NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
594104 |
2mwk   |
25332 | cing | 4-filtered-FRED | STAR | entry | full | 401 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mwk
# This FRED archive file contains, for PDB entry <2mwk>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.PDB_coordinate_file_version .
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_2mwk
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2mwk
_Assembly.Number_of_components 4
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 4228.51
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 $Exoglucanase_1 A . 1 1
2 . 2 $SUGAR__ALPHA_D_MANNOSE_ B . 1 1
3 . 2 $SUGAR__ALPHA_D_MANNOSE_ C . 1 1
4 . 2 $SUGAR__ALPHA_D_MANNOSE_ D . 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 MAN 1 MAN 1 1
3 2 MAN 1 MAN 1 1
4 2 MAN 1 MAN 1 1
stop_
save_
save_Exoglucanase_1
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Exoglucanase 1"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code TQSHYGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL
_Entity.Number_of_monomers 36
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 THR . 1 1
2 GLN . 1 1
3 SER . 1 1
4 HIS . 1 1
5 TYR . 1 1
6 GLY . 1 1
7 GLN . 1 1
8 CYS . 1 1
9 GLY . 1 1
10 GLY . 1 1
11 ILE . 1 1
12 GLY . 1 1
13 TYR . 1 1
14 SER . 1 1
15 GLY . 1 1
16 PRO . 1 1
17 THR . 1 1
18 VAL . 1 1
19 CYS . 1 1
20 ALA . 1 1
21 SER . 1 1
22 GLY . 1 1
23 THR . 1 1
24 THR . 1 1
25 CYS . 1 1
26 GLN . 1 1
27 VAL . 1 1
28 LEU . 1 1
29 ASN . 1 1
30 PRO . 1 1
31 TYR . 1 1
32 TYR . 1 1
33 SER . 1 1
34 GLN . 1 1
35 CYS . 1 1
36 LEU . 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
THR 1 1 1 1
GLN 2 2 1 1
SER 3 3 1 1
HIS 4 4 1 1
TYR 5 5 1 1
GLY 6 6 1 1
GLN 7 7 1 1
CYS 8 8 1 1
GLY 9 9 1 1
GLY 10 10 1 1
ILE 11 11 1 1
GLY 12 12 1 1
TYR 13 13 1 1
SER 14 14 1 1
GLY 15 15 1 1
PRO 16 16 1 1
THR 17 17 1 1
VAL 18 18 1 1
CYS 19 19 1 1
ALA 20 20 1 1
SER 21 21 1 1
GLY 22 22 1 1
THR 23 23 1 1
THR 24 24 1 1
CYS 25 25 1 1
GLN 26 26 1 1
VAL 27 27 1 1
LEU 28 28 1 1
ASN 29 29 1 1
PRO 30 30 1 1
TYR 31 31 1 1
TYR 32 32 1 1
SER 33 33 1 1
GLN 34 34 1 1
CYS 35 35 1 1
LEU 36 36 1 1
stop_
save_
save_SUGAR__ALPHA_D_MANNOSE_
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "SUGAR ALPHA D MANNOSE "
_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 MAN $MAN 1 2
stop_
save_
save_MAN
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID MAN
_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
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38 1 . . . 1 1
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40 1 . . . 1 1
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42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
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
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78 1 . . . 1 1
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80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
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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
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 1 . . . 1 1
131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
136 1 . . . 1 1
137 1 . . . 1 1
138 1 . . . 1 1
139 1 . . . 1 1
140 1 . . . 1 1
141 1 . . . 1 1
142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
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148 1 . . . 1 1
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160 1 . . . 1 1
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162 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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213 1 . . . 1 1
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215 1 . . . 1 1
216 1 . . . 1 1
217 1 . . . 1 1
218 1 . . . 1 1
219 1 . . . 1 1
220 1 . . . 1 1
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222 1 . . . 1 1
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224 1 . . . 1 1
225 1 . . . 1 1
226 1 . . . 1 1
227 1 . . . 1 1
228 1 . . . 1 1
229 1 . . . 1 1
230 1 . . . 1 1
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233 1 . . . 1 1
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238 1 . . . 1 1
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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
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270 1 . . . 1 1
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272 1 . . . 1 1
273 1 . . . 1 1
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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
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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
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 GLN HE22 . 2 . HE22 1 1
1 1 2 1 1 13 TYR HH . 13 . HH 1 1
2 1 1 1 1 26 GLN HA . 26 . HA 1 1
2 1 2 1 1 27 VAL H . 27 . HN 1 1
3 1 1 1 1 25 CYS HA . 25 . HA 1 1
3 1 2 1 1 26 GLN H . 26 . HN 1 1
4 1 1 1 1 32 TYR HA . 32 . HA 1 1
4 1 2 1 1 33 SER H . 33 . HN 1 1
5 1 1 1 1 21 SER HA . 21 . HA 1 1
5 1 2 1 1 22 GLY H . 22 . HN 1 1
6 1 1 1 1 13 TYR HA . 13 . HA 1 1
6 1 2 1 1 14 SER H . 14 . HN 1 1
7 1 1 1 1 35 CYS HA . 35 . HA 1 1
7 1 2 1 1 36 LEU H . 36 . HN 1 1
8 1 1 1 1 18 VAL HA . 18 . HA 1 1
8 1 2 1 1 19 CYS H . 19 . HN 1 1
9 1 1 1 1 20 ALA HA . 20 . HA 1 1
9 1 2 1 1 21 SER H . 21 . HN 1 1
10 1 1 1 1 1 THR HB . 1 . HB 1 1
10 1 2 1 1 2 GLN H . 2 . HN 1 1
11 1 1 1 1 16 PRO HA . 16 . HA 1 1
11 1 2 1 1 17 THR H . 17 . HN 1 1
12 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1
12 1 2 1 1 10 GLY H . 10 . HN 1 1
13 1 1 1 1 24 THR HA . 24 . HA 1 1
13 1 2 1 1 25 CYS H . 25 . HN 1 1
14 1 1 1 1 4 HIS HA . 4 . HA 1 1
14 1 2 1 1 5 TYR H . 5 . HN 1 1
15 1 1 1 1 23 THR HA . 23 . HA 1 1
15 1 2 1 1 24 THR H . 24 . HN 1 1
16 1 1 1 1 33 SER HA . 33 . HA 1 1
16 1 2 1 1 34 GLN H . 34 . HN 1 1
17 1 1 1 1 29 ASN QB . 29 . HB* 1 1
17 1 2 1 1 30 PRO HD3 . 30 . HD1 1 1
18 1 1 1 1 7 GLN HA . 7 . HA 1 1
18 1 2 1 1 8 CYS H . 8 . HN 1 1
19 1 1 1 1 31 TYR H . 31 . HN 1 1
19 1 2 1 1 32 TYR H . 32 . HN 1 1
20 1 1 1 1 2 GLN HA . 2 . HA 1 1
20 1 2 1 1 3 SER H . 3 . HN 1 1
21 1 1 1 1 3 SER HA . 3 . HA 1 1
21 1 2 1 1 4 HIS H . 4 . HN 1 1
22 1 1 1 1 27 VAL HA . 27 . HA 1 1
22 1 2 1 1 28 LEU H . 28 . HN 1 1
23 1 1 1 1 23 THR HB . 23 . HB 1 1
23 1 2 1 1 24 THR H . 24 . HN 1 1
24 1 1 1 1 17 THR H . 17 . HN 1 1
24 1 2 1 1 18 VAL H . 18 . HN 1 1
25 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1
25 1 2 1 1 5 TYR H . 5 . HN 1 1
26 1 1 1 1 7 GLN QG . 7 . HG2 1 1
26 1 2 1 1 9 GLY H . 9 . HN 1 1
27 1 1 1 1 8 CYS H . 8 . HN 1 1
27 1 2 1 1 9 GLY H . 9 . HN 1 1
28 1 1 1 1 29 ASN QB . 29 . HB* 1 1
28 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1
29 1 1 1 1 11 ILE H . 11 . HN 1 1
29 1 2 1 1 31 TYR HA . 31 . HA 1 1
30 1 1 1 1 5 TYR HD1 . 5 . HD1 1 1
30 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
31 1 1 1 1 28 LEU H . 28 . HN 1 1
31 1 2 1 1 33 SER HA . 33 . HA 1 1
32 1 1 1 1 4 HIS HA . 4 . HA 1 1
32 1 2 1 1 35 CYS QB . 35 . HB* 1 1
33 1 1 1 1 10 GLY HA2 . 10 . HA2 1 1
33 1 2 1 1 11 ILE H . 11 . HN 1 1
34 1 1 1 1 9 GLY HA3 . 9 . HA1 1 1
34 1 2 1 1 10 GLY H . 10 . HN 1 1
35 1 1 1 1 29 ASN HA . 29 . HA 1 1
35 1 2 1 1 30 PRO HD3 . 30 . HD1 1 1
36 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1
36 1 2 1 1 36 LEU HA . 36 . HA 1 1
37 1 1 1 1 5 TYR H . 5 . HN 1 1
37 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1
38 1 1 1 1 2 GLN HE21 . 2 . HE21 1 1
38 1 2 1 1 13 TYR QE . 13 . HE* 1 1
39 1 1 1 1 34 GLN HG2 . 34 . HG2 1 1
39 1 2 1 1 35 CYS H . 35 . HN 1 1
40 1 1 1 1 2 GLN HG2 . 2 . HG2 1 1
40 1 2 1 1 13 TYR HH . 13 . HH 1 1
41 1 1 1 1 22 GLY H . 22 . HN 1 1
41 1 2 1 1 23 THR H . 23 . HN 1 1
42 1 1 1 1 5 TYR HE1 . 5 . HE1 1 1
42 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
43 1 1 1 1 32 TYR QE . 32 . HE1 1 1
43 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1
44 1 1 1 1 3 SER HA . 3 . HA 1 1
44 1 2 1 1 20 ALA MB . 20 . HB* 1 1
45 1 1 1 1 20 ALA MB . 20 . HB* 1 1
45 1 2 1 1 21 SER H . 21 . HN 1 1
46 1 1 1 1 3 SER HB2 . 3 . HB2 1 1
46 1 2 1 1 4 HIS H . 4 . HN 1 1
47 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1
47 1 2 1 1 3 SER H . 3 . HN 1 1
48 1 1 1 1 11 ILE HB . 11 . HB 1 1
48 1 2 1 1 31 TYR HD2 . 31 . HD1 1 1
49 1 1 1 1 28 LEU HG . 28 . HG 1 1
49 1 2 1 1 29 ASN H . 29 . HN 1 1
50 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1
50 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1
51 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1
51 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1
52 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1
52 1 2 1 1 33 SER QB . 33 . HB2 1 1
53 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1
53 1 2 1 1 17 THR HA . 17 . HA 1 1
54 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1
54 1 2 1 1 35 CYS QB . 35 . HB* 1 1
55 1 1 1 1 24 THR H . 24 . HN 1 1
55 1 2 1 1 36 LEU H . 36 . HN 1 1
56 1 1 1 1 27 VAL HA . 27 . HA 1 1
56 1 2 1 1 29 ASN H . 29 . HN 1 1
57 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1
57 1 2 1 1 19 CYS H . 19 . HN 1 1
58 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1
58 1 2 1 1 19 CYS HA . 19 . HA 1 1
59 1 1 1 1 14 SER H . 14 . HN 1 1
59 1 2 1 1 15 GLY H . 15 . HN 1 1
60 1 1 1 1 28 LEU HG . 28 . HG 1 1
60 1 2 1 1 32 TYR QD . 32 . HD1 1 1
61 1 1 1 1 6 GLY H . 6 . HN 1 1
61 1 2 1 1 35 CYS QB . 35 . HB* 1 1
62 1 1 1 1 27 VAL HA . 27 . HA 1 1
62 1 2 1 1 33 SER HA . 33 . HA 1 1
63 1 1 1 1 7 GLN HA . 7 . HA 1 1
63 1 2 1 1 9 GLY H . 9 . HN 1 1
64 1 1 1 1 12 GLY H . 12 . HN 1 1
64 1 2 1 1 13 TYR H . 13 . HN 1 1
65 1 1 1 1 1 THR HB . 1 . HB 1 1
65 1 2 1 1 20 ALA MB . 20 . HB* 1 1
66 1 1 1 1 11 ILE MG . 11 . HG2* 1 1
66 1 2 1 1 12 GLY H . 12 . HN 1 1
67 1 1 1 1 7 GLN QB . 7 . HB1 1 1
67 1 2 1 1 9 GLY H . 9 . HN 1 1
68 1 1 1 1 9 GLY H . 9 . HN 1 1
68 1 2 1 1 33 SER QB . 33 . HB1 1 1
69 1 1 1 1 25 CYS HA . 25 . HA 1 1
69 1 2 1 1 36 LEU H . 36 . HN 1 1
70 1 1 1 1 28 LEU MD2 . 28 . HD2* 1 1
70 1 2 1 1 32 TYR QD . 32 . HD1 1 1
71 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1
71 1 2 1 1 29 ASN H . 29 . HN 1 1
72 1 1 1 1 26 GLN H . 26 . HN 1 1
72 1 2 1 1 34 GLN H . 34 . HN 1 1
73 1 1 1 1 11 ILE HB . 11 . HB 1 1
73 1 2 1 1 31 TYR HE2 . 31 . HE1 1 1
74 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1
74 1 2 1 1 23 THR MG . 23 . HG2* 1 1
75 1 1 1 1 11 ILE MG . 11 . HG2* 1 1
75 1 2 1 1 31 TYR HE2 . 31 . HE1 1 1
76 1 1 1 1 33 SER QB . 33 . HB1 1 1
76 1 2 1 1 34 GLN H . 34 . HN 1 1
77 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1
77 1 2 1 1 13 TYR HH . 13 . HH 1 1
78 1 1 1 1 29 ASN H . 29 . HN 1 1
78 1 2 1 1 32 TYR H . 32 . HN 1 1
79 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1
79 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1
80 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1
80 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1
81 1 1 1 1 3 SER HB3 . 3 . HB1 1 1
81 1 2 1 1 4 HIS H . 4 . HN 1 1
82 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
82 1 2 1 1 15 GLY HA3 . 15 . HA1 1 1
83 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1
83 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
84 1 1 1 1 5 TYR HA . 5 . HA 1 1
84 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1
85 1 1 1 1 1 THR MG . 1 . HG2* 1 1
85 1 2 1 1 20 ALA HA . 20 . HA 1 1
86 1 1 1 1 26 GLN H . 26 . HN 1 1
86 1 2 1 1 35 CYS HA . 35 . HA 1 1
87 1 1 1 1 22 GLY HA2 . 22 . HA2 1 1
87 1 2 1 1 23 THR H . 23 . HN 1 1
88 1 1 1 1 4 HIS HA . 4 . HA 1 1
88 1 2 1 1 23 THR MG . 23 . HG2* 1 1
89 1 1 1 1 23 THR HB . 23 . HB 1 1
89 1 2 1 1 35 CYS QB . 35 . HB* 1 1
90 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
90 1 2 1 1 16 PRO QG . 16 . HG* 1 1
91 1 1 1 1 7 GLN QG . 7 . HG1 1 1
91 1 2 1 1 8 CYS H . 8 . HN 1 1
92 1 1 1 1 12 GLY HA2 . 12 . HA2 1 1
92 1 2 1 1 13 TYR H . 13 . HN 1 1
93 1 1 1 1 28 LEU MD2 . 28 . HD2* 1 1
93 1 2 1 1 32 TYR QE . 32 . HE1 1 1
94 1 1 1 1 2 GLN H . 2 . HN 1 1
94 1 2 1 1 19 CYS HA . 19 . HA 1 1
95 1 1 1 1 5 TYR H . 5 . HN 1 1
95 1 2 1 1 6 GLY H . 6 . HN 1 1
96 1 1 1 1 2 GLN HG2 . 2 . HG2 1 1
96 1 2 1 1 3 SER H . 3 . HN 1 1
97 1 1 1 1 23 THR HB . 23 . HB 1 1
97 1 2 1 1 36 LEU H . 36 . HN 1 1
98 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1
98 1 2 1 1 5 TYR HA . 5 . HA 1 1
99 1 1 1 1 34 GLN HG3 . 34 . HG1 1 1
99 1 2 1 1 35 CYS H . 35 . HN 1 1
100 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1
100 1 2 1 1 32 TYR HA . 32 . HA 1 1
101 1 1 1 1 5 TYR HB2 . 5 . HB1 1 1
101 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1
102 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1
102 1 2 1 1 28 LEU H . 28 . HN 1 1
103 1 1 1 1 7 GLN QB . 7 . HB2 1 1
103 1 2 1 1 32 TYR QE . 32 . HE2 1 1
104 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1
104 1 2 1 1 9 GLY H . 9 . HN 1 1
105 1 1 1 1 21 SER HA . 21 . HA 1 1
105 1 2 1 1 23 THR H . 23 . HN 1 1
106 1 1 1 1 1 THR MG . 1 . HG2* 1 1
106 1 2 1 1 2 GLN H . 2 . HN 1 1
107 1 1 1 1 4 HIS H . 4 . HN 1 1
107 1 2 1 1 20 ALA MB . 20 . HB* 1 1
108 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
108 1 2 1 1 8 CYS HA . 8 . HA 1 1
109 1 1 1 1 24 THR MG . 24 . HG2* 1 1
109 1 2 1 1 25 CYS H . 25 . HN 1 1
110 1 1 1 1 8 CYS HA . 8 . HA 1 1
110 1 2 1 1 9 GLY H . 9 . HN 1 1
111 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1
111 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1
112 1 1 1 1 10 GLY H . 10 . HN 1 1
112 1 2 1 1 33 SER QB . 33 . HB2 1 1
113 1 1 1 1 26 GLN HB3 . 26 . HB1 1 1
113 1 2 1 1 27 VAL H . 27 . HN 1 1
114 1 1 1 1 11 ILE MD . 11 . HD* 1 1
114 1 2 1 1 31 TYR HE2 . 31 . HE1 1 1
115 1 1 1 1 35 CYS HB3 . 35 . HB1 1 1
115 1 2 1 1 36 LEU H . 36 . HN 1 1
116 1 1 1 1 27 VAL MG2 . 27 . HG2* 1 1
116 1 2 1 1 28 LEU H . 28 . HN 1 1
117 1 1 1 1 21 SER QB . 21 . HB* 1 1
117 1 2 1 1 22 GLY H . 22 . HN 1 1
118 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1
118 1 2 1 1 32 TYR HA . 32 . HA 1 1
119 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1
119 1 2 1 1 23 THR MG . 23 . HG2* 1 1
120 1 1 1 1 26 GLN HA . 26 . HA 1 1
120 1 2 1 1 27 VAL MG2 . 27 . HG2* 1 1
121 1 1 1 1 29 ASN HD22 . 29 . HD22 1 1
121 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1
122 1 1 1 1 11 ILE HG12 . 11 . HG12 1 1
122 1 2 1 1 12 GLY H . 12 . HN 1 1
123 1 1 1 1 5 TYR HD1 . 5 . HD1 1 1
123 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1
124 1 1 1 1 5 TYR HA . 5 . HA 1 1
124 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
125 1 1 1 1 11 ILE MG . 11 . HG2* 1 1
125 1 2 1 1 31 TYR HD2 . 31 . HD1 1 1
126 1 1 1 1 28 LEU HA . 28 . HA 1 1
126 1 2 1 1 29 ASN H . 29 . HN 1 1
127 1 1 1 1 22 GLY HA3 . 22 . HA1 1 1
127 1 2 1 1 23 THR H . 23 . HN 1 1
128 1 1 1 1 16 PRO HA . 16 . HA 1 1
128 1 2 1 1 18 VAL H . 18 . HN 1 1
129 1 1 1 1 5 TYR HA . 5 . HA 1 1
129 1 2 1 1 35 CYS QB . 35 . HB* 1 1
130 1 1 1 1 23 THR MG . 23 . HG2* 1 1
130 1 2 1 1 24 THR H . 24 . HN 1 1
131 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1
131 1 2 1 1 17 THR H . 17 . HN 1 1
132 1 1 1 1 29 ASN HD22 . 29 . HD22 1 1
132 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1
133 1 1 1 1 7 GLN QG . 7 . HG1 1 1
133 1 2 1 1 32 TYR QE . 32 . HE2 1 1
134 1 1 1 1 11 ILE MG . 11 . HG2* 1 1
134 1 2 1 1 12 GLY HA3 . 12 . HA1 1 1
135 1 1 1 1 2 GLN HE21 . 2 . HE21 1 1
135 1 2 1 1 13 TYR HH . 13 . HH 1 1
136 1 1 1 1 7 GLN QG . 7 . HG1 1 1
136 1 2 1 1 32 TYR QD . 32 . HD2 1 1
137 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1
137 1 2 1 1 32 TYR QD . 32 . HD1 1 1
138 1 1 1 1 31 TYR HA . 31 . HA 1 1
138 1 2 1 1 32 TYR H . 32 . HN 1 1
139 1 1 1 1 4 HIS HE1 . 4 . HE1 1 1
139 1 2 1 1 5 TYR HE2 . 5 . HE2 1 1
140 1 1 1 1 28 LEU H . 28 . HN 1 1
140 1 2 1 1 34 GLN H . 34 . HN 1 1
141 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
141 1 2 1 1 16 PRO HB3 . 16 . HB1 1 1
142 1 1 1 1 13 TYR QB . 13 . HB* 1 1
142 1 2 1 1 14 SER H . 14 . HN 1 1
143 1 1 1 1 7 GLN HA . 7 . HA 1 1
143 1 2 1 1 32 TYR QE . 32 . HE2 1 1
144 1 1 1 1 13 TYR QD . 13 . HD* 1 1
144 1 2 1 1 14 SER H . 14 . HN 1 1
145 1 1 1 1 30 PRO HD2 . 30 . HD2 1 1
145 1 2 1 1 31 TYR HD1 . 31 . HD2 1 1
146 1 1 1 1 25 CYS HA . 25 . HA 1 1
146 1 2 1 1 34 GLN H . 34 . HN 1 1
147 1 1 1 1 28 LEU HG . 28 . HG 1 1
147 1 2 1 1 32 TYR QE . 32 . HE1 1 1
148 1 1 1 1 34 GLN HB2 . 34 . HB2 1 1
148 1 2 1 1 35 CYS H . 35 . HN 1 1
149 1 1 1 1 32 TYR QD . 32 . HD1 1 1
149 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1
150 1 1 1 1 7 GLN HA . 7 . HA 1 1
150 1 2 1 1 35 CYS H . 35 . HN 1 1
151 1 1 1 1 1 THR HB . 1 . HB 1 1
151 1 2 1 1 18 VAL MG1 . 18 . HG1* 1 1
152 1 1 1 1 11 ILE MD . 11 . HD* 1 1
152 1 2 1 1 31 TYR HD2 . 31 . HD1 1 1
153 1 1 1 1 28 LEU HG . 28 . HG 1 1
153 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1
154 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1
154 1 2 1 1 17 THR H . 17 . HN 1 1
155 1 1 1 1 7 GLN QB . 7 . HB1 1 1
155 1 2 1 1 8 CYS H . 8 . HN 1 1
156 1 1 1 1 27 VAL HA . 27 . HA 1 1
156 1 2 1 1 34 GLN H . 34 . HN 1 1
157 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1
157 1 2 1 1 32 TYR QE . 32 . HE1 1 1
158 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1
158 1 2 1 1 29 ASN HA . 29 . HA 1 1
159 1 1 1 1 17 THR H . 17 . HN 1 1
159 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1
160 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
160 1 2 1 1 16 PRO HD3 . 16 . HD1 1 1
161 1 1 1 1 17 THR HA . 17 . HA 1 1
161 1 2 1 1 18 VAL H . 18 . HN 1 1
162 1 1 1 1 17 THR MG . 17 . HG2* 1 1
162 1 2 1 1 18 VAL H . 18 . HN 1 1
163 1 1 1 1 1 THR HB . 1 . HB 1 1
163 1 2 1 1 18 VAL H . 18 . HN 1 1
164 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1
164 1 2 1 1 3 SER H . 3 . HN 1 1
165 1 1 1 1 29 ASN QB . 29 . HB* 1 1
165 1 2 1 1 31 TYR H . 31 . HN 1 1
166 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1
166 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1
167 1 1 1 1 32 TYR QD . 32 . HD2 1 1
167 1 2 1 1 33 SER H . 33 . HN 1 1
168 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1
168 1 2 1 1 28 LEU HA . 28 . HA 1 1
169 1 1 1 1 27 VAL MG2 . 27 . HG2* 1 1
169 1 2 1 1 29 ASN H . 29 . HN 1 1
170 1 1 1 1 24 THR H . 24 . HN 1 1
170 1 2 1 1 35 CYS HA . 35 . HA 1 1
171 1 1 1 1 5 TYR HB3 . 5 . HB2 1 1
171 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1
172 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
172 1 2 1 1 16 PRO HB2 . 16 . HB2 1 1
173 1 1 1 1 9 GLY H . 9 . HN 1 1
173 1 2 1 1 10 GLY H . 10 . HN 1 1
174 1 1 1 1 28 LEU HG . 28 . HG 1 1
174 1 2 1 1 29 ASN HD22 . 29 . HD22 1 1
175 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1
175 1 2 1 1 26 GLN H . 26 . HN 1 1
176 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1
176 1 2 1 1 3 SER H . 3 . HN 1 1
177 1 1 1 1 25 CYS HB3 . 25 . HB1 1 1
177 1 2 1 1 26 GLN H . 26 . HN 1 1
178 1 1 1 1 23 THR H . 23 . HN 1 1
178 1 2 1 1 24 THR H . 24 . HN 1 1
179 1 1 1 1 30 PRO HG3 . 30 . HG1 1 1
179 1 2 1 1 31 TYR HD1 . 31 . HD2 1 1
180 1 1 1 1 5 TYR H . 5 . HN 1 1
180 1 2 1 1 23 THR MG . 23 . HG2* 1 1
181 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1
181 1 2 1 1 13 TYR HH . 13 . HH 1 1
182 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
182 1 2 1 1 17 THR HA . 17 . HA 1 1
183 1 1 1 1 4 HIS HE1 . 4 . HE1 1 1
183 1 2 1 1 23 THR MG . 23 . HG2* 1 1
184 1 1 1 1 24 THR H . 24 . HN 1 1
184 1 2 1 1 25 CYS H . 25 . HN 1 1
185 1 1 1 1 3 SER H . 3 . HN 1 1
185 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1
186 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1
186 1 2 1 1 13 TYR HH . 13 . HH 1 1
187 1 1 1 1 4 HIS H . 4 . HN 1 1
187 1 2 1 1 23 THR MG . 23 . HG2* 1 1
188 1 1 1 1 5 TYR HE1 . 5 . HE1 1 1
188 1 2 1 1 36 LEU HA . 36 . HA 1 1
189 1 1 1 1 30 PRO HB3 . 30 . HB1 1 1
189 1 2 1 1 31 TYR HD1 . 31 . HD2 1 1
190 1 1 1 1 24 THR H . 24 . HN 1 1
190 1 2 1 1 35 CYS QB . 35 . HB* 1 1
191 1 1 1 1 5 TYR H . 5 . HN 1 1
191 1 2 1 1 35 CYS H . 35 . HN 1 1
192 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1
192 1 2 1 1 5 TYR H . 5 . HN 1 1
193 1 1 1 1 29 ASN HD21 . 29 . HD21 1 1
193 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1
194 1 1 1 1 6 GLY HA3 . 6 . HA1 1 1
194 1 2 1 1 13 TYR HH . 13 . HH 1 1
195 1 1 1 1 30 PRO HD3 . 30 . HD1 1 1
195 1 2 1 1 31 TYR HD1 . 31 . HD2 1 1
196 1 1 1 1 11 ILE H . 11 . HN 1 1
196 1 2 1 1 31 TYR HD2 . 31 . HD1 1 1
197 1 1 1 1 5 TYR H . 5 . HN 1 1
197 1 2 1 1 36 LEU HA . 36 . HA 1 1
198 1 1 1 1 24 THR HB . 24 . HB 1 1
198 1 2 1 1 26 GLN HE21 . 26 . HE21 1 1
199 1 1 1 1 28 LEU QB . 28 . HB* 1 1
199 1 2 1 1 32 TYR QD . 32 . HD1 1 1
200 1 1 1 1 24 THR MG . 24 . HG2* 1 1
200 1 2 1 1 26 GLN HE21 . 26 . HE21 1 1
201 1 1 1 1 29 ASN HD21 . 29 . HD21 1 1
201 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1
202 1 1 1 1 26 GLN H . 26 . HN 1 1
202 1 2 1 1 33 SER HA . 33 . HA 1 1
203 1 1 1 1 4 HIS H . 4 . HN 1 1
203 1 2 1 1 5 TYR H . 5 . HN 1 1
204 1 1 1 1 15 GLY HA2 . 15 . HA2 1 1
204 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1
205 1 1 1 1 4 HIS HA . 4 . HA 1 1
205 1 2 1 1 6 GLY H . 6 . HN 1 1
206 1 1 1 1 3 SER HB2 . 3 . HB2 1 1
206 1 2 1 1 6 GLY H . 6 . HN 1 1
207 1 1 1 1 29 ASN HD22 . 29 . HD22 1 1
207 1 2 1 1 32 TYR H . 32 . HN 1 1
208 1 1 1 1 32 TYR QD . 32 . HD1 1 1
208 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1
209 1 1 1 1 5 TYR H . 5 . HN 1 1
209 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
210 1 1 1 1 30 PRO HA . 30 . HA 1 1
210 1 2 1 1 32 TYR H . 32 . HN 1 1
211 1 1 1 1 35 CYS H . 35 . HN 1 1
211 1 2 1 1 36 LEU H . 36 . HN 1 1
212 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1
212 1 2 1 1 36 LEU H . 36 . HN 1 1
213 1 1 1 1 11 ILE HA . 11 . HA 1 1
213 1 2 1 1 31 TYR HD2 . 31 . HD1 1 1
214 1 1 1 1 3 SER H . 3 . HN 1 1
214 1 2 1 1 4 HIS H . 4 . HN 1 1
215 1 1 1 1 11 ILE H . 11 . HN 1 1
215 1 2 1 1 31 TYR HB3 . 31 . HB1 1 1
216 1 1 1 1 32 TYR QE . 32 . HE2 1 1
216 1 2 1 1 33 SER H . 33 . HN 1 1
217 1 1 1 1 3 SER HB2 . 3 . HB2 1 1
217 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1
218 1 1 1 1 26 GLN H . 26 . HN 1 1
218 1 2 1 1 33 SER QB . 33 . HB1 1 1
219 1 1 1 1 10 GLY HA2 . 10 . HA2 1 1
219 1 2 1 1 32 TYR H . 32 . HN 1 1
220 1 1 1 1 23 THR MG . 23 . HG2* 1 1
220 1 2 1 1 36 LEU H . 36 . HN 1 1
221 1 1 1 1 29 ASN QB . 29 . HB* 1 1
221 1 2 1 1 31 TYR HD1 . 31 . HD2 1 1
222 1 1 1 1 19 CYS HA . 19 . HA 1 1
222 1 2 1 1 20 ALA H . 20 . HN 1 1
223 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1
223 1 2 1 1 20 ALA H . 20 . HN 1 1
224 1 1 1 1 1 THR HA . 1 . HA 1 1
224 1 2 1 1 20 ALA H . 20 . HN 1 1
225 1 1 1 1 1 THR HB . 1 . HB 1 1
225 1 2 1 1 20 ALA H . 20 . HN 1 1
226 1 1 1 1 11 ILE HA . 11 . HA 1 1
226 1 2 1 1 12 GLY H . 12 . HN 1 1
227 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1
227 1 2 1 1 11 ILE H . 11 . HN 1 1
228 1 1 1 1 1 THR HA . 1 . HA 1 1
228 1 2 1 1 2 GLN H . 2 . HN 1 1
229 1 1 1 1 27 VAL HA . 27 . HA 1 1
229 1 2 1 1 33 SER QB . 33 . HB1 1 1
230 1 1 1 1 1 THR MG . 1 . HG2* 1 1
230 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1
231 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1
231 1 2 1 1 23 THR MG . 23 . HG2* 1 1
232 1 1 1 1 28 LEU HA . 28 . HA 1 1
232 1 2 1 1 28 LEU MD1 . 28 . HD1* 1 1
233 1 1 1 1 29 ASN QB . 29 . HB* 1 1
233 1 2 1 1 29 ASN HD22 . 29 . HD22 1 1
234 1 1 1 1 3 SER H . 3 . HN 1 1
234 1 2 1 1 3 SER HB2 . 3 . HB2 1 1
235 1 1 1 1 17 THR H . 17 . HN 1 1
235 1 2 1 1 17 THR MG . 17 . HG2* 1 1
236 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1
236 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1
237 1 1 1 1 19 CYS H . 19 . HN 1 1
237 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1
238 1 1 1 1 26 GLN H . 26 . HN 1 1
238 1 2 1 1 26 GLN HB3 . 26 . HB1 1 1
239 1 1 1 1 28 LEU H . 28 . HN 1 1
239 1 2 1 1 28 LEU HG . 28 . HG 1 1
240 1 1 1 1 23 THR H . 23 . HN 1 1
240 1 2 1 1 23 THR MG . 23 . HG2* 1 1
241 1 1 1 1 32 TYR H . 32 . HN 1 1
241 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1
242 1 1 1 1 27 VAL H . 27 . HN 1 1
242 1 2 1 1 27 VAL MG2 . 27 . HG2* 1 1
243 1 1 1 1 11 ILE H . 11 . HN 1 1
243 1 2 1 1 11 ILE HG12 . 11 . HG12 1 1
244 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1
244 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1
245 1 1 1 1 14 SER H . 14 . HN 1 1
245 1 2 1 1 14 SER HB3 . 14 . HB1 1 1
246 1 1 1 1 8 CYS H . 8 . HN 1 1
246 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1
247 1 1 1 1 31 TYR H . 31 . HN 1 1
247 1 2 1 1 31 TYR HB3 . 31 . HB1 1 1
248 1 1 1 1 14 SER H . 14 . HN 1 1
248 1 2 1 1 14 SER HB2 . 14 . HB2 1 1
249 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1
249 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1
250 1 1 1 1 24 THR H . 24 . HN 1 1
250 1 2 1 1 24 THR HB . 24 . HB 1 1
251 1 1 1 1 34 GLN HE21 . 34 . HE21 1 1
251 1 2 1 1 34 GLN HG2 . 34 . HG2 1 1
252 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1
252 1 2 1 1 7 GLN QG . 7 . HG2 1 1
253 1 1 1 1 26 GLN H . 26 . HN 1 1
253 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1
254 1 1 1 1 36 LEU H . 36 . HN 1 1
254 1 2 1 1 36 LEU HG . 36 . HG 1 1
255 1 1 1 1 24 THR H . 24 . HN 1 1
255 1 2 1 1 24 THR MG . 24 . HG2* 1 1
256 1 1 1 1 11 ILE HA . 11 . HA 1 1
256 1 2 1 1 11 ILE MD . 11 . HD1* 1 1
257 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1
257 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1
258 1 1 1 1 29 ASN H . 29 . HN 1 1
258 1 2 1 1 29 ASN QB . 29 . HB* 1 1
259 1 1 1 1 28 LEU HA . 28 . HA 1 1
259 1 2 1 1 28 LEU MD2 . 28 . HD2* 1 1
260 1 1 1 1 11 ILE H . 11 . HN 1 1
260 1 2 1 1 11 ILE MD . 11 . HD1* 1 1
261 1 1 1 1 7 GLN HA . 7 . HA 1 1
261 1 2 1 1 7 GLN HE21 . 7 . HE21 1 1
262 1 1 1 1 5 TYR HB3 . 5 . HB2 1 1
262 1 2 1 1 5 TYR QE . 5 . HE* 1 1
263 1 1 1 1 34 GLN H . 34 . HN 1 1
263 1 2 1 1 34 GLN HG2 . 34 . HG2 1 1
264 1 1 1 1 8 CYS H . 8 . HN 1 1
264 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1
265 1 1 1 1 11 ILE H . 11 . HN 1 1
265 1 2 1 1 11 ILE MG . 11 . HG2* 1 1
266 1 1 1 1 5 TYR HB2 . 5 . HB1 1 1
266 1 2 1 1 5 TYR QE . 5 . HE* 1 1
267 1 1 1 1 26 GLN H . 26 . HN 1 1
267 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1
268 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1
268 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1
269 1 1 1 1 34 GLN H . 34 . HN 1 1
269 1 2 1 1 34 GLN HB3 . 34 . HB1 1 1
270 1 1 1 1 32 TYR HB3 . 32 . HB1 1 1
270 1 2 1 1 32 TYR QE . 32 . HE* 1 1
271 1 1 1 1 2 GLN H . 2 . HN 1 1
271 1 2 1 1 2 GLN HG2 . 2 . HG2 1 1
272 1 1 1 1 36 LEU H . 36 . HN 1 1
272 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1
273 1 1 1 1 32 TYR HA . 32 . HA 1 1
273 1 2 1 1 32 TYR QE . 32 . HE* 1 1
274 1 1 1 1 5 TYR HA . 5 . HA 1 1
274 1 2 1 1 5 TYR QE . 5 . HE* 1 1
275 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1
275 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1
276 1 1 1 1 17 THR H . 17 . HN 1 1
276 1 2 1 1 17 THR HB . 17 . HB 1 1
277 1 1 1 1 5 TYR H . 5 . HN 1 1
277 1 2 1 1 5 TYR HB2 . 5 . HB1 1 1
278 1 1 1 1 7 GLN HA . 7 . HA 1 1
278 1 2 1 1 7 GLN HE22 . 7 . HE22 1 1
279 1 1 1 1 36 LEU H . 36 . HN 1 1
279 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
280 1 1 1 1 2 GLN H . 2 . HN 1 1
280 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1
281 1 1 1 1 31 TYR HA . 31 . HA 1 1
281 1 2 1 1 31 TYR QE . 31 . HE* 1 1
282 1 1 1 1 29 ASN HA . 29 . HA 1 1
282 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1
283 1 1 1 1 34 GLN HE21 . 34 . HE21 1 1
283 1 2 1 1 34 GLN HG3 . 34 . HG1 1 1
284 1 1 1 1 31 TYR H . 31 . HN 1 1
284 1 2 1 1 31 TYR QD . 31 . HD* 1 1
285 1 1 1 1 27 VAL H . 27 . HN 1 1
285 1 2 1 1 27 VAL HA . 27 . HA 1 1
286 1 1 1 1 12 GLY H . 12 . HN 1 1
286 1 2 1 1 12 GLY HA2 . 12 . HA2 1 1
287 1 1 1 1 27 VAL H . 27 . HN 1 1
287 1 2 1 1 27 VAL HB . 27 . HB 1 1
288 1 1 1 1 13 TYR H . 13 . HN 1 1
288 1 2 1 1 13 TYR QB . 13 . HB* 1 1
289 1 1 1 1 6 GLY H . 6 . HN 1 1
289 1 2 1 1 6 GLY HA2 . 6 . HA2 1 1
290 1 1 1 1 5 TYR H . 5 . HN 1 1
290 1 2 1 1 5 TYR HA . 5 . HA 1 1
291 1 1 1 1 22 GLY H . 22 . HN 1 1
291 1 2 1 1 22 GLY HA2 . 22 . HA2 1 1
292 1 1 1 1 6 GLY H . 6 . HN 1 1
292 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1
293 1 1 1 1 14 SER H . 14 . HN 1 1
293 1 2 1 1 14 SER HA . 14 . HA 1 1
294 1 1 1 1 21 SER H . 21 . HN 1 1
294 1 2 1 1 21 SER HA . 21 . HA 1 1
295 1 1 1 1 7 GLN H . 7 . HN 1 1
295 1 2 1 1 7 GLN HA . 7 . HA 1 1
296 1 1 1 1 22 GLY H . 22 . HN 1 1
296 1 2 1 1 22 GLY HA3 . 22 . HA1 1 1
297 1 1 1 1 9 GLY H . 9 . HN 1 1
297 1 2 1 1 9 GLY HA2 . 9 . HA2 1 1
298 1 1 1 1 25 CYS H . 25 . HN 1 1
298 1 2 1 1 25 CYS HA . 25 . HA 1 1
299 1 1 1 1 13 TYR H . 13 . HN 1 1
299 1 2 1 1 13 TYR HA . 13 . HA 1 1
300 1 1 1 1 24 THR H . 24 . HN 1 1
300 1 2 1 1 24 THR HA . 24 . HA 1 1
301 1 1 1 1 23 THR H . 23 . HN 1 1
301 1 2 1 1 23 THR HA . 23 . HA 1 1
302 1 1 1 1 3 SER H . 3 . HN 1 1
302 1 2 1 1 3 SER HA . 3 . HA 1 1
303 1 1 1 1 29 ASN H . 29 . HN 1 1
303 1 2 1 1 29 ASN HA . 29 . HA 1 1
304 1 1 1 1 36 LEU H . 36 . HN 1 1
304 1 2 1 1 36 LEU HA . 36 . HA 1 1
305 1 1 1 1 33 SER H . 33 . HN 1 1
305 1 2 1 1 33 SER HA . 33 . HA 1 1
306 1 1 1 1 28 LEU H . 28 . HN 1 1
306 1 2 1 1 28 LEU HA . 28 . HA 1 1
307 1 1 1 1 9 GLY H . 9 . HN 1 1
307 1 2 1 1 9 GLY HA3 . 9 . HA1 1 1
308 1 1 1 1 15 GLY H . 15 . HN 1 1
308 1 2 1 1 15 GLY HA2 . 15 . HA2 1 1
309 1 1 1 1 11 ILE H . 11 . HN 1 1
309 1 2 1 1 11 ILE HA . 11 . HA 1 1
310 1 1 1 1 4 HIS H . 4 . HN 1 1
310 1 2 1 1 4 HIS HA . 4 . HA 1 1
311 1 1 1 1 35 CYS H . 35 . HN 1 1
311 1 2 1 1 35 CYS HA . 35 . HA 1 1
312 1 1 1 1 32 TYR H . 32 . HN 1 1
312 1 2 1 1 32 TYR HA . 32 . HA 1 1
313 1 1 1 1 17 THR H . 17 . HN 1 1
313 1 2 1 1 17 THR HA . 17 . HA 1 1
314 1 1 1 1 18 VAL H . 18 . HN 1 1
314 1 2 1 1 18 VAL HA . 18 . HA 1 1
315 1 1 1 1 2 GLN H . 2 . HN 1 1
315 1 2 1 1 2 GLN HA . 2 . HA 1 1
316 1 1 1 1 8 CYS H . 8 . HN 1 1
316 1 2 1 1 8 CYS HA . 8 . HA 1 1
317 1 1 1 1 15 GLY H . 15 . HN 1 1
317 1 2 1 1 15 GLY HA3 . 15 . HA1 1 1
318 1 1 1 1 10 GLY H . 10 . HN 1 1
318 1 2 1 1 10 GLY HA2 . 10 . HA2 1 1
319 1 1 1 1 12 GLY H . 12 . HN 1 1
319 1 2 1 1 12 GLY HA3 . 12 . HA1 1 1
320 1 1 1 1 5 TYR HB2 . 5 . HB1 1 1
320 1 2 1 1 5 TYR QD . 5 . HD* 1 1
321 1 1 1 1 31 TYR HB2 . 31 . HB2 1 1
321 1 2 1 1 31 TYR QD . 31 . HD* 1 1
322 1 1 1 1 5 TYR HB3 . 5 . HB2 1 1
322 1 2 1 1 5 TYR QD . 5 . HD* 1 1
323 1 1 1 1 36 LEU HA . 36 . HA 1 1
323 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1
324 1 1 1 1 32 TYR HB3 . 32 . HB1 1 1
324 1 2 1 1 32 TYR QD . 32 . HD* 1 1
325 1 1 1 1 35 CYS H . 35 . HN 1 1
325 1 2 1 1 35 CYS QB . 35 . HB* 1 1
326 1 1 1 1 5 TYR HA . 5 . HA 1 1
326 1 2 1 1 5 TYR QD . 5 . HD* 1 1
327 1 1 1 1 21 SER H . 21 . HN 1 1
327 1 2 1 1 21 SER QB . 21 . HB* 1 1
328 1 1 1 1 19 CYS H . 19 . HN 1 1
328 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1
329 1 1 1 1 33 SER H . 33 . HN 1 1
329 1 2 1 1 33 SER QB . 33 . HB2 1 1
330 1 1 1 1 4 HIS H . 4 . HN 1 1
330 1 2 1 1 4 HIS HB2 . 4 . HB2 1 1
331 1 1 1 1 31 TYR HB3 . 31 . HB1 1 1
331 1 2 1 1 31 TYR QD . 31 . HD* 1 1
332 1 1 1 1 32 TYR HB2 . 32 . HB2 1 1
332 1 2 1 1 32 TYR QD . 32 . HD* 1 1
333 1 1 1 1 29 ASN QB . 29 . HB* 1 1
333 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1
334 1 1 1 1 32 TYR HA . 32 . HA 1 1
334 1 2 1 1 32 TYR QD . 32 . HD* 1 1
335 1 1 1 1 27 VAL H . 27 . HN 1 1
335 1 2 1 1 27 VAL MG1 . 27 . HG1* 1 1
336 1 1 1 1 4 HIS H . 4 . HN 1 1
336 1 2 1 1 4 HIS HB3 . 4 . HB1 1 1
337 1 1 1 1 36 LEU H . 36 . HN 1 1
337 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1
338 1 1 1 1 17 THR HA . 17 . HA 1 1
338 1 2 1 1 17 THR HG1 . 17 . HG1* 1 1
339 1 1 1 1 11 ILE H . 11 . HN 1 1
339 1 2 1 1 11 ILE HG13 . 11 . HG11 1 1
340 1 1 1 1 18 VAL H . 18 . HN 1 1
340 1 2 1 1 18 VAL HB . 18 . HB 1 1
341 1 1 1 1 25 CYS H . 25 . HN 1 1
341 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1
342 1 1 1 1 11 ILE H . 11 . HN 1 1
342 1 2 1 1 11 ILE HB . 11 . HB 1 1
343 1 1 1 1 18 VAL H . 18 . HN 1 1
343 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1
344 1 1 1 1 7 GLN HA . 7 . HA 1 1
344 1 2 1 1 7 GLN QG . 7 . HG2 1 1
345 1 1 1 1 25 CYS H . 25 . HN 1 1
345 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1
346 1 1 1 1 26 GLN H . 26 . HN 1 1
346 1 2 1 1 26 GLN HB2 . 26 . HB2 1 1
347 1 1 1 1 4 HIS HA . 4 . HA 1 1
347 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1
348 1 1 1 1 31 TYR H . 31 . HN 1 1
348 1 2 1 1 31 TYR HB2 . 31 . HB2 1 1
349 1 1 1 1 2 GLN H . 2 . HN 1 1
349 1 2 1 1 2 GLN HB3 . 2 . HB1 1 1
350 1 1 1 1 11 ILE HA . 11 . HA 1 1
350 1 2 1 1 11 ILE HG12 . 11 . HG12 1 1
351 1 1 1 1 31 TYR HA . 31 . HA 1 1
351 1 2 1 1 31 TYR QD . 31 . HD* 1 1
352 1 1 1 1 2 GLN H . 2 . HN 1 1
352 1 2 1 1 2 GLN HB2 . 2 . HB2 1 1
353 1 1 1 1 3 SER H . 3 . HN 1 1
353 1 2 1 1 3 SER HB3 . 3 . HB1 1 1
354 1 1 1 1 32 TYR H . 32 . HN 1 1
354 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1
355 1 1 1 1 34 GLN H . 34 . HN 1 1
355 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1
356 1 1 1 1 16 PRO HA . 16 . HA 1 1
356 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1
357 1 1 1 1 13 TYR H . 13 . HN 1 1
357 1 2 1 1 13 TYR QD . 13 . HD* 1 1
358 1 1 1 1 32 TYR H . 32 . HN 1 1
358 1 2 1 1 32 TYR QD . 32 . HD* 1 1
359 1 1 1 1 2 GLN HA . 2 . HA 1 1
359 1 2 1 1 2 GLN HB2 . 2 . HB2 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 . . . . . 2.3 1.8 2.5 1 1
2 1 . . . . . 2.8 1.8 3.1 1 1
3 1 . . . . . 2.8 1.8 3.1 1 1
4 1 . . . . . 2.8 1.8 3.1 1 1
5 1 . . . . . 2.8 1.8 3.1 1 1
6 1 . . . . . 2.8 1.8 3.1 1 1
7 1 . . . . . 2.8 1.8 3.1 1 1
8 1 . . . . . 2.8 1.8 3.1 1 1
9 1 . . . . . 2.8 1.8 3.1 1 1
10 1 . . . . . 2.8 1.8 3.1 1 1
11 1 . . . . . 2.8 1.8 3.1 1 1
12 1 . . . . . 2.8 1.8 3.1 1 1
13 1 . . . . . 2.8 1.8 3.1 1 1
14 1 . . . . . 2.8 1.8 3.1 1 1
15 1 . . . . . 2.8 1.8 3.1 1 1
16 1 . . . . . 2.8 1.8 3.1 1 1
17 1 . . . . . 2.8 1.8 3.1 1 1
18 1 . . . . . 2.8 1.8 3.1 1 1
19 1 . . . . . 2.8 1.8 3.1 1 1
20 1 . . . . . 2.8 1.8 3.1 1 1
21 1 . . . . . 2.8 1.8 3.1 1 1
22 1 . . . . . 2.8 1.8 3.1 1 1
23 1 . . . . . 2.8 1.8 3.1 1 1
24 1 . . . . . 2.8 1.8 3.1 1 1
25 1 . . . . . 2.8 1.8 3.1 1 1
26 1 . . . . . 2.8 1.8 3.1 1 1
27 1 . . . . . 2.8 1.8 3.1 1 1
28 1 . . . . . 2.8 1.8 3.1 1 1
29 1 . . . . . 2.8 1.8 3.1 1 1
30 1 . . . . . 3.3 1.8 3.6 1 1
31 1 . . . . . 2.8 1.8 3.1 1 1
32 1 . . . . . 3.1 1.8 3.5 1 1
33 1 . . . . . 2.3 1.8 2.5 1 1
34 1 . . . . . 2.8 1.8 3.1 1 1
35 1 . . . . . 2.8 1.8 3.1 1 1
36 1 . . . . . 2.8 1.8 3.1 1 1
37 1 . . . . . 3.1 1.8 3.5 1 1
38 1 . . . . . 2.8 1.8 3.1 1 1
39 1 . . . . . 2.8 1.8 3.1 1 1
40 1 . . . . . 2.8 1.8 3.1 1 1
41 1 . . . . . 2.8 1.8 3.1 1 1
42 1 . . . . . 3.3 1.8 3.6 1 1
43 1 . . . . . 3.1 1.8 3.5 1 1
44 1 . . . . . 3.3 1.8 3.6 1 1
45 1 . . . . . 3.3 1.8 3.6 1 1
46 1 . . . . . 3.1 1.8 3.5 1 1
47 1 . . . . . 3.1 1.8 3.5 1 1
48 1 . . . . . 3.1 1.8 3.5 1 1
49 1 . . . . . 3.1 1.8 3.5 1 1
50 1 . . . . . 4.2 1.8 5.0 1 1
51 1 . . . . . 3.1 1.8 3.5 1 1
52 1 . . . . . 3.1 1.8 3.5 1 1
53 1 . . . . . 3.1 1.8 3.5 1 1
54 1 . . . . . 3.1 1.8 3.5 1 1
55 1 . . . . . 3.1 1.8 3.5 1 1
56 1 . . . . . 4.2 1.8 5.0 1 1
57 1 . . . . . 4.0 1.8 4.4 1 1
58 1 . . . . . 3.1 1.8 3.5 1 1
59 1 . . . . . 3.1 1.8 3.5 1 1
60 1 . . . . . 3.1 1.8 3.5 1 1
61 1 . . . . . 3.1 1.8 3.5 1 1
62 1 . . . . . 3.1 1.8 3.5 1 1
63 1 . . . . . 3.1 1.8 3.5 1 1
64 1 . . . . . 3.1 1.8 3.5 1 1
65 1 . . . . . 4.0 1.8 4.4 1 1
66 1 . . . . . 3.6 1.8 4.0 1 1
67 1 . . . . . 3.5 1.8 3.9 1 1
68 1 . . . . . 3.1 1.8 3.5 1 1
69 1 . . . . . 3.1 1.8 3.5 1 1
70 1 . . . . . 3.1 1.8 3.5 1 1
71 1 . . . . . 4.0 1.8 4.4 1 1
72 1 . . . . . 3.5 1.8 3.9 1 1
73 1 . . . . . 3.5 1.8 3.9 1 1
74 1 . . . . . 4.0 1.8 4.4 1 1
75 1 . . . . . 4.0 1.8 4.4 1 1
76 1 . . . . . 3.5 1.8 3.9 1 1
77 1 . . . . . 3.5 1.8 3.9 1 1
78 1 . . . . . 3.5 1.8 3.9 1 1
79 1 . . . . . 4.2 1.8 5.0 1 1
80 1 . . . . . 2.8 1.8 3.1 1 1
81 1 . . . . . 3.5 1.8 3.9 1 1
82 1 . . . . . 3.5 1.8 3.9 1 1
83 1 . . . . . 4.0 1.8 4.4 1 1
84 1 . . . . . 3.1 1.8 3.5 1 1
85 1 . . . . . 4.0 1.8 4.4 1 1
86 1 . . . . . 3.5 1.8 3.9 1 1
87 1 . . . . . 3.5 1.8 3.9 1 1
88 1 . . . . . 4.0 1.8 4.4 1 1
89 1 . . . . . 3.5 1.8 3.9 1 1
90 1 . . . . . 3.5 1.8 3.9 1 1
91 1 . . . . . 3.5 1.8 3.9 1 1
92 1 . . . . . 3.5 1.8 3.9 1 1
93 1 . . . . . 3.1 1.8 3.5 1 1
94 1 . . . . . 3.1 1.8 3.5 1 1
95 1 . . . . . 3.5 1.8 3.9 1 1
96 1 . . . . . 3.5 1.8 3.9 1 1
97 1 . . . . . 3.5 1.8 3.9 1 1
98 1 . . . . . 3.5 1.8 3.9 1 1
99 1 . . . . . 3.5 1.8 3.9 1 1
100 1 . . . . . 2.8 1.8 3.1 1 1
101 1 . . . . . 3.5 1.8 3.9 1 1
102 1 . . . . . 3.6 1.8 4.0 1 1
103 1 . . . . . 2.8 1.8 3.1 1 1
104 1 . . . . . 4.2 1.8 5.0 1 1
105 1 . . . . . 3.5 1.8 3.9 1 1
106 1 . . . . . 4.0 1.8 4.4 1 1
107 1 . . . . . 4.0 1.8 4.4 1 1
108 1 . . . . . 3.5 1.8 3.9 1 1
109 1 . . . . . 4.0 1.8 4.4 1 1
110 1 . . . . . 3.5 1.8 3.9 1 1
111 1 . . . . . 3.1 1.8 3.5 1 1
112 1 . . . . . 3.5 1.8 3.9 1 1
113 1 . . . . . 3.5 1.8 3.9 1 1
114 1 . . . . . 4.0 1.8 4.4 1 1
115 1 . . . . . 3.5 1.8 3.9 1 1
116 1 . . . . . 4.0 1.8 4.4 1 1
117 1 . . . . . 3.5 1.8 3.9 1 1
118 1 . . . . . 3.1 1.8 3.5 1 1
119 1 . . . . . 4.0 1.8 4.4 1 1
120 1 . . . . . 4.0 1.8 4.4 1 1
121 1 . . . . . 3.5 1.8 3.9 1 1
122 1 . . . . . 4.2 1.8 5.0 1 1
123 1 . . . . . 3.1 1.8 3.5 1 1
124 1 . . . . . 4.0 1.8 4.4 1 1
125 1 . . . . . 4.0 1.8 4.4 1 1
126 1 . . . . . 3.5 1.8 3.9 1 1
127 1 . . . . . 3.5 1.8 3.9 1 1
128 1 . . . . . 3.5 1.8 3.9 1 1
129 1 . . . . . 4.2 1.8 5.0 1 1
130 1 . . . . . 4.0 1.8 4.4 1 1
131 1 . . . . . 3.5 1.8 3.9 1 1
132 1 . . . . . 3.5 1.8 3.9 1 1
133 1 . . . . . 3.5 1.8 3.9 1 1
134 1 . . . . . 4.0 1.8 4.4 1 1
135 1 . . . . . 3.5 1.8 3.9 1 1
136 1 . . . . . 3.5 1.8 3.9 1 1
137 1 . . . . . 4.0 1.8 4.4 1 1
138 1 . . . . . 3.5 1.8 3.9 1 1
139 1 . . . . . 3.1 1.8 3.5 1 1
140 1 . . . . . 3.5 1.8 3.9 1 1
141 1 . . . . . 3.5 1.8 3.9 1 1
142 1 . . . . . 3.5 1.8 3.9 1 1
143 1 . . . . . 3.5 1.8 3.9 1 1
144 1 . . . . . 3.5 1.8 3.9 1 1
145 1 . . . . . 3.5 1.8 3.9 1 1
146 1 . . . . . 4.2 1.8 5.0 1 1
147 1 . . . . . 3.5 1.8 3.9 1 1
148 1 . . . . . 3.5 1.8 3.9 1 1
149 1 . . . . . 3.5 1.8 3.9 1 1
150 1 . . . . . 3.5 1.8 3.9 1 1
151 1 . . . . . 4.2 1.8 5.0 1 1
152 1 . . . . . 4.0 1.8 4.4 1 1
153 1 . . . . . 3.5 1.8 3.9 1 1
154 1 . . . . . 3.5 1.8 3.9 1 1
155 1 . . . . . 4.2 1.8 5.0 1 1
156 1 . . . . . 3.5 1.8 3.9 1 1
157 1 . . . . . 4.2 1.8 5.0 1 1
158 1 . . . . . 4.0 1.8 4.4 1 1
159 1 . . . . . 4.0 1.8 4.4 1 1
160 1 . . . . . 3.5 1.8 3.9 1 1
161 1 . . . . . 3.5 1.8 3.9 1 1
162 1 . . . . . 4.0 1.8 4.4 1 1
163 1 . . . . . 4.2 1.8 5.0 1 1
164 1 . . . . . 3.5 1.8 3.9 1 1
165 1 . . . . . 3.5 1.8 3.9 1 1
166 1 . . . . . 3.1 1.8 3.5 1 1
167 1 . . . . . 3.5 1.8 3.9 1 1
168 1 . . . . . 4.0 1.8 4.4 1 1
169 1 . . . . . 4.7 1.8 5.5 1 1
170 1 . . . . . 3.5 1.8 3.9 1 1
171 1 . . . . . 3.1 1.8 3.5 1 1
172 1 . . . . . 3.5 1.8 3.9 1 1
173 1 . . . . . 3.5 1.8 3.9 1 1
174 1 . . . . . 3.5 1.8 3.9 1 1
175 1 . . . . . 4.2 1.8 5.0 1 1
176 1 . . . . . 3.5 1.8 3.9 1 1
177 1 . . . . . 3.5 1.8 3.9 1 1
178 1 . . . . . 4.2 1.8 5.0 1 1
179 1 . . . . . 3.5 1.8 3.9 1 1
180 1 . . . . . 4.0 1.8 4.4 1 1
181 1 . . . . . 3.5 1.8 3.9 1 1
182 1 . . . . . 4.2 1.8 5.0 1 1
183 1 . . . . . 4.7 1.8 5.5 1 1
184 1 . . . . . 4.2 1.8 5.0 1 1
185 1 . . . . . 3.5 1.8 3.9 1 1
186 1 . . . . . 4.2 1.8 5.0 1 1
187 1 . . . . . 4.7 1.8 5.5 1 1
188 1 . . . . . 4.2 1.8 5.0 1 1
189 1 . . . . . 4.2 1.8 5.0 1 1
190 1 . . . . . 4.2 1.8 5.0 1 1
191 1 . . . . . 4.2 1.8 5.0 1 1
192 1 . . . . . 4.2 1.8 5.0 1 1
193 1 . . . . . 4.2 1.8 5.0 1 1
194 1 . . . . . 4.2 1.8 5.0 1 1
195 1 . . . . . 4.2 1.8 5.0 1 1
196 1 . . . . . 4.2 1.8 5.0 1 1
197 1 . . . . . 4.2 1.8 5.0 1 1
198 1 . . . . . 4.2 1.8 5.0 1 1
199 1 . . . . . 4.2 1.8 5.0 1 1
200 1 . . . . . 4.7 1.8 5.5 1 1
201 1 . . . . . 4.2 1.8 5.0 1 1
202 1 . . . . . 4.2 1.8 5.0 1 1
203 1 . . . . . 4.2 1.8 5.0 1 1
204 1 . . . . . 2.8 1.8 3.1 1 1
205 1 . . . . . 3.5 1.8 3.9 1 1
206 1 . . . . . 3.5 1.8 3.9 1 1
207 1 . . . . . 3.5 1.8 3.9 1 1
208 1 . . . . . 4.2 1.8 5.0 1 1
209 1 . . . . . 3.5 1.8 3.9 1 1
210 1 . . . . . 3.5 1.8 3.9 1 1
211 1 . . . . . 4.2 1.8 5.0 1 1
212 1 . . . . . 4.2 1.8 5.0 1 1
213 1 . . . . . 4.2 1.8 5.0 1 1
214 1 . . . . . 4.2 1.8 5.0 1 1
215 1 . . . . . 4.2 1.8 5.0 1 1
216 1 . . . . . 4.2 1.8 5.0 1 1
217 1 . . . . . 3.5 1.8 3.9 1 1
218 1 . . . . . 3.5 1.8 3.9 1 1
219 1 . . . . . 3.1 1.8 3.5 1 1
220 1 . . . . . 4.2 1.8 5.0 1 1
221 1 . . . . . 4.2 1.8 5.0 1 1
222 1 . . . . . 2.3 1.8 2.5 1 1
223 1 . . . . . 2.8 1.8 3.1 1 1
224 1 . . . . . 4.2 1.8 5.0 1 1
225 1 . . . . . 4.2 1.8 5.0 1 1
226 1 . . . . . 2.8 1.8 3.1 1 1
227 1 . . . . . 2.8 1.8 3.1 1 1
228 1 . . . . . 3.5 1.8 3.9 1 1
229 1 . . . . . 3.1 1.8 3.5 1 1
230 1 . . . . . 4.7 1.8 5.5 1 1
231 1 . . . . . 4.0 1.8 4.4 1 1
232 1 . . . . . 3.1 1.8 3.5 1 1
233 1 . . . . . 3.5 1.8 3.9 1 1
234 1 . . . . . 3.5 1.8 3.9 1 1
235 1 . . . . . 4.0 1.8 4.4 1 1
236 1 . . . . . 3.5 1.8 3.9 1 1
237 1 . . . . . 3.5 1.8 3.9 1 1
238 1 . . . . . 3.5 1.8 3.9 1 1
239 1 . . . . . 3.5 1.8 3.9 1 1
240 1 . . . . . 4.0 1.8 4.4 1 1
241 1 . . . . . 3.5 1.8 3.9 1 1
242 1 . . . . . 3.5 1.8 3.9 1 1
243 1 . . . . . 3.5 1.8 3.9 1 1
244 1 . . . . . 3.5 1.8 3.9 1 1
245 1 . . . . . 3.5 1.8 3.9 1 1
246 1 . . . . . 3.5 1.8 3.9 1 1
247 1 . . . . . 3.5 1.8 3.9 1 1
248 1 . . . . . 3.5 1.8 3.9 1 1
249 1 . . . . . 3.5 1.8 3.9 1 1
250 1 . . . . . 3.5 1.8 3.9 1 1
251 1 . . . . . 3.5 1.8 3.9 1 1
252 1 . . . . . 3.5 1.8 3.9 1 1
253 1 . . . . . 3.5 1.8 3.9 1 1
254 1 . . . . . 3.5 1.8 3.9 1 1
255 1 . . . . . 4.0 1.8 4.4 1 1
256 1 . . . . . 3.5 1.8 3.9 1 1
257 1 . . . . . 3.5 1.8 3.9 1 1
258 1 . . . . . 3.5 1.8 3.9 1 1
259 1 . . . . . 4.0 1.8 4.4 1 1
260 1 . . . . . 4.2 1.8 5.0 1 1
261 1 . . . . . 4.2 1.8 5.0 1 1
262 1 . . . . . 4.2 1.8 5.0 1 1
263 1 . . . . . 3.5 1.8 3.9 1 1
264 1 . . . . . 3.5 1.8 3.9 1 1
265 1 . . . . . 4.0 1.8 4.4 1 1
266 1 . . . . . 4.2 1.8 5.0 1 1
267 1 . . . . . 3.5 1.8 3.9 1 1
268 1 . . . . . 3.5 1.8 3.9 1 1
269 1 . . . . . 3.5 1.8 3.9 1 1
270 1 . . . . . 4.2 1.8 5.0 1 1
271 1 . . . . . 4.2 1.8 5.0 1 1
272 1 . . . . . 4.2 1.8 5.0 1 1
273 1 . . . . . 4.2 1.8 5.0 1 1
274 1 . . . . . 4.2 1.8 5.0 1 1
275 1 . . . . . 3.5 1.8 3.9 1 1
276 1 . . . . . 3.5 1.8 3.9 1 1
277 1 . . . . . 3.5 1.8 3.9 1 1
278 1 . . . . . 4.2 1.8 5.0 1 1
279 1 . . . . . 4.2 1.8 5.0 1 1
280 1 . . . . . 4.2 1.8 5.0 1 1
281 1 . . . . . 4.2 1.8 5.0 1 1
282 1 . . . . . 4.2 1.8 5.0 1 1
283 1 . . . . . 3.5 1.8 3.9 1 1
284 1 . . . . . 4.2 1.8 5.0 1 1
285 1 . . . . . 2.8 1.8 3.2 1 1
286 1 . . . . . 2.8 1.8 3.2 1 1
287 1 . . . . . 2.8 1.8 3.2 1 1
288 1 . . . . . 2.8 1.8 3.2 1 1
289 1 . . . . . 2.8 1.8 3.2 1 1
290 1 . . . . . 2.8 1.8 3.2 1 1
291 1 . . . . . 2.8 1.8 3.2 1 1
292 1 . . . . . 2.8 1.8 3.2 1 1
293 1 . . . . . 2.8 1.8 3.2 1 1
294 1 . . . . . 2.8 1.8 3.2 1 1
295 1 . . . . . 2.8 1.8 3.2 1 1
296 1 . . . . . 2.8 1.8 3.2 1 1
297 1 . . . . . 2.8 1.8 3.2 1 1
298 1 . . . . . 2.8 1.8 3.2 1 1
299 1 . . . . . 2.8 1.8 3.2 1 1
300 1 . . . . . 2.8 1.8 3.2 1 1
301 1 . . . . . 2.8 1.8 3.2 1 1
302 1 . . . . . 2.8 1.8 3.2 1 1
303 1 . . . . . 2.8 1.8 3.2 1 1
304 1 . . . . . 2.8 1.8 3.2 1 1
305 1 . . . . . 2.8 1.8 3.2 1 1
306 1 . . . . . 2.8 1.8 3.2 1 1
307 1 . . . . . 2.8 1.8 3.2 1 1
308 1 . . . . . 2.8 1.8 3.2 1 1
309 1 . . . . . 2.8 1.8 3.2 1 1
310 1 . . . . . 2.8 1.8 3.2 1 1
311 1 . . . . . 2.8 1.8 3.2 1 1
312 1 . . . . . 2.8 1.8 3.2 1 1
313 1 . . . . . 2.8 1.8 3.2 1 1
314 1 . . . . . 2.8 1.8 3.2 1 1
315 1 . . . . . 2.8 1.8 3.2 1 1
316 1 . . . . . 2.8 1.8 3.2 1 1
317 1 . . . . . 2.8 1.8 3.2 1 1
318 1 . . . . . 2.8 1.8 3.2 1 1
319 1 . . . . . 2.8 1.8 3.2 1 1
320 1 . . . . . 3.1 1.8 3.5 1 1
321 1 . . . . . 3.1 1.8 3.5 1 1
322 1 . . . . . 3.1 1.8 3.5 1 1
323 1 . . . . . 3.6 1.8 4.0 1 1
324 1 . . . . . 3.1 1.8 3.5 1 1
325 1 . . . . . 3.1 1.8 3.5 1 1
326 1 . . . . . 3.1 1.8 3.5 1 1
327 1 . . . . . 3.1 1.8 3.5 1 1
328 1 . . . . . 3.1 1.8 3.5 1 1
329 1 . . . . . 3.1 1.8 3.5 1 1
330 1 . . . . . 3.1 1.8 3.5 1 1
331 1 . . . . . 3.1 1.8 3.5 1 1
332 1 . . . . . 3.1 1.8 3.5 1 1
333 1 . . . . . 3.1 1.8 3.5 1 1
334 1 . . . . . 3.1 1.8 3.5 1 1
335 1 . . . . . 3.6 1.8 4.0 1 1
336 1 . . . . . 3.1 1.8 3.5 1 1
337 1 . . . . . 3.1 1.8 3.5 1 1
338 1 . . . . . 3.6 1.8 4.0 1 1
339 1 . . . . . 3.1 1.8 3.5 1 1
340 1 . . . . . 3.1 1.8 3.5 1 1
341 1 . . . . . 3.1 1.8 3.5 1 1
342 1 . . . . . 3.1 1.8 3.5 1 1
343 1 . . . . . 3.6 1.8 4.0 1 1
344 1 . . . . . 3.1 1.8 3.5 1 1
345 1 . . . . . 3.1 1.8 3.5 1 1
346 1 . . . . . 3.1 1.8 3.5 1 1
347 1 . . . . . 3.1 1.8 3.5 1 1
348 1 . . . . . 3.1 1.8 3.5 1 1
349 1 . . . . . 3.1 1.8 3.5 1 1
350 1 . . . . . 3.1 1.8 3.5 1 1
351 1 . . . . . 3.1 1.8 3.5 1 1
352 1 . . . . . 3.1 1.8 3.5 1 1
353 1 . . . . . 3.1 1.8 3.5 1 1
354 1 . . . . . 3.1 1.8 3.5 1 1
355 1 . . . . . 3.1 1.8 3.5 1 1
356 1 . . . . . 3.5 1.8 3.9 1 1
357 1 . . . . . 4.2 1.8 5.0 1 1
358 1 . . . . . 4.2 1.8 5.0 1 1
359 1 . . . . . 2.8 1.8 3.1 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 2
19 1 . . . 1 2
20 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 24 THR O . 24 . O 1 2
1 1 2 1 1 36 LEU H . 36 . HN 1 2
2 1 1 1 1 24 THR O . 24 . O 1 2
2 1 2 1 1 36 LEU N . 36 . N 1 2
3 1 1 1 1 26 GLN H . 26 . HN 1 2
3 1 2 1 1 34 GLN O . 34 . O 1 2
4 1 1 1 1 26 GLN N . 26 . N 1 2
4 1 2 1 1 34 GLN O . 34 . O 1 2
5 1 1 1 1 26 GLN O . 26 . O 1 2
5 1 2 1 1 34 GLN H . 34 . HN 1 2
6 1 1 1 1 26 GLN O . 26 . O 1 2
6 1 2 1 1 34 GLN N . 34 . N 1 2
7 1 1 1 1 28 LEU H . 28 . HN 1 2
7 1 2 1 1 32 TYR O . 32 . O 1 2
8 1 1 1 1 28 LEU N . 28 . N 1 2
8 1 2 1 1 32 TYR O . 32 . O 1 2
9 1 1 1 1 29 ASN H . 29 . HN 1 2
9 1 2 1 1 32 TYR O . 32 . O 1 2
10 1 1 1 1 29 ASN N . 29 . N 1 2
10 1 2 1 1 32 TYR O . 32 . O 1 2
11 1 1 1 1 6 GLY O . 6 . O 1 2
11 1 2 1 1 35 CYS H . 35 . HN 1 2
12 1 1 1 1 6 GLY O . 6 . O 1 2
12 1 2 1 1 35 CYS N . 35 . N 1 2
13 1 1 1 1 20 ALA O . 20 . O 1 2
13 1 2 1 1 23 THR H . 23 . HN 1 2
14 1 1 1 1 20 ALA O . 20 . O 1 2
14 1 2 1 1 23 THR N . 23 . N 1 2
15 1 1 1 1 8 CYS H . 8 . HN 1 2
15 1 2 1 1 33 SER O . 33 . O 1 2
16 1 1 1 1 8 CYS N . 8 . N 1 2
16 1 2 1 1 33 SER O . 33 . O 1 2
17 1 1 1 1 29 ASN O . 29 . O 1 2
17 1 2 1 1 32 TYR H . 32 . HN 1 2
18 1 1 1 1 29 ASN O . 29 . O 1 2
18 1 2 1 1 32 TYR N . 32 . N 1 2
19 1 1 1 1 9 GLY H . 9 . HN 1 2
19 1 2 1 1 33 SER O . 33 . O 1 2
20 1 1 1 1 9 GLY N . 9 . N 1 2
20 1 2 1 1 33 SER O . 33 . O 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.0 1.7 2.3 1 2
2 1 . . . . . 2.8 2.4 3.3 1 2
3 1 . . . . . 2.0 1.7 2.3 1 2
4 1 . . . . . 2.8 2.4 3.3 1 2
5 1 . . . . . 2.0 1.7 2.3 1 2
6 1 . . . . . 2.8 2.4 3.3 1 2
7 1 . . . . . 2.0 1.7 2.3 1 2
8 1 . . . . . 2.8 2.4 3.3 1 2
9 1 . . . . . 2.0 1.7 2.3 1 2
10 1 . . . . . 2.8 2.4 3.3 1 2
11 1 . . . . . 2.0 1.7 2.3 1 2
12 1 . . . . . 2.8 2.4 3.3 1 2
13 1 . . . . . 2.0 1.7 2.3 1 2
14 1 . . . . . 2.8 2.4 3.3 1 2
15 1 . . . . . 2.0 1.7 2.3 1 2
16 1 . . . . . 2.8 2.4 3.3 1 2
17 1 . . . . . 2.0 1.7 2.3 1 2
18 1 . . . . . 2.8 2.4 3.3 1 2
19 1 . . . . . 2.0 1.7 2.3 1 2
20 1 . . . . . 2.8 2.4 3.3 1 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 23 THR C 1 1 24 THR CA 1 1 24 THR N 1 1 24 THR C 100.0 140.0 . 23 . C . 24 . CA . 24 . N . 24 . C 1 1
2 . 1 1 1 THR C 1 1 2 GLN CA 1 1 2 GLN N 1 1 2 GLN C 100.0 140.0 . 1 . C . 2 . CA . 2 . N . 2 . C 1 1
3 . 1 1 2 GLN C 1 1 3 SER CA 1 1 3 SER N 1 1 3 SER C 80.0 160.0 . 2 . C . 3 . CA . 3 . N . 3 . C 1 1
4 . 1 1 35 CYS C 1 1 36 LEU CA 1 1 36 LEU N 1 1 36 LEU C 100.0 140.0 . 35 . C . 36 . CA . 36 . N . 36 . C 1 1
5 . 1 1 25 CYS C 1 1 26 GLN CA 1 1 26 GLN N 1 1 26 GLN C 100.0 140.0 . 25 . C . 26 . CA . 26 . N . 26 . C 1 1
6 . 1 1 30 PRO C 1 1 31 TYR CA 1 1 31 TYR N 1 1 31 TYR C 100.0 140.0 . 30 . C . 31 . CA . 31 . N . 31 . C 1 1
7 . 1 1 6 GLY C 1 1 7 GLN CA 1 1 7 GLN N 1 1 7 GLN C 100.0 140.0 . 6 . C . 7 . CA . 7 . N . 7 . C 1 1
8 . 1 1 27 VAL C 1 1 28 LEU CA 1 1 28 LEU N 1 1 28 LEU C 100.0 140.0 . 27 . C . 28 . CA . 28 . N . 28 . C 1 1
9 . 1 1 13 TYR C 1 1 14 SER CA 1 1 14 SER N 1 1 14 SER C 100.0 140.0 . 13 . C . 14 . CA . 14 . N . 14 . C 1 1
10 . 1 1 16 PRO C 1 1 17 THR CA 1 1 17 THR N 1 1 17 THR C 100.0 140.0 . 16 . C . 17 . CA . 17 . N . 17 . C 1 1
11 . 1 1 22 GLY C 1 1 23 THR CA 1 1 23 THR N 1 1 23 THR C 100.0 140.0 . 22 . C . 23 . CA . 23 . N . 23 . C 1 1
12 . 1 1 7 GLN C 1 1 8 CYS CA 1 1 8 CYS N 1 1 8 CYS C 100.0 140.0 . 7 . C . 8 . CA . 8 . N . 8 . C 1 1
13 . 1 1 32 TYR C 1 1 33 SER CA 1 1 33 SER N 1 1 33 SER C 100.0 140.0 . 32 . C . 33 . CA . 33 . N . 33 . C 1 1
14 . 1 1 17 THR C 1 1 18 VAL CA 1 1 18 VAL N 1 1 18 VAL C 100.0 140.0 . 17 . C . 18 . CA . 18 . N . 18 . C 1 1
15 . 1 1 31 TYR C 1 1 32 TYR CA 1 1 32 TYR N 1 1 32 TYR C 80.0 160.0 . 31 . C . 32 . CA . 32 . N . 32 . C 1 1
16 . 1 1 8 CYS C 1 1 9 GLY CA 1 1 9 GLY N 1 1 9 GLY C 80.0 160.0 . 8 . C . 9 . CA . 9 . N . 9 . C 1 1
17 . 1 1 14 SER C 1 1 15 GLY CA 1 1 15 GLY N 1 1 15 GLY C 80.0 160.0 . 14 . C . 15 . CA . 15 . N . 15 . C 1 1
18 . 1 1 11 ILE C 1 1 12 GLY CA 1 1 12 GLY N 1 1 12 GLY C 100.0 140.0 . 11 . C . 12 . CA . 12 . N . 12 . C 1 1
19 . 1 1 5 TYR C 1 1 6 GLY CA 1 1 6 GLY N 1 1 6 GLY C 80.0 160.0 . 5 . C . 6 . CA . 6 . N . 6 . C 1 1
20 . 1 1 21 SER C 1 1 22 GLY CA 1 1 22 GLY N 1 1 22 GLY C 80.0 160.0 . 21 . C . 22 . CA . 22 . N . 22 . C 1 1
21 . 1 1 9 GLY C 1 1 10 GLY CA 1 1 10 GLY N 1 1 10 GLY C 80.0 160.0 . 9 . C . 10 . CA . 10 . N . 10 . C 1 1
22 . 1 1 12 GLY C 1 1 13 TYR CA 1 1 13 TYR N 1 1 13 TYR C 80.0 160.0 . 12 . C . 13 . CA . 13 . N . 13 . C 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 THR C C -6.132 5.116 0.983 1.00 . A A . 1 THR C 1 1
1 2 1 1 1 THR CA C -7.013 5.155 2.198 1.00 . A A . 1 THR CA 1 1
1 3 1 1 1 THR CB C -8.080 4.020 2.113 1.00 . A A . 1 THR CB 1 1
1 4 1 1 1 THR CG2 C -8.484 3.597 3.520 1.00 . A A . 1 THR CG2 1 1
1 5 1 1 1 THR H1 H -8.720 6.307 2.125 1.00 . A A . 1 THR H1 1 1
1 6 1 1 1 THR H2 H -7.319 7.150 1.652 1.00 . A A . 1 THR H2 1 1
1 7 1 1 1 THR H3 H -7.648 6.867 3.320 1.00 . A A . 1 THR H3 1 1
1 8 1 1 1 THR HA H -6.374 5.014 3.053 1.00 . A A . 1 THR HA 1 1
1 9 1 1 1 THR HB H -7.723 3.126 1.562 1.00 . A A . 1 THR HB 1 1
1 10 1 1 1 THR HG21 H -7.621 3.084 3.993 1.00 . A A . 1 THR HG21 1 1
1 11 1 1 1 THR HG22 H -9.322 2.869 3.517 1.00 . A A . 1 THR HG22 1 1
1 12 1 1 1 THR HG23 H -8.760 4.446 4.172 1.00 . A A . 1 THR HG23 1 1
1 13 1 1 1 THR N N -7.713 6.486 2.360 1.00 . A A . 1 THR N 1 1
1 14 1 1 1 THR O O -5.994 6.151 0.355 1.00 . A A . 1 THR O 1 1
1 15 1 1 2 GLN C C -5.819 2.604 -1.379 1.00 . A A . 2 GLN C 1 1
1 16 1 1 2 GLN CA C -4.986 3.665 -0.684 1.00 . A A . 2 GLN CA 1 1
1 17 1 1 2 GLN CB C -3.561 3.081 -0.600 1.00 . A A . 2 GLN CB 1 1
1 18 1 1 2 GLN CD C -2.384 5.105 -1.362 1.00 . A A . 2 GLN CD 1 1
1 19 1 1 2 GLN CG C -2.685 3.665 -1.721 1.00 . A A . 2 GLN CG 1 1
1 20 1 1 2 GLN H H -5.518 3.184 1.267 1.00 . A A . 2 GLN H 1 1
1 21 1 1 2 GLN HA H -5.007 4.564 -1.292 1.00 . A A . 2 GLN HA 1 1
1 22 1 1 2 GLN HB2 H -3.137 3.308 0.407 1.00 . A A . 2 GLN HB2 1 1
1 23 1 1 2 GLN HB3 H -3.531 1.977 -0.687 1.00 . A A . 2 GLN HB3 1 1
1 24 1 1 2 GLN HE21 H -1.126 4.438 0.105 1.00 . A A . 2 GLN HE21 1 1
1 25 1 1 2 GLN HE22 H -1.418 6.151 0.078 1.00 . A A . 2 GLN HE22 1 1
1 26 1 1 2 GLN HG2 H -1.746 3.099 -1.837 1.00 . A A . 2 GLN HG2 1 1
1 27 1 1 2 GLN HG3 H -3.195 3.660 -2.703 1.00 . A A . 2 GLN HG3 1 1
1 28 1 1 2 GLN N N -5.558 3.948 0.618 1.00 . A A . 2 GLN N 1 1
1 29 1 1 2 GLN NE2 N -1.531 5.250 -0.333 1.00 . A A . 2 GLN NE2 1 1
1 30 1 1 2 GLN O O -6.584 1.870 -0.749 1.00 . A A . 2 GLN O 1 1
1 31 1 1 2 GLN OE1 O -2.914 6.068 -1.903 1.00 . A A . 2 GLN OE1 1 1
1 32 1 1 3 SER C C -5.975 0.190 -3.484 1.00 . A A . 3 SER C 1 1
1 33 1 1 3 SER CA C -6.478 1.614 -3.544 1.00 . A A . 3 SER CA 1 1
1 34 1 1 3 SER CB C -6.491 2.055 -5.031 1.00 . A A . 3 SER CB 1 1
1 35 1 1 3 SER H H -5.125 3.153 -3.220 1.00 . A A . 3 SER H 1 1
1 36 1 1 3 SER HA H -7.491 1.612 -3.175 1.00 . A A . 3 SER HA 1 1
1 37 1 1 3 SER HB2 H -5.990 1.327 -5.699 1.00 . A A . 3 SER HB2 1 1
1 38 1 1 3 SER HB3 H -7.530 2.226 -5.384 1.00 . A A . 3 SER HB3 1 1
1 39 1 1 3 SER N N -5.715 2.524 -2.710 1.00 . A A . 3 SER N 1 1
1 40 1 1 3 SER O O -4.896 -0.099 -2.980 1.00 . A A . 3 SER O 1 1
1 41 1 1 4 HIS C C -5.087 -2.288 -4.981 1.00 . A A . 4 HIS C 1 1
1 42 1 1 4 HIS CA C -6.340 -2.158 -4.148 1.00 . A A . 4 HIS CA 1 1
1 43 1 1 4 HIS CB C -7.434 -3.027 -4.821 1.00 . A A . 4 HIS CB 1 1
1 44 1 1 4 HIS CD2 C -6.468 -5.199 -3.746 1.00 . A A . 4 HIS CD2 1 1
1 45 1 1 4 HIS CE1 C -8.080 -6.557 -4.336 1.00 . A A . 4 HIS CE1 1 1
1 46 1 1 4 HIS CG C -7.346 -4.499 -4.508 1.00 . A A . 4 HIS CG 1 1
1 47 1 1 4 HIS H H -7.628 -0.520 -4.437 1.00 . A A . 4 HIS H 1 1
1 48 1 1 4 HIS HA H -6.109 -2.522 -3.157 1.00 . A A . 4 HIS HA 1 1
1 49 1 1 4 HIS HB2 H -8.420 -2.669 -4.453 1.00 . A A . 4 HIS HB2 1 1
1 50 1 1 4 HIS HB3 H -7.421 -2.889 -5.926 1.00 . A A . 4 HIS HB3 1 1
1 51 1 1 4 HIS HD1 H -9.173 -5.163 -5.380 1.00 . A A . 4 HIS HD1 1 1
1 52 1 1 4 HIS HD2 H -5.642 -4.853 -3.138 1.00 . A A . 4 HIS HD2 1 1
1 53 1 1 4 HIS HE1 H -8.665 -7.459 -4.463 1.00 . A A . 4 HIS HE1 1 1
1 54 1 1 4 HIS HE2 H -6.781 -7.003 -2.801 1.00 . A A . 4 HIS HE2 1 1
1 55 1 1 4 HIS N N -6.754 -0.764 -4.035 1.00 . A A . 4 HIS N 1 1
1 56 1 1 4 HIS ND1 N -8.341 -5.370 -4.869 1.00 . A A . 4 HIS ND1 1 1
1 57 1 1 4 HIS NE2 N -6.961 -6.473 -3.654 1.00 . A A . 4 HIS NE2 1 1
1 58 1 1 4 HIS O O -4.993 -1.717 -6.062 1.00 . A A . 4 HIS O 1 1
1 59 1 1 5 TYR C C -1.984 -1.947 -5.104 1.00 . A A . 5 TYR C 1 1
1 60 1 1 5 TYR CA C -2.791 -3.235 -5.038 1.00 . A A . 5 TYR CA 1 1
1 61 1 1 5 TYR CB C -2.820 -3.941 -6.413 1.00 . A A . 5 TYR CB 1 1
1 62 1 1 5 TYR CD1 C -3.451 -6.336 -5.820 1.00 . A A . 5 TYR CD1 1 1
1 63 1 1 5 TYR CD2 C -5.038 -4.928 -6.991 1.00 . A A . 5 TYR CD2 1 1
1 64 1 1 5 TYR CE1 C -4.372 -7.397 -5.859 1.00 . A A . 5 TYR CE1 1 1
1 65 1 1 5 TYR CE2 C -5.958 -5.976 -7.017 1.00 . A A . 5 TYR CE2 1 1
1 66 1 1 5 TYR CG C -3.780 -5.094 -6.394 1.00 . A A . 5 TYR CG 1 1
1 67 1 1 5 TYR CZ C -5.623 -7.212 -6.464 1.00 . A A . 5 TYR CZ 1 1
1 68 1 1 5 TYR H H -4.189 -3.407 -3.525 1.00 . A A . 5 TYR H 1 1
1 69 1 1 5 TYR HA H -2.287 -3.891 -4.350 1.00 . A A . 5 TYR HA 1 1
1 70 1 1 5 TYR HB2 H -3.130 -3.223 -7.204 1.00 . A A . 5 TYR HB2 1 1
1 71 1 1 5 TYR HB3 H -1.815 -4.327 -6.683 1.00 . A A . 5 TYR HB3 1 1
1 72 1 1 5 TYR HD1 H -2.485 -6.482 -5.356 1.00 . A A . 5 TYR HD1 1 1
1 73 1 1 5 TYR HD2 H -5.290 -3.973 -7.429 1.00 . A A . 5 TYR HD2 1 1
1 74 1 1 5 TYR HE1 H -4.114 -8.345 -5.410 1.00 . A A . 5 TYR HE1 1 1
1 75 1 1 5 TYR HE2 H -6.929 -5.833 -7.466 1.00 . A A . 5 TYR HE2 1 1
1 76 1 1 5 TYR HH H -6.103 -9.064 -6.653 1.00 . A A . 5 TYR HH 1 1
1 77 1 1 5 TYR N N -4.091 -3.006 -4.445 1.00 . A A . 5 TYR N 1 1
1 78 1 1 5 TYR O O -0.997 -1.839 -5.822 1.00 . A A . 5 TYR O 1 1
1 79 1 1 5 TYR OH O -6.580 -8.241 -6.516 1.00 . A A . 5 TYR OH 1 1
1 80 1 1 6 GLY C C -0.760 0.232 -3.024 1.00 . A A . 6 GLY C 1 1
1 81 1 1 6 GLY CA C -1.670 0.326 -4.189 1.00 . A A . 6 GLY CA 1 1
1 82 1 1 6 GLY H H -3.232 -1.013 -3.797 1.00 . A A . 6 GLY H 1 1
1 83 1 1 6 GLY HA2 H -1.060 0.515 -5.061 1.00 . A A . 6 GLY HA2 1 1
1 84 1 1 6 GLY HA3 H -2.382 1.104 -3.969 1.00 . A A . 6 GLY HA3 1 1
1 85 1 1 6 GLY N N -2.399 -0.917 -4.341 1.00 . A A . 6 GLY N 1 1
1 86 1 1 6 GLY O O -0.733 -0.768 -2.315 1.00 . A A . 6 GLY O 1 1
1 87 1 1 7 GLN C C 0.459 1.798 -0.413 1.00 . A A . 7 GLN C 1 1
1 88 1 1 7 GLN CA C 0.994 1.241 -1.725 1.00 . A A . 7 GLN CA 1 1
1 89 1 1 7 GLN CB C 2.220 2.046 -2.176 1.00 . A A . 7 GLN CB 1 1
1 90 1 1 7 GLN CD C 4.750 1.935 -1.948 1.00 . A A . 7 GLN CD 1 1
1 91 1 1 7 GLN CG C 3.410 1.810 -1.234 1.00 . A A . 7 GLN CG 1 1
1 92 1 1 7 GLN H H -0.030 2.122 -3.316 1.00 . A A . 7 GLN H 1 1
