NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
537888 |
2lcn   |
17618 | cing | 4-filtered-FRED | STAR | entry | full | 312 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lcn
# This FRED archive file contains, for PDB entry <2lcn>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.PDB_coordinate_file_version .
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_2lcn
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2lcn
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 2178.62
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 $WALP19_P10_peptide A . 1 1
stop_
save_
save_WALP19_P10_peptide
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "WALP19 P10 peptide"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XGWWLALALAPALALALWWAX
_Entity.Number_of_monomers 21
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 ACE $ACE 1 1
2 GLY . 1 1
3 TRP . 1 1
4 TRP . 1 1
5 LEU . 1 1
6 ALA . 1 1
7 LEU . 1 1
8 ALA . 1 1
9 LEU . 1 1
10 ALA . 1 1
11 PRO . 1 1
12 ALA . 1 1
13 LEU . 1 1
14 ALA . 1 1
15 LEU . 1 1
16 ALA . 1 1
17 LEU . 1 1
18 TRP . 1 1
19 TRP . 1 1
20 ALA . 1 1
21 ETA $ETA 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
ACE 1 1 1 1
GLY 2 2 1 1
TRP 3 3 1 1
TRP 4 4 1 1
LEU 5 5 1 1
ALA 6 6 1 1
LEU 7 7 1 1
ALA 8 8 1 1
LEU 9 9 1 1
ALA 10 10 1 1
PRO 11 11 1 1
ALA 12 12 1 1
LEU 13 13 1 1
ALA 14 14 1 1
LEU 15 15 1 1
ALA 16 16 1 1
LEU 17 17 1 1
TRP 18 18 1 1
TRP 19 19 1 1
ALA 20 20 1 1
ETA 21 21 1 1
stop_
save_
save_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACE
_Chem_comp.Type non-polymer
save_
save_ETA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ETA
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
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
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180 1 . . . 1 1
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185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 1 . . . 1 1
189 1 . . . 1 1
190 1 . . . 1 1
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192 1 . . . 1 1
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194 1 . . . 1 1
195 1 . . . 1 1
196 1 . . . 1 1
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198 1 . . . 1 1
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200 1 . . . 1 1
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202 1 . . . 1 1
203 1 . . . 1 1
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206 1 . . . 1 1
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208 1 . . . 1 1
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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
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 TRP H . 3 . HN 1 1
1 1 2 1 1 4 TRP HA . 3 . HA 1 1
2 1 1 1 1 4 TRP HB3 . 3 . HB1 1 1
2 1 2 1 1 5 LEU H . 4 . HN 1 1
3 1 1 1 1 4 TRP HB2 . 3 . HB2 1 1
3 1 2 1 1 5 LEU H . 4 . HN 1 1
4 1 1 1 1 3 TRP H . 2 . HN 1 1
4 1 2 1 1 4 TRP H . 3 . HN 1 1
5 1 1 1 1 5 LEU H . 4 . HN 1 1
5 1 2 1 1 5 LEU HA . 4 . HA 1 1
6 1 1 1 1 5 LEU HA . 4 . HA 1 1
6 1 2 1 1 5 LEU QB . 4 . HB# 1 1
7 1 1 1 1 5 LEU QB . 4 . HB# 1 1
7 1 2 1 1 5 LEU HG . 4 . HG 1 1
8 1 1 1 1 5 LEU H . 4 . HN 1 1
8 1 2 1 1 5 LEU HG . 4 . HG 1 1
9 1 1 1 1 5 LEU H . 4 . HN 1 1
9 1 2 1 1 5 LEU QB . 4 . HB# 1 1
10 1 1 1 1 5 LEU QB . 4 . HB# 1 1
10 1 2 1 1 6 ALA H . 5 . HN 1 1
11 1 1 1 1 5 LEU H . 4 . HN 1 1
11 1 2 1 1 6 ALA H . 5 . HN 1 1
12 1 1 1 1 6 ALA H . 5 . HN 1 1
12 1 2 1 1 6 ALA HA . 5 . HA 1 1
13 1 1 1 1 7 LEU H . 6 . HN 1 1
13 1 2 1 1 7 LEU HA . 6 . HA 1 1
14 1 1 1 1 7 LEU HA . 6 . HA 1 1
14 1 2 1 1 7 LEU HG . 6 . HG 1 1
15 1 1 1 1 8 ALA H . 7 . HN 1 1
15 1 2 1 1 8 ALA HA . 7 . HA 1 1
16 1 1 1 1 9 LEU H . 8 . HN 1 1
16 1 2 1 1 9 LEU HA . 8 . HA 1 1
17 1 1 1 1 9 LEU H . 8 . HN 1 1
17 1 2 1 1 10 ALA H . 9 . HN 1 1
18 1 1 1 1 10 ALA H . 9 . HN 1 1
18 1 2 1 1 10 ALA HA . 9 . HA 1 1
19 1 1 1 1 11 PRO HB3 . 10 . HB1 1 1
19 1 2 1 1 11 PRO QG . 10 . HG# 1 1
20 1 1 1 1 13 LEU H . 12 . HN 1 1
20 1 2 1 1 13 LEU HA . 12 . HA 1 1
21 1 1 1 1 13 LEU HA . 12 . HA 1 1
21 1 2 1 1 13 LEU QB . 12 . HB# 1 1
22 1 1 1 1 13 LEU H . 12 . HN 1 1
22 1 2 1 1 13 LEU QB . 12 . HB# 1 1
23 1 1 1 1 13 LEU QB . 12 . HB# 1 1
23 1 2 1 1 13 LEU HG . 12 . HG 1 1
24 1 1 1 1 13 LEU H . 12 . HN 1 1
24 1 2 1 1 13 LEU HG . 12 . HG 1 1
25 1 1 1 1 14 ALA H . 13 . HN 1 1
25 1 2 1 1 14 ALA HA . 13 . HA 1 1
26 1 1 1 1 15 LEU H . 14 . HN 1 1
26 1 2 1 1 15 LEU HA . 14 . HA 1 1
27 1 1 1 1 15 LEU H . 14 . HN 1 1
27 1 2 1 1 15 LEU QB . 14 . HB# 1 1
28 1 1 1 1 16 ALA H . 15 . HN 1 1
28 1 2 1 1 16 ALA HA . 15 . HA 1 1
29 1 1 1 1 17 LEU H . 16 . HN 1 1
29 1 2 1 1 17 LEU HA . 16 . HA 1 1
30 1 1 1 1 17 LEU H . 16 . HN 1 1
30 1 2 1 1 17 LEU HB3 . 16 . HB1 1 1
31 1 1 1 1 17 LEU H . 16 . HN 1 1
31 1 2 1 1 17 LEU HB2 . 16 . HB2 1 1
32 1 1 1 1 17 LEU H . 16 . HN 1 1
32 1 2 1 1 18 TRP H . 17 . HN 1 1
33 1 1 1 1 18 TRP H . 17 . HN 1 1
33 1 2 1 1 18 TRP HA . 17 . HA 1 1
34 1 1 1 1 18 TRP H . 17 . HN 1 1
34 1 2 1 1 18 TRP HB3 . 17 . HB1 1 1
35 1 1 1 1 18 TRP H . 17 . HN 1 1
35 1 2 1 1 18 TRP HB2 . 17 . HB2 1 1
36 1 1 1 1 18 TRP H . 17 . HN 1 1
36 1 2 1 1 19 TRP H . 18 . HN 1 1
37 1 1 1 1 19 TRP H . 18 . HN 1 1
37 1 2 1 1 19 TRP HA . 18 . HA 1 1
38 1 1 1 1 19 TRP H . 18 . HN 1 1
38 1 2 1 1 19 TRP HB3 . 18 . HB1 1 1
39 1 1 1 1 19 TRP H . 18 . HN 1 1
39 1 2 1 1 19 TRP HB2 . 18 . HB2 1 1
40 1 1 1 1 20 ALA H . 19 . HN 1 1
40 1 2 1 1 20 ALA HA . 19 . HA 1 1
41 1 1 1 1 19 TRP H . 18 . HN 1 1
41 1 2 1 1 20 ALA H . 19 . HN 1 1
42 1 1 1 1 3 TRP HA . 2 . HA 1 1
42 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
43 1 1 1 1 3 TRP HA . 2 . HA 1 1
43 1 2 1 1 3 TRP HE3 . 2 . HE3 1 1
44 1 1 1 1 3 TRP HA . 2 . HA 1 1
44 1 2 1 1 6 ALA H . 5 . HN 1 1
45 1 1 1 1 3 TRP H . 2 . HN 1 1
45 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
46 1 1 1 1 3 TRP HA . 2 . HA 1 1
46 1 2 1 1 3 TRP HB3 . 2 . HB1 1 1
47 1 1 1 1 3 TRP HA . 2 . HA 1 1
47 1 2 1 1 3 TRP HB2 . 2 . HB2 1 1
48 1 1 1 1 4 TRP HA . 3 . HA 1 1
48 1 2 1 1 5 LEU H . 4 . HN 1 1
49 1 1 1 1 4 TRP HA . 3 . HA 1 1
49 1 2 1 1 4 TRP HB3 . 3 . HB1 1 1
50 1 1 1 1 4 TRP HA . 3 . HA 1 1
50 1 2 1 1 4 TRP HB2 . 3 . HB2 1 1
51 1 1 1 1 4 TRP HB3 . 3 . HB1 1 1
51 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
52 1 1 1 1 4 TRP HB2 . 3 . HB2 1 1
52 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
53 1 1 1 1 5 LEU HA . 4 . HA 1 1
53 1 2 1 1 7 LEU H . 6 . HN 1 1
54 1 1 1 1 5 LEU HA . 4 . HA 1 1
54 1 2 1 1 8 ALA H . 7 . HN 1 1
55 1 1 1 1 5 LEU HA . 4 . HA 1 1
55 1 2 1 1 5 LEU HG . 4 . HG 1 1
56 1 1 1 1 7 LEU HA . 6 . HA 1 1
56 1 2 1 1 8 ALA H . 7 . HN 1 1
57 1 1 1 1 7 LEU HA . 6 . HA 1 1
57 1 2 1 1 10 ALA H . 9 . HN 1 1
58 1 1 1 1 7 LEU H . 6 . HN 1 1
58 1 2 1 1 7 LEU HG . 6 . HG 1 1
59 1 1 1 1 7 LEU HG . 6 . HG 1 1
59 1 2 1 1 8 ALA H . 7 . HN 1 1
60 1 1 1 1 8 ALA HA . 7 . HA 1 1
60 1 2 1 1 9 LEU H . 8 . HN 1 1
61 1 1 1 1 10 ALA H . 9 . HN 1 1
61 1 2 1 1 11 PRO HA . 10 . HA 1 1
62 1 1 1 1 11 PRO HB3 . 10 . HB1 1 1
62 1 2 1 1 11 PRO QD . 10 . HD# 1 1
63 1 1 1 1 11 PRO HA . 10 . HA 1 1
63 1 2 1 1 11 PRO HB2 . 10 . HB2 1 1
64 1 1 1 1 11 PRO HB2 . 10 . HB2 1 1
64 1 2 1 1 11 PRO QD . 10 . HD# 1 1
65 1 1 1 1 10 ALA H . 9 . HN 1 1
65 1 2 1 1 11 PRO QD . 10 . HD# 1 1
66 1 1 1 1 11 PRO HA . 10 . HA 1 1
66 1 2 1 1 11 PRO QD . 10 . HD# 1 1
67 1 1 1 1 11 PRO HA . 10 . HA 1 1
67 1 2 1 1 11 PRO QG . 10 . HG# 1 1
68 1 1 1 1 12 ALA H . 11 . HN 1 1
68 1 2 1 1 12 ALA MB . 11 . HB# 1 1
69 1 1 1 1 12 ALA MB . 11 . HB# 1 1
69 1 2 1 1 16 ALA H . 15 . HN 1 1
70 1 1 1 1 12 ALA H . 11 . HN 1 1
70 1 2 1 1 13 LEU H . 12 . HN 1 1
71 1 1 1 1 13 LEU HA . 12 . HA 1 1
71 1 2 1 1 16 ALA H . 15 . HN 1 1
72 1 1 1 1 13 LEU QB . 12 . HB# 1 1
72 1 2 1 1 14 ALA H . 13 . HN 1 1
73 1 1 1 1 13 LEU QB . 12 . HB# 1 1
73 1 2 1 1 16 ALA H . 15 . HN 1 1
74 1 1 1 1 13 LEU HA . 12 . HA 1 1
74 1 2 1 1 13 LEU HG . 12 . HG 1 1
75 1 1 1 1 13 LEU H . 12 . HN 1 1
75 1 2 1 1 14 ALA H . 13 . HN 1 1
76 1 1 1 1 14 ALA HA . 13 . HA 1 1
76 1 2 1 1 17 LEU H . 16 . HN 1 1
77 1 1 1 1 15 LEU HA . 14 . HA 1 1
77 1 2 1 1 18 TRP H . 17 . HN 1 1
78 1 1 1 1 15 LEU HA . 14 . HA 1 1
78 1 2 1 1 15 LEU QB . 14 . HB# 1 1
79 1 1 1 1 15 LEU QB . 14 . HB# 1 1
79 1 2 1 1 16 ALA H . 15 . HN 1 1
80 1 1 1 1 15 LEU H . 14 . HN 1 1
80 1 2 1 1 16 ALA H . 15 . HN 1 1
81 1 1 1 1 16 ALA HA . 15 . HA 1 1
81 1 2 1 1 17 LEU H . 16 . HN 1 1
82 1 1 1 1 16 ALA HA . 15 . HA 1 1
82 1 2 1 1 19 TRP H . 18 . HN 1 1
83 1 1 1 1 16 ALA HA . 15 . HA 1 1
83 1 2 1 1 20 ALA H . 19 . HN 1 1
84 1 1 1 1 17 LEU HA . 16 . HA 1 1
84 1 2 1 1 18 TRP H . 17 . HN 1 1
85 1 1 1 1 18 TRP HA . 17 . HA 1 1
85 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
86 1 1 1 1 18 TRP HZ3 . 17 . HZ3 1 1
86 1 2 1 1 19 TRP H . 18 . HN 1 1
87 1 1 1 1 19 TRP HA . 18 . HA 1 1
87 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
88 1 1 1 1 19 TRP HA . 18 . HA 1 1
88 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
89 1 1 1 1 19 TRP HA . 18 . HA 1 1
89 1 2 1 1 19 TRP HB3 . 18 . HB1 1 1
90 1 1 1 1 19 TRP HA . 18 . HA 1 1
90 1 2 1 1 19 TRP HB2 . 18 . HB2 1 1
91 1 1 1 1 19 TRP HB3 . 18 . HB1 1 1
91 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
92 1 1 1 1 19 TRP HB2 . 18 . HB2 1 1
92 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
93 1 1 1 1 19 TRP HB3 . 18 . HB1 1 1
93 1 2 1 1 20 ALA H . 19 . HN 1 1
94 1 1 1 1 19 TRP HB2 . 18 . HB2 1 1
94 1 2 1 1 20 ALA H . 19 . HN 1 1
95 1 1 1 1 3 TRP HB3 . 2 . HB1 1 1
95 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
96 1 1 1 1 3 TRP HB2 . 2 . HB2 1 1
96 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
97 1 1 1 1 3 TRP H . 2 . HN 1 1
97 1 2 1 1 3 TRP HB3 . 2 . HB1 1 1
98 1 1 1 1 3 TRP H . 2 . HN 1 1
98 1 2 1 1 3 TRP HB2 . 2 . HB2 1 1
99 1 1 1 1 3 TRP HB3 . 2 . HB1 1 1
99 1 2 1 1 3 TRP HE3 . 2 . HE3 1 1
100 1 1 1 1 3 TRP HB2 . 2 . HB2 1 1
100 1 2 1 1 3 TRP HE3 . 2 . HE3 1 1
101 1 1 1 1 3 TRP H . 2 . HN 1 1
101 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
102 1 1 1 1 3 TRP HE3 . 2 . HE3 1 1
102 1 2 1 1 4 TRP HA . 3 . HA 1 1
103 1 1 1 1 3 TRP HZ2 . 2 . HZ2 1 1
103 1 2 1 1 4 TRP HA . 3 . HA 1 1
104 1 1 1 1 4 TRP HA . 3 . HA 1 1
104 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
105 1 1 1 1 4 TRP HA . 3 . HA 1 1
105 1 2 1 1 7 LEU H . 6 . HN 1 1
106 1 1 1 1 4 TRP H . 3 . HN 1 1
106 1 2 1 1 5 LEU H . 4 . HN 1 1
107 1 1 1 1 6 ALA HA . 5 . HA 1 1
107 1 2 1 1 7 LEU H . 6 . HN 1 1
108 1 1 1 1 6 ALA HA . 5 . HA 1 1
108 1 2 1 1 9 LEU H . 8 . HN 1 1
109 1 1 1 1 6 ALA HA . 5 . HA 1 1
109 1 2 1 1 10 ALA H . 9 . HN 1 1
110 1 1 1 1 10 ALA H . 9 . HN 1 1
110 1 2 1 1 11 PRO HB2 . 10 . HB2 1 1
111 1 1 1 1 13 LEU HG . 12 . HG 1 1
111 1 2 1 1 14 ALA H . 13 . HN 1 1
112 1 1 1 1 14 ALA HA . 13 . HA 1 1
112 1 2 1 1 18 TRP H . 17 . HN 1 1
113 1 1 1 1 12 ALA HA . 11 . HA 1 1
113 1 2 1 1 15 LEU QB . 14 . HB# 1 1
114 1 1 1 1 16 ALA HA . 15 . HA 1 1
114 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
115 1 1 1 1 16 ALA HA . 15 . HA 1 1
115 1 2 1 1 19 TRP HZ3 . 18 . HZ3 1 1
116 1 1 1 1 16 ALA MB . 15 . HB# 1 1
116 1 2 1 1 19 TRP HZ3 . 18 . HZ3 1 1
117 1 1 1 1 16 ALA H . 15 . HN 1 1
117 1 2 1 1 17 LEU H . 16 . HN 1 1
118 1 1 1 1 17 LEU HA . 16 . HA 1 1
118 1 2 1 1 20 ALA H . 19 . HN 1 1
119 1 1 1 1 18 TRP HA . 17 . HA 1 1
119 1 2 1 1 18 TRP HE1 . 17 . HE1 1 1
120 1 1 1 1 18 TRP HB3 . 17 . HB1 1 1
120 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
121 1 1 1 1 18 TRP HB2 . 17 . HB2 1 1
121 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
122 1 1 1 1 18 TRP H . 17 . HN 1 1
122 1 2 1 1 18 TRP HZ3 . 17 . HZ3 1 1
123 1 1 1 1 18 TRP HE3 . 17 . HE3 1 1
123 1 2 1 1 19 TRP HA . 18 . HA 1 1
124 1 1 1 1 19 TRP HB3 . 18 . HB1 1 1
124 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
125 1 1 1 1 19 TRP HB2 . 18 . HB2 1 1
125 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
126 1 1 1 1 19 TRP HB3 . 18 . HB1 1 1
126 1 2 1 1 19 TRP HZ3 . 18 . HZ3 1 1
127 1 1 1 1 19 TRP HB2 . 18 . HB2 1 1
127 1 2 1 1 19 TRP HZ3 . 18 . HZ3 1 1
128 1 1 1 1 16 ALA HA . 15 . HA 1 1
128 1 2 1 1 19 TRP HB3 . 18 . HB1 1 1
129 1 1 1 1 16 ALA HA . 15 . HA 1 1
129 1 2 1 1 19 TRP HB2 . 18 . HB2 1 1
130 1 1 1 1 19 TRP HE3 . 18 . HE3 1 1
130 1 2 1 1 20 ALA H . 19 . HN 1 1
131 1 1 1 1 19 TRP HZ3 . 18 . HZ3 1 1
131 1 2 1 1 20 ALA H . 19 . HN 1 1
132 1 1 1 1 4 TRP HE1 . 3 . HE1 1 1
132 1 2 1 1 5 LEU HG . 4 . HG 1 1
133 1 1 1 1 18 TRP H . 17 . HN 1 1
133 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
134 1 1 1 1 18 TRP HZ3 . 17 . HZ3 1 1
134 1 2 1 1 19 TRP HA . 18 . HA 1 1
135 1 1 1 1 19 TRP HA . 18 . HA 1 1
135 1 2 1 1 19 TRP HE1 . 18 . HE1 1 1
136 1 1 1 1 5 LEU H . 4 . HN 1 1
136 1 2 1 1 5 LEU MD1 . 4 . HD1# 1 1
137 1 1 1 1 5 LEU H . 4 . HN 1 1
137 1 2 1 1 5 LEU MD2 . 4 . HD2# 1 1
138 1 1 1 1 5 LEU HA . 4 . HA 1 1
138 1 2 1 1 5 LEU MD1 . 4 . HD1# 1 1
139 1 1 1 1 5 LEU HA . 4 . HA 1 1
139 1 2 1 1 5 LEU MD2 . 4 . HD2# 1 1
140 1 1 1 1 5 LEU MD2 . 4 . HD2# 1 1
140 1 2 1 1 8 ALA H . 7 . HN 1 1
141 1 1 1 1 7 LEU H . 6 . HN 1 1
141 1 2 1 1 7 LEU HB3 . 6 . HB1 1 1
142 1 1 1 1 7 LEU H . 6 . HN 1 1
142 1 2 1 1 7 LEU HB2 . 6 . HB2 1 1
143 1 1 1 1 3 TRP HZ2 . 2 . HZ2 1 1
143 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
144 1 1 1 1 3 TRP HZ2 . 2 . HZ2 1 1
144 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
145 1 1 1 1 7 LEU MD1 . 6 . HD1# 1 1
145 1 2 1 1 8 ALA H . 7 . HN 1 1
146 1 1 1 1 7 LEU MD2 . 6 . HD2# 1 1
146 1 2 1 1 8 ALA H . 7 . HN 1 1
147 1 1 1 1 7 LEU MD1 . 6 . HD1# 1 1
147 1 2 1 1 10 ALA H . 9 . HN 1 1
148 1 1 1 1 7 LEU MD2 . 6 . HD2# 1 1
148 1 2 1 1 10 ALA H . 9 . HN 1 1
149 1 1 1 1 7 LEU HB3 . 6 . HB1 1 1
149 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
150 1 1 1 1 7 LEU HB3 . 6 . HB1 1 1
150 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
151 1 1 1 1 7 LEU HB2 . 6 . HB2 1 1
151 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
152 1 1 1 1 7 LEU H . 6 . HN 1 1
152 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
153 1 1 1 1 7 LEU H . 6 . HN 1 1
153 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
154 1 1 1 1 4 TRP HA . 3 . HA 1 1
154 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
155 1 1 1 1 4 TRP HA . 3 . HA 1 1
155 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
156 1 1 1 1 9 LEU MD1 . 8 . HD1# 1 1
156 1 2 1 1 10 ALA H . 9 . HN 1 1
157 1 1 1 1 9 LEU MD2 . 8 . HD2# 1 1
157 1 2 1 1 10 ALA H . 9 . HN 1 1
158 1 1 1 1 14 ALA MB . 13 . HB# 1 1
158 1 2 1 1 17 LEU H . 16 . HN 1 1
159 1 1 1 1 14 ALA MB . 13 . HB# 1 1
159 1 2 1 1 18 TRP H . 17 . HN 1 1
160 1 1 1 1 15 LEU QD . 14 . HD1# 1 1
160 1 2 1 1 16 ALA H . 15 . HN 1 1
161 1 1 1 1 15 LEU H . 14 . HN 1 1
161 1 2 1 1 15 LEU MD1 . 14 . HD1# 1 1
162 1 1 1 1 15 LEU H . 14 . HN 1 1
162 1 2 1 1 15 LEU MD2 . 14 . HD2# 1 1
163 1 1 1 1 18 TRP HB3 . 17 . HB1 1 1
163 1 2 1 1 18 TRP HZ3 . 17 . HZ3 1 1
164 1 1 1 1 15 LEU MD1 . 14 . HD1# 1 1
164 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
165 1 1 1 1 15 LEU MD2 . 14 . HD2# 1 1
165 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
166 1 1 1 1 15 LEU MD1 . 14 . HD1# 1 1
166 1 2 1 1 19 TRP HZ3 . 18 . HZ3 1 1
167 1 1 1 1 15 LEU MD2 . 14 . HD2# 1 1
167 1 2 1 1 19 TRP HZ3 . 18 . HZ3 1 1
168 1 1 1 1 15 LEU MD2 . 14 . HD2# 1 1
168 1 2 1 1 18 TRP HH2 . 17 . HH2 1 1
169 1 1 1 1 15 LEU MD1 . 14 . HD1# 1 1
169 1 2 1 1 18 TRP HH2 . 17 . HH2 1 1
170 1 1 1 1 16 ALA MB . 15 . HB# 1 1
170 1 2 1 1 19 TRP H . 18 . HN 1 1
171 1 1 1 1 19 TRP H . 18 . HN 1 1
171 1 2 1 1 20 ALA MB . 19 . HB# 1 1
172 1 1 1 1 6 ALA MB . 5 . HB# 1 1
172 1 2 1 1 9 LEU H . 8 . HN 1 1
173 1 1 1 1 13 LEU HA . 12 . HA 1 1
173 1 2 1 1 13 LEU QD . 12 . HD# 1 1
174 1 1 1 1 13 LEU QD . 12 . HD# 1 1
174 1 2 1 1 16 ALA H . 15 . HN 1 1
175 1 1 1 1 16 ALA MB . 15 . HB# 1 1
175 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
176 1 1 1 1 3 TRP HE3 . 2 . HE3 1 1
176 1 2 1 1 6 ALA MB . 5 . HB# 1 1
177 1 1 1 1 3 TRP HZ2 . 2 . HZ2 1 1
177 1 2 1 1 6 ALA MB . 5 . HB# 1 1
178 1 1 1 1 9 LEU HA . 8 . HA 1 1
178 1 2 1 1 9 LEU QB . 8 . HB# 1 1
179 1 1 1 1 9 LEU H . 8 . HN 1 1
179 1 2 1 1 9 LEU QB . 8 . HB# 1 1
180 1 1 1 1 9 LEU QB . 8 . HB# 1 1
180 1 2 1 1 10 ALA H . 9 . HN 1 1
181 1 1 1 1 9 LEU QB . 8 . HB# 1 1
181 1 2 1 1 9 LEU MD1 . 8 . HD1# 1 1
182 1 1 1 1 9 LEU QB . 8 . HB# 1 1
182 1 2 1 1 9 LEU MD2 . 8 . HD2# 1 1
183 1 1 1 1 9 LEU H . 8 . HN 1 1
183 1 2 1 1 9 LEU MD1 . 8 . HD1# 1 1
184 1 1 1 1 9 LEU H . 8 . HN 1 1
184 1 2 1 1 9 LEU MD2 . 8 . HD2# 1 1
185 1 1 1 1 13 LEU QB . 12 . HB# 1 1
185 1 2 1 1 13 LEU QD . 12 . HD# 1 1
186 1 1 1 1 13 LEU H . 12 . HN 1 1
186 1 2 1 1 13 LEU QD . 12 . HD# 1 1
187 1 1 1 1 14 ALA MB . 13 . HB# 1 1
187 1 2 1 1 15 LEU H . 14 . HN 1 1
188 1 1 1 1 13 LEU HA . 12 . HA 1 1
188 1 2 1 1 16 ALA MB . 15 . HB# 1 1
189 1 1 1 1 16 ALA MB . 15 . HB# 1 1
189 1 2 1 1 18 TRP H . 17 . HN 1 1
190 1 1 1 1 17 LEU HA . 16 . HA 1 1
190 1 2 1 1 20 ALA MB . 19 . HB# 1 1
191 1 1 1 1 19 TRP HE3 . 18 . HE3 1 1
191 1 2 1 1 20 ALA MB . 19 . HB# 1 1
192 1 1 1 1 19 TRP HZ3 . 18 . HZ3 1 1
192 1 2 1 1 20 ALA MB . 19 . HB# 1 1
193 1 1 1 1 6 ALA HA . 5 . HA 1 1
193 1 2 1 1 6 ALA MB . 5 . HB# 1 1
194 1 1 1 1 6 ALA H . 5 . HN 1 1
194 1 2 1 1 6 ALA MB . 5 . HB# 1 1
195 1 1 1 1 6 ALA MB . 5 . HB# 1 1
195 1 2 1 1 7 LEU H . 6 . HN 1 1
196 1 1 1 1 8 ALA HA . 7 . HA 1 1
196 1 2 1 1 8 ALA MB . 7 . HB# 1 1
197 1 1 1 1 8 ALA H . 7 . HN 1 1
197 1 2 1 1 8 ALA MB . 7 . HB# 1 1
198 1 1 1 1 8 ALA MB . 7 . HB# 1 1
198 1 2 1 1 9 LEU H . 8 . HN 1 1
199 1 1 1 1 10 ALA HA . 9 . HA 1 1
199 1 2 1 1 10 ALA MB . 9 . HB# 1 1
200 1 1 1 1 10 ALA H . 9 . HN 1 1
200 1 2 1 1 10 ALA MB . 9 . HB# 1 1
201 1 1 1 1 12 ALA MB . 11 . HB# 1 1
201 1 2 1 1 13 LEU H . 12 . HN 1 1
202 1 1 1 1 14 ALA HA . 13 . HA 1 1
202 1 2 1 1 14 ALA MB . 13 . HB# 1 1
203 1 1 1 1 14 ALA H . 13 . HN 1 1
203 1 2 1 1 14 ALA MB . 13 . HB# 1 1
204 1 1 1 1 16 ALA H . 15 . HN 1 1
204 1 2 1 1 16 ALA MB . 15 . HB# 1 1
205 1 1 1 1 16 ALA MB . 15 . HB# 1 1
205 1 2 1 1 17 LEU H . 16 . HN 1 1
206 1 1 1 1 20 ALA HA . 19 . HA 1 1
206 1 2 1 1 20 ALA MB . 19 . HB# 1 1
207 1 1 1 1 20 ALA H . 19 . HN 1 1
207 1 2 1 1 20 ALA MB . 19 . HB# 1 1
208 1 1 1 1 4 TRP HA . 3 . HA 1 1
208 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1
209 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1
209 1 2 1 1 5 LEU HA . 4 . HA 1 1
210 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1
210 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
211 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1
211 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
212 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1
212 1 2 1 1 8 ALA MB . 7 . HB# 1 1
213 1 1 1 1 4 TRP HH2 . 3 . HH2 1 1
213 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
214 1 1 1 1 4 TRP HH2 . 3 . HH2 1 1
214 1 2 1 1 5 LEU MD1 . 4 . HD1# 1 1
215 1 1 1 1 4 TRP HH2 . 3 . HH2 1 1
215 1 2 1 1 5 LEU MD2 . 4 . HD2# 1 1
216 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1
216 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
217 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1
217 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
218 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1
218 1 2 1 1 8 ALA MB . 7 . HB# 1 1
219 1 1 1 1 8 ALA HA . 7 . HA 1 1
219 1 2 1 1 11 PRO HA . 10 . HA 1 1
220 1 1 1 1 7 LEU HA . 6 . HA 1 1
220 1 2 1 1 11 PRO HA . 10 . HA 1 1
221 1 1 1 1 2 GLY H . 1 . HN 1 1
221 1 2 1 1 2 GLY HA3 . 1 . HA1 1 1
222 1 1 1 1 2 GLY H . 1 . HN 1 1
222 1 2 1 1 2 GLY HA2 . 1 . HA2 1 1
223 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
223 1 2 1 1 3 TRP H . 2 . HN 1 1
224 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
224 1 2 1 1 3 TRP H . 2 . HN 1 1
225 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
225 1 2 1 1 4 TRP HE1 . 3 . HE1 1 1
226 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
226 1 2 1 1 4 TRP HE1 . 3 . HE1 1 1
227 1 1 1 1 2 GLY H . 1 . HN 1 1
227 1 2 1 1 4 TRP HE1 . 3 . HE1 1 1
228 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
228 1 2 1 1 5 LEU H . 4 . HN 1 1
229 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
229 1 2 1 1 5 LEU H . 4 . HN 1 1
230 1 1 1 1 2 GLY H . 1 . HN 1 1
230 1 2 1 1 3 TRP H . 2 . HN 1 1
231 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
231 1 2 1 1 4 TRP H . 3 . HN 1 1
232 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
232 1 2 1 1 4 TRP H . 3 . HN 1 1
233 1 1 1 1 2 GLY H . 1 . HN 1 1
233 1 2 1 1 5 LEU QB . 4 . HB# 1 1
234 1 1 1 1 2 GLY H . 1 . HN 1 1
234 1 2 1 1 5 LEU HG . 4 . HG 1 1
235 1 1 1 1 2 GLY QA . 1 . HA2 1 1
235 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.2 1.8 2.8 1 1
2 1 . . . . . 3.4 1.8 5.5 1 1
3 1 . . . . . 3.4 1.8 5.5 1 1
4 1 . . . . . 2.2 1.8 2.8 1 1
5 1 . . . . . 2.2 1.8 2.8 1 1
6 1 . . . . . 2.2 1.8 2.8 1 1
7 1 . . . . . 2.2 1.8 2.8 1 1
8 1 . . . . . 2.2 1.8 2.8 1 1
9 1 . . . . . 2.2 1.8 2.8 1 1
10 1 . . . . . 2.2 1.8 2.8 1 1
11 1 . . . . . 2.2 1.8 2.8 1 1
12 1 . . . . . 2.2 1.8 2.8 1 1
13 1 . . . . . 2.2 1.8 2.8 1 1
14 1 . . . . . 2.2 1.8 2.8 1 1
15 1 . . . . . 2.2 1.8 2.8 1 1
16 1 . . . . . 2.2 1.8 2.8 1 1
17 1 . . . . . 2.2 1.8 2.8 1 1
18 1 . . . . . 2.2 1.8 2.8 1 1
19 1 . . . . . 2.2 1.8 2.8 1 1
20 1 . . . . . 2.2 1.8 2.8 1 1
21 1 . . . . . 2.2 1.8 2.8 1 1
22 1 . . . . . 2.2 1.8 2.8 1 1
23 1 . . . . . 2.2 1.8 2.8 1 1
24 1 . . . . . 2.2 1.8 2.8 1 1
25 1 . . . . . 2.2 1.8 2.8 1 1
26 1 . . . . . 2.2 1.8 2.8 1 1
27 1 . . . . . 2.2 1.8 2.8 1 1
28 1 . . . . . 2.2 1.8 2.8 1 1
29 1 . . . . . 2.2 1.8 2.8 1 1
30 1 . . . . . 2.6 1.8 3.5 1 1
31 1 . . . . . 2.2 1.8 2.8 1 1
32 1 . . . . . 2.2 1.8 2.8 1 1
33 1 . . . . . 2.2 1.8 2.8 1 1
34 1 . . . . . 2.2 1.8 2.8 1 1
35 1 . . . . . 2.6 1.8 3.5 1 1
36 1 . . . . . 2.2 1.8 2.8 1 1
37 1 . . . . . 2.2 1.8 2.8 1 1
38 1 . . . . . 2.2 1.8 2.8 1 1
39 1 . . . . . 2.2 1.8 2.8 1 1
40 1 . . . . . 2.2 1.8 2.8 1 1
41 1 . . . . . 2.2 1.8 2.8 1 1
42 1 . . . . . 3.4 1.8 5.5 1 1
43 1 . . . . . 3.4 1.8 5.5 1 1
44 1 . . . . . 3.4 1.8 5.5 1 1
45 1 . . . . . 2.6 1.8 3.5 1 1
46 1 . . . . . 2.2 1.8 2.8 1 1
47 1 . . . . . 2.2 1.8 2.8 1 1
48 1 . . . . . 2.6 1.8 3.5 1 1
49 1 . . . . . 2.6 1.8 3.5 1 1
50 1 . . . . . 2.6 1.8 3.5 1 1
51 1 . . . . . 2.6 1.8 3.5 1 1
52 1 . . . . . 2.6 1.8 3.5 1 1
53 1 . . . . . 2.6 1.8 3.5 1 1
54 1 . . . . . 2.6 1.8 3.5 1 1
55 1 . . . . . 2.6 1.8 3.5 1 1
56 1 . . . . . 2.6 1.8 3.5 1 1
57 1 . . . . . 2.6 1.8 3.5 1 1
58 1 . . . . . 2.6 1.8 3.5 1 1
59 1 . . . . . 3.4 1.8 5.5 1 1
60 1 . . . . . 2.6 1.8 3.5 1 1
61 1 . . . . . 3.4 1.8 5.5 1 1
62 1 . . . . . 2.6 1.8 3.5 1 1
63 1 . . . . . 2.6 1.8 3.5 1 1
64 1 . . . . . 2.6 1.8 3.5 1 1
65 1 . . . . . 2.6 1.8 3.5 1 1
66 1 . . . . . 2.6 1.8 3.5 1 1
67 1 . . . . . 2.6 1.8 3.5 1 1
68 1 . . . . . 2.6 1.8 3.5 1 1
69 1 . . . . . 2.6 1.8 3.5 1 1
70 1 . . . . . 2.6 1.8 3.5 1 1
71 1 . . . . . 2.6 1.8 3.5 1 1
72 1 . . . . . 2.6 1.8 3.5 1 1
73 1 . . . . . 3.4 1.8 5.5 1 1
74 1 . . . . . 2.6 1.8 3.5 1 1
75 1 . . . . . 2.6 1.8 3.5 1 1
76 1 . . . . . 2.6 1.8 3.5 1 1
77 1 . . . . . 2.6 1.8 3.5 1 1
78 1 . . . . . 2.6 1.8 3.5 1 1
79 1 . . . . . 2.6 1.8 3.5 1 1
80 1 . . . . . 2.6 1.8 3.5 1 1
81 1 . . . . . 2.6 1.8 3.5 1 1
82 1 . . . . . 2.6 1.8 3.5 1 1
83 1 . . . . . 2.6 1.8 3.5 1 1
84 1 . . . . . 2.6 1.8 3.5 1 1
85 1 . . . . . 2.6 1.8 3.5 1 1
86 1 . . . . . 2.6 1.8 3.5 1 1
87 1 . . . . . 2.6 1.8 3.5 1 1
88 1 . . . . . 3.4 1.8 5.5 1 1
89 1 . . . . . 2.6 1.8 3.5 1 1
90 1 . . . . . 2.6 1.8 3.5 1 1
91 1 . . . . . 2.6 1.8 3.5 1 1
92 1 . . . . . 2.6 1.8 3.5 1 1
93 1 . . . . . 2.6 1.8 3.5 1 1
94 1 . . . . . 2.6 1.8 3.5 1 1
95 1 . . . . . 2.6 1.8 3.5 1 1
96 1 . . . . . 2.6 1.8 3.5 1 1
97 1 . . . . . 2.2 1.8 2.8 1 1
98 1 . . . . . 2.6 1.8 3.5 1 1
99 1 . . . . . 3.4 1.8 5.5 1 1
100 1 . . . . . 3.4 1.8 5.5 1 1
101 1 . . . . . 3.4 1.8 5.5 1 1
102 1 . . . . . 3.4 1.8 5.5 1 1
103 1 . . . . . 3.4 1.8 5.5 1 1
104 1 . . . . . 3.4 1.8 5.5 1 1
105 1 . . . . . 3.4 1.8 5.5 1 1
106 1 . . . . . 3.4 1.8 5.5 1 1
107 1 . . . . . 3.4 1.8 5.5 1 1
108 1 . . . . . 3.4 1.8 5.5 1 1
109 1 . . . . . 3.4 1.8 5.5 1 1
110 1 . . . . . 3.4 1.8 5.5 1 1
111 1 . . . . . 3.4 1.8 5.5 1 1
112 1 . . . . . 3.4 1.8 5.5 1 1
113 1 . . . . . 3.4 1.8 5.5 1 1
114 1 . . . . . 3.4 1.8 5.5 1 1
115 1 . . . . . 3.4 1.8 5.5 1 1
116 1 . . . . . 3.4 1.8 5.5 1 1
117 1 . . . . . 3.4 1.8 5.5 1 1
118 1 . . . . . 3.4 1.8 5.5 1 1
119 1 . . . . . 3.4 1.8 5.5 1 1
120 1 . . . . . 3.4 1.8 5.5 1 1
121 1 . . . . . 3.4 1.8 5.5 1 1
122 1 . . . . . 3.4 1.8 5.5 1 1
123 1 . . . . . 3.4 1.8 5.5 1 1
124 1 . . . . . 3.4 1.8 5.5 1 1
125 1 . . . . . 3.4 1.8 5.5 1 1
126 1 . . . . . 3.4 1.8 6.0 1 1
127 1 . . . . . 3.4 1.8 6.0 1 1
128 1 . . . . . 3.4 1.8 6.0 1 1
129 1 . . . . . 3.4 1.8 6.0 1 1
130 1 . . . . . 3.4 1.8 5.5 1 1
131 1 . . . . . 3.4 1.8 5.5 1 1
132 1 . . . . . 3.4 1.8 6.0 1 1
133 1 . . . . . 3.4 1.8 6.0 1 1
134 1 . . . . . 3.4 1.8 6.0 1 1
135 1 . . . . . 3.4 1.8 6.0 1 1
136 1 . . . . . 3.4 1.8 6.5 1 1
137 1 . . . . . 3.4 1.8 6.0 1 1
138 1 . . . . . 2.6 1.8 4.0 1 1
139 1 . . . . . 2.2 1.8 3.5 1 1
140 1 . . . . . 3.4 1.8 6.5 1 1
141 1 . . . . . 2.6 1.8 3.5 1 1
142 1 . . . . . 2.2 1.8 2.8 1 1
143 1 . . . . . 3.4 1.8 6.5 1 1
144 1 . . . . . 3.4 1.8 6.5 1 1
145 1 . . . . . 3.4 1.8 6.5 1 1
146 1 . . . . . 3.4 1.8 6.5 1 1
147 1 . . . . . 3.4 1.8 6.5 1 1
148 1 . . . . . 3.4 1.8 6.5 1 1
149 1 . . . . . 2.6 1.8 3.5 1 1
150 1 . . . . . 2.6 1.8 3.5 1 1
151 1 . . . . . 2.6 1.8 3.5 1 1
152 1 . . . . . 2.6 1.8 4.0 1 1
153 1 . . . . . 2.6 1.8 4.0 1 1
154 1 . . . . . 3.4 1.8 6.5 1 1
155 1 . . . . . 3.4 1.8 6.5 1 1
156 1 . . . . . 3.4 1.8 5.5 1 1
157 1 . . . . . 3.4 1.8 6.5 1 1
158 1 . . . . . 3.4 1.8 6.5 1 1
159 1 . . . . . 3.4 1.8 6.5 1 1
160 1 . . . . . 3.4 1.8 6.5 1 1
161 1 . . . . . 3.4 1.8 6.5 1 1
162 1 . . . . . 3.4 1.8 6.5 1 1
163 1 . . . . . 3.4 1.8 5.5 1 1
164 1 . . . . . 3.4 1.8 6.0 1 1
165 1 . . . . . 3.4 1.8 6.0 1 1
166 1 . . . . . 3.4 1.8 6.5 1 1
167 1 . . . . . 3.4 1.8 6.5 1 1
168 1 . . . . . 3.4 1.8 6.5 1 1
169 1 . . . . . 3.4 1.8 6.5 1 1
170 1 . . . . . 3.4 1.8 6.5 1 1
171 1 . . . . . 3.4 1.8 6.5 1 1
172 1 . . . . . 3.4 1.8 6.0 1 1
173 1 . . . . . 3.4 1.8 6.0 1 1
174 1 . . . . . 3.4 1.8 6.0 1 1
175 1 . . . . . 3.4 1.8 6.0 1 1
176 1 . . . . . 2.6 1.8 4.0 1 1
177 1 . . . . . 2.6 1.8 4.0 1 1
178 1 . . . . . 2.6 1.8 3.5 1 1
179 1 . . . . . 2.2 1.8 2.8 1 1
180 1 . . . . . 2.2 1.8 2.8 1 1
181 1 . . . . . 2.6 1.8 4.0 1 1
182 1 . . . . . 2.6 1.8 4.0 1 1
183 1 . . . . . 2.6 1.8 4.0 1 1
184 1 . . . . . 2.6 1.8 4.0 1 1
185 1 . . . . . 2.6 1.8 4.0 1 1
186 1 . . . . . 2.6 1.8 4.0 1 1
187 1 . . . . . 2.6 1.8 4.0 1 1
188 1 . . . . . 2.6 1.8 4.0 1 1
189 1 . . . . . 3.4 1.8 6.0 1 1
190 1 . . . . . 2.6 1.8 4.0 1 1
191 1 . . . . . 2.6 1.8 4.0 1 1
192 1 . . . . . 2.6 1.8 4.0 1 1
193 1 . . . . . 2.2 1.8 3.5 1 1
194 1 . . . . . 2.2 1.8 3.5 1 1
195 1 . . . . . 2.2 1.8 3.5 1 1
196 1 . . . . . 2.2 1.8 3.5 1 1
197 1 . . . . . 2.2 1.8 3.5 1 1
198 1 . . . . . 2.2 1.8 3.5 1 1
199 1 . . . . . 2.2 1.8 3.5 1 1
200 1 . . . . . 2.2 1.8 3.5 1 1
201 1 . . . . . 2.2 1.8 3.5 1 1
202 1 . . . . . 2.2 1.8 3.5 1 1
203 1 . . . . . 2.2 1.8 3.5 1 1
204 1 . . . . . 2.2 1.8 3.5 1 1
205 1 . . . . . 2.2 1.8 3.5 1 1
206 1 . . . . . 2.2 1.8 3.5 1 1
207 1 . . . . . 2.2 1.8 3.5 1 1
208 1 . . . . . 3.4 1.8 6.0 1 1
209 1 . . . . . 3.4 1.8 6.0 1 1
210 1 . . . . . 3.4 1.8 6.0 1 1
211 1 . . . . . 3.4 1.8 6.0 1 1
212 1 . . . . . 3.4 1.8 6.0 1 1
213 1 . . . . . 3.4 1.8 6.5 1 1
214 1 . . . . . 3.4 1.8 6.5 1 1
215 1 . . . . . 3.4 1.8 6.5 1 1
216 1 . . . . . 3.4 1.8 6.0 1 1
217 1 . . . . . 3.4 1.8 6.0 1 1
218 1 . . . . . 3.4 1.8 6.0 1 1
219 1 . . . . . 3.4 1.8 5.5 1 1
220 1 . . . . . 3.4 1.8 5.5 1 1
221 1 . . . . . 2.2 1.8 2.8 1 1
222 1 . . . . . 2.2 1.8 2.8 1 1
223 1 . . . . . 2.2 1.8 2.8 1 1
224 1 . . . . . 2.2 1.8 2.8 1 1
225 1 . . . . . 3.4 1.8 5.5 1 1
226 1 . . . . . 3.4 1.8 5.5 1 1
227 1 . . . . . 3.4 1.8 5.5 1 1
228 1 . . . . . 3.4 1.8 6.0 1 1
229 1 . . . . . 3.4 1.8 6.0 1 1
230 1 . . . . . 2.6 1.8 3.5 1 1
231 1 . . . . . 3.4 1.8 5.5 1 1
232 1 . . . . . 3.4 1.8 5.5 1 1
233 1 . . . . . 3.4 1.8 5.5 1 1
234 1 . . . . . 2.6 1.8 3.5 1 1
235 1 . . . . . 3.4 1.8 6.0 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
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 TRP H . 3 . HN 1 2
1 1 2 1 1 4 TRP QB . 3 . HB2 1 2
2 1 1 1 1 18 TRP QB . 17 . HB2 1 2
2 1 2 1 1 19 TRP H . 18 . HN 1 2
3 1 1 1 1 15 LEU HA . 14 . HA 1 2
3 1 2 1 1 18 TRP QB . 17 . HB2 1 2
4 1 1 1 1 17 LEU H . 16 . HN 1 2
4 1 2 1 1 18 TRP QB . 17 . HB2 1 2
5 1 1 1 1 18 TRP QB . 17 . HB2 1 2
5 1 2 1 1 18 TRP HE3 . 17 . HE3 1 2
6 1 1 1 1 18 TRP HE3 . 17 . HE3 1 2
6 1 2 1 1 19 TRP QB . 18 . HB2 1 2
7 1 1 1 1 18 TRP HZ3 . 17 . HZ3 1 2
7 1 2 1 1 19 TRP QB . 18 . HB2 1 2
8 1 1 1 1 5 LEU QB . 4 . HB# 1 2
8 1 2 1 1 5 LEU QD . 4 . HD1# 1 2
9 1 1 1 1 7 LEU HA . 6 . HA 1 2
9 1 2 1 1 7 LEU QD . 6 . HD1# 1 2
10 1 1 1 1 3 TRP HE3 . 2 . HE3 1 2
10 1 2 1 1 7 LEU QD . 6 . HD1# 1 2
11 1 1 1 1 9 LEU HA . 8 . HA 1 2
11 1 2 1 1 9 LEU QD . 8 . HD1# 1 2
12 1 1 1 1 15 LEU QD . 14 . HD1# 1 2
12 1 2 1 1 19 TRP HE1 . 18 . HE1 1 2
13 1 1 1 1 7 LEU QB . 6 . HB2 1 2
13 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 2
14 1 1 1 1 7 LEU QB . 6 . HB2 1 2
14 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 2
15 1 1 1 1 17 LEU QD . 16 . HD1# 1 2
15 1 2 1 1 20 ALA H . 19 . HN 1 2
16 1 1 1 1 17 LEU HA . 16 . HA 1 2
16 1 2 1 1 17 LEU QD . 16 . HD1# 1 2
17 1 1 1 1 7 LEU QD . 6 . HD1# 1 2
17 1 2 1 1 11 PRO QG . 10 . HG# 1 2
18 1 1 1 1 15 LEU QD . 14 . HD1# 1 2
18 1 2 1 1 18 TRP HZ3 . 17 . HZ3 1 2
19 1 1 1 1 4 TRP HE3 . 3 . HE3 1 2
19 1 2 1 1 5 LEU MD2 . 4 . HD2# 1 2
20 1 1 1 1 4 TRP HE3 . 3 . HE3 1 2
20 1 2 1 1 5 LEU MD1 . 4 . HD1# 1 2
21 1 1 1 1 7 LEU HB3 . 6 . HB1 1 2
21 1 2 1 1 7 LEU HG . 6 . HG 1 2
22 1 1 1 1 7 LEU HB2 . 6 . HB2 1 2
22 1 2 1 1 7 LEU HG . 6 . HG 1 2
23 1 1 1 1 14 ALA HA . 13 . HA 1 2
23 1 2 1 1 17 LEU HB2 . 16 . HB2 1 2
24 1 1 1 1 7 LEU HB2 . 6 . HB2 1 2
24 1 2 1 1 8 ALA H . 7 . HN 1 2
25 1 1 1 1 17 LEU HB2 . 16 . HB2 1 2
25 1 2 1 1 18 TRP H . 17 . HN 1 2
26 1 1 1 1 14 ALA HA . 13 . HA 1 2
26 1 2 1 1 17 LEU MD2 . 16 . HD2# 1 2
27 1 1 1 1 14 ALA HA . 13 . HA 1 2
27 1 2 1 1 17 LEU MD1 . 16 . HD1# 1 2
28 1 1 1 1 17 LEU MD1 . 16 . HD1# 1 2
28 1 2 1 1 18 TRP H . 17 . HN 1 2
29 1 1 1 1 2 GLY H . 1 . HN 1 2
29 1 2 1 1 5 LEU MD1 . 4 . HD1# 1 2
30 1 1 1 1 2 GLY H . 1 . HN 1 2
30 1 2 1 1 5 LEU MD2 . 4 . HD2# 1 2
31 1 1 1 1 7 LEU HA . 6 . HA 1 2
31 1 2 1 1 7 LEU HB2 . 6 . HB2 1 2
32 1 1 1 1 17 LEU HA . 16 . HA 1 2
32 1 2 1 1 17 LEU HB3 . 16 . HB1 1 2
33 1 1 1 1 17 LEU HB2 . 16 . HB2 1 2
33 1 2 1 1 17 LEU QD . 16 . HD# 1 2
34 1 1 1 1 17 LEU H . 16 . HN 1 2
34 1 2 1 1 17 LEU MD1 . 16 . HD1# 1 2
35 1 1 1 1 17 LEU H . 16 . HN 1 2
35 1 2 1 1 17 LEU MD2 . 16 . HD2# 1 2
36 1 1 1 1 21 ETA HA1 . 20 . HA# 1 2
36 1 1 1 1 21 ETA HA2 . 20 . HA# 1 2
36 1 2 1 1 21 ETA HB1 . 20 . HB# 1 2
36 1 2 1 1 21 ETA HB2 . 20 . HB# 1 2
37 1 1 1 1 16 ALA MB . 15 . HB# 1 2
37 1 2 1 1 19 TRP HB3 . 18 . HB1 1 2
38 1 1 1 1 19 TRP HB3 . 18 . HB1 1 2
38 1 2 1 1 20 ALA MB . 19 . HB# 1 2
39 1 1 1 1 16 ALA MB . 15 . HB# 1 2
39 1 2 1 1 19 TRP HB2 . 18 . HB2 1 2
40 1 1 1 1 19 TRP HB2 . 18 . HB2 1 2
40 1 2 1 1 20 ALA MB . 19 . HB# 1 2
41 1 1 1 1 20 ALA MB . 19 . HB# 1 2
41 1 2 1 1 21 ETA HB1 . 20 . HB1 1 2
41 1 2 1 1 21 ETA HB2 . 20 . HB2 1 2
42 1 1 1 1 20 ALA MB . 19 . HB# 1 2
42 1 2 1 1 21 ETA HA1 . 20 . HA1 1 2
42 1 2 1 1 21 ETA HA2 . 20 . HA2 1 2
43 1 1 1 1 3 TRP HB3 . 2 . HB1 1 2
43 1 2 1 1 6 ALA MB . 5 . HB# 1 2
44 1 1 1 1 3 TRP HB2 . 2 . HB2 1 2
44 1 2 1 1 6 ALA MB . 5 . HB# 1 2
45 1 1 1 1 4 TRP HB3 . 3 . HB1 1 2
45 1 2 1 1 6 ALA MB . 5 . HB# 1 2
46 1 1 1 1 15 LEU MD1 . 14 . HD1# 1 2
46 1 2 1 1 19 TRP HB3 . 18 . HB1 1 2
47 1 1 1 1 4 TRP HA . 3 . HA 1 2
47 1 2 1 1 7 LEU HB2 . 6 . HB2 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.2 1.8 2.8 1 2
2 1 . . . . . 2.2 1.8 2.8 1 2
3 1 . . . . . 3.4 1.8 5.5 1 2
4 1 . . . . . 3.4 1.8 6.0 1 2
5 1 . . . . . 3.4 1.8 3.5 1 2
6 1 . . . . . 3.4 1.8 5.5 1 2
7 1 . . . . . 3.4 1.8 6.0 1 2
8 1 . . . . . 2.2 1.8 2.8 1 2
9 1 . . . . . 2.2 1.8 3.5 1 2
10 1 . . . . . 3.4 1.8 6.5 1 2
11 1 . . . . . 3.4 1.8 6.0 1 2
12 1 . . . . . 3.4 1.8 6.5 1 2
13 1 . . . . . 2.6 1.8 4.0 1 2
14 1 . . . . . 2.6 1.8 4.0 1 2
15 1 . . . . . 3.4 1.8 6.5 1 2
16 1 . . . . . 2.6 1.8 4.0 1 2
17 1 . . . . . 3.4 1.8 6.0 1 2
18 1 . . . . . 3.4 1.8 6.0 1 2
19 1 . . . . . 3.4 1.8 6.0 1 2
20 1 . . . . . 3.4 1.8 6.5 1 2
21 1 . . . . . 2.2 1.8 2.8 1 2
22 1 . . . . . 2.6 1.8 4.0 1 2
23 1 . . . . . 2.6 1.8 4.0 1 2
24 1 . . . . . 2.2 1.8 2.8 1 2
25 1 . . . . . 2.2 1.8 2.8 1 2
26 1 . . . . . 3.4 1.8 6.0 1 2
27 1 . . . . . 3.4 1.8 6.0 1 2
28 1 . . . . . 2.6 1.8 4.0 1 2
29 1 . . . . . 2.6 1.8 4.0 1 2
30 1 . . . . . 3.4 1.8 6.0 1 2
31 1 . . . . . 2.2 1.8 2.8 1 2
32 1 . . . . . 2.2 1.8 2.8 1 2
