NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
560297 |
2m5q   |
19071 | cing | 4-filtered-FRED | STAR | entry | full | 208 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2m5q
# This FRED archive file contains, for PDB entry <2m5q>:
#
# - 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_2m5q
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2m5q
_Assembly.Number_of_components 4
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 3878.31
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 $Glucagon A . 1 1
2 . 2 $GAMMA_L_GLUTAMIC_ACID B . 1 1
3 . 2 $GAMMA_L_GLUTAMIC_ACID C . 1 1
4 . 3 $PALMITIC_ACID D . 1 1
stop_
loop_
_PDBX_nonpoly_scheme.Entity_assembly_ID
_PDBX_nonpoly_scheme.Entity_ID
_PDBX_nonpoly_scheme.Mon_ID
_PDBX_nonpoly_scheme.Comp_index_ID
_PDBX_nonpoly_scheme.Comp_ID
_PDBX_nonpoly_scheme.Entry_ID
_PDBX_nonpoly_scheme.Assembly_ID
2 2 . 1 . 1 1
3 2 . 1 . 1 1
4 3 PLM 1 PLM 1 1
stop_
save_
save_Glucagon
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name Glucagon
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code HXQGTFTSDYSKKLDXRRAQDFVQWLMNTX
_Entity.Number_of_monomers 30
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 HIS . 1 1
2 ABA $ABA 1 1
3 GLN . 1 1
4 GLY . 1 1
5 THR . 1 1
6 PHE . 1 1
7 THR . 1 1
8 SER . 1 1
9 ASP . 1 1
10 TYR . 1 1
11 SER . 1 1
12 LYS . 1 1
13 LYS . 1 1
14 LEU . 1 1
15 ASP . 1 1
16 ABA $ABA 1 1
17 ARG . 1 1
18 ARG . 1 1
19 ALA . 1 1
20 GLN . 1 1
21 ASP . 1 1
22 PHE . 1 1
23 VAL . 1 1
24 GLN . 1 1
25 TRP . 1 1
26 LEU . 1 1
27 MET . 1 1
28 ASN . 1 1
29 THR . 1 1
30 NH2 $NH2 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
HIS 1 1 1 1
ABA 2 2 1 1
GLN 3 3 1 1
GLY 4 4 1 1
THR 5 5 1 1
PHE 6 6 1 1
THR 7 7 1 1
SER 8 8 1 1
ASP 9 9 1 1
TYR 10 10 1 1
SER 11 11 1 1
LYS 12 12 1 1
LYS 13 13 1 1
LEU 14 14 1 1
ASP 15 15 1 1
ABA 16 16 1 1
ARG 17 17 1 1
ARG 18 18 1 1
ALA 19 19 1 1
GLN 20 20 1 1
ASP 21 21 1 1
PHE 22 22 1 1
VAL 23 23 1 1
GLN 24 24 1 1
TRP 25 25 1 1
LEU 26 26 1 1
MET 27 27 1 1
ASN 28 28 1 1
THR 29 29 1 1
NH2 30 30 1 1
stop_
save_
save_GAMMA_L_GLUTAMIC_ACID
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "GAMMA L GLUTAMIC ACID"
_Entity.Type non-polymer
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . $. 1 2
stop_
save_
save_PALMITIC_ACID
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 3
_Entity.Name "PALMITIC ACID"
_Entity.Type non-polymer
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 PLM $PLM 1 3
stop_
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_ABA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ABA
_Chem_comp.Type non-polymer
save_
save_PLM
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID PLM
_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
206 1 . . . 1 1
207 1 . . . 1 1
208 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 3 GLN HA . 3 . HA 1 1
1 1 2 1 1 3 GLN QB . 3 . HB# 1 1
2 1 1 1 1 3 GLN HA . 3 . HA 1 1
2 1 2 1 1 3 GLN QG . 3 . HG# 1 1
3 1 1 1 1 3 GLN HA . 3 . HA 1 1
3 1 2 1 1 6 PHE QB . 6 . HB# 1 1
4 1 1 1 1 3 GLN HA . 3 . HA 1 1
4 1 2 1 1 6 PHE QD . 6 . HD* 1 1
5 1 1 1 1 3 GLN QB . 3 . HB# 1 1
5 1 2 1 1 7 THR MG . 7 . HG2# 1 1
6 1 1 1 1 4 GLY QA . 4 . HA# 1 1
6 1 2 1 1 5 THR MG . 5 . HG2# 1 1
7 1 1 1 1 5 THR HA . 5 . HA 1 1
7 1 2 1 1 5 THR HB . 5 . HB 1 1
8 1 1 1 1 5 THR HA . 5 . HA 1 1
8 1 2 1 1 5 THR MG . 5 . HG2# 1 1
9 1 1 1 1 5 THR MG . 5 . HG2# 1 1
9 1 2 1 1 6 PHE HA . 6 . HA 1 1
10 1 1 1 1 6 PHE HA . 6 . HA 1 1
10 1 2 1 1 6 PHE QB . 6 . HB# 1 1
11 1 1 1 1 6 PHE HA . 6 . HA 1 1
11 1 2 1 1 6 PHE QD . 6 . HD* 1 1
12 1 1 1 1 6 PHE HA . 6 . HA 1 1
12 1 2 1 1 9 ASP QB . 9 . HB# 1 1
13 1 1 1 1 6 PHE QB . 6 . HB# 1 1
13 1 2 1 1 6 PHE QD . 6 . HD* 1 1
14 1 1 1 1 6 PHE QB . 6 . HB# 1 1
14 1 2 1 1 7 THR HA . 7 . HA 1 1
15 1 1 1 1 6 PHE QB . 6 . HB# 1 1
15 1 2 1 1 10 TYR QE . 10 . HE# 1 1
16 1 1 1 1 6 PHE QD . 6 . HD* 1 1
16 1 2 1 1 7 THR HA . 7 . HA 1 1
17 1 1 1 1 6 PHE QD . 6 . HD* 1 1
17 1 2 1 1 7 THR MG . 7 . HG2# 1 1
18 1 1 1 1 6 PHE QD . 6 . HD* 1 1
18 1 2 1 1 10 TYR QB . 10 . HB# 1 1
19 1 1 1 1 7 THR HA . 7 . HA 1 1
19 1 2 1 1 7 THR HB . 7 . HB 1 1
20 1 1 1 1 7 THR HA . 7 . HA 1 1
20 1 2 1 1 7 THR MG . 7 . HG2# 1 1
21 1 1 1 1 7 THR HA . 7 . HA 1 1
21 1 2 1 1 10 TYR QB . 10 . HB# 1 1
22 1 1 1 1 7 THR MG . 7 . HG2# 1 1
22 1 2 1 1 10 TYR QB . 10 . HB# 1 1
23 1 1 1 1 8 SER HA . 8 . HA 1 1
23 1 2 1 1 8 SER QB . 8 . HB# 1 1
24 1 1 1 1 9 ASP HA . 9 . HA 1 1
24 1 2 1 1 9 ASP QB . 9 . HB# 1 1
25 1 1 1 1 9 ASP HA . 9 . HA 1 1
25 1 2 1 1 12 LYS QB . 12 . HB# 1 1
26 1 1 1 1 9 ASP HA . 9 . HA 1 1
26 1 2 1 1 12 LYS QG . 12 . HG# 1 1
27 1 1 1 1 10 TYR HA . 10 . HA 1 1
27 1 2 1 1 10 TYR HB2 . 10 . HB2 1 1
28 1 1 1 1 10 TYR HA . 10 . HA 1 1
28 1 2 1 1 10 TYR QB . 10 . HB# 1 1
29 1 1 1 1 10 TYR HA . 10 . HA 1 1
29 1 2 1 1 10 TYR QD . 10 . HD* 1 1
30 1 1 1 1 10 TYR HA . 10 . HA 1 1
30 1 2 1 1 10 TYR QE . 10 . HE# 1 1
31 1 1 1 1 10 TYR HA . 10 . HA 1 1
31 1 2 1 1 13 LYS QB . 13 . HB# 1 1
32 1 1 1 1 10 TYR QB . 10 . HB# 1 1
32 1 2 1 1 10 TYR QD . 10 . HD* 1 1
33 1 1 1 1 10 TYR QB . 10 . HB# 1 1
33 1 2 1 1 10 TYR QE . 10 . HE# 1 1
34 1 1 1 1 10 TYR QB . 10 . HB# 1 1
34 1 2 1 1 14 LEU QD . 14 . HD* 1 1
35 1 1 1 1 10 TYR QD . 10 . HD* 1 1
35 1 2 1 1 14 LEU HA . 14 . HA 1 1
36 1 1 1 1 10 TYR QD . 10 . HD# 1 1
36 1 2 1 1 14 LEU QB . 14 . HB# 1 1
37 1 1 1 1 10 TYR QD . 10 . HD* 1 1
37 1 2 1 1 14 LEU QD . 14 . HD* 1 1
38 1 1 1 1 10 TYR QE . 10 . HE# 1 1
38 1 2 1 1 14 LEU HA . 14 . HA 1 1
39 1 1 1 1 10 TYR QE . 10 . HE# 1 1
39 1 2 1 1 14 LEU QD . 14 . HD* 1 1
40 1 1 1 1 11 SER HA . 11 . HA 1 1
40 1 2 1 1 11 SER QB . 11 . HB# 1 1
41 1 1 1 1 12 LYS HA . 12 . HA 1 1
41 1 2 1 1 12 LYS QD . 12 . HD* 1 1
42 1 1 1 1 12 LYS HA . 12 . HA 1 1
42 1 2 1 1 12 LYS QG . 12 . HG# 1 1
43 1 1 1 1 12 LYS HA . 12 . HA 1 1
43 1 2 1 1 15 ASP QB . 15 . HB# 1 1
44 1 1 1 1 12 LYS QE . 12 . HE# 1 1
44 1 2 1 1 12 LYS QG . 12 . HG# 1 1
45 1 1 1 1 13 LYS H . 13 . HN 1 1
45 1 2 1 1 13 LYS HA . 13 . HA 1 1
46 1 1 1 1 13 LYS H . 13 . HN 1 1
46 1 2 1 1 13 LYS QB . 13 . HB# 1 1
47 1 1 1 1 13 LYS HA . 13 . HA 1 1
47 1 2 1 1 13 LYS QB . 13 . HB# 1 1
48 1 1 1 1 13 LYS HA . 13 . HA 1 1
48 1 2 1 1 13 LYS QD . 13 . HD* 1 1
49 1 1 1 1 13 LYS QD . 13 . HD* 1 1
49 1 2 1 1 17 ARG QB . 17 . HB# 1 1
50 1 1 1 1 13 LYS QE . 13 . HE# 1 1
50 1 2 1 1 13 LYS QG . 13 . HG# 1 1
51 1 1 1 1 13 LYS QG . 13 . HG# 1 1
51 1 2 1 1 17 ARG H . 17 . HN 1 1
52 1 1 1 1 14 LEU HA . 14 . HA 1 1
52 1 2 1 1 14 LEU QB . 14 . HB# 1 1
53 1 1 1 1 14 LEU HA . 14 . HA 1 1
53 1 2 1 1 14 LEU QD . 14 . HD* 1 1
54 1 1 1 1 14 LEU HA . 14 . HA 1 1
54 1 2 1 1 14 LEU HG . 14 . HG 1 1
55 1 1 1 1 14 LEU HA . 14 . HA 1 1
55 1 2 1 1 18 ARG H . 18 . HN 1 1
56 1 1 1 1 14 LEU QB . 14 . HB# 1 1
56 1 2 1 1 14 LEU QD . 14 . HD* 1 1
57 1 1 1 1 14 LEU QB . 14 . HB# 1 1
57 1 2 1 1 14 LEU HG . 14 . HG 1 1
58 1 1 1 1 14 LEU QB . 14 . HB# 1 1
58 1 2 1 1 15 ASP QB . 15 . HB# 1 1
59 1 1 1 1 14 LEU QB . 14 . HB# 1 1
59 1 2 1 1 17 ARG H . 17 . HN 1 1
60 1 1 1 1 14 LEU QB . 14 . HB# 1 1
60 1 2 1 1 18 ARG H . 18 . HN 1 1
61 1 1 1 1 14 LEU QD . 14 . HD* 1 1
61 1 2 1 1 15 ASP QB . 15 . HB# 1 1
62 1 1 1 1 14 LEU QD . 14 . HD* 1 1
62 1 2 1 1 18 ARG H . 18 . HN 1 1
63 1 1 1 1 15 ASP HA . 15 . HA 1 1
63 1 2 1 1 15 ASP QB . 15 . HB# 1 1
64 1 1 1 1 15 ASP HA . 15 . HA 1 1
64 1 2 1 1 17 ARG QB . 17 . HB# 1 1
65 1 1 1 1 15 ASP HA . 15 . HA 1 1
65 1 2 1 1 18 ARG QB . 18 . HB# 1 1
66 1 1 1 1 17 ARG H . 17 . HN 1 1
66 1 2 1 1 20 GLN H . 20 . HN 1 1
67 1 1 1 1 17 ARG HA . 17 . HA 1 1
67 1 2 1 1 17 ARG QD . 17 . HD* 1 1
68 1 1 1 1 17 ARG HA . 17 . HA 1 1
68 1 2 1 1 20 GLN QB . 20 . HB# 1 1
69 1 1 1 1 17 ARG HA . 17 . HA 1 1
69 1 2 1 1 21 ASP QB . 21 . HB# 1 1
70 1 1 1 1 17 ARG QB . 17 . HB# 1 1
70 1 2 1 1 17 ARG QD . 17 . HD* 1 1
71 1 1 1 1 17 ARG QB . 17 . HB# 1 1
71 1 2 1 1 18 ARG QB . 18 . HB# 1 1
72 1 1 1 1 17 ARG QB . 17 . HB# 1 1
72 1 2 1 1 20 GLN H . 20 . HN 1 1
73 1 1 1 1 18 ARG H . 18 . HN 1 1
73 1 2 1 1 18 ARG HA . 18 . HA 1 1
74 1 1 1 1 18 ARG H . 18 . HN 1 1
74 1 2 1 1 18 ARG QB . 18 . HB# 1 1
75 1 1 1 1 18 ARG H . 18 . HN 1 1
75 1 2 1 1 18 ARG QD . 18 . HD* 1 1
76 1 1 1 1 18 ARG H . 18 . HN 1 1
76 1 2 1 1 18 ARG QG . 18 . HG# 1 1
77 1 1 1 1 18 ARG H . 18 . HN 1 1
77 1 2 1 1 19 ALA HA . 19 . HA 1 1
78 1 1 1 1 18 ARG H . 18 . HN 1 1
78 1 2 1 1 19 ALA MB . 19 . HB# 1 1
79 1 1 1 1 18 ARG H . 18 . HN 1 1
79 1 2 1 1 20 GLN H . 20 . HN 1 1
80 1 1 1 1 18 ARG HA . 18 . HA 1 1
80 1 2 1 1 18 ARG QB . 18 . HB# 1 1
81 1 1 1 1 18 ARG HA . 18 . HA 1 1
81 1 2 1 1 18 ARG QD . 18 . HD* 1 1
82 1 1 1 1 18 ARG QB . 18 . HB# 1 1
82 1 2 1 1 18 ARG QD . 18 . HD* 1 1
83 1 1 1 1 18 ARG QB . 18 . HB# 1 1
83 1 2 1 1 19 ALA H . 19 . HN 1 1
84 1 1 1 1 19 ALA HA . 19 . HA 1 1
84 1 2 1 1 22 PHE QB . 22 . HB# 1 1
85 1 1 1 1 19 ALA HA . 19 . HA 1 1
85 1 2 1 1 22 PHE QD . 22 . HD* 1 1
86 1 1 1 1 19 ALA HA . 19 . HA 1 1
86 1 2 1 1 23 VAL H . 23 . HN 1 1
87 1 1 1 1 19 ALA HA . 19 . HA 1 1
87 1 2 1 1 23 VAL QG . 23 . HG* 1 1
88 1 1 1 1 19 ALA MB . 19 . HB# 1 1
88 1 2 1 1 20 GLN H . 20 . HN 1 1
89 1 1 1 1 19 ALA MB . 19 . HB# 1 1
89 1 2 1 1 20 GLN QB . 20 . HB# 1 1
90 1 1 1 1 19 ALA MB . 19 . HB# 1 1
90 1 2 1 1 20 GLN QG . 20 . HG# 1 1
91 1 1 1 1 19 ALA MB . 19 . HB# 1 1
91 1 2 1 1 22 PHE QB . 22 . HB# 1 1
92 1 1 1 1 19 ALA MB . 19 . HB# 1 1
92 1 2 1 1 22 PHE QD . 22 . HD# 1 1
93 1 1 1 1 19 ALA MB . 19 . HB# 1 1
93 1 2 1 1 23 VAL HB . 23 . HB 1 1
94 1 1 1 1 19 ALA MB . 19 . HB# 1 1
94 1 2 1 1 23 VAL QG . 23 . HG* 1 1
95 1 1 1 1 20 GLN H . 20 . HN 1 1
95 1 2 1 1 20 GLN HA . 20 . HA 1 1
96 1 1 1 1 20 GLN H . 20 . HN 1 1
96 1 2 1 1 20 GLN QB . 20 . HB# 1 1
97 1 1 1 1 20 GLN H . 20 . HN 1 1
97 1 2 1 1 20 GLN QG . 20 . HG# 1 1
98 1 1 1 1 20 GLN H . 20 . HN 1 1
98 1 2 1 1 23 VAL QG . 23 . HG* 1 1
99 1 1 1 1 20 GLN HA . 20 . HA 1 1
99 1 2 1 1 20 GLN QG . 20 . HG# 1 1
100 1 1 1 1 20 GLN HA . 20 . HA 1 1
100 1 2 1 1 23 VAL H . 23 . HN 1 1
101 1 1 1 1 20 GLN HA . 20 . HA 1 1
101 1 2 1 1 23 VAL HB . 23 . HB 1 1
102 1 1 1 1 20 GLN HA . 20 . HA 1 1
102 1 2 1 1 23 VAL QG . 23 . HG* 1 1
103 1 1 1 1 21 ASP HA . 21 . HA 1 1
103 1 2 1 1 21 ASP QB . 21 . HB# 1 1
104 1 1 1 1 21 ASP HA . 21 . HA 1 1
104 1 2 1 1 24 GLN H . 24 . HN 1 1
105 1 1 1 1 22 PHE H . 22 . HN 1 1
105 1 2 1 1 22 PHE QE . 22 . HE# 1 1
106 1 1 1 1 22 PHE HA . 22 . HA 1 1
106 1 2 1 1 22 PHE HB2 . 22 . HB2 1 1
107 1 1 1 1 22 PHE HA . 22 . HA 1 1
107 1 2 1 1 22 PHE QB . 22 . HB# 1 1
108 1 1 1 1 22 PHE HA . 22 . HA 1 1
108 1 2 1 1 22 PHE QD . 22 . HD* 1 1
109 1 1 1 1 22 PHE HA . 22 . HA 1 1
109 1 2 1 1 22 PHE QE . 22 . HE# 1 1
110 1 1 1 1 22 PHE HA . 22 . HA 1 1
110 1 2 1 1 23 VAL H . 23 . HN 1 1
111 1 1 1 1 22 PHE HA . 22 . HA 1 1
111 1 2 1 1 25 TRP H . 25 . HN 1 1
112 1 1 1 1 22 PHE HA . 22 . HA 1 1
112 1 2 1 1 25 TRP QB . 25 . HB# 1 1
113 1 1 1 1 22 PHE HA . 22 . HA 1 1
113 1 2 1 1 25 TRP HE3 . 25 . HE3 1 1
114 1 1 1 1 22 PHE HA . 22 . HA 1 1
114 1 2 1 1 25 TRP HZ3 . 25 . HZ3 1 1
115 1 1 1 1 22 PHE HA . 22 . HA 1 1
115 1 2 1 1 26 LEU H . 26 . HN 1 1
116 1 1 1 1 22 PHE QB . 22 . HB# 1 1
116 1 2 1 1 22 PHE QD . 22 . HD* 1 1
117 1 1 1 1 22 PHE QB . 22 . HB# 1 1
117 1 2 1 1 22 PHE QE . 22 . HE# 1 1
118 1 1 1 1 22 PHE QB . 22 . HB# 1 1
118 1 2 1 1 23 VAL H . 23 . HN 1 1
119 1 1 1 1 22 PHE QB . 22 . HB# 1 1
119 1 2 1 1 23 VAL QG . 23 . HG* 1 1
120 1 1 1 1 22 PHE QB . 22 . HB# 1 1
120 1 2 1 1 25 TRP H . 25 . HN 1 1
121 1 1 1 1 22 PHE HB3 . 22 . HB1 1 1
121 1 2 1 1 22 PHE QD . 22 . HD* 1 1
122 1 1 1 1 22 PHE QD . 22 . HD* 1 1
122 1 2 1 1 23 VAL H . 23 . HN 1 1
123 1 1 1 1 22 PHE QD . 22 . HD# 1 1
123 1 2 1 1 23 VAL HA . 23 . HA 1 1
124 1 1 1 1 22 PHE QD . 22 . HD# 1 1
124 1 2 1 1 23 VAL QG . 23 . HG* 1 1
125 1 1 1 1 22 PHE QD . 22 . HD# 1 1
125 1 2 1 1 26 LEU QD . 26 . HD* 1 1
126 1 1 1 1 22 PHE QE . 22 . HE# 1 1
126 1 2 1 1 23 VAL HA . 23 . HA 1 1
127 1 1 1 1 22 PHE QE . 22 . HE# 1 1
127 1 2 1 1 23 VAL QG . 23 . HG* 1 1
128 1 1 1 1 22 PHE QE . 22 . HE# 1 1
128 1 2 1 1 25 TRP HZ3 . 25 . HZ3 1 1
129 1 1 1 1 22 PHE QE . 22 . HE# 1 1
129 1 2 1 1 26 LEU QB . 26 . HB# 1 1
130 1 1 1 1 22 PHE QE . 22 . HE# 1 1
130 1 2 1 1 26 LEU QD . 26 . HD* 1 1
131 1 1 1 1 23 VAL H . 23 . HN 1 1
131 1 2 1 1 23 VAL HA . 23 . HA 1 1
132 1 1 1 1 23 VAL H . 23 . HN 1 1
132 1 2 1 1 23 VAL HB . 23 . HB 1 1
133 1 1 1 1 23 VAL H . 23 . HN 1 1
133 1 2 1 1 23 VAL QG . 23 . HG* 1 1
134 1 1 1 1 23 VAL H . 23 . HN 1 1
134 1 2 1 1 24 GLN H . 24 . HN 1 1
135 1 1 1 1 23 VAL H . 23 . HN 1 1
135 1 2 1 1 24 GLN QB . 24 . HB# 1 1
136 1 1 1 1 23 VAL HA . 23 . HA 1 1
136 1 2 1 1 23 VAL HB . 23 . HB 1 1
137 1 1 1 1 23 VAL HA . 23 . HA 1 1
137 1 2 1 1 23 VAL QG . 23 . HG* 1 1
138 1 1 1 1 23 VAL HA . 23 . HA 1 1
138 1 2 1 1 24 GLN H . 24 . HN 1 1
139 1 1 1 1 23 VAL HB . 23 . HB 1 1
139 1 2 1 1 24 GLN H . 24 . HN 1 1
140 1 1 1 1 23 VAL MG1 . 23 . HG1# 1 1
140 1 2 1 1 23 VAL MG2 . 23 . HG2# 1 1
141 1 1 1 1 23 VAL QG . 23 . HG* 1 1
141 1 2 1 1 24 GLN H . 24 . HN 1 1
142 1 1 1 1 23 VAL QG . 23 . HG* 1 1
142 1 2 1 1 26 LEU QB . 26 . HB# 1 1
143 1 1 1 1 23 VAL QG . 23 . HG* 1 1
143 1 2 1 1 26 LEU QD . 26 . HD* 1 1
144 1 1 1 1 23 VAL QG . 23 . HG* 1 1
144 1 2 1 1 27 MET H . 27 . HN 1 1
145 1 1 1 1 23 VAL QG . 23 . HG* 1 1
145 1 2 1 1 27 MET QB . 27 . HB# 1 1
146 1 1 1 1 23 VAL QG . 23 . HG* 1 1
146 1 2 1 1 27 MET QG . 27 . HG# 1 1
147 1 1 1 1 24 GLN H . 24 . HN 1 1
147 1 2 1 1 24 GLN HA . 24 . HA 1 1
148 1 1 1 1 24 GLN H . 24 . HN 1 1
148 1 2 1 1 24 GLN QB . 24 . HB# 1 1
149 1 1 1 1 24 GLN H . 24 . HN 1 1
149 1 2 1 1 24 GLN QG . 24 . HG# 1 1
150 1 1 1 1 24 GLN H . 24 . HN 1 1
150 1 2 1 1 25 TRP HA . 25 . HA 1 1
151 1 1 1 1 24 GLN H . 24 . HN 1 1
151 1 2 1 1 25 TRP QB . 25 . HB# 1 1
152 1 1 1 1 24 GLN HA . 24 . HA 1 1
152 1 2 1 1 24 GLN QB . 24 . HB# 1 1
153 1 1 1 1 24 GLN HA . 24 . HA 1 1
153 1 2 1 1 24 GLN QG . 24 . HG# 1 1
154 1 1 1 1 24 GLN HA . 24 . HA 1 1
154 1 2 1 1 25 TRP H . 25 . HN 1 1
155 1 1 1 1 24 GLN HA . 24 . HA 1 1
155 1 2 1 1 27 MET H . 27 . HN 1 1
156 1 1 1 1 24 GLN QB . 24 . HB# 1 1
156 1 2 1 1 25 TRP H . 25 . HN 1 1
157 1 1 1 1 24 GLN QE . 24 . HE# 1 1
157 1 2 1 1 26 LEU QB . 26 . HB# 1 1
158 1 1 1 1 25 TRP H . 25 . HN 1 1
158 1 2 1 1 25 TRP HA . 25 . HA 1 1
159 1 1 1 1 25 TRP H . 25 . HN 1 1
159 1 2 1 1 25 TRP QB . 25 . HB# 1 1
160 1 1 1 1 25 TRP H . 25 . HN 1 1
160 1 2 1 1 25 TRP HE3 . 25 . HE3 1 1
161 1 1 1 1 25 TRP H . 25 . HN 1 1
161 1 2 1 1 25 TRP HZ3 . 25 . HZ3 1 1
162 1 1 1 1 25 TRP H . 25 . HN 1 1
162 1 2 1 1 26 LEU H . 26 . HN 1 1
163 1 1 1 1 25 TRP HA . 25 . HA 1 1
163 1 2 1 1 25 TRP QB . 25 . HB# 1 1
164 1 1 1 1 25 TRP HA . 25 . HA 1 1
164 1 2 1 1 25 TRP HD1 . 25 . HD1 1 1
165 1 1 1 1 25 TRP HA . 25 . HA 1 1
165 1 2 1 1 25 TRP HE3 . 25 . HE3 1 1
166 1 1 1 1 25 TRP HA . 25 . HA 1 1
166 1 2 1 1 26 LEU H . 26 . HN 1 1
167 1 1 1 1 25 TRP HA . 25 . HA 1 1
167 1 2 1 1 28 ASN QB . 28 . HB# 1 1
168 1 1 1 1 25 TRP HA . 25 . HA 1 1
168 1 2 1 1 29 THR MG . 29 . HG2# 1 1
169 1 1 1 1 25 TRP QB . 25 . HB# 1 1
169 1 2 1 1 25 TRP HD1 . 25 . HD1 1 1
170 1 1 1 1 25 TRP QB . 25 . HB# 1 1
170 1 2 1 1 25 TRP HE3 . 25 . HE3 1 1
171 1 1 1 1 25 TRP QB . 25 . HB# 1 1
171 1 2 1 1 25 TRP HZ3 . 25 . HZ3 1 1
172 1 1 1 1 25 TRP QB . 25 . HB# 1 1
172 1 2 1 1 26 LEU H . 26 . HN 1 1
173 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
173 1 2 1 1 26 LEU H . 26 . HN 1 1
174 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
174 1 2 1 1 26 LEU HA . 26 . HA 1 1
175 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
175 1 2 1 1 26 LEU QB . 26 . HB# 1 1
176 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
176 1 2 1 1 26 LEU QD . 26 . HD* 1 1
177 1 1 1 1 25 TRP HH2 . 25 . HH2 1 1
177 1 2 1 1 25 TRP HZ3 . 25 . HZ3 1 1
178 1 1 1 1 25 TRP HZ2 . 25 . HZ2 1 1
178 1 2 1 1 26 LEU QD . 26 . HD* 1 1
179 1 1 1 1 25 TRP HZ3 . 25 . HZ3 1 1
179 1 2 1 1 26 LEU H . 26 . HN 1 1
180 1 1 1 1 25 TRP HZ3 . 25 . HZ3 1 1
180 1 2 1 1 26 LEU HA . 26 . HA 1 1
181 1 1 1 1 25 TRP HZ3 . 25 . HZ3 1 1
181 1 2 1 1 26 LEU QB . 26 . HB# 1 1
182 1 1 1 1 25 TRP HZ3 . 25 . HZ3 1 1
182 1 2 1 1 26 LEU QD . 26 . HD* 1 1
183 1 1 1 1 26 LEU H . 26 . HN 1 1
183 1 2 1 1 26 LEU HA . 26 . HA 1 1
184 1 1 1 1 26 LEU H . 26 . HN 1 1
184 1 2 1 1 26 LEU QB . 26 . HB# 1 1
185 1 1 1 1 26 LEU H . 26 . HN 1 1
185 1 2 1 1 26 LEU QD . 26 . HD* 1 1
186 1 1 1 1 26 LEU H . 26 . HN 1 1
186 1 2 1 1 27 MET H . 27 . HN 1 1
187 1 1 1 1 26 LEU HA . 26 . HA 1 1
187 1 2 1 1 26 LEU QB . 26 . HB# 1 1
188 1 1 1 1 26 LEU HA . 26 . HA 1 1
188 1 2 1 1 26 LEU QD . 26 . HD* 1 1
189 1 1 1 1 26 LEU HA . 26 . HA 1 1
189 1 2 1 1 27 MET H . 27 . HN 1 1
190 1 1 1 1 26 LEU HA . 26 . HA 1 1
190 1 2 1 1 29 THR MG . 29 . HG2# 1 1
191 1 1 1 1 26 LEU QB . 26 . HB# 1 1
191 1 2 1 1 26 LEU QD . 26 . HD* 1 1
192 1 1 1 1 26 LEU QB . 26 . HB# 1 1
192 1 2 1 1 27 MET H . 27 . HN 1 1
193 1 1 1 1 26 LEU QD . 26 . HD* 1 1
193 1 2 1 1 27 MET QB . 27 . HB# 1 1
194 1 1 1 1 27 MET H . 27 . HN 1 1
194 1 2 1 1 27 MET HA . 27 . HA 1 1
195 1 1 1 1 27 MET H . 27 . HN 1 1
195 1 2 1 1 27 MET QB . 27 . HB# 1 1
196 1 1 1 1 27 MET H . 27 . HN 1 1
196 1 2 1 1 27 MET QG . 27 . HG# 1 1
197 1 1 1 1 27 MET H . 27 . HN 1 1
197 1 2 1 1 28 ASN H . 28 . HN 1 1
198 1 1 1 1 27 MET HA . 27 . HA 1 1
198 1 2 1 1 27 MET QB . 27 . HB# 1 1
199 1 1 1 1 27 MET HA . 27 . HA 1 1
199 1 2 1 1 27 MET QG . 27 . HG# 1 1
200 1 1 1 1 27 MET HA . 27 . HA 1 1
200 1 2 1 1 28 ASN H . 28 . HN 1 1
201 1 1 1 1 27 MET QB . 27 . HB# 1 1
201 1 2 1 1 28 ASN H . 28 . HN 1 1
202 1 1 1 1 27 MET QG . 27 . HG# 1 1
202 1 2 1 1 28 ASN H . 28 . HN 1 1
203 1 1 1 1 28 ASN H . 28 . HN 1 1
203 1 2 1 1 28 ASN HA . 28 . HA 1 1
204 1 1 1 1 28 ASN H . 28 . HN 1 1
204 1 2 1 1 28 ASN QB . 28 . HB# 1 1
205 1 1 1 1 28 ASN HA . 28 . HA 1 1
205 1 2 1 1 28 ASN QB . 28 . HB# 1 1
206 1 1 1 1 28 ASN QB . 28 . HB# 1 1
206 1 2 1 1 29 THR MG . 29 . HG2# 1 1
207 1 1 1 1 29 THR HA . 29 . HA 1 1
207 1 2 1 1 29 THR HB . 29 . HB 1 1
208 1 1 1 1 29 THR HA . 29 . HA 1 1
208 1 2 1 1 29 THR MG . 29 . HG2# 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 . . . . . 2.5 1.8 3.0 1 1
2 1 . . . . . 3.0 1.8 4.0 1 1
3 1 . . . . . 3.0 1.8 4.0 1 1
4 1 . . . . . 3.0 1.8 4.0 1 1
5 1 . . . . . 4.0 1.8 5.0 1 1
6 1 . . . . . 2.5 1.8 3.0 1 1
7 1 . . . . . 3.0 1.8 4.0 1 1
8 1 . . . . . 2.5 1.8 3.0 1 1
9 1 . . . . . 4.0 1.8 5.0 1 1
10 1 . . . . . 2.5 1.8 3.0 1 1
11 1 . . . . . 2.5 1.8 3.6 1 1
12 1 . . . . . 3.0 1.8 4.0 1 1
13 1 . . . . . 2.5 1.8 3.0 1 1
14 1 . . . . . 4.0 1.8 5.0 1 1
15 1 . . . . . 4.0 1.8 5.0 1 1
16 1 . . . . . 4.0 1.8 5.0 1 1
17 1 . . . . . 4.0 1.8 5.0 1 1
18 1 . . . . . 4.0 1.8 5.0 1 1
19 1 . . . . . 2.5 1.8 3.0 1 1
20 1 . . . . . 2.5 1.8 3.0 1 1
21 1 . . . . . 2.5 1.8 3.0 1 1
22 1 . . . . . 4.0 1.8 5.0 1 1
23 1 . . . . . 2.5 1.8 3.0 1 1
24 1 . . . . . 2.5 1.8 3.0 1 1
25 1 . . . . . 4.0 1.8 5.0 1 1
26 1 . . . . . 4.0 1.8 5.0 1 1
27 1 . . . . . 2.5 1.8 3.0 1 1
28 1 . . . . . 2.5 1.8 3.0 1 1
29 1 . . . . . 2.5 1.8 3.0 1 1
30 1 . . . . . 4.0 1.8 5.0 1 1
31 1 . . . . . 3.0 1.8 4.0 1 1
32 1 . . . . . 2.5 1.8 3.0 1 1
33 1 . . . . . 3.0 1.8 4.0 1 1
34 1 . . . . . 4.0 1.8 5.0 1 1
35 1 . . . . . 3.0 1.8 6.0 1 1
36 1 . . . . . 4.0 1.8 5.0 1 1
37 1 . . . . . 2.5 1.8 3.0 1 1
38 1 . . . . . 4.0 1.8 5.0 1 1
39 1 . . . . . 2.5 1.8 3.0 1 1
40 1 . . . . . 2.5 1.8 3.0 1 1
41 1 . . . . . 3.0 1.8 4.0 1 1
42 1 . . . . . 2.5 1.8 3.0 1 1
43 1 . . . . . 3.0 1.8 4.0 1 1
44 1 . . . . . 3.0 1.8 4.0 1 1
45 1 . . . . . 3.0 1.8 4.0 1 1
46 1 . . . . . 3.0 1.8 4.0 1 1
47 1 . . . . . 2.5 1.8 3.0 1 1
48 1 . . . . . 2.5 1.8 4.0 1 1
49 1 . . . . . 3.0 1.8 5.0 1 1
50 1 . . . . . 2.5 1.8 3.0 1 1
51 1 . . . . . 4.0 1.8 5.0 1 1
52 1 . . . . . 2.5 1.8 3.0 1 1
53 1 . . . . . 2.5 1.8 3.0 1 1
54 1 . . . . . 3.0 1.8 4.0 1 1
55 1 . . . . . 4.0 1.8 4.0 1 1
56 1 . . . . . 2.5 1.8 3.0 1 1
57 1 . . . . . 2.5 1.8 3.0 1 1
58 1 . . . . . 3.0 1.8 4.0 1 1
59 1 . . . . . 4.0 1.8 5.0 1 1
60 1 . . . . . 3.0 1.8 4.0 1 1
61 1 . . . . . 4.0 1.8 5.0 1 1
62 1 . . . . . 3.0 1.8 4.7 1 1
63 1 . . . . . 2.5 1.8 3.0 1 1
64 1 . . . . . 4.0 1.8 6.0 1 1
65 1 . . . . . 3.0 1.8 4.0 1 1
66 1 . . . . . 4.0 1.8 5.0 1 1
67 1 . . . . . 2.5 1.8 3.0 1 1
68 1 . . . . . 4.0 1.8 5.0 1 1
69 1 . . . . . 3.0 1.8 4.0 1 1
70 1 . . . . . 2.5 1.8 3.0 1 1
71 1 . . . . . 4.0 1.8 5.0 1 1
72 1 . . . . . 3.0 1.8 5.0 1 1
73 1 . . . . . 2.5 1.8 3.0 1 1
74 1 . . . . . 2.5 1.8 3.0 1 1
75 1 . . . . . 4.0 1.8 5.0 1 1
76 1 . . . . . 3.0 1.8 4.0 1 1
77 1 . . . . . 4.0 1.8 5.0 1 1
78 1 . . . . . 2.5 1.8 3.0 1 1
79 1 . . . . . 4.0 1.8 5.0 1 1
80 1 . . . . . 2.5 1.8 3.0 1 1
81 1 . . . . . 3.0 1.8 4.0 1 1
82 1 . . . . . 2.5 1.8 3.0 1 1
83 1 . . . . . 4.0 1.8 5.0 1 1
84 1 . . . . . 3.0 1.8 4.0 1 1
85 1 . . . . . 3.0 1.8 4.0 1 1
86 1 . . . . . 4.0 1.8 5.0 1 1
87 1 . . . . . 4.0 1.8 5.0 1 1
88 1 . . . . . 2.5 1.8 3.0 1 1
89 1 . . . . . 4.0 1.8 4.0 1 1
90 1 . . . . . 4.0 1.8 5.0 1 1
91 1 . . . . . 3.0 1.8 4.0 1 1
92 1 . . . . . 4.0 1.8 5.0 1 1
93 1 . . . . . 3.0 1.8 4.0 1 1
94 1 . . . . . 2.5 1.8 3.0 1 1
95 1 . . . . . 2.5 1.8 3.0 1 1
96 1 . . . . . 3.0 1.8 4.0 1 1
97 1 . . . . . 4.0 1.8 5.0 1 1
98 1 . . . . . 4.0 1.8 5.0 1 1
99 1 . . . . . 3.0 1.8 4.0 1 1
100 1 . . . . . 4.0 1.8 4.0 1 1
101 1 . . . . . 4.0 1.8 5.0 1 1
102 1 . . . . . 3.0 1.8 4.0 1 1
103 1 . . . . . 2.5 1.8 3.0 1 1
104 1 . . . . . 3.0 1.8 5.0 1 1
105 1 . . . . . 4.0 1.8 6.0 1 1
106 1 . . . . . 2.5 1.8 3.0 1 1
107 1 . . . . . 2.5 1.8 3.0 1 1
108 1 . . . . . 2.5 1.8 3.0 1 1
109 1 . . . . . 3.0 1.8 4.0 1 1
110 1 . . . . . 4.0 1.8 5.0 1 1
111 1 . . . . . 3.0 1.8 4.0 1 1
112 1 . . . . . 3.0 1.8 4.0 1 1
113 1 . . . . . 3.0 1.8 4.0 1 1
114 1 . . . . . 4.0 1.8 5.0 1 1
115 1 . . . . . 4.0 1.8 5.0 1 1
116 1 . . . . . 2.5 1.8 3.0 1 1
117 1 . . . . . 3.0 1.8 4.0 1 1
118 1 . . . . . 2.5 1.8 3.0 1 1
119 1 . . . . . 3.0 1.8 4.0 1 1
120 1 . . . . . 4.0 1.8 5.0 1 1
121 1 . . . . . 2.5 1.8 3.0 1 1
122 1 . . . . . 3.0 1.8 4.0 1 1
123 1 . . . . . 4.0 1.8 5.0 1 1
124 1 . . . . . 2.5 1.8 3.0 1 1
125 1 . . . . . 3.0 1.8 4.0 1 1
126 1 . . . . . 4.0 1.8 5.0 1 1
127 1 . . . . . 4.0 1.8 5.0 1 1
128 1 . . . . . 2.5 1.8 3.0 1 1
129 1 . . . . . 4.0 1.8 5.0 1 1
130 1 . . . . . 2.5 1.8 3.0 1 1
131 1 . . . . . 2.5 1.8 3.0 1 1
132 1 . . . . . 2.5 1.8 3.0 1 1
133 1 . . . . . 2.5 1.8 3.0 1 1
134 1 . . . . . 2.5 1.8 3.0 1 1
135 1 . . . . . 4.0 1.8 5.0 1 1
136 1 . . . . . 2.5 1.8 3.0 1 1
137 1 . . . . . 2.5 1.8 3.0 1 1
138 1 . . . . . 4.0 1.8 5.0 1 1
139 1 . . . . . 4.0 1.8 5.0 1 1
140 1 . . . . . 2.5 1.8 3.0 1 1
141 1 . . . . . 3.0 1.8 4.0 1 1
142 1 . . . . . 2.5 1.8 3.0 1 1
143 1 . . . . . 3.0 1.8 4.0 1 1
144 1 . . . . . 4.0 1.8 5.0 1 1
145 1 . . . . . 3.0 1.8 3.0 1 1
146 1 . . . . . 2.5 1.8 3.0 1 1
147 1 . . . . . 2.5 1.8 3.0 1 1
148 1 . . . . . 2.5 1.8 3.0 1 1
149 1 . . . . . 3.0 1.8 4.0 1 1
150 1 . . . . . 4.0 1.8 5.0 1 1
151 1 . . . . . 4.0 1.8 5.0 1 1
152 1 . . . . . 2.5 1.8 3.0 1 1
153 1 . . . . . 3.0 1.8 4.0 1 1
154 1 . . . . . 4.0 1.8 5.0 1 1
155 1 . . . . . 3.0 1.8 4.0 1 1
156 1 . . . . . 3.0 1.8 4.0 1 1
157 1 . . . . . 4.0 1.8 5.0 1 1
158 1 . . . . . 2.5 1.8 3.0 1 1
159 1 . . . . . 2.5 1.8 3.0 1 1
160 1 . . . . . 4.0 1.8 5.0 1 1
161 1 . . . . . 4.0 1.8 5.0 1 1
162 1 . . . . . 2.5 1.8 3.0 1 1
163 1 . . . . . 2.5 1.8 3.0 1 1
164 1 . . . . . 2.5 1.8 3.0 1 1
165 1 . . . . . 2.5 1.8 5.3 1 1
166 1 . . . . . 3.0 1.8 4.0 1 1
167 1 . . . . . 3.0 1.8 4.0 1 1
168 1 . . . . . 4.0 1.8 5.0 1 1
169 1 . . . . . 2.5 1.8 3.0 1 1
170 1 . . . . . 2.5 1.8 4.0 1 1
171 1 . . . . . 3.0 1.8 5.0 1 1
172 1 . . . . . 3.0 1.8 4.0 1 1
173 1 . . . . . 3.0 1.8 4.0 1 1
174 1 . . . . . 2.5 1.8 3.0 1 1
175 1 . . . . . 3.0 1.8 4.0 1 1
176 1 . . . . . 3.0 1.8 4.0 1 1
177 1 . . . . . 2.5 1.8 3.0 1 1
178 1 . . . . . 2.5 1.8 3.0 1 1
179 1 . . . . . 4.0 1.8 5.0 1 1
180 1 . . . . . 4.0 1.8 5.0 1 1
181 1 . . . . . 4.0 1.8 5.0 1 1
182 1 . . . . . 2.5 1.8 3.0 1 1
183 1 . . . . . 2.5 1.8 3.0 1 1
184 1 . . . . . 2.5 1.8 3.0 1 1
185 1 . . . . . 3.0 1.8 4.0 1 1
186 1 . . . . . 2.5 1.8 3.0 1 1
187 1 . . . . . 2.5 1.8 3.0 1 1
188 1 . . . . . 2.5 1.8 3.0 1 1
189 1 . . . . . 3.0 1.8 4.0 1 1
190 1 . . . . . 4.0 1.8 5.0 1 1
191 1 . . . . . 2.5 1.8 3.0 1 1
192 1 . . . . . 3.0 1.8 4.0 1 1
193 1 . . . . . 3.0 1.8 4.0 1 1
194 1 . . . . . 2.5 1.8 3.0 1 1
195 1 . . . . . 2.5 1.8 3.0 1 1
196 1 . . . . . 2.5 1.8 3.0 1 1
197 1 . . . . . 4.0 1.8 5.0 1 1
198 1 . . . . . 2.5 1.8 3.0 1 1
199 1 . . . . . 2.5 1.8 4.0 1 1
200 1 . . . . . 4.0 1.8 5.0 1 1
201 1 . . . . . 4.0 1.8 5.0 1 1
202 1 . . . . . 2.5 1.8 3.0 1 1
203 1 . . . . . 3.0 1.8 4.0 1 1
204 1 . . . . . 3.0 1.8 4.0 1 1
205 1 . . . . . 2.5 1.8 3.0 1 1
206 1 . . . . . 3.0 1.8 4.0 1 1
207 1 . . . . . 2.5 1.8 3.0 1 1
208 1 . . . . . 2.5 1.8 3.0 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 HIS C C 42.300 9.186 -9.457 1.00 . A X . 1 HIS C 1 1
1 2 1 1 1 HIS CA C 42.856 8.232 -10.509 1.00 . A X . 1 HIS CA 1 1
1 3 1 1 1 HIS CB C 41.856 8.081 -11.657 1.00 . A X . 1 HIS CB 1 1
1 4 1 1 1 HIS CD2 C 43.389 6.800 -13.366 1.00 . A X . 1 HIS CD2 1 1
1 5 1 1 1 HIS CE1 C 43.343 8.249 -14.977 1.00 . A X . 1 HIS CE1 1 1
1 6 1 1 1 HIS CG C 42.601 7.842 -12.942 1.00 . A X . 1 HIS CG 1 1
1 7 1 1 1 HIS H1 H 43.055 6.162 -10.619 1.00 . A X . 1 HIS H1 1 1
1 8 1 1 1 HIS H2 H 42.376 6.717 -9.164 1.00 . A X . 1 HIS H2 1 1
1 9 1 1 1 HIS H3 H 44.043 6.890 -9.448 1.00 . A X . 1 HIS H3 1 1
1 10 1 1 1 HIS HA H 43.786 8.625 -10.892 1.00 . A X . 1 HIS HA 1 1
1 11 1 1 1 HIS HB2 H 41.203 7.241 -11.458 1.00 . A X . 1 HIS HB2 1 1
1 12 1 1 1 HIS HB3 H 41.268 8.985 -11.746 1.00 . A X . 1 HIS HB3 1 1
1 13 1 1 1 HIS HD2 H 43.611 5.914 -12.790 1.00 . A X . 1 HIS HD2 1 1
1 14 1 1 1 HIS HE1 H 43.514 8.745 -15.921 1.00 . A X . 1 HIS HE1 1 1
1 15 1 1 1 HIS HE2 H 44.436 6.490 -15.200 1.00 . A X . 1 HIS HE2 1 1
1 16 1 1 1 HIS N N 43.101 6.900 -9.887 1.00 . A X . 1 HIS N 1 1
1 17 1 1 1 HIS ND1 N 42.587 8.754 -13.985 1.00 . A X . 1 HIS ND1 1 1
1 18 1 1 1 HIS NE2 N 43.855 7.059 -14.651 1.00 . A X . 1 HIS NE2 1 1
1 19 1 1 1 HIS O O 41.631 8.763 -8.514 1.00 . A X . 1 HIS O 1 1
1 20 1 1 2 ABA C C 42.236 10.976 -7.252 1.00 . A X . 2 AIB C 1 1
1 21 1 1 2 ABA CA C 42.105 11.482 -8.686 1.00 . A X . 2 AIB CA 1 1
1 22 1 1 2 ABA H H 43.119 10.751 -10.397 1.00 . A X . 2 AIB H 1 1
1 23 1 1 2 ABA N N 42.582 10.474 -9.626 1.00 . A X . 2 AIB N 1 1
1 24 1 1 2 ABA O O 41.296 11.069 -6.463 1.00 . A X . 2 AIB O 1 1
1 25 1 1 3 GLN C C 43.327 10.993 -4.533 1.00 . A X . 3 GLN C 1 1
1 26 1 1 3 GLN CA C 43.646 9.928 -5.579 1.00 . A X . 3 GLN CA 1 1
1 27 1 1 3 GLN CB C 45.107 9.493 -5.439 1.00 . A X . 3 GLN CB 1 1
1 28 1 1 3 GLN CD C 46.560 8.726 -3.551 1.00 . A X . 3 GLN CD 1 1
1 29 1 1 3 GLN CG C 45.237 8.505 -4.279 1.00 . A X . 3 GLN CG 1 1
1 30 1 1 3 GLN H H 44.121 10.397 -7.590 1.00 . A X . 3 GLN H 1 1
1 31 1 1 3 GLN HA H 43.010 9.072 -5.413 1.00 . A X . 3 GLN HA 1 1
1 32 1 1 3 GLN HB2 H 45.432 9.022 -6.355 1.00 . A X . 3 GLN HB2 1 1
1 33 1 1 3 GLN HB3 H 45.723 10.359 -5.242 1.00 . A X . 3 GLN HB3 1 1
1 34 1 1 3 GLN HE21 H 45.699 9.232 -1.835 1.00 . A X . 3 GLN HE21 1 1
1 35 1 1 3 GLN HE22 H 47.397 9.242 -1.826 1.00 . A X . 3 GLN HE22 1 1
1 36 1 1 3 GLN HG2 H 44.419 8.653 -3.587 1.00 . A X . 3 GLN HG2 1 1
1 37 1 1 3 GLN HG3 H 45.208 7.494 -4.664 1.00 . A X . 3 GLN HG3 1 1
1 38 1 1 3 GLN N N 43.407 10.443 -6.921 1.00 . A X . 3 GLN N 1 1
1 39 1 1 3 GLN NE2 N 46.551 9.097 -2.301 1.00 . A X . 3 GLN NE2 1 1
1 40 1 1 3 GLN O O 43.288 10.707 -3.336 1.00 . A X . 3 GLN O 1 1
1 41 1 1 3 GLN OE1 O 47.628 8.554 -4.138 1.00 . A X . 3 GLN OE1 1 1
1 42 1 1 4 GLY C C 41.340 13.778 -4.275 1.00 . A X . 4 GLY C 1 1
1 43 1 1 4 GLY CA C 42.785 13.325 -4.098 1.00 . A X . 4 GLY CA 1 1
1 44 1 1 4 GLY H H 43.148 12.384 -5.963 1.00 . A X . 4 GLY H 1 1
1 45 1 1 4 GLY HA2 H 42.937 13.008 -3.075 1.00 . A X . 4 GLY HA2 1 1
1 46 1 1 4 GLY HA3 H 43.443 14.154 -4.314 1.00 . A X . 4 GLY HA3 1 1
1 47 1 1 4 GLY N N 43.102 12.219 -4.997 1.00 . A X . 4 GLY N 1 1
1 48 1 1 4 GLY O O 40.822 14.555 -3.473 1.00 . A X . 4 GLY O 1 1
1 49 1 1 5 THR C C 38.496 12.419 -5.986 1.00 . A X . 5 THR C 1 1
1 50 1 1 5 THR CA C 39.308 13.649 -5.602 1.00 . A X . 5 THR CA 1 1
1 51 1 1 5 THR CB C 39.247 14.677 -6.734 1.00 . A X . 5 THR CB 1 1
1 52 1 1 5 THR CG2 C 40.661 15.141 -7.079 1.00 . A X . 5 THR CG2 1 1
1 53 1 1 5 THR H H 41.160 12.673 -5.935 1.00 . A X . 5 THR H 1 1
1 54 1 1 5 THR HA H 38.880 14.086 -4.714 1.00 . A X . 5 THR HA 1 1
1 55 1 1 5 THR HB H 38.661 15.527 -6.420 1.00 . A X . 5 THR HB 1 1
1 56 1 1 5 THR HG1 H 38.554 14.762 -8.549 1.00 . A X . 5 THR HG1 1 1
1 57 1 1 5 THR HG21 H 40.614 15.907 -7.841 1.00 . A X . 5 THR HG21 1 1
1 58 1 1 5 THR HG22 H 41.234 14.303 -7.449 1.00 . A X . 5 THR HG22 1 1
1 59 1 1 5 THR HG23 H 41.136 15.541 -6.196 1.00 . A X . 5 THR HG23 1 1
1 60 1 1 5 THR N N 40.695 13.288 -5.330 1.00 . A X . 5 THR N 1 1
1 61 1 1 5 THR O O 37.420 12.532 -6.573 1.00 . A X . 5 THR O 1 1
1 62 1 1 5 THR OG1 O 38.648 14.083 -7.879 1.00 . A X . 5 THR OG1 1 1
1 63 1 1 6 PHE C C 37.700 9.402 -4.710 1.00 . A X . 6 PHE C 1 1
1 64 1 1 6 PHE CA C 38.333 9.995 -5.965 1.00 . A X . 6 PHE CA 1 1
1 65 1 1 6 PHE CB C 39.320 8.991 -6.563 1.00 . A X . 6 PHE CB 1 1
1 66 1 1 6 PHE CD1 C 37.834 7.184 -7.499 1.00 . A X . 6 PHE CD1 1 1
1 67 1 1 6 PHE CD2 C 39.068 6.739 -5.461 1.00 . A X . 6 PHE CD2 1 1
1 68 1 1 6 PHE CE1 C 37.283 5.897 -7.446 1.00 . A X . 6 PHE CE1 1 1
1 69 1 1 6 PHE CE2 C 38.519 5.453 -5.407 1.00 . A X . 6 PHE CE2 1 1
1 70 1 1 6 PHE CG C 38.726 7.605 -6.506 1.00 . A X . 6 PHE CG 1 1
1 71 1 1 6 PHE CZ C 37.626 5.032 -6.401 1.00 . A X . 6 PHE CZ 1 1
1 72 1 1 6 PHE H H 39.880 11.214 -5.183 1.00 . A X . 6 PHE H 1 1
1 73 1 1 6 PHE HA H 37.558 10.194 -6.689 1.00 . A X . 6 PHE HA 1 1
1 74 1 1 6 PHE HB2 H 39.520 9.255 -7.591 1.00 . A X . 6 PHE HB2 1 1
1 75 1 1 6 PHE HB3 H 40.240 9.011 -6.000 1.00 . A X . 6 PHE HB3 1 1
1 76 1 1 6 PHE HD1 H 37.569 7.852 -8.306 1.00 . A X . 6 PHE HD1 1 1
1 77 1 1 6 PHE HD2 H 39.757 7.063 -4.695 1.00 . A X . 6 PHE HD2 1 1
1 78 1 1 6 PHE HE1 H 36.594 5.574 -8.213 1.00 . A X . 6 PHE HE1 1 1
1 79 1 1 6 PHE HE2 H 38.782 4.785 -4.601 1.00 . A X . 6 PHE HE2 1 1
1 80 1 1 6 PHE HZ H 37.202 4.039 -6.360 1.00 . A X . 6 PHE HZ 1 1
1 81 1 1 6 PHE N N 39.018 11.243 -5.650 1.00 . A X . 6 PHE N 1 1
1 82 1 1 6 PHE O O 36.880 8.487 -4.791 1.00 . A X . 6 PHE O 1 1
1 83 1 1 7 THR C C 36.511 10.419 -1.736 1.00 . A X . 7 THR C 1 1
1 84 1 1 7 THR CA C 37.550 9.446 -2.286 1.00 . A X . 7 THR CA 1 1
1 85 1 1 7 THR CB C 38.682 9.279 -1.269 1.00 . A X . 7 THR CB 1 1
1 86 1 1 7 THR CG2 C 39.838 8.515 -1.914 1.00 . A X . 7 THR CG2 1 1
1 87 1 1 7 THR H H 38.742 10.656 -3.551 1.00 . A X . 7 THR H 1 1
1 88 1 1 7 THR HA H 37.081 8.487 -2.446 1.00 . A X . 7 THR HA 1 1
1 89 1 1 7 THR HB H 38.321 8.725 -0.416 1.00 . A X . 7 THR HB 1 1
1 90 1 1 7 THR HG1 H 39.935 10.764 -1.333 1.00 . A X . 7 THR HG1 1 1
1 91 1 1 7 THR HG21 H 40.331 9.149 -2.636 1.00 . A X . 7 THR HG21 1 1
1 92 1 1 7 THR HG22 H 39.458 7.633 -2.408 1.00 . A X . 7 THR HG22 1 1
1 93 1 1 7 THR HG23 H 40.545 8.222 -1.151 1.00 . A X . 7 THR HG23 1 1
1 94 1 1 7 THR N N 38.085 9.930 -3.554 1.00 . A X . 7 THR N 1 1
1 95 1 1 7 THR O O 35.316 10.123 -1.720 1.00 . A X . 7 THR O 1 1
1 96 1 1 7 THR OG1 O 39.132 10.560 -0.849 1.00 . A X . 7 THR OG1 1 1
1 97 1 1 8 SER C C 34.909 12.840 -1.691 1.00 . A X . 8 SER C 1 1
1 98 1 1 8 SER CA C 36.078 12.593 -0.742 1.00 . A X . 8 SER CA 1 1
1 99 1 1 8 SER CB C 36.839 13.899 -0.515 1.00 . A X . 8 SER CB 1 1
1 100 1 1 8 SER H H 37.938 11.763 -1.328 1.00 . A X . 8 SER H 1 1
1 101 1 1 8 SER HA H 35.693 12.243 0.204 1.00 . A X . 8 SER HA 1 1
1 102 1 1 8 SER HB2 H 36.511 14.638 -1.227 1.00 . A X . 8 SER HB2 1 1
1 103 1 1 8 SER HB3 H 36.643 14.256 0.488 1.00 . A X . 8 SER HB3 1 1
1 104 1 1 8 SER HG H 38.425 13.715 -1.626 1.00 . A X . 8 SER HG 1 1
1 105 1 1 8 SER N N 36.975 11.582 -1.289 1.00 . A X . 8 SER N 1 1
1 106 1 1 8 SER O O 33.746 12.700 -1.309 1.00 . A X . 8 SER O 1 1
1 107 1 1 8 SER OG O 38.230 13.667 -0.687 1.00 . A X . 8 SER OG 1 1
1 108 1 1 9 ASP C C 33.553 12.172 -4.391 1.00 . A X . 9 ASP C 1 1
1 109 1 1 9 ASP CA C 34.192 13.475 -3.922 1.00 . A X . 9 ASP CA 1 1
1 110 1 1 9 ASP CB C 34.797 14.210 -5.120 1.00 . A X . 9 ASP CB 1 1
1 111 1 1 9 ASP CG C 35.295 15.586 -4.689 1.00 . A X . 9 ASP CG 1 1
1 112 1 1 9 ASP H H 36.168 13.307 -3.175 1.00 . A X . 9 ASP H 1 1
1 113 1 1 9 ASP HA H 33.431 14.100 -3.479 1.00 . A X . 9 ASP HA 1 1
1 114 1 1 9 ASP HB2 H 35.625 13.635 -5.511 1.00 . A X . 9 ASP HB2 1 1
1 115 1 1 9 ASP HB3 H 34.044 14.327 -5.887 1.00 . A X . 9 ASP HB3 1 1
1 116 1 1 9 ASP N N 35.225 13.210 -2.927 1.00 . A X . 9 ASP N 1 1
1 117 1 1 9 ASP O O 33.230 12.017 -5.570 1.00 . A X . 9 ASP O 1 1
1 118 1 1 9 ASP OD1 O 35.010 15.973 -3.568 1.00 . A X . 9 ASP OD1 1 1
1 119 1 1 9 ASP OD2 O 35.954 16.231 -5.487 1.00 . A X . 9 ASP OD2 1 1
1 120 1 1 10 TYR C C 32.005 9.398 -2.596 1.00 . A X . 10 TYR C 1 1
1 121 1 1 10 TYR CA C 32.772 9.953 -3.792 1.00 . A X . 10 TYR CA 1 1
1 122 1 1 10 TYR CB C 33.858 8.961 -4.212 1.00 . A X . 10 TYR CB 1 1
1 123 1 1 10 TYR CD1 C 32.187 7.660 -5.581 1.00 . A X . 10 TYR CD1 1 1
1 124 1 1 10 TYR CD2 C 34.317 8.238 -6.585 1.00 . A X . 10 TYR CD2 1 1
1 125 1 1 10 TYR CE1 C 31.803 7.020 -6.764 1.00 . A X . 10 TYR CE1 1 1
1 126 1 1 10 TYR CE2 C 33.933 7.596 -7.768 1.00 . A X . 10 TYR CE2 1 1
1 127 1 1 10 TYR CG C 33.445 8.270 -5.491 1.00 . A X . 10 TYR CG 1 1
1 128 1 1 10 TYR CZ C 32.676 6.987 -7.858 1.00 . A X . 10 TYR CZ 1 1
1 129 1 1 10 TYR H H 33.650 11.420 -2.539 1.00 . A X . 10 TYR H 1 1
1 130 1 1 10 TYR HA H 32.087 10.088 -4.616 1.00 . A X . 10 TYR HA 1 1
1 131 1 1 10 TYR HB2 H 34.786 9.491 -4.371 1.00 . A X . 10 TYR HB2 1 1
1 132 1 1 10 TYR HB3 H 33.993 8.225 -3.434 1.00 . A X . 10 TYR HB3 1 1
1 133 1 1 10 TYR HD1 H 31.513 7.686 -4.737 1.00 . A X . 10 TYR HD1 1 1
1 134 1 1 10 TYR HD2 H 35.288 8.707 -6.516 1.00 . A X . 10 TYR HD2 1 1
1 135 1 1 10 TYR HE1 H 30.832 6.549 -6.834 1.00 . A X . 10 TYR HE1 1 1
1 136 1 1 10 TYR HE2 H 34.607 7.572 -8.612 1.00 . A X . 10 TYR HE2 1 1
1 137 1 1 10 TYR HH H 33.084 6.229 -9.562 1.00 . A X . 10 TYR HH 1 1
1 138 1 1 10 TYR N N 33.374 11.240 -3.463 1.00 . A X . 10 TYR N 1 1
1 139 1 1 10 TYR O O 31.847 8.186 -2.458 1.00 . A X . 10 TYR O 1 1
1 140 1 1 10 TYR OH O 32.299 6.355 -9.025 1.00 . A X . 10 TYR OH 1 1
1 141 1 1 11 SER C C 29.375 10.481 -0.590 1.00 . A X . 11 SER C 1 1
1 142 1 1 11 SER CA C 30.783 9.898 -0.550 1.00 . A X . 11 SER CA 1 1
1 143 1 1 11 SER CB C 31.501 10.383 0.710 1.00 . A X . 11 SER CB 1 1
1 144 1 1 11 SER H H 31.695 11.251 -1.903 1.00 . A X . 11 SER H 1 1
1 145 1 1 11 SER HA H 30.716 8.821 -0.519 1.00 . A X . 11 SER HA 1 1
1 146 1 1 11 SER HB2 H 32.566 10.351 0.554 1.00 . A X . 11 SER HB2 1 1
1 147 1 1 11 SER HB3 H 31.201 11.400 0.925 1.00 . A X . 11 SER HB3 1 1
1 148 1 1 11 SER HG H 30.205 9.487 1.853 1.00 . A X . 11 SER HG 1 1
1 149 1 1 11 SER N N 31.535 10.298 -1.736 1.00 . A X . 11 SER N 1 1
1 150 1 1 11 SER O O 28.639 10.419 0.395 1.00 . A X . 11 SER O 1 1
1 151 1 1 11 SER OG O 31.162 9.534 1.799 1.00 . A X . 11 SER OG 1 1
1 152 1 1 12 LYS C C 27.020 11.118 -3.171 1.00 . A X . 12 LYS C 1 1
1 153 1 1 12 LYS CA C 27.687 11.644 -1.904 1.00 . A X . 12 LYS CA 1 1
1 154 1 1 12 LYS CB C 27.807 13.167 -1.984 1.00 . A X . 12 LYS CB 1 1
1 155 1 1 12 LYS CD C 26.981 14.029 0.212 1.00 . A X . 12 LYS CD 1 1
1 156 1 1 12 LYS CE C 27.331 13.952 1.700 1.00 . A X . 12 LYS CE 1 1
1 157 1 1 12 LYS CG C 28.226 13.721 -0.621 1.00 . A X . 12 LYS CG 1 1
1 158 1 1 12 LYS H H 29.641 11.066 -2.485 1.00 . A X . 12 LYS H 1 1
1 159 1 1 12 LYS HA H 27.075 11.387 -1.053 1.00 . A X . 12 LYS HA 1 1
1 160 1 1 12 LYS HB2 H 28.549 13.431 -2.724 1.00 . A X . 12 LYS HB2 1 1
1 161 1 1 12 LYS HB3 H 26.854 13.589 -2.263 1.00 . A X . 12 LYS HB3 1 1
1 162 1 1 12 LYS HD2 H 26.626 15.021 -0.023 1.00 . A X . 12 LYS HD2 1 1
1 163 1 1 12 LYS HD3 H 26.211 13.306 -0.012 1.00 . A X . 12 LYS HD3 1 1
1 164 1 1 12 LYS HE2 H 27.572 12.931 1.961 1.00 . A X . 12 LYS HE2 1 1
1 165 1 1 12 LYS HE3 H 28.180 14.589 1.904 1.00 . A X . 12 LYS HE3 1 1
1 166 1 1 12 LYS HG2 H 28.834 12.991 -0.107 1.00 . A X . 12 LYS HG2 1 1
1 167 1 1 12 LYS HG3 H 28.796 14.627 -0.760 1.00 . A X . 12 LYS HG3 1 1
1 168 1 1 12 LYS HZ1 H 25.403 14.720 1.872 1.00 . A X . 12 LYS HZ1 1 1
1 169 1 1 12 LYS HZ2 H 26.454 15.198 3.119 1.00 . A X . 12 LYS HZ2 1 1
1 170 1 1 12 LYS HZ3 H 25.819 13.621 3.095 1.00 . A X . 12 LYS HZ3 1 1
1 171 1 1 12 LYS N N 29.009 11.048 -1.737 1.00 . A X . 12 LYS N 1 1
1 172 1 1 12 LYS NZ N 26.164 14.407 2.507 1.00 . A X . 12 LYS NZ 1 1
1 173 1 1 12 LYS O O 26.235 11.822 -3.807 1.00 . A X . 12 LYS O 1 1
1 174 1 1 13 LYS C C 26.265 7.856 -4.414 1.00 . A X . 13 LYS C 1 1
1 175 1 1 13 LYS CA C 26.763 9.264 -4.723 1.00 . A X . 13 LYS CA 1 1
1 176 1 1 13 LYS CB C 27.810 9.209 -5.839 1.00 . A X . 13 LYS CB 1 1
1 177 1 1 13 LYS CD C 27.965 8.059 -8.055 1.00 . A X . 13 LYS CD 1 1
1 178 1 1 13 LYS CE C 27.584 8.248 -9.525 1.00 . A X . 13 LYS CE 1 1
1 179 1 1 13 LYS CG C 27.114 8.984 -7.184 1.00 . A X . 13 LYS CG 1 1
1 180 1 1 13 LYS H H 27.968 9.365 -2.983 1.00 . A X . 13 LYS H 1 1
1 181 1 1 13 LYS HA H 25.929 9.861 -5.058 1.00 . A X . 13 LYS HA 1 1
1 182 1 1 13 LYS HB2 H 28.356 10.142 -5.866 1.00 . A X . 13 LYS HB2 1 1
1 183 1 1 13 LYS HB3 H 28.496 8.397 -5.650 1.00 . A X . 13 LYS HB3 1 1
1 184 1 1 13 LYS HD2 H 29.011 8.297 -7.922 1.00 . A X . 13 LYS HD2 1 1
1 185 1 1 13 LYS HD3 H 27.790 7.033 -7.769 1.00 . A X . 13 LYS HD3 1 1
1 186 1 1 13 LYS HE2 H 27.725 7.318 -10.054 1.00 . A X . 13 LYS HE2 1 1
1 187 1 1 13 LYS HE3 H 26.546 8.540 -9.588 1.00 . A X . 13 LYS HE3 1 1
1 188 1 1 13 LYS HG2 H 26.147 8.534 -7.016 1.00 . A X . 13 LYS HG2 1 1
1 189 1 1 13 LYS HG3 H 26.988 9.932 -7.686 1.00 . A X . 13 LYS HG3 1 1
1 190 1 1 13 LYS HZ1 H 28.117 10.211 -10.117 1.00 . A X . 13 LYS HZ1 1 1
1 191 1 1 13 LYS N N 27.338 9.876 -3.530 1.00 . A X . 13 LYS N 1 1
1 192 1 1 13 LYS NZ N 28.418 9.280 -10.131 1.00 . A X . 13 LYS NZ 1 1
1 193 1 1 13 LYS O O 25.060 7.629 -4.292 1.00 . A X . 13 LYS O 1 1
1 194 1 1 14 LEU C C 25.767 5.504 -2.891 1.00 . A X . 14 LEU C 1 1
1 195 1 1 14 LEU CA C 26.821 5.535 -3.989 1.00 . A X . 14 LEU CA 1 1
1 196 1 1 14 LEU CB C 28.038 4.714 -3.557 1.00 . A X . 14 LEU CB 1 1
1 197 1 1 14 LEU CD1 C 29.410 6.667 -2.839 1.00 . A X . 14 LEU CD1 1 1
1 198 1 1 14 LEU CD2 C 30.521 4.580 -3.641 1.00 . A X . 14 LEU CD2 1 1
1 199 1 1 14 LEU CG C 29.317 5.503 -3.824 1.00 . A X . 14 LEU CG 1 1
1 200 1 1 14 LEU H H 28.138 7.148 -4.392 1.00 . A X . 14 LEU H 1 1
1 201 1 1 14 LEU HA H 26.412 5.095 -4.878 1.00 . A X . 14 LEU HA 1 1
1 202 1 1 14 LEU HB2 H 27.966 4.488 -2.504 1.00 . A X . 14 LEU HB2 1 1
1 203 1 1 14 LEU HB3 H 28.065 3.793 -4.121 1.00 . A X . 14 LEU HB3 1 1
1 204 1 1 14 LEU HD11 H 29.578 7.585 -3.383 1.00 . A X . 14 LEU HD11 1 1
1 205 1 1 14 LEU HD12 H 30.226 6.498 -2.155 1.00 . A X . 14 LEU HD12 1 1
1 206 1 1 14 LEU HD13 H 28.485 6.742 -2.287 1.00 . A X . 14 LEU HD13 1 1
1 207 1 1 14 LEU HD21 H 30.581 4.268 -2.608 1.00 . A X . 14 LEU HD21 1 1
1 208 1 1 14 LEU HD22 H 31.424 5.107 -3.912 1.00 . A X . 14 LEU HD22 1 1
1 209 1 1 14 LEU HD23 H 30.405 3.713 -4.272 1.00 . A X . 14 LEU HD23 1 1
1 210 1 1 14 LEU HG H 29.305 5.883 -4.836 1.00 . A X . 14 LEU HG 1 1
1 211 1 1 14 LEU N N 27.194 6.912 -4.287 1.00 . A X . 14 LEU N 1 1
1 212 1 1 14 LEU O O 24.796 4.752 -2.969 1.00 . A X . 14 LEU O 1 1
1 213 1 1 15 ASP C C 23.770 7.177 -1.210 1.00 . A X . 15 ASP C 1 1
1 214 1 1 15 ASP CA C 25.008 6.406 -0.769 1.00 . A X . 15 ASP CA 1 1
1 215 1 1 15 ASP CB C 25.648 7.098 0.437 1.00 . A X . 15 ASP CB 1 1
1 216 1 1 15 ASP CG C 24.939 6.670 1.718 1.00 . A X . 15 ASP CG 1 1
1 217 1 1 15 ASP H H 26.745 6.920 -1.866 1.00 . A X . 15 ASP H 1 1
1 218 1 1 15 ASP HA H 24.721 5.403 -0.490 1.00 . A X . 15 ASP HA 1 1
1 219 1 1 15 ASP HB2 H 26.691 6.824 0.496 1.00 . A X . 15 ASP HB2 1 1
1 220 1 1 15 ASP HB3 H 25.561 8.170 0.322 1.00 . A X . 15 ASP HB3 1 1
1 221 1 1 15 ASP N N 25.958 6.337 -1.871 1.00 . A X . 15 ASP N 1 1
1 222 1 1 15 ASP O O 23.276 8.050 -0.497 1.00 . A X . 15 ASP O 1 1
1 223 1 1 15 ASP OD1 O 23.971 7.317 2.080 1.00 . A X . 15 ASP OD1 1 1
1 224 1 1 15 ASP OD2 O 25.375 5.701 2.317 1.00 . A X . 15 ASP OD2 1 1
1 225 1 1 16 ABA C C 21.883 6.931 -4.374 1.00 . A X . 16 AIB C 1 1
1 226 1 1 16 ABA CA C 22.113 7.485 -2.976 1.00 . A X . 16 AIB CA 1 1
1 227 1 1 16 ABA H H 23.741 6.138 -2.914 1.00 . A X . 16 AIB H 1 1
1 228 1 1 16 ABA N N 23.288 6.841 -2.402 1.00 . A X . 16 AIB N 1 1
1 229 1 1 16 ABA O O 20.773 6.969 -4.901 1.00 . A X . 16 AIB O 1 1
1 230 1 1 17 ARG C C 23.078 4.298 -6.163 1.00 . A X . 17 ARG C 1 1
1 231 1 1 17 ARG CA C 22.884 5.801 -6.282 1.00 . A X . 17 ARG CA 1 1
1 232 1 1 17 ARG CB C 23.970 6.396 -7.176 1.00 . A X . 17 ARG CB 1 1
1 233 1 1 17 ARG CD C 22.896 7.455 -9.167 1.00 . A X . 17 ARG CD 1 1
1 234 1 1 17 ARG CG C 23.591 6.197 -8.645 1.00 . A X . 17 ARG CG 1 1
1 235 1 1 17 ARG CZ C 21.403 8.079 -10.977 1.00 . A X . 17 ARG CZ 1 1
1 236 1 1 17 ARG H H 23.803 6.385 -4.471 1.00 . A X . 17 ARG H 1 1
1 237 1 1 17 ARG HA H 21.915 6.003 -6.716 1.00 . A X . 17 ARG HA 1 1
1 238 1 1 17 ARG HB2 H 24.065 7.451 -6.966 1.00 . A X . 17 ARG HB2 1 1
1 239 1 1 17 ARG HB3 H 24.908 5.900 -6.976 1.00 . A X . 17 ARG HB3 1 1
1 240 1 1 17 ARG HD2 H 22.219 7.828 -8.414 1.00 . A X . 17 ARG HD2 1 1
1 241 1 1 17 ARG HD3 H 23.639 8.210 -9.383 1.00 . A X . 17 ARG HD3 1 1
1 242 1 1 17 ARG HE H 22.186 6.251 -10.760 1.00 . A X . 17 ARG HE 1 1
1 243 1 1 17 ARG HG2 H 24.483 6.012 -9.225 1.00 . A X . 17 ARG HG2 1 1
1 244 1 1 17 ARG HG3 H 22.921 5.355 -8.735 1.00 . A X . 17 ARG HG3 1 1
1 245 1 1 17 ARG HH11 H 21.846 9.510 -9.648 1.00 . A X . 17 ARG HH11 1 1
1 246 1 1 17 ARG HH12 H 20.779 9.982 -10.928 1.00 . A X . 17 ARG HH12 1 1
1 247 1 1 17 ARG HH21 H 20.789 6.863 -12.442 1.00 . A X . 17 ARG HH21 1 1
1 248 1 1 17 ARG HH22 H 20.181 8.483 -12.511 1.00 . A X . 17 ARG HH22 1 1
1 249 1 1 17 ARG N N 22.951 6.394 -4.955 1.00 . A X . 17 ARG N 1 1
1 250 1 1 17 ARG NE N 22.145 7.153 -10.379 1.00 . A X . 17 ARG NE 1 1
1 251 1 1 17 ARG NH1 N 21.337 9.285 -10.479 1.00 . A X . 17 ARG NH1 1 1
1 252 1 1 17 ARG NH2 N 20.739 7.785 -12.061 1.00 . A X . 17 ARG NH2 1 1
1 253 1 1 17 ARG O O 22.753 3.538 -7.076 1.00 . A X . 17 ARG O 1 1
1 254 1 1 18 ARG C C 22.966 2.113 -3.520 1.00 . A X . 18 ARG C 1 1
1 255 1 1 18 ARG CA C 23.804 2.473 -4.727 1.00 . A X . 18 ARG CA 1 1
1 256 1 1 18 ARG CB C 25.281 2.214 -4.430 1.00 . A X . 18 ARG CB 1 1
1 257 1 1 18 ARG CD C 27.070 0.471 -4.370 1.00 . A X . 18 ARG CD 1 1
1 258 1 1 18 ARG CG C 25.592 0.736 -4.661 1.00 . A X . 18 ARG CG 1 1
1 259 1 1 18 ARG CZ C 27.510 -1.525 -5.681 1.00 . A X . 18 ARG CZ 1 1
1 260 1 1 18 ARG H H 23.800 4.542 -4.310 1.00 . A X . 18 ARG H 1 1
1 261 1 1 18 ARG HA H 23.494 1.881 -5.575 1.00 . A X . 18 ARG HA 1 1
1 262 1 1 18 ARG HB2 H 25.891 2.820 -5.087 1.00 . A X . 18 ARG HB2 1 1
1 263 1 1 18 ARG HB3 H 25.491 2.469 -3.400 1.00 . A X . 18 ARG HB3 1 1
1 264 1 1 18 ARG HD2 H 27.677 1.018 -5.073 1.00 . A X . 18 ARG HD2 1 1
1 265 1 1 18 ARG HD3 H 27.300 0.801 -3.367 1.00 . A X . 18 ARG HD3 1 1
1 266 1 1 18 ARG HE H 27.436 -1.500 -3.680 1.00 . A X . 18 ARG HE 1 1
1 267 1 1 18 ARG HG2 H 24.980 0.135 -4.005 1.00 . A X . 18 ARG HG2 1 1
1 268 1 1 18 ARG HG3 H 25.378 0.480 -5.688 1.00 . A X . 18 ARG HG3 1 1
1 269 1 1 18 ARG HH11 H 27.225 0.173 -6.702 1.00 . A X . 18 ARG HH11 1 1
1 270 1 1 18 ARG HH12 H 27.528 -1.238 -7.661 1.00 . A X . 18 ARG HH12 1 1
1 271 1 1 18 ARG HH21 H 27.829 -3.354 -4.931 1.00 . A X . 18 ARG HH21 1 1
1 272 1 1 18 ARG HH22 H 27.870 -3.234 -6.659 1.00 . A X . 18 ARG HH22 1 1
1 273 1 1 18 ARG N N 23.587 3.883 -5.008 1.00 . A X . 18 ARG N 1 1
1 274 1 1 18 ARG NE N 27.358 -0.954 -4.490 1.00 . A X . 18 ARG NE 1 1
1 275 1 1 18 ARG NH1 N 27.413 -0.808 -6.766 1.00 . A X . 18 ARG NH1 1 1
1 276 1 1 18 ARG NH2 N 27.755 -2.804 -5.764 1.00 . A X . 18 ARG NH2 1 1
1 277 1 1 18 ARG O O 23.051 1.012 -2.975 1.00 . A X . 18 ARG O 1 1
1 278 1 1 19 ALA C C 19.851 3.173 -2.350 1.00 . A X . 19 ALA C 1 1
1 279 1 1 19 ALA CA C 21.302 2.941 -1.957 1.00 . A X . 19 ALA CA 1 1
1 280 1 1 19 ALA CB C 21.718 3.964 -0.905 1.00 . A X . 19 ALA CB 1 1
1 281 1 1 19 ALA H H 22.171 3.938 -3.592 1.00 . A X . 19 ALA H 1 1
1 282 1 1 19 ALA HA H 21.411 1.950 -1.548 1.00 . A X . 19 ALA HA 1 1
1 283 1 1 19 ALA HB1 H 22.440 4.643 -1.343 1.00 . A X . 19 ALA HB1 1 1
1 284 1 1 19 ALA HB2 H 22.161 3.456 -0.063 1.00 . A X . 19 ALA HB2 1 1
1 285 1 1 19 ALA HB3 H 20.851 4.518 -0.581 1.00 . A X . 19 ALA HB3 1 1
1 286 1 1 19 ALA N N 22.168 3.086 -3.108 1.00 . A X . 19 ALA N 1 1
1 287 1 1 19 ALA O O 18.954 2.461 -1.901 1.00 . A X . 19 ALA O 1 1
1 288 1 1 20 GLN C C 17.722 3.351 -4.495 1.00 . A X . 20 GLN C 1 1
1 289 1 1 20 GLN CA C 18.275 4.488 -3.642 1.00 . A X . 20 GLN CA 1 1
1 290 1 1 20 GLN CB C 18.273 5.786 -4.451 1.00 . A X . 20 GLN CB 1 1
1 291 1 1 20 GLN CD C 16.674 6.147 -6.341 1.00 . A X . 20 GLN CD 1 1
1 292 1 1 20 GLN CG C 16.837 6.156 -4.825 1.00 . A X . 20 GLN CG 1 1
1 293 1 1 20 GLN H H 20.382 4.710 -3.527 1.00 . A X . 20 GLN H 1 1
1 294 1 1 20 GLN HA H 17.641 4.615 -2.777 1.00 . A X . 20 GLN HA 1 1
1 295 1 1 20 GLN HB2 H 18.705 6.578 -3.856 1.00 . A X . 20 GLN HB2 1 1
1 296 1 1 20 GLN HB3 H 18.855 5.652 -5.350 1.00 . A X . 20 GLN HB3 1 1
1 297 1 1 20 GLN HE21 H 15.532 4.523 -6.355 1.00 . A X . 20 GLN HE21 1 1
1 298 1 1 20 GLN HE22 H 15.849 5.201 -7.879 1.00 . A X . 20 GLN HE22 1 1
1 299 1 1 20 GLN HG2 H 16.157 5.440 -4.387 1.00 . A X . 20 GLN HG2 1 1
1 300 1 1 20 GLN HG3 H 16.612 7.142 -4.447 1.00 . A X . 20 GLN HG3 1 1
1 301 1 1 20 GLN N N 19.626 4.175 -3.197 1.00 . A X . 20 GLN N 1 1
1 302 1 1 20 GLN NE2 N 15.959 5.213 -6.905 1.00 . A X . 20 GLN NE2 1 1
1 303 1 1 20 GLN O O 16.796 2.649 -4.087 1.00 . A X . 20 GLN O 1 1
1 304 1 1 20 GLN OE1 O 17.209 7.016 -7.029 1.00 . A X . 20 GLN OE1 1 1
1 305 1 1 21 ASP C C 17.769 0.788 -5.816 1.00 . A X . 21 ASP C 1 1
1 306 1 1 21 ASP CA C 17.858 2.108 -6.573 1.00 . A X . 21 ASP CA 1 1
1 307 1 1 21 ASP CB C 18.838 1.969 -7.739 1.00 . A X . 21 ASP CB 1 1
1 308 1 1 21 ASP CG C 18.077 1.981 -9.061 1.00 . A X . 21 ASP CG 1 1
1 309 1 1 21 ASP H H 19.037 3.756 -5.950 1.00 . A X . 21 ASP H 1 1
1 310 1 1 21 ASP HA H 16.882 2.359 -6.962 1.00 . A X . 21 ASP HA 1 1
1 311 1 1 21 ASP HB2 H 19.538 2.795 -7.720 1.00 . A X . 21 ASP HB2 1 1
1 312 1 1 21 ASP HB3 H 19.376 1.037 -7.646 1.00 . A X . 21 ASP HB3 1 1
1 313 1 1 21 ASP N N 18.300 3.170 -5.678 1.00 . A X . 21 ASP N 1 1
1 314 1 1 21 ASP O O 16.920 -0.054 -6.112 1.00 . A X . 21 ASP O 1 1
1 315 1 1 21 ASP OD1 O 17.461 0.977 -9.377 1.00 . A X . 21 ASP OD1 1 1
1 316 1 1 21 ASP OD2 O 18.122 2.995 -9.738 1.00 . A X . 21 ASP OD2 1 1
1 317 1 1 22 PHE C C 17.541 -0.596 -3.015 1.00 . A X . 22 PHE C 1 1
1 318 1 1 22 PHE CA C 18.674 -0.599 -4.039 1.00 . A X . 22 PHE CA 1 1
1 319 1 1 22 PHE CB C 20.013 -0.718 -3.316 1.00 . A X . 22 PHE CB 1 1
1 320 1 1 22 PHE CD1 C 20.406 -3.119 -3.910 1.00 . A X . 22 PHE CD1 1 1
1 321 1 1 22 PHE CD2 C 20.198 -2.521 -1.571 1.00 . A X . 22 PHE CD2 1 1
1 322 1 1 22 PHE CE1 C 20.582 -4.455 -3.554 1.00 . A X . 22 PHE CE1 1 1
1 323 1 1 22 PHE CE2 C 20.370 -3.861 -1.214 1.00 . A X . 22 PHE CE2 1 1
1 324 1 1 22 PHE CG C 20.215 -2.153 -2.920 1.00 . A X . 22 PHE CG 1 1
1 325 1 1 22 PHE CZ C 20.564 -4.831 -2.206 1.00 . A X . 22 PHE CZ 1 1
1 326 1 1 22 PHE H H 19.305 1.321 -4.651 1.00 . A X . 22 PHE H 1 1
1 327 1 1 22 PHE HA H 18.556 -1.454 -4.690 1.00 . A X . 22 PHE HA 1 1
1 328 1 1 22 PHE HB2 H 20.809 -0.407 -3.978 1.00 . A X . 22 PHE HB2 1 1
1 329 1 1 22 PHE HB3 H 20.007 -0.095 -2.433 1.00 . A X . 22 PHE HB3 1 1
1 330 1 1 22 PHE HD1 H 20.423 -2.831 -4.950 1.00 . A X . 22 PHE HD1 1 1
1 331 1 1 22 PHE HD2 H 20.049 -1.772 -0.806 1.00 . A X . 22 PHE HD2 1 1
1 332 1 1 22 PHE HE1 H 20.726 -5.196 -4.321 1.00 . A X . 22 PHE HE1 1 1
1 333 1 1 22 PHE HE2 H 20.354 -4.147 -0.173 1.00 . A X . 22 PHE HE2 1 1
1 334 1 1 22 PHE HZ H 20.697 -5.866 -1.931 1.00 . A X . 22 PHE HZ 1 1
1 335 1 1 22 PHE N N 18.652 0.617 -4.838 1.00 . A X . 22 PHE N 1 1
1 336 1 1 22 PHE O O 16.563 -1.328 -3.158 1.00 . A X . 22 PHE O 1 1
1 337 1 1 23 VAL C C 15.286 0.621 -1.541 1.00 . A X . 23 VAL C 1 1
1 338 1 1 23 VAL CA C 16.658 0.313 -0.944 1.00 . A X . 23 VAL CA 1 1
1 339 1 1 23 VAL CB C 17.030 1.398 0.069 1.00 . A X . 23 VAL CB 1 1
1 340 1 1 23 VAL CG1 C 15.938 1.495 1.135 1.00 . A X . 23 VAL CG1 1 1
1 341 1 1 23 VAL CG2 C 18.360 1.039 0.733 1.00 . A X . 23 VAL CG2 1 1
1 342 1 1 23 VAL H H 18.478 0.792 -1.920 1.00 . A X . 23 VAL H 1 1
1 343 1 1 23 VAL HA H 16.611 -0.634 -0.430 1.00 . A X . 23 VAL HA 1 1
1 344 1 1 23 VAL HB H 17.121 2.346 -0.440 1.00 . A X . 23 VAL HB 1 1
1 345 1 1 23 VAL HG11 H 15.218 2.246 0.846 1.00 . A X . 23 VAL HG11 1 1
1 346 1 1 23 VAL HG12 H 16.382 1.770 2.081 1.00 . A X . 23 VAL HG12 1 1
1 347 1 1 23 VAL HG13 H 15.443 0.541 1.234 1.00 . A X . 23 VAL HG13 1 1
1 348 1 1 23 VAL HG21 H 18.193 0.816 1.777 1.00 . A X . 23 VAL HG21 1 1
1 349 1 1 23 VAL HG22 H 19.042 1.871 0.647 1.00 . A X . 23 VAL HG22 1 1
1 350 1 1 23 VAL HG23 H 18.785 0.174 0.245 1.00 . A X . 23 VAL HG23 1 1
1 351 1 1 23 VAL N N 17.678 0.230 -1.984 1.00 . A X . 23 VAL N 1 1
1 352 1 1 23 VAL O O 14.293 0.709 -0.820 1.00 . A X . 23 VAL O 1 1
1 353 1 1 24 GLN C C 13.199 -0.189 -3.803 1.00 . A X . 24 GLN C 1 1
1 354 1 1 24 GLN CA C 13.987 1.090 -3.536 1.00 . A X . 24 GLN CA 1 1
1 355 1 1 24 GLN CB C 14.284 1.826 -4.850 1.00 . A X . 24 GLN CB 1 1
1 356 1 1 24 GLN CD C 13.262 0.365 -6.622 1.00 . A X . 24 GLN CD 1 1
1 357 1 1 24 GLN CG C 13.121 1.668 -5.834 1.00 . A X . 24 GLN CG 1 1
1 358 1 1 24 GLN H H 16.056 0.711 -3.387 1.00 . A X . 24 GLN H 1 1
1 359 1 1 24 GLN HA H 13.395 1.730 -2.902 1.00 . A X . 24 GLN HA 1 1
1 360 1 1 24 GLN HB2 H 14.433 2.877 -4.642 1.00 . A X . 24 GLN HB2 1 1
1 361 1 1 24 GLN HB3 H 15.184 1.419 -5.290 1.00 . A X . 24 GLN HB3 1 1
1 362 1 1 24 GLN HE21 H 14.739 -0.340 -5.493 1.00 . A X . 24 GLN HE21 1 1
1 363 1 1 24 GLN HE22 H 14.251 -1.352 -6.766 1.00 . A X . 24 GLN HE22 1 1
1 364 1 1 24 GLN HG2 H 12.188 1.665 -5.293 1.00 . A X . 24 GLN HG2 1 1
1 365 1 1 24 GLN HG3 H 13.127 2.499 -6.523 1.00 . A X . 24 GLN HG3 1 1
1 366 1 1 24 GLN N N 15.237 0.788 -2.859 1.00 . A X . 24 GLN N 1 1
1 367 1 1 24 GLN NE2 N 14.159 -0.515 -6.264 1.00 . A X . 24 GLN NE2 1 1
1 368 1 1 24 GLN O O 11.970 -0.169 -3.855 1.00 . A X . 24 GLN O 1 1
1 369 1 1 24 GLN OE1 O 12.533 0.144 -7.588 1.00 . A X . 24 GLN OE1 1 1
1 370 1 1 25 TRP C C 13.166 -3.349 -2.895 1.00 . A X . 25 TRP C 1 1
1 371 1 1 25 TRP CA C 13.237 -2.572 -4.192 1.00 . A X . 25 TRP CA 1 1
1 372 1 1 25 TRP CB C 14.000 -3.406 -5.199 1.00 . A X . 25 TRP CB 1 1
1 373 1 1 25 TRP CD1 C 13.260 -5.773 -4.828 1.00 . A X . 25 TRP CD1 1 1
1 374 1 1 25 TRP CD2 C 15.140 -5.265 -3.726 1.00 . A X . 25 TRP CD2 1 1
1 375 1 1 25 TRP CE2 C 14.866 -6.614 -3.426 1.00 . A X . 25 TRP CE2 1 1
1 376 1 1 25 TRP CE3 C 16.269 -4.674 -3.162 1.00 . A X . 25 TRP CE3 1 1
1 377 1 1 25 TRP CG C 14.127 -4.767 -4.627 1.00 . A X . 25 TRP CG 1 1