1 93 1 1 7 GLN HA H 1.312 0.220 -1.561 1.00 . A A . 7 GLN HA 1 1
1 94 1 1 7 GLN HB2 H 2.477 1.723 -3.208 1.00 . A A . 7 GLN HB2 1 1
1 95 1 1 7 GLN HB3 H 1.979 3.123 -2.256 1.00 . A A . 7 GLN HB3 1 1
1 96 1 1 7 GLN HE21 H 5.569 0.860 -0.459 1.00 . A A . 7 GLN HE21 1 1
1 97 1 1 7 GLN HE22 H 6.632 1.216 -1.833 1.00 . A A . 7 GLN HE22 1 1
1 98 1 1 7 GLN HG2 H 3.376 2.495 -0.369 1.00 . A A . 7 GLN HG2 1 1
1 99 1 1 7 GLN HG3 H 3.328 0.773 -0.846 1.00 . A A . 7 GLN HG3 1 1
1 100 1 1 7 GLN N N 0.009 1.287 -2.771 1.00 . A A . 7 GLN N 1 1
1 101 1 1 7 GLN NE2 N 5.766 1.286 -1.345 1.00 . A A . 7 GLN NE2 1 1
1 102 1 1 7 GLN O O 0.028 2.940 -0.337 1.00 . A A . 7 GLN O 1 1
1 103 1 1 7 GLN OE1 O 4.913 2.505 -3.022 1.00 . A A . 7 GLN OE1 1 1
1 104 1 1 8 CYS C C 1.411 1.893 2.752 1.00 . A A . 8 CYS C 1 1
1 105 1 1 8 CYS CA C 0.139 1.560 1.999 1.00 . A A . 8 CYS CA 1 1
1 106 1 1 8 CYS CB C -0.778 0.563 2.793 1.00 . A A . 8 CYS CB 1 1
1 107 1 1 8 CYS H H 0.787 0.071 0.613 1.00 . A A . 8 CYS H 1 1
1 108 1 1 8 CYS HA H -0.395 2.497 1.911 1.00 . A A . 8 CYS HA 1 1
1 109 1 1 8 CYS HB2 H -1.779 1.046 2.822 1.00 . A A . 8 CYS HB2 1 1
1 110 1 1 8 CYS HB3 H -0.870 -0.362 2.184 1.00 . A A . 8 CYS HB3 1 1
1 111 1 1 8 CYS N N 0.469 1.019 0.680 1.00 . A A . 8 CYS N 1 1
1 112 1 1 8 CYS O O 1.428 2.655 3.714 1.00 . A A . 8 CYS O 1 1
1 113 1 1 8 CYS SG S -0.331 0.107 4.516 1.00 . A A . 8 CYS SG 1 1
1 114 1 1 9 GLY C C 4.900 1.202 2.103 1.00 . A A . 9 GLY C 1 1
1 115 1 1 9 GLY CA C 3.787 1.515 3.031 1.00 . A A . 9 GLY CA 1 1
1 116 1 1 9 GLY H H 2.548 0.768 1.495 1.00 . A A . 9 GLY H 1 1
1 117 1 1 9 GLY HA2 H 3.895 2.542 3.355 1.00 . A A . 9 GLY HA2 1 1
1 118 1 1 9 GLY HA3 H 3.811 0.794 3.836 1.00 . A A . 9 GLY HA3 1 1
1 119 1 1 9 GLY N N 2.545 1.345 2.311 1.00 . A A . 9 GLY N 1 1
1 120 1 1 9 GLY O O 4.752 0.460 1.135 1.00 . A A . 9 GLY O 1 1
1 121 1 1 10 GLY C C 8.395 2.004 2.160 1.00 . A A . 10 GLY C 1 1
1 122 1 1 10 GLY CA C 7.211 1.462 1.484 1.00 . A A . 10 GLY CA 1 1
1 123 1 1 10 GLY H H 6.256 2.363 3.107 1.00 . A A . 10 GLY H 1 1
1 124 1 1 10 GLY HA2 H 7.332 0.395 1.359 1.00 . A A . 10 GLY HA2 1 1
1 125 1 1 10 GLY HA3 H 7.117 2.031 0.575 1.00 . A A . 10 GLY HA3 1 1
1 126 1 1 10 GLY N N 6.081 1.751 2.332 1.00 . A A . 10 GLY N 1 1
1 127 1 1 10 GLY O O 8.264 2.773 3.104 1.00 . A A . 10 GLY O 1 1
1 128 1 1 11 ILE C C 10.872 3.774 1.782 1.00 . A A . 11 ILE C 1 1
1 129 1 1 11 ILE CA C 10.821 2.286 2.111 1.00 . A A . 11 ILE CA 1 1
1 130 1 1 11 ILE CB C 12.022 1.502 1.592 1.00 . A A . 11 ILE CB 1 1
1 131 1 1 11 ILE CD1 C 13.329 0.443 3.575 1.00 . A A . 11 ILE CD1 1 1
1 132 1 1 11 ILE CG1 C 12.245 0.268 2.506 1.00 . A A . 11 ILE CG1 1 1
1 133 1 1 11 ILE CG2 C 13.285 2.381 1.447 1.00 . A A . 11 ILE CG2 1 1
1 134 1 1 11 ILE H H 9.654 1.017 0.906 1.00 . A A . 11 ILE H 1 1
1 135 1 1 11 ILE HA H 10.843 2.242 3.192 1.00 . A A . 11 ILE HA 1 1
1 136 1 1 11 ILE HB H 11.763 1.128 0.573 1.00 . A A . 11 ILE HB 1 1
1 137 1 1 11 ILE HD11 H 13.183 1.386 4.143 1.00 . A A . 11 ILE HD11 1 1
1 138 1 1 11 ILE HD12 H 14.337 0.458 3.105 1.00 . A A . 11 ILE HD12 1 1
1 139 1 1 11 ILE HD13 H 13.305 -0.408 4.289 1.00 . A A . 11 ILE HD13 1 1
1 140 1 1 11 ILE HG12 H 11.289 -0.016 3.000 1.00 . A A . 11 ILE HG12 1 1
1 141 1 1 11 ILE HG13 H 12.542 -0.601 1.883 1.00 . A A . 11 ILE HG13 1 1
1 142 1 1 11 ILE HG21 H 13.170 3.125 0.630 1.00 . A A . 11 ILE HG21 1 1
1 143 1 1 11 ILE HG22 H 14.170 1.759 1.212 1.00 . A A . 11 ILE HG22 1 1
1 144 1 1 11 ILE HG23 H 13.489 2.930 2.392 1.00 . A A . 11 ILE HG23 1 1
1 145 1 1 11 ILE N N 9.586 1.658 1.664 1.00 . A A . 11 ILE N 1 1
1 146 1 1 11 ILE O O 11.342 4.597 2.561 1.00 . A A . 11 ILE O 1 1
1 147 1 1 12 GLY C C 8.980 5.892 -0.381 1.00 . A A . 12 GLY C 1 1
1 148 1 1 12 GLY CA C 10.337 5.520 0.113 1.00 . A A . 12 GLY CA 1 1
1 149 1 1 12 GLY H H 9.941 3.455 0.015 1.00 . A A . 12 GLY H 1 1
1 150 1 1 12 GLY HA2 H 10.572 6.212 0.911 1.00 . A A . 12 GLY HA2 1 1
1 151 1 1 12 GLY HA3 H 11.018 5.584 -0.723 1.00 . A A . 12 GLY HA3 1 1
1 152 1 1 12 GLY N N 10.345 4.147 0.601 1.00 . A A . 12 GLY N 1 1
1 153 1 1 12 GLY O O 8.825 6.413 -1.481 1.00 . A A . 12 GLY O 1 1
1 154 1 1 13 TYR C C 6.036 7.137 0.699 1.00 . A A . 13 TYR C 1 1
1 155 1 1 13 TYR CA C 6.575 5.886 0.014 1.00 . A A . 13 TYR CA 1 1
1 156 1 1 13 TYR CB C 5.645 4.676 0.288 1.00 . A A . 13 TYR CB 1 1
1 157 1 1 13 TYR CD1 C 4.150 5.264 -1.614 1.00 . A A . 13 TYR CD1 1 1
1 158 1 1 13 TYR CD2 C 3.135 4.956 0.570 1.00 . A A . 13 TYR CD2 1 1
1 159 1 1 13 TYR CE1 C 2.912 5.587 -2.156 1.00 . A A . 13 TYR CE1 1 1
1 160 1 1 13 TYR CE2 C 1.880 5.230 0.012 1.00 . A A . 13 TYR CE2 1 1
1 161 1 1 13 TYR CG C 4.276 4.957 -0.250 1.00 . A A . 13 TYR CG 1 1
1 162 1 1 13 TYR CZ C 1.782 5.542 -1.355 1.00 . A A . 13 TYR CZ 1 1
1 163 1 1 13 TYR H H 8.084 5.228 1.321 1.00 . A A . 13 TYR H 1 1
1 164 1 1 13 TYR HA H 6.560 6.095 -1.047 1.00 . A A . 13 TYR HA 1 1
1 165 1 1 13 TYR HB2 H 6.035 3.786 -0.242 1.00 . A A . 13 TYR HB2 1 1
1 166 1 1 13 TYR HB3 H 5.589 4.461 1.376 1.00 . A A . 13 TYR HB3 1 1
1 167 1 1 13 TYR HD1 H 5.011 5.243 -2.266 1.00 . A A . 13 TYR HD1 1 1
1 168 1 1 13 TYR HD2 H 3.220 4.724 1.624 1.00 . A A . 13 TYR HD2 1 1
1 169 1 1 13 TYR HE1 H 2.809 5.801 -3.211 1.00 . A A . 13 TYR HE1 1 1
1 170 1 1 13 TYR HE2 H 1.006 5.176 0.644 1.00 . A A . 13 TYR HE2 1 1
1 171 1 1 13 TYR HH H -0.115 5.335 -1.478 1.00 . A A . 13 TYR HH 1 1
1 172 1 1 13 TYR N N 7.935 5.591 0.405 1.00 . A A . 13 TYR N 1 1
1 173 1 1 13 TYR O O 6.310 7.403 1.865 1.00 . A A . 13 TYR O 1 1
1 174 1 1 13 TYR OH O 0.577 5.728 -2.029 1.00 . A A . 13 TYR OH 1 1
1 175 1 1 14 SER C C 3.232 9.361 0.121 1.00 . A A . 14 SER C 1 1
1 176 1 1 14 SER CA C 4.693 9.178 0.478 1.00 . A A . 14 SER CA 1 1
1 177 1 1 14 SER CB C 5.491 10.403 -0.026 1.00 . A A . 14 SER CB 1 1
1 178 1 1 14 SER H H 5.019 7.693 -0.975 1.00 . A A . 14 SER H 1 1
1 179 1 1 14 SER HA H 4.736 9.167 1.559 1.00 . A A . 14 SER HA 1 1
1 180 1 1 14 SER HB2 H 4.988 10.952 -0.845 1.00 . A A . 14 SER HB2 1 1
1 181 1 1 14 SER HB3 H 5.702 11.088 0.823 1.00 . A A . 14 SER HB3 1 1
1 182 1 1 14 SER N N 5.214 7.920 -0.026 1.00 . A A . 14 SER N 1 1
1 183 1 1 14 SER O O 2.831 10.322 -0.530 1.00 . A A . 14 SER O 1 1
1 184 1 1 15 GLY C C 0.203 7.954 1.469 1.00 . A A . 15 GLY C 1 1
1 185 1 1 15 GLY CA C 0.937 8.547 0.303 1.00 . A A . 15 GLY CA 1 1
1 186 1 1 15 GLY H H 2.669 7.661 1.099 1.00 . A A . 15 GLY H 1 1
1 187 1 1 15 GLY HA2 H 0.656 9.590 0.244 1.00 . A A . 15 GLY HA2 1 1
1 188 1 1 15 GLY HA3 H 0.705 7.982 -0.586 1.00 . A A . 15 GLY HA3 1 1
1 189 1 1 15 GLY N N 2.367 8.431 0.539 1.00 . A A . 15 GLY N 1 1
1 190 1 1 15 GLY O O 0.839 7.549 2.440 1.00 . A A . 15 GLY O 1 1
1 191 1 1 16 PRO C C -1.454 5.911 3.045 1.00 . A A . 16 PRO C 1 1
1 192 1 1 16 PRO CA C -1.955 7.234 2.442 1.00 . A A . 16 PRO CA 1 1
1 193 1 1 16 PRO CB C -3.327 7.100 1.764 1.00 . A A . 16 PRO CB 1 1
1 194 1 1 16 PRO CD C -1.918 8.533 0.377 1.00 . A A . 16 PRO CD 1 1
1 195 1 1 16 PRO CG C -3.381 8.203 0.691 1.00 . A A . 16 PRO CG 1 1
1 196 1 1 16 PRO HA H -1.981 7.928 3.268 1.00 . A A . 16 PRO HA 1 1
1 197 1 1 16 PRO HB2 H -3.409 6.118 1.247 1.00 . A A . 16 PRO HB2 1 1
1 198 1 1 16 PRO HB3 H -4.161 7.190 2.485 1.00 . A A . 16 PRO HB3 1 1
1 199 1 1 16 PRO HD2 H -1.642 8.134 -0.628 1.00 . A A . 16 PRO HD2 1 1
1 200 1 1 16 PRO HD3 H -1.758 9.635 0.391 1.00 . A A . 16 PRO HD3 1 1
1 201 1 1 16 PRO HG2 H -3.903 7.844 -0.227 1.00 . A A . 16 PRO HG2 1 1
1 202 1 1 16 PRO HG3 H -3.904 9.106 1.066 1.00 . A A . 16 PRO HG3 1 1
1 203 1 1 16 PRO N N -1.123 7.885 1.429 1.00 . A A . 16 PRO N 1 1
1 204 1 1 16 PRO O O -1.066 4.999 2.328 1.00 . A A . 16 PRO O 1 1
1 205 1 1 17 THR C C -2.018 3.643 5.534 1.00 . A A . 17 THR C 1 1
1 206 1 1 17 THR CA C -0.921 4.578 5.050 1.00 . A A . 17 THR CA 1 1
1 207 1 1 17 THR CB C 0.077 5.036 6.125 1.00 . A A . 17 THR CB 1 1
1 208 1 1 17 THR CG2 C -0.568 6.089 7.036 1.00 . A A . 17 THR CG2 1 1
1 209 1 1 17 THR H H -1.814 6.475 4.966 1.00 . A A . 17 THR H 1 1
1 210 1 1 17 THR HA H -0.362 3.988 4.345 1.00 . A A . 17 THR HA 1 1
1 211 1 1 17 THR HB H 0.948 5.494 5.598 1.00 . A A . 17 THR HB 1 1
1 212 1 1 17 THR HG1 H 1.376 3.678 6.615 1.00 . A A . 17 THR HG1 1 1
1 213 1 1 17 THR HG21 H -1.409 5.637 7.604 1.00 . A A . 17 THR HG21 1 1
1 214 1 1 17 THR HG22 H -0.920 6.978 6.481 1.00 . A A . 17 THR HG22 1 1
1 215 1 1 17 THR HG23 H 0.191 6.438 7.770 1.00 . A A . 17 THR HG23 1 1
1 216 1 1 17 THR N N -1.507 5.743 4.371 1.00 . A A . 17 THR N 1 1
1 217 1 1 17 THR O O -1.864 2.737 6.341 1.00 . A A . 17 THR O 1 1
1 218 1 1 17 THR OG1 O 0.563 4.024 6.994 1.00 . A A . 17 THR OG1 1 1
1 219 1 1 18 VAL C C -4.894 2.399 4.136 1.00 . A A . 18 VAL C 1 1
1 220 1 1 18 VAL CA C -4.386 3.061 5.380 1.00 . A A . 18 VAL CA 1 1
1 221 1 1 18 VAL CB C -5.483 3.937 5.982 1.00 . A A . 18 VAL CB 1 1
1 222 1 1 18 VAL CG1 C -6.670 3.088 6.486 1.00 . A A . 18 VAL CG1 1 1
1 223 1 1 18 VAL CG2 C -4.879 4.709 7.168 1.00 . A A . 18 VAL CG2 1 1
1 224 1 1 18 VAL H H -3.308 4.475 4.238 1.00 . A A . 18 VAL H 1 1
1 225 1 1 18 VAL HA H -4.124 2.282 6.084 1.00 . A A . 18 VAL HA 1 1
1 226 1 1 18 VAL HB H -5.843 4.670 5.226 1.00 . A A . 18 VAL HB 1 1
1 227 1 1 18 VAL HG11 H -6.480 2.741 7.524 1.00 . A A . 18 VAL HG11 1 1
1 228 1 1 18 VAL HG12 H -6.857 2.186 5.871 1.00 . A A . 18 VAL HG12 1 1
1 229 1 1 18 VAL HG13 H -7.604 3.689 6.494 1.00 . A A . 18 VAL HG13 1 1
1 230 1 1 18 VAL HG21 H -4.385 3.991 7.862 1.00 . A A . 18 VAL HG21 1 1
1 231 1 1 18 VAL HG22 H -5.669 5.246 7.732 1.00 . A A . 18 VAL HG22 1 1
1 232 1 1 18 VAL HG23 H -4.115 5.442 6.840 1.00 . A A . 18 VAL HG23 1 1
1 233 1 1 18 VAL N N -3.225 3.829 4.985 1.00 . A A . 18 VAL N 1 1
1 234 1 1 18 VAL O O -5.146 3.052 3.128 1.00 . A A . 18 VAL O 1 1
1 235 1 1 19 CYS C C -7.216 0.558 3.074 1.00 . A A . 19 CYS C 1 1
1 236 1 1 19 CYS CA C -5.719 0.395 3.048 1.00 . A A . 19 CYS CA 1 1
1 237 1 1 19 CYS CB C -5.290 -1.066 3.061 1.00 . A A . 19 CYS CB 1 1
1 238 1 1 19 CYS H H -4.854 0.535 4.946 1.00 . A A . 19 CYS H 1 1
1 239 1 1 19 CYS HA H -5.408 0.845 2.118 1.00 . A A . 19 CYS HA 1 1
1 240 1 1 19 CYS HB2 H -5.431 -1.480 4.084 1.00 . A A . 19 CYS HB2 1 1
1 241 1 1 19 CYS HB3 H -5.875 -1.703 2.386 1.00 . A A . 19 CYS HB3 1 1
1 242 1 1 19 CYS N N -5.078 1.083 4.144 1.00 . A A . 19 CYS N 1 1
1 243 1 1 19 CYS O O -7.812 0.701 4.133 1.00 . A A . 19 CYS O 1 1
1 244 1 1 19 CYS SG S -3.559 -1.150 2.577 1.00 . A A . 19 CYS SG 1 1
1 245 1 1 20 ALA C C -10.078 -0.195 2.509 1.00 . A A . 20 ALA C 1 1
1 246 1 1 20 ALA CA C -9.261 0.685 1.611 1.00 . A A . 20 ALA CA 1 1
1 247 1 1 20 ALA CB C -9.564 0.310 0.132 1.00 . A A . 20 ALA CB 1 1
1 248 1 1 20 ALA H H -7.292 0.484 1.051 1.00 . A A . 20 ALA H 1 1
1 249 1 1 20 ALA HA H -9.601 1.677 1.832 1.00 . A A . 20 ALA HA 1 1
1 250 1 1 20 ALA HB1 H -10.584 0.629 -0.165 1.00 . A A . 20 ALA HB1 1 1
1 251 1 1 20 ALA HB2 H -9.488 -0.788 -0.021 1.00 . A A . 20 ALA HB2 1 1
1 252 1 1 20 ALA HB3 H -8.827 0.784 -0.547 1.00 . A A . 20 ALA HB3 1 1
1 253 1 1 20 ALA N N -7.833 0.652 1.870 1.00 . A A . 20 ALA N 1 1
1 254 1 1 20 ALA O O -9.622 -1.217 2.964 1.00 . A A . 20 ALA O 1 1
1 255 1 1 21 SER C C -12.427 -2.114 3.069 1.00 . A A . 21 SER C 1 1
1 256 1 1 21 SER CA C -12.128 -0.734 3.658 1.00 . A A . 21 SER CA 1 1
1 257 1 1 21 SER CB C -13.467 -0.041 3.984 1.00 . A A . 21 SER CB 1 1
1 258 1 1 21 SER H H -11.767 0.988 2.559 1.00 . A A . 21 SER H 1 1
1 259 1 1 21 SER HA H -11.559 -0.881 4.570 1.00 . A A . 21 SER HA 1 1
1 260 1 1 21 SER HB2 H -14.197 -0.208 3.160 1.00 . A A . 21 SER HB2 1 1
1 261 1 1 21 SER HB3 H -13.876 -0.481 4.924 1.00 . A A . 21 SER HB3 1 1
1 262 1 1 21 SER HG H -14.095 1.737 4.471 1.00 . A A . 21 SER HG 1 1
1 263 1 1 21 SER N N -11.345 0.111 2.764 1.00 . A A . 21 SER N 1 1
1 264 1 1 21 SER O O -12.908 -3.010 3.749 1.00 . A A . 21 SER O 1 1
1 265 1 1 21 SER OG O -13.272 1.372 4.125 1.00 . A A . 21 SER OG 1 1
1 266 1 1 22 GLY C C -10.719 -4.122 0.866 1.00 . A A . 22 GLY C 1 1
1 267 1 1 22 GLY CA C -12.103 -3.553 1.051 1.00 . A A . 22 GLY CA 1 1
1 268 1 1 22 GLY H H -11.743 -1.498 1.296 1.00 . A A . 22 GLY H 1 1
1 269 1 1 22 GLY HA2 H -12.686 -4.291 1.583 1.00 . A A . 22 GLY HA2 1 1
1 270 1 1 22 GLY HA3 H -12.474 -3.366 0.056 1.00 . A A . 22 GLY HA3 1 1
1 271 1 1 22 GLY N N -12.124 -2.284 1.764 1.00 . A A . 22 GLY N 1 1
1 272 1 1 22 GLY O O -10.586 -5.195 0.294 1.00 . A A . 22 GLY O 1 1
1 273 1 1 23 THR C C -7.575 -3.790 2.517 1.00 . A A . 23 THR C 1 1
1 274 1 1 23 THR CA C -8.268 -3.817 1.150 1.00 . A A . 23 THR CA 1 1
1 275 1 1 23 THR CB C -7.413 -3.009 0.145 1.00 . A A . 23 THR CB 1 1
1 276 1 1 23 THR CG2 C -8.009 -2.968 -1.264 1.00 . A A . 23 THR CG2 1 1
1 277 1 1 23 THR H H -9.774 -2.582 1.858 1.00 . A A . 23 THR H 1 1
1 278 1 1 23 THR HA H -8.269 -4.843 0.828 1.00 . A A . 23 THR HA 1 1
1 279 1 1 23 THR HB H -6.410 -3.476 0.092 1.00 . A A . 23 THR HB 1 1
1 280 1 1 23 THR HG1 H -6.367 -1.414 0.089 1.00 . A A . 23 THR HG1 1 1
1 281 1 1 23 THR HG21 H -9.111 -2.883 -1.226 1.00 . A A . 23 THR HG21 1 1
1 282 1 1 23 THR HG22 H -7.739 -3.895 -1.805 1.00 . A A . 23 THR HG22 1 1
1 283 1 1 23 THR HG23 H -7.621 -2.093 -1.825 1.00 . A A . 23 THR HG23 1 1
1 284 1 1 23 THR N N -9.660 -3.400 1.290 1.00 . A A . 23 THR N 1 1
1 285 1 1 23 THR O O -8.027 -3.199 3.488 1.00 . A A . 23 THR O 1 1
1 286 1 1 23 THR OG1 O -7.218 -1.648 0.467 1.00 . A A . 23 THR OG1 1 1
1 287 1 1 24 THR C C -4.238 -4.262 3.772 1.00 . A A . 24 THR C 1 1
1 288 1 1 24 THR CA C -5.722 -4.510 3.966 1.00 . A A . 24 THR CA 1 1
1 289 1 1 24 THR CB C -5.925 -5.823 4.719 1.00 . A A . 24 THR CB 1 1
1 290 1 1 24 THR CG2 C -7.344 -5.896 5.303 1.00 . A A . 24 THR CG2 1 1
1 291 1 1 24 THR H H -6.167 -5.120 1.969 1.00 . A A . 24 THR H 1 1
1 292 1 1 24 THR HA H -6.065 -3.712 4.608 1.00 . A A . 24 THR HA 1 1
1 293 1 1 24 THR HB H -5.202 -5.930 5.563 1.00 . A A . 24 THR HB 1 1
1 294 1 1 24 THR HG1 H -6.442 -6.825 3.141 1.00 . A A . 24 THR HG1 1 1
1 295 1 1 24 THR HG21 H -7.431 -5.262 6.209 1.00 . A A . 24 THR HG21 1 1
1 296 1 1 24 THR HG22 H -7.600 -6.941 5.578 1.00 . A A . 24 THR HG22 1 1
1 297 1 1 24 THR HG23 H -8.099 -5.550 4.567 1.00 . A A . 24 THR HG23 1 1
1 298 1 1 24 THR N N -6.424 -4.452 2.681 1.00 . A A . 24 THR N 1 1
1 299 1 1 24 THR O O -3.667 -4.567 2.729 1.00 . A A . 24 THR O 1 1
1 300 1 1 24 THR OG1 O -5.787 -6.940 3.857 1.00 . A A . 24 THR OG1 1 1
1 301 1 1 25 CYS C C -1.300 -4.596 4.852 1.00 . A A . 25 CYS C 1 1
1 302 1 1 25 CYS CA C -2.125 -3.342 4.668 1.00 . A A . 25 CYS CA 1 1
1 303 1 1 25 CYS CB C -1.648 -2.327 5.750 1.00 . A A . 25 CYS CB 1 1
1 304 1 1 25 CYS H H -4.003 -3.381 5.608 1.00 . A A . 25 CYS H 1 1
1 305 1 1 25 CYS HA H -1.889 -2.963 3.683 1.00 . A A . 25 CYS HA 1 1
1 306 1 1 25 CYS HB2 H -2.103 -2.620 6.722 1.00 . A A . 25 CYS HB2 1 1
1 307 1 1 25 CYS HB3 H -0.546 -2.394 5.885 1.00 . A A . 25 CYS HB3 1 1
1 308 1 1 25 CYS N N -3.556 -3.631 4.757 1.00 . A A . 25 CYS N 1 1
1 309 1 1 25 CYS O O -1.279 -5.182 5.932 1.00 . A A . 25 CYS O 1 1
1 310 1 1 25 CYS SG S -2.021 -0.578 5.421 1.00 . A A . 25 CYS SG 1 1
1 311 1 1 26 GLN C C 1.539 -5.986 3.183 1.00 . A A . 26 GLN C 1 1
1 312 1 1 26 GLN CA C 0.231 -6.224 3.904 1.00 . A A . 26 GLN CA 1 1
1 313 1 1 26 GLN CB C -0.472 -7.478 3.326 1.00 . A A . 26 GLN CB 1 1
1 314 1 1 26 GLN CD C -2.587 -8.889 3.189 1.00 . A A . 26 GLN CD 1 1
1 315 1 1 26 GLN CG C -1.938 -7.648 3.802 1.00 . A A . 26 GLN CG 1 1
1 316 1 1 26 GLN H H -0.628 -4.579 2.911 1.00 . A A . 26 GLN H 1 1
1 317 1 1 26 GLN HA H 0.483 -6.410 4.940 1.00 . A A . 26 GLN HA 1 1
1 318 1 1 26 GLN HB2 H -0.462 -7.429 2.219 1.00 . A A . 26 GLN HB2 1 1
1 319 1 1 26 GLN HB3 H 0.106 -8.387 3.605 1.00 . A A . 26 GLN HB3 1 1
1 320 1 1 26 GLN HE21 H -4.470 -8.154 3.539 1.00 . A A . 26 GLN HE21 1 1
1 321 1 1 26 GLN HE22 H -4.378 -9.701 2.756 1.00 . A A . 26 GLN HE22 1 1
1 322 1 1 26 GLN HG2 H -1.968 -7.743 4.907 1.00 . A A . 26 GLN HG2 1 1
1 323 1 1 26 GLN HG3 H -2.543 -6.765 3.507 1.00 . A A . 26 GLN HG3 1 1
1 324 1 1 26 GLN N N -0.578 -5.031 3.808 1.00 . A A . 26 GLN N 1 1
1 325 1 1 26 GLN NE2 N -3.934 -8.946 3.223 1.00 . A A . 26 GLN NE2 1 1
1 326 1 1 26 GLN O O 1.727 -5.038 2.423 1.00 . A A . 26 GLN O 1 1
1 327 1 1 26 GLN OE1 O -1.921 -9.792 2.685 1.00 . A A . 26 GLN OE1 1 1
1 328 1 1 27 VAL C C 3.996 -7.572 1.632 1.00 . A A . 27 VAL C 1 1
1 329 1 1 27 VAL CA C 3.847 -6.694 2.855 1.00 . A A . 27 VAL CA 1 1
1 330 1 1 27 VAL CB C 4.928 -6.975 3.891 1.00 . A A . 27 VAL CB 1 1
1 331 1 1 27 VAL CG1 C 6.315 -7.141 3.242 1.00 . A A . 27 VAL CG1 1 1
1 332 1 1 27 VAL CG2 C 4.944 -5.802 4.889 1.00 . A A . 27 VAL CG2 1 1
1 333 1 1 27 VAL H H 2.378 -7.646 3.997 1.00 . A A . 27 VAL H 1 1
1 334 1 1 27 VAL HA H 3.994 -5.679 2.519 1.00 . A A . 27 VAL HA 1 1
1 335 1 1 27 VAL HB H 4.679 -7.917 4.437 1.00 . A A . 27 VAL HB 1 1
1 336 1 1 27 VAL HG11 H 6.377 -8.098 2.676 1.00 . A A . 27 VAL HG11 1 1
1 337 1 1 27 VAL HG12 H 7.105 -7.157 4.020 1.00 . A A . 27 VAL HG12 1 1
1 338 1 1 27 VAL HG13 H 6.517 -6.297 2.554 1.00 . A A . 27 VAL HG13 1 1
1 339 1 1 27 VAL HG21 H 5.746 -5.950 5.642 1.00 . A A . 27 VAL HG21 1 1
1 340 1 1 27 VAL HG22 H 3.975 -5.716 5.426 1.00 . A A . 27 VAL HG22 1 1
1 341 1 1 27 VAL HG23 H 5.139 -4.847 4.364 1.00 . A A . 27 VAL HG23 1 1
1 342 1 1 27 VAL N N 2.531 -6.840 3.435 1.00 . A A . 27 VAL N 1 1
1 343 1 1 27 VAL O O 3.734 -8.767 1.672 1.00 . A A . 27 VAL O 1 1
1 344 1 1 28 LEU C C 6.363 -7.931 -0.664 1.00 . A A . 28 LEU C 1 1
1 345 1 1 28 LEU CA C 4.842 -7.759 -0.661 1.00 . A A . 28 LEU CA 1 1
1 346 1 1 28 LEU CB C 4.273 -7.019 -1.915 1.00 . A A . 28 LEU CB 1 1
1 347 1 1 28 LEU CD1 C 4.865 -8.976 -3.483 1.00 . A A . 28 LEU CD1 1 1
1 348 1 1 28 LEU CD2 C 3.850 -6.866 -4.431 1.00 . A A . 28 LEU CD2 1 1
1 349 1 1 28 LEU CG C 4.747 -7.455 -3.326 1.00 . A A . 28 LEU CG 1 1
1 350 1 1 28 LEU H H 4.572 -6.002 0.443 1.00 . A A . 28 LEU H 1 1
1 351 1 1 28 LEU HA H 4.420 -8.757 -0.625 1.00 . A A . 28 LEU HA 1 1
1 352 1 1 28 LEU HB2 H 3.170 -7.180 -1.876 1.00 . A A . 28 LEU HB2 1 1
1 353 1 1 28 LEU HB3 H 4.433 -5.928 -1.801 1.00 . A A . 28 LEU HB3 1 1
1 354 1 1 28 LEU HD11 H 5.908 -9.293 -3.265 1.00 . A A . 28 LEU HD11 1 1
1 355 1 1 28 LEU HD12 H 4.644 -9.290 -4.523 1.00 . A A . 28 LEU HD12 1 1
1 356 1 1 28 LEU HD13 H 4.178 -9.505 -2.793 1.00 . A A . 28 LEU HD13 1 1
1 357 1 1 28 LEU HD21 H 4.258 -5.900 -4.790 1.00 . A A . 28 LEU HD21 1 1
1 358 1 1 28 LEU HD22 H 2.812 -6.714 -4.068 1.00 . A A . 28 LEU HD22 1 1
1 359 1 1 28 LEU HD23 H 3.811 -7.538 -5.313 1.00 . A A . 28 LEU HD23 1 1
1 360 1 1 28 LEU HG H 5.770 -7.058 -3.516 1.00 . A A . 28 LEU HG 1 1
1 361 1 1 28 LEU N N 4.448 -6.989 0.504 1.00 . A A . 28 LEU N 1 1
1 362 1 1 28 LEU O O 6.936 -8.911 -1.116 1.00 . A A . 28 LEU O 1 1
1 363 1 1 29 ASN C C 8.997 -5.878 0.839 1.00 . A A . 29 ASN C 1 1
1 364 1 1 29 ASN CA C 8.532 -6.890 -0.189 1.00 . A A . 29 ASN CA 1 1
1 365 1 1 29 ASN CB C 9.144 -6.522 -1.597 1.00 . A A . 29 ASN CB 1 1
1 366 1 1 29 ASN CG C 8.193 -6.041 -2.701 1.00 . A A . 29 ASN CG 1 1
1 367 1 1 29 ASN H H 6.635 -6.209 0.390 1.00 . A A . 29 ASN H 1 1
1 368 1 1 29 ASN HA H 8.910 -7.855 0.124 1.00 . A A . 29 ASN HA 1 1
1 369 1 1 29 ASN HB2 H 9.930 -5.743 -1.542 1.00 . A A . 29 ASN HB2 1 1
1 370 1 1 29 ASN HB3 H 9.616 -7.442 -2.008 1.00 . A A . 29 ASN HB3 1 1
1 371 1 1 29 ASN HD21 H 6.954 -5.127 -1.356 1.00 . A A . 29 ASN HD21 1 1
1 372 1 1 29 ASN HD22 H 6.487 -5.095 -3.032 1.00 . A A . 29 ASN HD22 1 1
1 373 1 1 29 ASN N N 7.090 -6.954 -0.093 1.00 . A A . 29 ASN N 1 1
1 374 1 1 29 ASN ND2 N 7.178 -5.279 -2.330 1.00 . A A . 29 ASN ND2 1 1
1 375 1 1 29 ASN O O 8.188 -5.045 1.252 1.00 . A A . 29 ASN O 1 1
1 376 1 1 29 ASN OD1 O 8.373 -6.339 -3.859 1.00 . A A . 29 ASN OD1 1 1
1 377 1 1 30 PRO C C 10.805 -3.473 1.799 1.00 . A A . 30 PRO C 1 1
1 378 1 1 30 PRO CA C 10.721 -4.915 2.283 1.00 . A A . 30 PRO CA 1 1
1 379 1 1 30 PRO CB C 12.109 -5.474 2.679 1.00 . A A . 30 PRO CB 1 1
1 380 1 1 30 PRO CD C 11.303 -6.760 0.780 1.00 . A A . 30 PRO CD 1 1
1 381 1 1 30 PRO CG C 12.575 -6.395 1.538 1.00 . A A . 30 PRO CG 1 1
1 382 1 1 30 PRO HA H 10.024 -4.920 3.110 1.00 . A A . 30 PRO HA 1 1
1 383 1 1 30 PRO HB2 H 12.859 -4.680 2.885 1.00 . A A . 30 PRO HB2 1 1
1 384 1 1 30 PRO HB3 H 11.994 -6.081 3.604 1.00 . A A . 30 PRO HB3 1 1
1 385 1 1 30 PRO HD2 H 11.483 -6.634 -0.312 1.00 . A A . 30 PRO HD2 1 1
1 386 1 1 30 PRO HD3 H 11.001 -7.811 0.989 1.00 . A A . 30 PRO HD3 1 1
1 387 1 1 30 PRO HG2 H 13.278 -5.861 0.864 1.00 . A A . 30 PRO HG2 1 1
1 388 1 1 30 PRO HG3 H 13.085 -7.303 1.925 1.00 . A A . 30 PRO HG3 1 1
1 389 1 1 30 PRO N N 10.262 -5.834 1.242 1.00 . A A . 30 PRO N 1 1
1 390 1 1 30 PRO O O 11.216 -2.618 2.568 1.00 . A A . 30 PRO O 1 1
1 391 1 1 31 TYR C C 9.109 -1.453 -0.599 1.00 . A A . 31 TYR C 1 1
1 392 1 1 31 TYR CA C 10.469 -1.851 -0.044 1.00 . A A . 31 TYR CA 1 1
1 393 1 1 31 TYR CB C 11.564 -1.774 -1.158 1.00 . A A . 31 TYR CB 1 1
1 394 1 1 31 TYR CD1 C 13.458 -3.027 -0.017 1.00 . A A . 31 TYR CD1 1 1
1 395 1 1 31 TYR CD2 C 13.752 -0.676 -0.474 1.00 . A A . 31 TYR CD2 1 1
1 396 1 1 31 TYR CE1 C 14.659 -3.046 0.706 1.00 . A A . 31 TYR CE1 1 1
1 397 1 1 31 TYR CE2 C 14.973 -0.698 0.220 1.00 . A A . 31 TYR CE2 1 1
1 398 1 1 31 TYR CG C 12.950 -1.829 -0.549 1.00 . A A . 31 TYR CG 1 1
1 399 1 1 31 TYR CZ C 15.407 -1.874 0.835 1.00 . A A . 31 TYR CZ 1 1
1 400 1 1 31 TYR H H 10.070 -3.912 -0.022 1.00 . A A . 31 TYR H 1 1
1 401 1 1 31 TYR HA H 10.680 -1.117 0.721 1.00 . A A . 31 TYR HA 1 1
1 402 1 1 31 TYR HB2 H 11.461 -2.620 -1.869 1.00 . A A . 31 TYR HB2 1 1
1 403 1 1 31 TYR HB3 H 11.479 -0.824 -1.730 1.00 . A A . 31 TYR HB3 1 1
1 404 1 1 31 TYR HD1 H 12.878 -3.928 -0.107 1.00 . A A . 31 TYR HD1 1 1
1 405 1 1 31 TYR HD2 H 13.401 0.255 -0.893 1.00 . A A . 31 TYR HD2 1 1
1 406 1 1 31 TYR HE1 H 14.994 -3.960 1.172 1.00 . A A . 31 TYR HE1 1 1
1 407 1 1 31 TYR HE2 H 15.564 0.200 0.319 1.00 . A A . 31 TYR HE2 1 1
1 408 1 1 31 TYR HH H 16.667 -2.704 2.041 1.00 . A A . 31 TYR HH 1 1
1 409 1 1 31 TYR N N 10.408 -3.176 0.547 1.00 . A A . 31 TYR N 1 1
1 410 1 1 31 TYR O O 8.916 -0.343 -1.089 1.00 . A A . 31 TYR O 1 1
1 411 1 1 31 TYR OH O 16.594 -1.862 1.589 1.00 . A A . 31 TYR OH 1 1
1 412 1 1 32 TYR C C 5.740 -2.901 -0.227 1.00 . A A . 32 TYR C 1 1
1 413 1 1 32 TYR CA C 6.784 -2.105 -1.016 1.00 . A A . 32 TYR CA 1 1
1 414 1 1 32 TYR CB C 6.739 -2.173 -2.589 1.00 . A A . 32 TYR CB 1 1
1 415 1 1 32 TYR CD1 C 4.705 -1.041 -3.487 1.00 . A A . 32 TYR CD1 1 1
1 416 1 1 32 TYR CD2 C 4.676 -3.445 -3.468 1.00 . A A . 32 TYR CD2 1 1
1 417 1 1 32 TYR CE1 C 3.389 -1.018 -3.961 1.00 . A A . 32 TYR CE1 1 1
1 418 1 1 32 TYR CE2 C 3.372 -3.429 -3.971 1.00 . A A . 32 TYR CE2 1 1
1 419 1 1 32 TYR CG C 5.347 -2.243 -3.172 1.00 . A A . 32 TYR CG 1 1
1 420 1 1 32 TYR CZ C 2.726 -2.221 -4.187 1.00 . A A . 32 TYR CZ 1 1
1 421 1 1 32 TYR H H 8.222 -3.162 0.080 1.00 . A A . 32 TYR H 1 1
1 422 1 1 32 TYR HA H 6.535 -1.082 -0.788 1.00 . A A . 32 TYR HA 1 1
1 423 1 1 32 TYR HB2 H 7.241 -1.266 -2.992 1.00 . A A . 32 TYR HB2 1 1
1 424 1 1 32 TYR HB3 H 7.335 -3.004 -2.997 1.00 . A A . 32 TYR HB3 1 1
1 425 1 1 32 TYR HD1 H 5.251 -0.124 -3.381 1.00 . A A . 32 TYR HD1 1 1
1 426 1 1 32 TYR HD2 H 5.132 -4.401 -3.327 1.00 . A A . 32 TYR HD2 1 1
1 427 1 1 32 TYR HE1 H 2.903 -0.081 -4.164 1.00 . A A . 32 TYR HE1 1 1
1 428 1 1 32 TYR HE2 H 2.851 -4.348 -4.192 1.00 . A A . 32 TYR HE2 1 1
1 429 1 1 32 TYR HH H 1.195 -1.401 -5.040 1.00 . A A . 32 TYR HH 1 1
1 430 1 1 32 TYR N N 8.105 -2.339 -0.474 1.00 . A A . 32 TYR N 1 1
1 431 1 1 32 TYR O O 5.700 -4.133 -0.213 1.00 . A A . 32 TYR O 1 1
1 432 1 1 32 TYR OH O 1.417 -2.258 -4.665 1.00 . A A . 32 TYR OH 1 1
1 433 1 1 33 SER C C 2.518 -2.352 0.537 1.00 . A A . 33 SER C 1 1
1 434 1 1 33 SER CA C 3.769 -2.747 1.253 1.00 . A A . 33 SER CA 1 1
1 435 1 1 33 SER CB C 3.637 -2.236 2.703 1.00 . A A . 33 SER CB 1 1
1 436 1 1 33 SER H H 4.943 -1.189 0.584 1.00 . A A . 33 SER H 1 1
1 437 1 1 33 SER HA H 3.828 -3.825 1.263 1.00 . A A . 33 SER HA 1 1
1 438 1 1 33 SER HB2 H 3.396 -1.155 2.712 1.00 . A A . 33 SER HB2 1 1
1 439 1 1 33 SER HB3 H 2.812 -2.762 3.237 1.00 . A A . 33 SER HB3 1 1
1 440 1 1 33 SER HG H 5.074 -3.349 3.381 1.00 . A A . 33 SER HG 1 1
1 441 1 1 33 SER N N 4.872 -2.188 0.504 1.00 . A A . 33 SER N 1 1
1 442 1 1 33 SER O O 2.263 -1.187 0.239 1.00 . A A . 33 SER O 1 1
1 443 1 1 33 SER OG O 4.870 -2.409 3.394 1.00 . A A . 33 SER OG 1 1
1 444 1 1 34 GLN C C -0.683 -3.236 0.076 1.00 . A A . 34 GLN C 1 1
1 445 1 1 34 GLN CA C 0.625 -3.246 -0.690 1.00 . A A . 34 GLN CA 1 1
1 446 1 1 34 GLN CB C 0.730 -4.426 -1.680 1.00 . A A . 34 GLN CB 1 1
1 447 1 1 34 GLN CD C -0.021 -5.433 -3.884 1.00 . A A . 34 GLN CD 1 1
1 448 1 1 34 GLN CG C -0.335 -4.416 -2.789 1.00 . A A . 34 GLN CG 1 1
1 449 1 1 34 GLN H H 1.812 -4.241 0.675 1.00 . A A . 34 GLN H 1 1
1 450 1 1 34 GLN HA H 0.698 -2.322 -1.245 1.00 . A A . 34 GLN HA 1 1
1 451 1 1 34 GLN HB2 H 1.737 -4.348 -2.148 1.00 . A A . 34 GLN HB2 1 1
1 452 1 1 34 GLN HB3 H 0.707 -5.394 -1.134 1.00 . A A . 34 GLN HB3 1 1
1 453 1 1 34 GLN HE21 H 0.410 -3.968 -5.228 1.00 . A A . 34 GLN HE21 1 1
1 454 1 1 34 GLN HE22 H 0.429 -5.620 -5.825 1.00 . A A . 34 GLN HE22 1 1
1 455 1 1 34 GLN HG2 H -1.324 -4.679 -2.365 1.00 . A A . 34 GLN HG2 1 1
1 456 1 1 34 GLN HG3 H -0.397 -3.395 -3.217 1.00 . A A . 34 GLN HG3 1 1
1 457 1 1 34 GLN N N 1.714 -3.353 0.223 1.00 . A A . 34 GLN N 1 1
1 458 1 1 34 GLN NE2 N 0.241 -4.950 -5.114 1.00 . A A . 34 GLN NE2 1 1
1 459 1 1 34 GLN O O -0.771 -3.654 1.228 1.00 . A A . 34 GLN O 1 1
1 460 1 1 34 GLN OE1 O -0.028 -6.642 -3.675 1.00 . A A . 34 GLN OE1 1 1
1 461 1 1 35 CYS C C -3.895 -3.905 -0.731 1.00 . A A . 35 CYS C 1 1
1 462 1 1 35 CYS CA C -3.096 -2.808 -0.068 1.00 . A A . 35 CYS CA 1 1
1 463 1 1 35 CYS CB C -3.817 -1.481 -0.366 1.00 . A A . 35 CYS CB 1 1
1 464 1 1 35 CYS H H -1.578 -2.218 -1.409 1.00 . A A . 35 CYS H 1 1
1 465 1 1 35 CYS HA H -3.086 -3.053 0.980 1.00 . A A . 35 CYS HA 1 1
1 466 1 1 35 CYS HB2 H -3.511 -1.152 -1.381 1.00 . A A . 35 CYS HB2 1 1
1 467 1 1 35 CYS HB3 H -4.911 -1.601 -0.367 1.00 . A A . 35 CYS HB3 1 1
1 468 1 1 35 CYS N N -1.742 -2.724 -0.561 1.00 . A A . 35 CYS N 1 1
1 469 1 1 35 CYS O O -4.198 -3.832 -1.920 1.00 . A A . 35 CYS O 1 1
1 470 1 1 35 CYS SG S -3.398 -0.193 0.810 1.00 . A A . 35 CYS SG 1 1
1 471 1 1 36 LEU C C -6.370 -6.278 -0.123 1.00 . A A . 36 LEU C 1 1
1 472 1 1 36 LEU CA C -4.897 -6.129 -0.509 1.00 . A A . 36 LEU CA 1 1
1 473 1 1 36 LEU CB C -4.169 -7.388 -0.014 1.00 . A A . 36 LEU CB 1 1
1 474 1 1 36 LEU CD1 C -2.724 -7.373 -2.075 1.00 . A A . 36 LEU CD1 1 1
1 475 1 1 36 LEU CD2 C -1.750 -6.582 0.112 1.00 . A A . 36 LEU CD2 1 1
1 476 1 1 36 LEU CG C -2.739 -7.545 -0.552 1.00 . A A . 36 LEU CG 1 1
1 477 1 1 36 LEU H H -4.070 -4.976 1.008 1.00 . A A . 36 LEU H 1 1
1 478 1 1 36 LEU HA H -4.884 -6.099 -1.585 1.00 . A A . 36 LEU HA 1 1
1 479 1 1 36 LEU HB2 H -4.158 -7.377 1.097 1.00 . A A . 36 LEU HB2 1 1
1 480 1 1 36 LEU HB3 H -4.751 -8.285 -0.329 1.00 . A A . 36 LEU HB3 1 1
1 481 1 1 36 LEU HD11 H -3.582 -7.905 -2.535 1.00 . A A . 36 LEU HD11 1 1
1 482 1 1 36 LEU HD12 H -1.782 -7.774 -2.496 1.00 . A A . 36 LEU HD12 1 1
1 483 1 1 36 LEU HD13 H -2.802 -6.297 -2.338 1.00 . A A . 36 LEU HD13 1 1
1 484 1 1 36 LEU HD21 H -2.018 -6.431 1.180 1.00 . A A . 36 LEU HD21 1 1
1 485 1 1 36 LEU HD22 H -1.792 -5.595 -0.378 1.00 . A A . 36 LEU HD22 1 1
1 486 1 1 36 LEU HD23 H -0.710 -6.958 0.038 1.00 . A A . 36 LEU HD23 1 1
1 487 1 1 36 LEU HG H -2.417 -8.584 -0.295 1.00 . A A . 36 LEU HG 1 1
1 488 1 1 36 LEU N N -4.292 -4.930 0.027 1.00 . A A . 36 LEU N 1 1
1 489 1 1 36 LEU O O -6.663 -6.568 1.063 1.00 . A A . 36 LEU O 1 1
1 490 1 1 36 LEU OXT O -7.219 -6.107 -1.034 1.00 . A A . 36 LEU OXT 1 1
1 491 2 2 1 MAN C1 C -9.605 3.913 0.183 1.00 . B A . 101 MAN C1 1 1
1 492 2 2 1 MAN C2 C -8.766 4.386 -0.984 1.00 . B A . 101 MAN C2 1 1
1 493 2 2 1 MAN C3 C -8.882 5.880 -1.047 1.00 . B A . 101 MAN C3 1 1
1 494 2 2 1 MAN C4 C -10.315 6.267 -1.292 1.00 . B A . 101 MAN C4 1 1
1 495 2 2 1 MAN C5 C -11.221 5.598 -0.255 1.00 . B A . 101 MAN C5 1 1
1 496 2 2 1 MAN C6 C -12.683 5.780 -0.583 1.00 . B A . 101 MAN C6 1 1
1 497 2 2 1 MAN H1 H -9.505 2.824 0.230 1.00 . B A . 101 MAN H1 1 1
1 498 2 2 1 MAN H2 H -7.723 4.130 -0.779 1.00 . B A . 101 MAN H2 1 1
1 499 2 2 1 MAN H3 H -8.620 6.289 -0.050 1.00 . B A . 101 MAN H3 1 1
1 500 2 2 1 MAN H4 H -10.614 5.912 -2.307 1.00 . B A . 101 MAN H4 1 1
1 501 2 2 1 MAN H5 H -11.036 6.080 0.734 1.00 . B A . 101 MAN H5 1 1
1 502 2 2 1 MAN H61 H -12.917 5.288 -1.556 1.00 . B A . 101 MAN H61 1 1
1 503 2 2 1 MAN H62 H -12.915 6.865 -0.686 1.00 . B A . 101 MAN H62 1 1
1 504 2 2 1 MAN HO2 H -9.306 2.824 -2.094 1.00 . B A . 101 MAN HO2 1 1
1 505 2 2 1 MAN HO3 H -8.066 6.179 -2.843 1.00 . B A . 101 MAN HO3 1 1
1 506 2 2 1 MAN HO4 H -10.169 8.076 -2.038 1.00 . B A . 101 MAN HO4 1 1
1 507 2 2 1 MAN HO6 H -13.022 4.566 0.927 1.00 . B A . 101 MAN HO6 1 1
1 508 2 2 1 MAN O1 O -9.254 4.514 1.455 1.00 . B A . 101 MAN O1 1 1
1 509 2 2 1 MAN O2 O -9.101 3.754 -2.226 1.00 . B A . 101 MAN O2 1 1
1 510 2 2 1 MAN O3 O -7.943 6.477 -1.936 1.00 . B A . 101 MAN O3 1 1
1 511 2 2 1 MAN O4 O -10.483 7.676 -1.217 1.00 . B A . 101 MAN O4 1 1
1 512 2 2 1 MAN O5 O -10.971 4.185 -0.109 1.00 . B A . 101 MAN O5 1 1
1 513 2 2 1 MAN O6 O -13.511 5.244 0.450 1.00 . B A . 101 MAN O6 1 1
1 514 3 2 1 MAN C1 C -5.538 3.780 -6.461 1.00 . C A . 102 MAN C1 1 1
1 515 3 2 1 MAN C2 C -4.474 2.938 -7.139 1.00 . C A . 102 MAN C2 1 1
1 516 3 2 1 MAN C3 C -3.243 2.945 -6.261 1.00 . C A . 102 MAN C3 1 1
1 517 3 2 1 MAN C4 C -2.766 4.373 -6.045 1.00 . C A . 102 MAN C4 1 1
1 518 3 2 1 MAN C5 C -3.900 5.279 -5.547 1.00 . C A . 102 MAN C5 1 1
1 519 3 2 1 MAN C6 C -3.508 6.749 -5.534 1.00 . C A . 102 MAN C6 1 1
1 520 3 2 1 MAN H1 H -6.472 3.776 -7.068 1.00 . C A . 102 MAN H1 1 1
1 521 3 2 1 MAN H2 H -4.829 1.890 -7.234 1.00 . C A . 102 MAN H2 1 1
1 522 3 2 1 MAN H3 H -3.518 2.554 -5.252 1.00 . C A . 102 MAN H3 1 1
1 523 3 2 1 MAN H4 H -2.437 4.774 -7.035 1.00 . C A . 102 MAN H4 1 1
1 524 3 2 1 MAN H5 H -4.149 5.001 -4.497 1.00 . C A . 102 MAN H5 1 1
1 525 3 2 1 MAN H61 H -3.290 7.076 -6.577 1.00 . C A . 102 MAN H61 1 1
1 526 3 2 1 MAN H62 H -2.586 6.883 -4.923 1.00 . C A . 102 MAN H62 1 1
1 527 3 2 1 MAN HO2 H -3.509 2.798 -8.849 1.00 . C A . 102 MAN HO2 1 1
1 528 3 2 1 MAN HO3 H -2.400 1.165 -6.561 1.00 . C A . 102 MAN HO3 1 1
1 529 3 2 1 MAN HO4 H -0.869 4.663 -5.636 1.00 . C A . 102 MAN HO4 1 1
1 530 3 2 1 MAN HO6 H -4.330 8.512 -5.144 1.00 . C A . 102 MAN HO6 1 1
1 531 3 2 1 MAN O1 O -5.800 3.296 -5.128 1.00 . C A . 102 MAN O1 1 1
1 532 3 2 1 MAN O2 O -4.202 3.357 -8.476 1.00 . C A . 102 MAN O2 1 1
1 533 3 2 1 MAN O3 O -2.229 2.085 -6.792 1.00 . C A . 102 MAN O3 1 1
1 534 3 2 1 MAN O4 O -1.660 4.415 -5.142 1.00 . C A . 102 MAN O4 1 1
1 535 3 2 1 MAN O5 O -5.083 5.132 -6.363 1.00 . C A . 102 MAN O5 1 1
1 536 3 2 1 MAN O6 O -4.533 7.585 -4.983 1.00 . C A . 102 MAN O6 1 1
1 537 4 2 1 MAN C1 C 7.702 11.002 -0.772 1.00 . D A . 103 MAN C1 1 1
1 538 4 2 1 MAN C2 C 7.167 12.133 -1.633 1.00 . D A . 103 MAN C2 1 1
1 539 4 2 1 MAN C3 C 6.792 11.554 -2.991 1.00 . D A . 103 MAN C3 1 1
1 540 4 2 1 MAN C4 C 8.022 10.938 -3.627 1.00 . D A . 103 MAN C4 1 1
1 541 4 2 1 MAN C5 C 8.630 9.898 -2.686 1.00 . D A . 103 MAN C5 1 1
1 542 4 2 1 MAN C6 C 9.922 9.315 -3.237 1.00 . D A . 103 MAN C6 1 1
1 543 4 2 1 MAN H1 H 7.992 11.395 0.229 1.00 . D A . 103 MAN H1 1 1
1 544 4 2 1 MAN H2 H 6.255 12.567 -1.169 1.00 . D A . 103 MAN H2 1 1
1 545 4 2 1 MAN H3 H 6.063 10.721 -2.838 1.00 . D A . 103 MAN H3 1 1
1 546 4 2 1 MAN H4 H 8.777 11.744 -3.786 1.00 . D A . 103 MAN H4 1 1
1 547 4 2 1 MAN H5 H 7.906 9.055 -2.570 1.00 . D A . 103 MAN H5 1 1
1 548 4 2 1 MAN H61 H 10.644 10.138 -3.431 1.00 . D A . 103 MAN H61 1 1
1 549 4 2 1 MAN H62 H 9.722 8.804 -4.207 1.00 . D A . 103 MAN H62 1 1
1 550 4 2 1 MAN HO2 H 8.902 12.997 -1.243 1.00 . D A . 103 MAN HO2 1 1
1 551 4 2 1 MAN HO3 H 5.275 12.717 -3.516 1.00 . D A . 103 MAN HO3 1 1
1 552 4 2 1 MAN HO4 H 7.304 11.062 -5.416 1.00 . D A . 103 MAN HO4 1 1
1 553 4 2 1 MAN HO6 H 9.858 7.747 -2.037 1.00 . D A . 103 MAN HO6 1 1
1 554 4 2 1 MAN O1 O 6.735 9.964 -0.568 1.00 . D A . 103 MAN O1 1 1
1 555 4 2 1 MAN O2 O 8.086 13.227 -1.703 1.00 . D A . 103 MAN O2 1 1
1 556 4 2 1 MAN O3 O 6.153 12.506 -3.850 1.00 . D A . 103 MAN O3 1 1
1 557 4 2 1 MAN O4 O 7.720 10.364 -4.895 1.00 . D A . 103 MAN O4 1 1
1 558 4 2 1 MAN O5 O 8.885 10.483 -1.389 1.00 . D A . 103 MAN O5 1 1
1 559 4 2 1 MAN O6 O 10.531 8.380 -2.343 1.00 . D A . 103 MAN O6 1 1
2 560 1 1 1 THR C C -5.706 5.586 0.633 1.00 . A A . 1 THR C 1 1
2 561 1 1 1 THR CA C -6.628 5.669 1.811 1.00 . A A . 1 THR CA 1 1
2 562 1 1 1 THR CB C -7.680 4.524 1.786 1.00 . A A . 1 THR CB 1 1
2 563 1 1 1 THR CG2 C -8.125 4.263 3.213 1.00 . A A . 1 THR CG2 1 1
2 564 1 1 1 THR H1 H -6.889 7.662 1.207 1.00 . A A . 1 THR H1 1 1
2 565 1 1 1 THR H2 H -7.398 7.392 2.832 1.00 . A A . 1 THR H2 1 1
2 566 1 1 1 THR H3 H -8.323 6.809 1.535 1.00 . A A . 1 THR H3 1 1
2 567 1 1 1 THR HA H -6.004 5.581 2.684 1.00 . A A . 1 THR HA 1 1
2 568 1 1 1 THR HB H -7.295 3.579 1.343 1.00 . A A . 1 THR HB 1 1
2 569 1 1 1 THR HG21 H -7.261 3.852 3.776 1.00 . A A . 1 THR HG21 1 1
2 570 1 1 1 THR HG22 H -8.936 3.505 3.266 1.00 . A A . 1 THR HG22 1 1
2 571 1 1 1 THR HG23 H -8.469 5.171 3.740 1.00 . A A . 1 THR HG23 1 1
2 572 1 1 1 THR N N -7.349 7.000 1.874 1.00 . A A . 1 THR N 1 1
2 573 1 1 1 THR O O -5.551 6.602 -0.022 1.00 . A A . 1 THR O 1 1
2 574 1 1 2 GLN C C -4.998 3.558 -2.043 1.00 . A A . 2 GLN C 1 1
2 575 1 1 2 GLN CA C -4.289 4.222 -0.864 1.00 . A A . 2 GLN CA 1 1
2 576 1 1 2 GLN CB C -3.049 3.369 -0.542 1.00 . A A . 2 GLN CB 1 1
2 577 1 1 2 GLN CD C -1.632 4.826 -1.934 1.00 . A A . 2 GLN CD 1 1
2 578 1 1 2 GLN CG C -2.090 3.397 -1.745 1.00 . A A . 2 GLN CG 1 1
2 579 1 1 2 GLN H H -5.055 3.675 1.003 1.00 . A A . 2 GLN H 1 1
2 580 1 1 2 GLN HA H -3.993 5.196 -1.231 1.00 . A A . 2 GLN HA 1 1
2 581 1 1 2 GLN HB2 H -2.545 3.794 0.358 1.00 . A A . 2 GLN HB2 1 1
2 582 1 1 2 GLN HB3 H -3.298 2.327 -0.255 1.00 . A A . 2 GLN HB3 1 1
2 583 1 1 2 GLN HE21 H -0.403 4.631 -0.324 1.00 . A A . 2 GLN HE21 1 1
2 584 1 1 2 GLN HE22 H -0.653 6.258 -0.878 1.00 . A A . 2 GLN HE22 1 1
2 585 1 1 2 GLN HG2 H -1.247 2.733 -1.555 1.00 . A A . 2 GLN HG2 1 1
2 586 1 1 2 GLN HG3 H -2.535 3.090 -2.709 1.00 . A A . 2 GLN HG3 1 1
2 587 1 1 2 GLN N N -5.087 4.420 0.331 1.00 . A A . 2 GLN N 1 1
2 588 1 1 2 GLN NE2 N -0.815 5.280 -0.976 1.00 . A A . 2 GLN NE2 1 1
2 589 1 1 2 GLN O O -5.632 4.219 -2.853 1.00 . A A . 2 GLN O 1 1
2 590 1 1 2 GLN OE1 O -2.015 5.551 -2.844 1.00 . A A . 2 GLN OE1 1 1
2 591 1 1 3 SER C C -5.580 0.043 -2.895 1.00 . A A . 3 SER C 1 1
2 592 1 1 3 SER CA C -5.663 1.511 -3.188 1.00 . A A . 3 SER CA 1 1
2 593 1 1 3 SER CB C -5.244 1.747 -4.667 1.00 . A A . 3 SER CB 1 1
2 594 1 1 3 SER H H -4.306 1.660 -1.617 1.00 . A A . 3 SER H 1 1
2 595 1 1 3 SER HA H -6.678 1.796 -3.001 1.00 . A A . 3 SER HA 1 1
2 596 1 1 3 SER HB2 H -5.200 2.827 -4.918 1.00 . A A . 3 SER HB2 1 1
2 597 1 1 3 SER HB3 H -4.247 1.305 -4.884 1.00 . A A . 3 SER HB3 1 1
2 598 1 1 3 SER N N -4.892 2.224 -2.198 1.00 . A A . 3 SER N 1 1
2 599 1 1 3 SER O O -4.732 -0.365 -2.123 1.00 . A A . 3 SER O 1 1
2 600 1 1 4 HIS C C -5.189 -2.516 -4.450 1.00 . A A . 4 HIS C 1 1
2 601 1 1 4 HIS CA C -6.301 -2.237 -3.498 1.00 . A A . 4 HIS CA 1 1
2 602 1 1 4 HIS CB C -7.572 -2.962 -4.007 1.00 . A A . 4 HIS CB 1 1
2 603 1 1 4 HIS CD2 C -6.570 -5.187 -3.150 1.00 . A A . 4 HIS CD2 1 1
2 604 1 1 4 HIS CE1 C -8.154 -6.536 -3.833 1.00 . A A . 4 HIS CE1 1 1
2 605 1 1 4 HIS CG C -7.486 -4.451 -3.822 1.00 . A A . 4 HIS CG 1 1
2 606 1 1 4 HIS H H -7.016 -0.440 -4.221 1.00 . A A . 4 HIS H 1 1
2 607 1 1 4 HIS HA H -6.021 -2.575 -2.512 1.00 . A A . 4 HIS HA 1 1
2 608 1 1 4 HIS HB2 H -8.446 -2.595 -3.427 1.00 . A A . 4 HIS HB2 1 1
2 609 1 1 4 HIS HB3 H -7.767 -2.725 -5.077 1.00 . A A . 4 HIS HB3 1 1
2 610 1 1 4 HIS HD1 H -9.303 -5.061 -4.724 1.00 . A A . 4 HIS HD1 1 1
2 611 1 1 4 HIS HD2 H -5.652 -4.869 -2.664 1.00 . A A . 4 HIS HD2 1 1
2 612 1 1 4 HIS HE1 H -8.709 -7.438 -4.049 1.00 . A A . 4 HIS HE1 1 1
2 613 1 1 4 HIS HE2 H -6.593 -7.238 -2.660 1.00 . A A . 4 HIS HE2 1 1
2 614 1 1 4 HIS N N -6.422 -0.804 -3.509 1.00 . A A . 4 HIS N 1 1
2 615 1 1 4 HIS ND1 N -8.462 -5.313 -4.243 1.00 . A A . 4 HIS ND1 1 1
2 616 1 1 4 HIS NE2 N -7.017 -6.479 -3.161 1.00 . A A . 4 HIS NE2 1 1
2 617 1 1 4 HIS O O -5.324 -2.256 -5.636 1.00 . A A . 4 HIS O 1 1
2 618 1 1 5 TYR C C -2.079 -1.821 -4.817 1.00 . A A . 5 TYR C 1 1
2 619 1 1 5 TYR CA C -2.822 -3.136 -4.635 1.00 . A A . 5 TYR CA 1 1
2 620 1 1 5 TYR CB C -2.942 -3.858 -6.003 1.00 . A A . 5 TYR CB 1 1
2 621 1 1 5 TYR CD1 C -3.560 -6.134 -5.059 1.00 . A A . 5 TYR CD1 1 1
2 622 1 1 5 TYR CD2 C -5.002 -5.113 -6.708 1.00 . A A . 5 TYR CD2 1 1
2 623 1 1 5 TYR CE1 C -4.397 -7.257 -5.019 1.00 . A A . 5 TYR CE1 1 1
2 624 1 1 5 TYR CE2 C -5.865 -6.211 -6.638 1.00 . A A . 5 TYR CE2 1 1
2 625 1 1 5 TYR CG C -3.842 -5.061 -5.918 1.00 . A A . 5 TYR CG 1 1
2 626 1 1 5 TYR CZ C -5.549 -7.291 -5.811 1.00 . A A . 5 TYR CZ 1 1
2 627 1 1 5 TYR H H -4.025 -3.138 -2.913 1.00 . A A . 5 TYR H 1 1
2 628 1 1 5 TYR HA H -2.220 -3.744 -3.990 1.00 . A A . 5 TYR HA 1 1
2 629 1 1 5 TYR HB2 H -3.347 -3.155 -6.765 1.00 . A A . 5 TYR HB2 1 1
2 630 1 1 5 TYR HB3 H -1.949 -4.192 -6.364 1.00 . A A . 5 TYR HB3 1 1
2 631 1 1 5 TYR HD1 H -2.698 -6.106 -4.418 1.00 . A A . 5 TYR HD1 1 1
2 632 1 1 5 TYR HD2 H -5.238 -4.278 -7.355 1.00 . A A . 5 TYR HD2 1 1
2 633 1 1 5 TYR HE1 H -4.157 -8.073 -4.353 1.00 . A A . 5 TYR HE1 1 1
2 634 1 1 5 TYR HE2 H -6.764 -6.228 -7.234 1.00 . A A . 5 TYR HE2 1 1
2 635 1 1 5 TYR HH H -5.877 -9.167 -5.562 1.00 . A A . 5 TYR HH 1 1
2 636 1 1 5 TYR N N -4.055 -2.958 -3.904 1.00 . A A . 5 TYR N 1 1
2 637 1 1 5 TYR O O -1.161 -1.721 -5.622 1.00 . A A . 5 TYR O 1 1
2 638 1 1 5 TYR OH O -6.420 -8.392 -5.737 1.00 . A A . 5 TYR OH 1 1
2 639 1 1 6 GLY C C -0.708 0.257 -2.729 1.00 . A A . 6 GLY C 1 1
2 640 1 1 6 GLY CA C -1.614 0.413 -3.913 1.00 . A A . 6 GLY CA 1 1
2 641 1 1 6 GLY H H -3.226 -0.870 -3.437 1.00 . A A . 6 GLY H 1 1
2 642 1 1 6 GLY HA2 H -1.004 0.559 -4.796 1.00 . A A . 6 GLY HA2 1 1
2 643 1 1 6 GLY HA3 H -2.270 1.242 -3.716 1.00 . A A . 6 GLY HA3 1 1
2 644 1 1 6 GLY N N -2.436 -0.779 -4.042 1.00 . A A . 6 GLY N 1 1
2 645 1 1 6 GLY O O -0.914 -0.606 -1.883 1.00 . A A . 6 GLY O 1 1
2 646 1 1 7 GLN C C 0.902 1.900 -0.267 1.00 . A A . 7 GLN C 1 1
2 647 1 1 7 GLN CA C 1.233 1.052 -1.494 1.00 . A A . 7 GLN CA 1 1
2 648 1 1 7 GLN CB C 2.617 1.512 -1.980 1.00 . A A . 7 GLN CB 1 1
2 649 1 1 7 GLN CD C 4.988 1.102 -1.131 1.00 . A A . 7 GLN CD 1 1
2 650 1 1 7 GLN CG C 3.609 1.602 -0.814 1.00 . A A . 7 GLN CG 1 1
2 651 1 1 7 GLN H H 0.472 1.827 -3.282 1.00 . A A . 7 GLN H 1 1
2 652 1 1 7 GLN HA H 1.313 0.027 -1.163 1.00 . A A . 7 GLN HA 1 1
2 653 1 1 7 GLN HB2 H 2.965 0.821 -2.771 1.00 . A A . 7 GLN HB2 1 1
2 654 1 1 7 GLN HB3 H 2.520 2.509 -2.457 1.00 . A A . 7 GLN HB3 1 1
2 655 1 1 7 GLN HE21 H 5.124 1.879 -2.996 1.00 . A A . 7 GLN HE21 1 1
2 656 1 1 7 GLN HE22 H 6.483 0.925 -2.441 1.00 . A A . 7 GLN HE22 1 1
2 657 1 1 7 GLN HG2 H 3.638 2.584 -0.317 1.00 . A A . 7 GLN HG2 1 1
2 658 1 1 7 GLN HG3 H 3.288 0.872 -0.034 1.00 . A A . 7 GLN HG3 1 1
2 659 1 1 7 GLN N N 0.305 1.120 -2.602 1.00 . A A . 7 GLN N 1 1
2 660 1 1 7 GLN NE2 N 5.616 1.398 -2.281 1.00 . A A . 7 GLN NE2 1 1
2 661 1 1 7 GLN O O 0.674 3.094 -0.383 1.00 . A A . 7 GLN O 1 1
2 662 1 1 7 GLN OE1 O 5.449 0.334 -0.299 1.00 . A A . 7 GLN OE1 1 1
2 663 1 1 8 CYS C C 2.109 2.282 2.973 1.00 . A A . 8 CYS C 1 1
2 664 1 1 8 CYS CA C 0.829 2.175 2.156 1.00 . A A . 8 CYS CA 1 1
2 665 1 1 8 CYS CB C -0.302 1.640 3.064 1.00 . A A . 8 CYS CB 1 1
2 666 1 1 8 CYS H H 1.113 0.368 1.071 1.00 . A A . 8 CYS H 1 1
2 667 1 1 8 CYS HA H 0.581 3.196 1.903 1.00 . A A . 8 CYS HA 1 1
2 668 1 1 8 CYS HB2 H -0.465 2.341 3.909 1.00 . A A . 8 CYS HB2 1 1
2 669 1 1 8 CYS HB3 H -1.225 1.663 2.452 1.00 . A A . 8 CYS HB3 1 1
2 670 1 1 8 CYS N N 0.934 1.350 0.957 1.00 . A A . 8 CYS N 1 1
2 671 1 1 8 CYS O O 2.150 3.020 3.948 1.00 . A A . 8 CYS O 1 1
2 672 1 1 8 CYS SG S -0.007 -0.050 3.692 1.00 . A A . 8 CYS SG 1 1
2 673 1 1 9 GLY C C 5.616 1.106 2.659 1.00 . A A . 9 GLY C 1 1
2 674 1 1 9 GLY CA C 4.415 1.589 3.412 1.00 . A A . 9 GLY CA 1 1
2 675 1 1 9 GLY H H 3.155 0.974 1.810 1.00 . A A . 9 GLY H 1 1
2 676 1 1 9 GLY HA2 H 4.627 2.592 3.755 1.00 . A A . 9 GLY HA2 1 1
2 677 1 1 9 GLY HA3 H 4.267 0.889 4.221 1.00 . A A . 9 GLY HA3 1 1
2 678 1 1 9 GLY N N 3.195 1.577 2.601 1.00 . A A . 9 GLY N 1 1
2 679 1 1 9 GLY O O 5.948 -0.072 2.692 1.00 . A A . 9 GLY O 1 1
2 680 1 1 10 GLY C C 8.671 2.319 1.476 1.00 . A A . 10 GLY C 1 1
2 681 1 1 10 GLY CA C 7.441 1.610 1.100 1.00 . A A . 10 GLY CA 1 1
2 682 1 1 10 GLY H H 6.109 2.970 2.020 1.00 . A A . 10 GLY H 1 1
2 683 1 1 10 GLY HA2 H 7.634 0.546 1.149 1.00 . A A . 10 GLY HA2 1 1
2 684 1 1 10 GLY HA3 H 7.227 1.936 0.097 1.00 . A A . 10 GLY HA3 1 1
2 685 1 1 10 GLY N N 6.314 1.999 1.944 1.00 . A A . 10 GLY N 1 1
2 686 1 1 10 GLY O O 8.630 3.324 2.170 1.00 . A A . 10 GLY O 1 1
2 687 1 1 11 ILE C C 11.104 3.924 0.513 1.00 . A A . 11 ILE C 1 1
2 688 1 1 11 ILE CA C 11.087 2.528 1.113 1.00 . A A . 11 ILE CA 1 1
2 689 1 1 11 ILE CB C 12.210 1.651 0.569 1.00 . A A . 11 ILE CB 1 1
2 690 1 1 11 ILE CD1 C 13.678 0.874 2.553 1.00 . A A . 11 ILE CD1 1 1
2 691 1 1 11 ILE CG1 C 12.522 0.541 1.603 1.00 . A A . 11 ILE CG1 1 1
2 692 1 1 11 ILE CG2 C 13.461 2.473 0.172 1.00 . A A . 11 ILE CG2 1 1
2 693 1 1 11 ILE H H 9.802 1.033 0.384 1.00 . A A . 11 ILE H 1 1
2 694 1 1 11 ILE HA H 11.247 2.669 2.173 1.00 . A A . 11 ILE HA 1 1
2 695 1 1 11 ILE HB H 11.831 1.156 -0.356 1.00 . A A . 11 ILE HB 1 1
2 696 1 1 11 ILE HD11 H 14.650 0.811 2.017 1.00 . A A . 11 ILE HD11 1 1
2 697 1 1 11 ILE HD12 H 13.709 0.147 3.393 1.00 . A A . 11 ILE HD12 1 1
2 698 1 1 11 ILE HD13 H 13.566 1.895 2.974 1.00 . A A . 11 ILE HD13 1 1
2 699 1 1 11 ILE HG12 H 11.612 0.313 2.203 1.00 . A A . 11 ILE HG12 1 1
2 700 1 1 11 ILE HG13 H 12.784 -0.398 1.070 1.00 . A A . 11 ILE HG13 1 1
2 701 1 1 11 ILE HG21 H 14.320 1.803 -0.037 1.00 . A A . 11 ILE HG21 1 1
2 702 1 1 11 ILE HG22 H 13.749 3.162 0.997 1.00 . A A . 11 ILE HG22 1 1
2 703 1 1 11 ILE HG23 H 13.278 3.081 -0.738 1.00 . A A . 11 ILE HG23 1 1
2 704 1 1 11 ILE N N 9.808 1.854 0.943 1.00 . A A . 11 ILE N 1 1
2 705 1 1 11 ILE O O 11.597 4.883 1.097 1.00 . A A . 11 ILE O 1 1
2 706 1 1 12 GLY C C 9.041 5.737 -1.620 1.00 . A A . 12 GLY C 1 1
2 707 1 1 12 GLY CA C 10.457 5.310 -1.429 1.00 . A A . 12 GLY CA 1 1
2 708 1 1 12 GLY H H 10.096 3.259 -1.102 1.00 . A A . 12 GLY H 1 1
2 709 1 1 12 GLY HA2 H 10.954 6.099 -0.881 1.00 . A A . 12 GLY HA2 1 1
2 710 1 1 12 GLY HA3 H 10.884 5.147 -2.407 1.00 . A A . 12 GLY HA3 1 1
2 711 1 1 12 GLY N N 10.510 4.060 -0.687 1.00 . A A . 12 GLY N 1 1
2 712 1 1 12 GLY O O 8.668 6.286 -2.653 1.00 . A A . 12 GLY O 1 1
2 713 1 1 13 TYR C C 6.429 6.909 0.222 1.00 . A A . 13 TYR C 1 1
2 714 1 1 13 TYR CA C 6.782 5.796 -0.746 1.00 . A A . 13 TYR CA 1 1
2 715 1 1 13 TYR CB C 5.911 4.562 -0.440 1.00 . A A . 13 TYR CB 1 1
2 716 1 1 13 TYR CD1 C 4.444 4.609 -2.446 1.00 . A A . 13 TYR CD1 1 1
2 717 1 1 13 TYR CD2 C 3.500 5.276 -0.312 1.00 . A A . 13 TYR CD2 1 1
2 718 1 1 13 TYR CE1 C 3.244 4.919 -3.083 1.00 . A A . 13 TYR CE1 1 1
2 719 1 1 13 TYR CE2 C 2.295 5.577 -0.953 1.00 . A A . 13 TYR CE2 1 1
2 720 1 1 13 TYR CG C 4.583 4.806 -1.065 1.00 . A A . 13 TYR CG 1 1
2 721 1 1 13 TYR CZ C 2.176 5.408 -2.343 1.00 . A A . 13 TYR CZ 1 1
2 722 1 1 13 TYR H H 8.496 5.080 0.234 1.00 . A A . 13 TYR H 1 1
2 723 1 1 13 TYR HA H 6.569 6.160 -1.744 1.00 . A A . 13 TYR HA 1 1
2 724 1 1 13 TYR HB2 H 6.354 3.664 -0.913 1.00 . A A . 13 TYR HB2 1 1
2 725 1 1 13 TYR HB3 H 5.801 4.379 0.650 1.00 . A A . 13 TYR HB3 1 1
2 726 1 1 13 TYR HD1 H 5.279 4.243 -3.024 1.00 . A A . 13 TYR HD1 1 1
2 727 1 1 13 TYR HD2 H 3.600 5.438 0.755 1.00 . A A . 13 TYR HD2 1 1
2 728 1 1 13 TYR HE1 H 3.124 4.766 -4.147 1.00 . A A . 13 TYR HE1 1 1
2 729 1 1 13 TYR HE2 H 1.491 5.948 -0.343 1.00 . A A . 13 TYR HE2 1 1
2 730 1 1 13 TYR HH H 0.256 5.514 -2.529 1.00 . A A . 13 TYR HH 1 1
2 731 1 1 13 TYR N N 8.179 5.467 -0.632 1.00 . A A . 13 TYR N 1 1
2 732 1 1 13 TYR O O 6.883 6.937 1.358 1.00 . A A . 13 TYR O 1 1
2 733 1 1 13 TYR OH O 1.025 5.710 -3.078 1.00 . A A . 13 TYR OH 1 1
2 734 1 1 14 SER C C 3.812 9.433 0.398 1.00 . A A . 14 SER C 1 1
2 735 1 1 14 SER CA C 5.248 9.012 0.588 1.00 . A A . 14 SER CA 1 1
2 736 1 1 14 SER CB C 6.096 10.251 0.205 1.00 . A A . 14 SER CB 1 1
2 737 1 1 14 SER H H 5.290 7.846 -1.174 1.00 . A A . 14 SER H 1 1
2 738 1 1 14 SER HA H 5.379 8.784 1.638 1.00 . A A . 14 SER HA 1 1
2 739 1 1 14 SER HB2 H 5.558 10.934 -0.488 1.00 . A A . 14 SER HB2 1 1
2 740 1 1 14 SER HB3 H 6.402 10.805 1.118 1.00 . A A . 14 SER HB3 1 1
2 741 1 1 14 SER N N 5.581 7.850 -0.227 1.00 . A A . 14 SER N 1 1
2 742 1 1 14 SER O O 3.381 10.462 0.904 1.00 . A A . 14 SER O 1 1
2 743 1 1 15 GLY C C 0.782 8.421 0.585 1.00 . A A . 15 GLY C 1 1
2 744 1 1 15 GLY CA C 1.612 8.896 -0.590 1.00 . A A . 15 GLY CA 1 1
2 745 1 1 15 GLY H H 3.403 7.804 -0.732 1.00 . A A . 15 GLY H 1 1
2 746 1 1 15 GLY HA2 H 1.446 9.960 -0.702 1.00 . A A . 15 GLY HA2 1 1
2 747 1 1 15 GLY HA3 H 1.340 8.327 -1.465 1.00 . A A . 15 GLY HA3 1 1
2 748 1 1 15 GLY N N 3.034 8.658 -0.383 1.00 . A A . 15 GLY N 1 1
2 749 1 1 15 GLY O O 1.310 8.203 1.671 1.00 . A A . 15 GLY O 1 1
2 750 1 1 16 PRO C C -0.871 6.473 2.292 1.00 . A A . 16 PRO C 1 1
2 751 1 1 16 PRO CA C -1.386 7.664 1.468 1.00 . A A . 16 PRO CA 1 1
2 752 1 1 16 PRO CB C -2.692 7.336 0.742 1.00 . A A . 16 PRO CB 1 1
2 753 1 1 16 PRO CD C -1.252 8.575 -0.794 1.00 . A A . 16 PRO CD 1 1
2 754 1 1 16 PRO CG C -2.715 8.210 -0.525 1.00 . A A . 16 PRO CG 1 1
2 755 1 1 16 PRO HA H -1.511 8.464 2.182 1.00 . A A . 16 PRO HA 1 1
2 756 1 1 16 PRO HB2 H -2.715 6.269 0.433 1.00 . A A . 16 PRO HB2 1 1
2 757 1 1 16 PRO HB3 H -3.571 7.531 1.384 1.00 . A A . 16 PRO HB3 1 1
2 758 1 1 16 PRO HD2 H -0.867 7.986 -1.660 1.00 . A A . 16 PRO HD2 1 1
2 759 1 1 16 PRO HD3 H -1.151 9.661 -1.017 1.00 . A A . 16 PRO HD3 1 1
2 760 1 1 16 PRO HG2 H -3.155 7.660 -1.389 1.00 . A A . 16 PRO HG2 1 1
2 761 1 1 16 PRO HG3 H -3.309 9.131 -0.352 1.00 . A A . 16 PRO HG3 1 1
2 762 1 1 16 PRO N N -0.521 8.223 0.429 1.00 . A A . 16 PRO N 1 1
2 763 1 1 16 PRO O O -0.350 5.510 1.741 1.00 . A A . 16 PRO O 1 1
2 764 1 1 17 THR C C -1.610 4.612 5.135 1.00 . A A . 17 THR C 1 1
2 765 1 1 17 THR CA C -0.514 5.472 4.522 1.00 . A A . 17 THR CA 1 1
2 766 1 1 17 THR CB C 0.336 6.139 5.605 1.00 . A A . 17 THR CB 1 1
2 767 1 1 17 THR CG2 C -0.468 7.230 6.338 1.00 . A A . 17 THR CG2 1 1
2 768 1 1 17 THR H H -1.477 7.276 4.051 1.00 . A A . 17 THR H 1 1
2 769 1 1 17 THR HA H 0.137 4.795 3.984 1.00 . A A . 17 THR HA 1 1
2 770 1 1 17 THR HB H 1.214 6.618 5.106 1.00 . A A . 17 THR HB 1 1
2 771 1 1 17 THR HG1 H 0.136 4.618 6.778 1.00 . A A . 17 THR HG1 1 1
2 772 1 1 17 THR HG21 H -0.163 8.231 5.966 1.00 . A A . 17 THR HG21 1 1
2 773 1 1 17 THR HG22 H -0.259 7.203 7.430 1.00 . A A . 17 THR HG22 1 1
2 774 1 1 17 THR HG23 H -1.559 7.115 6.203 1.00 . A A . 17 THR HG23 1 1
2 775 1 1 17 THR N N -1.075 6.480 3.615 1.00 . A A . 17 THR N 1 1
2 776 1 1 17 THR O O -1.461 3.979 6.175 1.00 . A A . 17 THR O 1 1
2 777 1 1 17 THR OG1 O 0.855 5.237 6.572 1.00 . A A . 17 THR OG1 1 1
2 778 1 1 18 VAL C C -4.515 3.047 3.943 1.00 . A A . 18 VAL C 1 1
2 779 1 1 18 VAL CA C -3.945 3.875 5.056 1.00 . A A . 18 VAL CA 1 1
2 780 1 1 18 VAL CB C -5.038 4.821 5.569 1.00 . A A . 18 VAL CB 1 1
2 781 1 1 18 VAL CG1 C -6.237 4.060 6.181 1.00 . A A . 18 VAL CG1 1 1
2 782 1 1 18 VAL CG2 C -4.450 5.739 6.652 1.00 . A A . 18 VAL CG2 1 1
2 783 1 1 18 VAL H H -2.870 4.999 3.612 1.00 . A A . 18 VAL H 1 1
2 784 1 1 18 VAL HA H -3.647 3.197 5.845 1.00 . A A . 18 VAL HA 1 1
2 785 1 1 18 VAL HB H -5.392 5.459 4.731 1.00 . A A . 18 VAL HB 1 1
2 786 1 1 18 VAL HG11 H -7.188 4.595 5.979 1.00 . A A . 18 VAL HG11 1 1
2 787 1 1 18 VAL HG12 H -6.127 3.988 7.284 1.00 . A A . 18 VAL HG12 1 1
2 788 1 1 18 VAL HG13 H -6.355 3.025 5.808 1.00 . A A . 18 VAL HG13 1 1
2 789 1 1 18 VAL HG21 H -5.215 6.459 7.011 1.00 . A A . 18 VAL HG21 1 1
2 790 1 1 18 VAL HG22 H -3.578 6.312 6.285 1.00 . A A . 18 VAL HG22 1 1
2 791 1 1 18 VAL HG23 H -4.117 5.127 7.521 1.00 . A A . 18 VAL HG23 1 1
2 792 1 1 18 VAL N N -2.793 4.574 4.505 1.00 . A A . 18 VAL N 1 1
2 793 1 1 18 VAL O O -4.727 3.534 2.834 1.00 . A A . 18 VAL O 1 1
2 794 1 1 19 CYS C C -6.958 1.180 3.155 1.00 . A A . 19 CYS C 1 1
2 795 1 1 19 CYS CA C -5.475 0.945 3.207 1.00 . A A . 19 CYS CA 1 1
2 796 1 1 19 CYS CB C -5.148 -0.507 3.485 1.00 . A A . 19 CYS CB 1 1
2 797 1 1 19 CYS H H -4.639 1.352 5.069 1.00 . A A . 19 CYS H 1 1
2 798 1 1 19 CYS HA H -5.120 1.197 2.221 1.00 . A A . 19 CYS HA 1 1
2 799 1 1 19 CYS HB2 H -5.411 -0.756 4.540 1.00 . A A . 19 CYS HB2 1 1
2 800 1 1 19 CYS HB3 H -5.712 -1.198 2.847 1.00 . A A . 19 CYS HB3 1 1
2 801 1 1 19 CYS N N -4.801 1.771 4.178 1.00 . A A . 19 CYS N 1 1
2 802 1 1 19 CYS O O -7.570 1.557 4.145 1.00 . A A . 19 CYS O 1 1
2 803 1 1 19 CYS SG S -3.396 -0.761 3.177 1.00 . A A . 19 CYS SG 1 1
2 804 1 1 20 ALA C C -9.884 0.565 2.585 1.00 . A A . 20 ALA C 1 1
2 805 1 1 20 ALA CA C -8.932 1.185 1.599 1.00 . A A . 20 ALA CA 1 1
2 806 1 1 20 ALA CB C -9.191 0.625 0.172 1.00 . A A . 20 ALA CB 1 1
2 807 1 1 20 ALA H H -7.019 0.577 1.231 1.00 . A A . 20 ALA H 1 1
2 808 1 1 20 ALA HA H -9.171 2.227 1.640 1.00 . A A . 20 ALA HA 1 1
2 809 1 1 20 ALA HB1 H -8.388 0.938 -0.528 1.00 . A A . 20 ALA HB1 1 1
2 810 1 1 20 ALA HB2 H -10.160 0.975 -0.241 1.00 . A A . 20 ALA HB2 1 1
2 811 1 1 20 ALA HB3 H -9.204 -0.486 0.179 1.00 . A A . 20 ALA HB3 1 1
2 812 1 1 20 ALA N N -7.531 1.061 1.935 1.00 . A A . 20 ALA N 1 1
2 813 1 1 20 ALA O O -9.551 -0.364 3.295 1.00 . A A . 20 ALA O 1 1
2 814 1 1 21 SER C C -12.523 -1.006 3.193 1.00 . A A . 21 SER C 1 1
2 815 1 1 21 SER CA C -12.147 0.445 3.515 1.00 . A A . 21 SER CA 1 1
2 816 1 1 21 SER CB C -13.431 1.319 3.491 1.00 . A A . 21 SER CB 1 1
2 817 1 1 21 SER H H -11.424 1.803 2.079 1.00 . A A . 21 SER H 1 1
2 818 1 1 21 SER HA H -11.724 0.434 4.514 1.00 . A A . 21 SER HA 1 1
2 819 1 1 21 SER HB2 H -13.241 2.191 2.827 1.00 . A A . 21 SER HB2 1 1
2 820 1 1 21 SER HB3 H -14.315 0.784 3.080 1.00 . A A . 21 SER HB3 1 1
2 821 1 1 21 SER HG H -14.391 1.263 5.179 1.00 . A A . 21 SER HG 1 1
2 822 1 1 21 SER N N -11.139 1.024 2.624 1.00 . A A . 21 SER N 1 1
2 823 1 1 21 SER O O -13.379 -1.600 3.836 1.00 . A A . 21 SER O 1 1
2 824 1 1 21 SER OG O -13.738 1.851 4.776 1.00 . A A . 21 SER OG 1 1
2 825 1 1 22 GLY C C -10.575 -3.602 1.672 1.00 . A A . 22 GLY C 1 1
2 826 1 1 22 GLY CA C -11.938 -2.979 1.764 1.00 . A A . 22 GLY CA 1 1
2 827 1 1 22 GLY H H -11.162 -1.050 1.729 1.00 . A A . 22 GLY H 1 1
2 828 1 1 22 GLY HA2 H -12.500 -3.557 2.483 1.00 . A A . 22 GLY HA2 1 1
2 829 1 1 22 GLY HA3 H -12.354 -3.008 0.769 1.00 . A A . 22 GLY HA3 1 1
2 830 1 1 22 GLY N N -11.863 -1.592 2.176 1.00 . A A . 22 GLY N 1 1
2 831 1 1 22 GLY O O -10.467 -4.718 1.186 1.00 . A A . 22 GLY O 1 1
2 832 1 1 23 THR C C -7.369 -3.144 3.270 1.00 . A A . 23 THR C 1 1
2 833 1 1 23 THR CA C -8.129 -3.368 1.962 1.00 . A A . 23 THR CA 1 1
2 834 1 1 23 THR CB C -7.292 -2.784 0.800 1.00 . A A . 23 THR CB 1 1
2 835 1 1 23 THR CG2 C -7.914 -2.995 -0.581 1.00 . A A . 23 THR CG2 1 1
2 836 1 1 23 THR H H -9.591 -2.010 2.557 1.00 . A A . 23 THR H 1 1
2 837 1 1 23 THR HA H -8.169 -4.436 1.828 1.00 . A A . 23 THR HA 1 1
2 838 1 1 23 THR HB H -6.323 -3.306 0.809 1.00 . A A . 23 THR HB 1 1
2 839 1 1 23 THR HG1 H -6.022 -1.400 0.766 1.00 . A A . 23 THR HG1 1 1
2 840 1 1 23 THR HG21 H -7.521 -3.941 -1.006 1.00 . A A . 23 THR HG21 1 1
2 841 1 1 23 THR HG22 H -7.664 -2.157 -1.262 1.00 . A A . 23 THR HG22 1 1
2 842 1 1 23 THR HG23 H -9.015 -3.070 -0.524 1.00 . A A . 23 THR HG23 1 1
2 843 1 1 23 THR N N -9.500 -2.879 2.063 1.00 . A A . 23 THR N 1 1
2 844 1 1 23 THR O O -7.730 -2.327 4.110 1.00 . A A . 23 THR O 1 1
2 845 1 1 23 THR OG1 O -6.975 -1.404 0.865 1.00 . A A . 23 THR OG1 1 1
2 846 1 1 24 THR C C -3.978 -3.724 4.408 1.00 . A A . 24 THR C 1 1
2 847 1 1 24 THR CA C -5.464 -3.775 4.726 1.00 . A A . 24 THR CA 1 1
2 848 1 1 24 THR CB C -5.770 -4.966 5.630 1.00 . A A . 24 THR CB 1 1
2 849 1 1 24 THR CG2 C -4.847 -6.168 5.411 1.00 . A A . 24 THR CG2 1 1
2 850 1 1 24 THR H H -6.081 -4.657 2.893 1.00 . A A . 24 THR H 1 1
2 851 1 1 24 THR HA H -5.711 -2.863 5.248 1.00 . A A . 24 THR HA 1 1
2 852 1 1 24 THR HB H -6.817 -5.292 5.403 1.00 . A A . 24 THR HB 1 1
2 853 1 1 24 THR HG1 H -6.607 -4.600 7.305 1.00 . A A . 24 THR HG1 1 1
2 854 1 1 24 THR HG21 H -4.805 -6.406 4.324 1.00 . A A . 24 THR HG21 1 1
2 855 1 1 24 THR HG22 H -5.239 -7.052 5.953 1.00 . A A . 24 THR HG22 1 1
2 856 1 1 24 THR HG23 H -3.820 -5.960 5.783 1.00 . A A . 24 THR HG23 1 1
2 857 1 1 24 THR N N -6.248 -3.854 3.491 1.00 . A A . 24 THR N 1 1
2 858 1 1 24 THR O O -3.537 -4.206 3.369 1.00 . A A . 24 THR O 1 1
2 859 1 1 24 THR OG1 O -5.694 -4.603 7.000 1.00 . A A . 24 THR OG1 1 1
2 860 1 1 25 CYS C C -0.976 -4.260 5.200 1.00 . A A . 25 CYS C 1 1
2 861 1 1 25 CYS CA C -1.700 -2.945 4.991 1.00 . A A . 25 CYS CA 1 1
2 862 1 1 25 CYS CB C -0.978 -1.884 5.890 1.00 . A A . 25 CYS CB 1 1
2 863 1 1 25 CYS H H -3.474 -2.758 6.136 1.00 . A A . 25 CYS H 1 1
2 864 1 1 25 CYS HA H -1.559 -2.684 3.950 1.00 . A A . 25 CYS HA 1 1
2 865 1 1 25 CYS HB2 H -1.346 -2.006 6.930 1.00 . A A . 25 CYS HB2 1 1
2 866 1 1 25 CYS HB3 H 0.116 -2.084 5.904 1.00 . A A . 25 CYS HB3 1 1
2 867 1 1 25 CYS N N -3.136 -3.091 5.263 1.00 . A A . 25 CYS N 1 1
2 868 1 1 25 CYS O O -0.976 -4.812 6.298 1.00 . A A . 25 CYS O 1 1
2 869 1 1 25 CYS SG S -1.124 -0.139 5.390 1.00 . A A . 25 CYS SG 1 1
2 870 1 1 26 GLN C C 1.706 -5.913 3.513 1.00 . A A . 26 GLN C 1 1
2 871 1 1 26 GLN CA C 0.406 -6.033 4.269 1.00 . A A . 26 GLN CA 1 1
2 872 1 1 26 GLN CB C -0.376 -7.245 3.700 1.00 . A A . 26 GLN CB 1 1
2 873 1 1 26 GLN CD C -2.579 -8.516 3.572 1.00 . A A . 26 GLN CD 1 1
2 874 1 1 26 GLN CG C -1.844 -7.321 4.180 1.00 . A A . 26 GLN CG 1 1
2 875 1 1 26 GLN H H -0.336 -4.355 3.248 1.00 . A A . 26 GLN H 1 1
2 876 1 1 26 GLN HA H 0.654 -6.219 5.305 1.00 . A A . 26 GLN HA 1 1
2 877 1 1 26 GLN HB2 H -0.365 -7.195 2.590 1.00 . A A . 26 GLN HB2 1 1
2 878 1 1 26 GLN HB3 H 0.147 -8.185 3.983 1.00 . A A . 26 GLN HB3 1 1
2 879 1 1 26 GLN HE21 H -4.091 -8.300 4.903 1.00 . A A . 26 GLN HE21 1 1
2 880 1 1 26 GLN HE22 H -4.322 -9.500 3.659 1.00 . A A . 26 GLN HE22 1 1
2 881 1 1 26 GLN HG2 H -1.878 -7.374 5.286 1.00 . A A . 26 GLN HG2 1 1
2 882 1 1 26 GLN HG3 H -2.385 -6.408 3.852 1.00 . A A . 26 GLN HG3 1 1
2 883 1 1 26 GLN N N -0.312 -4.785 4.158 1.00 . A A . 26 GLN N 1 1
2 884 1 1 26 GLN NE2 N -3.746 -8.859 4.157 1.00 . A A . 26 GLN NE2 1 1
2 885 1 1 26 GLN O O 1.842 -5.222 2.506 1.00 . A A . 26 GLN O 1 1
2 886 1 1 26 GLN OE1 O -2.162 -9.124 2.588 1.00 . A A . 26 GLN OE1 1 1
2 887 1 1 27 VAL C C 4.138 -7.580 2.280 1.00 . A A . 27 VAL C 1 1
2 888 1 1 27 VAL CA C 4.046 -6.570 3.404 1.00 . A A . 27 VAL CA 1 1
2 889 1 1 27 VAL CB C 5.121 -6.813 4.453 1.00 . A A . 27 VAL CB 1 1
2 890 1 1 27 VAL CG1 C 6.495 -7.083 3.805 1.00 . A A . 27 VAL CG1 1 1
