NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
620081 |
5lfy   |
34019 | cing | 4-filtered-FRED | STAR | entry | full | 178 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5lfy
# This FRED archive file contains, for PDB entry <5lfy>:
#
# - 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_5lfy
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 5lfy
_Assembly.Number_of_components 4
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 2565.32
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 $Amyloid_beta_A4_protein A . 1 1
2 . 1 $Amyloid_beta_A4_protein B . 1 1
3 . 2 $ZINC_ION C . 1 1
4 . 2 $ZINC_ION 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
3 2 ZN 1 ZN 1 1
4 2 ZN 1 ZN 1 1
stop_
save_
save_Amyloid_beta_A4_protein
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Amyloid beta A4 protein"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code DAEFRHHSGYX
_Entity.Number_of_monomers 11
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 ASP . 1 1
2 ALA . 1 1
3 GLU . 1 1
4 PHE . 1 1
5 ARG . 1 1
6 HIS . 1 1
7 HIS . 1 1
8 SER . 1 1
9 GLY . 1 1
10 TYR . 1 1
11 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
ASP 1 1 1 1
ALA 2 2 1 1
GLU 3 3 1 1
PHE 4 4 1 1
ARG 5 5 1 1
HIS 6 6 1 1
HIS 7 7 1 1
SER 8 8 1 1
GLY 9 9 1 1
TYR 10 10 1 1
NH2 11 11 1 1
stop_
save_
save_ZINC_ION
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "ZINC ION"
_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 ZN $ZN 1 2
stop_
save_
save_ZN
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ZN
_Chem_comp.Type non-polymer
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_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
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 ALA HA A 2 . HA 1 1
1 1 2 1 1 3 GLU QG A 3 . HG* 1 1
1 1 2 2 1 3 GLU QG B 3 . HG* 1 1
2 1 1 1 1 3 GLU QB A 3 . HB* 1 1
2 1 1 2 1 3 GLU QB B 3 . HB* 1 1
2 1 2 1 1 6 HIS HD2 A 6 . HD2 1 1
3 1 1 1 1 6 HIS QB A 6 . HB* 1 1
3 1 1 2 1 6 HIS QB B 6 . HB* 1 1
3 1 2 1 1 6 HIS HE1 A 6 . HE1 1 1
4 1 1 1 1 6 HIS HD2 A 6 . HD2 1 1
4 1 1 2 1 6 HIS HD2 B 6 . HD2 1 1
4 1 2 1 1 6 HIS HE1 A 6 . HE1 1 1
5 1 1 1 1 6 HIS HD2 A 6 . HD2 1 1
5 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1
5 1 2 2 1 7 HIS HD2 B 7 . HD2 1 1
6 1 1 1 1 6 HIS HE1 A 6 . HE1 1 1
6 1 1 2 1 6 HIS HE1 B 6 . HE1 1 1
6 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1
7 1 1 1 1 3 GLU QG A 3 . HG* 1 1
7 1 1 2 1 3 GLU QG B 3 . HG* 1 1
7 1 2 2 1 2 ALA HA B 2 . HA 1 1
8 1 1 1 1 3 GLU QB A 3 . HB* 1 1
8 1 1 2 1 3 GLU QB B 3 . HB* 1 1
8 1 2 2 1 6 HIS HD2 B 6 . HD2 1 1
9 1 1 1 1 6 HIS QB A 6 . HB* 1 1
9 1 1 2 1 6 HIS QB B 6 . HB* 1 1
9 1 2 2 1 6 HIS HE1 B 6 . HE1 1 1
10 1 1 1 1 6 HIS HD2 A 6 . HD2 1 1
10 1 1 2 1 6 HIS HD2 B 6 . HD2 1 1
10 1 2 2 1 6 HIS HE1 B 6 . HE1 1 1
11 1 1 1 1 7 HIS HD2 A 7 . HD2 1 1
11 1 1 2 1 7 HIS HD2 B 7 . HD2 1 1
11 1 2 2 1 6 HIS HD2 B 6 . HD2 1 1
12 1 1 1 1 6 HIS HE1 A 6 . HE1 1 1
12 1 1 2 1 6 HIS HE1 B 6 . HE1 1 1
12 1 2 2 1 7 HIS HD2 B 7 . HD2 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 . . . . . 4.5 1.0 4.5 1 1
2 1 . . . . . 4.0 0.5 4.0 1 1
3 1 . . . . . 4.0 0.5 4.0 1 1
4 1 . . . . . 4.0 1.5 4.0 1 1
5 1 . . . . . 3.5 0.5 3.5 1 1
6 1 . . . . . 4.0 1.5 4.0 1 1
7 1 . . . . . 4.5 1.0 4.5 1 1
8 1 . . . . . 4.0 0.5 4.0 1 1
9 1 . . . . . 4.0 0.5 4.0 1 1
10 1 . . . . . 4.0 1.5 4.0 1 1
11 1 . . . . . 3.5 0.5 3.5 1 1
12 1 . . . . . 4.0 1.5 4.0 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 2
19 1 . . . 1 2
20 1 . . . 1 2
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 1 . . . 1 2
26 1 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 1 . . . 1 2
39 1 . . . 1 2
40 1 . . . 1 2
41 1 . . . 1 2
42 1 . . . 1 2
43 1 . . . 1 2
44 1 . . . 1 2
45 1 . . . 1 2
46 1 . . . 1 2
47 1 . . . 1 2
48 1 . . . 1 2
49 1 . . . 1 2
50 1 . . . 1 2
51 1 . . . 1 2
52 1 . . . 1 2
53 1 . . . 1 2
54 1 . . . 1 2
55 1 . . . 1 2
56 1 . . . 1 2
57 1 . . . 1 2
58 1 . . . 1 2
59 1 . . . 1 2
60 1 . . . 1 2
61 1 . . . 1 2
62 1 . . . 1 2
63 1 . . . 1 2
64 1 . . . 1 2
65 1 . . . 1 2
66 1 . . . 1 2
67 1 . . . 1 2
68 1 . . . 1 2
69 1 . . . 1 2
70 1 . . . 1 2
71 1 . . . 1 2
72 1 . . . 1 2
73 1 . . . 1 2
74 1 . . . 1 2
75 1 . . . 1 2
76 1 . . . 1 2
77 1 . . . 1 2
78 1 . . . 1 2
79 1 . . . 1 2
80 1 . . . 1 2
81 1 . . . 1 2
82 1 . . . 1 2
83 1 . . . 1 2
84 1 . . . 1 2
85 1 . . . 1 2
86 1 . . . 1 2
87 1 . . . 1 2
88 1 . . . 1 2
89 1 . . . 1 2
90 1 . . . 1 2
91 1 . . . 1 2
92 1 . . . 1 2
93 1 . . . 1 2
94 1 . . . 1 2
95 1 . . . 1 2
96 1 . . . 1 2
97 1 . . . 1 2
98 1 . . . 1 2
99 1 . . . 1 2
100 1 . . . 1 2
101 1 . . . 1 2
102 1 . . . 1 2
103 1 . . . 1 2
104 1 . . . 1 2
105 1 . . . 1 2
106 1 . . . 1 2
107 1 . . . 1 2
108 1 . . . 1 2
109 1 . . . 1 2
110 1 . . . 1 2
111 1 . . . 1 2
112 1 . . . 1 2
113 1 . . . 1 2
114 1 . . . 1 2
115 1 . . . 1 2
116 1 . . . 1 2
117 1 . . . 1 2
118 1 . . . 1 2
119 1 . . . 1 2
120 1 . . . 1 2
121 1 . . . 1 2
122 1 . . . 1 2
123 1 . . . 1 2
124 1 . . . 1 2
125 1 . . . 1 2
126 1 . . . 1 2
127 1 . . . 1 2
128 1 . . . 1 2
129 1 . . . 1 2
130 1 . . . 1 2
131 1 . . . 1 2
132 1 . . . 1 2
133 1 . . . 1 2
134 1 . . . 1 2
135 1 . . . 1 2
136 1 . . . 1 2
137 1 . . . 1 2
138 1 . . . 1 2
139 1 . . . 1 2
140 1 . . . 1 2
141 1 . . . 1 2
142 1 . . . 1 2
143 1 . . . 1 2
144 1 . . . 1 2
145 1 . . . 1 2
146 1 . . . 1 2
147 1 . . . 1 2
148 1 . . . 1 2
149 1 . . . 1 2
150 1 . . . 1 2
151 1 . . . 1 2
152 1 . . . 1 2
153 1 . . . 1 2
154 1 . . . 1 2
155 1 . . . 1 2
156 1 . . . 1 2
157 1 . . . 1 2
158 1 . . . 1 2
159 1 . . . 1 2
160 1 . . . 1 2
161 1 . . . 1 2
162 1 . . . 1 2
163 1 . . . 1 2
164 1 . . . 1 2
165 1 . . . 1 2
166 1 . . . 1 2
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 7 HIS HE1 A 7 . HE1 1 2
1 1 2 2 1 1 ASP HA B 1 . HA 1 2
2 1 1 1 1 7 HIS HE1 A 7 . HE1 1 2
2 1 2 2 1 1 ASP QB B 1 . HB* 1 2
3 1 1 1 1 7 HIS HE1 A 7 . HE1 1 2
3 1 2 2 1 6 HIS HE1 B 6 . HE1 1 2
