NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
537926 |
2lco   |
17619 | cing | 4-filtered-FRED | STAR | entry | full | 286 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lco
# This FRED archive file contains, for PDB entry <2lco>:
#
# - 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_2lco
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2lco
_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_P8_peptide A . 1 1
stop_
save_
save_WALP19_P8_peptide
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "WALP19 P8 peptide"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XGWWLALAPALALALALWWAX
_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 PRO . 1 1
10 ALA . 1 1
11 LEU . 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
PRO 9 9 1 1
ALA 10 10 1 1
LEU 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
179 1 . . . 1 1
180 1 . . . 1 1
181 1 . . . 1 1
182 1 . . . 1 1
183 1 . . . 1 1
184 1 . . . 1 1
185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 1 . . . 1 1
189 1 . . . 1 1
190 1 . . . 1 1
191 1 . . . 1 1
192 1 . . . 1 1
193 1 . . . 1 1
194 1 . . . 1 1
195 1 . . . 1 1
196 1 . . . 1 1
197 1 . . . 1 1
198 1 . . . 1 1
199 1 . . . 1 1
200 1 . . . 1 1
201 1 . . . 1 1
202 1 . . . 1 1
203 1 . . . 1 1
204 1 . . . 1 1
205 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
1 1 2 1 1 3 TRP H . 2 . HN 1 1
2 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
2 1 2 1 1 3 TRP H . 2 . HN 1 1
3 1 1 1 1 2 GLY QA . 1 . HT# 1 1
3 1 2 1 1 3 TRP H . 2 . HN 1 1
4 1 1 1 1 3 TRP H . 2 . HN 1 1
4 1 2 1 1 3 TRP HA . 2 . HA 1 1
5 1 1 1 1 3 TRP QB . 2 . HB# 1 1
5 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
6 1 1 1 1 3 TRP H . 2 . HN 1 1
6 1 2 1 1 3 TRP QB . 2 . HB# 1 1
7 1 1 1 1 3 TRP H . 2 . HN 1 1
7 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
8 1 1 1 1 4 TRP H . 3 . HN 1 1
8 1 2 1 1 4 TRP HA . 3 . HA 1 1
9 1 1 1 1 4 TRP HA . 3 . HA 1 1
9 1 2 1 1 4 TRP HB3 . 3 . HB1 1 1
10 1 1 1 1 4 TRP HA . 3 . HA 1 1
10 1 2 1 1 4 TRP HB2 . 3 . HB2 1 1
11 1 1 1 1 4 TRP QB . 3 . HB# 1 1
11 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
12 1 1 1 1 4 TRP H . 3 . HN 1 1
12 1 2 1 1 4 TRP QB . 3 . HB# 1 1
13 1 1 1 1 4 TRP H . 3 . HN 1 1
13 1 2 1 1 5 LEU H . 4 . HN 1 1
14 1 1 1 1 5 LEU H . 4 . HN 1 1
14 1 2 1 1 5 LEU HA . 4 . HA 1 1
15 1 1 1 1 2 GLY QA . 1 . HT# 1 1
15 1 2 1 1 5 LEU HG . 4 . HG 1 1
16 1 1 1 1 5 LEU H . 4 . HN 1 1
16 1 2 1 1 5 LEU HG . 4 . HG 1 1
17 1 1 1 1 5 LEU H . 4 . HN 1 1
17 1 2 1 1 6 ALA H . 5 . HN 1 1
18 1 1 1 1 6 ALA H . 5 . HN 1 1
18 1 2 1 1 6 ALA HA . 5 . HA 1 1
19 1 1 1 1 7 LEU H . 6 . HN 1 1
19 1 2 1 1 7 LEU HA . 6 . HA 1 1
20 1 1 1 1 7 LEU H . 6 . HN 1 1
20 1 2 1 1 7 LEU HB3 . 6 . HB1 1 1
21 1 1 1 1 7 LEU H . 6 . HN 1 1
21 1 2 1 1 7 LEU HB2 . 6 . HB2 1 1
22 1 1 1 1 7 LEU H . 6 . HN 1 1
22 1 2 1 1 7 LEU HG . 6 . HG 1 1
23 1 1 1 1 7 LEU H . 6 . HN 1 1
23 1 2 1 1 8 ALA H . 7 . HN 1 1
24 1 1 1 1 8 ALA H . 7 . HN 1 1
24 1 2 1 1 8 ALA HA . 7 . HA 1 1
25 1 1 1 1 10 ALA H . 9 . HN 1 1
25 1 2 1 1 10 ALA HA . 9 . HA 1 1
26 1 1 1 1 10 ALA H . 9 . HN 1 1
26 1 2 1 1 11 LEU H . 10 . HN 1 1
27 1 1 1 1 11 LEU H . 10 . HN 1 1
27 1 2 1 1 11 LEU HA . 10 . HA 1 1
28 1 1 1 1 11 LEU HA . 10 . HA 1 1
28 1 2 1 1 12 ALA H . 11 . HN 1 1
29 1 1 1 1 11 LEU H . 10 . HN 1 1
29 1 2 1 1 11 LEU QB . 10 . HB# 1 1
30 1 1 1 1 11 LEU QB . 10 . HB# 1 1
30 1 2 1 1 11 LEU HG . 10 . HG 1 1
31 1 1 1 1 12 ALA H . 11 . HN 1 1
31 1 2 1 1 12 ALA HA . 11 . HA 1 1
32 1 1 1 1 13 LEU H . 12 . HN 1 1
32 1 2 1 1 13 LEU HA . 12 . HA 1 1
33 1 1 1 1 13 LEU H . 12 . HN 1 1
33 1 2 1 1 13 LEU QB . 12 . HB# 1 1
34 1 1 1 1 12 ALA H . 11 . HN 1 1
34 1 2 1 1 13 LEU H . 12 . HN 1 1
35 1 1 1 1 13 LEU H . 12 . HN 1 1
35 1 2 1 1 14 ALA H . 13 . HN 1 1
36 1 1 1 1 14 ALA H . 13 . HN 1 1
36 1 2 1 1 14 ALA HA . 13 . HA 1 1
37 1 1 1 1 14 ALA H . 13 . HN 1 1
37 1 2 1 1 15 LEU H . 14 . HN 1 1
38 1 1 1 1 15 LEU H . 14 . HN 1 1
38 1 2 1 1 15 LEU HA . 14 . HA 1 1
39 1 1 1 1 15 LEU H . 14 . HN 1 1
39 1 2 1 1 15 LEU HB3 . 14 . HB1 1 1
40 1 1 1 1 15 LEU H . 14 . HN 1 1
40 1 2 1 1 15 LEU HB2 . 14 . HB2 1 1
41 1 1 1 1 16 ALA H . 15 . HN 1 1
41 1 2 1 1 16 ALA HA . 15 . HA 1 1
42 1 1 1 1 17 LEU H . 16 . HN 1 1
42 1 2 1 1 17 LEU HA . 16 . HA 1 1
43 1 1 1 1 17 LEU H . 16 . HN 1 1
43 1 2 1 1 17 LEU HB3 . 16 . HB1 1 1
44 1 1 1 1 17 LEU H . 16 . HN 1 1
44 1 2 1 1 17 LEU HB2 . 16 . HB2 1 1
45 1 1 1 1 18 TRP H . 17 . HN 1 1
45 1 2 1 1 18 TRP HA . 17 . HA 1 1
46 1 1 1 1 18 TRP H . 17 . HN 1 1
46 1 2 1 1 18 TRP HB3 . 17 . HB1 1 1
47 1 1 1 1 18 TRP H . 17 . HN 1 1
47 1 2 1 1 18 TRP HB2 . 17 . HB2 1 1
48 1 1 1 1 18 TRP H . 17 . HN 1 1
48 1 2 1 1 19 TRP H . 18 . HN 1 1
49 1 1 1 1 19 TRP H . 18 . HN 1 1
49 1 2 1 1 19 TRP HA . 18 . HA 1 1
50 1 1 1 1 19 TRP H . 18 . HN 1 1
50 1 2 1 1 19 TRP HB3 . 18 . HB1 1 1
51 1 1 1 1 19 TRP H . 18 . HN 1 1
51 1 2 1 1 19 TRP HB2 . 18 . HB2 1 1
52 1 1 1 1 19 TRP HB3 . 18 . HB1 1 1
52 1 2 1 1 20 ALA H . 19 . HN 1 1
53 1 1 1 1 19 TRP HB2 . 18 . HB2 1 1
53 1 2 1 1 20 ALA H . 19 . HN 1 1
54 1 1 1 1 20 ALA H . 19 . HN 1 1
54 1 2 1 1 20 ALA HA . 19 . HA 1 1
55 1 1 1 1 19 TRP H . 18 . HN 1 1
55 1 2 1 1 20 ALA H . 19 . HN 1 1
56 1 1 1 1 3 TRP HA . 2 . HA 1 1
56 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
57 1 1 1 1 3 TRP HA . 2 . HA 1 1
57 1 2 1 1 4 TRP H . 3 . HN 1 1
58 1 1 1 1 3 TRP HA . 2 . HA 1 1
58 1 2 1 1 3 TRP QB . 2 . HB# 1 1
59 1 1 1 1 3 TRP HD1 . 2 . HD1 1 1
59 1 2 1 1 4 TRP HA . 3 . HA 1 1
60 1 1 1 1 4 TRP HA . 3 . HA 1 1
60 1 2 1 1 5 LEU H . 4 . HN 1 1
61 1 1 1 1 3 TRP H . 2 . HN 1 1
61 1 2 1 1 4 TRP H . 3 . HN 1 1
62 1 1 1 1 3 TRP HD1 . 2 . HD1 1 1
62 1 2 1 1 4 TRP HZ3 . 3 . HZ3 1 1
63 1 1 1 1 5 LEU HA . 4 . HA 1 1
63 1 2 1 1 6 ALA H . 5 . HN 1 1
64 1 1 1 1 5 LEU HA . 4 . HA 1 1
64 1 2 1 1 8 ALA H . 7 . HN 1 1
65 1 1 1 1 5 LEU HB3 . 4 . HB1 1 1
65 1 2 1 1 5 LEU HG . 4 . HG 1 1
66 1 1 1 1 5 LEU HB2 . 4 . HB2 1 1
66 1 2 1 1 5 LEU HG . 4 . HG 1 1
67 1 1 1 1 5 LEU HA . 4 . HA 1 1
67 1 2 1 1 5 LEU HG . 4 . HG 1 1
68 1 1 1 1 6 ALA HA . 5 . HA 1 1
68 1 2 1 1 7 LEU H . 6 . HN 1 1
69 1 1 1 1 6 ALA H . 5 . HN 1 1
69 1 2 1 1 7 LEU H . 6 . HN 1 1
70 1 1 1 1 8 ALA HA . 7 . HA 1 1
70 1 2 1 1 11 LEU H . 10 . HN 1 1
71 1 1 1 1 8 ALA H . 7 . HN 1 1
71 1 2 1 1 9 PRO HA . 8 . HA 1 1
72 1 1 1 1 9 PRO HA . 8 . HA 1 1
72 1 2 1 1 9 PRO HB3 . 8 . HB1 1 1
73 1 1 1 1 9 PRO HB3 . 8 . HB1 1 1
73 1 2 1 1 10 ALA H . 9 . HN 1 1
74 1 1 1 1 9 PRO HA . 8 . HA 1 1
74 1 2 1 1 9 PRO HB2 . 8 . HB2 1 1
75 1 1 1 1 9 PRO HB2 . 8 . HB2 1 1
75 1 2 1 1 10 ALA H . 9 . HN 1 1
76 1 1 1 1 11 LEU HA . 10 . HA 1 1
76 1 2 1 1 11 LEU QB . 10 . HB# 1 1
77 1 1 1 1 11 LEU QB . 10 . HB# 1 1
77 1 2 1 1 12 ALA H . 11 . HN 1 1
78 1 1 1 1 11 LEU HA . 10 . HA 1 1
78 1 2 1 1 11 LEU HG . 10 . HG 1 1
79 1 1 1 1 11 LEU H . 10 . HN 1 1
79 1 2 1 1 11 LEU HG . 10 . HG 1 1
80 1 1 1 1 11 LEU HG . 10 . HG 1 1
80 1 2 1 1 12 ALA H . 11 . HN 1 1
81 1 1 1 1 11 LEU HG . 10 . HG 1 1
81 1 2 1 1 15 LEU H . 14 . HN 1 1
82 1 1 1 1 12 ALA HA . 11 . HA 1 1
82 1 2 1 1 15 LEU H . 14 . HN 1 1
83 1 1 1 1 13 LEU HA . 12 . HA 1 1
83 1 2 1 1 16 ALA H . 15 . HN 1 1
84 1 1 1 1 13 LEU HA . 12 . HA 1 1
84 1 2 1 1 13 LEU QB . 12 . HB# 1 1
85 1 1 1 1 13 LEU QB . 12 . HB# 1 1
85 1 2 1 1 14 ALA H . 13 . HN 1 1
86 1 1 1 1 14 ALA HA . 13 . HA 1 1
86 1 2 1 1 15 LEU H . 14 . HN 1 1
87 1 1 1 1 14 ALA HA . 13 . HA 1 1
87 1 2 1 1 17 LEU H . 16 . HN 1 1
88 1 1 1 1 15 LEU HA . 14 . HA 1 1
88 1 2 1 1 18 TRP H . 17 . HN 1 1
89 1 1 1 1 15 LEU H . 14 . HN 1 1
89 1 2 1 1 16 ALA H . 15 . HN 1 1
90 1 1 1 1 16 ALA HA . 15 . HA 1 1
90 1 2 1 1 17 LEU H . 16 . HN 1 1
91 1 1 1 1 16 ALA HA . 15 . HA 1 1
91 1 2 1 1 19 TRP H . 18 . HN 1 1
92 1 1 1 1 16 ALA HA . 15 . HA 1 1
92 1 2 1 1 20 ALA H . 19 . HN 1 1
93 1 1 1 1 16 ALA H . 15 . HN 1 1
93 1 2 1 1 17 LEU H . 16 . HN 1 1
94 1 1 1 1 17 LEU HA . 16 . HA 1 1
94 1 2 1 1 18 TRP H . 17 . HN 1 1
95 1 1 1 1 17 LEU HA . 16 . HA 1 1
95 1 2 1 1 20 ALA H . 19 . HN 1 1
96 1 1 1 1 17 LEU H . 16 . HN 1 1
96 1 2 1 1 18 TRP H . 17 . HN 1 1
97 1 1 1 1 18 TRP HA . 17 . HA 1 1
97 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
98 1 1 1 1 18 TRP HB3 . 17 . HB1 1 1
98 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
99 1 1 1 1 18 TRP HB2 . 17 . HB2 1 1
99 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
100 1 1 1 1 18 TRP HE3 . 17 . HE3 1 1
100 1 2 1 1 19 TRP H . 18 . HN 1 1
101 1 1 1 1 19 TRP HA . 18 . HA 1 1
101 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
102 1 1 1 1 19 TRP HA . 18 . HA 1 1
102 1 2 1 1 19 TRP HB3 . 18 . HB1 1 1
103 1 1 1 1 19 TRP HA . 18 . HA 1 1
103 1 2 1 1 19 TRP HB2 . 18 . HB2 1 1
104 1 1 1 1 3 TRP HA . 2 . HA 1 1
104 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1
105 1 1 1 1 3 TRP HA . 2 . HA 1 1
105 1 2 1 1 5 LEU H . 4 . HN 1 1
106 1 1 1 1 3 TRP HA . 2 . HA 1 1
106 1 2 1 1 6 ALA H . 5 . HN 1 1
107 1 1 1 1 3 TRP QB . 2 . HB# 1 1
107 1 2 1 1 4 TRP H . 3 . HN 1 1
108 1 1 1 1 4 TRP HA . 3 . HA 1 1
108 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
109 1 1 1 1 4 TRP HA . 3 . HA 1 1
109 1 2 1 1 4 TRP HZ3 . 3 . HZ3 1 1
110 1 1 1 1 4 TRP HA . 3 . HA 1 1
110 1 2 1 1 6 ALA H . 5 . HN 1 1
111 1 1 1 1 4 TRP HA . 3 . HA 1 1
111 1 2 1 1 7 LEU H . 6 . HN 1 1
112 1 1 1 1 4 TRP QB . 3 . HB# 1 1
112 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1
113 1 1 1 1 4 TRP HB3 . 3 . HB1 1 1
113 1 2 1 1 5 LEU H . 4 . HN 1 1
114 1 1 1 1 4 TRP HB2 . 3 . HB2 1 1
114 1 2 1 1 5 LEU H . 4 . HN 1 1
115 1 1 1 1 3 TRP HE1 . 2 . HE1 1 1
115 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1
116 1 1 1 1 3 TRP HE1 . 2 . HE1 1 1
116 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1
117 1 1 1 1 4 TRP H . 3 . HN 1 1
117 1 2 1 1 4 TRP HE1 . 3 . HE1 1 1
118 1 1 1 1 4 TRP H . 3 . HN 1 1
118 1 2 1 1 6 ALA H . 5 . HN 1 1
119 1 1 1 1 5 LEU HA . 4 . HA 1 1
119 1 2 1 1 7 LEU H . 6 . HN 1 1
120 1 1 1 1 5 LEU HB3 . 4 . HB1 1 1
120 1 2 1 1 6 ALA H . 5 . HN 1 1
121 1 1 1 1 5 LEU HB2 . 4 . HB2 1 1
121 1 2 1 1 6 ALA H . 5 . HN 1 1
122 1 1 1 1 3 TRP H . 2 . HN 1 1
122 1 2 1 1 5 LEU H . 4 . HN 1 1
123 1 1 1 1 7 LEU HA . 6 . HA 1 1
123 1 2 1 1 10 ALA H . 9 . HN 1 1
124 1 1 1 1 7 LEU HA . 6 . HA 1 1
124 1 2 1 1 7 LEU HG . 6 . HG 1 1
125 1 1 1 1 7 LEU HB2 . 6 . HB2 1 1
125 1 2 1 1 7 LEU HG . 6 . HG 1 1
126 1 1 1 1 7 LEU HG . 6 . HG 1 1
126 1 2 1 1 8 ALA H . 7 . HN 1 1
127 1 1 1 1 10 ALA H . 9 . HN 1 1
127 1 2 1 1 12 ALA H . 11 . HN 1 1
128 1 1 1 1 12 ALA HA . 11 . HA 1 1
128 1 2 1 1 16 ALA H . 15 . HN 1 1
129 1 1 1 1 13 LEU H . 12 . HN 1 1
129 1 2 1 1 15 LEU H . 14 . HN 1 1
130 1 1 1 1 14 ALA HA . 13 . HA 1 1
130 1 2 1 1 18 TRP H . 17 . HN 1 1
131 1 1 1 1 14 ALA H . 13 . HN 1 1
131 1 2 1 1 16 ALA H . 15 . HN 1 1
132 1 1 1 1 15 LEU HA . 14 . HA 1 1
132 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
133 1 1 1 1 18 TRP HA . 17 . HA 1 1
133 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
134 1 1 1 1 18 TRP HA . 17 . HA 1 1
134 1 2 1 1 19 TRP H . 18 . HN 1 1
135 1 1 1 1 15 LEU HA . 14 . HA 1 1
135 1 2 1 1 18 TRP HB3 . 17 . HB1 1 1
136 1 1 1 1 15 LEU HA . 14 . HA 1 1
136 1 2 1 1 18 TRP HB2 . 17 . HB2 1 1
137 1 1 1 1 18 TRP H . 17 . HN 1 1
137 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
138 1 1 1 1 15 LEU MD1 . 14 . HD1# 1 1
138 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
139 1 1 1 1 15 LEU MD2 . 14 . HD2# 1 1
139 1 2 1 1 18 TRP HE3 . 17 . HE3 1 1
140 1 1 1 1 18 TRP HZ2 . 17 . HZ2 1 1
140 1 2 1 1 19 TRP H . 18 . HN 1 1
141 1 1 1 1 18 TRP HE3 . 17 . HE3 1 1
141 1 2 1 1 19 TRP HA . 18 . HA 1 1
142 1 1 1 1 18 TRP HE3 . 17 . HE3 1 1
142 1 2 1 1 19 TRP QB . 18 . HB# 1 1
143 1 1 1 1 19 TRP HB3 . 18 . HB1 1 1
143 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
144 1 1 1 1 19 TRP HB2 . 18 . HB2 1 1
144 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
145 1 1 1 1 19 TRP QB . 18 . HB# 1 1
145 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
146 1 1 1 1 19 TRP HE3 . 18 . HE3 1 1
146 1 2 1 1 20 ALA HA . 19 . HA 1 1
147 1 1 1 1 16 ALA HA . 15 . HA 1 1
147 1 2 1 1 19 TRP HE3 . 18 . HE3 1 1
148 1 1 1 1 19 TRP HD1 . 18 . HD1 1 1
148 1 2 1 1 20 ALA H . 19 . HN 1 1
149 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
149 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
150 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
150 1 2 1 1 3 TRP HD1 . 2 . HD1 1 1
151 1 1 1 1 2 GLY HA3 . 1 . HA1 1 1
151 1 2 1 1 5 LEU H . 4 . HN 1 1
152 1 1 1 1 2 GLY HA2 . 1 . HA2 1 1
152 1 2 1 1 5 LEU H . 4 . HN 1 1
153 1 1 1 1 3 TRP HD1 . 2 . HD1 1 1
153 1 2 1 1 4 TRP QB . 3 . HB# 1 1
154 1 1 1 1 4 TRP QB . 3 . HB# 1 1
154 1 2 1 1 4 TRP HZ3 . 3 . HZ3 1 1
155 1 1 1 1 3 TRP HE1 . 2 . HE1 1 1
155 1 2 1 1 4 TRP H . 3 . HN 1 1
156 1 1 1 1 3 TRP HE1 . 2 . HE1 1 1
156 1 2 1 1 4 TRP HZ3 . 3 . HZ3 1 1
157 1 1 1 1 4 TRP HD1 . 3 . HD1 1 1
157 1 2 1 1 5 LEU HA . 4 . HA 1 1
158 1 1 1 1 4 TRP HD1 . 3 . HD1 1 1
158 1 2 1 1 5 LEU HG . 4 . HG 1 1
159 1 1 1 1 18 TRP H . 17 . HN 1 1
159 1 2 1 1 18 TRP HD1 . 17 . HD1 1 1
160 1 1 1 1 19 TRP H . 18 . HN 1 1
160 1 2 1 1 19 TRP HD1 . 18 . HD1 1 1
161 1 1 1 1 6 ALA HA . 5 . HA 1 1
161 1 2 1 1 6 ALA MB . 5 . HB# 1 1
162 1 1 1 1 6 ALA H . 5 . HN 1 1
162 1 2 1 1 6 ALA MB . 5 . HB# 1 1
163 1 1 1 1 8 ALA H . 7 . HN 1 1
163 1 2 1 1 8 ALA MB . 7 . HB# 1 1
164 1 1 1 1 10 ALA HA . 9 . HA 1 1
164 1 2 1 1 10 ALA MB . 9 . HB# 1 1
165 1 1 1 1 10 ALA H . 9 . HN 1 1
165 1 2 1 1 10 ALA MB . 9 . HB# 1 1
166 1 1 1 1 10 ALA MB . 9 . HB# 1 1
166 1 2 1 1 11 LEU H . 10 . HN 1 1
167 1 1 1 1 12 ALA H . 11 . HN 1 1
167 1 2 1 1 12 ALA MB . 11 . HB# 1 1
168 1 1 1 1 14 ALA HA . 13 . HA 1 1
168 1 2 1 1 14 ALA MB . 13 . HB# 1 1
169 1 1 1 1 14 ALA H . 13 . HN 1 1
169 1 2 1 1 14 ALA MB . 13 . HB# 1 1
170 1 1 1 1 16 ALA H . 15 . HN 1 1
170 1 2 1 1 16 ALA MB . 15 . HB# 1 1
171 1 1 1 1 20 ALA HA . 19 . HA 1 1
171 1 2 1 1 20 ALA MB . 19 . HB# 1 1
172 1 1 1 1 20 ALA H . 19 . HN 1 1
172 1 2 1 1 20 ALA MB . 19 . HB# 1 1
173 1 1 1 1 3 TRP HD1 . 2 . HD1 1 1
173 1 2 1 1 6 ALA MB . 5 . HB# 1 1
174 1 1 1 1 12 ALA MB . 11 . HB# 1 1
174 1 2 1 1 13 LEU H . 12 . HN 1 1
175 1 1 1 1 14 ALA MB . 13 . HB# 1 1
175 1 2 1 1 15 LEU H . 14 . HN 1 1
176 1 1 1 1 14 ALA MB . 13 . HB# 1 1
176 1 2 1 1 18 TRP H . 17 . HN 1 1
177 1 1 1 1 16 ALA MB . 15 . HB# 1 1
177 1 2 1 1 17 LEU H . 16 . HN 1 1
178 1 1 1 1 5 LEU H . 4 . HN 1 1
178 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
179 1 1 1 1 5 LEU H . 4 . HN 1 1
179 1 2 1 1 6 ALA MB . 5 . HB# 1 1
180 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1
180 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
181 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1
181 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
182 1 1 1 1 7 LEU H . 6 . HN 1 1
182 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
183 1 1 1 1 7 LEU H . 6 . HN 1 1
183 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
184 1 1 1 1 5 LEU HA . 4 . HA 1 1
184 1 2 1 1 8 ALA MB . 7 . HB# 1 1
185 1 1 1 1 11 LEU HA . 10 . HA 1 1
185 1 2 1 1 11 LEU MD1 . 10 . HD1# 1 1
186 1 1 1 1 11 LEU HA . 10 . HA 1 1
186 1 2 1 1 11 LEU MD2 . 10 . HD2# 1 1
187 1 1 1 1 11 LEU H . 10 . HN 1 1
187 1 2 1 1 11 LEU MD1 . 10 . HD1# 1 1
188 1 1 1 1 11 LEU H . 10 . HN 1 1
188 1 2 1 1 11 LEU MD2 . 10 . HD2# 1 1
189 1 1 1 1 13 LEU HA . 12 . HA 1 1
189 1 2 1 1 13 LEU QD . 12 . HD# 1 1
190 1 1 1 1 13 LEU H . 12 . HN 1 1
190 1 2 1 1 13 LEU QD . 12 . HD# 1 1
191 1 1 1 1 13 LEU QD . 12 . HD# 1 1
191 1 2 1 1 14 ALA H . 13 . HN 1 1
192 1 1 1 1 15 LEU H . 14 . HN 1 1
192 1 2 1 1 15 LEU MD1 . 14 . HD1# 1 1
193 1 1 1 1 15 LEU H . 14 . HN 1 1
193 1 2 1 1 15 LEU MD2 . 14 . HD2# 1 1
194 1 1 1 1 13 LEU HA . 12 . HA 1 1
194 1 2 1 1 16 ALA MB . 15 . HB# 1 1
195 1 1 1 1 16 ALA MB . 15 . HB# 1 1
195 1 2 1 1 19 TRP H . 18 . HN 1 1
196 1 1 1 1 17 LEU HA . 16 . HA 1 1
196 1 2 1 1 17 LEU QD . 16 . HD# 1 1
197 1 1 1 1 17 LEU H . 16 . HN 1 1
197 1 2 1 1 17 LEU QD . 16 . HD# 1 1
198 1 1 1 1 19 TRP H . 18 . HN 1 1
198 1 2 1 1 20 ALA MB . 19 . HB# 1 1
199 1 1 1 1 6 ALA MB . 5 . HB# 1 1
199 1 2 1 1 7 LEU H . 6 . HN 1 1
200 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1
200 1 2 1 1 6 ALA MB . 5 . HB# 1 1
201 1 1 1 1 3 TRP HD1 . 2 . HD1 1 1
201 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1
202 1 1 1 1 3 TRP HD1 . 2 . HD1 1 1
202 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1
203 1 1 1 1 17 LEU QD . 16 . HD# 1 1
203 1 2 1 1 19 TRP H . 18 . HN 1 1
204 1 1 1 1 8 ALA H . 7 . HN 1 1
204 1 2 1 1 10 ALA H . 9 . HN 1 1
205 1 1 1 1 9 PRO QD . 8 . HD# 1 1
205 1 2 1 1 10 ALA H . 9 . HN 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.2 1.8 2.8 1 1
2 1 . . . . . 2.2 1.8 2.8 1 1
3 1 . . . . . 2.6 1.8 3.5 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 . . . . . 2.6 1.8 3.5 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 . . . . . 2.6 1.8 3.5 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 . . . . . 2.2 1.8 2.8 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 . . . . . 2.2 1.8 2.8 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 . . . . . 2.2 1.8 2.8 1 1
43 1 . . . . . 2.2 1.8 2.8 1 1
44 1 . . . . . 2.2 1.8 2.8 1 1
45 1 . . . . . 2.2 1.8 2.8 1 1
46 1 . . . . . 2.2 1.8 2.8 1 1
47 1 . . . . . 2.6 1.8 3.5 1 1
48 1 . . . . . 2.2 1.8 2.8 1 1
49 1 . . . . . 2.2 1.8 2.8 1 1
50 1 . . . . . 2.6 1.8 3.5 1 1
51 1 . . . . . 2.6 1.8 3.5 1 1
52 1 . . . . . 2.2 1.8 2.8 1 1
53 1 . . . . . 2.6 1.8 3.5 1 1
54 1 . . . . . 2.2 1.8 2.8 1 1
55 1 . . . . . 2.2 1.8 2.8 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 . . . . . 2.6 1.8 3.5 1 1
60 1 . . . . . 2.6 1.8 3.5 1 1
61 1 . . . . . 2.6 1.8 3.5 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 . . . . . 3.4 1.8 5.5 1 1
71 1 . . . . . 3.4 1.8 5.5 1 1
72 1 . . . . . 2.6 1.8 3.5 1 1
73 1 . . . . . 2.6 1.8 3.5 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 . . . . . 2.6 1.8 3.5 1 1
89 1 . . . . . 2.6 1.8 3.5 1 1
90 1 . . . . . 2.6 1.8 3.5 1 1
91 1 . . . . . 3.4 1.8 5.5 1 1
92 1 . . . . . 3.4 1.8 5.5 1 1
93 1 . . . . . 2.6 1.8 3.5 1 1
94 1 . . . . . 2.6 1.8 3.5 1 1
95 1 . . . . . 3.4 1.8 5.5 1 1
96 1 . . . . . 2.6 1.8 3.5 1 1
97 1 . . . . . 3.4 1.8 5.5 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 . . . . . 2.6 1.8 3.5 1 1
102 1 . . . . . 2.6 1.8 3.5 1 1
103 1 . . . . . 2.6 1.8 3.5 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 . . . . . . 1.8 2.8 1 1
126 1 . . . . . 3.4 1.8 5.5 1 1
127 1 . . . . . 3.4 1.8 5.5 1 1
128 1 . . . . . 3.4 1.8 5.5 1 1
129 1 . . . . . 3.4 1.8 5.5 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 5.5 1 1
133 1 . . . . . 3.4 1.8 5.5 1 1
134 1 . . . . . 3.4 1.8 5.5 1 1
135 1 . . . . . 3.4 1.8 5.5 1 1
136 1 . . . . . 3.4 1.8 5.5 1 1
137 1 . . . . . 3.4 1.8 5.5 1 1
138 1 . . . . . 3.4 1.8 6.0 1 1
139 1 . . . . . 3.4 1.8 6.0 1 1
140 1 . . . . . 3.4 1.8 5.5 1 1
141 1 . . . . . 3.4 1.8 5.5 1 1
142 1 . . . . . 3.4 1.8 5.5 1 1
143 1 . . . . . 3.4 1.8 5.5 1 1
144 1 . . . . . 3.4 1.8 5.5 1 1
145 1 . . . . . 2.6 1.8 3.5 1 1
146 1 . . . . . 2.6 1.8 3.5 1 1
147 1 . . . . . 3.4 1.8 5.5 1 1
148 1 . . . . . 3.4 1.8 5.5 1 1
149 1 . . . . . 3.4 1.8 6.0 1 1
150 1 . . . . . 3.4 1.8 6.0 1 1
151 1 . . . . . 3.4 1.8 6.0 1 1
152 1 . . . . . 3.4 1.8 6.0 1 1
153 1 . . . . . 3.4 1.8 6.0 1 1
154 1 . . . . . 3.4 1.8 6.0 1 1
155 1 . . . . . 3.4 1.8 6.0 1 1
156 1 . . . . . 3.4 1.8 6.0 1 1
157 1 . . . . . 3.4 1.8 6.0 1 1
158 1 . . . . . 3.4 1.8 6.0 1 1
159 1 . . . . . 3.4 1.8 6.0 1 1
160 1 . . . . . 3.4 1.8 6.0 1 1
161 1 . . . . . 2.2 1.8 3.3 1 1
162 1 . . . . . 2.2 1.8 3.3 1 1
163 1 . . . . . 2.2 1.8 3.3 1 1
164 1 . . . . . 2.2 1.8 3.3 1 1
165 1 . . . . . 2.2 1.8 3.3 1 1
166 1 . . . . . 2.6 1.8 4.0 1 1
167 1 . . . . . 2.2 1.8 3.3 1 1
168 1 . . . . . 2.2 1.8 3.3 1 1
169 1 . . . . . 2.2 1.8 3.3 1 1
170 1 . . . . . 2.2 1.8 3.3 1 1
171 1 . . . . . 2.2 1.8 3.3 1 1
172 1 . . . . . 2.2 1.8 3.3 1 1
173 1 . . . . . 3.4 1.8 6.0 1 1
174 1 . . . . . 2.6 1.8 4.0 1 1
175 1 . . . . . 2.6 1.8 4.0 1 1
176 1 . . . . . 2.6 1.8 4.0 1 1
177 1 . . . . . 2.6 1.8 4.0 1 1
178 1 . . . . . 3.4 1.8 6.0 1 1
179 1 . . . . . 3.4 1.8 6.0 1 1
180 1 . . . . . 3.4 1.8 6.0 1 1
181 1 . . . . . 3.4 1.8 6.0 1 1
182 1 . . . . . 3.4 1.8 6.0 1 1
183 1 . . . . . 3.4 1.8 6.0 1 1
184 1 . . . . . 3.4 1.8 6.0 1 1
185 1 . . . . . 3.4 1.8 6.0 1 1
186 1 . . . . . 3.4 1.8 6.0 1 1
187 1 . . . . . 3.4 1.8 6.0 1 1
188 1 . . . . . 3.4 1.8 6.0 1 1
189 1 . . . . . 3.4 1.8 6.0 1 1
190 1 . . . . . 3.4 1.8 6.0 1 1
191 1 . . . . . 3.4 1.8 6.0 1 1
192 1 . . . . . 3.4 1.8 6.0 1 1
193 1 . . . . . 3.4 1.8 6.0 1 1
194 1 . . . . . 3.4 1.8 6.0 1 1
195 1 . . . . . 3.4 1.8 6.0 1 1
196 1 . . . . . 3.4 1.8 6.0 1 1
197 1 . . . . . 3.4 1.8 6.0 1 1
198 1 . . . . . 3.4 1.8 6.0 1 1
199 1 . . . . . 2.6 1.8 4.0 1 1
200 1 . . . . . 3.4 1.8 6.5 1 1
201 1 . . . . . 3.4 1.8 6.5 1 1
202 1 . . . . . 3.4 1.8 6.5 1 1
203 1 . . . . . 3.4 1.8 6.5 1 1
204 1 . . . . . 3.4 1.8 5.5 1 1
205 1 . . . . . 3.4 1.8 5.5 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 2
19 1 . . . 1 2
20 1 . . . 1 2
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 1 . . . 1 2
26 1 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 1 . . . 1 2
39 1 . . . 1 2
40 1 . . . 1 2
41 1 . . . 1 2
42 1 . . . 1 2
43 1 . . . 1 2
44 1 . . . 1 2
45 1 . . . 1 2
46 1 . . . 1 2
47 1 . . . 1 2
48 1 . . . 1 2
49 1 . . . 1 2
50 1 . . . 1 2
51 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 GLY QA . 1 . HT# 1 2
1 1 2 1 1 5 LEU QB . 4 . HB2 1 2
2 1 1 1 1 5 LEU H . 4 . HN 1 2
2 1 2 1 1 5 LEU QB . 4 . HB2 1 2
3 1 1 1 1 5 LEU HA . 4 . HA 1 2
3 1 2 1 1 5 LEU QB . 4 . HB2 1 2
4 1 1 1 1 7 LEU HB3 . 6 . HB1 1 2
4 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 2
5 1 1 1 1 7 LEU HB3 . 6 . HB1 1 2
5 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 2
6 1 1 1 1 4 TRP HA . 3 . HA 1 2
6 1 2 1 1 7 LEU QD . 6 . HD1# 1 2
7 1 1 1 1 4 TRP HE3 . 3 . HE3 1 2
7 1 2 1 1 7 LEU QD . 6 . HD1# 1 2
8 1 1 1 1 7 LEU HA . 6 . HA 1 2
8 1 2 1 1 7 LEU QD . 6 . HD1# 1 2
9 1 1 1 1 9 PRO HB2 . 8 . HB2 1 2
9 1 2 1 1 9 PRO QD . 8 . HD2 1 2
10 1 1 1 1 8 ALA H . 7 . HN 1 2
10 1 2 1 1 9 PRO QD . 8 . HD2 1 2
11 1 1 1 1 9 PRO HB3 . 8 . HB1 1 2
11 1 2 1 1 9 PRO QD . 8 . HD2 1 2
12 1 1 1 1 8 ALA MB . 7 . HB# 1 2
12 1 2 1 1 9 PRO QD . 8 . HD2 1 2
13 1 1 1 1 9 PRO HB3 . 8 . HB1 1 2
13 1 2 1 1 9 PRO QG . 8 . HG2 1 2
14 1 1 1 1 9 PRO HA . 8 . HA 1 2
14 1 2 1 1 9 PRO QG . 8 . HG2 1 2
15 1 1 1 1 15 LEU HA . 14 . HA 1 2
15 1 2 1 1 15 LEU QD . 14 . HD1# 1 2
16 1 1 1 1 15 LEU HB3 . 14 . HB1 1 2
16 1 2 1 1 15 LEU MD1 . 14 . HD1# 1 2
17 1 1 1 1 15 LEU HB3 . 14 . HB1 1 2
17 1 2 1 1 15 LEU MD2 . 14 . HD2# 1 2
18 1 1 1 1 15 LEU HB2 . 14 . HB2 1 2
18 1 2 1 1 15 LEU MD1 . 14 . HD1# 1 2
19 1 1 1 1 15 LEU HB2 . 14 . HB2 1 2
19 1 2 1 1 15 LEU MD2 . 14 . HD2# 1 2
20 1 1 1 1 15 LEU QD . 14 . HD1# 1 2
20 1 2 1 1 16 ALA H . 15 . HN 1 2
21 1 1 1 1 18 TRP HB2 . 17 . HB2 1 2
21 1 2 1 1 19 TRP H . 18 . HN 1 2
22 1 1 1 1 18 TRP HB3 . 17 . HB1 1 2
22 1 2 1 1 19 TRP H . 18 . HN 1 2
23 1 1 1 1 18 TRP HB2 . 17 . HB2 1 2
23 1 2 1 1 18 TRP HE3 . 17 . HE3 1 2
24 1 1 1 1 18 TRP HB3 . 17 . HB1 1 2
24 1 2 1 1 18 TRP HE3 . 17 . HE3 1 2
25 1 1 1 1 2 GLY HA3 . 1 . HA1 1 2
25 1 2 1 1 4 TRP HD1 . 3 . HD1 1 2
26 1 1 1 1 2 GLY QA . 1 . HA2 1 2
26 1 2 1 1 4 TRP HD1 . 3 . HD1 1 2
27 1 1 1 1 2 GLY HA2 . 1 . HA2 1 2
27 1 2 1 1 4 TRP HD1 . 3 . HD1 1 2
28 1 1 1 1 2 GLY HA3 . 1 . HA1 1 2
28 1 2 1 1 4 TRP HE1 . 3 . HE1 1 2
29 1 1 1 1 2 GLY HA2 . 1 . HA2 1 2
29 1 2 1 1 4 TRP HE1 . 3 . HE1 1 2
30 1 1 1 1 7 LEU HB2 . 6 . HB2 1 2
30 1 2 1 1 8 ALA H . 7 . HN 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 4 TRP HA . 3 . HA 1 2
32 1 2 1 1 7 LEU HB2 . 6 . HB2 1 2
33 1 1 1 1 12 ALA HA . 11 . HA 1 2
33 1 2 1 1 15 LEU HB3 . 14 . HB1 1 2
34 1 1 1 1 15 LEU HA . 14 . HA 1 2
34 1 2 1 1 15 LEU HB3 . 14 . HB1 1 2
35 1 1 1 1 15 LEU HB3 . 14 . HB1 1 2
35 1 2 1 1 16 ALA H . 15 . HN 1 2
36 1 1 1 1 15 LEU HB2 . 14 . HB2 1 2
36 1 2 1 1 16 ALA H . 15 . HN 1 2
37 1 1 1 1 17 LEU HB3 . 16 . HB1 1 2
37 1 2 1 1 18 TRP H . 17 . HN 1 2
38 1 1 1 1 17 LEU HB2 . 16 . HB2 1 2
38 1 2 1 1 18 TRP H . 17 . HN 1 2
39 1 1 1 1 17 LEU HA . 16 . HA 1 2
39 1 2 1 1 17 LEU HB3 . 16 . HB1 1 2
40 1 1 1 1 2 GLY QA . 1 . HT# 1 2
40 1 2 1 1 5 LEU QD . 4 . HD2# 1 2
41 1 1 1 1 4 TRP HD1 . 3 . HD1 1 2
41 1 2 1 1 5 LEU QD . 4 . HD1# 1 2
42 1 1 1 1 4 TRP HE3 . 3 . HE3 1 2
42 1 2 1 1 5 LEU QD . 4 . HD1# 1 2
43 1 1 1 1 4 TRP HE1 . 3 . HE1 1 2
43 1 2 1 1 5 LEU QD . 4 . HD1# 1 2
44 1 1 1 1 5 LEU QD . 4 . HD1# 1 2
44 1 2 1 1 6 ALA H . 5 . HN 1 2
45 1 1 1 1 5 LEU HA . 4 . HA 1 2
45 1 2 1 1 5 LEU QD . 4 . HD1# 1 2
46 1 1 1 1 16 ALA MB . 15 . HB# 1 2
46 1 2 1 1 19 TRP QB . 18 . HB# 1 2
47 1 1 1 1 19 TRP QB . 18 . HB# 1 2
47 1 2 1 1 20 ALA MB . 19 . HB# 1 2
48 1 1 1 1 15 LEU QD . 14 . HD1# 1 2
48 1 2 1 1 19 TRP QB . 18 . HB# 1 2
49 1 1 1 1 14 ALA MB . 13 . HB# 1 2
49 1 2 1 1 18 TRP HB3 . 17 . HB1 1 2
50 1 1 1 1 15 LEU QD . 14 . HD1# 1 2
50 1 2 1 1 18 TRP QB . 17 . HB# 1 2
51 1 1 1 1 3 TRP HB3 . 2 . HB1 1 2
51 1 1 1 1 15 LEU HB2 . 14 . HB2 1 2
51 1 2 1 1 6 ALA MB . 5 . HB# 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 . . . . . 3.4 1.8 6.0 1 2
2 1 . . . . . 2.6 1.8 2.8 1 2
3 1 . . . . . 2.6 1.8 3.5 1 2
4 1 . . . . . 2.6 1.8 4.0 1 2
5 1 . . . . . 2.6 1.8 4.0 1 2
6 1 . . . . . 3.4 1.8 6.0 1 2
7 1 . . . . . 3.4 1.8 6.0 1 2
8 1 . . . . . 3.4 1.8 6.5 1 2
9 1 . . . . . 2.6 1.8 3.5 1 2
10 1 . . . . . 2.2 1.8 2.8 1 2
11 1 . . . . . 2.6 1.8 3.5 1 2
12 1 . . . . . 2.6 1.8 4.0 1 2
13 1 . . . . . 2.2 1.8 2.8 1 2
14 1 . . . . . 3.4 1.8 5.5 1 2
15 1 . . . . . 3.4 1.8 6.0 1 2
16 1 . . . . . 3.4 1.8 6.0 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 . . . . . 2.6 1.8 3.5 1 2
22 1 . . . . . 2.6 1.8 4.0 1 2
23 1 . . . . . 2.2 1.8 2.8 1 2
24 1 . . . . . 3.4 1.8 5.5 1 2
25 1 . . . . . 3.4 1.8 5.5 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 3.5 1 2
29 1 . . . . . 3.4 1.8 6.0 1 2
30 1 . . . . . 2.6 1.8 3.5 1 2
31 1 . . . . . 2.6 1.8 3.5 1 2
32 1 . . . . . 3.4 1.8 5.5 1 2
33 1 . . . . . 2.6 1.8 3.5 1 2
34 1 . . . . . 2.6 1.8 3.5 1 2
35 1 . . . . . 2.6 1.8 3.5 1 2
36 1 . . . . . 3.4 1.8 6.0 1 2
37 1 . . . . . 2.6 1.8 3.5 1 2
38 1 . . . . . 3.4 1.8 5.5 1 2
39 1 . . . . . 2.6 1.8 3.5 1 2
40 1 . . . . . 2.6 1.8 4.0 1 2
41 1 . . . . . 3.4 1.8 6.0 1 2
42 1 . . . . . 3.4 1.8 6.0 1 2
43 1 . . . . . 3.4 1.8 6.0 1 2
44 1 . . . . . 3.4 1.8 6.5 1 2
45 1 . . . . . 2.6 1.8 4.0 1 2
46 1 . . . . . 3.4 1.8 6.0 1 2
47 1 . . . . . 3.4 1.8 6.0 1 2
48 1 . . . . . 3.4 1.8 6.5 1 2
49 1 . . . . . 3.4 1.8 6.5 1 2
50 1 . . . . . 3.4 1.8 6.5 1 2
51 1 . . . . . 3.4 1.8 6.0 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 -100.0 -40.0 . 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 -71.0 -55.0 . 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 -97.0 -53.0 . 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 -129.0 -60.999996 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
6 . 1 1 8 ALA C 1 1 9 PRO N 1 1 9 PRO CA 1 1 9 PRO C -70.0 -42.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
7 . 1 1 9 PRO C 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C -77.0 -57.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1
8 . 1 1 10 ALA C 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C -89.0 -49.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
9 . 1 1 11 LEU C 1 1 12 ALA N 1 1 12 ALA CA 1 1 12 ALA C -80.0 -47.999996 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
10 . 1 1 12 ALA C 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C -79.0 -50.999996 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
11 . 1 1 13 LEU C 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C -77.0 -53.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1
12 . 1 1 14 ALA C 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C -95.99999 -44.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1
13 . 1 1 15 LEU C 1 1 16 ALA N 1 1 16 ALA CA 1 1 16 ALA C -77.0 -53.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1
14 . 1 1 16 ALA C 1 1 17 LEU N 1 1 17 LEU CA 1 1 17 LEU C -76.0 -52.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1
15 . 1 1 17 LEU C 1 1 18 TRP N 1 1 18 TRP CA 1 1 18 TRP C -74.0 -53.999996 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1
16 . 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
17 . 1 1 4 TRP N 1 1 4 TRP CA 1 1 4 TRP C 1 1 5 LEU N -60.0 -16.0 . 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 -50.999996 -30.999998 . 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 -58.0 -2.0 . 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 -60.0 16.0 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1
21 . 1 1 9 PRO N 1 1 9 PRO CA 1 1 9 PRO C 1 1 10 ALA N -49.0 -13.0 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1
22 . 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C 1 1 11 LEU N -44.999996 -5.0 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1
23 . 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C 1 1 12 ALA N -57.0 -13.0 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1
24 . 1 1 12 ALA N 1 1 12 ALA CA 1 1 12 ALA C 1 1 13 LEU N -58.0 -18.0 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1
25 . 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C 1 1 14 ALA N -66.0 -10.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1
26 . 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C 1 1 15 LEU N -56.0 -20.0 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1
27 . 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C 1 1 16 ALA N -58.0 -14.0 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1
28 . 1 1 16 ALA N 1 1 16 ALA CA 1 1 16 ALA C 1 1 17 LEU N -52.0 -28.0 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1
29 . 1 1 18 TRP N 1 1 18 TRP CA 1 1 18 TRP C 1 1 19 TRP N -52.0 -36.0 . 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 -53.0 -33.0 . 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 23.134 -4.786 -9.033 1.00 . A A . 0 ACE C 1 1
1 2 1 1 1 ACE CH3 C 23.771 -5.742 -8.029 1.00 . A A . 0 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 23.741 -6.747 -8.422 1.00 . A A . 0 ACE H1 1 1
1 4 1 1 1 ACE H2 H 23.224 -5.704 -7.099 1.00 . A A . 0 ACE H2 1 1
1 5 1 1 1 ACE H3 H 24.796 -5.454 -7.857 1.00 . A A . 0 ACE H3 1 1
1 6 1 1 1 ACE O O 23.384 -4.879 -10.234 1.00 . A A . 0 ACE O 1 1
1 7 1 1 2 GLY C C 21.039 -1.800 -8.560 1.00 . A A . 1 GLY C 1 1
1 8 1 1 2 GLY CA C 21.645 -2.909 -9.390 1.00 . A A . 1 GLY CA 1 1
1 9 1 1 2 GLY H H 22.139 -3.834 -7.573 1.00 . A A . 1 GLY H 1 1
1 10 1 1 2 GLY HA2 H 22.347 -2.492 -10.088 1.00 . A A . 1 GLY HA2 1 1
1 11 1 1 2 GLY HA3 H 20.851 -3.411 -9.928 1.00 . A A . 1 GLY HA3 1 1
1 12 1 1 2 GLY N N 22.309 -3.869 -8.535 1.00 . A A . 1 GLY N 1 1
1 13 1 1 2 GLY O O 21.664 -1.245 -7.662 1.00 . A A . 1 GLY O 1 1
1 14 1 1 3 TRP C C 18.732 -0.950 -6.761 1.00 . A A . 2 TRP C 1 1
1 15 1 1 3 TRP CA C 19.084 -0.451 -8.163 1.00 . A A . 2 TRP CA 1 1
1 16 1 1 3 TRP CB C 17.824 -0.002 -8.957 1.00 . A A . 2 TRP CB 1 1
1 17 1 1 3 TRP CD1 C 17.365 -2.388 -9.390 1.00 . A A . 2 TRP CD1 1 1
1 18 1 1 3 TRP CD2 C 16.778 -1.123 -11.136 1.00 . A A . 2 TRP CD2 1 1
1 19 1 1 3 TRP CE2 C 16.479 -2.460 -11.489 1.00 . A A . 2 TRP CE2 1 1
1 20 1 1 3 TRP CE3 C 16.500 -0.111 -12.072 1.00 . A A . 2 TRP CE3 1 1
1 21 1 1 3 TRP CG C 17.341 -1.126 -9.794 1.00 . A A . 2 TRP CG 1 1
1 22 1 1 3 TRP CH2 C 15.653 -1.769 -13.644 1.00 . A A . 2 TRP CH2 1 1
1 23 1 1 3 TRP CZ2 C 15.925 -2.785 -12.724 1.00 . A A . 2 TRP CZ2 1 1
1 24 1 1 3 TRP CZ3 C 15.940 -0.434 -13.319 1.00 . A A . 2 TRP CZ3 1 1
1 25 1 1 3 TRP H H 19.391 -1.980 -9.591 1.00 . A A . 2 TRP H 1 1
1 26 1 1 3 TRP HA H 19.737 0.386 -8.043 1.00 . A A . 2 TRP HA 1 1
1 27 1 1 3 TRP HB2 H 17.041 0.288 -8.276 1.00 . A A . 2 TRP HB2 1 1
