NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
368606 |
1awx   |
cing | 4-filtered-FRED | STAR | entry | full | 610 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1awx
# This FRED archive file contains, for PDB entry <1awx>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_1awx
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1awx
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 7760.46
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 $BRUTON_S_TYROSINE_KINASE A . 1 1
stop_
save_
save_BRUTON_S_TYROSINE_KINASE
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "BRUTON S TYROSINE KINASE"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GSMSTSELKKVVALYDYMPMNANDLQLRKGDEYFILEESNLPWWRARDKNGQEGYIPSNYVTEAEDS
_Entity.Number_of_monomers 67
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 GLY . 1 1
2 SER . 1 1
3 MET . 1 1
4 SER . 1 1
5 THR . 1 1
6 SER . 1 1
7 GLU . 1 1
8 LEU . 1 1
9 LYS . 1 1
10 LYS . 1 1
11 VAL . 1 1
12 VAL . 1 1
13 ALA . 1 1
14 LEU . 1 1
15 TYR . 1 1
16 ASP . 1 1
17 TYR . 1 1
18 MET . 1 1
19 PRO . 1 1
20 MET . 1 1
21 ASN . 1 1
22 ALA . 1 1
23 ASN . 1 1
24 ASP . 1 1
25 LEU . 1 1
26 GLN . 1 1
27 LEU . 1 1
28 ARG . 1 1
29 LYS . 1 1
30 GLY . 1 1
31 ASP . 1 1
32 GLU . 1 1
33 TYR . 1 1
34 PHE . 1 1
35 ILE . 1 1
36 LEU . 1 1
37 GLU . 1 1
38 GLU . 1 1
39 SER . 1 1
40 ASN . 1 1
41 LEU . 1 1
42 PRO . 1 1
43 TRP . 1 1
44 TRP . 1 1
45 ARG . 1 1
46 ALA . 1 1
47 ARG . 1 1
48 ASP . 1 1
49 LYS . 1 1
50 ASN . 1 1
51 GLY . 1 1
52 GLN . 1 1
53 GLU . 1 1
54 GLY . 1 1
55 TYR . 1 1
56 ILE . 1 1
57 PRO . 1 1
58 SER . 1 1
59 ASN . 1 1
60 TYR . 1 1
61 VAL . 1 1
62 THR . 1 1
63 GLU . 1 1
64 ALA . 1 1
65 GLU . 1 1
66 ASP . 1 1
67 SER . 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
GLY 1 1 1 1
SER 2 2 1 1
MET 3 3 1 1
SER 4 4 1 1
THR 5 5 1 1
SER 6 6 1 1
GLU 7 7 1 1
LEU 8 8 1 1
LYS 9 9 1 1
LYS 10 10 1 1
VAL 11 11 1 1
VAL 12 12 1 1
ALA 13 13 1 1
LEU 14 14 1 1
TYR 15 15 1 1
ASP 16 16 1 1
TYR 17 17 1 1
MET 18 18 1 1
PRO 19 19 1 1
MET 20 20 1 1
ASN 21 21 1 1
ALA 22 22 1 1
ASN 23 23 1 1
ASP 24 24 1 1
LEU 25 25 1 1
GLN 26 26 1 1
LEU 27 27 1 1
ARG 28 28 1 1
LYS 29 29 1 1
GLY 30 30 1 1
ASP 31 31 1 1
GLU 32 32 1 1
TYR 33 33 1 1
PHE 34 34 1 1
ILE 35 35 1 1
LEU 36 36 1 1
GLU 37 37 1 1
GLU 38 38 1 1
SER 39 39 1 1
ASN 40 40 1 1
LEU 41 41 1 1
PRO 42 42 1 1
TRP 43 43 1 1
TRP 44 44 1 1
ARG 45 45 1 1
ALA 46 46 1 1
ARG 47 47 1 1
ASP 48 48 1 1
LYS 49 49 1 1
ASN 50 50 1 1
GLY 51 51 1 1
GLN 52 52 1 1
GLU 53 53 1 1
GLY 54 54 1 1
TYR 55 55 1 1
ILE 56 56 1 1
PRO 57 57 1 1
SER 58 58 1 1
ASN 59 59 1 1
TYR 60 60 1 1
VAL 61 61 1 1
THR 62 62 1 1
GLU 63 63 1 1
ALA 64 64 1 1
GLU 65 65 1 1
ASP 66 66 1 1
SER 67 67 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 1 . . . 1 1
131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
136 1 . . . 1 1
137 1 . . . 1 1
138 1 . . . 1 1
139 1 . . . 1 1
140 1 . . . 1 1
141 1 . . . 1 1
142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
146 1 . . . 1 1
147 1 . . . 1 1
148 1 . . . 1 1
149 1 . . . 1 1
150 1 . . . 1 1
151 1 . . . 1 1
152 1 . . . 1 1
153 1 . . . 1 1
154 1 . . . 1 1
155 1 . . . 1 1
156 1 . . . 1 1
157 1 . . . 1 1
158 1 . . . 1 1
159 1 . . . 1 1
160 1 . . . 1 1
161 1 . . . 1 1
162 1 . . . 1 1
163 1 . . . 1 1
164 1 . . . 1 1
165 1 . . . 1 1
166 1 . . . 1 1
167 1 . . . 1 1
168 1 . . . 1 1
169 1 . . . 1 1
170 1 . . . 1 1
171 1 . . . 1 1
172 1 . . . 1 1
173 1 . . . 1 1
174 1 . . . 1 1
175 1 . . . 1 1
176 1 . . . 1 1
177 1 . . . 1 1
178 1 . . . 1 1
179 1 . . . 1 1
180 1 . . . 1 1
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182 1 . . . 1 1
183 1 . . . 1 1
184 1 . . . 1 1
185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 1 . . . 1 1
189 1 . . . 1 1
190 1 . . . 1 1
191 1 . . . 1 1
192 1 . . . 1 1
193 1 . . . 1 1
194 1 . . . 1 1
195 1 . . . 1 1
196 1 . . . 1 1
197 1 . . . 1 1
198 1 . . . 1 1
199 1 . . . 1 1
200 1 . . . 1 1
201 1 . . . 1 1
202 1 . . . 1 1
203 1 . . . 1 1
204 1 . . . 1 1
205 1 . . . 1 1
206 1 . . . 1 1
207 1 . . . 1 1
208 1 . . . 1 1
209 1 . . . 1 1
210 1 . . . 1 1
211 1 . . . 1 1
212 1 . . . 1 1
213 1 . . . 1 1
214 1 . . . 1 1
215 1 . . . 1 1
216 1 . . . 1 1
217 1 . . . 1 1
218 1 . . . 1 1
219 1 . . . 1 1
220 1 . . . 1 1
221 1 . . . 1 1
222 1 . . . 1 1
223 1 . . . 1 1
224 1 . . . 1 1
225 1 . . . 1 1
226 1 . . . 1 1
227 1 . . . 1 1
228 1 . . . 1 1
229 1 . . . 1 1
230 1 . . . 1 1
231 1 . . . 1 1
232 1 . . . 1 1
233 1 . . . 1 1
234 1 . . . 1 1
235 1 . . . 1 1
236 1 . . . 1 1
237 1 . . . 1 1
238 1 . . . 1 1
239 1 . . . 1 1
240 1 . . . 1 1
241 1 . . . 1 1
242 1 . . . 1 1
243 1 . . . 1 1
244 1 . . . 1 1
245 1 . . . 1 1
246 1 . . . 1 1
247 1 . . . 1 1
248 1 . . . 1 1
249 1 . . . 1 1
250 1 . . . 1 1
251 1 . . . 1 1
252 1 . . . 1 1
253 1 . . . 1 1
254 1 . . . 1 1
255 1 . . . 1 1
256 1 . . . 1 1
257 1 . . . 1 1
258 1 . . . 1 1
259 1 . . . 1 1
260 1 . . . 1 1
261 1 . . . 1 1
262 1 . . . 1 1
263 1 . . . 1 1
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 5 THR HA . 5 . HA 1 1
1 1 2 1 1 6 SER H . 6 . HN 1 1
2 1 1 1 1 6 SER HA . 6 . HA 1 1
2 1 2 1 1 7 GLU H . 7 . HN 1 1
3 1 1 1 1 6 SER QB . 6 . HB# 1 1
3 1 2 1 1 7 GLU H . 7 . HN 1 1
4 1 1 1 1 7 GLU H . 7 . HN 1 1
4 1 2 1 1 8 LEU H . 8 . HN 1 1
5 1 1 1 1 7 GLU HA . 7 . HA 1 1
5 1 2 1 1 8 LEU H . 8 . HN 1 1
6 1 1 1 1 7 GLU QB . 7 . HB# 1 1
6 1 2 1 1 8 LEU H . 8 . HN 1 1
7 1 1 1 1 8 LEU H . 8 . HN 1 1
7 1 2 1 1 8 LEU QB . 8 . HB# 1 1
8 1 1 1 1 8 LEU QB . 8 . HB# 1 1
8 1 2 1 1 9 LYS H . 9 . HN 1 1
9 1 1 1 1 8 LEU QD . 8 . HD# 1 1
9 1 2 1 1 9 LYS H . 9 . HN 1 1
10 1 1 1 1 9 LYS HA . 9 . HA 1 1
10 1 2 1 1 10 LYS H . 10 . HN 1 1
11 1 1 1 1 9 LYS QG . 9 . HG# 1 1
11 1 2 1 1 10 LYS H . 10 . HN 1 1
12 1 1 1 1 9 LYS H . 9 . HN 1 1
12 1 2 1 1 35 ILE H . 35 . HN 1 1
13 1 1 1 1 9 LYS H . 9 . HN 1 1
13 1 2 1 1 35 ILE HB . 35 . HB 1 1
14 1 1 1 1 10 LYS H . 10 . HN 1 1
14 1 2 1 1 10 LYS QB . 10 . HB# 1 1
15 1 1 1 1 10 LYS HA . 10 . HA 1 1
15 1 2 1 1 11 VAL H . 11 . HN 1 1
16 1 1 1 1 10 LYS QB . 10 . HB# 1 1
16 1 2 1 1 11 VAL H . 11 . HN 1 1
17 1 1 1 1 10 LYS QG . 10 . HG# 1 1
17 1 2 1 1 11 VAL H . 11 . HN 1 1
18 1 1 1 1 10 LYS QG . 10 . HG# 1 1
18 1 2 1 1 33 TYR H . 33 . HN 1 1
19 1 1 1 1 11 VAL HA . 11 . HA 1 1
19 1 2 1 1 12 VAL H . 12 . HN 1 1
20 1 1 1 1 11 VAL HB . 11 . HB 1 1
20 1 2 1 1 12 VAL H . 12 . HN 1 1
21 1 1 1 1 11 VAL QG . 11 . HG# 1 1
21 1 2 1 1 12 VAL H . 12 . HN 1 1
22 1 1 1 1 11 VAL H . 11 . HN 1 1
22 1 2 1 1 33 TYR H . 33 . HN 1 1
23 1 1 1 1 11 VAL QG . 11 . HG# 1 1
23 1 2 1 1 33 TYR H . 33 . HN 1 1
24 1 1 1 1 11 VAL H . 11 . HN 1 1
24 1 2 1 1 34 PHE HA . 34 . HA 1 1
25 1 1 1 1 11 VAL HB . 11 . HB 1 1
25 1 2 1 1 62 THR H . 62 . HN 1 1
26 1 1 1 1 11 VAL QG . 11 . HG# 1 1
26 1 2 1 1 64 ALA H . 64 . HN 1 1
27 1 1 1 1 12 VAL H . 12 . HN 1 1
27 1 2 1 1 12 VAL HB . 12 . HB 1 1
28 1 1 1 1 12 VAL HA . 12 . HA 1 1
28 1 2 1 1 13 ALA H . 13 . HN 1 1
29 1 1 1 1 12 VAL HB . 12 . HB 1 1
29 1 2 1 1 13 ALA H . 13 . HN 1 1
30 1 1 1 1 12 VAL MG1 . 12 . HG1# 1 1
30 1 2 1 1 30 GLY H . 30 . HN 1 1
31 1 1 1 1 12 VAL MG1 . 12 . HG1# 1 1
31 1 2 1 1 62 THR H . 62 . HN 1 1
32 1 1 1 1 12 VAL MG2 . 12 . HG2# 1 1
32 1 2 1 1 62 THR H . 62 . HN 1 1
33 1 1 1 1 12 VAL H . 12 . HN 1 1
33 1 2 1 1 64 ALA H . 64 . HN 1 1
34 1 1 1 1 13 ALA HA . 13 . HA 1 1
34 1 2 1 1 14 LEU H . 14 . HN 1 1
35 1 1 1 1 13 ALA MB . 13 . HB# 1 1
35 1 2 1 1 14 LEU H . 14 . HN 1 1
36 1 1 1 1 14 LEU H . 14 . HN 1 1
36 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1
37 1 1 1 1 14 LEU H . 14 . HN 1 1
37 1 2 1 1 14 LEU HG . 14 . HG 1 1
38 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1
38 1 2 1 1 15 TYR H . 15 . HN 1 1
39 1 1 1 1 14 LEU HG . 14 . HG 1 1
39 1 2 1 1 15 TYR H . 15 . HN 1 1
40 1 1 1 1 14 LEU QD . 14 . HD# 1 1
40 1 2 1 1 15 TYR H . 15 . HN 1 1
41 1 1 1 1 14 LEU H . 14 . HN 1 1
41 1 2 1 1 61 VAL HA . 61 . HA 1 1
42 1 1 1 1 14 LEU HG . 14 . HG 1 1
42 1 2 1 1 61 VAL H . 61 . HN 1 1
43 1 1 1 1 14 LEU H . 14 . HN 1 1
43 1 2 1 1 15 TYR H . 15 . HN 1 1
44 1 1 1 1 15 TYR H . 15 . HN 1 1
44 1 2 1 1 15 TYR HB2 . 15 . HB2 1 1
45 1 1 1 1 15 TYR H . 15 . HN 1 1
45 1 2 1 1 16 ASP H . 16 . HN 1 1
46 1 1 1 1 15 TYR HB2 . 15 . HB2 1 1
46 1 2 1 1 16 ASP H . 16 . HN 1 1
47 1 1 1 1 15 TYR H . 15 . HN 1 1
47 1 2 1 1 29 LYS HA . 29 . HA 1 1
48 1 1 1 1 16 ASP H . 16 . HN 1 1
48 1 2 1 1 16 ASP HB3 . 16 . HB1 1 1
49 1 1 1 1 16 ASP H . 16 . HN 1 1
49 1 2 1 1 16 ASP HB2 . 16 . HB2 1 1
50 1 1 1 1 16 ASP HB3 . 16 . HB1 1 1
50 1 2 1 1 17 TYR H . 17 . HN 1 1
51 1 1 1 1 16 ASP H . 16 . HN 1 1
51 1 2 1 1 29 LYS QB . 29 . HB# 1 1
52 1 1 1 1 17 TYR QB . 17 . HB# 1 1
52 1 2 1 1 18 MET H . 18 . HN 1 1
53 1 1 1 1 17 TYR QD . 17 . HD# 1 1
53 1 2 1 1 18 MET H . 18 . HN 1 1
54 1 1 1 1 17 TYR H . 17 . HN 1 1
54 1 2 1 1 26 GLN HA . 26 . HA 1 1
55 1 1 1 1 17 TYR H . 17 . HN 1 1
55 1 2 1 1 27 LEU HB2 . 27 . HB2 1 1
56 1 1 1 1 18 MET H . 18 . HN 1 1
56 1 2 1 1 18 MET HB3 . 18 . HB1 1 1
57 1 1 1 1 19 PRO HA . 19 . HA 1 1
57 1 2 1 1 20 MET H . 20 . HN 1 1
58 1 1 1 1 19 PRO QB . 19 . HB# 1 1
58 1 2 1 1 20 MET H . 20 . HN 1 1
59 1 1 1 1 19 PRO HA . 19 . HA 1 1
59 1 2 1 1 21 ASN H . 21 . HN 1 1
60 1 1 1 1 19 PRO QB . 19 . HB# 1 1
60 1 2 1 1 21 ASN H . 21 . HN 1 1
61 1 1 1 1 19 PRO QB . 19 . HB# 1 1
61 1 2 1 1 24 ASP H . 24 . HN 1 1
62 1 1 1 1 20 MET HA . 20 . HA 1 1
62 1 2 1 1 21 ASN H . 21 . HN 1 1
63 1 1 1 1 20 MET QG . 20 . HG# 1 1
63 1 2 1 1 21 ASN H . 21 . HN 1 1
64 1 1 1 1 21 ASN H . 21 . HN 1 1
64 1 2 1 1 21 ASN QB . 21 . HB# 1 1
65 1 1 1 1 21 ASN HA . 21 . HA 1 1
65 1 2 1 1 22 ALA H . 22 . HN 1 1
66 1 1 1 1 21 ASN QB . 21 . HB# 1 1
66 1 2 1 1 22 ALA H . 22 . HN 1 1
67 1 1 1 1 21 ASN QB . 21 . HB# 1 1
67 1 2 1 1 23 ASN H . 23 . HN 1 1
68 1 1 1 1 21 ASN H . 21 . HN 1 1
68 1 2 1 1 24 ASP QB . 24 . HB# 1 1
69 1 1 1 1 21 ASN QB . 21 . HB# 1 1
69 1 2 1 1 24 ASP H . 24 . HN 1 1
70 1 1 1 1 22 ALA HA . 22 . HA 1 1
70 1 2 1 1 23 ASN H . 23 . HN 1 1
71 1 1 1 1 22 ALA MB . 22 . HB# 1 1
71 1 2 1 1 23 ASN H . 23 . HN 1 1
72 1 1 1 1 22 ALA HA . 22 . HA 1 1
72 1 2 1 1 24 ASP H . 24 . HN 1 1
73 1 1 1 1 23 ASN HB3 . 23 . HB1 1 1
73 1 2 1 1 24 ASP H . 24 . HN 1 1
74 1 1 1 1 24 ASP H . 24 . HN 1 1
74 1 2 1 1 24 ASP QB . 24 . HB# 1 1
75 1 1 1 1 24 ASP H . 24 . HN 1 1
75 1 2 1 1 25 LEU H . 25 . HN 1 1
76 1 1 1 1 24 ASP HA . 24 . HA 1 1
76 1 2 1 1 25 LEU H . 25 . HN 1 1
77 1 1 1 1 24 ASP QB . 24 . HB# 1 1
77 1 2 1 1 25 LEU H . 25 . HN 1 1
78 1 1 1 1 25 LEU HA . 25 . HA 1 1
78 1 2 1 1 26 GLN H . 26 . HN 1 1
79 1 1 1 1 25 LEU QB . 25 . HB# 1 1
79 1 2 1 1 26 GLN H . 26 . HN 1 1
80 1 1 1 1 25 LEU QD . 25 . HD# 1 1
80 1 2 1 1 26 GLN H . 26 . HN 1 1
81 1 1 1 1 25 LEU QD . 25 . HD# 1 1
81 1 2 1 1 46 ALA H . 46 . HN 1 1
82 1 1 1 1 25 LEU H . 25 . HN 1 1
82 1 2 1 1 54 GLY QA . 54 . HA# 1 1
83 1 1 1 1 25 LEU QB . 25 . HB# 1 1
83 1 2 1 1 54 GLY H . 54 . HN 1 1
84 1 1 1 1 25 LEU QD . 25 . HD# 1 1
84 1 2 1 1 54 GLY H . 54 . HN 1 1
85 1 1 1 1 26 GLN HA . 26 . HA 1 1
85 1 2 1 1 27 LEU H . 27 . HN 1 1
86 1 1 1 1 26 GLN QG . 26 . HG# 1 1
86 1 2 1 1 27 LEU H . 27 . HN 1 1
87 1 1 1 1 27 LEU H . 27 . HN 1 1
87 1 2 1 1 27 LEU HG . 27 . HG 1 1
88 1 1 1 1 27 LEU HA . 27 . HA 1 1
88 1 2 1 1 28 ARG H . 28 . HN 1 1
89 1 1 1 1 27 LEU HB2 . 27 . HB2 1 1
89 1 2 1 1 28 ARG H . 28 . HN 1 1
90 1 1 1 1 27 LEU HG . 27 . HG# 1 1
90 1 2 1 1 28 ARG H . 28 . HN 1 1
91 1 1 1 1 27 LEU QD . 27 . HD# 1 1
91 1 2 1 1 28 ARG H . 28 . HN 1 1
92 1 1 1 1 28 ARG H . 28 . HN 1 1
92 1 2 1 1 28 ARG QB . 28 . HB# 1 1
93 1 1 1 1 28 ARG HA . 28 . HA 1 1
93 1 2 1 1 29 LYS H . 29 . HN 1 1
94 1 1 1 1 28 ARG QB . 28 . HB# 1 1
94 1 2 1 1 29 LYS H . 29 . HN 1 1
95 1 1 1 1 28 ARG H . 28 . HN 1 1
95 1 2 1 1 31 ASP QB . 31 . HB# 1 1
96 1 1 1 1 29 LYS H . 29 . HN 1 1
96 1 2 1 1 29 LYS HA . 29 . HA 1 1
97 1 1 1 1 29 LYS H . 29 . HN 1 1
97 1 2 1 1 29 LYS QB . 29 . HB# 1 1
98 1 1 1 1 29 LYS HA . 29 . HA 1 1
98 1 2 1 1 30 GLY H . 30 . HN 1 1
99 1 1 1 1 29 LYS QB . 29 . HB# 1 1
99 1 2 1 1 30 GLY H . 30 . HN 1 1
100 1 1 1 1 29 LYS QG . 29 . HG# 1 1
100 1 2 1 1 30 GLY H . 30 . HN 1 1
101 1 1 1 1 29 LYS HA . 29 . HA 1 1
101 1 2 1 1 31 ASP H . 31 . HN 1 1
102 1 1 1 1 30 GLY H . 30 . HN 1 1
102 1 2 1 1 31 ASP H . 31 . HN 1 1
103 1 1 1 1 30 GLY QA . 30 . HA# 1 1
103 1 2 1 1 31 ASP H . 31 . HN 1 1
104 1 1 1 1 31 ASP H . 31 . HN 1 1
104 1 2 1 1 31 ASP HA . 31 . HA 1 1
105 1 1 1 1 31 ASP H . 31 . HN 1 1
105 1 2 1 1 31 ASP QB . 31 . HB# 1 1
106 1 1 1 1 31 ASP HA . 31 . HA 1 1
106 1 2 1 1 32 GLU H . 32 . HN 1 1
107 1 1 1 1 31 ASP QB . 31 . HB# 1 1
107 1 2 1 1 32 GLU H . 32 . HN 1 1
108 1 1 1 1 32 GLU H . 32 . HN 1 1
108 1 2 1 1 32 GLU QG . 32 . HG# 1 1
109 1 1 1 1 32 GLU HA . 32 . HA 1 1
109 1 2 1 1 33 TYR H . 33 . HN 1 1
110 1 1 1 1 32 GLU HB2 . 32 . HB2 1 1
110 1 2 1 1 33 TYR H . 33 . HN 1 1
111 1 1 1 1 32 GLU QG . 32 . HG# 1 1
111 1 2 1 1 33 TYR H . 33 . HN 1 1
112 1 1 1 1 33 TYR H . 33 . HN 1 1
112 1 2 1 1 33 TYR HB3 . 33 . HB1 1 1
113 1 1 1 1 33 TYR HA . 33 . HA 1 1
113 1 2 1 1 34 PHE H . 34 . HN 1 1
114 1 1 1 1 33 TYR HB2 . 33 . HB2 1 1
114 1 2 1 1 34 PHE H . 34 . HN 1 1
115 1 1 1 1 33 TYR QD . 33 . HD# 1 1
115 1 2 1 1 34 PHE H . 34 . HN 1 1
116 1 1 1 1 34 PHE H . 34 . HN 1 1
116 1 2 1 1 34 PHE HB3 . 34 . HB1 1 1
117 1 1 1 1 34 PHE H . 34 . HN 1 1
117 1 2 1 1 34 PHE QD . 34 . HD# 1 1
118 1 1 1 1 34 PHE HB3 . 34 . HB1 1 1
118 1 2 1 1 35 ILE H . 35 . HN 1 1
119 1 1 1 1 34 PHE H . 34 . HN 1 1
119 1 2 1 1 46 ALA MB . 46 . HB# 1 1
120 1 1 1 1 34 PHE H . 34 . HN 1 1
120 1 2 1 1 47 ARG HB2 . 47 . HB2 1 1
121 1 1 1 1 34 PHE HB2 . 34 . HB2 1 1
121 1 2 1 1 47 ARG H . 47 . HN 1 1
122 1 1 1 1 34 PHE H . 34 . HN 1 1
122 1 2 1 1 48 ASP HA . 48 . HA 1 1
123 1 1 1 1 35 ILE H . 35 . HN 1 1
123 1 2 1 1 35 ILE HB . 35 . HB 1 1
124 1 1 1 1 35 ILE H . 35 . HN 1 1
124 1 2 1 1 35 ILE MD . 35 . HD1# 1 1
125 1 1 1 1 35 ILE MD . 35 . HD1# 1 1
125 1 2 1 1 36 LEU H . 36 . HN 1 1
126 1 1 1 1 35 ILE H . 35 . HN 1 1
126 1 2 1 1 46 ALA MB . 46 . HB# 1 1
127 1 1 1 1 35 ILE HA . 35 . HA 1 1
127 1 2 1 1 47 ARG H . 47 . HN 1 1
128 1 1 1 1 36 LEU H . 36 . HN 1 1
128 1 2 1 1 36 LEU QB . 36 . HB# 1 1
129 1 1 1 1 36 LEU H . 36 . HN 1 1
129 1 2 1 1 37 GLU H . 37 . HN 1 1
130 1 1 1 1 36 LEU QB . 36 . HB# 1 1
130 1 2 1 1 37 GLU H . 37 . HN 1 1
131 1 1 1 1 36 LEU QD . 36 . HD# 1 1
131 1 2 1 1 37 GLU H . 37 . HN 1 1
132 1 1 1 1 36 LEU H . 36 . HN 1 1
132 1 2 1 1 46 ALA HA . 46 . HA 1 1
133 1 1 1 1 36 LEU QD . 36 . HD# 1 1
133 1 2 1 1 46 ALA H . 46 . HN 1 1
134 1 1 1 1 37 GLU H . 37 . HN 1 1
134 1 2 1 1 37 GLU QB . 37 . HB# 1 1
135 1 1 1 1 37 GLU HA . 37 . HA 1 1
135 1 2 1 1 38 GLU H . 38 . HN 1 1
136 1 1 1 1 37 GLU QB . 37 . HB# 1 1
136 1 2 1 1 38 GLU H . 38 . HN 1 1
137 1 1 1 1 37 GLU QG . 37 . HG# 1 1
137 1 2 1 1 38 GLU H . 38 . HN 1 1
138 1 1 1 1 37 GLU QB . 37 . HB# 1 1
138 1 2 1 1 45 ARG H . 45 . HN 1 1
139 1 1 1 1 38 GLU H . 38 . HN 1 1
139 1 2 1 1 38 GLU HB3 . 38 . HB1 1 1
140 1 1 1 1 38 GLU HA . 38 . HA 1 1
140 1 2 1 1 39 SER H . 39 . HN 1 1
141 1 1 1 1 38 GLU HB2 . 38 . HB2 1 1
141 1 2 1 1 39 SER H . 39 . HN 1 1
142 1 1 1 1 38 GLU QG . 38 . HG# 1 1
142 1 2 1 1 39 SER H . 39 . HN 1 1
143 1 1 1 1 39 SER HA . 39 . HA 1 1
143 1 2 1 1 40 ASN H . 40 . HN 1 1
144 1 1 1 1 39 SER HB2 . 39 . HB2 1 1
144 1 2 1 1 40 ASN H . 40 . HN 1 1
145 1 1 1 1 39 SER HB3 . 39 . HB1 1 1
145 1 2 1 1 41 LEU H . 41 . HN 1 1
146 1 1 1 1 40 ASN H . 40 . HN 1 1
146 1 2 1 1 41 LEU H . 41 . HN 1 1
147 1 1 1 1 40 ASN HA . 40 . HA 1 1
147 1 2 1 1 41 LEU H . 41 . HN 1 1
148 1 1 1 1 40 ASN QB . 40 . HB# 1 1
148 1 2 1 1 41 LEU H . 41 . HN 1 1
149 1 1 1 1 41 LEU H . 41 . HN 1 1
149 1 2 1 1 41 LEU HB3 . 41 . HB1 1 1
150 1 1 1 1 41 LEU H . 41 . HN 1 1
150 1 2 1 1 41 LEU HG . 41 . HG 1 1
151 1 1 1 1 42 PRO HA . 42 . HA 1 1
151 1 2 1 1 43 TRP H . 43 . HN 1 1
152 1 1 1 1 42 PRO QB . 42 . HB# 1 1
152 1 2 1 1 43 TRP H . 43 . HN 1 1
153 1 1 1 1 42 PRO QG . 42 . HG# 1 1
153 1 2 1 1 43 TRP H . 43 . HN 1 1
154 1 1 1 1 42 PRO QD . 42 . HD# 1 1
154 1 2 1 1 43 TRP H . 43 . HN 1 1
155 1 1 1 1 42 PRO HA . 42 . HA 1 1
155 1 2 1 1 58 SER H . 58 . HN 1 1
156 1 1 1 1 43 TRP H . 43 . HN 1 1
156 1 2 1 1 43 TRP HB3 . 43 . HB1 1 1
157 1 1 1 1 43 TRP HA . 43 . HA 1 1
157 1 2 1 1 44 TRP H . 44 . HN 1 1
158 1 1 1 1 43 TRP HB3 . 43 . HB1 1 1
158 1 2 1 1 44 TRP H . 44 . HN 1 1
159 1 1 1 1 43 TRP HA . 43 . HA 1 1
159 1 2 1 1 58 SER H . 58 . HN 1 1
160 1 1 1 1 44 TRP H . 44 . HN 1 1
160 1 2 1 1 44 TRP HB3 . 44 . HB1 1 1
161 1 1 1 1 44 TRP H . 44 . HN 1 1
161 1 2 1 1 44 TRP HD1 . 44 . HD1 1 1
162 1 1 1 1 44 TRP HA . 44 . HA 1 1
162 1 2 1 1 45 ARG H . 45 . HN 1 1
163 1 1 1 1 44 TRP HB3 . 44 . HB1 1 1
163 1 2 1 1 45 ARG H . 45 . HN 1 1
164 1 1 1 1 44 TRP H . 44 . HN 1 1
164 1 2 1 1 56 ILE HB . 56 . HB 1 1
165 1 1 1 1 44 TRP H . 44 . HN 1 1
165 1 2 1 1 57 PRO HA . 57 . HA 1 1
166 1 1 1 1 44 TRP H . 44 . HN 1 1
166 1 2 1 1 58 SER H . 58 . HN 1 1
167 1 1 1 1 44 TRP HE1 . 44 . HE1 1 1
167 1 2 1 1 58 SER QB . 58 . HB# 1 1
168 1 1 1 1 45 ARG H . 45 . HN 1 1
168 1 2 1 1 45 ARG QB . 45 . HB# 1 1
169 1 1 1 1 45 ARG H . 45 . HN 1 1
169 1 2 1 1 45 ARG QD . 45 . HD# 1 1
170 1 1 1 1 45 ARG HA . 45 . HA 1 1
170 1 2 1 1 46 ALA H . 46 . HN 1 1
171 1 1 1 1 45 ARG QB . 45 . HB# 1 1
171 1 2 1 1 46 ALA H . 46 . HN 1 1
172 1 1 1 1 45 ARG QG . 45 . HG# 1 1
172 1 2 1 1 46 ALA H . 46 . HN 1 1
173 1 1 1 1 45 ARG HA . 45 . HA 1 1
173 1 2 1 1 54 GLY H . 54 . HN 1 1
174 1 1 1 1 45 ARG HA . 45 . HA 1 1
174 1 2 1 1 56 ILE H . 56 . HN 1 1
175 1 1 1 1 46 ALA HA . 46 . HA 1 1
175 1 2 1 1 47 ARG H . 47 . HN 1 1
176 1 1 1 1 46 ALA MB . 46 . HB# 1 1
176 1 2 1 1 47 ARG H . 47 . HN 1 1
177 1 1 1 1 46 ALA H . 46 . HN 1 1
177 1 2 1 1 54 GLY H . 54 . HN 1 1
178 1 1 1 1 46 ALA MB . 46 . HB# 1 1
178 1 2 1 1 54 GLY H . 54 . HN 1 1
179 1 1 1 1 46 ALA H . 46 . HN 1 1
179 1 2 1 1 55 TYR HA . 55 . HA 1 1
180 1 1 1 1 46 ALA H . 46 . HN 1 1
180 1 2 1 1 56 ILE MD . 56 . HD1# 1 1
181 1 1 1 1 47 ARG HA . 47 . HA 1 1
181 1 2 1 1 48 ASP H . 48 . HN 1 1
182 1 1 1 1 47 ARG QG . 47 . HG# 1 1
182 1 2 1 1 48 ASP H . 48 . HN 1 1
183 1 1 1 1 48 ASP H . 48 . HN 1 1
183 1 2 1 1 48 ASP HB2 . 48 . HB2 1 1
184 1 1 1 1 48 ASP HA . 48 . HA 1 1
184 1 2 1 1 49 LYS H . 49 . HN 1 1
185 1 1 1 1 48 ASP HB3 . 48 . HB1 1 1
185 1 2 1 1 49 LYS H . 49 . HN 1 1
186 1 1 1 1 48 ASP HB3 . 48 . HB1 1 1
186 1 2 1 1 50 ASN H . 50 . HN 1 1
187 1 1 1 1 48 ASP H . 48 . HN 1 1
187 1 2 1 1 52 GLN H . 52 . HN 1 1
188 1 1 1 1 49 LYS H . 49 . HN 1 1
188 1 2 1 1 49 LYS QG . 49 . HG# 1 1
189 1 1 1 1 49 LYS H . 49 . HN 1 1
189 1 2 1 1 49 LYS QB . 49 . HB# 1 1
190 1 1 1 1 49 LYS H . 49 . HN 1 1
190 1 2 1 1 50 ASN H . 50 . HN 1 1
191 1 1 1 1 49 LYS HA . 49 . HA 1 1
191 1 2 1 1 50 ASN H . 50 . HN 1 1