4 1 1 1 1 1 ASP HA A 1 . HA 1 2
4 1 2 1 1 2 ALA MB A 2 . HB* 1 2
5 1 1 1 1 1 ASP HA A 1 . HA 1 2
5 1 2 1 1 2 ALA H A 2 . HN 1 2
6 1 1 1 1 1 ASP QB A 1 . HB* 1 2
6 1 2 1 1 2 ALA H A 2 . HN 1 2
7 1 1 1 1 2 ALA H A 2 . HN 1 2
7 1 2 1 1 2 ALA HA A 2 . HA 1 2
8 1 1 1 1 2 ALA H A 2 . HN 1 2
8 1 2 1 1 5 ARG H A 5 . HN 1 2
9 1 1 1 1 2 ALA H A 2 . HN 1 2
9 1 2 1 1 5 ARG QG A 5 . HG* 1 2
10 1 1 1 1 2 ALA MB A 2 . HB* 1 2
10 1 2 1 1 3 GLU H A 3 . HN 1 2
11 1 1 1 1 2 ALA H A 2 . HN 1 2
11 1 2 1 1 3 GLU H A 3 . HN 1 2
12 1 1 1 1 3 GLU H A 3 . HN 1 2
12 1 2 1 1 3 GLU QB A 3 . HB* 1 2
13 1 1 1 1 3 GLU H A 3 . HN 1 2
13 1 2 1 1 5 ARG H A 5 . HN 1 2
14 1 1 1 1 3 GLU H A 3 . HN 1 2
14 1 2 1 1 6 HIS HD2 A 6 . HD2 1 2
15 1 1 1 1 2 ALA MB A 2 . HB* 1 2
15 1 2 1 1 4 PHE H A 4 . HN 1 2
16 1 1 1 1 2 ALA MB A 2 . HB* 1 2
16 1 2 1 1 4 PHE QB A 4 . HB* 1 2
17 1 1 1 1 2 ALA MB A 2 . HB* 1 2
17 1 2 1 1 4 PHE QD A 4 . HD* 1 2
18 1 1 1 1 2 ALA MB A 2 . HB* 1 2
18 1 2 1 1 4 PHE QE A 4 . HE* 1 2
19 1 1 1 1 3 GLU H A 3 . HN 1 2
19 1 2 1 1 4 PHE H A 4 . HN 1 2
20 1 1 1 1 3 GLU HA A 3 . HA 1 2
20 1 2 1 1 4 PHE H A 4 . HN 1 2
21 1 1 1 1 4 PHE H A 4 . HN 1 2
21 1 2 1 1 4 PHE QD A 4 . HD* 1 2
22 1 1 1 1 4 PHE H A 4 . HN 1 2
22 1 2 1 1 4 PHE HA A 4 . HA 1 2
23 1 1 1 1 4 PHE H A 4 . HN 1 2
23 1 2 1 1 4 PHE QB A 4 . HB* 1 2
24 1 1 1 1 4 PHE QB A 4 . HB* 1 2
24 1 2 1 1 4 PHE QD A 4 . HD* 1 2
25 1 1 1 1 4 PHE QD A 4 . HD* 1 2
25 1 2 1 1 5 ARG QG A 5 . HG* 1 2
26 1 1 1 1 4 PHE QE A 4 . HE* 1 2
26 1 2 1 1 5 ARG QG A 5 . HG* 1 2
27 1 1 1 1 4 PHE H A 4 . HN 1 2
27 1 2 1 1 6 HIS H A 6 . HN 1 2
28 1 1 1 1 1 ASP QB A 1 . HB* 1 2
28 1 2 1 1 5 ARG HG2 A 5 . HG2 1 2
29 1 1 1 1 1 ASP QB A 1 . HB* 1 2
29 1 2 1 1 5 ARG HG3 A 5 . HG1 1 2
30 1 1 1 1 2 ALA MB A 2 . HB* 1 2
30 1 2 1 1 5 ARG H A 5 . HN 1 2
31 1 1 1 1 4 PHE H A 4 . HN 1 2
31 1 2 1 1 5 ARG H A 5 . HN 1 2
32 1 1 1 1 4 PHE QB A 4 . HB* 1 2
32 1 2 1 1 5 ARG H A 5 . HN 1 2
33 1 1 1 1 5 ARG H A 5 . HN 1 2
33 1 2 1 1 5 ARG HA A 5 . HA 1 2
34 1 1 1 1 5 ARG H A 5 . HN 1 2
34 1 2 1 1 5 ARG QG A 5 . HG* 1 2
35 1 1 1 1 5 ARG HA A 5 . HA 1 2
35 1 2 1 1 5 ARG QG A 5 . HG* 1 2
36 1 1 1 1 5 ARG H A 5 . HN 1 2
36 1 2 1 1 6 HIS QB A 6 . HB* 1 2
37 1 1 1 1 3 GLU HA A 3 . HA 1 2
37 1 2 1 1 6 HIS H A 6 . HN 1 2
38 1 1 1 1 1 ASP QB A 1 . HB* 1 2
38 1 2 1 1 6 HIS H A 6 . HN 1 2
39 1 1 1 1 5 ARG QG A 5 . HG* 1 2
39 1 2 1 1 6 HIS H A 6 . HN 1 2
40 1 1 1 1 5 ARG H A 5 . HN 1 2
40 1 2 1 1 6 HIS H A 6 . HN 1 2
41 1 1 1 1 6 HIS H A 6 . HN 1 2
41 1 2 1 1 6 HIS HA A 6 . HA 1 2
42 1 1 1 1 6 HIS H A 6 . HN 1 2
42 1 2 1 1 6 HIS QB A 6 . HB* 1 2
43 1 1 1 1 3 GLU QG A 3 . HG* 1 2
43 1 2 1 1 7 HIS HD2 A 7 . HD2 1 2
44 1 1 1 1 6 HIS QB A 6 . HB* 1 2
44 1 2 1 1 7 HIS H A 7 . HN 1 2
45 1 1 1 1 6 HIS H A 6 . HN 1 2
45 1 2 1 1 7 HIS H A 7 . HN 1 2
46 1 1 1 1 7 HIS H A 7 . HN 1 2
46 1 2 1 1 7 HIS HD2 A 7 . HD2 1 2
47 1 1 1 1 7 HIS H A 7 . HN 1 2
47 1 2 1 1 7 HIS HA A 7 . HA 1 2
48 1 1 1 1 7 HIS H A 7 . HN 1 2
48 1 2 1 1 7 HIS QB A 7 . HB* 1 2
49 1 1 1 1 7 HIS H A 7 . HN 1 2
49 1 2 1 1 8 SER H A 8 . HN 1 2
50 1 1 1 1 8 SER H A 8 . HN 1 2
50 1 2 1 1 8 SER QB A 8 . HB* 1 2
51 1 1 1 1 8 SER HA A 8 . HA 1 2
51 1 2 1 1 9 GLY H A 9 . HN 1 2
52 1 1 1 1 9 GLY QA A 9 . HA* 1 2
52 1 2 1 1 10 TYR H A 10 . HN 1 2
53 1 1 1 1 10 TYR H A 10 . HN 1 2
53 1 2 1 1 10 TYR HA A 10 . HA 1 2
54 1 1 1 1 10 TYR H A 10 . HN 1 2
54 1 2 1 1 10 TYR QB A 10 . HB* 1 2
55 1 1 1 1 10 TYR QB A 10 . HB* 1 2
55 1 2 1 1 10 TYR HD1 A 10 . HD1 1 2
56 1 1 1 1 10 TYR H A 10 . HN 1 2
56 1 2 1 1 10 TYR HD1 A 10 . HD1 1 2
57 1 1 1 1 1 ASP QB A 1 . HB* 1 2
57 1 2 1 1 2 ALA MB A 2 . HB* 1 2
58 1 1 1 1 2 ALA H A 2 . HN 1 2
58 1 2 1 1 4 PHE QD A 4 . HD* 1 2
59 1 1 1 1 2 ALA H A 2 . HN 1 2
59 1 2 1 1 5 ARG QD A 5 . HD* 1 2
60 1 1 1 1 2 ALA HA A 2 . HA 1 2
60 1 2 1 1 3 GLU H A 3 . HN 1 2
61 1 1 1 1 3 GLU H A 3 . HN 1 2
61 1 2 1 1 3 GLU QG A 3 . HG* 1 2
62 1 1 1 1 3 GLU H A 3 . HN 1 2
62 1 2 1 1 4 PHE QD A 4 . HD* 1 2
63 1 1 1 1 2 ALA HA A 2 . HA 1 2
63 1 2 1 1 4 PHE H A 4 . HN 1 2
64 1 1 1 1 3 GLU QB A 3 . HB* 1 2
64 1 2 1 1 4 PHE H A 4 . HN 1 2
65 1 1 1 1 3 GLU QG A 3 . HG* 1 2
65 1 2 1 1 4 PHE H A 4 . HN 1 2
66 1 1 1 1 4 PHE HA A 4 . HA 1 2
66 1 2 1 1 7 HIS QB A 7 . HB* 1 2
67 1 1 1 1 1 ASP QB A 1 . HB* 1 2
67 1 2 1 1 5 ARG H A 5 . HN 1 2
68 1 1 1 1 4 PHE HA A 4 . HA 1 2
68 1 2 1 1 5 ARG H A 5 . HN 1 2
69 1 1 1 1 5 ARG HA A 5 . HA 1 2
69 1 2 1 1 5 ARG QD A 5 . HD* 1 2
70 1 1 1 1 1 ASP QB A 1 . HB* 1 2
70 1 2 1 1 6 HIS HE1 A 6 . HE1 1 2
71 1 1 1 1 4 PHE HA A 4 . HA 1 2
71 1 2 1 1 6 HIS H A 6 . HN 1 2
72 1 1 1 1 5 ARG HA A 5 . HA 1 2
72 1 2 1 1 6 HIS H A 6 . HN 1 2
73 1 1 1 1 5 ARG QB A 5 . HB* 1 2
73 1 2 1 1 6 HIS H A 6 . HN 1 2
74 1 1 1 1 5 ARG H A 5 . HN 1 2
74 1 2 1 1 7 HIS H A 7 . HN 1 2
75 1 1 1 1 6 HIS HA A 6 . HA 1 2
75 1 2 1 1 7 HIS H A 7 . HN 1 2
76 1 1 1 1 7 HIS HA A 7 . HA 1 2
76 1 2 1 1 8 SER H A 8 . HN 1 2
77 1 1 1 1 2 ALA HA A 2 . HA 1 2
77 1 2 1 1 6 HIS HD2 A 6 . HD2 1 2
78 1 1 1 1 2 ALA MB A 2 . HB* 1 2
78 1 2 1 1 6 HIS HD2 A 6 . HD2 1 2
79 1 1 1 1 3 GLU HA A 3 . HA 1 2
79 1 2 1 1 6 HIS HD2 A 6 . HD2 1 2
80 1 1 1 1 6 HIS H A 6 . HN 1 2
80 1 2 1 1 6 HIS HD2 A 6 . HD2 1 2
81 1 1 1 1 3 GLU HA A 3 . HA 1 2
81 1 2 1 1 7 HIS HD2 A 7 . HD2 1 2
82 1 1 1 1 3 GLU QB A 3 . HB* 1 2
82 1 2 1 1 7 HIS HD2 A 7 . HD2 1 2
83 1 1 1 1 6 HIS H A 6 . HN 1 2
83 1 2 1 1 7 HIS HD2 A 7 . HD2 1 2
84 1 1 1 1 6 HIS QB A 6 . HB* 1 2
84 1 2 1 1 7 HIS HE1 A 7 . HE1 1 2
85 1 1 1 1 6 HIS QB A 6 . HB* 1 2
85 1 2 1 1 7 HIS HD2 A 7 . HD2 1 2
86 1 1 2 1 1 ASP HA B 1 . HA 1 2
86 1 2 2 1 2 ALA MB B 2 . HB* 1 2
87 1 1 2 1 1 ASP HA B 1 . HA 1 2
87 1 2 2 1 2 ALA H B 2 . HN 1 2
88 1 1 2 1 1 ASP QB B 1 . HB* 1 2
88 1 2 2 1 2 ALA H B 2 . HN 1 2
89 1 1 2 1 2 ALA H B 2 . HN 1 2
89 1 2 2 1 2 ALA HA B 2 . HA 1 2
90 1 1 2 1 2 ALA H B 2 . HN 1 2
90 1 2 2 1 5 ARG H B 5 . HN 1 2
91 1 1 2 1 2 ALA H B 2 . HN 1 2
91 1 2 2 1 5 ARG QG B 5 . HG* 1 2
92 1 1 2 1 2 ALA MB B 2 . HB* 1 2