33 1 . . . . . 2.6 1.8 4.0 1 2
34 1 . . . . . 2.6 1.8 4.0 1 2
35 1 . . . . . 2.6 1.8 4.0 1 2
36 1 . . . . . 2.2 1.8 2.8 1 2
37 1 . . . . . 3.4 1.8 6.5 1 2
38 1 . . . . . 3.4 1.8 6.5 1 2
39 1 . . . . . 3.4 1.8 6.0 1 2
40 1 . . . . . 3.4 1.8 6.0 1 2
41 1 . . . . . 3.4 1.8 6.5 1 2
42 1 . . . . . 3.4 1.8 6.5 1 2
43 1 . . . . . 3.4 1.8 6.5 1 2
44 1 . . . . . 3.4 1.8 6.5 1 2
45 1 . . . . . 3.4 1.8 6.5 1 2
46 1 . . . . . 3.4 1.8 6.5 1 2
47 1 . . . . . 2.6 1.8 3.5 1 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 2 GLY C 1 1 3 TRP N 1 1 3 TRP CA 1 1 3 TRP C -68.0 -56.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1
2 . 1 1 3 TRP C 1 1 4 TRP N 1 1 4 TRP CA 1 1 4 TRP C -96.27 -42.73 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
3 . 1 1 4 TRP C 1 1 5 LEU N 1 1 5 LEU CA 1 1 5 LEU C -71.06 -56.11999 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1
4 . 1 1 5 LEU C 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C -88.17999 -48.54 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1
5 . 1 1 6 ALA C 1 1 7 LEU N 1 1 7 LEU CA 1 1 7 LEU C -95.23 -44.43 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
6 . 1 1 7 LEU C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -113.0 -53.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
7 . 1 1 8 ALA C 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU C -109.0 -49.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
8 . 1 1 11 PRO C 1 1 12 ALA N 1 1 12 ALA CA 1 1 12 ALA C -111.0 -30.999998 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
9 . 1 1 12 ALA C 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C -73.0 -60.999996 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
10 . 1 1 13 LEU C 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C -88.92 -45.96 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1
11 . 1 1 14 ALA C 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C -83.0 -50.999996 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1
12 . 1 1 15 LEU C 1 1 16 ALA N 1 1 16 ALA CA 1 1 16 ALA C -80.97 -54.05 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1
13 . 1 1 16 ALA C 1 1 17 LEU N 1 1 17 LEU CA 1 1 17 LEU C -72.9 -54.24 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1
14 . 1 1 17 LEU C 1 1 18 TRP N 1 1 18 TRP CA 1 1 18 TRP C -74.2 -54.44 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1
15 . 1 1 18 TRP C 1 1 19 TRP N 1 1 19 TRP CA 1 1 19 TRP C -69.0 -53.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1
16 . 1 1 3 TRP N 1 1 3 TRP CA 1 1 3 TRP C 1 1 4 TRP N -53.0 -33.0 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1
17 . 1 1 4 TRP N 1 1 4 TRP CA 1 1 4 TRP C 1 1 5 LEU N -69.28 -2.6 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1
18 . 1 1 5 LEU N 1 1 5 LEU CA 1 1 5 LEU C 1 1 6 ALA N -54.66 -23.4 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1
19 . 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C 1 1 7 LEU N -60.13 -1.49 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1
20 . 1 1 7 LEU N 1 1 7 LEU CA 1 1 7 LEU C 1 1 8 ALA N -56.44 -3.1399999 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1
21 . 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C 1 1 9 LEU N -70.0 30.0 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1
22 . 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU C 1 1 10 ALA N -65.0 30.999998 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1
23 . 1 1 12 ALA N 1 1 12 ALA CA 1 1 12 ALA C 1 1 13 LEU N -66.0 26.0 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1
24 . 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C 1 1 14 ALA N -57.0 -17.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1
25 . 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C 1 1 15 LEU N -74.62 8.88 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1
26 . 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C 1 1 16 ALA N -60.999996 -13.0 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1
27 . 1 1 16 ALA N 1 1 16 ALA CA 1 1 16 ALA C 1 1 17 LEU N -55.15 -27.85 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1
28 . 1 1 17 LEU N 1 1 17 LEU CA 1 1 17 LEU C 1 1 18 TRP N -53.46 -27.94 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1
29 . 1 1 18 TRP N 1 1 18 TRP CA 1 1 18 TRP C 1 1 19 TRP N -52.84 -35.94 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1
30 . 1 1 19 TRP N 1 1 19 TRP CA 1 1 19 TRP C 1 1 20 ALA N -52.0 -36.0 . 18 . N . 18 . CA . 18 . C . 19 . N 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 ACE C C 14.408 -6.229 13.630 1.00 . A A . 0 ACE C 1 1
1 2 1 1 1 ACE CH3 C 15.489 -7.026 12.909 1.00 . A A . 0 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 16.336 -6.387 12.711 1.00 . A A . 0 ACE H1 1 1
1 4 1 1 1 ACE H2 H 15.096 -7.406 11.978 1.00 . A A . 0 ACE H2 1 1
1 5 1 1 1 ACE H3 H 15.800 -7.853 13.531 1.00 . A A . 0 ACE H3 1 1
1 6 1 1 1 ACE O O 14.000 -6.583 14.737 1.00 . A A . 0 ACE O 1 1
1 7 1 1 2 GLY C C 12.139 -3.574 12.515 1.00 . A A . 1 GLY C 1 1
1 8 1 1 2 GLY CA C 12.918 -4.311 13.585 1.00 . A A . 1 GLY CA 1 1
1 9 1 1 2 GLY H H 14.294 -4.903 12.130 1.00 . A A . 1 GLY H 1 1
1 10 1 1 2 GLY HA2 H 12.237 -4.911 14.158 1.00 . A A . 1 GLY HA2 1 1
1 11 1 1 2 GLY HA3 H 13.384 -3.582 14.232 1.00 . A A . 1 GLY HA3 1 1
1 12 1 1 2 GLY N N 13.943 -5.147 13.001 1.00 . A A . 1 GLY N 1 1
1 13 1 1 2 GLY O O 11.686 -4.153 11.530 1.00 . A A . 1 GLY O 1 1
1 14 1 1 3 TRP C C 11.921 -1.430 10.433 1.00 . A A . 2 TRP C 1 1
1 15 1 1 3 TRP CA C 11.265 -1.427 11.829 1.00 . A A . 2 TRP CA 1 1
1 16 1 1 3 TRP CB C 11.162 0.006 12.463 1.00 . A A . 2 TRP CB 1 1
1 17 1 1 3 TRP CD1 C 12.924 1.572 11.625 1.00 . A A . 2 TRP CD1 1 1
1 18 1 1 3 TRP CD2 C 11.021 1.745 10.452 1.00 . A A . 2 TRP CD2 1 1
1 19 1 1 3 TRP CE2 C 11.925 2.668 9.884 1.00 . A A . 2 TRP CE2 1 1
1 20 1 1 3 TRP CE3 C 9.732 1.647 9.897 1.00 . A A . 2 TRP CE3 1 1
1 21 1 1 3 TRP CG C 11.689 1.069 11.553 1.00 . A A . 2 TRP CG 1 1
1 22 1 1 3 TRP CH2 C 10.282 3.361 8.261 1.00 . A A . 2 TRP CH2 1 1
1 23 1 1 3 TRP CZ2 C 11.566 3.468 8.802 1.00 . A A . 2 TRP CZ2 1 1
1 24 1 1 3 TRP CZ3 C 9.366 2.452 8.808 1.00 . A A . 2 TRP CZ3 1 1
1 25 1 1 3 TRP H H 12.386 -1.938 13.556 1.00 . A A . 2 TRP H 1 1
1 26 1 1 3 TRP HA H 10.268 -1.829 11.722 1.00 . A A . 2 TRP HA 1 1
1 27 1 1 3 TRP HB2 H 10.138 0.241 12.696 1.00 . A A . 2 TRP HB2 1 1
1 28 1 1 3 TRP HB3 H 11.733 0.013 13.380 1.00 . A A . 2 TRP HB3 1 1
1 29 1 1 3 TRP HD1 H 13.667 1.271 12.344 1.00 . A A . 2 TRP HD1 1 1
1 30 1 1 3 TRP HE1 H 13.888 3.052 10.466 1.00 . A A . 2 TRP HE1 1 1
1 31 1 1 3 TRP HE3 H 9.021 0.949 10.313 1.00 . A A . 2 TRP HE3 1 1
1 32 1 1 3 TRP HH2 H 9.995 3.978 7.422 1.00 . A A . 2 TRP HH2 1 1
1 33 1 1 3 TRP HZ2 H 12.274 4.163 8.386 1.00 . A A . 2 TRP HZ2 1 1
1 34 1 1 3 TRP HZ3 H 8.375 2.369 8.389 1.00 . A A . 2 TRP HZ3 1 1
1 35 1 1 3 TRP N N 11.993 -2.297 12.742 1.00 . A A . 2 TRP N 1 1
1 36 1 1 3 TRP NE1 N 13.077 2.529 10.634 1.00 . A A . 2 TRP NE1 1 1
1 37 1 1 3 TRP O O 11.226 -1.307 9.424 1.00 . A A . 2 TRP O 1 1
1 38 1 1 4 TRP C C 13.340 -2.550 8.088 1.00 . A A . 3 TRP C 1 1
1 39 1 1 4 TRP CA C 13.960 -1.571 9.100 1.00 . A A . 3 TRP CA 1 1
1 40 1 1 4 TRP CB C 15.461 -1.883 9.361 1.00 . A A . 3 TRP CB 1 1
1 41 1 1 4 TRP CD1 C 15.712 -4.121 10.467 1.00 . A A . 3 TRP CD1 1 1
1 42 1 1 4 TRP CD2 C 16.026 -4.228 8.251 1.00 . A A . 3 TRP CD2 1 1
1 43 1 1 4 TRP CE2 C 16.189 -5.540 8.742 1.00 . A A . 3 TRP CE2 1 1
1 44 1 1 4 TRP CE3 C 16.173 -4.011 6.870 1.00 . A A . 3 TRP CE3 1 1
1 45 1 1 4 TRP CG C 15.720 -3.352 9.370 1.00 . A A . 3 TRP CG 1 1
1 46 1 1 4 TRP CH2 C 16.629 -6.371 6.524 1.00 . A A . 3 TRP CH2 1 1
1 47 1 1 4 TRP CZ2 C 16.486 -6.604 7.895 1.00 . A A . 3 TRP CZ2 1 1
1 48 1 1 4 TRP CZ3 C 16.473 -5.077 6.013 1.00 . A A . 3 TRP CZ3 1 1
1 49 1 1 4 TRP H H 13.783 -1.654 11.190 1.00 . A A . 3 TRP H 1 1
1 50 1 1 4 TRP HA H 13.898 -0.581 8.672 1.00 . A A . 3 TRP HA 1 1
1 51 1 1 4 TRP HB2 H 16.066 -1.438 8.599 1.00 . A A . 3 TRP HB2 1 1
1 52 1 1 4 TRP HB3 H 15.744 -1.469 10.320 1.00 . A A . 3 TRP HB3 1 1
1 53 1 1 4 TRP HD1 H 15.520 -3.768 11.462 1.00 . A A . 3 TRP HD1 1 1
1 54 1 1 4 TRP HE1 H 16.039 -6.190 10.714 1.00 . A A . 3 TRP HE1 1 1
1 55 1 1 4 TRP HE3 H 16.057 -3.020 6.468 1.00 . A A . 3 TRP HE3 1 1
1 56 1 1 4 TRP HH2 H 16.859 -7.185 5.860 1.00 . A A . 3 TRP HH2 1 1
1 57 1 1 4 TRP HZ2 H 16.605 -7.598 8.297 1.00 . A A . 3 TRP HZ2 1 1
1 58 1 1 4 TRP HZ3 H 16.584 -4.899 4.953 1.00 . A A . 3 TRP HZ3 1 1
1 59 1 1 4 TRP N N 13.245 -1.562 10.377 1.00 . A A . 3 TRP N 1 1
1 60 1 1 4 TRP NE1 N 15.987 -5.427 10.102 1.00 . A A . 3 TRP NE1 1 1
1 61 1 1 4 TRP O O 13.816 -2.659 6.969 1.00 . A A . 3 TRP O 1 1
1 62 1 1 5 LEU C C 10.951 -3.405 6.435 1.00 . A A . 4 LEU C 1 1
1 63 1 1 5 LEU CA C 11.669 -4.186 7.531 1.00 . A A . 4 LEU CA 1 1
1 64 1 1 5 LEU CB C 10.690 -5.101 8.284 1.00 . A A . 4 LEU CB 1 1
1 65 1 1 5 LEU CD1 C 10.645 -6.797 10.155 1.00 . A A . 4 LEU CD1 1 1
1 66 1 1 5 LEU CD2 C 11.711 -7.407 7.995 1.00 . A A . 4 LEU CD2 1 1
1 67 1 1 5 LEU CG C 11.459 -6.254 8.981 1.00 . A A . 4 LEU CG 1 1
1 68 1 1 5 LEU H H 11.907 -3.156 9.353 1.00 . A A . 4 LEU H 1 1
1 69 1 1 5 LEU HA H 12.440 -4.784 7.080 1.00 . A A . 4 LEU HA 1 1
1 70 1 1 5 LEU HB2 H 10.171 -4.506 9.025 1.00 . A A . 4 LEU HB2 1 1
1 71 1 1 5 LEU HB3 H 9.970 -5.512 7.594 1.00 . A A . 4 LEU HB3 1 1
1 72 1 1 5 LEU HD11 H 11.224 -7.548 10.674 1.00 . A A . 4 LEU HD11 1 1
1 73 1 1 5 LEU HD12 H 9.733 -7.238 9.785 1.00 . A A . 4 LEU HD12 1 1
1 74 1 1 5 LEU HD13 H 10.408 -5.994 10.832 1.00 . A A . 4 LEU HD13 1 1
1 75 1 1 5 LEU HD21 H 10.778 -7.704 7.539 1.00 . A A . 4 LEU HD21 1 1
1 76 1 1 5 LEU HD22 H 12.128 -8.247 8.530 1.00 . A A . 4 LEU HD22 1 1
1 77 1 1 5 LEU HD23 H 12.404 -7.095 7.230 1.00 . A A . 4 LEU HD23 1 1
1 78 1 1 5 LEU HG H 12.407 -5.884 9.354 1.00 . A A . 4 LEU HG 1 1
1 79 1 1 5 LEU N N 12.286 -3.256 8.462 1.00 . A A . 4 LEU N 1 1
1 80 1 1 5 LEU O O 10.719 -3.916 5.339 1.00 . A A . 4 LEU O 1 1
1 81 1 1 6 ALA C C 10.847 -0.931 4.632 1.00 . A A . 5 ALA C 1 1
1 82 1 1 6 ALA CA C 9.922 -1.293 5.791 1.00 . A A . 5 ALA CA 1 1
1 83 1 1 6 ALA CB C 9.459 -0.011 6.492 1.00 . A A . 5 ALA CB 1 1
1 84 1 1 6 ALA H H 10.826 -1.810 7.631 1.00 . A A . 5 ALA H 1 1
1 85 1 1 6 ALA HA H 9.058 -1.808 5.405 1.00 . A A . 5 ALA HA 1 1
1 86 1 1 6 ALA HB1 H 8.757 0.512 5.860 1.00 . A A . 5 ALA HB1 1 1
1 87 1 1 6 ALA HB2 H 10.314 0.626 6.684 1.00 . A A . 5 ALA HB2 1 1
1 88 1 1 6 ALA HB3 H 8.984 -0.265 7.427 1.00 . A A . 5 ALA HB3 1 1
1 89 1 1 6 ALA N N 10.609 -2.160 6.745 1.00 . A A . 5 ALA N 1 1
1 90 1 1 6 ALA O O 10.402 -0.422 3.603 1.00 . A A . 5 ALA O 1 1
1 91 1 1 7 LEU C C 13.297 -2.101 2.858 1.00 . A A . 6 LEU C 1 1
1 92 1 1 7 LEU CA C 13.140 -0.907 3.785 1.00 . A A . 6 LEU CA 1 1
1 93 1 1 7 LEU CB C 14.479 -0.623 4.459 1.00 . A A . 6 LEU CB 1 1
1 94 1 1 7 LEU CD1 C 15.553 0.806 6.218 1.00 . A A . 6 LEU CD1 1 1
1 95 1 1 7 LEU CD2 C 14.792 1.864 4.100 1.00 . A A . 6 LEU CD2 1 1
1 96 1 1 7 LEU CG C 14.481 0.764 5.128 1.00 . A A . 6 LEU CG 1 1
1 97 1 1 7 LEU H H 12.434 -1.604 5.644 1.00 . A A . 6 LEU H 1 1
1 98 1 1 7 LEU HA H 12.843 -0.055 3.222 1.00 . A A . 6 LEU HA 1 1
1 99 1 1 7 LEU HB2 H 14.635 -1.380 5.202 1.00 . A A . 6 LEU HB2 1 1
1 100 1 1 7 LEU HB3 H 15.269 -0.672 3.736 1.00 . A A . 6 LEU HB3 1 1
1 101 1 1 7 LEU HD11 H 15.349 0.037 6.943 1.00 . A A . 6 LEU HD11 1 1
1 102 1 1 7 LEU HD12 H 15.542 1.771 6.699 1.00 . A A . 6 LEU HD12 1 1
1 103 1 1 7 LEU HD13 H 16.521 0.633 5.773 1.00 . A A . 6 LEU HD13 1 1
1 104 1 1 7 LEU HD21 H 14.944 2.801 4.616 1.00 . A A . 6 LEU HD21 1 1
1 105 1 1 7 LEU HD22 H 13.968 1.968 3.413 1.00 . A A . 6 LEU HD22 1 1
1 106 1 1 7 LEU HD23 H 15.688 1.609 3.553 1.00 . A A . 6 LEU HD23 1 1
1 107 1 1 7 LEU HG H 13.519 0.941 5.571 1.00 . A A . 6 LEU HG 1 1
1 108 1 1 7 LEU N N 12.139 -1.198 4.808 1.00 . A A . 6 LEU N 1 1
1 109 1 1 7 LEU O O 13.735 -1.965 1.718 1.00 . A A . 6 LEU O 1 1
1 110 1 1 8 ALA C C 11.911 -4.533 1.552 1.00 . A A . 7 ALA C 1 1
1 111 1 1 8 ALA CA C 13.022 -4.491 2.593 1.00 . A A . 7 ALA CA 1 1
1 112 1 1 8 ALA CB C 12.908 -5.699 3.522 1.00 . A A . 7 ALA CB 1 1
1 113 1 1 8 ALA H H 12.584 -3.296 4.279 1.00 . A A . 7 ALA H 1 1
1 114 1 1 8 ALA HA H 13.977 -4.522 2.096 1.00 . A A . 7 ALA HA 1 1
1 115 1 1 8 ALA HB1 H 12.011 -5.610 4.116 1.00 . A A . 7 ALA HB1 1 1
1 116 1 1 8 ALA HB2 H 13.769 -5.734 4.174 1.00 . A A . 7 ALA HB2 1 1
1 117 1 1 8 ALA HB3 H 12.863 -6.604 2.935 1.00 . A A . 7 ALA HB3 1 1
1 118 1 1 8 ALA N N 12.930 -3.265 3.365 1.00 . A A . 7 ALA N 1 1
1 119 1 1 8 ALA O O 11.984 -5.280 0.575 1.00 . A A . 7 ALA O 1 1
1 120 1 1 9 LEU C C 10.140 -2.980 -0.442 1.00 . A A . 8 LEU C 1 1
1 121 1 1 9 LEU CA C 9.751 -3.662 0.864 1.00 . A A . 8 LEU CA 1 1
1 122 1 1 9 LEU CB C 8.601 -2.887 1.504 1.00 . A A . 8 LEU CB 1 1
1 123 1 1 9 LEU CD1 C 7.202 -2.589 3.551 1.00 . A A . 8 LEU CD1 1 1
1 124 1 1 9 LEU CD2 C 7.935 -4.891 2.870 1.00 . A A . 8 LEU CD2 1 1
1 125 1 1 9 LEU CG C 8.336 -3.405 2.922 1.00 . A A . 8 LEU CG 1 1
1 126 1 1 9 LEU H H 10.884 -3.156 2.573 1.00 . A A . 8 LEU H 1 1
1 127 1 1 9 LEU HA H 9.415 -4.662 0.652 1.00 . A A . 8 LEU HA 1 1
1 128 1 1 9 LEU HB2 H 8.862 -1.838 1.546 1.00 . A A . 8 LEU HB2 1 1
1 129 1 1 9 LEU HB3 H 7.710 -3.012 0.907 1.00 . A A . 8 LEU HB3 1 1
1 130 1 1 9 LEU HD11 H 6.318 -2.671 2.937 1.00 . A A . 8 LEU HD11 1 1
1 131 1 1 9 LEU HD12 H 7.499 -1.554 3.620 1.00 . A A . 8 LEU HD12 1 1
1 132 1 1 9 LEU HD13 H 6.990 -2.970 4.540 1.00 . A A . 8 LEU HD13 1 1
1 133 1 1 9 LEU HD21 H 7.437 -5.166 3.789 1.00 . A A . 8 LEU HD21 1 1
1 134 1 1 9 LEU HD22 H 8.819 -5.497 2.752 1.00 . A A . 8 LEU HD22 1 1
1 135 1 1 9 LEU HD23 H 7.269 -5.060 2.035 1.00 . A A . 8 LEU HD23 1 1
1 136 1 1 9 LEU HG H 9.232 -3.287 3.516 1.00 . A A . 8 LEU HG 1 1
1 137 1 1 9 LEU N N 10.882 -3.724 1.776 1.00 . A A . 8 LEU N 1 1
1 138 1 1 9 LEU O O 9.553 -3.252 -1.488 1.00 . A A . 8 LEU O 1 1
1 139 1 1 10 ALA C C 12.828 -0.586 -1.327 1.00 . A A . 9 ALA C 1 1
1 140 1 1 10 ALA CA C 11.559 -1.392 -1.583 1.00 . A A . 9 ALA CA 1 1
1 141 1 1 10 ALA CB C 10.448 -0.460 -2.060 1.00 . A A . 9 ALA CB 1 1
1 142 1 1 10 ALA H H 11.569 -1.903 0.477 1.00 . A A . 9 ALA H 1 1
1 143 1 1 10 ALA HA H 11.753 -2.116 -2.356 1.00 . A A . 9 ALA HA 1 1
1 144 1 1 10 ALA HB1 H 9.628 -1.046 -2.446 1.00 . A A . 9 ALA HB1 1 1
1 145 1 1 10 ALA HB2 H 10.827 0.187 -2.839 1.00 . A A . 9 ALA HB2 1 1
1 146 1 1 10 ALA HB3 H 10.103 0.140 -1.232 1.00 . A A . 9 ALA HB3 1 1
1 147 1 1 10 ALA N N 11.129 -2.092 -0.381 1.00 . A A . 9 ALA N 1 1
1 148 1 1 10 ALA O O 12.808 0.644 -1.359 1.00 . A A . 9 ALA O 1 1
1 149 1 1 11 PRO C C 15.509 0.516 -1.854 1.00 . A A . 10 PRO C 1 1
1 150 1 1 11 PRO CA C 15.229 -0.576 -0.816 1.00 . A A . 10 PRO CA 1 1
1 151 1 1 11 PRO CB C 16.246 -1.726 -0.903 1.00 . A A . 10 PRO CB 1 1
1 152 1 1 11 PRO CD C 14.045 -2.719 -1.021 1.00 . A A . 10 PRO CD 1 1
1 153 1 1 11 PRO CG C 15.475 -2.948 -0.513 1.00 . A A . 10 PRO CG 1 1
1 154 1 1 11 PRO HA H 15.246 -0.165 0.178 1.00 . A A . 10 PRO HA 1 1
1 155 1 1 11 PRO HB2 H 16.615 -1.819 -1.920 1.00 . A A . 10 PRO HB2 1 1
1 156 1 1 11 PRO HB3 H 17.063 -1.572 -0.216 1.00 . A A . 10 PRO HB3 1 1
1 157 1 1 11 PRO HD2 H 13.925 -3.154 -2.007 1.00 . A A . 10 PRO HD2 1 1
1 158 1 1 11 PRO HD3 H 13.317 -3.120 -0.335 1.00 . A A . 10 PRO HD3 1 1
1 159 1 1 11 PRO HG2 H 15.913 -3.830 -0.975 1.00 . A A . 10 PRO HG2 1 1
1 160 1 1 11 PRO HG3 H 15.459 -3.060 0.560 1.00 . A A . 10 PRO HG3 1 1
1 161 1 1 11 PRO N N 13.924 -1.252 -1.079 1.00 . A A . 10 PRO N 1 1
1 162 1 1 11 PRO O O 14.760 0.672 -2.818 1.00 . A A . 10 PRO O 1 1
1 163 1 1 12 ALA C C 17.200 1.757 -3.973 1.00 . A A . 11 ALA C 1 1
1 164 1 1 12 ALA CA C 16.940 2.332 -2.586 1.00 . A A . 11 ALA CA 1 1
1 165 1 1 12 ALA CB C 18.188 3.073 -2.106 1.00 . A A . 11 ALA CB 1 1
1 166 1 1 12 ALA H H 17.152 1.103 -0.869 1.00 . A A . 11 ALA H 1 1
1 167 1 1 12 ALA HA H 16.121 3.033 -2.645 1.00 . A A . 11 ALA HA 1 1
1 168 1 1 12 ALA HB1 H 18.955 2.357 -1.854 1.00 . A A . 11 ALA HB1 1 1
1 169 1 1 12 ALA HB2 H 17.945 3.665 -1.236 1.00 . A A . 11 ALA HB2 1 1
1 170 1 1 12 ALA HB3 H 18.545 3.719 -2.896 1.00 . A A . 11 ALA HB3 1 1
1 171 1 1 12 ALA N N 16.587 1.267 -1.652 1.00 . A A . 11 ALA N 1 1
1 172 1 1 12 ALA O O 17.385 2.496 -4.936 1.00 . A A . 11 ALA O 1 1
1 173 1 1 13 LEU C C 16.400 0.219 -6.364 1.00 . A A . 12 LEU C 1 1
1 174 1 1 13 LEU CA C 17.463 -0.208 -5.354 1.00 . A A . 12 LEU CA 1 1
1 175 1 1 13 LEU CB C 17.440 -1.739 -5.197 1.00 . A A . 12 LEU CB 1 1
1 176 1 1 13 LEU CD1 C 18.497 -3.603 -3.872 1.00 . A A . 12 LEU CD1 1 1
1 177 1 1 13 LEU CD2 C 19.870 -2.384 -5.554 1.00 . A A . 12 LEU CD2 1 1
1 178 1 1 13 LEU CG C 18.739 -2.236 -4.520 1.00 . A A . 12 LEU CG 1 1
1 179 1 1 13 LEU H H 17.071 -0.102 -3.263 1.00 . A A . 12 LEU H 1 1
1 180 1 1 13 LEU HA H 18.430 0.094 -5.716 1.00 . A A . 12 LEU HA 1 1
1 181 1 1 13 LEU HB2 H 16.586 -2.009 -4.589 1.00 . A A . 12 LEU HB2 1 1
1 182 1 1 13 LEU HB3 H 17.338 -2.200 -6.167 1.00 . A A . 12 LEU HB3 1 1
1 183 1 1 13 LEU HD11 H 19.436 -4.006 -3.519 1.00 . A A . 12 LEU HD11 1 1
1 184 1 1 13 LEU HD12 H 18.069 -4.275 -4.601 1.00 . A A . 12 LEU HD12 1 1
1 185 1 1 13 LEU HD13 H 17.817 -3.493 -3.041 1.00 . A A . 12 LEU HD13 1 1
1 186 1 1 13 LEU HD21 H 20.198 -1.410 -5.881 1.00 . A A . 12 LEU HD21 1 1
1 187 1 1 13 LEU HD22 H 19.522 -2.951 -6.404 1.00 . A A . 12 LEU HD22 1 1
1 188 1 1 13 LEU HD23 H 20.701 -2.904 -5.099 1.00 . A A . 12 LEU HD23 1 1
1 189 1 1 13 LEU HG H 19.037 -1.530 -3.754 1.00 . A A . 12 LEU HG 1 1
1 190 1 1 13 LEU N N 17.217 0.434 -4.069 1.00 . A A . 12 LEU N 1 1
1 191 1 1 13 LEU O O 16.719 0.799 -7.402 1.00 . A A . 12 LEU O 1 1
1 192 1 1 14 ALA C C 14.135 1.779 -7.333 1.00 . A A . 13 ALA C 1 1
1 193 1 1 14 ALA CA C 14.052 0.304 -6.965 1.00 . A A . 13 ALA CA 1 1
1 194 1 1 14 ALA CB C 12.703 0.003 -6.312 1.00 . A A . 13 ALA CB 1 1
1 195 1 1 14 ALA H H 14.932 -0.527 -5.223 1.00 . A A . 13 ALA H 1 1
1 196 1 1 14 ALA HA H 14.140 -0.279 -7.867 1.00 . A A . 13 ALA HA 1 1
1 197 1 1 14 ALA HB1 H 12.585 -1.065 -6.208 1.00 . A A . 13 ALA HB1 1 1
1 198 1 1 14 ALA HB2 H 11.908 0.396 -6.930 1.00 . A A . 13 ALA HB2 1 1
1 199 1 1 14 ALA HB3 H 12.665 0.467 -5.338 1.00 . A A . 13 ALA HB3 1 1
1 200 1 1 14 ALA N N 15.139 -0.064 -6.062 1.00 . A A . 13 ALA N 1 1
1 201 1 1 14 ALA O O 13.686 2.190 -8.403 1.00 . A A . 13 ALA O 1 1
1 202 1 1 15 LEU C C 16.026 4.239 -7.628 1.00 . A A . 14 LEU C 1 1
1 203 1 1 15 LEU CA C 14.859 4.002 -6.677 1.00 . A A . 14 LEU CA 1 1
1 204 1 1 15 LEU CB C 15.060 4.721 -5.322 1.00 . A A . 14 LEU CB 1 1
1 205 1 1 15 LEU CD1 C 14.777 6.952 -6.430 1.00 . A A . 14 LEU CD1 1 1
1 206 1 1 15 LEU CD2 C 15.710 6.819 -4.130 1.00 . A A . 14 LEU CD2 1 1
1 207 1 1 15 LEU CG C 15.655 6.128 -5.495 1.00 . A A . 14 LEU CG 1 1
1 208 1 1 15 LEU H H 15.056 2.187 -5.611 1.00 . A A . 14 LEU H 1 1
1 209 1 1 15 LEU HA H 13.959 4.369 -7.144 1.00 . A A . 14 LEU HA 1 1
1 210 1 1 15 LEU HB2 H 14.105 4.807 -4.826 1.00 . A A . 14 LEU HB2 1 1
1 211 1 1 15 LEU HB3 H 15.719 4.131 -4.704 1.00 . A A . 14 LEU HB3 1 1
1 212 1 1 15 LEU HD11 H 13.746 6.875 -6.119 1.00 . A A . 14 LEU HD11 1 1
1 213 1 1 15 LEU HD12 H 14.880 6.577 -7.430 1.00 . A A . 14 LEU HD12 1 1
1 214 1 1 15 LEU HD13 H 15.087 7.985 -6.397 1.00 . A A . 14 LEU HD13 1 1
1 215 1 1 15 LEU HD21 H 14.706 6.952 -3.752 1.00 . A A . 14 LEU HD21 1 1
1 216 1 1 15 LEU HD22 H 16.187 7.783 -4.233 1.00 . A A . 14 LEU HD22 1 1
1 217 1 1 15 LEU HD23 H 16.275 6.209 -3.441 1.00 . A A . 14 LEU HD23 1 1
1 218 1 1 15 LEU HG H 16.654 6.058 -5.901 1.00 . A A . 14 LEU HG 1 1
1 219 1 1 15 LEU N N 14.715 2.573 -6.441 1.00 . A A . 14 LEU N 1 1
1 220 1 1 15 LEU O O 15.867 4.859 -8.681 1.00 . A A . 14 LEU O 1 1
1 221 1 1 16 ALA C C 18.133 3.265 -9.468 1.00 . A A . 15 ALA C 1 1
1 222 1 1 16 ALA CA C 18.367 3.911 -8.106 1.00 . A A . 15 ALA CA 1 1
1 223 1 1 16 ALA CB C 19.595 3.286 -7.444 1.00 . A A . 15 ALA CB 1 1
1 224 1 1 16 ALA H H 17.275 3.249 -6.417 1.00 . A A . 15 ALA H 1 1
1 225 1 1 16 ALA HA H 18.545 4.964 -8.246 1.00 . A A . 15 ALA HA 1 1
1 226 1 1 16 ALA HB1 H 19.365 2.275 -7.139 1.00 . A A . 15 ALA HB1 1 1
1 227 1 1 16 ALA HB2 H 19.873 3.869 -6.578 1.00 . A A . 15 ALA HB2 1 1
1 228 1 1 16 ALA HB3 H 20.415 3.272 -8.147 1.00 . A A . 15 ALA HB3 1 1
1 229 1 1 16 ALA N N 17.197 3.741 -7.262 1.00 . A A . 15 ALA N 1 1
1 230 1 1 16 ALA O O 18.684 3.707 -10.476 1.00 . A A . 15 ALA O 1 1
1 231 1 1 17 LEU C C 16.417 2.501 -11.740 1.00 . A A . 16 LEU C 1 1
1 232 1 1 17 LEU CA C 17.036 1.529 -10.746 1.00 . A A . 16 LEU CA 1 1
1 233 1 1 17 LEU CB C 16.091 0.308 -10.502 1.00 . A A . 16 LEU CB 1 1
1 234 1 1 17 LEU CD1 C 17.781 -1.019 -9.188 1.00 . A A . 16 LEU CD1 1 1
1 235 1 1 17 LEU CD2 C 15.905 -2.186 -10.383 1.00 . A A . 16 LEU CD2 1 1
1 236 1 1 17 LEU CG C 16.889 -1.009 -10.435 1.00 . A A . 16 LEU CG 1 1
1 237 1 1 17 LEU H H 16.908 1.904 -8.655 1.00 . A A . 16 LEU H 1 1
1 238 1 1 17 LEU HA H 17.965 1.185 -11.160 1.00 . A A . 16 LEU HA 1 1
1 239 1 1 17 LEU HB2 H 15.579 0.448 -9.566 1.00 . A A . 16 LEU HB2 1 1
1 240 1 1 17 LEU HB3 H 15.354 0.230 -11.294 1.00 . A A . 16 LEU HB3 1 1
1 241 1 1 17 LEU HD11 H 18.201 -0.034 -9.031 1.00 . A A . 16 LEU HD11 1 1
1 242 1 1 17 LEU HD12 H 18.581 -1.730 -9.326 1.00 . A A . 16 LEU HD12 1 1
1 243 1 1 17 LEU HD13 H 17.199 -1.301 -8.325 1.00 . A A . 16 LEU HD13 1 1
1 244 1 1 17 LEU HD21 H 16.449 -3.102 -10.205 1.00 . A A . 16 LEU HD21 1 1
1 245 1 1 17 LEU HD22 H 15.378 -2.258 -11.324 1.00 . A A . 16 LEU HD22 1 1
1 246 1 1 17 LEU HD23 H 15.195 -2.027 -9.585 1.00 . A A . 16 LEU HD23 1 1
1 247 1 1 17 LEU HG H 17.510 -1.096 -11.317 1.00 . A A . 16 LEU HG 1 1
1 248 1 1 17 LEU N N 17.317 2.215 -9.492 1.00 . A A . 16 LEU N 1 1
1 249 1 1 17 LEU O O 16.910 2.652 -12.858 1.00 . A A . 16 LEU O 1 1
1 250 1 1 18 TRP C C 15.466 5.404 -12.354 1.00 . A A . 17 TRP C 1 1
1 251 1 1 18 TRP CA C 14.667 4.091 -12.233 1.00 . A A . 17 TRP CA 1 1
1 252 1 1 18 TRP CB C 13.208 4.298 -11.728 1.00 . A A . 17 TRP CB 1 1
1 253 1 1 18 TRP CD1 C 11.945 6.033 -13.095 1.00 . A A . 17 TRP CD1 1 1
1 254 1 1 18 TRP CD2 C 12.947 6.856 -11.274 1.00 . A A . 17 TRP CD2 1 1
1 255 1 1 18 TRP CE2 C 12.310 7.946 -11.896 1.00 . A A . 17 TRP CE2 1 1
1 256 1 1 18 TRP CE3 C 13.661 7.073 -10.103 1.00 . A A . 17 TRP CE3 1 1
1 257 1 1 18 TRP CG C 12.707 5.669 -12.039 1.00 . A A . 17 TRP CG 1 1
1 258 1 1 18 TRP CH2 C 13.107 9.433 -10.176 1.00 . A A . 17 TRP CH2 1 1
1 259 1 1 18 TRP CZ2 C 12.383 9.228 -11.360 1.00 . A A . 17 TRP CZ2 1 1
1 260 1 1 18 TRP CZ3 C 13.744 8.344 -9.553 1.00 . A A . 17 TRP CZ3 1 1
1 261 1 1 18 TRP H H 14.954 2.998 -10.439 1.00 . A A . 17 TRP H 1 1
1 262 1 1 18 TRP HA H 14.621 3.646 -13.219 1.00 . A A . 17 TRP HA 1 1
1 263 1 1 18 TRP HB2 H 12.551 3.573 -12.189 1.00 . A A . 17 TRP HB2 1 1
1 264 1 1 18 TRP HB3 H 13.193 4.150 -10.654 1.00 . A A . 17 TRP HB3 1 1
1 265 1 1 18 TRP HD1 H 11.586 5.371 -13.869 1.00 . A A . 17 TRP HD1 1 1
1 266 1 1 18 TRP HE1 H 11.180 7.925 -13.646 1.00 . A A . 17 TRP HE1 1 1
1 267 1 1 18 TRP HE3 H 14.151 6.246 -9.617 1.00 . A A . 17 TRP HE3 1 1
1 268 1 1 18 TRP HH2 H 13.175 10.421 -9.745 1.00 . A A . 17 TRP HH2 1 1
1 269 1 1 18 TRP HZ2 H 11.889 10.051 -11.851 1.00 . A A . 17 TRP HZ2 1 1
1 270 1 1 18 TRP HZ3 H 14.301 8.481 -8.650 1.00 . A A . 17 TRP HZ3 1 1
1 271 1 1 18 TRP N N 15.333 3.151 -11.342 1.00 . A A . 17 TRP N 1 1
1 272 1 1 18 TRP NE1 N 11.707 7.397 -13.010 1.00 . A A . 17 TRP NE1 1 1
1 273 1 1 18 TRP O O 15.679 5.892 -13.465 1.00 . A A . 17 TRP O 1 1
1 274 1 1 19 TRP C C 17.838 7.071 -12.252 1.00 . A A . 18 TRP C 1 1
1 275 1 1 19 TRP CA C 16.668 7.219 -11.294 1.00 . A A . 18 TRP CA 1 1
1 276 1 1 19 TRP CB C 17.211 7.546 -9.911 1.00 . A A . 18 TRP CB 1 1
1 277 1 1 19 TRP CD1 C 17.592 9.966 -10.434 1.00 . A A . 18 TRP CD1 1 1
1 278 1 1 19 TRP CD2 C 19.384 8.996 -9.508 1.00 . A A . 18 TRP CD2 1 1
1 279 1 1 19 TRP CE2 C 19.741 10.342 -9.746 1.00 . A A . 18 TRP CE2 1 1
1 280 1 1 19 TRP CE3 C 20.336 8.147 -8.924 1.00 . A A . 18 TRP CE3 1 1
1 281 1 1 19 TRP CG C 18.019 8.792 -9.955 1.00 . A A . 18 TRP CG 1 1
1 282 1 1 19 TRP CH2 C 21.942 9.971 -8.833 1.00 . A A . 18 TRP CH2 1 1
1 283 1 1 19 TRP CZ2 C 21.004 10.831 -9.414 1.00 . A A . 18 TRP CZ2 1 1
1 284 1 1 19 TRP CZ3 C 21.607 8.631 -8.590 1.00 . A A . 18 TRP CZ3 1 1
1 285 1 1 19 TRP H H 15.728 5.573 -10.357 1.00 . A A . 18 TRP H 1 1
1 286 1 1 19 TRP HA H 16.029 8.020 -11.621 1.00 . A A . 18 TRP HA 1 1
1 287 1 1 19 TRP HB2 H 16.403 7.668 -9.222 1.00 . A A . 18 TRP HB2 1 1
1 288 1 1 19 TRP HB3 H 17.832 6.742 -9.585 1.00 . A A . 18 TRP HB3 1 1
1 289 1 1 19 TRP HD1 H 16.619 10.142 -10.841 1.00 . A A . 18 TRP HD1 1 1
1 290 1 1 19 TRP HE1 H 18.556 11.836 -10.592 1.00 . A A . 18 TRP HE1 1 1
1 291 1 1 19 TRP HE3 H 20.088 7.113 -8.733 1.00 . A A . 18 TRP HE3 1 1
1 292 1 1 19 TRP HH2 H 22.924 10.340 -8.573 1.00 . A A . 18 TRP HH2 1 1
1 293 1 1 19 TRP HZ2 H 21.255 11.863 -9.605 1.00 . A A . 18 TRP HZ2 1 1
1 294 1 1 19 TRP HZ3 H 22.326 7.967 -8.141 1.00 . A A . 18 TRP HZ3 1 1
1 295 1 1 19 TRP N N 15.907 5.974 -11.235 1.00 . A A . 18 TRP N 1 1
1 296 1 1 19 TRP NE1 N 18.610 10.898 -10.314 1.00 . A A . 18 TRP NE1 1 1
1 297 1 1 19 TRP O O 17.999 7.852 -13.189 1.00 . A A . 18 TRP O 1 1
1 298 1 1 20 ALA C C 19.397 5.082 -14.120 1.00 . A A . 19 ALA C 1 1
1 299 1 1 20 ALA CA C 19.813 5.787 -12.831 1.00 . A A . 19 ALA CA 1 1
1 300 1 1 20 ALA CB C 20.816 4.919 -12.069 1.00 . A A . 19 ALA CB 1 1
1 301 1 1 20 ALA H H 18.457 5.475 -11.233 1.00 . A A . 19 ALA H 1 1
1 302 1 1 20 ALA HA H 20.285 6.723 -13.080 1.00 . A A . 19 ALA HA 1 1
1 303 1 1 20 ALA HB1 H 20.907 5.283 -11.055 1.00 . A A . 19 ALA HB1 1 1
1 304 1 1 20 ALA HB2 H 21.779 4.970 -12.556 1.00 . A A . 19 ALA HB2 1 1
1 305 1 1 20 ALA HB3 H 20.473 3.896 -12.055 1.00 . A A . 19 ALA HB3 1 1
1 306 1 1 20 ALA N N 18.648 6.054 -11.999 1.00 . A A . 19 ALA N 1 1
1 307 1 1 20 ALA O O 20.237 4.750 -14.957 1.00 . A A . 19 ALA O 1 1
1 308 1 1 21 ETA CA C 17.575 4.193 -15.462 1.00 . A A . 20 ETA CA 1 1
1 309 1 1 21 ETA CB C 17.703 5.100 -16.684 1.00 . A A . 20 ETA CB 1 1
1 310 1 1 21 ETA HA1 H 16.535 3.953 -15.310 1.00 . A A . 20 ETA HA1 1 1
1 311 1 1 21 ETA HA2 H 18.132 3.281 -15.630 1.00 . A A . 20 ETA HA2 1 1
1 312 1 1 21 ETA HB1 H 17.099 4.698 -17.491 1.00 . A A . 20 ETA HB1 1 1
1 313 1 1 21 ETA HB2 H 18.727 5.145 -17.000 1.00 . A A . 20 ETA HB2 1 1
1 314 1 1 21 ETA HN2 H 17.473 5.146 -13.571 1.00 . A A . 20 ETA HN2 1 1
1 315 1 1 21 ETA HO H 17.358 6.515 -15.390 1.00 . A A . 20 ETA HO 1 1
1 316 1 1 21 ETA N N 18.095 4.858 -14.271 1.00 . A A . 20 ETA N 1 1
1 317 1 1 21 ETA O O 17.267 6.411 -16.340 1.00 . A A . 20 ETA O 1 1
2 318 1 1 1 ACE C C 13.351 -7.561 13.216 1.00 . A A . 0 ACE C 1 1
2 319 1 1 1 ACE CH3 C 14.396 -8.355 12.439 1.00 . A A . 0 ACE CH3 1 1
2 320 1 1 1 ACE H1 H 14.342 -9.396 12.725 1.00 . A A . 0 ACE H1 1 1
2 321 1 1 1 ACE H2 H 15.381 -7.972 12.663 1.00 . A A . 0 ACE H2 1 1
2 322 1 1 1 ACE H3 H 14.204 -8.263 11.381 1.00 . A A . 0 ACE H3 1 1
2 323 1 1 1 ACE O O 12.824 -8.034 14.223 1.00 . A A . 0 ACE O 1 1
2 324 1 1 2 GLY C C 11.424 -4.577 12.380 1.00 . A A . 1 GLY C 1 1
2 325 1 1 2 GLY CA C 12.078 -5.493 13.389 1.00 . A A . 1 GLY CA 1 1
2 326 1 1 2 GLY H H 13.495 -6.015 11.946 1.00 . A A . 1 GLY H 1 1
2 327 1 1 2 GLY HA2 H 11.319 -6.089 13.863 1.00 . A A . 1 GLY HA2 1 1
2 328 1 1 2 GLY HA3 H 12.573 -4.887 14.131 1.00 . A A . 1 GLY HA3 1 1
2 329 1 1 2 GLY N N 13.053 -6.348 12.744 1.00 . A A . 1 GLY N 1 1
2 330 1 1 2 GLY O O 10.984 -4.999 11.311 1.00 . A A . 1 GLY O 1 1
2 331 1 1 3 TRP C C 11.670 -2.035 10.675 1.00 . A A . 2 TRP C 1 1
2 332 1 1 3 TRP CA C 10.778 -2.295 11.905 1.00 . A A . 2 TRP CA 1 1
2 333 1 1 3 TRP CB C 10.532 -1.011 12.771 1.00 . A A . 2 TRP CB 1 1
2 334 1 1 3 TRP CD1 C 12.275 0.772 12.542 1.00 . A A . 2 TRP CD1 1 1
2 335 1 1 3 TRP CD2 C 10.621 1.017 11.046 1.00 . A A . 2 TRP CD2 1 1
2 336 1 1 3 TRP CE2 C 11.531 2.071 10.812 1.00 . A A . 2 TRP CE2 1 1
2 337 1 1 3 TRP CE3 C 9.475 0.933 10.235 1.00 . A A . 2 TRP CE3 1 1
2 338 1 1 3 TRP CG C 11.124 0.215 12.150 1.00 . A A . 2 TRP CG 1 1
2 339 1 1 3 TRP CH2 C 10.172 2.917 9.007 1.00 . A A . 2 TRP CH2 1 1
2 340 1 1 3 TRP CZ2 C 11.315 3.011 9.806 1.00 . A A . 2 TRP CZ2 1 1
2 341 1 1 3 TRP CZ3 C 9.253 1.879 9.221 1.00 . A A . 2 TRP CZ3 1 1
2 342 1 1 3 TRP H H 11.747 -3.084 13.610 1.00 . A A . 2 TRP H 1 1
2 343 1 1 3 TRP HA H 9.827 -2.664 11.552 1.00 . A A . 2 TRP HA 1 1
2 344 1 1 3 TRP HB2 H 9.476 -0.844 12.904 1.00 . A A . 2 TRP HB2 1 1
2 345 1 1 3 TRP HB3 H 10.980 -1.165 13.743 1.00 . A A . 2 TRP HB3 1 1
2 346 1 1 3 TRP HD1 H 12.891 0.404 13.345 1.00 . A A . 2 TRP HD1 1 1
2 347 1 1 3 TRP HE1 H 13.306 2.471 11.828 1.00 . A A . 2 TRP HE1 1 1
2 348 1 1 3 TRP HE3 H 8.763 0.137 10.392 1.00 . A A . 2 TRP HE3 1 1
2 349 1 1 3 TRP HH2 H 9.996 3.641 8.226 1.00 . A A . 2 TRP HH2 1 1
2 350 1 1 3 TRP HZ2 H 12.025 3.805 9.647 1.00 . A A . 2 TRP HZ2 1 1
2 351 1 1 3 TRP HZ3 H 8.371 1.807 8.603 1.00 . A A . 2 TRP HZ3 1 1
2 352 1 1 3 TRP N N 11.371 -3.324 12.745 1.00 . A A . 2 TRP N 1 1
2 353 1 1 3 TRP NE1 N 12.527 1.881 11.750 1.00 . A A . 2 TRP NE1 1 1
2 354 1 1 3 TRP O O 11.177 -1.660 9.611 1.00 . A A . 2 TRP O 1 1
2 355 1 1 4 TRP C C 13.481 -2.736 8.475 1.00 . A A . 3 TRP C 1 1
2 356 1 1 4 TRP CA C 13.917 -2.011 9.744 1.00 . A A . 3 TRP CA 1 1
2 357 1 1 4 TRP CB C 15.334 -2.443 10.193 1.00 . A A . 3 TRP CB 1 1
2 358 1 1 4 TRP CD1 C 15.302 -4.822 10.990 1.00 . A A . 3 TRP CD1 1 1
2 359 1 1 4 TRP CD2 C 15.976 -4.646 8.862 1.00 . A A . 3 TRP CD2 1 1
2 360 1 1 4 TRP CE2 C 16.003 -6.020 9.177 1.00 . A A . 3 TRP CE2 1 1
2 361 1 1 4 TRP CE3 C 16.360 -4.253 7.569 1.00 . A A . 3 TRP CE3 1 1
2 362 1 1 4 TRP CG C 15.526 -3.913 10.031 1.00 . A A . 3 TRP CG 1 1
2 363 1 1 4 TRP CH2 C 16.774 -6.568 6.962 1.00 . A A . 3 TRP CH2 1 1
2 364 1 1 4 TRP CZ2 C 16.396 -6.977 8.244 1.00 . A A . 3 TRP CZ2 1 1
2 365 1 1 4 TRP CZ3 C 16.757 -5.209 6.626 1.00 . A A . 3 TRP CZ3 1 1
2 366 1 1 4 TRP H H 13.327 -2.534 11.701 1.00 . A A . 3 TRP H 1 1
2 367 1 1 4 TRP HA H 13.947 -0.955 9.514 1.00 . A A . 3 TRP HA 1 1
2 368 1 1 4 TRP HB2 H 16.070 -1.935 9.604 1.00 . A A . 3 TRP HB2 1 1
2 369 1 1 4 TRP HB3 H 15.468 -2.180 11.234 1.00 . A A . 3 TRP HB3 1 1
2 370 1 1 4 TRP HD1 H 14.960 -4.597 11.983 1.00 . A A . 3 TRP HD1 1 1
2 371 1 1 4 TRP HE1 H 15.502 -6.918 10.982 1.00 . A A . 3 TRP HE1 1 1
2 372 1 1 4 TRP HE3 H 16.349 -3.211 7.302 1.00 . A A . 3 TRP HE3 1 1
2 373 1 1 4 TRP HH2 H 17.081 -7.297 6.231 1.00 . A A . 3 TRP HH2 1 1
2 374 1 1 4 TRP HZ2 H 16.408 -8.022 8.512 1.00 . A A . 3 TRP HZ2 1 1
2 375 1 1 4 TRP HZ3 H 17.049 -4.895 5.636 1.00 . A A . 3 TRP HZ3 1 1
2 376 1 1 4 TRP N N 12.976 -2.231 10.836 1.00 . A A . 3 TRP N 1 1
2 377 1 1 4 TRP NE1 N 15.583 -6.080 10.488 1.00 . A A . 3 TRP NE1 1 1
2 378 1 1 4 TRP O O 14.101 -2.589 7.443 1.00 . A A . 3 TRP O 1 1
2 379 1 1 5 LEU C C 11.677 -3.163 6.251 1.00 . A A . 4 LEU C 1 1
2 380 1 1 5 LEU CA C 11.999 -4.200 7.327 1.00 . A A . 4 LEU CA 1 1
2 381 1 1 5 LEU CB C 10.784 -5.104 7.609 1.00 . A A . 4 LEU CB 1 1
2 382 1 1 5 LEU CD1 C 10.117 -7.083 9.028 1.00 . A A . 4 LEU CD1 1 1
2 383 1 1 5 LEU CD2 C 11.634 -7.439 7.090 1.00 . A A . 4 LEU CD2 1 1
2 384 1 1 5 LEU CG C 11.248 -6.458 8.211 1.00 . A A . 4 LEU CG 1 1
2 385 1 1 5 LEU H H 11.923 -3.624 9.369 1.00 . A A . 4 LEU H 1 1
2 386 1 1 5 LEU HA H 12.820 -4.800 6.976 1.00 . A A . 4 LEU HA 1 1
2 387 1 1 5 LEU HB2 H 10.131 -4.598 8.310 1.00 . A A . 4 LEU HB2 1 1
2 388 1 1 5 LEU HB3 H 10.243 -5.286 6.691 1.00 . A A . 4 LEU HB3 1 1
2 389 1 1 5 LEU HD11 H 9.830 -6.407 9.818 1.00 . A A . 4 LEU HD11 1 1
2 390 1 1 5 LEU HD12 H 10.456 -8.014 9.455 1.00 . A A . 4 LEU HD12 1 1
2 391 1 1 5 LEU HD13 H 9.269 -7.268 8.385 1.00 . A A . 4 LEU HD13 1 1
2 392 1 1 5 LEU HD21 H 12.482 -7.057 6.543 1.00 . A A . 4 LEU HD21 1 1
2 393 1 1 5 LEU HD22 H 10.800 -7.563 6.418 1.00 . A A . 4 LEU HD22 1 1
2 394 1 1 5 LEU HD23 H 11.889 -8.395 7.525 1.00 . A A . 4 LEU HD23 1 1
2 395 1 1 5 LEU HG H 12.100 -6.293 8.858 1.00 . A A . 4 LEU HG 1 1
2 396 1 1 5 LEU N N 12.420 -3.513 8.532 1.00 . A A . 4 LEU N 1 1
2 397 1 1 5 LEU O O 12.120 -3.284 5.111 1.00 . A A . 4 LEU O 1 1
2 398 1 1 6 ALA C C 11.695 -0.647 4.811 1.00 . A A . 5 ALA C 1 1
2 399 1 1 6 ALA CA C 10.517 -1.101 5.672 1.00 . A A . 5 ALA CA 1 1
2 400 1 1 6 ALA CB C 9.967 0.104 6.438 1.00 . A A . 5 ALA CB 1 1
2 401 1 1 6 ALA H H 10.555 -2.098 7.534 1.00 . A A . 5 ALA H 1 1
2 402 1 1 6 ALA HA H 9.737 -1.476 5.033 1.00 . A A . 5 ALA HA 1 1
2 403 1 1 6 ALA HB1 H 9.549 0.814 5.739 1.00 . A A . 5 ALA HB1 1 1
2 404 1 1 6 ALA HB2 H 10.768 0.576 6.994 1.00 . A A . 5 ALA HB2 1 1
2 405 1 1 6 ALA HB3 H 9.200 -0.222 7.123 1.00 . A A . 5 ALA HB3 1 1