1 28 1 1 3 TRP HB3 H 18.072 0.834 -9.594 1.00 . A A . 2 TRP HB3 1 1
1 29 1 1 3 TRP HD1 H 17.732 -2.698 -8.434 1.00 . A A . 2 TRP HD1 1 1
1 30 1 1 3 TRP HE1 H 16.773 -4.167 -10.338 1.00 . A A . 2 TRP HE1 1 1
1 31 1 1 3 TRP HE3 H 16.717 0.919 -11.830 1.00 . A A . 2 TRP HE3 1 1
1 32 1 1 3 TRP HH2 H 15.222 -2.011 -14.605 1.00 . A A . 2 TRP HH2 1 1
1 33 1 1 3 TRP HZ2 H 15.708 -3.814 -12.964 1.00 . A A . 2 TRP HZ2 1 1
1 34 1 1 3 TRP HZ3 H 15.728 0.349 -14.032 1.00 . A A . 2 TRP HZ3 1 1
1 35 1 1 3 TRP N N 19.813 -1.492 -8.872 1.00 . A A . 2 TRP N 1 1
1 36 1 1 3 TRP NE1 N 16.859 -3.196 -10.386 1.00 . A A . 2 TRP NE1 1 1
1 37 1 1 3 TRP O O 17.966 -0.313 -6.039 1.00 . A A . 2 TRP O 1 1
1 38 1 1 4 TRP C C 19.896 -1.951 -4.022 1.00 . A A . 3 TRP C 1 1
1 39 1 1 4 TRP CA C 19.053 -2.671 -5.061 1.00 . A A . 3 TRP CA 1 1
1 40 1 1 4 TRP CB C 19.374 -4.179 -5.026 1.00 . A A . 3 TRP CB 1 1
1 41 1 1 4 TRP CD1 C 19.844 -5.588 -7.061 1.00 . A A . 3 TRP CD1 1 1
1 42 1 1 4 TRP CD2 C 17.733 -4.832 -7.023 1.00 . A A . 3 TRP CD2 1 1
1 43 1 1 4 TRP CE2 C 17.869 -5.603 -8.200 1.00 . A A . 3 TRP CE2 1 1
1 44 1 1 4 TRP CE3 C 16.486 -4.238 -6.765 1.00 . A A . 3 TRP CE3 1 1
1 45 1 1 4 TRP CG C 19.003 -4.839 -6.316 1.00 . A A . 3 TRP CG 1 1
1 46 1 1 4 TRP CH2 C 15.579 -5.180 -8.812 1.00 . A A . 3 TRP CH2 1 1
1 47 1 1 4 TRP CZ2 C 16.810 -5.780 -9.085 1.00 . A A . 3 TRP CZ2 1 1
1 48 1 1 4 TRP CZ3 C 15.422 -4.410 -7.652 1.00 . A A . 3 TRP CZ3 1 1
1 49 1 1 4 TRP H H 19.912 -2.561 -6.992 1.00 . A A . 3 TRP H 1 1
1 50 1 1 4 TRP HA H 18.029 -2.527 -4.818 1.00 . A A . 3 TRP HA 1 1
1 51 1 1 4 TRP HB2 H 20.428 -4.319 -4.858 1.00 . A A . 3 TRP HB2 1 1
1 52 1 1 4 TRP HB3 H 18.822 -4.642 -4.217 1.00 . A A . 3 TRP HB3 1 1
1 53 1 1 4 TRP HD1 H 20.871 -5.797 -6.822 1.00 . A A . 3 TRP HD1 1 1
1 54 1 1 4 TRP HE1 H 19.557 -6.606 -8.880 1.00 . A A . 3 TRP HE1 1 1
1 55 1 1 4 TRP HE3 H 16.346 -3.643 -5.884 1.00 . A A . 3 TRP HE3 1 1
1 56 1 1 4 TRP HH2 H 14.751 -5.310 -9.493 1.00 . A A . 3 TRP HH2 1 1
1 57 1 1 4 TRP HZ2 H 16.943 -6.376 -9.977 1.00 . A A . 3 TRP HZ2 1 1
1 58 1 1 4 TRP HZ3 H 14.479 -3.942 -7.438 1.00 . A A . 3 TRP HZ3 1 1
1 59 1 1 4 TRP N N 19.308 -2.099 -6.380 1.00 . A A . 3 TRP N 1 1
1 60 1 1 4 TRP NE1 N 19.173 -6.043 -8.178 1.00 . A A . 3 TRP NE1 1 1
1 61 1 1 4 TRP O O 19.379 -1.396 -3.054 1.00 . A A . 3 TRP O 1 1
1 62 1 1 5 LEU C C 21.676 0.128 -3.140 1.00 . A A . 4 LEU C 1 1
1 63 1 1 5 LEU CA C 22.121 -1.317 -3.334 1.00 . A A . 4 LEU CA 1 1
1 64 1 1 5 LEU CB C 23.562 -1.371 -3.886 1.00 . A A . 4 LEU CB 1 1
1 65 1 1 5 LEU CD1 C 23.793 -2.793 -6.017 1.00 . A A . 4 LEU CD1 1 1
1 66 1 1 5 LEU CD2 C 25.312 -3.229 -4.097 1.00 . A A . 4 LEU CD2 1 1
1 67 1 1 5 LEU CG C 23.888 -2.793 -4.483 1.00 . A A . 4 LEU CG 1 1
1 68 1 1 5 LEU H H 21.546 -2.425 -5.033 1.00 . A A . 4 LEU H 1 1
1 69 1 1 5 LEU HA H 22.088 -1.828 -2.383 1.00 . A A . 4 LEU HA 1 1
1 70 1 1 5 LEU HB2 H 23.672 -0.605 -4.648 1.00 . A A . 4 LEU HB2 1 1
1 71 1 1 5 LEU HB3 H 24.242 -1.152 -3.072 1.00 . A A . 4 LEU HB3 1 1
1 72 1 1 5 LEU HD11 H 22.763 -2.750 -6.301 1.00 . A A . 4 LEU HD11 1 1
1 73 1 1 5 LEU HD12 H 24.228 -3.702 -6.406 1.00 . A A . 4 LEU HD12 1 1
1 74 1 1 5 LEU HD13 H 24.320 -1.944 -6.424 1.00 . A A . 4 LEU HD13 1 1
1 75 1 1 5 LEU HD21 H 25.569 -4.126 -4.643 1.00 . A A . 4 LEU HD21 1 1
1 76 1 1 5 LEU HD22 H 25.355 -3.427 -3.037 1.00 . A A . 4 LEU HD22 1 1
1 77 1 1 5 LEU HD23 H 26.010 -2.443 -4.346 1.00 . A A . 4 LEU HD23 1 1
1 78 1 1 5 LEU HG H 23.181 -3.522 -4.107 1.00 . A A . 4 LEU HG 1 1
1 79 1 1 5 LEU N N 21.201 -1.968 -4.243 1.00 . A A . 4 LEU N 1 1
1 80 1 1 5 LEU O O 21.926 0.742 -2.104 1.00 . A A . 4 LEU O 1 1
1 81 1 1 6 ALA C C 19.697 2.275 -2.871 1.00 . A A . 5 ALA C 1 1
1 82 1 1 6 ALA CA C 20.509 2.022 -4.140 1.00 . A A . 5 ALA CA 1 1
1 83 1 1 6 ALA CB C 19.620 2.260 -5.365 1.00 . A A . 5 ALA CB 1 1
1 84 1 1 6 ALA H H 20.844 0.100 -4.957 1.00 . A A . 5 ALA H 1 1
1 85 1 1 6 ALA HA H 21.340 2.706 -4.176 1.00 . A A . 5 ALA HA 1 1
1 86 1 1 6 ALA HB1 H 19.472 3.320 -5.504 1.00 . A A . 5 ALA HB1 1 1
1 87 1 1 6 ALA HB2 H 18.663 1.778 -5.217 1.00 . A A . 5 ALA HB2 1 1
1 88 1 1 6 ALA HB3 H 20.096 1.844 -6.241 1.00 . A A . 5 ALA HB3 1 1
1 89 1 1 6 ALA N N 21.007 0.653 -4.165 1.00 . A A . 5 ALA N 1 1
1 90 1 1 6 ALA O O 19.337 3.413 -2.571 1.00 . A A . 5 ALA O 1 1
1 91 1 1 7 LEU C C 19.553 1.585 0.301 1.00 . A A . 6 LEU C 1 1
1 92 1 1 7 LEU CA C 18.643 1.305 -0.895 1.00 . A A . 6 LEU CA 1 1
1 93 1 1 7 LEU CB C 17.887 -0.005 -0.661 1.00 . A A . 6 LEU CB 1 1
1 94 1 1 7 LEU CD1 C 16.610 -1.802 -1.875 1.00 . A A . 6 LEU CD1 1 1
1 95 1 1 7 LEU CD2 C 15.651 0.495 -1.737 1.00 . A A . 6 LEU CD2 1 1
1 96 1 1 7 LEU CG C 16.955 -0.310 -1.855 1.00 . A A . 6 LEU CG 1 1
1 97 1 1 7 LEU H H 19.721 0.328 -2.417 1.00 . A A . 6 LEU H 1 1
1 98 1 1 7 LEU HA H 17.928 2.102 -0.984 1.00 . A A . 6 LEU HA 1 1
1 99 1 1 7 LEU HB2 H 18.607 -0.807 -0.547 1.00 . A A . 6 LEU HB2 1 1
1 100 1 1 7 LEU HB3 H 17.304 0.079 0.239 1.00 . A A . 6 LEU HB3 1 1
1 101 1 1 7 LEU HD11 H 17.516 -2.380 -1.978 1.00 . A A . 6 LEU HD11 1 1
1 102 1 1 7 LEU HD12 H 15.955 -2.008 -2.709 1.00 . A A . 6 LEU HD12 1 1
1 103 1 1 7 LEU HD13 H 16.115 -2.069 -0.954 1.00 . A A . 6 LEU HD13 1 1
1 104 1 1 7 LEU HD21 H 15.217 0.347 -0.759 1.00 . A A . 6 LEU HD21 1 1
1 105 1 1 7 LEU HD22 H 14.955 0.156 -2.490 1.00 . A A . 6 LEU HD22 1 1
1 106 1 1 7 LEU HD23 H 15.854 1.544 -1.888 1.00 . A A . 6 LEU HD23 1 1
1 107 1 1 7 LEU HG H 17.459 -0.053 -2.777 1.00 . A A . 6 LEU HG 1 1
1 108 1 1 7 LEU N N 19.412 1.205 -2.130 1.00 . A A . 6 LEU N 1 1
1 109 1 1 7 LEU O O 19.113 2.147 1.304 1.00 . A A . 6 LEU O 1 1
1 110 1 1 8 ALA C C 21.916 2.913 1.584 1.00 . A A . 7 ALA C 1 1
1 111 1 1 8 ALA CA C 21.768 1.409 1.284 1.00 . A A . 7 ALA CA 1 1
1 112 1 1 8 ALA CB C 23.135 0.744 0.939 1.00 . A A . 7 ALA CB 1 1
1 113 1 1 8 ALA H H 21.120 0.745 -0.624 1.00 . A A . 7 ALA H 1 1
1 114 1 1 8 ALA HA H 21.365 0.937 2.171 1.00 . A A . 7 ALA HA 1 1
1 115 1 1 8 ALA HB1 H 23.121 0.428 -0.094 1.00 . A A . 7 ALA HB1 1 1
1 116 1 1 8 ALA HB2 H 23.300 -0.124 1.566 1.00 . A A . 7 ALA HB2 1 1
1 117 1 1 8 ALA HB3 H 23.949 1.443 1.086 1.00 . A A . 7 ALA HB3 1 1
1 118 1 1 8 ALA N N 20.820 1.191 0.195 1.00 . A A . 7 ALA N 1 1
1 119 1 1 8 ALA O O 21.717 3.339 2.721 1.00 . A A . 7 ALA O 1 1
1 120 1 1 9 PRO C C 21.335 5.788 1.699 1.00 . A A . 8 PRO C 1 1
1 121 1 1 9 PRO CA C 22.422 5.194 0.800 1.00 . A A . 8 PRO CA 1 1
1 122 1 1 9 PRO CB C 22.312 5.735 -0.625 1.00 . A A . 8 PRO CB 1 1
1 123 1 1 9 PRO CD C 22.523 3.335 -0.797 1.00 . A A . 8 PRO CD 1 1
1 124 1 1 9 PRO CG C 22.909 4.662 -1.474 1.00 . A A . 8 PRO CG 1 1
1 125 1 1 9 PRO HA H 23.400 5.420 1.184 1.00 . A A . 8 PRO HA 1 1
1 126 1 1 9 PRO HB2 H 21.268 5.896 -0.888 1.00 . A A . 8 PRO HB2 1 1
1 127 1 1 9 PRO HB3 H 22.871 6.644 -0.734 1.00 . A A . 8 PRO HB3 1 1
1 128 1 1 9 PRO HD2 H 21.636 2.925 -1.259 1.00 . A A . 8 PRO HD2 1 1
1 129 1 1 9 PRO HD3 H 23.336 2.632 -0.838 1.00 . A A . 8 PRO HD3 1 1
1 130 1 1 9 PRO HG2 H 22.504 4.717 -2.482 1.00 . A A . 8 PRO HG2 1 1
1 131 1 1 9 PRO HG3 H 23.986 4.752 -1.497 1.00 . A A . 8 PRO HG3 1 1
1 132 1 1 9 PRO N N 22.257 3.719 0.604 1.00 . A A . 8 PRO N 1 1
1 133 1 1 9 PRO O O 21.622 6.496 2.663 1.00 . A A . 8 PRO O 1 1
1 134 1 1 10 ALA C C 18.959 5.424 3.549 1.00 . A A . 9 ALA C 1 1
1 135 1 1 10 ALA CA C 18.958 5.990 2.131 1.00 . A A . 9 ALA CA 1 1
1 136 1 1 10 ALA CB C 17.650 5.616 1.432 1.00 . A A . 9 ALA CB 1 1
1 137 1 1 10 ALA H H 19.935 4.924 0.582 1.00 . A A . 9 ALA H 1 1
1 138 1 1 10 ALA HA H 19.021 7.065 2.183 1.00 . A A . 9 ALA HA 1 1
1 139 1 1 10 ALA HB1 H 16.834 6.167 1.877 1.00 . A A . 9 ALA HB1 1 1
1 140 1 1 10 ALA HB2 H 17.472 4.557 1.543 1.00 . A A . 9 ALA HB2 1 1
1 141 1 1 10 ALA HB3 H 17.720 5.861 0.382 1.00 . A A . 9 ALA HB3 1 1
1 142 1 1 10 ALA N N 20.092 5.490 1.364 1.00 . A A . 9 ALA N 1 1
1 143 1 1 10 ALA O O 18.410 6.034 4.467 1.00 . A A . 9 ALA O 1 1
1 144 1 1 11 LEU C C 20.899 4.088 5.753 1.00 . A A . 10 LEU C 1 1
1 145 1 1 11 LEU CA C 19.651 3.599 5.026 1.00 . A A . 10 LEU CA 1 1
1 146 1 1 11 LEU CB C 19.617 2.053 4.775 1.00 . A A . 10 LEU CB 1 1
1 147 1 1 11 LEU CD1 C 20.046 1.295 7.165 1.00 . A A . 10 LEU CD1 1 1
1 148 1 1 11 LEU CD2 C 20.595 -0.200 5.199 1.00 . A A . 10 LEU CD2 1 1
1 149 1 1 11 LEU CG C 20.552 1.255 5.700 1.00 . A A . 10 LEU CG 1 1
1 150 1 1 11 LEU H H 19.997 3.810 2.966 1.00 . A A . 10 LEU H 1 1
1 151 1 1 11 LEU HA H 18.807 3.886 5.604 1.00 . A A . 10 LEU HA 1 1
1 152 1 1 11 LEU HB2 H 18.610 1.689 4.918 1.00 . A A . 10 LEU HB2 1 1
1 153 1 1 11 LEU HB3 H 19.900 1.868 3.747 1.00 . A A . 10 LEU HB3 1 1
1 154 1 1 11 LEU HD11 H 19.390 0.456 7.363 1.00 . A A . 10 LEU HD11 1 1
1 155 1 1 11 LEU HD12 H 19.500 2.210 7.346 1.00 . A A . 10 LEU HD12 1 1
1 156 1 1 11 LEU HD13 H 20.893 1.248 7.833 1.00 . A A . 10 LEU HD13 1 1
1 157 1 1 11 LEU HD21 H 21.222 -0.788 5.853 1.00 . A A . 10 LEU HD21 1 1
1 158 1 1 11 LEU HD22 H 20.996 -0.224 4.197 1.00 . A A . 10 LEU HD22 1 1
1 159 1 1 11 LEU HD23 H 19.594 -0.608 5.196 1.00 . A A . 10 LEU HD23 1 1
1 160 1 1 11 LEU HG H 21.548 1.671 5.645 1.00 . A A . 10 LEU HG 1 1
1 161 1 1 11 LEU N N 19.577 4.252 3.726 1.00 . A A . 10 LEU N 1 1
1 162 1 1 11 LEU O O 21.093 3.861 6.946 1.00 . A A . 10 LEU O 1 1
1 163 1 1 12 ALA C C 22.727 6.017 6.854 1.00 . A A . 11 ALA C 1 1
1 164 1 1 12 ALA CA C 22.978 5.297 5.535 1.00 . A A . 11 ALA CA 1 1
1 165 1 1 12 ALA CB C 23.610 6.265 4.534 1.00 . A A . 11 ALA CB 1 1
1 166 1 1 12 ALA H H 21.496 4.889 4.070 1.00 . A A . 11 ALA H 1 1
1 167 1 1 12 ALA HA H 23.662 4.482 5.709 1.00 . A A . 11 ALA HA 1 1
1 168 1 1 12 ALA HB1 H 24.599 6.536 4.872 1.00 . A A . 11 ALA HB1 1 1
1 169 1 1 12 ALA HB2 H 23.001 7.152 4.456 1.00 . A A . 11 ALA HB2 1 1
1 170 1 1 12 ALA HB3 H 23.679 5.788 3.567 1.00 . A A . 11 ALA HB3 1 1
1 171 1 1 12 ALA N N 21.730 4.757 5.002 1.00 . A A . 11 ALA N 1 1
1 172 1 1 12 ALA O O 23.655 6.256 7.626 1.00 . A A . 11 ALA O 1 1
1 173 1 1 13 LEU C C 21.248 6.096 9.520 1.00 . A A . 12 LEU C 1 1
1 174 1 1 13 LEU CA C 21.120 7.047 8.340 1.00 . A A . 12 LEU CA 1 1
1 175 1 1 13 LEU CB C 19.693 7.597 8.258 1.00 . A A . 12 LEU CB 1 1
1 176 1 1 13 LEU CD1 C 18.051 8.812 6.820 1.00 . A A . 12 LEU CD1 1 1
1 177 1 1 13 LEU CD2 C 20.493 9.299 6.608 1.00 . A A . 12 LEU CD2 1 1
1 178 1 1 13 LEU CG C 19.454 8.204 6.874 1.00 . A A . 12 LEU CG 1 1
1 179 1 1 13 LEU H H 20.769 6.143 6.462 1.00 . A A . 12 LEU H 1 1
1 180 1 1 13 LEU HA H 21.804 7.867 8.483 1.00 . A A . 12 LEU HA 1 1
1 181 1 1 13 LEU HB2 H 18.987 6.795 8.426 1.00 . A A . 12 LEU HB2 1 1
1 182 1 1 13 LEU HB3 H 19.557 8.360 9.008 1.00 . A A . 12 LEU HB3 1 1
1 183 1 1 13 LEU HD11 H 17.961 9.579 7.576 1.00 . A A . 12 LEU HD11 1 1
1 184 1 1 13 LEU HD12 H 17.317 8.041 7.000 1.00 . A A . 12 LEU HD12 1 1
1 185 1 1 13 LEU HD13 H 17.884 9.248 5.846 1.00 . A A . 12 LEU HD13 1 1
1 186 1 1 13 LEU HD21 H 20.593 9.923 7.484 1.00 . A A . 12 LEU HD21 1 1
1 187 1 1 13 LEU HD22 H 20.176 9.902 5.769 1.00 . A A . 12 LEU HD22 1 1
1 188 1 1 13 LEU HD23 H 21.446 8.842 6.381 1.00 . A A . 12 LEU HD23 1 1
1 189 1 1 13 LEU HG H 19.537 7.430 6.124 1.00 . A A . 12 LEU HG 1 1
1 190 1 1 13 LEU N N 21.469 6.359 7.109 1.00 . A A . 12 LEU N 1 1
1 191 1 1 13 LEU O O 22.075 6.306 10.408 1.00 . A A . 12 LEU O 1 1
1 192 1 1 14 ALA C C 21.893 3.505 10.698 1.00 . A A . 13 ALA C 1 1
1 193 1 1 14 ALA CA C 20.491 4.085 10.618 1.00 . A A . 13 ALA CA 1 1
1 194 1 1 14 ALA CB C 19.476 2.960 10.410 1.00 . A A . 13 ALA CB 1 1
1 195 1 1 14 ALA H H 19.792 4.919 8.799 1.00 . A A . 13 ALA H 1 1
1 196 1 1 14 ALA HA H 20.270 4.593 11.543 1.00 . A A . 13 ALA HA 1 1
1 197 1 1 14 ALA HB1 H 18.533 3.378 10.092 1.00 . A A . 13 ALA HB1 1 1
1 198 1 1 14 ALA HB2 H 19.339 2.430 11.342 1.00 . A A . 13 ALA HB2 1 1
1 199 1 1 14 ALA HB3 H 19.842 2.277 9.660 1.00 . A A . 13 ALA HB3 1 1
1 200 1 1 14 ALA N N 20.433 5.047 9.529 1.00 . A A . 13 ALA N 1 1
1 201 1 1 14 ALA O O 22.415 3.260 11.783 1.00 . A A . 13 ALA O 1 1
1 202 1 1 15 LEU C C 24.750 3.600 10.384 1.00 . A A . 14 LEU C 1 1
1 203 1 1 15 LEU CA C 23.851 2.740 9.517 1.00 . A A . 14 LEU CA 1 1
1 204 1 1 15 LEU CB C 24.370 2.672 8.067 1.00 . A A . 14 LEU CB 1 1
1 205 1 1 15 LEU CD1 C 25.745 1.120 6.597 1.00 . A A . 14 LEU CD1 1 1
1 206 1 1 15 LEU CD2 C 26.921 2.691 8.124 1.00 . A A . 14 LEU CD2 1 1
1 207 1 1 15 LEU CG C 25.668 1.810 7.965 1.00 . A A . 14 LEU CG 1 1
1 208 1 1 15 LEU H H 22.051 3.502 8.695 1.00 . A A . 14 LEU H 1 1
1 209 1 1 15 LEU HA H 23.820 1.754 9.936 1.00 . A A . 14 LEU HA 1 1
1 210 1 1 15 LEU HB2 H 23.592 2.238 7.451 1.00 . A A . 14 LEU HB2 1 1
1 211 1 1 15 LEU HB3 H 24.569 3.675 7.718 1.00 . A A . 14 LEU HB3 1 1
1 212 1 1 15 LEU HD11 H 24.984 0.355 6.537 1.00 . A A . 14 LEU HD11 1 1
1 213 1 1 15 LEU HD12 H 26.718 0.669 6.476 1.00 . A A . 14 LEU HD12 1 1
1 214 1 1 15 LEU HD13 H 25.585 1.849 5.817 1.00 . A A . 14 LEU HD13 1 1
1 215 1 1 15 LEU HD21 H 27.802 2.095 7.938 1.00 . A A . 14 LEU HD21 1 1
1 216 1 1 15 LEU HD22 H 26.963 3.088 9.124 1.00 . A A . 14 LEU HD22 1 1
1 217 1 1 15 LEU HD23 H 26.884 3.505 7.415 1.00 . A A . 14 LEU HD23 1 1
1 218 1 1 15 LEU HG H 25.664 1.047 8.731 1.00 . A A . 14 LEU HG 1 1
1 219 1 1 15 LEU N N 22.506 3.289 9.540 1.00 . A A . 14 LEU N 1 1
1 220 1 1 15 LEU O O 25.484 3.089 11.227 1.00 . A A . 14 LEU O 1 1
1 221 1 1 16 ALA C C 25.171 5.631 12.449 1.00 . A A . 15 ALA C 1 1
1 222 1 1 16 ALA CA C 25.499 5.814 10.971 1.00 . A A . 15 ALA CA 1 1
1 223 1 1 16 ALA CB C 25.231 7.261 10.556 1.00 . A A . 15 ALA CB 1 1
1 224 1 1 16 ALA H H 24.074 5.269 9.503 1.00 . A A . 15 ALA H 1 1
1 225 1 1 16 ALA HA H 26.541 5.587 10.808 1.00 . A A . 15 ALA HA 1 1
1 226 1 1 16 ALA HB1 H 25.514 7.397 9.522 1.00 . A A . 15 ALA HB1 1 1
1 227 1 1 16 ALA HB2 H 25.811 7.928 11.177 1.00 . A A . 15 ALA HB2 1 1
1 228 1 1 16 ALA HB3 H 24.181 7.482 10.673 1.00 . A A . 15 ALA HB3 1 1
1 229 1 1 16 ALA N N 24.684 4.908 10.184 1.00 . A A . 15 ALA N 1 1
1 230 1 1 16 ALA O O 25.992 5.912 13.322 1.00 . A A . 15 ALA O 1 1
1 231 1 1 17 LEU C C 24.155 3.718 14.726 1.00 . A A . 16 LEU C 1 1
1 232 1 1 17 LEU CA C 23.501 4.947 14.083 1.00 . A A . 16 LEU CA 1 1
1 233 1 1 17 LEU CB C 21.963 4.814 14.114 1.00 . A A . 16 LEU CB 1 1
1 234 1 1 17 LEU CD1 C 19.880 5.048 15.485 1.00 . A A . 16 LEU CD1 1 1
1 235 1 1 17 LEU CD2 C 22.044 4.466 16.603 1.00 . A A . 16 LEU CD2 1 1
1 236 1 1 17 LEU CG C 21.394 5.272 15.469 1.00 . A A . 16 LEU CG 1 1
1 237 1 1 17 LEU H H 23.342 4.964 11.976 1.00 . A A . 16 LEU H 1 1
1 238 1 1 17 LEU HA H 23.776 5.811 14.657 1.00 . A A . 16 LEU HA 1 1
1 239 1 1 17 LEU HB2 H 21.540 5.427 13.333 1.00 . A A . 16 LEU HB2 1 1
1 240 1 1 17 LEU HB3 H 21.682 3.785 13.944 1.00 . A A . 16 LEU HB3 1 1
1 241 1 1 17 LEU HD11 H 19.664 4.028 15.204 1.00 . A A . 16 LEU HD11 1 1
1 242 1 1 17 LEU HD12 H 19.409 5.722 14.785 1.00 . A A . 16 LEU HD12 1 1
1 243 1 1 17 LEU HD13 H 19.499 5.237 16.477 1.00 . A A . 16 LEU HD13 1 1
1 244 1 1 17 LEU HD21 H 21.450 4.560 17.502 1.00 . A A . 16 LEU HD21 1 1
1 245 1 1 17 LEU HD22 H 23.037 4.847 16.792 1.00 . A A . 16 LEU HD22 1 1
1 246 1 1 17 LEU HD23 H 22.104 3.426 16.319 1.00 . A A . 16 LEU HD23 1 1
1 247 1 1 17 LEU HG H 21.600 6.326 15.603 1.00 . A A . 16 LEU HG 1 1
1 248 1 1 17 LEU N N 23.952 5.163 12.715 1.00 . A A . 16 LEU N 1 1
1 249 1 1 17 LEU O O 24.934 3.857 15.668 1.00 . A A . 16 LEU O 1 1
1 250 1 1 18 TRP C C 25.877 1.094 14.426 1.00 . A A . 17 TRP C 1 1
1 251 1 1 18 TRP CA C 24.422 1.305 14.819 1.00 . A A . 17 TRP CA 1 1
1 252 1 1 18 TRP CB C 23.601 0.064 14.470 1.00 . A A . 17 TRP CB 1 1
1 253 1 1 18 TRP CD1 C 22.347 0.408 12.301 1.00 . A A . 17 TRP CD1 1 1
1 254 1 1 18 TRP CD2 C 24.225 -0.803 12.035 1.00 . A A . 17 TRP CD2 1 1
1 255 1 1 18 TRP CE2 C 23.628 -0.693 10.759 1.00 . A A . 17 TRP CE2 1 1
1 256 1 1 18 TRP CE3 C 25.429 -1.523 12.142 1.00 . A A . 17 TRP CE3 1 1
1 257 1 1 18 TRP CG C 23.392 -0.094 12.998 1.00 . A A . 17 TRP CG 1 1
1 258 1 1 18 TRP CH2 C 25.396 -1.985 9.751 1.00 . A A . 17 TRP CH2 1 1
1 259 1 1 18 TRP CZ2 C 24.200 -1.274 9.630 1.00 . A A . 17 TRP CZ2 1 1
1 260 1 1 18 TRP CZ3 C 26.009 -2.110 11.006 1.00 . A A . 17 TRP CZ3 1 1
1 261 1 1 18 TRP H H 23.206 2.439 13.487 1.00 . A A . 17 TRP H 1 1
1 262 1 1 18 TRP HA H 24.392 1.417 15.893 1.00 . A A . 17 TRP HA 1 1
1 263 1 1 18 TRP HB2 H 24.122 -0.799 14.829 1.00 . A A . 17 TRP HB2 1 1
1 264 1 1 18 TRP HB3 H 22.643 0.131 14.963 1.00 . A A . 17 TRP HB3 1 1
1 265 1 1 18 TRP HD1 H 21.537 0.990 12.715 1.00 . A A . 17 TRP HD1 1 1
1 266 1 1 18 TRP HE1 H 21.865 0.290 10.254 1.00 . A A . 17 TRP HE1 1 1
1 267 1 1 18 TRP HE3 H 25.909 -1.624 13.102 1.00 . A A . 17 TRP HE3 1 1
1 268 1 1 18 TRP HH2 H 25.847 -2.439 8.881 1.00 . A A . 17 TRP HH2 1 1
1 269 1 1 18 TRP HZ2 H 23.721 -1.172 8.668 1.00 . A A . 17 TRP HZ2 1 1
1 270 1 1 18 TRP HZ3 H 26.934 -2.661 11.099 1.00 . A A . 17 TRP HZ3 1 1
1 271 1 1 18 TRP N N 23.837 2.515 14.235 1.00 . A A . 17 TRP N 1 1
1 272 1 1 18 TRP NE1 N 22.487 0.052 10.972 1.00 . A A . 17 TRP NE1 1 1
1 273 1 1 18 TRP O O 26.699 0.730 15.267 1.00 . A A . 17 TRP O 1 1
1 274 1 1 19 TRP C C 28.521 1.902 13.642 1.00 . A A . 18 TRP C 1 1
1 275 1 1 19 TRP CA C 27.585 1.130 12.723 1.00 . A A . 18 TRP CA 1 1
1 276 1 1 19 TRP CB C 27.762 1.631 11.283 1.00 . A A . 18 TRP CB 1 1
1 277 1 1 19 TRP CD1 C 29.199 -0.169 10.247 1.00 . A A . 18 TRP CD1 1 1
1 278 1 1 19 TRP CD2 C 30.312 1.763 10.528 1.00 . A A . 18 TRP CD2 1 1
1 279 1 1 19 TRP CE2 C 31.222 0.851 9.945 1.00 . A A . 18 TRP CE2 1 1
1 280 1 1 19 TRP CE3 C 30.767 3.064 10.809 1.00 . A A . 18 TRP CE3 1 1
1 281 1 1 19 TRP CG C 29.034 1.089 10.708 1.00 . A A . 18 TRP CG 1 1
1 282 1 1 19 TRP CH2 C 32.973 2.509 9.937 1.00 . A A . 18 TRP CH2 1 1
1 283 1 1 19 TRP CZ2 C 32.535 1.213 9.652 1.00 . A A . 18 TRP CZ2 1 1
1 284 1 1 19 TRP CZ3 C 32.090 3.434 10.515 1.00 . A A . 18 TRP CZ3 1 1
1 285 1 1 19 TRP H H 25.520 1.602 12.531 1.00 . A A . 18 TRP H 1 1
1 286 1 1 19 TRP HA H 27.829 0.078 12.768 1.00 . A A . 18 TRP HA 1 1
1 287 1 1 19 TRP HB2 H 26.929 1.300 10.686 1.00 . A A . 18 TRP HB2 1 1
1 288 1 1 19 TRP HB3 H 27.799 2.711 11.278 1.00 . A A . 18 TRP HB3 1 1
1 289 1 1 19 TRP HD1 H 28.440 -0.937 10.235 1.00 . A A . 18 TRP HD1 1 1
1 290 1 1 19 TRP HE1 H 30.877 -1.129 9.408 1.00 . A A . 18 TRP HE1 1 1
1 291 1 1 19 TRP HE3 H 30.095 3.784 11.254 1.00 . A A . 18 TRP HE3 1 1
1 292 1 1 19 TRP HH2 H 33.988 2.798 9.712 1.00 . A A . 18 TRP HH2 1 1
1 293 1 1 19 TRP HZ2 H 33.208 0.495 9.208 1.00 . A A . 18 TRP HZ2 1 1
1 294 1 1 19 TRP HZ3 H 32.431 4.435 10.734 1.00 . A A . 18 TRP HZ3 1 1
1 295 1 1 19 TRP N N 26.205 1.316 13.166 1.00 . A A . 18 TRP N 1 1
1 296 1 1 19 TRP NE1 N 30.498 -0.312 9.793 1.00 . A A . 18 TRP NE1 1 1
1 297 1 1 19 TRP O O 29.473 1.349 14.193 1.00 . A A . 18 TRP O 1 1
1 298 1 1 20 ALA C C 28.394 4.179 16.034 1.00 . A A . 19 ALA C 1 1
1 299 1 1 20 ALA CA C 29.028 4.071 14.654 1.00 . A A . 19 ALA CA 1 1
1 300 1 1 20 ALA CB C 29.128 5.462 14.022 1.00 . A A . 19 ALA CB 1 1
1 301 1 1 20 ALA H H 27.457 3.557 13.333 1.00 . A A . 19 ALA H 1 1
1 302 1 1 20 ALA HA H 30.018 3.666 14.760 1.00 . A A . 19 ALA HA 1 1
1 303 1 1 20 ALA HB1 H 29.926 6.014 14.495 1.00 . A A . 19 ALA HB1 1 1
1 304 1 1 20 ALA HB2 H 28.195 5.989 14.160 1.00 . A A . 19 ALA HB2 1 1
1 305 1 1 20 ALA HB3 H 29.335 5.363 12.967 1.00 . A A . 19 ALA HB3 1 1
1 306 1 1 20 ALA N N 28.230 3.191 13.801 1.00 . A A . 19 ALA N 1 1
1 307 1 1 20 ALA O O 28.515 5.201 16.709 1.00 . A A . 19 ALA O 1 1
1 308 1 1 21 ETA CA C 27.062 3.084 17.742 1.00 . A A . 20 ETA CA 1 1
1 309 1 1 21 ETA CB C 28.087 2.857 18.851 1.00 . A A . 20 ETA CB 1 1
1 310 1 1 21 ETA HA1 H 26.342 2.282 17.762 1.00 . A A . 20 ETA HA1 1 1
1 311 1 1 21 ETA HA2 H 26.556 4.027 17.907 1.00 . A A . 20 ETA HA2 1 1
1 312 1 1 21 ETA HB1 H 28.710 2.008 18.595 1.00 . A A . 20 ETA HB1 1 1
1 313 1 1 21 ETA HB2 H 27.582 2.656 19.778 1.00 . A A . 20 ETA HB2 1 1
1 314 1 1 21 ETA HN2 H 27.662 2.332 15.852 1.00 . A A . 20 ETA HN2 1 1
1 315 1 1 21 ETA HO H 29.602 3.826 19.597 1.00 . A A . 20 ETA HO 1 1
1 316 1 1 21 ETA N N 27.719 3.114 16.441 1.00 . A A . 20 ETA N 1 1
1 317 1 1 21 ETA O O 28.878 4.031 19.002 1.00 . A A . 20 ETA O 1 1
2 318 1 1 1 ACE C C 22.000 -6.381 -7.533 1.00 . A A . 0 ACE C 1 1
2 319 1 1 1 ACE CH3 C 22.316 -7.156 -6.259 1.00 . A A . 0 ACE CH3 1 1
2 320 1 1 1 ACE H1 H 23.378 -7.117 -6.067 1.00 . A A . 0 ACE H1 1 1
2 321 1 1 1 ACE H2 H 22.010 -8.185 -6.378 1.00 . A A . 0 ACE H2 1 1
2 322 1 1 1 ACE H3 H 21.783 -6.717 -5.428 1.00 . A A . 0 ACE H3 1 1
2 323 1 1 1 ACE O O 22.239 -6.866 -8.640 1.00 . A A . 0 ACE O 1 1
2 324 1 1 2 GLY C C 20.836 -2.932 -8.064 1.00 . A A . 1 GLY C 1 1
2 325 1 1 2 GLY CA C 21.113 -4.349 -8.511 1.00 . A A . 1 GLY CA 1 1
2 326 1 1 2 GLY H H 21.284 -4.832 -6.477 1.00 . A A . 1 GLY H 1 1
2 327 1 1 2 GLY HA2 H 21.919 -4.349 -9.223 1.00 . A A . 1 GLY HA2 1 1
2 328 1 1 2 GLY HA3 H 20.220 -4.746 -8.974 1.00 . A A . 1 GLY HA3 1 1
2 329 1 1 2 GLY N N 21.458 -5.176 -7.375 1.00 . A A . 1 GLY N 1 1
2 330 1 1 2 GLY O O 21.574 -2.341 -7.282 1.00 . A A . 1 GLY O 1 1
2 331 1 1 3 TRP C C 18.828 -1.024 -6.789 1.00 . A A . 2 TRP C 1 1
2 332 1 1 3 TRP CA C 19.345 -1.049 -8.228 1.00 . A A . 2 TRP CA 1 1
2 333 1 1 3 TRP CB C 18.287 -0.513 -9.238 1.00 . A A . 2 TRP CB 1 1
2 334 1 1 3 TRP CD1 C 17.167 -2.704 -9.082 1.00 . A A . 2 TRP CD1 1 1
2 335 1 1 3 TRP CD2 C 17.027 -1.872 -11.152 1.00 . A A . 2 TRP CD2 1 1
2 336 1 1 3 TRP CE2 C 16.361 -3.120 -11.175 1.00 . A A . 2 TRP CE2 1 1
2 337 1 1 3 TRP CE3 C 17.084 -1.128 -12.344 1.00 . A A . 2 TRP CE3 1 1
2 338 1 1 3 TRP CG C 17.524 -1.651 -9.801 1.00 . A A . 2 TRP CG 1 1
2 339 1 1 3 TRP CH2 C 15.838 -2.866 -13.513 1.00 . A A . 2 TRP CH2 1 1
2 340 1 1 3 TRP CZ2 C 15.774 -3.615 -12.335 1.00 . A A . 2 TRP CZ2 1 1
2 341 1 1 3 TRP CZ3 C 16.491 -1.624 -13.518 1.00 . A A . 2 TRP CZ3 1 1
2 342 1 1 3 TRP H H 19.229 -2.937 -9.172 1.00 . A A . 2 TRP H 1 1
2 343 1 1 3 TRP HA H 20.208 -0.422 -8.263 1.00 . A A . 2 TRP HA 1 1
2 344 1 1 3 TRP HB2 H 17.605 0.154 -8.739 1.00 . A A . 2 TRP HB2 1 1
2 345 1 1 3 TRP HB3 H 18.783 0.014 -10.040 1.00 . A A . 2 TRP HB3 1 1
2 346 1 1 3 TRP HD1 H 17.398 -2.821 -8.044 1.00 . A A . 2 TRP HD1 1 1
2 347 1 1 3 TRP HE1 H 16.109 -4.447 -9.593 1.00 . A A . 2 TRP HE1 1 1
2 348 1 1 3 TRP HE3 H 17.585 -0.171 -12.357 1.00 . A A . 2 TRP HE3 1 1
2 349 1 1 3 TRP HH2 H 15.385 -3.241 -14.418 1.00 . A A . 2 TRP HH2 1 1
2 350 1 1 3 TRP HZ2 H 15.273 -4.572 -12.322 1.00 . A A . 2 TRP HZ2 1 1
2 351 1 1 3 TRP HZ3 H 16.540 -1.046 -14.429 1.00 . A A . 2 TRP HZ3 1 1
2 352 1 1 3 TRP N N 19.758 -2.402 -8.567 1.00 . A A . 2 TRP N 1 1
2 353 1 1 3 TRP NE1 N 16.477 -3.592 -9.884 1.00 . A A . 2 TRP NE1 1 1
2 354 1 1 3 TRP O O 18.252 -0.032 -6.343 1.00 . A A . 2 TRP O 1 1
2 355 1 1 4 TRP C C 19.601 -1.500 -3.776 1.00 . A A . 3 TRP C 1 1
2 356 1 1 4 TRP CA C 18.608 -2.220 -4.672 1.00 . A A . 3 TRP CA 1 1
2 357 1 1 4 TRP CB C 18.473 -3.686 -4.215 1.00 . A A . 3 TRP CB 1 1
2 358 1 1 4 TRP CD1 C 18.552 -5.675 -5.759 1.00 . A A . 3 TRP CD1 1 1
2 359 1 1 4 TRP CD2 C 16.754 -4.386 -6.127 1.00 . A A . 3 TRP CD2 1 1
2 360 1 1 4 TRP CE2 C 16.682 -5.459 -7.046 1.00 . A A . 3 TRP CE2 1 1
2 361 1 1 4 TRP CE3 C 15.729 -3.424 -6.156 1.00 . A A . 3 TRP CE3 1 1
2 362 1 1 4 TRP CG C 17.952 -4.548 -5.320 1.00 . A A . 3 TRP CG 1 1
2 363 1 1 4 TRP CH2 C 14.628 -4.607 -7.970 1.00 . A A . 3 TRP CH2 1 1
2 364 1 1 4 TRP CZ2 C 15.636 -5.574 -7.956 1.00 . A A . 3 TRP CZ2 1 1
2 365 1 1 4 TRP CZ3 C 14.679 -3.534 -7.069 1.00 . A A . 3 TRP CZ3 1 1
2 366 1 1 4 TRP H H 19.514 -2.885 -6.465 1.00 . A A . 3 TRP H 1 1
2 367 1 1 4 TRP HA H 17.665 -1.739 -4.580 1.00 . A A . 3 TRP HA 1 1
2 368 1 1 4 TRP HB2 H 19.437 -4.059 -3.913 1.00 . A A . 3 TRP HB2 1 1
2 369 1 1 4 TRP HB3 H 17.793 -3.736 -3.374 1.00 . A A . 3 TRP HB3 1 1
2 370 1 1 4 TRP HD1 H 19.468 -6.084 -5.374 1.00 . A A . 3 TRP HD1 1 1
2 371 1 1 4 TRP HE1 H 18.016 -7.035 -7.274 1.00 . A A . 3 TRP HE1 1 1
2 372 1 1 4 TRP HE3 H 15.752 -2.595 -5.477 1.00 . A A . 3 TRP HE3 1 1
2 373 1 1 4 TRP HH2 H 13.811 -4.684 -8.673 1.00 . A A . 3 TRP HH2 1 1
2 374 1 1 4 TRP HZ2 H 15.606 -6.404 -8.646 1.00 . A A . 3 TRP HZ2 1 1
2 375 1 1 4 TRP HZ3 H 13.909 -2.784 -7.077 1.00 . A A . 3 TRP HZ3 1 1
2 376 1 1 4 TRP N N 19.048 -2.129 -6.061 1.00 . A A . 3 TRP N 1 1
2 377 1 1 4 TRP NE1 N 17.798 -6.216 -6.783 1.00 . A A . 3 TRP NE1 1 1
2 378 1 1 4 TRP O O 19.245 -0.585 -3.035 1.00 . A A . 3 TRP O 1 1
2 379 1 1 5 LEU C C 21.880 0.180 -3.295 1.00 . A A . 4 LEU C 1 1
2 380 1 1 5 LEU CA C 21.900 -1.326 -3.064 1.00 . A A . 4 LEU CA 1 1
2 381 1 1 5 LEU CB C 23.275 -1.915 -3.443 1.00 . A A . 4 LEU CB 1 1
2 382 1 1 5 LEU CD1 C 23.132 -3.883 -5.092 1.00 . A A . 4 LEU CD1 1 1
2 383 1 1 5 LEU CD2 C 24.433 -4.155 -2.989 1.00 . A A . 4 LEU CD2 1 1
2 384 1 1 5 LEU CG C 23.197 -3.480 -3.611 1.00 . A A . 4 LEU CG 1 1
2 385 1 1 5 LEU H H 21.066 -2.657 -4.470 1.00 . A A . 4 LEU H 1 1
2 386 1 1 5 LEU HA H 21.702 -1.528 -2.022 1.00 . A A . 4 LEU HA 1 1
2 387 1 1 5 LEU HB2 H 23.611 -1.450 -4.364 1.00 . A A . 4 LEU HB2 1 1
2 388 1 1 5 LEU HB3 H 23.976 -1.667 -2.654 1.00 . A A . 4 LEU HB3 1 1
2 389 1 1 5 LEU HD11 H 22.162 -3.649 -5.474 1.00 . A A . 4 LEU HD11 1 1
2 390 1 1 5 LEU HD12 H 23.300 -4.946 -5.184 1.00 . A A . 4 LEU HD12 1 1
2 391 1 1 5 LEU HD13 H 23.884 -3.353 -5.656 1.00 . A A . 4 LEU HD13 1 1
2 392 1 1 5 LEU HD21 H 24.434 -5.203 -3.253 1.00 . A A . 4 LEU HD21 1 1
2 393 1 1 5 LEU HD22 H 24.398 -4.052 -1.915 1.00 . A A . 4 LEU HD22 1 1
2 394 1 1 5 LEU HD23 H 25.327 -3.687 -3.370 1.00 . A A . 4 LEU HD23 1 1
2 395 1 1 5 LEU HG H 22.304 -3.859 -3.125 1.00 . A A . 4 LEU HG 1 1
2 396 1 1 5 LEU N N 20.851 -1.927 -3.859 1.00 . A A . 4 LEU N 1 1
2 397 1 1 5 LEU O O 22.273 0.966 -2.435 1.00 . A A . 4 LEU O 1 1
2 398 1 1 6 ALA C C 20.536 2.767 -3.829 1.00 . A A . 5 ALA C 1 1
2 399 1 1 6 ALA CA C 21.317 1.962 -4.869 1.00 . A A . 5 ALA CA 1 1
2 400 1 1 6 ALA CB C 20.610 2.066 -6.223 1.00 . A A . 5 ALA CB 1 1
2 401 1 1 6 ALA H H 21.114 -0.129 -5.114 1.00 . A A . 5 ALA H 1 1
2 402 1 1 6 ALA HA H 22.309 2.371 -4.965 1.00 . A A . 5 ALA HA 1 1
2 403 1 1 6 ALA HB1 H 20.997 1.311 -6.891 1.00 . A A . 5 ALA HB1 1 1
2 404 1 1 6 ALA HB2 H 20.783 3.043 -6.647 1.00 . A A . 5 ALA HB2 1 1
2 405 1 1 6 ALA HB3 H 19.546 1.915 -6.089 1.00 . A A . 5 ALA HB3 1 1
2 406 1 1 6 ALA N N 21.410 0.559 -4.480 1.00 . A A . 5 ALA N 1 1
2 407 1 1 6 ALA O O 20.638 3.993 -3.780 1.00 . A A . 5 ALA O 1 1
2 408 1 1 7 LEU C C 19.640 2.657 -0.603 1.00 . A A . 6 LEU C 1 1
2 409 1 1 7 LEU CA C 18.943 2.710 -1.965 1.00 . A A . 6 LEU CA 1 1
2 410 1 1 7 LEU CB C 17.596 1.993 -1.870 1.00 . A A . 6 LEU CB 1 1
2 411 1 1 7 LEU CD1 C 15.665 1.081 -3.167 1.00 . A A . 6 LEU CD1 1 1
2 412 1 1 7 LEU CD2 C 16.946 3.038 -4.055 1.00 . A A . 6 LEU CD2 1 1
2 413 1 1 7 LEU CG C 17.052 1.720 -3.276 1.00 . A A . 6 LEU CG 1 1
2 414 1 1 7 LEU H H 19.705 1.103 -3.091 1.00 . A A . 6 LEU H 1 1
2 415 1 1 7 LEU HA H 18.763 3.738 -2.227 1.00 . A A . 6 LEU HA 1 1
2 416 1 1 7 LEU HB2 H 17.724 1.055 -1.347 1.00 . A A . 6 LEU HB2 1 1
2 417 1 1 7 LEU HB3 H 16.901 2.614 -1.336 1.00 . A A . 6 LEU HB3 1 1
2 418 1 1 7 LEU HD11 H 15.035 1.693 -2.536 1.00 . A A . 6 LEU HD11 1 1
2 419 1 1 7 LEU HD12 H 15.755 0.095 -2.736 1.00 . A A . 6 LEU HD12 1 1
2 420 1 1 7 LEU HD13 H 15.225 1.006 -4.150 1.00 . A A . 6 LEU HD13 1 1
2 421 1 1 7 LEU HD21 H 16.524 3.801 -3.419 1.00 . A A . 6 LEU HD21 1 1
2 422 1 1 7 LEU HD22 H 16.311 2.898 -4.919 1.00 . A A . 6 LEU HD22 1 1
2 423 1 1 7 LEU HD23 H 17.929 3.343 -4.380 1.00 . A A . 6 LEU HD23 1 1
2 424 1 1 7 LEU HG H 17.716 1.041 -3.792 1.00 . A A . 6 LEU HG 1 1
2 425 1 1 7 LEU N N 19.749 2.070 -3.002 1.00 . A A . 6 LEU N 1 1
2 426 1 1 7 LEU O O 19.113 3.157 0.390 1.00 . A A . 6 LEU O 1 1
2 427 1 1 8 ALA C C 22.124 3.296 1.148 1.00 . A A . 7 ALA C 1 1
2 428 1 1 8 ALA CA C 21.568 1.938 0.687 1.00 . A A . 7 ALA CA 1 1
2 429 1 1 8 ALA CB C 22.711 0.917 0.536 1.00 . A A . 7 ALA CB 1 1
2 430 1 1 8 ALA H H 21.191 1.667 -1.379 1.00 . A A . 7 ALA H 1 1
2 431 1 1 8 ALA HA H 20.892 1.576 1.447 1.00 . A A . 7 ALA HA 1 1
2 432 1 1 8 ALA HB1 H 22.949 0.488 1.499 1.00 . A A . 7 ALA HB1 1 1
2 433 1 1 8 ALA HB2 H 23.591 1.402 0.138 1.00 . A A . 7 ALA HB2 1 1
2 434 1 1 8 ALA HB3 H 22.401 0.132 -0.137 1.00 . A A . 7 ALA HB3 1 1
2 435 1 1 8 ALA N N 20.820 2.048 -0.561 1.00 . A A . 7 ALA N 1 1
2 436 1 1 8 ALA O O 22.161 3.570 2.347 1.00 . A A . 7 ALA O 1 1
2 437 1 1 9 PRO C C 22.182 6.263 1.548 1.00 . A A . 8 PRO C 1 1
2 438 1 1 9 PRO CA C 23.116 5.488 0.617 1.00 . A A . 8 PRO CA 1 1
2 439 1 1 9 PRO CB C 23.257 6.193 -0.742 1.00 . A A . 8 PRO CB 1 1
2 440 1 1 9 PRO CD C 22.574 3.949 -1.216 1.00 . A A . 8 PRO CD 1 1
2 441 1 1 9 PRO CG C 23.470 5.081 -1.711 1.00 . A A . 8 PRO CG 1 1
2 442 1 1 9 PRO HA H 24.089 5.384 1.058 1.00 . A A . 8 PRO HA 1 1
2 443 1 1 9 PRO HB2 H 22.346 6.738 -0.985 1.00 . A A . 8 PRO HB2 1 1
2 444 1 1 9 PRO HB3 H 24.101 6.852 -0.748 1.00 . A A . 8 PRO HB3 1 1
2 445 1 1 9 PRO HD2 H 21.582 4.059 -1.633 1.00 . A A . 8 PRO HD2 1 1
2 446 1 1 9 PRO HD3 H 22.991 2.989 -1.457 1.00 . A A . 8 PRO HD3 1 1
2 447 1 1 9 PRO HG2 H 23.183 5.396 -2.709 1.00 . A A . 8 PRO HG2 1 1
2 448 1 1 9 PRO HG3 H 24.497 4.754 -1.695 1.00 . A A . 8 PRO HG3 1 1
2 449 1 1 9 PRO N N 22.557 4.146 0.245 1.00 . A A . 8 PRO N 1 1
2 450 1 1 9 PRO O O 22.590 6.747 2.601 1.00 . A A . 8 PRO O 1 1
2 451 1 1 10 ALA C C 19.748 6.442 3.298 1.00 . A A . 9 ALA C 1 1
2 452 1 1 10 ALA CA C 19.929 7.080 1.921 1.00 . A A . 9 ALA CA 1 1
2 453 1 1 10 ALA CB C 18.591 7.081 1.180 1.00 . A A . 9 ALA CB 1 1
2 454 1 1 10 ALA H H 20.678 5.958 0.285 1.00 . A A . 9 ALA H 1 1
2 455 1 1 10 ALA HA H 20.248 8.102 2.050 1.00 . A A . 9 ALA HA 1 1
2 456 1 1 10 ALA HB1 H 17.839 7.553 1.794 1.00 . A A . 9 ALA HB1 1 1
2 457 1 1 10 ALA HB2 H 18.296 6.063 0.969 1.00 . A A . 9 ALA HB2 1 1
2 458 1 1 10 ALA HB3 H 18.694 7.626 0.253 1.00 . A A . 9 ALA HB3 1 1
2 459 1 1 10 ALA N N 20.932 6.368 1.138 1.00 . A A . 9 ALA N 1 1
2 460 1 1 10 ALA O O 19.225 7.072 4.217 1.00 . A A . 9 ALA O 1 1
2 461 1 1 11 LEU C C 21.309 4.746 5.540 1.00 . A A . 10 LEU C 1 1
2 462 1 1 11 LEU CA C 20.072 4.459 4.696 1.00 . A A . 10 LEU CA 1 1
2 463 1 1 11 LEU CB C 19.860 2.945 4.352 1.00 . A A . 10 LEU CB 1 1
2 464 1 1 11 LEU CD1 C 20.042 1.984 6.701 1.00 . A A . 10 LEU CD1 1 1
2 465 1 1 11 LEU CD2 C 20.547 0.569 4.667 1.00 . A A . 10 LEU CD2 1 1
2 466 1 1 11 LEU CG C 20.637 1.984 5.269 1.00 . A A . 10 LEU CG 1 1
2 467 1 1 11 LEU H H 20.590 4.729 2.680 1.00 . A A . 10 LEU H 1 1
2 468 1 1 11 LEU HA H 19.228 4.826 5.230 1.00 . A A . 10 LEU HA 1 1
2 469 1 1 11 LEU HB2 H 18.809 2.704 4.425 1.00 . A A . 10 LEU HB2 1 1
2 470 1 1 11 LEU HB3 H 20.171 2.781 3.329 1.00 . A A . 10 LEU HB3 1 1
2 471 1 1 11 LEU HD11 H 20.830 1.789 7.412 1.00 . A A . 10 LEU HD11 1 1
2 472 1 1 11 LEU HD12 H 19.280 1.219 6.795 1.00 . A A . 10 LEU HD12 1 1
2 473 1 1 11 LEU HD13 H 19.596 2.943 6.919 1.00 . A A . 10 LEU HD13 1 1
2 474 1 1 11 LEU HD21 H 21.113 -0.119 5.279 1.00 . A A . 10 LEU HD21 1 1
2 475 1 1 11 LEU HD22 H 20.952 0.577 3.666 1.00 . A A . 10 LEU HD22 1 1
2 476 1 1 11 LEU HD23 H 19.514 0.256 4.634 1.00 . A A . 10 LEU HD23 1 1
2 477 1 1 11 LEU HG H 21.675 2.281 5.305 1.00 . A A . 10 LEU HG 1 1
2 478 1 1 11 LEU N N 20.183 5.185 3.439 1.00 . A A . 10 LEU N 1 1
2 479 1 1 11 LEU O O 21.381 4.426 6.726 1.00 . A A . 10 LEU O 1 1
2 480 1 1 12 ALA C C 23.267 6.360 6.896 1.00 . A A . 11 ALA C 1 1
2 481 1 1 12 ALA CA C 23.528 5.697 5.549 1.00 . A A . 11 ALA CA 1 1
2 482 1 1 12 ALA CB C 24.344 6.641 4.664 1.00 . A A . 11 ALA CB 1 1
2 483 1 1 12 ALA H H 22.126 5.564 3.961 1.00 . A A . 11 ALA H 1 1