92 1 2 2 1 3 GLU H B 3 . HN 1 2
93 1 1 2 1 2 ALA H B 2 . HN 1 2
93 1 2 2 1 3 GLU H B 3 . HN 1 2
94 1 1 2 1 3 GLU H B 3 . HN 1 2
94 1 2 2 1 3 GLU QB B 3 . HB* 1 2
95 1 1 2 1 3 GLU H B 3 . HN 1 2
95 1 2 2 1 5 ARG H B 5 . HN 1 2
96 1 1 2 1 3 GLU H B 3 . HN 1 2
96 1 2 2 1 6 HIS HD2 B 6 . HD2 1 2
97 1 1 2 1 2 ALA MB B 2 . HB* 1 2
97 1 2 2 1 4 PHE H B 4 . HN 1 2
98 1 1 2 1 2 ALA MB B 2 . HB* 1 2
98 1 2 2 1 4 PHE QB B 4 . HB* 1 2
99 1 1 2 1 2 ALA MB B 2 . HB* 1 2
99 1 2 2 1 4 PHE QD B 4 . HD* 1 2
100 1 1 2 1 2 ALA MB B 2 . HB* 1 2
100 1 2 2 1 4 PHE QE B 4 . HE* 1 2
101 1 1 2 1 3 GLU H B 3 . HN 1 2
101 1 2 2 1 4 PHE H B 4 . HN 1 2
102 1 1 2 1 3 GLU HA B 3 . HA 1 2
102 1 2 2 1 4 PHE H B 4 . HN 1 2
103 1 1 2 1 4 PHE H B 4 . HN 1 2
103 1 2 2 1 4 PHE QD B 4 . HD* 1 2
104 1 1 2 1 4 PHE H B 4 . HN 1 2
104 1 2 2 1 4 PHE HA B 4 . HA 1 2
105 1 1 2 1 4 PHE H B 4 . HN 1 2
105 1 2 2 1 4 PHE QB B 4 . HB* 1 2
106 1 1 2 1 4 PHE QB B 4 . HB* 1 2
106 1 2 2 1 4 PHE QD B 4 . HD* 1 2
107 1 1 2 1 4 PHE QD B 4 . HD* 1 2
107 1 2 2 1 5 ARG QG B 5 . HG* 1 2
108 1 1 2 1 4 PHE QE B 4 . HE* 1 2
108 1 2 2 1 5 ARG QG B 5 . HG* 1 2
109 1 1 2 1 4 PHE H B 4 . HN 1 2
109 1 2 2 1 6 HIS H B 6 . HN 1 2
110 1 1 2 1 1 ASP QB B 1 . HB* 1 2
110 1 2 2 1 5 ARG HG2 B 5 . HG2 1 2
111 1 1 2 1 1 ASP QB B 1 . HB* 1 2
111 1 2 2 1 5 ARG HG3 B 5 . HG1 1 2
112 1 1 2 1 2 ALA MB B 2 . HB* 1 2
112 1 2 2 1 5 ARG H B 5 . HN 1 2
113 1 1 2 1 4 PHE H B 4 . HN 1 2
113 1 2 2 1 5 ARG H B 5 . HN 1 2
114 1 1 2 1 4 PHE QB B 4 . HB* 1 2
114 1 2 2 1 5 ARG H B 5 . HN 1 2
115 1 1 2 1 5 ARG H B 5 . HN 1 2
115 1 2 2 1 5 ARG HA B 5 . HA 1 2
116 1 1 2 1 5 ARG H B 5 . HN 1 2
116 1 2 2 1 5 ARG QG B 5 . HG* 1 2
117 1 1 2 1 5 ARG HA B 5 . HA 1 2
117 1 2 2 1 5 ARG QG B 5 . HG* 1 2
118 1 1 2 1 5 ARG H B 5 . HN 1 2
118 1 2 2 1 6 HIS QB B 6 . HB* 1 2
119 1 1 2 1 3 GLU HA B 3 . HA 1 2
119 1 2 2 1 6 HIS H B 6 . HN 1 2
120 1 1 2 1 1 ASP QB B 1 . HB* 1 2
120 1 2 2 1 6 HIS H B 6 . HN 1 2
121 1 1 2 1 5 ARG QG B 5 . HG* 1 2
121 1 2 2 1 6 HIS H B 6 . HN 1 2
122 1 1 2 1 5 ARG H B 5 . HN 1 2
122 1 2 2 1 6 HIS H B 6 . HN 1 2
123 1 1 2 1 6 HIS H B 6 . HN 1 2
123 1 2 2 1 6 HIS HA B 6 . HA 1 2
124 1 1 2 1 6 HIS H B 6 . HN 1 2
124 1 2 2 1 6 HIS QB B 6 . HB* 1 2
125 1 1 2 1 3 GLU QG B 3 . HG* 1 2
125 1 2 2 1 7 HIS HD2 B 7 . HD2 1 2
126 1 1 2 1 6 HIS QB B 6 . HB* 1 2
126 1 2 2 1 7 HIS H B 7 . HN 1 2
127 1 1 2 1 6 HIS H B 6 . HN 1 2
127 1 2 2 1 7 HIS H B 7 . HN 1 2
128 1 1 2 1 7 HIS H B 7 . HN 1 2
128 1 2 2 1 7 HIS HD2 B 7 . HD2 1 2
129 1 1 2 1 7 HIS H B 7 . HN 1 2
129 1 2 2 1 7 HIS HA B 7 . HA 1 2
130 1 1 2 1 7 HIS H B 7 . HN 1 2
130 1 2 2 1 7 HIS QB B 7 . HB* 1 2
131 1 1 2 1 7 HIS H B 7 . HN 1 2
131 1 2 2 1 8 SER H B 8 . HN 1 2
132 1 1 2 1 8 SER H B 8 . HN 1 2
132 1 2 2 1 8 SER QB B 8 . HB* 1 2
133 1 1 2 1 8 SER HA B 8 . HA 1 2
133 1 2 2 1 9 GLY H B 9 . HN 1 2
134 1 1 2 1 9 GLY QA B 9 . HA* 1 2
134 1 2 2 1 10 TYR H B 10 . HN 1 2
135 1 1 2 1 10 TYR H B 10 . HN 1 2
135 1 2 2 1 10 TYR HA B 10 . HA 1 2
136 1 1 2 1 10 TYR H B 10 . HN 1 2
136 1 2 2 1 10 TYR QB B 10 . HB* 1 2
137 1 1 2 1 10 TYR QB B 10 . HB* 1 2
137 1 2 2 1 10 TYR HD1 B 10 . HD1 1 2
138 1 1 2 1 10 TYR H B 10 . HN 1 2
138 1 2 2 1 10 TYR HD1 B 10 . HD1 1 2
139 1 1 2 1 1 ASP QB B 1 . HB* 1 2
139 1 2 2 1 2 ALA MB B 2 . HB* 1 2
140 1 1 2 1 2 ALA H B 2 . HN 1 2
140 1 2 2 1 4 PHE QD B 4 . HD* 1 2
141 1 1 2 1 2 ALA H B 2 . HN 1 2
141 1 2 2 1 5 ARG QD B 5 . HD* 1 2
142 1 1 2 1 2 ALA HA B 2 . HA 1 2
142 1 2 2 1 3 GLU H B 3 . HN 1 2
143 1 1 2 1 3 GLU H B 3 . HN 1 2
143 1 2 2 1 3 GLU QG B 3 . HG* 1 2
144 1 1 2 1 3 GLU H B 3 . HN 1 2
144 1 2 2 1 4 PHE QD B 4 . HD* 1 2
145 1 1 2 1 2 ALA HA B 2 . HA 1 2
145 1 2 2 1 4 PHE H B 4 . HN 1 2
146 1 1 2 1 3 GLU QB B 3 . HB* 1 2
146 1 2 2 1 4 PHE H B 4 . HN 1 2
147 1 1 2 1 3 GLU QG B 3 . HG* 1 2
147 1 2 2 1 4 PHE H B 4 . HN 1 2
148 1 1 2 1 4 PHE HA B 4 . HA 1 2
148 1 2 2 1 7 HIS QB B 7 . HB* 1 2
149 1 1 2 1 1 ASP QB B 1 . HB* 1 2
149 1 2 2 1 5 ARG H B 5 . HN 1 2
150 1 1 2 1 4 PHE HA B 4 . HA 1 2
150 1 2 2 1 5 ARG H B 5 . HN 1 2
151 1 1 2 1 5 ARG HA B 5 . HA 1 2
151 1 2 2 1 5 ARG QD B 5 . HD* 1 2
152 1 1 2 1 1 ASP QB B 1 . HB* 1 2
152 1 2 2 1 6 HIS HE1 B 6 . HE1 1 2
153 1 1 2 1 4 PHE HA B 4 . HA 1 2
153 1 2 2 1 6 HIS H B 6 . HN 1 2
154 1 1 2 1 5 ARG HA B 5 . HA 1 2
154 1 2 2 1 6 HIS H B 6 . HN 1 2
155 1 1 2 1 5 ARG QB B 5 . HB* 1 2
155 1 2 2 1 6 HIS H B 6 . HN 1 2
156 1 1 2 1 5 ARG H B 5 . HN 1 2
156 1 2 2 1 7 HIS H B 7 . HN 1 2
157 1 1 2 1 6 HIS HA B 6 . HA 1 2
157 1 2 2 1 7 HIS H B 7 . HN 1 2
158 1 1 2 1 7 HIS HA B 7 . HA 1 2
158 1 2 2 1 8 SER H B 8 . HN 1 2
159 1 1 2 1 2 ALA HA B 2 . HA 1 2
159 1 2 2 1 6 HIS HD2 B 6 . HD2 1 2
160 1 1 2 1 2 ALA MB B 2 . HB* 1 2
160 1 2 2 1 6 HIS HD2 B 6 . HD2 1 2
161 1 1 2 1 3 GLU HA B 3 . HA 1 2
161 1 2 2 1 6 HIS HD2 B 6 . HD2 1 2
162 1 1 2 1 6 HIS H B 6 . HN 1 2
162 1 2 2 1 6 HIS HD2 B 6 . HD2 1 2
163 1 1 2 1 3 GLU HA B 3 . HA 1 2
163 1 2 2 1 7 HIS HD2 B 7 . HD2 1 2
164 1 1 2 1 3 GLU QB B 3 . HB* 1 2
164 1 2 2 1 7 HIS HD2 B 7 . HD2 1 2
165 1 1 2 1 6 HIS H B 6 . HN 1 2
165 1 2 2 1 7 HIS HD2 B 7 . HD2 1 2
166 1 1 2 1 6 HIS QB B 6 . HB* 1 2
166 1 2 2 1 7 HIS HE1 B 7 . HE1 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.5 1.5 5.5 1 2
2 1 . . . . . 5.5 1.5 5.5 1 2
3 1 . . . . . 3.5 0.0 3.5 1 2
4 1 . . . . . 4.0 0.0 4.0 1 2
5 1 . . . . . 2.5 0.0 2.5 1 2
6 1 . . . . . 3.5 0.0 3.5 1 2
7 1 . . . . . 3.0 0.0 3.0 1 2
8 1 . . . . . 5.5 0.0 5.5 1 2
9 1 . . . . . 5.5 0.0 5.5 1 2
10 1 . . . . . 3.0 0.0 3.0 1 2
11 1 . . . . . 5.5 0.0 5.5 1 2
12 1 . . . . . 3.5 0.0 3.5 1 2
13 1 . . . . . 5.0 0.0 5.0 1 2
14 1 . . . . . 3.5 0.0 3.5 1 2
15 1 . . . . . 3.0 0.0 3.0 1 2
16 1 . . . . . 4.0 0.0 4.0 1 2
17 1 . . . . . 2.5 -1.0 2.5 1 2
18 1 . . . . . 3.5 0.0 3.5 1 2
19 1 . . . . . 3.0 0.0 3.0 1 2
20 1 . . . . . 3.5 0.0 3.5 1 2
21 1 . . . . . 2.5 0.0 2.5 1 2
22 1 . . . . . 3.0 0.0 3.0 1 2
23 1 . . . . . 3.0 0.0 3.0 1 2
24 1 . . . . . . 0.0 3.0 1 2