192 1 1 1 1 49 LYS QG . 49 . HG# 1 1
192 1 2 1 1 50 ASN H . 50 . HN 1 1
193 1 1 1 1 49 LYS QB . 49 . HB# 1 1
193 1 2 1 1 50 ASN H . 50 . HN 1 1
194 1 1 1 1 49 LYS H . 49 . HN 1 1
194 1 2 1 1 51 GLY H . 51 . HN 1 1
195 1 1 1 1 49 LYS HA . 49 . HA 1 1
195 1 2 1 1 51 GLY H . 51 . HN 1 1
196 1 1 1 1 50 ASN H . 50 . HN 1 1
196 1 2 1 1 50 ASN HA . 50 . HA 1 1
197 1 1 1 1 50 ASN H . 50 . HN 1 1
197 1 2 1 1 50 ASN HB2 . 50 . HB2 1 1
198 1 1 1 1 50 ASN HA . 50 . HA 1 1
198 1 2 1 1 51 GLY H . 51 . HN 1 1
199 1 1 1 1 50 ASN HB3 . 50 . HB1 1 1
199 1 2 1 1 51 GLY H . 51 . HN 1 1
200 1 1 1 1 50 ASN HB3 . 50 . HB1 1 1
200 1 2 1 1 52 GLN H . 52 . HN 1 1
201 1 1 1 1 51 GLY QA . 51 . HA# 1 1
201 1 2 1 1 52 GLN H . 52 . HN 1 1
202 1 1 1 1 52 GLN H . 52 . HN 1 1
202 1 2 1 1 52 GLN HB3 . 52 . HB1 1 1
203 1 1 1 1 52 GLN HA . 52 . HA 1 1
203 1 2 1 1 53 GLU H . 53 . HN 1 1
204 1 1 1 1 52 GLN HB3 . 52 . HB1 1 1
204 1 2 1 1 53 GLU H . 53 . HN 1 1
205 1 1 1 1 52 GLN QG . 52 . HG# 1 1
205 1 2 1 1 53 GLU H . 53 . HN 1 1
206 1 1 1 1 53 GLU H . 53 . HN 1 1
206 1 2 1 1 53 GLU QB . 53 . HB# 1 1
207 1 1 1 1 53 GLU HA . 53 . HA 1 1
207 1 2 1 1 54 GLY H . 54 . HN 1 1
208 1 1 1 1 53 GLU QG . 53 . HG# 1 1
208 1 2 1 1 54 GLY H . 54 . HN 1 1
209 1 1 1 1 53 GLU QB . 53 . HB# 1 1
209 1 2 1 1 54 GLY H . 54 . HN 1 1
210 1 1 1 1 54 GLY QA . 54 . HA# 1 1
210 1 2 1 1 55 TYR H . 55 . HN 1 1
211 1 1 1 1 54 GLY H . 54 . HN 1 1
211 1 2 1 1 55 TYR H . 55 . HN 1 1
212 1 1 1 1 55 TYR H . 55 . HN 1 1
212 1 2 1 1 55 TYR HB2 . 55 . HB2 1 1
213 1 1 1 1 55 TYR H . 55 . HN 1 1
213 1 2 1 1 55 TYR QD . 55 . HD# 1 1
214 1 1 1 1 55 TYR HA . 55 . HA 1 1
214 1 2 1 1 56 ILE H . 56 . HN 1 1
215 1 1 1 1 56 ILE H . 56 . HN 1 1
215 1 2 1 1 56 ILE MD . 56 . HD1# 1 1
216 1 1 1 1 57 PRO HA . 57 . HA 1 1
216 1 2 1 1 58 SER H . 58 . HN 1 1
217 1 1 1 1 57 PRO QB . 57 . HB# 1 1
217 1 2 1 1 58 SER H . 58 . HN 1 1
218 1 1 1 1 57 PRO QB . 57 . HB# 1 1
218 1 2 1 1 59 ASN H . 59 . HN 1 1
219 1 1 1 1 57 PRO QB . 57 . HB# 1 1
219 1 2 1 1 60 TYR H . 60 . HN 1 1
220 1 1 1 1 58 SER HA . 58 . HA 1 1
220 1 2 1 1 59 ASN H . 59 . HN 1 1
221 1 1 1 1 58 SER HA . 58 . HA 1 1
221 1 2 1 1 60 TYR H . 60 . HN 1 1
222 1 1 1 1 59 ASN H . 59 . HN 1 1
222 1 2 1 1 59 ASN HB2 . 59 . HB2 1 1
223 1 1 1 1 59 ASN H . 59 . HN 1 1
223 1 2 1 1 60 TYR H . 60 . HN 1 1
224 1 1 1 1 59 ASN HA . 59 . HA 1 1
224 1 2 1 1 60 TYR H . 60 . HN 1 1
225 1 1 1 1 59 ASN HB3 . 59 . HB1 1 1
225 1 2 1 1 60 TYR H . 60 . HN 1 1
226 1 1 1 1 59 ASN HA . 59 . HA 1 1
226 1 2 1 1 61 VAL H . 61 . HN 1 1
227 1 1 1 1 60 TYR H . 60 . HN 1 1
227 1 2 1 1 60 TYR HB3 . 60 . HB1 1 1
228 1 1 1 1 60 TYR H . 60 . HN 1 1
228 1 2 1 1 61 VAL QG . 61 . HG# 1 1
229 1 1 1 1 60 TYR HA . 60 . HA 1 1
229 1 2 1 1 61 VAL H . 61 . HN 1 1
230 1 1 1 1 60 TYR HB2 . 60 . HB2 1 1
230 1 2 1 1 61 VAL H . 61 . HN 1 1
231 1 1 1 1 61 VAL H . 61 . HN 1 1
231 1 2 1 1 61 VAL QG . 61 . HG# 1 1
232 1 1 1 1 61 VAL H . 61 . HN 1 1
232 1 2 1 1 62 THR H . 62 . HN 1 1
233 1 1 1 1 61 VAL HA . 61 . HA 1 1
233 1 2 1 1 62 THR H . 62 . HN 1 1
234 1 1 1 1 61 VAL HB . 61 . HB 1 1
234 1 2 1 1 62 THR H . 62 . HN 1 1
235 1 1 1 1 61 VAL QG . 61 . HG# 1 1
235 1 2 1 1 62 THR H . 62 . HN 1 1
236 1 1 1 1 62 THR H . 62 . HN 1 1
236 1 2 1 1 62 THR MG . 62 . HG2# 1 1
237 1 1 1 1 62 THR HA . 62 . HA 1 1
237 1 2 1 1 63 GLU H . 63 . HN 1 1
238 1 1 1 1 62 THR HB . 62 . HB 1 1
238 1 2 1 1 63 GLU H . 63 . HN 1 1
239 1 1 1 1 62 THR MG . 62 . HG2# 1 1
239 1 2 1 1 63 GLU H . 63 . HN 1 1
240 1 1 1 1 63 GLU H . 63 . HN 1 1
240 1 2 1 1 63 GLU QB . 63 . HB# 1 1
241 1 1 1 1 63 GLU HA . 63 . HA 1 1
241 1 2 1 1 64 ALA H . 64 . HN 1 1
242 1 1 1 1 63 GLU QB . 63 . HB# 1 1
242 1 2 1 1 64 ALA H . 64 . HN 1 1
243 1 1 1 1 63 GLU QG . 63 . HG# 1 1
243 1 2 1 1 64 ALA H . 64 . HN 1 1
244 1 1 1 1 64 ALA HA . 64 . HA 1 1
244 1 2 1 1 65 GLU H . 65 . HN 1 1
245 1 1 1 1 64 ALA MB . 64 . HB# 1 1
245 1 2 1 1 65 GLU H . 65 . HN 1 1
246 1 1 1 1 65 GLU H . 65 . HN 1 1
246 1 2 1 1 65 GLU HB2 . 65 . HB2 1 1
247 1 1 1 1 10 LYS HA . 10 . HA 1 1
247 1 2 1 1 35 ILE H . 35 . HN 1 1
248 1 1 1 1 11 VAL QG . 11 . HG# 1 1
248 1 2 1 1 34 PHE H . 34 . HN 1 1
249 1 1 1 1 11 VAL QG . 11 . HG# 1 1
249 1 2 1 1 63 GLU H . 63 . HN 1 1
250 1 1 1 1 12 VAL H . 12 . HN 1 1
250 1 2 1 1 61 VAL HA . 61 . HA 1 1
251 1 1 1 1 12 VAL H . 12 . HN 1 1
251 1 2 1 1 62 THR MG . 62 . HG2# 1 1
252 1 1 1 1 13 ALA MB . 13 . HB# 1 1
252 1 2 1 1 30 GLY H . 30 . HN 1 1
253 1 1 1 1 13 ALA H . 13 . HN 1 1
253 1 2 1 1 33 TYR QE . 33 . HE# 1 1
254 1 1 1 1 24 ASP HA . 24 . HA 1 1
254 1 2 1 1 55 TYR H . 55 . HN 1 1
255 1 1 1 1 25 LEU QD . 25 . HD# 1 1
255 1 2 1 1 47 ARG H . 47 . HN 1 1
256 1 1 1 1 25 LEU QD . 25 . HD# 1 1
256 1 2 1 1 48 ASP H . 48 . HN 1 1
257 1 1 1 1 25 LEU QD . 25 . HD# 1 1
257 1 2 1 1 53 GLU H . 53 . HN 1 1
258 1 1 1 1 28 ARG H . 28 . HN 1 1
258 1 2 1 1 33 TYR QE . 33 . HE# 1 1
259 1 1 1 1 13 ALA MB . 13 . HB# 1 1
259 1 2 1 1 31 ASP H . 31 . HN 1 1
260 1 1 1 1 31 ASP H . 31 . HN 1 1
260 1 2 1 1 33 TYR QE . 33 . HE# 1 1
261 1 1 1 1 35 ILE MD . 35 . HD1# 1 1
261 1 2 1 1 37 GLU H . 37 . HN 1 1
262 1 1 1 1 36 LEU H . 36 . HN 1 1
262 1 2 1 1 46 ALA MB . 46 . HB# 1 1
263 1 1 1 1 60 TYR H . 60 . HN 1 1
263 1 2 1 1 61 VAL H . 61 . HN 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.0 0.0 5.0 1 1
2 1 . . . . . 3.5 0.0 3.5 1 1
3 1 . . . . . 5.0 0.0 5.7 1 1
4 1 . . . . . 5.0 0.0 5.0 1 1
5 1 . . . . . 2.8 0.0 2.8 1 1
6 1 . . . . . 5.0 0.0 5.7 1 1
7 1 . . . . . 3.5 0.0 4.2 1 1
8 1 . . . . . 5.0 0.0 5.7 1 1
9 1 . . . . . 5.0 0.0 6.5 1 1
10 1 . . . . . 2.8 0.0 2.8 1 1
11 1 . . . . . 5.0 0.0 5.7 1 1
12 1 . . . . . 5.0 0.0 5.0 1 1
13 1 . . . . . 3.5 0.0 3.5 1 1
14 1 . . . . . 3.5 0.0 4.2 1 1
15 1 . . . . . 2.8 0.0 2.8 1 1
16 1 . . . . . 5.0 0.0 5.7 1 1
17 1 . . . . . 3.5 0.0 4.2 1 1
18 1 . . . . . 5.0 0.0 5.7 1 1
19 1 . . . . . 2.8 0.0 2.8 1 1
20 1 . . . . . 2.8 0.0 2.8 1 1
21 1 . . . . . 5.0 0.0 6.5 1 1
22 1 . . . . . 5.0 0.0 5.0 1 1
23 1 . . . . . 3.5 0.0 5.0 1 1
24 1 . . . . . 5.0 0.0 5.0 1 1
25 1 . . . . . 3.5 0.0 3.5 1 1
26 1 . . . . . 5.0 0.0 6.5 1 1
27 1 . . . . . 3.5 0.0 3.5 1 1
28 1 . . . . . 3.5 0.0 3.5 1 1
29 1 . . . . . 5.0 0.0 5.0 1 1
30 1 . . . . . 5.0 0.0 5.4 1 1
31 1 . . . . . 5.0 0.0 5.4 1 1
32 1 . . . . . 5.0 0.0 5.4 1 1
33 1 . . . . . 5.0 0.0 5.0 1 1
34 1 . . . . . 2.8 0.0 2.8 1 1
35 1 . . . . . 5.0 0.0 5.4 1 1
36 1 . . . . . 3.5 0.0 3.5 1 1
37 1 . . . . . 3.5 0.0 3.5 1 1
38 1 . . . . . 3.5 0.0 3.5 1 1
39 1 . . . . . 5.0 0.0 5.0 1 1
40 1 . . . . . 5.0 0.0 6.5 1 1
41 1 . . . . . 3.5 0.0 3.5 1 1
42 1 . . . . . 5.0 0.0 5.0 1 1
43 1 . . . . . 2.8 0.0 2.8 1 1
44 1 . . . . . 3.5 0.0 3.5 1 1
45 1 . . . . . 5.0 0.0 5.0 1 1
46 1 . . . . . 3.5 0.0 3.5 1 1
47 1 . . . . . 5.0 0.0 5.0 1 1
48 1 . . . . . 3.5 0.0 3.5 1 1
49 1 . . . . . 2.8 0.0 2.8 1 1
50 1 . . . . . 3.5 0.0 3.5 1 1
51 1 . . . . . 3.5 0.0 4.2 1 1
52 1 . . . . . 5.0 0.0 5.7 1 1
53 1 . . . . . 5.0 0.0 7.0 1 1
54 1 . . . . . 5.0 0.0 5.0 1 1
55 1 . . . . . 3.5 0.0 3.5 1 1
56 1 . . . . . 3.5 0.0 3.5 1 1
57 1 . . . . . 2.8 0.0 2.8 1 1
58 1 . . . . . . 0.0 4.2 1 1
59 1 . . . . . 5.0 0.0 5.0 1 1
60 1 . . . . . 5.0 0.0 5.7 1 1
61 1 . . . . . 5.0 0.0 5.7 1 1
62 1 . . . . . 5.0 0.0 5.0 1 1
63 1 . . . . . 3.5 0.0 4.2 1 1
64 1 . . . . . 3.5 0.0 4.2 1 1
65 1 . . . . . 3.5 0.0 3.5 1 1
66 1 . . . . . 5.0 0.0 5.7 1 1
67 1 . . . . . 5.0 0.0 5.7 1 1
68 1 . . . . . 5.0 0.0 5.7 1 1
69 1 . . . . . 5.0 0.0 5.7 1 1
70 1 . . . . . 3.5 0.0 3.5 1 1
71 1 . . . . . 5.0 0.0 5.4 1 1
72 1 . . . . . 5.0 0.0 5.0 1 1
73 1 . . . . . 5.0 0.0 5.0 1 1
74 1 . . . . . 3.5 0.0 4.2 1 1
75 1 . . . . . 5.0 0.0 5.0 1 1
76 1 . . . . . 2.8 0.0 2.8 1 1
77 1 . . . . . 3.5 0.0 4.2 1 1
78 1 . . . . . 3.5 0.0 3.5 1 1
79 1 . . . . . 5.0 0.0 5.7 1 1
80 1 . . . . . 3.5 0.0 5.0 1 1
81 1 . . . . . 5.0 0.0 6.5 1 1
82 1 . . . . . 5.0 0.0 5.7 1 1
83 1 . . . . . 5.0 0.0 5.7 1 1
84 1 . . . . . 5.0 0.0 6.5 1 1
85 1 . . . . . 2.8 0.0 2.8 1 1
86 1 . . . . . 5.0 0.0 5.7 1 1
87 1 . . . . . 3.5 0.0 3.5 1 1
88 1 . . . . . 2.8 0.0 2.8 1 1
89 1 . . . . . 3.5 0.0 3.5 1 1
90 1 . . . . . 3.5 0.0 4.2 1 1
91 1 . . . . . 5.0 0.0 6.5 1 1
92 1 . . . . . 3.5 0.0 4.2 1 1
93 1 . . . . . 2.8 0.0 2.8 1 1
94 1 . . . . . 3.5 0.0 4.2 1 1
95 1 . . . . . 5.0 0.0 5.7 1 1
96 1 . . . . . 2.8 0.0 2.8 1 1
97 1 . . . . . 3.5 0.0 4.2 1 1
98 1 . . . . . 2.8 0.0 2.8 1 1
99 1 . . . . . 5.0 0.0 5.7 1 1
100 1 . . . . . 3.5 0.0 4.2 1 1
101 1 . . . . . 3.5 0.0 3.5 1 1
102 1 . . . . . 3.5 0.0 3.5 1 1
103 1 . . . . . 3.5 0.0 4.2 1 1
104 1 . . . . . 2.8 0.0 2.8 1 1
105 1 . . . . . 3.5 0.0 4.2 1 1
106 1 . . . . . 2.8 0.0 2.8 1 1
107 1 . . . . . 3.5 0.0 4.2 1 1
108 1 . . . . . 3.5 0.0 4.2 1 1
109 1 . . . . . 2.8 0.0 2.8 1 1
110 1 . . . . . 3.5 0.0 3.5 1 1
111 1 . . . . . 5.0 0.0 5.7 1 1
112 1 . . . . . 3.5 0.0 3.5 1 1
113 1 . . . . . 2.8 0.0 2.8 1 1
114 1 . . . . . 2.8 0.0 2.8 1 1
115 1 . . . . . 5.0 0.0 7.0 1 1
116 1 . . . . . 3.5 0.0 3.5 1 1
117 1 . . . . . 5.0 0.0 5.5 1 1
118 1 . . . . . 3.5 0.0 3.5 1 1
119 1 . . . . . 5.0 0.0 5.4 1 1
120 1 . . . . . 5.0 0.0 5.0 1 1
121 1 . . . . . 3.5 0.0 3.5 1 1
122 1 . . . . . 3.5 0.0 3.5 1 1
123 1 . . . . . 2.8 0.0 2.8 1 1
124 1 . . . . . 5.0 0.0 5.4 1 1
125 1 . . . . . 5.0 0.0 5.4 1 1
126 1 . . . . . 5.0 0.0 5.4 1 1
127 1 . . . . . 5.0 0.0 5.0 1 1
128 1 . . . . . 3.5 0.0 4.2 1 1
129 1 . . . . . 3.5 0.0 3.5 1 1
130 1 . . . . . 3.5 0.0 4.2 1 1
131 1 . . . . . 5.0 0.0 6.5 1 1
132 1 . . . . . 3.5 0.0 3.5 1 1
133 1 . . . . . 5.0 0.0 6.5 1 1
134 1 . . . . . 3.5 0.0 4.2 1 1
135 1 . . . . . 2.8 0.0 2.8 1 1
136 1 . . . . . 5.0 0.0 5.7 1 1
137 1 . . . . . . 0.0 4.2 1 1
138 1 . . . . . 5.0 0.0 5.7 1 1
139 1 . . . . . 3.5 0.0 3.5 1 1
140 1 . . . . . 2.8 0.0 2.8 1 1
141 1 . . . . . 5.0 0.0 5.0 1 1
142 1 . . . . . 5.0 0.0 5.7 1 1
143 1 . . . . . 3.5 0.0 3.5 1 1
144 1 . . . . . 5.0 0.0 5.0 1 1
145 1 . . . . . 5.0 0.0 5.0 1 1
146 1 . . . . . 5.0 0.0 5.0 1 1
147 1 . . . . . 5.0 0.0 5.0 1 1
148 1 . . . . . 5.0 0.0 5.7 1 1
149 1 . . . . . 3.5 0.0 3.5 1 1
150 1 . . . . . 3.5 0.0 3.5 1 1
151 1 . . . . . 5.0 0.0 5.0 1 1
152 1 . . . . . 3.5 0.0 4.2 1 1
153 1 . . . . . 5.0 0.0 5.7 1 1
154 1 . . . . . 5.0 0.0 5.7 1 1
155 1 . . . . . 3.5 0.0 3.5 1 1
156 1 . . . . . 3.5 0.0 3.5 1 1
157 1 . . . . . 2.8 0.0 2.8 1 1
158 1 . . . . . 3.5 0.0 3.5 1 1
159 1 . . . . . . 0.0 3.5 1 1
160 1 . . . . . 3.5 0.0 3.5 1 1
161 1 . . . . . 5.0 0.0 5.0 1 1
162 1 . . . . . 2.8 0.0 2.8 1 1
163 1 . . . . . 2.8 0.0 2.8 1 1
164 1 . . . . . 3.5 0.0 3.5 1 1
165 1 . . . . . 5.0 0.0 5.0 1 1
166 1 . . . . . 5.0 0.0 5.0 1 1
167 1 . . . . . 5.0 0.0 5.7 1 1
168 1 . . . . . 3.5 0.0 4.2 1 1
169 1 . . . . . 5.0 0.0 5.7 1 1
170 1 . . . . . 2.8 0.0 2.8 1 1
171 1 . . . . . 5.0 0.0 5.7 1 1
172 1 . . . . . 5.0 0.0 5.7 1 1
173 1 . . . . . 5.0 0.0 5.0 1 1
174 1 . . . . . 5.0 0.0 5.0 1 1
175 1 . . . . . 2.8 0.0 2.8 1 1
176 1 . . . . . 3.5 0.0 3.9 1 1
177 1 . . . . . 3.5 0.0 3.5 1 1
178 1 . . . . . 5.0 0.0 5.4 1 1
179 1 . . . . . 5.0 0.0 5.0 1 1
180 1 . . . . . 5.0 0.0 5.4 1 1
181 1 . . . . . 2.8 0.0 2.8 1 1
182 1 . . . . . 3.5 0.0 4.2 1 1
183 1 . . . . . 3.5 0.0 3.5 1 1
184 1 . . . . . 3.5 0.0 3.5 1 1
185 1 . . . . . 3.5 0.0 3.5 1 1
186 1 . . . . . 5.0 0.0 5.0 1 1
187 1 . . . . . 5.0 0.0 5.0 1 1
188 1 . . . . . 3.5 0.0 4.2 1 1
189 1 . . . . . 3.5 0.0 4.2 1 1
190 1 . . . . . . 0.0 3.5 1 1
191 1 . . . . . 3.5 0.0 3.5 1 1
192 1 . . . . . 5.0 0.0 5.7 1 1
193 1 . . . . . 5.0 0.0 5.7 1 1
194 1 . . . . . 5.0 0.0 5.0 1 1
195 1 . . . . . 5.0 0.0 5.0 1 1
196 1 . . . . . 2.8 0.0 2.8 1 1
197 1 . . . . . 2.8 0.0 2.8 1 1
198 1 . . . . . 3.5 0.0 3.5 1 1
199 1 . . . . . 5.0 0.0 5.0 1 1
200 1 . . . . . 5.0 0.0 5.0 1 1
201 1 . . . . . 5.0 0.0 5.7 1 1
202 1 . . . . . 3.5 0.0 3.5 1 1
203 1 . . . . . 2.8 0.0 2.8 1 1
204 1 . . . . . 3.5 0.0 3.5 1 1
205 1 . . . . . 5.0 0.0 5.7 1 1
206 1 . . . . . 3.5 0.0 4.2 1 1
207 1 . . . . . 2.8 0.0 2.8 1 1
208 1 . . . . . 5.0 0.0 5.7 1 1
209 1 . . . . . 3.5 0.0 4.2 1 1
210 1 . . . . . 3.5 0.0 4.2 1 1
211 1 . . . . . 5.0 0.0 5.0 1 1
212 1 . . . . . 2.8 0.0 2.8 1 1
213 1 . . . . . 5.0 0.0 7.0 1 1
214 1 . . . . . 2.8 0.0 2.8 1 1
215 1 . . . . . 5.0 0.0 5.4 1 1
216 1 . . . . . 2.8 0.0 2.8 1 1
217 1 . . . . . 5.0 0.0 5.7 1 1
218 1 . . . . . 5.0 0.0 5.7 1 1
219 1 . . . . . 5.0 0.0 5.7 1 1
220 1 . . . . . 5.0 0.0 5.0 1 1
221 1 . . . . . 5.0 0.0 5.0 1 1
222 1 . . . . . 3.5 0.0 3.5 1 1
223 1 . . . . . 3.5 0.0 3.5 1 1
224 1 . . . . . 5.0 0.0 5.0 1 1
225 1 . . . . . 3.5 0.0 3.5 1 1
226 1 . . . . . 5.0 0.0 5.0 1 1
227 1 . . . . . 3.5 0.0 3.5 1 1
228 1 . . . . . 5.0 0.0 6.5 1 1
229 1 . . . . . 5.0 0.0 5.0 1 1
230 1 . . . . . 5.0 0.0 5.0 1 1
231 1 . . . . . 3.5 0.0 5.0 1 1
232 1 . . . . . 5.0 0.0 5.0 1 1
233 1 . . . . . 2.8 0.0 2.8 1 1
234 1 . . . . . 3.5 0.0 3.5 1 1
235 1 . . . . . 5.0 0.0 6.5 1 1
236 1 . . . . . 3.5 0.0 3.9 1 1
237 1 . . . . . 5.0 0.0 5.0 1 1
238 1 . . . . . 5.0 0.0 5.0 1 1
239 1 . . . . . 5.0 0.0 5.4 1 1
240 1 . . . . . 3.5 0.0 4.2 1 1
241 1 . . . . . 5.0 0.0 5.0 1 1
242 1 . . . . . 5.0 0.0 5.7 1 1
243 1 . . . . . 5.0 0.0 5.7 1 1
244 1 . . . . . 5.0 0.0 5.0 1 1
245 1 . . . . . 5.0 0.0 5.4 1 1
246 1 . . . . . 3.5 0.0 3.5 1 1
247 1 . . . . . 5.0 0.0 5.0 1 1
248 1 . . . . . 5.0 0.0 6.5 1 1
249 1 . . . . . 5.0 0.0 6.5 1 1
250 1 . . . . . 5.0 0.0 5.0 1 1
251 1 . . . . . . 0.0 3.9 1 1
252 1 . . . . . 5.0 0.0 5.4 1 1
253 1 . . . . . 5.0 0.0 5.5 1 1
254 1 . . . . . 2.8 0.0 2.8 1 1
255 1 . . . . . 5.0 0.0 6.5 1 1
256 1 . . . . . 5.0 0.0 5.0 1 1
257 1 . . . . . 5.0 0.0 6.5 1 1
258 1 . . . . . 5.0 0.0 5.5 1 1
259 1 . . . . . 5.0 0.0 5.4 1 1
260 1 . . . . . 5.0 0.0 5.5 1 1
261 1 . . . . . 5.0 0.0 5.4 1 1
262 1 . . . . . 5.0 0.0 5.4 1 1
263 1 . . . . . . 0.0 2.8 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 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 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
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 1 . . . 1 2
26 1 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 1 . . . 1 2
39 1 . . . 1 2
40 1 . . . 1 2
41 1 . . . 1 2
42 1 . . . 1 2
43 1 . . . 1 2
44 1 . . . 1 2
45 1 . . . 1 2
46 1 . . . 1 2
47 1 . . . 1 2
48 1 . . . 1 2
49 1 . . . 1 2
50 1 . . . 1 2
51 1 . . . 1 2
52 1 . . . 1 2
53 1 . . . 1 2
54 1 . . . 1 2
55 1 . . . 1 2
56 1 . . . 1 2
57 1 . . . 1 2
58 1 . . . 1 2
59 1 . . . 1 2
60 1 . . . 1 2
61 1 . . . 1 2
62 1 . . . 1 2
63 1 . . . 1 2
64 1 . . . 1 2
65 1 . . . 1 2
66 1 . . . 1 2
67 1 . . . 1 2
68 1 . . . 1 2
69 1 . . . 1 2
70 1 . . . 1 2
71 1 . . . 1 2
72 1 . . . 1 2
73 1 . . . 1 2
74 1 . . . 1 2
75 1 . . . 1 2
76 1 . . . 1 2
77 1 . . . 1 2
78 1 . . . 1 2
79 1 . . . 1 2
80 1 . . . 1 2
81 1 . . . 1 2
82 1 . . . 1 2
83 1 . . . 1 2
84 1 . . . 1 2
85 1 . . . 1 2
86 1 . . . 1 2
87 1 . . . 1 2
88 1 . . . 1 2
89 1 . . . 1 2
90 1 . . . 1 2
91 1 . . . 1 2
92 1 . . . 1 2
93 1 . . . 1 2
94 1 . . . 1 2
95 1 . . . 1 2
96 1 . . . 1 2
97 1 . . . 1 2
98 1 . . . 1 2
99 1 . . . 1 2
100 1 . . . 1 2
101 1 . . . 1 2
102 1 . . . 1 2
103 1 . . . 1 2
104 1 . . . 1 2
105 1 . . . 1 2
106 1 . . . 1 2
107 1 . . . 1 2
108 1 . . . 1 2
109 1 . . . 1 2
110 1 . . . 1 2
111 1 . . . 1 2
112 1 . . . 1 2
113 1 . . . 1 2
114 1 . . . 1 2
115 1 . . . 1 2
116 1 . . . 1 2
117 1 . . . 1 2
118 1 . . . 1 2
119 1 . . . 1 2
120 1 . . . 1 2
121 1 . . . 1 2
122 1 . . . 1 2
123 1 . . . 1 2
124 1 . . . 1 2
125 1 . . . 1 2
126 1 . . . 1 2
127 1 . . . 1 2
128 1 . . . 1 2
129 1 . . . 1 2
130 1 . . . 1 2
131 1 . . . 1 2
132 1 . . . 1 2
133 1 . . . 1 2
134 1 . . . 1 2
135 1 . . . 1 2
136 1 . . . 1 2
137 1 . . . 1 2
138 1 . . . 1 2
139 1 . . . 1 2
140 1 . . . 1 2
141 1 . . . 1 2
142 1 . . . 1 2
143 1 . . . 1 2
144 1 . . . 1 2
145 1 . . . 1 2
146 1 . . . 1 2
147 1 . . . 1 2
148 1 . . . 1 2
149 1 . . . 1 2
150 1 . . . 1 2
151 1 . . . 1 2
152 1 . . . 1 2
153 1 . . . 1 2
154 1 . . . 1 2
155 1 . . . 1 2
156 1 . . . 1 2
157 1 . . . 1 2
158 1 . . . 1 2
159 1 . . . 1 2
160 1 . . . 1 2
161 1 . . . 1 2
162 1 . . . 1 2
163 1 . . . 1 2
164 1 . . . 1 2
165 1 . . . 1 2
166 1 . . . 1 2
167 1 . . . 1 2
168 1 . . . 1 2
169 1 . . . 1 2
170 1 . . . 1 2
171 1 . . . 1 2
172 1 . . . 1 2
173 1 . . . 1 2
174 1 . . . 1 2
175 1 . . . 1 2
176 1 . . . 1 2
177 1 . . . 1 2
178 1 . . . 1 2
179 1 . . . 1 2
180 1 . . . 1 2
181 1 . . . 1 2
182 1 . . . 1 2
183 1 . . . 1 2
184 1 . . . 1 2
185 1 . . . 1 2
186 1 . . . 1 2
187 1 . . . 1 2
188 1 . . . 1 2
189 1 . . . 1 2
190 1 . . . 1 2
191 1 . . . 1 2
192 1 . . . 1 2
193 1 . . . 1 2
194 1 . . . 1 2
195 1 . . . 1 2
196 1 . . . 1 2
197 1 . . . 1 2
198 1 . . . 1 2
199 1 . . . 1 2
200 1 . . . 1 2
201 1 . . . 1 2
202 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 4 SER HA . 4 . HA 1 2
1 1 2 1 1 5 THR H . 5 . HN 1 2
2 1 1 1 1 5 THR MG . 5 . HG2# 1 2
2 1 2 1 1 6 SER H . 6 . HN 1 2
3 1 1 1 1 7 GLU H . 7 . HN 1 2
3 1 2 1 1 7 GLU HB2 . 7 . HB2 1 2
4 1 1 1 1 7 GLU QG . 7 . HG# 1 2
4 1 2 1 1 8 LEU H . 8 . HN 1 2
5 1 1 1 1 8 LEU H . 8 . HN 1 2
5 1 2 1 1 9 LYS H . 9 . HN 1 2
6 1 1 1 1 8 LEU HA . 8 . HA 1 2
6 1 2 1 1 9 LYS H . 9 . HN 1 2
7 1 1 1 1 9 LYS QB . 9 . HB# 1 2
7 1 2 1 1 9 LYS QE . 9 . HE# 1 2
8 1 1 1 1 9 LYS H . 9 . HN 1 2
8 1 2 1 1 35 ILE MG . 35 . HG2# 1 2
9 1 1 1 1 10 LYS HA . 10 . HA 1 2
9 1 2 1 1 10 LYS QG . 10 . HG# 1 2
10 1 1 1 1 10 LYS HA . 10 . HA 1 2
10 1 2 1 1 11 VAL QG . 11 . HG# 1 2
11 1 1 1 1 10 LYS HA . 10 . HA 1 2
11 1 2 1 1 34 PHE HA . 34 . HA 1 2
12 1 1 1 1 10 LYS HA . 10 . HA 1 2
12 1 2 1 1 34 PHE QD . 34 . HD# 1 2
13 1 1 1 1 10 LYS QB . 10 . HB# 1 2
13 1 2 1 1 34 PHE QE . 34 . HE# 1 2
14 1 1 1 1 11 VAL H . 11 . HN 1 2
14 1 2 1 1 11 VAL QG . 11 . HG# 1 2
15 1 1 1 1 11 VAL HA . 11 . HA 1 2
15 1 2 1 1 11 VAL HB . 11 . HB 1 2
16 1 1 1 1 11 VAL HA . 11 . HA 1 2
16 1 2 1 1 63 GLU HA . 63 . HA 1 2
17 1 1 1 1 11 VAL QG . 11 . HG# 1 2
17 1 2 1 1 63 GLU QG . 63 . HG# 1 2
18 1 1 1 1 11 VAL HA . 11 . HA 1 2
18 1 2 1 1 64 ALA H . 64 . HN 1 2
19 1 1 1 1 11 VAL HA . 11 . HA 1 2
19 1 2 1 1 64 ALA MB . 64 . HB# 1 2
20 1 1 1 1 12 VAL H . 12 . HN 1 2
20 1 2 1 1 12 VAL MG2 . 12 . HG2# 1 2
21 1 1 1 1 12 VAL H . 12 . HN 1 2
21 1 2 1 1 12 VAL MG1 . 12 . HG1# 1 2
22 1 1 1 1 12 VAL HA . 12 . HA 1 2
22 1 2 1 1 12 VAL HB . 12 . HB 1 2
23 1 1 1 1 12 VAL HA . 12 . HA 1 2
23 1 2 1 1 12 VAL MG1 . 12 . HG1# 1 2
24 1 1 1 1 12 VAL HA . 12 . HA 1 2
24 1 2 1 1 12 VAL MG2 . 12 . HG2# 1 2
25 1 1 1 1 12 VAL MG1 . 12 . HG1# 1 2
25 1 2 1 1 13 ALA H . 13 . HN 1 2
26 1 1 1 1 12 VAL MG2 . 12 . HG2# 1 2
26 1 2 1 1 13 ALA H . 13 . HN 1 2
27 1 1 1 1 12 VAL HA . 12 . HA 1 2
27 1 2 1 1 32 GLU HB2 . 32 . HB2 1 2
28 1 1 1 1 12 VAL HA . 12 . HA 1 2
28 1 2 1 1 33 TYR H . 33 . HN 1 2
29 1 1 1 1 12 VAL HA . 12 . HA 1 2
29 1 2 1 1 33 TYR QE . 33 . HE# 1 2