1 378 1 1 25 TRP CH2 C 16.829 -6.739 -2.025 1.00 . A X . 25 TRP CH2 1 1
1 379 1 1 25 TRP CZ2 C 15.701 -7.352 -2.580 1.00 . A X . 25 TRP CZ2 1 1
1 380 1 1 25 TRP CZ3 C 17.107 -5.397 -2.319 1.00 . A X . 25 TRP CZ3 1 1
1 381 1 1 25 TRP H H 14.890 -1.281 -3.883 1.00 . A X . 25 TRP H 1 1
1 382 1 1 25 TRP HA H 12.240 -2.407 -4.562 1.00 . A X . 25 TRP HA 1 1
1 383 1 1 25 TRP HB2 H 13.456 -3.443 -6.133 1.00 . A X . 25 TRP HB2 1 1
1 384 1 1 25 TRP HB3 H 14.983 -2.983 -5.359 1.00 . A X . 25 TRP HB3 1 1
1 385 1 1 25 TRP HD1 H 12.375 -5.713 -5.442 1.00 . A X . 25 TRP HD1 1 1
1 386 1 1 25 TRP HE1 H 13.260 -7.761 -4.110 1.00 . A X . 25 TRP HE1 1 1
1 387 1 1 25 TRP HE3 H 16.483 -3.647 -3.367 1.00 . A X . 25 TRP HE3 1 1
1 388 1 1 25 TRP HH2 H 17.482 -7.297 -1.371 1.00 . A X . 25 TRP HH2 1 1
1 389 1 1 25 TRP HZ2 H 15.477 -8.380 -2.350 1.00 . A X . 25 TRP HZ2 1 1
1 390 1 1 25 TRP HZ3 H 17.970 -4.915 -1.894 1.00 . A X . 25 TRP HZ3 1 1
1 391 1 1 25 TRP N N 13.905 -1.305 -3.953 1.00 . A X . 25 TRP N 1 1
1 392 1 1 25 TRP NE1 N 13.701 -6.887 -4.124 1.00 . A X . 25 TRP NE1 1 1
1 393 1 1 25 TRP O O 12.189 -4.045 -2.622 1.00 . A X . 25 TRP O 1 1
1 394 1 1 26 LEU C C 13.008 -3.660 -0.037 1.00 . A X . 26 LEU C 1 1
1 395 1 1 26 LEU CA C 14.277 -3.935 -0.840 1.00 . A X . 26 LEU CA 1 1
1 396 1 1 26 LEU CB C 15.503 -3.496 -0.032 1.00 . A X . 26 LEU CB 1 1
1 397 1 1 26 LEU CD1 C 16.358 -5.720 0.832 1.00 . A X . 26 LEU CD1 1 1
1 398 1 1 26 LEU CD2 C 16.536 -3.664 2.240 1.00 . A X . 26 LEU CD2 1 1
1 399 1 1 26 LEU CG C 15.675 -4.396 1.208 1.00 . A X . 26 LEU CG 1 1
1 400 1 1 26 LEU H H 14.975 -2.669 -2.377 1.00 . A X . 26 LEU H 1 1
1 401 1 1 26 LEU HA H 14.356 -4.987 -1.050 1.00 . A X . 26 LEU HA 1 1
1 402 1 1 26 LEU HB2 H 16.383 -3.556 -0.651 1.00 . A X . 26 LEU HB2 1 1
1 403 1 1 26 LEU HB3 H 15.365 -2.474 0.289 1.00 . A X . 26 LEU HB3 1 1
1 404 1 1 26 LEU HD11 H 15.682 -6.332 0.250 1.00 . A X . 26 LEU HD11 1 1
1 405 1 1 26 LEU HD12 H 16.630 -6.248 1.733 1.00 . A X . 26 LEU HD12 1 1
1 406 1 1 26 LEU HD13 H 17.248 -5.517 0.257 1.00 . A X . 26 LEU HD13 1 1
1 407 1 1 26 LEU HD21 H 16.664 -4.290 3.111 1.00 . A X . 26 LEU HD21 1 1
1 408 1 1 26 LEU HD22 H 16.049 -2.743 2.526 1.00 . A X . 26 LEU HD22 1 1
1 409 1 1 26 LEU HD23 H 17.502 -3.443 1.810 1.00 . A X . 26 LEU HD23 1 1
1 410 1 1 26 LEU HG H 14.707 -4.608 1.639 1.00 . A X . 26 LEU HG 1 1
1 411 1 1 26 LEU N N 14.222 -3.232 -2.101 1.00 . A X . 26 LEU N 1 1
1 412 1 1 26 LEU O O 12.508 -4.534 0.673 1.00 . A X . 26 LEU O 1 1
1 413 1 1 27 MET C C 10.056 -2.201 -0.297 1.00 . A X . 27 MET C 1 1
1 414 1 1 27 MET CA C 11.295 -2.050 0.581 1.00 . A X . 27 MET CA 1 1
1 415 1 1 27 MET CB C 11.414 -0.599 1.052 1.00 . A X . 27 MET CB 1 1
1 416 1 1 27 MET CE C 9.922 1.859 -1.889 1.00 . A X . 27 MET CE 1 1
1 417 1 1 27 MET CG C 11.355 0.337 -0.157 1.00 . A X . 27 MET CG 1 1
1 418 1 1 27 MET H H 12.945 -1.773 -0.725 1.00 . A X . 27 MET H 1 1
1 419 1 1 27 MET HA H 11.191 -2.688 1.445 1.00 . A X . 27 MET HA 1 1
1 420 1 1 27 MET HB2 H 10.599 -0.372 1.725 1.00 . A X . 27 MET HB2 1 1
1 421 1 1 27 MET HB3 H 12.357 -0.463 1.564 1.00 . A X . 27 MET HB3 1 1
1 422 1 1 27 MET HE1 H 8.957 2.104 -2.309 1.00 . A X . 27 MET HE1 1 1
1 423 1 1 27 MET HE2 H 10.447 1.199 -2.560 1.00 . A X . 27 MET HE2 1 1
1 424 1 1 27 MET HE3 H 10.501 2.763 -1.753 1.00 . A X . 27 MET HE3 1 1
1 425 1 1 27 MET HG2 H 12.076 1.134 -0.030 1.00 . A X . 27 MET HG2 1 1
1 426 1 1 27 MET HG3 H 11.582 -0.220 -1.055 1.00 . A X . 27 MET HG3 1 1
1 427 1 1 27 MET N N 12.499 -2.434 -0.147 1.00 . A X . 27 MET N 1 1
1 428 1 1 27 MET O O 8.965 -1.763 0.072 1.00 . A X . 27 MET O 1 1
1 429 1 1 27 MET SD S 9.695 1.045 -0.290 1.00 . A X . 27 MET SD 1 1
1 430 1 1 28 ASN C C 8.571 -4.449 -2.250 1.00 . A X . 28 ASN C 1 1
1 431 1 1 28 ASN CA C 9.114 -3.028 -2.376 1.00 . A X . 28 ASN CA 1 1
1 432 1 1 28 ASN CB C 9.569 -2.780 -3.814 1.00 . A X . 28 ASN CB 1 1
1 433 1 1 28 ASN CG C 8.363 -2.772 -4.748 1.00 . A X . 28 ASN CG 1 1
1 434 1 1 28 ASN H H 11.118 -3.154 -1.699 1.00 . A X . 28 ASN H 1 1
1 435 1 1 28 ASN HA H 8.328 -2.330 -2.134 1.00 . A X . 28 ASN HA 1 1
1 436 1 1 28 ASN HB2 H 10.073 -1.826 -3.870 1.00 . A X . 28 ASN HB2 1 1
1 437 1 1 28 ASN HB3 H 10.248 -3.563 -4.115 1.00 . A X . 28 ASN HB3 1 1
1 438 1 1 28 ASN HD21 H 9.458 -2.631 -6.399 1.00 . A X . 28 ASN HD21 1 1
1 439 1 1 28 ASN HD22 H 7.779 -2.682 -6.643 1.00 . A X . 28 ASN HD22 1 1
1 440 1 1 28 ASN N N 10.228 -2.825 -1.456 1.00 . A X . 28 ASN N 1 1
1 441 1 1 28 ASN ND2 N 8.548 -2.687 -6.036 1.00 . A X . 28 ASN ND2 1 1
1 442 1 1 28 ASN O O 7.690 -4.854 -3.008 1.00 . A X . 28 ASN O 1 1
1 443 1 1 28 ASN OD1 O 7.222 -2.845 -4.292 1.00 . A X . 28 ASN OD1 1 1
1 444 1 1 29 THR C C 8.511 -6.858 0.416 1.00 . A X . 29 THR C 1 1
1 445 1 1 29 THR CA C 8.663 -6.571 -1.075 1.00 . A X . 29 THR CA 1 1
1 446 1 1 29 THR CB C 9.675 -7.545 -1.682 1.00 . A X . 29 THR CB 1 1
1 447 1 1 29 THR CG2 C 9.471 -7.616 -3.197 1.00 . A X . 29 THR CG2 1 1
1 448 1 1 29 THR H H 9.802 -4.820 -0.717 1.00 . A X . 29 THR H 1 1
1 449 1 1 29 THR HA H 7.709 -6.714 -1.558 1.00 . A X . 29 THR HA 1 1
1 450 1 1 29 THR HB H 9.532 -8.526 -1.257 1.00 . A X . 29 THR HB 1 1
1 451 1 1 29 THR HG1 H 11.109 -7.094 -0.448 1.00 . A X . 29 THR HG1 1 1
1 452 1 1 29 THR HG21 H 9.093 -6.671 -3.554 1.00 . A X . 29 THR HG21 1 1
1 453 1 1 29 THR HG22 H 8.762 -8.398 -3.428 1.00 . A X . 29 THR HG22 1 1
1 454 1 1 29 THR HG23 H 10.414 -7.833 -3.677 1.00 . A X . 29 THR HG23 1 1
1 455 1 1 29 THR N N 9.102 -5.197 -1.290 1.00 . A X . 29 THR N 1 1
1 456 1 1 29 THR O O 8.620 -5.951 1.241 1.00 . A X . 29 THR O 1 1
1 457 1 1 29 THR OG1 O 10.992 -7.093 -1.401 1.00 . A X . 29 THR OG1 1 1
1 458 1 1 30 NH2 HN1 H 8.179 -8.798 0.156 1.00 . A X . 30 NH2 HN1 1 1
1 459 1 1 30 NH2 HN2 H 8.165 -8.269 1.769 1.00 . A X . 30 NH2 HN2 1 1
1 460 1 1 30 NH2 N N 8.265 -8.076 0.813 1.00 . A X . 30 NH2 N 1 1
1 461 2 2 1 . C C 32.916 10.914 -8.595 1.00 . B X . 101 GGL C 1 1
1 462 2 2 1 . CA C 31.468 11.383 -8.499 1.00 . B X . 101 GGL CA 1 1
1 463 2 2 1 . CB C 30.720 11.001 -9.777 1.00 . B X . 101 GGL CB 1 1
1 464 2 2 1 . CD C 29.578 8.977 -10.705 1.00 . B X . 101 GGL CD 1 1
1 465 2 2 1 . CG C 30.830 9.493 -10.004 1.00 . B X . 101 GGL CG 1 1
1 466 2 2 1 . H H 32.228 13.315 -8.072 1.00 . B X . 101 GGL H 1 1
1 467 2 2 1 . HA H 30.996 10.895 -7.660 1.00 . B X . 101 GGL HA 1 1
1 468 2 2 1 . HB2 H 31.153 11.522 -10.617 1.00 . B X . 101 GGL HB2 1 1
1 469 2 2 1 . HB3 H 29.680 11.276 -9.680 1.00 . B X . 101 GGL HB3 1 1
1 470 2 2 1 . HG2 H 31.695 9.284 -10.618 1.00 . B X . 101 GGL HG2 1 1
1 471 2 2 1 . HG3 H 30.939 8.993 -9.052 1.00 . B X . 101 GGL HG3 1 1
1 472 2 2 1 . N N 31.410 12.827 -8.300 1.00 . B X . 101 GGL N 1 1
1 473 2 2 1 . O O 33.470 10.986 -9.679 1.00 . B X . 101 GGL O 1 1
1 474 2 2 1 . OE1 O 29.656 8.411 -11.796 1.00 . B X . 101 GGL OE1 1 1
1 475 2 2 1 . OXT O 33.456 10.511 -7.578 1.00 . B X . 101 GGL OXT 1 1
1 476 3 2 1 . C C 31.677 13.629 -12.114 1.00 . C X . 102 GGL C 1 1
1 477 3 2 1 . CA C 30.673 14.476 -11.340 1.00 . C X . 102 GGL CA 1 1
1 478 3 2 1 . CB C 31.339 15.035 -10.081 1.00 . C X . 102 GGL CB 1 1
1 479 3 2 1 . CD C 30.266 13.492 -8.426 1.00 . C X . 102 GGL CD 1 1
1 480 3 2 1 . CG C 30.376 14.939 -8.894 1.00 . C X . 102 GGL CG 1 1
1 481 3 2 1 . H H 29.592 12.969 -10.315 1.00 . C X . 102 GGL H 1 1
1 482 3 2 1 . HA H 30.358 15.300 -11.962 1.00 . C X . 102 GGL HA 1 1
1 483 3 2 1 . HB2 H 32.232 14.467 -9.865 1.00 . C X . 102 GGL HB2 1 1
1 484 3 2 1 . HB3 H 31.604 16.070 -10.244 1.00 . C X . 102 GGL HB3 1 1
1 485 3 2 1 . HG2 H 30.747 15.550 -8.084 1.00 . C X . 102 GGL HG2 1 1
1 486 3 2 1 . HG3 H 29.402 15.296 -9.193 1.00 . C X . 102 GGL HG3 1 1
1 487 3 2 1 . N N 29.502 13.683 -10.980 1.00 . C X . 102 GGL N 1 1
1 488 3 2 1 . O O 31.262 12.642 -12.698 1.00 . C X . 102 GGL O 1 1
1 489 3 2 1 . OE1 O 29.172 13.000 -8.150 1.00 . C X . 102 GGL OE1 1 1
1 490 3 2 1 . OXT O 32.833 14.012 -12.161 1.00 . C X . 102 GGL OXT 1 1
1 491 4 3 1 PLM C1 C 28.331 13.876 -11.578 1.00 . D X . 103 PLM C1 1 1
1 492 4 3 1 PLM C2 C 27.458 12.639 -11.759 1.00 . D X . 103 PLM C2 1 1
1 493 4 3 1 PLM C3 C 28.155 11.636 -12.681 1.00 . D X . 103 PLM C3 1 1
1 494 4 3 1 PLM C4 C 27.227 10.447 -12.936 1.00 . D X . 103 PLM C4 1 1
1 495 4 3 1 PLM C5 C 27.882 9.491 -13.936 1.00 . D X . 103 PLM C5 1 1
1 496 4 3 1 PLM C6 C 27.324 8.081 -13.736 1.00 . D X . 103 PLM C6 1 1
1 497 4 3 1 PLM C7 C 27.866 7.156 -14.828 1.00 . D X . 103 PLM C7 1 1
1 498 4 3 1 PLM C8 C 27.935 5.723 -14.298 1.00 . D X . 103 PLM C8 1 1
1 499 4 3 1 PLM C9 C 29.223 5.527 -13.492 1.00 . D X . 103 PLM C9 1 1
1 500 4 3 1 PLM CA C 28.937 4.631 -12.286 1.00 . D X . 103 PLM CA 1 1
1 501 4 3 1 PLM CB C 30.233 4.394 -11.506 1.00 . D X . 103 PLM CB 1 1
1 502 4 3 1 PLM CC C 29.919 3.639 -10.211 1.00 . D X . 103 PLM CC 1 1
1 503 4 3 1 PLM CD C 29.586 4.637 -9.099 1.00 . D X . 103 PLM CD 1 1
1 504 4 3 1 PLM CE C 28.607 3.997 -8.112 1.00 . D X . 103 PLM CE 1 1
1 505 4 3 1 PLM CF C 27.178 4.127 -8.645 1.00 . D X . 103 PLM CF 1 1
1 506 4 3 1 PLM CG C 26.379 2.874 -8.277 1.00 . D X . 103 PLM CG 1 1
1 507 4 3 1 PLM H21 H 27.281 12.181 -10.798 1.00 . D X . 103 PLM H21 1 1
1 508 4 3 1 PLM H22 H 26.513 12.930 -12.196 1.00 . D X . 103 PLM H22 1 1
1 509 4 3 1 PLM H31 H 28.393 12.113 -13.618 1.00 . D X . 103 PLM H31 1 1
1 510 4 3 1 PLM H32 H 29.064 11.288 -12.212 1.00 . D X . 103 PLM H32 1 1
1 511 4 3 1 PLM H41 H 26.289 10.802 -13.339 1.00 . D X . 103 PLM H41 1 1
1 512 4 3 1 PLM H42 H 27.044 9.926 -12.007 1.00 . D X . 103 PLM H42 1 1
1 513 4 3 1 PLM H51 H 27.672 9.822 -14.941 1.00 . D X . 103 PLM H51 1 1
1 514 4 3 1 PLM H52 H 28.951 9.481 -13.776 1.00 . D X . 103 PLM H52 1 1
1 515 4 3 1 PLM H61 H 26.246 8.110 -13.791 1.00 . D X . 103 PLM H61 1 1
1 516 4 3 1 PLM H62 H 27.624 7.709 -12.767 1.00 . D X . 103 PLM H62 1 1
1 517 4 3 1 PLM H71 H 27.208 7.191 -15.685 1.00 . D X . 103 PLM H71 1 1
1 518 4 3 1 PLM H72 H 28.853 7.484 -15.121 1.00 . D X . 103 PLM H72 1 1
1 519 4 3 1 PLM H81 H 27.924 5.031 -15.127 1.00 . D X . 103 PLM H81 1 1
1 520 4 3 1 PLM H82 H 27.082 5.533 -13.661 1.00 . D X . 103 PLM H82 1 1
1 521 4 3 1 PLM H91 H 29.971 5.062 -14.117 1.00 . D X . 103 PLM H91 1 1
1 522 4 3 1 PLM H92 H 29.585 6.484 -13.148 1.00 . D X . 103 PLM H92 1 1
1 523 4 3 1 PLM HA1 H 28.214 5.110 -11.645 1.00 . D X . 103 PLM HA1 1 1
1 524 4 3 1 PLM HA2 H 28.544 3.683 -12.626 1.00 . D X . 103 PLM HA2 1 1
1 525 4 3 1 PLM HB1 H 30.689 5.343 -11.269 1.00 . D X . 103 PLM HB1 1 1
1 526 4 3 1 PLM HB2 H 30.912 3.808 -12.108 1.00 . D X . 103 PLM HB2 1 1
1 527 4 3 1 PLM HC1 H 29.075 2.986 -10.372 1.00 . D X . 103 PLM HC1 1 1
1 528 4 3 1 PLM HC2 H 30.778 3.050 -9.921 1.00 . D X . 103 PLM HC2 1 1
1 529 4 3 1 PLM HD1 H 30.494 4.910 -8.579 1.00 . D X . 103 PLM HD1 1 1
1 530 4 3 1 PLM HD2 H 29.140 5.523 -9.528 1.00 . D X . 103 PLM HD2 1 1
1 531 4 3 1 PLM HE1 H 28.681 4.497 -7.157 1.00 . D X . 103 PLM HE1 1 1
1 532 4 3 1 PLM HE2 H 28.853 2.952 -7.990 1.00 . D X . 103 PLM HE2 1 1
1 533 4 3 1 PLM HF1 H 26.709 4.995 -8.209 1.00 . D X . 103 PLM HF1 1 1
1 534 4 3 1 PLM HF2 H 27.203 4.235 -9.720 1.00 . D X . 103 PLM HF2 1 1
1 535 4 3 1 PLM HG1 H 25.325 3.101 -8.303 1.00 . D X . 103 PLM HG1 1 1
1 536 4 3 1 PLM HG2 H 26.596 2.089 -8.987 1.00 . D X . 103 PLM HG2 1 1
1 537 4 3 1 PLM HG3 H 26.655 2.551 -7.285 1.00 . D X . 103 PLM HG3 1 1
1 538 4 3 1 PLM O2 O 27.942 14.982 -11.951 1.00 . D X . 103 PLM O2 1 1
2 539 1 1 1 HIS C C 41.972 3.841 5.626 1.00 . A X . 1 HIS C 1 1
2 540 1 1 1 HIS CA C 43.365 3.219 5.642 1.00 . A X . 1 HIS CA 1 1
2 541 1 1 1 HIS CB C 44.428 4.317 5.673 1.00 . A X . 1 HIS CB 1 1
2 542 1 1 1 HIS CD2 C 46.599 3.231 6.682 1.00 . A X . 1 HIS CD2 1 1
2 543 1 1 1 HIS CE1 C 47.675 2.902 4.830 1.00 . A X . 1 HIS CE1 1 1
2 544 1 1 1 HIS CG C 45.796 3.691 5.668 1.00 . A X . 1 HIS CG 1 1
2 545 1 1 1 HIS H1 H 44.511 2.523 4.050 1.00 . A X . 1 HIS H1 1 1
2 546 1 1 1 HIS H2 H 42.856 2.674 3.698 1.00 . A X . 1 HIS H2 1 1
2 547 1 1 1 HIS H3 H 43.411 1.384 4.657 1.00 . A X . 1 HIS H3 1 1
2 548 1 1 1 HIS HA H 43.468 2.595 6.518 1.00 . A X . 1 HIS HA 1 1
2 549 1 1 1 HIS HB2 H 44.318 4.951 4.803 1.00 . A X . 1 HIS HB2 1 1
2 550 1 1 1 HIS HB3 H 44.308 4.911 6.571 1.00 . A X . 1 HIS HB3 1 1
2 551 1 1 1 HIS HD2 H 46.347 3.253 7.732 1.00 . A X . 1 HIS HD2 1 1
2 552 1 1 1 HIS HE1 H 48.434 2.616 4.118 1.00 . A X . 1 HIS HE1 1 1
2 553 1 1 1 HIS HE2 H 48.538 2.343 6.641 1.00 . A X . 1 HIS HE2 1 1
2 554 1 1 1 HIS N N 43.549 2.388 4.420 1.00 . A X . 1 HIS N 1 1
2 555 1 1 1 HIS ND1 N 46.502 3.472 4.496 1.00 . A X . 1 HIS ND1 1 1
2 556 1 1 1 HIS NE2 N 47.785 2.733 6.151 1.00 . A X . 1 HIS NE2 1 1
2 557 1 1 1 HIS O O 41.503 4.361 6.637 1.00 . A X . 1 HIS O 1 1
2 558 1 1 2 ABA C C 40.015 5.855 4.533 1.00 . A X . 2 AIB C 1 1
2 559 1 1 2 ABA CA C 39.979 4.344 4.334 1.00 . A X . 2 AIB CA 1 1
2 560 1 1 2 ABA H H 41.742 3.354 3.697 1.00 . A X . 2 AIB H 1 1
2 561 1 1 2 ABA N N 41.317 3.783 4.471 1.00 . A X . 2 AIB N 1 1
2 562 1 1 2 ABA O O 41.052 6.490 4.343 1.00 . A X . 2 AIB O 1 1
2 563 1 1 3 GLN C C 39.280 8.623 3.907 1.00 . A X . 3 GLN C 1 1
2 564 1 1 3 GLN CA C 38.788 7.865 5.137 1.00 . A X . 3 GLN CA 1 1
2 565 1 1 3 GLN CB C 39.621 8.260 6.357 1.00 . A X . 3 GLN CB 1 1
2 566 1 1 3 GLN CD C 39.415 8.279 8.850 1.00 . A X . 3 GLN CD 1 1
2 567 1 1 3 GLN CG C 39.136 7.482 7.582 1.00 . A X . 3 GLN CG 1 1
2 568 1 1 3 GLN H H 38.080 5.868 5.051 1.00 . A X . 3 GLN H 1 1
2 569 1 1 3 GLN HA H 37.757 8.128 5.319 1.00 . A X . 3 GLN HA 1 1
2 570 1 1 3 GLN HB2 H 40.661 8.033 6.174 1.00 . A X . 3 GLN HB2 1 1
2 571 1 1 3 GLN HB3 H 39.511 9.320 6.540 1.00 . A X . 3 GLN HB3 1 1
2 572 1 1 3 GLN HE21 H 40.576 6.879 9.649 1.00 . A X . 3 GLN HE21 1 1
2 573 1 1 3 GLN HE22 H 40.367 8.275 10.593 1.00 . A X . 3 GLN HE22 1 1
2 574 1 1 3 GLN HG2 H 38.072 7.305 7.496 1.00 . A X . 3 GLN HG2 1 1
2 575 1 1 3 GLN HG3 H 39.656 6.534 7.632 1.00 . A X . 3 GLN HG3 1 1
2 576 1 1 3 GLN N N 38.875 6.426 4.915 1.00 . A X . 3 GLN N 1 1
2 577 1 1 3 GLN NE2 N 40.183 7.768 9.774 1.00 . A X . 3 GLN NE2 1 1
2 578 1 1 3 GLN O O 38.484 9.033 3.061 1.00 . A X . 3 GLN O 1 1
2 579 1 1 3 GLN OE1 O 38.920 9.395 9.005 1.00 . A X . 3 GLN OE1 1 1
2 580 1 1 4 GLY C C 40.748 8.841 1.363 1.00 . A X . 4 GLY C 1 1
2 581 1 1 4 GLY CA C 41.170 9.506 2.668 1.00 . A X . 4 GLY CA 1 1
2 582 1 1 4 GLY H H 41.183 8.450 4.505 1.00 . A X . 4 GLY H 1 1
2 583 1 1 4 GLY HA2 H 40.831 10.531 2.674 1.00 . A X . 4 GLY HA2 1 1
2 584 1 1 4 GLY HA3 H 42.246 9.484 2.743 1.00 . A X . 4 GLY HA3 1 1
2 585 1 1 4 GLY N N 40.594 8.801 3.807 1.00 . A X . 4 GLY N 1 1
2 586 1 1 4 GLY O O 41.031 9.347 0.276 1.00 . A X . 4 GLY O 1 1
2 587 1 1 5 THR C C 38.168 6.515 0.505 1.00 . A X . 5 THR C 1 1
2 588 1 1 5 THR CA C 39.609 6.970 0.311 1.00 . A X . 5 THR CA 1 1
2 589 1 1 5 THR CB C 40.504 5.754 0.075 1.00 . A X . 5 THR CB 1 1
2 590 1 1 5 THR CG2 C 41.650 5.762 1.086 1.00 . A X . 5 THR CG2 1 1
2 591 1 1 5 THR H H 39.877 7.355 2.375 1.00 . A X . 5 THR H 1 1
2 592 1 1 5 THR HA H 39.661 7.613 -0.550 1.00 . A X . 5 THR HA 1 1
2 593 1 1 5 THR HB H 40.912 5.795 -0.924 1.00 . A X . 5 THR HB 1 1
2 594 1 1 5 THR HG1 H 39.475 4.268 -0.645 1.00 . A X . 5 THR HG1 1 1
2 595 1 1 5 THR HG21 H 42.298 4.918 0.905 1.00 . A X . 5 THR HG21 1 1
2 596 1 1 5 THR HG22 H 41.247 5.699 2.086 1.00 . A X . 5 THR HG22 1 1
2 597 1 1 5 THR HG23 H 42.213 6.678 0.984 1.00 . A X . 5 THR HG23 1 1
2 598 1 1 5 THR N N 40.071 7.706 1.482 1.00 . A X . 5 THR N 1 1
2 599 1 1 5 THR O O 37.544 5.986 -0.415 1.00 . A X . 5 THR O 1 1
2 600 1 1 5 THR OG1 O 39.740 4.566 0.229 1.00 . A X . 5 THR OG1 1 1
2 601 1 1 6 PHE C C 35.583 7.430 2.823 1.00 . A X . 6 PHE C 1 1
2 602 1 1 6 PHE CA C 36.278 6.336 2.016 1.00 . A X . 6 PHE CA 1 1
2 603 1 1 6 PHE CB C 36.274 5.025 2.806 1.00 . A X . 6 PHE CB 1 1
2 604 1 1 6 PHE CD1 C 33.931 4.220 2.344 1.00 . A X . 6 PHE CD1 1 1
2 605 1 1 6 PHE CD2 C 34.504 4.905 4.597 1.00 . A X . 6 PHE CD2 1 1
2 606 1 1 6 PHE CE1 C 32.627 3.927 2.765 1.00 . A X . 6 PHE CE1 1 1
2 607 1 1 6 PHE CE2 C 33.202 4.613 5.018 1.00 . A X . 6 PHE CE2 1 1
2 608 1 1 6 PHE CG C 34.869 4.708 3.260 1.00 . A X . 6 PHE CG 1 1
2 609 1 1 6 PHE CZ C 32.264 4.123 4.101 1.00 . A X . 6 PHE CZ 1 1
2 610 1 1 6 PHE H H 38.193 7.152 2.401 1.00 . A X . 6 PHE H 1 1
2 611 1 1 6 PHE HA H 35.742 6.188 1.091 1.00 . A X . 6 PHE HA 1 1
2 612 1 1 6 PHE HB2 H 36.637 4.226 2.177 1.00 . A X . 6 PHE HB2 1 1
2 613 1 1 6 PHE HB3 H 36.916 5.123 3.668 1.00 . A X . 6 PHE HB3 1 1
2 614 1 1 6 PHE HD1 H 34.212 4.067 1.313 1.00 . A X . 6 PHE HD1 1 1
2 615 1 1 6 PHE HD2 H 35.228 5.283 5.305 1.00 . A X . 6 PHE HD2 1 1
2 616 1 1 6 PHE HE1 H 31.904 3.549 2.057 1.00 . A X . 6 PHE HE1 1 1
2 617 1 1 6 PHE HE2 H 32.921 4.764 6.050 1.00 . A X . 6 PHE HE2 1 1
2 618 1 1 6 PHE HZ H 31.258 3.897 4.426 1.00 . A X . 6 PHE HZ 1 1
2 619 1 1 6 PHE N N 37.647 6.725 1.708 1.00 . A X . 6 PHE N 1 1
2 620 1 1 6 PHE O O 36.224 8.371 3.285 1.00 . A X . 6 PHE O 1 1
2 621 1 1 7 THR C C 33.222 9.512 2.885 1.00 . A X . 7 THR C 1 1
2 622 1 1 7 THR CA C 33.502 8.282 3.743 1.00 . A X . 7 THR CA 1 1
2 623 1 1 7 THR CB C 34.274 8.698 4.999 1.00 . A X . 7 THR CB 1 1
2 624 1 1 7 THR CG2 C 33.288 9.012 6.126 1.00 . A X . 7 THR CG2 1 1
2 625 1 1 7 THR H H 33.811 6.524 2.598 1.00 . A X . 7 THR H 1 1
2 626 1 1 7 THR HA H 32.564 7.841 4.041 1.00 . A X . 7 THR HA 1 1
2 627 1 1 7 THR HB H 34.861 9.577 4.786 1.00 . A X . 7 THR HB 1 1
2 628 1 1 7 THR HG1 H 35.591 7.913 6.195 1.00 . A X . 7 THR HG1 1 1
2 629 1 1 7 THR HG21 H 33.834 9.344 6.997 1.00 . A X . 7 THR HG21 1 1
2 630 1 1 7 THR HG22 H 32.725 8.125 6.370 1.00 . A X . 7 THR HG22 1 1
2 631 1 1 7 THR HG23 H 32.612 9.791 5.806 1.00 . A X . 7 THR HG23 1 1
2 632 1 1 7 THR N N 34.270 7.297 2.989 1.00 . A X . 7 THR N 1 1
2 633 1 1 7 THR O O 32.067 9.872 2.658 1.00 . A X . 7 THR O 1 1
2 634 1 1 7 THR OG1 O 35.131 7.639 5.398 1.00 . A X . 7 THR OG1 1 1
2 635 1 1 8 SER C C 33.233 11.053 0.388 1.00 . A X . 8 SER C 1 1
2 636 1 1 8 SER CA C 34.142 11.340 1.578 1.00 . A X . 8 SER CA 1 1
2 637 1 1 8 SER CB C 35.513 11.795 1.077 1.00 . A X . 8 SER CB 1 1
2 638 1 1 8 SER H H 35.183 9.819 2.624 1.00 . A X . 8 SER H 1 1
2 639 1 1 8 SER HA H 33.708 12.131 2.170 1.00 . A X . 8 SER HA 1 1
2 640 1 1 8 SER HB2 H 36.108 12.138 1.907 1.00 . A X . 8 SER HB2 1 1
2 641 1 1 8 SER HB3 H 36.014 10.963 0.598 1.00 . A X . 8 SER HB3 1 1
2 642 1 1 8 SER HG H 34.469 13.233 0.284 1.00 . A X . 8 SER HG 1 1
2 643 1 1 8 SER N N 34.287 10.152 2.411 1.00 . A X . 8 SER N 1 1
2 644 1 1 8 SER O O 32.103 11.542 0.326 1.00 . A X . 8 SER O 1 1
2 645 1 1 8 SER OG O 35.344 12.860 0.151 1.00 . A X . 8 SER OG 1 1
2 646 1 1 9 ASP C C 31.594 9.345 -1.338 1.00 . A X . 9 ASP C 1 1
2 647 1 1 9 ASP CA C 32.952 9.914 -1.737 1.00 . A X . 9 ASP CA 1 1
2 648 1 1 9 ASP CB C 33.709 8.884 -2.579 1.00 . A X . 9 ASP CB 1 1
2 649 1 1 9 ASP CG C 35.104 9.405 -2.909 1.00 . A X . 9 ASP CG 1 1
2 650 1 1 9 ASP H H 34.635 9.898 -0.450 1.00 . A X . 9 ASP H 1 1
2 651 1 1 9 ASP HA H 32.800 10.803 -2.330 1.00 . A X . 9 ASP HA 1 1
2 652 1 1 9 ASP HB2 H 33.795 7.960 -2.021 1.00 . A X . 9 ASP HB2 1 1
2 653 1 1 9 ASP HB3 H 33.169 8.703 -3.497 1.00 . A X . 9 ASP HB3 1 1
2 654 1 1 9 ASP N N 33.730 10.259 -0.554 1.00 . A X . 9 ASP N 1 1
2 655 1 1 9 ASP O O 30.560 9.744 -1.878 1.00 . A X . 9 ASP O 1 1
2 656 1 1 9 ASP OD1 O 35.215 10.210 -3.820 1.00 . A X . 9 ASP OD1 1 1
2 657 1 1 9 ASP OD2 O 36.042 8.992 -2.246 1.00 . A X . 9 ASP OD2 1 1
2 658 1 1 10 TYR C C 29.506 8.814 0.813 1.00 . A X . 10 TYR C 1 1
2 659 1 1 10 TYR CA C 30.367 7.795 0.073 1.00 . A X . 10 TYR CA 1 1
2 660 1 1 10 TYR CB C 30.688 6.624 1.003 1.00 . A X . 10 TYR CB 1 1
2 661 1 1 10 TYR CD1 C 29.955 4.543 -0.212 1.00 . A X . 10 TYR CD1 1 1
2 662 1 1 10 TYR CD2 C 32.313 5.107 -0.182 1.00 . A X . 10 TYR CD2 1 1
2 663 1 1 10 TYR CE1 C 30.238 3.402 -0.971 1.00 . A X . 10 TYR CE1 1 1
2 664 1 1 10 TYR CE2 C 32.596 3.966 -0.941 1.00 . A X . 10 TYR CE2 1 1
2 665 1 1 10 TYR CG C 30.993 5.395 0.182 1.00 . A X . 10 TYR CG 1 1
2 666 1 1 10 TYR CZ C 31.559 3.113 -1.336 1.00 . A X . 10 TYR CZ 1 1
2 667 1 1 10 TYR H H 32.457 8.135 0.001 1.00 . A X . 10 TYR H 1 1
2 668 1 1 10 TYR HA H 29.818 7.425 -0.779 1.00 . A X . 10 TYR HA 1 1
2 669 1 1 10 TYR HB2 H 31.546 6.873 1.612 1.00 . A X . 10 TYR HB2 1 1
2 670 1 1 10 TYR HB3 H 29.839 6.428 1.641 1.00 . A X . 10 TYR HB3 1 1
2 671 1 1 10 TYR HD1 H 28.937 4.765 0.069 1.00 . A X . 10 TYR HD1 1 1
2 672 1 1 10 TYR HD2 H 33.114 5.766 0.123 1.00 . A X . 10 TYR HD2 1 1
2 673 1 1 10 TYR HE1 H 29.438 2.744 -1.277 1.00 . A X . 10 TYR HE1 1 1
2 674 1 1 10 TYR HE2 H 33.616 3.743 -1.222 1.00 . A X . 10 TYR HE2 1 1
2 675 1 1 10 TYR HH H 32.316 1.371 -1.527 1.00 . A X . 10 TYR HH 1 1
2 676 1 1 10 TYR N N 31.603 8.413 -0.392 1.00 . A X . 10 TYR N 1 1
2 677 1 1 10 TYR O O 29.832 10.000 0.863 1.00 . A X . 10 TYR O 1 1
2 678 1 1 10 TYR OH O 31.838 1.988 -2.085 1.00 . A X . 10 TYR OH 1 1
2 679 1 1 11 SER C C 26.975 10.327 1.223 1.00 . A X . 11 SER C 1 1
2 680 1 1 11 SER CA C 27.504 9.219 2.128 1.00 . A X . 11 SER CA 1 1
2 681 1 1 11 SER CB C 28.240 9.839 3.315 1.00 . A X . 11 SER CB 1 1
2 682 1 1 11 SER H H 28.195 7.388 1.319 1.00 . A X . 11 SER H 1 1
2 683 1 1 11 SER HA H 26.672 8.640 2.497 1.00 . A X . 11 SER HA 1 1
2 684 1 1 11 SER HB2 H 29.090 9.230 3.574 1.00 . A X . 11 SER HB2 1 1
2 685 1 1 11 SER HB3 H 28.580 10.831 3.050 1.00 . A X . 11 SER HB3 1 1
2 686 1 1 11 SER HG H 27.487 9.121 4.960 1.00 . A X . 11 SER HG 1 1
2 687 1 1 11 SER N N 28.405 8.342 1.390 1.00 . A X . 11 SER N 1 1
2 688 1 1 11 SER O O 26.271 11.228 1.679 1.00 . A X . 11 SER O 1 1
2 689 1 1 11 SER OG O 27.359 9.910 4.429 1.00 . A X . 11 SER OG 1 1
2 690 1 1 12 LYS C C 26.395 10.607 -2.312 1.00 . A X . 12 LYS C 1 1
2 691 1 1 12 LYS CA C 26.876 11.261 -1.018 1.00 . A X . 12 LYS CA 1 1
2 692 1 1 12 LYS CB C 28.022 12.225 -1.333 1.00 . A X . 12 LYS CB 1 1
2 693 1 1 12 LYS CD C 27.539 14.534 -0.505 1.00 . A X . 12 LYS CD 1 1
2 694 1 1 12 LYS CE C 27.697 15.497 0.672 1.00 . A X . 12 LYS CE 1 1
2 695 1 1 12 LYS CG C 28.206 13.199 -0.167 1.00 . A X . 12 LYS CG 1 1
2 696 1 1 12 LYS H H 27.885 9.516 -0.365 1.00 . A X . 12 LYS H 1 1
2 697 1 1 12 LYS HA H 26.061 11.820 -0.587 1.00 . A X . 12 LYS HA 1 1
2 698 1 1 12 LYS HB2 H 28.933 11.662 -1.480 1.00 . A X . 12 LYS HB2 1 1
2 699 1 1 12 LYS HB3 H 27.791 12.779 -2.230 1.00 . A X . 12 LYS HB3 1 1
2 700 1 1 12 LYS HD2 H 28.006 14.957 -1.384 1.00 . A X . 12 LYS HD2 1 1
2 701 1 1 12 LYS HD3 H 26.490 14.372 -0.699 1.00 . A X . 12 LYS HD3 1 1
2 702 1 1 12 LYS HE2 H 27.019 16.330 0.550 1.00 . A X . 12 LYS HE2 1 1
2 703 1 1 12 LYS HE3 H 27.472 14.979 1.593 1.00 . A X . 12 LYS HE3 1 1
2 704 1 1 12 LYS HG2 H 27.757 12.785 0.723 1.00 . A X . 12 LYS HG2 1 1
2 705 1 1 12 LYS HG3 H 29.261 13.360 0.004 1.00 . A X . 12 LYS HG3 1 1
2 706 1 1 12 LYS HZ1 H 29.367 16.365 -0.219 1.00 . A X . 12 LYS HZ1 1 1
2 707 1 1 12 LYS HZ2 H 29.738 15.224 0.982 1.00 . A X . 12 LYS HZ2 1 1
2 708 1 1 12 LYS HZ3 H 29.172 16.764 1.417 1.00 . A X . 12 LYS HZ3 1 1
2 709 1 1 12 LYS N N 27.321 10.255 -0.059 1.00 . A X . 12 LYS N 1 1
2 710 1 1 12 LYS NZ N 29.099 16.001 0.717 1.00 . A X . 12 LYS NZ 1 1
2 711 1 1 12 LYS O O 25.226 10.724 -2.677 1.00 . A X . 12 LYS O 1 1
2 712 1 1 13 LYS C C 26.396 7.877 -4.013 1.00 . A X . 13 LYS C 1 1
2 713 1 1 13 LYS CA C 26.961 9.273 -4.259 1.00 . A X . 13 LYS CA 1 1
2 714 1 1 13 LYS CB C 28.200 9.173 -5.152 1.00 . A X . 13 LYS CB 1 1
2 715 1 1 13 LYS CD C 28.416 9.217 -7.642 1.00 . A X . 13 LYS CD 1 1
2 716 1 1 13 LYS CE C 28.054 8.494 -8.941 1.00 . A X . 13 LYS CE 1 1
2 717 1 1 13 LYS CG C 27.837 8.450 -6.452 1.00 . A X . 13 LYS CG 1 1
2 718 1 1 13 LYS H H 28.225 9.876 -2.667 1.00 . A X . 13 LYS H 1 1
2 719 1 1 13 LYS HA H 26.214 9.864 -4.768 1.00 . A X . 13 LYS HA 1 1
2 720 1 1 13 LYS HB2 H 28.562 10.165 -5.379 1.00 . A X . 13 LYS HB2 1 1
2 721 1 1 13 LYS HB3 H 28.971 8.618 -4.638 1.00 . A X . 13 LYS HB3 1 1
2 722 1 1 13 LYS HD2 H 28.005 10.217 -7.659 1.00 . A X . 13 LYS HD2 1 1
2 723 1 1 13 LYS HD3 H 29.490 9.271 -7.549 1.00 . A X . 13 LYS HD3 1 1
2 724 1 1 13 LYS HE2 H 28.481 7.503 -8.928 1.00 . A X . 13 LYS HE2 1 1
2 725 1 1 13 LYS HE3 H 26.980 8.419 -9.020 1.00 . A X . 13 LYS HE3 1 1
2 726 1 1 13 LYS HG2 H 28.246 7.449 -6.433 1.00 . A X . 13 LYS HG2 1 1
2 727 1 1 13 LYS HG3 H 26.763 8.399 -6.547 1.00 . A X . 13 LYS HG3 1 1
2 728 1 1 13 LYS HZ1 H 28.940 10.128 -9.959 1.00 . A X . 13 LYS HZ1 1 1
2 729 1 1 13 LYS N N 27.306 9.929 -3.003 1.00 . A X . 13 LYS N 1 1
2 730 1 1 13 LYS NZ N 28.576 9.227 -10.088 1.00 . A X . 13 LYS NZ 1 1
2 731 1 1 13 LYS O O 25.184 7.709 -3.882 1.00 . A X . 13 LYS O 1 1
2 732 1 1 14 LEU C C 25.739 5.462 -2.692 1.00 . A X . 14 LEU C 1 1
2 733 1 1 14 LEU CA C 26.849 5.507 -3.732 1.00 . A X . 14 LEU CA 1 1
2 734 1 1 14 LEU CB C 28.026 4.654 -3.265 1.00 . A X . 14 LEU CB 1 1
2 735 1 1 14 LEU CD1 C 30.218 5.818 -3.513 1.00 . A X . 14 LEU CD1 1 1
2 736 1 1 14 LEU CD2 C 29.890 3.541 -4.487 1.00 . A X . 14 LEU CD2 1 1
2 737 1 1 14 LEU CG C 29.219 4.882 -4.192 1.00 . A X . 14 LEU CG 1 1
2 738 1 1 14 LEU H H 28.233 7.076 -4.074 1.00 . A X . 14 LEU H 1 1
2 739 1 1 14 LEU HA H 26.478 5.103 -4.660 1.00 . A X . 14 LEU HA 1 1
2 740 1 1 14 LEU HB2 H 28.294 4.929 -2.255 1.00 . A X . 14 LEU HB2 1 1
2 741 1 1 14 LEU HB3 H 27.748 3.612 -3.293 1.00 . A X . 14 LEU HB3 1 1
2 742 1 1 14 LEU HD11 H 30.760 5.277 -2.753 1.00 . A X . 14 LEU HD11 1 1
2 743 1 1 14 LEU HD12 H 29.688 6.642 -3.061 1.00 . A X . 14 LEU HD12 1 1
2 744 1 1 14 LEU HD13 H 30.912 6.198 -4.250 1.00 . A X . 14 LEU HD13 1 1
2 745 1 1 14 LEU HD21 H 30.755 3.702 -5.114 1.00 . A X . 14 LEU HD21 1 1
2 746 1 1 14 LEU HD22 H 29.191 2.893 -4.994 1.00 . A X . 14 LEU HD22 1 1
2 747 1 1 14 LEU HD23 H 30.199 3.081 -3.561 1.00 . A X . 14 LEU HD23 1 1
2 748 1 1 14 LEU HG H 28.876 5.327 -5.115 1.00 . A X . 14 LEU HG 1 1
2 749 1 1 14 LEU N N 27.279 6.883 -3.958 1.00 . A X . 14 LEU N 1 1
2 750 1 1 14 LEU O O 24.737 4.768 -2.869 1.00 . A X . 14 LEU O 1 1
2 751 1 1 15 ASP C C 23.722 7.096 -1.033 1.00 . A X . 15 ASP C 1 1
2 752 1 1 15 ASP CA C 24.908 6.264 -0.565 1.00 . A X . 15 ASP CA 1 1
2 753 1 1 15 ASP CB C 25.498 6.877 0.707 1.00 . A X . 15 ASP CB 1 1
2 754 1 1 15 ASP CG C 24.783 6.321 1.933 1.00 . A X . 15 ASP CG 1 1
2 755 1 1 15 ASP H H 26.727 6.758 -1.530 1.00 . A X . 15 ASP H 1 1
2 756 1 1 15 ASP HA H 24.574 5.258 -0.351 1.00 . A X . 15 ASP HA 1 1
2 757 1 1 15 ASP HB2 H 26.551 6.635 0.765 1.00 . A X . 15 ASP HB2 1 1
2 758 1 1 15 ASP HB3 H 25.375 7.950 0.675 1.00 . A X . 15 ASP HB3 1 1
2 759 1 1 15 ASP N N 25.915 6.217 -1.615 1.00 . A X . 15 ASP N 1 1
2 760 1 1 15 ASP O O 23.208 7.940 -0.298 1.00 . A X . 15 ASP O 1 1
2 761 1 1 15 ASP OD1 O 23.577 6.154 1.867 1.00 . A X . 15 ASP OD1 1 1
2 762 1 1 15 ASP OD2 O 25.453 6.072 2.923 1.00 . A X . 15 ASP OD2 1 1
2 763 1 1 16 ABA C C 22.000 7.072 -4.305 1.00 . A X . 16 AIB C 1 1
2 764 1 1 16 ABA CA C 22.192 7.567 -2.877 1.00 . A X . 16 AIB CA 1 1
2 765 1 1 16 ABA H H 23.774 6.167 -2.799 1.00 . A X . 16 AIB H 1 1
2 766 1 1 16 ABA N N 23.309 6.850 -2.272 1.00 . A X . 16 AIB N 1 1
2 767 1 1 16 ABA O O 20.908 7.161 -4.868 1.00 . A X . 16 AIB O 1 1
2 768 1 1 17 ARG C C 23.196 4.486 -6.170 1.00 . A X . 17 ARG C 1 1
2 769 1 1 17 ARG CA C 23.038 6.000 -6.224 1.00 . A X . 17 ARG CA 1 1
2 770 1 1 17 ARG CB C 24.166 6.608 -7.054 1.00 . A X . 17 ARG CB 1 1
2 771 1 1 17 ARG CD C 22.794 8.321 -8.257 1.00 . A X . 17 ARG CD 1 1
2 772 1 1 17 ARG CG C 23.625 7.046 -8.419 1.00 . A X . 17 ARG CG 1 1
2 773 1 1 17 ARG CZ C 21.542 8.185 -10.334 1.00 . A X . 17 ARG CZ 1 1
2 774 1 1 17 ARG H H 23.907 6.483 -4.359 1.00 . A X . 17 ARG H 1 1
2 775 1 1 17 ARG HA H 22.088 6.239 -6.679 1.00 . A X . 17 ARG HA 1 1
2 776 1 1 17 ARG HB2 H 24.571 7.464 -6.533 1.00 . A X . 17 ARG HB2 1 1
2 777 1 1 17 ARG HB3 H 24.941 5.872 -7.195 1.00 . A X . 17 ARG HB3 1 1
2 778 1 1 17 ARG HD2 H 22.570 8.473 -7.213 1.00 . A X . 17 ARG HD2 1 1
2 779 1 1 17 ARG HD3 H 23.361 9.164 -8.627 1.00 . A X . 17 ARG HD3 1 1
2 780 1 1 17 ARG HE H 20.698 8.156 -8.520 1.00 . A X . 17 ARG HE 1 1
2 781 1 1 17 ARG HG2 H 24.453 7.237 -9.087 1.00 . A X . 17 ARG HG2 1 1
2 782 1 1 17 ARG HG3 H 23.005 6.264 -8.830 1.00 . A X . 17 ARG HG3 1 1
2 783 1 1 17 ARG HH11 H 23.533 8.324 -10.497 1.00 . A X . 17 ARG HH11 1 1
2 784 1 1 17 ARG HH12 H 22.662 8.233 -11.992 1.00 . A X . 17 ARG HH12 1 1
2 785 1 1 17 ARG HH21 H 19.551 8.040 -10.476 1.00 . A X . 17 ARG HH21 1 1
2 786 1 1 17 ARG HH22 H 20.409 8.073 -11.980 1.00 . A X . 17 ARG HH22 1 1
2 787 1 1 17 ARG N N 23.073 6.535 -4.870 1.00 . A X . 17 ARG N 1 1
2 788 1 1 17 ARG NE N 21.547 8.210 -9.005 1.00 . A X . 17 ARG NE 1 1
2 789 1 1 17 ARG NH1 N 22.667 8.252 -10.992 1.00 . A X . 17 ARG NH1 1 1
2 790 1 1 17 ARG NH2 N 20.413 8.092 -10.981 1.00 . A X . 17 ARG NH2 1 1
2 791 1 1 17 ARG O O 22.906 3.778 -7.133 1.00 . A X . 17 ARG O 1 1
2 792 1 1 18 ARG C C 22.935 2.177 -3.629 1.00 . A X . 18 ARG C 1 1
2 793 1 1 18 ARG CA C 23.818 2.579 -4.793 1.00 . A X . 18 ARG CA 1 1
2 794 1 1 18 ARG CB C 25.277 2.275 -4.464 1.00 . A X . 18 ARG CB 1 1
2 795 1 1 18 ARG CD C 26.606 0.297 -3.727 1.00 . A X . 18 ARG CD 1 1
2 796 1 1 18 ARG CG C 25.554 0.794 -4.716 1.00 . A X . 18 ARG CG 1 1
2 797 1 1 18 ARG CZ C 26.557 -0.765 -1.543 1.00 . A X . 18 ARG CZ 1 1
2 798 1 1 18 ARG H H 23.831 4.624 -4.273 1.00 . A X . 18 ARG H 1 1
2 799 1 1 18 ARG HA H 23.524 2.033 -5.677 1.00 . A X . 18 ARG HA 1 1
2 800 1 1 18 ARG HB2 H 25.920 2.874 -5.093 1.00 . A X . 18 ARG HB2 1 1
2 801 1 1 18 ARG HB3 H 25.468 2.505 -3.422 1.00 . A X . 18 ARG HB3 1 1
2 802 1 1 18 ARG HD2 H 27.030 -0.627 -4.090 1.00 . A X . 18 ARG HD2 1 1
2 803 1 1 18 ARG HD3 H 27.388 1.036 -3.639 1.00 . A X . 18 ARG HD3 1 1
2 804 1 1 18 ARG HE H 25.176 0.535 -2.181 1.00 . A X . 18 ARG HE 1 1
2 805 1 1 18 ARG HG2 H 24.641 0.232 -4.586 1.00 . A X . 18 ARG HG2 1 1
2 806 1 1 18 ARG HG3 H 25.917 0.664 -5.723 1.00 . A X . 18 ARG HG3 1 1
2 807 1 1 18 ARG HH11 H 28.085 -1.254 -2.742 1.00 . A X . 18 ARG HH11 1 1
2 808 1 1 18 ARG HH12 H 28.074 -2.023 -1.190 1.00 . A X . 18 ARG HH12 1 1
2 809 1 1 18 ARG HH21 H 25.156 -0.469 -0.144 1.00 . A X . 18 ARG HH21 1 1
2 810 1 1 18 ARG HH22 H 26.416 -1.578 0.281 1.00 . A X . 18 ARG HH22 1 1
2 811 1 1 18 ARG N N 23.639 4.004 -5.012 1.00 . A X . 18 ARG N 1 1
2 812 1 1 18 ARG NE N 26.003 0.068 -2.419 1.00 . A X . 18 ARG NE 1 1
2 813 1 1 18 ARG NH1 N 27.658 -1.396 -1.850 1.00 . A X . 18 ARG NH1 1 1
2 814 1 1 18 ARG NH2 N 26.000 -0.951 -0.378 1.00 . A X . 18 ARG NH2 1 1
2 815 1 1 18 ARG O O 22.933 1.034 -3.177 1.00 . A X . 18 ARG O 1 1
2 816 1 1 19 ALA C C 19.854 3.212 -2.469 1.00 . A X . 19 ALA C 1 1
2 817 1 1 19 ALA CA C 21.295 2.984 -2.031 1.00 . A X . 19 ALA CA 1 1
2 818 1 1 19 ALA CB C 21.669 3.983 -0.941 1.00 . A X . 19 ALA CB 1 1
2 819 1 1 19 ALA H H 22.262 4.052 -3.565 1.00 . A X . 19 ALA H 1 1
2 820 1 1 19 ALA HA H 21.398 1.985 -1.646 1.00 . A X . 19 ALA HA 1 1
2 821 1 1 19 ALA HB1 H 22.337 4.725 -1.361 1.00 . A X . 19 ALA HB1 1 1
2 822 1 1 19 ALA HB2 H 22.167 3.463 -0.134 1.00 . A X . 19 ALA HB2 1 1
2 823 1 1 19 ALA HB3 H 20.777 4.463 -0.569 1.00 . A X . 19 ALA HB3 1 1
2 824 1 1 19 ALA N N 22.193 3.166 -3.152 1.00 . A X . 19 ALA N 1 1
2 825 1 1 19 ALA O O 18.935 2.557 -1.981 1.00 . A X . 19 ALA O 1 1
2 826 1 1 20 GLN C C 17.857 3.346 -4.842 1.00 . A X . 20 GLN C 1 1
2 827 1 1 20 GLN CA C 18.328 4.447 -3.900 1.00 . A X . 20 GLN CA 1 1
2 828 1 1 20 GLN CB C 18.333 5.787 -4.637 1.00 . A X . 20 GLN CB 1 1
2 829 1 1 20 GLN CD C 16.763 6.609 -6.402 1.00 . A X . 20 GLN CD 1 1
2 830 1 1 20 GLN CG C 16.893 6.208 -4.936 1.00 . A X . 20 GLN CG 1 1
2 831 1 1 20 GLN H H 20.438 4.636 -3.759 1.00 . A X . 20 GLN H 1 1
2 832 1 1 20 GLN HA H 17.647 4.510 -3.064 1.00 . A X . 20 GLN HA 1 1
2 833 1 1 20 GLN HB2 H 18.805 6.536 -4.018 1.00 . A X . 20 GLN HB2 1 1
2 834 1 1 20 GLN HB3 H 18.878 5.688 -5.564 1.00 . A X . 20 GLN HB3 1 1
2 835 1 1 20 GLN HE21 H 18.385 7.753 -6.386 1.00 . A X . 20 GLN HE21 1 1
2 836 1 1 20 GLN HE22 H 17.567 7.674 -7.872 1.00 . A X . 20 GLN HE22 1 1
2 837 1 1 20 GLN HG2 H 16.227 5.384 -4.729 1.00 . A X . 20 GLN HG2 1 1
2 838 1 1 20 GLN HG3 H 16.628 7.048 -4.312 1.00 . A X . 20 GLN HG3 1 1
2 839 1 1 20 GLN N N 19.666 4.146 -3.400 1.00 . A X . 20 GLN N 1 1
2 840 1 1 20 GLN NE2 N 17.644 7.412 -6.931 1.00 . A X . 20 GLN NE2 1 1
2 841 1 1 20 GLN O O 16.897 2.634 -4.550 1.00 . A X . 20 GLN O 1 1
2 842 1 1 20 GLN OE1 O 15.831 6.179 -7.085 1.00 . A X . 20 GLN OE1 1 1
2 843 1 1 21 ASP C C 18.144 0.813 -6.278 1.00 . A X . 21 ASP C 1 1
2 844 1 1 21 ASP CA C 18.192 2.185 -6.946 1.00 . A X . 21 ASP CA 1 1
2 845 1 1 21 ASP CB C 19.222 2.168 -8.076 1.00 . A X . 21 ASP CB 1 1
2 846 1 1 21 ASP CG C 20.039 0.883 -8.018 1.00 . A X . 21 ASP CG 1 1
2 847 1 1 21 ASP H H 19.305 3.801 -6.147 1.00 . A X . 21 ASP H 1 1
2 848 1 1 21 ASP HA H 17.223 2.412 -7.360 1.00 . A X . 21 ASP HA 1 1
2 849 1 1 21 ASP HB2 H 18.710 2.225 -9.028 1.00 . A X . 21 ASP HB2 1 1
2 850 1 1 21 ASP HB3 H 19.884 3.018 -7.971 1.00 . A X . 21 ASP HB3 1 1
2 851 1 1 21 ASP N N 18.544 3.208 -5.970 1.00 . A X . 21 ASP N 1 1
2 852 1 1 21 ASP O O 17.726 -0.172 -6.889 1.00 . A X . 21 ASP O 1 1
2 853 1 1 21 ASP OD1 O 20.945 0.816 -7.204 1.00 . A X . 21 ASP OD1 1 1
2 854 1 1 21 ASP OD2 O 19.746 -0.018 -8.788 1.00 . A X . 21 ASP OD2 1 1
2 855 1 1 22 PHE C C 17.482 -0.529 -3.241 1.00 . A X . 22 PHE C 1 1
2 856 1 1 22 PHE CA C 18.603 -0.487 -4.277 1.00 . A X . 22 PHE CA 1 1
2 857 1 1 22 PHE CB C 19.946 -0.623 -3.569 1.00 . A X . 22 PHE CB 1 1
2 858 1 1 22 PHE CD1 C 20.337 -3.007 -4.227 1.00 . A X . 22 PHE CD1 1 1
2 859 1 1 22 PHE CD2 C 20.164 -2.465 -1.873 1.00 . A X . 22 PHE CD2 1 1
2 860 1 1 22 PHE CE1 C 20.522 -4.349 -3.906 1.00 . A X . 22 PHE CE1 1 1
2 861 1 1 22 PHE CE2 C 20.347 -3.811 -1.549 1.00 . A X . 22 PHE CE2 1 1
2 862 1 1 22 PHE CG C 20.159 -2.065 -3.212 1.00 . A X . 22 PHE CG 1 1
2 863 1 1 22 PHE CZ C 20.527 -4.756 -2.567 1.00 . A X . 22 PHE CZ 1 1
2 864 1 1 22 PHE H H 18.913 1.573 -4.597 1.00 . A X . 22 PHE H 1 1
2 865 1 1 22 PHE HA H 18.485 -1.317 -4.959 1.00 . A X . 22 PHE HA 1 1
2 866 1 1 22 PHE HB2 H 20.737 -0.293 -4.229 1.00 . A X . 22 PHE HB2 1 1
2 867 1 1 22 PHE HB3 H 19.946 -0.023 -2.672 1.00 . A X . 22 PHE HB3 1 1
2 868 1 1 22 PHE HD1 H 20.336 -2.695 -5.261 1.00 . A X . 22 PHE HD1 1 1
2 869 1 1 22 PHE HD2 H 20.026 -1.736 -1.088 1.00 . A X . 22 PHE HD2 1 1
2 870 1 1 22 PHE HE1 H 20.655 -5.069 -4.694 1.00 . A X . 22 PHE HE1 1 1
2 871 1 1 22 PHE HE2 H 20.349 -4.120 -0.517 1.00 . A X . 22 PHE HE2 1 1
2 872 1 1 22 PHE HZ H 20.670 -5.797 -2.319 1.00 . A X . 22 PHE HZ 1 1
2 873 1 1 22 PHE N N 18.584 0.760 -5.026 1.00 . A X . 22 PHE N 1 1
2 874 1 1 22 PHE O O 16.530 -1.297 -3.374 1.00 . A X . 22 PHE O 1 1
2 875 1 1 23 VAL C C 15.221 0.614 -1.676 1.00 . A X . 23 VAL C 1 1
2 876 1 1 23 VAL CA C 16.619 0.329 -1.134 1.00 . A X . 23 VAL CA 1 1
2 877 1 1 23 VAL CB C 16.995 1.402 -0.112 1.00 . A X . 23 VAL CB 1 1
2 878 1 1 23 VAL CG1 C 15.937 1.448 0.993 1.00 . A X . 23 VAL CG1 1 1
2 879 1 1 23 VAL CG2 C 18.357 1.064 0.502 1.00 . A X . 23 VAL CG2 1 1
2 880 1 1 23 VAL H H 18.400 0.871 -2.147 1.00 . A X . 23 VAL H 1 1
2 881 1 1 23 VAL HA H 16.609 -0.628 -0.638 1.00 . A X . 23 VAL HA 1 1
2 882 1 1 23 VAL HB H 17.046 2.362 -0.600 1.00 . A X . 23 VAL HB 1 1
2 883 1 1 23 VAL HG11 H 15.480 0.475 1.097 1.00 . A X . 23 VAL HG11 1 1
2 884 1 1 23 VAL HG12 H 15.180 2.175 0.737 1.00 . A X . 23 VAL HG12 1 1
2 885 1 1 23 VAL HG13 H 16.403 1.728 1.926 1.00 . A X . 23 VAL HG13 1 1
2 886 1 1 23 VAL HG21 H 19.020 1.911 0.393 1.00 . A X . 23 VAL HG21 1 1
2 887 1 1 23 VAL HG22 H 18.778 0.209 -0.005 1.00 . A X . 23 VAL HG22 1 1
2 888 1 1 23 VAL HG23 H 18.233 0.839 1.550 1.00 . A X . 23 VAL HG23 1 1
2 889 1 1 23 VAL N N 17.613 0.289 -2.204 1.00 . A X . 23 VAL N 1 1
2 890 1 1 23 VAL O O 14.259 0.677 -0.911 1.00 . A X . 23 VAL O 1 1
2 891 1 1 24 GLN C C 13.052 -0.235 -3.857 1.00 . A X . 24 GLN C 1 1
2 892 1 1 24 GLN CA C 13.801 1.063 -3.582 1.00 . A X . 24 GLN CA 1 1
2 893 1 1 24 GLN CB C 13.957 1.869 -4.876 1.00 . A X . 24 GLN CB 1 1
2 894 1 1 24 GLN CD C 13.647 0.125 -6.641 1.00 . A X . 24 GLN CD 1 1
2 895 1 1 24 GLN CG C 14.658 1.020 -5.936 1.00 . A X . 24 GLN CG 1 1
2 896 1 1 24 GLN H H 15.894 0.730 -3.561 1.00 . A X . 24 GLN H 1 1
2 897 1 1 24 GLN HA H 13.223 1.644 -2.878 1.00 . A X . 24 GLN HA 1 1
2 898 1 1 24 GLN HB2 H 12.978 2.159 -5.236 1.00 . A X . 24 GLN HB2 1 1
2 899 1 1 24 GLN HB3 H 14.545 2.754 -4.679 1.00 . A X . 24 GLN HB3 1 1
2 900 1 1 24 GLN HE21 H 14.179 -1.497 -5.638 1.00 . A X . 24 GLN HE21 1 1
2 901 1 1 24 GLN HE22 H 12.934 -1.722 -6.768 1.00 . A X . 24 GLN HE22 1 1
2 902 1 1 24 GLN HG2 H 15.125 1.669 -6.661 1.00 . A X . 24 GLN HG2 1 1
2 903 1 1 24 GLN HG3 H 15.410 0.407 -5.465 1.00 . A X . 24 GLN HG3 1 1
2 904 1 1 24 GLN N N 15.103 0.788 -2.989 1.00 . A X . 24 GLN N 1 1
2 905 1 1 24 GLN NE2 N 13.580 -1.137 -6.324 1.00 . A X . 24 GLN NE2 1 1
2 906 1 1 24 GLN O O 11.836 -0.228 -4.043 1.00 . A X . 24 GLN O 1 1
2 907 1 1 24 GLN OE1 O 12.895 0.588 -7.500 1.00 . A X . 24 GLN OE1 1 1
2 908 1 1 25 TRP C C 13.126 -3.405 -2.759 1.00 . A X . 25 TRP C 1 1
2 909 1 1 25 TRP CA C 13.152 -2.648 -4.068 1.00 . A X . 25 TRP CA 1 1
2 910 1 1 25 TRP CB C 13.936 -3.474 -5.068 1.00 . A X . 25 TRP CB 1 1
2 911 1 1 25 TRP CD1 C 13.234 -5.848 -4.648 1.00 . A X . 25 TRP CD1 1 1
2 912 1 1 25 TRP CD2 C 15.130 -5.294 -3.595 1.00 . A X . 25 TRP CD2 1 1
2 913 1 1 25 TRP CE2 C 14.882 -6.643 -3.268 1.00 . A X . 25 TRP CE2 1 1
2 914 1 1 25 TRP CE3 C 16.260 -4.677 -3.066 1.00 . A X . 25 TRP CE3 1 1
2 915 1 1 25 TRP CG C 14.090 -4.826 -4.480 1.00 . A X . 25 TRP CG 1 1
2 916 1 1 25 TRP CH2 C 16.877 -6.715 -1.909 1.00 . A X . 25 TRP CH2 1 1
2 917 1 1 25 TRP CZ2 C 15.747 -7.353 -2.429 1.00 . A X . 25 TRP CZ2 1 1
2 918 1 1 25 TRP CZ3 C 17.126 -5.375 -2.231 1.00 . A X . 25 TRP CZ3 1 1
2 919 1 1 25 TRP H H 14.748 -1.307 -3.668 1.00 . A X . 25 TRP H 1 1
2 920 1 1 25 TRP HA H 12.143 -2.524 -4.430 1.00 . A X . 25 TRP HA 1 1
2 921 1 1 25 TRP HB2 H 13.395 -3.535 -6.004 1.00 . A X . 25 TRP HB2 1 1
2 922 1 1 25 TRP HB3 H 14.911 -3.036 -5.230 1.00 . A X . 25 TRP HB3 1 1
2 923 1 1 25 TRP HD1 H 12.336 -5.813 -5.243 1.00 . A X . 25 TRP HD1 1 1
2 924 1 1 25 TRP HE1 H 13.278 -7.824 -3.898 1.00 . A X . 25 TRP HE1 1 1
2 925 1 1 25 TRP HE3 H 16.456 -3.648 -3.291 1.00 . A X . 25 TRP HE3 1 1
2 926 1 1 25 TRP HH2 H 17.553 -7.252 -1.262 1.00 . A X . 25 TRP HH2 1 1
2 927 1 1 25 TRP HZ2 H 15.544 -8.380 -2.176 1.00 . A X . 25 TRP HZ2 1 1
2 928 1 1 25 TRP HZ3 H 17.992 -4.873 -1.834 1.00 . A X . 25 TRP HZ3 1 1
2 929 1 1 25 TRP N N 13.777 -1.352 -3.850 1.00 . A X . 25 TRP N 1 1
2 930 1 1 25 TRP NE1 N 13.706 -6.944 -3.936 1.00 . A X . 25 TRP NE1 1 1
2 931 1 1 25 TRP O O 12.171 -4.116 -2.450 1.00 . A X . 25 TRP O 1 1
2 932 1 1 26 LEU C C 13.055 -3.667 0.111 1.00 . A X . 26 LEU C 1 1
2 933 1 1 26 LEU CA C 14.306 -3.928 -0.722 1.00 . A X . 26 LEU CA 1 1
2 934 1 1 26 LEU CB C 15.545 -3.444 0.040 1.00 . A X . 26 LEU CB 1 1
2 935 1 1 26 LEU CD1 C 16.463 -5.629 0.938 1.00 . A X . 26 LEU CD1 1 1
2 936 1 1 26 LEU CD2 C 16.655 -3.532 2.278 1.00 . A X . 26 LEU CD2 1 1
2 937 1 1 26 LEU CG C 15.771 -4.307 1.299 1.00 . A X . 26 LEU CG 1 1
2 938 1 1 26 LEU H H 14.932 -2.676 -2.301 1.00 . A X . 26 LEU H 1 1
2 939 1 1 26 LEU HA H 14.402 -4.981 -0.916 1.00 . A X . 26 LEU HA 1 1
2 940 1 1 26 LEU HB2 H 16.409 -3.506 -0.602 1.00 . A X . 26 LEU HB2 1 1
2 941 1 1 26 LEU HB3 H 15.398 -2.416 0.336 1.00 . A X . 26 LEU HB3 1 1
2 942 1 1 26 LEU HD11 H 16.758 -6.135 1.846 1.00 . A X . 26 LEU HD11 1 1
2 943 1 1 26 LEU HD12 H 17.340 -5.429 0.343 1.00 . A X . 26 LEU HD12 1 1
2 944 1 1 26 LEU HD13 H 15.785 -6.263 0.382 1.00 . A X . 26 LEU HD13 1 1
2 945 1 1 26 LEU HD21 H 17.607 -3.322 1.814 1.00 . A X . 26 LEU HD21 1 1
2 946 1 1 26 LEU HD22 H 16.811 -4.125 3.168 1.00 . A X . 26 LEU HD22 1 1
2 947 1 1 26 LEU HD23 H 16.171 -2.604 2.545 1.00 . A X . 26 LEU HD23 1 1
2 948 1 1 26 LEU HG H 14.823 -4.518 1.768 1.00 . A X . 26 LEU HG 1 1
2 949 1 1 26 LEU N N 14.200 -3.250 -1.995 1.00 . A X . 26 LEU N 1 1
2 950 1 1 26 LEU O O 12.605 -4.531 0.864 1.00 . A X . 26 LEU O 1 1
2 951 1 1 27 MET C C 10.053 -2.273 -0.112 1.00 . A X . 27 MET C 1 1
2 952 1 1 27 MET CA C 11.311 -2.090 0.732 1.00 . A X . 27 MET CA 1 1
2 953 1 1 27 MET CB C 11.418 -0.631 1.184 1.00 . A X . 27 MET CB 1 1
2 954 1 1 27 MET CE C 9.794 1.834 -1.685 1.00 . A X . 27 MET CE 1 1
2 955 1 1 27 MET CG C 11.294 0.290 -0.030 1.00 . A X . 27 MET CG 1 1
2 956 1 1 27 MET H H 12.911 -1.807 -0.633 1.00 . A X . 27 MET H 1 1
2 957 1 1 27 MET HA H 11.241 -2.719 1.605 1.00 . A X . 27 MET HA 1 1
2 958 1 1 27 MET HB2 H 10.625 -0.414 1.886 1.00 . A X . 27 MET HB2 1 1
2 959 1 1 27 MET HB3 H 12.375 -0.471 1.659 1.00 . A X . 27 MET HB3 1 1
2 960 1 1 27 MET HE1 H 10.036 1.133 -2.472 1.00 . A X . 27 MET HE1 1 1
2 961 1 1 27 MET HE2 H 10.586 2.557 -1.595 1.00 . A X . 27 MET HE2 1 1
2 962 1 1 27 MET HE3 H 8.869 2.343 -1.921 1.00 . A X . 27 MET HE3 1 1
2 963 1 1 27 MET HG2 H 11.991 1.111 0.068 1.00 . A X . 27 MET HG2 1 1
2 964 1 1 27 MET HG3 H 11.515 -0.267 -0.930 1.00 . A X . 27 MET HG3 1 1
2 965 1 1 27 MET N N 12.504 -2.462 -0.021 1.00 . A X . 27 MET N 1 1
2 966 1 1 27 MET O O 8.966 -1.853 0.283 1.00 . A X . 27 MET O 1 1
2 967 1 1 27 MET SD S 9.607 0.940 -0.123 1.00 . A X . 27 MET SD 1 1
2 968 1 1 28 ASN C C 8.456 -4.503 -1.893 1.00 . A X . 28 ASN C 1 1
2 969 1 1 28 ASN CA C 9.070 -3.132 -2.157 1.00 . A X . 28 ASN CA 1 1
2 970 1 1 28 ASN CB C 9.517 -3.044 -3.618 1.00 . A X . 28 ASN CB 1 1
2 971 1 1 28 ASN CG C 8.328 -3.284 -4.541 1.00 . A X . 28 ASN CG 1 1
2 972 1 1 28 ASN H H 11.095 -3.215 -1.536 1.00 . A X . 28 ASN H 1 1
2 973 1 1 28 ASN HA H 8.324 -2.373 -1.974 1.00 . A X . 28 ASN HA 1 1
2 974 1 1 28 ASN HB2 H 9.927 -2.063 -3.808 1.00 . A X . 28 ASN HB2 1 1
2 975 1 1 28 ASN HB3 H 10.271 -3.792 -3.807 1.00 . A X . 28 ASN HB3 1 1
2 976 1 1 28 ASN HD21 H 7.683 -1.409 -4.441 1.00 . A X . 28 ASN HD21 1 1
2 977 1 1 28 ASN HD22 H 6.756 -2.443 -5.416 1.00 . A X . 28 ASN HD22 1 1
2 978 1 1 28 ASN N N 10.206 -2.902 -1.271 1.00 . A X . 28 ASN N 1 1
2 979 1 1 28 ASN ND2 N 7.522 -2.297 -4.824 1.00 . A X . 28 ASN ND2 1 1
2 980 1 1 28 ASN O O 7.337 -4.786 -2.322 1.00 . A X . 28 ASN O 1 1
2 981 1 1 28 ASN OD1 O 8.127 -4.400 -5.020 1.00 . A X . 28 ASN OD1 1 1
2 982 1 1 29 THR C C 7.768 -6.652 0.326 1.00 . A X . 29 THR C 1 1
2 983 1 1 29 THR CA C 8.713 -6.692 -0.871 1.00 . A X . 29 THR CA 1 1
2 984 1 1 29 THR CB C 9.895 -7.612 -0.561 1.00 . A X . 29 THR CB 1 1
2 985 1 1 29 THR CG2 C 10.739 -7.806 -1.823 1.00 . A X . 29 THR CG2 1 1
2 986 1 1 29 THR H H 10.079 -5.072 -0.871 1.00 . A X . 29 THR H 1 1
2 987 1 1 29 THR HA H 8.182 -7.082 -1.726 1.00 . A X . 29 THR HA 1 1
2 988 1 1 29 THR HB H 9.528 -8.571 -0.227 1.00 . A X . 29 THR HB 1 1
2 989 1 1 29 THR HG1 H 10.849 -6.111 0.225 1.00 . A X . 29 THR HG1 1 1
2 990 1 1 29 THR HG21 H 11.230 -6.878 -2.073 1.00 . A X . 29 THR HG21 1 1
2 991 1 1 29 THR HG22 H 10.100 -8.109 -2.640 1.00 . A X . 29 THR HG22 1 1
2 992 1 1 29 THR HG23 H 11.482 -8.570 -1.644 1.00 . A X . 29 THR HG23 1 1
2 993 1 1 29 THR N N 9.196 -5.352 -1.187 1.00 . A X . 29 THR N 1 1
2 994 1 1 29 THR O O 8.212 -6.633 1.472 1.00 . A X . 29 THR O 1 1
2 995 1 1 29 THR OG1 O 10.694 -7.028 0.460 1.00 . A X . 29 THR OG1 1 1
2 996 1 1 30 NH2 HN1 H 6.125 -6.656 -0.791 1.00 . A X . 30 NH2 HN1 1 1
2 997 1 1 30 NH2 HN2 H 5.864 -6.617 0.886 1.00 . A X . 30 NH2 HN2 1 1
2 998 1 1 30 NH2 N N 6.479 -6.641 0.124 1.00 . A X . 30 NH2 N 1 1
2 999 2 2 1 . C C 32.030 6.118 -11.916 1.00 . B X . 101 GGL C 1 1
2 1000 2 2 1 . CA C 32.092 7.390 -11.075 1.00 . B X . 101 GGL CA 1 1
2 1001 2 2 1 . CB C 31.033 8.379 -11.566 1.00 . B X . 101 GGL CB 1 1
2 1002 2 2 1 . CD C 28.565 8.694 -11.306 1.00 . B X . 101 GGL CD 1 1
2 1003 2 2 1 . CG C 29.670 7.688 -11.610 1.00 . B X . 101 GGL CG 1 1
2 1004 2 2 1 . H H 34.164 7.471 -11.518 1.00 . B X . 101 GGL H 1 1
2 1005 2 2 1 . HA H 31.887 7.140 -10.046 1.00 . B X . 101 GGL HA 1 1
2 1006 2 2 1 . HB2 H 31.292 8.724 -12.555 1.00 . B X . 101 GGL HB2 1 1
2 1007 2 2 1 . HB3 H 30.989 9.222 -10.891 1.00 . B X . 101 GGL HB3 1 1
2 1008 2 2 1 . HG2 H 29.512 7.269 -12.593 1.00 . B X . 101 GGL HG2 1 1
2 1009 2 2 1 . HG3 H 29.645 6.897 -10.875 1.00 . B X . 101 GGL HG3 1 1
2 1010 2 2 1 . N N 33.417 7.995 -11.161 1.00 . B X . 101 GGL N 1 1
2 1011 2 2 1 . O O 31.192 5.281 -11.626 1.00 . B X . 101 GGL O 1 1
2 1012 2 2 1 . OE1 O 27.751 9.018 -12.172 1.00 . B X . 101 GGL OE1 1 1
2 1013 2 2 1 . OXT O 32.821 6.001 -12.837 1.00 . B X . 101 GGL OXT 1 1
2 1014 3 2 1 . C C 34.804 12.438 -8.705 1.00 . C X . 102 GGL C 1 1
2 1015 3 2 1 . CA C 35.498 11.459 -9.649 1.00 . C X . 102 GGL CA 1 1
2 1016 3 2 1 . CB C 34.777 11.459 -10.999 1.00 . C X . 102 GGL CB 1 1
2 1017 3 2 1 . CD C 33.627 9.246 -10.764 1.00 . C X . 102 GGL CD 1 1
2 1018 3 2 1 . CG C 34.680 10.031 -11.541 1.00 . C X . 102 GGL CG 1 1
2 1019 3 2 1 . H H 35.388 9.343 -9.668 1.00 . C X . 102 GGL H 1 1
2 1020 3 2 1 . HA H 36.517 11.782 -9.799 1.00 . C X . 102 GGL HA 1 1
2 1021 3 2 1 . HB2 H 33.783 11.864 -10.876 1.00 . C X . 102 GGL HB2 1 1
2 1022 3 2 1 . HB3 H 35.327 12.070 -11.700 1.00 . C X . 102 GGL HB3 1 1
2 1023 3 2 1 . HG2 H 34.402 10.062 -12.585 1.00 . C X . 102 GGL HG2 1 1
2 1024 3 2 1 . HG3 H 35.639 9.543 -11.441 1.00 . C X . 102 GGL HG3 1 1
2 1025 3 2 1 . N N 35.504 10.117 -9.079 1.00 . C X . 102 GGL N 1 1
2 1026 3 2 1 . O O 34.001 11.988 -7.902 1.00 . C X . 102 GGL O 1 1
2 1027 3 2 1 . OE1 O 33.051 9.749 -9.799 1.00 . C X . 102 GGL OE1 1 1
2 1028 3 2 1 . OXT O 35.103 13.618 -8.782 1.00 . C X . 102 GGL OXT 1 1
2 1029 4 3 1 PLM C1 C 35.660 9.927 -7.774 1.00 . D X . 103 PLM C1 1 1
2 1030 4 3 1 PLM C2 C 34.488 9.282 -7.042 1.00 . D X . 103 PLM C2 1 1
2 1031 4 3 1 PLM C3 C 34.583 7.759 -7.143 1.00 . D X . 103 PLM C3 1 1
2 1032 4 3 1 PLM C4 C 33.378 7.124 -6.445 1.00 . D X . 103 PLM C4 1 1
2 1033 4 3 1 PLM C5 C 33.796 5.794 -5.815 1.00 . D X . 103 PLM C5 1 1
2 1034 4 3 1 PLM C6 C 34.407 4.892 -6.889 1.00 . D X . 103 PLM C6 1 1
2 1035 4 3 1 PLM C7 C 34.198 3.426 -6.502 1.00 . D X . 103 PLM C7 1 1
2 1036 4 3 1 PLM C8 C 32.828 2.957 -7.000 1.00 . D X . 103 PLM C8 1 1
2 1037 4 3 1 PLM C9 C 32.964 2.395 -8.419 1.00 . D X . 103 PLM C9 1 1
2 1038 4 3 1 PLM CA C 31.592 1.924 -8.924 1.00 . D X . 103 PLM CA 1 1
2 1039 4 3 1 PLM CB C 30.683 3.125 -9.217 1.00 . D X . 103 PLM CB 1 1
2 1040 4 3 1 PLM CC C 29.524 3.140 -8.219 1.00 . D X . 103 PLM CC 1 1
2 1041 4 3 1 PLM CD C 28.713 4.426 -8.398 1.00 . D X . 103 PLM CD 1 1
2 1042 4 3 1 PLM CE C 27.503 4.410 -7.456 1.00 . D X . 103 PLM CE 1 1
2 1043 4 3 1 PLM CF C 26.307 3.737 -8.147 1.00 . D X . 103 PLM CF 1 1
2 1044 4 3 1 PLM CG C 25.804 4.603 -9.311 1.00 . D X . 103 PLM CG 1 1
2 1045 4 3 1 PLM H21 H 34.508 9.575 -6.004 1.00 . D X . 103 PLM H21 1 1
2 1046 4 3 1 PLM H22 H 33.561 9.612 -7.490 1.00 . D X . 103 PLM H22 1 1
2 1047 4 3 1 PLM H31 H 34.593 7.465 -8.182 1.00 . D X . 103 PLM H31 1 1
2 1048 4 3 1 PLM H32 H 35.493 7.423 -6.666 1.00 . D X . 103 PLM H32 1 1
2 1049 4 3 1 PLM H41 H 32.595 6.951 -7.167 1.00 . D X . 103 PLM H41 1 1
2 1050 4 3 1 PLM H42 H 33.016 7.791 -5.675 1.00 . D X . 103 PLM H42 1 1
2 1051 4 3 1 PLM H51 H 34.526 5.976 -5.041 1.00 . D X . 103 PLM H51 1 1
2 1052 4 3 1 PLM H52 H 32.930 5.311 -5.388 1.00 . D X . 103 PLM H52 1 1
2 1053 4 3 1 PLM H61 H 35.464 5.095 -6.972 1.00 . D X . 103 PLM H61 1 1
2 1054 4 3 1 PLM H62 H 33.927 5.085 -7.837 1.00 . D X . 103 PLM H62 1 1
2 1055 4 3 1 PLM H71 H 34.971 2.821 -6.950 1.00 . D X . 103 PLM H71 1 1
2 1056 4 3 1 PLM H72 H 34.243 3.327 -5.427 1.00 . D X . 103 PLM H72 1 1
2 1057 4 3 1 PLM H81 H 32.144 3.792 -7.005 1.00 . D X . 103 PLM H81 1 1
2 1058 4 3 1 PLM H82 H 32.452 2.187 -6.343 1.00 . D X . 103 PLM H82 1 1
2 1059 4 3 1 PLM H91 H 33.356 3.158 -9.075 1.00 . D X . 103 PLM H91 1 1
2 1060 4 3 1 PLM H92 H 33.644 1.556 -8.405 1.00 . D X . 103 PLM H92 1 1
2 1061 4 3 1 PLM HA1 H 31.726 1.349 -9.828 1.00 . D X . 103 PLM HA1 1 1
2 1062 4 3 1 PLM HA2 H 31.131 1.303 -8.172 1.00 . D X . 103 PLM HA2 1 1
2 1063 4 3 1 PLM HB1 H 30.291 3.039 -10.220 1.00 . D X . 103 PLM HB1 1 1
2 1064 4 3 1 PLM HB2 H 31.243 4.044 -9.130 1.00 . D X . 103 PLM HB2 1 1
2 1065 4 3 1 PLM HC1 H 28.889 2.286 -8.393 1.00 . D X . 103 PLM HC1 1 1
2 1066 4 3 1 PLM HC2 H 29.915 3.098 -7.214 1.00 . D X . 103 PLM HC2 1 1
2 1067 4 3 1 PLM HD1 H 29.336 5.277 -8.165 1.00 . D X . 103 PLM HD1 1 1
2 1068 4 3 1 PLM HD2 H 28.380 4.498 -9.421 1.00 . D X . 103 PLM HD2 1 1
2 1069 4 3 1 PLM HE1 H 27.243 5.423 -7.184 1.00 . D X . 103 PLM HE1 1 1
2 1070 4 3 1 PLM HE2 H 27.752 3.857 -6.562 1.00 . D X . 103 PLM HE2 1 1
2 1071 4 3 1 PLM HF1 H 26.609 2.773 -8.528 1.00 . D X . 103 PLM HF1 1 1
2 1072 4 3 1 PLM HF2 H 25.509 3.605 -7.432 1.00 . D X . 103 PLM HF2 1 1
2 1073 4 3 1 PLM HG1 H 26.038 4.117 -10.247 1.00 . D X . 103 PLM HG1 1 1
2 1074 4 3 1 PLM HG2 H 24.734 4.729 -9.229 1.00 . D X . 103 PLM HG2 1 1
2 1075 4 3 1 PLM HG3 H 26.283 5.570 -9.279 1.00 . D X . 103 PLM HG3 1 1
2 1076 4 3 1 PLM O2 O 36.700 10.204 -7.175 1.00 . D X . 103 PLM O2 1 1
3 1077 1 1 1 HIS C C 38.082 7.173 -12.374 1.00 . A X . 1 HIS C 1 1
3 1078 1 1 1 HIS CA C 37.017 6.095 -12.207 1.00 . A X . 1 HIS CA 1 1
3 1079 1 1 1 HIS CB C 37.249 4.971 -13.218 1.00 . A X . 1 HIS CB 1 1
3 1080 1 1 1 HIS CD2 C 34.958 5.147 -14.495 1.00 . A X . 1 HIS CD2 1 1
3 1081 1 1 1 HIS CE1 C 35.735 5.486 -16.490 1.00 . A X . 1 HIS CE1 1 1
3 1082 1 1 1 HIS CG C 36.327 5.151 -14.394 1.00 . A X . 1 HIS CG 1 1
3 1083 1 1 1 HIS H1 H 35.548 6.903 -13.443 1.00 . A X . 1 HIS H1 1 1
3 1084 1 1 1 HIS H2 H 35.585 7.572 -11.882 1.00 . A X . 1 HIS H2 1 1
3 1085 1 1 1 HIS H3 H 34.937 6.022 -12.129 1.00 . A X . 1 HIS H3 1 1
3 1086 1 1 1 HIS HA H 37.068 5.694 -11.206 1.00 . A X . 1 HIS HA 1 1
3 1087 1 1 1 HIS HB2 H 38.275 4.998 -13.558 1.00 . A X . 1 HIS HB2 1 1
3 1088 1 1 1 HIS HB3 H 37.049 4.017 -12.749 1.00 . A X . 1 HIS HB3 1 1
3 1089 1 1 1 HIS HD2 H 34.273 5.001 -13.673 1.00 . A X . 1 HIS HD2 1 1
3 1090 1 1 1 HIS HE1 H 35.800 5.662 -17.554 1.00 . A X . 1 HIS HE1 1 1
3 1091 1 1 1 HIS HE2 H 33.677 5.404 -16.184 1.00 . A X . 1 HIS HE2 1 1
3 1092 1 1 1 HIS N N 35.670 6.693 -12.432 1.00 . A X . 1 HIS N 1 1
3 1093 1 1 1 HIS ND1 N 36.801 5.369 -15.678 1.00 . A X . 1 HIS ND1 1 1
3 1094 1 1 1 HIS NE2 N 34.586 5.358 -15.820 1.00 . A X . 1 HIS NE2 1 1
3 1095 1 1 1 HIS O O 37.972 8.041 -13.241 1.00 . A X . 1 HIS O 1 1
3 1096 1 1 2 ABA C C 41.411 7.582 -10.834 1.00 . A X . 2 AIB C 1 1
3 1097 1 1 2 ABA CA C 40.193 8.090 -11.599 1.00 . A X . 2 AIB CA 1 1
3 1098 1 1 2 ABA H H 39.146 6.400 -10.865 1.00 . A X . 2 AIB H 1 1
3 1099 1 1 2 ABA N N 39.112 7.114 -11.536 1.00 . A X . 2 AIB N 1 1
3 1100 1 1 2 ABA O O 42.513 8.112 -10.980 1.00 . A X . 2 AIB O 1 1
3 1101 1 1 3 GLN C C 43.173 7.086 -8.658 1.00 . A X . 3 GLN C 1 1
3 1102 1 1 3 GLN CA C 42.293 5.982 -9.236 1.00 . A X . 3 GLN CA 1 1