25 1 . . . . . 4.0 0.0 4.0 1 2
26 1 . . . . . 4.0 0.0 4.0 1 2
27 1 . . . . . 4.0 0.0 4.0 1 2
28 1 . . . . . 3.5 0.0 3.5 1 2
29 1 . . . . . 3.5 0.0 3.5 1 2
30 1 . . . . . 3.0 0.0 3.0 1 2
31 1 . . . . . 2.5 0.0 2.5 1 2
32 1 . . . . . 4.0 0.0 4.0 1 2
33 1 . . . . . 3.0 0.0 3.0 1 2
34 1 . . . . . 4.0 0.0 4.0 1 2
35 1 . . . . . 4.0 0.0 4.0 1 2
36 1 . . . . . 4.5 0.0 4.5 1 2
37 1 . . . . . 4.0 0.0 4.0 1 2
38 1 . . . . . . 0.0 3.5 1 2
39 1 . . . . . 4.0 0.0 4.0 1 2
40 1 . . . . . 2.5 0.0 2.5 1 2
41 1 . . . . . 3.0 0.0 3.0 1 2
42 1 . . . . . 3.5 0.0 3.5 1 2
43 1 . . . . . 4.0 0.5 4.0 1 2
44 1 . . . . . 3.5 0.0 3.5 1 2
45 1 . . . . . 2.5 0.0 2.5 1 2
46 1 . . . . . 2.5 0.0 2.5 1 2
47 1 . . . . . 3.0 0.0 3.0 1 2
48 1 . . . . . 3.5 0.0 3.5 1 2
49 1 . . . . . 4.5 0.0 4.5 1 2
50 1 . . . . . 3.0 0.0 3.0 1 2
51 1 . . . . . 3.0 0.0 3.0 1 2
52 1 . . . . . 3.0 0.0 3.0 1 2
53 1 . . . . . 3.0 0.0 3.0 1 2
54 1 . . . . . 3.5 0.0 3.5 1 2
55 1 . . . . . 3.5 0.0 3.5 1 2
56 1 . . . . . 2.5 0.0 2.5 1 2
57 1 . . . . . 4.5 0.0 4.5 1 2
58 1 . . . . . 4.5 0.0 4.5 1 2
59 1 . . . . . 5.0 0.0 5.0 1 2
60 1 . . . . . 2.5 0.0 2.5 1 2
61 1 . . . . . 4.5 0.0 4.5 1 2
62 1 . . . . . 4.5 0.0 4.5 1 2
63 1 . . . . . 4.5 0.0 4.5 1 2
64 1 . . . . . 3.5 0.0 3.5 1 2
65 1 . . . . . 4.5 0.0 4.5 1 2
66 1 . . . . . 4.5 0.0 4.5 1 2
67 1 . . . . . 4.5 0.0 4.5 1 2
68 1 . . . . . 3.5 0.0 3.5 1 2
69 1 . . . . . 4.5 0.0 4.5 1 2
70 1 . . . . . 3.5 0.0 3.5 1 2
71 1 . . . . . 4.5 0.0 4.5 1 2
72 1 . . . . . 3.5 0.0 3.5 1 2
73 1 . . . . . 4.0 0.0 4.0 1 2
74 1 . . . . . 4.0 0.0 4.0 1 2
75 1 . . . . . 3.5 0.0 3.5 1 2
76 1 . . . . . 3.5 0.0 3.5 1 2
77 1 . . . . . 4.5 0.0 4.5 1 2
78 1 . . . . . 5.5 0.0 5.5 1 2
79 1 . . . . . 3.5 0.0 3.5 1 2
80 1 . . . . . 4.0 0.0 4.0 1 2
81 1 . . . . . 3.5 0.0 3.5 1 2
82 1 . . . . . 4.0 0.0 4.0 1 2
83 1 . . . . . 4.5 0.5 4.5 1 2
84 1 . . . . . 5.5 0.0 5.5 1 2
85 1 . . . . . 4.0 0.0 4.0 1 2
86 1 . . . . . 4.0 0.0 4.0 1 2
87 1 . . . . . 2.5 0.0 2.5 1 2
88 1 . . . . . 3.5 0.0 3.5 1 2
89 1 . . . . . 3.0 0.0 3.0 1 2
90 1 . . . . . 5.5 0.0 5.5 1 2
91 1 . . . . . 5.5 0.0 5.5 1 2
92 1 . . . . . 3.0 0.0 3.0 1 2
93 1 . . . . . 5.5 0.0 5.5 1 2
94 1 . . . . . 3.5 0.0 3.5 1 2
95 1 . . . . . 5.0 0.0 5.0 1 2
96 1 . . . . . 3.5 0.0 3.5 1 2
97 1 . . . . . 3.0 0.0 3.0 1 2
98 1 . . . . . 4.0 0.0 4.0 1 2
99 1 . . . . . 2.5 -1.0 2.5 1 2
100 1 . . . . . 3.5 0.0 3.5 1 2
101 1 . . . . . 3.0 0.0 3.0 1 2
102 1 . . . . . 3.5 0.0 3.5 1 2
103 1 . . . . . 2.5 0.0 2.5 1 2
104 1 . . . . . 3.0 0.0 3.0 1 2
105 1 . . . . . 3.0 0.0 3.0 1 2
106 1 . . . . . . 0.0 3.0 1 2
107 1 . . . . . 4.0 0.0 4.0 1 2
108 1 . . . . . 4.0 0.0 4.0 1 2
109 1 . . . . . 4.0 0.0 4.0 1 2
110 1 . . . . . 3.5 0.0 3.5 1 2
111 1 . . . . . 3.5 0.0 3.5 1 2
112 1 . . . . . 3.0 0.0 3.0 1 2
113 1 . . . . . 2.5 0.0 2.5 1 2
114 1 . . . . . 4.0 0.0 4.0 1 2
115 1 . . . . . 3.0 0.0 3.0 1 2
116 1 . . . . . 4.0 0.0 4.0 1 2
117 1 . . . . . 4.0 0.0 4.0 1 2
118 1 . . . . . 4.5 0.0 4.5 1 2
119 1 . . . . . 4.0 0.0 4.0 1 2
120 1 . . . . . . 0.0 3.5 1 2
121 1 . . . . . 4.0 0.0 4.0 1 2
122 1 . . . . . 2.5 0.0 2.5 1 2
123 1 . . . . . 3.0 0.0 3.0 1 2
124 1 . . . . . 3.5 0.0 3.5 1 2
125 1 . . . . . 4.0 0.5 4.0 1 2
126 1 . . . . . 3.5 0.0 3.5 1 2
127 1 . . . . . 2.5 0.0 2.5 1 2
128 1 . . . . . 2.5 0.0 2.5 1 2
129 1 . . . . . 3.0 0.0 3.0 1 2
130 1 . . . . . 3.5 0.0 3.5 1 2
131 1 . . . . . 4.5 0.0 4.5 1 2
132 1 . . . . . 3.0 0.0 3.0 1 2
133 1 . . . . . 3.0 0.0 3.0 1 2
134 1 . . . . . 3.0 0.0 3.0 1 2
135 1 . . . . . 3.0 0.0 3.0 1 2
136 1 . . . . . 3.5 0.0 3.5 1 2
137 1 . . . . . 3.5 0.0 3.5 1 2
138 1 . . . . . 2.5 0.0 2.5 1 2
139 1 . . . . . 4.5 0.0 4.5 1 2
140 1 . . . . . 4.5 0.0 4.5 1 2
141 1 . . . . . 5.0 0.0 5.0 1 2
142 1 . . . . . 2.5 0.0 2.5 1 2
143 1 . . . . . 4.5 0.0 4.5 1 2
144 1 . . . . . 4.5 0.0 4.5 1 2
145 1 . . . . . 4.5 0.0 4.5 1 2
146 1 . . . . . 3.5 0.0 3.5 1 2
147 1 . . . . . 4.5 0.0 4.5 1 2
148 1 . . . . . 4.5 0.0 4.5 1 2
149 1 . . . . . 4.5 0.0 4.5 1 2
150 1 . . . . . 3.5 0.0 3.5 1 2
151 1 . . . . . 4.5 0.0 4.5 1 2
152 1 . . . . . 3.5 0.0 3.5 1 2
153 1 . . . . . 4.5 0.0 4.5 1 2
154 1 . . . . . 3.5 0.0 3.5 1 2
155 1 . . . . . 4.0 0.0 4.0 1 2
156 1 . . . . . 4.0 0.0 4.0 1 2
157 1 . . . . . 3.5 0.0 3.5 1 2
158 1 . . . . . 3.5 0.0 3.5 1 2
159 1 . . . . . 4.5 0.0 4.5 1 2
160 1 . . . . . 5.5 0.0 5.5 1 2
161 1 . . . . . 3.5 0.0 3.5 1 2
162 1 . . . . . 4.0 0.0 4.0 1 2
163 1 . . . . . 3.5 0.0 3.5 1 2
164 1 . . . . . 4.0 0.0 4.0 1 2
165 1 . . . . . 4.5 0.5 4.5 1 2
166 1 . . . . . 5.5 0.0 5.5 1 2
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 ASP C C 0.518 5.247 -1.930 1.00 . A A . 1 ASP C 1 1
1 2 1 1 1 ASP CA C 0.480 6.388 -0.917 1.00 . A A . 1 ASP CA 1 1
1 3 1 1 1 ASP CB C 0.690 5.843 0.499 1.00 . A A . 1 ASP CB 1 1
1 4 1 1 1 ASP CG C 0.690 6.939 1.548 1.00 . A A . 1 ASP CG 1 1
1 5 1 1 1 ASP H1 H -1.075 7.240 -1.960 1.00 . A A . 1 ASP H1 1 1
1 6 1 1 1 ASP H2 H -0.703 8.011 -0.472 1.00 . A A . 1 ASP H2 1 1
1 7 1 1 1 ASP H3 H -1.526 6.505 -0.479 1.00 . A A . 1 ASP H3 1 1
1 8 1 1 1 ASP HA H 1.266 7.091 -1.149 1.00 . A A . 1 ASP HA 1 1
1 9 1 1 1 ASP HB2 H -0.103 5.150 0.731 1.00 . A A . 1 ASP HB2 1 1
1 10 1 1 1 ASP HB3 H 1.639 5.327 0.544 1.00 . A A . 1 ASP HB3 1 1
1 11 1 1 1 ASP N N -0.824 7.100 -0.961 1.00 . A A . 1 ASP N 1 1
1 12 1 1 1 ASP O O -0.524 4.792 -2.405 1.00 . A A . 1 ASP O 1 1
1 13 1 1 1 ASP OD1 O 0.732 8.128 1.166 1.00 . A A . 1 ASP OD1 1 1
1 14 1 1 1 ASP OD2 O 0.647 6.608 2.752 1.00 . A A . 1 ASP OD2 1 1
1 15 1 1 2 ALA C C 2.601 2.518 -2.565 1.00 . A A . 2 ALA C 1 1
1 16 1 1 2 ALA CA C 1.898 3.705 -3.212 1.00 . A A . 2 ALA CA 1 1
1 17 1 1 2 ALA CB C 2.680 4.189 -4.424 1.00 . A A . 2 ALA CB 1 1
1 18 1 1 2 ALA H H 2.515 5.197 -1.846 1.00 . A A . 2 ALA H 1 1
1 19 1 1 2 ALA HA H 0.918 3.391 -3.547 1.00 . A A . 2 ALA HA 1 1
1 20 1 1 2 ALA HB1 H 3.631 3.681 -4.466 1.00 . A A . 2 ALA HB1 1 1
1 21 1 1 2 ALA HB2 H 2.844 5.254 -4.345 1.00 . A A . 2 ALA HB2 1 1