2 484 1 1 12 ALA HA H 24.098 4.795 5.711 1.00 . A A . 11 ALA HA 1 1
2 485 1 1 12 ALA HB1 H 25.265 6.897 5.168 1.00 . A A . 11 ALA HB1 1 1
2 486 1 1 12 ALA HB2 H 23.777 7.540 4.475 1.00 . A A . 11 ALA HB2 1 1
2 487 1 1 12 ALA HB3 H 24.570 6.152 3.728 1.00 . A A . 11 ALA HB3 1 1
2 488 1 1 12 ALA N N 22.270 5.350 4.896 1.00 . A A . 11 ALA N 1 1
2 489 1 1 12 ALA O O 24.156 6.436 7.743 1.00 . A A . 11 ALA O 1 1
2 490 1 1 13 LEU C C 21.625 6.456 9.460 1.00 . A A . 12 LEU C 1 1
2 491 1 1 13 LEU CA C 21.687 7.486 8.340 1.00 . A A . 12 LEU CA 1 1
2 492 1 1 13 LEU CB C 20.339 8.200 8.205 1.00 . A A . 12 LEU CB 1 1
2 493 1 1 13 LEU CD1 C 18.973 9.722 6.768 1.00 . A A . 12 LEU CD1 1 1
2 494 1 1 13 LEU CD2 C 21.469 9.838 6.690 1.00 . A A . 12 LEU CD2 1 1
2 495 1 1 13 LEU CG C 20.264 8.904 6.848 1.00 . A A . 12 LEU CG 1 1
2 496 1 1 13 LEU H H 21.371 6.749 6.384 1.00 . A A . 12 LEU H 1 1
2 497 1 1 13 LEU HA H 22.445 8.211 8.581 1.00 . A A . 12 LEU HA 1 1
2 498 1 1 13 LEU HB2 H 19.536 7.479 8.281 1.00 . A A . 12 LEU HB2 1 1
2 499 1 1 13 LEU HB3 H 20.239 8.934 8.991 1.00 . A A . 12 LEU HB3 1 1
2 500 1 1 13 LEU HD11 H 18.979 10.316 5.866 1.00 . A A . 12 LEU HD11 1 1
2 501 1 1 13 LEU HD12 H 18.905 10.373 7.627 1.00 . A A . 12 LEU HD12 1 1
2 502 1 1 13 LEU HD13 H 18.124 9.054 6.755 1.00 . A A . 12 LEU HD13 1 1
2 503 1 1 13 LEU HD21 H 21.614 10.399 7.601 1.00 . A A . 12 LEU HD21 1 1
2 504 1 1 13 LEU HD22 H 21.291 10.521 5.871 1.00 . A A . 12 LEU HD22 1 1
2 505 1 1 13 LEU HD23 H 22.353 9.253 6.482 1.00 . A A . 12 LEU HD23 1 1
2 506 1 1 13 LEU HG H 20.269 8.164 6.060 1.00 . A A . 12 LEU HG 1 1
2 507 1 1 13 LEU N N 22.042 6.837 7.089 1.00 . A A . 12 LEU N 1 1
2 508 1 1 13 LEU O O 22.405 6.518 10.411 1.00 . A A . 12 LEU O 1 1
2 509 1 1 14 ALA C C 21.897 3.745 10.499 1.00 . A A . 13 ALA C 1 1
2 510 1 1 14 ALA CA C 20.577 4.484 10.369 1.00 . A A . 13 ALA CA 1 1
2 511 1 1 14 ALA CB C 19.464 3.494 10.023 1.00 . A A . 13 ALA CB 1 1
2 512 1 1 14 ALA H H 20.105 5.500 8.569 1.00 . A A . 13 ALA H 1 1
2 513 1 1 14 ALA HA H 20.348 4.956 11.310 1.00 . A A . 13 ALA HA 1 1
2 514 1 1 14 ALA HB1 H 19.803 2.825 9.248 1.00 . A A . 13 ALA HB1 1 1
2 515 1 1 14 ALA HB2 H 18.594 4.034 9.680 1.00 . A A . 13 ALA HB2 1 1
2 516 1 1 14 ALA HB3 H 19.209 2.923 10.904 1.00 . A A . 13 ALA HB3 1 1
2 517 1 1 14 ALA N N 20.702 5.509 9.346 1.00 . A A . 13 ALA N 1 1
2 518 1 1 14 ALA O O 22.316 3.388 11.598 1.00 . A A . 13 ALA O 1 1
2 519 1 1 15 LEU C C 24.761 3.525 10.371 1.00 . A A . 14 LEU C 1 1
2 520 1 1 15 LEU CA C 23.834 2.823 9.396 1.00 . A A . 14 LEU CA 1 1
2 521 1 1 15 LEU CB C 24.442 2.779 7.981 1.00 . A A . 14 LEU CB 1 1
2 522 1 1 15 LEU CD1 C 25.737 1.170 6.502 1.00 . A A . 14 LEU CD1 1 1
2 523 1 1 15 LEU CD2 C 26.969 2.507 8.197 1.00 . A A . 14 LEU CD2 1 1
2 524 1 1 15 LEU CG C 25.643 1.784 7.904 1.00 . A A . 14 LEU CG 1 1
2 525 1 1 15 LEU H H 22.187 3.825 8.512 1.00 . A A . 14 LEU H 1 1
2 526 1 1 15 LEU HA H 23.667 1.826 9.747 1.00 . A A . 14 LEU HA 1 1
2 527 1 1 15 LEU HB2 H 23.665 2.472 7.290 1.00 . A A . 14 LEU HB2 1 1
2 528 1 1 15 LEU HB3 H 24.773 3.773 7.710 1.00 . A A . 14 LEU HB3 1 1
2 529 1 1 15 LEU HD11 H 26.532 0.439 6.483 1.00 . A A . 14 LEU HD11 1 1
2 530 1 1 15 LEU HD12 H 25.942 1.946 5.781 1.00 . A A . 14 LEU HD12 1 1
2 531 1 1 15 LEU HD13 H 24.801 0.688 6.256 1.00 . A A . 14 LEU HD13 1 1
2 532 1 1 15 LEU HD21 H 27.791 1.827 8.027 1.00 . A A . 14 LEU HD21 1 1
2 533 1 1 15 LEU HD22 H 26.986 2.838 9.222 1.00 . A A . 14 LEU HD22 1 1
2 534 1 1 15 LEU HD23 H 27.070 3.359 7.541 1.00 . A A . 14 LEU HD23 1 1
2 535 1 1 15 LEU HG H 25.502 0.984 8.618 1.00 . A A . 14 LEU HG 1 1
2 536 1 1 15 LEU N N 22.559 3.519 9.369 1.00 . A A . 14 LEU N 1 1
2 537 1 1 15 LEU O O 25.373 2.888 11.224 1.00 . A A . 14 LEU O 1 1
2 538 1 1 16 ALA C C 25.261 5.377 12.580 1.00 . A A . 15 ALA C 1 1
2 539 1 1 16 ALA CA C 25.706 5.604 11.140 1.00 . A A . 15 ALA CA 1 1
2 540 1 1 16 ALA CB C 25.625 7.094 10.802 1.00 . A A . 15 ALA CB 1 1
2 541 1 1 16 ALA H H 24.335 5.307 9.553 1.00 . A A . 15 ALA H 1 1
2 542 1 1 16 ALA HA H 26.727 5.272 11.026 1.00 . A A . 15 ALA HA 1 1
2 543 1 1 16 ALA HB1 H 26.309 7.645 11.431 1.00 . A A . 15 ALA HB1 1 1
2 544 1 1 16 ALA HB2 H 24.618 7.448 10.969 1.00 . A A . 15 ALA HB2 1 1
2 545 1 1 16 ALA HB3 H 25.891 7.244 9.766 1.00 . A A . 15 ALA HB3 1 1
2 546 1 1 16 ALA N N 24.853 4.841 10.248 1.00 . A A . 15 ALA N 1 1
2 547 1 1 16 ALA O O 26.047 5.514 13.517 1.00 . A A . 15 ALA O 1 1
2 548 1 1 17 LEU C C 23.895 3.459 14.663 1.00 . A A . 16 LEU C 1 1
2 549 1 1 17 LEU CA C 23.423 4.790 14.064 1.00 . A A . 16 LEU CA 1 1
2 550 1 1 17 LEU CB C 21.880 4.829 13.993 1.00 . A A . 16 LEU CB 1 1
2 551 1 1 17 LEU CD1 C 19.750 5.215 15.253 1.00 . A A . 16 LEU CD1 1 1
2 552 1 1 17 LEU CD2 C 21.764 4.345 16.458 1.00 . A A . 16 LEU CD2 1 1
2 553 1 1 17 LEU CG C 21.277 5.274 15.337 1.00 . A A . 16 LEU CG 1 1
2 554 1 1 17 LEU H H 23.408 4.942 11.957 1.00 . A A . 16 LEU H 1 1
2 555 1 1 17 LEU HA H 23.752 5.582 14.707 1.00 . A A . 16 LEU HA 1 1
2 556 1 1 17 LEU HB2 H 21.580 5.527 13.227 1.00 . A A . 16 LEU HB2 1 1
2 557 1 1 17 LEU HB3 H 21.501 3.849 13.745 1.00 . A A . 16 LEU HB3 1 1
2 558 1 1 17 LEU HD11 H 19.441 4.205 15.024 1.00 . A A . 16 LEU HD11 1 1
2 559 1 1 17 LEU HD12 H 19.406 5.880 14.475 1.00 . A A . 16 LEU HD12 1 1
2 560 1 1 17 LEU HD13 H 19.325 5.515 16.200 1.00 . A A . 16 LEU HD13 1 1
2 561 1 1 17 LEU HD21 H 22.779 4.603 16.722 1.00 . A A . 16 LEU HD21 1 1
2 562 1 1 17 LEU HD22 H 21.730 3.320 16.118 1.00 . A A . 16 LEU HD22 1 1
2 563 1 1 17 LEU HD23 H 21.130 4.456 17.326 1.00 . A A . 16 LEU HD23 1 1
2 564 1 1 17 LEU HG H 21.582 6.291 15.546 1.00 . A A . 16 LEU HG 1 1
2 565 1 1 17 LEU N N 23.985 5.031 12.742 1.00 . A A . 16 LEU N 1 1
2 566 1 1 17 LEU O O 24.618 3.455 15.658 1.00 . A A . 16 LEU O 1 1
2 567 1 1 18 TRP C C 25.339 0.679 14.295 1.00 . A A . 17 TRP C 1 1
2 568 1 1 18 TRP CA C 23.890 1.030 14.609 1.00 . A A . 17 TRP CA 1 1
2 569 1 1 18 TRP CB C 22.965 -0.086 14.128 1.00 . A A . 17 TRP CB 1 1
2 570 1 1 18 TRP CD1 C 21.924 0.453 11.889 1.00 . A A . 17 TRP CD1 1 1
2 571 1 1 18 TRP CD2 C 23.736 -0.868 11.706 1.00 . A A . 17 TRP CD2 1 1
2 572 1 1 18 TRP CE2 C 23.257 -0.652 10.394 1.00 . A A . 17 TRP CE2 1 1
2 573 1 1 18 TRP CE3 C 24.878 -1.674 11.869 1.00 . A A . 17 TRP CE3 1 1
2 574 1 1 18 TRP CG C 22.872 -0.154 12.637 1.00 . A A . 17 TRP CG 1 1
2 575 1 1 18 TRP CH2 C 25.017 -2.011 9.460 1.00 . A A . 17 TRP CH2 1 1
2 576 1 1 18 TRP CZ2 C 23.883 -1.212 9.283 1.00 . A A . 17 TRP CZ2 1 1
2 577 1 1 18 TRP CZ3 C 25.512 -2.242 10.751 1.00 . A A . 17 TRP CZ3 1 1
2 578 1 1 18 TRP H H 22.900 2.371 13.286 1.00 . A A . 17 TRP H 1 1
2 579 1 1 18 TRP HA H 23.799 1.080 15.685 1.00 . A A . 17 TRP HA 1 1
2 580 1 1 18 TRP HB2 H 23.351 -1.019 14.480 1.00 . A A . 17 TRP HB2 1 1
2 581 1 1 18 TRP HB3 H 21.980 0.071 14.543 1.00 . A A . 17 TRP HB3 1 1
2 582 1 1 18 TRP HD1 H 21.121 1.068 12.267 1.00 . A A . 17 TRP HD1 1 1
2 583 1 1 18 TRP HE1 H 21.609 0.474 9.805 1.00 . A A . 17 TRP HE1 1 1
2 584 1 1 18 TRP HE3 H 25.267 -1.858 12.858 1.00 . A A . 17 TRP HE3 1 1
2 585 1 1 18 TRP HH2 H 25.509 -2.449 8.606 1.00 . A A . 17 TRP HH2 1 1
2 586 1 1 18 TRP HZ2 H 23.494 -1.030 8.293 1.00 . A A . 17 TRP HZ2 1 1
2 587 1 1 18 TRP HZ3 H 26.388 -2.859 10.888 1.00 . A A . 17 TRP HZ3 1 1
2 588 1 1 18 TRP N N 23.483 2.330 14.074 1.00 . A A . 17 TRP N 1 1
2 589 1 1 18 TRP NE1 N 22.151 0.157 10.557 1.00 . A A . 17 TRP NE1 1 1
2 590 1 1 18 TRP O O 26.055 0.170 15.158 1.00 . A A . 17 TRP O 1 1
2 591 1 1 19 TRP C C 28.106 1.224 13.733 1.00 . A A . 18 TRP C 1 1
2 592 1 1 19 TRP CA C 27.155 0.628 12.706 1.00 . A A . 18 TRP CA 1 1
2 593 1 1 19 TRP CB C 27.483 1.202 11.322 1.00 . A A . 18 TRP CB 1 1
2 594 1 1 19 TRP CD1 C 28.800 -0.652 10.224 1.00 . A A . 18 TRP CD1 1 1
2 595 1 1 19 TRP CD2 C 30.089 1.106 10.775 1.00 . A A . 18 TRP CD2 1 1
2 596 1 1 19 TRP CE2 C 30.941 0.151 10.175 1.00 . A A . 18 TRP CE2 1 1
2 597 1 1 19 TRP CE3 C 30.656 2.315 11.216 1.00 . A A . 18 TRP CE3 1 1
2 598 1 1 19 TRP CG C 28.734 0.571 10.793 1.00 . A A . 18 TRP CG 1 1
2 599 1 1 19 TRP CH2 C 32.854 1.589 10.460 1.00 . A A . 18 TRP CH2 1 1
2 600 1 1 19 TRP CZ2 C 32.305 0.382 10.017 1.00 . A A . 18 TRP CZ2 1 1
2 601 1 1 19 TRP CZ3 C 32.032 2.553 11.060 1.00 . A A . 18 TRP CZ3 1 1
2 602 1 1 19 TRP H H 25.172 1.345 12.423 1.00 . A A . 18 TRP H 1 1
2 603 1 1 19 TRP HA H 27.279 -0.444 12.685 1.00 . A A . 18 TRP HA 1 1
2 604 1 1 19 TRP HB2 H 26.667 1.001 10.648 1.00 . A A . 18 TRP HB2 1 1
2 605 1 1 19 TRP HB3 H 27.629 2.271 11.401 1.00 . A A . 18 TRP HB3 1 1
2 606 1 1 19 TRP HD1 H 27.967 -1.321 10.079 1.00 . A A . 18 TRP HD1 1 1
2 607 1 1 19 TRP HE1 H 30.431 -1.721 9.422 1.00 . A A . 18 TRP HE1 1 1
2 608 1 1 19 TRP HE3 H 30.031 3.064 11.679 1.00 . A A . 18 TRP HE3 1 1
2 609 1 1 19 TRP HH2 H 33.912 1.777 10.343 1.00 . A A . 18 TRP HH2 1 1
2 610 1 1 19 TRP HZ2 H 32.931 -0.366 9.555 1.00 . A A . 18 TRP HZ2 1 1
2 611 1 1 19 TRP HZ3 H 32.458 3.485 11.402 1.00 . A A . 18 TRP HZ3 1 1
2 612 1 1 19 TRP N N 25.776 0.942 13.075 1.00 . A A . 18 TRP N 1 1
2 613 1 1 19 TRP NE1 N 30.110 -0.903 9.856 1.00 . A A . 18 TRP NE1 1 1
2 614 1 1 19 TRP O O 28.951 0.530 14.300 1.00 . A A . 18 TRP O 1 1
2 615 1 1 20 ALA C C 28.010 3.480 16.222 1.00 . A A . 19 ALA C 1 1
2 616 1 1 20 ALA CA C 28.779 3.257 14.928 1.00 . A A . 19 ALA CA 1 1
2 617 1 1 20 ALA CB C 29.195 4.606 14.339 1.00 . A A . 19 ALA CB 1 1
2 618 1 1 20 ALA H H 27.257 3.007 13.481 1.00 . A A . 19 ALA H 1 1
2 619 1 1 20 ALA HA H 29.664 2.687 15.147 1.00 . A A . 19 ALA HA 1 1
2 620 1 1 20 ALA HB1 H 29.939 4.450 13.572 1.00 . A A . 19 ALA HB1 1 1
2 621 1 1 20 ALA HB2 H 29.607 5.229 15.120 1.00 . A A . 19 ALA HB2 1 1
2 622 1 1 20 ALA HB3 H 28.332 5.092 13.909 1.00 . A A . 19 ALA HB3 1 1
2 623 1 1 20 ALA N N 27.950 2.526 13.967 1.00 . A A . 19 ALA N 1 1
2 624 1 1 20 ALA O O 28.184 4.495 16.897 1.00 . A A . 19 ALA O 1 1
2 625 1 1 21 ETA CA C 26.358 2.612 17.776 1.00 . A A . 20 ETA CA 1 1
2 626 1 1 21 ETA CB C 27.215 2.307 19.002 1.00 . A A . 20 ETA CB 1 1
2 627 1 1 21 ETA HA1 H 25.550 1.899 17.728 1.00 . A A . 20 ETA HA1 1 1
2 628 1 1 21 ETA HA2 H 25.951 3.611 17.861 1.00 . A A . 20 ETA HA2 1 1
2 629 1 1 21 ETA HB1 H 28.131 2.886 18.951 1.00 . A A . 20 ETA HB1 1 1
2 630 1 1 21 ETA HB2 H 27.461 1.262 19.025 1.00 . A A . 20 ETA HB2 1 1
2 631 1 1 21 ETA HN2 H 27.066 1.737 15.979 1.00 . A A . 20 ETA HN2 1 1
2 632 1 1 21 ETA HO H 26.789 2.066 20.886 1.00 . A A . 20 ETA HO 1 1
2 633 1 1 21 ETA N N 27.158 2.521 16.560 1.00 . A A . 20 ETA N 1 1
2 634 1 1 21 ETA O O 26.481 2.634 20.177 1.00 . A A . 20 ETA O 1 1
3 635 1 1 1 ACE C C 23.002 -5.301 -8.352 1.00 . A A . 0 ACE C 1 1
3 636 1 1 1 ACE CH3 C 23.603 -6.183 -7.263 1.00 . A A . 0 ACE CH3 1 1
3 637 1 1 1 ACE H1 H 23.060 -6.039 -6.340 1.00 . A A . 0 ACE H1 1 1
3 638 1 1 1 ACE H2 H 24.641 -5.920 -7.117 1.00 . A A . 0 ACE H2 1 1
3 639 1 1 1 ACE H3 H 23.535 -7.219 -7.561 1.00 . A A . 0 ACE H3 1 1
3 640 1 1 1 ACE O O 23.251 -5.511 -9.539 1.00 . A A . 0 ACE O 1 1
3 641 1 1 2 GLY C C 21.017 -2.210 -8.165 1.00 . A A . 1 GLY C 1 1
3 642 1 1 2 GLY CA C 21.580 -3.414 -8.886 1.00 . A A . 1 GLY CA 1 1
3 643 1 1 2 GLY H H 22.038 -4.187 -6.990 1.00 . A A . 1 GLY H 1 1
3 644 1 1 2 GLY HA2 H 22.296 -3.091 -9.618 1.00 . A A . 1 GLY HA2 1 1
3 645 1 1 2 GLY HA3 H 20.767 -3.933 -9.375 1.00 . A A . 1 GLY HA3 1 1
3 646 1 1 2 GLY N N 22.208 -4.314 -7.943 1.00 . A A . 1 GLY N 1 1
3 647 1 1 2 GLY O O 21.664 -1.597 -7.322 1.00 . A A . 1 GLY O 1 1
3 648 1 1 3 TRP C C 18.747 -1.107 -6.461 1.00 . A A . 2 TRP C 1 1
3 649 1 1 3 TRP CA C 19.116 -0.756 -7.902 1.00 . A A . 2 TRP CA 1 1
3 650 1 1 3 TRP CB C 17.871 -0.337 -8.738 1.00 . A A . 2 TRP CB 1 1
3 651 1 1 3 TRP CD1 C 17.322 -2.733 -8.946 1.00 . A A . 2 TRP CD1 1 1
3 652 1 1 3 TRP CD2 C 16.785 -1.618 -10.807 1.00 . A A . 2 TRP CD2 1 1
3 653 1 1 3 TRP CE2 C 16.436 -2.969 -11.033 1.00 . A A . 2 TRP CE2 1 1
3 654 1 1 3 TRP CE3 C 16.547 -0.689 -11.834 1.00 . A A . 2 TRP CE3 1 1
3 655 1 1 3 TRP CG C 17.347 -1.515 -9.468 1.00 . A A . 2 TRP CG 1 1
3 656 1 1 3 TRP CH2 C 15.638 -2.454 -13.248 1.00 . A A . 2 TRP CH2 1 1
3 657 1 1 3 TRP CZ2 C 15.870 -3.388 -12.234 1.00 . A A . 2 TRP CZ2 1 1
3 658 1 1 3 TRP CZ3 C 15.976 -1.106 -13.050 1.00 . A A . 2 TRP CZ3 1 1
3 659 1 1 3 TRP H H 19.363 -2.423 -9.179 1.00 . A A . 2 TRP H 1 1
3 660 1 1 3 TRP HA H 19.799 0.063 -7.861 1.00 . A A . 2 TRP HA 1 1
3 661 1 1 3 TRP HB2 H 17.101 0.044 -8.088 1.00 . A A . 2 TRP HB2 1 1
3 662 1 1 3 TRP HB3 H 18.150 0.425 -9.450 1.00 . A A . 2 TRP HB3 1 1
3 663 1 1 3 TRP HD1 H 17.676 -2.966 -7.963 1.00 . A A . 2 TRP HD1 1 1
3 664 1 1 3 TRP HE1 H 16.662 -4.571 -9.724 1.00 . A A . 2 TRP HE1 1 1
3 665 1 1 3 TRP HE3 H 16.804 0.350 -11.691 1.00 . A A . 2 TRP HE3 1 1
3 666 1 1 3 TRP HH2 H 15.199 -2.770 -14.183 1.00 . A A . 2 TRP HH2 1 1
3 667 1 1 3 TRP HZ2 H 15.614 -4.427 -12.378 1.00 . A A . 2 TRP HZ2 1 1
3 668 1 1 3 TRP HZ3 H 15.796 -0.387 -13.833 1.00 . A A . 2 TRP HZ3 1 1
3 669 1 1 3 TRP N N 19.804 -1.886 -8.510 1.00 . A A . 2 TRP N 1 1
3 670 1 1 3 TRP NE1 N 16.787 -3.613 -9.864 1.00 . A A . 2 TRP NE1 1 1
3 671 1 1 3 TRP O O 18.007 -0.376 -5.804 1.00 . A A . 2 TRP O 1 1
3 672 1 1 4 TRP C C 19.877 -1.888 -3.639 1.00 . A A . 3 TRP C 1 1
3 673 1 1 4 TRP CA C 19.005 -2.671 -4.605 1.00 . A A . 3 TRP CA 1 1
3 674 1 1 4 TRP CB C 19.267 -4.180 -4.427 1.00 . A A . 3 TRP CB 1 1
3 675 1 1 4 TRP CD1 C 19.678 -5.792 -6.319 1.00 . A A . 3 TRP CD1 1 1
3 676 1 1 4 TRP CD2 C 17.597 -4.954 -6.355 1.00 . A A . 3 TRP CD2 1 1
3 677 1 1 4 TRP CE2 C 17.701 -5.837 -7.455 1.00 . A A . 3 TRP CE2 1 1
3 678 1 1 4 TRP CE3 C 16.375 -4.290 -6.157 1.00 . A A . 3 TRP CE3 1 1
3 679 1 1 4 TRP CG C 18.869 -4.943 -5.649 1.00 . A A . 3 TRP CG 1 1
3 680 1 1 4 TRP CH2 C 15.428 -5.386 -8.107 1.00 . A A . 3 TRP CH2 1 1
3 681 1 1 4 TRP CZ2 C 16.635 -6.055 -8.322 1.00 . A A . 3 TRP CZ2 1 1
3 682 1 1 4 TRP CZ3 C 15.303 -4.504 -7.025 1.00 . A A . 3 TRP CZ3 1 1
3 683 1 1 4 TRP H H 19.863 -2.778 -6.536 1.00 . A A . 3 TRP H 1 1
3 684 1 1 4 TRP HA H 17.988 -2.465 -4.378 1.00 . A A . 3 TRP HA 1 1
3 685 1 1 4 TRP HB2 H 20.315 -4.344 -4.245 1.00 . A A . 3 TRP HB2 1 1
3 686 1 1 4 TRP HB3 H 18.698 -4.542 -3.580 1.00 . A A . 3 TRP HB3 1 1
3 687 1 1 4 TRP HD1 H 20.696 -6.016 -6.060 1.00 . A A . 3 TRP HD1 1 1
3 688 1 1 4 TRP HE1 H 19.348 -6.963 -8.035 1.00 . A A . 3 TRP HE1 1 1
3 689 1 1 4 TRP HE3 H 16.260 -3.610 -5.336 1.00 . A A . 3 TRP HE3 1 1
3 690 1 1 4 TRP HH2 H 14.593 -5.545 -8.775 1.00 . A A . 3 TRP HH2 1 1
3 691 1 1 4 TRP HZ2 H 16.742 -6.736 -9.152 1.00 . A A . 3 TRP HZ2 1 1
3 692 1 1 4 TRP HZ3 H 14.379 -3.983 -6.857 1.00 . A A . 3 TRP HZ3 1 1
3 693 1 1 4 TRP N N 19.279 -2.236 -5.971 1.00 . A A . 3 TRP N 1 1
3 694 1 1 4 TRP NE1 N 18.987 -6.322 -7.390 1.00 . A A . 3 TRP NE1 1 1
3 695 1 1 4 TRP O O 19.385 -1.226 -2.725 1.00 . A A . 3 TRP O 1 1
3 696 1 1 5 LEU C C 21.735 0.198 -2.959 1.00 . A A . 4 LEU C 1 1
3 697 1 1 5 LEU CA C 22.127 -1.273 -3.014 1.00 . A A . 4 LEU CA 1 1
3 698 1 1 5 LEU CB C 23.563 -1.431 -3.559 1.00 . A A . 4 LEU CB 1 1
3 699 1 1 5 LEU CD1 C 23.736 -3.062 -5.540 1.00 . A A . 4 LEU CD1 1 1
3 700 1 1 5 LEU CD2 C 25.249 -3.360 -3.589 1.00 . A A . 4 LEU CD2 1 1
3 701 1 1 5 LEU CG C 23.838 -2.915 -4.015 1.00 . A A . 4 LEU CG 1 1
3 702 1 1 5 LEU H H 21.505 -2.514 -4.601 1.00 . A A . 4 LEU H 1 1
3 703 1 1 5 LEU HA H 22.078 -1.692 -2.021 1.00 . A A . 4 LEU HA 1 1
3 704 1 1 5 LEU HB2 H 23.696 -0.748 -4.392 1.00 . A A . 4 LEU HB2 1 1
3 705 1 1 5 LEU HB3 H 24.253 -1.158 -2.771 1.00 . A A . 4 LEU HB3 1 1
3 706 1 1 5 LEU HD11 H 24.290 -2.275 -6.028 1.00 . A A . 4 LEU HD11 1 1
3 707 1 1 5 LEU HD12 H 22.708 -3.013 -5.828 1.00 . A A . 4 LEU HD12 1 1
3 708 1 1 5 LEU HD13 H 24.139 -4.019 -5.839 1.00 . A A . 4 LEU HD13 1 1
3 709 1 1 5 LEU HD21 H 25.970 -2.626 -3.915 1.00 . A A . 4 LEU HD21 1 1
3 710 1 1 5 LEU HD22 H 25.473 -4.313 -4.045 1.00 . A A . 4 LEU HD22 1 1
3 711 1 1 5 LEU HD23 H 25.288 -3.456 -2.514 1.00 . A A . 4 LEU HD23 1 1
3 712 1 1 5 LEU HG H 23.108 -3.580 -3.569 1.00 . A A . 4 LEU HG 1 1
3 713 1 1 5 LEU N N 21.180 -1.973 -3.858 1.00 . A A . 4 LEU N 1 1
3 714 1 1 5 LEU O O 22.010 0.898 -1.986 1.00 . A A . 4 LEU O 1 1
3 715 1 1 6 ALA C C 19.840 2.435 -2.893 1.00 . A A . 5 ALA C 1 1
3 716 1 1 6 ALA CA C 20.637 2.031 -4.133 1.00 . A A . 5 ALA CA 1 1
3 717 1 1 6 ALA CB C 19.754 2.188 -5.375 1.00 . A A . 5 ALA CB 1 1
3 718 1 1 6 ALA H H 20.898 0.031 -4.766 1.00 . A A . 5 ALA H 1 1
3 719 1 1 6 ALA HA H 21.494 2.678 -4.233 1.00 . A A . 5 ALA HA 1 1
3 720 1 1 6 ALA HB1 H 18.780 1.757 -5.182 1.00 . A A . 5 ALA HB1 1 1
3 721 1 1 6 ALA HB2 H 20.212 1.676 -6.208 1.00 . A A . 5 ALA HB2 1 1
3 722 1 1 6 ALA HB3 H 19.645 3.235 -5.611 1.00 . A A . 5 ALA HB3 1 1
3 723 1 1 6 ALA N N 21.085 0.648 -4.028 1.00 . A A . 5 ALA N 1 1
3 724 1 1 6 ALA O O 19.545 3.613 -2.691 1.00 . A A . 5 ALA O 1 1
3 725 1 1 7 LEU C C 19.648 2.015 0.328 1.00 . A A . 6 LEU C 1 1
3 726 1 1 7 LEU CA C 18.728 1.697 -0.851 1.00 . A A . 6 LEU CA 1 1
3 727 1 1 7 LEU CB C 17.889 0.461 -0.515 1.00 . A A . 6 LEU CB 1 1
3 728 1 1 7 LEU CD1 C 16.465 -1.333 -1.538 1.00 . A A . 6 LEU CD1 1 1
3 729 1 1 7 LEU CD2 C 15.740 1.048 -1.717 1.00 . A A . 6 LEU CD2 1 1
3 730 1 1 7 LEU CG C 16.958 0.109 -1.689 1.00 . A A . 6 LEU CG 1 1
3 731 1 1 7 LEU H H 19.749 0.534 -2.278 1.00 . A A . 6 LEU H 1 1
3 732 1 1 7 LEU HA H 18.064 2.526 -1.008 1.00 . A A . 6 LEU HA 1 1
3 733 1 1 7 LEU HB2 H 18.556 -0.371 -0.320 1.00 . A A . 6 LEU HB2 1 1
3 734 1 1 7 LEU HB3 H 17.304 0.657 0.364 1.00 . A A . 6 LEU HB3 1 1
3 735 1 1 7 LEU HD11 H 15.834 -1.587 -2.377 1.00 . A A . 6 LEU HD11 1 1
3 736 1 1 7 LEU HD12 H 15.903 -1.426 -0.622 1.00 . A A . 6 LEU HD12 1 1
3 737 1 1 7 LEU HD13 H 17.313 -2.002 -1.510 1.00 . A A . 6 LEU HD13 1 1
3 738 1 1 7 LEU HD21 H 15.308 1.122 -0.730 1.00 . A A . 6 LEU HD21 1 1
3 739 1 1 7 LEU HD22 H 15.001 0.652 -2.398 1.00 . A A . 6 LEU HD22 1 1
3 740 1 1 7 LEU HD23 H 16.043 2.027 -2.054 1.00 . A A . 6 LEU HD23 1 1
3 741 1 1 7 LEU HG H 17.508 0.197 -2.618 1.00 . A A . 6 LEU HG 1 1
3 742 1 1 7 LEU N N 19.492 1.449 -2.067 1.00 . A A . 6 LEU N 1 1
3 743 1 1 7 LEU O O 19.242 2.692 1.274 1.00 . A A . 6 LEU O 1 1
3 744 1 1 8 ALA C C 22.054 3.286 1.555 1.00 . A A . 7 ALA C 1 1
3 745 1 1 8 ALA CA C 21.838 1.774 1.353 1.00 . A A . 7 ALA CA 1 1
3 746 1 1 8 ALA CB C 23.176 1.029 1.062 1.00 . A A . 7 ALA CB 1 1
3 747 1 1 8 ALA H H 21.160 0.992 -0.500 1.00 . A A . 7 ALA H 1 1
3 748 1 1 8 ALA HA H 21.411 1.379 2.266 1.00 . A A . 7 ALA HA 1 1
3 749 1 1 8 ALA HB1 H 24.020 1.702 1.162 1.00 . A A . 7 ALA HB1 1 1
3 750 1 1 8 ALA HB2 H 23.154 0.642 0.056 1.00 . A A . 7 ALA HB2 1 1
3 751 1 1 8 ALA HB3 H 23.300 0.198 1.749 1.00 . A A . 7 ALA HB3 1 1
3 752 1 1 8 ALA N N 20.885 1.527 0.274 1.00 . A A . 7 ALA N 1 1
3 753 1 1 8 ALA O O 21.875 3.791 2.663 1.00 . A A . 7 ALA O 1 1
3 754 1 1 9 PRO C C 21.599 6.180 1.485 1.00 . A A . 8 PRO C 1 1
3 755 1 1 9 PRO CA C 22.658 5.485 0.628 1.00 . A A . 8 PRO CA 1 1
3 756 1 1 9 PRO CB C 22.573 5.937 -0.829 1.00 . A A . 8 PRO CB 1 1
3 757 1 1 9 PRO CD C 22.672 3.526 -0.847 1.00 . A A . 8 PRO CD 1 1
3 758 1 1 9 PRO CG C 23.124 4.786 -1.603 1.00 . A A . 8 PRO CG 1 1
3 759 1 1 9 PRO HA H 23.644 5.689 0.999 1.00 . A A . 8 PRO HA 1 1
3 760 1 1 9 PRO HB2 H 21.537 6.124 -1.105 1.00 . A A . 8 PRO HB2 1 1
3 761 1 1 9 PRO HB3 H 23.170 6.812 -0.994 1.00 . A A . 8 PRO HB3 1 1
3 762 1 1 9 PRO HD2 H 21.764 3.134 -1.284 1.00 . A A . 8 PRO HD2 1 1
3 763 1 1 9 PRO HD3 H 23.448 2.781 -0.841 1.00 . A A . 8 PRO HD3 1 1
3 764 1 1 9 PRO HG2 H 22.727 4.795 -2.616 1.00 . A A . 8 PRO HG2 1 1
3 765 1 1 9 PRO HG3 H 24.203 4.824 -1.623 1.00 . A A . 8 PRO HG3 1 1
3 766 1 1 9 PRO N N 22.426 4.010 0.527 1.00 . A A . 8 PRO N 1 1
3 767 1 1 9 PRO O O 21.918 6.934 2.405 1.00 . A A . 8 PRO O 1 1
3 768 1 1 10 ALA C C 19.161 5.966 3.323 1.00 . A A . 9 ALA C 1 1
3 769 1 1 10 ALA CA C 19.232 6.511 1.898 1.00 . A A . 9 ALA CA 1 1
3 770 1 1 10 ALA CB C 17.916 6.225 1.174 1.00 . A A . 9 ALA CB 1 1
3 771 1 1 10 ALA H H 20.161 5.309 0.422 1.00 . A A . 9 ALA H 1 1
3 772 1 1 10 ALA HA H 19.376 7.578 1.939 1.00 . A A . 9 ALA HA 1 1
3 773 1 1 10 ALA HB1 H 17.730 5.161 1.173 1.00 . A A . 9 ALA HB1 1 1
3 774 1 1 10 ALA HB2 H 17.981 6.579 0.156 1.00 . A A . 9 ALA HB2 1 1
3 775 1 1 10 ALA HB3 H 17.109 6.731 1.680 1.00 . A A . 9 ALA HB3 1 1
3 776 1 1 10 ALA N N 20.344 5.915 1.167 1.00 . A A . 9 ALA N 1 1
3 777 1 1 10 ALA O O 18.694 6.650 4.234 1.00 . A A . 9 ALA O 1 1
3 778 1 1 11 LEU C C 20.904 4.451 5.548 1.00 . A A . 10 LEU C 1 1
3 779 1 1 11 LEU CA C 19.618 4.084 4.817 1.00 . A A . 10 LEU CA 1 1
3 780 1 1 11 LEU CB C 19.426 2.547 4.581 1.00 . A A . 10 LEU CB 1 1
3 781 1 1 11 LEU CD1 C 19.749 1.767 6.979 1.00 . A A . 10 LEU CD1 1 1
3 782 1 1 11 LEU CD2 C 20.169 0.211 5.031 1.00 . A A . 10 LEU CD2 1 1
3 783 1 1 11 LEU CG C 20.267 1.667 5.523 1.00 . A A . 10 LEU CG 1 1
3 784 1 1 11 LEU H H 19.986 4.228 2.757 1.00 . A A . 10 LEU H 1 1
3 785 1 1 11 LEU HA H 18.804 4.465 5.384 1.00 . A A . 10 LEU HA 1 1
3 786 1 1 11 LEU HB2 H 18.386 2.290 4.720 1.00 . A A . 10 LEU HB2 1 1
3 787 1 1 11 LEU HB3 H 19.696 2.323 3.558 1.00 . A A . 10 LEU HB3 1 1
3 788 1 1 11 LEU HD11 H 19.314 2.742 7.152 1.00 . A A . 10 LEU HD11 1 1
3 789 1 1 11 LEU HD12 H 20.572 1.624 7.660 1.00 . A A . 10 LEU HD12 1 1
3 790 1 1 11 LEU HD13 H 19.000 1.006 7.167 1.00 . A A . 10 LEU HD13 1 1
3 791 1 1 11 LEU HD21 H 20.570 -0.451 5.785 1.00 . A A . 10 LEU HD21 1 1
3 792 1 1 11 LEU HD22 H 20.735 0.101 4.118 1.00 . A A . 10 LEU HD22 1 1
3 793 1 1 11 LEU HD23 H 19.134 -0.038 4.846 1.00 . A A . 10 LEU HD23 1 1
3 794 1 1 11 LEU HG H 21.300 1.981 5.477 1.00 . A A . 10 LEU HG 1 1
3 795 1 1 11 LEU N N 19.625 4.728 3.512 1.00 . A A . 10 LEU N 1 1
3 796 1 1 11 LEU O O 21.069 4.216 6.744 1.00 . A A . 10 LEU O 1 1
3 797 1 1 12 ALA C C 22.916 6.192 6.639 1.00 . A A . 11 ALA C 1 1
3 798 1 1 12 ALA CA C 23.095 5.443 5.325 1.00 . A A . 11 ALA CA 1 1
3 799 1 1 12 ALA CB C 23.816 6.338 4.316 1.00 . A A . 11 ALA CB 1 1
3 800 1 1 12 ALA H H 21.583 5.170 3.860 1.00 . A A . 11 ALA H 1 1
3 801 1 1 12 ALA HA H 23.698 4.566 5.503 1.00 . A A . 11 ALA HA 1 1
3 802 1 1 12 ALA HB1 H 24.839 6.480 4.629 1.00 . A A . 11 ALA HB1 1 1
3 803 1 1 12 ALA HB2 H 23.320 7.295 4.264 1.00 . A A . 11 ALA HB2 1 1
3 804 1 1 12 ALA HB3 H 23.799 5.869 3.343 1.00 . A A . 11 ALA HB3 1 1
3 805 1 1 12 ALA N N 21.801 5.025 4.795 1.00 . A A . 11 ALA N 1 1
3 806 1 1 12 ALA O O 23.865 6.343 7.410 1.00 . A A . 11 ALA O 1 1
3 807 1 1 13 LEU C C 21.449 6.430 9.302 1.00 . A A . 12 LEU C 1 1
3 808 1 1 13 LEU CA C 21.420 7.384 8.119 1.00 . A A . 12 LEU CA 1 1
3 809 1 1 13 LEU CB C 20.056 8.074 8.030 1.00 . A A . 12 LEU CB 1 1
3 810 1 1 13 LEU CD1 C 18.570 9.484 6.602 1.00 . A A . 12 LEU CD1 1 1
3 811 1 1 13 LEU CD2 C 21.053 9.653 6.365 1.00 . A A . 12 LEU CD2 1 1
3 812 1 1 13 LEU CG C 19.884 8.702 6.647 1.00 . A A . 12 LEU CG 1 1
3 813 1 1 13 LEU H H 20.980 6.509 6.246 1.00 . A A . 12 LEU H 1 1
3 814 1 1 13 LEU HA H 22.183 8.131 8.259 1.00 . A A . 12 LEU HA 1 1
3 815 1 1 13 LEU HB2 H 19.272 7.348 8.196 1.00 . A A . 12 LEU HB2 1 1
3 816 1 1 13 LEU HB3 H 19.994 8.847 8.781 1.00 . A A . 12 LEU HB3 1 1
3 817 1 1 13 LEU HD11 H 18.543 10.190 7.419 1.00 . A A . 12 LEU HD11 1 1
3 818 1 1 13 LEU HD12 H 17.739 8.799 6.691 1.00 . A A . 12 LEU HD12 1 1
3 819 1 1 13 LEU HD13 H 18.498 10.016 5.664 1.00 . A A . 12 LEU HD13 1 1
3 820 1 1 13 LEU HD21 H 20.807 10.291 5.528 1.00 . A A . 12 LEU HD21 1 1
3 821 1 1 13 LEU HD22 H 21.936 9.078 6.128 1.00 . A A . 12 LEU HD22 1 1
3 822 1 1 13 LEU HD23 H 21.243 10.261 7.238 1.00 . A A . 12 LEU HD23 1 1
3 823 1 1 13 LEU HG H 19.860 7.920 5.899 1.00 . A A . 12 LEU HG 1 1
3 824 1 1 13 LEU N N 21.699 6.658 6.891 1.00 . A A . 12 LEU N 1 1
3 825 1 1 13 LEU O O 22.301 6.550 10.184 1.00 . A A . 12 LEU O 1 1
3 826 1 1 14 ALA C C 21.811 3.797 10.493 1.00 . A A . 13 ALA C 1 1
3 827 1 1 14 ALA CA C 20.480 4.523 10.415 1.00 . A A . 13 ALA CA 1 1
3 828 1 1 14 ALA CB C 19.348 3.512 10.217 1.00 . A A . 13 ALA CB 1 1
3 829 1 1 14 ALA H H 19.866 5.422 8.597 1.00 . A A . 13 ALA H 1 1
3 830 1 1 14 ALA HA H 20.318 5.055 11.340 1.00 . A A . 13 ALA HA 1 1
3 831 1 1 14 ALA HB1 H 18.455 4.028 9.897 1.00 . A A . 13 ALA HB1 1 1
3 832 1 1 14 ALA HB2 H 19.157 3.004 11.150 1.00 . A A . 13 ALA HB2 1 1
3 833 1 1 14 ALA HB3 H 19.636 2.789 9.470 1.00 . A A . 13 ALA HB3 1 1
3 834 1 1 14 ALA N N 20.521 5.480 9.322 1.00 . A A . 13 ALA N 1 1
3 835 1 1 14 ALA O O 22.296 3.479 11.575 1.00 . A A . 13 ALA O 1 1
3 836 1 1 15 LEU C C 24.663 3.586 10.209 1.00 . A A . 14 LEU C 1 1
3 837 1 1 15 LEU CA C 23.687 2.848 9.310 1.00 . A A . 14 LEU CA 1 1
3 838 1 1 15 LEU CB C 24.212 2.765 7.864 1.00 . A A . 14 LEU CB 1 1
3 839 1 1 15 LEU CD1 C 25.428 1.118 6.358 1.00 . A A . 14 LEU CD1 1 1
3 840 1 1 15 LEU CD2 C 26.749 2.509 7.940 1.00 . A A . 14 LEU CD2 1 1
3 841 1 1 15 LEU CG C 25.411 1.772 7.745 1.00 . A A . 14 LEU CG 1 1
3 842 1 1 15 LEU H H 21.984 3.809 8.492 1.00 . A A . 14 LEU H 1 1
3 843 1 1 15 LEU HA H 23.549 1.861 9.701 1.00 . A A . 14 LEU HA 1 1
3 844 1 1 15 LEU HB2 H 23.398 2.434 7.229 1.00 . A A . 14 LEU HB2 1 1
3 845 1 1 15 LEU HB3 H 24.520 3.751 7.545 1.00 . A A . 14 LEU HB3 1 1
3 846 1 1 15 LEU HD11 H 25.353 1.883 5.599 1.00 . A A . 14 LEU HD11 1 1
3 847 1 1 15 LEU HD12 H 24.592 0.440 6.271 1.00 . A A . 14 LEU HD12 1 1
3 848 1 1 15 LEU HD13 H 26.350 0.572 6.229 1.00 . A A . 14 LEU HD13 1 1
3 849 1 1 15 LEU HD21 H 26.820 2.872 8.952 1.00 . A A . 14 LEU HD21 1 1
3 850 1 1 15 LEU HD22 H 26.807 3.342 7.256 1.00 . A A . 14 LEU HD22 1 1
3 851 1 1 15 LEU HD23 H 27.564 1.828 7.744 1.00 . A A . 14 LEU HD23 1 1
3 852 1 1 15 LEU HG H 25.317 0.993 8.488 1.00 . A A . 14 LEU HG 1 1
3 853 1 1 15 LEU N N 22.407 3.536 9.335 1.00 . A A . 14 LEU N 1 1
3 854 1 1 15 LEU O O 25.338 2.976 11.035 1.00 . A A . 14 LEU O 1 1
3 855 1 1 16 ALA C C 25.270 5.497 12.344 1.00 . A A . 15 ALA C 1 1
3 856 1 1 16 ALA CA C 25.622 5.694 10.873 1.00 . A A . 15 ALA CA 1 1
3 857 1 1 16 ALA CB C 25.502 7.173 10.505 1.00 . A A . 15 ALA CB 1 1
3 858 1 1 16 ALA H H 24.160 5.342 9.383 1.00 . A A . 15 ALA H 1 1
3 859 1 1 16 ALA HA H 26.638 5.369 10.705 1.00 . A A . 15 ALA HA 1 1
3 860 1 1 16 ALA HB1 H 24.559 7.558 10.863 1.00 . A A . 15 ALA HB1 1 1
3 861 1 1 16 ALA HB2 H 25.551 7.282 9.432 1.00 . A A . 15 ALA HB2 1 1
3 862 1 1 16 ALA HB3 H 26.312 7.725 10.959 1.00 . A A . 15 ALA HB3 1 1
3 863 1 1 16 ALA N N 24.727 4.899 10.054 1.00 . A A . 15 ALA N 1 1
3 864 1 1 16 ALA O O 26.111 5.667 13.226 1.00 . A A . 15 ALA O 1 1
3 865 1 1 17 LEU C C 24.057 3.623 14.567 1.00 . A A . 16 LEU C 1 1
3 866 1 1 17 LEU CA C 23.537 4.930 13.959 1.00 . A A . 16 LEU CA 1 1
3 867 1 1 17 LEU CB C 21.992 4.954 13.998 1.00 . A A . 16 LEU CB 1 1
3 868 1 1 17 LEU CD1 C 21.450 6.897 15.539 1.00 . A A . 16 LEU CD1 1 1
3 869 1 1 17 LEU CD2 C 20.060 4.831 15.625 1.00 . A A . 16 LEU CD2 1 1
3 870 1 1 17 LEU CG C 21.482 5.367 15.404 1.00 . A A . 16 LEU CG 1 1
3 871 1 1 17 LEU H H 23.386 5.029 11.851 1.00 . A A . 16 LEU H 1 1
3 872 1 1 17 LEU HA H 23.900 5.739 14.557 1.00 . A A . 16 LEU HA 1 1
3 873 1 1 17 LEU HB2 H 21.631 5.656 13.258 1.00 . A A . 16 LEU HB2 1 1
3 874 1 1 17 LEU HB3 H 21.616 3.969 13.758 1.00 . A A . 16 LEU HB3 1 1
3 875 1 1 17 LEU HD11 H 20.889 7.322 14.720 1.00 . A A . 16 LEU HD11 1 1
3 876 1 1 17 LEU HD12 H 22.455 7.287 15.526 1.00 . A A . 16 LEU HD12 1 1
3 877 1 1 17 LEU HD13 H 20.976 7.163 16.472 1.00 . A A . 16 LEU HD13 1 1
3 878 1 1 17 LEU HD21 H 19.426 5.146 14.809 1.00 . A A . 16 LEU HD21 1 1
3 879 1 1 17 LEU HD22 H 19.669 5.218 16.555 1.00 . A A . 16 LEU HD22 1 1
3 880 1 1 17 LEU HD23 H 20.085 3.753 15.667 1.00 . A A . 16 LEU HD23 1 1
3 881 1 1 17 LEU HG H 22.142 4.959 16.158 1.00 . A A . 16 LEU HG 1 1
3 882 1 1 17 LEU N N 24.010 5.143 12.596 1.00 . A A . 16 LEU N 1 1
3 883 1 1 17 LEU O O 24.845 3.654 15.512 1.00 . A A . 16 LEU O 1 1
3 884 1 1 18 TRP C C 25.497 0.841 14.191 1.00 . A A . 17 TRP C 1 1
3 885 1 1 18 TRP CA C 24.070 1.193 14.592 1.00 . A A . 17 TRP CA 1 1
3 886 1 1 18 TRP CB C 23.116 0.058 14.210 1.00 . A A . 17 TRP CB 1 1
3 887 1 1 18 TRP CD1 C 21.901 0.787 12.116 1.00 . A A . 17 TRP CD1 1 1
3 888 1 1 18 TRP CD2 C 23.434 -0.810 11.717 1.00 . A A . 17 TRP CD2 1 1
3 889 1 1 18 TRP CE2 C 22.835 -0.503 10.475 1.00 . A A . 17 TRP CE2 1 1
3 890 1 1 18 TRP CE3 C 24.441 -1.793 11.741 1.00 . A A . 17 TRP CE3 1 1
3 891 1 1 18 TRP CG C 22.824 0.025 12.744 1.00 . A A . 17 TRP CG 1 1
3 892 1 1 18 TRP CH2 C 24.216 -2.119 9.338 1.00 . A A . 17 TRP CH2 1 1
3 893 1 1 18 TRP CZ2 C 23.215 -1.145 9.299 1.00 . A A . 17 TRP CZ2 1 1
3 894 1 1 18 TRP CZ3 C 24.827 -2.443 10.557 1.00 . A A . 17 TRP CZ3 1 1
3 895 1 1 18 TRP H H 22.983 2.482 13.294 1.00 . A A . 17 TRP H 1 1
3 896 1 1 18 TRP HA H 24.053 1.278 15.669 1.00 . A A . 17 TRP HA 1 1
3 897 1 1 18 TRP HB2 H 23.561 -0.877 14.488 1.00 . A A . 17 TRP HB2 1 1
3 898 1 1 18 TRP HB3 H 22.193 0.187 14.754 1.00 . A A . 17 TRP HB3 1 1
3 899 1 1 18 TRP HD1 H 21.264 1.521 12.589 1.00 . A A . 17 TRP HD1 1 1
3 900 1 1 18 TRP HE1 H 21.333 0.884 10.089 1.00 . A A . 17 TRP HE1 1 1
3 901 1 1 18 TRP HE3 H 24.917 -2.049 12.674 1.00 . A A . 17 TRP HE3 1 1
3 902 1 1 18 TRP HH2 H 24.518 -2.621 8.431 1.00 . A A . 17 TRP HH2 1 1
3 903 1 1 18 TRP HZ2 H 22.739 -0.889 8.364 1.00 . A A . 17 TRP HZ2 1 1
3 904 1 1 18 TRP HZ3 H 25.601 -3.196 10.586 1.00 . A A . 17 TRP HZ3 1 1
3 905 1 1 18 TRP N N 23.617 2.473 14.043 1.00 . A A . 17 TRP N 1 1
3 906 1 1 18 TRP NE1 N 21.907 0.474 10.769 1.00 . A A . 17 TRP NE1 1 1
3 907 1 1 18 TRP O O 26.272 0.363 15.018 1.00 . A A . 17 TRP O 1 1
3 908 1 1 19 TRP C C 28.215 1.388 13.435 1.00 . A A . 18 TRP C 1 1
3 909 1 1 19 TRP CA C 27.205 0.752 12.490 1.00 . A A . 18 TRP CA 1 1
3 910 1 1 19 TRP CB C 27.441 1.276 11.067 1.00 . A A . 18 TRP CB 1 1
3 911 1 1 19 TRP CD1 C 28.686 -0.638 9.988 1.00 . A A . 18 TRP CD1 1 1
3 912 1 1 19 TRP CD2 C 29.992 1.165 10.306 1.00 . A A . 18 TRP CD2 1 1
3 913 1 1 19 TRP CE2 C 30.802 0.177 9.701 1.00 . A A . 18 TRP CE2 1 1
3 914 1 1 19 TRP CE3 C 30.577 2.407 10.613 1.00 . A A . 18 TRP CE3 1 1
3 915 1 1 19 TRP CG C 28.651 0.621 10.476 1.00 . A A . 18 TRP CG 1 1
3 916 1 1 19 TRP CH2 C 32.714 1.648 9.721 1.00 . A A . 18 TRP CH2 1 1
3 917 1 1 19 TRP CZ2 C 32.146 0.410 9.410 1.00 . A A . 18 TRP CZ2 1 1
3 918 1 1 19 TRP CZ3 C 31.931 2.645 10.322 1.00 . A A . 18 TRP CZ3 1 1
3 919 1 1 19 TRP H H 25.201 1.449 12.313 1.00 . A A . 18 TRP H 1 1
3 920 1 1 19 TRP HA H 27.335 -0.321 12.501 1.00 . A A . 18 TRP HA 1 1
3 921 1 1 19 TRP HB2 H 26.580 1.057 10.459 1.00 . A A . 18 TRP HB2 1 1
3 922 1 1 19 TRP HB3 H 27.595 2.346 11.098 1.00 . A A . 18 TRP HB3 1 1
3 923 1 1 19 TRP HD1 H 27.854 -1.324 9.962 1.00 . A A . 18 TRP HD1 1 1
3 924 1 1 19 TRP HE1 H 30.258 -1.745 9.123 1.00 . A A . 18 TRP HE1 1 1
3 925 1 1 19 TRP HE3 H 29.983 3.180 11.075 1.00 . A A . 18 TRP HE3 1 1
3 926 1 1 19 TRP HH2 H 33.753 1.837 9.499 1.00 . A A . 18 TRP HH2 1 1
3 927 1 1 19 TRP HZ2 H 32.741 -0.364 8.947 1.00 . A A . 18 TRP HZ2 1 1
3 928 1 1 19 TRP HZ3 H 32.372 3.601 10.561 1.00 . A A . 18 TRP HZ3 1 1
3 929 1 1 19 TRP N N 25.850 1.069 12.938 1.00 . A A . 18 TRP N 1 1
3 930 1 1 19 TRP NE1 N 29.964 -0.902 9.526 1.00 . A A . 18 TRP NE1 1 1
3 931 1 1 19 TRP O O 29.101 0.719 13.965 1.00 . A A . 18 TRP O 1 1
3 932 1 1 20 ALA C C 28.356 3.525 15.921 1.00 . A A . 19 ALA C 1 1
3 933 1 1 20 ALA CA C 28.946 3.454 14.520 1.00 . A A . 19 ALA CA 1 1
3 934 1 1 20 ALA CB C 29.146 4.868 13.970 1.00 . A A . 19 ALA CB 1 1
3 935 1 1 20 ALA H H 27.333 3.157 13.183 1.00 . A A . 19 ALA H 1 1
3 936 1 1 20 ALA HA H 29.901 2.964 14.573 1.00 . A A . 19 ALA HA 1 1