2 891 1 1 27 VAL CG2 C 5.177 -5.579 5.378 1.00 . A A . 27 VAL CG2 1 1
2 892 1 1 27 VAL H H 2.624 -7.191 4.797 1.00 . A A . 27 VAL H 1 1
2 893 1 1 27 VAL HA H 4.226 -5.592 2.976 1.00 . A A . 27 VAL HA 1 1
2 894 1 1 27 VAL HB H 4.832 -7.705 5.059 1.00 . A A . 27 VAL HB 1 1
2 895 1 1 27 VAL HG11 H 6.539 -8.116 3.396 1.00 . A A . 27 VAL HG11 1 1
2 896 1 1 27 VAL HG12 H 7.303 -6.975 4.558 1.00 . A A . 27 VAL HG12 1 1
2 897 1 1 27 VAL HG13 H 6.684 -6.360 2.984 1.00 . A A . 27 VAL HG13 1 1
2 898 1 1 27 VAL HG21 H 4.318 -4.896 5.206 1.00 . A A . 27 VAL HG21 1 1
2 899 1 1 27 VAL HG22 H 6.102 -4.996 5.185 1.00 . A A . 27 VAL HG22 1 1
2 900 1 1 27 VAL HG23 H 5.167 -5.888 6.444 1.00 . A A . 27 VAL HG23 1 1
2 901 1 1 27 VAL N N 2.736 -6.599 4.009 1.00 . A A . 27 VAL N 1 1
2 902 1 1 27 VAL O O 3.935 -8.775 2.475 1.00 . A A . 27 VAL O 1 1
2 903 1 1 28 LEU C C 6.304 -8.084 -0.198 1.00 . A A . 28 LEU C 1 1
2 904 1 1 28 LEU CA C 4.783 -7.998 -0.044 1.00 . A A . 28 LEU CA 1 1
2 905 1 1 28 LEU CB C 3.996 -7.471 -1.290 1.00 . A A . 28 LEU CB 1 1
2 906 1 1 28 LEU CD1 C 4.933 -9.309 -2.887 1.00 . A A . 28 LEU CD1 1 1
2 907 1 1 28 LEU CD2 C 3.322 -7.553 -3.750 1.00 . A A . 28 LEU CD2 1 1
2 908 1 1 28 LEU CG C 4.428 -7.869 -2.727 1.00 . A A . 28 LEU CG 1 1
2 909 1 1 28 LEU H H 4.527 -6.132 0.897 1.00 . A A . 28 LEU H 1 1
2 910 1 1 28 LEU HA H 4.448 -9.007 0.158 1.00 . A A . 28 LEU HA 1 1
2 911 1 1 28 LEU HB2 H 2.944 -7.810 -1.149 1.00 . A A . 28 LEU HB2 1 1
2 912 1 1 28 LEU HB3 H 3.971 -6.358 -1.249 1.00 . A A . 28 LEU HB3 1 1
2 913 1 1 28 LEU HD11 H 4.492 -9.802 -3.775 1.00 . A A . 28 LEU HD11 1 1
2 914 1 1 28 LEU HD12 H 4.702 -9.913 -1.986 1.00 . A A . 28 LEU HD12 1 1
2 915 1 1 28 LEU HD13 H 6.039 -9.298 -3.018 1.00 . A A . 28 LEU HD13 1 1
2 916 1 1 28 LEU HD21 H 3.756 -7.036 -4.633 1.00 . A A . 28 LEU HD21 1 1
2 917 1 1 28 LEU HD22 H 2.544 -6.900 -3.301 1.00 . A A . 28 LEU HD22 1 1
2 918 1 1 28 LEU HD23 H 2.828 -8.482 -4.100 1.00 . A A . 28 LEU HD23 1 1
2 919 1 1 28 LEU HG H 5.280 -7.224 -3.020 1.00 . A A . 28 LEU HG 1 1
2 920 1 1 28 LEU N N 4.469 -7.113 1.064 1.00 . A A . 28 LEU N 1 1
2 921 1 1 28 LEU O O 6.888 -9.066 -0.644 1.00 . A A . 28 LEU O 1 1
2 922 1 1 29 ASN C C 8.977 -5.791 0.794 1.00 . A A . 29 ASN C 1 1
2 923 1 1 29 ASN CA C 8.431 -6.894 -0.088 1.00 . A A . 29 ASN CA 1 1
2 924 1 1 29 ASN CB C 8.807 -6.613 -1.602 1.00 . A A . 29 ASN CB 1 1
2 925 1 1 29 ASN CG C 7.725 -6.127 -2.557 1.00 . A A . 29 ASN CG 1 1
2 926 1 1 29 ASN H H 6.590 -6.292 0.731 1.00 . A A . 29 ASN H 1 1
2 927 1 1 29 ASN HA H 8.905 -7.813 0.225 1.00 . A A . 29 ASN HA 1 1
2 928 1 1 29 ASN HB2 H 9.629 -5.876 -1.707 1.00 . A A . 29 ASN HB2 1 1
2 929 1 1 29 ASN HB3 H 9.162 -7.571 -2.038 1.00 . A A . 29 ASN HB3 1 1
2 930 1 1 29 ASN HD21 H 6.590 -5.338 -1.049 1.00 . A A . 29 ASN HD21 1 1
2 931 1 1 29 ASN HD22 H 5.919 -5.243 -2.627 1.00 . A A . 29 ASN HD22 1 1
2 932 1 1 29 ASN N N 7.025 -7.038 0.230 1.00 . A A . 29 ASN N 1 1
2 933 1 1 29 ASN ND2 N 6.675 -5.481 -2.037 1.00 . A A . 29 ASN ND2 1 1
2 934 1 1 29 ASN O O 8.205 -4.930 1.213 1.00 . A A . 29 ASN O 1 1
2 935 1 1 29 ASN OD1 O 7.805 -6.304 -3.769 1.00 . A A . 29 ASN OD1 1 1
2 936 1 1 30 PRO C C 10.918 -3.319 1.261 1.00 . A A . 30 PRO C 1 1
2 937 1 1 30 PRO CA C 10.850 -4.686 1.928 1.00 . A A . 30 PRO CA 1 1
2 938 1 1 30 PRO CB C 12.257 -5.240 2.251 1.00 . A A . 30 PRO CB 1 1
2 939 1 1 30 PRO CD C 11.275 -6.643 0.520 1.00 . A A . 30 PRO CD 1 1
2 940 1 1 30 PRO CG C 12.607 -6.267 1.160 1.00 . A A . 30 PRO CG 1 1
2 941 1 1 30 PRO HA H 10.237 -4.567 2.810 1.00 . A A . 30 PRO HA 1 1
2 942 1 1 30 PRO HB2 H 13.033 -4.447 2.323 1.00 . A A . 30 PRO HB2 1 1
2 943 1 1 30 PRO HB3 H 12.210 -5.762 3.231 1.00 . A A . 30 PRO HB3 1 1
2 944 1 1 30 PRO HD2 H 11.351 -6.523 -0.585 1.00 . A A . 30 PRO HD2 1 1
2 945 1 1 30 PRO HD3 H 11.001 -7.694 0.764 1.00 . A A . 30 PRO HD3 1 1
2 946 1 1 30 PRO HG2 H 13.275 -5.818 0.397 1.00 . A A . 30 PRO HG2 1 1
2 947 1 1 30 PRO HG3 H 13.111 -7.159 1.588 1.00 . A A . 30 PRO HG3 1 1
2 948 1 1 30 PRO N N 10.277 -5.714 1.060 1.00 . A A . 30 PRO N 1 1
2 949 1 1 30 PRO O O 11.473 -2.396 1.840 1.00 . A A . 30 PRO O 1 1
2 950 1 1 31 TYR C C 8.914 -1.628 -1.149 1.00 . A A . 31 TYR C 1 1
2 951 1 1 31 TYR CA C 10.330 -1.912 -0.685 1.00 . A A . 31 TYR CA 1 1
2 952 1 1 31 TYR CB C 11.287 -1.975 -1.913 1.00 . A A . 31 TYR CB 1 1
2 953 1 1 31 TYR CD1 C 13.258 -3.336 -1.070 1.00 . A A . 31 TYR CD1 1 1
2 954 1 1 31 TYR CD2 C 13.549 -0.962 -1.401 1.00 . A A . 31 TYR CD2 1 1
2 955 1 1 31 TYR CE1 C 14.564 -3.431 -0.567 1.00 . A A . 31 TYR CE1 1 1
2 956 1 1 31 TYR CE2 C 14.852 -1.051 -0.892 1.00 . A A . 31 TYR CE2 1 1
2 957 1 1 31 TYR CG C 12.720 -2.095 -1.453 1.00 . A A . 31 TYR CG 1 1
2 958 1 1 31 TYR CZ C 15.357 -2.283 -0.479 1.00 . A A . 31 TYR CZ 1 1
2 959 1 1 31 TYR H H 9.881 -3.931 -0.347 1.00 . A A . 31 TYR H 1 1
2 960 1 1 31 TYR HA H 10.606 -1.089 -0.039 1.00 . A A . 31 TYR HA 1 1
2 961 1 1 31 TYR HB2 H 11.048 -2.852 -2.551 1.00 . A A . 31 TYR HB2 1 1
2 962 1 1 31 TYR HB3 H 11.197 -1.057 -2.533 1.00 . A A . 31 TYR HB3 1 1
2 963 1 1 31 TYR HD1 H 12.636 -4.215 -1.122 1.00 . A A . 31 TYR HD1 1 1
2 964 1 1 31 TYR HD2 H 13.170 -0.002 -1.716 1.00 . A A . 31 TYR HD2 1 1
2 965 1 1 31 TYR HE1 H 14.949 -4.381 -0.231 1.00 . A A . 31 TYR HE1 1 1
2 966 1 1 31 TYR HE2 H 15.473 -0.171 -0.819 1.00 . A A . 31 TYR HE2 1 1
2 967 1 1 31 TYR HH H 17.030 -3.217 -0.251 1.00 . A A . 31 TYR HH 1 1
2 968 1 1 31 TYR N N 10.344 -3.156 0.059 1.00 . A A . 31 TYR N 1 1
2 969 1 1 31 TYR O O 8.655 -0.648 -1.849 1.00 . A A . 31 TYR O 1 1
2 970 1 1 31 TYR OH O 16.684 -2.354 -0.018 1.00 . A A . 31 TYR OH 1 1
2 971 1 1 32 TYR C C 5.587 -3.018 -0.159 1.00 . A A . 32 TYR C 1 1
2 972 1 1 32 TYR CA C 6.585 -2.389 -1.175 1.00 . A A . 32 TYR CA 1 1
2 973 1 1 32 TYR CB C 6.403 -2.610 -2.727 1.00 . A A . 32 TYR CB 1 1
2 974 1 1 32 TYR CD1 C 4.104 -1.785 -2.916 1.00 . A A . 32 TYR CD1 1 1
2 975 1 1 32 TYR CD2 C 4.487 -4.009 -3.770 1.00 . A A . 32 TYR CD2 1 1
2 976 1 1 32 TYR CE1 C 2.773 -1.845 -3.308 1.00 . A A . 32 TYR CE1 1 1
2 977 1 1 32 TYR CE2 C 3.143 -4.072 -4.171 1.00 . A A . 32 TYR CE2 1 1
2 978 1 1 32 TYR CG C 4.979 -2.847 -3.138 1.00 . A A . 32 TYR CG 1 1
2 979 1 1 32 TYR CZ C 2.317 -2.969 -3.963 1.00 . A A . 32 TYR CZ 1 1
2 980 1 1 32 TYR H H 8.140 -3.153 -0.019 1.00 . A A . 32 TYR H 1 1
2 981 1 1 32 TYR HA H 6.368 -1.357 -1.131 1.00 . A A . 32 TYR HA 1 1
2 982 1 1 32 TYR HB2 H 6.747 -1.696 -3.258 1.00 . A A . 32 TYR HB2 1 1
2 983 1 1 32 TYR HB3 H 7.051 -3.405 -3.132 1.00 . A A . 32 TYR HB3 1 1
2 984 1 1 32 TYR HD1 H 4.486 -0.901 -2.463 1.00 . A A . 32 TYR HD1 1 1
2 985 1 1 32 TYR HD2 H 5.132 -4.844 -3.993 1.00 . A A . 32 TYR HD2 1 1
2 986 1 1 32 TYR HE1 H 2.103 -1.014 -3.170 1.00 . A A . 32 TYR HE1 1 1
2 987 1 1 32 TYR HE2 H 2.754 -4.951 -4.661 1.00 . A A . 32 TYR HE2 1 1
2 988 1 1 32 TYR HH H 1.130 -3.140 -5.435 1.00 . A A . 32 TYR HH 1 1
2 989 1 1 32 TYR N N 7.952 -2.475 -0.728 1.00 . A A . 32 TYR N 1 1
2 990 1 1 32 TYR O O 5.396 -4.230 -0.067 1.00 . A A . 32 TYR O 1 1
2 991 1 1 32 TYR OH O 1.049 -2.884 -4.513 1.00 . A A . 32 TYR OH 1 1
2 992 1 1 33 SER C C 2.526 -2.327 0.832 1.00 . A A . 33 SER C 1 1
2 993 1 1 33 SER CA C 3.811 -2.666 1.507 1.00 . A A . 33 SER CA 1 1
2 994 1 1 33 SER CB C 3.711 -2.134 2.952 1.00 . A A . 33 SER CB 1 1
2 995 1 1 33 SER H H 5.128 -1.214 0.683 1.00 . A A . 33 SER H 1 1
2 996 1 1 33 SER HA H 3.847 -3.741 1.598 1.00 . A A . 33 SER HA 1 1
2 997 1 1 33 SER HB2 H 3.730 -1.028 2.942 1.00 . A A . 33 SER HB2 1 1
2 998 1 1 33 SER HB3 H 2.752 -2.451 3.424 1.00 . A A . 33 SER HB3 1 1
2 999 1 1 33 SER HG H 5.050 -1.951 4.342 1.00 . A A . 33 SER HG 1 1
2 1000 1 1 33 SER N N 4.915 -2.196 0.668 1.00 . A A . 33 SER N 1 1
2 1001 1 1 33 SER O O 2.138 -1.168 0.687 1.00 . A A . 33 SER O 1 1
2 1002 1 1 33 SER OG O 4.771 -2.657 3.747 1.00 . A A . 33 SER OG 1 1
2 1003 1 1 34 GLN C C -0.562 -3.203 0.494 1.00 . A A . 34 GLN C 1 1
2 1004 1 1 34 GLN CA C 0.659 -3.312 -0.400 1.00 . A A . 34 GLN CA 1 1
2 1005 1 1 34 GLN CB C 0.642 -4.587 -1.271 1.00 . A A . 34 GLN CB 1 1
2 1006 1 1 34 GLN CD C -0.238 -5.731 -3.351 1.00 . A A . 34 GLN CD 1 1
2 1007 1 1 34 GLN CG C -0.484 -4.630 -2.317 1.00 . A A . 34 GLN CG 1 1
2 1008 1 1 34 GLN H H 2.103 -4.286 0.693 1.00 . A A . 34 GLN H 1 1
2 1009 1 1 34 GLN HA H 0.689 -2.436 -1.034 1.00 . A A . 34 GLN HA 1 1
2 1010 1 1 34 GLN HB2 H 1.623 -4.617 -1.800 1.00 . A A . 34 GLN HB2 1 1
2 1011 1 1 34 GLN HB3 H 0.602 -5.492 -0.625 1.00 . A A . 34 GLN HB3 1 1
2 1012 1 1 34 GLN HE21 H -0.267 -4.379 -4.846 1.00 . A A . 34 GLN HE21 1 1
2 1013 1 1 34 GLN HE22 H -0.110 -6.068 -5.328 1.00 . A A . 34 GLN HE22 1 1
2 1014 1 1 34 GLN HG2 H -1.456 -4.826 -1.833 1.00 . A A . 34 GLN HG2 1 1
2 1015 1 1 34 GLN HG3 H -0.545 -3.634 -2.794 1.00 . A A . 34 GLN HG3 1 1
2 1016 1 1 34 GLN N N 1.844 -3.370 0.386 1.00 . A A . 34 GLN N 1 1
2 1017 1 1 34 GLN NE2 N -0.246 -5.358 -4.648 1.00 . A A . 34 GLN NE2 1 1
2 1018 1 1 34 GLN O O -0.540 -3.475 1.690 1.00 . A A . 34 GLN O 1 1
2 1019 1 1 34 GLN OE1 O -0.073 -6.907 -3.049 1.00 . A A . 34 GLN OE1 1 1
2 1020 1 1 35 CYS C C -3.901 -3.741 -0.035 1.00 . A A . 35 CYS C 1 1
2 1021 1 1 35 CYS CA C -2.957 -2.709 0.566 1.00 . A A . 35 CYS CA 1 1
2 1022 1 1 35 CYS CB C -3.529 -1.313 0.283 1.00 . A A . 35 CYS CB 1 1
2 1023 1 1 35 CYS H H -1.619 -2.389 -1.007 1.00 . A A . 35 CYS H 1 1
2 1024 1 1 35 CYS HA H -2.866 -2.906 1.620 1.00 . A A . 35 CYS HA 1 1
2 1025 1 1 35 CYS HB2 H -3.146 -1.044 -0.719 1.00 . A A . 35 CYS HB2 1 1
2 1026 1 1 35 CYS HB3 H -4.627 -1.306 0.260 1.00 . A A . 35 CYS HB3 1 1
2 1027 1 1 35 CYS N N -1.676 -2.766 -0.086 1.00 . A A . 35 CYS N 1 1
2 1028 1 1 35 CYS O O -4.277 -3.630 -1.205 1.00 . A A . 35 CYS O 1 1
2 1029 1 1 35 CYS SG S -2.973 -0.006 1.369 1.00 . A A . 35 CYS SG 1 1
2 1030 1 1 36 LEU C C -6.418 -6.076 0.957 1.00 . A A . 36 LEU C 1 1
2 1031 1 1 36 LEU CA C -5.059 -5.906 0.280 1.00 . A A . 36 LEU CA 1 1
2 1032 1 1 36 LEU CB C -4.312 -7.229 0.535 1.00 . A A . 36 LEU CB 1 1
2 1033 1 1 36 LEU CD1 C -3.166 -6.958 -1.667 1.00 . A A . 36 LEU CD1 1 1
2 1034 1 1 36 LEU CD2 C -1.872 -6.523 0.490 1.00 . A A . 36 LEU CD2 1 1
2 1035 1 1 36 LEU CG C -2.971 -7.342 -0.197 1.00 . A A . 36 LEU CG 1 1
2 1036 1 1 36 LEU H H -4.030 -4.812 1.713 1.00 . A A . 36 LEU H 1 1
2 1037 1 1 36 LEU HA H -5.287 -5.794 -0.765 1.00 . A A . 36 LEU HA 1 1
2 1038 1 1 36 LEU HB2 H -4.159 -7.363 1.627 1.00 . A A . 36 LEU HB2 1 1
2 1039 1 1 36 LEU HB3 H -4.958 -8.071 0.195 1.00 . A A . 36 LEU HB3 1 1
2 1040 1 1 36 LEU HD11 H -3.303 -5.862 -1.762 1.00 . A A . 36 LEU HD11 1 1
2 1041 1 1 36 LEU HD12 H -4.073 -7.451 -2.069 1.00 . A A . 36 LEU HD12 1 1
2 1042 1 1 36 LEU HD13 H -2.290 -7.262 -2.265 1.00 . A A . 36 LEU HD13 1 1
2 1043 1 1 36 LEU HD21 H -0.870 -6.968 0.330 1.00 . A A . 36 LEU HD21 1 1
2 1044 1 1 36 LEU HD22 H -2.074 -6.468 1.579 1.00 . A A . 36 LEU HD22 1 1
2 1045 1 1 36 LEU HD23 H -1.862 -5.486 0.124 1.00 . A A . 36 LEU HD23 1 1
2 1046 1 1 36 LEU HG H -2.661 -8.414 -0.134 1.00 . A A . 36 LEU HG 1 1
2 1047 1 1 36 LEU N N -4.311 -4.752 0.749 1.00 . A A . 36 LEU N 1 1
2 1048 1 1 36 LEU O O -6.460 -6.180 2.208 1.00 . A A . 36 LEU O 1 1
2 1049 1 1 36 LEU OXT O -7.424 -6.109 0.200 1.00 . A A . 36 LEU OXT 1 1
2 1050 2 2 1 MAN C1 C -9.127 4.254 -0.176 1.00 . B A . 101 MAN C1 1 1
2 1051 2 2 1 MAN C2 C -8.186 4.626 -1.266 1.00 . B A . 101 MAN C2 1 1
2 1052 2 2 1 MAN C3 C -8.222 6.097 -1.536 1.00 . B A . 101 MAN C3 1 1
2 1053 2 2 1 MAN C4 C -9.614 6.479 -1.947 1.00 . B A . 101 MAN C4 1 1
2 1054 2 2 1 MAN C5 C -10.631 5.921 -0.949 1.00 . B A . 101 MAN C5 1 1
2 1055 2 2 1 MAN C6 C -12.051 6.086 -1.436 1.00 . B A . 101 MAN C6 1 1
2 1056 2 2 1 MAN H1 H -9.066 3.162 -0.057 1.00 . B A . 101 MAN H1 1 1
2 1057 2 2 1 MAN H2 H -7.193 4.301 -0.955 1.00 . B A . 101 MAN H2 1 1
2 1058 2 2 1 MAN H3 H -8.006 6.644 -0.598 1.00 . B A . 101 MAN H3 1 1
2 1059 2 2 1 MAN H4 H -9.825 6.051 -2.957 1.00 . B A . 101 MAN H4 1 1
2 1060 2 2 1 MAN H5 H -10.528 6.484 0.008 1.00 . B A . 101 MAN H5 1 1
2 1061 2 2 1 MAN H61 H -12.160 5.606 -2.436 1.00 . B A . 101 MAN H61 1 1
2 1062 2 2 1 MAN H62 H -12.284 7.169 -1.554 1.00 . B A . 101 MAN H62 1 1
2 1063 2 2 1 MAN HO2 H -9.377 3.706 -2.553 1.00 . B A . 101 MAN HO2 1 1
2 1064 2 2 1 MAN HO3 H -6.870 5.735 -2.940 1.00 . B A . 101 MAN HO3 1 1
2 1065 2 2 1 MAN HO4 H -9.064 8.196 -2.663 1.00 . B A . 101 MAN HO4 1 1
2 1066 2 2 1 MAN HO6 H -12.739 5.614 0.369 1.00 . B A . 101 MAN HO6 1 1
2 1067 2 2 1 MAN O1 O -8.836 4.949 1.056 1.00 . B A . 101 MAN O1 1 1
2 1068 2 2 1 MAN O2 O -8.434 3.891 -2.436 1.00 . B A . 101 MAN O2 1 1
2 1069 2 2 1 MAN O3 O -7.237 6.511 -2.478 1.00 . B A . 101 MAN O3 1 1
2 1070 2 2 1 MAN O4 O -9.716 7.892 -2.013 1.00 . B A . 101 MAN O4 1 1
2 1071 2 2 1 MAN O5 O -10.433 4.527 -0.652 1.00 . B A . 101 MAN O5 1 1
2 1072 2 2 1 MAN O6 O -12.994 5.480 -0.548 1.00 . B A . 101 MAN O6 1 1
2 1073 3 2 1 MAN C1 C -7.206 1.939 -6.126 1.00 . C A . 102 MAN C1 1 1
2 1074 3 2 1 MAN C2 C -8.162 2.484 -5.078 1.00 . C A . 102 MAN C2 1 1
2 1075 3 2 1 MAN C3 C -8.887 1.336 -4.377 1.00 . C A . 102 MAN C3 1 1
2 1076 3 2 1 MAN C4 C -9.516 0.398 -5.375 1.00 . C A . 102 MAN C4 1 1
2 1077 3 2 1 MAN C5 C -8.560 0.012 -6.497 1.00 . C A . 102 MAN C5 1 1
2 1078 3 2 1 MAN C6 C -9.311 -0.748 -7.572 1.00 . C A . 102 MAN C6 1 1
2 1079 3 2 1 MAN H1 H -6.711 2.781 -6.665 1.00 . C A . 102 MAN H1 1 1
2 1080 3 2 1 MAN H2 H -7.511 3.035 -4.375 1.00 . C A . 102 MAN H2 1 1
2 1081 3 2 1 MAN H3 H -8.147 0.750 -3.833 1.00 . C A . 102 MAN H3 1 1
2 1082 3 2 1 MAN H4 H -10.370 0.943 -5.846 1.00 . C A . 102 MAN H4 1 1
2 1083 3 2 1 MAN H5 H -7.751 -0.647 -6.105 1.00 . C A . 102 MAN H5 1 1
2 1084 3 2 1 MAN H61 H -10.037 -0.055 -8.055 1.00 . C A . 102 MAN H61 1 1
2 1085 3 2 1 MAN H62 H -9.883 -1.582 -7.108 1.00 . C A . 102 MAN H62 1 1
2 1086 3 2 1 MAN HO2 H -8.664 4.282 -5.738 1.00 . C A . 102 MAN HO2 1 1
2 1087 3 2 1 MAN HO3 H -10.470 2.302 -3.797 1.00 . C A . 102 MAN HO3 1 1
2 1088 3 2 1 MAN HO4 H -10.776 -0.527 -4.196 1.00 . C A . 102 MAN HO4 1 1
2 1089 3 2 1 MAN HO6 H -8.870 -1.301 -9.421 1.00 . C A . 102 MAN HO6 1 1
2 1090 3 2 1 MAN O1 O -6.188 1.106 -5.533 1.00 . C A . 102 MAN O1 1 1
2 1091 3 2 1 MAN O2 O -9.104 3.437 -5.576 1.00 . C A . 102 MAN O2 1 1
2 1092 3 2 1 MAN O3 O -9.825 1.727 -3.370 1.00 . C A . 102 MAN O3 1 1
2 1093 3 2 1 MAN O4 O -10.012 -0.778 -4.730 1.00 . C A . 102 MAN O4 1 1
2 1094 3 2 1 MAN O5 O -7.959 1.184 -7.077 1.00 . C A . 102 MAN O5 1 1
2 1095 3 2 1 MAN O6 O -8.450 -1.324 -8.554 1.00 . C A . 102 MAN O6 1 1
2 1096 4 2 1 MAN C1 C 8.266 10.829 -0.687 1.00 . D A . 103 MAN C1 1 1
2 1097 4 2 1 MAN C2 C 7.739 11.994 -1.494 1.00 . D A . 103 MAN C2 1 1
2 1098 4 2 1 MAN C3 C 7.201 11.454 -2.810 1.00 . D A . 103 MAN C3 1 1
2 1099 4 2 1 MAN C4 C 8.333 10.790 -3.575 1.00 . D A . 103 MAN C4 1 1
2 1100 4 2 1 MAN C5 C 9.032 9.747 -2.695 1.00 . D A . 103 MAN C5 1 1
2 1101 4 2 1 MAN C6 C 10.286 9.189 -3.348 1.00 . D A . 103 MAN C6 1 1
2 1102 4 2 1 MAN H1 H 8.624 11.184 0.307 1.00 . D A . 103 MAN H1 1 1
2 1103 4 2 1 MAN H2 H 6.904 12.487 -0.947 1.00 . D A . 103 MAN H2 1 1
2 1104 4 2 1 MAN H3 H 6.446 10.664 -2.588 1.00 . D A . 103 MAN H3 1 1
2 1105 4 2 1 MAN H4 H 9.080 11.579 -3.831 1.00 . D A . 103 MAN H4 1 1
2 1106 4 2 1 MAN H5 H 8.326 8.899 -2.530 1.00 . D A . 103 MAN H5 1 1
2 1107 4 2 1 MAN H61 H 10.991 10.016 -3.584 1.00 . D A . 103 MAN H61 1 1
2 1108 4 2 1 MAN H62 H 10.026 8.678 -4.302 1.00 . D A . 103 MAN H62 1 1
2 1109 4 2 1 MAN HO2 H 9.557 12.592 -1.959 1.00 . D A . 103 MAN HO2 1 1
2 1110 4 2 1 MAN HO3 H 6.107 12.053 -4.336 1.00 . D A . 103 MAN HO3 1 1
2 1111 4 2 1 MAN HO4 H 7.533 9.331 -4.661 1.00 . D A . 103 MAN HO4 1 1
2 1112 4 2 1 MAN HO6 H 10.372 8.032 -1.778 1.00 . D A . 103 MAN HO6 1 1
2 1113 4 2 1 MAN O1 O 7.270 9.815 -0.486 1.00 . D A . 103 MAN O1 1 1
2 1114 4 2 1 MAN O2 O 8.741 13.002 -1.655 1.00 . D A . 103 MAN O2 1 1
2 1115 4 2 1 MAN O3 O 6.511 12.453 -3.560 1.00 . D A . 103 MAN O3 1 1
2 1116 4 2 1 MAN O4 O 7.897 10.209 -4.805 1.00 . D A . 103 MAN O4 1 1
2 1117 4 2 1 MAN O5 O 9.387 10.281 -1.401 1.00 . D A . 103 MAN O5 1 1
2 1118 4 2 1 MAN O6 O 10.960 8.254 -2.510 1.00 . D A . 103 MAN O6 1 1
3 1119 1 1 1 THR C C -5.897 4.801 0.896 1.00 . A A . 1 THR C 1 1
3 1120 1 1 1 THR CA C -6.737 4.891 2.137 1.00 . A A . 1 THR CA 1 1
3 1121 1 1 1 THR CB C -7.856 3.799 2.101 1.00 . A A . 1 THR CB 1 1
3 1122 1 1 1 THR CG2 C -8.203 3.375 3.522 1.00 . A A . 1 THR CG2 1 1
3 1123 1 1 1 THR H1 H -7.193 6.672 3.237 1.00 . A A . 1 THR H1 1 1
3 1124 1 1 1 THR H2 H -8.390 6.124 2.155 1.00 . A A . 1 THR H2 1 1
3 1125 1 1 1 THR H3 H -6.988 6.873 1.541 1.00 . A A . 1 THR H3 1 1
3 1126 1 1 1 THR HA H -6.076 4.734 2.971 1.00 . A A . 1 THR HA 1 1
3 1127 1 1 1 THR HB H -7.569 2.901 1.520 1.00 . A A . 1 THR HB 1 1
3 1128 1 1 1 THR HG21 H -8.369 4.230 4.203 1.00 . A A . 1 THR HG21 1 1
3 1129 1 1 1 THR HG22 H -7.354 2.789 3.928 1.00 . A A . 1 THR HG22 1 1
3 1130 1 1 1 THR HG23 H -9.095 2.714 3.558 1.00 . A A . 1 THR HG23 1 1
3 1131 1 1 1 THR N N -7.362 6.258 2.303 1.00 . A A . 1 THR N 1 1
3 1132 1 1 1 THR O O -5.739 5.823 0.252 1.00 . A A . 1 THR O 1 1
3 1133 1 1 2 GLN C C -5.768 2.248 -1.443 1.00 . A A . 2 GLN C 1 1
3 1134 1 1 2 GLN CA C -4.895 3.294 -0.800 1.00 . A A . 2 GLN CA 1 1
3 1135 1 1 2 GLN CB C -3.461 2.726 -0.787 1.00 . A A . 2 GLN CB 1 1
3 1136 1 1 2 GLN CD C -2.495 4.947 -1.271 1.00 . A A . 2 GLN CD 1 1
3 1137 1 1 2 GLN CG C -2.601 3.520 -1.778 1.00 . A A . 2 GLN CG 1 1
3 1138 1 1 2 GLN H H -5.365 2.837 1.164 1.00 . A A . 2 GLN H 1 1
3 1139 1 1 2 GLN HA H -4.963 4.177 -1.426 1.00 . A A . 2 GLN HA 1 1
3 1140 1 1 2 GLN HB2 H -3.053 2.806 0.248 1.00 . A A . 2 GLN HB2 1 1
3 1141 1 1 2 GLN HB3 H -3.400 1.646 -1.048 1.00 . A A . 2 GLN HB3 1 1
3 1142 1 1 2 GLN HE21 H -1.190 4.330 0.175 1.00 . A A . 2 GLN HE21 1 1
3 1143 1 1 2 GLN HE22 H -1.675 6.006 0.251 1.00 . A A . 2 GLN HE22 1 1
3 1144 1 1 2 GLN HG2 H -1.598 3.086 -1.886 1.00 . A A . 2 GLN HG2 1 1
3 1145 1 1 2 GLN HG3 H -3.058 3.542 -2.787 1.00 . A A . 2 GLN HG3 1 1
3 1146 1 1 2 GLN N N -5.388 3.607 0.526 1.00 . A A . 2 GLN N 1 1
3 1147 1 1 2 GLN NE2 N -1.716 5.110 -0.184 1.00 . A A . 2 GLN NE2 1 1
3 1148 1 1 2 GLN O O -6.516 1.551 -0.762 1.00 . A A . 2 GLN O 1 1
3 1149 1 1 2 GLN OE1 O -3.086 5.887 -1.787 1.00 . A A . 2 GLN OE1 1 1
3 1150 1 1 3 SER C C -6.042 -0.190 -3.446 1.00 . A A . 3 SER C 1 1
3 1151 1 1 3 SER CA C -6.527 1.233 -3.564 1.00 . A A . 3 SER CA 1 1
3 1152 1 1 3 SER CB C -6.529 1.586 -5.075 1.00 . A A . 3 SER CB 1 1
3 1153 1 1 3 SER H H -5.108 2.733 -3.314 1.00 . A A . 3 SER H 1 1
3 1154 1 1 3 SER HA H -7.536 1.269 -3.180 1.00 . A A . 3 SER HA 1 1
3 1155 1 1 3 SER HB2 H -5.849 0.927 -5.654 1.00 . A A . 3 SER HB2 1 1
3 1156 1 1 3 SER HB3 H -7.555 1.532 -5.498 1.00 . A A . 3 SER HB3 1 1
3 1157 1 1 3 SER N N -5.721 2.153 -2.780 1.00 . A A . 3 SER N 1 1
3 1158 1 1 3 SER O O -4.975 -0.459 -2.909 1.00 . A A . 3 SER O 1 1
3 1159 1 1 4 HIS C C -5.081 -2.629 -4.911 1.00 . A A . 4 HIS C 1 1
3 1160 1 1 4 HIS CA C -6.335 -2.542 -4.072 1.00 . A A . 4 HIS CA 1 1
3 1161 1 1 4 HIS CB C -7.385 -3.482 -4.714 1.00 . A A . 4 HIS CB 1 1
3 1162 1 1 4 HIS CD2 C -6.208 -5.637 -3.801 1.00 . A A . 4 HIS CD2 1 1
3 1163 1 1 4 HIS CE1 C -7.916 -6.995 -3.999 1.00 . A A . 4 HIS CE1 1 1
3 1164 1 1 4 HIS CG C -7.237 -4.938 -4.339 1.00 . A A . 4 HIS CG 1 1
3 1165 1 1 4 HIS H H -7.672 -0.951 -4.416 1.00 . A A . 4 HIS H 1 1
3 1166 1 1 4 HIS HA H -6.089 -2.872 -3.070 1.00 . A A . 4 HIS HA 1 1
3 1167 1 1 4 HIS HB2 H -8.384 -3.146 -4.361 1.00 . A A . 4 HIS HB2 1 1
3 1168 1 1 4 HIS HB3 H -7.378 -3.391 -5.824 1.00 . A A . 4 HIS HB3 1 1
3 1169 1 1 4 HIS HD1 H -9.218 -5.592 -4.748 1.00 . A A . 4 HIS HD1 1 1
3 1170 1 1 4 HIS HD2 H -5.241 -5.296 -3.443 1.00 . A A . 4 HIS HD2 1 1
3 1171 1 1 4 HIS HE1 H -8.533 -7.878 -3.938 1.00 . A A . 4 HIS HE1 1 1
3 1172 1 1 4 HIS HE2 H -6.236 -7.559 -2.965 1.00 . A A . 4 HIS HE2 1 1
3 1173 1 1 4 HIS N N -6.799 -1.162 -3.995 1.00 . A A . 4 HIS N 1 1
3 1174 1 1 4 HIS ND1 N -8.287 -5.809 -4.462 1.00 . A A . 4 HIS ND1 1 1
3 1175 1 1 4 HIS NE2 N -6.657 -6.919 -3.614 1.00 . A A . 4 HIS NE2 1 1
3 1176 1 1 4 HIS O O -5.022 -2.095 -6.013 1.00 . A A . 4 HIS O 1 1
3 1177 1 1 5 TYR C C -1.962 -2.156 -4.914 1.00 . A A . 5 TYR C 1 1
3 1178 1 1 5 TYR CA C -2.729 -3.466 -4.885 1.00 . A A . 5 TYR CA 1 1
3 1179 1 1 5 TYR CB C -2.674 -4.209 -6.241 1.00 . A A . 5 TYR CB 1 1
3 1180 1 1 5 TYR CD1 C -3.087 -6.680 -5.734 1.00 . A A . 5 TYR CD1 1 1
3 1181 1 1 5 TYR CD2 C -4.847 -5.347 -6.724 1.00 . A A . 5 TYR CD2 1 1
3 1182 1 1 5 TYR CE1 C -3.929 -7.806 -5.766 1.00 . A A . 5 TYR CE1 1 1
3 1183 1 1 5 TYR CE2 C -5.695 -6.455 -6.732 1.00 . A A . 5 TYR CE2 1 1
3 1184 1 1 5 TYR CG C -3.544 -5.438 -6.214 1.00 . A A . 5 TYR CG 1 1
3 1185 1 1 5 TYR CZ C -5.233 -7.687 -6.266 1.00 . A A . 5 TYR CZ 1 1
3 1186 1 1 5 TYR H H -4.126 -3.643 -3.416 1.00 . A A . 5 TYR H 1 1
3 1187 1 1 5 TYR HA H -2.229 -4.091 -4.161 1.00 . A A . 5 TYR HA 1 1
3 1188 1 1 5 TYR HB2 H -3.019 -3.535 -7.053 1.00 . A A . 5 TYR HB2 1 1
3 1189 1 1 5 TYR HB3 H -1.635 -4.519 -6.474 1.00 . A A . 5 TYR HB3 1 1
3 1190 1 1 5 TYR HD1 H -2.083 -6.776 -5.345 1.00 . A A . 5 TYR HD1 1 1
3 1191 1 1 5 TYR HD2 H -5.198 -4.397 -7.100 1.00 . A A . 5 TYR HD2 1 1
3 1192 1 1 5 TYR HE1 H -3.570 -8.753 -5.389 1.00 . A A . 5 TYR HE1 1 1
3 1193 1 1 5 TYR HE2 H -6.710 -6.358 -7.084 1.00 . A A . 5 TYR HE2 1 1
3 1194 1 1 5 TYR HH H -5.596 -9.574 -6.372 1.00 . A A . 5 TYR HH 1 1
3 1195 1 1 5 TYR N N -4.054 -3.269 -4.350 1.00 . A A . 5 TYR N 1 1
3 1196 1 1 5 TYR O O -0.925 -2.036 -5.551 1.00 . A A . 5 TYR O 1 1
3 1197 1 1 5 TYR OH O -6.122 -8.777 -6.275 1.00 . A A . 5 TYR OH 1 1
3 1198 1 1 6 GLY C C -0.773 0.079 -2.946 1.00 . A A . 6 GLY C 1 1
3 1199 1 1 6 GLY CA C -1.773 0.146 -4.048 1.00 . A A . 6 GLY CA 1 1
3 1200 1 1 6 GLY H H -3.313 -1.234 -3.697 1.00 . A A . 6 GLY H 1 1
3 1201 1 1 6 GLY HA2 H -1.247 0.384 -4.964 1.00 . A A . 6 GLY HA2 1 1
3 1202 1 1 6 GLY HA3 H -2.512 0.882 -3.774 1.00 . A A . 6 GLY HA3 1 1
3 1203 1 1 6 GLY N N -2.450 -1.128 -4.191 1.00 . A A . 6 GLY N 1 1
3 1204 1 1 6 GLY O O -0.583 -0.954 -2.314 1.00 . A A . 6 GLY O 1 1
3 1205 1 1 7 GLN C C 0.407 1.836 -0.325 1.00 . A A . 7 GLN C 1 1
3 1206 1 1 7 GLN CA C 0.904 1.226 -1.630 1.00 . A A . 7 GLN CA 1 1
3 1207 1 1 7 GLN CB C 2.098 2.046 -2.145 1.00 . A A . 7 GLN CB 1 1
3 1208 1 1 7 GLN CD C 4.627 2.132 -1.939 1.00 . A A . 7 GLN CD 1 1
3 1209 1 1 7 GLN CG C 3.307 1.905 -1.212 1.00 . A A . 7 GLN CG 1 1
3 1210 1 1 7 GLN H H -0.222 2.024 -3.199 1.00 . A A . 7 GLN H 1 1
3 1211 1 1 7 GLN HA H 1.252 0.225 -1.416 1.00 . A A . 7 GLN HA 1 1
3 1212 1 1 7 GLN HB2 H 2.355 1.670 -3.161 1.00 . A A . 7 GLN HB2 1 1
3 1213 1 1 7 GLN HB3 H 1.821 3.111 -2.277 1.00 . A A . 7 GLN HB3 1 1
3 1214 1 1 7 GLN HE21 H 5.540 1.133 -0.452 1.00 . A A . 7 GLN HE21 1 1
3 1215 1 1 7 GLN HE22 H 6.551 1.529 -1.854 1.00 . A A . 7 GLN HE22 1 1
3 1216 1 1 7 GLN HG2 H 3.227 2.589 -0.347 1.00 . A A . 7 GLN HG2 1 1
3 1217 1 1 7 GLN HG3 H 3.301 0.863 -0.822 1.00 . A A . 7 GLN HG3 1 1
3 1218 1 1 7 GLN N N -0.102 1.194 -2.661 1.00 . A A . 7 GLN N 1 1
3 1219 1 1 7 GLN NE2 N 5.699 1.572 -1.340 1.00 . A A . 7 GLN NE2 1 1
3 1220 1 1 7 GLN O O 0.048 3.002 -0.262 1.00 . A A . 7 GLN O 1 1
3 1221 1 1 7 GLN OE1 O 4.741 2.709 -3.014 1.00 . A A . 7 GLN OE1 1 1
3 1222 1 1 8 CYS C C 1.320 1.987 2.876 1.00 . A A . 8 CYS C 1 1
3 1223 1 1 8 CYS CA C 0.072 1.676 2.090 1.00 . A A . 8 CYS CA 1 1
3 1224 1 1 8 CYS CB C -0.739 0.689 2.953 1.00 . A A . 8 CYS CB 1 1
3 1225 1 1 8 CYS H H 0.611 0.116 0.756 1.00 . A A . 8 CYS H 1 1
3 1226 1 1 8 CYS HA H -0.479 2.602 1.996 1.00 . A A . 8 CYS HA 1 1
3 1227 1 1 8 CYS HB2 H -0.804 1.021 4.012 1.00 . A A . 8 CYS HB2 1 1
3 1228 1 1 8 CYS HB3 H -1.774 0.751 2.566 1.00 . A A . 8 CYS HB3 1 1
3 1229 1 1 8 CYS N N 0.379 1.091 0.785 1.00 . A A . 8 CYS N 1 1
3 1230 1 1 8 CYS O O 1.273 2.601 3.933 1.00 . A A . 8 CYS O 1 1
3 1231 1 1 8 CYS SG S -0.074 -1.015 2.833 1.00 . A A . 8 CYS SG 1 1
3 1232 1 1 9 GLY C C 4.843 1.500 2.129 1.00 . A A . 9 GLY C 1 1
3 1233 1 1 9 GLY CA C 3.729 1.773 3.076 1.00 . A A . 9 GLY CA 1 1
3 1234 1 1 9 GLY H H 2.498 1.042 1.524 1.00 . A A . 9 GLY H 1 1
3 1235 1 1 9 GLY HA2 H 3.799 2.801 3.403 1.00 . A A . 9 GLY HA2 1 1
3 1236 1 1 9 GLY HA3 H 3.790 1.049 3.877 1.00 . A A . 9 GLY HA3 1 1
3 1237 1 1 9 GLY N N 2.482 1.572 2.370 1.00 . A A . 9 GLY N 1 1
3 1238 1 1 9 GLY O O 4.705 0.770 1.153 1.00 . A A . 9 GLY O 1 1
3 1239 1 1 10 GLY C C 8.326 2.438 2.074 1.00 . A A . 10 GLY C 1 1
3 1240 1 1 10 GLY CA C 7.132 1.841 1.462 1.00 . A A . 10 GLY CA 1 1
3 1241 1 1 10 GLY H H 6.176 2.697 3.120 1.00 . A A . 10 GLY H 1 1
3 1242 1 1 10 GLY HA2 H 7.291 0.778 1.335 1.00 . A A . 10 GLY HA2 1 1
3 1243 1 1 10 GLY HA3 H 6.979 2.400 0.557 1.00 . A A . 10 GLY HA3 1 1
3 1244 1 1 10 GLY N N 6.013 2.085 2.343 1.00 . A A . 10 GLY N 1 1
3 1245 1 1 10 GLY O O 8.216 3.194 3.026 1.00 . A A . 10 GLY O 1 1
3 1246 1 1 11 ILE C C 10.737 4.320 1.597 1.00 . A A . 11 ILE C 1 1
3 1247 1 1 11 ILE CA C 10.730 2.833 1.920 1.00 . A A . 11 ILE CA 1 1
3 1248 1 1 11 ILE CB C 11.937 2.093 1.352 1.00 . A A . 11 ILE CB 1 1
3 1249 1 1 11 ILE CD1 C 13.337 1.181 3.336 1.00 . A A . 11 ILE CD1 1 1
3 1250 1 1 11 ILE CG1 C 12.263 0.899 2.282 1.00 . A A . 11 ILE CG1 1 1
3 1251 1 1 11 ILE CG2 C 13.156 3.015 1.113 1.00 . A A . 11 ILE CG2 1 1
3 1252 1 1 11 ILE H H 9.565 1.542 0.727 1.00 . A A . 11 ILE H 1 1
3 1253 1 1 11 ILE HA H 10.783 2.781 3.000 1.00 . A A . 11 ILE HA 1 1
3 1254 1 1 11 ILE HB H 11.641 1.678 0.358 1.00 . A A . 11 ILE HB 1 1
3 1255 1 1 11 ILE HD11 H 13.355 0.365 4.091 1.00 . A A . 11 ILE HD11 1 1
3 1256 1 1 11 ILE HD12 H 13.146 2.142 3.857 1.00 . A A . 11 ILE HD12 1 1
3 1257 1 1 11 ILE HD13 H 14.342 1.220 2.861 1.00 . A A . 11 ILE HD13 1 1
3 1258 1 1 11 ILE HG12 H 11.333 0.553 2.788 1.00 . A A . 11 ILE HG12 1 1
3 1259 1 1 11 ILE HG13 H 12.622 0.044 1.671 1.00 . A A . 11 ILE HG13 1 1
3 1260 1 1 11 ILE HG21 H 12.973 3.716 0.272 1.00 . A A . 11 ILE HG21 1 1
3 1261 1 1 11 ILE HG22 H 14.054 2.417 0.868 1.00 . A A . 11 ILE HG22 1 1
3 1262 1 1 11 ILE HG23 H 13.381 3.610 2.024 1.00 . A A . 11 ILE HG23 1 1
3 1263 1 1 11 ILE N N 9.501 2.173 1.495 1.00 . A A . 11 ILE N 1 1
3 1264 1 1 11 ILE O O 11.297 5.145 2.311 1.00 . A A . 11 ILE O 1 1
3 1265 1 1 12 GLY C C 8.624 6.474 -0.297 1.00 . A A . 12 GLY C 1 1
3 1266 1 1 12 GLY CA C 10.020 6.075 0.025 1.00 . A A . 12 GLY CA 1 1
3 1267 1 1 12 GLY H H 9.601 4.005 -0.044 1.00 . A A . 12 GLY H 1 1
3 1268 1 1 12 GLY HA2 H 10.353 6.757 0.795 1.00 . A A . 12 GLY HA2 1 1
3 1269 1 1 12 GLY HA3 H 10.598 6.138 -0.884 1.00 . A A . 12 GLY HA3 1 1
3 1270 1 1 12 GLY N N 10.067 4.698 0.494 1.00 . A A . 12 GLY N 1 1
3 1271 1 1 12 GLY O O 8.388 7.378 -1.087 1.00 . A A . 12 GLY O 1 1
3 1272 1 1 13 TYR C C 5.708 7.144 0.994 1.00 . A A . 13 TYR C 1 1
3 1273 1 1 13 TYR CA C 6.248 6.090 0.034 1.00 . A A . 13 TYR CA 1 1
3 1274 1 1 13 TYR CB C 5.387 4.818 0.092 1.00 . A A . 13 TYR CB 1 1
3 1275 1 1 13 TYR CD1 C 3.861 5.385 -1.804 1.00 . A A . 13 TYR CD1 1 1
3 1276 1 1 13 TYR CD2 C 2.906 5.149 0.414 1.00 . A A . 13 TYR CD2 1 1
3 1277 1 1 13 TYR CE1 C 2.599 5.662 -2.328 1.00 . A A . 13 TYR CE1 1 1
3 1278 1 1 13 TYR CE2 C 1.639 5.408 -0.116 1.00 . A A . 13 TYR CE2 1 1
3 1279 1 1 13 TYR CG C 4.022 5.124 -0.434 1.00 . A A . 13 TYR CG 1 1
3 1280 1 1 13 TYR CZ C 1.493 5.658 -1.489 1.00 . A A . 13 TYR CZ 1 1
3 1281 1 1 13 TYR H H 7.840 5.147 1.030 1.00 . A A . 13 TYR H 1 1
3 1282 1 1 13 TYR HA H 6.178 6.491 -0.971 1.00 . A A . 13 TYR HA 1 1
3 1283 1 1 13 TYR HB2 H 5.843 4.052 -0.564 1.00 . A A . 13 TYR HB2 1 1
3 1284 1 1 13 TYR HB3 H 5.316 4.420 1.126 1.00 . A A . 13 TYR HB3 1 1
3 1285 1 1 13 TYR HD1 H 4.707 5.321 -2.474 1.00 . A A . 13 TYR HD1 1 1
3 1286 1 1 13 TYR HD2 H 3.017 4.951 1.473 1.00 . A A . 13 TYR HD2 1 1
3 1287 1 1 13 TYR HE1 H 2.460 5.816 -3.389 1.00 . A A . 13 TYR HE1 1 1
3 1288 1 1 13 TYR HE2 H 0.789 5.388 0.550 1.00 . A A . 13 TYR HE2 1 1
3 1289 1 1 13 TYR HH H -0.408 5.442 -1.532 1.00 . A A . 13 TYR HH 1 1
3 1290 1 1 13 TYR N N 7.634 5.794 0.302 1.00 . A A . 13 TYR N 1 1
3 1291 1 1 13 TYR O O 5.911 7.100 2.200 1.00 . A A . 13 TYR O 1 1
3 1292 1 1 13 TYR OH O 0.253 5.857 -2.098 1.00 . A A . 13 TYR OH 1 1
3 1293 1 1 14 SER C C 3.065 9.556 1.006 1.00 . A A . 14 SER C 1 1
3 1294 1 1 14 SER CA C 4.561 9.351 1.093 1.00 . A A . 14 SER CA 1 1
3 1295 1 1 14 SER CB C 5.298 10.620 0.558 1.00 . A A . 14 SER CB 1 1
3 1296 1 1 14 SER H H 4.844 8.084 -0.549 1.00 . A A . 14 SER H 1 1
3 1297 1 1 14 SER HA H 4.778 9.262 2.148 1.00 . A A . 14 SER HA 1 1
3 1298 1 1 14 SER HB2 H 5.135 11.467 1.260 1.00 . A A . 14 SER HB2 1 1
3 1299 1 1 14 SER HB3 H 6.389 10.437 0.471 1.00 . A A . 14 SER HB3 1 1
3 1300 1 1 14 SER N N 5.005 8.132 0.428 1.00 . A A . 14 SER N 1 1
3 1301 1 1 14 SER O O 2.556 10.656 1.185 1.00 . A A . 14 SER O 1 1
3 1302 1 1 15 GLY C C 0.163 7.949 1.690 1.00 . A A . 15 GLY C 1 1
3 1303 1 1 15 GLY CA C 0.874 8.554 0.509 1.00 . A A . 15 GLY CA 1 1
3 1304 1 1 15 GLY H H 2.730 7.579 0.707 1.00 . A A . 15 GLY H 1 1
3 1305 1 1 15 GLY HA2 H 0.555 9.582 0.413 1.00 . A A . 15 GLY HA2 1 1
3 1306 1 1 15 GLY HA3 H 0.641 7.966 -0.364 1.00 . A A . 15 GLY HA3 1 1
3 1307 1 1 15 GLY N N 2.316 8.486 0.694 1.00 . A A . 15 GLY N 1 1
3 1308 1 1 15 GLY O O 0.804 7.555 2.662 1.00 . A A . 15 GLY O 1 1
3 1309 1 1 16 PRO C C -1.463 5.928 3.326 1.00 . A A . 16 PRO C 1 1
3 1310 1 1 16 PRO CA C -1.977 7.221 2.688 1.00 . A A . 16 PRO CA 1 1
3 1311 1 1 16 PRO CB C -3.348 7.030 2.026 1.00 . A A . 16 PRO CB 1 1
3 1312 1 1 16 PRO CD C -1.968 8.426 0.573 1.00 . A A . 16 PRO CD 1 1
3 1313 1 1 16 PRO CG C -3.424 8.084 0.907 1.00 . A A . 16 PRO CG 1 1
3 1314 1 1 16 PRO HA H -2.009 7.942 3.492 1.00 . A A . 16 PRO HA 1 1
3 1315 1 1 16 PRO HB2 H -3.407 6.024 1.554 1.00 . A A . 16 PRO HB2 1 1
3 1316 1 1 16 PRO HB3 H -4.176 7.133 2.752 1.00 . A A . 16 PRO HB3 1 1
3 1317 1 1 16 PRO HD2 H -1.684 7.981 -0.410 1.00 . A A . 16 PRO HD2 1 1
3 1318 1 1 16 PRO HD3 H -1.827 9.531 0.531 1.00 . A A . 16 PRO HD3 1 1
3 1319 1 1 16 PRO HG2 H -3.937 7.682 0.004 1.00 . A A . 16 PRO HG2 1 1
3 1320 1 1 16 PRO HG3 H -3.956 8.996 1.249 1.00 . A A . 16 PRO HG3 1 1
3 1321 1 1 16 PRO N N -1.161 7.847 1.651 1.00 . A A . 16 PRO N 1 1
3 1322 1 1 16 PRO O O -1.142 4.977 2.622 1.00 . A A . 16 PRO O 1 1
3 1323 1 1 17 THR C C -1.971 3.671 5.762 1.00 . A A . 17 THR C 1 1
3 1324 1 1 17 THR CA C -0.907 4.701 5.404 1.00 . A A . 17 THR CA 1 1
3 1325 1 1 17 THR CB C -0.152 5.189 6.648 1.00 . A A . 17 THR CB 1 1
3 1326 1 1 17 THR CG2 C -1.039 6.152 7.456 1.00 . A A . 17 THR CG2 1 1
3 1327 1 1 17 THR H H -1.745 6.609 5.220 1.00 . A A . 17 THR H 1 1
3 1328 1 1 17 THR HA H -0.191 4.190 4.781 1.00 . A A . 17 THR HA 1 1
3 1329 1 1 17 THR HB H 0.761 5.737 6.312 1.00 . A A . 17 THR HB 1 1
3 1330 1 1 17 THR HG1 H -0.431 3.503 7.548 1.00 . A A . 17 THR HG1 1 1
3 1331 1 1 17 THR HG21 H -2.089 5.802 7.499 1.00 . A A . 17 THR HG21 1 1
3 1332 1 1 17 THR HG22 H -1.002 7.171 7.017 1.00 . A A . 17 THR HG22 1 1
3 1333 1 1 17 THR HG23 H -0.662 6.227 8.500 1.00 . A A . 17 THR HG23 1 1
3 1334 1 1 17 THR N N -1.473 5.833 4.664 1.00 . A A . 17 THR N 1 1
3 1335 1 1 17 THR O O -1.841 2.855 6.670 1.00 . A A . 17 THR O 1 1
3 1336 1 1 17 THR OG1 O 0.282 4.163 7.531 1.00 . A A . 17 THR OG1 1 1
3 1337 1 1 18 VAL C C -4.659 2.167 4.118 1.00 . A A . 18 VAL C 1 1
3 1338 1 1 18 VAL CA C -4.241 2.841 5.397 1.00 . A A . 18 VAL CA 1 1
3 1339 1 1 18 VAL CB C -5.433 3.610 5.983 1.00 . A A . 18 VAL CB 1 1
3 1340 1 1 18 VAL CG1 C -6.544 2.649 6.460 1.00 . A A . 18 VAL CG1 1 1
3 1341 1 1 18 VAL CG2 C -4.980 4.464 7.184 1.00 . A A . 18 VAL CG2 1 1
3 1342 1 1 18 VAL H H -3.155 4.255 4.245 1.00 . A A . 18 VAL H 1 1
3 1343 1 1 18 VAL HA H -3.948 2.062 6.088 1.00 . A A . 18 VAL HA 1 1
3 1344 1 1 18 VAL HB H -5.852 4.295 5.212 1.00 . A A . 18 VAL HB 1 1
3 1345 1 1 18 VAL HG11 H -6.698 1.789 5.785 1.00 . A A . 18 VAL HG11 1 1
3 1346 1 1 18 VAL HG12 H -7.513 3.186 6.536 1.00 . A A . 18 VAL HG12 1 1
3 1347 1 1 18 VAL HG13 H -6.302 2.237 7.462 1.00 . A A . 18 VAL HG13 1 1
3 1348 1 1 18 VAL HG21 H -5.698 4.353 8.026 1.00 . A A . 18 VAL HG21 1 1
3 1349 1 1 18 VAL HG22 H -4.919 5.538 6.920 1.00 . A A . 18 VAL HG22 1 1
3 1350 1 1 18 VAL HG23 H -3.992 4.131 7.567 1.00 . A A . 18 VAL HG23 1 1
3 1351 1 1 18 VAL N N -3.114 3.693 5.063 1.00 . A A . 18 VAL N 1 1
3 1352 1 1 18 VAL O O -4.828 2.816 3.091 1.00 . A A . 18 VAL O 1 1
3 1353 1 1 19 CYS C C -6.970 0.310 3.020 1.00 . A A . 19 CYS C 1 1
3 1354 1 1 19 CYS CA C -5.477 0.168 3.001 1.00 . A A . 19 CYS CA 1 1
3 1355 1 1 19 CYS CB C -5.064 -1.297 3.018 1.00 . A A . 19 CYS CB 1 1
3 1356 1 1 19 CYS H H -4.738 0.309 4.948 1.00 . A A . 19 CYS H 1 1
3 1357 1 1 19 CYS HA H -5.161 0.626 2.077 1.00 . A A . 19 CYS HA 1 1
3 1358 1 1 19 CYS HB2 H -5.192 -1.716 4.041 1.00 . A A . 19 CYS HB2 1 1
3 1359 1 1 19 CYS HB3 H -5.639 -1.942 2.340 1.00 . A A . 19 CYS HB3 1 1
3 1360 1 1 19 CYS N N -4.870 0.851 4.123 1.00 . A A . 19 CYS N 1 1
3 1361 1 1 19 CYS O O -7.570 0.393 4.084 1.00 . A A . 19 CYS O 1 1
3 1362 1 1 19 CYS SG S -3.351 -1.364 2.510 1.00 . A A . 19 CYS SG 1 1
3 1363 1 1 20 ALA C C -9.840 -0.383 2.508 1.00 . A A . 20 ALA C 1 1
3 1364 1 1 20 ALA CA C -9.033 0.493 1.606 1.00 . A A . 20 ALA CA 1 1
3 1365 1 1 20 ALA CB C -9.404 0.135 0.142 1.00 . A A . 20 ALA CB 1 1
3 1366 1 1 20 ALA H H -7.058 0.342 0.985 1.00 . A A . 20 ALA H 1 1
3 1367 1 1 20 ALA HA H -9.343 1.484 1.864 1.00 . A A . 20 ALA HA 1 1
3 1368 1 1 20 ALA HB1 H -10.418 0.503 -0.119 1.00 . A A . 20 ALA HB1 1 1
3 1369 1 1 20 ALA HB2 H -9.387 -0.961 -0.024 1.00 . A A . 20 ALA HB2 1 1
3 1370 1 1 20 ALA HB3 H -8.685 0.585 -0.571 1.00 . A A . 20 ALA HB3 1 1
3 1371 1 1 20 ALA N N -7.595 0.441 1.827 1.00 . A A . 20 ALA N 1 1
3 1372 1 1 20 ALA O O -9.388 -1.450 2.859 1.00 . A A . 20 ALA O 1 1
3 1373 1 1 21 SER C C -12.223 -2.256 3.143 1.00 . A A . 21 SER C 1 1
3 1374 1 1 21 SER CA C -11.854 -0.900 3.741 1.00 . A A . 21 SER CA 1 1
3 1375 1 1 21 SER CB C -13.126 -0.187 4.252 1.00 . A A . 21 SER CB 1 1
3 1376 1 1 21 SER H H -11.458 0.864 2.649 1.00 . A A . 21 SER H 1 1
3 1377 1 1 21 SER HA H -11.224 -1.140 4.592 1.00 . A A . 21 SER HA 1 1
3 1378 1 1 21 SER HB2 H -13.255 0.760 3.681 1.00 . A A . 21 SER HB2 1 1
3 1379 1 1 21 SER HB3 H -14.056 -0.782 4.113 1.00 . A A . 21 SER HB3 1 1
3 1380 1 1 21 SER HG H -12.879 -0.680 6.107 1.00 . A A . 21 SER HG 1 1
3 1381 1 1 21 SER N N -11.072 -0.023 2.871 1.00 . A A . 21 SER N 1 1
3 1382 1 1 21 SER O O -12.701 -3.143 3.838 1.00 . A A . 21 SER O 1 1
3 1383 1 1 21 SER OG O -12.967 0.155 5.625 1.00 . A A . 21 SER OG 1 1
3 1384 1 1 22 GLY C C -10.654 -4.330 0.897 1.00 . A A . 22 GLY C 1 1
3 1385 1 1 22 GLY CA C -12.010 -3.710 1.127 1.00 . A A . 22 GLY CA 1 1
3 1386 1 1 22 GLY H H -11.587 -1.662 1.337 1.00 . A A . 22 GLY H 1 1
3 1387 1 1 22 GLY HA2 H -12.599 -4.425 1.685 1.00 . A A . 22 GLY HA2 1 1
3 1388 1 1 22 GLY HA3 H -12.413 -3.513 0.146 1.00 . A A . 22 GLY HA3 1 1
3 1389 1 1 22 GLY N N -11.960 -2.436 1.832 1.00 . A A . 22 GLY N 1 1
3 1390 1 1 22 GLY O O -10.567 -5.366 0.251 1.00 . A A . 22 GLY O 1 1
3 1391 1 1 23 THR C C -7.417 -4.085 2.489 1.00 . A A . 23 THR C 1 1
3 1392 1 1 23 THR CA C -8.184 -4.109 1.153 1.00 . A A . 23 THR CA 1 1
3 1393 1 1 23 THR CB C -7.395 -3.263 0.126 1.00 . A A . 23 THR CB 1 1
3 1394 1 1 23 THR CG2 C -8.101 -3.082 -1.223 1.00 . A A . 23 THR CG2 1 1
3 1395 1 1 23 THR H H -9.675 -2.904 1.987 1.00 . A A . 23 THR H 1 1
3 1396 1 1 23 THR HA H -8.214 -5.130 0.819 1.00 . A A . 23 THR HA 1 1
3 1397 1 1 23 THR HB H -6.402 -3.724 -0.060 1.00 . A A . 23 THR HB 1 1
3 1398 1 1 23 THR HG1 H -7.804 -1.821 1.280 1.00 . A A . 23 THR HG1 1 1
3 1399 1 1 23 THR HG21 H -7.974 -3.991 -1.841 1.00 . A A . 23 THR HG21 1 1
3 1400 1 1 23 THR HG22 H -7.654 -2.220 -1.760 1.00 . A A . 23 THR HG22 1 1
3 1401 1 1 23 THR HG23 H -9.180 -2.881 -1.101 1.00 . A A . 23 THR HG23 1 1
3 1402 1 1 23 THR N N -9.567 -3.683 1.364 1.00 . A A . 23 THR N 1 1
3 1403 1 1 23 THR O O -7.811 -3.462 3.466 1.00 . A A . 23 THR O 1 1
3 1404 1 1 23 THR OG1 O -7.158 -1.947 0.567 1.00 . A A . 23 THR OG1 1 1
3 1405 1 1 24 THR C C -4.022 -4.568 3.620 1.00 . A A . 24 THR C 1 1
3 1406 1 1 24 THR CA C -5.485 -4.879 3.832 1.00 . A A . 24 THR CA 1 1
3 1407 1 1 24 THR CB C -5.553 -6.262 4.460 1.00 . A A . 24 THR CB 1 1
3 1408 1 1 24 THR CG2 C -6.907 -6.405 5.171 1.00 . A A . 24 THR CG2 1 1
3 1409 1 1 24 THR H H -6.058 -5.393 1.834 1.00 . A A . 24 THR H 1 1
3 1410 1 1 24 THR HA H -5.842 -4.162 4.556 1.00 . A A . 24 THR HA 1 1
3 1411 1 1 24 THR HB H -4.763 -6.413 5.237 1.00 . A A . 24 THR HB 1 1
3 1412 1 1 24 THR HG1 H -5.987 -7.067 2.719 1.00 . A A . 24 THR HG1 1 1
3 1413 1 1 24 THR HG21 H -7.052 -7.444 5.532 1.00 . A A . 24 THR HG21 1 1
3 1414 1 1 24 THR HG22 H -7.747 -6.146 4.492 1.00 . A A . 24 THR HG22 1 1
3 1415 1 1 24 THR HG23 H -6.949 -5.720 6.045 1.00 . A A . 24 THR HG23 1 1
3 1416 1 1 24 THR N N -6.266 -4.761 2.593 1.00 . A A . 24 THR N 1 1
3 1417 1 1 24 THR O O -3.463 -4.883 2.581 1.00 . A A . 24 THR O 1 1
3 1418 1 1 24 THR OG1 O -5.415 -7.291 3.483 1.00 . A A . 24 THR OG1 1 1
3 1419 1 1 25 CYS C C -1.008 -4.686 4.762 1.00 . A A . 25 CYS C 1 1
3 1420 1 1 25 CYS CA C -1.929 -3.551 4.396 1.00 . A A . 25 CYS CA 1 1
3 1421 1 1 25 CYS CB C -1.503 -2.289 5.204 1.00 . A A . 25 CYS CB 1 1
3 1422 1 1 25 CYS H H -3.738 -3.717 5.469 1.00 . A A . 25 CYS H 1 1
3 1423 1 1 25 CYS HA H -1.760 -3.356 3.345 1.00 . A A . 25 CYS HA 1 1
3 1424 1 1 25 CYS HB2 H -2.262 -1.497 5.047 1.00 . A A . 25 CYS HB2 1 1
3 1425 1 1 25 CYS HB3 H -1.508 -2.531 6.288 1.00 . A A . 25 CYS HB3 1 1
3 1426 1 1 25 CYS N N -3.333 -3.917 4.585 1.00 . A A . 25 CYS N 1 1
3 1427 1 1 25 CYS O O -1.068 -5.229 5.863 1.00 . A A . 25 CYS O 1 1
3 1428 1 1 25 CYS SG S 0.136 -1.617 4.752 1.00 . A A . 25 CYS SG 1 1
3 1429 1 1 26 GLN C C 2.070 -5.845 3.336 1.00 . A A . 26 GLN C 1 1
3 1430 1 1 26 GLN CA C 0.769 -6.179 4.028 1.00 . A A . 26 GLN CA 1 1
3 1431 1 1 26 GLN CB C 0.210 -7.510 3.459 1.00 . A A . 26 GLN CB 1 1
3 1432 1 1 26 GLN CD C -1.781 -9.073 3.206 1.00 . A A . 26 GLN CD 1 1
3 1433 1 1 26 GLN CG C -1.264 -7.788 3.850 1.00 . A A . 26 GLN CG 1 1
3 1434 1 1 26 GLN H H -0.129 -4.643 2.918 1.00 . A A . 26 GLN H 1 1
3 1435 1 1 26 GLN HA H 0.982 -6.282 5.084 1.00 . A A . 26 GLN HA 1 1
3 1436 1 1 26 GLN HB2 H 0.279 -7.492 2.349 1.00 . A A . 26 GLN HB2 1 1
3 1437 1 1 26 GLN HB3 H 0.839 -8.357 3.816 1.00 . A A . 26 GLN HB3 1 1
3 1438 1 1 26 GLN HE21 H -3.640 -8.256 2.920 1.00 . A A . 26 GLN HE21 1 1
3 1439 1 1 26 GLN HE22 H -3.389 -9.856 2.280 1.00 . A A . 26 GLN HE22 1 1
3 1440 1 1 26 GLN HG2 H -1.355 -7.885 4.951 1.00 . A A . 26 GLN HG2 1 1
3 1441 1 1 26 GLN HG3 H -1.907 -6.947 3.519 1.00 . A A . 26 GLN HG3 1 1
3 1442 1 1 26 GLN N N -0.130 -5.072 3.827 1.00 . A A . 26 GLN N 1 1
3 1443 1 1 26 GLN NE2 N -3.059 -9.061 2.775 1.00 . A A . 26 GLN NE2 1 1
3 1444 1 1 26 GLN O O 2.230 -4.830 2.660 1.00 . A A . 26 GLN O 1 1
3 1445 1 1 26 GLN OE1 O -1.071 -10.070 3.082 1.00 . A A . 26 GLN OE1 1 1
3 1446 1 1 27 VAL C C 4.608 -7.421 1.798 1.00 . A A . 27 VAL C 1 1
3 1447 1 1 27 VAL CA C 4.397 -6.483 2.962 1.00 . A A . 27 VAL CA 1 1
3 1448 1 1 27 VAL CB C 5.458 -6.665 4.041 1.00 . A A . 27 VAL CB 1 1
3 1449 1 1 27 VAL CG1 C 6.864 -6.902 3.454 1.00 . A A . 27 VAL CG1 1 1
3 1450 1 1 27 VAL CG2 C 5.453 -5.407 4.934 1.00 . A A . 27 VAL CG2 1 1
3 1451 1 1 27 VAL H H 2.937 -7.554 3.999 1.00 . A A . 27 VAL H 1 1
3 1452 1 1 27 VAL HA H 4.496 -5.479 2.576 1.00 . A A . 27 VAL HA 1 1
3 1453 1 1 27 VAL HB H 5.177 -7.552 4.659 1.00 . A A . 27 VAL HB 1 1
3 1454 1 1 27 VAL HG11 H 7.113 -6.109 2.723 1.00 . A A . 27 VAL HG11 1 1
3 1455 1 1 27 VAL HG12 H 6.929 -7.894 2.954 1.00 . A A . 27 VAL HG12 1 1
3 1456 1 1 27 VAL HG13 H 7.624 -6.883 4.263 1.00 . A A . 27 VAL HG13 1 1
3 1457 1 1 27 VAL HG21 H 4.451 -4.928 4.966 1.00 . A A . 27 VAL HG21 1 1
3 1458 1 1 27 VAL HG22 H 6.183 -4.661 4.556 1.00 . A A . 27 VAL HG22 1 1
3 1459 1 1 27 VAL HG23 H 5.737 -5.675 5.974 1.00 . A A . 27 VAL HG23 1 1
3 1460 1 1 27 VAL N N 3.079 -6.698 3.512 1.00 . A A . 27 VAL N 1 1
3 1461 1 1 27 VAL O O 4.490 -8.633 1.925 1.00 . A A . 27 VAL O 1 1
3 1462 1 1 28 LEU C C 6.883 -7.694 -0.587 1.00 . A A . 28 LEU C 1 1
3 1463 1 1 28 LEU CA C 5.352 -7.668 -0.521 1.00 . A A . 28 LEU CA 1 1
3 1464 1 1 28 LEU CB C 4.632 -7.083 -1.783 1.00 . A A . 28 LEU CB 1 1
3 1465 1 1 28 LEU CD1 C 5.704 -8.794 -3.426 1.00 . A A . 28 LEU CD1 1 1
3 1466 1 1 28 LEU CD2 C 4.198 -6.953 -4.300 1.00 . A A . 28 LEU CD2 1 1
3 1467 1 1 28 LEU CG C 5.198 -7.362 -3.202 1.00 . A A . 28 LEU CG 1 1
3 1468 1 1 28 LEU H H 4.938 -5.878 0.496 1.00 . A A . 28 LEU H 1 1
3 1469 1 1 28 LEU HA H 5.040 -8.698 -0.405 1.00 . A A . 28 LEU HA 1 1
3 1470 1 1 28 LEU HB2 H 3.591 -7.478 -1.751 1.00 . A A . 28 LEU HB2 1 1
3 1471 1 1 28 LEU HB3 H 4.550 -5.978 -1.671 1.00 . A A . 28 LEU HB3 1 1
3 1472 1 1 28 LEU HD11 H 5.265 -9.257 -4.330 1.00 . A A . 28 LEU HD11 1 1
3 1473 1 1 28 LEU HD12 H 5.481 -9.439 -2.553 1.00 . A A . 28 LEU HD12 1 1
3 1474 1 1 28 LEU HD13 H 6.810 -8.772 -3.561 1.00 . A A . 28 LEU HD13 1 1
3 1475 1 1 28 LEU HD21 H 4.618 -6.123 -4.908 1.00 . A A . 28 LEU HD21 1 1
3 1476 1 1 28 LEU HD22 H 3.231 -6.626 -3.861 1.00 . A A . 28 LEU HD22 1 1
3 1477 1 1 28 LEU HD23 H 3.989 -7.791 -4.994 1.00 . A A . 28 LEU HD23 1 1
3 1478 1 1 28 LEU HG H 6.086 -6.710 -3.349 1.00 . A A . 28 LEU HG 1 1
3 1479 1 1 28 LEU N N 4.938 -6.867 0.617 1.00 . A A . 28 LEU N 1 1
3 1480 1 1 28 LEU O O 7.533 -8.599 -1.095 1.00 . A A . 28 LEU O 1 1
3 1481 1 1 29 ASN C C 9.371 -5.408 0.797 1.00 . A A . 29 ASN C 1 1
3 1482 1 1 29 ASN CA C 8.946 -6.442 -0.220 1.00 . A A . 29 ASN CA 1 1
3 1483 1 1 29 ASN CB C 9.391 -5.987 -1.667 1.00 . A A . 29 ASN CB 1 1
3 1484 1 1 29 ASN CG C 8.337 -5.424 -2.622 1.00 . A A . 29 ASN CG 1 1
3 1485 1 1 29 ASN H H 7.040 -6.010 0.547 1.00 . A A . 29 ASN H 1 1
3 1486 1 1 29 ASN HA H 9.452 -7.363 0.035 1.00 . A A . 29 ASN HA 1 1
3 1487 1 1 29 ASN HB2 H 10.196 -5.225 -1.651 1.00 . A A . 29 ASN HB2 1 1
3 1488 1 1 29 ASN HB3 H 9.798 -6.883 -2.185 1.00 . A A . 29 ASN HB3 1 1
3 1489 1 1 29 ASN HD21 H 7.106 -4.839 -1.098 1.00 . A A . 29 ASN HD21 1 1
3 1490 1 1 29 ASN HD22 H 6.516 -4.597 -2.708 1.00 . A A . 29 ASN HD22 1 1
3 1491 1 1 29 ASN N N 7.534 -6.676 -0.008 1.00 . A A . 29 ASN N 1 1
3 1492 1 1 29 ASN ND2 N 7.250 -4.870 -2.093 1.00 . A A . 29 ASN ND2 1 1
3 1493 1 1 29 ASN O O 8.519 -4.645 1.256 1.00 . A A . 29 ASN O 1 1
3 1494 1 1 29 ASN OD1 O 8.490 -5.475 -3.831 1.00 . A A . 29 ASN OD1 1 1
3 1495 1 1 30 PRO C C 11.047 -2.888 1.659 1.00 . A A . 30 PRO C 1 1
3 1496 1 1 30 PRO CA C 11.082 -4.325 2.159 1.00 . A A . 30 PRO CA 1 1
3 1497 1 1 30 PRO CB C 12.517 -4.793 2.503 1.00 . A A . 30 PRO CB 1 1
3 1498 1 1 30 PRO CD C 11.734 -6.094 0.598 1.00 . A A . 30 PRO CD 1 1
3 1499 1 1 30 PRO CG C 12.998 -5.696 1.354 1.00 . A A . 30 PRO CG 1 1
3 1500 1 1 30 PRO HA H 10.420 -4.368 3.013 1.00 . A A . 30 PRO HA 1 1
3 1501 1 1 30 PRO HB2 H 13.222 -3.951 2.676 1.00 . A A . 30 PRO HB2 1 1
3 1502 1 1 30 PRO HB3 H 12.475 -5.397 3.436 1.00 . A A . 30 PRO HB3 1 1
3 1503 1 1 30 PRO HD2 H 11.875 -5.879 -0.486 1.00 . A A . 30 PRO HD2 1 1
3 1504 1 1 30 PRO HD3 H 11.516 -7.177 0.738 1.00 . A A . 30 PRO HD3 1 1
3 1505 1 1 30 PRO HG2 H 13.689 -5.144 0.682 1.00 . A A . 30 PRO HG2 1 1
3 1506 1 1 30 PRO HG3 H 13.531 -6.591 1.739 1.00 . A A . 30 PRO HG3 1 1
3 1507 1 1 30 PRO N N 10.645 -5.276 1.143 1.00 . A A . 30 PRO N 1 1
3 1508 1 1 30 PRO O O 11.398 -1.995 2.414 1.00 . A A . 30 PRO O 1 1
3 1509 1 1 31 TYR C C 9.165 -1.005 -0.707 1.00 . A A . 31 TYR C 1 1
3 1510 1 1 31 TYR CA C 10.565 -1.317 -0.196 1.00 . A A . 31 TYR CA 1 1
3 1511 1 1 31 TYR CB C 11.624 -1.187 -1.340 1.00 . A A . 31 TYR CB 1 1
3 1512 1 1 31 TYR CD1 C 13.616 -2.332 -0.259 1.00 . A A . 31 TYR CD1 1 1
3 1513 1 1 31 TYR CD2 C 13.776 0.029 -0.725 1.00 . A A . 31 TYR CD2 1 1
3 1514 1 1 31 TYR CE1 C 14.852 -2.294 0.398 1.00 . A A . 31 TYR CE1 1 1
3 1515 1 1 31 TYR CE2 C 15.035 0.065 -0.101 1.00 . A A . 31 TYR CE2 1 1
3 1516 1 1 31 TYR CG C 13.028 -1.163 -0.771 1.00 . A A . 31 TYR CG 1 1
3 1517 1 1 31 TYR CZ C 15.562 -1.097 0.472 1.00 . A A . 31 TYR CZ 1 1
3 1518 1 1 31 TYR H H 10.324 -3.404 -0.148 1.00 . A A . 31 TYR H 1 1
3 1519 1 1 31 TYR HA H 10.756 -0.565 0.555 1.00 . A A . 31 TYR HA 1 1
3 1520 1 1 31 TYR HB2 H 11.549 -2.043 -2.042 1.00 . A A . 31 TYR HB2 1 1
3 1521 1 1 31 TYR HB3 H 11.470 -0.248 -1.916 1.00 . A A . 31 TYR HB3 1 1
3 1522 1 1 31 TYR HD1 H 13.081 -3.263 -0.321 1.00 . A A . 31 TYR HD1 1 1
3 1523 1 1 31 TYR HD2 H 13.357 0.940 -1.127 1.00 . A A . 31 TYR HD2 1 1
3 1524 1 1 31 TYR HE1 H 15.266 -3.184 0.846 1.00 . A A . 31 TYR HE1 1 1
3 1525 1 1 31 TYR HE2 H 15.579 0.994 -0.038 1.00 . A A . 31 TYR HE2 1 1
3 1526 1 1 31 TYR HH H 17.280 -0.294 0.834 1.00 . A A . 31 TYR HH 1 1
3 1527 1 1 31 TYR N N 10.607 -2.637 0.410 1.00 . A A . 31 TYR N 1 1
3 1528 1 1 31 TYR O O 8.893 0.088 -1.201 1.00 . A A . 31 TYR O 1 1
3 1529 1 1 31 TYR OH O 16.820 -1.092 1.100 1.00 . A A . 31 TYR OH 1 1
3 1530 1 1 32 TYR C C 5.869 -2.579 -0.151 1.00 . A A . 32 TYR C 1 1
3 1531 1 1 32 TYR CA C 6.864 -1.794 -1.031 1.00 . A A . 32 TYR CA 1 1
3 1532 1 1 32 TYR CB C 6.781 -1.920 -2.606 1.00 . A A . 32 TYR CB 1 1
3 1533 1 1 32 TYR CD1 C 4.500 -1.127 -3.089 1.00 . A A . 32 TYR CD1 1 1
3 1534 1 1 32 TYR CD2 C 4.962 -3.398 -3.729 1.00 . A A . 32 TYR CD2 1 1
3 1535 1 1 32 TYR CE1 C 3.174 -1.254 -3.490 1.00 . A A . 32 TYR CE1 1 1
3 1536 1 1 32 TYR CE2 C 3.630 -3.532 -4.145 1.00 . A A . 32 TYR CE2 1 1
3 1537 1 1 32 TYR CG C 5.397 -2.192 -3.140 1.00 . A A . 32 TYR CG 1 1
3 1538 1 1 32 TYR CZ C 2.748 -2.466 -4.002 1.00 . A A . 32 TYR CZ 1 1
3 1539 1 1 32 TYR H H 8.403 -2.757 0.012 1.00 . A A . 32 TYR H 1 1
3 1540 1 1 32 TYR HA H 6.583 -0.772 -0.841 1.00 . A A . 32 TYR HA 1 1
3 1541 1 1 32 TYR HB2 H 7.135 -0.965 -3.053 1.00 . A A . 32 TYR HB2 1 1
3 1542 1 1 32 TYR HB3 H 7.478 -2.674 -3.010 1.00 . A A . 32 TYR HB3 1 1
3 1543 1 1 32 TYR HD1 H 4.863 -0.187 -2.759 1.00 . A A . 32 TYR HD1 1 1
3 1544 1 1 32 TYR HD2 H 5.629 -4.226 -3.894 1.00 . A A . 32 TYR HD2 1 1
3 1545 1 1 32 TYR HE1 H 2.495 -0.424 -3.423 1.00 . A A . 32 TYR HE1 1 1
3 1546 1 1 32 TYR HE2 H 3.264 -4.448 -4.578 1.00 . A A . 32 TYR HE2 1 1
3 1547 1 1 32 TYR HH H 0.936 -1.818 -4.194 1.00 . A A . 32 TYR HH 1 1
3 1548 1 1 32 TYR N N 8.217 -1.945 -0.539 1.00 . A A . 32 TYR N 1 1
3 1549 1 1 32 TYR O O 5.912 -3.801 0.001 1.00 . A A . 32 TYR O 1 1
3 1550 1 1 32 TYR OH O 1.429 -2.619 -4.400 1.00 . A A . 32 TYR OH 1 1
3 1551 1 1 33 SER C C 2.623 -2.265 0.591 1.00 . A A . 33 SER C 1 1
3 1552 1 1 33 SER CA C 3.907 -2.482 1.332 1.00 . A A . 33 SER CA 1 1
3 1553 1 1 33 SER CB C 3.763 -1.874 2.745 1.00 . A A . 33 SER CB 1 1
3 1554 1 1 33 SER H H 4.932 -0.873 0.540 1.00 . A A . 33 SER H 1 1
3 1555 1 1 33 SER HA H 4.069 -3.544 1.433 1.00 . A A . 33 SER HA 1 1
3 1556 1 1 33 SER HB2 H 3.263 -0.887 2.702 1.00 . A A . 33 SER HB2 1 1
3 1557 1 1 33 SER HB3 H 3.131 -2.525 3.392 1.00 . A A . 33 SER HB3 1 1
3 1558 1 1 33 SER HG H 5.546 -2.496 3.193 1.00 . A A . 33 SER HG 1 1
3 1559 1 1 33 SER N N 4.944 -1.877 0.517 1.00 . A A . 33 SER N 1 1
3 1560 1 1 33 SER O O 2.224 -1.139 0.294 1.00 . A A . 33 SER O 1 1
3 1561 1 1 33 SER OG O 5.052 -1.681 3.325 1.00 . A A . 33 SER OG 1 1
3 1562 1 1 34 GLN C C -0.455 -3.462 0.084 1.00 . A A . 34 GLN C 1 1
3 1563 1 1 34 GLN CA C 0.859 -3.385 -0.669 1.00 . A A . 34 GLN CA 1 1
3 1564 1 1 34 GLN CB C 1.020 -4.572 -1.649 1.00 . A A . 34 GLN CB 1 1
3 1565 1 1 34 GLN CD C 0.194 -5.705 -3.785 1.00 . A A . 34 GLN CD 1 1
3 1566 1 1 34 GLN CG C -0.126 -4.706 -2.673 1.00 . A A . 34 GLN CG 1 1
3 1567 1 1 34 GLN H H 2.213 -4.245 0.641 1.00 . A A . 34 GLN H 1 1
3 1568 1 1 34 GLN HA H 0.854 -2.472 -1.244 1.00 . A A . 34 GLN HA 1 1
3 1569 1 1 34 GLN HB2 H 1.981 -4.416 -2.187 1.00 . A A . 34 GLN HB2 1 1
3 1570 1 1 34 GLN HB3 H 1.115 -5.522 -1.078 1.00 . A A . 34 GLN HB3 1 1
3 1571 1 1 34 GLN HE21 H 0.610 -4.219 -5.105 1.00 . A A . 34 GLN HE21 1 1
3 1572 1 1 34 GLN HE22 H 0.630 -5.856 -5.738 1.00 . A A . 34 GLN HE22 1 1
3 1573 1 1 34 GLN HG2 H -1.040 -5.061 -2.163 1.00 . A A . 34 GLN HG2 1 1
3 1574 1 1 34 GLN HG3 H -0.354 -3.711 -3.101 1.00 . A A . 34 GLN HG3 1 1
3 1575 1 1 34 GLN N N 1.973 -3.368 0.231 1.00 . A A . 34 GLN N 1 1
3 1576 1 1 34 GLN NE2 N 0.441 -5.205 -5.012 1.00 . A A . 34 GLN NE2 1 1
3 1577 1 1 34 GLN O O -0.530 -3.965 1.202 1.00 . A A . 34 GLN O 1 1
3 1578 1 1 34 GLN OE1 O 0.206 -6.917 -3.593 1.00 . A A . 34 GLN OE1 1 1
3 1579 1 1 35 CYS C C -3.609 -4.243 -0.774 1.00 . A A . 35 CYS C 1 1
3 1580 1 1 35 CYS CA C -2.894 -3.110 -0.077 1.00 . A A . 35 CYS CA 1 1
3 1581 1 1 35 CYS CB C -3.701 -1.836 -0.386 1.00 . A A . 35 CYS CB 1 1
3 1582 1 1 35 CYS H H -1.386 -2.412 -1.364 1.00 . A A . 35 CYS H 1 1
3 1583 1 1 35 CYS HA H -2.892 -3.349 0.969 1.00 . A A . 35 CYS HA 1 1
3 1584 1 1 35 CYS HB2 H -3.484 -1.546 -1.434 1.00 . A A . 35 CYS HB2 1 1
3 1585 1 1 35 CYS HB3 H -4.792 -2.004 -0.288 1.00 . A A . 35 CYS HB3 1 1
3 1586 1 1 35 CYS N N -1.530 -2.946 -0.530 1.00 . A A . 35 CYS N 1 1
3 1587 1 1 35 CYS O O -3.661 -4.295 -1.994 1.00 . A A . 35 CYS O 1 1
3 1588 1 1 35 CYS SG S -3.250 -0.481 0.696 1.00 . A A . 35 CYS SG 1 1
3 1589 1 1 36 LEU C C -6.289 -6.433 -0.229 1.00 . A A . 36 LEU C 1 1
3 1590 1 1 36 LEU CA C -4.811 -6.355 -0.612 1.00 . A A . 36 LEU CA 1 1
3 1591 1 1 36 LEU CB C -4.153 -7.650 -0.112 1.00 . A A . 36 LEU CB 1 1
3 1592 1 1 36 LEU CD1 C -2.465 -7.624 -1.975 1.00 . A A . 36 LEU CD1 1 1
3 1593 1 1 36 LEU CD2 C -1.738 -6.905 0.345 1.00 . A A . 36 LEU CD2 1 1
3 1594 1 1 36 LEU CG C -2.669 -7.817 -0.470 1.00 . A A . 36 LEU CG 1 1
3 1595 1 1 36 LEU H H -4.100 -5.182 0.962 1.00 . A A . 36 LEU H 1 1
3 1596 1 1 36 LEU HA H -4.773 -6.320 -1.688 1.00 . A A . 36 LEU HA 1 1
3 1597 1 1 36 LEU HB2 H -4.272 -7.692 0.991 1.00 . A A . 36 LEU HB2 1 1
3 1598 1 1 36 LEU HB3 H -4.712 -8.513 -0.537 1.00 . A A . 36 LEU HB3 1 1
3 1599 1 1 36 LEU HD11 H -2.514 -6.547 -2.234 1.00 . A A . 36 LEU HD11 1 1
3 1600 1 1 36 LEU HD12 H -3.252 -8.148 -2.551 1.00 . A A . 36 LEU HD12 1 1
3 1601 1 1 36 LEU HD13 H -1.472 -8.014 -2.275 1.00 . A A . 36 LEU HD13 1 1
3 1602 1 1 36 LEU HD21 H -1.580 -5.943 -0.174 1.00 . A A . 36 LEU HD21 1 1
3 1603 1 1 36 LEU HD22 H -0.751 -7.378 0.498 1.00 . A A . 36 LEU HD22 1 1
3 1604 1 1 36 LEU HD23 H -2.188 -6.677 1.334 1.00 . A A . 36 LEU HD23 1 1
3 1605 1 1 36 LEU HG H -2.403 -8.869 -0.204 1.00 . A A . 36 LEU HG 1 1
3 1606 1 1 36 LEU N N -4.198 -5.180 -0.038 1.00 . A A . 36 LEU N 1 1
3 1607 1 1 36 LEU O O -6.584 -6.821 0.931 1.00 . A A . 36 LEU O 1 1
3 1608 1 1 36 LEU OXT O -7.139 -6.083 -1.083 1.00 . A A . 36 LEU OXT 1 1
3 1609 2 2 1 MAN C1 C -9.509 3.733 0.276 1.00 . B A . 101 MAN C1 1 1
3 1610 2 2 1 MAN C2 C -8.658 4.091 -0.912 1.00 . B A . 101 MAN C2 1 1
3 1611 2 2 1 MAN C3 C -8.646 5.580 -1.059 1.00 . B A . 101 MAN C3 1 1
3 1612 2 2 1 MAN C4 C -10.058 6.102 -1.222 1.00 . B A . 101 MAN C4 1 1
3 1613 2 2 1 MAN C5 C -10.977 5.542 -0.130 1.00 . B A . 101 MAN C5 1 1
3 1614 2 2 1 MAN C6 C -12.439 5.842 -0.384 1.00 . B A . 101 MAN C6 1 1
3 1615 2 2 1 MAN H1 H -9.538 2.643 0.339 1.00 . B A . 101 MAN H1 1 1
3 1616 2 2 1 MAN H2 H -7.641 3.763 -0.680 1.00 . B A . 101 MAN H2 1 1
3 1617 2 2 1 MAN H3 H -8.267 6.021 -0.115 1.00 . B A . 101 MAN H3 1 1
3 1618 2 2 1 MAN H4 H -10.440 5.761 -2.213 1.00 . B A . 101 MAN H4 1 1
3 1619 2 2 1 MAN H5 H -10.701 6.011 0.844 1.00 . B A . 101 MAN H5 1 1
3 1620 2 2 1 MAN H61 H -12.728 5.428 -1.378 1.00 . B A . 101 MAN H61 1 1
3 1621 2 2 1 MAN H62 H -12.601 6.943 -0.411 1.00 . B A . 101 MAN H62 1 1
3 1622 2 2 1 MAN HO2 H -8.284 3.537 -2.746 1.00 . B A . 101 MAN HO2 1 1
3 1623 2 2 1 MAN HO3 H -8.146 6.411 -2.803 1.00 . B A . 101 MAN HO3 1 1
3 1624 2 2 1 MAN HO4 H -10.560 7.898 -1.902 1.00 . B A . 101 MAN HO4 1 1
3 1625 2 2 1 MAN HO6 H -12.971 5.416 1.492 1.00 . B A . 101 MAN HO6 1 1
3 1626 2 2 1 MAN O1 O -9.043 4.342 1.512 1.00 . B A . 101 MAN O1 1 1
3 1627 2 2 1 MAN O2 O -9.007 3.408 -2.117 1.00 . B A . 101 MAN O2 1 1
3 1628 2 2 1 MAN O3 O -7.715 5.969 -2.065 1.00 . B A . 101 MAN O3 1 1
3 1629 2 2 1 MAN O4 O -10.074 7.524 -1.157 1.00 . B A . 101 MAN O4 1 1
3 1630 2 2 1 MAN O5 O -10.846 4.124 0.021 1.00 . B A . 101 MAN O5 1 1
3 1631 2 2 1 MAN O6 O -13.299 5.266 0.602 1.00 . B A . 101 MAN O6 1 1
3 1632 3 2 1 MAN C1 C -5.822 3.365 -6.572 1.00 . C A . 102 MAN C1 1 1
3 1633 3 2 1 MAN C2 C -4.702 2.608 -7.259 1.00 . C A . 102 MAN C2 1 1
3 1634 3 2 1 MAN C3 C -3.457 2.694 -6.401 1.00 . C A . 102 MAN C3 1 1
3 1635 3 2 1 MAN C4 C -3.057 4.149 -6.226 1.00 . C A . 102 MAN C4 1 1
3 1636 3 2 1 MAN C5 C -4.249 4.976 -5.739 1.00 . C A . 102 MAN C5 1 1
3 1637 3 2 1 MAN C6 C -3.967 6.465 -5.741 1.00 . C A . 102 MAN C6 1 1
3 1638 3 2 1 MAN H1 H -6.760 3.276 -7.168 1.00 . C A . 102 MAN H1 1 1
3 1639 3 2 1 MAN H2 H -4.978 1.536 -7.375 1.00 . C A . 102 MAN H2 1 1
3 1640 3 2 1 MAN H3 H -3.690 2.292 -5.387 1.00 . C A . 102 MAN H3 1 1
3 1641 3 2 1 MAN H4 H -2.751 4.545 -7.225 1.00 . C A . 102 MAN H4 1 1
3 1642 3 2 1 MAN H5 H -4.464 4.687 -4.681 1.00 . C A . 102 MAN H5 1 1
3 1643 3 2 1 MAN H61 H -3.719 6.805 -6.772 1.00 . C A . 102 MAN H61 1 1
3 1644 3 2 1 MAN H62 H -3.093 6.689 -5.087 1.00 . C A . 102 MAN H62 1 1
3 1645 3 2 1 MAN HO2 H -4.611 4.041 -8.612 1.00 . C A . 102 MAN HO2 1 1
3 1646 3 2 1 MAN HO3 H -2.421 1.944 -7.886 1.00 . C A . 102 MAN HO3 1 1
3 1647 3 2 1 MAN HO4 H -1.210 4.695 -5.791 1.00 . C A . 102 MAN HO4 1 1
3 1648 3 2 1 MAN HO6 H -5.853 6.988 -5.811 1.00 . C A . 102 MAN HO6 1 1
3 1649 3 2 1 MAN O1 O -6.065 2.927 -5.221 1.00 . C A . 102 MAN O1 1 1
3 1650 3 2 1 MAN O2 O -4.473 3.085 -8.588 1.00 . C A . 102 MAN O2 1 1
3 1651 3 2 1 MAN O3 O -2.411 1.879 -6.923 1.00 . C A . 102 MAN O3 1 1
3 1652 3 2 1 MAN O4 O -1.959 4.299 -5.328 1.00 . C A . 102 MAN O4 1 1
3 1653 3 2 1 MAN O5 O -5.433 4.746 -6.543 1.00 . C A . 102 MAN O5 1 1
3 1654 3 2 1 MAN O6 O -5.091 7.203 -5.263 1.00 . C A . 102 MAN O6 1 1
3 1655 4 2 1 MAN C1 C 4.700 10.127 -1.817 1.00 . D A . 103 MAN C1 1 1
3 1656 4 2 1 MAN C2 C 6.043 9.534 -2.210 1.00 . D A . 103 MAN C2 1 1
3 1657 4 2 1 MAN C3 C 6.944 10.671 -2.659 1.00 . D A . 103 MAN C3 1 1
3 1658 4 2 1 MAN C4 C 6.298 11.351 -3.846 1.00 . D A . 103 MAN C4 1 1
3 1659 4 2 1 MAN C5 C 4.907 11.844 -3.465 1.00 . D A . 103 MAN C5 1 1
3 1660 4 2 1 MAN C6 C 4.161 12.427 -4.643 1.00 . D A . 103 MAN C6 1 1
3 1661 4 2 1 MAN H1 H 3.978 9.324 -1.566 1.00 . D A . 103 MAN H1 1 1
3 1662 4 2 1 MAN H2 H 6.536 9.071 -1.331 1.00 . D A . 103 MAN H2 1 1
3 1663 4 2 1 MAN H3 H 7.000 11.423 -1.834 1.00 . D A . 103 MAN H3 1 1
3 1664 4 2 1 MAN H4 H 6.186 10.598 -4.663 1.00 . D A . 103 MAN H4 1 1
3 1665 4 2 1 MAN H5 H 5.002 12.633 -2.680 1.00 . D A . 103 MAN H5 1 1
3 1666 4 2 1 MAN H61 H 4.081 11.658 -5.445 1.00 . D A . 103 MAN H61 1 1
3 1667 4 2 1 MAN H62 H 4.717 13.299 -5.056 1.00 . D A . 103 MAN H62 1 1
3 1668 4 2 1 MAN HO2 H 5.204 7.878 -2.998 1.00 . D A . 103 MAN HO2 1 1
3 1669 4 2 1 MAN HO3 H 8.781 10.164 -2.112 1.00 . D A . 103 MAN HO3 1 1
3 1670 4 2 1 MAN HO4 H 7.878 12.029 -4.732 1.00 . D A . 103 MAN HO4 1 1
3 1671 4 2 1 MAN HO6 H 2.481 12.167 -3.695 1.00 . D A . 103 MAN HO6 1 1
3 1672 4 2 1 MAN O1 O 4.795 11.059 -0.722 1.00 . D A . 103 MAN O1 1 1
3 1673 4 2 1 MAN O2 O 5.902 8.504 -3.202 1.00 . D A . 103 MAN O2 1 1