1 22 1 1 2 ALA HB3 H 2.120 3.977 -5.323 1.00 . A A . 2 ALA HB3 1 1
1 23 1 1 2 ALA N N 1.723 4.792 -2.257 1.00 . A A . 2 ALA N 1 1
1 24 1 1 2 ALA O O 2.984 2.570 -1.397 1.00 . A A . 2 ALA O 1 1
1 25 1 1 3 GLU C C 4.769 0.558 -2.207 1.00 . A A . 3 GLU C 1 1
1 26 1 1 3 GLU CA C 3.419 0.238 -2.843 1.00 . A A . 3 GLU CA 1 1
1 27 1 1 3 GLU CB C 3.607 -0.762 -3.987 1.00 . A A . 3 GLU CB 1 1
1 28 1 1 3 GLU CD C 2.603 -2.866 -3.024 1.00 . A A . 3 GLU CD 1 1
1 29 1 1 3 GLU CG C 3.862 -2.186 -3.519 1.00 . A A . 3 GLU CG 1 1
1 30 1 1 3 GLU H H 2.438 1.470 -4.258 1.00 . A A . 3 GLU H 1 1
1 31 1 1 3 GLU HA H 2.779 -0.204 -2.095 1.00 . A A . 3 GLU HA 1 1
1 32 1 1 3 GLU HB2 H 2.717 -0.761 -4.599 1.00 . A A . 3 GLU HB2 1 1
1 33 1 1 3 GLU HB3 H 4.447 -0.449 -4.590 1.00 . A A . 3 GLU HB3 1 1
1 34 1 1 3 GLU HG2 H 4.260 -2.757 -4.343 1.00 . A A . 3 GLU HG2 1 1
1 35 1 1 3 GLU HG3 H 4.582 -2.164 -2.715 1.00 . A A . 3 GLU HG3 1 1
1 36 1 1 3 GLU N N 2.766 1.447 -3.335 1.00 . A A . 3 GLU N 1 1
1 37 1 1 3 GLU O O 5.156 -0.048 -1.208 1.00 . A A . 3 GLU O 1 1
1 38 1 1 3 GLU OE1 O 1.708 -2.159 -2.518 1.00 . A A . 3 GLU OE1 1 1
1 39 1 1 3 GLU OE2 O 2.508 -4.106 -3.151 1.00 . A A . 3 GLU OE2 1 1
1 40 1 1 4 PHE C C 6.644 2.637 -0.939 1.00 . A A . 4 PHE C 1 1
1 41 1 1 4 PHE CA C 6.787 1.908 -2.270 1.00 . A A . 4 PHE CA 1 1
1 42 1 1 4 PHE CB C 7.516 2.801 -3.277 1.00 . A A . 4 PHE CB 1 1
1 43 1 1 4 PHE CD1 C 7.053 5.183 -2.635 1.00 . A A . 4 PHE CD1 1 1
1 44 1 1 4 PHE CD2 C 6.004 4.313 -4.592 1.00 . A A . 4 PHE CD2 1 1
1 45 1 1 4 PHE CE1 C 6.438 6.402 -2.844 1.00 . A A . 4 PHE CE1 1 1
1 46 1 1 4 PHE CE2 C 5.385 5.531 -4.806 1.00 . A A . 4 PHE CE2 1 1
1 47 1 1 4 PHE CG C 6.843 4.125 -3.506 1.00 . A A . 4 PHE CG 1 1
1 48 1 1 4 PHE CZ C 5.603 6.577 -3.931 1.00 . A A . 4 PHE CZ 1 1
1 49 1 1 4 PHE H H 5.124 1.965 -3.579 1.00 . A A . 4 PHE H 1 1
1 50 1 1 4 PHE HA H 7.366 1.010 -2.113 1.00 . A A . 4 PHE HA 1 1
1 51 1 1 4 PHE HB2 H 8.515 2.994 -2.919 1.00 . A A . 4 PHE HB2 1 1
1 52 1 1 4 PHE HB3 H 7.573 2.287 -4.226 1.00 . A A . 4 PHE HB3 1 1
1 53 1 1 4 PHE HD1 H 7.706 5.047 -1.786 1.00 . A A . 4 PHE HD1 1 1
1 54 1 1 4 PHE HD2 H 5.832 3.495 -5.276 1.00 . A A . 4 PHE HD2 1 1
1 55 1 1 4 PHE HE1 H 6.610 7.218 -2.158 1.00 . A A . 4 PHE HE1 1 1
1 56 1 1 4 PHE HE2 H 4.733 5.664 -5.656 1.00 . A A . 4 PHE HE2 1 1
1 57 1 1 4 PHE HZ H 5.121 7.529 -4.095 1.00 . A A . 4 PHE HZ 1 1
1 58 1 1 4 PHE N N 5.484 1.513 -2.788 1.00 . A A . 4 PHE N 1 1
1 59 1 1 4 PHE O O 7.519 2.557 -0.078 1.00 . A A . 4 PHE O 1 1
1 60 1 1 5 ARG C C 4.747 3.187 1.542 1.00 . A A . 5 ARG C 1 1
1 61 1 1 5 ARG CA C 5.274 4.101 0.440 1.00 . A A . 5 ARG CA 1 1
1 62 1 1 5 ARG CB C 4.277 5.225 0.165 1.00 . A A . 5 ARG CB 1 1
1 63 1 1 5 ARG CD C 3.819 7.569 0.947 1.00 . A A . 5 ARG CD 1 1
1 64 1 1 5 ARG CG C 4.022 6.121 1.366 1.00 . A A . 5 ARG CG 1 1
1 65 1 1 5 ARG CZ C 5.137 9.044 2.423 1.00 . A A . 5 ARG CZ 1 1
1 66 1 1 5 ARG H H 4.875 3.376 -1.507 1.00 . A A . 5 ARG H 1 1
1 67 1 1 5 ARG HA H 6.208 4.532 0.767 1.00 . A A . 5 ARG HA 1 1
1 68 1 1 5 ARG HB2 H 4.655 5.837 -0.640 1.00 . A A . 5 ARG HB2 1 1
1 69 1 1 5 ARG HB3 H 3.338 4.788 -0.137 1.00 . A A . 5 ARG HB3 1 1
1 70 1 1 5 ARG HD2 H 4.542 7.814 0.184 1.00 . A A . 5 ARG HD2 1 1
1 71 1 1 5 ARG HD3 H 2.824 7.676 0.543 1.00 . A A . 5 ARG HD3 1 1
1 72 1 1 5 ARG HE H 3.176 8.713 2.588 1.00 . A A . 5 ARG HE 1 1
1 73 1 1 5 ARG HG2 H 3.135 5.777 1.877 1.00 . A A . 5 ARG HG2 1 1
1 74 1 1 5 ARG HG3 H 4.868 6.063 2.032 1.00 . A A . 5 ARG HG3 1 1
1 75 1 1 5 ARG HH11 H 6.222 8.140 0.972 1.00 . A A . 5 ARG HH11 1 1
1 76 1 1 5 ARG HH12 H 7.114 9.187 2.022 1.00 . A A . 5 ARG HH12 1 1
1 77 1 1 5 ARG HH21 H 4.355 10.086 3.967 1.00 . A A . 5 ARG HH21 1 1
1 78 1 1 5 ARG HH22 H 6.057 10.289 3.722 1.00 . A A . 5 ARG HH22 1 1
1 79 1 1 5 ARG N N 5.535 3.352 -0.783 1.00 . A A . 5 ARG N 1 1
1 80 1 1 5 ARG NE N 3.978 8.492 2.069 1.00 . A A . 5 ARG NE 1 1
1 81 1 1 5 ARG NH1 N 6.249 8.767 1.749 1.00 . A A . 5 ARG NH1 1 1
1 82 1 1 5 ARG NH2 N 5.187 9.874 3.455 1.00 . A A . 5 ARG NH2 1 1
1 83 1 1 5 ARG O O 5.113 3.330 2.709 1.00 . A A . 5 ARG O 1 1
1 84 1 1 6 HIS C C 4.384 0.385 2.679 1.00 . A A . 6 HIS C 1 1
1 85 1 1 6 HIS CA C 3.311 1.310 2.127 1.00 . A A . 6 HIS CA 1 1
1 86 1 1 6 HIS CB C 2.216 0.471 1.469 1.00 . A A . 6 HIS CB 1 1
1 87 1 1 6 HIS CD2 C 0.777 1.326 -0.493 1.00 . A A . 6 HIS CD2 1 1
1 88 1 1 6 HIS CE1 C -0.489 2.719 0.569 1.00 . A A . 6 HIS CE1 1 1
1 89 1 1 6 HIS CG C 1.150 1.282 0.808 1.00 . A A . 6 HIS CG 1 1
1 90 1 1 6 HIS H H 3.635 2.180 0.220 1.00 . A A . 6 HIS H 1 1
1 91 1 1 6 HIS HA H 2.885 1.880 2.937 1.00 . A A . 6 HIS HA 1 1
1 92 1 1 6 HIS HB2 H 2.662 -0.161 0.717 1.00 . A A . 6 HIS HB2 1 1
1 93 1 1 6 HIS HB3 H 1.747 -0.147 2.220 1.00 . A A . 6 HIS HB3 1 1
1 94 1 1 6 HIS HD1 H 0.357 2.370 2.430 1.00 . A A . 6 HIS HD1 1 1
1 95 1 1 6 HIS HD2 H 1.208 0.745 -1.295 1.00 . A A . 6 HIS HD2 1 1
1 96 1 1 6 HIS HE1 H -1.243 3.457 0.800 1.00 . A A . 6 HIS HE1 1 1
1 97 1 1 6 HIS N N 3.887 2.247 1.166 1.00 . A A . 6 HIS N 1 1
1 98 1 1 6 HIS ND1 N 0.337 2.172 1.470 1.00 . A A . 6 HIS ND1 1 1
1 99 1 1 6 HIS NE2 N -0.261 2.241 -0.638 1.00 . A A . 6 HIS NE2 1 1
1 100 1 1 6 HIS O O 4.434 0.116 3.880 1.00 . A A . 6 HIS O 1 1
1 101 1 1 7 HIS C C 7.604 -0.248 2.407 1.00 . A A . 7 HIS C 1 1
1 102 1 1 7 HIS CA C 6.306 -1.011 2.168 1.00 . A A . 7 HIS CA 1 1
1 103 1 1 7 HIS CB C 6.506 -2.066 1.079 1.00 . A A . 7 HIS CB 1 1
1 104 1 1 7 HIS CD2 C 4.179 -2.615 0.069 1.00 . A A . 7 HIS CD2 1 1
1 105 1 1 7 HIS CE1 C 3.910 -4.605 0.869 1.00 . A A . 7 HIS CE1 1 1
1 106 1 1 7 HIS CG C 5.285 -2.892 0.813 1.00 . A A . 7 HIS CG 1 1
1 107 1 1 7 HIS H H 5.131 0.146 0.846 1.00 . A A . 7 HIS H 1 1
1 108 1 1 7 HIS HA H 6.015 -1.503 3.083 1.00 . A A . 7 HIS HA 1 1
1 109 1 1 7 HIS HB2 H 6.781 -1.574 0.158 1.00 . A A . 7 HIS HB2 1 1
1 110 1 1 7 HIS HB3 H 7.302 -2.733 1.377 1.00 . A A . 7 HIS HB3 1 1