3 937 1 1 20 ALA HB1 H 28.264 5.460 14.169 1.00 . A A . 19 ALA HB1 1 1
3 938 1 1 20 ALA HB2 H 29.314 4.820 12.905 1.00 . A A . 19 ALA HB2 1 1
3 939 1 1 20 ALA HB3 H 29.999 5.323 14.450 1.00 . A A . 19 ALA HB3 1 1
3 940 1 1 20 ALA N N 28.061 2.694 13.637 1.00 . A A . 19 ALA N 1 1
3 941 1 1 20 ALA O O 28.591 4.480 16.661 1.00 . A A . 19 ALA O 1 1
3 942 1 1 21 ETA CA C 26.959 2.446 17.586 1.00 . A A . 20 ETA CA 1 1
3 943 1 1 21 ETA CB C 27.978 2.033 18.646 1.00 . A A . 20 ETA CB 1 1
3 944 1 1 21 ETA HA1 H 26.159 1.723 17.569 1.00 . A A . 20 ETA HA1 1 1
3 945 1 1 21 ETA HA2 H 26.558 3.420 17.832 1.00 . A A . 20 ETA HA2 1 1
3 946 1 1 21 ETA HB1 H 28.267 1.001 18.480 1.00 . A A . 20 ETA HB1 1 1
3 947 1 1 21 ETA HB2 H 27.543 2.124 19.624 1.00 . A A . 20 ETA HB2 1 1
3 948 1 1 21 ETA HN2 H 27.442 1.776 15.632 1.00 . A A . 20 ETA HN2 1 1
3 949 1 1 21 ETA HO H 29.505 2.776 17.694 1.00 . A A . 20 ETA HO 1 1
3 950 1 1 21 ETA N N 27.588 2.504 16.272 1.00 . A A . 20 ETA N 1 1
3 951 1 1 21 ETA O O 29.110 2.890 18.562 1.00 . A A . 20 ETA O 1 1
4 952 1 1 1 ACE C C 22.982 -4.930 -8.951 1.00 . A A . 0 ACE C 1 1
4 953 1 1 1 ACE CH3 C 23.647 -5.871 -7.951 1.00 . A A . 0 ACE CH3 1 1
4 954 1 1 1 ACE H1 H 23.611 -6.881 -8.330 1.00 . A A . 0 ACE H1 1 1
4 955 1 1 1 ACE H2 H 23.125 -5.822 -7.006 1.00 . A A . 0 ACE H2 1 1
4 956 1 1 1 ACE H3 H 24.677 -5.577 -7.809 1.00 . A A . 0 ACE H3 1 1
4 957 1 1 1 ACE O O 23.205 -5.036 -10.157 1.00 . A A . 0 ACE O 1 1
4 958 1 1 2 GLY C C 20.883 -1.947 -8.467 1.00 . A A . 1 GLY C 1 1
4 959 1 1 2 GLY CA C 21.475 -3.066 -9.296 1.00 . A A . 1 GLY CA 1 1
4 960 1 1 2 GLY H H 22.016 -3.966 -7.481 1.00 . A A . 1 GLY H 1 1
4 961 1 1 2 GLY HA2 H 22.157 -2.655 -10.017 1.00 . A A . 1 GLY HA2 1 1
4 962 1 1 2 GLY HA3 H 20.670 -3.577 -9.808 1.00 . A A . 1 GLY HA3 1 1
4 963 1 1 2 GLY N N 22.164 -4.011 -8.445 1.00 . A A . 1 GLY N 1 1
4 964 1 1 2 GLY O O 21.527 -1.376 -7.593 1.00 . A A . 1 GLY O 1 1
4 965 1 1 3 TRP C C 18.616 -1.084 -6.625 1.00 . A A . 2 TRP C 1 1
4 966 1 1 3 TRP CA C 18.930 -0.604 -8.042 1.00 . A A . 2 TRP CA 1 1
4 967 1 1 3 TRP CB C 17.648 -0.175 -8.812 1.00 . A A . 2 TRP CB 1 1
4 968 1 1 3 TRP CD1 C 17.193 -2.568 -9.201 1.00 . A A . 2 TRP CD1 1 1
4 969 1 1 3 TRP CD2 C 16.570 -1.332 -10.956 1.00 . A A . 2 TRP CD2 1 1
4 970 1 1 3 TRP CE2 C 16.271 -2.675 -11.284 1.00 . A A . 2 TRP CE2 1 1
4 971 1 1 3 TRP CE3 C 16.271 -0.337 -11.902 1.00 . A A . 2 TRP CE3 1 1
4 972 1 1 3 TRP CG C 17.157 -1.313 -9.624 1.00 . A A . 2 TRP CG 1 1
4 973 1 1 3 TRP CH2 C 15.405 -2.021 -13.435 1.00 . A A . 2 TRP CH2 1 1
4 974 1 1 3 TRP CZ2 C 15.697 -3.021 -12.503 1.00 . A A . 2 TRP CZ2 1 1
4 975 1 1 3 TRP CZ3 C 15.692 -0.680 -13.135 1.00 . A A . 2 TRP CZ3 1 1
4 976 1 1 3 TRP H H 19.213 -2.153 -9.455 1.00 . A A . 2 TRP H 1 1
4 977 1 1 3 TRP HA H 19.580 0.238 -7.951 1.00 . A A . 2 TRP HA 1 1
4 978 1 1 3 TRP HB2 H 16.879 0.117 -8.117 1.00 . A A . 2 TRP HB2 1 1
4 979 1 1 3 TRP HB3 H 17.876 0.655 -9.465 1.00 . A A . 2 TRP HB3 1 1
4 980 1 1 3 TRP HD1 H 17.577 -2.861 -8.247 1.00 . A A . 2 TRP HD1 1 1
4 981 1 1 3 TRP HE1 H 16.591 -4.365 -10.111 1.00 . A A . 2 TRP HE1 1 1
4 982 1 1 3 TRP HE3 H 16.489 0.698 -11.679 1.00 . A A . 2 TRP HE3 1 1
4 983 1 1 3 TRP HH2 H 14.959 -2.279 -14.384 1.00 . A A . 2 TRP HH2 1 1
4 984 1 1 3 TRP HZ2 H 15.480 -4.056 -12.725 1.00 . A A . 2 TRP HZ2 1 1
4 985 1 1 3 TRP HZ3 H 15.466 0.092 -13.855 1.00 . A A . 2 TRP HZ3 1 1
4 986 1 1 3 TRP N N 19.648 -1.652 -8.754 1.00 . A A . 2 TRP N 1 1
4 987 1 1 3 TRP NE1 N 16.674 -3.394 -10.177 1.00 . A A . 2 TRP NE1 1 1
4 988 1 1 3 TRP O O 17.861 -0.442 -5.895 1.00 . A A . 2 TRP O 1 1
4 989 1 1 4 TRP C C 19.856 -2.037 -3.902 1.00 . A A . 3 TRP C 1 1
4 990 1 1 4 TRP CA C 18.990 -2.777 -4.907 1.00 . A A . 3 TRP CA 1 1
4 991 1 1 4 TRP CB C 19.319 -4.282 -4.858 1.00 . A A . 3 TRP CB 1 1
4 992 1 1 4 TRP CD1 C 19.745 -5.717 -6.886 1.00 . A A . 3 TRP CD1 1 1
4 993 1 1 4 TRP CD2 C 17.631 -4.971 -6.801 1.00 . A A . 3 TRP CD2 1 1
4 994 1 1 4 TRP CE2 C 17.741 -5.759 -7.972 1.00 . A A . 3 TRP CE2 1 1
4 995 1 1 4 TRP CE3 C 16.388 -4.381 -6.519 1.00 . A A . 3 TRP CE3 1 1
4 996 1 1 4 TRP CG C 18.919 -4.962 -6.129 1.00 . A A . 3 TRP CG 1 1
4 997 1 1 4 TRP CH2 C 15.433 -5.357 -8.529 1.00 . A A . 3 TRP CH2 1 1
4 998 1 1 4 TRP CZ2 C 16.661 -5.953 -8.828 1.00 . A A . 3 TRP CZ2 1 1
4 999 1 1 4 TRP CZ3 C 15.301 -4.572 -7.376 1.00 . A A . 3 TRP CZ3 1 1
4 1000 1 1 4 TRP H H 19.802 -2.691 -6.860 1.00 . A A . 3 TRP H 1 1
4 1001 1 1 4 TRP HA H 17.972 -2.634 -4.640 1.00 . A A . 3 TRP HA 1 1
4 1002 1 1 4 TRP HB2 H 20.377 -4.415 -4.715 1.00 . A A . 3 TRP HB2 1 1
4 1003 1 1 4 TRP HB3 H 18.789 -4.737 -4.030 1.00 . A A . 3 TRP HB3 1 1
4 1004 1 1 4 TRP HD1 H 20.778 -5.915 -6.671 1.00 . A A . 3 TRP HD1 1 1
4 1005 1 1 4 TRP HE1 H 19.417 -6.760 -8.683 1.00 . A A . 3 TRP HE1 1 1
4 1006 1 1 4 TRP HE3 H 16.267 -3.776 -5.643 1.00 . A A . 3 TRP HE3 1 1
4 1007 1 1 4 TRP HH2 H 14.587 -5.499 -9.187 1.00 . A A . 3 TRP HH2 1 1
4 1008 1 1 4 TRP HZ2 H 16.773 -6.560 -9.713 1.00 . A A . 3 TRP HZ2 1 1
4 1009 1 1 4 TRP HZ3 H 14.361 -4.107 -7.142 1.00 . A A . 3 TRP HZ3 1 1
4 1010 1 1 4 TRP N N 19.209 -2.223 -6.240 1.00 . A A . 3 TRP N 1 1
4 1011 1 1 4 TRP NE1 N 19.048 -6.189 -7.978 1.00 . A A . 3 TRP NE1 1 1
4 1012 1 1 4 TRP O O 19.362 -1.470 -2.927 1.00 . A A . 3 TRP O 1 1
4 1013 1 1 5 LEU C C 21.647 0.066 -3.101 1.00 . A A . 4 LEU C 1 1
4 1014 1 1 5 LEU CA C 22.096 -1.379 -3.285 1.00 . A A . 4 LEU CA 1 1
4 1015 1 1 5 LEU CB C 23.521 -1.433 -3.876 1.00 . A A . 4 LEU CB 1 1
4 1016 1 1 5 LEU CD1 C 23.706 -2.893 -5.984 1.00 . A A . 4 LEU CD1 1 1
4 1017 1 1 5 LEU CD2 C 25.277 -3.285 -4.098 1.00 . A A . 4 LEU CD2 1 1
4 1018 1 1 5 LEU CG C 23.841 -2.864 -4.455 1.00 . A A . 4 LEU CG 1 1
4 1019 1 1 5 LEU H H 21.481 -2.515 -4.950 1.00 . A A . 4 LEU H 1 1
4 1020 1 1 5 LEU HA H 22.091 -1.876 -2.327 1.00 . A A . 4 LEU HA 1 1
4 1021 1 1 5 LEU HB2 H 23.602 -0.681 -4.654 1.00 . A A . 4 LEU HB2 1 1
4 1022 1 1 5 LEU HB3 H 24.222 -1.194 -3.086 1.00 . A A . 4 LEU HB3 1 1
4 1023 1 1 5 LEU HD11 H 24.137 -3.807 -6.369 1.00 . A A . 4 LEU HD11 1 1
4 1024 1 1 5 LEU HD12 H 24.217 -2.050 -6.421 1.00 . A A . 4 LEU HD12 1 1
4 1025 1 1 5 LEU HD13 H 22.668 -2.860 -6.243 1.00 . A A . 4 LEU HD13 1 1
4 1026 1 1 5 LEU HD21 H 25.347 -3.463 -3.035 1.00 . A A . 4 LEU HD21 1 1
4 1027 1 1 5 LEU HD22 H 25.963 -2.500 -4.379 1.00 . A A . 4 LEU HD22 1 1
4 1028 1 1 5 LEU HD23 H 25.525 -4.190 -4.634 1.00 . A A . 4 LEU HD23 1 1
4 1029 1 1 5 LEU HG H 23.147 -3.591 -4.048 1.00 . A A . 4 LEU HG 1 1
4 1030 1 1 5 LEU N N 21.155 -2.048 -4.158 1.00 . A A . 4 LEU N 1 1
4 1031 1 1 5 LEU O O 21.923 0.699 -2.083 1.00 . A A . 4 LEU O 1 1
4 1032 1 1 6 ALA C C 19.667 2.207 -2.806 1.00 . A A . 5 ALA C 1 1
4 1033 1 1 6 ALA CA C 20.440 1.937 -4.096 1.00 . A A . 5 ALA CA 1 1
4 1034 1 1 6 ALA CB C 19.512 2.150 -5.296 1.00 . A A . 5 ALA CB 1 1
4 1035 1 1 6 ALA H H 20.763 0.005 -4.893 1.00 . A A . 5 ALA H 1 1
4 1036 1 1 6 ALA HA H 21.266 2.625 -4.170 1.00 . A A . 5 ALA HA 1 1
4 1037 1 1 6 ALA HB1 H 19.966 1.728 -6.181 1.00 . A A . 5 ALA HB1 1 1
4 1038 1 1 6 ALA HB2 H 19.350 3.207 -5.445 1.00 . A A . 5 ALA HB2 1 1
4 1039 1 1 6 ALA HB3 H 18.565 1.662 -5.111 1.00 . A A . 5 ALA HB3 1 1
4 1040 1 1 6 ALA N N 20.946 0.570 -4.113 1.00 . A A . 5 ALA N 1 1
4 1041 1 1 6 ALA O O 19.309 3.348 -2.515 1.00 . A A . 5 ALA O 1 1
4 1042 1 1 7 LEU C C 19.629 1.571 0.380 1.00 . A A . 6 LEU C 1 1
4 1043 1 1 7 LEU CA C 18.681 1.268 -0.782 1.00 . A A . 6 LEU CA 1 1
4 1044 1 1 7 LEU CB C 17.939 -0.041 -0.502 1.00 . A A . 6 LEU CB 1 1
4 1045 1 1 7 LEU CD1 C 16.628 -1.862 -1.639 1.00 . A A . 6 LEU CD1 1 1
4 1046 1 1 7 LEU CD2 C 15.671 0.436 -1.518 1.00 . A A . 6 LEU CD2 1 1
4 1047 1 1 7 LEU CG C 16.972 -0.370 -1.659 1.00 . A A . 6 LEU CG 1 1
4 1048 1 1 7 LEU H H 19.718 0.269 -2.320 1.00 . A A . 6 LEU H 1 1
4 1049 1 1 7 LEU HA H 17.961 2.060 -0.861 1.00 . A A . 6 LEU HA 1 1
4 1050 1 1 7 LEU HB2 H 18.666 -0.838 -0.397 1.00 . A A . 6 LEU HB2 1 1
4 1051 1 1 7 LEU HB3 H 17.384 0.055 0.415 1.00 . A A . 6 LEU HB3 1 1
4 1052 1 1 7 LEU HD11 H 17.538 -2.442 -1.690 1.00 . A A . 6 LEU HD11 1 1
4 1053 1 1 7 LEU HD12 H 16.003 -2.098 -2.488 1.00 . A A . 6 LEU HD12 1 1
4 1054 1 1 7 LEU HD13 H 16.101 -2.098 -0.727 1.00 . A A . 6 LEU HD13 1 1
4 1055 1 1 7 LEU HD21 H 14.951 0.077 -2.239 1.00 . A A . 6 LEU HD21 1 1
4 1056 1 1 7 LEU HD22 H 15.866 1.480 -1.701 1.00 . A A . 6 LEU HD22 1 1
4 1057 1 1 7 LEU HD23 H 15.269 0.313 -0.523 1.00 . A A . 6 LEU HD23 1 1
4 1058 1 1 7 LEU HG H 17.447 -0.131 -2.601 1.00 . A A . 6 LEU HG 1 1
4 1059 1 1 7 LEU N N 19.412 1.149 -2.038 1.00 . A A . 6 LEU N 1 1
4 1060 1 1 7 LEU O O 19.219 2.154 1.385 1.00 . A A . 6 LEU O 1 1
4 1061 1 1 8 ALA C C 22.023 2.924 1.570 1.00 . A A . 7 ALA C 1 1
4 1062 1 1 8 ALA CA C 21.874 1.415 1.296 1.00 . A A . 7 ALA CA 1 1
4 1063 1 1 8 ALA CB C 23.233 0.755 0.914 1.00 . A A . 7 ALA CB 1 1
4 1064 1 1 8 ALA H H 21.165 0.713 -0.577 1.00 . A A . 7 ALA H 1 1
4 1065 1 1 8 ALA HA H 21.504 0.952 2.202 1.00 . A A . 7 ALA HA 1 1
4 1066 1 1 8 ALA HB1 H 23.426 -0.102 1.549 1.00 . A A . 7 ALA HB1 1 1
4 1067 1 1 8 ALA HB2 H 24.047 1.461 1.024 1.00 . A A . 7 ALA HB2 1 1
4 1068 1 1 8 ALA HB3 H 23.188 0.426 -0.113 1.00 . A A . 7 ALA HB3 1 1
4 1069 1 1 8 ALA N N 20.892 1.175 0.242 1.00 . A A . 7 ALA N 1 1
4 1070 1 1 8 ALA O O 21.860 3.364 2.708 1.00 . A A . 7 ALA O 1 1
4 1071 1 1 9 PRO C C 21.431 5.791 1.674 1.00 . A A . 8 PRO C 1 1
4 1072 1 1 9 PRO CA C 22.485 5.196 0.739 1.00 . A A . 8 PRO CA 1 1
4 1073 1 1 9 PRO CB C 22.313 5.716 -0.688 1.00 . A A . 8 PRO CB 1 1
4 1074 1 1 9 PRO CD C 22.543 3.317 -0.836 1.00 . A A . 8 PRO CD 1 1
4 1075 1 1 9 PRO CG C 22.890 4.638 -1.544 1.00 . A A . 8 PRO CG 1 1
4 1076 1 1 9 PRO HA H 23.476 5.434 1.080 1.00 . A A . 8 PRO HA 1 1
4 1077 1 1 9 PRO HB2 H 21.258 5.860 -0.912 1.00 . A A . 8 PRO HB2 1 1
4 1078 1 1 9 PRO HB3 H 22.857 6.629 -0.830 1.00 . A A . 8 PRO HB3 1 1
4 1079 1 1 9 PRO HD2 H 21.645 2.891 -1.260 1.00 . A A . 8 PRO HD2 1 1
4 1080 1 1 9 PRO HD3 H 23.361 2.621 -0.895 1.00 . A A . 8 PRO HD3 1 1
4 1081 1 1 9 PRO HG2 H 22.448 4.675 -2.537 1.00 . A A . 8 PRO HG2 1 1
4 1082 1 1 9 PRO HG3 H 23.964 4.738 -1.608 1.00 . A A . 8 PRO HG3 1 1
4 1083 1 1 9 PRO N N 22.322 3.717 0.569 1.00 . A A . 8 PRO N 1 1
4 1084 1 1 9 PRO O O 21.749 6.513 2.615 1.00 . A A . 8 PRO O 1 1
4 1085 1 1 10 ALA C C 19.169 5.463 3.638 1.00 . A A . 9 ALA C 1 1
4 1086 1 1 10 ALA CA C 19.074 5.980 2.204 1.00 . A A . 9 ALA CA 1 1
4 1087 1 1 10 ALA CB C 17.740 5.548 1.593 1.00 . A A . 9 ALA CB 1 1
4 1088 1 1 10 ALA H H 19.992 4.900 0.627 1.00 . A A . 9 ALA H 1 1
4 1089 1 1 10 ALA HA H 19.112 7.057 2.218 1.00 . A A . 9 ALA HA 1 1
4 1090 1 1 10 ALA HB1 H 17.707 5.843 0.555 1.00 . A A . 9 ALA HB1 1 1
4 1091 1 1 10 ALA HB2 H 16.929 6.021 2.128 1.00 . A A . 9 ALA HB2 1 1
4 1092 1 1 10 ALA HB3 H 17.641 4.475 1.667 1.00 . A A . 9 ALA HB3 1 1
4 1093 1 1 10 ALA N N 20.178 5.478 1.395 1.00 . A A . 9 ALA N 1 1
4 1094 1 1 10 ALA O O 18.645 6.081 4.565 1.00 . A A . 9 ALA O 1 1
4 1095 1 1 11 LEU C C 21.276 4.268 5.775 1.00 . A A . 10 LEU C 1 1
4 1096 1 1 11 LEU CA C 20.011 3.712 5.131 1.00 . A A . 10 LEU CA 1 1
4 1097 1 1 11 LEU CB C 20.019 2.154 4.930 1.00 . A A . 10 LEU CB 1 1
4 1098 1 1 11 LEU CD1 C 20.670 1.402 7.269 1.00 . A A . 10 LEU CD1 1 1
4 1099 1 1 11 LEU CD2 C 21.181 -0.035 5.264 1.00 . A A . 10 LEU CD2 1 1
4 1100 1 1 11 LEU CG C 21.075 1.414 5.778 1.00 . A A . 10 LEU CG 1 1
4 1101 1 1 11 LEU H H 20.238 3.872 3.049 1.00 . A A . 10 LEU H 1 1
4 1102 1 1 11 LEU HA H 19.191 3.988 5.746 1.00 . A A . 10 LEU HA 1 1
4 1103 1 1 11 LEU HB2 H 19.048 1.755 5.182 1.00 . A A . 10 LEU HB2 1 1
4 1104 1 1 11 LEU HB3 H 20.205 1.949 3.883 1.00 . A A . 10 LEU HB3 1 1
4 1105 1 1 11 LEU HD11 H 20.026 0.557 7.478 1.00 . A A . 10 LEU HD11 1 1
4 1106 1 1 11 LEU HD12 H 20.141 2.308 7.511 1.00 . A A . 10 LEU HD12 1 1
4 1107 1 1 11 LEU HD13 H 21.557 1.332 7.878 1.00 . A A . 10 LEU HD13 1 1
4 1108 1 1 11 LEU HD21 H 20.189 -0.445 5.134 1.00 . A A . 10 LEU HD21 1 1
4 1109 1 1 11 LEU HD22 H 21.726 -0.632 5.980 1.00 . A A . 10 LEU HD22 1 1
4 1110 1 1 11 LEU HD23 H 21.702 -0.044 4.318 1.00 . A A . 10 LEU HD23 1 1
4 1111 1 1 11 LEU HG H 22.034 1.893 5.663 1.00 . A A . 10 LEU HG 1 1
4 1112 1 1 11 LEU N N 19.842 4.322 3.817 1.00 . A A . 10 LEU N 1 1
4 1113 1 1 11 LEU O O 21.539 4.087 6.961 1.00 . A A . 10 LEU O 1 1
4 1114 1 1 12 ALA C C 23.091 6.329 6.699 1.00 . A A . 11 ALA C 1 1
4 1115 1 1 12 ALA CA C 23.295 5.541 5.411 1.00 . A A . 11 ALA CA 1 1
4 1116 1 1 12 ALA CB C 23.866 6.461 4.332 1.00 . A A . 11 ALA CB 1 1
4 1117 1 1 12 ALA H H 21.757 5.035 4.039 1.00 . A A . 11 ALA H 1 1
4 1118 1 1 12 ALA HA H 24.005 4.752 5.601 1.00 . A A . 11 ALA HA 1 1
4 1119 1 1 12 ALA HB1 H 23.242 7.338 4.238 1.00 . A A . 11 ALA HB1 1 1
4 1120 1 1 12 ALA HB2 H 23.897 5.936 3.389 1.00 . A A . 11 ALA HB2 1 1
4 1121 1 1 12 ALA HB3 H 24.867 6.761 4.608 1.00 . A A . 11 ALA HB3 1 1
4 1122 1 1 12 ALA N N 22.042 4.942 4.962 1.00 . A A . 11 ALA N 1 1
4 1123 1 1 12 ALA O O 24.010 6.460 7.506 1.00 . A A . 11 ALA O 1 1
4 1124 1 1 13 LEU C C 21.568 6.700 9.299 1.00 . A A . 12 LEU C 1 1
4 1125 1 1 13 LEU CA C 21.594 7.619 8.089 1.00 . A A . 12 LEU CA 1 1
4 1126 1 1 13 LEU CB C 20.253 8.344 7.946 1.00 . A A . 12 LEU CB 1 1
4 1127 1 1 13 LEU CD1 C 18.845 9.751 6.437 1.00 . A A . 12 LEU CD1 1 1
4 1128 1 1 13 LEU CD2 C 21.337 9.834 6.254 1.00 . A A . 12 LEU CD2 1 1
4 1129 1 1 13 LEU CG C 20.131 8.930 6.538 1.00 . A A . 12 LEU CG 1 1
4 1130 1 1 13 LEU H H 21.188 6.718 6.219 1.00 . A A . 12 LEU H 1 1
4 1131 1 1 13 LEU HA H 22.374 8.348 8.230 1.00 . A A . 12 LEU HA 1 1
4 1132 1 1 13 LEU HB2 H 19.445 7.645 8.116 1.00 . A A . 12 LEU HB2 1 1
4 1133 1 1 13 LEU HB3 H 20.196 9.143 8.669 1.00 . A A . 12 LEU HB3 1 1
4 1134 1 1 13 LEU HD11 H 17.994 9.108 6.604 1.00 . A A . 12 LEU HD11 1 1
4 1135 1 1 13 LEU HD12 H 18.775 10.190 5.452 1.00 . A A . 12 LEU HD12 1 1
4 1136 1 1 13 LEU HD13 H 18.857 10.533 7.180 1.00 . A A . 12 LEU HD13 1 1
4 1137 1 1 13 LEU HD21 H 21.131 10.448 5.390 1.00 . A A . 12 LEU HD21 1 1
4 1138 1 1 13 LEU HD22 H 22.206 9.224 6.061 1.00 . A A . 12 LEU HD22 1 1
4 1139 1 1 13 LEU HD23 H 21.523 10.467 7.110 1.00 . A A . 12 LEU HD23 1 1
4 1140 1 1 13 LEU HG H 20.101 8.124 5.816 1.00 . A A . 12 LEU HG 1 1
4 1141 1 1 13 LEU N N 21.886 6.851 6.890 1.00 . A A . 12 LEU N 1 1
4 1142 1 1 13 LEU O O 22.394 6.828 10.202 1.00 . A A . 12 LEU O 1 1
4 1143 1 1 14 ALA C C 21.832 4.065 10.543 1.00 . A A . 13 ALA C 1 1
4 1144 1 1 14 ALA CA C 20.529 4.847 10.434 1.00 . A A . 13 ALA CA 1 1
4 1145 1 1 14 ALA CB C 19.339 3.895 10.253 1.00 . A A . 13 ALA CB 1 1
4 1146 1 1 14 ALA H H 19.988 5.704 8.572 1.00 . A A . 13 ALA H 1 1
4 1147 1 1 14 ALA HA H 20.391 5.417 11.340 1.00 . A A . 13 ALA HA 1 1
4 1148 1 1 14 ALA HB1 H 18.433 4.390 10.571 1.00 . A A . 13 ALA HB1 1 1
4 1149 1 1 14 ALA HB2 H 19.487 3.004 10.850 1.00 . A A . 13 ALA HB2 1 1
4 1150 1 1 14 ALA HB3 H 19.252 3.622 9.216 1.00 . A A . 13 ALA HB3 1 1
4 1151 1 1 14 ALA N N 20.622 5.769 9.316 1.00 . A A . 13 ALA N 1 1
4 1152 1 1 14 ALA O O 22.263 3.710 11.636 1.00 . A A . 13 ALA O 1 1
4 1153 1 1 15 LEU C C 24.688 3.772 10.348 1.00 . A A . 14 LEU C 1 1
4 1154 1 1 15 LEU CA C 23.719 3.067 9.418 1.00 . A A . 14 LEU CA 1 1
4 1155 1 1 15 LEU CB C 24.288 2.972 7.990 1.00 . A A . 14 LEU CB 1 1
4 1156 1 1 15 LEU CD1 C 25.444 1.267 6.499 1.00 . A A . 14 LEU CD1 1 1
4 1157 1 1 15 LEU CD2 C 26.803 2.577 8.117 1.00 . A A . 14 LEU CD2 1 1
4 1158 1 1 15 LEU CG C 25.433 1.913 7.891 1.00 . A A . 14 LEU CG 1 1
4 1159 1 1 15 LEU H H 22.092 4.105 8.546 1.00 . A A . 14 LEU H 1 1
4 1160 1 1 15 LEU HA H 23.534 2.083 9.802 1.00 . A A . 14 LEU HA 1 1
4 1161 1 1 15 LEU HB2 H 23.479 2.700 7.323 1.00 . A A . 14 LEU HB2 1 1
4 1162 1 1 15 LEU HB3 H 24.663 3.943 7.698 1.00 . A A . 14 LEU HB3 1 1
4 1163 1 1 15 LEU HD11 H 24.518 0.735 6.342 1.00 . A A . 14 LEU HD11 1 1
4 1164 1 1 15 LEU HD12 H 26.272 0.577 6.429 1.00 . A A . 14 LEU HD12 1 1
4 1165 1 1 15 LEU HD13 H 25.552 2.034 5.747 1.00 . A A . 14 LEU HD13 1 1
4 1166 1 1 15 LEU HD21 H 27.581 1.831 8.033 1.00 . A A . 14 LEU HD21 1 1
4 1167 1 1 15 LEU HD22 H 26.837 3.019 9.098 1.00 . A A . 14 LEU HD22 1 1
4 1168 1 1 15 LEU HD23 H 26.959 3.342 7.372 1.00 . A A . 14 LEU HD23 1 1
4 1169 1 1 15 LEU HG H 25.282 1.137 8.626 1.00 . A A . 14 LEU HG 1 1
4 1170 1 1 15 LEU N N 22.466 3.801 9.403 1.00 . A A . 14 LEU N 1 1
4 1171 1 1 15 LEU O O 25.306 3.144 11.206 1.00 . A A . 14 LEU O 1 1
4 1172 1 1 16 ALA C C 25.314 5.651 12.492 1.00 . A A . 15 ALA C 1 1
4 1173 1 1 16 ALA CA C 25.704 5.849 11.032 1.00 . A A . 15 ALA CA 1 1
4 1174 1 1 16 ALA CB C 25.629 7.333 10.671 1.00 . A A . 15 ALA CB 1 1
4 1175 1 1 16 ALA H H 24.286 5.540 9.488 1.00 . A A . 15 ALA H 1 1
4 1176 1 1 16 ALA HA H 26.716 5.501 10.884 1.00 . A A . 15 ALA HA 1 1
4 1177 1 1 16 ALA HB1 H 26.414 7.869 11.183 1.00 . A A . 15 ALA HB1 1 1
4 1178 1 1 16 ALA HB2 H 24.669 7.728 10.970 1.00 . A A . 15 ALA HB2 1 1
4 1179 1 1 16 ALA HB3 H 25.749 7.451 9.604 1.00 . A A . 15 ALA HB3 1 1
4 1180 1 1 16 ALA N N 24.810 5.081 10.185 1.00 . A A . 15 ALA N 1 1
4 1181 1 1 16 ALA O O 26.138 5.795 13.395 1.00 . A A . 15 ALA O 1 1
4 1182 1 1 17 LEU C C 24.024 3.801 14.674 1.00 . A A . 16 LEU C 1 1
4 1183 1 1 17 LEU CA C 23.530 5.115 14.059 1.00 . A A . 16 LEU CA 1 1
4 1184 1 1 17 LEU CB C 21.984 5.152 14.046 1.00 . A A . 16 LEU CB 1 1
4 1185 1 1 17 LEU CD1 C 19.902 5.570 15.373 1.00 . A A . 16 LEU CD1 1 1
4 1186 1 1 17 LEU CD2 C 21.958 4.722 16.523 1.00 . A A . 16 LEU CD2 1 1
4 1187 1 1 17 LEU CG C 21.431 5.629 15.401 1.00 . A A . 16 LEU CG 1 1
4 1188 1 1 17 LEU H H 23.432 5.231 11.952 1.00 . A A . 16 LEU H 1 1
4 1189 1 1 17 LEU HA H 23.881 5.922 14.671 1.00 . A A . 16 LEU HA 1 1
4 1190 1 1 17 LEU HB2 H 21.656 5.831 13.275 1.00 . A A . 16 LEU HB2 1 1
4 1191 1 1 17 LEU HB3 H 21.599 4.166 13.834 1.00 . A A . 16 LEU HB3 1 1
4 1192 1 1 17 LEU HD11 H 19.510 5.952 16.303 1.00 . A A . 16 LEU HD11 1 1
4 1193 1 1 17 LEU HD12 H 19.584 4.545 15.243 1.00 . A A . 16 LEU HD12 1 1
4 1194 1 1 17 LEU HD13 H 19.534 6.168 14.553 1.00 . A A . 16 LEU HD13 1 1
4 1195 1 1 17 LEU HD21 H 21.913 3.690 16.208 1.00 . A A . 16 LEU HD21 1 1
4 1196 1 1 17 LEU HD22 H 21.354 4.854 17.410 1.00 . A A . 16 LEU HD22 1 1
4 1197 1 1 17 LEU HD23 H 22.981 4.986 16.748 1.00 . A A . 16 LEU HD23 1 1
4 1198 1 1 17 LEU HG H 21.746 6.649 15.576 1.00 . A A . 16 LEU HG 1 1
4 1199 1 1 17 LEU N N 24.040 5.326 12.711 1.00 . A A . 16 LEU N 1 1
4 1200 1 1 17 LEU O O 24.804 3.821 15.627 1.00 . A A . 16 LEU O 1 1
4 1201 1 1 18 TRP C C 25.424 1.000 14.313 1.00 . A A . 17 TRP C 1 1
4 1202 1 1 18 TRP CA C 23.999 1.372 14.701 1.00 . A A . 17 TRP CA 1 1
4 1203 1 1 18 TRP CB C 23.032 0.254 14.306 1.00 . A A . 17 TRP CB 1 1
4 1204 1 1 18 TRP CD1 C 21.855 1.024 12.205 1.00 . A A . 17 TRP CD1 1 1
4 1205 1 1 18 TRP CD2 C 23.357 -0.604 11.812 1.00 . A A . 17 TRP CD2 1 1
4 1206 1 1 18 TRP CE2 C 22.779 -0.277 10.566 1.00 . A A . 17 TRP CE2 1 1
4 1207 1 1 18 TRP CE3 C 24.341 -1.609 11.841 1.00 . A A . 17 TRP CE3 1 1
4 1208 1 1 18 TRP CG C 22.755 0.237 12.838 1.00 . A A . 17 TRP CG 1 1
4 1209 1 1 18 TRP CH2 C 24.138 -1.916 9.434 1.00 . A A . 17 TRP CH2 1 1
4 1210 1 1 18 TRP CZ2 C 23.158 -0.920 9.390 1.00 . A A . 17 TRP CZ2 1 1
4 1211 1 1 18 TRP CZ3 C 24.728 -2.260 10.658 1.00 . A A . 17 TRP CZ3 1 1
4 1212 1 1 18 TRP H H 22.945 2.678 13.393 1.00 . A A . 17 TRP H 1 1
4 1213 1 1 18 TRP HA H 23.971 1.456 15.778 1.00 . A A . 17 TRP HA 1 1
4 1214 1 1 18 TRP HB2 H 23.461 -0.690 14.581 1.00 . A A . 17 TRP HB2 1 1
4 1215 1 1 18 TRP HB3 H 22.106 0.393 14.841 1.00 . A A . 17 TRP HB3 1 1
4 1216 1 1 18 TRP HD1 H 21.228 1.768 12.676 1.00 . A A . 17 TRP HD1 1 1
4 1217 1 1 18 TRP HE1 H 21.310 1.145 10.173 1.00 . A A . 17 TRP HE1 1 1
4 1218 1 1 18 TRP HE3 H 24.803 -1.881 12.779 1.00 . A A . 17 TRP HE3 1 1
4 1219 1 1 18 TRP HH2 H 24.438 -2.419 8.527 1.00 . A A . 17 TRP HH2 1 1
4 1220 1 1 18 TRP HZ2 H 22.698 -0.648 8.451 1.00 . A A . 17 TRP HZ2 1 1
4 1221 1 1 18 TRP HZ3 H 25.485 -3.030 10.691 1.00 . A A . 17 TRP HZ3 1 1
4 1222 1 1 18 TRP N N 23.572 2.658 14.148 1.00 . A A . 17 TRP N 1 1
4 1223 1 1 18 TRP NE1 N 21.868 0.719 10.856 1.00 . A A . 17 TRP NE1 1 1
4 1224 1 1 18 TRP O O 26.182 0.497 15.143 1.00 . A A . 17 TRP O 1 1
4 1225 1 1 19 TRP C C 28.159 1.507 13.588 1.00 . A A . 18 TRP C 1 1
4 1226 1 1 19 TRP CA C 27.146 0.901 12.627 1.00 . A A . 18 TRP CA 1 1
4 1227 1 1 19 TRP CB C 27.401 1.439 11.215 1.00 . A A . 18 TRP CB 1 1
4 1228 1 1 19 TRP CD1 C 28.649 -0.485 10.153 1.00 . A A . 18 TRP CD1 1 1
4 1229 1 1 19 TRP CD2 C 29.949 1.327 10.445 1.00 . A A . 18 TRP CD2 1 1
4 1230 1 1 19 TRP CE2 C 30.761 0.335 9.849 1.00 . A A . 18 TRP CE2 1 1
4 1231 1 1 19 TRP CE3 C 30.531 2.574 10.736 1.00 . A A . 18 TRP CE3 1 1
4 1232 1 1 19 TRP CG C 28.610 0.780 10.628 1.00 . A A . 18 TRP CG 1 1
4 1233 1 1 19 TRP CH2 C 32.667 1.812 9.846 1.00 . A A . 18 TRP CH2 1 1
4 1234 1 1 19 TRP CZ2 C 32.102 0.569 9.551 1.00 . A A . 18 TRP CZ2 1 1
4 1235 1 1 19 TRP CZ3 C 31.883 2.814 10.438 1.00 . A A . 18 TRP CZ3 1 1
4 1236 1 1 19 TRP H H 25.157 1.635 12.442 1.00 . A A . 18 TRP H 1 1
4 1237 1 1 19 TRP HA H 27.257 -0.174 12.624 1.00 . A A . 18 TRP HA 1 1
4 1238 1 1 19 TRP HB2 H 26.545 1.235 10.595 1.00 . A A . 18 TRP HB2 1 1
4 1239 1 1 19 TRP HB3 H 27.565 2.507 11.261 1.00 . A A . 18 TRP HB3 1 1
4 1240 1 1 19 TRP HD1 H 27.819 -1.174 10.137 1.00 . A A . 18 TRP HD1 1 1
4 1241 1 1 19 TRP HE1 H 30.222 -1.596 9.295 1.00 . A A . 18 TRP HE1 1 1
4 1242 1 1 19 TRP HE3 H 29.935 3.352 11.192 1.00 . A A . 18 TRP HE3 1 1
4 1243 1 1 19 TRP HH2 H 33.705 2.003 9.619 1.00 . A A . 18 TRP HH2 1 1
4 1244 1 1 19 TRP HZ2 H 32.699 -0.207 9.096 1.00 . A A . 18 TRP HZ2 1 1
4 1245 1 1 19 TRP HZ3 H 32.320 3.775 10.665 1.00 . A A . 18 TRP HZ3 1 1
4 1246 1 1 19 TRP N N 25.793 1.236 13.067 1.00 . A A . 18 TRP N 1 1
4 1247 1 1 19 TRP NE1 N 29.925 -0.749 9.690 1.00 . A A . 18 TRP NE1 1 1
4 1248 1 1 19 TRP O O 29.029 0.814 14.116 1.00 . A A . 18 TRP O 1 1
4 1249 1 1 20 ALA C C 28.395 3.492 16.131 1.00 . A A . 19 ALA C 1 1
4 1250 1 1 20 ALA CA C 28.926 3.535 14.706 1.00 . A A . 19 ALA CA 1 1
4 1251 1 1 20 ALA CB C 29.070 4.989 14.250 1.00 . A A . 19 ALA CB 1 1
4 1252 1 1 20 ALA H H 27.314 3.298 13.354 1.00 . A A . 19 ALA H 1 1
4 1253 1 1 20 ALA HA H 29.893 3.069 14.687 1.00 . A A . 19 ALA HA 1 1
4 1254 1 1 20 ALA HB1 H 28.188 5.545 14.532 1.00 . A A . 19 ALA HB1 1 1
4 1255 1 1 20 ALA HB2 H 29.186 5.020 13.177 1.00 . A A . 19 ALA HB2 1 1
4 1256 1 1 20 ALA HB3 H 29.939 5.428 14.718 1.00 . A A . 19 ALA HB3 1 1
4 1257 1 1 20 ALA N N 28.030 2.813 13.807 1.00 . A A . 19 ALA N 1 1
4 1258 1 1 20 ALA O O 28.696 4.362 16.948 1.00 . A A . 19 ALA O 1 1
4 1259 1 1 21 ETA CA C 27.017 2.294 17.742 1.00 . A A . 20 ETA CA 1 1
4 1260 1 1 21 ETA CB C 26.516 3.631 18.300 1.00 . A A . 20 ETA CB 1 1
4 1261 1 1 21 ETA HA1 H 27.763 1.889 18.411 1.00 . A A . 20 ETA HA1 1 1
4 1262 1 1 21 ETA HA2 H 26.188 1.602 17.673 1.00 . A A . 20 ETA HA2 1 1
4 1263 1 1 21 ETA HB1 H 26.194 4.260 17.479 1.00 . A A . 20 ETA HB1 1 1
4 1264 1 1 21 ETA HB2 H 27.305 4.131 18.836 1.00 . A A . 20 ETA HB2 1 1
4 1265 1 1 21 ETA HN2 H 27.408 1.814 15.711 1.00 . A A . 20 ETA HN2 1 1
4 1266 1 1 21 ETA HO H 25.506 2.479 19.502 1.00 . A A . 20 ETA HO 1 1
4 1267 1 1 21 ETA N N 27.603 2.469 16.414 1.00 . A A . 20 ETA N 1 1
4 1268 1 1 21 ETA O O 25.436 3.385 19.194 1.00 . A A . 20 ETA O 1 1
5 1269 1 1 1 ACE C C 22.808 -5.670 -7.919 1.00 . A A . 0 ACE C 1 1
5 1270 1 1 1 ACE CH3 C 23.327 -6.524 -6.767 1.00 . A A . 0 ACE CH3 1 1
5 1271 1 1 1 ACE H1 H 22.769 -6.298 -5.871 1.00 . A A . 0 ACE H1 1 1
5 1272 1 1 1 ACE H2 H 24.374 -6.311 -6.604 1.00 . A A . 0 ACE H2 1 1
5 1273 1 1 1 ACE H3 H 23.207 -7.568 -7.012 1.00 . A A . 0 ACE H3 1 1
5 1274 1 1 1 ACE O O 23.070 -5.962 -9.086 1.00 . A A . 0 ACE O 1 1
5 1275 1 1 2 GLY C C 21.009 -2.461 -7.956 1.00 . A A . 1 GLY C 1 1
5 1276 1 1 2 GLY CA C 21.519 -3.733 -8.594 1.00 . A A . 1 GLY CA 1 1
5 1277 1 1 2 GLY H H 21.884 -4.423 -6.647 1.00 . A A . 1 GLY H 1 1
5 1278 1 1 2 GLY HA2 H 22.272 -3.492 -9.322 1.00 . A A . 1 GLY HA2 1 1
5 1279 1 1 2 GLY HA3 H 20.690 -4.231 -9.080 1.00 . A A . 1 GLY HA3 1 1
5 1280 1 1 2 GLY N N 22.069 -4.614 -7.587 1.00 . A A . 1 GLY N 1 1
5 1281 1 1 2 GLY O O 21.667 -1.839 -7.127 1.00 . A A . 1 GLY O 1 1
5 1282 1 1 3 TRP C C 18.761 -1.142 -6.379 1.00 . A A . 2 TRP C 1 1
5 1283 1 1 3 TRP CA C 19.188 -0.892 -7.824 1.00 . A A . 2 TRP CA 1 1
5 1284 1 1 3 TRP CB C 17.992 -0.449 -8.719 1.00 . A A . 2 TRP CB 1 1
5 1285 1 1 3 TRP CD1 C 17.311 -2.818 -8.815 1.00 . A A . 2 TRP CD1 1 1
5 1286 1 1 3 TRP CD2 C 16.895 -1.779 -10.749 1.00 . A A . 2 TRP CD2 1 1
5 1287 1 1 3 TRP CE2 C 16.474 -3.119 -10.914 1.00 . A A . 2 TRP CE2 1 1
5 1288 1 1 3 TRP CE3 C 16.741 -0.897 -11.833 1.00 . A A . 2 TRP CE3 1 1
5 1289 1 1 3 TRP CG C 17.422 -1.635 -9.400 1.00 . A A . 2 TRP CG 1 1
5 1290 1 1 3 TRP CH2 C 15.771 -2.683 -13.178 1.00 . A A . 2 TRP CH2 1 1
5 1291 1 1 3 TRP CZ2 C 15.920 -3.571 -12.108 1.00 . A A . 2 TRP CZ2 1 1
5 1292 1 1 3 TRP CZ3 C 16.181 -1.348 -13.040 1.00 . A A . 2 TRP CZ3 1 1
5 1293 1 1 3 TRP H H 19.372 -2.637 -9.003 1.00 . A A . 2 TRP H 1 1
5 1294 1 1 3 TRP HA H 19.915 -0.111 -7.807 1.00 . A A . 2 TRP HA 1 1
5 1295 1 1 3 TRP HB2 H 17.227 0.008 -8.114 1.00 . A A . 2 TRP HB2 1 1
5 1296 1 1 3 TRP HB3 H 18.334 0.257 -9.461 1.00 . A A . 2 TRP HB3 1 1
5 1297 1 1 3 TRP HD1 H 17.622 -3.015 -7.811 1.00 . A A . 2 TRP HD1 1 1
5 1298 1 1 3 TRP HE1 H 16.568 -4.656 -9.515 1.00 . A A . 2 TRP HE1 1 1
5 1299 1 1 3 TRP HE3 H 17.053 0.132 -11.736 1.00 . A A . 2 TRP HE3 1 1
5 1300 1 1 3 TRP HH2 H 15.342 -3.024 -14.108 1.00 . A A . 2 TRP HH2 1 1
5 1301 1 1 3 TRP HZ2 H 15.608 -4.600 -12.204 1.00 . A A . 2 TRP HZ2 1 1
5 1302 1 1 3 TRP HZ3 H 16.067 -0.663 -13.868 1.00 . A A . 2 TRP HZ3 1 1
5 1303 1 1 3 TRP N N 19.825 -2.090 -8.351 1.00 . A A . 2 TRP N 1 1
5 1304 1 1 3 TRP NE1 N 16.752 -3.716 -9.702 1.00 . A A . 2 TRP NE1 1 1
5 1305 1 1 3 TRP O O 18.047 -0.336 -5.783 1.00 . A A . 2 TRP O 1 1
5 1306 1 1 4 TRP C C 19.769 -1.829 -3.487 1.00 . A A . 3 TRP C 1 1
5 1307 1 1 4 TRP CA C 18.879 -2.614 -4.436 1.00 . A A . 3 TRP CA 1 1
5 1308 1 1 4 TRP CB C 19.050 -4.123 -4.171 1.00 . A A . 3 TRP CB 1 1
5 1309 1 1 4 TRP CD1 C 19.418 -5.855 -5.964 1.00 . A A . 3 TRP CD1 1 1
5 1310 1 1 4 TRP CD2 C 17.390 -4.906 -6.104 1.00 . A A . 3 TRP CD2 1 1
5 1311 1 1 4 TRP CE2 C 17.472 -5.852 -7.152 1.00 . A A . 3 TRP CE2 1 1
5 1312 1 1 4 TRP CE3 C 16.203 -4.167 -5.976 1.00 . A A . 3 TRP CE3 1 1
5 1313 1 1 4 TRP CG C 18.641 -4.929 -5.362 1.00 . A A . 3 TRP CG 1 1
5 1314 1 1 4 TRP CH2 C 15.246 -5.311 -7.893 1.00 . A A . 3 TRP CH2 1 1
5 1315 1 1 4 TRP CZ2 C 16.418 -6.058 -8.036 1.00 . A A . 3 TRP CZ2 1 1
5 1316 1 1 4 TRP CZ3 C 15.143 -4.367 -6.862 1.00 . A A . 3 TRP CZ3 1 1
5 1317 1 1 4 TRP H H 19.781 -2.873 -6.333 1.00 . A A . 3 TRP H 1 1
5 1318 1 1 4 TRP HA H 17.870 -2.340 -4.251 1.00 . A A . 3 TRP HA 1 1
5 1319 1 1 4 TRP HB2 H 20.081 -4.336 -3.949 1.00 . A A . 3 TRP HB2 1 1
5 1320 1 1 4 TRP HB3 H 18.440 -4.408 -3.322 1.00 . A A . 3 TRP HB3 1 1
5 1321 1 1 4 TRP HD1 H 20.415 -6.121 -5.663 1.00 . A A . 3 TRP HD1 1 1
5 1322 1 1 4 TRP HE1 H 19.067 -7.098 -7.625 1.00 . A A . 3 TRP HE1 1 1
5 1323 1 1 4 TRP HE3 H 16.105 -3.439 -5.195 1.00 . A A . 3 TRP HE3 1 1
5 1324 1 1 4 TRP HH2 H 14.422 -5.461 -8.575 1.00 . A A . 3 TRP HH2 1 1
5 1325 1 1 4 TRP HZ2 H 16.509 -6.788 -8.827 1.00 . A A . 3 TRP HZ2 1 1
5 1326 1 1 4 TRP HZ3 H 14.246 -3.787 -6.748 1.00 . A A . 3 TRP HZ3 1 1
5 1327 1 1 4 TRP N N 19.213 -2.271 -5.815 1.00 . A A . 3 TRP N 1 1
5 1328 1 1 4 TRP NE1 N 18.726 -6.404 -7.024 1.00 . A A . 3 TRP NE1 1 1
5 1329 1 1 4 TRP O O 19.291 -1.092 -2.627 1.00 . A A . 3 TRP O 1 1
5 1330 1 1 5 LEU C C 21.726 0.182 -2.865 1.00 . A A . 4 LEU C 1 1
5 1331 1 1 5 LEU CA C 22.032 -1.310 -2.830 1.00 . A A . 4 LEU CA 1 1
5 1332 1 1 5 LEU CB C 23.471 -1.579 -3.323 1.00 . A A . 4 LEU CB 1 1
5 1333 1 1 5 LEU CD1 C 23.603 -3.326 -5.207 1.00 . A A . 4 LEU CD1 1 1
5 1334 1 1 5 LEU CD2 C 25.039 -3.600 -3.198 1.00 . A A . 4 LEU CD2 1 1
5 1335 1 1 5 LEU CG C 23.670 -3.099 -3.690 1.00 . A A . 4 LEU CG 1 1
5 1336 1 1 5 LEU H H 21.382 -2.599 -4.365 1.00 . A A . 4 LEU H 1 1
5 1337 1 1 5 LEU HA H 21.934 -1.669 -1.817 1.00 . A A . 4 LEU HA 1 1
5 1338 1 1 5 LEU HB2 H 23.665 -0.952 -4.187 1.00 . A A . 4 LEU HB2 1 1
5 1339 1 1 5 LEU HB3 H 24.155 -1.301 -2.531 1.00 . A A . 4 LEU HB3 1 1
5 1340 1 1 5 LEU HD11 H 24.219 -2.601 -5.718 1.00 . A A . 4 LEU HD11 1 1
5 1341 1 1 5 LEU HD12 H 22.587 -3.227 -5.528 1.00 . A A . 4 LEU HD12 1 1
5 1342 1 1 5 LEU HD13 H 23.951 -4.320 -5.441 1.00 . A A . 4 LEU HD13 1 1
5 1343 1 1 5 LEU HD21 H 25.812 -2.930 -3.542 1.00 . A A . 4 LEU HD21 1 1
5 1344 1 1 5 LEU HD22 H 25.218 -4.590 -3.592 1.00 . A A . 4 LEU HD22 1 1
5 1345 1 1 5 LEU HD23 H 25.044 -3.636 -2.119 1.00 . A A . 4 LEU HD23 1 1
5 1346 1 1 5 LEU HG H 22.889 -3.696 -3.230 1.00 . A A . 4 LEU HG 1 1
5 1347 1 1 5 LEU N N 21.070 -2.000 -3.662 1.00 . A A . 4 LEU N 1 1
5 1348 1 1 5 LEU O O 22.015 0.918 -1.924 1.00 . A A . 4 LEU O 1 1
5 1349 1 1 6 ALA C C 19.966 2.516 -2.965 1.00 . A A . 5 ALA C 1 1
5 1350 1 1 6 ALA CA C 20.766 2.007 -4.163 1.00 . A A . 5 ALA CA 1 1
5 1351 1 1 6 ALA CB C 19.921 2.145 -5.432 1.00 . A A . 5 ALA CB 1 1
5 1352 1 1 6 ALA H H 20.926 -0.036 -4.684 1.00 . A A . 5 ALA H 1 1
5 1353 1 1 6 ALA HA H 21.660 2.598 -4.274 1.00 . A A . 5 ALA HA 1 1
5 1354 1 1 6 ALA HB1 H 20.367 1.565 -6.227 1.00 . A A . 5 ALA HB1 1 1
5 1355 1 1 6 ALA HB2 H 19.876 3.183 -5.726 1.00 . A A . 5 ALA HB2 1 1
5 1356 1 1 6 ALA HB3 H 18.919 1.781 -5.242 1.00 . A A . 5 ALA HB3 1 1
5 1357 1 1 6 ALA N N 21.129 0.609 -3.974 1.00 . A A . 5 ALA N 1 1
5 1358 1 1 6 ALA O O 19.710 3.714 -2.841 1.00 . A A . 5 ALA O 1 1
5 1359 1 1 7 LEU C C 19.716 2.261 0.283 1.00 . A A . 6 LEU C 1 1
5 1360 1 1 7 LEU CA C 18.799 1.941 -0.898 1.00 . A A . 6 LEU CA 1 1
5 1361 1 1 7 LEU CB C 17.886 0.770 -0.525 1.00 . A A . 6 LEU CB 1 1
5 1362 1 1 7 LEU CD1 C 16.422 -1.009 -1.527 1.00 . A A . 6 LEU CD1 1 1
5 1363 1 1 7 LEU CD2 C 15.769 1.384 -1.765 1.00 . A A . 6 LEU CD2 1 1
5 1364 1 1 7 LEU CG C 16.959 0.413 -1.704 1.00 . A A . 6 LEU CG 1 1
5 1365 1 1 7 LEU H H 19.800 0.662 -2.236 1.00 . A A . 6 LEU H 1 1
5 1366 1 1 7 LEU HA H 18.187 2.799 -1.106 1.00 . A A . 6 LEU HA 1 1
5 1367 1 1 7 LEU HB2 H 18.503 -0.086 -0.276 1.00 . A A . 6 LEU HB2 1 1
5 1368 1 1 7 LEU HB3 H 17.294 1.042 0.330 1.00 . A A . 6 LEU HB3 1 1
5 1369 1 1 7 LEU HD11 H 17.248 -1.704 -1.484 1.00 . A A . 6 LEU HD11 1 1
5 1370 1 1 7 LEU HD12 H 15.785 -1.260 -2.362 1.00 . A A . 6 LEU HD12 1 1
5 1371 1 1 7 LEU HD13 H 15.854 -1.068 -0.611 1.00 . A A . 6 LEU HD13 1 1
5 1372 1 1 7 LEU HD21 H 15.050 1.020 -2.485 1.00 . A A . 6 LEU HD21 1 1
5 1373 1 1 7 LEU HD22 H 16.110 2.362 -2.067 1.00 . A A . 6 LEU HD22 1 1
5 1374 1 1 7 LEU HD23 H 15.298 1.449 -0.796 1.00 . A A . 6 LEU HD23 1 1
5 1375 1 1 7 LEU HG H 17.518 0.465 -2.629 1.00 . A A . 6 LEU HG 1 1
5 1376 1 1 7 LEU N N 19.571 1.596 -2.086 1.00 . A A . 6 LEU N 1 1
5 1377 1 1 7 LEU O O 19.342 3.018 1.180 1.00 . A A . 6 LEU O 1 1
5 1378 1 1 8 ALA C C 22.149 3.425 1.522 1.00 . A A . 7 ALA C 1 1
5 1379 1 1 8 ALA CA C 21.863 1.920 1.370 1.00 . A A . 7 ALA CA 1 1
5 1380 1 1 8 ALA CB C 23.168 1.104 1.123 1.00 . A A . 7 ALA CB 1 1
5 1381 1 1 8 ALA H H 21.164 1.087 -0.452 1.00 . A A . 7 ALA H 1 1
5 1382 1 1 8 ALA HA H 21.407 1.578 2.291 1.00 . A A . 7 ALA HA 1 1
5 1383 1 1 8 ALA HB1 H 23.253 0.302 1.849 1.00 . A A . 7 ALA HB1 1 1
5 1384 1 1 8 ALA HB2 H 24.041 1.740 1.202 1.00 . A A . 7 ALA HB2 1 1
5 1385 1 1 8 ALA HB3 H 23.134 0.677 0.133 1.00 . A A . 7 ALA HB3 1 1
5 1386 1 1 8 ALA N N 20.915 1.682 0.285 1.00 . A A . 7 ALA N 1 1