30 1 1 1 1 12 VAL H . 12 . HN 1 2
30 1 2 1 1 61 VAL HB . 61 . HB 1 2
31 1 1 1 1 12 VAL H . 12 . HN 1 2
31 1 2 1 1 62 THR H . 62 . HN 1 2
32 1 1 1 1 12 VAL H . 12 . HN 1 2
32 1 2 1 1 63 GLU HA . 63 . HA 1 2
33 1 1 1 1 14 LEU HA . 14 . HA 1 2
33 1 2 1 1 14 LEU QD . 14 . HD# 1 2
34 1 1 1 1 14 LEU HA . 14 . HA 1 2
34 1 2 1 1 15 TYR H . 15 . HN 1 2
35 1 1 1 1 14 LEU HA . 14 . HA 1 2
35 1 2 1 1 30 GLY H . 30 . HN 1 2
36 1 1 1 1 14 LEU HG . 14 . HG 1 2
36 1 2 1 1 61 VAL HA . 61 . HA 1 2
37 1 1 1 1 14 LEU H . 14 . HN 1 2
37 1 2 1 1 62 THR H . 62 . HN 1 2
38 1 1 1 1 17 TYR HA . 17 . HA 1 2
38 1 2 1 1 18 MET H . 18 . HN 1 2
39 1 1 1 1 17 TYR H . 17 . HN 1 2
39 1 2 1 1 27 LEU H . 27 . HN 1 2
40 1 1 1 1 17 TYR QB . 17 . HB# 1 2
40 1 2 1 1 27 LEU H . 27 . HN 1 2
41 1 1 1 1 17 TYR QD . 17 . HD# 1 2
41 1 2 1 1 27 LEU H . 27 . HN 1 2
42 1 1 1 1 17 TYR QD . 17 . HD# 1 2
42 1 2 1 1 27 LEU HB2 . 27 . HB2 1 2
43 1 1 1 1 17 TYR QD . 17 . HD# 1 2
43 1 2 1 1 27 LEU QD . 27 . HD# 1 2
44 1 1 1 1 18 MET HA . 18 . HA 1 2
44 1 2 1 1 19 PRO QD . 19 . HD# 1 2
45 1 1 1 1 20 MET H . 20 . HN 1 2
45 1 2 1 1 20 MET HB2 . 20 . HB2 1 2
46 1 1 1 1 20 MET H . 20 . HN 1 2
46 1 2 1 1 21 ASN H . 21 . HN 1 2
47 1 1 1 1 20 MET HB2 . 20 . HB2 1 2
47 1 2 1 1 21 ASN H . 21 . HN 1 2
48 1 1 1 1 20 MET H . 20 . HN 1 2
48 1 2 1 1 24 ASP QB . 24 . HB# 1 2
49 1 1 1 1 21 ASN H . 21 . HN 1 2
49 1 2 1 1 21 ASN QD . 21 . HD2# 1 2
50 1 1 1 1 22 ALA MB . 22 . HB# 1 2
50 1 2 1 1 23 ASN QD . 23 . HD2# 1 2
51 1 1 1 1 23 ASN H . 23 . HN 1 2
51 1 2 1 1 24 ASP H . 24 . HN 1 2
52 1 1 1 1 23 ASN HA . 23 . HA 1 2
52 1 2 1 1 24 ASP H . 24 . HN 1 2
53 1 1 1 1 24 ASP HA . 24 . HA 1 2
53 1 2 1 1 54 GLY QA . 54 . HA# 1 2
54 1 1 1 1 25 LEU QB . 25 . HB# 1 2
54 1 2 1 1 27 LEU QD . 27 . HD# 1 2
55 1 1 1 1 25 LEU QD . 25 . HD# 1 2
55 1 2 1 1 27 LEU QD . 27 . HD# 1 2
56 1 1 1 1 25 LEU QD . 25 . HD# 1 2
56 1 2 1 1 47 ARG HA . 47 . HA 1 2
57 1 1 1 1 25 LEU QD . 25 . HD# 1 2
57 1 2 1 1 53 GLU HA . 53 . HA 1 2
58 1 1 1 1 25 LEU H . 25 . HN 1 2
58 1 2 1 1 55 TYR H . 55 . HN 1 2
59 1 1 1 1 26 GLN H . 26 . HN 1 2
59 1 2 1 1 26 GLN QB . 26 . HB# 1 2
60 1 1 1 1 26 GLN QB . 26 . HB# 1 2
60 1 2 1 1 27 LEU H . 27 . HN 1 2
61 1 1 1 1 27 LEU HA . 27 . HA 1 2
61 1 2 1 1 27 LEU QD . 27 . HD# 1 2
62 1 1 1 1 27 LEU QD . 27 . HD# 1 2
62 1 2 1 1 56 ILE QG . 56 . HG1# 1 2
63 1 1 1 1 27 LEU QD . 27 . HD# 1 2
63 1 2 1 1 56 ILE MG . 56 . HG2# 1 2
64 1 1 1 1 27 LEU QD . 27 . HD# 1 2
64 1 2 1 1 56 ILE MD . 56 . HD1# 1 2
65 1 1 1 1 27 LEU QD . 27 . HD# 1 2
65 1 2 1 1 60 TYR HB3 . 60 . HB1 1 2
66 1 1 1 1 27 LEU QD . 27 . HD# 1 2
66 1 2 1 1 61 VAL QG . 61 . HG# 1 2
67 1 1 1 1 29 LYS HA . 29 . HA 1 2
67 1 2 1 1 29 LYS QG . 29 . HG# 1 2
68 1 1 1 1 32 GLU H . 32 . HN 1 2
68 1 2 1 1 32 GLU HB2 . 32 . HB2 1 2
69 1 1 1 1 32 GLU HA . 32 . HA 1 2
69 1 2 1 1 32 GLU QG . 32 . HG# 1 2
70 1 1 1 1 33 TYR H . 33 . HN 1 2
70 1 2 1 1 33 TYR QD . 33 . HD# 1 2
71 1 1 1 1 34 PHE HA . 34 . HA 1 2
71 1 2 1 1 34 PHE HB3 . 34 . HB1 1 2
72 1 1 1 1 34 PHE HA . 34 . HA 1 2
72 1 2 1 1 35 ILE H . 35 . HN 1 2
73 1 1 1 1 34 PHE QD . 34 . HD# 1 2
73 1 2 1 1 35 ILE H . 35 . HN 1 2
74 1 1 1 1 34 PHE HA . 34 . HA 1 2
74 1 2 1 1 46 ALA MB . 46 . HB# 1 2
75 1 1 1 1 34 PHE H . 34 . HN 1 2
75 1 2 1 1 47 ARG H . 47 . HN 1 2
76 1 1 1 1 34 PHE QD . 34 . HD# 1 2
76 1 2 1 1 47 ARG QG . 47 . HG# 1 2
77 1 1 1 1 35 ILE HB . 35 . HB 1 2
77 1 2 1 1 35 ILE MD . 35 . HD1# 1 2
78 1 1 1 1 35 ILE MG . 35 . HG2# 1 2
78 1 2 1 1 36 LEU H . 36 . HN 1 2
79 1 1 1 1 35 ILE MG . 35 . HG2# 1 2
79 1 2 1 1 44 TRP HB3 . 44 . HB1 1 2
80 1 1 1 1 35 ILE MD . 35 . HD1# 1 2
80 1 2 1 1 44 TRP HB3 . 44 . HB1 1 2
81 1 1 1 1 35 ILE MG . 35 . HG2# 1 2
81 1 2 1 1 45 ARG H . 45 . HN 1 2
82 1 1 1 1 35 ILE HB . 35 . HB 1 2
82 1 2 1 1 46 ALA MB . 46 . HB# 1 2
83 1 1 1 1 35 ILE MD . 35 . HD1# 1 2
83 1 2 1 1 46 ALA HA . 46 . HA 1 2
84 1 1 1 1 36 LEU H . 36 . HN 1 2
84 1 2 1 1 45 ARG QB . 45 . HB# 1 2
85 1 1 1 1 36 LEU QB . 36 . HB# 1 2
85 1 2 1 1 45 ARG H . 45 . HN 1 2
86 1 1 1 1 36 LEU QB . 36 . HB# 1 2
86 1 2 1 1 46 ALA HA . 46 . HA 1 2
87 1 1 1 1 36 LEU QD . 36 . HD# 1 2
87 1 2 1 1 47 ARG HE . 47 . HE 1 2
88 1 1 1 1 37 GLU H . 37 . HN 1 2
88 1 2 1 1 45 ARG H . 45 . HN 1 2
89 1 1 1 1 38 GLU HA . 38 . HA 1 2
89 1 2 1 1 38 GLU QG . 38 . HG# 1 2
90 1 1 1 1 38 GLU HA . 38 . HA 1 2
90 1 2 1 1 44 TRP HD1 . 44 . HD1 1 2
91 1 1 1 1 39 SER HB2 . 39 . HB2 1 2
91 1 2 1 1 44 TRP HD1 . 44 . HD1 1 2
92 1 1 1 1 41 LEU QD . 41 . HD# 1 2
92 1 2 1 1 42 PRO QG . 42 . HG# 1 2
93 1 1 1 1 41 LEU QD . 41 . HD# 1 2
93 1 2 1 1 42 PRO QD . 42 . HD# 1 2
94 1 1 1 1 42 PRO QG . 42 . HG# 1 2
94 1 2 1 1 43 TRP HD1 . 43 . HD1 1 2
95 1 1 1 1 43 TRP HA . 43 . HA 1 2
95 1 2 1 1 43 TRP HB3 . 43 . HB1 1 2
96 1 1 1 1 43 TRP HA . 43 . HA 1 2
96 1 2 1 1 43 TRP HE3 . 43 . HE3 1 2
97 1 1 1 1 43 TRP HB3 . 43 . HB1 1 2
97 1 2 1 1 43 TRP HE3 . 43 . HE3 1 2
98 1 1 1 1 43 TRP HA . 43 . HA 1 2
98 1 2 1 1 57 PRO HA . 57 . HA 1 2
99 1 1 1 1 43 TRP HD1 . 43 . HD1 1 2
99 1 2 1 1 57 PRO HA . 57 . HA 1 2
100 1 1 1 1 43 TRP HE3 . 43 . HE3 1 2
100 1 2 1 1 57 PRO HA . 57 . HA 1 2
101 1 1 1 1 43 TRP HE3 . 43 . HE3 1 2
101 1 2 1 1 57 PRO QG . 57 . HG# 1 2
102 1 1 1 1 44 TRP H . 44 . HN 1 2
102 1 2 1 1 56 ILE H . 56 . HN 1 2
103 1 1 1 1 44 TRP H . 44 . HN 1 2
103 1 2 1 1 56 ILE MD . 56 . HD1# 1 2
104 1 1 1 1 45 ARG HA . 45 . HA 1 2
104 1 2 1 1 55 TYR HA . 55 . HA 1 2
105 1 1 1 1 47 ARG H . 47 . HN 1 2
105 1 2 1 1 47 ARG HB2 . 47 . HB2 1 2
106 1 1 1 1 47 ARG HA . 47 . HA 1 2
106 1 2 1 1 47 ARG HB3 . 47 . HB1 1 2
107 1 1 1 1 47 ARG HA . 47 . HA 1 2
107 1 2 1 1 47 ARG QG . 47 . HG# 1 2
108 1 1 1 1 47 ARG HB3 . 47 . HB1 1 2
108 1 2 1 1 48 ASP H . 48 . HN 1 2
109 1 1 1 1 47 ARG HA . 47 . HA 1 2
109 1 2 1 1 53 GLU HA . 53 . HA 1 2
110 1 1 1 1 47 ARG HA . 47 . HA 1 2
110 1 2 1 1 53 GLU QG . 53 . HG# 1 2
111 1 1 1 1 47 ARG HE . 47 . HE 1 2
111 1 2 1 1 53 GLU QG . 53 . HG# 1 2
112 1 1 1 1 47 ARG HE . 47 . HE 1 2
112 1 2 1 1 53 GLU QB . 53 . HB# 1 2
113 1 1 1 1 47 ARG HA . 47 . HA 1 2
113 1 2 1 1 54 GLY H . 54 . HN 1 2
114 1 1 1 1 48 ASP HA . 48 . HA 1 2
114 1 2 1 1 48 ASP HB2 . 48 . HB2 1 2
115 1 1 1 1 48 ASP H . 48 . HN 1 2
115 1 2 1 1 53 GLU HA . 53 . HA 1 2
116 1 1 1 1 50 ASN H . 50 . HN 1 2
116 1 2 1 1 51 GLY H . 51 . HN 1 2
117 1 1 1 1 50 ASN H . 50 . HN 1 2
117 1 2 1 1 52 GLN H . 52 . HN 1 2
118 1 1 1 1 51 GLY H . 51 . HN 1 2
118 1 2 1 1 52 GLN H . 52 . HN 1 2
119 1 1 1 1 53 GLU HA . 53 . HA 1 2
119 1 2 1 1 53 GLU QG . 53 . HG# 1 2
120 1 1 1 1 55 TYR HB3 . 55 . HB1 1 2
120 1 2 1 1 55 TYR QD . 55 . HD# 1 2
121 1 1 1 1 55 TYR HB3 . 55 . HB1 1 2
121 1 2 1 1 56 ILE H . 56 . HN 1 2
122 1 1 1 1 56 ILE H . 56 . HN 1 2
122 1 2 1 1 56 ILE HB . 56 . HB 1 2
123 1 1 1 1 60 TYR HB2 . 60 . HB2 1 2
123 1 2 1 1 61 VAL QG . 61 . HG# 1 2
124 1 1 1 1 61 VAL HA . 61 . HA 1 2
124 1 2 1 1 61 VAL HB . 61 . HB 1 2
125 1 1 1 1 63 GLU H . 63 . HN 1 2
125 1 2 1 1 64 ALA H . 64 . HN 1 2
126 1 1 1 1 64 ALA H . 64 . HN 1 2
126 1 2 1 1 65 GLU H . 65 . HN 1 2
127 1 1 1 1 65 GLU HA . 65 . HA 1 2
127 1 2 1 1 66 ASP H . 66 . HN 1 2
128 1 1 1 1 5 THR HA . 5 . HA 1 2
128 1 2 1 1 8 LEU QB . 8 . HB# 1 2
129 1 1 1 1 5 THR HA . 5 . HA 1 2
129 1 2 1 1 8 LEU QD . 8 . HD# 1 2
130 1 1 1 1 7 GLU HA . 7 . HA 1 2
130 1 2 1 1 7 GLU QG . 7 . HG# 1 2
131 1 1 1 1 8 LEU QD . 8 . HD# 1 2
131 1 2 1 1 35 ILE H . 35 . HN 1 2
132 1 1 1 1 8 LEU QD . 8 . HD# 1 2
132 1 2 1 1 36 LEU HA . 36 . HA 1 2
133 1 1 1 1 9 LYS QG . 9 . HG# 1 2
133 1 2 1 1 10 LYS QE . 10 . HE# 1 2
134 1 1 1 1 11 VAL QG . 11 . HG# 1 2
134 1 2 1 1 33 TYR HB2 . 33 . HB2 1 2
135 1 1 1 1 11 VAL QG . 11 . HG# 1 2
135 1 2 1 1 34 PHE HA . 34 . HA 1 2
136 1 1 1 1 11 VAL HA . 11 . HA 1 2
136 1 2 1 1 61 VAL HB . 61 . HB 1 2
137 1 1 1 1 11 VAL HA . 11 . HA 1 2
137 1 2 1 1 61 VAL QG . 61 . HG# 1 2
138 1 1 1 1 11 VAL QG . 11 . HG# 1 2
138 1 2 1 1 62 THR H . 62 . HN 1 2
139 1 1 1 1 11 VAL QG . 11 . HG# 1 2
139 1 2 1 1 63 GLU HA . 63 . HA 1 2
140 1 1 1 1 11 VAL H . 11 . HN 1 2
140 1 2 1 1 64 ALA HA . 64 . HA 1 2
141 1 1 1 1 12 VAL MG1 . 12 . HG1# 1 2
141 1 2 1 1 30 GLY QA . 30 . HA# 1 2
142 1 1 1 1 12 VAL MG2 . 12 . HG2# 1 2
142 1 2 1 1 30 GLY QA . 30 . HA# 1 2
143 1 1 1 1 12 VAL HA . 12 . HA 1 2
143 1 2 1 1 32 GLU HB3 . 32 . HB1 1 2
144 1 1 1 1 12 VAL MG1 . 12 . HG1# 1 2
144 1 2 1 1 32 GLU HA . 32 . HA 1 2
145 1 1 1 1 12 VAL MG2 . 12 . HG2# 1 2
145 1 2 1 1 32 GLU HA . 32 . HA 1 2
146 1 1 1 1 12 VAL MG1 . 12 . HG1# 1 2
146 1 2 1 1 32 GLU QG . 32 . HG# 1 2
147 1 1 1 1 12 VAL MG2 . 12 . HG2# 1 2
147 1 2 1 1 32 GLU QG . 32 . HG# 1 2
148 1 1 1 1 12 VAL HA . 12 . HA 1 2
148 1 2 1 1 33 TYR QD . 33 . HD# 1 2
149 1 1 1 1 13 ALA H . 13 . HN 1 2
149 1 2 1 1 33 TYR QD . 33 . HD# 1 2
150 1 1 1 1 13 ALA H . 13 . HN 1 2
150 1 2 1 1 61 VAL QG . 61 . HG# 1 2
151 1 1 1 1 13 ALA MB . 13 . HB# 1 2
151 1 2 1 1 61 VAL HA . 61 . HA 1 2
152 1 1 1 1 14 LEU QD . 14 . HD# 1 2
152 1 2 1 1 62 THR HB . 62 . HB 1 2
153 1 1 1 1 14 LEU QD . 14 . HD# 1 2
153 1 2 1 1 62 THR MG . 62 . HG2# 1 2
154 1 1 1 1 17 TYR HA . 17 . HA 1 2
154 1 2 1 1 17 TYR QD . 17 . HD# 1 2
155 1 1 1 1 17 TYR QB . 17 . HB# 1 2
155 1 2 1 1 27 LEU HB2 . 27 . HB2 1 2
156 1 1 1 1 17 TYR QB . 17 . HB# 1 2
156 1 2 1 1 27 LEU QD . 27 . HD# 1 2
157 1 1 1 1 18 MET HA . 18 . HA 1 2
157 1 2 1 1 19 PRO QG . 19 . HG# 1 2
158 1 1 1 1 18 MET HA . 18 . HA 1 2
158 1 2 1 1 26 GLN QG . 26 . HG# 1 2
159 1 1 1 1 19 PRO QB . 19 . HB# 1 2
159 1 2 1 1 22 ALA HA . 22 . HA 1 2
160 1 1 1 1 19 PRO QG . 19 . HG# 1 2
160 1 2 1 1 22 ALA HA . 22 . HA 1 2
161 1 1 1 1 19 PRO HA . 19 . HA 1 2
161 1 2 1 1 24 ASP QB . 24 . HB# 1 2
162 1 1 1 1 19 PRO QB . 19 . HB# 1 2
162 1 2 1 1 24 ASP QB . 24 . HB# 1 2
163 1 1 1 1 23 ASN HA . 23 . HA 1 2
163 1 2 1 1 23 ASN HB2 . 23 . HB2 1 2
164 1 1 1 1 23 ASN HB3 . 23 . HB1 1 2
164 1 2 1 1 24 ASP HA . 24 . HA 1 2
165 1 1 1 1 24 ASP HA . 24 . HA 1 2
165 1 2 1 1 55 TYR QB . 55 . HB# 1 2
166 1 1 1 1 25 LEU QD . 25 . HD# 1 2
166 1 2 1 1 46 ALA HA . 46 . HA 1 2
167 1 1 1 1 25 LEU QD . 25 . HD# 1 2
167 1 2 1 1 46 ALA MB . 46 . HB# 1 2
168 1 1 1 1 25 LEU QD . 25 . HD# 1 2
168 1 2 1 1 47 ARG HB3 . 47 . HB1 1 2
169 1 1 1 1 25 LEU QD . 25 . HD# 1 2
169 1 2 1 1 48 ASP HB2 . 48 . HB2 1 2
170 1 1 1 1 25 LEU QB . 25 . HB# 1 2
170 1 2 1 1 54 GLY QA . 54 . HA# 1 2
171 1 1 1 1 25 LEU QD . 25 . HD# 1 2
171 1 2 1 1 54 GLY QA . 54 . HA# 1 2
172 1 1 1 1 25 LEU QB . 25 . HB# 1 2
172 1 2 1 1 55 TYR HA . 55 . HA 1 2
173 1 1 1 1 25 LEU QD . 25 . HD# 1 2
173 1 2 1 1 55 TYR HA . 55 . HA 1 2
174 1 1 1 1 27 LEU QD . 27 . HD# 1 2
174 1 2 1 1 57 PRO QD . 57 . HD# 1 2
175 1 1 1 1 31 ASP QB . 31 . HB# 1 2
175 1 2 1 1 33 TYR QE . 33 . HE# 1 2
176 1 1 1 1 32 GLU HA . 32 . HA 1 2
176 1 2 1 1 32 GLU HB3 . 32 . HB1 1 2
177 1 1 1 1 33 TYR QD . 33 . HD# 1 2
177 1 2 1 1 56 ILE MG . 56 . HG2# 1 2
178 1 1 1 1 33 TYR QD . 33 . HD# 1 2
178 1 2 1 1 61 VAL QG . 61 . HG# 1 2
179 1 1 1 1 33 TYR QE . 33 . HE# 1 2
179 1 2 1 1 61 VAL QG . 61 . HG# 1 2
180 1 1 1 1 34 PHE HB3 . 34 . HB1 1 2
180 1 2 1 1 47 ARG H . 47 . HN 1 2
181 1 1 1 1 35 ILE MG . 35 . HG2# 1 2
181 1 2 1 1 37 GLU H . 37 . HN 1 2
182 1 1 1 1 35 ILE MG . 35 . HG2# 1 2
182 1 2 1 1 46 ALA MB . 46 . HB# 1 2
183 1 1 1 1 35 ILE HA . 35 . HA 1 2
183 1 2 1 1 46 ALA MB . 46 . HB# 1 2
184 1 1 1 1 36 LEU HA . 36 . HA 1 2
184 1 2 1 1 37 GLU H . 37 . HN 1 2
185 1 1 1 1 36 LEU QD . 36 . HD# 1 2
185 1 2 1 1 53 GLU QG . 53 . HG# 1 2
186 1 1 1 1 41 LEU HB2 . 41 . HB2 1 2
186 1 2 1 1 42 PRO QG . 42 . HG# 1 2
187 1 1 1 1 41 LEU HB2 . 41 . HB2 1 2
187 1 2 1 1 42 PRO QD . 42 . HD# 1 2
188 1 1 1 1 44 TRP HB3 . 44 . HB1 1 2
188 1 2 1 1 44 TRP HE3 . 44 . HE3 1 2
189 1 1 1 1 44 TRP HD1 . 44 . HD1 1 2
189 1 2 1 1 45 ARG H . 45 . HN 1 2
190 1 1 1 1 44 TRP HE3 . 44 . HE3 1 2
190 1 2 1 1 46 ALA MB . 46 . HB# 1 2
191 1 1 1 1 44 TRP HB2 . 44 . HB2 1 2
191 1 2 1 1 56 ILE MG . 56 . HG2# 1 2
192 1 1 1 1 45 ARG HA . 45 . HA 1 2
192 1 2 1 1 45 ARG QG . 45 . HG# 1 2
193 1 1 1 1 47 ARG HB3 . 47 . HB1 1 2
193 1 2 1 1 47 ARG QD . 47 . HD# 1 2
194 1 1 1 1 49 LYS HA . 49 . HA 1 2
194 1 2 1 1 49 LYS QE . 49 . HE# 1 2
195 1 1 1 1 56 ILE HA . 56 . HA 1 2
195 1 2 1 1 56 ILE QG . 56 . HG1# 1 2
196 1 1 1 1 56 ILE MD . 56 . HD1# 1 2
196 1 2 1 1 56 ILE MG . 56 . HG2# 1 2
197 1 1 1 1 56 ILE MG . 56 . HG2# 1 2
197 1 2 1 1 58 SER HA . 58 . HA 1 2
198 1 1 1 1 56 ILE QG . 56 . HG1# 1 2
198 1 2 1 1 61 VAL QG . 61 . HG# 1 2
199 1 1 1 1 56 ILE MG . 56 . HG2# 1 2
199 1 2 1 1 61 VAL QG . 61 . HG# 1 2
200 1 1 1 1 58 SER HA . 58 . HA 1 2
200 1 2 1 1 61 VAL QG . 61 . HG# 1 2
201 1 1 1 1 61 VAL HA . 61 . HA 1 2
201 1 2 1 1 62 THR MG . 62 . HG2# 1 2
202 1 1 1 1 65 GLU HA . 65 . HA 1 2
202 1 2 1 1 65 GLU HB3 . 65 . HB1 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 . . . . . 5.0 0.0 5.0 1 2
2 1 . . . . . 5.0 0.0 5.4 1 2
3 1 . . . . . 3.5 0.0 3.5 1 2
4 1 . . . . . 5.0 0.0 5.7 1 2
5 1 . . . . . 5.0 0.0 5.0 1 2
6 1 . . . . . 2.8 0.0 2.8 1 2
7 1 . . . . . 3.5 0.0 4.9 1 2
8 1 . . . . . 5.0 0.0 5.4 1 2
9 1 . . . . . 3.5 0.0 4.2 1 2
10 1 . . . . . 5.0 0.0 6.5 1 2
11 1 . . . . . 3.5 0.0 3.5 1 2
12 1 . . . . . 5.0 0.0 7.0 1 2
13 1 . . . . . 5.0 0.0 7.7 1 2
14 1 . . . . . 3.5 0.0 5.0 1 2
15 1 . . . . . 2.8 0.0 2.8 1 2
16 1 . . . . . 2.8 0.0 2.8 1 2
17 1 . . . . . 5.0 0.0 7.2 1 2
18 1 . . . . . 2.8 0.0 2.8 1 2
19 1 . . . . . 5.0 0.0 5.4 1 2
20 1 . . . . . 3.5 0.0 3.9 1 2
21 1 . . . . . 3.5 0.0 3.9 1 2
22 1 . . . . . 2.8 0.0 2.8 1 2
23 1 . . . . . 3.5 0.0 3.9 1 2
24 1 . . . . . 3.5 0.0 3.9 1 2
25 1 . . . . . 3.5 0.0 3.9 1 2
26 1 . . . . . 3.5 0.0 3.9 1 2
27 1 . . . . . 3.5 0.0 3.5 1 2
28 1 . . . . . 3.5 0.0 3.5 1 2
29 1 . . . . . 5.0 0.0 7.0 1 2
30 1 . . . . . 3.5 0.0 3.5 1 2
31 1 . . . . . 3.5 0.0 3.5 1 2
32 1 . . . . . 3.5 0.0 3.5 1 2
33 1 . . . . . 3.5 0.0 5.0 1 2
34 1 . . . . . 3.5 0.0 3.5 1 2
35 1 . . . . . 5.0 0.0 5.0 1 2
36 1 . . . . . 3.5 0.0 3.5 1 2
37 1 . . . . . 5.0 0.0 5.0 1 2
38 1 . . . . . 2.8 0.0 2.8 1 2
39 1 . . . . . 5.0 0.0 5.0 1 2
40 1 . . . . . 3.5 0.0 4.2 1 2
41 1 . . . . . 5.0 0.0 7.0 1 2
42 1 . . . . . 5.0 0.0 7.0 1 2
43 1 . . . . . 5.0 0.0 8.5 1 2
44 1 . . . . . 3.5 0.0 4.2 1 2
45 1 . . . . . 3.5 0.0 3.5 1 2
46 1 . . . . . 3.5 0.0 3.5 1 2
47 1 . . . . . 3.5 0.0 3.5 1 2
48 1 . . . . . 5.0 0.0 5.7 1 2
49 1 . . . . . 5.0 0.0 5.7 1 2
50 1 . . . . . 5.0 0.0 6.1 1 2
51 1 . . . . . 3.5 0.0 3.5 1 2
52 1 . . . . . 3.5 0.0 3.5 1 2
53 1 . . . . . 5.0 0.0 5.7 1 2
54 1 . . . . . 3.5 0.0 5.7 1 2
55 1 . . . . . 5.0 0.0 8.0 1 2
56 1 . . . . . 5.0 0.0 5.0 1 2
57 1 . . . . . 5.0 0.0 6.5 1 2
58 1 . . . . . 3.5 0.0 3.5 1 2
59 1 . . . . . 3.5 0.0 4.2 1 2
60 1 . . . . . 5.0 0.0 5.7 1 2
61 1 . . . . . 3.5 0.0 5.0 1 2
62 1 . . . . . 5.0 0.0 7.2 1 2
63 1 . . . . . 5.0 0.0 6.9 1 2
64 1 . . . . . 5.0 0.0 6.9 1 2
65 1 . . . . . 5.0 0.0 6.5 1 2
66 1 . . . . . 5.0 0.0 8.0 1 2
67 1 . . . . . 3.5 0.0 4.2 1 2
68 1 . . . . . 2.8 0.0 2.8 1 2
69 1 . . . . . 3.5 0.0 4.2 1 2
70 1 . . . . . 3.5 0.0 5.5 1 2
71 1 . . . . . 2.8 0.0 2.8 1 2
72 1 . . . . . 2.8 0.0 2.8 1 2
73 1 . . . . . 5.0 0.0 7.0 1 2
74 1 . . . . . 5.0 0.0 5.4 1 2
75 1 . . . . . 3.5 0.0 3.5 1 2
76 1 . . . . . 5.0 0.0 7.7 1 2
77 1 . . . . . 3.5 0.0 3.9 1 2
78 1 . . . . . 5.0 0.0 5.4 1 2
79 1 . . . . . 5.0 0.0 5.4 1 2
80 1 . . . . . 5.0 0.0 5.4 1 2
81 1 . . . . . 5.0 0.0 5.4 1 2
82 1 . . . . . 5.0 0.0 5.4 1 2
83 1 . . . . . 5.0 0.0 5.4 1 2
84 1 . . . . . 5.0 0.0 5.7 1 2
85 1 . . . . . 5.0 0.0 5.7 1 2
86 1 . . . . . 3.5 0.0 4.2 1 2
87 1 . . . . . 5.0 0.0 6.5 1 2
88 1 . . . . . 3.5 0.0 3.5 1 2
89 1 . . . . . 3.5 0.0 4.2 1 2
90 1 . . . . . 3.5 0.0 3.5 1 2
91 1 . . . . . 3.5 0.0 3.5 1 2
92 1 . . . . . 5.0 0.0 7.2 1 2
93 1 . . . . . 5.0 0.0 7.2 1 2
94 1 . . . . . 5.0 0.0 5.7 1 2
95 1 . . . . . 2.8 0.0 2.8 1 2
96 1 . . . . . 3.5 0.0 3.5 1 2
97 1 . . . . . 2.8 0.0 2.8 1 2
98 1 . . . . . 2.8 0.0 2.8 1 2
99 1 . . . . . 5.0 0.0 5.0 1 2
100 1 . . . . . 5.0 0.0 5.0 1 2
101 1 . . . . . 3.5 0.0 4.2 1 2
102 1 . . . . . 3.5 0.0 3.5 1 2
103 1 . . . . . 5.0 0.0 5.4 1 2
104 1 . . . . . 2.8 0.0 2.8 1 2
105 1 . . . . . 3.5 0.0 3.5 1 2
106 1 . . . . . 2.8 0.0 2.8 1 2
107 1 . . . . . 3.5 0.0 4.2 1 2
108 1 . . . . . 3.5 0.0 3.5 1 2
109 1 . . . . . 2.8 0.0 2.8 1 2
110 1 . . . . . 5.0 0.0 5.7 1 2
111 1 . . . . . 5.0 0.0 5.7 1 2
112 1 . . . . . 5.0 0.0 5.7 1 2
113 1 . . . . . 3.5 0.0 3.5 1 2
114 1 . . . . . 2.8 0.0 2.8 1 2
115 1 . . . . . 5.0 0.0 5.0 1 2
116 1 . . . . . 2.8 0.0 2.8 1 2
117 1 . . . . . 3.5 0.0 3.5 1 2
118 1 . . . . . 2.8 0.0 2.8 1 2
119 1 . . . . . 3.5 0.0 4.2 1 2
120 1 . . . . . 2.8 0.0 4.8 1 2
121 1 . . . . . 3.5 0.0 3.5 1 2
122 1 . . . . . 3.5 0.0 3.5 1 2
123 1 . . . . . 5.0 0.0 6.5 1 2
124 1 . . . . . 2.8 0.0 2.8 1 2
125 1 . . . . . 5.0 0.0 5.0 1 2
126 1 . . . . . 5.0 0.0 5.0 1 2
127 1 . . . . . 5.0 0.0 5.0 1 2
128 1 . . . . . 5.0 0.0 5.7 1 2
129 1 . . . . . 5.0 0.0 6.5 1 2
130 1 . . . . . 3.5 0.0 4.2 1 2
131 1 . . . . . 5.0 0.0 6.5 1 2
132 1 . . . . . 5.0 0.0 6.5 1 2
133 1 . . . . . 5.0 0.0 6.4 1 2
134 1 . . . . . 5.0 0.0 6.5 1 2
135 1 . . . . . 5.0 0.0 6.5 1 2
136 1 . . . . . 5.0 0.0 5.0 1 2
137 1 . . . . . 5.0 0.0 6.5 1 2
138 1 . . . . . 5.0 0.0 6.5 1 2
139 1 . . . . . 5.0 0.0 6.5 1 2
140 1 . . . . . 3.5 0.0 3.5 1 2
141 1 . . . . . 5.0 0.0 6.1 1 2
142 1 . . . . . 5.0 0.0 6.1 1 2
143 1 . . . . . 3.5 0.0 3.5 1 2
144 1 . . . . . 5.0 0.0 5.4 1 2
145 1 . . . . . 5.0 0.0 5.4 1 2
146 1 . . . . . 3.5 0.0 4.6 1 2
147 1 . . . . . 3.5 0.0 4.6 1 2
148 1 . . . . . 3.5 0.0 5.5 1 2
149 1 . . . . . 5.0 0.0 7.0 1 2
150 1 . . . . . 5.0 0.0 6.5 1 2
151 1 . . . . . 5.0 0.0 5.4 1 2
152 1 . . . . . 3.5 0.0 5.0 1 2
153 1 . . . . . 3.5 0.0 5.4 1 2
154 1 . . . . . 3.5 0.0 5.5 1 2
155 1 . . . . . 5.0 0.0 5.7 1 2
156 1 . . . . . 5.0 0.0 7.2 1 2
157 1 . . . . . 3.5 0.0 4.2 1 2
158 1 . . . . . 5.0 0.0 5.7 1 2
159 1 . . . . . 3.5 0.0 4.2 1 2
160 1 . . . . . 5.0 0.0 5.7 1 2
161 1 . . . . . 3.5 0.0 4.2 1 2
162 1 . . . . . 3.5 0.0 4.9 1 2
163 1 . . . . . 2.8 0.0 2.8 1 2
164 1 . . . . . 3.5 0.0 3.5 1 2
165 1 . . . . . 3.5 0.0 4.2 1 2
166 1 . . . . . 5.0 0.0 6.5 1 2
167 1 . . . . . 5.0 0.0 6.9 1 2
168 1 . . . . . 3.5 0.0 5.0 1 2
169 1 . . . . . 3.5 0.0 5.0 1 2
170 1 . . . . . 3.5 0.0 4.9 1 2
171 1 . . . . . 5.0 0.0 7.2 1 2
172 1 . . . . . 3.5 0.0 4.2 1 2
173 1 . . . . . 5.0 0.0 6.5 1 2
174 1 . . . . . 3.5 0.0 5.7 1 2
175 1 . . . . . 3.5 0.0 6.2 1 2
176 1 . . . . . 2.8 0.0 2.8 1 2
177 1 . . . . . 5.0 0.0 7.4 1 2
178 1 . . . . . 5.0 0.0 8.5 1 2
179 1 . . . . . 5.0 0.0 8.5 1 2
180 1 . . . . . 3.5 0.0 3.5 1 2
181 1 . . . . . 5.0 0.0 5.4 1 2
182 1 . . . . . 5.0 0.0 5.8 1 2
183 1 . . . . . 5.0 0.0 5.4 1 2
184 1 . . . . . 3.5 0.0 3.5 1 2
185 1 . . . . . 5.0 0.0 7.2 1 2
186 1 . . . . . 3.5 0.0 4.2 1 2