2 406 1 1 6 ALA N N 10.898 -2.149 6.617 1.00 . A A . 5 ALA N 1 1
2 407 1 1 6 ALA O O 11.491 -0.067 3.745 1.00 . A A . 5 ALA O 1 1
2 408 1 1 7 LEU C C 14.335 -1.476 3.334 1.00 . A A . 6 LEU C 1 1
2 409 1 1 7 LEU CA C 14.094 -0.499 4.483 1.00 . A A . 6 LEU CA 1 1
2 410 1 1 7 LEU CB C 15.331 -0.431 5.389 1.00 . A A . 6 LEU CB 1 1
2 411 1 1 7 LEU CD1 C 16.180 0.633 7.504 1.00 . A A . 6 LEU CD1 1 1
2 412 1 1 7 LEU CD2 C 15.877 2.042 5.470 1.00 . A A . 6 LEU CD2 1 1
2 413 1 1 7 LEU CG C 15.315 0.844 6.254 1.00 . A A . 6 LEU CG 1 1
2 414 1 1 7 LEU H H 13.047 -1.367 6.108 1.00 . A A . 6 LEU H 1 1
2 415 1 1 7 LEU HA H 13.915 0.470 4.073 1.00 . A A . 6 LEU HA 1 1
2 416 1 1 7 LEU HB2 H 15.331 -1.289 6.025 1.00 . A A . 6 LEU HB2 1 1
2 417 1 1 7 LEU HB3 H 16.219 -0.441 4.789 1.00 . A A . 6 LEU HB3 1 1
2 418 1 1 7 LEU HD11 H 15.692 -0.071 8.162 1.00 . A A . 6 LEU HD11 1 1
2 419 1 1 7 LEU HD12 H 16.310 1.574 8.015 1.00 . A A . 6 LEU HD12 1 1
2 420 1 1 7 LEU HD13 H 17.144 0.243 7.210 1.00 . A A . 6 LEU HD13 1 1
2 421 1 1 7 LEU HD21 H 15.206 2.303 4.668 1.00 . A A . 6 LEU HD21 1 1
2 422 1 1 7 LEU HD22 H 16.844 1.788 5.062 1.00 . A A . 6 LEU HD22 1 1
2 423 1 1 7 LEU HD23 H 15.983 2.884 6.137 1.00 . A A . 6 LEU HD23 1 1
2 424 1 1 7 LEU HG H 14.305 1.049 6.557 1.00 . A A . 6 LEU HG 1 1
2 425 1 1 7 LEU N N 12.924 -0.904 5.257 1.00 . A A . 6 LEU N 1 1
2 426 1 1 7 LEU O O 14.681 -1.070 2.224 1.00 . A A . 6 LEU O 1 1
2 427 1 1 8 ALA C C 13.113 -3.937 1.713 1.00 . A A . 7 ALA C 1 1
2 428 1 1 8 ALA CA C 14.352 -3.796 2.596 1.00 . A A . 7 ALA CA 1 1
2 429 1 1 8 ALA CB C 14.653 -5.135 3.270 1.00 . A A . 7 ALA CB 1 1
2 430 1 1 8 ALA H H 13.878 -3.027 4.507 1.00 . A A . 7 ALA H 1 1
2 431 1 1 8 ALA HA H 15.193 -3.526 1.980 1.00 . A A . 7 ALA HA 1 1
2 432 1 1 8 ALA HB1 H 14.737 -5.906 2.517 1.00 . A A . 7 ALA HB1 1 1
2 433 1 1 8 ALA HB2 H 13.853 -5.383 3.952 1.00 . A A . 7 ALA HB2 1 1
2 434 1 1 8 ALA HB3 H 15.582 -5.062 3.814 1.00 . A A . 7 ALA HB3 1 1
2 435 1 1 8 ALA N N 14.153 -2.764 3.609 1.00 . A A . 7 ALA N 1 1
2 436 1 1 8 ALA O O 13.135 -4.647 0.707 1.00 . A A . 7 ALA O 1 1
2 437 1 1 9 LEU C C 10.631 -2.077 0.455 1.00 . A A . 8 LEU C 1 1
2 438 1 1 9 LEU CA C 10.773 -3.301 1.351 1.00 . A A . 8 LEU CA 1 1
2 439 1 1 9 LEU CB C 9.596 -3.333 2.319 1.00 . A A . 8 LEU CB 1 1
2 440 1 1 9 LEU CD1 C 8.598 -4.465 4.309 1.00 . A A . 8 LEU CD1 1 1
2 441 1 1 9 LEU CD2 C 9.564 -5.856 2.447 1.00 . A A . 8 LEU CD2 1 1
2 442 1 1 9 LEU CG C 9.706 -4.546 3.254 1.00 . A A . 8 LEU CG 1 1
2 443 1 1 9 LEU H H 12.078 -2.715 2.907 1.00 . A A . 8 LEU H 1 1
2 444 1 1 9 LEU HA H 10.740 -4.184 0.741 1.00 . A A . 8 LEU HA 1 1
2 445 1 1 9 LEU HB2 H 9.606 -2.424 2.902 1.00 . A A . 8 LEU HB2 1 1
2 446 1 1 9 LEU HB3 H 8.674 -3.391 1.761 1.00 . A A . 8 LEU HB3 1 1
2 447 1 1 9 LEU HD11 H 7.642 -4.354 3.819 1.00 . A A . 8 LEU HD11 1 1
2 448 1 1 9 LEU HD12 H 8.775 -3.617 4.954 1.00 . A A . 8 LEU HD12 1 1
2 449 1 1 9 LEU HD13 H 8.597 -5.371 4.899 1.00 . A A . 8 LEU HD13 1 1
2 450 1 1 9 LEU HD21 H 8.836 -5.727 1.659 1.00 . A A . 8 LEU HD21 1 1
2 451 1 1 9 LEU HD22 H 9.244 -6.657 3.100 1.00 . A A . 8 LEU HD22 1 1
2 452 1 1 9 LEU HD23 H 10.519 -6.117 2.016 1.00 . A A . 8 LEU HD23 1 1
2 453 1 1 9 LEU HG H 10.667 -4.525 3.749 1.00 . A A . 8 LEU HG 1 1
2 454 1 1 9 LEU N N 12.031 -3.258 2.101 1.00 . A A . 8 LEU N 1 1
2 455 1 1 9 LEU O O 9.873 -2.094 -0.516 1.00 . A A . 8 LEU O 1 1
2 456 1 1 10 ALA C C 12.692 0.877 -0.060 1.00 . A A . 9 ALA C 1 1
2 457 1 1 10 ALA CA C 11.316 0.223 0.003 1.00 . A A . 9 ALA CA 1 1
2 458 1 1 10 ALA CB C 10.313 1.194 0.632 1.00 . A A . 9 ALA CB 1 1
2 459 1 1 10 ALA H H 11.948 -1.057 1.565 1.00 . A A . 9 ALA H 1 1
2 460 1 1 10 ALA HA H 10.996 0.004 -1.003 1.00 . A A . 9 ALA HA 1 1
2 461 1 1 10 ALA HB1 H 10.300 2.115 0.068 1.00 . A A . 9 ALA HB1 1 1
2 462 1 1 10 ALA HB2 H 10.603 1.401 1.652 1.00 . A A . 9 ALA HB2 1 1
2 463 1 1 10 ALA HB3 H 9.328 0.751 0.620 1.00 . A A . 9 ALA HB3 1 1
2 464 1 1 10 ALA N N 11.363 -1.012 0.784 1.00 . A A . 9 ALA N 1 1
2 465 1 1 10 ALA O O 12.835 2.070 0.211 1.00 . A A . 9 ALA O 1 1
2 466 1 1 11 PRO C C 15.271 1.542 -1.745 1.00 . A A . 10 PRO C 1 1
2 467 1 1 11 PRO CA C 15.101 0.644 -0.515 1.00 . A A . 10 PRO CA 1 1
2 468 1 1 11 PRO CB C 15.934 -0.639 -0.628 1.00 . A A . 10 PRO CB 1 1
2 469 1 1 11 PRO CD C 13.640 -1.312 -0.756 1.00 . A A . 10 PRO CD 1 1
2 470 1 1 11 PRO CG C 15.028 -1.599 -1.320 1.00 . A A . 10 PRO CG 1 1
2 471 1 1 11 PRO HA H 15.381 1.170 0.379 1.00 . A A . 10 PRO HA 1 1
2 472 1 1 11 PRO HB2 H 16.826 -0.463 -1.206 1.00 . A A . 10 PRO HB2 1 1
2 473 1 1 11 PRO HB3 H 16.184 -1.021 0.352 1.00 . A A . 10 PRO HB3 1 1
2 474 1 1 11 PRO HD2 H 12.879 -1.505 -1.502 1.00 . A A . 10 PRO HD2 1 1
2 475 1 1 11 PRO HD3 H 13.470 -1.893 0.133 1.00 . A A . 10 PRO HD3 1 1
2 476 1 1 11 PRO HG2 H 15.052 -1.421 -2.392 1.00 . A A . 10 PRO HG2 1 1
2 477 1 1 11 PRO HG3 H 15.304 -2.619 -1.100 1.00 . A A . 10 PRO HG3 1 1
2 478 1 1 11 PRO N N 13.703 0.124 -0.413 1.00 . A A . 10 PRO N 1 1
2 479 1 1 11 PRO O O 14.547 1.398 -2.732 1.00 . A A . 10 PRO O 1 1
2 480 1 1 12 ALA C C 16.847 2.599 -4.053 1.00 . A A . 11 ALA C 1 1
2 481 1 1 12 ALA CA C 16.470 3.375 -2.796 1.00 . A A . 11 ALA CA 1 1
2 482 1 1 12 ALA CB C 17.595 4.352 -2.451 1.00 . A A . 11 ALA CB 1 1
2 483 1 1 12 ALA H H 16.772 2.537 -0.870 1.00 . A A . 11 ALA H 1 1
2 484 1 1 12 ALA HA H 15.571 3.939 -2.991 1.00 . A A . 11 ALA HA 1 1
2 485 1 1 12 ALA HB1 H 17.893 4.884 -3.344 1.00 . A A . 11 ALA HB1 1 1
2 486 1 1 12 ALA HB2 H 18.440 3.806 -2.059 1.00 . A A . 11 ALA HB2 1 1
2 487 1 1 12 ALA HB3 H 17.246 5.058 -1.711 1.00 . A A . 11 ALA HB3 1 1
2 488 1 1 12 ALA N N 16.225 2.466 -1.680 1.00 . A A . 11 ALA N 1 1
2 489 1 1 12 ALA O O 17.077 3.188 -5.109 1.00 . A A . 11 ALA O 1 1
2 490 1 1 13 LEU C C 16.248 0.670 -6.217 1.00 . A A . 12 LEU C 1 1
2 491 1 1 13 LEU CA C 17.272 0.473 -5.102 1.00 . A A . 12 LEU CA 1 1
2 492 1 1 13 LEU CB C 17.343 -1.010 -4.721 1.00 . A A . 12 LEU CB 1 1
2 493 1 1 13 LEU CD1 C 18.187 -2.567 -2.935 1.00 . A A . 12 LEU CD1 1 1
2 494 1 1 13 LEU CD2 C 19.829 -1.298 -4.314 1.00 . A A . 12 LEU CD2 1 1
2 495 1 1 13 LEU CG C 18.438 -1.240 -3.658 1.00 . A A . 12 LEU CG 1 1
2 496 1 1 13 LEU H H 16.729 0.853 -3.083 1.00 . A A . 12 LEU H 1 1
2 497 1 1 13 LEU HA H 18.237 0.787 -5.461 1.00 . A A . 12 LEU HA 1 1
2 498 1 1 13 LEU HB2 H 16.382 -1.313 -4.326 1.00 . A A . 12 LEU HB2 1 1
2 499 1 1 13 LEU HB3 H 17.564 -1.595 -5.599 1.00 . A A . 12 LEU HB3 1 1
2 500 1 1 13 LEU HD11 H 18.283 -3.383 -3.636 1.00 . A A . 12 LEU HD11 1 1
2 501 1 1 13 LEU HD12 H 17.190 -2.568 -2.518 1.00 . A A . 12 LEU HD12 1 1
2 502 1 1 13 LEU HD13 H 18.909 -2.687 -2.142 1.00 . A A . 12 LEU HD13 1 1
2 503 1 1 13 LEU HD21 H 19.812 -1.973 -5.156 1.00 . A A . 12 LEU HD21 1 1
2 504 1 1 13 LEU HD22 H 20.547 -1.653 -3.591 1.00 . A A . 12 LEU HD22 1 1
2 505 1 1 13 LEU HD23 H 20.117 -0.313 -4.644 1.00 . A A . 12 LEU HD23 1 1
2 506 1 1 13 LEU HG H 18.409 -0.434 -2.937 1.00 . A A . 12 LEU HG 1 1
2 507 1 1 13 LEU N N 16.915 1.279 -3.945 1.00 . A A . 12 LEU N 1 1
2 508 1 1 13 LEU O O 16.594 1.119 -7.309 1.00 . A A . 12 LEU O 1 1
2 509 1 1 14 ALA C C 13.942 1.895 -7.530 1.00 . A A . 13 ALA C 1 1
2 510 1 1 14 ALA CA C 13.941 0.484 -6.953 1.00 . A A . 13 ALA CA 1 1
2 511 1 1 14 ALA CB C 12.574 0.177 -6.342 1.00 . A A . 13 ALA CB 1 1
2 512 1 1 14 ALA H H 14.756 -0.025 -5.065 1.00 . A A . 13 ALA H 1 1
2 513 1 1 14 ALA HA H 14.126 -0.215 -7.750 1.00 . A A . 13 ALA HA 1 1
2 514 1 1 14 ALA HB1 H 11.821 0.201 -7.116 1.00 . A A . 13 ALA HB1 1 1
2 515 1 1 14 ALA HB2 H 12.341 0.916 -5.590 1.00 . A A . 13 ALA HB2 1 1
2 516 1 1 14 ALA HB3 H 12.594 -0.804 -5.890 1.00 . A A . 13 ALA HB3 1 1
2 517 1 1 14 ALA N N 14.990 0.334 -5.946 1.00 . A A . 13 ALA N 1 1
2 518 1 1 14 ALA O O 13.477 2.120 -8.647 1.00 . A A . 13 ALA O 1 1
2 519 1 1 15 LEU C C 15.730 4.405 -8.119 1.00 . A A . 14 LEU C 1 1
2 520 1 1 15 LEU CA C 14.533 4.228 -7.196 1.00 . A A . 14 LEU CA 1 1
2 521 1 1 15 LEU CB C 14.628 5.146 -5.951 1.00 . A A . 14 LEU CB 1 1
2 522 1 1 15 LEU CD1 C 14.295 7.199 -7.361 1.00 . A A . 14 LEU CD1 1 1
2 523 1 1 15 LEU CD2 C 15.145 7.411 -5.032 1.00 . A A . 14 LEU CD2 1 1
2 524 1 1 15 LEU CG C 15.170 6.545 -6.295 1.00 . A A . 14 LEU CG 1 1
2 525 1 1 15 LEU H H 14.825 2.597 -5.885 1.00 . A A . 14 LEU H 1 1
2 526 1 1 15 LEU HA H 13.638 4.465 -7.746 1.00 . A A . 14 LEU HA 1 1
2 527 1 1 15 LEU HB2 H 13.646 5.252 -5.520 1.00 . A A . 14 LEU HB2 1 1
2 528 1 1 15 LEU HB3 H 15.277 4.685 -5.224 1.00 . A A . 14 LEU HB3 1 1
2 529 1 1 15 LEU HD11 H 13.270 7.220 -7.023 1.00 . A A . 14 LEU HD11 1 1
2 530 1 1 15 LEU HD12 H 14.361 6.634 -8.274 1.00 . A A . 14 LEU HD12 1 1
2 531 1 1 15 LEU HD13 H 14.636 8.209 -7.538 1.00 . A A . 14 LEU HD13 1 1
2 532 1 1 15 LEU HD21 H 15.729 8.304 -5.197 1.00 . A A . 14 LEU HD21 1 1
2 533 1 1 15 LEU HD22 H 15.565 6.854 -4.207 1.00 . A A . 14 LEU HD22 1 1
2 534 1 1 15 LEU HD23 H 14.126 7.683 -4.800 1.00 . A A . 14 LEU HD23 1 1
2 535 1 1 15 LEU HG H 16.186 6.472 -6.655 1.00 . A A . 14 LEU HG 1 1
2 536 1 1 15 LEU N N 14.469 2.839 -6.761 1.00 . A A . 14 LEU N 1 1
2 537 1 1 15 LEU O O 15.596 4.889 -9.243 1.00 . A A . 14 LEU O 1 1
2 538 1 1 16 ALA C C 17.971 3.280 -9.706 1.00 . A A . 15 ALA C 1 1
2 539 1 1 16 ALA CA C 18.099 4.126 -8.445 1.00 . A A . 15 ALA CA 1 1
2 540 1 1 16 ALA CB C 19.317 3.678 -7.637 1.00 . A A . 15 ALA CB 1 1
2 541 1 1 16 ALA H H 16.950 3.622 -6.742 1.00 . A A . 15 ALA H 1 1
2 542 1 1 16 ALA HA H 18.226 5.157 -8.728 1.00 . A A . 15 ALA HA 1 1
2 543 1 1 16 ALA HB1 H 19.270 4.108 -6.648 1.00 . A A . 15 ALA HB1 1 1
2 544 1 1 16 ALA HB2 H 20.219 4.011 -8.131 1.00 . A A . 15 ALA HB2 1 1
2 545 1 1 16 ALA HB3 H 19.323 2.601 -7.563 1.00 . A A . 15 ALA HB3 1 1
2 546 1 1 16 ALA N N 16.897 4.005 -7.642 1.00 . A A . 15 ALA N 1 1
2 547 1 1 16 ALA O O 18.549 3.604 -10.743 1.00 . A A . 15 ALA O 1 1
2 548 1 1 17 LEU C C 16.406 2.093 -11.915 1.00 . A A . 16 LEU C 1 1
2 549 1 1 17 LEU CA C 17.025 1.315 -10.761 1.00 . A A . 16 LEU CA 1 1
2 550 1 1 17 LEU CB C 16.129 0.096 -10.376 1.00 . A A . 16 LEU CB 1 1
2 551 1 1 17 LEU CD1 C 17.795 -0.903 -8.771 1.00 . A A . 16 LEU CD1 1 1
2 552 1 1 17 LEU CD2 C 16.051 -2.354 -9.852 1.00 . A A . 16 LEU CD2 1 1
2 553 1 1 17 LEU CG C 16.980 -1.146 -10.048 1.00 . A A . 16 LEU CG 1 1
2 554 1 1 17 LEU H H 16.775 1.981 -8.758 1.00 . A A . 16 LEU H 1 1
2 555 1 1 17 LEU HA H 17.988 0.963 -11.079 1.00 . A A . 16 LEU HA 1 1
2 556 1 1 17 LEU HB2 H 15.549 0.354 -9.509 1.00 . A A . 16 LEU HB2 1 1
2 557 1 1 17 LEU HB3 H 15.450 -0.152 -11.188 1.00 . A A . 16 LEU HB3 1 1
2 558 1 1 17 LEU HD11 H 18.156 0.117 -8.756 1.00 . A A . 16 LEU HD11 1 1
2 559 1 1 17 LEU HD12 H 18.637 -1.577 -8.751 1.00 . A A . 16 LEU HD12 1 1
2 560 1 1 17 LEU HD13 H 17.177 -1.078 -7.904 1.00 . A A . 16 LEU HD13 1 1
2 561 1 1 17 LEU HD21 H 15.622 -2.637 -10.802 1.00 . A A . 16 LEU HD21 1 1
2 562 1 1 17 LEU HD22 H 15.261 -2.092 -9.165 1.00 . A A . 16 LEU HD22 1 1
2 563 1 1 17 LEU HD23 H 16.617 -3.182 -9.451 1.00 . A A . 16 LEU HD23 1 1
2 564 1 1 17 LEU HG H 17.657 -1.342 -10.870 1.00 . A A . 16 LEU HG 1 1
2 565 1 1 17 LEU N N 17.210 2.191 -9.612 1.00 . A A . 16 LEU N 1 1
2 566 1 1 17 LEU O O 16.942 2.103 -13.022 1.00 . A A . 16 LEU O 1 1
2 567 1 1 18 TRP C C 15.330 4.826 -12.985 1.00 . A A . 17 TRP C 1 1
2 568 1 1 18 TRP CA C 14.600 3.495 -12.709 1.00 . A A . 17 TRP CA 1 1
2 569 1 1 18 TRP CB C 13.109 3.676 -12.304 1.00 . A A . 17 TRP CB 1 1
2 570 1 1 18 TRP CD1 C 11.823 5.118 -13.957 1.00 . A A . 17 TRP CD1 1 1
2 571 1 1 18 TRP CD2 C 12.683 6.252 -12.232 1.00 . A A . 17 TRP CD2 1 1
2 572 1 1 18 TRP CE2 C 12.019 7.201 -13.031 1.00 . A A . 17 TRP CE2 1 1
2 573 1 1 18 TRP CE3 C 13.322 6.676 -11.072 1.00 . A A . 17 TRP CE3 1 1
2 574 1 1 18 TRP CG C 12.549 4.956 -12.829 1.00 . A A . 17 TRP CG 1 1
2 575 1 1 18 TRP CH2 C 12.642 8.961 -11.507 1.00 . A A . 17 TRP CH2 1 1
2 576 1 1 18 TRP CZ2 C 11.992 8.548 -12.679 1.00 . A A . 17 TRP CZ2 1 1
2 577 1 1 18 TRP CZ3 C 13.306 8.013 -10.708 1.00 . A A . 17 TRP CZ3 1 1
2 578 1 1 18 TRP H H 14.862 2.697 -10.763 1.00 . A A . 17 TRP H 1 1
2 579 1 1 18 TRP HA H 14.634 2.913 -13.622 1.00 . A A . 17 TRP HA 1 1
2 580 1 1 18 TRP HB2 H 12.519 2.855 -12.687 1.00 . A A . 17 TRP HB2 1 1
2 581 1 1 18 TRP HB3 H 13.046 3.678 -11.222 1.00 . A A . 17 TRP HB3 1 1
2 582 1 1 18 TRP HD1 H 11.542 4.334 -14.644 1.00 . A A . 17 TRP HD1 1 1
2 583 1 1 18 TRP HE1 H 10.983 6.862 -14.805 1.00 . A A . 17 TRP HE1 1 1
2 584 1 1 18 TRP HE3 H 13.834 5.959 -10.451 1.00 . A A . 17 TRP HE3 1 1
2 585 1 1 18 TRP HH2 H 12.632 10.002 -11.220 1.00 . A A . 17 TRP HH2 1 1
2 586 1 1 18 TRP HZ2 H 11.477 9.262 -13.304 1.00 . A A . 17 TRP HZ2 1 1
2 587 1 1 18 TRP HZ3 H 13.809 8.309 -9.811 1.00 . A A . 17 TRP HZ3 1 1
2 588 1 1 18 TRP N N 15.273 2.734 -11.662 1.00 . A A . 17 TRP N 1 1
2 589 1 1 18 TRP NE1 N 11.504 6.464 -14.079 1.00 . A A . 17 TRP NE1 1 1
2 590 1 1 18 TRP O O 15.573 5.165 -14.142 1.00 . A A . 17 TRP O 1 1
2 591 1 1 19 TRP C C 17.587 6.645 -13.019 1.00 . A A . 18 TRP C 1 1
2 592 1 1 19 TRP CA C 16.367 6.845 -12.136 1.00 . A A . 18 TRP CA 1 1
2 593 1 1 19 TRP CB C 16.823 7.384 -10.789 1.00 . A A . 18 TRP CB 1 1
2 594 1 1 19 TRP CD1 C 17.057 9.742 -11.593 1.00 . A A . 18 TRP CD1 1 1
2 595 1 1 19 TRP CD2 C 18.888 9.008 -10.539 1.00 . A A . 18 TRP CD2 1 1
2 596 1 1 19 TRP CE2 C 19.164 10.336 -10.932 1.00 . A A . 18 TRP CE2 1 1
2 597 1 1 19 TRP CE3 C 19.879 8.297 -9.848 1.00 . A A . 18 TRP CE3 1 1
2 598 1 1 19 TRP CG C 17.549 8.665 -10.973 1.00 . A A . 18 TRP CG 1 1
2 599 1 1 19 TRP CH2 C 21.367 10.216 -9.956 1.00 . A A . 18 TRP CH2 1 1
2 600 1 1 19 TRP CZ2 C 20.389 10.941 -10.647 1.00 . A A . 18 TRP CZ2 1 1
2 601 1 1 19 TRP CZ3 C 21.108 8.895 -9.558 1.00 . A A . 18 TRP CZ3 1 1
2 602 1 1 19 TRP H H 15.469 5.281 -11.024 1.00 . A A . 18 TRP H 1 1
2 603 1 1 19 TRP HA H 15.698 7.556 -12.591 1.00 . A A . 18 TRP HA 1 1
2 604 1 1 19 TRP HB2 H 15.980 7.539 -10.151 1.00 . A A . 18 TRP HB2 1 1
2 605 1 1 19 TRP HB3 H 17.480 6.676 -10.337 1.00 . A A . 18 TRP HB3 1 1
2 606 1 1 19 TRP HD1 H 16.081 9.802 -12.029 1.00 . A A . 18 TRP HD1 1 1
2 607 1 1 19 TRP HE1 H 17.902 11.640 -11.965 1.00 . A A . 18 TRP HE1 1 1
2 608 1 1 19 TRP HE3 H 19.691 7.280 -9.537 1.00 . A A . 18 TRP HE3 1 1
2 609 1 1 19 TRP HH2 H 22.319 10.673 -9.729 1.00 . A A . 18 TRP HH2 1 1
2 610 1 1 19 TRP HZ2 H 20.580 11.958 -10.956 1.00 . A A . 18 TRP HZ2 1 1
2 611 1 1 19 TRP HZ3 H 21.857 8.334 -9.026 1.00 . A A . 18 TRP HZ3 1 1
2 612 1 1 19 TRP N N 15.675 5.574 -11.939 1.00 . A A . 18 TRP N 1 1
2 613 1 1 19 TRP NE1 N 18.012 10.746 -11.576 1.00 . A A . 18 TRP NE1 1 1
2 614 1 1 19 TRP O O 17.761 7.321 -14.032 1.00 . A A . 18 TRP O 1 1
2 615 1 1 20 ALA C C 19.326 4.602 -14.615 1.00 . A A . 19 ALA C 1 1
2 616 1 1 20 ALA CA C 19.643 5.404 -13.356 1.00 . A A . 19 ALA CA 1 1
2 617 1 1 20 ALA CB C 20.612 4.618 -12.472 1.00 . A A . 19 ALA CB 1 1
2 618 1 1 20 ALA H H 18.223 5.212 -11.794 1.00 . A A . 19 ALA H 1 1
2 619 1 1 20 ALA HA H 20.111 6.327 -13.641 1.00 . A A . 19 ALA HA 1 1
2 620 1 1 20 ALA HB1 H 20.260 3.603 -12.365 1.00 . A A . 19 ALA HB1 1 1
2 621 1 1 20 ALA HB2 H 20.670 5.084 -11.497 1.00 . A A . 19 ALA HB2 1 1
2 622 1 1 20 ALA HB3 H 21.592 4.614 -12.926 1.00 . A A . 19 ALA HB3 1 1
2 623 1 1 20 ALA N N 18.427 5.708 -12.614 1.00 . A A . 19 ALA N 1 1
2 624 1 1 20 ALA O O 19.849 4.887 -15.692 1.00 . A A . 19 ALA O 1 1
2 625 1 1 21 ETA CA C 18.092 2.760 -15.607 1.00 . A A . 20 ETA CA 1 1
2 626 1 1 21 ETA CB C 17.057 3.470 -16.479 1.00 . A A . 20 ETA CB 1 1
2 627 1 1 21 ETA HA1 H 17.668 1.836 -15.245 1.00 . A A . 20 ETA HA1 1 1
2 628 1 1 21 ETA HA2 H 18.972 2.543 -16.197 1.00 . A A . 20 ETA HA2 1 1
2 629 1 1 21 ETA HB1 H 16.169 3.671 -15.890 1.00 . A A . 20 ETA HB1 1 1
2 630 1 1 21 ETA HB2 H 16.793 2.845 -17.312 1.00 . A A . 20 ETA HB2 1 1
2 631 1 1 21 ETA HN2 H 18.086 3.418 -13.590 1.00 . A A . 20 ETA HN2 1 1
2 632 1 1 21 ETA HO H 18.178 5.050 -16.287 1.00 . A A . 20 ETA HO 1 1
2 633 1 1 21 ETA N N 18.470 3.598 -14.472 1.00 . A A . 20 ETA N 1 1
2 634 1 1 21 ETA O O 17.616 4.682 -16.972 1.00 . A A . 20 ETA O 1 1
3 635 1 1 1 ACE C C 13.726 -6.743 13.690 1.00 . A A . 0 ACE C 1 1
3 636 1 1 1 ACE CH3 C 14.738 -7.644 12.991 1.00 . A A . 0 ACE CH3 1 1
3 637 1 1 1 ACE H1 H 14.471 -7.749 11.951 1.00 . A A . 0 ACE H1 1 1
3 638 1 1 1 ACE H2 H 14.738 -8.617 13.463 1.00 . A A . 0 ACE H2 1 1
3 639 1 1 1 ACE H3 H 15.723 -7.208 13.071 1.00 . A A . 0 ACE H3 1 1
3 640 1 1 1 ACE O O 13.115 -7.139 14.684 1.00 . A A . 0 ACE O 1 1
3 641 1 1 2 GLY C C 11.910 -3.794 12.644 1.00 . A A . 1 GLY C 1 1
3 642 1 1 2 GLY CA C 12.618 -4.567 13.735 1.00 . A A . 1 GLY CA 1 1
3 643 1 1 2 GLY H H 14.055 -5.256 12.383 1.00 . A A . 1 GLY H 1 1
3 644 1 1 2 GLY HA2 H 11.882 -5.071 14.336 1.00 . A A . 1 GLY HA2 1 1
3 645 1 1 2 GLY HA3 H 13.161 -3.868 14.351 1.00 . A A . 1 GLY HA3 1 1
3 646 1 1 2 GLY N N 13.550 -5.524 13.167 1.00 . A A . 1 GLY N 1 1
3 647 1 1 2 GLY O O 11.416 -4.356 11.668 1.00 . A A . 1 GLY O 1 1
3 648 1 1 3 TRP C C 11.981 -1.587 10.556 1.00 . A A . 2 TRP C 1 1
3 649 1 1 3 TRP CA C 11.225 -1.601 11.899 1.00 . A A . 2 TRP CA 1 1
3 650 1 1 3 TRP CB C 11.107 -0.182 12.558 1.00 . A A . 2 TRP CB 1 1
3 651 1 1 3 TRP CD1 C 12.861 1.417 11.782 1.00 . A A . 2 TRP CD1 1 1
3 652 1 1 3 TRP CD2 C 10.987 1.570 10.559 1.00 . A A . 2 TRP CD2 1 1
3 653 1 1 3 TRP CE2 C 11.892 2.512 10.022 1.00 . A A . 2 TRP CE2 1 1
3 654 1 1 3 TRP CE3 C 9.716 1.457 9.970 1.00 . A A . 2 TRP CE3 1 1
3 655 1 1 3 TRP CG C 11.636 0.896 11.672 1.00 . A A . 2 TRP CG 1 1
3 656 1 1 3 TRP CH2 C 10.282 3.193 8.360 1.00 . A A . 2 TRP CH2 1 1
3 657 1 1 3 TRP CZ2 C 11.549 3.315 8.937 1.00 . A A . 2 TRP CZ2 1 1
3 658 1 1 3 TRP CZ3 C 9.366 2.265 8.876 1.00 . A A . 2 TRP CZ3 1 1
3 659 1 1 3 TRP H H 12.286 -2.152 13.647 1.00 . A A . 2 TRP H 1 1
3 660 1 1 3 TRP HA H 10.230 -1.977 11.712 1.00 . A A . 2 TRP HA 1 1
3 661 1 1 3 TRP HB2 H 10.080 0.042 12.787 1.00 . A A . 2 TRP HB2 1 1
3 662 1 1 3 TRP HB3 H 11.670 -0.189 13.480 1.00 . A A . 2 TRP HB3 1 1
3 663 1 1 3 TRP HD1 H 13.587 1.120 12.519 1.00 . A A . 2 TRP HD1 1 1
3 664 1 1 3 TRP HE1 H 13.833 2.920 10.660 1.00 . A A . 2 TRP HE1 1 1
3 665 1 1 3 TRP HE3 H 9.003 0.745 10.361 1.00 . A A . 2 TRP HE3 1 1
3 666 1 1 3 TRP HH2 H 10.010 3.812 7.519 1.00 . A A . 2 TRP HH2 1 1
3 667 1 1 3 TRP HZ2 H 12.258 4.024 8.544 1.00 . A A . 2 TRP HZ2 1 1
3 668 1 1 3 TRP HZ3 H 8.387 2.172 8.431 1.00 . A A . 2 TRP HZ3 1 1
3 669 1 1 3 TRP N N 11.871 -2.502 12.839 1.00 . A A . 2 TRP N 1 1
3 670 1 1 3 TRP NE1 N 13.025 2.383 10.801 1.00 . A A . 2 TRP NE1 1 1
3 671 1 1 3 TRP O O 11.371 -1.403 9.502 1.00 . A A . 2 TRP O 1 1
3 672 1 1 4 TRP C C 13.556 -2.730 8.314 1.00 . A A . 3 TRP C 1 1
3 673 1 1 4 TRP CA C 14.110 -1.776 9.381 1.00 . A A . 3 TRP CA 1 1
3 674 1 1 4 TRP CB C 15.574 -2.128 9.750 1.00 . A A . 3 TRP CB 1 1
3 675 1 1 4 TRP CD1 C 15.621 -4.323 10.963 1.00 . A A . 3 TRP CD1 1 1
3 676 1 1 4 TRP CD2 C 16.120 -4.541 8.789 1.00 . A A . 3 TRP CD2 1 1
3 677 1 1 4 TRP CE2 C 16.179 -5.837 9.345 1.00 . A A . 3 TRP CE2 1 1
3 678 1 1 4 TRP CE3 C 16.397 -4.392 7.420 1.00 . A A . 3 TRP CE3 1 1
3 679 1 1 4 TRP CG C 15.762 -3.605 9.842 1.00 . A A . 3 TRP CG 1 1
3 680 1 1 4 TRP CH2 C 16.770 -6.782 7.210 1.00 . A A . 3 TRP CH2 1 1
3 681 1 1 4 TRP CZ2 C 16.499 -6.948 8.571 1.00 . A A . 3 TRP CZ2 1 1
3 682 1 1 4 TRP CZ3 C 16.720 -5.505 6.636 1.00 . A A . 3 TRP CZ3 1 1
3 683 1 1 4 TRP H H 13.764 -1.919 11.446 1.00 . A A . 3 TRP H 1 1
3 684 1 1 4 TRP HA H 14.103 -0.781 8.966 1.00 . A A . 3 TRP HA 1 1
3 685 1 1 4 TRP HB2 H 16.239 -1.744 9.005 1.00 . A A . 3 TRP HB2 1 1
3 686 1 1 4 TRP HB3 H 15.815 -1.680 10.705 1.00 . A A . 3 TRP HB3 1 1
3 687 1 1 4 TRP HD1 H 15.359 -3.921 11.922 1.00 . A A . 3 TRP HD1 1 1
3 688 1 1 4 TRP HE1 H 15.829 -6.391 11.318 1.00 . A A . 3 TRP HE1 1 1
3 689 1 1 4 TRP HE3 H 16.363 -3.415 6.970 1.00 . A A . 3 TRP HE3 1 1
3 690 1 1 4 TRP HH2 H 17.018 -7.633 6.603 1.00 . A A . 3 TRP HH2 1 1
3 691 1 1 4 TRP HZ2 H 16.536 -7.928 9.020 1.00 . A A . 3 TRP HZ2 1 1
3 692 1 1 4 TRP HZ3 H 16.931 -5.379 5.584 1.00 . A A . 3 TRP HZ3 1 1
3 693 1 1 4 TRP N N 13.297 -1.775 10.596 1.00 . A A . 3 TRP N 1 1
3 694 1 1 4 TRP NE1 N 15.866 -5.655 10.675 1.00 . A A . 3 TRP NE1 1 1
3 695 1 1 4 TRP O O 14.123 -2.851 7.242 1.00 . A A . 3 TRP O 1 1
3 696 1 1 5 LEU C C 11.303 -3.548 6.440 1.00 . A A . 4 LEU C 1 1
3 697 1 1 5 LEU CA C 11.899 -4.315 7.613 1.00 . A A . 4 LEU CA 1 1
3 698 1 1 5 LEU CB C 10.833 -5.180 8.268 1.00 . A A . 4 LEU CB 1 1
3 699 1 1 5 LEU CD1 C 10.420 -6.701 10.214 1.00 . A A . 4 LEU CD1 1 1
3 700 1 1 5 LEU CD2 C 12.146 -7.350 8.522 1.00 . A A . 4 LEU CD2 1 1
3 701 1 1 5 LEU CG C 11.485 -6.161 9.263 1.00 . A A . 4 LEU CG 1 1
3 702 1 1 5 LEU H H 12.011 -3.295 9.449 1.00 . A A . 4 LEU H 1 1
3 703 1 1 5 LEU HA H 12.681 -4.946 7.242 1.00 . A A . 4 LEU HA 1 1
3 704 1 1 5 LEU HB2 H 10.145 -4.527 8.792 1.00 . A A . 4 LEU HB2 1 1
3 705 1 1 5 LEU HB3 H 10.295 -5.727 7.512 1.00 . A A . 4 LEU HB3 1 1
3 706 1 1 5 LEU HD11 H 9.910 -5.878 10.691 1.00 . A A . 4 LEU HD11 1 1
3 707 1 1 5 LEU HD12 H 10.893 -7.316 10.965 1.00 . A A . 4 LEU HD12 1 1
3 708 1 1 5 LEU HD13 H 9.710 -7.292 9.658 1.00 . A A . 4 LEU HD13 1 1
3 709 1 1 5 LEU HD21 H 12.306 -8.166 9.215 1.00 . A A . 4 LEU HD21 1 1
3 710 1 1 5 LEU HD22 H 13.099 -7.045 8.122 1.00 . A A . 4 LEU HD22 1 1
3 711 1 1 5 LEU HD23 H 11.510 -7.686 7.717 1.00 . A A . 4 LEU HD23 1 1
3 712 1 1 5 LEU HG H 12.233 -5.632 9.841 1.00 . A A . 4 LEU HG 1 1
3 713 1 1 5 LEU N N 12.461 -3.403 8.592 1.00 . A A . 4 LEU N 1 1
3 714 1 1 5 LEU O O 11.134 -4.098 5.352 1.00 . A A . 4 LEU O 1 1
3 715 1 1 6 ALA C C 11.469 -1.093 4.563 1.00 . A A . 5 ALA C 1 1
3 716 1 1 6 ALA CA C 10.413 -1.448 5.609 1.00 . A A . 5 ALA CA 1 1
3 717 1 1 6 ALA CB C 9.853 -0.157 6.212 1.00 . A A . 5 ALA CB 1 1
3 718 1 1 6 ALA H H 11.142 -1.878 7.538 1.00 . A A . 5 ALA H 1 1
3 719 1 1 6 ALA HA H 9.610 -1.985 5.135 1.00 . A A . 5 ALA HA 1 1
3 720 1 1 6 ALA HB1 H 9.251 0.353 5.475 1.00 . A A . 5 ALA HB1 1 1
3 721 1 1 6 ALA HB2 H 10.669 0.486 6.518 1.00 . A A . 5 ALA HB2 1 1
3 722 1 1 6 ALA HB3 H 9.244 -0.395 7.072 1.00 . A A . 5 ALA HB3 1 1
3 723 1 1 6 ALA N N 10.988 -2.280 6.662 1.00 . A A . 5 ALA N 1 1
3 724 1 1 6 ALA O O 11.142 -0.624 3.473 1.00 . A A . 5 ALA O 1 1
3 725 1 1 7 LEU C C 13.975 -2.113 2.940 1.00 . A A . 6 LEU C 1 1
3 726 1 1 7 LEU CA C 13.833 -1.017 3.991 1.00 . A A . 6 LEU CA 1 1
3 727 1 1 7 LEU CB C 15.139 -0.893 4.788 1.00 . A A . 6 LEU CB 1 1
3 728 1 1 7 LEU CD1 C 16.221 0.428 6.635 1.00 . A A . 6 LEU CD1 1 1
3 729 1 1 7 LEU CD2 C 15.826 1.514 4.426 1.00 . A A . 6 LEU CD2 1 1
3 730 1 1 7 LEU CG C 15.266 0.500 5.438 1.00 . A A . 6 LEU CG 1 1
3 731 1 1 7 LEU H H 12.937 -1.691 5.785 1.00 . A A . 6 LEU H 1 1
3 732 1 1 7 LEU HA H 13.633 -0.090 3.504 1.00 . A A . 6 LEU HA 1 1
3 733 1 1 7 LEU HB2 H 15.122 -1.642 5.551 1.00 . A A . 6 LEU HB2 1 1
3 734 1 1 7 LEU HB3 H 15.985 -1.065 4.147 1.00 . A A . 6 LEU HB3 1 1
3 735 1 1 7 LEU HD11 H 15.730 -0.073 7.452 1.00 . A A . 6 LEU HD11 1 1
3 736 1 1 7 LEU HD12 H 16.498 1.426 6.943 1.00 . A A . 6 LEU HD12 1 1
3 737 1 1 7 LEU HD13 H 17.106 -0.124 6.356 1.00 . A A . 6 LEU HD13 1 1
3 738 1 1 7 LEU HD21 H 16.031 2.445 4.934 1.00 . A A . 6 LEU HD21 1 1
3 739 1 1 7 LEU HD22 H 15.107 1.688 3.643 1.00 . A A . 6 LEU HD22 1 1
3 740 1 1 7 LEU HD23 H 16.740 1.133 3.998 1.00 . A A . 6 LEU HD23 1 1
3 741 1 1 7 LEU HG H 14.297 0.818 5.775 1.00 . A A . 6 LEU HG 1 1
3 742 1 1 7 LEU N N 12.735 -1.318 4.904 1.00 . A A . 6 LEU N 1 1
3 743 1 1 7 LEU O O 14.470 -1.870 1.842 1.00 . A A . 6 LEU O 1 1
3 744 1 1 8 ALA C C 12.406 -4.475 1.440 1.00 . A A . 7 ALA C 1 1
3 745 1 1 8 ALA CA C 13.619 -4.448 2.364 1.00 . A A . 7 ALA CA 1 1
3 746 1 1 8 ALA CB C 13.676 -5.755 3.152 1.00 . A A . 7 ALA CB 1 1
3 747 1 1 8 ALA H H 13.150 -3.449 4.169 1.00 . A A . 7 ALA H 1 1
3 748 1 1 8 ALA HA H 14.514 -4.363 1.772 1.00 . A A . 7 ALA HA 1 1
3 749 1 1 8 ALA HB1 H 12.795 -5.843 3.770 1.00 . A A . 7 ALA HB1 1 1
3 750 1 1 8 ALA HB2 H 14.557 -5.761 3.777 1.00 . A A . 7 ALA HB2 1 1
3 751 1 1 8 ALA HB3 H 13.718 -6.587 2.465 1.00 . A A . 7 ALA HB3 1 1
3 752 1 1 8 ALA N N 13.539 -3.316 3.284 1.00 . A A . 7 ALA N 1 1
3 753 1 1 8 ALA O O 12.420 -5.130 0.397 1.00 . A A . 7 ALA O 1 1
3 754 1 1 9 LEU C C 10.109 -2.485 0.123 1.00 . A A . 8 LEU C 1 1
3 755 1 1 9 LEU CA C 10.119 -3.697 1.050 1.00 . A A . 8 LEU CA 1 1
3 756 1 1 9 LEU CB C 8.927 -3.596 1.992 1.00 . A A . 8 LEU CB 1 1
3 757 1 1 9 LEU CD1 C 7.801 -4.554 4.007 1.00 . A A . 8 LEU CD1 1 1
3 758 1 1 9 LEU CD2 C 8.676 -6.098 2.230 1.00 . A A . 8 LEU CD2 1 1
3 759 1 1 9 LEU CG C 8.918 -4.771 2.981 1.00 . A A . 8 LEU CG 1 1
3 760 1 1 9 LEU H H 11.403 -3.265 2.672 1.00 . A A . 8 LEU H 1 1
3 761 1 1 9 LEU HA H 10.016 -4.587 0.461 1.00 . A A . 8 LEU HA 1 1
3 762 1 1 9 LEU HB2 H 9.000 -2.666 2.539 1.00 . A A . 8 LEU HB2 1 1
3 763 1 1 9 LEU HB3 H 8.014 -3.603 1.418 1.00 . A A . 8 LEU HB3 1 1
3 764 1 1 9 LEU HD11 H 8.071 -3.744 4.668 1.00 . A A . 8 LEU HD11 1 1
3 765 1 1 9 LEU HD12 H 7.663 -5.457 4.583 1.00 . A A . 8 LEU HD12 1 1
3 766 1 1 9 LEU HD13 H 6.882 -4.310 3.494 1.00 . A A . 8 LEU HD13 1 1
3 767 1 1 9 LEU HD21 H 9.604 -6.443 1.799 1.00 . A A . 8 LEU HD21 1 1
3 768 1 1 9 LEU HD22 H 7.950 -5.947 1.445 1.00 . A A . 8 LEU HD22 1 1
3 769 1 1 9 LEU HD23 H 8.305 -6.847 2.918 1.00 . A A . 8 LEU HD23 1 1
3 770 1 1 9 LEU HG H 9.870 -4.810 3.495 1.00 . A A . 8 LEU HG 1 1
3 771 1 1 9 LEU N N 11.353 -3.760 1.833 1.00 . A A . 8 LEU N 1 1
3 772 1 1 9 LEU O O 9.338 -2.435 -0.835 1.00 . A A . 8 LEU O 1 1
3 773 1 1 10 ALA C C 12.447 0.283 -0.380 1.00 . A A . 9 ALA C 1 1
3 774 1 1 10 ALA CA C 11.036 -0.293 -0.405 1.00 . A A . 9 ALA CA 1 1
3 775 1 1 10 ALA CB C 10.046 0.748 0.121 1.00 . A A . 9 ALA CB 1 1
3 776 1 1 10 ALA H H 11.550 -1.596 1.185 1.00 . A A . 9 ALA H 1 1
3 777 1 1 10 ALA HA H 10.780 -0.532 -1.423 1.00 . A A . 9 ALA HA 1 1
3 778 1 1 10 ALA HB1 H 10.009 1.586 -0.560 1.00 . A A . 9 ALA HB1 1 1
3 779 1 1 10 ALA HB2 H 10.365 1.087 1.094 1.00 . A A . 9 ALA HB2 1 1
3 780 1 1 10 ALA HB3 H 9.065 0.303 0.198 1.00 . A A . 9 ALA HB3 1 1
3 781 1 1 10 ALA N N 10.962 -1.505 0.412 1.00 . A A . 9 ALA N 1 1
3 782 1 1 10 ALA O O 12.648 1.445 -0.024 1.00 . A A . 9 ALA O 1 1
3 783 1 1 11 PRO C C 15.111 0.939 -1.902 1.00 . A A . 10 PRO C 1 1
3 784 1 1 11 PRO CA C 14.850 -0.067 -0.775 1.00 . A A . 10 PRO CA 1 1
3 785 1 1 11 PRO CB C 15.617 -1.384 -0.984 1.00 . A A . 10 PRO CB 1 1
3 786 1 1 11 PRO CD C 13.272 -1.906 -1.190 1.00 . A A . 10 PRO CD 1 1
3 787 1 1 11 PRO CG C 14.659 -2.267 -1.721 1.00 . A A . 10 PRO CG 1 1
3 788 1 1 11 PRO HA H 15.129 0.356 0.174 1.00 . A A . 10 PRO HA 1 1
3 789 1 1 11 PRO HB2 H 16.508 -1.212 -1.568 1.00 . A A . 10 PRO HB2 1 1
3 790 1 1 11 PRO HB3 H 15.871 -1.836 -0.037 1.00 . A A . 10 PRO HB3 1 1
3 791 1 1 11 PRO HD2 H 12.531 -1.990 -1.977 1.00 . A A . 10 PRO HD2 1 1
3 792 1 1 11 PRO HD3 H 13.008 -2.525 -0.348 1.00 . A A . 10 PRO HD3 1 1
3 793 1 1 11 PRO HG2 H 14.722 -2.071 -2.789 1.00 . A A . 10 PRO HG2 1 1
3 794 1 1 11 PRO HG3 H 14.861 -3.308 -1.520 1.00 . A A . 10 PRO HG3 1 1
3 795 1 1 11 PRO N N 13.420 -0.505 -0.751 1.00 . A A . 10 PRO N 1 1
3 796 1 1 11 PRO O O 14.433 0.923 -2.930 1.00 . A A . 10 PRO O 1 1
3 797 1 1 12 ALA C C 16.820 2.146 -4.022 1.00 . A A . 11 ALA C 1 1
3 798 1 1 12 ALA CA C 16.432 2.813 -2.709 1.00 . A A . 11 ALA CA 1 1
3 799 1 1 12 ALA CB C 17.589 3.689 -2.229 1.00 . A A . 11 ALA CB 1 1
3 800 1 1 12 ALA H H 16.606 1.779 -0.863 1.00 . A A . 11 ALA H 1 1
3 801 1 1 12 ALA HA H 15.570 3.441 -2.876 1.00 . A A . 11 ALA HA 1 1
3 802 1 1 12 ALA HB1 H 17.248 4.330 -1.429 1.00 . A A . 11 ALA HB1 1 1
3 803 1 1 12 ALA HB2 H 17.942 4.296 -3.051 1.00 . A A . 11 ALA HB2 1 1
3 804 1 1 12 ALA HB3 H 18.392 3.062 -1.872 1.00 . A A . 11 ALA HB3 1 1
3 805 1 1 12 ALA N N 16.097 1.811 -1.701 1.00 . A A . 11 ALA N 1 1
3 806 1 1 12 ALA O O 17.055 2.820 -5.023 1.00 . A A . 11 ALA O 1 1
3 807 1 1 13 LEU C C 16.263 0.394 -6.350 1.00 . A A . 12 LEU C 1 1
3 808 1 1 13 LEU CA C 17.265 0.107 -5.232 1.00 . A A . 12 LEU CA 1 1
3 809 1 1 13 LEU CB C 17.319 -1.403 -4.967 1.00 . A A . 12 LEU CB 1 1
3 810 1 1 13 LEU CD1 C 18.041 -3.084 -3.234 1.00 . A A . 12 LEU CD1 1 1
3 811 1 1 13 LEU CD2 C 19.770 -1.752 -4.438 1.00 . A A . 12 LEU CD2 1 1
3 812 1 1 13 LEU CG C 18.347 -1.717 -3.858 1.00 . A A . 12 LEU CG 1 1
3 813 1 1 13 LEU H H 16.705 0.334 -3.191 1.00 . A A . 12 LEU H 1 1
3 814 1 1 13 LEU HA H 18.240 0.438 -5.549 1.00 . A A . 12 LEU HA 1 1
3 815 1 1 13 LEU HB2 H 16.336 -1.738 -4.660 1.00 . A A . 12 LEU HB2 1 1
3 816 1 1 13 LEU HB3 H 17.600 -1.914 -5.874 1.00 . A A . 12 LEU HB3 1 1
3 817 1 1 13 LEU HD11 H 18.170 -3.856 -3.978 1.00 . A A . 12 LEU HD11 1 1
3 818 1 1 13 LEU HD12 H 17.023 -3.096 -2.875 1.00 . A A . 12 LEU HD12 1 1
3 819 1 1 13 LEU HD13 H 18.716 -3.261 -2.409 1.00 . A A . 12 LEU HD13 1 1
3 820 1 1 13 LEU HD21 H 19.801 -2.409 -5.295 1.00 . A A . 12 LEU HD21 1 1
3 821 1 1 13 LEU HD22 H 20.453 -2.118 -3.686 1.00 . A A . 12 LEU HD22 1 1
3 822 1 1 13 LEU HD23 H 20.068 -0.758 -4.735 1.00 . A A . 12 LEU HD23 1 1
3 823 1 1 13 LEU HG H 18.287 -0.959 -3.088 1.00 . A A . 12 LEU HG 1 1
3 824 1 1 13 LEU N N 16.895 0.823 -4.018 1.00 . A A . 12 LEU N 1 1
3 825 1 1 13 LEU O O 16.634 0.916 -7.399 1.00 . A A . 12 LEU O 1 1
3 826 1 1 14 ALA C C 14.004 1.748 -7.607 1.00 . A A . 13 ALA C 1 1
3 827 1 1 14 ALA CA C 13.975 0.297 -7.146 1.00 . A A . 13 ALA CA 1 1
3 828 1 1 14 ALA CB C 12.588 -0.044 -6.600 1.00 . A A . 13 ALA CB 1 1
3 829 1 1 14 ALA H H 14.742 -0.357 -5.277 1.00 . A A . 13 ALA H 1 1
3 830 1 1 14 ALA HA H 14.180 -0.337 -7.994 1.00 . A A . 13 ALA HA 1 1
3 831 1 1 14 ALA HB1 H 12.536 -1.100 -6.380 1.00 . A A . 13 ALA HB1 1 1
3 832 1 1 14 ALA HB2 H 11.840 0.207 -7.339 1.00 . A A . 13 ALA HB2 1 1
3 833 1 1 14 ALA HB3 H 12.407 0.522 -5.699 1.00 . A A . 13 ALA HB3 1 1
3 834 1 1 14 ALA N N 14.997 0.058 -6.129 1.00 . A A . 13 ALA N 1 1
3 835 1 1 14 ALA O O 13.598 2.064 -8.725 1.00 . A A . 13 ALA O 1 1
3 836 1 1 15 LEU C C 15.796 4.284 -7.936 1.00 . A A . 14 LEU C 1 1
3 837 1 1 15 LEU CA C 14.573 4.041 -7.061 1.00 . A A . 14 LEU CA 1 1
3 838 1 1 15 LEU CB C 14.633 4.855 -5.749 1.00 . A A . 14 LEU CB 1 1
3 839 1 1 15 LEU CD1 C 14.295 6.993 -7.016 1.00 . A A . 14 LEU CD1 1 1
3 840 1 1 15 LEU CD2 C 15.079 7.051 -4.654 1.00 . A A . 14 LEU CD2 1 1
3 841 1 1 15 LEU CG C 15.155 6.282 -5.975 1.00 . A A . 14 LEU CG 1 1
3 842 1 1 15 LEU H H 14.799 2.313 -5.867 1.00 . A A . 14 LEU H 1 1
3 843 1 1 15 LEU HA H 13.694 4.325 -7.617 1.00 . A A . 14 LEU HA 1 1
3 844 1 1 15 LEU HB2 H 13.641 4.912 -5.327 1.00 . A A . 14 LEU HB2 1 1
3 845 1 1 15 LEU HB3 H 15.278 4.349 -5.049 1.00 . A A . 14 LEU HB3 1 1
3 846 1 1 15 LEU HD11 H 14.429 6.521 -7.971 1.00 . A A . 14 LEU HD11 1 1
3 847 1 1 15 LEU HD12 H 14.593 8.029 -7.082 1.00 . A A . 14 LEU HD12 1 1
3 848 1 1 15 LEU HD13 H 13.256 6.935 -6.726 1.00 . A A . 14 LEU HD13 1 1
3 849 1 1 15 LEU HD21 H 14.047 7.273 -4.424 1.00 . A A . 14 LEU HD21 1 1
3 850 1 1 15 LEU HD22 H 15.635 7.972 -4.743 1.00 . A A . 14 LEU HD22 1 1
3 851 1 1 15 LEU HD23 H 15.502 6.450 -3.863 1.00 . A A . 14 LEU HD23 1 1
3 852 1 1 15 LEU HG H 16.181 6.251 -6.312 1.00 . A A . 14 LEU HG 1 1
3 853 1 1 15 LEU N N 14.490 2.625 -6.739 1.00 . A A . 14 LEU N 1 1
3 854 1 1 15 LEU O O 15.686 4.838 -9.031 1.00 . A A . 14 LEU O 1 1
3 855 1 1 16 ALA C C 18.092 3.305 -9.547 1.00 . A A . 15 ALA C 1 1
3 856 1 1 16 ALA CA C 18.183 4.049 -8.217 1.00 . A A . 15 ALA CA 1 1
3 857 1 1 16 ALA CB C 19.385 3.538 -7.418 1.00 . A A . 15 ALA CB 1 1
3 858 1 1 16 ALA H H 16.994 3.428 -6.579 1.00 . A A . 15 ALA H 1 1
3 859 1 1 16 ALA HA H 18.317 5.099 -8.413 1.00 . A A . 15 ALA HA 1 1
3 860 1 1 16 ALA HB1 H 19.335 3.919 -6.410 1.00 . A A . 15 ALA HB1 1 1
3 861 1 1 16 ALA HB2 H 20.300 3.875 -7.886 1.00 . A A . 15 ALA HB2 1 1
3 862 1 1 16 ALA HB3 H 19.370 2.458 -7.397 1.00 . A A . 15 ALA HB3 1 1
3 863 1 1 16 ALA N N 16.959 3.866 -7.455 1.00 . A A . 15 ALA N 1 1
3 864 1 1 16 ALA O O 18.685 3.722 -10.542 1.00 . A A . 15 ALA O 1 1
3 865 1 1 17 LEU C C 16.612 2.284 -11.887 1.00 . A A . 16 LEU C 1 1
3 866 1 1 17 LEU CA C 17.198 1.418 -10.779 1.00 . A A . 16 LEU CA 1 1
3 867 1 1 17 LEU CB C 16.292 0.172 -10.518 1.00 . A A . 16 LEU CB 1 1
3 868 1 1 17 LEU CD1 C 17.922 -0.960 -8.962 1.00 . A A . 16 LEU CD1 1 1
3 869 1 1 17 LEU CD2 C 16.202 -2.308 -10.205 1.00 . A A . 16 LEU CD2 1 1
3 870 1 1 17 LEU CG C 17.137 -1.093 -10.275 1.00 . A A . 16 LEU CG 1 1
3 871 1 1 17 LEU H H 16.899 1.916 -8.733 1.00 . A A . 16 LEU H 1 1
3 872 1 1 17 LEU HA H 18.172 1.092 -11.097 1.00 . A A . 16 LEU HA 1 1
3 873 1 1 17 LEU HB2 H 15.691 0.357 -9.646 1.00 . A A . 16 LEU HB2 1 1