3 1674 4 2 1 MAN O3 O 8.286 10.251 -2.932 1.00 . D A . 103 MAN O3 1 1
3 1675 4 2 1 MAN O4 O 7.085 12.424 -4.351 1.00 . D A . 103 MAN O4 1 1
3 1676 4 2 1 MAN O5 O 4.106 10.762 -2.951 1.00 . D A . 103 MAN O5 1 1
3 1677 4 2 1 MAN O6 O 2.850 12.851 -4.267 1.00 . D A . 103 MAN O6 1 1
4 1678 1 1 1 THR C C -6.139 5.073 1.100 1.00 . A A . 1 THR C 1 1
4 1679 1 1 1 THR CA C -7.021 5.047 2.316 1.00 . A A . 1 THR CA 1 1
4 1680 1 1 1 THR CB C -8.113 3.942 2.170 1.00 . A A . 1 THR CB 1 1
4 1681 1 1 1 THR CG2 C -8.538 3.470 3.556 1.00 . A A . 1 THR CG2 1 1
4 1682 1 1 1 THR H1 H -8.666 6.258 2.209 1.00 . A A . 1 THR H1 1 1
4 1683 1 1 1 THR H2 H -7.189 7.113 2.050 1.00 . A A . 1 THR H2 1 1
4 1684 1 1 1 THR H3 H -7.748 6.587 3.597 1.00 . A A . 1 THR H3 1 1
4 1685 1 1 1 THR HA H -6.380 4.852 3.154 1.00 . A A . 1 THR HA 1 1
4 1686 1 1 1 THR HB H -7.765 3.069 1.579 1.00 . A A . 1 THR HB 1 1
4 1687 1 1 1 THR HG21 H -8.893 4.291 4.207 1.00 . A A . 1 THR HG21 1 1
4 1688 1 1 1 THR HG22 H -7.665 2.997 4.052 1.00 . A A . 1 THR HG22 1 1
4 1689 1 1 1 THR HG23 H -9.332 2.695 3.508 1.00 . A A . 1 THR HG23 1 1
4 1690 1 1 1 THR N N -7.694 6.370 2.584 1.00 . A A . 1 THR N 1 1
4 1691 1 1 1 THR O O -5.992 6.149 0.542 1.00 . A A . 1 THR O 1 1
4 1692 1 1 2 GLN C C -5.772 2.650 -1.356 1.00 . A A . 2 GLN C 1 1
4 1693 1 1 2 GLN CA C -4.967 3.679 -0.608 1.00 . A A . 2 GLN CA 1 1
4 1694 1 1 2 GLN CB C -3.558 3.057 -0.497 1.00 . A A . 2 GLN CB 1 1
4 1695 1 1 2 GLN CD C -2.399 5.123 -1.032 1.00 . A A . 2 GLN CD 1 1
4 1696 1 1 2 GLN CG C -2.651 3.721 -1.537 1.00 . A A . 2 GLN CG 1 1
4 1697 1 1 2 GLN H H -5.583 3.107 1.269 1.00 . A A . 2 GLN H 1 1
4 1698 1 1 2 GLN HA H -4.977 4.594 -1.190 1.00 . A A . 2 GLN HA 1 1
4 1699 1 1 2 GLN HB2 H -3.172 3.215 0.538 1.00 . A A . 2 GLN HB2 1 1
4 1700 1 1 2 GLN HB3 H -3.530 1.953 -0.641 1.00 . A A . 2 GLN HB3 1 1
4 1701 1 1 2 GLN HE21 H -1.000 4.352 0.233 1.00 . A A . 2 GLN HE21 1 1
4 1702 1 1 2 GLN HE22 H -1.352 6.034 0.464 1.00 . A A . 2 GLN HE22 1 1
4 1703 1 1 2 GLN HG2 H -1.696 3.184 -1.670 1.00 . A A . 2 GLN HG2 1 1
4 1704 1 1 2 GLN HG3 H -3.134 3.798 -2.531 1.00 . A A . 2 GLN HG3 1 1
4 1705 1 1 2 GLN N N -5.580 3.918 0.679 1.00 . A A . 2 GLN N 1 1
4 1706 1 1 2 GLN NE2 N -1.469 5.197 -0.067 1.00 . A A . 2 GLN NE2 1 1
4 1707 1 1 2 GLN O O -6.507 1.874 -0.749 1.00 . A A . 2 GLN O 1 1
4 1708 1 1 2 GLN OE1 O -3.004 6.109 -1.431 1.00 . A A . 2 GLN OE1 1 1
4 1709 1 1 3 SER C C -5.955 0.317 -3.485 1.00 . A A . 3 SER C 1 1
4 1710 1 1 3 SER CA C -6.390 1.763 -3.576 1.00 . A A . 3 SER CA 1 1
4 1711 1 1 3 SER CB C -6.265 2.205 -5.059 1.00 . A A . 3 SER CB 1 1
4 1712 1 1 3 SER H H -5.076 3.302 -3.164 1.00 . A A . 3 SER H 1 1
4 1713 1 1 3 SER HA H -7.427 1.814 -3.277 1.00 . A A . 3 SER HA 1 1
4 1714 1 1 3 SER HB2 H -5.635 1.515 -5.657 1.00 . A A . 3 SER HB2 1 1
4 1715 1 1 3 SER HB3 H -7.267 2.301 -5.528 1.00 . A A . 3 SER HB3 1 1
4 1716 1 1 3 SER N N -5.656 2.642 -2.689 1.00 . A A . 3 SER N 1 1
4 1717 1 1 3 SER O O -4.934 -0.023 -2.895 1.00 . A A . 3 SER O 1 1
4 1718 1 1 4 HIS C C -5.045 -2.131 -5.010 1.00 . A A . 4 HIS C 1 1
4 1719 1 1 4 HIS CA C -6.334 -1.993 -4.237 1.00 . A A . 4 HIS CA 1 1
4 1720 1 1 4 HIS CB C -7.400 -2.822 -4.994 1.00 . A A . 4 HIS CB 1 1
4 1721 1 1 4 HIS CD2 C -6.462 -5.031 -3.989 1.00 . A A . 4 HIS CD2 1 1
4 1722 1 1 4 HIS CE1 C -8.065 -6.365 -4.658 1.00 . A A . 4 HIS CE1 1 1
4 1723 1 1 4 HIS CG C -7.314 -4.305 -4.751 1.00 . A A . 4 HIS CG 1 1
4 1724 1 1 4 HIS H H -7.547 -0.307 -4.585 1.00 . A A . 4 HIS H 1 1
4 1725 1 1 4 HIS HA H -6.161 -2.383 -3.243 1.00 . A A . 4 HIS HA 1 1
4 1726 1 1 4 HIS HB2 H -8.399 -2.478 -4.652 1.00 . A A . 4 HIS HB2 1 1
4 1727 1 1 4 HIS HB3 H -7.336 -2.635 -6.090 1.00 . A A . 4 HIS HB3 1 1
4 1728 1 1 4 HIS HD1 H -9.139 -4.913 -5.651 1.00 . A A . 4 HIS HD1 1 1
4 1729 1 1 4 HIS HD2 H -5.701 -4.690 -3.291 1.00 . A A . 4 HIS HD2 1 1
4 1730 1 1 4 HIS HE1 H -8.670 -7.250 -4.778 1.00 . A A . 4 HIS HE1 1 1
4 1731 1 1 4 HIS HE2 H -6.889 -6.772 -3.039 1.00 . A A . 4 HIS HE2 1 1
4 1732 1 1 4 HIS N N -6.721 -0.595 -4.116 1.00 . A A . 4 HIS N 1 1
4 1733 1 1 4 HIS ND1 N -8.302 -5.161 -5.165 1.00 . A A . 4 HIS ND1 1 1
4 1734 1 1 4 HIS NE2 N -6.959 -6.304 -3.951 1.00 . A A . 4 HIS NE2 1 1
4 1735 1 1 4 HIS O O -4.901 -1.554 -6.082 1.00 . A A . 4 HIS O 1 1
4 1736 1 1 5 TYR C C -1.929 -1.803 -4.851 1.00 . A A . 5 TYR C 1 1
4 1737 1 1 5 TYR CA C -2.754 -3.079 -4.952 1.00 . A A . 5 TYR CA 1 1
4 1738 1 1 5 TYR CB C -2.689 -3.702 -6.369 1.00 . A A . 5 TYR CB 1 1
4 1739 1 1 5 TYR CD1 C -3.183 -6.178 -5.999 1.00 . A A . 5 TYR CD1 1 1
4 1740 1 1 5 TYR CD2 C -4.852 -4.767 -7.039 1.00 . A A . 5 TYR CD2 1 1
4 1741 1 1 5 TYR CE1 C -4.054 -7.275 -6.102 1.00 . A A . 5 TYR CE1 1 1
4 1742 1 1 5 TYR CE2 C -5.718 -5.858 -7.146 1.00 . A A . 5 TYR CE2 1 1
4 1743 1 1 5 TYR CG C -3.584 -4.908 -6.456 1.00 . A A . 5 TYR CG 1 1
4 1744 1 1 5 TYR CZ C -5.320 -7.110 -6.672 1.00 . A A . 5 TYR CZ 1 1
4 1745 1 1 5 TYR H H -4.225 -3.297 -3.535 1.00 . A A . 5 TYR H 1 1
4 1746 1 1 5 TYR HA H -2.309 -3.787 -4.272 1.00 . A A . 5 TYR HA 1 1
4 1747 1 1 5 TYR HB2 H -3.002 -2.955 -7.129 1.00 . A A . 5 TYR HB2 1 1
4 1748 1 1 5 TYR HB3 H -1.655 -4.018 -6.618 1.00 . A A . 5 TYR HB3 1 1
4 1749 1 1 5 TYR HD1 H -2.204 -6.318 -5.563 1.00 . A A . 5 TYR HD1 1 1
4 1750 1 1 5 TYR HD2 H -5.157 -3.793 -7.393 1.00 . A A . 5 TYR HD2 1 1
4 1751 1 1 5 TYR HE1 H -3.745 -8.248 -5.747 1.00 . A A . 5 TYR HE1 1 1
4 1752 1 1 5 TYR HE2 H -6.700 -5.717 -7.568 1.00 . A A . 5 TYR HE2 1 1
4 1753 1 1 5 TYR HH H -6.790 -8.029 -7.509 1.00 . A A . 5 TYR HH 1 1
4 1754 1 1 5 TYR N N -4.087 -2.869 -4.439 1.00 . A A . 5 TYR N 1 1
4 1755 1 1 5 TYR O O -0.840 -1.691 -5.398 1.00 . A A . 5 TYR O 1 1
4 1756 1 1 5 TYR OH O -6.216 -8.191 -6.760 1.00 . A A . 5 TYR OH 1 1
4 1757 1 1 6 GLY C C -0.797 0.212 -2.636 1.00 . A A . 6 GLY C 1 1
4 1758 1 1 6 GLY CA C -1.673 0.419 -3.817 1.00 . A A . 6 GLY CA 1 1
4 1759 1 1 6 GLY H H -3.310 -0.882 -3.665 1.00 . A A . 6 GLY H 1 1
4 1760 1 1 6 GLY HA2 H -1.036 0.655 -4.657 1.00 . A A . 6 GLY HA2 1 1
4 1761 1 1 6 GLY HA3 H -2.384 1.191 -3.573 1.00 . A A . 6 GLY HA3 1 1
4 1762 1 1 6 GLY N N -2.412 -0.796 -4.098 1.00 . A A . 6 GLY N 1 1
4 1763 1 1 6 GLY O O -0.802 -0.851 -2.029 1.00 . A A . 6 GLY O 1 1
4 1764 1 1 7 GLN C C 0.379 1.671 0.141 1.00 . A A . 7 GLN C 1 1
4 1765 1 1 7 GLN CA C 0.900 1.041 -1.145 1.00 . A A . 7 GLN CA 1 1
4 1766 1 1 7 GLN CB C 2.260 1.668 -1.467 1.00 . A A . 7 GLN CB 1 1
4 1767 1 1 7 GLN CD C 4.594 1.858 -0.608 1.00 . A A . 7 GLN CD 1 1
4 1768 1 1 7 GLN CG C 3.341 1.030 -0.588 1.00 . A A . 7 GLN CG 1 1
4 1769 1 1 7 GLN H H 0.002 2.097 -2.719 1.00 . A A . 7 GLN H 1 1
4 1770 1 1 7 GLN HA H 1.066 -0.011 -0.959 1.00 . A A . 7 GLN HA 1 1
4 1771 1 1 7 GLN HB2 H 2.510 1.517 -2.537 1.00 . A A . 7 GLN HB2 1 1
4 1772 1 1 7 GLN HB3 H 2.213 2.771 -1.307 1.00 . A A . 7 GLN HB3 1 1
4 1773 1 1 7 GLN HE21 H 5.149 1.326 -2.491 1.00 . A A . 7 GLN HE21 1 1
4 1774 1 1 7 GLN HE22 H 6.229 2.400 -1.646 1.00 . A A . 7 GLN HE22 1 1
4 1775 1 1 7 GLN HG2 H 3.025 1.057 0.476 1.00 . A A . 7 GLN HG2 1 1
4 1776 1 1 7 GLN HG3 H 3.536 -0.027 -0.833 1.00 . A A . 7 GLN HG3 1 1
4 1777 1 1 7 GLN N N -0.007 1.217 -2.253 1.00 . A A . 7 GLN N 1 1
4 1778 1 1 7 GLN NE2 N 5.414 1.824 -1.675 1.00 . A A . 7 GLN NE2 1 1
4 1779 1 1 7 GLN O O -0.222 2.738 0.135 1.00 . A A . 7 GLN O 1 1
4 1780 1 1 7 GLN OE1 O 4.803 2.546 0.382 1.00 . A A . 7 GLN OE1 1 1
4 1781 1 1 8 CYS C C 1.608 1.743 3.458 1.00 . A A . 8 CYS C 1 1
4 1782 1 1 8 CYS CA C 0.352 1.628 2.591 1.00 . A A . 8 CYS CA 1 1
4 1783 1 1 8 CYS CB C -0.797 0.805 3.267 1.00 . A A . 8 CYS CB 1 1
4 1784 1 1 8 CYS H H 1.016 0.108 1.266 1.00 . A A . 8 CYS H 1 1
4 1785 1 1 8 CYS HA H 0.012 2.649 2.476 1.00 . A A . 8 CYS HA 1 1
4 1786 1 1 8 CYS HB2 H -1.705 1.446 3.281 1.00 . A A . 8 CYS HB2 1 1
4 1787 1 1 8 CYS HB3 H -1.016 -0.033 2.573 1.00 . A A . 8 CYS HB3 1 1
4 1788 1 1 8 CYS N N 0.622 1.031 1.292 1.00 . A A . 8 CYS N 1 1
4 1789 1 1 8 CYS O O 1.629 2.499 4.423 1.00 . A A . 8 CYS O 1 1
4 1790 1 1 8 CYS SG S -0.518 0.086 4.927 1.00 . A A . 8 CYS SG 1 1
4 1791 1 1 9 GLY C C 5.124 0.487 3.339 1.00 . A A . 9 GLY C 1 1
4 1792 1 1 9 GLY CA C 3.871 0.973 4.015 1.00 . A A . 9 GLY CA 1 1
4 1793 1 1 9 GLY H H 2.696 0.462 2.310 1.00 . A A . 9 GLY H 1 1
4 1794 1 1 9 GLY HA2 H 4.082 1.964 4.393 1.00 . A A . 9 GLY HA2 1 1
4 1795 1 1 9 GLY HA3 H 3.649 0.262 4.798 1.00 . A A . 9 GLY HA3 1 1
4 1796 1 1 9 GLY N N 2.703 1.026 3.128 1.00 . A A . 9 GLY N 1 1
4 1797 1 1 9 GLY O O 5.543 -0.657 3.466 1.00 . A A . 9 GLY O 1 1
4 1798 1 1 10 GLY C C 8.055 1.965 2.189 1.00 . A A . 10 GLY C 1 1
4 1799 1 1 10 GLY CA C 6.982 1.009 1.818 1.00 . A A . 10 GLY CA 1 1
4 1800 1 1 10 GLY H H 5.419 2.263 2.403 1.00 . A A . 10 GLY H 1 1
4 1801 1 1 10 GLY HA2 H 7.332 0.013 2.045 1.00 . A A . 10 GLY HA2 1 1
4 1802 1 1 10 GLY HA3 H 6.798 1.161 0.768 1.00 . A A . 10 GLY HA3 1 1
4 1803 1 1 10 GLY N N 5.769 1.334 2.549 1.00 . A A . 10 GLY N 1 1
4 1804 1 1 10 GLY O O 7.822 2.999 2.799 1.00 . A A . 10 GLY O 1 1
4 1805 1 1 11 ILE C C 10.448 3.752 1.209 1.00 . A A . 11 ILE C 1 1
4 1806 1 1 11 ILE CA C 10.451 2.472 2.033 1.00 . A A . 11 ILE CA 1 1
4 1807 1 1 11 ILE CB C 11.708 1.628 1.821 1.00 . A A . 11 ILE CB 1 1
4 1808 1 1 11 ILE CD1 C 13.036 1.372 4.024 1.00 . A A . 11 ILE CD1 1 1
4 1809 1 1 11 ILE CG1 C 11.983 0.769 3.085 1.00 . A A . 11 ILE CG1 1 1
4 1810 1 1 11 ILE CG2 C 12.930 2.470 1.377 1.00 . A A . 11 ILE CG2 1 1
4 1811 1 1 11 ILE H H 9.430 0.809 1.261 1.00 . A A . 11 ILE H 1 1
4 1812 1 1 11 ILE HA H 10.426 2.798 3.064 1.00 . A A . 11 ILE HA 1 1
4 1813 1 1 11 ILE HB H 11.481 0.923 0.987 1.00 . A A . 11 ILE HB 1 1
4 1814 1 1 11 ILE HD11 H 12.824 2.447 4.215 1.00 . A A . 11 ILE HD11 1 1
4 1815 1 1 11 ILE HD12 H 14.050 1.285 3.577 1.00 . A A . 11 ILE HD12 1 1
4 1816 1 1 11 ILE HD13 H 13.046 0.838 4.997 1.00 . A A . 11 ILE HD13 1 1
4 1817 1 1 11 ILE HG12 H 11.035 0.620 3.649 1.00 . A A . 11 ILE HG12 1 1
4 1818 1 1 11 ILE HG13 H 12.327 -0.245 2.776 1.00 . A A . 11 ILE HG13 1 1
4 1819 1 1 11 ILE HG21 H 13.089 3.327 2.066 1.00 . A A . 11 ILE HG21 1 1
4 1820 1 1 11 ILE HG22 H 12.788 2.868 0.350 1.00 . A A . 11 ILE HG22 1 1
4 1821 1 1 11 ILE HG23 H 13.849 1.853 1.374 1.00 . A A . 11 ILE HG23 1 1
4 1822 1 1 11 ILE N N 9.286 1.640 1.786 1.00 . A A . 11 ILE N 1 1
4 1823 1 1 11 ILE O O 10.917 4.801 1.640 1.00 . A A . 11 ILE O 1 1
4 1824 1 1 12 GLY C C 8.477 5.103 -1.378 1.00 . A A . 12 GLY C 1 1
4 1825 1 1 12 GLY CA C 9.871 4.818 -0.939 1.00 . A A . 12 GLY CA 1 1
4 1826 1 1 12 GLY H H 9.461 2.842 -0.305 1.00 . A A . 12 GLY H 1 1
4 1827 1 1 12 GLY HA2 H 10.242 5.718 -0.467 1.00 . A A . 12 GLY HA2 1 1
4 1828 1 1 12 GLY HA3 H 10.431 4.538 -1.817 1.00 . A A . 12 GLY HA3 1 1
4 1829 1 1 12 GLY N N 9.897 3.689 -0.019 1.00 . A A . 12 GLY N 1 1
4 1830 1 1 12 GLY O O 8.031 4.635 -2.424 1.00 . A A . 12 GLY O 1 1
4 1831 1 1 13 TYR C C 5.904 7.426 -0.180 1.00 . A A . 13 TYR C 1 1
4 1832 1 1 13 TYR CA C 6.378 6.214 -0.933 1.00 . A A . 13 TYR CA 1 1
4 1833 1 1 13 TYR CB C 5.476 5.035 -0.572 1.00 . A A . 13 TYR CB 1 1
4 1834 1 1 13 TYR CD1 C 3.727 5.021 -2.367 1.00 . A A . 13 TYR CD1 1 1
4 1835 1 1 13 TYR CD2 C 3.038 5.408 -0.073 1.00 . A A . 13 TYR CD2 1 1
4 1836 1 1 13 TYR CE1 C 2.408 5.189 -2.793 1.00 . A A . 13 TYR CE1 1 1
4 1837 1 1 13 TYR CE2 C 1.716 5.566 -0.498 1.00 . A A . 13 TYR CE2 1 1
4 1838 1 1 13 TYR CG C 4.053 5.170 -1.011 1.00 . A A . 13 TYR CG 1 1
4 1839 1 1 13 TYR CZ C 1.416 5.485 -1.866 1.00 . A A . 13 TYR CZ 1 1
4 1840 1 1 13 TYR H H 8.051 6.177 0.318 1.00 . A A . 13 TYR H 1 1
4 1841 1 1 13 TYR HA H 6.327 6.433 -1.992 1.00 . A A . 13 TYR HA 1 1
4 1842 1 1 13 TYR HB2 H 5.901 4.159 -1.089 1.00 . A A . 13 TYR HB2 1 1
4 1843 1 1 13 TYR HB3 H 5.515 4.840 0.526 1.00 . A A . 13 TYR HB3 1 1
4 1844 1 1 13 TYR HD1 H 4.500 4.788 -3.083 1.00 . A A . 13 TYR HD1 1 1
4 1845 1 1 13 TYR HD2 H 3.283 5.489 0.979 1.00 . A A . 13 TYR HD2 1 1
4 1846 1 1 13 TYR HE1 H 2.147 5.103 -3.837 1.00 . A A . 13 TYR HE1 1 1
4 1847 1 1 13 TYR HE2 H 0.969 5.784 0.247 1.00 . A A . 13 TYR HE2 1 1
4 1848 1 1 13 TYR HH H -0.479 5.671 -1.639 1.00 . A A . 13 TYR HH 1 1
4 1849 1 1 13 TYR N N 7.727 5.869 -0.576 1.00 . A A . 13 TYR N 1 1
4 1850 1 1 13 TYR O O 6.329 7.698 0.938 1.00 . A A . 13 TYR O 1 1
4 1851 1 1 13 TYR OH O 0.135 5.694 -2.382 1.00 . A A . 13 TYR OH 1 1
4 1852 1 1 14 SER C C 2.989 9.529 -0.423 1.00 . A A . 14 SER C 1 1
4 1853 1 1 14 SER CA C 4.468 9.383 -0.187 1.00 . A A . 14 SER CA 1 1
4 1854 1 1 14 SER CB C 5.146 10.621 -0.789 1.00 . A A . 14 SER CB 1 1
4 1855 1 1 14 SER H H 4.618 7.905 -1.679 1.00 . A A . 14 SER H 1 1
4 1856 1 1 14 SER HA H 4.624 9.369 0.883 1.00 . A A . 14 SER HA 1 1
4 1857 1 1 14 SER HB2 H 4.845 10.754 -1.852 1.00 . A A . 14 SER HB2 1 1
4 1858 1 1 14 SER HB3 H 4.910 11.528 -0.191 1.00 . A A . 14 SER HB3 1 1
4 1859 1 1 14 SER N N 4.955 8.158 -0.778 1.00 . A A . 14 SER N 1 1
4 1860 1 1 14 SER O O 2.542 10.351 -1.217 1.00 . A A . 14 SER O 1 1
4 1861 1 1 15 GLY C C 0.122 8.283 1.412 1.00 . A A . 15 GLY C 1 1
4 1862 1 1 15 GLY CA C 0.731 8.790 0.136 1.00 . A A . 15 GLY CA 1 1
4 1863 1 1 15 GLY H H 2.535 8.060 0.918 1.00 . A A . 15 GLY H 1 1
4 1864 1 1 15 GLY HA2 H 0.435 9.824 0.019 1.00 . A A . 15 GLY HA2 1 1
4 1865 1 1 15 GLY HA3 H 0.433 8.148 -0.681 1.00 . A A . 15 GLY HA3 1 1
4 1866 1 1 15 GLY N N 2.175 8.709 0.248 1.00 . A A . 15 GLY N 1 1
4 1867 1 1 15 GLY O O 0.846 8.039 2.373 1.00 . A A . 15 GLY O 1 1
4 1868 1 1 16 PRO C C -1.303 6.177 3.164 1.00 . A A . 16 PRO C 1 1
4 1869 1 1 16 PRO CA C -1.913 7.454 2.562 1.00 . A A . 16 PRO CA 1 1
4 1870 1 1 16 PRO CB C -3.320 7.227 1.982 1.00 . A A . 16 PRO CB 1 1
4 1871 1 1 16 PRO CD C -2.093 8.652 0.443 1.00 . A A . 16 PRO CD 1 1
4 1872 1 1 16 PRO CG C -3.510 8.327 0.924 1.00 . A A . 16 PRO CG 1 1
4 1873 1 1 16 PRO HA H -1.906 8.175 3.365 1.00 . A A . 16 PRO HA 1 1
4 1874 1 1 16 PRO HB2 H -3.371 6.243 1.463 1.00 . A A . 16 PRO HB2 1 1
4 1875 1 1 16 PRO HB3 H -4.105 7.264 2.760 1.00 . A A . 16 PRO HB3 1 1
4 1876 1 1 16 PRO HD2 H -1.896 8.166 -0.541 1.00 . A A . 16 PRO HD2 1 1
4 1877 1 1 16 PRO HD3 H -1.958 9.753 0.339 1.00 . A A . 16 PRO HD3 1 1
4 1878 1 1 16 PRO HG2 H -4.134 7.973 0.071 1.00 . A A . 16 PRO HG2 1 1
4 1879 1 1 16 PRO HG3 H -3.974 9.234 1.363 1.00 . A A . 16 PRO HG3 1 1
4 1880 1 1 16 PRO N N -1.193 8.107 1.465 1.00 . A A . 16 PRO N 1 1
4 1881 1 1 16 PRO O O -0.596 5.442 2.490 1.00 . A A . 16 PRO O 1 1
4 1882 1 1 17 THR C C -2.063 3.708 5.525 1.00 . A A . 17 THR C 1 1
4 1883 1 1 17 THR CA C -0.985 4.713 5.131 1.00 . A A . 17 THR CA 1 1
4 1884 1 1 17 THR CB C -0.081 5.190 6.285 1.00 . A A . 17 THR CB 1 1
4 1885 1 1 17 THR CG2 C -0.744 6.370 7.011 1.00 . A A . 17 THR CG2 1 1
4 1886 1 1 17 THR H H -2.090 6.493 5.013 1.00 . A A . 17 THR H 1 1
4 1887 1 1 17 THR HA H -0.344 4.158 4.460 1.00 . A A . 17 THR HA 1 1
4 1888 1 1 17 THR HB H 0.887 5.527 5.842 1.00 . A A . 17 THR HB 1 1
4 1889 1 1 17 THR HG1 H 1.136 4.152 7.378 1.00 . A A . 17 THR HG1 1 1
4 1890 1 1 17 THR HG21 H -1.774 6.098 7.321 1.00 . A A . 17 THR HG21 1 1
4 1891 1 1 17 THR HG22 H -0.756 7.282 6.382 1.00 . A A . 17 THR HG22 1 1
4 1892 1 1 17 THR HG23 H -0.167 6.612 7.930 1.00 . A A . 17 THR HG23 1 1
4 1893 1 1 17 THR N N -1.579 5.868 4.438 1.00 . A A . 17 THR N 1 1
4 1894 1 1 17 THR O O -1.888 2.740 6.252 1.00 . A A . 17 THR O 1 1
4 1895 1 1 17 THR OG1 O 0.182 4.237 7.304 1.00 . A A . 17 THR OG1 1 1
4 1896 1 1 18 VAL C C -4.878 2.333 4.164 1.00 . A A . 18 VAL C 1 1
4 1897 1 1 18 VAL CA C -4.403 3.052 5.392 1.00 . A A . 18 VAL CA 1 1
4 1898 1 1 18 VAL CB C -5.543 3.879 5.988 1.00 . A A . 18 VAL CB 1 1
4 1899 1 1 18 VAL CG1 C -6.675 2.970 6.516 1.00 . A A . 18 VAL CG1 1 1
4 1900 1 1 18 VAL CG2 C -4.983 4.717 7.152 1.00 . A A . 18 VAL CG2 1 1
4 1901 1 1 18 VAL H H -3.394 4.549 4.268 1.00 . A A . 18 VAL H 1 1
4 1902 1 1 18 VAL HA H -4.114 2.301 6.115 1.00 . A A . 18 VAL HA 1 1
4 1903 1 1 18 VAL HB H -5.949 4.574 5.223 1.00 . A A . 18 VAL HB 1 1
4 1904 1 1 18 VAL HG11 H -6.741 1.999 5.985 1.00 . A A . 18 VAL HG11 1 1
4 1905 1 1 18 VAL HG12 H -7.660 3.472 6.422 1.00 . A A . 18 VAL HG12 1 1
4 1906 1 1 18 VAL HG13 H -6.513 2.744 7.592 1.00 . A A . 18 VAL HG13 1 1
4 1907 1 1 18 VAL HG21 H -5.794 5.275 7.663 1.00 . A A . 18 VAL HG21 1 1
4 1908 1 1 18 VAL HG22 H -4.216 5.442 6.814 1.00 . A A . 18 VAL HG22 1 1
4 1909 1 1 18 VAL HG23 H -4.505 4.041 7.897 1.00 . A A . 18 VAL HG23 1 1
4 1910 1 1 18 VAL N N -3.278 3.878 4.986 1.00 . A A . 18 VAL N 1 1
4 1911 1 1 18 VAL O O -5.184 2.954 3.155 1.00 . A A . 18 VAL O 1 1
4 1912 1 1 19 CYS C C -7.081 0.465 3.017 1.00 . A A . 19 CYS C 1 1
4 1913 1 1 19 CYS CA C -5.587 0.274 3.089 1.00 . A A . 19 CYS CA 1 1
4 1914 1 1 19 CYS CB C -5.185 -1.196 3.165 1.00 . A A . 19 CYS CB 1 1
4 1915 1 1 19 CYS H H -4.691 0.478 4.975 1.00 . A A . 19 CYS H 1 1
4 1916 1 1 19 CYS HA H -5.226 0.682 2.157 1.00 . A A . 19 CYS HA 1 1
4 1917 1 1 19 CYS HB2 H -5.367 -1.573 4.197 1.00 . A A . 19 CYS HB2 1 1
4 1918 1 1 19 CYS HB3 H -5.764 -1.846 2.485 1.00 . A A . 19 CYS HB3 1 1
4 1919 1 1 19 CYS N N -4.966 1.005 4.176 1.00 . A A . 19 CYS N 1 1
4 1920 1 1 19 CYS O O -7.743 0.616 4.038 1.00 . A A . 19 CYS O 1 1
4 1921 1 1 19 CYS SG S -3.433 -1.305 2.732 1.00 . A A . 19 CYS SG 1 1
4 1922 1 1 20 ALA C C -9.942 -0.236 2.323 1.00 . A A . 20 ALA C 1 1
4 1923 1 1 20 ALA CA C -9.050 0.619 1.476 1.00 . A A . 20 ALA CA 1 1
4 1924 1 1 20 ALA CB C -9.349 0.314 -0.018 1.00 . A A . 20 ALA CB 1 1
4 1925 1 1 20 ALA H H -7.059 0.379 0.978 1.00 . A A . 20 ALA H 1 1
4 1926 1 1 20 ALA HA H -9.352 1.610 1.727 1.00 . A A . 20 ALA HA 1 1
4 1927 1 1 20 ALA HB1 H -10.358 0.665 -0.315 1.00 . A A . 20 ALA HB1 1 1
4 1928 1 1 20 ALA HB2 H -9.302 -0.774 -0.219 1.00 . A A . 20 ALA HB2 1 1
4 1929 1 1 20 ALA HB3 H -8.608 0.800 -0.682 1.00 . A A . 20 ALA HB3 1 1
4 1930 1 1 20 ALA N N -7.632 0.551 1.784 1.00 . A A . 20 ALA N 1 1
4 1931 1 1 20 ALA O O -9.559 -1.305 2.750 1.00 . A A . 20 ALA O 1 1
4 1932 1 1 21 SER C C -12.534 -1.939 2.668 1.00 . A A . 21 SER C 1 1
4 1933 1 1 21 SER CA C -12.119 -0.634 3.338 1.00 . A A . 21 SER CA 1 1
4 1934 1 1 21 SER CB C -13.381 0.196 3.641 1.00 . A A . 21 SER CB 1 1
4 1935 1 1 21 SER H H -11.533 1.065 2.296 1.00 . A A . 21 SER H 1 1
4 1936 1 1 21 SER HA H -11.630 -0.899 4.268 1.00 . A A . 21 SER HA 1 1
4 1937 1 1 21 SER HB2 H -13.945 0.379 2.698 1.00 . A A . 21 SER HB2 1 1
4 1938 1 1 21 SER HB3 H -14.047 -0.347 4.349 1.00 . A A . 21 SER HB3 1 1
4 1939 1 1 21 SER HG H -12.748 1.298 5.107 1.00 . A A . 21 SER HG 1 1
4 1940 1 1 21 SER N N -11.193 0.165 2.547 1.00 . A A . 21 SER N 1 1
4 1941 1 1 21 SER O O -13.230 -2.758 3.253 1.00 . A A . 21 SER O 1 1
4 1942 1 1 21 SER OG O -12.998 1.461 4.189 1.00 . A A . 21 SER OG 1 1
4 1943 1 1 22 GLY C C -10.823 -4.075 0.516 1.00 . A A . 22 GLY C 1 1
4 1944 1 1 22 GLY CA C -12.158 -3.394 0.672 1.00 . A A . 22 GLY CA 1 1
4 1945 1 1 22 GLY H H -11.527 -1.426 1.015 1.00 . A A . 22 GLY H 1 1
4 1946 1 1 22 GLY HA2 H -12.816 -4.092 1.169 1.00 . A A . 22 GLY HA2 1 1
4 1947 1 1 22 GLY HA3 H -12.479 -3.152 -0.329 1.00 . A A . 22 GLY HA3 1 1
4 1948 1 1 22 GLY N N -12.081 -2.145 1.414 1.00 . A A . 22 GLY N 1 1
4 1949 1 1 22 GLY O O -10.742 -5.075 -0.184 1.00 . A A . 22 GLY O 1 1
4 1950 1 1 23 THR C C -7.670 -4.077 2.306 1.00 . A A . 23 THR C 1 1
4 1951 1 1 23 THR CA C -8.379 -4.020 0.944 1.00 . A A . 23 THR CA 1 1
4 1952 1 1 23 THR CB C -7.493 -3.150 0.033 1.00 . A A . 23 THR CB 1 1
4 1953 1 1 23 THR CG2 C -8.066 -2.881 -1.366 1.00 . A A . 23 THR CG2 1 1
4 1954 1 1 23 THR H H -9.842 -2.759 1.750 1.00 . A A . 23 THR H 1 1
4 1955 1 1 23 THR HA H -8.431 -5.022 0.557 1.00 . A A . 23 THR HA 1 1
4 1956 1 1 23 THR HB H -6.505 -3.634 -0.096 1.00 . A A . 23 THR HB 1 1
4 1957 1 1 23 THR HG1 H -7.701 -1.916 1.456 1.00 . A A . 23 THR HG1 1 1
4 1958 1 1 23 THR HG21 H -7.584 -1.979 -1.799 1.00 . A A . 23 THR HG21 1 1
4 1959 1 1 23 THR HG22 H -9.156 -2.705 -1.333 1.00 . A A . 23 THR HG22 1 1
4 1960 1 1 23 THR HG23 H -7.864 -3.748 -2.023 1.00 . A A . 23 THR HG23 1 1
4 1961 1 1 23 THR N N -9.744 -3.520 1.105 1.00 . A A . 23 THR N 1 1
4 1962 1 1 23 THR O O -8.034 -3.392 3.255 1.00 . A A . 23 THR O 1 1
4 1963 1 1 23 THR OG1 O -7.261 -1.875 0.589 1.00 . A A . 23 THR OG1 1 1
4 1964 1 1 24 THR C C -4.353 -4.743 3.507 1.00 . A A . 24 THR C 1 1
4 1965 1 1 24 THR CA C -5.834 -4.964 3.701 1.00 . A A . 24 THR CA 1 1
4 1966 1 1 24 THR CB C -6.020 -6.312 4.390 1.00 . A A . 24 THR CB 1 1
4 1967 1 1 24 THR CG2 C -7.336 -6.242 5.182 1.00 . A A . 24 THR CG2 1 1
4 1968 1 1 24 THR H H -6.415 -5.547 1.740 1.00 . A A . 24 THR H 1 1
4 1969 1 1 24 THR HA H -6.148 -4.191 4.387 1.00 . A A . 24 THR HA 1 1
4 1970 1 1 24 THR HB H -5.195 -6.558 5.094 1.00 . A A . 24 THR HB 1 1
4 1971 1 1 24 THR HG1 H -6.418 -8.151 3.851 1.00 . A A . 24 THR HG1 1 1
4 1972 1 1 24 THR HG21 H -8.191 -5.996 4.516 1.00 . A A . 24 THR HG21 1 1
4 1973 1 1 24 THR HG22 H -7.267 -5.439 5.949 1.00 . A A . 24 THR HG22 1 1
4 1974 1 1 24 THR HG23 H -7.548 -7.200 5.696 1.00 . A A . 24 THR HG23 1 1
4 1975 1 1 24 THR N N -6.586 -4.842 2.450 1.00 . A A . 24 THR N 1 1
4 1976 1 1 24 THR O O -3.777 -5.134 2.503 1.00 . A A . 24 THR O 1 1
4 1977 1 1 24 THR OG1 O -6.094 -7.355 3.430 1.00 . A A . 24 THR OG1 1 1
4 1978 1 1 25 CYS C C -1.392 -5.055 4.614 1.00 . A A . 25 CYS C 1 1
4 1979 1 1 25 CYS CA C -2.228 -3.831 4.323 1.00 . A A . 25 CYS CA 1 1
4 1980 1 1 25 CYS CB C -1.723 -2.658 5.206 1.00 . A A . 25 CYS CB 1 1
4 1981 1 1 25 CYS H H -4.097 -3.757 5.292 1.00 . A A . 25 CYS H 1 1
4 1982 1 1 25 CYS HA H -2.042 -3.573 3.289 1.00 . A A . 25 CYS HA 1 1
4 1983 1 1 25 CYS HB2 H -2.521 -1.890 5.248 1.00 . A A . 25 CYS HB2 1 1
4 1984 1 1 25 CYS HB3 H -1.564 -2.996 6.252 1.00 . A A . 25 CYS HB3 1 1
4 1985 1 1 25 CYS N N -3.662 -4.081 4.461 1.00 . A A . 25 CYS N 1 1
4 1986 1 1 25 CYS O O -1.500 -5.662 5.678 1.00 . A A . 25 CYS O 1 1
4 1987 1 1 25 CYS SG S -0.193 -1.885 4.580 1.00 . A A . 25 CYS SG 1 1
4 1988 1 1 26 GLN C C 1.561 -6.342 3.061 1.00 . A A . 26 GLN C 1 1
4 1989 1 1 26 GLN CA C 0.264 -6.637 3.772 1.00 . A A . 26 GLN CA 1 1
4 1990 1 1 26 GLN CB C -0.394 -7.880 3.114 1.00 . A A . 26 GLN CB 1 1
4 1991 1 1 26 GLN CD C -2.536 -9.207 2.708 1.00 . A A . 26 GLN CD 1 1
4 1992 1 1 26 GLN CG C -1.901 -8.022 3.429 1.00 . A A . 26 GLN CG 1 1
4 1993 1 1 26 GLN H H -0.498 -4.959 2.779 1.00 . A A . 26 GLN H 1 1
4 1994 1 1 26 GLN HA H 0.491 -6.818 4.814 1.00 . A A . 26 GLN HA 1 1
4 1995 1 1 26 GLN HB2 H -0.284 -7.817 2.008 1.00 . A A . 26 GLN HB2 1 1
4 1996 1 1 26 GLN HB3 H 0.140 -8.797 3.448 1.00 . A A . 26 GLN HB3 1 1
4 1997 1 1 26 GLN HE21 H -4.380 -8.547 3.229 1.00 . A A . 26 GLN HE21 1 1
4 1998 1 1 26 GLN HE22 H -4.319 -10.017 2.301 1.00 . A A . 26 GLN HE22 1 1
4 1999 1 1 26 GLN HG2 H -2.054 -8.131 4.521 1.00 . A A . 26 GLN HG2 1 1
4 2000 1 1 26 GLN HG3 H -2.440 -7.115 3.086 1.00 . A A . 26 GLN HG3 1 1
4 2001 1 1 26 GLN N N -0.546 -5.451 3.657 1.00 . A A . 26 GLN N 1 1
4 2002 1 1 26 GLN NE2 N -3.873 -9.323 2.855 1.00 . A A . 26 GLN NE2 1 1
4 2003 1 1 26 GLN O O 1.739 -5.312 2.419 1.00 . A A . 26 GLN O 1 1
4 2004 1 1 26 GLN OE1 O -1.893 -10.005 2.029 1.00 . A A . 26 GLN OE1 1 1
4 2005 1 1 27 VAL C C 4.052 -7.823 1.373 1.00 . A A . 27 VAL C 1 1
4 2006 1 1 27 VAL CA C 3.861 -7.022 2.639 1.00 . A A . 27 VAL CA 1 1
4 2007 1 1 27 VAL CB C 4.910 -7.346 3.695 1.00 . A A . 27 VAL CB 1 1
4 2008 1 1 27 VAL CG1 C 6.309 -7.553 3.082 1.00 . A A . 27 VAL CG1 1 1
4 2009 1 1 27 VAL CG2 C 4.930 -6.188 4.713 1.00 . A A . 27 VAL CG2 1 1
4 2010 1 1 27 VAL H H 2.373 -8.125 3.599 1.00 . A A . 27 VAL H 1 1
4 2011 1 1 27 VAL HA H 4.000 -5.984 2.371 1.00 . A A . 27 VAL HA 1 1
4 2012 1 1 27 VAL HB H 4.607 -8.282 4.221 1.00 . A A . 27 VAL HB 1 1
4 2013 1 1 27 VAL HG11 H 6.391 -8.561 2.621 1.00 . A A . 27 VAL HG11 1 1
4 2014 1 1 27 VAL HG12 H 7.091 -7.458 3.863 1.00 . A A . 27 VAL HG12 1 1
4 2015 1 1 27 VAL HG13 H 6.506 -6.786 2.305 1.00 . A A . 27 VAL HG13 1 1
4 2016 1 1 27 VAL HG21 H 3.976 -5.618 4.707 1.00 . A A . 27 VAL HG21 1 1
4 2017 1 1 27 VAL HG22 H 5.741 -5.471 4.463 1.00 . A A . 27 VAL HG22 1 1
4 2018 1 1 27 VAL HG23 H 5.099 -6.566 5.741 1.00 . A A . 27 VAL HG23 1 1
4 2019 1 1 27 VAL N N 2.535 -7.244 3.169 1.00 . A A . 27 VAL N 1 1
4 2020 1 1 27 VAL O O 3.822 -9.028 1.337 1.00 . A A . 27 VAL O 1 1
4 2021 1 1 28 LEU C C 6.468 -7.943 -0.863 1.00 . A A . 28 LEU C 1 1
4 2022 1 1 28 LEU CA C 4.954 -7.840 -0.903 1.00 . A A . 28 LEU CA 1 1
4 2023 1 1 28 LEU CB C 4.433 -7.112 -2.181 1.00 . A A . 28 LEU CB 1 1
4 2024 1 1 28 LEU CD1 C 5.612 -8.794 -3.766 1.00 . A A . 28 LEU CD1 1 1
4 2025 1 1 28 LEU CD2 C 4.416 -6.813 -4.727 1.00 . A A . 28 LEU CD2 1 1
4 2026 1 1 28 LEU CG C 5.207 -7.332 -3.514 1.00 . A A . 28 LEU CG 1 1
4 2027 1 1 28 LEU H H 4.615 -6.166 0.321 1.00 . A A . 28 LEU H 1 1
4 2028 1 1 28 LEU HA H 4.586 -8.859 -0.921 1.00 . A A . 28 LEU HA 1 1
4 2029 1 1 28 LEU HB2 H 3.380 -7.447 -2.324 1.00 . A A . 28 LEU HB2 1 1
4 2030 1 1 28 LEU HB3 H 4.390 -6.024 -1.964 1.00 . A A . 28 LEU HB3 1 1
4 2031 1 1 28 LEU HD11 H 5.107 -9.475 -3.050 1.00 . A A . 28 LEU HD11 1 1
4 2032 1 1 28 LEU HD12 H 6.710 -8.909 -3.632 1.00 . A A . 28 LEU HD12 1 1
4 2033 1 1 28 LEU HD13 H 5.361 -9.128 -4.791 1.00 . A A . 28 LEU HD13 1 1
4 2034 1 1 28 LEU HD21 H 4.593 -7.434 -5.628 1.00 . A A . 28 LEU HD21 1 1
4 2035 1 1 28 LEU HD22 H 4.725 -5.783 -4.993 1.00 . A A . 28 LEU HD22 1 1
4 2036 1 1 28 LEU HD23 H 3.324 -6.822 -4.516 1.00 . A A . 28 LEU HD23 1 1
4 2037 1 1 28 LEU HG H 6.151 -6.738 -3.454 1.00 . A A . 28 LEU HG 1 1
4 2038 1 1 28 LEU N N 4.495 -7.155 0.289 1.00 . A A . 28 LEU N 1 1
4 2039 1 1 28 LEU O O 7.063 -8.986 -1.122 1.00 . A A . 28 LEU O 1 1
4 2040 1 1 29 ASN C C 9.017 -5.957 0.683 1.00 . A A . 29 ASN C 1 1
4 2041 1 1 29 ASN CA C 8.605 -6.870 -0.477 1.00 . A A . 29 ASN CA 1 1
4 2042 1 1 29 ASN CB C 9.146 -6.545 -1.923 1.00 . A A . 29 ASN CB 1 1
4 2043 1 1 29 ASN CG C 9.138 -5.073 -2.311 1.00 . A A . 29 ASN CG 1 1
4 2044 1 1 29 ASN H H 6.708 -6.021 -0.186 1.00 . A A . 29 ASN H 1 1
4 2045 1 1 29 ASN HA H 8.928 -7.866 -0.197 1.00 . A A . 29 ASN HA 1 1
4 2046 1 1 29 ASN HB2 H 10.197 -6.887 -2.003 1.00 . A A . 29 ASN HB2 1 1
4 2047 1 1 29 ASN HB3 H 8.551 -7.133 -2.652 1.00 . A A . 29 ASN HB3 1 1
4 2048 1 1 29 ASN HD21 H 8.771 -5.427 -4.297 1.00 . A A . 29 ASN HD21 1 1
4 2049 1 1 29 ASN HD22 H 8.815 -3.758 -3.775 1.00 . A A . 29 ASN HD22 1 1
4 2050 1 1 29 ASN N N 7.162 -6.857 -0.497 1.00 . A A . 29 ASN N 1 1
4 2051 1 1 29 ASN ND2 N 8.870 -4.731 -3.590 1.00 . A A . 29 ASN ND2 1 1
4 2052 1 1 29 ASN O O 8.156 -5.256 1.219 1.00 . A A . 29 ASN O 1 1
4 2053 1 1 29 ASN OD1 O 9.362 -4.194 -1.495 1.00 . A A . 29 ASN OD1 1 1
4 2054 1 1 30 PRO C C 10.669 -3.595 2.035 1.00 . A A . 30 PRO C 1 1
4 2055 1 1 30 PRO CA C 10.669 -5.107 2.294 1.00 . A A . 30 PRO CA 1 1
4 2056 1 1 30 PRO CB C 12.104 -5.613 2.613 1.00 . A A . 30 PRO CB 1 1
4 2057 1 1 30 PRO CD C 11.386 -6.609 0.503 1.00 . A A . 30 PRO CD 1 1
4 2058 1 1 30 PRO CG C 12.480 -6.676 1.562 1.00 . A A . 30 PRO CG 1 1
4 2059 1 1 30 PRO HA H 9.973 -5.290 3.100 1.00 . A A . 30 PRO HA 1 1
4 2060 1 1 30 PRO HB2 H 12.854 -4.793 2.601 1.00 . A A . 30 PRO HB2 1 1
4 2061 1 1 30 PRO HB3 H 12.127 -6.063 3.628 1.00 . A A . 30 PRO HB3 1 1
4 2062 1 1 30 PRO HD2 H 11.728 -6.019 -0.377 1.00 . A A . 30 PRO HD2 1 1
4 2063 1 1 30 PRO HD3 H 11.100 -7.636 0.179 1.00 . A A . 30 PRO HD3 1 1
4 2064 1 1 30 PRO HG2 H 13.480 -6.482 1.118 1.00 . A A . 30 PRO HG2 1 1
4 2065 1 1 30 PRO HG3 H 12.488 -7.685 2.032 1.00 . A A . 30 PRO HG3 1 1
4 2066 1 1 30 PRO N N 10.272 -5.897 1.124 1.00 . A A . 30 PRO N 1 1
4 2067 1 1 30 PRO O O 11.067 -2.828 2.904 1.00 . A A . 30 PRO O 1 1
4 2068 1 1 31 TYR C C 8.928 -1.359 -0.173 1.00 . A A . 31 TYR C 1 1
4 2069 1 1 31 TYR CA C 10.295 -1.780 0.372 1.00 . A A . 31 TYR CA 1 1
4 2070 1 1 31 TYR CB C 11.405 -1.628 -0.723 1.00 . A A . 31 TYR CB 1 1
4 2071 1 1 31 TYR CD1 C 13.286 -3.070 0.228 1.00 . A A . 31 TYR CD1 1 1
4 2072 1 1 31 TYR CD2 C 13.602 -0.685 0.119 1.00 . A A . 31 TYR CD2 1 1
4 2073 1 1 31 TYR CE1 C 14.487 -3.200 0.939 1.00 . A A . 31 TYR CE1 1 1
4 2074 1 1 31 TYR CE2 C 14.807 -0.807 0.826 1.00 . A A . 31 TYR CE2 1 1
4 2075 1 1 31 TYR CG C 12.785 -1.802 -0.119 1.00 . A A . 31 TYR CG 1 1
4 2076 1 1 31 TYR CZ C 15.232 -2.065 1.261 1.00 . A A . 31 TYR CZ 1 1
4 2077 1 1 31 TYR H H 9.904 -3.800 0.165 1.00 . A A . 31 TYR H 1 1
4 2078 1 1 31 TYR HA H 10.501 -1.122 1.205 1.00 . A A . 31 TYR HA 1 1
4 2079 1 1 31 TYR HB2 H 11.273 -2.395 -1.514 1.00 . A A . 31 TYR HB2 1 1
4 2080 1 1 31 TYR HB3 H 11.355 -0.624 -1.196 1.00 . A A . 31 TYR HB3 1 1
4 2081 1 1 31 TYR HD1 H 12.699 -3.947 0.015 1.00 . A A . 31 TYR HD1 1 1
4 2082 1 1 31 TYR HD2 H 13.270 0.287 -0.207 1.00 . A A . 31 TYR HD2 1 1
4 2083 1 1 31 TYR HE1 H 14.826 -4.170 1.273 1.00 . A A . 31 TYR HE1 1 1
4 2084 1 1 31 TYR HE2 H 15.390 0.074 1.050 1.00 . A A . 31 TYR HE2 1 1
4 2085 1 1 31 TYR HH H 16.695 -1.322 2.272 1.00 . A A . 31 TYR HH 1 1
4 2086 1 1 31 TYR N N 10.240 -3.145 0.846 1.00 . A A . 31 TYR N 1 1
4 2087 1 1 31 TYR O O 8.768 -0.284 -0.750 1.00 . A A . 31 TYR O 1 1
4 2088 1 1 31 TYR OH O 16.404 -2.202 2.026 1.00 . A A . 31 TYR OH 1 1
4 2089 1 1 32 TYR C C 5.566 -2.909 0.133 1.00 . A A . 32 TYR C 1 1
4 2090 1 1 32 TYR CA C 6.593 -2.046 -0.594 1.00 . A A . 32 TYR CA 1 1
4 2091 1 1 32 TYR CB C 6.645 -2.441 -2.107 1.00 . A A . 32 TYR CB 1 1
4 2092 1 1 32 TYR CD1 C 4.562 -1.267 -2.893 1.00 . A A . 32 TYR CD1 1 1
4 2093 1 1 32 TYR CD2 C 4.779 -3.616 -3.352 1.00 . A A . 32 TYR CD2 1 1
4 2094 1 1 32 TYR CE1 C 3.297 -1.246 -3.492 1.00 . A A . 32 TYR CE1 1 1
4 2095 1 1 32 TYR CE2 C 3.526 -3.603 -3.973 1.00 . A A . 32 TYR CE2 1 1
4 2096 1 1 32 TYR CG C 5.307 -2.444 -2.799 1.00 . A A . 32 TYR CG 1 1
4 2097 1 1 32 TYR CZ C 2.798 -2.419 -4.047 1.00 . A A . 32 TYR CZ 1 1
4 2098 1 1 32 TYR H H 8.040 -3.032 0.553 1.00 . A A . 32 TYR H 1 1
4 2099 1 1 32 TYR HA H 6.274 -1.016 -0.505 1.00 . A A . 32 TYR HA 1 1
4 2100 1 1 32 TYR HB2 H 7.327 -1.766 -2.666 1.00 . A A . 32 TYR HB2 1 1
4 2101 1 1 32 TYR HB3 H 7.044 -3.471 -2.165 1.00 . A A . 32 TYR HB3 1 1
4 2102 1 1 32 TYR HD1 H 4.989 -0.387 -2.477 1.00 . A A . 32 TYR HD1 1 1
4 2103 1 1 32 TYR HD2 H 5.347 -4.528 -3.284 1.00 . A A . 32 TYR HD2 1 1
4 2104 1 1 32 TYR HE1 H 2.717 -0.341 -3.552 1.00 . A A . 32 TYR HE1 1 1
4 2105 1 1 32 TYR HE2 H 3.095 -4.498 -4.392 1.00 . A A . 32 TYR HE2 1 1
4 2106 1 1 32 TYR HH H 1.092 -1.634 -4.617 1.00 . A A . 32 TYR HH 1 1
4 2107 1 1 32 TYR N N 7.886 -2.186 0.041 1.00 . A A . 32 TYR N 1 1
4 2108 1 1 32 TYR O O 5.446 -4.115 -0.098 1.00 . A A . 32 TYR O 1 1
4 2109 1 1 32 TYR OH O 1.586 -2.459 -4.725 1.00 . A A . 32 TYR OH 1 1
4 2110 1 1 33 SER C C 2.384 -2.526 0.878 1.00 . A A . 33 SER C 1 1
4 2111 1 1 33 SER CA C 3.617 -2.938 1.615 1.00 . A A . 33 SER CA 1 1
4 2112 1 1 33 SER CB C 3.384 -2.666 3.108 1.00 . A A . 33 SER CB 1 1
4 2113 1 1 33 SER H H 4.952 -1.345 1.303 1.00 . A A . 33 SER H 1 1
4 2114 1 1 33 SER HA H 3.713 -4.008 1.512 1.00 . A A . 33 SER HA 1 1
4 2115 1 1 33 SER HB2 H 3.246 -1.584 3.295 1.00 . A A . 33 SER HB2 1 1
4 2116 1 1 33 SER HB3 H 2.469 -3.179 3.478 1.00 . A A . 33 SER HB3 1 1
4 2117 1 1 33 SER HG H 5.226 -2.512 3.667 1.00 . A A . 33 SER HG 1 1
4 2118 1 1 33 SER N N 4.776 -2.285 1.022 1.00 . A A . 33 SER N 1 1
4 2119 1 1 33 SER O O 2.033 -1.348 0.803 1.00 . A A . 33 SER O 1 1
4 2120 1 1 33 SER OG O 4.506 -3.143 3.840 1.00 . A A . 33 SER OG 1 1
4 2121 1 1 34 GLN C C -0.707 -3.491 0.131 1.00 . A A . 34 GLN C 1 1
4 2122 1 1 34 GLN CA C 0.620 -3.384 -0.607 1.00 . A A . 34 GLN CA 1 1
4 2123 1 1 34 GLN CB C 0.768 -4.482 -1.686 1.00 . A A . 34 GLN CB 1 1
4 2124 1 1 34 GLN CD C 0.013 -5.430 -3.919 1.00 . A A . 34 GLN CD 1 1
4 2125 1 1 34 GLN CG C -0.302 -4.446 -2.791 1.00 . A A . 34 GLN CG 1 1
4 2126 1 1 34 GLN H H 1.952 -4.456 0.545 1.00 . A A . 34 GLN H 1 1
4 2127 1 1 34 GLN HA H 0.666 -2.414 -1.077 1.00 . A A . 34 GLN HA 1 1
4 2128 1 1 34 GLN HB2 H 1.770 -4.340 -2.147 1.00 . A A . 34 GLN HB2 1 1
4 2129 1 1 34 GLN HB3 H 0.772 -5.486 -1.202 1.00 . A A . 34 GLN HB3 1 1
4 2130 1 1 34 GLN HE21 H 0.515 -3.934 -5.196 1.00 . A A . 34 GLN HE21 1 1
4 2131 1 1 34 GLN HE22 H 0.449 -5.550 -5.871 1.00 . A A . 34 GLN HE22 1 1
4 2132 1 1 34 GLN HG2 H -1.288 -4.736 -2.374 1.00 . A A . 34 GLN HG2 1 1
4 2133 1 1 34 GLN HG3 H -0.378 -3.412 -3.182 1.00 . A A . 34 GLN HG3 1 1
4 2134 1 1 34 GLN N N 1.725 -3.517 0.288 1.00 . A A . 34 GLN N 1 1
4 2135 1 1 34 GLN NE2 N 0.285 -4.909 -5.132 1.00 . A A . 34 GLN NE2 1 1
4 2136 1 1 34 GLN O O -0.800 -4.047 1.220 1.00 . A A . 34 GLN O 1 1
4 2137 1 1 34 GLN OE1 O 0.010 -6.645 -3.757 1.00 . A A . 34 GLN OE1 1 1
4 2138 1 1 35 CYS C C -3.923 -4.077 -0.798 1.00 . A A . 35 CYS C 1 1
4 2139 1 1 35 CYS CA C -3.137 -3.057 0.009 1.00 . A A . 35 CYS CA 1 1
4 2140 1 1 35 CYS CB C -3.854 -1.704 -0.174 1.00 . A A . 35 CYS CB 1 1
4 2141 1 1 35 CYS H H -1.619 -2.347 -1.252 1.00 . A A . 35 CYS H 1 1
4 2142 1 1 35 CYS HA H -3.149 -3.378 1.038 1.00 . A A . 35 CYS HA 1 1
4 2143 1 1 35 CYS HB2 H -3.725 -1.369 -1.223 1.00 . A A . 35 CYS HB2 1 1
4 2144 1 1 35 CYS HB3 H -4.935 -1.817 0.017 1.00 . A A . 35 CYS HB3 1 1
4 2145 1 1 35 CYS N N -1.773 -2.932 -0.455 1.00 . A A . 35 CYS N 1 1
4 2146 1 1 35 CYS O O -4.097 -3.920 -2.004 1.00 . A A . 35 CYS O 1 1
4 2147 1 1 35 CYS SG S -3.228 -0.422 0.926 1.00 . A A . 35 CYS SG 1 1
4 2148 1 1 36 LEU C C -6.561 -6.368 -0.538 1.00 . A A . 36 LEU C 1 1
4 2149 1 1 36 LEU CA C -5.065 -6.250 -0.851 1.00 . A A . 36 LEU CA 1 1
4 2150 1 1 36 LEU CB C -4.408 -7.588 -0.462 1.00 . A A . 36 LEU CB 1 1
4 2151 1 1 36 LEU CD1 C -2.819 -7.393 -2.401 1.00 . A A . 36 LEU CD1 1 1
4 2152 1 1 36 LEU CD2 C -1.969 -6.892 -0.070 1.00 . A A . 36 LEU CD2 1 1
4 2153 1 1 36 LEU CG C -2.944 -7.730 -0.910 1.00 . A A . 36 LEU CG 1 1
4 2154 1 1 36 LEU H H -4.299 -5.282 0.817 1.00 . A A . 36 LEU H 1 1
4 2155 1 1 36 LEU HA H -4.999 -6.114 -1.916 1.00 . A A . 36 LEU HA 1 1
4 2156 1 1 36 LEU HB2 H -4.483 -7.722 0.640 1.00 . A A . 36 LEU HB2 1 1
4 2157 1 1 36 LEU HB3 H -4.989 -8.414 -0.933 1.00 . A A . 36 LEU HB3 1 1
4 2158 1 1 36 LEU HD11 H -2.850 -6.294 -2.549 1.00 . A A . 36 LEU HD11 1 1
4 2159 1 1 36 LEU HD12 H -3.656 -7.841 -2.974 1.00 . A A . 36 LEU HD12 1 1
4 2160 1 1 36 LEU HD13 H -1.862 -7.779 -2.802 1.00 . A A . 36 LEU HD13 1 1
4 2161 1 1 36 LEU HD21 H -1.833 -5.892 -0.520 1.00 . A A . 36 LEU HD21 1 1
4 2162 1 1 36 LEU HD22 H -0.977 -7.380 -0.002 1.00 . A A . 36 LEU HD22 1 1
4 2163 1 1 36 LEU HD23 H -2.372 -6.742 0.953 1.00 . A A . 36 LEU HD23 1 1
4 2164 1 1 36 LEU HG H -2.671 -8.803 -0.755 1.00 . A A . 36 LEU HG 1 1
4 2165 1 1 36 LEU N N -4.437 -5.138 -0.169 1.00 . A A . 36 LEU N 1 1
4 2166 1 1 36 LEU O O -6.915 -6.788 0.584 1.00 . A A . 36 LEU O 1 1
4 2167 1 1 36 LEU OXT O -7.381 -6.042 -1.432 1.00 . A A . 36 LEU OXT 1 1
4 2168 2 2 1 MAN C1 C -9.676 3.922 0.261 1.00 . B A . 101 MAN C1 1 1
4 2169 2 2 1 MAN C2 C -8.794 4.328 -0.884 1.00 . B A . 101 MAN C2 1 1
4 2170 2 2 1 MAN C3 C -8.761 5.835 -0.962 1.00 . B A . 101 MAN C3 1 1
4 2171 2 2 1 MAN C4 C -10.156 6.363 -1.178 1.00 . B A . 101 MAN C4 1 1
4 2172 2 2 1 MAN C5 C -11.135 5.751 -0.170 1.00 . B A . 101 MAN C5 1 1
4 2173 2 2 1 MAN C6 C -12.577 6.027 -0.516 1.00 . B A . 101 MAN C6 1 1
4 2174 2 2 1 MAN H1 H -9.699 2.826 0.291 1.00 . B A . 101 MAN H1 1 1
4 2175 2 2 1 MAN H2 H -7.778 3.990 -0.651 1.00 . B A . 101 MAN H2 1 1
4 2176 2 2 1 MAN H3 H -8.429 6.224 0.022 1.00 . B A . 101 MAN H3 1 1
4 2177 2 2 1 MAN H4 H -10.475 6.060 -2.204 1.00 . B A . 101 MAN H4 1 1
4 2178 2 2 1 MAN H5 H -10.939 6.186 0.837 1.00 . B A . 101 MAN H5 1 1
4 2179 2 2 1 MAN H61 H -12.834 5.553 -1.492 1.00 . B A . 101 MAN H61 1 1
4 2180 2 2 1 MAN H62 H -12.740 7.123 -0.620 1.00 . B A . 101 MAN H62 1 1
4 2181 2 2 1 MAN HO2 H -10.004 3.954 -2.415 1.00 . B A . 101 MAN HO2 1 1
4 2182 2 2 1 MAN HO3 H -7.706 7.248 -1.892 1.00 . B A . 101 MAN HO3 1 1
4 2183 2 2 1 MAN HO4 H -9.960 8.141 -0.259 1.00 . B A . 101 MAN HO4 1 1
4 2184 2 2 1 MAN HO6 H -13.052 4.793 0.959 1.00 . B A . 101 MAN HO6 1 1
4 2185 2 2 1 MAN O1 O -9.271 4.499 1.530 1.00 . B A . 101 MAN O1 1 1
4 2186 2 2 1 MAN O2 O -9.141 3.662 -2.104 1.00 . B A . 101 MAN O2 1 1
4 2187 2 2 1 MAN O3 O -7.806 6.289 -1.913 1.00 . B A . 101 MAN O3 1 1
4 2188 2 2 1 MAN O4 O -10.195 7.786 -1.118 1.00 . B A . 101 MAN O4 1 1
4 2189 2 2 1 MAN O5 O -11.003 4.324 -0.055 1.00 . B A . 101 MAN O5 1 1
4 2190 2 2 1 MAN O6 O -13.446 5.552 0.514 1.00 . B A . 101 MAN O6 1 1
4 2191 3 2 1 MAN C1 C -5.259 3.980 -6.384 1.00 . C A . 102 MAN C1 1 1
4 2192 3 2 1 MAN C2 C -4.120 3.189 -6.992 1.00 . C A . 102 MAN C2 1 1
4 2193 3 2 1 MAN C3 C -2.994 3.145 -5.979 1.00 . C A . 102 MAN C3 1 1
4 2194 3 2 1 MAN C4 C -2.516 4.551 -5.696 1.00 . C A . 102 MAN C4 1 1
4 2195 3 2 1 MAN C5 C -3.696 5.438 -5.280 1.00 . C A . 102 MAN C5 1 1
4 2196 3 2 1 MAN C6 C -3.340 6.906 -5.178 1.00 . C A . 102 MAN C6 1 1
4 2197 3 2 1 MAN H1 H -6.134 3.982 -7.074 1.00 . C A . 102 MAN H1 1 1
4 2198 3 2 1 MAN H2 H -4.438 2.142 -7.197 1.00 . C A . 102 MAN H2 1 1
4 2199 3 2 1 MAN H3 H -3.389 2.726 -5.023 1.00 . C A . 102 MAN H3 1 1
4 2200 3 2 1 MAN H4 H -2.089 4.972 -6.639 1.00 . C A . 102 MAN H4 1 1
4 2201 3 2 1 MAN H5 H -4.045 5.115 -4.271 1.00 . C A . 102 MAN H5 1 1
4 2202 3 2 1 MAN H61 H -3.024 7.294 -6.174 1.00 . C A . 102 MAN H61 1 1
4 2203 3 2 1 MAN H62 H -2.498 7.052 -4.464 1.00 . C A . 102 MAN H62 1 1
4 2204 3 2 1 MAN HO2 H -3.738 4.694 -8.209 1.00 . C A . 102 MAN HO2 1 1
4 2205 3 2 1 MAN HO3 H -1.124 2.629 -5.972 1.00 . C A . 102 MAN HO3 1 1
4 2206 3 2 1 MAN HO4 H -0.727 5.055 -4.997 1.00 . C A . 102 MAN HO4 1 1
4 2207 3 2 1 MAN HO6 H -5.236 7.387 -5.209 1.00 . C A . 102 MAN HO6 1 1
4 2208 3 2 1 MAN O1 O -5.651 3.493 -5.088 1.00 . C A . 102 MAN O1 1 1
4 2209 3 2 1 MAN O2 O -3.726 3.732 -8.256 1.00 . C A . 102 MAN O2 1 1
4 2210 3 2 1 MAN O3 O -1.927 2.293 -6.380 1.00 . C A . 102 MAN O3 1 1
4 2211 3 2 1 MAN O4 O -1.486 4.530 -4.708 1.00 . C A . 102 MAN O4 1 1
4 2212 3 2 1 MAN O5 O -4.795 5.330 -6.219 1.00 . C A . 102 MAN O5 1 1
4 2213 3 2 1 MAN O6 O -4.456 7.667 -4.714 1.00 . C A . 102 MAN O6 1 1
4 2214 4 2 1 MAN C1 C 7.335 11.619 -0.935 1.00 . D A . 103 MAN C1 1 1
4 2215 4 2 1 MAN C2 C 6.934 12.373 -2.184 1.00 . D A . 103 MAN C2 1 1
4 2216 4 2 1 MAN C3 C 7.169 11.475 -3.384 1.00 . D A . 103 MAN C3 1 1
4 2217 4 2 1 MAN C4 C 8.649 11.125 -3.458 1.00 . D A . 103 MAN C4 1 1
4 2218 4 2 1 MAN C5 C 9.079 10.485 -2.137 1.00 . D A . 103 MAN C5 1 1
4 2219 4 2 1 MAN C6 C 10.569 10.208 -2.085 1.00 . D A . 103 MAN C6 1 1
4 2220 4 2 1 MAN H1 H 7.165 12.255 -0.036 1.00 . D A . 103 MAN H1 1 1
4 2221 4 2 1 MAN H2 H 5.854 12.637 -2.140 1.00 . D A . 103 MAN H2 1 1
4 2222 4 2 1 MAN H3 H 6.621 10.515 -3.233 1.00 . D A . 103 MAN H3 1 1
4 2223 4 2 1 MAN H4 H 9.234 12.064 -3.594 1.00 . D A . 103 MAN H4 1 1
4 2224 4 2 1 MAN H5 H 8.548 9.508 -2.024 1.00 . D A . 103 MAN H5 1 1
4 2225 4 2 1 MAN H61 H 11.136 11.163 -2.168 1.00 . D A . 103 MAN H61 1 1
4 2226 4 2 1 MAN H62 H 10.871 9.562 -2.940 1.00 . D A . 103 MAN H62 1 1
4 2227 4 2 1 MAN HO2 H 8.543 13.494 -2.033 1.00 . D A . 103 MAN HO2 1 1
4 2228 4 2 1 MAN HO3 H 6.472 12.984 -4.422 1.00 . D A . 103 MAN HO3 1 1
4 2229 4 2 1 MAN HO4 H 8.218 9.748 -4.805 1.00 . D A . 103 MAN HO4 1 1
4 2230 4 2 1 MAN HO6 H 10.568 10.033 -0.129 1.00 . D A . 103 MAN HO6 1 1
4 2231 4 2 1 MAN O1 O 6.561 10.423 -0.780 1.00 . D A . 103 MAN O1 1 1
4 2232 4 2 1 MAN O2 O 7.621 13.622 -2.293 1.00 . D A . 103 MAN O2 1 1
4 2233 4 2 1 MAN O3 O 6.629 12.043 -4.574 1.00 . D A . 103 MAN O3 1 1
4 2234 4 2 1 MAN O4 O 8.981 10.274 -4.551 1.00 . D A . 103 MAN O4 1 1
4 2235 4 2 1 MAN O5 O 8.742 11.336 -1.017 1.00 . D A . 103 MAN O5 1 1
4 2236 4 2 1 MAN O6 O 10.934 9.543 -0.876 1.00 . D A . 103 MAN O6 1 1
5 2237 1 1 1 THR C C -5.982 5.072 1.085 1.00 . A A . 1 THR C 1 1
5 2238 1 1 1 THR CA C -6.809 5.092 2.347 1.00 . A A . 1 THR CA 1 1
5 2239 1 1 1 THR CB C -7.895 3.969 2.273 1.00 . A A . 1 THR CB 1 1
5 2240 1 1 1 THR CG2 C -8.264 3.505 3.677 1.00 . A A . 1 THR CG2 1 1
5 2241 1 1 1 THR H1 H -7.357 6.762 3.572 1.00 . A A . 1 THR H1 1 1
5 2242 1 1 1 THR H2 H -8.509 6.265 2.428 1.00 . A A . 1 THR H2 1 1
5 2243 1 1 1 THR H3 H -7.136 7.123 1.907 1.00 . A A . 1 THR H3 1 1
5 2244 1 1 1 THR HA H -6.135 4.911 3.165 1.00 . A A . 1 THR HA 1 1
5 2245 1 1 1 THR HB H -7.567 3.088 1.684 1.00 . A A . 1 THR HB 1 1
5 2246 1 1 1 THR HG21 H -8.710 4.301 4.302 1.00 . A A . 1 THR HG21 1 1
5 2247 1 1 1 THR HG22 H -7.352 3.125 4.183 1.00 . A A . 1 THR HG22 1 1
5 2248 1 1 1 THR HG23 H -8.977 2.655 3.658 1.00 . A A . 1 THR HG23 1 1
5 2249 1 1 1 THR N N -7.487 6.423 2.600 1.00 . A A . 1 THR N 1 1
5 2250 1 1 1 THR O O -5.879 6.104 0.439 1.00 . A A . 1 THR O 1 1
5 2251 1 1 2 GLN C C -5.761 2.599 -1.329 1.00 . A A . 2 GLN C 1 1
5 2252 1 1 2 GLN CA C -4.923 3.648 -0.652 1.00 . A A . 2 GLN CA 1 1
5 2253 1 1 2 GLN CB C -3.493 3.083 -0.661 1.00 . A A . 2 GLN CB 1 1
5 2254 1 1 2 GLN CD C -2.420 5.217 -1.164 1.00 . A A . 2 GLN CD 1 1
5 2255 1 1 2 GLN CG C -2.668 3.834 -1.714 1.00 . A A . 2 GLN CG 1 1
5 2256 1 1 2 GLN H H -5.370 3.124 1.301 1.00 . A A . 2 GLN H 1 1
5 2257 1 1 2 GLN HA H -4.986 4.549 -1.249 1.00 . A A . 2 GLN HA 1 1
5 2258 1 1 2 GLN HB2 H -3.063 3.195 0.363 1.00 . A A . 2 GLN HB2 1 1
5 2259 1 1 2 GLN HB3 H -3.426 1.996 -0.883 1.00 . A A . 2 GLN HB3 1 1
5 2260 1 1 2 GLN HE21 H -1.070 4.391 0.118 1.00 . A A . 2 GLN HE21 1 1
5 2261 1 1 2 GLN HE22 H -1.326 6.091 0.322 1.00 . A A . 2 GLN HE22 1 1
5 2262 1 1 2 GLN HG2 H -1.700 3.345 -1.907 1.00 . A A . 2 GLN HG2 1 1
5 2263 1 1 2 GLN HG3 H -3.202 3.929 -2.679 1.00 . A A . 2 GLN HG3 1 1
5 2264 1 1 2 GLN N N -5.429 3.909 0.679 1.00 . A A . 2 GLN N 1 1
5 2265 1 1 2 GLN NE2 N -1.479 5.257 -0.203 1.00 . A A . 2 GLN NE2 1 1
5 2266 1 1 2 GLN O O -6.452 1.823 -0.670 1.00 . A A . 2 GLN O 1 1
5 2267 1 1 2 GLN OE1 O -3.042 6.210 -1.522 1.00 . A A . 2 GLN OE1 1 1
5 2268 1 1 3 SER C C -5.984 0.288 -3.452 1.00 . A A . 3 SER C 1 1
5 2269 1 1 3 SER CA C -6.501 1.702 -3.505 1.00 . A A . 3 SER CA 1 1
5 2270 1 1 3 SER CB C -6.491 2.138 -4.996 1.00 . A A . 3 SER CB 1 1
5 2271 1 1 3 SER H H -5.174 3.243 -3.185 1.00 . A A . 3 SER H 1 1
5 2272 1 1 3 SER HA H -7.514 1.705 -3.132 1.00 . A A . 3 SER HA 1 1
5 2273 1 1 3 SER HB2 H -5.867 1.467 -5.622 1.00 . A A . 3 SER HB2 1 1
5 2274 1 1 3 SER HB3 H -7.522 2.183 -5.403 1.00 . A A . 3 SER HB3 1 1
5 2275 1 1 3 SER N N -5.728 2.593 -2.668 1.00 . A A . 3 SER N 1 1
5 2276 1 1 3 SER O O -4.887 0.018 -2.974 1.00 . A A . 3 SER O 1 1
5 2277 1 1 4 HIS C C -5.064 -2.101 -5.018 1.00 . A A . 4 HIS C 1 1
5 2278 1 1 4 HIS CA C -6.293 -2.044 -4.140 1.00 . A A . 4 HIS CA 1 1
5 2279 1 1 4 HIS CB C -7.373 -2.957 -4.772 1.00 . A A . 4 HIS CB 1 1
5 2280 1 1 4 HIS CD2 C -6.173 -5.123 -3.932 1.00 . A A . 4 HIS CD2 1 1
5 2281 1 1 4 HIS CE1 C -7.841 -6.509 -4.225 1.00 . A A . 4 HIS CE1 1 1
5 2282 1 1 4 HIS CG C -7.202 -4.426 -4.474 1.00 . A A . 4 HIS CG 1 1
5 2283 1 1 4 HIS H H -7.642 -0.445 -4.382 1.00 . A A . 4 HIS H 1 1
5 2284 1 1 4 HIS HA H -6.011 -2.407 -3.160 1.00 . A A . 4 HIS HA 1 1
5 2285 1 1 4 HIS HB2 H -8.353 -2.646 -4.350 1.00 . A A . 4 HIS HB2 1 1
5 2286 1 1 4 HIS HB3 H -7.423 -2.808 -5.874 1.00 . A A . 4 HIS HB3 1 1
5 2287 1 1 4 HIS HD1 H -9.153 -5.116 -4.974 1.00 . A A . 4 HIS HD1 1 1
5 2288 1 1 4 HIS HD2 H -5.217 -4.778 -3.555 1.00 . A A . 4 HIS HD2 1 1
5 2289 1 1 4 HIS HE1 H -8.429 -7.415 -4.239 1.00 . A A . 4 HIS HE1 1 1
5 2290 1 1 4 HIS HE2 H -6.187 -7.074 -3.155 1.00 . A A . 4 HIS HE2 1 1
5 2291 1 1 4 HIS N N -6.755 -0.672 -3.999 1.00 . A A . 4 HIS N 1 1
5 2292 1 1 4 HIS ND1 N -8.229 -5.315 -4.657 1.00 . A A . 4 HIS ND1 1 1
5 2293 1 1 4 HIS NE2 N -6.600 -6.415 -3.794 1.00 . A A . 4 HIS NE2 1 1
5 2294 1 1 4 HIS O O -5.035 -1.517 -6.096 1.00 . A A . 4 HIS O 1 1
5 2295 1 1 5 TYR C C -1.923 -1.688 -5.127 1.00 . A A . 5 TYR C 1 1
5 2296 1 1 5 TYR CA C -2.739 -2.970 -5.140 1.00 . A A . 5 TYR CA 1 1
5 2297 1 1 5 TYR CB C -2.780 -3.613 -6.548 1.00 . A A . 5 TYR CB 1 1
5 2298 1 1 5 TYR CD1 C -3.288 -6.075 -6.120 1.00 . A A . 5 TYR CD1 1 1
5 2299 1 1 5 TYR CD2 C -5.003 -4.644 -7.054 1.00 . A A . 5 TYR CD2 1 1
5 2300 1 1 5 TYR CE1 C -4.174 -7.164 -6.175 1.00 . A A . 5 TYR CE1 1 1
5 2301 1 1 5 TYR CE2 C -5.895 -5.716 -7.081 1.00 . A A . 5 TYR CE2 1 1
5 2302 1 1 5 TYR CG C -3.699 -4.803 -6.562 1.00 . A A . 5 TYR CG 1 1
5 2303 1 1 5 TYR CZ C -5.478 -6.978 -6.656 1.00 . A A . 5 TYR CZ 1 1
5 2304 1 1 5 TYR H H -4.089 -3.174 -3.593 1.00 . A A . 5 TYR H 1 1
5 2305 1 1 5 TYR HA H -2.228 -3.664 -4.495 1.00 . A A . 5 TYR HA 1 1
5 2306 1 1 5 TYR HB2 H -3.131 -2.869 -7.295 1.00 . A A . 5 TYR HB2 1 1
5 2307 1 1 5 TYR HB3 H -1.767 -3.949 -6.854 1.00 . A A . 5 TYR HB3 1 1
5 2308 1 1 5 TYR HD1 H -2.283 -6.220 -5.745 1.00 . A A . 5 TYR HD1 1 1
5 2309 1 1 5 TYR HD2 H -5.319 -3.671 -7.399 1.00 . A A . 5 TYR HD2 1 1
5 2310 1 1 5 TYR HE1 H -3.850 -8.134 -5.826 1.00 . A A . 5 TYR HE1 1 1
5 2311 1 1 5 TYR HE2 H -6.908 -5.571 -7.424 1.00 . A A . 5 TYR HE2 1 1
5 2312 1 1 5 TYR HH H -5.921 -8.839 -6.866 1.00 . A A . 5 TYR HH 1 1
5 2313 1 1 5 TYR N N -4.024 -2.773 -4.516 1.00 . A A . 5 TYR N 1 1
5 2314 1 1 5 TYR O O -0.905 -1.582 -5.795 1.00 . A A . 5 TYR O 1 1
5 2315 1 1 5 TYR OH O -6.410 -8.031 -6.687 1.00 . A A . 5 TYR OH 1 1
5 2316 1 1 6 GLY C C -0.619 0.342 -2.967 1.00 . A A . 6 GLY C 1 1
5 2317 1 1 6 GLY CA C -1.597 0.539 -4.084 1.00 . A A . 6 GLY CA 1 1
5 2318 1 1 6 GLY H H -3.220 -0.778 -3.851 1.00 . A A . 6 GLY H 1 1
5 2319 1 1 6 GLY HA2 H -1.040 0.799 -4.974 1.00 . A A . 6 GLY HA2 1 1
5 2320 1 1 6 GLY HA3 H -2.304 1.296 -3.784 1.00 . A A . 6 GLY HA3 1 1
5 2321 1 1 6 GLY N N -2.344 -0.686 -4.324 1.00 . A A . 6 GLY N 1 1
5 2322 1 1 6 GLY O O -0.268 -0.780 -2.624 1.00 . A A . 6 GLY O 1 1
5 2323 1 1 7 GLN C C 0.251 1.759 0.059 1.00 . A A . 7 GLN C 1 1
5 2324 1 1 7 GLN CA C 0.840 1.355 -1.283 1.00 . A A . 7 GLN CA 1 1
5 2325 1 1 7 GLN CB C 1.980 2.342 -1.623 1.00 . A A . 7 GLN CB 1 1
5 2326 1 1 7 GLN CD C 4.288 1.836 -2.611 1.00 . A A . 7 GLN CD 1 1
5 2327 1 1 7 GLN CG C 3.416 1.827 -1.343 1.00 . A A . 7 GLN CG 1 1
5 2328 1 1 7 GLN H H -0.408 2.336 -2.634 1.00 . A A . 7 GLN H 1 1
5 2329 1 1 7 GLN HA H 1.220 0.352 -1.186 1.00 . A A . 7 GLN HA 1 1
5 2330 1 1 7 GLN HB2 H 1.856 2.629 -2.692 1.00 . A A . 7 GLN HB2 1 1
5 2331 1 1 7 GLN HB3 H 1.840 3.291 -1.075 1.00 . A A . 7 GLN HB3 1 1
5 2332 1 1 7 GLN HE21 H 6.045 1.827 -1.557 1.00 . A A . 7 GLN HE21 1 1
5 2333 1 1 7 GLN HE22 H 6.162 1.700 -3.289 1.00 . A A . 7 GLN HE22 1 1
5 2334 1 1 7 GLN HG2 H 3.888 2.450 -0.561 1.00 . A A . 7 GLN HG2 1 1
5 2335 1 1 7 GLN HG3 H 3.358 0.796 -0.949 1.00 . A A . 7 GLN HG3 1 1
5 2336 1 1 7 GLN N N -0.154 1.422 -2.335 1.00 . A A . 7 GLN N 1 1
5 2337 1 1 7 GLN NE2 N 5.626 1.733 -2.448 1.00 . A A . 7 GLN NE2 1 1
5 2338 1 1 7 GLN O O -0.595 2.638 0.157 1.00 . A A . 7 GLN O 1 1
5 2339 1 1 7 GLN OE1 O 3.805 1.887 -3.737 1.00 . A A . 7 GLN OE1 1 1
5 2340 1 1 8 CYS C C 1.608 1.754 3.349 1.00 . A A . 8 CYS C 1 1
5 2341 1 1 8 CYS CA C 0.366 1.610 2.492 1.00 . A A . 8 CYS CA 1 1
5 2342 1 1 8 CYS CB C -0.694 0.650 3.138 1.00 . A A . 8 CYS CB 1 1
5 2343 1 1 8 CYS H H 1.280 0.327 1.045 1.00 . A A . 8 CYS H 1 1
5 2344 1 1 8 CYS HA H -0.041 2.613 2.459 1.00 . A A . 8 CYS HA 1 1
5 2345 1 1 8 CYS HB2 H -1.681 1.096 2.881 1.00 . A A . 8 CYS HB2 1 1
5 2346 1 1 8 CYS HB3 H -0.626 -0.327 2.612 1.00 . A A . 8 CYS HB3 1 1
5 2347 1 1 8 CYS N N 0.707 1.143 1.153 1.00 . A A . 8 CYS N 1 1
5 2348 1 1 8 CYS O O 1.598 2.442 4.355 1.00 . A A . 8 CYS O 1 1
5 2349 1 1 8 CYS SG S -0.632 0.374 4.955 1.00 . A A . 8 CYS SG 1 1
5 2350 1 1 9 GLY C C 5.092 0.676 3.124 1.00 . A A . 9 GLY C 1 1
5 2351 1 1 9 GLY CA C 3.875 1.080 3.878 1.00 . A A . 9 GLY CA 1 1
5 2352 1 1 9 GLY H H 2.751 0.609 2.130 1.00 . A A . 9 GLY H 1 1
5 2353 1 1 9 GLY HA2 H 4.065 2.054 4.314 1.00 . A A . 9 GLY HA2 1 1
5 2354 1 1 9 GLY HA3 H 3.687 0.315 4.619 1.00 . A A . 9 GLY HA3 1 1
5 2355 1 1 9 GLY N N 2.733 1.141 2.968 1.00 . A A . 9 GLY N 1 1
5 2356 1 1 9 GLY O O 5.926 -0.098 3.576 1.00 . A A . 9 GLY O 1 1
5 2357 1 1 10 GLY C C 7.486 1.924 1.584 1.00 . A A . 10 GLY C 1 1
5 2358 1 1 10 GLY CA C 6.444 0.953 1.127 1.00 . A A . 10 GLY CA 1 1
5 2359 1 1 10 GLY H H 4.542 1.808 1.558 1.00 . A A . 10 GLY H 1 1
5 2360 1 1 10 GLY HA2 H 6.835 -0.040 1.297 1.00 . A A . 10 GLY HA2 1 1
5 2361 1 1 10 GLY HA3 H 6.249 1.171 0.093 1.00 . A A . 10 GLY HA3 1 1
5 2362 1 1 10 GLY N N 5.200 1.125 1.864 1.00 . A A . 10 GLY N 1 1
5 2363 1 1 10 GLY O O 7.166 3.070 1.862 1.00 . A A . 10 GLY O 1 1
5 2364 1 1 11 ILE C C 10.003 3.576 1.075 1.00 . A A . 11 ILE C 1 1
5 2365 1 1 11 ILE CA C 9.903 2.339 1.957 1.00 . A A . 11 ILE CA 1 1
5 2366 1 1 11 ILE CB C 11.197 1.513 1.900 1.00 . A A . 11 ILE CB 1 1
5 2367 1 1 11 ILE CD1 C 12.248 1.488 4.255 1.00 . A A . 11 ILE CD1 1 1
5 2368 1 1 11 ILE CG1 C 11.407 0.727 3.220 1.00 . A A . 11 ILE CG1 1 1
5 2369 1 1 11 ILE CG2 C 12.437 2.370 1.531 1.00 . A A . 11 ILE CG2 1 1
5 2370 1 1 11 ILE H H 8.979 0.560 1.359 1.00 . A A . 11 ILE H 1 1
5 2371 1 1 11 ILE HA H 9.757 2.701 2.966 1.00 . A A . 11 ILE HA 1 1
5 2372 1 1 11 ILE HB H 11.070 0.757 1.088 1.00 . A A . 11 ILE HB 1 1
5 2373 1 1 11 ILE HD11 H 12.201 0.990 5.247 1.00 . A A . 11 ILE HD11 1 1
5 2374 1 1 11 ILE HD12 H 11.888 2.533 4.367 1.00 . A A . 11 ILE HD12 1 1
5 2375 1 1 11 ILE HD13 H 13.317 1.515 3.948 1.00 . A A . 11 ILE HD13 1 1
5 2376 1 1 11 ILE HG12 H 10.421 0.465 3.664 1.00 . A A . 11 ILE HG12 1 1
5 2377 1 1 11 ILE HG13 H 11.927 -0.235 2.996 1.00 . A A . 11 ILE HG13 1 1
5 2378 1 1 11 ILE HG21 H 12.485 3.290 2.153 1.00 . A A . 11 ILE HG21 1 1
5 2379 1 1 11 ILE HG22 H 12.420 2.664 0.461 1.00 . A A . 11 ILE HG22 1 1
5 2380 1 1 11 ILE HG23 H 13.370 1.801 1.704 1.00 . A A . 11 ILE HG23 1 1
5 2381 1 1 11 ILE N N 8.763 1.501 1.597 1.00 . A A . 11 ILE N 1 1
5 2382 1 1 11 ILE O O 10.226 4.693 1.532 1.00 . A A . 11 ILE O 1 1
5 2383 1 1 12 GLY C C 8.353 4.865 -1.521 1.00 . A A . 12 GLY C 1 1
5 2384 1 1 12 GLY CA C 9.762 4.490 -1.197 1.00 . A A . 12 GLY CA 1 1
5 2385 1 1 12 GLY H H 9.572 2.480 -0.566 1.00 . A A . 12 GLY H 1 1
5 2386 1 1 12 GLY HA2 H 10.249 5.368 -0.791 1.00 . A A . 12 GLY HA2 1 1
5 2387 1 1 12 GLY HA3 H 10.219 4.141 -2.110 1.00 . A A . 12 GLY HA3 1 1
5 2388 1 1 12 GLY N N 9.790 3.395 -0.242 1.00 . A A . 12 GLY N 1 1
5 2389 1 1 12 GLY O O 7.856 4.563 -2.602 1.00 . A A . 12 GLY O 1 1
5 2390 1 1 13 TYR C C 5.954 7.194 -0.079 1.00 . A A . 13 TYR C 1 1
5 2391 1 1 13 TYR CA C 6.289 5.927 -0.845 1.00 . A A . 13 TYR CA 1 1
5 2392 1 1 13 TYR CB C 5.322 4.789 -0.446 1.00 . A A . 13 TYR CB 1 1
5 2393 1 1 13 TYR CD1 C 3.665 5.147 -2.286 1.00 . A A . 13 TYR CD1 1 1
5 2394 1 1 13 TYR CD2 C 2.930 5.433 0.010 1.00 . A A . 13 TYR CD2 1 1
5 2395 1 1 13 TYR CE1 C 2.397 5.514 -2.744 1.00 . A A . 13 TYR CE1 1 1
5 2396 1 1 13 TYR CE2 C 1.656 5.785 -0.452 1.00 . A A . 13 TYR CE2 1 1
5 2397 1 1 13 TYR CG C 3.940 5.119 -0.909 1.00 . A A . 13 TYR CG 1 1
5 2398 1 1 13 TYR CZ C 1.401 5.841 -1.832 1.00 . A A . 13 TYR CZ 1 1
5 2399 1 1 13 TYR H H 8.016 5.704 0.323 1.00 . A A . 13 TYR H 1 1
5 2400 1 1 13 TYR HA H 6.184 6.163 -1.897 1.00 . A A . 13 TYR HA 1 1
5 2401 1 1 13 TYR HB2 H 5.643 3.857 -0.947 1.00 . A A . 13 TYR HB2 1 1
5 2402 1 1 13 TYR HB3 H 5.335 4.619 0.654 1.00 . A A . 13 TYR HB3 1 1
5 2403 1 1 13 TYR HD1 H 4.429 4.879 -3.001 1.00 . A A . 13 TYR HD1 1 1
5 2404 1 1 13 TYR HD2 H 3.136 5.421 1.072 1.00 . A A . 13 TYR HD2 1 1
5 2405 1 1 13 TYR HE1 H 2.172 5.522 -3.802 1.00 . A A . 13 TYR HE1 1 1
5 2406 1 1 13 TYR HE2 H 0.900 6.020 0.274 1.00 . A A . 13 TYR HE2 1 1
5 2407 1 1 13 TYR HH H -0.521 5.968 -1.715 1.00 . A A . 13 TYR HH 1 1
5 2408 1 1 13 TYR N N 7.648 5.522 -0.591 1.00 . A A . 13 TYR N 1 1
5 2409 1 1 13 TYR O O 6.432 7.413 1.026 1.00 . A A . 13 TYR O 1 1
5 2410 1 1 13 TYR OH O 0.154 6.185 -2.365 1.00 . A A . 13 TYR OH 1 1
5 2411 1 1 14 SER C C 3.263 9.601 -0.214 1.00 . A A . 14 SER C 1 1
5 2412 1 1 14 SER CA C 4.735 9.323 -0.055 1.00 . A A . 14 SER CA 1 1
5 2413 1 1 14 SER CB C 5.463 10.518 -0.692 1.00 . A A . 14 SER CB 1 1
5 2414 1 1 14 SER H H 4.701 7.842 -1.552 1.00 . A A . 14 SER H 1 1
5 2415 1 1 14 SER HA H 4.947 9.302 1.006 1.00 . A A . 14 SER HA 1 1
5 2416 1 1 14 SER HB2 H 5.188 10.619 -1.766 1.00 . A A . 14 SER HB2 1 1
5 2417 1 1 14 SER HB3 H 5.241 11.459 -0.141 1.00 . A A . 14 SER HB3 1 1
5 2418 1 1 14 SER N N 5.095 8.051 -0.662 1.00 . A A . 14 SER N 1 1
5 2419 1 1 14 SER O O 2.858 10.528 -0.908 1.00 . A A . 14 SER O 1 1
5 2420 1 1 15 GLY C C 0.307 8.355 1.514 1.00 . A A . 15 GLY C 1 1
5 2421 1 1 15 GLY CA C 0.963 8.974 0.312 1.00 . A A . 15 GLY CA 1 1
5 2422 1 1 15 GLY H H 2.727 8.059 1.007 1.00 . A A . 15 GLY H 1 1
5 2423 1 1 15 GLY HA2 H 0.733 10.031 0.328 1.00 . A A . 15 GLY HA2 1 1
5 2424 1 1 15 GLY HA3 H 0.633 8.463 -0.581 1.00 . A A . 15 GLY HA3 1 1
5 2425 1 1 15 GLY N N 2.401 8.787 0.404 1.00 . A A . 15 GLY N 1 1
5 2426 1 1 15 GLY O O 0.998 8.034 2.477 1.00 . A A . 15 GLY O 1 1
5 2427 1 1 16 PRO C C -1.128 6.131 3.087 1.00 . A A . 16 PRO C 1 1
5 2428 1 1 16 PRO CA C -1.744 7.429 2.549 1.00 . A A . 16 PRO CA 1 1
5 2429 1 1 16 PRO CB C -3.148 7.230 1.951 1.00 . A A . 16 PRO CB 1 1
5 2430 1 1 16 PRO CD C -1.885 8.682 0.462 1.00 . A A . 16 PRO CD 1 1
5 2431 1 1 16 PRO CG C -3.312 8.358 0.918 1.00 . A A . 16 PRO CG 1 1
5 2432 1 1 16 PRO HA H -1.756 8.101 3.394 1.00 . A A . 16 PRO HA 1 1
5 2433 1 1 16 PRO HB2 H -3.215 6.256 1.419 1.00 . A A . 16 PRO HB2 1 1
5 2434 1 1 16 PRO HB3 H -3.937 7.266 2.725 1.00 . A A . 16 PRO HB3 1 1
5 2435 1 1 16 PRO HD2 H -1.662 8.178 -0.506 1.00 . A A . 16 PRO HD2 1 1
5 2436 1 1 16 PRO HD3 H -1.750 9.782 0.342 1.00 . A A . 16 PRO HD3 1 1
5 2437 1 1 16 PRO HG2 H -3.937 8.041 0.054 1.00 . A A . 16 PRO HG2 1 1
5 2438 1 1 16 PRO HG3 H -3.767 9.258 1.382 1.00 . A A . 16 PRO HG3 1 1
5 2439 1 1 16 PRO N N -1.007 8.155 1.512 1.00 . A A . 16 PRO N 1 1
5 2440 1 1 16 PRO O O -0.507 5.375 2.352 1.00 . A A . 16 PRO O 1 1
5 2441 1 1 17 THR C C -1.755 3.745 5.565 1.00 . A A . 17 THR C 1 1
5 2442 1 1 17 THR CA C -0.690 4.689 5.048 1.00 . A A . 17 THR CA 1 1
5 2443 1 1 17 THR CB C 0.232 5.176 6.164 1.00 . A A . 17 THR CB 1 1
5 2444 1 1 17 THR CG2 C -0.539 5.968 7.228 1.00 . A A . 17 THR CG2 1 1
5 2445 1 1 17 THR H H -1.780 6.474 4.974 1.00 . A A . 17 THR H 1 1
5 2446 1 1 17 THR HA H -0.096 4.123 4.346 1.00 . A A . 17 THR HA 1 1
5 2447 1 1 17 THR HB H 0.993 5.838 5.682 1.00 . A A . 17 THR HB 1 1
5 2448 1 1 17 THR HG1 H 0.268 3.551 7.205 1.00 . A A . 17 THR HG1 1 1
5 2449 1 1 17 THR HG21 H 0.181 6.607 7.781 1.00 . A A . 17 THR HG21 1 1
5 2450 1 1 17 THR HG22 H -1.019 5.279 7.956 1.00 . A A . 17 THR HG22 1 1
5 2451 1 1 17 THR HG23 H -1.317 6.622 6.795 1.00 . A A . 17 THR HG23 1 1
5 2452 1 1 17 THR N N -1.316 5.833 4.377 1.00 . A A . 17 THR N 1 1
5 2453 1 1 17 THR O O -1.572 2.975 6.500 1.00 . A A . 17 THR O 1 1
5 2454 1 1 17 THR OG1 O 0.936 4.152 6.847 1.00 . A A . 17 THR OG1 1 1
5 2455 1 1 18 VAL C C -4.612 2.343 4.144 1.00 . A A . 18 VAL C 1 1
5 2456 1 1 18 VAL CA C -4.087 3.000 5.389 1.00 . A A . 18 VAL CA 1 1
5 2457 1 1 18 VAL CB C -5.211 3.821 6.031 1.00 . A A . 18 VAL CB 1 1
5 2458 1 1 18 VAL CG1 C -6.322 2.908 6.595 1.00 . A A . 18 VAL CG1 1 1
5 2459 1 1 18 VAL CG2 C -4.626 4.683 7.166 1.00 . A A . 18 VAL CG2 1 1
5 2460 1 1 18 VAL H H -3.062 4.395 4.176 1.00 . A A . 18 VAL H 1 1
5 2461 1 1 18 VAL HA H -3.770 2.217 6.066 1.00 . A A . 18 VAL HA 1 1
5 2462 1 1 18 VAL HB H -5.660 4.508 5.279 1.00 . A A . 18 VAL HB 1 1