1 111 1 1 7 HIS HD1 H 5.712 -4.651 1.895 1.00 . A A . 7 HIS HD1 1 1
1 112 1 1 7 HIS HD2 H 3.978 -1.689 -0.452 1.00 . A A . 7 HIS HD2 1 1
1 113 1 1 7 HIS HE1 H 3.489 -5.569 1.111 1.00 . A A . 7 HIS HE1 1 1
1 114 1 1 7 HIS N N 5.232 -0.105 1.788 1.00 . A A . 7 HIS N 1 1
1 115 1 1 7 HIS ND1 N 5.092 -4.160 1.315 1.00 . A A . 7 HIS ND1 1 1
1 116 1 1 7 HIS NE2 N 3.319 -3.706 0.107 1.00 . A A . 7 HIS NE2 1 1
1 117 1 1 7 HIS O O 7.723 0.924 2.050 1.00 . A A . 7 HIS O 1 1
1 118 1 1 8 SER C C 11.006 -1.286 3.058 1.00 . A A . 8 SER C 1 1
1 119 1 1 8 SER CA C 9.865 -0.305 3.306 1.00 . A A . 8 SER CA 1 1
1 120 1 1 8 SER CB C 9.905 0.182 4.757 1.00 . A A . 8 SER CB 1 1
1 121 1 1 8 SER H H 8.418 -1.851 3.277 1.00 . A A . 8 SER H 1 1
1 122 1 1 8 SER HA H 9.985 0.542 2.649 1.00 . A A . 8 SER HA 1 1
1 123 1 1 8 SER HB2 H 9.041 0.802 4.949 1.00 . A A . 8 SER HB2 1 1
1 124 1 1 8 SER HB3 H 9.891 -0.669 5.421 1.00 . A A . 8 SER HB3 1 1
1 125 1 1 8 SER HG H 11.384 0.766 5.900 1.00 . A A . 8 SER HG 1 1
1 126 1 1 8 SER N N 8.575 -0.920 3.016 1.00 . A A . 8 SER N 1 1
1 127 1 1 8 SER O O 10.799 -2.499 3.022 1.00 . A A . 8 SER O 1 1
1 128 1 1 8 SER OG O 11.075 0.941 5.008 1.00 . A A . 8 SER OG 1 1
1 129 1 1 9 GLY C C 13.732 -1.668 1.172 1.00 . A A . 9 GLY C 1 1
1 130 1 1 9 GLY CA C 13.369 -1.593 2.642 1.00 . A A . 9 GLY CA 1 1
1 131 1 1 9 GLY H H 12.315 0.222 2.924 1.00 . A A . 9 GLY H 1 1
1 132 1 1 9 GLY HA2 H 14.209 -1.196 3.191 1.00 . A A . 9 GLY HA2 1 1
1 133 1 1 9 GLY HA3 H 13.157 -2.589 3.000 1.00 . A A . 9 GLY HA3 1 1
1 134 1 1 9 GLY N N 12.211 -0.752 2.885 1.00 . A A . 9 GLY N 1 1
1 135 1 1 9 GLY O O 13.031 -1.117 0.324 1.00 . A A . 9 GLY O 1 1
1 136 1 1 10 TYR C C 14.215 -3.154 -1.371 1.00 . A A . 10 TYR C 1 1
1 137 1 1 10 TYR CA C 15.288 -2.498 -0.507 1.00 . A A . 10 TYR CA 1 1
1 138 1 1 10 TYR CB C 16.574 -3.325 -0.557 1.00 . A A . 10 TYR CB 1 1
1 139 1 1 10 TYR CD1 C 18.119 -2.691 1.338 1.00 . A A . 10 TYR CD1 1 1
1 140 1 1 10 TYR CD2 C 18.589 -1.830 -0.835 1.00 . A A . 10 TYR CD2 1 1
1 141 1 1 10 TYR CE1 C 19.223 -2.031 1.842 1.00 . A A . 10 TYR CE1 1 1
1 142 1 1 10 TYR CE2 C 19.696 -1.168 -0.338 1.00 . A A . 10 TYR CE2 1 1
1 143 1 1 10 TYR CG C 17.783 -2.602 -0.007 1.00 . A A . 10 TYR CG 1 1
1 144 1 1 10 TYR CZ C 20.009 -1.272 1.000 1.00 . A A . 10 TYR CZ 1 1
1 145 1 1 10 TYR H H 15.347 -2.770 1.592 1.00 . A A . 10 TYR H 1 1
1 146 1 1 10 TYR HA H 15.490 -1.511 -0.895 1.00 . A A . 10 TYR HA 1 1
1 147 1 1 10 TYR HB2 H 16.436 -4.226 0.021 1.00 . A A . 10 TYR HB2 1 1
1 148 1 1 10 TYR HB3 H 16.782 -3.590 -1.583 1.00 . A A . 10 TYR HB3 1 1
1 149 1 1 10 TYR HD1 H 17.502 -3.286 1.994 1.00 . A A . 10 TYR HD1 1 1
1 150 1 1 10 TYR HD2 H 18.341 -1.750 -1.884 1.00 . A A . 10 TYR HD2 1 1
1 151 1 1 10 TYR HE1 H 19.468 -2.113 2.891 1.00 . A A . 10 TYR HE1 1 1
1 152 1 1 10 TYR HE2 H 20.311 -0.573 -0.998 1.00 . A A . 10 TYR HE2 1 1
1 153 1 1 10 TYR HH H 21.762 -1.256 1.790 1.00 . A A . 10 TYR HH 1 1
1 154 1 1 10 TYR N N 14.831 -2.353 0.871 1.00 . A A . 10 TYR N 1 1
1 155 1 1 10 TYR O O 13.463 -2.416 -2.043 1.00 . A A . 10 TYR O 1 1
1 156 1 1 10 TYR OH O 21.109 -0.615 1.499 1.00 . A A . 10 TYR OH 1 1
1 157 1 1 11 NH2 HN1 H 14.767 -5.029 -0.807 1.00 . A A . 11 NH2 HN1 1 1
1 158 1 1 11 NH2 HN2 H 13.431 -4.945 -1.933 1.00 . A A . 11 NH2 HN2 1 1
1 159 1 1 11 NH2 N N 14.131 -4.483 -1.370 1.00 . A A . 11 NH2 N 1 1
1 160 2 1 1 ASP C C -0.342 -5.616 -0.696 1.00 . B B . 1 ASP C 1 1
1 161 2 1 1 ASP CA C -0.445 -6.488 0.549 1.00 . B B . 1 ASP CA 1 1
1 162 2 1 1 ASP CB C -1.262 -5.771 1.632 1.00 . B B . 1 ASP CB 1 1
1 163 2 1 1 ASP CG C -1.005 -6.325 3.022 1.00 . B B . 1 ASP CG 1 1
1 164 2 1 1 ASP H1 H 1.243 -5.965 1.605 1.00 . B B . 1 ASP H1 1 1
1 165 2 1 1 ASP H2 H 1.523 -7.030 0.288 1.00 . B B . 1 ASP H2 1 1
1 166 2 1 1 ASP H3 H 0.805 -7.618 1.733 1.00 . B B . 1 ASP H3 1 1
1 167 2 1 1 ASP HA H -0.937 -7.414 0.289 1.00 . B B . 1 ASP HA 1 1
1 168 2 1 1 ASP HB2 H -1.008 -4.722 1.631 1.00 . B B . 1 ASP HB2 1 1
1 169 2 1 1 ASP HB3 H -2.312 -5.882 1.412 1.00 . B B . 1 ASP HB3 1 1
1 170 2 1 1 ASP N N 0.902 -6.804 1.093 1.00 . B B . 1 ASP N 1 1
1 171 2 1 1 ASP O O 0.754 -5.246 -1.116 1.00 . B B . 1 ASP O 1 1
1 172 2 1 1 ASP OD1 O -0.800 -7.552 3.143 1.00 . B B . 1 ASP OD1 1 1
1 173 2 1 1 ASP OD2 O -1.010 -5.532 3.987 1.00 . B B . 1 ASP OD2 1 1
1 174 2 1 2 ALA C C -2.288 -3.167 -2.228 1.00 . B B . 2 ALA C 1 1
1 175 2 1 2 ALA CA C -1.528 -4.464 -2.483 1.00 . B B . 2 ALA CA 1 1
1 176 2 1 2 ALA CB C -2.157 -5.230 -3.635 1.00 . B B . 2 ALA CB 1 1
1 177 2 1 2 ALA H H -2.329 -5.619 -0.904 1.00 . B B . 2 ALA H 1 1
1 178 2 1 2 ALA HA H -0.509 -4.222 -2.756 1.00 . B B . 2 ALA HA 1 1
1 179 2 1 2 ALA HB1 H -3.194 -5.424 -3.413 1.00 . B B . 2 ALA HB1 1 1
1 180 2 1 2 ALA HB2 H -1.636 -6.166 -3.772 1.00 . B B . 2 ALA HB2 1 1
1 181 2 1 2 ALA HB3 H -2.086 -4.643 -4.540 1.00 . B B . 2 ALA HB3 1 1
1 182 2 1 2 ALA N N -1.489 -5.292 -1.284 1.00 . B B . 2 ALA N 1 1
1 183 2 1 2 ALA O O -2.840 -2.961 -1.149 1.00 . B B . 2 ALA O 1 1
1 184 2 1 3 GLU C C -4.427 -1.165 -2.648 1.00 . B B . 3 GLU C 1 1
1 185 2 1 3 GLU CA C -2.984 -1.007 -3.121 1.00 . B B . 3 GLU CA 1 1
1 186 2 1 3 GLU CB C -2.957 -0.281 -4.468 1.00 . B B . 3 GLU CB 1 1
1 187 2 1 3 GLU CD C -2.097 2.049 -4.015 1.00 . B B . 3 GLU CD 1 1
1 188 2 1 3 GLU CG C -3.299 1.196 -4.369 1.00 . B B . 3 GLU CG 1 1
1 189 2 1 3 GLU H H -1.839 -2.519 -4.063 1.00 . B B . 3 GLU H 1 1
1 190 2 1 3 GLU HA H -2.447 -0.414 -2.398 1.00 . B B . 3 GLU HA 1 1
1 191 2 1 3 GLU HB2 H -1.968 -0.371 -4.892 1.00 . B B . 3 GLU HB2 1 1
1 192 2 1 3 GLU HB3 H -3.668 -0.750 -5.130 1.00 . B B . 3 GLU HB3 1 1
1 193 2 1 3 GLU HG2 H -3.688 1.528 -5.319 1.00 . B B . 3 GLU HG2 1 1
1 194 2 1 3 GLU HG3 H -4.052 1.328 -3.606 1.00 . B B . 3 GLU HG3 1 1
1 195 2 1 3 GLU N N -2.305 -2.295 -3.230 1.00 . B B . 3 GLU N 1 1
1 196 2 1 3 GLU O O -4.929 -0.340 -1.885 1.00 . B B . 3 GLU O 1 1