5 1387 1 1 8 ALA O O 21.990 3.977 2.610 1.00 . A A . 7 ALA O 1 1
5 1388 1 1 9 PRO C C 21.834 6.333 1.351 1.00 . A A . 8 PRO C 1 1
5 1389 1 1 9 PRO CA C 22.863 5.558 0.525 1.00 . A A . 8 PRO CA 1 1
5 1390 1 1 9 PRO CB C 22.808 5.963 -0.948 1.00 . A A . 8 PRO CB 1 1
5 1391 1 1 9 PRO CD C 22.790 3.551 -0.883 1.00 . A A . 8 PRO CD 1 1
5 1392 1 1 9 PRO CG C 23.312 4.761 -1.675 1.00 . A A . 8 PRO CG 1 1
5 1393 1 1 9 PRO HA H 23.855 5.727 0.895 1.00 . A A . 8 PRO HA 1 1
5 1394 1 1 9 PRO HB2 H 21.783 6.187 -1.239 1.00 . A A . 8 PRO HB2 1 1
5 1395 1 1 9 PRO HB3 H 23.446 6.802 -1.138 1.00 . A A . 8 PRO HB3 1 1
5 1396 1 1 9 PRO HD2 H 21.867 3.193 -1.316 1.00 . A A . 8 PRO HD2 1 1
5 1397 1 1 9 PRO HD3 H 23.526 2.767 -0.845 1.00 . A A . 8 PRO HD3 1 1
5 1398 1 1 9 PRO HG2 H 22.928 4.755 -2.693 1.00 . A A . 8 PRO HG2 1 1
5 1399 1 1 9 PRO HG3 H 24.391 4.747 -1.681 1.00 . A A . 8 PRO HG3 1 1
5 1400 1 1 9 PRO N N 22.561 4.094 0.471 1.00 . A A . 8 PRO N 1 1
5 1401 1 1 9 PRO O O 22.186 7.101 2.246 1.00 . A A . 8 PRO O 1 1
5 1402 1 1 10 ALA C C 19.364 6.283 3.173 1.00 . A A . 9 ALA C 1 1
5 1403 1 1 10 ALA CA C 19.484 6.793 1.739 1.00 . A A . 9 ALA CA 1 1
5 1404 1 1 10 ALA CB C 18.163 6.567 1.002 1.00 . A A . 9 ALA CB 1 1
5 1405 1 1 10 ALA H H 20.360 5.497 0.309 1.00 . A A . 9 ALA H 1 1
5 1406 1 1 10 ALA HA H 19.688 7.850 1.759 1.00 . A A . 9 ALA HA 1 1
5 1407 1 1 10 ALA HB1 H 18.290 6.798 -0.045 1.00 . A A . 9 ALA HB1 1 1
5 1408 1 1 10 ALA HB2 H 17.402 7.209 1.423 1.00 . A A . 9 ALA HB2 1 1
5 1409 1 1 10 ALA HB3 H 17.863 5.535 1.110 1.00 . A A . 9 ALA HB3 1 1
5 1410 1 1 10 ALA N N 20.569 6.119 1.034 1.00 . A A . 9 ALA N 1 1
5 1411 1 1 10 ALA O O 18.932 7.013 4.065 1.00 . A A . 9 ALA O 1 1
5 1412 1 1 11 LEU C C 20.986 4.704 5.445 1.00 . A A . 10 LEU C 1 1
5 1413 1 1 11 LEU CA C 19.687 4.405 4.707 1.00 . A A . 10 LEU CA 1 1
5 1414 1 1 11 LEU CB C 19.402 2.880 4.496 1.00 . A A . 10 LEU CB 1 1
5 1415 1 1 11 LEU CD1 C 19.655 2.136 6.916 1.00 . A A . 10 LEU CD1 1 1
5 1416 1 1 11 LEU CD2 C 19.985 0.510 5.007 1.00 . A A . 10 LEU CD2 1 1
5 1417 1 1 11 LEU CG C 20.175 1.968 5.465 1.00 . A A . 10 LEU CG 1 1
5 1418 1 1 11 LEU H H 20.083 4.487 2.649 1.00 . A A . 10 LEU H 1 1
5 1419 1 1 11 LEU HA H 18.891 4.846 5.257 1.00 . A A . 10 LEU HA 1 1
5 1420 1 1 11 LEU HB2 H 18.346 2.690 4.623 1.00 . A A . 10 LEU HB2 1 1
5 1421 1 1 11 LEU HB3 H 19.672 2.618 3.481 1.00 . A A . 10 LEU HB3 1 1
5 1422 1 1 11 LEU HD11 H 19.270 3.139 7.059 1.00 . A A . 10 LEU HD11 1 1
5 1423 1 1 11 LEU HD12 H 20.465 1.969 7.605 1.00 . A A . 10 LEU HD12 1 1
5 1424 1 1 11 LEU HD13 H 18.864 1.422 7.120 1.00 . A A . 10 LEU HD13 1 1
5 1425 1 1 11 LEU HD21 H 18.935 0.318 4.842 1.00 . A A . 10 LEU HD21 1 1
5 1426 1 1 11 LEU HD22 H 20.357 -0.158 5.768 1.00 . A A . 10 LEU HD22 1 1
5 1427 1 1 11 LEU HD23 H 20.530 0.348 4.088 1.00 . A A . 10 LEU HD23 1 1
5 1428 1 1 11 LEU HG H 21.226 2.212 5.421 1.00 . A A . 10 LEU HG 1 1
5 1429 1 1 11 LEU N N 19.748 5.023 3.390 1.00 . A A . 10 LEU N 1 1
5 1430 1 1 11 LEU O O 21.128 4.480 6.646 1.00 . A A . 10 LEU O 1 1
5 1431 1 1 12 ALA C C 23.097 6.337 6.525 1.00 . A A . 11 ALA C 1 1
5 1432 1 1 12 ALA CA C 23.234 5.561 5.222 1.00 . A A . 11 ALA CA 1 1
5 1433 1 1 12 ALA CB C 24.009 6.399 4.203 1.00 . A A . 11 ALA CB 1 1
5 1434 1 1 12 ALA H H 21.718 5.355 3.752 1.00 . A A . 11 ALA H 1 1
5 1435 1 1 12 ALA HA H 23.784 4.654 5.413 1.00 . A A . 11 ALA HA 1 1
5 1436 1 1 12 ALA HB1 H 25.038 6.486 4.519 1.00 . A A . 11 ALA HB1 1 1
5 1437 1 1 12 ALA HB2 H 23.569 7.381 4.135 1.00 . A A . 11 ALA HB2 1 1
5 1438 1 1 12 ALA HB3 H 23.969 5.918 3.237 1.00 . A A . 11 ALA HB3 1 1
5 1439 1 1 12 ALA N N 21.921 5.213 4.691 1.00 . A A . 11 ALA N 1 1
5 1440 1 1 12 ALA O O 24.050 6.445 7.296 1.00 . A A . 11 ALA O 1 1
5 1441 1 1 13 LEU C C 21.622 6.689 9.177 1.00 . A A . 12 LEU C 1 1
5 1442 1 1 13 LEU CA C 21.670 7.634 7.985 1.00 . A A . 12 LEU CA 1 1
5 1443 1 1 13 LEU CB C 20.354 8.418 7.878 1.00 . A A . 12 LEU CB 1 1
5 1444 1 1 13 LEU CD1 C 21.168 9.238 5.649 1.00 . A A . 12 LEU CD1 1 1
5 1445 1 1 13 LEU CD2 C 19.187 10.309 6.741 1.00 . A A . 12 LEU CD2 1 1
5 1446 1 1 13 LEU CG C 20.548 9.651 6.988 1.00 . A A . 12 LEU CG 1 1
5 1447 1 1 13 LEU H H 21.182 6.759 6.123 1.00 . A A . 12 LEU H 1 1
5 1448 1 1 13 LEU HA H 22.482 8.325 8.126 1.00 . A A . 12 LEU HA 1 1
5 1449 1 1 13 LEU HB2 H 19.594 7.782 7.448 1.00 . A A . 12 LEU HB2 1 1
5 1450 1 1 13 LEU HB3 H 20.041 8.736 8.861 1.00 . A A . 12 LEU HB3 1 1
5 1451 1 1 13 LEU HD11 H 21.036 10.031 4.927 1.00 . A A . 12 LEU HD11 1 1
5 1452 1 1 13 LEU HD12 H 20.688 8.341 5.289 1.00 . A A . 12 LEU HD12 1 1
5 1453 1 1 13 LEU HD13 H 22.224 9.050 5.785 1.00 . A A . 12 LEU HD13 1 1
5 1454 1 1 13 LEU HD21 H 18.705 10.508 7.687 1.00 . A A . 12 LEU HD21 1 1
5 1455 1 1 13 LEU HD22 H 18.568 9.648 6.154 1.00 . A A . 12 LEU HD22 1 1
5 1456 1 1 13 LEU HD23 H 19.328 11.238 6.207 1.00 . A A . 12 LEU HD23 1 1
5 1457 1 1 13 LEU HG H 21.205 10.351 7.486 1.00 . A A . 12 LEU HG 1 1
5 1458 1 1 13 LEU N N 21.907 6.875 6.768 1.00 . A A . 12 LEU N 1 1
5 1459 1 1 13 LEU O O 22.482 6.747 10.057 1.00 . A A . 12 LEU O 1 1
5 1460 1 1 14 ALA C C 21.782 4.054 10.395 1.00 . A A . 13 ALA C 1 1
5 1461 1 1 14 ALA CA C 20.506 4.874 10.307 1.00 . A A . 13 ALA CA 1 1
5 1462 1 1 14 ALA CB C 19.303 3.948 10.113 1.00 . A A . 13 ALA CB 1 1
5 1463 1 1 14 ALA H H 19.962 5.804 8.480 1.00 . A A . 13 ALA H 1 1
5 1464 1 1 14 ALA HA H 20.382 5.426 11.225 1.00 . A A . 13 ALA HA 1 1
5 1465 1 1 14 ALA HB1 H 19.542 3.191 9.381 1.00 . A A . 13 ALA HB1 1 1
5 1466 1 1 14 ALA HB2 H 18.456 4.524 9.772 1.00 . A A . 13 ALA HB2 1 1
5 1467 1 1 14 ALA HB3 H 19.064 3.474 11.055 1.00 . A A . 13 ALA HB3 1 1
5 1468 1 1 14 ALA N N 20.622 5.815 9.205 1.00 . A A . 13 ALA N 1 1
5 1469 1 1 14 ALA O O 22.228 3.694 11.481 1.00 . A A . 13 ALA O 1 1
5 1470 1 1 15 LEU C C 24.612 3.631 10.152 1.00 . A A . 14 LEU C 1 1
5 1471 1 1 15 LEU CA C 23.602 2.984 9.222 1.00 . A A . 14 LEU CA 1 1
5 1472 1 1 15 LEU CB C 24.144 2.896 7.782 1.00 . A A . 14 LEU CB 1 1
5 1473 1 1 15 LEU CD1 C 25.262 1.198 6.257 1.00 . A A . 14 LEU CD1 1 1
5 1474 1 1 15 LEU CD2 C 26.655 2.460 7.886 1.00 . A A . 14 LEU CD2 1 1
5 1475 1 1 15 LEU CG C 25.272 1.823 7.658 1.00 . A A . 14 LEU CG 1 1
5 1476 1 1 15 LEU H H 21.981 4.072 8.395 1.00 . A A . 14 LEU H 1 1
5 1477 1 1 15 LEU HA H 23.388 2.000 9.588 1.00 . A A . 14 LEU HA 1 1
5 1478 1 1 15 LEU HB2 H 23.319 2.639 7.127 1.00 . A A . 14 LEU HB2 1 1
5 1479 1 1 15 LEU HB3 H 24.527 3.864 7.492 1.00 . A A . 14 LEU HB3 1 1
5 1480 1 1 15 LEU HD11 H 26.149 0.597 6.124 1.00 . A A . 14 LEU HD11 1 1
5 1481 1 1 15 LEU HD12 H 25.244 1.981 5.513 1.00 . A A . 14 LEU HD12 1 1
5 1482 1 1 15 LEU HD13 H 24.386 0.576 6.147 1.00 . A A . 14 LEU HD13 1 1
5 1483 1 1 15 LEU HD21 H 26.782 3.295 7.212 1.00 . A A . 14 LEU HD21 1 1
5 1484 1 1 15 LEU HD22 H 27.423 1.727 7.694 1.00 . A A . 14 LEU HD22 1 1
5 1485 1 1 15 LEU HD23 H 26.734 2.803 8.903 1.00 . A A . 14 LEU HD23 1 1
5 1486 1 1 15 LEU HG H 25.113 1.037 8.383 1.00 . A A . 14 LEU HG 1 1
5 1487 1 1 15 LEU N N 22.374 3.760 9.242 1.00 . A A . 14 LEU N 1 1
5 1488 1 1 15 LEU O O 25.218 2.960 10.985 1.00 . A A . 14 LEU O 1 1
5 1489 1 1 16 ALA C C 25.332 5.443 12.327 1.00 . A A . 15 ALA C 1 1
5 1490 1 1 16 ALA CA C 25.721 5.647 10.866 1.00 . A A . 15 ALA CA 1 1
5 1491 1 1 16 ALA CB C 25.712 7.139 10.531 1.00 . A A . 15 ALA CB 1 1
5 1492 1 1 16 ALA H H 24.267 5.431 9.339 1.00 . A A . 15 ALA H 1 1
5 1493 1 1 16 ALA HA H 26.713 5.255 10.705 1.00 . A A . 15 ALA HA 1 1
5 1494 1 1 16 ALA HB1 H 26.381 7.662 11.197 1.00 . A A . 15 ALA HB1 1 1
5 1495 1 1 16 ALA HB2 H 24.711 7.528 10.646 1.00 . A A . 15 ALA HB2 1 1
5 1496 1 1 16 ALA HB3 H 26.038 7.281 9.511 1.00 . A A . 15 ALA HB3 1 1
5 1497 1 1 16 ALA N N 24.784 4.936 10.017 1.00 . A A . 15 ALA N 1 1
5 1498 1 1 16 ALA O O 26.168 5.535 13.225 1.00 . A A . 15 ALA O 1 1
5 1499 1 1 17 LEU C C 23.960 3.613 14.485 1.00 . A A . 16 LEU C 1 1
5 1500 1 1 17 LEU CA C 23.533 4.965 13.899 1.00 . A A . 16 LEU CA 1 1
5 1501 1 1 17 LEU CB C 21.994 5.087 13.902 1.00 . A A . 16 LEU CB 1 1
5 1502 1 1 17 LEU CD1 C 19.949 5.597 15.255 1.00 . A A . 16 LEU CD1 1 1
5 1503 1 1 17 LEU CD2 C 21.966 4.619 16.371 1.00 . A A . 16 LEU CD2 1 1
5 1504 1 1 17 LEU CG C 21.480 5.571 15.269 1.00 . A A . 16 LEU CG 1 1
5 1505 1 1 17 LEU H H 23.428 5.119 11.794 1.00 . A A . 16 LEU H 1 1
5 1506 1 1 17 LEU HA H 23.934 5.739 14.522 1.00 . A A . 16 LEU HA 1 1
5 1507 1 1 17 LEU HB2 H 21.695 5.796 13.144 1.00 . A A . 16 LEU HB2 1 1
5 1508 1 1 17 LEU HB3 H 21.551 4.127 13.678 1.00 . A A . 16 LEU HB3 1 1
5 1509 1 1 17 LEU HD11 H 19.587 5.927 16.218 1.00 . A A . 16 LEU HD11 1 1
5 1510 1 1 17 LEU HD12 H 19.574 4.604 15.052 1.00 . A A . 16 LEU HD12 1 1
5 1511 1 1 17 LEU HD13 H 19.607 6.275 14.489 1.00 . A A . 16 LEU HD13 1 1
5 1512 1 1 17 LEU HD21 H 21.860 3.596 16.040 1.00 . A A . 16 LEU HD21 1 1
5 1513 1 1 17 LEU HD22 H 21.379 4.769 17.266 1.00 . A A . 16 LEU HD22 1 1
5 1514 1 1 17 LEU HD23 H 23.004 4.821 16.588 1.00 . A A . 16 LEU HD23 1 1
5 1515 1 1 17 LEU HG H 21.851 6.569 15.457 1.00 . A A . 16 LEU HG 1 1
5 1516 1 1 17 LEU N N 24.046 5.174 12.550 1.00 . A A . 16 LEU N 1 1
5 1517 1 1 17 LEU O O 24.738 3.575 15.438 1.00 . A A . 16 LEU O 1 1
5 1518 1 1 18 TRP C C 25.220 0.755 14.073 1.00 . A A . 17 TRP C 1 1
5 1519 1 1 18 TRP CA C 23.814 1.190 14.466 1.00 . A A . 17 TRP CA 1 1
5 1520 1 1 18 TRP CB C 22.796 0.126 14.050 1.00 . A A . 17 TRP CB 1 1
5 1521 1 1 18 TRP CD1 C 21.654 0.950 11.950 1.00 . A A . 17 TRP CD1 1 1
5 1522 1 1 18 TRP CD2 C 23.123 -0.706 11.546 1.00 . A A . 17 TRP CD2 1 1
5 1523 1 1 18 TRP CE2 C 22.561 -0.349 10.300 1.00 . A A . 17 TRP CE2 1 1
5 1524 1 1 18 TRP CE3 C 24.085 -1.733 11.569 1.00 . A A . 17 TRP CE3 1 1
5 1525 1 1 18 TRP CG C 22.530 0.135 12.579 1.00 . A A . 17 TRP CG 1 1
5 1526 1 1 18 TRP CH2 C 23.892 -2.002 9.156 1.00 . A A . 17 TRP CH2 1 1
5 1527 1 1 18 TRP CZ2 C 22.936 -0.984 9.118 1.00 . A A . 17 TRP CZ2 1 1
5 1528 1 1 18 TRP CZ3 C 24.466 -2.376 10.380 1.00 . A A . 17 TRP CZ3 1 1
5 1529 1 1 18 TRP H H 22.828 2.572 13.182 1.00 . A A . 17 TRP H 1 1
5 1530 1 1 18 TRP HA H 23.788 1.255 15.545 1.00 . A A . 17 TRP HA 1 1
5 1531 1 1 18 TRP HB2 H 23.175 -0.840 14.319 1.00 . A A . 17 TRP HB2 1 1
5 1532 1 1 18 TRP HB3 H 21.874 0.307 14.579 1.00 . A A . 17 TRP HB3 1 1
5 1533 1 1 18 TRP HD1 H 21.040 1.700 12.426 1.00 . A A . 17 TRP HD1 1 1
5 1534 1 1 18 TRP HE1 H 21.128 1.110 9.915 1.00 . A A . 17 TRP HE1 1 1
5 1535 1 1 18 TRP HE3 H 24.532 -2.028 12.505 1.00 . A A . 17 TRP HE3 1 1
5 1536 1 1 18 TRP HH2 H 24.189 -2.500 8.245 1.00 . A A . 17 TRP HH2 1 1
5 1537 1 1 18 TRP HZ2 H 22.489 -0.690 8.181 1.00 . A A . 17 TRP HZ2 1 1
5 1538 1 1 18 TRP HZ3 H 25.204 -3.163 10.407 1.00 . A A . 17 TRP HZ3 1 1
5 1539 1 1 18 TRP N N 23.452 2.505 13.936 1.00 . A A . 17 TRP N 1 1
5 1540 1 1 18 TRP NE1 N 21.672 0.662 10.597 1.00 . A A . 17 TRP NE1 1 1
5 1541 1 1 18 TRP O O 25.951 0.202 14.896 1.00 . A A . 17 TRP O 1 1
5 1542 1 1 19 TRP C C 27.979 1.141 13.364 1.00 . A A . 18 TRP C 1 1
5 1543 1 1 19 TRP CA C 26.940 0.602 12.390 1.00 . A A . 18 TRP CA 1 1
5 1544 1 1 19 TRP CB C 27.228 1.151 10.989 1.00 . A A . 18 TRP CB 1 1
5 1545 1 1 19 TRP CD1 C 28.391 -0.817 9.909 1.00 . A A . 18 TRP CD1 1 1
5 1546 1 1 19 TRP CD2 C 29.768 0.933 10.220 1.00 . A A . 18 TRP CD2 1 1
5 1547 1 1 19 TRP CE2 C 30.537 -0.088 9.615 1.00 . A A . 18 TRP CE2 1 1
5 1548 1 1 19 TRP CE3 C 30.404 2.150 10.522 1.00 . A A . 18 TRP CE3 1 1
5 1549 1 1 19 TRP CG C 28.407 0.444 10.395 1.00 . A A . 18 TRP CG 1 1
5 1550 1 1 19 TRP CH2 C 32.505 1.305 9.626 1.00 . A A . 18 TRP CH2 1 1
5 1551 1 1 19 TRP CZ2 C 31.888 0.090 9.320 1.00 . A A . 18 TRP CZ2 1 1
5 1552 1 1 19 TRP CZ3 C 31.765 2.334 10.227 1.00 . A A . 18 TRP CZ3 1 1
5 1553 1 1 19 TRP H H 24.991 1.434 12.214 1.00 . A A . 18 TRP H 1 1
5 1554 1 1 19 TRP HA H 26.999 -0.477 12.370 1.00 . A A . 18 TRP HA 1 1
5 1555 1 1 19 TRP HB2 H 26.365 0.998 10.362 1.00 . A A . 18 TRP HB2 1 1
5 1556 1 1 19 TRP HB3 H 27.440 2.209 11.053 1.00 . A A . 18 TRP HB3 1 1
5 1557 1 1 19 TRP HD1 H 27.531 -1.469 9.887 1.00 . A A . 18 TRP HD1 1 1
5 1558 1 1 19 TRP HE1 H 29.914 -1.988 9.043 1.00 . A A . 18 TRP HE1 1 1
5 1559 1 1 19 TRP HE3 H 29.842 2.949 10.984 1.00 . A A . 18 TRP HE3 1 1
5 1560 1 1 19 TRP HH2 H 33.551 1.451 9.402 1.00 . A A . 18 TRP HH2 1 1
5 1561 1 1 19 TRP HZ2 H 32.450 -0.708 8.858 1.00 . A A . 18 TRP HZ2 1 1
5 1562 1 1 19 TRP HZ3 H 32.244 3.272 10.464 1.00 . A A . 18 TRP HZ3 1 1
5 1563 1 1 19 TRP N N 25.605 0.994 12.833 1.00 . A A . 18 TRP N 1 1
5 1564 1 1 19 TRP NE1 N 29.655 -1.133 9.445 1.00 . A A . 18 TRP NE1 1 1
5 1565 1 1 19 TRP O O 28.814 0.398 13.880 1.00 . A A . 18 TRP O 1 1
5 1566 1 1 20 ALA C C 28.326 3.032 15.949 1.00 . A A . 19 ALA C 1 1
5 1567 1 1 20 ALA CA C 28.841 3.107 14.520 1.00 . A A . 19 ALA CA 1 1
5 1568 1 1 20 ALA CB C 29.029 4.571 14.114 1.00 . A A . 19 ALA CB 1 1
5 1569 1 1 20 ALA H H 27.222 2.975 13.161 1.00 . A A . 19 ALA H 1 1
5 1570 1 1 20 ALA HA H 29.790 2.610 14.473 1.00 . A A . 19 ALA HA 1 1
5 1571 1 1 20 ALA HB1 H 29.911 4.968 14.594 1.00 . A A . 19 ALA HB1 1 1
5 1572 1 1 20 ALA HB2 H 28.165 5.143 14.419 1.00 . A A . 19 ALA HB2 1 1
5 1573 1 1 20 ALA HB3 H 29.142 4.635 13.042 1.00 . A A . 19 ALA HB3 1 1
5 1574 1 1 20 ALA N N 27.911 2.446 13.607 1.00 . A A . 19 ALA N 1 1
5 1575 1 1 20 ALA O O 28.685 3.846 16.799 1.00 . A A . 19 ALA O 1 1
5 1576 1 1 21 ETA CA C 26.895 1.835 17.525 1.00 . A A . 20 ETA CA 1 1
5 1577 1 1 21 ETA CB C 26.567 3.176 18.206 1.00 . A A . 20 ETA CB 1 1
5 1578 1 1 21 ETA HA1 H 27.594 1.287 18.139 1.00 . A A . 20 ETA HA1 1 1
5 1579 1 1 21 ETA HA2 H 25.987 1.253 17.418 1.00 . A A . 20 ETA HA2 1 1
5 1580 1 1 21 ETA HB1 H 27.432 3.521 18.766 1.00 . A A . 20 ETA HB1 1 1
5 1581 1 1 21 ETA HB2 H 25.741 3.054 18.883 1.00 . A A . 20 ETA HB2 1 1
5 1582 1 1 21 ETA HN2 H 27.240 1.434 15.468 1.00 . A A . 20 ETA HN2 1 1
5 1583 1 1 21 ETA HO H 26.737 4.914 17.346 1.00 . A A . 20 ETA HO 1 1
5 1584 1 1 21 ETA N N 27.479 2.042 16.197 1.00 . A A . 20 ETA N 1 1
5 1585 1 1 21 ETA O O 26.207 4.125 17.210 1.00 . A A . 20 ETA O 1 1
6 1586 1 1 1 ACE C C 21.189 -4.550 -10.796 1.00 . A A . 0 ACE C 1 1
6 1587 1 1 1 ACE CH3 C 21.432 -5.826 -9.998 1.00 . A A . 0 ACE CH3 1 1
6 1588 1 1 1 ACE H1 H 20.897 -5.773 -9.061 1.00 . A A . 0 ACE H1 1 1
6 1589 1 1 1 ACE H2 H 22.489 -5.937 -9.807 1.00 . A A . 0 ACE H2 1 1
6 1590 1 1 1 ACE H3 H 21.079 -6.676 -10.565 1.00 . A A . 0 ACE H3 1 1
6 1591 1 1 1 ACE O O 21.427 -4.508 -12.004 1.00 . A A . 0 ACE O 1 1
6 1592 1 1 2 GLY C C 20.218 -1.163 -9.736 1.00 . A A . 1 GLY C 1 1
6 1593 1 1 2 GLY CA C 20.441 -2.246 -10.768 1.00 . A A . 1 GLY CA 1 1
6 1594 1 1 2 GLY H H 20.537 -3.589 -9.160 1.00 . A A . 1 GLY H 1 1
6 1595 1 1 2 GLY HA2 H 21.266 -1.973 -11.400 1.00 . A A . 1 GLY HA2 1 1
6 1596 1 1 2 GLY HA3 H 19.543 -2.344 -11.363 1.00 . A A . 1 GLY HA3 1 1
6 1597 1 1 2 GLY N N 20.713 -3.509 -10.117 1.00 . A A . 1 GLY N 1 1
6 1598 1 1 2 GLY O O 20.963 -1.019 -8.772 1.00 . A A . 1 GLY O 1 1
6 1599 1 1 3 TRP C C 18.273 0.083 -7.748 1.00 . A A . 2 TRP C 1 1
6 1600 1 1 3 TRP CA C 18.820 0.673 -9.048 1.00 . A A . 2 TRP CA 1 1
6 1601 1 1 3 TRP CB C 17.811 1.654 -9.715 1.00 . A A . 2 TRP CB 1 1
6 1602 1 1 3 TRP CD1 C 16.590 -0.320 -10.550 1.00 . A A . 2 TRP CD1 1 1
6 1603 1 1 3 TRP CD2 C 16.531 1.352 -12.032 1.00 . A A . 2 TRP CD2 1 1
6 1604 1 1 3 TRP CE2 C 15.812 0.280 -12.608 1.00 . A A . 2 TRP CE2 1 1
6 1605 1 1 3 TRP CE3 C 16.647 2.544 -12.768 1.00 . A A . 2 TRP CE3 1 1
6 1606 1 1 3 TRP CG C 17.009 0.925 -10.725 1.00 . A A . 2 TRP CG 1 1
6 1607 1 1 3 TRP CH2 C 15.350 1.573 -14.588 1.00 . A A . 2 TRP CH2 1 1
6 1608 1 1 3 TRP CZ2 C 15.228 0.382 -13.866 1.00 . A A . 2 TRP CZ2 1 1
6 1609 1 1 3 TRP CZ3 C 16.059 2.653 -14.040 1.00 . A A . 2 TRP CZ3 1 1
6 1610 1 1 3 TRP H H 18.641 -0.591 -10.734 1.00 . A A . 2 TRP H 1 1
6 1611 1 1 3 TRP HA H 19.711 1.205 -8.801 1.00 . A A . 2 TRP HA 1 1
6 1612 1 1 3 TRP HB2 H 17.148 2.064 -8.971 1.00 . A A . 2 TRP HB2 1 1
6 1613 1 1 3 TRP HB3 H 18.348 2.457 -10.199 1.00 . A A . 2 TRP HB3 1 1
6 1614 1 1 3 TRP HD1 H 16.794 -0.897 -9.673 1.00 . A A . 2 TRP HD1 1 1
6 1615 1 1 3 TRP HE1 H 15.466 -1.599 -11.783 1.00 . A A . 2 TRP HE1 1 1
6 1616 1 1 3 TRP HE3 H 17.191 3.381 -12.354 1.00 . A A . 2 TRP HE3 1 1
6 1617 1 1 3 TRP HH2 H 14.899 1.662 -15.565 1.00 . A A . 2 TRP HH2 1 1
6 1618 1 1 3 TRP HZ2 H 14.684 -0.455 -14.281 1.00 . A A . 2 TRP HZ2 1 1
6 1619 1 1 3 TRP HZ3 H 16.152 3.573 -14.598 1.00 . A A . 2 TRP HZ3 1 1
6 1620 1 1 3 TRP N N 19.178 -0.409 -9.953 1.00 . A A . 2 TRP N 1 1
6 1621 1 1 3 TRP NE1 N 15.878 -0.723 -11.662 1.00 . A A . 2 TRP NE1 1 1
6 1622 1 1 3 TRP O O 17.741 0.803 -6.903 1.00 . A A . 2 TRP O 1 1
6 1623 1 1 4 TRP C C 18.943 -1.720 -5.264 1.00 . A A . 3 TRP C 1 1
6 1624 1 1 4 TRP CA C 17.940 -1.917 -6.390 1.00 . A A . 3 TRP CA 1 1
6 1625 1 1 4 TRP CB C 17.732 -3.425 -6.633 1.00 . A A . 3 TRP CB 1 1
6 1626 1 1 4 TRP CD1 C 17.766 -4.526 -8.900 1.00 . A A . 3 TRP CD1 1 1
6 1627 1 1 4 TRP CD2 C 16.033 -3.122 -8.663 1.00 . A A . 3 TRP CD2 1 1
6 1628 1 1 4 TRP CE2 C 15.940 -3.671 -9.963 1.00 . A A . 3 TRP CE2 1 1
6 1629 1 1 4 TRP CE3 C 15.051 -2.199 -8.267 1.00 . A A . 3 TRP CE3 1 1
6 1630 1 1 4 TRP CG C 17.203 -3.681 -8.007 1.00 . A A . 3 TRP CG 1 1
6 1631 1 1 4 TRP CH2 C 13.946 -2.401 -10.421 1.00 . A A . 3 TRP CH2 1 1
6 1632 1 1 4 TRP CZ2 C 14.913 -3.320 -10.834 1.00 . A A . 3 TRP CZ2 1 1
6 1633 1 1 4 TRP CZ3 C 14.020 -1.842 -9.138 1.00 . A A . 3 TRP CZ3 1 1
6 1634 1 1 4 TRP H H 18.850 -1.764 -8.294 1.00 . A A . 3 TRP H 1 1
6 1635 1 1 4 TRP HA H 17.018 -1.481 -6.095 1.00 . A A . 3 TRP HA 1 1
6 1636 1 1 4 TRP HB2 H 18.671 -3.941 -6.524 1.00 . A A . 3 TRP HB2 1 1
6 1637 1 1 4 TRP HB3 H 17.030 -3.811 -5.903 1.00 . A A . 3 TRP HB3 1 1
6 1638 1 1 4 TRP HD1 H 18.655 -5.107 -8.732 1.00 . A A . 3 TRP HD1 1 1
6 1639 1 1 4 TRP HE1 H 17.213 -5.046 -10.862 1.00 . A A . 3 TRP HE1 1 1
6 1640 1 1 4 TRP HE3 H 15.091 -1.758 -7.290 1.00 . A A . 3 TRP HE3 1 1
6 1641 1 1 4 TRP HH2 H 13.145 -2.119 -11.089 1.00 . A A . 3 TRP HH2 1 1
6 1642 1 1 4 TRP HZ2 H 14.865 -3.757 -11.820 1.00 . A A . 3 TRP HZ2 1 1
6 1643 1 1 4 TRP HZ3 H 13.283 -1.130 -8.815 1.00 . A A . 3 TRP HZ3 1 1
6 1644 1 1 4 TRP N N 18.416 -1.241 -7.593 1.00 . A A . 3 TRP N 1 1
6 1645 1 1 4 TRP NE1 N 17.017 -4.519 -10.059 1.00 . A A . 3 TRP NE1 1 1
6 1646 1 1 4 TRP O O 18.613 -1.202 -4.199 1.00 . A A . 3 TRP O 1 1
6 1647 1 1 5 LEU C C 21.293 -0.558 -4.083 1.00 . A A . 4 LEU C 1 1
6 1648 1 1 5 LEU CA C 21.227 -2.010 -4.540 1.00 . A A . 4 LEU CA 1 1
6 1649 1 1 5 LEU CB C 22.581 -2.453 -5.135 1.00 . A A . 4 LEU CB 1 1
6 1650 1 1 5 LEU CD1 C 22.387 -3.471 -7.489 1.00 . A A . 4 LEU CD1 1 1
6 1651 1 1 5 LEU CD2 C 23.601 -4.729 -5.723 1.00 . A A . 4 LEU CD2 1 1
6 1652 1 1 5 LEU CG C 22.424 -3.772 -5.985 1.00 . A A . 4 LEU CG 1 1
6 1653 1 1 5 LEU H H 20.366 -2.541 -6.390 1.00 . A A . 4 LEU H 1 1
6 1654 1 1 5 LEU HA H 20.990 -2.639 -3.695 1.00 . A A . 4 LEU HA 1 1
6 1655 1 1 5 LEU HB2 H 22.971 -1.649 -5.752 1.00 . A A . 4 LEU HB2 1 1
6 1656 1 1 5 LEU HB3 H 23.267 -2.626 -4.316 1.00 . A A . 4 LEU HB3 1 1
6 1657 1 1 5 LEU HD11 H 23.189 -2.797 -7.753 1.00 . A A . 4 LEU HD11 1 1
6 1658 1 1 5 LEU HD12 H 21.447 -3.023 -7.731 1.00 . A A . 4 LEU HD12 1 1
6 1659 1 1 5 LEU HD13 H 22.494 -4.389 -8.045 1.00 . A A . 4 LEU HD13 1 1
6 1660 1 1 5 LEU HD21 H 23.537 -5.112 -4.715 1.00 . A A . 4 LEU HD21 1 1
6 1661 1 1 5 LEU HD22 H 24.531 -4.198 -5.850 1.00 . A A . 4 LEU HD22 1 1
6 1662 1 1 5 LEU HD23 H 23.554 -5.549 -6.425 1.00 . A A . 4 LEU HD23 1 1
6 1663 1 1 5 LEU HG H 21.497 -4.271 -5.724 1.00 . A A . 4 LEU HG 1 1
6 1664 1 1 5 LEU N N 20.170 -2.140 -5.522 1.00 . A A . 4 LEU N 1 1
6 1665 1 1 5 LEU O O 21.705 -0.257 -2.965 1.00 . A A . 4 LEU O 1 1
6 1666 1 1 6 ALA C C 20.160 2.051 -3.373 1.00 . A A . 5 ALA C 1 1
6 1667 1 1 6 ALA CA C 20.869 1.763 -4.695 1.00 . A A . 5 ALA CA 1 1
6 1668 1 1 6 ALA CB C 20.146 2.500 -5.826 1.00 . A A . 5 ALA CB 1 1
6 1669 1 1 6 ALA H H 20.556 0.019 -5.849 1.00 . A A . 5 ALA H 1 1
6 1670 1 1 6 ALA HA H 21.884 2.121 -4.643 1.00 . A A . 5 ALA HA 1 1
6 1671 1 1 6 ALA HB1 H 20.480 2.114 -6.779 1.00 . A A . 5 ALA HB1 1 1
6 1672 1 1 6 ALA HB2 H 20.363 3.555 -5.769 1.00 . A A . 5 ALA HB2 1 1
6 1673 1 1 6 ALA HB3 H 19.078 2.346 -5.733 1.00 . A A . 5 ALA HB3 1 1
6 1674 1 1 6 ALA N N 20.873 0.333 -4.976 1.00 . A A . 5 ALA N 1 1
6 1675 1 1 6 ALA O O 20.226 3.165 -2.854 1.00 . A A . 5 ALA O 1 1
6 1676 1 1 7 LEU C C 19.684 0.963 -0.378 1.00 . A A . 6 LEU C 1 1
6 1677 1 1 7 LEU CA C 18.759 1.187 -1.576 1.00 . A A . 6 LEU CA 1 1
6 1678 1 1 7 LEU CB C 17.609 0.177 -1.528 1.00 . A A . 6 LEU CB 1 1
6 1679 1 1 7 LEU CD1 C 15.838 -0.878 -2.970 1.00 . A A . 6 LEU CD1 1 1
6 1680 1 1 7 LEU CD2 C 15.685 1.551 -2.433 1.00 . A A . 6 LEU CD2 1 1
6 1681 1 1 7 LEU CG C 16.655 0.393 -2.722 1.00 . A A . 6 LEU CG 1 1
6 1682 1 1 7 LEU H H 19.460 0.180 -3.289 1.00 . A A . 6 LEU H 1 1
6 1683 1 1 7 LEU HA H 18.348 2.177 -1.517 1.00 . A A . 6 LEU HA 1 1
6 1684 1 1 7 LEU HB2 H 18.024 -0.825 -1.571 1.00 . A A . 6 LEU HB2 1 1
6 1685 1 1 7 LEU HB3 H 17.069 0.299 -0.607 1.00 . A A . 6 LEU HB3 1 1
6 1686 1 1 7 LEU HD11 H 15.254 -1.107 -2.091 1.00 . A A . 6 LEU HD11 1 1
6 1687 1 1 7 LEU HD12 H 16.506 -1.699 -3.183 1.00 . A A . 6 LEU HD12 1 1
6 1688 1 1 7 LEU HD13 H 15.178 -0.724 -3.811 1.00 . A A . 6 LEU HD13 1 1
6 1689 1 1 7 LEU HD21 H 16.225 2.485 -2.425 1.00 . A A . 6 LEU HD21 1 1
6 1690 1 1 7 LEU HD22 H 15.210 1.401 -1.476 1.00 . A A . 6 LEU HD22 1 1
6 1691 1 1 7 LEU HD23 H 14.929 1.583 -3.203 1.00 . A A . 6 LEU HD23 1 1
6 1692 1 1 7 LEU HG H 17.234 0.618 -3.609 1.00 . A A . 6 LEU HG 1 1
6 1693 1 1 7 LEU N N 19.481 1.041 -2.833 1.00 . A A . 6 LEU N 1 1
6 1694 1 1 7 LEU O O 19.423 1.465 0.716 1.00 . A A . 6 LEU O 1 1
6 1695 1 1 8 ALA C C 22.318 1.242 1.026 1.00 . A A . 7 ALA C 1 1
6 1696 1 1 8 ALA CA C 21.700 -0.067 0.499 1.00 . A A . 7 ALA CA 1 1
6 1697 1 1 8 ALA CB C 22.788 -1.071 0.017 1.00 . A A . 7 ALA CB 1 1
6 1698 1 1 8 ALA H H 20.921 -0.171 -1.472 1.00 . A A . 7 ALA H 1 1
6 1699 1 1 8 ALA HA H 21.145 -0.518 1.312 1.00 . A A . 7 ALA HA 1 1
6 1700 1 1 8 ALA HB1 H 23.780 -0.719 0.279 1.00 . A A . 7 ALA HB1 1 1
6 1701 1 1 8 ALA HB2 H 22.725 -1.177 -1.053 1.00 . A A . 7 ALA HB2 1 1
6 1702 1 1 8 ALA HB3 H 22.626 -2.045 0.470 1.00 . A A . 7 ALA HB3 1 1
6 1703 1 1 8 ALA N N 20.759 0.207 -0.584 1.00 . A A . 7 ALA N 1 1
6 1704 1 1 8 ALA O O 22.212 1.536 2.212 1.00 . A A . 7 ALA O 1 1
6 1705 1 1 9 PRO C C 22.745 4.069 1.639 1.00 . A A . 8 PRO C 1 1
6 1706 1 1 9 PRO CA C 23.579 3.319 0.603 1.00 . A A . 8 PRO CA 1 1
6 1707 1 1 9 PRO CB C 23.623 4.086 -0.712 1.00 . A A . 8 PRO CB 1 1
6 1708 1 1 9 PRO CD C 23.143 1.789 -1.263 1.00 . A A . 8 PRO CD 1 1
6 1709 1 1 9 PRO CG C 23.907 3.039 -1.735 1.00 . A A . 8 PRO CG 1 1
6 1710 1 1 9 PRO HA H 24.582 3.166 0.949 1.00 . A A . 8 PRO HA 1 1
6 1711 1 1 9 PRO HB2 H 22.662 4.560 -0.905 1.00 . A A . 8 PRO HB2 1 1
6 1712 1 1 9 PRO HB3 H 24.403 4.812 -0.701 1.00 . A A . 8 PRO HB3 1 1
6 1713 1 1 9 PRO HD2 H 22.193 1.718 -1.774 1.00 . A A . 8 PRO HD2 1 1
6 1714 1 1 9 PRO HD3 H 23.727 0.899 -1.414 1.00 . A A . 8 PRO HD3 1 1
6 1715 1 1 9 PRO HG2 H 23.555 3.369 -2.710 1.00 . A A . 8 PRO HG2 1 1
6 1716 1 1 9 PRO HG3 H 24.964 2.821 -1.770 1.00 . A A . 8 PRO HG3 1 1
6 1717 1 1 9 PRO N N 22.947 2.026 0.184 1.00 . A A . 8 PRO N 1 1
6 1718 1 1 9 PRO O O 23.271 4.661 2.581 1.00 . A A . 8 PRO O 1 1
6 1719 1 1 10 ALA C C 20.662 4.217 3.778 1.00 . A A . 9 ALA C 1 1
6 1720 1 1 10 ALA CA C 20.512 4.701 2.332 1.00 . A A . 9 ALA CA 1 1
6 1721 1 1 10 ALA CB C 19.079 4.454 1.860 1.00 . A A . 9 ALA CB 1 1
6 1722 1 1 10 ALA H H 21.114 3.544 0.663 1.00 . A A . 9 ALA H 1 1
6 1723 1 1 10 ALA HA H 20.700 5.762 2.300 1.00 . A A . 9 ALA HA 1 1
6 1724 1 1 10 ALA HB1 H 18.400 5.065 2.436 1.00 . A A . 9 ALA HB1 1 1
6 1725 1 1 10 ALA HB2 H 18.830 3.412 1.996 1.00 . A A . 9 ALA HB2 1 1
6 1726 1 1 10 ALA HB3 H 18.996 4.711 0.815 1.00 . A A . 9 ALA HB3 1 1
6 1727 1 1 10 ALA N N 21.449 4.031 1.438 1.00 . A A . 9 ALA N 1 1
6 1728 1 1 10 ALA O O 20.004 4.744 4.675 1.00 . A A . 9 ALA O 1 1
6 1729 1 1 11 LEU C C 22.590 3.656 6.157 1.00 . A A . 10 LEU C 1 1
6 1730 1 1 11 LEU CA C 21.722 2.704 5.367 1.00 . A A . 10 LEU CA 1 1
6 1731 1 1 11 LEU CB C 22.305 1.262 5.312 1.00 . A A . 10 LEU CB 1 1
6 1732 1 1 11 LEU CD1 C 24.312 -0.232 5.383 1.00 . A A . 10 LEU CD1 1 1
6 1733 1 1 11 LEU CD2 C 24.404 1.858 4.026 1.00 . A A . 10 LEU CD2 1 1
6 1734 1 1 11 LEU CG C 23.846 1.223 5.307 1.00 . A A . 10 LEU CG 1 1
6 1735 1 1 11 LEU H H 22.031 2.824 3.282 1.00 . A A . 10 LEU H 1 1
6 1736 1 1 11 LEU HA H 20.773 2.675 5.846 1.00 . A A . 10 LEU HA 1 1
6 1737 1 1 11 LEU HB2 H 21.956 0.706 6.168 1.00 . A A . 10 LEU HB2 1 1
6 1738 1 1 11 LEU HB3 H 21.939 0.783 4.418 1.00 . A A . 10 LEU HB3 1 1
6 1739 1 1 11 LEU HD11 H 23.865 -0.709 6.244 1.00 . A A . 10 LEU HD11 1 1
6 1740 1 1 11 LEU HD12 H 25.388 -0.263 5.473 1.00 . A A . 10 LEU HD12 1 1
6 1741 1 1 11 LEU HD13 H 24.011 -0.754 4.487 1.00 . A A . 10 LEU HD13 1 1
6 1742 1 1 11 LEU HD21 H 25.449 2.091 4.169 1.00 . A A . 10 LEU HD21 1 1
6 1743 1 1 11 LEU HD22 H 23.866 2.762 3.810 1.00 . A A . 10 LEU HD22 1 1
6 1744 1 1 11 LEU HD23 H 24.302 1.170 3.199 1.00 . A A . 10 LEU HD23 1 1
6 1745 1 1 11 LEU HG H 24.223 1.742 6.167 1.00 . A A . 10 LEU HG 1 1
6 1746 1 1 11 LEU N N 21.523 3.218 4.015 1.00 . A A . 10 LEU N 1 1
6 1747 1 1 11 LEU O O 22.741 3.544 7.373 1.00 . A A . 10 LEU O 1 1
6 1748 1 1 12 ALA C C 23.396 6.180 7.267 1.00 . A A . 11 ALA C 1 1
6 1749 1 1 12 ALA CA C 24.026 5.594 6.010 1.00 . A A . 11 ALA CA 1 1
6 1750 1 1 12 ALA CB C 24.285 6.710 4.996 1.00 . A A . 11 ALA CB 1 1
6 1751 1 1 12 ALA H H 22.965 4.579 4.475 1.00 . A A . 11 ALA H 1 1
6 1752 1 1 12 ALA HA H 24.967 5.136 6.271 1.00 . A A . 11 ALA HA 1 1
6 1753 1 1 12 ALA HB1 H 24.957 7.439 5.425 1.00 . A A . 11 ALA HB1 1 1
6 1754 1 1 12 ALA HB2 H 23.351 7.188 4.739 1.00 . A A . 11 ALA HB2 1 1
6 1755 1 1 12 ALA HB3 H 24.731 6.290 4.106 1.00 . A A . 11 ALA HB3 1 1
6 1756 1 1 12 ALA N N 23.150 4.583 5.430 1.00 . A A . 11 ALA N 1 1
6 1757 1 1 12 ALA O O 24.097 6.561 8.205 1.00 . A A . 11 ALA O 1 1
6 1758 1 1 13 LEU C C 21.483 5.802 9.595 1.00 . A A . 12 LEU C 1 1
6 1759 1 1 13 LEU CA C 21.364 6.780 8.435 1.00 . A A . 12 LEU CA 1 1
6 1760 1 1 13 LEU CB C 19.890 7.020 8.082 1.00 . A A . 12 LEU CB 1 1
6 1761 1 1 13 LEU CD1 C 19.767 8.501 10.115 1.00 . A A . 12 LEU CD1 1 1
6 1762 1 1 13 LEU CD2 C 17.678 7.818 8.916 1.00 . A A . 12 LEU CD2 1 1
6 1763 1 1 13 LEU CG C 19.080 7.368 9.340 1.00 . A A . 12 LEU CG 1 1
6 1764 1 1 13 LEU H H 21.562 5.923 6.511 1.00 . A A . 12 LEU H 1 1
6 1765 1 1 13 LEU HA H 21.820 7.714 8.713 1.00 . A A . 12 LEU HA 1 1
6 1766 1 1 13 LEU HB2 H 19.821 7.836 7.377 1.00 . A A . 12 LEU HB2 1 1
6 1767 1 1 13 LEU HB3 H 19.482 6.127 7.634 1.00 . A A . 12 LEU HB3 1 1
6 1768 1 1 13 LEU HD11 H 20.123 9.249 9.423 1.00 . A A . 12 LEU HD11 1 1
6 1769 1 1 13 LEU HD12 H 20.601 8.101 10.673 1.00 . A A . 12 LEU HD12 1 1
6 1770 1 1 13 LEU HD13 H 19.064 8.952 10.801 1.00 . A A . 12 LEU HD13 1 1
6 1771 1 1 13 LEU HD21 H 17.742 8.768 8.407 1.00 . A A . 12 LEU HD21 1 1
6 1772 1 1 13 LEU HD22 H 17.053 7.920 9.791 1.00 . A A . 12 LEU HD22 1 1
6 1773 1 1 13 LEU HD23 H 17.249 7.083 8.252 1.00 . A A . 12 LEU HD23 1 1
6 1774 1 1 13 LEU HG H 19.004 6.495 9.973 1.00 . A A . 12 LEU HG 1 1
6 1775 1 1 13 LEU N N 22.071 6.244 7.282 1.00 . A A . 12 LEU N 1 1
6 1776 1 1 13 LEU O O 21.941 6.163 10.679 1.00 . A A . 12 LEU O 1 1
6 1777 1 1 14 ALA C C 22.594 3.399 10.852 1.00 . A A . 13 ALA C 1 1
6 1778 1 1 14 ALA CA C 21.151 3.546 10.400 1.00 . A A . 13 ALA CA 1 1
6 1779 1 1 14 ALA CB C 20.637 2.204 9.883 1.00 . A A . 13 ALA CB 1 1
6 1780 1 1 14 ALA H H 20.722 4.323 8.477 1.00 . A A . 13 ALA H 1 1
6 1781 1 1 14 ALA HA H 20.548 3.856 11.239 1.00 . A A . 13 ALA HA 1 1
6 1782 1 1 14 ALA HB1 H 19.562 2.243 9.781 1.00 . A A . 13 ALA HB1 1 1
6 1783 1 1 14 ALA HB2 H 20.905 1.425 10.583 1.00 . A A . 13 ALA HB2 1 1
6 1784 1 1 14 ALA HB3 H 21.083 1.992 8.922 1.00 . A A . 13 ALA HB3 1 1
6 1785 1 1 14 ALA N N 21.075 4.559 9.359 1.00 . A A . 13 ALA N 1 1
6 1786 1 1 14 ALA O O 22.871 3.189 12.029 1.00 . A A . 13 ALA O 1 1
6 1787 1 1 15 LEU C C 25.261 4.344 11.367 1.00 . A A . 14 LEU C 1 1
6 1788 1 1 15 LEU CA C 24.928 3.390 10.235 1.00 . A A . 14 LEU CA 1 1
6 1789 1 1 15 LEU CB C 25.782 3.681 8.985 1.00 . A A . 14 LEU CB 1 1
6 1790 1 1 15 LEU CD1 C 27.897 2.819 7.870 1.00 . A A . 14 LEU CD1 1 1
6 1791 1 1 15 LEU CD2 C 28.094 4.447 9.738 1.00 . A A . 14 LEU CD2 1 1
6 1792 1 1 15 LEU CG C 27.272 3.265 9.198 1.00 . A A . 14 LEU CG 1 1
6 1793 1 1 15 LEU H H 23.247 3.682 8.977 1.00 . A A . 14 LEU H 1 1
6 1794 1 1 15 LEU HA H 25.112 2.391 10.571 1.00 . A A . 14 LEU HA 1 1
6 1795 1 1 15 LEU HB2 H 25.362 3.127 8.154 1.00 . A A . 14 LEU HB2 1 1
6 1796 1 1 15 LEU HB3 H 25.727 4.738 8.759 1.00 . A A . 14 LEU HB3 1 1
6 1797 1 1 15 LEU HD11 H 28.943 2.594 8.022 1.00 . A A . 14 LEU HD11 1 1
6 1798 1 1 15 LEU HD12 H 27.801 3.611 7.143 1.00 . A A . 14 LEU HD12 1 1
6 1799 1 1 15 LEU HD13 H 27.388 1.937 7.511 1.00 . A A . 14 LEU HD13 1 1
6 1800 1 1 15 LEU HD21 H 27.980 5.296 9.080 1.00 . A A . 14 LEU HD21 1 1
6 1801 1 1 15 LEU HD22 H 29.136 4.168 9.784 1.00 . A A . 14 LEU HD22 1 1
6 1802 1 1 15 LEU HD23 H 27.752 4.709 10.725 1.00 . A A . 14 LEU HD23 1 1
6 1803 1 1 15 LEU HG H 27.326 2.439 9.895 1.00 . A A . 14 LEU HG 1 1
6 1804 1 1 15 LEU N N 23.517 3.513 9.906 1.00 . A A . 14 LEU N 1 1
6 1805 1 1 15 LEU O O 25.868 3.950 12.362 1.00 . A A . 14 LEU O 1 1
6 1806 1 1 16 ALA C C 24.518 6.103 13.573 1.00 . A A . 15 ALA C 1 1
6 1807 1 1 16 ALA CA C 25.118 6.580 12.255 1.00 . A A . 15 ALA CA 1 1
6 1808 1 1 16 ALA CB C 24.510 7.928 11.866 1.00 . A A . 15 ALA CB 1 1
6 1809 1 1 16 ALA H H 24.367 5.859 10.410 1.00 . A A . 15 ALA H 1 1
6 1810 1 1 16 ALA HA H 26.186 6.694 12.372 1.00 . A A . 15 ALA HA 1 1
6 1811 1 1 16 ALA HB1 H 24.884 8.225 10.897 1.00 . A A . 15 ALA HB1 1 1
6 1812 1 1 16 ALA HB2 H 24.784 8.671 12.600 1.00 . A A . 15 ALA HB2 1 1
6 1813 1 1 16 ALA HB3 H 23.435 7.840 11.827 1.00 . A A . 15 ALA HB3 1 1
6 1814 1 1 16 ALA N N 24.855 5.594 11.222 1.00 . A A . 15 ALA N 1 1
6 1815 1 1 16 ALA O O 24.969 6.488 14.651 1.00 . A A . 15 ALA O 1 1
6 1816 1 1 17 LEU C C 23.663 3.697 15.392 1.00 . A A . 16 LEU C 1 1
6 1817 1 1 17 LEU CA C 22.814 4.738 14.651 1.00 . A A . 16 LEU CA 1 1
6 1818 1 1 17 LEU CB C 21.450 4.132 14.253 1.00 . A A . 16 LEU CB 1 1
6 1819 1 1 17 LEU CD1 C 19.144 3.521 15.015 1.00 . A A . 16 LEU CD1 1 1
6 1820 1 1 17 LEU CD2 C 21.032 3.531 16.657 1.00 . A A . 16 LEU CD2 1 1
6 1821 1 1 17 LEU CG C 20.446 4.218 15.416 1.00 . A A . 16 LEU CG 1 1
6 1822 1 1 17 LEU H H 23.170 4.999 12.586 1.00 . A A . 16 LEU H 1 1
6 1823 1 1 17 LEU HA H 22.637 5.559 15.319 1.00 . A A . 16 LEU HA 1 1
6 1824 1 1 17 LEU HB2 H 21.055 4.677 13.409 1.00 . A A . 16 LEU HB2 1 1
6 1825 1 1 17 LEU HB3 H 21.578 3.097 13.974 1.00 . A A . 16 LEU HB3 1 1
6 1826 1 1 17 LEU HD11 H 18.773 3.950 14.096 1.00 . A A . 16 LEU HD11 1 1
6 1827 1 1 17 LEU HD12 H 18.409 3.653 15.796 1.00 . A A . 16 LEU HD12 1 1
6 1828 1 1 17 LEU HD13 H 19.329 2.467 14.870 1.00 . A A . 16 LEU HD13 1 1
6 1829 1 1 17 LEU HD21 H 21.502 2.602 16.369 1.00 . A A . 16 LEU HD21 1 1
6 1830 1 1 17 LEU HD22 H 20.243 3.330 17.367 1.00 . A A . 16 LEU HD22 1 1
6 1831 1 1 17 LEU HD23 H 21.765 4.179 17.114 1.00 . A A . 16 LEU HD23 1 1
6 1832 1 1 17 LEU HG H 20.242 5.258 15.635 1.00 . A A . 16 LEU HG 1 1
6 1833 1 1 17 LEU N N 23.487 5.264 13.471 1.00 . A A . 16 LEU N 1 1