5 2463 1 1 18 VAL HG11 H -7.286 3.458 6.644 1.00 . A A . 18 VAL HG11 1 1
5 2464 1 1 18 VAL HG12 H -6.068 2.577 7.624 1.00 . A A . 18 VAL HG12 1 1
5 2465 1 1 18 VAL HG13 H -6.494 1.997 5.989 1.00 . A A . 18 VAL HG13 1 1
5 2466 1 1 18 VAL HG21 H -3.682 4.238 7.551 1.00 . A A . 18 VAL HG21 1 1
5 2467 1 1 18 VAL HG22 H -5.333 4.730 8.022 1.00 . A A . 18 VAL HG22 1 1
5 2468 1 1 18 VAL HG23 H -4.416 5.717 6.825 1.00 . A A . 18 VAL HG23 1 1
5 2469 1 1 18 VAL N N -2.958 3.813 4.972 1.00 . A A . 18 VAL N 1 1
5 2470 1 1 18 VAL O O -4.835 3.008 3.138 1.00 . A A . 18 VAL O 1 1
5 2471 1 1 19 CYS C C -6.988 0.506 3.088 1.00 . A A . 19 CYS C 1 1
5 2472 1 1 19 CYS CA C -5.489 0.365 3.033 1.00 . A A . 19 CYS CA 1 1
5 2473 1 1 19 CYS CB C -5.045 -1.094 3.023 1.00 . A A . 19 CYS CB 1 1
5 2474 1 1 19 CYS H H -4.669 0.477 4.951 1.00 . A A . 19 CYS H 1 1
5 2475 1 1 19 CYS HA H -5.198 0.834 2.105 1.00 . A A . 19 CYS HA 1 1
5 2476 1 1 19 CYS HB2 H -5.143 -1.505 4.053 1.00 . A A . 19 CYS HB2 1 1
5 2477 1 1 19 CYS HB3 H -5.652 -1.748 2.387 1.00 . A A . 19 CYS HB3 1 1
5 2478 1 1 19 CYS N N -4.848 1.034 4.144 1.00 . A A . 19 CYS N 1 1
5 2479 1 1 19 CYS O O -7.559 0.636 4.163 1.00 . A A . 19 CYS O 1 1
5 2480 1 1 19 CYS SG S -3.327 -1.169 2.478 1.00 . A A . 19 CYS SG 1 1
5 2481 1 1 20 ALA C C -9.901 -0.211 2.597 1.00 . A A . 20 ALA C 1 1
5 2482 1 1 20 ALA CA C -9.073 0.648 1.689 1.00 . A A . 20 ALA CA 1 1
5 2483 1 1 20 ALA CB C -9.415 0.314 0.210 1.00 . A A . 20 ALA CB 1 1
5 2484 1 1 20 ALA H H -7.132 0.464 1.050 1.00 . A A . 20 ALA H 1 1
5 2485 1 1 20 ALA HA H -9.384 1.639 1.940 1.00 . A A . 20 ALA HA 1 1
5 2486 1 1 20 ALA HB1 H -9.356 -0.779 0.027 1.00 . A A . 20 ALA HB1 1 1
5 2487 1 1 20 ALA HB2 H -8.686 0.795 -0.475 1.00 . A A . 20 ALA HB2 1 1
5 2488 1 1 20 ALA HB3 H -10.430 0.662 -0.068 1.00 . A A . 20 ALA HB3 1 1
5 2489 1 1 20 ALA N N -7.638 0.597 1.903 1.00 . A A . 20 ALA N 1 1
5 2490 1 1 20 ALA O O -9.460 -1.238 3.058 1.00 . A A . 20 ALA O 1 1
5 2491 1 1 21 SER C C -12.279 -2.118 3.060 1.00 . A A . 21 SER C 1 1
5 2492 1 1 21 SER CA C -11.971 -0.760 3.703 1.00 . A A . 21 SER CA 1 1
5 2493 1 1 21 SER CB C -13.293 -0.073 4.107 1.00 . A A . 21 SER CB 1 1
5 2494 1 1 21 SER H H -11.571 0.976 2.555 1.00 . A A . 21 SER H 1 1
5 2495 1 1 21 SER HA H -11.409 -0.970 4.607 1.00 . A A . 21 SER HA 1 1
5 2496 1 1 21 SER HB2 H -13.046 0.883 4.623 1.00 . A A . 21 SER HB2 1 1
5 2497 1 1 21 SER HB3 H -13.889 0.169 3.199 1.00 . A A . 21 SER HB3 1 1
5 2498 1 1 21 SER HG H -13.882 -1.804 4.784 1.00 . A A . 21 SER HG 1 1
5 2499 1 1 21 SER N N -11.169 0.120 2.853 1.00 . A A . 21 SER N 1 1
5 2500 1 1 21 SER O O -12.777 -3.027 3.712 1.00 . A A . 21 SER O 1 1
5 2501 1 1 21 SER OG O -14.058 -0.871 5.008 1.00 . A A . 21 SER OG 1 1
5 2502 1 1 22 GLY C C -10.596 -4.095 0.828 1.00 . A A . 22 GLY C 1 1
5 2503 1 1 22 GLY CA C -11.973 -3.522 1.026 1.00 . A A . 22 GLY CA 1 1
5 2504 1 1 22 GLY H H -11.580 -1.479 1.288 1.00 . A A . 22 GLY H 1 1
5 2505 1 1 22 GLY HA2 H -12.554 -4.265 1.556 1.00 . A A . 22 GLY HA2 1 1
5 2506 1 1 22 GLY HA3 H -12.352 -3.324 0.037 1.00 . A A . 22 GLY HA3 1 1
5 2507 1 1 22 GLY N N -11.971 -2.261 1.754 1.00 . A A . 22 GLY N 1 1
5 2508 1 1 22 GLY O O -10.470 -5.155 0.232 1.00 . A A . 22 GLY O 1 1
5 2509 1 1 23 THR C C -7.448 -3.823 2.450 1.00 . A A . 23 THR C 1 1
5 2510 1 1 23 THR CA C -8.151 -3.814 1.094 1.00 . A A . 23 THR CA 1 1
5 2511 1 1 23 THR CB C -7.311 -3.001 0.077 1.00 . A A . 23 THR CB 1 1
5 2512 1 1 23 THR CG2 C -7.967 -2.891 -1.299 1.00 . A A . 23 THR CG2 1 1
5 2513 1 1 23 THR H H -9.645 -2.590 1.864 1.00 . A A . 23 THR H 1 1
5 2514 1 1 23 THR HA H -8.162 -4.835 0.755 1.00 . A A . 23 THR HA 1 1
5 2515 1 1 23 THR HB H -6.335 -3.505 -0.052 1.00 . A A . 23 THR HB 1 1
5 2516 1 1 23 THR HG1 H -6.335 -1.749 1.111 1.00 . A A . 23 THR HG1 1 1
5 2517 1 1 23 THR HG21 H -9.059 -2.748 -1.218 1.00 . A A . 23 THR HG21 1 1
5 2518 1 1 23 THR HG22 H -7.760 -3.816 -1.874 1.00 . A A . 23 THR HG22 1 1
5 2519 1 1 23 THR HG23 H -7.550 -2.021 -1.844 1.00 . A A . 23 THR HG23 1 1
5 2520 1 1 23 THR N N -9.535 -3.389 1.270 1.00 . A A . 23 THR N 1 1
5 2521 1 1 23 THR O O -7.887 -3.261 3.440 1.00 . A A . 23 THR O 1 1
5 2522 1 1 23 THR OG1 O -7.017 -1.667 0.440 1.00 . A A . 23 THR OG1 1 1
5 2523 1 1 24 THR C C -4.118 -4.370 3.624 1.00 . A A . 24 THR C 1 1
5 2524 1 1 24 THR CA C -5.592 -4.601 3.847 1.00 . A A . 24 THR CA 1 1
5 2525 1 1 24 THR CB C -5.852 -5.951 4.510 1.00 . A A . 24 THR CB 1 1
5 2526 1 1 24 THR CG2 C -4.860 -6.293 5.633 1.00 . A A . 24 THR CG2 1 1
5 2527 1 1 24 THR H H -6.073 -5.146 1.844 1.00 . A A . 24 THR H 1 1
5 2528 1 1 24 THR HA H -5.909 -3.827 4.533 1.00 . A A . 24 THR HA 1 1
5 2529 1 1 24 THR HB H -5.844 -6.747 3.730 1.00 . A A . 24 THR HB 1 1
5 2530 1 1 24 THR HG1 H -7.767 -5.773 4.419 1.00 . A A . 24 THR HG1 1 1
5 2531 1 1 24 THR HG21 H -5.285 -7.074 6.300 1.00 . A A . 24 THR HG21 1 1
5 2532 1 1 24 THR HG22 H -4.649 -5.403 6.260 1.00 . A A . 24 THR HG22 1 1
5 2533 1 1 24 THR HG23 H -3.906 -6.675 5.224 1.00 . A A . 24 THR HG23 1 1
5 2534 1 1 24 THR N N -6.298 -4.482 2.575 1.00 . A A . 24 THR N 1 1
5 2535 1 1 24 THR O O -3.573 -4.724 2.584 1.00 . A A . 24 THR O 1 1
5 2536 1 1 24 THR OG1 O -7.129 -5.944 5.124 1.00 . A A . 24 THR OG1 1 1
5 2537 1 1 25 CYS C C -1.212 -4.780 4.637 1.00 . A A . 25 CYS C 1 1
5 2538 1 1 25 CYS CA C -1.976 -3.482 4.474 1.00 . A A . 25 CYS CA 1 1
5 2539 1 1 25 CYS CB C -1.455 -2.498 5.561 1.00 . A A . 25 CYS CB 1 1
5 2540 1 1 25 CYS H H -3.856 -3.389 5.400 1.00 . A A . 25 CYS H 1 1
5 2541 1 1 25 CYS HA H -1.734 -3.101 3.492 1.00 . A A . 25 CYS HA 1 1
5 2542 1 1 25 CYS HB2 H -1.687 -2.929 6.561 1.00 . A A . 25 CYS HB2 1 1
5 2543 1 1 25 CYS HB3 H -0.348 -2.418 5.490 1.00 . A A . 25 CYS HB3 1 1
5 2544 1 1 25 CYS N N -3.416 -3.696 4.563 1.00 . A A . 25 CYS N 1 1
5 2545 1 1 25 CYS O O -1.227 -5.385 5.706 1.00 . A A . 25 CYS O 1 1
5 2546 1 1 25 CYS SG S -2.178 -0.828 5.494 1.00 . A A . 25 CYS SG 1 1
5 2547 1 1 26 GLN C C 1.505 -6.323 2.927 1.00 . A A . 26 GLN C 1 1
5 2548 1 1 26 GLN CA C 0.202 -6.495 3.671 1.00 . A A . 26 GLN CA 1 1
5 2549 1 1 26 GLN CB C -0.585 -7.711 3.100 1.00 . A A . 26 GLN CB 1 1
5 2550 1 1 26 GLN CD C -2.878 -8.863 2.881 1.00 . A A . 26 GLN CD 1 1
5 2551 1 1 26 GLN CG C -2.056 -7.782 3.584 1.00 . A A . 26 GLN CG 1 1
5 2552 1 1 26 GLN H H -0.535 -4.783 2.693 1.00 . A A . 26 GLN H 1 1
5 2553 1 1 26 GLN HA H 0.460 -6.697 4.702 1.00 . A A . 26 GLN HA 1 1
5 2554 1 1 26 GLN HB2 H -0.580 -7.667 1.992 1.00 . A A . 26 GLN HB2 1 1
5 2555 1 1 26 GLN HB3 H -0.068 -8.656 3.378 1.00 . A A . 26 GLN HB3 1 1
5 2556 1 1 26 GLN HE21 H -4.588 -8.154 3.737 1.00 . A A . 26 GLN HE21 1 1
5 2557 1 1 26 GLN HE22 H -4.785 -9.446 2.595 1.00 . A A . 26 GLN HE22 1 1
5 2558 1 1 26 GLN HG2 H -2.083 -7.955 4.678 1.00 . A A . 26 GLN HG2 1 1
5 2559 1 1 26 GLN HG3 H -2.558 -6.820 3.361 1.00 . A A . 26 GLN HG3 1 1
5 2560 1 1 26 GLN N N -0.523 -5.246 3.585 1.00 . A A . 26 GLN N 1 1
5 2561 1 1 26 GLN NE2 N -4.205 -8.855 3.147 1.00 . A A . 26 GLN NE2 1 1
5 2562 1 1 26 GLN O O 1.674 -5.480 2.043 1.00 . A A . 26 GLN O 1 1
5 2563 1 1 26 GLN OE1 O -2.386 -9.673 2.100 1.00 . A A . 26 GLN OE1 1 1
5 2564 1 1 27 VAL C C 3.860 -7.863 1.429 1.00 . A A . 27 VAL C 1 1
5 2565 1 1 27 VAL CA C 3.814 -7.062 2.714 1.00 . A A . 27 VAL CA 1 1
5 2566 1 1 27 VAL CB C 4.882 -7.515 3.700 1.00 . A A . 27 VAL CB 1 1
5 2567 1 1 27 VAL CG1 C 6.236 -7.737 3.001 1.00 . A A . 27 VAL CG1 1 1
5 2568 1 1 27 VAL CG2 C 5.013 -6.428 4.784 1.00 . A A . 27 VAL CG2 1 1
5 2569 1 1 27 VAL H H 2.366 -7.817 4.005 1.00 . A A . 27 VAL H 1 1
5 2570 1 1 27 VAL HA H 4.040 -6.036 2.456 1.00 . A A . 27 VAL HA 1 1
5 2571 1 1 27 VAL HB H 4.566 -8.473 4.176 1.00 . A A . 27 VAL HB 1 1
5 2572 1 1 27 VAL HG11 H 6.251 -8.714 2.469 1.00 . A A . 27 VAL HG11 1 1
5 2573 1 1 27 VAL HG12 H 7.062 -7.729 3.741 1.00 . A A . 27 VAL HG12 1 1
5 2574 1 1 27 VAL HG13 H 6.420 -6.923 2.274 1.00 . A A . 27 VAL HG13 1 1
5 2575 1 1 27 VAL HG21 H 4.041 -6.226 5.279 1.00 . A A . 27 VAL HG21 1 1
5 2576 1 1 27 VAL HG22 H 5.380 -5.477 4.338 1.00 . A A . 27 VAL HG22 1 1
5 2577 1 1 27 VAL HG23 H 5.738 -6.750 5.561 1.00 . A A . 27 VAL HG23 1 1
5 2578 1 1 27 VAL N N 2.503 -7.120 3.310 1.00 . A A . 27 VAL N 1 1
5 2579 1 1 27 VAL O O 3.596 -9.059 1.406 1.00 . A A . 27 VAL O 1 1
5 2580 1 1 28 LEU C C 6.014 -8.063 -1.063 1.00 . A A . 28 LEU C 1 1
5 2581 1 1 28 LEU CA C 4.498 -7.880 -0.938 1.00 . A A . 28 LEU CA 1 1
5 2582 1 1 28 LEU CB C 3.808 -7.048 -2.072 1.00 . A A . 28 LEU CB 1 1
5 2583 1 1 28 LEU CD1 C 4.698 -8.562 -4.001 1.00 . A A . 28 LEU CD1 1 1
5 2584 1 1 28 LEU CD2 C 3.228 -6.580 -4.501 1.00 . A A . 28 LEU CD2 1 1
5 2585 1 1 28 LEU CG C 4.279 -7.161 -3.546 1.00 . A A . 28 LEU CG 1 1
5 2586 1 1 28 LEU H H 4.332 -6.213 0.332 1.00 . A A . 28 LEU H 1 1
5 2587 1 1 28 LEU HA H 4.072 -8.876 -0.945 1.00 . A A . 28 LEU HA 1 1
5 2588 1 1 28 LEU HB2 H 2.730 -7.332 -2.045 1.00 . A A . 28 LEU HB2 1 1
5 2589 1 1 28 LEU HB3 H 3.849 -5.970 -1.798 1.00 . A A . 28 LEU HB3 1 1
5 2590 1 1 28 LEU HD11 H 4.375 -9.331 -3.269 1.00 . A A . 28 LEU HD11 1 1
5 2591 1 1 28 LEU HD12 H 5.807 -8.607 -4.085 1.00 . A A . 28 LEU HD12 1 1
5 2592 1 1 28 LEU HD13 H 4.271 -8.807 -4.994 1.00 . A A . 28 LEU HD13 1 1
5 2593 1 1 28 LEU HD21 H 2.648 -5.783 -3.995 1.00 . A A . 28 LEU HD21 1 1
5 2594 1 1 28 LEU HD22 H 2.518 -7.367 -4.831 1.00 . A A . 28 LEU HD22 1 1
5 2595 1 1 28 LEU HD23 H 3.718 -6.146 -5.399 1.00 . A A . 28 LEU HD23 1 1
5 2596 1 1 28 LEU HG H 5.170 -6.516 -3.685 1.00 . A A . 28 LEU HG 1 1
5 2597 1 1 28 LEU N N 4.215 -7.201 0.314 1.00 . A A . 28 LEU N 1 1
5 2598 1 1 28 LEU O O 6.547 -8.967 -1.695 1.00 . A A . 28 LEU O 1 1
5 2599 1 1 29 ASN C C 8.751 -6.252 0.542 1.00 . A A . 29 ASN C 1 1
5 2600 1 1 29 ASN CA C 8.207 -7.075 -0.605 1.00 . A A . 29 ASN CA 1 1
5 2601 1 1 29 ASN CB C 8.670 -6.426 -1.968 1.00 . A A . 29 ASN CB 1 1
5 2602 1 1 29 ASN CG C 7.614 -5.752 -2.851 1.00 . A A . 29 ASN CG 1 1
5 2603 1 1 29 ASN H H 6.372 -6.555 0.255 1.00 . A A . 29 ASN H 1 1
5 2604 1 1 29 ASN HA H 8.620 -8.072 -0.517 1.00 . A A . 29 ASN HA 1 1
5 2605 1 1 29 ASN HB2 H 9.466 -5.666 -1.837 1.00 . A A . 29 ASN HB2 1 1
5 2606 1 1 29 ASN HB3 H 9.093 -7.239 -2.597 1.00 . A A . 29 ASN HB3 1 1
5 2607 1 1 29 ASN HD21 H 6.499 -5.139 -1.244 1.00 . A A . 29 ASN HD21 1 1
5 2608 1 1 29 ASN HD22 H 5.843 -4.815 -2.819 1.00 . A A . 29 ASN HD22 1 1
5 2609 1 1 29 ASN N N 6.784 -7.196 -0.389 1.00 . A A . 29 ASN N 1 1
5 2610 1 1 29 ASN ND2 N 6.592 -5.151 -2.246 1.00 . A A . 29 ASN ND2 1 1
5 2611 1 1 29 ASN O O 7.998 -5.467 1.118 1.00 . A A . 29 ASN O 1 1
5 2612 1 1 29 ASN OD1 O 7.721 -5.754 -4.061 1.00 . A A . 29 ASN OD1 1 1
5 2613 1 1 30 PRO C C 10.675 -4.123 1.853 1.00 . A A . 30 PRO C 1 1
5 2614 1 1 30 PRO CA C 10.568 -5.630 2.056 1.00 . A A . 30 PRO CA 1 1
5 2615 1 1 30 PRO CB C 11.947 -6.301 2.254 1.00 . A A . 30 PRO CB 1 1
5 2616 1 1 30 PRO CD C 11.020 -7.135 0.175 1.00 . A A . 30 PRO CD 1 1
5 2617 1 1 30 PRO CG C 12.342 -6.919 0.903 1.00 . A A . 30 PRO CG 1 1
5 2618 1 1 30 PRO HA H 9.907 -5.780 2.899 1.00 . A A . 30 PRO HA 1 1
5 2619 1 1 30 PRO HB2 H 12.723 -5.601 2.630 1.00 . A A . 30 PRO HB2 1 1
5 2620 1 1 30 PRO HB3 H 11.832 -7.120 2.999 1.00 . A A . 30 PRO HB3 1 1
5 2621 1 1 30 PRO HD2 H 11.121 -6.808 -0.885 1.00 . A A . 30 PRO HD2 1 1
5 2622 1 1 30 PRO HD3 H 10.719 -8.206 0.209 1.00 . A A . 30 PRO HD3 1 1
5 2623 1 1 30 PRO HG2 H 12.983 -6.223 0.321 1.00 . A A . 30 PRO HG2 1 1
5 2624 1 1 30 PRO HG3 H 12.891 -7.876 1.032 1.00 . A A . 30 PRO HG3 1 1
5 2625 1 1 30 PRO N N 10.031 -6.313 0.879 1.00 . A A . 30 PRO N 1 1
5 2626 1 1 30 PRO O O 11.050 -3.413 2.776 1.00 . A A . 30 PRO O 1 1
5 2627 1 1 31 TYR C C 9.134 -1.686 -0.247 1.00 . A A . 31 TYR C 1 1
5 2628 1 1 31 TYR CA C 10.445 -2.205 0.315 1.00 . A A . 31 TYR CA 1 1
5 2629 1 1 31 TYR CB C 11.630 -1.956 -0.663 1.00 . A A . 31 TYR CB 1 1
5 2630 1 1 31 TYR CD1 C 13.501 -3.108 0.627 1.00 . A A . 31 TYR CD1 1 1
5 2631 1 1 31 TYR CD2 C 13.513 -0.704 0.450 1.00 . A A . 31 TYR CD2 1 1
5 2632 1 1 31 TYR CE1 C 14.590 -3.055 1.507 1.00 . A A . 31 TYR CE1 1 1
5 2633 1 1 31 TYR CE2 C 14.613 -0.643 1.317 1.00 . A A . 31 TYR CE2 1 1
5 2634 1 1 31 TYR CG C 12.912 -1.931 0.135 1.00 . A A . 31 TYR CG 1 1
5 2635 1 1 31 TYR CZ C 15.137 -1.819 1.858 1.00 . A A . 31 TYR CZ 1 1
5 2636 1 1 31 TYR H H 10.050 -4.239 -0.054 1.00 . A A . 31 TYR H 1 1
5 2637 1 1 31 TYR HA H 10.592 -1.623 1.217 1.00 . A A . 31 TYR HA 1 1
5 2638 1 1 31 TYR HB2 H 11.694 -2.763 -1.422 1.00 . A A . 31 TYR HB2 1 1
5 2639 1 1 31 TYR HB3 H 11.531 -0.982 -1.190 1.00 . A A . 31 TYR HB3 1 1
5 2640 1 1 31 TYR HD1 H 13.065 -4.059 0.381 1.00 . A A . 31 TYR HD1 1 1
5 2641 1 1 31 TYR HD2 H 13.093 0.205 0.051 1.00 . A A . 31 TYR HD2 1 1
5 2642 1 1 31 TYR HE1 H 14.992 -3.961 1.936 1.00 . A A . 31 TYR HE1 1 1
5 2643 1 1 31 TYR HE2 H 15.043 0.308 1.592 1.00 . A A . 31 TYR HE2 1 1
5 2644 1 1 31 TYR HH H 17.026 -1.851 2.219 1.00 . A A . 31 TYR HH 1 1
5 2645 1 1 31 TYR N N 10.353 -3.613 0.651 1.00 . A A . 31 TYR N 1 1
5 2646 1 1 31 TYR O O 9.005 -0.531 -0.647 1.00 . A A . 31 TYR O 1 1
5 2647 1 1 31 TYR OH O 16.228 -1.754 2.741 1.00 . A A . 31 TYR OH 1 1
5 2648 1 1 32 TYR C C 5.707 -2.883 0.062 1.00 . A A . 32 TYR C 1 1
5 2649 1 1 32 TYR CA C 6.791 -2.149 -0.736 1.00 . A A . 32 TYR CA 1 1
5 2650 1 1 32 TYR CB C 6.725 -2.147 -2.311 1.00 . A A . 32 TYR CB 1 1
5 2651 1 1 32 TYR CD1 C 4.414 -1.314 -2.426 1.00 . A A . 32 TYR CD1 1 1
5 2652 1 1 32 TYR CD2 C 4.928 -3.163 -3.884 1.00 . A A . 32 TYR CD2 1 1
5 2653 1 1 32 TYR CE1 C 3.125 -1.242 -2.952 1.00 . A A . 32 TYR CE1 1 1
5 2654 1 1 32 TYR CE2 C 3.616 -3.125 -4.380 1.00 . A A . 32 TYR CE2 1 1
5 2655 1 1 32 TYR CG C 5.335 -2.250 -2.887 1.00 . A A . 32 TYR CG 1 1
5 2656 1 1 32 TYR CZ C 2.735 -2.149 -3.925 1.00 . A A . 32 TYR CZ 1 1
5 2657 1 1 32 TYR H H 8.153 -3.412 0.222 1.00 . A A . 32 TYR H 1 1
5 2658 1 1 32 TYR HA H 6.631 -1.115 -0.488 1.00 . A A . 32 TYR HA 1 1
5 2659 1 1 32 TYR HB2 H 7.163 -1.197 -2.685 1.00 . A A . 32 TYR HB2 1 1
5 2660 1 1 32 TYR HB3 H 7.367 -2.933 -2.747 1.00 . A A . 32 TYR HB3 1 1
5 2661 1 1 32 TYR HD1 H 4.734 -0.619 -1.674 1.00 . A A . 32 TYR HD1 1 1
5 2662 1 1 32 TYR HD2 H 5.611 -3.892 -4.295 1.00 . A A . 32 TYR HD2 1 1
5 2663 1 1 32 TYR HE1 H 2.446 -0.469 -2.641 1.00 . A A . 32 TYR HE1 1 1
5 2664 1 1 32 TYR HE2 H 3.283 -3.825 -5.131 1.00 . A A . 32 TYR HE2 1 1
5 2665 1 1 32 TYR HH H 0.944 -1.429 -3.930 1.00 . A A . 32 TYR HH 1 1
5 2666 1 1 32 TYR N N 8.088 -2.525 -0.237 1.00 . A A . 32 TYR N 1 1
5 2667 1 1 32 TYR O O 5.602 -4.108 0.061 1.00 . A A . 32 TYR O 1 1
5 2668 1 1 32 TYR OH O 1.445 -2.079 -4.441 1.00 . A A . 32 TYR OH 1 1
5 2669 1 1 33 SER C C 2.511 -2.336 0.665 1.00 . A A . 33 SER C 1 1
5 2670 1 1 33 SER CA C 3.707 -2.758 1.441 1.00 . A A . 33 SER CA 1 1
5 2671 1 1 33 SER CB C 3.479 -2.406 2.917 1.00 . A A . 33 SER CB 1 1
5 2672 1 1 33 SER H H 4.945 -1.155 0.876 1.00 . A A . 33 SER H 1 1
5 2673 1 1 33 SER HA H 3.764 -3.837 1.402 1.00 . A A . 33 SER HA 1 1
5 2674 1 1 33 SER HB2 H 3.188 -1.351 3.049 1.00 . A A . 33 SER HB2 1 1
5 2675 1 1 33 SER HB3 H 2.651 -3.027 3.332 1.00 . A A . 33 SER HB3 1 1
5 2676 1 1 33 SER HG H 5.337 -2.018 3.414 1.00 . A A . 33 SER HG 1 1
5 2677 1 1 33 SER N N 4.855 -2.143 0.793 1.00 . A A . 33 SER N 1 1
5 2678 1 1 33 SER O O 2.231 -1.144 0.513 1.00 . A A . 33 SER O 1 1
5 2679 1 1 33 SER OG O 4.667 -2.681 3.650 1.00 . A A . 33 SER OG 1 1
5 2680 1 1 34 GLN C C -0.574 -3.177 -0.056 1.00 . A A . 34 GLN C 1 1
5 2681 1 1 34 GLN CA C 0.746 -3.189 -0.805 1.00 . A A . 34 GLN CA 1 1
5 2682 1 1 34 GLN CB C 0.839 -4.312 -1.873 1.00 . A A . 34 GLN CB 1 1
5 2683 1 1 34 GLN CD C 0.028 -5.212 -4.132 1.00 . A A . 34 GLN CD 1 1
5 2684 1 1 34 GLN CG C -0.268 -4.285 -2.950 1.00 . A A . 34 GLN CG 1 1
5 2685 1 1 34 GLN H H 2.000 -4.280 0.405 1.00 . A A . 34 GLN H 1 1
5 2686 1 1 34 GLN HA H 0.851 -2.238 -1.298 1.00 . A A . 34 GLN HA 1 1
5 2687 1 1 34 GLN HB2 H 1.829 -4.198 -2.370 1.00 . A A . 34 GLN HB2 1 1
5 2688 1 1 34 GLN HB3 H 0.842 -5.307 -1.375 1.00 . A A . 34 GLN HB3 1 1
5 2689 1 1 34 GLN HE21 H 0.468 -3.652 -5.373 1.00 . A A . 34 GLN HE21 1 1
5 2690 1 1 34 GLN HE22 H 0.503 -5.257 -6.076 1.00 . A A . 34 GLN HE22 1 1
5 2691 1 1 34 GLN HG2 H -1.228 -4.616 -2.513 1.00 . A A . 34 GLN HG2 1 1
5 2692 1 1 34 GLN HG3 H -0.406 -3.250 -3.312 1.00 . A A . 34 GLN HG3 1 1
5 2693 1 1 34 GLN N N 1.824 -3.336 0.119 1.00 . A A . 34 GLN N 1 1
5 2694 1 1 34 GLN NE2 N 0.306 -4.640 -5.321 1.00 . A A . 34 GLN NE2 1 1
5 2695 1 1 34 GLN O O -0.670 -3.590 1.099 1.00 . A A . 34 GLN O 1 1
5 2696 1 1 34 GLN OE1 O -0.013 -6.433 -4.021 1.00 . A A . 34 GLN OE1 1 1
5 2697 1 1 35 CYS C C -3.790 -3.845 -0.875 1.00 . A A . 35 CYS C 1 1
5 2698 1 1 35 CYS CA C -2.986 -2.763 -0.195 1.00 . A A . 35 CYS CA 1 1
5 2699 1 1 35 CYS CB C -3.695 -1.417 -0.443 1.00 . A A . 35 CYS CB 1 1
5 2700 1 1 35 CYS H H -1.489 -2.211 -1.573 1.00 . A A . 35 CYS H 1 1
5 2701 1 1 35 CYS HA H -2.972 -3.047 0.843 1.00 . A A . 35 CYS HA 1 1
5 2702 1 1 35 CYS HB2 H -3.430 -1.077 -1.464 1.00 . A A . 35 CYS HB2 1 1
5 2703 1 1 35 CYS HB3 H -4.792 -1.515 -0.404 1.00 . A A . 35 CYS HB3 1 1
5 2704 1 1 35 CYS N N -1.633 -2.671 -0.700 1.00 . A A . 35 CYS N 1 1
5 2705 1 1 35 CYS O O -4.076 -3.760 -2.065 1.00 . A A . 35 CYS O 1 1
5 2706 1 1 35 CYS SG S -3.189 -0.161 0.740 1.00 . A A . 35 CYS SG 1 1
5 2707 1 1 36 LEU C C -6.261 -6.237 -0.263 1.00 . A A . 36 LEU C 1 1
5 2708 1 1 36 LEU CA C -4.806 -6.067 -0.700 1.00 . A A . 36 LEU CA 1 1
5 2709 1 1 36 LEU CB C -4.057 -7.344 -0.280 1.00 . A A . 36 LEU CB 1 1
5 2710 1 1 36 LEU CD1 C -2.619 -7.195 -2.329 1.00 . A A . 36 LEU CD1 1 1
5 2711 1 1 36 LEU CD2 C -1.648 -6.508 -0.094 1.00 . A A . 36 LEU CD2 1 1
5 2712 1 1 36 LEU CG C -2.623 -7.446 -0.817 1.00 . A A . 36 LEU CG 1 1
5 2713 1 1 36 LEU H H -3.966 -4.961 0.839 1.00 . A A . 36 LEU H 1 1
5 2714 1 1 36 LEU HA H -4.833 -5.993 -1.771 1.00 . A A . 36 LEU HA 1 1
5 2715 1 1 36 LEU HB2 H -4.044 -7.405 0.829 1.00 . A A . 36 LEU HB2 1 1
5 2716 1 1 36 LEU HB3 H -4.625 -8.228 -0.649 1.00 . A A . 36 LEU HB3 1 1
5 2717 1 1 36 LEU HD11 H -3.448 -7.741 -2.820 1.00 . A A . 36 LEU HD11 1 1
5 2718 1 1 36 LEU HD12 H -1.659 -7.534 -2.765 1.00 . A A . 36 LEU HD12 1 1
5 2719 1 1 36 LEU HD13 H -2.746 -6.113 -2.540 1.00 . A A . 36 LEU HD13 1 1
5 2720 1 1 36 LEU HD21 H -0.612 -6.901 -0.115 1.00 . A A . 36 LEU HD21 1 1
5 2721 1 1 36 LEU HD22 H -1.964 -6.359 0.961 1.00 . A A . 36 LEU HD22 1 1
5 2722 1 1 36 LEU HD23 H -1.649 -5.519 -0.580 1.00 . A A . 36 LEU HD23 1 1
5 2723 1 1 36 LEU HG H -2.285 -8.493 -0.618 1.00 . A A . 36 LEU HG 1 1
5 2724 1 1 36 LEU N N -4.191 -4.884 -0.137 1.00 . A A . 36 LEU N 1 1
5 2725 1 1 36 LEU O O -6.491 -6.555 0.929 1.00 . A A . 36 LEU O 1 1
5 2726 1 1 36 LEU OXT O -7.156 -6.045 -1.124 1.00 . A A . 36 LEU OXT 1 1
5 2727 2 2 1 MAN C1 C -9.514 3.917 0.413 1.00 . B A . 101 MAN C1 1 1
5 2728 2 2 1 MAN C2 C -8.689 4.332 -0.767 1.00 . B A . 101 MAN C2 1 1
5 2729 2 2 1 MAN C3 C -8.673 5.835 -0.871 1.00 . B A . 101 MAN C3 1 1
5 2730 2 2 1 MAN C4 C -10.087 6.361 -0.987 1.00 . B A . 101 MAN C4 1 1
5 2731 2 2 1 MAN C5 C -11.000 5.715 0.056 1.00 . B A . 101 MAN C5 1 1
5 2732 2 2 1 MAN C6 C -12.459 5.990 -0.191 1.00 . B A . 101 MAN C6 1 1
5 2733 2 2 1 MAN H1 H -9.502 2.824 0.443 1.00 . B A . 101 MAN H1 1 1
5 2734 2 2 1 MAN H2 H -7.667 4.006 -0.562 1.00 . B A . 101 MAN H2 1 1
5 2735 2 2 1 MAN H3 H -8.284 6.255 0.079 1.00 . B A . 101 MAN H3 1 1
5 2736 2 2 1 MAN H4 H -10.465 6.106 -2.005 1.00 . B A . 101 MAN H4 1 1
5 2737 2 2 1 MAN H5 H -10.748 6.138 1.059 1.00 . B A . 101 MAN H5 1 1
5 2738 2 2 1 MAN H61 H -12.769 5.562 -1.173 1.00 . B A . 101 MAN H61 1 1
5 2739 2 2 1 MAN H62 H -12.641 7.088 -0.219 1.00 . B A . 101 MAN H62 1 1
5 2740 2 2 1 MAN HO2 H -9.932 3.937 -2.258 1.00 . B A . 101 MAN HO2 1 1
5 2741 2 2 1 MAN HO3 H -6.877 6.165 -1.677 1.00 . B A . 101 MAN HO3 1 1
5 2742 2 2 1 MAN HO4 H -10.237 8.205 -1.661 1.00 . B A . 101 MAN HO4 1 1
5 2743 2 2 1 MAN HO6 H -13.056 4.480 0.910 1.00 . B A . 101 MAN HO6 1 1
5 2744 2 2 1 MAN O1 O -9.082 4.497 1.671 1.00 . B A . 101 MAN O1 1 1
5 2745 2 2 1 MAN O2 O -9.061 3.645 -1.966 1.00 . B A . 101 MAN O2 1 1
5 2746 2 2 1 MAN O3 O -7.808 6.282 -1.910 1.00 . B A . 101 MAN O3 1 1
5 2747 2 2 1 MAN O4 O -10.129 7.770 -0.804 1.00 . B A . 101 MAN O4 1 1
5 2748 2 2 1 MAN O5 O -10.854 4.287 0.128 1.00 . B A . 101 MAN O5 1 1
5 2749 2 2 1 MAN O6 O -13.250 5.422 0.853 1.00 . B A . 101 MAN O6 1 1
5 2750 3 2 1 MAN C1 C -5.712 3.964 -6.411 1.00 . C A . 102 MAN C1 1 1
5 2751 3 2 1 MAN C2 C -4.622 3.189 -7.142 1.00 . C A . 102 MAN C2 1 1
5 2752 3 2 1 MAN C3 C -3.397 3.218 -6.263 1.00 . C A . 102 MAN C3 1 1
5 2753 3 2 1 MAN C4 C -2.957 4.646 -6.019 1.00 . C A . 102 MAN C4 1 1
5 2754 3 2 1 MAN C5 C -4.110 5.504 -5.500 1.00 . C A . 102 MAN C5 1 1
5 2755 3 2 1 MAN C6 C -3.746 6.980 -5.462 1.00 . C A . 102 MAN C6 1 1
5 2756 3 2 1 MAN H1 H -6.660 3.939 -6.995 1.00 . C A . 102 MAN H1 1 1
5 2757 3 2 1 MAN H2 H -4.944 2.135 -7.279 1.00 . C A . 102 MAN H2 1 1
5 2758 3 2 1 MAN H3 H -3.667 2.786 -5.271 1.00 . C A . 102 MAN H3 1 1
5 2759 3 2 1 MAN H4 H -2.611 5.087 -6.988 1.00 . C A . 102 MAN H4 1 1
5 2760 3 2 1 MAN H5 H -4.327 5.190 -4.453 1.00 . C A . 102 MAN H5 1 1
5 2761 3 2 1 MAN H61 H -3.543 7.338 -6.497 1.00 . C A . 102 MAN H61 1 1
5 2762 3 2 1 MAN H62 H -2.814 7.125 -4.868 1.00 . C A . 102 MAN H62 1 1
5 2763 3 2 1 MAN HO2 H -4.293 2.968 -9.097 1.00 . C A . 102 MAN HO2 1 1
5 2764 3 2 1 MAN HO3 H -2.128 2.676 -7.662 1.00 . C A . 102 MAN HO3 1 1
5 2765 3 2 1 MAN HO4 H -1.361 3.867 -5.262 1.00 . C A . 102 MAN HO4 1 1
5 2766 3 2 1 MAN HO6 H -5.050 7.440 -4.046 1.00 . C A . 102 MAN HO6 1 1
5 2767 3 2 1 MAN O1 O -5.935 3.450 -5.078 1.00 . C A . 102 MAN O1 1 1
5 2768 3 2 1 MAN O2 O -4.347 3.685 -8.457 1.00 . C A . 102 MAN O2 1 1
5 2769 3 2 1 MAN O3 O -2.342 2.396 -6.763 1.00 . C A . 102 MAN O3 1 1
5 2770 3 2 1 MAN O4 O -1.887 4.654 -5.079 1.00 . C A . 102 MAN O4 1 1
5 2771 3 2 1 MAN O5 O -5.312 5.332 -6.282 1.00 . C A . 102 MAN O5 1 1
5 2772 3 2 1 MAN O6 O -4.782 7.790 -4.897 1.00 . C A . 102 MAN O6 1 1
5 2773 4 2 1 MAN C1 C 7.668 11.466 -0.798 1.00 . D A . 103 MAN C1 1 1
5 2774 4 2 1 MAN C2 C 7.393 12.152 -2.117 1.00 . D A . 103 MAN C2 1 1
5 2775 4 2 1 MAN C3 C 7.672 11.161 -3.237 1.00 . D A . 103 MAN C3 1 1
5 2776 4 2 1 MAN C4 C 9.128 10.728 -3.168 1.00 . D A . 103 MAN C4 1 1
5 2777 4 2 1 MAN C5 C 9.464 10.203 -1.767 1.00 . D A . 103 MAN C5 1 1
5 2778 4 2 1 MAN C6 C 10.946 9.901 -1.605 1.00 . D A . 103 MAN C6 1 1
5 2779 4 2 1 MAN H1 H 7.448 12.164 0.042 1.00 . D A . 103 MAN H1 1 1
5 2780 4 2 1 MAN H2 H 6.322 12.452 -2.177 1.00 . D A . 103 MAN H2 1 1
5 2781 4 2 1 MAN H3 H 7.051 10.252 -3.058 1.00 . D A . 103 MAN H3 1 1
5 2782 4 2 1 MAN H4 H 9.762 11.629 -3.353 1.00 . D A . 103 MAN H4 1 1
5 2783 4 2 1 MAN H5 H 8.903 9.253 -1.602 1.00 . D A . 103 MAN H5 1 1
5 2784 4 2 1 MAN H61 H 11.531 10.838 -1.747 1.00 . D A . 103 MAN H61 1 1
5 2785 4 2 1 MAN H62 H 11.277 9.181 -2.386 1.00 . D A . 103 MAN H62 1 1
5 2786 4 2 1 MAN HO2 H 9.055 13.197 -1.974 1.00 . D A . 103 MAN HO2 1 1
5 2787 4 2 1 MAN HO3 H 7.123 10.958 -5.136 1.00 . D A . 103 MAN HO3 1 1
5 2788 4 2 1 MAN HO4 H 8.856 9.030 -4.168 1.00 . D A . 103 MAN HO4 1 1
5 2789 4 2 1 MAN HO6 H 10.577 8.783 0.006 1.00 . D A . 103 MAN HO6 1 1
5 2790 4 2 1 MAN O1 O 6.868 10.285 -0.635 1.00 . D A . 103 MAN O1 1 1
5 2791 4 2 1 MAN O2 O 8.140 13.367 -2.224 1.00 . D A . 103 MAN O2 1 1
5 2792 4 2 1 MAN O3 O 7.280 11.672 -4.512 1.00 . D A . 103 MAN O3 1 1
5 2793 4 2 1 MAN O4 O 9.471 9.767 -4.169 1.00 . D A . 103 MAN O4 1 1
5 2794 4 2 1 MAN O5 O 9.067 11.145 -0.750 1.00 . D A . 103 MAN O5 1 1
5 2795 4 2 1 MAN O6 O 11.276 9.357 -0.324 1.00 . D A . 103 MAN O6 1 1
6 2796 1 1 1 THR C C -5.851 5.340 0.284 1.00 . A A . 1 THR C 1 1
6 2797 1 1 1 THR CA C -6.664 5.614 1.515 1.00 . A A . 1 THR CA 1 1
6 2798 1 1 1 THR CB C -7.769 4.518 1.648 1.00 . A A . 1 THR CB 1 1
6 2799 1 1 1 THR CG2 C -8.139 4.342 3.114 1.00 . A A . 1 THR CG2 1 1
6 2800 1 1 1 THR H1 H -8.357 6.803 1.555 1.00 . A A . 1 THR H1 1 1
6 2801 1 1 1 THR H2 H -7.129 7.408 0.549 1.00 . A A . 1 THR H2 1 1
6 2802 1 1 1 THR H3 H -7.015 7.608 2.243 1.00 . A A . 1 THR H3 1 1
6 2803 1 1 1 THR HA H -5.991 5.578 2.356 1.00 . A A . 1 THR HA 1 1
6 2804 1 1 1 THR HB H -7.467 3.530 1.241 1.00 . A A . 1 THR HB 1 1
6 2805 1 1 1 THR HG21 H -9.095 3.791 3.239 1.00 . A A . 1 THR HG21 1 1
6 2806 1 1 1 THR HG22 H -8.200 5.298 3.667 1.00 . A A . 1 THR HG22 1 1
6 2807 1 1 1 THR HG23 H -7.353 3.735 3.604 1.00 . A A . 1 THR HG23 1 1
6 2808 1 1 1 THR N N -7.325 6.979 1.482 1.00 . A A . 1 THR N 1 1
6 2809 1 1 1 THR O O -5.771 6.224 -0.555 1.00 . A A . 1 THR O 1 1
6 2810 1 1 2 GLN C C -5.767 2.455 -1.587 1.00 . A A . 2 GLN C 1 1
6 2811 1 1 2 GLN CA C -4.844 3.563 -1.131 1.00 . A A . 2 GLN CA 1 1
6 2812 1 1 2 GLN CB C -3.441 2.931 -1.047 1.00 . A A . 2 GLN CB 1 1
6 2813 1 1 2 GLN CD C -2.304 4.892 -2.001 1.00 . A A . 2 GLN CD 1 1
6 2814 1 1 2 GLN CG C -2.594 3.424 -2.227 1.00 . A A . 2 GLN CG 1 1
6 2815 1 1 2 GLN H H -5.226 3.487 0.908 1.00 . A A . 2 GLN H 1 1
6 2816 1 1 2 GLN HA H -4.873 4.337 -1.891 1.00 . A A . 2 GLN HA 1 1
6 2817 1 1 2 GLN HB2 H -2.980 3.199 -0.067 1.00 . A A . 2 GLN HB2 1 1
6 2818 1 1 2 GLN HB3 H -3.443 1.820 -1.079 1.00 . A A . 2 GLN HB3 1 1
6 2819 1 1 2 GLN HE21 H -1.051 4.389 -0.466 1.00 . A A . 2 GLN HE21 1 1
6 2820 1 1 2 GLN HE22 H -1.336 6.092 -0.682 1.00 . A A . 2 GLN HE22 1 1
6 2821 1 1 2 GLN HG2 H -1.652 2.865 -2.309 1.00 . A A . 2 GLN HG2 1 1
6 2822 1 1 2 GLN HG3 H -3.134 3.315 -3.186 1.00 . A A . 2 GLN HG3 1 1
6 2823 1 1 2 GLN N N -5.296 4.117 0.129 1.00 . A A . 2 GLN N 1 1
6 2824 1 1 2 GLN NE2 N -1.466 5.150 -0.980 1.00 . A A . 2 GLN NE2 1 1
6 2825 1 1 2 GLN O O -6.491 1.857 -0.791 1.00 . A A . 2 GLN O 1 1
6 2826 1 1 2 GLN OE1 O -2.827 5.781 -2.662 1.00 . A A . 2 GLN OE1 1 1
6 2827 1 1 3 SER C C -6.126 -0.168 -3.393 1.00 . A A . 3 SER C 1 1
6 2828 1 1 3 SER CA C -6.635 1.234 -3.560 1.00 . A A . 3 SER CA 1 1
6 2829 1 1 3 SER CB C -6.742 1.486 -5.087 1.00 . A A . 3 SER CB 1 1
6 2830 1 1 3 SER H H -5.210 2.731 -3.532 1.00 . A A . 3 SER H 1 1
6 2831 1 1 3 SER HA H -7.614 1.281 -3.106 1.00 . A A . 3 SER HA 1 1
6 2832 1 1 3 SER HB2 H -6.194 0.728 -5.686 1.00 . A A . 3 SER HB2 1 1
6 2833 1 1 3 SER HB3 H -7.804 1.519 -5.412 1.00 . A A . 3 SER HB3 1 1
6 2834 1 1 3 SER N N -5.784 2.207 -2.904 1.00 . A A . 3 SER N 1 1
6 2835 1 1 3 SER O O -4.986 -0.396 -3.006 1.00 . A A . 3 SER O 1 1
6 2836 1 1 4 HIS C C -5.368 -2.793 -4.653 1.00 . A A . 4 HIS C 1 1
6 2837 1 1 4 HIS CA C -6.556 -2.562 -3.743 1.00 . A A . 4 HIS CA 1 1
6 2838 1 1 4 HIS CB C -7.702 -3.492 -4.210 1.00 . A A . 4 HIS CB 1 1
6 2839 1 1 4 HIS CD2 C -6.568 -5.599 -3.154 1.00 . A A . 4 HIS CD2 1 1
6 2840 1 1 4 HIS CE1 C -8.329 -6.901 -3.152 1.00 . A A . 4 HIS CE1 1 1
6 2841 1 1 4 HIS CG C -7.595 -4.913 -3.714 1.00 . A A . 4 HIS CG 1 1
6 2842 1 1 4 HIS H H -7.884 -0.962 -4.048 1.00 . A A . 4 HIS H 1 1
6 2843 1 1 4 HIS HA H -6.255 -2.810 -2.734 1.00 . A A . 4 HIS HA 1 1
6 2844 1 1 4 HIS HB2 H -8.651 -3.074 -3.809 1.00 . A A . 4 HIS HB2 1 1
6 2845 1 1 4 HIS HB3 H -7.784 -3.497 -5.320 1.00 . A A . 4 HIS HB3 1 1
6 2846 1 1 4 HIS HD1 H -9.620 -5.521 -3.955 1.00 . A A . 4 HIS HD1 1 1
6 2847 1 1 4 HIS HD2 H -5.573 -5.265 -2.878 1.00 . A A . 4 HIS HD2 1 1
6 2848 1 1 4 HIS HE1 H -8.966 -7.758 -2.997 1.00 . A A . 4 HIS HE1 1 1
6 2849 1 1 4 HIS HE2 H -6.622 -7.452 -2.161 1.00 . A A . 4 HIS HE2 1 1
6 2850 1 1 4 HIS N N -6.958 -1.165 -3.754 1.00 . A A . 4 HIS N 1 1
6 2851 1 1 4 HIS ND1 N -8.680 -5.749 -3.708 1.00 . A A . 4 HIS ND1 1 1
6 2852 1 1 4 HIS NE2 N -7.053 -6.836 -2.827 1.00 . A A . 4 HIS NE2 1 1
6 2853 1 1 4 HIS O O -5.357 -2.359 -5.801 1.00 . A A . 4 HIS O 1 1
6 2854 1 1 5 TYR C C -2.221 -2.573 -4.988 1.00 . A A . 5 TYR C 1 1
6 2855 1 1 5 TYR CA C -3.087 -3.793 -4.735 1.00 . A A . 5 TYR CA 1 1
6 2856 1 1 5 TYR CB C -3.216 -4.634 -6.027 1.00 . A A . 5 TYR CB 1 1
6 2857 1 1 5 TYR CD1 C -3.831 -6.964 -5.221 1.00 . A A . 5 TYR CD1 1 1
6 2858 1 1 5 TYR CD2 C -5.503 -5.602 -6.324 1.00 . A A . 5 TYR CD2 1 1
6 2859 1 1 5 TYR CE1 C -4.773 -7.996 -5.081 1.00 . A A . 5 TYR CE1 1 1
6 2860 1 1 5 TYR CE2 C -6.446 -6.621 -6.173 1.00 . A A . 5 TYR CE2 1 1
6 2861 1 1 5 TYR CG C -4.194 -5.756 -5.842 1.00 . A A . 5 TYR CG 1 1
6 2862 1 1 5 TYR CZ C -6.078 -7.821 -5.559 1.00 . A A . 5 TYR CZ 1 1
6 2863 1 1 5 TYR H H -4.375 -3.675 -3.122 1.00 . A A . 5 TYR H 1 1
6 2864 1 1 5 TYR HA H -2.571 -4.393 -4.005 1.00 . A A . 5 TYR HA 1 1
6 2865 1 1 5 TYR HB2 H -3.556 -3.991 -6.868 1.00 . A A . 5 TYR HB2 1 1
6 2866 1 1 5 TYR HB3 H -2.234 -5.071 -6.308 1.00 . A A . 5 TYR HB3 1 1
6 2867 1 1 5 TYR HD1 H -2.825 -7.103 -4.848 1.00 . A A . 5 TYR HD1 1 1
6 2868 1 1 5 TYR HD2 H -5.783 -4.672 -6.796 1.00 . A A . 5 TYR HD2 1 1
6 2869 1 1 5 TYR HE1 H -4.498 -8.917 -4.588 1.00 . A A . 5 TYR HE1 1 1
6 2870 1 1 5 TYR HE2 H -7.464 -6.464 -6.493 1.00 . A A . 5 TYR HE2 1 1
6 2871 1 1 5 TYR HH H -7.158 -9.291 -6.171 1.00 . A A . 5 TYR HH 1 1
6 2872 1 1 5 TYR N N -4.336 -3.438 -4.103 1.00 . A A . 5 TYR N 1 1
6 2873 1 1 5 TYR O O -1.223 -2.658 -5.694 1.00 . A A . 5 TYR O 1 1
6 2874 1 1 5 TYR OH O -7.059 -8.806 -5.347 1.00 . A A . 5 TYR OH 1 1
6 2875 1 1 6 GLY C C -0.891 -0.207 -3.207 1.00 . A A . 6 GLY C 1 1
6 2876 1 1 6 GLY CA C -1.801 -0.201 -4.388 1.00 . A A . 6 GLY CA 1 1
6 2877 1 1 6 GLY H H -3.426 -1.401 -3.845 1.00 . A A . 6 GLY H 1 1
6 2878 1 1 6 GLY HA2 H -1.200 -0.139 -5.286 1.00 . A A . 6 GLY HA2 1 1
6 2879 1 1 6 GLY HA3 H -2.480 0.626 -4.258 1.00 . A A . 6 GLY HA3 1 1
6 2880 1 1 6 GLY N N -2.590 -1.418 -4.393 1.00 . A A . 6 GLY N 1 1
6 2881 1 1 6 GLY O O -0.825 -1.174 -2.458 1.00 . A A . 6 GLY O 1 1
6 2882 1 1 7 GLN C C 0.360 1.673 -0.678 1.00 . A A . 7 GLN C 1 1
6 2883 1 1 7 GLN CA C 0.815 0.941 -1.937 1.00 . A A . 7 GLN CA 1 1
6 2884 1 1 7 GLN CB C 2.043 1.644 -2.537 1.00 . A A . 7 GLN CB 1 1
6 2885 1 1 7 GLN CD C 4.582 1.492 -2.371 1.00 . A A . 7 GLN CD 1 1
6 2886 1 1 7 GLN CG C 3.260 1.521 -1.612 1.00 . A A . 7 GLN CG 1 1
6 2887 1 1 7 GLN H H -0.256 1.705 -3.547 1.00 . A A . 7 GLN H 1 1
6 2888 1 1 7 GLN HA H 1.112 -0.061 -1.659 1.00 . A A . 7 GLN HA 1 1
6 2889 1 1 7 GLN HB2 H 2.250 1.153 -3.513 1.00 . A A . 7 GLN HB2 1 1
6 2890 1 1 7 GLN HB3 H 1.825 2.705 -2.772 1.00 . A A . 7 GLN HB3 1 1
6 2891 1 1 7 GLN HE21 H 5.406 0.673 -0.734 1.00 . A A . 7 GLN HE21 1 1
6 2892 1 1 7 GLN HE22 H 6.443 0.736 -2.166 1.00 . A A . 7 GLN HE22 1 1
6 2893 1 1 7 GLN HG2 H 3.274 2.332 -0.863 1.00 . A A . 7 GLN HG2 1 1
6 2894 1 1 7 GLN HG3 H 3.164 0.558 -1.068 1.00 . A A . 7 GLN HG3 1 1
6 2895 1 1 7 GLN N N -0.196 0.903 -2.962 1.00 . A A . 7 GLN N 1 1
6 2896 1 1 7 GLN NE2 N 5.606 0.960 -1.673 1.00 . A A . 7 GLN NE2 1 1
6 2897 1 1 7 GLN O O 0.018 2.845 -0.717 1.00 . A A . 7 GLN O 1 1
6 2898 1 1 7 GLN OE1 O 4.731 1.860 -3.531 1.00 . A A . 7 GLN OE1 1 1
6 2899 1 1 8 CYS C C 1.381 2.122 2.424 1.00 . A A . 8 CYS C 1 1
6 2900 1 1 8 CYS CA C 0.077 1.745 1.755 1.00 . A A . 8 CYS CA 1 1
6 2901 1 1 8 CYS CB C -0.851 0.906 2.708 1.00 . A A . 8 CYS CB 1 1
6 2902 1 1 8 CYS H H 0.614 0.065 0.547 1.00 . A A . 8 CYS H 1 1
6 2903 1 1 8 CYS HA H -0.422 2.685 1.563 1.00 . A A . 8 CYS HA 1 1
6 2904 1 1 8 CYS HB2 H -1.843 1.406 2.656 1.00 . A A . 8 CYS HB2 1 1
6 2905 1 1 8 CYS HB3 H -0.955 -0.106 2.262 1.00 . A A . 8 CYS HB3 1 1
6 2906 1 1 8 CYS N N 0.342 1.029 0.502 1.00 . A A . 8 CYS N 1 1
6 2907 1 1 8 CYS O O 1.440 2.936 3.333 1.00 . A A . 8 CYS O 1 1
6 2908 1 1 8 CYS SG S -0.425 0.739 4.489 1.00 . A A . 8 CYS SG 1 1
6 2909 1 1 9 GLY C C 4.832 1.329 1.787 1.00 . A A . 9 GLY C 1 1
6 2910 1 1 9 GLY CA C 3.745 1.794 2.675 1.00 . A A . 9 GLY CA 1 1
6 2911 1 1 9 GLY H H 2.492 0.925 1.209 1.00 . A A . 9 GLY H 1 1
6 2912 1 1 9 GLY HA2 H 3.883 2.850 2.868 1.00 . A A . 9 GLY HA2 1 1
6 2913 1 1 9 GLY HA3 H 3.750 1.182 3.567 1.00 . A A . 9 GLY HA3 1 1
6 2914 1 1 9 GLY N N 2.500 1.562 1.980 1.00 . A A . 9 GLY N 1 1
6 2915 1 1 9 GLY O O 4.627 0.519 0.891 1.00 . A A . 9 GLY O 1 1
6 2916 1 1 10 GLY C C 8.364 1.889 1.787 1.00 . A A . 10 GLY C 1 1
6 2917 1 1 10 GLY CA C 7.152 1.333 1.169 1.00 . A A . 10 GLY CA 1 1
6 2918 1 1 10 GLY H H 6.280 2.457 2.699 1.00 . A A . 10 GLY H 1 1
6 2919 1 1 10 GLY HA2 H 7.210 0.252 1.185 1.00 . A A . 10 GLY HA2 1 1
6 2920 1 1 10 GLY HA3 H 7.079 1.778 0.191 1.00 . A A . 10 GLY HA3 1 1
6 2921 1 1 10 GLY N N 6.051 1.795 1.980 1.00 . A A . 10 GLY N 1 1
6 2922 1 1 10 GLY O O 8.266 2.670 2.725 1.00 . A A . 10 GLY O 1 1
6 2923 1 1 11 ILE C C 10.915 3.620 1.357 1.00 . A A . 11 ILE C 1 1
6 2924 1 1 11 ILE CA C 10.789 2.141 1.706 1.00 . A A . 11 ILE CA 1 1
6 2925 1 1 11 ILE CB C 11.957 1.307 1.186 1.00 . A A . 11 ILE CB 1 1
6 2926 1 1 11 ILE CD1 C 13.240 0.288 3.202 1.00 . A A . 11 ILE CD1 1 1
6 2927 1 1 11 ILE CG1 C 12.163 0.096 2.130 1.00 . A A . 11 ILE CG1 1 1
6 2928 1 1 11 ILE CG2 C 13.248 2.133 0.980 1.00 . A A . 11 ILE CG2 1 1
6 2929 1 1 11 ILE H H 9.588 0.896 0.502 1.00 . A A . 11 ILE H 1 1
6 2930 1 1 11 ILE HA H 10.806 2.103 2.787 1.00 . A A . 11 ILE HA 1 1
6 2931 1 1 11 ILE HB H 11.662 0.911 0.185 1.00 . A A . 11 ILE HB 1 1
6 2932 1 1 11 ILE HD11 H 14.250 0.300 2.737 1.00 . A A . 11 ILE HD11 1 1
6 2933 1 1 11 ILE HD12 H 13.213 -0.557 3.923 1.00 . A A . 11 ILE HD12 1 1
6 2934 1 1 11 ILE HD13 H 13.085 1.236 3.757 1.00 . A A . 11 ILE HD13 1 1
6 2935 1 1 11 ILE HG12 H 11.198 -0.160 2.625 1.00 . A A . 11 ILE HG12 1 1
6 2936 1 1 11 ILE HG13 H 12.452 -0.796 1.535 1.00 . A A . 11 ILE HG13 1 1
6 2937 1 1 11 ILE HG21 H 14.101 1.472 0.735 1.00 . A A . 11 ILE HG21 1 1
6 2938 1 1 11 ILE HG22 H 13.505 2.693 1.906 1.00 . A A . 11 ILE HG22 1 1
6 2939 1 1 11 ILE HG23 H 13.136 2.862 0.150 1.00 . A A . 11 ILE HG23 1 1
6 2940 1 1 11 ILE N N 9.536 1.558 1.243 1.00 . A A . 11 ILE N 1 1
6 2941 1 1 11 ILE O O 11.547 4.402 2.057 1.00 . A A . 11 ILE O 1 1
6 2942 1 1 12 GLY C C 9.012 5.887 -0.700 1.00 . A A . 12 GLY C 1 1
6 2943 1 1 12 GLY CA C 10.350 5.407 -0.248 1.00 . A A . 12 GLY CA 1 1
6 2944 1 1 12 GLY H H 9.737 3.383 -0.265 1.00 . A A . 12 GLY H 1 1
6 2945 1 1 12 GLY HA2 H 10.669 6.086 0.532 1.00 . A A . 12 GLY HA2 1 1
6 2946 1 1 12 GLY HA3 H 11.002 5.399 -1.108 1.00 . A A . 12 GLY HA3 1 1
6 2947 1 1 12 GLY N N 10.253 4.045 0.266 1.00 . A A . 12 GLY N 1 1
6 2948 1 1 12 GLY O O 8.891 6.781 -1.534 1.00 . A A . 12 GLY O 1 1
6 2949 1 1 13 TYR C C 6.129 6.847 0.267 1.00 . A A . 13 TYR C 1 1
6 2950 1 1 13 TYR CA C 6.596 5.622 -0.514 1.00 . A A . 13 TYR CA 1 1
6 2951 1 1 13 TYR CB C 5.630 4.446 -0.239 1.00 . A A . 13 TYR CB 1 1
6 2952 1 1 13 TYR CD1 C 4.219 4.905 -2.237 1.00 . A A . 13 TYR CD1 1 1
6 2953 1 1 13 TYR CD2 C 3.138 4.854 -0.064 1.00 . A A . 13 TYR CD2 1 1
6 2954 1 1 13 TYR CE1 C 2.997 5.162 -2.851 1.00 . A A . 13 TYR CE1 1 1
6 2955 1 1 13 TYR CE2 C 1.906 5.075 -0.686 1.00 . A A . 13 TYR CE2 1 1
6 2956 1 1 13 TYR CG C 4.299 4.745 -0.845 1.00 . A A . 13 TYR CG 1 1
6 2957 1 1 13 TYR CZ C 1.843 5.219 -2.081 1.00 . A A . 13 TYR CZ 1 1
6 2958 1 1 13 TYR H H 8.082 4.625 0.581 1.00 . A A . 13 TYR H 1 1
6 2959 1 1 13 TYR HA H 6.580 5.875 -1.567 1.00 . A A . 13 TYR HA 1 1
6 2960 1 1 13 TYR HB2 H 6.005 3.520 -0.718 1.00 . A A . 13 TYR HB2 1 1
6 2961 1 1 13 TYR HB3 H 5.517 4.272 0.853 1.00 . A A . 13 TYR HB3 1 1
6 2962 1 1 13 TYR HD1 H 5.101 4.793 -2.852 1.00 . A A . 13 TYR HD1 1 1
6 2963 1 1 13 TYR HD2 H 3.184 4.742 1.012 1.00 . A A . 13 TYR HD2 1 1
6 2964 1 1 13 TYR HE1 H 2.926 5.255 -3.926 1.00 . A A . 13 TYR HE1 1 1
6 2965 1 1 13 TYR HE2 H 1.020 5.117 -0.070 1.00 . A A . 13 TYR HE2 1 1
6 2966 1 1 13 TYR HH H -0.061 5.097 -2.176 1.00 . A A . 13 TYR HH 1 1
6 2967 1 1 13 TYR N N 7.948 5.257 -0.176 1.00 . A A . 13 TYR N 1 1
6 2968 1 1 13 TYR O O 6.391 6.978 1.456 1.00 . A A . 13 TYR O 1 1
6 2969 1 1 13 TYR OH O 0.646 5.366 -2.780 1.00 . A A . 13 TYR OH 1 1
6 2970 1 1 14 SER C C 3.410 9.180 -0.005 1.00 . A A . 14 SER C 1 1
6 2971 1 1 14 SER CA C 4.882 8.960 0.234 1.00 . A A . 14 SER CA 1 1
6 2972 1 1 14 SER CB C 5.555 10.208 -0.351 1.00 . A A . 14 SER CB 1 1
6 2973 1 1 14 SER H H 5.214 7.617 -1.369 1.00 . A A . 14 SER H 1 1
6 2974 1 1 14 SER HA H 5.029 8.935 1.305 1.00 . A A . 14 SER HA 1 1
6 2975 1 1 14 SER HB2 H 5.538 10.121 -1.461 1.00 . A A . 14 SER HB2 1 1
6 2976 1 1 14 SER HB3 H 5.091 11.161 -0.019 1.00 . A A . 14 SER HB3 1 1
6 2977 1 1 14 SER N N 5.390 7.749 -0.401 1.00 . A A . 14 SER N 1 1
6 2978 1 1 14 SER O O 2.873 10.237 0.315 1.00 . A A . 14 SER O 1 1
6 2979 1 1 15 GLY C C 0.521 7.913 0.499 1.00 . A A . 15 GLY C 1 1
6 2980 1 1 15 GLY CA C 1.250 8.326 -0.763 1.00 . A A . 15 GLY CA 1 1
6 2981 1 1 15 GLY H H 3.113 7.329 -0.805 1.00 . A A . 15 GLY H 1 1
6 2982 1 1 15 GLY HA2 H 0.997 9.355 -0.979 1.00 . A A . 15 GLY HA2 1 1
6 2983 1 1 15 GLY HA3 H 0.961 7.660 -1.558 1.00 . A A . 15 GLY HA3 1 1
6 2984 1 1 15 GLY N N 2.696 8.213 -0.606 1.00 . A A . 15 GLY N 1 1
6 2985 1 1 15 GLY O O 1.150 7.573 1.497 1.00 . A A . 15 GLY O 1 1
6 2986 1 1 16 PRO C C -1.198 6.185 2.375 1.00 . A A . 16 PRO C 1 1
6 2987 1 1 16 PRO CA C -1.631 7.448 1.621 1.00 . A A . 16 PRO CA 1 1
6 2988 1 1 16 PRO CB C -3.032 7.289 1.012 1.00 . A A . 16 PRO CB 1 1
6 2989 1 1 16 PRO CD C -1.605 8.416 -0.618 1.00 . A A . 16 PRO CD 1 1
6 2990 1 1 16 PRO CG C -3.069 8.237 -0.199 1.00 . A A . 16 PRO CG 1 1
6 2991 1 1 16 PRO HA H -1.585 8.243 2.350 1.00 . A A . 16 PRO HA 1 1
6 2992 1 1 16 PRO HB2 H -3.172 6.249 0.639 1.00 . A A . 16 PRO HB2 1 1
6 2993 1 1 16 PRO HB3 H -3.827 7.515 1.746 1.00 . A A . 16 PRO HB3 1 1
6 2994 1 1 16 PRO HD2 H -1.393 7.828 -1.543 1.00 . A A . 16 PRO HD2 1 1
6 2995 1 1 16 PRO HD3 H -1.378 9.488 -0.811 1.00 . A A . 16 PRO HD3 1 1
6 2996 1 1 16 PRO HG2 H -3.661 7.804 -1.037 1.00 . A A . 16 PRO HG2 1 1
6 2997 1 1 16 PRO HG3 H -3.497 9.221 0.082 1.00 . A A . 16 PRO HG3 1 1
6 2998 1 1 16 PRO N N -0.806 7.909 0.502 1.00 . A A . 16 PRO N 1 1
6 2999 1 1 16 PRO O O -0.996 5.143 1.764 1.00 . A A . 16 PRO O 1 1
6 3000 1 1 17 THR C C -1.806 4.248 5.065 1.00 . A A . 17 THR C 1 1
6 3001 1 1 17 THR CA C -0.666 5.081 4.508 1.00 . A A . 17 THR CA 1 1
6 3002 1 1 17 THR CB C 0.293 5.527 5.612 1.00 . A A . 17 THR CB 1 1
6 3003 1 1 17 THR CG2 C -0.381 6.600 6.482 1.00 . A A . 17 THR CG2 1 1
6 3004 1 1 17 THR H H -1.309 7.058 4.216 1.00 . A A . 17 THR H 1 1
6 3005 1 1 17 THR HA H -0.117 4.419 3.868 1.00 . A A . 17 THR HA 1 1
6 3006 1 1 17 THR HB H 1.203 5.964 5.135 1.00 . A A . 17 THR HB 1 1
6 3007 1 1 17 THR HG1 H -0.023 3.872 6.552 1.00 . A A . 17 THR HG1 1 1
6 3008 1 1 17 THR HG21 H -0.412 7.571 5.948 1.00 . A A . 17 THR HG21 1 1
6 3009 1 1 17 THR HG22 H 0.206 6.747 7.414 1.00 . A A . 17 THR HG22 1 1
6 3010 1 1 17 THR HG23 H -1.409 6.302 6.771 1.00 . A A . 17 THR HG23 1 1
6 3011 1 1 17 THR N N -1.151 6.215 3.715 1.00 . A A . 17 THR N 1 1
6 3012 1 1 17 THR O O -1.677 3.472 6.005 1.00 . A A . 17 THR O 1 1
6 3013 1 1 17 THR OG1 O 0.732 4.478 6.466 1.00 . A A . 17 THR OG1 1 1
6 3014 1 1 18 VAL C C -4.738 2.963 3.818 1.00 . A A . 18 VAL C 1 1
6 3015 1 1 18 VAL CA C -4.189 3.734 4.978 1.00 . A A . 18 VAL CA 1 1
6 3016 1 1 18 VAL CB C -5.244 4.711 5.496 1.00 . A A . 18 VAL CB 1 1
6 3017 1 1 18 VAL CG1 C -6.445 3.973 6.125 1.00 . A A . 18 VAL CG1 1 1
6 3018 1 1 18 VAL CG2 C -4.591 5.598 6.569 1.00 . A A . 18 VAL CG2 1 1
6 3019 1 1 18 VAL H H -3.058 4.948 3.664 1.00 . A A . 18 VAL H 1 1
6 3020 1 1 18 VAL HA H -3.947 3.022 5.757 1.00 . A A . 18 VAL HA 1 1
6 3021 1 1 18 VAL HB H -5.605 5.361 4.668 1.00 . A A . 18 VAL HB 1 1
6 3022 1 1 18 VAL HG11 H -6.214 3.672 7.169 1.00 . A A . 18 VAL HG11 1 1
6 3023 1 1 18 VAL HG12 H -6.733 3.057 5.577 1.00 . A A . 18 VAL HG12 1 1
6 3024 1 1 18 VAL HG13 H -7.334 4.638 6.150 1.00 . A A . 18 VAL HG13 1 1
6 3025 1 1 18 VAL HG21 H -5.366 6.057 7.219 1.00 . A A . 18 VAL HG21 1 1
6 3026 1 1 18 VAL HG22 H -3.981 6.406 6.116 1.00 . A A . 18 VAL HG22 1 1
6 3027 1 1 18 VAL HG23 H -3.927 4.982 7.217 1.00 . A A . 18 VAL HG23 1 1
6 3028 1 1 18 VAL N N -3.002 4.404 4.491 1.00 . A A . 18 VAL N 1 1
6 3029 1 1 18 VAL O O -4.895 3.495 2.722 1.00 . A A . 18 VAL O 1 1
6 3030 1 1 19 CYS C C -7.237 1.141 3.082 1.00 . A A . 19 CYS C 1 1
6 3031 1 1 19 CYS CA C -5.753 0.907 3.011 1.00 . A A . 19 CYS CA 1 1
6 3032 1 1 19 CYS CB C -5.369 -0.558 3.215 1.00 . A A . 19 CYS CB 1 1
6 3033 1 1 19 CYS H H -4.952 1.256 4.898 1.00 . A A . 19 CYS H 1 1
6 3034 1 1 19 CYS HA H -5.462 1.230 2.024 1.00 . A A . 19 CYS HA 1 1
6 3035 1 1 19 CYS HB2 H -5.501 -0.837 4.285 1.00 . A A . 19 CYS HB2 1 1
6 3036 1 1 19 CYS HB3 H -5.968 -1.270 2.650 1.00 . A A . 19 CYS HB3 1 1
6 3037 1 1 19 CYS N N -5.072 1.692 4.011 1.00 . A A . 19 CYS N 1 1
6 3038 1 1 19 CYS O O -7.775 1.421 4.145 1.00 . A A . 19 CYS O 1 1
6 3039 1 1 19 CYS SG S -3.660 -0.787 2.709 1.00 . A A . 19 CYS SG 1 1
6 3040 1 1 20 ALA C C -10.143 0.433 2.782 1.00 . A A . 20 ALA C 1 1
6 3041 1 1 20 ALA CA C -9.353 1.169 1.730 1.00 . A A . 20 ALA CA 1 1
6 3042 1 1 20 ALA CB C -9.735 0.613 0.328 1.00 . A A . 20 ALA CB 1 1
6 3043 1 1 20 ALA H H -7.427 0.926 1.057 1.00 . A A . 20 ALA H 1 1
6 3044 1 1 20 ALA HA H -9.662 2.196 1.826 1.00 . A A . 20 ALA HA 1 1
6 3045 1 1 20 ALA HB1 H -10.726 0.985 -0.003 1.00 . A A . 20 ALA HB1 1 1
6 3046 1 1 20 ALA HB2 H -9.749 -0.498 0.323 1.00 . A A . 20 ALA HB2 1 1
6 3047 1 1 20 ALA HB3 H -8.981 0.925 -0.427 1.00 . A A . 20 ALA HB3 1 1
6 3048 1 1 20 ALA N N -7.916 1.139 1.908 1.00 . A A . 20 ALA N 1 1
6 3049 1 1 20 ALA O O -9.677 -0.533 3.353 1.00 . A A . 20 ALA O 1 1
6 3050 1 1 21 SER C C -12.538 -1.312 3.675 1.00 . A A . 21 SER C 1 1
6 3051 1 1 21 SER CA C -12.202 0.144 4.056 1.00 . A A . 21 SER CA 1 1
6 3052 1 1 21 SER CB C -13.486 0.984 4.287 1.00 . A A . 21 SER CB 1 1
6 3053 1 1 21 SER H H -11.785 1.623 2.604 1.00 . A A . 21 SER H 1 1
6 3054 1 1 21 SER HA H -11.624 0.100 4.971 1.00 . A A . 21 SER HA 1 1
6 3055 1 1 21 SER HB2 H -13.198 2.058 4.328 1.00 . A A . 21 SER HB2 1 1
6 3056 1 1 21 SER HB3 H -14.178 0.850 3.426 1.00 . A A . 21 SER HB3 1 1
6 3057 1 1 21 SER HG H -13.635 0.956 6.241 1.00 . A A . 21 SER HG 1 1
6 3058 1 1 21 SER N N -11.391 0.823 3.042 1.00 . A A . 21 SER N 1 1
6 3059 1 1 21 SER O O -13.042 -2.093 4.471 1.00 . A A . 21 SER O 1 1
6 3060 1 1 21 SER OG O -14.171 0.667 5.496 1.00 . A A . 21 SER OG 1 1
6 3061 1 1 22 GLY C C -10.825 -3.670 1.711 1.00 . A A . 22 GLY C 1 1
6 3062 1 1 22 GLY CA C -12.198 -3.075 1.926 1.00 . A A . 22 GLY CA 1 1
6 3063 1 1 22 GLY H H -11.747 -1.030 1.854 1.00 . A A . 22 GLY H 1 1
6 3064 1 1 22 GLY HA2 H -12.717 -3.722 2.619 1.00 . A A . 22 GLY HA2 1 1
6 3065 1 1 22 GLY HA3 H -12.662 -3.054 0.953 1.00 . A A . 22 GLY HA3 1 1
6 3066 1 1 22 GLY N N -12.193 -1.705 2.426 1.00 . A A . 22 GLY N 1 1
6 3067 1 1 22 GLY O O -10.735 -4.823 1.309 1.00 . A A . 22 GLY O 1 1
6 3068 1 1 23 THR C C -7.582 -3.280 3.059 1.00 . A A . 23 THR C 1 1
6 3069 1 1 23 THR CA C -8.354 -3.374 1.740 1.00 . A A . 23 THR CA 1 1
6 3070 1 1 23 THR CB C -7.510 -2.681 0.632 1.00 . A A . 23 THR CB 1 1
6 3071 1 1 23 THR CG2 C -8.113 -2.833 -0.765 1.00 . A A . 23 THR CG2 1 1
6 3072 1 1 23 THR H H -9.812 -2.015 2.376 1.00 . A A . 23 THR H 1 1
6 3073 1 1 23 THR HA H -8.396 -4.417 1.489 1.00 . A A . 23 THR HA 1 1
6 3074 1 1 23 THR HB H -6.495 -3.134 0.622 1.00 . A A . 23 THR HB 1 1
6 3075 1 1 23 THR HG1 H -6.835 -1.179 1.576 1.00 . A A . 23 THR HG1 1 1
6 3076 1 1 23 THR HG21 H -7.825 -3.807 -1.196 1.00 . A A . 23 THR HG21 1 1
6 3077 1 1 23 THR HG22 H -7.717 -2.036 -1.425 1.00 . A A . 23 THR HG22 1 1
6 3078 1 1 23 THR HG23 H -9.214 -2.750 -0.733 1.00 . A A . 23 THR HG23 1 1
6 3079 1 1 23 THR N N -9.732 -2.902 1.921 1.00 . A A . 23 THR N 1 1
6 3080 1 1 23 THR O O -7.890 -2.512 3.963 1.00 . A A . 23 THR O 1 1
6 3081 1 1 23 THR OG1 O -7.344 -1.300 0.747 1.00 . A A . 23 THR OG1 1 1
6 3082 1 1 24 THR C C -4.229 -3.875 4.151 1.00 . A A . 24 THR C 1 1
6 3083 1 1 24 THR CA C -5.693 -4.138 4.433 1.00 . A A . 24 THR CA 1 1
6 3084 1 1 24 THR CB C -5.834 -5.468 5.175 1.00 . A A . 24 THR CB 1 1
6 3085 1 1 24 THR CG2 C -7.104 -5.407 6.047 1.00 . A A . 24 THR CG2 1 1
6 3086 1 1 24 THR H H -6.351 -4.773 2.521 1.00 . A A . 24 THR H 1 1
6 3087 1 1 24 THR HA H -5.998 -3.360 5.118 1.00 . A A . 24 THR HA 1 1
6 3088 1 1 24 THR HB H -4.976 -5.664 5.860 1.00 . A A . 24 THR HB 1 1
6 3089 1 1 24 THR HG1 H -6.518 -6.364 3.550 1.00 . A A . 24 THR HG1 1 1
6 3090 1 1 24 THR HG21 H -7.575 -6.407 6.148 1.00 . A A . 24 THR HG21 1 1
6 3091 1 1 24 THR HG22 H -7.857 -4.714 5.615 1.00 . A A . 24 THR HG22 1 1
6 3092 1 1 24 THR HG23 H -6.846 -5.042 7.063 1.00 . A A . 24 THR HG23 1 1
6 3093 1 1 24 THR N N -6.502 -4.053 3.218 1.00 . A A . 24 THR N 1 1
6 3094 1 1 24 THR O O -3.677 -4.325 3.154 1.00 . A A . 24 THR O 1 1
6 3095 1 1 24 THR OG1 O -5.919 -6.587 4.298 1.00 . A A . 24 THR OG1 1 1
6 3096 1 1 25 CYS C C -1.289 -4.091 5.133 1.00 . A A . 25 CYS C 1 1
6 3097 1 1 25 CYS CA C -2.102 -2.839 4.856 1.00 . A A . 25 CYS CA 1 1
6 3098 1 1 25 CYS CB C -1.575 -1.741 5.829 1.00 . A A . 25 CYS CB 1 1
6 3099 1 1 25 CYS H H -3.972 -2.690 5.805 1.00 . A A . 25 CYS H 1 1
6 3100 1 1 25 CYS HA H -1.892 -2.553 3.834 1.00 . A A . 25 CYS HA 1 1
6 3101 1 1 25 CYS HB2 H -1.936 -1.991 6.851 1.00 . A A . 25 CYS HB2 1 1
6 3102 1 1 25 CYS HB3 H -0.463 -1.770 5.866 1.00 . A A . 25 CYS HB3 1 1
6 3103 1 1 25 CYS N N -3.537 -3.085 5.005 1.00 . A A . 25 CYS N 1 1
6 3104 1 1 25 CYS O O -1.312 -4.620 6.242 1.00 . A A . 25 CYS O 1 1
6 3105 1 1 25 CYS SG S -2.053 -0.026 5.445 1.00 . A A . 25 CYS SG 1 1
6 3106 1 1 26 GLN C C 1.575 -5.605 3.561 1.00 . A A . 26 GLN C 1 1
6 3107 1 1 26 GLN CA C 0.269 -5.774 4.299 1.00 . A A . 26 GLN CA 1 1
6 3108 1 1 26 GLN CB C -0.439 -7.056 3.791 1.00 . A A . 26 GLN CB 1 1
6 3109 1 1 26 GLN CD C -2.368 -8.680 4.179 1.00 . A A . 26 GLN CD 1 1
6 3110 1 1 26 GLN CG C -1.842 -7.265 4.413 1.00 . A A . 26 GLN CG 1 1
6 3111 1 1 26 GLN H H -0.553 -4.173 3.220 1.00 . A A . 26 GLN H 1 1
6 3112 1 1 26 GLN HA H 0.523 -5.899 5.343 1.00 . A A . 26 GLN HA 1 1
6 3113 1 1 26 GLN HB2 H -0.526 -7.021 2.688 1.00 . A A . 26 GLN HB2 1 1
6 3114 1 1 26 GLN HB3 H 0.195 -7.938 4.033 1.00 . A A . 26 GLN HB3 1 1
6 3115 1 1 26 GLN HE21 H -4.310 -8.027 4.026 1.00 . A A . 26 GLN HE21 1 1
6 3116 1 1 26 GLN HE22 H -4.038 -9.747 3.869 1.00 . A A . 26 GLN HE22 1 1
6 3117 1 1 26 GLN HG2 H -1.778 -7.117 5.511 1.00 . A A . 26 GLN HG2 1 1
6 3118 1 1 26 GLN HG3 H -2.554 -6.523 3.996 1.00 . A A . 26 GLN HG3 1 1
6 3119 1 1 26 GLN N N -0.531 -4.580 4.140 1.00 . A A . 26 GLN N 1 1
6 3120 1 1 26 GLN NE2 N -3.699 -8.822 3.999 1.00 . A A . 26 GLN NE2 1 1
6 3121 1 1 26 GLN O O 1.847 -4.585 2.937 1.00 . A A . 26 GLN O 1 1
6 3122 1 1 26 GLN OE1 O -1.617 -9.656 4.188 1.00 . A A . 26 GLN OE1 1 1
6 3123 1 1 27 VAL C C 3.867 -7.518 1.918 1.00 . A A . 27 VAL C 1 1
6 3124 1 1 27 VAL CA C 3.781 -6.565 3.085 1.00 . A A . 27 VAL CA 1 1
6 3125 1 1 27 VAL CB C 4.822 -6.881 4.154 1.00 . A A . 27 VAL CB 1 1
6 3126 1 1 27 VAL CG1 C 6.184 -7.282 3.550 1.00 . A A . 27 VAL CG1 1 1
6 3127 1 1 27 VAL CG2 C 4.967 -5.634 5.047 1.00 . A A . 27 VAL CG2 1 1
6 3128 1 1 27 VAL H H 2.194 -7.469 4.078 1.00 . A A . 27 VAL H 1 1
6 3129 1 1 27 VAL HA H 4.002 -5.581 2.698 1.00 . A A . 27 VAL HA 1 1
6 3130 1 1 27 VAL HB H 4.455 -7.731 4.779 1.00 . A A . 27 VAL HB 1 1
6 3131 1 1 27 VAL HG11 H 6.460 -6.607 2.714 1.00 . A A . 27 VAL HG11 1 1
6 3132 1 1 27 VAL HG12 H 6.153 -8.329 3.176 1.00 . A A . 27 VAL HG12 1 1
6 3133 1 1 27 VAL HG13 H 6.978 -7.217 4.323 1.00 . A A . 27 VAL HG13 1 1
6 3134 1 1 27 VAL HG21 H 3.988 -5.332 5.474 1.00 . A A . 27 VAL HG21 1 1
6 3135 1 1 27 VAL HG22 H 5.369 -4.781 4.457 1.00 . A A . 27 VAL HG22 1 1
6 3136 1 1 27 VAL HG23 H 5.664 -5.841 5.886 1.00 . A A . 27 VAL HG23 1 1
6 3137 1 1 27 VAL N N 2.449 -6.610 3.643 1.00 . A A . 27 VAL N 1 1
6 3138 1 1 27 VAL O O 3.497 -8.683 2.015 1.00 . A A . 27 VAL O 1 1
6 3139 1 1 28 LEU C C 6.193 -8.012 -0.476 1.00 . A A . 28 LEU C 1 1
6 3140 1 1 28 LEU CA C 4.684 -7.872 -0.364 1.00 . A A . 28 LEU CA 1 1
6 3141 1 1 28 LEU CB C 4.005 -7.298 -1.645 1.00 . A A . 28 LEU CB 1 1
6 3142 1 1 28 LEU CD1 C 4.991 -9.096 -3.228 1.00 . A A . 28 LEU CD1 1 1
6 3143 1 1 28 LEU CD2 C 3.742 -7.126 -4.180 1.00 . A A . 28 LEU CD2 1 1
6 3144 1 1 28 LEU CG C 4.642 -7.611 -3.027 1.00 . A A . 28 LEU CG 1 1
6 3145 1 1 28 LEU H H 4.601 -6.060 0.687 1.00 . A A . 28 LEU H 1 1
6 3146 1 1 28 LEU HA H 4.312 -8.878 -0.212 1.00 . A A . 28 LEU HA 1 1
6 3147 1 1 28 LEU HB2 H 2.956 -7.670 -1.645 1.00 . A A . 28 LEU HB2 1 1
6 3148 1 1 28 LEU HB3 H 3.944 -6.196 -1.520 1.00 . A A . 28 LEU HB3 1 1
6 3149 1 1 28 LEU HD11 H 4.501 -9.528 -4.121 1.00 . A A . 28 LEU HD11 1 1
6 3150 1 1 28 LEU HD12 H 4.679 -9.696 -2.348 1.00 . A A . 28 LEU HD12 1 1
6 3151 1 1 28 LEU HD13 H 6.090 -9.213 -3.344 1.00 . A A . 28 LEU HD13 1 1
6 3152 1 1 28 LEU HD21 H 2.740 -6.841 -3.795 1.00 . A A . 28 LEU HD21 1 1
6 3153 1 1 28 LEU HD22 H 3.593 -7.913 -4.946 1.00 . A A . 28 LEU HD22 1 1
6 3154 1 1 28 LEU HD23 H 4.193 -6.252 -4.694 1.00 . A A . 28 LEU HD23 1 1
6 3155 1 1 28 LEU HG H 5.600 -7.036 -3.084 1.00 . A A . 28 LEU HG 1 1
6 3156 1 1 28 LEU N N 4.363 -7.027 0.768 1.00 . A A . 28 LEU N 1 1
6 3157 1 1 28 LEU O O 6.731 -9.073 -0.787 1.00 . A A . 28 LEU O 1 1
6 3158 1 1 29 ASN C C 8.933 -5.997 0.730 1.00 . A A . 29 ASN C 1 1
6 3159 1 1 29 ASN CA C 8.398 -7.038 -0.258 1.00 . A A . 29 ASN CA 1 1
6 3160 1 1 29 ASN CB C 8.844 -6.958 -1.773 1.00 . A A . 29 ASN CB 1 1
6 3161 1 1 29 ASN CG C 8.963 -5.563 -2.376 1.00 . A A . 29 ASN CG 1 1
6 3162 1 1 29 ASN H H 6.574 -6.091 0.162 1.00 . A A . 29 ASN H 1 1
6 3163 1 1 29 ASN HA H 8.691 -8.002 0.143 1.00 . A A . 29 ASN HA 1 1
6 3164 1 1 29 ASN HB2 H 9.844 -7.425 -1.871 1.00 . A A . 29 ASN HB2 1 1
6 3165 1 1 29 ASN HB3 H 8.142 -7.569 -2.376 1.00 . A A . 29 ASN HB3 1 1
6 3166 1 1 29 ASN HD21 H 8.276 -6.131 -4.220 1.00 . A A . 29 ASN HD21 1 1
6 3167 1 1 29 ASN HD22 H 8.579 -4.425 -3.971 1.00 . A A . 29 ASN HD22 1 1
6 3168 1 1 29 ASN N N 6.960 -6.955 -0.169 1.00 . A A . 29 ASN N 1 1
6 3169 1 1 29 ASN ND2 N 8.575 -5.372 -3.650 1.00 . A A . 29 ASN ND2 1 1
6 3170 1 1 29 ASN O O 8.136 -5.219 1.258 1.00 . A A . 29 ASN O 1 1
6 3171 1 1 29 ASN OD1 O 9.406 -4.625 -1.733 1.00 . A A . 29 ASN OD1 1 1
6 3172 1 1 30 PRO C C 10.668 -3.533 1.643 1.00 . A A . 30 PRO C 1 1
6 3173 1 1 30 PRO CA C 10.741 -5.000 2.065 1.00 . A A . 30 PRO CA 1 1
6 3174 1 1 30 PRO CB C 12.209 -5.452 2.288 1.00 . A A . 30 PRO CB 1 1
6 3175 1 1 30 PRO CD C 11.269 -6.736 0.434 1.00 . A A . 30 PRO CD 1 1
6 3176 1 1 30 PRO CG C 12.468 -6.667 1.376 1.00 . A A . 30 PRO CG 1 1
6 3177 1 1 30 PRO HA H 10.136 -5.096 2.956 1.00 . A A . 30 PRO HA 1 1
6 3178 1 1 30 PRO HB2 H 12.936 -4.645 2.059 1.00 . A A . 30 PRO HB2 1 1
6 3179 1 1 30 PRO HB3 H 12.357 -5.736 3.352 1.00 . A A . 30 PRO HB3 1 1
6 3180 1 1 30 PRO HD2 H 11.524 -6.293 -0.555 1.00 . A A . 30 PRO HD2 1 1
6 3181 1 1 30 PRO HD3 H 10.940 -7.792 0.303 1.00 . A A . 30 PRO HD3 1 1
6 3182 1 1 30 PRO HG2 H 13.417 -6.563 0.809 1.00 . A A . 30 PRO HG2 1 1
6 3183 1 1 30 PRO HG3 H 12.517 -7.594 1.990 1.00 . A A . 30 PRO HG3 1 1
6 3184 1 1 30 PRO N N 10.227 -5.916 1.045 1.00 . A A . 30 PRO N 1 1
6 3185 1 1 30 PRO O O 10.936 -2.665 2.462 1.00 . A A . 30 PRO O 1 1
6 3186 1 1 31 TYR C C 8.933 -1.625 -0.795 1.00 . A A . 31 TYR C 1 1
6 3187 1 1 31 TYR CA C 10.332 -1.945 -0.262 1.00 . A A . 31 TYR CA 1 1
6 3188 1 1 31 TYR CB C 11.394 -1.891 -1.415 1.00 . A A . 31 TYR CB 1 1
6 3189 1 1 31 TYR CD1 C 13.321 -3.228 -0.407 1.00 . A A . 31 TYR CD1 1 1
6 3190 1 1 31 TYR CD2 C 13.651 -0.877 -0.832 1.00 . A A . 31 TYR CD2 1 1
6 3191 1 1 31 TYR CE1 C 14.578 -3.299 0.213 1.00 . A A . 31 TYR CE1 1 1
6 3192 1 1 31 TYR CE2 C 14.910 -0.944 -0.217 1.00 . A A . 31 TYR CE2 1 1
6 3193 1 1 31 TYR CG C 12.810 -2.004 -0.879 1.00 . A A . 31 TYR CG 1 1
6 3194 1 1 31 TYR CZ C 15.365 -2.149 0.316 1.00 . A A . 31 TYR CZ 1 1
6 3195 1 1 31 TYR H H 10.079 -3.991 -0.245 1.00 . A A . 31 TYR H 1 1
6 3196 1 1 31 TYR HA H 10.545 -1.185 0.473 1.00 . A A . 31 TYR HA 1 1
6 3197 1 1 31 TYR HB2 H 11.231 -2.729 -2.126 1.00 . A A . 31 TYR HB2 1 1
6 3198 1 1 31 TYR HB3 H 11.312 -0.938 -1.979 1.00 . A A . 31 TYR HB3 1 1
6 3199 1 1 31 TYR HD1 H 12.712 -4.115 -0.470 1.00 . A A . 31 TYR HD1 1 1
6 3200 1 1 31 TYR HD2 H 13.302 0.070 -1.216 1.00 . A A . 31 TYR HD2 1 1
6 3201 1 1 31 TYR HE1 H 14.922 -4.232 0.630 1.00 . A A . 31 TYR HE1 1 1
6 3202 1 1 31 TYR HE2 H 15.529 -0.063 -0.135 1.00 . A A . 31 TYR HE2 1 1
6 3203 1 1 31 TYR HH H 16.887 -3.111 1.012 1.00 . A A . 31 TYR HH 1 1
6 3204 1 1 31 TYR N N 10.338 -3.244 0.375 1.00 . A A . 31 TYR N 1 1
6 3205 1 1 31 TYR O O 8.722 -0.634 -1.494 1.00 . A A . 31 TYR O 1 1
6 3206 1 1 31 TYR OH O 16.630 -2.192 0.930 1.00 . A A . 31 TYR OH 1 1
6 3207 1 1 32 TYR C C 5.569 -3.037 -0.124 1.00 . A A . 32 TYR C 1 1
6 3208 1 1 32 TYR CA C 6.597 -2.366 -1.030 1.00 . A A . 32 TYR CA 1 1
6 3209 1 1 32 TYR CB C 6.561 -2.991 -2.458 1.00 . A A . 32 TYR CB 1 1
6 3210 1 1 32 TYR CD1 C 4.832 -1.580 -3.664 1.00 . A A . 32 TYR CD1 1 1
6 3211 1 1 32 TYR CD2 C 4.374 -3.914 -3.292 1.00 . A A . 32 TYR CD2 1 1
6 3212 1 1 32 TYR CE1 C 3.557 -1.418 -4.229 1.00 . A A . 32 TYR CE1 1 1
6 3213 1 1 32 TYR CE2 C 3.118 -3.769 -3.889 1.00 . A A . 32 TYR CE2 1 1
6 3214 1 1 32 TYR CG C 5.231 -2.818 -3.143 1.00 . A A . 32 TYR CG 1 1
6 3215 1 1 32 TYR CZ C 2.701 -2.516 -4.323 1.00 . A A . 32 TYR CZ 1 1
6 3216 1 1 32 TYR H H 8.088 -3.193 0.198 1.00 . A A . 32 TYR H 1 1
6 3217 1 1 32 TYR HA H 6.318 -1.331 -1.101 1.00 . A A . 32 TYR HA 1 1
6 3218 1 1 32 TYR HB2 H 7.344 -2.542 -3.103 1.00 . A A . 32 TYR HB2 1 1
6 3219 1 1 32 TYR HB3 H 6.757 -4.077 -2.360 1.00 . A A . 32 TYR HB3 1 1
6 3220 1 1 32 TYR HD1 H 5.509 -0.745 -3.622 1.00 . A A . 32 TYR HD1 1 1
6 3221 1 1 32 TYR HD2 H 4.701 -4.871 -2.932 1.00 . A A . 32 TYR HD2 1 1
6 3222 1 1 32 TYR HE1 H 3.238 -0.450 -4.581 1.00 . A A . 32 TYR HE1 1 1
6 3223 1 1 32 TYR HE2 H 2.457 -4.615 -3.995 1.00 . A A . 32 TYR HE2 1 1
6 3224 1 1 32 TYR HH H 1.472 -2.297 -5.799 1.00 . A A . 32 TYR HH 1 1
6 3225 1 1 32 TYR N N 7.915 -2.437 -0.435 1.00 . A A . 32 TYR N 1 1
6 3226 1 1 32 TYR O O 5.470 -4.262 -0.022 1.00 . A A . 32 TYR O 1 1
6 3227 1 1 32 TYR OH O 1.410 -2.386 -4.843 1.00 . A A . 32 TYR OH 1 1
6 3228 1 1 33 SER C C 2.407 -2.340 0.670 1.00 . A A . 33 SER C 1 1
6 3229 1 1 33 SER CA C 3.681 -2.630 1.414 1.00 . A A . 33 SER CA 1 1
6 3230 1 1 33 SER CB C 3.597 -1.863 2.759 1.00 . A A . 33 SER CB 1 1
6 3231 1 1 33 SER H H 4.859 -1.213 0.489 1.00 . A A . 33 SER H 1 1
6 3232 1 1 33 SER HA H 3.757 -3.688 1.606 1.00 . A A . 33 SER HA 1 1
6 3233 1 1 33 SER HB2 H 3.134 -0.867 2.621 1.00 . A A . 33 SER HB2 1 1
6 3234 1 1 33 SER HB3 H 2.953 -2.423 3.472 1.00 . A A . 33 SER HB3 1 1
6 3235 1 1 33 SER HG H 5.000 -0.759 3.541 1.00 . A A . 33 SER HG 1 1
6 3236 1 1 33 SER N N 4.757 -2.207 0.543 1.00 . A A . 33 SER N 1 1
6 3237 1 1 33 SER O O 2.105 -1.203 0.305 1.00 . A A . 33 SER O 1 1
6 3238 1 1 33 SER OG O 4.896 -1.689 3.325 1.00 . A A . 33 SER OG 1 1
6 3239 1 1 34 GLN C C -0.798 -3.206 0.295 1.00 . A A . 34 GLN C 1 1
6 3240 1 1 34 GLN CA C 0.506 -3.320 -0.483 1.00 . A A . 34 GLN CA 1 1
6 3241 1 1 34 GLN CB C 0.570 -4.568 -1.390 1.00 . A A . 34 GLN CB 1 1
6 3242 1 1 34 GLN CD C -0.321 -5.843 -3.383 1.00 . A A . 34 GLN CD 1 1
6 3243 1 1 34 GLN CG C -0.522 -4.637 -2.471 1.00 . A A . 34 GLN CG 1 1
6 3244 1 1 34 GLN H H 1.780 -4.243 0.882 1.00 . A A . 34 GLN H 1 1
6 3245 1 1 34 GLN HA H 0.592 -2.447 -1.113 1.00 . A A . 34 GLN HA 1 1