1 197 2 1 3 GLU OE1 O -1.108 1.493 -3.496 1.00 . B B . 3 GLU OE1 1 1
1 198 2 1 3 GLU OE2 O -2.145 3.273 -4.260 1.00 . B B . 3 GLU OE2 1 1
1 199 2 1 4 PHE C C -6.564 -2.850 -1.239 1.00 . B B . 4 PHE C 1 1
1 200 2 1 4 PHE CA C -6.480 -2.451 -2.709 1.00 . B B . 4 PHE CA 1 1
1 201 2 1 4 PHE CB C -7.129 -3.521 -3.596 1.00 . B B . 4 PHE CB 1 1
1 202 2 1 4 PHE CD1 C -7.394 -5.689 -2.360 1.00 . B B . 4 PHE CD1 1 1
1 203 2 1 4 PHE CD2 C -5.612 -5.496 -3.933 1.00 . B B . 4 PHE CD2 1 1
1 204 2 1 4 PHE CE1 C -7.012 -6.988 -2.081 1.00 . B B . 4 PHE CE1 1 1
1 205 2 1 4 PHE CE2 C -5.224 -6.793 -3.657 1.00 . B B . 4 PHE CE2 1 1
1 206 2 1 4 PHE CG C -6.699 -4.930 -3.288 1.00 . B B . 4 PHE CG 1 1
1 207 2 1 4 PHE CZ C -5.926 -7.541 -2.730 1.00 . B B . 4 PHE CZ 1 1
1 208 2 1 4 PHE H H -4.652 -2.845 -3.706 1.00 . B B . 4 PHE H 1 1
1 209 2 1 4 PHE HA H -7.014 -1.521 -2.839 1.00 . B B . 4 PHE HA 1 1
1 210 2 1 4 PHE HB2 H -8.201 -3.471 -3.476 1.00 . B B . 4 PHE HB2 1 1
1 211 2 1 4 PHE HB3 H -6.881 -3.316 -4.627 1.00 . B B . 4 PHE HB3 1 1
1 212 2 1 4 PHE HD1 H -8.243 -5.258 -1.852 1.00 . B B . 4 PHE HD1 1 1
1 213 2 1 4 PHE HD2 H -5.063 -4.913 -4.656 1.00 . B B . 4 PHE HD2 1 1
1 214 2 1 4 PHE HE1 H -7.562 -7.569 -1.356 1.00 . B B . 4 PHE HE1 1 1
1 215 2 1 4 PHE HE2 H -4.374 -7.224 -4.166 1.00 . B B . 4 PHE HE2 1 1
1 216 2 1 4 PHE HZ H -5.625 -8.555 -2.514 1.00 . B B . 4 PHE HZ 1 1
1 217 2 1 4 PHE N N -5.095 -2.217 -3.101 1.00 . B B . 4 PHE N 1 1
1 218 2 1 4 PHE O O -7.541 -2.547 -0.557 1.00 . B B . 4 PHE O 1 1
1 219 2 1 5 ARG C C -5.120 -2.795 1.545 1.00 . B B . 5 ARG C 1 1
1 220 2 1 5 ARG CA C -5.480 -3.960 0.632 1.00 . B B . 5 ARG CA 1 1
1 221 2 1 5 ARG CB C -4.466 -5.090 0.801 1.00 . B B . 5 ARG CB 1 1
1 222 2 1 5 ARG CD C -3.860 -7.485 0.309 1.00 . B B . 5 ARG CD 1 1
1 223 2 1 5 ARG CG C -4.847 -6.356 0.056 1.00 . B B . 5 ARG CG 1 1
1 224 2 1 5 ARG CZ C -5.085 -9.554 -0.239 1.00 . B B . 5 ARG CZ 1 1
1 225 2 1 5 ARG H H -4.773 -3.733 -1.349 1.00 . B B . 5 ARG H 1 1
1 226 2 1 5 ARG HA H -6.459 -4.324 0.901 1.00 . B B . 5 ARG HA 1 1
1 227 2 1 5 ARG HB2 H -3.508 -4.755 0.432 1.00 . B B . 5 ARG HB2 1 1
1 228 2 1 5 ARG HB3 H -4.377 -5.327 1.850 1.00 . B B . 5 ARG HB3 1 1
1 229 2 1 5 ARG HD2 H -2.865 -7.134 0.087 1.00 . B B . 5 ARG HD2 1 1
1 230 2 1 5 ARG HD3 H -3.917 -7.769 1.350 1.00 . B B . 5 ARG HD3 1 1
1 231 2 1 5 ARG HE H -3.601 -8.780 -1.326 1.00 . B B . 5 ARG HE 1 1
1 232 2 1 5 ARG HG2 H -5.823 -6.669 0.384 1.00 . B B . 5 ARG HG2 1 1
1 233 2 1 5 ARG HG3 H -4.871 -6.141 -1.001 1.00 . B B . 5 ARG HG3 1 1
1 234 2 1 5 ARG HH11 H -5.705 -8.638 1.454 1.00 . B B . 5 ARG HH11 1 1
1 235 2 1 5 ARG HH12 H -6.546 -10.097 1.048 1.00 . B B . 5 ARG HH12 1 1
1 236 2 1 5 ARG HH21 H -4.705 -10.696 -1.862 1.00 . B B . 5 ARG HH21 1 1
1 237 2 1 5 ARG HH22 H -5.978 -11.265 -0.834 1.00 . B B . 5 ARG HH22 1 1
1 238 2 1 5 ARG N N -5.527 -3.527 -0.757 1.00 . B B . 5 ARG N 1 1
1 239 2 1 5 ARG NE N -4.142 -8.655 -0.518 1.00 . B B . 5 ARG NE 1 1
1 240 2 1 5 ARG NH1 N -5.840 -9.418 0.844 1.00 . B B . 5 ARG NH1 1 1
1 241 2 1 5 ARG NH2 N -5.271 -10.589 -1.045 1.00 . B B . 5 ARG NH2 1 1
1 242 2 1 5 ARG O O -5.702 -2.627 2.616 1.00 . B B . 5 ARG O 1 1
1 243 2 1 6 HIS C C -4.838 0.208 1.942 1.00 . B B . 6 HIS C 1 1
1 244 2 1 6 HIS CA C -3.726 -0.830 1.882 1.00 . B B . 6 HIS CA 1 1
1 245 2 1 6 HIS CB C -2.483 -0.195 1.263 1.00 . B B . 6 HIS CB 1 1
1 246 2 1 6 HIS CD2 C -0.800 -1.571 -0.123 1.00 . B B . 6 HIS CD2 1 1
1 247 2 1 6 HIS CE1 C 0.293 -2.533 1.475 1.00 . B B . 6 HIS CE1 1 1
1 248 2 1 6 HIS CG C -1.353 -1.146 1.037 1.00 . B B . 6 HIS CG 1 1
1 249 2 1 6 HIS H H -3.739 -2.175 0.240 1.00 . B B . 6 HIS H 1 1
1 250 2 1 6 HIS HA H -3.497 -1.160 2.884 1.00 . B B . 6 HIS HA 1 1
1 251 2 1 6 HIS HB2 H -2.748 0.229 0.306 1.00 . B B . 6 HIS HB2 1 1
1 252 2 1 6 HIS HB3 H -2.130 0.594 1.912 1.00 . B B . 6 HIS HB3 1 1
1 253 2 1 6 HIS HD1 H -0.807 -1.668 3.008 1.00 . B B . 6 HIS HD1 1 1
1 254 2 1 6 HIS HD2 H -1.108 -1.278 -1.115 1.00 . B B . 6 HIS HD2 1 1
1 255 2 1 6 HIS HE1 H 1.009 -3.134 2.018 1.00 . B B . 6 HIS HE1 1 1
1 256 2 1 6 HIS N N -4.160 -1.988 1.107 1.00 . B B . 6 HIS N 1 1
1 257 2 1 6 HIS ND1 N -0.649 -1.767 2.046 1.00 . B B . 6 HIS ND1 1 1
1 258 2 1 6 HIS NE2 N 0.239 -2.448 0.161 1.00 . B B . 6 HIS NE2 1 1
1 259 2 1 6 HIS O O -5.078 0.824 2.981 1.00 . B B . 6 HIS O 1 1
1 260 2 1 7 HIS C C -7.933 0.695 1.027 1.00 . B B . 7 HIS C 1 1
1 261 2 1 7 HIS CA C -6.595 1.357 0.713 1.00 . B B . 7 HIS CA 1 1
1 262 2 1 7 HIS CB C -6.628 1.968 -0.690 1.00 . B B . 7 HIS CB 1 1
1 263 2 1 7 HIS CD2 C -4.098 2.264 -1.193 1.00 . B B . 7 HIS CD2 1 1
1 264 2 1 7 HIS CE1 C -4.070 4.384 -1.617 1.00 . B B . 7 HIS CE1 1 1
1 265 2 1 7 HIS CG C -5.376 2.709 -1.055 1.00 . B B . 7 HIS CG 1 1
1 266 2 1 7 HIS H H -5.261 -0.130 0.022 1.00 . B B . 7 HIS H 1 1
1 267 2 1 7 HIS HA H -6.414 2.141 1.435 1.00 . B B . 7 HIS HA 1 1
1 268 2 1 7 HIS HB2 H -6.769 1.180 -1.414 1.00 . B B . 7 HIS HB2 1 1
1 269 2 1 7 HIS HB3 H -7.455 2.660 -0.754 1.00 . B B . 7 HIS HB3 1 1
1 270 2 1 7 HIS HD1 H -6.101 4.672 -1.311 1.00 . B B . 7 HIS HD1 1 1
1 271 2 1 7 HIS HD2 H -3.759 1.247 -1.052 1.00 . B B . 7 HIS HD2 1 1
1 272 2 1 7 HIS HE1 H -3.739 5.380 -1.872 1.00 . B B . 7 HIS HE1 1 1
1 273 2 1 7 HIS N N -5.508 0.395 0.812 1.00 . B B . 7 HIS N 1 1
1 274 2 1 7 HIS ND1 N -5.337 4.059 -1.327 1.00 . B B . 7 HIS ND1 1 1
1 275 2 1 7 HIS NE2 N -3.279 3.331 -1.550 1.00 . B B . 7 HIS NE2 1 1
1 276 2 1 7 HIS O O -8.286 -0.323 0.434 1.00 . B B . 7 HIS O 1 1
1 277 2 1 8 SER C C -11.062 1.790 2.225 1.00 . B B . 8 SER C 1 1
1 278 2 1 8 SER CA C -9.967 0.738 2.362 1.00 . B B . 8 SER CA 1 1
1 279 2 1 8 SER CB C -9.913 0.227 3.803 1.00 . B B . 8 SER CB 1 1
1 280 2 1 8 SER H H -8.335 2.084 2.408 1.00 . B B . 8 SER H 1 1
1 281 2 1 8 SER HA H -10.195 -0.089 1.706 1.00 . B B . 8 SER HA 1 1
1 282 2 1 8 SER HB2 H -9.634 1.037 4.460 1.00 . B B . 8 SER HB2 1 1