187 1 . . . . . 3.5 0.0 4.2 1 2
188 1 . . . . . 3.5 0.0 3.5 1 2
189 1 . . . . . 5.0 0.0 5.0 1 2
190 1 . . . . . 3.5 0.0 3.9 1 2
191 1 . . . . . 3.5 0.0 3.9 1 2
192 1 . . . . . 3.5 0.0 4.2 1 2
193 1 . . . . . 3.5 0.0 4.2 1 2
194 1 . . . . . 3.5 0.0 4.2 1 2
195 1 . . . . . 3.5 0.0 4.2 1 2
196 1 . . . . . 3.5 0.0 4.3 1 2
197 1 . . . . . 5.0 0.0 5.4 1 2
198 1 . . . . . 5.0 0.0 7.2 1 2
199 1 . . . . . 5.0 0.0 6.9 1 2
200 1 . . . . . 5.0 0.0 6.5 1 2
201 1 . . . . . 5.0 0.0 5.4 1 2
202 1 . . . . . 2.8 0.0 2.8 1 2
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 3
_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 3
2 1 . . . 1 3
3 1 . . . 1 3
4 1 . . . 1 3
5 1 . . . 1 3
6 1 . . . 1 3
7 1 . . . 1 3
8 1 . . . 1 3
9 1 . . . 1 3
10 1 . . . 1 3
11 1 . . . 1 3
12 1 . . . 1 3
13 1 . . . 1 3
14 1 . . . 1 3
15 1 . . . 1 3
16 1 . . . 1 3
17 1 . . . 1 3
18 1 . . . 1 3
19 1 . . . 1 3
20 1 . . . 1 3
21 1 . . . 1 3
22 1 . . . 1 3
23 1 . . . 1 3
24 1 . . . 1 3
25 1 . . . 1 3
26 1 . . . 1 3
27 1 . . . 1 3
28 1 . . . 1 3
29 1 . . . 1 3
30 1 . . . 1 3
31 1 . . . 1 3
32 1 . . . 1 3
33 1 . . . 1 3
34 1 . . . 1 3
35 1 . . . 1 3
36 1 . . . 1 3
37 1 . . . 1 3
38 1 . . . 1 3
39 1 . . . 1 3
40 1 . . . 1 3
41 1 . . . 1 3
42 1 . . . 1 3
43 1 . . . 1 3
44 1 . . . 1 3
45 1 . . . 1 3
46 1 . . . 1 3
47 1 . . . 1 3
48 1 . . . 1 3
49 1 . . . 1 3
50 1 . . . 1 3
51 1 . . . 1 3
52 1 . . . 1 3
53 1 . . . 1 3
54 1 . . . 1 3
55 1 . . . 1 3
56 1 . . . 1 3
57 1 . . . 1 3
58 1 . . . 1 3
59 1 . . . 1 3
60 1 . . . 1 3
61 1 . . . 1 3
62 1 . . . 1 3
63 1 . . . 1 3
64 1 . . . 1 3
65 1 . . . 1 3
66 1 . . . 1 3
67 1 . . . 1 3
68 1 . . . 1 3
69 1 . . . 1 3
70 1 . . . 1 3
71 1 . . . 1 3
72 1 . . . 1 3
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 12 VAL HA . 12 . HA 1 3
1 1 2 1 1 32 GLU QG . 32 . HG# 1 3
2 1 1 1 1 14 LEU HB2 . 14 . HB2 1 3
2 1 2 1 1 15 TYR QD . 15 . HD# 1 3
3 1 1 1 1 14 LEU QD . 14 . HD# 1 3
3 1 2 1 1 15 TYR QD . 15 . HD# 1 3
4 1 1 1 1 15 TYR QD . 15 . HD# 1 3
4 1 2 1 1 60 TYR HA . 60 . HA 1 3
5 1 1 1 1 15 TYR QD . 15 . HD# 1 3
5 1 2 1 1 60 TYR HB3 . 60 . HB1 1 3
6 1 1 1 1 15 TYR QD . 15 . HD# 1 3
6 1 2 1 1 60 TYR QD . 60 . HD# 1 3
7 1 1 1 1 15 TYR QD . 15 . HD# 1 3
7 1 2 1 1 60 TYR QE . 60 . HE# 1 3
8 1 1 1 1 16 ASP HB3 . 16 . HB1 1 3
8 1 2 1 1 17 TYR HA . 17 . HA 1 3
9 1 1 1 1 17 TYR QD . 17 . HD# 1 3
9 1 2 1 1 19 PRO HA . 19 . HA 1 3
10 1 1 1 1 17 TYR QD . 17 . HD# 1 3
10 1 2 1 1 26 GLN HA . 26 . HA 1 3
11 1 1 1 1 17 TYR QD . 17 . HD# 1 3
11 1 2 1 1 27 LEU HG . 27 . HG 1 3
12 1 1 1 1 17 TYR QB . 17 . HB# 1 3
12 1 2 1 1 60 TYR QD . 60 . HD# 1 3
13 1 1 1 1 32 GLU HA . 32 . HA 1 3
13 1 2 1 1 33 TYR QD . 33 . HD# 1 3
14 1 1 1 1 32 GLU HA . 32 . HA 1 3
14 1 2 1 1 33 TYR QE . 33 . HE# 1 3
15 1 1 1 1 33 TYR HA . 33 . HA 1 3
15 1 2 1 1 33 TYR QE . 33 . HE# 1 3
16 1 1 1 1 33 TYR HB3 . 33 . HB1 1 3
16 1 2 1 1 33 TYR QD . 33 . HD# 1 3
17 1 1 1 1 33 TYR HA . 33 . HA 1 3
17 1 2 1 1 48 ASP HA . 48 . HA 1 3
18 1 1 1 1 33 TYR QD . 33 . HD# 1 3
18 1 2 1 1 48 ASP HA . 48 . HA 1 3
19 1 1 1 1 33 TYR QD . 33 . HD# 1 3
19 1 2 1 1 48 ASP HB3 . 48 . HB1 1 3
20 1 1 1 1 33 TYR QE . 33 . HE# 1 3
20 1 2 1 1 48 ASP HA . 48 . HA 1 3
21 1 1 1 1 33 TYR QE . 33 . HE# 1 3
21 1 2 1 1 48 ASP HB3 . 48 . HB1 1 3
22 1 1 1 1 35 ILE HA . 35 . HA 1 3
22 1 2 1 1 46 ALA HA . 46 . HA 1 3
23 1 1 1 1 43 TRP HA . 43 . HA 1 3
23 1 2 1 1 43 TRP HD1 . 43 . HD1 1 3
24 1 1 1 1 43 TRP HB3 . 43 . HB1 1 3
24 1 2 1 1 43 TRP HD1 . 43 . HD1 1 3
25 1 1 1 1 44 TRP HB3 . 44 . HB1 1 3
25 1 2 1 1 44 TRP HD1 . 44 . HD1 1 3
26 1 1 1 1 10 LYS HB2 . 10 . HB2 1 3
26 1 2 1 1 34 PHE QE . 34 . HE# 1 3
27 1 1 1 1 10 LYS QG . 10 . HG# 1 3
27 1 2 1 1 34 PHE HA . 34 . HA 1 3
28 1 1 1 1 11 VAL HB . 11 . HB 1 3
28 1 2 1 1 61 VAL HA . 61 . HA 1 3
29 1 1 1 1 11 VAL HA . 11 . HA 1 3
29 1 2 1 1 63 GLU QG . 63 . HG# 1 3
30 1 1 1 1 12 VAL HB . 12 . HB 1 3
30 1 2 1 1 32 GLU HA . 32 . HA 1 3
31 1 1 1 1 12 VAL HA . 12 . HA 1 3
31 1 2 1 1 64 ALA MB . 64 . HB# 1 3
32 1 1 1 1 14 LEU QD . 14 . HD# 1 3
32 1 2 1 1 61 VAL HA . 61 . HA 1 3
33 1 1 1 1 17 TYR QE . 17 . HE# 1 3
33 1 2 1 1 19 PRO HA . 19 . HA 1 3
34 1 1 1 1 27 LEU HB2 . 27 . HB2 1 3
34 1 2 1 1 56 ILE HA . 56 . HA 1 3
35 1 1 1 1 27 LEU QD . 27 . HD# 1 3
35 1 2 1 1 56 ILE HA . 56 . HA 1 3
36 1 1 1 1 18 MET HA . 18 . HA 1 3
36 1 2 1 1 26 GLN HA . 26 . HA 1 3
37 1 1 1 1 18 MET HA . 18 . HA 1 3
37 1 2 1 1 26 GLN QB . 26 . HB# 1 3
38 1 1 1 1 18 MET HA . 18 . HA 1 3
38 1 2 1 1 27 LEU HB2 . 27 . HB2 1 3
39 1 1 1 1 20 MET HA . 20 . HA 1 3
39 1 2 1 1 20 MET QG . 20 . HG# 1 3
40 1 1 1 1 23 ASN HB3 . 23 . HB1 1 3
40 1 2 1 1 55 TYR HA . 55 . HA 1 3
41 1 1 1 1 28 ARG HA . 28 . HA 1 3
41 1 2 1 1 28 ARG QG . 28 . HG# 1 3
42 1 1 1 1 33 TYR HB3 . 33 . HB1 1 3
42 1 2 1 1 48 ASP HA . 48 . HA 1 3
43 1 1 1 1 17 TYR QE . 17 . HE# 1 3
43 1 2 1 1 56 ILE MD . 56 . HD1# 1 3
44 1 1 1 1 34 PHE HA . 34 . HA 1 3
44 1 2 1 1 34 PHE QD . 34 . HD# 1 3
45 1 1 1 1 35 ILE HA . 35 . HA 1 3
45 1 2 1 1 35 ILE MG . 35 . HG2# 1 3
46 1 1 1 1 35 ILE HA . 35 . HA 1 3
46 1 2 1 1 35 ILE MD . 35 . HD1# 1 3
47 1 1 1 1 35 ILE MG . 35 . HG2# 1 3
47 1 2 1 1 46 ALA HA . 46 . HA 1 3
48 1 1 1 1 36 LEU HA . 36 . HA 1 3
48 1 2 1 1 36 LEU QD . 36 . HD# 1 3
49 1 1 1 1 38 GLU HA . 38 . HA 1 3
49 1 2 1 1 44 TRP HA . 44 . HA 1 3
50 1 1 1 1 44 TRP HZ3 . 44 . HZ3 1 3
50 1 2 1 1 46 ALA MB . 46 . HB# 1 3
51 1 1 1 1 44 TRP HE3 . 44 . HE3 1 3
51 1 2 1 1 56 ILE MG . 56 . HG2# 1 3
52 1 1 1 1 44 TRP HE3 . 44 . HE3 1 3
52 1 2 1 1 61 VAL QG . 61 . HG# 1 3
53 1 1 1 1 47 ARG HB2 . 47 . HB2 1 3
53 1 2 1 1 53 GLU HA . 53 . HA 1 3
54 1 1 1 1 48 ASP HA . 48 . HA 1 3
54 1 2 1 1 49 LYS HA . 49 . HA 1 3
55 1 1 1 1 52 GLN HA . 52 . HA 1 3
55 1 2 1 1 52 GLN QG . 52 . HG# 1 3
56 1 1 1 1 56 ILE HA . 56 . HA 1 3
56 1 2 1 1 57 PRO QD . 57 . HD# 1 3
57 1 1 1 1 56 ILE MG . 56 . HG2# 1 3
57 1 2 1 1 61 VAL HA . 61 . HA 1 3
58 1 1 1 1 62 THR HA . 62 . HA 1 3
58 1 2 1 1 62 THR HB . 62 . HB 1 3
59 1 1 1 1 65 GLU HA . 65 . HA 1 3
59 1 2 1 1 65 GLU QG . 65 . HG# 1 3
60 1 1 1 1 13 ALA MB . 13 . HB# 1 3
60 1 2 1 1 33 TYR QD . 33 . HD# 1 3
61 1 1 1 1 13 ALA MB . 13 . HB# 1 3
61 1 2 1 1 33 TYR QE . 33 . HE# 1 3
62 1 1 1 1 27 LEU QD . 27 . HD# 1 3
62 1 2 1 1 33 TYR QD . 33 . HD# 1 3
63 1 1 1 1 27 LEU QD . 27 . HD# 1 3
63 1 2 1 1 33 TYR QE . 33 . HE# 1 3
64 1 1 1 1 33 TYR QD . 33 . HD# 1 3
64 1 2 1 1 46 ALA MB . 46 . HB# 1 3
65 1 1 1 1 33 TYR QE . 33 . HE# 1 3
65 1 2 1 1 46 ALA MB . 46 . HB# 1 3
66 1 1 1 1 33 TYR QD . 33 . HD# 1 3
66 1 2 1 1 48 ASP H . 48 . HN 1 3
67 1 1 1 1 33 TYR QE . 33 . HE# 1 3
67 1 2 1 1 49 LYS H . 49 . HN 1 3
68 1 1 1 1 38 GLU H . 38 . HN 1 3
68 1 2 1 1 41 LEU H . 41 . HN 1 3
69 1 1 1 1 41 LEU HA . 41 . HA 1 3
69 1 2 1 1 42 PRO QD . 42 . HD# 1 3
70 1 1 1 1 42 PRO HA . 42 . HA 1 3
70 1 2 1 1 43 TRP HD1 . 43 . HD1 1 3
71 1 1 1 1 43 TRP HZ3 . 43 . HZ3 1 3
71 1 2 1 1 56 ILE HA . 56 . HA 1 3
72 1 1 1 1 44 TRP H . 44 . HN 1 3
72 1 2 1 1 56 ILE MG . 56 . HG2# 1 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 3.5 0.0 4.2 1 3
2 1 . . . . . 3.5 0.0 5.5 1 3
3 1 . . . . . 5.0 0.0 8.5 1 3
4 1 . . . . . 5.0 0.0 7.0 1 3
5 1 . . . . . 5.0 0.0 7.0 1 3
6 1 . . . . . 5.0 0.0 9.0 1 3
7 1 . . . . . 5.0 0.0 9.0 1 3
8 1 . . . . . 5.0 0.0 5.0 1 3
9 1 . . . . . 5.0 0.0 7.0 1 3
10 1 . . . . . 5.0 0.0 7.0 1 3
11 1 . . . . . 5.0 0.0 7.0 1 3
12 1 . . . . . 5.0 0.0 7.7 1 3
13 1 . . . . . 5.0 0.0 7.0 1 3
14 1 . . . . . 5.0 0.0 7.0 1 3
15 1 . . . . . 5.0 0.0 7.0 1 3
16 1 . . . . . 2.8 0.0 4.8 1 3
17 1 . . . . . 3.5 0.0 3.5 1 3
18 1 . . . . . 3.5 0.0 5.5 1 3
19 1 . . . . . 3.5 0.0 5.5 1 3
20 1 . . . . . 3.5 0.0 5.5 1 3
21 1 . . . . . 3.5 0.0 5.5 1 3
22 1 . . . . . 2.8 0.0 2.8 1 3
23 1 . . . . . 5.0 0.0 5.0 1 3
24 1 . . . . . 3.5 0.0 3.5 1 3
25 1 . . . . . 3.5 0.0 3.5 1 3
26 1 . . . . . 3.5 0.0 5.5 1 3
27 1 . . . . . 5.0 0.0 5.7 1 3
28 1 . . . . . 5.0 0.0 5.0 1 3
29 1 . . . . . 5.0 0.0 5.7 1 3
30 1 . . . . . 5.0 0.0 5.0 1 3
31 1 . . . . . 5.0 0.0 5.4 1 3
32 1 . . . . . 5.0 0.0 6.5 1 3
33 1 . . . . . 3.5 0.0 5.5 1 3
34 1 . . . . . 5.0 0.0 5.0 1 3
35 1 . . . . . 5.0 0.0 6.5 1 3
36 1 . . . . . 5.0 0.0 5.0 1 3
37 1 . . . . . 5.0 0.0 5.7 1 3
38 1 . . . . . 5.0 0.0 5.0 1 3
39 1 . . . . . 3.5 0.0 4.2 1 3
40 1 . . . . . 5.0 0.0 5.7 1 3
41 1 . . . . . 3.5 0.0 4.2 1 3
42 1 . . . . . 5.0 0.0 5.0 1 3
43 1 . . . . . 5.0 0.0 7.4 1 3
44 1 . . . . . 3.5 0.0 5.5 1 3
45 1 . . . . . 3.5 0.0 3.9 1 3
46 1 . . . . . 3.5 0.0 3.9 1 3
47 1 . . . . . 5.0 0.0 5.4 1 3
48 1 . . . . . 3.5 0.0 5.0 1 3
49 1 . . . . . 5.0 0.0 5.0 1 3
50 1 . . . . . 5.0 0.0 5.4 1 3
51 1 . . . . . 5.0 0.0 5.4 1 3
52 1 . . . . . 5.0 0.0 6.5 1 3
53 1 . . . . . 5.0 0.0 5.0 1 3
54 1 . . . . . 5.0 0.0 5.0 1 3
55 1 . . . . . 3.5 0.0 4.2 1 3
56 1 . . . . . 3.5 0.0 4.2 1 3
57 1 . . . . . 5.0 0.0 5.4 1 3
58 1 . . . . . 2.8 0.0 2.8 1 3
59 1 . . . . . 3.5 0.0 4.2 1 3
60 1 . . . . . 5.0 0.0 7.4 1 3
61 1 . . . . . 3.5 0.0 5.9 1 3
62 1 . . . . . 5.0 0.0 8.5 1 3
63 1 . . . . . 5.0 0.0 8.5 1 3
64 1 . . . . . 5.0 0.0 7.4 1 3
65 1 . . . . . 5.0 0.0 7.4 1 3
66 1 . . . . . 5.0 0.0 7.0 1 3
67 1 . . . . . 5.0 0.0 7.0 1 3
68 1 . . . . . 6.0 0.0 6.0 1 3
69 1 . . . . . 5.0 0.0 5.7 1 3
70 1 . . . . . 6.0 0.0 6.0 1 3
71 1 . . . . . 5.0 0.0 5.7 1 3
72 1 . . . . . 5.0 0.0 5.4 1 3
stop_
save_
save_CNS/XPLOR_distance_constraints_7_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 4
_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 4
2 1 . . . 1 4
3 1 . . . 1 4
4 1 . . . 1 4
5 1 . . . 1 4
6 1 . . . 1 4
7 1 . . . 1 4
8 1 . . . 1 4
9 1 . . . 1 4
10 1 . . . 1 4
11 1 . . . 1 4
12 1 . . . 1 4
13 1 . . . 1 4
14 1 . . . 1 4
15 1 . . . 1 4
16 1 . . . 1 4
17 1 . . . 1 4
18 1 . . . 1 4
19 1 . . . 1 4
20 1 . . . 1 4
21 1 . . . 1 4
22 1 . . . 1 4
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 11 VAL O . 11 . O 1 4
1 1 2 1 1 33 TYR H . 33 . HN 1 4
2 1 1 1 1 11 VAL O . 11 . O 1 4
2 1 2 1 1 33 TYR N . 33 . N 1 4
3 1 1 1 1 11 VAL H . 11 . HN 1 4
3 1 2 1 1 33 TYR O . 33 . O 1 4
4 1 1 1 1 11 VAL N . 11 . N 1 4
4 1 2 1 1 33 TYR O . 33 . O 1 4
5 1 1 1 1 13 ALA H . 13 . HN 1 4
5 1 2 1 1 31 ASP O . 31 . O 1 4
6 1 1 1 1 13 ALA N . 13 . N 1 4
6 1 2 1 1 31 ASP O . 31 . O 1 4
7 1 1 1 1 12 VAL O . 12 . O 1 4
7 1 2 1 1 62 THR H . 62 . HN 1 4
8 1 1 1 1 12 VAL O . 12 . O 1 4
8 1 2 1 1 62 THR N . 62 . N 1 4
9 1 1 1 1 14 LEU H . 14 . HN 1 4
9 1 2 1 1 60 TYR O . 60 . O 1 4
10 1 1 1 1 14 LEU N . 14 . N 1 4
10 1 2 1 1 60 TYR O . 60 . O 1 4
11 1 1 1 1 34 PHE H . 34 . HN 1 4
11 1 2 1 1 47 ARG O . 47 . O 1 4
12 1 1 1 1 34 PHE N . 34 . N 1 4
12 1 2 1 1 47 ARG O . 47 . O 1 4
13 1 1 1 1 34 PHE O . 34 . O 1 4
13 1 2 1 1 47 ARG H . 47 . HN 1 4
14 1 1 1 1 34 PHE O . 34 . O 1 4
14 1 2 1 1 47 ARG N . 47 . N 1 4
15 1 1 1 1 48 ASP H . 48 . HN 1 4
15 1 2 1 1 52 GLN O . 52 . O 1 4
16 1 1 1 1 48 ASP N . 48 . N 1 4
16 1 2 1 1 52 GLN O . 52 . O 1 4
17 1 1 1 1 46 ALA O . 46 . O 1 4
17 1 2 1 1 54 GLY H . 54 . HN 1 4
18 1 1 1 1 46 ALA O . 46 . O 1 4
18 1 2 1 1 54 GLY N . 54 . N 1 4
19 1 1 1 1 44 TRP H . 44 . HN 1 4
19 1 2 1 1 56 ILE O . 56 . O 1 4
20 1 1 1 1 44 TRP N . 44 . N 1 4
20 1 2 1 1 56 ILE O . 56 . O 1 4
21 1 1 1 1 42 PRO O . 42 . O 1 4
21 1 2 1 1 58 SER H . 58 . HN 1 4
22 1 1 1 1 42 PRO O . 42 . O 1 4
22 1 2 1 1 58 SER N . 58 . N 1 4
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 1.8 2.4 1 4
2 1 . . . . . 2.8 2.6 3.2 1 4
3 1 . . . . . 2.0 1.8 2.4 1 4
4 1 . . . . . 2.8 2.6 3.2 1 4
5 1 . . . . . 2.0 1.8 2.4 1 4
6 1 . . . . . 2.8 2.6 3.2 1 4
7 1 . . . . . 2.0 1.8 2.4 1 4
8 1 . . . . . 2.8 2.6 3.2 1 4
9 1 . . . . . 2.0 1.8 2.4 1 4
10 1 . . . . . 2.8 2.6 3.2 1 4
11 1 . . . . . 2.0 1.8 2.4 1 4
12 1 . . . . . 2.8 2.6 3.2 1 4
13 1 . . . . . 2.0 1.8 2.4 1 4
14 1 . . . . . 2.8 2.6 3.2 1 4
15 1 . . . . . 2.0 1.8 2.4 1 4
16 1 . . . . . 2.8 2.6 3.2 1 4
17 1 . . . . . 2.0 1.8 2.4 1 4
18 1 . . . . . 2.8 2.6 3.2 1 4
19 1 . . . . . 2.0 1.8 2.4 1 4
20 1 . . . . . 2.8 2.6 3.2 1 4
21 1 . . . . . 2.0 1.8 2.4 1 4
22 1 . . . . . 2.8 2.6 3.2 1 4
stop_
save_
save_CNS/XPLOR_dihedral_6
_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 7 GLU N 1 1 7 GLU CA 1 1 7 GLU CB 1 1 7 GLU CG -89.99999 -30.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1
2 . 1 1 14 LEU N 1 1 14 LEU CA 1 1 14 LEU CB 1 1 14 LEU CG -89.99999 -30.0 . 14 . N . 14 . CA . 14 . CB . 14 . CG 1 1
3 . 1 1 15 TYR N 1 1 15 TYR CA 1 1 15 TYR CB 1 1 15 TYR CG -89.99999 -30.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1
4 . 1 1 16 ASP N 1 1 16 ASP CA 1 1 16 ASP CB 1 1 16 ASP CG -89.99999 -30.0 . 16 . N . 16 . CA . 16 . CB . 16 . CG 1 1
5 . 1 1 20 MET N 1 1 20 MET CA 1 1 20 MET CB 1 1 20 MET CG -89.99999 -30.0 . 20 . N . 20 . CA . 20 . CB . 20 . CG 1 1
6 . 1 1 23 ASN N 1 1 23 ASN CA 1 1 23 ASN CB 1 1 23 ASN CG -89.99999 -30.0 . 23 . N . 23 . CA . 23 . CB . 23 . CG 1 1
7 . 1 1 27 LEU N 1 1 27 LEU CA 1 1 27 LEU CB 1 1 27 LEU CG -89.99999 -30.0 . 27 . N . 27 . CA . 27 . CB . 27 . CG 1 1
8 . 1 1 32 GLU N 1 1 32 GLU CA 1 1 32 GLU CB 1 1 32 GLU CG -89.99999 -30.0 . 32 . N . 32 . CA . 32 . CB . 32 . CG 1 1
9 . 1 1 33 TYR N 1 1 33 TYR CA 1 1 33 TYR CB 1 1 33 TYR CG -89.99999 -30.0 . 33 . N . 33 . CA . 33 . CB . 33 . CG 1 1
10 . 1 1 34 PHE N 1 1 34 PHE CA 1 1 34 PHE CB 1 1 34 PHE CG -89.99999 -30.0 . 34 . N . 34 . CA . 34 . CB . 34 . CG 1 1
11 . 1 1 38 GLU N 1 1 38 GLU CA 1 1 38 GLU CB 1 1 38 GLU CG 30.0 89.99999 . 38 . N . 38 . CA . 38 . CB . 38 . CG 1 1
12 . 1 1 43 TRP N 1 1 43 TRP CA 1 1 43 TRP CB 1 1 43 TRP CG -89.99999 -30.0 . 43 . N . 43 . CA . 43 . CB . 43 . CG 1 1
13 . 1 1 44 TRP N 1 1 44 TRP CA 1 1 44 TRP CB 1 1 44 TRP CG -89.99999 -30.0 . 44 . N . 44 . CA . 44 . CB . 44 . CG 1 1
14 . 1 1 47 ARG N 1 1 47 ARG CA 1 1 47 ARG CB 1 1 47 ARG CG -89.99999 -30.0 . 47 . N . 47 . CA . 47 . CB . 47 . CG 1 1
15 . 1 1 48 ASP N 1 1 48 ASP CA 1 1 48 ASP CB 1 1 48 ASP CG 30.0 89.99999 . 48 . N . 48 . CA . 48 . CB . 48 . CG 1 1
16 . 1 1 50 ASN N 1 1 50 ASN CA 1 1 50 ASN CB 1 1 50 ASN CG -89.99999 -30.0 . 50 . N . 50 . CA . 50 . CB . 50 . CG 1 1
17 . 1 1 52 GLN N 1 1 52 GLN CA 1 1 52 GLN CB 1 1 52 GLN CG -89.99999 -30.0 . 52 . N . 52 . CA . 52 . CB . 52 . CG 1 1
18 . 1 1 55 TYR N 1 1 55 TYR CA 1 1 55 TYR CB 1 1 55 TYR CG -89.99999 -30.0 . 55 . N . 55 . CA . 55 . CB . 55 . CG 1 1
19 . 1 1 59 ASN N 1 1 59 ASN CA 1 1 59 ASN CB 1 1 59 ASN CG 30.0 89.99999 . 59 . N . 59 . CA . 59 . CB . 59 . CG 1 1
20 . 1 1 60 TYR N 1 1 60 TYR CA 1 1 60 TYR CB 1 1 60 TYR CG -105.0 -15.0 . 60 . N . 60 . CA . 60 . CB . 60 . CG 1 1
21 . 1 1 65 GLU N 1 1 65 GLU CA 1 1 65 GLU CB 1 1 65 GLU CG -105.0 -15.0 . 65 . N . 65 . CA . 65 . CB . 65 . CG 1 1
22 . 1 1 12 VAL N 1 1 12 VAL CA 1 1 12 VAL CB 1 1 12 VAL CG1 -225.0 -135.0 . 12 . N . 12 . CA . 12 . CB . 12 . CG1 1 1
23 . 1 1 9 LYS C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -179.99998 -60.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
24 . 1 1 10 LYS C 1 1 11 VAL N 1 1 11 VAL CA 1 1 11 VAL C -179.99998 -60.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
25 . 1 1 11 VAL C 1 1 12 VAL N 1 1 12 VAL CA 1 1 12 VAL C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
26 . 1 1 17 TYR C 1 1 18 MET N 1 1 18 MET CA 1 1 18 MET C -179.99998 -60.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1
27 . 1 1 19 PRO C 1 1 20 MET N 1 1 20 MET CA 1 1 20 MET C -179.99998 -60.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1
28 . 1 1 20 MET C 1 1 21 ASN N 1 1 21 ASN CA 1 1 21 ASN C -179.99998 -60.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1
29 . 1 1 22 ALA C 1 1 23 ASN N 1 1 23 ASN CA 1 1 23 ASN C -179.99998 -60.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1
30 . 1 1 26 GLN C 1 1 27 LEU N 1 1 27 LEU CA 1 1 27 LEU C -160.0 -80.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1
31 . 1 1 27 LEU C 1 1 28 ARG N 1 1 28 ARG CA 1 1 28 ARG C -179.99998 -60.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1
32 . 1 1 31 ASP C 1 1 32 GLU N 1 1 32 GLU CA 1 1 32 GLU C -179.99998 -60.0 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1
33 . 1 1 32 GLU C 1 1 33 TYR N 1 1 33 TYR CA 1 1 33 TYR C -160.0 -80.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1
34 . 1 1 33 TYR C 1 1 34 PHE N 1 1 34 PHE CA 1 1 34 PHE C -179.99998 -60.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1
35 . 1 1 34 PHE C 1 1 35 ILE N 1 1 35 ILE CA 1 1 35 ILE C -179.99998 -60.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1
36 . 1 1 35 ILE C 1 1 36 LEU N 1 1 36 LEU CA 1 1 36 LEU C -179.99998 -60.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1
37 . 1 1 42 PRO C 1 1 43 TRP N 1 1 43 TRP CA 1 1 43 TRP C -160.0 -80.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1
38 . 1 1 43 TRP C 1 1 44 TRP N 1 1 44 TRP CA 1 1 44 TRP C -160.0 -80.0 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1
39 . 1 1 44 TRP C 1 1 45 ARG N 1 1 45 ARG CA 1 1 45 ARG C -179.99998 -60.0 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1
40 . 1 1 45 ARG C 1 1 46 ALA N 1 1 46 ALA CA 1 1 46 ALA C -160.0 -80.0 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1
41 . 1 1 46 ALA C 1 1 47 ARG N 1 1 47 ARG CA 1 1 47 ARG C -179.99998 -60.0 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1
42 . 1 1 47 ARG C 1 1 48 ASP N 1 1 48 ASP CA 1 1 48 ASP C -179.99998 -60.0 . 47 . C . 48 . N . 48 . CA . 48 . C 1 1
43 . 1 1 49 LYS C 1 1 50 ASN N 1 1 50 ASN CA 1 1 50 ASN C -179.99998 -60.0 . 49 . C . 50 . N . 50 . CA . 50 . C 1 1
44 . 1 1 52 GLN C 1 1 53 GLU N 1 1 53 GLU CA 1 1 53 GLU C -160.0 -80.0 . 52 . C . 53 . N . 53 . CA . 53 . C 1 1
45 . 1 1 54 GLY C 1 1 55 TYR N 1 1 55 TYR CA 1 1 55 TYR C -179.99998 -60.0 . 54 . C . 55 . N . 55 . CA . 55 . C 1 1
46 . 1 1 55 TYR C 1 1 56 ILE N 1 1 56 ILE CA 1 1 56 ILE C -160.0 -80.0 . 55 . C . 56 . N . 56 . CA . 56 . C 1 1
47 . 1 1 58 SER C 1 1 59 ASN N 1 1 59 ASN CA 1 1 59 ASN C -179.99998 -60.0 . 58 . C . 59 . N . 59 . CA . 59 . C 1 1
48 . 1 1 59 ASN C 1 1 60 TYR N 1 1 60 TYR CA 1 1 60 TYR C -179.99998 -60.0 . 59 . C . 60 . N . 60 . CA . 60 . C 1 1
49 . 1 1 60 TYR C 1 1 61 VAL N 1 1 61 VAL CA 1 1 61 VAL C -160.0 -80.0 . 60 . C . 61 . N . 61 . CA . 61 . C 1 1
50 . 1 1 61 VAL C 1 1 62 THR N 1 1 62 THR CA 1 1 62 THR C -179.99998 -60.0 . 61 . C . 62 . N . 62 . CA . 62 . C 1 1
51 . 1 1 62 THR C 1 1 63 GLU N 1 1 63 GLU CA 1 1 63 GLU C -100.0 -20.0 . 62 . C . 63 . N . 63 . CA . 63 . 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 GLY C C 49.534 21.047 6.327 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C 50.808 21.458 7.066 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H 51.540 19.511 7.164 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY H2 H 52.088 20.391 5.817 1.00 . A A . 1 GLY H2 1 1