3 1103 1 1 3 GLN CB C 43.140 5.057 -10.113 1.00 . A X . 3 GLN CB 1 1
3 1104 1 1 3 GLN CD C 42.940 3.141 -11.710 1.00 . A X . 3 GLN CD 1 1
3 1105 1 1 3 GLN CG C 42.323 3.821 -10.492 1.00 . A X . 3 GLN CG 1 1
3 1106 1 1 3 GLN H H 40.306 6.171 -9.944 1.00 . A X . 3 GLN H 1 1
3 1107 1 1 3 GLN HA H 41.876 5.404 -8.424 1.00 . A X . 3 GLN HA 1 1
3 1108 1 1 3 GLN HB2 H 43.436 5.584 -11.010 1.00 . A X . 3 GLN HB2 1 1
3 1109 1 1 3 GLN HB3 H 44.021 4.751 -9.569 1.00 . A X . 3 GLN HB3 1 1
3 1110 1 1 3 GLN HE21 H 41.206 2.448 -12.385 1.00 . A X . 3 GLN HE21 1 1
3 1111 1 1 3 GLN HE22 H 42.561 2.055 -13.328 1.00 . A X . 3 GLN HE22 1 1
3 1112 1 1 3 GLN HG2 H 42.315 3.129 -9.660 1.00 . A X . 3 GLN HG2 1 1
3 1113 1 1 3 GLN HG3 H 41.310 4.119 -10.723 1.00 . A X . 3 GLN HG3 1 1
3 1114 1 1 3 GLN N N 41.205 6.552 -10.020 1.00 . A X . 3 GLN N 1 1
3 1115 1 1 3 GLN NE2 N 42.172 2.495 -12.543 1.00 . A X . 3 GLN NE2 1 1
3 1116 1 1 3 GLN O O 44.114 7.546 -9.305 1.00 . A X . 3 GLN O 1 1
3 1117 1 1 3 GLN OE1 O 44.154 3.201 -11.907 1.00 . A X . 3 GLN OE1 1 1
3 1118 1 1 4 GLY C C 42.872 9.881 -6.813 1.00 . A X . 4 GLY C 1 1
3 1119 1 1 4 GLY CA C 43.628 8.557 -6.780 1.00 . A X . 4 GLY CA 1 1
3 1120 1 1 4 GLY H H 42.099 7.102 -6.969 1.00 . A X . 4 GLY H 1 1
3 1121 1 1 4 GLY HA2 H 43.810 8.275 -5.754 1.00 . A X . 4 GLY HA2 1 1
3 1122 1 1 4 GLY HA3 H 44.572 8.678 -7.290 1.00 . A X . 4 GLY HA3 1 1
3 1123 1 1 4 GLY N N 42.860 7.504 -7.437 1.00 . A X . 4 GLY N 1 1
3 1124 1 1 4 GLY O O 43.217 10.820 -6.098 1.00 . A X . 4 GLY O 1 1
3 1125 1 1 5 THR C C 39.552 10.817 -7.799 1.00 . A X . 5 THR C 1 1
3 1126 1 1 5 THR CA C 41.038 11.158 -7.766 1.00 . A X . 5 THR CA 1 1
3 1127 1 1 5 THR CB C 41.419 11.915 -9.041 1.00 . A X . 5 THR CB 1 1
3 1128 1 1 5 THR CG2 C 42.638 11.253 -9.686 1.00 . A X . 5 THR CG2 1 1
3 1129 1 1 5 THR H H 41.611 9.163 -8.192 1.00 . A X . 5 THR H 1 1
3 1130 1 1 5 THR HA H 41.232 11.792 -6.915 1.00 . A X . 5 THR HA 1 1
3 1131 1 1 5 THR HB H 41.657 12.938 -8.796 1.00 . A X . 5 THR HB 1 1
3 1132 1 1 5 THR HG1 H 39.696 12.557 -9.676 1.00 . A X . 5 THR HG1 1 1
3 1133 1 1 5 THR HG21 H 42.388 10.244 -9.978 1.00 . A X . 5 THR HG21 1 1
3 1134 1 1 5 THR HG22 H 43.451 11.229 -8.976 1.00 . A X . 5 THR HG22 1 1
3 1135 1 1 5 THR HG23 H 42.936 11.818 -10.557 1.00 . A X . 5 THR HG23 1 1
3 1136 1 1 5 THR N N 41.839 9.945 -7.648 1.00 . A X . 5 THR N 1 1
3 1137 1 1 5 THR O O 38.703 11.705 -7.879 1.00 . A X . 5 THR O 1 1
3 1138 1 1 5 THR OG1 O 40.325 11.886 -9.950 1.00 . A X . 5 THR OG1 1 1
3 1139 1 1 6 PHE C C 37.409 8.660 -6.361 1.00 . A X . 6 PHE C 1 1
3 1140 1 1 6 PHE CA C 37.860 9.073 -7.758 1.00 . A X . 6 PHE CA 1 1
3 1141 1 1 6 PHE CB C 37.714 7.887 -8.714 1.00 . A X . 6 PHE CB 1 1
3 1142 1 1 6 PHE CD1 C 36.077 6.310 -7.624 1.00 . A X . 6 PHE CD1 1 1
3 1143 1 1 6 PHE CD2 C 38.446 5.806 -7.495 1.00 . A X . 6 PHE CD2 1 1
3 1144 1 1 6 PHE CE1 C 35.792 5.150 -6.893 1.00 . A X . 6 PHE CE1 1 1
3 1145 1 1 6 PHE CE2 C 38.160 4.647 -6.765 1.00 . A X . 6 PHE CE2 1 1
3 1146 1 1 6 PHE CG C 37.405 6.637 -7.925 1.00 . A X . 6 PHE CG 1 1
3 1147 1 1 6 PHE CZ C 36.833 4.319 -6.463 1.00 . A X . 6 PHE CZ 1 1
3 1148 1 1 6 PHE H H 39.967 8.862 -7.672 1.00 . A X . 6 PHE H 1 1
3 1149 1 1 6 PHE HA H 37.233 9.880 -8.105 1.00 . A X . 6 PHE HA 1 1
3 1150 1 1 6 PHE HB2 H 36.909 8.083 -9.408 1.00 . A X . 6 PHE HB2 1 1
3 1151 1 1 6 PHE HB3 H 38.635 7.750 -9.259 1.00 . A X . 6 PHE HB3 1 1
3 1152 1 1 6 PHE HD1 H 35.274 6.951 -7.954 1.00 . A X . 6 PHE HD1 1 1
3 1153 1 1 6 PHE HD2 H 39.470 6.059 -7.728 1.00 . A X . 6 PHE HD2 1 1
3 1154 1 1 6 PHE HE1 H 34.768 4.898 -6.661 1.00 . A X . 6 PHE HE1 1 1
3 1155 1 1 6 PHE HE2 H 38.963 4.006 -6.433 1.00 . A X . 6 PHE HE2 1 1
3 1156 1 1 6 PHE HZ H 36.613 3.425 -5.899 1.00 . A X . 6 PHE HZ 1 1
3 1157 1 1 6 PHE N N 39.247 9.525 -7.736 1.00 . A X . 6 PHE N 1 1
3 1158 1 1 6 PHE O O 36.227 8.750 -6.028 1.00 . A X . 6 PHE O 1 1
3 1159 1 1 7 THR C C 37.550 8.963 -3.358 1.00 . A X . 7 THR C 1 1
3 1160 1 1 7 THR CA C 38.048 7.786 -4.188 1.00 . A X . 7 THR CA 1 1
3 1161 1 1 7 THR CB C 39.294 7.187 -3.531 1.00 . A X . 7 THR CB 1 1
3 1162 1 1 7 THR CG2 C 39.851 6.068 -4.410 1.00 . A X . 7 THR CG2 1 1
3 1163 1 1 7 THR H H 39.283 8.161 -5.868 1.00 . A X . 7 THR H 1 1
3 1164 1 1 7 THR HA H 37.277 7.030 -4.222 1.00 . A X . 7 THR HA 1 1
3 1165 1 1 7 THR HB H 39.033 6.783 -2.564 1.00 . A X . 7 THR HB 1 1
3 1166 1 1 7 THR HG1 H 41.065 7.796 -3.005 1.00 . A X . 7 THR HG1 1 1
3 1167 1 1 7 THR HG21 H 40.801 5.737 -4.015 1.00 . A X . 7 THR HG21 1 1
3 1168 1 1 7 THR HG22 H 39.989 6.435 -5.418 1.00 . A X . 7 THR HG22 1 1
3 1169 1 1 7 THR HG23 H 39.158 5.239 -4.422 1.00 . A X . 7 THR HG23 1 1
3 1170 1 1 7 THR N N 38.358 8.209 -5.547 1.00 . A X . 7 THR N 1 1
3 1171 1 1 7 THR O O 36.541 8.861 -2.659 1.00 . A X . 7 THR O 1 1
3 1172 1 1 7 THR OG1 O 40.276 8.202 -3.372 1.00 . A X . 7 THR OG1 1 1
3 1173 1 1 8 SER C C 36.371 11.480 -2.738 1.00 . A X . 8 SER C 1 1
3 1174 1 1 8 SER CA C 37.882 11.276 -2.692 1.00 . A X . 8 SER CA 1 1
3 1175 1 1 8 SER CB C 38.582 12.502 -3.277 1.00 . A X . 8 SER CB 1 1
3 1176 1 1 8 SER H H 39.057 10.106 -4.014 1.00 . A X . 8 SER H 1 1
3 1177 1 1 8 SER HA H 38.188 11.157 -1.664 1.00 . A X . 8 SER HA 1 1
3 1178 1 1 8 SER HB2 H 38.252 12.660 -4.290 1.00 . A X . 8 SER HB2 1 1
3 1179 1 1 8 SER HB3 H 38.337 13.372 -2.681 1.00 . A X . 8 SER HB3 1 1
3 1180 1 1 8 SER HG H 40.331 12.545 -4.129 1.00 . A X . 8 SER HG 1 1
3 1181 1 1 8 SER N N 38.262 10.083 -3.441 1.00 . A X . 8 SER N 1 1
3 1182 1 1 8 SER O O 35.663 11.156 -1.785 1.00 . A X . 8 SER O 1 1
3 1183 1 1 8 SER OG O 39.987 12.289 -3.269 1.00 . A X . 8 SER OG 1 1
3 1184 1 1 9 ASP C C 33.647 11.092 -3.464 1.00 . A X . 9 ASP C 1 1
3 1185 1 1 9 ASP CA C 34.457 12.262 -4.012 1.00 . A X . 9 ASP CA 1 1
3 1186 1 1 9 ASP CB C 34.125 12.465 -5.491 1.00 . A X . 9 ASP CB 1 1
3 1187 1 1 9 ASP CG C 34.002 13.954 -5.798 1.00 . A X . 9 ASP CG 1 1
3 1188 1 1 9 ASP H H 36.498 12.257 -4.578 1.00 . A X . 9 ASP H 1 1
3 1189 1 1 9 ASP HA H 34.190 13.158 -3.469 1.00 . A X . 9 ASP HA 1 1
3 1190 1 1 9 ASP HB2 H 34.914 12.039 -6.095 1.00 . A X . 9 ASP HB2 1 1
3 1191 1 1 9 ASP HB3 H 33.189 11.975 -5.720 1.00 . A X . 9 ASP HB3 1 1
3 1192 1 1 9 ASP N N 35.885 12.019 -3.852 1.00 . A X . 9 ASP N 1 1
3 1193 1 1 9 ASP O O 32.739 11.280 -2.652 1.00 . A X . 9 ASP O 1 1
3 1194 1 1 9 ASP OD1 O 34.695 14.730 -5.161 1.00 . A X . 9 ASP OD1 1 1
3 1195 1 1 9 ASP OD2 O 33.215 14.296 -6.668 1.00 . A X . 9 ASP OD2 1 1
3 1196 1 1 10 TYR C C 33.019 8.766 -1.952 1.00 . A X . 10 TYR C 1 1
3 1197 1 1 10 TYR CA C 33.276 8.692 -3.454 1.00 . A X . 10 TYR CA 1 1
3 1198 1 1 10 TYR CB C 34.101 7.442 -3.777 1.00 . A X . 10 TYR CB 1 1
3 1199 1 1 10 TYR CD1 C 33.134 6.835 -6.024 1.00 . A X . 10 TYR CD1 1 1
3 1200 1 1 10 TYR CD2 C 32.704 5.374 -4.136 1.00 . A X . 10 TYR CD2 1 1
3 1201 1 1 10 TYR CE1 C 32.381 5.990 -6.849 1.00 . A X . 10 TYR CE1 1 1
3 1202 1 1 10 TYR CE2 C 31.952 4.529 -4.962 1.00 . A X . 10 TYR CE2 1 1
3 1203 1 1 10 TYR CG C 33.296 6.527 -4.667 1.00 . A X . 10 TYR CG 1 1
3 1204 1 1 10 TYR CZ C 31.789 4.838 -6.317 1.00 . A X . 10 TYR CZ 1 1
3 1205 1 1 10 TYR H H 34.714 9.797 -4.554 1.00 . A X . 10 TYR H 1 1
3 1206 1 1 10 TYR HA H 32.327 8.628 -3.969 1.00 . A X . 10 TYR HA 1 1
3 1207 1 1 10 TYR HB2 H 35.009 7.731 -4.285 1.00 . A X . 10 TYR HB2 1 1
3 1208 1 1 10 TYR HB3 H 34.348 6.926 -2.861 1.00 . A X . 10 TYR HB3 1 1
3 1209 1 1 10 TYR HD1 H 33.589 7.724 -6.435 1.00 . A X . 10 TYR HD1 1 1
3 1210 1 1 10 TYR HD2 H 32.829 5.136 -3.090 1.00 . A X . 10 TYR HD2 1 1
3 1211 1 1 10 TYR HE1 H 32.255 6.228 -7.894 1.00 . A X . 10 TYR HE1 1 1
3 1212 1 1 10 TYR HE2 H 31.490 3.643 -4.550 1.00 . A X . 10 TYR HE2 1 1
3 1213 1 1 10 TYR HH H 31.222 3.099 -6.865 1.00 . A X . 10 TYR HH 1 1
3 1214 1 1 10 TYR N N 33.981 9.886 -3.910 1.00 . A X . 10 TYR N 1 1
3 1215 1 1 10 TYR O O 33.902 8.473 -1.146 1.00 . A X . 10 TYR O 1 1
3 1216 1 1 10 TYR OH O 31.047 4.006 -7.131 1.00 . A X . 10 TYR OH 1 1
3 1217 1 1 11 SER C C 30.106 9.996 -0.024 1.00 . A X . 11 SER C 1 1
3 1218 1 1 11 SER CA C 31.442 9.275 -0.177 1.00 . A X . 11 SER CA 1 1
3 1219 1 1 11 SER CB C 32.525 10.041 0.583 1.00 . A X . 11 SER CB 1 1
3 1220 1 1 11 SER H H 31.143 9.386 -2.271 1.00 . A X . 11 SER H 1 1
3 1221 1 1 11 SER HA H 31.356 8.284 0.244 1.00 . A X . 11 SER HA 1 1
3 1222 1 1 11 SER HB2 H 33.233 9.346 1.005 1.00 . A X . 11 SER HB2 1 1
3 1223 1 1 11 SER HB3 H 33.040 10.705 -0.100 1.00 . A X . 11 SER HB3 1 1
3 1224 1 1 11 SER HG H 32.609 11.013 2.266 1.00 . A X . 11 SER HG 1 1
3 1225 1 1 11 SER N N 31.806 9.164 -1.585 1.00 . A X . 11 SER N 1 1
3 1226 1 1 11 SER O O 29.280 9.620 0.807 1.00 . A X . 11 SER O 1 1
3 1227 1 1 11 SER OG O 31.925 10.790 1.631 1.00 . A X . 11 SER OG 1 1
3 1228 1 1 12 LYS C C 27.911 11.683 -2.107 1.00 . A X . 12 LYS C 1 1
3 1229 1 1 12 LYS CA C 28.670 11.809 -0.789 1.00 . A X . 12 LYS CA 1 1
3 1230 1 1 12 LYS CB C 28.987 13.282 -0.522 1.00 . A X . 12 LYS CB 1 1
3 1231 1 1 12 LYS CD C 29.142 14.308 1.751 1.00 . A X . 12 LYS CD 1 1
3 1232 1 1 12 LYS CE C 29.955 14.355 3.045 1.00 . A X . 12 LYS CE 1 1
3 1233 1 1 12 LYS CG C 29.844 13.398 0.740 1.00 . A X . 12 LYS CG 1 1
3 1234 1 1 12 LYS H H 30.606 11.283 -1.474 1.00 . A X . 12 LYS H 1 1
3 1235 1 1 12 LYS HA H 28.047 11.437 0.010 1.00 . A X . 12 LYS HA 1 1
3 1236 1 1 12 LYS HB2 H 29.528 13.690 -1.364 1.00 . A X . 12 LYS HB2 1 1
3 1237 1 1 12 LYS HB3 H 28.069 13.829 -0.383 1.00 . A X . 12 LYS HB3 1 1
3 1238 1 1 12 LYS HD2 H 29.059 15.304 1.340 1.00 . A X . 12 LYS HD2 1 1
3 1239 1 1 12 LYS HD3 H 28.157 13.920 1.961 1.00 . A X . 12 LYS HD3 1 1
3 1240 1 1 12 LYS HE2 H 29.357 14.796 3.830 1.00 . A X . 12 LYS HE2 1 1
3 1241 1 1 12 LYS HE3 H 30.241 13.351 3.328 1.00 . A X . 12 LYS HE3 1 1
3 1242 1 1 12 LYS HG2 H 29.983 12.418 1.172 1.00 . A X . 12 LYS HG2 1 1
3 1243 1 1 12 LYS HG3 H 30.805 13.821 0.485 1.00 . A X . 12 LYS HG3 1 1
3 1244 1 1 12 LYS HZ1 H 31.107 15.683 1.926 1.00 . A X . 12 LYS HZ1 1 1
3 1245 1 1 12 LYS HZ2 H 32.016 14.558 2.819 1.00 . A X . 12 LYS HZ2 1 1
3 1246 1 1 12 LYS HZ3 H 31.271 15.869 3.605 1.00 . A X . 12 LYS HZ3 1 1
3 1247 1 1 12 LYS N N 29.906 11.034 -0.834 1.00 . A X . 12 LYS N 1 1
3 1248 1 1 12 LYS NZ N 31.180 15.178 2.833 1.00 . A X . 12 LYS NZ 1 1
3 1249 1 1 12 LYS O O 27.650 12.678 -2.781 1.00 . A X . 12 LYS O 1 1
3 1250 1 1 13 LYS C C 26.390 8.751 -3.786 1.00 . A X . 13 LYS C 1 1
3 1251 1 1 13 LYS CA C 26.838 10.206 -3.711 1.00 . A X . 13 LYS CA 1 1
3 1252 1 1 13 LYS CB C 27.734 10.531 -4.910 1.00 . A X . 13 LYS CB 1 1
3 1253 1 1 13 LYS CD C 27.567 10.597 -7.402 1.00 . A X . 13 LYS CD 1 1
3 1254 1 1 13 LYS CE C 27.318 9.117 -7.709 1.00 . A X . 13 LYS CE 1 1
3 1255 1 1 13 LYS CG C 26.874 10.984 -6.094 1.00 . A X . 13 LYS CG 1 1
3 1256 1 1 13 LYS H H 27.801 9.695 -1.893 1.00 . A X . 13 LYS H 1 1
3 1257 1 1 13 LYS HA H 25.966 10.843 -3.740 1.00 . A X . 13 LYS HA 1 1
3 1258 1 1 13 LYS HB2 H 28.420 11.321 -4.641 1.00 . A X . 13 LYS HB2 1 1
3 1259 1 1 13 LYS HB3 H 28.292 9.652 -5.190 1.00 . A X . 13 LYS HB3 1 1
3 1260 1 1 13 LYS HD2 H 27.176 11.202 -8.206 1.00 . A X . 13 LYS HD2 1 1
3 1261 1 1 13 LYS HD3 H 28.629 10.768 -7.307 1.00 . A X . 13 LYS HD3 1 1
3 1262 1 1 13 LYS HE2 H 26.974 8.614 -6.820 1.00 . A X . 13 LYS HE2 1 1
3 1263 1 1 13 LYS HE3 H 26.566 9.035 -8.479 1.00 . A X . 13 LYS HE3 1 1
3 1264 1 1 13 LYS HG2 H 25.904 10.511 -6.042 1.00 . A X . 13 LYS HG2 1 1
3 1265 1 1 13 LYS HG3 H 26.753 12.056 -6.058 1.00 . A X . 13 LYS HG3 1 1
3 1266 1 1 13 LYS HZ1 H 28.877 7.681 -7.711 1.00 . A X . 13 LYS HZ1 1 1
3 1267 1 1 13 LYS N N 27.564 10.452 -2.469 1.00 . A X . 13 LYS N 1 1
3 1268 1 1 13 LYS NZ N 28.549 8.484 -8.167 1.00 . A X . 13 LYS NZ 1 1
3 1269 1 1 13 LYS O O 25.197 8.465 -3.895 1.00 . A X . 13 LYS O 1 1
3 1270 1 1 14 LEU C C 25.895 6.109 -2.812 1.00 . A X . 14 LEU C 1 1
3 1271 1 1 14 LEU CA C 27.030 6.414 -3.781 1.00 . A X . 14 LEU CA 1 1
3 1272 1 1 14 LEU CB C 28.247 5.540 -3.439 1.00 . A X . 14 LEU CB 1 1
3 1273 1 1 14 LEU CD1 C 29.814 7.180 -4.557 1.00 . A X . 14 LEU CD1 1 1
3 1274 1 1 14 LEU CD2 C 29.384 7.325 -2.084 1.00 . A X . 14 LEU CD2 1 1
3 1275 1 1 14 LEU CG C 29.525 6.377 -3.280 1.00 . A X . 14 LEU CG 1 1
3 1276 1 1 14 LEU H H 28.277 8.118 -3.632 1.00 . A X . 14 LEU H 1 1
3 1277 1 1 14 LEU HA H 26.707 6.175 -4.782 1.00 . A X . 14 LEU HA 1 1
3 1278 1 1 14 LEU HB2 H 28.053 5.013 -2.517 1.00 . A X . 14 LEU HB2 1 1
3 1279 1 1 14 LEU HB3 H 28.392 4.820 -4.232 1.00 . A X . 14 LEU HB3 1 1
3 1280 1 1 14 LEU HD11 H 30.733 6.832 -4.999 1.00 . A X . 14 LEU HD11 1 1
3 1281 1 1 14 LEU HD12 H 29.914 8.225 -4.311 1.00 . A X . 14 LEU HD12 1 1
3 1282 1 1 14 LEU HD13 H 29.010 7.051 -5.266 1.00 . A X . 14 LEU HD13 1 1
3 1283 1 1 14 LEU HD21 H 30.124 7.070 -1.338 1.00 . A X . 14 LEU HD21 1 1
3 1284 1 1 14 LEU HD22 H 28.397 7.224 -1.659 1.00 . A X . 14 LEU HD22 1 1
3 1285 1 1 14 LEU HD23 H 29.537 8.343 -2.408 1.00 . A X . 14 LEU HD23 1 1
3 1286 1 1 14 LEU HG H 30.351 5.708 -3.100 1.00 . A X . 14 LEU HG 1 1
3 1287 1 1 14 LEU N N 27.351 7.834 -3.723 1.00 . A X . 14 LEU N 1 1
3 1288 1 1 14 LEU O O 25.021 5.291 -3.098 1.00 . A X . 14 LEU O 1 1
3 1289 1 1 15 ASP C C 23.600 7.312 -1.122 1.00 . A X . 15 ASP C 1 1
3 1290 1 1 15 ASP CA C 24.868 6.602 -0.670 1.00 . A X . 15 ASP CA 1 1
3 1291 1 1 15 ASP CB C 25.324 7.164 0.679 1.00 . A X . 15 ASP CB 1 1
3 1292 1 1 15 ASP CG C 24.301 6.823 1.758 1.00 . A X . 15 ASP CG 1 1
3 1293 1 1 15 ASP H H 26.623 7.439 -1.504 1.00 . A X . 15 ASP H 1 1
3 1294 1 1 15 ASP HA H 24.666 5.546 -0.564 1.00 . A X . 15 ASP HA 1 1
3 1295 1 1 15 ASP HB2 H 26.281 6.733 0.942 1.00 . A X . 15 ASP HB2 1 1
3 1296 1 1 15 ASP HB3 H 25.420 8.240 0.605 1.00 . A X . 15 ASP HB3 1 1
3 1297 1 1 15 ASP N N 25.909 6.790 -1.670 1.00 . A X . 15 ASP N 1 1
3 1298 1 1 15 ASP O O 23.036 8.129 -0.397 1.00 . A X . 15 ASP O 1 1
3 1299 1 1 15 ASP OD1 O 23.284 6.240 1.419 1.00 . A X . 15 ASP OD1 1 1
3 1300 1 1 15 ASP OD2 O 24.551 7.149 2.907 1.00 . A X . 15 ASP OD2 1 1
3 1301 1 1 16 ABA C C 21.817 7.076 -4.349 1.00 . A X . 16 AIB C 1 1
3 1302 1 1 16 ABA CA C 21.985 7.593 -2.926 1.00 . A X . 16 AIB CA 1 1
3 1303 1 1 16 ABA H H 23.685 6.340 -2.864 1.00 . A X . 16 AIB H 1 1
3 1304 1 1 16 ABA N N 23.176 6.993 -2.339 1.00 . A X . 16 AIB N 1 1
3 1305 1 1 16 ABA O O 20.746 7.184 -4.944 1.00 . A X . 16 AIB O 1 1
3 1306 1 1 17 ARG C C 23.126 4.430 -6.127 1.00 . A X . 17 ARG C 1 1
3 1307 1 1 17 ARG CA C 22.879 5.929 -6.216 1.00 . A X . 17 ARG CA 1 1
3 1308 1 1 17 ARG CB C 23.967 6.580 -7.069 1.00 . A X . 17 ARG CB 1 1
3 1309 1 1 17 ARG CD C 22.353 7.878 -8.511 1.00 . A X . 17 ARG CD 1 1
3 1310 1 1 17 ARG CG C 23.516 7.979 -7.513 1.00 . A X . 17 ARG CG 1 1
3 1311 1 1 17 ARG CZ C 21.601 9.142 -10.443 1.00 . A X . 17 ARG CZ 1 1
3 1312 1 1 17 ARG H H 23.707 6.429 -4.336 1.00 . A X . 17 ARG H 1 1
3 1313 1 1 17 ARG HA H 21.914 6.103 -6.669 1.00 . A X . 17 ARG HA 1 1
3 1314 1 1 17 ARG HB2 H 24.871 6.665 -6.483 1.00 . A X . 17 ARG HB2 1 1
3 1315 1 1 17 ARG HB3 H 24.159 5.967 -7.937 1.00 . A X . 17 ARG HB3 1 1
3 1316 1 1 17 ARG HD2 H 22.256 6.861 -8.857 1.00 . A X . 17 ARG HD2 1 1
3 1317 1 1 17 ARG HD3 H 21.439 8.175 -8.021 1.00 . A X . 17 ARG HD3 1 1
3 1318 1 1 17 ARG HE H 23.509 9.054 -9.842 1.00 . A X . 17 ARG HE 1 1
3 1319 1 1 17 ARG HG2 H 23.195 8.541 -6.649 1.00 . A X . 17 ARG HG2 1 1
3 1320 1 1 17 ARG HG3 H 24.343 8.487 -7.983 1.00 . A X . 17 ARG HG3 1 1
3 1321 1 1 17 ARG HH11 H 20.196 8.145 -9.424 1.00 . A X . 17 ARG HH11 1 1
3 1322 1 1 17 ARG HH12 H 19.634 9.040 -10.796 1.00 . A X . 17 ARG HH12 1 1
3 1323 1 1 17 ARG HH21 H 22.779 10.231 -11.642 1.00 . A X . 17 ARG HH21 1 1
3 1324 1 1 17 ARG HH22 H 21.095 10.222 -12.052 1.00 . A X . 17 ARG HH22 1 1
3 1325 1 1 17 ARG N N 22.890 6.494 -4.873 1.00 . A X . 17 ARG N 1 1
3 1326 1 1 17 ARG NE N 22.598 8.750 -9.653 1.00 . A X . 17 ARG NE 1 1
3 1327 1 1 17 ARG NH1 N 20.382 8.745 -10.203 1.00 . A X . 17 ARG NH1 1 1
3 1328 1 1 17 ARG NH2 N 21.843 9.926 -11.458 1.00 . A X . 17 ARG NH2 1 1
3 1329 1 1 17 ARG O O 22.805 3.675 -7.045 1.00 . A X . 17 ARG O 1 1
3 1330 1 1 18 ARG C C 23.105 2.190 -3.554 1.00 . A X . 18 ARG C 1 1
3 1331 1 1 18 ARG CA C 23.943 2.608 -4.741 1.00 . A X . 18 ARG CA 1 1
3 1332 1 1 18 ARG CB C 25.426 2.398 -4.432 1.00 . A X . 18 ARG CB 1 1
3 1333 1 1 18 ARG CD C 26.991 0.534 -3.871 1.00 . A X . 18 ARG CD 1 1
3 1334 1 1 18 ARG CG C 25.811 0.954 -4.749 1.00 . A X . 18 ARG CG 1 1
3 1335 1 1 18 ARG CZ C 28.084 -1.563 -3.318 1.00 . A X . 18 ARG CZ 1 1
3 1336 1 1 18 ARG H H 23.883 4.668 -4.286 1.00 . A X . 18 ARG H 1 1
3 1337 1 1 18 ARG HA H 23.665 2.024 -5.606 1.00 . A X . 18 ARG HA 1 1
3 1338 1 1 18 ARG HB2 H 26.019 3.071 -5.037 1.00 . A X . 18 ARG HB2 1 1
3 1339 1 1 18 ARG HB3 H 25.606 2.597 -3.383 1.00 . A X . 18 ARG HB3 1 1
3 1340 1 1 18 ARG HD2 H 27.820 1.204 -4.043 1.00 . A X . 18 ARG HD2 1 1
3 1341 1 1 18 ARG HD3 H 26.699 0.589 -2.832 1.00 . A X . 18 ARG HD3 1 1
3 1342 1 1 18 ARG HE H 27.167 -1.209 -5.062 1.00 . A X . 18 ARG HE 1 1
3 1343 1 1 18 ARG HG2 H 24.968 0.307 -4.554 1.00 . A X . 18 ARG HG2 1 1
3 1344 1 1 18 ARG HG3 H 26.093 0.877 -5.787 1.00 . A X . 18 ARG HG3 1 1
3 1345 1 1 18 ARG HH11 H 28.127 -0.133 -1.916 1.00 . A X . 18 ARG HH11 1 1
3 1346 1 1 18 ARG HH12 H 28.915 -1.619 -1.498 1.00 . A X . 18 ARG HH12 1 1
3 1347 1 1 18 ARG HH21 H 28.197 -3.160 -4.520 1.00 . A X . 18 ARG HH21 1 1
3 1348 1 1 18 ARG HH22 H 28.954 -3.331 -2.972 1.00 . A X . 18 ARG HH22 1 1
3 1349 1 1 18 ARG N N 23.675 4.013 -4.992 1.00 . A X . 18 ARG N 1 1
3 1350 1 1 18 ARG NE N 27.400 -0.829 -4.190 1.00 . A X . 18 ARG NE 1 1
3 1351 1 1 18 ARG NH1 N 28.400 -1.065 -2.154 1.00 . A X . 18 ARG NH1 1 1
3 1352 1 1 18 ARG NH2 N 28.440 -2.779 -3.628 1.00 . A X . 18 ARG NH2 1 1
3 1353 1 1 18 ARG O O 23.229 1.086 -3.024 1.00 . A X . 18 ARG O 1 1
3 1354 1 1 19 ALA C C 19.925 3.096 -2.433 1.00 . A X . 19 ALA C 1 1
3 1355 1 1 19 ALA CA C 21.376 2.923 -2.011 1.00 . A X . 19 ALA CA 1 1
3 1356 1 1 19 ALA CB C 21.728 3.948 -0.940 1.00 . A X . 19 ALA CB 1 1
3 1357 1 1 19 ALA H H 22.229 3.978 -3.617 1.00 . A X . 19 ALA H 1 1
3 1358 1 1 19 ALA HA H 21.520 1.933 -1.612 1.00 . A X . 19 ALA HA 1 1
3 1359 1 1 19 ALA HB1 H 20.830 4.461 -0.624 1.00 . A X . 19 ALA HB1 1 1
3 1360 1 1 19 ALA HB2 H 22.428 4.665 -1.357 1.00 . A X . 19 ALA HB2 1 1
3 1361 1 1 19 ALA HB3 H 22.178 3.450 -0.096 1.00 . A X . 19 ALA HB3 1 1
3 1362 1 1 19 ALA N N 22.255 3.121 -3.144 1.00 . A X . 19 ALA N 1 1
3 1363 1 1 19 ALA O O 19.047 2.354 -1.992 1.00 . A X . 19 ALA O 1 1
3 1364 1 1 20 GLN C C 17.847 3.186 -4.651 1.00 . A X . 20 GLN C 1 1
3 1365 1 1 20 GLN CA C 18.323 4.334 -3.771 1.00 . A X . 20 GLN CA 1 1
3 1366 1 1 20 GLN CB C 18.283 5.641 -4.565 1.00 . A X . 20 GLN CB 1 1
3 1367 1 1 20 GLN CD C 16.773 7.324 -5.637 1.00 . A X . 20 GLN CD 1 1
3 1368 1 1 20 GLN CG C 16.830 6.005 -4.872 1.00 . A X . 20 GLN CG 1 1
3 1369 1 1 20 GLN H H 20.419 4.637 -3.618 1.00 . A X . 20 GLN H 1 1
3 1370 1 1 20 GLN HA H 17.664 4.421 -2.921 1.00 . A X . 20 GLN HA 1 1
3 1371 1 1 20 GLN HB2 H 18.736 6.428 -3.982 1.00 . A X . 20 GLN HB2 1 1
3 1372 1 1 20 GLN HB3 H 18.825 5.518 -5.491 1.00 . A X . 20 GLN HB3 1 1
3 1373 1 1 20 GLN HE21 H 16.253 8.392 -4.045 1.00 . A X . 20 GLN HE21 1 1
3 1374 1 1 20 GLN HE22 H 16.416 9.272 -5.487 1.00 . A X . 20 GLN HE22 1 1
3 1375 1 1 20 GLN HG2 H 16.384 5.224 -5.472 1.00 . A X . 20 GLN HG2 1 1
3 1376 1 1 20 GLN HG3 H 16.282 6.105 -3.947 1.00 . A X . 20 GLN HG3 1 1
3 1377 1 1 20 GLN N N 19.677 4.079 -3.295 1.00 . A X . 20 GLN N 1 1
3 1378 1 1 20 GLN NE2 N 16.455 8.420 -5.004 1.00 . A X . 20 GLN NE2 1 1
3 1379 1 1 20 GLN O O 16.981 2.406 -4.256 1.00 . A X . 20 GLN O 1 1
3 1380 1 1 20 GLN OE1 O 17.028 7.357 -6.840 1.00 . A X . 20 GLN OE1 1 1
3 1381 1 1 21 ASP C C 18.027 0.680 -6.044 1.00 . A X . 21 ASP C 1 1
3 1382 1 1 21 ASP CA C 18.053 2.022 -6.768 1.00 . A X . 21 ASP CA 1 1
3 1383 1 1 21 ASP CB C 19.055 1.965 -7.923 1.00 . A X . 21 ASP CB 1 1
3 1384 1 1 21 ASP CG C 18.315 1.974 -9.256 1.00 . A X . 21 ASP CG 1 1
3 1385 1 1 21 ASP H H 19.111 3.732 -6.105 1.00 . A X . 21 ASP H 1 1
3 1386 1 1 21 ASP HA H 17.071 2.226 -7.166 1.00 . A X . 21 ASP HA 1 1
3 1387 1 1 21 ASP HB2 H 19.711 2.824 -7.871 1.00 . A X . 21 ASP HB2 1 1
3 1388 1 1 21 ASP HB3 H 19.640 1.059 -7.847 1.00 . A X . 21 ASP HB3 1 1
3 1389 1 1 21 ASP N N 18.423 3.085 -5.844 1.00 . A X . 21 ASP N 1 1
3 1390 1 1 21 ASP O O 17.277 -0.223 -6.413 1.00 . A X . 21 ASP O 1 1
3 1391 1 1 21 ASP OD1 O 17.480 2.845 -9.441 1.00 . A X . 21 ASP OD1 1 1
3 1392 1 1 21 ASP OD2 O 18.593 1.112 -10.073 1.00 . A X . 21 ASP OD2 1 1
3 1393 1 1 22 PHE C C 17.793 -0.740 -3.217 1.00 . A X . 22 PHE C 1 1
3 1394 1 1 22 PHE CA C 18.927 -0.669 -4.236 1.00 . A X . 22 PHE CA 1 1
3 1395 1 1 22 PHE CB C 20.271 -0.745 -3.514 1.00 . A X . 22 PHE CB 1 1
3 1396 1 1 22 PHE CD1 C 20.771 -3.112 -4.163 1.00 . A X . 22 PHE CD1 1 1
3 1397 1 1 22 PHE CD2 C 20.534 -2.580 -1.813 1.00 . A X . 22 PHE CD2 1 1
3 1398 1 1 22 PHE CE1 C 21.003 -4.447 -3.841 1.00 . A X . 22 PHE CE1 1 1
3 1399 1 1 22 PHE CE2 C 20.770 -3.919 -1.487 1.00 . A X . 22 PHE CE2 1 1
3 1400 1 1 22 PHE CG C 20.537 -2.179 -3.152 1.00 . A X . 22 PHE CG 1 1
3 1401 1 1 22 PHE CZ C 21.003 -4.854 -2.501 1.00 . A X . 22 PHE CZ 1 1
3 1402 1 1 22 PHE H H 19.430 1.312 -4.765 1.00 . A X . 22 PHE H 1 1
3 1403 1 1 22 PHE HA H 18.848 -1.515 -4.906 1.00 . A X . 22 PHE HA 1 1
3 1404 1 1 22 PHE HB2 H 21.052 -0.383 -4.167 1.00 . A X . 22 PHE HB2 1 1
3 1405 1 1 22 PHE HB3 H 20.236 -0.144 -2.616 1.00 . A X . 22 PHE HB3 1 1
3 1406 1 1 22 PHE HD1 H 20.774 -2.799 -5.198 1.00 . A X . 22 PHE HD1 1 1
3 1407 1 1 22 PHE HD2 H 20.354 -1.857 -1.030 1.00 . A X . 22 PHE HD2 1 1
3 1408 1 1 22 PHE HE1 H 21.179 -5.162 -4.625 1.00 . A X . 22 PHE HE1 1 1
3 1409 1 1 22 PHE HE2 H 20.768 -4.229 -0.454 1.00 . A X . 22 PHE HE2 1 1
3 1410 1 1 22 PHE HZ H 21.184 -5.891 -2.251 1.00 . A X . 22 PHE HZ 1 1
3 1411 1 1 22 PHE N N 18.855 0.560 -5.010 1.00 . A X . 22 PHE N 1 1
3 1412 1 1 22 PHE O O 16.845 -1.504 -3.385 1.00 . A X . 22 PHE O 1 1
3 1413 1 1 23 VAL C C 15.491 0.322 -1.711 1.00 . A X . 23 VAL C 1 1
3 1414 1 1 23 VAL CA C 16.874 0.065 -1.118 1.00 . A X . 23 VAL CA 1 1
3 1415 1 1 23 VAL CB C 17.189 1.140 -0.077 1.00 . A X . 23 VAL CB 1 1
3 1416 1 1 23 VAL CG1 C 16.107 1.137 1.007 1.00 . A X . 23 VAL CG1 1 1
3 1417 1 1 23 VAL CG2 C 18.549 0.849 0.562 1.00 . A X . 23 VAL CG2 1 1
3 1418 1 1 23 VAL H H 18.676 0.646 -2.072 1.00 . A X . 23 VAL H 1 1
3 1419 1 1 23 VAL HA H 16.872 -0.895 -0.631 1.00 . A X . 23 VAL HA 1 1
3 1420 1 1 23 VAL HB H 17.213 2.108 -0.555 1.00 . A X . 23 VAL HB 1 1
3 1421 1 1 23 VAL HG11 H 15.646 0.162 1.058 1.00 . A X . 23 VAL HG11 1 1
3 1422 1 1 23 VAL HG12 H 15.357 1.878 0.769 1.00 . A X . 23 VAL HG12 1 1
3 1423 1 1 23 VAL HG13 H 16.554 1.373 1.962 1.00 . A X . 23 VAL HG13 1 1
3 1424 1 1 23 VAL HG21 H 19.242 0.522 -0.201 1.00 . A X . 23 VAL HG21 1 1
3 1425 1 1 23 VAL HG22 H 18.440 0.072 1.304 1.00 . A X . 23 VAL HG22 1 1
3 1426 1 1 23 VAL HG23 H 18.927 1.745 1.030 1.00 . A X . 23 VAL HG23 1 1
3 1427 1 1 23 VAL N N 17.897 0.058 -2.158 1.00 . A X . 23 VAL N 1 1
3 1428 1 1 23 VAL O O 14.492 0.329 -0.992 1.00 . A X . 23 VAL O 1 1
3 1429 1 1 24 GLN C C 13.435 -0.509 -3.964 1.00 . A X . 24 GLN C 1 1
3 1430 1 1 24 GLN CA C 14.171 0.796 -3.689 1.00 . A X . 24 GLN CA 1 1
3 1431 1 1 24 GLN CB C 14.432 1.558 -4.996 1.00 . A X . 24 GLN CB 1 1
3 1432 1 1 24 GLN CD C 13.460 0.074 -6.776 1.00 . A X . 24 GLN CD 1 1
3 1433 1 1 24 GLN CG C 13.270 1.362 -5.976 1.00 . A X . 24 GLN CG 1 1
3 1434 1 1 24 GLN H H 16.257 0.523 -3.547 1.00 . A X . 24 GLN H 1 1
3 1435 1 1 24 GLN HA H 13.557 1.405 -3.044 1.00 . A X . 24 GLN HA 1 1
3 1436 1 1 24 GLN HB2 H 14.540 2.611 -4.777 1.00 . A X . 24 GLN HB2 1 1
3 1437 1 1 24 GLN HB3 H 15.345 1.192 -5.446 1.00 . A X . 24 GLN HB3 1 1
3 1438 1 1 24 GLN HE21 H 14.969 -0.583 -5.662 1.00 . A X . 24 GLN HE21 1 1
3 1439 1 1 24 GLN HE22 H 14.516 -1.601 -6.944 1.00 . A X . 24 GLN HE22 1 1
3 1440 1 1 24 GLN HG2 H 12.340 1.317 -5.431 1.00 . A X . 24 GLN HG2 1 1
3 1441 1 1 24 GLN HG3 H 13.241 2.200 -6.657 1.00 . A X . 24 GLN HG3 1 1
3 1442 1 1 24 GLN N N 15.436 0.536 -3.021 1.00 . A X . 24 GLN N 1 1
3 1443 1 1 24 GLN NE2 N 14.392 -0.773 -6.433 1.00 . A X . 24 GLN NE2 1 1
3 1444 1 1 24 GLN O O 12.205 -0.539 -4.011 1.00 . A X . 24 GLN O 1 1
3 1445 1 1 24 GLN OE1 O 12.737 -0.166 -7.743 1.00 . A X . 24 GLN OE1 1 1
3 1446 1 1 25 TRP C C 13.526 -3.666 -3.077 1.00 . A X . 25 TRP C 1 1
3 1447 1 1 25 TRP CA C 13.567 -2.885 -4.370 1.00 . A X . 25 TRP CA 1 1
3 1448 1 1 25 TRP CB C 14.363 -3.681 -5.382 1.00 . A X . 25 TRP CB 1 1
3 1449 1 1 25 TRP CD1 C 13.720 -6.077 -5.014 1.00 . A X . 25 TRP CD1 1 1
3 1450 1 1 25 TRP CD2 C 15.587 -5.499 -3.924 1.00 . A X . 25 TRP CD2 1 1
3 1451 1 1 25 TRP CE2 C 15.367 -6.860 -3.628 1.00 . A X . 25 TRP CE2 1 1
3 1452 1 1 25 TRP CE3 C 16.695 -4.866 -3.366 1.00 . A X . 25 TRP CE3 1 1
3 1453 1 1 25 TRP CG C 14.547 -5.039 -4.815 1.00 . A X . 25 TRP CG 1 1
3 1454 1 1 25 TRP CH2 C 17.343 -6.912 -2.241 1.00 . A X . 25 TRP CH2 1 1
3 1455 1 1 25 TRP CZ2 C 16.237 -7.567 -2.791 1.00 . A X . 25 TRP CZ2 1 1
3 1456 1 1 25 TRP CZ3 C 17.567 -5.560 -2.531 1.00 . A X . 25 TRP CZ3 1 1
3 1457 1 1 25 TRP H H 15.167 -1.531 -4.058 1.00 . A X . 25 TRP H 1 1
3 1458 1 1 25 TRP HA H 12.563 -2.756 -4.739 1.00 . A X . 25 TRP HA 1 1
3 1459 1 1 25 TRP HB2 H 13.819 -3.738 -6.315 1.00 . A X . 25 TRP HB2 1 1
3 1460 1 1 25 TRP HB3 H 15.327 -3.217 -5.541 1.00 . A X . 25 TRP HB3 1 1
3 1461 1 1 25 TRP HD1 H 12.828 -6.050 -5.622 1.00 . A X . 25 TRP HD1 1 1
3 1462 1 1 25 TRP HE1 H 13.801 -8.067 -4.305 1.00 . A X . 25 TRP HE1 1 1
3 1463 1 1 25 TRP HE3 H 16.869 -3.830 -3.567 1.00 . A X . 25 TRP HE3 1 1
3 1464 1 1 25 TRP HH2 H 18.023 -7.446 -1.593 1.00 . A X . 25 TRP HH2 1 1
3 1465 1 1 25 TRP HZ2 H 16.055 -8.604 -2.564 1.00 . A X . 25 TRP HZ2 1 1
3 1466 1 1 25 TRP HZ3 H 18.414 -5.046 -2.110 1.00 . A X . 25 TRP HZ3 1 1
3 1467 1 1 25 TRP N N 14.184 -1.594 -4.126 1.00 . A X . 25 TRP N 1 1
3 1468 1 1 25 TRP NE1 N 14.209 -7.174 -4.319 1.00 . A X . 25 TRP NE1 1 1
3 1469 1 1 25 TRP O O 12.547 -4.349 -2.774 1.00 . A X . 25 TRP O 1 1
3 1470 1 1 26 LEU C C 13.398 -4.075 -0.273 1.00 . A X . 26 LEU C 1 1
3 1471 1 1 26 LEU CA C 14.692 -4.271 -1.057 1.00 . A X . 26 LEU CA 1 1
3 1472 1 1 26 LEU CB C 15.878 -3.763 -0.232 1.00 . A X . 26 LEU CB 1 1
3 1473 1 1 26 LEU CD1 C 16.845 -5.944 0.627 1.00 . A X . 26 LEU CD1 1 1
3 1474 1 1 26 LEU CD2 C 16.902 -3.890 2.046 1.00 . A X . 26 LEU CD2 1 1
3 1475 1 1 26 LEU CG C 16.089 -4.660 1.004 1.00 . A X . 26 LEU CG 1 1
3 1476 1 1 26 LEU H H 15.360 -3.009 -2.611 1.00 . A X . 26 LEU H 1 1
3 1477 1 1 26 LEU HA H 14.834 -5.315 -1.272 1.00 . A X . 26 LEU HA 1 1
3 1478 1 1 26 LEU HB2 H 16.766 -3.765 -0.841 1.00 . A X . 26 LEU HB2 1 1
3 1479 1 1 26 LEU HB3 H 15.673 -2.755 0.095 1.00 . A X . 26 LEU HB3 1 1
3 1480 1 1 26 LEU HD11 H 16.200 -6.596 0.052 1.00 . A X . 26 LEU HD11 1 1
3 1481 1 1 26 LEU HD12 H 17.154 -6.452 1.528 1.00 . A X . 26 LEU HD12 1 1
3 1482 1 1 26 LEU HD13 H 17.717 -5.693 0.045 1.00 . A X . 26 LEU HD13 1 1
3 1483 1 1 26 LEU HD21 H 16.371 -2.990 2.324 1.00 . A X . 26 LEU HD21 1 1
3 1484 1 1 26 LEU HD22 H 17.863 -3.627 1.631 1.00 . A X . 26 LEU HD22 1 1
3 1485 1 1 26 LEU HD23 H 17.044 -4.507 2.921 1.00 . A X . 26 LEU HD23 1 1
3 1486 1 1 26 LEU HG H 15.131 -4.925 1.427 1.00 . A X . 26 LEU HG 1 1
3 1487 1 1 26 LEU N N 14.608 -3.565 -2.316 1.00 . A X . 26 LEU N 1 1
3 1488 1 1 26 LEU O O 12.927 -4.987 0.408 1.00 . A X . 26 LEU O 1 1
3 1489 1 1 27 MET C C 10.389 -2.774 -0.567 1.00 . A X . 27 MET C 1 1
3 1490 1 1 27 MET CA C 11.596 -2.563 0.340 1.00 . A X . 27 MET CA 1 1
3 1491 1 1 27 MET CB C 11.626 -1.115 0.837 1.00 . A X . 27 MET CB 1 1
3 1492 1 1 27 MET CE C 10.138 1.849 0.797 1.00 . A X . 27 MET CE 1 1
3 1493 1 1 27 MET CG C 11.566 -0.154 -0.352 1.00 . A X . 27 MET CG 1 1
3 1494 1 1 27 MET H H 13.256 -2.178 -0.927 1.00 . A X . 27 MET H 1 1
3 1495 1 1 27 MET HA H 11.511 -3.221 1.191 1.00 . A X . 27 MET HA 1 1
3 1496 1 1 27 MET HB2 H 10.780 -0.941 1.486 1.00 . A X . 27 MET HB2 1 1
3 1497 1 1 27 MET HB3 H 12.543 -0.944 1.388 1.00 . A X . 27 MET HB3 1 1
3 1498 1 1 27 MET HE1 H 10.830 2.594 0.431 1.00 . A X . 27 MET HE1 1 1
3 1499 1 1 27 MET HE2 H 10.536 1.404 1.696 1.00 . A X . 27 MET HE2 1 1
3 1500 1 1 27 MET HE3 H 9.186 2.310 1.017 1.00 . A X . 27 MET HE3 1 1
3 1501 1 1 27 MET HG2 H 12.292 0.634 -0.216 1.00 . A X . 27 MET HG2 1 1
3 1502 1 1 27 MET HG3 H 11.784 -0.693 -1.265 1.00 . A X . 27 MET HG3 1 1
3 1503 1 1 27 MET N N 12.833 -2.872 -0.370 1.00 . A X . 27 MET N 1 1
3 1504 1 1 27 MET O O 10.453 -3.529 -1.538 1.00 . A X . 27 MET O 1 1
3 1505 1 1 27 MET SD S 9.910 0.569 -0.461 1.00 . A X . 27 MET SD 1 1
3 1506 1 1 28 ASN C C 7.592 -3.675 -1.067 1.00 . A X . 28 ASN C 1 1
3 1507 1 1 28 ASN CA C 8.069 -2.226 -1.037 1.00 . A X . 28 ASN CA 1 1
3 1508 1 1 28 ASN CB C 8.324 -1.742 -2.467 1.00 . A X . 28 ASN CB 1 1
3 1509 1 1 28 ASN CG C 7.091 -1.022 -2.999 1.00 . A X . 28 ASN CG 1 1
3 1510 1 1 28 ASN H H 9.295 -1.518 0.540 1.00 . A X . 28 ASN H 1 1
3 1511 1 1 28 ASN HA H 7.300 -1.613 -0.594 1.00 . A X . 28 ASN HA 1 1
3 1512 1 1 28 ASN HB2 H 9.165 -1.064 -2.470 1.00 . A X . 28 ASN HB2 1 1
3 1513 1 1 28 ASN HB3 H 8.543 -2.589 -3.098 1.00 . A X . 28 ASN HB3 1 1
3 1514 1 1 28 ASN HD21 H 7.671 0.763 -2.349 1.00 . A X . 28 ASN HD21 1 1
3 1515 1 1 28 ASN HD22 H 6.181 0.736 -3.162 1.00 . A X . 28 ASN HD22 1 1
3 1516 1 1 28 ASN N N 9.288 -2.105 -0.244 1.00 . A X . 28 ASN N 1 1
3 1517 1 1 28 ASN ND2 N 6.971 0.266 -2.822 1.00 . A X . 28 ASN ND2 1 1
3 1518 1 1 28 ASN O O 6.606 -4.001 -1.727 1.00 . A X . 28 ASN O 1 1
3 1519 1 1 28 ASN OD1 O 6.213 -1.648 -3.592 1.00 . A X . 28 ASN OD1 1 1
3 1520 1 1 29 THR C C 6.892 -6.202 0.781 1.00 . A X . 29 THR C 1 1
3 1521 1 1 29 THR CA C 7.940 -5.953 -0.299 1.00 . A X . 29 THR CA 1 1
3 1522 1 1 29 THR CB C 9.181 -6.800 -0.011 1.00 . A X . 29 THR CB 1 1
3 1523 1 1 29 THR CG2 C 10.016 -6.934 -1.286 1.00 . A X . 29 THR CG2 1 1
3 1524 1 1 29 THR H H 9.077 -4.224 0.160 1.00 . A X . 29 THR H 1 1
3 1525 1 1 29 THR HA H 7.533 -6.244 -1.255 1.00 . A X . 29 THR HA 1 1
3 1526 1 1 29 THR HB H 8.881 -7.781 0.321 1.00 . A X . 29 THR HB 1 1
3 1527 1 1 29 THR HG1 H 9.497 -5.374 1.274 1.00 . A X . 29 THR HG1 1 1
3 1528 1 1 29 THR HG21 H 11.060 -7.026 -1.026 1.00 . A X . 29 THR HG21 1 1
3 1529 1 1 29 THR HG22 H 9.874 -6.059 -1.904 1.00 . A X . 29 THR HG22 1 1
3 1530 1 1 29 THR HG23 H 9.703 -7.813 -1.831 1.00 . A X . 29 THR HG23 1 1
3 1531 1 1 29 THR N N 8.300 -4.541 -0.348 1.00 . A X . 29 THR N 1 1
3 1532 1 1 29 THR O O 5.696 -6.266 0.490 1.00 . A X . 29 THR O 1 1
3 1533 1 1 29 THR OG1 O 9.957 -6.171 1.000 1.00 . A X . 29 THR OG1 1 1
3 1534 1 1 30 NH2 HN1 H 8.221 -6.295 2.253 1.00 . A X . 30 NH2 HN1 1 1
3 1535 1 1 30 NH2 HN2 H 6.604 -6.507 2.722 1.00 . A X . 30 NH2 HN2 1 1
3 1536 1 1 30 NH2 N N 7.270 -6.347 2.021 1.00 . A X . 30 NH2 N 1 1
3 1537 2 2 1 . C C 33.367 10.683 -8.809 1.00 . B X . 101 GGL C 1 1
3 1538 2 2 1 . CA C 32.071 11.488 -8.834 1.00 . B X . 101 GGL CA 1 1
3 1539 2 2 1 . CB C 31.000 10.711 -9.607 1.00 . B X . 101 GGL CB 1 1
3 1540 2 2 1 . CD C 29.241 8.983 -9.185 1.00 . B X . 101 GGL CD 1 1
3 1541 2 2 1 . CG C 30.676 9.399 -8.884 1.00 . B X . 101 GGL CG 1 1
3 1542 2 2 1 . H H 32.573 13.546 -8.893 1.00 . B X . 101 GGL H 1 1
3 1543 2 2 1 . HA H 31.731 11.639 -7.821 1.00 . B X . 101 GGL HA 1 1
3 1544 2 2 1 . HB2 H 31.364 10.488 -10.600 1.00 . B X . 101 GGL HB2 1 1
3 1545 2 2 1 . HB3 H 30.104 11.310 -9.681 1.00 . B X . 101 GGL HB3 1 1
3 1546 2 2 1 . HG2 H 31.350 8.627 -9.224 1.00 . B X . 101 GGL HG2 1 1
3 1547 2 2 1 . HG3 H 30.791 9.531 -7.818 1.00 . B X . 101 GGL HG3 1 1
3 1548 2 2 1 . N N 32.290 12.792 -9.452 1.00 . B X . 101 GGL N 1 1
3 1549 2 2 1 . O O 34.313 11.144 -8.192 1.00 . B X . 101 GGL O 1 1
3 1550 2 2 1 . OE1 O 28.764 9.136 -10.310 1.00 . B X . 101 GGL OE1 1 1
3 1551 2 2 1 . OXT O 33.434 9.689 -9.511 1.00 . B X . 101 GGL OXT 1 1
3 1552 3 2 1 . C C 31.482 17.163 -10.812 1.00 . C X . 102 GGL C 1 1
3 1553 3 2 1 . CA C 31.648 15.649 -10.741 1.00 . C X . 102 GGL CA 1 1
3 1554 3 2 1 . CB C 32.657 15.196 -11.802 1.00 . C X . 102 GGL CB 1 1
3 1555 3 2 1 . CD C 32.110 12.980 -10.756 1.00 . C X . 102 GGL CD 1 1
3 1556 3 2 1 . CG C 33.184 13.797 -11.466 1.00 . C X . 102 GGL CG 1 1
3 1557 3 2 1 . H H 30.022 14.884 -11.867 1.00 . C X . 102 GGL H 1 1
3 1558 3 2 1 . HA H 32.023 15.383 -9.764 1.00 . C X . 102 GGL HA 1 1
3 1559 3 2 1 . HB2 H 32.175 15.176 -12.768 1.00 . C X . 102 GGL HB2 1 1
3 1560 3 2 1 . HB3 H 33.484 15.892 -11.829 1.00 . C X . 102 GGL HB3 1 1
3 1561 3 2 1 . HG2 H 33.467 13.295 -12.380 1.00 . C X . 102 GGL HG2 1 1
3 1562 3 2 1 . HG3 H 34.049 13.885 -10.825 1.00 . C X . 102 GGL HG3 1 1
3 1563 3 2 1 . N N 30.365 14.986 -10.955 1.00 . C X . 102 GGL N 1 1
3 1564 3 2 1 . O O 31.979 17.835 -9.925 1.00 . C X . 102 GGL O 1 1
3 1565 3 2 1 . OE1 O 31.058 12.697 -11.331 1.00 . C X . 102 GGL OE1 1 1
3 1566 3 2 1 . OXT O 30.831 17.624 -11.734 1.00 . C X . 102 GGL OXT 1 1
3 1567 4 3 1 PLM C1 C 29.654 14.518 -9.934 1.00 . D X . 103 PLM C1 1 1
3 1568 4 3 1 PLM C2 C 28.201 14.972 -9.864 1.00 . D X . 103 PLM C2 1 1
3 1569 4 3 1 PLM C3 C 27.456 14.544 -11.131 1.00 . D X . 103 PLM C3 1 1
3 1570 4 3 1 PLM C4 C 27.512 13.019 -11.269 1.00 . D X . 103 PLM C4 1 1
3 1571 4 3 1 PLM C5 C 26.235 12.524 -11.952 1.00 . D X . 103 PLM C5 1 1
3 1572 4 3 1 PLM C6 C 26.507 11.182 -12.634 1.00 . D X . 103 PLM C6 1 1
3 1573 4 3 1 PLM C7 C 25.236 10.329 -12.598 1.00 . D X . 103 PLM C7 1 1
3 1574 4 3 1 PLM C8 C 25.424 9.087 -13.476 1.00 . D X . 103 PLM C8 1 1
3 1575 4 3 1 PLM C9 C 25.116 7.825 -12.659 1.00 . D X . 103 PLM C9 1 1
3 1576 4 3 1 PLM CA C 26.151 7.653 -11.540 1.00 . D X . 103 PLM CA 1 1
3 1577 4 3 1 PLM CB C 26.497 6.168 -11.389 1.00 . D X . 103 PLM CB 1 1
3 1578 4 3 1 PLM CC C 27.528 5.989 -10.270 1.00 . D X . 103 PLM CC 1 1
3 1579 4 3 1 PLM CD C 26.812 5.841 -8.925 1.00 . D X . 103 PLM CD 1 1
3 1580 4 3 1 PLM CE C 27.849 5.658 -7.810 1.00 . D X . 103 PLM CE 1 1
3 1581 4 3 1 PLM CF C 27.874 4.198 -7.342 1.00 . D X . 103 PLM CF 1 1
3 1582 4 3 1 PLM CG C 28.385 3.300 -8.473 1.00 . D X . 103 PLM CG 1 1
3 1583 4 3 1 PLM H21 H 27.727 14.526 -9.001 1.00 . D X . 103 PLM H21 1 1
3 1584 4 3 1 PLM H22 H 28.166 16.048 -9.775 1.00 . D X . 103 PLM H22 1 1
3 1585 4 3 1 PLM H31 H 26.426 14.862 -11.067 1.00 . D X . 103 PLM H31 1 1
3 1586 4 3 1 PLM H32 H 27.921 15.000 -11.992 1.00 . D X . 103 PLM H32 1 1
3 1587 4 3 1 PLM H41 H 27.595 12.573 -10.290 1.00 . D X . 103 PLM H41 1 1
3 1588 4 3 1 PLM H42 H 28.369 12.744 -11.866 1.00 . D X . 103 PLM H42 1 1
3 1589 4 3 1 PLM H51 H 25.457 12.401 -11.211 1.00 . D X . 103 PLM H51 1 1
3 1590 4 3 1 PLM H52 H 25.918 13.245 -12.689 1.00 . D X . 103 PLM H52 1 1
3 1591 4 3 1 PLM H61 H 27.302 10.668 -12.115 1.00 . D X . 103 PLM H61 1 1
3 1592 4 3 1 PLM H62 H 26.797 11.353 -13.660 1.00 . D X . 103 PLM H62 1 1
3 1593 4 3 1 PLM H71 H 25.037 10.024 -11.582 1.00 . D X . 103 PLM H71 1 1
3 1594 4 3 1 PLM H72 H 24.404 10.908 -12.970 1.00 . D X . 103 PLM H72 1 1
3 1595 4 3 1 PLM H81 H 26.441 9.048 -13.838 1.00 . D X . 103 PLM H81 1 1
3 1596 4 3 1 PLM H82 H 24.748 9.141 -14.317 1.00 . D X . 103 PLM H82 1 1
3 1597 4 3 1 PLM H91 H 24.131 7.913 -12.225 1.00 . D X . 103 PLM H91 1 1
3 1598 4 3 1 PLM H92 H 25.143 6.964 -13.311 1.00 . D X . 103 PLM H92 1 1
3 1599 4 3 1 PLM HA1 H 27.046 8.207 -11.779 1.00 . D X . 103 PLM HA1 1 1
3 1600 4 3 1 PLM HA2 H 25.739 8.020 -10.612 1.00 . D X . 103 PLM HA2 1 1
3 1601 4 3 1 PLM HB1 H 26.908 5.798 -12.317 1.00 . D X . 103 PLM HB1 1 1
3 1602 4 3 1 PLM HB2 H 25.602 5.614 -11.146 1.00 . D X . 103 PLM HB2 1 1
3 1603 4 3 1 PLM HC1 H 28.117 5.104 -10.464 1.00 . D X . 103 PLM HC1 1 1
3 1604 4 3 1 PLM HC2 H 28.177 6.850 -10.240 1.00 . D X . 103 PLM HC2 1 1
3 1605 4 3 1 PLM HD1 H 26.230 6.728 -8.729 1.00 . D X . 103 PLM HD1 1 1
3 1606 4 3 1 PLM HD2 H 26.157 4.984 -8.959 1.00 . D X . 103 PLM HD2 1 1
3 1607 4 3 1 PLM HE1 H 27.593 6.293 -6.974 1.00 . D X . 103 PLM HE1 1 1
3 1608 4 3 1 PLM HE2 H 28.826 5.931 -8.180 1.00 . D X . 103 PLM HE2 1 1
3 1609 4 3 1 PLM HF1 H 28.533 4.109 -6.491 1.00 . D X . 103 PLM HF1 1 1
3 1610 4 3 1 PLM HF2 H 26.879 3.891 -7.059 1.00 . D X . 103 PLM HF2 1 1
3 1611 4 3 1 PLM HG1 H 27.612 3.181 -9.218 1.00 . D X . 103 PLM HG1 1 1
3 1612 4 3 1 PLM HG2 H 29.255 3.752 -8.927 1.00 . D X . 103 PLM HG2 1 1
3 1613 4 3 1 PLM HG3 H 28.650 2.333 -8.072 1.00 . D X . 103 PLM HG3 1 1
3 1614 4 3 1 PLM O2 O 30.148 13.843 -9.029 1.00 . D X . 103 PLM O2 1 1
4 1615 1 1 1 HIS C C 39.850 20.553 -9.823 1.00 . A X . 1 HIS C 1 1
4 1616 1 1 1 HIS CA C 41.047 20.999 -10.657 1.00 . A X . 1 HIS CA 1 1
4 1617 1 1 1 HIS CB C 42.258 21.229 -9.751 1.00 . A X . 1 HIS CB 1 1
4 1618 1 1 1 HIS CD2 C 44.285 20.461 -11.236 1.00 . A X . 1 HIS CD2 1 1
4 1619 1 1 1 HIS CE1 C 44.770 18.630 -10.185 1.00 . A X . 1 HIS CE1 1 1
4 1620 1 1 1 HIS CG C 43.393 20.349 -10.198 1.00 . A X . 1 HIS CG 1 1
4 1621 1 1 1 HIS H1 H 39.986 22.081 -12.084 1.00 . A X . 1 HIS H1 1 1
4 1622 1 1 1 HIS H2 H 41.567 22.642 -11.825 1.00 . A X . 1 HIS H2 1 1
4 1623 1 1 1 HIS H3 H 40.350 22.961 -10.681 1.00 . A X . 1 HIS H3 1 1
4 1624 1 1 1 HIS HA H 41.282 20.235 -11.382 1.00 . A X . 1 HIS HA 1 1
4 1625 1 1 1 HIS HB2 H 42.560 22.266 -9.809 1.00 . A X . 1 HIS HB2 1 1
4 1626 1 1 1 HIS HB3 H 41.996 20.985 -8.729 1.00 . A X . 1 HIS HB3 1 1
4 1627 1 1 1 HIS HD2 H 44.310 21.270 -11.951 1.00 . A X . 1 HIS HD2 1 1
4 1628 1 1 1 HIS HE1 H 45.245 17.704 -9.895 1.00 . A X . 1 HIS HE1 1 1
4 1629 1 1 1 HIS HE2 H 45.889 19.195 -11.847 1.00 . A X . 1 HIS HE2 1 1
4 1630 1 1 1 HIS N N 40.712 22.266 -11.365 1.00 . A X . 1 HIS N 1 1
4 1631 1 1 1 HIS ND1 N 43.721 19.174 -9.542 1.00 . A X . 1 HIS ND1 1 1
4 1632 1 1 1 HIS NE2 N 45.155 19.376 -11.225 1.00 . A X . 1 HIS NE2 1 1
4 1633 1 1 1 HIS O O 39.248 21.355 -9.107 1.00 . A X . 1 HIS O 1 1
4 1634 1 1 2 ABA C C 37.091 19.435 -9.576 1.00 . A X . 2 AIB C 1 1
4 1635 1 1 2 ABA CA C 38.382 18.732 -9.171 1.00 . A X . 2 AIB CA 1 1
4 1636 1 1 2 ABA H H 40.025 18.682 -10.509 1.00 . A X . 2 AIB H 1 1
4 1637 1 1 2 ABA N N 39.510 19.273 -9.921 1.00 . A X . 2 AIB N 1 1
4 1638 1 1 2 ABA O O 36.997 20.661 -9.518 1.00 . A X . 2 AIB O 1 1
4 1639 1 1 3 GLN C C 34.057 19.708 -9.148 1.00 . A X . 3 GLN C 1 1
4 1640 1 1 3 GLN CA C 34.811 19.217 -10.379 1.00 . A X . 3 GLN CA 1 1
4 1641 1 1 3 GLN CB C 33.985 18.168 -11.135 1.00 . A X . 3 GLN CB 1 1
4 1642 1 1 3 GLN CD C 32.455 20.058 -11.722 1.00 . A X . 3 GLN CD 1 1
4 1643 1 1 3 GLN CG C 33.210 18.850 -12.264 1.00 . A X . 3 GLN CG 1 1
4 1644 1 1 3 GLN H H 36.223 17.681 -10.001 1.00 . A X . 3 GLN H 1 1
4 1645 1 1 3 GLN HA H 34.987 20.052 -11.029 1.00 . A X . 3 GLN HA 1 1
4 1646 1 1 3 GLN HB2 H 34.646 17.424 -11.553 1.00 . A X . 3 GLN HB2 1 1
4 1647 1 1 3 GLN HB3 H 33.291 17.694 -10.461 1.00 . A X . 3 GLN HB3 1 1
4 1648 1 1 3 GLN HE21 H 33.533 21.376 -12.742 1.00 . A X . 3 GLN HE21 1 1
4 1649 1 1 3 GLN HE22 H 32.314 22.039 -11.762 1.00 . A X . 3 GLN HE22 1 1
4 1650 1 1 3 GLN HG2 H 33.902 19.175 -13.029 1.00 . A X . 3 GLN HG2 1 1
4 1651 1 1 3 GLN HG3 H 32.505 18.150 -12.689 1.00 . A X . 3 GLN HG3 1 1
4 1652 1 1 3 GLN N N 36.094 18.652 -9.979 1.00 . A X . 3 GLN N 1 1
4 1653 1 1 3 GLN NE2 N 32.795 21.257 -12.108 1.00 . A X . 3 GLN NE2 1 1
4 1654 1 1 3 GLN O O 32.862 19.456 -8.989 1.00 . A X . 3 GLN O 1 1
4 1655 1 1 3 GLN OE1 O 31.528 19.906 -10.924 1.00 . A X . 3 GLN OE1 1 1
4 1656 1 1 4 GLY C C 34.375 19.912 -5.927 1.00 . A X . 4 GLY C 1 1
4 1657 1 1 4 GLY CA C 34.193 20.922 -7.049 1.00 . A X . 4 GLY CA 1 1
4 1658 1 1 4 GLY H H 35.727 20.564 -8.458 1.00 . A X . 4 GLY H 1 1
4 1659 1 1 4 GLY HA2 H 34.682 21.850 -6.784 1.00 . A X . 4 GLY HA2 1 1
4 1660 1 1 4 GLY HA3 H 33.140 21.100 -7.199 1.00 . A X . 4 GLY HA3 1 1
4 1661 1 1 4 GLY N N 34.779 20.405 -8.276 1.00 . A X . 4 GLY N 1 1
4 1662 1 1 4 GLY O O 33.420 19.551 -5.240 1.00 . A X . 4 GLY O 1 1
4 1663 1 1 5 THR C C 34.943 17.285 -4.883 1.00 . A X . 5 THR C 1 1
4 1664 1 1 5 THR CA C 35.901 18.450 -4.732 1.00 . A X . 5 THR CA 1 1
4 1665 1 1 5 THR CB C 35.752 19.069 -3.342 1.00 . A X . 5 THR CB 1 1
4 1666 1 1 5 THR CG2 C 36.010 20.571 -3.425 1.00 . A X . 5 THR CG2 1 1
4 1667 1 1 5 THR H H 36.330 19.753 -6.347 1.00 . A X . 5 THR H 1 1
4 1668 1 1 5 THR HA H 36.914 18.097 -4.856 1.00 . A X . 5 THR HA 1 1
4 1669 1 1 5 THR HB H 36.466 18.622 -2.668 1.00 . A X . 5 THR HB 1 1
4 1670 1 1 5 THR HG1 H 34.233 19.515 -2.210 1.00 . A X . 5 THR HG1 1 1
4 1671 1 1 5 THR HG21 H 36.784 20.764 -4.155 1.00 . A X . 5 THR HG21 1 1
4 1672 1 1 5 THR HG22 H 36.327 20.937 -2.459 1.00 . A X . 5 THR HG22 1 1
4 1673 1 1 5 THR HG23 H 35.102 21.075 -3.720 1.00 . A X . 5 THR HG23 1 1
4 1674 1 1 5 THR N N 35.611 19.440 -5.761 1.00 . A X . 5 THR N 1 1
4 1675 1 1 5 THR O O 34.795 16.454 -3.988 1.00 . A X . 5 THR O 1 1
4 1676 1 1 5 THR OG1 O 34.435 18.838 -2.861 1.00 . A X . 5 THR OG1 1 1
4 1677 1 1 6 PHE C C 33.923 14.825 -6.068 1.00 . A X . 6 PHE C 1 1
4 1678 1 1 6 PHE CA C 33.325 16.204 -6.333 1.00 . A X . 6 PHE CA 1 1
4 1679 1 1 6 PHE CB C 32.890 16.318 -7.797 1.00 . A X . 6 PHE CB 1 1
4 1680 1 1 6 PHE CD1 C 32.899 13.950 -8.660 1.00 . A X . 6 PHE CD1 1 1
4 1681 1 1 6 PHE CD2 C 34.697 15.439 -9.317 1.00 . A X . 6 PHE CD2 1 1
4 1682 1 1 6 PHE CE1 C 33.475 12.922 -9.417 1.00 . A X . 6 PHE CE1 1 1
4 1683 1 1 6 PHE CE2 C 35.271 14.412 -10.075 1.00 . A X . 6 PHE CE2 1 1
4 1684 1 1 6 PHE CG C 33.511 15.209 -8.609 1.00 . A X . 6 PHE CG 1 1
4 1685 1 1 6 PHE CZ C 34.660 13.153 -10.125 1.00 . A X . 6 PHE CZ 1 1
4 1686 1 1 6 PHE H H 34.451 17.947 -6.701 1.00 . A X . 6 PHE H 1 1
4 1687 1 1 6 PHE HA H 32.464 16.341 -5.701 1.00 . A X . 6 PHE HA 1 1
4 1688 1 1 6 PHE HB2 H 31.813 16.251 -7.860 1.00 . A X . 6 PHE HB2 1 1
4 1689 1 1 6 PHE HB3 H 33.213 17.274 -8.190 1.00 . A X . 6 PHE HB3 1 1
4 1690 1 1 6 PHE HD1 H 31.985 13.772 -8.115 1.00 . A X . 6 PHE HD1 1 1
4 1691 1 1 6 PHE HD2 H 35.168 16.411 -9.278 1.00 . A X . 6 PHE HD2 1 1
4 1692 1 1 6 PHE HE1 H 33.003 11.952 -9.455 1.00 . A X . 6 PHE HE1 1 1
4 1693 1 1 6 PHE HE2 H 36.186 14.591 -10.621 1.00 . A X . 6 PHE HE2 1 1
4 1694 1 1 6 PHE HZ H 35.104 12.360 -10.709 1.00 . A X . 6 PHE HZ 1 1
4 1695 1 1 6 PHE N N 34.287 17.247 -6.035 1.00 . A X . 6 PHE N 1 1
4 1696 1 1 6 PHE O O 33.214 13.820 -6.063 1.00 . A X . 6 PHE O 1 1
4 1697 1 1 7 THR C C 35.763 13.139 -4.102 1.00 . A X . 7 THR C 1 1
4 1698 1 1 7 THR CA C 35.915 13.525 -5.570 1.00 . A X . 7 THR CA 1 1
4 1699 1 1 7 THR CB C 37.402 13.650 -5.914 1.00 . A X . 7 THR CB 1 1
4 1700 1 1 7 THR CG2 C 37.571 13.757 -7.431 1.00 . A X . 7 THR CG2 1 1
4 1701 1 1 7 THR H H 35.749 15.620 -5.851 1.00 . A X . 7 THR H 1 1
4 1702 1 1 7 THR HA H 35.479 12.752 -6.183 1.00 . A X . 7 THR HA 1 1
4 1703 1 1 7 THR HB H 37.928 12.778 -5.558 1.00 . A X . 7 THR HB 1 1
4 1704 1 1 7 THR HG1 H 38.876 14.839 -5.472 1.00 . A X . 7 THR HG1 1 1
4 1705 1 1 7 THR HG21 H 36.605 13.907 -7.890 1.00 . A X . 7 THR HG21 1 1
4 1706 1 1 7 THR HG22 H 38.012 12.847 -7.808 1.00 . A X . 7 THR HG22 1 1
4 1707 1 1 7 THR HG23 H 38.214 14.593 -7.663 1.00 . A X . 7 THR HG23 1 1
4 1708 1 1 7 THR N N 35.233 14.787 -5.841 1.00 . A X . 7 THR N 1 1
4 1709 1 1 7 THR O O 35.315 12.038 -3.785 1.00 . A X . 7 THR O 1 1
4 1710 1 1 7 THR OG1 O 37.934 14.813 -5.293 1.00 . A X . 7 THR OG1 1 1
4 1711 1 1 8 SER C C 34.587 13.839 -1.327 1.00 . A X . 8 SER C 1 1
4 1712 1 1 8 SER CA C 36.042 13.794 -1.781 1.00 . A X . 8 SER CA 1 1
4 1713 1 1 8 SER CB C 36.851 14.836 -1.007 1.00 . A X . 8 SER CB 1 1
4 1714 1 1 8 SER H H 36.490 14.912 -3.524 1.00 . A X . 8 SER H 1 1
4 1715 1 1 8 SER HA H 36.445 12.814 -1.572 1.00 . A X . 8 SER HA 1 1
4 1716 1 1 8 SER HB2 H 36.182 15.512 -0.504 1.00 . A X . 8 SER HB2 1 1
4 1717 1 1 8 SER HB3 H 37.471 14.336 -0.275 1.00 . A X . 8 SER HB3 1 1
4 1718 1 1 8 SER HG H 38.542 15.643 -1.534 1.00 . A X . 8 SER HG 1 1
4 1719 1 1 8 SER N N 36.141 14.052 -3.213 1.00 . A X . 8 SER N 1 1
4 1720 1 1 8 SER O O 34.257 13.405 -0.224 1.00 . A X . 8 SER O 1 1
4 1721 1 1 8 SER OG O 37.663 15.568 -1.915 1.00 . A X . 8 SER OG 1 1
4 1722 1 1 9 ASP C C 31.513 13.365 -2.571 1.00 . A X . 9 ASP C 1 1
4 1723 1 1 9 ASP CA C 32.301 14.462 -1.863 1.00 . A X . 9 ASP CA 1 1
4 1724 1 1 9 ASP CB C 31.762 15.831 -2.282 1.00 . A X . 9 ASP CB 1 1
4 1725 1 1 9 ASP CG C 30.647 16.264 -1.335 1.00 . A X . 9 ASP CG 1 1
4 1726 1 1 9 ASP H H 34.040 14.696 -3.052 1.00 . A X . 9 ASP H 1 1
4 1727 1 1 9 ASP HA H 32.176 14.350 -0.796 1.00 . A X . 9 ASP HA 1 1
4 1728 1 1 9 ASP HB2 H 32.563 16.557 -2.250 1.00 . A X . 9 ASP HB2 1 1
4 1729 1 1 9 ASP HB3 H 31.371 15.769 -3.288 1.00 . A X . 9 ASP HB3 1 1
4 1730 1 1 9 ASP N N 33.719 14.366 -2.187 1.00 . A X . 9 ASP N 1 1
4 1731 1 1 9 ASP O O 30.312 13.500 -2.802 1.00 . A X . 9 ASP O 1 1
4 1732 1 1 9 ASP OD1 O 30.942 16.494 -0.173 1.00 . A X . 9 ASP OD1 1 1
4 1733 1 1 9 ASP OD2 O 29.517 16.358 -1.784 1.00 . A X . 9 ASP OD2 1 1
4 1734 1 1 10 TYR C C 30.959 10.187 -2.582 1.00 . A X . 10 TYR C 1 1
4 1735 1 1 10 TYR CA C 31.549 11.163 -3.594 1.00 . A X . 10 TYR CA 1 1
4 1736 1 1 10 TYR CB C 32.557 10.433 -4.484 1.00 . A X . 10 TYR CB 1 1
4 1737 1 1 10 TYR CD1 C 31.663 10.885 -6.795 1.00 . A X . 10 TYR CD1 1 1
4 1738 1 1 10 TYR CD2 C 31.447 8.651 -5.879 1.00 . A X . 10 TYR CD2 1 1
4 1739 1 1 10 TYR CE1 C 31.029 10.466 -7.970 1.00 . A X . 10 TYR CE1 1 1
4 1740 1 1 10 TYR CE2 C 30.811 8.231 -7.054 1.00 . A X . 10 TYR CE2 1 1
4 1741 1 1 10 TYR CG C 31.873 9.978 -5.750 1.00 . A X . 10 TYR CG 1 1
4 1742 1 1 10 TYR CZ C 30.602 9.138 -8.099 1.00 . A X . 10 TYR CZ 1 1
4 1743 1 1 10 TYR H H 33.154 12.223 -2.704 1.00 . A X . 10 TYR H 1 1
4 1744 1 1 10 TYR HA H 30.753 11.547 -4.214 1.00 . A X . 10 TYR HA 1 1
4 1745 1 1 10 TYR HB2 H 33.369 11.102 -4.733 1.00 . A X . 10 TYR HB2 1 1
4 1746 1 1 10 TYR HB3 H 32.946 9.575 -3.957 1.00 . A X . 10 TYR HB3 1 1
4 1747 1 1 10 TYR HD1 H 31.993 11.908 -6.695 1.00 . A X . 10 TYR HD1 1 1
4 1748 1 1 10 TYR HD2 H 31.608 7.952 -5.072 1.00 . A X . 10 TYR HD2 1 1
4 1749 1 1 10 TYR HE1 H 30.868 11.167 -8.776 1.00 . A X . 10 TYR HE1 1 1
4 1750 1 1 10 TYR HE2 H 30.481 7.207 -7.153 1.00 . A X . 10 TYR HE2 1 1
4 1751 1 1 10 TYR HH H 30.013 9.446 -9.888 1.00 . A X . 10 TYR HH 1 1
4 1752 1 1 10 TYR N N 32.198 12.277 -2.914 1.00 . A X . 10 TYR N 1 1
4 1753 1 1 10 TYR O O 30.108 9.364 -2.922 1.00 . A X . 10 TYR O 1 1
4 1754 1 1 10 TYR OH O 29.976 8.724 -9.257 1.00 . A X . 10 TYR OH 1 1
4 1755 1 1 11 SER C C 29.406 9.472 -0.194 1.00 . A X . 11 SER C 1 1
4 1756 1 1 11 SER CA C 30.928 9.402 -0.285 1.00 . A X . 11 SER CA 1 1
4 1757 1 1 11 SER CB C 31.538 9.804 1.058 1.00 . A X . 11 SER CB 1 1
4 1758 1 1 11 SER H H 32.096 10.957 -1.127 1.00 . A X . 11 SER H 1 1
4 1759 1 1 11 SER HA H 31.219 8.388 -0.511 1.00 . A X . 11 SER HA 1 1
4 1760 1 1 11 SER HB2 H 31.295 9.065 1.803 1.00 . A X . 11 SER HB2 1 1
4 1761 1 1 11 SER HB3 H 32.613 9.868 0.957 1.00 . A X . 11 SER HB3 1 1
4 1762 1 1 11 SER HG H 30.927 11.611 0.673 1.00 . A X . 11 SER HG 1 1
4 1763 1 1 11 SER N N 31.417 10.282 -1.339 1.00 . A X . 11 SER N 1 1
4 1764 1 1 11 SER O O 28.782 8.698 0.532 1.00 . A X . 11 SER O 1 1
4 1765 1 1 11 SER OG O 31.010 11.061 1.456 1.00 . A X . 11 SER OG 1 1
4 1766 1 1 12 LYS C C 26.748 9.878 -2.147 1.00 . A X . 12 LYS C 1 1
4 1767 1 1 12 LYS CA C 27.367 10.564 -0.933 1.00 . A X . 12 LYS CA 1 1
4 1768 1 1 12 LYS CB C 27.006 12.050 -0.945 1.00 . A X . 12 LYS CB 1 1
4 1769 1 1 12 LYS CD C 26.217 13.049 1.206 1.00 . A X . 12 LYS CD 1 1
4 1770 1 1 12 LYS CE C 26.660 13.699 2.517 1.00 . A X . 12 LYS CE 1 1
4 1771 1 1 12 LYS CG C 27.449 12.695 0.369 1.00 . A X . 12 LYS CG 1 1
4 1772 1 1 12 LYS H H 29.364 10.990 -1.497 1.00 . A X . 12 LYS H 1 1
4 1773 1 1 12 LYS HA H 26.967 10.116 -0.035 1.00 . A X . 12 LYS HA 1 1
4 1774 1 1 12 LYS HB2 H 27.508 12.534 -1.771 1.00 . A X . 12 LYS HB2 1 1
4 1775 1 1 12 LYS HB3 H 25.939 12.161 -1.057 1.00 . A X . 12 LYS HB3 1 1
4 1776 1 1 12 LYS HD2 H 25.593 13.737 0.652 1.00 . A X . 12 LYS HD2 1 1
4 1777 1 1 12 LYS HD3 H 25.658 12.150 1.422 1.00 . A X . 12 LYS HD3 1 1
4 1778 1 1 12 LYS HE2 H 25.891 13.560 3.265 1.00 . A X . 12 LYS HE2 1 1
4 1779 1 1 12 LYS HE3 H 27.579 13.243 2.854 1.00 . A X . 12 LYS HE3 1 1
4 1780 1 1 12 LYS HG2 H 28.069 12.001 0.919 1.00 . A X . 12 LYS HG2 1 1
4 1781 1 1 12 LYS HG3 H 28.010 13.592 0.161 1.00 . A X . 12 LYS HG3 1 1
4 1782 1 1 12 LYS HZ1 H 27.501 15.295 1.477 1.00 . A X . 12 LYS HZ1 1 1
4 1783 1 1 12 LYS HZ2 H 27.323 15.571 3.143 1.00 . A X . 12 LYS HZ2 1 1
4 1784 1 1 12 LYS HZ3 H 25.967 15.623 2.120 1.00 . A X . 12 LYS HZ3 1 1
4 1785 1 1 12 LYS N N 28.816 10.403 -0.937 1.00 . A X . 12 LYS N 1 1
4 1786 1 1 12 LYS NZ N 26.879 15.157 2.297 1.00 . A X . 12 LYS NZ 1 1
4 1787 1 1 12 LYS O O 25.668 9.293 -2.058 1.00 . A X . 12 LYS O 1 1
4 1788 1 1 13 LYS C C 26.411 7.937 -4.221 1.00 . A X . 13 LYS C 1 1
4 1789 1 1 13 LYS CA C 26.946 9.337 -4.506 1.00 . A X . 13 LYS CA 1 1
4 1790 1 1 13 LYS CB C 28.072 9.266 -5.543 1.00 . A X . 13 LYS CB 1 1
4 1791 1 1 13 LYS CD C 27.400 10.073 -7.814 1.00 . A X . 13 LYS CD 1 1
4 1792 1 1 13 LYS CE C 26.835 9.651 -9.171 1.00 . A X . 13 LYS CE 1 1
4 1793 1 1 13 LYS CG C 27.502 8.850 -6.902 1.00 . A X . 13 LYS CG 1 1
4 1794 1 1 13 LYS H H 28.293 10.435 -3.293 1.00 . A X . 13 LYS H 1 1
4 1795 1 1 13 LYS HA H 26.144 9.941 -4.903 1.00 . A X . 13 LYS HA 1 1
4 1796 1 1 13 LYS HB2 H 28.539 10.236 -5.631 1.00 . A X . 13 LYS HB2 1 1
4 1797 1 1 13 LYS HB3 H 28.806 8.543 -5.228 1.00 . A X . 13 LYS HB3 1 1
4 1798 1 1 13 LYS HD2 H 26.746 10.805 -7.362 1.00 . A X . 13 LYS HD2 1 1
4 1799 1 1 13 LYS HD3 H 28.380 10.502 -7.954 1.00 . A X . 13 LYS HD3 1 1
4 1800 1 1 13 LYS HE2 H 26.856 8.576 -9.249 1.00 . A X . 13 LYS HE2 1 1
4 1801 1 1 13 LYS HE3 H 25.814 9.995 -9.255 1.00 . A X . 13 LYS HE3 1 1
4 1802 1 1 13 LYS HG2 H 28.155 8.117 -7.355 1.00 . A X . 13 LYS HG2 1 1
4 1803 1 1 13 LYS HG3 H 26.521 8.421 -6.768 1.00 . A X . 13 LYS HG3 1 1
4 1804 1 1 13 LYS HZ1 H 28.483 10.662 -10.040 1.00 . A X . 13 LYS HZ1 1 1
4 1805 1 1 13 LYS N N 27.438 9.956 -3.281 1.00 . A X . 13 LYS N 1 1
4 1806 1 1 13 LYS NZ N 27.631 10.226 -10.250 1.00 . A X . 13 LYS NZ 1 1
4 1807 1 1 13 LYS O O 25.201 7.739 -4.116 1.00 . A X . 13 LYS O 1 1
4 1808 1 1 14 LEU C C 25.802 5.569 -2.797 1.00 . A X . 14 LEU C 1 1
4 1809 1 1 14 LEU CA C 26.916 5.593 -3.833 1.00 . A X . 14 LEU CA 1 1
4 1810 1 1 14 LEU CB C 28.095 4.749 -3.325 1.00 . A X . 14 LEU CB 1 1
4 1811 1 1 14 LEU CD1 C 30.567 4.599 -3.007 1.00 . A X . 14 LEU CD1 1 1
4 1812 1 1 14 LEU CD2 C 29.654 5.474 -5.154 1.00 . A X . 14 LEU CD2 1 1
4 1813 1 1 14 LEU CG C 29.440 5.419 -3.639 1.00 . A X . 14 LEU CG 1 1
4 1814 1 1 14 LEU H H 28.266 7.186 -4.203 1.00 . A X . 14 LEU H 1 1
4 1815 1 1 14 LEU HA H 26.547 5.157 -4.750 1.00 . A X . 14 LEU HA 1 1
4 1816 1 1 14 LEU HB2 H 28.004 4.619 -2.257 1.00 . A X . 14 LEU HB2 1 1
4 1817 1 1 14 LEU HB3 H 28.064 3.780 -3.803 1.00 . A X . 14 LEU HB3 1 1