6 3246 1 1 34 GLN HB2 H 1.564 -4.534 -1.890 1.00 . A A . 34 GLN HB2 1 1
6 3247 1 1 34 GLN HB3 H 0.557 -5.488 -0.765 1.00 . A A . 34 GLN HB3 1 1
6 3248 1 1 34 GLN HE21 H -0.057 -4.649 -5.014 1.00 . A A . 34 GLN HE21 1 1
6 3249 1 1 34 GLN HE22 H -0.022 -6.389 -5.282 1.00 . A A . 34 GLN HE22 1 1
6 3250 1 1 34 GLN HG2 H -1.522 -4.748 -2.004 1.00 . A A . 34 GLN HG2 1 1
6 3251 1 1 34 GLN HG3 H -0.502 -3.697 -3.061 1.00 . A A . 34 GLN HG3 1 1
6 3252 1 1 34 GLN N N 1.625 -3.378 0.408 1.00 . A A . 34 GLN N 1 1
6 3253 1 1 34 GLN NE2 N -0.123 -5.594 -4.693 1.00 . A A . 34 GLN NE2 1 1
6 3254 1 1 34 GLN O O -0.881 -3.547 1.473 1.00 . A A . 34 GLN O 1 1
6 3255 1 1 34 GLN OE1 O -0.367 -6.995 -2.963 1.00 . A A . 34 GLN OE1 1 1
6 3256 1 1 35 CYS C C -4.053 -3.820 -0.323 1.00 . A A . 35 CYS C 1 1
6 3257 1 1 35 CYS CA C -3.206 -2.678 0.193 1.00 . A A . 35 CYS CA 1 1
6 3258 1 1 35 CYS CB C -3.920 -1.366 -0.202 1.00 . A A . 35 CYS CB 1 1
6 3259 1 1 35 CYS H H -1.705 -2.276 -1.248 1.00 . A A . 35 CYS H 1 1
6 3260 1 1 35 CYS HA H -3.163 -2.816 1.261 1.00 . A A . 35 CYS HA 1 1
6 3261 1 1 35 CYS HB2 H -3.612 -1.119 -1.238 1.00 . A A . 35 CYS HB2 1 1
6 3262 1 1 35 CYS HB3 H -5.023 -1.461 -0.192 1.00 . A A . 35 CYS HB3 1 1
6 3263 1 1 35 CYS N N -1.858 -2.691 -0.347 1.00 . A A . 35 CYS N 1 1
6 3264 1 1 35 CYS O O -4.391 -3.874 -1.502 1.00 . A A . 35 CYS O 1 1
6 3265 1 1 35 CYS SG S -3.477 0.007 0.865 1.00 . A A . 35 CYS SG 1 1
6 3266 1 1 36 LEU C C -6.585 -6.029 0.574 1.00 . A A . 36 LEU C 1 1
6 3267 1 1 36 LEU CA C -5.112 -5.976 0.148 1.00 . A A . 36 LEU CA 1 1
6 3268 1 1 36 LEU CB C -4.412 -7.211 0.743 1.00 . A A . 36 LEU CB 1 1
6 3269 1 1 36 LEU CD1 C -3.129 -7.591 -1.401 1.00 . A A . 36 LEU CD1 1 1
6 3270 1 1 36 LEU CD2 C -1.959 -6.516 0.551 1.00 . A A . 36 LEU CD2 1 1
6 3271 1 1 36 LEU CG C -3.036 -7.520 0.129 1.00 . A A . 36 LEU CG 1 1
6 3272 1 1 36 LEU H H -4.159 -4.729 1.510 1.00 . A A . 36 LEU H 1 1
6 3273 1 1 36 LEU HA H -5.123 -6.052 -0.925 1.00 . A A . 36 LEU HA 1 1
6 3274 1 1 36 LEU HB2 H -4.317 -7.072 1.843 1.00 . A A . 36 LEU HB2 1 1
6 3275 1 1 36 LEU HB3 H -5.061 -8.102 0.582 1.00 . A A . 36 LEU HB3 1 1
6 3276 1 1 36 LEU HD11 H -4.055 -8.117 -1.710 1.00 . A A . 36 LEU HD11 1 1
6 3277 1 1 36 LEU HD12 H -2.251 -8.128 -1.815 1.00 . A A . 36 LEU HD12 1 1
6 3278 1 1 36 LEU HD13 H -3.143 -6.565 -1.828 1.00 . A A . 36 LEU HD13 1 1
6 3279 1 1 36 LEU HD21 H -2.115 -6.204 1.606 1.00 . A A . 36 LEU HD21 1 1
6 3280 1 1 36 LEU HD22 H -2.022 -5.606 -0.070 1.00 . A A . 36 LEU HD22 1 1
6 3281 1 1 36 LEU HD23 H -0.942 -6.942 0.431 1.00 . A A . 36 LEU HD23 1 1
6 3282 1 1 36 LEU HG H -2.734 -8.521 0.523 1.00 . A A . 36 LEU HG 1 1
6 3283 1 1 36 LEU N N -4.443 -4.757 0.544 1.00 . A A . 36 LEU N 1 1
6 3284 1 1 36 LEU O O -7.459 -5.881 -0.315 1.00 . A A . 36 LEU O 1 1
6 3285 1 1 36 LEU OXT O -6.859 -6.231 1.781 1.00 . A A . 36 LEU OXT 1 1
6 3286 2 2 1 MAN C1 C -9.384 4.131 -0.164 1.00 . B A . 101 MAN C1 1 1
6 3287 2 2 1 MAN C2 C -8.572 4.358 -1.408 1.00 . B A . 101 MAN C2 1 1
6 3288 2 2 1 MAN C3 C -8.645 5.806 -1.784 1.00 . B A . 101 MAN C3 1 1
6 3289 2 2 1 MAN C4 C -10.080 6.209 -2.000 1.00 . B A . 101 MAN C4 1 1
6 3290 2 2 1 MAN C5 C -10.965 5.765 -0.828 1.00 . B A . 101 MAN C5 1 1
6 3291 2 2 1 MAN C6 C -12.437 5.954 -1.126 1.00 . B A . 101 MAN C6 1 1
6 3292 2 2 1 MAN H1 H -9.297 3.067 0.076 1.00 . B A . 101 MAN H1 1 1
6 3293 2 2 1 MAN H2 H -7.536 4.138 -1.151 1.00 . B A . 101 MAN H2 1 1
6 3294 2 2 1 MAN H3 H -8.274 6.404 -0.925 1.00 . B A . 101 MAN H3 1 1
6 3295 2 2 1 MAN H4 H -10.443 5.699 -2.925 1.00 . B A . 101 MAN H4 1 1
6 3296 2 2 1 MAN H5 H -10.723 6.389 0.063 1.00 . B A . 101 MAN H5 1 1
6 3297 2 2 1 MAN H61 H -12.720 5.308 -1.990 1.00 . B A . 101 MAN H61 1 1
6 3298 2 2 1 MAN H62 H -12.623 7.016 -1.407 1.00 . B A . 101 MAN H62 1 1
6 3299 2 2 1 MAN HO2 H -8.208 3.590 -3.159 1.00 . B A . 101 MAN HO2 1 1
6 3300 2 2 1 MAN HO3 H -7.458 6.987 -2.862 1.00 . B A . 101 MAN HO3 1 1
6 3301 2 2 1 MAN HO4 H -10.424 7.829 -3.067 1.00 . B A . 101 MAN HO4 1 1
6 3302 2 2 1 MAN HO6 H -14.181 5.563 -0.263 1.00 . B A . 101 MAN HO6 1 1
6 3303 2 2 1 MAN O1 O -8.946 4.946 0.955 1.00 . B A . 101 MAN O1 1 1
6 3304 2 2 1 MAN O2 O -8.886 3.466 -2.480 1.00 . B A . 101 MAN O2 1 1
6 3305 2 2 1 MAN O3 O -7.786 6.079 -2.890 1.00 . B A . 101 MAN O3 1 1
6 3306 2 2 1 MAN O4 O -10.173 7.621 -2.158 1.00 . B A . 101 MAN O4 1 1
6 3307 2 2 1 MAN O5 O -10.748 4.389 -0.470 1.00 . B A . 101 MAN O5 1 1
6 3308 2 2 1 MAN O6 O -13.257 5.637 0.002 1.00 . B A . 101 MAN O6 1 1
6 3309 3 2 1 MAN C1 C -6.025 3.101 -6.759 1.00 . C A . 102 MAN C1 1 1
6 3310 3 2 1 MAN C2 C -5.017 2.222 -7.486 1.00 . C A . 102 MAN C2 1 1
6 3311 3 2 1 MAN C3 C -3.701 2.303 -6.724 1.00 . C A . 102 MAN C3 1 1
6 3312 3 2 1 MAN C4 C -3.220 3.751 -6.753 1.00 . C A . 102 MAN C4 1 1
6 3313 3 2 1 MAN C5 C -4.303 4.678 -6.191 1.00 . C A . 102 MAN C5 1 1
6 3314 3 2 1 MAN C6 C -3.965 6.146 -6.343 1.00 . C A . 102 MAN C6 1 1
6 3315 3 2 1 MAN H1 H -7.017 3.038 -7.262 1.00 . C A . 102 MAN H1 1 1
6 3316 3 2 1 MAN H2 H -5.358 1.165 -7.482 1.00 . C A . 102 MAN H2 1 1
6 3317 3 2 1 MAN H3 H -3.891 2.044 -5.658 1.00 . C A . 102 MAN H3 1 1
6 3318 3 2 1 MAN H4 H -3.047 4.032 -7.820 1.00 . C A . 102 MAN H4 1 1
6 3319 3 2 1 MAN H5 H -4.400 4.479 -5.097 1.00 . C A . 102 MAN H5 1 1
6 3320 3 2 1 MAN H61 H -3.863 6.399 -7.423 1.00 . C A . 102 MAN H61 1 1
6 3321 3 2 1 MAN H62 H -2.994 6.375 -5.847 1.00 . C A . 102 MAN H62 1 1
6 3322 3 2 1 MAN HO2 H -5.533 2.156 -9.428 1.00 . C A . 102 MAN HO2 1 1
6 3323 3 2 1 MAN HO3 H -3.044 0.459 -7.165 1.00 . C A . 102 MAN HO3 1 1
6 3324 3 2 1 MAN HO4 H -2.040 3.697 -5.151 1.00 . C A . 102 MAN HO4 1 1
6 3325 3 2 1 MAN HO6 H -5.819 6.694 -6.157 1.00 . C A . 102 MAN HO6 1 1
6 3326 3 2 1 MAN O1 O -6.159 2.756 -5.366 1.00 . C A . 102 MAN O1 1 1
6 3327 3 2 1 MAN O2 O -4.882 2.584 -8.864 1.00 . C A . 102 MAN O2 1 1
6 3328 3 2 1 MAN O3 O -2.724 1.365 -7.182 1.00 . C A . 102 MAN O3 1 1
6 3329 3 2 1 MAN O4 O -1.984 3.954 -6.068 1.00 . C A . 102 MAN O4 1 1
6 3330 3 2 1 MAN O5 O -5.594 4.465 -6.810 1.00 . C A . 102 MAN O5 1 1
6 3331 3 2 1 MAN O6 O -4.984 6.959 -5.755 1.00 . C A . 102 MAN O6 1 1
6 3332 4 2 1 MAN C1 C 7.590 11.473 -0.193 1.00 . D A . 103 MAN C1 1 1
6 3333 4 2 1 MAN C2 C 7.657 11.722 -1.689 1.00 . D A . 103 MAN C2 1 1
6 3334 4 2 1 MAN C3 C 8.402 10.550 -2.310 1.00 . D A . 103 MAN C3 1 1
6 3335 4 2 1 MAN C4 C 9.806 10.482 -1.716 1.00 . D A . 103 MAN C4 1 1
6 3336 4 2 1 MAN C5 C 9.720 10.392 -0.190 1.00 . D A . 103 MAN C5 1 1
6 3337 4 2 1 MAN C6 C 11.078 10.465 0.480 1.00 . D A . 103 MAN C6 1 1
6 3338 4 2 1 MAN H1 H 7.035 12.298 0.307 1.00 . D A . 103 MAN H1 1 1
6 3339 4 2 1 MAN H2 H 6.631 11.754 -2.111 1.00 . D A . 103 MAN H2 1 1
6 3340 4 2 1 MAN H3 H 7.892 9.603 -2.015 1.00 . D A . 103 MAN H3 1 1
6 3341 4 2 1 MAN H4 H 10.344 11.426 -1.973 1.00 . D A . 103 MAN H4 1 1
6 3342 4 2 1 MAN H5 H 9.259 9.411 0.080 1.00 . D A . 103 MAN H5 1 1
6 3343 4 2 1 MAN H61 H 11.563 11.438 0.240 1.00 . D A . 103 MAN H61 1 1
6 3344 4 2 1 MAN H62 H 11.739 9.652 0.101 1.00 . D A . 103 MAN H62 1 1
6 3345 4 2 1 MAN HO2 H 7.771 13.713 -1.597 1.00 . D A . 103 MAN HO2 1 1
6 3346 4 2 1 MAN HO3 H 7.881 11.363 -4.030 1.00 . D A . 103 MAN HO3 1 1
6 3347 4 2 1 MAN HO4 H 10.032 8.595 -2.235 1.00 . D A . 103 MAN HO4 1 1
6 3348 4 2 1 MAN HO6 H 10.271 10.926 2.198 1.00 . D A . 103 MAN HO6 1 1
6 3349 4 2 1 MAN O1 O 6.912 10.238 0.076 1.00 . D A . 103 MAN O1 1 1
6 3350 4 2 1 MAN O2 O 8.238 12.988 -2.027 1.00 . D A . 103 MAN O2 1 1
6 3351 4 2 1 MAN O3 O 8.345 10.573 -3.737 1.00 . D A . 103 MAN O3 1 1
6 3352 4 2 1 MAN O4 O 10.576 9.393 -2.222 1.00 . D A . 103 MAN O4 1 1
6 3353 4 2 1 MAN O5 O 8.910 11.453 0.360 1.00 . D A . 103 MAN O5 1 1
6 3354 4 2 1 MAN O6 O 10.969 10.331 1.897 1.00 . D A . 103 MAN O6 1 1
7 3355 1 1 1 THR C C -5.752 5.105 0.838 1.00 . A A . 1 THR C 1 1
7 3356 1 1 1 THR CA C -6.562 5.245 2.095 1.00 . A A . 1 THR CA 1 1
7 3357 1 1 1 THR CB C -7.704 4.185 2.077 1.00 . A A . 1 THR CB 1 1
7 3358 1 1 1 THR CG2 C -8.094 3.829 3.505 1.00 . A A . 1 THR CG2 1 1
7 3359 1 1 1 THR H1 H -7.245 6.914 3.250 1.00 . A A . 1 THR H1 1 1
7 3360 1 1 1 THR H2 H -8.148 6.539 1.871 1.00 . A A . 1 THR H2 1 1
7 3361 1 1 1 THR H3 H -6.645 7.313 1.684 1.00 . A A . 1 THR H3 1 1
7 3362 1 1 1 THR HA H -5.889 5.084 2.918 1.00 . A A . 1 THR HA 1 1
7 3363 1 1 1 THR HB H -7.429 3.257 1.537 1.00 . A A . 1 THR HB 1 1
7 3364 1 1 1 THR HG21 H -8.959 3.133 3.536 1.00 . A A . 1 THR HG21 1 1
7 3365 1 1 1 THR HG22 H -8.335 4.713 4.124 1.00 . A A . 1 THR HG22 1 1
7 3366 1 1 1 THR HG23 H -7.242 3.304 3.984 1.00 . A A . 1 THR HG23 1 1
7 3367 1 1 1 THR N N -7.175 6.621 2.258 1.00 . A A . 1 THR N 1 1
7 3368 1 1 1 THR O O -5.622 6.093 0.135 1.00 . A A . 1 THR O 1 1
7 3369 1 1 2 GLN C C -5.635 2.536 -1.454 1.00 . A A . 2 GLN C 1 1
7 3370 1 1 2 GLN CA C -4.738 3.554 -0.803 1.00 . A A . 2 GLN CA 1 1
7 3371 1 1 2 GLN CB C -3.336 2.916 -0.775 1.00 . A A . 2 GLN CB 1 1
7 3372 1 1 2 GLN CD C -2.265 5.025 -1.468 1.00 . A A . 2 GLN CD 1 1
7 3373 1 1 2 GLN CG C -2.481 3.581 -1.863 1.00 . A A . 2 GLN CG 1 1
7 3374 1 1 2 GLN H H -5.175 3.163 1.189 1.00 . A A . 2 GLN H 1 1
7 3375 1 1 2 GLN HA H -4.757 4.432 -1.438 1.00 . A A . 2 GLN HA 1 1
7 3376 1 1 2 GLN HB2 H -2.892 3.061 0.238 1.00 . A A . 2 GLN HB2 1 1
7 3377 1 1 2 GLN HB3 H -3.330 1.816 -0.940 1.00 . A A . 2 GLN HB3 1 1
7 3378 1 1 2 GLN HE21 H -1.063 4.383 0.057 1.00 . A A . 2 GLN HE21 1 1
7 3379 1 1 2 GLN HE22 H -1.391 6.093 0.024 1.00 . A A . 2 GLN HE22 1 1
7 3380 1 1 2 GLN HG2 H -1.501 3.106 -1.963 1.00 . A A . 2 GLN HG2 1 1
7 3381 1 1 2 GLN HG3 H -2.974 3.555 -2.855 1.00 . A A . 2 GLN HG3 1 1
7 3382 1 1 2 GLN N N -5.233 3.901 0.513 1.00 . A A . 2 GLN N 1 1
7 3383 1 1 2 GLN NE2 N -1.492 5.187 -0.377 1.00 . A A . 2 GLN NE2 1 1
7 3384 1 1 2 GLN O O -6.371 1.812 -0.785 1.00 . A A . 2 GLN O 1 1
7 3385 1 1 2 GLN OE1 O -2.762 5.975 -2.057 1.00 . A A . 2 GLN OE1 1 1
7 3386 1 1 3 SER C C -6.042 0.186 -3.476 1.00 . A A . 3 SER C 1 1
7 3387 1 1 3 SER CA C -6.460 1.625 -3.589 1.00 . A A . 3 SER CA 1 1
7 3388 1 1 3 SER CB C -6.440 2.006 -5.087 1.00 . A A . 3 SER CB 1 1
7 3389 1 1 3 SER H H -5.092 3.150 -3.332 1.00 . A A . 3 SER H 1 1
7 3390 1 1 3 SER HA H -7.469 1.700 -3.223 1.00 . A A . 3 SER HA 1 1
7 3391 1 1 3 SER HB2 H -5.843 1.290 -5.691 1.00 . A A . 3 SER HB2 1 1
7 3392 1 1 3 SER HB3 H -7.472 2.088 -5.492 1.00 . A A . 3 SER HB3 1 1
7 3393 1 1 3 SER N N -5.637 2.507 -2.790 1.00 . A A . 3 SER N 1 1
7 3394 1 1 3 SER O O -4.956 -0.132 -3.002 1.00 . A A . 3 SER O 1 1
7 3395 1 1 4 HIS C C -5.300 -2.317 -4.914 1.00 . A A . 4 HIS C 1 1
7 3396 1 1 4 HIS CA C -6.516 -2.150 -4.031 1.00 . A A . 4 HIS CA 1 1
7 3397 1 1 4 HIS CB C -7.647 -3.021 -4.628 1.00 . A A . 4 HIS CB 1 1
7 3398 1 1 4 HIS CD2 C -6.509 -5.211 -3.768 1.00 . A A . 4 HIS CD2 1 1
7 3399 1 1 4 HIS CE1 C -8.247 -6.537 -3.961 1.00 . A A . 4 HIS CE1 1 1
7 3400 1 1 4 HIS CG C -7.528 -4.491 -4.306 1.00 . A A . 4 HIS CG 1 1
7 3401 1 1 4 HIS H H -7.762 -0.482 -4.346 1.00 . A A . 4 HIS H 1 1
7 3402 1 1 4 HIS HA H -6.257 -2.486 -3.035 1.00 . A A . 4 HIS HA 1 1
7 3403 1 1 4 HIS HB2 H -8.605 -2.660 -4.195 1.00 . A A . 4 HIS HB2 1 1
7 3404 1 1 4 HIS HB3 H -7.708 -2.888 -5.732 1.00 . A A . 4 HIS HB3 1 1
7 3405 1 1 4 HIS HD1 H -9.527 -5.101 -4.694 1.00 . A A . 4 HIS HD1 1 1
7 3406 1 1 4 HIS HD2 H -5.530 -4.896 -3.427 1.00 . A A . 4 HIS HD2 1 1
7 3407 1 1 4 HIS HE1 H -8.868 -7.410 -3.906 1.00 . A A . 4 HIS HE1 1 1
7 3408 1 1 4 HIS HE2 H -6.561 -7.160 -2.974 1.00 . A A . 4 HIS HE2 1 1
7 3409 1 1 4 HIS N N -6.888 -0.746 -3.955 1.00 . A A . 4 HIS N 1 1
7 3410 1 1 4 HIS ND1 N -8.590 -5.339 -4.429 1.00 . A A . 4 HIS ND1 1 1
7 3411 1 1 4 HIS NE2 N -6.984 -6.475 -3.582 1.00 . A A . 4 HIS NE2 1 1
7 3412 1 1 4 HIS O O -5.254 -1.797 -6.023 1.00 . A A . 4 HIS O 1 1
7 3413 1 1 5 TYR C C -2.159 -2.014 -5.076 1.00 . A A . 5 TYR C 1 1
7 3414 1 1 5 TYR CA C -3.011 -3.265 -5.006 1.00 . A A . 5 TYR CA 1 1
7 3415 1 1 5 TYR CB C -3.086 -3.948 -6.393 1.00 . A A . 5 TYR CB 1 1
7 3416 1 1 5 TYR CD1 C -3.730 -6.323 -5.784 1.00 . A A . 5 TYR CD1 1 1
7 3417 1 1 5 TYR CD2 C -5.332 -4.916 -6.933 1.00 . A A . 5 TYR CD2 1 1
7 3418 1 1 5 TYR CE1 C -4.667 -7.367 -5.769 1.00 . A A . 5 TYR CE1 1 1
7 3419 1 1 5 TYR CE2 C -6.272 -5.949 -6.907 1.00 . A A . 5 TYR CE2 1 1
7 3420 1 1 5 TYR CG C -4.061 -5.087 -6.364 1.00 . A A . 5 TYR CG 1 1
7 3421 1 1 5 TYR CZ C -5.935 -7.178 -6.330 1.00 . A A . 5 TYR CZ 1 1
7 3422 1 1 5 TYR H H -4.343 -3.345 -3.435 1.00 . A A . 5 TYR H 1 1
7 3423 1 1 5 TYR HA H -2.510 -3.945 -4.338 1.00 . A A . 5 TYR HA 1 1
7 3424 1 1 5 TYR HB2 H -3.400 -3.216 -7.168 1.00 . A A . 5 TYR HB2 1 1
7 3425 1 1 5 TYR HB3 H -2.091 -4.348 -6.686 1.00 . A A . 5 TYR HB3 1 1
7 3426 1 1 5 TYR HD1 H -2.752 -6.474 -5.345 1.00 . A A . 5 TYR HD1 1 1
7 3427 1 1 5 TYR HD2 H -5.587 -3.961 -7.371 1.00 . A A . 5 TYR HD2 1 1
7 3428 1 1 5 TYR HE1 H -4.418 -8.311 -5.305 1.00 . A A . 5 TYR HE1 1 1
7 3429 1 1 5 TYR HE2 H -7.262 -5.777 -7.300 1.00 . A A . 5 TYR HE2 1 1
7 3430 1 1 5 TYR HH H -7.668 -7.913 -6.749 1.00 . A A . 5 TYR HH 1 1
7 3431 1 1 5 TYR N N -4.281 -2.995 -4.380 1.00 . A A . 5 TYR N 1 1
7 3432 1 1 5 TYR O O -1.150 -1.992 -5.762 1.00 . A A . 5 TYR O 1 1
7 3433 1 1 5 TYR OH O -6.919 -8.177 -6.212 1.00 . A A . 5 TYR OH 1 1
7 3434 1 1 6 GLY C C -0.746 0.084 -3.098 1.00 . A A . 6 GLY C 1 1
7 3435 1 1 6 GLY CA C -1.739 0.267 -4.198 1.00 . A A . 6 GLY CA 1 1
7 3436 1 1 6 GLY H H -3.397 -0.972 -3.840 1.00 . A A . 6 GLY H 1 1
7 3437 1 1 6 GLY HA2 H -1.187 0.459 -5.109 1.00 . A A . 6 GLY HA2 1 1
7 3438 1 1 6 GLY HA3 H -2.404 1.069 -3.914 1.00 . A A . 6 GLY HA3 1 1
7 3439 1 1 6 GLY N N -2.537 -0.939 -4.351 1.00 . A A . 6 GLY N 1 1
7 3440 1 1 6 GLY O O -0.453 -1.033 -2.692 1.00 . A A . 6 GLY O 1 1
7 3441 1 1 7 GLN C C 0.359 1.763 -0.221 1.00 . A A . 7 GLN C 1 1
7 3442 1 1 7 GLN CA C 0.805 1.125 -1.533 1.00 . A A . 7 GLN CA 1 1
7 3443 1 1 7 GLN CB C 2.018 1.909 -2.044 1.00 . A A . 7 GLN CB 1 1
7 3444 1 1 7 GLN CD C 4.543 1.788 -1.883 1.00 . A A . 7 GLN CD 1 1
7 3445 1 1 7 GLN CG C 3.228 1.741 -1.117 1.00 . A A . 7 GLN CG 1 1
7 3446 1 1 7 GLN H H -0.387 2.078 -2.938 1.00 . A A . 7 GLN H 1 1
7 3447 1 1 7 GLN HA H 1.106 0.108 -1.335 1.00 . A A . 7 GLN HA 1 1
7 3448 1 1 7 GLN HB2 H 2.247 1.533 -3.063 1.00 . A A . 7 GLN HB2 1 1
7 3449 1 1 7 GLN HB3 H 1.768 2.979 -2.177 1.00 . A A . 7 GLN HB3 1 1
7 3450 1 1 7 GLN HE21 H 5.391 0.784 -0.363 1.00 . A A . 7 GLN HE21 1 1
7 3451 1 1 7 GLN HE22 H 6.400 1.006 -1.804 1.00 . A A . 7 GLN HE22 1 1
7 3452 1 1 7 GLN HG2 H 3.230 2.497 -0.311 1.00 . A A . 7 GLN HG2 1 1
7 3453 1 1 7 GLN HG3 H 3.142 0.743 -0.641 1.00 . A A . 7 GLN HG3 1 1
7 3454 1 1 7 GLN N N -0.197 1.174 -2.569 1.00 . A A . 7 GLN N 1 1
7 3455 1 1 7 GLN NE2 N 5.563 1.145 -1.281 1.00 . A A . 7 GLN NE2 1 1
7 3456 1 1 7 GLN O O -0.016 2.924 -0.173 1.00 . A A . 7 GLN O 1 1
7 3457 1 1 7 GLN OE1 O 4.681 2.307 -2.985 1.00 . A A . 7 GLN OE1 1 1
7 3458 1 1 8 CYS C C 1.382 1.866 3.018 1.00 . A A . 8 CYS C 1 1
7 3459 1 1 8 CYS CA C 0.124 1.647 2.216 1.00 . A A . 8 CYS CA 1 1
7 3460 1 1 8 CYS CB C -0.769 0.714 3.054 1.00 . A A . 8 CYS CB 1 1
7 3461 1 1 8 CYS H H 0.672 0.083 0.892 1.00 . A A . 8 CYS H 1 1
7 3462 1 1 8 CYS HA H -0.353 2.614 2.125 1.00 . A A . 8 CYS HA 1 1
7 3463 1 1 8 CYS HB2 H -0.851 1.060 4.109 1.00 . A A . 8 CYS HB2 1 1
7 3464 1 1 8 CYS HB3 H -1.782 0.833 2.624 1.00 . A A . 8 CYS HB3 1 1
7 3465 1 1 8 CYS N N 0.395 1.047 0.909 1.00 . A A . 8 CYS N 1 1
7 3466 1 1 8 CYS O O 1.361 2.475 4.081 1.00 . A A . 8 CYS O 1 1
7 3467 1 1 8 CYS SG S -0.203 -1.028 2.964 1.00 . A A . 8 CYS SG 1 1
7 3468 1 1 9 GLY C C 4.852 1.159 2.213 1.00 . A A . 9 GLY C 1 1
7 3469 1 1 9 GLY CA C 3.785 1.478 3.201 1.00 . A A . 9 GLY CA 1 1
7 3470 1 1 9 GLY H H 2.501 0.864 1.654 1.00 . A A . 9 GLY H 1 1
7 3471 1 1 9 GLY HA2 H 3.928 2.489 3.556 1.00 . A A . 9 GLY HA2 1 1
7 3472 1 1 9 GLY HA3 H 3.815 0.724 3.977 1.00 . A A . 9 GLY HA3 1 1
7 3473 1 1 9 GLY N N 2.516 1.374 2.513 1.00 . A A . 9 GLY N 1 1
7 3474 1 1 9 GLY O O 4.630 0.451 1.236 1.00 . A A . 9 GLY O 1 1
7 3475 1 1 10 GLY C C 8.385 1.879 2.080 1.00 . A A . 10 GLY C 1 1
7 3476 1 1 10 GLY CA C 7.148 1.346 1.487 1.00 . A A . 10 GLY CA 1 1
7 3477 1 1 10 GLY H H 6.296 2.261 3.164 1.00 . A A . 10 GLY H 1 1
7 3478 1 1 10 GLY HA2 H 7.242 0.274 1.376 1.00 . A A . 10 GLY HA2 1 1
7 3479 1 1 10 GLY HA3 H 7.012 1.894 0.571 1.00 . A A . 10 GLY HA3 1 1
7 3480 1 1 10 GLY N N 6.064 1.666 2.390 1.00 . A A . 10 GLY N 1 1
7 3481 1 1 10 GLY O O 8.325 2.641 3.034 1.00 . A A . 10 GLY O 1 1
7 3482 1 1 11 ILE C C 10.872 3.634 1.586 1.00 . A A . 11 ILE C 1 1
7 3483 1 1 11 ILE CA C 10.812 2.138 1.882 1.00 . A A . 11 ILE CA 1 1
7 3484 1 1 11 ILE CB C 11.973 1.352 1.273 1.00 . A A . 11 ILE CB 1 1
7 3485 1 1 11 ILE CD1 C 13.439 0.341 3.169 1.00 . A A . 11 ILE CD1 1 1
7 3486 1 1 11 ILE CG1 C 12.291 0.130 2.174 1.00 . A A . 11 ILE CG1 1 1
7 3487 1 1 11 ILE CG2 C 13.216 2.233 1.003 1.00 . A A . 11 ILE CG2 1 1
7 3488 1 1 11 ILE H H 9.556 0.899 0.733 1.00 . A A . 11 ILE H 1 1
7 3489 1 1 11 ILE HA H 10.900 2.068 2.958 1.00 . A A . 11 ILE HA 1 1
7 3490 1 1 11 ILE HB H 11.629 0.961 0.286 1.00 . A A . 11 ILE HB 1 1
7 3491 1 1 11 ILE HD11 H 13.500 -0.516 3.873 1.00 . A A . 11 ILE HD11 1 1
7 3492 1 1 11 ILE HD12 H 13.297 1.274 3.754 1.00 . A A . 11 ILE HD12 1 1
7 3493 1 1 11 ILE HD13 H 14.411 0.398 2.632 1.00 . A A . 11 ILE HD13 1 1
7 3494 1 1 11 ILE HG12 H 11.377 -0.181 2.728 1.00 . A A . 11 ILE HG12 1 1
7 3495 1 1 11 ILE HG13 H 12.578 -0.730 1.532 1.00 . A A . 11 ILE HG13 1 1
7 3496 1 1 11 ILE HG21 H 14.081 1.607 0.712 1.00 . A A . 11 ILE HG21 1 1
7 3497 1 1 11 ILE HG22 H 13.498 2.801 1.916 1.00 . A A . 11 ILE HG22 1 1
7 3498 1 1 11 ILE HG23 H 13.029 2.955 0.182 1.00 . A A . 11 ILE HG23 1 1
7 3499 1 1 11 ILE N N 9.541 1.532 1.501 1.00 . A A . 11 ILE N 1 1
7 3500 1 1 11 ILE O O 11.412 4.426 2.351 1.00 . A A . 11 ILE O 1 1
7 3501 1 1 12 GLY C C 8.894 5.809 -0.438 1.00 . A A . 12 GLY C 1 1
7 3502 1 1 12 GLY CA C 10.274 5.426 -0.020 1.00 . A A . 12 GLY CA 1 1
7 3503 1 1 12 GLY H H 9.819 3.375 -0.119 1.00 . A A . 12 GLY H 1 1
7 3504 1 1 12 GLY HA2 H 10.556 6.103 0.776 1.00 . A A . 12 GLY HA2 1 1
7 3505 1 1 12 GLY HA3 H 10.910 5.499 -0.888 1.00 . A A . 12 GLY HA3 1 1
7 3506 1 1 12 GLY N N 10.282 4.045 0.449 1.00 . A A . 12 GLY N 1 1
7 3507 1 1 12 GLY O O 8.672 6.373 -1.504 1.00 . A A . 12 GLY O 1 1
7 3508 1 1 13 TYR C C 6.085 7.040 0.816 1.00 . A A . 13 TYR C 1 1
7 3509 1 1 13 TYR CA C 6.521 5.788 0.069 1.00 . A A . 13 TYR CA 1 1
7 3510 1 1 13 TYR CB C 5.561 4.620 0.392 1.00 . A A . 13 TYR CB 1 1
7 3511 1 1 13 TYR CD1 C 4.161 5.078 -1.617 1.00 . A A . 13 TYR CD1 1 1
7 3512 1 1 13 TYR CD2 C 3.064 5.018 0.547 1.00 . A A . 13 TYR CD2 1 1
7 3513 1 1 13 TYR CE1 C 2.950 5.370 -2.236 1.00 . A A . 13 TYR CE1 1 1
7 3514 1 1 13 TYR CE2 C 1.839 5.261 -0.084 1.00 . A A . 13 TYR CE2 1 1
7 3515 1 1 13 TYR CG C 4.230 4.906 -0.224 1.00 . A A . 13 TYR CG 1 1
7 3516 1 1 13 TYR CZ C 1.793 5.442 -1.475 1.00 . A A . 13 TYR CZ 1 1
7 3517 1 1 13 TYR H H 8.081 5.021 1.254 1.00 . A A . 13 TYR H 1 1
7 3518 1 1 13 TYR HA H 6.454 6.020 -0.985 1.00 . A A . 13 TYR HA 1 1
7 3519 1 1 13 TYR HB2 H 5.937 3.684 -0.065 1.00 . A A . 13 TYR HB2 1 1
7 3520 1 1 13 TYR HB3 H 5.457 4.474 1.490 1.00 . A A . 13 TYR HB3 1 1
7 3521 1 1 13 TYR HD1 H 5.043 4.955 -2.228 1.00 . A A . 13 TYR HD1 1 1
7 3522 1 1 13 TYR HD2 H 3.105 4.902 1.622 1.00 . A A . 13 TYR HD2 1 1
7 3523 1 1 13 TYR HE1 H 2.891 5.473 -3.311 1.00 . A A . 13 TYR HE1 1 1
7 3524 1 1 13 TYR HE2 H 0.952 5.304 0.526 1.00 . A A . 13 TYR HE2 1 1
7 3525 1 1 13 TYR HH H -0.112 5.337 -1.621 1.00 . A A . 13 TYR HH 1 1
7 3526 1 1 13 TYR N N 7.889 5.442 0.372 1.00 . A A . 13 TYR N 1 1
7 3527 1 1 13 TYR O O 6.498 7.290 1.943 1.00 . A A . 13 TYR O 1 1
7 3528 1 1 13 TYR OH O 0.608 5.641 -2.186 1.00 . A A . 13 TYR OH 1 1
7 3529 1 1 14 SER C C 3.284 9.338 0.639 1.00 . A A . 14 SER C 1 1
7 3530 1 1 14 SER CA C 4.763 9.097 0.792 1.00 . A A . 14 SER CA 1 1
7 3531 1 1 14 SER CB C 5.417 10.317 0.120 1.00 . A A . 14 SER CB 1 1
7 3532 1 1 14 SER H H 4.926 7.639 -0.738 1.00 . A A . 14 SER H 1 1
7 3533 1 1 14 SER HA H 4.979 9.104 1.852 1.00 . A A . 14 SER HA 1 1
7 3534 1 1 14 SER HB2 H 4.904 10.574 -0.834 1.00 . A A . 14 SER HB2 1 1
7 3535 1 1 14 SER HB3 H 5.421 11.190 0.809 1.00 . A A . 14 SER HB3 1 1
7 3536 1 1 14 SER N N 5.207 7.847 0.190 1.00 . A A . 14 SER N 1 1
7 3537 1 1 14 SER O O 2.778 10.397 0.999 1.00 . A A . 14 SER O 1 1
7 3538 1 1 15 GLY C C 0.399 8.023 1.185 1.00 . A A . 15 GLY C 1 1
7 3539 1 1 15 GLY CA C 1.094 8.497 -0.072 1.00 . A A . 15 GLY CA 1 1
7 3540 1 1 15 GLY H H 2.950 7.507 -0.181 1.00 . A A . 15 GLY H 1 1
7 3541 1 1 15 GLY HA2 H 0.825 9.531 -0.237 1.00 . A A . 15 GLY HA2 1 1
7 3542 1 1 15 GLY HA3 H 0.797 7.860 -0.887 1.00 . A A . 15 GLY HA3 1 1
7 3543 1 1 15 GLY N N 2.541 8.386 0.049 1.00 . A A . 15 GLY N 1 1
7 3544 1 1 15 GLY O O 1.047 7.711 2.180 1.00 . A A . 15 GLY O 1 1
7 3545 1 1 16 PRO C C -1.207 6.133 3.000 1.00 . A A . 16 PRO C 1 1
7 3546 1 1 16 PRO CA C -1.715 7.391 2.287 1.00 . A A . 16 PRO CA 1 1
7 3547 1 1 16 PRO CB C -3.106 7.172 1.683 1.00 . A A . 16 PRO CB 1 1
7 3548 1 1 16 PRO CD C -1.748 8.406 0.069 1.00 . A A . 16 PRO CD 1 1
7 3549 1 1 16 PRO CG C -3.197 8.124 0.478 1.00 . A A . 16 PRO CG 1 1
7 3550 1 1 16 PRO HA H -1.712 8.164 3.040 1.00 . A A . 16 PRO HA 1 1
7 3551 1 1 16 PRO HB2 H -3.199 6.127 1.309 1.00 . A A . 16 PRO HB2 1 1
7 3552 1 1 16 PRO HB3 H -3.909 7.355 2.422 1.00 . A A . 16 PRO HB3 1 1
7 3553 1 1 16 PRO HD2 H -1.495 7.848 -0.862 1.00 . A A . 16 PRO HD2 1 1
7 3554 1 1 16 PRO HD3 H -1.592 9.493 -0.112 1.00 . A A . 16 PRO HD3 1 1
7 3555 1 1 16 PRO HG2 H -3.741 7.655 -0.373 1.00 . A A . 16 PRO HG2 1 1
7 3556 1 1 16 PRO HG3 H -3.704 9.071 0.751 1.00 . A A . 16 PRO HG3 1 1
7 3557 1 1 16 PRO N N -0.923 7.934 1.184 1.00 . A A . 16 PRO N 1 1
7 3558 1 1 16 PRO O O -0.901 5.134 2.361 1.00 . A A . 16 PRO O 1 1
7 3559 1 1 17 THR C C -1.721 4.013 5.541 1.00 . A A . 17 THR C 1 1
7 3560 1 1 17 THR CA C -0.649 5.010 5.116 1.00 . A A . 17 THR CA 1 1
7 3561 1 1 17 THR CB C 0.136 5.553 6.312 1.00 . A A . 17 THR CB 1 1
7 3562 1 1 17 THR CG2 C -0.745 6.480 7.168 1.00 . A A . 17 THR CG2 1 1
7 3563 1 1 17 THR H H -1.448 6.929 4.855 1.00 . A A . 17 THR H 1 1
7 3564 1 1 17 THR HA H 0.053 4.456 4.509 1.00 . A A . 17 THR HA 1 1
7 3565 1 1 17 THR HB H 0.995 6.149 5.917 1.00 . A A . 17 THR HB 1 1
7 3566 1 1 17 THR HG1 H 0.281 3.709 6.902 1.00 . A A . 17 THR HG1 1 1
7 3567 1 1 17 THR HG21 H -0.181 6.784 8.077 1.00 . A A . 17 THR HG21 1 1
7 3568 1 1 17 THR HG22 H -1.669 5.964 7.501 1.00 . A A . 17 THR HG22 1 1
7 3569 1 1 17 THR HG23 H -1.011 7.407 6.622 1.00 . A A . 17 THR HG23 1 1
7 3570 1 1 17 THR N N -1.208 6.116 4.337 1.00 . A A . 17 THR N 1 1
7 3571 1 1 17 THR O O -1.528 3.145 6.384 1.00 . A A . 17 THR O 1 1
7 3572 1 1 17 THR OG1 O 0.682 4.552 7.159 1.00 . A A . 17 THR OG1 1 1
7 3573 1 1 18 VAL C C -4.524 2.553 4.113 1.00 . A A . 18 VAL C 1 1
7 3574 1 1 18 VAL CA C -4.062 3.298 5.338 1.00 . A A . 18 VAL CA 1 1
7 3575 1 1 18 VAL CB C -5.219 4.144 5.880 1.00 . A A . 18 VAL CB 1 1
7 3576 1 1 18 VAL CG1 C -6.334 3.260 6.480 1.00 . A A . 18 VAL CG1 1 1
7 3577 1 1 18 VAL CG2 C -4.677 5.083 6.973 1.00 . A A . 18 VAL CG2 1 1
7 3578 1 1 18 VAL H H -2.997 4.695 4.150 1.00 . A A . 18 VAL H 1 1
7 3579 1 1 18 VAL HA H -3.780 2.565 6.082 1.00 . A A . 18 VAL HA 1 1
7 3580 1 1 18 VAL HB H -5.651 4.774 5.071 1.00 . A A . 18 VAL HB 1 1
7 3581 1 1 18 VAL HG11 H -7.311 3.789 6.442 1.00 . A A . 18 VAL HG11 1 1
7 3582 1 1 18 VAL HG12 H -6.116 3.032 7.545 1.00 . A A . 18 VAL HG12 1 1
7 3583 1 1 18 VAL HG13 H -6.463 2.295 5.953 1.00 . A A . 18 VAL HG13 1 1
7 3584 1 1 18 VAL HG21 H -3.950 4.535 7.614 1.00 . A A . 18 VAL HG21 1 1
7 3585 1 1 18 VAL HG22 H -5.502 5.438 7.626 1.00 . A A . 18 VAL HG22 1 1
7 3586 1 1 18 VAL HG23 H -4.163 5.964 6.538 1.00 . A A . 18 VAL HG23 1 1
7 3587 1 1 18 VAL N N -2.919 4.103 4.943 1.00 . A A . 18 VAL N 1 1
7 3588 1 1 18 VAL O O -4.657 3.137 3.042 1.00 . A A . 18 VAL O 1 1
7 3589 1 1 19 CYS C C -6.940 0.752 3.103 1.00 . A A . 19 CYS C 1 1
7 3590 1 1 19 CYS CA C -5.460 0.539 3.121 1.00 . A A . 19 CYS CA 1 1
7 3591 1 1 19 CYS CB C -5.145 -0.950 3.202 1.00 . A A . 19 CYS CB 1 1
7 3592 1 1 19 CYS H H -4.730 0.765 5.070 1.00 . A A . 19 CYS H 1 1
7 3593 1 1 19 CYS HA H -5.120 0.937 2.179 1.00 . A A . 19 CYS HA 1 1
7 3594 1 1 19 CYS HB2 H -5.223 -1.293 4.259 1.00 . A A . 19 CYS HB2 1 1
7 3595 1 1 19 CYS HB3 H -5.821 -1.595 2.616 1.00 . A A . 19 CYS HB3 1 1
7 3596 1 1 19 CYS N N -4.819 1.255 4.207 1.00 . A A . 19 CYS N 1 1
7 3597 1 1 19 CYS O O -7.553 0.943 4.146 1.00 . A A . 19 CYS O 1 1
7 3598 1 1 19 CYS SG S -3.480 -1.177 2.589 1.00 . A A . 19 CYS SG 1 1
7 3599 1 1 20 ALA C C -9.786 0.036 2.566 1.00 . A A . 20 ALA C 1 1
7 3600 1 1 20 ALA CA C -8.967 0.874 1.640 1.00 . A A . 20 ALA CA 1 1
7 3601 1 1 20 ALA CB C -9.337 0.496 0.178 1.00 . A A . 20 ALA CB 1 1
7 3602 1 1 20 ALA H H -6.993 0.600 1.070 1.00 . A A . 20 ALA H 1 1
7 3603 1 1 20 ALA HA H -9.265 1.875 1.874 1.00 . A A . 20 ALA HA 1 1
7 3604 1 1 20 ALA HB1 H -10.317 0.925 -0.114 1.00 . A A . 20 ALA HB1 1 1
7 3605 1 1 20 ALA HB2 H -9.407 -0.604 0.050 1.00 . A A . 20 ALA HB2 1 1
7 3606 1 1 20 ALA HB3 H -8.566 0.856 -0.530 1.00 . A A . 20 ALA HB3 1 1
7 3607 1 1 20 ALA N N -7.535 0.807 1.887 1.00 . A A . 20 ALA N 1 1
7 3608 1 1 20 ALA O O -9.355 -1.034 2.942 1.00 . A A . 20 ALA O 1 1
7 3609 1 1 21 SER C C -12.312 -1.612 3.337 1.00 . A A . 21 SER C 1 1
7 3610 1 1 21 SER CA C -11.824 -0.270 3.881 1.00 . A A . 21 SER CA 1 1
7 3611 1 1 21 SER CB C -13.049 0.604 4.262 1.00 . A A . 21 SER CB 1 1
7 3612 1 1 21 SER H H -11.379 1.345 2.689 1.00 . A A . 21 SER H 1 1
7 3613 1 1 21 SER HA H -11.224 -0.473 4.760 1.00 . A A . 21 SER HA 1 1
7 3614 1 1 21 SER HB2 H -13.933 0.354 3.635 1.00 . A A . 21 SER HB2 1 1
7 3615 1 1 21 SER HB3 H -13.319 0.410 5.325 1.00 . A A . 21 SER HB3 1 1
7 3616 1 1 21 SER HG H -12.382 2.328 4.891 1.00 . A A . 21 SER HG 1 1
7 3617 1 1 21 SER N N -10.999 0.452 2.924 1.00 . A A . 21 SER N 1 1
7 3618 1 1 21 SER O O -12.887 -2.419 4.055 1.00 . A A . 21 SER O 1 1
7 3619 1 1 21 SER OG O -12.756 1.996 4.068 1.00 . A A . 21 SER OG 1 1
7 3620 1 1 22 GLY C C -10.957 -3.873 1.096 1.00 . A A . 22 GLY C 1 1
7 3621 1 1 22 GLY CA C -12.247 -3.134 1.345 1.00 . A A . 22 GLY CA 1 1
7 3622 1 1 22 GLY H H -11.618 -1.135 1.524 1.00 . A A . 22 GLY H 1 1
7 3623 1 1 22 GLY HA2 H -12.882 -3.785 1.927 1.00 . A A . 22 GLY HA2 1 1
7 3624 1 1 22 GLY HA3 H -12.648 -2.914 0.368 1.00 . A A . 22 GLY HA3 1 1
7 3625 1 1 22 GLY N N -12.067 -1.859 2.031 1.00 . A A . 22 GLY N 1 1
7 3626 1 1 22 GLY O O -10.968 -4.938 0.495 1.00 . A A . 22 GLY O 1 1
7 3627 1 1 23 THR C C -7.737 -3.887 2.624 1.00 . A A . 23 THR C 1 1
7 3628 1 1 23 THR CA C -8.476 -3.834 1.282 1.00 . A A . 23 THR CA 1 1
7 3629 1 1 23 THR CB C -7.602 -3.015 0.314 1.00 . A A . 23 THR CB 1 1
7 3630 1 1 23 THR CG2 C -8.208 -2.806 -1.080 1.00 . A A . 23 THR CG2 1 1
7 3631 1 1 23 THR H H -9.849 -2.490 2.099 1.00 . A A . 23 THR H 1 1
7 3632 1 1 23 THR HA H -8.570 -4.843 0.918 1.00 . A A . 23 THR HA 1 1
7 3633 1 1 23 THR HB H -6.620 -3.512 0.182 1.00 . A A . 23 THR HB 1 1
7 3634 1 1 23 THR HG1 H -7.944 -1.633 1.571 1.00 . A A . 23 THR HG1 1 1
7 3635 1 1 23 THR HG21 H -7.715 -1.945 -1.578 1.00 . A A . 23 THR HG21 1 1
7 3636 1 1 23 THR HG22 H -9.294 -2.608 -1.023 1.00 . A A . 23 THR HG22 1 1
7 3637 1 1 23 THR HG23 H -8.042 -3.710 -1.697 1.00 . A A . 23 THR HG23 1 1
7 3638 1 1 23 THR N N -9.814 -3.296 1.504 1.00 . A A . 23 THR N 1 1
7 3639 1 1 23 THR O O -8.141 -3.297 3.617 1.00 . A A . 23 THR O 1 1
7 3640 1 1 23 THR OG1 O -7.353 -1.716 0.802 1.00 . A A . 23 THR OG1 1 1
7 3641 1 1 24 THR C C -4.376 -4.505 3.711 1.00 . A A . 24 THR C 1 1
7 3642 1 1 24 THR CA C -5.850 -4.773 3.938 1.00 . A A . 24 THR CA 1 1
7 3643 1 1 24 THR CB C -6.070 -6.175 4.491 1.00 . A A . 24 THR CB 1 1
7 3644 1 1 24 THR CG2 C -5.024 -6.594 5.531 1.00 . A A . 24 THR CG2 1 1
7 3645 1 1 24 THR H H -6.425 -5.227 1.939 1.00 . A A . 24 THR H 1 1
7 3646 1 1 24 THR HA H -6.171 -4.058 4.684 1.00 . A A . 24 THR HA 1 1
7 3647 1 1 24 THR HB H -6.082 -6.907 3.647 1.00 . A A . 24 THR HB 1 1
7 3648 1 1 24 THR HG1 H -7.989 -6.081 4.478 1.00 . A A . 24 THR HG1 1 1
7 3649 1 1 24 THR HG21 H -5.373 -7.496 6.079 1.00 . A A . 24 THR HG21 1 1
7 3650 1 1 24 THR HG22 H -4.852 -5.785 6.270 1.00 . A A . 24 THR HG22 1 1
7 3651 1 1 24 THR HG23 H -4.064 -6.845 5.048 1.00 . A A . 24 THR HG23 1 1
7 3652 1 1 24 THR N N -6.609 -4.593 2.705 1.00 . A A . 24 THR N 1 1
7 3653 1 1 24 THR O O -3.813 -4.940 2.712 1.00 . A A . 24 THR O 1 1
7 3654 1 1 24 THR OG1 O -7.320 -6.232 5.157 1.00 . A A . 24 THR OG1 1 1
7 3655 1 1 25 CYS C C -1.391 -4.643 4.793 1.00 . A A . 25 CYS C 1 1
7 3656 1 1 25 CYS CA C -2.257 -3.456 4.446 1.00 . A A . 25 CYS CA 1 1
7 3657 1 1 25 CYS CB C -1.778 -2.234 5.290 1.00 . A A . 25 CYS CB 1 1
7 3658 1 1 25 CYS H H -4.128 -3.415 5.426 1.00 . A A . 25 CYS H 1 1
7 3659 1 1 25 CYS HA H -2.069 -3.255 3.401 1.00 . A A . 25 CYS HA 1 1
7 3660 1 1 25 CYS HB2 H -2.488 -1.396 5.145 1.00 . A A . 25 CYS HB2 1 1
7 3661 1 1 25 CYS HB3 H -1.817 -2.500 6.368 1.00 . A A . 25 CYS HB3 1 1
7 3662 1 1 25 CYS N N -3.687 -3.747 4.600 1.00 . A A . 25 CYS N 1 1
7 3663 1 1 25 CYS O O -1.441 -5.163 5.905 1.00 . A A . 25 CYS O 1 1
7 3664 1 1 25 CYS SG S -0.095 -1.638 4.890 1.00 . A A . 25 CYS SG 1 1
7 3665 1 1 26 GLN C C 1.576 -6.039 3.353 1.00 . A A . 26 GLN C 1 1
7 3666 1 1 26 GLN CA C 0.253 -6.268 4.046 1.00 . A A . 26 GLN CA 1 1
7 3667 1 1 26 GLN CB C -0.388 -7.580 3.512 1.00 . A A . 26 GLN CB 1 1
7 3668 1 1 26 GLN CD C -2.537 -8.950 3.239 1.00 . A A . 26 GLN CD 1 1
7 3669 1 1 26 GLN CG C -1.869 -7.758 3.927 1.00 . A A . 26 GLN CG 1 1
7 3670 1 1 26 GLN H H -0.572 -4.700 2.915 1.00 . A A . 26 GLN H 1 1
7 3671 1 1 26 GLN HA H 0.465 -6.370 5.103 1.00 . A A . 26 GLN HA 1 1
7 3672 1 1 26 GLN HB2 H -0.332 -7.586 2.402 1.00 . A A . 26 GLN HB2 1 1
7 3673 1 1 26 GLN HB3 H 0.191 -8.458 3.876 1.00 . A A . 26 GLN HB3 1 1
7 3674 1 1 26 GLN HE21 H -4.349 -8.021 3.302 1.00 . A A . 26 GLN HE21 1 1
7 3675 1 1 26 GLN HE22 H -4.315 -9.582 2.540 1.00 . A A . 26 GLN HE22 1 1
7 3676 1 1 26 GLN HG2 H -1.951 -7.883 5.026 1.00 . A A . 26 GLN HG2 1 1
7 3677 1 1 26 GLN HG3 H -2.434 -6.850 3.635 1.00 . A A . 26 GLN HG3 1 1
7 3678 1 1 26 GLN N N -0.578 -5.108 3.834 1.00 . A A . 26 GLN N 1 1
7 3679 1 1 26 GLN NE2 N -3.875 -8.864 3.071 1.00 . A A . 26 GLN NE2 1 1
7 3680 1 1 26 GLN O O 1.769 -5.133 2.541 1.00 . A A . 26 GLN O 1 1
7 3681 1 1 26 GLN OE1 O -1.900 -9.922 2.840 1.00 . A A . 26 GLN OE1 1 1
7 3682 1 1 27 VAL C C 3.945 -7.648 1.839 1.00 . A A . 27 VAL C 1 1
7 3683 1 1 27 VAL CA C 3.876 -6.796 3.090 1.00 . A A . 27 VAL CA 1 1
7 3684 1 1 27 VAL CB C 4.955 -7.182 4.091 1.00 . A A . 27 VAL CB 1 1
7 3685 1 1 27 VAL CG1 C 6.325 -7.356 3.406 1.00 . A A . 27 VAL CG1 1 1
7 3686 1 1 27 VAL CG2 C 5.010 -6.082 5.168 1.00 . A A . 27 VAL CG2 1 1
7 3687 1 1 27 VAL H H 2.398 -7.635 4.301 1.00 . A A . 27 VAL H 1 1
7 3688 1 1 27 VAL HA H 4.076 -5.779 2.785 1.00 . A A . 27 VAL HA 1 1
7 3689 1 1 27 VAL HB H 4.684 -8.150 4.580 1.00 . A A . 27 VAL HB 1 1
7 3690 1 1 27 VAL HG11 H 6.389 -8.358 2.925 1.00 . A A . 27 VAL HG11 1 1
7 3691 1 1 27 VAL HG12 H 7.142 -7.283 4.153 1.00 . A A . 27 VAL HG12 1 1
7 3692 1 1 27 VAL HG13 H 6.485 -6.573 2.640 1.00 . A A . 27 VAL HG13 1 1
7 3693 1 1 27 VAL HG21 H 5.886 -6.239 5.833 1.00 . A A . 27 VAL HG21 1 1
7 3694 1 1 27 VAL HG22 H 4.095 -6.099 5.798 1.00 . A A . 27 VAL HG22 1 1
7 3695 1 1 27 VAL HG23 H 5.098 -5.077 4.706 1.00 . A A . 27 VAL HG23 1 1
7 3696 1 1 27 VAL N N 2.564 -6.871 3.685 1.00 . A A . 27 VAL N 1 1
7 3697 1 1 27 VAL O O 3.654 -8.837 1.862 1.00 . A A . 27 VAL O 1 1
7 3698 1 1 28 LEU C C 6.119 -7.964 -0.692 1.00 . A A . 28 LEU C 1 1
7 3699 1 1 28 LEU CA C 4.607 -7.782 -0.517 1.00 . A A . 28 LEU CA 1 1
7 3700 1 1 28 LEU CB C 3.883 -7.017 -1.676 1.00 . A A . 28 LEU CB 1 1
7 3701 1 1 28 LEU CD1 C 4.486 -8.790 -3.471 1.00 . A A . 28 LEU CD1 1 1
7 3702 1 1 28 LEU CD2 C 3.276 -6.661 -4.133 1.00 . A A . 28 LEU CD2 1 1
7 3703 1 1 28 LEU CG C 4.272 -7.304 -3.150 1.00 . A A . 28 LEU CG 1 1
7 3704 1 1 28 LEU H H 4.494 -6.059 0.671 1.00 . A A . 28 LEU H 1 1
7 3705 1 1 28 LEU HA H 4.190 -8.780 -0.462 1.00 . A A . 28 LEU HA 1 1
7 3706 1 1 28 LEU HB2 H 2.800 -7.257 -1.566 1.00 . A A . 28 LEU HB2 1 1
7 3707 1 1 28 LEU HB3 H 3.984 -5.924 -1.501 1.00 . A A . 28 LEU HB3 1 1
7 3708 1 1 28 LEU HD11 H 4.215 -9.432 -2.610 1.00 . A A . 28 LEU HD11 1 1
7 3709 1 1 28 LEU HD12 H 5.563 -8.960 -3.698 1.00 . A A . 28 LEU HD12 1 1
7 3710 1 1 28 LEU HD13 H 3.901 -9.114 -4.353 1.00 . A A . 28 LEU HD13 1 1
7 3711 1 1 28 LEU HD21 H 2.376 -6.295 -3.600 1.00 . A A . 28 LEU HD21 1 1
7 3712 1 1 28 LEU HD22 H 2.939 -7.382 -4.904 1.00 . A A . 28 LEU HD22 1 1
7 3713 1 1 28 LEU HD23 H 3.750 -5.811 -4.668 1.00 . A A . 28 LEU HD23 1 1
7 3714 1 1 28 LEU HG H 5.250 -6.820 -3.359 1.00 . A A . 28 LEU HG 1 1
7 3715 1 1 28 LEU N N 4.345 -7.042 0.705 1.00 . A A . 28 LEU N 1 1
7 3716 1 1 28 LEU O O 6.624 -8.851 -1.367 1.00 . A A . 28 LEU O 1 1
7 3717 1 1 29 ASN C C 8.905 -5.992 0.689 1.00 . A A . 29 ASN C 1 1
7 3718 1 1 29 ASN CA C 8.346 -7.014 -0.283 1.00 . A A . 29 ASN CA 1 1
7 3719 1 1 29 ASN CB C 8.802 -6.640 -1.751 1.00 . A A . 29 ASN CB 1 1
7 3720 1 1 29 ASN CG C 7.778 -6.001 -2.697 1.00 . A A . 29 ASN CG 1 1
7 3721 1 1 29 ASN H H 6.536 -6.467 0.623 1.00 . A A . 29 ASN H 1 1
7 3722 1 1 29 ASN HA H 8.772 -7.973 -0.020 1.00 . A A . 29 ASN HA 1 1
7 3723 1 1 29 ASN HB2 H 9.668 -5.950 -1.774 1.00 . A A . 29 ASN HB2 1 1
7 3724 1 1 29 ASN HB3 H 9.112 -7.580 -2.256 1.00 . A A . 29 ASN HB3 1 1
7 3725 1 1 29 ASN HD21 H 6.695 -5.210 -1.152 1.00 . A A . 29 ASN HD21 1 1
7 3726 1 1 29 ASN HD22 H 6.078 -4.985 -2.768 1.00 . A A . 29 ASN HD22 1 1
7 3727 1 1 29 ASN N N 6.926 -7.125 -0.017 1.00 . A A . 29 ASN N 1 1
7 3728 1 1 29 ASN ND2 N 6.811 -5.296 -2.156 1.00 . A A . 29 ASN ND2 1 1
7 3729 1 1 29 ASN O O 8.146 -5.143 1.158 1.00 . A A . 29 ASN O 1 1
7 3730 1 1 29 ASN OD1 O 7.869 -6.138 -3.903 1.00 . A A . 29 ASN OD1 1 1
7 3731 1 1 30 PRO C C 10.874 -3.647 1.500 1.00 . A A . 30 PRO C 1 1
7 3732 1 1 30 PRO CA C 10.754 -5.074 2.008 1.00 . A A . 30 PRO CA 1 1
7 3733 1 1 30 PRO CB C 12.138 -5.688 2.319 1.00 . A A . 30 PRO CB 1 1
7 3734 1 1 30 PRO CD C 11.187 -6.901 0.440 1.00 . A A . 30 PRO CD 1 1
7 3735 1 1 30 PRO CG C 12.511 -6.585 1.128 1.00 . A A . 30 PRO CG 1 1
7 3736 1 1 30 PRO HA H 10.111 -5.036 2.877 1.00 . A A . 30 PRO HA 1 1
7 3737 1 1 30 PRO HB2 H 12.924 -4.925 2.512 1.00 . A A . 30 PRO HB2 1 1
7 3738 1 1 30 PRO HB3 H 12.045 -6.319 3.230 1.00 . A A . 30 PRO HB3 1 1
7 3739 1 1 30 PRO HD2 H 11.296 -6.725 -0.654 1.00 . A A . 30 PRO HD2 1 1
7 3740 1 1 30 PRO HD3 H 10.886 -7.957 0.621 1.00 . A A . 30 PRO HD3 1 1
7 3741 1 1 30 PRO HG2 H 13.185 -6.047 0.429 1.00 . A A . 30 PRO HG2 1 1
7 3742 1 1 30 PRO HG3 H 13.020 -7.515 1.462 1.00 . A A . 30 PRO HG3 1 1
7 3743 1 1 30 PRO N N 10.193 -5.986 1.013 1.00 . A A . 30 PRO N 1 1
7 3744 1 1 30 PRO O O 11.379 -2.805 2.226 1.00 . A A . 30 PRO O 1 1
7 3745 1 1 31 TYR C C 9.048 -1.582 -0.735 1.00 . A A . 31 TYR C 1 1
7 3746 1 1 31 TYR CA C 10.437 -2.016 -0.302 1.00 . A A . 31 TYR CA 1 1
7 3747 1 1 31 TYR CB C 11.439 -1.965 -1.496 1.00 . A A . 31 TYR CB 1 1
7 3748 1 1 31 TYR CD1 C 13.463 -3.159 -0.517 1.00 . A A . 31 TYR CD1 1 1
7 3749 1 1 31 TYR CD2 C 13.603 -0.784 -0.931 1.00 . A A . 31 TYR CD2 1 1
7 3750 1 1 31 TYR CE1 C 14.741 -3.139 0.062 1.00 . A A . 31 TYR CE1 1 1
7 3751 1 1 31 TYR CE2 C 14.881 -0.761 -0.357 1.00 . A A . 31 TYR CE2 1 1
7 3752 1 1 31 TYR CG C 12.859 -1.975 -0.979 1.00 . A A . 31 TYR CG 1 1
7 3753 1 1 31 TYR CZ C 15.444 -1.932 0.145 1.00 . A A . 31 TYR CZ 1 1
7 3754 1 1 31 TYR H H 9.989 -4.065 -0.259 1.00 . A A . 31 TYR H 1 1
7 3755 1 1 31 TYR HA H 10.725 -1.290 0.444 1.00 . A A . 31 TYR HA 1 1
7 3756 1 1 31 TYR HB2 H 11.300 -2.840 -2.165 1.00 . A A . 31 TYR HB2 1 1
7 3757 1 1 31 TYR HB3 H 11.302 -1.041 -2.100 1.00 . A A . 31 TYR HB3 1 1
7 3758 1 1 31 TYR HD1 H 12.913 -4.083 -0.566 1.00 . A A . 31 TYR HD1 1 1
7 3759 1 1 31 TYR HD2 H 13.169 0.138 -1.289 1.00 . A A . 31 TYR HD2 1 1
7 3760 1 1 31 TYR HE1 H 15.169 -4.044 0.466 1.00 . A A . 31 TYR HE1 1 1
7 3761 1 1 31 TYR HE2 H 15.437 0.162 -0.288 1.00 . A A . 31 TYR HE2 1 1
7 3762 1 1 31 TYR HH H 17.261 -2.560 0.296 1.00 . A A . 31 TYR HH 1 1
7 3763 1 1 31 TYR N N 10.397 -3.343 0.281 1.00 . A A . 31 TYR N 1 1
7 3764 1 1 31 TYR O O 8.843 -0.458 -1.189 1.00 . A A . 31 TYR O 1 1
7 3765 1 1 31 TYR OH O 16.733 -1.870 0.702 1.00 . A A . 31 TYR OH 1 1
7 3766 1 1 32 TYR C C 5.652 -2.913 -0.148 1.00 . A A . 32 TYR C 1 1
7 3767 1 1 32 TYR CA C 6.695 -2.173 -1.006 1.00 . A A . 32 TYR CA 1 1
7 3768 1 1 32 TYR CB C 6.603 -2.246 -2.575 1.00 . A A . 32 TYR CB 1 1
7 3769 1 1 32 TYR CD1 C 4.392 -3.320 -3.331 1.00 . A A . 32 TYR CD1 1 1
7 3770 1 1 32 TYR CD2 C 4.753 -0.951 -3.583 1.00 . A A . 32 TYR CD2 1 1
7 3771 1 1 32 TYR CE1 C 3.124 -3.177 -3.902 1.00 . A A . 32 TYR CE1 1 1
7 3772 1 1 32 TYR CE2 C 3.464 -0.795 -4.091 1.00 . A A . 32 TYR CE2 1 1
7 3773 1 1 32 TYR CG C 5.212 -2.193 -3.135 1.00 . A A . 32 TYR CG 1 1
7 3774 1 1 32 TYR CZ C 2.654 -1.913 -4.238 1.00 . A A . 32 TYR CZ 1 1
7 3775 1 1 32 TYR H H 8.167 -3.289 -0.024 1.00 . A A . 32 TYR H 1 1
7 3776 1 1 32 TYR HA H 6.502 -1.139 -0.776 1.00 . A A . 32 TYR HA 1 1
7 3777 1 1 32 TYR HB2 H 7.179 -1.391 -2.991 1.00 . A A . 32 TYR HB2 1 1
7 3778 1 1 32 TYR HB3 H 7.114 -3.117 -3.011 1.00 . A A . 32 TYR HB3 1 1
7 3779 1 1 32 TYR HD1 H 4.712 -4.311 -3.077 1.00 . A A . 32 TYR HD1 1 1
7 3780 1 1 32 TYR HD2 H 5.415 -0.102 -3.547 1.00 . A A . 32 TYR HD2 1 1
7 3781 1 1 32 TYR HE1 H 2.494 -4.035 -4.074 1.00 . A A . 32 TYR HE1 1 1
7 3782 1 1 32 TYR HE2 H 3.119 0.175 -4.407 1.00 . A A . 32 TYR HE2 1 1
7 3783 1 1 32 TYR HH H 0.805 -1.405 -4.065 1.00 . A A . 32 TYR HH 1 1
7 3784 1 1 32 TYR N N 8.038 -2.452 -0.552 1.00 . A A . 32 TYR N 1 1
7 3785 1 1 32 TYR O O 5.668 -4.131 0.031 1.00 . A A . 32 TYR O 1 1
7 3786 1 1 32 TYR OH O 1.368 -1.780 -4.753 1.00 . A A . 32 TYR OH 1 1
7 3787 1 1 33 SER C C 2.375 -2.372 0.619 1.00 . A A . 33 SER C 1 1
7 3788 1 1 33 SER CA C 3.655 -2.759 1.280 1.00 . A A . 33 SER CA 1 1
7 3789 1 1 33 SER CB C 3.586 -2.236 2.734 1.00 . A A . 33 SER CB 1 1
7 3790 1 1 33 SER H H 4.717 -1.180 0.456 1.00 . A A . 33 SER H 1 1
7 3791 1 1 33 SER HA H 3.715 -3.837 1.295 1.00 . A A . 33 SER HA 1 1
7 3792 1 1 33 SER HB2 H 3.250 -1.179 2.756 1.00 . A A . 33 SER HB2 1 1
7 3793 1 1 33 SER HB3 H 2.846 -2.823 3.326 1.00 . A A . 33 SER HB3 1 1
7 3794 1 1 33 SER HG H 5.164 -3.205 3.326 1.00 . A A . 33 SER HG 1 1
7 3795 1 1 33 SER N N 4.712 -2.184 0.467 1.00 . A A . 33 SER N 1 1
7 3796 1 1 33 SER O O 2.083 -1.195 0.420 1.00 . A A . 33 SER O 1 1
7 3797 1 1 33 SER OG O 4.873 -2.289 3.345 1.00 . A A . 33 SER OG 1 1
7 3798 1 1 34 GLN C C -0.854 -3.356 0.108 1.00 . A A . 34 GLN C 1 1
7 3799 1 1 34 GLN CA C 0.449 -3.167 -0.626 1.00 . A A . 34 GLN CA 1 1
7 3800 1 1 34 GLN CB C 0.606 -3.993 -1.934 1.00 . A A . 34 GLN CB 1 1
7 3801 1 1 34 GLN CD C -0.288 -5.590 -3.718 1.00 . A A . 34 GLN CD 1 1
7 3802 1 1 34 GLN CG C -0.580 -4.853 -2.410 1.00 . A A . 34 GLN CG 1 1
7 3803 1 1 34 GLN H H 1.733 -4.298 0.557 1.00 . A A . 34 GLN H 1 1
7 3804 1 1 34 GLN HA H 0.430 -2.132 -0.919 1.00 . A A . 34 GLN HA 1 1
7 3805 1 1 34 GLN HB2 H 0.822 -3.253 -2.729 1.00 . A A . 34 GLN HB2 1 1
7 3806 1 1 34 GLN HB3 H 1.501 -4.648 -1.832 1.00 . A A . 34 GLN HB3 1 1
7 3807 1 1 34 GLN HE21 H -0.050 -3.853 -4.804 1.00 . A A . 34 GLN HE21 1 1
7 3808 1 1 34 GLN HE22 H 0.072 -5.359 -5.670 1.00 . A A . 34 GLN HE22 1 1
7 3809 1 1 34 GLN HG2 H -0.778 -5.627 -1.641 1.00 . A A . 34 GLN HG2 1 1
7 3810 1 1 34 GLN HG3 H -1.494 -4.250 -2.553 1.00 . A A . 34 GLN HG3 1 1
7 3811 1 1 34 GLN N N 1.584 -3.367 0.228 1.00 . A A . 34 GLN N 1 1
7 3812 1 1 34 GLN NE2 N -0.098 -4.851 -4.831 1.00 . A A . 34 GLN NE2 1 1
7 3813 1 1 34 GLN O O -0.918 -3.912 1.201 1.00 . A A . 34 GLN O 1 1
7 3814 1 1 34 GLN OE1 O -0.254 -6.816 -3.769 1.00 . A A . 34 GLN OE1 1 1
7 3815 1 1 35 CYS C C -4.069 -4.037 -0.705 1.00 . A A . 35 CYS C 1 1
7 3816 1 1 35 CYS CA C -3.284 -2.963 0.007 1.00 . A A . 35 CYS CA 1 1
7 3817 1 1 35 CYS CB C -4.033 -1.645 -0.248 1.00 . A A . 35 CYS CB 1 1
7 3818 1 1 35 CYS H H -1.799 -2.303 -1.323 1.00 . A A . 35 CYS H 1 1
7 3819 1 1 35 CYS HA H -3.268 -3.236 1.051 1.00 . A A . 35 CYS HA 1 1
7 3820 1 1 35 CYS HB2 H -3.914 -1.374 -1.314 1.00 . A A . 35 CYS HB2 1 1
7 3821 1 1 35 CYS HB3 H -5.110 -1.750 -0.034 1.00 . A A . 35 CYS HB3 1 1
7 3822 1 1 35 CYS N N -1.932 -2.825 -0.484 1.00 . A A . 35 CYS N 1 1
7 3823 1 1 35 CYS O O -4.270 -3.969 -1.915 1.00 . A A . 35 CYS O 1 1
7 3824 1 1 35 CYS SG S -3.389 -0.319 0.767 1.00 . A A . 35 CYS SG 1 1
7 3825 1 1 36 LEU C C -6.694 -6.252 -0.152 1.00 . A A . 36 LEU C 1 1
7 3826 1 1 36 LEU CA C -5.215 -6.194 -0.548 1.00 . A A . 36 LEU CA 1 1
7 3827 1 1 36 LEU CB C -4.566 -7.507 -0.077 1.00 . A A . 36 LEU CB 1 1
7 3828 1 1 36 LEU CD1 C -2.888 -7.347 -1.940 1.00 . A A . 36 LEU CD1 1 1
7 3829 1 1 36 LEU CD2 C -2.141 -6.853 0.428 1.00 . A A . 36 LEU CD2 1 1
7 3830 1 1 36 LEU CG C -3.088 -7.674 -0.458 1.00 . A A . 36 LEU CG 1 1
7 3831 1 1 36 LEU H H -4.358 -5.117 1.007 1.00 . A A . 36 LEU H 1 1
7 3832 1 1 36 LEU HA H -5.189 -6.141 -1.622 1.00 . A A . 36 LEU HA 1 1
7 3833 1 1 36 LEU HB2 H -4.671 -7.572 1.025 1.00 . A A . 36 LEU HB2 1 1
7 3834 1 1 36 LEU HB3 H -5.137 -8.356 -0.514 1.00 . A A . 36 LEU HB3 1 1
7 3835 1 1 36 LEU HD11 H -2.942 -6.250 -2.099 1.00 . A A . 36 LEU HD11 1 1
7 3836 1 1 36 LEU HD12 H -3.669 -7.827 -2.562 1.00 . A A . 36 LEU HD12 1 1
7 3837 1 1 36 LEU HD13 H -1.893 -7.705 -2.271 1.00 . A A . 36 LEU HD13 1 1
7 3838 1 1 36 LEU HD21 H -2.501 -6.851 1.475 1.00 . A A . 36 LEU HD21 1 1
7 3839 1 1 36 LEU HD22 H -2.108 -5.799 0.104 1.00 . A A . 36 LEU HD22 1 1
7 3840 1 1 36 LEU HD23 H -1.110 -7.254 0.395 1.00 . A A . 36 LEU HD23 1 1
7 3841 1 1 36 LEU HG H -2.835 -8.750 -0.289 1.00 . A A . 36 LEU HG 1 1
7 3842 1 1 36 LEU N N -4.552 -5.045 0.023 1.00 . A A . 36 LEU N 1 1
7 3843 1 1 36 LEU O O -7.551 -5.911 -1.004 1.00 . A A . 36 LEU O 1 1
7 3844 1 1 36 LEU OXT O -6.982 -6.623 1.011 1.00 . A A . 36 LEU OXT 1 1
7 3845 2 2 1 MAN C1 C -9.331 4.110 0.229 1.00 . B A . 101 MAN C1 1 1
7 3846 2 2 1 MAN C2 C -8.475 4.367 -0.976 1.00 . B A . 101 MAN C2 1 1
7 3847 2 2 1 MAN C3 C -8.356 5.850 -1.188 1.00 . B A . 101 MAN C3 1 1
7 3848 2 2 1 MAN C4 C -9.718 6.437 -1.412 1.00 . B A . 101 MAN C4 1 1
7 3849 2 2 1 MAN C5 C -10.695 5.958 -0.330 1.00 . B A . 101 MAN C5 1 1
7 3850 2 2 1 MAN C6 C -12.128 6.269 -0.671 1.00 . B A . 101 MAN C6 1 1
7 3851 2 2 1 MAN H1 H -9.407 3.026 0.349 1.00 . B A . 101 MAN H1 1 1
7 3852 2 2 1 MAN H2 H -7.474 4.000 -0.748 1.00 . B A . 101 MAN H2 1 1
7 3853 2 2 1 MAN H3 H -7.989 6.307 -0.246 1.00 . B A . 101 MAN H3 1 1
7 3854 2 2 1 MAN H4 H -10.088 6.092 -2.408 1.00 . B A . 101 MAN H4 1 1
7 3855 2 2 1 MAN H5 H -10.451 6.474 0.627 1.00 . B A . 101 MAN H5 1 1
7 3856 2 2 1 MAN H61 H -12.395 5.791 -1.642 1.00 . B A . 101 MAN H61 1 1
7 3857 2 2 1 MAN H62 H -12.256 7.370 -0.778 1.00 . B A . 101 MAN H62 1 1
7 3858 2 2 1 MAN HO2 H -8.486 2.788 -2.163 1.00 . B A . 101 MAN HO2 1 1
7 3859 2 2 1 MAN HO3 H -6.808 6.883 -1.940 1.00 . B A . 101 MAN HO3 1 1
7 3860 2 2 1 MAN HO4 H -9.289 8.144 -2.249 1.00 . B A . 101 MAN HO4 1 1
7 3861 2 2 1 MAN HO6 H -12.948 4.835 0.387 1.00 . B A . 101 MAN HO6 1 1
7 3862 2 2 1 MAN O1 O -8.857 4.747 1.442 1.00 . B A . 101 MAN O1 1 1
7 3863 2 2 1 MAN O2 O -8.924 3.640 -2.123 1.00 . B A . 101 MAN O2 1 1
7 3864 2 2 1 MAN O3 O -7.406 6.171 -2.203 1.00 . B A . 101 MAN O3 1 1
7 3865 2 2 1 MAN O4 O -9.632 7.857 -1.392 1.00 . B A . 101 MAN O4 1 1
7 3866 2 2 1 MAN O5 O -10.642 4.543 -0.079 1.00 . B A . 101 MAN O5 1 1
7 3867 2 2 1 MAN O6 O -13.011 5.798 0.349 1.00 . B A . 101 MAN O6 1 1
7 3868 3 2 1 MAN C1 C -5.782 3.839 -6.538 1.00 . C A . 102 MAN C1 1 1
7 3869 3 2 1 MAN C2 C -4.937 2.982 -7.463 1.00 . C A . 102 MAN C2 1 1
7 3870 3 2 1 MAN C3 C -3.557 2.866 -6.855 1.00 . C A . 102 MAN C3 1 1
7 3871 3 2 1 MAN C4 C -2.957 4.249 -6.675 1.00 . C A . 102 MAN C4 1 1
7 3872 3 2 1 MAN C5 C -3.895 5.177 -5.893 1.00 . C A . 102 MAN C5 1 1
7 3873 3 2 1 MAN C6 C -3.407 6.618 -5.884 1.00 . C A . 102 MAN C6 1 1
7 3874 3 2 1 MAN H1 H -6.815 3.930 -6.944 1.00 . C A . 102 MAN H1 1 1
7 3875 3 2 1 MAN H2 H -5.381 1.968 -7.546 1.00 . C A . 102 MAN H2 1 1
7 3876 3 2 1 MAN H3 H -3.649 2.422 -5.834 1.00 . C A . 102 MAN H3 1 1
7 3877 3 2 1 MAN H4 H -2.820 4.703 -7.687 1.00 . C A . 102 MAN H4 1 1
7 3878 3 2 1 MAN H5 H -3.941 4.836 -4.833 1.00 . C A . 102 MAN H5 1 1
7 3879 3 2 1 MAN H61 H -3.436 7.013 -6.926 1.00 . C A . 102 MAN H61 1 1
7 3880 3 2 1 MAN H62 H -2.353 6.652 -5.528 1.00 . C A . 102 MAN H62 1 1
7 3881 3 2 1 MAN HO2 H -4.240 2.965 -9.290 1.00 . C A . 102 MAN HO2 1 1
7 3882 3 2 1 MAN HO3 H -2.507 1.192 -7.130 1.00 . C A . 102 MAN HO3 1 1
7 3883 3 2 1 MAN HO4 H -1.065 3.813 -6.696 1.00 . C A . 102 MAN HO4 1 1
7 3884 3 2 1 MAN HO6 H -4.074 8.385 -5.290 1.00 . C A . 102 MAN HO6 1 1
7 3885 3 2 1 MAN O1 O -5.823 3.283 -5.208 1.00 . C A . 102 MAN O1 1 1
7 3886 3 2 1 MAN O2 O -4.897 3.477 -8.801 1.00 . C A . 102 MAN O2 1 1
7 3887 3 2 1 MAN O3 O -2.721 1.993 -7.623 1.00 . C A . 102 MAN O3 1 1
7 3888 3 2 1 MAN O4 O -1.683 4.159 -6.040 1.00 . C A . 102 MAN O4 1 1
7 3889 3 2 1 MAN O5 O -5.225 5.156 -6.453 1.00 . C A . 102 MAN O5 1 1
7 3890 3 2 1 MAN O6 O -4.187 7.466 -5.032 1.00 . C A . 102 MAN O6 1 1
7 3891 4 2 1 MAN C1 C 7.616 11.110 -0.498 1.00 . D A . 103 MAN C1 1 1
7 3892 4 2 1 MAN C2 C 7.049 11.969 -1.611 1.00 . D A . 103 MAN C2 1 1
7 3893 4 2 1 MAN C3 C 6.950 11.129 -2.868 1.00 . D A . 103 MAN C3 1 1
7 3894 4 2 1 MAN C4 C 8.327 10.586 -3.233 1.00 . D A . 103 MAN C4 1 1
7 3895 4 2 1 MAN C5 C 8.930 9.825 -2.047 1.00 . D A . 103 MAN C5 1 1
7 3896 4 2 1 MAN C6 C 10.362 9.389 -2.295 1.00 . D A . 103 MAN C6 1 1
7 3897 4 2 1 MAN H1 H 7.714 11.720 0.428 1.00 . D A . 103 MAN H1 1 1
7 3898 4 2 1 MAN H2 H 6.029 12.314 -1.333 1.00 . D A . 103 MAN H2 1 1
7 3899 4 2 1 MAN H3 H 6.313 10.238 -2.649 1.00 . D A . 103 MAN H3 1 1
7 3900 4 2 1 MAN H4 H 8.994 11.456 -3.444 1.00 . D A . 103 MAN H4 1 1
7 3901 4 2 1 MAN H5 H 8.323 8.909 -1.856 1.00 . D A . 103 MAN H5 1 1
7 3902 4 2 1 MAN H61 H 10.984 10.281 -2.536 1.00 . D A . 103 MAN H61 1 1
7 3903 4 2 1 MAN H62 H 10.407 8.696 -3.166 1.00 . D A . 103 MAN H62 1 1
7 3904 4 2 1 MAN HO2 H 7.364 13.698 -2.482 1.00 . D A . 103 MAN HO2 1 1
7 3905 4 2 1 MAN HO3 H 5.441 11.488 -4.116 1.00 . D A . 103 MAN HO3 1 1
7 3906 4 2 1 MAN HO4 H 7.595 9.138 -4.378 1.00 . D A . 103 MAN HO4 1 1
7 3907 4 2 1 MAN HO6 H 10.704 9.265 -0.384 1.00 . D A . 103 MAN HO6 1 1
7 3908 4 2 1 MAN O1 O 6.762 9.989 -0.222 1.00 . D A . 103 MAN O1 1 1
7 3909 4 2 1 MAN O2 O 7.802 13.168 -1.805 1.00 . D A . 103 MAN O2 1 1
7 3910 4 2 1 MAN O3 O 6.306 11.860 -3.917 1.00 . D A . 103 MAN O3 1 1
7 3911 4 2 1 MAN O4 O 8.313 9.775 -4.409 1.00 . D A . 103 MAN O4 1 1
7 3912 4 2 1 MAN O5 O 8.924 10.638 -0.853 1.00 . D A . 103 MAN O5 1 1
7 3913 4 2 1 MAN O6 O 10.921 8.728 -1.157 1.00 . D A . 103 MAN O6 1 1
8 3914 1 1 1 THR C C -6.028 5.760 0.805 1.00 . A A . 1 THR C 1 1
8 3915 1 1 1 THR CA C -6.999 5.709 1.954 1.00 . A A . 1 THR CA 1 1
8 3916 1 1 1 THR CB C -7.959 4.483 1.857 1.00 . A A . 1 THR CB 1 1
8 3917 1 1 1 THR CG2 C -8.361 4.084 3.271 1.00 . A A . 1 THR CG2 1 1
8 3918 1 1 1 THR H1 H -8.816 6.701 2.021 1.00 . A A . 1 THR H1 1 1
8 3919 1 1 1 THR H2 H -7.572 7.602 1.286 1.00 . A A . 1 THR H2 1 1
8 3920 1 1 1 THR H3 H -7.639 7.472 2.989 1.00 . A A . 1 THR H3 1 1
8 3921 1 1 1 THR HA H -6.397 5.606 2.840 1.00 . A A . 1 THR HA 1 1
8 3922 1 1 1 THR HB H -7.500 3.614 1.345 1.00 . A A . 1 THR HB 1 1
8 3923 1 1 1 THR HG21 H -8.734 4.929 3.878 1.00 . A A . 1 THR HG21 1 1
8 3924 1 1 1 THR HG22 H -7.463 3.684 3.784 1.00 . A A . 1 THR HG22 1 1
8 3925 1 1 1 THR HG23 H -9.127 3.281 3.286 1.00 . A A . 1 THR HG23 1 1
8 3926 1 1 1 THR N N -7.808 6.979 2.094 1.00 . A A . 1 THR N 1 1
8 3927 1 1 1 THR O O -5.848 6.841 0.269 1.00 . A A . 1 THR O 1 1
8 3928 1 1 2 GLN C C -5.320 3.818 -1.943 1.00 . A A . 2 GLN C 1 1
8 3929 1 1 2 GLN CA C -4.602 4.524 -0.801 1.00 . A A . 2 GLN CA 1 1
8 3930 1 1 2 GLN CB C -3.313 3.712 -0.554 1.00 . A A . 2 GLN CB 1 1
8 3931 1 1 2 GLN CD C -1.823 5.175 -1.852 1.00 . A A . 2 GLN CD 1 1
8 3932 1 1 2 GLN CG C -2.412 3.779 -1.809 1.00 . A A . 2 GLN CG 1 1
8 3933 1 1 2 GLN H H -5.361 3.838 1.025 1.00 . A A . 2 GLN H 1 1
8 3934 1 1 2 GLN HA H -4.361 5.518 -1.162 1.00 . A A . 2 GLN HA 1 1
8 3935 1 1 2 GLN HB2 H -2.797 4.137 0.337 1.00 . A A . 2 GLN HB2 1 1
8 3936 1 1 2 GLN HB3 H -3.503 2.658 -0.268 1.00 . A A . 2 GLN HB3 1 1
8 3937 1 1 2 GLN HE21 H -0.597 4.677 -0.301 1.00 . A A . 2 GLN HE21 1 1
8 3938 1 1 2 GLN HE22 H -0.658 6.370 -0.694 1.00 . A A . 2 GLN HE22 1 1
8 3939 1 1 2 GLN HG2 H -1.624 3.015 -1.782 1.00 . A A . 2 GLN HG2 1 1
8 3940 1 1 2 GLN HG3 H -2.941 3.639 -2.772 1.00 . A A . 2 GLN HG3 1 1
8 3941 1 1 2 GLN N N -5.396 4.630 0.410 1.00 . A A . 2 GLN N 1 1
8 3942 1 1 2 GLN NE2 N -0.933 5.431 -0.881 1.00 . A A . 2 GLN NE2 1 1
8 3943 1 1 2 GLN O O -5.894 4.435 -2.828 1.00 . A A . 2 GLN O 1 1
8 3944 1 1 2 GLN OE1 O -2.179 6.034 -2.650 1.00 . A A . 2 GLN OE1 1 1
8 3945 1 1 3 SER C C -5.997 0.286 -2.602 1.00 . A A . 3 SER C 1 1
8 3946 1 1 3 SER CA C -5.928 1.730 -3.032 1.00 . A A . 3 SER CA 1 1
8 3947 1 1 3 SER CB C -5.246 1.882 -4.424 1.00 . A A . 3 SER CB 1 1
8 3948 1 1 3 SER H H -4.822 1.932 -1.280 1.00 . A A . 3 SER H 1 1
8 3949 1 1 3 SER HA H -6.941 2.082 -3.058 1.00 . A A . 3 SER HA 1 1
8 3950 1 1 3 SER HB2 H -5.157 2.947 -4.728 1.00 . A A . 3 SER HB2 1 1
8 3951 1 1 3 SER HB3 H -4.232 1.440 -4.415 1.00 . A A . 3 SER HB3 1 1
8 3952 1 1 3 SER N N -5.300 2.474 -1.969 1.00 . A A . 3 SER N 1 1
8 3953 1 1 3 SER O O -5.717 -0.008 -1.456 1.00 . A A . 3 SER O 1 1
8 3954 1 1 4 HIS C C -5.382 -2.414 -4.367 1.00 . A A . 4 HIS C 1 1
8 3955 1 1 4 HIS CA C -6.436 -2.053 -3.381 1.00 . A A . 4 HIS CA 1 1
8 3956 1 1 4 HIS CB C -7.754 -2.733 -3.850 1.00 . A A . 4 HIS CB 1 1
8 3957 1 1 4 HIS CD2 C -6.944 -5.002 -2.877 1.00 . A A . 4 HIS CD2 1 1
8 3958 1 1 4 HIS CE1 C -8.658 -6.229 -3.465 1.00 . A A . 4 HIS CE1 1 1
8 3959 1 1 4 HIS CG C -7.782 -4.222 -3.600 1.00 . A A . 4 HIS CG 1 1
8 3960 1 1 4 HIS H H -6.553 -0.287 -4.440 1.00 . A A . 4 HIS H 1 1
8 3961 1 1 4 HIS HA H -6.135 -2.360 -2.388 1.00 . A A . 4 HIS HA 1 1
8 3962 1 1 4 HIS HB2 H -8.597 -2.278 -3.287 1.00 . A A . 4 HIS HB2 1 1
8 3963 1 1 4 HIS HB3 H -7.945 -2.543 -4.929 1.00 . A A . 4 HIS HB3 1 1
8 3964 1 1 4 HIS HD1 H -9.663 -4.709 -4.449 1.00 . A A . 4 HIS HD1 1 1
8 3965 1 1 4 HIS HD2 H -6.036 -4.742 -2.342 1.00 . A A . 4 HIS HD2 1 1
8 3966 1 1 4 HIS HE1 H -9.287 -7.093 -3.626 1.00 . A A . 4 HIS HE1 1 1
8 3967 1 1 4 HIS HE2 H -7.247 -6.919 -2.100 1.00 . A A . 4 HIS HE2 1 1
8 3968 1 1 4 HIS N N -6.408 -0.621 -3.504 1.00 . A A . 4 HIS N 1 1
8 3969 1 1 4 HIS ND1 N -8.842 -5.013 -3.969 1.00 . A A . 4 HIS ND1 1 1
8 3970 1 1 4 HIS NE2 N -7.524 -6.237 -2.793 1.00 . A A . 4 HIS NE2 1 1
8 3971 1 1 4 HIS O O -5.490 -2.089 -5.540 1.00 . A A . 4 HIS O 1 1
8 3972 1 1 5 TYR C C -2.208 -2.209 -4.850 1.00 . A A . 5 TYR C 1 1
8 3973 1 1 5 TYR CA C -3.114 -3.380 -4.566 1.00 . A A . 5 TYR CA 1 1
8 3974 1 1 5 TYR CB C -3.344 -4.135 -5.895 1.00 . A A . 5 TYR CB 1 1
8 3975 1 1 5 TYR CD1 C -4.182 -6.282 -4.869 1.00 . A A . 5 TYR CD1 1 1
8 3976 1 1 5 TYR CD2 C -5.570 -5.110 -6.474 1.00 . A A . 5 TYR CD2 1 1
8 3977 1 1 5 TYR CE1 C -5.162 -7.278 -4.757 1.00 . A A . 5 TYR CE1 1 1
8 3978 1 1 5 TYR CE2 C -6.546 -6.103 -6.366 1.00 . A A . 5 TYR CE2 1 1
8 3979 1 1 5 TYR CG C -4.381 -5.196 -5.736 1.00 . A A . 5 TYR CG 1 1
8 3980 1 1 5 TYR CZ C -6.334 -7.194 -5.518 1.00 . A A . 5 TYR CZ 1 1
8 3981 1 1 5 TYR H H -4.297 -3.234 -2.878 1.00 . A A . 5 TYR H 1 1
8 3982 1 1 5 TYR HA H -2.591 -4.031 -3.887 1.00 . A A . 5 TYR HA 1 1
8 3983 1 1 5 TYR HB2 H -3.665 -3.426 -6.690 1.00 . A A . 5 TYR HB2 1 1
8 3984 1 1 5 TYR HB3 H -2.411 -4.626 -6.238 1.00 . A A . 5 TYR HB3 1 1
8 3985 1 1 5 TYR HD1 H -3.270 -6.354 -4.293 1.00 . A A . 5 TYR HD1 1 1
8 3986 1 1 5 TYR HD2 H -5.728 -4.260 -7.124 1.00 . A A . 5 TYR HD2 1 1
8 3987 1 1 5 TYR HE1 H -5.013 -8.111 -4.084 1.00 . A A . 5 TYR HE1 1 1
8 3988 1 1 5 TYR HE2 H -7.461 -6.008 -6.929 1.00 . A A . 5 TYR HE2 1 1
8 3989 1 1 5 TYR HH H -7.719 -8.288 -6.272 1.00 . A A . 5 TYR HH 1 1
8 3990 1 1 5 TYR N N -4.303 -2.992 -3.858 1.00 . A A . 5 TYR N 1 1
8 3991 1 1 5 TYR O O -1.199 -2.389 -5.516 1.00 . A A . 5 TYR O 1 1
8 3992 1 1 5 TYR OH O -7.332 -8.177 -5.400 1.00 . A A . 5 TYR OH 1 1
8 3993 1 1 6 GLY C C -0.781 0.128 -3.086 1.00 . A A . 6 GLY C 1 1
8 3994 1 1 6 GLY CA C -1.626 0.137 -4.318 1.00 . A A . 6 GLY CA 1 1
8 3995 1 1 6 GLY H H -3.396 -0.930 -3.846 1.00 . A A . 6 GLY H 1 1
8 3996 1 1 6 GLY HA2 H -0.966 0.089 -5.175 1.00 . A A . 6 GLY HA2 1 1
8 3997 1 1 6 GLY HA3 H -2.205 1.044 -4.290 1.00 . A A . 6 GLY HA3 1 1
8 3998 1 1 6 GLY N N -2.529 -1.007 -4.323 1.00 . A A . 6 GLY N 1 1
8 3999 1 1 6 GLY O O -0.866 -0.776 -2.259 1.00 . A A . 6 GLY O 1 1
8 4000 1 1 7 GLN C C 0.634 1.868 -0.588 1.00 . A A . 7 GLN C 1 1
8 4001 1 1 7 GLN CA C 1.046 1.165 -1.876 1.00 . A A . 7 GLN CA 1 1
8 4002 1 1 7 GLN CB C 2.277 1.899 -2.429 1.00 . A A . 7 GLN CB 1 1
8 4003 1 1 7 GLN CD C 4.802 1.660 -2.295 1.00 . A A . 7 GLN CD 1 1
8 4004 1 1 7 GLN CG C 3.493 1.692 -1.517 1.00 . A A . 7 GLN CG 1 1
8 4005 1 1 7 GLN H H 0.093 1.919 -3.558 1.00 . A A . 7 GLN H 1 1
8 4006 1 1 7 GLN HA H 1.326 0.146 -1.647 1.00 . A A . 7 GLN HA 1 1
8 4007 1 1 7 GLN HB2 H 2.476 1.503 -3.445 1.00 . A A . 7 GLN HB2 1 1
8 4008 1 1 7 GLN HB3 H 2.074 2.980 -2.571 1.00 . A A . 7 GLN HB3 1 1
8 4009 1 1 7 GLN HE21 H 5.644 0.753 -0.710 1.00 . A A . 7 GLN HE21 1 1
8 4010 1 1 7 GLN HE22 H 6.651 0.858 -2.167 1.00 . A A . 7 GLN HE22 1 1
8 4011 1 1 7 GLN HG2 H 3.537 2.469 -0.732 1.00 . A A . 7 GLN HG2 1 1
8 4012 1 1 7 GLN HG3 H 3.371 0.710 -1.013 1.00 . A A . 7 GLN HG3 1 1
8 4013 1 1 7 GLN N N 0.037 1.169 -2.906 1.00 . A A . 7 GLN N 1 1
8 4014 1 1 7 GLN NE2 N 5.816 1.042 -1.655 1.00 . A A . 7 GLN NE2 1 1
8 4015 1 1 7 GLN O O 0.323 3.048 -0.592 1.00 . A A . 7 GLN O 1 1
8 4016 1 1 7 GLN OE1 O 4.944 2.085 -3.436 1.00 . A A . 7 GLN OE1 1 1
8 4017 1 1 8 CYS C C 1.752 2.270 2.490 1.00 . A A . 8 CYS C 1 1
8 4018 1 1 8 CYS CA C 0.431 1.912 1.848 1.00 . A A . 8 CYS CA 1 1
8 4019 1 1 8 CYS CB C -0.464 1.057 2.810 1.00 . A A . 8 CYS CB 1 1
8 4020 1 1 8 CYS H H 0.909 0.238 0.598 1.00 . A A . 8 CYS H 1 1
8 4021 1 1 8 CYS HA H -0.067 2.860 1.690 1.00 . A A . 8 CYS HA 1 1
8 4022 1 1 8 CYS HB2 H -1.488 1.466 2.670 1.00 . A A . 8 CYS HB2 1 1
8 4023 1 1 8 CYS HB3 H -0.452 0.013 2.430 1.00 . A A . 8 CYS HB3 1 1
8 4024 1 1 8 CYS N N 0.645 1.205 0.579 1.00 . A A . 8 CYS N 1 1
8 4025 1 1 8 CYS O O 1.843 3.141 3.344 1.00 . A A . 8 CYS O 1 1
8 4026 1 1 8 CYS SG S -0.130 1.042 4.619 1.00 . A A . 8 CYS SG 1 1
8 4027 1 1 9 GLY C C 5.158 1.319 1.796 1.00 . A A . 9 GLY C 1 1
8 4028 1 1 9 GLY CA C 4.109 1.768 2.742 1.00 . A A . 9 GLY CA 1 1
8 4029 1 1 9 GLY H H 2.786 0.985 1.302 1.00 . A A . 9 GLY H 1 1
8 4030 1 1 9 GLY HA2 H 4.291 2.803 2.997 1.00 . A A . 9 GLY HA2 1 1
8 4031 1 1 9 GLY HA3 H 4.115 1.094 3.588 1.00 . A A . 9 GLY HA3 1 1