1 5 1 1 1 GLY H3 H 52.727 20.705 7.360 1.00 . A A . 1 GLY H3 1 1
1 6 1 1 1 GLY HA2 H 50.605 21.530 8.125 1.00 . A A . 1 GLY HA2 1 1
1 7 1 1 1 GLY HA3 H 51.141 22.417 6.697 1.00 . A A . 1 GLY HA3 1 1
1 8 1 1 1 GLY N N 51.871 20.439 6.834 1.00 . A A . 1 GLY N 1 1
1 9 1 1 1 GLY O O 48.672 20.389 6.879 1.00 . A A . 1 GLY O 1 1
1 10 1 1 2 SER C C 48.593 20.369 2.995 1.00 . A A . 2 SER C 1 1
1 11 1 1 2 SER CA C 48.193 21.069 4.297 1.00 . A A . 2 SER CA 1 1
1 12 1 1 2 SER CB C 47.502 22.399 4.001 1.00 . A A . 2 SER CB 1 1
1 13 1 1 2 SER H H 50.120 21.962 4.663 1.00 . A A . 2 SER H 1 1
1 14 1 1 2 SER HA H 47.542 20.437 4.881 1.00 . A A . 2 SER HA 1 1
1 15 1 1 2 SER HB2 H 46.631 22.227 3.390 1.00 . A A . 2 SER HB2 1 1
1 16 1 1 2 SER HB3 H 47.201 22.862 4.931 1.00 . A A . 2 SER HB3 1 1
1 17 1 1 2 SER HG H 48.203 23.186 2.365 1.00 . A A . 2 SER HG 1 1
1 18 1 1 2 SER N N 49.410 21.432 5.082 1.00 . A A . 2 SER N 1 1
1 19 1 1 2 SER O O 49.761 20.225 2.691 1.00 . A A . 2 SER O 1 1
1 20 1 1 2 SER OG O 48.402 23.250 3.302 1.00 . A A . 2 SER OG 1 1
1 21 1 1 3 MET C C 48.907 18.074 1.148 1.00 . A A . 3 MET C 1 1
1 22 1 1 3 MET CA C 47.929 19.236 0.927 1.00 . A A . 3 MET CA 1 1
1 23 1 1 3 MET CB C 48.559 20.303 0.025 1.00 . A A . 3 MET CB 1 1
1 24 1 1 3 MET CE C 48.936 23.184 -1.322 1.00 . A A . 3 MET CE 1 1
1 25 1 1 3 MET CG C 47.473 20.946 -0.840 1.00 . A A . 3 MET CG 1 1
1 26 1 1 3 MET H H 46.693 20.063 2.493 1.00 . A A . 3 MET H 1 1
1 27 1 1 3 MET HA H 47.018 18.873 0.478 1.00 . A A . 3 MET HA 1 1
1 28 1 1 3 MET HB2 H 49.028 21.060 0.637 1.00 . A A . 3 MET HB2 1 1
1 29 1 1 3 MET HB3 H 49.300 19.845 -0.612 1.00 . A A . 3 MET HB3 1 1
1 30 1 1 3 MET HE1 H 48.617 23.126 -0.291 1.00 . A A . 3 MET HE1 1 1
1 31 1 1 3 MET HE2 H 50.016 23.146 -1.373 1.00 . A A . 3 MET HE2 1 1
1 32 1 1 3 MET HE3 H 48.591 24.110 -1.752 1.00 . A A . 3 MET HE3 1 1
1 33 1 1 3 MET HG2 H 46.802 20.182 -1.203 1.00 . A A . 3 MET HG2 1 1
1 34 1 1 3 MET HG3 H 46.919 21.661 -0.250 1.00 . A A . 3 MET HG3 1 1
1 35 1 1 3 MET N N 47.626 19.932 2.222 1.00 . A A . 3 MET N 1 1
1 36 1 1 3 MET O O 50.110 18.247 1.099 1.00 . A A . 3 MET O 1 1
1 37 1 1 3 MET SD S 48.242 21.790 -2.245 1.00 . A A . 3 MET SD 1 1
1 38 1 1 4 SER C C 50.081 15.393 0.344 1.00 . A A . 4 SER C 1 1
1 39 1 1 4 SER CA C 49.284 15.713 1.615 1.00 . A A . 4 SER CA 1 1
1 40 1 1 4 SER CB C 48.344 14.558 1.959 1.00 . A A . 4 SER CB 1 1
1 41 1 1 4 SER H H 47.418 16.787 1.422 1.00 . A A . 4 SER H 1 1
1 42 1 1 4 SER HA H 49.953 15.900 2.440 1.00 . A A . 4 SER HA 1 1
1 43 1 1 4 SER HB2 H 47.843 14.763 2.890 1.00 . A A . 4 SER HB2 1 1
1 44 1 1 4 SER HB3 H 47.607 14.448 1.174 1.00 . A A . 4 SER HB3 1 1
1 45 1 1 4 SER HG H 49.658 13.445 2.865 1.00 . A A . 4 SER HG 1 1
1 46 1 1 4 SER N N 48.393 16.895 1.390 1.00 . A A . 4 SER N 1 1
1 47 1 1 4 SER O O 51.135 14.789 0.403 1.00 . A A . 4 SER O 1 1
1 48 1 1 4 SER OG O 49.100 13.361 2.088 1.00 . A A . 4 SER OG 1 1
1 49 1 1 5 THR C C 51.731 16.085 -2.038 1.00 . A A . 5 THR C 1 1
1 50 1 1 5 THR CA C 50.309 15.511 -2.083 1.00 . A A . 5 THR CA 1 1
1 51 1 1 5 THR CB C 49.488 16.206 -3.171 1.00 . A A . 5 THR CB 1 1
1 52 1 1 5 THR CG2 C 48.213 15.405 -3.440 1.00 . A A . 5 THR CG2 1 1
1 53 1 1 5 THR H H 48.731 16.275 -0.821 1.00 . A A . 5 THR H 1 1
1 54 1 1 5 THR HA H 50.340 14.449 -2.270 1.00 . A A . 5 THR HA 1 1
1 55 1 1 5 THR HB H 50.068 16.267 -4.078 1.00 . A A . 5 THR HB 1 1
1 56 1 1 5 THR HG1 H 49.182 18.099 -3.499 1.00 . A A . 5 THR HG1 1 1
1 57 1 1 5 THR HG21 H 48.418 14.351 -3.320 1.00 . A A . 5 THR HG21 1 1
1 58 1 1 5 THR HG22 H 47.446 15.704 -2.741 1.00 . A A . 5 THR HG22 1 1
1 59 1 1 5 THR HG23 H 47.875 15.594 -4.448 1.00 . A A . 5 THR HG23 1 1
1 60 1 1 5 THR N N 49.584 15.792 -0.802 1.00 . A A . 5 THR N 1 1
1 61 1 1 5 THR O O 52.615 15.624 -2.736 1.00 . A A . 5 THR O 1 1
1 62 1 1 5 THR OG1 O 49.144 17.515 -2.738 1.00 . A A . 5 THR OG1 1 1
1 63 1 1 6 SER C C 54.343 16.638 -0.697 1.00 . A A . 6 SER C 1 1
1 64 1 1 6 SER CA C 53.323 17.693 -1.130 1.00 . A A . 6 SER CA 1 1
1 65 1 1 6 SER CB C 53.206 18.792 -0.073 1.00 . A A . 6 SER CB 1 1
1 66 1 1 6 SER H H 51.227 17.439 -0.671 1.00 . A A . 6 SER H 1 1
1 67 1 1 6 SER HA H 53.607 18.122 -2.075 1.00 . A A . 6 SER HA 1 1
1 68 1 1 6 SER HB2 H 52.708 19.649 -0.495 1.00 . A A . 6 SER HB2 1 1
1 69 1 1 6 SER HB3 H 52.631 18.423 0.767 1.00 . A A . 6 SER HB3 1 1
1 70 1 1 6 SER HG H 54.866 19.783 -0.289 1.00 . A A . 6 SER HG 1 1
1 71 1 1 6 SER N N 51.956 17.086 -1.222 1.00 . A A . 6 SER N 1 1
1 72 1 1 6 SER O O 55.156 16.187 -1.483 1.00 . A A . 6 SER O 1 1
1 73 1 1 6 SER OG O 54.507 19.171 0.357 1.00 . A A . 6 SER OG 1 1
1 74 1 1 7 GLU C C 54.623 13.824 0.995 1.00 . A A . 7 GLU C 1 1
1 75 1 1 7 GLU CA C 55.263 15.216 1.048 1.00 . A A . 7 GLU CA 1 1
1 76 1 1 7 GLU CB C 55.559 15.622 2.493 1.00 . A A . 7 GLU CB 1 1
1 77 1 1 7 GLU CD C 58.052 15.767 2.396 1.00 . A A . 7 GLU CD 1 1
1 78 1 1 7 GLU CG C 56.757 16.573 2.520 1.00 . A A . 7 GLU CG 1 1
1 79 1 1 7 GLU H H 53.636 16.625 1.154 1.00 . A A . 7 GLU H 1 1
1 80 1 1 7 GLU HA H 56.172 15.235 0.466 1.00 . A A . 7 GLU HA 1 1
1 81 1 1 7 GLU HB2 H 54.695 16.118 2.911 1.00 . A A . 7 GLU HB2 1 1
1 82 1 1 7 GLU HB3 H 55.787 14.742 3.075 1.00 . A A . 7 GLU HB3 1 1
1 83 1 1 7 GLU HG2 H 56.684 17.268 1.696 1.00 . A A . 7 GLU HG2 1 1
1 84 1 1 7 GLU HG3 H 56.763 17.118 3.452 1.00 . A A . 7 GLU HG3 1 1
1 85 1 1 7 GLU N N 54.302 16.243 0.548 1.00 . A A . 7 GLU N 1 1
1 86 1 1 7 GLU O O 54.349 13.217 2.014 1.00 . A A . 7 GLU O 1 1
1 87 1 1 7 GLU OE1 O 58.136 14.720 3.016 1.00 . A A . 7 GLU OE1 1 1
1 88 1 1 7 GLU OE2 O 58.936 16.210 1.682 1.00 . A A . 7 GLU OE2 1 1
1 89 1 1 8 LEU C C 54.004 11.412 -1.729 1.00 . A A . 8 LEU C 1 1
1 90 1 1 8 LEU CA C 53.761 11.968 -0.323 1.00 . A A . 8 LEU CA 1 1
1 91 1 1 8 LEU CB C 52.268 12.196 -0.085 1.00 . A A . 8 LEU CB 1 1
1 92 1 1 8 LEU CD1 C 51.472 10.397 1.455 1.00 . A A . 8 LEU CD1 1 1
1 93 1 1 8 LEU CD2 C 50.137 10.988 -0.572 1.00 . A A . 8 LEU CD2 1 1
1 94 1 1 8 LEU CG C 51.551 10.847 -0.005 1.00 . A A . 8 LEU CG 1 1
1 95 1 1 8 LEU H H 54.615 13.831 -0.992 1.00 . A A . 8 LEU H 1 1
1 96 1 1 8 LEU HA H 54.155 11.296 0.423 1.00 . A A . 8 LEU HA 1 1
1 97 1 1 8 LEU HB2 H 52.129 12.734 0.842 1.00 . A A . 8 LEU HB2 1 1
1 98 1 1 8 LEU HB3 H 51.857 12.772 -0.901 1.00 . A A . 8 LEU HB3 1 1
1 99 1 1 8 LEU HD11 H 52.388 10.659 1.963 1.00 . A A . 8 LEU HD11 1 1
1 100 1 1 8 LEU HD12 H 50.639 10.887 1.938 1.00 . A A . 8 LEU HD12 1 1
1 101 1 1 8 LEU HD13 H 51.331 9.327 1.495 1.00 . A A . 8 LEU HD13 1 1
1 102 1 1 8 LEU HD21 H 49.793 12.003 -0.436 1.00 . A A . 8 LEU HD21 1 1
1 103 1 1 8 LEU HD22 H 50.145 10.749 -1.625 1.00 . A A . 8 LEU HD22 1 1
1 104 1 1 8 LEU HD23 H 49.473 10.311 -0.054 1.00 . A A . 8 LEU HD23 1 1
1 105 1 1 8 LEU HG H 52.100 10.114 -0.578 1.00 . A A . 8 LEU HG 1 1
1 106 1 1 8 LEU N N 54.384 13.319 -0.189 1.00 . A A . 8 LEU N 1 1
1 107 1 1 8 LEU O O 53.531 11.957 -2.709 1.00 . A A . 8 LEU O 1 1
1 108 1 1 9 LYS C C 54.735 8.228 -3.144 1.00 . A A . 9 LYS C 1 1
1 109 1 1 9 LYS CA C 55.015 9.733 -3.170 1.00 . A A . 9 LYS CA 1 1
1 110 1 1 9 LYS CB C 56.501 9.999 -3.422 1.00 . A A . 9 LYS CB 1 1
1 111 1 1 9 LYS CD C 57.959 11.943 -4.009 1.00 . A A . 9 LYS CD 1 1
1 112 1 1 9 LYS CE C 58.283 12.946 -5.118 1.00 . A A . 9 LYS CE 1 1
1 113 1 1 9 LYS CG C 56.659 11.210 -4.345 1.00 . A A . 9 LYS CG 1 1
1 114 1 1 9 LYS H H 55.104 9.915 -1.024 1.00 . A A . 9 LYS H 1 1
1 115 1 1 9 LYS HA H 54.419 10.214 -3.930 1.00 . A A . 9 LYS HA 1 1
1 116 1 1 9 LYS HB2 H 56.995 10.195 -2.482 1.00 . A A . 9 LYS HB2 1 1
1 117 1 1 9 LYS HB3 H 56.947 9.133 -3.889 1.00 . A A . 9 LYS HB3 1 1
1 118 1 1 9 LYS HD2 H 57.844 12.467 -3.071 1.00 . A A . 9 LYS HD2 1 1
1 119 1 1 9 LYS HD3 H 58.764 11.228 -3.926 1.00 . A A . 9 LYS HD3 1 1
1 120 1 1 9 LYS HE2 H 59.000 12.522 -5.809 1.00 . A A . 9 LYS HE2 1 1
1 121 1 1 9 LYS HE3 H 57.384 13.236 -5.638 1.00 . A A . 9 LYS HE3 1 1
1 122 1 1 9 LYS HG2 H 56.687 10.878 -5.373 1.00 . A A . 9 LYS HG2 1 1
1 123 1 1 9 LYS HG3 H 55.824 11.880 -4.206 1.00 . A A . 9 LYS HG3 1 1
1 124 1 1 9 LYS HZ1 H 59.685 13.815 -3.848 1.00 . A A . 9 LYS HZ1 1 1
1 125 1 1 9 LYS HZ2 H 59.180 14.824 -5.114 1.00 . A A . 9 LYS HZ2 1 1
1 126 1 1 9 LYS HZ3 H 58.151 14.544 -3.792 1.00 . A A . 9 LYS HZ3 1 1
1 127 1 1 9 LYS N N 54.736 10.333 -1.831 1.00 . A A . 9 LYS N 1 1
1 128 1 1 9 LYS NZ N 58.869 14.121 -4.415 1.00 . A A . 9 LYS NZ 1 1
1 129 1 1 9 LYS O O 54.121 7.720 -2.224 1.00 . A A . 9 LYS O 1 1
1 130 1 1 10 LYS C C 56.197 5.288 -3.732 1.00 . A A . 10 LYS C 1 1
1 131 1 1 10 LYS CA C 54.944 6.041 -4.191 1.00 . A A . 10 LYS CA 1 1
1 132 1 1 10 LYS CB C 54.636 5.734 -5.657 1.00 . A A . 10 LYS CB 1 1
1 133 1 1 10 LYS CD C 53.150 7.526 -6.572 1.00 . A A . 10 LYS CD 1 1
1 134 1 1 10 LYS CE C 53.552 7.460 -8.047 1.00 . A A . 10 LYS CE 1 1
1 135 1 1 10 LYS CG C 53.187 6.120 -5.969 1.00 . A A . 10 LYS CG 1 1
1 136 1 1 10 LYS H H 55.671 7.952 -4.875 1.00 . A A . 10 LYS H 1 1
1 137 1 1 10 LYS HA H 54.099 5.777 -3.574 1.00 . A A . 10 LYS HA 1 1
1 138 1 1 10 LYS HB2 H 55.304 6.301 -6.290 1.00 . A A . 10 LYS HB2 1 1
1 139 1 1 10 LYS HB3 H 54.773 4.680 -5.841 1.00 . A A . 10 LYS HB3 1 1
1 140 1 1 10 LYS HD2 H 52.150 7.927 -6.487 1.00 . A A . 10 LYS HD2 1 1
1 141 1 1 10 LYS HD3 H 53.841 8.164 -6.041 1.00 . A A . 10 LYS HD3 1 1
1 142 1 1 10 LYS HE2 H 54.625 7.361 -8.139 1.00 . A A . 10 LYS HE2 1 1
1 143 1 1 10 LYS HE3 H 53.053 6.639 -8.537 1.00 . A A . 10 LYS HE3 1 1
1 144 1 1 10 LYS HG2 H 52.771 5.414 -6.674 1.00 . A A . 10 LYS HG2 1 1
1 145 1 1 10 LYS HG3 H 52.606 6.105 -5.059 1.00 . A A . 10 LYS HG3 1 1
1 146 1 1 10 LYS HZ1 H 52.102 8.918 -8.371 1.00 . A A . 10 LYS HZ1 1 1
1 147 1 1 10 LYS HZ2 H 53.684 9.527 -8.256 1.00 . A A . 10 LYS HZ2 1 1
1 148 1 1 10 LYS HZ3 H 53.182 8.719 -9.663 1.00 . A A . 10 LYS HZ3 1 1
1 149 1 1 10 LYS N N 55.181 7.515 -4.147 1.00 . A A . 10 LYS N 1 1
1 150 1 1 10 LYS NZ N 53.096 8.754 -8.628 1.00 . A A . 10 LYS NZ 1 1
1 151 1 1 10 LYS O O 57.160 5.883 -3.288 1.00 . A A . 10 LYS O 1 1
1 152 1 1 11 VAL C C 57.428 1.863 -4.192 1.00 . A A . 11 VAL C 1 1
1 153 1 1 11 VAL CA C 57.378 3.177 -3.413 1.00 . A A . 11 VAL CA 1 1
1 154 1 1 11 VAL CB C 57.202 2.899 -1.914 1.00 . A A . 11 VAL CB 1 1
1 155 1 1 11 VAL CG1 C 57.395 4.196 -1.128 1.00 . A A . 11 VAL CG1 1 1
1 156 1 1 11 VAL CG2 C 55.807 2.327 -1.637 1.00 . A A . 11 VAL CG2 1 1
1 157 1 1 11 VAL H H 55.402 3.530 -4.205 1.00 . A A . 11 VAL H 1 1
1 158 1 1 11 VAL HA H 58.284 3.739 -3.575 1.00 . A A . 11 VAL HA 1 1
1 159 1 1 11 VAL HB H 57.950 2.184 -1.600 1.00 . A A . 11 VAL HB 1 1
1 160 1 1 11 VAL HG11 H 58.316 4.670 -1.436 1.00 . A A . 11 VAL HG11 1 1
1 161 1 1 11 VAL HG12 H 56.569 4.860 -1.320 1.00 . A A . 11 VAL HG12 1 1
1 162 1 1 11 VAL HG13 H 57.441 3.974 -0.073 1.00 . A A . 11 VAL HG13 1 1
1 163 1 1 11 VAL HG21 H 55.579 1.568 -2.371 1.00 . A A . 11 VAL HG21 1 1
1 164 1 1 11 VAL HG22 H 55.787 1.891 -0.650 1.00 . A A . 11 VAL HG22 1 1
1 165 1 1 11 VAL HG23 H 55.076 3.119 -1.697 1.00 . A A . 11 VAL HG23 1 1
1 166 1 1 11 VAL N N 56.189 3.983 -3.840 1.00 . A A . 11 VAL N 1 1
1 167 1 1 11 VAL O O 56.432 1.402 -4.708 1.00 . A A . 11 VAL O 1 1
1 168 1 1 12 VAL C C 58.641 -1.195 -4.015 1.00 . A A . 12 VAL C 1 1
1 169 1 1 12 VAL CA C 58.723 -0.024 -5.019 1.00 . A A . 12 VAL CA 1 1
1 170 1 1 12 VAL CB C 60.113 0.112 -5.713 1.00 . A A . 12 VAL CB 1 1
1 171 1 1 12 VAL CG1 C 60.988 -1.148 -5.596 1.00 . A A . 12 VAL CG1 1 1
1 172 1 1 12 VAL CG2 C 59.905 0.414 -7.195 1.00 . A A . 12 VAL CG2 1 1
1 173 1 1 12 VAL H H 59.371 1.657 -3.842 1.00 . A A . 12 VAL H 1 1
1 174 1 1 12 VAL HA H 57.941 -0.103 -5.767 1.00 . A A . 12 VAL HA 1 1
1 175 1 1 12 VAL HB H 60.638 0.934 -5.267 1.00 . A A . 12 VAL HB 1 1
1 176 1 1 12 VAL HG11 H 61.035 -1.461 -4.564 1.00 . A A . 12 VAL HG11 1 1
1 177 1 1 12 VAL HG12 H 60.564 -1.938 -6.196 1.00 . A A . 12 VAL HG12 1 1
1 178 1 1 12 VAL HG13 H 61.983 -0.924 -5.948 1.00 . A A . 12 VAL HG13 1 1
1 179 1 1 12 VAL HG21 H 59.141 1.167 -7.302 1.00 . A A . 12 VAL HG21 1 1
1 180 1 1 12 VAL HG22 H 60.829 0.775 -7.620 1.00 . A A . 12 VAL HG22 1 1
1 181 1 1 12 VAL HG23 H 59.602 -0.488 -7.706 1.00 . A A . 12 VAL HG23 1 1
1 182 1 1 12 VAL N N 58.584 1.262 -4.274 1.00 . A A . 12 VAL N 1 1
1 183 1 1 12 VAL O O 58.502 -0.989 -2.826 1.00 . A A . 12 VAL O 1 1
1 184 1 1 13 ALA C C 59.935 -4.448 -3.758 1.00 . A A . 13 ALA C 1 1
1 185 1 1 13 ALA CA C 58.679 -3.592 -3.577 1.00 . A A . 13 ALA CA 1 1
1 186 1 1 13 ALA CB C 57.439 -4.372 -4.011 1.00 . A A . 13 ALA CB 1 1
1 187 1 1 13 ALA H H 58.851 -2.548 -5.451 1.00 . A A . 13 ALA H 1 1
1 188 1 1 13 ALA HA H 58.579 -3.275 -2.552 1.00 . A A . 13 ALA HA 1 1
1 189 1 1 13 ALA HB1 H 56.674 -3.684 -4.334 1.00 . A A . 13 ALA HB1 1 1
1 190 1 1 13 ALA HB2 H 57.696 -5.033 -4.826 1.00 . A A . 13 ALA HB2 1 1
1 191 1 1 13 ALA HB3 H 57.072 -4.954 -3.178 1.00 . A A . 13 ALA HB3 1 1
1 192 1 1 13 ALA N N 58.736 -2.411 -4.489 1.00 . A A . 13 ALA N 1 1
1 193 1 1 13 ALA O O 60.336 -4.744 -4.869 1.00 . A A . 13 ALA O 1 1
1 194 1 1 14 LEU C C 61.433 -7.168 -2.758 1.00 . A A . 14 LEU C 1 1
1 195 1 1 14 LEU CA C 61.792 -5.682 -2.787 1.00 . A A . 14 LEU CA 1 1
1 196 1 1 14 LEU CB C 62.637 -5.304 -1.571 1.00 . A A . 14 LEU CB 1 1
1 197 1 1 14 LEU CD1 C 63.514 -3.316 -0.329 1.00 . A A . 14 LEU CD1 1 1
1 198 1 1 14 LEU CD2 C 64.263 -3.762 -2.674 1.00 . A A . 14 LEU CD2 1 1
1 199 1 1 14 LEU CG C 63.085 -3.847 -1.699 1.00 . A A . 14 LEU CG 1 1
1 200 1 1 14 LEU H H 60.216 -4.592 -1.796 1.00 . A A . 14 LEU H 1 1
1 201 1 1 14 LEU HA H 62.326 -5.445 -3.690 1.00 . A A . 14 LEU HA 1 1
1 202 1 1 14 LEU HB2 H 62.051 -5.425 -0.672 1.00 . A A . 14 LEU HB2 1 1
1 203 1 1 14 LEU HB3 H 63.506 -5.943 -1.523 1.00 . A A . 14 LEU HB3 1 1
1 204 1 1 14 LEU HD11 H 63.774 -4.143 0.315 1.00 . A A . 14 LEU HD11 1 1
1 205 1 1 14 LEU HD12 H 64.370 -2.666 -0.444 1.00 . A A . 14 LEU HD12 1 1
1 206 1 1 14 LEU HD13 H 62.699 -2.760 0.110 1.00 . A A . 14 LEU HD13 1 1
1 207 1 1 14 LEU HD21 H 65.019 -4.479 -2.389 1.00 . A A . 14 LEU HD21 1 1
1 208 1 1 14 LEU HD22 H 63.919 -3.979 -3.674 1.00 . A A . 14 LEU HD22 1 1
1 209 1 1 14 LEU HD23 H 64.683 -2.767 -2.645 1.00 . A A . 14 LEU HD23 1 1
1 210 1 1 14 LEU HG H 62.264 -3.252 -2.073 1.00 . A A . 14 LEU HG 1 1
1 211 1 1 14 LEU N N 60.559 -4.846 -2.678 1.00 . A A . 14 LEU N 1 1
1 212 1 1 14 LEU O O 61.532 -7.856 -3.756 1.00 . A A . 14 LEU O 1 1
1 213 1 1 15 TYR C C 59.134 -9.274 -1.529 1.00 . A A . 15 TYR C 1 1
1 214 1 1 15 TYR CA C 60.655 -9.110 -1.521 1.00 . A A . 15 TYR CA 1 1
1 215 1 1 15 TYR CB C 61.234 -9.581 -0.187 1.00 . A A . 15 TYR CB 1 1
1 216 1 1 15 TYR CD1 C 63.527 -10.266 -0.980 1.00 . A A . 15 TYR CD1 1 1
1 217 1 1 15 TYR CD2 C 63.336 -8.417 0.578 1.00 . A A . 15 TYR CD2 1 1
1 218 1 1 15 TYR CE1 C 64.919 -10.114 -0.989 1.00 . A A . 15 TYR CE1 1 1
1 219 1 1 15 TYR CE2 C 64.728 -8.266 0.569 1.00 . A A . 15 TYR CE2 1 1
1 220 1 1 15 TYR CG C 62.736 -9.417 -0.197 1.00 . A A . 15 TYR CG 1 1
1 221 1 1 15 TYR CZ C 65.520 -9.114 -0.214 1.00 . A A . 15 TYR CZ 1 1
1 222 1 1 15 TYR H H 60.954 -7.085 -0.837 1.00 . A A . 15 TYR H 1 1
1 223 1 1 15 TYR HA H 61.098 -9.667 -2.331 1.00 . A A . 15 TYR HA 1 1
1 224 1 1 15 TYR HB2 H 60.812 -8.995 0.613 1.00 . A A . 15 TYR HB2 1 1
1 225 1 1 15 TYR HB3 H 60.988 -10.622 -0.037 1.00 . A A . 15 TYR HB3 1 1
1 226 1 1 15 TYR HD1 H 63.064 -11.037 -1.577 1.00 . A A . 15 TYR HD1 1 1
1 227 1 1 15 TYR HD2 H 62.726 -7.763 1.182 1.00 . A A . 15 TYR HD2 1 1
1 228 1 1 15 TYR HE1 H 65.530 -10.769 -1.593 1.00 . A A . 15 TYR HE1 1 1
1 229 1 1 15 TYR HE2 H 65.191 -7.494 1.166 1.00 . A A . 15 TYR HE2 1 1
1 230 1 1 15 TYR HH H 67.132 -8.477 -1.014 1.00 . A A . 15 TYR HH 1 1
1 231 1 1 15 TYR N N 61.021 -7.664 -1.623 1.00 . A A . 15 TYR N 1 1
1 232 1 1 15 TYR O O 58.395 -8.310 -1.467 1.00 . A A . 15 TYR O 1 1
1 233 1 1 15 TYR OH O 66.891 -8.965 -0.223 1.00 . A A . 15 TYR OH 1 1
1 234 1 1 16 ASP C C 56.615 -10.659 -0.209 1.00 . A A . 16 ASP C 1 1
1 235 1 1 16 ASP CA C 57.193 -10.740 -1.626 1.00 . A A . 16 ASP CA 1 1
1 236 1 1 16 ASP CB C 57.033 -12.152 -2.191 1.00 . A A . 16 ASP CB 1 1
1 237 1 1 16 ASP CG C 57.024 -12.092 -3.719 1.00 . A A . 16 ASP CG 1 1
1 238 1 1 16 ASP H H 59.290 -11.246 -1.662 1.00 . A A . 16 ASP H 1 1
1 239 1 1 16 ASP HA H 56.703 -10.030 -2.270 1.00 . A A . 16 ASP HA 1 1
1 240 1 1 16 ASP HB2 H 57.856 -12.768 -1.858 1.00 . A A . 16 ASP HB2 1 1
1 241 1 1 16 ASP HB3 H 56.102 -12.576 -1.844 1.00 . A A . 16 ASP HB3 1 1
1 242 1 1 16 ASP N N 58.667 -10.492 -1.609 1.00 . A A . 16 ASP N 1 1
1 243 1 1 16 ASP O O 57.316 -10.834 0.769 1.00 . A A . 16 ASP O 1 1
1 244 1 1 16 ASP OD1 O 57.901 -11.448 -4.272 1.00 . A A . 16 ASP OD1 1 1
1 245 1 1 16 ASP OD2 O 56.141 -12.691 -4.311 1.00 . A A . 16 ASP OD2 1 1
1 246 1 1 17 TYR C C 53.165 -10.283 1.073 1.00 . A A . 17 TYR C 1 1
1 247 1 1 17 TYR CA C 54.693 -10.292 1.244 1.00 . A A . 17 TYR CA 1 1
1 248 1 1 17 TYR CB C 55.225 -8.965 1.828 1.00 . A A . 17 TYR CB 1 1
1 249 1 1 17 TYR CD1 C 53.907 -9.381 3.958 1.00 . A A . 17 TYR CD1 1 1
1 250 1 1 17 TYR CD2 C 54.057 -7.120 3.094 1.00 . A A . 17 TYR CD2 1 1
1 251 1 1 17 TYR CE1 C 53.122 -8.920 5.022 1.00 . A A . 17 TYR CE1 1 1
1 252 1 1 17 TYR CE2 C 53.273 -6.660 4.157 1.00 . A A . 17 TYR CE2 1 1
1 253 1 1 17 TYR CG C 54.375 -8.479 2.992 1.00 . A A . 17 TYR CG 1 1
1 254 1 1 17 TYR CZ C 52.805 -7.560 5.121 1.00 . A A . 17 TYR CZ 1 1
1 255 1 1 17 TYR H H 54.797 -10.253 -0.906 1.00 . A A . 17 TYR H 1 1
1 256 1 1 17 TYR HA H 54.997 -11.119 1.868 1.00 . A A . 17 TYR HA 1 1
1 257 1 1 17 TYR HB2 H 56.237 -9.113 2.172 1.00 . A A . 17 TYR HB2 1 1
1 258 1 1 17 TYR HB3 H 55.226 -8.215 1.052 1.00 . A A . 17 TYR HB3 1 1
1 259 1 1 17 TYR HD1 H 54.151 -10.430 3.882 1.00 . A A . 17 TYR HD1 1 1
1 260 1 1 17 TYR HD2 H 54.420 -6.426 2.351 1.00 . A A . 17 TYR HD2 1 1
1 261 1 1 17 TYR HE1 H 52.760 -9.613 5.767 1.00 . A A . 17 TYR HE1 1 1
1 262 1 1 17 TYR HE2 H 53.028 -5.610 4.233 1.00 . A A . 17 TYR HE2 1 1
1 263 1 1 17 TYR HH H 52.542 -7.197 6.977 1.00 . A A . 17 TYR HH 1 1
1 264 1 1 17 TYR N N 55.337 -10.391 -0.099 1.00 . A A . 17 TYR N 1 1
1 265 1 1 17 TYR O O 52.560 -9.247 0.872 1.00 . A A . 17 TYR O 1 1
1 266 1 1 17 TYR OH O 52.031 -7.106 6.170 1.00 . A A . 17 TYR OH 1 1
1 267 1 1 18 MET C C 50.358 -11.129 2.301 1.00 . A A . 18 MET C 1 1
1 268 1 1 18 MET CA C 51.065 -11.512 0.988 1.00 . A A . 18 MET CA 1 1
1 269 1 1 18 MET CB C 50.777 -12.970 0.630 1.00 . A A . 18 MET CB 1 1
1 270 1 1 18 MET CE C 51.076 -15.905 -0.478 1.00 . A A . 18 MET CE 1 1
1 271 1 1 18 MET CG C 51.131 -13.215 -0.838 1.00 . A A . 18 MET CG 1 1
1 272 1 1 18 MET H H 53.064 -12.253 1.308 1.00 . A A . 18 MET H 1 1