3 874 1 1 17 LEU HB3 H 15.634 -0.006 -11.363 1.00 . A A . 16 LEU HB3 1 1
3 875 1 1 17 LEU HD11 H 18.276 0.056 -8.849 1.00 . A A . 16 LEU HD11 1 1
3 876 1 1 17 LEU HD12 H 18.768 -1.629 -8.983 1.00 . A A . 16 LEU HD12 1 1
3 877 1 1 17 LEU HD13 H 17.287 -1.214 -8.128 1.00 . A A . 16 LEU HD13 1 1
3 878 1 1 17 LEU HD21 H 16.788 -3.213 -10.132 1.00 . A A . 16 LEU HD21 1 1
3 879 1 1 17 LEU HD22 H 15.593 -2.346 -11.098 1.00 . A A . 16 LEU HD22 1 1
3 880 1 1 17 LEU HD23 H 15.564 -2.221 -9.338 1.00 . A A . 16 LEU HD23 1 1
3 881 1 1 17 LEU HG H 17.835 -1.221 -11.093 1.00 . A A . 16 LEU HG 1 1
3 882 1 1 17 LEU N N 17.347 2.201 -9.559 1.00 . A A . 16 LEU N 1 1
3 883 1 1 17 LEU O O 17.181 2.379 -12.975 1.00 . A A . 16 LEU O 1 1
3 884 1 1 18 TRP C C 15.565 5.092 -12.770 1.00 . A A . 17 TRP C 1 1
3 885 1 1 18 TRP CA C 14.830 3.746 -12.621 1.00 . A A . 17 TRP CA 1 1
3 886 1 1 18 TRP CB C 13.324 3.898 -12.253 1.00 . A A . 17 TRP CB 1 1
3 887 1 1 18 TRP CD1 C 12.094 5.469 -13.834 1.00 . A A . 17 TRP CD1 1 1
3 888 1 1 18 TRP CD2 C 12.893 6.460 -11.996 1.00 . A A . 17 TRP CD2 1 1
3 889 1 1 18 TRP CE2 C 12.255 7.470 -12.739 1.00 . A A . 17 TRP CE2 1 1
3 890 1 1 18 TRP CE3 C 13.491 6.791 -10.787 1.00 . A A . 17 TRP CE3 1 1
3 891 1 1 18 TRP CG C 12.780 5.215 -12.697 1.00 . A A . 17 TRP CG 1 1
3 892 1 1 18 TRP CH2 C 12.824 9.104 -11.062 1.00 . A A . 17 TRP CH2 1 1
3 893 1 1 18 TRP CZ2 C 12.215 8.786 -12.283 1.00 . A A . 17 TRP CZ2 1 1
3 894 1 1 18 TRP CZ3 C 13.462 8.095 -10.318 1.00 . A A . 17 TRP CZ3 1 1
3 895 1 1 18 TRP H H 15.037 2.796 -10.733 1.00 . A A . 17 TRP H 1 1
3 896 1 1 18 TRP HA H 14.893 3.237 -13.576 1.00 . A A . 17 TRP HA 1 1
3 897 1 1 18 TRP HB2 H 12.749 3.109 -12.719 1.00 . A A . 17 TRP HB2 1 1
3 898 1 1 18 TRP HB3 H 13.225 3.817 -11.178 1.00 . A A . 17 TRP HB3 1 1
3 899 1 1 18 TRP HD1 H 11.836 4.742 -14.590 1.00 . A A . 17 TRP HD1 1 1
3 900 1 1 18 TRP HE1 H 11.281 7.276 -14.570 1.00 . A A . 17 TRP HE1 1 1
3 901 1 1 18 TRP HE3 H 13.982 6.024 -10.209 1.00 . A A . 17 TRP HE3 1 1
3 902 1 1 18 TRP HH2 H 12.803 10.120 -10.693 1.00 . A A . 17 TRP HH2 1 1
3 903 1 1 18 TRP HZ2 H 11.721 9.548 -12.868 1.00 . A A . 17 TRP HZ2 1 1
3 904 1 1 18 TRP HZ3 H 13.933 8.320 -9.382 1.00 . A A . 17 TRP HZ3 1 1
3 905 1 1 18 TRP N N 15.472 2.905 -11.616 1.00 . A A . 17 TRP N 1 1
3 906 1 1 18 TRP NE1 N 11.777 6.820 -13.859 1.00 . A A . 17 TRP NE1 1 1
3 907 1 1 18 TRP O O 15.843 5.518 -13.891 1.00 . A A . 17 TRP O 1 1
3 908 1 1 19 TRP C C 17.827 6.909 -12.588 1.00 . A A . 18 TRP C 1 1
3 909 1 1 19 TRP CA C 16.573 7.043 -11.741 1.00 . A A . 18 TRP CA 1 1
3 910 1 1 19 TRP CB C 16.977 7.479 -10.338 1.00 . A A . 18 TRP CB 1 1
3 911 1 1 19 TRP CD1 C 17.214 9.895 -10.945 1.00 . A A . 18 TRP CD1 1 1
3 912 1 1 19 TRP CD2 C 19.003 9.106 -9.859 1.00 . A A . 18 TRP CD2 1 1
3 913 1 1 19 TRP CE2 C 19.275 10.464 -10.133 1.00 . A A . 18 TRP CE2 1 1
3 914 1 1 19 TRP CE3 C 19.972 8.357 -9.175 1.00 . A A . 18 TRP CE3 1 1
3 915 1 1 19 TRP CG C 17.692 8.779 -10.386 1.00 . A A . 18 TRP CG 1 1
3 916 1 1 19 TRP CH2 C 21.429 10.300 -9.060 1.00 . A A . 18 TRP CH2 1 1
3 917 1 1 19 TRP CZ2 C 20.473 11.062 -9.740 1.00 . A A . 18 TRP CZ2 1 1
3 918 1 1 19 TRP CZ3 C 21.174 8.949 -8.779 1.00 . A A . 18 TRP CZ3 1 1
3 919 1 1 19 TRP H H 15.648 5.408 -10.774 1.00 . A A . 18 TRP H 1 1
3 920 1 1 19 TRP HA H 15.920 7.786 -12.166 1.00 . A A . 18 TRP HA 1 1
3 921 1 1 19 TRP HB2 H 16.110 7.570 -9.719 1.00 . A A . 18 TRP HB2 1 1
3 922 1 1 19 TRP HB3 H 17.627 6.741 -9.924 1.00 . A A . 18 TRP HB3 1 1
3 923 1 1 19 TRP HD1 H 16.261 9.979 -11.423 1.00 . A A . 18 TRP HD1 1 1
3 924 1 1 19 TRP HE1 H 18.044 11.827 -11.123 1.00 . A A . 18 TRP HE1 1 1
3 925 1 1 19 TRP HE3 H 19.786 7.316 -8.954 1.00 . A A . 18 TRP HE3 1 1
3 926 1 1 19 TRP HH2 H 22.361 10.752 -8.750 1.00 . A A . 18 TRP HH2 1 1
3 927 1 1 19 TRP HZ2 H 20.660 12.103 -9.960 1.00 . A A . 18 TRP HZ2 1 1
3 928 1 1 19 TRP HZ3 H 21.907 8.359 -8.255 1.00 . A A . 18 TRP HZ3 1 1
3 929 1 1 19 TRP N N 15.877 5.761 -11.661 1.00 . A A . 18 TRP N 1 1
3 930 1 1 19 TRP NE1 N 18.149 10.907 -10.801 1.00 . A A . 18 TRP NE1 1 1
3 931 1 1 19 TRP O O 18.029 7.644 -13.554 1.00 . A A . 18 TRP O 1 1
3 932 1 1 20 ALA C C 19.633 4.946 -14.216 1.00 . A A . 19 ALA C 1 1
3 933 1 1 20 ALA CA C 19.906 5.709 -12.922 1.00 . A A . 19 ALA CA 1 1
3 934 1 1 20 ALA CB C 20.863 4.908 -12.038 1.00 . A A . 19 ALA CB 1 1
3 935 1 1 20 ALA H H 18.435 5.411 -11.428 1.00 . A A . 19 ALA H 1 1
3 936 1 1 20 ALA HA H 20.364 6.654 -13.160 1.00 . A A . 19 ALA HA 1 1
3 937 1 1 20 ALA HB1 H 21.859 4.955 -12.452 1.00 . A A . 19 ALA HB1 1 1
3 938 1 1 20 ALA HB2 H 20.539 3.878 -11.996 1.00 . A A . 19 ALA HB2 1 1
3 939 1 1 20 ALA HB3 H 20.867 5.326 -11.042 1.00 . A A . 19 ALA HB3 1 1
3 940 1 1 20 ALA N N 18.662 5.956 -12.208 1.00 . A A . 19 ALA N 1 1
3 941 1 1 20 ALA O O 20.557 4.598 -14.951 1.00 . A A . 19 ALA O 1 1
3 942 1 1 21 ETA CA C 17.966 3.968 -15.693 1.00 . A A . 20 ETA CA 1 1
3 943 1 1 21 ETA CB C 18.064 4.877 -16.917 1.00 . A A . 20 ETA CB 1 1
3 944 1 1 21 ETA HA1 H 16.948 3.628 -15.591 1.00 . A A . 20 ETA HA1 1 1
3 945 1 1 21 ETA HA2 H 18.619 3.114 -15.824 1.00 . A A . 20 ETA HA2 1 1
3 946 1 1 21 ETA HB1 H 18.058 4.268 -17.815 1.00 . A A . 20 ETA HB1 1 1
3 947 1 1 21 ETA HB2 H 18.977 5.442 -16.880 1.00 . A A . 20 ETA HB2 1 1
3 948 1 1 21 ETA HN2 H 17.664 4.993 -13.863 1.00 . A A . 20 ETA HN2 1 1
3 949 1 1 21 ETA HO H 17.259 6.609 -16.537 1.00 . A A . 20 ETA HO 1 1
3 950 1 1 21 ETA N N 18.356 4.690 -14.486 1.00 . A A . 20 ETA N 1 1
3 951 1 1 21 ETA O O 16.962 5.778 -16.916 1.00 . A A . 20 ETA O 1 1
4 952 1 1 1 ACE C C 14.015 -6.222 13.783 1.00 . A A . 0 ACE C 1 1
4 953 1 1 1 ACE CH3 C 15.015 -7.146 13.099 1.00 . A A . 0 ACE CH3 1 1
4 954 1 1 1 ACE H1 H 15.202 -8.001 13.733 1.00 . A A . 0 ACE H1 1 1
4 955 1 1 1 ACE H2 H 15.939 -6.615 12.928 1.00 . A A . 0 ACE H2 1 1
4 956 1 1 1 ACE H3 H 14.610 -7.480 12.156 1.00 . A A . 0 ACE H3 1 1
4 957 1 1 1 ACE O O 13.565 -6.496 14.895 1.00 . A A . 0 ACE O 1 1
4 958 1 1 2 GLY C C 12.034 -3.416 12.540 1.00 . A A . 1 GLY C 1 1
4 959 1 1 2 GLY CA C 12.727 -4.168 13.653 1.00 . A A . 1 GLY CA 1 1
4 960 1 1 2 GLY H H 14.046 -4.947 12.238 1.00 . A A . 1 GLY H 1 1
4 961 1 1 2 GLY HA2 H 11.988 -4.674 14.248 1.00 . A A . 1 GLY HA2 1 1
4 962 1 1 2 GLY HA3 H 13.259 -3.458 14.268 1.00 . A A . 1 GLY HA3 1 1
4 963 1 1 2 GLY N N 13.666 -5.124 13.113 1.00 . A A . 1 GLY N 1 1
4 964 1 1 2 GLY O O 11.565 -3.995 11.562 1.00 . A A . 1 GLY O 1 1
4 965 1 1 3 TRP C C 12.044 -1.345 10.385 1.00 . A A . 2 TRP C 1 1
4 966 1 1 3 TRP CA C 11.344 -1.242 11.756 1.00 . A A . 2 TRP CA 1 1
4 967 1 1 3 TRP CB C 11.332 0.215 12.339 1.00 . A A . 2 TRP CB 1 1
4 968 1 1 3 TRP CD1 C 13.228 1.658 11.573 1.00 . A A . 2 TRP CD1 1 1
4 969 1 1 3 TRP CD2 C 11.445 1.818 10.221 1.00 . A A . 2 TRP CD2 1 1
4 970 1 1 3 TRP CE2 C 12.433 2.669 9.681 1.00 . A A . 2 TRP CE2 1 1
4 971 1 1 3 TRP CE3 C 10.208 1.727 9.559 1.00 . A A . 2 TRP CE3 1 1
4 972 1 1 3 TRP CG C 11.983 1.196 11.419 1.00 . A A . 2 TRP CG 1 1
4 973 1 1 3 TRP CH2 C 10.971 3.308 7.873 1.00 . A A . 2 TRP CH2 1 1
4 974 1 1 3 TRP CZ2 C 12.204 3.406 8.522 1.00 . A A . 2 TRP CZ2 1 1
4 975 1 1 3 TRP CZ3 C 9.974 2.470 8.391 1.00 . A A . 2 TRP CZ3 1 1
4 976 1 1 3 TRP H H 12.377 -1.767 13.532 1.00 . A A . 2 TRP H 1 1
4 977 1 1 3 TRP HA H 10.324 -1.572 11.630 1.00 . A A . 2 TRP HA 1 1
4 978 1 1 3 TRP HB2 H 10.321 0.541 12.516 1.00 . A A . 2 TRP HB2 1 1
4 979 1 1 3 TRP HB3 H 11.863 0.212 13.280 1.00 . A A . 2 TRP HB3 1 1
4 980 1 1 3 TRP HD1 H 13.891 1.379 12.375 1.00 . A A . 2 TRP HD1 1 1
4 981 1 1 3 TRP HE1 H 14.351 3.020 10.415 1.00 . A A . 2 TRP HE1 1 1
4 982 1 1 3 TRP HE3 H 9.434 1.085 9.951 1.00 . A A . 2 TRP HE3 1 1
4 983 1 1 3 TRP HH2 H 10.785 3.875 6.974 1.00 . A A . 2 TRP HH2 1 1
4 984 1 1 3 TRP HZ2 H 12.975 4.047 8.129 1.00 . A A . 2 TRP HZ2 1 1
4 985 1 1 3 TRP HZ3 H 9.021 2.394 7.889 1.00 . A A . 2 TRP HZ3 1 1
4 986 1 1 3 TRP N N 11.980 -2.126 12.720 1.00 . A A . 2 TRP N 1 1
4 987 1 1 3 TRP NE1 N 13.507 2.540 10.540 1.00 . A A . 2 TRP NE1 1 1
4 988 1 1 3 TRP O O 11.401 -1.200 9.346 1.00 . A A . 2 TRP O 1 1
4 989 1 1 4 TRP C C 13.467 -2.667 8.145 1.00 . A A . 3 TRP C 1 1
4 990 1 1 4 TRP CA C 14.120 -1.704 9.149 1.00 . A A . 3 TRP CA 1 1
4 991 1 1 4 TRP CB C 15.581 -2.116 9.487 1.00 . A A . 3 TRP CB 1 1
4 992 1 1 4 TRP CD1 C 15.624 -4.331 10.663 1.00 . A A . 3 TRP CD1 1 1
4 993 1 1 4 TRP CD2 C 16.017 -4.528 8.464 1.00 . A A . 3 TRP CD2 1 1
4 994 1 1 4 TRP CE2 C 16.065 -5.833 8.999 1.00 . A A . 3 TRP CE2 1 1
4 995 1 1 4 TRP CE3 C 16.236 -4.367 7.086 1.00 . A A . 3 TRP CE3 1 1
4 996 1 1 4 TRP CG C 15.733 -3.598 9.546 1.00 . A A . 3 TRP CG 1 1
4 997 1 1 4 TRP CH2 C 16.533 -6.763 6.827 1.00 . A A . 3 TRP CH2 1 1
4 998 1 1 4 TRP CZ2 C 16.319 -6.941 8.197 1.00 . A A . 3 TRP CZ2 1 1
4 999 1 1 4 TRP CZ3 C 16.492 -5.478 6.273 1.00 . A A . 3 TRP CZ3 1 1
4 1000 1 1 4 TRP H H 13.837 -1.698 11.235 1.00 . A A . 3 TRP H 1 1
4 1001 1 1 4 TRP HA H 14.150 -0.728 8.683 1.00 . A A . 3 TRP HA 1 1
4 1002 1 1 4 TRP HB2 H 16.250 -1.736 8.741 1.00 . A A . 3 TRP HB2 1 1
4 1003 1 1 4 TRP HB3 H 15.850 -1.695 10.448 1.00 . A A . 3 TRP HB3 1 1
4 1004 1 1 4 TRP HD1 H 15.418 -3.936 11.639 1.00 . A A . 3 TRP HD1 1 1
4 1005 1 1 4 TRP HE1 H 15.791 -6.409 10.978 1.00 . A A . 3 TRP HE1 1 1
4 1006 1 1 4 TRP HE3 H 16.209 -3.383 6.650 1.00 . A A . 3 TRP HE3 1 1
4 1007 1 1 4 TRP HH2 H 16.729 -7.613 6.197 1.00 . A A . 3 TRP HH2 1 1
4 1008 1 1 4 TRP HZ2 H 16.349 -7.929 8.631 1.00 . A A . 3 TRP HZ2 1 1
4 1009 1 1 4 TRP HZ3 H 16.657 -5.340 5.214 1.00 . A A . 3 TRP HZ3 1 1
4 1010 1 1 4 TRP N N 13.353 -1.591 10.390 1.00 . A A . 3 TRP N 1 1
4 1011 1 1 4 TRP NE1 N 15.819 -5.664 10.345 1.00 . A A . 3 TRP NE1 1 1
4 1012 1 1 4 TRP O O 13.984 -2.863 7.056 1.00 . A A . 3 TRP O 1 1
4 1013 1 1 5 LEU C C 11.043 -3.374 6.432 1.00 . A A . 4 LEU C 1 1
4 1014 1 1 5 LEU CA C 11.681 -4.174 7.563 1.00 . A A . 4 LEU CA 1 1
4 1015 1 1 5 LEU CB C 10.620 -5.000 8.302 1.00 . A A . 4 LEU CB 1 1
4 1016 1 1 5 LEU CD1 C 10.411 -6.617 10.234 1.00 . A A . 4 LEU CD1 1 1
4 1017 1 1 5 LEU CD2 C 11.487 -7.380 8.128 1.00 . A A . 4 LEU CD2 1 1
4 1018 1 1 5 LEU CG C 11.290 -6.175 9.064 1.00 . A A . 4 LEU CG 1 1
4 1019 1 1 5 LEU H H 11.916 -3.093 9.350 1.00 . A A . 4 LEU H 1 1
4 1020 1 1 5 LEU HA H 12.419 -4.833 7.143 1.00 . A A . 4 LEU HA 1 1
4 1021 1 1 5 LEU HB2 H 10.110 -4.349 9.000 1.00 . A A . 4 LEU HB2 1 1
4 1022 1 1 5 LEU HB3 H 9.902 -5.391 7.595 1.00 . A A . 4 LEU HB3 1 1
4 1023 1 1 5 LEU HD11 H 9.493 -7.038 9.855 1.00 . A A . 4 LEU HD11 1 1
4 1024 1 1 5 LEU HD12 H 10.187 -5.767 10.861 1.00 . A A . 4 LEU HD12 1 1
4 1025 1 1 5 LEU HD13 H 10.936 -7.362 10.813 1.00 . A A . 4 LEU HD13 1 1
4 1026 1 1 5 LEU HD21 H 10.543 -7.640 7.671 1.00 . A A . 4 LEU HD21 1 1
4 1027 1 1 5 LEU HD22 H 11.848 -8.221 8.700 1.00 . A A . 4 LEU HD22 1 1
4 1028 1 1 5 LEU HD23 H 12.205 -7.137 7.361 1.00 . A A . 4 LEU HD23 1 1
4 1029 1 1 5 LEU HG H 12.250 -5.857 9.450 1.00 . A A . 4 LEU HG 1 1
4 1030 1 1 5 LEU N N 12.335 -3.264 8.488 1.00 . A A . 4 LEU N 1 1
4 1031 1 1 5 LEU O O 10.792 -3.901 5.350 1.00 . A A . 4 LEU O 1 1
4 1032 1 1 6 ALA C C 11.153 -0.972 4.546 1.00 . A A . 5 ALA C 1 1
4 1033 1 1 6 ALA CA C 10.182 -1.218 5.699 1.00 . A A . 5 ALA CA 1 1
4 1034 1 1 6 ALA CB C 9.805 0.123 6.341 1.00 . A A . 5 ALA CB 1 1
4 1035 1 1 6 ALA H H 11.012 -1.725 7.573 1.00 . A A . 5 ALA H 1 1
4 1036 1 1 6 ALA HA H 9.288 -1.683 5.319 1.00 . A A . 5 ALA HA 1 1
4 1037 1 1 6 ALA HB1 H 9.286 0.734 5.617 1.00 . A A . 5 ALA HB1 1 1
4 1038 1 1 6 ALA HB2 H 10.702 0.635 6.667 1.00 . A A . 5 ALA HB2 1 1
4 1039 1 1 6 ALA HB3 H 9.163 -0.052 7.191 1.00 . A A . 5 ALA HB3 1 1
4 1040 1 1 6 ALA N N 10.788 -2.096 6.696 1.00 . A A . 5 ALA N 1 1
4 1041 1 1 6 ALA O O 10.762 -0.506 3.477 1.00 . A A . 5 ALA O 1 1
4 1042 1 1 7 LEU C C 13.542 -2.332 2.871 1.00 . A A . 6 LEU C 1 1
4 1043 1 1 7 LEU CA C 13.465 -1.113 3.778 1.00 . A A . 6 LEU CA 1 1
4 1044 1 1 7 LEU CB C 14.805 -0.938 4.481 1.00 . A A . 6 LEU CB 1 1
4 1045 1 1 7 LEU CD1 C 15.969 0.430 6.229 1.00 . A A . 6 LEU CD1 1 1
4 1046 1 1 7 LEU CD2 C 15.352 1.500 4.065 1.00 . A A . 6 LEU CD2 1 1
4 1047 1 1 7 LEU CG C 14.921 0.459 5.115 1.00 . A A . 6 LEU CG 1 1
4 1048 1 1 7 LEU H H 12.667 -1.657 5.653 1.00 . A A . 6 LEU H 1 1
4 1049 1 1 7 LEU HA H 13.261 -0.246 3.196 1.00 . A A . 6 LEU HA 1 1
4 1050 1 1 7 LEU HB2 H 14.865 -1.687 5.247 1.00 . A A . 6 LEU HB2 1 1
4 1051 1 1 7 LEU HB3 H 15.608 -1.083 3.784 1.00 . A A . 6 LEU HB3 1 1
4 1052 1 1 7 LEU HD11 H 16.932 0.183 5.809 1.00 . A A . 6 LEU HD11 1 1
4 1053 1 1 7 LEU HD12 H 15.694 -0.317 6.959 1.00 . A A . 6 LEU HD12 1 1
4 1054 1 1 7 LEU HD13 H 16.018 1.397 6.704 1.00 . A A . 6 LEU HD13 1 1
4 1055 1 1 7 LEU HD21 H 16.208 1.136 3.515 1.00 . A A . 6 LEU HD21 1 1
4 1056 1 1 7 LEU HD22 H 15.617 2.420 4.563 1.00 . A A . 6 LEU HD22 1 1
4 1057 1 1 7 LEU HD23 H 14.539 1.689 3.382 1.00 . A A . 6 LEU HD23 1 1
4 1058 1 1 7 LEU HG H 13.971 0.735 5.532 1.00 . A A . 6 LEU HG 1 1
4 1059 1 1 7 LEU N N 12.421 -1.291 4.781 1.00 . A A . 6 LEU N 1 1
4 1060 1 1 7 LEU O O 14.052 -2.259 1.757 1.00 . A A . 6 LEU O 1 1
4 1061 1 1 8 ALA C C 11.894 -4.680 1.586 1.00 . A A . 7 ALA C 1 1
4 1062 1 1 8 ALA CA C 13.032 -4.686 2.599 1.00 . A A . 7 ALA CA 1 1
4 1063 1 1 8 ALA CB C 12.885 -5.880 3.544 1.00 . A A . 7 ALA CB 1 1
4 1064 1 1 8 ALA H H 12.629 -3.432 4.254 1.00 . A A . 7 ALA H 1 1
4 1065 1 1 8 ALA HA H 13.970 -4.771 2.075 1.00 . A A . 7 ALA HA 1 1
4 1066 1 1 8 ALA HB1 H 11.930 -5.827 4.046 1.00 . A A . 7 ALA HB1 1 1
4 1067 1 1 8 ALA HB2 H 13.677 -5.858 4.278 1.00 . A A . 7 ALA HB2 1 1
4 1068 1 1 8 ALA HB3 H 12.944 -6.797 2.978 1.00 . A A . 7 ALA HB3 1 1
4 1069 1 1 8 ALA N N 13.027 -3.445 3.363 1.00 . A A . 7 ALA N 1 1
4 1070 1 1 8 ALA O O 11.862 -5.492 0.661 1.00 . A A . 7 ALA O 1 1
4 1071 1 1 9 LEU C C 10.181 -2.919 -0.407 1.00 . A A . 8 LEU C 1 1
4 1072 1 1 9 LEU CA C 9.812 -3.639 0.885 1.00 . A A . 8 LEU CA 1 1
4 1073 1 1 9 LEU CB C 8.687 -2.874 1.580 1.00 . A A . 8 LEU CB 1 1
4 1074 1 1 9 LEU CD1 C 7.370 -2.635 3.690 1.00 . A A . 8 LEU CD1 1 1
4 1075 1 1 9 LEU CD2 C 8.196 -4.895 2.983 1.00 . A A . 8 LEU CD2 1 1
4 1076 1 1 9 LEU CG C 8.514 -3.391 3.009 1.00 . A A . 8 LEU CG 1 1
4 1077 1 1 9 LEU H H 11.039 -3.144 2.531 1.00 . A A . 8 LEU H 1 1
4 1078 1 1 9 LEU HA H 9.455 -4.625 0.646 1.00 . A A . 8 LEU HA 1 1
4 1079 1 1 9 LEU HB2 H 8.936 -1.821 1.604 1.00 . A A . 8 LEU HB2 1 1
4 1080 1 1 9 LEU HB3 H 7.765 -3.014 1.035 1.00 . A A . 8 LEU HB3 1 1
4 1081 1 1 9 LEU HD11 H 6.437 -2.876 3.202 1.00 . A A . 8 LEU HD11 1 1
4 1082 1 1 9 LEU HD12 H 7.549 -1.572 3.619 1.00 . A A . 8 LEU HD12 1 1
4 1083 1 1 9 LEU HD13 H 7.318 -2.922 4.729 1.00 . A A . 8 LEU HD13 1 1
4 1084 1 1 9 LEU HD21 H 7.491 -5.106 2.191 1.00 . A A . 8 LEU HD21 1 1
4 1085 1 1 9 LEU HD22 H 7.772 -5.195 3.930 1.00 . A A . 8 LEU HD22 1 1
4 1086 1 1 9 LEU HD23 H 9.106 -5.451 2.809 1.00 . A A . 8 LEU HD23 1 1
4 1087 1 1 9 LEU HG H 9.428 -3.222 3.559 1.00 . A A . 8 LEU HG 1 1
4 1088 1 1 9 LEU N N 10.958 -3.756 1.775 1.00 . A A . 8 LEU N 1 1
4 1089 1 1 9 LEU O O 9.555 -3.141 -1.444 1.00 . A A . 8 LEU O 1 1
4 1090 1 1 10 ALA C C 12.915 -0.601 -1.351 1.00 . A A . 9 ALA C 1 1
4 1091 1 1 10 ALA CA C 11.592 -1.332 -1.552 1.00 . A A . 9 ALA CA 1 1
4 1092 1 1 10 ALA CB C 10.510 -0.325 -1.938 1.00 . A A . 9 ALA CB 1 1
4 1093 1 1 10 ALA H H 11.667 -1.903 0.493 1.00 . A A . 9 ALA H 1 1
4 1094 1 1 10 ALA HA H 11.704 -2.035 -2.357 1.00 . A A . 9 ALA HA 1 1
4 1095 1 1 10 ALA HB1 H 10.885 0.330 -2.710 1.00 . A A . 9 ALA HB1 1 1
4 1096 1 1 10 ALA HB2 H 10.236 0.259 -1.072 1.00 . A A . 9 ALA HB2 1 1
4 1097 1 1 10 ALA HB3 H 9.641 -0.853 -2.305 1.00 . A A . 9 ALA HB3 1 1
4 1098 1 1 10 ALA N N 11.191 -2.055 -0.354 1.00 . A A . 9 ALA N 1 1
4 1099 1 1 10 ALA O O 12.964 0.628 -1.372 1.00 . A A . 9 ALA O 1 1
4 1100 1 1 11 PRO C C 15.585 0.398 -1.975 1.00 . A A . 10 PRO C 1 1
4 1101 1 1 11 PRO CA C 15.332 -0.729 -0.966 1.00 . A A . 10 PRO CA 1 1
4 1102 1 1 11 PRO CB C 16.276 -1.919 -1.189 1.00 . A A . 10 PRO CB 1 1
4 1103 1 1 11 PRO CD C 14.023 -2.803 -1.128 1.00 . A A . 10 PRO CD 1 1
4 1104 1 1 11 PRO CG C 15.483 -3.120 -0.774 1.00 . A A . 10 PRO CG 1 1
4 1105 1 1 11 PRO HA H 15.443 -0.370 0.041 1.00 . A A . 10 PRO HA 1 1
4 1106 1 1 11 PRO HB2 H 16.545 -1.988 -2.239 1.00 . A A . 10 PRO HB2 1 1
4 1107 1 1 11 PRO HB3 H 17.159 -1.831 -0.576 1.00 . A A . 10 PRO HB3 1 1
4 1108 1 1 11 PRO HD2 H 13.771 -3.219 -2.096 1.00 . A A . 10 PRO HD2 1 1
4 1109 1 1 11 PRO HD3 H 13.348 -3.168 -0.368 1.00 . A A . 10 PRO HD3 1 1
4 1110 1 1 11 PRO HG2 H 15.829 -4.000 -1.314 1.00 . A A . 10 PRO HG2 1 1
4 1111 1 1 11 PRO HG3 H 15.568 -3.282 0.289 1.00 . A A . 10 PRO HG3 1 1
4 1112 1 1 11 PRO N N 13.981 -1.329 -1.167 1.00 . A A . 10 PRO N 1 1
4 1113 1 1 11 PRO O O 14.902 0.486 -2.996 1.00 . A A . 10 PRO O 1 1
4 1114 1 1 12 ALA C C 17.166 1.810 -3.989 1.00 . A A . 11 ALA C 1 1
4 1115 1 1 12 ALA CA C 16.872 2.355 -2.599 1.00 . A A . 11 ALA CA 1 1
4 1116 1 1 12 ALA CB C 18.084 3.140 -2.099 1.00 . A A . 11 ALA CB 1 1
4 1117 1 1 12 ALA H H 17.081 1.144 -0.867 1.00 . A A . 11 ALA H 1 1
4 1118 1 1 12 ALA HA H 16.022 3.018 -2.652 1.00 . A A . 11 ALA HA 1 1
4 1119 1 1 12 ALA HB1 H 18.421 3.811 -2.878 1.00 . A A . 11 ALA HB1 1 1
4 1120 1 1 12 ALA HB2 H 18.878 2.453 -1.847 1.00 . A A . 11 ALA HB2 1 1
4 1121 1 1 12 ALA HB3 H 17.809 3.711 -1.227 1.00 . A A . 11 ALA HB3 1 1
4 1122 1 1 12 ALA N N 16.563 1.254 -1.692 1.00 . A A . 11 ALA N 1 1
4 1123 1 1 12 ALA O O 17.295 2.561 -4.949 1.00 . A A . 11 ALA O 1 1
4 1124 1 1 13 LEU C C 16.483 0.234 -6.376 1.00 . A A . 12 LEU C 1 1
4 1125 1 1 13 LEU CA C 17.563 -0.134 -5.363 1.00 . A A . 12 LEU CA 1 1
4 1126 1 1 13 LEU CB C 17.616 -1.655 -5.207 1.00 . A A . 12 LEU CB 1 1
4 1127 1 1 13 LEU CD1 C 18.543 -3.538 -3.852 1.00 . A A . 12 LEU CD1 1 1
4 1128 1 1 13 LEU CD2 C 20.107 -1.808 -4.784 1.00 . A A . 12 LEU CD2 1 1
4 1129 1 1 13 LEU CG C 18.701 -2.054 -4.195 1.00 . A A . 12 LEU CG 1 1
4 1130 1 1 13 LEU H H 17.171 -0.042 -3.269 1.00 . A A . 12 LEU H 1 1
4 1131 1 1 13 LEU HA H 18.515 0.216 -5.724 1.00 . A A . 12 LEU HA 1 1
4 1132 1 1 13 LEU HB2 H 16.654 -2.005 -4.854 1.00 . A A . 12 LEU HB2 1 1
4 1133 1 1 13 LEU HB3 H 17.829 -2.108 -6.161 1.00 . A A . 12 LEU HB3 1 1
4 1134 1 1 13 LEU HD11 H 17.537 -3.722 -3.502 1.00 . A A . 12 LEU HD11 1 1
4 1135 1 1 13 LEU HD12 H 19.248 -3.807 -3.080 1.00 . A A . 12 LEU HD12 1 1
4 1136 1 1 13 LEU HD13 H 18.732 -4.134 -4.733 1.00 . A A . 12 LEU HD13 1 1
4 1137 1 1 13 LEU HD21 H 20.837 -2.394 -4.242 1.00 . A A . 12 LEU HD21 1 1
4 1138 1 1 13 LEU HD22 H 20.358 -0.763 -4.690 1.00 . A A . 12 LEU HD22 1 1
4 1139 1 1 13 LEU HD23 H 20.125 -2.088 -5.826 1.00 . A A . 12 LEU HD23 1 1
4 1140 1 1 13 LEU HG H 18.574 -1.468 -3.293 1.00 . A A . 12 LEU HG 1 1
4 1141 1 1 13 LEU N N 17.277 0.494 -4.082 1.00 . A A . 12 LEU N 1 1
4 1142 1 1 13 LEU O O 16.775 0.828 -7.412 1.00 . A A . 12 LEU O 1 1
4 1143 1 1 14 ALA C C 14.174 1.672 -7.371 1.00 . A A . 13 ALA C 1 1
4 1144 1 1 14 ALA CA C 14.143 0.200 -6.983 1.00 . A A . 13 ALA CA 1 1
4 1145 1 1 14 ALA CB C 12.805 -0.139 -6.325 1.00 . A A . 13 ALA CB 1 1
4 1146 1 1 14 ALA H H 15.055 -0.582 -5.235 1.00 . A A . 13 ALA H 1 1
4 1147 1 1 14 ALA HA H 14.253 -0.393 -7.875 1.00 . A A . 13 ALA HA 1 1
4 1148 1 1 14 ALA HB1 H 12.811 -1.172 -6.008 1.00 . A A . 13 ALA HB1 1 1
4 1149 1 1 14 ALA HB2 H 12.005 0.015 -7.034 1.00 . A A . 13 ALA HB2 1 1
4 1150 1 1 14 ALA HB3 H 12.653 0.498 -5.466 1.00 . A A . 13 ALA HB3 1 1
4 1151 1 1 14 ALA N N 15.240 -0.112 -6.075 1.00 . A A . 13 ALA N 1 1
4 1152 1 1 14 ALA O O 13.777 2.043 -8.477 1.00 . A A . 13 ALA O 1 1
4 1153 1 1 15 LEU C C 15.898 4.218 -7.652 1.00 . A A . 14 LEU C 1 1
4 1154 1 1 15 LEU CA C 14.734 3.935 -6.710 1.00 . A A . 14 LEU CA 1 1
4 1155 1 1 15 LEU CB C 14.886 4.673 -5.360 1.00 . A A . 14 LEU CB 1 1
4 1156 1 1 15 LEU CD1 C 14.589 6.892 -6.488 1.00 . A A . 14 LEU CD1 1 1
4 1157 1 1 15 LEU CD2 C 15.475 6.780 -4.162 1.00 . A A . 14 LEU CD2 1 1
4 1158 1 1 15 LEU CG C 15.461 6.089 -5.529 1.00 . A A . 14 LEU CG 1 1
4 1159 1 1 15 LEU H H 14.952 2.154 -5.597 1.00 . A A . 14 LEU H 1 1
4 1160 1 1 15 LEU HA H 13.824 4.256 -7.188 1.00 . A A . 14 LEU HA 1 1
4 1161 1 1 15 LEU HB2 H 13.917 4.748 -4.893 1.00 . A A . 14 LEU HB2 1 1
4 1162 1 1 15 LEU HB3 H 15.537 4.100 -4.717 1.00 . A A . 14 LEU HB3 1 1
4 1163 1 1 15 LEU HD11 H 14.826 7.943 -6.404 1.00 . A A . 14 LEU HD11 1 1
4 1164 1 1 15 LEU HD12 H 13.548 6.738 -6.244 1.00 . A A . 14 LEU HD12 1 1
4 1165 1 1 15 LEU HD13 H 14.774 6.563 -7.494 1.00 . A A . 14 LEU HD13 1 1
4 1166 1 1 15 LEU HD21 H 14.478 6.779 -3.748 1.00 . A A . 14 LEU HD21 1 1
4 1167 1 1 15 LEU HD22 H 15.817 7.797 -4.278 1.00 . A A . 14 LEU HD22 1 1
4 1168 1 1 15 LEU HD23 H 16.143 6.250 -3.500 1.00 . A A . 14 LEU HD23 1 1
4 1169 1 1 15 LEU HG H 16.470 6.035 -5.913 1.00 . A A . 14 LEU HG 1 1
4 1170 1 1 15 LEU N N 14.650 2.506 -6.457 1.00 . A A . 14 LEU N 1 1
4 1171 1 1 15 LEU O O 15.713 4.784 -8.730 1.00 . A A . 14 LEU O 1 1
4 1172 1 1 16 ALA C C 18.070 3.388 -9.437 1.00 . A A . 15 ALA C 1 1
4 1173 1 1 16 ALA CA C 18.263 4.039 -8.073 1.00 . A A . 15 ALA CA 1 1
4 1174 1 1 16 ALA CB C 19.506 3.459 -7.394 1.00 . A A . 15 ALA CB 1 1
4 1175 1 1 16 ALA H H 17.187 3.372 -6.382 1.00 . A A . 15 ALA H 1 1
4 1176 1 1 16 ALA HA H 18.404 5.099 -8.210 1.00 . A A . 15 ALA HA 1 1
4 1177 1 1 16 ALA HB1 H 19.487 2.382 -7.470 1.00 . A A . 15 ALA HB1 1 1
4 1178 1 1 16 ALA HB2 H 19.514 3.746 -6.352 1.00 . A A . 15 ALA HB2 1 1
4 1179 1 1 16 ALA HB3 H 20.392 3.839 -7.879 1.00 . A A . 15 ALA HB3 1 1
4 1180 1 1 16 ALA N N 17.092 3.820 -7.247 1.00 . A A . 15 ALA N 1 1
4 1181 1 1 16 ALA O O 18.649 3.828 -10.429 1.00 . A A . 15 ALA O 1 1
4 1182 1 1 17 LEU C C 16.405 2.616 -11.750 1.00 . A A . 16 LEU C 1 1
4 1183 1 1 17 LEU CA C 17.019 1.648 -10.746 1.00 . A A . 16 LEU CA 1 1
4 1184 1 1 17 LEU CB C 16.088 0.411 -10.526 1.00 . A A . 16 LEU CB 1 1
4 1185 1 1 17 LEU CD1 C 17.801 -0.938 -9.267 1.00 . A A . 16 LEU CD1 1 1
4 1186 1 1 17 LEU CD2 C 15.921 -2.084 -10.475 1.00 . A A . 16 LEU CD2 1 1
4 1187 1 1 17 LEU CG C 16.895 -0.899 -10.503 1.00 . A A . 16 LEU CG 1 1
4 1188 1 1 17 LEU H H 16.821 2.020 -8.660 1.00 . A A . 16 LEU H 1 1
4 1189 1 1 17 LEU HA H 17.964 1.321 -11.136 1.00 . A A . 16 LEU HA 1 1
4 1190 1 1 17 LEU HB2 H 15.582 0.519 -9.580 1.00 . A A . 16 LEU HB2 1 1
4 1191 1 1 17 LEU HB3 H 15.342 0.348 -11.313 1.00 . A A . 16 LEU HB3 1 1
4 1192 1 1 17 LEU HD11 H 18.603 -1.640 -9.434 1.00 . A A . 16 LEU HD11 1 1
4 1193 1 1 17 LEU HD12 H 17.229 -1.243 -8.403 1.00 . A A . 16 LEU HD12 1 1
4 1194 1 1 17 LEU HD13 H 18.218 0.045 -9.092 1.00 . A A . 16 LEU HD13 1 1
4 1195 1 1 17 LEU HD21 H 15.155 -1.900 -9.738 1.00 . A A . 16 LEU HD21 1 1
4 1196 1 1 17 LEU HD22 H 16.459 -2.986 -10.219 1.00 . A A . 16 LEU HD22 1 1
4 1197 1 1 17 LEU HD23 H 15.467 -2.200 -11.448 1.00 . A A . 16 LEU HD23 1 1
4 1198 1 1 17 LEU HG H 17.508 -0.956 -11.394 1.00 . A A . 16 LEU HG 1 1
4 1199 1 1 17 LEU N N 17.256 2.333 -9.483 1.00 . A A . 16 LEU N 1 1
4 1200 1 1 17 LEU O O 16.938 2.805 -12.843 1.00 . A A . 16 LEU O 1 1
4 1201 1 1 18 TRP C C 15.383 5.466 -12.397 1.00 . A A . 17 TRP C 1 1
4 1202 1 1 18 TRP CA C 14.611 4.139 -12.289 1.00 . A A . 17 TRP CA 1 1
4 1203 1 1 18 TRP CB C 13.140 4.312 -11.813 1.00 . A A . 17 TRP CB 1 1
4 1204 1 1 18 TRP CD1 C 11.863 6.040 -13.175 1.00 . A A . 17 TRP CD1 1 1
4 1205 1 1 18 TRP CD2 C 12.821 6.860 -11.330 1.00 . A A . 17 TRP CD2 1 1
4 1206 1 1 18 TRP CE2 C 12.171 7.945 -11.947 1.00 . A A . 17 TRP CE2 1 1
4 1207 1 1 18 TRP CE3 C 13.512 7.076 -10.146 1.00 . A A . 17 TRP CE3 1 1
4 1208 1 1 18 TRP CG C 12.616 5.679 -12.114 1.00 . A A . 17 TRP CG 1 1
4 1209 1 1 18 TRP CH2 C 12.911 9.423 -10.195 1.00 . A A . 17 TRP CH2 1 1
4 1210 1 1 18 TRP CZ2 C 12.209 9.221 -11.391 1.00 . A A . 17 TRP CZ2 1 1
4 1211 1 1 18 TRP CZ3 C 13.562 8.339 -9.577 1.00 . A A . 17 TRP CZ3 1 1
4 1212 1 1 18 TRP H H 14.870 3.021 -10.508 1.00 . A A . 17 TRP H 1 1
4 1213 1 1 18 TRP HA H 14.595 3.695 -13.276 1.00 . A A . 17 TRP HA 1 1
4 1214 1 1 18 TRP HB2 H 12.505 3.582 -12.297 1.00 . A A . 17 TRP HB2 1 1
4 1215 1 1 18 TRP HB3 H 13.108 4.149 -10.742 1.00 . A A . 17 TRP HB3 1 1
4 1216 1 1 18 TRP HD1 H 11.529 5.383 -13.964 1.00 . A A . 17 TRP HD1 1 1
4 1217 1 1 18 TRP HE1 H 11.068 7.923 -13.713 1.00 . A A . 17 TRP HE1 1 1
4 1218 1 1 18 TRP HE3 H 14.013 6.251 -9.667 1.00 . A A . 17 TRP HE3 1 1
4 1219 1 1 18 TRP HH2 H 12.953 10.407 -9.748 1.00 . A A . 17 TRP HH2 1 1
4 1220 1 1 18 TRP HZ2 H 11.705 10.042 -11.877 1.00 . A A . 17 TRP HZ2 1 1
4 1221 1 1 18 TRP HZ3 H 14.103 8.474 -8.664 1.00 . A A . 17 TRP HZ3 1 1
4 1222 1 1 18 TRP N N 15.280 3.210 -11.387 1.00 . A A . 17 TRP N 1 1
4 1223 1 1 18 TRP NE1 N 11.595 7.399 -13.077 1.00 . A A . 17 TRP NE1 1 1
4 1224 1 1 18 TRP O O 15.603 5.957 -13.504 1.00 . A A . 17 TRP O 1 1
4 1225 1 1 19 TRP C C 17.709 7.187 -12.274 1.00 . A A . 18 TRP C 1 1
4 1226 1 1 19 TRP CA C 16.529 7.309 -11.325 1.00 . A A . 18 TRP CA 1 1
4 1227 1 1 19 TRP CB C 17.051 7.641 -9.932 1.00 . A A . 18 TRP CB 1 1
4 1228 1 1 19 TRP CD1 C 17.439 10.057 -10.461 1.00 . A A . 18 TRP CD1 1 1
4 1229 1 1 19 TRP CD2 C 19.218 9.092 -9.505 1.00 . A A . 18 TRP CD2 1 1
4 1230 1 1 19 TRP CE2 C 19.577 10.437 -9.745 1.00 . A A . 18 TRP CE2 1 1
4 1231 1 1 19 TRP CE3 C 20.160 8.246 -8.904 1.00 . A A . 18 TRP CE3 1 1
4 1232 1 1 19 TRP CG C 17.860 8.886 -9.970 1.00 . A A . 18 TRP CG 1 1
4 1233 1 1 19 TRP CH2 C 21.766 10.070 -8.799 1.00 . A A . 18 TRP CH2 1 1
4 1234 1 1 19 TRP CZ2 C 20.836 10.927 -9.397 1.00 . A A . 18 TRP CZ2 1 1
4 1235 1 1 19 TRP CZ3 C 21.425 8.731 -8.553 1.00 . A A . 18 TRP CZ3 1 1
4 1236 1 1 19 TRP H H 15.613 5.649 -10.393 1.00 . A A . 18 TRP H 1 1
4 1237 1 1 19 TRP HA H 15.875 8.098 -11.652 1.00 . A A . 18 TRP HA 1 1
4 1238 1 1 19 TRP HB2 H 16.233 7.765 -9.256 1.00 . A A . 18 TRP HB2 1 1
4 1239 1 1 19 TRP HB3 H 17.667 6.837 -9.593 1.00 . A A . 18 TRP HB3 1 1
4 1240 1 1 19 TRP HD1 H 16.471 10.229 -10.882 1.00 . A A . 18 TRP HD1 1 1
4 1241 1 1 19 TRP HE1 H 18.403 11.927 -10.615 1.00 . A A . 18 TRP HE1 1 1
4 1242 1 1 19 TRP HE3 H 19.908 7.214 -8.710 1.00 . A A . 18 TRP HE3 1 1
4 1243 1 1 19 TRP HH2 H 22.744 10.437 -8.527 1.00 . A A . 18 TRP HH2 1 1
4 1244 1 1 19 TRP HZ2 H 21.091 11.959 -9.590 1.00 . A A . 18 TRP HZ2 1 1
4 1245 1 1 19 TRP HZ3 H 22.139 8.068 -8.092 1.00 . A A . 18 TRP HZ3 1 1
4 1246 1 1 19 TRP N N 15.793 6.049 -11.273 1.00 . A A . 18 TRP N 1 1
4 1247 1 1 19 TRP NE1 N 18.455 10.990 -10.332 1.00 . A A . 18 TRP NE1 1 1
4 1248 1 1 19 TRP O O 17.868 7.981 -13.202 1.00 . A A . 18 TRP O 1 1
4 1249 1 1 20 ALA C C 19.316 5.267 -14.159 1.00 . A A . 19 ALA C 1 1
4 1250 1 1 20 ALA CA C 19.707 5.938 -12.846 1.00 . A A . 19 ALA CA 1 1
4 1251 1 1 20 ALA CB C 20.698 5.054 -12.088 1.00 . A A . 19 ALA CB 1 1
4 1252 1 1 20 ALA H H 18.339 5.594 -11.266 1.00 . A A . 19 ALA H 1 1
4 1253 1 1 20 ALA HA H 20.181 6.881 -13.060 1.00 . A A . 19 ALA HA 1 1
4 1254 1 1 20 ALA HB1 H 20.805 5.418 -11.078 1.00 . A A . 19 ALA HB1 1 1
4 1255 1 1 20 ALA HB2 H 21.656 5.081 -12.586 1.00 . A A . 19 ALA HB2 1 1
4 1256 1 1 20 ALA HB3 H 20.332 4.038 -12.068 1.00 . A A . 19 ALA HB3 1 1
4 1257 1 1 20 ALA N N 18.530 6.182 -12.024 1.00 . A A . 19 ALA N 1 1
4 1258 1 1 20 ALA O O 20.090 5.254 -15.116 1.00 . A A . 19 ALA O 1 1
4 1259 1 1 21 ETA CA C 17.621 4.040 -15.397 1.00 . A A . 20 ETA CA 1 1
4 1260 1 1 21 ETA CB C 18.336 2.705 -15.591 1.00 . A A . 20 ETA CB 1 1
4 1261 1 1 21 ETA HA1 H 17.806 4.665 -16.257 1.00 . A A . 20 ETA HA1 1 1
4 1262 1 1 21 ETA HA2 H 16.557 3.869 -15.299 1.00 . A A . 20 ETA HA2 1 1
4 1263 1 1 21 ETA HB1 H 17.802 2.118 -16.332 1.00 . A A . 20 ETA HB1 1 1
4 1264 1 1 21 ETA HB2 H 18.356 2.164 -14.664 1.00 . A A . 20 ETA HB2 1 1
4 1265 1 1 21 ETA HN2 H 17.536 4.755 -13.403 1.00 . A A . 20 ETA HN2 1 1
4 1266 1 1 21 ETA HO H 20.071 3.562 -15.393 1.00 . A A . 20 ETA HO 1 1
4 1267 1 1 21 ETA N N 18.108 4.712 -14.196 1.00 . A A . 20 ETA N 1 1
4 1268 1 1 21 ETA O O 19.672 2.948 -16.014 1.00 . A A . 20 ETA O 1 1
5 1269 1 1 1 ACE C C 14.259 -6.674 13.774 1.00 . A A . 0 ACE C 1 1
5 1270 1 1 1 ACE CH3 C 15.296 -7.512 13.037 1.00 . A A . 0 ACE CH3 1 1
5 1271 1 1 1 ACE H1 H 15.497 -8.411 13.600 1.00 . A A . 0 ACE H1 1 1
5 1272 1 1 1 ACE H2 H 16.208 -6.944 12.930 1.00 . A A . 0 ACE H2 1 1
5 1273 1 1 1 ACE H3 H 14.919 -7.775 12.060 1.00 . A A . 0 ACE H3 1 1
5 1274 1 1 1 ACE O O 13.836 -7.024 14.876 1.00 . A A . 0 ACE O 1 1
5 1275 1 1 2 GLY C C 12.083 -3.954 12.684 1.00 . A A . 1 GLY C 1 1
5 1276 1 1 2 GLY CA C 12.868 -4.678 13.754 1.00 . A A . 1 GLY CA 1 1
5 1277 1 1 2 GLY H H 14.213 -5.327 12.292 1.00 . A A . 1 GLY H 1 1
5 1278 1 1 2 GLY HA2 H 12.186 -5.240 14.365 1.00 . A A . 1 GLY HA2 1 1
5 1279 1 1 2 GLY HA3 H 13.375 -3.945 14.363 1.00 . A A . 1 GLY HA3 1 1
5 1280 1 1 2 GLY N N 13.849 -5.562 13.161 1.00 . A A . 1 GLY N 1 1
5 1281 1 1 2 GLY O O 11.588 -4.547 11.732 1.00 . A A . 1 GLY O 1 1
5 1282 1 1 3 TRP C C 11.956 -1.781 10.572 1.00 . A A . 2 TRP C 1 1
5 1283 1 1 3 TRP CA C 11.256 -1.809 11.945 1.00 . A A . 2 TRP CA 1 1
5 1284 1 1 3 TRP CB C 11.100 -0.390 12.593 1.00 . A A . 2 TRP CB 1 1
5 1285 1 1 3 TRP CD1 C 12.754 1.316 11.811 1.00 . A A . 2 TRP CD1 1 1
5 1286 1 1 3 TRP CD2 C 10.902 1.300 10.545 1.00 . A A . 2 TRP CD2 1 1
5 1287 1 1 3 TRP CE2 C 11.746 2.293 10.005 1.00 . A A . 2 TRP CE2 1 1
5 1288 1 1 3 TRP CE3 C 9.655 1.078 9.933 1.00 . A A . 2 TRP CE3 1 1
5 1289 1 1 3 TRP CG C 11.571 0.703 11.689 1.00 . A A . 2 TRP CG 1 1
5 1290 1 1 3 TRP CH2 C 10.127 2.811 8.292 1.00 . A A . 2 TRP CH2 1 1
5 1291 1 1 3 TRP CZ2 C 11.368 3.042 8.892 1.00 . A A . 2 TRP CZ2 1 1
5 1292 1 1 3 TRP CZ3 C 9.272 1.831 8.812 1.00 . A A . 2 TRP CZ3 1 1
5 1293 1 1 3 TRP H H 12.407 -2.285 13.660 1.00 . A A . 2 TRP H 1 1
5 1294 1 1 3 TRP HA H 10.275 -2.235 11.806 1.00 . A A . 2 TRP HA 1 1
5 1295 1 1 3 TRP HB2 H 10.069 -0.200 12.839 1.00 . A A . 2 TRP HB2 1 1
5 1296 1 1 3 TRP HB3 H 11.679 -0.366 13.504 1.00 . A A . 2 TRP HB3 1 1
5 1297 1 1 3 TRP HD1 H 13.484 1.091 12.571 1.00 . A A . 2 TRP HD1 1 1
5 1298 1 1 3 TRP HE1 H 13.636 2.861 10.673 1.00 . A A . 2 TRP HE1 1 1
5 1299 1 1 3 TRP HE3 H 8.991 0.323 10.326 1.00 . A A . 2 TRP HE3 1 1
5 1300 1 1 3 TRP HH2 H 9.828 3.388 7.430 1.00 . A A . 2 TRP HH2 1 1
5 1301 1 1 3 TRP HZ2 H 12.030 3.794 8.497 1.00 . A A . 2 TRP HZ2 1 1
5 1302 1 1 3 TRP HZ3 H 8.313 1.653 8.348 1.00 . A A . 2 TRP HZ3 1 1
5 1303 1 1 3 TRP N N 11.982 -2.666 12.870 1.00 . A A . 2 TRP N 1 1
5 1304 1 1 3 TRP NE1 N 12.867 2.269 10.811 1.00 . A A . 2 TRP NE1 1 1
5 1305 1 1 3 TRP O O 11.297 -1.638 9.542 1.00 . A A . 2 TRP O 1 1
5 1306 1 1 4 TRP C C 13.480 -2.847 8.259 1.00 . A A . 3 TRP C 1 1
5 1307 1 1 4 TRP CA C 14.051 -1.894 9.319 1.00 . A A . 3 TRP CA 1 1
5 1308 1 1 4 TRP CB C 15.534 -2.230 9.647 1.00 . A A . 3 TRP CB 1 1
5 1309 1 1 4 TRP CD1 C 15.697 -4.485 10.741 1.00 . A A . 3 TRP CD1 1 1
5 1310 1 1 4 TRP CD2 C 16.123 -4.575 8.542 1.00 . A A . 3 TRP CD2 1 1
5 1311 1 1 4 TRP CE2 C 16.244 -5.896 9.029 1.00 . A A . 3 TRP CE2 1 1
5 1312 1 1 4 TRP CE3 C 16.343 -4.349 7.173 1.00 . A A . 3 TRP CE3 1 1
5 1313 1 1 4 TRP CG C 15.772 -3.705 9.653 1.00 . A A . 3 TRP CG 1 1
5 1314 1 1 4 TRP CH2 C 16.787 -6.714 6.828 1.00 . A A . 3 TRP CH2 1 1
5 1315 1 1 4 TRP CZ2 C 16.571 -6.955 8.188 1.00 . A A . 3 TRP CZ2 1 1
5 1316 1 1 4 TRP CZ3 C 16.673 -5.411 6.322 1.00 . A A . 3 TRP CZ3 1 1
5 1317 1 1 4 TRP H H 13.783 -2.023 11.396 1.00 . A A . 3 TRP H 1 1
5 1318 1 1 4 TRP HA H 14.021 -0.895 8.914 1.00 . A A . 3 TRP HA 1 1
5 1319 1 1 4 TRP HB2 H 16.180 -1.788 8.920 1.00 . A A . 3 TRP HB2 1 1
5 1320 1 1 4 TRP HB3 H 15.774 -1.831 10.623 1.00 . A A . 3 TRP HB3 1 1
5 1321 1 1 4 TRP HD1 H 15.458 -4.141 11.729 1.00 . A A . 3 TRP HD1 1 1
5 1322 1 1 4 TRP HE1 H 15.987 -6.559 10.980 1.00 . A A . 3 TRP HE1 1 1
5 1323 1 1 4 TRP HE3 H 16.261 -3.353 6.773 1.00 . A A . 3 TRP HE3 1 1
5 1324 1 1 4 TRP HH2 H 17.040 -7.527 6.170 1.00 . A A . 3 TRP HH2 1 1
5 1325 1 1 4 TRP HZ2 H 16.657 -7.954 8.586 1.00 . A A . 3 TRP HZ2 1 1
5 1326 1 1 4 TRP HZ3 H 16.840 -5.223 5.270 1.00 . A A . 3 TRP HZ3 1 1
5 1327 1 1 4 TRP N N 13.280 -1.911 10.562 1.00 . A A . 3 TRP N 1 1
5 1328 1 1 4 TRP NE1 N 15.976 -5.792 10.376 1.00 . A A . 3 TRP NE1 1 1
5 1329 1 1 4 TRP O O 14.008 -2.937 7.162 1.00 . A A . 3 TRP O 1 1
5 1330 1 1 5 LEU C C 11.102 -3.712 6.506 1.00 . A A . 4 LEU C 1 1
5 1331 1 1 5 LEU CA C 11.825 -4.470 7.608 1.00 . A A . 4 LEU CA 1 1
5 1332 1 1 5 LEU CB C 10.853 -5.410 8.312 1.00 . A A . 4 LEU CB 1 1
5 1333 1 1 5 LEU CD1 C 10.699 -7.018 10.240 1.00 . A A . 4 LEU CD1 1 1
5 1334 1 1 5 LEU CD2 C 12.176 -7.586 8.309 1.00 . A A . 4 LEU CD2 1 1