8 4032 1 1 9 GLY N N 2.837 1.626 2.065 1.00 . A A . 9 GLY N 1 1
8 4033 1 1 9 GLY O O 4.903 0.545 0.880 1.00 . A A . 9 GLY O 1 1
8 4034 1 1 10 GLY C C 8.713 1.861 1.656 1.00 . A A . 10 GLY C 1 1
8 4035 1 1 10 GLY CA C 7.460 1.346 1.079 1.00 . A A . 10 GLY CA 1 1
8 4036 1 1 10 GLY H H 6.641 2.421 2.676 1.00 . A A . 10 GLY H 1 1
8 4037 1 1 10 GLY HA2 H 7.503 0.266 1.044 1.00 . A A . 10 GLY HA2 1 1
8 4038 1 1 10 GLY HA3 H 7.355 1.835 0.126 1.00 . A A . 10 GLY HA3 1 1
8 4039 1 1 10 GLY N N 6.391 1.779 1.948 1.00 . A A . 10 GLY N 1 1
8 4040 1 1 10 GLY O O 8.681 2.664 2.577 1.00 . A A . 10 GLY O 1 1
8 4041 1 1 11 ILE C C 11.293 3.478 1.103 1.00 . A A . 11 ILE C 1 1
8 4042 1 1 11 ILE CA C 11.149 2.009 1.478 1.00 . A A . 11 ILE CA 1 1
8 4043 1 1 11 ILE CB C 12.274 1.132 0.934 1.00 . A A . 11 ILE CB 1 1
8 4044 1 1 11 ILE CD1 C 13.578 0.122 2.943 1.00 . A A . 11 ILE CD1 1 1
8 4045 1 1 11 ILE CG1 C 12.475 -0.067 1.896 1.00 . A A . 11 ILE CG1 1 1
8 4046 1 1 11 ILE CG2 C 13.582 1.915 0.674 1.00 . A A . 11 ILE CG2 1 1
8 4047 1 1 11 ILE H H 9.849 0.785 0.359 1.00 . A A . 11 ILE H 1 1
8 4048 1 1 11 ILE HA H 11.210 1.994 2.559 1.00 . A A . 11 ILE HA 1 1
8 4049 1 1 11 ILE HB H 11.934 0.728 -0.048 1.00 . A A . 11 ILE HB 1 1
8 4050 1 1 11 ILE HD11 H 13.558 -0.716 3.673 1.00 . A A . 11 ILE HD11 1 1
8 4051 1 1 11 ILE HD12 H 13.440 1.075 3.496 1.00 . A A . 11 ILE HD12 1 1
8 4052 1 1 11 ILE HD13 H 14.580 0.126 2.463 1.00 . A A . 11 ILE HD13 1 1
8 4053 1 1 11 ILE HG12 H 11.517 -0.277 2.421 1.00 . A A . 11 ILE HG12 1 1
8 4054 1 1 11 ILE HG13 H 12.722 -0.977 1.310 1.00 . A A . 11 ILE HG13 1 1
8 4055 1 1 11 ILE HG21 H 13.871 2.501 1.575 1.00 . A A . 11 ILE HG21 1 1
8 4056 1 1 11 ILE HG22 H 13.468 2.619 -0.177 1.00 . A A . 11 ILE HG22 1 1
8 4057 1 1 11 ILE HG23 H 14.410 1.221 0.434 1.00 . A A . 11 ILE HG23 1 1
8 4058 1 1 11 ILE N N 9.856 1.451 1.098 1.00 . A A . 11 ILE N 1 1
8 4059 1 1 11 ILE O O 11.903 4.274 1.809 1.00 . A A . 11 ILE O 1 1
8 4060 1 1 12 GLY C C 9.393 5.655 -0.991 1.00 . A A . 12 GLY C 1 1
8 4061 1 1 12 GLY CA C 10.757 5.213 -0.579 1.00 . A A . 12 GLY CA 1 1
8 4062 1 1 12 GLY H H 10.176 3.194 -0.557 1.00 . A A . 12 GLY H 1 1
8 4063 1 1 12 GLY HA2 H 11.093 5.911 0.176 1.00 . A A . 12 GLY HA2 1 1
8 4064 1 1 12 GLY HA3 H 11.376 5.206 -1.463 1.00 . A A . 12 GLY HA3 1 1
8 4065 1 1 12 GLY N N 10.700 3.860 -0.041 1.00 . A A . 12 GLY N 1 1
8 4066 1 1 12 GLY O O 9.213 6.360 -1.974 1.00 . A A . 12 GLY O 1 1
8 4067 1 1 13 TYR C C 6.601 6.860 0.133 1.00 . A A . 13 TYR C 1 1
8 4068 1 1 13 TYR CA C 7.009 5.597 -0.613 1.00 . A A . 13 TYR CA 1 1
8 4069 1 1 13 TYR CB C 6.007 4.461 -0.314 1.00 . A A . 13 TYR CB 1 1
8 4070 1 1 13 TYR CD1 C 4.562 4.993 -2.262 1.00 . A A . 13 TYR CD1 1 1
8 4071 1 1 13 TYR CD2 C 3.554 5.043 -0.054 1.00 . A A . 13 TYR CD2 1 1
8 4072 1 1 13 TYR CE1 C 3.353 5.370 -2.835 1.00 . A A . 13 TYR CE1 1 1
8 4073 1 1 13 TYR CE2 C 2.328 5.394 -0.635 1.00 . A A . 13 TYR CE2 1 1
8 4074 1 1 13 TYR CG C 4.674 4.833 -0.873 1.00 . A A . 13 TYR CG 1 1
8 4075 1 1 13 TYR CZ C 2.242 5.561 -2.029 1.00 . A A . 13 TYR CZ 1 1
8 4076 1 1 13 TYR H H 8.497 4.674 0.555 1.00 . A A . 13 TYR H 1 1
8 4077 1 1 13 TYR HA H 6.967 5.824 -1.671 1.00 . A A . 13 TYR HA 1 1
8 4078 1 1 13 TYR HB2 H 6.335 3.536 -0.825 1.00 . A A . 13 TYR HB2 1 1
8 4079 1 1 13 TYR HB3 H 5.925 4.274 0.778 1.00 . A A . 13 TYR HB3 1 1
8 4080 1 1 13 TYR HD1 H 5.410 4.806 -2.905 1.00 . A A . 13 TYR HD1 1 1
8 4081 1 1 13 TYR HD2 H 3.631 4.922 1.018 1.00 . A A . 13 TYR HD2 1 1
8 4082 1 1 13 TYR HE1 H 3.258 5.464 -3.908 1.00 . A A . 13 TYR HE1 1 1
8 4083 1 1 13 TYR HE2 H 1.476 5.514 0.013 1.00 . A A . 13 TYR HE2 1 1
8 4084 1 1 13 TYR HH H 0.336 5.518 -2.169 1.00 . A A . 13 TYR HH 1 1
8 4085 1 1 13 TYR N N 8.355 5.199 -0.279 1.00 . A A . 13 TYR N 1 1
8 4086 1 1 13 TYR O O 6.844 7.004 1.328 1.00 . A A . 13 TYR O 1 1
8 4087 1 1 13 TYR OH O 1.061 5.840 -2.717 1.00 . A A . 13 TYR OH 1 1
8 4088 1 1 14 SER C C 4.128 9.424 -0.308 1.00 . A A . 14 SER C 1 1
8 4089 1 1 14 SER CA C 5.560 9.068 0.024 1.00 . A A . 14 SER CA 1 1
8 4090 1 1 14 SER CB C 6.473 10.231 -0.433 1.00 . A A . 14 SER CB 1 1
8 4091 1 1 14 SER H H 5.767 7.667 -1.538 1.00 . A A . 14 SER H 1 1
8 4092 1 1 14 SER HA H 5.615 8.998 1.101 1.00 . A A . 14 SER HA 1 1
8 4093 1 1 14 SER HB2 H 6.104 10.726 -1.353 1.00 . A A . 14 SER HB2 1 1
8 4094 1 1 14 SER HB3 H 6.584 10.969 0.390 1.00 . A A . 14 SER HB3 1 1
8 4095 1 1 14 SER N N 5.927 7.791 -0.564 1.00 . A A . 14 SER N 1 1
8 4096 1 1 14 SER O O 3.840 10.429 -0.950 1.00 . A A . 14 SER O 1 1
8 4097 1 1 15 GLY C C 0.901 8.329 0.946 1.00 . A A . 15 GLY C 1 1
8 4098 1 1 15 GLY CA C 1.760 8.825 -0.183 1.00 . A A . 15 GLY CA 1 1
8 4099 1 1 15 GLY H H 3.388 7.802 0.682 1.00 . A A . 15 GLY H 1 1
8 4100 1 1 15 GLY HA2 H 1.575 9.888 -0.267 1.00 . A A . 15 GLY HA2 1 1
8 4101 1 1 15 GLY HA3 H 1.531 8.268 -1.080 1.00 . A A . 15 GLY HA3 1 1
8 4102 1 1 15 GLY N N 3.166 8.590 0.109 1.00 . A A . 15 GLY N 1 1
8 4103 1 1 15 GLY O O 1.418 8.045 2.023 1.00 . A A . 15 GLY O 1 1
8 4104 1 1 16 PRO C C -0.906 6.371 2.466 1.00 . A A . 16 PRO C 1 1
8 4105 1 1 16 PRO CA C -1.343 7.655 1.744 1.00 . A A . 16 PRO CA 1 1
8 4106 1 1 16 PRO CB C -2.669 7.493 0.980 1.00 . A A . 16 PRO CB 1 1
8 4107 1 1 16 PRO CD C -1.094 8.711 -0.442 1.00 . A A . 16 PRO CD 1 1
8 4108 1 1 16 PRO CG C -2.591 8.466 -0.210 1.00 . A A . 16 PRO CG 1 1
8 4109 1 1 16 PRO HA H -1.420 8.403 2.519 1.00 . A A . 16 PRO HA 1 1
8 4110 1 1 16 PRO HB2 H -2.774 6.461 0.586 1.00 . A A . 16 PRO HB2 1 1
8 4111 1 1 16 PRO HB3 H -3.546 7.707 1.620 1.00 . A A . 16 PRO HB3 1 1
8 4112 1 1 16 PRO HD2 H -0.745 8.143 -1.336 1.00 . A A . 16 PRO HD2 1 1
8 4113 1 1 16 PRO HD3 H -0.894 9.795 -0.602 1.00 . A A . 16 PRO HD3 1 1
8 4114 1 1 16 PRO HG2 H -3.067 8.035 -1.120 1.00 . A A . 16 PRO HG2 1 1
8 4115 1 1 16 PRO HG3 H -3.094 9.424 0.035 1.00 . A A . 16 PRO HG3 1 1
8 4116 1 1 16 PRO N N -0.415 8.224 0.764 1.00 . A A . 16 PRO N 1 1
8 4117 1 1 16 PRO O O -0.474 5.417 1.833 1.00 . A A . 16 PRO O 1 1
8 4118 1 1 17 THR C C -1.726 4.428 5.226 1.00 . A A . 17 THR C 1 1
8 4119 1 1 17 THR CA C -0.568 5.184 4.607 1.00 . A A . 17 THR CA 1 1
8 4120 1 1 17 THR CB C 0.400 5.699 5.662 1.00 . A A . 17 THR CB 1 1
8 4121 1 1 17 THR CG2 C -0.314 6.603 6.684 1.00 . A A . 17 THR CG2 1 1
8 4122 1 1 17 THR H H -1.419 7.081 4.294 1.00 . A A . 17 THR H 1 1
8 4123 1 1 17 THR HA H -0.038 4.474 3.990 1.00 . A A . 17 THR HA 1 1
8 4124 1 1 17 THR HB H 1.182 6.286 5.121 1.00 . A A . 17 THR HB 1 1
8 4125 1 1 17 THR HG1 H 1.263 4.983 7.233 1.00 . A A . 17 THR HG1 1 1
8 4126 1 1 17 THR HG21 H -0.641 6.019 7.571 1.00 . A A . 17 THR HG21 1 1
8 4127 1 1 17 THR HG22 H -1.213 7.085 6.252 1.00 . A A . 17 THR HG22 1 1
8 4128 1 1 17 THR HG23 H 0.377 7.405 7.016 1.00 . A A . 17 THR HG23 1 1
8 4129 1 1 17 THR N N -1.074 6.298 3.792 1.00 . A A . 17 THR N 1 1
8 4130 1 1 17 THR O O -1.648 3.714 6.218 1.00 . A A . 17 THR O 1 1
8 4131 1 1 17 THR OG1 O 1.056 4.652 6.358 1.00 . A A . 17 THR OG1 1 1
8 4132 1 1 18 VAL C C -4.593 3.112 3.951 1.00 . A A . 18 VAL C 1 1
8 4133 1 1 18 VAL CA C -4.097 3.912 5.112 1.00 . A A . 18 VAL CA 1 1
8 4134 1 1 18 VAL CB C -5.172 4.880 5.598 1.00 . A A . 18 VAL CB 1 1
8 4135 1 1 18 VAL CG1 C -6.379 4.120 6.187 1.00 . A A . 18 VAL CG1 1 1
8 4136 1 1 18 VAL CG2 C -4.550 5.776 6.683 1.00 . A A . 18 VAL CG2 1 1
8 4137 1 1 18 VAL H H -2.952 5.097 3.782 1.00 . A A . 18 VAL H 1 1
8 4138 1 1 18 VAL HA H -3.870 3.216 5.909 1.00 . A A . 18 VAL HA 1 1
8 4139 1 1 18 VAL HB H -5.512 5.528 4.763 1.00 . A A . 18 VAL HB 1 1
8 4140 1 1 18 VAL HG11 H -6.184 3.853 7.248 1.00 . A A . 18 VAL HG11 1 1
8 4141 1 1 18 VAL HG12 H -6.604 3.176 5.653 1.00 . A A . 18 VAL HG12 1 1
8 4142 1 1 18 VAL HG13 H -7.289 4.756 6.160 1.00 . A A . 18 VAL HG13 1 1
8 4143 1 1 18 VAL HG21 H -3.960 6.602 6.237 1.00 . A A . 18 VAL HG21 1 1
8 4144 1 1 18 VAL HG22 H -3.868 5.172 7.325 1.00 . A A . 18 VAL HG22 1 1
8 4145 1 1 18 VAL HG23 H -5.337 6.207 7.336 1.00 . A A . 18 VAL HG23 1 1
8 4146 1 1 18 VAL N N -2.912 4.584 4.629 1.00 . A A . 18 VAL N 1 1
8 4147 1 1 18 VAL O O -5.007 3.658 2.927 1.00 . A A . 18 VAL O 1 1
8 4148 1 1 19 CYS C C -6.691 1.130 3.016 1.00 . A A . 19 CYS C 1 1
8 4149 1 1 19 CYS CA C -5.201 0.942 3.058 1.00 . A A . 19 CYS CA 1 1
8 4150 1 1 19 CYS CB C -4.801 -0.513 3.266 1.00 . A A . 19 CYS CB 1 1
8 4151 1 1 19 CYS H H -4.204 1.328 4.857 1.00 . A A . 19 CYS H 1 1
8 4152 1 1 19 CYS HA H -4.864 1.265 2.088 1.00 . A A . 19 CYS HA 1 1
8 4153 1 1 19 CYS HB2 H -4.896 -0.769 4.345 1.00 . A A . 19 CYS HB2 1 1
8 4154 1 1 19 CYS HB3 H -5.427 -1.234 2.720 1.00 . A A . 19 CYS HB3 1 1
8 4155 1 1 19 CYS N N -4.567 1.784 4.046 1.00 . A A . 19 CYS N 1 1
8 4156 1 1 19 CYS O O -7.310 1.396 4.037 1.00 . A A . 19 CYS O 1 1
8 4157 1 1 19 CYS SG S -3.105 -0.720 2.700 1.00 . A A . 19 CYS SG 1 1
8 4158 1 1 20 ALA C C -9.585 0.505 2.514 1.00 . A A . 20 ALA C 1 1
8 4159 1 1 20 ALA CA C -8.693 1.137 1.489 1.00 . A A . 20 ALA CA 1 1
8 4160 1 1 20 ALA CB C -9.000 0.561 0.081 1.00 . A A . 20 ALA CB 1 1
8 4161 1 1 20 ALA H H -6.714 0.727 1.042 1.00 . A A . 20 ALA H 1 1
8 4162 1 1 20 ALA HA H -8.975 2.159 1.537 1.00 . A A . 20 ALA HA 1 1
8 4163 1 1 20 ALA HB1 H -9.186 -0.533 0.139 1.00 . A A . 20 ALA HB1 1 1
8 4164 1 1 20 ALA HB2 H -8.136 0.709 -0.599 1.00 . A A . 20 ALA HB2 1 1
8 4165 1 1 20 ALA HB3 H -9.904 1.017 -0.370 1.00 . A A . 20 ALA HB3 1 1
8 4166 1 1 20 ALA N N -7.268 1.091 1.790 1.00 . A A . 20 ALA N 1 1
8 4167 1 1 20 ALA O O -9.213 -0.475 3.115 1.00 . A A . 20 ALA O 1 1
8 4168 1 1 21 SER C C -12.106 -0.993 3.539 1.00 . A A . 21 SER C 1 1
8 4169 1 1 21 SER CA C -11.685 0.456 3.757 1.00 . A A . 21 SER CA 1 1
8 4170 1 1 21 SER CB C -12.937 1.364 3.869 1.00 . A A . 21 SER CB 1 1
8 4171 1 1 21 SER H H -11.205 1.776 2.259 1.00 . A A . 21 SER H 1 1
8 4172 1 1 21 SER HA H -11.161 0.461 4.705 1.00 . A A . 21 SER HA 1 1
8 4173 1 1 21 SER HB2 H -13.840 0.790 4.180 1.00 . A A . 21 SER HB2 1 1
8 4174 1 1 21 SER HB3 H -12.731 2.125 4.656 1.00 . A A . 21 SER HB3 1 1
8 4175 1 1 21 SER HG H -13.994 2.533 2.704 1.00 . A A . 21 SER HG 1 1
8 4176 1 1 21 SER N N -10.795 1.004 2.743 1.00 . A A . 21 SER N 1 1
8 4177 1 1 21 SER O O -12.593 -1.650 4.450 1.00 . A A . 21 SER O 1 1
8 4178 1 1 21 SER OG O -13.160 2.054 2.630 1.00 . A A . 21 SER OG 1 1
8 4179 1 1 22 GLY C C -10.664 -3.659 1.904 1.00 . A A . 22 GLY C 1 1
8 4180 1 1 22 GLY CA C -11.984 -2.933 1.977 1.00 . A A . 22 GLY CA 1 1
8 4181 1 1 22 GLY H H -11.518 -0.906 1.627 1.00 . A A . 22 GLY H 1 1
8 4182 1 1 22 GLY HA2 H -12.586 -3.450 2.710 1.00 . A A . 22 GLY HA2 1 1
8 4183 1 1 22 GLY HA3 H -12.399 -2.986 0.983 1.00 . A A . 22 GLY HA3 1 1
8 4184 1 1 22 GLY N N -11.875 -1.519 2.319 1.00 . A A . 22 GLY N 1 1
8 4185 1 1 22 GLY O O -10.639 -4.824 1.532 1.00 . A A . 22 GLY O 1 1
8 4186 1 1 23 THR C C -7.365 -3.216 3.308 1.00 . A A . 23 THR C 1 1
8 4187 1 1 23 THR CA C -8.184 -3.490 2.042 1.00 . A A . 23 THR CA 1 1
8 4188 1 1 23 THR CB C -7.389 -2.867 0.879 1.00 . A A . 23 THR CB 1 1
8 4189 1 1 23 THR CG2 C -8.097 -2.918 -0.475 1.00 . A A . 23 THR CG2 1 1
8 4190 1 1 23 THR H H -9.605 -2.064 2.608 1.00 . A A . 23 THR H 1 1
8 4191 1 1 23 THR HA H -8.238 -4.557 1.910 1.00 . A A . 23 THR HA 1 1
8 4192 1 1 23 THR HB H -6.413 -3.376 0.777 1.00 . A A . 23 THR HB 1 1
8 4193 1 1 23 THR HG1 H -7.612 -1.287 1.881 1.00 . A A . 23 THR HG1 1 1
8 4194 1 1 23 THR HG21 H -7.782 -2.064 -1.110 1.00 . A A . 23 THR HG21 1 1
8 4195 1 1 23 THR HG22 H -9.196 -2.887 -0.373 1.00 . A A . 23 THR HG22 1 1
8 4196 1 1 23 THR HG23 H -7.818 -3.863 -0.973 1.00 . A A . 23 THR HG23 1 1
8 4197 1 1 23 THR N N -9.543 -2.974 2.191 1.00 . A A . 23 THR N 1 1
8 4198 1 1 23 THR O O -7.667 -2.343 4.112 1.00 . A A . 23 THR O 1 1
8 4199 1 1 23 THR OG1 O -7.094 -1.508 1.085 1.00 . A A . 23 THR OG1 1 1
8 4200 1 1 24 THR C C -3.942 -3.653 4.304 1.00 . A A . 24 THR C 1 1
8 4201 1 1 24 THR CA C -5.403 -3.777 4.673 1.00 . A A . 24 THR CA 1 1
8 4202 1 1 24 THR CB C -5.663 -4.941 5.626 1.00 . A A . 24 THR CB 1 1
8 4203 1 1 24 THR CG2 C -4.489 -5.326 6.535 1.00 . A A . 24 THR CG2 1 1
8 4204 1 1 24 THR H H -6.092 -4.699 2.874 1.00 . A A . 24 THR H 1 1
8 4205 1 1 24 THR HA H -5.640 -2.857 5.191 1.00 . A A . 24 THR HA 1 1
8 4206 1 1 24 THR HB H -5.973 -5.828 5.016 1.00 . A A . 24 THR HB 1 1
8 4207 1 1 24 THR HG1 H -6.472 -4.944 7.369 1.00 . A A . 24 THR HG1 1 1
8 4208 1 1 24 THR HG21 H -4.157 -4.453 7.136 1.00 . A A . 24 THR HG21 1 1
8 4209 1 1 24 THR HG22 H -3.630 -5.693 5.939 1.00 . A A . 24 THR HG22 1 1
8 4210 1 1 24 THR HG23 H -4.789 -6.141 7.227 1.00 . A A . 24 THR HG23 1 1
8 4211 1 1 24 THR N N -6.237 -3.904 3.485 1.00 . A A . 24 THR N 1 1
8 4212 1 1 24 THR O O -3.494 -4.180 3.291 1.00 . A A . 24 THR O 1 1
8 4213 1 1 24 THR OG1 O -6.703 -4.577 6.516 1.00 . A A . 24 THR OG1 1 1
8 4214 1 1 25 CYS C C -0.960 -4.081 5.112 1.00 . A A . 25 CYS C 1 1
8 4215 1 1 25 CYS CA C -1.691 -2.779 4.850 1.00 . A A . 25 CYS CA 1 1
8 4216 1 1 25 CYS CB C -1.014 -1.686 5.733 1.00 . A A . 25 CYS CB 1 1
8 4217 1 1 25 CYS H H -3.480 -2.463 5.907 1.00 . A A . 25 CYS H 1 1
8 4218 1 1 25 CYS HA H -1.529 -2.549 3.807 1.00 . A A . 25 CYS HA 1 1
8 4219 1 1 25 CYS HB2 H -1.158 -1.967 6.800 1.00 . A A . 25 CYS HB2 1 1
8 4220 1 1 25 CYS HB3 H 0.082 -1.684 5.542 1.00 . A A . 25 CYS HB3 1 1
8 4221 1 1 25 CYS N N -3.127 -2.906 5.091 1.00 . A A . 25 CYS N 1 1
8 4222 1 1 25 CYS O O -0.949 -4.584 6.234 1.00 . A A . 25 CYS O 1 1
8 4223 1 1 25 CYS SG S -1.646 0.012 5.516 1.00 . A A . 25 CYS SG 1 1
8 4224 1 1 26 GLN C C 1.702 -5.788 3.479 1.00 . A A . 26 GLN C 1 1
8 4225 1 1 26 GLN CA C 0.413 -5.894 4.263 1.00 . A A . 26 GLN CA 1 1
8 4226 1 1 26 GLN CB C -0.394 -7.143 3.810 1.00 . A A . 26 GLN CB 1 1
8 4227 1 1 26 GLN CD C -2.657 -8.357 3.847 1.00 . A A . 26 GLN CD 1 1
8 4228 1 1 26 GLN CG C -1.864 -7.134 4.303 1.00 . A A . 26 GLN CG 1 1
8 4229 1 1 26 GLN H H -0.367 -4.289 3.152 1.00 . A A . 26 GLN H 1 1
8 4230 1 1 26 GLN HA H 0.689 -6.011 5.302 1.00 . A A . 26 GLN HA 1 1
8 4231 1 1 26 GLN HB2 H -0.394 -7.207 2.702 1.00 . A A . 26 GLN HB2 1 1
8 4232 1 1 26 GLN HB3 H 0.108 -8.063 4.184 1.00 . A A . 26 GLN HB3 1 1
8 4233 1 1 26 GLN HE21 H -4.259 -7.780 4.966 1.00 . A A . 26 GLN HE21 1 1
8 4234 1 1 26 GLN HE22 H -4.467 -9.210 3.997 1.00 . A A . 26 GLN HE22 1 1
8 4235 1 1 26 GLN HG2 H -1.885 -7.072 5.410 1.00 . A A . 26 GLN HG2 1 1
8 4236 1 1 26 GLN HG3 H -2.387 -6.250 3.884 1.00 . A A . 26 GLN HG3 1 1
8 4237 1 1 26 GLN N N -0.316 -4.660 4.086 1.00 . A A . 26 GLN N 1 1
8 4238 1 1 26 GLN NE2 N -3.893 -8.491 4.378 1.00 . A A . 26 GLN NE2 1 1
8 4239 1 1 26 GLN O O 1.863 -5.010 2.539 1.00 . A A . 26 GLN O 1 1
8 4240 1 1 26 GLN OE1 O -2.213 -9.169 3.039 1.00 . A A . 26 GLN OE1 1 1
8 4241 1 1 27 VAL C C 4.031 -7.517 2.079 1.00 . A A . 27 VAL C 1 1
8 4242 1 1 27 VAL CA C 4.000 -6.541 3.235 1.00 . A A . 27 VAL CA 1 1
8 4243 1 1 27 VAL CB C 5.111 -6.814 4.240 1.00 . A A . 27 VAL CB 1 1
8 4244 1 1 27 VAL CG1 C 6.450 -7.115 3.540 1.00 . A A . 27 VAL CG1 1 1
8 4245 1 1 27 VAL CG2 C 5.254 -5.575 5.145 1.00 . A A . 27 VAL CG2 1 1
8 4246 1 1 27 VAL H H 2.586 -7.228 4.611 1.00 . A A . 27 VAL H 1 1
8 4247 1 1 27 VAL HA H 4.183 -5.559 2.821 1.00 . A A . 27 VAL HA 1 1
8 4248 1 1 27 VAL HB H 4.830 -7.696 4.864 1.00 . A A . 27 VAL HB 1 1
8 4249 1 1 27 VAL HG11 H 6.630 -6.379 2.732 1.00 . A A . 27 VAL HG11 1 1
8 4250 1 1 27 VAL HG12 H 6.450 -8.140 3.107 1.00 . A A . 27 VAL HG12 1 1
8 4251 1 1 27 VAL HG13 H 7.289 -7.047 4.263 1.00 . A A . 27 VAL HG13 1 1
8 4252 1 1 27 VAL HG21 H 5.688 -4.728 4.573 1.00 . A A . 27 VAL HG21 1 1
8 4253 1 1 27 VAL HG22 H 5.931 -5.804 5.995 1.00 . A A . 27 VAL HG22 1 1
8 4254 1 1 27 VAL HG23 H 4.275 -5.258 5.561 1.00 . A A . 27 VAL HG23 1 1
8 4255 1 1 27 VAL N N 2.708 -6.566 3.879 1.00 . A A . 27 VAL N 1 1
8 4256 1 1 27 VAL O O 3.792 -8.707 2.244 1.00 . A A . 27 VAL O 1 1
8 4257 1 1 28 LEU C C 6.083 -8.076 -0.476 1.00 . A A . 28 LEU C 1 1
8 4258 1 1 28 LEU CA C 4.573 -7.887 -0.280 1.00 . A A . 28 LEU CA 1 1
8 4259 1 1 28 LEU CB C 3.817 -7.247 -1.493 1.00 . A A . 28 LEU CB 1 1
8 4260 1 1 28 LEU CD1 C 4.346 -9.186 -3.141 1.00 . A A . 28 LEU CD1 1 1
8 4261 1 1 28 LEU CD2 C 3.229 -7.071 -3.971 1.00 . A A . 28 LEU CD2 1 1
8 4262 1 1 28 LEU CG C 4.197 -7.672 -2.936 1.00 . A A . 28 LEU CG 1 1
8 4263 1 1 28 LEU H H 4.453 -6.046 0.717 1.00 . A A . 28 LEU H 1 1
8 4264 1 1 28 LEU HA H 4.163 -8.874 -0.111 1.00 . A A . 28 LEU HA 1 1
8 4265 1 1 28 LEU HB2 H 2.736 -7.472 -1.346 1.00 . A A . 28 LEU HB2 1 1
8 4266 1 1 28 LEU HB3 H 3.921 -6.141 -1.432 1.00 . A A . 28 LEU HB3 1 1
8 4267 1 1 28 LEU HD11 H 4.415 -9.721 -2.174 1.00 . A A . 28 LEU HD11 1 1
8 4268 1 1 28 LEU HD12 H 5.289 -9.384 -3.700 1.00 . A A . 28 LEU HD12 1 1
8 4269 1 1 28 LEU HD13 H 3.499 -9.612 -3.712 1.00 . A A . 28 LEU HD13 1 1
8 4270 1 1 28 LEU HD21 H 2.412 -6.519 -3.463 1.00 . A A . 28 LEU HD21 1 1
8 4271 1 1 28 LEU HD22 H 2.761 -7.863 -4.591 1.00 . A A . 28 LEU HD22 1 1
8 4272 1 1 28 LEU HD23 H 3.760 -6.378 -4.657 1.00 . A A . 28 LEU HD23 1 1
8 4273 1 1 28 LEU HG H 5.199 -7.251 -3.166 1.00 . A A . 28 LEU HG 1 1
8 4274 1 1 28 LEU N N 4.346 -7.025 0.866 1.00 . A A . 28 LEU N 1 1
8 4275 1 1 28 LEU O O 6.581 -8.999 -1.107 1.00 . A A . 28 LEU O 1 1
8 4276 1 1 29 ASN C C 8.854 -6.003 0.746 1.00 . A A . 29 ASN C 1 1
8 4277 1 1 29 ASN CA C 8.306 -7.078 -0.168 1.00 . A A . 29 ASN CA 1 1
8 4278 1 1 29 ASN CB C 8.746 -6.764 -1.656 1.00 . A A . 29 ASN CB 1 1
8 4279 1 1 29 ASN CG C 7.694 -6.259 -2.641 1.00 . A A . 29 ASN CG 1 1
8 4280 1 1 29 ASN H H 6.505 -6.494 0.728 1.00 . A A . 29 ASN H 1 1
8 4281 1 1 29 ASN HA H 8.743 -8.019 0.138 1.00 . A A . 29 ASN HA 1 1
8 4282 1 1 29 ASN HB2 H 9.568 -6.023 -1.716 1.00 . A A . 29 ASN HB2 1 1
8 4283 1 1 29 ASN HB3 H 9.122 -7.711 -2.099 1.00 . A A . 29 ASN HB3 1 1
8 4284 1 1 29 ASN HD21 H 6.595 -5.366 -1.164 1.00 . A A . 29 ASN HD21 1 1
8 4285 1 1 29 ASN HD22 H 5.932 -5.340 -2.767 1.00 . A A . 29 ASN HD22 1 1
8 4286 1 1 29 ASN N N 6.891 -7.186 0.123 1.00 . A A . 29 ASN N 1 1
8 4287 1 1 29 ASN ND2 N 6.680 -5.552 -2.149 1.00 . A A . 29 ASN ND2 1 1
8 4288 1 1 29 ASN O O 8.090 -5.133 1.166 1.00 . A A . 29 ASN O 1 1
8 4289 1 1 29 ASN OD1 O 7.779 -6.488 -3.838 1.00 . A A . 29 ASN OD1 1 1
8 4290 1 1 30 PRO C C 10.704 -3.589 1.421 1.00 . A A . 30 PRO C 1 1
8 4291 1 1 30 PRO CA C 10.696 -4.996 1.995 1.00 . A A . 30 PRO CA 1 1
8 4292 1 1 30 PRO CB C 12.116 -5.523 2.301 1.00 . A A . 30 PRO CB 1 1
8 4293 1 1 30 PRO CD C 11.141 -6.902 0.532 1.00 . A A . 30 PRO CD 1 1
8 4294 1 1 30 PRO CG C 12.455 -6.587 1.242 1.00 . A A . 30 PRO CG 1 1
8 4295 1 1 30 PRO HA H 10.075 -4.953 2.878 1.00 . A A . 30 PRO HA 1 1
8 4296 1 1 30 PRO HB2 H 12.884 -4.719 2.324 1.00 . A A . 30 PRO HB2 1 1
8 4297 1 1 30 PRO HB3 H 12.104 -6.007 3.303 1.00 . A A . 30 PRO HB3 1 1
8 4298 1 1 30 PRO HD2 H 11.269 -6.743 -0.563 1.00 . A A . 30 PRO HD2 1 1
8 4299 1 1 30 PRO HD3 H 10.834 -7.955 0.722 1.00 . A A . 30 PRO HD3 1 1
8 4300 1 1 30 PRO HG2 H 13.196 -6.198 0.512 1.00 . A A . 30 PRO HG2 1 1
8 4301 1 1 30 PRO HG3 H 12.879 -7.500 1.712 1.00 . A A . 30 PRO HG3 1 1
8 4302 1 1 30 PRO N N 10.142 -5.970 1.062 1.00 . A A . 30 PRO N 1 1
8 4303 1 1 30 PRO O O 10.948 -2.652 2.164 1.00 . A A . 30 PRO O 1 1
8 4304 1 1 31 TYR C C 9.096 -1.744 -1.056 1.00 . A A . 31 TYR C 1 1
8 4305 1 1 31 TYR CA C 10.477 -2.127 -0.555 1.00 . A A . 31 TYR CA 1 1
8 4306 1 1 31 TYR CB C 11.507 -2.137 -1.728 1.00 . A A . 31 TYR CB 1 1
8 4307 1 1 31 TYR CD1 C 13.353 -3.565 -0.735 1.00 . A A . 31 TYR CD1 1 1
8 4308 1 1 31 TYR CD2 C 13.800 -1.223 -1.114 1.00 . A A . 31 TYR CD2 1 1
8 4309 1 1 31 TYR CE1 C 14.600 -3.708 -0.115 1.00 . A A . 31 TYR CE1 1 1
8 4310 1 1 31 TYR CE2 C 15.061 -1.368 -0.513 1.00 . A A . 31 TYR CE2 1 1
8 4311 1 1 31 TYR CG C 12.910 -2.311 -1.189 1.00 . A A . 31 TYR CG 1 1
8 4312 1 1 31 TYR CZ C 15.452 -2.610 -0.004 1.00 . A A . 31 TYR CZ 1 1
8 4313 1 1 31 TYR H H 10.236 -4.209 -0.442 1.00 . A A . 31 TYR H 1 1
8 4314 1 1 31 TYR HA H 10.748 -1.351 0.146 1.00 . A A . 31 TYR HA 1 1
8 4315 1 1 31 TYR HB2 H 11.299 -2.970 -2.432 1.00 . A A . 31 TYR HB2 1 1
8 4316 1 1 31 TYR HB3 H 11.467 -1.182 -2.297 1.00 . A A . 31 TYR HB3 1 1
8 4317 1 1 31 TYR HD1 H 12.702 -4.419 -0.818 1.00 . A A . 31 TYR HD1 1 1
8 4318 1 1 31 TYR HD2 H 13.492 -0.253 -1.476 1.00 . A A . 31 TYR HD2 1 1
8 4319 1 1 31 TYR HE1 H 14.915 -4.662 0.281 1.00 . A A . 31 TYR HE1 1 1
8 4320 1 1 31 TYR HE2 H 15.717 -0.515 -0.426 1.00 . A A . 31 TYR HE2 1 1
8 4321 1 1 31 TYR HH H 17.231 -2.000 0.429 1.00 . A A . 31 TYR HH 1 1
8 4322 1 1 31 TYR N N 10.434 -3.414 0.115 1.00 . A A . 31 TYR N 1 1
8 4323 1 1 31 TYR O O 8.903 -0.678 -1.637 1.00 . A A . 31 TYR O 1 1
8 4324 1 1 31 TYR OH O 16.709 -2.786 0.600 1.00 . A A . 31 TYR OH 1 1
8 4325 1 1 32 TYR C C 5.693 -2.960 -0.310 1.00 . A A . 32 TYR C 1 1
8 4326 1 1 32 TYR CA C 6.735 -2.339 -1.261 1.00 . A A . 32 TYR CA 1 1
8 4327 1 1 32 TYR CB C 6.618 -2.574 -2.816 1.00 . A A . 32 TYR CB 1 1
8 4328 1 1 32 TYR CD1 C 4.724 -1.300 -3.710 1.00 . A A . 32 TYR CD1 1 1
8 4329 1 1 32 TYR CD2 C 4.408 -3.685 -3.622 1.00 . A A . 32 TYR CD2 1 1
8 4330 1 1 32 TYR CE1 C 3.434 -1.135 -4.196 1.00 . A A . 32 TYR CE1 1 1
8 4331 1 1 32 TYR CE2 C 3.118 -3.528 -4.156 1.00 . A A . 32 TYR CE2 1 1
8 4332 1 1 32 TYR CG C 5.213 -2.555 -3.353 1.00 . A A . 32 TYR CG 1 1
8 4333 1 1 32 TYR CZ C 2.635 -2.244 -4.407 1.00 . A A . 32 TYR CZ 1 1
8 4334 1 1 32 TYR H H 8.210 -3.367 -0.182 1.00 . A A . 32 TYR H 1 1
8 4335 1 1 32 TYR HA H 6.557 -1.285 -1.145 1.00 . A A . 32 TYR HA 1 1
8 4336 1 1 32 TYR HB2 H 7.188 -1.763 -3.322 1.00 . A A . 32 TYR HB2 1 1
8 4337 1 1 32 TYR HB3 H 7.123 -3.481 -3.175 1.00 . A A . 32 TYR HB3 1 1
8 4338 1 1 32 TYR HD1 H 5.379 -0.452 -3.646 1.00 . A A . 32 TYR HD1 1 1
8 4339 1 1 32 TYR HD2 H 4.766 -4.683 -3.463 1.00 . A A . 32 TYR HD2 1 1
8 4340 1 1 32 TYR HE1 H 3.073 -0.157 -4.465 1.00 . A A . 32 TYR HE1 1 1
8 4341 1 1 32 TYR HE2 H 2.503 -4.389 -4.366 1.00 . A A . 32 TYR HE2 1 1
8 4342 1 1 32 TYR HH H 1.204 -2.657 -5.627 1.00 . A A . 32 TYR HH 1 1
8 4343 1 1 32 TYR N N 8.078 -2.583 -0.787 1.00 . A A . 32 TYR N 1 1
8 4344 1 1 32 TYR O O 5.603 -4.169 -0.097 1.00 . A A . 32 TYR O 1 1
8 4345 1 1 32 TYR OH O 1.377 -2.002 -4.947 1.00 . A A . 32 TYR OH 1 1
8 4346 1 1 33 SER C C 2.546 -2.292 0.527 1.00 . A A . 33 SER C 1 1
8 4347 1 1 33 SER CA C 3.824 -2.580 1.244 1.00 . A A . 33 SER CA 1 1
8 4348 1 1 33 SER CB C 3.734 -1.866 2.616 1.00 . A A . 33 SER CB 1 1
8 4349 1 1 33 SER H H 4.967 -1.128 0.304 1.00 . A A . 33 SER H 1 1
8 4350 1 1 33 SER HA H 3.892 -3.644 1.413 1.00 . A A . 33 SER HA 1 1
8 4351 1 1 33 SER HB2 H 3.335 -0.841 2.500 1.00 . A A . 33 SER HB2 1 1
8 4352 1 1 33 SER HB3 H 3.029 -2.412 3.283 1.00 . A A . 33 SER HB3 1 1
8 4353 1 1 33 SER HG H 5.278 -2.629 3.531 1.00 . A A . 33 SER HG 1 1
8 4354 1 1 33 SER N N 4.878 -2.127 0.352 1.00 . A A . 33 SER N 1 1
8 4355 1 1 33 SER O O 2.200 -1.148 0.232 1.00 . A A . 33 SER O 1 1
8 4356 1 1 33 SER OG O 5.016 -1.754 3.231 1.00 . A A . 33 SER OG 1 1
8 4357 1 1 34 GLN C C -0.582 -3.204 0.239 1.00 . A A . 34 GLN C 1 1
8 4358 1 1 34 GLN CA C 0.663 -3.288 -0.628 1.00 . A A . 34 GLN CA 1 1
8 4359 1 1 34 GLN CB C 0.684 -4.527 -1.550 1.00 . A A . 34 GLN CB 1 1
8 4360 1 1 34 GLN CD C -0.252 -5.661 -3.614 1.00 . A A . 34 GLN CD 1 1
8 4361 1 1 34 GLN CG C -0.456 -4.557 -2.582 1.00 . A A . 34 GLN CG 1 1
8 4362 1 1 34 GLN H H 2.006 -4.241 0.621 1.00 . A A . 34 GLN H 1 1
8 4363 1 1 34 GLN HA H 0.699 -2.400 -1.247 1.00 . A A . 34 GLN HA 1 1
8 4364 1 1 34 GLN HB2 H 1.658 -4.501 -2.091 1.00 . A A . 34 GLN HB2 1 1
8 4365 1 1 34 GLN HB3 H 0.677 -5.459 -0.941 1.00 . A A . 34 GLN HB3 1 1
8 4366 1 1 34 GLN HE21 H -0.321 -4.323 -5.152 1.00 . A A . 34 GLN HE21 1 1
8 4367 1 1 34 GLN HE22 H -0.111 -6.018 -5.574 1.00 . A A . 34 GLN HE22 1 1
8 4368 1 1 34 GLN HG2 H -1.418 -4.757 -2.070 1.00 . A A . 34 GLN HG2 1 1
8 4369 1 1 34 GLN HG3 H -0.507 -3.566 -3.079 1.00 . A A . 34 GLN HG3 1 1
8 4370 1 1 34 GLN N N 1.818 -3.351 0.207 1.00 . A A . 34 GLN N 1 1
8 4371 1 1 34 GLN NE2 N -0.202 -5.283 -4.908 1.00 . A A . 34 GLN NE2 1 1
8 4372 1 1 34 GLN O O -0.570 -3.508 1.430 1.00 . A A . 34 GLN O 1 1
8 4373 1 1 34 GLN OE1 O -0.154 -6.842 -3.299 1.00 . A A . 34 GLN OE1 1 1
8 4374 1 1 35 CYS C C -3.914 -3.817 -0.197 1.00 . A A . 35 CYS C 1 1
8 4375 1 1 35 CYS CA C -2.989 -2.731 0.296 1.00 . A A . 35 CYS CA 1 1
8 4376 1 1 35 CYS CB C -3.684 -1.408 -0.052 1.00 . A A . 35 CYS CB 1 1
8 4377 1 1 35 CYS H H -1.615 -2.329 -1.249 1.00 . A A . 35 CYS H 1 1
8 4378 1 1 35 CYS HA H -2.883 -2.887 1.357 1.00 . A A . 35 CYS HA 1 1
8 4379 1 1 35 CYS HB2 H -3.593 -1.233 -1.145 1.00 . A A . 35 CYS HB2 1 1
8 4380 1 1 35 CYS HB3 H -4.758 -1.459 0.218 1.00 . A A . 35 CYS HB3 1 1
8 4381 1 1 35 CYS N N -1.694 -2.750 -0.346 1.00 . A A . 35 CYS N 1 1
8 4382 1 1 35 CYS O O -4.311 -3.806 -1.360 1.00 . A A . 35 CYS O 1 1
8 4383 1 1 35 CYS SG S -2.996 -0.005 0.819 1.00 . A A . 35 CYS SG 1 1
8 4384 1 1 36 LEU C C -6.416 -6.060 0.833 1.00 . A A . 36 LEU C 1 1
8 4385 1 1 36 LEU CA C -5.018 -5.951 0.230 1.00 . A A . 36 LEU CA 1 1
8 4386 1 1 36 LEU CB C -4.267 -7.235 0.617 1.00 . A A . 36 LEU CB 1 1
8 4387 1 1 36 LEU CD1 C -3.034 -7.125 -1.567 1.00 . A A . 36 LEU CD1 1 1
8 4388 1 1 36 LEU CD2 C -1.823 -6.489 0.563 1.00 . A A . 36 LEU CD2 1 1
8 4389 1 1 36 LEU CG C -2.898 -7.387 -0.063 1.00 . A A . 36 LEU CG 1 1
8 4390 1 1 36 LEU H H -4.034 -4.755 1.623 1.00 . A A . 36 LEU H 1 1
8 4391 1 1 36 LEU HA H -5.182 -5.930 -0.834 1.00 . A A . 36 LEU HA 1 1
8 4392 1 1 36 LEU HB2 H -4.152 -7.276 1.721 1.00 . A A . 36 LEU HB2 1 1
8 4393 1 1 36 LEU HB3 H -4.896 -8.106 0.322 1.00 . A A . 36 LEU HB3 1 1
8 4394 1 1 36 LEU HD11 H -3.147 -6.038 -1.758 1.00 . A A . 36 LEU HD11 1 1
8 4395 1 1 36 LEU HD12 H -3.937 -7.634 -1.963 1.00 . A A . 36 LEU HD12 1 1
8 4396 1 1 36 LEU HD13 H -2.143 -7.490 -2.109 1.00 . A A . 36 LEU HD13 1 1
8 4397 1 1 36 LEU HD21 H -1.788 -5.521 0.037 1.00 . A A . 36 LEU HD21 1 1
8 4398 1 1 36 LEU HD22 H -0.821 -6.955 0.507 1.00 . A A . 36 LEU HD22 1 1
8 4399 1 1 36 LEU HD23 H -2.073 -6.278 1.625 1.00 . A A . 36 LEU HD23 1 1
8 4400 1 1 36 LEU HG H -2.583 -8.446 0.100 1.00 . A A . 36 LEU HG 1 1
8 4401 1 1 36 LEU N N -4.303 -4.766 0.655 1.00 . A A . 36 LEU N 1 1
8 4402 1 1 36 LEU O O -7.389 -6.041 0.032 1.00 . A A . 36 LEU O 1 1
8 4403 1 1 36 LEU OXT O -6.518 -6.163 2.080 1.00 . A A . 36 LEU OXT 1 1
8 4404 2 2 1 MAN C1 C -9.447 4.202 -0.109 1.00 . B A . 101 MAN C1 1 1
8 4405 2 2 1 MAN C2 C -8.555 4.678 -1.217 1.00 . B A . 101 MAN C2 1 1
8 4406 2 2 1 MAN C3 C -8.695 6.168 -1.322 1.00 . B A . 101 MAN C3 1 1
8 4407 2 2 1 MAN C4 C -10.128 6.515 -1.646 1.00 . B A . 101 MAN C4 1 1
8 4408 2 2 1 MAN C5 C -11.075 5.830 -0.659 1.00 . B A . 101 MAN C5 1 1
8 4409 2 2 1 MAN C6 C -12.526 5.956 -1.063 1.00 . B A . 101 MAN C6 1 1
8 4410 2 2 1 MAN H1 H -9.354 3.111 -0.063 1.00 . B A . 101 MAN H1 1 1
8 4411 2 2 1 MAN H2 H -7.535 4.408 -0.924 1.00 . B A . 101 MAN H2 1 1
8 4412 2 2 1 MAN H3 H -8.486 6.622 -0.336 1.00 . B A . 101 MAN H3 1 1
8 4413 2 2 1 MAN H4 H -10.361 6.148 -2.675 1.00 . B A . 101 MAN H4 1 1
8 4414 2 2 1 MAN H5 H -10.956 6.317 0.337 1.00 . B A . 101 MAN H5 1 1
8 4415 2 2 1 MAN H61 H -12.663 5.500 -2.071 1.00 . B A . 101 MAN H61 1 1
8 4416 2 2 1 MAN H62 H -12.807 7.031 -1.134 1.00 . B A . 101 MAN H62 1 1
8 4417 2 2 1 MAN HO2 H -9.211 3.185 -2.433 1.00 . B A . 101 MAN HO2 1 1
8 4418 2 2 1 MAN HO3 H -7.562 6.128 -2.934 1.00 . B A . 101 MAN HO3 1 1
8 4419 2 2 1 MAN HO4 H -9.932 8.313 -2.382 1.00 . B A . 101 MAN HO4 1 1
8 4420 2 2 1 MAN HO6 H -13.329 5.672 0.735 1.00 . B A . 101 MAN HO6 1 1
8 4421 2 2 1 MAN O1 O -9.159 4.850 1.162 1.00 . B A . 101 MAN O1 1 1
8 4422 2 2 1 MAN O2 O -8.788 4.056 -2.480 1.00 . B A . 101 MAN O2 1 1
8 4423 2 2 1 MAN O3 O -7.741 6.743 -2.205 1.00 . B A . 101 MAN O3 1 1
8 4424 2 2 1 MAN O4 O -10.330 7.921 -1.592 1.00 . B A . 101 MAN O4 1 1
8 4425 2 2 1 MAN O5 O -10.787 4.432 -0.497 1.00 . B A . 101 MAN O5 1 1
8 4426 2 2 1 MAN O6 O -13.399 5.293 -0.144 1.00 . B A . 101 MAN O6 1 1
8 4427 3 2 1 MAN C1 C -6.897 1.974 -6.221 1.00 . C A . 102 MAN C1 1 1
8 4428 3 2 1 MAN C2 C -8.047 2.559 -5.421 1.00 . C A . 102 MAN C2 1 1
8 4429 3 2 1 MAN C3 C -8.827 1.436 -4.765 1.00 . C A . 102 MAN C3 1 1
8 4430 3 2 1 MAN C4 C -9.324 0.444 -5.789 1.00 . C A . 102 MAN C4 1 1
8 4431 3 2 1 MAN C5 C -8.184 0.003 -6.705 1.00 . C A . 102 MAN C5 1 1
8 4432 3 2 1 MAN C6 C -8.693 -0.845 -7.853 1.00 . C A . 102 MAN C6 1 1
8 4433 3 2 1 MAN H1 H -6.319 2.791 -6.715 1.00 . C A . 102 MAN H1 1 1
8 4434 3 2 1 MAN H2 H -7.622 3.236 -4.646 1.00 . C A . 102 MAN H2 1 1
8 4435 3 2 1 MAN H3 H -8.150 0.868 -4.124 1.00 . C A . 102 MAN H3 1 1
8 4436 3 2 1 MAN H4 H -10.104 0.941 -6.414 1.00 . C A . 102 MAN H4 1 1
8 4437 3 2 1 MAN H5 H -7.474 -0.625 -6.122 1.00 . C A . 102 MAN H5 1 1
8 4438 3 2 1 MAN H61 H -9.324 -0.226 -8.532 1.00 . C A . 102 MAN H61 1 1
8 4439 3 2 1 MAN H62 H -9.330 -1.668 -7.461 1.00 . C A . 102 MAN H62 1 1
8 4440 3 2 1 MAN HO2 H -8.891 3.055 -7.136 1.00 . C A . 102 MAN HO2 1 1
8 4441 3 2 1 MAN HO3 H -10.318 2.605 -4.321 1.00 . C A . 102 MAN HO3 1 1
8 4442 3 2 1 MAN HO4 H -10.537 -0.340 -4.492 1.00 . C A . 102 MAN HO4 1 1
8 4443 3 2 1 MAN HO6 H -6.804 -0.972 -8.433 1.00 . C A . 102 MAN HO6 1 1
8 4444 3 2 1 MAN O1 O -6.001 1.182 -5.419 1.00 . C A . 102 MAN O1 1 1
8 4445 3 2 1 MAN O2 O -8.915 3.361 -6.219 1.00 . C A . 102 MAN O2 1 1
8 4446 3 2 1 MAN O3 O -9.848 1.883 -3.876 1.00 . C A . 102 MAN O3 1 1
8 4447 3 2 1 MAN O4 O -9.905 -0.684 -5.140 1.00 . C A . 102 MAN O4 1 1
8 4448 3 2 1 MAN O5 O -7.460 1.133 -7.240 1.00 . C A . 102 MAN O5 1 1
8 4449 3 2 1 MAN O6 O -7.627 -1.454 -8.581 1.00 . C A . 102 MAN O6 1 1
8 4450 4 2 1 MAN C1 C 8.815 10.687 -0.870 1.00 . D A . 103 MAN C1 1 1
8 4451 4 2 1 MAN C2 C 8.450 11.857 -1.770 1.00 . D A . 103 MAN C2 1 1
8 4452 4 2 1 MAN C3 C 8.172 11.317 -3.161 1.00 . D A . 103 MAN C3 1 1
8 4453 4 2 1 MAN C4 C 9.425 10.650 -3.681 1.00 . D A . 103 MAN C4 1 1
8 4454 4 2 1 MAN C5 C 9.879 9.558 -2.709 1.00 . D A . 103 MAN C5 1 1
8 4455 4 2 1 MAN C6 C 11.216 8.964 -3.120 1.00 . D A . 103 MAN C6 1 1
8 4456 4 2 1 MAN H1 H 9.032 11.071 0.153 1.00 . D A . 103 MAN H1 1 1
8 4457 4 2 1 MAN H2 H 7.523 12.349 -1.401 1.00 . D A . 103 MAN H2 1 1
8 4458 4 2 1 MAN H3 H 7.387 10.526 -3.097 1.00 . D A . 103 MAN H3 1 1
8 4459 4 2 1 MAN H4 H 10.231 11.420 -3.729 1.00 . D A . 103 MAN H4 1 1
8 4460 4 2 1 MAN H5 H 9.115 8.745 -2.706 1.00 . D A . 103 MAN H5 1 1
8 4461 4 2 1 MAN H61 H 11.955 9.786 -3.247 1.00 . D A . 103 MAN H61 1 1
8 4462 4 2 1 MAN H62 H 11.114 8.432 -4.093 1.00 . D A . 103 MAN H62 1 1
8 4463 4 2 1 MAN HO2 H 9.151 13.650 -1.296 1.00 . D A . 103 MAN HO2 1 1
8 4464 4 2 1 MAN HO3 H 7.570 11.901 -4.910 1.00 . D A . 103 MAN HO3 1 1
8 4465 4 2 1 MAN HO4 H 9.894 10.498 -5.591 1.00 . D A . 103 MAN HO4 1 1
8 4466 4 2 1 MAN HO6 H 11.407 8.364 -1.291 1.00 . D A . 103 MAN HO6 1 1
8 4467 4 2 1 MAN O1 O 7.764 9.713 -0.758 1.00 . D A . 103 MAN O1 1 1
8 4468 4 2 1 MAN O2 O 9.468 12.866 -1.753 1.00 . D A . 103 MAN O2 1 1
8 4469 4 2 1 MAN O3 O 7.670 12.318 -4.047 1.00 . D A . 103 MAN O3 1 1
8 4470 4 2 1 MAN O4 O 9.235 10.124 -4.997 1.00 . D A . 103 MAN O4 1 1
8 4471 4 2 1 MAN O5 O 10.014 10.065 -1.361 1.00 . D A . 103 MAN O5 1 1
8 4472 4 2 1 MAN O6 O 11.728 8.053 -2.149 1.00 . D A . 103 MAN O6 1 1
9 4473 1 1 1 THR C C -5.941 5.420 0.429 1.00 . A A . 1 THR C 1 1
9 4474 1 1 1 THR CA C -6.908 5.525 1.578 1.00 . A A . 1 THR CA 1 1
9 4475 1 1 1 THR CB C -7.927 4.342 1.591 1.00 . A A . 1 THR CB 1 1
9 4476 1 1 1 THR CG2 C -8.365 4.100 3.027 1.00 . A A . 1 THR CG2 1 1
9 4477 1 1 1 THR H1 H -8.683 6.609 1.588 1.00 . A A . 1 THR H1 1 1
9 4478 1 1 1 THR H2 H -7.445 7.326 0.668 1.00 . A A . 1 THR H2 1 1
9 4479 1 1 1 THR H3 H -7.420 7.457 2.367 1.00 . A A . 1 THR H3 1 1
9 4480 1 1 1 THR HA H -6.313 5.496 2.473 1.00 . A A . 1 THR HA 1 1
9 4481 1 1 1 THR HB H -7.506 3.404 1.172 1.00 . A A . 1 THR HB 1 1
9 4482 1 1 1 THR HG21 H -9.217 3.392 3.098 1.00 . A A . 1 THR HG21 1 1
9 4483 1 1 1 THR HG22 H -8.639 5.030 3.560 1.00 . A A . 1 THR HG22 1 1
9 4484 1 1 1 THR HG23 H -7.517 3.649 3.576 1.00 . A A . 1 THR HG23 1 1
9 4485 1 1 1 THR N N -7.662 6.841 1.571 1.00 . A A . 1 THR N 1 1
9 4486 1 1 1 THR O O -5.753 6.434 -0.220 1.00 . A A . 1 THR O 1 1
9 4487 1 1 2 GLN C C -5.262 3.237 -2.191 1.00 . A A . 2 GLN C 1 1
9 4488 1 1 2 GLN CA C -4.560 4.041 -1.085 1.00 . A A . 2 GLN CA 1 1
9 4489 1 1 2 GLN CB C -3.242 3.310 -0.782 1.00 . A A . 2 GLN CB 1 1
9 4490 1 1 2 GLN CD C -1.877 4.889 -2.103 1.00 . A A . 2 GLN CD 1 1
9 4491 1 1 2 GLN CG C -2.318 3.441 -2.009 1.00 . A A . 2 GLN CG 1 1
9 4492 1 1 2 GLN H H -5.291 3.505 0.814 1.00 . A A . 2 GLN H 1 1
9 4493 1 1 2 GLN HA H -4.347 5.009 -1.524 1.00 . A A . 2 GLN HA 1 1
9 4494 1 1 2 GLN HB2 H -2.772 3.776 0.116 1.00 . A A . 2 GLN HB2 1 1
9 4495 1 1 2 GLN HB3 H -3.372 2.247 -0.495 1.00 . A A . 2 GLN HB3 1 1
9 4496 1 1 2 GLN HE21 H -0.703 4.622 -0.460 1.00 . A A . 2 GLN HE21 1 1
9 4497 1 1 2 GLN HE22 H -0.910 6.275 -0.976 1.00 . A A . 2 GLN HE22 1 1
9 4498 1 1 2 GLN HG2 H -1.450 2.790 -1.902 1.00 . A A . 2 GLN HG2 1 1
9 4499 1 1 2 GLN HG3 H -2.796 3.182 -2.974 1.00 . A A . 2 GLN HG3 1 1
9 4500 1 1 2 GLN N N -5.328 4.244 0.138 1.00 . A A . 2 GLN N 1 1
9 4501 1 1 2 GLN NE2 N -1.089 5.303 -1.095 1.00 . A A . 2 GLN NE2 1 1
9 4502 1 1 2 GLN O O -5.940 3.778 -3.058 1.00 . A A . 2 GLN O 1 1
9 4503 1 1 2 GLN OE1 O -2.262 5.654 -2.982 1.00 . A A . 2 GLN OE1 1 1
9 4504 1 1 3 SER C C -5.817 -0.320 -2.755 1.00 . A A . 3 SER C 1 1
9 4505 1 1 3 SER CA C -5.864 1.104 -3.193 1.00 . A A . 3 SER CA 1 1
9 4506 1 1 3 SER CB C -5.389 1.238 -4.673 1.00 . A A . 3 SER CB 1 1
9 4507 1 1 3 SER H H -4.573 1.389 -1.573 1.00 . A A . 3 SER H 1 1
9 4508 1 1 3 SER HA H -6.887 1.397 -3.080 1.00 . A A . 3 SER HA 1 1
9 4509 1 1 3 SER HB2 H -5.370 2.291 -5.016 1.00 . A A . 3 SER HB2 1 1
9 4510 1 1 3 SER HB3 H -4.378 0.809 -4.814 1.00 . A A . 3 SER HB3 1 1
9 4511 1 1 3 SER N N -5.135 1.903 -2.220 1.00 . A A . 3 SER N 1 1
9 4512 1 1 3 SER O O -5.189 -0.621 -1.760 1.00 . A A . 3 SER O 1 1
9 4513 1 1 4 HIS C C -5.293 -2.994 -4.262 1.00 . A A . 4 HIS C 1 1
9 4514 1 1 4 HIS CA C -6.390 -2.661 -3.309 1.00 . A A . 4 HIS CA 1 1
9 4515 1 1 4 HIS CB C -7.656 -3.446 -3.738 1.00 . A A . 4 HIS CB 1 1
9 4516 1 1 4 HIS CD2 C -6.560 -5.618 -2.857 1.00 . A A . 4 HIS CD2 1 1
9 4517 1 1 4 HIS CE1 C -8.251 -6.970 -3.145 1.00 . A A . 4 HIS CE1 1 1
9 4518 1 1 4 HIS CG C -7.560 -4.913 -3.421 1.00 . A A . 4 HIS CG 1 1
9 4519 1 1 4 HIS H H -6.890 -0.949 -4.340 1.00 . A A . 4 HIS H 1 1
9 4520 1 1 4 HIS HA H -6.079 -2.919 -2.299 1.00 . A A . 4 HIS HA 1 1
9 4521 1 1 4 HIS HB2 H -8.525 -3.031 -3.184 1.00 . A A . 4 HIS HB2 1 1
9 4522 1 1 4 HIS HB3 H -7.866 -3.314 -4.823 1.00 . A A . 4 HIS HB3 1 1
9 4523 1 1 4 HIS HD1 H -9.517 -5.544 -3.938 1.00 . A A . 4 HIS HD1 1 1
9 4524 1 1 4 HIS HD2 H -5.571 -5.293 -2.537 1.00 . A A . 4 HIS HD2 1 1
9 4525 1 1 4 HIS HE1 H -8.853 -7.872 -3.157 1.00 . A A . 4 HIS HE1 1 1
9 4526 1 1 4 HIS HE2 H -6.533 -7.620 -2.202 1.00 . A A . 4 HIS HE2 1 1
9 4527 1 1 4 HIS N N -6.487 -1.248 -3.464 1.00 . A A . 4 HIS N 1 1
9 4528 1 1 4 HIS ND1 N -8.614 -5.780 -3.602 1.00 . A A . 4 HIS ND1 1 1
9 4529 1 1 4 HIS NE2 N -7.016 -6.900 -2.694 1.00 . A A . 4 HIS NE2 1 1
9 4530 1 1 4 HIS O O -5.432 -2.787 -5.459 1.00 . A A . 4 HIS O 1 1
9 4531 1 1 5 TYR C C -2.108 -2.420 -4.538 1.00 . A A . 5 TYR C 1 1
9 4532 1 1 5 TYR CA C -2.918 -3.688 -4.340 1.00 . A A . 5 TYR CA 1 1
9 4533 1 1 5 TYR CB C -3.030 -4.499 -5.653 1.00 . A A . 5 TYR CB 1 1
9 4534 1 1 5 TYR CD1 C -3.491 -6.749 -4.588 1.00 . A A . 5 TYR CD1 1 1
9 4535 1 1 5 TYR CD2 C -5.118 -5.828 -6.125 1.00 . A A . 5 TYR CD2 1 1
9 4536 1 1 5 TYR CE1 C -4.301 -7.880 -4.413 1.00 . A A . 5 TYR CE1 1 1
9 4537 1 1 5 TYR CE2 C -5.933 -6.950 -5.944 1.00 . A A . 5 TYR CE2 1 1
9 4538 1 1 5 TYR CG C -3.891 -5.715 -5.450 1.00 . A A . 5 TYR CG 1 1
9 4539 1 1 5 TYR CZ C -5.517 -7.980 -5.096 1.00 . A A . 5 TYR CZ 1 1
9 4540 1 1 5 TYR H H -4.140 -3.531 -2.695 1.00 . A A . 5 TYR H 1 1
9 4541 1 1 5 TYR HA H -2.382 -4.285 -3.624 1.00 . A A . 5 TYR HA 1 1
9 4542 1 1 5 TYR HB2 H -3.460 -3.869 -6.462 1.00 . A A . 5 TYR HB2 1 1
9 4543 1 1 5 TYR HB3 H -2.033 -4.844 -5.993 1.00 . A A . 5 TYR HB3 1 1
9 4544 1 1 5 TYR HD1 H -2.554 -6.676 -4.055 1.00 . A A . 5 TYR HD1 1 1
9 4545 1 1 5 TYR HD2 H -5.438 -5.025 -6.775 1.00 . A A . 5 TYR HD2 1 1
9 4546 1 1 5 TYR HE1 H -3.993 -8.668 -3.741 1.00 . A A . 5 TYR HE1 1 1
9 4547 1 1 5 TYR HE2 H -6.889 -7.004 -6.441 1.00 . A A . 5 TYR HE2 1 1
9 4548 1 1 5 TYR HH H -6.283 -9.659 -5.619 1.00 . A A . 5 TYR HH 1 1
9 4549 1 1 5 TYR N N -4.172 -3.404 -3.696 1.00 . A A . 5 TYR N 1 1
9 4550 1 1 5 TYR O O -1.032 -2.455 -5.114 1.00 . A A . 5 TYR O 1 1
9 4551 1 1 5 TYR OH O -6.364 -9.077 -4.859 1.00 . A A . 5 TYR OH 1 1
9 4552 1 1 6 GLY C C -0.837 -0.007 -2.814 1.00 . A A . 6 GLY C 1 1
9 4553 1 1 6 GLY CA C -1.790 -0.037 -3.969 1.00 . A A . 6 GLY CA 1 1
9 4554 1 1 6 GLY H H -3.449 -1.298 -3.535 1.00 . A A . 6 GLY H 1 1
9 4555 1 1 6 GLY HA2 H -1.212 0.041 -4.880 1.00 . A A . 6 GLY HA2 1 1
9 4556 1 1 6 GLY HA3 H -2.466 0.789 -3.829 1.00 . A A . 6 GLY HA3 1 1
9 4557 1 1 6 GLY N N -2.570 -1.271 -3.997 1.00 . A A . 6 GLY N 1 1
9 4558 1 1 6 GLY O O -0.866 -0.859 -1.934 1.00 . A A . 6 GLY O 1 1
9 4559 1 1 7 GLN C C 0.662 1.912 -0.489 1.00 . A A . 7 GLN C 1 1
9 4560 1 1 7 GLN CA C 1.039 1.124 -1.746 1.00 . A A . 7 GLN CA 1 1
9 4561 1 1 7 GLN CB C 2.227 1.850 -2.390 1.00 . A A . 7 GLN CB 1 1
9 4562 1 1 7 GLN CD C 4.751 1.786 -2.271 1.00 . A A . 7 GLN CD 1 1
9 4563 1 1 7 GLN CG C 3.456 1.806 -1.476 1.00 . A A . 7 GLN CG 1 1
9 4564 1 1 7 GLN H H 0.029 1.730 -3.455 1.00 . A A . 7 GLN H 1 1
9 4565 1 1 7 GLN HA H 1.353 0.132 -1.453 1.00 . A A . 7 GLN HA 1 1
9 4566 1 1 7 GLN HB2 H 2.433 1.340 -3.356 1.00 . A A . 7 GLN HB2 1 1
9 4567 1 1 7 GLN HB3 H 1.972 2.903 -2.642 1.00 . A A . 7 GLN HB3 1 1
9 4568 1 1 7 GLN HE21 H 5.651 1.027 -0.646 1.00 . A A . 7 GLN HE21 1 1
9 4569 1 1 7 GLN HE22 H 6.638 1.094 -2.114 1.00 . A A . 7 GLN HE22 1 1
9 4570 1 1 7 GLN HG2 H 3.457 2.654 -0.766 1.00 . A A . 7 GLN HG2 1 1
9 4571 1 1 7 GLN HG3 H 3.399 0.867 -0.886 1.00 . A A . 7 GLN HG3 1 1
9 4572 1 1 7 GLN N N 0.013 1.022 -2.756 1.00 . A A . 7 GLN N 1 1
9 4573 1 1 7 GLN NE2 N 5.808 1.295 -1.599 1.00 . A A . 7 GLN NE2 1 1
9 4574 1 1 7 GLN O O 0.362 3.091 -0.547 1.00 . A A . 7 GLN O 1 1
9 4575 1 1 7 GLN OE1 O 4.844 2.120 -3.449 1.00 . A A . 7 GLN OE1 1 1
9 4576 1 1 8 CYS C C 1.729 2.440 2.660 1.00 . A A . 8 CYS C 1 1
9 4577 1 1 8 CYS CA C 0.450 2.078 1.948 1.00 . A A . 8 CYS CA 1 1
9 4578 1 1 8 CYS CB C -0.368 1.232 2.945 1.00 . A A . 8 CYS CB 1 1
9 4579 1 1 8 CYS H H 0.927 0.352 0.798 1.00 . A A . 8 CYS H 1 1
9 4580 1 1 8 CYS HA H -0.065 3.008 1.755 1.00 . A A . 8 CYS HA 1 1
9 4581 1 1 8 CYS HB2 H -0.314 1.625 3.985 1.00 . A A . 8 CYS HB2 1 1
9 4582 1 1 8 CYS HB3 H -1.426 1.372 2.652 1.00 . A A . 8 CYS HB3 1 1
9 4583 1 1 8 CYS N N 0.693 1.323 0.712 1.00 . A A . 8 CYS N 1 1
9 4584 1 1 8 CYS O O 1.741 3.198 3.628 1.00 . A A . 8 CYS O 1 1
9 4585 1 1 8 CYS SG S 0.127 -0.531 2.866 1.00 . A A . 8 CYS SG 1 1
9 4586 1 1 9 GLY C C 5.169 1.608 1.869 1.00 . A A . 9 GLY C 1 1
9 4587 1 1 9 GLY CA C 4.132 2.095 2.814 1.00 . A A . 9 GLY CA 1 1
9 4588 1 1 9 GLY H H 2.804 1.284 1.397 1.00 . A A . 9 GLY H 1 1
9 4589 1 1 9 GLY HA2 H 4.294 3.148 3.001 1.00 . A A . 9 GLY HA2 1 1
9 4590 1 1 9 GLY HA3 H 4.170 1.472 3.698 1.00 . A A . 9 GLY HA3 1 1
9 4591 1 1 9 GLY N N 2.850 1.903 2.179 1.00 . A A . 9 GLY N 1 1
9 4592 1 1 9 GLY O O 4.926 0.776 1.006 1.00 . A A . 9 GLY O 1 1
9 4593 1 1 10 GLY C C 8.677 2.213 1.712 1.00 . A A . 10 GLY C 1 1
9 4594 1 1 10 GLY CA C 7.467 1.633 1.116 1.00 . A A . 10 GLY CA 1 1
9 4595 1 1 10 GLY H H 6.649 2.779 2.653 1.00 . A A . 10 GLY H 1 1
9 4596 1 1 10 GLY HA2 H 7.541 0.555 1.114 1.00 . A A . 10 GLY HA2 1 1
9 4597 1 1 10 GLY HA3 H 7.371 2.095 0.147 1.00 . A A . 10 GLY HA3 1 1
9 4598 1 1 10 GLY N N 6.395 2.086 1.972 1.00 . A A . 10 GLY N 1 1
9 4599 1 1 10 GLY O O 8.564 3.099 2.549 1.00 . A A . 10 GLY O 1 1
9 4600 1 1 11 ILE C C 11.168 3.900 1.378 1.00 . A A . 11 ILE C 1 1
9 4601 1 1 11 ILE CA C 11.122 2.402 1.659 1.00 . A A . 11 ILE CA 1 1
9 4602 1 1 11 ILE CB C 12.300 1.644 1.046 1.00 . A A . 11 ILE CB 1 1
9 4603 1 1 11 ILE CD1 C 13.765 0.669 2.954 1.00 . A A . 11 ILE CD1 1 1
9 4604 1 1 11 ILE CG1 C 12.638 0.425 1.945 1.00 . A A . 11 ILE CG1 1 1
9 4605 1 1 11 ILE CG2 C 13.527 2.549 0.779 1.00 . A A . 11 ILE CG2 1 1
9 4606 1 1 11 ILE H H 9.915 1.053 0.588 1.00 . A A . 11 ILE H 1 1
9 4607 1 1 11 ILE HA H 11.190 2.315 2.735 1.00 . A A . 11 ILE HA 1 1
9 4608 1 1 11 ILE HB H 11.966 1.254 0.056 1.00 . A A . 11 ILE HB 1 1
9 4609 1 1 11 ILE HD11 H 13.578 1.595 3.538 1.00 . A A . 11 ILE HD11 1 1
9 4610 1 1 11 ILE HD12 H 14.743 0.763 2.433 1.00 . A A . 11 ILE HD12 1 1
9 4611 1 1 11 ILE HD13 H 13.841 -0.185 3.660 1.00 . A A . 11 ILE HD13 1 1
9 4612 1 1 11 ILE HG12 H 11.723 0.113 2.496 1.00 . A A . 11 ILE HG12 1 1
9 4613 1 1 11 ILE HG13 H 12.933 -0.441 1.314 1.00 . A A . 11 ILE HG13 1 1
9 4614 1 1 11 ILE HG21 H 14.401 1.941 0.472 1.00 . A A . 11 ILE HG21 1 1
9 4615 1 1 11 ILE HG22 H 13.808 3.110 1.697 1.00 . A A . 11 ILE HG22 1 1
9 4616 1 1 11 ILE HG23 H 13.324 3.278 -0.032 1.00 . A A . 11 ILE HG23 1 1
9 4617 1 1 11 ILE N N 9.860 1.798 1.245 1.00 . A A . 11 ILE N 1 1
9 4618 1 1 11 ILE O O 11.689 4.693 2.152 1.00 . A A . 11 ILE O 1 1
9 4619 1 1 12 GLY C C 9.081 6.119 -0.485 1.00 . A A . 12 GLY C 1 1
9 4620 1 1 12 GLY CA C 10.475 5.717 -0.134 1.00 . A A . 12 GLY CA 1 1
9 4621 1 1 12 GLY H H 10.134 3.642 -0.339 1.00 . A A . 12 GLY H 1 1
9 4622 1 1 12 GLY HA2 H 10.764 6.355 0.689 1.00 . A A . 12 GLY HA2 1 1
9 4623 1 1 12 GLY HA3 H 11.085 5.855 -1.014 1.00 . A A . 12 GLY HA3 1 1
9 4624 1 1 12 GLY N N 10.563 4.317 0.250 1.00 . A A . 12 GLY N 1 1
9 4625 1 1 12 GLY O O 8.876 6.816 -1.474 1.00 . A A . 12 GLY O 1 1
9 4626 1 1 13 TYR C C 6.163 7.112 0.915 1.00 . A A . 13 TYR C 1 1
9 4627 1 1 13 TYR CA C 6.689 6.014 -0.005 1.00 . A A . 13 TYR CA 1 1
9 4628 1 1 13 TYR CB C 5.780 4.773 0.102 1.00 . A A . 13 TYR CB 1 1
9 4629 1 1 13 TYR CD1 C 4.512 5.095 -2.012 1.00 . A A . 13 TYR CD1 1 1
9 4630 1 1 13 TYR CD2 C 3.298 5.263 0.081 1.00 . A A . 13 TYR CD2 1 1
9 4631 1 1 13 TYR CE1 C 3.342 5.344 -2.723 1.00 . A A . 13 TYR CE1 1 1
9 4632 1 1 13 TYR CE2 C 2.122 5.498 -0.636 1.00 . A A . 13 TYR CE2 1 1
9 4633 1 1 13 TYR CG C 4.501 5.054 -0.610 1.00 . A A . 13 TYR CG 1 1
9 4634 1 1 13 TYR CZ C 2.148 5.543 -2.040 1.00 . A A . 13 TYR CZ 1 1
9 4635 1 1 13 TYR H H 8.253 5.183 1.137 1.00 . A A . 13 TYR H 1 1
9 4636 1 1 13 TYR HA H 6.629 6.392 -1.019 1.00 . A A . 13 TYR HA 1 1
9 4637 1 1 13 TYR HB2 H 6.253 3.910 -0.409 1.00 . A A . 13 TYR HB2 1 1
9 4638 1 1 13 TYR HB3 H 5.574 4.506 1.160 1.00 . A A . 13 TYR HB3 1 1
9 4639 1 1 13 TYR HD1 H 5.426 4.911 -2.559 1.00 . A A . 13 TYR HD1 1 1
9 4640 1 1 13 TYR HD2 H 3.275 5.238 1.163 1.00 . A A . 13 TYR HD2 1 1
9 4641 1 1 13 TYR HE1 H 3.342 5.348 -3.804 1.00 . A A . 13 TYR HE1 1 1
9 4642 1 1 13 TYR HE2 H 1.209 5.635 -0.076 1.00 . A A . 13 TYR HE2 1 1
9 4643 1 1 13 TYR HH H 0.253 5.427 -2.337 1.00 . A A . 13 TYR HH 1 1
9 4644 1 1 13 TYR N N 8.071 5.689 0.295 1.00 . A A . 13 TYR N 1 1
9 4645 1 1 13 TYR O O 6.324 7.083 2.129 1.00 . A A . 13 TYR O 1 1
9 4646 1 1 13 TYR OH O 1.024 5.729 -2.844 1.00 . A A . 13 TYR OH 1 1
9 4647 1 1 14 SER C C 3.611 9.630 0.695 1.00 . A A . 14 SER C 1 1
9 4648 1 1 14 SER CA C 5.081 9.366 0.929 1.00 . A A . 14 SER CA 1 1
9 4649 1 1 14 SER CB C 5.888 10.612 0.432 1.00 . A A . 14 SER CB 1 1
9 4650 1 1 14 SER H H 5.427 8.069 -0.685 1.00 . A A . 14 SER H 1 1
9 4651 1 1 14 SER HA H 5.203 9.286 2.001 1.00 . A A . 14 SER HA 1 1
9 4652 1 1 14 SER HB2 H 5.671 11.486 1.086 1.00 . A A . 14 SER HB2 1 1
9 4653 1 1 14 SER HB3 H 6.979 10.417 0.465 1.00 . A A . 14 SER HB3 1 1
9 4654 1 1 14 SER N N 5.527 8.121 0.306 1.00 . A A . 14 SER N 1 1
9 4655 1 1 14 SER O O 3.080 10.677 1.048 1.00 . A A . 14 SER O 1 1
9 4656 1 1 15 GLY C C 0.628 8.265 0.805 1.00 . A A . 15 GLY C 1 1
9 4657 1 1 15 GLY CA C 1.519 8.784 -0.296 1.00 . A A . 15 GLY CA 1 1
9 4658 1 1 15 GLY H H 3.355 7.782 -0.094 1.00 . A A . 15 GLY H 1 1
9 4659 1 1 15 GLY HA2 H 1.280 9.825 -0.467 1.00 . A A . 15 GLY HA2 1 1
9 4660 1 1 15 GLY HA3 H 1.380 8.171 -1.173 1.00 . A A . 15 GLY HA3 1 1
9 4661 1 1 15 GLY N N 2.920 8.661 0.067 1.00 . A A . 15 GLY N 1 1
9 4662 1 1 15 GLY O O 1.100 7.971 1.901 1.00 . A A . 15 GLY O 1 1
9 4663 1 1 16 PRO C C -1.198 6.346 2.346 1.00 . A A . 16 PRO C 1 1
9 4664 1 1 16 PRO CA C -1.624 7.571 1.533 1.00 . A A . 16 PRO CA 1 1
9 4665 1 1 16 PRO CB C -2.896 7.302 0.722 1.00 . A A . 16 PRO CB 1 1
9 4666 1 1 16 PRO CD C -1.317 8.560 -0.673 1.00 . A A . 16 PRO CD 1 1
9 4667 1 1 16 PRO CG C -2.799 8.184 -0.537 1.00 . A A . 16 PRO CG 1 1
9 4668 1 1 16 PRO HA H -1.765 8.361 2.256 1.00 . A A . 16 PRO HA 1 1
9 4669 1 1 16 PRO HB2 H -2.944 6.238 0.402 1.00 . A A . 16 PRO HB2 1 1
9 4670 1 1 16 PRO HB3 H -3.808 7.526 1.307 1.00 . A A . 16 PRO HB3 1 1
9 4671 1 1 16 PRO HD2 H -0.867 8.048 -1.556 1.00 . A A . 16 PRO HD2 1 1
9 4672 1 1 16 PRO HD3 H -1.201 9.661 -0.794 1.00 . A A . 16 PRO HD3 1 1
9 4673 1 1 16 PRO HG2 H -3.150 7.632 -1.438 1.00 . A A . 16 PRO HG2 1 1
9 4674 1 1 16 PRO HG3 H -3.413 9.101 -0.422 1.00 . A A . 16 PRO HG3 1 1
9 4675 1 1 16 PRO N N -0.672 8.111 0.564 1.00 . A A . 16 PRO N 1 1
9 4676 1 1 16 PRO O O -0.820 5.329 1.776 1.00 . A A . 16 PRO O 1 1
9 4677 1 1 17 THR C C -1.934 4.518 5.149 1.00 . A A . 17 THR C 1 1
9 4678 1 1 17 THR CA C -0.809 5.350 4.569 1.00 . A A . 17 THR CA 1 1
9 4679 1 1 17 THR CB C 0.030 5.992 5.664 1.00 . A A . 17 THR CB 1 1
9 4680 1 1 17 THR CG2 C -0.839 6.753 6.687 1.00 . A A . 17 THR CG2 1 1
9 4681 1 1 17 THR H H -1.644 7.224 4.123 1.00 . A A . 17 THR H 1 1
9 4682 1 1 17 THR HA H -0.178 4.674 4.011 1.00 . A A . 17 THR HA 1 1
9 4683 1 1 17 THR HB H 0.718 6.721 5.168 1.00 . A A . 17 THR HB 1 1
9 4684 1 1 17 THR HG1 H 1.258 4.484 5.695 1.00 . A A . 17 THR HG1 1 1
9 4685 1 1 17 THR HG21 H -1.084 6.095 7.550 1.00 . A A . 17 THR HG21 1 1
9 4686 1 1 17 THR HG22 H -1.788 7.115 6.249 1.00 . A A . 17 THR HG22 1 1
9 4687 1 1 17 THR HG23 H -0.277 7.627 7.078 1.00 . A A . 17 THR HG23 1 1
9 4688 1 1 17 THR N N -1.340 6.389 3.679 1.00 . A A . 17 THR N 1 1
9 4689 1 1 17 THR O O -1.802 3.725 6.073 1.00 . A A . 17 THR O 1 1
9 4690 1 1 17 THR OG1 O 0.838 5.050 6.355 1.00 . A A . 17 THR OG1 1 1
9 4691 1 1 18 VAL C C -4.741 3.077 3.910 1.00 . A A . 18 VAL C 1 1
9 4692 1 1 18 VAL CA C -4.303 3.957 5.036 1.00 . A A . 18 VAL CA 1 1
9 4693 1 1 18 VAL CB C -5.435 4.898 5.438 1.00 . A A . 18 VAL CB 1 1
9 4694 1 1 18 VAL CG1 C -6.623 4.120 6.042 1.00 . A A . 18 VAL CG1 1 1
9 4695 1 1 18 VAL CG2 C -4.890 5.870 6.496 1.00 . A A . 18 VAL CG2 1 1
9 4696 1 1 18 VAL H H -3.181 5.192 3.731 1.00 . A A . 18 VAL H 1 1
9 4697 1 1 18 VAL HA H -4.072 3.320 5.880 1.00 . A A . 18 VAL HA 1 1
9 4698 1 1 18 VAL HB H -5.781 5.485 4.561 1.00 . A A . 18 VAL HB 1 1
9 4699 1 1 18 VAL HG11 H -7.549 4.732 6.004 1.00 . A A . 18 VAL HG11 1 1
9 4700 1 1 18 VAL HG12 H -6.423 3.874 7.107 1.00 . A A . 18 VAL HG12 1 1
9 4701 1 1 18 VAL HG13 H -6.828 3.163 5.526 1.00 . A A . 18 VAL HG13 1 1
9 4702 1 1 18 VAL HG21 H -4.332 5.301 7.273 1.00 . A A . 18 VAL HG21 1 1
9 4703 1 1 18 VAL HG22 H -5.721 6.408 6.998 1.00 . A A . 18 VAL HG22 1 1
9 4704 1 1 18 VAL HG23 H -4.199 6.614 6.052 1.00 . A A . 18 VAL HG23 1 1
9 4705 1 1 18 VAL N N -3.128 4.650 4.559 1.00 . A A . 18 VAL N 1 1
9 4706 1 1 18 VAL O O -5.061 3.535 2.810 1.00 . A A . 18 VAL O 1 1
9 4707 1 1 19 CYS C C -6.868 1.050 3.104 1.00 . A A . 19 CYS C 1 1
9 4708 1 1 19 CYS CA C -5.385 0.857 3.194 1.00 . A A . 19 CYS CA 1 1
9 4709 1 1 19 CYS CB C -4.971 -0.572 3.511 1.00 . A A . 19 CYS CB 1 1
9 4710 1 1 19 CYS H H -4.483 1.378 5.001 1.00 . A A . 19 CYS H 1 1
9 4711 1 1 19 CYS HA H -5.032 1.106 2.208 1.00 . A A . 19 CYS HA 1 1
9 4712 1 1 19 CYS HB2 H -5.177 -0.808 4.581 1.00 . A A . 19 CYS HB2 1 1
9 4713 1 1 19 CYS HB3 H -5.496 -1.328 2.910 1.00 . A A . 19 CYS HB3 1 1
9 4714 1 1 19 CYS N N -4.771 1.765 4.128 1.00 . A A . 19 CYS N 1 1
9 4715 1 1 19 CYS O O -7.518 1.388 4.084 1.00 . A A . 19 CYS O 1 1
9 4716 1 1 19 CYS SG S -3.222 -0.702 3.129 1.00 . A A . 19 CYS SG 1 1
9 4717 1 1 20 ALA C C -9.722 0.359 2.597 1.00 . A A . 20 ALA C 1 1
9 4718 1 1 20 ALA CA C -8.834 0.974 1.551 1.00 . A A . 20 ALA CA 1 1
9 4719 1 1 20 ALA CB C -9.123 0.347 0.163 1.00 . A A . 20 ALA CB 1 1
9 4720 1 1 20 ALA H H -6.848 0.529 1.159 1.00 . A A . 20 ALA H 1 1
9 4721 1 1 20 ALA HA H -9.120 2.002 1.551 1.00 . A A . 20 ALA HA 1 1
9 4722 1 1 20 ALA HB1 H -8.331 0.622 -0.565 1.00 . A A . 20 ALA HB1 1 1
9 4723 1 1 20 ALA HB2 H -10.108 0.669 -0.234 1.00 . A A . 20 ALA HB2 1 1
9 4724 1 1 20 ALA HB3 H -9.146 -0.760 0.229 1.00 . A A . 20 ALA HB3 1 1
9 4725 1 1 20 ALA N N -7.418 0.942 1.872 1.00 . A A . 20 ALA N 1 1
9 4726 1 1 20 ALA O O -9.332 -0.606 3.222 1.00 . A A . 20 ALA O 1 1
9 4727 1 1 21 SER C C -12.216 -1.153 3.663 1.00 . A A . 21 SER C 1 1
9 4728 1 1 21 SER CA C -11.851 0.335 3.816 1.00 . A A . 21 SER CA 1 1
9 4729 1 1 21 SER CB C -13.074 1.302 3.933 1.00 . A A . 21 SER CB 1 1
9 4730 1 1 21 SER H H -11.260 1.668 2.308 1.00 . A A . 21 SER H 1 1
9 4731 1 1 21 SER HA H -11.333 0.374 4.766 1.00 . A A . 21 SER HA 1 1
9 4732 1 1 21 SER HB2 H -12.808 2.131 4.626 1.00 . A A . 21 SER HB2 1 1
9 4733 1 1 21 SER HB3 H -13.249 1.751 2.929 1.00 . A A . 21 SER HB3 1 1
9 4734 1 1 21 SER HG H -14.160 0.206 5.146 1.00 . A A . 21 SER HG 1 1
9 4735 1 1 21 SER N N -10.936 0.874 2.809 1.00 . A A . 21 SER N 1 1
9 4736 1 1 21 SER O O -12.748 -1.765 4.581 1.00 . A A . 21 SER O 1 1
9 4737 1 1 21 SER OG O -14.309 0.721 4.341 1.00 . A A . 21 SER OG 1 1
9 4738 1 1 22 GLY C C -10.538 -3.869 2.130 1.00 . A A . 22 GLY C 1 1
9 4739 1 1 22 GLY CA C -11.889 -3.198 2.250 1.00 . A A . 22 GLY CA 1 1
9 4740 1 1 22 GLY H H -11.396 -1.204 1.832 1.00 . A A . 22 GLY H 1 1
9 4741 1 1 22 GLY HA2 H -12.428 -3.706 3.035 1.00 . A A . 22 GLY HA2 1 1
9 4742 1 1 22 GLY HA3 H -12.354 -3.317 1.284 1.00 . A A . 22 GLY HA3 1 1
9 4743 1 1 22 GLY N N -11.843 -1.763 2.514 1.00 . A A . 22 GLY N 1 1
9 4744 1 1 22 GLY O O -10.484 -5.042 1.788 1.00 . A A . 22 GLY O 1 1
9 4745 1 1 23 THR C C -7.198 -3.378 3.398 1.00 . A A . 23 THR C 1 1
9 4746 1 1 23 THR CA C -8.054 -3.648 2.150 1.00 . A A . 23 THR CA 1 1
9 4747 1 1 23 THR CB C -7.298 -3.006 0.964 1.00 . A A . 23 THR CB 1 1
9 4748 1 1 23 THR CG2 C -8.038 -3.102 -0.376 1.00 . A A . 23 THR CG2 1 1
9 4749 1 1 23 THR H H -9.497 -2.238 2.771 1.00 . A A . 23 THR H 1 1
9 4750 1 1 23 THR HA H -8.106 -4.710 2.006 1.00 . A A . 23 THR HA 1 1
9 4751 1 1 23 THR HB H -6.305 -3.489 0.841 1.00 . A A . 23 THR HB 1 1
9 4752 1 1 23 THR HG1 H -7.579 -1.446 1.964 1.00 . A A . 23 THR HG1 1 1
9 4753 1 1 23 THR HG21 H -7.776 -4.053 -0.875 1.00 . A A . 23 THR HG21 1 1
9 4754 1 1 23 THR HG22 H -7.733 -2.268 -1.043 1.00 . A A . 23 THR HG22 1 1
9 4755 1 1 23 THR HG23 H -9.134 -3.066 -0.245 1.00 . A A . 23 THR HG23 1 1
9 4756 1 1 23 THR N N -9.421 -3.146 2.353 1.00 . A A . 23 THR N 1 1
9 4757 1 1 23 THR O O -7.455 -2.449 4.159 1.00 . A A . 23 THR O 1 1
9 4758 1 1 23 THR OG1 O -7.054 -1.641 1.153 1.00 . A A . 23 THR OG1 1 1
9 4759 1 1 24 THR C C -3.770 -3.920 4.412 1.00 . A A . 24 THR C 1 1
9 4760 1 1 24 THR CA C -5.238 -4.072 4.784 1.00 . A A . 24 THR CA 1 1
9 4761 1 1 24 THR CB C -5.392 -5.325 5.636 1.00 . A A . 24 THR CB 1 1
9 4762 1 1 24 THR CG2 C -4.394 -5.393 6.805 1.00 . A A . 24 THR CG2 1 1
9 4763 1 1 24 THR H H -6.002 -4.931 2.982 1.00 . A A . 24 THR H 1 1
9 4764 1 1 24 THR HA H -5.501 -3.211 5.383 1.00 . A A . 24 THR HA 1 1
9 4765 1 1 24 THR HB H -5.273 -6.229 4.990 1.00 . A A . 24 THR HB 1 1
9 4766 1 1 24 THR HG1 H -7.291 -5.556 5.470 1.00 . A A . 24 THR HG1 1 1
9 4767 1 1 24 THR HG21 H -4.074 -4.384 7.132 1.00 . A A . 24 THR HG21 1 1
9 4768 1 1 24 THR HG22 H -3.499 -5.980 6.511 1.00 . A A . 24 THR HG22 1 1
9 4769 1 1 24 THR HG23 H -4.856 -5.889 7.685 1.00 . A A . 24 THR HG23 1 1
9 4770 1 1 24 THR N N -6.113 -4.137 3.606 1.00 . A A . 24 THR N 1 1
9 4771 1 1 24 THR O O -3.310 -4.522 3.449 1.00 . A A . 24 THR O 1 1
9 4772 1 1 24 THR OG1 O -6.692 -5.358 6.201 1.00 . A A . 24 THR OG1 1 1
9 4773 1 1 25 CYS C C -0.680 -4.027 5.207 1.00 . A A . 25 CYS C 1 1
9 4774 1 1 25 CYS CA C -1.558 -2.862 4.816 1.00 . A A . 25 CYS CA 1 1
9 4775 1 1 25 CYS CB C -0.965 -1.577 5.478 1.00 . A A . 25 CYS CB 1 1
9 4776 1 1 25 CYS H H -3.314 -2.647 5.954 1.00 . A A . 25 CYS H 1 1
9 4777 1 1 25 CYS HA H -1.479 -2.766 3.741 1.00 . A A . 25 CYS HA 1 1
9 4778 1 1 25 CYS HB2 H -1.693 -0.748 5.381 1.00 . A A . 25 CYS HB2 1 1
9 4779 1 1 25 CYS HB3 H -0.827 -1.749 6.567 1.00 . A A . 25 CYS HB3 1 1
9 4780 1 1 25 CYS N N -2.972 -3.090 5.134 1.00 . A A . 25 CYS N 1 1
9 4781 1 1 25 CYS O O -0.682 -4.470 6.353 1.00 . A A . 25 CYS O 1 1
9 4782 1 1 25 CYS SG S 0.619 -1.024 4.759 1.00 . A A . 25 CYS SG 1 1
9 4783 1 1 26 GLN C C 2.201 -5.469 3.644 1.00 . A A . 26 GLN C 1 1
9 4784 1 1 26 GLN CA C 0.958 -5.681 4.475 1.00 . A A . 26 GLN CA 1 1
9 4785 1 1 26 GLN CB C 0.287 -7.020 4.067 1.00 . A A . 26 GLN CB 1 1
9 4786 1 1 26 GLN CD C -1.745 -8.541 4.322 1.00 . A A . 26 GLN CD 1 1
9 4787 1 1 26 GLN CG C -1.162 -7.156 4.593 1.00 . A A . 26 GLN CG 1 1
9 4788 1 1 26 GLN H H 0.068 -4.194 3.310 1.00 . A A . 26 GLN H 1 1
9 4789 1 1 26 GLN HA H 1.262 -5.705 5.513 1.00 . A A . 26 GLN HA 1 1
9 4790 1 1 26 GLN HB2 H 0.268 -7.110 2.959 1.00 . A A . 26 GLN HB2 1 1
9 4791 1 1 26 GLN HB3 H 0.898 -7.862 4.462 1.00 . A A . 26 GLN HB3 1 1
9 4792 1 1 26 GLN HE21 H -3.543 -7.747 3.775 1.00 . A A . 26 GLN HE21 1 1
9 4793 1 1 26 GLN HE22 H -3.424 -9.490 3.758 1.00 . A A . 26 GLN HE22 1 1
9 4794 1 1 26 GLN HG2 H -1.180 -6.988 5.689 1.00 . A A . 26 GLN HG2 1 1
9 4795 1 1 26 GLN HG3 H -1.800 -6.386 4.116 1.00 . A A . 26 GLN HG3 1 1
9 4796 1 1 26 GLN N N 0.100 -4.547 4.253 1.00 . A A . 26 GLN N 1 1
9 4797 1 1 26 GLN NE2 N -3.039 -8.591 3.938 1.00 . A A . 26 GLN NE2 1 1
9 4798 1 1 26 GLN O O 2.377 -4.458 2.970 1.00 . A A . 26 GLN O 1 1
9 4799 1 1 26 GLN OE1 O -1.082 -9.566 4.465 1.00 . A A . 26 GLN OE1 1 1
9 4800 1 1 27 VAL C C 4.451 -7.250 1.839 1.00 . A A . 27 VAL C 1 1
9 4801 1 1 27 VAL CA C 4.405 -6.306 3.017 1.00 . A A . 27 VAL CA 1 1
9 4802 1 1 27 VAL CB C 5.553 -6.534 3.992 1.00 . A A . 27 VAL CB 1 1
9 4803 1 1 27 VAL CG1 C 6.880 -6.825 3.264 1.00 . A A . 27 VAL CG1 1 1
9 4804 1 1 27 VAL CG2 C 5.673 -5.271 4.866 1.00 . A A . 27 VAL CG2 1 1
9 4805 1 1 27 VAL H H 2.964 -7.279 4.165 1.00 . A A . 27 VAL H 1 1
9 4806 1 1 27 VAL HA H 4.536 -5.314 2.611 1.00 . A A . 27 VAL HA 1 1
9 4807 1 1 27 VAL HB H 5.317 -7.406 4.647 1.00 . A A . 27 VAL HB 1 1
9 4808 1 1 27 VAL HG11 H 6.908 -7.880 2.911 1.00 . A A . 27 VAL HG11 1 1
9 4809 1 1 27 VAL HG12 H 7.739 -6.666 3.949 1.00 . A A . 27 VAL HG12 1 1
9 4810 1 1 27 VAL HG13 H 7.002 -6.150 2.394 1.00 . A A . 27 VAL HG13 1 1
9 4811 1 1 27 VAL HG21 H 4.757 -5.121 5.476 1.00 . A A . 27 VAL HG21 1 1
9 4812 1 1 27 VAL HG22 H 5.821 -4.368 4.234 1.00 . A A . 27 VAL HG22 1 1
9 4813 1 1 27 VAL HG23 H 6.539 -5.360 5.556 1.00 . A A . 27 VAL HG23 1 1
9 4814 1 1 27 VAL N N 3.132 -6.422 3.687 1.00 . A A . 27 VAL N 1 1
9 4815 1 1 27 VAL O O 4.180 -8.440 1.961 1.00 . A A . 27 VAL O 1 1
9 4816 1 1 28 LEU C C 6.581 -7.635 -0.709 1.00 . A A . 28 LEU C 1 1
9 4817 1 1 28 LEU CA C 5.075 -7.536 -0.514 1.00 . A A . 28 LEU CA 1 1