6 1834 1 1 17 LEU O O 24.109 3.949 16.512 1.00 . A A . 16 LEU O 1 1
6 1835 1 1 18 TRP C C 26.168 1.785 15.438 1.00 . A A . 17 TRP C 1 1
6 1836 1 1 18 TRP CA C 24.674 1.489 15.446 1.00 . A A . 17 TRP CA 1 1
6 1837 1 1 18 TRP CB C 24.404 0.112 14.835 1.00 . A A . 17 TRP CB 1 1
6 1838 1 1 18 TRP CD1 C 23.545 0.492 12.489 1.00 . A A . 17 TRP CD1 1 1
6 1839 1 1 18 TRP CD2 C 25.657 -0.284 12.524 1.00 . A A . 17 TRP CD2 1 1
6 1840 1 1 18 TRP CE2 C 25.307 -0.122 11.165 1.00 . A A . 17 TRP CE2 1 1
6 1841 1 1 18 TRP CE3 C 26.946 -0.764 12.823 1.00 . A A . 17 TRP CE3 1 1
6 1842 1 1 18 TRP CG C 24.521 0.115 13.345 1.00 . A A . 17 TRP CG 1 1
6 1843 1 1 18 TRP CH2 C 27.475 -0.900 10.450 1.00 . A A . 17 TRP CH2 1 1
6 1844 1 1 18 TRP CZ2 C 26.198 -0.425 10.138 1.00 . A A . 17 TRP CZ2 1 1
6 1845 1 1 18 TRP CZ3 C 27.848 -1.070 11.790 1.00 . A A . 17 TRP CZ3 1 1
6 1846 1 1 18 TRP H H 23.507 2.355 13.893 1.00 . A A . 17 TRP H 1 1
6 1847 1 1 18 TRP HA H 24.360 1.450 16.479 1.00 . A A . 17 TRP HA 1 1
6 1848 1 1 18 TRP HB2 H 25.116 -0.587 15.229 1.00 . A A . 17 TRP HB2 1 1
6 1849 1 1 18 TRP HB3 H 23.410 -0.199 15.113 1.00 . A A . 17 TRP HB3 1 1
6 1850 1 1 18 TRP HD1 H 22.564 0.845 12.768 1.00 . A A . 17 TRP HD1 1 1
6 1851 1 1 18 TRP HE1 H 23.503 0.558 10.383 1.00 . A A . 17 TRP HE1 1 1
6 1852 1 1 18 TRP HE3 H 27.243 -0.897 13.852 1.00 . A A . 17 TRP HE3 1 1
6 1853 1 1 18 TRP HH2 H 28.171 -1.137 9.660 1.00 . A A . 17 TRP HH2 1 1
6 1854 1 1 18 TRP HZ2 H 25.903 -0.291 9.108 1.00 . A A . 17 TRP HZ2 1 1
6 1855 1 1 18 TRP HZ3 H 28.834 -1.437 12.031 1.00 . A A . 17 TRP HZ3 1 1
6 1856 1 1 18 TRP N N 23.882 2.525 14.783 1.00 . A A . 17 TRP N 1 1
6 1857 1 1 18 TRP NE1 N 24.012 0.351 11.194 1.00 . A A . 17 TRP NE1 1 1
6 1858 1 1 18 TRP O O 26.848 1.570 16.442 1.00 . A A . 17 TRP O 1 1
6 1859 1 1 19 TRP C C 28.505 3.458 15.425 1.00 . A A . 18 TRP C 1 1
6 1860 1 1 19 TRP CA C 28.109 2.580 14.247 1.00 . A A . 18 TRP CA 1 1
6 1861 1 1 19 TRP CB C 28.430 3.312 12.940 1.00 . A A . 18 TRP CB 1 1
6 1862 1 1 19 TRP CD1 C 30.603 2.229 12.241 1.00 . A A . 18 TRP CD1 1 1
6 1863 1 1 19 TRP CD2 C 30.875 4.367 12.886 1.00 . A A . 18 TRP CD2 1 1
6 1864 1 1 19 TRP CE2 C 32.155 3.885 12.524 1.00 . A A . 18 TRP CE2 1 1
6 1865 1 1 19 TRP CE3 C 30.770 5.697 13.333 1.00 . A A . 18 TRP CE3 1 1
6 1866 1 1 19 TRP CG C 29.907 3.295 12.696 1.00 . A A . 18 TRP CG 1 1
6 1867 1 1 19 TRP CH2 C 33.169 6.009 13.047 1.00 . A A . 18 TRP CH2 1 1
6 1868 1 1 19 TRP CZ2 C 33.288 4.690 12.601 1.00 . A A . 18 TRP CZ2 1 1
6 1869 1 1 19 TRP CZ3 C 31.911 6.512 13.412 1.00 . A A . 18 TRP CZ3 1 1
6 1870 1 1 19 TRP H H 26.104 2.427 13.552 1.00 . A A . 18 TRP H 1 1
6 1871 1 1 19 TRP HA H 28.670 1.658 14.285 1.00 . A A . 18 TRP HA 1 1
6 1872 1 1 19 TRP HB2 H 27.926 2.824 12.124 1.00 . A A . 18 TRP HB2 1 1
6 1873 1 1 19 TRP HB3 H 28.092 4.337 13.010 1.00 . A A . 18 TRP HB3 1 1
6 1874 1 1 19 TRP HD1 H 30.185 1.265 11.998 1.00 . A A . 18 TRP HD1 1 1
6 1875 1 1 19 TRP HE1 H 32.657 1.989 11.832 1.00 . A A . 18 TRP HE1 1 1
6 1876 1 1 19 TRP HE3 H 29.806 6.093 13.615 1.00 . A A . 18 TRP HE3 1 1
6 1877 1 1 19 TRP HH2 H 34.042 6.641 13.110 1.00 . A A . 18 TRP HH2 1 1
6 1878 1 1 19 TRP HZ2 H 34.253 4.296 12.319 1.00 . A A . 18 TRP HZ2 1 1
6 1879 1 1 19 TRP HZ3 H 31.819 7.532 13.755 1.00 . A A . 18 TRP HZ3 1 1
6 1880 1 1 19 TRP N N 26.683 2.274 14.324 1.00 . A A . 18 TRP N 1 1
6 1881 1 1 19 TRP NE1 N 31.938 2.580 12.139 1.00 . A A . 18 TRP NE1 1 1
6 1882 1 1 19 TRP O O 29.436 3.148 16.168 1.00 . A A . 18 TRP O 1 1
6 1883 1 1 20 ALA C C 27.136 5.187 17.860 1.00 . A A . 19 ALA C 1 1
6 1884 1 1 20 ALA CA C 28.027 5.508 16.669 1.00 . A A . 19 ALA CA 1 1
6 1885 1 1 20 ALA CB C 27.755 6.936 16.192 1.00 . A A . 19 ALA CB 1 1
6 1886 1 1 20 ALA H H 27.052 4.739 14.955 1.00 . A A . 19 ALA H 1 1
6 1887 1 1 20 ALA HA H 29.053 5.434 16.977 1.00 . A A . 19 ALA HA 1 1
6 1888 1 1 20 ALA HB1 H 28.186 7.077 15.211 1.00 . A A . 19 ALA HB1 1 1
6 1889 1 1 20 ALA HB2 H 28.198 7.638 16.883 1.00 . A A . 19 ALA HB2 1 1
6 1890 1 1 20 ALA HB3 H 26.689 7.104 16.143 1.00 . A A . 19 ALA HB3 1 1
6 1891 1 1 20 ALA N N 27.776 4.561 15.583 1.00 . A A . 19 ALA N 1 1
6 1892 1 1 20 ALA O O 26.762 6.072 18.631 1.00 . A A . 19 ALA O 1 1
6 1893 1 1 21 ETA CA C 25.952 3.467 19.098 1.00 . A A . 20 ETA CA 1 1
6 1894 1 1 21 ETA CB C 26.102 1.962 19.311 1.00 . A A . 20 ETA CB 1 1
6 1895 1 1 21 ETA HA1 H 24.922 3.686 18.866 1.00 . A A . 20 ETA HA1 1 1
6 1896 1 1 21 ETA HA2 H 26.236 3.988 20.002 1.00 . A A . 20 ETA HA2 1 1
6 1897 1 1 21 ETA HB1 H 25.620 1.436 18.494 1.00 . A A . 20 ETA HB1 1 1
6 1898 1 1 21 ETA HB2 H 25.636 1.676 20.236 1.00 . A A . 20 ETA HB2 1 1
6 1899 1 1 21 ETA HN2 H 27.134 3.259 17.348 1.00 . A A . 20 ETA HN2 1 1
6 1900 1 1 21 ETA HO H 27.661 1.243 20.227 1.00 . A A . 20 ETA HO 1 1
6 1901 1 1 21 ETA N N 26.802 3.913 17.999 1.00 . A A . 20 ETA N 1 1
6 1902 1 1 21 ETA O O 27.485 1.634 19.369 1.00 . A A . 20 ETA O 1 1
7 1903 1 1 1 ACE C C 22.938 -5.063 -8.914 1.00 . A A . 0 ACE C 1 1
7 1904 1 1 1 ACE CH3 C 23.502 -6.031 -7.879 1.00 . A A . 0 ACE CH3 1 1
7 1905 1 1 1 ACE H1 H 22.940 -5.946 -6.961 1.00 . A A . 0 ACE H1 1 1
7 1906 1 1 1 ACE H2 H 24.538 -5.795 -7.692 1.00 . A A . 0 ACE H2 1 1
7 1907 1 1 1 ACE H3 H 23.426 -7.040 -8.254 1.00 . A A . 0 ACE H3 1 1
7 1908 1 1 1 ACE O O 23.203 -5.196 -10.109 1.00 . A A . 0 ACE O 1 1
7 1909 1 1 2 GLY C C 21.005 -1.954 -8.542 1.00 . A A . 1 GLY C 1 1
7 1910 1 1 2 GLY CA C 21.565 -3.113 -9.338 1.00 . A A . 1 GLY CA 1 1
7 1911 1 1 2 GLY H H 21.974 -4.024 -7.493 1.00 . A A . 1 GLY H 1 1
7 1912 1 1 2 GLY HA2 H 22.302 -2.749 -10.030 1.00 . A A . 1 GLY HA2 1 1
7 1913 1 1 2 GLY HA3 H 20.755 -3.581 -9.881 1.00 . A A . 1 GLY HA3 1 1
7 1914 1 1 2 GLY N N 22.158 -4.089 -8.450 1.00 . A A . 1 GLY N 1 1
7 1915 1 1 2 GLY O O 21.641 -1.414 -7.643 1.00 . A A . 1 GLY O 1 1
7 1916 1 1 3 TRP C C 18.712 -0.942 -6.810 1.00 . A A . 2 TRP C 1 1
7 1917 1 1 3 TRP CA C 19.118 -0.493 -8.214 1.00 . A A . 2 TRP CA 1 1
7 1918 1 1 3 TRP CB C 17.900 0.006 -9.044 1.00 . A A . 2 TRP CB 1 1
7 1919 1 1 3 TRP CD1 C 17.321 -2.361 -9.438 1.00 . A A . 2 TRP CD1 1 1
7 1920 1 1 3 TRP CD2 C 16.845 -1.105 -11.225 1.00 . A A . 2 TRP CD2 1 1
7 1921 1 1 3 TRP CE2 C 16.481 -2.430 -11.556 1.00 . A A . 2 TRP CE2 1 1
7 1922 1 1 3 TRP CE3 C 16.645 -0.101 -12.189 1.00 . A A . 2 TRP CE3 1 1
7 1923 1 1 3 TRP CG C 17.376 -1.109 -9.868 1.00 . A A . 2 TRP CG 1 1
7 1924 1 1 3 TRP CH2 C 15.744 -1.745 -13.746 1.00 . A A . 2 TRP CH2 1 1
7 1925 1 1 3 TRP CZ2 C 15.938 -2.753 -12.797 1.00 . A A . 2 TRP CZ2 1 1
7 1926 1 1 3 TRP CZ3 C 16.097 -0.421 -13.442 1.00 . A A . 2 TRP CZ3 1 1
7 1927 1 1 3 TRP H H 19.371 -2.067 -9.603 1.00 . A A . 2 TRP H 1 1
7 1928 1 1 3 TRP HA H 19.813 0.309 -8.098 1.00 . A A . 2 TRP HA 1 1
7 1929 1 1 3 TRP HB2 H 17.121 0.350 -8.386 1.00 . A A . 2 TRP HB2 1 1
7 1930 1 1 3 TRP HB3 H 18.207 0.813 -9.692 1.00 . A A . 2 TRP HB3 1 1
7 1931 1 1 3 TRP HD1 H 17.647 -2.668 -8.467 1.00 . A A . 2 TRP HD1 1 1
7 1932 1 1 3 TRP HE1 H 16.653 -4.126 -10.363 1.00 . A A . 2 TRP HE1 1 1
7 1933 1 1 3 TRP HE3 H 16.914 0.921 -11.963 1.00 . A A . 2 TRP HE3 1 1
7 1934 1 1 3 TRP HH2 H 15.324 -1.984 -14.711 1.00 . A A . 2 TRP HH2 1 1
7 1935 1 1 3 TRP HZ2 H 15.670 -3.774 -13.021 1.00 . A A . 2 TRP HZ2 1 1
7 1936 1 1 3 TRP HZ3 H 15.946 0.357 -14.177 1.00 . A A . 2 TRP HZ3 1 1
7 1937 1 1 3 TRP N N 19.804 -1.587 -8.887 1.00 . A A . 2 TRP N 1 1
7 1938 1 1 3 TRP NE1 N 16.794 -3.162 -10.430 1.00 . A A . 2 TRP NE1 1 1
7 1939 1 1 3 TRP O O 17.966 -0.250 -6.119 1.00 . A A . 2 TRP O 1 1
7 1940 1 1 4 TRP C C 19.767 -1.945 -4.027 1.00 . A A . 3 TRP C 1 1
7 1941 1 1 4 TRP CA C 18.906 -2.640 -5.068 1.00 . A A . 3 TRP CA 1 1
7 1942 1 1 4 TRP CB C 19.142 -4.162 -4.995 1.00 . A A . 3 TRP CB 1 1
7 1943 1 1 4 TRP CD1 C 19.573 -5.637 -6.992 1.00 . A A . 3 TRP CD1 1 1
7 1944 1 1 4 TRP CD2 C 17.506 -4.767 -7.010 1.00 . A A . 3 TRP CD2 1 1
7 1945 1 1 4 TRP CE2 C 17.622 -5.569 -8.170 1.00 . A A . 3 TRP CE2 1 1
7 1946 1 1 4 TRP CE3 C 16.289 -4.101 -6.790 1.00 . A A . 3 TRP CE3 1 1
7 1947 1 1 4 TRP CG C 18.761 -4.828 -6.279 1.00 . A A . 3 TRP CG 1 1
7 1948 1 1 4 TRP CH2 C 15.371 -5.036 -8.836 1.00 . A A . 3 TRP CH2 1 1
7 1949 1 1 4 TRP CZ2 C 16.573 -5.707 -9.072 1.00 . A A . 3 TRP CZ2 1 1
7 1950 1 1 4 TRP CZ3 C 15.234 -4.234 -7.694 1.00 . A A . 3 TRP CZ3 1 1
7 1951 1 1 4 TRP H H 19.808 -2.618 -6.982 1.00 . A A . 3 TRP H 1 1
7 1952 1 1 4 TRP HA H 17.887 -2.434 -4.848 1.00 . A A . 3 TRP HA 1 1
7 1953 1 1 4 TRP HB2 H 20.184 -4.357 -4.803 1.00 . A A . 3 TRP HB2 1 1
7 1954 1 1 4 TRP HB3 H 18.550 -4.577 -4.188 1.00 . A A . 3 TRP HB3 1 1
7 1955 1 1 4 TRP HD1 H 20.582 -5.896 -6.728 1.00 . A A . 3 TRP HD1 1 1
7 1956 1 1 4 TRP HE1 H 19.265 -6.676 -8.795 1.00 . A A . 3 TRP HE1 1 1
7 1957 1 1 4 TRP HE3 H 16.166 -3.482 -5.924 1.00 . A A . 3 TRP HE3 1 1
7 1958 1 1 4 TRP HH2 H 14.550 -5.134 -9.530 1.00 . A A . 3 TRP HH2 1 1
7 1959 1 1 4 TRP HZ2 H 16.689 -6.327 -9.948 1.00 . A A . 3 TRP HZ2 1 1
7 1960 1 1 4 TRP HZ3 H 14.313 -3.712 -7.507 1.00 . A A . 3 TRP HZ3 1 1
7 1961 1 1 4 TRP N N 19.218 -2.112 -6.393 1.00 . A A . 3 TRP N 1 1
7 1962 1 1 4 TRP NE1 N 18.898 -6.078 -8.113 1.00 . A A . 3 TRP NE1 1 1
7 1963 1 1 4 TRP O O 19.263 -1.339 -3.081 1.00 . A A . 3 TRP O 1 1
7 1964 1 1 5 LEU C C 21.644 0.051 -3.154 1.00 . A A . 4 LEU C 1 1
7 1965 1 1 5 LEU CA C 22.012 -1.420 -3.307 1.00 . A A . 4 LEU CA 1 1
7 1966 1 1 5 LEU CB C 23.457 -1.567 -3.829 1.00 . A A . 4 LEU CB 1 1
7 1967 1 1 5 LEU CD1 C 23.651 -3.049 -5.921 1.00 . A A . 4 LEU CD1 1 1
7 1968 1 1 5 LEU CD2 C 25.102 -3.527 -3.961 1.00 . A A . 4 LEU CD2 1 1
7 1969 1 1 5 LEU CG C 23.714 -3.019 -4.388 1.00 . A A . 4 LEU CG 1 1
7 1970 1 1 5 LEU H H 21.408 -2.533 -4.992 1.00 . A A . 4 LEU H 1 1
7 1971 1 1 5 LEU HA H 21.931 -1.907 -2.347 1.00 . A A . 4 LEU HA 1 1
7 1972 1 1 5 LEU HB2 H 23.623 -0.826 -4.604 1.00 . A A . 4 LEU HB2 1 1
7 1973 1 1 5 LEU HB3 H 24.133 -1.368 -3.007 1.00 . A A . 4 LEU HB3 1 1
7 1974 1 1 5 LEU HD11 H 24.040 -3.990 -6.281 1.00 . A A . 4 LEU HD11 1 1
7 1975 1 1 5 LEU HD12 H 24.236 -2.242 -6.335 1.00 . A A . 4 LEU HD12 1 1
7 1976 1 1 5 LEU HD13 H 22.630 -2.949 -6.230 1.00 . A A . 4 LEU HD13 1 1
7 1977 1 1 5 LEU HD21 H 25.111 -3.700 -2.896 1.00 . A A . 4 LEU HD21 1 1
7 1978 1 1 5 LEU HD22 H 25.849 -2.789 -4.214 1.00 . A A . 4 LEU HD22 1 1
7 1979 1 1 5 LEU HD23 H 25.317 -4.450 -4.480 1.00 . A A . 4 LEU HD23 1 1
7 1980 1 1 5 LEU HG H 22.957 -3.698 -4.011 1.00 . A A . 4 LEU HG 1 1
7 1981 1 1 5 LEU N N 21.074 -2.040 -4.220 1.00 . A A . 4 LEU N 1 1
7 1982 1 1 5 LEU O O 21.910 0.675 -2.128 1.00 . A A . 4 LEU O 1 1
7 1983 1 1 6 ALA C C 19.789 2.312 -2.966 1.00 . A A . 5 ALA C 1 1
7 1984 1 1 6 ALA CA C 20.604 1.984 -4.216 1.00 . A A . 5 ALA CA 1 1
7 1985 1 1 6 ALA CB C 19.748 2.242 -5.460 1.00 . A A . 5 ALA CB 1 1
7 1986 1 1 6 ALA H H 20.845 0.029 -4.985 1.00 . A A . 5 ALA H 1 1
7 1987 1 1 6 ALA HA H 21.473 2.619 -4.254 1.00 . A A . 5 ALA HA 1 1
7 1988 1 1 6 ALA HB1 H 19.657 3.306 -5.621 1.00 . A A . 5 ALA HB1 1 1
7 1989 1 1 6 ALA HB2 H 18.765 1.814 -5.317 1.00 . A A . 5 ALA HB2 1 1
7 1990 1 1 6 ALA HB3 H 20.216 1.786 -6.320 1.00 . A A . 5 ALA HB3 1 1
7 1991 1 1 6 ALA N N 21.025 0.589 -4.202 1.00 . A A . 5 ALA N 1 1
7 1992 1 1 6 ALA O O 19.491 3.475 -2.696 1.00 . A A . 5 ALA O 1 1
7 1993 1 1 7 LEU C C 19.555 1.690 0.219 1.00 . A A . 6 LEU C 1 1
7 1994 1 1 7 LEU CA C 18.649 1.448 -0.989 1.00 . A A . 6 LEU CA 1 1
7 1995 1 1 7 LEU CB C 17.805 0.194 -0.745 1.00 . A A . 6 LEU CB 1 1
7 1996 1 1 7 LEU CD1 C 16.430 -1.539 -1.940 1.00 . A A . 6 LEU CD1 1 1
7 1997 1 1 7 LEU CD2 C 15.635 0.823 -1.886 1.00 . A A . 6 LEU CD2 1 1
7 1998 1 1 7 LEU CG C 16.881 -0.076 -1.951 1.00 . A A . 6 LEU CG 1 1
7 1999 1 1 7 LEU H H 19.692 0.376 -2.471 1.00 . A A . 6 LEU H 1 1
7 2000 1 1 7 LEU HA H 17.989 2.288 -1.103 1.00 . A A . 6 LEU HA 1 1
7 2001 1 1 7 LEU HB2 H 18.470 -0.650 -0.600 1.00 . A A . 6 LEU HB2 1 1
7 2002 1 1 7 LEU HB3 H 17.211 0.334 0.141 1.00 . A A . 6 LEU HB3 1 1
7 2003 1 1 7 LEU HD11 H 15.786 -1.723 -2.787 1.00 . A A . 6 LEU HD11 1 1
7 2004 1 1 7 LEU HD12 H 15.890 -1.742 -1.027 1.00 . A A . 6 LEU HD12 1 1
7 2005 1 1 7 LEU HD13 H 17.295 -2.183 -1.998 1.00 . A A . 6 LEU HD13 1 1
7 2006 1 1 7 LEU HD21 H 14.930 0.507 -2.640 1.00 . A A . 6 LEU HD21 1 1
7 2007 1 1 7 LEU HD22 H 15.915 1.849 -2.069 1.00 . A A . 6 LEU HD22 1 1
7 2008 1 1 7 LEU HD23 H 15.175 0.742 -0.912 1.00 . A A . 6 LEU HD23 1 1
7 2009 1 1 7 LEU HG H 17.422 0.119 -2.867 1.00 . A A . 6 LEU HG 1 1
7 2010 1 1 7 LEU N N 19.430 1.276 -2.208 1.00 . A A . 6 LEU N 1 1
7 2011 1 1 7 LEU O O 19.136 2.299 1.204 1.00 . A A . 6 LEU O 1 1
7 2012 1 1 8 ALA C C 21.966 2.882 1.532 1.00 . A A . 7 ALA C 1 1
7 2013 1 1 8 ALA CA C 21.735 1.386 1.246 1.00 . A A . 7 ALA CA 1 1
7 2014 1 1 8 ALA CB C 23.067 0.640 0.932 1.00 . A A . 7 ALA CB 1 1
7 2015 1 1 8 ALA H H 21.078 0.730 -0.662 1.00 . A A . 7 ALA H 1 1
7 2016 1 1 8 ALA HA H 21.291 0.948 2.131 1.00 . A A . 7 ALA HA 1 1
7 2017 1 1 8 ALA HB1 H 23.174 -0.226 1.577 1.00 . A A . 7 ALA HB1 1 1
7 2018 1 1 8 ALA HB2 H 23.918 1.293 1.080 1.00 . A A . 7 ALA HB2 1 1
7 2019 1 1 8 ALA HB3 H 23.050 0.310 -0.096 1.00 . A A . 7 ALA HB3 1 1
7 2020 1 1 8 ALA N N 20.794 1.210 0.143 1.00 . A A . 7 ALA N 1 1
7 2021 1 1 8 ALA O O 21.778 3.332 2.663 1.00 . A A . 7 ALA O 1 1
7 2022 1 1 9 PRO C C 21.551 5.790 1.605 1.00 . A A . 8 PRO C 1 1
7 2023 1 1 9 PRO CA C 22.613 5.121 0.730 1.00 . A A . 8 PRO CA 1 1
7 2024 1 1 9 PRO CB C 22.556 5.650 -0.703 1.00 . A A . 8 PRO CB 1 1
7 2025 1 1 9 PRO CD C 22.626 3.241 -0.845 1.00 . A A . 8 PRO CD 1 1
7 2026 1 1 9 PRO CG C 23.102 4.533 -1.529 1.00 . A A . 8 PRO CG 1 1
7 2027 1 1 9 PRO HA H 23.597 5.294 1.125 1.00 . A A . 8 PRO HA 1 1
7 2028 1 1 9 PRO HB2 H 21.527 5.867 -0.984 1.00 . A A . 8 PRO HB2 1 1
7 2029 1 1 9 PRO HB3 H 23.168 6.523 -0.814 1.00 . A A . 8 PRO HB3 1 1
7 2030 1 1 9 PRO HD2 H 21.721 2.882 -1.316 1.00 . A A . 8 PRO HD2 1 1
7 2031 1 1 9 PRO HD3 H 23.394 2.488 -0.867 1.00 . A A . 8 PRO HD3 1 1
7 2032 1 1 9 PRO HG2 H 22.719 4.600 -2.545 1.00 . A A . 8 PRO HG2 1 1
7 2033 1 1 9 PRO HG3 H 24.182 4.558 -1.534 1.00 . A A . 8 PRO HG3 1 1
7 2034 1 1 9 PRO N N 22.364 3.656 0.548 1.00 . A A . 8 PRO N 1 1
7 2035 1 1 9 PRO O O 21.866 6.491 2.565 1.00 . A A . 8 PRO O 1 1
7 2036 1 1 10 ALA C C 19.144 5.614 3.434 1.00 . A A . 9 ALA C 1 1
7 2037 1 1 10 ALA CA C 19.183 6.142 2.001 1.00 . A A . 9 ALA CA 1 1
7 2038 1 1 10 ALA CB C 17.863 5.817 1.301 1.00 . A A . 9 ALA CB 1 1
7 2039 1 1 10 ALA H H 20.116 4.998 0.478 1.00 . A A . 9 ALA H 1 1
7 2040 1 1 10 ALA HA H 19.302 7.213 2.027 1.00 . A A . 9 ALA HA 1 1
7 2041 1 1 10 ALA HB1 H 17.820 4.760 1.086 1.00 . A A . 9 ALA HB1 1 1
7 2042 1 1 10 ALA HB2 H 17.799 6.375 0.377 1.00 . A A . 9 ALA HB2 1 1
7 2043 1 1 10 ALA HB3 H 17.039 6.088 1.943 1.00 . A A . 9 ALA HB3 1 1
7 2044 1 1 10 ALA N N 20.296 5.563 1.256 1.00 . A A . 9 ALA N 1 1
7 2045 1 1 10 ALA O O 18.593 6.260 4.325 1.00 . A A . 9 ALA O 1 1
7 2046 1 1 11 LEU C C 21.011 4.288 5.711 1.00 . A A . 10 LEU C 1 1
7 2047 1 1 11 LEU CA C 19.766 3.813 4.971 1.00 . A A . 10 LEU CA 1 1
7 2048 1 1 11 LEU CB C 19.694 2.262 4.759 1.00 . A A . 10 LEU CB 1 1
7 2049 1 1 11 LEU CD1 C 20.071 1.546 7.172 1.00 . A A . 10 LEU CD1 1 1
7 2050 1 1 11 LEU CD2 C 20.616 -0.002 5.246 1.00 . A A . 10 LEU CD2 1 1
7 2051 1 1 11 LEU CG C 20.598 1.464 5.716 1.00 . A A . 10 LEU CG 1 1
7 2052 1 1 11 LEU H H 20.154 3.961 2.913 1.00 . A A . 10 LEU H 1 1
7 2053 1 1 11 LEU HA H 18.919 4.136 5.525 1.00 . A A . 10 LEU HA 1 1
7 2054 1 1 11 LEU HB2 H 18.677 1.926 4.897 1.00 . A A . 10 LEU HB2 1 1
7 2055 1 1 11 LEU HB3 H 19.986 2.043 3.740 1.00 . A A . 10 LEU HB3 1 1
7 2056 1 1 11 LEU HD11 H 19.540 2.478 7.322 1.00 . A A . 10 LEU HD11 1 1
7 2057 1 1 11 LEU HD12 H 20.904 1.503 7.854 1.00 . A A . 10 LEU HD12 1 1
7 2058 1 1 11 LEU HD13 H 19.400 0.719 7.380 1.00 . A A . 10 LEU HD13 1 1
7 2059 1 1 11 LEU HD21 H 19.601 -0.355 5.130 1.00 . A A . 10 LEU HD21 1 1
7 2060 1 1 11 LEU HD22 H 21.125 -0.609 5.979 1.00 . A A . 10 LEU HD22 1 1
7 2061 1 1 11 LEU HD23 H 21.132 -0.071 4.300 1.00 . A A . 10 LEU HD23 1 1
7 2062 1 1 11 LEU HG H 21.604 1.856 5.667 1.00 . A A . 10 LEU HG 1 1
7 2063 1 1 11 LEU N N 19.730 4.434 3.654 1.00 . A A . 10 LEU N 1 1
7 2064 1 1 11 LEU O O 21.179 4.080 6.911 1.00 . A A . 10 LEU O 1 1
7 2065 1 1 12 ALA C C 22.866 6.190 6.815 1.00 . A A . 11 ALA C 1 1
7 2066 1 1 12 ALA CA C 23.120 5.447 5.509 1.00 . A A . 11 ALA CA 1 1
7 2067 1 1 12 ALA CB C 23.787 6.387 4.506 1.00 . A A . 11 ALA CB 1 1
7 2068 1 1 12 ALA H H 21.656 5.043 4.025 1.00 . A A . 11 ALA H 1 1
7 2069 1 1 12 ALA HA H 23.786 4.620 5.704 1.00 . A A . 11 ALA HA 1 1
7 2070 1 1 12 ALA HB1 H 23.170 7.264 4.367 1.00 . A A . 11 ALA HB1 1 1
7 2071 1 1 12 ALA HB2 H 23.911 5.879 3.560 1.00 . A A . 11 ALA HB2 1 1
7 2072 1 1 12 ALA HB3 H 24.755 6.686 4.882 1.00 . A A . 11 ALA HB3 1 1
7 2073 1 1 12 ALA N N 21.871 4.925 4.965 1.00 . A A . 11 ALA N 1 1
7 2074 1 1 12 ALA O O 23.789 6.424 7.595 1.00 . A A . 11 ALA O 1 1
7 2075 1 1 13 LEU C C 21.348 6.324 9.458 1.00 . A A . 12 LEU C 1 1
7 2076 1 1 13 LEU CA C 21.262 7.269 8.268 1.00 . A A . 12 LEU CA 1 1
7 2077 1 1 13 LEU CB C 19.848 7.858 8.146 1.00 . A A . 12 LEU CB 1 1
7 2078 1 1 13 LEU CD1 C 20.434 9.311 10.116 1.00 . A A . 12 LEU CD1 1 1
7 2079 1 1 13 LEU CD2 C 18.074 9.198 9.287 1.00 . A A . 12 LEU CD2 1 1
7 2080 1 1 13 LEU CG C 19.365 8.399 9.501 1.00 . A A . 12 LEU CG 1 1
7 2081 1 1 13 LEU H H 20.915 6.345 6.398 1.00 . A A . 12 LEU H 1 1
7 2082 1 1 13 LEU HA H 21.966 8.070 8.409 1.00 . A A . 12 LEU HA 1 1
7 2083 1 1 13 LEU HB2 H 19.858 8.663 7.426 1.00 . A A . 12 LEU HB2 1 1
7 2084 1 1 13 LEU HB3 H 19.169 7.088 7.811 1.00 . A A . 12 LEU HB3 1 1
7 2085 1 1 13 LEU HD11 H 20.843 9.954 9.351 1.00 . A A . 12 LEU HD11 1 1
7 2086 1 1 13 LEU HD12 H 21.223 8.707 10.538 1.00 . A A . 12 LEU HD12 1 1
7 2087 1 1 13 LEU HD13 H 19.992 9.916 10.895 1.00 . A A . 12 LEU HD13 1 1
7 2088 1 1 13 LEU HD21 H 17.326 8.560 8.839 1.00 . A A . 12 LEU HD21 1 1
7 2089 1 1 13 LEU HD22 H 18.273 10.034 8.632 1.00 . A A . 12 LEU HD22 1 1
7 2090 1 1 13 LEU HD23 H 17.715 9.562 10.238 1.00 . A A . 12 LEU HD23 1 1
7 2091 1 1 13 LEU HG H 19.172 7.572 10.170 1.00 . A A . 12 LEU HG 1 1
7 2092 1 1 13 LEU N N 21.611 6.557 7.050 1.00 . A A . 12 LEU N 1 1
7 2093 1 1 13 LEU O O 22.183 6.507 10.344 1.00 . A A . 12 LEU O 1 1
7 2094 1 1 14 ALA C C 21.888 3.735 10.673 1.00 . A A . 13 ALA C 1 1
7 2095 1 1 14 ALA CA C 20.506 4.359 10.575 1.00 . A A . 13 ALA CA 1 1
7 2096 1 1 14 ALA CB C 19.455 3.266 10.372 1.00 . A A . 13 ALA CB 1 1
7 2097 1 1 14 ALA H H 19.843 5.204 8.747 1.00 . A A . 13 ALA H 1 1
7 2098 1 1 14 ALA HA H 20.296 4.884 11.495 1.00 . A A . 13 ALA HA 1 1
7 2099 1 1 14 ALA HB1 H 18.535 3.712 10.024 1.00 . A A . 13 ALA HB1 1 1
7 2100 1 1 14 ALA HB2 H 19.279 2.762 11.311 1.00 . A A . 13 ALA HB2 1 1
7 2101 1 1 14 ALA HB3 H 19.809 2.552 9.644 1.00 . A A . 13 ALA HB3 1 1
7 2102 1 1 14 ALA N N 20.488 5.311 9.477 1.00 . A A . 13 ALA N 1 1
7 2103 1 1 14 ALA O O 22.382 3.457 11.762 1.00 . A A . 13 ALA O 1 1
7 2104 1 1 15 LEU C C 24.751 3.733 10.431 1.00 . A A . 14 LEU C 1 1
7 2105 1 1 15 LEU CA C 23.847 2.931 9.513 1.00 . A A . 14 LEU CA 1 1
7 2106 1 1 15 LEU CB C 24.398 2.900 8.074 1.00 . A A . 14 LEU CB 1 1
7 2107 1 1 15 LEU CD1 C 25.752 1.362 6.573 1.00 . A A . 14 LEU CD1 1 1
7 2108 1 1 15 LEU CD2 C 26.944 2.829 8.187 1.00 . A A . 14 LEU CD2 1 1
7 2109 1 1 15 LEU CG C 25.668 1.998 7.966 1.00 . A A . 14 LEU CG 1 1
7 2110 1 1 15 LEU H H 22.086 3.761 8.673 1.00 . A A . 14 LEU H 1 1
7 2111 1 1 15 LEU HA H 23.778 1.933 9.895 1.00 . A A . 14 LEU HA 1 1
7 2112 1 1 15 LEU HB2 H 23.620 2.517 7.425 1.00 . A A . 14 LEU HB2 1 1
7 2113 1 1 15 LEU HB3 H 24.638 3.909 7.769 1.00 . A A . 14 LEU HB3 1 1
7 2114 1 1 15 LEU HD11 H 26.608 0.703 6.531 1.00 . A A . 14 LEU HD11 1 1
7 2115 1 1 15 LEU HD12 H 25.858 2.136 5.829 1.00 . A A . 14 LEU HD12 1 1
7 2116 1 1 15 LEU HD13 H 24.852 0.797 6.380 1.00 . A A . 14 LEU HD13 1 1
7 2117 1 1 15 LEU HD21 H 26.974 3.188 9.202 1.00 . A A . 14 LEU HD21 1 1
7 2118 1 1 15 LEU HD22 H 26.953 3.668 7.508 1.00 . A A . 14 LEU HD22 1 1
7 2119 1 1 15 LEU HD23 H 27.810 2.210 8.000 1.00 . A A . 14 LEU HD23 1 1
7 2120 1 1 15 LEU HG H 25.620 1.206 8.701 1.00 . A A . 14 LEU HG 1 1
7 2121 1 1 15 LEU N N 22.518 3.520 9.523 1.00 . A A . 14 LEU N 1 1
7 2122 1 1 15 LEU O O 25.455 3.170 11.266 1.00 . A A . 14 LEU O 1 1
7 2123 1 1 16 ALA C C 25.188 5.667 12.584 1.00 . A A . 15 ALA C 1 1
7 2124 1 1 16 ALA CA C 25.544 5.902 11.120 1.00 . A A . 15 ALA CA 1 1
7 2125 1 1 16 ALA CB C 25.318 7.372 10.760 1.00 . A A . 15 ALA CB 1 1
7 2126 1 1 16 ALA H H 24.135 5.452 9.604 1.00 . A A . 15 ALA H 1 1
7 2127 1 1 16 ALA HA H 26.583 5.656 10.963 1.00 . A A . 15 ALA HA 1 1
7 2128 1 1 16 ALA HB1 H 26.004 7.989 11.320 1.00 . A A . 15 ALA HB1 1 1
7 2129 1 1 16 ALA HB2 H 24.303 7.650 11.004 1.00 . A A . 15 ALA HB2 1 1
7 2130 1 1 16 ALA HB3 H 25.485 7.514 9.703 1.00 . A A . 15 ALA HB3 1 1
7 2131 1 1 16 ALA N N 24.722 5.048 10.282 1.00 . A A . 15 ALA N 1 1
7 2132 1 1 16 ALA O O 26.002 5.893 13.479 1.00 . A A . 15 ALA O 1 1
7 2133 1 1 17 LEU C C 24.088 3.685 14.774 1.00 . A A . 16 LEU C 1 1
7 2134 1 1 17 LEU CA C 23.481 4.957 14.170 1.00 . A A . 16 LEU CA 1 1
7 2135 1 1 17 LEU CB C 21.937 4.868 14.186 1.00 . A A . 16 LEU CB 1 1
7 2136 1 1 17 LEU CD1 C 21.190 6.769 15.692 1.00 . A A . 16 LEU CD1 1 1
7 2137 1 1 17 LEU CD2 C 20.011 4.576 15.805 1.00 . A A . 16 LEU CD2 1 1
7 2138 1 1 17 LEU CG C 21.375 5.249 15.584 1.00 . A A . 16 LEU CG 1 1
7 2139 1 1 17 LEU H H 23.352 5.062 12.061 1.00 . A A . 16 LEU H 1 1
7 2140 1 1 17 LEU HA H 23.776 5.783 14.781 1.00 . A A . 16 LEU HA 1 1
7 2141 1 1 17 LEU HB2 H 21.537 5.539 13.437 1.00 . A A . 16 LEU HB2 1 1
7 2142 1 1 17 LEU HB3 H 21.638 3.857 13.943 1.00 . A A . 16 LEU HB3 1 1
7 2143 1 1 17 LEU HD11 H 21.030 7.039 16.726 1.00 . A A . 16 LEU HD11 1 1
7 2144 1 1 17 LEU HD12 H 20.334 7.071 15.107 1.00 . A A . 16 LEU HD12 1 1
7 2145 1 1 17 LEU HD13 H 22.070 7.273 15.322 1.00 . A A . 16 LEU HD13 1 1
7 2146 1 1 17 LEU HD21 H 20.151 3.513 15.938 1.00 . A A . 16 LEU HD21 1 1
7 2147 1 1 17 LEU HD22 H 19.380 4.751 14.947 1.00 . A A . 16 LEU HD22 1 1
7 2148 1 1 17 LEU HD23 H 19.543 4.991 16.686 1.00 . A A . 16 LEU HD23 1 1
7 2149 1 1 17 LEU HG H 22.066 4.922 16.351 1.00 . A A . 16 LEU HG 1 1
7 2150 1 1 17 LEU N N 23.955 5.217 12.815 1.00 . A A . 16 LEU N 1 1
7 2151 1 1 17 LEU O O 24.856 3.764 15.732 1.00 . A A . 16 LEU O 1 1
7 2152 1 1 18 TRP C C 25.737 1.022 14.397 1.00 . A A . 17 TRP C 1 1
7 2153 1 1 18 TRP CA C 24.282 1.262 14.776 1.00 . A A . 17 TRP CA 1 1
7 2154 1 1 18 TRP CB C 23.428 0.063 14.367 1.00 . A A . 17 TRP CB 1 1
7 2155 1 1 18 TRP CD1 C 22.208 0.601 12.219 1.00 . A A . 17 TRP CD1 1 1
7 2156 1 1 18 TRP CD2 C 23.988 -0.737 11.894 1.00 . A A . 17 TRP CD2 1 1
7 2157 1 1 18 TRP CE2 C 23.404 -0.522 10.626 1.00 . A A . 17 TRP CE2 1 1
7 2158 1 1 18 TRP CE3 C 25.133 -1.551 11.966 1.00 . A A . 17 TRP CE3 1 1
7 2159 1 1 18 TRP CG C 23.211 -0.011 12.891 1.00 . A A . 17 TRP CG 1 1
7 2160 1 1 18 TRP CH2 C 25.069 -1.900 9.557 1.00 . A A . 17 TRP CH2 1 1
7 2161 1 1 18 TRP CZ2 C 23.932 -1.093 9.470 1.00 . A A . 17 TRP CZ2 1 1
7 2162 1 1 18 TRP CZ3 C 25.669 -2.129 10.804 1.00 . A A . 17 TRP CZ3 1 1
7 2163 1 1 18 TRP H H 23.124 2.482 13.472 1.00 . A A . 17 TRP H 1 1
7 2164 1 1 18 TRP HA H 24.240 1.334 15.853 1.00 . A A . 17 TRP HA 1 1
7 2165 1 1 18 TRP HB2 H 23.926 -0.833 14.678 1.00 . A A . 17 TRP HB2 1 1
7 2166 1 1 18 TRP HB3 H 22.474 0.131 14.866 1.00 . A A . 17 TRP HB3 1 1
7 2167 1 1 18 TRP HD1 H 21.444 1.223 12.660 1.00 . A A . 17 TRP HD1 1 1
7 2168 1 1 18 TRP HE1 H 21.723 0.615 10.168 1.00 . A A . 17 TRP HE1 1 1
7 2169 1 1 18 TRP HE3 H 25.602 -1.733 12.921 1.00 . A A . 17 TRP HE3 1 1
7 2170 1 1 18 TRP HH2 H 25.486 -2.346 8.666 1.00 . A A . 17 TRP HH2 1 1
7 2171 1 1 18 TRP HZ2 H 23.464 -0.912 8.514 1.00 . A A . 17 TRP HZ2 1 1
7 2172 1 1 18 TRP HZ3 H 26.548 -2.753 10.870 1.00 . A A . 17 TRP HZ3 1 1
7 2173 1 1 18 TRP N N 23.744 2.511 14.232 1.00 . A A . 17 TRP N 1 1
7 2174 1 1 18 TRP NE1 N 22.323 0.297 10.875 1.00 . A A . 17 TRP NE1 1 1
7 2175 1 1 18 TRP O O 26.534 0.595 15.232 1.00 . A A . 17 TRP O 1 1
7 2176 1 1 19 TRP C C 28.416 1.778 13.689 1.00 . A A . 18 TRP C 1 1
7 2177 1 1 19 TRP CA C 27.473 1.080 12.721 1.00 . A A . 18 TRP CA 1 1
7 2178 1 1 19 TRP CB C 27.687 1.642 11.309 1.00 . A A . 18 TRP CB 1 1
7 2179 1 1 19 TRP CD1 C 29.093 -0.154 10.223 1.00 . A A . 18 TRP CD1 1 1
7 2180 1 1 19 TRP CD2 C 30.248 1.741 10.584 1.00 . A A . 18 TRP CD2 1 1
7 2181 1 1 19 TRP CE2 C 31.143 0.828 9.978 1.00 . A A . 18 TRP CE2 1 1
7 2182 1 1 19 TRP CE3 C 30.731 3.020 10.916 1.00 . A A . 18 TRP CE3 1 1
7 2183 1 1 19 TRP CG C 28.952 1.091 10.728 1.00 . A A . 18 TRP CG 1 1
7 2184 1 1 19 TRP CH2 C 32.932 2.443 10.046 1.00 . A A . 18 TRP CH2 1 1
7 2185 1 1 19 TRP CZ2 C 32.466 1.168 9.710 1.00 . A A . 18 TRP CZ2 1 1
7 2186 1 1 19 TRP CZ3 C 32.066 3.368 10.647 1.00 . A A . 18 TRP CZ3 1 1
7 2187 1 1 19 TRP H H 25.425 1.626 12.521 1.00 . A A . 18 TRP H 1 1
7 2188 1 1 19 TRP HA H 27.683 0.020 12.718 1.00 . A A . 18 TRP HA 1 1
7 2189 1 1 19 TRP HB2 H 26.855 1.365 10.684 1.00 . A A . 18 TRP HB2 1 1
7 2190 1 1 19 TRP HB3 H 27.756 2.720 11.357 1.00 . A A . 18 TRP HB3 1 1
7 2191 1 1 19 TRP HD1 H 28.317 -0.902 10.177 1.00 . A A . 18 TRP HD1 1 1
7 2192 1 1 19 TRP HE1 H 30.758 -1.123 9.367 1.00 . A A . 18 TRP HE1 1 1
7 2193 1 1 19 TRP HE3 H 30.071 3.739 11.379 1.00 . A A . 18 TRP HE3 1 1
7 2194 1 1 19 TRP HH2 H 33.956 2.716 9.843 1.00 . A A . 18 TRP HH2 1 1
7 2195 1 1 19 TRP HZ2 H 33.127 0.451 9.247 1.00 . A A . 18 TRP HZ2 1 1
7 2196 1 1 19 TRP HZ3 H 32.426 4.352 10.906 1.00 . A A . 18 TRP HZ3 1 1
7 2197 1 1 19 TRP N N 26.092 1.289 13.151 1.00 . A A . 18 TRP N 1 1
7 2198 1 1 19 TRP NE1 N 30.393 -0.312 9.777 1.00 . A A . 18 TRP NE1 1 1
7 2199 1 1 19 TRP O O 29.343 1.171 14.225 1.00 . A A . 18 TRP O 1 1
7 2200 1 1 20 ALA C C 28.357 3.880 16.205 1.00 . A A . 19 ALA C 1 1
7 2201 1 1 20 ALA CA C 28.972 3.876 14.812 1.00 . A A . 19 ALA CA 1 1
7 2202 1 1 20 ALA CB C 29.067 5.311 14.288 1.00 . A A . 19 ALA CB 1 1
7 2203 1 1 20 ALA H H 27.406 3.478 13.447 1.00 . A A . 19 ALA H 1 1
7 2204 1 1 20 ALA HA H 29.961 3.462 14.874 1.00 . A A . 19 ALA HA 1 1
7 2205 1 1 20 ALA HB1 H 29.259 5.293 13.225 1.00 . A A . 19 ALA HB1 1 1
7 2206 1 1 20 ALA HB2 H 29.874 5.824 14.790 1.00 . A A . 19 ALA HB2 1 1
7 2207 1 1 20 ALA HB3 H 28.138 5.827 14.477 1.00 . A A . 19 ALA HB3 1 1
7 2208 1 1 20 ALA N N 28.161 3.065 13.907 1.00 . A A . 19 ALA N 1 1
7 2209 1 1 20 ALA O O 28.507 4.837 16.964 1.00 . A A . 19 ALA O 1 1
7 2210 1 1 21 ETA CA C 27.022 2.669 17.830 1.00 . A A . 20 ETA CA 1 1
7 2211 1 1 21 ETA CB C 26.700 1.205 18.124 1.00 . A A . 20 ETA CB 1 1
7 2212 1 1 21 ETA HA1 H 26.103 3.236 17.834 1.00 . A A . 20 ETA HA1 1 1
7 2213 1 1 21 ETA HA2 H 27.686 3.053 18.593 1.00 . A A . 20 ETA HA2 1 1
7 2214 1 1 21 ETA HB1 H 25.824 0.911 17.558 1.00 . A A . 20 ETA HB1 1 1
7 2215 1 1 21 ETA HB2 H 26.501 1.080 19.172 1.00 . A A . 20 ETA HB2 1 1
7 2216 1 1 21 ETA HN2 H 27.583 2.071 15.873 1.00 . A A . 20 ETA HN2 1 1
7 2217 1 1 21 ETA HO H 28.199 0.763 16.962 1.00 . A A . 20 ETA HO 1 1
7 2218 1 1 21 ETA N N 27.664 2.798 16.527 1.00 . A A . 20 ETA N 1 1
7 2219 1 1 21 ETA O O 27.820 0.402 17.768 1.00 . A A . 20 ETA O 1 1
8 2220 1 1 1 ACE C C 22.984 -4.518 -9.430 1.00 . A A . 0 ACE C 1 1
8 2221 1 1 1 ACE CH3 C 23.721 -5.483 -8.508 1.00 . A A . 0 ACE CH3 1 1
8 2222 1 1 1 ACE H1 H 23.224 -5.517 -7.548 1.00 . A A . 0 ACE H1 1 1
8 2223 1 1 1 ACE H2 H 24.740 -5.151 -8.376 1.00 . A A . 0 ACE H2 1 1
8 2224 1 1 1 ACE H3 H 23.719 -6.471 -8.946 1.00 . A A . 0 ACE H3 1 1
8 2225 1 1 1 ACE O O 23.169 -4.545 -10.646 1.00 . A A . 0 ACE O 1 1
8 2226 1 1 2 GLY C C 20.777 -1.665 -8.706 1.00 . A A . 1 GLY C 1 1
8 2227 1 1 2 GLY CA C 21.390 -2.703 -9.618 1.00 . A A . 1 GLY CA 1 1
8 2228 1 1 2 GLY H H 22.030 -3.681 -7.876 1.00 . A A . 1 GLY H 1 1
8 2229 1 1 2 GLY HA2 H 22.031 -2.221 -10.332 1.00 . A A . 1 GLY HA2 1 1
8 2230 1 1 2 GLY HA3 H 20.593 -3.220 -10.136 1.00 . A A . 1 GLY HA3 1 1
8 2231 1 1 2 GLY N N 22.145 -3.665 -8.846 1.00 . A A . 1 GLY N 1 1
8 2232 1 1 2 GLY O O 21.422 -1.118 -7.818 1.00 . A A . 1 GLY O 1 1
8 2233 1 1 3 TRP C C 18.532 -1.015 -6.751 1.00 . A A . 2 TRP C 1 1
8 2234 1 1 3 TRP CA C 18.783 -0.438 -8.144 1.00 . A A . 2 TRP CA 1 1
8 2235 1 1 3 TRP CB C 17.460 -0.019 -8.851 1.00 . A A . 2 TRP CB 1 1
8 2236 1 1 3 TRP CD1 C 17.095 -2.403 -9.370 1.00 . A A . 2 TRP CD1 1 1
8 2237 1 1 3 TRP CD2 C 16.365 -1.095 -11.029 1.00 . A A . 2 TRP CD2 1 1
8 2238 1 1 3 TRP CE2 C 16.113 -2.428 -11.428 1.00 . A A . 2 TRP CE2 1 1
8 2239 1 1 3 TRP CE3 C 15.995 -0.058 -11.904 1.00 . A A . 2 TRP CE3 1 1
8 2240 1 1 3 TRP CG C 16.992 -1.128 -9.715 1.00 . A A . 2 TRP CG 1 1
8 2241 1 1 3 TRP CH2 C 15.153 -1.686 -13.510 1.00 . A A . 2 TRP CH2 1 1
8 2242 1 1 3 TRP CZ2 C 15.516 -2.726 -12.649 1.00 . A A . 2 TRP CZ2 1 1
8 2243 1 1 3 TRP CZ3 C 15.392 -0.354 -13.139 1.00 . A A . 2 TRP CZ3 1 1
8 2244 1 1 3 TRP H H 19.086 -1.885 -9.656 1.00 . A A . 2 TRP H 1 1
8 2245 1 1 3 TRP HA H 19.398 0.425 -8.020 1.00 . A A . 2 TRP HA 1 1
8 2246 1 1 3 TRP HB2 H 16.702 0.197 -8.117 1.00 . A A . 2 TRP HB2 1 1
8 2247 1 1 3 TRP HB3 H 17.633 0.857 -9.459 1.00 . A A . 2 TRP HB3 1 1
8 2248 1 1 3 TRP HD1 H 17.521 -2.736 -8.447 1.00 . A A . 2 TRP HD1 1 1
8 2249 1 1 3 TRP HE1 H 16.541 -4.168 -10.371 1.00 . A A . 2 TRP HE1 1 1
8 2250 1 1 3 TRP HE3 H 16.176 0.970 -11.627 1.00 . A A . 2 TRP HE3 1 1
8 2251 1 1 3 TRP HH2 H 14.688 -1.907 -14.460 1.00 . A A . 2 TRP HH2 1 1
8 2252 1 1 3 TRP HZ2 H 15.336 -3.754 -12.927 1.00 . A A . 2 TRP HZ2 1 1
8 2253 1 1 3 TRP HZ3 H 15.110 0.448 -13.804 1.00 . A A . 2 TRP HZ3 1 1
8 2254 1 1 3 TRP N N 19.522 -1.407 -8.939 1.00 . A A . 2 TRP N 1 1
8 2255 1 1 3 TRP NE1 N 16.580 -3.192 -10.379 1.00 . A A . 2 TRP NE1 1 1
8 2256 1 1 3 TRP O O 17.772 -0.453 -5.963 1.00 . A A . 2 TRP O 1 1
8 2257 1 1 4 TRP C C 19.897 -2.073 -4.125 1.00 . A A . 3 TRP C 1 1
8 2258 1 1 4 TRP CA C 19.033 -2.789 -5.150 1.00 . A A . 3 TRP CA 1 1
8 2259 1 1 4 TRP CB C 19.427 -4.278 -5.202 1.00 . A A . 3 TRP CB 1 1
8 2260 1 1 4 TRP CD1 C 19.848 -5.569 -7.325 1.00 . A A . 3 TRP CD1 1 1
8 2261 1 1 4 TRP CD2 C 17.709 -4.924 -7.135 1.00 . A A . 3 TRP CD2 1 1
8 2262 1 1 4 TRP CE2 C 17.815 -5.634 -8.354 1.00 . A A . 3 TRP CE2 1 1
8 2263 1 1 4 TRP CE3 C 16.452 -4.407 -6.782 1.00 . A A . 3 TRP CE3 1 1
8 2264 1 1 4 TRP CG C 19.016 -4.897 -6.500 1.00 . A A . 3 TRP CG 1 1
8 2265 1 1 4 TRP CH2 C 15.475 -5.301 -8.819 1.00 . A A . 3 TRP CH2 1 1
8 2266 1 1 4 TRP CZ2 C 16.717 -5.825 -9.188 1.00 . A A . 3 TRP CZ2 1 1
8 2267 1 1 4 TRP CZ3 C 15.347 -4.594 -7.616 1.00 . A A . 3 TRP CZ3 1 1
8 2268 1 1 4 TRP H H 19.780 -2.548 -7.115 1.00 . A A . 3 TRP H 1 1
8 2269 1 1 4 TRP HA H 18.017 -2.706 -4.846 1.00 . A A . 3 TRP HA 1 1
8 2270 1 1 4 TRP HB2 H 20.494 -4.373 -5.099 1.00 . A A . 3 TRP HB2 1 1
8 2271 1 1 4 TRP HB3 H 18.943 -4.804 -4.388 1.00 . A A . 3 TRP HB3 1 1
8 2272 1 1 4 TRP HD1 H 20.896 -5.734 -7.152 1.00 . A A . 3 TRP HD1 1 1
8 2273 1 1 4 TRP HE1 H 19.508 -6.517 -9.172 1.00 . A A . 3 TRP HE1 1 1
8 2274 1 1 4 TRP HE3 H 16.333 -3.861 -5.868 1.00 . A A . 3 TRP HE3 1 1
8 2275 1 1 4 TRP HH2 H 14.617 -5.442 -9.459 1.00 . A A . 3 TRP HH2 1 1
8 2276 1 1 4 TRP HZ2 H 16.827 -6.372 -10.113 1.00 . A A . 3 TRP HZ2 1 1
8 2277 1 1 4 TRP HZ3 H 14.396 -4.185 -7.329 1.00 . A A . 3 TRP HZ3 1 1
8 2278 1 1 4 TRP N N 19.187 -2.147 -6.452 1.00 . A A . 3 TRP N 1 1
8 2279 1 1 4 TRP NE1 N 19.137 -6.006 -8.425 1.00 . A A . 3 TRP NE1 1 1
8 2280 1 1 4 TRP O O 19.410 -1.589 -3.104 1.00 . A A . 3 TRP O 1 1