5 1335 1 1 5 LEU CG C 11.628 -6.430 9.177 1.00 . A A . 4 LEU CG 1 1
5 1336 1 1 5 LEU H H 11.988 -3.473 9.444 1.00 . A A . 4 LEU H 1 1
5 1337 1 1 5 LEU HA H 12.607 -5.048 7.160 1.00 . A A . 4 LEU HA 1 1
5 1338 1 1 5 LEU HB2 H 10.206 -4.810 8.940 1.00 . A A . 4 LEU HB2 1 1
5 1339 1 1 5 LEU HB3 H 10.257 -5.929 7.581 1.00 . A A . 4 LEU HB3 1 1
5 1340 1 1 5 LEU HD11 H 9.938 -7.613 9.762 1.00 . A A . 4 LEU HD11 1 1
5 1341 1 1 5 LEU HD12 H 10.235 -6.221 10.800 1.00 . A A . 4 LEU HD12 1 1
5 1342 1 1 5 LEU HD13 H 11.273 -7.640 10.909 1.00 . A A . 4 LEU HD13 1 1
5 1343 1 1 5 LEU HD21 H 11.409 -7.936 7.632 1.00 . A A . 4 LEU HD21 1 1
5 1344 1 1 5 LEU HD22 H 12.482 -8.402 8.947 1.00 . A A . 4 LEU HD22 1 1
5 1345 1 1 5 LEU HD23 H 13.028 -7.247 7.743 1.00 . A A . 4 LEU HD23 1 1
5 1346 1 1 5 LEU HG H 12.451 -5.927 9.671 1.00 . A A . 4 LEU HG 1 1
5 1347 1 1 5 LEU N N 12.410 -3.555 8.571 1.00 . A A . 4 LEU N 1 1
5 1348 1 1 5 LEU O O 10.861 -4.256 5.431 1.00 . A A . 4 LEU O 1 1
5 1349 1 1 6 ALA C C 11.023 -1.184 4.693 1.00 . A A . 5 ALA C 1 1
5 1350 1 1 6 ALA CA C 10.061 -1.650 5.784 1.00 . A A . 5 ALA CA 1 1
5 1351 1 1 6 ALA CB C 9.437 -0.428 6.466 1.00 . A A . 5 ALA CB 1 1
5 1352 1 1 6 ALA H H 10.971 -2.058 7.637 1.00 . A A . 5 ALA H 1 1
5 1353 1 1 6 ALA HA H 9.277 -2.236 5.340 1.00 . A A . 5 ALA HA 1 1
5 1354 1 1 6 ALA HB1 H 8.854 -0.750 7.317 1.00 . A A . 5 ALA HB1 1 1
5 1355 1 1 6 ALA HB2 H 8.798 0.088 5.766 1.00 . A A . 5 ALA HB2 1 1
5 1356 1 1 6 ALA HB3 H 10.221 0.241 6.800 1.00 . A A . 5 ALA HB3 1 1
5 1357 1 1 6 ALA N N 10.758 -2.463 6.772 1.00 . A A . 5 ALA N 1 1
5 1358 1 1 6 ALA O O 10.599 -0.702 3.643 1.00 . A A . 5 ALA O 1 1
5 1359 1 1 7 LEU C C 13.461 -1.928 2.853 1.00 . A A . 6 LEU C 1 1
5 1360 1 1 7 LEU CA C 13.337 -0.917 3.992 1.00 . A A . 6 LEU CA 1 1
5 1361 1 1 7 LEU CB C 14.687 -0.785 4.708 1.00 . A A . 6 LEU CB 1 1
5 1362 1 1 7 LEU CD1 C 15.840 0.461 6.556 1.00 . A A . 6 LEU CD1 1 1
5 1363 1 1 7 LEU CD2 C 15.247 1.674 4.469 1.00 . A A . 6 LEU CD2 1 1
5 1364 1 1 7 LEU CG C 14.802 0.568 5.440 1.00 . A A . 6 LEU CG 1 1
5 1365 1 1 7 LEU H H 12.598 -1.716 5.807 1.00 . A A . 6 LEU H 1 1
5 1366 1 1 7 LEU HA H 13.067 0.032 3.587 1.00 . A A . 6 LEU HA 1 1
5 1367 1 1 7 LEU HB2 H 14.751 -1.583 5.419 1.00 . A A . 6 LEU HB2 1 1
5 1368 1 1 7 LEU HB3 H 15.496 -0.878 4.004 1.00 . A A . 6 LEU HB3 1 1
5 1369 1 1 7 LEU HD11 H 15.544 -0.314 7.240 1.00 . A A . 6 LEU HD11 1 1
5 1370 1 1 7 LEU HD12 H 15.909 1.401 7.082 1.00 . A A . 6 LEU HD12 1 1
5 1371 1 1 7 LEU HD13 H 16.801 0.214 6.129 1.00 . A A . 6 LEU HD13 1 1
5 1372 1 1 7 LEU HD21 H 14.458 1.883 3.767 1.00 . A A . 6 LEU HD21 1 1
5 1373 1 1 7 LEU HD22 H 16.130 1.356 3.937 1.00 . A A . 6 LEU HD22 1 1
5 1374 1 1 7 LEU HD23 H 15.473 2.568 5.031 1.00 . A A . 6 LEU HD23 1 1
5 1375 1 1 7 LEU HG H 13.847 0.818 5.865 1.00 . A A . 6 LEU HG 1 1
5 1376 1 1 7 LEU N N 12.318 -1.327 4.952 1.00 . A A . 6 LEU N 1 1
5 1377 1 1 7 LEU O O 13.837 -1.567 1.741 1.00 . A A . 6 LEU O 1 1
5 1378 1 1 8 ALA C C 12.005 -4.189 1.203 1.00 . A A . 7 ALA C 1 1
5 1379 1 1 8 ALA CA C 13.235 -4.223 2.104 1.00 . A A . 7 ALA CA 1 1
5 1380 1 1 8 ALA CB C 13.350 -5.602 2.760 1.00 . A A . 7 ALA CB 1 1
5 1381 1 1 8 ALA H H 12.845 -3.433 4.028 1.00 . A A . 7 ALA H 1 1
5 1382 1 1 8 ALA HA H 14.114 -4.051 1.506 1.00 . A A . 7 ALA HA 1 1
5 1383 1 1 8 ALA HB1 H 12.491 -5.774 3.391 1.00 . A A . 7 ALA HB1 1 1
5 1384 1 1 8 ALA HB2 H 14.249 -5.641 3.358 1.00 . A A . 7 ALA HB2 1 1
5 1385 1 1 8 ALA HB3 H 13.393 -6.362 1.995 1.00 . A A . 7 ALA HB3 1 1
5 1386 1 1 8 ALA N N 13.147 -3.185 3.130 1.00 . A A . 7 ALA N 1 1
5 1387 1 1 8 ALA O O 11.946 -4.878 0.186 1.00 . A A . 7 ALA O 1 1
5 1388 1 1 9 LEU C C 9.881 -2.117 -0.195 1.00 . A A . 8 LEU C 1 1
5 1389 1 1 9 LEU CA C 9.782 -3.243 0.830 1.00 . A A . 8 LEU CA 1 1
5 1390 1 1 9 LEU CB C 8.629 -2.940 1.785 1.00 . A A . 8 LEU CB 1 1
5 1391 1 1 9 LEU CD1 C 7.456 -3.651 3.878 1.00 . A A . 8 LEU CD1 1 1
5 1392 1 1 9 LEU CD2 C 8.649 -5.357 2.474 1.00 . A A . 8 LEU CD2 1 1
5 1393 1 1 9 LEU CG C 8.670 -3.903 2.976 1.00 . A A . 8 LEU CG 1 1
5 1394 1 1 9 LEU H H 11.130 -2.860 2.409 1.00 . A A . 8 LEU H 1 1
5 1395 1 1 9 LEU HA H 9.568 -4.164 0.321 1.00 . A A . 8 LEU HA 1 1
5 1396 1 1 9 LEU HB2 H 8.726 -1.921 2.141 1.00 . A A . 8 LEU HB2 1 1
5 1397 1 1 9 LEU HB3 H 7.691 -3.052 1.266 1.00 . A A . 8 LEU HB3 1 1
5 1398 1 1 9 LEU HD11 H 6.568 -4.038 3.401 1.00 . A A . 8 LEU HD11 1 1
5 1399 1 1 9 LEU HD12 H 7.344 -2.590 4.044 1.00 . A A . 8 LEU HD12 1 1
5 1400 1 1 9 LEU HD13 H 7.603 -4.151 4.824 1.00 . A A . 8 LEU HD13 1 1
5 1401 1 1 9 LEU HD21 H 9.637 -5.635 2.138 1.00 . A A . 8 LEU HD21 1 1
5 1402 1 1 9 LEU HD22 H 7.951 -5.450 1.655 1.00 . A A . 8 LEU HD22 1 1
5 1403 1 1 9 LEU HD23 H 8.347 -6.016 3.278 1.00 . A A . 8 LEU HD23 1 1
5 1404 1 1 9 LEU HG H 9.573 -3.724 3.542 1.00 . A A . 8 LEU HG 1 1
5 1405 1 1 9 LEU N N 11.021 -3.378 1.591 1.00 . A A . 8 LEU N 1 1
5 1406 1 1 9 LEU O O 9.172 -2.123 -1.201 1.00 . A A . 8 LEU O 1 1
5 1407 1 1 10 ALA C C 12.316 0.593 -0.676 1.00 . A A . 9 ALA C 1 1
5 1408 1 1 10 ALA CA C 10.933 -0.024 -0.849 1.00 . A A . 9 ALA CA 1 1
5 1409 1 1 10 ALA CB C 9.861 1.032 -0.576 1.00 . A A . 9 ALA CB 1 1
5 1410 1 1 10 ALA H H 11.298 -1.193 0.878 1.00 . A A . 9 ALA H 1 1
5 1411 1 1 10 ALA HA H 10.829 -0.368 -1.863 1.00 . A A . 9 ALA HA 1 1
5 1412 1 1 10 ALA HB1 H 9.843 1.744 -1.388 1.00 . A A . 9 ALA HB1 1 1
5 1413 1 1 10 ALA HB2 H 10.086 1.544 0.347 1.00 . A A . 9 ALA HB2 1 1
5 1414 1 1 10 ALA HB3 H 8.896 0.552 -0.497 1.00 . A A . 9 ALA HB3 1 1
5 1415 1 1 10 ALA N N 10.759 -1.150 0.063 1.00 . A A . 9 ALA N 1 1
5 1416 1 1 10 ALA O O 12.443 1.785 -0.393 1.00 . A A . 9 ALA O 1 1
5 1417 1 1 11 PRO C C 15.137 1.208 -1.865 1.00 . A A . 10 PRO C 1 1
5 1418 1 1 11 PRO CA C 14.751 0.289 -0.703 1.00 . A A . 10 PRO CA 1 1
5 1419 1 1 11 PRO CB C 15.572 -1.012 -0.691 1.00 . A A . 10 PRO CB 1 1
5 1420 1 1 11 PRO CD C 13.291 -1.626 -1.182 1.00 . A A . 10 PRO CD 1 1
5 1421 1 1 11 PRO CG C 14.748 -1.984 -1.478 1.00 . A A . 10 PRO CG 1 1
5 1422 1 1 11 PRO HA H 14.882 0.799 0.236 1.00 . A A . 10 PRO HA 1 1
5 1423 1 1 11 PRO HB2 H 16.533 -0.856 -1.154 1.00 . A A . 10 PRO HB2 1 1
5 1424 1 1 11 PRO HB3 H 15.697 -1.378 0.318 1.00 . A A . 10 PRO HB3 1 1
5 1425 1 1 11 PRO HD2 H 12.676 -1.794 -2.058 1.00 . A A . 10 PRO HD2 1 1
5 1426 1 1 11 PRO HD3 H 12.919 -2.186 -0.339 1.00 . A A . 10 PRO HD3 1 1
5 1427 1 1 11 PRO HG2 H 14.961 -1.872 -2.539 1.00 . A A . 10 PRO HG2 1 1
5 1428 1 1 11 PRO HG3 H 14.941 -2.998 -1.163 1.00 . A A . 10 PRO HG3 1 1
5 1429 1 1 11 PRO N N 13.346 -0.192 -0.842 1.00 . A A . 10 PRO N 1 1
5 1430 1 1 11 PRO O O 14.490 1.206 -2.912 1.00 . A A . 10 PRO O 1 1
5 1431 1 1 12 ALA C C 17.086 2.137 -3.955 1.00 . A A . 11 ALA C 1 1
5 1432 1 1 12 ALA CA C 16.648 2.906 -2.711 1.00 . A A . 11 ALA CA 1 1
5 1433 1 1 12 ALA CB C 17.812 3.752 -2.196 1.00 . A A . 11 ALA CB 1 1
5 1434 1 1 12 ALA H H 16.673 1.954 -0.818 1.00 . A A . 11 ALA H 1 1
5 1435 1 1 12 ALA HA H 15.835 3.565 -2.977 1.00 . A A . 11 ALA HA 1 1
5 1436 1 1 12 ALA HB1 H 17.447 4.466 -1.473 1.00 . A A . 11 ALA HB1 1 1
5 1437 1 1 12 ALA HB2 H 18.267 4.278 -3.024 1.00 . A A . 11 ALA HB2 1 1
5 1438 1 1 12 ALA HB3 H 18.546 3.111 -1.730 1.00 . A A . 11 ALA HB3 1 1
5 1439 1 1 12 ALA N N 16.193 1.991 -1.672 1.00 . A A . 11 ALA N 1 1
5 1440 1 1 12 ALA O O 17.385 2.731 -4.990 1.00 . A A . 11 ALA O 1 1
5 1441 1 1 13 LEU C C 16.596 0.204 -6.165 1.00 . A A . 12 LEU C 1 1
5 1442 1 1 13 LEU CA C 17.535 -0.013 -4.980 1.00 . A A . 12 LEU CA 1 1
5 1443 1 1 13 LEU CB C 17.541 -1.495 -4.584 1.00 . A A . 12 LEU CB 1 1
5 1444 1 1 13 LEU CD1 C 18.174 -3.070 -2.735 1.00 . A A . 12 LEU CD1 1 1
5 1445 1 1 13 LEU CD2 C 19.955 -1.713 -3.842 1.00 . A A . 12 LEU CD2 1 1
5 1446 1 1 13 LEU CG C 18.483 -1.720 -3.388 1.00 . A A . 12 LEU CG 1 1
5 1447 1 1 13 LEU H H 16.881 0.391 -2.999 1.00 . A A . 12 LEU H 1 1
5 1448 1 1 13 LEU HA H 18.529 0.273 -5.276 1.00 . A A . 12 LEU HA 1 1
5 1449 1 1 13 LEU HB2 H 16.536 -1.791 -4.312 1.00 . A A . 12 LEU HB2 1 1
5 1450 1 1 13 LEU HB3 H 17.872 -2.088 -5.420 1.00 . A A . 12 LEU HB3 1 1
5 1451 1 1 13 LEU HD11 H 18.864 -3.242 -1.921 1.00 . A A . 12 LEU HD11 1 1
5 1452 1 1 13 LEU HD12 H 18.278 -3.856 -3.469 1.00 . A A . 12 LEU HD12 1 1
5 1453 1 1 13 LEU HD13 H 17.163 -3.062 -2.355 1.00 . A A . 12 LEU HD13 1 1
5 1454 1 1 13 LEU HD21 H 20.576 -2.107 -3.050 1.00 . A A . 12 LEU HD21 1 1
5 1455 1 1 13 LEU HD22 H 20.262 -0.703 -4.061 1.00 . A A . 12 LEU HD22 1 1
5 1456 1 1 13 LEU HD23 H 20.072 -2.324 -4.725 1.00 . A A . 12 LEU HD23 1 1
5 1457 1 1 13 LEU HG H 18.324 -0.933 -2.662 1.00 . A A . 12 LEU HG 1 1
5 1458 1 1 13 LEU N N 17.126 0.813 -3.849 1.00 . A A . 12 LEU N 1 1
5 1459 1 1 13 LEU O O 17.036 0.601 -7.243 1.00 . A A . 12 LEU O 1 1
5 1460 1 1 14 ALA C C 14.344 1.585 -7.503 1.00 . A A . 13 ALA C 1 1
5 1461 1 1 14 ALA CA C 14.341 0.133 -7.048 1.00 . A A . 13 ALA CA 1 1
5 1462 1 1 14 ALA CB C 12.940 -0.259 -6.576 1.00 . A A . 13 ALA CB 1 1
5 1463 1 1 14 ALA H H 14.995 -0.364 -5.095 1.00 . A A . 13 ALA H 1 1
5 1464 1 1 14 ALA HA H 14.618 -0.492 -7.879 1.00 . A A . 13 ALA HA 1 1
5 1465 1 1 14 ALA HB1 H 12.893 -1.329 -6.440 1.00 . A A . 13 ALA HB1 1 1
5 1466 1 1 14 ALA HB2 H 12.213 0.041 -7.317 1.00 . A A . 13 ALA HB2 1 1
5 1467 1 1 14 ALA HB3 H 12.724 0.232 -5.640 1.00 . A A . 13 ALA HB3 1 1
5 1468 1 1 14 ALA N N 15.305 -0.050 -5.969 1.00 . A A . 13 ALA N 1 1
5 1469 1 1 14 ALA O O 13.888 1.909 -8.599 1.00 . A A . 13 ALA O 1 1
5 1470 1 1 15 LEU C C 16.113 4.155 -7.869 1.00 . A A . 14 LEU C 1 1
5 1471 1 1 15 LEU CA C 14.938 3.874 -6.939 1.00 . A A . 14 LEU CA 1 1
5 1472 1 1 15 LEU CB C 15.089 4.659 -5.618 1.00 . A A . 14 LEU CB 1 1
5 1473 1 1 15 LEU CD1 C 14.900 6.877 -4.487 1.00 . A A . 14 LEU CD1 1 1
5 1474 1 1 15 LEU CD2 C 15.197 6.777 -6.958 1.00 . A A . 14 LEU CD2 1 1
5 1475 1 1 15 LEU CG C 14.554 6.090 -5.752 1.00 . A A . 14 LEU CG 1 1
5 1476 1 1 15 LEU H H 15.210 2.126 -5.790 1.00 . A A . 14 LEU H 1 1
5 1477 1 1 15 LEU HA H 14.029 4.172 -7.430 1.00 . A A . 14 LEU HA 1 1
5 1478 1 1 15 LEU HB2 H 14.535 4.152 -4.843 1.00 . A A . 14 LEU HB2 1 1
5 1479 1 1 15 LEU HB3 H 16.132 4.696 -5.335 1.00 . A A . 14 LEU HB3 1 1
5 1480 1 1 15 LEU HD11 H 14.351 7.807 -4.480 1.00 . A A . 14 LEU HD11 1 1
5 1481 1 1 15 LEU HD12 H 15.961 7.084 -4.472 1.00 . A A . 14 LEU HD12 1 1
5 1482 1 1 15 LEU HD13 H 14.634 6.295 -3.617 1.00 . A A . 14 LEU HD13 1 1
5 1483 1 1 15 LEU HD21 H 14.766 6.382 -7.861 1.00 . A A . 14 LEU HD21 1 1
5 1484 1 1 15 LEU HD22 H 16.261 6.593 -6.955 1.00 . A A . 14 LEU HD22 1 1
5 1485 1 1 15 LEU HD23 H 15.015 7.841 -6.909 1.00 . A A . 14 LEU HD23 1 1
5 1486 1 1 15 LEU HG H 13.479 6.060 -5.875 1.00 . A A . 14 LEU HG 1 1
5 1487 1 1 15 LEU N N 14.866 2.451 -6.644 1.00 . A A . 14 LEU N 1 1
5 1488 1 1 15 LEU O O 15.938 4.684 -8.967 1.00 . A A . 14 LEU O 1 1
5 1489 1 1 16 ALA C C 18.353 3.267 -9.564 1.00 . A A . 15 ALA C 1 1
5 1490 1 1 16 ALA CA C 18.484 4.023 -8.250 1.00 . A A . 15 ALA CA 1 1
5 1491 1 1 16 ALA CB C 19.744 3.572 -7.512 1.00 . A A . 15 ALA CB 1 1
5 1492 1 1 16 ALA H H 17.404 3.370 -6.550 1.00 . A A . 15 ALA H 1 1
5 1493 1 1 16 ALA HA H 18.560 5.076 -8.463 1.00 . A A . 15 ALA HA 1 1
5 1494 1 1 16 ALA HB1 H 19.916 4.217 -6.664 1.00 . A A . 15 ALA HB1 1 1
5 1495 1 1 16 ALA HB2 H 20.592 3.624 -8.181 1.00 . A A . 15 ALA HB2 1 1
5 1496 1 1 16 ALA HB3 H 19.617 2.555 -7.171 1.00 . A A . 15 ALA HB3 1 1
5 1497 1 1 16 ALA N N 17.309 3.796 -7.430 1.00 . A A . 15 ALA N 1 1
5 1498 1 1 16 ALA O O 18.893 3.685 -10.587 1.00 . A A . 15 ALA O 1 1
5 1499 1 1 17 LEU C C 16.736 2.178 -11.791 1.00 . A A . 16 LEU C 1 1
5 1500 1 1 17 LEU CA C 17.452 1.358 -10.730 1.00 . A A . 16 LEU CA 1 1
5 1501 1 1 17 LEU CB C 16.638 0.088 -10.406 1.00 . A A . 16 LEU CB 1 1
5 1502 1 1 17 LEU CD1 C 16.756 -2.022 -9.023 1.00 . A A . 16 LEU CD1 1 1
5 1503 1 1 17 LEU CD2 C 18.161 -1.813 -11.102 1.00 . A A . 16 LEU CD2 1 1
5 1504 1 1 17 LEU CG C 17.561 -1.049 -9.900 1.00 . A A . 16 LEU CG 1 1
5 1505 1 1 17 LEU H H 17.226 1.859 -8.686 1.00 . A A . 16 LEU H 1 1
5 1506 1 1 17 LEU HA H 18.415 1.075 -11.107 1.00 . A A . 16 LEU HA 1 1
5 1507 1 1 17 LEU HB2 H 15.919 0.337 -9.639 1.00 . A A . 16 LEU HB2 1 1
5 1508 1 1 17 LEU HB3 H 16.101 -0.252 -11.285 1.00 . A A . 16 LEU HB3 1 1
5 1509 1 1 17 LEU HD11 H 17.263 -2.975 -8.966 1.00 . A A . 16 LEU HD11 1 1
5 1510 1 1 17 LEU HD12 H 15.772 -2.161 -9.448 1.00 . A A . 16 LEU HD12 1 1
5 1511 1 1 17 LEU HD13 H 16.661 -1.607 -8.035 1.00 . A A . 16 LEU HD13 1 1
5 1512 1 1 17 LEU HD21 H 17.433 -2.516 -11.485 1.00 . A A . 16 LEU HD21 1 1
5 1513 1 1 17 LEU HD22 H 19.042 -2.347 -10.784 1.00 . A A . 16 LEU HD22 1 1
5 1514 1 1 17 LEU HD23 H 18.429 -1.116 -11.880 1.00 . A A . 16 LEU HD23 1 1
5 1515 1 1 17 LEU HG H 18.360 -0.622 -9.305 1.00 . A A . 16 LEU HG 1 1
5 1516 1 1 17 LEU N N 17.634 2.149 -9.530 1.00 . A A . 16 LEU N 1 1
5 1517 1 1 17 LEU O O 17.239 2.341 -12.903 1.00 . A A . 16 LEU O 1 1
5 1518 1 1 18 TRP C C 15.418 4.877 -12.593 1.00 . A A . 17 TRP C 1 1
5 1519 1 1 18 TRP CA C 14.796 3.475 -12.415 1.00 . A A . 17 TRP CA 1 1
5 1520 1 1 18 TRP CB C 13.307 3.508 -11.960 1.00 . A A . 17 TRP CB 1 1
5 1521 1 1 18 TRP CD1 C 11.860 4.957 -13.472 1.00 . A A . 17 TRP CD1 1 1
5 1522 1 1 18 TRP CD2 C 12.696 6.032 -11.698 1.00 . A A . 17 TRP CD2 1 1
5 1523 1 1 18 TRP CE2 C 11.937 6.980 -12.409 1.00 . A A . 17 TRP CE2 1 1
5 1524 1 1 18 TRP CE3 C 13.344 6.425 -10.531 1.00 . A A . 17 TRP CE3 1 1
5 1525 1 1 18 TRP CG C 12.636 4.773 -12.380 1.00 . A A . 17 TRP CG 1 1
5 1526 1 1 18 TRP CH2 C 12.484 8.676 -10.788 1.00 . A A . 17 TRP CH2 1 1
5 1527 1 1 18 TRP CZ2 C 11.825 8.295 -11.964 1.00 . A A . 17 TRP CZ2 1 1
5 1528 1 1 18 TRP CZ3 C 13.242 7.728 -10.077 1.00 . A A . 17 TRP CZ3 1 1
5 1529 1 1 18 TRP H H 15.170 2.528 -10.556 1.00 . A A . 17 TRP H 1 1
5 1530 1 1 18 TRP HA H 14.844 2.976 -13.376 1.00 . A A . 17 TRP HA 1 1
5 1531 1 1 18 TRP HB2 H 12.772 2.670 -12.385 1.00 . A A . 17 TRP HB2 1 1
5 1532 1 1 18 TRP HB3 H 13.279 3.433 -10.879 1.00 . A A . 17 TRP HB3 1 1
5 1533 1 1 18 TRP HD1 H 11.612 4.202 -14.202 1.00 . A A . 17 TRP HD1 1 1
5 1534 1 1 18 TRP HE1 H 10.865 6.689 -14.172 1.00 . A A . 17 TRP HE1 1 1
5 1535 1 1 18 TRP HE3 H 13.927 5.709 -9.974 1.00 . A A . 17 TRP HE3 1 1
5 1536 1 1 18 TRP HH2 H 12.410 9.691 -10.427 1.00 . A A . 17 TRP HH2 1 1
5 1537 1 1 18 TRP HZ2 H 11.238 9.009 -12.523 1.00 . A A . 17 TRP HZ2 1 1
5 1538 1 1 18 TRP HZ3 H 13.754 7.999 -9.179 1.00 . A A . 17 TRP HZ3 1 1
5 1539 1 1 18 TRP N N 15.556 2.687 -11.456 1.00 . A A . 17 TRP N 1 1
5 1540 1 1 18 TRP NE1 N 11.440 6.281 -13.490 1.00 . A A . 17 TRP NE1 1 1
5 1541 1 1 18 TRP O O 15.578 5.337 -13.724 1.00 . A A . 17 TRP O 1 1
5 1542 1 1 19 TRP C C 17.555 6.851 -12.553 1.00 . A A . 18 TRP C 1 1
5 1543 1 1 19 TRP CA C 16.358 6.888 -11.615 1.00 . A A . 18 TRP CA 1 1
5 1544 1 1 19 TRP CB C 16.825 7.357 -10.240 1.00 . A A . 18 TRP CB 1 1
5 1545 1 1 19 TRP CD1 C 16.985 9.763 -10.927 1.00 . A A . 18 TRP CD1 1 1
5 1546 1 1 19 TRP CD2 C 18.822 9.050 -9.867 1.00 . A A . 18 TRP CD2 1 1
5 1547 1 1 19 TRP CE2 C 19.053 10.405 -10.190 1.00 . A A . 18 TRP CE2 1 1
5 1548 1 1 19 TRP CE3 C 19.827 8.346 -9.189 1.00 . A A . 18 TRP CE3 1 1
5 1549 1 1 19 TRP CG C 17.506 8.676 -10.347 1.00 . A A . 18 TRP CG 1 1
5 1550 1 1 19 TRP CH2 C 21.239 10.326 -9.173 1.00 . A A . 18 TRP CH2 1 1
5 1551 1 1 19 TRP CZ2 C 20.247 11.043 -9.849 1.00 . A A . 18 TRP CZ2 1 1
5 1552 1 1 19 TRP CZ3 C 21.027 8.977 -8.843 1.00 . A A . 18 TRP CZ3 1 1
5 1553 1 1 19 TRP H H 15.631 5.173 -10.602 1.00 . A A . 18 TRP H 1 1
5 1554 1 1 19 TRP HA H 15.623 7.580 -11.990 1.00 . A A . 18 TRP HA 1 1
5 1555 1 1 19 TRP HB2 H 15.987 7.438 -9.578 1.00 . A A . 18 TRP HB2 1 1
5 1556 1 1 19 TRP HB3 H 17.514 6.641 -9.849 1.00 . A A . 18 TRP HB3 1 1
5 1557 1 1 19 TRP HD1 H 16.017 9.808 -11.381 1.00 . A A . 18 TRP HD1 1 1
5 1558 1 1 19 TRP HE1 H 17.763 11.707 -11.188 1.00 . A A . 18 TRP HE1 1 1
5 1559 1 1 19 TRP HE3 H 19.673 7.309 -8.931 1.00 . A A . 18 TRP HE3 1 1
5 1560 1 1 19 TRP HH2 H 22.166 10.808 -8.903 1.00 . A A . 18 TRP HH2 1 1
5 1561 1 1 19 TRP HZ2 H 20.404 12.080 -10.106 1.00 . A A . 18 TRP HZ2 1 1
5 1562 1 1 19 TRP HZ3 H 21.788 8.423 -8.322 1.00 . A A . 18 TRP HZ3 1 1
5 1563 1 1 19 TRP N N 15.767 5.556 -11.499 1.00 . A A . 18 TRP N 1 1
5 1564 1 1 19 TRP NE1 N 17.898 10.801 -10.839 1.00 . A A . 18 TRP NE1 1 1
5 1565 1 1 19 TRP O O 17.632 7.605 -13.522 1.00 . A A . 18 TRP O 1 1
5 1566 1 1 20 ALA C C 19.400 5.005 -14.315 1.00 . A A . 19 ALA C 1 1
5 1567 1 1 20 ALA CA C 19.691 5.809 -13.050 1.00 . A A . 19 ALA CA 1 1
5 1568 1 1 20 ALA CB C 20.782 5.111 -12.233 1.00 . A A . 19 ALA CB 1 1
5 1569 1 1 20 ALA H H 18.355 5.397 -11.456 1.00 . A A . 19 ALA H 1 1
5 1570 1 1 20 ALA HA H 20.046 6.786 -13.331 1.00 . A A . 19 ALA HA 1 1
5 1571 1 1 20 ALA HB1 H 21.743 5.282 -12.694 1.00 . A A . 19 ALA HB1 1 1
5 1572 1 1 20 ALA HB2 H 20.585 4.048 -12.196 1.00 . A A . 19 ALA HB2 1 1
5 1573 1 1 20 ALA HB3 H 20.790 5.509 -11.229 1.00 . A A . 19 ALA HB3 1 1
5 1574 1 1 20 ALA N N 18.485 5.961 -12.245 1.00 . A A . 19 ALA N 1 1
5 1575 1 1 20 ALA O O 20.317 4.618 -15.039 1.00 . A A . 19 ALA O 1 1
5 1576 1 1 21 ETA CA C 17.724 3.995 -15.752 1.00 . A A . 20 ETA CA 1 1
5 1577 1 1 21 ETA CB C 17.924 4.824 -17.019 1.00 . A A . 20 ETA CB 1 1
5 1578 1 1 21 ETA HA1 H 16.682 3.726 -15.671 1.00 . A A . 20 ETA HA1 1 1
5 1579 1 1 21 ETA HA2 H 18.323 3.095 -15.812 1.00 . A A . 20 ETA HA2 1 1
5 1580 1 1 21 ETA HB1 H 17.512 4.286 -17.865 1.00 . A A . 20 ETA HB1 1 1
5 1581 1 1 21 ETA HB2 H 18.973 4.988 -17.186 1.00 . A A . 20 ETA HB2 1 1
5 1582 1 1 21 ETA HN2 H 17.432 5.088 -13.958 1.00 . A A . 20 ETA HN2 1 1
5 1583 1 1 21 ETA HO H 16.397 5.922 -16.517 1.00 . A A . 20 ETA HO 1 1
5 1584 1 1 21 ETA N N 18.121 4.756 -14.572 1.00 . A A . 20 ETA N 1 1
5 1585 1 1 21 ETA O O 17.279 6.082 -16.863 1.00 . A A . 20 ETA O 1 1
6 1586 1 1 1 ACE C C 14.295 -6.781 13.631 1.00 . A A . 0 ACE C 1 1
6 1587 1 1 1 ACE CH3 C 15.351 -7.579 12.878 1.00 . A A . 0 ACE CH3 1 1
6 1588 1 1 1 ACE H1 H 15.065 -7.664 11.840 1.00 . A A . 0 ACE H1 1 1
6 1589 1 1 1 ACE H2 H 15.432 -8.565 13.309 1.00 . A A . 0 ACE H2 1 1
6 1590 1 1 1 ACE H3 H 16.303 -7.075 12.950 1.00 . A A . 0 ACE H3 1 1
6 1591 1 1 1 ACE O O 13.812 -7.210 14.680 1.00 . A A . 0 ACE O 1 1
6 1592 1 1 2 GLY C C 12.138 -4.037 12.642 1.00 . A A . 1 GLY C 1 1
6 1593 1 1 2 GLY CA C 12.943 -4.754 13.702 1.00 . A A . 1 GLY CA 1 1
6 1594 1 1 2 GLY H H 14.346 -5.320 12.262 1.00 . A A . 1 GLY H 1 1
6 1595 1 1 2 GLY HA2 H 12.276 -5.331 14.318 1.00 . A A . 1 GLY HA2 1 1
6 1596 1 1 2 GLY HA3 H 13.442 -4.015 14.312 1.00 . A A . 1 GLY HA3 1 1
6 1597 1 1 2 GLY N N 13.936 -5.614 13.091 1.00 . A A . 1 GLY N 1 1
6 1598 1 1 2 GLY O O 11.661 -4.635 11.678 1.00 . A A . 1 GLY O 1 1
6 1599 1 1 3 TRP C C 11.967 -1.810 10.576 1.00 . A A . 2 TRP C 1 1
6 1600 1 1 3 TRP CA C 11.252 -1.900 11.939 1.00 . A A . 2 TRP CA 1 1
6 1601 1 1 3 TRP CB C 11.036 -0.504 12.619 1.00 . A A . 2 TRP CB 1 1
6 1602 1 1 3 TRP CD1 C 12.620 1.276 11.863 1.00 . A A . 2 TRP CD1 1 1
6 1603 1 1 3 TRP CD2 C 10.757 1.230 10.616 1.00 . A A . 2 TRP CD2 1 1
6 1604 1 1 3 TRP CE2 C 11.563 2.265 10.092 1.00 . A A . 2 TRP CE2 1 1
6 1605 1 1 3 TRP CE3 C 9.512 0.982 10.009 1.00 . A A . 2 TRP CE3 1 1
6 1606 1 1 3 TRP CG C 11.459 0.627 11.738 1.00 . A A . 2 TRP CG 1 1
6 1607 1 1 3 TRP CH2 C 9.911 2.773 8.409 1.00 . A A . 2 TRP CH2 1 1
6 1608 1 1 3 TRP CZ2 C 11.150 3.028 9.003 1.00 . A A . 2 TRP CZ2 1 1
6 1609 1 1 3 TRP CZ3 C 9.093 1.751 8.911 1.00 . A A . 2 TRP CZ3 1 1
6 1610 1 1 3 TRP H H 12.412 -2.376 13.647 1.00 . A A . 2 TRP H 1 1
6 1611 1 1 3 TRP HA H 10.288 -2.357 11.777 1.00 . A A . 2 TRP HA 1 1
6 1612 1 1 3 TRP HB2 H 9.999 -0.364 12.871 1.00 . A A . 2 TRP HB2 1 1
6 1613 1 1 3 TRP HB3 H 11.619 -0.476 13.529 1.00 . A A . 2 TRP HB3 1 1
6 1614 1 1 3 TRP HD1 H 13.366 1.057 12.610 1.00 . A A . 2 TRP HD1 1 1
6 1615 1 1 3 TRP HE1 H 13.440 2.876 10.756 1.00 . A A . 2 TRP HE1 1 1
6 1616 1 1 3 TRP HE3 H 8.875 0.198 10.390 1.00 . A A . 2 TRP HE3 1 1
6 1617 1 1 3 TRP HH2 H 9.584 3.360 7.564 1.00 . A A . 2 TRP HH2 1 1
6 1618 1 1 3 TRP HZ2 H 11.783 3.809 8.621 1.00 . A A . 2 TRP HZ2 1 1
6 1619 1 1 3 TRP HZ3 H 8.135 1.554 8.452 1.00 . A A . 2 TRP HZ3 1 1
6 1620 1 1 3 TRP N N 11.999 -2.754 12.848 1.00 . A A . 2 TRP N 1 1
6 1621 1 1 3 TRP NE1 N 12.693 2.257 10.886 1.00 . A A . 2 TRP NE1 1 1
6 1622 1 1 3 TRP O O 11.318 -1.651 9.543 1.00 . A A . 2 TRP O 1 1
6 1623 1 1 4 TRP C C 13.563 -2.797 8.270 1.00 . A A . 3 TRP C 1 1
6 1624 1 1 4 TRP CA C 14.079 -1.833 9.347 1.00 . A A . 3 TRP CA 1 1
6 1625 1 1 4 TRP CB C 15.571 -2.095 9.691 1.00 . A A . 3 TRP CB 1 1
6 1626 1 1 4 TRP CD1 C 15.842 -4.352 10.763 1.00 . A A . 3 TRP CD1 1 1
6 1627 1 1 4 TRP CD2 C 16.292 -4.390 8.568 1.00 . A A . 3 TRP CD2 1 1
6 1628 1 1 4 TRP CE2 C 16.479 -5.707 9.038 1.00 . A A . 3 TRP CE2 1 1
6 1629 1 1 4 TRP CE3 C 16.513 -4.134 7.205 1.00 . A A . 3 TRP CE3 1 1
6 1630 1 1 4 TRP CG C 15.886 -3.554 9.686 1.00 . A A . 3 TRP CG 1 1
6 1631 1 1 4 TRP CH2 C 17.085 -6.466 6.835 1.00 . A A . 3 TRP CH2 1 1
6 1632 1 1 4 TRP CZ2 C 16.870 -6.737 8.189 1.00 . A A . 3 TRP CZ2 1 1
6 1633 1 1 4 TRP CZ3 C 16.907 -5.166 6.344 1.00 . A A . 3 TRP CZ3 1 1
6 1634 1 1 4 TRP H H 13.794 -2.035 11.412 1.00 . A A . 3 TRP H 1 1
6 1635 1 1 4 TRP HA H 14.000 -0.831 8.953 1.00 . A A . 3 TRP HA 1 1
6 1636 1 1 4 TRP HB2 H 16.202 -1.609 8.978 1.00 . A A . 3 TRP HB2 1 1
6 1637 1 1 4 TRP HB3 H 15.777 -1.694 10.676 1.00 . A A . 3 TRP HB3 1 1
6 1638 1 1 4 TRP HD1 H 15.576 -4.034 11.754 1.00 . A A . 3 TRP HD1 1 1
6 1639 1 1 4 TRP HE1 H 16.239 -6.411 10.980 1.00 . A A . 3 TRP HE1 1 1
6 1640 1 1 4 TRP HE3 H 16.381 -3.138 6.819 1.00 . A A . 3 TRP HE3 1 1
6 1641 1 1 4 TRP HH2 H 17.387 -7.256 6.169 1.00 . A A . 3 TRP HH2 1 1
6 1642 1 1 4 TRP HZ2 H 17.005 -7.736 8.574 1.00 . A A . 3 TRP HZ2 1 1
6 1643 1 1 4 TRP HZ3 H 17.073 -4.956 5.297 1.00 . A A . 3 TRP HZ3 1 1
6 1644 1 1 4 TRP N N 13.295 -1.908 10.579 1.00 . A A . 3 TRP N 1 1
6 1645 1 1 4 TRP NE1 N 16.193 -5.636 10.385 1.00 . A A . 3 TRP NE1 1 1
6 1646 1 1 4 TRP O O 14.103 -2.850 7.177 1.00 . A A . 3 TRP O 1 1
6 1647 1 1 5 LEU C C 11.243 -3.752 6.487 1.00 . A A . 4 LEU C 1 1
6 1648 1 1 5 LEU CA C 11.990 -4.486 7.590 1.00 . A A . 4 LEU CA 1 1
6 1649 1 1 5 LEU CB C 11.059 -5.466 8.283 1.00 . A A . 4 LEU CB 1 1
6 1650 1 1 5 LEU CD1 C 10.924 -7.114 10.153 1.00 . A A . 4 LEU CD1 1 1
6 1651 1 1 5 LEU CD2 C 12.653 -7.452 8.357 1.00 . A A . 4 LEU CD2 1 1
6 1652 1 1 5 LEU CG C 11.873 -6.403 9.193 1.00 . A A . 4 LEU CG 1 1
6 1653 1 1 5 LEU H H 12.099 -3.498 9.441 1.00 . A A . 4 LEU H 1 1
6 1654 1 1 5 LEU HA H 12.800 -5.030 7.148 1.00 . A A . 4 LEU HA 1 1
6 1655 1 1 5 LEU HB2 H 10.354 -4.900 8.879 1.00 . A A . 4 LEU HB2 1 1
6 1656 1 1 5 LEU HB3 H 10.524 -6.042 7.548 1.00 . A A . 4 LEU HB3 1 1
6 1657 1 1 5 LEU HD11 H 10.257 -7.749 9.593 1.00 . A A . 4 LEU HD11 1 1
6 1658 1 1 5 LEU HD12 H 10.352 -6.381 10.700 1.00 . A A . 4 LEU HD12 1 1
6 1659 1 1 5 LEU HD13 H 11.499 -7.712 10.842 1.00 . A A . 4 LEU HD13 1 1
6 1660 1 1 5 LEU HD21 H 13.591 -7.026 8.033 1.00 . A A . 4 LEU HD21 1 1
6 1661 1 1 5 LEU HD22 H 12.078 -7.746 7.494 1.00 . A A . 4 LEU HD22 1 1
6 1662 1 1 5 LEU HD23 H 12.857 -8.329 8.961 1.00 . A A . 4 LEU HD23 1 1
6 1663 1 1 5 LEU HG H 12.571 -5.808 9.771 1.00 . A A . 4 LEU HG 1 1
6 1664 1 1 5 LEU N N 12.527 -3.555 8.567 1.00 . A A . 4 LEU N 1 1
6 1665 1 1 5 LEU O O 11.046 -4.291 5.398 1.00 . A A . 4 LEU O 1 1
6 1666 1 1 6 ALA C C 11.051 -1.206 4.700 1.00 . A A . 5 ALA C 1 1
6 1667 1 1 6 ALA CA C 10.104 -1.728 5.780 1.00 . A A . 5 ALA CA 1 1
6 1668 1 1 6 ALA CB C 9.426 -0.542 6.472 1.00 . A A . 5 ALA CB 1 1
6 1669 1 1 6 ALA H H 11.008 -2.123 7.638 1.00 . A A . 5 ALA H 1 1
6 1670 1 1 6 ALA HA H 9.347 -2.339 5.324 1.00 . A A . 5 ALA HA 1 1
6 1671 1 1 6 ALA HB1 H 8.721 -0.085 5.796 1.00 . A A . 5 ALA HB1 1 1
6 1672 1 1 6 ALA HB2 H 10.176 0.188 6.761 1.00 . A A . 5 ALA HB2 1 1
6 1673 1 1 6 ALA HB3 H 8.908 -0.889 7.354 1.00 . A A . 5 ALA HB3 1 1
6 1674 1 1 6 ALA N N 10.829 -2.523 6.765 1.00 . A A . 5 ALA N 1 1
6 1675 1 1 6 ALA O O 10.611 -0.705 3.664 1.00 . A A . 5 ALA O 1 1
6 1676 1 1 7 LEU C C 13.532 -1.867 2.868 1.00 . A A . 6 LEU C 1 1
6 1677 1 1 7 LEU CA C 13.358 -0.863 4.002 1.00 . A A . 6 LEU CA 1 1
6 1678 1 1 7 LEU CB C 14.691 -0.672 4.736 1.00 . A A . 6 LEU CB 1 1
6 1679 1 1 7 LEU CD1 C 15.740 0.631 6.616 1.00 . A A . 6 LEU CD1 1 1
6 1680 1 1 7 LEU CD2 C 15.140 1.812 4.509 1.00 . A A . 6 LEU CD2 1 1
6 1681 1 1 7 LEU CG C 14.729 0.684 5.472 1.00 . A A . 6 LEU CG 1 1
6 1682 1 1 7 LEU H H 12.642 -1.730 5.793 1.00 . A A . 6 LEU H 1 1
6 1683 1 1 7 LEU HA H 13.048 0.073 3.596 1.00 . A A . 6 LEU HA 1 1
6 1684 1 1 7 LEU HB2 H 14.783 -1.468 5.444 1.00 . A A . 6 LEU HB2 1 1
6 1685 1 1 7 LEU HB3 H 15.511 -0.724 4.043 1.00 . A A . 6 LEU HB3 1 1
6 1686 1 1 7 LEU HD11 H 15.707 1.557 7.170 1.00 . A A . 6 LEU HD11 1 1
6 1687 1 1 7 LEU HD12 H 16.731 0.485 6.214 1.00 . A A . 6 LEU HD12 1 1
6 1688 1 1 7 LEU HD13 H 15.495 -0.188 7.270 1.00 . A A . 6 LEU HD13 1 1
6 1689 1 1 7 LEU HD21 H 15.325 2.713 5.075 1.00 . A A . 6 LEU HD21 1 1
6 1690 1 1 7 LEU HD22 H 14.349 1.993 3.802 1.00 . A A . 6 LEU HD22 1 1
6 1691 1 1 7 LEU HD23 H 16.040 1.533 3.980 1.00 . A A . 6 LEU HD23 1 1
6 1692 1 1 7 LEU HG H 13.753 0.892 5.874 1.00 . A A . 6 LEU HG 1 1
6 1693 1 1 7 LEU N N 12.351 -1.325 4.951 1.00 . A A . 6 LEU N 1 1
6 1694 1 1 7 LEU O O 13.924 -1.501 1.763 1.00 . A A . 6 LEU O 1 1
6 1695 1 1 8 ALA C C 12.141 -4.182 1.220 1.00 . A A . 7 ALA C 1 1
6 1696 1 1 8 ALA CA C 13.362 -4.175 2.136 1.00 . A A . 7 ALA CA 1 1
6 1697 1 1 8 ALA CB C 13.501 -5.539 2.814 1.00 . A A . 7 ALA CB 1 1
6 1698 1 1 8 ALA H H 12.919 -3.370 4.041 1.00 . A A . 7 ALA H 1 1
6 1699 1 1 8 ALA HA H 14.244 -3.991 1.547 1.00 . A A . 7 ALA HA 1 1
6 1700 1 1 8 ALA HB1 H 12.631 -5.728 3.425 1.00 . A A . 7 ALA HB1 1 1
6 1701 1 1 8 ALA HB2 H 14.386 -5.544 3.433 1.00 . A A . 7 ALA HB2 1 1
6 1702 1 1 8 ALA HB3 H 13.585 -6.308 2.060 1.00 . A A . 7 ALA HB3 1 1
6 1703 1 1 8 ALA N N 13.235 -3.129 3.147 1.00 . A A . 7 ALA N 1 1
6 1704 1 1 8 ALA O O 12.138 -4.837 0.178 1.00 . A A . 7 ALA O 1 1
6 1705 1 1 9 LEU C C 9.927 -2.220 -0.161 1.00 . A A . 8 LEU C 1 1
6 1706 1 1 9 LEU CA C 9.870 -3.366 0.844 1.00 . A A . 8 LEU CA 1 1
6 1707 1 1 9 LEU CB C 8.688 -3.136 1.782 1.00 . A A . 8 LEU CB 1 1
6 1708 1 1 9 LEU CD1 C 7.500 -3.942 3.823 1.00 . A A . 8 LEU CD1 1 1
6 1709 1 1 9 LEU CD2 C 8.857 -5.550 2.455 1.00 . A A . 8 LEU CD2 1 1
6 1710 1 1 9 LEU CG C 8.759 -4.103 2.967 1.00 . A A . 8 LEU CG 1 1
6 1711 1 1 9 LEU H H 11.167 -2.954 2.458 1.00 . A A . 8 LEU H 1 1
6 1712 1 1 9 LEU HA H 9.713 -4.290 0.317 1.00 . A A . 8 LEU HA 1 1
6 1713 1 1 9 LEU HB2 H 8.721 -2.117 2.147 1.00 . A A . 8 LEU HB2 1 1
6 1714 1 1 9 LEU HB3 H 7.766 -3.296 1.245 1.00 . A A . 8 LEU HB3 1 1
6 1715 1 1 9 LEU HD11 H 6.654 -4.370 3.305 1.00 . A A . 8 LEU HD11 1 1
6 1716 1 1 9 LEU HD12 H 7.318 -2.893 4.001 1.00 . A A . 8 LEU HD12 1 1
6 1717 1 1 9 LEU HD13 H 7.638 -4.448 4.768 1.00 . A A . 8 LEU HD13 1 1
6 1718 1 1 9 LEU HD21 H 9.870 -5.751 2.137 1.00 . A A . 8 LEU HD21 1 1
6 1719 1 1 9 LEU HD22 H 8.184 -5.689 1.621 1.00 . A A . 8 LEU HD22 1 1
6 1720 1 1 9 LEU HD23 H 8.590 -6.234 3.249 1.00 . A A . 8 LEU HD23 1 1
6 1721 1 1 9 LEU HG H 9.628 -3.867 3.566 1.00 . A A . 8 LEU HG 1 1
6 1722 1 1 9 LEU N N 11.104 -3.450 1.621 1.00 . A A . 8 LEU N 1 1
6 1723 1 1 9 LEU O O 9.221 -2.235 -1.170 1.00 . A A . 8 LEU O 1 1
6 1724 1 1 10 ALA C C 12.272 0.566 -0.618 1.00 . A A . 9 ALA C 1 1
6 1725 1 1 10 ALA CA C 10.898 -0.074 -0.773 1.00 . A A . 9 ALA CA 1 1
6 1726 1 1 10 ALA CB C 9.814 0.957 -0.455 1.00 . A A . 9 ALA CB 1 1
6 1727 1 1 10 ALA H H 11.303 -1.259 0.932 1.00 . A A . 9 ALA H 1 1
6 1728 1 1 10 ALA HA H 10.778 -0.398 -1.793 1.00 . A A . 9 ALA HA 1 1
6 1729 1 1 10 ALA HB1 H 8.861 0.460 -0.361 1.00 . A A . 9 ALA HB1 1 1
6 1730 1 1 10 ALA HB2 H 9.764 1.685 -1.252 1.00 . A A . 9 ALA HB2 1 1
6 1731 1 1 10 ALA HB3 H 10.052 1.456 0.472 1.00 . A A . 9 ALA HB3 1 1
6 1732 1 1 10 ALA N N 10.765 -1.223 0.117 1.00 . A A . 9 ALA N 1 1
6 1733 1 1 10 ALA O O 12.384 1.760 -0.338 1.00 . A A . 9 ALA O 1 1
6 1734 1 1 11 PRO C C 15.054 1.260 -1.817 1.00 . A A . 10 PRO C 1 1
6 1735 1 1 11 PRO CA C 14.715 0.298 -0.673 1.00 . A A . 10 PRO CA 1 1
6 1736 1 1 11 PRO CB C 15.560 -0.987 -0.721 1.00 . A A . 10 PRO CB 1 1
6 1737 1 1 11 PRO CD C 13.274 -1.638 -1.131 1.00 . A A . 10 PRO CD 1 1
6 1738 1 1 11 PRO CG C 14.724 -1.963 -1.489 1.00 . A A . 10 PRO CG 1 1
6 1739 1 1 11 PRO HA H 14.859 0.784 0.277 1.00 . A A . 10 PRO HA 1 1
6 1740 1 1 11 PRO HB2 H 16.498 -0.804 -1.223 1.00 . A A . 10 PRO HB2 1 1
6 1741 1 1 11 PRO HB3 H 15.737 -1.366 0.276 1.00 . A A . 10 PRO HB3 1 1
6 1742 1 1 11 PRO HD2 H 12.626 -1.822 -1.979 1.00 . A A . 10 PRO HD2 1 1
6 1743 1 1 11 PRO HD3 H 12.953 -2.203 -0.274 1.00 . A A . 10 PRO HD3 1 1
6 1744 1 1 11 PRO HG2 H 14.892 -1.834 -2.556 1.00 . A A . 10 PRO HG2 1 1
6 1745 1 1 11 PRO HG3 H 14.948 -2.977 -1.196 1.00 . A A . 10 PRO HG3 1 1
6 1746 1 1 11 PRO N N 13.314 -0.204 -0.795 1.00 . A A . 10 PRO N 1 1
6 1747 1 1 11 PRO O O 14.324 1.344 -2.804 1.00 . A A . 10 PRO O 1 1
6 1748 1 1 12 ALA C C 16.930 2.208 -4.001 1.00 . A A . 11 ALA C 1 1
6 1749 1 1 12 ALA CA C 16.571 2.930 -2.704 1.00 . A A . 11 ALA CA 1 1
6 1750 1 1 12 ALA CB C 17.773 3.743 -2.230 1.00 . A A . 11 ALA CB 1 1
6 1751 1 1 12 ALA H H 16.704 1.878 -0.866 1.00 . A A . 11 ALA H 1 1
6 1752 1 1 12 ALA HA H 15.753 3.606 -2.892 1.00 . A A . 11 ALA HA 1 1
6 1753 1 1 12 ALA HB1 H 17.478 4.375 -1.404 1.00 . A A . 11 ALA HB1 1 1
6 1754 1 1 12 ALA HB2 H 18.131 4.357 -3.044 1.00 . A A . 11 ALA HB2 1 1
6 1755 1 1 12 ALA HB3 H 18.558 3.074 -1.911 1.00 . A A . 11 ALA HB3 1 1
6 1756 1 1 12 ALA N N 16.160 1.982 -1.674 1.00 . A A . 11 ALA N 1 1
6 1757 1 1 12 ALA O O 17.207 2.843 -5.018 1.00 . A A . 11 ALA O 1 1
6 1758 1 1 13 LEU C C 16.293 0.425 -6.288 1.00 . A A . 12 LEU C 1 1
6 1759 1 1 13 LEU CA C 17.267 0.112 -5.152 1.00 . A A . 12 LEU CA 1 1
6 1760 1 1 13 LEU CB C 17.240 -1.390 -4.843 1.00 . A A . 12 LEU CB 1 1
6 1761 1 1 13 LEU CD1 C 17.862 -3.085 -3.098 1.00 . A A . 12 LEU CD1 1 1
6 1762 1 1 13 LEU CD2 C 19.660 -1.752 -4.195 1.00 . A A . 12 LEU CD2 1 1
6 1763 1 1 13 LEU CG C 18.208 -1.716 -3.689 1.00 . A A . 12 LEU CG 1 1
6 1764 1 1 13 LEU H H 16.711 0.429 -3.123 1.00 . A A . 12 LEU H 1 1
6 1765 1 1 13 LEU HA H 18.258 0.383 -5.472 1.00 . A A . 12 LEU HA 1 1
6 1766 1 1 13 LEU HB2 H 16.234 -1.672 -4.561 1.00 . A A . 12 LEU HB2 1 1
6 1767 1 1 13 LEU HB3 H 17.529 -1.941 -5.723 1.00 . A A . 12 LEU HB3 1 1
6 1768 1 1 13 LEU HD11 H 18.641 -3.388 -2.414 1.00 . A A . 12 LEU HD11 1 1
6 1769 1 1 13 LEU HD12 H 17.782 -3.809 -3.895 1.00 . A A . 12 LEU HD12 1 1
6 1770 1 1 13 LEU HD13 H 16.922 -3.023 -2.571 1.00 . A A . 12 LEU HD13 1 1
6 1771 1 1 13 LEU HD21 H 19.724 -2.364 -5.082 1.00 . A A . 12 LEU HD21 1 1
6 1772 1 1 13 LEU HD22 H 20.293 -2.172 -3.427 1.00 . A A . 12 LEU HD22 1 1
6 1773 1 1 13 LEU HD23 H 19.993 -0.752 -4.421 1.00 . A A . 12 LEU HD23 1 1
6 1774 1 1 13 LEU HG H 18.109 -0.962 -2.919 1.00 . A A . 12 LEU HG 1 1
6 1775 1 1 13 LEU N N 16.931 0.884 -3.962 1.00 . A A . 12 LEU N 1 1
6 1776 1 1 13 LEU O O 16.709 0.864 -7.360 1.00 . A A . 12 LEU O 1 1
6 1777 1 1 14 ALA C C 14.063 1.924 -7.534 1.00 . A A . 13 ALA C 1 1
6 1778 1 1 14 ALA CA C 14.000 0.470 -7.089 1.00 . A A . 13 ALA CA 1 1
6 1779 1 1 14 ALA CB C 12.600 0.154 -6.559 1.00 . A A . 13 ALA CB 1 1
6 1780 1 1 14 ALA H H 14.711 -0.153 -5.192 1.00 . A A . 13 ALA H 1 1
6 1781 1 1 14 ALA HA H 14.196 -0.156 -7.941 1.00 . A A . 13 ALA HA 1 1
6 1782 1 1 14 ALA HB1 H 12.513 -0.908 -6.383 1.00 . A A . 13 ALA HB1 1 1
6 1783 1 1 14 ALA HB2 H 11.863 0.459 -7.287 1.00 . A A . 13 ALA HB2 1 1
6 1784 1 1 14 ALA HB3 H 12.435 0.688 -5.635 1.00 . A A . 13 ALA HB3 1 1
6 1785 1 1 14 ALA N N 15.003 0.201 -6.058 1.00 . A A . 13 ALA N 1 1
6 1786 1 1 14 ALA O O 13.640 2.264 -8.638 1.00 . A A . 13 ALA O 1 1
6 1787 1 1 15 LEU C C 15.917 4.416 -7.888 1.00 . A A . 14 LEU C 1 1
6 1788 1 1 15 LEU CA C 14.715 4.194 -6.980 1.00 . A A . 14 LEU CA 1 1
6 1789 1 1 15 LEU CB C 14.848 4.999 -5.671 1.00 . A A . 14 LEU CB 1 1
6 1790 1 1 15 LEU CD1 C 14.389 7.096 -6.958 1.00 . A A . 14 LEU CD1 1 1
6 1791 1 1 15 LEU CD2 C 15.255 7.234 -4.629 1.00 . A A . 14 LEU CD2 1 1
6 1792 1 1 15 LEU CG C 15.309 6.439 -5.937 1.00 . A A . 14 LEU CG 1 1
6 1793 1 1 15 LEU H H 14.916 2.446 -5.807 1.00 . A A . 14 LEU H 1 1
6 1794 1 1 15 LEU HA H 13.827 4.510 -7.504 1.00 . A A . 14 LEU HA 1 1
6 1795 1 1 15 LEU HB2 H 13.893 5.022 -5.171 1.00 . A A . 14 LEU HB2 1 1
6 1796 1 1 15 LEU HB3 H 15.565 4.513 -5.033 1.00 . A A . 14 LEU HB3 1 1