4 1818 1 1 14 LEU HD11 H 30.155 3.702 -2.565 1.00 . A X . 14 LEU HD11 1 1
4 1819 1 1 14 LEU HD12 H 31.054 5.185 -2.243 1.00 . A X . 14 LEU HD12 1 1
4 1820 1 1 14 LEU HD13 H 31.284 4.328 -3.767 1.00 . A X . 14 LEU HD13 1 1
4 1821 1 1 14 LEU HD21 H 30.688 5.702 -5.364 1.00 . A X . 14 LEU HD21 1 1
4 1822 1 1 14 LEU HD22 H 29.023 6.235 -5.586 1.00 . A X . 14 LEU HD22 1 1
4 1823 1 1 14 LEU HD23 H 29.405 4.516 -5.586 1.00 . A X . 14 LEU HD23 1 1
4 1824 1 1 14 LEU HG H 29.459 6.417 -3.226 1.00 . A X . 14 LEU HG 1 1
4 1825 1 1 14 LEU N N 27.319 6.971 -4.103 1.00 . A X . 14 LEU N 1 1
4 1826 1 1 14 LEU O O 24.799 4.874 -2.965 1.00 . A X . 14 LEU O 1 1
4 1827 1 1 15 ASP C C 23.775 7.211 -1.150 1.00 . A X . 15 ASP C 1 1
4 1828 1 1 15 ASP CA C 24.975 6.399 -0.674 1.00 . A X . 15 ASP CA 1 1
4 1829 1 1 15 ASP CB C 25.567 7.040 0.583 1.00 . A X . 15 ASP CB 1 1
4 1830 1 1 15 ASP CG C 24.638 6.811 1.769 1.00 . A X . 15 ASP CG 1 1
4 1831 1 1 15 ASP H H 26.795 6.872 -1.648 1.00 . A X . 15 ASP H 1 1
4 1832 1 1 15 ASP HA H 24.650 5.397 -0.440 1.00 . A X . 15 ASP HA 1 1
4 1833 1 1 15 ASP HB2 H 26.531 6.595 0.790 1.00 . A X . 15 ASP HB2 1 1
4 1834 1 1 15 ASP HB3 H 25.687 8.102 0.421 1.00 . A X . 15 ASP HB3 1 1
4 1835 1 1 15 ASP N N 25.979 6.336 -1.728 1.00 . A X . 15 ASP N 1 1
4 1836 1 1 15 ASP O O 23.278 8.084 -0.438 1.00 . A X . 15 ASP O 1 1
4 1837 1 1 15 ASP OD1 O 24.097 5.723 1.873 1.00 . A X . 15 ASP OD1 1 1
4 1838 1 1 15 ASP OD2 O 24.481 7.728 2.559 1.00 . A X . 15 ASP OD2 1 1
4 1839 1 1 16 ABA C C 21.972 7.082 -4.375 1.00 . A X . 16 AIB C 1 1
4 1840 1 1 16 ABA CA C 22.191 7.606 -2.963 1.00 . A X . 16 AIB CA 1 1
4 1841 1 1 16 ABA H H 23.778 6.211 -2.878 1.00 . A X . 16 AIB H 1 1
4 1842 1 1 16 ABA N N 23.328 6.914 -2.365 1.00 . A X . 16 AIB N 1 1
4 1843 1 1 16 ABA O O 20.865 7.136 -4.908 1.00 . A X . 16 AIB O 1 1
4 1844 1 1 17 ARG C C 23.183 4.494 -6.228 1.00 . A X . 17 ARG C 1 1
4 1845 1 1 17 ARG CA C 22.980 5.999 -6.304 1.00 . A X . 17 ARG CA 1 1
4 1846 1 1 17 ARG CB C 24.063 6.623 -7.182 1.00 . A X . 17 ARG CB 1 1
4 1847 1 1 17 ARG CD C 22.671 8.034 -8.713 1.00 . A X . 17 ARG CD 1 1
4 1848 1 1 17 ARG CG C 23.540 6.776 -8.613 1.00 . A X . 17 ARG CG 1 1
4 1849 1 1 17 ARG CZ C 23.551 9.306 -10.588 1.00 . A X . 17 ARG CZ 1 1
4 1850 1 1 17 ARG H H 23.892 6.537 -4.475 1.00 . A X . 17 ARG H 1 1
4 1851 1 1 17 ARG HA H 22.013 6.205 -6.734 1.00 . A X . 17 ARG HA 1 1
4 1852 1 1 17 ARG HB2 H 24.329 7.592 -6.784 1.00 . A X . 17 ARG HB2 1 1
4 1853 1 1 17 ARG HB3 H 24.933 5.983 -7.184 1.00 . A X . 17 ARG HB3 1 1
4 1854 1 1 17 ARG HD2 H 21.826 7.832 -9.352 1.00 . A X . 17 ARG HD2 1 1
4 1855 1 1 17 ARG HD3 H 22.317 8.305 -7.728 1.00 . A X . 17 ARG HD3 1 1
4 1856 1 1 17 ARG HE H 23.891 9.766 -8.668 1.00 . A X . 17 ARG HE 1 1
4 1857 1 1 17 ARG HG2 H 24.375 6.860 -9.292 1.00 . A X . 17 ARG HG2 1 1
4 1858 1 1 17 ARG HG3 H 22.950 5.912 -8.874 1.00 . A X . 17 ARG HG3 1 1
4 1859 1 1 17 ARG HH11 H 22.434 7.707 -11.042 1.00 . A X . 17 ARG HH11 1 1
4 1860 1 1 17 ARG HH12 H 23.046 8.604 -12.392 1.00 . A X . 17 ARG HH12 1 1
4 1861 1 1 17 ARG HH21 H 24.696 10.942 -10.436 1.00 . A X . 17 ARG HH21 1 1
4 1862 1 1 17 ARG HH22 H 24.325 10.433 -12.049 1.00 . A X . 17 ARG HH22 1 1
4 1863 1 1 17 ARG N N 23.042 6.559 -4.962 1.00 . A X . 17 ARG N 1 1
4 1864 1 1 17 ARG NE N 23.445 9.138 -9.273 1.00 . A X . 17 ARG NE 1 1
4 1865 1 1 17 ARG NH1 N 22.963 8.474 -11.404 1.00 . A X . 17 ARG NH1 1 1
4 1866 1 1 17 ARG NH2 N 24.244 10.305 -11.061 1.00 . A X . 17 ARG NH2 1 1
4 1867 1 1 17 ARG O O 22.929 3.765 -7.187 1.00 . A X . 17 ARG O 1 1
4 1868 1 1 18 ARG C C 22.983 2.224 -3.632 1.00 . A X . 18 ARG C 1 1
4 1869 1 1 18 ARG CA C 23.838 2.625 -4.816 1.00 . A X . 18 ARG CA 1 1
4 1870 1 1 18 ARG CB C 25.314 2.365 -4.504 1.00 . A X . 18 ARG CB 1 1
4 1871 1 1 18 ARG CD C 26.552 0.413 -3.552 1.00 . A X . 18 ARG CD 1 1
4 1872 1 1 18 ARG CG C 25.615 0.876 -4.669 1.00 . A X . 18 ARG CG 1 1
4 1873 1 1 18 ARG CZ C 28.794 0.806 -4.398 1.00 . A X . 18 ARG CZ 1 1
4 1874 1 1 18 ARG H H 23.783 4.675 -4.325 1.00 . A X . 18 ARG H 1 1
4 1875 1 1 18 ARG HA H 23.545 2.057 -5.686 1.00 . A X . 18 ARG HA 1 1
4 1876 1 1 18 ARG HB2 H 25.931 2.935 -5.185 1.00 . A X . 18 ARG HB2 1 1
4 1877 1 1 18 ARG HB3 H 25.525 2.665 -3.485 1.00 . A X . 18 ARG HB3 1 1
4 1878 1 1 18 ARG HD2 H 26.075 0.568 -2.597 1.00 . A X . 18 ARG HD2 1 1
4 1879 1 1 18 ARG HD3 H 26.765 -0.640 -3.678 1.00 . A X . 18 ARG HD3 1 1
4 1880 1 1 18 ARG HE H 27.908 1.951 -3.016 1.00 . A X . 18 ARG HE 1 1
4 1881 1 1 18 ARG HG2 H 24.692 0.316 -4.620 1.00 . A X . 18 ARG HG2 1 1
4 1882 1 1 18 ARG HG3 H 26.086 0.709 -5.625 1.00 . A X . 18 ARG HG3 1 1
4 1883 1 1 18 ARG HH11 H 27.810 -0.759 -5.164 1.00 . A X . 18 ARG HH11 1 1
4 1884 1 1 18 ARG HH12 H 29.408 -0.507 -5.778 1.00 . A X . 18 ARG HH12 1 1
4 1885 1 1 18 ARG HH21 H 30.007 2.289 -3.818 1.00 . A X . 18 ARG HH21 1 1
4 1886 1 1 18 ARG HH22 H 30.652 1.220 -5.017 1.00 . A X . 18 ARG HH22 1 1
4 1887 1 1 18 ARG N N 23.621 4.039 -5.058 1.00 . A X . 18 ARG N 1 1
4 1888 1 1 18 ARG NE N 27.800 1.167 -3.593 1.00 . A X . 18 ARG NE 1 1
4 1889 1 1 18 ARG NH1 N 28.661 -0.235 -5.174 1.00 . A X . 18 ARG NH1 1 1
4 1890 1 1 18 ARG NH2 N 29.904 1.491 -4.412 1.00 . A X . 18 ARG NH2 1 1
4 1891 1 1 18 ARG O O 23.035 1.096 -3.144 1.00 . A X . 18 ARG O 1 1
4 1892 1 1 19 ALA C C 19.875 3.227 -2.460 1.00 . A X . 19 ALA C 1 1
4 1893 1 1 19 ALA CA C 21.323 3.011 -2.044 1.00 . A X . 19 ALA CA 1 1
4 1894 1 1 19 ALA CB C 21.705 4.014 -0.961 1.00 . A X . 19 ALA CB 1 1
4 1895 1 1 19 ALA H H 22.231 4.070 -3.619 1.00 . A X . 19 ALA H 1 1
4 1896 1 1 19 ALA HA H 21.440 2.014 -1.655 1.00 . A X . 19 ALA HA 1 1
4 1897 1 1 19 ALA HB1 H 20.813 4.498 -0.588 1.00 . A X . 19 ALA HB1 1 1
4 1898 1 1 19 ALA HB2 H 22.371 4.756 -1.388 1.00 . A X . 19 ALA HB2 1 1
4 1899 1 1 19 ALA HB3 H 22.204 3.501 -0.154 1.00 . A X . 19 ALA HB3 1 1
4 1900 1 1 19 ALA N N 22.204 3.195 -3.178 1.00 . A X . 19 ALA N 1 1
4 1901 1 1 19 ALA O O 18.967 2.574 -1.946 1.00 . A X . 19 ALA O 1 1
4 1902 1 1 20 GLN C C 17.834 3.327 -4.800 1.00 . A X . 20 GLN C 1 1
4 1903 1 1 20 GLN CA C 18.318 4.437 -3.875 1.00 . A X . 20 GLN CA 1 1
4 1904 1 1 20 GLN CB C 18.300 5.773 -4.619 1.00 . A X . 20 GLN CB 1 1
4 1905 1 1 20 GLN CD C 16.822 7.451 -5.742 1.00 . A X . 20 GLN CD 1 1
4 1906 1 1 20 GLN CG C 16.852 6.182 -4.898 1.00 . A X . 20 GLN CG 1 1
4 1907 1 1 20 GLN H H 20.429 4.638 -3.775 1.00 . A X . 20 GLN H 1 1
4 1908 1 1 20 GLN HA H 17.652 4.501 -3.027 1.00 . A X . 20 GLN HA 1 1
4 1909 1 1 20 GLN HB2 H 18.776 6.528 -4.014 1.00 . A X . 20 GLN HB2 1 1
4 1910 1 1 20 GLN HB3 H 18.830 5.671 -5.555 1.00 . A X . 20 GLN HB3 1 1
4 1911 1 1 20 GLN HE21 H 14.904 7.263 -6.221 1.00 . A X . 20 GLN HE21 1 1
4 1912 1 1 20 GLN HE22 H 15.685 8.624 -6.869 1.00 . A X . 20 GLN HE22 1 1
4 1913 1 1 20 GLN HG2 H 16.352 5.385 -5.431 1.00 . A X . 20 GLN HG2 1 1
4 1914 1 1 20 GLN HG3 H 16.345 6.362 -3.963 1.00 . A X . 20 GLN HG3 1 1
4 1915 1 1 20 GLN N N 19.665 4.148 -3.397 1.00 . A X . 20 GLN N 1 1
4 1916 1 1 20 GLN NE2 N 15.711 7.809 -6.326 1.00 . A X . 20 GLN NE2 1 1
4 1917 1 1 20 GLN O O 16.879 2.617 -4.488 1.00 . A X . 20 GLN O 1 1
4 1918 1 1 20 GLN OE1 O 17.838 8.135 -5.872 1.00 . A X . 20 GLN OE1 1 1
4 1919 1 1 21 ASP C C 18.113 0.778 -6.221 1.00 . A X . 21 ASP C 1 1
4 1920 1 1 21 ASP CA C 18.138 2.146 -6.897 1.00 . A X . 21 ASP CA 1 1
4 1921 1 1 21 ASP CB C 19.142 2.128 -8.053 1.00 . A X . 21 ASP CB 1 1
4 1922 1 1 21 ASP CG C 18.406 1.984 -9.380 1.00 . A X . 21 ASP CG 1 1
4 1923 1 1 21 ASP H H 19.261 3.770 -6.133 1.00 . A X . 21 ASP H 1 1
4 1924 1 1 21 ASP HA H 17.157 2.364 -7.291 1.00 . A X . 21 ASP HA 1 1
4 1925 1 1 21 ASP HB2 H 19.704 3.053 -8.051 1.00 . A X . 21 ASP HB2 1 1
4 1926 1 1 21 ASP HB3 H 19.819 1.294 -7.927 1.00 . A X . 21 ASP HB3 1 1
4 1927 1 1 21 ASP N N 18.505 3.178 -5.936 1.00 . A X . 21 ASP N 1 1
4 1928 1 1 21 ASP O O 17.700 -0.216 -6.819 1.00 . A X . 21 ASP O 1 1
4 1929 1 1 21 ASP OD1 O 17.879 0.912 -9.629 1.00 . A X . 21 ASP OD1 1 1
4 1930 1 1 21 ASP OD2 O 18.379 2.947 -10.128 1.00 . A X . 21 ASP OD2 1 1
4 1931 1 1 22 PHE C C 17.511 -0.551 -3.162 1.00 . A X . 22 PHE C 1 1
4 1932 1 1 22 PHE CA C 18.613 -0.504 -4.219 1.00 . A X . 22 PHE CA 1 1
4 1933 1 1 22 PHE CB C 19.970 -0.625 -3.534 1.00 . A X . 22 PHE CB 1 1
4 1934 1 1 22 PHE CD1 C 20.367 -3.010 -4.183 1.00 . A X . 22 PHE CD1 1 1
4 1935 1 1 22 PHE CD2 C 20.229 -2.457 -1.830 1.00 . A X . 22 PHE CD2 1 1
4 1936 1 1 22 PHE CE1 C 20.564 -4.349 -3.859 1.00 . A X . 22 PHE CE1 1 1
4 1937 1 1 22 PHE CE2 C 20.430 -3.799 -1.503 1.00 . A X . 22 PHE CE2 1 1
4 1938 1 1 22 PHE CG C 20.200 -2.064 -3.172 1.00 . A X . 22 PHE CG 1 1
4 1939 1 1 22 PHE CZ C 20.596 -4.749 -2.517 1.00 . A X . 22 PHE CZ 1 1
4 1940 1 1 22 PHE H H 18.895 1.557 -4.555 1.00 . A X . 22 PHE H 1 1
4 1941 1 1 22 PHE HA H 18.491 -1.338 -4.894 1.00 . A X . 22 PHE HA 1 1
4 1942 1 1 22 PHE HB2 H 20.747 -0.293 -4.208 1.00 . A X . 22 PHE HB2 1 1
4 1943 1 1 22 PHE HB3 H 19.980 -0.020 -2.639 1.00 . A X . 22 PHE HB3 1 1
4 1944 1 1 22 PHE HD1 H 20.346 -2.704 -5.219 1.00 . A X . 22 PHE HD1 1 1
4 1945 1 1 22 PHE HD2 H 20.099 -1.723 -1.048 1.00 . A X . 22 PHE HD2 1 1
4 1946 1 1 22 PHE HE1 H 20.689 -5.073 -4.645 1.00 . A X . 22 PHE HE1 1 1
4 1947 1 1 22 PHE HE2 H 20.450 -4.102 -0.469 1.00 . A X . 22 PHE HE2 1 1
4 1948 1 1 22 PHE HZ H 20.750 -5.789 -2.265 1.00 . A X . 22 PHE HZ 1 1
4 1949 1 1 22 PHE N N 18.570 0.738 -4.973 1.00 . A X . 22 PHE N 1 1
4 1950 1 1 22 PHE O O 16.562 -1.325 -3.276 1.00 . A X . 22 PHE O 1 1
4 1951 1 1 23 VAL C C 15.269 0.582 -1.561 1.00 . A X . 23 VAL C 1 1
4 1952 1 1 23 VAL CA C 16.679 0.309 -1.044 1.00 . A X . 23 VAL CA 1 1
4 1953 1 1 23 VAL CB C 17.063 1.388 -0.032 1.00 . A X . 23 VAL CB 1 1
4 1954 1 1 23 VAL CG1 C 16.017 1.439 1.083 1.00 . A X . 23 VAL CG1 1 1
4 1955 1 1 23 VAL CG2 C 18.432 1.059 0.568 1.00 . A X . 23 VAL CG2 1 1
4 1956 1 1 23 VAL H H 18.439 0.860 -2.088 1.00 . A X . 23 VAL H 1 1
4 1957 1 1 23 VAL HA H 16.685 -0.646 -0.542 1.00 . A X . 23 VAL HA 1 1
4 1958 1 1 23 VAL HB H 17.107 2.346 -0.527 1.00 . A X . 23 VAL HB 1 1
4 1959 1 1 23 VAL HG11 H 16.490 1.740 2.007 1.00 . A X . 23 VAL HG11 1 1
4 1960 1 1 23 VAL HG12 H 15.576 0.461 1.208 1.00 . A X . 23 VAL HG12 1 1
4 1961 1 1 23 VAL HG13 H 15.247 2.150 0.823 1.00 . A X . 23 VAL HG13 1 1
4 1962 1 1 23 VAL HG21 H 19.042 0.566 -0.175 1.00 . A X . 23 VAL HG21 1 1
4 1963 1 1 23 VAL HG22 H 18.305 0.406 1.419 1.00 . A X . 23 VAL HG22 1 1
4 1964 1 1 23 VAL HG23 H 18.916 1.970 0.884 1.00 . A X . 23 VAL HG23 1 1
4 1965 1 1 23 VAL N N 17.655 0.272 -2.129 1.00 . A X . 23 VAL N 1 1
4 1966 1 1 23 VAL O O 14.320 0.636 -0.780 1.00 . A X . 23 VAL O 1 1
4 1967 1 1 24 GLN C C 13.070 -0.291 -3.699 1.00 . A X . 24 GLN C 1 1
4 1968 1 1 24 GLN CA C 13.813 1.014 -3.442 1.00 . A X . 24 GLN CA 1 1
4 1969 1 1 24 GLN CB C 13.939 1.814 -4.744 1.00 . A X . 24 GLN CB 1 1
4 1970 1 1 24 GLN CD C 13.612 0.061 -6.496 1.00 . A X . 24 GLN CD 1 1
4 1971 1 1 24 GLN CG C 14.629 0.964 -5.810 1.00 . A X . 24 GLN CG 1 1
4 1972 1 1 24 GLN H H 15.909 0.698 -3.459 1.00 . A X . 24 GLN H 1 1
4 1973 1 1 24 GLN HA H 13.243 1.594 -2.732 1.00 . A X . 24 GLN HA 1 1
4 1974 1 1 24 GLN HB2 H 12.953 2.093 -5.088 1.00 . A X . 24 GLN HB2 1 1
4 1975 1 1 24 GLN HB3 H 14.524 2.704 -4.561 1.00 . A X . 24 GLN HB3 1 1
4 1976 1 1 24 GLN HE21 H 14.168 -1.554 -5.494 1.00 . A X . 24 GLN HE21 1 1
4 1977 1 1 24 GLN HE22 H 12.909 -1.792 -6.605 1.00 . A X . 24 GLN HE22 1 1
4 1978 1 1 24 GLN HG2 H 15.082 1.612 -6.545 1.00 . A X . 24 GLN HG2 1 1
4 1979 1 1 24 GLN HG3 H 15.393 0.357 -5.348 1.00 . A X . 24 GLN HG3 1 1
4 1980 1 1 24 GLN N N 15.127 0.751 -2.872 1.00 . A X . 24 GLN N 1 1
4 1981 1 1 24 GLN NE2 N 13.559 -1.200 -6.173 1.00 . A X . 24 GLN NE2 1 1
4 1982 1 1 24 GLN O O 11.850 -0.294 -3.865 1.00 . A X . 24 GLN O 1 1
4 1983 1 1 24 GLN OE1 O 12.849 0.515 -7.348 1.00 . A X . 24 GLN OE1 1 1
4 1984 1 1 25 TRP C C 13.183 -3.452 -2.589 1.00 . A X . 25 TRP C 1 1
4 1985 1 1 25 TRP CA C 13.184 -2.703 -3.902 1.00 . A X . 25 TRP CA 1 1
4 1986 1 1 25 TRP CB C 13.958 -3.529 -4.910 1.00 . A X . 25 TRP CB 1 1
4 1987 1 1 25 TRP CD1 C 13.280 -5.905 -4.463 1.00 . A X . 25 TRP CD1 1 1
4 1988 1 1 25 TRP CD2 C 15.189 -5.333 -3.448 1.00 . A X . 25 TRP CD2 1 1
4 1989 1 1 25 TRP CE2 C 14.956 -6.681 -3.108 1.00 . A X . 25 TRP CE2 1 1
4 1990 1 1 25 TRP CE3 C 16.325 -4.706 -2.940 1.00 . A X . 25 TRP CE3 1 1
4 1991 1 1 25 TRP CG C 14.131 -4.875 -4.317 1.00 . A X . 25 TRP CG 1 1
4 1992 1 1 25 TRP CH2 C 16.974 -6.732 -1.783 1.00 . A X . 25 TRP CH2 1 1
4 1993 1 1 25 TRP CZ2 C 15.839 -7.382 -2.279 1.00 . A X . 25 TRP CZ2 1 1
4 1994 1 1 25 TRP CZ3 C 17.211 -5.394 -2.117 1.00 . A X . 25 TRP CZ3 1 1
4 1995 1 1 25 TRP H H 14.776 -1.351 -3.536 1.00 . A X . 25 TRP H 1 1
4 1996 1 1 25 TRP HA H 12.170 -2.588 -4.249 1.00 . A X . 25 TRP HA 1 1
4 1997 1 1 25 TRP HB2 H 13.403 -3.598 -5.835 1.00 . A X . 25 TRP HB2 1 1
4 1998 1 1 25 TRP HB3 H 14.927 -3.085 -5.088 1.00 . A X . 25 TRP HB3 1 1
4 1999 1 1 25 TRP HD1 H 12.370 -5.878 -5.045 1.00 . A X . 25 TRP HD1 1 1
4 2000 1 1 25 TRP HE1 H 13.348 -7.877 -3.704 1.00 . A X . 25 TRP HE1 1 1
4 2001 1 1 25 TRP HE3 H 16.509 -3.676 -3.175 1.00 . A X . 25 TRP HE3 1 1
4 2002 1 1 25 TRP HH2 H 17.664 -7.263 -1.143 1.00 . A X . 25 TRP HH2 1 1
4 2003 1 1 25 TRP HZ2 H 15.648 -8.407 -2.018 1.00 . A X . 25 TRP HZ2 1 1
4 2004 1 1 25 TRP HZ3 H 18.078 -4.884 -1.736 1.00 . A X . 25 TRP HZ3 1 1
4 2005 1 1 25 TRP N N 13.802 -1.401 -3.700 1.00 . A X . 25 TRP N 1 1
4 2006 1 1 25 TRP NE1 N 13.771 -6.994 -3.754 1.00 . A X . 25 TRP NE1 1 1
4 2007 1 1 25 TRP O O 12.230 -4.154 -2.253 1.00 . A X . 25 TRP O 1 1
4 2008 1 1 26 LEU C C 13.165 -3.715 0.274 1.00 . A X . 26 LEU C 1 1
4 2009 1 1 26 LEU CA C 14.408 -3.969 -0.576 1.00 . A X . 26 LEU CA 1 1
4 2010 1 1 26 LEU CB C 15.652 -3.465 0.166 1.00 . A X . 26 LEU CB 1 1
4 2011 1 1 26 LEU CD1 C 16.606 -5.633 1.066 1.00 . A X . 26 LEU CD1 1 1
4 2012 1 1 26 LEU CD2 C 16.793 -3.525 2.389 1.00 . A X . 26 LEU CD2 1 1
4 2013 1 1 26 LEU CG C 15.904 -4.315 1.427 1.00 . A X . 26 LEU CG 1 1
4 2014 1 1 26 LEU H H 15.005 -2.732 -2.177 1.00 . A X . 26 LEU H 1 1
4 2015 1 1 26 LEU HA H 14.513 -5.021 -0.762 1.00 . A X . 26 LEU HA 1 1
4 2016 1 1 26 LEU HB2 H 16.507 -3.521 -0.488 1.00 . A X . 26 LEU HB2 1 1
4 2017 1 1 26 LEU HB3 H 15.496 -2.437 0.457 1.00 . A X . 26 LEU HB3 1 1
4 2018 1 1 26 LEU HD11 H 17.470 -5.427 0.456 1.00 . A X . 26 LEU HD11 1 1
4 2019 1 1 26 LEU HD12 H 15.926 -6.280 0.527 1.00 . A X . 26 LEU HD12 1 1
4 2020 1 1 26 LEU HD13 H 16.922 -6.127 1.973 1.00 . A X . 26 LEU HD13 1 1
4 2021 1 1 26 LEU HD21 H 16.302 -2.600 2.656 1.00 . A X . 26 LEU HD21 1 1
4 2022 1 1 26 LEU HD22 H 17.736 -3.307 1.912 1.00 . A X . 26 LEU HD22 1 1
4 2023 1 1 26 LEU HD23 H 16.967 -4.109 3.281 1.00 . A X . 26 LEU HD23 1 1
4 2024 1 1 26 LEU HG H 14.965 -4.536 1.912 1.00 . A X . 26 LEU HG 1 1
4 2025 1 1 26 LEU N N 14.276 -3.299 -1.850 1.00 . A X . 26 LEU N 1 1
4 2026 1 1 26 LEU O O 12.724 -4.585 1.024 1.00 . A X . 26 LEU O 1 1
4 2027 1 1 27 MET C C 10.161 -2.361 0.106 1.00 . A X . 27 MET C 1 1
4 2028 1 1 27 MET CA C 11.430 -2.142 0.923 1.00 . A X . 27 MET CA 1 1
4 2029 1 1 27 MET CB C 11.520 -0.675 1.347 1.00 . A X . 27 MET CB 1 1
4 2030 1 1 27 MET CE C 9.895 2.386 0.794 1.00 . A X . 27 MET CE 1 1
4 2031 1 1 27 MET CG C 11.388 0.222 0.116 1.00 . A X . 27 MET CG 1 1
4 2032 1 1 27 MET H H 13.014 -1.849 -0.456 1.00 . A X . 27 MET H 1 1
4 2033 1 1 27 MET HA H 11.384 -2.757 1.810 1.00 . A X . 27 MET HA 1 1
4 2034 1 1 27 MET HB2 H 10.725 -0.452 2.045 1.00 . A X . 27 MET HB2 1 1
4 2035 1 1 27 MET HB3 H 12.476 -0.494 1.819 1.00 . A X . 27 MET HB3 1 1
4 2036 1 1 27 MET HE1 H 8.949 2.908 0.822 1.00 . A X . 27 MET HE1 1 1
4 2037 1 1 27 MET HE2 H 10.613 2.980 0.251 1.00 . A X . 27 MET HE2 1 1
4 2038 1 1 27 MET HE3 H 10.254 2.222 1.801 1.00 . A X . 27 MET HE3 1 1
4 2039 1 1 27 MET HG2 H 12.043 1.076 0.220 1.00 . A X . 27 MET HG2 1 1
4 2040 1 1 27 MET HG3 H 11.659 -0.338 -0.769 1.00 . A X . 27 MET HG3 1 1
4 2041 1 1 27 MET N N 12.614 -2.507 0.155 1.00 . A X . 27 MET N 1 1
4 2042 1 1 27 MET O O 9.058 -2.063 0.564 1.00 . A X . 27 MET O 1 1
4 2043 1 1 27 MET SD S 9.676 0.792 -0.034 1.00 . A X . 27 MET SD 1 1
4 2044 1 1 28 ASN C C 8.804 -4.615 -1.951 1.00 . A X . 28 ASN C 1 1
4 2045 1 1 28 ASN CA C 9.178 -3.136 -1.975 1.00 . A X . 28 ASN CA 1 1
4 2046 1 1 28 ASN CB C 9.507 -2.716 -3.409 1.00 . A X . 28 ASN CB 1 1
4 2047 1 1 28 ASN CG C 8.220 -2.424 -4.174 1.00 . A X . 28 ASN CG 1 1
4 2048 1 1 28 ASN H H 11.224 -3.100 -1.420 1.00 . A X . 28 ASN H 1 1
4 2049 1 1 28 ASN HA H 8.338 -2.555 -1.626 1.00 . A X . 28 ASN HA 1 1
4 2050 1 1 28 ASN HB2 H 10.123 -1.828 -3.390 1.00 . A X . 28 ASN HB2 1 1
4 2051 1 1 28 ASN HB3 H 10.042 -3.514 -3.903 1.00 . A X . 28 ASN HB3 1 1
4 2052 1 1 28 ASN HD21 H 7.043 -3.243 -2.803 1.00 . A X . 28 ASN HD21 1 1
4 2053 1 1 28 ASN HD22 H 6.244 -2.602 -4.155 1.00 . A X . 28 ASN HD22 1 1
4 2054 1 1 28 ASN N N 10.322 -2.882 -1.106 1.00 . A X . 28 ASN N 1 1
4 2055 1 1 28 ASN ND2 N 7.073 -2.786 -3.669 1.00 . A X . 28 ASN ND2 1 1
4 2056 1 1 28 ASN O O 8.525 -5.212 -2.990 1.00 . A X . 28 ASN O 1 1
4 2057 1 1 28 ASN OD1 O 8.262 -1.850 -5.265 1.00 . A X . 28 ASN OD1 1 1
4 2058 1 1 29 THR C C 7.022 -6.765 -0.120 1.00 . A X . 29 THR C 1 1
4 2059 1 1 29 THR CA C 8.459 -6.609 -0.609 1.00 . A X . 29 THR CA 1 1
4 2060 1 1 29 THR CB C 9.413 -7.277 0.383 1.00 . A X . 29 THR CB 1 1
4 2061 1 1 29 THR CG2 C 10.853 -7.112 -0.102 1.00 . A X . 29 THR CG2 1 1
4 2062 1 1 29 THR H H 9.032 -4.674 0.036 1.00 . A X . 29 THR H 1 1
4 2063 1 1 29 THR HA H 8.557 -7.095 -1.569 1.00 . A X . 29 THR HA 1 1
4 2064 1 1 29 THR HB H 9.180 -8.329 0.455 1.00 . A X . 29 THR HB 1 1
4 2065 1 1 29 THR HG1 H 9.217 -5.720 1.532 1.00 . A X . 29 THR HG1 1 1
4 2066 1 1 29 THR HG21 H 11.429 -6.595 0.651 1.00 . A X . 29 THR HG21 1 1
4 2067 1 1 29 THR HG22 H 10.863 -6.542 -1.019 1.00 . A X . 29 THR HG22 1 1
4 2068 1 1 29 THR HG23 H 11.287 -8.086 -0.279 1.00 . A X . 29 THR HG23 1 1
4 2069 1 1 29 THR N N 8.800 -5.199 -0.757 1.00 . A X . 29 THR N 1 1
4 2070 1 1 29 THR O O 6.107 -6.143 -0.659 1.00 . A X . 29 THR O 1 1
4 2071 1 1 29 THR OG1 O 9.267 -6.669 1.659 1.00 . A X . 29 THR OG1 1 1
4 2072 1 1 30 NH2 HN1 H 7.497 -8.058 1.309 1.00 . A X . 30 NH2 HN1 1 1
4 2073 1 1 30 NH2 HN2 H 5.848 -7.669 1.200 1.00 . A X . 30 NH2 HN2 1 1
4 2074 1 1 30 NH2 N N 6.767 -7.564 0.879 1.00 . A X . 30 NH2 N 1 1
4 2075 2 2 1 . C C 28.036 6.281 -13.354 1.00 . B X . 101 GGL C 1 1
4 2076 2 2 1 . CA C 29.038 7.002 -12.457 1.00 . B X . 101 GGL CA 1 1
4 2077 2 2 1 . CB C 28.795 8.511 -12.527 1.00 . B X . 101 GGL CB 1 1
4 2078 2 2 1 . CD C 27.221 10.170 -11.512 1.00 . B X . 101 GGL CD 1 1
4 2079 2 2 1 . CG C 27.333 8.810 -12.196 1.00 . B X . 101 GGL CG 1 1
4 2080 2 2 1 . H H 31.103 7.378 -12.756 1.00 . B X . 101 GGL H 1 1
4 2081 2 2 1 . HA H 28.897 6.675 -11.437 1.00 . B X . 101 GGL HA 1 1
4 2082 2 2 1 . HB2 H 29.016 8.865 -13.523 1.00 . B X . 101 GGL HB2 1 1
4 2083 2 2 1 . HB3 H 29.437 9.013 -11.817 1.00 . B X . 101 GGL HB3 1 1
4 2084 2 2 1 . HG2 H 26.752 8.820 -13.107 1.00 . B X . 101 GGL HG2 1 1
4 2085 2 2 1 . HG3 H 26.950 8.046 -11.536 1.00 . B X . 101 GGL HG3 1 1
4 2086 2 2 1 . N N 30.405 6.700 -12.868 1.00 . B X . 101 GGL N 1 1
4 2087 2 2 1 . O O 26.894 6.156 -12.946 1.00 . B X . 101 GGL O 1 1
4 2088 2 2 1 . OE1 O 26.789 11.148 -12.122 1.00 . B X . 101 GGL OE1 1 1
4 2089 2 2 1 . OXT O 28.388 5.997 -14.487 1.00 . B X . 101 GGL OXT 1 1
4 2090 3 2 1 . C C 31.683 9.205 -14.499 1.00 . C X . 102 GGL C 1 1
4 2091 3 2 1 . CA C 32.245 7.823 -14.811 1.00 . C X . 102 GGL CA 1 1
4 2092 3 2 1 . CB C 31.139 6.947 -15.407 1.00 . C X . 102 GGL CB 1 1
4 2093 3 2 1 . CD C 30.721 5.519 -13.390 1.00 . C X . 102 GGL CD 1 1
4 2094 3 2 1 . CG C 31.225 5.532 -14.830 1.00 . C X . 102 GGL CG 1 1
4 2095 3 2 1 . H H 32.657 6.247 -13.455 1.00 . C X . 102 GGL H 1 1
4 2096 3 2 1 . HA H 33.038 7.923 -15.538 1.00 . C X . 102 GGL HA 1 1
4 2097 3 2 1 . HB2 H 30.176 7.375 -15.169 1.00 . C X . 102 GGL HB2 1 1
4 2098 3 2 1 . HB3 H 31.255 6.903 -16.480 1.00 . C X . 102 GGL HB3 1 1
4 2099 3 2 1 . HG2 H 30.617 4.866 -15.426 1.00 . C X . 102 GGL HG2 1 1
4 2100 3 2 1 . HG3 H 32.251 5.197 -14.855 1.00 . C X . 102 GGL HG3 1 1
4 2101 3 2 1 . N N 32.786 7.205 -13.606 1.00 . C X . 102 GGL N 1 1
4 2102 3 2 1 . O O 31.546 9.990 -15.423 1.00 . C X . 102 GGL O 1 1
4 2103 3 2 1 . OE1 O 30.613 4.461 -12.769 1.00 . C X . 102 GGL OE1 1 1
4 2104 3 2 1 . OXT O 31.432 9.472 -13.334 1.00 . C X . 102 GGL OXT 1 1
4 2105 4 3 1 PLM C1 C 33.502 7.912 -12.736 1.00 . D X . 103 PLM C1 1 1
4 2106 4 3 1 PLM C2 C 33.013 7.897 -11.291 1.00 . D X . 103 PLM C2 1 1
4 2107 4 3 1 PLM C3 C 32.988 6.461 -10.764 1.00 . D X . 103 PLM C3 1 1
4 2108 4 3 1 PLM C4 C 32.634 6.471 -9.274 1.00 . D X . 103 PLM C4 1 1
4 2109 4 3 1 PLM C5 C 33.804 5.906 -8.465 1.00 . D X . 103 PLM C5 1 1
4 2110 4 3 1 PLM C6 C 33.972 4.418 -8.778 1.00 . D X . 103 PLM C6 1 1
4 2111 4 3 1 PLM C7 C 33.586 3.591 -7.550 1.00 . D X . 103 PLM C7 1 1
4 2112 4 3 1 PLM C8 C 33.768 2.103 -7.859 1.00 . D X . 103 PLM C8 1 1
4 2113 4 3 1 PLM C9 C 32.503 1.341 -7.457 1.00 . D X . 103 PLM C9 1 1
4 2114 4 3 1 PLM CA C 31.369 1.684 -8.428 1.00 . D X . 103 PLM CA 1 1
4 2115 4 3 1 PLM CB C 30.118 2.078 -7.640 1.00 . D X . 103 PLM CB 1 1
4 2116 4 3 1 PLM CC C 28.916 2.135 -8.584 1.00 . D X . 103 PLM CC 1 1
4 2117 4 3 1 PLM CD C 27.694 2.673 -7.827 1.00 . D X . 103 PLM CD 1 1
4 2118 4 3 1 PLM CE C 27.711 4.212 -7.810 1.00 . D X . 103 PLM CE 1 1
4 2119 4 3 1 PLM CF C 26.720 4.764 -8.843 1.00 . D X . 103 PLM CF 1 1
4 2120 4 3 1 PLM CG C 27.179 4.393 -10.256 1.00 . D X . 103 PLM CG 1 1
4 2121 4 3 1 PLM H21 H 33.677 8.491 -10.682 1.00 . D X . 103 PLM H21 1 1
4 2122 4 3 1 PLM H22 H 32.017 8.313 -11.246 1.00 . D X . 103 PLM H22 1 1
4 2123 4 3 1 PLM H31 H 32.247 5.891 -11.305 1.00 . D X . 103 PLM H31 1 1
4 2124 4 3 1 PLM H32 H 33.959 6.009 -10.900 1.00 . D X . 103 PLM H32 1 1
4 2125 4 3 1 PLM H41 H 31.755 5.864 -9.109 1.00 . D X . 103 PLM H41 1 1
4 2126 4 3 1 PLM H42 H 32.435 7.484 -8.960 1.00 . D X . 103 PLM H42 1 1
4 2127 4 3 1 PLM H51 H 34.710 6.434 -8.724 1.00 . D X . 103 PLM H51 1 1
4 2128 4 3 1 PLM H52 H 33.604 6.031 -7.410 1.00 . D X . 103 PLM H52 1 1
4 2129 4 3 1 PLM H61 H 35.002 4.218 -9.038 1.00 . D X . 103 PLM H61 1 1
4 2130 4 3 1 PLM H62 H 33.334 4.149 -9.607 1.00 . D X . 103 PLM H62 1 1
4 2131 4 3 1 PLM H71 H 34.219 3.867 -6.719 1.00 . D X . 103 PLM H71 1 1
4 2132 4 3 1 PLM H72 H 32.555 3.784 -7.297 1.00 . D X . 103 PLM H72 1 1
4 2133 4 3 1 PLM H81 H 34.609 1.720 -7.301 1.00 . D X . 103 PLM H81 1 1
4 2134 4 3 1 PLM H82 H 33.948 1.974 -8.915 1.00 . D X . 103 PLM H82 1 1
4 2135 4 3 1 PLM H91 H 32.697 0.280 -7.492 1.00 . D X . 103 PLM H91 1 1
4 2136 4 3 1 PLM H92 H 32.217 1.622 -6.455 1.00 . D X . 103 PLM H92 1 1
4 2137 4 3 1 PLM HA1 H 31.671 2.507 -9.059 1.00 . D X . 103 PLM HA1 1 1
4 2138 4 3 1 PLM HA2 H 31.150 0.823 -9.044 1.00 . D X . 103 PLM HA2 1 1
4 2139 4 3 1 PLM HB1 H 30.268 3.046 -7.189 1.00 . D X . 103 PLM HB1 1 1
4 2140 4 3 1 PLM HB2 H 29.933 1.347 -6.866 1.00 . D X . 103 PLM HB2 1 1
4 2141 4 3 1 PLM HC1 H 29.144 2.778 -9.420 1.00 . D X . 103 PLM HC1 1 1
4 2142 4 3 1 PLM HC2 H 28.699 1.141 -8.947 1.00 . D X . 103 PLM HC2 1 1
4 2143 4 3 1 PLM HD1 H 26.794 2.325 -8.310 1.00 . D X . 103 PLM HD1 1 1
4 2144 4 3 1 PLM HD2 H 27.717 2.308 -6.812 1.00 . D X . 103 PLM HD2 1 1
4 2145 4 3 1 PLM HE1 H 28.705 4.569 -8.039 1.00 . D X . 103 PLM HE1 1 1
4 2146 4 3 1 PLM HE2 H 27.427 4.559 -6.828 1.00 . D X . 103 PLM HE2 1 1
4 2147 4 3 1 PLM HF1 H 25.739 4.351 -8.664 1.00 . D X . 103 PLM HF1 1 1
4 2148 4 3 1 PLM HF2 H 26.675 5.839 -8.755 1.00 . D X . 103 PLM HF2 1 1
4 2149 4 3 1 PLM HG1 H 26.562 4.904 -10.980 1.00 . D X . 103 PLM HG1 1 1
4 2150 4 3 1 PLM HG2 H 28.209 4.690 -10.390 1.00 . D X . 103 PLM HG2 1 1
4 2151 4 3 1 PLM HG3 H 27.089 3.326 -10.398 1.00 . D X . 103 PLM HG3 1 1
4 2152 4 3 1 PLM O2 O 34.509 8.544 -13.053 1.00 . D X . 103 PLM O2 1 1
5 2153 1 1 1 HIS C C 43.120 14.100 -6.541 1.00 . A X . 1 HIS C 1 1
5 2154 1 1 1 HIS CA C 43.674 14.469 -5.170 1.00 . A X . 1 HIS CA 1 1
5 2155 1 1 1 HIS CB C 45.041 13.814 -4.964 1.00 . A X . 1 HIS CB 1 1
5 2156 1 1 1 HIS CD2 C 45.710 14.204 -2.454 1.00 . A X . 1 HIS CD2 1 1
5 2157 1 1 1 HIS CE1 C 47.056 15.877 -2.743 1.00 . A X . 1 HIS CE1 1 1
5 2158 1 1 1 HIS CG C 45.739 14.463 -3.802 1.00 . A X . 1 HIS CG 1 1
5 2159 1 1 1 HIS H1 H 43.042 13.066 -3.769 1.00 . A X . 1 HIS H1 1 1
5 2160 1 1 1 HIS H2 H 41.777 13.924 -4.510 1.00 . A X . 1 HIS H2 1 1
5 2161 1 1 1 HIS H3 H 42.735 14.673 -3.324 1.00 . A X . 1 HIS H3 1 1
5 2162 1 1 1 HIS HA H 43.778 15.542 -5.104 1.00 . A X . 1 HIS HA 1 1
5 2163 1 1 1 HIS HB2 H 44.908 12.759 -4.762 1.00 . A X . 1 HIS HB2 1 1
5 2164 1 1 1 HIS HB3 H 45.638 13.938 -5.858 1.00 . A X . 1 HIS HB3 1 1
5 2165 1 1 1 HIS HD2 H 45.128 13.426 -1.982 1.00 . A X . 1 HIS HD2 1 1
5 2166 1 1 1 HIS HE1 H 47.751 16.684 -2.560 1.00 . A X . 1 HIS HE1 1 1
5 2167 1 1 1 HIS HE2 H 46.716 15.147 -0.824 1.00 . A X . 1 HIS HE2 1 1
5 2168 1 1 1 HIS N N 42.737 13.998 -4.113 1.00 . A X . 1 HIS N 1 1
5 2169 1 1 1 HIS ND1 N 46.604 15.533 -3.963 1.00 . A X . 1 HIS ND1 1 1
5 2170 1 1 1 HIS NE2 N 46.543 15.099 -1.788 1.00 . A X . 1 HIS NE2 1 1
5 2171 1 1 1 HIS O O 43.364 14.794 -7.527 1.00 . A X . 1 HIS O 1 1
5 2172 1 1 2 ABA C C 41.237 13.730 -8.639 1.00 . A X . 2 AIB C 1 1
5 2173 1 1 2 ABA CA C 41.789 12.549 -7.853 1.00 . A X . 2 AIB CA 1 1
5 2174 1 1 2 ABA H H 42.211 12.487 -5.778 1.00 . A X . 2 AIB H 1 1
5 2175 1 1 2 ABA N N 42.372 13.001 -6.596 1.00 . A X . 2 AIB N 1 1
5 2176 1 1 2 ABA O O 41.613 13.950 -9.790 1.00 . A X . 2 AIB O 1 1
5 2177 1 1 3 GLN C C 38.928 15.163 -9.883 1.00 . A X . 3 GLN C 1 1
5 2178 1 1 3 GLN CA C 39.729 15.628 -8.672 1.00 . A X . 3 GLN CA 1 1
5 2179 1 1 3 GLN CB C 40.811 16.616 -9.108 1.00 . A X . 3 GLN CB 1 1
5 2180 1 1 3 GLN CD C 41.260 18.992 -9.748 1.00 . A X . 3 GLN CD 1 1
5 2181 1 1 3 GLN CG C 40.185 17.993 -9.338 1.00 . A X . 3 GLN CG 1 1
5 2182 1 1 3 GLN H H 40.067 14.250 -7.099 1.00 . A X . 3 GLN H 1 1
5 2183 1 1 3 GLN HA H 39.061 16.118 -7.978 1.00 . A X . 3 GLN HA 1 1
5 2184 1 1 3 GLN HB2 H 41.563 16.685 -8.335 1.00 . A X . 3 GLN HB2 1 1
5 2185 1 1 3 GLN HB3 H 41.265 16.271 -10.024 1.00 . A X . 3 GLN HB3 1 1
5 2186 1 1 3 GLN HE21 H 41.830 19.367 -7.883 1.00 . A X . 3 GLN HE21 1 1
5 2187 1 1 3 GLN HE22 H 42.675 20.218 -9.085 1.00 . A X . 3 GLN HE22 1 1
5 2188 1 1 3 GLN HG2 H 39.443 17.922 -10.121 1.00 . A X . 3 GLN HG2 1 1
5 2189 1 1 3 GLN HG3 H 39.714 18.329 -8.424 1.00 . A X . 3 GLN HG3 1 1
5 2190 1 1 3 GLN N N 40.336 14.480 -8.014 1.00 . A X . 3 GLN N 1 1
5 2191 1 1 3 GLN NE2 N 41.981 19.575 -8.829 1.00 . A X . 3 GLN NE2 1 1
5 2192 1 1 3 GLN O O 37.698 15.167 -9.861 1.00 . A X . 3 GLN O 1 1
5 2193 1 1 3 GLN OE1 O 41.447 19.252 -10.936 1.00 . A X . 3 GLN OE1 1 1
5 2194 1 1 4 GLY C C 37.985 13.149 -11.746 1.00 . A X . 4 GLY C 1 1
5 2195 1 1 4 GLY CA C 38.961 14.253 -12.127 1.00 . A X . 4 GLY CA 1 1
5 2196 1 1 4 GLY H H 40.611 14.745 -10.889 1.00 . A X . 4 GLY H 1 1
5 2197 1 1 4 GLY HA2 H 38.424 15.066 -12.594 1.00 . A X . 4 GLY HA2 1 1
5 2198 1 1 4 GLY HA3 H 39.692 13.860 -12.814 1.00 . A X . 4 GLY HA3 1 1
5 2199 1 1 4 GLY N N 39.631 14.742 -10.930 1.00 . A X . 4 GLY N 1 1
5 2200 1 1 4 GLY O O 37.011 12.887 -12.452 1.00 . A X . 4 GLY O 1 1
5 2201 1 1 5 THR C C 37.062 11.710 -8.643 1.00 . A X . 5 THR C 1 1
5 2202 1 1 5 THR CA C 37.409 11.445 -10.105 1.00 . A X . 5 THR CA 1 1
5 2203 1 1 5 THR CB C 38.116 10.094 -10.240 1.00 . A X . 5 THR CB 1 1
5 2204 1 1 5 THR CG2 C 39.353 10.249 -11.128 1.00 . A X . 5 THR CG2 1 1
5 2205 1 1 5 THR H H 39.045 12.782 -10.090 1.00 . A X . 5 THR H 1 1
5 2206 1 1 5 THR HA H 36.498 11.422 -10.680 1.00 . A X . 5 THR HA 1 1
5 2207 1 1 5 THR HB H 37.444 9.381 -10.692 1.00 . A X . 5 THR HB 1 1
5 2208 1 1 5 THR HG1 H 38.617 10.385 -8.382 1.00 . A X . 5 THR HG1 1 1
5 2209 1 1 5 THR HG21 H 40.060 10.911 -10.652 1.00 . A X . 5 THR HG21 1 1
5 2210 1 1 5 THR HG22 H 39.061 10.660 -12.082 1.00 . A X . 5 THR HG22 1 1
5 2211 1 1 5 THR HG23 H 39.812 9.282 -11.279 1.00 . A X . 5 THR HG23 1 1
5 2212 1 1 5 THR N N 38.258 12.515 -10.609 1.00 . A X . 5 THR N 1 1
5 2213 1 1 5 THR O O 36.126 11.125 -8.098 1.00 . A X . 5 THR O 1 1
5 2214 1 1 5 THR OG1 O 38.507 9.626 -8.957 1.00 . A X . 5 THR OG1 1 1
5 2215 1 1 6 PHE C C 37.706 11.735 -5.725 1.00 . A X . 6 PHE C 1 1
5 2216 1 1 6 PHE CA C 37.608 12.963 -6.626 1.00 . A X . 6 PHE CA 1 1
5 2217 1 1 6 PHE CB C 36.236 13.620 -6.461 1.00 . A X . 6 PHE CB 1 1
5 2218 1 1 6 PHE CD1 C 37.117 15.441 -4.948 1.00 . A X . 6 PHE CD1 1 1
5 2219 1 1 6 PHE CD2 C 35.851 16.075 -6.918 1.00 . A X . 6 PHE CD2 1 1
5 2220 1 1 6 PHE CE1 C 37.273 16.791 -4.613 1.00 . A X . 6 PHE CE1 1 1
5 2221 1 1 6 PHE CE2 C 36.007 17.425 -6.582 1.00 . A X . 6 PHE CE2 1 1
5 2222 1 1 6 PHE CG C 36.407 15.081 -6.101 1.00 . A X . 6 PHE CG 1 1
5 2223 1 1 6 PHE CZ C 36.718 17.784 -5.430 1.00 . A X . 6 PHE CZ 1 1
5 2224 1 1 6 PHE H H 38.553 13.037 -8.519 1.00 . A X . 6 PHE H 1 1
5 2225 1 1 6 PHE HA H 38.369 13.668 -6.329 1.00 . A X . 6 PHE HA 1 1
5 2226 1 1 6 PHE HB2 H 35.689 13.540 -7.390 1.00 . A X . 6 PHE HB2 1 1
5 2227 1 1 6 PHE HB3 H 35.688 13.117 -5.679 1.00 . A X . 6 PHE HB3 1 1
5 2228 1 1 6 PHE HD1 H 37.547 14.676 -4.318 1.00 . A X . 6 PHE HD1 1 1
5 2229 1 1 6 PHE HD2 H 35.303 15.801 -7.807 1.00 . A X . 6 PHE HD2 1 1
5 2230 1 1 6 PHE HE1 H 37.821 17.069 -3.725 1.00 . A X . 6 PHE HE1 1 1
5 2231 1 1 6 PHE HE2 H 35.579 18.191 -7.212 1.00 . A X . 6 PHE HE2 1 1
5 2232 1 1 6 PHE HZ H 36.837 18.825 -5.172 1.00 . A X . 6 PHE HZ 1 1
5 2233 1 1 6 PHE N N 37.826 12.604 -8.023 1.00 . A X . 6 PHE N 1 1
5 2234 1 1 6 PHE O O 37.077 10.708 -5.983 1.00 . A X . 6 PHE O 1 1
5 2235 1 1 7 THR C C 37.735 10.859 -2.559 1.00 . A X . 7 THR C 1 1
5 2236 1 1 7 THR CA C 38.695 10.741 -3.740 1.00 . A X . 7 THR CA 1 1
5 2237 1 1 7 THR CB C 40.136 10.730 -3.231 1.00 . A X . 7 THR CB 1 1
5 2238 1 1 7 THR CG2 C 40.763 12.104 -3.461 1.00 . A X . 7 THR CG2 1 1
5 2239 1 1 7 THR H H 38.990 12.688 -4.522 1.00 . A X . 7 THR H 1 1
5 2240 1 1 7 THR HA H 38.504 9.815 -4.256 1.00 . A X . 7 THR HA 1 1
5 2241 1 1 7 THR HB H 40.702 9.987 -3.770 1.00 . A X . 7 THR HB 1 1
5 2242 1 1 7 THR HG1 H 40.216 11.248 -1.359 1.00 . A X . 7 THR HG1 1 1
5 2243 1 1 7 THR HG21 H 40.096 12.869 -3.096 1.00 . A X . 7 THR HG21 1 1
5 2244 1 1 7 THR HG22 H 40.934 12.249 -4.517 1.00 . A X . 7 THR HG22 1 1
5 2245 1 1 7 THR HG23 H 41.703 12.164 -2.933 1.00 . A X . 7 THR HG23 1 1
5 2246 1 1 7 THR N N 38.509 11.847 -4.673 1.00 . A X . 7 THR N 1 1
5 2247 1 1 7 THR O O 36.686 10.215 -2.533 1.00 . A X . 7 THR O 1 1
5 2248 1 1 7 THR OG1 O 40.149 10.424 -1.845 1.00 . A X . 7 THR OG1 1 1
5 2249 1 1 8 SER C C 35.809 12.064 -0.794 1.00 . A X . 8 SER C 1 1
5 2250 1 1 8 SER CA C 37.271 11.874 -0.400 1.00 . A X . 8 SER CA 1 1
5 2251 1 1 8 SER CB C 37.752 13.096 0.382 1.00 . A X . 8 SER CB 1 1
5 2252 1 1 8 SER H H 38.952 12.167 -1.658 1.00 . A X . 8 SER H 1 1
5 2253 1 1 8 SER HA H 37.354 11.004 0.230 1.00 . A X . 8 SER HA 1 1
5 2254 1 1 8 SER HB2 H 38.718 13.402 0.018 1.00 . A X . 8 SER HB2 1 1
5 2255 1 1 8 SER HB3 H 37.047 13.907 0.249 1.00 . A X . 8 SER HB3 1 1
5 2256 1 1 8 SER HG H 38.191 13.530 2.228 1.00 . A X . 8 SER HG 1 1
5 2257 1 1 8 SER N N 38.103 11.682 -1.583 1.00 . A X . 8 SER N 1 1
5 2258 1 1 8 SER O O 34.946 11.279 -0.402 1.00 . A X . 8 SER O 1 1
5 2259 1 1 8 SER OG O 37.853 12.761 1.760 1.00 . A X . 8 SER OG 1 1
5 2260 1 1 9 ASP C C 33.456 12.109 -2.393 1.00 . A X . 9 ASP C 1 1
5 2261 1 1 9 ASP CA C 34.180 13.395 -2.008 1.00 . A X . 9 ASP CA 1 1
5 2262 1 1 9 ASP CB C 34.210 14.343 -3.207 1.00 . A X . 9 ASP CB 1 1
5 2263 1 1 9 ASP CG C 34.010 15.781 -2.738 1.00 . A X . 9 ASP CG 1 1
5 2264 1 1 9 ASP H H 36.271 13.701 -1.847 1.00 . A X . 9 ASP H 1 1
5 2265 1 1 9 ASP HA H 33.644 13.872 -1.201 1.00 . A X . 9 ASP HA 1 1
5 2266 1 1 9 ASP HB2 H 35.165 14.259 -3.707 1.00 . A X . 9 ASP HB2 1 1
5 2267 1 1 9 ASP HB3 H 33.418 14.078 -3.894 1.00 . A X . 9 ASP HB3 1 1
5 2268 1 1 9 ASP N N 35.542 13.110 -1.569 1.00 . A X . 9 ASP N 1 1
5 2269 1 1 9 ASP O O 32.273 11.940 -2.098 1.00 . A X . 9 ASP O 1 1
5 2270 1 1 9 ASP OD1 O 32.923 16.085 -2.273 1.00 . A X . 9 ASP OD1 1 1
5 2271 1 1 9 ASP OD2 O 34.945 16.556 -2.849 1.00 . A X . 9 ASP OD2 1 1
5 2272 1 1 10 TYR C C 33.141 9.127 -2.261 1.00 . A X . 10 TYR C 1 1
5 2273 1 1 10 TYR CA C 33.585 9.940 -3.476 1.00 . A X . 10 TYR CA 1 1
5 2274 1 1 10 TYR CB C 34.602 9.136 -4.289 1.00 . A X . 10 TYR CB 1 1
5 2275 1 1 10 TYR CD1 C 32.711 7.888 -5.394 1.00 . A X . 10 TYR CD1 1 1
5 2276 1 1 10 TYR CD2 C 34.531 8.705 -6.773 1.00 . A X . 10 TYR CD2 1 1
5 2277 1 1 10 TYR CE1 C 32.088 7.356 -6.530 1.00 . A X . 10 TYR CE1 1 1
5 2278 1 1 10 TYR CE2 C 33.908 8.173 -7.908 1.00 . A X . 10 TYR CE2 1 1
5 2279 1 1 10 TYR CG C 33.931 8.563 -5.516 1.00 . A X . 10 TYR CG 1 1
5 2280 1 1 10 TYR CZ C 32.688 7.498 -7.787 1.00 . A X . 10 TYR CZ 1 1
5 2281 1 1 10 TYR H H 35.110 11.396 -3.265 1.00 . A X . 10 TYR H 1 1
5 2282 1 1 10 TYR HA H 32.724 10.143 -4.094 1.00 . A X . 10 TYR HA 1 1
5 2283 1 1 10 TYR HB2 H 35.413 9.784 -4.591 1.00 . A X . 10 TYR HB2 1 1
5 2284 1 1 10 TYR HB3 H 34.991 8.331 -3.684 1.00 . A X . 10 TYR HB3 1 1
5 2285 1 1 10 TYR HD1 H 32.251 7.779 -4.424 1.00 . A X . 10 TYR HD1 1 1
5 2286 1 1 10 TYR HD2 H 35.472 9.224 -6.867 1.00 . A X . 10 TYR HD2 1 1
5 2287 1 1 10 TYR HE1 H 31.145 6.837 -6.437 1.00 . A X . 10 TYR HE1 1 1
5 2288 1 1 10 TYR HE2 H 34.371 8.283 -8.877 1.00 . A X . 10 TYR HE2 1 1
5 2289 1 1 10 TYR HH H 31.581 7.680 -9.332 1.00 . A X . 10 TYR HH 1 1
5 2290 1 1 10 TYR N N 34.172 11.206 -3.055 1.00 . A X . 10 TYR N 1 1
5 2291 1 1 10 TYR O O 33.963 8.523 -1.574 1.00 . A X . 10 TYR O 1 1
5 2292 1 1 10 TYR OH O 32.074 6.975 -8.907 1.00 . A X . 10 TYR OH 1 1
5 2293 1 1 11 SER C C 29.875 8.825 -0.556 1.00 . A X . 11 SER C 1 1
5 2294 1 1 11 SER CA C 31.299 8.375 -0.871 1.00 . A X . 11 SER CA 1 1
5 2295 1 1 11 SER CB C 32.184 8.584 0.357 1.00 . A X . 11 SER CB 1 1
5 2296 1 1 11 SER H H 31.226 9.617 -2.587 1.00 . A X . 11 SER H 1 1
5 2297 1 1 11 SER HA H 31.287 7.324 -1.115 1.00 . A X . 11 SER HA 1 1
5 2298 1 1 11 SER HB2 H 31.578 8.577 1.247 1.00 . A X . 11 SER HB2 1 1
5 2299 1 1 11 SER HB3 H 32.912 7.785 0.414 1.00 . A X . 11 SER HB3 1 1
5 2300 1 1 11 SER HG H 32.196 10.530 0.397 1.00 . A X . 11 SER HG 1 1
5 2301 1 1 11 SER N N 31.836 9.118 -2.005 1.00 . A X . 11 SER N 1 1
5 2302 1 1 11 SER O O 29.002 8.004 -0.275 1.00 . A X . 11 SER O 1 1
5 2303 1 1 11 SER OG O 32.846 9.838 0.250 1.00 . A X . 11 SER OG 1 1
5 2304 1 1 12 LYS C C 27.415 10.547 -1.533 1.00 . A X . 12 LYS C 1 1
5 2305 1 1 12 LYS CA C 28.326 10.680 -0.316 1.00 . A X . 12 LYS CA 1 1
5 2306 1 1 12 LYS CB C 28.443 12.155 0.074 1.00 . A X . 12 LYS CB 1 1
5 2307 1 1 12 LYS CD C 29.146 13.730 1.884 1.00 . A X . 12 LYS CD 1 1
5 2308 1 1 12 LYS CE C 30.029 13.880 3.124 1.00 . A X . 12 LYS CE 1 1
5 2309 1 1 12 LYS CG C 29.161 12.270 1.421 1.00 . A X . 12 LYS CG 1 1
5 2310 1 1 12 LYS H H 30.382 10.743 -0.830 1.00 . A X . 12 LYS H 1 1
5 2311 1 1 12 LYS HA H 27.893 10.135 0.509 1.00 . A X . 12 LYS HA 1 1
5 2312 1 1 12 LYS HB2 H 29.005 12.685 -0.682 1.00 . A X . 12 LYS HB2 1 1
5 2313 1 1 12 LYS HB3 H 27.457 12.586 0.157 1.00 . A X . 12 LYS HB3 1 1
5 2314 1 1 12 LYS HD2 H 29.523 14.362 1.092 1.00 . A X . 12 LYS HD2 1 1
5 2315 1 1 12 LYS HD3 H 28.136 14.019 2.126 1.00 . A X . 12 LYS HD3 1 1
5 2316 1 1 12 LYS HE2 H 29.540 14.529 3.836 1.00 . A X . 12 LYS HE2 1 1
5 2317 1 1 12 LYS HE3 H 30.190 12.910 3.571 1.00 . A X . 12 LYS HE3 1 1
5 2318 1 1 12 LYS HG2 H 28.657 11.655 2.151 1.00 . A X . 12 LYS HG2 1 1
5 2319 1 1 12 LYS HG3 H 30.183 11.939 1.314 1.00 . A X . 12 LYS HG3 1 1
5 2320 1 1 12 LYS HZ1 H 31.570 14.188 1.759 1.00 . A X . 12 LYS HZ1 1 1
5 2321 1 1 12 LYS HZ2 H 32.080 14.130 3.380 1.00 . A X . 12 LYS HZ2 1 1
5 2322 1 1 12 LYS HZ3 H 31.283 15.508 2.785 1.00 . A X . 12 LYS HZ3 1 1
5 2323 1 1 12 LYS N N 29.649 10.134 -0.601 1.00 . A X . 12 LYS N 1 1
5 2324 1 1 12 LYS NZ N 31.339 14.471 2.732 1.00 . A X . 12 LYS NZ 1 1
5 2325 1 1 12 LYS O O 26.323 11.113 -1.565 1.00 . A X . 12 LYS O 1 1
5 2326 1 1 13 LYS C C 26.551 8.163 -3.791 1.00 . A X . 13 LYS C 1 1
5 2327 1 1 13 LYS CA C 27.096 9.586 -3.746 1.00 . A X . 13 LYS CA 1 1
5 2328 1 1 13 LYS CB C 27.979 9.849 -4.972 1.00 . A X . 13 LYS CB 1 1
5 2329 1 1 13 LYS CD C 26.067 9.703 -6.609 1.00 . A X . 13 LYS CD 1 1
5 2330 1 1 13 LYS CE C 26.047 9.814 -8.135 1.00 . A X . 13 LYS CE 1 1
5 2331 1 1 13 LYS CG C 27.183 10.596 -6.054 1.00 . A X . 13 LYS CG 1 1
5 2332 1 1 13 LYS H H 28.753 9.368 -2.441 1.00 . A X . 13 LYS H 1 1
5 2333 1 1 13 LYS HA H 26.265 10.275 -3.753 1.00 . A X . 13 LYS HA 1 1
5 2334 1 1 13 LYS HB2 H 28.827 10.450 -4.677 1.00 . A X . 13 LYS HB2 1 1
5 2335 1 1 13 LYS HB3 H 28.332 8.909 -5.369 1.00 . A X . 13 LYS HB3 1 1
5 2336 1 1 13 LYS HD2 H 26.246 8.676 -6.325 1.00 . A X . 13 LYS HD2 1 1
5 2337 1 1 13 LYS HD3 H 25.118 10.027 -6.213 1.00 . A X . 13 LYS HD3 1 1
5 2338 1 1 13 LYS HE2 H 25.214 9.250 -8.525 1.00 . A X . 13 LYS HE2 1 1
5 2339 1 1 13 LYS HE3 H 25.936 10.851 -8.414 1.00 . A X . 13 LYS HE3 1 1
5 2340 1 1 13 LYS HG2 H 26.751 11.492 -5.635 1.00 . A X . 13 LYS HG2 1 1
5 2341 1 1 13 LYS HG3 H 27.850 10.868 -6.859 1.00 . A X . 13 LYS HG3 1 1
5 2342 1 1 13 LYS HZ1 H 27.494 8.336 -8.599 1.00 . A X . 13 LYS HZ1 1 1
5 2343 1 1 13 LYS N N 27.874 9.793 -2.529 1.00 . A X . 13 LYS N 1 1
5 2344 1 1 13 LYS NZ N 27.287 9.289 -8.695 1.00 . A X . 13 LYS NZ 1 1
5 2345 1 1 13 LYS O O 25.376 7.951 -4.085 1.00 . A X . 13 LYS O 1 1
5 2346 1 1 14 LEU C C 25.815 5.623 -2.529 1.00 . A X . 14 LEU C 1 1
5 2347 1 1 14 LEU CA C 26.977 5.798 -3.494 1.00 . A X . 14 LEU CA 1 1
5 2348 1 1 14 LEU CB C 28.124 4.866 -3.088 1.00 . A X . 14 LEU CB 1 1
5 2349 1 1 14 LEU CD1 C 30.456 4.742 -2.214 1.00 . A X . 14 LEU CD1 1 1
5 2350 1 1 14 LEU CD2 C 29.892 6.344 -4.041 1.00 . A X . 14 LEU CD2 1 1
5 2351 1 1 14 LEU CG C 29.378 5.677 -2.765 1.00 . A X . 14 LEU CG 1 1
5 2352 1 1 14 LEU H H 28.328 7.417 -3.255 1.00 . A X . 14 LEU H 1 1
5 2353 1 1 14 LEU HA H 26.651 5.538 -4.489 1.00 . A X . 14 LEU HA 1 1
5 2354 1 1 14 LEU HB2 H 27.830 4.297 -2.217 1.00 . A X . 14 LEU HB2 1 1
5 2355 1 1 14 LEU HB3 H 28.337 4.190 -3.902 1.00 . A X . 14 LEU HB3 1 1
5 2356 1 1 14 LEU HD11 H 30.667 5.001 -1.188 1.00 . A X . 14 LEU HD11 1 1
5 2357 1 1 14 LEU HD12 H 31.356 4.843 -2.803 1.00 . A X . 14 LEU HD12 1 1
5 2358 1 1 14 LEU HD13 H 30.106 3.721 -2.263 1.00 . A X . 14 LEU HD13 1 1
5 2359 1 1 14 LEU HD21 H 30.014 7.402 -3.871 1.00 . A X . 14 LEU HD21 1 1
5 2360 1 1 14 LEU HD22 H 29.180 6.187 -4.839 1.00 . A X . 14 LEU HD22 1 1
5 2361 1 1 14 LEU HD23 H 30.841 5.910 -4.314 1.00 . A X . 14 LEU HD23 1 1
5 2362 1 1 14 LEU HG H 29.145 6.429 -2.025 1.00 . A X . 14 LEU HG 1 1
5 2363 1 1 14 LEU N N 27.407 7.191 -3.490 1.00 . A X . 14 LEU N 1 1
5 2364 1 1 14 LEU O O 24.856 4.906 -2.816 1.00 . A X . 14 LEU O 1 1
5 2365 1 1 15 ASP C C 23.651 7.043 -0.849 1.00 . A X . 15 ASP C 1 1
5 2366 1 1 15 ASP CA C 24.849 6.224 -0.386 1.00 . A X . 15 ASP CA 1 1
5 2367 1 1 15 ASP CB C 25.357 6.756 0.955 1.00 . A X . 15 ASP CB 1 1
5 2368 1 1 15 ASP CG C 25.528 8.269 0.881 1.00 . A X . 15 ASP CG 1 1
5 2369 1 1 15 ASP H H 26.688 6.858 -1.217 1.00 . A X . 15 ASP H 1 1
5 2370 1 1 15 ASP HA H 24.548 5.193 -0.270 1.00 . A X . 15 ASP HA 1 1
5 2371 1 1 15 ASP HB2 H 24.642 6.513 1.730 1.00 . A X . 15 ASP HB2 1 1
5 2372 1 1 15 ASP HB3 H 26.309 6.298 1.185 1.00 . A X . 15 ASP HB3 1 1
5 2373 1 1 15 ASP N N 25.903 6.297 -1.386 1.00 . A X . 15 ASP N 1 1
5 2374 1 1 15 ASP O O 23.132 7.884 -0.115 1.00 . A X . 15 ASP O 1 1
5 2375 1 1 15 ASP OD1 O 25.620 8.781 -0.222 1.00 . A X . 15 ASP OD1 1 1
5 2376 1 1 15 ASP OD2 O 25.564 8.895 1.928 1.00 . A X . 15 ASP OD2 1 1
5 2377 1 1 16 ABA C C 21.920 6.990 -4.107 1.00 . A X . 16 AIB C 1 1
5 2378 1 1 16 ABA CA C 22.103 7.489 -2.681 1.00 . A X . 16 AIB CA 1 1
5 2379 1 1 16 ABA H H 23.699 6.107 -2.609 1.00 . A X . 16 AIB H 1 1
5 2380 1 1 16 ABA N N 23.232 6.786 -2.081 1.00 . A X . 16 AIB N 1 1
5 2381 1 1 16 ABA O O 20.801 6.753 -4.558 1.00 . A X . 16 AIB O 1 1
5 2382 1 1 17 ARG C C 23.151 4.803 -6.163 1.00 . A X . 17 ARG C 1 1
5 2383 1 1 17 ARG CA C 23.003 6.320 -6.171 1.00 . A X . 17 ARG CA 1 1
5 2384 1 1 17 ARG CB C 24.139 6.950 -6.973 1.00 . A X . 17 ARG CB 1 1
5 2385 1 1 17 ARG CD C 22.736 6.985 -9.072 1.00 . A X . 17 ARG CD 1 1
5 2386 1 1 17 ARG CG C 24.061 6.526 -8.447 1.00 . A X . 17 ARG CG 1 1
5 2387 1 1 17 ARG CZ C 20.991 8.552 -8.432 1.00 . A X . 17 ARG CZ 1 1
5 2388 1 1 17 ARG H H 23.901 7.009 -4.383 1.00 . A X . 17 ARG H 1 1
5 2389 1 1 17 ARG HA H 22.057 6.583 -6.618 1.00 . A X . 17 ARG HA 1 1
5 2390 1 1 17 ARG HB2 H 24.072 8.024 -6.898 1.00 . A X . 17 ARG HB2 1 1
5 2391 1 1 17 ARG HB3 H 25.083 6.623 -6.560 1.00 . A X . 17 ARG HB3 1 1
5 2392 1 1 17 ARG HD2 H 22.878 7.149 -10.129 1.00 . A X . 17 ARG HD2 1 1
5 2393 1 1 17 ARG HD3 H 21.992 6.216 -8.928 1.00 . A X . 17 ARG HD3 1 1
5 2394 1 1 17 ARG HE H 22.935 8.829 -8.044 1.00 . A X . 17 ARG HE 1 1
5 2395 1 1 17 ARG HG2 H 24.881 6.973 -8.990 1.00 . A X . 17 ARG HG2 1 1
5 2396 1 1 17 ARG HG3 H 24.133 5.452 -8.516 1.00 . A X . 17 ARG HG3 1 1
5 2397 1 1 17 ARG HH11 H 20.397 6.912 -9.417 1.00 . A X . 17 ARG HH11 1 1
5 2398 1 1 17 ARG HH12 H 19.138 8.011 -8.962 1.00 . A X . 17 ARG HH12 1 1
5 2399 1 1 17 ARG HH21 H 21.286 10.269 -7.447 1.00 . A X . 17 ARG HH21 1 1
5 2400 1 1 17 ARG HH22 H 19.640 9.910 -7.849 1.00 . A X . 17 ARG HH22 1 1
5 2401 1 1 17 ARG N N 23.037 6.815 -4.804 1.00 . A X . 17 ARG N 1 1
5 2402 1 1 17 ARG NE N 22.280 8.227 -8.454 1.00 . A X . 17 ARG NE 1 1
5 2403 1 1 17 ARG NH1 N 20.106 7.762 -8.980 1.00 . A X . 17 ARG NH1 1 1
5 2404 1 1 17 ARG NH2 N 20.609 9.664 -7.865 1.00 . A X . 17 ARG NH2 1 1
5 2405 1 1 17 ARG O O 22.793 4.124 -7.124 1.00 . A X . 17 ARG O 1 1
5 2406 1 1 18 ARG C C 22.958 2.405 -3.731 1.00 . A X . 18 ARG C 1 1
5 2407 1 1 18 ARG CA C 23.834 2.852 -4.882 1.00 . A X . 18 ARG CA 1 1
5 2408 1 1 18 ARG CB C 25.296 2.533 -4.572 1.00 . A X . 18 ARG CB 1 1
5 2409 1 1 18 ARG CD C 26.516 0.501 -3.778 1.00 . A X . 18 ARG CD 1 1
5 2410 1 1 18 ARG CG C 25.562 1.052 -4.839 1.00 . A X . 18 ARG CG 1 1
5 2411 1 1 18 ARG CZ C 28.747 0.922 -4.642 1.00 . A X . 18 ARG CZ 1 1
5 2412 1 1 18 ARG H H 23.901 4.881 -4.304 1.00 . A X . 18 ARG H 1 1
5 2413 1 1 18 ARG HA H 23.535 2.340 -5.785 1.00 . A X . 18 ARG HA 1 1
5 2414 1 1 18 ARG HB2 H 25.937 3.136 -5.203 1.00 . A X . 18 ARG HB2 1 1
5 2415 1 1 18 ARG HB3 H 25.501 2.754 -3.533 1.00 . A X . 18 ARG HB3 1 1
5 2416 1 1 18 ARG HD2 H 26.060 0.596 -2.805 1.00 . A X . 18 ARG HD2 1 1
5 2417 1 1 18 ARG HD3 H 26.710 -0.542 -3.981 1.00 . A X . 18 ARG HD3 1 1
5 2418 1 1 18 ARG HE H 27.901 1.987 -3.173 1.00 . A X . 18 ARG HE 1 1
5 2419 1 1 18 ARG HG2 H 24.630 0.509 -4.804 1.00 . A X . 18 ARG HG2 1 1
5 2420 1 1 18 ARG HG3 H 26.008 0.939 -5.816 1.00 . A X . 18 ARG HG3 1 1
5 2421 1 1 18 ARG HH11 H 27.733 -0.590 -5.476 1.00 . A X . 18 ARG HH11 1 1
5 2422 1 1 18 ARG HH12 H 29.320 -0.311 -6.111 1.00 . A X . 18 ARG HH12 1 1
5 2423 1 1 18 ARG HH21 H 29.983 2.361 -4.001 1.00 . A X . 18 ARG HH21 1 1
5 2424 1 1 18 ARG HH22 H 30.594 1.359 -5.277 1.00 . A X . 18 ARG HH22 1 1
5 2425 1 1 18 ARG N N 23.659 4.285 -5.048 1.00 . A X . 18 ARG N 1 1
5 2426 1 1 18 ARG NE N 27.773 1.242 -3.796 1.00 . A X . 18 ARG NE 1 1
5 2427 1 1 18 ARG NH1 N 28.589 -0.070 -5.475 1.00 . A X . 18 ARG NH1 1 1
5 2428 1 1 18 ARG NH2 N 29.861 1.600 -4.639 1.00 . A X . 18 ARG NH2 1 1
5 2429 1 1 18 ARG O O 23.100 1.306 -3.196 1.00 . A X . 18 ARG O 1 1
5 2430 1 1 19 ALA C C 19.716 3.326 -2.672 1.00 . A X . 19 ALA C 1 1
5 2431 1 1 19 ALA CA C 21.155 3.062 -2.248 1.00 . A X . 19 ALA CA 1 1
5 2432 1 1 19 ALA CB C 21.539 3.986 -1.099 1.00 . A X . 19 ALA CB 1 1
5 2433 1 1 19 ALA H H 22.023 4.164 -3.816 1.00 . A X . 19 ALA H 1 1
5 2434 1 1 19 ALA HA H 21.250 2.038 -1.923 1.00 . A X . 19 ALA HA 1 1
5 2435 1 1 19 ALA HB1 H 20.676 4.561 -0.795 1.00 . A X . 19 ALA HB1 1 1
5 2436 1 1 19 ALA HB2 H 22.323 4.655 -1.435 1.00 . A X . 19 ALA HB2 1 1
5 2437 1 1 19 ALA HB3 H 21.896 3.399 -0.266 1.00 . A X . 19 ALA HB3 1 1
5 2438 1 1 19 ALA N N 22.062 3.303 -3.349 1.00 . A X . 19 ALA N 1 1
5 2439 1 1 19 ALA O O 18.791 2.655 -2.215 1.00 . A X . 19 ALA O 1 1
5 2440 1 1 20 GLN C C 17.771 3.666 -5.128 1.00 . A X . 20 GLN C 1 1
5 2441 1 1 20 GLN CA C 18.189 4.636 -4.031 1.00 . A X . 20 GLN CA 1 1
5 2442 1 1 20 GLN CB C 18.150 6.071 -4.563 1.00 . A X . 20 GLN CB 1 1
5 2443 1 1 20 GLN CD C 16.577 6.968 -6.290 1.00 . A X . 20 GLN CD 1 1
5 2444 1 1 20 GLN CG C 16.703 6.473 -4.852 1.00 . A X . 20 GLN CG 1 1
5 2445 1 1 20 GLN H H 20.304 4.811 -3.893 1.00 . A X . 20 GLN H 1 1
5 2446 1 1 20 GLN HA H 17.497 4.549 -3.204 1.00 . A X . 20 GLN HA 1 1
5 2447 1 1 20 GLN HB2 H 18.569 6.738 -3.826 1.00 . A X . 20 GLN HB2 1 1
5 2448 1 1 20 GLN HB3 H 18.727 6.132 -5.474 1.00 . A X . 20 GLN HB3 1 1
5 2449 1 1 20 GLN HE21 H 15.988 5.208 -6.996 1.00 . A X . 20 GLN HE21 1 1
5 2450 1 1 20 GLN HE22 H 16.108 6.449 -8.148 1.00 . A X . 20 GLN HE22 1 1
5 2451 1 1 20 GLN HG2 H 16.057 5.620 -4.708 1.00 . A X . 20 GLN HG2 1 1
5 2452 1 1 20 GLN HG3 H 16.410 7.263 -4.176 1.00 . A X . 20 GLN HG3 1 1
5 2453 1 1 20 GLN N N 19.530 4.307 -3.555 1.00 . A X . 20 GLN N 1 1
5 2454 1 1 20 GLN NE2 N 16.192 6.139 -7.222 1.00 . A X . 20 GLN NE2 1 1
5 2455 1 1 20 GLN O O 16.584 3.412 -5.330 1.00 . A X . 20 GLN O 1 1
5 2456 1 1 20 GLN OE1 O 16.833 8.139 -6.569 1.00 . A X . 20 GLN OE1 1 1
5 2457 1 1 21 ASP C C 18.477 0.748 -6.306 1.00 . A X . 21 ASP C 1 1
5 2458 1 1 21 ASP CA C 18.480 2.157 -6.886 1.00 . A X . 21 ASP CA 1 1
5 2459 1 1 21 ASP CB C 19.545 2.264 -7.980 1.00 . A X . 21 ASP CB 1 1
5 2460 1 1 21 ASP CG C 20.441 1.030 -7.956 1.00 . A X . 21 ASP CG 1 1
5 2461 1 1 21 ASP H H 19.684 3.345 -5.614 1.00 . A X . 21 ASP H 1 1
5 2462 1 1 21 ASP HA H 17.511 2.368 -7.313 1.00 . A X . 21 ASP HA 1 1
5 2463 1 1 21 ASP HB2 H 19.061 2.337 -8.945 1.00 . A X . 21 ASP HB2 1 1
5 2464 1 1 21 ASP HB3 H 20.147 3.147 -7.809 1.00 . A X . 21 ASP HB3 1 1
5 2465 1 1 21 ASP N N 18.755 3.114 -5.825 1.00 . A X . 21 ASP N 1 1
5 2466 1 1 21 ASP O O 18.165 -0.225 -6.993 1.00 . A X . 21 ASP O 1 1
5 2467 1 1 21 ASP OD1 O 21.076 0.804 -6.939 1.00 . A X . 21 ASP OD1 1 1
5 2468 1 1 21 ASP OD2 O 20.480 0.331 -8.954 1.00 . A X . 21 ASP OD2 1 1
5 2469 1 1 22 PHE C C 17.753 -0.725 -3.323 1.00 . A X . 22 PHE C 1 1
5 2470 1 1 22 PHE CA C 18.889 -0.612 -4.332 1.00 . A X . 22 PHE CA 1 1
5 2471 1 1 22 PHE CB C 20.221 -0.723 -3.600 1.00 . A X . 22 PHE CB 1 1
5 2472 1 1 22 PHE CD1 C 20.681 -3.087 -4.277 1.00 . A X . 22 PHE CD1 1 1
5 2473 1 1 22 PHE CD2 C 20.450 -2.576 -1.921 1.00 . A X . 22 PHE CD2 1 1
5 2474 1 1 22 PHE CE1 C 20.892 -4.429 -3.969 1.00 . A X . 22 PHE CE1 1 1
5 2475 1 1 22 PHE CE2 C 20.660 -3.921 -1.609 1.00 . A X . 22 PHE CE2 1 1
5 2476 1 1 22 PHE CG C 20.461 -2.163 -3.256 1.00 . A X . 22 PHE CG 1 1
5 2477 1 1 22 PHE CZ C 20.881 -4.851 -2.632 1.00 . A X . 22 PHE CZ 1 1
5 2478 1 1 22 PHE H H 19.079 1.472 -4.544 1.00 . A X . 22 PHE H 1 1
5 2479 1 1 22 PHE HA H 18.814 -1.420 -5.046 1.00 . A X . 22 PHE HA 1 1
5 2480 1 1 22 PHE HB2 H 21.016 -0.364 -4.240 1.00 . A X . 22 PHE HB2 1 1
5 2481 1 1 22 PHE HB3 H 20.184 -0.134 -2.696 1.00 . A X . 22 PHE HB3 1 1
5 2482 1 1 22 PHE HD1 H 20.692 -2.764 -5.307 1.00 . A X . 22 PHE HD1 1 1
5 2483 1 1 22 PHE HD2 H 20.280 -1.859 -1.131 1.00 . A X . 22 PHE HD2 1 1
5 2484 1 1 22 PHE HE1 H 21.056 -5.136 -4.760 1.00 . A X . 22 PHE HE1 1 1
5 2485 1 1 22 PHE HE2 H 20.649 -4.241 -0.581 1.00 . A X . 22 PHE HE2 1 1
5 2486 1 1 22 PHE HZ H 21.043 -5.892 -2.393 1.00 . A X . 22 PHE HZ 1 1
5 2487 1 1 22 PHE N N 18.836 0.660 -5.029 1.00 . A X . 22 PHE N 1 1
5 2488 1 1 22 PHE O O 16.861 -1.557 -3.467 1.00 . A X . 22 PHE O 1 1
5 2489 1 1 23 VAL C C 15.383 0.332 -1.843 1.00 . A X . 23 VAL C 1 1
5 2490 1 1 23 VAL CA C 16.770 0.097 -1.255 1.00 . A X . 23 VAL CA 1 1
5 2491 1 1 23 VAL CB C 17.063 1.176 -0.212 1.00 . A X . 23 VAL CB 1 1
5 2492 1 1 23 VAL CG1 C 15.978 1.155 0.868 1.00 . A X . 23 VAL CG1 1 1
5 2493 1 1 23 VAL CG2 C 18.428 0.912 0.428 1.00 . A X . 23 VAL CG2 1 1
5 2494 1 1 23 VAL H H 18.535 0.759 -2.228 1.00 . A X . 23 VAL H 1 1
5 2495 1 1 23 VAL HA H 16.786 -0.866 -0.769 1.00 . A X . 23 VAL HA 1 1
5 2496 1 1 23 VAL HB H 17.071 2.143 -0.692 1.00 . A X . 23 VAL HB 1 1
5 2497 1 1 23 VAL HG11 H 16.412 1.419 1.821 1.00 . A X . 23 VAL HG11 1 1
5 2498 1 1 23 VAL HG12 H 15.550 0.164 0.930 1.00 . A X . 23 VAL HG12 1 1
5 2499 1 1 23 VAL HG13 H 15.205 1.865 0.615 1.00 . A X . 23 VAL HG13 1 1
5 2500 1 1 23 VAL HG21 H 19.208 1.255 -0.235 1.00 . A X . 23 VAL HG21 1 1
5 2501 1 1 23 VAL HG22 H 18.545 -0.147 0.605 1.00 . A X . 23 VAL HG22 1 1
5 2502 1 1 23 VAL HG23 H 18.493 1.443 1.367 1.00 . A X . 23 VAL HG23 1 1
5 2503 1 1 23 VAL N N 17.797 0.116 -2.292 1.00 . A X . 23 VAL N 1 1
5 2504 1 1 23 VAL O O 14.395 0.392 -1.113 1.00 . A X . 23 VAL O 1 1
5 2505 1 1 24 GLN C C 13.334 -0.606 -4.125 1.00 . A X . 24 GLN C 1 1
5 2506 1 1 24 GLN CA C 14.032 0.711 -3.819 1.00 . A X . 24 GLN CA 1 1
5 2507 1 1 24 GLN CB C 14.247 1.509 -5.106 1.00 . A X . 24 GLN CB 1 1
5 2508 1 1 24 GLN CD C 14.584 3.524 -3.634 1.00 . A X . 24 GLN CD 1 1
5 2509 1 1 24 GLN CG C 13.876 2.978 -4.875 1.00 . A X . 24 GLN CG 1 1
5 2510 1 1 24 GLN H H 16.125 0.425 -3.699 1.00 . A X . 24 GLN H 1 1
5 2511 1 1 24 GLN HA H 13.403 1.280 -3.153 1.00 . A X . 24 GLN HA 1 1
5 2512 1 1 24 GLN HB2 H 15.286 1.443 -5.400 1.00 . A X . 24 GLN HB2 1 1
5 2513 1 1 24 GLN HB3 H 13.623 1.102 -5.889 1.00 . A X . 24 GLN HB3 1 1
5 2514 1 1 24 GLN HE21 H 15.982 2.113 -3.621 1.00 . A X . 24 GLN HE21 1 1
5 2515 1 1 24 GLN HE22 H 16.094 3.257 -2.374 1.00 . A X . 24 GLN HE22 1 1
5 2516 1 1 24 GLN HG2 H 14.168 3.559 -5.736 1.00 . A X . 24 GLN HG2 1 1
5 2517 1 1 24 GLN HG3 H 12.807 3.058 -4.737 1.00 . A X . 24 GLN HG3 1 1
5 2518 1 1 24 GLN N N 15.310 0.472 -3.162 1.00 . A X . 24 GLN N 1 1
5 2519 1 1 24 GLN NE2 N 15.642 2.914 -3.172 1.00 . A X . 24 GLN NE2 1 1
5 2520 1 1 24 GLN O O 12.113 -0.650 -4.261 1.00 . A X . 24 GLN O 1 1
5 2521 1 1 24 GLN OE1 O 14.160 4.533 -3.073 1.00 . A X . 24 GLN OE1 1 1
5 2522 1 1 25 TRP C C 13.479 -3.752 -3.133 1.00 . A X . 25 TRP C 1 1
5 2523 1 1 25 TRP CA C 13.525 -2.994 -4.441 1.00 . A X . 25 TRP CA 1 1
5 2524 1 1 25 TRP CB C 14.366 -3.791 -5.417 1.00 . A X . 25 TRP CB 1 1
5 2525 1 1 25 TRP CD1 C 13.735 -6.188 -5.012 1.00 . A X . 25 TRP CD1 1 1
5 2526 1 1 25 TRP CD2 C 15.571 -5.568 -3.893 1.00 . A X . 25 TRP CD2 1 1
5 2527 1 1 25 TRP CE2 C 15.355 -6.923 -3.567 1.00 . A X . 25 TRP CE2 1 1
5 2528 1 1 25 TRP CE3 C 16.662 -4.914 -3.324 1.00 . A X . 25 TRP CE3 1 1
5 2529 1 1 25 TRP CG C 14.550 -5.137 -4.819 1.00 . A X . 25 TRP CG 1 1
5 2530 1 1 25 TRP CH2 C 17.299 -6.926 -2.134 1.00 . A X . 25 TRP CH2 1 1