1 273 1 1 18 MET HA H 50.736 -10.864 0.188 1.00 . A A . 18 MET HA 1 1
1 274 1 1 18 MET HB2 H 51.372 -13.619 1.257 1.00 . A A . 18 MET HB2 1 1
1 275 1 1 18 MET HB3 H 49.730 -13.180 0.785 1.00 . A A . 18 MET HB3 1 1
1 276 1 1 18 MET HE1 H 52.141 -15.794 -0.610 1.00 . A A . 18 MET HE1 1 1
1 277 1 1 18 MET HE2 H 50.831 -15.782 0.568 1.00 . A A . 18 MET HE2 1 1
1 278 1 1 18 MET HE3 H 50.774 -16.888 -0.811 1.00 . A A . 18 MET HE3 1 1
1 279 1 1 18 MET HG2 H 50.870 -12.344 -1.421 1.00 . A A . 18 MET HG2 1 1
1 280 1 1 18 MET HG3 H 52.191 -13.403 -0.927 1.00 . A A . 18 MET HG3 1 1
1 281 1 1 18 MET N N 52.549 -11.435 1.148 1.00 . A A . 18 MET N 1 1
1 282 1 1 18 MET O O 50.983 -11.106 3.342 1.00 . A A . 18 MET O 1 1
1 283 1 1 18 MET SD S 50.210 -14.648 -1.450 1.00 . A A . 18 MET SD 1 1
1 284 1 1 19 PRO C C 48.138 -11.639 4.371 1.00 . A A . 19 PRO C 1 1
1 285 1 1 19 PRO CA C 48.308 -10.442 3.430 1.00 . A A . 19 PRO CA 1 1
1 286 1 1 19 PRO CB C 46.957 -10.004 2.847 1.00 . A A . 19 PRO CB 1 1
1 287 1 1 19 PRO CD C 48.313 -10.858 0.938 1.00 . A A . 19 PRO CD 1 1
1 288 1 1 19 PRO CG C 47.004 -10.167 1.316 1.00 . A A . 19 PRO CG 1 1
1 289 1 1 19 PRO HA H 48.780 -9.616 3.935 1.00 . A A . 19 PRO HA 1 1
1 290 1 1 19 PRO HB2 H 46.167 -10.620 3.255 1.00 . A A . 19 PRO HB2 1 1
1 291 1 1 19 PRO HB3 H 46.774 -8.969 3.093 1.00 . A A . 19 PRO HB3 1 1
1 292 1 1 19 PRO HD2 H 48.128 -11.875 0.617 1.00 . A A . 19 PRO HD2 1 1
1 293 1 1 19 PRO HD3 H 48.836 -10.302 0.180 1.00 . A A . 19 PRO HD3 1 1
1 294 1 1 19 PRO HG2 H 46.171 -10.767 0.986 1.00 . A A . 19 PRO HG2 1 1
1 295 1 1 19 PRO HG3 H 46.966 -9.196 0.845 1.00 . A A . 19 PRO HG3 1 1
1 296 1 1 19 PRO N N 49.072 -10.831 2.219 1.00 . A A . 19 PRO N 1 1
1 297 1 1 19 PRO O O 48.341 -12.776 3.987 1.00 . A A . 19 PRO O 1 1
1 298 1 1 20 MET C C 46.086 -12.579 6.964 1.00 . A A . 20 MET C 1 1
1 299 1 1 20 MET CA C 47.562 -12.499 6.575 1.00 . A A . 20 MET CA 1 1
1 300 1 1 20 MET CB C 48.412 -12.125 7.791 1.00 . A A . 20 MET CB 1 1
1 301 1 1 20 MET CE C 52.274 -13.192 7.764 1.00 . A A . 20 MET CE 1 1
1 302 1 1 20 MET CG C 49.877 -11.979 7.372 1.00 . A A . 20 MET CG 1 1
1 303 1 1 20 MET H H 47.597 -10.461 5.875 1.00 . A A . 20 MET H 1 1
1 304 1 1 20 MET HA H 47.897 -13.435 6.158 1.00 . A A . 20 MET HA 1 1
1 305 1 1 20 MET HB2 H 48.060 -11.190 8.202 1.00 . A A . 20 MET HB2 1 1
1 306 1 1 20 MET HB3 H 48.329 -12.900 8.539 1.00 . A A . 20 MET HB3 1 1
1 307 1 1 20 MET HE1 H 51.990 -13.186 6.721 1.00 . A A . 20 MET HE1 1 1
1 308 1 1 20 MET HE2 H 53.184 -12.628 7.891 1.00 . A A . 20 MET HE2 1 1
1 309 1 1 20 MET HE3 H 52.435 -14.210 8.093 1.00 . A A . 20 MET HE3 1 1
1 310 1 1 20 MET HG2 H 50.073 -12.623 6.528 1.00 . A A . 20 MET HG2 1 1
1 311 1 1 20 MET HG3 H 50.068 -10.953 7.094 1.00 . A A . 20 MET HG3 1 1
1 312 1 1 20 MET N N 47.759 -11.386 5.597 1.00 . A A . 20 MET N 1 1
1 313 1 1 20 MET O O 45.485 -13.637 6.955 1.00 . A A . 20 MET O 1 1
1 314 1 1 20 MET SD S 50.954 -12.444 8.751 1.00 . A A . 20 MET SD 1 1
1 315 1 1 21 ASN C C 43.301 -10.433 6.825 1.00 . A A . 21 ASN C 1 1
1 316 1 1 21 ASN CA C 44.062 -11.440 7.688 1.00 . A A . 21 ASN CA 1 1
1 317 1 1 21 ASN CB C 44.052 -11.007 9.154 1.00 . A A . 21 ASN CB 1 1
1 318 1 1 21 ASN CG C 44.196 -12.238 10.051 1.00 . A A . 21 ASN CG 1 1
1 319 1 1 21 ASN H H 46.017 -10.624 7.291 1.00 . A A . 21 ASN H 1 1
1 320 1 1 21 ASN HA H 43.632 -12.421 7.589 1.00 . A A . 21 ASN HA 1 1
1 321 1 1 21 ASN HB2 H 44.876 -10.331 9.335 1.00 . A A . 21 ASN HB2 1 1
1 322 1 1 21 ASN HB3 H 43.121 -10.509 9.377 1.00 . A A . 21 ASN HB3 1 1
1 323 1 1 21 ASN HD21 H 45.180 -11.262 11.474 1.00 . A A . 21 ASN HD21 1 1
1 324 1 1 21 ASN HD22 H 44.910 -12.911 11.778 1.00 . A A . 21 ASN HD22 1 1
1 325 1 1 21 ASN N N 45.503 -11.459 7.299 1.00 . A A . 21 ASN N 1 1
1 326 1 1 21 ASN ND2 N 44.813 -12.128 11.196 1.00 . A A . 21 ASN ND2 1 1
1 327 1 1 21 ASN O O 42.323 -10.765 6.181 1.00 . A A . 21 ASN O 1 1
1 328 1 1 21 ASN OD1 O 43.742 -13.311 9.707 1.00 . A A . 21 ASN OD1 1 1
1 329 1 1 22 ALA C C 43.909 -6.878 5.956 1.00 . A A . 22 ALA C 1 1
1 330 1 1 22 ALA CA C 43.068 -8.156 5.989 1.00 . A A . 22 ALA CA 1 1
1 331 1 1 22 ALA CB C 41.734 -7.898 6.693 1.00 . A A . 22 ALA CB 1 1
1 332 1 1 22 ALA H H 44.540 -8.976 7.337 1.00 . A A . 22 ALA H 1 1
1 333 1 1 22 ALA HA H 42.893 -8.516 4.990 1.00 . A A . 22 ALA HA 1 1
1 334 1 1 22 ALA HB1 H 41.837 -8.109 7.747 1.00 . A A . 22 ALA HB1 1 1
1 335 1 1 22 ALA HB2 H 41.450 -6.865 6.559 1.00 . A A . 22 ALA HB2 1 1
1 336 1 1 22 ALA HB3 H 40.973 -8.538 6.270 1.00 . A A . 22 ALA HB3 1 1
1 337 1 1 22 ALA N N 43.749 -9.206 6.809 1.00 . A A . 22 ALA N 1 1
1 338 1 1 22 ALA O O 44.024 -6.225 4.937 1.00 . A A . 22 ALA O 1 1
1 339 1 1 23 ASN C C 46.492 -5.356 6.144 1.00 . A A . 23 ASN C 1 1
1 340 1 1 23 ASN CA C 45.333 -5.282 7.122 1.00 . A A . 23 ASN CA 1 1
1 341 1 1 23 ASN CB C 45.901 -5.229 8.533 1.00 . A A . 23 ASN CB 1 1
1 342 1 1 23 ASN CG C 44.976 -4.412 9.436 1.00 . A A . 23 ASN CG 1 1
1 343 1 1 23 ASN H H 44.379 -7.069 7.872 1.00 . A A . 23 ASN H 1 1
1 344 1 1 23 ASN HA H 44.736 -4.413 6.941 1.00 . A A . 23 ASN HA 1 1
1 345 1 1 23 ASN HB2 H 45.976 -6.232 8.913 1.00 . A A . 23 ASN HB2 1 1
1 346 1 1 23 ASN HB3 H 46.889 -4.776 8.503 1.00 . A A . 23 ASN HB3 1 1
1 347 1 1 23 ASN HD21 H 44.913 -5.793 10.860 1.00 . A A . 23 ASN HD21 1 1
1 348 1 1 23 ASN HD22 H 44.010 -4.390 11.170 1.00 . A A . 23 ASN HD22 1 1
1 349 1 1 23 ASN N N 44.494 -6.521 7.069 1.00 . A A . 23 ASN N 1 1
1 350 1 1 23 ASN ND2 N 44.602 -4.906 10.584 1.00 . A A . 23 ASN ND2 1 1
1 351 1 1 23 ASN O O 46.653 -4.513 5.285 1.00 . A A . 23 ASN O 1 1
1 352 1 1 23 ASN OD1 O 44.591 -3.312 9.093 1.00 . A A . 23 ASN OD1 1 1
1 353 1 1 24 ASP C C 48.202 -6.314 3.962 1.00 . A A . 24 ASP C 1 1
1 354 1 1 24 ASP CA C 48.538 -6.482 5.452 1.00 . A A . 24 ASP CA 1 1
1 355 1 1 24 ASP CB C 49.065 -7.892 5.724 1.00 . A A . 24 ASP CB 1 1
1 356 1 1 24 ASP CG C 49.588 -7.978 7.160 1.00 . A A . 24 ASP CG 1 1
1 357 1 1 24 ASP H H 47.180 -6.975 7.048 1.00 . A A . 24 ASP H 1 1
1 358 1 1 24 ASP HA H 49.270 -5.756 5.757 1.00 . A A . 24 ASP HA 1 1
1 359 1 1 24 ASP HB2 H 48.266 -8.606 5.587 1.00 . A A . 24 ASP HB2 1 1
1 360 1 1 24 ASP HB3 H 49.868 -8.115 5.038 1.00 . A A . 24 ASP HB3 1 1
1 361 1 1 24 ASP N N 47.329 -6.341 6.316 1.00 . A A . 24 ASP N 1 1
1 362 1 1 24 ASP O O 47.194 -6.800 3.484 1.00 . A A . 24 ASP O 1 1
1 363 1 1 24 ASP OD1 O 49.021 -7.320 8.018 1.00 . A A . 24 ASP OD1 1 1
1 364 1 1 24 ASP OD2 O 50.546 -8.701 7.378 1.00 . A A . 24 ASP OD2 1 1
1 365 1 1 25 LEU C C 49.548 -6.485 0.976 1.00 . A A . 25 LEU C 1 1
1 366 1 1 25 LEU CA C 48.796 -5.420 1.780 1.00 . A A . 25 LEU CA 1 1
1 367 1 1 25 LEU CB C 49.335 -4.016 1.479 1.00 . A A . 25 LEU CB 1 1
1 368 1 1 25 LEU CD1 C 47.468 -2.868 0.259 1.00 . A A . 25 LEU CD1 1 1
1 369 1 1 25 LEU CD2 C 49.825 -2.577 -0.514 1.00 . A A . 25 LEU CD2 1 1
1 370 1 1 25 LEU CG C 48.827 -3.559 0.105 1.00 . A A . 25 LEU CG 1 1
1 371 1 1 25 LEU H H 49.851 -5.253 3.648 1.00 . A A . 25 LEU H 1 1
1 372 1 1 25 LEU HA H 47.739 -5.465 1.570 1.00 . A A . 25 LEU HA 1 1
1 373 1 1 25 LEU HB2 H 48.995 -3.327 2.240 1.00 . A A . 25 LEU HB2 1 1
1 374 1 1 25 LEU HB3 H 50.412 -4.036 1.477 1.00 . A A . 25 LEU HB3 1 1
1 375 1 1 25 LEU HD11 H 46.949 -3.276 1.113 1.00 . A A . 25 LEU HD11 1 1
1 376 1 1 25 LEU HD12 H 47.618 -1.807 0.401 1.00 . A A . 25 LEU HD12 1 1
1 377 1 1 25 LEU HD13 H 46.879 -3.031 -0.632 1.00 . A A . 25 LEU HD13 1 1
1 378 1 1 25 LEU HD21 H 50.808 -2.756 -0.107 1.00 . A A . 25 LEU HD21 1 1
1 379 1 1 25 LEU HD22 H 49.848 -2.715 -1.584 1.00 . A A . 25 LEU HD22 1 1
1 380 1 1 25 LEU HD23 H 49.521 -1.564 -0.290 1.00 . A A . 25 LEU HD23 1 1
1 381 1 1 25 LEU HG H 48.719 -4.419 -0.540 1.00 . A A . 25 LEU HG 1 1
1 382 1 1 25 LEU N N 49.046 -5.629 3.234 1.00 . A A . 25 LEU N 1 1
1 383 1 1 25 LEU O O 50.630 -6.900 1.346 1.00 . A A . 25 LEU O 1 1
1 384 1 1 26 GLN C C 50.808 -7.403 -1.727 1.00 . A A . 26 GLN C 1 1
1 385 1 1 26 GLN CA C 49.647 -7.995 -0.929 1.00 . A A . 26 GLN CA 1 1
1 386 1 1 26 GLN CB C 48.562 -8.522 -1.871 1.00 . A A . 26 GLN CB 1 1
1 387 1 1 26 GLN CD C 47.966 -10.348 -3.468 1.00 . A A . 26 GLN CD 1 1
1 388 1 1 26 GLN CG C 49.096 -9.731 -2.640 1.00 . A A . 26 GLN CG 1 1
1 389 1 1 26 GLN H H 48.096 -6.597 -0.375 1.00 . A A . 26 GLN H 1 1
1 390 1 1 26 GLN HA H 50.003 -8.792 -0.297 1.00 . A A . 26 GLN HA 1 1
1 391 1 1 26 GLN HB2 H 47.697 -8.814 -1.293 1.00 . A A . 26 GLN HB2 1 1
1 392 1 1 26 GLN HB3 H 48.284 -7.747 -2.569 1.00 . A A . 26 GLN HB3 1 1
1 393 1 1 26 GLN HE21 H 49.141 -10.783 -5.008 1.00 . A A . 26 GLN HE21 1 1
1 394 1 1 26 GLN HE22 H 47.511 -11.220 -5.193 1.00 . A A . 26 GLN HE22 1 1
1 395 1 1 26 GLN HG2 H 49.894 -9.416 -3.296 1.00 . A A . 26 GLN HG2 1 1
1 396 1 1 26 GLN HG3 H 49.470 -10.465 -1.943 1.00 . A A . 26 GLN HG3 1 1
1 397 1 1 26 GLN N N 48.975 -6.941 -0.107 1.00 . A A . 26 GLN N 1 1
1 398 1 1 26 GLN NE2 N 48.228 -10.823 -4.655 1.00 . A A . 26 GLN NE2 1 1
1 399 1 1 26 GLN O O 50.659 -7.036 -2.878 1.00 . A A . 26 GLN O 1 1
1 400 1 1 26 GLN OE1 O 46.834 -10.397 -3.030 1.00 . A A . 26 GLN OE1 1 1
1 401 1 1 27 LEU C C 53.752 -7.839 -2.757 1.00 . A A . 27 LEU C 1 1
1 402 1 1 27 LEU CA C 53.149 -6.769 -1.839 1.00 . A A . 27 LEU CA 1 1
1 403 1 1 27 LEU CB C 54.130 -6.373 -0.731 1.00 . A A . 27 LEU CB 1 1
1 404 1 1 27 LEU CD1 C 53.050 -4.877 0.969 1.00 . A A . 27 LEU CD1 1 1
1 405 1 1 27 LEU CD2 C 55.220 -4.212 -0.089 1.00 . A A . 27 LEU CD2 1 1
1 406 1 1 27 LEU CG C 53.879 -4.918 -0.320 1.00 . A A . 27 LEU CG 1 1
1 407 1 1 27 LEU H H 52.058 -7.630 -0.199 1.00 . A A . 27 LEU H 1 1
1 408 1 1 27 LEU HA H 52.869 -5.898 -2.410 1.00 . A A . 27 LEU HA 1 1
1 409 1 1 27 LEU HB2 H 53.981 -7.014 0.126 1.00 . A A . 27 LEU HB2 1 1
1 410 1 1 27 LEU HB3 H 55.143 -6.478 -1.090 1.00 . A A . 27 LEU HB3 1 1
1 411 1 1 27 LEU HD11 H 52.586 -5.838 1.132 1.00 . A A . 27 LEU HD11 1 1
1 412 1 1 27 LEU HD12 H 53.691 -4.642 1.807 1.00 . A A . 27 LEU HD12 1 1
1 413 1 1 27 LEU HD13 H 52.286 -4.121 0.878 1.00 . A A . 27 LEU HD13 1 1
1 414 1 1 27 LEU HD21 H 55.941 -4.562 -0.813 1.00 . A A . 27 LEU HD21 1 1
1 415 1 1 27 LEU HD22 H 55.088 -3.145 -0.198 1.00 . A A . 27 LEU HD22 1 1
1 416 1 1 27 LEU HD23 H 55.575 -4.430 0.908 1.00 . A A . 27 LEU HD23 1 1
1 417 1 1 27 LEU HG H 53.336 -4.414 -1.105 1.00 . A A . 27 LEU HG 1 1
1 418 1 1 27 LEU N N 51.966 -7.321 -1.124 1.00 . A A . 27 LEU N 1 1
1 419 1 1 27 LEU O O 53.158 -8.874 -2.992 1.00 . A A . 27 LEU O 1 1
1 420 1 1 28 ARG C C 57.018 -8.134 -4.468 1.00 . A A . 28 ARG C 1 1
1 421 1 1 28 ARG CA C 55.575 -8.566 -4.203 1.00 . A A . 28 ARG CA 1 1
1 422 1 1 28 ARG CB C 54.751 -8.513 -5.494 1.00 . A A . 28 ARG CB 1 1
1 423 1 1 28 ARG CD C 53.733 -9.873 -7.328 1.00 . A A . 28 ARG CD 1 1
1 424 1 1 28 ARG CG C 54.547 -9.931 -6.033 1.00 . A A . 28 ARG CG 1 1
1 425 1 1 28 ARG CZ C 53.007 -11.687 -8.758 1.00 . A A . 28 ARG CZ 1 1
1 426 1 1 28 ARG H H 55.369 -6.740 -3.083 1.00 . A A . 28 ARG H 1 1
1 427 1 1 28 ARG HA H 55.546 -9.558 -3.786 1.00 . A A . 28 ARG HA 1 1
1 428 1 1 28 ARG HB2 H 53.789 -8.065 -5.288 1.00 . A A . 28 ARG HB2 1 1
1 429 1 1 28 ARG HB3 H 55.272 -7.921 -6.231 1.00 . A A . 28 ARG HB3 1 1
1 430 1 1 28 ARG HD2 H 52.689 -9.702 -7.106 1.00 . A A . 28 ARG HD2 1 1
1 431 1 1 28 ARG HD3 H 54.113 -9.099 -7.977 1.00 . A A . 28 ARG HD3 1 1
1 432 1 1 28 ARG HE H 54.733 -11.726 -7.777 1.00 . A A . 28 ARG HE 1 1
1 433 1 1 28 ARG HG2 H 55.509 -10.382 -6.231 1.00 . A A . 28 ARG HG2 1 1
1 434 1 1 28 ARG HG3 H 54.015 -10.521 -5.303 1.00 . A A . 28 ARG HG3 1 1
1 435 1 1 28 ARG HH11 H 51.695 -12.045 -7.289 1.00 . A A . 28 ARG HH11 1 1
1 436 1 1 28 ARG HH12 H 51.167 -12.465 -8.884 1.00 . A A . 28 ARG HH12 1 1
1 437 1 1 28 ARG HH21 H 54.105 -11.441 -10.414 1.00 . A A . 28 ARG HH21 1 1
1 438 1 1 28 ARG HH22 H 52.531 -12.123 -10.653 1.00 . A A . 28 ARG HH22 1 1
1 439 1 1 28 ARG N N 54.920 -7.587 -3.285 1.00 . A A . 28 ARG N 1 1
1 440 1 1 28 ARG NE N 53.922 -11.208 -7.960 1.00 . A A . 28 ARG NE 1 1
1 441 1 1 28 ARG NH1 N 51.868 -12.097 -8.273 1.00 . A A . 28 ARG NH1 1 1
1 442 1 1 28 ARG NH2 N 53.232 -11.755 -10.042 1.00 . A A . 28 ARG NH2 1 1
1 443 1 1 28 ARG O O 57.600 -7.388 -3.703 1.00 . A A . 28 ARG O 1 1
1 444 1 1 29 LYS C C 59.046 -7.501 -7.227 1.00 . A A . 29 LYS C 1 1
1 445 1 1 29 LYS CA C 58.994 -8.213 -5.872 1.00 . A A . 29 LYS CA 1 1
1 446 1 1 29 LYS CB C 59.770 -9.537 -5.895 1.00 . A A . 29 LYS CB 1 1
1 447 1 1 29 LYS CD C 62.113 -10.405 -5.765 1.00 . A A . 29 LYS CD 1 1
1 448 1 1 29 LYS CE C 63.349 -10.565 -6.655 1.00 . A A . 29 LYS CE 1 1
1 449 1 1 29 LYS CG C 61.222 -9.292 -6.321 1.00 . A A . 29 LYS CG 1 1
1 450 1 1 29 LYS H H 57.106 -9.187 -6.141 1.00 . A A . 29 LYS H 1 1
1 451 1 1 29 LYS HA H 59.379 -7.573 -5.107 1.00 . A A . 29 LYS HA 1 1
1 452 1 1 29 LYS HB2 H 59.757 -9.975 -4.906 1.00 . A A . 29 LYS HB2 1 1
1 453 1 1 29 LYS HB3 H 59.302 -10.215 -6.592 1.00 . A A . 29 LYS HB3 1 1
1 454 1 1 29 LYS HD2 H 62.421 -10.151 -4.761 1.00 . A A . 29 LYS HD2 1 1
1 455 1 1 29 LYS HD3 H 61.561 -11.333 -5.749 1.00 . A A . 29 LYS HD3 1 1
1 456 1 1 29 LYS HE2 H 63.171 -10.127 -7.628 1.00 . A A . 29 LYS HE2 1 1
1 457 1 1 29 LYS HE3 H 64.210 -10.111 -6.188 1.00 . A A . 29 LYS HE3 1 1
1 458 1 1 29 LYS HG2 H 61.283 -9.287 -7.400 1.00 . A A . 29 LYS HG2 1 1
1 459 1 1 29 LYS HG3 H 61.555 -8.340 -5.937 1.00 . A A . 29 LYS HG3 1 1
1 460 1 1 29 LYS HZ1 H 62.702 -12.468 -7.195 1.00 . A A . 29 LYS HZ1 1 1
1 461 1 1 29 LYS HZ2 H 64.373 -12.226 -7.379 1.00 . A A . 29 LYS HZ2 1 1
1 462 1 1 29 LYS HZ3 H 63.714 -12.441 -5.831 1.00 . A A . 29 LYS HZ3 1 1
1 463 1 1 29 LYS N N 57.594 -8.594 -5.547 1.00 . A A . 29 LYS N 1 1
1 464 1 1 29 LYS NZ N 63.550 -12.036 -6.774 1.00 . A A . 29 LYS NZ 1 1
1 465 1 1 29 LYS O O 58.659 -8.045 -8.244 1.00 . A A . 29 LYS O 1 1
1 466 1 1 30 GLY C C 58.350 -4.626 -8.657 1.00 . A A . 30 GLY C 1 1
1 467 1 1 30 GLY CA C 59.595 -5.505 -8.510 1.00 . A A . 30 GLY CA 1 1
1 468 1 1 30 GLY H H 59.815 -5.866 -6.399 1.00 . A A . 30 GLY H 1 1
1 469 1 1 30 GLY HA2 H 60.476 -4.878 -8.495 1.00 . A A . 30 GLY HA2 1 1
1 470 1 1 30 GLY HA3 H 59.650 -6.186 -9.344 1.00 . A A . 30 GLY HA3 1 1
1 471 1 1 30 GLY N N 59.517 -6.279 -7.237 1.00 . A A . 30 GLY N 1 1
1 472 1 1 30 GLY O O 58.366 -3.638 -9.367 1.00 . A A . 30 GLY O 1 1
1 473 1 1 31 ASP C C 56.175 -2.903 -7.214 1.00 . A A . 31 ASP C 1 1
1 474 1 1 31 ASP CA C 56.035 -4.147 -8.090 1.00 . A A . 31 ASP CA 1 1
1 475 1 1 31 ASP CB C 54.909 -5.045 -7.575 1.00 . A A . 31 ASP CB 1 1
1 476 1 1 31 ASP CG C 53.566 -4.533 -8.099 1.00 . A A . 31 ASP CG 1 1
1 477 1 1 31 ASP H H 57.281 -5.765 -7.419 1.00 . A A . 31 ASP H 1 1
1 478 1 1 31 ASP HA H 55.853 -3.874 -9.113 1.00 . A A . 31 ASP HA 1 1
1 479 1 1 31 ASP HB2 H 55.069 -6.057 -7.920 1.00 . A A . 31 ASP HB2 1 1
1 480 1 1 31 ASP HB3 H 54.901 -5.030 -6.495 1.00 . A A . 31 ASP HB3 1 1
1 481 1 1 31 ASP N N 57.273 -4.971 -7.989 1.00 . A A . 31 ASP N 1 1
1 482 1 1 31 ASP O O 57.042 -2.836 -6.370 1.00 . A A . 31 ASP O 1 1
1 483 1 1 31 ASP OD1 O 53.248 -4.825 -9.240 1.00 . A A . 31 ASP OD1 1 1
1 484 1 1 31 ASP OD2 O 52.880 -3.856 -7.351 1.00 . A A . 31 ASP OD2 1 1
1 485 1 1 32 GLU C C 54.035 -0.336 -6.034 1.00 . A A . 32 GLU C 1 1
1 486 1 1 32 GLU CA C 55.427 -0.679 -6.571 1.00 . A A . 32 GLU CA 1 1
1 487 1 1 32 GLU CB C 55.951 0.434 -7.497 1.00 . A A . 32 GLU CB 1 1
1 488 1 1 32 GLU CD C 56.544 -0.684 -9.658 1.00 . A A . 32 GLU CD 1 1
1 489 1 1 32 GLU CG C 57.106 -0.073 -8.373 1.00 . A A . 32 GLU CG 1 1
1 490 1 1 32 GLU H H 54.641 -1.996 -8.094 1.00 . A A . 32 GLU H 1 1
1 491 1 1 32 GLU HA H 56.112 -0.833 -5.752 1.00 . A A . 32 GLU HA 1 1
1 492 1 1 32 GLU HB2 H 55.155 0.769 -8.123 1.00 . A A . 32 GLU HB2 1 1
1 493 1 1 32 GLU HB3 H 56.300 1.260 -6.900 1.00 . A A . 32 GLU HB3 1 1
1 494 1 1 32 GLU HG2 H 57.756 0.752 -8.623 1.00 . A A . 32 GLU HG2 1 1
1 495 1 1 32 GLU HG3 H 57.663 -0.824 -7.834 1.00 . A A . 32 GLU HG3 1 1
1 496 1 1 32 GLU N N 55.334 -1.921 -7.405 1.00 . A A . 32 GLU N 1 1
1 497 1 1 32 GLU O O 53.041 -0.852 -6.511 1.00 . A A . 32 GLU O 1 1
1 498 1 1 32 GLU OE1 O 56.023 0.065 -10.468 1.00 . A A . 32 GLU OE1 1 1
1 499 1 1 32 GLU OE2 O 56.643 -1.890 -9.810 1.00 . A A . 32 GLU OE2 1 1
1 500 1 1 33 TYR C C 52.444 2.325 -4.251 1.00 . A A . 33 TYR C 1 1
1 501 1 1 33 TYR CA C 52.622 0.816 -4.428 1.00 . A A . 33 TYR CA 1 1
1 502 1 1 33 TYR CB C 52.626 0.144 -3.048 1.00 . A A . 33 TYR CB 1 1
1 503 1 1 33 TYR CD1 C 52.483 -2.277 -3.745 1.00 . A A . 33 TYR CD1 1 1
1 504 1 1 33 TYR CD2 C 54.481 -1.500 -2.614 1.00 . A A . 33 TYR CD2 1 1
1 505 1 1 33 TYR CE1 C 53.035 -3.556 -3.841 1.00 . A A . 33 TYR CE1 1 1
1 506 1 1 33 TYR CE2 C 55.031 -2.779 -2.706 1.00 . A A . 33 TYR CE2 1 1
1 507 1 1 33 TYR CG C 53.207 -1.250 -3.132 1.00 . A A . 33 TYR CG 1 1
1 508 1 1 33 TYR CZ C 54.309 -3.806 -3.320 1.00 . A A . 33 TYR CZ 1 1
1 509 1 1 33 TYR H H 54.756 0.863 -4.623 1.00 . A A . 33 TYR H 1 1
1 510 1 1 33 TYR HA H 51.827 0.408 -5.031 1.00 . A A . 33 TYR HA 1 1
1 511 1 1 33 TYR HB2 H 53.216 0.736 -2.366 1.00 . A A . 33 TYR HB2 1 1
1 512 1 1 33 TYR HB3 H 51.624 0.088 -2.687 1.00 . A A . 33 TYR HB3 1 1
1 513 1 1 33 TYR HD1 H 51.501 -2.082 -4.145 1.00 . A A . 33 TYR HD1 1 1
1 514 1 1 33 TYR HD2 H 55.038 -0.705 -2.140 1.00 . A A . 33 TYR HD2 1 1
1 515 1 1 33 TYR HE1 H 52.479 -4.352 -4.315 1.00 . A A . 33 TYR HE1 1 1
1 516 1 1 33 TYR HE2 H 56.015 -2.975 -2.305 1.00 . A A . 33 TYR HE2 1 1
1 517 1 1 33 TYR HH H 55.074 -5.219 -4.339 1.00 . A A . 33 TYR HH 1 1
1 518 1 1 33 TYR N N 53.952 0.491 -5.020 1.00 . A A . 33 TYR N 1 1
1 519 1 1 33 TYR O O 53.223 3.123 -4.736 1.00 . A A . 33 TYR O 1 1
1 520 1 1 33 TYR OH O 54.854 -5.062 -3.417 1.00 . A A . 33 TYR OH 1 1
1 521 1 1 34 PHE C C 51.129 4.405 -1.771 1.00 . A A . 34 PHE C 1 1
1 522 1 1 34 PHE CA C 51.154 4.150 -3.278 1.00 . A A . 34 PHE CA 1 1
1 523 1 1 34 PHE CB C 49.780 4.418 -3.879 1.00 . A A . 34 PHE CB 1 1
1 524 1 1 34 PHE CD1 C 50.123 3.889 -6.319 1.00 . A A . 34 PHE CD1 1 1
1 525 1 1 34 PHE CD2 C 49.879 6.207 -5.652 1.00 . A A . 34 PHE CD2 1 1
1 526 1 1 34 PHE CE1 C 50.263 4.288 -7.653 1.00 . A A . 34 PHE CE1 1 1
1 527 1 1 34 PHE CE2 C 50.019 6.606 -6.986 1.00 . A A . 34 PHE CE2 1 1
1 528 1 1 34 PHE CG C 49.930 4.849 -5.318 1.00 . A A . 34 PHE CG 1 1
1 529 1 1 34 PHE CZ C 50.211 5.646 -7.987 1.00 . A A . 34 PHE CZ 1 1
1 530 1 1 34 PHE H H 50.823 2.028 -3.151 1.00 . A A . 34 PHE H 1 1
1 531 1 1 34 PHE HA H 51.899 4.765 -3.757 1.00 . A A . 34 PHE HA 1 1
1 532 1 1 34 PHE HB2 H 49.185 3.517 -3.831 1.00 . A A . 34 PHE HB2 1 1
1 533 1 1 34 PHE HB3 H 49.296 5.198 -3.315 1.00 . A A . 34 PHE HB3 1 1