6 1797 1 1 15 LEU HD11 H 14.569 8.161 -6.973 1.00 . A A . 14 LEU HD11 1 1
6 1798 1 1 15 LEU HD12 H 13.359 6.907 -6.692 1.00 . A A . 14 LEU HD12 1 1
6 1799 1 1 15 LEU HD13 H 14.591 6.684 -7.929 1.00 . A A . 14 LEU HD13 1 1
6 1800 1 1 15 LEU HD21 H 15.787 6.694 -3.857 1.00 . A A . 14 LEU HD21 1 1
6 1801 1 1 15 LEU HD22 H 14.226 7.367 -4.329 1.00 . A A . 14 LEU HD22 1 1
6 1802 1 1 15 LEU HD23 H 15.716 8.200 -4.775 1.00 . A A . 14 LEU HD23 1 1
6 1803 1 1 15 LEU HG H 16.322 6.435 -6.313 1.00 . A A . 14 LEU HG 1 1
6 1804 1 1 15 LEU N N 14.595 2.777 -6.669 1.00 . A A . 14 LEU N 1 1
6 1805 1 1 15 LEU O O 15.787 4.967 -8.981 1.00 . A A . 14 LEU O 1 1
6 1806 1 1 16 ALA C C 18.138 3.398 -9.558 1.00 . A A . 15 ALA C 1 1
6 1807 1 1 16 ALA CA C 18.280 4.153 -8.245 1.00 . A A . 15 ALA CA 1 1
6 1808 1 1 16 ALA CB C 19.511 3.652 -7.489 1.00 . A A . 15 ALA CB 1 1
6 1809 1 1 16 ALA H H 17.143 3.544 -6.562 1.00 . A A . 15 ALA H 1 1
6 1810 1 1 16 ALA HA H 18.405 5.200 -8.460 1.00 . A A . 15 ALA HA 1 1
6 1811 1 1 16 ALA HB1 H 20.402 3.923 -8.035 1.00 . A A . 15 ALA HB1 1 1
6 1812 1 1 16 ALA HB2 H 19.460 2.578 -7.390 1.00 . A A . 15 ALA HB2 1 1
6 1813 1 1 16 ALA HB3 H 19.539 4.104 -6.508 1.00 . A A . 15 ALA HB3 1 1
6 1814 1 1 16 ALA N N 17.084 3.984 -7.439 1.00 . A A . 15 ALA N 1 1
6 1815 1 1 16 ALA O O 18.701 3.799 -10.577 1.00 . A A . 15 ALA O 1 1
6 1816 1 1 17 LEU C C 16.525 2.355 -11.812 1.00 . A A . 16 LEU C 1 1
6 1817 1 1 17 LEU CA C 17.195 1.513 -10.736 1.00 . A A . 16 LEU CA 1 1
6 1818 1 1 17 LEU CB C 16.330 0.276 -10.425 1.00 . A A . 16 LEU CB 1 1
6 1819 1 1 17 LEU CD1 C 16.319 -1.852 -9.083 1.00 . A A . 16 LEU CD1 1 1
6 1820 1 1 17 LEU CD2 C 17.844 -1.658 -11.062 1.00 . A A . 16 LEU CD2 1 1
6 1821 1 1 17 LEU CG C 17.198 -0.888 -9.890 1.00 . A A . 16 LEU CG 1 1
6 1822 1 1 17 LEU H H 16.964 2.023 -8.691 1.00 . A A . 16 LEU H 1 1
6 1823 1 1 17 LEU HA H 18.151 1.194 -11.098 1.00 . A A . 16 LEU HA 1 1
6 1824 1 1 17 LEU HB2 H 15.601 0.553 -9.677 1.00 . A A . 16 LEU HB2 1 1
6 1825 1 1 17 LEU HB3 H 15.806 -0.049 -11.315 1.00 . A A . 16 LEU HB3 1 1
6 1826 1 1 17 LEU HD11 H 15.375 -1.991 -9.593 1.00 . A A . 16 LEU HD11 1 1
6 1827 1 1 17 LEU HD12 H 16.140 -1.430 -8.110 1.00 . A A . 16 LEU HD12 1 1
6 1828 1 1 17 LEU HD13 H 16.817 -2.805 -8.975 1.00 . A A . 16 LEU HD13 1 1
6 1829 1 1 17 LEU HD21 H 18.599 -1.046 -11.529 1.00 . A A . 16 LEU HD21 1 1
6 1830 1 1 17 LEU HD22 H 17.092 -1.921 -11.790 1.00 . A A . 16 LEU HD22 1 1
6 1831 1 1 17 LEU HD23 H 18.302 -2.561 -10.684 1.00 . A A . 16 LEU HD23 1 1
6 1832 1 1 17 LEU HG H 17.969 -0.489 -9.245 1.00 . A A . 16 LEU HG 1 1
6 1833 1 1 17 LEU N N 17.387 2.300 -9.532 1.00 . A A . 16 LEU N 1 1
6 1834 1 1 17 LEU O O 17.046 2.483 -12.919 1.00 . A A . 16 LEU O 1 1
6 1835 1 1 18 TRP C C 15.361 5.090 -12.670 1.00 . A A . 17 TRP C 1 1
6 1836 1 1 18 TRP CA C 14.656 3.731 -12.471 1.00 . A A . 17 TRP CA 1 1
6 1837 1 1 18 TRP CB C 13.173 3.857 -12.017 1.00 . A A . 17 TRP CB 1 1
6 1838 1 1 18 TRP CD1 C 11.810 5.350 -13.562 1.00 . A A . 17 TRP CD1 1 1
6 1839 1 1 18 TRP CD2 C 12.698 6.418 -11.810 1.00 . A A . 17 TRP CD2 1 1
6 1840 1 1 18 TRP CE2 C 11.993 7.390 -12.544 1.00 . A A . 17 TRP CE2 1 1
6 1841 1 1 18 TRP CE3 C 13.362 6.802 -10.651 1.00 . A A . 17 TRP CE3 1 1
6 1842 1 1 18 TRP CG C 12.572 5.149 -12.463 1.00 . A A . 17 TRP CG 1 1
6 1843 1 1 18 TRP CH2 C 12.626 9.090 -10.959 1.00 . A A . 17 TRP CH2 1 1
6 1844 1 1 18 TRP CZ2 C 11.952 8.719 -12.129 1.00 . A A . 17 TRP CZ2 1 1
6 1845 1 1 18 TRP CZ3 C 13.330 8.119 -10.226 1.00 . A A . 17 TRP CZ3 1 1
6 1846 1 1 18 TRP H H 14.968 2.789 -10.596 1.00 . A A . 17 TRP H 1 1
6 1847 1 1 18 TRP HA H 14.677 3.210 -13.421 1.00 . A A . 17 TRP HA 1 1
6 1848 1 1 18 TRP HB2 H 12.592 3.040 -12.425 1.00 . A A . 17 TRP HB2 1 1
6 1849 1 1 18 TRP HB3 H 13.139 3.804 -10.934 1.00 . A A . 17 TRP HB3 1 1
6 1850 1 1 18 TRP HD1 H 11.523 4.593 -14.277 1.00 . A A . 17 TRP HD1 1 1
6 1851 1 1 18 TRP HE1 H 10.914 7.115 -14.303 1.00 . A A . 17 TRP HE1 1 1
6 1852 1 1 18 TRP HE3 H 13.903 6.067 -10.077 1.00 . A A . 17 TRP HE3 1 1
6 1853 1 1 18 TRP HH2 H 12.605 10.116 -10.622 1.00 . A A . 17 TRP HH2 1 1
6 1854 1 1 18 TRP HZ2 H 11.405 9.451 -12.705 1.00 . A A . 17 TRP HZ2 1 1
6 1855 1 1 18 TRP HZ3 H 13.852 8.380 -9.332 1.00 . A A . 17 TRP HZ3 1 1
6 1856 1 1 18 TRP N N 15.369 2.920 -11.494 1.00 . A A . 17 TRP N 1 1
6 1857 1 1 18 TRP NE1 N 11.463 6.693 -13.611 1.00 . A A . 17 TRP NE1 1 1
6 1858 1 1 18 TRP O O 15.567 5.518 -13.807 1.00 . A A . 17 TRP O 1 1
6 1859 1 1 19 TRP C C 17.614 6.933 -12.614 1.00 . A A . 18 TRP C 1 1
6 1860 1 1 19 TRP CA C 16.401 7.055 -11.703 1.00 . A A . 18 TRP CA 1 1
6 1861 1 1 19 TRP CB C 16.869 7.514 -10.329 1.00 . A A . 18 TRP CB 1 1
6 1862 1 1 19 TRP CD1 C 17.060 9.921 -10.992 1.00 . A A . 18 TRP CD1 1 1
6 1863 1 1 19 TRP CD2 C 18.915 9.155 -10.001 1.00 . A A . 18 TRP CD2 1 1
6 1864 1 1 19 TRP CE2 C 19.165 10.509 -10.317 1.00 . A A . 18 TRP CE2 1 1
6 1865 1 1 19 TRP CE3 C 19.926 8.421 -9.364 1.00 . A A . 18 TRP CE3 1 1
6 1866 1 1 19 TRP CG C 17.576 8.816 -10.442 1.00 . A A . 18 TRP CG 1 1
6 1867 1 1 19 TRP CH2 C 21.381 10.371 -9.374 1.00 . A A . 18 TRP CH2 1 1
6 1868 1 1 19 TRP CZ2 C 20.383 11.117 -10.009 1.00 . A A . 18 TRP CZ2 1 1
6 1869 1 1 19 TRP CZ3 C 21.150 9.024 -9.052 1.00 . A A . 18 TRP CZ3 1 1
6 1870 1 1 19 TRP H H 15.553 5.397 -10.688 1.00 . A A . 18 TRP H 1 1
6 1871 1 1 19 TRP HA H 15.717 7.784 -12.105 1.00 . A A . 18 TRP HA 1 1
6 1872 1 1 19 TRP HB2 H 16.030 7.617 -9.673 1.00 . A A . 18 TRP HB2 1 1
6 1873 1 1 19 TRP HB3 H 17.541 6.789 -9.934 1.00 . A A . 18 TRP HB3 1 1
6 1874 1 1 19 TRP HD1 H 16.079 9.992 -11.413 1.00 . A A . 18 TRP HD1 1 1
6 1875 1 1 19 TRP HE1 H 17.872 11.850 -11.257 1.00 . A A . 18 TRP HE1 1 1
6 1876 1 1 19 TRP HE3 H 19.760 7.384 -9.112 1.00 . A A . 18 TRP HE3 1 1
6 1877 1 1 19 TRP HH2 H 22.328 10.830 -9.130 1.00 . A A . 18 TRP HH2 1 1
6 1878 1 1 19 TRP HZ2 H 20.554 12.153 -10.260 1.00 . A A . 18 TRP HZ2 1 1
6 1879 1 1 19 TRP HZ3 H 21.916 8.446 -8.562 1.00 . A A . 18 TRP HZ3 1 1
6 1880 1 1 19 TRP N N 15.730 5.765 -11.582 1.00 . A A . 18 TRP N 1 1
6 1881 1 1 19 TRP NE1 N 17.999 10.938 -10.924 1.00 . A A . 18 TRP NE1 1 1
6 1882 1 1 19 TRP O O 17.760 7.672 -13.589 1.00 . A A . 18 TRP O 1 1
6 1883 1 1 20 ALA C C 19.367 4.984 -14.328 1.00 . A A . 19 ALA C 1 1
6 1884 1 1 20 ALA CA C 19.687 5.754 -13.052 1.00 . A A . 19 ALA CA 1 1
6 1885 1 1 20 ALA CB C 20.701 4.972 -12.212 1.00 . A A . 19 ALA CB 1 1
6 1886 1 1 20 ALA H H 18.297 5.440 -11.486 1.00 . A A . 19 ALA H 1 1
6 1887 1 1 20 ALA HA H 20.118 6.701 -13.316 1.00 . A A . 19 ALA HA 1 1
6 1888 1 1 20 ALA HB1 H 21.685 5.081 -12.642 1.00 . A A . 19 ALA HB1 1 1
6 1889 1 1 20 ALA HB2 H 20.430 3.926 -12.195 1.00 . A A . 19 ALA HB2 1 1
6 1890 1 1 20 ALA HB3 H 20.706 5.358 -11.203 1.00 . A A . 19 ALA HB3 1 1
6 1891 1 1 20 ALA N N 18.478 5.988 -12.276 1.00 . A A . 19 ALA N 1 1
6 1892 1 1 20 ALA O O 19.446 5.526 -15.431 1.00 . A A . 19 ALA O 1 1
6 1893 1 1 21 ETA CA C 18.670 2.867 -15.310 1.00 . A A . 20 ETA CA 1 1
6 1894 1 1 21 ETA CB C 18.913 1.395 -14.967 1.00 . A A . 20 ETA CB 1 1
6 1895 1 1 21 ETA HA1 H 19.287 3.136 -16.155 1.00 . A A . 20 ETA HA1 1 1
6 1896 1 1 21 ETA HA2 H 17.628 3.010 -15.564 1.00 . A A . 20 ETA HA2 1 1
6 1897 1 1 21 ETA HB1 H 19.047 0.828 -15.883 1.00 . A A . 20 ETA HB1 1 1
6 1898 1 1 21 ETA HB2 H 18.070 1.001 -14.431 1.00 . A A . 20 ETA HB2 1 1
6 1899 1 1 21 ETA HN2 H 18.961 3.345 -13.262 1.00 . A A . 20 ETA HN2 1 1
6 1900 1 1 21 ETA HO H 19.792 1.378 -13.229 1.00 . A A . 20 ETA HO 1 1
6 1901 1 1 21 ETA N N 19.004 3.717 -14.166 1.00 . A A . 20 ETA N 1 1
6 1902 1 1 21 ETA O O 20.071 1.295 -14.145 1.00 . A A . 20 ETA O 1 1
7 1903 1 1 1 ACE C C 15.124 -6.361 13.630 1.00 . A A . 0 ACE C 1 1
7 1904 1 1 1 ACE CH3 C 16.334 -6.892 12.874 1.00 . A A . 0 ACE CH3 1 1
7 1905 1 1 1 ACE H1 H 16.015 -7.307 11.930 1.00 . A A . 0 ACE H1 1 1
7 1906 1 1 1 ACE H2 H 16.815 -7.661 13.460 1.00 . A A . 0 ACE H2 1 1
7 1907 1 1 1 ACE H3 H 17.030 -6.086 12.700 1.00 . A A . 0 ACE H3 1 1
7 1908 1 1 1 ACE O O 14.821 -6.814 14.734 1.00 . A A . 0 ACE O 1 1
7 1909 1 1 2 GLY C C 12.328 -4.226 12.605 1.00 . A A . 1 GLY C 1 1
7 1910 1 1 2 GLY CA C 13.261 -4.803 13.648 1.00 . A A . 1 GLY CA 1 1
7 1911 1 1 2 GLY H H 14.705 -5.062 12.159 1.00 . A A . 1 GLY H 1 1
7 1912 1 1 2 GLY HA2 H 12.732 -5.548 14.215 1.00 . A A . 1 GLY HA2 1 1
7 1913 1 1 2 GLY HA3 H 13.573 -4.007 14.308 1.00 . A A . 1 GLY HA3 1 1
7 1914 1 1 2 GLY N N 14.429 -5.391 13.031 1.00 . A A . 1 GLY N 1 1
7 1915 1 1 2 GLY O O 11.981 -4.869 11.616 1.00 . A A . 1 GLY O 1 1
7 1916 1 1 3 TRP C C 11.690 -2.052 10.607 1.00 . A A . 2 TRP C 1 1
7 1917 1 1 3 TRP CA C 11.030 -2.286 11.981 1.00 . A A . 2 TRP CA 1 1
7 1918 1 1 3 TRP CB C 10.596 -0.961 12.696 1.00 . A A . 2 TRP CB 1 1
7 1919 1 1 3 TRP CD1 C 11.839 1.072 11.951 1.00 . A A . 2 TRP CD1 1 1
7 1920 1 1 3 TRP CD2 C 9.985 0.729 10.735 1.00 . A A . 2 TRP CD2 1 1
7 1921 1 1 3 TRP CE2 C 10.591 1.894 10.218 1.00 . A A . 2 TRP CE2 1 1
7 1922 1 1 3 TRP CE3 C 8.787 0.282 10.146 1.00 . A A . 2 TRP CE3 1 1
7 1923 1 1 3 TRP CG C 10.803 0.238 11.832 1.00 . A A . 2 TRP CG 1 1
7 1924 1 1 3 TRP CH2 C 8.840 2.139 8.574 1.00 . A A . 2 TRP CH2 1 1
7 1925 1 1 3 TRP CZ2 C 10.031 2.595 9.150 1.00 . A A . 2 TRP CZ2 1 1
7 1926 1 1 3 TRP CZ3 C 8.220 0.985 9.071 1.00 . A A . 2 TRP CZ3 1 1
7 1927 1 1 3 TRP H H 12.262 -2.590 13.673 1.00 . A A . 2 TRP H 1 1
7 1928 1 1 3 TRP HA H 10.154 -2.899 11.829 1.00 . A A . 2 TRP HA 1 1
7 1929 1 1 3 TRP HB2 H 9.556 -1.003 12.972 1.00 . A A . 2 TRP HB2 1 1
7 1930 1 1 3 TRP HB3 H 11.185 -0.852 13.595 1.00 . A A . 2 TRP HB3 1 1
7 1931 1 1 3 TRP HD1 H 12.627 0.970 12.680 1.00 . A A . 2 TRP HD1 1 1
7 1932 1 1 3 TRP HE1 H 12.352 2.806 10.862 1.00 . A A . 2 TRP HE1 1 1
7 1933 1 1 3 TRP HE3 H 8.302 -0.606 10.522 1.00 . A A . 2 TRP HE3 1 1
7 1934 1 1 3 TRP HH2 H 8.399 2.676 7.746 1.00 . A A . 2 TRP HH2 1 1
7 1935 1 1 3 TRP HZ2 H 10.513 3.480 8.772 1.00 . A A . 2 TRP HZ2 1 1
7 1936 1 1 3 TRP HZ3 H 7.301 0.635 8.625 1.00 . A A . 2 TRP HZ3 1 1
7 1937 1 1 3 TRP N N 11.933 -3.009 12.859 1.00 . A A . 2 TRP N 1 1
7 1938 1 1 3 TRP NE1 N 11.724 2.066 10.992 1.00 . A A . 2 TRP NE1 1 1
7 1939 1 1 3 TRP O O 11.004 -2.013 9.586 1.00 . A A . 2 TRP O 1 1
7 1940 1 1 4 TRP C C 13.385 -2.679 8.255 1.00 . A A . 3 TRP C 1 1
7 1941 1 1 4 TRP CA C 13.742 -1.656 9.341 1.00 . A A . 3 TRP CA 1 1
7 1942 1 1 4 TRP CB C 15.266 -1.654 9.645 1.00 . A A . 3 TRP CB 1 1
7 1943 1 1 4 TRP CD1 C 15.949 -3.842 10.663 1.00 . A A . 3 TRP CD1 1 1
7 1944 1 1 4 TRP CD2 C 16.360 -3.764 8.461 1.00 . A A . 3 TRP CD2 1 1
7 1945 1 1 4 TRP CE2 C 16.784 -5.035 8.905 1.00 . A A . 3 TRP CE2 1 1
7 1946 1 1 4 TRP CE3 C 16.509 -3.453 7.099 1.00 . A A . 3 TRP CE3 1 1
7 1947 1 1 4 TRP CG C 15.833 -3.034 9.602 1.00 . A A . 3 TRP CG 1 1
7 1948 1 1 4 TRP CH2 C 17.476 -5.643 6.681 1.00 . A A . 3 TRP CH2 1 1
7 1949 1 1 4 TRP CZ2 C 17.335 -5.966 8.033 1.00 . A A . 3 TRP CZ2 1 1
7 1950 1 1 4 TRP CZ3 C 17.064 -4.386 6.215 1.00 . A A . 3 TRP CZ3 1 1
7 1951 1 1 4 TRP H H 13.539 -1.923 11.412 1.00 . A A . 3 TRP H 1 1
7 1952 1 1 4 TRP HA H 13.476 -0.679 8.966 1.00 . A A . 3 TRP HA 1 1
7 1953 1 1 4 TRP HB2 H 15.782 -1.053 8.925 1.00 . A A . 3 TRP HB2 1 1
7 1954 1 1 4 TRP HB3 H 15.425 -1.238 10.630 1.00 . A A . 3 TRP HB3 1 1
7 1955 1 1 4 TRP HD1 H 15.647 -3.592 11.663 1.00 . A A . 3 TRP HD1 1 1
7 1956 1 1 4 TRP HE1 H 16.705 -5.801 10.834 1.00 . A A . 3 TRP HE1 1 1
7 1957 1 1 4 TRP HE3 H 16.195 -2.491 6.732 1.00 . A A . 3 TRP HE3 1 1
7 1958 1 1 4 TRP HH2 H 17.903 -6.358 5.998 1.00 . A A . 3 TRP HH2 1 1
7 1959 1 1 4 TRP HZ2 H 17.651 -6.931 8.400 1.00 . A A . 3 TRP HZ2 1 1
7 1960 1 1 4 TRP HZ3 H 17.172 -4.135 5.169 1.00 . A A . 3 TRP HZ3 1 1
7 1961 1 1 4 TRP N N 13.012 -1.891 10.587 1.00 . A A . 3 TRP N 1 1
7 1962 1 1 4 TRP NE1 N 16.513 -5.036 10.256 1.00 . A A . 3 TRP NE1 1 1
7 1963 1 1 4 TRP O O 13.907 -2.618 7.153 1.00 . A A . 3 TRP O 1 1
7 1964 1 1 5 LEU C C 11.232 -3.986 6.491 1.00 . A A . 4 LEU C 1 1
7 1965 1 1 5 LEU CA C 12.124 -4.608 7.560 1.00 . A A . 4 LEU CA 1 1
7 1966 1 1 5 LEU CB C 11.398 -5.765 8.237 1.00 . A A . 4 LEU CB 1 1
7 1967 1 1 5 LEU CD1 C 11.639 -7.437 10.106 1.00 . A A . 4 LEU CD1 1 1
7 1968 1 1 5 LEU CD2 C 13.170 -7.591 8.135 1.00 . A A . 4 LEU CD2 1 1
7 1969 1 1 5 LEU CG C 12.396 -6.619 9.056 1.00 . A A . 4 LEU CG 1 1
7 1970 1 1 5 LEU H H 12.085 -3.652 9.429 1.00 . A A . 4 LEU H 1 1
7 1971 1 1 5 LEU HA H 13.011 -4.979 7.088 1.00 . A A . 4 LEU HA 1 1
7 1972 1 1 5 LEU HB2 H 10.642 -5.351 8.891 1.00 . A A . 4 LEU HB2 1 1
7 1973 1 1 5 LEU HB3 H 10.921 -6.376 7.490 1.00 . A A . 4 LEU HB3 1 1
7 1974 1 1 5 LEU HD11 H 11.032 -8.179 9.613 1.00 . A A . 4 LEU HD11 1 1
7 1975 1 1 5 LEU HD12 H 11.006 -6.787 10.689 1.00 . A A . 4 LEU HD12 1 1
7 1976 1 1 5 LEU HD13 H 12.348 -7.927 10.756 1.00 . A A . 4 LEU HD13 1 1
7 1977 1 1 5 LEU HD21 H 12.488 -8.076 7.451 1.00 . A A . 4 LEU HD21 1 1
7 1978 1 1 5 LEU HD22 H 13.658 -8.344 8.736 1.00 . A A . 4 LEU HD22 1 1
7 1979 1 1 5 LEU HD23 H 13.918 -7.051 7.578 1.00 . A A . 4 LEU HD23 1 1
7 1980 1 1 5 LEU HG H 13.096 -5.965 9.561 1.00 . A A . 4 LEU HG 1 1
7 1981 1 1 5 LEU N N 12.503 -3.616 8.550 1.00 . A A . 4 LEU N 1 1
7 1982 1 1 5 LEU O O 11.120 -4.509 5.382 1.00 . A A . 4 LEU O 1 1
7 1983 1 1 6 ALA C C 10.538 -1.500 4.786 1.00 . A A . 5 ALA C 1 1
7 1984 1 1 6 ALA CA C 9.724 -2.185 5.879 1.00 . A A . 5 ALA CA 1 1
7 1985 1 1 6 ALA CB C 8.888 -1.135 6.610 1.00 . A A . 5 ALA CB 1 1
7 1986 1 1 6 ALA H H 10.720 -2.479 7.714 1.00 . A A . 5 ALA H 1 1
7 1987 1 1 6 ALA HA H 9.060 -2.904 5.432 1.00 . A A . 5 ALA HA 1 1
7 1988 1 1 6 ALA HB1 H 9.527 -0.317 6.920 1.00 . A A . 5 ALA HB1 1 1
7 1989 1 1 6 ALA HB2 H 8.428 -1.580 7.480 1.00 . A A . 5 ALA HB2 1 1
7 1990 1 1 6 ALA HB3 H 8.121 -0.760 5.948 1.00 . A A . 5 ALA HB3 1 1
7 1991 1 1 6 ALA N N 10.601 -2.867 6.825 1.00 . A A . 5 ALA N 1 1
7 1992 1 1 6 ALA O O 9.997 -1.084 3.761 1.00 . A A . 5 ALA O 1 1
7 1993 1 1 7 LEU C C 13.046 -1.693 2.903 1.00 . A A . 6 LEU C 1 1
7 1994 1 1 7 LEU CA C 12.723 -0.741 4.044 1.00 . A A . 6 LEU CA 1 1
7 1995 1 1 7 LEU CB C 14.020 -0.327 4.744 1.00 . A A . 6 LEU CB 1 1
7 1996 1 1 7 LEU CD1 C 14.884 1.104 6.620 1.00 . A A . 6 LEU CD1 1 1
7 1997 1 1 7 LEU CD2 C 14.009 2.194 4.561 1.00 . A A . 6 LEU CD2 1 1
7 1998 1 1 7 LEU CG C 13.837 0.997 5.511 1.00 . A A . 6 LEU CG 1 1
7 1999 1 1 7 LEU H H 12.219 -1.725 5.846 1.00 . A A . 6 LEU H 1 1
7 2000 1 1 7 LEU HA H 12.244 0.126 3.654 1.00 . A A . 6 LEU HA 1 1
7 2001 1 1 7 LEU HB2 H 14.275 -1.109 5.430 1.00 . A A . 6 LEU HB2 1 1
7 2002 1 1 7 LEU HB3 H 14.815 -0.217 4.026 1.00 . A A . 6 LEU HB3 1 1
7 2003 1 1 7 LEU HD11 H 15.872 1.128 6.184 1.00 . A A . 6 LEU HD11 1 1
7 2004 1 1 7 LEU HD12 H 14.799 0.250 7.269 1.00 . A A . 6 LEU HD12 1 1
7 2005 1 1 7 LEU HD13 H 14.718 2.008 7.187 1.00 . A A . 6 LEU HD13 1 1
7 2006 1 1 7 LEU HD21 H 14.011 3.105 5.137 1.00 . A A . 6 LEU HD21 1 1
7 2007 1 1 7 LEU HD22 H 13.196 2.222 3.856 1.00 . A A . 6 LEU HD22 1 1
7 2008 1 1 7 LEU HD23 H 14.944 2.106 4.030 1.00 . A A . 6 LEU HD23 1 1
7 2009 1 1 7 LEU HG H 12.855 1.018 5.947 1.00 . A A . 6 LEU HG 1 1
7 2010 1 1 7 LEU N N 11.841 -1.380 5.012 1.00 . A A . 6 LEU N 1 1
7 2011 1 1 7 LEU O O 13.410 -1.266 1.808 1.00 . A A . 6 LEU O 1 1
7 2012 1 1 8 ALA C C 12.055 -4.089 1.152 1.00 . A A . 7 ALA C 1 1
7 2013 1 1 8 ALA CA C 13.192 -3.994 2.165 1.00 . A A . 7 ALA CA 1 1
7 2014 1 1 8 ALA CB C 13.387 -5.350 2.840 1.00 . A A . 7 ALA CB 1 1
7 2015 1 1 8 ALA H H 12.616 -3.256 4.062 1.00 . A A . 7 ALA H 1 1
7 2016 1 1 8 ALA HA H 14.100 -3.732 1.652 1.00 . A A . 7 ALA HA 1 1
7 2017 1 1 8 ALA HB1 H 12.489 -5.614 3.378 1.00 . A A . 7 ALA HB1 1 1
7 2018 1 1 8 ALA HB2 H 14.216 -5.293 3.531 1.00 . A A . 7 ALA HB2 1 1
7 2019 1 1 8 ALA HB3 H 13.592 -6.100 2.091 1.00 . A A . 7 ALA HB3 1 1
7 2020 1 1 8 ALA N N 12.911 -2.978 3.171 1.00 . A A . 7 ALA N 1 1
7 2021 1 1 8 ALA O O 12.186 -4.745 0.119 1.00 . A A . 7 ALA O 1 1
7 2022 1 1 9 LEU C C 9.880 -2.346 -0.486 1.00 . A A . 8 LEU C 1 1
7 2023 1 1 9 LEU CA C 9.775 -3.445 0.570 1.00 . A A . 8 LEU CA 1 1
7 2024 1 1 9 LEU CB C 8.500 -3.229 1.391 1.00 . A A . 8 LEU CB 1 1
7 2025 1 1 9 LEU CD1 C 9.315 -4.944 3.038 1.00 . A A . 8 LEU CD1 1 1
7 2026 1 1 9 LEU CD2 C 6.914 -4.227 3.033 1.00 . A A . 8 LEU CD2 1 1
7 2027 1 1 9 LEU CG C 8.139 -4.506 2.157 1.00 . A A . 8 LEU CG 1 1
7 2028 1 1 9 LEU H H 10.893 -2.929 2.290 1.00 . A A . 8 LEU H 1 1
7 2029 1 1 9 LEU HA H 9.712 -4.400 0.081 1.00 . A A . 8 LEU HA 1 1
7 2030 1 1 9 LEU HB2 H 8.665 -2.423 2.090 1.00 . A A . 8 LEU HB2 1 1
7 2031 1 1 9 LEU HB3 H 7.682 -2.968 0.733 1.00 . A A . 8 LEU HB3 1 1
7 2032 1 1 9 LEU HD11 H 10.054 -5.442 2.430 1.00 . A A . 8 LEU HD11 1 1
7 2033 1 1 9 LEU HD12 H 8.963 -5.625 3.802 1.00 . A A . 8 LEU HD12 1 1
7 2034 1 1 9 LEU HD13 H 9.758 -4.079 3.508 1.00 . A A . 8 LEU HD13 1 1
7 2035 1 1 9 LEU HD21 H 6.146 -3.755 2.439 1.00 . A A . 8 LEU HD21 1 1
7 2036 1 1 9 LEU HD22 H 7.196 -3.571 3.844 1.00 . A A . 8 LEU HD22 1 1
7 2037 1 1 9 LEU HD23 H 6.540 -5.156 3.436 1.00 . A A . 8 LEU HD23 1 1
7 2038 1 1 9 LEU HG H 7.908 -5.292 1.453 1.00 . A A . 8 LEU HG 1 1
7 2039 1 1 9 LEU N N 10.938 -3.432 1.455 1.00 . A A . 8 LEU N 1 1
7 2040 1 1 9 LEU O O 9.291 -2.449 -1.560 1.00 . A A . 8 LEU O 1 1
7 2041 1 1 10 ALA C C 12.070 0.588 -0.799 1.00 . A A . 9 ALA C 1 1
7 2042 1 1 10 ALA CA C 10.793 -0.181 -1.105 1.00 . A A . 9 ALA CA 1 1
7 2043 1 1 10 ALA CB C 9.593 0.758 -1.011 1.00 . A A . 9 ALA CB 1 1
7 2044 1 1 10 ALA H H 11.074 -1.258 0.697 1.00 . A A . 9 ALA H 1 1
7 2045 1 1 10 ALA HA H 10.850 -0.567 -2.108 1.00 . A A . 9 ALA HA 1 1
7 2046 1 1 10 ALA HB1 H 9.627 1.292 -0.072 1.00 . A A . 9 ALA HB1 1 1
7 2047 1 1 10 ALA HB2 H 8.683 0.182 -1.066 1.00 . A A . 9 ALA HB2 1 1
7 2048 1 1 10 ALA HB3 H 9.624 1.463 -1.828 1.00 . A A . 9 ALA HB3 1 1
7 2049 1 1 10 ALA N N 10.629 -1.292 -0.173 1.00 . A A . 9 ALA N 1 1
7 2050 1 1 10 ALA O O 12.033 1.790 -0.536 1.00 . A A . 9 ALA O 1 1
7 2051 1 1 11 PRO C C 14.967 1.453 -1.700 1.00 . A A . 10 PRO C 1 1
7 2052 1 1 11 PRO CA C 14.516 0.547 -0.548 1.00 . A A . 10 PRO CA 1 1
7 2053 1 1 11 PRO CB C 15.441 -0.664 -0.370 1.00 . A A . 10 PRO CB 1 1
7 2054 1 1 11 PRO CD C 13.324 -1.522 -1.136 1.00 . A A . 10 PRO CD 1 1
7 2055 1 1 11 PRO CG C 14.835 -1.725 -1.231 1.00 . A A . 10 PRO CG 1 1
7 2056 1 1 11 PRO HA H 14.483 1.104 0.372 1.00 . A A . 10 PRO HA 1 1
7 2057 1 1 11 PRO HB2 H 16.443 -0.426 -0.698 1.00 . A A . 10 PRO HB2 1 1
7 2058 1 1 11 PRO HB3 H 15.448 -0.992 0.659 1.00 . A A . 10 PRO HB3 1 1
7 2059 1 1 11 PRO HD2 H 12.851 -1.767 -2.079 1.00 . A A . 10 PRO HD2 1 1
7 2060 1 1 11 PRO HD3 H 12.904 -2.106 -0.333 1.00 . A A . 10 PRO HD3 1 1
7 2061 1 1 11 PRO HG2 H 15.172 -1.603 -2.259 1.00 . A A . 10 PRO HG2 1 1
7 2062 1 1 11 PRO HG3 H 15.090 -2.708 -0.869 1.00 . A A . 10 PRO HG3 1 1
7 2063 1 1 11 PRO N N 13.190 -0.082 -0.829 1.00 . A A . 10 PRO N 1 1
7 2064 1 1 11 PRO O O 14.230 1.654 -2.666 1.00 . A A . 10 PRO O 1 1
7 2065 1 1 12 ALA C C 16.963 2.109 -3.917 1.00 . A A . 11 ALA C 1 1
7 2066 1 1 12 ALA CA C 16.705 2.879 -2.623 1.00 . A A . 11 ALA CA 1 1
7 2067 1 1 12 ALA CB C 18.011 3.538 -2.161 1.00 . A A . 11 ALA CB 1 1
7 2068 1 1 12 ALA H H 16.718 1.803 -0.790 1.00 . A A . 11 ALA H 1 1
7 2069 1 1 12 ALA HA H 15.981 3.653 -2.815 1.00 . A A . 11 ALA HA 1 1
7 2070 1 1 12 ALA HB1 H 18.660 2.789 -1.734 1.00 . A A . 11 ALA HB1 1 1
7 2071 1 1 12 ALA HB2 H 17.791 4.290 -1.417 1.00 . A A . 11 ALA HB2 1 1
7 2072 1 1 12 ALA HB3 H 18.502 4.001 -3.008 1.00 . A A . 11 ALA HB3 1 1
7 2073 1 1 12 ALA N N 16.178 1.997 -1.586 1.00 . A A . 11 ALA N 1 1
7 2074 1 1 12 ALA O O 17.303 2.700 -4.942 1.00 . A A . 11 ALA O 1 1
7 2075 1 1 13 LEU C C 16.080 0.387 -6.180 1.00 . A A . 12 LEU C 1 1
7 2076 1 1 13 LEU CA C 17.037 -0.016 -5.061 1.00 . A A . 12 LEU CA 1 1
7 2077 1 1 13 LEU CB C 16.859 -1.500 -4.736 1.00 . A A . 12 LEU CB 1 1
7 2078 1 1 13 LEU CD1 C 17.390 -3.320 -3.103 1.00 . A A . 12 LEU CD1 1 1
7 2079 1 1 13 LEU CD2 C 19.202 -1.735 -3.836 1.00 . A A . 12 LEU CD2 1 1
7 2080 1 1 13 LEU CG C 17.699 -1.873 -3.508 1.00 . A A . 12 LEU CG 1 1
7 2081 1 1 13 LEU H H 16.540 0.366 -3.030 1.00 . A A . 12 LEU H 1 1
7 2082 1 1 13 LEU HA H 18.047 0.144 -5.400 1.00 . A A . 12 LEU HA 1 1
7 2083 1 1 13 LEU HB2 H 15.815 -1.695 -4.532 1.00 . A A . 12 LEU HB2 1 1
7 2084 1 1 13 LEU HB3 H 17.176 -2.093 -5.580 1.00 . A A . 12 LEU HB3 1 1
7 2085 1 1 13 LEU HD11 H 17.843 -3.997 -3.810 1.00 . A A . 12 LEU HD11 1 1
7 2086 1 1 13 LEU HD12 H 16.321 -3.472 -3.095 1.00 . A A . 12 LEU HD12 1 1
7 2087 1 1 13 LEU HD13 H 17.786 -3.511 -2.116 1.00 . A A . 12 LEU HD13 1 1
7 2088 1 1 13 LEU HD21 H 19.782 -2.309 -3.126 1.00 . A A . 12 LEU HD21 1 1
7 2089 1 1 13 LEU HD22 H 19.492 -0.698 -3.772 1.00 . A A . 12 LEU HD22 1 1
7 2090 1 1 13 LEU HD23 H 19.395 -2.101 -4.835 1.00 . A A . 12 LEU HD23 1 1
7 2091 1 1 13 LEU HG H 17.443 -1.213 -2.691 1.00 . A A . 12 LEU HG 1 1
7 2092 1 1 13 LEU N N 16.807 0.793 -3.871 1.00 . A A . 12 LEU N 1 1
7 2093 1 1 13 LEU O O 16.510 0.789 -7.255 1.00 . A A . 12 LEU O 1 1
7 2094 1 1 14 ALA C C 14.025 2.093 -7.423 1.00 . A A . 13 ALA C 1 1
7 2095 1 1 14 ALA CA C 13.816 0.651 -6.971 1.00 . A A . 13 ALA CA 1 1
7 2096 1 1 14 ALA CB C 12.389 0.471 -6.454 1.00 . A A . 13 ALA CB 1 1
7 2097 1 1 14 ALA H H 14.465 -0.044 -5.072 1.00 . A A . 13 ALA H 1 1
7 2098 1 1 14 ALA HA H 13.961 0.004 -7.823 1.00 . A A . 13 ALA HA 1 1
7 2099 1 1 14 ALA HB1 H 12.179 1.222 -5.707 1.00 . A A . 13 ALA HB1 1 1
7 2100 1 1 14 ALA HB2 H 12.287 -0.511 -6.017 1.00 . A A . 13 ALA HB2 1 1
7 2101 1 1 14 ALA HB3 H 11.694 0.574 -7.274 1.00 . A A . 13 ALA HB3 1 1
7 2102 1 1 14 ALA N N 14.782 0.283 -5.941 1.00 . A A . 13 ALA N 1 1
7 2103 1 1 14 ALA O O 13.586 2.480 -8.507 1.00 . A A . 13 ALA O 1 1
7 2104 1 1 15 LEU C C 16.179 4.382 -7.818 1.00 . A A . 14 LEU C 1 1
7 2105 1 1 15 LEU CA C 14.958 4.284 -6.915 1.00 . A A . 14 LEU CA 1 1
7 2106 1 1 15 LEU CB C 15.165 5.075 -5.612 1.00 . A A . 14 LEU CB 1 1
7 2107 1 1 15 LEU CD1 C 14.914 7.209 -6.904 1.00 . A A . 14 LEU CD1 1 1
7 2108 1 1 15 LEU CD2 C 15.765 7.256 -4.564 1.00 . A A . 14 LEU CD2 1 1
7 2109 1 1 15 LEU CG C 15.760 6.465 -5.876 1.00 . A A . 14 LEU CG 1 1
7 2110 1 1 15 LEU H H 15.022 2.524 -5.744 1.00 . A A . 14 LEU H 1 1
7 2111 1 1 15 LEU HA H 14.110 4.685 -7.442 1.00 . A A . 14 LEU HA 1 1
7 2112 1 1 15 LEU HB2 H 14.215 5.192 -5.116 1.00 . A A . 14 LEU HB2 1 1
7 2113 1 1 15 LEU HB3 H 15.830 4.525 -4.971 1.00 . A A . 14 LEU HB3 1 1
7 2114 1 1 15 LEU HD11 H 15.206 8.249 -6.923 1.00 . A A . 14 LEU HD11 1 1
7 2115 1 1 15 LEU HD12 H 13.871 7.132 -6.639 1.00 . A A . 14 LEU HD12 1 1
7 2116 1 1 15 LEU HD13 H 15.072 6.777 -7.872 1.00 . A A . 14 LEU HD13 1 1
7 2117 1 1 15 LEU HD21 H 16.206 8.228 -4.731 1.00 . A A . 14 LEU HD21 1 1
7 2118 1 1 15 LEU HD22 H 16.343 6.722 -3.825 1.00 . A A . 14 LEU HD22 1 1
7 2119 1 1 15 LEU HD23 H 14.751 7.375 -4.210 1.00 . A A . 14 LEU HD23 1 1
7 2120 1 1 15 LEU HG H 16.773 6.367 -6.240 1.00 . A A . 14 LEU HG 1 1
7 2121 1 1 15 LEU N N 14.696 2.884 -6.592 1.00 . A A . 14 LEU N 1 1
7 2122 1 1 15 LEU O O 16.116 4.957 -8.905 1.00 . A A . 14 LEU O 1 1
7 2123 1 1 16 ALA C C 18.281 3.118 -9.495 1.00 . A A . 15 ALA C 1 1
7 2124 1 1 16 ALA CA C 18.499 3.863 -8.180 1.00 . A A . 15 ALA CA 1 1
7 2125 1 1 16 ALA CB C 19.667 3.240 -7.414 1.00 . A A . 15 ALA CB 1 1
7 2126 1 1 16 ALA H H 17.300 3.364 -6.505 1.00 . A A . 15 ALA H 1 1
7 2127 1 1 16 ALA HA H 18.731 4.892 -8.398 1.00 . A A . 15 ALA HA 1 1
7 2128 1 1 16 ALA HB1 H 19.518 2.174 -7.336 1.00 . A A . 15 ALA HB1 1 1
7 2129 1 1 16 ALA HB2 H 19.721 3.671 -6.426 1.00 . A A . 15 ALA HB2 1 1
7 2130 1 1 16 ALA HB3 H 20.590 3.437 -7.943 1.00 . A A . 15 ALA HB3 1 1
7 2131 1 1 16 ALA N N 17.291 3.818 -7.376 1.00 . A A . 15 ALA N 1 1
7 2132 1 1 16 ALA O O 18.878 3.456 -10.515 1.00 . A A . 15 ALA O 1 1
7 2133 1 1 17 LEU C C 16.577 2.213 -11.748 1.00 . A A . 16 LEU C 1 1
7 2134 1 1 17 LEU CA C 17.148 1.317 -10.660 1.00 . A A . 16 LEU CA 1 1
7 2135 1 1 17 LEU CB C 16.166 0.150 -10.328 1.00 . A A . 16 LEU CB 1 1
7 2136 1 1 17 LEU CD1 C 18.204 -0.973 -9.253 1.00 . A A . 16 LEU CD1 1 1
7 2137 1 1 17 LEU CD2 C 15.962 -2.170 -9.390 1.00 . A A . 16 LEU CD2 1 1
7 2138 1 1 17 LEU CG C 16.919 -1.188 -10.096 1.00 . A A . 16 LEU CG 1 1
7 2139 1 1 17 LEU H H 16.983 1.873 -8.614 1.00 . A A . 16 LEU H 1 1
7 2140 1 1 17 LEU HA H 18.071 0.912 -11.026 1.00 . A A . 16 LEU HA 1 1
7 2141 1 1 17 LEU HB2 H 15.622 0.404 -9.432 1.00 . A A . 16 LEU HB2 1 1
7 2142 1 1 17 LEU HB3 H 15.455 0.013 -11.137 1.00 . A A . 16 LEU HB3 1 1
7 2143 1 1 17 LEU HD11 H 18.363 -1.807 -8.579 1.00 . A A . 16 LEU HD11 1 1
7 2144 1 1 17 LEU HD12 H 18.128 -0.065 -8.679 1.00 . A A . 16 LEU HD12 1 1
7 2145 1 1 17 LEU HD13 H 19.050 -0.896 -9.918 1.00 . A A . 16 LEU HD13 1 1
7 2146 1 1 17 LEU HD21 H 16.430 -3.140 -9.316 1.00 . A A . 16 LEU HD21 1 1
7 2147 1 1 17 LEU HD22 H 15.049 -2.253 -9.960 1.00 . A A . 16 LEU HD22 1 1
7 2148 1 1 17 LEU HD23 H 15.736 -1.800 -8.400 1.00 . A A . 16 LEU HD23 1 1
7 2149 1 1 17 LEU HG H 17.204 -1.599 -11.057 1.00 . A A . 16 LEU HG 1 1
7 2150 1 1 17 LEU N N 17.426 2.098 -9.460 1.00 . A A . 16 LEU N 1 1
7 2151 1 1 17 LEU O O 17.089 2.239 -12.867 1.00 . A A . 16 LEU O 1 1
7 2152 1 1 18 TRP C C 15.750 5.080 -12.632 1.00 . A A . 17 TRP C 1 1
7 2153 1 1 18 TRP CA C 14.899 3.814 -12.420 1.00 . A A . 17 TRP CA 1 1
7 2154 1 1 18 TRP CB C 13.436 4.111 -11.971 1.00 . A A . 17 TRP CB 1 1
7 2155 1 1 18 TRP CD1 C 12.251 5.732 -13.528 1.00 . A A . 17 TRP CD1 1 1
7 2156 1 1 18 TRP CD2 C 13.246 6.710 -11.781 1.00 . A A . 17 TRP CD2 1 1
7 2157 1 1 18 TRP CE2 C 12.651 7.747 -12.523 1.00 . A A . 17 TRP CE2 1 1
7 2158 1 1 18 TRP CE3 C 13.946 7.027 -10.623 1.00 . A A . 17 TRP CE3 1 1
7 2159 1 1 18 TRP CG C 12.984 5.458 -12.427 1.00 . A A . 17 TRP CG 1 1
7 2160 1 1 18 TRP CH2 C 13.462 9.379 -10.948 1.00 . A A . 17 TRP CH2 1 1
7 2161 1 1 18 TRP CZ2 C 12.752 9.075 -12.118 1.00 . A A . 17 TRP CZ2 1 1
7 2162 1 1 18 TRP CZ3 C 14.057 8.342 -10.206 1.00 . A A . 17 TRP CZ3 1 1
7 2163 1 1 18 TRP H H 15.118 2.891 -10.527 1.00 . A A . 17 TRP H 1 1
7 2164 1 1 18 TRP HA H 14.862 3.284 -13.364 1.00 . A A . 17 TRP HA 1 1
7 2165 1 1 18 TRP HB2 H 12.768 3.364 -12.377 1.00 . A A . 17 TRP HB2 1 1
7 2166 1 1 18 TRP HB3 H 13.393 4.068 -10.889 1.00 . A A . 17 TRP HB3 1 1
7 2167 1 1 18 TRP HD1 H 11.885 5.005 -14.238 1.00 . A A . 17 TRP HD1 1 1
7 2168 1 1 18 TRP HE1 H 11.550 7.578 -14.284 1.00 . A A . 17 TRP HE1 1 1
7 2169 1 1 18 TRP HE3 H 14.404 6.241 -10.045 1.00 . A A . 17 TRP HE3 1 1
7 2170 1 1 18 TRP HH2 H 13.552 10.403 -10.618 1.00 . A A . 17 TRP HH2 1 1
7 2171 1 1 18 TRP HZ2 H 12.289 9.858 -12.701 1.00 . A A . 17 TRP HZ2 1 1
7 2172 1 1 18 TRP HZ3 H 14.603 8.553 -9.310 1.00 . A A . 17 TRP HZ3 1 1
7 2173 1 1 18 TRP N N 15.514 2.939 -11.431 1.00 . A A . 17 TRP N 1 1
7 2174 1 1 18 TRP NE1 N 12.049 7.104 -13.587 1.00 . A A . 17 TRP NE1 1 1
7 2175 1 1 18 TRP O O 16.005 5.470 -13.772 1.00 . A A . 17 TRP O 1 1
7 2176 1 1 19 TRP C C 18.200 6.636 -12.572 1.00 . A A . 18 TRP C 1 1
7 2177 1 1 19 TRP CA C 16.999 6.919 -11.683 1.00 . A A . 18 TRP CA 1 1
7 2178 1 1 19 TRP CB C 17.492 7.350 -10.311 1.00 . A A . 18 TRP CB 1 1
7 2179 1 1 19 TRP CD1 C 17.928 9.718 -11.010 1.00 . A A . 18 TRP CD1 1 1
7 2180 1 1 19 TRP CD2 C 19.675 8.792 -9.962 1.00 . A A . 18 TRP CD2 1 1
7 2181 1 1 19 TRP CE2 C 20.064 10.109 -10.292 1.00 . A A . 18 TRP CE2 1 1
7 2182 1 1 19 TRP CE3 C 20.591 7.973 -9.288 1.00 . A A . 18 TRP CE3 1 1
7 2183 1 1 19 TRP CG C 18.321 8.576 -10.429 1.00 . A A . 18 TRP CG 1 1
7 2184 1 1 19 TRP CH2 C 22.232 9.767 -9.290 1.00 . A A . 18 TRP CH2 1 1
7 2185 1 1 19 TRP CZ2 C 21.329 10.599 -9.962 1.00 . A A . 18 TRP CZ2 1 1
7 2186 1 1 19 TRP CZ3 C 21.860 8.456 -8.954 1.00 . A A . 18 TRP CZ3 1 1
7 2187 1 1 19 TRP H H 15.968 5.382 -10.652 1.00 . A A . 18 TRP H 1 1
7 2188 1 1 19 TRP HA H 16.406 7.709 -12.111 1.00 . A A . 18 TRP HA 1 1
7 2189 1 1 19 TRP HB2 H 16.660 7.536 -9.666 1.00 . A A . 18 TRP HB2 1 1
7 2190 1 1 19 TRP HB3 H 18.088 6.567 -9.900 1.00 . A A . 18 TRP HB3 1 1
7 2191 1 1 19 TRP HD1 H 16.970 9.878 -11.456 1.00 . A A . 18 TRP HD1 1 1
7 2192 1 1 19 TRP HE1 H 18.930 11.553 -11.284 1.00 . A A . 18 TRP HE1 1 1
7 2193 1 1 19 TRP HE3 H 20.317 6.962 -9.026 1.00 . A A . 18 TRP HE3 1 1
7 2194 1 1 19 TRP HH2 H 23.214 10.135 -9.029 1.00 . A A . 18 TRP HH2 1 1
7 2195 1 1 19 TRP HZ2 H 21.608 11.610 -10.223 1.00 . A A . 18 TRP HZ2 1 1
7 2196 1 1 19 TRP HZ3 H 22.551 7.812 -8.437 1.00 . A A . 18 TRP HZ3 1 1
7 2197 1 1 19 TRP N N 16.188 5.717 -11.549 1.00 . A A . 18 TRP N 1 1
7 2198 1 1 19 TRP NE1 N 18.960 10.639 -10.935 1.00 . A A . 18 TRP NE1 1 1
7 2199 1 1 19 TRP O O 18.433 7.320 -13.568 1.00 . A A . 18 TRP O 1 1
7 2200 1 1 20 ALA C C 19.746 4.453 -14.209 1.00 . A A . 19 ALA C 1 1
7 2201 1 1 20 ALA CA C 20.141 5.229 -12.955 1.00 . A A . 19 ALA CA 1 1
7 2202 1 1 20 ALA CB C 21.069 4.373 -12.089 1.00 . A A . 19 ALA CB 1 1
7 2203 1 1 20 ALA H H 18.713 5.112 -11.391 1.00 . A A . 19 ALA H 1 1
7 2204 1 1 20 ALA HA H 20.668 6.120 -13.248 1.00 . A A . 19 ALA HA 1 1
7 2205 1 1 20 ALA HB1 H 21.130 4.799 -11.096 1.00 . A A . 19 ALA HB1 1 1
7 2206 1 1 20 ALA HB2 H 22.053 4.351 -12.532 1.00 . A A . 19 ALA HB2 1 1
7 2207 1 1 20 ALA HB3 H 20.679 3.367 -12.025 1.00 . A A . 19 ALA HB3 1 1
7 2208 1 1 20 ALA N N 18.957 5.614 -12.196 1.00 . A A . 19 ALA N 1 1
7 2209 1 1 20 ALA O O 20.604 3.966 -14.946 1.00 . A A . 19 ALA O 1 1
7 2210 1 1 21 ETA CA C 17.948 3.623 -15.609 1.00 . A A . 20 ETA CA 1 1
7 2211 1 1 21 ETA CB C 18.084 4.481 -16.865 1.00 . A A . 20 ETA CB 1 1
7 2212 1 1 21 ETA HA1 H 16.909 3.378 -15.463 1.00 . A A . 20 ETA HA1 1 1
7 2213 1 1 21 ETA HA2 H 18.520 2.713 -15.733 1.00 . A A . 20 ETA HA2 1 1
7 2214 1 1 21 ETA HB1 H 17.521 4.026 -17.672 1.00 . A A . 20 ETA HB1 1 1
7 2215 1 1 21 ETA HB2 H 19.117 4.546 -17.152 1.00 . A A . 20 ETA HB2 1 1
7 2216 1 1 21 ETA HN2 H 17.807 4.751 -13.821 1.00 . A A . 20 ETA HN2 1 1
7 2217 1 1 21 ETA HO H 18.339 6.400 -16.643 1.00 . A A . 20 ETA HO 1 1
7 2218 1 1 21 ETA N N 18.444 4.342 -14.443 1.00 . A A . 20 ETA N 1 1
7 2219 1 1 21 ETA O O 17.598 5.792 -16.591 1.00 . A A . 20 ETA O 1 1
8 2220 1 1 1 ACE C C 14.907 -6.354 13.790 1.00 . A A . 0 ACE C 1 1
8 2221 1 1 1 ACE CH3 C 16.102 -6.954 13.057 1.00 . A A . 0 ACE CH3 1 1
8 2222 1 1 1 ACE H1 H 16.509 -7.768 13.639 1.00 . A A . 0 ACE H1 1 1
8 2223 1 1 1 ACE H2 H 16.860 -6.197 12.919 1.00 . A A . 0 ACE H2 1 1
8 2224 1 1 1 ACE H3 H 15.783 -7.325 12.094 1.00 . A A . 0 ACE H3 1 1
8 2225 1 1 1 ACE O O 14.558 -6.793 14.886 1.00 . A A . 0 ACE O 1 1
8 2226 1 1 2 GLY C C 12.243 -4.110 12.697 1.00 . A A . 1 GLY C 1 1
8 2227 1 1 2 GLY CA C 13.135 -4.690 13.771 1.00 . A A . 1 GLY CA 1 1
8 2228 1 1 2 GLY H H 14.592 -5.033 12.317 1.00 . A A . 1 GLY H 1 1
8 2229 1 1 2 GLY HA2 H 12.569 -5.392 14.356 1.00 . A A . 1 GLY HA2 1 1
8 2230 1 1 2 GLY HA3 H 13.475 -3.887 14.406 1.00 . A A . 1 GLY HA3 1 1
8 2231 1 1 2 GLY N N 14.281 -5.345 13.181 1.00 . A A . 1 GLY N 1 1
8 2232 1 1 2 GLY O O 11.908 -4.764 11.710 1.00 . A A . 1 GLY O 1 1
8 2233 1 1 3 TRP C C 11.686 -1.990 10.624 1.00 . A A . 2 TRP C 1 1
8 2234 1 1 3 TRP CA C 10.999 -2.161 11.994 1.00 . A A . 2 TRP CA 1 1
8 2235 1 1 3 TRP CB C 10.579 -0.799 12.650 1.00 . A A . 2 TRP CB 1 1
8 2236 1 1 3 TRP CD1 C 11.928 1.160 11.878 1.00 . A A . 2 TRP CD1 1 1
8 2237 1 1 3 TRP CD2 C 10.083 0.872 10.636 1.00 . A A . 2 TRP CD2 1 1
8 2238 1 1 3 TRP CE2 C 10.753 1.995 10.103 1.00 . A A . 2 TRP CE2 1 1
8 2239 1 1 3 TRP CE3 C 8.878 0.468 10.033 1.00 . A A . 2 TRP CE3 1 1
8 2240 1 1 3 TRP CG C 10.857 0.370 11.760 1.00 . A A . 2 TRP CG 1 1
8 2241 1 1 3 TRP CH2 C 9.050 2.282 8.420 1.00 . A A . 2 TRP CH2 1 1
8 2242 1 1 3 TRP CZ2 C 10.247 2.694 9.010 1.00 . A A . 2 TRP CZ2 1 1
8 2243 1 1 3 TRP CZ3 C 8.366 1.171 8.931 1.00 . A A . 2 TRP CZ3 1 1
8 2244 1 1 3 TRP H H 12.182 -2.449 13.731 1.00 . A A . 2 TRP H 1 1
8 2245 1 1 3 TRP HA H 10.113 -2.759 11.845 1.00 . A A . 2 TRP HA 1 1
8 2246 1 1 3 TRP HB2 H 9.528 -0.802 12.882 1.00 . A A . 2 TRP HB2 1 1
8 2247 1 1 3 TRP HB3 H 11.133 -0.680 13.570 1.00 . A A . 2 TRP HB3 1 1
8 2248 1 1 3 TRP HD1 H 12.696 1.042 12.625 1.00 . A A . 2 TRP HD1 1 1
8 2249 1 1 3 TRP HE1 H 12.539 2.842 10.757 1.00 . A A . 2 TRP HE1 1 1
8 2250 1 1 3 TRP HE3 H 8.343 -0.387 10.420 1.00 . A A . 2 TRP HE3 1 1
8 2251 1 1 3 TRP HH2 H 8.651 2.820 7.572 1.00 . A A . 2 TRP HH2 1 1
8 2252 1 1 3 TRP HZ2 H 10.778 3.545 8.621 1.00 . A A . 2 TRP HZ2 1 1
8 2253 1 1 3 TRP HZ3 H 7.440 0.854 8.473 1.00 . A A . 2 TRP HZ3 1 1
8 2254 1 1 3 TRP N N 11.866 -2.880 12.917 1.00 . A A . 2 TRP N 1 1
8 2255 1 1 3 TRP NE1 N 11.876 2.135 10.894 1.00 . A A . 2 TRP NE1 1 1