5 2531 1 1 25 TRP CZ2 C 16.209 -7.602 -2.693 1.00 . A X . 25 TRP CZ2 1 1
5 2532 1 1 25 TRP CZ3 C 17.517 -5.580 -2.454 1.00 . A X . 25 TRP CZ3 1 1
5 2533 1 1 25 TRP H H 15.080 -1.607 -4.044 1.00 . A X . 25 TRP H 1 1
5 2534 1 1 25 TRP HA H 12.527 -2.897 -4.835 1.00 . A X . 25 TRP HA 1 1
5 2535 1 1 25 TRP HB2 H 13.852 -3.873 -6.366 1.00 . A X . 25 TRP HB2 1 1
5 2536 1 1 25 TRP HB3 H 15.327 -3.317 -5.552 1.00 . A X . 25 TRP HB3 1 1
5 2537 1 1 25 TRP HD1 H 12.858 -6.184 -5.641 1.00 . A X . 25 TRP HD1 1 1
5 2538 1 1 25 TRP HE1 H 13.816 -8.158 -4.252 1.00 . A X . 25 TRP HE1 1 1
5 2539 1 1 25 TRP HE3 H 16.834 -3.881 -3.548 1.00 . A X . 25 TRP HE3 1 1
5 2540 1 1 25 TRP HH2 H 17.966 -7.439 -1.458 1.00 . A X . 25 TRP HH2 1 1
5 2541 1 1 25 TRP HZ2 H 16.030 -8.633 -2.443 1.00 . A X . 25 TRP HZ2 1 1
5 2542 1 1 25 TRP HZ3 H 18.350 -5.049 -2.027 1.00 . A X . 25 TRP HZ3 1 1
5 2543 1 1 25 TRP N N 14.105 -1.685 -4.194 1.00 . A X . 25 TRP N 1 1
5 2544 1 1 25 TRP NE1 N 14.216 -7.264 -4.278 1.00 . A X . 25 TRP NE1 1 1
5 2545 1 1 25 TRP O O 12.516 -4.462 -2.840 1.00 . A X . 25 TRP O 1 1
5 2546 1 1 26 LEU C C 13.320 -4.087 -0.304 1.00 . A X . 26 LEU C 1 1
5 2547 1 1 26 LEU CA C 14.624 -4.271 -1.072 1.00 . A X . 26 LEU CA 1 1
5 2548 1 1 26 LEU CB C 15.794 -3.718 -0.246 1.00 . A X . 26 LEU CB 1 1
5 2549 1 1 26 LEU CD1 C 16.765 -5.859 0.701 1.00 . A X . 26 LEU CD1 1 1
5 2550 1 1 26 LEU CD2 C 16.806 -3.753 2.041 1.00 . A X . 26 LEU CD2 1 1
5 2551 1 1 26 LEU CG C 16.000 -4.566 1.026 1.00 . A X . 26 LEU CG 1 1
5 2552 1 1 26 LEU H H 15.276 -3.019 -2.642 1.00 . A X . 26 LEU H 1 1
5 2553 1 1 26 LEU HA H 14.793 -5.316 -1.260 1.00 . A X . 26 LEU HA 1 1
5 2554 1 1 26 LEU HB2 H 16.693 -3.729 -0.840 1.00 . A X . 26 LEU HB2 1 1
5 2555 1 1 26 LEU HB3 H 15.574 -2.699 0.040 1.00 . A X . 26 LEU HB3 1 1
5 2556 1 1 26 LEU HD11 H 16.132 -6.532 0.136 1.00 . A X . 26 LEU HD11 1 1
5 2557 1 1 26 LEU HD12 H 17.057 -6.340 1.623 1.00 . A X . 26 LEU HD12 1 1
5 2558 1 1 26 LEU HD13 H 17.647 -5.625 0.129 1.00 . A X . 26 LEU HD13 1 1
5 2559 1 1 26 LEU HD21 H 16.273 -2.843 2.277 1.00 . A X . 26 LEU HD21 1 1
5 2560 1 1 26 LEU HD22 H 17.770 -3.507 1.621 1.00 . A X . 26 LEU HD22 1 1
5 2561 1 1 26 LEU HD23 H 16.941 -4.335 2.941 1.00 . A X . 26 LEU HD23 1 1
5 2562 1 1 26 LEU HG H 15.042 -4.818 1.453 1.00 . A X . 26 LEU HG 1 1
5 2563 1 1 26 LEU N N 14.540 -3.596 -2.349 1.00 . A X . 26 LEU N 1 1
5 2564 1 1 26 LEU O O 12.837 -5.009 0.352 1.00 . A X . 26 LEU O 1 1
5 2565 1 1 27 MET C C 10.313 -2.862 -0.592 1.00 . A X . 27 MET C 1 1
5 2566 1 1 27 MET CA C 11.514 -2.580 0.308 1.00 . A X . 27 MET CA 1 1
5 2567 1 1 27 MET CB C 11.505 -1.112 0.748 1.00 . A X . 27 MET CB 1 1
5 2568 1 1 27 MET CE C 10.237 1.915 -1.677 1.00 . A X . 27 MET CE 1 1
5 2569 1 1 27 MET CG C 11.447 -0.203 -0.482 1.00 . A X . 27 MET CG 1 1
5 2570 1 1 27 MET H H 13.193 -2.181 -0.925 1.00 . A X . 27 MET H 1 1
5 2571 1 1 27 MET HA H 11.445 -3.205 1.185 1.00 . A X . 27 MET HA 1 1
5 2572 1 1 27 MET HB2 H 10.640 -0.931 1.371 1.00 . A X . 27 MET HB2 1 1
5 2573 1 1 27 MET HB3 H 12.406 -0.900 1.307 1.00 . A X . 27 MET HB3 1 1
5 2574 1 1 27 MET HE1 H 10.615 1.549 -2.621 1.00 . A X . 27 MET HE1 1 1
5 2575 1 1 27 MET HE2 H 11.000 2.501 -1.190 1.00 . A X . 27 MET HE2 1 1
5 2576 1 1 27 MET HE3 H 9.366 2.530 -1.845 1.00 . A X . 27 MET HE3 1 1
5 2577 1 1 27 MET HG2 H 12.171 0.593 -0.374 1.00 . A X . 27 MET HG2 1 1
5 2578 1 1 27 MET HG3 H 11.671 -0.779 -1.369 1.00 . A X . 27 MET HG3 1 1
5 2579 1 1 27 MET N N 12.759 -2.880 -0.388 1.00 . A X . 27 MET N 1 1
5 2580 1 1 27 MET O O 10.387 -3.690 -1.499 1.00 . A X . 27 MET O 1 1
5 2581 1 1 27 MET SD S 9.790 0.510 -0.626 1.00 . A X . 27 MET SD 1 1
5 2582 1 1 28 ASN C C 7.564 -3.817 -1.103 1.00 . A X . 28 ASN C 1 1
5 2583 1 1 28 ASN CA C 7.998 -2.355 -1.123 1.00 . A X . 28 ASN CA 1 1
5 2584 1 1 28 ASN CB C 8.242 -1.914 -2.569 1.00 . A X . 28 ASN CB 1 1
5 2585 1 1 28 ASN CG C 6.949 -2.027 -3.372 1.00 . A X . 28 ASN CG 1 1
5 2586 1 1 28 ASN H H 9.208 -1.522 0.405 1.00 . A X . 28 ASN H 1 1
5 2587 1 1 28 ASN HA H 7.208 -1.749 -0.703 1.00 . A X . 28 ASN HA 1 1
5 2588 1 1 28 ASN HB2 H 8.580 -0.889 -2.579 1.00 . A X . 28 ASN HB2 1 1
5 2589 1 1 28 ASN HB3 H 8.994 -2.544 -3.014 1.00 . A X . 28 ASN HB3 1 1
5 2590 1 1 28 ASN HD21 H 5.802 -2.260 -1.769 1.00 . A X . 28 ASN HD21 1 1
5 2591 1 1 28 ASN HD22 H 4.983 -2.277 -3.257 1.00 . A X . 28 ASN HD22 1 1
5 2592 1 1 28 ASN N N 9.209 -2.168 -0.332 1.00 . A X . 28 ASN N 1 1
5 2593 1 1 28 ASN ND2 N 5.817 -2.203 -2.747 1.00 . A X . 28 ASN ND2 1 1
5 2594 1 1 28 ASN O O 7.021 -4.327 -2.082 1.00 . A X . 28 ASN O 1 1
5 2595 1 1 28 ASN OD1 O 6.974 -1.954 -4.601 1.00 . A X . 28 ASN OD1 1 1
5 2596 1 1 29 THR C C 6.891 -6.166 1.553 1.00 . A X . 29 THR C 1 1
5 2597 1 1 29 THR CA C 7.439 -5.889 0.156 1.00 . A X . 29 THR CA 1 1
5 2598 1 1 29 THR CB C 8.659 -6.777 -0.100 1.00 . A X . 29 THR CB 1 1
5 2599 1 1 29 THR CG2 C 8.888 -6.913 -1.606 1.00 . A X . 29 THR CG2 1 1
5 2600 1 1 29 THR H H 8.245 -4.027 0.768 1.00 . A X . 29 THR H 1 1
5 2601 1 1 29 THR HA H 6.678 -6.124 -0.571 1.00 . A X . 29 THR HA 1 1
5 2602 1 1 29 THR HB H 8.487 -7.756 0.324 1.00 . A X . 29 THR HB 1 1
5 2603 1 1 29 THR HG1 H 10.418 -5.952 -0.192 1.00 . A X . 29 THR HG1 1 1
5 2604 1 1 29 THR HG21 H 8.179 -7.617 -2.016 1.00 . A X . 29 THR HG21 1 1
5 2605 1 1 29 THR HG22 H 9.892 -7.265 -1.787 1.00 . A X . 29 THR HG22 1 1
5 2606 1 1 29 THR HG23 H 8.753 -5.951 -2.078 1.00 . A X . 29 THR HG23 1 1
5 2607 1 1 29 THR N N 7.808 -4.485 0.019 1.00 . A X . 29 THR N 1 1
5 2608 1 1 29 THR O O 7.643 -6.186 2.527 1.00 . A X . 29 THR O 1 1
5 2609 1 1 29 THR OG1 O 9.803 -6.193 0.505 1.00 . A X . 29 THR OG1 1 1
5 2610 1 1 30 NH2 HN1 H 5.015 -6.363 0.933 1.00 . A X . 30 NH2 HN1 1 1
5 2611 1 1 30 NH2 HN2 H 5.252 -6.558 2.602 1.00 . A X . 30 NH2 HN2 1 1
5 2612 1 1 30 NH2 N N 5.613 -6.380 1.709 1.00 . A X . 30 NH2 N 1 1
5 2613 2 2 1 . C C 32.339 9.615 -11.078 1.00 . B X . 101 GGL C 1 1
5 2614 2 2 1 . CA C 31.951 10.386 -9.819 1.00 . B X . 101 GGL CA 1 1
5 2615 2 2 1 . CB C 30.475 10.781 -9.896 1.00 . B X . 101 GGL CB 1 1
5 2616 2 2 1 . CD C 28.143 10.084 -9.328 1.00 . B X . 101 GGL CD 1 1
5 2617 2 2 1 . CG C 29.617 9.707 -9.223 1.00 . B X . 101 GGL CG 1 1
5 2618 2 2 1 . H H 33.485 11.594 -8.996 1.00 . B X . 101 GGL H 1 1
5 2619 2 2 1 . HA H 32.098 9.751 -8.960 1.00 . B X . 101 GGL HA 1 1
5 2620 2 2 1 . HB2 H 30.181 10.876 -10.931 1.00 . B X . 101 GGL HB2 1 1
5 2621 2 2 1 . HB3 H 30.331 11.725 -9.393 1.00 . B X . 101 GGL HB3 1 1
5 2622 2 2 1 . HG2 H 29.779 8.756 -9.710 1.00 . B X . 101 GGL HG2 1 1
5 2623 2 2 1 . HG3 H 29.891 9.628 -8.181 1.00 . B X . 101 GGL HG3 1 1
5 2624 2 2 1 . N N 32.778 11.579 -9.674 1.00 . B X . 101 GGL N 1 1
5 2625 2 2 1 . O O 32.875 8.528 -10.940 1.00 . B X . 101 GGL O 1 1
5 2626 2 2 1 . OE1 O 27.797 11.112 -9.907 1.00 . B X . 101 GGL OE1 1 1
5 2627 2 2 1 . OXT O 32.139 10.146 -12.158 1.00 . B X . 101 GGL OXT 1 1
5 2628 3 2 1 . C C 31.877 15.555 -13.014 1.00 . C X . 102 GGL C 1 1
5 2629 3 2 1 . CA C 31.869 15.475 -11.490 1.00 . C X . 102 GGL CA 1 1
5 2630 3 2 1 . CB C 33.239 14.999 -10.997 1.00 . C X . 102 GGL CB 1 1
5 2631 3 2 1 . CD C 32.587 12.645 -10.443 1.00 . C X . 102 GGL CD 1 1
5 2632 3 2 1 . CG C 33.059 13.979 -9.871 1.00 . C X . 102 GGL CG 1 1
5 2633 3 2 1 . H H 30.908 13.608 -11.204 1.00 . C X . 102 GGL H 1 1
5 2634 3 2 1 . HA H 31.680 16.461 -11.089 1.00 . C X . 102 GGL HA 1 1
5 2635 3 2 1 . HB2 H 33.774 14.540 -11.817 1.00 . C X . 102 GGL HB2 1 1
5 2636 3 2 1 . HB3 H 33.801 15.843 -10.628 1.00 . C X . 102 GGL HB3 1 1
5 2637 3 2 1 . HG2 H 34.004 13.834 -9.366 1.00 . C X . 102 GGL HG2 1 1
5 2638 3 2 1 . HG3 H 32.329 14.345 -9.166 1.00 . C X . 102 GGL HG3 1 1
5 2639 3 2 1 . N N 30.824 14.568 -11.030 1.00 . C X . 102 GGL N 1 1
5 2640 3 2 1 . O O 31.451 14.597 -13.639 1.00 . C X . 102 GGL O 1 1
5 2641 3 2 1 . OE1 O 32.176 12.569 -11.601 1.00 . C X . 102 GGL OE1 1 1
5 2642 3 2 1 . OXT O 32.337 16.558 -13.533 1.00 . C X . 102 GGL OXT 1 1
5 2643 4 3 1 PLM C1 C 29.747 15.025 -10.399 1.00 . D X . 103 PLM C1 1 1
5 2644 4 3 1 PLM C2 C 28.558 14.072 -10.322 1.00 . D X . 103 PLM C2 1 1
5 2645 4 3 1 PLM C3 C 27.437 14.558 -11.243 1.00 . D X . 103 PLM C3 1 1
5 2646 4 3 1 PLM C4 C 26.373 13.467 -11.369 1.00 . D X . 103 PLM C4 1 1
5 2647 4 3 1 PLM C5 C 26.708 12.559 -12.555 1.00 . D X . 103 PLM C5 1 1
5 2648 4 3 1 PLM C6 C 25.652 11.456 -12.670 1.00 . D X . 103 PLM C6 1 1
5 2649 4 3 1 PLM C7 C 26.244 10.257 -13.415 1.00 . D X . 103 PLM C7 1 1
5 2650 4 3 1 PLM C8 C 26.900 9.304 -12.414 1.00 . D X . 103 PLM C8 1 1
5 2651 4 3 1 PLM C9 C 27.509 8.111 -13.162 1.00 . D X . 103 PLM C9 1 1
5 2652 4 3 1 PLM CA C 27.293 6.819 -12.364 1.00 . D X . 103 PLM CA 1 1
5 2653 4 3 1 PLM CB C 28.066 6.887 -11.043 1.00 . D X . 103 PLM CB 1 1
5 2654 4 3 1 PLM CC C 27.727 5.660 -10.193 1.00 . D X . 103 PLM CC 1 1
5 2655 4 3 1 PLM CD C 28.748 5.519 -9.056 1.00 . D X . 103 PLM CD 1 1
5 2656 4 3 1 PLM CE C 28.032 5.206 -7.734 1.00 . D X . 103 PLM CE 1 1
5 2657 4 3 1 PLM CF C 27.361 3.832 -7.816 1.00 . D X . 103 PLM CF 1 1
5 2658 4 3 1 PLM CG C 28.172 2.819 -7.006 1.00 . D X . 103 PLM CG 1 1
5 2659 4 3 1 PLM H21 H 28.872 13.085 -10.630 1.00 . D X . 103 PLM H21 1 1
5 2660 4 3 1 PLM H22 H 28.196 14.032 -9.306 1.00 . D X . 103 PLM H22 1 1
5 2661 4 3 1 PLM H31 H 26.992 15.450 -10.827 1.00 . D X . 103 PLM H31 1 1
5 2662 4 3 1 PLM H32 H 27.843 14.780 -12.218 1.00 . D X . 103 PLM H32 1 1
5 2663 4 3 1 PLM H41 H 25.407 13.923 -11.528 1.00 . D X . 103 PLM H41 1 1
5 2664 4 3 1 PLM H42 H 26.348 12.881 -10.461 1.00 . D X . 103 PLM H42 1 1
5 2665 4 3 1 PLM H51 H 26.718 13.141 -13.464 1.00 . D X . 103 PLM H51 1 1
5 2666 4 3 1 PLM H52 H 27.680 12.113 -12.403 1.00 . D X . 103 PLM H52 1 1
5 2667 4 3 1 PLM H61 H 24.799 11.832 -13.214 1.00 . D X . 103 PLM H61 1 1
5 2668 4 3 1 PLM H62 H 25.343 11.150 -11.681 1.00 . D X . 103 PLM H62 1 1
5 2669 4 3 1 PLM H71 H 25.458 9.738 -13.944 1.00 . D X . 103 PLM H71 1 1
5 2670 4 3 1 PLM H72 H 26.984 10.602 -14.122 1.00 . D X . 103 PLM H72 1 1
5 2671 4 3 1 PLM H81 H 26.158 8.954 -11.712 1.00 . D X . 103 PLM H81 1 1
5 2672 4 3 1 PLM H82 H 27.679 9.826 -11.880 1.00 . D X . 103 PLM H82 1 1
5 2673 4 3 1 PLM H91 H 27.037 8.017 -14.129 1.00 . D X . 103 PLM H91 1 1
5 2674 4 3 1 PLM H92 H 28.567 8.276 -13.296 1.00 . D X . 103 PLM H92 1 1
5 2675 4 3 1 PLM HA1 H 26.239 6.688 -12.160 1.00 . D X . 103 PLM HA1 1 1
5 2676 4 3 1 PLM HA2 H 27.650 5.980 -12.943 1.00 . D X . 103 PLM HA2 1 1
5 2677 4 3 1 PLM HB1 H 27.790 7.781 -10.507 1.00 . D X . 103 PLM HB1 1 1
5 2678 4 3 1 PLM HB2 H 29.126 6.901 -11.248 1.00 . D X . 103 PLM HB2 1 1
5 2679 4 3 1 PLM HC1 H 26.736 5.772 -9.781 1.00 . D X . 103 PLM HC1 1 1
5 2680 4 3 1 PLM HC2 H 27.758 4.776 -10.813 1.00 . D X . 103 PLM HC2 1 1
5 2681 4 3 1 PLM HD1 H 29.434 4.719 -9.288 1.00 . D X . 103 PLM HD1 1 1
5 2682 4 3 1 PLM HD2 H 29.299 6.443 -8.955 1.00 . D X . 103 PLM HD2 1 1
5 2683 4 3 1 PLM HE1 H 27.286 5.961 -7.539 1.00 . D X . 103 PLM HE1 1 1
5 2684 4 3 1 PLM HE2 H 28.753 5.201 -6.929 1.00 . D X . 103 PLM HE2 1 1
5 2685 4 3 1 PLM HF1 H 26.361 3.897 -7.412 1.00 . D X . 103 PLM HF1 1 1
5 2686 4 3 1 PLM HF2 H 27.312 3.509 -8.843 1.00 . D X . 103 PLM HF2 1 1
5 2687 4 3 1 PLM HG1 H 29.192 2.810 -7.360 1.00 . D X . 103 PLM HG1 1 1
5 2688 4 3 1 PLM HG2 H 28.157 3.098 -5.963 1.00 . D X . 103 PLM HG2 1 1
5 2689 4 3 1 PLM HG3 H 27.740 1.836 -7.122 1.00 . D X . 103 PLM HG3 1 1
5 2690 4 3 1 PLM O2 O 29.717 16.116 -9.829 1.00 . D X . 103 PLM O2 1 1
6 2691 1 1 1 HIS C C 38.890 2.300 -4.950 1.00 . A X . 1 HIS C 1 1
6 2692 1 1 1 HIS CA C 37.426 2.076 -5.310 1.00 . A X . 1 HIS CA 1 1
6 2693 1 1 1 HIS CB C 37.316 1.035 -6.426 1.00 . A X . 1 HIS CB 1 1
6 2694 1 1 1 HIS CD2 C 35.132 -0.412 -6.632 1.00 . A X . 1 HIS CD2 1 1
6 2695 1 1 1 HIS CE1 C 33.775 1.154 -7.267 1.00 . A X . 1 HIS CE1 1 1
6 2696 1 1 1 HIS CG C 35.866 0.746 -6.701 1.00 . A X . 1 HIS CG 1 1
6 2697 1 1 1 HIS H1 H 36.534 3.268 -6.766 1.00 . A X . 1 HIS H1 1 1
6 2698 1 1 1 HIS H2 H 37.534 4.121 -5.690 1.00 . A X . 1 HIS H2 1 1
6 2699 1 1 1 HIS H3 H 36.000 3.590 -5.187 1.00 . A X . 1 HIS H3 1 1
6 2700 1 1 1 HIS HA H 36.892 1.726 -4.439 1.00 . A X . 1 HIS HA 1 1
6 2701 1 1 1 HIS HB2 H 37.784 1.417 -7.323 1.00 . A X . 1 HIS HB2 1 1
6 2702 1 1 1 HIS HB3 H 37.811 0.124 -6.117 1.00 . A X . 1 HIS HB3 1 1
6 2703 1 1 1 HIS HD2 H 35.519 -1.379 -6.346 1.00 . A X . 1 HIS HD2 1 1
6 2704 1 1 1 HIS HE1 H 32.887 1.682 -7.580 1.00 . A X . 1 HIS HE1 1 1
6 2705 1 1 1 HIS HE2 H 33.069 -0.790 -7.031 1.00 . A X . 1 HIS HE2 1 1
6 2706 1 1 1 HIS N N 36.829 3.361 -5.773 1.00 . A X . 1 HIS N 1 1
6 2707 1 1 1 HIS ND1 N 34.981 1.731 -7.107 1.00 . A X . 1 HIS ND1 1 1
6 2708 1 1 1 HIS NE2 N 33.812 -0.152 -6.991 1.00 . A X . 1 HIS NE2 1 1
6 2709 1 1 1 HIS O O 39.544 1.419 -4.392 1.00 . A X . 1 HIS O 1 1
6 2710 1 1 2 ABA C C 41.112 3.497 -3.521 1.00 . A X . 2 AIB C 1 1
6 2711 1 1 2 ABA CA C 40.789 3.814 -4.976 1.00 . A X . 2 AIB CA 1 1
6 2712 1 1 2 ABA H H 38.831 4.149 -5.715 1.00 . A X . 2 AIB H 1 1
6 2713 1 1 2 ABA N N 39.399 3.485 -5.272 1.00 . A X . 2 AIB N 1 1
6 2714 1 1 2 ABA O O 42.264 3.238 -3.174 1.00 . A X . 2 AIB O 1 1
6 2715 1 1 3 GLN C C 41.043 4.395 -0.596 1.00 . A X . 3 GLN C 1 1
6 2716 1 1 3 GLN CA C 40.279 3.252 -1.254 1.00 . A X . 3 GLN CA 1 1
6 2717 1 1 3 GLN CB C 41.050 1.943 -1.072 1.00 . A X . 3 GLN CB 1 1
6 2718 1 1 3 GLN CD C 41.245 -0.121 0.330 1.00 . A X . 3 GLN CD 1 1
6 2719 1 1 3 GLN CG C 40.431 1.143 0.075 1.00 . A X . 3 GLN CG 1 1
6 2720 1 1 3 GLN H H 39.194 3.747 -3.006 1.00 . A X . 3 GLN H 1 1
6 2721 1 1 3 GLN HA H 39.312 3.158 -0.784 1.00 . A X . 3 GLN HA 1 1
6 2722 1 1 3 GLN HB2 H 41.000 1.366 -1.984 1.00 . A X . 3 GLN HB2 1 1
6 2723 1 1 3 GLN HB3 H 42.082 2.162 -0.840 1.00 . A X . 3 GLN HB3 1 1
6 2724 1 1 3 GLN HE21 H 39.760 -1.350 -0.148 1.00 . A X . 3 GLN HE21 1 1
6 2725 1 1 3 GLN HE22 H 41.209 -2.105 0.311 1.00 . A X . 3 GLN HE22 1 1
6 2726 1 1 3 GLN HG2 H 40.421 1.750 0.970 1.00 . A X . 3 GLN HG2 1 1
6 2727 1 1 3 GLN HG3 H 39.417 0.868 -0.186 1.00 . A X . 3 GLN HG3 1 1
6 2728 1 1 3 GLN N N 40.090 3.528 -2.673 1.00 . A X . 3 GLN N 1 1
6 2729 1 1 3 GLN NE2 N 40.693 -1.289 0.150 1.00 . A X . 3 GLN NE2 1 1
6 2730 1 1 3 GLN O O 40.519 5.081 0.282 1.00 . A X . 3 GLN O 1 1
6 2731 1 1 3 GLN OE1 O 42.415 -0.042 0.705 1.00 . A X . 3 GLN OE1 1 1
6 2732 1 1 4 GLY C C 42.526 7.034 -0.875 1.00 . A X . 4 GLY C 1 1
6 2733 1 1 4 GLY CA C 43.102 5.678 -0.491 1.00 . A X . 4 GLY CA 1 1
6 2734 1 1 4 GLY H H 42.644 4.033 -1.745 1.00 . A X . 4 GLY H 1 1
6 2735 1 1 4 GLY HA2 H 43.131 5.591 0.586 1.00 . A X . 4 GLY HA2 1 1
6 2736 1 1 4 GLY HA3 H 44.105 5.595 -0.883 1.00 . A X . 4 GLY HA3 1 1
6 2737 1 1 4 GLY N N 42.281 4.604 -1.038 1.00 . A X . 4 GLY N 1 1
6 2738 1 1 4 GLY O O 42.520 7.969 -0.074 1.00 . A X . 4 GLY O 1 1
6 2739 1 1 5 THR C C 40.128 8.078 -3.310 1.00 . A X . 5 THR C 1 1
6 2740 1 1 5 THR CA C 41.444 8.369 -2.595 1.00 . A X . 5 THR CA 1 1
6 2741 1 1 5 THR CB C 42.415 9.081 -3.542 1.00 . A X . 5 THR CB 1 1
6 2742 1 1 5 THR CG2 C 43.422 8.071 -4.085 1.00 . A X . 5 THR CG2 1 1
6 2743 1 1 5 THR H H 42.062 6.346 -2.697 1.00 . A X . 5 THR H 1 1
6 2744 1 1 5 THR HA H 41.249 9.011 -1.757 1.00 . A X . 5 THR HA 1 1
6 2745 1 1 5 THR HB H 42.944 9.849 -3.001 1.00 . A X . 5 THR HB 1 1
6 2746 1 1 5 THR HG1 H 42.179 9.494 -5.427 1.00 . A X . 5 THR HG1 1 1
6 2747 1 1 5 THR HG21 H 44.052 7.724 -3.282 1.00 . A X . 5 THR HG21 1 1
6 2748 1 1 5 THR HG22 H 44.029 8.540 -4.845 1.00 . A X . 5 THR HG22 1 1
6 2749 1 1 5 THR HG23 H 42.892 7.234 -4.514 1.00 . A X . 5 THR HG23 1 1
6 2750 1 1 5 THR N N 42.035 7.129 -2.107 1.00 . A X . 5 THR N 1 1
6 2751 1 1 5 THR O O 40.080 7.972 -4.535 1.00 . A X . 5 THR O 1 1
6 2752 1 1 5 THR OG1 O 41.695 9.667 -4.616 1.00 . A X . 5 THR OG1 1 1
6 2753 1 1 6 PHE C C 36.670 7.816 -2.022 1.00 . A X . 6 PHE C 1 1
6 2754 1 1 6 PHE CA C 37.749 7.645 -3.085 1.00 . A X . 6 PHE CA 1 1
6 2755 1 1 6 PHE CB C 37.723 6.212 -3.621 1.00 . A X . 6 PHE CB 1 1
6 2756 1 1 6 PHE CD1 C 35.860 6.590 -5.274 1.00 . A X . 6 PHE CD1 1 1
6 2757 1 1 6 PHE CD2 C 35.569 4.901 -3.559 1.00 . A X . 6 PHE CD2 1 1
6 2758 1 1 6 PHE CE1 C 34.588 6.295 -5.780 1.00 . A X . 6 PHE CE1 1 1
6 2759 1 1 6 PHE CE2 C 34.298 4.606 -4.066 1.00 . A X . 6 PHE CE2 1 1
6 2760 1 1 6 PHE CG C 36.350 5.894 -4.163 1.00 . A X . 6 PHE CG 1 1
6 2761 1 1 6 PHE CZ C 33.807 5.303 -5.176 1.00 . A X . 6 PHE CZ 1 1
6 2762 1 1 6 PHE H H 39.164 8.023 -1.557 1.00 . A X . 6 PHE H 1 1
6 2763 1 1 6 PHE HA H 37.552 8.326 -3.901 1.00 . A X . 6 PHE HA 1 1
6 2764 1 1 6 PHE HB2 H 38.454 6.112 -4.411 1.00 . A X . 6 PHE HB2 1 1
6 2765 1 1 6 PHE HB3 H 37.962 5.527 -2.822 1.00 . A X . 6 PHE HB3 1 1
6 2766 1 1 6 PHE HD1 H 36.461 7.357 -5.741 1.00 . A X . 6 PHE HD1 1 1
6 2767 1 1 6 PHE HD2 H 35.946 4.362 -2.701 1.00 . A X . 6 PHE HD2 1 1
6 2768 1 1 6 PHE HE1 H 34.210 6.833 -6.638 1.00 . A X . 6 PHE HE1 1 1
6 2769 1 1 6 PHE HE2 H 33.695 3.841 -3.600 1.00 . A X . 6 PHE HE2 1 1
6 2770 1 1 6 PHE HZ H 32.828 5.075 -5.568 1.00 . A X . 6 PHE HZ 1 1
6 2771 1 1 6 PHE N N 39.063 7.937 -2.528 1.00 . A X . 6 PHE N 1 1
6 2772 1 1 6 PHE O O 35.477 7.820 -2.326 1.00 . A X . 6 PHE O 1 1
6 2773 1 1 7 THR C C 35.504 9.498 0.270 1.00 . A X . 7 THR C 1 1
6 2774 1 1 7 THR CA C 36.165 8.126 0.333 1.00 . A X . 7 THR CA 1 1
6 2775 1 1 7 THR CB C 36.899 7.972 1.669 1.00 . A X . 7 THR CB 1 1
6 2776 1 1 7 THR CG2 C 37.479 6.560 1.775 1.00 . A X . 7 THR CG2 1 1
6 2777 1 1 7 THR H H 38.063 7.944 -0.590 1.00 . A X . 7 THR H 1 1
6 2778 1 1 7 THR HA H 35.402 7.365 0.268 1.00 . A X . 7 THR HA 1 1
6 2779 1 1 7 THR HB H 36.210 8.136 2.481 1.00 . A X . 7 THR HB 1 1
6 2780 1 1 7 THR HG1 H 38.483 8.722 2.512 1.00 . A X . 7 THR HG1 1 1
6 2781 1 1 7 THR HG21 H 36.672 5.848 1.863 1.00 . A X . 7 THR HG21 1 1
6 2782 1 1 7 THR HG22 H 38.113 6.497 2.647 1.00 . A X . 7 THR HG22 1 1
6 2783 1 1 7 THR HG23 H 38.059 6.342 0.892 1.00 . A X . 7 THR HG23 1 1
6 2784 1 1 7 THR N N 37.101 7.955 -0.772 1.00 . A X . 7 THR N 1 1
6 2785 1 1 7 THR O O 34.334 9.651 0.619 1.00 . A X . 7 THR O 1 1
6 2786 1 1 7 THR OG1 O 37.951 8.925 1.740 1.00 . A X . 7 THR OG1 1 1
6 2787 1 1 8 SER C C 34.395 11.848 -1.009 1.00 . A X . 8 SER C 1 1
6 2788 1 1 8 SER CA C 35.737 11.850 -0.288 1.00 . A X . 8 SER CA 1 1
6 2789 1 1 8 SER CB C 36.727 12.733 -1.048 1.00 . A X . 8 SER CB 1 1
6 2790 1 1 8 SER H H 37.188 10.312 -0.446 1.00 . A X . 8 SER H 1 1
6 2791 1 1 8 SER HA H 35.603 12.253 0.705 1.00 . A X . 8 SER HA 1 1
6 2792 1 1 8 SER HB2 H 36.525 12.677 -2.104 1.00 . A X . 8 SER HB2 1 1
6 2793 1 1 8 SER HB3 H 36.621 13.759 -0.718 1.00 . A X . 8 SER HB3 1 1
6 2794 1 1 8 SER HG H 38.168 11.446 -1.264 1.00 . A X . 8 SER HG 1 1
6 2795 1 1 8 SER N N 36.262 10.493 -0.180 1.00 . A X . 8 SER N 1 1
6 2796 1 1 8 SER O O 33.675 12.848 -1.004 1.00 . A X . 8 SER O 1 1
6 2797 1 1 8 SER OG O 38.050 12.277 -0.800 1.00 . A X . 8 SER OG 1 1
6 2798 1 1 9 ASP C C 32.122 9.273 -2.010 1.00 . A X . 9 ASP C 1 1
6 2799 1 1 9 ASP CA C 32.805 10.593 -2.352 1.00 . A X . 9 ASP CA 1 1
6 2800 1 1 9 ASP CB C 33.059 10.662 -3.859 1.00 . A X . 9 ASP CB 1 1
6 2801 1 1 9 ASP CG C 31.732 10.749 -4.606 1.00 . A X . 9 ASP CG 1 1
6 2802 1 1 9 ASP H H 34.679 9.957 -1.597 1.00 . A X . 9 ASP H 1 1
6 2803 1 1 9 ASP HA H 32.153 11.408 -2.071 1.00 . A X . 9 ASP HA 1 1
6 2804 1 1 9 ASP HB2 H 33.655 11.537 -4.083 1.00 . A X . 9 ASP HB2 1 1
6 2805 1 1 9 ASP HB3 H 33.590 9.772 -4.174 1.00 . A X . 9 ASP HB3 1 1
6 2806 1 1 9 ASP N N 34.064 10.719 -1.628 1.00 . A X . 9 ASP N 1 1
6 2807 1 1 9 ASP O O 31.972 8.400 -2.864 1.00 . A X . 9 ASP O 1 1
6 2808 1 1 9 ASP OD1 O 31.051 11.748 -4.449 1.00 . A X . 9 ASP OD1 1 1
6 2809 1 1 9 ASP OD2 O 31.415 9.812 -5.320 1.00 . A X . 9 ASP OD2 1 1
6 2810 1 1 10 TYR C C 29.982 8.239 0.738 1.00 . A X . 10 TYR C 1 1
6 2811 1 1 10 TYR CA C 31.046 7.914 -0.308 1.00 . A X . 10 TYR CA 1 1
6 2812 1 1 10 TYR CB C 32.074 6.955 0.299 1.00 . A X . 10 TYR CB 1 1
6 2813 1 1 10 TYR CD1 C 30.568 5.005 -0.277 1.00 . A X . 10 TYR CD1 1 1
6 2814 1 1 10 TYR CD2 C 32.956 4.791 -0.648 1.00 . A X . 10 TYR CD2 1 1
6 2815 1 1 10 TYR CE1 C 30.377 3.704 -0.755 1.00 . A X . 10 TYR CE1 1 1
6 2816 1 1 10 TYR CE2 C 32.764 3.489 -1.124 1.00 . A X . 10 TYR CE2 1 1
6 2817 1 1 10 TYR CG C 31.858 5.552 -0.223 1.00 . A X . 10 TYR CG 1 1
6 2818 1 1 10 TYR CZ C 31.475 2.945 -1.178 1.00 . A X . 10 TYR CZ 1 1
6 2819 1 1 10 TYR H H 31.858 9.863 -0.115 1.00 . A X . 10 TYR H 1 1
6 2820 1 1 10 TYR HA H 30.576 7.443 -1.158 1.00 . A X . 10 TYR HA 1 1
6 2821 1 1 10 TYR HB2 H 33.068 7.285 0.035 1.00 . A X . 10 TYR HB2 1 1
6 2822 1 1 10 TYR HB3 H 31.973 6.955 1.374 1.00 . A X . 10 TYR HB3 1 1
6 2823 1 1 10 TYR HD1 H 29.721 5.590 0.049 1.00 . A X . 10 TYR HD1 1 1
6 2824 1 1 10 TYR HD2 H 33.951 5.209 -0.607 1.00 . A X . 10 TYR HD2 1 1
6 2825 1 1 10 TYR HE1 H 29.382 3.286 -0.799 1.00 . A X . 10 TYR HE1 1 1
6 2826 1 1 10 TYR HE2 H 33.611 2.904 -1.451 1.00 . A X . 10 TYR HE2 1 1
6 2827 1 1 10 TYR HH H 31.820 1.069 -1.113 1.00 . A X . 10 TYR HH 1 1
6 2828 1 1 10 TYR N N 31.711 9.135 -0.753 1.00 . A X . 10 TYR N 1 1
6 2829 1 1 10 TYR O O 29.611 7.389 1.546 1.00 . A X . 10 TYR O 1 1
6 2830 1 1 10 TYR OH O 31.286 1.662 -1.648 1.00 . A X . 10 TYR OH 1 1
6 2831 1 1 11 SER C C 27.507 10.866 1.011 1.00 . A X . 11 SER C 1 1
6 2832 1 1 11 SER CA C 28.482 9.900 1.671 1.00 . A X . 11 SER CA 1 1
6 2833 1 1 11 SER CB C 29.142 10.577 2.872 1.00 . A X . 11 SER CB 1 1
6 2834 1 1 11 SER H H 29.834 10.113 0.053 1.00 . A X . 11 SER H 1 1
6 2835 1 1 11 SER HA H 27.938 9.032 2.015 1.00 . A X . 11 SER HA 1 1
6 2836 1 1 11 SER HB2 H 29.493 9.829 3.562 1.00 . A X . 11 SER HB2 1 1
6 2837 1 1 11 SER HB3 H 29.978 11.175 2.534 1.00 . A X . 11 SER HB3 1 1
6 2838 1 1 11 SER HG H 28.249 12.284 3.150 1.00 . A X . 11 SER HG 1 1
6 2839 1 1 11 SER N N 29.500 9.475 0.717 1.00 . A X . 11 SER N 1 1
6 2840 1 1 11 SER O O 26.660 11.462 1.677 1.00 . A X . 11 SER O 1 1
6 2841 1 1 11 SER OG O 28.187 11.404 3.526 1.00 . A X . 11 SER OG 1 1
6 2842 1 1 12 LYS C C 26.534 11.405 -2.462 1.00 . A X . 12 LYS C 1 1
6 2843 1 1 12 LYS CA C 26.758 11.917 -1.042 1.00 . A X . 12 LYS CA 1 1
6 2844 1 1 12 LYS CB C 27.371 13.318 -1.095 1.00 . A X . 12 LYS CB 1 1
6 2845 1 1 12 LYS CD C 27.874 15.346 0.276 1.00 . A X . 12 LYS CD 1 1
6 2846 1 1 12 LYS CE C 29.171 15.563 -0.506 1.00 . A X . 12 LYS CE 1 1
6 2847 1 1 12 LYS CG C 27.550 13.852 0.328 1.00 . A X . 12 LYS CG 1 1
6 2848 1 1 12 LYS H H 28.327 10.519 -0.781 1.00 . A X . 12 LYS H 1 1
6 2849 1 1 12 LYS HA H 25.806 11.973 -0.537 1.00 . A X . 12 LYS HA 1 1
6 2850 1 1 12 LYS HB2 H 28.332 13.271 -1.588 1.00 . A X . 12 LYS HB2 1 1
6 2851 1 1 12 LYS HB3 H 26.717 13.977 -1.645 1.00 . A X . 12 LYS HB3 1 1
6 2852 1 1 12 LYS HD2 H 27.066 15.873 -0.213 1.00 . A X . 12 LYS HD2 1 1
6 2853 1 1 12 LYS HD3 H 27.994 15.724 1.280 1.00 . A X . 12 LYS HD3 1 1
6 2854 1 1 12 LYS HE2 H 29.859 14.756 -0.295 1.00 . A X . 12 LYS HE2 1 1
6 2855 1 1 12 LYS HE3 H 28.954 15.584 -1.565 1.00 . A X . 12 LYS HE3 1 1
6 2856 1 1 12 LYS HG2 H 26.639 13.700 0.887 1.00 . A X . 12 LYS HG2 1 1
6 2857 1 1 12 LYS HG3 H 28.362 13.327 0.810 1.00 . A X . 12 LYS HG3 1 1
6 2858 1 1 12 LYS HZ1 H 30.687 16.986 -0.601 1.00 . A X . 12 LYS HZ1 1 1
6 2859 1 1 12 LYS HZ2 H 29.956 16.854 0.926 1.00 . A X . 12 LYS HZ2 1 1
6 2860 1 1 12 LYS HZ3 H 29.143 17.639 -0.343 1.00 . A X . 12 LYS HZ3 1 1
6 2861 1 1 12 LYS N N 27.633 11.019 -0.303 1.00 . A X . 12 LYS N 1 1
6 2862 1 1 12 LYS NZ N 29.785 16.858 -0.101 1.00 . A X . 12 LYS NZ 1 1
6 2863 1 1 12 LYS O O 25.958 12.104 -3.297 1.00 . A X . 12 LYS O 1 1
6 2864 1 1 13 LYS C C 26.410 8.135 -3.957 1.00 . A X . 13 LYS C 1 1
6 2865 1 1 13 LYS CA C 26.826 9.600 -4.059 1.00 . A X . 13 LYS CA 1 1
6 2866 1 1 13 LYS CB C 28.133 9.740 -4.860 1.00 . A X . 13 LYS CB 1 1
6 2867 1 1 13 LYS CD C 27.053 9.060 -7.034 1.00 . A X . 13 LYS CD 1 1
6 2868 1 1 13 LYS CE C 27.898 7.784 -7.128 1.00 . A X . 13 LYS CE 1 1
6 2869 1 1 13 LYS CG C 27.823 10.169 -6.303 1.00 . A X . 13 LYS CG 1 1
6 2870 1 1 13 LYS H H 27.441 9.670 -2.030 1.00 . A X . 13 LYS H 1 1
6 2871 1 1 13 LYS HA H 26.043 10.137 -4.570 1.00 . A X . 13 LYS HA 1 1
6 2872 1 1 13 LYS HB2 H 28.754 10.490 -4.391 1.00 . A X . 13 LYS HB2 1 1
6 2873 1 1 13 LYS HB3 H 28.664 8.801 -4.870 1.00 . A X . 13 LYS HB3 1 1
6 2874 1 1 13 LYS HD2 H 26.144 8.845 -6.497 1.00 . A X . 13 LYS HD2 1 1
6 2875 1 1 13 LYS HD3 H 26.808 9.397 -8.029 1.00 . A X . 13 LYS HD3 1 1
6 2876 1 1 13 LYS HE2 H 27.712 7.168 -6.261 1.00 . A X . 13 LYS HE2 1 1
6 2877 1 1 13 LYS HE3 H 27.616 7.240 -8.015 1.00 . A X . 13 LYS HE3 1 1
6 2878 1 1 13 LYS HG2 H 27.224 11.067 -6.289 1.00 . A X . 13 LYS HG2 1 1
6 2879 1 1 13 LYS HG3 H 28.745 10.367 -6.823 1.00 . A X . 13 LYS HG3 1 1
6 2880 1 1 13 LYS HZ1 H 29.687 8.783 -6.583 1.00 . A X . 13 LYS HZ1 1 1
6 2881 1 1 13 LYS N N 26.990 10.185 -2.733 1.00 . A X . 13 LYS N 1 1
6 2882 1 1 13 LYS NZ N 29.322 8.106 -7.188 1.00 . A X . 13 LYS NZ 1 1
6 2883 1 1 13 LYS O O 25.231 7.812 -4.089 1.00 . A X . 13 LYS O 1 1
6 2884 1 1 14 LEU C C 25.925 5.654 -2.590 1.00 . A X . 14 LEU C 1 1
6 2885 1 1 14 LEU CA C 27.052 5.832 -3.595 1.00 . A X . 14 LEU CA 1 1
6 2886 1 1 14 LEU CB C 28.278 5.037 -3.147 1.00 . A X . 14 LEU CB 1 1
6 2887 1 1 14 LEU CD1 C 30.461 6.159 -3.641 1.00 . A X . 14 LEU CD1 1 1
6 2888 1 1 14 LEU CD2 C 30.050 3.832 -4.441 1.00 . A X . 14 LEU CD2 1 1
6 2889 1 1 14 LEU CG C 29.402 5.195 -4.176 1.00 . A X . 14 LEU CG 1 1
6 2890 1 1 14 LEU H H 28.294 7.548 -3.612 1.00 . A X . 14 LEU H 1 1
6 2891 1 1 14 LEU HA H 26.725 5.462 -4.555 1.00 . A X . 14 LEU HA 1 1
6 2892 1 1 14 LEU HB2 H 28.612 5.403 -2.187 1.00 . A X . 14 LEU HB2 1 1
6 2893 1 1 14 LEU HB3 H 28.012 3.996 -3.064 1.00 . A X . 14 LEU HB3 1 1
6 2894 1 1 14 LEU HD11 H 30.000 7.104 -3.399 1.00 . A X . 14 LEU HD11 1 1
6 2895 1 1 14 LEU HD12 H 31.220 6.312 -4.392 1.00 . A X . 14 LEU HD12 1 1
6 2896 1 1 14 LEU HD13 H 30.912 5.742 -2.753 1.00 . A X . 14 LEU HD13 1 1
6 2897 1 1 14 LEU HD21 H 30.506 3.469 -3.534 1.00 . A X . 14 LEU HD21 1 1
6 2898 1 1 14 LEU HD22 H 30.806 3.936 -5.205 1.00 . A X . 14 LEU HD22 1 1
6 2899 1 1 14 LEU HD23 H 29.300 3.130 -4.773 1.00 . A X . 14 LEU HD23 1 1
6 2900 1 1 14 LEU HG H 28.995 5.586 -5.096 1.00 . A X . 14 LEU HG 1 1
6 2901 1 1 14 LEU N N 27.369 7.246 -3.714 1.00 . A X . 14 LEU N 1 1
6 2902 1 1 14 LEU O O 25.016 4.852 -2.794 1.00 . A X . 14 LEU O 1 1
6 2903 1 1 15 ASP C C 23.712 7.103 -0.994 1.00 . A X . 15 ASP C 1 1
6 2904 1 1 15 ASP CA C 24.948 6.370 -0.495 1.00 . A X . 15 ASP CA 1 1
6 2905 1 1 15 ASP CB C 25.442 7.002 0.807 1.00 . A X . 15 ASP CB 1 1
6 2906 1 1 15 ASP CG C 24.541 6.585 1.964 1.00 . A X . 15 ASP CG 1 1
6 2907 1 1 15 ASP H H 26.722 7.066 -1.413 1.00 . A X . 15 ASP H 1 1
6 2908 1 1 15 ASP HA H 24.694 5.334 -0.317 1.00 . A X . 15 ASP HA 1 1
6 2909 1 1 15 ASP HB2 H 26.453 6.674 1.003 1.00 . A X . 15 ASP HB2 1 1
6 2910 1 1 15 ASP HB3 H 25.423 8.080 0.711 1.00 . A X . 15 ASP HB3 1 1
6 2911 1 1 15 ASP N N 25.982 6.431 -1.513 1.00 . A X . 15 ASP N 1 1
6 2912 1 1 15 ASP O O 23.184 7.994 -0.328 1.00 . A X . 15 ASP O 1 1
6 2913 1 1 15 ASP OD1 O 23.353 6.852 1.892 1.00 . A X . 15 ASP OD1 1 1
6 2914 1 1 15 ASP OD2 O 25.053 6.002 2.907 1.00 . A X . 15 ASP OD2 1 1
6 2915 1 1 16 ABA C C 21.939 6.673 -4.196 1.00 . A X . 16 AIB C 1 1
6 2916 1 1 16 ABA CA C 22.118 7.317 -2.829 1.00 . A X . 16 AIB CA 1 1
6 2917 1 1 16 ABA H H 23.764 6.009 -2.657 1.00 . A X . 16 AIB H 1 1
6 2918 1 1 16 ABA N N 23.278 6.719 -2.186 1.00 . A X . 16 AIB N 1 1
6 2919 1 1 16 ABA O O 20.864 6.180 -4.531 1.00 . A X . 16 AIB O 1 1
6 2920 1 1 17 ARG C C 23.186 4.540 -6.167 1.00 . A X . 17 ARG C 1 1
6 2921 1 1 17 ARG CA C 22.976 6.045 -6.289 1.00 . A X . 17 ARG CA 1 1
6 2922 1 1 17 ARG CB C 24.067 6.638 -7.167 1.00 . A X . 17 ARG CB 1 1
6 2923 1 1 17 ARG CD C 22.833 7.593 -9.119 1.00 . A X . 17 ARG CD 1 1
6 2924 1 1 17 ARG CG C 23.561 7.929 -7.817 1.00 . A X . 17 ARG CG 1 1
6 2925 1 1 17 ARG CZ C 24.244 8.695 -10.762 1.00 . A X . 17 ARG CZ 1 1
6 2926 1 1 17 ARG H H 23.853 7.053 -4.649 1.00 . A X . 17 ARG H 1 1
6 2927 1 1 17 ARG HA H 22.014 6.235 -6.743 1.00 . A X . 17 ARG HA 1 1
6 2928 1 1 17 ARG HB2 H 24.933 6.852 -6.556 1.00 . A X . 17 ARG HB2 1 1
6 2929 1 1 17 ARG HB3 H 24.330 5.929 -7.937 1.00 . A X . 17 ARG HB3 1 1
6 2930 1 1 17 ARG HD2 H 22.365 6.626 -9.030 1.00 . A X . 17 ARG HD2 1 1
6 2931 1 1 17 ARG HD3 H 22.075 8.341 -9.307 1.00 . A X . 17 ARG HD3 1 1
6 2932 1 1 17 ARG HE H 24.072 6.708 -10.593 1.00 . A X . 17 ARG HE 1 1
6 2933 1 1 17 ARG HG2 H 22.881 8.427 -7.142 1.00 . A X . 17 ARG HG2 1 1
6 2934 1 1 17 ARG HG3 H 24.396 8.577 -8.031 1.00 . A X . 17 ARG HG3 1 1
6 2935 1 1 17 ARG HH11 H 23.208 9.885 -9.529 1.00 . A X . 17 ARG HH11 1 1
6 2936 1 1 17 ARG HH12 H 24.207 10.695 -10.688 1.00 . A X . 17 ARG HH12 1 1
6 2937 1 1 17 ARG HH21 H 25.386 7.763 -12.118 1.00 . A X . 17 ARG HH21 1 1
6 2938 1 1 17 ARG HH22 H 25.440 9.495 -12.153 1.00 . A X . 17 ARG HH22 1 1
6 2939 1 1 17 ARG N N 23.014 6.658 -4.973 1.00 . A X . 17 ARG N 1 1
6 2940 1 1 17 ARG NE N 23.777 7.570 -10.231 1.00 . A X . 17 ARG NE 1 1
6 2941 1 1 17 ARG NH1 N 23.855 9.848 -10.289 1.00 . A X . 17 ARG NH1 1 1
6 2942 1 1 17 ARG NH2 N 25.090 8.648 -11.756 1.00 . A X . 17 ARG NH2 1 1
6 2943 1 1 17 ARG O O 22.825 3.778 -7.062 1.00 . A X . 17 ARG O 1 1
6 2944 1 1 18 ARG C C 23.170 2.304 -3.587 1.00 . A X . 18 ARG C 1 1
6 2945 1 1 18 ARG CA C 24.001 2.713 -4.783 1.00 . A X . 18 ARG CA 1 1
6 2946 1 1 18 ARG CB C 25.481 2.476 -4.484 1.00 . A X . 18 ARG CB 1 1
6 2947 1 1 18 ARG CD C 27.249 0.718 -4.295 1.00 . A X . 18 ARG CD 1 1
6 2948 1 1 18 ARG CG C 25.832 1.018 -4.785 1.00 . A X . 18 ARG CG 1 1
6 2949 1 1 18 ARG CZ C 27.885 -1.079 -5.801 1.00 . A X . 18 ARG CZ 1 1
6 2950 1 1 18 ARG H H 24.009 4.780 -4.349 1.00 . A X . 18 ARG H 1 1
6 2951 1 1 18 ARG HA H 23.707 2.130 -5.644 1.00 . A X . 18 ARG HA 1 1
6 2952 1 1 18 ARG HB2 H 26.083 3.128 -5.102 1.00 . A X . 18 ARG HB2 1 1
6 2953 1 1 18 ARG HB3 H 25.674 2.683 -3.439 1.00 . A X . 18 ARG HB3 1 1
6 2954 1 1 18 ARG HD2 H 27.706 1.629 -3.939 1.00 . A X . 18 ARG HD2 1 1
6 2955 1 1 18 ARG HD3 H 27.203 0.002 -3.486 1.00 . A X . 18 ARG HD3 1 1
6 2956 1 1 18 ARG HE H 28.730 0.736 -5.812 1.00 . A X . 18 ARG HE 1 1
6 2957 1 1 18 ARG HG2 H 25.130 0.369 -4.281 1.00 . A X . 18 ARG HG2 1 1
6 2958 1 1 18 ARG HG3 H 25.777 0.848 -5.850 1.00 . A X . 18 ARG HG3 1 1
6 2959 1 1 18 ARG HH11 H 26.426 -1.483 -4.490 1.00 . A X . 18 ARG HH11 1 1
6 2960 1 1 18 ARG HH12 H 26.859 -2.780 -5.552 1.00 . A X . 18 ARG HH12 1 1
6 2961 1 1 18 ARG HH21 H 29.305 -0.962 -7.208 1.00 . A X . 18 ARG HH21 1 1
6 2962 1 1 18 ARG HH22 H 28.489 -2.486 -7.089 1.00 . A X . 18 ARG HH22 1 1
6 2963 1 1 18 ARG N N 23.759 4.124 -5.039 1.00 . A X . 18 ARG N 1 1
6 2964 1 1 18 ARG NE N 28.053 0.171 -5.383 1.00 . A X . 18 ARG NE 1 1
6 2965 1 1 18 ARG NH1 N 26.987 -1.839 -5.237 1.00 . A X . 18 ARG NH1 1 1
6 2966 1 1 18 ARG NH2 N 28.617 -1.544 -6.775 1.00 . A X . 18 ARG NH2 1 1
6 2967 1 1 18 ARG O O 23.429 1.294 -2.934 1.00 . A X . 18 ARG O 1 1
6 2968 1 1 19 ALA C C 19.852 3.150 -2.557 1.00 . A X . 19 ALA C 1 1
6 2969 1 1 19 ALA CA C 21.306 2.914 -2.168 1.00 . A X . 19 ALA CA 1 1
6 2970 1 1 19 ALA CB C 21.710 3.875 -1.058 1.00 . A X . 19 ALA CB 1 1
6 2971 1 1 19 ALA H H 22.049 3.931 -3.855 1.00 . A X . 19 ALA H 1 1
6 2972 1 1 19 ALA HA H 21.424 1.901 -1.818 1.00 . A X . 19 ALA HA 1 1
6 2973 1 1 19 ALA HB1 H 22.422 4.591 -1.457 1.00 . A X . 19 ALA HB1 1 1
6 2974 1 1 19 ALA HB2 H 22.166 3.321 -0.251 1.00 . A X . 19 ALA HB2 1 1
6 2975 1 1 19 ALA HB3 H 20.838 4.395 -0.694 1.00 . A X . 19 ALA HB3 1 1
6 2976 1 1 19 ALA N N 22.179 3.134 -3.300 1.00 . A X . 19 ALA N 1 1
6 2977 1 1 19 ALA O O 18.953 2.464 -2.072 1.00 . A X . 19 ALA O 1 1
6 2978 1 1 20 GLN C C 17.777 3.366 -4.858 1.00 . A X . 20 GLN C 1 1
6 2979 1 1 20 GLN CA C 18.261 4.423 -3.873 1.00 . A X . 20 GLN CA 1 1
6 2980 1 1 20 GLN CB C 18.204 5.806 -4.527 1.00 . A X . 20 GLN CB 1 1
6 2981 1 1 20 GLN CD C 16.561 6.593 -6.243 1.00 . A X . 20 GLN CD 1 1
6 2982 1 1 20 GLN CG C 16.745 6.189 -4.785 1.00 . A X . 20 GLN CG 1 1
6 2983 1 1 20 GLN H H 20.376 4.641 -3.800 1.00 . A X . 20 GLN H 1 1
6 2984 1 1 20 GLN HA H 17.612 4.420 -3.010 1.00 . A X . 20 GLN HA 1 1
6 2985 1 1 20 GLN HB2 H 18.654 6.534 -3.868 1.00 . A X . 20 GLN HB2 1 1
6 2986 1 1 20 GLN HB3 H 18.740 5.785 -5.464 1.00 . A X . 20 GLN HB3 1 1
6 2987 1 1 20 GLN HE21 H 15.649 4.905 -6.750 1.00 . A X . 20 GLN HE21 1 1
6 2988 1 1 20 GLN HE22 H 15.849 6.027 -8.008 1.00 . A X . 20 GLN HE22 1 1
6 2989 1 1 20 GLN HG2 H 16.108 5.346 -4.562 1.00 . A X . 20 GLN HG2 1 1
6 2990 1 1 20 GLN HG3 H 16.476 7.018 -4.148 1.00 . A X . 20 GLN HG3 1 1
6 2991 1 1 20 GLN N N 19.622 4.122 -3.436 1.00 . A X . 20 GLN N 1 1
6 2992 1 1 20 GLN NE2 N 15.971 5.774 -7.069 1.00 . A X . 20 GLN NE2 1 1
6 2993 1 1 20 GLN O O 16.828 2.634 -4.578 1.00 . A X . 20 GLN O 1 1
6 2994 1 1 20 GLN OE1 O 16.964 7.687 -6.640 1.00 . A X . 20 GLN OE1 1 1
6 2995 1 1 21 ASP C C 18.033 0.905 -6.408 1.00 . A X . 21 ASP C 1 1
6 2996 1 1 21 ASP CA C 18.066 2.303 -7.018 1.00 . A X . 21 ASP CA 1 1
6 2997 1 1 21 ASP CB C 19.070 2.336 -8.172 1.00 . A X . 21 ASP CB 1 1
6 2998 1 1 21 ASP CG C 18.401 1.868 -9.460 1.00 . A X . 21 ASP CG 1 1
6 2999 1 1 21 ASP H H 19.191 3.889 -6.174 1.00 . A X . 21 ASP H 1 1
6 3000 1 1 21 ASP HA H 17.087 2.545 -7.400 1.00 . A X . 21 ASP HA 1 1
6 3001 1 1 21 ASP HB2 H 19.433 3.347 -8.302 1.00 . A X . 21 ASP HB2 1 1
6 3002 1 1 21 ASP HB3 H 19.900 1.681 -7.942 1.00 . A X . 21 ASP HB3 1 1
6 3003 1 1 21 ASP N N 18.438 3.284 -6.007 1.00 . A X . 21 ASP N 1 1
6 3004 1 1 21 ASP O O 17.598 -0.054 -7.045 1.00 . A X . 21 ASP O 1 1
6 3005 1 1 21 ASP OD1 O 17.304 2.330 -9.736 1.00 . A X . 21 ASP OD1 1 1
6 3006 1 1 21 ASP OD2 O 18.992 1.055 -10.150 1.00 . A X . 21 ASP OD2 1 1
6 3007 1 1 22 PHE C C 17.459 -0.557 -3.403 1.00 . A X . 22 PHE C 1 1
6 3008 1 1 22 PHE CA C 18.545 -0.475 -4.473 1.00 . A X . 22 PHE CA 1 1
6 3009 1 1 22 PHE CB C 19.911 -0.644 -3.815 1.00 . A X . 22 PHE CB 1 1
6 3010 1 1 22 PHE CD1 C 20.264 -3.003 -4.572 1.00 . A X . 22 PHE CD1 1 1
6 3011 1 1 22 PHE CD2 C 20.170 -2.550 -2.195 1.00 . A X . 22 PHE CD2 1 1
6 3012 1 1 22 PHE CE1 C 20.448 -4.358 -4.308 1.00 . A X . 22 PHE CE1 1 1
6 3013 1 1 22 PHE CE2 C 20.357 -3.907 -1.928 1.00 . A X . 22 PHE CE2 1 1
6 3014 1 1 22 PHE CG C 20.126 -2.100 -3.518 1.00 . A X . 22 PHE CG 1 1
6 3015 1 1 22 PHE CZ C 20.496 -4.815 -2.985 1.00 . A X . 22 PHE CZ 1 1
6 3016 1 1 22 PHE H H 18.849 1.596 -4.718 1.00 . A X . 22 PHE H 1 1
6 3017 1 1 22 PHE HA H 18.402 -1.277 -5.184 1.00 . A X . 22 PHE HA 1 1
6 3018 1 1 22 PHE HB2 H 20.683 -0.293 -4.487 1.00 . A X . 22 PHE HB2 1 1
6 3019 1 1 22 PHE HB3 H 19.943 -0.079 -2.896 1.00 . A X . 22 PHE HB3 1 1
6 3020 1 1 22 PHE HD1 H 20.233 -2.653 -5.593 1.00 . A X . 22 PHE HD1 1 1
6 3021 1 1 22 PHE HD2 H 20.064 -1.848 -1.381 1.00 . A X . 22 PHE HD2 1 1
6 3022 1 1 22 PHE HE1 H 20.550 -5.049 -5.124 1.00 . A X . 22 PHE HE1 1 1
6 3023 1 1 22 PHE HE2 H 20.390 -4.254 -0.908 1.00 . A X . 22 PHE HE2 1 1
6 3024 1 1 22 PHE HZ H 20.639 -5.866 -2.781 1.00 . A X . 22 PHE HZ 1 1
6 3025 1 1 22 PHE N N 18.507 0.800 -5.169 1.00 . A X . 22 PHE N 1 1
6 3026 1 1 22 PHE O O 16.501 -1.318 -3.533 1.00 . A X . 22 PHE O 1 1
6 3027 1 1 23 VAL C C 15.254 0.531 -1.720 1.00 . A X . 23 VAL C 1 1
6 3028 1 1 23 VAL CA C 16.669 0.221 -1.237 1.00 . A X . 23 VAL CA 1 1
6 3029 1 1 23 VAL CB C 17.082 1.249 -0.184 1.00 . A X . 23 VAL CB 1 1
6 3030 1 1 23 VAL CG1 C 16.062 1.252 0.958 1.00 . A X . 23 VAL CG1 1 1
6 3031 1 1 23 VAL CG2 C 18.463 0.889 0.368 1.00 . A X . 23 VAL CG2 1 1
6 3032 1 1 23 VAL H H 18.416 0.799 -2.285 1.00 . A X . 23 VAL H 1 1
6 3033 1 1 23 VAL HA H 16.670 -0.755 -0.779 1.00 . A X . 23 VAL HA 1 1
6 3034 1 1 23 VAL HB H 17.117 2.230 -0.635 1.00 . A X . 23 VAL HB 1 1
6 3035 1 1 23 VAL HG11 H 16.563 1.489 1.886 1.00 . A X . 23 VAL HG11 1 1
6 3036 1 1 23 VAL HG12 H 15.604 0.277 1.034 1.00 . A X . 23 VAL HG12 1 1
6 3037 1 1 23 VAL HG13 H 15.302 1.993 0.761 1.00 . A X . 23 VAL HG13 1 1
6 3038 1 1 23 VAL HG21 H 18.358 0.135 1.134 1.00 . A X . 23 VAL HG21 1 1
6 3039 1 1 23 VAL HG22 H 18.925 1.770 0.786 1.00 . A X . 23 VAL HG22 1 1
6 3040 1 1 23 VAL HG23 H 19.079 0.506 -0.432 1.00 . A X . 23 VAL HG23 1 1
6 3041 1 1 23 VAL N N 17.626 0.222 -2.338 1.00 . A X . 23 VAL N 1 1
6 3042 1 1 23 VAL O O 14.317 0.565 -0.922 1.00 . A X . 23 VAL O 1 1
6 3043 1 1 24 GLN C C 13.013 -0.225 -3.863 1.00 . A X . 24 GLN C 1 1
6 3044 1 1 24 GLN CA C 13.774 1.059 -3.558 1.00 . A X . 24 GLN CA 1 1
6 3045 1 1 24 GLN CB C 13.889 1.917 -4.822 1.00 . A X . 24 GLN CB 1 1
6 3046 1 1 24 GLN CD C 13.538 0.248 -6.650 1.00 . A X . 24 GLN CD 1 1
6 3047 1 1 24 GLN CG C 14.565 1.114 -5.933 1.00 . A X . 24 GLN CG 1 1
6 3048 1 1 24 GLN H H 15.865 0.720 -3.621 1.00 . A X . 24 GLN H 1 1
6 3049 1 1 24 GLN HA H 13.220 1.612 -2.813 1.00 . A X . 24 GLN HA 1 1
6 3050 1 1 24 GLN HB2 H 12.900 2.213 -5.145 1.00 . A X . 24 GLN HB2 1 1
6 3051 1 1 24 GLN HB3 H 14.479 2.796 -4.605 1.00 . A X . 24 GLN HB3 1 1
6 3052 1 1 24 GLN HE21 H 14.084 -1.413 -5.718 1.00 . A X . 24 GLN HE21 1 1
6 3053 1 1 24 GLN HE22 H 12.817 -1.593 -6.832 1.00 . A X . 24 GLN HE22 1 1
6 3054 1 1 24 GLN HG2 H 15.016 1.793 -6.641 1.00 . A X . 24 GLN HG2 1 1
6 3055 1 1 24 GLN HG3 H 15.330 0.482 -5.505 1.00 . A X . 24 GLN HG3 1 1
6 3056 1 1 24 GLN N N 15.093 0.757 -3.021 1.00 . A X . 24 GLN N 1 1
6 3057 1 1 24 GLN NE2 N 13.475 -1.026 -6.377 1.00 . A X . 24 GLN NE2 1 1
6 3058 1 1 24 GLN O O 11.792 -0.206 -4.020 1.00 . A X . 24 GLN O 1 1
6 3059 1 1 24 GLN OE1 O 12.775 0.743 -7.479 1.00 . A X . 24 GLN OE1 1 1
6 3060 1 1 25 TRP C C 13.108 -3.436 -2.892 1.00 . A X . 25 TRP C 1 1
6 3061 1 1 25 TRP CA C 13.097 -2.626 -4.169 1.00 . A X . 25 TRP CA 1 1
6 3062 1 1 25 TRP CB C 13.849 -3.414 -5.225 1.00 . A X . 25 TRP CB 1 1
6 3063 1 1 25 TRP CD1 C 13.147 -5.800 -4.881 1.00 . A X . 25 TRP CD1 1 1
6 3064 1 1 25 TRP CD2 C 15.078 -5.298 -3.865 1.00 . A X . 25 TRP CD2 1 1
6 3065 1 1 25 TRP CE2 C 14.833 -6.657 -3.585 1.00 . A X . 25 TRP CE2 1 1
6 3066 1 1 25 TRP CE3 C 16.227 -4.707 -3.344 1.00 . A X . 25 TRP CE3 1 1
6 3067 1 1 25 TRP CG C 14.014 -4.789 -4.698 1.00 . A X . 25 TRP CG 1 1
6 3068 1 1 25 TRP CH2 C 16.866 -6.793 -2.292 1.00 . A X . 25 TRP CH2 1 1
6 3069 1 1 25 TRP CZ2 C 15.718 -7.404 -2.802 1.00 . A X . 25 TRP CZ2 1 1
6 3070 1 1 25 TRP CZ3 C 17.114 -5.441 -2.566 1.00 . A X . 25 TRP CZ3 1 1
6 3071 1 1 25 TRP H H 14.708 -1.310 -3.758 1.00 . A X . 25 TRP H 1 1
6 3072 1 1 25 TRP HA H 12.080 -2.488 -4.496 1.00 . A X . 25 TRP HA 1 1
6 3073 1 1 25 TRP HB2 H 13.282 -3.433 -6.145 1.00 . A X . 25 TRP HB2 1 1
6 3074 1 1 25 TRP HB3 H 14.821 -2.973 -5.396 1.00 . A X . 25 TRP HB3 1 1
6 3075 1 1 25 TRP HD1 H 12.232 -5.737 -5.447 1.00 . A X . 25 TRP HD1 1 1
6 3076 1 1 25 TRP HE1 H 13.203 -7.805 -4.214 1.00 . A X . 25 TRP HE1 1 1
6 3077 1 1 25 TRP HE3 H 16.420 -3.670 -3.534 1.00 . A X . 25 TRP HE3 1 1
6 3078 1 1 25 TRP HH2 H 17.559 -7.359 -1.686 1.00 . A X . 25 TRP HH2 1 1
6 3079 1 1 25 TRP HZ2 H 15.517 -8.439 -2.586 1.00 . A X . 25 TRP HZ2 1 1
6 3080 1 1 25 TRP HZ3 H 17.993 -4.960 -2.175 1.00 . A X . 25 TRP HZ3 1 1
6 3081 1 1 25 TRP N N 13.732 -1.342 -3.917 1.00 . A X . 25 TRP N 1 1
6 3082 1 1 25 TRP NE1 N 13.635 -6.925 -4.228 1.00 . A X . 25 TRP NE1 1 1
6 3083 1 1 25 TRP O O 12.158 -4.156 -2.584 1.00 . A X . 25 TRP O 1 1
6 3084 1 1 26 LEU C C 13.122 -3.814 -0.034 1.00 . A X . 26 LEU C 1 1
6 3085 1 1 26 LEU CA C 14.347 -4.047 -0.915 1.00 . A X . 26 LEU CA 1 1
6 3086 1 1 26 LEU CB C 15.611 -3.599 -0.172 1.00 . A X . 26 LEU CB 1 1
6 3087 1 1 26 LEU CD1 C 16.548 -5.821 0.609 1.00 . A X . 26 LEU CD1 1 1
6 3088 1 1 26 LEU CD2 C 16.785 -3.781 2.027 1.00 . A X . 26 LEU CD2 1 1
6 3089 1 1 26 LEU CG C 15.870 -4.511 1.043 1.00 . A X . 26 LEU CG 1 1
6 3090 1 1 26 LEU H H 14.931 -2.734 -2.459 1.00 . A X . 26 LEU H 1 1
6 3091 1 1 26 LEU HA H 14.432 -5.092 -1.153 1.00 . A X . 26 LEU HA 1 1
6 3092 1 1 26 LEU HB2 H 16.453 -3.639 -0.844 1.00 . A X . 26 LEU HB2 1 1
6 3093 1 1 26 LEU HB3 H 15.478 -2.584 0.168 1.00 . A X . 26 LEU HB3 1 1
6 3094 1 1 26 LEU HD11 H 15.850 -6.430 0.048 1.00 . A X . 26 LEU HD11 1 1
6 3095 1 1 26 LEU HD12 H 16.866 -6.364 1.485 1.00 . A X . 26 LEU HD12 1 1
6 3096 1 1 26 LEU HD13 H 17.406 -5.598 -0.002 1.00 . A X . 26 LEU HD13 1 1
6 3097 1 1 26 LEU HD21 H 16.965 -4.409 2.887 1.00 . A X . 26 LEU HD21 1 1
6 3098 1 1 26 LEU HD22 H 16.313 -2.862 2.346 1.00 . A X . 26 LEU HD22 1 1
6 3099 1 1 26 LEU HD23 H 17.725 -3.554 1.546 1.00 . A X . 26 LEU HD23 1 1
6 3100 1 1 26 LEU HG H 14.935 -4.741 1.531 1.00 . A X . 26 LEU HG 1 1
6 3101 1 1 26 LEU N N 14.205 -3.317 -2.155 1.00 . A X . 26 LEU N 1 1
6 3102 1 1 26 LEU O O 12.678 -4.713 0.680 1.00 . A X . 26 LEU O 1 1
6 3103 1 1 27 MET C C 10.139 -2.405 -0.087 1.00 . A X . 27 MET C 1 1
6 3104 1 1 27 MET CA C 11.424 -2.246 0.722 1.00 . A X . 27 MET CA 1 1
6 3105 1 1 27 MET CB C 11.544 -0.804 1.213 1.00 . A X . 27 MET CB 1 1
6 3106 1 1 27 MET CE C 9.633 1.183 -1.768 1.00 . A X . 27 MET CE 1 1
6 3107 1 1 27 MET CG C 11.388 0.154 0.030 1.00 . A X . 27 MET CG 1 1
6 3108 1 1 27 MET H H 12.991 -1.912 -0.669 1.00 . A X . 27 MET H 1 1
6 3109 1 1 27 MET HA H 11.382 -2.903 1.577 1.00 . A X . 27 MET HA 1 1
6 3110 1 1 27 MET HB2 H 10.771 -0.606 1.943 1.00 . A X . 27 MET HB2 1 1
6 3111 1 1 27 MET HB3 H 12.514 -0.657 1.666 1.00 . A X . 27 MET HB3 1 1
6 3112 1 1 27 MET HE1 H 10.378 1.931 -2.005 1.00 . A X . 27 MET HE1 1 1
6 3113 1 1 27 MET HE2 H 8.655 1.560 -2.020 1.00 . A X . 27 MET HE2 1 1
6 3114 1 1 27 MET HE3 H 9.827 0.282 -2.332 1.00 . A X . 27 MET HE3 1 1
6 3115 1 1 27 MET HG2 H 12.089 0.971 0.133 1.00 . A X . 27 MET HG2 1 1
6 3116 1 1 27 MET HG3 H 11.585 -0.377 -0.891 1.00 . A X . 27 MET HG3 1 1
6 3117 1 1 27 MET N N 12.589 -2.593 -0.084 1.00 . A X . 27 MET N 1 1
6 3118 1 1 27 MET O O 9.064 -1.999 0.354 1.00 . A X . 27 MET O 1 1
6 3119 1 1 27 MET SD S 9.701 0.809 0.002 1.00 . A X . 27 MET SD 1 1
6 3120 1 1 28 ASN C C 8.522 -4.606 -1.924 1.00 . A X . 28 ASN C 1 1
6 3121 1 1 28 ASN CA C 9.093 -3.206 -2.126 1.00 . A X . 28 ASN CA 1 1
6 3122 1 1 28 ASN CB C 9.485 -3.020 -3.593 1.00 . A X . 28 ASN CB 1 1
6 3123 1 1 28 ASN CG C 8.257 -3.167 -4.484 1.00 . A X . 28 ASN CG 1 1
6 3124 1 1 28 ASN H H 11.136 -3.305 -1.569 1.00 . A X . 28 ASN H 1 1
6 3125 1 1 28 ASN HA H 8.337 -2.480 -1.872 1.00 . A X . 28 ASN HA 1 1
6 3126 1 1 28 ASN HB2 H 9.909 -2.036 -3.728 1.00 . A X . 28 ASN HB2 1 1
6 3127 1 1 28 ASN HB3 H 10.217 -3.766 -3.865 1.00 . A X . 28 ASN HB3 1 1
6 3128 1 1 28 ASN HD21 H 6.967 -3.016 -2.981 1.00 . A X . 28 ASN HD21 1 1
6 3129 1 1 28 ASN HD22 H 6.272 -3.229 -4.516 1.00 . A X . 28 ASN HD22 1 1
6 3130 1 1 28 ASN N N 10.256 -3.000 -1.269 1.00 . A X . 28 ASN N 1 1
6 3131 1 1 28 ASN ND2 N 7.067 -3.135 -3.949 1.00 . A X . 28 ASN ND2 1 1
6 3132 1 1 28 ASN O O 7.971 -5.203 -2.850 1.00 . A X . 28 ASN O 1 1
6 3133 1 1 28 ASN OD1 O 8.385 -3.319 -5.698 1.00 . A X . 28 ASN OD1 1 1
6 3134 1 1 29 THR C C 7.479 -6.466 0.973 1.00 . A X . 29 THR C 1 1
6 3135 1 1 29 THR CA C 8.151 -6.457 -0.395 1.00 . A X . 29 THR CA 1 1
6 3136 1 1 29 THR CB C 9.300 -7.469 -0.410 1.00 . A X . 29 THR CB 1 1
6 3137 1 1 29 THR CG2 C 10.619 -6.743 -0.666 1.00 . A X . 29 THR CG2 1 1
6 3138 1 1 29 THR H H 9.106 -4.604 -0.010 1.00 . A X . 29 THR H 1 1
6 3139 1 1 29 THR HA H 7.428 -6.741 -1.144 1.00 . A X . 29 THR HA 1 1
6 3140 1 1 29 THR HB H 9.132 -8.191 -1.194 1.00 . A X . 29 THR HB 1 1
6 3141 1 1 29 THR HG1 H 8.513 -8.567 0.990 1.00 . A X . 29 THR HG1 1 1
6 3142 1 1 29 THR HG21 H 10.589 -6.271 -1.637 1.00 . A X . 29 THR HG21 1 1
6 3143 1 1 29 THR HG22 H 11.433 -7.451 -0.636 1.00 . A X . 29 THR HG22 1 1
6 3144 1 1 29 THR HG23 H 10.771 -5.990 0.094 1.00 . A X . 29 THR HG23 1 1
6 3145 1 1 29 THR N N 8.657 -5.125 -0.708 1.00 . A X . 29 THR N 1 1
6 3146 1 1 29 THR O O 7.819 -5.664 1.843 1.00 . A X . 29 THR O 1 1
6 3147 1 1 29 THR OG1 O 9.357 -8.133 0.845 1.00 . A X . 29 THR OG1 1 1
6 3148 1 1 30 NH2 HN1 H 6.265 -7.973 0.526 1.00 . A X . 30 NH2 HN1 1 1
6 3149 1 1 30 NH2 HN2 H 6.098 -7.349 2.094 1.00 . A X . 30 NH2 HN2 1 1
6 3150 1 1 30 NH2 N N 6.536 -7.334 1.219 1.00 . A X . 30 NH2 N 1 1
6 3151 2 2 1 . C C 34.106 9.151 -7.956 1.00 . B X . 101 GGL C 1 1
6 3152 2 2 1 . CA C 32.921 9.996 -8.419 1.00 . B X . 101 GGL CA 1 1
6 3153 2 2 1 . CB C 31.827 9.082 -8.975 1.00 . B X . 101 GGL CB 1 1
6 3154 2 2 1 . CD C 30.131 7.495 -8.049 1.00 . B X . 101 GGL CD 1 1
6 3155 2 2 1 . CG C 31.595 7.918 -8.010 1.00 . B X . 101 GGL CG 1 1
6 3156 2 2 1 . H H 33.583 10.622 -10.333 1.00 . B X . 101 GGL H 1 1
6 3157 2 2 1 . HA H 32.526 10.538 -7.574 1.00 . B X . 101 GGL HA 1 1
6 3158 2 2 1 . HB2 H 32.134 8.696 -9.935 1.00 . B X . 101 GGL HB2 1 1
6 3159 2 2 1 . HB3 H 30.912 9.645 -9.087 1.00 . B X . 101 GGL HB3 1 1
6 3160 2 2 1 . HG2 H 32.217 7.082 -8.300 1.00 . B X . 101 GGL HG2 1 1
6 3161 2 2 1 . HG3 H 31.854 8.224 -7.008 1.00 . B X . 101 GGL HG3 1 1
6 3162 2 2 1 . N N 33.341 10.948 -9.441 1.00 . B X . 101 GGL N 1 1
6 3163 2 2 1 . O O 34.381 8.151 -8.597 1.00 . B X . 101 GGL O 1 1
6 3164 2 2 1 . OE1 O 29.729 6.694 -8.893 1.00 . B X . 101 GGL OE1 1 1
6 3165 2 2 1 . OXT O 34.696 9.499 -6.947 1.00 . B X . 101 GGL OXT 1 1
6 3166 3 2 1 . C C 30.830 14.638 -12.457 1.00 . C X . 102 GGL C 1 1
6 3167 3 2 1 . CA C 30.540 13.599 -11.379 1.00 . C X . 102 GGL CA 1 1
6 3168 3 2 1 . CB C 31.826 12.845 -11.035 1.00 . C X . 102 GGL CB 1 1
6 3169 3 2 1 . CD C 33.399 12.250 -9.183 1.00 . C X . 102 GGL CD 1 1
6 3170 3 2 1 . CG C 32.168 13.066 -9.560 1.00 . C X . 102 GGL CG 1 1
6 3171 3 2 1 . H H 29.223 12.688 -12.769 1.00 . C X . 102 GGL H 1 1
6 3172 3 2 1 . HA H 30.182 14.101 -10.494 1.00 . C X . 102 GGL HA 1 1
6 3173 3 2 1 . HB2 H 31.685 11.789 -11.217 1.00 . C X . 102 GGL HB2 1 1
6 3174 3 2 1 . HB3 H 32.633 13.211 -11.649 1.00 . C X . 102 GGL HB3 1 1
6 3175 3 2 1 . HG2 H 31.333 12.759 -8.949 1.00 . C X . 102 GGL HG2 1 1
6 3176 3 2 1 . HG3 H 32.369 14.115 -9.393 1.00 . C X . 102 GGL HG3 1 1
6 3177 3 2 1 . N N 29.520 12.660 -11.835 1.00 . C X . 102 GGL N 1 1
6 3178 3 2 1 . O O 30.193 14.581 -13.495 1.00 . C X . 102 GGL O 1 1
6 3179 3 2 1 . OE1 O 34.393 12.794 -8.699 1.00 . C X . 102 GGL OE1 1 1
6 3180 3 2 1 . OXT O 31.668 15.493 -12.217 1.00 . C X . 102 GGL OXT 1 1
6 3181 4 3 1 PLM C1 C 28.984 11.771 -11.005 1.00 . D X . 103 PLM C1 1 1
6 3182 4 3 1 PLM C2 C 27.689 11.113 -11.470 1.00 . D X . 103 PLM C2 1 1
6 3183 4 3 1 PLM C3 C 28.002 9.947 -12.409 1.00 . D X . 103 PLM C3 1 1
6 3184 4 3 1 PLM C4 C 28.515 8.758 -11.593 1.00 . D X . 103 PLM C4 1 1
6 3185 4 3 1 PLM C5 C 28.845 7.597 -12.535 1.00 . D X . 103 PLM C5 1 1
6 3186 4 3 1 PLM C6 C 30.269 7.107 -12.259 1.00 . D X . 103 PLM C6 1 1
6 3187 4 3 1 PLM C7 C 30.591 5.932 -13.186 1.00 . D X . 103 PLM C7 1 1
6 3188 4 3 1 PLM C8 C 30.159 4.622 -12.522 1.00 . D X . 103 PLM C8 1 1
6 3189 4 3 1 PLM C9 C 31.307 4.080 -11.667 1.00 . D X . 103 PLM C9 1 1
6 3190 4 3 1 PLM CA C 30.861 2.793 -10.968 1.00 . D X . 103 PLM CA 1 1
6 3191 4 3 1 PLM CB C 31.159 2.896 -9.471 1.00 . D X . 103 PLM CB 1 1
6 3192 4 3 1 PLM CC C 30.236 3.939 -8.836 1.00 . D X . 103 PLM CC 1 1
6 3193 4 3 1 PLM CD C 29.263 3.246 -7.879 1.00 . D X . 103 PLM CD 1 1
6 3194 4 3 1 PLM CE C 28.217 4.254 -7.398 1.00 . D X . 103 PLM CE 1 1
6 3195 4 3 1 PLM CF C 27.025 4.242 -8.356 1.00 . D X . 103 PLM CF 1 1
6 3196 4 3 1 PLM CG C 26.060 3.122 -7.959 1.00 . D X . 103 PLM CG 1 1
6 3197 4 3 1 PLM H21 H 27.146 10.746 -10.611 1.00 . D X . 103 PLM H21 1 1
6 3198 4 3 1 PLM H22 H 27.084 11.841 -11.991 1.00 . D X . 103 PLM H22 1 1
6 3199 4 3 1 PLM H31 H 27.107 9.660 -12.939 1.00 . D X . 103 PLM H31 1 1
6 3200 4 3 1 PLM H32 H 28.760 10.249 -13.118 1.00 . D X . 103 PLM H32 1 1
6 3201 4 3 1 PLM H41 H 27.753 8.447 -10.894 1.00 . D X . 103 PLM H41 1 1
6 3202 4 3 1 PLM H42 H 29.403 9.047 -11.053 1.00 . D X . 103 PLM H42 1 1
6 3203 4 3 1 PLM H51 H 28.148 6.791 -12.370 1.00 . D X . 103 PLM H51 1 1
6 3204 4 3 1 PLM H52 H 28.772 7.933 -13.558 1.00 . D X . 103 PLM H52 1 1
6 3205 4 3 1 PLM H61 H 30.346 6.787 -11.231 1.00 . D X . 103 PLM H61 1 1
6 3206 4 3 1 PLM H62 H 30.967 7.910 -12.441 1.00 . D X . 103 PLM H62 1 1
6 3207 4 3 1 PLM H71 H 30.063 6.054 -14.120 1.00 . D X . 103 PLM H71 1 1
6 3208 4 3 1 PLM H72 H 31.655 5.906 -13.375 1.00 . D X . 103 PLM H72 1 1
6 3209 4 3 1 PLM H81 H 29.907 3.900 -13.284 1.00 . D X . 103 PLM H81 1 1
6 3210 4 3 1 PLM H82 H 29.298 4.802 -11.897 1.00 . D X . 103 PLM H82 1 1
6 3211 4 3 1 PLM H91 H 32.158 3.869 -12.299 1.00 . D X . 103 PLM H91 1 1
6 3212 4 3 1 PLM H92 H 31.584 4.815 -10.926 1.00 . D X . 103 PLM H92 1 1
6 3213 4 3 1 PLM HA1 H 29.801 2.651 -11.115 1.00 . D X . 103 PLM HA1 1 1
6 3214 4 3 1 PLM HA2 H 31.399 1.953 -11.384 1.00 . D X . 103 PLM HA2 1 1
6 3215 4 3 1 PLM HB1 H 32.188 3.192 -9.327 1.00 . D X . 103 PLM HB1 1 1
6 3216 4 3 1 PLM HB2 H 30.992 1.936 -9.003 1.00 . D X . 103 PLM HB2 1 1
6 3217 4 3 1 PLM HC1 H 30.827 4.658 -8.288 1.00 . D X . 103 PLM HC1 1 1
6 3218 4 3 1 PLM HC2 H 29.679 4.447 -9.609 1.00 . D X . 103 PLM HC2 1 1
6 3219 4 3 1 PLM HD1 H 28.771 2.434 -8.393 1.00 . D X . 103 PLM HD1 1 1
6 3220 4 3 1 PLM HD2 H 29.808 2.857 -7.033 1.00 . D X . 103 PLM HD2 1 1
6 3221 4 3 1 PLM HE1 H 28.652 5.241 -7.378 1.00 . D X . 103 PLM HE1 1 1
6 3222 4 3 1 PLM HE2 H 27.884 3.987 -6.403 1.00 . D X . 103 PLM HE2 1 1
6 3223 4 3 1 PLM HF1 H 26.515 5.192 -8.307 1.00 . D X . 103 PLM HF1 1 1
6 3224 4 3 1 PLM HF2 H 27.374 4.073 -9.364 1.00 . D X . 103 PLM HF2 1 1
6 3225 4 3 1 PLM HG1 H 26.608 2.331 -7.470 1.00 . D X . 103 PLM HG1 1 1
6 3226 4 3 1 PLM HG2 H 25.314 3.514 -7.285 1.00 . D X . 103 PLM HG2 1 1
6 3227 4 3 1 PLM HG3 H 25.578 2.733 -8.844 1.00 . D X . 103 PLM HG3 1 1
6 3228 4 3 1 PLM O2 O 29.465 11.508 -9.903 1.00 . D X . 103 PLM O2 1 1
7 3229 1 1 1 HIS C C 38.463 3.374 -6.760 1.00 . A X . 1 HIS C 1 1
7 3230 1 1 1 HIS CA C 39.797 3.059 -7.426 1.00 . A X . 1 HIS CA 1 1
7 3231 1 1 1 HIS CB C 40.008 3.976 -8.634 1.00 . A X . 1 HIS CB 1 1
7 3232 1 1 1 HIS CD2 C 42.492 4.807 -8.416 1.00 . A X . 1 HIS CD2 1 1
7 3233 1 1 1 HIS CE1 C 43.372 3.585 -9.973 1.00 . A X . 1 HIS CE1 1 1
7 3234 1 1 1 HIS CG C 41.476 4.054 -8.951 1.00 . A X . 1 HIS CG 1 1
7 3235 1 1 1 HIS H1 H 39.829 1.604 -8.916 1.00 . A X . 1 HIS H1 1 1
7 3236 1 1 1 HIS H2 H 38.939 1.165 -7.537 1.00 . A X . 1 HIS H2 1 1
7 3237 1 1 1 HIS H3 H 40.638 1.157 -7.493 1.00 . A X . 1 HIS H3 1 1
7 3238 1 1 1 HIS HA H 40.597 3.212 -6.716 1.00 . A X . 1 HIS HA 1 1
7 3239 1 1 1 HIS HB2 H 39.476 3.575 -9.486 1.00 . A X . 1 HIS HB2 1 1
7 3240 1 1 1 HIS HB3 H 39.635 4.964 -8.405 1.00 . A X . 1 HIS HB3 1 1
7 3241 1 1 1 HIS HD2 H 42.380 5.521 -7.614 1.00 . A X . 1 HIS HD2 1 1
7 3242 1 1 1 HIS HE1 H 44.081 3.135 -10.651 1.00 . A X . 1 HIS HE1 1 1
7 3243 1 1 1 HIS HE2 H 44.571 4.894 -8.887 1.00 . A X . 1 HIS HE2 1 1
7 3244 1 1 1 HIS N N 39.801 1.640 -7.876 1.00 . A X . 1 HIS N 1 1
7 3245 1 1 1 HIS ND1 N 42.061 3.282 -9.943 1.00 . A X . 1 HIS ND1 1 1