8 2281 1 1 5 LEU C C 21.620 0.054 -3.245 1.00 . A A . 4 LEU C 1 1
8 2282 1 1 5 LEU CA C 22.124 -1.357 -3.528 1.00 . A A . 4 LEU CA 1 1
8 2283 1 1 5 LEU CB C 23.532 -1.313 -4.160 1.00 . A A . 4 LEU CB 1 1
8 2284 1 1 5 LEU CD1 C 23.713 -2.630 -6.361 1.00 . A A . 4 LEU CD1 1 1
8 2285 1 1 5 LEU CD2 C 25.357 -3.069 -4.549 1.00 . A A . 4 LEU CD2 1 1
8 2286 1 1 5 LEU CG C 23.894 -2.689 -4.838 1.00 . A A . 4 LEU CG 1 1
8 2287 1 1 5 LEU H H 21.508 -2.416 -5.244 1.00 . A A . 4 LEU H 1 1
8 2288 1 1 5 LEU HA H 22.168 -1.911 -2.604 1.00 . A A . 4 LEU HA 1 1
8 2289 1 1 5 LEU HB2 H 23.561 -0.511 -4.890 1.00 . A A . 4 LEU HB2 1 1
8 2290 1 1 5 LEU HB3 H 24.245 -1.094 -3.375 1.00 . A A . 4 LEU HB3 1 1
8 2291 1 1 5 LEU HD11 H 24.178 -1.738 -6.757 1.00 . A A . 4 LEU HD11 1 1
8 2292 1 1 5 LEU HD12 H 22.669 -2.623 -6.589 1.00 . A A . 4 LEU HD12 1 1
8 2293 1 1 5 LEU HD13 H 24.166 -3.499 -6.815 1.00 . A A . 4 LEU HD13 1 1
8 2294 1 1 5 LEU HD21 H 25.468 -3.308 -3.503 1.00 . A A . 4 LEU HD21 1 1
8 2295 1 1 5 LEU HD22 H 26.000 -2.240 -4.801 1.00 . A A . 4 LEU HD22 1 1
8 2296 1 1 5 LEU HD23 H 25.625 -3.928 -5.147 1.00 . A A . 4 LEU HD23 1 1
8 2297 1 1 5 LEU HG H 23.244 -3.470 -4.458 1.00 . A A . 4 LEU HG 1 1
8 2298 1 1 5 LEU N N 21.186 -2.013 -4.416 1.00 . A A . 4 LEU N 1 1
8 2299 1 1 5 LEU O O 21.901 0.635 -2.198 1.00 . A A . 4 LEU O 1 1
8 2300 1 1 6 ALA C C 19.559 2.088 -2.769 1.00 . A A . 5 ALA C 1 1
8 2301 1 1 6 ALA CA C 20.305 1.926 -4.092 1.00 . A A . 5 ALA CA 1 1
8 2302 1 1 6 ALA CB C 19.335 2.169 -5.252 1.00 . A A . 5 ALA CB 1 1
8 2303 1 1 6 ALA H H 20.686 0.061 -5.012 1.00 . A A . 5 ALA H 1 1
8 2304 1 1 6 ALA HA H 21.098 2.654 -4.146 1.00 . A A . 5 ALA HA 1 1
8 2305 1 1 6 ALA HB1 H 18.414 1.628 -5.072 1.00 . A A . 5 ALA HB1 1 1
8 2306 1 1 6 ALA HB2 H 19.779 1.820 -6.172 1.00 . A A . 5 ALA HB2 1 1
8 2307 1 1 6 ALA HB3 H 19.123 3.223 -5.331 1.00 . A A . 5 ALA HB3 1 1
8 2308 1 1 6 ALA N N 20.868 0.586 -4.204 1.00 . A A . 5 ALA N 1 1
8 2309 1 1 6 ALA O O 19.156 3.193 -2.405 1.00 . A A . 5 ALA O 1 1
8 2310 1 1 7 LEU C C 19.646 1.285 0.377 1.00 . A A . 6 LEU C 1 1
8 2311 1 1 7 LEU CA C 18.680 0.996 -0.772 1.00 . A A . 6 LEU CA 1 1
8 2312 1 1 7 LEU CB C 18.010 -0.361 -0.543 1.00 . A A . 6 LEU CB 1 1
8 2313 1 1 7 LEU CD1 C 16.755 -2.180 -1.745 1.00 . A A . 6 LEU CD1 1 1
8 2314 1 1 7 LEU CD2 C 15.688 0.055 -1.464 1.00 . A A . 6 LEU CD2 1 1
8 2315 1 1 7 LEU CG C 17.023 -0.674 -1.689 1.00 . A A . 6 LEU CG 1 1
8 2316 1 1 7 LEU H H 19.716 0.131 -2.389 1.00 . A A . 6 LEU H 1 1
8 2317 1 1 7 LEU HA H 17.920 1.755 -0.789 1.00 . A A . 6 LEU HA 1 1
8 2318 1 1 7 LEU HB2 H 18.777 -1.126 -0.504 1.00 . A A . 6 LEU HB2 1 1
8 2319 1 1 7 LEU HB3 H 17.481 -0.342 0.394 1.00 . A A . 6 LEU HB3 1 1
8 2320 1 1 7 LEU HD11 H 16.101 -2.399 -2.577 1.00 . A A . 6 LEU HD11 1 1
8 2321 1 1 7 LEU HD12 H 16.284 -2.497 -0.826 1.00 . A A . 6 LEU HD12 1 1
8 2322 1 1 7 LEU HD13 H 17.688 -2.709 -1.871 1.00 . A A . 6 LEU HD13 1 1
8 2323 1 1 7 LEU HD21 H 14.965 -0.299 -2.185 1.00 . A A . 6 LEU HD21 1 1
8 2324 1 1 7 LEU HD22 H 15.826 1.116 -1.589 1.00 . A A . 6 LEU HD22 1 1
8 2325 1 1 7 LEU HD23 H 15.325 -0.147 -0.467 1.00 . A A . 6 LEU HD23 1 1
8 2326 1 1 7 LEU HG H 17.455 -0.359 -2.630 1.00 . A A . 6 LEU HG 1 1
8 2327 1 1 7 LEU N N 19.377 0.979 -2.052 1.00 . A A . 6 LEU N 1 1
8 2328 1 1 7 LEU O O 19.240 1.790 1.425 1.00 . A A . 6 LEU O 1 1
8 2329 1 1 8 ALA C C 22.024 2.695 1.555 1.00 . A A . 7 ALA C 1 1
8 2330 1 1 8 ALA CA C 21.925 1.194 1.219 1.00 . A A . 7 ALA CA 1 1
8 2331 1 1 8 ALA CB C 23.296 0.605 0.771 1.00 . A A . 7 ALA CB 1 1
8 2332 1 1 8 ALA H H 21.193 0.559 -0.669 1.00 . A A . 7 ALA H 1 1
8 2333 1 1 8 ALA HA H 21.599 0.679 2.114 1.00 . A A . 7 ALA HA 1 1
8 2334 1 1 8 ALA HB1 H 23.539 -0.272 1.360 1.00 . A A . 7 ALA HB1 1 1
8 2335 1 1 8 ALA HB2 H 24.086 1.336 0.889 1.00 . A A . 7 ALA HB2 1 1
8 2336 1 1 8 ALA HB3 H 23.232 0.320 -0.270 1.00 . A A . 7 ALA HB3 1 1
8 2337 1 1 8 ALA N N 20.922 0.962 0.181 1.00 . A A . 7 ALA N 1 1
8 2338 1 1 8 ALA O O 21.877 3.079 2.715 1.00 . A A . 7 ALA O 1 1
8 2339 1 1 9 PRO C C 21.322 5.529 1.800 1.00 . A A . 8 PRO C 1 1
8 2340 1 1 9 PRO CA C 22.376 5.018 0.816 1.00 . A A . 8 PRO CA 1 1
8 2341 1 1 9 PRO CB C 22.148 5.594 -0.582 1.00 . A A . 8 PRO CB 1 1
8 2342 1 1 9 PRO CD C 22.461 3.214 -0.843 1.00 . A A . 8 PRO CD 1 1
8 2343 1 1 9 PRO CG C 22.740 4.576 -1.500 1.00 . A A . 8 PRO CG 1 1
8 2344 1 1 9 PRO HA H 23.364 5.279 1.144 1.00 . A A . 8 PRO HA 1 1
8 2345 1 1 9 PRO HB2 H 21.083 5.710 -0.774 1.00 . A A . 8 PRO HB2 1 1
8 2346 1 1 9 PRO HB3 H 22.655 6.531 -0.696 1.00 . A A . 8 PRO HB3 1 1
8 2347 1 1 9 PRO HD2 H 21.567 2.774 -1.262 1.00 . A A . 8 PRO HD2 1 1
8 2348 1 1 9 PRO HD3 H 23.302 2.553 -0.956 1.00 . A A . 8 PRO HD3 1 1
8 2349 1 1 9 PRO HG2 H 22.271 4.641 -2.479 1.00 . A A . 8 PRO HG2 1 1
8 2350 1 1 9 PRO HG3 H 23.808 4.720 -1.586 1.00 . A A . 8 PRO HG3 1 1
8 2351 1 1 9 PRO N N 22.265 3.543 0.583 1.00 . A A . 8 PRO N 1 1
8 2352 1 1 9 PRO O O 21.636 6.219 2.768 1.00 . A A . 8 PRO O 1 1
8 2353 1 1 10 ALA C C 19.137 5.053 3.805 1.00 . A A . 9 ALA C 1 1
8 2354 1 1 10 ALA CA C 18.971 5.601 2.389 1.00 . A A . 9 ALA CA 1 1
8 2355 1 1 10 ALA CB C 17.644 5.115 1.806 1.00 . A A . 9 ALA CB 1 1
8 2356 1 1 10 ALA H H 19.894 4.630 0.745 1.00 . A A . 9 ALA H 1 1
8 2357 1 1 10 ALA HA H 18.954 6.677 2.431 1.00 . A A . 9 ALA HA 1 1
8 2358 1 1 10 ALA HB1 H 17.659 4.038 1.724 1.00 . A A . 9 ALA HB1 1 1
8 2359 1 1 10 ALA HB2 H 17.502 5.548 0.826 1.00 . A A . 9 ALA HB2 1 1
8 2360 1 1 10 ALA HB3 H 16.835 5.416 2.453 1.00 . A A . 9 ALA HB3 1 1
8 2361 1 1 10 ALA N N 20.076 5.180 1.534 1.00 . A A . 9 ALA N 1 1
8 2362 1 1 10 ALA O O 18.580 5.599 4.758 1.00 . A A . 9 ALA O 1 1
8 2363 1 1 11 LEU C C 21.372 3.985 5.873 1.00 . A A . 10 LEU C 1 1
8 2364 1 1 11 LEU CA C 20.149 3.340 5.234 1.00 . A A . 10 LEU CA 1 1
8 2365 1 1 11 LEU CB C 20.287 1.794 4.991 1.00 . A A . 10 LEU CB 1 1
8 2366 1 1 11 LEU CD1 C 21.032 1.023 7.293 1.00 . A A . 10 LEU CD1 1 1
8 2367 1 1 11 LEU CD2 C 21.646 -0.291 5.237 1.00 . A A . 10 LEU CD2 1 1
8 2368 1 1 11 LEU CG C 21.418 1.124 5.801 1.00 . A A . 10 LEU CG 1 1
8 2369 1 1 11 LEU H H 20.325 3.575 3.154 1.00 . A A . 10 LEU H 1 1
8 2370 1 1 11 LEU HA H 19.319 3.529 5.868 1.00 . A A . 10 LEU HA 1 1
8 2371 1 1 11 LEU HB2 H 19.358 1.308 5.247 1.00 . A A . 10 LEU HB2 1 1
8 2372 1 1 11 LEU HB3 H 20.469 1.633 3.936 1.00 . A A . 10 LEU HB3 1 1
8 2373 1 1 11 LEU HD11 H 20.446 0.131 7.470 1.00 . A A . 10 LEU HD11 1 1
8 2374 1 1 11 LEU HD12 H 20.450 1.883 7.578 1.00 . A A . 10 LEU HD12 1 1
8 2375 1 1 11 LEU HD13 H 21.929 0.985 7.891 1.00 . A A . 10 LEU HD13 1 1
8 2376 1 1 11 LEU HD21 H 20.705 -0.817 5.194 1.00 . A A . 10 LEU HD21 1 1
8 2377 1 1 11 LEU HD22 H 22.330 -0.827 5.878 1.00 . A A . 10 LEU HD22 1 1
8 2378 1 1 11 LEU HD23 H 22.066 -0.219 4.245 1.00 . A A . 10 LEU HD23 1 1
8 2379 1 1 11 LEU HG H 22.329 1.692 5.697 1.00 . A A . 10 LEU HG 1 1
8 2380 1 1 11 LEU N N 19.907 3.968 3.941 1.00 . A A . 10 LEU N 1 1
8 2381 1 1 11 LEU O O 21.667 3.796 7.050 1.00 . A A . 10 LEU O 1 1
8 2382 1 1 12 ALA C C 23.014 6.187 6.817 1.00 . A A . 11 ALA C 1 1
8 2383 1 1 12 ALA CA C 23.272 5.432 5.520 1.00 . A A . 11 ALA CA 1 1
8 2384 1 1 12 ALA CB C 23.763 6.405 4.448 1.00 . A A . 11 ALA CB 1 1
8 2385 1 1 12 ALA H H 21.760 4.834 4.153 1.00 . A A . 11 ALA H 1 1
8 2386 1 1 12 ALA HA H 24.041 4.699 5.697 1.00 . A A . 11 ALA HA 1 1
8 2387 1 1 12 ALA HB1 H 23.848 5.889 3.503 1.00 . A A . 11 ALA HB1 1 1
8 2388 1 1 12 ALA HB2 H 24.729 6.795 4.732 1.00 . A A . 11 ALA HB2 1 1
8 2389 1 1 12 ALA HB3 H 23.061 7.221 4.352 1.00 . A A . 11 ALA HB3 1 1
8 2390 1 1 12 ALA N N 22.067 4.741 5.069 1.00 . A A . 11 ALA N 1 1
8 2391 1 1 12 ALA O O 23.917 6.352 7.637 1.00 . A A . 11 ALA O 1 1
8 2392 1 1 13 LEU C C 21.469 6.433 9.409 1.00 . A A . 12 LEU C 1 1
8 2393 1 1 13 LEU CA C 21.438 7.376 8.211 1.00 . A A . 12 LEU CA 1 1
8 2394 1 1 13 LEU CB C 20.047 8.021 8.062 1.00 . A A . 12 LEU CB 1 1
8 2395 1 1 13 LEU CD1 C 18.565 9.922 8.727 1.00 . A A . 12 LEU CD1 1 1
8 2396 1 1 13 LEU CD2 C 19.978 8.785 10.461 1.00 . A A . 12 LEU CD2 1 1
8 2397 1 1 13 LEU CG C 19.908 9.237 8.991 1.00 . A A . 12 LEU CG 1 1
8 2398 1 1 13 LEU H H 21.098 6.486 6.322 1.00 . A A . 12 LEU H 1 1
8 2399 1 1 13 LEU HA H 22.174 8.148 8.362 1.00 . A A . 12 LEU HA 1 1
8 2400 1 1 13 LEU HB2 H 19.916 8.341 7.039 1.00 . A A . 12 LEU HB2 1 1
8 2401 1 1 13 LEU HB3 H 19.282 7.298 8.307 1.00 . A A . 12 LEU HB3 1 1
8 2402 1 1 13 LEU HD11 H 18.528 10.259 7.702 1.00 . A A . 12 LEU HD11 1 1
8 2403 1 1 13 LEU HD12 H 18.457 10.768 9.389 1.00 . A A . 12 LEU HD12 1 1
8 2404 1 1 13 LEU HD13 H 17.763 9.222 8.905 1.00 . A A . 12 LEU HD13 1 1
8 2405 1 1 13 LEU HD21 H 19.555 9.550 11.098 1.00 . A A . 12 LEU HD21 1 1
8 2406 1 1 13 LEU HD22 H 21.008 8.624 10.738 1.00 . A A . 12 LEU HD22 1 1
8 2407 1 1 13 LEU HD23 H 19.423 7.865 10.586 1.00 . A A . 12 LEU HD23 1 1
8 2408 1 1 13 LEU HG H 20.710 9.934 8.783 1.00 . A A . 12 LEU HG 1 1
8 2409 1 1 13 LEU N N 21.782 6.643 7.003 1.00 . A A . 12 LEU N 1 1
8 2410 1 1 13 LEU O O 22.271 6.612 10.325 1.00 . A A . 12 LEU O 1 1
8 2411 1 1 14 ALA C C 21.922 3.805 10.621 1.00 . A A . 13 ALA C 1 1
8 2412 1 1 14 ALA CA C 20.564 4.483 10.495 1.00 . A A . 13 ALA CA 1 1
8 2413 1 1 14 ALA CB C 19.460 3.441 10.274 1.00 . A A . 13 ALA CB 1 1
8 2414 1 1 14 ALA H H 19.983 5.329 8.641 1.00 . A A . 13 ALA H 1 1
8 2415 1 1 14 ALA HA H 20.360 5.021 11.409 1.00 . A A . 13 ALA HA 1 1
8 2416 1 1 14 ALA HB1 H 19.429 3.167 9.234 1.00 . A A . 13 ALA HB1 1 1
8 2417 1 1 14 ALA HB2 H 18.508 3.860 10.562 1.00 . A A . 13 ALA HB2 1 1
8 2418 1 1 14 ALA HB3 H 19.660 2.561 10.874 1.00 . A A . 13 ALA HB3 1 1
8 2419 1 1 14 ALA N N 20.600 5.431 9.397 1.00 . A A . 13 ALA N 1 1
8 2420 1 1 14 ALA O O 22.372 3.496 11.722 1.00 . A A . 13 ALA O 1 1
8 2421 1 1 15 LEU C C 24.796 3.732 10.441 1.00 . A A . 14 LEU C 1 1
8 2422 1 1 15 LEU CA C 23.886 2.941 9.520 1.00 . A A . 14 LEU CA 1 1
8 2423 1 1 15 LEU CB C 24.466 2.862 8.095 1.00 . A A . 14 LEU CB 1 1
8 2424 1 1 15 LEU CD1 C 25.811 1.249 6.664 1.00 . A A . 14 LEU CD1 1 1
8 2425 1 1 15 LEU CD2 C 27.008 2.737 8.256 1.00 . A A . 14 LEU CD2 1 1
8 2426 1 1 15 LEU CG C 25.717 1.929 8.037 1.00 . A A . 14 LEU CG 1 1
8 2427 1 1 15 LEU H H 22.190 3.842 8.628 1.00 . A A . 14 LEU H 1 1
8 2428 1 1 15 LEU HA H 23.774 1.952 9.921 1.00 . A A . 14 LEU HA 1 1
8 2429 1 1 15 LEU HB2 H 23.693 2.481 7.439 1.00 . A A . 14 LEU HB2 1 1
8 2430 1 1 15 LEU HB3 H 24.737 3.856 7.772 1.00 . A A . 14 LEU HB3 1 1
8 2431 1 1 15 LEU HD11 H 24.929 0.649 6.499 1.00 . A A . 14 LEU HD11 1 1
8 2432 1 1 15 LEU HD12 H 26.687 0.617 6.635 1.00 . A A . 14 LEU HD12 1 1
8 2433 1 1 15 LEU HD13 H 25.885 2.002 5.894 1.00 . A A . 14 LEU HD13 1 1
8 2434 1 1 15 LEU HD21 H 27.048 3.552 7.549 1.00 . A A . 14 LEU HD21 1 1
8 2435 1 1 15 LEU HD22 H 27.863 2.094 8.106 1.00 . A A . 14 LEU HD22 1 1
8 2436 1 1 15 LEU HD23 H 27.028 3.127 9.259 1.00 . A A . 14 LEU HD23 1 1
8 2437 1 1 15 LEU HG H 25.639 1.160 8.794 1.00 . A A . 14 LEU HG 1 1
8 2438 1 1 15 LEU N N 22.582 3.577 9.489 1.00 . A A . 14 LEU N 1 1
8 2439 1 1 15 LEU O O 25.461 3.164 11.305 1.00 . A A . 14 LEU O 1 1
8 2440 1 1 16 ALA C C 25.257 5.697 12.559 1.00 . A A . 15 ALA C 1 1
8 2441 1 1 16 ALA CA C 25.650 5.888 11.098 1.00 . A A . 15 ALA CA 1 1
8 2442 1 1 16 ALA CB C 25.480 7.356 10.704 1.00 . A A . 15 ALA CB 1 1
8 2443 1 1 16 ALA H H 24.261 5.452 9.560 1.00 . A A . 15 ALA H 1 1
8 2444 1 1 16 ALA HA H 26.683 5.605 10.969 1.00 . A A . 15 ALA HA 1 1
8 2445 1 1 16 ALA HB1 H 25.664 7.468 9.644 1.00 . A A . 15 ALA HB1 1 1
8 2446 1 1 16 ALA HB2 H 26.182 7.962 11.256 1.00 . A A . 15 ALA HB2 1 1
8 2447 1 1 16 ALA HB3 H 24.473 7.675 10.929 1.00 . A A . 15 ALA HB3 1 1
8 2448 1 1 16 ALA N N 24.818 5.043 10.261 1.00 . A A . 15 ALA N 1 1
8 2449 1 1 16 ALA O O 26.060 5.913 13.466 1.00 . A A . 15 ALA O 1 1
8 2450 1 1 17 LEU C C 24.064 3.812 14.763 1.00 . A A . 16 LEU C 1 1
8 2451 1 1 17 LEU CA C 23.493 5.080 14.118 1.00 . A A . 16 LEU CA 1 1
8 2452 1 1 17 LEU CB C 21.949 5.016 14.088 1.00 . A A . 16 LEU CB 1 1
8 2453 1 1 17 LEU CD1 C 19.828 5.329 15.379 1.00 . A A . 16 LEU CD1 1 1
8 2454 1 1 17 LEU CD2 C 21.911 4.608 16.569 1.00 . A A . 16 LEU CD2 1 1
8 2455 1 1 17 LEU CG C 21.351 5.473 15.429 1.00 . A A . 16 LEU CG 1 1
8 2456 1 1 17 LEU H H 23.413 5.145 12.007 1.00 . A A . 16 LEU H 1 1
8 2457 1 1 17 LEU HA H 23.784 5.919 14.716 1.00 . A A . 16 LEU HA 1 1
8 2458 1 1 17 LEU HB2 H 21.587 5.662 13.304 1.00 . A A . 16 LEU HB2 1 1
8 2459 1 1 17 LEU HB3 H 21.631 4.004 13.886 1.00 . A A . 16 LEU HB3 1 1
8 2460 1 1 17 LEU HD11 H 19.570 4.312 15.124 1.00 . A A . 16 LEU HD11 1 1
8 2461 1 1 17 LEU HD12 H 19.427 6.000 14.634 1.00 . A A . 16 LEU HD12 1 1
8 2462 1 1 17 LEU HD13 H 19.412 5.574 16.345 1.00 . A A . 16 LEU HD13 1 1
8 2463 1 1 17 LEU HD21 H 22.911 4.938 16.812 1.00 . A A . 16 LEU HD21 1 1
8 2464 1 1 17 LEU HD22 H 21.937 3.574 16.262 1.00 . A A . 16 LEU HD22 1 1
8 2465 1 1 17 LEU HD23 H 21.282 4.707 17.444 1.00 . A A . 16 LEU HD23 1 1
8 2466 1 1 17 LEU HG H 21.606 6.511 15.597 1.00 . A A . 16 LEU HG 1 1
8 2467 1 1 17 LEU N N 24.005 5.294 12.771 1.00 . A A . 16 LEU N 1 1
8 2468 1 1 17 LEU O O 24.813 3.900 15.737 1.00 . A A . 16 LEU O 1 1
8 2469 1 1 18 TRP C C 25.672 1.116 14.480 1.00 . A A . 17 TRP C 1 1
8 2470 1 1 18 TRP CA C 24.215 1.388 14.824 1.00 . A A . 17 TRP CA 1 1
8 2471 1 1 18 TRP CB C 23.351 0.193 14.422 1.00 . A A . 17 TRP CB 1 1
8 2472 1 1 18 TRP CD1 C 22.203 0.580 12.205 1.00 . A A . 17 TRP CD1 1 1
8 2473 1 1 18 TRP CD2 C 24.080 -0.643 12.007 1.00 . A A . 17 TRP CD2 1 1
8 2474 1 1 18 TRP CE2 C 23.544 -0.510 10.706 1.00 . A A . 17 TRP CE2 1 1
8 2475 1 1 18 TRP CE3 C 25.271 -1.376 12.160 1.00 . A A . 17 TRP CE3 1 1
8 2476 1 1 18 TRP CG C 23.210 0.059 12.941 1.00 . A A . 17 TRP CG 1 1
8 2477 1 1 18 TRP CH2 C 25.347 -1.804 9.764 1.00 . A A . 17 TRP CH2 1 1
8 2478 1 1 18 TRP CZ2 C 24.163 -1.079 9.596 1.00 . A A . 17 TRP CZ2 1 1
8 2479 1 1 18 TRP CZ3 C 25.900 -1.952 11.043 1.00 . A A . 17 TRP CZ3 1 1
8 2480 1 1 18 TRP H H 23.105 2.597 13.470 1.00 . A A . 17 TRP H 1 1
8 2481 1 1 18 TRP HA H 24.150 1.483 15.898 1.00 . A A . 17 TRP HA 1 1
8 2482 1 1 18 TRP HB2 H 23.814 -0.697 14.794 1.00 . A A . 17 TRP HB2 1 1
8 2483 1 1 18 TRP HB3 H 22.375 0.302 14.869 1.00 . A A . 17 TRP HB3 1 1
8 2484 1 1 18 TRP HD1 H 21.378 1.164 12.589 1.00 . A A . 17 TRP HD1 1 1
8 2485 1 1 18 TRP HE1 H 21.814 0.497 10.135 1.00 . A A . 17 TRP HE1 1 1
8 2486 1 1 18 TRP HE3 H 25.704 -1.496 13.142 1.00 . A A . 17 TRP HE3 1 1
8 2487 1 1 18 TRP HH2 H 25.833 -2.249 8.909 1.00 . A A . 17 TRP HH2 1 1
8 2488 1 1 18 TRP HZ2 H 23.730 -0.960 8.615 1.00 . A A . 17 TRP HZ2 1 1
8 2489 1 1 18 TRP HZ3 H 26.814 -2.513 11.172 1.00 . A A . 17 TRP HZ3 1 1
8 2490 1 1 18 TRP N N 23.710 2.632 14.240 1.00 . A A . 17 TRP N 1 1
8 2491 1 1 18 TRP NE1 N 22.401 0.242 10.879 1.00 . A A . 17 TRP NE1 1 1
8 2492 1 1 18 TRP O O 26.445 0.697 15.343 1.00 . A A . 17 TRP O 1 1
8 2493 1 1 19 TRP C C 28.377 1.816 13.805 1.00 . A A . 18 TRP C 1 1
8 2494 1 1 19 TRP CA C 27.440 1.108 12.837 1.00 . A A . 18 TRP CA 1 1
8 2495 1 1 19 TRP CB C 27.688 1.634 11.419 1.00 . A A . 18 TRP CB 1 1
8 2496 1 1 19 TRP CD1 C 29.111 -0.185 10.397 1.00 . A A . 18 TRP CD1 1 1
8 2497 1 1 19 TRP CD2 C 30.269 1.706 10.767 1.00 . A A . 18 TRP CD2 1 1
8 2498 1 1 19 TRP CE2 C 31.174 0.779 10.200 1.00 . A A . 18 TRP CE2 1 1
8 2499 1 1 19 TRP CE3 C 30.751 2.985 11.098 1.00 . A A . 18 TRP CE3 1 1
8 2500 1 1 19 TRP CG C 28.964 1.067 10.881 1.00 . A A . 18 TRP CG 1 1
8 2501 1 1 19 TRP CH2 C 32.972 2.382 10.301 1.00 . A A . 18 TRP CH2 1 1
8 2502 1 1 19 TRP CZ2 C 32.508 1.107 9.967 1.00 . A A . 18 TRP CZ2 1 1
8 2503 1 1 19 TRP CZ3 C 32.095 3.320 10.865 1.00 . A A . 18 TRP CZ3 1 1
8 2504 1 1 19 TRP H H 25.407 1.680 12.586 1.00 . A A . 18 TRP H 1 1
8 2505 1 1 19 TRP HA H 27.635 0.047 12.863 1.00 . A A . 18 TRP HA 1 1
8 2506 1 1 19 TRP HB2 H 26.870 1.345 10.780 1.00 . A A . 18 TRP HB2 1 1
8 2507 1 1 19 TRP HB3 H 27.759 2.713 11.443 1.00 . A A . 18 TRP HB3 1 1
8 2508 1 1 19 TRP HD1 H 28.331 -0.928 10.336 1.00 . A A . 18 TRP HD1 1 1
8 2509 1 1 19 TRP HE1 H 30.794 -1.176 9.602 1.00 . A A . 18 TRP HE1 1 1
8 2510 1 1 19 TRP HE3 H 30.084 3.715 11.533 1.00 . A A . 18 TRP HE3 1 1
8 2511 1 1 19 TRP HH2 H 34.004 2.646 10.123 1.00 . A A . 18 TRP HH2 1 1
8 2512 1 1 19 TRP HZ2 H 33.176 0.379 9.532 1.00 . A A . 18 TRP HZ2 1 1
8 2513 1 1 19 TRP HZ3 H 32.456 4.305 11.122 1.00 . A A . 18 TRP HZ3 1 1
8 2514 1 1 19 TRP N N 26.055 1.348 13.236 1.00 . A A . 18 TRP N 1 1
8 2515 1 1 19 TRP NE1 N 30.422 -0.357 9.991 1.00 . A A . 18 TRP NE1 1 1
8 2516 1 1 19 TRP O O 29.284 1.208 14.375 1.00 . A A . 18 TRP O 1 1
8 2517 1 1 20 ALA C C 28.258 4.061 16.237 1.00 . A A . 19 ALA C 1 1
8 2518 1 1 20 ALA CA C 28.944 3.937 14.884 1.00 . A A . 19 ALA CA 1 1
8 2519 1 1 20 ALA CB C 29.143 5.329 14.280 1.00 . A A . 19 ALA CB 1 1
8 2520 1 1 20 ALA H H 27.399 3.524 13.500 1.00 . A A . 19 ALA H 1 1
8 2521 1 1 20 ALA HA H 29.905 3.479 15.026 1.00 . A A . 19 ALA HA 1 1
8 2522 1 1 20 ALA HB1 H 29.946 5.834 14.796 1.00 . A A . 19 ALA HB1 1 1
8 2523 1 1 20 ALA HB2 H 28.233 5.901 14.383 1.00 . A A . 19 ALA HB2 1 1
8 2524 1 1 20 ALA HB3 H 29.393 5.235 13.233 1.00 . A A . 19 ALA HB3 1 1
8 2525 1 1 20 ALA N N 28.137 3.113 13.985 1.00 . A A . 19 ALA N 1 1
8 2526 1 1 20 ALA O O 28.397 5.069 16.930 1.00 . A A . 19 ALA O 1 1
8 2527 1 1 21 ETA CA C 26.807 3.013 17.877 1.00 . A A . 20 ETA CA 1 1
8 2528 1 1 21 ETA CB C 27.783 2.803 19.031 1.00 . A A . 20 ETA CB 1 1
8 2529 1 1 21 ETA HA1 H 26.087 2.210 17.877 1.00 . A A . 20 ETA HA1 1 1
8 2530 1 1 21 ETA HA2 H 26.293 3.956 18.005 1.00 . A A . 20 ETA HA2 1 1
8 2531 1 1 21 ETA HB1 H 28.641 3.452 18.896 1.00 . A A . 20 ETA HB1 1 1
8 2532 1 1 21 ETA HB2 H 28.114 1.781 19.048 1.00 . A A . 20 ETA HB2 1 1
8 2533 1 1 21 ETA HN2 H 27.450 2.252 16.003 1.00 . A A . 20 ETA HN2 1 1
8 2534 1 1 21 ETA HO H 26.307 2.592 20.283 1.00 . A A . 20 ETA HO 1 1
8 2535 1 1 21 ETA N N 27.517 3.025 16.604 1.00 . A A . 20 ETA N 1 1
8 2536 1 1 21 ETA O O 27.123 3.095 20.258 1.00 . A A . 20 ETA O 1 1
9 2537 1 1 1 ACE C C 22.863 -5.289 -8.657 1.00 . A A . 0 ACE C 1 1
9 2538 1 1 1 ACE CH3 C 23.372 -6.243 -7.581 1.00 . A A . 0 ACE CH3 1 1
9 2539 1 1 1 ACE H1 H 22.799 -6.104 -6.676 1.00 . A A . 0 ACE H1 1 1
9 2540 1 1 1 ACE H2 H 24.414 -6.040 -7.384 1.00 . A A . 0 ACE H2 1 1
9 2541 1 1 1 ACE H3 H 23.263 -7.261 -7.924 1.00 . A A . 0 ACE H3 1 1
9 2542 1 1 1 ACE O O 23.147 -5.469 -9.842 1.00 . A A . 0 ACE O 1 1
9 2543 1 1 2 GLY C C 21.033 -2.106 -8.425 1.00 . A A . 1 GLY C 1 1
9 2544 1 1 2 GLY CA C 21.566 -3.309 -9.171 1.00 . A A . 1 GLY CA 1 1
9 2545 1 1 2 GLY H H 21.906 -4.174 -7.291 1.00 . A A . 1 GLY H 1 1
9 2546 1 1 2 GLY HA2 H 22.328 -2.995 -9.860 1.00 . A A . 1 GLY HA2 1 1
9 2547 1 1 2 GLY HA3 H 20.750 -3.766 -9.716 1.00 . A A . 1 GLY HA3 1 1
9 2548 1 1 2 GLY N N 22.108 -4.276 -8.242 1.00 . A A . 1 GLY N 1 1
9 2549 1 1 2 GLY O O 21.673 -1.557 -7.534 1.00 . A A . 1 GLY O 1 1
9 2550 1 1 3 TRP C C 18.749 -0.959 -6.767 1.00 . A A . 2 TRP C 1 1
9 2551 1 1 3 TRP CA C 19.193 -0.572 -8.178 1.00 . A A . 2 TRP CA 1 1
9 2552 1 1 3 TRP CB C 18.005 -0.061 -9.045 1.00 . A A . 2 TRP CB 1 1
9 2553 1 1 3 TRP CD1 C 17.352 -2.418 -9.371 1.00 . A A . 2 TRP CD1 1 1
9 2554 1 1 3 TRP CD2 C 16.953 -1.208 -11.207 1.00 . A A . 2 TRP CD2 1 1
9 2555 1 1 3 TRP CE2 C 16.549 -2.531 -11.501 1.00 . A A . 2 TRP CE2 1 1
9 2556 1 1 3 TRP CE3 C 16.806 -0.231 -12.208 1.00 . A A . 2 TRP CE3 1 1
9 2557 1 1 3 TRP CG C 17.459 -1.184 -9.842 1.00 . A A . 2 TRP CG 1 1
9 2558 1 1 3 TRP CH2 C 15.876 -1.895 -13.727 1.00 . A A . 2 TRP CH2 1 1
9 2559 1 1 3 TRP CZ2 C 16.018 -2.877 -12.741 1.00 . A A . 2 TRP CZ2 1 1
9 2560 1 1 3 TRP CZ3 C 16.270 -0.574 -13.461 1.00 . A A . 2 TRP CZ3 1 1
9 2561 1 1 3 TRP H H 19.413 -2.199 -9.510 1.00 . A A . 2 TRP H 1 1
9 2562 1 1 3 TRP HA H 19.912 0.209 -8.077 1.00 . A A . 2 TRP HA 1 1
9 2563 1 1 3 TRP HB2 H 17.227 0.331 -8.412 1.00 . A A . 2 TRP HB2 1 1
9 2564 1 1 3 TRP HB3 H 18.350 0.714 -9.714 1.00 . A A . 2 TRP HB3 1 1
9 2565 1 1 3 TRP HD1 H 17.650 -2.703 -8.383 1.00 . A A . 2 TRP HD1 1 1
9 2566 1 1 3 TRP HE1 H 16.639 -4.189 -10.248 1.00 . A A . 2 TRP HE1 1 1
9 2567 1 1 3 TRP HE3 H 17.105 0.788 -12.012 1.00 . A A . 2 TRP HE3 1 1
9 2568 1 1 3 TRP HH2 H 15.466 -2.154 -14.691 1.00 . A A . 2 TRP HH2 1 1
9 2569 1 1 3 TRP HZ2 H 15.718 -3.895 -12.936 1.00 . A A . 2 TRP HZ2 1 1
9 2570 1 1 3 TRP HZ3 H 16.160 0.183 -14.224 1.00 . A A . 2 TRP HZ3 1 1
9 2571 1 1 3 TRP N N 19.851 -1.711 -8.802 1.00 . A A . 2 TRP N 1 1
9 2572 1 1 3 TRP NE1 N 16.816 -3.234 -10.345 1.00 . A A . 2 TRP NE1 1 1
9 2573 1 1 3 TRP O O 18.017 -0.219 -6.112 1.00 . A A . 2 TRP O 1 1
9 2574 1 1 4 TRP C C 19.726 -1.903 -3.936 1.00 . A A . 3 TRP C 1 1
9 2575 1 1 4 TRP CA C 18.857 -2.604 -4.967 1.00 . A A . 3 TRP CA 1 1
9 2576 1 1 4 TRP CB C 19.040 -4.129 -4.839 1.00 . A A . 3 TRP CB 1 1
9 2577 1 1 4 TRP CD1 C 19.451 -5.683 -6.781 1.00 . A A . 3 TRP CD1 1 1
9 2578 1 1 4 TRP CD2 C 17.416 -4.745 -6.861 1.00 . A A . 3 TRP CD2 1 1
9 2579 1 1 4 TRP CE2 C 17.522 -5.589 -7.991 1.00 . A A . 3 TRP CE2 1 1
9 2580 1 1 4 TRP CE3 C 16.219 -4.033 -6.682 1.00 . A A . 3 TRP CE3 1 1
9 2581 1 1 4 TRP CG C 18.657 -4.824 -6.107 1.00 . A A . 3 TRP CG 1 1
9 2582 1 1 4 TRP CH2 C 15.300 -5.003 -8.711 1.00 . A A . 3 TRP CH2 1 1
9 2583 1 1 4 TRP CZ2 C 16.482 -5.722 -8.907 1.00 . A A . 3 TRP CZ2 1 1
9 2584 1 1 4 TRP CZ3 C 15.173 -4.160 -7.598 1.00 . A A . 3 TRP CZ3 1 1
9 2585 1 1 4 TRP H H 19.789 -2.676 -6.865 1.00 . A A . 3 TRP H 1 1
9 2586 1 1 4 TRP HA H 17.843 -2.356 -4.771 1.00 . A A . 3 TRP HA 1 1
9 2587 1 1 4 TRP HB2 H 20.071 -4.352 -4.624 1.00 . A A . 3 TRP HB2 1 1
9 2588 1 1 4 TRP HB3 H 18.421 -4.496 -4.030 1.00 . A A . 3 TRP HB3 1 1
9 2589 1 1 4 TRP HD1 H 20.448 -5.966 -6.492 1.00 . A A . 3 TRP HD1 1 1
9 2590 1 1 4 TRP HE1 H 19.136 -6.770 -8.554 1.00 . A A . 3 TRP HE1 1 1
9 2591 1 1 4 TRP HE3 H 16.102 -3.380 -5.838 1.00 . A A . 3 TRP HE3 1 1
9 2592 1 1 4 TRP HH2 H 14.486 -5.096 -9.415 1.00 . A A . 3 TRP HH2 1 1
9 2593 1 1 4 TRP HZ2 H 16.591 -6.373 -9.760 1.00 . A A . 3 TRP HZ2 1 1
9 2594 1 1 4 TRP HZ3 H 14.269 -3.601 -7.444 1.00 . A A . 3 TRP HZ3 1 1
9 2595 1 1 4 TRP N N 19.207 -2.131 -6.302 1.00 . A A . 3 TRP N 1 1
9 2596 1 1 4 TRP NE1 N 18.780 -6.137 -7.897 1.00 . A A . 3 TRP NE1 1 1
9 2597 1 1 4 TRP O O 19.230 -1.251 -3.018 1.00 . A A . 3 TRP O 1 1
9 2598 1 1 5 LEU C C 21.655 0.059 -3.101 1.00 . A A . 4 LEU C 1 1
9 2599 1 1 5 LEU CA C 21.976 -1.428 -3.200 1.00 . A A . 4 LEU CA 1 1
9 2600 1 1 5 LEU CB C 23.423 -1.638 -3.696 1.00 . A A . 4 LEU CB 1 1
9 2601 1 1 5 LEU CD1 C 23.597 -3.199 -5.732 1.00 . A A . 4 LEU CD1 1 1
9 2602 1 1 5 LEU CD2 C 25.007 -3.651 -3.735 1.00 . A A . 4 LEU CD2 1 1
9 2603 1 1 5 LEU CG C 23.641 -3.116 -4.200 1.00 . A A . 4 LEU CG 1 1
9 2604 1 1 5 LEU H H 21.359 -2.574 -4.858 1.00 . A A . 4 LEU H 1 1
9 2605 1 1 5 LEU HA H 21.867 -1.880 -2.226 1.00 . A A . 4 LEU HA 1 1
9 2606 1 1 5 LEU HB2 H 23.623 -0.932 -4.494 1.00 . A A . 4 LEU HB2 1 1
9 2607 1 1 5 LEU HB3 H 24.095 -1.431 -2.872 1.00 . A A . 4 LEU HB3 1 1
9 2608 1 1 5 LEU HD11 H 22.585 -3.080 -6.058 1.00 . A A . 4 LEU HD11 1 1
9 2609 1 1 5 LEU HD12 H 23.960 -4.165 -6.053 1.00 . A A . 4 LEU HD12 1 1
9 2610 1 1 5 LEU HD13 H 24.213 -2.425 -6.165 1.00 . A A . 4 LEU HD13 1 1
9 2611 1 1 5 LEU HD21 H 25.779 -2.946 -4.004 1.00 . A A . 4 LEU HD21 1 1
9 2612 1 1 5 LEU HD22 H 25.201 -4.598 -4.219 1.00 . A A . 4 LEU HD22 1 1
9 2613 1 1 5 LEU HD23 H 24.997 -3.788 -2.664 1.00 . A A . 4 LEU HD23 1 1
9 2614 1 1 5 LEU HG H 22.859 -3.758 -3.810 1.00 . A A . 4 LEU HG 1 1
9 2615 1 1 5 LEU N N 21.031 -2.045 -4.107 1.00 . A A . 4 LEU N 1 1
9 2616 1 1 5 LEU O O 21.927 0.708 -2.092 1.00 . A A . 4 LEU O 1 1
9 2617 1 1 6 ALA C C 19.872 2.378 -3.013 1.00 . A A . 5 ALA C 1 1
9 2618 1 1 6 ALA CA C 20.694 1.988 -4.239 1.00 . A A . 5 ALA CA 1 1
9 2619 1 1 6 ALA CB C 19.866 2.234 -5.504 1.00 . A A . 5 ALA CB 1 1
9 2620 1 1 6 ALA H H 20.881 0.003 -4.943 1.00 . A A . 5 ALA H 1 1
9 2621 1 1 6 ALA HA H 21.584 2.594 -4.283 1.00 . A A . 5 ALA HA 1 1
9 2622 1 1 6 ALA HB1 H 19.814 3.295 -5.701 1.00 . A A . 5 ALA HB1 1 1
9 2623 1 1 6 ALA HB2 H 18.866 1.843 -5.363 1.00 . A A . 5 ALA HB2 1 1
9 2624 1 1 6 ALA HB3 H 20.329 1.733 -6.341 1.00 . A A . 5 ALA HB3 1 1
9 2625 1 1 6 ALA N N 21.068 0.580 -4.174 1.00 . A A . 5 ALA N 1 1
9 2626 1 1 6 ALA O O 19.600 3.557 -2.786 1.00 . A A . 5 ALA O 1 1
9 2627 1 1 7 LEU C C 19.583 1.853 0.192 1.00 . A A . 6 LEU C 1 1
9 2628 1 1 7 LEU CA C 18.686 1.609 -1.022 1.00 . A A . 6 LEU CA 1 1
9 2629 1 1 7 LEU CB C 17.797 0.391 -0.758 1.00 . A A . 6 LEU CB 1 1
9 2630 1 1 7 LEU CD1 C 16.383 -1.328 -1.932 1.00 . A A . 6 LEU CD1 1 1
9 2631 1 1 7 LEU CD2 C 15.662 1.058 -1.941 1.00 . A A . 6 LEU CD2 1 1
9 2632 1 1 7 LEU CG C 16.880 0.120 -1.970 1.00 . A A . 6 LEU CG 1 1
9 2633 1 1 7 LEU H H 19.721 0.464 -2.454 1.00 . A A . 6 LEU H 1 1
9 2634 1 1 7 LEU HA H 18.056 2.466 -1.168 1.00 . A A . 6 LEU HA 1 1
9 2635 1 1 7 LEU HB2 H 18.431 -0.472 -0.583 1.00 . A A . 6 LEU HB2 1 1
9 2636 1 1 7 LEU HB3 H 17.197 0.573 0.116 1.00 . A A . 6 LEU HB3 1 1
9 2637 1 1 7 LEU HD11 H 17.229 -1.998 -1.906 1.00 . A A . 6 LEU HD11 1 1
9 2638 1 1 7 LEU HD12 H 15.792 -1.528 -2.812 1.00 . A A . 6 LEU HD12 1 1
9 2639 1 1 7 LEU HD13 H 15.778 -1.477 -1.049 1.00 . A A . 6 LEU HD13 1 1
9 2640 1 1 7 LEU HD21 H 15.186 1.012 -0.973 1.00 . A A . 6 LEU HD21 1 1
9 2641 1 1 7 LEU HD22 H 14.957 0.748 -2.698 1.00 . A A . 6 LEU HD22 1 1
9 2642 1 1 7 LEU HD23 H 15.976 2.070 -2.143 1.00 . A A . 6 LEU HD23 1 1
9 2643 1 1 7 LEU HG H 17.437 0.277 -2.884 1.00 . A A . 6 LEU HG 1 1
9 2644 1 1 7 LEU N N 19.478 1.378 -2.224 1.00 . A A . 6 LEU N 1 1
9 2645 1 1 7 LEU O O 19.173 2.507 1.151 1.00 . A A . 6 LEU O 1 1
9 2646 1 1 8 ALA C C 21.992 2.997 1.525 1.00 . A A . 7 ALA C 1 1
9 2647 1 1 8 ALA CA C 21.735 1.501 1.262 1.00 . A A . 7 ALA CA 1 1
9 2648 1 1 8 ALA CB C 23.057 0.725 0.976 1.00 . A A . 7 ALA CB 1 1
9 2649 1 1 8 ALA H H 21.082 0.813 -0.635 1.00 . A A . 7 ALA H 1 1
9 2650 1 1 8 ALA HA H 21.272 1.087 2.148 1.00 . A A . 7 ALA HA 1 1
9 2651 1 1 8 ALA HB1 H 23.044 0.374 -0.045 1.00 . A A . 7 ALA HB1 1 1
9 2652 1 1 8 ALA HB2 H 23.141 -0.130 1.636 1.00 . A A . 7 ALA HB2 1 1
9 2653 1 1 8 ALA HB3 H 23.918 1.366 1.122 1.00 . A A . 7 ALA HB3 1 1
9 2654 1 1 8 ALA N N 20.804 1.327 0.150 1.00 . A A . 7 ALA N 1 1
9 2655 1 1 8 ALA O O 21.803 3.469 2.646 1.00 . A A . 7 ALA O 1 1
9 2656 1 1 9 PRO C C 21.634 5.913 1.547 1.00 . A A . 8 PRO C 1 1
9 2657 1 1 9 PRO CA C 22.689 5.208 0.692 1.00 . A A . 8 PRO CA 1 1
9 2658 1 1 9 PRO CB C 22.654 5.713 -0.751 1.00 . A A . 8 PRO CB 1 1
9 2659 1 1 9 PRO CD C 22.679 3.302 -0.852 1.00 . A A . 8 PRO CD 1 1
9 2660 1 1 9 PRO CG C 23.189 4.574 -1.551 1.00 . A A . 8 PRO CG 1 1
9 2661 1 1 9 PRO HA H 23.673 5.369 1.091 1.00 . A A . 8 PRO HA 1 1
9 2662 1 1 9 PRO HB2 H 21.632 5.942 -1.046 1.00 . A A . 8 PRO HB2 1 1
9 2663 1 1 9 PRO HB3 H 23.281 6.574 -0.871 1.00 . A A . 8 PRO HB3 1 1
9 2664 1 1 9 PRO HD2 H 21.772 2.955 -1.326 1.00 . A A . 8 PRO HD2 1 1
9 2665 1 1 9 PRO HD3 H 23.431 2.534 -0.855 1.00 . A A . 8 PRO HD3 1 1
9 2666 1 1 9 PRO HG2 H 22.818 4.631 -2.573 1.00 . A A . 8 PRO HG2 1 1
9 2667 1 1 9 PRO HG3 H 24.269 4.578 -1.544 1.00 . A A . 8 PRO HG3 1 1
9 2668 1 1 9 PRO N N 22.414 3.746 0.532 1.00 . A A . 8 PRO N 1 1
9 2669 1 1 9 PRO O O 21.957 6.624 2.497 1.00 . A A . 8 PRO O 1 1
9 2670 1 1 10 ALA C C 19.205 5.802 3.357 1.00 . A A . 9 ALA C 1 1
9 2671 1 1 10 ALA CA C 19.273 6.319 1.921 1.00 . A A . 9 ALA CA 1 1
9 2672 1 1 10 ALA CB C 17.952 6.023 1.209 1.00 . A A . 9 ALA CB 1 1
9 2673 1 1 10 ALA H H 20.190 5.131 0.424 1.00 . A A . 9 ALA H 1 1
9 2674 1 1 10 ALA HA H 19.419 7.387 1.940 1.00 . A A . 9 ALA HA 1 1
9 2675 1 1 10 ALA HB1 H 17.794 4.956 1.173 1.00 . A A . 9 ALA HB1 1 1
9 2676 1 1 10 ALA HB2 H 17.990 6.416 0.203 1.00 . A A . 9 ALA HB2 1 1
9 2677 1 1 10 ALA HB3 H 17.141 6.490 1.747 1.00 . A A . 9 ALA HB3 1 1
9 2678 1 1 10 ALA N N 20.378 5.705 1.193 1.00 . A A . 9 ALA N 1 1
9 2679 1 1 10 ALA O O 18.674 6.475 4.241 1.00 . A A . 9 ALA O 1 1
9 2680 1 1 11 LEU C C 21.009 4.418 5.650 1.00 . A A . 10 LEU C 1 1
9 2681 1 1 11 LEU CA C 19.751 3.986 4.906 1.00 . A A . 10 LEU CA 1 1
9 2682 1 1 11 LEU CB C 19.622 2.437 4.702 1.00 . A A . 10 LEU CB 1 1
9 2683 1 1 11 LEU CD1 C 19.984 1.714 7.115 1.00 . A A . 10 LEU CD1 1 1
9 2684 1 1 11 LEU CD2 C 20.468 0.144 5.190 1.00 . A A . 10 LEU CD2 1 1
9 2685 1 1 11 LEU CG C 20.503 1.611 5.657 1.00 . A A . 10 LEU CG 1 1
9 2686 1 1 11 LEU H H 20.154 4.111 2.850 1.00 . A A . 10 LEU H 1 1
9 2687 1 1 11 LEU HA H 18.915 4.344 5.454 1.00 . A A . 10 LEU HA 1 1
9 2688 1 1 11 LEU HB2 H 18.595 2.139 4.849 1.00 . A A . 10 LEU HB2 1 1
9 2689 1 1 11 LEU HB3 H 19.899 2.203 3.683 1.00 . A A . 10 LEU HB3 1 1
9 2690 1 1 11 LEU HD11 H 19.288 0.910 7.329 1.00 . A A . 10 LEU HD11 1 1
9 2691 1 1 11 LEU HD12 H 19.478 2.656 7.266 1.00 . A A . 10 LEU HD12 1 1
9 2692 1 1 11 LEU HD13 H 20.822 1.647 7.794 1.00 . A A . 10 LEU HD13 1 1
9 2693 1 1 11 LEU HD21 H 20.919 -0.485 5.944 1.00 . A A . 10 LEU HD21 1 1
9 2694 1 1 11 LEU HD22 H 21.017 0.046 4.266 1.00 . A A . 10 LEU HD22 1 1
9 2695 1 1 11 LEU HD23 H 19.444 -0.159 5.034 1.00 . A A . 10 LEU HD23 1 1
9 2696 1 1 11 LEU HG H 21.521 1.968 5.605 1.00 . A A . 10 LEU HG 1 1
9 2697 1 1 11 LEU N N 19.746 4.601 3.586 1.00 . A A . 10 LEU N 1 1
9 2698 1 1 11 LEU O O 21.165 4.207 6.852 1.00 . A A . 10 LEU O 1 1
9 2699 1 1 12 ALA C C 22.928 6.254 6.759 1.00 . A A . 11 ALA C 1 1
9 2700 1 1 12 ALA CA C 23.159 5.502 5.455 1.00 . A A . 11 ALA CA 1 1
9 2701 1 1 12 ALA CB C 23.862 6.418 4.451 1.00 . A A . 11 ALA CB 1 1
9 2702 1 1 12 ALA H H 21.687 5.148 3.966 1.00 . A A . 11 ALA H 1 1
9 2703 1 1 12 ALA HA H 23.796 4.653 5.651 1.00 . A A . 11 ALA HA 1 1
9 2704 1 1 12 ALA HB1 H 23.961 5.908 3.505 1.00 . A A . 11 ALA HB1 1 1
9 2705 1 1 12 ALA HB2 H 24.842 6.676 4.827 1.00 . A A . 11 ALA HB2 1 1
9 2706 1 1 12 ALA HB3 H 23.280 7.318 4.318 1.00 . A A . 11 ALA HB3 1 1
9 2707 1 1 12 ALA N N 21.895 5.023 4.906 1.00 . A A . 11 ALA N 1 1
9 2708 1 1 12 ALA O O 23.857 6.456 7.541 1.00 . A A . 11 ALA O 1 1
9 2709 1 1 13 LEU C C 21.413 6.440 9.399 1.00 . A A . 12 LEU C 1 1
9 2710 1 1 13 LEU CA C 21.358 7.391 8.208 1.00 . A A . 12 LEU CA 1 1
9 2711 1 1 13 LEU CB C 19.961 8.030 8.083 1.00 . A A . 12 LEU CB 1 1
9 2712 1 1 13 LEU CD1 C 18.415 9.812 8.912 1.00 . A A . 12 LEU CD1 1 1
9 2713 1 1 13 LEU CD2 C 20.122 8.831 10.463 1.00 . A A . 12 LEU CD2 1 1
9 2714 1 1 13 LEU CG C 19.835 9.248 9.010 1.00 . A A . 12 LEU CG 1 1
9 2715 1 1 13 LEU H H 20.984 6.477 6.338 1.00 . A A . 12 LEU H 1 1
9 2716 1 1 13 LEU HA H 22.093 8.165 8.351 1.00 . A A . 12 LEU HA 1 1
9 2717 1 1 13 LEU HB2 H 19.809 8.346 7.062 1.00 . A A . 12 LEU HB2 1 1
9 2718 1 1 13 LEU HB3 H 19.204 7.303 8.344 1.00 . A A . 12 LEU HB3 1 1
9 2719 1 1 13 LEU HD11 H 18.185 10.031 7.880 1.00 . A A . 12 LEU HD11 1 1
9 2720 1 1 13 LEU HD12 H 18.348 10.719 9.497 1.00 . A A . 12 LEU HD12 1 1
9 2721 1 1 13 LEU HD13 H 17.712 9.086 9.293 1.00 . A A . 12 LEU HD13 1 1
9 2722 1 1 13 LEU HD21 H 19.738 9.583 11.139 1.00 . A A . 12 LEU HD21 1 1
9 2723 1 1 13 LEU HD22 H 21.187 8.738 10.605 1.00 . A A . 12 LEU HD22 1 1
9 2724 1 1 13 LEU HD23 H 19.644 7.884 10.669 1.00 . A A . 12 LEU HD23 1 1
9 2725 1 1 13 LEU HG H 20.541 10.006 8.700 1.00 . A A . 12 LEU HG 1 1
9 2726 1 1 13 LEU N N 21.687 6.665 6.991 1.00 . A A . 12 LEU N 1 1
9 2727 1 1 13 LEU O O 22.253 6.595 10.286 1.00 . A A . 12 LEU O 1 1
9 2728 1 1 14 ALA C C 21.869 3.835 10.613 1.00 . A A . 13 ALA C 1 1
9 2729 1 1 14 ALA CA C 20.508 4.503 10.515 1.00 . A A . 13 ALA CA 1 1