8 2256 1 1 3 TRP O O 11.016 -1.960 9.594 1.00 . A A . 2 TRP O 1 1
8 2257 1 1 4 TRP C C 13.390 -2.738 8.311 1.00 . A A . 3 TRP C 1 1
8 2258 1 1 4 TRP CA C 13.770 -1.702 9.381 1.00 . A A . 3 TRP CA 1 1
8 2259 1 1 4 TRP CB C 15.289 -1.745 9.713 1.00 . A A . 3 TRP CB 1 1
8 2260 1 1 4 TRP CD1 C 15.898 -3.929 10.786 1.00 . A A . 3 TRP CD1 1 1
8 2261 1 1 4 TRP CD2 C 16.328 -3.920 8.586 1.00 . A A . 3 TRP CD2 1 1
8 2262 1 1 4 TRP CE2 C 16.707 -5.193 9.064 1.00 . A A . 3 TRP CE2 1 1
8 2263 1 1 4 TRP CE3 C 16.497 -3.648 7.218 1.00 . A A . 3 TRP CE3 1 1
8 2264 1 1 4 TRP CG C 15.814 -3.143 9.705 1.00 . A A . 3 TRP CG 1 1
8 2265 1 1 4 TRP CH2 C 17.398 -5.877 6.860 1.00 . A A . 3 TRP CH2 1 1
8 2266 1 1 4 TRP CZ2 C 17.235 -6.164 8.219 1.00 . A A . 3 TRP CZ2 1 1
8 2267 1 1 4 TRP CZ3 C 17.029 -4.620 6.361 1.00 . A A . 3 TRP CZ3 1 1
8 2268 1 1 4 TRP H H 13.521 -1.899 11.457 1.00 . A A . 3 TRP H 1 1
8 2269 1 1 4 TRP HA H 13.546 -0.724 8.980 1.00 . A A . 3 TRP HA 1 1
8 2270 1 1 4 TRP HB2 H 15.837 -1.175 8.994 1.00 . A A . 3 TRP HB2 1 1
8 2271 1 1 4 TRP HB3 H 15.443 -1.317 10.694 1.00 . A A . 3 TRP HB3 1 1
8 2272 1 1 4 TRP HD1 H 15.598 -3.645 11.777 1.00 . A A . 3 TRP HD1 1 1
8 2273 1 1 4 TRP HE1 H 16.588 -5.907 11.012 1.00 . A A . 3 TRP HE1 1 1
8 2274 1 1 4 TRP HE3 H 16.220 -2.684 6.824 1.00 . A A . 3 TRP HE3 1 1
8 2275 1 1 4 TRP HH2 H 17.805 -6.621 6.197 1.00 . A A . 3 TRP HH2 1 1
8 2276 1 1 4 TRP HZ2 H 17.516 -7.130 8.611 1.00 . A A . 3 TRP HZ2 1 1
8 2277 1 1 4 TRP HZ3 H 17.154 -4.398 5.311 1.00 . A A . 3 TRP HZ3 1 1
8 2278 1 1 4 TRP N N 13.012 -1.874 10.621 1.00 . A A . 3 TRP N 1 1
8 2279 1 1 4 TRP NE1 N 16.426 -5.153 10.413 1.00 . A A . 3 TRP NE1 1 1
8 2280 1 1 4 TRP O O 13.932 -2.722 7.217 1.00 . A A . 3 TRP O 1 1
8 2281 1 1 5 LEU C C 11.223 -4.001 6.526 1.00 . A A . 4 LEU C 1 1
8 2282 1 1 5 LEU CA C 12.065 -4.630 7.627 1.00 . A A . 4 LEU CA 1 1
8 2283 1 1 5 LEU CB C 11.278 -5.748 8.308 1.00 . A A . 4 LEU CB 1 1
8 2284 1 1 5 LEU CD1 C 11.436 -7.391 10.211 1.00 . A A . 4 LEU CD1 1 1
8 2285 1 1 5 LEU CD2 C 12.902 -7.700 8.229 1.00 . A A . 4 LEU CD2 1 1
8 2286 1 1 5 LEU CG C 12.226 -6.651 9.132 1.00 . A A . 4 LEU CG 1 1
8 2287 1 1 5 LEU H H 12.026 -3.635 9.476 1.00 . A A . 4 LEU H 1 1
8 2288 1 1 5 LEU HA H 12.945 -5.045 7.180 1.00 . A A . 4 LEU HA 1 1
8 2289 1 1 5 LEU HB2 H 10.542 -5.292 8.959 1.00 . A A . 4 LEU HB2 1 1
8 2290 1 1 5 LEU HB3 H 10.769 -6.340 7.562 1.00 . A A . 4 LEU HB3 1 1
8 2291 1 1 5 LEU HD11 H 10.883 -6.680 10.807 1.00 . A A . 4 LEU HD11 1 1
8 2292 1 1 5 LEU HD12 H 12.120 -7.935 10.843 1.00 . A A . 4 LEU HD12 1 1
8 2293 1 1 5 LEU HD13 H 10.750 -8.080 9.743 1.00 . A A . 4 LEU HD13 1 1
8 2294 1 1 5 LEU HD21 H 13.407 -8.428 8.847 1.00 . A A . 4 LEU HD21 1 1
8 2295 1 1 5 LEU HD22 H 13.623 -7.224 7.585 1.00 . A A . 4 LEU HD22 1 1
8 2296 1 1 5 LEU HD23 H 12.158 -8.203 7.627 1.00 . A A . 4 LEU HD23 1 1
8 2297 1 1 5 LEU HG H 12.983 -6.040 9.607 1.00 . A A . 4 LEU HG 1 1
8 2298 1 1 5 LEU N N 12.463 -3.633 8.607 1.00 . A A . 4 LEU N 1 1
8 2299 1 1 5 LEU O O 11.122 -4.548 5.431 1.00 . A A . 4 LEU O 1 1
8 2300 1 1 6 ALA C C 10.646 -1.518 4.757 1.00 . A A . 5 ALA C 1 1
8 2301 1 1 6 ALA CA C 9.788 -2.161 5.844 1.00 . A A . 5 ALA CA 1 1
8 2302 1 1 6 ALA CB C 8.962 -1.077 6.542 1.00 . A A . 5 ALA CB 1 1
8 2303 1 1 6 ALA H H 10.732 -2.453 7.705 1.00 . A A . 5 ALA H 1 1
8 2304 1 1 6 ALA HA H 9.115 -2.869 5.392 1.00 . A A . 5 ALA HA 1 1
8 2305 1 1 6 ALA HB1 H 8.442 -1.506 7.386 1.00 . A A . 5 ALA HB1 1 1
8 2306 1 1 6 ALA HB2 H 8.243 -0.667 5.848 1.00 . A A . 5 ALA HB2 1 1
8 2307 1 1 6 ALA HB3 H 9.617 -0.286 6.888 1.00 . A A . 5 ALA HB3 1 1
8 2308 1 1 6 ALA N N 10.621 -2.855 6.821 1.00 . A A . 5 ALA N 1 1
8 2309 1 1 6 ALA O O 10.137 -1.102 3.716 1.00 . A A . 5 ALA O 1 1
8 2310 1 1 7 LEU C C 13.160 -1.810 2.909 1.00 . A A . 6 LEU C 1 1
8 2311 1 1 7 LEU CA C 12.869 -0.841 4.048 1.00 . A A . 6 LEU CA 1 1
8 2312 1 1 7 LEU CB C 14.173 -0.474 4.764 1.00 . A A . 6 LEU CB 1 1
8 2313 1 1 7 LEU CD1 C 15.078 0.953 6.623 1.00 . A A . 6 LEU CD1 1 1
8 2314 1 1 7 LEU CD2 C 14.283 2.046 4.538 1.00 . A A . 6 LEU CD2 1 1
8 2315 1 1 7 LEU CG C 14.041 0.874 5.504 1.00 . A A . 6 LEU CG 1 1
8 2316 1 1 7 LEU H H 12.297 -1.783 5.853 1.00 . A A . 6 LEU H 1 1
8 2317 1 1 7 LEU HA H 12.429 0.045 3.650 1.00 . A A . 6 LEU HA 1 1
8 2318 1 1 7 LEU HB2 H 14.377 -1.252 5.470 1.00 . A A . 6 LEU HB2 1 1
8 2319 1 1 7 LEU HB3 H 14.984 -0.417 4.059 1.00 . A A . 6 LEU HB3 1 1
8 2320 1 1 7 LEU HD11 H 14.958 1.881 7.162 1.00 . A A . 6 LEU HD11 1 1
8 2321 1 1 7 LEU HD12 H 16.070 0.905 6.201 1.00 . A A . 6 LEU HD12 1 1
8 2322 1 1 7 LEU HD13 H 14.935 0.126 7.295 1.00 . A A . 6 LEU HD13 1 1
8 2323 1 1 7 LEU HD21 H 13.474 2.110 3.829 1.00 . A A . 6 LEU HD21 1 1
8 2324 1 1 7 LEU HD22 H 15.214 1.898 4.011 1.00 . A A . 6 LEU HD22 1 1
8 2325 1 1 7 LEU HD23 H 14.338 2.965 5.102 1.00 . A A . 6 LEU HD23 1 1
8 2326 1 1 7 LEU HG H 13.056 0.948 5.925 1.00 . A A . 6 LEU HG 1 1
8 2327 1 1 7 LEU N N 11.947 -1.437 5.007 1.00 . A A . 6 LEU N 1 1
8 2328 1 1 7 LEU O O 13.536 -1.398 1.812 1.00 . A A . 6 LEU O 1 1
8 2329 1 1 8 ALA C C 12.068 -4.170 1.166 1.00 . A A . 7 ALA C 1 1
8 2330 1 1 8 ALA CA C 13.229 -4.110 2.158 1.00 . A A . 7 ALA CA 1 1
8 2331 1 1 8 ALA CB C 13.411 -5.477 2.822 1.00 . A A . 7 ALA CB 1 1
8 2332 1 1 8 ALA H H 12.677 -3.369 4.063 1.00 . A A . 7 ALA H 1 1
8 2333 1 1 8 ALA HA H 14.134 -3.862 1.628 1.00 . A A . 7 ALA HA 1 1
8 2334 1 1 8 ALA HB1 H 14.242 -5.436 3.509 1.00 . A A . 7 ALA HB1 1 1
8 2335 1 1 8 ALA HB2 H 13.606 -6.223 2.065 1.00 . A A . 7 ALA HB2 1 1
8 2336 1 1 8 ALA HB3 H 12.511 -5.738 3.360 1.00 . A A . 7 ALA HB3 1 1
8 2337 1 1 8 ALA N N 12.983 -3.093 3.174 1.00 . A A . 7 ALA N 1 1
8 2338 1 1 8 ALA O O 12.157 -4.829 0.129 1.00 . A A . 7 ALA O 1 1
8 2339 1 1 9 LEU C C 9.934 -2.388 -0.453 1.00 . A A . 8 LEU C 1 1
8 2340 1 1 9 LEU CA C 9.796 -3.454 0.632 1.00 . A A . 8 LEU CA 1 1
8 2341 1 1 9 LEU CB C 8.544 -3.159 1.474 1.00 . A A . 8 LEU CB 1 1
8 2342 1 1 9 LEU CD1 C 9.314 -4.938 3.064 1.00 . A A . 8 LEU CD1 1 1
8 2343 1 1 9 LEU CD2 C 6.977 -4.045 3.204 1.00 . A A . 8 LEU CD2 1 1
8 2344 1 1 9 LEU CG C 8.126 -4.409 2.256 1.00 . A A . 8 LEU CG 1 1
8 2345 1 1 9 LEU H H 10.964 -2.976 2.330 1.00 . A A . 8 LEU H 1 1
8 2346 1 1 9 LEU HA H 9.679 -4.417 0.166 1.00 . A A . 8 LEU HA 1 1
8 2347 1 1 9 LEU HB2 H 8.767 -2.361 2.166 1.00 . A A . 8 LEU HB2 1 1
8 2348 1 1 9 LEU HB3 H 7.731 -2.857 0.829 1.00 . A A . 8 LEU HB3 1 1
8 2349 1 1 9 LEU HD11 H 9.837 -4.111 3.521 1.00 . A A . 8 LEU HD11 1 1
8 2350 1 1 9 LEU HD12 H 9.986 -5.471 2.408 1.00 . A A . 8 LEU HD12 1 1
8 2351 1 1 9 LEU HD13 H 8.961 -5.609 3.835 1.00 . A A . 8 LEU HD13 1 1
8 2352 1 1 9 LEU HD21 H 6.671 -4.922 3.754 1.00 . A A . 8 LEU HD21 1 1
8 2353 1 1 9 LEU HD22 H 6.142 -3.669 2.630 1.00 . A A . 8 LEU HD22 1 1
8 2354 1 1 9 LEU HD23 H 7.309 -3.284 3.894 1.00 . A A . 8 LEU HD23 1 1
8 2355 1 1 9 LEU HG H 7.797 -5.171 1.562 1.00 . A A . 8 LEU HG 1 1
8 2356 1 1 9 LEU N N 10.977 -3.478 1.494 1.00 . A A . 8 LEU N 1 1
8 2357 1 1 9 LEU O O 9.335 -2.500 -1.522 1.00 . A A . 8 LEU O 1 1
8 2358 1 1 10 ALA C C 12.203 0.483 -0.836 1.00 . A A . 9 ALA C 1 1
8 2359 1 1 10 ALA CA C 10.917 -0.277 -1.137 1.00 . A A . 9 ALA CA 1 1
8 2360 1 1 10 ALA CB C 9.732 0.687 -1.087 1.00 . A A . 9 ALA CB 1 1
8 2361 1 1 10 ALA H H 11.173 -1.309 0.693 1.00 . A A . 9 ALA H 1 1
8 2362 1 1 10 ALA HA H 10.979 -0.695 -2.127 1.00 . A A . 9 ALA HA 1 1
8 2363 1 1 10 ALA HB1 H 9.793 1.378 -1.915 1.00 . A A . 9 ALA HB1 1 1
8 2364 1 1 10 ALA HB2 H 9.753 1.237 -0.157 1.00 . A A . 9 ALA HB2 1 1
8 2365 1 1 10 ALA HB3 H 8.810 0.126 -1.153 1.00 . A A . 9 ALA HB3 1 1
8 2366 1 1 10 ALA N N 10.720 -1.353 -0.174 1.00 . A A . 9 ALA N 1 1
8 2367 1 1 10 ALA O O 12.177 1.688 -0.582 1.00 . A A . 9 ALA O 1 1
8 2368 1 1 11 PRO C C 15.094 1.322 -1.745 1.00 . A A . 10 PRO C 1 1
8 2369 1 1 11 PRO CA C 14.643 0.432 -0.580 1.00 . A A . 10 PRO CA 1 1
8 2370 1 1 11 PRO CB C 15.566 -0.776 -0.377 1.00 . A A . 10 PRO CB 1 1
8 2371 1 1 11 PRO CD C 13.448 -1.634 -1.150 1.00 . A A . 10 PRO CD 1 1
8 2372 1 1 11 PRO CG C 14.962 -1.853 -1.221 1.00 . A A . 10 PRO CG 1 1
8 2373 1 1 11 PRO HA H 14.603 1.005 0.331 1.00 . A A . 10 PRO HA 1 1
8 2374 1 1 11 PRO HB2 H 16.568 -0.544 -0.704 1.00 . A A . 10 PRO HB2 1 1
8 2375 1 1 11 PRO HB3 H 15.568 -1.086 0.659 1.00 . A A . 10 PRO HB3 1 1
8 2376 1 1 11 PRO HD2 H 12.988 -1.882 -2.099 1.00 . A A . 10 PRO HD2 1 1
8 2377 1 1 11 PRO HD3 H 13.011 -2.210 -0.350 1.00 . A A . 10 PRO HD3 1 1
8 2378 1 1 11 PRO HG2 H 15.315 -1.760 -2.246 1.00 . A A . 10 PRO HG2 1 1
8 2379 1 1 11 PRO HG3 H 15.203 -2.831 -0.831 1.00 . A A . 10 PRO HG3 1 1
8 2380 1 1 11 PRO N N 13.318 -0.195 -0.859 1.00 . A A . 10 PRO N 1 1
8 2381 1 1 11 PRO O O 14.400 1.432 -2.756 1.00 . A A . 10 PRO O 1 1
8 2382 1 1 12 ALA C C 17.039 2.068 -3.927 1.00 . A A . 11 ALA C 1 1
8 2383 1 1 12 ALA CA C 16.779 2.831 -2.634 1.00 . A A . 11 ALA CA 1 1
8 2384 1 1 12 ALA CB C 18.083 3.483 -2.175 1.00 . A A . 11 ALA CB 1 1
8 2385 1 1 12 ALA H H 16.763 1.832 -0.763 1.00 . A A . 11 ALA H 1 1
8 2386 1 1 12 ALA HA H 16.060 3.610 -2.826 1.00 . A A . 11 ALA HA 1 1
8 2387 1 1 12 ALA HB1 H 18.760 2.721 -1.816 1.00 . A A . 11 ALA HB1 1 1
8 2388 1 1 12 ALA HB2 H 17.876 4.185 -1.382 1.00 . A A . 11 ALA HB2 1 1
8 2389 1 1 12 ALA HB3 H 18.535 4.002 -3.010 1.00 . A A . 11 ALA HB3 1 1
8 2390 1 1 12 ALA N N 16.253 1.954 -1.592 1.00 . A A . 11 ALA N 1 1
8 2391 1 1 12 ALA O O 17.359 2.670 -4.952 1.00 . A A . 11 ALA O 1 1
8 2392 1 1 13 LEU C C 16.185 0.355 -6.198 1.00 . A A . 12 LEU C 1 1
8 2393 1 1 13 LEU CA C 17.146 -0.046 -5.083 1.00 . A A . 12 LEU CA 1 1
8 2394 1 1 13 LEU CB C 16.988 -1.538 -4.774 1.00 . A A . 12 LEU CB 1 1
8 2395 1 1 13 LEU CD1 C 17.565 -3.376 -3.175 1.00 . A A . 12 LEU CD1 1 1
8 2396 1 1 13 LEU CD2 C 19.338 -1.751 -3.885 1.00 . A A . 12 LEU CD2 1 1
8 2397 1 1 13 LEU CG C 17.842 -1.918 -3.556 1.00 . A A . 12 LEU CG 1 1
8 2398 1 1 13 LEU H H 16.654 0.308 -3.048 1.00 . A A . 12 LEU H 1 1
8 2399 1 1 13 LEU HA H 18.152 0.131 -5.422 1.00 . A A . 12 LEU HA 1 1
8 2400 1 1 13 LEU HB2 H 15.948 -1.750 -4.567 1.00 . A A . 12 LEU HB2 1 1
8 2401 1 1 13 LEU HB3 H 17.307 -2.117 -5.627 1.00 . A A . 12 LEU HB3 1 1
8 2402 1 1 13 LEU HD11 H 16.500 -3.556 -3.178 1.00 . A A . 12 LEU HD11 1 1
8 2403 1 1 13 LEU HD12 H 17.960 -3.573 -2.190 1.00 . A A . 12 LEU HD12 1 1
8 2404 1 1 13 LEU HD13 H 18.041 -4.032 -3.890 1.00 . A A . 12 LEU HD13 1 1
8 2405 1 1 13 LEU HD21 H 19.933 -2.323 -3.185 1.00 . A A . 12 LEU HD21 1 1
8 2406 1 1 13 LEU HD22 H 19.610 -0.710 -3.809 1.00 . A A . 12 LEU HD22 1 1
8 2407 1 1 13 LEU HD23 H 19.531 -2.102 -4.889 1.00 . A A . 12 LEU HD23 1 1
8 2408 1 1 13 LEU HG H 17.577 -1.278 -2.724 1.00 . A A . 12 LEU HG 1 1
8 2409 1 1 13 LEU N N 16.907 0.748 -3.886 1.00 . A A . 12 LEU N 1 1
8 2410 1 1 13 LEU O O 16.624 0.780 -7.263 1.00 . A A . 12 LEU O 1 1
8 2411 1 1 14 ALA C C 14.075 2.019 -7.437 1.00 . A A . 13 ALA C 1 1
8 2412 1 1 14 ALA CA C 13.890 0.580 -6.969 1.00 . A A . 13 ALA CA 1 1
8 2413 1 1 14 ALA CB C 12.480 0.401 -6.405 1.00 . A A . 13 ALA CB 1 1
8 2414 1 1 14 ALA H H 14.575 -0.126 -5.093 1.00 . A A . 13 ALA H 1 1
8 2415 1 1 14 ALA HA H 14.006 -0.075 -7.816 1.00 . A A . 13 ALA HA 1 1
8 2416 1 1 14 ALA HB1 H 12.334 -0.631 -6.121 1.00 . A A . 13 ALA HB1 1 1
8 2417 1 1 14 ALA HB2 H 11.755 0.672 -7.158 1.00 . A A . 13 ALA HB2 1 1
8 2418 1 1 14 ALA HB3 H 12.355 1.034 -5.539 1.00 . A A . 13 ALA HB3 1 1
8 2419 1 1 14 ALA N N 14.882 0.222 -5.957 1.00 . A A . 13 ALA N 1 1
8 2420 1 1 14 ALA O O 13.663 2.381 -8.540 1.00 . A A . 13 ALA O 1 1
8 2421 1 1 15 LEU C C 16.137 4.346 -7.851 1.00 . A A . 14 LEU C 1 1
8 2422 1 1 15 LEU CA C 14.932 4.235 -6.928 1.00 . A A . 14 LEU CA 1 1
8 2423 1 1 15 LEU CB C 15.149 5.037 -5.629 1.00 . A A . 14 LEU CB 1 1
8 2424 1 1 15 LEU CD1 C 14.897 7.179 -6.919 1.00 . A A . 14 LEU CD1 1 1
8 2425 1 1 15 LEU CD2 C 15.793 7.221 -4.598 1.00 . A A . 14 LEU CD2 1 1
8 2426 1 1 15 LEU CG C 15.753 6.424 -5.905 1.00 . A A . 14 LEU CG 1 1
8 2427 1 1 15 LEU H H 15.000 2.491 -5.735 1.00 . A A . 14 LEU H 1 1
8 2428 1 1 15 LEU HA H 14.070 4.620 -7.444 1.00 . A A . 14 LEU HA 1 1
8 2429 1 1 15 LEU HB2 H 14.200 5.164 -5.131 1.00 . A A . 14 LEU HB2 1 1
8 2430 1 1 15 LEU HB3 H 15.813 4.484 -4.984 1.00 . A A . 14 LEU HB3 1 1
8 2431 1 1 15 LEU HD11 H 15.221 8.208 -6.967 1.00 . A A . 14 LEU HD11 1 1
8 2432 1 1 15 LEU HD12 H 13.862 7.141 -6.615 1.00 . A A . 14 LEU HD12 1 1
8 2433 1 1 15 LEU HD13 H 15.006 6.724 -7.886 1.00 . A A . 14 LEU HD13 1 1
8 2434 1 1 15 LEU HD21 H 16.171 8.215 -4.794 1.00 . A A . 14 LEU HD21 1 1
8 2435 1 1 15 LEU HD22 H 16.441 6.723 -3.893 1.00 . A A . 14 LEU HD22 1 1
8 2436 1 1 15 LEU HD23 H 14.798 7.289 -4.187 1.00 . A A . 14 LEU HD23 1 1
8 2437 1 1 15 LEU HG H 16.759 6.317 -6.289 1.00 . A A . 14 LEU HG 1 1
8 2438 1 1 15 LEU N N 14.696 2.836 -6.595 1.00 . A A . 14 LEU N 1 1
8 2439 1 1 15 LEU O O 16.044 4.908 -8.942 1.00 . A A . 14 LEU O 1 1
8 2440 1 1 16 ALA C C 18.223 3.138 -9.554 1.00 . A A . 15 ALA C 1 1
8 2441 1 1 16 ALA CA C 18.459 3.865 -8.236 1.00 . A A . 15 ALA CA 1 1
8 2442 1 1 16 ALA CB C 19.639 3.234 -7.494 1.00 . A A . 15 ALA CB 1 1
8 2443 1 1 16 ALA H H 17.293 3.362 -6.539 1.00 . A A . 15 ALA H 1 1
8 2444 1 1 16 ALA HA H 18.687 4.898 -8.443 1.00 . A A . 15 ALA HA 1 1
8 2445 1 1 16 ALA HB1 H 19.419 2.198 -7.286 1.00 . A A . 15 ALA HB1 1 1
8 2446 1 1 16 ALA HB2 H 19.805 3.761 -6.566 1.00 . A A . 15 ALA HB2 1 1
8 2447 1 1 16 ALA HB3 H 20.526 3.298 -8.107 1.00 . A A . 15 ALA HB3 1 1
8 2448 1 1 16 ALA N N 17.264 3.808 -7.416 1.00 . A A . 15 ALA N 1 1
8 2449 1 1 16 ALA O O 18.845 3.451 -10.568 1.00 . A A . 15 ALA O 1 1
8 2450 1 1 17 LEU C C 16.502 2.312 -11.836 1.00 . A A . 16 LEU C 1 1
8 2451 1 1 17 LEU CA C 17.017 1.394 -10.729 1.00 . A A . 16 LEU CA 1 1
8 2452 1 1 17 LEU CB C 15.960 0.296 -10.388 1.00 . A A . 16 LEU CB 1 1
8 2453 1 1 17 LEU CD1 C 17.013 -1.318 -12.053 1.00 . A A . 16 LEU CD1 1 1
8 2454 1 1 17 LEU CD2 C 17.658 -1.415 -9.597 1.00 . A A . 16 LEU CD2 1 1
8 2455 1 1 17 LEU CG C 16.514 -1.137 -10.597 1.00 . A A . 16 LEU CG 1 1
8 2456 1 1 17 LEU H H 16.860 1.951 -8.693 1.00 . A A . 16 LEU H 1 1
8 2457 1 1 17 LEU HA H 17.915 0.932 -11.071 1.00 . A A . 16 LEU HA 1 1
8 2458 1 1 17 LEU HB2 H 15.671 0.410 -9.367 1.00 . A A . 16 LEU HB2 1 1
8 2459 1 1 17 LEU HB3 H 15.074 0.415 -11.000 1.00 . A A . 16 LEU HB3 1 1
8 2460 1 1 17 LEU HD11 H 18.078 -1.131 -12.116 1.00 . A A . 16 LEU HD11 1 1
8 2461 1 1 17 LEU HD12 H 16.495 -0.634 -12.713 1.00 . A A . 16 LEU HD12 1 1
8 2462 1 1 17 LEU HD13 H 16.812 -2.331 -12.369 1.00 . A A . 16 LEU HD13 1 1
8 2463 1 1 17 LEU HD21 H 17.443 -0.942 -8.650 1.00 . A A . 16 LEU HD21 1 1
8 2464 1 1 17 LEU HD22 H 18.586 -1.030 -9.989 1.00 . A A . 16 LEU HD22 1 1
8 2465 1 1 17 LEU HD23 H 17.748 -2.482 -9.452 1.00 . A A . 16 LEU HD23 1 1
8 2466 1 1 17 LEU HG H 15.707 -1.840 -10.424 1.00 . A A . 16 LEU HG 1 1
8 2467 1 1 17 LEU N N 17.321 2.160 -9.532 1.00 . A A . 16 LEU N 1 1
8 2468 1 1 17 LEU O O 17.052 2.344 -12.937 1.00 . A A . 16 LEU O 1 1
8 2469 1 1 18 TRP C C 15.724 5.206 -12.695 1.00 . A A . 17 TRP C 1 1
8 2470 1 1 18 TRP CA C 14.858 3.945 -12.523 1.00 . A A . 17 TRP CA 1 1
8 2471 1 1 18 TRP CB C 13.393 4.249 -12.099 1.00 . A A . 17 TRP CB 1 1
8 2472 1 1 18 TRP CD1 C 12.267 5.942 -13.627 1.00 . A A . 17 TRP CD1 1 1
8 2473 1 1 18 TRP CD2 C 13.239 6.840 -11.826 1.00 . A A . 17 TRP CD2 1 1
8 2474 1 1 18 TRP CE2 C 12.678 7.913 -12.542 1.00 . A A . 17 TRP CE2 1 1
8 2475 1 1 18 TRP CE3 C 13.918 7.102 -10.642 1.00 . A A . 17 TRP CE3 1 1
8 2476 1 1 18 TRP CG C 12.970 5.616 -12.520 1.00 . A A . 17 TRP CG 1 1
8 2477 1 1 18 TRP CH2 C 13.482 9.473 -10.889 1.00 . A A . 17 TRP CH2 1 1
8 2478 1 1 18 TRP CZ2 C 12.793 9.224 -12.086 1.00 . A A . 17 TRP CZ2 1 1
8 2479 1 1 18 TRP CZ3 C 14.043 8.400 -10.173 1.00 . A A . 17 TRP CZ3 1 1
8 2480 1 1 18 TRP H H 15.024 2.981 -10.646 1.00 . A A . 17 TRP H 1 1
8 2481 1 1 18 TRP HA H 14.835 3.434 -13.478 1.00 . A A . 17 TRP HA 1 1
8 2482 1 1 18 TRP HB2 H 12.722 3.524 -12.542 1.00 . A A . 17 TRP HB2 1 1
8 2483 1 1 18 TRP HB3 H 13.327 4.175 -11.021 1.00 . A A . 17 TRP HB3 1 1
8 2484 1 1 18 TRP HD1 H 11.905 5.248 -14.370 1.00 . A A . 17 TRP HD1 1 1
8 2485 1 1 18 TRP HE1 H 11.614 7.825 -14.330 1.00 . A A . 17 TRP HE1 1 1
8 2486 1 1 18 TRP HE3 H 14.351 6.287 -10.084 1.00 . A A . 17 TRP HE3 1 1
8 2487 1 1 18 TRP HH2 H 13.581 10.483 -10.520 1.00 . A A . 17 TRP HH2 1 1
8 2488 1 1 18 TRP HZ2 H 12.356 10.035 -12.650 1.00 . A A . 17 TRP HZ2 1 1
8 2489 1 1 18 TRP HZ3 H 14.574 8.569 -9.258 1.00 . A A . 17 TRP HZ3 1 1
8 2490 1 1 18 TRP N N 15.441 3.046 -11.539 1.00 . A A . 17 TRP N 1 1
8 2491 1 1 18 TRP NE1 N 12.090 7.318 -13.641 1.00 . A A . 17 TRP NE1 1 1
8 2492 1 1 18 TRP O O 15.996 5.615 -13.824 1.00 . A A . 17 TRP O 1 1
8 2493 1 1 19 TRP C C 18.174 6.764 -12.597 1.00 . A A . 18 TRP C 1 1
8 2494 1 1 19 TRP CA C 16.978 7.021 -11.696 1.00 . A A . 18 TRP CA 1 1
8 2495 1 1 19 TRP CB C 17.479 7.405 -10.312 1.00 . A A . 18 TRP CB 1 1
8 2496 1 1 19 TRP CD1 C 17.961 9.781 -10.940 1.00 . A A . 18 TRP CD1 1 1
8 2497 1 1 19 TRP CD2 C 19.694 8.789 -9.930 1.00 . A A . 18 TRP CD2 1 1
8 2498 1 1 19 TRP CE2 C 20.107 10.108 -10.222 1.00 . A A . 18 TRP CE2 1 1
8 2499 1 1 19 TRP CE3 C 20.598 7.934 -9.288 1.00 . A A . 18 TRP CE3 1 1
8 2500 1 1 19 TRP CG C 18.334 8.615 -10.398 1.00 . A A . 18 TRP CG 1 1
8 2501 1 1 19 TRP CH2 C 22.273 9.697 -9.244 1.00 . A A . 18 TRP CH2 1 1
8 2502 1 1 19 TRP CZ2 C 21.382 10.564 -9.885 1.00 . A A . 18 TRP CZ2 1 1
8 2503 1 1 19 TRP CZ3 C 21.878 8.383 -8.946 1.00 . A A . 18 TRP CZ3 1 1
8 2504 1 1 19 TRP H H 15.928 5.480 -10.701 1.00 . A A . 18 TRP H 1 1
8 2505 1 1 19 TRP HA H 16.389 7.829 -12.094 1.00 . A A . 18 TRP HA 1 1
8 2506 1 1 19 TRP HB2 H 16.649 7.596 -9.665 1.00 . A A . 18 TRP HB2 1 1
8 2507 1 1 19 TRP HB3 H 18.055 6.600 -9.917 1.00 . A A . 18 TRP HB3 1 1
8 2508 1 1 19 TRP HD1 H 17.002 9.972 -11.377 1.00 . A A . 18 TRP HD1 1 1
8 2509 1 1 19 TRP HE1 H 18.998 11.605 -11.164 1.00 . A A . 18 TRP HE1 1 1
8 2510 1 1 19 TRP HE3 H 20.305 6.921 -9.053 1.00 . A A . 18 TRP HE3 1 1
8 2511 1 1 19 TRP HH2 H 23.262 10.038 -8.977 1.00 . A A . 18 TRP HH2 1 1
8 2512 1 1 19 TRP HZ2 H 21.677 11.576 -10.118 1.00 . A A . 18 TRP HZ2 1 1
8 2513 1 1 19 TRP HZ3 H 22.561 7.712 -8.452 1.00 . A A . 18 TRP HZ3 1 1
8 2514 1 1 19 TRP N N 16.156 5.821 -11.595 1.00 . A A . 18 TRP N 1 1
8 2515 1 1 19 TRP NE1 N 19.011 10.678 -10.842 1.00 . A A . 18 TRP NE1 1 1
8 2516 1 1 19 TRP O O 18.412 7.487 -13.566 1.00 . A A . 18 TRP O 1 1
8 2517 1 1 20 ALA C C 19.693 4.656 -14.325 1.00 . A A . 19 ALA C 1 1
8 2518 1 1 20 ALA CA C 20.101 5.360 -13.035 1.00 . A A . 19 ALA CA 1 1
8 2519 1 1 20 ALA CB C 21.010 4.447 -12.211 1.00 . A A . 19 ALA CB 1 1
8 2520 1 1 20 ALA H H 18.674 5.196 -11.477 1.00 . A A . 19 ALA H 1 1
8 2521 1 1 20 ALA HA H 20.643 6.257 -13.282 1.00 . A A . 19 ALA HA 1 1
8 2522 1 1 20 ALA HB1 H 21.983 4.391 -12.678 1.00 . A A . 19 ALA HB1 1 1
8 2523 1 1 20 ALA HB2 H 20.579 3.458 -12.161 1.00 . A A . 19 ALA HB2 1 1
8 2524 1 1 20 ALA HB3 H 21.114 4.847 -11.212 1.00 . A A . 19 ALA HB3 1 1
8 2525 1 1 20 ALA N N 18.922 5.725 -12.262 1.00 . A A . 19 ALA N 1 1
8 2526 1 1 20 ALA O O 20.526 4.392 -15.190 1.00 . A A . 19 ALA O 1 1
8 2527 1 1 21 ETA CA C 17.889 3.680 -15.630 1.00 . A A . 20 ETA CA 1 1
8 2528 1 1 21 ETA CB C 18.041 4.576 -16.857 1.00 . A A . 20 ETA CB 1 1
8 2529 1 1 21 ETA HA1 H 16.845 3.454 -15.488 1.00 . A A . 20 ETA HA1 1 1
8 2530 1 1 21 ETA HA2 H 18.440 2.761 -15.783 1.00 . A A . 20 ETA HA2 1 1
8 2531 1 1 21 ETA HB1 H 17.514 4.129 -17.693 1.00 . A A . 20 ETA HB1 1 1
8 2532 1 1 21 ETA HB2 H 19.081 4.677 -17.109 1.00 . A A . 20 ETA HB2 1 1
8 2533 1 1 21 ETA HN2 H 17.785 4.591 -13.719 1.00 . A A . 20 ETA HN2 1 1
8 2534 1 1 21 ETA HO H 18.242 6.480 -16.502 1.00 . A A . 20 ETA HO 1 1
8 2535 1 1 21 ETA N N 18.403 4.355 -14.443 1.00 . A A . 20 ETA N 1 1
8 2536 1 1 21 ETA O O 17.509 5.863 -16.560 1.00 . A A . 20 ETA O 1 1
9 2537 1 1 1 ACE C C 13.966 -6.670 13.898 1.00 . A A . 0 ACE C 1 1
9 2538 1 1 1 ACE CH3 C 15.016 -7.544 13.222 1.00 . A A . 0 ACE CH3 1 1
9 2539 1 1 1 ACE H1 H 15.927 -6.979 13.092 1.00 . A A . 0 ACE H1 1 1
9 2540 1 1 1 ACE H2 H 14.651 -7.865 12.257 1.00 . A A . 0 ACE H2 1 1
9 2541 1 1 1 ACE H3 H 15.214 -8.410 13.836 1.00 . A A . 0 ACE H3 1 1
9 2542 1 1 1 ACE O O 13.475 -6.996 14.979 1.00 . A A . 0 ACE O 1 1
9 2543 1 1 2 GLY C C 11.938 -3.891 12.678 1.00 . A A . 1 GLY C 1 1
9 2544 1 1 2 GLY CA C 12.636 -4.640 13.792 1.00 . A A . 1 GLY CA 1 1
9 2545 1 1 2 GLY H H 14.034 -5.333 12.405 1.00 . A A . 1 GLY H 1 1
9 2546 1 1 2 GLY HA2 H 11.900 -5.181 14.363 1.00 . A A . 1 GLY HA2 1 1
9 2547 1 1 2 GLY HA3 H 13.128 -3.923 14.430 1.00 . A A . 1 GLY HA3 1 1
9 2548 1 1 2 GLY N N 13.620 -5.553 13.255 1.00 . A A . 1 GLY N 1 1
9 2549 1 1 2 GLY O O 11.506 -4.467 11.682 1.00 . A A . 1 GLY O 1 1
9 2550 1 1 3 TRP C C 11.959 -1.719 10.584 1.00 . A A . 2 TRP C 1 1
9 2551 1 1 3 TRP CA C 11.193 -1.719 11.923 1.00 . A A . 2 TRP CA 1 1
9 2552 1 1 3 TRP CB C 11.064 -0.292 12.564 1.00 . A A . 2 TRP CB 1 1
9 2553 1 1 3 TRP CD1 C 12.859 1.314 11.887 1.00 . A A . 2 TRP CD1 1 1
9 2554 1 1 3 TRP CD2 C 11.084 1.418 10.518 1.00 . A A . 2 TRP CD2 1 1
9 2555 1 1 3 TRP CE2 C 12.019 2.361 10.034 1.00 . A A . 2 TRP CE2 1 1
9 2556 1 1 3 TRP CE3 C 9.865 1.280 9.830 1.00 . A A . 2 TRP CE3 1 1
9 2557 1 1 3 TRP CG C 11.650 0.775 11.694 1.00 . A A . 2 TRP CG 1 1
9 2558 1 1 3 TRP CH2 C 10.542 2.990 8.234 1.00 . A A . 2 TRP CH2 1 1
9 2559 1 1 3 TRP CZ2 C 11.757 3.138 8.907 1.00 . A A . 2 TRP CZ2 1 1
9 2560 1 1 3 TRP CZ3 C 9.596 2.063 8.695 1.00 . A A . 2 TRP CZ3 1 1
9 2561 1 1 3 TRP H H 12.210 -2.249 13.705 1.00 . A A . 2 TRP H 1 1
9 2562 1 1 3 TRP HA H 10.202 -2.104 11.735 1.00 . A A . 2 TRP HA 1 1
9 2563 1 1 3 TRP HB2 H 10.030 -0.052 12.742 1.00 . A A . 2 TRP HB2 1 1
9 2564 1 1 3 TRP HB3 H 11.583 -0.297 13.511 1.00 . A A . 2 TRP HB3 1 1
9 2565 1 1 3 TRP HD1 H 13.530 1.042 12.684 1.00 . A A . 2 TRP HD1 1 1
9 2566 1 1 3 TRP HE1 H 13.899 2.805 10.814 1.00 . A A . 2 TRP HE1 1 1
9 2567 1 1 3 TRP HE3 H 9.130 0.568 10.177 1.00 . A A . 2 TRP HE3 1 1
9 2568 1 1 3 TRP HH2 H 10.331 3.590 7.361 1.00 . A A . 2 TRP HH2 1 1
9 2569 1 1 3 TRP HZ2 H 12.488 3.848 8.559 1.00 . A A . 2 TRP HZ2 1 1
9 2570 1 1 3 TRP HZ3 H 8.658 1.948 8.174 1.00 . A A . 2 TRP HZ3 1 1
9 2571 1 1 3 TRP N N 11.839 -2.605 12.879 1.00 . A A . 2 TRP N 1 1
9 2572 1 1 3 TRP NE1 N 13.088 2.262 10.903 1.00 . A A . 2 TRP NE1 1 1
9 2573 1 1 3 TRP O O 11.356 -1.547 9.524 1.00 . A A . 2 TRP O 1 1
9 2574 1 1 4 TRP C C 13.544 -2.842 8.340 1.00 . A A . 3 TRP C 1 1
9 2575 1 1 4 TRP CA C 14.101 -1.915 9.429 1.00 . A A . 3 TRP CA 1 1
9 2576 1 1 4 TRP CB C 15.560 -2.292 9.809 1.00 . A A . 3 TRP CB 1 1
9 2577 1 1 4 TRP CD1 C 15.620 -4.547 10.914 1.00 . A A . 3 TRP CD1 1 1
9 2578 1 1 4 TRP CD2 C 16.130 -4.657 8.733 1.00 . A A . 3 TRP CD2 1 1
9 2579 1 1 4 TRP CE2 C 16.197 -5.978 9.229 1.00 . A A . 3 TRP CE2 1 1
9 2580 1 1 4 TRP CE3 C 16.411 -4.446 7.371 1.00 . A A . 3 TRP CE3 1 1
9 2581 1 1 4 TRP CG C 15.758 -3.772 9.828 1.00 . A A . 3 TRP CG 1 1
9 2582 1 1 4 TRP CH2 C 16.804 -6.821 7.056 1.00 . A A . 3 TRP CH2 1 1
9 2583 1 1 4 TRP CZ2 C 16.529 -7.050 8.406 1.00 . A A . 3 TRP CZ2 1 1
9 2584 1 1 4 TRP CZ3 C 16.746 -5.522 6.539 1.00 . A A . 3 TRP CZ3 1 1
9 2585 1 1 4 TRP H H 13.733 -2.035 11.495 1.00 . A A . 3 TRP H 1 1
9 2586 1 1 4 TRP HA H 14.114 -0.914 9.024 1.00 . A A . 3 TRP HA 1 1
9 2587 1 1 4 TRP HB2 H 16.240 -1.868 9.099 1.00 . A A . 3 TRP HB2 1 1
9 2588 1 1 4 TRP HB3 H 15.780 -1.893 10.791 1.00 . A A . 3 TRP HB3 1 1
9 2589 1 1 4 TRP HD1 H 15.351 -4.193 11.891 1.00 . A A . 3 TRP HD1 1 1
9 2590 1 1 4 TRP HE1 H 15.845 -6.629 11.172 1.00 . A A . 3 TRP HE1 1 1
9 2591 1 1 4 TRP HE3 H 16.371 -3.450 6.964 1.00 . A A . 3 TRP HE3 1 1
9 2592 1 1 4 TRP HH2 H 17.062 -7.643 6.413 1.00 . A A . 3 TRP HH2 1 1
9 2593 1 1 4 TRP HZ2 H 16.572 -8.050 8.810 1.00 . A A . 3 TRP HZ2 1 1
9 2594 1 1 4 TRP HZ3 H 16.959 -5.346 5.495 1.00 . A A . 3 TRP HZ3 1 1
9 2595 1 1 4 TRP N N 13.275 -1.904 10.637 1.00 . A A . 3 TRP N 1 1
9 2596 1 1 4 TRP NE1 N 15.878 -5.861 10.564 1.00 . A A . 3 TRP NE1 1 1
9 2597 1 1 4 TRP O O 14.124 -2.953 7.273 1.00 . A A . 3 TRP O 1 1
9 2598 1 1 5 LEU C C 11.284 -3.586 6.429 1.00 . A A . 4 LEU C 1 1
9 2599 1 1 5 LEU CA C 11.871 -4.390 7.582 1.00 . A A . 4 LEU CA 1 1
9 2600 1 1 5 LEU CB C 10.793 -5.272 8.211 1.00 . A A . 4 LEU CB 1 1
9 2601 1 1 5 LEU CD1 C 10.460 -6.908 10.100 1.00 . A A . 4 LEU CD1 1 1
9 2602 1 1 5 LEU CD2 C 11.833 -7.589 8.146 1.00 . A A . 4 LEU CD2 1 1
9 2603 1 1 5 LEU CG C 11.444 -6.402 9.047 1.00 . A A . 4 LEU CG 1 1
9 2604 1 1 5 LEU H H 11.967 -3.406 9.440 1.00 . A A . 4 LEU H 1 1
9 2605 1 1 5 LEU HA H 12.654 -5.015 7.200 1.00 . A A . 4 LEU HA 1 1
9 2606 1 1 5 LEU HB2 H 10.179 -4.647 8.848 1.00 . A A . 4 LEU HB2 1 1
9 2607 1 1 5 LEU HB3 H 10.175 -5.702 7.437 1.00 . A A . 4 LEU HB3 1 1
9 2608 1 1 5 LEU HD11 H 9.625 -7.384 9.611 1.00 . A A . 4 LEU HD11 1 1
9 2609 1 1 5 LEU HD12 H 10.108 -6.079 10.693 1.00 . A A . 4 LEU HD12 1 1
9 2610 1 1 5 LEU HD13 H 10.959 -7.622 10.737 1.00 . A A . 4 LEU HD13 1 1
9 2611 1 1 5 LEU HD21 H 12.657 -7.312 7.508 1.00 . A A . 4 LEU HD21 1 1
9 2612 1 1 5 LEU HD22 H 10.990 -7.881 7.539 1.00 . A A . 4 LEU HD22 1 1
9 2613 1 1 5 LEU HD23 H 12.128 -8.422 8.767 1.00 . A A . 4 LEU HD23 1 1
9 2614 1 1 5 LEU HG H 12.326 -6.022 9.546 1.00 . A A . 4 LEU HG 1 1
9 2615 1 1 5 LEU N N 12.431 -3.504 8.589 1.00 . A A . 4 LEU N 1 1
9 2616 1 1 5 LEU O O 11.120 -4.104 5.324 1.00 . A A . 4 LEU O 1 1
9 2617 1 1 6 ALA C C 11.464 -1.075 4.627 1.00 . A A . 5 ALA C 1 1
9 2618 1 1 6 ALA CA C 10.402 -1.465 5.655 1.00 . A A . 5 ALA CA 1 1
9 2619 1 1 6 ALA CB C 9.827 -0.200 6.296 1.00 . A A . 5 ALA CB 1 1
9 2620 1 1 6 ALA H H 11.119 -1.947 7.575 1.00 . A A . 5 ALA H 1 1
9 2621 1 1 6 ALA HA H 9.607 -1.994 5.158 1.00 . A A . 5 ALA HA 1 1
9 2622 1 1 6 ALA HB1 H 10.636 0.454 6.595 1.00 . A A . 5 ALA HB1 1 1
9 2623 1 1 6 ALA HB2 H 9.244 -0.470 7.165 1.00 . A A . 5 ALA HB2 1 1
9 2624 1 1 6 ALA HB3 H 9.196 0.311 5.584 1.00 . A A . 5 ALA HB3 1 1
9 2625 1 1 6 ALA N N 10.970 -2.325 6.686 1.00 . A A . 5 ALA N 1 1
9 2626 1 1 6 ALA O O 11.144 -0.549 3.561 1.00 . A A . 5 ALA O 1 1
9 2627 1 1 7 LEU C C 13.990 -2.068 2.982 1.00 . A A . 6 LEU C 1 1
9 2628 1 1 7 LEU CA C 13.832 -0.999 4.059 1.00 . A A . 6 LEU CA 1 1
9 2629 1 1 7 LEU CB C 15.129 -0.893 4.869 1.00 . A A . 6 LEU CB 1 1
9 2630 1 1 7 LEU CD1 C 16.214 0.380 6.738 1.00 . A A . 6 LEU CD1 1 1
9 2631 1 1 7 LEU CD2 C 15.756 1.548 4.582 1.00 . A A . 6 LEU CD2 1 1
9 2632 1 1 7 LEU CG C 15.239 0.476 5.563 1.00 . A A . 6 LEU CG 1 1
9 2633 1 1 7 LEU H H 12.926 -1.747 5.817 1.00 . A A . 6 LEU H 1 1
9 2634 1 1 7 LEU HA H 13.634 -0.062 3.595 1.00 . A A . 6 LEU HA 1 1
9 2635 1 1 7 LEU HB2 H 15.110 -1.667 5.608 1.00 . A A . 6 LEU HB2 1 1
9 2636 1 1 7 LEU HB3 H 15.982 -1.038 4.231 1.00 . A A . 6 LEU HB3 1 1
9 2637 1 1 7 LEU HD11 H 15.762 -0.195 7.530 1.00 . A A . 6 LEU HD11 1 1
9 2638 1 1 7 LEU HD12 H 16.445 1.370 7.098 1.00 . A A . 6 LEU HD12 1 1
9 2639 1 1 7 LEU HD13 H 17.121 -0.108 6.412 1.00 . A A . 6 LEU HD13 1 1
9 2640 1 1 7 LEU HD21 H 14.981 1.800 3.876 1.00 . A A . 6 LEU HD21 1 1
9 2641 1 1 7 LEU HD22 H 16.619 1.177 4.050 1.00 . A A . 6 LEU HD22 1 1
9 2642 1 1 7 LEU HD23 H 16.034 2.433 5.135 1.00 . A A . 6 LEU HD23 1 1
9 2643 1 1 7 LEU HG H 14.270 0.758 5.931 1.00 . A A . 6 LEU HG 1 1
9 2644 1 1 7 LEU N N 12.728 -1.330 4.956 1.00 . A A . 6 LEU N 1 1
9 2645 1 1 7 LEU O O 14.508 -1.799 1.902 1.00 . A A . 6 LEU O 1 1
9 2646 1 1 8 ALA C C 12.402 -4.424 1.448 1.00 . A A . 7 ALA C 1 1
9 2647 1 1 8 ALA CA C 13.633 -4.388 2.345 1.00 . A A . 7 ALA CA 1 1
9 2648 1 1 8 ALA CB C 13.743 -5.706 3.113 1.00 . A A . 7 ALA CB 1 1
9 2649 1 1 8 ALA H H 13.136 -3.431 4.161 1.00 . A A . 7 ALA H 1 1
9 2650 1 1 8 ALA HA H 14.513 -4.271 1.734 1.00 . A A . 7 ALA HA 1 1
9 2651 1 1 8 ALA HB1 H 14.569 -5.651 3.807 1.00 . A A . 7 ALA HB1 1 1
9 2652 1 1 8 ALA HB2 H 13.908 -6.516 2.419 1.00 . A A . 7 ALA HB2 1 1
9 2653 1 1 8 ALA HB3 H 12.827 -5.879 3.659 1.00 . A A . 7 ALA HB3 1 1
9 2654 1 1 8 ALA N N 13.543 -3.276 3.288 1.00 . A A . 7 ALA N 1 1
9 2655 1 1 8 ALA O O 12.406 -5.054 0.390 1.00 . A A . 7 ALA O 1 1
9 2656 1 1 9 LEU C C 10.054 -2.468 0.223 1.00 . A A . 8 LEU C 1 1
9 2657 1 1 9 LEU CA C 10.092 -3.683 1.143 1.00 . A A . 8 LEU CA 1 1
9 2658 1 1 9 LEU CB C 8.929 -3.583 2.121 1.00 . A A . 8 LEU CB 1 1
9 2659 1 1 9 LEU CD1 C 7.835 -4.588 4.128 1.00 . A A . 8 LEU CD1 1 1
9 2660 1 1 9 LEU CD2 C 8.538 -6.083 2.226 1.00 . A A . 8 LEU CD2 1 1
9 2661 1 1 9 LEU CG C 8.890 -4.814 3.040 1.00 . A A . 8 LEU CG 1 1
9 2662 1 1 9 LEU H H 11.412 -3.267 2.735 1.00 . A A . 8 LEU H 1 1
9 2663 1 1 9 LEU HA H 9.973 -4.573 0.557 1.00 . A A . 8 LEU HA 1 1
9 2664 1 1 9 LEU HB2 H 9.060 -2.691 2.719 1.00 . A A . 8 LEU HB2 1 1
9 2665 1 1 9 LEU HB3 H 8.002 -3.511 1.574 1.00 . A A . 8 LEU HB3 1 1
9 2666 1 1 9 LEU HD11 H 8.007 -3.634 4.603 1.00 . A A . 8 LEU HD11 1 1
9 2667 1 1 9 LEU HD12 H 7.903 -5.376 4.864 1.00 . A A . 8 LEU HD12 1 1
9 2668 1 1 9 LEU HD13 H 6.852 -4.597 3.682 1.00 . A A . 8 LEU HD13 1 1
9 2669 1 1 9 LEU HD21 H 9.437 -6.481 1.777 1.00 . A A . 8 LEU HD21 1 1
9 2670 1 1 9 LEU HD22 H 7.828 -5.840 1.450 1.00 . A A . 8 LEU HD22 1 1
9 2671 1 1 9 LEU HD23 H 8.108 -6.833 2.879 1.00 . A A . 8 LEU HD23 1 1
9 2672 1 1 9 LEU HG H 9.858 -4.935 3.509 1.00 . A A . 8 LEU HG 1 1
9 2673 1 1 9 LEU N N 11.347 -3.743 1.887 1.00 . A A . 8 LEU N 1 1
9 2674 1 1 9 LEU O O 9.265 -2.420 -0.720 1.00 . A A . 8 LEU O 1 1
9 2675 1 1 10 ALA C C 12.374 0.303 -0.317 1.00 . A A . 9 ALA C 1 1
9 2676 1 1 10 ALA CA C 10.962 -0.268 -0.306 1.00 . A A . 9 ALA CA 1 1
9 2677 1 1 10 ALA CB C 9.989 0.772 0.255 1.00 . A A . 9 ALA CB 1 1
9 2678 1 1 10 ALA H H 11.511 -1.577 1.264 1.00 . A A . 9 ALA H 1 1
9 2679 1 1 10 ALA HA H 10.677 -0.498 -1.318 1.00 . A A . 9 ALA HA 1 1
9 2680 1 1 10 ALA HB1 H 10.167 1.724 -0.221 1.00 . A A . 9 ALA HB1 1 1
9 2681 1 1 10 ALA HB2 H 10.139 0.868 1.320 1.00 . A A . 9 ALA HB2 1 1
9 2682 1 1 10 ALA HB3 H 8.973 0.457 0.061 1.00 . A A . 9 ALA HB3 1 1
9 2683 1 1 10 ALA N N 10.908 -1.486 0.502 1.00 . A A . 9 ALA N 1 1
9 2684 1 1 10 ALA O O 12.594 1.449 0.076 1.00 . A A . 9 ALA O 1 1
9 2685 1 1 11 PRO C C 14.986 0.947 -1.979 1.00 . A A . 10 PRO C 1 1
9 2686 1 1 11 PRO CA C 14.754 -0.040 -0.827 1.00 . A A . 10 PRO CA 1 1
9 2687 1 1 11 PRO CB C 15.506 -1.360 -1.039 1.00 . A A . 10 PRO CB 1 1
9 2688 1 1 11 PRO CD C 13.156 -1.856 -1.247 1.00 . A A . 10 PRO CD 1 1
9 2689 1 1 11 PRO CG C 14.540 -2.222 -1.788 1.00 . A A . 10 PRO CG 1 1
9 2690 1 1 11 PRO HA H 15.061 0.396 0.107 1.00 . A A . 10 PRO HA 1 1
9 2691 1 1 11 PRO HB2 H 16.401 -1.194 -1.613 1.00 . A A . 10 PRO HB2 1 1
9 2692 1 1 11 PRO HB3 H 15.745 -1.822 -0.093 1.00 . A A . 10 PRO HB3 1 1
9 2693 1 1 11 PRO HD2 H 12.416 -1.901 -2.037 1.00 . A A . 10 PRO HD2 1 1
9 2694 1 1 11 PRO HD3 H 12.881 -2.499 -0.427 1.00 . A A . 10 PRO HD3 1 1
9 2695 1 1 11 PRO HG2 H 14.604 -2.009 -2.853 1.00 . A A . 10 PRO HG2 1 1
9 2696 1 1 11 PRO HG3 H 14.733 -3.269 -1.603 1.00 . A A . 10 PRO HG3 1 1
9 2697 1 1 11 PRO N N 13.326 -0.473 -0.759 1.00 . A A . 10 PRO N 1 1
9 2698 1 1 11 PRO O O 14.307 0.887 -3.005 1.00 . A A . 10 PRO O 1 1
9 2699 1 1 12 ALA C C 16.656 2.172 -4.134 1.00 . A A . 11 ALA C 1 1
9 2700 1 1 12 ALA CA C 16.249 2.845 -2.828 1.00 . A A . 11 ALA CA 1 1
9 2701 1 1 12 ALA CB C 17.381 3.764 -2.365 1.00 . A A . 11 ALA CB 1 1
9 2702 1 1 12 ALA H H 16.449 1.855 -0.958 1.00 . A A . 11 ALA H 1 1
9 2703 1 1 12 ALA HA H 15.372 3.446 -3.003 1.00 . A A . 11 ALA HA 1 1
9 2704 1 1 12 ALA HB1 H 17.022 4.410 -1.578 1.00 . A A . 11 ALA HB1 1 1
9 2705 1 1 12 ALA HB2 H 17.718 4.364 -3.199 1.00 . A A . 11 ALA HB2 1 1
9 2706 1 1 12 ALA HB3 H 18.202 3.166 -1.997 1.00 . A A . 11 ALA HB3 1 1
9 2707 1 1 12 ALA N N 15.943 1.853 -1.797 1.00 . A A . 11 ALA N 1 1
9 2708 1 1 12 ALA O O 16.945 2.845 -5.122 1.00 . A A . 11 ALA O 1 1
9 2709 1 1 13 LEU C C 16.112 0.470 -6.490 1.00 . A A . 12 LEU C 1 1
9 2710 1 1 13 LEU CA C 17.067 0.132 -5.351 1.00 . A A . 12 LEU CA 1 1
9 2711 1 1 13 LEU CB C 17.048 -1.378 -5.100 1.00 . A A . 12 LEU CB 1 1
9 2712 1 1 13 LEU CD1 C 17.724 -3.111 -3.408 1.00 . A A . 12 LEU CD1 1 1
9 2713 1 1 13 LEU CD2 C 19.493 -1.855 -4.635 1.00 . A A . 12 LEU CD2 1 1
9 2714 1 1 13 LEU CG C 18.086 -1.756 -4.022 1.00 . A A . 12 LEU CG 1 1
9 2715 1 1 13 LEU H H 16.451 0.354 -3.328 1.00 . A A . 12 LEU H 1 1
9 2716 1 1 13 LEU HA H 18.062 0.427 -5.631 1.00 . A A . 12 LEU HA 1 1
9 2717 1 1 13 LEU HB2 H 16.056 -1.662 -4.768 1.00 . A A . 12 LEU HB2 1 1