7 3246 1 1 1 HIS NE2 N 43.687 4.509 -9.062 1.00 . A X . 1 HIS NE2 1 1
7 3247 1 1 1 HIS O O 37.399 3.177 -7.350 1.00 . A X . 1 HIS O 1 1
7 3248 1 1 2 ABA C C 37.656 4.558 -3.343 1.00 . A X . 2 AIB C 1 1
7 3249 1 1 2 ABA CA C 37.313 4.203 -4.788 1.00 . A X . 2 AIB CA 1 1
7 3250 1 1 2 ABA H H 39.399 4.001 -5.104 1.00 . A X . 2 AIB H 1 1
7 3251 1 1 2 ABA N N 38.524 3.865 -5.526 1.00 . A X . 2 AIB N 1 1
7 3252 1 1 2 ABA O O 37.599 5.721 -2.946 1.00 . A X . 2 AIB O 1 1
7 3253 1 1 3 GLN C C 39.395 4.890 -1.033 1.00 . A X . 3 GLN C 1 1
7 3254 1 1 3 GLN CA C 38.365 3.771 -1.161 1.00 . A X . 3 GLN CA 1 1
7 3255 1 1 3 GLN CB C 38.927 2.485 -0.554 1.00 . A X . 3 GLN CB 1 1
7 3256 1 1 3 GLN CD C 41.340 1.821 -0.599 1.00 . A X . 3 GLN CD 1 1
7 3257 1 1 3 GLN CG C 40.069 1.963 -1.429 1.00 . A X . 3 GLN CG 1 1
7 3258 1 1 3 GLN H H 38.046 2.641 -2.927 1.00 . A X . 3 GLN H 1 1
7 3259 1 1 3 GLN HA H 37.475 4.051 -0.619 1.00 . A X . 3 GLN HA 1 1
7 3260 1 1 3 GLN HB2 H 39.299 2.690 0.439 1.00 . A X . 3 GLN HB2 1 1
7 3261 1 1 3 GLN HB3 H 38.148 1.741 -0.501 1.00 . A X . 3 GLN HB3 1 1
7 3262 1 1 3 GLN HE21 H 42.406 3.034 -1.753 1.00 . A X . 3 GLN HE21 1 1
7 3263 1 1 3 GLN HE22 H 43.238 2.377 -0.427 1.00 . A X . 3 GLN HE22 1 1
7 3264 1 1 3 GLN HG2 H 39.795 0.999 -1.835 1.00 . A X . 3 GLN HG2 1 1
7 3265 1 1 3 GLN HG3 H 40.247 2.658 -2.238 1.00 . A X . 3 GLN HG3 1 1
7 3266 1 1 3 GLN N N 38.015 3.550 -2.559 1.00 . A X . 3 GLN N 1 1
7 3267 1 1 3 GLN NE2 N 42.417 2.464 -0.956 1.00 . A X . 3 GLN NE2 1 1
7 3268 1 1 3 GLN O O 39.697 5.339 0.074 1.00 . A X . 3 GLN O 1 1
7 3269 1 1 3 GLN OE1 O 41.350 1.106 0.404 1.00 . A X . 3 GLN OE1 1 1
7 3270 1 1 4 GLY C C 40.457 7.604 -2.977 1.00 . A X . 4 GLY C 1 1
7 3271 1 1 4 GLY CA C 40.933 6.398 -2.172 1.00 . A X . 4 GLY CA 1 1
7 3272 1 1 4 GLY H H 39.656 4.933 -3.018 1.00 . A X . 4 GLY H 1 1
7 3273 1 1 4 GLY HA2 H 41.130 6.707 -1.155 1.00 . A X . 4 GLY HA2 1 1
7 3274 1 1 4 GLY HA3 H 41.845 6.022 -2.610 1.00 . A X . 4 GLY HA3 1 1
7 3275 1 1 4 GLY N N 39.932 5.333 -2.167 1.00 . A X . 4 GLY N 1 1
7 3276 1 1 4 GLY O O 41.116 8.643 -2.996 1.00 . A X . 4 GLY O 1 1
7 3277 1 1 5 THR C C 37.275 8.734 -4.195 1.00 . A X . 5 THR C 1 1
7 3278 1 1 5 THR CA C 38.770 8.548 -4.451 1.00 . A X . 5 THR CA 1 1
7 3279 1 1 5 THR CB C 39.007 8.266 -5.936 1.00 . A X . 5 THR CB 1 1
7 3280 1 1 5 THR CG2 C 39.888 7.025 -6.088 1.00 . A X . 5 THR CG2 1 1
7 3281 1 1 5 THR H H 38.833 6.608 -3.597 1.00 . A X . 5 THR H 1 1
7 3282 1 1 5 THR HA H 39.278 9.463 -4.191 1.00 . A X . 5 THR HA 1 1
7 3283 1 1 5 THR HB H 39.504 9.111 -6.388 1.00 . A X . 5 THR HB 1 1
7 3284 1 1 5 THR HG1 H 37.217 8.829 -6.449 1.00 . A X . 5 THR HG1 1 1
7 3285 1 1 5 THR HG21 H 40.803 7.163 -5.529 1.00 . A X . 5 THR HG21 1 1
7 3286 1 1 5 THR HG22 H 40.122 6.876 -7.131 1.00 . A X . 5 THR HG22 1 1
7 3287 1 1 5 THR HG23 H 39.362 6.161 -5.709 1.00 . A X . 5 THR HG23 1 1
7 3288 1 1 5 THR N N 39.314 7.459 -3.644 1.00 . A X . 5 THR N 1 1
7 3289 1 1 5 THR O O 36.599 9.456 -4.928 1.00 . A X . 5 THR O 1 1
7 3290 1 1 5 THR OG1 O 37.761 8.049 -6.583 1.00 . A X . 5 THR OG1 1 1
7 3291 1 1 6 PHE C C 35.138 9.218 -1.699 1.00 . A X . 6 PHE C 1 1
7 3292 1 1 6 PHE CA C 35.345 8.202 -2.819 1.00 . A X . 6 PHE CA 1 1
7 3293 1 1 6 PHE CB C 34.777 6.842 -2.395 1.00 . A X . 6 PHE CB 1 1
7 3294 1 1 6 PHE CD1 C 36.236 6.695 -0.340 1.00 . A X . 6 PHE CD1 1 1
7 3295 1 1 6 PHE CD2 C 33.842 6.397 -0.093 1.00 . A X . 6 PHE CD2 1 1
7 3296 1 1 6 PHE CE1 C 36.399 6.501 1.037 1.00 . A X . 6 PHE CE1 1 1
7 3297 1 1 6 PHE CE2 C 34.007 6.206 1.283 1.00 . A X . 6 PHE CE2 1 1
7 3298 1 1 6 PHE CG C 34.956 6.643 -0.907 1.00 . A X . 6 PHE CG 1 1
7 3299 1 1 6 PHE CZ C 35.286 6.258 1.849 1.00 . A X . 6 PHE CZ 1 1
7 3300 1 1 6 PHE H H 37.346 7.527 -2.599 1.00 . A X . 6 PHE H 1 1
7 3301 1 1 6 PHE HA H 34.814 8.540 -3.694 1.00 . A X . 6 PHE HA 1 1
7 3302 1 1 6 PHE HB2 H 33.725 6.807 -2.638 1.00 . A X . 6 PHE HB2 1 1
7 3303 1 1 6 PHE HB3 H 35.289 6.058 -2.928 1.00 . A X . 6 PHE HB3 1 1
7 3304 1 1 6 PHE HD1 H 37.096 6.884 -0.962 1.00 . A X . 6 PHE HD1 1 1
7 3305 1 1 6 PHE HD2 H 32.855 6.356 -0.528 1.00 . A X . 6 PHE HD2 1 1
7 3306 1 1 6 PHE HE1 H 37.387 6.539 1.475 1.00 . A X . 6 PHE HE1 1 1
7 3307 1 1 6 PHE HE2 H 33.147 6.019 1.908 1.00 . A X . 6 PHE HE2 1 1
7 3308 1 1 6 PHE HZ H 35.413 6.109 2.911 1.00 . A X . 6 PHE HZ 1 1
7 3309 1 1 6 PHE N N 36.763 8.086 -3.153 1.00 . A X . 6 PHE N 1 1
7 3310 1 1 6 PHE O O 34.102 9.879 -1.632 1.00 . A X . 6 PHE O 1 1
7 3311 1 1 7 THR C C 35.426 11.599 -0.160 1.00 . A X . 7 THR C 1 1
7 3312 1 1 7 THR CA C 36.047 10.279 0.289 1.00 . A X . 7 THR CA 1 1
7 3313 1 1 7 THR CB C 37.442 10.540 0.858 1.00 . A X . 7 THR CB 1 1
7 3314 1 1 7 THR CG2 C 38.078 9.217 1.286 1.00 . A X . 7 THR CG2 1 1
7 3315 1 1 7 THR H H 36.934 8.788 -0.929 1.00 . A X . 7 THR H 1 1
7 3316 1 1 7 THR HA H 35.429 9.848 1.063 1.00 . A X . 7 THR HA 1 1
7 3317 1 1 7 THR HB H 37.365 11.192 1.715 1.00 . A X . 7 THR HB 1 1
7 3318 1 1 7 THR HG1 H 39.157 11.159 0.178 1.00 . A X . 7 THR HG1 1 1
7 3319 1 1 7 THR HG21 H 39.094 9.394 1.607 1.00 . A X . 7 THR HG21 1 1
7 3320 1 1 7 THR HG22 H 38.079 8.532 0.452 1.00 . A X . 7 THR HG22 1 1
7 3321 1 1 7 THR HG23 H 37.511 8.794 2.102 1.00 . A X . 7 THR HG23 1 1
7 3322 1 1 7 THR N N 36.131 9.340 -0.824 1.00 . A X . 7 THR N 1 1
7 3323 1 1 7 THR O O 34.301 11.928 0.217 1.00 . A X . 7 THR O 1 1
7 3324 1 1 7 THR OG1 O 38.249 11.157 -0.135 1.00 . A X . 7 THR OG1 1 1
7 3325 1 1 8 SER C C 34.616 13.460 -2.516 1.00 . A X . 8 SER C 1 1
7 3326 1 1 8 SER CA C 35.687 13.646 -1.446 1.00 . A X . 8 SER CA 1 1
7 3327 1 1 8 SER CB C 36.850 14.452 -2.024 1.00 . A X . 8 SER CB 1 1
7 3328 1 1 8 SER H H 37.062 12.047 -1.223 1.00 . A X . 8 SER H 1 1
7 3329 1 1 8 SER HA H 35.262 14.194 -0.620 1.00 . A X . 8 SER HA 1 1
7 3330 1 1 8 SER HB2 H 37.784 14.018 -1.708 1.00 . A X . 8 SER HB2 1 1
7 3331 1 1 8 SER HB3 H 36.795 14.437 -3.104 1.00 . A X . 8 SER HB3 1 1
7 3332 1 1 8 SER HG H 37.577 16.245 -1.813 1.00 . A X . 8 SER HG 1 1
7 3333 1 1 8 SER N N 36.170 12.358 -0.960 1.00 . A X . 8 SER N 1 1
7 3334 1 1 8 SER O O 34.442 14.314 -3.386 1.00 . A X . 8 SER O 1 1
7 3335 1 1 8 SER OG O 36.773 15.791 -1.551 1.00 . A X . 8 SER OG 1 1
7 3336 1 1 9 ASP C C 31.848 11.060 -2.849 1.00 . A X . 9 ASP C 1 1
7 3337 1 1 9 ASP CA C 32.846 12.062 -3.416 1.00 . A X . 9 ASP CA 1 1
7 3338 1 1 9 ASP CB C 33.453 11.505 -4.706 1.00 . A X . 9 ASP CB 1 1
7 3339 1 1 9 ASP CG C 34.492 12.477 -5.255 1.00 . A X . 9 ASP CG 1 1
7 3340 1 1 9 ASP H H 34.078 11.698 -1.732 1.00 . A X . 9 ASP H 1 1
7 3341 1 1 9 ASP HA H 32.327 12.981 -3.646 1.00 . A X . 9 ASP HA 1 1
7 3342 1 1 9 ASP HB2 H 33.926 10.555 -4.497 1.00 . A X . 9 ASP HB2 1 1
7 3343 1 1 9 ASP HB3 H 32.672 11.366 -5.440 1.00 . A X . 9 ASP HB3 1 1
7 3344 1 1 9 ASP N N 33.899 12.343 -2.448 1.00 . A X . 9 ASP N 1 1
7 3345 1 1 9 ASP O O 31.077 10.449 -3.590 1.00 . A X . 9 ASP O 1 1
7 3346 1 1 9 ASP OD1 O 34.094 13.448 -5.878 1.00 . A X . 9 ASP OD1 1 1
7 3347 1 1 9 ASP OD2 O 35.670 12.235 -5.047 1.00 . A X . 9 ASP OD2 1 1
7 3348 1 1 10 TYR C C 29.828 10.716 -0.176 1.00 . A X . 10 TYR C 1 1
7 3349 1 1 10 TYR CA C 30.958 9.964 -0.871 1.00 . A X . 10 TYR CA 1 1
7 3350 1 1 10 TYR CB C 31.723 9.127 0.159 1.00 . A X . 10 TYR CB 1 1
7 3351 1 1 10 TYR CD1 C 30.360 7.030 -0.142 1.00 . A X . 10 TYR CD1 1 1
7 3352 1 1 10 TYR CD2 C 30.435 8.061 2.051 1.00 . A X . 10 TYR CD2 1 1
7 3353 1 1 10 TYR CE1 C 29.519 6.028 0.357 1.00 . A X . 10 TYR CE1 1 1
7 3354 1 1 10 TYR CE2 C 29.595 7.059 2.550 1.00 . A X . 10 TYR CE2 1 1
7 3355 1 1 10 TYR CG C 30.818 8.045 0.704 1.00 . A X . 10 TYR CG 1 1
7 3356 1 1 10 TYR CZ C 29.137 6.042 1.703 1.00 . A X . 10 TYR CZ 1 1
7 3357 1 1 10 TYR H H 32.503 11.410 -0.990 1.00 . A X . 10 TYR H 1 1
7 3358 1 1 10 TYR HA H 30.535 9.305 -1.613 1.00 . A X . 10 TYR HA 1 1
7 3359 1 1 10 TYR HB2 H 32.581 8.674 -0.315 1.00 . A X . 10 TYR HB2 1 1
7 3360 1 1 10 TYR HB3 H 32.052 9.762 0.967 1.00 . A X . 10 TYR HB3 1 1
7 3361 1 1 10 TYR HD1 H 30.653 7.016 -1.181 1.00 . A X . 10 TYR HD1 1 1
7 3362 1 1 10 TYR HD2 H 30.789 8.843 2.704 1.00 . A X . 10 TYR HD2 1 1
7 3363 1 1 10 TYR HE1 H 29.167 5.245 -0.298 1.00 . A X . 10 TYR HE1 1 1
7 3364 1 1 10 TYR HE2 H 29.300 7.069 3.588 1.00 . A X . 10 TYR HE2 1 1
7 3365 1 1 10 TYR HH H 28.136 5.245 3.120 1.00 . A X . 10 TYR HH 1 1
7 3366 1 1 10 TYR N N 31.866 10.896 -1.529 1.00 . A X . 10 TYR N 1 1
7 3367 1 1 10 TYR O O 29.781 11.946 -0.202 1.00 . A X . 10 TYR O 1 1
7 3368 1 1 10 TYR OH O 28.309 5.054 2.195 1.00 . A X . 10 TYR OH 1 1
7 3369 1 1 11 SER C C 27.008 11.472 0.183 1.00 . A X . 11 SER C 1 1
7 3370 1 1 11 SER CA C 27.792 10.579 1.136 1.00 . A X . 11 SER CA 1 1
7 3371 1 1 11 SER CB C 28.294 11.408 2.319 1.00 . A X . 11 SER CB 1 1
7 3372 1 1 11 SER H H 29.005 8.994 0.428 1.00 . A X . 11 SER H 1 1
7 3373 1 1 11 SER HA H 27.143 9.801 1.504 1.00 . A X . 11 SER HA 1 1
7 3374 1 1 11 SER HB2 H 28.406 12.436 2.020 1.00 . A X . 11 SER HB2 1 1
7 3375 1 1 11 SER HB3 H 27.577 11.347 3.129 1.00 . A X . 11 SER HB3 1 1
7 3376 1 1 11 SER HG H 30.227 11.262 2.165 1.00 . A X . 11 SER HG 1 1
7 3377 1 1 11 SER N N 28.918 9.970 0.442 1.00 . A X . 11 SER N 1 1
7 3378 1 1 11 SER O O 26.306 12.388 0.610 1.00 . A X . 11 SER O 1 1
7 3379 1 1 11 SER OG O 29.552 10.903 2.746 1.00 . A X . 11 SER OG 1 1
7 3380 1 1 12 LYS C C 26.020 11.120 -3.298 1.00 . A X . 12 LYS C 1 1
7 3381 1 1 12 LYS CA C 26.443 11.993 -2.118 1.00 . A X . 12 LYS CA 1 1
7 3382 1 1 12 LYS CB C 27.351 13.122 -2.613 1.00 . A X . 12 LYS CB 1 1
7 3383 1 1 12 LYS CD C 27.426 15.001 -4.257 1.00 . A X . 12 LYS CD 1 1
7 3384 1 1 12 LYS CE C 26.969 15.470 -5.640 1.00 . A X . 12 LYS CE 1 1
7 3385 1 1 12 LYS CG C 26.879 13.597 -3.989 1.00 . A X . 12 LYS CG 1 1
7 3386 1 1 12 LYS H H 27.717 10.462 -1.395 1.00 . A X . 12 LYS H 1 1
7 3387 1 1 12 LYS HA H 25.561 12.427 -1.673 1.00 . A X . 12 LYS HA 1 1
7 3388 1 1 12 LYS HB2 H 27.311 13.946 -1.915 1.00 . A X . 12 LYS HB2 1 1
7 3389 1 1 12 LYS HB3 H 28.365 12.761 -2.687 1.00 . A X . 12 LYS HB3 1 1
7 3390 1 1 12 LYS HD2 H 27.052 15.681 -3.505 1.00 . A X . 12 LYS HD2 1 1
7 3391 1 1 12 LYS HD3 H 28.503 14.982 -4.224 1.00 . A X . 12 LYS HD3 1 1
7 3392 1 1 12 LYS HE2 H 25.911 15.283 -5.754 1.00 . A X . 12 LYS HE2 1 1
7 3393 1 1 12 LYS HE3 H 27.161 16.528 -5.743 1.00 . A X . 12 LYS HE3 1 1
7 3394 1 1 12 LYS HG2 H 27.243 12.918 -4.747 1.00 . A X . 12 LYS HG2 1 1
7 3395 1 1 12 LYS HG3 H 25.801 13.621 -4.013 1.00 . A X . 12 LYS HG3 1 1
7 3396 1 1 12 LYS HZ1 H 27.717 13.710 -6.464 1.00 . A X . 12 LYS HZ1 1 1
7 3397 1 1 12 LYS HZ2 H 28.702 15.070 -6.724 1.00 . A X . 12 LYS HZ2 1 1
7 3398 1 1 12 LYS HZ3 H 27.268 14.874 -7.614 1.00 . A X . 12 LYS HZ3 1 1
7 3399 1 1 12 LYS N N 27.140 11.203 -1.112 1.00 . A X . 12 LYS N 1 1
7 3400 1 1 12 LYS NZ N 27.720 14.725 -6.690 1.00 . A X . 12 LYS NZ 1 1
7 3401 1 1 12 LYS O O 24.895 11.230 -3.785 1.00 . A X . 12 LYS O 1 1
7 3402 1 1 13 LYS C C 26.272 7.983 -4.415 1.00 . A X . 13 LYS C 1 1
7 3403 1 1 13 LYS CA C 26.627 9.387 -4.889 1.00 . A X . 13 LYS CA 1 1
7 3404 1 1 13 LYS CB C 27.821 9.330 -5.850 1.00 . A X . 13 LYS CB 1 1
7 3405 1 1 13 LYS CD C 26.668 9.517 -8.065 1.00 . A X . 13 LYS CD 1 1
7 3406 1 1 13 LYS CE C 27.537 8.728 -9.048 1.00 . A X . 13 LYS CE 1 1
7 3407 1 1 13 LYS CG C 27.560 10.243 -7.052 1.00 . A X . 13 LYS CG 1 1
7 3408 1 1 13 LYS H H 27.811 10.220 -3.337 1.00 . A X . 13 LYS H 1 1
7 3409 1 1 13 LYS HA H 25.775 9.789 -5.416 1.00 . A X . 13 LYS HA 1 1
7 3410 1 1 13 LYS HB2 H 28.712 9.661 -5.334 1.00 . A X . 13 LYS HB2 1 1
7 3411 1 1 13 LYS HB3 H 27.962 8.319 -6.198 1.00 . A X . 13 LYS HB3 1 1
7 3412 1 1 13 LYS HD2 H 26.010 8.839 -7.543 1.00 . A X . 13 LYS HD2 1 1
7 3413 1 1 13 LYS HD3 H 26.079 10.242 -8.609 1.00 . A X . 13 LYS HD3 1 1
7 3414 1 1 13 LYS HE2 H 28.110 7.991 -8.509 1.00 . A X . 13 LYS HE2 1 1
7 3415 1 1 13 LYS HE3 H 26.898 8.229 -9.763 1.00 . A X . 13 LYS HE3 1 1
7 3416 1 1 13 LYS HG2 H 27.069 11.146 -6.721 1.00 . A X . 13 LYS HG2 1 1
7 3417 1 1 13 LYS HG3 H 28.497 10.495 -7.519 1.00 . A X . 13 LYS HG3 1 1
7 3418 1 1 13 LYS HZ1 H 28.148 10.526 -9.989 1.00 . A X . 13 LYS HZ1 1 1
7 3419 1 1 13 LYS N N 26.928 10.262 -3.759 1.00 . A X . 13 LYS N 1 1
7 3420 1 1 13 LYS NZ N 28.446 9.623 -9.752 1.00 . A X . 13 LYS NZ 1 1
7 3421 1 1 13 LYS O O 25.105 7.695 -4.165 1.00 . A X . 13 LYS O 1 1
7 3422 1 1 14 LEU C C 26.001 5.727 -2.746 1.00 . A X . 14 LEU C 1 1
7 3423 1 1 14 LEU CA C 27.014 5.741 -3.880 1.00 . A X . 14 LEU CA 1 1
7 3424 1 1 14 LEU CB C 28.304 5.044 -3.439 1.00 . A X . 14 LEU CB 1 1
7 3425 1 1 14 LEU CD1 C 30.772 5.269 -3.125 1.00 . A X . 14 LEU CD1 1 1
7 3426 1 1 14 LEU CD2 C 29.708 6.192 -5.179 1.00 . A X . 14 LEU CD2 1 1
7 3427 1 1 14 LEU CG C 29.519 5.949 -3.677 1.00 . A X . 14 LEU CG 1 1
7 3428 1 1 14 LEU H H 28.182 7.388 -4.528 1.00 . A X . 14 LEU H 1 1
7 3429 1 1 14 LEU HA H 26.599 5.197 -4.713 1.00 . A X . 14 LEU HA 1 1
7 3430 1 1 14 LEU HB2 H 28.236 4.803 -2.390 1.00 . A X . 14 LEU HB2 1 1
7 3431 1 1 14 LEU HB3 H 28.423 4.132 -4.007 1.00 . A X . 14 LEU HB3 1 1
7 3432 1 1 14 LEU HD11 H 31.576 5.985 -3.070 1.00 . A X . 14 LEU HD11 1 1
7 3433 1 1 14 LEU HD12 H 31.057 4.457 -3.777 1.00 . A X . 14 LEU HD12 1 1
7 3434 1 1 14 LEU HD13 H 30.567 4.881 -2.138 1.00 . A X . 14 LEU HD13 1 1
7 3435 1 1 14 LEU HD21 H 30.564 5.631 -5.528 1.00 . A X . 14 LEU HD21 1 1
7 3436 1 1 14 LEU HD22 H 29.872 7.244 -5.356 1.00 . A X . 14 LEU HD22 1 1
7 3437 1 1 14 LEU HD23 H 28.828 5.872 -5.714 1.00 . A X . 14 LEU HD23 1 1
7 3438 1 1 14 LEU HG H 29.371 6.893 -3.173 1.00 . A X . 14 LEU HG 1 1
7 3439 1 1 14 LEU N N 27.270 7.109 -4.308 1.00 . A X . 14 LEU N 1 1
7 3440 1 1 14 LEU O O 25.127 4.862 -2.691 1.00 . A X . 14 LEU O 1 1
7 3441 1 1 15 ASP C C 23.845 7.377 -1.264 1.00 . A X . 15 ASP C 1 1
7 3442 1 1 15 ASP CA C 25.157 6.794 -0.755 1.00 . A X . 15 ASP CA 1 1
7 3443 1 1 15 ASP CB C 25.722 7.673 0.362 1.00 . A X . 15 ASP CB 1 1
7 3444 1 1 15 ASP CG C 24.944 7.440 1.653 1.00 . A X . 15 ASP CG 1 1
7 3445 1 1 15 ASP H H 26.799 7.384 -1.955 1.00 . A X . 15 ASP H 1 1
7 3446 1 1 15 ASP HA H 24.977 5.799 -0.374 1.00 . A X . 15 ASP HA 1 1
7 3447 1 1 15 ASP HB2 H 26.763 7.427 0.521 1.00 . A X . 15 ASP HB2 1 1
7 3448 1 1 15 ASP HB3 H 25.635 8.713 0.076 1.00 . A X . 15 ASP HB3 1 1
7 3449 1 1 15 ASP N N 26.098 6.705 -1.857 1.00 . A X . 15 ASP N 1 1
7 3450 1 1 15 ASP O O 23.264 8.274 -0.654 1.00 . A X . 15 ASP O 1 1
7 3451 1 1 15 ASP OD1 O 24.055 6.603 1.642 1.00 . A X . 15 ASP OD1 1 1
7 3452 1 1 15 ASP OD2 O 25.249 8.099 2.633 1.00 . A X . 15 ASP OD2 1 1
7 3453 1 1 16 ABA C C 22.001 6.523 -4.347 1.00 . A X . 16 AIB C 1 1
7 3454 1 1 16 ABA CA C 22.173 7.295 -3.044 1.00 . A X . 16 AIB CA 1 1
7 3455 1 1 16 ABA H H 23.932 6.146 -2.830 1.00 . A X . 16 AIB H 1 1
7 3456 1 1 16 ABA N N 23.405 6.852 -2.402 1.00 . A X . 16 AIB N 1 1
7 3457 1 1 16 ABA O O 20.955 5.935 -4.605 1.00 . A X . 16 AIB O 1 1
7 3458 1 1 17 ARG C C 23.247 4.305 -6.180 1.00 . A X . 17 ARG C 1 1
7 3459 1 1 17 ARG CA C 23.026 5.796 -6.419 1.00 . A X . 17 ARG CA 1 1
7 3460 1 1 17 ARG CB C 24.123 6.333 -7.332 1.00 . A X . 17 ARG CB 1 1
7 3461 1 1 17 ARG CD C 22.725 6.044 -9.406 1.00 . A X . 17 ARG CD 1 1
7 3462 1 1 17 ARG CG C 23.499 7.046 -8.538 1.00 . A X . 17 ARG CG 1 1
7 3463 1 1 17 ARG CZ C 24.150 6.158 -11.370 1.00 . A X . 17 ARG CZ 1 1
7 3464 1 1 17 ARG H H 23.870 6.995 -4.896 1.00 . A X . 17 ARG H 1 1
7 3465 1 1 17 ARG HA H 22.067 5.944 -6.891 1.00 . A X . 17 ARG HA 1 1
7 3466 1 1 17 ARG HB2 H 24.730 7.031 -6.774 1.00 . A X . 17 ARG HB2 1 1
7 3467 1 1 17 ARG HB3 H 24.738 5.513 -7.672 1.00 . A X . 17 ARG HB3 1 1
7 3468 1 1 17 ARG HD2 H 23.055 5.042 -9.184 1.00 . A X . 17 ARG HD2 1 1
7 3469 1 1 17 ARG HD3 H 21.670 6.128 -9.188 1.00 . A X . 17 ARG HD3 1 1
7 3470 1 1 17 ARG HE H 22.207 6.637 -11.374 1.00 . A X . 17 ARG HE 1 1
7 3471 1 1 17 ARG HG2 H 22.823 7.814 -8.189 1.00 . A X . 17 ARG HG2 1 1
7 3472 1 1 17 ARG HG3 H 24.281 7.499 -9.129 1.00 . A X . 17 ARG HG3 1 1
7 3473 1 1 17 ARG HH11 H 25.016 5.551 -9.671 1.00 . A X . 17 ARG HH11 1 1
7 3474 1 1 17 ARG HH12 H 26.053 5.621 -11.057 1.00 . A X . 17 ARG HH12 1 1
7 3475 1 1 17 ARG HH21 H 23.559 6.730 -13.196 1.00 . A X . 17 ARG HH21 1 1
7 3476 1 1 17 ARG HH22 H 25.228 6.290 -13.053 1.00 . A X . 17 ARG HH22 1 1
7 3477 1 1 17 ARG N N 23.054 6.516 -5.155 1.00 . A X . 17 ARG N 1 1
7 3478 1 1 17 ARG NE N 22.951 6.323 -10.819 1.00 . A X . 17 ARG NE 1 1
7 3479 1 1 17 ARG NH1 N 25.151 5.744 -10.643 1.00 . A X . 17 ARG NH1 1 1
7 3480 1 1 17 ARG NH2 N 24.325 6.412 -12.638 1.00 . A X . 17 ARG NH2 1 1
7 3481 1 1 17 ARG O O 22.963 3.480 -7.049 1.00 . A X . 17 ARG O 1 1
7 3482 1 1 18 ARG C C 23.145 2.258 -3.406 1.00 . A X . 18 ARG C 1 1
7 3483 1 1 18 ARG CA C 23.980 2.580 -4.625 1.00 . A X . 18 ARG CA 1 1
7 3484 1 1 18 ARG CB C 25.460 2.364 -4.305 1.00 . A X . 18 ARG CB 1 1
7 3485 1 1 18 ARG CD C 27.051 0.556 -3.643 1.00 . A X . 18 ARG CD 1 1
7 3486 1 1 18 ARG CG C 25.802 0.883 -4.462 1.00 . A X . 18 ARG CG 1 1
7 3487 1 1 18 ARG CZ C 29.050 -0.771 -4.017 1.00 . A X . 18 ARG CZ 1 1
7 3488 1 1 18 ARG H H 23.931 4.673 -4.326 1.00 . A X . 18 ARG H 1 1
7 3489 1 1 18 ARG HA H 23.690 1.937 -5.442 1.00 . A X . 18 ARG HA 1 1
7 3490 1 1 18 ARG HB2 H 26.065 2.948 -4.985 1.00 . A X . 18 ARG HB2 1 1
7 3491 1 1 18 ARG HB3 H 25.658 2.672 -3.286 1.00 . A X . 18 ARG HB3 1 1
7 3492 1 1 18 ARG HD2 H 27.708 1.412 -3.636 1.00 . A X . 18 ARG HD2 1 1
7 3493 1 1 18 ARG HD3 H 26.761 0.321 -2.630 1.00 . A X . 18 ARG HD3 1 1
7 3494 1 1 18 ARG HE H 27.255 -1.222 -4.778 1.00 . A X . 18 ARG HE 1 1
7 3495 1 1 18 ARG HG2 H 24.972 0.285 -4.112 1.00 . A X . 18 ARG HG2 1 1
7 3496 1 1 18 ARG HG3 H 25.988 0.667 -5.503 1.00 . A X . 18 ARG HG3 1 1
7 3497 1 1 18 ARG HH11 H 29.259 0.860 -2.875 1.00 . A X . 18 ARG HH11 1 1
7 3498 1 1 18 ARG HH12 H 30.700 -0.068 -3.126 1.00 . A X . 18 ARG HH12 1 1
7 3499 1 1 18 ARG HH21 H 29.140 -2.445 -5.111 1.00 . A X . 18 ARG HH21 1 1
7 3500 1 1 18 ARG HH22 H 30.632 -1.940 -4.391 1.00 . A X . 18 ARG HH22 1 1
7 3501 1 1 18 ARG N N 23.740 3.969 -4.988 1.00 . A X . 18 ARG N 1 1
7 3502 1 1 18 ARG NE N 27.751 -0.583 -4.223 1.00 . A X . 18 ARG NE 1 1
7 3503 1 1 18 ARG NH1 N 29.722 0.072 -3.281 1.00 . A X . 18 ARG NH1 1 1
7 3504 1 1 18 ARG NH2 N 29.654 -1.798 -4.548 1.00 . A X . 18 ARG NH2 1 1
7 3505 1 1 18 ARG O O 23.420 1.311 -2.668 1.00 . A X . 18 ARG O 1 1
7 3506 1 1 19 ALA C C 19.810 3.210 -2.462 1.00 . A X . 19 ALA C 1 1
7 3507 1 1 19 ALA CA C 21.255 2.937 -2.058 1.00 . A X . 19 ALA CA 1 1
7 3508 1 1 19 ALA CB C 21.687 3.927 -0.984 1.00 . A X . 19 ALA CB 1 1
7 3509 1 1 19 ALA H H 21.991 3.829 -3.819 1.00 . A X . 19 ALA H 1 1
7 3510 1 1 19 ALA HA H 21.337 1.934 -1.669 1.00 . A X . 19 ALA HA 1 1
7 3511 1 1 19 ALA HB1 H 22.367 4.649 -1.425 1.00 . A X . 19 ALA HB1 1 1
7 3512 1 1 19 ALA HB2 H 22.188 3.397 -0.187 1.00 . A X . 19 ALA HB2 1 1
7 3513 1 1 19 ALA HB3 H 20.820 4.437 -0.593 1.00 . A X . 19 ALA HB3 1 1
7 3514 1 1 19 ALA N N 22.135 3.085 -3.197 1.00 . A X . 19 ALA N 1 1
7 3515 1 1 19 ALA O O 18.884 2.600 -1.928 1.00 . A X . 19 ALA O 1 1
7 3516 1 1 20 GLN C C 17.759 3.377 -4.803 1.00 . A X . 20 GLN C 1 1
7 3517 1 1 20 GLN CA C 18.281 4.459 -3.867 1.00 . A X . 20 GLN CA 1 1
7 3518 1 1 20 GLN CB C 18.285 5.807 -4.590 1.00 . A X . 20 GLN CB 1 1
7 3519 1 1 20 GLN CD C 16.833 7.548 -5.649 1.00 . A X . 20 GLN CD 1 1
7 3520 1 1 20 GLN CG C 16.844 6.249 -4.850 1.00 . A X . 20 GLN CG 1 1
7 3521 1 1 20 GLN H H 20.403 4.580 -3.806 1.00 . A X . 20 GLN H 1 1
7 3522 1 1 20 GLN HA H 17.626 4.525 -3.011 1.00 . A X . 20 GLN HA 1 1
7 3523 1 1 20 GLN HB2 H 18.782 6.544 -3.976 1.00 . A X . 20 GLN HB2 1 1
7 3524 1 1 20 GLN HB3 H 18.804 5.711 -5.532 1.00 . A X . 20 GLN HB3 1 1
7 3525 1 1 20 GLN HE21 H 16.523 6.644 -7.390 1.00 . A X . 20 GLN HE21 1 1
7 3526 1 1 20 GLN HE22 H 16.642 8.335 -7.461 1.00 . A X . 20 GLN HE22 1 1
7 3527 1 1 20 GLN HG2 H 16.329 5.480 -5.406 1.00 . A X . 20 GLN HG2 1 1
7 3528 1 1 20 GLN HG3 H 16.344 6.406 -3.905 1.00 . A X . 20 GLN HG3 1 1
7 3529 1 1 20 GLN N N 19.625 4.126 -3.408 1.00 . A X . 20 GLN N 1 1
7 3530 1 1 20 GLN NE2 N 16.652 7.505 -6.941 1.00 . A X . 20 GLN NE2 1 1
7 3531 1 1 20 GLN O O 16.769 2.709 -4.505 1.00 . A X . 20 GLN O 1 1
7 3532 1 1 20 GLN OE1 O 16.993 8.628 -5.083 1.00 . A X . 20 GLN OE1 1 1
7 3533 1 1 21 ASP C C 17.996 0.812 -6.239 1.00 . A X . 21 ASP C 1 1
7 3534 1 1 21 ASP CA C 18.034 2.187 -6.899 1.00 . A X . 21 ASP CA 1 1
7 3535 1 1 21 ASP CB C 19.018 2.167 -8.070 1.00 . A X . 21 ASP CB 1 1
7 3536 1 1 21 ASP CG C 18.600 1.107 -9.084 1.00 . A X . 21 ASP CG 1 1
7 3537 1 1 21 ASP H H 19.222 3.757 -6.115 1.00 . A X . 21 ASP H 1 1
7 3538 1 1 21 ASP HA H 17.050 2.427 -7.272 1.00 . A X . 21 ASP HA 1 1
7 3539 1 1 21 ASP HB2 H 19.024 3.137 -8.550 1.00 . A X . 21 ASP HB2 1 1
7 3540 1 1 21 ASP HB3 H 20.009 1.939 -7.702 1.00 . A X . 21 ASP HB3 1 1
7 3541 1 1 21 ASP N N 18.436 3.200 -5.932 1.00 . A X . 21 ASP N 1 1
7 3542 1 1 21 ASP O O 17.593 -0.175 -6.855 1.00 . A X . 21 ASP O 1 1
7 3543 1 1 21 ASP OD1 O 17.581 1.297 -9.726 1.00 . A X . 21 ASP OD1 1 1
7 3544 1 1 21 ASP OD2 O 19.306 0.118 -9.201 1.00 . A X . 21 ASP OD2 1 1
7 3545 1 1 22 PHE C C 17.375 -0.531 -3.172 1.00 . A X . 22 PHE C 1 1
7 3546 1 1 22 PHE CA C 18.464 -0.492 -4.242 1.00 . A X . 22 PHE CA 1 1
7 3547 1 1 22 PHE CB C 19.829 -0.647 -3.579 1.00 . A X . 22 PHE CB 1 1
7 3548 1 1 22 PHE CD1 C 20.176 -3.027 -4.271 1.00 . A X . 22 PHE CD1 1 1
7 3549 1 1 22 PHE CD2 C 20.084 -2.507 -1.908 1.00 . A X . 22 PHE CD2 1 1
7 3550 1 1 22 PHE CE1 C 20.358 -4.374 -3.970 1.00 . A X . 22 PHE CE1 1 1
7 3551 1 1 22 PHE CE2 C 20.266 -3.858 -1.603 1.00 . A X . 22 PHE CE2 1 1
7 3552 1 1 22 PHE CG C 20.040 -2.094 -3.243 1.00 . A X . 22 PHE CG 1 1
7 3553 1 1 22 PHE CZ C 20.403 -4.796 -2.635 1.00 . A X . 22 PHE CZ 1 1
7 3554 1 1 22 PHE H H 18.753 1.572 -4.551 1.00 . A X . 22 PHE H 1 1
7 3555 1 1 22 PHE HA H 18.316 -1.317 -4.924 1.00 . A X . 22 PHE HA 1 1
7 3556 1 1 22 PHE HB2 H 20.601 -0.317 -4.261 1.00 . A X . 22 PHE HB2 1 1
7 3557 1 1 22 PHE HB3 H 19.863 -0.055 -2.676 1.00 . A X . 22 PHE HB3 1 1
7 3558 1 1 22 PHE HD1 H 20.144 -2.705 -5.302 1.00 . A X . 22 PHE HD1 1 1
7 3559 1 1 22 PHE HD2 H 19.979 -1.783 -1.113 1.00 . A X . 22 PHE HD2 1 1
7 3560 1 1 22 PHE HE1 H 20.458 -5.087 -4.767 1.00 . A X . 22 PHE HE1 1 1
7 3561 1 1 22 PHE HE2 H 20.298 -4.178 -0.575 1.00 . A X . 22 PHE HE2 1 1
7 3562 1 1 22 PHE HZ H 20.543 -5.840 -2.403 1.00 . A X . 22 PHE HZ 1 1
7 3563 1 1 22 PHE N N 18.434 0.757 -4.984 1.00 . A X . 22 PHE N 1 1
7 3564 1 1 22 PHE O O 16.404 -1.278 -3.287 1.00 . A X . 22 PHE O 1 1
7 3565 1 1 23 VAL C C 15.183 0.612 -1.515 1.00 . A X . 23 VAL C 1 1
7 3566 1 1 23 VAL CA C 16.595 0.304 -1.022 1.00 . A X . 23 VAL CA 1 1
7 3567 1 1 23 VAL CB C 17.015 1.355 0.005 1.00 . A X . 23 VAL CB 1 1
7 3568 1 1 23 VAL CG1 C 15.987 1.404 1.136 1.00 . A X . 23 VAL CG1 1 1
7 3569 1 1 23 VAL CG2 C 18.386 0.989 0.578 1.00 . A X . 23 VAL CG2 1 1
7 3570 1 1 23 VAL H H 18.355 0.829 -2.078 1.00 . A X . 23 VAL H 1 1
7 3571 1 1 23 VAL HA H 16.588 -0.661 -0.538 1.00 . A X . 23 VAL HA 1 1
7 3572 1 1 23 VAL HB H 17.069 2.322 -0.473 1.00 . A X . 23 VAL HB 1 1
7 3573 1 1 23 VAL HG11 H 15.528 0.433 1.249 1.00 . A X . 23 VAL HG11 1 1
7 3574 1 1 23 VAL HG12 H 15.227 2.135 0.901 1.00 . A X . 23 VAL HG12 1 1
7 3575 1 1 23 VAL HG13 H 16.479 1.679 2.058 1.00 . A X . 23 VAL HG13 1 1
7 3576 1 1 23 VAL HG21 H 18.263 0.573 1.567 1.00 . A X . 23 VAL HG21 1 1
7 3577 1 1 23 VAL HG22 H 19.002 1.874 0.634 1.00 . A X . 23 VAL HG22 1 1
7 3578 1 1 23 VAL HG23 H 18.861 0.260 -0.062 1.00 . A X . 23 VAL HG23 1 1
7 3579 1 1 23 VAL N N 17.554 0.266 -2.121 1.00 . A X . 23 VAL N 1 1
7 3580 1 1 23 VAL O O 14.245 0.666 -0.719 1.00 . A X . 23 VAL O 1 1
7 3581 1 1 24 GLN C C 12.942 -0.174 -3.646 1.00 . A X . 24 GLN C 1 1
7 3582 1 1 24 GLN CA C 13.708 1.112 -3.364 1.00 . A X . 24 GLN CA 1 1
7 3583 1 1 24 GLN CB C 13.830 1.946 -4.644 1.00 . A X . 24 GLN CB 1 1
7 3584 1 1 24 GLN CD C 13.485 0.239 -6.439 1.00 . A X . 24 GLN CD 1 1
7 3585 1 1 24 GLN CG C 14.510 1.121 -5.736 1.00 . A X . 24 GLN CG 1 1
7 3586 1 1 24 GLN H H 15.799 0.760 -3.417 1.00 . A X . 24 GLN H 1 1
7 3587 1 1 24 GLN HA H 13.156 1.681 -2.631 1.00 . A X . 24 GLN HA 1 1
7 3588 1 1 24 GLN HB2 H 12.842 2.237 -4.975 1.00 . A X . 24 GLN HB2 1 1
7 3589 1 1 24 GLN HB3 H 14.418 2.829 -4.443 1.00 . A X . 24 GLN HB3 1 1
7 3590 1 1 24 GLN HE21 H 14.028 -1.402 -5.472 1.00 . A X . 24 GLN HE21 1 1
7 3591 1 1 24 GLN HE22 H 12.764 -1.603 -6.587 1.00 . A X . 24 GLN HE22 1 1
7 3592 1 1 24 GLN HG2 H 14.963 1.786 -6.455 1.00 . A X . 24 GLN HG2 1 1
7 3593 1 1 24 GLN HG3 H 15.273 0.498 -5.294 1.00 . A X . 24 GLN HG3 1 1
7 3594 1 1 24 GLN N N 15.026 0.813 -2.819 1.00 . A X . 24 GLN N 1 1
7 3595 1 1 24 GLN NE2 N 13.420 -1.025 -6.142 1.00 . A X . 24 GLN NE2 1 1
7 3596 1 1 24 GLN O O 11.722 -0.153 -3.808 1.00 . A X . 24 GLN O 1 1
7 3597 1 1 24 GLN OE1 O 12.724 0.719 -7.281 1.00 . A X . 24 GLN OE1 1 1
7 3598 1 1 25 TRP C C 13.017 -3.365 -2.608 1.00 . A X . 25 TRP C 1 1
7 3599 1 1 25 TRP CA C 13.015 -2.583 -3.903 1.00 . A X . 25 TRP CA 1 1
7 3600 1 1 25 TRP CB C 13.768 -3.393 -4.939 1.00 . A X . 25 TRP CB 1 1
7 3601 1 1 25 TRP CD1 C 13.055 -5.769 -4.551 1.00 . A X . 25 TRP CD1 1 1
7 3602 1 1 25 TRP CD2 C 14.983 -5.256 -3.540 1.00 . A X . 25 TRP CD2 1 1
7 3603 1 1 25 TRP CE2 C 14.732 -6.609 -3.234 1.00 . A X . 25 TRP CE2 1 1
7 3604 1 1 25 TRP CE3 C 16.134 -4.661 -3.028 1.00 . A X . 25 TRP CE3 1 1
7 3605 1 1 25 TRP CG C 13.925 -4.759 -4.386 1.00 . A X . 25 TRP CG 1 1
7 3606 1 1 25 TRP CH2 C 16.762 -6.729 -1.933 1.00 . A X . 25 TRP CH2 1 1
7 3607 1 1 25 TRP CZ2 C 15.613 -7.346 -2.435 1.00 . A X . 25 TRP CZ2 1 1
7 3608 1 1 25 TRP CZ3 C 17.015 -5.384 -2.233 1.00 . A X . 25 TRP CZ3 1 1
7 3609 1 1 25 TRP H H 14.631 -1.265 -3.512 1.00 . A X . 25 TRP H 1 1
7 3610 1 1 25 TRP HA H 11.999 -2.445 -4.237 1.00 . A X . 25 TRP HA 1 1
7 3611 1 1 25 TRP HB2 H 13.203 -3.429 -5.862 1.00 . A X . 25 TRP HB2 1 1
7 3612 1 1 25 TRP HB3 H 14.742 -2.960 -5.115 1.00 . A X . 25 TRP HB3 1 1
7 3613 1 1 25 TRP HD1 H 12.141 -5.714 -5.122 1.00 . A X . 25 TRP HD1 1 1
7 3614 1 1 25 TRP HE1 H 13.101 -7.761 -3.846 1.00 . A X . 25 TRP HE1 1 1
7 3615 1 1 25 TRP HE3 H 16.333 -3.629 -3.235 1.00 . A X . 25 TRP HE3 1 1
7 3616 1 1 25 TRP HH2 H 17.451 -7.287 -1.316 1.00 . A X . 25 TRP HH2 1 1
7 3617 1 1 25 TRP HZ2 H 15.407 -8.375 -2.200 1.00 . A X . 25 TRP HZ2 1 1
7 3618 1 1 25 TRP HZ3 H 17.896 -4.899 -1.849 1.00 . A X . 25 TRP HZ3 1 1
7 3619 1 1 25 TRP N N 13.656 -1.296 -3.674 1.00 . A X . 25 TRP N 1 1
7 3620 1 1 25 TRP NE1 N 13.537 -6.884 -3.876 1.00 . A X . 25 TRP NE1 1 1
7 3621 1 1 25 TRP O O 12.056 -4.060 -2.280 1.00 . A X . 25 TRP O 1 1
7 3622 1 1 26 LEU C C 13.026 -3.692 0.250 1.00 . A X . 26 LEU C 1 1
7 3623 1 1 26 LEU CA C 14.252 -3.950 -0.621 1.00 . A X . 26 LEU CA 1 1
7 3624 1 1 26 LEU CB C 15.514 -3.491 0.119 1.00 . A X . 26 LEU CB 1 1
7 3625 1 1 26 LEU CD1 C 16.440 -5.699 0.948 1.00 . A X . 26 LEU CD1 1 1
7 3626 1 1 26 LEU CD2 C 16.678 -3.633 2.327 1.00 . A X . 26 LEU CD2 1 1
7 3627 1 1 26 LEU CG C 15.766 -4.379 1.352 1.00 . A X . 26 LEU CG 1 1
7 3628 1 1 26 LEU H H 14.853 -2.681 -2.197 1.00 . A X . 26 LEU H 1 1
7 3629 1 1 26 LEU HA H 14.333 -5.000 -0.836 1.00 . A X . 26 LEU HA 1 1
7 3630 1 1 26 LEU HB2 H 16.360 -3.546 -0.548 1.00 . A X . 26 LEU HB2 1 1
7 3631 1 1 26 LEU HB3 H 15.383 -2.468 0.438 1.00 . A X . 26 LEU HB3 1 1
7 3632 1 1 26 LEU HD11 H 15.741 -6.318 0.397 1.00 . A X . 26 LEU HD11 1 1
7 3633 1 1 26 LEU HD12 H 16.755 -6.225 1.837 1.00 . A X . 26 LEU HD12 1 1
7 3634 1 1 26 LEU HD13 H 17.301 -5.492 0.335 1.00 . A X . 26 LEU HD13 1 1
7 3635 1 1 26 LEU HD21 H 16.852 -4.244 3.199 1.00 . A X . 26 LEU HD21 1 1
7 3636 1 1 26 LEU HD22 H 16.208 -2.707 2.624 1.00 . A X . 26 LEU HD22 1 1
7 3637 1 1 26 LEU HD23 H 17.621 -3.419 1.843 1.00 . A X . 26 LEU HD23 1 1
7 3638 1 1 26 LEU HG H 14.828 -4.596 1.840 1.00 . A X . 26 LEU HG 1 1
7 3639 1 1 26 LEU N N 14.118 -3.246 -1.877 1.00 . A X . 26 LEU N 1 1
7 3640 1 1 26 LEU O O 12.573 -4.574 0.979 1.00 . A X . 26 LEU O 1 1
7 3641 1 1 27 MET C C 10.049 -2.275 0.159 1.00 . A X . 27 MET C 1 1
7 3642 1 1 27 MET CA C 11.334 -2.100 0.966 1.00 . A X . 27 MET CA 1 1
7 3643 1 1 27 MET CB C 11.459 -0.647 1.427 1.00 . A X . 27 MET CB 1 1
7 3644 1 1 27 MET CE C 9.818 1.971 -1.301 1.00 . A X . 27 MET CE 1 1
7 3645 1 1 27 MET CG C 11.307 0.286 0.223 1.00 . A X . 27 MET CG 1 1
7 3646 1 1 27 MET H H 12.910 -1.804 -0.422 1.00 . A X . 27 MET H 1 1
7 3647 1 1 27 MET HA H 11.287 -2.737 1.837 1.00 . A X . 27 MET HA 1 1
7 3648 1 1 27 MET HB2 H 10.683 -0.430 2.149 1.00 . A X . 27 MET HB2 1 1
7 3649 1 1 27 MET HB3 H 12.428 -0.494 1.878 1.00 . A X . 27 MET HB3 1 1
7 3650 1 1 27 MET HE1 H 10.576 1.536 -1.937 1.00 . A X . 27 MET HE1 1 1
7 3651 1 1 27 MET HE2 H 10.116 2.967 -1.021 1.00 . A X . 27 MET HE2 1 1
7 3652 1 1 27 MET HE3 H 8.877 2.013 -1.831 1.00 . A X . 27 MET HE3 1 1
7 3653 1 1 27 MET HG2 H 12.017 1.097 0.305 1.00 . A X . 27 MET HG2 1 1
7 3654 1 1 27 MET HG3 H 11.495 -0.268 -0.688 1.00 . A X . 27 MET HG3 1 1
7 3655 1 1 27 MET N N 12.500 -2.470 0.174 1.00 . A X . 27 MET N 1 1
7 3656 1 1 27 MET O O 8.961 -1.947 0.632 1.00 . A X . 27 MET O 1 1
7 3657 1 1 27 MET SD S 9.626 0.954 0.185 1.00 . A X . 27 MET SD 1 1
7 3658 1 1 28 ASN C C 8.605 -4.472 -1.896 1.00 . A X . 28 ASN C 1 1
7 3659 1 1 28 ASN CA C 9.024 -3.006 -1.916 1.00 . A X . 28 ASN CA 1 1
7 3660 1 1 28 ASN CB C 9.352 -2.587 -3.351 1.00 . A X . 28 ASN CB 1 1
7 3661 1 1 28 ASN CG C 8.065 -2.297 -4.117 1.00 . A X . 28 ASN CG 1 1
7 3662 1 1 28 ASN H H 11.075 -3.036 -1.381 1.00 . A X . 28 ASN H 1 1
7 3663 1 1 28 ASN HA H 8.206 -2.401 -1.556 1.00 . A X . 28 ASN HA 1 1
7 3664 1 1 28 ASN HB2 H 9.966 -1.699 -3.333 1.00 . A X . 28 ASN HB2 1 1
7 3665 1 1 28 ASN HB3 H 9.888 -3.385 -3.843 1.00 . A X . 28 ASN HB3 1 1
7 3666 1 1 28 ASN HD21 H 9.002 -1.832 -5.805 1.00 . A X . 28 ASN HD21 1 1
7 3667 1 1 28 ASN HD22 H 7.308 -1.736 -5.865 1.00 . A X . 28 ASN HD22 1 1
7 3668 1 1 28 ASN N N 10.184 -2.792 -1.058 1.00 . A X . 28 ASN N 1 1
7 3669 1 1 28 ASN ND2 N 8.131 -1.925 -5.366 1.00 . A X . 28 ASN ND2 1 1
7 3670 1 1 28 ASN O O 7.477 -4.809 -2.254 1.00 . A X . 28 ASN O 1 1
7 3671 1 1 28 ASN OD1 O 6.972 -2.416 -3.563 1.00 . A X . 28 ASN OD1 1 1
7 3672 1 1 29 THR C C 8.123 -7.046 -0.404 1.00 . A X . 29 THR C 1 1
7 3673 1 1 29 THR CA C 9.233 -6.767 -1.411 1.00 . A X . 29 THR CA 1 1
7 3674 1 1 29 THR CB C 10.495 -7.536 -1.011 1.00 . A X . 29 THR CB 1 1
7 3675 1 1 29 THR CG2 C 11.512 -7.480 -2.152 1.00 . A X . 29 THR CG2 1 1
7 3676 1 1 29 THR H H 10.402 -5.012 -1.201 1.00 . A X . 29 THR H 1 1
7 3677 1 1 29 THR HA H 8.915 -7.104 -2.386 1.00 . A X . 29 THR HA 1 1
7 3678 1 1 29 THR HB H 10.240 -8.565 -0.811 1.00 . A X . 29 THR HB 1 1
7 3679 1 1 29 THR HG1 H 11.324 -6.054 -0.063 1.00 . A X . 29 THR HG1 1 1
7 3680 1 1 29 THR HG21 H 11.274 -6.656 -2.806 1.00 . A X . 29 THR HG21 1 1
7 3681 1 1 29 THR HG22 H 11.478 -8.405 -2.709 1.00 . A X . 29 THR HG22 1 1
7 3682 1 1 29 THR HG23 H 12.503 -7.342 -1.744 1.00 . A X . 29 THR HG23 1 1
7 3683 1 1 29 THR N N 9.519 -5.338 -1.474 1.00 . A X . 29 THR N 1 1
7 3684 1 1 29 THR O O 6.981 -6.631 -0.600 1.00 . A X . 29 THR O 1 1
7 3685 1 1 29 THR OG1 O 11.054 -6.949 0.155 1.00 . A X . 29 THR OG1 1 1
7 3686 1 1 30 NH2 HN1 H 9.301 -8.063 0.829 1.00 . A X . 30 NH2 HN1 1 1
7 3687 1 1 30 NH2 HN2 H 7.685 -7.918 1.326 1.00 . A X . 30 NH2 HN2 1 1
7 3688 1 1 30 NH2 N N 8.392 -7.733 0.673 1.00 . A X . 30 NH2 N 1 1
7 3689 2 2 1 . C C 32.702 10.169 -10.827 1.00 . B X . 101 GGL C 1 1
7 3690 2 2 1 . CA C 32.747 10.579 -9.358 1.00 . B X . 101 GGL CA 1 1
7 3691 2 2 1 . CB C 31.328 10.590 -8.787 1.00 . B X . 101 GGL CB 1 1
7 3692 2 2 1 . CD C 29.673 9.235 -10.083 1.00 . B X . 101 GGL CD 1 1
7 3693 2 2 1 . CG C 30.699 9.206 -8.956 1.00 . B X . 101 GGL CG 1 1
7 3694 2 2 1 . H H 34.048 12.035 -8.534 1.00 . B X . 101 GGL H 1 1
7 3695 2 2 1 . HA H 33.337 9.859 -8.811 1.00 . B X . 101 GGL HA 1 1
7 3696 2 2 1 . HB2 H 30.733 11.321 -9.313 1.00 . B X . 101 GGL HB2 1 1
7 3697 2 2 1 . HB3 H 31.365 10.844 -7.737 1.00 . B X . 101 GGL HB3 1 1
7 3698 2 2 1 . HG2 H 31.470 8.487 -9.190 1.00 . B X . 101 GGL HG2 1 1
7 3699 2 2 1 . HG3 H 30.211 8.919 -8.035 1.00 . B X . 101 GGL HG3 1 1
7 3700 2 2 1 . N N 33.353 11.897 -9.211 1.00 . B X . 101 GGL N 1 1
7 3701 2 2 1 . O O 32.309 10.990 -11.638 1.00 . B X . 101 GGL O 1 1
7 3702 2 2 1 . OE1 O 29.983 8.891 -11.224 1.00 . B X . 101 GGL OE1 1 1
7 3703 2 2 1 . OXT O 33.009 9.023 -11.111 1.00 . B X . 101 GGL OXT 1 1
7 3704 3 2 1 . C C 32.651 15.977 -12.417 1.00 . C X . 102 GGL C 1 1
7 3705 3 2 1 . CA C 31.749 15.450 -11.305 1.00 . C X . 102 GGL CA 1 1
7 3706 3 2 1 . CB C 32.545 15.379 -9.997 1.00 . C X . 102 GGL CB 1 1
7 3707 3 2 1 . CD C 32.985 12.914 -9.985 1.00 . C X . 102 GGL CD 1 1
7 3708 3 2 1 . CG C 32.263 14.058 -9.279 1.00 . C X . 102 GGL CG 1 1
7 3709 3 2 1 . H H 31.817 13.360 -11.637 1.00 . C X . 102 GGL H 1 1
7 3710 3 2 1 . HA H 30.924 16.134 -11.172 1.00 . C X . 102 GGL HA 1 1
7 3711 3 2 1 . HB2 H 33.600 15.449 -10.216 1.00 . C X . 102 GGL HB2 1 1
7 3712 3 2 1 . HB3 H 32.256 16.202 -9.358 1.00 . C X . 102 GGL HB3 1 1
7 3713 3 2 1 . HG2 H 32.614 14.124 -8.260 1.00 . C X . 102 GGL HG2 1 1
7 3714 3 2 1 . HG3 H 31.199 13.867 -9.278 1.00 . C X . 102 GGL HG3 1 1
7 3715 3 2 1 . N N 31.222 14.136 -11.654 1.00 . C X . 102 GGL N 1 1
7 3716 3 2 1 . O O 32.587 15.438 -13.509 1.00 . C X . 102 GGL O 1 1
7 3717 3 2 1 . OE1 O 33.385 13.047 -11.141 1.00 . C X . 102 GGL OE1 1 1
7 3718 3 2 1 . OXT O 33.354 16.945 -12.175 1.00 . C X . 102 GGL OXT 1 1
7 3719 4 3 1 PLM C1 C 29.969 13.992 -12.074 1.00 . D X . 103 PLM C1 1 1
7 3720 4 3 1 PLM C2 C 29.357 12.604 -11.903 1.00 . D X . 103 PLM C2 1 1
7 3721 4 3 1 PLM C3 C 28.334 12.344 -13.010 1.00 . D X . 103 PLM C3 1 1
7 3722 4 3 1 PLM C4 C 27.744 10.943 -12.842 1.00 . D X . 103 PLM C4 1 1
7 3723 4 3 1 PLM C5 C 28.594 9.934 -13.616 1.00 . D X . 103 PLM C5 1 1
7 3724 4 3 1 PLM C6 C 28.059 8.520 -13.375 1.00 . D X . 103 PLM C6 1 1
7 3725 4 3 1 PLM C7 C 29.114 7.496 -13.793 1.00 . D X . 103 PLM C7 1 1
7 3726 4 3 1 PLM C8 C 28.605 6.084 -13.491 1.00 . D X . 103 PLM C8 1 1
7 3727 4 3 1 PLM C9 C 28.995 5.692 -12.064 1.00 . D X . 103 PLM C9 1 1
7 3728 4 3 1 PLM CA C 30.384 5.046 -12.073 1.00 . D X . 103 PLM CA 1 1
7 3729 4 3 1 PLM CB C 30.923 4.959 -10.641 1.00 . D X . 103 PLM CB 1 1
7 3730 4 3 1 PLM CC C 30.078 3.984 -9.811 1.00 . D X . 103 PLM CC 1 1
7 3731 4 3 1 PLM CD C 29.186 4.772 -8.849 1.00 . D X . 103 PLM CD 1 1
7 3732 4 3 1 PLM CE C 28.256 3.807 -8.111 1.00 . D X . 103 PLM CE 1 1
7 3733 4 3 1 PLM CF C 26.959 3.640 -8.906 1.00 . D X . 103 PLM CF 1 1
7 3734 4 3 1 PLM CG C 26.052 2.635 -8.196 1.00 . D X . 103 PLM CG 1 1
7 3735 4 3 1 PLM H21 H 30.139 11.860 -11.954 1.00 . D X . 103 PLM H21 1 1
7 3736 4 3 1 PLM H22 H 28.869 12.546 -10.942 1.00 . D X . 103 PLM H22 1 1
7 3737 4 3 1 PLM H31 H 27.544 13.078 -12.950 1.00 . D X . 103 PLM H31 1 1
7 3738 4 3 1 PLM H32 H 28.818 12.418 -13.972 1.00 . D X . 103 PLM H32 1 1
7 3739 4 3 1 PLM H41 H 26.733 10.930 -13.224 1.00 . D X . 103 PLM H41 1 1
7 3740 4 3 1 PLM H42 H 27.733 10.679 -11.795 1.00 . D X . 103 PLM H42 1 1
7 3741 4 3 1 PLM H51 H 28.551 10.160 -14.671 1.00 . D X . 103 PLM H51 1 1
7 3742 4 3 1 PLM H52 H 29.619 9.993 -13.278 1.00 . D X . 103 PLM H52 1 1
7 3743 4 3 1 PLM H61 H 27.162 8.372 -13.958 1.00 . D X . 103 PLM H61 1 1
7 3744 4 3 1 PLM H62 H 27.830 8.396 -12.326 1.00 . D X . 103 PLM H62 1 1
7 3745 4 3 1 PLM H71 H 29.308 7.590 -14.851 1.00 . D X . 103 PLM H71 1 1
7 3746 4 3 1 PLM H72 H 30.028 7.676 -13.244 1.00 . D X . 103 PLM H72 1 1
7 3747 4 3 1 PLM H81 H 29.045 5.387 -14.190 1.00 . D X . 103 PLM H81 1 1
7 3748 4 3 1 PLM H82 H 27.531 6.062 -13.590 1.00 . D X . 103 PLM H82 1 1
7 3749 4 3 1 PLM H91 H 29.013 6.574 -11.440 1.00 . D X . 103 PLM H91 1 1
7 3750 4 3 1 PLM H92 H 28.273 4.989 -11.676 1.00 . D X . 103 PLM H92 1 1
7 3751 4 3 1 PLM HA1 H 30.319 4.055 -12.499 1.00 . D X . 103 PLM HA1 1 1
7 3752 4 3 1 PLM HA2 H 31.052 5.647 -12.671 1.00 . D X . 103 PLM HA2 1 1
7 3753 4 3 1 PLM HB1 H 30.890 5.938 -10.186 1.00 . D X . 103 PLM HB1 1 1
7 3754 4 3 1 PLM HB2 H 31.946 4.613 -10.665 1.00 . D X . 103 PLM HB2 1 1
7 3755 4 3 1 PLM HC1 H 29.462 3.386 -10.464 1.00 . D X . 103 PLM HC1 1 1
7 3756 4 3 1 PLM HC2 H 30.731 3.337 -9.244 1.00 . D X . 103 PLM HC2 1 1
7 3757 4 3 1 PLM HD1 H 29.804 5.296 -8.134 1.00 . D X . 103 PLM HD1 1 1
7 3758 4 3 1 PLM HD2 H 28.597 5.485 -9.406 1.00 . D X . 103 PLM HD2 1 1
7 3759 4 3 1 PLM HE1 H 28.028 4.204 -7.132 1.00 . D X . 103 PLM HE1 1 1
7 3760 4 3 1 PLM HE2 H 28.740 2.848 -8.007 1.00 . D X . 103 PLM HE2 1 1
7 3761 4 3 1 PLM HF1 H 26.456 4.593 -8.976 1.00 . D X . 103 PLM HF1 1 1
7 3762 4 3 1 PLM HF2 H 27.189 3.281 -9.898 1.00 . D X . 103 PLM HF2 1 1
7 3763 4 3 1 PLM HG1 H 26.622 1.754 -7.938 1.00 . D X . 103 PLM HG1 1 1
7 3764 4 3 1 PLM HG2 H 25.654 3.081 -7.296 1.00 . D X . 103 PLM HG2 1 1
7 3765 4 3 1 PLM HG3 H 25.238 2.357 -8.851 1.00 . D X . 103 PLM HG3 1 1
7 3766 4 3 1 PLM O2 O 29.319 14.909 -12.578 1.00 . D X . 103 PLM O2 1 1
8 3767 1 1 1 HIS C C 41.106 13.887 -15.523 1.00 . A X . 1 HIS C 1 1
8 3768 1 1 1 HIS CA C 41.118 14.935 -16.629 1.00 . A X . 1 HIS CA 1 1
8 3769 1 1 1 HIS CB C 41.004 16.335 -16.024 1.00 . A X . 1 HIS CB 1 1
8 3770 1 1 1 HIS CD2 C 42.155 18.191 -17.488 1.00 . A X . 1 HIS CD2 1 1
8 3771 1 1 1 HIS CE1 C 40.504 18.602 -18.828 1.00 . A X . 1 HIS CE1 1 1
8 3772 1 1 1 HIS CG C 41.123 17.364 -17.113 1.00 . A X . 1 HIS CG 1 1
8 3773 1 1 1 HIS H1 H 39.291 15.483 -17.464 1.00 . A X . 1 HIS H1 1 1
8 3774 1 1 1 HIS H2 H 39.500 13.805 -17.293 1.00 . A X . 1 HIS H2 1 1
8 3775 1 1 1 HIS H3 H 40.312 14.643 -18.528 1.00 . A X . 1 HIS H3 1 1
8 3776 1 1 1 HIS HA H 42.042 14.859 -17.186 1.00 . A X . 1 HIS HA 1 1
8 3777 1 1 1 HIS HB2 H 40.045 16.438 -15.533 1.00 . A X . 1 HIS HB2 1 1
8 3778 1 1 1 HIS HB3 H 41.797 16.481 -15.303 1.00 . A X . 1 HIS HB3 1 1
8 3779 1 1 1 HIS HD2 H 43.124 18.228 -17.012 1.00 . A X . 1 HIS HD2 1 1
8 3780 1 1 1 HIS HE1 H 39.901 19.019 -19.621 1.00 . A X . 1 HIS HE1 1 1
8 3781 1 1 1 HIS HE2 H 42.292 19.645 -19.043 1.00 . A X . 1 HIS HE2 1 1
8 3782 1 1 1 HIS N N 39.969 14.698 -17.548 1.00 . A X . 1 HIS N 1 1
8 3783 1 1 1 HIS ND1 N 40.081 17.644 -17.983 1.00 . A X . 1 HIS ND1 1 1
8 3784 1 1 1 HIS NE2 N 41.761 18.970 -18.571 1.00 . A X . 1 HIS NE2 1 1
8 3785 1 1 1 HIS O O 41.841 12.899 -15.581 1.00 . A X . 1 HIS O 1 1
8 3786 1 1 2 ABA C C 41.453 13.188 -12.580 1.00 . A X . 2 AIB C 1 1
8 3787 1 1 2 ABA CA C 40.167 13.173 -13.400 1.00 . A X . 2 AIB CA 1 1
8 3788 1 1 2 ABA H H 39.705 14.908 -14.524 1.00 . A X . 2 AIB H 1 1
8 3789 1 1 2 ABA N N 40.267 14.105 -14.516 1.00 . A X . 2 AIB N 1 1
8 3790 1 1 2 ABA O O 42.083 14.234 -12.426 1.00 . A X . 2 AIB O 1 1
8 3791 1 1 3 GLN C C 43.311 13.141 -10.439 1.00 . A X . 3 GLN C 1 1
8 3792 1 1 3 GLN CA C 43.043 11.879 -11.254 1.00 . A X . 3 GLN CA 1 1
8 3793 1 1 3 GLN CB C 44.249 11.575 -12.150 1.00 . A X . 3 GLN CB 1 1
8 3794 1 1 3 GLN CD C 45.702 12.484 -13.970 1.00 . A X . 3 GLN CD 1 1
8 3795 1 1 3 GLN CG C 44.370 12.638 -13.245 1.00 . A X . 3 GLN CG 1 1
8 3796 1 1 3 GLN H H 41.278 11.224 -12.230 1.00 . A X . 3 GLN H 1 1
8 3797 1 1 3 GLN HA H 42.908 11.052 -10.572 1.00 . A X . 3 GLN HA 1 1
8 3798 1 1 3 GLN HB2 H 45.147 11.572 -11.552 1.00 . A X . 3 GLN HB2 1 1
8 3799 1 1 3 GLN HB3 H 44.119 10.605 -12.608 1.00 . A X . 3 GLN HB3 1 1
8 3800 1 1 3 GLN HE21 H 44.912 11.552 -15.534 1.00 . A X . 3 GLN HE21 1 1
8 3801 1 1 3 GLN HE22 H 46.590 11.792 -15.606 1.00 . A X . 3 GLN HE22 1 1
8 3802 1 1 3 GLN HG2 H 43.561 12.519 -13.954 1.00 . A X . 3 GLN HG2 1 1
8 3803 1 1 3 GLN HG3 H 44.318 13.622 -12.799 1.00 . A X . 3 GLN HG3 1 1
8 3804 1 1 3 GLN N N 41.830 12.017 -12.064 1.00 . A X . 3 GLN N 1 1
8 3805 1 1 3 GLN NE2 N 45.738 11.894 -15.134 1.00 . A X . 3 GLN NE2 1 1
8 3806 1 1 3 GLN O O 44.421 13.674 -10.446 1.00 . A X . 3 GLN O 1 1
8 3807 1 1 3 GLN OE1 O 46.738 12.912 -13.463 1.00 . A X . 3 GLN OE1 1 1
8 3808 1 1 4 GLY C C 41.042 15.399 -8.614 1.00 . A X . 4 GLY C 1 1
8 3809 1 1 4 GLY CA C 42.414 14.812 -8.922 1.00 . A X . 4 GLY CA 1 1
8 3810 1 1 4 GLY H H 41.425 13.144 -9.774 1.00 . A X . 4 GLY H 1 1
8 3811 1 1 4 GLY HA2 H 42.911 14.560 -7.996 1.00 . A X . 4 GLY HA2 1 1
8 3812 1 1 4 GLY HA3 H 42.999 15.546 -9.454 1.00 . A X . 4 GLY HA3 1 1
8 3813 1 1 4 GLY N N 42.285 13.611 -9.739 1.00 . A X . 4 GLY N 1 1
8 3814 1 1 4 GLY O O 40.898 16.245 -7.731 1.00 . A X . 4 GLY O 1 1
8 3815 1 1 5 THR C C 37.694 14.244 -9.167 1.00 . A X . 5 THR C 1 1
8 3816 1 1 5 THR CA C 38.672 15.414 -9.154 1.00 . A X . 5 THR CA 1 1
8 3817 1 1 5 THR CB C 38.299 16.407 -10.258 1.00 . A X . 5 THR CB 1 1
8 3818 1 1 5 THR CG2 C 39.553 16.795 -11.044 1.00 . A X . 5 THR CG2 1 1
8 3819 1 1 5 THR H H 40.214 14.261 -10.035 1.00 . A X . 5 THR H 1 1
8 3820 1 1 5 THR HA H 38.608 15.914 -8.200 1.00 . A X . 5 THR HA 1 1
8 3821 1 1 5 THR HB H 37.868 17.293 -9.817 1.00 . A X . 5 THR HB 1 1
8 3822 1 1 5 THR HG1 H 36.552 16.330 -11.108 1.00 . A X . 5 THR HG1 1 1
8 3823 1 1 5 THR HG21 H 39.948 15.924 -11.546 1.00 . A X . 5 THR HG21 1 1
8 3824 1 1 5 THR HG22 H 40.296 17.189 -10.366 1.00 . A X . 5 THR HG22 1 1
8 3825 1 1 5 THR HG23 H 39.299 17.548 -11.776 1.00 . A X . 5 THR HG23 1 1
8 3826 1 1 5 THR N N 40.036 14.938 -9.349 1.00 . A X . 5 THR N 1 1
8 3827 1 1 5 THR O O 36.491 14.424 -8.981 1.00 . A X . 5 THR O 1 1
8 3828 1 1 5 THR OG1 O 37.356 15.806 -11.134 1.00 . A X . 5 THR OG1 1 1
8 3829 1 1 6 PHE C C 37.364 11.174 -8.058 1.00 . A X . 6 PHE C 1 1
8 3830 1 1 6 PHE CA C 37.392 11.848 -9.426 1.00 . A X . 6 PHE CA 1 1
8 3831 1 1 6 PHE CB C 37.934 10.870 -10.471 1.00 . A X . 6 PHE CB 1 1
8 3832 1 1 6 PHE CD1 C 39.474 9.344 -9.185 1.00 . A X . 6 PHE CD1 1 1
8 3833 1 1 6 PHE CD2 C 37.286 8.520 -9.829 1.00 . A X . 6 PHE CD2 1 1
8 3834 1 1 6 PHE CE1 C 39.757 8.115 -8.576 1.00 . A X . 6 PHE CE1 1 1
8 3835 1 1 6 PHE CE2 C 37.570 7.291 -9.222 1.00 . A X . 6 PHE CE2 1 1
8 3836 1 1 6 PHE CG C 38.238 9.546 -9.813 1.00 . A X . 6 PHE CG 1 1
8 3837 1 1 6 PHE CZ C 38.805 7.089 -8.594 1.00 . A X . 6 PHE CZ 1 1
8 3838 1 1 6 PHE H H 39.190 12.965 -9.532 1.00 . A X . 6 PHE H 1 1
8 3839 1 1 6 PHE HA H 36.386 12.128 -9.700 1.00 . A X . 6 PHE HA 1 1
8 3840 1 1 6 PHE HB2 H 37.194 10.725 -11.245 1.00 . A X . 6 PHE HB2 1 1
8 3841 1 1 6 PHE HB3 H 38.837 11.270 -10.904 1.00 . A X . 6 PHE HB3 1 1
8 3842 1 1 6 PHE HD1 H 40.209 10.136 -9.171 1.00 . A X . 6 PHE HD1 1 1
8 3843 1 1 6 PHE HD2 H 36.334 8.675 -10.314 1.00 . A X . 6 PHE HD2 1 1
8 3844 1 1 6 PHE HE1 H 40.710 7.959 -8.091 1.00 . A X . 6 PHE HE1 1 1
8 3845 1 1 6 PHE HE2 H 36.836 6.499 -9.235 1.00 . A X . 6 PHE HE2 1 1
8 3846 1 1 6 PHE HZ H 39.023 6.141 -8.125 1.00 . A X . 6 PHE HZ 1 1
8 3847 1 1 6 PHE N N 38.223 13.045 -9.389 1.00 . A X . 6 PHE N 1 1
8 3848 1 1 6 PHE O O 36.630 10.207 -7.846 1.00 . A X . 6 PHE O 1 1
8 3849 1 1 7 THR C C 37.276 11.873 -4.855 1.00 . A X . 7 THR C 1 1
8 3850 1 1 7 THR CA C 38.228 11.131 -5.788 1.00 . A X . 7 THR CA 1 1
8 3851 1 1 7 THR CB C 39.656 11.225 -5.246 1.00 . A X . 7 THR CB 1 1
8 3852 1 1 7 THR CG2 C 40.645 10.792 -6.330 1.00 . A X . 7 THR CG2 1 1
8 3853 1 1 7 THR H H 38.730 12.461 -7.360 1.00 . A X . 7 THR H 1 1
8 3854 1 1 7 THR HA H 37.939 10.090 -5.829 1.00 . A X . 7 THR HA 1 1
8 3855 1 1 7 THR HB H 39.760 10.575 -4.390 1.00 . A X . 7 THR HB 1 1
8 3856 1 1 7 THR HG1 H 40.772 12.817 -5.241 1.00 . A X . 7 THR HG1 1 1
8 3857 1 1 7 THR HG21 H 40.405 9.792 -6.658 1.00 . A X . 7 THR HG21 1 1
8 3858 1 1 7 THR HG22 H 41.648 10.809 -5.929 1.00 . A X . 7 THR HG22 1 1
8 3859 1 1 7 THR HG23 H 40.581 11.471 -7.168 1.00 . A X . 7 THR HG23 1 1
8 3860 1 1 7 THR N N 38.167 11.690 -7.133 1.00 . A X . 7 THR N 1 1
8 3861 1 1 7 THR O O 36.280 11.313 -4.395 1.00 . A X . 7 THR O 1 1
8 3862 1 1 7 THR OG1 O 39.928 12.565 -4.862 1.00 . A X . 7 THR OG1 1 1
8 3863 1 1 8 SER C C 35.367 14.135 -4.305 1.00 . A X . 8 SER C 1 1
8 3864 1 1 8 SER CA C 36.753 13.943 -3.700 1.00 . A X . 8 SER CA 1 1
8 3865 1 1 8 SER CB C 37.404 15.307 -3.468 1.00 . A X . 8 SER CB 1 1
8 3866 1 1 8 SER H H 38.394 13.529 -4.975 1.00 . A X . 8 SER H 1 1
8 3867 1 1 8 SER HA H 36.654 13.439 -2.749 1.00 . A X . 8 SER HA 1 1
8 3868 1 1 8 SER HB2 H 38.397 15.172 -3.071 1.00 . A X . 8 SER HB2 1 1
8 3869 1 1 8 SER HB3 H 37.465 15.839 -4.409 1.00 . A X . 8 SER HB3 1 1
8 3870 1 1 8 SER HG H 35.698 15.877 -2.726 1.00 . A X . 8 SER HG 1 1
8 3871 1 1 8 SER N N 37.589 13.134 -4.580 1.00 . A X . 8 SER N 1 1
8 3872 1 1 8 SER O O 35.024 15.225 -4.764 1.00 . A X . 8 SER O 1 1
8 3873 1 1 8 SER OG O 36.625 16.048 -2.540 1.00 . A X . 8 SER OG 1 1
8 3874 1 1 9 ASP C C 32.668 11.726 -5.060 1.00 . A X . 9 ASP C 1 1
8 3875 1 1 9 ASP CA C 33.225 13.131 -4.853 1.00 . A X . 9 ASP CA 1 1
8 3876 1 1 9 ASP CB C 33.241 13.877 -6.189 1.00 . A X . 9 ASP CB 1 1
8 3877 1 1 9 ASP CG C 32.181 13.301 -7.122 1.00 . A X . 9 ASP CG 1 1
8 3878 1 1 9 ASP H H 34.900 12.227 -3.922 1.00 . A X . 9 ASP H 1 1
8 3879 1 1 9 ASP HA H 32.588 13.664 -4.165 1.00 . A X . 9 ASP HA 1 1
8 3880 1 1 9 ASP HB2 H 33.036 14.925 -6.017 1.00 . A X . 9 ASP HB2 1 1
8 3881 1 1 9 ASP HB3 H 34.215 13.771 -6.647 1.00 . A X . 9 ASP HB3 1 1
8 3882 1 1 9 ASP N N 34.574 13.069 -4.302 1.00 . A X . 9 ASP N 1 1
8 3883 1 1 9 ASP O O 31.473 11.551 -5.298 1.00 . A X . 9 ASP O 1 1
8 3884 1 1 9 ASP OD1 O 32.405 12.223 -7.648 1.00 . A X . 9 ASP OD1 1 1
8 3885 1 1 9 ASP OD2 O 31.160 13.945 -7.294 1.00 . A X . 9 ASP OD2 1 1
8 3886 1 1 10 TYR C C 32.740 8.720 -3.808 1.00 . A X . 10 TYR C 1 1
8 3887 1 1 10 TYR CA C 33.125 9.343 -5.148 1.00 . A X . 10 TYR CA 1 1
8 3888 1 1 10 TYR CB C 34.265 8.536 -5.781 1.00 . A X . 10 TYR CB 1 1
8 3889 1 1 10 TYR CD1 C 32.559 6.852 -6.565 1.00 . A X . 10 TYR CD1 1 1
8 3890 1 1 10 TYR CD2 C 34.347 7.486 -8.072 1.00 . A X . 10 TYR CD2 1 1
8 3891 1 1 10 TYR CE1 C 32.043 5.985 -7.538 1.00 . A X . 10 TYR CE1 1 1
8 3892 1 1 10 TYR CE2 C 33.833 6.619 -9.045 1.00 . A X . 10 TYR CE2 1 1
8 3893 1 1 10 TYR CG C 33.711 7.602 -6.832 1.00 . A X . 10 TYR CG 1 1
8 3894 1 1 10 TYR CZ C 32.682 5.869 -8.778 1.00 . A X . 10 TYR CZ 1 1
8 3895 1 1 10 TYR H H 34.482 10.929 -4.777 1.00 . A X . 10 TYR H 1 1
8 3896 1 1 10 TYR HA H 32.271 9.318 -5.806 1.00 . A X . 10 TYR HA 1 1
8 3897 1 1 10 TYR HB2 H 34.973 9.212 -6.238 1.00 . A X . 10 TYR HB2 1 1
8 3898 1 1 10 TYR HB3 H 34.763 7.959 -5.015 1.00 . A X . 10 TYR HB3 1 1
8 3899 1 1 10 TYR HD1 H 32.070 6.942 -5.609 1.00 . A X . 10 TYR HD1 1 1
8 3900 1 1 10 TYR HD2 H 35.236 8.064 -8.278 1.00 . A X . 10 TYR HD2 1 1
8 3901 1 1 10 TYR HE1 H 31.152 5.408 -7.331 1.00 . A X . 10 TYR HE1 1 1
8 3902 1 1 10 TYR HE2 H 34.327 6.530 -10.002 1.00 . A X . 10 TYR HE2 1 1
8 3903 1 1 10 TYR HH H 31.668 4.335 -9.288 1.00 . A X . 10 TYR HH 1 1
8 3904 1 1 10 TYR N N 33.541 10.729 -4.969 1.00 . A X . 10 TYR N 1 1
8 3905 1 1 10 TYR O O 31.644 8.181 -3.655 1.00 . A X . 10 TYR O 1 1
8 3906 1 1 10 TYR OH O 32.178 5.014 -9.736 1.00 . A X . 10 TYR OH 1 1
8 3907 1 1 11 SER C C 32.052 8.702 -0.972 1.00 . A X . 11 SER C 1 1
8 3908 1 1 11 SER CA C 33.401 8.238 -1.518 1.00 . A X . 11 SER CA 1 1
8 3909 1 1 11 SER CB C 34.512 8.660 -0.557 1.00 . A X . 11 SER CB 1 1
8 3910 1 1 11 SER H H 34.506 9.241 -3.023 1.00 . A X . 11 SER H 1 1
8 3911 1 1 11 SER HA H 33.395 7.161 -1.590 1.00 . A X . 11 SER HA 1 1
8 3912 1 1 11 SER HB2 H 34.412 8.122 0.370 1.00 . A X . 11 SER HB2 1 1
8 3913 1 1 11 SER HB3 H 35.473 8.435 -1.000 1.00 . A X . 11 SER HB3 1 1
8 3914 1 1 11 SER HG H 34.067 10.476 -1.095 1.00 . A X . 11 SER HG 1 1
8 3915 1 1 11 SER N N 33.649 8.799 -2.842 1.00 . A X . 11 SER N 1 1
8 3916 1 1 11 SER O O 31.580 8.196 0.047 1.00 . A X . 11 SER O 1 1
8 3917 1 1 11 SER OG O 34.407 10.054 -0.302 1.00 . A X . 11 SER OG 1 1
8 3918 1 1 12 LYS C C 29.196 10.314 -2.407 1.00 . A X . 12 LYS C 1 1
8 3919 1 1 12 LYS CA C 30.145 10.190 -1.223 1.00 . A X . 12 LYS CA 1 1
8 3920 1 1 12 LYS CB C 30.329 11.561 -0.567 1.00 . A X . 12 LYS CB 1 1
8 3921 1 1 12 LYS CD C 29.079 13.035 1.015 1.00 . A X . 12 LYS CD 1 1
8 3922 1 1 12 LYS CE C 30.114 14.132 0.765 1.00 . A X . 12 LYS CE 1 1
8 3923 1 1 12 LYS CG C 28.958 12.151 -0.227 1.00 . A X . 12 LYS CG 1 1
8 3924 1 1 12 LYS H H 31.863 10.034 -2.457 1.00 . A X . 12 LYS H 1 1
8 3925 1 1 12 LYS HA H 29.713 9.514 -0.498 1.00 . A X . 12 LYS HA 1 1
8 3926 1 1 12 LYS HB2 H 30.909 11.451 0.337 1.00 . A X . 12 LYS HB2 1 1
8 3927 1 1 12 LYS HB3 H 30.843 12.221 -1.249 1.00 . A X . 12 LYS HB3 1 1
8 3928 1 1 12 LYS HD2 H 28.119 13.487 1.230 1.00 . A X . 12 LYS HD2 1 1
8 3929 1 1 12 LYS HD3 H 29.388 12.435 1.857 1.00 . A X . 12 LYS HD3 1 1
8 3930 1 1 12 LYS HE2 H 31.068 13.827 1.174 1.00 . A X . 12 LYS HE2 1 1
8 3931 1 1 12 LYS HE3 H 30.214 14.297 -0.297 1.00 . A X . 12 LYS HE3 1 1
8 3932 1 1 12 LYS HG2 H 28.606 12.743 -1.059 1.00 . A X . 12 LYS HG2 1 1
8 3933 1 1 12 LYS HG3 H 28.260 11.352 -0.032 1.00 . A X . 12 LYS HG3 1 1
8 3934 1 1 12 LYS HZ1 H 28.668 15.559 1.220 1.00 . A X . 12 LYS HZ1 1 1
8 3935 1 1 12 LYS HZ2 H 30.238 16.189 1.065 1.00 . A X . 12 LYS HZ2 1 1
8 3936 1 1 12 LYS HZ3 H 29.805 15.312 2.454 1.00 . A X . 12 LYS HZ3 1 1
8 3937 1 1 12 LYS N N 31.439 9.667 -1.653 1.00 . A X . 12 LYS N 1 1
8 3938 1 1 12 LYS NZ N 29.674 15.393 1.426 1.00 . A X . 12 LYS NZ 1 1
8 3939 1 1 12 LYS O O 29.051 11.387 -2.992 1.00 . A X . 12 LYS O 1 1
8 3940 1 1 13 LYS C C 26.880 7.857 -3.920 1.00 . A X . 13 LYS C 1 1
8 3941 1 1 13 LYS CA C 27.608 9.196 -3.866 1.00 . A X . 13 LYS CA 1 1
8 3942 1 1 13 LYS CB C 28.358 9.427 -5.183 1.00 . A X . 13 LYS CB 1 1
8 3943 1 1 13 LYS CD C 27.311 8.468 -7.246 1.00 . A X . 13 LYS CD 1 1
8 3944 1 1 13 LYS CE C 28.628 8.333 -8.014 1.00 . A X . 13 LYS CE 1 1
8 3945 1 1 13 LYS CG C 27.370 9.691 -6.330 1.00 . A X . 13 LYS CG 1 1
8 3946 1 1 13 LYS H H 28.702 8.382 -2.246 1.00 . A X . 13 LYS H 1 1
8 3947 1 1 13 LYS HA H 26.888 9.986 -3.721 1.00 . A X . 13 LYS HA 1 1
8 3948 1 1 13 LYS HB2 H 29.015 10.277 -5.075 1.00 . A X . 13 LYS HB2 1 1
8 3949 1 1 13 LYS HB3 H 28.942 8.550 -5.412 1.00 . A X . 13 LYS HB3 1 1
8 3950 1 1 13 LYS HD2 H 27.148 7.581 -6.652 1.00 . A X . 13 LYS HD2 1 1
8 3951 1 1 13 LYS HD3 H 26.498 8.584 -7.949 1.00 . A X . 13 LYS HD3 1 1
8 3952 1 1 13 LYS HE2 H 29.342 9.047 -7.633 1.00 . A X . 13 LYS HE2 1 1
8 3953 1 1 13 LYS HE3 H 29.013 7.335 -7.877 1.00 . A X . 13 LYS HE3 1 1
8 3954 1 1 13 LYS HG2 H 26.385 9.886 -5.933 1.00 . A X . 13 LYS HG2 1 1
8 3955 1 1 13 LYS HG3 H 27.701 10.546 -6.900 1.00 . A X . 13 LYS HG3 1 1
8 3956 1 1 13 LYS HZ1 H 28.512 9.497 -9.780 1.00 . A X . 13 LYS HZ1 1 1
8 3957 1 1 13 LYS N N 28.548 9.207 -2.752 1.00 . A X . 13 LYS N 1 1
8 3958 1 1 13 LYS NZ N 28.415 8.586 -9.434 1.00 . A X . 13 LYS NZ 1 1
8 3959 1 1 13 LYS O O 25.661 7.807 -4.084 1.00 . A X . 13 LYS O 1 1
8 3960 1 1 14 LEU C C 25.891 5.378 -2.815 1.00 . A X . 14 LEU C 1 1
8 3961 1 1 14 LEU CA C 27.052 5.441 -3.794 1.00 . A X . 14 LEU CA 1 1