9 2730 1 1 14 ALA CB C 19.420 3.446 10.311 1.00 . A A . 13 ALA CB 1 1
9 2731 1 1 14 ALA H H 19.872 5.371 8.686 1.00 . A A . 13 ALA H 1 1
9 2732 1 1 14 ALA HA H 20.314 5.035 11.434 1.00 . A A . 13 ALA HA 1 1
9 2733 1 1 14 ALA HB1 H 19.222 2.952 11.251 1.00 . A A . 13 ALA HB1 1 1
9 2734 1 1 14 ALA HB2 H 19.752 2.717 9.587 1.00 . A A . 13 ALA HB2 1 1
9 2735 1 1 14 ALA HB3 H 18.517 3.919 9.957 1.00 . A A . 13 ALA HB3 1 1
9 2736 1 1 14 ALA N N 20.521 5.456 9.417 1.00 . A A . 13 ALA N 1 1
9 2737 1 1 14 ALA O O 22.352 3.542 11.703 1.00 . A A . 13 ALA O 1 1
9 2738 1 1 15 LEU C C 24.728 3.731 10.383 1.00 . A A . 14 LEU C 1 1
9 2739 1 1 15 LEU CA C 23.800 2.966 9.455 1.00 . A A . 14 LEU CA 1 1
9 2740 1 1 15 LEU CB C 24.356 2.926 8.018 1.00 . A A . 14 LEU CB 1 1
9 2741 1 1 15 LEU CD1 C 25.666 1.354 6.511 1.00 . A A . 14 LEU CD1 1 1
9 2742 1 1 15 LEU CD2 C 26.899 2.769 8.142 1.00 . A A . 14 LEU CD2 1 1
9 2743 1 1 15 LEU CG C 25.596 1.984 7.908 1.00 . A A . 14 LEU CG 1 1
9 2744 1 1 15 LEU H H 22.067 3.852 8.614 1.00 . A A . 14 LEU H 1 1
9 2745 1 1 15 LEU HA H 23.698 1.967 9.830 1.00 . A A . 14 LEU HA 1 1
9 2746 1 1 15 LEU HB2 H 23.568 2.573 7.363 1.00 . A A . 14 LEU HB2 1 1
9 2747 1 1 15 LEU HB3 H 24.632 3.928 7.720 1.00 . A A . 14 LEU HB3 1 1
9 2748 1 1 15 LEU HD11 H 25.810 2.129 5.773 1.00 . A A . 14 LEU HD11 1 1
9 2749 1 1 15 LEU HD12 H 24.744 0.830 6.307 1.00 . A A . 14 LEU HD12 1 1
9 2750 1 1 15 LEU HD13 H 26.491 0.660 6.470 1.00 . A A . 14 LEU HD13 1 1
9 2751 1 1 15 LEU HD21 H 26.935 3.120 9.159 1.00 . A A . 14 LEU HD21 1 1
9 2752 1 1 15 LEU HD22 H 26.937 3.613 7.469 1.00 . A A . 14 LEU HD22 1 1
9 2753 1 1 15 LEU HD23 H 27.744 2.123 7.952 1.00 . A A . 14 LEU HD23 1 1
9 2754 1 1 15 LEU HG H 25.519 1.188 8.636 1.00 . A A . 14 LEU HG 1 1
9 2755 1 1 15 LEU N N 22.491 3.597 9.464 1.00 . A A . 14 LEU N 1 1
9 2756 1 1 15 LEU O O 25.417 3.139 11.209 1.00 . A A . 14 LEU O 1 1
9 2757 1 1 16 ALA C C 25.216 5.630 12.559 1.00 . A A . 15 ALA C 1 1
9 2758 1 1 16 ALA CA C 25.580 5.868 11.097 1.00 . A A . 15 ALA CA 1 1
9 2759 1 1 16 ALA CB C 25.399 7.347 10.752 1.00 . A A . 15 ALA CB 1 1
9 2760 1 1 16 ALA H H 24.157 5.477 9.578 1.00 . A A . 15 ALA H 1 1
9 2761 1 1 16 ALA HA H 26.612 5.593 10.939 1.00 . A A . 15 ALA HA 1 1
9 2762 1 1 16 ALA HB1 H 25.497 7.483 9.685 1.00 . A A . 15 ALA HB1 1 1
9 2763 1 1 16 ALA HB2 H 26.153 7.931 11.261 1.00 . A A . 15 ALA HB2 1 1
9 2764 1 1 16 ALA HB3 H 24.419 7.673 11.069 1.00 . A A . 15 ALA HB3 1 1
9 2765 1 1 16 ALA N N 24.734 5.049 10.251 1.00 . A A . 15 ALA N 1 1
9 2766 1 1 16 ALA O O 26.035 5.822 13.457 1.00 . A A . 15 ALA O 1 1
9 2767 1 1 17 LEU C C 24.053 3.662 14.730 1.00 . A A . 16 LEU C 1 1
9 2768 1 1 17 LEU CA C 23.487 4.957 14.138 1.00 . A A . 16 LEU CA 1 1
9 2769 1 1 17 LEU CB C 21.943 4.915 14.157 1.00 . A A . 16 LEU CB 1 1
9 2770 1 1 17 LEU CD1 C 21.297 6.793 15.738 1.00 . A A . 16 LEU CD1 1 1
9 2771 1 1 17 LEU CD2 C 19.999 4.667 15.757 1.00 . A A . 16 LEU CD2 1 1
9 2772 1 1 17 LEU CG C 21.398 5.271 15.566 1.00 . A A . 16 LEU CG 1 1
9 2773 1 1 17 LEU H H 23.363 5.086 12.030 1.00 . A A . 16 LEU H 1 1
9 2774 1 1 17 LEU HA H 23.806 5.769 14.756 1.00 . A A . 16 LEU HA 1 1
9 2775 1 1 17 LEU HB2 H 21.561 5.618 13.430 1.00 . A A . 16 LEU HB2 1 1
9 2776 1 1 17 LEU HB3 H 21.612 3.920 13.888 1.00 . A A . 16 LEU HB3 1 1
9 2777 1 1 17 LEU HD11 H 20.728 7.214 14.922 1.00 . A A . 16 LEU HD11 1 1
9 2778 1 1 17 LEU HD12 H 22.285 7.227 15.748 1.00 . A A . 16 LEU HD12 1 1
9 2779 1 1 17 LEU HD13 H 20.801 7.015 16.671 1.00 . A A . 16 LEU HD13 1 1
9 2780 1 1 17 LEU HD21 H 19.560 5.054 16.664 1.00 . A A . 16 LEU HD21 1 1
9 2781 1 1 17 LEU HD22 H 20.077 3.592 15.826 1.00 . A A . 16 LEU HD22 1 1
9 2782 1 1 17 LEU HD23 H 19.376 4.928 14.914 1.00 . A A . 16 LEU HD23 1 1
9 2783 1 1 17 LEU HG H 22.066 4.873 16.319 1.00 . A A . 16 LEU HG 1 1
9 2784 1 1 17 LEU N N 23.970 5.215 12.786 1.00 . A A . 16 LEU N 1 1
9 2785 1 1 17 LEU O O 24.823 3.709 15.691 1.00 . A A . 16 LEU O 1 1
9 2786 1 1 18 TRP C C 25.618 0.951 14.329 1.00 . A A . 17 TRP C 1 1
9 2787 1 1 18 TRP CA C 24.171 1.235 14.711 1.00 . A A . 17 TRP CA 1 1
9 2788 1 1 18 TRP CB C 23.276 0.067 14.293 1.00 . A A . 17 TRP CB 1 1
9 2789 1 1 18 TRP CD1 C 22.070 0.732 12.173 1.00 . A A . 17 TRP CD1 1 1
9 2790 1 1 18 TRP CD2 C 23.733 -0.737 11.801 1.00 . A A . 17 TRP CD2 1 1
9 2791 1 1 18 TRP CE2 C 23.148 -0.460 10.546 1.00 . A A . 17 TRP CE2 1 1
9 2792 1 1 18 TRP CE3 C 24.811 -1.640 11.845 1.00 . A A . 17 TRP CE3 1 1
9 2793 1 1 18 TRP CG C 23.030 0.033 12.819 1.00 . A A . 17 TRP CG 1 1
9 2794 1 1 18 TRP CH2 C 24.684 -1.948 9.432 1.00 . A A . 17 TRP CH2 1 1
9 2795 1 1 18 TRP CZ2 C 23.613 -1.054 9.374 1.00 . A A . 17 TRP CZ2 1 1
9 2796 1 1 18 TRP CZ3 C 25.283 -2.242 10.666 1.00 . A A . 17 TRP CZ3 1 1
9 2797 1 1 18 TRP H H 23.051 2.501 13.418 1.00 . A A . 17 TRP H 1 1
9 2798 1 1 18 TRP HA H 24.131 1.299 15.789 1.00 . A A . 17 TRP HA 1 1
9 2799 1 1 18 TRP HB2 H 23.750 -0.851 14.578 1.00 . A A . 17 TRP HB2 1 1
9 2800 1 1 18 TRP HB3 H 22.333 0.155 14.810 1.00 . A A . 17 TRP HB3 1 1
9 2801 1 1 18 TRP HD1 H 21.364 1.407 12.635 1.00 . A A . 17 TRP HD1 1 1
9 2802 1 1 18 TRP HE1 H 21.555 0.813 10.131 1.00 . A A . 17 TRP HE1 1 1
9 2803 1 1 18 TRP HE3 H 25.278 -1.872 12.789 1.00 . A A . 17 TRP HE3 1 1
9 2804 1 1 18 TRP HH2 H 25.050 -2.413 8.529 1.00 . A A . 17 TRP HH2 1 1
9 2805 1 1 18 TRP HZ2 H 23.146 -0.822 8.428 1.00 . A A . 17 TRP HZ2 1 1
9 2806 1 1 18 TRP HZ3 H 26.110 -2.933 10.711 1.00 . A A . 17 TRP HZ3 1 1
9 2807 1 1 18 TRP N N 23.673 2.504 14.178 1.00 . A A . 17 TRP N 1 1
9 2808 1 1 18 TRP NE1 N 22.139 0.438 10.822 1.00 . A A . 17 TRP NE1 1 1
9 2809 1 1 18 TRP O O 26.398 0.489 15.162 1.00 . A A . 17 TRP O 1 1
9 2810 1 1 19 TRP C C 28.321 1.621 13.635 1.00 . A A . 18 TRP C 1 1
9 2811 1 1 19 TRP CA C 27.357 0.965 12.657 1.00 . A A . 18 TRP CA 1 1
9 2812 1 1 19 TRP CB C 27.594 1.532 11.252 1.00 . A A . 18 TRP CB 1 1
9 2813 1 1 19 TRP CD1 C 28.944 -0.305 10.162 1.00 . A A . 18 TRP CD1 1 1
9 2814 1 1 19 TRP CD2 C 30.156 1.554 10.524 1.00 . A A . 18 TRP CD2 1 1
9 2815 1 1 19 TRP CE2 C 31.021 0.615 9.916 1.00 . A A . 18 TRP CE2 1 1
9 2816 1 1 19 TRP CE3 C 30.678 2.818 10.857 1.00 . A A . 18 TRP CE3 1 1
9 2817 1 1 19 TRP CG C 28.841 0.943 10.669 1.00 . A A . 18 TRP CG 1 1
9 2818 1 1 19 TRP CH2 C 32.859 2.175 9.984 1.00 . A A . 18 TRP CH2 1 1
9 2819 1 1 19 TRP CZ2 C 32.355 0.915 9.648 1.00 . A A . 18 TRP CZ2 1 1
9 2820 1 1 19 TRP CZ3 C 32.022 3.124 10.588 1.00 . A A . 18 TRP CZ3 1 1
9 2821 1 1 19 TRP H H 25.329 1.582 12.460 1.00 . A A . 18 TRP H 1 1
9 2822 1 1 19 TRP HA H 27.531 -0.101 12.647 1.00 . A A . 18 TRP HA 1 1
9 2823 1 1 19 TRP HB2 H 26.755 1.289 10.623 1.00 . A A . 18 TRP HB2 1 1
9 2824 1 1 19 TRP HB3 H 27.700 2.607 11.310 1.00 . A A . 18 TRP HB3 1 1
9 2825 1 1 19 TRP HD1 H 28.145 -1.029 10.115 1.00 . A A . 18 TRP HD1 1 1
9 2826 1 1 19 TRP HE1 H 30.577 -1.322 9.302 1.00 . A A . 18 TRP HE1 1 1
9 2827 1 1 19 TRP HE3 H 30.041 3.555 11.323 1.00 . A A . 18 TRP HE3 1 1
9 2828 1 1 19 TRP HH2 H 33.891 2.416 9.779 1.00 . A A . 18 TRP HH2 1 1
9 2829 1 1 19 TRP HZ2 H 32.992 0.179 9.182 1.00 . A A . 18 TRP HZ2 1 1
9 2830 1 1 19 TRP HZ3 H 32.413 4.097 10.847 1.00 . A A . 18 TRP HZ3 1 1
9 2831 1 1 19 TRP N N 25.983 1.216 13.088 1.00 . A A . 18 TRP N 1 1
9 2832 1 1 19 TRP NE1 N 30.237 -0.500 9.714 1.00 . A A . 18 TRP NE1 1 1
9 2833 1 1 19 TRP O O 29.229 0.979 14.165 1.00 . A A . 18 TRP O 1 1
9 2834 1 1 20 ALA C C 28.349 3.661 16.181 1.00 . A A . 19 ALA C 1 1
9 2835 1 1 20 ALA CA C 28.943 3.686 14.780 1.00 . A A . 19 ALA CA 1 1
9 2836 1 1 20 ALA CB C 29.056 5.133 14.293 1.00 . A A . 19 ALA CB 1 1
9 2837 1 1 20 ALA H H 27.367 3.355 13.411 1.00 . A A . 19 ALA H 1 1
9 2838 1 1 20 ALA HA H 29.926 3.254 14.815 1.00 . A A . 19 ALA HA 1 1
9 2839 1 1 20 ALA HB1 H 29.230 5.142 13.228 1.00 . A A . 19 ALA HB1 1 1
9 2840 1 1 20 ALA HB2 H 29.879 5.620 14.797 1.00 . A A . 19 ALA HB2 1 1
9 2841 1 1 20 ALA HB3 H 28.139 5.660 14.513 1.00 . A A . 19 ALA HB3 1 1
9 2842 1 1 20 ALA N N 28.107 2.913 13.866 1.00 . A A . 19 ALA N 1 1
9 2843 1 1 20 ALA O O 28.530 4.591 16.966 1.00 . A A . 19 ALA O 1 1
9 2844 1 1 21 ETA CA C 27.007 2.422 17.791 1.00 . A A . 20 ETA CA 1 1
9 2845 1 1 21 ETA CB C 26.792 0.942 18.101 1.00 . A A . 20 ETA CB 1 1
9 2846 1 1 21 ETA HA1 H 26.050 2.919 17.791 1.00 . A A . 20 ETA HA1 1 1
9 2847 1 1 21 ETA HA2 H 27.641 2.860 18.553 1.00 . A A . 20 ETA HA2 1 1
9 2848 1 1 21 ETA HB1 H 26.674 0.813 19.172 1.00 . A A . 20 ETA HB1 1 1
9 2849 1 1 21 ETA HB2 H 27.642 0.373 17.771 1.00 . A A . 20 ETA HB2 1 1
9 2850 1 1 21 ETA HN2 H 27.534 1.878 15.807 1.00 . A A . 20 ETA HN2 1 1
9 2851 1 1 21 ETA HO H 24.980 0.234 18.066 1.00 . A A . 20 ETA HO 1 1
9 2852 1 1 21 ETA N N 27.637 2.583 16.482 1.00 . A A . 20 ETA N 1 1
9 2853 1 1 21 ETA O O 25.636 0.484 17.411 1.00 . A A . 20 ETA O 1 1
10 2854 1 1 1 ACE C C 22.466 -6.542 -6.578 1.00 . A A . 0 ACE C 1 1
10 2855 1 1 1 ACE CH3 C 22.806 -7.185 -5.237 1.00 . A A . 0 ACE CH3 1 1
10 2856 1 1 1 ACE H1 H 22.243 -6.702 -4.452 1.00 . A A . 0 ACE H1 1 1
10 2857 1 1 1 ACE H2 H 23.863 -7.077 -5.044 1.00 . A A . 0 ACE H2 1 1
10 2858 1 1 1 ACE H3 H 22.552 -8.234 -5.268 1.00 . A A . 0 ACE H3 1 1
10 2859 1 1 1 ACE O O 22.743 -7.107 -7.634 1.00 . A A . 0 ACE O 1 1
10 2860 1 1 2 GLY C C 21.131 -3.218 -7.414 1.00 . A A . 1 GLY C 1 1
10 2861 1 1 2 GLY CA C 21.487 -4.652 -7.735 1.00 . A A . 1 GLY CA 1 1
10 2862 1 1 2 GLY H H 21.659 -4.947 -5.665 1.00 . A A . 1 GLY H 1 1
10 2863 1 1 2 GLY HA2 H 22.300 -4.671 -8.438 1.00 . A A . 1 GLY HA2 1 1
10 2864 1 1 2 GLY HA3 H 20.620 -5.134 -8.168 1.00 . A A . 1 GLY HA3 1 1
10 2865 1 1 2 GLY N N 21.861 -5.357 -6.529 1.00 . A A . 1 GLY N 1 1
10 2866 1 1 2 GLY O O 21.828 -2.523 -6.683 1.00 . A A . 1 GLY O 1 1
10 2867 1 1 3 TRP C C 19.013 -1.315 -6.324 1.00 . A A . 2 TRP C 1 1
10 2868 1 1 3 TRP CA C 19.545 -1.437 -7.752 1.00 . A A . 2 TRP CA 1 1
10 2869 1 1 3 TRP CB C 18.472 -1.048 -8.812 1.00 . A A . 2 TRP CB 1 1
10 2870 1 1 3 TRP CD1 C 17.466 -3.274 -8.474 1.00 . A A . 2 TRP CD1 1 1
10 2871 1 1 3 TRP CD2 C 17.309 -2.632 -10.610 1.00 . A A . 2 TRP CD2 1 1
10 2872 1 1 3 TRP CE2 C 16.711 -3.911 -10.529 1.00 . A A . 2 TRP CE2 1 1
10 2873 1 1 3 TRP CE3 C 17.344 -1.993 -11.861 1.00 . A A . 2 TRP CE3 1 1
10 2874 1 1 3 TRP CG C 17.777 -2.269 -9.280 1.00 . A A . 2 TRP CG 1 1
10 2875 1 1 3 TRP CH2 C 16.205 -3.889 -12.885 1.00 . A A . 2 TRP CH2 1 1
10 2876 1 1 3 TRP CZ2 C 16.165 -4.536 -11.646 1.00 . A A . 2 TRP CZ2 1 1
10 2877 1 1 3 TRP CZ3 C 16.794 -2.619 -12.992 1.00 . A A . 2 TRP CZ3 1 1
10 2878 1 1 3 TRP H H 19.539 -3.404 -8.529 1.00 . A A . 2 TRP H 1 1
10 2879 1 1 3 TRP HA H 20.374 -0.771 -7.836 1.00 . A A . 2 TRP HA 1 1
10 2880 1 1 3 TRP HB2 H 17.750 -0.378 -8.377 1.00 . A A . 2 TRP HB2 1 1
10 2881 1 1 3 TRP HB3 H 18.949 -0.566 -9.653 1.00 . A A . 2 TRP HB3 1 1
10 2882 1 1 3 TRP HD1 H 17.689 -3.287 -7.428 1.00 . A A . 2 TRP HD1 1 1
10 2883 1 1 3 TRP HE1 H 16.507 -5.109 -8.840 1.00 . A A . 2 TRP HE1 1 1
10 2884 1 1 3 TRP HE3 H 17.794 -1.016 -11.954 1.00 . A A . 2 TRP HE3 1 1
10 2885 1 1 3 TRP HH2 H 15.783 -4.366 -13.759 1.00 . A A . 2 TRP HH2 1 1
10 2886 1 1 3 TRP HZ2 H 15.714 -5.513 -11.554 1.00 . A A . 2 TRP HZ2 1 1
10 2887 1 1 3 TRP HZ3 H 16.823 -2.121 -13.950 1.00 . A A . 2 TRP HZ3 1 1
10 2888 1 1 3 TRP N N 20.032 -2.792 -7.969 1.00 . A A . 2 TRP N 1 1
10 2889 1 1 3 TRP NE1 N 16.834 -4.263 -9.202 1.00 . A A . 2 TRP NE1 1 1
10 2890 1 1 3 TRP O O 18.382 -0.321 -5.970 1.00 . A A . 2 TRP O 1 1
10 2891 1 1 4 TRP C C 19.775 -1.489 -3.277 1.00 . A A . 3 TRP C 1 1
10 2892 1 1 4 TRP CA C 18.830 -2.335 -4.113 1.00 . A A . 3 TRP CA 1 1
10 2893 1 1 4 TRP CB C 18.767 -3.760 -3.531 1.00 . A A . 3 TRP CB 1 1
10 2894 1 1 4 TRP CD1 C 18.965 -5.869 -4.898 1.00 . A A . 3 TRP CD1 1 1
10 2895 1 1 4 TRP CD2 C 17.107 -4.712 -5.386 1.00 . A A . 3 TRP CD2 1 1
10 2896 1 1 4 TRP CE2 C 17.101 -5.863 -6.209 1.00 . A A . 3 TRP CE2 1 1
10 2897 1 1 4 TRP CE3 C 16.035 -3.812 -5.506 1.00 . A A . 3 TRP CE3 1 1
10 2898 1 1 4 TRP CG C 18.304 -4.740 -4.562 1.00 . A A . 3 TRP CG 1 1
10 2899 1 1 4 TRP CH2 C 15.016 -5.202 -7.217 1.00 . A A . 3 TRP CH2 1 1
10 2900 1 1 4 TRP CZ2 C 16.073 -6.110 -7.113 1.00 . A A . 3 TRP CZ2 1 1
10 2901 1 1 4 TRP CZ3 C 15.002 -4.055 -6.412 1.00 . A A . 3 TRP CZ3 1 1
10 2902 1 1 4 TRP H H 19.789 -3.104 -5.835 1.00 . A A . 3 TRP H 1 1
10 2903 1 1 4 TRP HA H 17.863 -1.897 -4.069 1.00 . A A . 3 TRP HA 1 1
10 2904 1 1 4 TRP HB2 H 19.744 -4.055 -3.192 1.00 . A A . 3 TRP HB2 1 1
10 2905 1 1 4 TRP HB3 H 18.082 -3.774 -2.693 1.00 . A A . 3 TRP HB3 1 1
10 2906 1 1 4 TRP HD1 H 19.898 -6.193 -4.472 1.00 . A A . 3 TRP HD1 1 1
10 2907 1 1 4 TRP HE1 H 18.518 -7.379 -6.292 1.00 . A A . 3 TRP HE1 1 1
10 2908 1 1 4 TRP HE3 H 16.006 -2.927 -4.901 1.00 . A A . 3 TRP HE3 1 1
10 2909 1 1 4 TRP HH2 H 14.212 -5.383 -7.916 1.00 . A A . 3 TRP HH2 1 1
10 2910 1 1 4 TRP HZ2 H 16.093 -6.997 -7.729 1.00 . A A . 3 TRP HZ2 1 1
10 2911 1 1 4 TRP HZ3 H 14.194 -3.351 -6.489 1.00 . A A . 3 TRP HZ3 1 1
10 2912 1 1 4 TRP N N 19.281 -2.341 -5.502 1.00 . A A . 3 TRP N 1 1
10 2913 1 1 4 TRP NE1 N 18.254 -6.535 -5.875 1.00 . A A . 3 TRP NE1 1 1
10 2914 1 1 4 TRP O O 19.364 -0.534 -2.618 1.00 . A A . 3 TRP O 1 1
10 2915 1 1 5 LEU C C 21.958 0.346 -2.931 1.00 . A A . 4 LEU C 1 1
10 2916 1 1 5 LEU CA C 22.055 -1.132 -2.570 1.00 . A A . 4 LEU CA 1 1
10 2917 1 1 5 LEU CB C 23.464 -1.675 -2.890 1.00 . A A . 4 LEU CB 1 1
10 2918 1 1 5 LEU CD1 C 23.443 -3.786 -4.359 1.00 . A A . 4 LEU CD1 1 1
10 2919 1 1 5 LEU CD2 C 24.735 -3.801 -2.235 1.00 . A A . 4 LEU CD2 1 1
10 2920 1 1 5 LEU CG C 23.471 -3.251 -2.920 1.00 . A A . 4 LEU CG 1 1
10 2921 1 1 5 LEU H H 21.306 -2.621 -3.861 1.00 . A A . 4 LEU H 1 1
10 2922 1 1 5 LEU HA H 21.859 -1.254 -1.517 1.00 . A A . 4 LEU HA 1 1
10 2923 1 1 5 LEU HB2 H 23.781 -1.276 -3.848 1.00 . A A . 4 LEU HB2 1 1
10 2924 1 1 5 LEU HB3 H 24.143 -1.322 -2.124 1.00 . A A . 4 LEU HB3 1 1
10 2925 1 1 5 LEU HD11 H 23.669 -4.843 -4.358 1.00 . A A . 4 LEU HD11 1 1
10 2926 1 1 5 LEU HD12 H 24.170 -3.269 -4.965 1.00 . A A . 4 LEU HD12 1 1
10 2927 1 1 5 LEU HD13 H 22.464 -3.639 -4.765 1.00 . A A . 4 LEU HD13 1 1
10 2928 1 1 5 LEU HD21 H 24.685 -3.607 -1.174 1.00 . A A . 4 LEU HD21 1 1
10 2929 1 1 5 LEU HD22 H 25.608 -3.320 -2.651 1.00 . A A . 4 LEU HD22 1 1
10 2930 1 1 5 LEU HD23 H 24.796 -4.867 -2.405 1.00 . A A . 4 LEU HD23 1 1
10 2931 1 1 5 LEU HG H 22.596 -3.635 -2.407 1.00 . A A . 4 LEU HG 1 1
10 2932 1 1 5 LEU N N 21.047 -1.854 -3.318 1.00 . A A . 4 LEU N 1 1
10 2933 1 1 5 LEU O O 22.301 1.223 -2.140 1.00 . A A . 4 LEU O 1 1
10 2934 1 1 6 ALA C C 20.481 2.800 -3.690 1.00 . A A . 5 ALA C 1 1
10 2935 1 1 6 ALA CA C 21.315 1.954 -4.654 1.00 . A A . 5 ALA CA 1 1
10 2936 1 1 6 ALA CB C 20.619 1.905 -6.017 1.00 . A A . 5 ALA CB 1 1
10 2937 1 1 6 ALA H H 21.225 -0.158 -4.720 1.00 . A A . 5 ALA H 1 1
10 2938 1 1 6 ALA HA H 22.285 2.407 -4.778 1.00 . A A . 5 ALA HA 1 1
10 2939 1 1 6 ALA HB1 H 19.562 1.710 -5.877 1.00 . A A . 5 ALA HB1 1 1
10 2940 1 1 6 ALA HB2 H 21.050 1.116 -6.614 1.00 . A A . 5 ALA HB2 1 1
10 2941 1 1 6 ALA HB3 H 20.746 2.850 -6.522 1.00 . A A . 5 ALA HB3 1 1
10 2942 1 1 6 ALA N N 21.479 0.596 -4.147 1.00 . A A . 5 ALA N 1 1
10 2943 1 1 6 ALA O O 20.523 4.029 -3.739 1.00 . A A . 5 ALA O 1 1
10 2944 1 1 7 LEU C C 19.546 2.898 -0.476 1.00 . A A . 6 LEU C 1 1
10 2945 1 1 7 LEU CA C 18.867 2.810 -1.845 1.00 . A A . 6 LEU CA 1 1
10 2946 1 1 7 LEU CB C 17.555 2.035 -1.708 1.00 . A A . 6 LEU CB 1 1
10 2947 1 1 7 LEU CD1 C 15.692 0.931 -2.953 1.00 . A A . 6 LEU CD1 1 1
10 2948 1 1 7 LEU CD2 C 16.909 2.855 -3.987 1.00 . A A . 6 LEU CD2 1 1
10 2949 1 1 7 LEU CG C 17.052 1.617 -3.093 1.00 . A A . 6 LEU CG 1 1
10 2950 1 1 7 LEU H H 19.721 1.161 -2.831 1.00 . A A . 6 LEU H 1 1
10 2951 1 1 7 LEU HA H 18.639 3.804 -2.189 1.00 . A A . 6 LEU HA 1 1
10 2952 1 1 7 LEU HB2 H 17.720 1.151 -1.105 1.00 . A A . 6 LEU HB2 1 1
10 2953 1 1 7 LEU HB3 H 16.820 2.662 -1.238 1.00 . A A . 6 LEU HB3 1 1
10 2954 1 1 7 LEU HD11 H 15.805 0.015 -2.391 1.00 . A A . 6 LEU HD11 1 1
10 2955 1 1 7 LEU HD12 H 15.299 0.705 -3.933 1.00 . A A . 6 LEU HD12 1 1
10 2956 1 1 7 LEU HD13 H 15.009 1.588 -2.434 1.00 . A A . 6 LEU HD13 1 1
10 2957 1 1 7 LEU HD21 H 16.439 3.652 -3.429 1.00 . A A . 6 LEU HD21 1 1
10 2958 1 1 7 LEU HD22 H 16.303 2.612 -4.848 1.00 . A A . 6 LEU HD22 1 1
10 2959 1 1 7 LEU HD23 H 17.887 3.175 -4.317 1.00 . A A . 6 LEU HD23 1 1
10 2960 1 1 7 LEU HG H 17.755 0.925 -3.536 1.00 . A A . 6 LEU HG 1 1
10 2961 1 1 7 LEU N N 19.718 2.133 -2.819 1.00 . A A . 6 LEU N 1 1
10 2962 1 1 7 LEU O O 18.979 3.438 0.473 1.00 . A A . 6 LEU O 1 1
10 2963 1 1 8 ALA C C 21.986 3.796 1.237 1.00 . A A . 7 ALA C 1 1
10 2964 1 1 8 ALA CA C 21.498 2.384 0.876 1.00 . A A . 7 ALA CA 1 1
10 2965 1 1 8 ALA CB C 22.690 1.413 0.807 1.00 . A A . 7 ALA CB 1 1
10 2966 1 1 8 ALA H H 21.158 1.943 -1.166 1.00 . A A . 7 ALA H 1 1
10 2967 1 1 8 ALA HA H 20.835 2.046 1.656 1.00 . A A . 7 ALA HA 1 1
10 2968 1 1 8 ALA HB1 H 22.419 0.555 0.211 1.00 . A A . 7 ALA HB1 1 1
10 2969 1 1 8 ALA HB2 H 22.952 1.086 1.804 1.00 . A A . 7 ALA HB2 1 1
10 2970 1 1 8 ALA HB3 H 23.542 1.905 0.361 1.00 . A A . 7 ALA HB3 1 1
10 2971 1 1 8 ALA N N 20.758 2.362 -0.381 1.00 . A A . 7 ALA N 1 1
10 2972 1 1 8 ALA O O 22.001 4.157 2.415 1.00 . A A . 7 ALA O 1 1
10 2973 1 1 9 PRO C C 21.925 6.772 1.456 1.00 . A A . 8 PRO C 1 1
10 2974 1 1 9 PRO CA C 22.876 5.991 0.551 1.00 . A A . 8 PRO CA 1 1
10 2975 1 1 9 PRO CB C 22.952 6.613 -0.850 1.00 . A A . 8 PRO CB 1 1
10 2976 1 1 9 PRO CD C 22.419 4.303 -1.169 1.00 . A A . 8 PRO CD 1 1
10 2977 1 1 9 PRO CG C 23.238 5.458 -1.743 1.00 . A A . 8 PRO CG 1 1
10 2978 1 1 9 PRO HA H 23.865 5.966 0.975 1.00 . A A . 8 PRO HA 1 1
10 2979 1 1 9 PRO HB2 H 22.000 7.072 -1.114 1.00 . A A . 8 PRO HB2 1 1
10 2980 1 1 9 PRO HB3 H 23.745 7.330 -0.911 1.00 . A A . 8 PRO HB3 1 1
10 2981 1 1 9 PRO HD2 H 21.425 4.316 -1.592 1.00 . A A . 8 PRO HD2 1 1
10 2982 1 1 9 PRO HD3 H 22.901 3.359 -1.343 1.00 . A A . 8 PRO HD3 1 1
10 2983 1 1 9 PRO HG2 H 22.929 5.686 -2.759 1.00 . A A . 8 PRO HG2 1 1
10 2984 1 1 9 PRO HG3 H 24.285 5.202 -1.713 1.00 . A A . 8 PRO HG3 1 1
10 2985 1 1 9 PRO N N 22.384 4.601 0.276 1.00 . A A . 8 PRO N 1 1
10 2986 1 1 9 PRO O O 22.330 7.348 2.464 1.00 . A A . 8 PRO O 1 1
10 2987 1 1 10 ALA C C 19.489 6.879 3.236 1.00 . A A . 9 ALA C 1 1
10 2988 1 1 10 ALA CA C 19.644 7.491 1.845 1.00 . A A . 9 ALA CA 1 1
10 2989 1 1 10 ALA CB C 18.305 7.439 1.111 1.00 . A A . 9 ALA CB 1 1
10 2990 1 1 10 ALA H H 20.408 6.307 0.261 1.00 . A A . 9 ALA H 1 1
10 2991 1 1 10 ALA HA H 19.941 8.522 1.948 1.00 . A A . 9 ALA HA 1 1
10 2992 1 1 10 ALA HB1 H 17.577 8.034 1.645 1.00 . A A . 9 ALA HB1 1 1
10 2993 1 1 10 ALA HB2 H 17.962 6.417 1.056 1.00 . A A . 9 ALA HB2 1 1
10 2994 1 1 10 ALA HB3 H 18.426 7.832 0.111 1.00 . A A . 9 ALA HB3 1 1
10 2995 1 1 10 ALA N N 20.660 6.783 1.076 1.00 . A A . 9 ALA N 1 1
10 2996 1 1 10 ALA O O 19.082 7.559 4.179 1.00 . A A . 9 ALA O 1 1
10 2997 1 1 11 LEU C C 21.031 5.023 5.384 1.00 . A A . 10 LEU C 1 1
10 2998 1 1 11 LEU CA C 19.715 4.877 4.628 1.00 . A A . 10 LEU CA 1 1
10 2999 1 1 11 LEU CB C 19.323 3.396 4.301 1.00 . A A . 10 LEU CB 1 1
10 3000 1 1 11 LEU CD1 C 19.525 2.459 6.660 1.00 . A A . 10 LEU CD1 1 1
10 3001 1 1 11 LEU CD2 C 19.728 0.959 4.632 1.00 . A A . 10 LEU CD2 1 1
10 3002 1 1 11 LEU CG C 20.027 2.360 5.196 1.00 . A A . 10 LEU CG 1 1
10 3003 1 1 11 LEU H H 20.134 5.095 2.583 1.00 . A A . 10 LEU H 1 1
10 3004 1 1 11 LEU HA H 18.953 5.327 5.215 1.00 . A A . 10 LEU HA 1 1
10 3005 1 1 11 LEU HB2 H 18.257 3.273 4.418 1.00 . A A . 10 LEU HB2 1 1
10 3006 1 1 11 LEU HB3 H 19.575 3.196 3.268 1.00 . A A . 10 LEU HB3 1 1
10 3007 1 1 11 LEU HD11 H 18.694 1.783 6.823 1.00 . A A . 10 LEU HD11 1 1
10 3008 1 1 11 LEU HD12 H 19.199 3.466 6.875 1.00 . A A . 10 LEU HD12 1 1
10 3009 1 1 11 LEU HD13 H 20.332 2.197 7.329 1.00 . A A . 10 LEU HD13 1 1
10 3010 1 1 11 LEU HD21 H 18.663 0.851 4.481 1.00 . A A . 10 LEU HD21 1 1
10 3011 1 1 11 LEU HD22 H 20.070 0.209 5.330 1.00 . A A . 10 LEU HD22 1 1
10 3012 1 1 11 LEU HD23 H 20.241 0.833 3.689 1.00 . A A . 10 LEU HD23 1 1
10 3013 1 1 11 LEU HG H 21.094 2.527 5.161 1.00 . A A . 10 LEU HG 1 1
10 3014 1 1 11 LEU N N 19.816 5.589 3.361 1.00 . A A . 10 LEU N 1 1
10 3015 1 1 11 LEU O O 21.147 4.703 6.566 1.00 . A A . 10 LEU O 1 1
10 3016 1 1 12 ALA C C 23.247 6.410 6.589 1.00 . A A . 11 ALA C 1 1
10 3017 1 1 12 ALA CA C 23.339 5.714 5.238 1.00 . A A . 11 ALA CA 1 1
10 3018 1 1 12 ALA CB C 24.202 6.548 4.290 1.00 . A A . 11 ALA CB 1 1
10 3019 1 1 12 ALA H H 21.829 5.736 3.746 1.00 . A A . 11 ALA H 1 1
10 3020 1 1 12 ALA HA H 23.809 4.752 5.376 1.00 . A A . 11 ALA HA 1 1
10 3021 1 1 12 ALA HB1 H 23.832 7.563 4.265 1.00 . A A . 11 ALA HB1 1 1
10 3022 1 1 12 ALA HB2 H 24.161 6.124 3.298 1.00 . A A . 11 ALA HB2 1 1
10 3023 1 1 12 ALA HB3 H 25.224 6.547 4.639 1.00 . A A . 11 ALA HB3 1 1
10 3024 1 1 12 ALA N N 22.010 5.510 4.672 1.00 . A A . 11 ALA N 1 1
10 3025 1 1 12 ALA O O 24.193 6.388 7.375 1.00 . A A . 11 ALA O 1 1
10 3026 1 1 13 LEU C C 21.788 6.708 9.250 1.00 . A A . 12 LEU C 1 1
10 3027 1 1 13 LEU CA C 21.906 7.721 8.119 1.00 . A A . 12 LEU CA 1 1
10 3028 1 1 13 LEU CB C 20.647 8.597 8.059 1.00 . A A . 12 LEU CB 1 1
10 3029 1 1 13 LEU CD1 C 21.525 9.501 5.887 1.00 . A A . 12 LEU CD1 1 1
10 3030 1 1 13 LEU CD2 C 19.619 10.636 7.049 1.00 . A A . 12 LEU CD2 1 1
10 3031 1 1 13 LEU CG C 20.930 9.869 7.251 1.00 . A A . 12 LEU CG 1 1
10 3032 1 1 13 LEU H H 21.379 7.013 6.198 1.00 . A A . 12 LEU H 1 1
10 3033 1 1 13 LEU HA H 22.763 8.346 8.306 1.00 . A A . 12 LEU HA 1 1
10 3034 1 1 13 LEU HB2 H 19.848 8.043 7.586 1.00 . A A . 12 LEU HB2 1 1
10 3035 1 1 13 LEU HB3 H 20.349 8.872 9.060 1.00 . A A . 12 LEU HB3 1 1
10 3036 1 1 13 LEU HD11 H 22.563 9.232 6.009 1.00 . A A . 12 LEU HD11 1 1
10 3037 1 1 13 LEU HD12 H 21.451 10.347 5.219 1.00 . A A . 12 LEU HD12 1 1
10 3038 1 1 13 LEU HD13 H 20.982 8.665 5.470 1.00 . A A . 12 LEU HD13 1 1
10 3039 1 1 13 LEU HD21 H 18.937 10.036 6.466 1.00 . A A . 12 LEU HD21 1 1
10 3040 1 1 13 LEU HD22 H 19.820 11.561 6.527 1.00 . A A . 12 LEU HD22 1 1
10 3041 1 1 13 LEU HD23 H 19.177 10.855 8.010 1.00 . A A . 12 LEU HD23 1 1
10 3042 1 1 13 LEU HG H 21.633 10.486 7.793 1.00 . A A . 12 LEU HG 1 1
10 3043 1 1 13 LEU N N 22.101 7.027 6.856 1.00 . A A . 12 LEU N 1 1
10 3044 1 1 13 LEU O O 22.630 6.667 10.145 1.00 . A A . 12 LEU O 1 1
10 3045 1 1 14 ALA C C 21.770 3.981 10.295 1.00 . A A . 13 ALA C 1 1
10 3046 1 1 14 ALA CA C 20.554 4.888 10.245 1.00 . A A . 13 ALA CA 1 1
10 3047 1 1 14 ALA CB C 19.299 4.056 9.982 1.00 . A A . 13 ALA CB 1 1
10 3048 1 1 14 ALA H H 20.097 5.957 8.472 1.00 . A A . 13 ALA H 1 1
10 3049 1 1 14 ALA HA H 20.452 5.388 11.196 1.00 . A A . 13 ALA HA 1 1
10 3050 1 1 14 ALA HB1 H 19.493 3.345 9.195 1.00 . A A . 13 ALA HB1 1 1
10 3051 1 1 14 ALA HB2 H 18.488 4.706 9.689 1.00 . A A . 13 ALA HB2 1 1
10 3052 1 1 14 ALA HB3 H 19.028 3.526 10.885 1.00 . A A . 13 ALA HB3 1 1
10 3053 1 1 14 ALA N N 20.742 5.889 9.207 1.00 . A A . 13 ALA N 1 1
10 3054 1 1 14 ALA O O 22.199 3.557 11.365 1.00 . A A . 13 ALA O 1 1
10 3055 1 1 15 LEU C C 24.573 3.405 9.986 1.00 . A A . 14 LEU C 1 1
10 3056 1 1 15 LEU CA C 23.501 2.824 9.084 1.00 . A A . 14 LEU CA 1 1
10 3057 1 1 15 LEU CB C 24.003 2.689 7.633 1.00 . A A . 14 LEU CB 1 1
10 3058 1 1 15 LEU CD1 C 24.966 0.909 6.097 1.00 . A A . 14 LEU CD1 1 1
10 3059 1 1 15 LEU CD2 C 26.477 2.070 7.693 1.00 . A A . 14 LEU CD2 1 1
10 3060 1 1 15 LEU CG C 25.047 1.536 7.494 1.00 . A A . 14 LEU CG 1 1
10 3061 1 1 15 LEU H H 21.957 4.044 8.296 1.00 . A A . 14 LEU H 1 1
10 3062 1 1 15 LEU HA H 23.227 1.861 9.462 1.00 . A A . 14 LEU HA 1 1
10 3063 1 1 15 LEU HB2 H 23.149 2.490 6.998 1.00 . A A . 14 LEU HB2 1 1
10 3064 1 1 15 LEU HB3 H 24.450 3.625 7.329 1.00 . A A . 14 LEU HB3 1 1
10 3065 1 1 15 LEU HD11 H 25.733 0.156 5.996 1.00 . A A . 14 LEU HD11 1 1
10 3066 1 1 15 LEU HD12 H 25.109 1.674 5.348 1.00 . A A . 14 LEU HD12 1 1
10 3067 1 1 15 LEU HD13 H 23.995 0.452 5.965 1.00 . A A . 14 LEU HD13 1 1
10 3068 1 1 15 LEU HD21 H 27.185 1.282 7.486 1.00 . A A . 14 LEU HD21 1 1
10 3069 1 1 15 LEU HD22 H 26.603 2.404 8.709 1.00 . A A . 14 LEU HD22 1 1
10 3070 1 1 15 LEU HD23 H 26.653 2.895 7.018 1.00 . A A . 14 LEU HD23 1 1
10 3071 1 1 15 LEU HG H 24.844 0.766 8.225 1.00 . A A . 14 LEU HG 1 1
10 3072 1 1 15 LEU N N 22.331 3.683 9.130 1.00 . A A . 14 LEU N 1 1
10 3073 1 1 15 LEU O O 25.158 2.697 10.801 1.00 . A A . 14 LEU O 1 1
10 3074 1 1 16 ALA C C 25.451 5.187 12.138 1.00 . A A . 15 ALA C 1 1
10 3075 1 1 16 ALA CA C 25.825 5.349 10.667 1.00 . A A . 15 ALA CA 1 1
10 3076 1 1 16 ALA CB C 25.914 6.835 10.316 1.00 . A A . 15 ALA CB 1 1
10 3077 1 1 16 ALA H H 24.322 5.225 9.181 1.00 . A A . 15 ALA H 1 1
10 3078 1 1 16 ALA HA H 26.783 4.886 10.492 1.00 . A A . 15 ALA HA 1 1
10 3079 1 1 16 ALA HB1 H 24.937 7.286 10.408 1.00 . A A . 15 ALA HB1 1 1
10 3080 1 1 16 ALA HB2 H 26.266 6.943 9.300 1.00 . A A . 15 ALA HB2 1 1
10 3081 1 1 16 ALA HB3 H 26.602 7.323 10.989 1.00 . A A . 15 ALA HB3 1 1
10 3082 1 1 16 ALA N N 24.823 4.698 9.844 1.00 . A A . 15 ALA N 1 1
10 3083 1 1 16 ALA O O 26.310 5.224 13.018 1.00 . A A . 15 ALA O 1 1
10 3084 1 1 17 LEU C C 23.979 3.478 14.336 1.00 . A A . 16 LEU C 1 1
10 3085 1 1 17 LEU CA C 23.657 4.857 13.751 1.00 . A A . 16 LEU CA 1 1
10 3086 1 1 17 LEU CB C 22.134 5.109 13.797 1.00 . A A . 16 LEU CB 1 1
10 3087 1 1 17 LEU CD1 C 21.888 7.079 15.380 1.00 . A A . 16 LEU CD1 1 1
10 3088 1 1 17 LEU CD2 C 20.207 5.240 15.430 1.00 . A A . 16 LEU CD2 1 1
10 3089 1 1 17 LEU CG C 21.693 5.565 15.213 1.00 . A A . 16 LEU CG 1 1
10 3090 1 1 17 LEU H H 23.519 5.002 11.645 1.00 . A A . 16 LEU H 1 1
10 3091 1 1 17 LEU HA H 24.137 5.594 14.359 1.00 . A A . 16 LEU HA 1 1
10 3092 1 1 17 LEU HB2 H 21.880 5.872 13.074 1.00 . A A . 16 LEU HB2 1 1
10 3093 1 1 17 LEU HB3 H 21.616 4.196 13.538 1.00 . A A . 16 LEU HB3 1 1
10 3094 1 1 17 LEU HD11 H 21.398 7.599 14.571 1.00 . A A . 16 LEU HD11 1 1
10 3095 1 1 17 LEU HD12 H 22.941 7.315 15.374 1.00 . A A . 16 LEU HD12 1 1
10 3096 1 1 17 LEU HD13 H 21.458 7.392 16.319 1.00 . A A . 16 LEU HD13 1 1
10 3097 1 1 17 LEU HD21 H 20.058 4.173 15.351 1.00 . A A . 16 LEU HD21 1 1
10 3098 1 1 17 LEU HD22 H 19.616 5.743 14.680 1.00 . A A . 16 LEU HD22 1 1
10 3099 1 1 17 LEU HD23 H 19.905 5.575 16.411 1.00 . A A . 16 LEU HD23 1 1
10 3100 1 1 17 LEU HG H 22.286 5.047 15.956 1.00 . A A . 16 LEU HG 1 1
10 3101 1 1 17 LEU N N 24.154 5.016 12.389 1.00 . A A . 16 LEU N 1 1
10 3102 1 1 17 LEU O O 24.757 3.378 15.285 1.00 . A A . 16 LEU O 1 1
10 3103 1 1 18 TRP C C 25.003 0.523 13.918 1.00 . A A . 17 TRP C 1 1
10 3104 1 1 18 TRP CA C 23.640 1.072 14.318 1.00 . A A . 17 TRP CA 1 1
10 3105 1 1 18 TRP CB C 22.543 0.089 13.913 1.00 . A A . 17 TRP CB 1 1
10 3106 1 1 18 TRP CD1 C 21.442 0.789 11.748 1.00 . A A . 17 TRP CD1 1 1
10 3107 1 1 18 TRP CD2 C 23.004 -0.803 11.450 1.00 . A A . 17 TRP CD2 1 1
10 3108 1 1 18 TRP CE2 C 22.472 -0.513 10.175 1.00 . A A . 17 TRP CE2 1 1
10 3109 1 1 18 TRP CE3 C 24.013 -1.780 11.540 1.00 . A A . 17 TRP CE3 1 1
10 3110 1 1 18 TRP CG C 22.334 0.039 12.434 1.00 . A A . 17 TRP CG 1 1
10 3111 1 1 18 TRP CH2 C 23.923 -2.132 9.133 1.00 . A A . 17 TRP CH2 1 1
10 3112 1 1 18 TRP CZ2 C 22.921 -1.164 9.027 1.00 . A A . 17 TRP CZ2 1 1
10 3113 1 1 18 TRP CZ3 C 24.469 -2.439 10.387 1.00 . A A . 17 TRP CZ3 1 1
10 3114 1 1 18 TRP H H 22.760 2.528 13.038 1.00 . A A . 17 TRP H 1 1
10 3115 1 1 18 TRP HA H 23.627 1.141 15.397 1.00 . A A . 17 TRP HA 1 1
10 3116 1 1 18 TRP HB2 H 22.826 -0.888 14.245 1.00 . A A . 17 TRP HB2 1 1
10 3117 1 1 18 TRP HB3 H 21.622 0.377 14.397 1.00 . A A . 17 TRP HB3 1 1
10 3118 1 1 18 TRP HD1 H 20.776 1.523 12.176 1.00 . A A . 17 TRP HD1 1 1
10 3119 1 1 18 TRP HE1 H 20.985 0.861 9.692 1.00 . A A . 17 TRP HE1 1 1
10 3120 1 1 18 TRP HE3 H 24.439 -2.024 12.501 1.00 . A A . 17 TRP HE3 1 1
10 3121 1 1 18 TRP HH2 H 24.278 -2.642 8.248 1.00 . A A . 17 TRP HH2 1 1
10 3122 1 1 18 TRP HZ2 H 22.495 -0.921 8.066 1.00 . A A . 17 TRP HZ2 1 1
10 3123 1 1 18 TRP HZ3 H 25.243 -3.188 10.467 1.00 . A A . 17 TRP HZ3 1 1
10 3124 1 1 18 TRP N N 23.381 2.413 13.790 1.00 . A A . 17 TRP N 1 1
10 3125 1 1 18 TRP NE1 N 21.524 0.462 10.407 1.00 . A A . 17 TRP NE1 1 1
10 3126 1 1 18 TRP O O 25.700 -0.068 14.742 1.00 . A A . 17 TRP O 1 1
10 3127 1 1 19 TRP C C 27.772 0.683 13.170 1.00 . A A . 18 TRP C 1 1
10 3128 1 1 19 TRP CA C 26.685 0.207 12.216 1.00 . A A . 18 TRP CA 1 1
10 3129 1 1 19 TRP CB C 26.995 0.711 10.800 1.00 . A A . 18 TRP CB 1 1
10 3130 1 1 19 TRP CD1 C 27.946 -1.344 9.681 1.00 . A A . 18 TRP CD1 1 1
10 3131 1 1 19 TRP CD2 C 29.502 0.238 10.039 1.00 . A A . 18 TRP CD2 1 1
10 3132 1 1 19 TRP CE2 C 30.161 -0.846 9.414 1.00 . A A . 18 TRP CE2 1 1
10 3133 1 1 19 TRP CE3 C 30.264 1.373 10.372 1.00 . A A . 18 TRP CE3 1 1
10 3134 1 1 19 TRP CG C 28.095 -0.104 10.197 1.00 . A A . 18 TRP CG 1 1
10 3135 1 1 19 TRP CH2 C 32.268 0.324 9.467 1.00 . A A . 18 TRP CH2 1 1
10 3136 1 1 19 TRP CZ2 C 31.523 -0.809 9.130 1.00 . A A . 18 TRP CZ2 1 1
10 3137 1 1 19 TRP CZ3 C 31.640 1.413 10.087 1.00 . A A . 18 TRP CZ3 1 1
10 3138 1 1 19 TRP H H 24.802 1.184 12.046 1.00 . A A . 18 TRP H 1 1
10 3139 1 1 19 TRP HA H 26.661 -0.873 12.213 1.00 . A A . 18 TRP HA 1 1
10 3140 1 1 19 TRP HB2 H 26.111 0.627 10.190 1.00 . A A . 18 TRP HB2 1 1
10 3141 1 1 19 TRP HB3 H 27.301 1.747 10.845 1.00 . A A . 18 TRP HB3 1 1
10 3142 1 1 19 TRP HD1 H 27.021 -1.897 9.641 1.00 . A A . 18 TRP HD1 1 1
10 3143 1 1 19 TRP HE1 H 29.338 -2.654 8.796 1.00 . A A . 18 TRP HE1 1 1
10 3144 1 1 19 TRP HE3 H 29.789 2.217 10.851 1.00 . A A . 18 TRP HE3 1 1
10 3145 1 1 19 TRP HH2 H 33.325 0.361 9.250 1.00 . A A . 18 TRP HH2 1 1
10 3146 1 1 19 TRP HZ2 H 31.999 -1.653 8.652 1.00 . A A . 18 TRP HZ2 1 1
10 3147 1 1 19 TRP HZ3 H 32.215 2.289 10.347 1.00 . A A . 18 TRP HZ3 1 1
10 3148 1 1 19 TRP N N 25.389 0.710 12.667 1.00 . A A . 18 TRP N 1 1
10 3149 1 1 19 TRP NE1 N 29.171 -1.786 9.216 1.00 . A A . 18 TRP NE1 1 1
10 3150 1 1 19 TRP O O 28.553 -0.112 13.693 1.00 . A A . 18 TRP O 1 1
10 3151 1 1 20 ALA C C 28.195 2.783 15.670 1.00 . A A . 19 ALA C 1 1
10 3152 1 1 20 ALA CA C 28.787 2.612 14.278 1.00 . A A . 19 ALA CA 1 1
10 3153 1 1 20 ALA CB C 29.211 3.975 13.726 1.00 . A A . 19 ALA CB 1 1
10 3154 1 1 20 ALA H H 27.152 2.562 12.936 1.00 . A A . 19 ALA H 1 1
10 3155 1 1 20 ALA HA H 29.653 1.980 14.347 1.00 . A A . 19 ALA HA 1 1
10 3156 1 1 20 ALA HB1 H 28.430 4.697 13.908 1.00 . A A . 19 ALA HB1 1 1
10 3157 1 1 20 ALA HB2 H 29.387 3.894 12.664 1.00 . A A . 19 ALA HB2 1 1
10 3158 1 1 20 ALA HB3 H 30.118 4.295 14.218 1.00 . A A . 19 ALA HB3 1 1
10 3159 1 1 20 ALA N N 27.805 1.994 13.386 1.00 . A A . 19 ALA N 1 1
10 3160 1 1 20 ALA O O 28.560 3.699 16.407 1.00 . A A . 19 ALA O 1 1
10 3161 1 1 21 ETA CA C 26.631 1.940 17.322 1.00 . A A . 20 ETA CA 1 1
10 3162 1 1 21 ETA CB C 27.633 1.617 18.428 1.00 . A A . 20 ETA CB 1 1
10 3163 1 1 21 ETA HA1 H 25.831 1.216 17.353 1.00 . A A . 20 ETA HA1 1 1
10 3164 1 1 21 ETA HA2 H 26.224 2.930 17.481 1.00 . A A . 20 ETA HA2 1 1
10 3165 1 1 21 ETA HB1 H 27.116 1.581 19.380 1.00 . A A . 20 ETA HB1 1 1
10 3166 1 1 21 ETA HB2 H 28.390 2.379 18.467 1.00 . A A . 20 ETA HB2 1 1
10 3167 1 1 21 ETA HN2 H 27.033 1.187 15.380 1.00 . A A . 20 ETA HN2 1 1
10 3168 1 1 21 ETA HO H 29.032 0.536 17.613 1.00 . A A . 20 ETA HO 1 1
10 3169 1 1 21 ETA N N 27.278 1.891 16.017 1.00 . A A . 20 ETA N 1 1
10 3170 1 1 21 ETA O O 28.251 0.367 18.145 1.00 . A A . 20 ETA O 1 1
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