1 534 1 1 34 PHE HD1 H 50.163 2.841 -6.062 1.00 . A A . 34 PHE HD1 1 1
1 535 1 1 34 PHE HD2 H 49.730 6.948 -4.879 1.00 . A A . 34 PHE HD2 1 1
1 536 1 1 34 PHE HE1 H 50.412 3.547 -8.425 1.00 . A A . 34 PHE HE1 1 1
1 537 1 1 34 PHE HE2 H 49.979 7.654 -7.244 1.00 . A A . 34 PHE HE2 1 1
1 538 1 1 34 PHE HZ H 50.320 5.954 -9.017 1.00 . A A . 34 PHE HZ 1 1
1 539 1 1 34 PHE N N 51.419 2.705 -3.534 1.00 . A A . 34 PHE N 1 1
1 540 1 1 34 PHE O O 50.378 3.783 -1.044 1.00 . A A . 34 PHE O 1 1
1 541 1 1 35 ILE C C 50.973 6.672 0.553 1.00 . A A . 35 ILE C 1 1
1 542 1 1 35 ILE CA C 51.992 5.599 0.168 1.00 . A A . 35 ILE CA 1 1
1 543 1 1 35 ILE CB C 53.416 6.101 0.438 1.00 . A A . 35 ILE CB 1 1
1 544 1 1 35 ILE CD1 C 54.232 3.729 0.706 1.00 . A A . 35 ILE CD1 1 1
1 545 1 1 35 ILE CG1 C 54.450 5.061 -0.021 1.00 . A A . 35 ILE CG1 1 1
1 546 1 1 35 ILE CG2 C 53.595 6.369 1.937 1.00 . A A . 35 ILE CG2 1 1
1 547 1 1 35 ILE H H 52.540 5.789 -1.911 1.00 . A A . 35 ILE H 1 1
1 548 1 1 35 ILE HA H 51.813 4.701 0.733 1.00 . A A . 35 ILE HA 1 1
1 549 1 1 35 ILE HB H 53.570 7.019 -0.104 1.00 . A A . 35 ILE HB 1 1
1 550 1 1 35 ILE HD11 H 53.640 3.896 1.595 1.00 . A A . 35 ILE HD11 1 1
1 551 1 1 35 ILE HD12 H 53.715 3.043 0.053 1.00 . A A . 35 ILE HD12 1 1
1 552 1 1 35 ILE HD13 H 55.187 3.311 0.982 1.00 . A A . 35 ILE HD13 1 1
1 553 1 1 35 ILE HG12 H 54.354 4.907 -1.086 1.00 . A A . 35 ILE HG12 1 1
1 554 1 1 35 ILE HG13 H 55.442 5.427 0.199 1.00 . A A . 35 ILE HG13 1 1
1 555 1 1 35 ILE HG21 H 53.228 5.524 2.500 1.00 . A A . 35 ILE HG21 1 1
1 556 1 1 35 ILE HG22 H 54.643 6.517 2.153 1.00 . A A . 35 ILE HG22 1 1
1 557 1 1 35 ILE HG23 H 53.042 7.254 2.213 1.00 . A A . 35 ILE HG23 1 1
1 558 1 1 35 ILE N N 51.947 5.308 -1.300 1.00 . A A . 35 ILE N 1 1
1 559 1 1 35 ILE O O 50.884 7.715 -0.067 1.00 . A A . 35 ILE O 1 1
1 560 1 1 36 LEU C C 49.609 7.951 3.443 1.00 . A A . 36 LEU C 1 1
1 561 1 1 36 LEU CA C 49.213 7.417 2.059 1.00 . A A . 36 LEU CA 1 1
1 562 1 1 36 LEU CB C 47.894 6.647 2.143 1.00 . A A . 36 LEU CB 1 1
1 563 1 1 36 LEU CD1 C 47.775 5.025 0.244 1.00 . A A . 36 LEU CD1 1 1
1 564 1 1 36 LEU CD2 C 45.814 6.483 0.766 1.00 . A A . 36 LEU CD2 1 1
1 565 1 1 36 LEU CG C 47.343 6.409 0.735 1.00 . A A . 36 LEU CG 1 1
1 566 1 1 36 LEU H H 50.328 5.576 2.075 1.00 . A A . 36 LEU H 1 1
1 567 1 1 36 LEU HA H 49.125 8.226 1.352 1.00 . A A . 36 LEU HA 1 1
1 568 1 1 36 LEU HB2 H 48.062 5.699 2.630 1.00 . A A . 36 LEU HB2 1 1
1 569 1 1 36 LEU HB3 H 47.179 7.222 2.714 1.00 . A A . 36 LEU HB3 1 1
1 570 1 1 36 LEU HD11 H 47.415 4.272 0.929 1.00 . A A . 36 LEU HD11 1 1
1 571 1 1 36 LEU HD12 H 47.361 4.846 -0.738 1.00 . A A . 36 LEU HD12 1 1
1 572 1 1 36 LEU HD13 H 48.853 4.981 0.194 1.00 . A A . 36 LEU HD13 1 1
1 573 1 1 36 LEU HD21 H 45.506 7.308 1.392 1.00 . A A . 36 LEU HD21 1 1
1 574 1 1 36 LEU HD22 H 45.439 6.632 -0.235 1.00 . A A . 36 LEU HD22 1 1
1 575 1 1 36 LEU HD23 H 45.417 5.561 1.166 1.00 . A A . 36 LEU HD23 1 1
1 576 1 1 36 LEU HG H 47.729 7.165 0.066 1.00 . A A . 36 LEU HG 1 1
1 577 1 1 36 LEU N N 50.220 6.422 1.591 1.00 . A A . 36 LEU N 1 1
1 578 1 1 36 LEU O O 49.191 9.022 3.843 1.00 . A A . 36 LEU O 1 1
1 579 1 1 37 GLU C C 52.356 7.721 5.646 1.00 . A A . 37 GLU C 1 1
1 580 1 1 37 GLU CA C 50.827 7.671 5.537 1.00 . A A . 37 GLU CA 1 1
1 581 1 1 37 GLU CB C 50.254 6.631 6.501 1.00 . A A . 37 GLU CB 1 1
1 582 1 1 37 GLU CD C 48.445 6.608 8.228 1.00 . A A . 37 GLU CD 1 1
1 583 1 1 37 GLU CG C 49.706 7.331 7.748 1.00 . A A . 37 GLU CG 1 1
1 584 1 1 37 GLU H H 50.731 6.351 3.841 1.00 . A A . 37 GLU H 1 1
1 585 1 1 37 GLU HA H 50.405 8.641 5.749 1.00 . A A . 37 GLU HA 1 1
1 586 1 1 37 GLU HB2 H 49.458 6.089 6.011 1.00 . A A . 37 GLU HB2 1 1
1 587 1 1 37 GLU HB3 H 51.032 5.942 6.792 1.00 . A A . 37 GLU HB3 1 1
1 588 1 1 37 GLU HG2 H 50.452 7.311 8.529 1.00 . A A . 37 GLU HG2 1 1
1 589 1 1 37 GLU HG3 H 49.461 8.355 7.509 1.00 . A A . 37 GLU HG3 1 1
1 590 1 1 37 GLU N N 50.409 7.211 4.179 1.00 . A A . 37 GLU N 1 1
1 591 1 1 37 GLU O O 53.059 7.727 4.656 1.00 . A A . 37 GLU O 1 1
1 592 1 1 37 GLU OE1 O 47.680 6.171 7.385 1.00 . A A . 37 GLU OE1 1 1
1 593 1 1 37 GLU OE2 O 48.267 6.505 9.431 1.00 . A A . 37 GLU OE2 1 1
1 594 1 1 38 GLU C C 54.552 7.891 8.597 1.00 . A A . 38 GLU C 1 1
1 595 1 1 38 GLU CA C 54.338 7.811 7.091 1.00 . A A . 38 GLU CA 1 1
1 596 1 1 38 GLU CB C 54.848 9.092 6.409 1.00 . A A . 38 GLU CB 1 1
1 597 1 1 38 GLU CD C 55.035 11.483 7.137 1.00 . A A . 38 GLU CD 1 1
1 598 1 1 38 GLU CG C 54.072 10.312 6.925 1.00 . A A . 38 GLU CG 1 1
1 599 1 1 38 GLU H H 52.268 7.742 7.630 1.00 . A A . 38 GLU H 1 1
1 600 1 1 38 GLU HA H 54.826 6.939 6.681 1.00 . A A . 38 GLU HA 1 1
1 601 1 1 38 GLU HB2 H 55.900 9.216 6.625 1.00 . A A . 38 GLU HB2 1 1
1 602 1 1 38 GLU HB3 H 54.711 9.007 5.345 1.00 . A A . 38 GLU HB3 1 1
1 603 1 1 38 GLU HG2 H 53.321 10.591 6.200 1.00 . A A . 38 GLU HG2 1 1
1 604 1 1 38 GLU HG3 H 53.594 10.068 7.861 1.00 . A A . 38 GLU HG3 1 1
1 605 1 1 38 GLU N N 52.864 7.756 6.854 1.00 . A A . 38 GLU N 1 1
1 606 1 1 38 GLU O O 55.340 8.676 9.089 1.00 . A A . 38 GLU O 1 1
1 607 1 1 38 GLU OE1 O 56.038 11.286 7.802 1.00 . A A . 38 GLU OE1 1 1
1 608 1 1 38 GLU OE2 O 54.752 12.556 6.630 1.00 . A A . 38 GLU OE2 1 1
1 609 1 1 39 SER C C 55.349 6.899 11.277 1.00 . A A . 39 SER C 1 1
1 610 1 1 39 SER CA C 53.908 7.106 10.815 1.00 . A A . 39 SER CA 1 1
1 611 1 1 39 SER CB C 53.036 5.937 11.269 1.00 . A A . 39 SER CB 1 1
1 612 1 1 39 SER H H 53.174 6.499 8.883 1.00 . A A . 39 SER H 1 1
1 613 1 1 39 SER HA H 53.515 8.029 11.210 1.00 . A A . 39 SER HA 1 1
1 614 1 1 39 SER HB2 H 53.351 5.034 10.765 1.00 . A A . 39 SER HB2 1 1
1 615 1 1 39 SER HB3 H 53.137 5.808 12.338 1.00 . A A . 39 SER HB3 1 1
1 616 1 1 39 SER HG H 51.324 5.437 10.489 1.00 . A A . 39 SER HG 1 1
1 617 1 1 39 SER N N 53.814 7.096 9.325 1.00 . A A . 39 SER N 1 1
1 618 1 1 39 SER O O 56.276 6.900 10.488 1.00 . A A . 39 SER O 1 1
1 619 1 1 39 SER OG O 51.680 6.208 10.938 1.00 . A A . 39 SER OG 1 1
1 620 1 1 40 ASN C C 57.281 5.012 13.063 1.00 . A A . 40 ASN C 1 1
1 621 1 1 40 ASN CA C 56.912 6.499 13.085 1.00 . A A . 40 ASN CA 1 1
1 622 1 1 40 ASN CB C 56.861 7.012 14.525 1.00 . A A . 40 ASN CB 1 1
1 623 1 1 40 ASN CG C 56.647 8.527 14.521 1.00 . A A . 40 ASN CG 1 1
1 624 1 1 40 ASN H H 54.773 6.708 13.166 1.00 . A A . 40 ASN H 1 1
1 625 1 1 40 ASN HA H 57.628 7.072 12.518 1.00 . A A . 40 ASN HA 1 1
1 626 1 1 40 ASN HB2 H 56.046 6.534 15.048 1.00 . A A . 40 ASN HB2 1 1
1 627 1 1 40 ASN HB3 H 57.792 6.784 15.022 1.00 . A A . 40 ASN HB3 1 1
1 628 1 1 40 ASN HD21 H 55.766 8.550 16.300 1.00 . A A . 40 ASN HD21 1 1
1 629 1 1 40 ASN HD22 H 55.921 10.064 15.548 1.00 . A A . 40 ASN HD22 1 1
1 630 1 1 40 ASN N N 55.539 6.711 12.554 1.00 . A A . 40 ASN N 1 1
1 631 1 1 40 ASN ND2 N 56.062 9.094 15.541 1.00 . A A . 40 ASN ND2 1 1
1 632 1 1 40 ASN O O 58.109 4.573 13.839 1.00 . A A . 40 ASN O 1 1
1 633 1 1 40 ASN OD1 O 57.014 9.203 13.580 1.00 . A A . 40 ASN OD1 1 1
1 634 1 1 41 LEU C C 57.292 2.302 10.700 1.00 . A A . 41 LEU C 1 1
1 635 1 1 41 LEU CA C 57.046 2.776 12.145 1.00 . A A . 41 LEU CA 1 1
1 636 1 1 41 LEU CB C 55.867 2.022 12.770 1.00 . A A . 41 LEU CB 1 1
1 637 1 1 41 LEU CD1 C 53.678 1.123 11.973 1.00 . A A . 41 LEU CD1 1 1
1 638 1 1 41 LEU CD2 C 53.830 3.470 12.803 1.00 . A A . 41 LEU CD2 1 1
1 639 1 1 41 LEU CG C 54.565 2.366 12.040 1.00 . A A . 41 LEU CG 1 1
1 640 1 1 41 LEU H H 56.020 4.594 11.552 1.00 . A A . 41 LEU H 1 1
1 641 1 1 41 LEU HA H 57.931 2.608 12.738 1.00 . A A . 41 LEU HA 1 1
1 642 1 1 41 LEU HB2 H 56.052 0.958 12.694 1.00 . A A . 41 LEU HB2 1 1
1 643 1 1 41 LEU HB3 H 55.779 2.296 13.811 1.00 . A A . 41 LEU HB3 1 1
1 644 1 1 41 LEU HD11 H 54.283 0.263 11.729 1.00 . A A . 41 LEU HD11 1 1
1 645 1 1 41 LEU HD12 H 53.205 0.968 12.931 1.00 . A A . 41 LEU HD12 1 1
1 646 1 1 41 LEU HD13 H 52.921 1.259 11.216 1.00 . A A . 41 LEU HD13 1 1
1 647 1 1 41 LEU HD21 H 53.649 3.146 13.818 1.00 . A A . 41 LEU HD21 1 1
1 648 1 1 41 LEU HD22 H 54.433 4.365 12.814 1.00 . A A . 41 LEU HD22 1 1
1 649 1 1 41 LEU HD23 H 52.887 3.677 12.318 1.00 . A A . 41 LEU HD23 1 1
1 650 1 1 41 LEU HG H 54.790 2.704 11.038 1.00 . A A . 41 LEU HG 1 1
1 651 1 1 41 LEU N N 56.688 4.229 12.183 1.00 . A A . 41 LEU N 1 1
1 652 1 1 41 LEU O O 56.830 2.929 9.767 1.00 . A A . 41 LEU O 1 1
1 653 1 1 42 PRO C C 57.048 0.340 8.432 1.00 . A A . 42 PRO C 1 1
1 654 1 1 42 PRO CA C 58.331 0.677 9.198 1.00 . A A . 42 PRO CA 1 1
1 655 1 1 42 PRO CB C 59.129 -0.597 9.505 1.00 . A A . 42 PRO CB 1 1
1 656 1 1 42 PRO CD C 58.589 0.448 11.704 1.00 . A A . 42 PRO CD 1 1
1 657 1 1 42 PRO CG C 59.245 -0.757 11.031 1.00 . A A . 42 PRO CG 1 1
1 658 1 1 42 PRO HA H 58.941 1.369 8.642 1.00 . A A . 42 PRO HA 1 1
1 659 1 1 42 PRO HB2 H 58.622 -1.456 9.087 1.00 . A A . 42 PRO HB2 1 1
1 660 1 1 42 PRO HB3 H 60.117 -0.517 9.078 1.00 . A A . 42 PRO HB3 1 1
1 661 1 1 42 PRO HD2 H 57.806 0.126 12.377 1.00 . A A . 42 PRO HD2 1 1
1 662 1 1 42 PRO HD3 H 59.323 1.045 12.222 1.00 . A A . 42 PRO HD3 1 1
1 663 1 1 42 PRO HG2 H 58.739 -1.660 11.340 1.00 . A A . 42 PRO HG2 1 1
1 664 1 1 42 PRO HG3 H 60.283 -0.804 11.316 1.00 . A A . 42 PRO HG3 1 1
1 665 1 1 42 PRO N N 58.027 1.208 10.551 1.00 . A A . 42 PRO N 1 1
1 666 1 1 42 PRO O O 56.966 0.538 7.234 1.00 . A A . 42 PRO O 1 1
1 667 1 1 43 TRP C C 53.934 0.697 8.173 1.00 . A A . 43 TRP C 1 1
1 668 1 1 43 TRP CA C 54.787 -0.551 8.411 1.00 . A A . 43 TRP CA 1 1
1 669 1 1 43 TRP CB C 54.063 -1.512 9.360 1.00 . A A . 43 TRP CB 1 1
1 670 1 1 43 TRP CD1 C 55.765 -2.713 10.748 1.00 . A A . 43 TRP CD1 1 1
1 671 1 1 43 TRP CD2 C 55.063 -3.967 9.025 1.00 . A A . 43 TRP CD2 1 1
1 672 1 1 43 TRP CE2 C 56.011 -4.745 9.732 1.00 . A A . 43 TRP CE2 1 1
1 673 1 1 43 TRP CE3 C 54.463 -4.531 7.885 1.00 . A A . 43 TRP CE3 1 1
1 674 1 1 43 TRP CG C 54.933 -2.679 9.698 1.00 . A A . 43 TRP CG 1 1
1 675 1 1 43 TRP CH2 C 55.742 -6.581 8.191 1.00 . A A . 43 TRP CH2 1 1
1 676 1 1 43 TRP CZ2 C 56.350 -6.036 9.325 1.00 . A A . 43 TRP CZ2 1 1
1 677 1 1 43 TRP CZ3 C 54.801 -5.830 7.473 1.00 . A A . 43 TRP CZ3 1 1
1 678 1 1 43 TRP H H 56.151 -0.344 10.068 1.00 . A A . 43 TRP H 1 1
1 679 1 1 43 TRP HA H 55.001 -1.046 7.477 1.00 . A A . 43 TRP HA 1 1
1 680 1 1 43 TRP HB2 H 53.805 -0.990 10.267 1.00 . A A . 43 TRP HB2 1 1
1 681 1 1 43 TRP HB3 H 53.170 -1.865 8.893 1.00 . A A . 43 TRP HB3 1 1
1 682 1 1 43 TRP HD1 H 55.900 -1.911 11.449 1.00 . A A . 43 TRP HD1 1 1
1 683 1 1 43 TRP HE1 H 57.073 -4.211 11.445 1.00 . A A . 43 TRP HE1 1 1
1 684 1 1 43 TRP HE3 H 53.739 -3.963 7.321 1.00 . A A . 43 TRP HE3 1 1
1 685 1 1 43 TRP HH2 H 55.997 -7.579 7.868 1.00 . A A . 43 TRP HH2 1 1
1 686 1 1 43 TRP HZ2 H 57.075 -6.610 9.882 1.00 . A A . 43 TRP HZ2 1 1
1 687 1 1 43 TRP HZ3 H 54.333 -6.254 6.597 1.00 . A A . 43 TRP HZ3 1 1
1 688 1 1 43 TRP N N 56.057 -0.182 9.107 1.00 . A A . 43 TRP N 1 1
1 689 1 1 43 TRP NE1 N 56.411 -3.935 10.776 1.00 . A A . 43 TRP NE1 1 1
1 690 1 1 43 TRP O O 53.613 1.425 9.093 1.00 . A A . 43 TRP O 1 1
1 691 1 1 44 TRP C C 51.327 1.705 6.218 1.00 . A A . 44 TRP C 1 1
1 692 1 1 44 TRP CA C 52.738 2.141 6.625 1.00 . A A . 44 TRP CA 1 1
1 693 1 1 44 TRP CB C 53.419 2.779 5.412 1.00 . A A . 44 TRP CB 1 1
1 694 1 1 44 TRP CD1 C 55.360 3.523 6.888 1.00 . A A . 44 TRP CD1 1 1
1 695 1 1 44 TRP CD2 C 55.918 3.205 4.735 1.00 . A A . 44 TRP CD2 1 1
1 696 1 1 44 TRP CE2 C 57.099 3.605 5.394 1.00 . A A . 44 TRP CE2 1 1
1 697 1 1 44 TRP CE3 C 55.975 2.937 3.360 1.00 . A A . 44 TRP CE3 1 1
1 698 1 1 44 TRP CG C 54.837 3.150 5.693 1.00 . A A . 44 TRP CG 1 1
1 699 1 1 44 TRP CH2 C 58.345 3.468 3.328 1.00 . A A . 44 TRP CH2 1 1
1 700 1 1 44 TRP CZ2 C 58.306 3.738 4.703 1.00 . A A . 44 TRP CZ2 1 1
1 701 1 1 44 TRP CZ3 C 57.176 3.068 2.659 1.00 . A A . 44 TRP CZ3 1 1
1 702 1 1 44 TRP H H 53.841 0.346 6.221 1.00 . A A . 44 TRP H 1 1
1 703 1 1 44 TRP HA H 52.712 2.833 7.451 1.00 . A A . 44 TRP HA 1 1
1 704 1 1 44 TRP HB2 H 53.406 2.075 4.586 1.00 . A A . 44 TRP HB2 1 1
1 705 1 1 44 TRP HB3 H 52.877 3.661 5.126 1.00 . A A . 44 TRP HB3 1 1
1 706 1 1 44 TRP HD1 H 54.817 3.598 7.823 1.00 . A A . 44 TRP HD1 1 1
1 707 1 1 44 TRP HE1 H 57.329 4.072 7.417 1.00 . A A . 44 TRP HE1 1 1
1 708 1 1 44 TRP HE3 H 55.081 2.628 2.839 1.00 . A A . 44 TRP HE3 1 1
1 709 1 1 44 TRP HH2 H 59.272 3.569 2.783 1.00 . A A . 44 TRP HH2 1 1
1 710 1 1 44 TRP HZ2 H 59.200 4.046 5.224 1.00 . A A . 44 TRP HZ2 1 1
1 711 1 1 44 TRP HZ3 H 57.197 2.862 1.599 1.00 . A A . 44 TRP HZ3 1 1
1 712 1 1 44 TRP N N 53.568 0.946 6.943 1.00 . A A . 44 TRP N 1 1
1 713 1 1 44 TRP NE1 N 56.711 3.788 6.711 1.00 . A A . 44 TRP NE1 1 1
1 714 1 1 44 TRP O O 50.919 0.587 6.451 1.00 . A A . 44 TRP O 1 1
1 715 1 1 45 ARG C C 49.209 2.625 3.590 1.00 . A A . 45 ARG C 1 1
1 716 1 1 45 ARG CA C 49.247 2.243 5.072 1.00 . A A . 45 ARG CA 1 1
1 717 1 1 45 ARG CB C 48.288 3.109 5.890 1.00 . A A . 45 ARG CB 1 1
1 718 1 1 45 ARG CD C 46.188 3.033 7.242 1.00 . A A . 45 ARG CD 1 1
1 719 1 1 45 ARG CG C 46.987 2.342 6.134 1.00 . A A . 45 ARG CG 1 1
1 720 1 1 45 ARG CZ C 44.039 2.487 8.213 1.00 . A A . 45 ARG CZ 1 1
1 721 1 1 45 ARG H H 50.982 3.460 5.370 1.00 . A A . 45 ARG H 1 1
1 722 1 1 45 ARG HA H 49.038 1.193 5.213 1.00 . A A . 45 ARG HA 1 1
1 723 1 1 45 ARG HB2 H 48.745 3.356 6.837 1.00 . A A . 45 ARG HB2 1 1
1 724 1 1 45 ARG HB3 H 48.071 4.017 5.347 1.00 . A A . 45 ARG HB3 1 1
1 725 1 1 45 ARG HD2 H 46.825 3.230 8.094 1.00 . A A . 45 ARG HD2 1 1
1 726 1 1 45 ARG HD3 H 45.752 3.949 6.876 1.00 . A A . 45 ARG HD3 1 1
1 727 1 1 45 ARG HE H 45.215 1.116 7.390 1.00 . A A . 45 ARG HE 1 1
1 728 1 1 45 ARG HG2 H 46.403 2.325 5.225 1.00 . A A . 45 ARG HG2 1 1
1 729 1 1 45 ARG HG3 H 47.216 1.331 6.435 1.00 . A A . 45 ARG HG3 1 1
1 730 1 1 45 ARG HH11 H 45.022 3.126 9.836 1.00 . A A . 45 ARG HH11 1 1
1 731 1 1 45 ARG HH12 H 43.305 3.354 9.862 1.00 . A A . 45 ARG HH12 1 1
1 732 1 1 45 ARG HH21 H 42.806 1.947 6.732 1.00 . A A . 45 ARG HH21 1 1
1 733 1 1 45 ARG HH22 H 42.050 2.687 8.104 1.00 . A A . 45 ARG HH22 1 1
1 734 1 1 45 ARG N N 50.608 2.579 5.567 1.00 . A A . 45 ARG N 1 1
1 735 1 1 45 ARG NE N 45.115 2.067 7.606 1.00 . A A . 45 ARG NE 1 1
1 736 1 1 45 ARG NH1 N 44.129 3.032 9.396 1.00 . A A . 45 ARG NH1 1 1
1 737 1 1 45 ARG NH2 N 42.874 2.364 7.638 1.00 . A A . 45 ARG NH2 1 1
1 738 1 1 45 ARG O O 48.627 3.620 3.207 1.00 . A A . 45 ARG O 1 1
1 739 1 1 46 ALA C C 49.055 1.226 0.502 1.00 . A A . 46 ALA C 1 1
1 740 1 1 46 ALA CA C 49.943 2.176 1.308 1.00 . A A . 46 ALA CA 1 1
1 741 1 1 46 ALA CB C 51.427 1.980 0.946 1.00 . A A . 46 ALA CB 1 1
1 742 1 1 46 ALA H H 50.352 1.078 3.114 1.00 . A A . 46 ALA H 1 1
1 743 1 1 46 ALA HA H 49.656 3.200 1.133 1.00 . A A . 46 ALA HA 1 1
1 744 1 1 46 ALA HB1 H 52.019 1.944 1.850 1.00 . A A . 46 ALA HB1 1 1
1 745 1 1 46 ALA HB2 H 51.550 1.059 0.400 1.00 . A A . 46 ALA HB2 1 1
1 746 1 1 46 ALA HB3 H 51.765 2.801 0.335 1.00 . A A . 46 ALA HB3 1 1
1 747 1 1 46 ALA N N 49.873 1.856 2.766 1.00 . A A . 46 ALA N 1 1
1 748 1 1 46 ALA O O 48.739 0.137 0.942 1.00 . A A . 46 ALA O 1 1
1 749 1 1 47 ARG C C 48.557 0.230 -2.721 1.00 . A A . 47 ARG C 1 1
1 750 1 1 47 ARG CA C 47.782 0.755 -1.517 1.00 . A A . 47 ARG CA 1 1
1 751 1 1 47 ARG CB C 46.637 1.640 -1.996 1.00 . A A . 47 ARG CB 1 1
1 752 1 1 47 ARG CD C 45.211 3.444 -1.000 1.00 . A A . 47 ARG CD 1 1
1 753 1 1 47 ARG CG C 45.743 2.016 -0.817 1.00 . A A . 47 ARG CG 1 1
1 754 1 1 47 ARG CZ C 43.089 4.079 -1.978 1.00 . A A . 47 ARG CZ 1 1
1 755 1 1 47 ARG H H 48.919 2.518 -1.011 1.00 . A A . 47 ARG H 1 1
1 756 1 1 47 ARG HA H 47.394 -0.064 -0.932 1.00 . A A . 47 ARG HA 1 1
1 757 1 1 47 ARG HB2 H 47.037 2.536 -2.448 1.00 . A A . 47 ARG HB2 1 1
1 758 1 1 47 ARG HB3 H 46.056 1.096 -2.724 1.00 . A A . 47 ARG HB3 1 1
1 759 1 1 47 ARG HD2 H 45.432 4.039 -0.125 1.00 . A A . 47 ARG HD2 1 1
1 760 1 1 47 ARG HD3 H 45.637 3.899 -1.881 1.00 . A A . 47 ARG HD3 1 1
1 761 1 1 47 ARG HE H 43.259 2.598 -0.667 1.00 . A A . 47 ARG HE 1 1
1 762 1 1 47 ARG HG2 H 44.916 1.323 -0.766 1.00 . A A . 47 ARG HG2 1 1
1 763 1 1 47 ARG HG3 H 46.314 1.961 0.098 1.00 . A A . 47 ARG HG3 1 1
1 764 1 1 47 ARG HH11 H 43.996 5.743 -1.333 1.00 . A A . 47 ARG HH11 1 1
1 765 1 1 47 ARG HH12 H 42.822 5.967 -2.587 1.00 . A A . 47 ARG HH12 1 1
1 766 1 1 47 ARG HH21 H 42.031 2.598 -2.812 1.00 . A A . 47 ARG HH21 1 1
1 767 1 1 47 ARG HH22 H 41.709 4.186 -3.425 1.00 . A A . 47 ARG HH22 1 1
1 768 1 1 47 ARG N N 48.650 1.633 -0.678 1.00 . A A . 47 ARG N 1 1
1 769 1 1 47 ARG NE N 43.739 3.291 -1.167 1.00 . A A . 47 ARG NE 1 1
1 770 1 1 47 ARG NH1 N 43.320 5.363 -1.965 1.00 . A A . 47 ARG NH1 1 1
1 771 1 1 47 ARG NH2 N 42.208 3.582 -2.803 1.00 . A A . 47 ARG NH2 1 1
1 772 1 1 47 ARG O O 49.562 0.788 -3.114 1.00 . A A . 47 ARG O 1 1
1 773 1 1 48 ASP C C 48.083 -0.943 -5.787 1.00 . A A . 48 ASP C 1 1
1 774 1 1 48 ASP CA C 48.778 -1.405 -4.497 1.00 . A A . 48 ASP CA 1 1
1 775 1 1 48 ASP CB C 48.671 -2.925 -4.309 1.00 . A A . 48 ASP CB 1 1
1 776 1 1 48 ASP CG C 47.203 -3.377 -4.353 1.00 . A A . 48 ASP CG 1 1
1 777 1 1 48 ASP H H 47.271 -1.257 -2.975 1.00 . A A . 48 ASP H 1 1
1 778 1 1 48 ASP HA H 49.814 -1.104 -4.503 1.00 . A A . 48 ASP HA 1 1
1 779 1 1 48 ASP HB2 H 49.218 -3.418 -5.090 1.00 . A A . 48 ASP HB2 1 1
1 780 1 1 48 ASP HB3 H 49.095 -3.195 -3.355 1.00 . A A . 48 ASP HB3 1 1
1 781 1 1 48 ASP N N 48.086 -0.834 -3.311 1.00 . A A . 48 ASP N 1 1
1 782 1 1 48 ASP O O 47.472 0.109 -5.826 1.00 . A A . 48 ASP O 1 1
1 783 1 1 48 ASP OD1 O 46.337 -2.560 -4.084 1.00 . A A . 48 ASP OD1 1 1
1 784 1 1 48 ASP OD2 O 46.972 -4.536 -4.656 1.00 . A A . 48 ASP OD2 1 1
1 785 1 1 49 LYS C C 46.141 -1.995 -8.238 1.00 . A A . 49 LYS C 1 1
1 786 1 1 49 LYS CA C 47.516 -1.331 -8.121 1.00 . A A . 49 LYS CA 1 1
1 787 1 1 49 LYS CB C 48.454 -1.842 -9.216 1.00 . A A . 49 LYS CB 1 1
1 788 1 1 49 LYS CD C 50.234 -0.853 -10.668 1.00 . A A . 49 LYS CD 1 1
1 789 1 1 49 LYS CE C 49.687 0.443 -11.269 1.00 . A A . 49 LYS CE 1 1
1 790 1 1 49 LYS CG C 49.732 -1.000 -9.229 1.00 . A A . 49 LYS CG 1 1
1 791 1 1 49 LYS H H 48.668 -2.563 -6.780 1.00 . A A . 49 LYS H 1 1
1 792 1 1 49 LYS HA H 47.424 -0.259 -8.186 1.00 . A A . 49 LYS HA 1 1
1 793 1 1 49 LYS HB2 H 48.704 -2.876 -9.021 1.00 . A A . 49 LYS HB2 1 1
1 794 1 1 49 LYS HB3 H 47.964 -1.764 -10.174 1.00 . A A . 49 LYS HB3 1 1
1 795 1 1 49 LYS HD2 H 51.314 -0.826 -10.671 1.00 . A A . 49 LYS HD2 1 1
1 796 1 1 49 LYS HD3 H 49.893 -1.692 -11.255 1.00 . A A . 49 LYS HD3 1 1
1 797 1 1 49 LYS HE2 H 48.650 0.576 -10.993 1.00 . A A . 49 LYS HE2 1 1
1 798 1 1 49 LYS HE3 H 50.275 1.287 -10.944 1.00 . A A . 49 LYS HE3 1 1