8 3962 1 1 14 LEU CB C 28.084 4.376 -3.407 1.00 . A X . 14 LEU CB 1 1
8 3963 1 1 14 LEU CD1 C 30.489 3.903 -2.952 1.00 . A X . 14 LEU CD1 1 1
8 3964 1 1 14 LEU CD2 C 29.856 5.526 -4.734 1.00 . A X . 14 LEU CD2 1 1
8 3965 1 1 14 LEU CG C 29.486 4.984 -3.354 1.00 . A X . 14 LEU CG 1 1
8 3966 1 1 14 LEU H H 28.601 6.877 -3.636 1.00 . A X . 14 LEU H 1 1
8 3967 1 1 14 LEU HA H 26.692 5.233 -4.791 1.00 . A X . 14 LEU HA 1 1
8 3968 1 1 14 LEU HB2 H 27.833 3.974 -2.435 1.00 . A X . 14 LEU HB2 1 1
8 3969 1 1 14 LEU HB3 H 28.067 3.583 -4.139 1.00 . A X . 14 LEU HB3 1 1
8 3970 1 1 14 LEU HD11 H 29.983 2.951 -2.885 1.00 . A X . 14 LEU HD11 1 1
8 3971 1 1 14 LEU HD12 H 30.920 4.149 -1.994 1.00 . A X . 14 LEU HD12 1 1
8 3972 1 1 14 LEU HD13 H 31.271 3.842 -3.694 1.00 . A X . 14 LEU HD13 1 1
8 3973 1 1 14 LEU HD21 H 30.777 5.069 -5.061 1.00 . A X . 14 LEU HD21 1 1
8 3974 1 1 14 LEU HD22 H 29.985 6.595 -4.680 1.00 . A X . 14 LEU HD22 1 1
8 3975 1 1 14 LEU HD23 H 29.070 5.293 -5.438 1.00 . A X . 14 LEU HD23 1 1
8 3976 1 1 14 LEU HG H 29.511 5.782 -2.627 1.00 . A X . 14 LEU HG 1 1
8 3977 1 1 14 LEU N N 27.639 6.774 -3.771 1.00 . A X . 14 LEU N 1 1
8 3978 1 1 14 LEU O O 24.947 4.610 -2.994 1.00 . A X . 14 LEU O 1 1
8 3979 1 1 15 ASP C C 23.711 6.990 -1.294 1.00 . A X . 15 ASP C 1 1
8 3980 1 1 15 ASP CA C 24.934 6.250 -0.760 1.00 . A X . 15 ASP CA 1 1
8 3981 1 1 15 ASP CB C 25.468 6.956 0.486 1.00 . A X . 15 ASP CB 1 1
8 3982 1 1 15 ASP CG C 24.434 6.892 1.606 1.00 . A X . 15 ASP CG 1 1
8 3983 1 1 15 ASP H H 26.753 6.790 -1.693 1.00 . A X . 15 ASP H 1 1
8 3984 1 1 15 ASP HA H 24.650 5.242 -0.498 1.00 . A X . 15 ASP HA 1 1
8 3985 1 1 15 ASP HB2 H 26.379 6.467 0.807 1.00 . A X . 15 ASP HB2 1 1
8 3986 1 1 15 ASP HB3 H 25.678 7.991 0.251 1.00 . A X . 15 ASP HB3 1 1
8 3987 1 1 15 ASP N N 25.975 6.202 -1.776 1.00 . A X . 15 ASP N 1 1
8 3988 1 1 15 ASP O O 22.895 7.500 -0.527 1.00 . A X . 15 ASP O 1 1
8 3989 1 1 15 ASP OD1 O 24.036 5.794 1.955 1.00 . A X . 15 ASP OD1 1 1
8 3990 1 1 15 ASP OD2 O 24.058 7.942 2.098 1.00 . A X . 15 ASP OD2 1 1
8 3991 1 1 16 ABA C C 22.333 7.108 -4.686 1.00 . A X . 16 AIB C 1 1
8 3992 1 1 16 ABA CA C 22.491 7.698 -3.291 1.00 . A X . 16 AIB CA 1 1
8 3993 1 1 16 ABA H H 24.291 6.604 -3.165 1.00 . A X . 16 AIB H 1 1
8 3994 1 1 16 ABA N N 23.602 7.034 -2.619 1.00 . A X . 16 AIB N 1 1
8 3995 1 1 16 ABA O O 21.433 7.479 -5.441 1.00 . A X . 16 AIB O 1 1
8 3996 1 1 17 ARG C C 23.240 3.995 -6.089 1.00 . A X . 17 ARG C 1 1
8 3997 1 1 17 ARG CA C 23.198 5.503 -6.301 1.00 . A X . 17 ARG CA 1 1
8 3998 1 1 17 ARG CB C 24.401 5.936 -7.132 1.00 . A X . 17 ARG CB 1 1
8 3999 1 1 17 ARG CD C 23.151 7.937 -7.971 1.00 . A X . 17 ARG CD 1 1
8 4000 1 1 17 ARG CG C 23.923 6.681 -8.382 1.00 . A X . 17 ARG CG 1 1
8 4001 1 1 17 ARG CZ C 21.211 7.636 -9.401 1.00 . A X . 17 ARG CZ 1 1
8 4002 1 1 17 ARG H H 23.905 5.922 -4.354 1.00 . A X . 17 ARG H 1 1
8 4003 1 1 17 ARG HA H 22.289 5.762 -6.823 1.00 . A X . 17 ARG HA 1 1
8 4004 1 1 17 ARG HB2 H 25.029 6.586 -6.540 1.00 . A X . 17 ARG HB2 1 1
8 4005 1 1 17 ARG HB3 H 24.964 5.062 -7.427 1.00 . A X . 17 ARG HB3 1 1
8 4006 1 1 17 ARG HD2 H 23.334 8.146 -6.929 1.00 . A X . 17 ARG HD2 1 1
8 4007 1 1 17 ARG HD3 H 23.489 8.773 -8.567 1.00 . A X . 17 ARG HD3 1 1
8 4008 1 1 17 ARG HE H 21.125 7.687 -7.402 1.00 . A X . 17 ARG HE 1 1
8 4009 1 1 17 ARG HG2 H 24.778 6.962 -8.981 1.00 . A X . 17 ARG HG2 1 1
8 4010 1 1 17 ARG HG3 H 23.275 6.036 -8.959 1.00 . A X . 17 ARG HG3 1 1
8 4011 1 1 17 ARG HH11 H 22.977 7.837 -10.320 1.00 . A X . 17 ARG HH11 1 1
8 4012 1 1 17 ARG HH12 H 21.611 7.627 -11.363 1.00 . A X . 17 ARG HH12 1 1
8 4013 1 1 17 ARG HH21 H 19.327 7.410 -8.761 1.00 . A X . 17 ARG HH21 1 1
8 4014 1 1 17 ARG HH22 H 19.543 7.384 -10.480 1.00 . A X . 17 ARG HH22 1 1
8 4015 1 1 17 ARG N N 23.221 6.173 -5.008 1.00 . A X . 17 ARG N 1 1
8 4016 1 1 17 ARG NE N 21.721 7.742 -8.178 1.00 . A X . 17 ARG NE 1 1
8 4017 1 1 17 ARG NH1 N 21.994 7.705 -10.442 1.00 . A X . 17 ARG NH1 1 1
8 4018 1 1 17 ARG NH2 N 19.927 7.463 -9.560 1.00 . A X . 17 ARG NH2 1 1
8 4019 1 1 17 ARG O O 22.927 3.218 -6.988 1.00 . A X . 17 ARG O 1 1
8 4020 1 1 18 ARG C C 22.737 1.976 -3.347 1.00 . A X . 18 ARG C 1 1
8 4021 1 1 18 ARG CA C 23.677 2.196 -4.513 1.00 . A X . 18 ARG CA 1 1
8 4022 1 1 18 ARG CB C 25.103 1.817 -4.110 1.00 . A X . 18 ARG CB 1 1
8 4023 1 1 18 ARG CD C 26.792 -0.022 -4.088 1.00 . A X . 18 ARG CD 1 1
8 4024 1 1 18 ARG CG C 25.394 0.386 -4.556 1.00 . A X . 18 ARG CG 1 1
8 4025 1 1 18 ARG CZ C 26.442 -1.136 -1.958 1.00 . A X . 18 ARG CZ 1 1
8 4026 1 1 18 ARG H H 23.827 4.278 -4.193 1.00 . A X . 18 ARG H 1 1
8 4027 1 1 18 ARG HA H 23.363 1.590 -5.349 1.00 . A X . 18 ARG HA 1 1
8 4028 1 1 18 ARG HB2 H 25.802 2.494 -4.584 1.00 . A X . 18 ARG HB2 1 1
8 4029 1 1 18 ARG HB3 H 25.203 1.886 -3.035 1.00 . A X . 18 ARG HB3 1 1
8 4030 1 1 18 ARG HD2 H 27.412 -0.227 -4.948 1.00 . A X . 18 ARG HD2 1 1
8 4031 1 1 18 ARG HD3 H 27.227 0.786 -3.518 1.00 . A X . 18 ARG HD3 1 1
8 4032 1 1 18 ARG HE H 26.871 -2.097 -3.661 1.00 . A X . 18 ARG HE 1 1
8 4033 1 1 18 ARG HG2 H 24.660 -0.281 -4.128 1.00 . A X . 18 ARG HG2 1 1
8 4034 1 1 18 ARG HG3 H 25.346 0.329 -5.633 1.00 . A X . 18 ARG HG3 1 1
8 4035 1 1 18 ARG HH11 H 26.276 0.860 -1.963 1.00 . A X . 18 ARG HH11 1 1
8 4036 1 1 18 ARG HH12 H 26.026 0.090 -0.432 1.00 . A X . 18 ARG HH12 1 1
8 4037 1 1 18 ARG HH21 H 26.547 -3.112 -1.656 1.00 . A X . 18 ARG HH21 1 1
8 4038 1 1 18 ARG HH22 H 26.179 -2.158 -0.257 1.00 . A X . 18 ARG HH22 1 1
8 4039 1 1 18 ARG N N 23.612 3.602 -4.874 1.00 . A X . 18 ARG N 1 1
8 4040 1 1 18 ARG NE N 26.716 -1.217 -3.255 1.00 . A X . 18 ARG NE 1 1
8 4041 1 1 18 ARG NH1 N 26.232 0.028 -1.408 1.00 . A X . 18 ARG NH1 1 1
8 4042 1 1 18 ARG NH2 N 26.386 -2.220 -1.233 1.00 . A X . 18 ARG NH2 1 1
8 4043 1 1 18 ARG O O 22.649 0.889 -2.779 1.00 . A X . 18 ARG O 1 1
8 4044 1 1 19 ALA C C 19.708 3.382 -2.403 1.00 . A X . 19 ALA C 1 1
8 4045 1 1 19 ALA CA C 21.106 3.044 -1.903 1.00 . A X . 19 ALA CA 1 1
8 4046 1 1 19 ALA CB C 21.552 4.065 -0.867 1.00 . A X . 19 ALA CB 1 1
8 4047 1 1 19 ALA H H 22.182 3.884 -3.503 1.00 . A X . 19 ALA H 1 1
8 4048 1 1 19 ALA HA H 21.095 2.069 -1.451 1.00 . A X . 19 ALA HA 1 1
8 4049 1 1 19 ALA HB1 H 22.373 4.644 -1.275 1.00 . A X . 19 ALA HB1 1 1
8 4050 1 1 19 ALA HB2 H 21.877 3.554 0.027 1.00 . A X . 19 ALA HB2 1 1
8 4051 1 1 19 ALA HB3 H 20.728 4.722 -0.628 1.00 . A X . 19 ALA HB3 1 1
8 4052 1 1 19 ALA N N 22.046 3.053 -3.002 1.00 . A X . 19 ALA N 1 1
8 4053 1 1 19 ALA O O 18.718 2.829 -1.926 1.00 . A X . 19 ALA O 1 1
8 4054 1 1 20 GLN C C 17.764 3.529 -4.757 1.00 . A X . 20 GLN C 1 1
8 4055 1 1 20 GLN CA C 18.343 4.675 -3.936 1.00 . A X . 20 GLN CA 1 1
8 4056 1 1 20 GLN CB C 18.502 5.916 -4.820 1.00 . A X . 20 GLN CB 1 1
8 4057 1 1 20 GLN CD C 18.113 8.386 -4.934 1.00 . A X . 20 GLN CD 1 1
8 4058 1 1 20 GLN CG C 17.760 7.100 -4.194 1.00 . A X . 20 GLN CG 1 1
8 4059 1 1 20 GLN H H 20.457 4.692 -3.729 1.00 . A X . 20 GLN H 1 1
8 4060 1 1 20 GLN HA H 17.664 4.904 -3.127 1.00 . A X . 20 GLN HA 1 1
8 4061 1 1 20 GLN HB2 H 19.551 6.156 -4.917 1.00 . A X . 20 GLN HB2 1 1
8 4062 1 1 20 GLN HB3 H 18.090 5.716 -5.798 1.00 . A X . 20 GLN HB3 1 1
8 4063 1 1 20 GLN HE21 H 17.244 9.569 -3.597 1.00 . A X . 20 GLN HE21 1 1
8 4064 1 1 20 GLN HE22 H 17.966 10.366 -4.911 1.00 . A X . 20 GLN HE22 1 1
8 4065 1 1 20 GLN HG2 H 16.697 6.931 -4.257 1.00 . A X . 20 GLN HG2 1 1
8 4066 1 1 20 GLN HG3 H 18.047 7.199 -3.156 1.00 . A X . 20 GLN HG3 1 1
8 4067 1 1 20 GLN N N 19.632 4.286 -3.377 1.00 . A X . 20 GLN N 1 1
8 4068 1 1 20 GLN NE2 N 17.744 9.535 -4.439 1.00 . A X . 20 GLN NE2 1 1
8 4069 1 1 20 GLN O O 16.850 2.836 -4.312 1.00 . A X . 20 GLN O 1 1
8 4070 1 1 20 GLN OE1 O 18.739 8.341 -5.993 1.00 . A X . 20 GLN OE1 1 1
8 4071 1 1 21 ASP C C 17.807 0.940 -6.048 1.00 . A X . 21 ASP C 1 1
8 4072 1 1 21 ASP CA C 17.841 2.256 -6.817 1.00 . A X . 21 ASP CA 1 1
8 4073 1 1 21 ASP CB C 18.771 2.122 -8.025 1.00 . A X . 21 ASP CB 1 1
8 4074 1 1 21 ASP CG C 17.978 2.308 -9.316 1.00 . A X . 21 ASP CG 1 1
8 4075 1 1 21 ASP H H 19.038 3.908 -6.251 1.00 . A X . 21 ASP H 1 1
8 4076 1 1 21 ASP HA H 16.846 2.489 -7.164 1.00 . A X . 21 ASP HA 1 1
8 4077 1 1 21 ASP HB2 H 19.544 2.878 -7.967 1.00 . A X . 21 ASP HB2 1 1
8 4078 1 1 21 ASP HB3 H 19.224 1.141 -8.023 1.00 . A X . 21 ASP HB3 1 1
8 4079 1 1 21 ASP N N 18.308 3.329 -5.951 1.00 . A X . 21 ASP N 1 1
8 4080 1 1 21 ASP O O 17.217 -0.042 -6.497 1.00 . A X . 21 ASP O 1 1
8 4081 1 1 21 ASP OD1 O 17.223 3.263 -9.391 1.00 . A X . 21 ASP OD1 1 1
8 4082 1 1 21 ASP OD2 O 18.140 1.494 -10.209 1.00 . A X . 21 ASP OD2 1 1
8 4083 1 1 22 PHE C C 17.357 -0.268 -3.038 1.00 . A X . 22 PHE C 1 1
8 4084 1 1 22 PHE CA C 18.501 -0.257 -4.050 1.00 . A X . 22 PHE CA 1 1
8 4085 1 1 22 PHE CB C 19.837 -0.302 -3.310 1.00 . A X . 22 PHE CB 1 1
8 4086 1 1 22 PHE CD1 C 20.330 -2.702 -3.826 1.00 . A X . 22 PHE CD1 1 1
8 4087 1 1 22 PHE CD2 C 20.084 -2.038 -1.509 1.00 . A X . 22 PHE CD2 1 1
8 4088 1 1 22 PHE CE1 C 20.557 -4.017 -3.428 1.00 . A X . 22 PHE CE1 1 1
8 4089 1 1 22 PHE CE2 C 20.312 -3.357 -1.107 1.00 . A X . 22 PHE CE2 1 1
8 4090 1 1 22 PHE CG C 20.094 -1.714 -2.869 1.00 . A X . 22 PHE CG 1 1
8 4091 1 1 22 PHE CZ C 20.548 -4.350 -2.068 1.00 . A X . 22 PHE CZ 1 1
8 4092 1 1 22 PHE H H 18.905 1.743 -4.582 1.00 . A X . 22 PHE H 1 1
8 4093 1 1 22 PHE HA H 18.424 -1.134 -4.676 1.00 . A X . 22 PHE HA 1 1
8 4094 1 1 22 PHE HB2 H 20.628 0.019 -3.976 1.00 . A X . 22 PHE HB2 1 1
8 4095 1 1 22 PHE HB3 H 19.799 0.347 -2.449 1.00 . A X . 22 PHE HB3 1 1
8 4096 1 1 22 PHE HD1 H 20.339 -2.448 -4.875 1.00 . A X . 22 PHE HD1 1 1
8 4097 1 1 22 PHE HD2 H 19.903 -1.273 -0.770 1.00 . A X . 22 PHE HD2 1 1
8 4098 1 1 22 PHE HE1 H 20.735 -4.774 -4.170 1.00 . A X . 22 PHE HE1 1 1
8 4099 1 1 22 PHE HE2 H 20.302 -3.609 -0.059 1.00 . A X . 22 PHE HE2 1 1
8 4100 1 1 22 PHE HZ H 20.724 -5.371 -1.759 1.00 . A X . 22 PHE HZ 1 1
8 4101 1 1 22 PHE N N 18.450 0.932 -4.884 1.00 . A X . 22 PHE N 1 1
8 4102 1 1 22 PHE O O 16.407 -1.037 -3.170 1.00 . A X . 22 PHE O 1 1
8 4103 1 1 23 VAL C C 15.046 0.877 -1.589 1.00 . A X . 23 VAL C 1 1
8 4104 1 1 23 VAL CA C 16.433 0.658 -0.988 1.00 . A X . 23 VAL CA 1 1
8 4105 1 1 23 VAL CB C 16.750 1.796 -0.017 1.00 . A X . 23 VAL CB 1 1
8 4106 1 1 23 VAL CG1 C 15.636 1.903 1.025 1.00 . A X . 23 VAL CG1 1 1
8 4107 1 1 23 VAL CG2 C 18.078 1.509 0.686 1.00 . A X . 23 VAL CG2 1 1
8 4108 1 1 23 VAL H H 18.241 1.173 -1.967 1.00 . A X . 23 VAL H 1 1
8 4109 1 1 23 VAL HA H 16.432 -0.270 -0.439 1.00 . A X . 23 VAL HA 1 1
8 4110 1 1 23 VAL HB H 16.823 2.726 -0.561 1.00 . A X . 23 VAL HB 1 1
8 4111 1 1 23 VAL HG11 H 15.206 0.927 1.195 1.00 . A X . 23 VAL HG11 1 1
8 4112 1 1 23 VAL HG12 H 14.871 2.576 0.666 1.00 . A X . 23 VAL HG12 1 1
8 4113 1 1 23 VAL HG13 H 16.043 2.283 1.950 1.00 . A X . 23 VAL HG13 1 1
8 4114 1 1 23 VAL HG21 H 18.862 1.407 -0.051 1.00 . A X . 23 VAL HG21 1 1
8 4115 1 1 23 VAL HG22 H 17.996 0.593 1.252 1.00 . A X . 23 VAL HG22 1 1
8 4116 1 1 23 VAL HG23 H 18.316 2.324 1.354 1.00 . A X . 23 VAL HG23 1 1
8 4117 1 1 23 VAL N N 17.459 0.586 -2.024 1.00 . A X . 23 VAL N 1 1
8 4118 1 1 23 VAL O O 14.052 0.925 -0.864 1.00 . A X . 23 VAL O 1 1
8 4119 1 1 24 GLN C C 12.987 -0.110 -3.805 1.00 . A X . 24 GLN C 1 1
8 4120 1 1 24 GLN CA C 13.693 1.218 -3.571 1.00 . A X . 24 GLN CA 1 1
8 4121 1 1 24 GLN CB C 13.896 1.941 -4.907 1.00 . A X . 24 GLN CB 1 1
8 4122 1 1 24 GLN CD C 14.609 4.112 -3.855 1.00 . A X . 24 GLN CD 1 1
8 4123 1 1 24 GLN CG C 13.580 3.436 -4.760 1.00 . A X . 24 GLN CG 1 1
8 4124 1 1 24 GLN H H 15.790 0.961 -3.447 1.00 . A X . 24 GLN H 1 1
8 4125 1 1 24 GLN HA H 13.071 1.821 -2.930 1.00 . A X . 24 GLN HA 1 1
8 4126 1 1 24 GLN HB2 H 14.924 1.822 -5.224 1.00 . A X . 24 GLN HB2 1 1
8 4127 1 1 24 GLN HB3 H 13.239 1.509 -5.650 1.00 . A X . 24 GLN HB3 1 1
8 4128 1 1 24 GLN HE21 H 14.493 2.741 -2.420 1.00 . A X . 24 GLN HE21 1 1
8 4129 1 1 24 GLN HE22 H 15.578 4.009 -2.125 1.00 . A X . 24 GLN HE22 1 1
8 4130 1 1 24 GLN HG2 H 13.610 3.899 -5.736 1.00 . A X . 24 GLN HG2 1 1
8 4131 1 1 24 GLN HG3 H 12.593 3.561 -4.340 1.00 . A X . 24 GLN HG3 1 1
8 4132 1 1 24 GLN N N 14.975 1.007 -2.911 1.00 . A X . 24 GLN N 1 1
8 4133 1 1 24 GLN NE2 N 14.918 3.576 -2.705 1.00 . A X . 24 GLN NE2 1 1
8 4134 1 1 24 GLN O O 11.769 -0.149 -3.980 1.00 . A X . 24 GLN O 1 1
8 4135 1 1 24 GLN OE1 O 15.145 5.161 -4.207 1.00 . A X . 24 GLN OE1 1 1
8 4136 1 1 25 TRP C C 13.128 -3.228 -2.628 1.00 . A X . 25 TRP C 1 1
8 4137 1 1 25 TRP CA C 13.166 -2.517 -3.964 1.00 . A X . 25 TRP CA 1 1
8 4138 1 1 25 TRP CB C 13.997 -3.349 -4.918 1.00 . A X . 25 TRP CB 1 1
8 4139 1 1 25 TRP CD1 C 13.381 -5.733 -4.440 1.00 . A X . 25 TRP CD1 1 1
8 4140 1 1 25 TRP CD2 C 15.216 -5.073 -3.344 1.00 . A X . 25 TRP CD2 1 1
8 4141 1 1 25 TRP CE2 C 15.010 -6.419 -2.982 1.00 . A X . 25 TRP CE2 1 1
8 4142 1 1 25 TRP CE3 C 16.305 -4.397 -2.796 1.00 . A X . 25 TRP CE3 1 1
8 4143 1 1 25 TRP CG C 14.188 -4.674 -4.278 1.00 . A X . 25 TRP CG 1 1
8 4144 1 1 25 TRP CH2 C 16.957 -6.373 -1.556 1.00 . A X . 25 TRP CH2 1 1
8 4145 1 1 25 TRP CZ2 C 15.871 -7.070 -2.092 1.00 . A X . 25 TRP CZ2 1 1
8 4146 1 1 25 TRP CZ3 C 17.167 -5.035 -1.910 1.00 . A X . 25 TRP CZ3 1 1
8 4147 1 1 25 TRP H H 14.717 -1.118 -3.612 1.00 . A X . 25 TRP H 1 1
8 4148 1 1 25 TRP HA H 12.164 -2.436 -4.352 1.00 . A X . 25 TRP HA 1 1
8 4149 1 1 25 TRP HB2 H 13.474 -3.462 -5.858 1.00 . A X . 25 TRP HB2 1 1
8 4150 1 1 25 TRP HB3 H 14.955 -2.878 -5.079 1.00 . A X . 25 TRP HB3 1 1
8 4151 1 1 25 TRP HD1 H 12.501 -5.753 -5.067 1.00 . A X . 25 TRP HD1 1 1
8 4152 1 1 25 TRP HE1 H 13.475 -7.683 -3.627 1.00 . A X . 25 TRP HE1 1 1
8 4153 1 1 25 TRP HE3 H 16.468 -3.369 -3.047 1.00 . A X . 25 TRP HE3 1 1
8 4154 1 1 25 TRP HH2 H 17.630 -6.862 -0.867 1.00 . A X . 25 TRP HH2 1 1
8 4155 1 1 25 TRP HZ2 H 15.699 -8.095 -1.815 1.00 . A X . 25 TRP HZ2 1 1
8 4156 1 1 25 TRP HZ3 H 17.999 -4.488 -1.501 1.00 . A X . 25 TRP HZ3 1 1
8 4157 1 1 25 TRP N N 13.749 -1.198 -3.780 1.00 . A X . 25 TRP N 1 1
8 4158 1 1 25 TRP NE1 N 13.870 -6.787 -3.679 1.00 . A X . 25 TRP NE1 1 1
8 4159 1 1 25 TRP O O 12.191 -3.964 -2.322 1.00 . A X . 25 TRP O 1 1
8 4160 1 1 26 LEU C C 12.970 -3.389 0.247 1.00 . A X . 26 LEU C 1 1
8 4161 1 1 26 LEU CA C 14.255 -3.641 -0.536 1.00 . A X . 26 LEU CA 1 1
8 4162 1 1 26 LEU CB C 15.450 -3.095 0.254 1.00 . A X . 26 LEU CB 1 1
8 4163 1 1 26 LEU CD1 C 16.414 -5.219 1.247 1.00 . A X . 26 LEU CD1 1 1
8 4164 1 1 26 LEU CD2 C 16.463 -3.081 2.540 1.00 . A X . 26 LEU CD2 1 1
8 4165 1 1 26 LEU CG C 15.656 -3.916 1.544 1.00 . A X . 26 LEU CG 1 1
8 4166 1 1 26 LEU H H 14.892 -2.419 -2.135 1.00 . A X . 26 LEU H 1 1
8 4167 1 1 26 LEU HA H 14.388 -4.696 -0.688 1.00 . A X . 26 LEU HA 1 1
8 4168 1 1 26 LEU HB2 H 16.339 -3.147 -0.354 1.00 . A X . 26 LEU HB2 1 1
8 4169 1 1 26 LEU HB3 H 15.260 -2.065 0.517 1.00 . A X . 26 LEU HB3 1 1
8 4170 1 1 26 LEU HD11 H 15.781 -5.895 0.687 1.00 . A X . 26 LEU HD11 1 1
8 4171 1 1 26 LEU HD12 H 16.697 -5.685 2.178 1.00 . A X . 26 LEU HD12 1 1
8 4172 1 1 26 LEU HD13 H 17.302 -4.999 0.675 1.00 . A X . 26 LEU HD13 1 1
8 4173 1 1 26 LEU HD21 H 17.421 -2.832 2.108 1.00 . A X . 26 LEU HD21 1 1
8 4174 1 1 26 LEU HD22 H 16.612 -3.647 3.447 1.00 . A X . 26 LEU HD22 1 1
8 4175 1 1 26 LEU HD23 H 15.924 -2.173 2.768 1.00 . A X . 26 LEU HD23 1 1
8 4176 1 1 26 LEU HG H 14.699 -4.156 1.979 1.00 . A X . 26 LEU HG 1 1
8 4177 1 1 26 LEU N N 14.171 -3.009 -1.836 1.00 . A X . 26 LEU N 1 1
8 4178 1 1 26 LEU O O 12.537 -4.228 1.039 1.00 . A X . 26 LEU O 1 1
8 4179 1 1 27 MET C C 9.913 -2.151 -0.097 1.00 . A X . 27 MET C 1 1
8 4180 1 1 27 MET CA C 11.153 -1.853 0.743 1.00 . A X . 27 MET CA 1 1
8 4181 1 1 27 MET CB C 11.188 -0.366 1.098 1.00 . A X . 27 MET CB 1 1
8 4182 1 1 27 MET CE C 9.877 2.687 -1.156 1.00 . A X . 27 MET CE 1 1
8 4183 1 1 27 MET CG C 11.096 0.466 -0.183 1.00 . A X . 27 MET CG 1 1
8 4184 1 1 27 MET H H 12.773 -1.579 -0.598 1.00 . A X . 27 MET H 1 1
8 4185 1 1 27 MET HA H 11.099 -2.424 1.657 1.00 . A X . 27 MET HA 1 1
8 4186 1 1 27 MET HB2 H 10.354 -0.131 1.745 1.00 . A X . 27 MET HB2 1 1
8 4187 1 1 27 MET HB3 H 12.116 -0.140 1.606 1.00 . A X . 27 MET HB3 1 1
8 4188 1 1 27 MET HE1 H 8.981 3.251 -1.381 1.00 . A X . 27 MET HE1 1 1
8 4189 1 1 27 MET HE2 H 10.406 2.477 -2.071 1.00 . A X . 27 MET HE2 1 1
8 4190 1 1 27 MET HE3 H 10.514 3.263 -0.499 1.00 . A X . 27 MET HE3 1 1
8 4191 1 1 27 MET HG2 H 11.806 1.280 -0.134 1.00 . A X . 27 MET HG2 1 1
8 4192 1 1 27 MET HG3 H 11.318 -0.160 -1.036 1.00 . A X . 27 MET HG3 1 1
8 4193 1 1 27 MET N N 12.376 -2.216 0.036 1.00 . A X . 27 MET N 1 1
8 4194 1 1 27 MET O O 8.805 -1.745 0.256 1.00 . A X . 27 MET O 1 1
8 4195 1 1 27 MET SD S 9.421 1.135 -0.347 1.00 . A X . 27 MET SD 1 1
8 4196 1 1 28 ASN C C 8.468 -4.610 -1.761 1.00 . A X . 28 ASN C 1 1
8 4197 1 1 28 ASN CA C 8.975 -3.205 -2.071 1.00 . A X . 28 ASN CA 1 1
8 4198 1 1 28 ASN CB C 9.395 -3.126 -3.540 1.00 . A X . 28 ASN CB 1 1
8 4199 1 1 28 ASN CG C 9.639 -1.674 -3.934 1.00 . A X . 28 ASN CG 1 1
8 4200 1 1 28 ASN H H 11.000 -3.166 -1.438 1.00 . A X . 28 ASN H 1 1
8 4201 1 1 28 ASN HA H 8.175 -2.500 -1.899 1.00 . A X . 28 ASN HA 1 1
8 4202 1 1 28 ASN HB2 H 10.301 -3.695 -3.686 1.00 . A X . 28 ASN HB2 1 1
8 4203 1 1 28 ASN HB3 H 8.611 -3.536 -4.159 1.00 . A X . 28 ASN HB3 1 1
8 4204 1 1 28 ASN HD21 H 9.779 -2.071 -5.875 1.00 . A X . 28 ASN HD21 1 1
8 4205 1 1 28 ASN HD22 H 9.967 -0.438 -5.453 1.00 . A X . 28 ASN HD22 1 1
8 4206 1 1 28 ASN N N 10.099 -2.864 -1.204 1.00 . A X . 28 ASN N 1 1
8 4207 1 1 28 ASN ND2 N 9.810 -1.369 -5.192 1.00 . A X . 28 ASN ND2 1 1
8 4208 1 1 28 ASN O O 7.339 -4.785 -1.304 1.00 . A X . 28 ASN O 1 1
8 4209 1 1 28 ASN OD1 O 9.676 -0.793 -3.075 1.00 . A X . 28 ASN OD1 1 1
8 4210 1 1 29 THR C C 9.586 -7.494 -0.470 1.00 . A X . 29 THR C 1 1
8 4211 1 1 29 THR CA C 8.938 -6.994 -1.758 1.00 . A X . 29 THR CA 1 1
8 4212 1 1 29 THR CB C 9.375 -7.877 -2.927 1.00 . A X . 29 THR CB 1 1
8 4213 1 1 29 THR CG2 C 9.684 -7.001 -4.142 1.00 . A X . 29 THR CG2 1 1
8 4214 1 1 29 THR H H 10.198 -5.407 -2.377 1.00 . A X . 29 THR H 1 1
8 4215 1 1 29 THR HA H 7.865 -7.056 -1.655 1.00 . A X . 29 THR HA 1 1
8 4216 1 1 29 THR HB H 8.580 -8.563 -3.178 1.00 . A X . 29 THR HB 1 1
8 4217 1 1 29 THR HG1 H 11.277 -8.258 -3.058 1.00 . A X . 29 THR HG1 1 1
8 4218 1 1 29 THR HG21 H 8.835 -6.368 -4.356 1.00 . A X . 29 THR HG21 1 1
8 4219 1 1 29 THR HG22 H 9.887 -7.630 -4.997 1.00 . A X . 29 THR HG22 1 1
8 4220 1 1 29 THR HG23 H 10.548 -6.387 -3.934 1.00 . A X . 29 THR HG23 1 1
8 4221 1 1 29 THR N N 9.311 -5.608 -2.014 1.00 . A X . 29 THR N 1 1
8 4222 1 1 29 THR O O 9.059 -8.391 0.188 1.00 . A X . 29 THR O 1 1
8 4223 1 1 29 THR OG1 O 10.535 -8.608 -2.559 1.00 . A X . 29 THR OG1 1 1
8 4224 1 1 30 NH2 HN1 H 11.128 -6.249 -0.593 1.00 . A X . 30 NH2 HN1 1 1
8 4225 1 1 30 NH2 HN2 H 11.134 -7.278 0.756 1.00 . A X . 30 NH2 HN2 1 1
8 4226 1 1 30 NH2 N N 10.709 -6.963 -0.069 1.00 . A X . 30 NH2 N 1 1
8 4227 2 2 1 . C C 32.007 8.819 -12.032 1.00 . B X . 101 GGL C 1 1
8 4228 2 2 1 . CA C 31.081 8.748 -10.822 1.00 . B X . 101 GGL CA 1 1
8 4229 2 2 1 . CB C 30.565 7.316 -10.657 1.00 . B X . 101 GGL CB 1 1
8 4230 2 2 1 . CD C 28.101 7.603 -10.269 1.00 . B X . 101 GGL CD 1 1
8 4231 2 2 1 . CG C 29.177 7.193 -11.275 1.00 . B X . 101 GGL CG 1 1
8 4232 2 2 1 . H H 29.057 9.342 -11.026 1.00 . B X . 101 GGL H 1 1
8 4233 2 2 1 . HA H 31.634 9.011 -9.942 1.00 . B X . 101 GGL HA 1 1
8 4234 2 2 1 . HB2 H 30.517 7.069 -9.609 1.00 . B X . 101 GGL HB2 1 1
8 4235 2 2 1 . HB3 H 31.240 6.635 -11.154 1.00 . B X . 101 GGL HB3 1 1
8 4236 2 2 1 . HG2 H 29.127 7.830 -12.142 1.00 . B X . 101 GGL HG2 1 1
8 4237 2 2 1 . HG3 H 29.014 6.170 -11.576 1.00 . B X . 101 GGL HG3 1 1
8 4238 2 2 1 . N N 29.973 9.684 -10.970 1.00 . B X . 101 GGL N 1 1
8 4239 2 2 1 . O O 31.622 9.437 -13.011 1.00 . B X . 101 GGL O 1 1
8 4240 2 2 1 . OE1 O 26.992 7.068 -10.285 1.00 . B X . 101 GGL OE1 1 1
8 4241 2 2 1 . OXT O 33.099 8.283 -11.949 1.00 . B X . 101 GGL OXT 1 1
8 4242 3 2 1 . C C 28.233 15.360 -10.529 1.00 . C X . 102 GGL C 1 1
8 4243 3 2 1 . CA C 27.779 13.913 -10.371 1.00 . C X . 102 GGL CA 1 1
8 4244 3 2 1 . CB C 28.696 12.996 -11.183 1.00 . C X . 102 GGL CB 1 1
8 4245 3 2 1 . CD C 30.191 10.993 -11.073 1.00 . C X . 102 GGL CD 1 1
8 4246 3 2 1 . CG C 29.251 11.895 -10.278 1.00 . C X . 102 GGL CG 1 1
8 4247 3 2 1 . H H 26.071 14.300 -11.564 1.00 . C X . 102 GGL H 1 1
8 4248 3 2 1 . HA H 27.844 13.636 -9.330 1.00 . C X . 102 GGL HA 1 1
8 4249 3 2 1 . HB2 H 28.134 12.550 -11.992 1.00 . C X . 102 GGL HB2 1 1
8 4250 3 2 1 . HB3 H 29.514 13.572 -11.587 1.00 . C X . 102 GGL HB3 1 1
8 4251 3 2 1 . HG2 H 28.435 11.306 -9.887 1.00 . C X . 102 GGL HG2 1 1
8 4252 3 2 1 . HG3 H 29.794 12.343 -9.459 1.00 . C X . 102 GGL HG3 1 1
8 4253 3 2 1 . N N 26.400 13.758 -10.817 1.00 . C X . 102 GGL N 1 1
8 4254 3 2 1 . O O 27.677 16.047 -11.370 1.00 . C X . 102 GGL O 1 1
8 4255 3 2 1 . OE1 O 31.069 11.472 -11.789 1.00 . C X . 102 GGL OE1 1 1
8 4256 3 2 1 . OXT O 29.158 15.749 -9.833 1.00 . C X . 102 GGL OXT 1 1
8 4257 4 3 1 PLM C1 C 25.582 12.889 -10.231 1.00 . D X . 103 PLM C1 1 1
8 4258 4 3 1 PLM C2 C 24.302 12.554 -10.990 1.00 . D X . 103 PLM C2 1 1
8 4259 4 3 1 PLM C3 C 24.610 11.577 -12.127 1.00 . D X . 103 PLM C3 1 1
8 4260 4 3 1 PLM C4 C 24.739 10.161 -11.562 1.00 . D X . 103 PLM C4 1 1
8 4261 4 3 1 PLM C5 C 25.036 9.181 -12.699 1.00 . D X . 103 PLM C5 1 1
8 4262 4 3 1 PLM C6 C 24.552 7.783 -12.305 1.00 . D X . 103 PLM C6 1 1
8 4263 4 3 1 PLM C7 C 25.134 6.749 -13.271 1.00 . D X . 103 PLM C7 1 1
8 4264 4 3 1 PLM C8 C 24.632 5.353 -12.888 1.00 . D X . 103 PLM C8 1 1
8 4265 4 3 1 PLM C9 C 25.700 4.308 -13.226 1.00 . D X . 103 PLM C9 1 1
8 4266 4 3 1 PLM CA C 26.685 4.179 -12.057 1.00 . D X . 103 PLM CA 1 1
8 4267 4 3 1 PLM CB C 26.077 3.314 -10.945 1.00 . D X . 103 PLM CB 1 1
8 4268 4 3 1 PLM CC C 26.301 3.989 -9.588 1.00 . D X . 103 PLM CC 1 1
8 4269 4 3 1 PLM CD C 27.806 4.125 -9.316 1.00 . D X . 103 PLM CD 1 1
8 4270 4 3 1 PLM CE C 28.070 4.046 -7.806 1.00 . D X . 103 PLM CE 1 1
8 4271 4 3 1 PLM CF C 27.821 2.620 -7.304 1.00 . D X . 103 PLM CF 1 1
8 4272 4 3 1 PLM CG C 29.089 2.086 -6.633 1.00 . D X . 103 PLM CG 1 1
8 4273 4 3 1 PLM H21 H 23.592 12.102 -10.312 1.00 . D X . 103 PLM H21 1 1
8 4274 4 3 1 PLM H22 H 23.880 13.460 -11.400 1.00 . D X . 103 PLM H22 1 1
8 4275 4 3 1 PLM H31 H 23.807 11.604 -12.850 1.00 . D X . 103 PLM H31 1 1
8 4276 4 3 1 PLM H32 H 25.535 11.861 -12.604 1.00 . D X . 103 PLM H32 1 1
8 4277 4 3 1 PLM H41 H 23.815 9.881 -11.076 1.00 . D X . 103 PLM H41 1 1
8 4278 4 3 1 PLM H42 H 25.546 10.133 -10.844 1.00 . D X . 103 PLM H42 1 1
8 4279 4 3 1 PLM H51 H 24.523 9.500 -13.594 1.00 . D X . 103 PLM H51 1 1
8 4280 4 3 1 PLM H52 H 26.099 9.154 -12.884 1.00 . D X . 103 PLM H52 1 1
8 4281 4 3 1 PLM H61 H 23.474 7.750 -12.350 1.00 . D X . 103 PLM H61 1 1
8 4282 4 3 1 PLM H62 H 24.877 7.561 -11.299 1.00 . D X . 103 PLM H62 1 1
8 4283 4 3 1 PLM H71 H 24.820 6.980 -14.279 1.00 . D X . 103 PLM H71 1 1
8 4284 4 3 1 PLM H72 H 26.212 6.773 -13.216 1.00 . D X . 103 PLM H72 1 1
8 4285 4 3 1 PLM H81 H 23.729 5.134 -13.437 1.00 . D X . 103 PLM H81 1 1
8 4286 4 3 1 PLM H82 H 24.423 5.327 -11.829 1.00 . D X . 103 PLM H82 1 1
8 4287 4 3 1 PLM H91 H 25.227 3.354 -13.409 1.00 . D X . 103 PLM H91 1 1
8 4288 4 3 1 PLM H92 H 26.235 4.615 -14.112 1.00 . D X . 103 PLM H92 1 1
8 4289 4 3 1 PLM HA1 H 27.597 3.722 -12.408 1.00 . D X . 103 PLM HA1 1 1
8 4290 4 3 1 PLM HA2 H 26.904 5.160 -11.668 1.00 . D X . 103 PLM HA2 1 1
8 4291 4 3 1 PLM HB1 H 26.550 2.343 -10.947 1.00 . D X . 103 PLM HB1 1 1
8 4292 4 3 1 PLM HB2 H 25.018 3.194 -11.113 1.00 . D X . 103 PLM HB2 1 1
8 4293 4 3 1 PLM HC1 H 25.849 4.970 -9.597 1.00 . D X . 103 PLM HC1 1 1
8 4294 4 3 1 PLM HC2 H 25.844 3.394 -8.813 1.00 . D X . 103 PLM HC2 1 1
8 4295 4 3 1 PLM HD1 H 28.339 3.335 -9.822 1.00 . D X . 103 PLM HD1 1 1
8 4296 4 3 1 PLM HD2 H 28.149 5.077 -9.686 1.00 . D X . 103 PLM HD2 1 1
8 4297 4 3 1 PLM HE1 H 27.409 4.727 -7.289 1.00 . D X . 103 PLM HE1 1 1
8 4298 4 3 1 PLM HE2 H 29.094 4.322 -7.606 1.00 . D X . 103 PLM HE2 1 1
8 4299 4 3 1 PLM HF1 H 27.011 2.630 -6.591 1.00 . D X . 103 PLM HF1 1 1
8 4300 4 3 1 PLM HF2 H 27.560 1.982 -8.133 1.00 . D X . 103 PLM HF2 1 1
8 4301 4 3 1 PLM HG1 H 28.880 1.129 -6.179 1.00 . D X . 103 PLM HG1 1 1
8 4302 4 3 1 PLM HG2 H 29.866 1.970 -7.374 1.00 . D X . 103 PLM HG2 1 1
8 4303 4 3 1 PLM HG3 H 29.417 2.780 -5.874 1.00 . D X . 103 PLM HG3 1 1
8 4304 4 3 1 PLM O2 O 25.795 12.417 -9.115 1.00 . D X . 103 PLM O2 1 1
9 4305 1 1 1 HIS C C 41.495 15.092 -13.385 1.00 . A X . 1 HIS C 1 1
9 4306 1 1 1 HIS CA C 42.158 16.135 -14.281 1.00 . A X . 1 HIS CA 1 1
9 4307 1 1 1 HIS CB C 43.663 15.875 -14.357 1.00 . A X . 1 HIS CB 1 1
9 4308 1 1 1 HIS CD2 C 45.064 16.819 -16.372 1.00 . A X . 1 HIS CD2 1 1
9 4309 1 1 1 HIS CE1 C 44.879 18.930 -15.922 1.00 . A X . 1 HIS CE1 1 1
9 4310 1 1 1 HIS CG C 44.307 16.918 -15.230 1.00 . A X . 1 HIS CG 1 1
9 4311 1 1 1 HIS H1 H 42.639 17.704 -13.000 1.00 . A X . 1 HIS H1 1 1
9 4312 1 1 1 HIS H2 H 40.972 17.526 -13.283 1.00 . A X . 1 HIS H2 1 1
9 4313 1 1 1 HIS H3 H 41.973 18.198 -14.480 1.00 . A X . 1 HIS H3 1 1
9 4314 1 1 1 HIS HA H 41.733 16.077 -15.272 1.00 . A X . 1 HIS HA 1 1
9 4315 1 1 1 HIS HB2 H 44.088 15.928 -13.363 1.00 . A X . 1 HIS HB2 1 1
9 4316 1 1 1 HIS HB3 H 43.841 14.895 -14.777 1.00 . A X . 1 HIS HB3 1 1
9 4317 1 1 1 HIS HD2 H 45.337 15.894 -16.857 1.00 . A X . 1 HIS HD2 1 1
9 4318 1 1 1 HIS HE1 H 44.972 20.005 -15.970 1.00 . A X . 1 HIS HE1 1 1
9 4319 1 1 1 HIS HE2 H 45.962 18.321 -17.592 1.00 . A X . 1 HIS HE2 1 1
9 4320 1 1 1 HIS N N 41.917 17.494 -13.719 1.00 . A X . 1 HIS N 1 1
9 4321 1 1 1 HIS ND1 N 44.202 18.274 -14.963 1.00 . A X . 1 HIS ND1 1 1
9 4322 1 1 1 HIS NE2 N 45.424 18.091 -16.806 1.00 . A X . 1 HIS NE2 1 1
9 4323 1 1 1 HIS O O 41.833 14.965 -12.209 1.00 . A X . 1 HIS O 1 1
9 4324 1 1 2 ABA C C 40.813 12.553 -12.308 1.00 . A X . 2 AIB C 1 1
9 4325 1 1 2 ABA CA C 39.839 13.323 -13.197 1.00 . A X . 2 AIB CA 1 1
9 4326 1 1 2 ABA H H 40.318 14.500 -14.893 1.00 . A X . 2 AIB H 1 1
9 4327 1 1 2 ABA N N 40.546 14.352 -13.951 1.00 . A X . 2 AIB N 1 1
9 4328 1 1 2 ABA O O 40.483 12.175 -11.185 1.00 . A X . 2 AIB O 1 1
9 4329 1 1 3 GLN C C 43.510 12.444 -10.873 1.00 . A X . 3 GLN C 1 1
9 4330 1 1 3 GLN CA C 43.015 11.594 -12.041 1.00 . A X . 3 GLN CA 1 1
9 4331 1 1 3 GLN CB C 44.195 11.212 -12.937 1.00 . A X . 3 GLN CB 1 1
9 4332 1 1 3 GLN CD C 45.983 12.207 -14.378 1.00 . A X . 3 GLN CD 1 1
9 4333 1 1 3 GLN CG C 44.583 12.409 -13.807 1.00 . A X . 3 GLN CG 1 1
9 4334 1 1 3 GLN H H 42.236 12.642 -13.712 1.00 . A X . 3 GLN H 1 1
9 4335 1 1 3 GLN HA H 42.564 10.693 -11.652 1.00 . A X . 3 GLN HA 1 1
9 4336 1 1 3 GLN HB2 H 45.035 10.925 -12.322 1.00 . A X . 3 GLN HB2 1 1
9 4337 1 1 3 GLN HB3 H 43.912 10.386 -13.572 1.00 . A X . 3 GLN HB3 1 1
9 4338 1 1 3 GLN HE21 H 46.800 13.641 -13.273 1.00 . A X . 3 GLN HE21 1 1
9 4339 1 1 3 GLN HE22 H 47.867 12.831 -14.314 1.00 . A X . 3 GLN HE22 1 1
9 4340 1 1 3 GLN HG2 H 43.875 12.507 -14.620 1.00 . A X . 3 GLN HG2 1 1
9 4341 1 1 3 GLN HG3 H 44.568 13.308 -13.207 1.00 . A X . 3 GLN HG3 1 1
9 4342 1 1 3 GLN N N 42.016 12.321 -12.812 1.00 . A X . 3 GLN N 1 1
9 4343 1 1 3 GLN NE2 N 46.964 12.955 -13.953 1.00 . A X . 3 GLN NE2 1 1
9 4344 1 1 3 GLN O O 44.701 12.455 -10.560 1.00 . A X . 3 GLN O 1 1
9 4345 1 1 3 GLN OE1 O 46.187 11.345 -15.232 1.00 . A X . 3 GLN OE1 1 1
9 4346 1 1 4 GLY C C 41.676 14.545 -8.426 1.00 . A X . 4 GLY C 1 1
9 4347 1 1 4 GLY CA C 42.932 14.001 -9.100 1.00 . A X . 4 GLY CA 1 1
9 4348 1 1 4 GLY H H 41.655 13.105 -10.523 1.00 . A X . 4 GLY H 1 1
9 4349 1 1 4 GLY HA2 H 43.499 13.424 -8.383 1.00 . A X . 4 GLY HA2 1 1
9 4350 1 1 4 GLY HA3 H 43.530 14.829 -9.446 1.00 . A X . 4 GLY HA3 1 1
9 4351 1 1 4 GLY N N 42.585 13.153 -10.231 1.00 . A X . 4 GLY N 1 1
9 4352 1 1 4 GLY O O 41.755 15.215 -7.397 1.00 . A X . 4 GLY O 1 1
9 4353 1 1 5 THR C C 38.183 13.633 -8.504 1.00 . A X . 5 THR C 1 1
9 4354 1 1 5 THR CA C 39.251 14.723 -8.453 1.00 . A X . 5 THR CA 1 1
9 4355 1 1 5 THR CB C 38.760 15.959 -9.213 1.00 . A X . 5 THR CB 1 1
9 4356 1 1 5 THR CG2 C 39.930 16.615 -9.948 1.00 . A X . 5 THR CG2 1 1
9 4357 1 1 5 THR H H 40.509 13.714 -9.832 1.00 . A X . 5 THR H 1 1
9 4358 1 1 5 THR HA H 39.412 14.998 -7.423 1.00 . A X . 5 THR HA 1 1
9 4359 1 1 5 THR HB H 38.340 16.666 -8.515 1.00 . A X . 5 THR HB 1 1
9 4360 1 1 5 THR HG1 H 37.112 15.042 -9.689 1.00 . A X . 5 THR HG1 1 1
9 4361 1 1 5 THR HG21 H 40.300 15.945 -10.709 1.00 . A X . 5 THR HG21 1 1
9 4362 1 1 5 THR HG22 H 40.721 16.830 -9.246 1.00 . A X . 5 THR HG22 1 1
9 4363 1 1 5 THR HG23 H 39.597 17.532 -10.409 1.00 . A X . 5 THR HG23 1 1
9 4364 1 1 5 THR N N 40.514 14.252 -9.012 1.00 . A X . 5 THR N 1 1
9 4365 1 1 5 THR O O 37.244 13.642 -7.708 1.00 . A X . 5 THR O 1 1
9 4366 1 1 5 THR OG1 O 37.763 15.573 -10.150 1.00 . A X . 5 THR OG1 1 1
9 4367 1 1 6 PHE C C 37.344 10.759 -8.298 1.00 . A X . 6 PHE C 1 1
9 4368 1 1 6 PHE CA C 37.348 11.616 -9.559 1.00 . A X . 6 PHE CA 1 1
9 4369 1 1 6 PHE CB C 37.663 10.735 -10.772 1.00 . A X . 6 PHE CB 1 1
9 4370 1 1 6 PHE CD1 C 39.548 9.206 -10.092 1.00 . A X . 6 PHE CD1 1 1
9 4371 1 1 6 PHE CD2 C 37.282 8.342 -10.079 1.00 . A X . 6 PHE CD2 1 1
9 4372 1 1 6 PHE CE1 C 40.024 7.964 -9.656 1.00 . A X . 6 PHE CE1 1 1
9 4373 1 1 6 PHE CE2 C 37.759 7.100 -9.644 1.00 . A X . 6 PHE CE2 1 1
9 4374 1 1 6 PHE CG C 38.177 9.396 -10.303 1.00 . A X . 6 PHE CG 1 1
9 4375 1 1 6 PHE CZ C 39.129 6.910 -9.432 1.00 . A X . 6 PHE CZ 1 1
9 4376 1 1 6 PHE H H 39.087 12.731 -10.050 1.00 . A X . 6 PHE H 1 1
9 4377 1 1 6 PHE HA H 36.368 12.050 -9.690 1.00 . A X . 6 PHE HA 1 1
9 4378 1 1 6 PHE HB2 H 36.764 10.590 -11.354 1.00 . A X . 6 PHE HB2 1 1
9 4379 1 1 6 PHE HB3 H 38.410 11.212 -11.384 1.00 . A X . 6 PHE HB3 1 1
9 4380 1 1 6 PHE HD1 H 40.238 10.018 -10.264 1.00 . A X . 6 PHE HD1 1 1
9 4381 1 1 6 PHE HD2 H 36.225 8.487 -10.242 1.00 . A X . 6 PHE HD2 1 1
9 4382 1 1 6 PHE HE1 H 41.083 7.818 -9.493 1.00 . A X . 6 PHE HE1 1 1
9 4383 1 1 6 PHE HE2 H 37.069 6.287 -9.471 1.00 . A X . 6 PHE HE2 1 1
9 4384 1 1 6 PHE HZ H 39.497 5.952 -9.096 1.00 . A X . 6 PHE HZ 1 1
9 4385 1 1 6 PHE N N 38.323 12.696 -9.438 1.00 . A X . 6 PHE N 1 1
9 4386 1 1 6 PHE O O 36.444 9.943 -8.093 1.00 . A X . 6 PHE O 1 1
9 4387 1 1 7 THR C C 37.933 11.006 -5.042 1.00 . A X . 7 THR C 1 1
9 4388 1 1 7 THR CA C 38.457 10.188 -6.217 1.00 . A X . 7 THR CA 1 1
9 4389 1 1 7 THR CB C 39.916 9.801 -5.961 1.00 . A X . 7 THR CB 1 1
9 4390 1 1 7 THR CG2 C 40.825 10.556 -6.931 1.00 . A X . 7 THR CG2 1 1
9 4391 1 1 7 THR H H 39.042 11.614 -7.673 1.00 . A X . 7 THR H 1 1
9 4392 1 1 7 THR HA H 37.870 9.288 -6.309 1.00 . A X . 7 THR HA 1 1
9 4393 1 1 7 THR HB H 40.039 8.740 -6.110 1.00 . A X . 7 THR HB 1 1
9 4394 1 1 7 THR HG1 H 40.941 9.520 -4.332 1.00 . A X . 7 THR HG1 1 1
9 4395 1 1 7 THR HG21 H 40.609 10.245 -7.943 1.00 . A X . 7 THR HG21 1 1
9 4396 1 1 7 THR HG22 H 41.858 10.340 -6.701 1.00 . A X . 7 THR HG22 1 1
9 4397 1 1 7 THR HG23 H 40.650 11.617 -6.837 1.00 . A X . 7 THR HG23 1 1
9 4398 1 1 7 THR N N 38.354 10.950 -7.456 1.00 . A X . 7 THR N 1 1
9 4399 1 1 7 THR O O 37.170 10.504 -4.216 1.00 . A X . 7 THR O 1 1
9 4400 1 1 7 THR OG1 O 40.265 10.136 -4.625 1.00 . A X . 7 THR OG1 1 1
9 4401 1 1 8 SER C C 36.441 13.511 -4.057 1.00 . A X . 8 SER C 1 1
9 4402 1 1 8 SER CA C 37.913 13.145 -3.893 1.00 . A X . 8 SER CA 1 1
9 4403 1 1 8 SER CB C 38.759 14.418 -3.884 1.00 . A X . 8 SER CB 1 1
9 4404 1 1 8 SER H H 38.955 12.611 -5.658 1.00 . A X . 8 SER H 1 1
9 4405 1 1 8 SER HA H 38.043 12.634 -2.951 1.00 . A X . 8 SER HA 1 1
9 4406 1 1 8 SER HB2 H 39.416 14.422 -4.738 1.00 . A X . 8 SER HB2 1 1
9 4407 1 1 8 SER HB3 H 38.108 15.282 -3.929 1.00 . A X . 8 SER HB3 1 1
9 4408 1 1 8 SER HG H 39.270 15.226 -2.188 1.00 . A X . 8 SER HG 1 1
9 4409 1 1 8 SER N N 38.347 12.267 -4.972 1.00 . A X . 8 SER N 1 1
9 4410 1 1 8 SER O O 35.940 14.417 -3.391 1.00 . A X . 8 SER O 1 1
9 4411 1 1 8 SER OG O 39.537 14.456 -2.694 1.00 . A X . 8 SER OG 1 1
9 4412 1 1 9 ASP C C 33.573 11.754 -5.343 1.00 . A X . 9 ASP C 1 1
9 4413 1 1 9 ASP CA C 34.341 13.063 -5.191 1.00 . A X . 9 ASP CA 1 1
9 4414 1 1 9 ASP CB C 34.175 13.906 -6.457 1.00 . A X . 9 ASP CB 1 1
9 4415 1 1 9 ASP CG C 34.434 15.376 -6.141 1.00 . A X . 9 ASP CG 1 1
9 4416 1 1 9 ASP H H 36.208 12.094 -5.451 1.00 . A X . 9 ASP H 1 1
9 4417 1 1 9 ASP HA H 33.937 13.611 -4.354 1.00 . A X . 9 ASP HA 1 1
9 4418 1 1 9 ASP HB2 H 34.880 13.570 -7.206 1.00 . A X . 9 ASP HB2 1 1
9 4419 1 1 9 ASP HB3 H 33.168 13.793 -6.833 1.00 . A X . 9 ASP HB3 1 1
9 4420 1 1 9 ASP N N 35.756 12.803 -4.948 1.00 . A X . 9 ASP N 1 1
9 4421 1 1 9 ASP O O 32.420 11.747 -5.774 1.00 . A X . 9 ASP O 1 1
9 4422 1 1 9 ASP OD1 O 35.578 15.788 -6.236 1.00 . A X . 9 ASP OD1 1 1
9 4423 1 1 9 ASP OD2 O 33.484 16.066 -5.810 1.00 . A X . 9 ASP OD2 1 1
9 4424 1 1 10 TYR C C 33.108 8.871 -3.717 1.00 . A X . 10 TYR C 1 1
9 4425 1 1 10 TYR CA C 33.590 9.339 -5.090 1.00 . A X . 10 TYR CA 1 1
9 4426 1 1 10 TYR CB C 34.582 8.327 -5.672 1.00 . A X . 10 TYR CB 1 1
9 4427 1 1 10 TYR CD1 C 32.642 6.878 -6.381 1.00 . A X . 10 TYR CD1 1 1
9 4428 1 1 10 TYR CD2 C 34.461 7.236 -7.942 1.00 . A X . 10 TYR CD2 1 1
9 4429 1 1 10 TYR CE1 C 31.989 6.074 -7.323 1.00 . A X . 10 TYR CE1 1 1
9 4430 1 1 10 TYR CE2 C 33.809 6.432 -8.885 1.00 . A X . 10 TYR CE2 1 1
9 4431 1 1 10 TYR CG C 33.877 7.459 -6.689 1.00 . A X . 10 TYR CG 1 1
9 4432 1 1 10 TYR CZ C 32.574 5.851 -8.575 1.00 . A X . 10 TYR CZ 1 1
9 4433 1 1 10 TYR H H 35.139 10.717 -4.653 1.00 . A X . 10 TYR H 1 1
9 4434 1 1 10 TYR HA H 32.739 9.411 -5.750 1.00 . A X . 10 TYR HA 1 1
9 4435 1 1 10 TYR HB2 H 35.392 8.857 -6.152 1.00 . A X . 10 TYR HB2 1 1
9 4436 1 1 10 TYR HB3 H 34.977 7.707 -4.883 1.00 . A X . 10 TYR HB3 1 1
9 4437 1 1 10 TYR HD1 H 32.192 7.050 -5.415 1.00 . A X . 10 TYR HD1 1 1
9 4438 1 1 10 TYR HD2 H 35.416 7.683 -8.182 1.00 . A X . 10 TYR HD2 1 1
9 4439 1 1 10 TYR HE1 H 31.036 5.627 -7.082 1.00 . A X . 10 TYR HE1 1 1
9 4440 1 1 10 TYR HE2 H 34.259 6.259 -9.851 1.00 . A X . 10 TYR HE2 1 1
9 4441 1 1 10 TYR HH H 32.142 4.144 -9.311 1.00 . A X . 10 TYR HH 1 1
9 4442 1 1 10 TYR N N 34.221 10.650 -4.988 1.00 . A X . 10 TYR N 1 1
9 4443 1 1 10 TYR O O 33.189 7.687 -3.387 1.00 . A X . 10 TYR O 1 1
9 4444 1 1 10 TYR OH O 31.931 5.059 -9.505 1.00 . A X . 10 TYR OH 1 1
9 4445 1 1 11 SER C C 30.631 9.855 -1.471 1.00 . A X . 11 SER C 1 1
9 4446 1 1 11 SER CA C 32.112 9.500 -1.586 1.00 . A X . 11 SER CA 1 1
9 4447 1 1 11 SER CB C 32.906 10.281 -0.540 1.00 . A X . 11 SER CB 1 1
9 4448 1 1 11 SER H H 32.569 10.739 -3.244 1.00 . A X . 11 SER H 1 1
9 4449 1 1 11 SER HA H 32.232 8.444 -1.400 1.00 . A X . 11 SER HA 1 1
9 4450 1 1 11 SER HB2 H 33.520 9.604 0.029 1.00 . A X . 11 SER HB2 1 1
9 4451 1 1 11 SER HB3 H 33.539 11.006 -1.036 1.00 . A X . 11 SER HB3 1 1
9 4452 1 1 11 SER HG H 32.429 11.023 1.195 1.00 . A X . 11 SER HG 1 1
9 4453 1 1 11 SER N N 32.607 9.814 -2.923 1.00 . A X . 11 SER N 1 1
9 4454 1 1 11 SER O O 29.904 9.261 -0.675 1.00 . A X . 11 SER O 1 1
9 4455 1 1 11 SER OG O 32.004 10.943 0.338 1.00 . A X . 11 SER OG 1 1
9 4456 1 1 12 LYS C C 28.104 10.865 -3.551 1.00 . A X . 12 LYS C 1 1
9 4457 1 1 12 LYS CA C 28.803 11.259 -2.253 1.00 . A X . 12 LYS CA 1 1
9 4458 1 1 12 LYS CB C 28.730 12.776 -2.073 1.00 . A X . 12 LYS CB 1 1
9 4459 1 1 12 LYS CD C 28.287 13.725 0.196 1.00 . A X . 12 LYS CD 1 1
9 4460 1 1 12 LYS CE C 28.873 13.924 1.594 1.00 . A X . 12 LYS CE 1 1
9 4461 1 1 12 LYS CG C 29.362 13.162 -0.734 1.00 . A X . 12 LYS CG 1 1
9 4462 1 1 12 LYS H H 30.826 11.262 -2.880 1.00 . A X . 12 LYS H 1 1
9 4463 1 1 12 LYS HA H 28.296 10.785 -1.425 1.00 . A X . 12 LYS HA 1 1
9 4464 1 1 12 LYS HB2 H 29.263 13.259 -2.878 1.00 . A X . 12 LYS HB2 1 1
9 4465 1 1 12 LYS HB3 H 27.697 13.091 -2.086 1.00 . A X . 12 LYS HB3 1 1
9 4466 1 1 12 LYS HD2 H 27.941 14.675 -0.189 1.00 . A X . 12 LYS HD2 1 1
9 4467 1 1 12 LYS HD3 H 27.460 13.036 0.249 1.00 . A X . 12 LYS HD3 1 1
9 4468 1 1 12 LYS HE2 H 28.501 14.849 2.014 1.00 . A X . 12 LYS HE2 1 1
9 4469 1 1 12 LYS HE3 H 28.583 13.097 2.227 1.00 . A X . 12 LYS HE3 1 1
9 4470 1 1 12 LYS HG2 H 29.809 12.288 -0.282 1.00 . A X . 12 LYS HG2 1 1
9 4471 1 1 12 LYS HG3 H 30.122 13.911 -0.898 1.00 . A X . 12 LYS HG3 1 1
9 4472 1 1 12 LYS HZ1 H 30.636 14.591 0.708 1.00 . A X . 12 LYS HZ1 1 1
9 4473 1 1 12 LYS HZ2 H 30.735 13.024 1.357 1.00 . A X . 12 LYS HZ2 1 1
9 4474 1 1 12 LYS HZ3 H 30.746 14.375 2.387 1.00 . A X . 12 LYS HZ3 1 1
9 4475 1 1 12 LYS N N 30.197 10.826 -2.268 1.00 . A X . 12 LYS N 1 1
9 4476 1 1 12 LYS NZ N 30.359 13.983 1.506 1.00 . A X . 12 LYS NZ 1 1
9 4477 1 1 12 LYS O O 27.835 11.712 -4.402 1.00 . A X . 12 LYS O 1 1
9 4478 1 1 13 LYS C C 26.563 7.696 -4.634 1.00 . A X . 13 LYS C 1 1
9 4479 1 1 13 LYS CA C 27.142 9.083 -4.892 1.00 . A X . 13 LYS CA 1 1
9 4480 1 1 13 LYS CB C 28.143 9.030 -6.063 1.00 . A X . 13 LYS CB 1 1
9 4481 1 1 13 LYS CD C 26.848 7.991 -7.970 1.00 . A X . 13 LYS CD 1 1
9 4482 1 1 13 LYS CE C 27.757 7.430 -9.067 1.00 . A X . 13 LYS CE 1 1
9 4483 1 1 13 LYS CG C 27.451 9.289 -7.418 1.00 . A X . 13 LYS CG 1 1
9 4484 1 1 13 LYS H H 28.049 8.947 -2.982 1.00 . A X . 13 LYS H 1 1
9 4485 1 1 13 LYS HA H 26.335 9.756 -5.134 1.00 . A X . 13 LYS HA 1 1
9 4486 1 1 13 LYS HB2 H 28.900 9.785 -5.908 1.00 . A X . 13 LYS HB2 1 1
9 4487 1 1 13 LYS HB3 H 28.616 8.060 -6.083 1.00 . A X . 13 LYS HB3 1 1
9 4488 1 1 13 LYS HD2 H 26.750 7.264 -7.180 1.00 . A X . 13 LYS HD2 1 1
9 4489 1 1 13 LYS HD3 H 25.875 8.199 -8.390 1.00 . A X . 13 LYS HD3 1 1
9 4490 1 1 13 LYS HE2 H 27.330 6.516 -9.452 1.00 . A X . 13 LYS HE2 1 1
9 4491 1 1 13 LYS HE3 H 27.837 8.151 -9.869 1.00 . A X . 13 LYS HE3 1 1
9 4492 1 1 13 LYS HG2 H 26.670 10.025 -7.304 1.00 . A X . 13 LYS HG2 1 1
9 4493 1 1 13 LYS HG3 H 28.181 9.661 -8.119 1.00 . A X . 13 LYS HG3 1 1
9 4494 1 1 13 LYS HZ1 H 29.167 6.667 -7.680 1.00 . A X . 13 LYS HZ1 1 1
9 4495 1 1 13 LYS N N 27.812 9.577 -3.693 1.00 . A X . 13 LYS N 1 1
9 4496 1 1 13 LYS NZ N 29.083 7.151 -8.529 1.00 . A X . 13 LYS NZ 1 1
9 4497 1 1 13 LYS O O 25.378 7.456 -4.869 1.00 . A X . 13 LYS O 1 1
9 4498 1 1 14 LEU C C 25.784 5.486 -2.859 1.00 . A X . 14 LEU C 1 1
9 4499 1 1 14 LEU CA C 26.941 5.435 -3.848 1.00 . A X . 14 LEU CA 1 1
9 4500 1 1 14 LEU CB C 28.075 4.584 -3.264 1.00 . A X . 14 LEU CB 1 1
9 4501 1 1 14 LEU CD1 C 30.438 4.579 -2.463 1.00 . A X . 14 LEU CD1 1 1
9 4502 1 1 14 LEU CD2 C 29.843 5.782 -4.567 1.00 . A X . 14 LEU CD2 1 1
9 4503 1 1 14 LEU CG C 29.362 5.408 -3.163 1.00 . A X . 14 LEU CG 1 1
9 4504 1 1 14 LEU H H 28.329 7.036 -3.964 1.00 . A X . 14 LEU H 1 1
9 4505 1 1 14 LEU HA H 26.599 4.980 -4.765 1.00 . A X . 14 LEU HA 1 1
9 4506 1 1 14 LEU HB2 H 27.794 4.240 -2.281 1.00 . A X . 14 LEU HB2 1 1
9 4507 1 1 14 LEU HB3 H 28.248 3.734 -3.905 1.00 . A X . 14 LEU HB3 1 1
9 4508 1 1 14 LEU HD11 H 31.320 4.535 -3.086 1.00 . A X . 14 LEU HD11 1 1
9 4509 1 1 14 LEU HD12 H 30.068 3.579 -2.292 1.00 . A X . 14 LEU HD12 1 1
9 4510 1 1 14 LEU HD13 H 30.688 5.037 -1.517 1.00 . A X . 14 LEU HD13 1 1
9 4511 1 1 14 LEU HD21 H 29.995 6.850 -4.623 1.00 . A X . 14 LEU HD21 1 1
9 4512 1 1 14 LEU HD22 H 29.100 5.486 -5.294 1.00 . A X . 14 LEU HD22 1 1
9 4513 1 1 14 LEU HD23 H 30.773 5.273 -4.776 1.00 . A X . 14 LEU HD23 1 1
9 4514 1 1 14 LEU HG H 29.174 6.306 -2.591 1.00 . A X . 14 LEU HG 1 1
9 4515 1 1 14 LEU N N 27.399 6.789 -4.140 1.00 . A X . 14 LEU N 1 1
9 4516 1 1 14 LEU O O 24.784 4.788 -3.020 1.00 . A X . 14 LEU O 1 1
9 4517 1 1 15 ASP C C 23.721 7.280 -1.417 1.00 . A X . 15 ASP C 1 1
9 4518 1 1 15 ASP CA C 24.879 6.476 -0.838 1.00 . A X . 15 ASP CA 1 1
9 4519 1 1 15 ASP CB C 25.433 7.183 0.401 1.00 . A X . 15 ASP CB 1 1
9 4520 1 1 15 ASP CG C 24.482 6.994 1.576 1.00 . A X . 15 ASP CG 1 1
9 4521 1 1 15 ASP H H 26.741 6.867 -1.769 1.00 . A X . 15 ASP H 1 1
9 4522 1 1 15 ASP HA H 24.524 5.496 -0.557 1.00 . A X . 15 ASP HA 1 1
9 4523 1 1 15 ASP HB2 H 26.399 6.765 0.650 1.00 . A X . 15 ASP HB2 1 1
9 4524 1 1 15 ASP HB3 H 25.539 8.240 0.193 1.00 . A X . 15 ASP HB3 1 1
9 4525 1 1 15 ASP N N 25.925 6.329 -1.841 1.00 . A X . 15 ASP N 1 1
9 4526 1 1 15 ASP O O 23.266 8.257 -0.820 1.00 . A X . 15 ASP O 1 1
9 4527 1 1 15 ASP OD1 O 23.984 5.893 1.740 1.00 . A X . 15 ASP OD1 1 1
9 4528 1 1 15 ASP OD2 O 24.265 7.954 2.299 1.00 . A X . 15 ASP OD2 1 1
9 4529 1 1 16 ABA C C 21.925 6.836 -4.614 1.00 . A X . 16 AIB C 1 1
9 4530 1 1 16 ABA CA C 22.160 7.520 -3.274 1.00 . A X . 16 AIB CA 1 1
9 4531 1 1 16 ABA H H 23.678 6.073 -3.006 1.00 . A X . 16 AIB H 1 1
9 4532 1 1 16 ABA N N 23.261 6.855 -2.587 1.00 . A X . 16 AIB N 1 1
9 4533 1 1 16 ABA O O 20.801 6.779 -5.109 1.00 . A X . 16 AIB O 1 1
9 4534 1 1 17 ARG C C 23.089 4.103 -6.201 1.00 . A X . 17 ARG C 1 1
9 4535 1 1 17 ARG CA C 22.918 5.596 -6.451 1.00 . A X . 17 ARG CA 1 1
9 4536 1 1 17 ARG CB C 24.012 6.095 -7.391 1.00 . A X . 17 ARG CB 1 1
9 4537 1 1 17 ARG CD C 22.870 5.101 -9.394 1.00 . A X . 17 ARG CD 1 1
9 4538 1 1 17 ARG CG C 23.424 6.388 -8.777 1.00 . A X . 17 ARG CG 1 1
9 4539 1 1 17 ARG CZ C 22.100 4.478 -11.613 1.00 . A X . 17 ARG CZ 1 1
9 4540 1 1 17 ARG H H 23.864 6.371 -4.726 1.00 . A X . 17 ARG H 1 1
9 4541 1 1 17 ARG HA H 21.952 5.773 -6.897 1.00 . A X . 17 ARG HA 1 1
9 4542 1 1 17 ARG HB2 H 24.438 6.999 -6.983 1.00 . A X . 17 ARG HB2 1 1
9 4543 1 1 17 ARG HB3 H 24.781 5.342 -7.477 1.00 . A X . 17 ARG HB3 1 1
9 4544 1 1 17 ARG HD2 H 23.452 4.258 -9.055 1.00 . A X . 17 ARG HD2 1 1
9 4545 1 1 17 ARG HD3 H 21.842 4.970 -9.088 1.00 . A X . 17 ARG HD3 1 1
9 4546 1 1 17 ARG HE H 23.611 5.745 -11.273 1.00 . A X . 17 ARG HE 1 1
9 4547 1 1 17 ARG HG2 H 22.630 7.114 -8.684 1.00 . A X . 17 ARG HG2 1 1
9 4548 1 1 17 ARG HG3 H 24.199 6.785 -9.415 1.00 . A X . 17 ARG HG3 1 1
9 4549 1 1 17 ARG HH11 H 21.137 3.641 -10.070 1.00 . A X . 17 ARG HH11 1 1
9 4550 1 1 17 ARG HH12 H 20.569 3.188 -11.643 1.00 . A X . 17 ARG HH12 1 1
9 4551 1 1 17 ARG HH21 H 22.872 5.152 -13.335 1.00 . A X . 17 ARG HH21 1 1
9 4552 1 1 17 ARG HH22 H 21.550 4.042 -13.490 1.00 . A X . 17 ARG HH22 1 1
9 4553 1 1 17 ARG N N 22.998 6.302 -5.181 1.00 . A X . 17 ARG N 1 1
9 4554 1 1 17 ARG NE N 22.937 5.173 -10.850 1.00 . A X . 17 ARG NE 1 1
9 4555 1 1 17 ARG NH1 N 21.199 3.709 -11.066 1.00 . A X . 17 ARG NH1 1 1
9 4556 1 1 17 ARG NH2 N 22.180 4.564 -12.914 1.00 . A X . 17 ARG NH2 1 1
9 4557 1 1 17 ARG O O 22.745 3.272 -7.040 1.00 . A X . 17 ARG O 1 1
9 4558 1 1 18 ARG C C 22.942 2.150 -3.391 1.00 . A X . 18 ARG C 1 1
9 4559 1 1 18 ARG CA C 23.794 2.398 -4.617 1.00 . A X . 18 ARG CA 1 1
9 4560 1 1 18 ARG CB C 25.264 2.145 -4.286 1.00 . A X . 18 ARG CB 1 1
9 4561 1 1 18 ARG CD C 26.889 0.314 -3.789 1.00 . A X . 18 ARG CD 1 1
9 4562 1 1 18 ARG CG C 25.585 0.667 -4.504 1.00 . A X . 18 ARG CG 1 1
9 4563 1 1 18 ARG CZ C 25.966 -0.707 -1.790 1.00 . A X . 18 ARG CZ 1 1
9 4564 1 1 18 ARG H H 23.829 4.494 -4.379 1.00 . A X . 18 ARG H 1 1
9 4565 1 1 18 ARG HA H 23.484 1.740 -5.415 1.00 . A X . 18 ARG HA 1 1
9 4566 1 1 18 ARG HB2 H 25.889 2.749 -4.929 1.00 . A X . 18 ARG HB2 1 1
9 4567 1 1 18 ARG HB3 H 25.452 2.404 -3.252 1.00 . A X . 18 ARG HB3 1 1
9 4568 1 1 18 ARG HD2 H 27.235 -0.651 -4.132 1.00 . A X . 18 ARG HD2 1 1
9 4569 1 1 18 ARG HD3 H 27.635 1.062 -4.020 1.00 . A X . 18 ARG HD3 1 1
9 4570 1 1 18 ARG HE H 27.071 0.962 -1.780 1.00 . A X . 18 ARG HE 1 1
9 4571 1 1 18 ARG HG2 H 24.780 0.065 -4.107 1.00 . A X . 18 ARG HG2 1 1
9 4572 1 1 18 ARG HG3 H 25.691 0.475 -5.561 1.00 . A X . 18 ARG HG3 1 1
9 4573 1 1 18 ARG HH11 H 25.575 -1.626 -3.524 1.00 . A X . 18 ARG HH11 1 1
9 4574 1 1 18 ARG HH12 H 24.903 -2.372 -2.113 1.00 . A X . 18 ARG HH12 1 1
9 4575 1 1 18 ARG HH21 H 26.195 -0.012 0.075 1.00 . A X . 18 ARG HH21 1 1
9 4576 1 1 18 ARG HH22 H 25.255 -1.459 -0.075 1.00 . A X . 18 ARG HH22 1 1
9 4577 1 1 18 ARG N N 23.599 3.780 -5.017 1.00 . A X . 18 ARG N 1 1
9 4578 1 1 18 ARG NE N 26.680 0.265 -2.347 1.00 . A X . 18 ARG NE 1 1
9 4579 1 1 18 ARG NH1 N 25.441 -1.642 -2.532 1.00 . A X . 18 ARG NH1 1 1
9 4580 1 1 18 ARG NH2 N 25.792 -0.728 -0.495 1.00 . A X . 18 ARG NH2 1 1
9 4581 1 1 18 ARG O O 23.004 1.095 -2.759 1.00 . A X . 18 ARG O 1 1
9 4582 1 1 19 ALA C C 19.833 3.313 -2.344 1.00 . A X . 19 ALA C 1 1
9 4583 1 1 19 ALA CA C 21.281 3.125 -1.915 1.00 . A X . 19 ALA CA 1 1
9 4584 1 1 19 ALA CB C 21.680 4.245 -0.962 1.00 . A X . 19 ALA CB 1 1
9 4585 1 1 19 ALA H H 22.177 3.974 -3.617 1.00 . A X . 19 ALA H 1 1
9 4586 1 1 19 ALA HA H 21.388 2.180 -1.412 1.00 . A X . 19 ALA HA 1 1
9 4587 1 1 19 ALA HB1 H 22.357 4.918 -1.477 1.00 . A X . 19 ALA HB1 1 1
9 4588 1 1 19 ALA HB2 H 22.174 3.824 -0.099 1.00 . A X . 19 ALA HB2 1 1
9 4589 1 1 19 ALA HB3 H 20.799 4.785 -0.651 1.00 . A X . 19 ALA HB3 1 1
9 4590 1 1 19 ALA N N 22.156 3.164 -3.067 1.00 . A X . 19 ALA N 1 1
9 4591 1 1 19 ALA O O 18.934 2.642 -1.839 1.00 . A X . 19 ALA O 1 1
9 4592 1 1 20 GLN C C 17.731 3.284 -4.523 1.00 . A X . 20 GLN C 1 1
9 4593 1 1 20 GLN CA C 18.263 4.493 -3.764 1.00 . A X . 20 GLN CA 1 1
9 4594 1 1 20 GLN CB C 18.261 5.720 -4.679 1.00 . A X . 20 GLN CB 1 1
9 4595 1 1 20 GLN CD C 16.441 5.148 -6.297 1.00 . A X . 20 GLN CD 1 1
9 4596 1 1 20 GLN CG C 16.828 6.033 -5.118 1.00 . A X . 20 GLN CG 1 1
9 4597 1 1 20 GLN H H 20.369 4.739 -3.651 1.00 . A X . 20 GLN H 1 1
9 4598 1 1 20 GLN HA H 17.621 4.686 -2.917 1.00 . A X . 20 GLN HA 1 1
9 4599 1 1 20 GLN HB2 H 18.667 6.567 -4.146 1.00 . A X . 20 GLN HB2 1 1
9 4600 1 1 20 GLN HB3 H 18.866 5.519 -5.550 1.00 . A X . 20 GLN HB3 1 1
9 4601 1 1 20 GLN HE21 H 14.673 4.656 -5.537 1.00 . A X . 20 GLN HE21 1 1
9 4602 1 1 20 GLN HE22 H 15.028 3.972 -7.048 1.00 . A X . 20 GLN HE22 1 1
9 4603 1 1 20 GLN HG2 H 16.152 5.853 -4.295 1.00 . A X . 20 GLN HG2 1 1
9 4604 1 1 20 GLN HG3 H 16.765 7.069 -5.413 1.00 . A X . 20 GLN HG3 1 1
9 4605 1 1 20 GLN N N 19.612 4.231 -3.279 1.00 . A X . 20 GLN N 1 1
9 4606 1 1 20 GLN NE2 N 15.284 4.542 -6.293 1.00 . A X . 20 GLN NE2 1 1
9 4607 1 1 20 GLN O O 16.888 2.543 -4.018 1.00 . A X . 20 GLN O 1 1
9 4608 1 1 20 GLN OE1 O 17.210 5.004 -7.247 1.00 . A X . 20 GLN OE1 1 1
9 4609 1 1 21 ASP C C 17.737 0.693 -5.702 1.00 . A X . 21 ASP C 1 1
9 4610 1 1 21 ASP CA C 17.806 1.957 -6.551 1.00 . A X . 21 ASP CA 1 1
9 4611 1 1 21 ASP CB C 18.786 1.749 -7.708 1.00 . A X . 21 ASP CB 1 1
9 4612 1 1 21 ASP CG C 19.304 0.314 -7.700 1.00 . A X . 21 ASP CG 1 1
9 4613 1 1 21 ASP H H 18.909 3.706 -6.087 1.00 . A X . 21 ASP H 1 1
9 4614 1 1 21 ASP HA H 16.828 2.166 -6.956 1.00 . A X . 21 ASP HA 1 1
9 4615 1 1 21 ASP HB2 H 18.282 1.943 -8.644 1.00 . A X . 21 ASP HB2 1 1
9 4616 1 1 21 ASP HB3 H 19.621 2.430 -7.598 1.00 . A X . 21 ASP HB3 1 1
9 4617 1 1 21 ASP N N 18.234 3.086 -5.736 1.00 . A X . 21 ASP N 1 1
9 4618 1 1 21 ASP O O 16.903 -0.182 -5.935 1.00 . A X . 21 ASP O 1 1
9 4619 1 1 21 ASP OD1 O 20.085 -0.008 -6.820 1.00 . A X . 21 ASP OD1 1 1
9 4620 1 1 21 ASP OD2 O 18.910 -0.441 -8.574 1.00 . A X . 21 ASP OD2 1 1
9 4621 1 1 22 PHE C C 17.523 -0.495 -2.814 1.00 . A X . 22 PHE C 1 1
9 4622 1 1 22 PHE CA C 18.661 -0.549 -3.829 1.00 . A X . 22 PHE CA 1 1
9 4623 1 1 22 PHE CB C 20.000 -0.588 -3.094 1.00 . A X . 22 PHE CB 1 1
9 4624 1 1 22 PHE CD1 C 20.444 -3.017 -3.510 1.00 . A X . 22 PHE CD1 1 1
9 4625 1 1 22 PHE CD2 C 20.209 -2.257 -1.222 1.00 . A X . 22 PHE CD2 1 1
9 4626 1 1 22 PHE CE1 C 20.641 -4.322 -3.060 1.00 . A X . 22 PHE CE1 1 1
9 4627 1 1 22 PHE CE2 C 20.408 -3.564 -0.769 1.00 . A X . 22 PHE CE2 1 1
9 4628 1 1 22 PHE CG C 20.229 -1.986 -2.595 1.00 . A X . 22 PHE CG 1 1
9 4629 1 1 22 PHE CZ C 20.624 -4.599 -1.687 1.00 . A X . 22 PHE CZ 1 1
9 4630 1 1 22 PHE H H 19.263 1.333 -4.576 1.00 . A X . 22 PHE H 1 1
9 4631 1 1 22 PHE HA H 18.565 -1.450 -4.417 1.00 . A X . 22 PHE HA 1 1
9 4632 1 1 22 PHE HB2 H 20.793 -0.310 -3.773 1.00 . A X . 22 PHE HB2 1 1
9 4633 1 1 22 PHE HB3 H 19.978 0.096 -2.259 1.00 . A X . 22 PHE HB3 1 1
9 4634 1 1 22 PHE HD1 H 20.459 -2.807 -4.570 1.00 . A X . 22 PHE HD1 1 1
9 4635 1 1 22 PHE HD2 H 20.043 -1.458 -0.516 1.00 . A X . 22 PHE HD2 1 1
9 4636 1 1 22 PHE HE1 H 20.802 -5.113 -3.771 1.00 . A X . 22 PHE HE1 1 1
9 4637 1 1 22 PHE HE2 H 20.394 -3.773 0.288 1.00 . A X . 22 PHE HE2 1 1
9 4638 1 1 22 PHE HZ H 20.777 -5.609 -1.337 1.00 . A X . 22 PHE HZ 1 1
9 4639 1 1 22 PHE N N 18.622 0.607 -4.713 1.00 . A X . 22 PHE N 1 1
9 4640 1 1 22 PHE O O 16.555 -1.247 -2.916 1.00 . A X . 22 PHE O 1 1
9 4641 1 1 23 VAL C C 15.253 0.824 -1.429 1.00 . A X . 23 VAL C 1 1
9 4642 1 1 23 VAL CA C 16.617 0.528 -0.807 1.00 . A X . 23 VAL CA 1 1
9 4643 1 1 23 VAL CB C 16.991 1.650 0.162 1.00 . A X . 23 VAL CB 1 1
9 4644 1 1 23 VAL CG1 C 15.892 1.801 1.217 1.00 . A X . 23 VAL CG1 1 1
9 4645 1 1 23 VAL CG2 C 18.313 1.307 0.852 1.00 . A X . 23 VAL CG2 1 1
9 4646 1 1 23 VAL H H 18.436 0.969 -1.802 1.00 . A X . 23 VAL H 1 1
9 4647 1 1 23 VAL HA H 16.556 -0.397 -0.256 1.00 . A X . 23 VAL HA 1 1
9 4648 1 1 23 VAL HB H 17.096 2.575 -0.382 1.00 . A X . 23 VAL HB 1 1
9 4649 1 1 23 VAL HG11 H 15.169 2.530 0.881 1.00 . A X . 23 VAL HG11 1 1
9 4650 1 1 23 VAL HG12 H 16.330 2.131 2.147 1.00 . A X . 23 VAL HG12 1 1
9 4651 1 1 23 VAL HG13 H 15.403 0.850 1.366 1.00 . A X . 23 VAL HG13 1 1
9 4652 1 1 23 VAL HG21 H 19.009 2.123 0.722 1.00 . A X . 23 VAL HG21 1 1
9 4653 1 1 23 VAL HG22 H 18.724 0.409 0.415 1.00 . A X . 23 VAL HG22 1 1
9 4654 1 1 23 VAL HG23 H 18.139 1.147 1.905 1.00 . A X . 23 VAL HG23 1 1
9 4655 1 1 23 VAL N N 17.643 0.395 -1.835 1.00 . A X . 23 VAL N 1 1
9 4656 1 1 23 VAL O O 14.261 0.981 -0.718 1.00 . A X . 23 VAL O 1 1
9 4657 1 1 24 GLN C C 13.185 -0.096 -3.711 1.00 . A X . 24 GLN C 1 1
9 4658 1 1 24 GLN CA C 13.963 1.189 -3.451 1.00 . A X . 24 GLN CA 1 1
9 4659 1 1 24 GLN CB C 14.270 1.906 -4.773 1.00 . A X . 24 GLN CB 1 1
9 4660 1 1 24 GLN CD C 13.221 0.453 -6.536 1.00 . A X . 24 GLN CD 1 1
9 4661 1 1 24 GLN CG C 13.097 1.756 -5.746 1.00 . A X . 24 GLN CG 1 1
9 4662 1 1 24 GLN H H 16.026 0.777 -3.275 1.00 . A X . 24 GLN H 1 1
9 4663 1 1 24 GLN HA H 13.362 1.835 -2.833 1.00 . A X . 24 GLN HA 1 1
9 4664 1 1 24 GLN HB2 H 14.437 2.956 -4.576 1.00 . A X . 24 GLN HB2 1 1
9 4665 1 1 24 GLN HB3 H 15.159 1.479 -5.215 1.00 . A X . 24 GLN HB3 1 1
9 4666 1 1 24 GLN HE21 H 14.693 -0.273 -5.412 1.00 . A X . 24 GLN HE21 1 1
9 4667 1 1 24 GLN HE22 H 14.190 -1.275 -6.686 1.00 . A X . 24 GLN HE22 1 1
9 4668 1 1 24 GLN HG2 H 12.169 1.758 -5.196 1.00 . A X . 24 GLN HG2 1 1
9 4669 1 1 24 GLN HG3 H 13.102 2.588 -6.435 1.00 . A X . 24 GLN HG3 1 1
9 4670 1 1 24 GLN N N 15.209 0.905 -2.755 1.00 . A X . 24 GLN N 1 1
9 4671 1 1 24 GLN NE2 N 14.108 -0.439 -6.182 1.00 . A X . 24 GLN NE2 1 1
9 4672 1 1 24 GLN O O 11.954 -0.083 -3.757 1.00 . A X . 24 GLN O 1 1
9 4673 1 1 24 GLN OE1 O 12.489 0.243 -7.502 1.00 . A X . 24 GLN OE1 1 1