9 4818 1 1 28 LEU CB C 4.314 -6.955 -1.745 1.00 . A A . 28 LEU CB 1 1
9 4819 1 1 28 LEU CD1 C 5.218 -8.714 -3.417 1.00 . A A . 28 LEU CD1 1 1
9 4820 1 1 28 LEU CD2 C 3.922 -6.727 -4.260 1.00 . A A . 28 LEU CD2 1 1
9 4821 1 1 28 LEU CG C 4.880 -7.235 -3.165 1.00 . A A . 28 LEU CG 1 1
9 4822 1 1 28 LEU H H 4.962 -5.739 0.559 1.00 . A A . 28 LEU H 1 1
9 4823 1 1 28 LEU HA H 4.733 -8.552 -0.360 1.00 . A A . 28 LEU HA 1 1
9 4824 1 1 28 LEU HB2 H 3.273 -7.345 -1.697 1.00 . A A . 28 LEU HB2 1 1
9 4825 1 1 28 LEU HB3 H 4.241 -5.857 -1.601 1.00 . A A . 28 LEU HB3 1 1
9 4826 1 1 28 LEU HD11 H 6.299 -8.820 -3.654 1.00 . A A . 28 LEU HD11 1 1
9 4827 1 1 28 LEU HD12 H 4.635 -9.141 -4.256 1.00 . A A . 28 LEU HD12 1 1
9 4828 1 1 28 LEU HD13 H 5.006 -9.326 -2.516 1.00 . A A . 28 LEU HD13 1 1
9 4829 1 1 28 LEU HD21 H 3.710 -7.506 -5.019 1.00 . A A . 28 LEU HD21 1 1
9 4830 1 1 28 LEU HD22 H 4.357 -5.859 -4.797 1.00 . A A . 28 LEU HD22 1 1
9 4831 1 1 28 LEU HD23 H 2.951 -6.424 -3.814 1.00 . A A . 28 LEU HD23 1 1
9 4832 1 1 28 LEU HG H 5.832 -6.656 -3.256 1.00 . A A . 28 LEU HG 1 1
9 4833 1 1 28 LEU N N 4.797 -6.719 0.651 1.00 . A A . 28 LEU N 1 1
9 4834 1 1 28 LEU O O 7.124 -8.664 -1.104 1.00 . A A . 28 LEU O 1 1
9 4835 1 1 29 ASN C C 9.333 -5.574 0.442 1.00 . A A . 29 ASN C 1 1
9 4836 1 1 29 ASN CA C 8.779 -6.624 -0.526 1.00 . A A . 29 ASN CA 1 1
9 4837 1 1 29 ASN CB C 9.170 -6.519 -2.054 1.00 . A A . 29 ASN CB 1 1
9 4838 1 1 29 ASN CG C 9.289 -5.122 -2.648 1.00 . A A . 29 ASN CG 1 1
9 4839 1 1 29 ASN H H 6.952 -5.743 0.014 1.00 . A A . 29 ASN H 1 1
9 4840 1 1 29 ASN HA H 9.106 -7.584 -0.145 1.00 . A A . 29 ASN HA 1 1
9 4841 1 1 29 ASN HB2 H 10.159 -6.999 -2.192 1.00 . A A . 29 ASN HB2 1 1
9 4842 1 1 29 ASN HB3 H 8.444 -7.116 -2.643 1.00 . A A . 29 ASN HB3 1 1
9 4843 1 1 29 ASN HD21 H 8.370 -5.640 -4.398 1.00 . A A . 29 ASN HD21 1 1
9 4844 1 1 29 ASN HD22 H 8.771 -3.951 -4.186 1.00 . A A . 29 ASN HD22 1 1
9 4845 1 1 29 ASN N N 7.342 -6.578 -0.380 1.00 . A A . 29 ASN N 1 1
9 4846 1 1 29 ASN ND2 N 8.770 -4.896 -3.869 1.00 . A A . 29 ASN ND2 1 1
9 4847 1 1 29 ASN O O 8.545 -4.798 0.985 1.00 . A A . 29 ASN O 1 1
9 4848 1 1 29 ASN OD1 O 9.858 -4.210 -2.047 1.00 . A A . 29 ASN OD1 1 1
9 4849 1 1 30 PRO C C 10.969 -3.092 1.362 1.00 . A A . 30 PRO C 1 1
9 4850 1 1 30 PRO CA C 11.172 -4.562 1.728 1.00 . A A . 30 PRO CA 1 1
9 4851 1 1 30 PRO CB C 12.673 -4.927 1.838 1.00 . A A . 30 PRO CB 1 1
9 4852 1 1 30 PRO CD C 11.670 -6.263 0.054 1.00 . A A . 30 PRO CD 1 1
9 4853 1 1 30 PRO CG C 12.918 -6.145 0.926 1.00 . A A . 30 PRO CG 1 1
9 4854 1 1 30 PRO HA H 10.637 -4.720 2.654 1.00 . A A . 30 PRO HA 1 1
9 4855 1 1 30 PRO HB2 H 13.328 -4.086 1.531 1.00 . A A . 30 PRO HB2 1 1
9 4856 1 1 30 PRO HB3 H 12.930 -5.176 2.889 1.00 . A A . 30 PRO HB3 1 1
9 4857 1 1 30 PRO HD2 H 11.853 -5.813 -0.948 1.00 . A A . 30 PRO HD2 1 1
9 4858 1 1 30 PRO HD3 H 11.371 -7.330 -0.058 1.00 . A A . 30 PRO HD3 1 1
9 4859 1 1 30 PRO HG2 H 13.830 -6.021 0.304 1.00 . A A . 30 PRO HG2 1 1
9 4860 1 1 30 PRO HG3 H 13.028 -7.062 1.545 1.00 . A A . 30 PRO HG3 1 1
9 4861 1 1 30 PRO N N 10.633 -5.480 0.723 1.00 . A A . 30 PRO N 1 1
9 4862 1 1 30 PRO O O 11.046 -2.235 2.230 1.00 . A A . 30 PRO O 1 1
9 4863 1 1 31 TYR C C 9.217 -1.206 -0.968 1.00 . A A . 31 TYR C 1 1
9 4864 1 1 31 TYR CA C 10.652 -1.464 -0.502 1.00 . A A . 31 TYR CA 1 1
9 4865 1 1 31 TYR CB C 11.666 -1.303 -1.693 1.00 . A A . 31 TYR CB 1 1
9 4866 1 1 31 TYR CD1 C 13.631 -2.707 -0.872 1.00 . A A . 31 TYR CD1 1 1
9 4867 1 1 31 TYR CD2 C 13.968 -0.338 -1.173 1.00 . A A . 31 TYR CD2 1 1
9 4868 1 1 31 TYR CE1 C 14.905 -2.821 -0.296 1.00 . A A . 31 TYR CE1 1 1
9 4869 1 1 31 TYR CE2 C 15.249 -0.451 -0.610 1.00 . A A . 31 TYR CE2 1 1
9 4870 1 1 31 TYR CG C 13.109 -1.452 -1.240 1.00 . A A . 31 TYR CG 1 1
9 4871 1 1 31 TYR CZ C 15.700 -1.685 -0.139 1.00 . A A . 31 TYR CZ 1 1
9 4872 1 1 31 TYR H H 10.607 -3.526 -0.590 1.00 . A A . 31 TYR H 1 1
9 4873 1 1 31 TYR HA H 10.862 -0.729 0.258 1.00 . A A . 31 TYR HA 1 1
9 4874 1 1 31 TYR HB2 H 11.473 -2.072 -2.470 1.00 . A A . 31 TYR HB2 1 1
9 4875 1 1 31 TYR HB3 H 11.550 -0.301 -2.161 1.00 . A A . 31 TYR HB3 1 1
9 4876 1 1 31 TYR HD1 H 13.015 -3.586 -0.969 1.00 . A A . 31 TYR HD1 1 1
9 4877 1 1 31 TYR HD2 H 13.618 0.631 -1.493 1.00 . A A . 31 TYR HD2 1 1
9 4878 1 1 31 TYR HE1 H 15.255 -3.782 0.050 1.00 . A A . 31 TYR HE1 1 1
9 4879 1 1 31 TYR HE2 H 15.880 0.419 -0.498 1.00 . A A . 31 TYR HE2 1 1
9 4880 1 1 31 TYR HH H 17.040 -2.658 0.854 1.00 . A A . 31 TYR HH 1 1
9 4881 1 1 31 TYR N N 10.737 -2.787 0.075 1.00 . A A . 31 TYR N 1 1
9 4882 1 1 31 TYR O O 8.926 -0.202 -1.617 1.00 . A A . 31 TYR O 1 1
9 4883 1 1 31 TYR OH O 16.950 -1.772 0.500 1.00 . A A . 31 TYR OH 1 1
9 4884 1 1 32 TYR C C 5.932 -2.716 -0.152 1.00 . A A . 32 TYR C 1 1
9 4885 1 1 32 TYR CA C 6.905 -2.029 -1.107 1.00 . A A . 32 TYR CA 1 1
9 4886 1 1 32 TYR CB C 6.813 -2.653 -2.527 1.00 . A A . 32 TYR CB 1 1
9 4887 1 1 32 TYR CD1 C 5.092 -1.197 -3.671 1.00 . A A . 32 TYR CD1 1 1
9 4888 1 1 32 TYR CD2 C 4.609 -3.533 -3.356 1.00 . A A . 32 TYR CD2 1 1
9 4889 1 1 32 TYR CE1 C 3.832 -1.011 -4.259 1.00 . A A . 32 TYR CE1 1 1
9 4890 1 1 32 TYR CE2 C 3.366 -3.364 -3.975 1.00 . A A . 32 TYR CE2 1 1
9 4891 1 1 32 TYR CG C 5.473 -2.450 -3.176 1.00 . A A . 32 TYR CG 1 1
9 4892 1 1 32 TYR CZ C 2.972 -2.100 -4.401 1.00 . A A . 32 TYR CZ 1 1
9 4893 1 1 32 TYR H H 8.496 -2.860 -0.010 1.00 . A A . 32 TYR H 1 1
9 4894 1 1 32 TYR HA H 6.609 -0.998 -1.163 1.00 . A A . 32 TYR HA 1 1
9 4895 1 1 32 TYR HB2 H 7.584 -2.215 -3.194 1.00 . A A . 32 TYR HB2 1 1
9 4896 1 1 32 TYR HB3 H 6.994 -3.744 -2.437 1.00 . A A . 32 TYR HB3 1 1
9 4897 1 1 32 TYR HD1 H 5.779 -0.371 -3.608 1.00 . A A . 32 TYR HD1 1 1
9 4898 1 1 32 TYR HD2 H 4.926 -4.503 -3.022 1.00 . A A . 32 TYR HD2 1 1
9 4899 1 1 32 TYR HE1 H 3.543 -0.034 -4.611 1.00 . A A . 32 TYR HE1 1 1
9 4900 1 1 32 TYR HE2 H 2.705 -4.203 -4.127 1.00 . A A . 32 TYR HE2 1 1
9 4901 1 1 32 TYR HH H 1.668 -1.090 -5.400 1.00 . A A . 32 TYR HH 1 1
9 4902 1 1 32 TYR N N 8.260 -2.084 -0.599 1.00 . A A . 32 TYR N 1 1
9 4903 1 1 32 TYR O O 5.854 -3.942 -0.049 1.00 . A A . 32 TYR O 1 1
9 4904 1 1 32 TYR OH O 1.718 -1.959 -5.002 1.00 . A A . 32 TYR OH 1 1
9 4905 1 1 33 SER C C 2.789 -2.129 0.733 1.00 . A A . 33 SER C 1 1
9 4906 1 1 33 SER CA C 4.087 -2.361 1.453 1.00 . A A . 33 SER CA 1 1
9 4907 1 1 33 SER CB C 3.987 -1.604 2.804 1.00 . A A . 33 SER CB 1 1
9 4908 1 1 33 SER H H 5.170 -0.910 0.458 1.00 . A A . 33 SER H 1 1
9 4909 1 1 33 SER HA H 4.205 -3.415 1.648 1.00 . A A . 33 SER HA 1 1
9 4910 1 1 33 SER HB2 H 3.495 -0.618 2.688 1.00 . A A . 33 SER HB2 1 1
9 4911 1 1 33 SER HB3 H 3.361 -2.192 3.512 1.00 . A A . 33 SER HB3 1 1
9 4912 1 1 33 SER HG H 5.745 -0.790 2.800 1.00 . A A . 33 SER HG 1 1
9 4913 1 1 33 SER N N 5.129 -1.905 0.554 1.00 . A A . 33 SER N 1 1
9 4914 1 1 33 SER O O 2.414 -1.002 0.408 1.00 . A A . 33 SER O 1 1
9 4915 1 1 33 SER OG O 5.276 -1.398 3.377 1.00 . A A . 33 SER OG 1 1
9 4916 1 1 34 GLN C C -0.350 -3.287 0.508 1.00 . A A . 34 GLN C 1 1
9 4917 1 1 34 GLN CA C 0.897 -3.213 -0.361 1.00 . A A . 34 GLN CA 1 1
9 4918 1 1 34 GLN CB C 1.003 -4.391 -1.351 1.00 . A A . 34 GLN CB 1 1
9 4919 1 1 34 GLN CD C 0.016 -5.628 -3.325 1.00 . A A . 34 GLN CD 1 1
9 4920 1 1 34 GLN CG C -0.231 -4.580 -2.244 1.00 . A A . 34 GLN CG 1 1
9 4921 1 1 34 GLN H H 2.330 -4.084 0.858 1.00 . A A . 34 GLN H 1 1
9 4922 1 1 34 GLN HA H 0.839 -2.296 -0.932 1.00 . A A . 34 GLN HA 1 1
9 4923 1 1 34 GLN HB2 H 1.889 -4.186 -1.989 1.00 . A A . 34 GLN HB2 1 1
9 4924 1 1 34 GLN HB3 H 1.211 -5.333 -0.794 1.00 . A A . 34 GLN HB3 1 1
9 4925 1 1 34 GLN HE21 H 0.113 -4.199 -4.786 1.00 . A A . 34 GLN HE21 1 1
9 4926 1 1 34 GLN HE22 H 0.241 -5.874 -5.298 1.00 . A A . 34 GLN HE22 1 1
9 4927 1 1 34 GLN HG2 H -1.087 -4.931 -1.634 1.00 . A A . 34 GLN HG2 1 1
9 4928 1 1 34 GLN HG3 H -0.492 -3.605 -2.699 1.00 . A A . 34 GLN HG3 1 1
9 4929 1 1 34 GLN N N 2.082 -3.212 0.441 1.00 . A A . 34 GLN N 1 1
9 4930 1 1 34 GLN NE2 N 0.152 -5.182 -4.589 1.00 . A A . 34 GLN NE2 1 1
9 4931 1 1 34 GLN O O -0.328 -3.758 1.637 1.00 . A A . 34 GLN O 1 1
9 4932 1 1 34 GLN OE1 O 0.057 -6.828 -3.069 1.00 . A A . 34 GLN OE1 1 1
9 4933 1 1 35 CYS C C -3.653 -3.952 0.053 1.00 . A A . 35 CYS C 1 1
9 4934 1 1 35 CYS CA C -2.778 -2.859 0.645 1.00 . A A . 35 CYS CA 1 1
9 4935 1 1 35 CYS CB C -3.525 -1.559 0.316 1.00 . A A . 35 CYS CB 1 1
9 4936 1 1 35 CYS H H -1.434 -2.301 -0.871 1.00 . A A . 35 CYS H 1 1
9 4937 1 1 35 CYS HA H -2.676 -3.025 1.705 1.00 . A A . 35 CYS HA 1 1
9 4938 1 1 35 CYS HB2 H -3.304 -1.361 -0.753 1.00 . A A . 35 CYS HB2 1 1
9 4939 1 1 35 CYS HB3 H -4.621 -1.661 0.460 1.00 . A A . 35 CYS HB3 1 1
9 4940 1 1 35 CYS N N -1.483 -2.793 -0.001 1.00 . A A . 35 CYS N 1 1
9 4941 1 1 35 CYS O O -3.913 -3.947 -1.141 1.00 . A A . 35 CYS O 1 1
9 4942 1 1 35 CYS SG S -3.001 -0.108 1.213 1.00 . A A . 35 CYS SG 1 1
9 4943 1 1 36 LEU C C -6.290 -6.172 0.885 1.00 . A A . 36 LEU C 1 1
9 4944 1 1 36 LEU CA C -4.861 -6.062 0.350 1.00 . A A . 36 LEU CA 1 1
9 4945 1 1 36 LEU CB C -4.173 -7.372 0.775 1.00 . A A . 36 LEU CB 1 1
9 4946 1 1 36 LEU CD1 C -2.715 -7.301 -1.254 1.00 . A A . 36 LEU CD1 1 1
9 4947 1 1 36 LEU CD2 C -1.719 -6.671 0.985 1.00 . A A . 36 LEU CD2 1 1
9 4948 1 1 36 LEU CG C -2.742 -7.550 0.254 1.00 . A A . 36 LEU CG 1 1
9 4949 1 1 36 LEU H H -3.954 -4.908 1.835 1.00 . A A . 36 LEU H 1 1
9 4950 1 1 36 LEU HA H -4.952 -6.019 -0.722 1.00 . A A . 36 LEU HA 1 1
9 4951 1 1 36 LEU HB2 H -4.179 -7.433 1.883 1.00 . A A . 36 LEU HB2 1 1
9 4952 1 1 36 LEU HB3 H -4.787 -8.222 0.396 1.00 . A A . 36 LEU HB3 1 1
9 4953 1 1 36 LEU HD11 H -2.794 -6.215 -1.467 1.00 . A A . 36 LEU HD11 1 1
9 4954 1 1 36 LEU HD12 H -3.579 -7.803 -1.732 1.00 . A A . 36 LEU HD12 1 1
9 4955 1 1 36 LEU HD13 H -1.774 -7.681 -1.697 1.00 . A A . 36 LEU HD13 1 1
9 4956 1 1 36 LEU HD21 H -2.080 -6.425 2.004 1.00 . A A . 36 LEU HD21 1 1
9 4957 1 1 36 LEU HD22 H -1.581 -5.714 0.449 1.00 . A A . 36 LEU HD22 1 1
9 4958 1 1 36 LEU HD23 H -0.735 -7.171 1.054 1.00 . A A . 36 LEU HD23 1 1
9 4959 1 1 36 LEU HG H -2.465 -8.614 0.452 1.00 . A A . 36 LEU HG 1 1
9 4960 1 1 36 LEU N N -4.156 -4.897 0.853 1.00 . A A . 36 LEU N 1 1
9 4961 1 1 36 LEU O O -7.234 -6.123 0.056 1.00 . A A . 36 LEU O 1 1
9 4962 1 1 36 LEU OXT O -6.444 -6.320 2.124 1.00 . A A . 36 LEU OXT 1 1
9 4963 2 2 1 MAN C1 C -9.401 3.942 -0.350 1.00 . B A . 101 MAN C1 1 1
9 4964 2 2 1 MAN C2 C -8.423 4.228 -1.450 1.00 . B A . 101 MAN C2 1 1
9 4965 2 2 1 MAN C3 C -8.468 5.690 -1.769 1.00 . B A . 101 MAN C3 1 1
9 4966 2 2 1 MAN C4 C -9.842 6.070 -2.229 1.00 . B A . 101 MAN C4 1 1
9 4967 2 2 1 MAN C5 C -10.884 5.594 -1.212 1.00 . B A . 101 MAN C5 1 1
9 4968 2 2 1 MAN C6 C -12.288 5.726 -1.750 1.00 . B A . 101 MAN C6 1 1
9 4969 2 2 1 MAN H1 H -9.394 2.858 -0.171 1.00 . B A . 101 MAN H1 1 1
9 4970 2 2 1 MAN H2 H -7.444 3.921 -1.076 1.00 . B A . 101 MAN H2 1 1
9 4971 2 2 1 MAN H3 H -8.305 6.246 -0.826 1.00 . B A . 101 MAN H3 1 1
9 4972 2 2 1 MAN H4 H -10.050 5.586 -3.214 1.00 . B A . 101 MAN H4 1 1
9 4973 2 2 1 MAN H5 H -10.795 6.227 -0.300 1.00 . B A . 101 MAN H5 1 1
9 4974 2 2 1 MAN H61 H -12.396 5.107 -2.671 1.00 . B A . 101 MAN H61 1 1
9 4975 2 2 1 MAN H62 H -12.482 6.787 -2.028 1.00 . B A . 101 MAN H62 1 1
9 4976 2 2 1 MAN HO2 H -7.945 3.658 -3.243 1.00 . B A . 101 MAN HO2 1 1
9 4977 2 2 1 MAN HO3 H -7.402 5.691 -3.484 1.00 . B A . 101 MAN HO3 1 1
9 4978 2 2 1 MAN HO4 H -9.200 7.763 -2.955 1.00 . B A . 101 MAN HO4 1 1
9 4979 2 2 1 MAN HO6 H -12.860 5.106 0.044 1.00 . B A . 101 MAN HO6 1 1
9 4980 2 2 1 MAN O1 O -9.101 4.698 0.851 1.00 . B A . 101 MAN O1 1 1
9 4981 2 2 1 MAN O2 O -8.640 3.440 -2.600 1.00 . B A . 101 MAN O2 1 1
9 4982 2 2 1 MAN O3 O -7.425 6.142 -2.631 1.00 . B A . 101 MAN O3 1 1
9 4983 2 2 1 MAN O4 O -9.915 7.481 -2.366 1.00 . B A . 101 MAN O4 1 1
9 4984 2 2 1 MAN O5 O -10.715 4.226 -0.801 1.00 . B A . 101 MAN O5 1 1
9 4985 2 2 1 MAN O6 O -13.272 5.317 -0.798 1.00 . B A . 101 MAN O6 1 1
9 4986 3 2 1 MAN C1 C -7.280 1.233 -6.247 1.00 . C A . 102 MAN C1 1 1
9 4987 3 2 1 MAN C2 C -8.295 1.828 -5.287 1.00 . C A . 102 MAN C2 1 1
9 4988 3 2 1 MAN C3 C -9.025 0.716 -4.546 1.00 . C A . 102 MAN C3 1 1
9 4989 3 2 1 MAN C4 C -9.579 -0.324 -5.485 1.00 . C A . 102 MAN C4 1 1
9 4990 3 2 1 MAN C5 C -8.548 -0.781 -6.511 1.00 . C A . 102 MAN C5 1 1
9 4991 3 2 1 MAN C6 C -9.203 -1.678 -7.546 1.00 . C A . 102 MAN C6 1 1
9 4992 3 2 1 MAN H1 H -6.793 2.045 -6.837 1.00 . C A . 102 MAN H1 1 1
9 4993 3 2 1 MAN H2 H -7.711 2.448 -4.585 1.00 . C A . 102 MAN H2 1 1
9 4994 3 2 1 MAN H3 H -8.299 0.195 -3.920 1.00 . C A . 102 MAN H3 1 1
9 4995 3 2 1 MAN H4 H -10.418 0.152 -6.049 1.00 . C A . 102 MAN H4 1 1
9 4996 3 2 1 MAN H5 H -7.745 -1.370 -6.013 1.00 . C A . 102 MAN H5 1 1
9 4997 3 2 1 MAN H61 H -9.919 -1.069 -8.143 1.00 . C A . 102 MAN H61 1 1
9 4998 3 2 1 MAN H62 H -9.775 -2.482 -7.033 1.00 . C A . 102 MAN H62 1 1
9 4999 3 2 1 MAN HO2 H -9.896 2.937 -5.245 1.00 . C A . 102 MAN HO2 1 1
9 5000 3 2 1 MAN HO3 H -9.716 1.046 -2.725 1.00 . C A . 102 MAN HO3 1 1
9 5001 3 2 1 MAN HO4 H -11.005 -1.266 -4.541 1.00 . C A . 102 MAN HO4 1 1
9 5002 3 2 1 MAN HO6 H -8.594 -2.332 -9.312 1.00 . C A . 102 MAN HO6 1 1
9 5003 3 2 1 MAN O1 O -6.273 0.494 -5.526 1.00 . C A . 102 MAN O1 1 1
9 5004 3 2 1 MAN O2 O -9.201 2.739 -5.891 1.00 . C A . 102 MAN O2 1 1
9 5005 3 2 1 MAN O3 O -10.018 1.178 -3.627 1.00 . C A . 102 MAN O3 1 1
9 5006 3 2 1 MAN O4 O -10.083 -1.450 -4.762 1.00 . C A . 102 MAN O4 1 1
9 5007 3 2 1 MAN O5 O -7.948 0.354 -7.161 1.00 . C A . 102 MAN O5 1 1
9 5008 3 2 1 MAN O6 O -8.264 -2.322 -8.406 1.00 . C A . 102 MAN O6 1 1
9 5009 4 2 1 MAN C1 C 5.512 10.047 -1.978 1.00 . D A . 103 MAN C1 1 1
9 5010 4 2 1 MAN C2 C 6.865 9.389 -2.162 1.00 . D A . 103 MAN C2 1 1
9 5011 4 2 1 MAN C3 C 7.852 10.432 -2.619 1.00 . D A . 103 MAN C3 1 1
9 5012 4 2 1 MAN C4 C 7.356 11.059 -3.901 1.00 . D A . 103 MAN C4 1 1
9 5013 4 2 1 MAN C5 C 5.963 11.648 -3.699 1.00 . D A . 103 MAN C5 1 1
9 5014 4 2 1 MAN C6 C 5.380 12.183 -4.994 1.00 . D A . 103 MAN C6 1 1
9 5015 4 2 1 MAN H1 H 4.736 9.280 -1.789 1.00 . D A . 103 MAN H1 1 1
9 5016 4 2 1 MAN H2 H 7.258 9.004 -1.200 1.00 . D A . 103 MAN H2 1 1
9 5017 4 2 1 MAN H3 H 7.890 11.238 -1.844 1.00 . D A . 103 MAN H3 1 1
9 5018 4 2 1 MAN H4 H 7.284 10.263 -4.681 1.00 . D A . 103 MAN H4 1 1
9 5019 4 2 1 MAN H5 H 6.010 12.479 -2.958 1.00 . D A . 103 MAN H5 1 1
9 5020 4 2 1 MAN H61 H 5.253 11.333 -5.704 1.00 . D A . 103 MAN H61 1 1
9 5021 4 2 1 MAN H62 H 6.088 12.912 -5.447 1.00 . D A . 103 MAN H62 1 1
9 5022 4 2 1 MAN HO2 H 7.687 8.027 -3.303 1.00 . D A . 103 MAN HO2 1 1
9 5023 4 2 1 MAN HO3 H 9.484 9.565 -1.896 1.00 . D A . 103 MAN HO3 1 1
9 5024 4 2 1 MAN HO4 H 9.153 11.679 -4.195 1.00 . D A . 103 MAN HO4 1 1
9 5025 4 2 1 MAN HO6 H 3.631 12.869 -5.633 1.00 . D A . 103 MAN HO6 1 1
9 5026 4 2 1 MAN O1 O 5.525 11.016 -0.907 1.00 . D A . 103 MAN O1 1 1
9 5027 4 2 1 MAN O2 O 6.788 8.258 -3.033 1.00 . D A . 103 MAN O2 1 1
9 5028 4 2 1 MAN O3 O 9.171 9.888 -2.750 1.00 . D A . 103 MAN O3 1 1
9 5029 4 2 1 MAN O4 O 8.273 12.045 -4.357 1.00 . D A . 103 MAN O4 1 1
9 5030 4 2 1 MAN O5 O 5.078 10.628 -3.210 1.00 . D A . 103 MAN O5 1 1
9 5031 4 2 1 MAN O6 O 4.123 12.842 -4.807 1.00 . D A . 103 MAN O6 1 1
10 5032 1 1 1 THR C C -6.237 5.034 -0.198 1.00 . A A . 1 THR C 1 1
10 5033 1 1 1 THR CA C -7.081 5.370 0.989 1.00 . A A . 1 THR CA 1 1
10 5034 1 1 1 THR CB C -8.139 4.254 1.209 1.00 . A A . 1 THR CB 1 1
10 5035 1 1 1 THR CG2 C -8.423 4.191 2.699 1.00 . A A . 1 THR CG2 1 1
10 5036 1 1 1 THR H1 H -7.604 7.344 1.667 1.00 . A A . 1 THR H1 1 1
10 5037 1 1 1 THR H2 H -8.807 6.480 0.827 1.00 . A A . 1 THR H2 1 1
10 5038 1 1 1 THR H3 H -7.493 7.149 -0.036 1.00 . A A . 1 THR H3 1 1
10 5039 1 1 1 THR HA H -6.410 5.412 1.833 1.00 . A A . 1 THR HA 1 1
10 5040 1 1 1 THR HB H -7.820 3.257 0.850 1.00 . A A . 1 THR HB 1 1
10 5041 1 1 1 THR HG21 H -9.182 3.414 2.941 1.00 . A A . 1 THR HG21 1 1
10 5042 1 1 1 THR HG22 H -8.759 5.152 3.131 1.00 . A A . 1 THR HG22 1 1
10 5043 1 1 1 THR HG23 H -7.483 3.902 3.223 1.00 . A A . 1 THR HG23 1 1
10 5044 1 1 1 THR N N -7.783 6.708 0.869 1.00 . A A . 1 THR N 1 1
10 5045 1 1 1 THR O O -6.135 5.884 -1.065 1.00 . A A . 1 THR O 1 1
10 5046 1 1 2 GLN C C -5.945 2.146 -1.983 1.00 . A A . 2 GLN C 1 1
10 5047 1 1 2 GLN CA C -5.099 3.296 -1.520 1.00 . A A . 2 GLN CA 1 1
10 5048 1 1 2 GLN CB C -3.680 2.711 -1.378 1.00 . A A . 2 GLN CB 1 1
10 5049 1 1 2 GLN CD C -2.531 4.735 -2.162 1.00 . A A . 2 GLN CD 1 1
10 5050 1 1 2 GLN CG C -2.803 3.284 -2.500 1.00 . A A . 2 GLN CG 1 1
10 5051 1 1 2 GLN H H -5.719 3.115 0.428 1.00 . A A . 2 GLN H 1 1
10 5052 1 1 2 GLN HA H -5.131 4.056 -2.295 1.00 . A A . 2 GLN HA 1 1
10 5053 1 1 2 GLN HB2 H -3.283 2.955 -0.366 1.00 . A A . 2 GLN HB2 1 1
10 5054 1 1 2 GLN HB3 H -3.630 1.600 -1.443 1.00 . A A . 2 GLN HB3 1 1
10 5055 1 1 2 GLN HE21 H -1.363 4.123 -0.601 1.00 . A A . 2 GLN HE21 1 1
10 5056 1 1 2 GLN HE22 H -1.640 5.844 -0.714 1.00 . A A . 2 GLN HE22 1 1
10 5057 1 1 2 GLN HG2 H -1.858 2.733 -2.605 1.00 . A A . 2 GLN HG2 1 1
10 5058 1 1 2 GLN HG3 H -3.316 3.248 -3.483 1.00 . A A . 2 GLN HG3 1 1
10 5059 1 1 2 GLN N N -5.654 3.813 -0.280 1.00 . A A . 2 GLN N 1 1
10 5060 1 1 2 GLN NE2 N -1.782 4.918 -1.054 1.00 . A A . 2 GLN NE2 1 1
10 5061 1 1 2 GLN O O -6.598 1.499 -1.169 1.00 . A A . 2 GLN O 1 1
10 5062 1 1 2 GLN OE1 O -3.000 5.676 -2.789 1.00 . A A . 2 GLN OE1 1 1
10 5063 1 1 3 SER C C -6.225 -0.550 -3.526 1.00 . A A . 3 SER C 1 1
10 5064 1 1 3 SER CA C -6.743 0.816 -3.895 1.00 . A A . 3 SER CA 1 1
10 5065 1 1 3 SER CB C -6.752 0.897 -5.442 1.00 . A A . 3 SER CB 1 1
10 5066 1 1 3 SER H H -5.449 2.435 -3.948 1.00 . A A . 3 SER H 1 1
10 5067 1 1 3 SER HA H -7.751 0.900 -3.519 1.00 . A A . 3 SER HA 1 1
10 5068 1 1 3 SER HB2 H -6.033 0.182 -5.894 1.00 . A A . 3 SER HB2 1 1
10 5069 1 1 3 SER HB3 H -7.771 0.722 -5.849 1.00 . A A . 3 SER HB3 1 1
10 5070 1 1 3 SER N N -5.966 1.883 -3.295 1.00 . A A . 3 SER N 1 1
10 5071 1 1 3 SER O O -5.101 -0.702 -3.059 1.00 . A A . 3 SER O 1 1
10 5072 1 1 4 HIS C C -5.357 -3.230 -4.509 1.00 . A A . 4 HIS C 1 1
10 5073 1 1 4 HIS CA C -6.542 -2.974 -3.604 1.00 . A A . 4 HIS CA 1 1
10 5074 1 1 4 HIS CB C -7.629 -4.027 -3.940 1.00 . A A . 4 HIS CB 1 1
10 5075 1 1 4 HIS CD2 C -6.266 -5.925 -2.785 1.00 . A A . 4 HIS CD2 1 1
10 5076 1 1 4 HIS CE1 C -7.869 -7.389 -2.625 1.00 . A A . 4 HIS CE1 1 1
10 5077 1 1 4 HIS CG C -7.352 -5.398 -3.361 1.00 . A A . 4 HIS CG 1 1
10 5078 1 1 4 HIS H H -7.929 -1.482 -4.157 1.00 . A A . 4 HIS H 1 1
10 5079 1 1 4 HIS HA H -6.209 -3.085 -2.581 1.00 . A A . 4 HIS HA 1 1
10 5080 1 1 4 HIS HB2 H -8.585 -3.663 -3.509 1.00 . A A . 4 HIS HB2 1 1
10 5081 1 1 4 HIS HB3 H -7.766 -4.113 -5.041 1.00 . A A . 4 HIS HB3 1 1
10 5082 1 1 4 HIS HD1 H -9.310 -6.233 -3.511 1.00 . A A . 4 HIS HD1 1 1
10 5083 1 1 4 HIS HD2 H -5.288 -5.487 -2.578 1.00 . A A . 4 HIS HD2 1 1
10 5084 1 1 4 HIS HE1 H -8.413 -8.302 -2.377 1.00 . A A . 4 HIS HE1 1 1
10 5085 1 1 4 HIS HE2 H -6.103 -7.695 -1.648 1.00 . A A . 4 HIS HE2 1 1
10 5086 1 1 4 HIS N N -7.021 -1.609 -3.777 1.00 . A A . 4 HIS N 1 1
10 5087 1 1 4 HIS ND1 N -8.363 -6.342 -3.264 1.00 . A A . 4 HIS ND1 1 1
10 5088 1 1 4 HIS NE2 N -6.602 -7.181 -2.331 1.00 . A A . 4 HIS NE2 1 1
10 5089 1 1 4 HIS O O -5.405 -2.940 -5.700 1.00 . A A . 4 HIS O 1 1
10 5090 1 1 5 TYR C C -2.206 -2.793 -4.862 1.00 . A A . 5 TYR C 1 1
10 5091 1 1 5 TYR CA C -3.012 -4.040 -4.550 1.00 . A A . 5 TYR CA 1 1
10 5092 1 1 5 TYR CB C -3.107 -4.956 -5.795 1.00 . A A . 5 TYR CB 1 1
10 5093 1 1 5 TYR CD1 C -3.425 -7.253 -4.771 1.00 . A A . 5 TYR CD1 1 1
10 5094 1 1 5 TYR CD2 C -5.272 -6.215 -5.946 1.00 . A A . 5 TYR CD2 1 1
10 5095 1 1 5 TYR CE1 C -4.231 -8.368 -4.497 1.00 . A A . 5 TYR CE1 1 1
10 5096 1 1 5 TYR CE2 C -6.078 -7.324 -5.671 1.00 . A A . 5 TYR CE2 1 1
10 5097 1 1 5 TYR CG C -3.945 -6.163 -5.492 1.00 . A A . 5 TYR CG 1 1
10 5098 1 1 5 TYR CZ C -5.554 -8.400 -4.949 1.00 . A A . 5 TYR CZ 1 1
10 5099 1 1 5 TYR H H -4.265 -3.880 -2.918 1.00 . A A . 5 TYR H 1 1
10 5100 1 1 5 TYR HA H -2.458 -4.582 -3.806 1.00 . A A . 5 TYR HA 1 1
10 5101 1 1 5 TYR HB2 H -3.547 -4.403 -6.652 1.00 . A A . 5 TYR HB2 1 1
10 5102 1 1 5 TYR HB3 H -2.097 -5.306 -6.100 1.00 . A A . 5 TYR HB3 1 1
10 5103 1 1 5 TYR HD1 H -2.401 -7.236 -4.425 1.00 . A A . 5 TYR HD1 1 1
10 5104 1 1 5 TYR HD2 H -5.673 -5.375 -6.495 1.00 . A A . 5 TYR HD2 1 1
10 5105 1 1 5 TYR HE1 H -3.832 -9.196 -3.930 1.00 . A A . 5 TYR HE1 1 1
10 5106 1 1 5 TYR HE2 H -7.112 -7.326 -5.980 1.00 . A A . 5 TYR HE2 1 1
10 5107 1 1 5 TYR HH H -6.570 -9.962 -5.422 1.00 . A A . 5 TYR HH 1 1
10 5108 1 1 5 TYR N N -4.269 -3.726 -3.915 1.00 . A A . 5 TYR N 1 1
10 5109 1 1 5 TYR O O -1.174 -2.871 -5.513 1.00 . A A . 5 TYR O 1 1
10 5110 1 1 5 TYR OH O -6.392 -9.478 -4.611 1.00 . A A . 5 TYR OH 1 1
10 5111 1 1 6 GLY C C -0.900 -0.313 -3.304 1.00 . A A . 6 GLY C 1 1
10 5112 1 1 6 GLY CA C -1.875 -0.380 -4.436 1.00 . A A . 6 GLY CA 1 1
10 5113 1 1 6 GLY H H -3.499 -1.578 -3.857 1.00 . A A . 6 GLY H 1 1
10 5114 1 1 6 GLY HA2 H -1.322 -0.350 -5.366 1.00 . A A . 6 GLY HA2 1 1
10 5115 1 1 6 GLY HA3 H -2.563 0.442 -4.322 1.00 . A A . 6 GLY HA3 1 1
10 5116 1 1 6 GLY N N -2.637 -1.615 -4.363 1.00 . A A . 6 GLY N 1 1
10 5117 1 1 6 GLY O O -0.761 -1.250 -2.526 1.00 . A A . 6 GLY O 1 1
10 5118 1 1 7 GLN C C 0.318 1.648 -0.891 1.00 . A A . 7 GLN C 1 1
10 5119 1 1 7 GLN CA C 0.822 0.939 -2.138 1.00 . A A . 7 GLN CA 1 1
10 5120 1 1 7 GLN CB C 1.987 1.753 -2.734 1.00 . A A . 7 GLN CB 1 1
10 5121 1 1 7 GLN CD C 4.543 1.720 -2.603 1.00 . A A . 7 GLN CD 1 1
10 5122 1 1 7 GLN CG C 3.230 1.684 -1.831 1.00 . A A . 7 GLN CG 1 1
10 5123 1 1 7 GLN H H -0.357 1.616 -3.720 1.00 . A A . 7 GLN H 1 1
10 5124 1 1 7 GLN HA H 1.193 -0.037 -1.857 1.00 . A A . 7 GLN HA 1 1
10 5125 1 1 7 GLN HB2 H 2.208 1.320 -3.733 1.00 . A A . 7 GLN HB2 1 1
10 5126 1 1 7 GLN HB3 H 1.697 2.807 -2.922 1.00 . A A . 7 GLN HB3 1 1
10 5127 1 1 7 GLN HE21 H 5.455 1.039 -0.947 1.00 . A A . 7 GLN HE21 1 1
10 5128 1 1 7 GLN HE22 H 6.456 1.117 -2.405 1.00 . A A . 7 GLN HE22 1 1
10 5129 1 1 7 GLN HG2 H 3.219 2.494 -1.082 1.00 . A A . 7 GLN HG2 1 1
10 5130 1 1 7 GLN HG3 H 3.198 0.721 -1.282 1.00 . A A . 7 GLN HG3 1 1
10 5131 1 1 7 GLN N N -0.210 0.819 -3.141 1.00 . A A . 7 GLN N 1 1
10 5132 1 1 7 GLN NE2 N 5.613 1.295 -1.904 1.00 . A A . 7 GLN NE2 1 1
10 5133 1 1 7 GLN O O -0.217 2.742 -0.979 1.00 . A A . 7 GLN O 1 1
10 5134 1 1 7 GLN OE1 O 4.636 2.033 -3.790 1.00 . A A . 7 GLN OE1 1 1
10 5135 1 1 8 CYS C C 1.407 2.390 2.171 1.00 . A A . 8 CYS C 1 1
10 5136 1 1 8 CYS CA C 0.152 1.848 1.539 1.00 . A A . 8 CYS CA 1 1
10 5137 1 1 8 CYS CB C -0.667 0.983 2.554 1.00 . A A . 8 CYS CB 1 1
10 5138 1 1 8 CYS H H 0.884 0.186 0.411 1.00 . A A . 8 CYS H 1 1
10 5139 1 1 8 CYS HA H -0.440 2.719 1.308 1.00 . A A . 8 CYS HA 1 1
10 5140 1 1 8 CYS HB2 H -1.685 1.430 2.541 1.00 . A A . 8 CYS HB2 1 1
10 5141 1 1 8 CYS HB3 H -0.734 -0.044 2.134 1.00 . A A . 8 CYS HB3 1 1
10 5142 1 1 8 CYS N N 0.463 1.093 0.322 1.00 . A A . 8 CYS N 1 1
10 5143 1 1 8 CYS O O 1.383 3.341 2.945 1.00 . A A . 8 CYS O 1 1
10 5144 1 1 8 CYS SG S -0.142 0.892 4.314 1.00 . A A . 8 CYS SG 1 1
10 5145 1 1 9 GLY C C 4.889 1.613 1.621 1.00 . A A . 9 GLY C 1 1
10 5146 1 1 9 GLY CA C 3.796 2.091 2.503 1.00 . A A . 9 GLY CA 1 1
10 5147 1 1 9 GLY H H 2.563 1.091 1.126 1.00 . A A . 9 GLY H 1 1
10 5148 1 1 9 GLY HA2 H 3.909 3.156 2.658 1.00 . A A . 9 GLY HA2 1 1
10 5149 1 1 9 GLY HA3 H 3.825 1.510 3.416 1.00 . A A . 9 GLY HA3 1 1
10 5150 1 1 9 GLY N N 2.553 1.804 1.827 1.00 . A A . 9 GLY N 1 1
10 5151 1 1 9 GLY O O 4.693 0.810 0.713 1.00 . A A . 9 GLY O 1 1
10 5152 1 1 10 GLY C C 8.392 2.282 1.622 1.00 . A A . 10 GLY C 1 1
10 5153 1 1 10 GLY CA C 7.220 1.644 1.005 1.00 . A A . 10 GLY CA 1 1
10 5154 1 1 10 GLY H H 6.329 2.732 2.545 1.00 . A A . 10 GLY H 1 1
10 5155 1 1 10 GLY HA2 H 7.336 0.570 1.033 1.00 . A A . 10 GLY HA2 1 1
10 5156 1 1 10 GLY HA3 H 7.116 2.076 0.021 1.00 . A A . 10 GLY HA3 1 1
10 5157 1 1 10 GLY N N 6.111 2.059 1.830 1.00 . A A . 10 GLY N 1 1
10 5158 1 1 10 GLY O O 8.230 3.131 2.490 1.00 . A A . 10 GLY O 1 1
10 5159 1 1 11 ILE C C 10.834 4.092 1.291 1.00 . A A . 11 ILE C 1 1
10 5160 1 1 11 ILE CA C 10.822 2.597 1.604 1.00 . A A . 11 ILE CA 1 1
10 5161 1 1 11 ILE CB C 12.038 1.841 1.069 1.00 . A A . 11 ILE CB 1 1
10 5162 1 1 11 ILE CD1 C 13.447 1.002 3.076 1.00 . A A . 11 ILE CD1 1 1
10 5163 1 1 11 ILE CG1 C 12.371 0.671 2.034 1.00 . A A . 11 ILE CG1 1 1
10 5164 1 1 11 ILE CG2 C 13.253 2.761 0.800 1.00 . A A . 11 ILE CG2 1 1
10 5165 1 1 11 ILE H H 9.701 1.227 0.476 1.00 . A A . 11 ILE H 1 1
10 5166 1 1 11 ILE HA H 10.849 2.546 2.685 1.00 . A A . 11 ILE HA 1 1
10 5167 1 1 11 ILE HB H 11.749 1.395 0.088 1.00 . A A . 11 ILE HB 1 1
10 5168 1 1 11 ILE HD11 H 13.527 0.184 3.824 1.00 . A A . 11 ILE HD11 1 1
10 5169 1 1 11 ILE HD12 H 13.207 1.947 3.608 1.00 . A A . 11 ILE HD12 1 1
10 5170 1 1 11 ILE HD13 H 14.441 1.110 2.589 1.00 . A A . 11 ILE HD13 1 1
10 5171 1 1 11 ILE HG12 H 11.446 0.335 2.554 1.00 . A A . 11 ILE HG12 1 1
10 5172 1 1 11 ILE HG13 H 12.726 -0.204 1.450 1.00 . A A . 11 ILE HG13 1 1
10 5173 1 1 11 ILE HG21 H 14.143 2.158 0.526 1.00 . A A . 11 ILE HG21 1 1
10 5174 1 1 11 ILE HG22 H 13.501 3.357 1.705 1.00 . A A . 11 ILE HG22 1 1
10 5175 1 1 11 ILE HG23 H 13.050 3.466 -0.033 1.00 . A A . 11 ILE HG23 1 1
10 5176 1 1 11 ILE N N 9.598 1.939 1.163 1.00 . A A . 11 ILE N 1 1
10 5177 1 1 11 ILE O O 11.356 4.907 2.044 1.00 . A A . 11 ILE O 1 1
10 5178 1 1 12 GLY C C 8.691 6.183 -0.683 1.00 . A A . 12 GLY C 1 1
10 5179 1 1 12 GLY CA C 10.093 5.860 -0.277 1.00 . A A . 12 GLY CA 1 1
10 5180 1 1 12 GLY H H 9.781 3.781 -0.405 1.00 . A A . 12 GLY H 1 1
10 5181 1 1 12 GLY HA2 H 10.330 6.529 0.540 1.00 . A A . 12 GLY HA2 1 1
10 5182 1 1 12 GLY HA3 H 10.721 6.001 -1.142 1.00 . A A . 12 GLY HA3 1 1
10 5183 1 1 12 GLY N N 10.216 4.474 0.156 1.00 . A A . 12 GLY N 1 1
10 5184 1 1 12 GLY O O 8.457 6.827 -1.701 1.00 . A A . 12 GLY O 1 1
10 5185 1 1 13 TYR C C 5.723 7.016 0.677 1.00 . A A . 13 TYR C 1 1
10 5186 1 1 13 TYR CA C 6.308 5.959 -0.243 1.00 . A A . 13 TYR CA 1 1
10 5187 1 1 13 TYR CB C 5.446 4.683 -0.118 1.00 . A A . 13 TYR CB 1 1
10 5188 1 1 13 TYR CD1 C 4.021 5.218 -2.085 1.00 . A A . 13 TYR CD1 1 1
10 5189 1 1 13 TYR CD2 C 2.919 4.841 0.045 1.00 . A A . 13 TYR CD2 1 1
10 5190 1 1 13 TYR CE1 C 2.788 5.411 -2.698 1.00 . A A . 13 TYR CE1 1 1
10 5191 1 1 13 TYR CE2 C 1.677 4.989 -0.581 1.00 . A A . 13 TYR CE2 1 1
10 5192 1 1 13 TYR CG C 4.098 4.919 -0.717 1.00 . A A . 13 TYR CG 1 1
10 5193 1 1 13 TYR CZ C 1.623 5.258 -1.957 1.00 . A A . 13 TYR CZ 1 1
10 5194 1 1 13 TYR H H 7.895 5.236 0.938 1.00 . A A . 13 TYR H 1 1
10 5195 1 1 13 TYR HA H 6.240 6.342 -1.252 1.00 . A A . 13 TYR HA 1 1
10 5196 1 1 13 TYR HB2 H 5.912 3.848 -0.677 1.00 . A A . 13 TYR HB2 1 1
10 5197 1 1 13 TYR HB3 H 5.334 4.400 0.950 1.00 . A A . 13 TYR HB3 1 1
10 5198 1 1 13 TYR HD1 H 4.920 5.278 -2.683 1.00 . A A . 13 TYR HD1 1 1
10 5199 1 1 13 TYR HD2 H 2.966 4.638 1.106 1.00 . A A . 13 TYR HD2 1 1
10 5200 1 1 13 TYR HE1 H 2.722 5.618 -3.756 1.00 . A A . 13 TYR HE1 1 1
10 5201 1 1 13 TYR HE2 H 0.778 4.878 0.011 1.00 . A A . 13 TYR HE2 1 1
10 5202 1 1 13 TYR HH H -0.235 4.861 -2.159 1.00 . A A . 13 TYR HH 1 1
10 5203 1 1 13 TYR N N 7.694 5.694 0.074 1.00 . A A . 13 TYR N 1 1
10 5204 1 1 13 TYR O O 6.014 7.058 1.867 1.00 . A A . 13 TYR O 1 1
10 5205 1 1 13 TYR OH O 0.438 5.323 -2.682 1.00 . A A . 13 TYR OH 1 1
10 5206 1 1 14 SER C C 2.785 9.144 0.579 1.00 . A A . 14 SER C 1 1
10 5207 1 1 14 SER CA C 4.244 8.945 0.898 1.00 . A A . 14 SER CA 1 1
10 5208 1 1 14 SER CB C 4.917 10.288 0.570 1.00 . A A . 14 SER CB 1 1
10 5209 1 1 14 SER H H 4.636 7.817 -0.844 1.00 . A A . 14 SER H 1 1
10 5210 1 1 14 SER HA H 4.320 8.743 1.958 1.00 . A A . 14 SER HA 1 1
10 5211 1 1 14 SER HB2 H 4.612 10.640 -0.441 1.00 . A A . 14 SER HB2 1 1
10 5212 1 1 14 SER HB3 H 4.679 11.051 1.343 1.00 . A A . 14 SER HB3 1 1
10 5213 1 1 14 SER N N 4.832 7.861 0.129 1.00 . A A . 14 SER N 1 1
10 5214 1 1 14 SER O O 2.210 10.187 0.877 1.00 . A A . 14 SER O 1 1
10 5215 1 1 15 GLY C C -0.098 7.692 0.822 1.00 . A A . 15 GLY C 1 1
10 5216 1 1 15 GLY CA C 0.712 8.206 -0.348 1.00 . A A . 15 GLY CA 1 1
10 5217 1 1 15 GLY H H 2.616 7.300 -0.251 1.00 . A A . 15 GLY H 1 1
10 5218 1 1 15 GLY HA2 H 0.422 9.231 -0.540 1.00 . A A . 15 GLY HA2 1 1
10 5219 1 1 15 GLY HA3 H 0.532 7.564 -1.194 1.00 . A A . 15 GLY HA3 1 1
10 5220 1 1 15 GLY N N 2.142 8.158 -0.072 1.00 . A A . 15 GLY N 1 1
10 5221 1 1 15 GLY O O 0.450 7.378 1.875 1.00 . A A . 15 GLY O 1 1
10 5222 1 1 16 PRO C C -1.844 5.734 2.448 1.00 . A A . 16 PRO C 1 1
10 5223 1 1 16 PRO CA C -2.297 6.997 1.704 1.00 . A A . 16 PRO CA 1 1
10 5224 1 1 16 PRO CB C -3.615 6.760 0.960 1.00 . A A . 16 PRO CB 1 1
10 5225 1 1 16 PRO CD C -2.141 8.072 -0.483 1.00 . A A . 16 PRO CD 1 1
10 5226 1 1 16 PRO CG C -3.615 7.747 -0.220 1.00 . A A . 16 PRO CG 1 1
10 5227 1 1 16 PRO HA H -2.387 7.758 2.464 1.00 . A A . 16 PRO HA 1 1
10 5228 1 1 16 PRO HB2 H -3.632 5.726 0.544 1.00 . A A . 16 PRO HB2 1 1
10 5229 1 1 16 PRO HB3 H -4.488 6.895 1.623 1.00 . A A . 16 PRO HB3 1 1
10 5230 1 1 16 PRO HD2 H -1.788 7.553 -1.405 1.00 . A A . 16 PRO HD2 1 1
10 5231 1 1 16 PRO HD3 H -1.992 9.166 -0.615 1.00 . A A . 16 PRO HD3 1 1
10 5232 1 1 16 PRO HG2 H -4.067 7.294 -1.131 1.00 . A A . 16 PRO HG2 1 1
10 5233 1 1 16 PRO HG3 H -4.166 8.675 0.032 1.00 . A A . 16 PRO HG3 1 1
10 5234 1 1 16 PRO N N -1.413 7.576 0.690 1.00 . A A . 16 PRO N 1 1
10 5235 1 1 16 PRO O O -1.565 4.720 1.819 1.00 . A A . 16 PRO O 1 1
10 5236 1 1 17 THR C C -2.446 4.019 5.449 1.00 . A A . 17 THR C 1 1
10 5237 1 1 17 THR CA C -1.342 4.679 4.639 1.00 . A A . 17 THR CA 1 1
10 5238 1 1 17 THR CB C -0.243 5.229 5.550 1.00 . A A . 17 THR CB 1 1
10 5239 1 1 17 THR CG2 C -0.762 6.469 6.301 1.00 . A A . 17 THR CG2 1 1
10 5240 1 1 17 THR H H -2.136 6.573 4.274 1.00 . A A . 17 THR H 1 1
10 5241 1 1 17 THR HA H -0.904 3.895 4.035 1.00 . A A . 17 THR HA 1 1
10 5242 1 1 17 THR HB H 0.623 5.528 4.910 1.00 . A A . 17 THR HB 1 1
10 5243 1 1 17 THR HG1 H -0.533 3.874 6.895 1.00 . A A . 17 THR HG1 1 1
10 5244 1 1 17 THR HG21 H -1.839 6.385 6.550 1.00 . A A . 17 THR HG21 1 1
10 5245 1 1 17 THR HG22 H -0.595 7.380 5.689 1.00 . A A . 17 THR HG22 1 1
10 5246 1 1 17 THR HG23 H -0.206 6.599 7.255 1.00 . A A . 17 THR HG23 1 1
10 5247 1 1 17 THR N N -1.887 5.743 3.789 1.00 . A A . 17 THR N 1 1
10 5248 1 1 17 THR O O -2.240 3.414 6.493 1.00 . A A . 17 THR O 1 1
10 5249 1 1 17 THR OG1 O 0.250 4.302 6.509 1.00 . A A . 17 THR OG1 1 1
10 5250 1 1 18 VAL C C -5.222 2.258 5.035 1.00 . A A . 18 VAL C 1 1
10 5251 1 1 18 VAL CA C -4.831 3.555 5.694 1.00 . A A . 18 VAL CA 1 1
10 5252 1 1 18 VAL CB C -5.985 4.567 5.763 1.00 . A A . 18 VAL CB 1 1
10 5253 1 1 18 VAL CG1 C -7.369 3.947 6.060 1.00 . A A . 18 VAL CG1 1 1
10 5254 1 1 18 VAL CG2 C -5.648 5.553 6.897 1.00 . A A . 18 VAL CG2 1 1
10 5255 1 1 18 VAL H H -3.853 4.657 4.159 1.00 . A A . 18 VAL H 1 1
10 5256 1 1 18 VAL HA H -4.574 3.281 6.709 1.00 . A A . 18 VAL HA 1 1
10 5257 1 1 18 VAL HB H -6.040 5.117 4.798 1.00 . A A . 18 VAL HB 1 1
10 5258 1 1 18 VAL HG11 H -7.715 3.265 5.262 1.00 . A A . 18 VAL HG11 1 1
10 5259 1 1 18 VAL HG12 H -8.139 4.737 6.184 1.00 . A A . 18 VAL HG12 1 1
10 5260 1 1 18 VAL HG13 H -7.333 3.348 6.995 1.00 . A A . 18 VAL HG13 1 1
10 5261 1 1 18 VAL HG21 H -4.553 5.699 7.004 1.00 . A A . 18 VAL HG21 1 1
10 5262 1 1 18 VAL HG22 H -6.020 5.138 7.861 1.00 . A A . 18 VAL HG22 1 1
10 5263 1 1 18 VAL HG23 H -6.134 6.536 6.738 1.00 . A A . 18 VAL HG23 1 1
10 5264 1 1 18 VAL N N -3.699 4.147 4.990 1.00 . A A . 18 VAL N 1 1
10 5265 1 1 18 VAL O O -5.784 1.381 5.676 1.00 . A A . 18 VAL O 1 1
10 5266 1 1 19 CYS C C -6.956 1.171 2.726 1.00 . A A . 19 CYS C 1 1
10 5267 1 1 19 CYS CA C -5.452 1.066 2.867 1.00 . A A . 19 CYS CA 1 1
10 5268 1 1 19 CYS CB C -4.994 -0.355 3.257 1.00 . A A . 19 CYS CB 1 1
10 5269 1 1 19 CYS H H -4.182 2.682 3.351 1.00 . A A . 19 CYS H 1 1
10 5270 1 1 19 CYS HA H -5.102 1.283 1.875 1.00 . A A . 19 CYS HA 1 1
10 5271 1 1 19 CYS HB2 H -4.976 -0.458 4.363 1.00 . A A . 19 CYS HB2 1 1
10 5272 1 1 19 CYS HB3 H -5.670 -1.149 2.909 1.00 . A A . 19 CYS HB3 1 1
10 5273 1 1 19 CYS N N -4.882 2.096 3.729 1.00 . A A . 19 CYS N 1 1
10 5274 1 1 19 CYS O O -7.654 1.591 3.631 1.00 . A A . 19 CYS O 1 1
10 5275 1 1 19 CYS SG S -3.347 -0.697 2.628 1.00 . A A . 19 CYS SG 1 1
10 5276 1 1 20 ALA C C -9.711 0.121 2.503 1.00 . A A . 20 ALA C 1 1
10 5277 1 1 20 ALA CA C -8.990 0.818 1.380 1.00 . A A . 20 ALA CA 1 1
10 5278 1 1 20 ALA CB C -9.394 0.153 0.039 1.00 . A A . 20 ALA CB 1 1
10 5279 1 1 20 ALA H H -7.021 0.515 0.774 1.00 . A A . 20 ALA H 1 1
10 5280 1 1 20 ALA HA H -9.358 1.820 1.450 1.00 . A A . 20 ALA HA 1 1
10 5281 1 1 20 ALA HB1 H -9.160 -0.929 0.054 1.00 . A A . 20 ALA HB1 1 1
10 5282 1 1 20 ALA HB2 H -8.847 0.604 -0.812 1.00 . A A . 20 ALA HB2 1 1
10 5283 1 1 20 ALA HB3 H -10.482 0.259 -0.153 1.00 . A A . 20 ALA HB3 1 1
10 5284 1 1 20 ALA N N -7.541 0.900 1.539 1.00 . A A . 20 ALA N 1 1
10 5285 1 1 20 ALA O O -9.187 -0.832 3.046 1.00 . A A . 20 ALA O 1 1
10 5286 1 1 21 SER C C -12.053 -1.493 3.778 1.00 . A A . 21 SER C 1 1
10 5287 1 1 21 SER CA C -11.634 -0.041 4.007 1.00 . A A . 21 SER CA 1 1
10 5288 1 1 21 SER CB C -12.910 0.778 4.315 1.00 . A A . 21 SER CB 1 1
10 5289 1 1 21 SER H H -11.324 1.401 2.555 1.00 . A A . 21 SER H 1 1
10 5290 1 1 21 SER HA H -10.977 -0.020 4.869 1.00 . A A . 21 SER HA 1 1
10 5291 1 1 21 SER HB2 H -13.674 0.597 3.526 1.00 . A A . 21 SER HB2 1 1
10 5292 1 1 21 SER HB3 H -13.324 0.454 5.298 1.00 . A A . 21 SER HB3 1 1
10 5293 1 1 21 SER HG H -13.331 2.611 4.810 1.00 . A A . 21 SER HG 1 1
10 5294 1 1 21 SER N N -10.920 0.551 2.881 1.00 . A A . 21 SER N 1 1
10 5295 1 1 21 SER O O -12.585 -2.152 4.662 1.00 . A A . 21 SER O 1 1
10 5296 1 1 21 SER OG O -12.611 2.178 4.335 1.00 . A A . 21 SER OG 1 1
10 5297 1 1 22 GLY C C -10.581 -4.096 2.031 1.00 . A A . 22 GLY C 1 1
10 5298 1 1 22 GLY CA C -11.914 -3.401 2.157 1.00 . A A . 22 GLY CA 1 1
10 5299 1 1 22 GLY H H -11.393 -1.381 1.900 1.00 . A A . 22 GLY H 1 1
10 5300 1 1 22 GLY HA2 H -12.493 -3.951 2.884 1.00 . A A . 22 GLY HA2 1 1
10 5301 1 1 22 GLY HA3 H -12.344 -3.419 1.169 1.00 . A A . 22 GLY HA3 1 1
10 5302 1 1 22 GLY N N -11.810 -2.002 2.551 1.00 . A A . 22 GLY N 1 1
10 5303 1 1 22 GLY O O -10.537 -5.277 1.720 1.00 . A A . 22 GLY O 1 1
10 5304 1 1 23 THR C C -7.337 -3.562 3.376 1.00 . A A . 23 THR C 1 1
10 5305 1 1 23 THR CA C -8.101 -3.836 2.076 1.00 . A A . 23 THR CA 1 1
10 5306 1 1 23 THR CB C -7.309 -3.156 0.948 1.00 . A A . 23 THR CB 1 1
10 5307 1 1 23 THR CG2 C -7.947 -3.262 -0.442 1.00 . A A . 23 THR CG2 1 1
10 5308 1 1 23 THR H H -9.544 -2.426 2.568 1.00 . A A . 23 THR H 1 1
10 5309 1 1 23 THR HA H -8.124 -4.900 1.920 1.00 . A A . 23 THR HA 1 1
10 5310 1 1 23 THR HB H -6.298 -3.598 0.883 1.00 . A A . 23 THR HB 1 1
10 5311 1 1 23 THR HG1 H -7.499 -1.626 2.065 1.00 . A A . 23 THR HG1 1 1
10 5312 1 1 23 THR HG21 H -7.548 -2.460 -1.099 1.00 . A A . 23 THR HG21 1 1
10 5313 1 1 23 THR HG22 H -9.046 -3.149 -0.387 1.00 . A A . 23 THR HG22 1 1
10 5314 1 1 23 THR HG23 H -7.704 -4.248 -0.886 1.00 . A A . 23 THR HG23 1 1
10 5315 1 1 23 THR N N -9.473 -3.362 2.215 1.00 . A A . 23 THR N 1 1
10 5316 1 1 23 THR O O -7.800 -2.862 4.266 1.00 . A A . 23 THR O 1 1
10 5317 1 1 23 THR OG1 O -7.134 -1.776 1.172 1.00 . A A . 23 THR OG1 1 1
10 5318 1 1 24 THR C C -3.843 -3.698 4.389 1.00 . A A . 24 THR C 1 1
10 5319 1 1 24 THR CA C -5.302 -3.939 4.725 1.00 . A A . 24 THR CA 1 1
10 5320 1 1 24 THR CB C -5.443 -5.175 5.608 1.00 . A A . 24 THR CB 1 1
10 5321 1 1 24 THR CG2 C -4.355 -5.321 6.682 1.00 . A A . 24 THR CG2 1 1
10 5322 1 1 24 THR H H -5.873 -4.829 2.885 1.00 . A A . 24 THR H 1 1
10 5323 1 1 24 THR HA H -5.623 -3.070 5.285 1.00 . A A . 24 THR HA 1 1
10 5324 1 1 24 THR HB H -5.448 -6.088 4.961 1.00 . A A . 24 THR HB 1 1
10 5325 1 1 24 THR HG1 H -7.349 -4.944 5.643 1.00 . A A . 24 THR HG1 1 1
10 5326 1 1 24 THR HG21 H -3.373 -5.568 6.235 1.00 . A A . 24 THR HG21 1 1
10 5327 1 1 24 THR HG22 H -4.625 -6.145 7.377 1.00 . A A . 24 THR HG22 1 1
10 5328 1 1 24 THR HG23 H -4.264 -4.387 7.274 1.00 . A A . 24 THR HG23 1 1
10 5329 1 1 24 THR N N -6.111 -4.082 3.520 1.00 . A A . 24 THR N 1 1
10 5330 1 1 24 THR O O -3.321 -4.214 3.404 1.00 . A A . 24 THR O 1 1
10 5331 1 1 24 THR OG1 O -6.670 -5.097 6.314 1.00 . A A . 24 THR OG1 1 1
10 5332 1 1 25 CYS C C -0.843 -3.805 5.347 1.00 . A A . 25 CYS C 1 1
10 5333 1 1 25 CYS CA C -1.705 -2.601 5.008 1.00 . A A . 25 CYS CA 1 1
10 5334 1 1 25 CYS CB C -1.220 -1.437 5.916 1.00 . A A . 25 CYS CB 1 1
10 5335 1 1 25 CYS H H -3.557 -2.457 5.982 1.00 . A A . 25 CYS H 1 1
10 5336 1 1 25 CYS HA H -1.514 -2.362 3.971 1.00 . A A . 25 CYS HA 1 1
10 5337 1 1 25 CYS HB2 H -1.600 -1.620 6.945 1.00 . A A . 25 CYS HB2 1 1
10 5338 1 1 25 CYS HB3 H -0.109 -1.431 5.984 1.00 . A A . 25 CYS HB3 1 1
10 5339 1 1 25 CYS N N -3.131 -2.861 5.178 1.00 . A A . 25 CYS N 1 1
10 5340 1 1 25 CYS O O -0.773 -4.231 6.498 1.00 . A A . 25 CYS O 1 1
10 5341 1 1 25 CYS SG S -1.735 0.222 5.382 1.00 . A A . 25 CYS SG 1 1
10 5342 1 1 26 GLN C C 1.959 -5.336 3.689 1.00 . A A . 26 GLN C 1 1
10 5343 1 1 26 GLN CA C 0.761 -5.486 4.601 1.00 . A A . 26 GLN CA 1 1
10 5344 1 1 26 GLN CB C 0.102 -6.872 4.354 1.00 . A A . 26 GLN CB 1 1
10 5345 1 1 26 GLN CD C -1.858 -8.431 4.887 1.00 . A A . 26 GLN CD 1 1
10 5346 1 1 26 GLN CG C -1.287 -7.023 5.021 1.00 . A A . 26 GLN CG 1 1
10 5347 1 1 26 GLN H H -0.208 -4.037 3.414 1.00 . A A . 26 GLN H 1 1
10 5348 1 1 26 GLN HA H 1.130 -5.439 5.618 1.00 . A A . 26 GLN HA 1 1
10 5349 1 1 26 GLN HB2 H 0.009 -7.048 3.264 1.00 . A A . 26 GLN HB2 1 1
10 5350 1 1 26 GLN HB3 H 0.768 -7.670 4.752 1.00 . A A . 26 GLN HB3 1 1
10 5351 1 1 26 GLN HE21 H -2.077 -8.204 2.880 1.00 . A A . 26 GLN HE21 1 1
10 5352 1 1 26 GLN HE22 H -2.611 -9.728 3.557 1.00 . A A . 26 GLN HE22 1 1
10 5353 1 1 26 GLN HG2 H -1.202 -6.807 6.107 1.00 . A A . 26 GLN HG2 1 1
10 5354 1 1 26 GLN HG3 H -2.015 -6.307 4.585 1.00 . A A . 26 GLN HG3 1 1
10 5355 1 1 26 GLN N N -0.125 -4.365 4.360 1.00 . A A . 26 GLN N 1 1
10 5356 1 1 26 GLN NE2 N -2.170 -8.841 3.642 1.00 . A A . 26 GLN NE2 1 1
10 5357 1 1 26 GLN O O 2.094 -4.378 2.932 1.00 . A A . 26 GLN O 1 1
10 5358 1 1 26 GLN OE1 O -2.025 -9.162 5.863 1.00 . A A . 26 GLN OE1 1 1
10 5359 1 1 27 VAL C C 4.157 -7.188 1.891 1.00 . A A . 27 VAL C 1 1
10 5360 1 1 27 VAL CA C 4.154 -6.206 3.039 1.00 . A A . 27 VAL CA 1 1
10 5361 1 1 27 VAL CB C 5.322 -6.424 3.993 1.00 . A A . 27 VAL CB 1 1
10 5362 1 1 27 VAL CG1 C 6.625 -6.776 3.249 1.00 . A A . 27 VAL CG1 1 1
10 5363 1 1 27 VAL CG2 C 5.509 -5.135 4.819 1.00 . A A . 27 VAL CG2 1 1
10 5364 1 1 27 VAL H H 2.763 -7.103 4.301 1.00 . A A . 27 VAL H 1 1
10 5365 1 1 27 VAL HA H 4.286 -5.227 2.602 1.00 . A A . 27 VAL HA 1 1
10 5366 1 1 27 VAL HB H 5.069 -7.266 4.682 1.00 . A A . 27 VAL HB 1 1
10 5367 1 1 27 VAL HG11 H 6.610 -7.826 2.885 1.00 . A A . 27 VAL HG11 1 1
10 5368 1 1 27 VAL HG12 H 7.502 -6.651 3.918 1.00 . A A . 27 VAL HG12 1 1
10 5369 1 1 27 VAL HG13 H 6.757 -6.097 2.383 1.00 . A A . 27 VAL HG13 1 1
10 5370 1 1 27 VAL HG21 H 5.824 -5.383 5.855 1.00 . A A . 27 VAL HG21 1 1
10 5371 1 1 27 VAL HG22 H 4.574 -4.538 4.875 1.00 . A A . 27 VAL HG22 1 1
10 5372 1 1 27 VAL HG23 H 6.291 -4.493 4.360 1.00 . A A . 27 VAL HG23 1 1
10 5373 1 1 27 VAL N N 2.898 -6.283 3.754 1.00 . A A . 27 VAL N 1 1
10 5374 1 1 27 VAL O O 3.826 -8.358 2.051 1.00 . A A . 27 VAL O 1 1
10 5375 1 1 28 LEU C C 6.299 -7.712 -0.636 1.00 . A A . 28 LEU C 1 1
10 5376 1 1 28 LEU CA C 4.793 -7.577 -0.445 1.00 . A A . 28 LEU CA 1 1
10 5377 1 1 28 LEU CB C 4.040 -7.026 -1.696 1.00 . A A . 28 LEU CB 1 1
10 5378 1 1 28 LEU CD1 C 4.904 -8.843 -3.316 1.00 . A A . 28 LEU CD1 1 1
10 5379 1 1 28 LEU CD2 C 3.695 -6.840 -4.225 1.00 . A A . 28 LEU CD2 1 1
10 5380 1 1 28 LEU CG C 4.617 -7.348 -3.101 1.00 . A A . 28 LEU CG 1 1
10 5381 1 1 28 LEU H H 4.740 -5.745 0.566 1.00 . A A . 28 LEU H 1 1
10 5382 1 1 28 LEU HA H 4.434 -8.580 -0.255 1.00 . A A . 28 LEU HA 1 1
10 5383 1 1 28 LEU HB2 H 2.998 -7.414 -1.647 1.00 . A A . 28 LEU HB2 1 1
10 5384 1 1 28 LEU HB3 H 3.966 -5.925 -1.582 1.00 . A A . 28 LEU HB3 1 1
10 5385 1 1 28 LEU HD11 H 4.280 -9.275 -4.122 1.00 . A A . 28 LEU HD11 1 1
10 5386 1 1 28 LEU HD12 H 4.704 -9.422 -2.391 1.00 . A A . 28 LEU HD12 1 1
10 5387 1 1 28 LEU HD13 H 5.973 -8.986 -3.584 1.00 . A A . 28 LEU HD13 1 1
10 5388 1 1 28 LEU HD21 H 3.596 -7.581 -5.043 1.00 . A A . 28 LEU HD21 1 1
10 5389 1 1 28 LEU HD22 H 4.096 -5.914 -4.683 1.00 . A A . 28 LEU HD22 1 1
10 5390 1 1 28 LEU HD23 H 2.676 -6.637 -3.830 1.00 . A A . 28 LEU HD23 1 1
10 5391 1 1 28 LEU HG H 5.589 -6.803 -3.195 1.00 . A A . 28 LEU HG 1 1
10 5392 1 1 28 LEU N N 4.531 -6.713 0.689 1.00 . A A . 28 LEU N 1 1
10 5393 1 1 28 LEU O O 6.818 -8.763 -1.002 1.00 . A A . 28 LEU O 1 1
10 5394 1 1 29 ASN C C 9.100 -5.688 0.489 1.00 . A A . 29 ASN C 1 1
10 5395 1 1 29 ASN CA C 8.521 -6.745 -0.466 1.00 . A A . 29 ASN CA 1 1
10 5396 1 1 29 ASN CB C 8.917 -6.670 -1.994 1.00 . A A . 29 ASN CB 1 1
10 5397 1 1 29 ASN CG C 9.002 -5.277 -2.604 1.00 . A A . 29 ASN CG 1 1
10 5398 1 1 29 ASN H H 6.714 -5.807 0.030 1.00 . A A . 29 ASN H 1 1
10 5399 1 1 29 ASN HA H 8.826 -7.707 -0.071 1.00 . A A . 29 ASN HA 1 1
10 5400 1 1 29 ASN HB2 H 9.915 -7.131 -2.125 1.00 . A A . 29 ASN HB2 1 1
10 5401 1 1 29 ASN HB3 H 8.200 -7.287 -2.573 1.00 . A A . 29 ASN HB3 1 1
10 5402 1 1 29 ASN HD21 H 8.266 -5.866 -4.421 1.00 . A A . 29 ASN HD21 1 1
10 5403 1 1 29 ASN HD22 H 8.556 -4.156 -4.196 1.00 . A A . 29 ASN HD22 1 1
10 5404 1 1 29 ASN N N 7.084 -6.665 -0.329 1.00 . A A . 29 ASN N 1 1
10 5405 1 1 29 ASN ND2 N 8.579 -5.095 -3.870 1.00 . A A . 29 ASN ND2 1 1
10 5406 1 1 29 ASN O O 8.333 -4.872 1.004 1.00 . A A . 29 ASN O 1 1
10 5407 1 1 29 ASN OD1 O 9.439 -4.321 -1.971 1.00 . A A . 29 ASN OD1 1 1
10 5408 1 1 30 PRO C C 10.960 -3.239 1.321 1.00 . A A . 30 PRO C 1 1
10 5409 1 1 30 PRO CA C 10.947 -4.702 1.776 1.00 . A A . 30 PRO CA 1 1
10 5410 1 1 30 PRO CB C 12.389 -5.223 2.018 1.00 . A A . 30 PRO CB 1 1
10 5411 1 1 30 PRO CD C 11.411 -6.467 0.146 1.00 . A A . 30 PRO CD 1 1
10 5412 1 1 30 PRO CG C 12.681 -6.328 0.982 1.00 . A A . 30 PRO CG 1 1
10 5413 1 1 30 PRO HA H 10.340 -4.740 2.669 1.00 . A A . 30 PRO HA 1 1
10 5414 1 1 30 PRO HB2 H 13.154 -4.420 1.948 1.00 . A A . 30 PRO HB2 1 1
10 5415 1 1 30 PRO HB3 H 12.454 -5.652 3.041 1.00 . A A . 30 PRO HB3 1 1
10 5416 1 1 30 PRO HD2 H 11.588 -6.087 -0.885 1.00 . A A . 30 PRO HD2 1 1
10 5417 1 1 30 PRO HD3 H 11.085 -7.532 0.107 1.00 . A A . 30 PRO HD3 1 1
10 5418 1 1 30 PRO HG2 H 13.542 -6.060 0.334 1.00 . A A . 30 PRO HG2 1 1
10 5419 1 1 30 PRO HG3 H 12.911 -7.287 1.497 1.00 . A A . 30 PRO HG3 1 1
10 5420 1 1 30 PRO N N 10.399 -5.625 0.779 1.00 . A A . 30 PRO N 1 1
10 5421 1 1 30 PRO O O 11.431 -2.386 2.058 1.00 . A A . 30 PRO O 1 1
10 5422 1 1 31 TYR C C 9.055 -1.309 -1.037 1.00 . A A . 31 TYR C 1 1
10 5423 1 1 31 TYR CA C 10.458 -1.627 -0.514 1.00 . A A . 31 TYR CA 1 1
10 5424 1 1 31 TYR CB C 11.516 -1.582 -1.667 1.00 . A A . 31 TYR CB 1 1
10 5425 1 1 31 TYR CD1 C 13.442 -2.965 -0.730 1.00 . A A . 31 TYR CD1 1 1
10 5426 1 1 31 TYR CD2 C 13.729 -0.577 -0.941 1.00 . A A . 31 TYR CD2 1 1
10 5427 1 1 31 TYR CE1 C 14.667 -3.057 -0.051 1.00 . A A . 31 TYR CE1 1 1
10 5428 1 1 31 TYR CE2 C 14.967 -0.669 -0.287 1.00 . A A . 31 TYR CE2 1 1
10 5429 1 1 31 TYR CG C 12.920 -1.714 -1.111 1.00 . A A . 31 TYR CG 1 1
10 5430 1 1 31 TYR CZ C 15.415 -1.901 0.188 1.00 . A A . 31 TYR CZ 1 1
10 5431 1 1 31 TYR H H 10.067 -3.658 -0.457 1.00 . A A . 31 TYR H 1 1
10 5432 1 1 31 TYR HA H 10.684 -0.869 0.223 1.00 . A A . 31 TYR HA 1 1
10 5433 1 1 31 TYR HB2 H 11.345 -2.417 -2.379 1.00 . A A . 31 TYR HB2 1 1
10 5434 1 1 31 TYR HB3 H 11.451 -0.624 -2.226 1.00 . A A . 31 TYR HB3 1 1
10 5435 1 1 31 TYR HD1 H 12.850 -3.853 -0.886 1.00 . A A . 31 TYR HD1 1 1
10 5436 1 1 31 TYR HD2 H 13.369 0.391 -1.253 1.00 . A A . 31 TYR HD2 1 1
10 5437 1 1 31 TYR HE1 H 15.023 -4.014 0.299 1.00 . A A . 31 TYR HE1 1 1
10 5438 1 1 31 TYR HE2 H 15.556 0.217 -0.102 1.00 . A A . 31 TYR HE2 1 1
10 5439 1 1 31 TYR HH H 16.422 -2.463 1.731 1.00 . A A . 31 TYR HH 1 1
10 5440 1 1 31 TYR N N 10.449 -2.929 0.117 1.00 . A A . 31 TYR N 1 1
10 5441 1 1 31 TYR O O 8.834 -0.342 -1.764 1.00 . A A . 31 TYR O 1 1
10 5442 1 1 31 TYR OH O 16.603 -1.950 0.941 1.00 . A A . 31 TYR OH 1 1
10 5443 1 1 32 TYR C C 5.730 -2.725 -0.248 1.00 . A A . 32 TYR C 1 1
10 5444 1 1 32 TYR CA C 6.712 -2.046 -1.197 1.00 . A A . 32 TYR CA 1 1
10 5445 1 1 32 TYR CB C 6.645 -2.697 -2.608 1.00 . A A . 32 TYR CB 1 1
10 5446 1 1 32 TYR CD1 C 4.903 -1.317 -3.819 1.00 . A A . 32 TYR CD1 1 1
10 5447 1 1 32 TYR CD2 C 4.432 -3.628 -3.330 1.00 . A A . 32 TYR CD2 1 1
10 5448 1 1 32 TYR CE1 C 3.617 -1.165 -4.358 1.00 . A A . 32 TYR CE1 1 1
10 5449 1 1 32 TYR CE2 C 3.168 -3.495 -3.909 1.00 . A A . 32 TYR CE2 1 1
10 5450 1 1 32 TYR CG C 5.300 -2.536 -3.255 1.00 . A A . 32 TYR CG 1 1
10 5451 1 1 32 TYR CZ C 2.750 -2.257 -4.385 1.00 . A A . 32 TYR CZ 1 1
10 5452 1 1 32 TYR H H 8.231 -2.858 -0.002 1.00 . A A . 32 TYR H 1 1
10 5453 1 1 32 TYR HA H 6.422 -1.012 -1.276 1.00 . A A . 32 TYR HA 1 1
10 5454 1 1 32 TYR HB2 H 7.408 -2.260 -3.285 1.00 . A A . 32 TYR HB2 1 1
10 5455 1 1 32 TYR HB3 H 6.842 -3.782 -2.499 1.00 . A A . 32 TYR HB3 1 1
10 5456 1 1 32 TYR HD1 H 5.592 -0.490 -3.833 1.00 . A A . 32 TYR HD1 1 1
10 5457 1 1 32 TYR HD2 H 4.756 -4.575 -2.940 1.00 . A A . 32 TYR HD2 1 1
10 5458 1 1 32 TYR HE1 H 3.311 -0.212 -4.759 1.00 . A A . 32 TYR HE1 1 1
10 5459 1 1 32 TYR HE2 H 2.499 -4.339 -3.968 1.00 . A A . 32 TYR HE2 1 1
10 5460 1 1 32 TYR HH H 1.283 -1.222 -5.089 1.00 . A A . 32 TYR HH 1 1
10 5461 1 1 32 TYR N N 8.043 -2.104 -0.633 1.00 . A A . 32 TYR N 1 1
10 5462 1 1 32 TYR O O 5.660 -3.948 -0.116 1.00 . A A . 32 TYR O 1 1
10 5463 1 1 32 TYR OH O 1.450 -2.140 -4.879 1.00 . A A . 32 TYR OH 1 1
10 5464 1 1 33 SER C C 2.604 -2.094 0.621 1.00 . A A . 33 SER C 1 1
10 5465 1 1 33 SER CA C 3.888 -2.355 1.345 1.00 . A A . 33 SER CA 1 1
10 5466 1 1 33 SER CB C 3.808 -1.568 2.677 1.00 . A A . 33 SER CB 1 1
10 5467 1 1 33 SER H H 4.947 -0.912 0.299 1.00 . A A . 33 SER H 1 1
10 5468 1 1 33 SER HA H 3.990 -3.409 1.544 1.00 . A A . 33 SER HA 1 1
10 5469 1 1 33 SER HB2 H 3.304 -0.590 2.552 1.00 . A A . 33 SER HB2 1 1
10 5470 1 1 33 SER HB3 H 3.209 -2.143 3.418 1.00 . A A . 33 SER HB3 1 1
10 5471 1 1 33 SER HG H 5.583 -0.802 2.550 1.00 . A A . 33 SER HG 1 1
10 5472 1 1 33 SER N N 4.923 -1.903 0.435 1.00 . A A . 33 SER N 1 1
10 5473 1 1 33 SER O O 2.312 -0.971 0.222 1.00 . A A . 33 SER O 1 1
10 5474 1 1 33 SER OG O 5.111 -1.330 3.201 1.00 . A A . 33 SER OG 1 1
10 5475 1 1 34 GLN C C -0.630 -3.129 0.374 1.00 . A A . 34 GLN C 1 1
10 5476 1 1 34 GLN CA C 0.647 -3.060 -0.439 1.00 . A A . 34 GLN CA 1 1
10 5477 1 1 34 GLN CB C 0.790 -4.065 -1.615 1.00 . A A . 34 GLN CB 1 1
10 5478 1 1 34 GLN CD C -0.105 -5.925 -3.105 1.00 . A A . 34 GLN CD 1 1
10 5479 1 1 34 GLN CG C -0.394 -4.992 -1.930 1.00 . A A . 34 GLN CG 1 1
10 5480 1 1 34 GLN H H 1.953 -3.988 0.899 1.00 . A A . 34 GLN H 1 1
10 5481 1 1 34 GLN HA H 0.614 -2.085 -0.895 1.00 . A A . 34 GLN HA 1 1
10 5482 1 1 34 GLN HB2 H 0.990 -3.445 -2.516 1.00 . A A . 34 GLN HB2 1 1
10 5483 1 1 34 GLN HB3 H 1.691 -4.695 -1.431 1.00 . A A . 34 GLN HB3 1 1
10 5484 1 1 34 GLN HE21 H -0.048 -4.381 -4.467 1.00 . A A . 34 GLN HE21 1 1
10 5485 1 1 34 GLN HE22 H 0.146 -5.999 -5.090 1.00 . A A . 34 GLN HE22 1 1
10 5486 1 1 34 GLN HG2 H -0.578 -5.634 -1.049 1.00 . A A . 34 GLN HG2 1 1
10 5487 1 1 34 GLN HG3 H -1.309 -4.413 -2.147 1.00 . A A . 34 GLN HG3 1 1
10 5488 1 1 34 GLN N N 1.805 -3.132 0.407 1.00 . A A . 34 GLN N 1 1
10 5489 1 1 34 GLN NE2 N 0.002 -5.374 -4.331 1.00 . A A . 34 GLN NE2 1 1
10 5490 1 1 34 GLN O O -0.627 -3.451 1.558 1.00 . A A . 34 GLN O 1 1
10 5491 1 1 34 GLN OE1 O -0.002 -7.140 -2.951 1.00 . A A . 34 GLN OE1 1 1
10 5492 1 1 35 CYS C C -3.840 -4.070 -0.111 1.00 . A A . 35 CYS C 1 1
10 5493 1 1 35 CYS CA C -3.080 -2.839 0.324 1.00 . A A . 35 CYS CA 1 1
10 5494 1 1 35 CYS CB C -3.904 -1.615 -0.114 1.00 . A A . 35 CYS CB 1 1
10 5495 1 1 35 CYS H H -1.670 -2.369 -1.175 1.00 . A A . 35 CYS H 1 1
10 5496 1 1 35 CYS HA H -3.000 -2.910 1.396 1.00 . A A . 35 CYS HA 1 1
10 5497 1 1 35 CYS HB2 H -3.823 -1.505 -1.213 1.00 . A A . 35 CYS HB2 1 1
10 5498 1 1 35 CYS HB3 H -4.971 -1.740 0.139 1.00 . A A . 35 CYS HB3 1 1
10 5499 1 1 35 CYS N N -1.754 -2.750 -0.253 1.00 . A A . 35 CYS N 1 1
10 5500 1 1 35 CYS O O -4.143 -4.240 -1.290 1.00 . A A . 35 CYS O 1 1
10 5501 1 1 35 CYS SG S -3.311 -0.124 0.689 1.00 . A A . 35 CYS SG 1 1
10 5502 1 1 36 LEU C C -6.205 -6.366 1.068 1.00 . A A . 36 LEU C 1 1
10 5503 1 1 36 LEU CA C -4.769 -6.246 0.555 1.00 . A A . 36 LEU CA 1 1
10 5504 1 1 36 LEU CB C -3.963 -7.392 1.202 1.00 . A A . 36 LEU CB 1 1
10 5505 1 1 36 LEU CD1 C -2.554 -7.472 -0.882 1.00 . A A . 36 LEU CD1 1 1
10 5506 1 1 36 LEU CD2 C -1.581 -6.512 1.257 1.00 . A A . 36 LEU CD2 1 1
10 5507 1 1 36 LEU CG C -2.539 -7.543 0.649 1.00 . A A . 36 LEU CG 1 1
10 5508 1 1 36 LEU H H -3.929 -4.805 1.798 1.00 . A A . 36 LEU H 1 1
10 5509 1 1 36 LEU HA H -4.836 -6.392 -0.507 1.00 . A A . 36 LEU HA 1 1
10 5510 1 1 36 LEU HB2 H -3.936 -7.230 2.303 1.00 . A A . 36 LEU HB2 1 1
10 5511 1 1 36 LEU HB3 H -4.510 -8.346 1.026 1.00 . A A . 36 LEU HB3 1 1
10 5512 1 1 36 LEU HD11 H -2.721 -6.426 -1.218 1.00 . A A . 36 LEU HD11 1 1
10 5513 1 1 36 LEU HD12 H -3.365 -8.102 -1.298 1.00 . A A . 36 LEU HD12 1 1
10 5514 1 1 36 LEU HD13 H -1.585 -7.819 -1.289 1.00 . A A . 36 LEU HD13 1 1
10 5515 1 1 36 LEU HD21 H -0.520 -6.798 1.113 1.00 . A A . 36 LEU HD21 1 1
10 5516 1 1 36 LEU HD22 H -1.793 -6.356 2.334 1.00 . A A . 36 LEU HD22 1 1
10 5517 1 1 36 LEU HD23 H -1.726 -5.529 0.778 1.00 . A A . 36 LEU HD23 1 1
10 5518 1 1 36 LEU HG H -2.174 -8.557 0.938 1.00 . A A . 36 LEU HG 1 1
10 5519 1 1 36 LEU N N -4.178 -4.956 0.835 1.00 . A A . 36 LEU N 1 1
10 5520 1 1 36 LEU O O -6.380 -6.460 2.305 1.00 . A A . 36 LEU O 1 1
10 5521 1 1 36 LEU OXT O -7.137 -6.370 0.223 1.00 . A A . 36 LEU OXT 1 1
10 5522 2 2 1 MAN C1 C -9.812 3.703 -0.526 1.00 . B A . 101 MAN C1 1 1
10 5523 2 2 1 MAN C2 C -8.965 3.807 -1.767 1.00 . B A . 101 MAN C2 1 1
10 5524 2 2 1 MAN C3 C -9.005 5.218 -2.261 1.00 . B A . 101 MAN C3 1 1
10 5525 2 2 1 MAN C4 C -10.429 5.627 -2.542 1.00 . B A . 101 MAN C4 1 1
10 5526 2 2 1 MAN C5 C -11.345 5.306 -1.357 1.00 . B A . 101 MAN C5 1 1
10 5527 2 2 1 MAN C6 C -12.808 5.450 -1.708 1.00 . B A . 101 MAN C6 1 1
10 5528 2 2 1 MAN H1 H -9.818 2.655 -0.210 1.00 . B A . 101 MAN H1 1 1
10 5529 2 2 1 MAN H2 H -7.938 3.570 -1.478 1.00 . B A . 101 MAN H2 1 1
10 5530 2 2 1 MAN H3 H -8.628 5.892 -1.467 1.00 . B A . 101 MAN H3 1 1
10 5531 2 2 1 MAN H4 H -10.786 5.042 -3.425 1.00 . B A . 101 MAN H4 1 1
10 5532 2 2 1 MAN H5 H -11.116 5.997 -0.513 1.00 . B A . 101 MAN H5 1 1
10 5533 2 2 1 MAN H61 H -13.082 4.667 -2.454 1.00 . B A . 101 MAN H61 1 1
10 5534 2 2 1 MAN H62 H -12.995 6.446 -2.165 1.00 . B A . 101 MAN H62 1 1
10 5535 2 2 1 MAN HO2 H -8.898 3.233 -3.609 1.00 . B A . 101 MAN HO2 1 1
10 5536 2 2 1 MAN HO3 H -8.257 6.253 -3.768 1.00 . B A . 101 MAN HO3 1 1
10 5537 2 2 1 MAN HO4 H -10.976 7.511 -2.193 1.00 . B A . 101 MAN HO4 1 1
10 5538 2 2 1 MAN HO6 H -14.522 5.036 -0.796 1.00 . B A . 101 MAN HO6 1 1
10 5539 2 2 1 MAN O1 O -9.358 4.596 0.534 1.00 . B A . 101 MAN O1 1 1
10 5540 2 2 1 MAN O2 O -9.296 2.876 -2.796 1.00 . B A . 101 MAN O2 1 1
10 5541 2 2 1 MAN O3 O -8.139 5.375 -3.385 1.00 . B A . 101 MAN O3 1 1
10 5542 2 2 1 MAN O4 O -10.476 7.015 -2.851 1.00 . B A . 101 MAN O4 1 1
10 5543 2 2 1 MAN O5 O -11.160 3.971 -0.877 1.00 . B A . 101 MAN O5 1 1
10 5544 2 2 1 MAN O6 O -13.638 5.334 -0.550 1.00 . B A . 101 MAN O6 1 1
10 5545 3 2 1 MAN C1 C -6.163 2.453 -7.225 1.00 . C A . 102 MAN C1 1 1
10 5546 3 2 1 MAN C2 C -5.027 1.628 -7.822 1.00 . C A . 102 MAN C2 1 1
10 5547 3 2 1 MAN C3 C -3.776 1.913 -7.025 1.00 . C A . 102 MAN C3 1 1
10 5548 3 2 1 MAN C4 C -3.450 3.389 -7.090 1.00 . C A . 102 MAN C4 1 1
10 5549 3 2 1 MAN C5 C -4.650 4.231 -6.659 1.00 . C A . 102 MAN C5 1 1
10 5550 3 2 1 MAN C6 C -4.450 5.711 -6.909 1.00 . C A . 102 MAN C6 1 1
10 5551 3 2 1 MAN H1 H -7.111 2.251 -7.774 1.00 . C A . 102 MAN H1 1 1
10 5552 3 2 1 MAN H2 H -5.277 0.548 -7.737 1.00 . C A . 102 MAN H2 1 1
10 5553 3 2 1 MAN H3 H -3.978 1.664 -5.956 1.00 . C A . 102 MAN H3 1 1
10 5554 3 2 1 MAN H4 H -3.215 3.662 -8.149 1.00 . C A . 102 MAN H4 1 1
10 5555 3 2 1 MAN H5 H -4.798 4.096 -5.562 1.00 . C A . 102 MAN H5 1 1
10 5556 3 2 1 MAN H61 H -4.340 5.898 -8.003 1.00 . C A . 102 MAN H61 1 1
10 5557 3 2 1 MAN H62 H -3.523 6.068 -6.406 1.00 . C A . 102 MAN H62 1 1
10 5558 3 2 1 MAN HO2 H -4.514 1.080 -9.661 1.00 . C A . 102 MAN HO2 1 1
10 5559 3 2 1 MAN HO3 H -2.411 1.340 -8.318 1.00 . C A . 102 MAN HO3 1 1
10 5560 3 2 1 MAN HO4 H -1.575 3.157 -6.605 1.00 . C A . 102 MAN HO4 1 1
10 5561 3 2 1 MAN HO6 H -6.357 6.068 -6.799 1.00 . C A . 102 MAN HO6 1 1
10 5562 3 2 1 MAN O1 O -6.348 2.211 -5.816 1.00 . C A . 102 MAN O1 1 1
10 5563 3 2 1 MAN O2 O -4.830 1.876 -9.218 1.00 . C A . 102 MAN O2 1 1
10 5564 3 2 1 MAN O3 O -2.676 1.093 -7.424 1.00 . C A . 102 MAN O3 1 1
10 5565 3 2 1 MAN O4 O -2.316 3.678 -6.277 1.00 . C A . 102 MAN O4 1 1
10 5566 3 2 1 MAN O5 O -5.859 3.847 -7.355 1.00 . C A . 102 MAN O5 1 1
10 5567 3 2 1 MAN O6 O -5.563 6.456 -6.412 1.00 . C A . 102 MAN O6 1 1
10 5568 4 2 1 MAN C1 C 7.112 11.292 0.600 1.00 . D A . 103 MAN C1 1 1
10 5569 4 2 1 MAN C2 C 6.756 12.250 -0.521 1.00 . D A . 103 MAN C2 1 1
10 5570 4 2 1 MAN C3 C 7.046 11.559 -1.839 1.00 . D A . 103 MAN C3 1 1
10 5571 4 2 1 MAN C4 C 8.513 11.160 -1.899 1.00 . D A . 103 MAN C4 1 1
10 5572 4 2 1 MAN C5 C 8.877 10.302 -0.687 1.00 . D A . 103 MAN C5 1 1
10 5573 4 2 1 MAN C6 C 10.360 9.963 -0.659 1.00 . D A . 103 MAN C6 1 1
10 5574 4 2 1 MAN H1 H 6.917 11.772 1.585 1.00 . D A . 103 MAN H1 1 1
10 5575 4 2 1 MAN H2 H 5.672 12.497 -0.480 1.00 . D A . 103 MAN H2 1 1
10 5576 4 2 1 MAN H3 H 6.450 10.617 -1.889 1.00 . D A . 103 MAN H3 1 1
10 5577 4 2 1 MAN H4 H 9.129 12.089 -1.843 1.00 . D A . 103 MAN H4 1 1
10 5578 4 2 1 MAN H5 H 8.312 9.340 -0.738 1.00 . D A . 103 MAN H5 1 1
10 5579 4 2 1 MAN H61 H 10.943 10.906 -0.552 1.00 . D A . 103 MAN H61 1 1
10 5580 4 2 1 MAN H62 H 10.652 9.484 -1.621 1.00 . D A . 103 MAN H62 1 1
10 5581 4 2 1 MAN HO2 H 7.957 13.514 0.408 1.00 . D A . 103 MAN HO2 1 1
10 5582 4 2 1 MAN HO3 H 6.995 13.243 -2.799 1.00 . D A . 103 MAN HO3 1 1
10 5583 4 2 1 MAN HO4 H 8.115 9.992 -3.435 1.00 . D A . 103 MAN HO4 1 1
10 5584 4 2 1 MAN HO6 H 11.651 9.078 0.569 1.00 . D A . 103 MAN HO6 1 1
10 5585 4 2 1 MAN O1 O 6.329 10.094 0.534 1.00 . D A . 103 MAN O1 1 1
10 5586 4 2 1 MAN O2 O 7.437 13.506 -0.405 1.00 . D A . 103 MAN O2 1 1
10 5587 4 2 1 MAN O3 O 6.627 12.361 -2.939 1.00 . D A . 103 MAN O3 1 1
10 5588 4 2 1 MAN O4 O 8.863 10.507 -3.117 1.00 . D A . 103 MAN O4 1 1
10 5589 4 2 1 MAN O5 O 8.516 11.004 0.526 1.00 . D A . 103 MAN O5 1 1
10 5590 4 2 1 MAN O6 O 10.704 9.066 0.401 1.00 . D A . 103 MAN O6 1 1
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