1 799 1 1 49 LYS HG2 H 49.524 -0.023 -8.818 1.00 . A A . 49 LYS HG2 1 1
1 800 1 1 49 LYS HG3 H 50.491 -1.487 -8.634 1.00 . A A . 49 LYS HG3 1 1
1 801 1 1 49 LYS HZ1 H 49.292 -0.583 -13.037 1.00 . A A . 49 LYS HZ1 1 1
1 802 1 1 49 LYS HZ2 H 49.427 1.100 -13.227 1.00 . A A . 49 LYS HZ2 1 1
1 803 1 1 49 LYS HZ3 H 50.819 0.161 -12.993 1.00 . A A . 49 LYS HZ3 1 1
1 804 1 1 49 LYS N N 48.171 -1.721 -6.837 1.00 . A A . 49 LYS N 1 1
1 805 1 1 49 LYS NZ N 49.816 0.267 -12.743 1.00 . A A . 49 LYS NZ 1 1
1 806 1 1 49 LYS O O 45.722 -2.384 -9.312 1.00 . A A . 49 LYS O 1 1
1 807 1 1 50 ASN C C 43.090 -1.939 -6.345 1.00 . A A . 50 ASN C 1 1
1 808 1 1 50 ASN CA C 44.091 -2.752 -7.177 1.00 . A A . 50 ASN CA 1 1
1 809 1 1 50 ASN CB C 44.287 -4.143 -6.572 1.00 . A A . 50 ASN CB 1 1
1 810 1 1 50 ASN CG C 44.675 -5.131 -7.674 1.00 . A A . 50 ASN CG 1 1
1 811 1 1 50 ASN H H 45.794 -1.799 -6.296 1.00 . A A . 50 ASN H 1 1
1 812 1 1 50 ASN HA H 43.755 -2.837 -8.190 1.00 . A A . 50 ASN HA 1 1
1 813 1 1 50 ASN HB2 H 45.070 -4.106 -5.829 1.00 . A A . 50 ASN HB2 1 1
1 814 1 1 50 ASN HB3 H 43.367 -4.467 -6.109 1.00 . A A . 50 ASN HB3 1 1
1 815 1 1 50 ASN HD21 H 43.959 -6.710 -6.707 1.00 . A A . 50 ASN HD21 1 1
1 816 1 1 50 ASN HD22 H 44.650 -7.040 -8.222 1.00 . A A . 50 ASN HD22 1 1
1 817 1 1 50 ASN N N 45.438 -2.122 -7.141 1.00 . A A . 50 ASN N 1 1
1 818 1 1 50 ASN ND2 N 44.406 -6.399 -7.521 1.00 . A A . 50 ASN ND2 1 1
1 819 1 1 50 ASN O O 42.062 -2.445 -5.937 1.00 . A A . 50 ASN O 1 1
1 820 1 1 50 ASN OD1 O 45.228 -4.745 -8.685 1.00 . A A . 50 ASN OD1 1 1
1 821 1 1 51 GLY C C 42.279 -0.432 -3.893 1.00 . A A . 51 GLY C 1 1
1 822 1 1 51 GLY CA C 42.446 0.162 -5.294 1.00 . A A . 51 GLY CA 1 1
1 823 1 1 51 GLY H H 44.213 -0.297 -6.436 1.00 . A A . 51 GLY H 1 1
1 824 1 1 51 GLY HA2 H 42.846 1.163 -5.216 1.00 . A A . 51 GLY HA2 1 1
1 825 1 1 51 GLY HA3 H 41.484 0.197 -5.783 1.00 . A A . 51 GLY HA3 1 1
1 826 1 1 51 GLY N N 43.381 -0.684 -6.095 1.00 . A A . 51 GLY N 1 1
1 827 1 1 51 GLY O O 41.241 -0.293 -3.272 1.00 . A A . 51 GLY O 1 1
1 828 1 1 52 GLN C C 44.313 -1.156 -1.132 1.00 . A A . 52 GLN C 1 1
1 829 1 1 52 GLN CA C 43.201 -1.700 -2.033 1.00 . A A . 52 GLN CA 1 1
1 830 1 1 52 GLN CB C 43.381 -3.200 -2.260 1.00 . A A . 52 GLN CB 1 1
1 831 1 1 52 GLN CD C 42.018 -5.265 -1.908 1.00 . A A . 52 GLN CD 1 1
1 832 1 1 52 GLN CG C 42.015 -3.850 -2.489 1.00 . A A . 52 GLN CG 1 1
1 833 1 1 52 GLN H H 44.116 -1.190 -3.915 1.00 . A A . 52 GLN H 1 1
1 834 1 1 52 GLN HA H 42.234 -1.506 -1.598 1.00 . A A . 52 GLN HA 1 1
1 835 1 1 52 GLN HB2 H 44.006 -3.360 -3.127 1.00 . A A . 52 GLN HB2 1 1
1 836 1 1 52 GLN HB3 H 43.847 -3.641 -1.394 1.00 . A A . 52 GLN HB3 1 1
1 837 1 1 52 GLN HE21 H 40.989 -6.041 -3.418 1.00 . A A . 52 GLN HE21 1 1
1 838 1 1 52 GLN HE22 H 41.426 -7.138 -2.198 1.00 . A A . 52 GLN HE22 1 1
1 839 1 1 52 GLN HG2 H 41.250 -3.262 -2.003 1.00 . A A . 52 GLN HG2 1 1
1 840 1 1 52 GLN HG3 H 41.812 -3.899 -3.549 1.00 . A A . 52 GLN HG3 1 1
1 841 1 1 52 GLN N N 43.292 -1.092 -3.394 1.00 . A A . 52 GLN N 1 1
1 842 1 1 52 GLN NE2 N 41.429 -6.228 -2.562 1.00 . A A . 52 GLN NE2 1 1
1 843 1 1 52 GLN O O 45.433 -0.960 -1.565 1.00 . A A . 52 GLN O 1 1
1 844 1 1 52 GLN OE1 O 42.563 -5.497 -0.847 1.00 . A A . 52 GLN OE1 1 1
1 845 1 1 53 GLU C C 45.436 -1.461 2.073 1.00 . A A . 53 GLU C 1 1
1 846 1 1 53 GLU CA C 45.044 -0.386 1.059 1.00 . A A . 53 GLU CA 1 1
1 847 1 1 53 GLU CB C 44.384 0.808 1.762 1.00 . A A . 53 GLU CB 1 1
1 848 1 1 53 GLU CD C 42.682 1.428 3.487 1.00 . A A . 53 GLU CD 1 1
1 849 1 1 53 GLU CG C 43.109 0.357 2.482 1.00 . A A . 53 GLU CG 1 1
1 850 1 1 53 GLU H H 43.099 -1.084 0.440 1.00 . A A . 53 GLU H 1 1
1 851 1 1 53 GLU HA H 45.912 -0.057 0.513 1.00 . A A . 53 GLU HA 1 1
1 852 1 1 53 GLU HB2 H 45.073 1.225 2.482 1.00 . A A . 53 GLU HB2 1 1
1 853 1 1 53 GLU HB3 H 44.132 1.562 1.032 1.00 . A A . 53 GLU HB3 1 1
1 854 1 1 53 GLU HG2 H 42.321 0.207 1.758 1.00 . A A . 53 GLU HG2 1 1
1 855 1 1 53 GLU HG3 H 43.299 -0.568 3.005 1.00 . A A . 53 GLU HG3 1 1
1 856 1 1 53 GLU N N 44.009 -0.915 0.118 1.00 . A A . 53 GLU N 1 1
1 857 1 1 53 GLU O O 44.654 -2.337 2.394 1.00 . A A . 53 GLU O 1 1
1 858 1 1 53 GLU OE1 O 42.302 2.502 3.051 1.00 . A A . 53 GLU OE1 1 1
1 859 1 1 53 GLU OE2 O 42.744 1.157 4.675 1.00 . A A . 53 GLU OE2 1 1
1 860 1 1 54 GLY C C 48.397 -1.926 4.193 1.00 . A A . 54 GLY C 1 1
1 861 1 1 54 GLY CA C 47.089 -2.405 3.580 1.00 . A A . 54 GLY CA 1 1
1 862 1 1 54 GLY H H 47.253 -0.672 2.310 1.00 . A A . 54 GLY H 1 1
1 863 1 1 54 GLY HA2 H 46.339 -2.505 4.353 1.00 . A A . 54 GLY HA2 1 1
1 864 1 1 54 GLY HA3 H 47.241 -3.357 3.097 1.00 . A A . 54 GLY HA3 1 1
1 865 1 1 54 GLY N N 46.639 -1.395 2.582 1.00 . A A . 54 GLY N 1 1
1 866 1 1 54 GLY O O 48.657 -0.741 4.237 1.00 . A A . 54 GLY O 1 1
1 867 1 1 55 TYR C C 51.693 -2.612 4.342 1.00 . A A . 55 TYR C 1 1
1 868 1 1 55 TYR CA C 50.506 -2.381 5.282 1.00 . A A . 55 TYR CA 1 1
1 869 1 1 55 TYR CB C 50.654 -3.197 6.565 1.00 . A A . 55 TYR CB 1 1
1 870 1 1 55 TYR CD1 C 50.396 -1.525 8.433 1.00 . A A . 55 TYR CD1 1 1
1 871 1 1 55 TYR CD2 C 48.530 -2.976 7.898 1.00 . A A . 55 TYR CD2 1 1
1 872 1 1 55 TYR CE1 C 49.640 -0.924 9.446 1.00 . A A . 55 TYR CE1 1 1
1 873 1 1 55 TYR CE2 C 47.773 -2.376 8.911 1.00 . A A . 55 TYR CE2 1 1
1 874 1 1 55 TYR CG C 49.841 -2.551 7.659 1.00 . A A . 55 TYR CG 1 1
1 875 1 1 55 TYR CZ C 48.328 -1.350 9.685 1.00 . A A . 55 TYR CZ 1 1
1 876 1 1 55 TYR H H 48.995 -3.773 4.632 1.00 . A A . 55 TYR H 1 1
1 877 1 1 55 TYR HA H 50.432 -1.340 5.522 1.00 . A A . 55 TYR HA 1 1
1 878 1 1 55 TYR HB2 H 50.301 -4.202 6.396 1.00 . A A . 55 TYR HB2 1 1
1 879 1 1 55 TYR HB3 H 51.693 -3.223 6.857 1.00 . A A . 55 TYR HB3 1 1
1 880 1 1 55 TYR HD1 H 51.408 -1.196 8.248 1.00 . A A . 55 TYR HD1 1 1
1 881 1 1 55 TYR HD2 H 48.103 -3.767 7.300 1.00 . A A . 55 TYR HD2 1 1
1 882 1 1 55 TYR HE1 H 50.068 -0.133 10.043 1.00 . A A . 55 TYR HE1 1 1
1 883 1 1 55 TYR HE2 H 46.761 -2.704 9.094 1.00 . A A . 55 TYR HE2 1 1
1 884 1 1 55 TYR HH H 47.921 -1.063 11.528 1.00 . A A . 55 TYR HH 1 1
1 885 1 1 55 TYR N N 49.222 -2.824 4.670 1.00 . A A . 55 TYR N 1 1
1 886 1 1 55 TYR O O 51.708 -3.528 3.543 1.00 . A A . 55 TYR O 1 1
1 887 1 1 55 TYR OH O 47.581 -0.758 10.683 1.00 . A A . 55 TYR OH 1 1
1 888 1 1 56 ILE C C 55.162 -1.630 4.428 1.00 . A A . 56 ILE C 1 1
1 889 1 1 56 ILE CA C 53.893 -1.877 3.569 1.00 . A A . 56 ILE CA 1 1
1 890 1 1 56 ILE CB C 53.687 -0.760 2.517 1.00 . A A . 56 ILE CB 1 1
1 891 1 1 56 ILE CD1 C 51.354 -1.186 1.751 1.00 . A A . 56 ILE CD1 1 1
1 892 1 1 56 ILE CG1 C 52.829 -1.299 1.376 1.00 . A A . 56 ILE CG1 1 1
1 893 1 1 56 ILE CG2 C 55.015 -0.266 1.932 1.00 . A A . 56 ILE CG2 1 1
1 894 1 1 56 ILE H H 52.630 -1.034 5.092 1.00 . A A . 56 ILE H 1 1
1 895 1 1 56 ILE HA H 53.925 -2.844 3.082 1.00 . A A . 56 ILE HA 1 1
1 896 1 1 56 ILE HB H 53.176 0.070 2.980 1.00 . A A . 56 ILE HB 1 1
1 897 1 1 56 ILE HD11 H 51.252 -0.605 2.656 1.00 . A A . 56 ILE HD11 1 1
1 898 1 1 56 ILE HD12 H 50.819 -0.703 0.950 1.00 . A A . 56 ILE HD12 1 1
1 899 1 1 56 ILE HD13 H 50.952 -2.172 1.911 1.00 . A A . 56 ILE HD13 1 1
1 900 1 1 56 ILE HG12 H 53.019 -0.726 0.481 1.00 . A A . 56 ILE HG12 1 1
1 901 1 1 56 ILE HG13 H 53.075 -2.334 1.200 1.00 . A A . 56 ILE HG13 1 1
1 902 1 1 56 ILE HG21 H 55.681 -1.103 1.795 1.00 . A A . 56 ILE HG21 1 1
1 903 1 1 56 ILE HG22 H 54.831 0.211 0.980 1.00 . A A . 56 ILE HG22 1 1
1 904 1 1 56 ILE HG23 H 55.461 0.446 2.611 1.00 . A A . 56 ILE HG23 1 1
1 905 1 1 56 ILE N N 52.685 -1.763 4.440 1.00 . A A . 56 ILE N 1 1
1 906 1 1 56 ILE O O 55.434 -0.496 4.771 1.00 . A A . 56 ILE O 1 1
1 907 1 1 57 PRO C C 58.120 -1.553 4.815 1.00 . A A . 57 PRO C 1 1
1 908 1 1 57 PRO CA C 57.146 -2.478 5.557 1.00 . A A . 57 PRO CA 1 1
1 909 1 1 57 PRO CB C 57.709 -3.898 5.676 1.00 . A A . 57 PRO CB 1 1
1 910 1 1 57 PRO CD C 55.601 -4.071 4.343 1.00 . A A . 57 PRO CD 1 1
1 911 1 1 57 PRO CG C 56.777 -4.865 4.923 1.00 . A A . 57 PRO CG 1 1
1 912 1 1 57 PRO HA H 56.908 -2.087 6.534 1.00 . A A . 57 PRO HA 1 1
1 913 1 1 57 PRO HB2 H 58.699 -3.933 5.245 1.00 . A A . 57 PRO HB2 1 1
1 914 1 1 57 PRO HB3 H 57.756 -4.182 6.716 1.00 . A A . 57 PRO HB3 1 1
1 915 1 1 57 PRO HD2 H 55.573 -4.165 3.265 1.00 . A A . 57 PRO HD2 1 1
1 916 1 1 57 PRO HD3 H 54.669 -4.388 4.783 1.00 . A A . 57 PRO HD3 1 1
1 917 1 1 57 PRO HG2 H 57.321 -5.343 4.123 1.00 . A A . 57 PRO HG2 1 1
1 918 1 1 57 PRO HG3 H 56.404 -5.613 5.604 1.00 . A A . 57 PRO HG3 1 1
1 919 1 1 57 PRO N N 55.916 -2.674 4.749 1.00 . A A . 57 PRO N 1 1
1 920 1 1 57 PRO O O 58.461 -1.788 3.672 1.00 . A A . 57 PRO O 1 1
1 921 1 1 58 SER C C 60.731 -0.272 4.236 1.00 . A A . 58 SER C 1 1
1 922 1 1 58 SER CA C 59.506 0.460 4.796 1.00 . A A . 58 SER CA 1 1
1 923 1 1 58 SER CB C 59.927 1.430 5.900 1.00 . A A . 58 SER CB 1 1
1 924 1 1 58 SER H H 58.262 -0.335 6.374 1.00 . A A . 58 SER H 1 1
1 925 1 1 58 SER HA H 59.001 0.999 4.010 1.00 . A A . 58 SER HA 1 1
1 926 1 1 58 SER HB2 H 59.055 1.912 6.311 1.00 . A A . 58 SER HB2 1 1
1 927 1 1 58 SER HB3 H 60.436 0.883 6.683 1.00 . A A . 58 SER HB3 1 1
1 928 1 1 58 SER HG H 61.588 2.442 5.890 1.00 . A A . 58 SER HG 1 1
1 929 1 1 58 SER N N 58.560 -0.500 5.457 1.00 . A A . 58 SER N 1 1
1 930 1 1 58 SER O O 61.166 -0.011 3.130 1.00 . A A . 58 SER O 1 1
1 931 1 1 58 SER OG O 60.792 2.416 5.354 1.00 . A A . 58 SER OG 1 1
1 932 1 1 59 ASN C C 62.131 -2.744 3.260 1.00 . A A . 59 ASN C 1 1
1 933 1 1 59 ASN CA C 62.485 -1.934 4.511 1.00 . A A . 59 ASN CA 1 1
1 934 1 1 59 ASN CB C 62.877 -2.848 5.686 1.00 . A A . 59 ASN CB 1 1
1 935 1 1 59 ASN CG C 61.871 -3.996 5.864 1.00 . A A . 59 ASN CG 1 1
1 936 1 1 59 ASN H H 60.913 -1.370 5.880 1.00 . A A . 59 ASN H 1 1
1 937 1 1 59 ASN HA H 63.291 -1.250 4.296 1.00 . A A . 59 ASN HA 1 1
1 938 1 1 59 ASN HB2 H 63.859 -3.257 5.511 1.00 . A A . 59 ASN HB2 1 1
1 939 1 1 59 ASN HB3 H 62.891 -2.261 6.584 1.00 . A A . 59 ASN HB3 1 1
1 940 1 1 59 ASN HD21 H 60.682 -2.958 7.067 1.00 . A A . 59 ASN HD21 1 1
1 941 1 1 59 ASN HD22 H 60.176 -4.544 6.739 1.00 . A A . 59 ASN HD22 1 1
1 942 1 1 59 ASN N N 61.286 -1.182 4.992 1.00 . A A . 59 ASN N 1 1
1 943 1 1 59 ASN ND2 N 60.822 -3.818 6.619 1.00 . A A . 59 ASN ND2 1 1
1 944 1 1 59 ASN O O 62.906 -2.849 2.329 1.00 . A A . 59 ASN O 1 1
1 945 1 1 59 ASN OD1 O 62.047 -5.063 5.310 1.00 . A A . 59 ASN OD1 1 1
1 946 1 1 60 TYR C C 60.350 -3.285 0.834 1.00 . A A . 60 TYR C 1 1
1 947 1 1 60 TYR CA C 60.528 -4.151 2.088 1.00 . A A . 60 TYR CA 1 1
1 948 1 1 60 TYR CB C 59.187 -4.763 2.503 1.00 . A A . 60 TYR CB 1 1
1 949 1 1 60 TYR CD1 C 59.755 -6.366 4.368 1.00 . A A . 60 TYR CD1 1 1
1 950 1 1 60 TYR CD2 C 59.255 -7.263 2.172 1.00 . A A . 60 TYR CD2 1 1
1 951 1 1 60 TYR CE1 C 59.954 -7.663 4.853 1.00 . A A . 60 TYR CE1 1 1
1 952 1 1 60 TYR CE2 C 59.453 -8.561 2.658 1.00 . A A . 60 TYR CE2 1 1
1 953 1 1 60 TYR CG C 59.405 -6.165 3.027 1.00 . A A . 60 TYR CG 1 1
1 954 1 1 60 TYR CZ C 59.803 -8.761 3.998 1.00 . A A . 60 TYR CZ 1 1
1 955 1 1 60 TYR H H 60.379 -3.221 4.037 1.00 . A A . 60 TYR H 1 1
1 956 1 1 60 TYR HA H 61.244 -4.934 1.899 1.00 . A A . 60 TYR HA 1 1
1 957 1 1 60 TYR HB2 H 58.739 -4.156 3.275 1.00 . A A . 60 TYR HB2 1 1
1 958 1 1 60 TYR HB3 H 58.529 -4.799 1.648 1.00 . A A . 60 TYR HB3 1 1
1 959 1 1 60 TYR HD1 H 59.871 -5.520 5.028 1.00 . A A . 60 TYR HD1 1 1
1 960 1 1 60 TYR HD2 H 58.986 -7.109 1.138 1.00 . A A . 60 TYR HD2 1 1
1 961 1 1 60 TYR HE1 H 60.223 -7.818 5.888 1.00 . A A . 60 TYR HE1 1 1
1 962 1 1 60 TYR HE2 H 59.337 -9.408 1.998 1.00 . A A . 60 TYR HE2 1 1
1 963 1 1 60 TYR HH H 60.913 -10.116 4.758 1.00 . A A . 60 TYR HH 1 1
1 964 1 1 60 TYR N N 60.965 -3.323 3.256 1.00 . A A . 60 TYR N 1 1
1 965 1 1 60 TYR O O 60.693 -3.697 -0.259 1.00 . A A . 60 TYR O 1 1
1 966 1 1 60 TYR OH O 59.998 -10.041 4.477 1.00 . A A . 60 TYR OH 1 1
1 967 1 1 61 VAL C C 60.650 -0.105 -0.280 1.00 . A A . 61 VAL C 1 1
1 968 1 1 61 VAL CA C 59.607 -1.224 -0.227 1.00 . A A . 61 VAL CA 1 1
1 969 1 1 61 VAL CB C 58.202 -0.630 -0.093 1.00 . A A . 61 VAL CB 1 1
1 970 1 1 61 VAL CG1 C 57.166 -1.754 -0.142 1.00 . A A . 61 VAL CG1 1 1
1 971 1 1 61 VAL CG2 C 58.074 0.123 1.233 1.00 . A A . 61 VAL CG2 1 1
1 972 1 1 61 VAL H H 59.534 -1.787 1.861 1.00 . A A . 61 VAL H 1 1
1 973 1 1 61 VAL HA H 59.659 -1.819 -1.121 1.00 . A A . 61 VAL HA 1 1
1 974 1 1 61 VAL HB H 58.028 0.055 -0.915 1.00 . A A . 61 VAL HB 1 1
1 975 1 1 61 VAL HG11 H 57.398 -2.422 -0.959 1.00 . A A . 61 VAL HG11 1 1
1 976 1 1 61 VAL HG12 H 57.185 -2.302 0.788 1.00 . A A . 61 VAL HG12 1 1
1 977 1 1 61 VAL HG13 H 56.183 -1.332 -0.291 1.00 . A A . 61 VAL HG13 1 1
1 978 1 1 61 VAL HG21 H 59.045 0.484 1.539 1.00 . A A . 61 VAL HG21 1 1
1 979 1 1 61 VAL HG22 H 57.402 0.958 1.107 1.00 . A A . 61 VAL HG22 1 1
1 980 1 1 61 VAL HG23 H 57.683 -0.542 1.988 1.00 . A A . 61 VAL HG23 1 1
1 981 1 1 61 VAL N N 59.810 -2.098 0.974 1.00 . A A . 61 VAL N 1 1
1 982 1 1 61 VAL O O 61.395 0.115 0.655 1.00 . A A . 61 VAL O 1 1
1 983 1 1 62 THR C C 61.016 2.848 -2.358 1.00 . A A . 62 THR C 1 1
1 984 1 1 62 THR CA C 61.669 1.721 -1.530 1.00 . A A . 62 THR CA 1 1
1 985 1 1 62 THR CB C 62.878 1.092 -2.239 1.00 . A A . 62 THR CB 1 1
1 986 1 1 62 THR CG2 C 62.458 0.534 -3.601 1.00 . A A . 62 THR CG2 1 1
1 987 1 1 62 THR H H 60.074 0.398 -2.111 1.00 . A A . 62 THR H 1 1
1 988 1 1 62 THR HA H 61.961 2.094 -0.560 1.00 . A A . 62 THR HA 1 1
1 989 1 1 62 THR HB H 63.272 0.290 -1.633 1.00 . A A . 62 THR HB 1 1
1 990 1 1 62 THR HG1 H 64.625 1.857 -1.858 1.00 . A A . 62 THR HG1 1 1
1 991 1 1 62 THR HG21 H 61.418 0.247 -3.569 1.00 . A A . 62 THR HG21 1 1
1 992 1 1 62 THR HG22 H 62.599 1.288 -4.360 1.00 . A A . 62 THR HG22 1 1
1 993 1 1 62 THR HG23 H 63.062 -0.330 -3.837 1.00 . A A . 62 THR HG23 1 1
1 994 1 1 62 THR N N 60.693 0.603 -1.378 1.00 . A A . 62 THR N 1 1
1 995 1 1 62 THR O O 59.890 3.217 -2.098 1.00 . A A . 62 THR O 1 1
1 996 1 1 62 THR OG1 O 63.882 2.081 -2.423 1.00 . A A . 62 THR OG1 1 1
1 997 1 1 63 GLU C C 60.338 3.894 -5.362 1.00 . A A . 63 GLU C 1 1
1 998 1 1 63 GLU CA C 61.073 4.488 -4.158 1.00 . A A . 63 GLU CA 1 1
1 999 1 1 63 GLU CB C 62.243 5.360 -4.615 1.00 . A A . 63 GLU CB 1 1
1 1000 1 1 63 GLU CD C 63.612 7.382 -4.082 1.00 . A A . 63 GLU CD 1 1
1 1001 1 1 63 GLU CG C 62.445 6.506 -3.622 1.00 . A A . 63 GLU CG 1 1
1 1002 1 1 63 GLU H H 62.595 3.100 -3.546 1.00 . A A . 63 GLU H 1 1
1 1003 1 1 63 GLU HA H 60.393 5.065 -3.553 1.00 . A A . 63 GLU HA 1 1
1 1004 1 1 63 GLU HB2 H 63.141 4.762 -4.664 1.00 . A A . 63 GLU HB2 1 1
1 1005 1 1 63 GLU HB3 H 62.028 5.767 -5.592 1.00 . A A . 63 GLU HB3 1 1
1 1006 1 1 63 GLU HG2 H 61.545 7.102 -3.571 1.00 . A A . 63 GLU HG2 1 1
1 1007 1 1 63 GLU HG3 H 62.665 6.102 -2.645 1.00 . A A . 63 GLU HG3 1 1
1 1008 1 1 63 GLU N N 61.692 3.398 -3.343 1.00 . A A . 63 GLU N 1 1
1 1009 1 1 63 GLU O O 60.833 3.005 -6.025 1.00 . A A . 63 GLU O 1 1
1 1010 1 1 63 GLU OE1 O 64.683 6.840 -4.301 1.00 . A A . 63 GLU OE1 1 1
1 1011 1 1 63 GLU OE2 O 63.414 8.579 -4.208 1.00 . A A . 63 GLU OE2 1 1
1 1012 1 1 64 ALA C C 59.201 3.793 -8.081 1.00 . A A . 64 ALA C 1 1
1 1013 1 1 64 ALA CA C 58.356 3.848 -6.800 1.00 . A A . 64 ALA CA 1 1
1 1014 1 1 64 ALA CB C 57.198 4.832 -6.972 1.00 . A A . 64 ALA CB 1 1
1 1015 1 1 64 ALA H H 58.781 5.095 -5.084 1.00 . A A . 64 ALA H 1 1
1 1016 1 1 64 ALA HA H 57.966 2.870 -6.564 1.00 . A A . 64 ALA HA 1 1
1 1017 1 1 64 ALA HB1 H 57.076 5.406 -6.066 1.00 . A A . 64 ALA HB1 1 1
1 1018 1 1 64 ALA HB2 H 57.411 5.500 -7.794 1.00 . A A . 64 ALA HB2 1 1
1 1019 1 1 64 ALA HB3 H 56.289 4.286 -7.177 1.00 . A A . 64 ALA HB3 1 1
1 1020 1 1 64 ALA N N 59.153 4.380 -5.643 1.00 . A A . 64 ALA N 1 1
1 1021 1 1 64 ALA O O 59.074 2.880 -8.877 1.00 . A A . 64 ALA O 1 1
1 1022 1 1 65 GLU C C 62.325 5.247 -9.172 1.00 . A A . 65 GLU C 1 1
1 1023 1 1 65 GLU CA C 60.909 4.772 -9.510 1.00 . A A . 65 GLU CA 1 1
1 1024 1 1 65 GLU CB C 60.226 5.757 -10.459 1.00 . A A . 65 GLU CB 1 1
1 1025 1 1 65 GLU CD C 58.700 5.726 -12.438 1.00 . A A . 65 GLU CD 1 1
1 1026 1 1 65 GLU CG C 58.986 5.101 -11.071 1.00 . A A . 65 GLU CG 1 1
1 1027 1 1 65 GLU H H 60.138 5.486 -7.627 1.00 . A A . 65 GLU H 1 1
1 1028 1 1 65 GLU HA H 60.937 3.791 -9.956 1.00 . A A . 65 GLU HA 1 1
1 1029 1 1 65 GLU HB2 H 59.933 6.641 -9.910 1.00 . A A . 65 GLU HB2 1 1
1 1030 1 1 65 GLU HB3 H 60.910 6.033 -11.246 1.00 . A A . 65 GLU HB3 1 1
1 1031 1 1 65 GLU HG2 H 59.161 4.041 -11.187 1.00 . A A . 65 GLU HG2 1 1
1 1032 1 1 65 GLU HG3 H 58.138 5.258 -10.421 1.00 . A A . 65 GLU HG3 1 1
1 1033 1 1 65 GLU N N 60.057 4.763 -8.283 1.00 . A A . 65 GLU N 1 1
1 1034 1 1 65 GLU O O 62.528 6.015 -8.250 1.00 . A A . 65 GLU O 1 1
1 1035 1 1 65 GLU OE1 O 58.559 6.936 -12.496 1.00 . A A . 65 GLU OE1 1 1
1 1036 1 1 65 GLU OE2 O 58.626 4.983 -13.402 1.00 . A A . 65 GLU OE2 1 1
1 1037 1 1 66 ASP C C 65.420 5.546 -10.962 1.00 . A A . 66 ASP C 1 1
1 1038 1 1 66 ASP CA C 64.711 5.210 -9.647 1.00 . A A . 66 ASP CA 1 1
1 1039 1 1 66 ASP CB C 65.365 3.999 -8.981 1.00 . A A . 66 ASP CB 1 1
1 1040 1 1 66 ASP CG C 65.116 4.049 -7.473 1.00 . A A . 66 ASP CG 1 1
1 1041 1 1 66 ASP H H 63.109 4.175 -10.650 1.00 . A A . 66 ASP H 1 1
1 1042 1 1 66 ASP HA H 64.734 6.056 -8.979 1.00 . A A . 66 ASP HA 1 1
1 1043 1 1 66 ASP HB2 H 64.940 3.092 -9.388 1.00 . A A . 66 ASP HB2 1 1
1 1044 1 1 66 ASP HB3 H 66.428 4.015 -9.169 1.00 . A A . 66 ASP HB3 1 1
1 1045 1 1 66 ASP N N 63.303 4.792 -9.914 1.00 . A A . 66 ASP N 1 1
1 1046 1 1 66 ASP O O 65.659 4.683 -11.786 1.00 . A A . 66 ASP O 1 1
1 1047 1 1 66 ASP OD1 O 63.988 4.309 -7.087 1.00 . A A . 66 ASP OD1 1 1
1 1048 1 1 66 ASP OD2 O 66.057 3.827 -6.729 1.00 . A A . 66 ASP OD2 1 1
1 1049 1 1 67 SER C C 67.964 7.024 -12.270 1.00 . A A . 67 SER C 1 1
1 1050 1 1 67 SER CA C 66.450 7.198 -12.422 1.00 . A A . 67 SER CA 1 1
1 1051 1 1 67 SER CB C 66.096 8.671 -12.615 1.00 . A A . 67 SER CB 1 1
1 1052 1 1 67 SER H H 65.551 7.470 -10.481 1.00 . A A . 67 SER H 1 1
1 1053 1 1 67 SER HA H 66.085 6.618 -13.255 1.00 . A A . 67 SER HA 1 1
1 1054 1 1 67 SER HB2 H 65.187 8.898 -12.083 1.00 . A A . 67 SER HB2 1 1
1 1055 1 1 67 SER HB3 H 66.899 9.287 -12.231 1.00 . A A . 67 SER HB3 1 1
1 1056 1 1 67 SER HG H 65.168 9.540 -14.088 1.00 . A A . 67 SER HG 1 1
1 1057 1 1 67 SER N N 65.756 6.795 -11.162 1.00 . A A . 67 SER N 1 1
1 1058 1 1 67 SER O O 68.566 6.445 -13.160 1.00 . A A . 67 SER O 1 1
1 1059 1 1 67 SER OXT O 68.494 7.472 -11.267 1.00 . A A . 67 SER OXT 1 1
1 1060 1 1 67 SER OG O 65.904 8.930 -14.000 1.00 . A A . 67 SER OG 1 1
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