9 4674 1 1 25 TRP C C 13.196 -3.261 -2.794 1.00 . A X . 25 TRP C 1 1
9 4675 1 1 25 TRP CA C 13.233 -2.481 -4.089 1.00 . A X . 25 TRP CA 1 1
9 4676 1 1 25 TRP CB C 13.986 -3.305 -5.114 1.00 . A X . 25 TRP CB 1 1
9 4677 1 1 25 TRP CD1 C 13.268 -5.679 -4.733 1.00 . A X . 25 TRP CD1 1 1
9 4678 1 1 25 TRP CD2 C 15.167 -5.162 -3.669 1.00 . A X . 25 TRP CD2 1 1
9 4679 1 1 25 TRP CE2 C 14.906 -6.513 -3.366 1.00 . A X . 25 TRP CE2 1 1
9 4680 1 1 25 TRP CE3 C 16.303 -4.566 -3.128 1.00 . A X . 25 TRP CE3 1 1
9 4681 1 1 25 TRP CG C 14.131 -4.668 -4.546 1.00 . A X . 25 TRP CG 1 1
9 4682 1 1 25 TRP CH2 C 16.898 -6.628 -2.007 1.00 . A X . 25 TRP CH2 1 1
9 4683 1 1 25 TRP CZ2 C 15.763 -7.248 -2.540 1.00 . A X . 25 TRP CZ2 1 1
9 4684 1 1 25 TRP CZ3 C 17.162 -5.285 -2.304 1.00 . A X . 25 TRP CZ3 1 1
9 4685 1 1 25 TRP H H 14.880 -1.179 -3.794 1.00 . A X . 25 TRP H 1 1
9 4686 1 1 25 TRP HA H 12.227 -2.323 -4.440 1.00 . A X . 25 TRP HA 1 1
9 4687 1 1 25 TRP HB2 H 13.424 -3.345 -6.037 1.00 . A X . 25 TRP HB2 1 1
9 4688 1 1 25 TRP HB3 H 14.961 -2.875 -5.289 1.00 . A X . 25 TRP HB3 1 1
9 4689 1 1 25 TRP HD1 H 12.369 -5.624 -5.329 1.00 . A X . 25 TRP HD1 1 1
9 4690 1 1 25 TRP HE1 H 13.292 -7.668 -4.020 1.00 . A X . 25 TRP HE1 1 1
9 4691 1 1 25 TRP HE3 H 16.507 -3.537 -3.334 1.00 . A X . 25 TRP HE3 1 1
9 4692 1 1 25 TRP HH2 H 17.568 -7.184 -1.367 1.00 . A X . 25 TRP HH2 1 1
9 4693 1 1 25 TRP HZ2 H 15.551 -8.278 -2.307 1.00 . A X . 25 TRP HZ2 1 1
9 4694 1 1 25 TRP HZ3 H 18.031 -4.798 -1.896 1.00 . A X . 25 TRP HZ3 1 1
9 4695 1 1 25 TRP N N 13.896 -1.208 -3.859 1.00 . A X . 25 TRP N 1 1
9 4696 1 1 25 TRP NE1 N 13.729 -6.791 -4.041 1.00 . A X . 25 TRP NE1 1 1
9 4697 1 1 25 TRP O O 12.231 -3.966 -2.501 1.00 . A X . 25 TRP O 1 1
9 4698 1 1 26 LEU C C 13.100 -3.573 0.066 1.00 . A X . 26 LEU C 1 1
9 4699 1 1 26 LEU CA C 14.352 -3.839 -0.763 1.00 . A X . 26 LEU CA 1 1
9 4700 1 1 26 LEU CB C 15.592 -3.393 0.020 1.00 . A X . 26 LEU CB 1 1
9 4701 1 1 26 LEU CD1 C 16.480 -5.614 0.861 1.00 . A X . 26 LEU CD1 1 1
9 4702 1 1 26 LEU CD2 C 16.675 -3.558 2.268 1.00 . A X . 26 LEU CD2 1 1
9 4703 1 1 26 LEU CG C 15.797 -4.294 1.254 1.00 . A X . 26 LEU CG 1 1
9 4704 1 1 26 LEU H H 15.008 -2.565 -2.312 1.00 . A X . 26 LEU H 1 1
9 4705 1 1 26 LEU HA H 14.433 -4.890 -0.976 1.00 . A X . 26 LEU HA 1 1
9 4706 1 1 26 LEU HB2 H 16.460 -3.449 -0.619 1.00 . A X . 26 LEU HB2 1 1
9 4707 1 1 26 LEU HB3 H 15.456 -2.373 0.344 1.00 . A X . 26 LEU HB3 1 1
9 4708 1 1 26 LEU HD11 H 15.796 -6.228 0.292 1.00 . A X . 26 LEU HD11 1 1
9 4709 1 1 26 LEU HD12 H 16.772 -6.142 1.757 1.00 . A X . 26 LEU HD12 1 1
9 4710 1 1 26 LEU HD13 H 17.357 -5.404 0.270 1.00 . A X . 26 LEU HD13 1 1
9 4711 1 1 26 LEU HD21 H 17.631 -3.334 1.821 1.00 . A X . 26 LEU HD21 1 1
9 4712 1 1 26 LEU HD22 H 16.822 -4.183 3.137 1.00 . A X . 26 LEU HD22 1 1
9 4713 1 1 26 LEU HD23 H 16.190 -2.639 2.563 1.00 . A X . 26 LEU HD23 1 1
9 4714 1 1 26 LEU HG H 14.841 -4.513 1.706 1.00 . A X . 26 LEU HG 1 1
9 4715 1 1 26 LEU N N 14.266 -3.135 -2.023 1.00 . A X . 26 LEU N 1 1
9 4716 1 1 26 LEU O O 12.654 -4.431 0.828 1.00 . A X . 26 LEU O 1 1
9 4717 1 1 27 MET C C 10.093 -2.135 -0.189 1.00 . A X . 27 MET C 1 1
9 4718 1 1 27 MET CA C 11.347 -2.000 0.671 1.00 . A X . 27 MET CA 1 1
9 4719 1 1 27 MET CB C 11.474 -0.558 1.167 1.00 . A X . 27 MET CB 1 1
9 4720 1 1 27 MET CE C 9.911 2.135 -1.528 1.00 . A X . 27 MET CE 1 1
9 4721 1 1 27 MET CG C 11.356 0.402 -0.018 1.00 . A X . 27 MET CG 1 1
9 4722 1 1 27 MET H H 12.946 -1.720 -0.698 1.00 . A X . 27 MET H 1 1
9 4723 1 1 27 MET HA H 11.255 -2.653 1.525 1.00 . A X . 27 MET HA 1 1
9 4724 1 1 27 MET HB2 H 10.687 -0.353 1.880 1.00 . A X . 27 MET HB2 1 1
9 4725 1 1 27 MET HB3 H 12.436 -0.425 1.642 1.00 . A X . 27 MET HB3 1 1
9 4726 1 1 27 MET HE1 H 10.884 1.950 -1.959 1.00 . A X . 27 MET HE1 1 1
9 4727 1 1 27 MET HE2 H 9.852 3.162 -1.206 1.00 . A X . 27 MET HE2 1 1
9 4728 1 1 27 MET HE3 H 9.142 1.947 -2.264 1.00 . A X . 27 MET HE3 1 1
9 4729 1 1 27 MET HG2 H 12.045 1.225 0.114 1.00 . A X . 27 MET HG2 1 1
9 4730 1 1 27 MET HG3 H 11.591 -0.125 -0.932 1.00 . A X . 27 MET HG3 1 1
9 4731 1 1 27 MET N N 12.541 -2.370 -0.080 1.00 . A X . 27 MET N 1 1
9 4732 1 1 27 MET O O 9.008 -1.713 0.213 1.00 . A X . 27 MET O 1 1
9 4733 1 1 27 MET SD S 9.665 1.042 -0.107 1.00 . A X . 27 MET SD 1 1
9 4734 1 1 28 ASN C C 8.418 -4.238 -1.993 1.00 . A X . 28 ASN C 1 1
9 4735 1 1 28 ASN CA C 9.110 -2.908 -2.268 1.00 . A X . 28 ASN CA 1 1
9 4736 1 1 28 ASN CB C 9.579 -2.866 -3.723 1.00 . A X . 28 ASN CB 1 1
9 4737 1 1 28 ASN CG C 8.408 -3.162 -4.655 1.00 . A X . 28 ASN CG 1 1
9 4738 1 1 28 ASN H H 11.131 -3.043 -1.639 1.00 . A X . 28 ASN H 1 1
9 4739 1 1 28 ASN HA H 8.403 -2.106 -2.107 1.00 . A X . 28 ASN HA 1 1
9 4740 1 1 28 ASN HB2 H 9.975 -1.886 -3.944 1.00 . A X . 28 ASN HB2 1 1
9 4741 1 1 28 ASN HB3 H 10.349 -3.607 -3.873 1.00 . A X . 28 ASN HB3 1 1
9 4742 1 1 28 ASN HD21 H 9.332 -4.658 -5.578 1.00 . A X . 28 ASN HD21 1 1
9 4743 1 1 28 ASN HD22 H 7.762 -4.325 -6.129 1.00 . A X . 28 ASN HD22 1 1
9 4744 1 1 28 ASN N N 10.245 -2.724 -1.369 1.00 . A X . 28 ASN N 1 1
9 4745 1 1 28 ASN ND2 N 8.510 -4.127 -5.527 1.00 . A X . 28 ASN ND2 1 1
9 4746 1 1 28 ASN O O 7.231 -4.276 -1.669 1.00 . A X . 28 ASN O 1 1
9 4747 1 1 28 ASN OD1 O 7.375 -2.497 -4.585 1.00 . A X . 28 ASN OD1 1 1
9 4748 1 1 29 THR C C 9.027 -7.173 -0.515 1.00 . A X . 29 THR C 1 1
9 4749 1 1 29 THR CA C 8.614 -6.657 -1.890 1.00 . A X . 29 THR CA 1 1
9 4750 1 1 29 THR CB C 9.102 -7.626 -2.970 1.00 . A X . 29 THR CB 1 1
9 4751 1 1 29 THR CG2 C 10.195 -6.957 -3.804 1.00 . A X . 29 THR CG2 1 1
9 4752 1 1 29 THR H H 10.107 -5.237 -2.388 1.00 . A X . 29 THR H 1 1
9 4753 1 1 29 THR HA H 7.536 -6.601 -1.934 1.00 . A X . 29 THR HA 1 1
9 4754 1 1 29 THR HB H 8.278 -7.896 -3.612 1.00 . A X . 29 THR HB 1 1
9 4755 1 1 29 THR HG1 H 10.102 -9.295 -3.017 1.00 . A X . 29 THR HG1 1 1
9 4756 1 1 29 THR HG21 H 10.587 -7.664 -4.519 1.00 . A X . 29 THR HG21 1 1
9 4757 1 1 29 THR HG22 H 10.990 -6.622 -3.154 1.00 . A X . 29 THR HG22 1 1
9 4758 1 1 29 THR HG23 H 9.777 -6.108 -4.327 1.00 . A X . 29 THR HG23 1 1
9 4759 1 1 29 THR N N 9.167 -5.328 -2.127 1.00 . A X . 29 THR N 1 1
9 4760 1 1 29 THR O O 8.334 -8.000 0.076 1.00 . A X . 29 THR O 1 1
9 4761 1 1 29 THR OG1 O 9.623 -8.794 -2.352 1.00 . A X . 29 THR OG1 1 1
9 4762 1 1 30 NH2 HN1 H 10.676 -6.070 -0.439 1.00 . A X . 30 NH2 HN1 1 1
9 4763 1 1 30 NH2 HN2 H 10.398 -7.057 0.915 1.00 . A X . 30 NH2 HN2 1 1
9 4764 1 1 30 NH2 N N 10.125 -6.730 0.032 1.00 . A X . 30 NH2 N 1 1
9 4765 2 2 1 . C C 33.124 11.032 -9.456 1.00 . B X . 101 GGL C 1 1
9 4766 2 2 1 . CA C 31.671 11.092 -8.996 1.00 . B X . 101 GGL CA 1 1
9 4767 2 2 1 . CB C 30.900 9.906 -9.578 1.00 . B X . 101 GGL CB 1 1
9 4768 2 2 1 . CD C 30.180 7.545 -9.168 1.00 . B X . 101 GGL CD 1 1
9 4769 2 2 1 . CG C 30.905 8.748 -8.577 1.00 . B X . 101 GGL CG 1 1
9 4770 2 2 1 . H H 31.486 12.888 -10.106 1.00 . B X . 101 GGL H 1 1
9 4771 2 2 1 . HA H 31.642 11.032 -7.918 1.00 . B X . 101 GGL HA 1 1
9 4772 2 2 1 . HB2 H 31.371 9.585 -10.495 1.00 . B X . 101 GGL HB2 1 1
9 4773 2 2 1 . HB3 H 29.881 10.202 -9.780 1.00 . B X . 101 GGL HB3 1 1
9 4774 2 2 1 . HG2 H 31.924 8.476 -8.348 1.00 . B X . 101 GGL HG2 1 1
9 4775 2 2 1 . HG3 H 30.405 9.057 -7.670 1.00 . B X . 101 GGL HG3 1 1
9 4776 2 2 1 . N N 31.051 12.343 -9.416 1.00 . B X . 101 GGL N 1 1
9 4777 2 2 1 . O O 33.671 9.942 -9.484 1.00 . B X . 101 GGL O 1 1
9 4778 2 2 1 . OE1 O 30.642 6.947 -10.140 1.00 . B X . 101 GGL OE1 1 1
9 4779 2 2 1 . OXT O 33.657 12.073 -9.802 1.00 . B X . 101 GGL OXT 1 1
9 4780 3 2 1 . C C 27.688 11.575 -10.155 1.00 . C X . 102 GGL C 1 1
9 4781 3 2 1 . CA C 28.449 12.452 -11.149 1.00 . C X . 102 GGL CA 1 1
9 4782 3 2 1 . CB C 28.478 13.909 -10.655 1.00 . C X . 102 GGL CB 1 1
9 4783 3 2 1 . CD C 29.910 12.761 -8.880 1.00 . C X . 102 GGL CD 1 1
9 4784 3 2 1 . CG C 29.366 14.088 -9.401 1.00 . C X . 102 GGL CG 1 1
9 4785 3 2 1 . H H 26.928 12.821 -12.579 1.00 . C X . 102 GGL H 1 1
9 4786 3 2 1 . HA H 29.459 12.087 -11.255 1.00 . C X . 102 GGL HA 1 1
9 4787 3 2 1 . HB2 H 28.860 14.539 -11.444 1.00 . C X . 102 GGL HB2 1 1
9 4788 3 2 1 . HB3 H 27.470 14.218 -10.418 1.00 . C X . 102 GGL HB3 1 1
9 4789 3 2 1 . HG2 H 30.195 14.735 -9.649 1.00 . C X . 102 GGL HG2 1 1
9 4790 3 2 1 . HG3 H 28.780 14.554 -8.624 1.00 . C X . 102 GGL HG3 1 1
9 4791 3 2 1 . N N 27.803 12.396 -12.455 1.00 . C X . 102 GGL N 1 1
9 4792 3 2 1 . O O 27.485 10.410 -10.458 1.00 . C X . 102 GGL O 1 1
9 4793 3 2 1 . OE1 O 29.340 12.161 -7.967 1.00 . C X . 102 GGL OE1 1 1
9 4794 3 2 1 . OXT O 27.275 12.095 -9.132 1.00 . C X . 102 GGL OXT 1 1
9 4795 4 3 1 PLM C1 C 28.378 11.776 -13.481 1.00 . D X . 103 PLM C1 1 1
9 4796 4 3 1 PLM C2 C 27.605 10.606 -14.079 1.00 . D X . 103 PLM C2 1 1
9 4797 4 3 1 PLM C3 C 28.548 9.425 -14.319 1.00 . D X . 103 PLM C3 1 1
9 4798 4 3 1 PLM C4 C 29.086 8.919 -12.979 1.00 . D X . 103 PLM C4 1 1
9 4799 4 3 1 PLM C5 C 29.706 7.533 -13.168 1.00 . D X . 103 PLM C5 1 1
9 4800 4 3 1 PLM C6 C 28.635 6.462 -12.952 1.00 . D X . 103 PLM C6 1 1
9 4801 4 3 1 PLM C7 C 29.036 5.182 -13.687 1.00 . D X . 103 PLM C7 1 1
9 4802 4 3 1 PLM C8 C 30.385 4.690 -13.162 1.00 . D X . 103 PLM C8 1 1
9 4803 4 3 1 PLM C9 C 30.414 3.160 -13.182 1.00 . D X . 103 PLM C9 1 1
9 4804 4 3 1 PLM CA C 29.706 2.615 -11.939 1.00 . D X . 103 PLM CA 1 1
9 4805 4 3 1 PLM CB C 30.743 2.289 -10.863 1.00 . D X . 103 PLM CB 1 1
9 4806 4 3 1 PLM CC C 30.035 2.022 -9.534 1.00 . D X . 103 PLM CC 1 1
9 4807 4 3 1 PLM CD C 29.878 3.335 -8.762 1.00 . D X . 103 PLM CD 1 1
9 4808 4 3 1 PLM CE C 28.655 3.247 -7.842 1.00 . D X . 103 PLM CE 1 1
9 4809 4 3 1 PLM CF C 27.370 3.467 -8.650 1.00 . D X . 103 PLM CF 1 1
9 4810 4 3 1 PLM CG C 26.345 2.394 -8.275 1.00 . D X . 103 PLM CG 1 1
9 4811 4 3 1 PLM H21 H 26.822 10.307 -13.397 1.00 . D X . 103 PLM H21 1 1
9 4812 4 3 1 PLM H22 H 27.165 10.910 -15.017 1.00 . D X . 103 PLM H22 1 1
9 4813 4 3 1 PLM H31 H 28.008 8.629 -14.814 1.00 . D X . 103 PLM H31 1 1
9 4814 4 3 1 PLM H32 H 29.371 9.742 -14.942 1.00 . D X . 103 PLM H32 1 1
9 4815 4 3 1 PLM H41 H 28.278 8.858 -12.265 1.00 . D X . 103 PLM H41 1 1
9 4816 4 3 1 PLM H42 H 29.839 9.604 -12.614 1.00 . D X . 103 PLM H42 1 1
9 4817 4 3 1 PLM H51 H 30.101 7.448 -14.170 1.00 . D X . 103 PLM H51 1 1
9 4818 4 3 1 PLM H52 H 30.503 7.394 -12.453 1.00 . D X . 103 PLM H52 1 1
9 4819 4 3 1 PLM H61 H 27.689 6.816 -13.334 1.00 . D X . 103 PLM H61 1 1
9 4820 4 3 1 PLM H62 H 28.540 6.255 -11.895 1.00 . D X . 103 PLM H62 1 1
9 4821 4 3 1 PLM H71 H 28.287 4.421 -13.521 1.00 . D X . 103 PLM H71 1 1
9 4822 4 3 1 PLM H72 H 29.115 5.386 -14.746 1.00 . D X . 103 PLM H72 1 1
9 4823 4 3 1 PLM H81 H 30.531 5.040 -12.151 1.00 . D X . 103 PLM H81 1 1
9 4824 4 3 1 PLM H82 H 31.177 5.072 -13.791 1.00 . D X . 103 PLM H82 1 1
9 4825 4 3 1 PLM H91 H 29.911 2.802 -14.068 1.00 . D X . 103 PLM H91 1 1
9 4826 4 3 1 PLM H92 H 31.440 2.819 -13.189 1.00 . D X . 103 PLM H92 1 1
9 4827 4 3 1 PLM HA1 H 29.017 3.357 -11.563 1.00 . D X . 103 PLM HA1 1 1
9 4828 4 3 1 PLM HA2 H 29.164 1.719 -12.198 1.00 . D X . 103 PLM HA2 1 1
9 4829 4 3 1 PLM HB1 H 31.419 3.125 -10.749 1.00 . D X . 103 PLM HB1 1 1
9 4830 4 3 1 PLM HB2 H 31.302 1.413 -11.155 1.00 . D X . 103 PLM HB2 1 1
9 4831 4 3 1 PLM HC1 H 29.061 1.595 -9.723 1.00 . D X . 103 PLM HC1 1 1
9 4832 4 3 1 PLM HC2 H 30.621 1.329 -8.947 1.00 . D X . 103 PLM HC2 1 1
9 4833 4 3 1 PLM HD1 H 30.762 3.507 -8.165 1.00 . D X . 103 PLM HD1 1 1
9 4834 4 3 1 PLM HD2 H 29.754 4.152 -9.457 1.00 . D X . 103 PLM HD2 1 1
9 4835 4 3 1 PLM HE1 H 28.729 4.006 -7.076 1.00 . D X . 103 PLM HE1 1 1
9 4836 4 3 1 PLM HE2 H 28.624 2.272 -7.379 1.00 . D X . 103 PLM HE2 1 1
9 4837 4 3 1 PLM HF1 H 26.966 4.444 -8.424 1.00 . D X . 103 PLM HF1 1 1
9 4838 4 3 1 PLM HF2 H 27.584 3.402 -9.704 1.00 . D X . 103 PLM HF2 1 1
9 4839 4 3 1 PLM HG1 H 25.378 2.667 -8.670 1.00 . D X . 103 PLM HG1 1 1
9 4840 4 3 1 PLM HG2 H 26.649 1.444 -8.689 1.00 . D X . 103 PLM HG2 1 1
9 4841 4 3 1 PLM HG3 H 26.284 2.316 -7.199 1.00 . D X . 103 PLM HG3 1 1
9 4842 4 3 1 PLM O2 O 29.451 12.135 -13.964 1.00 . D X . 103 PLM O2 1 1
10 4843 1 1 1 HIS C C 38.789 2.734 3.435 1.00 . A X . 1 HIS C 1 1
10 4844 1 1 1 HIS CA C 38.645 1.239 3.172 1.00 . A X . 1 HIS CA 1 1
10 4845 1 1 1 HIS CB C 39.820 0.742 2.327 1.00 . A X . 1 HIS CB 1 1
10 4846 1 1 1 HIS CD2 C 41.660 -0.011 4.046 1.00 . A X . 1 HIS CD2 1 1
10 4847 1 1 1 HIS CE1 C 41.371 -2.154 3.898 1.00 . A X . 1 HIS CE1 1 1
10 4848 1 1 1 HIS CG C 40.651 -0.215 3.136 1.00 . A X . 1 HIS CG 1 1
10 4849 1 1 1 HIS H1 H 37.550 0.352 1.640 1.00 . A X . 1 HIS H1 1 1
10 4850 1 1 1 HIS H2 H 36.984 1.887 2.098 1.00 . A X . 1 HIS H2 1 1
10 4851 1 1 1 HIS H3 H 36.686 0.539 3.088 1.00 . A X . 1 HIS H3 1 1
10 4852 1 1 1 HIS HA H 38.632 0.710 4.114 1.00 . A X . 1 HIS HA 1 1
10 4853 1 1 1 HIS HB2 H 39.442 0.236 1.447 1.00 . A X . 1 HIS HB2 1 1
10 4854 1 1 1 HIS HB3 H 40.429 1.583 2.028 1.00 . A X . 1 HIS HB3 1 1
10 4855 1 1 1 HIS HD2 H 42.043 0.954 4.344 1.00 . A X . 1 HIS HD2 1 1
10 4856 1 1 1 HIS HE1 H 41.471 -3.219 4.046 1.00 . A X . 1 HIS HE1 1 1
10 4857 1 1 1 HIS HE2 H 42.823 -1.394 5.181 1.00 . A X . 1 HIS HE2 1 1
10 4858 1 1 1 HIS N N 37.370 0.985 2.444 1.00 . A X . 1 HIS N 1 1
10 4859 1 1 1 HIS ND1 N 40.484 -1.589 3.058 1.00 . A X . 1 HIS ND1 1 1
10 4860 1 1 1 HIS NE2 N 42.112 -1.237 4.525 1.00 . A X . 1 HIS NE2 1 1
10 4861 1 1 1 HIS O O 37.962 3.532 2.997 1.00 . A X . 1 HIS O 1 1
10 4862 1 1 2 ABA C C 38.883 5.119 5.171 1.00 . A X . 2 AIB C 1 1
10 4863 1 1 2 ABA CA C 40.093 4.507 4.470 1.00 . A X . 2 AIB CA 1 1
10 4864 1 1 2 ABA H H 40.470 2.422 4.473 1.00 . A X . 2 AIB H 1 1
10 4865 1 1 2 ABA N N 39.845 3.105 4.152 1.00 . A X . 2 AIB N 1 1
10 4866 1 1 2 ABA O O 38.561 6.290 4.970 1.00 . A X . 2 AIB O 1 1
10 4867 1 1 3 GLN C C 37.336 6.206 7.290 1.00 . A X . 3 GLN C 1 1
10 4868 1 1 3 GLN CA C 37.052 4.818 6.729 1.00 . A X . 3 GLN CA 1 1
10 4869 1 1 3 GLN CB C 36.698 3.866 7.873 1.00 . A X . 3 GLN CB 1 1
10 4870 1 1 3 GLN CD C 37.622 4.428 10.129 1.00 . A X . 3 GLN CD 1 1
10 4871 1 1 3 GLN CG C 37.900 3.719 8.808 1.00 . A X . 3 GLN CG 1 1
10 4872 1 1 3 GLN H H 38.515 3.401 6.135 1.00 . A X . 3 GLN H 1 1
10 4873 1 1 3 GLN HA H 36.213 4.877 6.051 1.00 . A X . 3 GLN HA 1 1
10 4874 1 1 3 GLN HB2 H 35.859 4.265 8.424 1.00 . A X . 3 GLN HB2 1 1
10 4875 1 1 3 GLN HB3 H 36.438 2.899 7.468 1.00 . A X . 3 GLN HB3 1 1
10 4876 1 1 3 GLN HE21 H 38.272 2.919 11.244 1.00 . A X . 3 GLN HE21 1 1
10 4877 1 1 3 GLN HE22 H 37.717 4.271 12.106 1.00 . A X . 3 GLN HE22 1 1
10 4878 1 1 3 GLN HG2 H 38.082 2.669 8.995 1.00 . A X . 3 GLN HG2 1 1
10 4879 1 1 3 GLN HG3 H 38.772 4.159 8.344 1.00 . A X . 3 GLN HG3 1 1
10 4880 1 1 3 GLN N N 38.216 4.326 6.004 1.00 . A X . 3 GLN N 1 1
10 4881 1 1 3 GLN NE2 N 37.893 3.822 11.253 1.00 . A X . 3 GLN NE2 1 1
10 4882 1 1 3 GLN O O 36.417 6.971 7.584 1.00 . A X . 3 GLN O 1 1
10 4883 1 1 3 GLN OE1 O 37.145 5.562 10.137 1.00 . A X . 3 GLN OE1 1 1
10 4884 1 1 4 GLY C C 39.165 8.837 6.832 1.00 . A X . 4 GLY C 1 1
10 4885 1 1 4 GLY CA C 39.025 7.821 7.957 1.00 . A X . 4 GLY CA 1 1
10 4886 1 1 4 GLY H H 39.306 5.871 7.180 1.00 . A X . 4 GLY H 1 1
10 4887 1 1 4 GLY HA2 H 38.284 8.168 8.663 1.00 . A X . 4 GLY HA2 1 1
10 4888 1 1 4 GLY HA3 H 39.977 7.719 8.459 1.00 . A X . 4 GLY HA3 1 1
10 4889 1 1 4 GLY N N 38.619 6.523 7.434 1.00 . A X . 4 GLY N 1 1
10 4890 1 1 4 GLY O O 38.886 10.022 7.016 1.00 . A X . 4 GLY O 1 1
10 4891 1 1 5 THR C C 38.754 8.923 3.434 1.00 . A X . 5 THR C 1 1
10 4892 1 1 5 THR CA C 39.784 9.236 4.514 1.00 . A X . 5 THR CA 1 1
10 4893 1 1 5 THR CB C 41.196 9.069 3.951 1.00 . A X . 5 THR CB 1 1
10 4894 1 1 5 THR CG2 C 42.038 8.248 4.928 1.00 . A X . 5 THR CG2 1 1
10 4895 1 1 5 THR H H 39.812 7.409 5.586 1.00 . A X . 5 THR H 1 1
10 4896 1 1 5 THR HA H 39.657 10.257 4.826 1.00 . A X . 5 THR HA 1 1
10 4897 1 1 5 THR HB H 41.649 10.040 3.821 1.00 . A X . 5 THR HB 1 1
10 4898 1 1 5 THR HG1 H 41.601 8.941 2.053 1.00 . A X . 5 THR HG1 1 1
10 4899 1 1 5 THR HG21 H 41.981 8.691 5.912 1.00 . A X . 5 THR HG21 1 1
10 4900 1 1 5 THR HG22 H 43.066 8.237 4.598 1.00 . A X . 5 THR HG22 1 1
10 4901 1 1 5 THR HG23 H 41.661 7.239 4.968 1.00 . A X . 5 THR HG23 1 1
10 4902 1 1 5 THR N N 39.604 8.363 5.668 1.00 . A X . 5 THR N 1 1
10 4903 1 1 5 THR O O 38.955 9.235 2.260 1.00 . A X . 5 THR O 1 1
10 4904 1 1 5 THR OG1 O 41.133 8.404 2.697 1.00 . A X . 5 THR OG1 1 1
10 4905 1 1 6 PHE C C 35.664 9.175 2.697 1.00 . A X . 6 PHE C 1 1
10 4906 1 1 6 PHE CA C 36.583 7.974 2.898 1.00 . A X . 6 PHE CA 1 1
10 4907 1 1 6 PHE CB C 35.764 6.792 3.429 1.00 . A X . 6 PHE CB 1 1
10 4908 1 1 6 PHE CD1 C 35.014 6.359 1.049 1.00 . A X . 6 PHE CD1 1 1
10 4909 1 1 6 PHE CD2 C 35.440 4.469 2.508 1.00 . A X . 6 PHE CD2 1 1
10 4910 1 1 6 PHE CE1 C 34.675 5.480 0.013 1.00 . A X . 6 PHE CE1 1 1
10 4911 1 1 6 PHE CE2 C 35.101 3.592 1.471 1.00 . A X . 6 PHE CE2 1 1
10 4912 1 1 6 PHE CG C 35.398 5.853 2.299 1.00 . A X . 6 PHE CG 1 1
10 4913 1 1 6 PHE CZ C 34.720 4.097 0.223 1.00 . A X . 6 PHE CZ 1 1
10 4914 1 1 6 PHE H H 37.534 8.095 4.789 1.00 . A X . 6 PHE H 1 1
10 4915 1 1 6 PHE HA H 37.030 7.705 1.953 1.00 . A X . 6 PHE HA 1 1
10 4916 1 1 6 PHE HB2 H 36.347 6.257 4.163 1.00 . A X . 6 PHE HB2 1 1
10 4917 1 1 6 PHE HB3 H 34.860 7.162 3.891 1.00 . A X . 6 PHE HB3 1 1
10 4918 1 1 6 PHE HD1 H 34.977 7.424 0.885 1.00 . A X . 6 PHE HD1 1 1
10 4919 1 1 6 PHE HD2 H 35.733 4.077 3.471 1.00 . A X . 6 PHE HD2 1 1
10 4920 1 1 6 PHE HE1 H 34.380 5.870 -0.951 1.00 . A X . 6 PHE HE1 1 1
10 4921 1 1 6 PHE HE2 H 35.135 2.525 1.634 1.00 . A X . 6 PHE HE2 1 1
10 4922 1 1 6 PHE HZ H 34.457 3.420 -0.577 1.00 . A X . 6 PHE HZ 1 1
10 4923 1 1 6 PHE N N 37.643 8.314 3.840 1.00 . A X . 6 PHE N 1 1
10 4924 1 1 6 PHE O O 35.440 9.621 1.572 1.00 . A X . 6 PHE O 1 1
10 4925 1 1 7 THR C C 34.783 11.898 2.793 1.00 . A X . 7 THR C 1 1
10 4926 1 1 7 THR CA C 34.244 10.841 3.753 1.00 . A X . 7 THR CA 1 1
10 4927 1 1 7 THR CB C 34.094 11.442 5.152 1.00 . A X . 7 THR CB 1 1
10 4928 1 1 7 THR CG2 C 34.429 10.381 6.203 1.00 . A X . 7 THR CG2 1 1
10 4929 1 1 7 THR H H 35.357 9.292 4.671 1.00 . A X . 7 THR H 1 1
10 4930 1 1 7 THR HA H 33.274 10.516 3.408 1.00 . A X . 7 THR HA 1 1
10 4931 1 1 7 THR HB H 33.077 11.775 5.295 1.00 . A X . 7 THR HB 1 1
10 4932 1 1 7 THR HG1 H 35.701 12.424 4.670 1.00 . A X . 7 THR HG1 1 1
10 4933 1 1 7 THR HG21 H 34.030 10.683 7.160 1.00 . A X . 7 THR HG21 1 1
10 4934 1 1 7 THR HG22 H 35.501 10.273 6.278 1.00 . A X . 7 THR HG22 1 1
10 4935 1 1 7 THR HG23 H 33.992 9.436 5.913 1.00 . A X . 7 THR HG23 1 1
10 4936 1 1 7 THR N N 35.138 9.692 3.804 1.00 . A X . 7 THR N 1 1
10 4937 1 1 7 THR O O 35.921 11.807 2.332 1.00 . A X . 7 THR O 1 1
10 4938 1 1 7 THR OG1 O 34.979 12.545 5.290 1.00 . A X . 7 THR OG1 1 1
10 4939 1 1 8 SER C C 34.272 13.472 0.139 1.00 . A X . 8 SER C 1 1
10 4940 1 1 8 SER CA C 34.364 13.958 1.582 1.00 . A X . 8 SER CA 1 1
10 4941 1 1 8 SER CB C 35.798 14.393 1.888 1.00 . A X . 8 SER CB 1 1
10 4942 1 1 8 SER H H 33.062 12.915 2.889 1.00 . A X . 8 SER H 1 1
10 4943 1 1 8 SER HA H 33.706 14.804 1.712 1.00 . A X . 8 SER HA 1 1
10 4944 1 1 8 SER HB2 H 36.022 14.198 2.923 1.00 . A X . 8 SER HB2 1 1
10 4945 1 1 8 SER HB3 H 36.483 13.834 1.262 1.00 . A X . 8 SER HB3 1 1
10 4946 1 1 8 SER HG H 35.353 16.253 2.240 1.00 . A X . 8 SER HG 1 1
10 4947 1 1 8 SER N N 33.958 12.896 2.494 1.00 . A X . 8 SER N 1 1
10 4948 1 1 8 SER O O 34.199 14.271 -0.794 1.00 . A X . 8 SER O 1 1
10 4949 1 1 8 SER OG O 35.931 15.785 1.634 1.00 . A X . 8 SER OG 1 1
10 4950 1 1 9 ASP C C 33.174 10.415 -1.349 1.00 . A X . 9 ASP C 1 1
10 4951 1 1 9 ASP CA C 34.184 11.556 -1.354 1.00 . A X . 9 ASP CA 1 1
10 4952 1 1 9 ASP CB C 35.555 11.026 -1.780 1.00 . A X . 9 ASP CB 1 1
10 4953 1 1 9 ASP CG C 36.528 12.184 -1.967 1.00 . A X . 9 ASP CG 1 1
10 4954 1 1 9 ASP H H 34.331 11.572 0.758 1.00 . A X . 9 ASP H 1 1
10 4955 1 1 9 ASP HA H 33.864 12.309 -2.060 1.00 . A X . 9 ASP HA 1 1
10 4956 1 1 9 ASP HB2 H 35.934 10.358 -1.016 1.00 . A X . 9 ASP HB2 1 1
10 4957 1 1 9 ASP HB3 H 35.457 10.487 -2.713 1.00 . A X . 9 ASP HB3 1 1
10 4958 1 1 9 ASP N N 34.273 12.155 -0.028 1.00 . A X . 9 ASP N 1 1
10 4959 1 1 9 ASP O O 32.972 9.742 -2.359 1.00 . A X . 9 ASP O 1 1
10 4960 1 1 9 ASP OD1 O 37.092 12.624 -0.979 1.00 . A X . 9 ASP OD1 1 1
10 4961 1 1 9 ASP OD2 O 36.696 12.614 -3.097 1.00 . A X . 9 ASP OD2 1 1
10 4962 1 1 10 TYR C C 30.384 9.629 0.797 1.00 . A X . 10 TYR C 1 1
10 4963 1 1 10 TYR CA C 31.555 9.145 -0.055 1.00 . A X . 10 TYR CA 1 1
10 4964 1 1 10 TYR CB C 32.203 7.921 0.599 1.00 . A X . 10 TYR CB 1 1
10 4965 1 1 10 TYR CD1 C 30.360 6.288 0.076 1.00 . A X . 10 TYR CD1 1 1
10 4966 1 1 10 TYR CD2 C 30.919 6.703 2.398 1.00 . A X . 10 TYR CD2 1 1
10 4967 1 1 10 TYR CE1 C 29.368 5.385 0.474 1.00 . A X . 10 TYR CE1 1 1
10 4968 1 1 10 TYR CE2 C 29.927 5.800 2.797 1.00 . A X . 10 TYR CE2 1 1
10 4969 1 1 10 TYR CG C 31.135 6.947 1.035 1.00 . A X . 10 TYR CG 1 1
10 4970 1 1 10 TYR CZ C 29.151 5.141 1.836 1.00 . A X . 10 TYR CZ 1 1
10 4971 1 1 10 TYR H H 32.750 10.776 0.573 1.00 . A X . 10 TYR H 1 1
10 4972 1 1 10 TYR HA H 31.189 8.868 -1.033 1.00 . A X . 10 TYR HA 1 1
10 4973 1 1 10 TYR HB2 H 32.858 7.441 -0.113 1.00 . A X . 10 TYR HB2 1 1
10 4974 1 1 10 TYR HB3 H 32.777 8.235 1.458 1.00 . A X . 10 TYR HB3 1 1
10 4975 1 1 10 TYR HD1 H 30.530 6.476 -0.972 1.00 . A X . 10 TYR HD1 1 1
10 4976 1 1 10 TYR HD2 H 31.517 7.212 3.140 1.00 . A X . 10 TYR HD2 1 1
10 4977 1 1 10 TYR HE1 H 28.768 4.878 -0.270 1.00 . A X . 10 TYR HE1 1 1
10 4978 1 1 10 TYR HE2 H 29.762 5.612 3.847 1.00 . A X . 10 TYR HE2 1 1
10 4979 1 1 10 TYR HH H 27.938 4.452 3.139 1.00 . A X . 10 TYR HH 1 1
10 4980 1 1 10 TYR N N 32.544 10.206 -0.198 1.00 . A X . 10 TYR N 1 1
10 4981 1 1 10 TYR O O 30.465 10.676 1.438 1.00 . A X . 10 TYR O 1 1
10 4982 1 1 10 TYR OH O 28.173 4.251 2.230 1.00 . A X . 10 TYR OH 1 1
10 4983 1 1 11 SER C C 27.288 10.264 0.817 1.00 . A X . 11 SER C 1 1
10 4984 1 1 11 SER CA C 28.113 9.224 1.566 1.00 . A X . 11 SER CA 1 1
10 4985 1 1 11 SER CB C 28.521 9.780 2.932 1.00 . A X . 11 SER CB 1 1
10 4986 1 1 11 SER H H 29.288 8.042 0.261 1.00 . A X . 11 SER H 1 1
10 4987 1 1 11 SER HA H 27.510 8.342 1.716 1.00 . A X . 11 SER HA 1 1
10 4988 1 1 11 SER HB2 H 27.772 9.527 3.663 1.00 . A X . 11 SER HB2 1 1
10 4989 1 1 11 SER HB3 H 29.469 9.348 3.227 1.00 . A X . 11 SER HB3 1 1
10 4990 1 1 11 SER HG H 27.764 11.550 2.657 1.00 . A X . 11 SER HG 1 1
10 4991 1 1 11 SER N N 29.296 8.863 0.795 1.00 . A X . 11 SER N 1 1
10 4992 1 1 11 SER O O 26.324 10.809 1.354 1.00 . A X . 11 SER O 1 1
10 4993 1 1 11 SER OG O 28.634 11.194 2.848 1.00 . A X . 11 SER OG 1 1
10 4994 1 1 12 LYS C C 26.574 10.905 -2.590 1.00 . A X . 12 LYS C 1 1
10 4995 1 1 12 LYS CA C 26.978 11.514 -1.250 1.00 . A X . 12 LYS CA 1 1
10 4996 1 1 12 LYS CB C 27.877 12.729 -1.500 1.00 . A X . 12 LYS CB 1 1
10 4997 1 1 12 LYS CD C 27.128 14.471 0.129 1.00 . A X . 12 LYS CD 1 1
10 4998 1 1 12 LYS CE C 27.514 15.796 -0.532 1.00 . A X . 12 LYS CE 1 1
10 4999 1 1 12 LYS CG C 28.199 13.420 -0.173 1.00 . A X . 12 LYS CG 1 1
10 5000 1 1 12 LYS H H 28.458 10.068 -0.796 1.00 . A X . 12 LYS H 1 1
10 5001 1 1 12 LYS HA H 26.089 11.840 -0.732 1.00 . A X . 12 LYS HA 1 1
10 5002 1 1 12 LYS HB2 H 28.795 12.404 -1.969 1.00 . A X . 12 LYS HB2 1 1
10 5003 1 1 12 LYS HB3 H 27.368 13.424 -2.151 1.00 . A X . 12 LYS HB3 1 1
10 5004 1 1 12 LYS HD2 H 26.176 14.138 -0.258 1.00 . A X . 12 LYS HD2 1 1
10 5005 1 1 12 LYS HD3 H 27.054 14.613 1.197 1.00 . A X . 12 LYS HD3 1 1
10 5006 1 1 12 LYS HE2 H 28.218 16.321 0.097 1.00 . A X . 12 LYS HE2 1 1
10 5007 1 1 12 LYS HE3 H 27.965 15.600 -1.495 1.00 . A X . 12 LYS HE3 1 1
10 5008 1 1 12 LYS HG2 H 28.218 12.687 0.619 1.00 . A X . 12 LYS HG2 1 1
10 5009 1 1 12 LYS HG3 H 29.163 13.900 -0.242 1.00 . A X . 12 LYS HG3 1 1
10 5010 1 1 12 LYS HZ1 H 25.837 16.787 0.204 1.00 . A X . 12 LYS HZ1 1 1
10 5011 1 1 12 LYS HZ2 H 25.633 16.143 -1.355 1.00 . A X . 12 LYS HZ2 1 1
10 5012 1 1 12 LYS HZ3 H 26.560 17.548 -1.129 1.00 . A X . 12 LYS HZ3 1 1
10 5013 1 1 12 LYS N N 27.680 10.535 -0.427 1.00 . A X . 12 LYS N 1 1
10 5014 1 1 12 LYS NZ N 26.294 16.631 -0.717 1.00 . A X . 12 LYS NZ 1 1
10 5015 1 1 12 LYS O O 25.557 11.284 -3.171 1.00 . A X . 12 LYS O 1 1
10 5016 1 1 13 LYS C C 26.529 7.917 -4.147 1.00 . A X . 13 LYS C 1 1
10 5017 1 1 13 LYS CA C 27.101 9.319 -4.358 1.00 . A X . 13 LYS CA 1 1
10 5018 1 1 13 LYS CB C 28.387 9.251 -5.191 1.00 . A X . 13 LYS CB 1 1
10 5019 1 1 13 LYS CD C 27.182 9.701 -7.354 1.00 . A X . 13 LYS CD 1 1
10 5020 1 1 13 LYS CE C 27.621 9.776 -8.818 1.00 . A X . 13 LYS CE 1 1
10 5021 1 1 13 LYS CG C 28.080 8.715 -6.597 1.00 . A X . 13 LYS CG 1 1
10 5022 1 1 13 LYS H H 28.180 9.709 -2.573 1.00 . A X . 13 LYS H 1 1
10 5023 1 1 13 LYS HA H 26.372 9.910 -4.890 1.00 . A X . 13 LYS HA 1 1
10 5024 1 1 13 LYS HB2 H 28.818 10.238 -5.267 1.00 . A X . 13 LYS HB2 1 1
10 5025 1 1 13 LYS HB3 H 29.093 8.595 -4.707 1.00 . A X . 13 LYS HB3 1 1
10 5026 1 1 13 LYS HD2 H 26.157 9.364 -7.304 1.00 . A X . 13 LYS HD2 1 1
10 5027 1 1 13 LYS HD3 H 27.259 10.682 -6.910 1.00 . A X . 13 LYS HD3 1 1
10 5028 1 1 13 LYS HE2 H 26.990 10.474 -9.344 1.00 . A X . 13 LYS HE2 1 1
10 5029 1 1 13 LYS HE3 H 28.646 10.117 -8.866 1.00 . A X . 13 LYS HE3 1 1
10 5030 1 1 13 LYS HG2 H 29.006 8.584 -7.139 1.00 . A X . 13 LYS HG2 1 1
10 5031 1 1 13 LYS HG3 H 27.578 7.763 -6.518 1.00 . A X . 13 LYS HG3 1 1
10 5032 1 1 13 LYS HZ1 H 27.514 7.661 -8.889 1.00 . A X . 13 LYS HZ1 1 1
10 5033 1 1 13 LYS N N 27.381 9.966 -3.078 1.00 . A X . 13 LYS N 1 1
10 5034 1 1 13 LYS NZ N 27.515 8.467 -9.448 1.00 . A X . 13 LYS NZ 1 1
10 5035 1 1 13 LYS O O 25.315 7.751 -4.032 1.00 . A X . 13 LYS O 1 1
10 5036 1 1 14 LEU C C 25.841 5.478 -2.883 1.00 . A X . 14 LEU C 1 1
10 5037 1 1 14 LEU CA C 26.956 5.534 -3.917 1.00 . A X . 14 LEU CA 1 1
10 5038 1 1 14 LEU CB C 28.115 4.632 -3.472 1.00 . A X . 14 LEU CB 1 1
10 5039 1 1 14 LEU CD1 C 30.548 4.517 -2.920 1.00 . A X . 14 LEU CD1 1 1
10 5040 1 1 14 LEU CD2 C 29.811 5.696 -4.988 1.00 . A X . 14 LEU CD2 1 1
10 5041 1 1 14 LEU CG C 29.449 5.388 -3.531 1.00 . A X . 14 LEU CG 1 1
10 5042 1 1 14 LEU H H 28.358 7.095 -4.210 1.00 . A X . 14 LEU H 1 1
10 5043 1 1 14 LEU HA H 26.574 5.165 -4.856 1.00 . A X . 14 LEU HA 1 1
10 5044 1 1 14 LEU HB2 H 27.939 4.300 -2.461 1.00 . A X . 14 LEU HB2 1 1
10 5045 1 1 14 LEU HB3 H 28.166 3.774 -4.126 1.00 . A X . 14 LEU HB3 1 1
10 5046 1 1 14 LEU HD11 H 31.446 5.103 -2.798 1.00 . A X . 14 LEU HD11 1 1
10 5047 1 1 14 LEU HD12 H 30.748 3.680 -3.572 1.00 . A X . 14 LEU HD12 1 1
10 5048 1 1 14 LEU HD13 H 30.223 4.151 -1.957 1.00 . A X . 14 LEU HD13 1 1
10 5049 1 1 14 LEU HD21 H 30.450 4.914 -5.371 1.00 . A X . 14 LEU HD21 1 1
10 5050 1 1 14 LEU HD22 H 30.333 6.640 -5.037 1.00 . A X . 14 LEU HD22 1 1
10 5051 1 1 14 LEU HD23 H 28.913 5.750 -5.584 1.00 . A X . 14 LEU HD23 1 1
10 5052 1 1 14 LEU HG H 29.373 6.307 -2.971 1.00 . A X . 14 LEU HG 1 1
10 5053 1 1 14 LEU N N 27.403 6.911 -4.107 1.00 . A X . 14 LEU N 1 1
10 5054 1 1 14 LEU O O 24.856 4.759 -3.056 1.00 . A X . 14 LEU O 1 1
10 5055 1 1 15 ASP C C 23.800 7.134 -1.230 1.00 . A X . 15 ASP C 1 1
10 5056 1 1 15 ASP CA C 24.977 6.283 -0.771 1.00 . A X . 15 ASP CA 1 1
10 5057 1 1 15 ASP CB C 25.561 6.862 0.518 1.00 . A X . 15 ASP CB 1 1
10 5058 1 1 15 ASP CG C 24.699 6.457 1.709 1.00 . A X . 15 ASP CG 1 1
10 5059 1 1 15 ASP H H 26.791 6.810 -1.730 1.00 . A X . 15 ASP H 1 1
10 5060 1 1 15 ASP HA H 24.634 5.276 -0.582 1.00 . A X . 15 ASP HA 1 1
10 5061 1 1 15 ASP HB2 H 26.566 6.484 0.656 1.00 . A X . 15 ASP HB2 1 1
10 5062 1 1 15 ASP HB3 H 25.588 7.941 0.446 1.00 . A X . 15 ASP HB3 1 1
10 5063 1 1 15 ASP N N 25.991 6.249 -1.813 1.00 . A X . 15 ASP N 1 1
10 5064 1 1 15 ASP O O 23.316 7.997 -0.499 1.00 . A X . 15 ASP O 1 1
10 5065 1 1 15 ASP OD1 O 23.494 6.375 1.540 1.00 . A X . 15 ASP OD1 1 1
10 5066 1 1 15 ASP OD2 O 25.257 6.234 2.771 1.00 . A X . 15 ASP OD2 1 1
10 5067 1 1 16 ABA C C 21.986 7.060 -4.451 1.00 . A X . 16 AIB C 1 1
10 5068 1 1 16 ABA CA C 22.241 7.603 -3.052 1.00 . A X . 16 AIB CA 1 1
10 5069 1 1 16 ABA H H 23.799 6.176 -2.981 1.00 . A X . 16 AIB H 1 1
10 5070 1 1 16 ABA N N 23.357 6.876 -2.457 1.00 . A X . 16 AIB N 1 1
10 5071 1 1 16 ABA O O 20.916 7.258 -5.027 1.00 . A X . 16 AIB O 1 1
10 5072 1 1 17 ARG C C 23.029 4.238 -6.159 1.00 . A X . 17 ARG C 1 1
10 5073 1 1 17 ARG CA C 22.878 5.745 -6.296 1.00 . A X . 17 ARG CA 1 1
10 5074 1 1 17 ARG CB C 23.967 6.293 -7.215 1.00 . A X . 17 ARG CB 1 1
10 5075 1 1 17 ARG CD C 22.744 7.180 -9.205 1.00 . A X . 17 ARG CD 1 1
10 5076 1 1 17 ARG CG C 23.464 7.560 -7.910 1.00 . A X . 17 ARG CG 1 1
10 5077 1 1 17 ARG CZ C 21.582 8.414 -10.946 1.00 . A X . 17 ARG CZ 1 1
10 5078 1 1 17 ARG H H 23.798 6.222 -4.453 1.00 . A X . 17 ARG H 1 1
10 5079 1 1 17 ARG HA H 21.910 5.967 -6.718 1.00 . A X . 17 ARG HA 1 1
10 5080 1 1 17 ARG HB2 H 24.845 6.526 -6.630 1.00 . A X . 17 ARG HB2 1 1
10 5081 1 1 17 ARG HB3 H 24.214 5.550 -7.958 1.00 . A X . 17 ARG HB3 1 1
10 5082 1 1 17 ARG HD2 H 23.473 6.943 -9.964 1.00 . A X . 17 ARG HD2 1 1
10 5083 1 1 17 ARG HD3 H 22.119 6.316 -9.028 1.00 . A X . 17 ARG HD3 1 1
10 5084 1 1 17 ARG HE H 21.607 8.959 -9.020 1.00 . A X . 17 ARG HE 1 1
10 5085 1 1 17 ARG HG2 H 22.779 8.080 -7.255 1.00 . A X . 17 ARG HG2 1 1
10 5086 1 1 17 ARG HG3 H 24.301 8.201 -8.140 1.00 . A X . 17 ARG HG3 1 1
10 5087 1 1 17 ARG HH11 H 22.554 6.759 -11.518 1.00 . A X . 17 ARG HH11 1 1
10 5088 1 1 17 ARG HH12 H 21.736 7.621 -12.778 1.00 . A X . 17 ARG HH12 1 1
10 5089 1 1 17 ARG HH21 H 20.533 10.096 -10.668 1.00 . A X . 17 ARG HH21 1 1
10 5090 1 1 17 ARG HH22 H 20.592 9.511 -12.297 1.00 . A X . 17 ARG HH22 1 1
10 5091 1 1 17 ARG N N 22.980 6.353 -4.975 1.00 . A X . 17 ARG N 1 1
10 5092 1 1 17 ARG NE N 21.918 8.291 -9.666 1.00 . A X . 17 ARG NE 1 1
10 5093 1 1 17 ARG NH1 N 21.989 7.530 -11.815 1.00 . A X . 17 ARG NH1 1 1
10 5094 1 1 17 ARG NH2 N 20.845 9.418 -11.334 1.00 . A X . 17 ARG NH2 1 1
10 5095 1 1 17 ARG O O 22.670 3.476 -7.058 1.00 . A X . 17 ARG O 1 1
10 5096 1 1 18 ARG C C 22.846 2.087 -3.509 1.00 . A X . 18 ARG C 1 1
10 5097 1 1 18 ARG CA C 23.713 2.409 -4.706 1.00 . A X . 18 ARG CA 1 1
10 5098 1 1 18 ARG CB C 25.177 2.109 -4.381 1.00 . A X . 18 ARG CB 1 1
10 5099 1 1 18 ARG CD C 25.066 -0.214 -5.294 1.00 . A X . 18 ARG CD 1 1
10 5100 1 1 18 ARG CG C 25.747 1.149 -5.427 1.00 . A X . 18 ARG CG 1 1
10 5101 1 1 18 ARG CZ C 25.621 -2.328 -4.236 1.00 . A X . 18 ARG CZ 1 1
10 5102 1 1 18 ARG H H 23.777 4.486 -4.315 1.00 . A X . 18 ARG H 1 1
10 5103 1 1 18 ARG HA H 23.398 1.816 -5.553 1.00 . A X . 18 ARG HA 1 1
10 5104 1 1 18 ARG HB2 H 25.743 3.031 -4.389 1.00 . A X . 18 ARG HB2 1 1
10 5105 1 1 18 ARG HB3 H 25.242 1.654 -3.403 1.00 . A X . 18 ARG HB3 1 1
10 5106 1 1 18 ARG HD2 H 24.260 -0.143 -4.581 1.00 . A X . 18 ARG HD2 1 1
10 5107 1 1 18 ARG HD3 H 24.668 -0.508 -6.255 1.00 . A X . 18 ARG HD3 1 1
10 5108 1 1 18 ARG HE H 26.983 -1.064 -4.980 1.00 . A X . 18 ARG HE 1 1
10 5109 1 1 18 ARG HG2 H 25.569 1.547 -6.416 1.00 . A X . 18 ARG HG2 1 1
10 5110 1 1 18 ARG HG3 H 26.809 1.036 -5.270 1.00 . A X . 18 ARG HG3 1 1
10 5111 1 1 18 ARG HH11 H 23.676 -1.867 -4.350 1.00 . A X . 18 ARG HH11 1 1
10 5112 1 1 18 ARG HH12 H 24.044 -3.378 -3.590 1.00 . A X . 18 ARG HH12 1 1
10 5113 1 1 18 ARG HH21 H 27.473 -3.045 -3.984 1.00 . A X . 18 ARG HH21 1 1
10 5114 1 1 18 ARG HH22 H 26.193 -4.046 -3.383 1.00 . A X . 18 ARG HH22 1 1
10 5115 1 1 18 ARG N N 23.537 3.822 -5.004 1.00 . A X . 18 ARG N 1 1
10 5116 1 1 18 ARG NE N 26.024 -1.214 -4.839 1.00 . A X . 18 ARG NE 1 1
10 5117 1 1 18 ARG NH1 N 24.347 -2.541 -4.044 1.00 . A X . 18 ARG NH1 1 1
10 5118 1 1 18 ARG NH2 N 26.497 -3.209 -3.837 1.00 . A X . 18 ARG NH2 1 1
10 5119 1 1 18 ARG O O 22.837 0.970 -2.992 1.00 . A X . 18 ARG O 1 1
10 5120 1 1 19 ALA C C 19.801 3.250 -2.362 1.00 . A X . 19 ALA C 1 1
10 5121 1 1 19 ALA CA C 21.244 3.013 -1.935 1.00 . A X . 19 ALA CA 1 1
10 5122 1 1 19 ALA CB C 21.660 4.058 -0.906 1.00 . A X . 19 ALA CB 1 1
10 5123 1 1 19 ALA H H 22.201 3.971 -3.544 1.00 . A X . 19 ALA H 1 1
10 5124 1 1 19 ALA HA H 21.332 2.033 -1.498 1.00 . A X . 19 ALA HA 1 1
10 5125 1 1 19 ALA HB1 H 22.347 4.755 -1.373 1.00 . A X . 19 ALA HB1 1 1
10 5126 1 1 19 ALA HB2 H 22.148 3.570 -0.075 1.00 . A X . 19 ALA HB2 1 1
10 5127 1 1 19 ALA HB3 H 20.787 4.586 -0.555 1.00 . A X . 19 ALA HB3 1 1
10 5128 1 1 19 ALA N N 22.126 3.112 -3.078 1.00 . A X . 19 ALA N 1 1
10 5129 1 1 19 ALA O O 18.883 2.597 -1.869 1.00 . A X . 19 ALA O 1 1
10 5130 1 1 20 GLN C C 17.732 3.330 -4.602 1.00 . A X . 20 GLN C 1 1
10 5131 1 1 20 GLN CA C 18.270 4.492 -3.777 1.00 . A X . 20 GLN CA 1 1
10 5132 1 1 20 GLN CB C 18.299 5.759 -4.634 1.00 . A X . 20 GLN CB 1 1
10 5133 1 1 20 GLN CD C 16.766 6.943 -6.218 1.00 . A X . 20 GLN CD 1 1
10 5134 1 1 20 GLN CG C 16.869 6.258 -4.860 1.00 . A X . 20 GLN CG 1 1
10 5135 1 1 20 GLN H H 20.381 4.673 -3.654 1.00 . A X . 20 GLN H 1 1
10 5136 1 1 20 GLN HA H 17.616 4.655 -2.933 1.00 . A X . 20 GLN HA 1 1
10 5137 1 1 20 GLN HB2 H 18.870 6.522 -4.128 1.00 . A X . 20 GLN HB2 1 1
10 5138 1 1 20 GLN HB3 H 18.755 5.539 -5.587 1.00 . A X . 20 GLN HB3 1 1
10 5139 1 1 20 GLN HE21 H 18.702 7.370 -6.316 1.00 . A X . 20 GLN HE21 1 1
10 5140 1 1 20 GLN HE22 H 17.778 7.881 -7.646 1.00 . A X . 20 GLN HE22 1 1
10 5141 1 1 20 GLN HG2 H 16.188 5.422 -4.826 1.00 . A X . 20 GLN HG2 1 1
10 5142 1 1 20 GLN HG3 H 16.610 6.964 -4.084 1.00 . A X . 20 GLN HG3 1 1
10 5143 1 1 20 GLN N N 19.609 4.186 -3.289 1.00 . A X . 20 GLN N 1 1
10 5144 1 1 20 GLN NE2 N 17.837 7.439 -6.772 1.00 . A X . 20 GLN NE2 1 1
10 5145 1 1 20 GLN O O 16.788 2.652 -4.197 1.00 . A X . 20 GLN O 1 1
10 5146 1 1 20 GLN OE1 O 15.679 7.027 -6.790 1.00 . A X . 20 GLN OE1 1 1
10 5147 1 1 21 ASP C C 17.839 0.710 -5.840 1.00 . A X . 21 ASP C 1 1
10 5148 1 1 21 ASP CA C 17.929 2.013 -6.628 1.00 . A X . 21 ASP CA 1 1
10 5149 1 1 21 ASP CB C 18.927 1.852 -7.776 1.00 . A X . 21 ASP CB 1 1
10 5150 1 1 21 ASP CG C 18.187 1.824 -9.110 1.00 . A X . 21 ASP CG 1 1
10 5151 1 1 21 ASP H H 19.098 3.671 -6.024 1.00 . A X . 21 ASP H 1 1
10 5152 1 1 21 ASP HA H 16.957 2.244 -7.038 1.00 . A X . 21 ASP HA 1 1
10 5153 1 1 21 ASP HB2 H 19.620 2.685 -7.768 1.00 . A X . 21 ASP HB2 1 1
10 5154 1 1 21 ASP HB3 H 19.473 0.928 -7.650 1.00 . A X . 21 ASP HB3 1 1
10 5155 1 1 21 ASP N N 18.348 3.101 -5.756 1.00 . A X . 21 ASP N 1 1
10 5156 1 1 21 ASP O O 17.065 -0.184 -6.182 1.00 . A X . 21 ASP O 1 1
10 5157 1 1 21 ASP OD1 O 17.542 0.826 -9.385 1.00 . A X . 21 ASP OD1 1 1
10 5158 1 1 21 ASP OD2 O 18.278 2.800 -9.836 1.00 . A X . 21 ASP OD2 1 1
10 5159 1 1 22 PHE C C 17.503 -0.553 -2.942 1.00 . A X . 22 PHE C 1 1
10 5160 1 1 22 PHE CA C 18.651 -0.578 -3.948 1.00 . A X . 22 PHE CA 1 1
10 5161 1 1 22 PHE CB C 19.979 -0.671 -3.201 1.00 . A X . 22 PHE CB 1 1
10 5162 1 1 22 PHE CD1 C 20.398 -3.083 -3.728 1.00 . A X . 22 PHE CD1 1 1
10 5163 1 1 22 PHE CD2 C 20.139 -2.431 -1.411 1.00 . A X . 22 PHE CD2 1 1
10 5164 1 1 22 PHE CE1 C 20.570 -4.410 -3.338 1.00 . A X . 22 PHE CE1 1 1
10 5165 1 1 22 PHE CE2 C 20.314 -3.759 -1.017 1.00 . A X . 22 PHE CE2 1 1
10 5166 1 1 22 PHE CG C 20.182 -2.095 -2.767 1.00 . A X . 22 PHE CG 1 1
10 5167 1 1 22 PHE CZ C 20.529 -4.752 -1.981 1.00 . A X . 22 PHE CZ 1 1
10 5168 1 1 22 PHE H H 19.236 1.355 -4.561 1.00 . A X . 22 PHE H 1 1
10 5169 1 1 22 PHE HA H 18.548 -1.452 -4.576 1.00 . A X . 22 PHE HA 1 1
10 5170 1 1 22 PHE HB2 H 20.784 -0.372 -3.858 1.00 . A X . 22 PHE HB2 1 1
10 5171 1 1 22 PHE HB3 H 19.957 -0.027 -2.334 1.00 . A X . 22 PHE HB3 1 1
10 5172 1 1 22 PHE HD1 H 20.432 -2.821 -4.775 1.00 . A X . 22 PHE HD1 1 1
10 5173 1 1 22 PHE HD2 H 19.973 -1.664 -0.667 1.00 . A X . 22 PHE HD2 1 1
10 5174 1 1 22 PHE HE1 H 20.732 -5.167 -4.085 1.00 . A X . 22 PHE HE1 1 1
10 5175 1 1 22 PHE HE2 H 20.281 -4.019 0.029 1.00 . A X . 22 PHE HE2 1 1
10 5176 1 1 22 PHE HZ H 20.664 -5.780 -1.679 1.00 . A X . 22 PHE HZ 1 1
10 5177 1 1 22 PHE N N 18.639 0.613 -4.782 1.00 . A X . 22 PHE N 1 1
10 5178 1 1 22 PHE O O 16.534 -1.297 -3.076 1.00 . A X . 22 PHE O 1 1
10 5179 1 1 23 VAL C C 15.220 0.693 -1.535 1.00 . A X . 23 VAL C 1 1
10 5180 1 1 23 VAL CA C 16.584 0.409 -0.910 1.00 . A X . 23 VAL CA 1 1
10 5181 1 1 23 VAL CB C 16.934 1.522 0.079 1.00 . A X . 23 VAL CB 1 1
10 5182 1 1 23 VAL CG1 C 15.827 1.639 1.128 1.00 . A X . 23 VAL CG1 1 1
10 5183 1 1 23 VAL CG2 C 18.257 1.187 0.772 1.00 . A X . 23 VAL CG2 1 1
10 5184 1 1 23 VAL H H 18.414 0.875 -1.874 1.00 . A X . 23 VAL H 1 1
10 5185 1 1 23 VAL HA H 16.535 -0.525 -0.374 1.00 . A X . 23 VAL HA 1 1
10 5186 1 1 23 VAL HB H 17.028 2.458 -0.449 1.00 . A X . 23 VAL HB 1 1
10 5187 1 1 23 VAL HG11 H 16.255 1.949 2.070 1.00 . A X . 23 VAL HG11 1 1
10 5188 1 1 23 VAL HG12 H 15.343 0.681 1.251 1.00 . A X . 23 VAL HG12 1 1
10 5189 1 1 23 VAL HG13 H 15.100 2.370 0.805 1.00 . A X . 23 VAL HG13 1 1
10 5190 1 1 23 VAL HG21 H 18.838 2.090 0.891 1.00 . A X . 23 VAL HG21 1 1
10 5191 1 1 23 VAL HG22 H 18.809 0.479 0.171 1.00 . A X . 23 VAL HG22 1 1
10 5192 1 1 23 VAL HG23 H 18.057 0.757 1.742 1.00 . A X . 23 VAL HG23 1 1
10 5193 1 1 23 VAL N N 17.619 0.306 -1.934 1.00 . A X . 23 VAL N 1 1
10 5194 1 1 23 VAL O O 14.217 0.801 -0.829 1.00 . A X . 23 VAL O 1 1
10 5195 1 1 24 GLN C C 13.165 -0.201 -3.795 1.00 . A X . 24 GLN C 1 1
10 5196 1 1 24 GLN CA C 13.942 1.090 -3.560 1.00 . A X . 24 GLN CA 1 1
10 5197 1 1 24 GLN CB C 14.252 1.784 -4.893 1.00 . A X . 24 GLN CB 1 1
10 5198 1 1 24 GLN CD C 13.253 0.265 -6.627 1.00 . A X . 24 GLN CD 1 1
10 5199 1 1 24 GLN CG C 13.100 1.591 -5.883 1.00 . A X . 24 GLN CG 1 1
10 5200 1 1 24 GLN H H 16.010 0.725 -3.372 1.00 . A X . 24 GLN H 1 1
10 5201 1 1 24 GLN HA H 13.340 1.747 -2.952 1.00 . A X . 24 GLN HA 1 1
10 5202 1 1 24 GLN HB2 H 14.395 2.841 -4.716 1.00 . A X . 24 GLN HB2 1 1
10 5203 1 1 24 GLN HB3 H 15.158 1.366 -5.311 1.00 . A X . 24 GLN HB3 1 1
10 5204 1 1 24 GLN HE21 H 14.722 -0.398 -5.463 1.00 . A X . 24 GLN HE21 1 1
10 5205 1 1 24 GLN HE22 H 14.251 -1.452 -6.709 1.00 . A X . 24 GLN HE22 1 1
10 5206 1 1 24 GLN HG2 H 12.160 1.601 -5.353 1.00 . A X . 24 GLN HG2 1 1
10 5207 1 1 24 GLN HG3 H 13.110 2.400 -6.598 1.00 . A X . 24 GLN HG3 1 1
10 5208 1 1 24 GLN N N 15.186 0.815 -2.858 1.00 . A X . 24 GLN N 1 1
10 5209 1 1 24 GLN NE2 N 14.150 -0.600 -6.235 1.00 . A X . 24 GLN NE2 1 1
10 5210 1 1 24 GLN O O 11.935 -0.189 -3.861 1.00 . A X . 24 GLN O 1 1
10 5211 1 1 24 GLN OE1 O 12.534 0.010 -7.593 1.00 . A X . 24 GLN OE1 1 1
10 5212 1 1 25 TRP C C 13.136 -3.331 -2.788 1.00 . A X . 25 TRP C 1 1
10 5213 1 1 25 TRP CA C 13.220 -2.595 -4.107 1.00 . A X . 25 TRP CA 1 1
10 5214 1 1 25 TRP CB C 14.002 -3.454 -5.079 1.00 . A X . 25 TRP CB 1 1
10 5215 1 1 25 TRP CD1 C 13.269 -5.814 -4.643 1.00 . A X . 25 TRP CD1 1 1
10 5216 1 1 25 TRP CD2 C 15.131 -5.261 -3.533 1.00 . A X . 25 TRP CD2 1 1
10 5217 1 1 25 TRP CE2 C 14.861 -6.602 -3.194 1.00 . A X . 25 TRP CE2 1 1
10 5218 1 1 25 TRP CE3 C 16.250 -4.646 -2.972 1.00 . A X . 25 TRP CE3 1 1
10 5219 1 1 25 TRP CG C 14.128 -4.797 -4.462 1.00 . A X . 25 TRP CG 1 1
10 5220 1 1 25 TRP CH2 C 16.804 -6.671 -1.764 1.00 . A X . 25 TRP CH2 1 1
10 5221 1 1 25 TRP CZ2 C 15.687 -7.307 -2.315 1.00 . A X . 25 TRP CZ2 1 1
10 5222 1 1 25 TRP CZ3 C 17.079 -5.338 -2.096 1.00 . A X . 25 TRP CZ3 1 1
10 5223 1 1 25 TRP H H 14.862 -1.285 -3.821 1.00 . A X . 25 TRP H 1 1
10 5224 1 1 25 TRP HA H 12.226 -2.447 -4.496 1.00 . A X . 25 TRP HA 1 1
10 5225 1 1 25 TRP HB2 H 13.469 -3.526 -6.019 1.00 . A X . 25 TRP HB2 1 1
10 5226 1 1 25 TRP HB3 H 14.983 -3.032 -5.239 1.00 . A X . 25 TRP HB3 1 1
10 5227 1 1 25 TRP HD1 H 12.392 -5.778 -5.271 1.00 . A X . 25 TRP HD1 1 1
10 5228 1 1 25 TRP HE1 H 13.268 -7.778 -3.864 1.00 . A X . 25 TRP HE1 1 1
10 5229 1 1 25 TRP HE3 H 16.461 -3.624 -3.206 1.00 . A X . 25 TRP HE3 1 1
10 5230 1 1 25 TRP HH2 H 17.452 -7.204 -1.084 1.00 . A X . 25 TRP HH2 1 1
10 5231 1 1 25 TRP HZ2 H 15.467 -8.328 -2.056 1.00 . A X . 25 TRP HZ2 1 1
10 5232 1 1 25 TRP HZ3 H 17.934 -4.837 -1.676 1.00 . A X . 25 TRP HZ3 1 1
10 5233 1 1 25 TRP N N 13.878 -1.316 -3.902 1.00 . A X . 25 TRP N 1 1
10 5234 1 1 25 TRP NE1 N 13.706 -6.902 -3.899 1.00 . A X . 25 TRP NE1 1 1
10 5235 1 1 25 TRP O O 12.159 -4.025 -2.506 1.00 . A X . 25 TRP O 1 1
10 5236 1 1 26 LEU C C 12.943 -3.554 0.076 1.00 . A X . 26 LEU C 1 1
10 5237 1 1 26 LEU CA C 14.223 -3.846 -0.701 1.00 . A X . 26 LEU CA 1 1
10 5238 1 1 26 LEU CB C 15.435 -3.374 0.109 1.00 . A X . 26 LEU CB 1 1
10 5239 1 1 26 LEU CD1 C 16.291 -5.564 1.052 1.00 . A X . 26 LEU CD1 1 1
10 5240 1 1 26 LEU CD2 C 16.438 -3.465 2.398 1.00 . A X . 26 LEU CD2 1 1
10 5241 1 1 26 LEU CG C 15.595 -4.234 1.378 1.00 . A X . 26 LEU CG 1 1
10 5242 1 1 26 LEU H H 14.935 -2.624 -2.269 1.00 . A X . 26 LEU H 1 1
10 5243 1 1 26 LEU HA H 14.311 -4.902 -0.878 1.00 . A X . 26 LEU HA 1 1
10 5244 1 1 26 LEU HB2 H 16.323 -3.448 -0.498 1.00 . A X . 26 LEU HB2 1 1
10 5245 1 1 26 LEU HB3 H 15.286 -2.344 0.395 1.00 . A X . 26 LEU HB3 1 1
10 5246 1 1 26 LEU HD11 H 17.188 -5.375 0.484 1.00 . A X . 26 LEU HD11 1 1
10 5247 1 1 26 LEU HD12 H 15.627 -6.199 0.481 1.00 . A X . 26 LEU HD12 1 1
10 5248 1 1 26 LEU HD13 H 16.553 -6.062 1.974 1.00 . A X . 26 LEU HD13 1 1
10 5249 1 1 26 LEU HD21 H 17.411 -3.259 1.977 1.00 . A X . 26 LEU HD21 1 1
10 5250 1 1 26 LEU HD22 H 16.551 -4.059 3.292 1.00 . A X . 26 LEU HD22 1 1
10 5251 1 1 26 LEU HD23 H 15.947 -2.534 2.642 1.00 . A X . 26 LEU HD23 1 1
10 5252 1 1 26 LEU HG H 14.625 -4.438 1.803 1.00 . A X . 26 LEU HG 1 1
10 5253 1 1 26 LEU N N 14.181 -3.182 -1.986 1.00 . A X . 26 LEU N 1 1
10 5254 1 1 26 LEU O O 12.436 -4.410 0.801 1.00 . A X . 26 LEU O 1 1
10 5255 1 1 27 MET C C 9.986 -2.126 -0.260 1.00 . A X . 27 MET C 1 1
10 5256 1 1 27 MET CA C 11.214 -1.936 0.627 1.00 . A X . 27 MET CA 1 1
10 5257 1 1 27 MET CB C 11.316 -0.471 1.053 1.00 . A X . 27 MET CB 1 1
10 5258 1 1 27 MET CE C 10.062 2.584 -1.312 1.00 . A X . 27 MET CE 1 1
10 5259 1 1 27 MET CG C 11.264 0.426 -0.186 1.00 . A X . 27 MET CG 1 1
10 5260 1 1 27 MET H H 12.881 -1.687 -0.664 1.00 . A X . 27 MET H 1 1
10 5261 1 1 27 MET HA H 11.104 -2.547 1.510 1.00 . A X . 27 MET HA 1 1
10 5262 1 1 27 MET HB2 H 10.491 -0.228 1.709 1.00 . A X . 27 MET HB2 1 1
10 5263 1 1 27 MET HB3 H 12.250 -0.311 1.571 1.00 . A X . 27 MET HB3 1 1
10 5264 1 1 27 MET HE1 H 9.175 3.166 -1.527 1.00 . A X . 27 MET HE1 1 1
10 5265 1 1 27 MET HE2 H 10.526 2.285 -2.237 1.00 . A X . 27 MET HE2 1 1
10 5266 1 1 27 MET HE3 H 10.758 3.179 -0.737 1.00 . A X . 27 MET HE3 1 1
10 5267 1 1 27 MET HG2 H 11.978 1.231 -0.078 1.00 . A X . 27 MET HG2 1 1
10 5268 1 1 27 MET HG3 H 11.507 -0.158 -1.064 1.00 . A X . 27 MET HG3 1 1
10 5269 1 1 27 MET N N 12.429 -2.334 -0.075 1.00 . A X . 27 MET N 1 1
10 5270 1 1 27 MET O O 8.888 -1.686 0.083 1.00 . A X . 27 MET O 1 1
10 5271 1 1 27 MET SD S 9.600 1.115 -0.363 1.00 . A X . 27 MET SD 1 1
10 5272 1 1 28 ASN C C 8.467 -4.406 -2.079 1.00 . A X . 28 ASN C 1 1
10 5273 1 1 28 ASN CA C 9.074 -3.028 -2.320 1.00 . A X . 28 ASN CA 1 1
10 5274 1 1 28 ASN CB C 9.569 -2.931 -3.765 1.00 . A X . 28 ASN CB 1 1
10 5275 1 1 28 ASN CG C 8.406 -3.138 -4.728 1.00 . A X . 28 ASN CG 1 1
10 5276 1 1 28 ASN H H 11.072 -3.115 -1.618 1.00 . A X . 28 ASN H 1 1
10 5277 1 1 28 ASN HA H 8.313 -2.278 -2.162 1.00 . A X . 28 ASN HA 1 1
10 5278 1 1 28 ASN HB2 H 10.003 -1.956 -3.930 1.00 . A X . 28 ASN HB2 1 1
10 5279 1 1 28 ASN HB3 H 10.317 -3.691 -3.938 1.00 . A X . 28 ASN HB3 1 1
10 5280 1 1 28 ASN HD21 H 8.129 -1.198 -5.044 1.00 . A X . 28 ASN HD21 1 1
10 5281 1 1 28 ASN HD22 H 7.073 -2.226 -5.884 1.00 . A X . 28 ASN HD22 1 1
10 5282 1 1 28 ASN N N 10.177 -2.786 -1.397 1.00 . A X . 28 ASN N 1 1
10 5283 1 1 28 ASN ND2 N 7.821 -2.101 -5.263 1.00 . A X . 28 ASN ND2 1 1
10 5284 1 1 28 ASN O O 7.254 -4.587 -2.177 1.00 . A X . 28 ASN O 1 1
10 5285 1 1 28 ASN OD1 O 8.020 -4.275 -5.001 1.00 . A X . 28 ASN OD1 1 1
10 5286 1 1 29 THR C C 8.562 -6.932 -0.027 1.00 . A X . 29 THR C 1 1
10 5287 1 1 29 THR CA C 8.858 -6.735 -1.510 1.00 . A X . 29 THR CA 1 1
10 5288 1 1 29 THR CB C 9.920 -7.741 -1.959 1.00 . A X . 29 THR CB 1 1
10 5289 1 1 29 THR CG2 C 10.043 -7.710 -3.484 1.00 . A X . 29 THR CG2 1 1
10 5290 1 1 29 THR H H 10.277 -5.173 -1.700 1.00 . A X . 29 THR H 1 1
10 5291 1 1 29 THR HA H 7.953 -6.908 -2.074 1.00 . A X . 29 THR HA 1 1
10 5292 1 1 29 THR HB H 9.632 -8.733 -1.646 1.00 . A X . 29 THR HB 1 1
10 5293 1 1 29 THR HG1 H 11.848 -7.935 -1.792 1.00 . A X . 29 THR HG1 1 1
10 5294 1 1 29 THR HG21 H 9.543 -8.571 -3.903 1.00 . A X . 29 THR HG21 1 1
10 5295 1 1 29 THR HG22 H 11.086 -7.729 -3.761 1.00 . A X . 29 THR HG22 1 1
10 5296 1 1 29 THR HG23 H 9.585 -6.808 -3.864 1.00 . A X . 29 THR HG23 1 1
10 5297 1 1 29 THR N N 9.321 -5.376 -1.764 1.00 . A X . 29 THR N 1 1
10 5298 1 1 29 THR O O 9.456 -6.809 0.811 1.00 . A X . 29 THR O 1 1
10 5299 1 1 29 THR OG1 O 11.169 -7.402 -1.374 1.00 . A X . 29 THR OG1 1 1
10 5300 1 1 30 NH2 HN1 H 6.639 -7.333 -0.316 1.00 . A X . 30 NH2 HN1 1 1
10 5301 1 1 30 NH2 HN2 H 7.151 -7.363 1.302 1.00 . A X . 30 NH2 HN2 1 1
10 5302 1 1 30 NH2 N N 7.350 -7.235 0.351 1.00 . A X . 30 NH2 N 1 1
10 5303 2 2 1 . C C 31.059 6.838 -12.502 1.00 . B X . 101 GGL C 1 1
10 5304 2 2 1 . CA C 31.047 8.187 -11.790 1.00 . B X . 101 GGL CA 1 1
10 5305 2 2 1 . CB C 29.637 8.782 -11.842 1.00 . B X . 101 GGL CB 1 1
10 5306 2 2 1 . CD C 27.420 8.346 -10.768 1.00 . B X . 101 GGL CD 1 1
10 5307 2 2 1 . CG C 28.611 7.707 -11.474 1.00 . B X . 101 GGL CG 1 1
10 5308 2 2 1 . H H 32.744 8.734 -12.934 1.00 . B X . 101 GGL H 1 1
10 5309 2 2 1 . HA H 31.324 8.039 -10.757 1.00 . B X . 101 GGL HA 1 1
10 5310 2 2 1 . HB2 H 29.435 9.143 -12.840 1.00 . B X . 101 GGL HB2 1 1
10 5311 2 2 1 . HB3 H 29.566 9.601 -11.141 1.00 . B X . 101 GGL HB3 1 1
10 5312 2 2 1 . HG2 H 28.271 7.213 -12.372 1.00 . B X . 101 GGL HG2 1 1
10 5313 2 2 1 . HG3 H 29.070 6.982 -10.818 1.00 . B X . 101 GGL HG3 1 1
10 5314 2 2 1 . N N 32.002 9.101 -12.411 1.00 . B X . 101 GGL N 1 1
10 5315 2 2 1 . O O 30.303 6.685 -13.448 1.00 . B X . 101 GGL O 1 1
10 5316 2 2 1 . OE1 O 26.423 8.690 -11.402 1.00 . B X . 101 GGL OE1 1 1
10 5317 2 2 1 . OXT O 31.886 6.014 -12.150 1.00 . B X . 101 GGL OXT 1 1
10 5318 3 2 1 . C C 31.983 10.212 -9.467 1.00 . C X . 102 GGL C 1 1
10 5319 3 2 1 . CA C 32.125 11.675 -9.883 1.00 . C X . 102 GGL CA 1 1
10 5320 3 2 1 . CB C 33.365 11.852 -10.776 1.00 . C X . 102 GGL CB 1 1
10 5321 3 2 1 . CD C 31.881 10.419 -12.284 1.00 . C X . 102 GGL CD 1 1
10 5322 3 2 1 . CG C 33.193 11.193 -12.164 1.00 . C X . 102 GGL CG 1 1
10 5323 3 2 1 . H H 32.656 13.407 -8.783 1.00 . C X . 102 GGL H 1 1
10 5324 3 2 1 . HA H 31.244 11.984 -10.424 1.00 . C X . 102 GGL HA 1 1
10 5325 3 2 1 . HB2 H 33.549 12.907 -10.912 1.00 . C X . 102 GGL HB2 1 1
10 5326 3 2 1 . HB3 H 34.217 11.411 -10.281 1.00 . C X . 102 GGL HB3 1 1
10 5327 3 2 1 . HG2 H 33.218 11.961 -12.922 1.00 . C X . 102 GGL HG2 1 1
10 5328 3 2 1 . HG3 H 34.014 10.512 -12.331 1.00 . C X . 102 GGL HG3 1 1
10 5329 3 2 1 . N N 32.255 12.517 -8.700 1.00 . C X . 102 GGL N 1 1
10 5330 3 2 1 . O O 32.904 9.454 -9.722 1.00 . C X . 102 GGL O 1 1
10 5331 3 2 1 . OE1 O 30.832 11.015 -12.530 1.00 . C X . 102 GGL OE1 1 1
10 5332 3 2 1 . OXT O 30.993 9.892 -8.830 1.00 . C X . 102 GGL OXT 1 1
10 5333 4 3 1 PLM C1 C 31.839 12.098 -7.508 1.00 . D X . 103 PLM C1 1 1
10 5334 4 3 1 PLM C2 C 32.847 12.203 -6.368 1.00 . D X . 103 PLM C2 1 1
10 5335 4 3 1 PLM C3 C 33.983 11.201 -6.581 1.00 . D X . 103 PLM C3 1 1
10 5336 4 3 1 PLM C4 C 33.668 9.907 -5.828 1.00 . D X . 103 PLM C4 1 1
10 5337 4 3 1 PLM C5 C 34.451 8.750 -6.453 1.00 . D X . 103 PLM C5 1 1
10 5338 4 3 1 PLM C6 C 34.172 7.464 -5.672 1.00 . D X . 103 PLM C6 1 1
10 5339 4 3 1 PLM C7 C 34.402 6.256 -6.580 1.00 . D X . 103 PLM C7 1 1
10 5340 4 3 1 PLM C8 C 33.091 5.879 -7.271 1.00 . D X . 103 PLM C8 1 1
10 5341 4 3 1 PLM C9 C 33.370 4.843 -8.363 1.00 . D X . 103 PLM C9 1 1
10 5342 4 3 1 PLM CA C 32.123 3.982 -8.592 1.00 . D X . 103 PLM CA 1 1
10 5343 4 3 1 PLM CB C 30.967 4.869 -9.069 1.00 . D X . 103 PLM CB 1 1
10 5344 4 3 1 PLM CC C 29.745 4.001 -9.395 1.00 . D X . 103 PLM CC 1 1
10 5345 4 3 1 PLM CD C 28.939 3.728 -8.120 1.00 . D X . 103 PLM CD 1 1
10 5346 4 3 1 PLM CE C 27.776 4.721 -8.025 1.00 . D X . 103 PLM CE 1 1
10 5347 4 3 1 PLM CF C 26.665 4.316 -9.002 1.00 . D X . 103 PLM CF 1 1
10 5348 4 3 1 PLM CG C 26.215 5.539 -9.804 1.00 . D X . 103 PLM CG 1 1
10 5349 4 3 1 PLM H21 H 33.252 13.204 -6.340 1.00 . D X . 103 PLM H21 1 1
10 5350 4 3 1 PLM H22 H 32.352 11.991 -5.433 1.00 . D X . 103 PLM H22 1 1
10 5351 4 3 1 PLM H31 H 34.084 10.989 -7.635 1.00 . D X . 103 PLM H31 1 1
10 5352 4 3 1 PLM H32 H 34.906 11.619 -6.207 1.00 . D X . 103 PLM H32 1 1
10 5353 4 3 1 PLM H41 H 32.610 9.701 -5.892 1.00 . D X . 103 PLM H41 1 1
10 5354 4 3 1 PLM H42 H 33.952 10.014 -4.792 1.00 . D X . 103 PLM H42 1 1
10 5355 4 3 1 PLM H51 H 34.144 8.621 -7.480 1.00 . D X . 103 PLM H51 1 1
10 5356 4 3 1 PLM H52 H 35.507 8.970 -6.419 1.00 . D X . 103 PLM H52 1 1
10 5357 4 3 1 PLM H61 H 33.149 7.467 -5.328 1.00 . D X . 103 PLM H61 1 1
10 5358 4 3 1 PLM H62 H 34.836 7.409 -4.822 1.00 . D X . 103 PLM H62 1 1
10 5359 4 3 1 PLM H71 H 35.144 6.501 -7.325 1.00 . D X . 103 PLM H71 1 1
10 5360 4 3 1 PLM H72 H 34.750 5.421 -5.988 1.00 . D X . 103 PLM H72 1 1
10 5361 4 3 1 PLM H81 H 32.652 6.761 -7.715 1.00 . D X . 103 PLM H81 1 1
10 5362 4 3 1 PLM H82 H 32.407 5.464 -6.545 1.00 . D X . 103 PLM H82 1 1
10 5363 4 3 1 PLM H91 H 33.629 5.349 -9.282 1.00 . D X . 103 PLM H91 1 1
10 5364 4 3 1 PLM H92 H 34.190 4.211 -8.058 1.00 . D X . 103 PLM H92 1 1
10 5365 4 3 1 PLM HA1 H 32.339 3.235 -9.342 1.00 . D X . 103 PLM HA1 1 1
10 5366 4 3 1 PLM HA2 H 31.848 3.493 -7.669 1.00 . D X . 103 PLM HA2 1 1
10 5367 4 3 1 PLM HB1 H 31.271 5.404 -9.957 1.00 . D X . 103 PLM HB1 1 1
10 5368 4 3 1 PLM HB2 H 30.711 5.577 -8.295 1.00 . D X . 103 PLM HB2 1 1
10 5369 4 3 1 PLM HC1 H 29.121 4.520 -10.108 1.00 . D X . 103 PLM HC1 1 1
10 5370 4 3 1 PLM HC2 H 30.070 3.064 -9.821 1.00 . D X . 103 PLM HC2 1 1
10 5371 4 3 1 PLM HD1 H 28.552 2.719 -8.147 1.00 . D X . 103 PLM HD1 1 1
10 5372 4 3 1 PLM HD2 H 29.577 3.840 -7.257 1.00 . D X . 103 PLM HD2 1 1
10 5373 4 3 1 PLM HE1 H 28.130 5.712 -8.270 1.00 . D X . 103 PLM HE1 1 1
10 5374 4 3 1 PLM HE2 H 27.386 4.720 -7.018 1.00 . D X . 103 PLM HE2 1 1
10 5375 4 3 1 PLM HF1 H 27.034 3.561 -9.680 1.00 . D X . 103 PLM HF1 1 1
10 5376 4 3 1 PLM HF2 H 25.827 3.921 -8.448 1.00 . D X . 103 PLM HF2 1 1
10 5377 4 3 1 PLM HG1 H 26.971 5.789 -10.532 1.00 . D X . 103 PLM HG1 1 1
10 5378 4 3 1 PLM HG2 H 25.288 5.314 -10.311 1.00 . D X . 103 PLM HG2 1 1
10 5379 4 3 1 PLM HG3 H 26.066 6.374 -9.136 1.00 . D X . 103 PLM HG3 1 1
10 5380 4 3 1 PLM O2 O 30.698 11.684 -7.305 1.00 . D X . 103 PLM O2 1 1
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