9 2718 1 1 13 LEU HB3 H 17.275 -1.894 -6.018 1.00 . A A . 12 LEU HB3 1 1
9 2719 1 1 13 LEU HD11 H 17.782 -3.878 -4.166 1.00 . A A . 12 LEU HD11 1 1
9 2720 1 1 13 LEU HD12 H 16.720 -3.071 -3.011 1.00 . A A . 12 LEU HD12 1 1
9 2721 1 1 13 LEU HD13 H 18.415 -3.340 -2.610 1.00 . A A . 12 LEU HD13 1 1
9 2722 1 1 13 LEU HD21 H 20.165 -2.297 -3.915 1.00 . A A . 12 LEU HD21 1 1
9 2723 1 1 13 LEU HD22 H 19.850 -0.869 -4.892 1.00 . A A . 12 LEU HD22 1 1
9 2724 1 1 13 LEU HD23 H 19.468 -2.470 -5.523 1.00 . A A . 12 LEU HD23 1 1
9 2725 1 1 13 LEU HG H 18.081 -1.006 -3.241 1.00 . A A . 12 LEU HG 1 1
9 2726 1 1 13 LEU N N 16.684 0.847 -4.141 1.00 . A A . 12 LEU N 1 1
9 2727 1 1 13 LEU O O 16.532 0.991 -7.523 1.00 . A A . 12 LEU O 1 1
9 2728 1 1 14 ALA C C 13.946 1.903 -7.801 1.00 . A A . 13 ALA C 1 1
9 2729 1 1 14 ALA CA C 13.843 0.458 -7.340 1.00 . A A . 13 ALA CA 1 1
9 2730 1 1 14 ALA CB C 12.431 0.185 -6.818 1.00 . A A . 13 ALA CB 1 1
9 2731 1 1 14 ALA H H 14.538 -0.243 -5.468 1.00 . A A . 13 ALA H 1 1
9 2732 1 1 14 ALA HA H 14.030 -0.187 -8.182 1.00 . A A . 13 ALA HA 1 1
9 2733 1 1 14 ALA HB1 H 12.220 0.846 -5.991 1.00 . A A . 13 ALA HB1 1 1
9 2734 1 1 14 ALA HB2 H 12.362 -0.840 -6.487 1.00 . A A . 13 ALA HB2 1 1
9 2735 1 1 14 ALA HB3 H 11.716 0.358 -7.609 1.00 . A A . 13 ALA HB3 1 1
9 2736 1 1 14 ALA N N 14.830 0.174 -6.305 1.00 . A A . 13 ALA N 1 1
9 2737 1 1 14 ALA O O 13.550 2.234 -8.919 1.00 . A A . 13 ALA O 1 1
9 2738 1 1 15 LEU C C 15.901 4.339 -8.106 1.00 . A A . 14 LEU C 1 1
9 2739 1 1 15 LEU CA C 14.639 4.169 -7.286 1.00 . A A . 14 LEU CA 1 1
9 2740 1 1 15 LEU CB C 14.697 5.034 -6.009 1.00 . A A . 14 LEU CB 1 1
9 2741 1 1 15 LEU CD1 C 14.456 7.520 -5.480 1.00 . A A . 14 LEU CD1 1 1
9 2742 1 1 15 LEU CD2 C 16.712 6.627 -6.022 1.00 . A A . 14 LEU CD2 1 1
9 2743 1 1 15 LEU CG C 15.205 6.485 -6.329 1.00 . A A . 14 LEU CG 1 1
9 2744 1 1 15 LEU H H 14.790 2.442 -6.073 1.00 . A A . 14 LEU H 1 1
9 2745 1 1 15 LEU HA H 13.796 4.481 -7.884 1.00 . A A . 14 LEU HA 1 1
9 2746 1 1 15 LEU HB2 H 13.698 5.075 -5.588 1.00 . A A . 14 LEU HB2 1 1
9 2747 1 1 15 LEU HB3 H 15.353 4.564 -5.295 1.00 . A A . 14 LEU HB3 1 1
9 2748 1 1 15 LEU HD11 H 14.500 7.234 -4.440 1.00 . A A . 14 LEU HD11 1 1
9 2749 1 1 15 LEU HD12 H 13.426 7.566 -5.799 1.00 . A A . 14 LEU HD12 1 1
9 2750 1 1 15 LEU HD13 H 14.917 8.489 -5.609 1.00 . A A . 14 LEU HD13 1 1
9 2751 1 1 15 LEU HD21 H 16.912 6.283 -5.017 1.00 . A A . 14 LEU HD21 1 1
9 2752 1 1 15 LEU HD22 H 16.995 7.665 -6.105 1.00 . A A . 14 LEU HD22 1 1
9 2753 1 1 15 LEU HD23 H 17.286 6.045 -6.725 1.00 . A A . 14 LEU HD23 1 1
9 2754 1 1 15 LEU HG H 15.029 6.712 -7.374 1.00 . A A . 14 LEU HG 1 1
9 2755 1 1 15 LEU N N 14.486 2.762 -6.942 1.00 . A A . 14 LEU N 1 1
9 2756 1 1 15 LEU O O 15.881 4.929 -9.180 1.00 . A A . 14 LEU O 1 1
9 2757 1 1 16 ALA C C 18.134 3.231 -9.674 1.00 . A A . 15 ALA C 1 1
9 2758 1 1 16 ALA CA C 18.252 3.933 -8.327 1.00 . A A . 15 ALA CA 1 1
9 2759 1 1 16 ALA CB C 19.395 3.322 -7.515 1.00 . A A . 15 ALA CB 1 1
9 2760 1 1 16 ALA H H 16.977 3.351 -6.739 1.00 . A A . 15 ALA H 1 1
9 2761 1 1 16 ALA HA H 18.459 4.977 -8.499 1.00 . A A . 15 ALA HA 1 1
9 2762 1 1 16 ALA HB1 H 19.141 2.308 -7.242 1.00 . A A . 15 ALA HB1 1 1
9 2763 1 1 16 ALA HB2 H 19.553 3.907 -6.622 1.00 . A A . 15 ALA HB2 1 1
9 2764 1 1 16 ALA HB3 H 20.298 3.319 -8.109 1.00 . A A . 15 ALA HB3 1 1
9 2765 1 1 16 ALA N N 17.003 3.818 -7.603 1.00 . A A . 15 ALA N 1 1
9 2766 1 1 16 ALA O O 18.766 3.632 -10.648 1.00 . A A . 15 ALA O 1 1
9 2767 1 1 17 LEU C C 16.575 2.374 -12.033 1.00 . A A . 16 LEU C 1 1
9 2768 1 1 17 LEU CA C 17.147 1.445 -10.968 1.00 . A A . 16 LEU CA 1 1
9 2769 1 1 17 LEU CB C 16.215 0.214 -10.747 1.00 . A A . 16 LEU CB 1 1
9 2770 1 1 17 LEU CD1 C 17.724 -0.956 -9.111 1.00 . A A . 16 LEU CD1 1 1
9 2771 1 1 17 LEU CD2 C 16.085 -2.271 -10.477 1.00 . A A . 16 LEU CD2 1 1
9 2772 1 1 17 LEU CG C 17.031 -1.063 -10.472 1.00 . A A . 16 LEU CG 1 1
9 2773 1 1 17 LEU H H 16.843 1.901 -8.914 1.00 . A A . 16 LEU H 1 1
9 2774 1 1 17 LEU HA H 18.111 1.111 -11.303 1.00 . A A . 16 LEU HA 1 1
9 2775 1 1 17 LEU HB2 H 15.581 0.407 -9.898 1.00 . A A . 16 LEU HB2 1 1
9 2776 1 1 17 LEU HB3 H 15.593 0.051 -11.620 1.00 . A A . 16 LEU HB3 1 1
9 2777 1 1 17 LEU HD11 H 18.122 0.042 -8.987 1.00 . A A . 16 LEU HD11 1 1
9 2778 1 1 17 LEU HD12 H 18.529 -1.672 -9.062 1.00 . A A . 16 LEU HD12 1 1
9 2779 1 1 17 LEU HD13 H 17.013 -1.159 -8.323 1.00 . A A . 16 LEU HD13 1 1
9 2780 1 1 17 LEU HD21 H 15.736 -2.450 -11.483 1.00 . A A . 16 LEU HD21 1 1
9 2781 1 1 17 LEU HD22 H 15.240 -2.070 -9.834 1.00 . A A . 16 LEU HD22 1 1
9 2782 1 1 17 LEU HD23 H 16.613 -3.142 -10.118 1.00 . A A . 16 LEU HD23 1 1
9 2783 1 1 17 LEU HG H 17.779 -1.188 -11.245 1.00 . A A . 16 LEU HG 1 1
9 2784 1 1 17 LEU N N 17.321 2.179 -9.724 1.00 . A A . 16 LEU N 1 1
9 2785 1 1 17 LEU O O 17.154 2.528 -13.107 1.00 . A A . 16 LEU O 1 1
9 2786 1 1 18 TRP C C 15.548 5.223 -12.772 1.00 . A A . 17 TRP C 1 1
9 2787 1 1 18 TRP CA C 14.797 3.878 -12.693 1.00 . A A . 17 TRP CA 1 1
9 2788 1 1 18 TRP CB C 13.299 4.029 -12.294 1.00 . A A . 17 TRP CB 1 1
9 2789 1 1 18 TRP CD1 C 12.116 5.790 -13.699 1.00 . A A . 17 TRP CD1 1 1
9 2790 1 1 18 TRP CD2 C 12.887 6.555 -11.745 1.00 . A A . 17 TRP CD2 1 1
9 2791 1 1 18 TRP CE2 C 12.274 7.651 -12.378 1.00 . A A . 17 TRP CE2 1 1
9 2792 1 1 18 TRP CE3 C 13.463 6.740 -10.494 1.00 . A A . 17 TRP CE3 1 1
9 2793 1 1 18 TRP CG C 12.777 5.400 -12.589 1.00 . A A . 17 TRP CG 1 1
9 2794 1 1 18 TRP CH2 C 12.824 9.077 -10.514 1.00 . A A . 17 TRP CH2 1 1
9 2795 1 1 18 TRP CZ2 C 12.237 8.907 -11.776 1.00 . A A . 17 TRP CZ2 1 1
9 2796 1 1 18 TRP CZ3 C 13.437 7.981 -9.878 1.00 . A A . 17 TRP CZ3 1 1
9 2797 1 1 18 TRP H H 14.991 2.822 -10.873 1.00 . A A . 17 TRP H 1 1
9 2798 1 1 18 TRP HA H 14.844 3.422 -13.672 1.00 . A A . 17 TRP HA 1 1
9 2799 1 1 18 TRP HB2 H 12.697 3.306 -12.828 1.00 . A A . 17 TRP HB2 1 1
9 2800 1 1 18 TRP HB3 H 13.212 3.839 -11.231 1.00 . A A . 17 TRP HB3 1 1
9 2801 1 1 18 TRP HD1 H 11.867 5.160 -14.539 1.00 . A A . 17 TRP HD1 1 1
9 2802 1 1 18 TRP HE1 H 11.337 7.676 -14.237 1.00 . A A . 17 TRP HE1 1 1
9 2803 1 1 18 TRP HE3 H 13.932 5.909 -10.000 1.00 . A A . 17 TRP HE3 1 1
9 2804 1 1 18 TRP HH2 H 12.805 10.044 -10.031 1.00 . A A . 17 TRP HH2 1 1
9 2805 1 1 18 TRP HZ2 H 11.763 9.735 -12.279 1.00 . A A . 17 TRP HZ2 1 1
9 2806 1 1 18 TRP HZ3 H 13.892 8.090 -8.913 1.00 . A A . 17 TRP HZ3 1 1
9 2807 1 1 18 TRP N N 15.434 2.981 -11.739 1.00 . A A . 17 TRP N 1 1
9 2808 1 1 18 TRP NE1 N 11.814 7.138 -13.575 1.00 . A A . 17 TRP NE1 1 1
9 2809 1 1 18 TRP O O 15.829 5.704 -13.869 1.00 . A A . 17 TRP O 1 1
9 2810 1 1 19 TRP C C 17.857 7.000 -12.469 1.00 . A A . 18 TRP C 1 1
9 2811 1 1 19 TRP CA C 16.581 7.106 -11.647 1.00 . A A . 18 TRP CA 1 1
9 2812 1 1 19 TRP CB C 16.947 7.489 -10.217 1.00 . A A . 18 TRP CB 1 1
9 2813 1 1 19 TRP CD1 C 17.323 9.903 -10.766 1.00 . A A . 18 TRP CD1 1 1
9 2814 1 1 19 TRP CD2 C 19.014 9.017 -9.599 1.00 . A A . 18 TRP CD2 1 1
9 2815 1 1 19 TRP CE2 C 19.360 10.366 -9.834 1.00 . A A . 18 TRP CE2 1 1
9 2816 1 1 19 TRP CE3 C 19.910 8.214 -8.877 1.00 . A A . 18 TRP CE3 1 1
9 2817 1 1 19 TRP CG C 17.721 8.757 -10.202 1.00 . A A . 18 TRP CG 1 1
9 2818 1 1 19 TRP CH2 C 21.443 10.090 -8.649 1.00 . A A . 18 TRP CH2 1 1
9 2819 1 1 19 TRP CZ2 C 20.559 10.903 -9.367 1.00 . A A . 18 TRP CZ2 1 1
9 2820 1 1 19 TRP CZ3 C 21.116 8.747 -8.405 1.00 . A A . 18 TRP CZ3 1 1
9 2821 1 1 19 TRP H H 15.644 5.438 -10.757 1.00 . A A . 18 TRP H 1 1
9 2822 1 1 19 TRP HA H 15.945 7.869 -12.059 1.00 . A A . 18 TRP HA 1 1
9 2823 1 1 19 TRP HB2 H 16.057 7.606 -9.636 1.00 . A A . 18 TRP HB2 1 1
9 2824 1 1 19 TRP HB3 H 17.545 6.710 -9.793 1.00 . A A . 18 TRP HB3 1 1
9 2825 1 1 19 TRP HD1 H 16.401 10.035 -11.293 1.00 . A A . 18 TRP HD1 1 1
9 2826 1 1 19 TRP HE1 H 18.246 11.797 -10.864 1.00 . A A . 18 TRP HE1 1 1
9 2827 1 1 19 TRP HE3 H 19.668 7.180 -8.685 1.00 . A A . 18 TRP HE3 1 1
9 2828 1 1 19 TRP HH2 H 22.374 10.495 -8.282 1.00 . A A . 18 TRP HH2 1 1
9 2829 1 1 19 TRP HZ2 H 20.803 11.938 -9.558 1.00 . A A . 18 TRP HZ2 1 1
9 2830 1 1 19 TRP HZ3 H 21.794 8.117 -7.853 1.00 . A A . 18 TRP HZ3 1 1
9 2831 1 1 19 TRP N N 15.872 5.829 -11.630 1.00 . A A . 18 TRP N 1 1
9 2832 1 1 19 TRP NE1 N 18.292 10.870 -10.553 1.00 . A A . 18 TRP NE1 1 1
9 2833 1 1 19 TRP O O 18.082 7.773 -13.399 1.00 . A A . 18 TRP O 1 1
9 2834 1 1 20 ALA C C 19.710 5.122 -14.145 1.00 . A A . 19 ALA C 1 1
9 2835 1 1 20 ALA CA C 19.944 5.819 -12.807 1.00 . A A . 19 ALA CA 1 1
9 2836 1 1 20 ALA CB C 20.896 4.987 -11.938 1.00 . A A . 19 ALA CB 1 1
9 2837 1 1 20 ALA H H 18.441 5.456 -11.356 1.00 . A A . 19 ALA H 1 1
9 2838 1 1 20 ALA HA H 20.401 6.778 -12.992 1.00 . A A . 19 ALA HA 1 1
9 2839 1 1 20 ALA HB1 H 20.805 5.297 -10.906 1.00 . A A . 19 ALA HB1 1 1
9 2840 1 1 20 ALA HB2 H 21.913 5.140 -12.270 1.00 . A A . 19 ALA HB2 1 1
9 2841 1 1 20 ALA HB3 H 20.646 3.939 -12.023 1.00 . A A . 19 ALA HB3 1 1
9 2842 1 1 20 ALA N N 18.684 6.033 -12.109 1.00 . A A . 19 ALA N 1 1
9 2843 1 1 20 ALA O O 20.459 5.325 -15.100 1.00 . A A . 19 ALA O 1 1
9 2844 1 1 21 ETA CA C 18.351 3.584 -15.439 1.00 . A A . 20 ETA CA 1 1
9 2845 1 1 21 ETA CB C 19.359 2.461 -15.671 1.00 . A A . 20 ETA CB 1 1
9 2846 1 1 21 ETA HA1 H 18.393 4.267 -16.271 1.00 . A A . 20 ETA HA1 1 1
9 2847 1 1 21 ETA HA2 H 17.356 3.167 -15.365 1.00 . A A . 20 ETA HA2 1 1
9 2848 1 1 21 ETA HB1 H 19.295 2.130 -16.702 1.00 . A A . 20 ETA HB1 1 1
9 2849 1 1 21 ETA HB2 H 19.140 1.634 -15.022 1.00 . A A . 20 ETA HB2 1 1
9 2850 1 1 21 ETA HN2 H 18.102 4.175 -13.416 1.00 . A A . 20 ETA HN2 1 1
9 2851 1 1 21 ETA HO H 20.917 2.610 -14.515 1.00 . A A . 20 ETA HO 1 1
9 2852 1 1 21 ETA N N 18.667 4.300 -14.209 1.00 . A A . 20 ETA N 1 1
9 2853 1 1 21 ETA O O 20.666 2.941 -15.381 1.00 . A A . 20 ETA O 1 1
10 2854 1 1 1 ACE C C 14.105 -6.607 13.914 1.00 . A A . 0 ACE C 1 1
10 2855 1 1 1 ACE CH3 C 15.184 -7.445 13.237 1.00 . A A . 0 ACE CH3 1 1
10 2856 1 1 1 ACE H1 H 16.098 -6.873 13.182 1.00 . A A . 0 ACE H1 1 1
10 2857 1 1 1 ACE H2 H 14.863 -7.711 12.241 1.00 . A A . 0 ACE H2 1 1
10 2858 1 1 1 ACE H3 H 15.356 -8.343 13.811 1.00 . A A . 0 ACE H3 1 1
10 2859 1 1 1 ACE O O 13.628 -6.953 14.996 1.00 . A A . 0 ACE O 1 1
10 2860 1 1 2 GLY C C 11.984 -3.899 12.689 1.00 . A A . 1 GLY C 1 1
10 2861 1 1 2 GLY CA C 12.707 -4.618 13.809 1.00 . A A . 1 GLY CA 1 1
10 2862 1 1 2 GLY H H 14.128 -5.266 12.422 1.00 . A A . 1 GLY H 1 1
10 2863 1 1 2 GLY HA2 H 11.994 -5.181 14.384 1.00 . A A . 1 GLY HA2 1 1
10 2864 1 1 2 GLY HA3 H 13.177 -3.882 14.442 1.00 . A A . 1 GLY HA3 1 1
10 2865 1 1 2 GLY N N 13.722 -5.500 13.273 1.00 . A A . 1 GLY N 1 1
10 2866 1 1 2 GLY O O 11.562 -4.496 11.701 1.00 . A A . 1 GLY O 1 1
10 2867 1 1 3 TRP C C 11.938 -1.749 10.555 1.00 . A A . 2 TRP C 1 1
10 2868 1 1 3 TRP CA C 11.175 -1.765 11.899 1.00 . A A . 2 TRP CA 1 1
10 2869 1 1 3 TRP CB C 10.979 -0.337 12.515 1.00 . A A . 2 TRP CB 1 1
10 2870 1 1 3 TRP CD1 C 12.724 1.292 11.770 1.00 . A A . 2 TRP CD1 1 1
10 2871 1 1 3 TRP CD2 C 10.894 1.369 10.477 1.00 . A A . 2 TRP CD2 1 1
10 2872 1 1 3 TRP CE2 C 11.791 2.323 9.952 1.00 . A A . 2 TRP CE2 1 1
10 2873 1 1 3 TRP CE3 C 9.648 1.209 9.846 1.00 . A A . 2 TRP CE3 1 1
10 2874 1 1 3 TRP CG C 11.517 0.737 11.628 1.00 . A A . 2 TRP CG 1 1
10 2875 1 1 3 TRP CH2 C 10.223 2.925 8.220 1.00 . A A . 2 TRP CH2 1 1
10 2876 1 1 3 TRP CZ2 C 11.466 3.093 8.837 1.00 . A A . 2 TRP CZ2 1 1
10 2877 1 1 3 TRP CZ3 C 9.314 1.983 8.723 1.00 . A A . 2 TRP CZ3 1 1
10 2878 1 1 3 TRP H H 12.215 -2.230 13.691 1.00 . A A . 2 TRP H 1 1
10 2879 1 1 3 TRP HA H 10.199 -2.194 11.715 1.00 . A A . 2 TRP HA 1 1
10 2880 1 1 3 TRP HB2 H 9.935 -0.139 12.686 1.00 . A A . 2 TRP HB2 1 1
10 2881 1 1 3 TRP HB3 H 11.495 -0.301 13.464 1.00 . A A . 2 TRP HB3 1 1
10 2882 1 1 3 TRP HD1 H 13.432 1.029 12.538 1.00 . A A . 2 TRP HD1 1 1
10 2883 1 1 3 TRP HE1 H 13.698 2.794 10.652 1.00 . A A . 2 TRP HE1 1 1
10 2884 1 1 3 TRP HE3 H 8.943 0.487 10.228 1.00 . A A . 2 TRP HE3 1 1
10 2885 1 1 3 TRP HH2 H 9.962 3.517 7.354 1.00 . A A . 2 TRP HH2 1 1
10 2886 1 1 3 TRP HZ2 H 12.170 3.814 8.455 1.00 . A A . 2 TRP HZ2 1 1
10 2887 1 1 3 TRP HZ3 H 8.355 1.852 8.246 1.00 . A A . 2 TRP HZ3 1 1
10 2888 1 1 3 TRP N N 11.850 -2.613 12.872 1.00 . A A . 2 TRP N 1 1
10 2889 1 1 3 TRP NE1 N 12.899 2.241 10.775 1.00 . A A . 2 TRP NE1 1 1
10 2890 1 1 3 TRP O O 11.327 -1.604 9.496 1.00 . A A . 2 TRP O 1 1
10 2891 1 1 4 TRP C C 13.564 -2.838 8.311 1.00 . A A . 3 TRP C 1 1
10 2892 1 1 4 TRP CA C 14.093 -1.881 9.393 1.00 . A A . 3 TRP CA 1 1
10 2893 1 1 4 TRP CB C 15.561 -2.211 9.783 1.00 . A A . 3 TRP CB 1 1
10 2894 1 1 4 TRP CD1 C 15.672 -4.446 10.919 1.00 . A A . 3 TRP CD1 1 1
10 2895 1 1 4 TRP CD2 C 16.184 -4.576 8.740 1.00 . A A . 3 TRP CD2 1 1
10 2896 1 1 4 TRP CE2 C 16.279 -5.887 9.254 1.00 . A A . 3 TRP CE2 1 1
10 2897 1 1 4 TRP CE3 C 16.460 -4.377 7.377 1.00 . A A . 3 TRP CE3 1 1
10 2898 1 1 4 TRP CG C 15.794 -3.685 9.823 1.00 . A A . 3 TRP CG 1 1
10 2899 1 1 4 TRP CH2 C 16.904 -6.749 7.095 1.00 . A A . 3 TRP CH2 1 1
10 2900 1 1 4 TRP CZ2 C 16.634 -6.965 8.449 1.00 . A A . 3 TRP CZ2 1 1
10 2901 1 1 4 TRP CZ3 C 16.818 -5.457 6.560 1.00 . A A . 3 TRP CZ3 1 1
10 2902 1 1 4 TRP H H 13.725 -1.999 11.461 1.00 . A A . 3 TRP H 1 1
10 2903 1 1 4 TRP HA H 14.076 -0.884 8.981 1.00 . A A . 3 TRP HA 1 1
10 2904 1 1 4 TRP HB2 H 16.236 -1.781 9.075 1.00 . A A . 3 TRP HB2 1 1
10 2905 1 1 4 TRP HB3 H 15.765 -1.797 10.761 1.00 . A A . 3 TRP HB3 1 1
10 2906 1 1 4 TRP HD1 H 15.397 -4.084 11.892 1.00 . A A . 3 TRP HD1 1 1
10 2907 1 1 4 TRP HE1 H 15.943 -6.515 11.204 1.00 . A A . 3 TRP HE1 1 1
10 2908 1 1 4 TRP HE3 H 16.400 -3.389 6.955 1.00 . A A . 3 TRP HE3 1 1
10 2909 1 1 4 TRP HH2 H 17.178 -7.574 6.462 1.00 . A A . 3 TRP HH2 1 1
10 2910 1 1 4 TRP HZ2 H 16.698 -7.957 8.868 1.00 . A A . 3 TRP HZ2 1 1
10 2911 1 1 4 TRP HZ3 H 17.027 -5.291 5.514 1.00 . A A . 3 TRP HZ3 1 1
10 2912 1 1 4 TRP N N 13.264 -1.889 10.604 1.00 . A A . 3 TRP N 1 1
10 2913 1 1 4 TRP NE1 N 15.960 -5.758 10.587 1.00 . A A . 3 TRP NE1 1 1
10 2914 1 1 4 TRP O O 14.145 -2.942 7.242 1.00 . A A . 3 TRP O 1 1
10 2915 1 1 5 LEU C C 11.271 -3.689 6.439 1.00 . A A . 4 LEU C 1 1
10 2916 1 1 5 LEU CA C 11.922 -4.446 7.592 1.00 . A A . 4 LEU CA 1 1
10 2917 1 1 5 LEU CB C 10.895 -5.351 8.264 1.00 . A A . 4 LEU CB 1 1
10 2918 1 1 5 LEU CD1 C 10.621 -6.925 10.215 1.00 . A A . 4 LEU CD1 1 1
10 2919 1 1 5 LEU CD2 C 12.125 -7.577 8.337 1.00 . A A . 4 LEU CD2 1 1
10 2920 1 1 5 LEU CG C 11.603 -6.388 9.170 1.00 . A A . 4 LEU CG 1 1
10 2921 1 1 5 LEU H H 12.009 -3.433 9.424 1.00 . A A . 4 LEU H 1 1
10 2922 1 1 5 LEU HA H 12.714 -5.049 7.200 1.00 . A A . 4 LEU HA 1 1
10 2923 1 1 5 LEU HB2 H 10.239 -4.727 8.858 1.00 . A A . 4 LEU HB2 1 1
10 2924 1 1 5 LEU HB3 H 10.313 -5.859 7.513 1.00 . A A . 4 LEU HB3 1 1
10 2925 1 1 5 LEU HD11 H 9.875 -7.534 9.727 1.00 . A A . 4 LEU HD11 1 1
10 2926 1 1 5 LEU HD12 H 10.142 -6.104 10.724 1.00 . A A . 4 LEU HD12 1 1
10 2927 1 1 5 LEU HD13 H 11.158 -7.526 10.932 1.00 . A A . 4 LEU HD13 1 1
10 2928 1 1 5 LEU HD21 H 11.354 -7.920 7.664 1.00 . A A . 4 LEU HD21 1 1
10 2929 1 1 5 LEU HD22 H 12.401 -8.384 8.999 1.00 . A A . 4 LEU HD22 1 1
10 2930 1 1 5 LEU HD23 H 12.991 -7.275 7.770 1.00 . A A . 4 LEU HD23 1 1
10 2931 1 1 5 LEU HG H 12.431 -5.912 9.681 1.00 . A A . 4 LEU HG 1 1
10 2932 1 1 5 LEU N N 12.472 -3.529 8.575 1.00 . A A . 4 LEU N 1 1
10 2933 1 1 5 LEU O O 11.109 -4.235 5.351 1.00 . A A . 4 LEU O 1 1
10 2934 1 1 6 ALA C C 11.294 -1.181 4.597 1.00 . A A . 5 ALA C 1 1
10 2935 1 1 6 ALA CA C 10.269 -1.622 5.639 1.00 . A A . 5 ALA CA 1 1
10 2936 1 1 6 ALA CB C 9.629 -0.384 6.269 1.00 . A A . 5 ALA CB 1 1
10 2937 1 1 6 ALA H H 11.052 -2.036 7.556 1.00 . A A . 5 ALA H 1 1
10 2938 1 1 6 ALA HA H 9.499 -2.201 5.159 1.00 . A A . 5 ALA HA 1 1
10 2939 1 1 6 ALA HB1 H 9.010 -0.683 7.100 1.00 . A A . 5 ALA HB1 1 1
10 2940 1 1 6 ALA HB2 H 9.025 0.126 5.532 1.00 . A A . 5 ALA HB2 1 1
10 2941 1 1 6 ALA HB3 H 10.405 0.284 6.621 1.00 . A A . 5 ALA HB3 1 1
10 2942 1 1 6 ALA N N 10.902 -2.436 6.677 1.00 . A A . 5 ALA N 1 1
10 2943 1 1 6 ALA O O 10.930 -0.684 3.532 1.00 . A A . 5 ALA O 1 1
10 2944 1 1 7 LEU C C 13.809 -2.036 2.909 1.00 . A A . 6 LEU C 1 1
10 2945 1 1 7 LEU CA C 13.644 -0.984 4.000 1.00 . A A . 6 LEU CA 1 1
10 2946 1 1 7 LEU CB C 14.952 -0.845 4.786 1.00 . A A . 6 LEU CB 1 1
10 2947 1 1 7 LEU CD1 C 15.988 0.428 6.684 1.00 . A A . 6 LEU CD1 1 1
10 2948 1 1 7 LEU CD2 C 15.552 1.603 4.543 1.00 . A A . 6 LEU CD2 1 1
10 2949 1 1 7 LEU CG C 15.031 0.521 5.500 1.00 . A A . 6 LEU CG 1 1
10 2950 1 1 7 LEU H H 12.802 -1.765 5.775 1.00 . A A . 6 LEU H 1 1
10 2951 1 1 7 LEU HA H 13.404 -0.045 3.553 1.00 . A A . 6 LEU HA 1 1
10 2952 1 1 7 LEU HB2 H 14.972 -1.630 5.512 1.00 . A A . 6 LEU HB2 1 1
10 2953 1 1 7 LEU HB3 H 15.795 -0.953 4.128 1.00 . A A . 6 LEU HB3 1 1
10 2954 1 1 7 LEU HD11 H 16.017 1.374 7.203 1.00 . A A . 6 LEU HD11 1 1
10 2955 1 1 7 LEU HD12 H 16.977 0.179 6.329 1.00 . A A . 6 LEU HD12 1 1
10 2956 1 1 7 LEU HD13 H 15.646 -0.339 7.351 1.00 . A A . 6 LEU HD13 1 1
10 2957 1 1 7 LEU HD21 H 16.467 1.267 4.078 1.00 . A A . 6 LEU HD21 1 1
10 2958 1 1 7 LEU HD22 H 15.748 2.507 5.101 1.00 . A A . 6 LEU HD22 1 1
10 2959 1 1 7 LEU HD23 H 14.813 1.802 3.786 1.00 . A A . 6 LEU HD23 1 1
10 2960 1 1 7 LEU HG H 14.054 0.790 5.854 1.00 . A A . 6 LEU HG 1 1
10 2961 1 1 7 LEU N N 12.573 -1.366 4.911 1.00 . A A . 6 LEU N 1 1
10 2962 1 1 7 LEU O O 14.301 -1.744 1.821 1.00 . A A . 6 LEU O 1 1
10 2963 1 1 8 ALA C C 12.273 -4.374 1.324 1.00 . A A . 7 ALA C 1 1
10 2964 1 1 8 ALA CA C 13.493 -4.356 2.245 1.00 . A A . 7 ALA CA 1 1
10 2965 1 1 8 ALA CB C 13.594 -5.689 2.989 1.00 . A A . 7 ALA CB 1 1
10 2966 1 1 8 ALA H H 13.003 -3.438 4.086 1.00 . A A . 7 ALA H 1 1
10 2967 1 1 8 ALA HA H 14.383 -4.226 1.651 1.00 . A A . 7 ALA HA 1 1
10 2968 1 1 8 ALA HB1 H 12.645 -5.918 3.452 1.00 . A A . 7 ALA HB1 1 1
10 2969 1 1 8 ALA HB2 H 14.356 -5.616 3.751 1.00 . A A . 7 ALA HB2 1 1
10 2970 1 1 8 ALA HB3 H 13.853 -6.473 2.292 1.00 . A A . 7 ALA HB3 1 1
10 2971 1 1 8 ALA N N 13.392 -3.260 3.207 1.00 . A A . 7 ALA N 1 1
10 2972 1 1 8 ALA O O 12.277 -5.028 0.280 1.00 . A A . 7 ALA O 1 1
10 2973 1 1 9 LEU C C 10.009 -2.386 -0.009 1.00 . A A . 8 LEU C 1 1
10 2974 1 1 9 LEU CA C 9.989 -3.572 0.948 1.00 . A A . 8 LEU CA 1 1
10 2975 1 1 9 LEU CB C 8.804 -3.419 1.893 1.00 . A A . 8 LEU CB 1 1
10 2976 1 1 9 LEU CD1 C 7.636 -4.330 3.905 1.00 . A A . 8 LEU CD1 1 1
10 2977 1 1 9 LEU CD2 C 8.627 -5.917 2.234 1.00 . A A . 8 LEU CD2 1 1
10 2978 1 1 9 LEU CG C 8.797 -4.551 2.931 1.00 . A A . 8 LEU CG 1 1
10 2979 1 1 9 LEU H H 11.287 -3.155 2.562 1.00 . A A . 8 LEU H 1 1
10 2980 1 1 9 LEU HA H 9.860 -4.473 0.381 1.00 . A A . 8 LEU HA 1 1
10 2981 1 1 9 LEU HB2 H 8.889 -2.466 2.400 1.00 . A A . 8 LEU HB2 1 1
10 2982 1 1 9 LEU HB3 H 7.887 -3.445 1.326 1.00 . A A . 8 LEU HB3 1 1
10 2983 1 1 9 LEU HD11 H 7.772 -4.958 4.774 1.00 . A A . 8 LEU HD11 1 1
10 2984 1 1 9 LEU HD12 H 6.708 -4.588 3.417 1.00 . A A . 8 LEU HD12 1 1
10 2985 1 1 9 LEU HD13 H 7.608 -3.293 4.209 1.00 . A A . 8 LEU HD13 1 1
10 2986 1 1 9 LEU HD21 H 7.921 -5.826 1.423 1.00 . A A . 8 LEU HD21 1 1
10 2987 1 1 9 LEU HD22 H 8.262 -6.647 2.946 1.00 . A A . 8 LEU HD22 1 1
10 2988 1 1 9 LEU HD23 H 9.579 -6.249 1.849 1.00 . A A . 8 LEU HD23 1 1
10 2989 1 1 9 LEU HG H 9.729 -4.533 3.478 1.00 . A A . 8 LEU HG 1 1
10 2990 1 1 9 LEU N N 11.228 -3.650 1.724 1.00 . A A . 8 LEU N 1 1
10 2991 1 1 9 LEU O O 9.262 -2.361 -0.987 1.00 . A A . 8 LEU O 1 1
10 2992 1 1 10 ALA C C 12.364 0.378 -0.524 1.00 . A A . 9 ALA C 1 1
10 2993 1 1 10 ALA CA C 10.959 -0.212 -0.579 1.00 . A A . 9 ALA CA 1 1
10 2994 1 1 10 ALA CB C 9.943 0.842 -0.134 1.00 . A A . 9 ALA CB 1 1
10 2995 1 1 10 ALA H H 11.431 -1.468 1.061 1.00 . A A . 9 ALA H 1 1
10 2996 1 1 10 ALA HA H 10.744 -0.489 -1.597 1.00 . A A . 9 ALA HA 1 1
10 2997 1 1 10 ALA HB1 H 10.269 1.287 0.796 1.00 . A A . 9 ALA HB1 1 1
10 2998 1 1 10 ALA HB2 H 8.981 0.377 0.009 1.00 . A A . 9 ALA HB2 1 1
10 2999 1 1 10 ALA HB3 H 9.865 1.610 -0.891 1.00 . A A . 9 ALA HB3 1 1
10 3000 1 1 10 ALA N N 10.861 -1.399 0.272 1.00 . A A . 9 ALA N 1 1
10 3001 1 1 10 ALA O O 12.540 1.558 -0.219 1.00 . A A . 9 ALA O 1 1
10 3002 1 1 11 PRO C C 15.070 1.015 -1.951 1.00 . A A . 10 PRO C 1 1
10 3003 1 1 11 PRO CA C 14.784 0.037 -0.803 1.00 . A A . 10 PRO CA 1 1
10 3004 1 1 11 PRO CB C 15.575 -1.273 -0.941 1.00 . A A . 10 PRO CB 1 1
10 3005 1 1 11 PRO CD C 13.244 -1.838 -1.191 1.00 . A A . 10 PRO CD 1 1
10 3006 1 1 11 PRO CG C 14.651 -2.202 -1.664 1.00 . A A . 10 PRO CG 1 1
10 3007 1 1 11 PRO HA H 15.022 0.497 0.141 1.00 . A A . 10 PRO HA 1 1
10 3008 1 1 11 PRO HB2 H 16.478 -1.110 -1.506 1.00 . A A . 10 PRO HB2 1 1
10 3009 1 1 11 PRO HB3 H 15.812 -1.682 0.031 1.00 . A A . 10 PRO HB3 1 1
10 3010 1 1 11 PRO HD2 H 12.528 -1.967 -1.993 1.00 . A A . 10 PRO HD2 1 1
10 3011 1 1 11 PRO HD3 H 12.963 -2.420 -0.327 1.00 . A A . 10 PRO HD3 1 1
10 3012 1 1 11 PRO HG2 H 14.746 -2.054 -2.738 1.00 . A A . 10 PRO HG2 1 1
10 3013 1 1 11 PRO HG3 H 14.862 -3.231 -1.409 1.00 . A A . 10 PRO HG3 1 1
10 3014 1 1 11 PRO N N 13.360 -0.417 -0.816 1.00 . A A . 10 PRO N 1 1
10 3015 1 1 11 PRO O O 14.425 0.965 -2.999 1.00 . A A . 10 PRO O 1 1
10 3016 1 1 12 ALA C C 16.787 2.203 -4.056 1.00 . A A . 11 ALA C 1 1
10 3017 1 1 12 ALA CA C 16.398 2.885 -2.753 1.00 . A A . 11 ALA CA 1 1
10 3018 1 1 12 ALA CB C 17.562 3.748 -2.270 1.00 . A A . 11 ALA CB 1 1
10 3019 1 1 12 ALA H H 16.515 1.895 -0.884 1.00 . A A . 11 ALA H 1 1
10 3020 1 1 12 ALA HA H 15.548 3.525 -2.932 1.00 . A A . 11 ALA HA 1 1
10 3021 1 1 12 ALA HB1 H 18.347 3.112 -1.890 1.00 . A A . 11 ALA HB1 1 1
10 3022 1 1 12 ALA HB2 H 17.221 4.410 -1.488 1.00 . A A . 11 ALA HB2 1 1
10 3023 1 1 12 ALA HB3 H 17.944 4.333 -3.099 1.00 . A A . 11 ALA HB3 1 1
10 3024 1 1 12 ALA N N 16.037 1.901 -1.738 1.00 . A A . 11 ALA N 1 1
10 3025 1 1 12 ALA O O 17.052 2.869 -5.056 1.00 . A A . 11 ALA O 1 1
10 3026 1 1 13 LEU C C 16.209 0.475 -6.365 1.00 . A A . 12 LEU C 1 1
10 3027 1 1 13 LEU CA C 17.191 0.152 -5.247 1.00 . A A . 12 LEU CA 1 1
10 3028 1 1 13 LEU CB C 17.190 -1.355 -4.978 1.00 . A A . 12 LEU CB 1 1
10 3029 1 1 13 LEU CD1 C 17.885 -3.067 -3.275 1.00 . A A . 12 LEU CD1 1 1
10 3030 1 1 13 LEU CD2 C 19.641 -1.770 -4.489 1.00 . A A . 12 LEU CD2 1 1
10 3031 1 1 13 LEU CG C 18.224 -1.706 -3.890 1.00 . A A . 12 LEU CG 1 1
10 3032 1 1 13 LEU H H 16.610 0.396 -3.219 1.00 . A A . 12 LEU H 1 1
10 3033 1 1 13 LEU HA H 18.177 0.453 -5.553 1.00 . A A . 12 LEU HA 1 1
10 3034 1 1 13 LEU HB2 H 16.202 -1.647 -4.648 1.00 . A A . 12 LEU HB2 1 1
10 3035 1 1 13 LEU HB3 H 17.430 -1.881 -5.887 1.00 . A A . 12 LEU HB3 1 1
10 3036 1 1 13 LEU HD11 H 18.625 -3.325 -2.534 1.00 . A A . 12 LEU HD11 1 1
10 3037 1 1 13 LEU HD12 H 17.873 -3.819 -4.050 1.00 . A A . 12 LEU HD12 1 1
10 3038 1 1 13 LEU HD13 H 16.912 -3.017 -2.810 1.00 . A A . 12 LEU HD13 1 1
10 3039 1 1 13 LEU HD21 H 20.315 -2.201 -3.762 1.00 . A A . 12 LEU HD21 1 1
10 3040 1 1 13 LEU HD22 H 19.979 -0.777 -4.739 1.00 . A A . 12 LEU HD22 1 1
10 3041 1 1 13 LEU HD23 H 19.637 -2.383 -5.377 1.00 . A A . 12 LEU HD23 1 1
10 3042 1 1 13 LEU HG H 18.191 -0.953 -3.112 1.00 . A A . 12 LEU HG 1 1
10 3043 1 1 13 LEU N N 16.825 0.879 -4.045 1.00 . A A . 12 LEU N 1 1
10 3044 1 1 13 LEU O O 16.603 0.983 -7.415 1.00 . A A . 12 LEU O 1 1
10 3045 1 1 14 ALA C C 14.029 1.891 -7.653 1.00 . A A . 13 ALA C 1 1
10 3046 1 1 14 ALA CA C 13.921 0.454 -7.160 1.00 . A A . 13 ALA CA 1 1
10 3047 1 1 14 ALA CB C 12.526 0.192 -6.590 1.00 . A A . 13 ALA CB 1 1
10 3048 1 1 14 ALA H H 14.658 -0.226 -5.299 1.00 . A A . 13 ALA H 1 1
10 3049 1 1 14 ALA HA H 14.083 -0.207 -7.998 1.00 . A A . 13 ALA HA 1 1
10 3050 1 1 14 ALA HB1 H 11.787 0.313 -7.368 1.00 . A A . 13 ALA HB1 1 1
10 3051 1 1 14 ALA HB2 H 12.325 0.892 -5.791 1.00 . A A . 13 ALA HB2 1 1
10 3052 1 1 14 ALA HB3 H 12.481 -0.815 -6.204 1.00 . A A . 13 ALA HB3 1 1
10 3053 1 1 14 ALA N N 14.932 0.182 -6.147 1.00 . A A . 13 ALA N 1 1
10 3054 1 1 14 ALA O O 13.636 2.203 -8.776 1.00 . A A . 13 ALA O 1 1
10 3055 1 1 15 LEU C C 15.979 4.317 -8.030 1.00 . A A . 14 LEU C 1 1
10 3056 1 1 15 LEU CA C 14.726 4.167 -7.184 1.00 . A A . 14 LEU CA 1 1
10 3057 1 1 15 LEU CB C 14.805 5.056 -5.927 1.00 . A A . 14 LEU CB 1 1
10 3058 1 1 15 LEU CD1 C 14.577 7.553 -5.442 1.00 . A A . 14 LEU CD1 1 1
10 3059 1 1 15 LEU CD2 C 16.819 6.643 -5.998 1.00 . A A . 14 LEU CD2 1 1
10 3060 1 1 15 LEU CG C 15.310 6.498 -6.283 1.00 . A A . 14 LEU CG 1 1
10 3061 1 1 15 LEU H H 14.870 2.462 -5.935 1.00 . A A . 14 LEU H 1 1
10 3062 1 1 15 LEU HA H 13.875 4.470 -7.776 1.00 . A A . 14 LEU HA 1 1
10 3063 1 1 15 LEU HB2 H 13.814 5.105 -5.490 1.00 . A A . 14 LEU HB2 1 1
10 3064 1 1 15 LEU HB3 H 15.473 4.597 -5.215 1.00 . A A . 14 LEU HB3 1 1
10 3065 1 1 15 LEU HD11 H 13.527 7.551 -5.695 1.00 . A A . 14 LEU HD11 1 1
10 3066 1 1 15 LEU HD12 H 14.994 8.526 -5.648 1.00 . A A . 14 LEU HD12 1 1
10 3067 1 1 15 LEU HD13 H 14.696 7.324 -4.393 1.00 . A A . 14 LEU HD13 1 1
10 3068 1 1 15 LEU HD21 H 17.386 6.047 -6.694 1.00 . A A . 14 LEU HD21 1 1
10 3069 1 1 15 LEU HD22 H 17.030 6.318 -4.991 1.00 . A A . 14 LEU HD22 1 1
10 3070 1 1 15 LEU HD23 H 17.101 7.681 -6.101 1.00 . A A . 14 LEU HD23 1 1
10 3071 1 1 15 LEU HG H 15.122 6.704 -7.331 1.00 . A A . 14 LEU HG 1 1
10 3072 1 1 15 LEU N N 14.568 2.768 -6.811 1.00 . A A . 14 LEU N 1 1
10 3073 1 1 15 LEU O O 15.940 4.880 -9.118 1.00 . A A . 14 LEU O 1 1
10 3074 1 1 16 ALA C C 18.192 3.172 -9.610 1.00 . A A . 15 ALA C 1 1
10 3075 1 1 16 ALA CA C 18.329 3.910 -8.281 1.00 . A A . 15 ALA CA 1 1
10 3076 1 1 16 ALA CB C 19.488 3.327 -7.473 1.00 . A A . 15 ALA CB 1 1
10 3077 1 1 16 ALA H H 17.082 3.367 -6.658 1.00 . A A . 15 ALA H 1 1
10 3078 1 1 16 ALA HA H 18.531 4.949 -8.485 1.00 . A A . 15 ALA HA 1 1
10 3079 1 1 16 ALA HB1 H 20.421 3.587 -7.945 1.00 . A A . 15 ALA HB1 1 1
10 3080 1 1 16 ALA HB2 H 19.392 2.252 -7.432 1.00 . A A . 15 ALA HB2 1 1
10 3081 1 1 16 ALA HB3 H 19.465 3.730 -6.471 1.00 . A A . 15 ALA HB3 1 1
10 3082 1 1 16 ALA N N 17.092 3.811 -7.533 1.00 . A A . 15 ALA N 1 1
10 3083 1 1 16 ALA O O 18.821 3.543 -10.599 1.00 . A A . 15 ALA O 1 1
10 3084 1 1 17 LEU C C 16.596 2.273 -11.933 1.00 . A A . 16 LEU C 1 1
10 3085 1 1 17 LEU CA C 17.175 1.361 -10.854 1.00 . A A . 16 LEU CA 1 1
10 3086 1 1 17 LEU CB C 16.224 0.153 -10.594 1.00 . A A . 16 LEU CB 1 1
10 3087 1 1 17 LEU CD1 C 17.757 -1.011 -8.970 1.00 . A A . 16 LEU CD1 1 1
10 3088 1 1 17 LEU CD2 C 16.051 -2.325 -10.255 1.00 . A A . 16 LEU CD2 1 1
10 3089 1 1 17 LEU CG C 17.020 -1.136 -10.306 1.00 . A A . 16 LEU CG 1 1
10 3090 1 1 17 LEU H H 16.892 1.872 -8.809 1.00 . A A . 16 LEU H 1 1
10 3091 1 1 17 LEU HA H 18.129 1.003 -11.191 1.00 . A A . 16 LEU HA 1 1
10 3092 1 1 17 LEU HB2 H 15.603 0.374 -9.741 1.00 . A A . 16 LEU HB2 1 1
10 3093 1 1 17 LEU HB3 H 15.585 -0.018 -11.456 1.00 . A A . 16 LEU HB3 1 1
10 3094 1 1 17 LEU HD11 H 18.163 -0.016 -8.872 1.00 . A A . 16 LEU HD11 1 1
10 3095 1 1 17 LEU HD12 H 18.562 -1.729 -8.938 1.00 . A A . 16 LEU HD12 1 1
10 3096 1 1 17 LEU HD13 H 17.075 -1.203 -8.157 1.00 . A A . 16 LEU HD13 1 1
10 3097 1 1 17 LEU HD21 H 15.284 -2.136 -9.516 1.00 . A A . 16 LEU HD21 1 1
10 3098 1 1 17 LEU HD22 H 16.593 -3.223 -9.988 1.00 . A A . 16 LEU HD22 1 1
10 3099 1 1 17 LEU HD23 H 15.594 -2.455 -11.223 1.00 . A A . 16 LEU HD23 1 1
10 3100 1 1 17 LEU HG H 17.742 -1.294 -11.096 1.00 . A A . 16 LEU HG 1 1
10 3101 1 1 17 LEU N N 17.367 2.125 -9.628 1.00 . A A . 16 LEU N 1 1
10 3102 1 1 17 LEU O O 17.166 2.409 -13.014 1.00 . A A . 16 LEU O 1 1
10 3103 1 1 18 TRP C C 15.558 5.106 -12.701 1.00 . A A . 17 TRP C 1 1
10 3104 1 1 18 TRP CA C 14.810 3.766 -12.596 1.00 . A A . 17 TRP CA 1 1
10 3105 1 1 18 TRP CB C 13.317 3.927 -12.185 1.00 . A A . 17 TRP CB 1 1
10 3106 1 1 18 TRP CD1 C 12.126 5.663 -13.609 1.00 . A A . 17 TRP CD1 1 1
10 3107 1 1 18 TRP CD2 C 12.910 6.461 -11.675 1.00 . A A . 17 TRP CD2 1 1
10 3108 1 1 18 TRP CE2 C 12.290 7.546 -12.319 1.00 . A A . 17 TRP CE2 1 1
10 3109 1 1 18 TRP CE3 C 13.494 6.665 -10.431 1.00 . A A . 17 TRP CE3 1 1
10 3110 1 1 18 TRP CG C 12.793 5.292 -12.498 1.00 . A A . 17 TRP CG 1 1
10 3111 1 1 18 TRP CH2 C 12.852 8.999 -10.480 1.00 . A A . 17 TRP CH2 1 1
10 3112 1 1 18 TRP CZ2 C 12.257 8.811 -11.736 1.00 . A A . 17 TRP CZ2 1 1
10 3113 1 1 18 TRP CZ3 C 13.472 7.914 -9.833 1.00 . A A . 17 TRP CZ3 1 1
10 3114 1 1 18 TRP H H 15.021 2.739 -10.765 1.00 . A A . 17 TRP H 1 1
10 3115 1 1 18 TRP HA H 14.846 3.295 -13.567 1.00 . A A . 17 TRP HA 1 1
10 3116 1 1 18 TRP HB2 H 12.708 3.195 -12.697 1.00 . A A . 17 TRP HB2 1 1
10 3117 1 1 18 TRP HB3 H 13.242 3.757 -11.118 1.00 . A A . 17 TRP HB3 1 1
10 3118 1 1 18 TRP HD1 H 11.874 5.017 -14.435 1.00 . A A . 17 TRP HD1 1 1
10 3119 1 1 18 TRP HE1 H 11.340 7.539 -14.173 1.00 . A A . 17 TRP HE1 1 1
10 3120 1 1 18 TRP HE3 H 13.970 5.842 -9.928 1.00 . A A . 17 TRP HE3 1 1
10 3121 1 1 18 TRP HH2 H 12.837 9.972 -10.011 1.00 . A A . 17 TRP HH2 1 1
10 3122 1 1 18 TRP HZ2 H 11.777 9.631 -12.246 1.00 . A A . 17 TRP HZ2 1 1
10 3123 1 1 18 TRP HZ3 H 13.935 8.036 -8.874 1.00 . A A . 17 TRP HZ3 1 1
10 3124 1 1 18 TRP N N 15.457 2.884 -11.637 1.00 . A A . 17 TRP N 1 1
10 3125 1 1 18 TRP NE1 N 11.822 7.013 -13.505 1.00 . A A . 17 TRP NE1 1 1
10 3126 1 1 18 TRP O O 15.836 5.565 -13.808 1.00 . A A . 17 TRP O 1 1
10 3127 1 1 19 TRP C C 17.856 6.885 -12.465 1.00 . A A . 18 TRP C 1 1
10 3128 1 1 19 TRP CA C 16.594 7.009 -11.624 1.00 . A A . 18 TRP CA 1 1
10 3129 1 1 19 TRP CB C 16.979 7.425 -10.210 1.00 . A A . 18 TRP CB 1 1
10 3130 1 1 19 TRP CD1 C 17.298 9.837 -10.808 1.00 . A A . 18 TRP CD1 1 1
10 3131 1 1 19 TRP CD2 C 19.039 8.995 -9.686 1.00 . A A . 18 TRP CD2 1 1
10 3132 1 1 19 TRP CE2 C 19.356 10.346 -9.951 1.00 . A A . 18 TRP CE2 1 1
10 3133 1 1 19 TRP CE3 C 19.969 8.218 -8.984 1.00 . A A . 18 TRP CE3 1 1
10 3134 1 1 19 TRP CG C 17.732 8.706 -10.240 1.00 . A A . 18 TRP CG 1 1
10 3135 1 1 19 TRP CH2 C 21.479 10.118 -8.833 1.00 . A A . 18 TRP CH2 1 1
10 3136 1 1 19 TRP CZ2 C 20.562 10.907 -9.533 1.00 . A A . 18 TRP CZ2 1 1
10 3137 1 1 19 TRP CZ3 C 21.180 8.775 -8.560 1.00 . A A . 18 TRP CZ3 1 1
10 3138 1 1 19 TRP H H 15.661 5.363 -10.691 1.00 . A A . 18 TRP H 1 1
10 3139 1 1 19 TRP HA H 15.951 7.761 -12.046 1.00 . A A . 18 TRP HA 1 1
10 3140 1 1 19 TRP HB2 H 16.099 7.541 -9.614 1.00 . A A . 18 TRP HB2 1 1
10 3141 1 1 19 TRP HB3 H 17.599 6.667 -9.781 1.00 . A A . 18 TRP HB3 1 1
10 3142 1 1 19 TRP HD1 H 16.358 9.949 -11.306 1.00 . A A . 18 TRP HD1 1 1
10 3143 1 1 19 TRP HE1 H 18.188 11.744 -10.966 1.00 . A A . 18 TRP HE1 1 1
10 3144 1 1 19 TRP HE3 H 19.748 7.183 -8.769 1.00 . A A . 18 TRP HE3 1 1
10 3145 1 1 19 TRP HH2 H 22.415 10.541 -8.503 1.00 . A A . 18 TRP HH2 1 1
10 3146 1 1 19 TRP HZ2 H 20.786 11.943 -9.746 1.00 . A A . 18 TRP HZ2 1 1
10 3147 1 1 19 TRP HZ3 H 21.884 8.164 -8.021 1.00 . A A . 18 TRP HZ3 1 1
10 3148 1 1 19 TRP N N 15.886 5.735 -11.572 1.00 . A A . 18 TRP N 1 1
10 3149 1 1 19 TRP NE1 N 18.259 10.822 -10.642 1.00 . A A . 18 TRP NE1 1 1
10 3150 1 1 19 TRP O O 18.066 7.641 -13.413 1.00 . A A . 18 TRP O 1 1
10 3151 1 1 20 ALA C C 19.673 4.956 -14.135 1.00 . A A . 19 ALA C 1 1
10 3152 1 1 20 ALA CA C 19.937 5.693 -12.824 1.00 . A A . 19 ALA CA 1 1
10 3153 1 1 20 ALA CB C 20.913 4.893 -11.949 1.00 . A A . 19 ALA CB 1 1
10 3154 1 1 20 ALA H H 18.460 5.357 -11.338 1.00 . A A . 19 ALA H 1 1
10 3155 1 1 20 ALA HA H 20.383 6.649 -13.049 1.00 . A A . 19 ALA HA 1 1
10 3156 1 1 20 ALA HB1 H 21.924 5.059 -12.292 1.00 . A A . 19 ALA HB1 1 1
10 3157 1 1 20 ALA HB2 H 20.682 3.838 -12.011 1.00 . A A . 19 ALA HB2 1 1
10 3158 1 1 20 ALA HB3 H 20.826 5.222 -10.923 1.00 . A A . 19 ALA HB3 1 1
10 3159 1 1 20 ALA N N 18.690 5.921 -12.104 1.00 . A A . 19 ALA N 1 1
10 3160 1 1 20 ALA O O 20.568 4.803 -14.966 1.00 . A A . 19 ALA O 1 1
10 3161 1 1 21 ETA CA C 18.063 3.785 -15.526 1.00 . A A . 20 ETA CA 1 1
10 3162 1 1 21 ETA CB C 17.973 4.749 -16.703 1.00 . A A . 20 ETA CB 1 1
10 3163 1 1 21 ETA HA1 H 17.105 3.313 -15.385 1.00 . A A . 20 ETA HA1 1 1
10 3164 1 1 21 ETA HA2 H 18.809 3.029 -15.736 1.00 . A A . 20 ETA HA2 1 1
10 3165 1 1 21 ETA HB1 H 17.493 4.251 -17.538 1.00 . A A . 20 ETA HB1 1 1
10 3166 1 1 21 ETA HB2 H 18.958 5.058 -16.996 1.00 . A A . 20 ETA HB2 1 1
10 3167 1 1 21 ETA HN2 H 17.763 4.654 -13.616 1.00 . A A . 20 ETA HN2 1 1
10 3168 1 1 21 ETA HO H 17.315 5.991 -15.357 1.00 . A A . 20 ETA HO 1 1
10 3169 1 1 21 ETA N N 18.436 4.503 -14.312 1.00 . A A . 20 ETA N 1 1
10 3170 1 1 21 ETA O O 17.228 5.895 -16.308 1.00 . A A . 20 ETA O 1 1
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