1 283 2 1 8 SER HB3 H -10.886 -0.148 4.088 1.00 . B B . 8 SER HB3 1 1
1 284 2 1 8 SER HG H -8.519 -0.736 4.787 1.00 . B B . 8 SER HG 1 1
1 285 2 1 8 SER N N -8.671 1.276 1.968 1.00 . B B . 8 SER N 1 1
1 286 2 1 8 SER O O -10.835 2.974 2.472 1.00 . B B . 8 SER O 1 1
1 287 2 1 8 SER OG O -8.964 -0.817 3.940 1.00 . B B . 8 SER OG 1 1
1 288 2 1 9 GLY C C -14.666 1.540 1.366 1.00 . B B . 9 GLY C 1 1
1 289 2 1 9 GLY CA C -13.367 2.261 1.669 1.00 . B B . 9 GLY CA 1 1
1 290 2 1 9 GLY H H -12.374 0.392 1.651 1.00 . B B . 9 GLY H 1 1
1 291 2 1 9 GLY HA2 H -13.488 2.830 2.579 1.00 . B B . 9 GLY HA2 1 1
1 292 2 1 9 GLY HA3 H -13.147 2.940 0.859 1.00 . B B . 9 GLY HA3 1 1
1 293 2 1 9 GLY N N -12.251 1.347 1.832 1.00 . B B . 9 GLY N 1 1
1 294 2 1 9 GLY O O -14.732 0.727 0.444 1.00 . B B . 9 GLY O 1 1
1 295 2 1 10 TYR C C -18.029 2.227 1.455 1.00 . B B . 10 TYR C 1 1
1 296 2 1 10 TYR CA C -17.005 1.212 1.953 1.00 . B B . 10 TYR CA 1 1
1 297 2 1 10 TYR CB C -17.488 0.585 3.263 1.00 . B B . 10 TYR CB 1 1
1 298 2 1 10 TYR CD1 C -16.586 1.859 5.247 1.00 . B B . 10 TYR CD1 1 1
1 299 2 1 10 TYR CD2 C -18.849 2.240 4.598 1.00 . B B . 10 TYR CD2 1 1
1 300 2 1 10 TYR CE1 C -16.725 2.768 6.279 1.00 . B B . 10 TYR CE1 1 1
1 301 2 1 10 TYR CE2 C -18.995 3.150 5.627 1.00 . B B . 10 TYR CE2 1 1
1 302 2 1 10 TYR CG C -17.643 1.580 4.390 1.00 . B B . 10 TYR CG 1 1
1 303 2 1 10 TYR CZ C -17.931 3.410 6.464 1.00 . B B . 10 TYR CZ 1 1
1 304 2 1 10 TYR H H -15.587 2.494 2.863 1.00 . B B . 10 TYR H 1 1
1 305 2 1 10 TYR HA H -16.895 0.436 1.212 1.00 . B B . 10 TYR HA 1 1
1 306 2 1 10 TYR HB2 H -18.447 0.118 3.098 1.00 . B B . 10 TYR HB2 1 1
1 307 2 1 10 TYR HB3 H -16.777 -0.166 3.577 1.00 . B B . 10 TYR HB3 1 1
1 308 2 1 10 TYR HD1 H -15.643 1.354 5.098 1.00 . B B . 10 TYR HD1 1 1
1 309 2 1 10 TYR HD2 H -19.680 2.034 3.941 1.00 . B B . 10 TYR HD2 1 1
1 310 2 1 10 TYR HE1 H -15.892 2.971 6.935 1.00 . B B . 10 TYR HE1 1 1
1 311 2 1 10 TYR HE2 H -19.939 3.654 5.772 1.00 . B B . 10 TYR HE2 1 1
1 312 2 1 10 TYR HH H -18.944 4.221 7.884 1.00 . B B . 10 TYR HH 1 1
1 313 2 1 10 TYR N N -15.702 1.838 2.143 1.00 . B B . 10 TYR N 1 1
1 314 2 1 10 TYR O O -19.172 1.817 1.160 1.00 . B B . 10 TYR O 1 1
1 315 2 1 10 TYR OH O -18.073 4.316 7.491 1.00 . B B . 10 TYR OH 1 1
1 316 2 1 11 NH2 HN1 H -16.716 3.774 1.611 1.00 . B B . 11 NH2 HN1 1 1
1 317 2 1 11 NH2 HN2 H -18.312 4.197 1.031 1.00 . B B . 11 NH2 HN2 1 1
1 318 2 1 11 NH2 N N -17.656 3.502 1.358 1.00 . B B . 11 NH2 N 1 1
1 319 3 2 1 ZN ZN ZN 1.641 -3.412 -1.005 1.00 . C A . 101 ZN ZN 1 1
1 320 4 2 1 ZN ZN ZN -1.390 2.955 -2.213 1.00 . D A . 102 ZN ZN 1 1
2 321 1 1 1 ASP C C 0.538 5.234 -1.991 1.00 . A A . 1 ASP C 1 1
2 322 1 1 1 ASP CA C 0.524 6.393 -0.998 1.00 . A A . 1 ASP CA 1 1
2 323 1 1 1 ASP CB C 0.800 5.881 0.417 1.00 . A A . 1 ASP CB 1 1
2 324 1 1 1 ASP CG C 0.959 7.006 1.420 1.00 . A A . 1 ASP CG 1 1
2 325 1 1 1 ASP H1 H -0.660 8.017 -0.560 1.00 . A A . 1 ASP H1 1 1
2 326 1 1 1 ASP H2 H -1.457 6.502 -0.458 1.00 . A A . 1 ASP H2 1 1
2 327 1 1 1 ASP H3 H -1.096 7.181 -1.993 1.00 . A A . 1 ASP H3 1 1
2 328 1 1 1 ASP HA H 1.288 7.103 -1.275 1.00 . A A . 1 ASP HA 1 1
2 329 1 1 1 ASP HB2 H -0.022 5.256 0.734 1.00 . A A . 1 ASP HB2 1 1
2 330 1 1 1 ASP HB3 H 1.710 5.295 0.413 1.00 . A A . 1 ASP HB3 1 1
2 331 1 1 1 ASP N N -0.791 7.085 -1.003 1.00 . A A . 1 ASP N 1 1
2 332 1 1 1 ASP O O -0.512 4.779 -2.445 1.00 . A A . 1 ASP O 1 1
2 333 1 1 1 ASP OD1 O 0.882 6.733 2.637 1.00 . A A . 1 ASP OD1 1 1
2 334 1 1 1 ASP OD2 O 1.158 8.162 0.990 1.00 . A A . 1 ASP OD2 1 1
2 335 1 1 2 ALA C C 2.597 2.476 -2.599 1.00 . A A . 2 ALA C 1 1
2 336 1 1 2 ALA CA C 1.895 3.656 -3.258 1.00 . A A . 2 ALA CA 1 1
2 337 1 1 2 ALA CB C 2.663 4.113 -4.488 1.00 . A A . 2 ALA CB 1 1
2 338 1 1 2 ALA H H 2.535 5.169 -1.928 1.00 . A A . 2 ALA H 1 1
2 339 1 1 2 ALA HA H 0.909 3.343 -3.575 1.00 . A A . 2 ALA HA 1 1
2 340 1 1 2 ALA HB1 H 3.656 3.687 -4.469 1.00 . A A . 2 ALA HB1 1 1
2 341 1 1 2 ALA HB2 H 2.734 5.191 -4.490 1.00 . A A . 2 ALA HB2 1 1
2 342 1 1 2 ALA HB3 H 2.148 3.785 -5.378 1.00 . A A . 2 ALA HB3 1 1
2 343 1 1 2 ALA N N 1.737 4.762 -2.322 1.00 . A A . 2 ALA N 1 1
2 344 1 1 2 ALA O O 2.954 2.528 -1.422 1.00 . A A . 2 ALA O 1 1
2 345 1 1 3 GLU C C 4.795 0.521 -2.237 1.00 . A A . 3 GLU C 1 1
2 346 1 1 3 GLU CA C 3.442 0.204 -2.873 1.00 . A A . 3 GLU CA 1 1
2 347 1 1 3 GLU CB C 3.627 -0.797 -4.015 1.00 . A A . 3 GLU CB 1 1
2 348 1 1 3 GLU CD C 2.575 -2.870 -3.032 1.00 . A A . 3 GLU CD 1 1
2 349 1 1 3 GLU CG C 3.847 -2.228 -3.547 1.00 . A A . 3 GLU CG 1 1
2 350 1 1 3 GLU H H 2.478 1.436 -4.298 1.00 . A A . 3 GLU H 1 1
2 351 1 1 3 GLU HA H 2.801 -0.234 -2.125 1.00 . A A . 3 GLU HA 1 1
2 352 1 1 3 GLU HB2 H 2.749 -0.778 -4.641 1.00 . A A . 3 GLU HB2 1 1
2 353 1 1 3 GLU HB3 H 4.484 -0.499 -4.603 1.00 . A A . 3 GLU HB3 1 1
2 354 1 1 3 GLU HG2 H 4.216 -2.812 -4.376 1.00 . A A . 3 GLU HG2 1 1
2 355 1 1 3 GLU HG3 H 4.578 -2.226 -2.753 1.00 . A A . 3 GLU HG3 1 1
2 356 1 1 3 GLU N N 2.789 1.412 -3.369 1.00 . A A . 3 GLU N 1 1
2 357 1 1 3 GLU O O 5.168 -0.070 -1.225 1.00 . A A . 3 GLU O 1 1
2 358 1 1 3 GLU OE1 O 1.697 -2.135 -2.539 1.00 . A A . 3 GLU OE1 1 1
2 359 1 1 3 GLU OE2 O 2.454 -4.111 -3.132 1.00 . A A . 3 GLU OE2 1 1
2 360 1 1 4 PHE C C 6.701 2.593 -1.000 1.00 . A A . 4 PHE C 1 1
2 361 1 1 4 PHE CA C 6.835 1.835 -2.316 1.00 . A A . 4 PHE CA 1 1
2 362 1 1 4 PHE CB C 7.588 2.687 -3.342 1.00 . A A . 4 PHE CB 1 1
2 363 1 1 4 PHE CD1 C 7.443 5.125 -2.758 1.00 . A A . 4 PHE CD1 1 1
2 364 1 1 4 PHE CD2 C 6.034 4.289 -4.491 1.00 . A A . 4 PHE CD2 1 1
2 365 1 1 4 PHE CE1 C 6.917 6.390 -2.935 1.00 . A A . 4 PHE CE1 1 1
2 366 1 1 4 PHE CE2 C 5.503 5.552 -4.671 1.00 . A A . 4 PHE CE2 1 1
2 367 1 1 4 PHE CG C 7.009 4.062 -3.533 1.00 . A A . 4 PHE CG 1 1
2 368 1 1 4 PHE CZ C 5.944 6.604 -3.892 1.00 . A A . 4 PHE CZ 1 1
2 369 1 1 4 PHE H H 5.179 1.893 -3.634 1.00 . A A . 4 PHE H 1 1
2 370 1 1 4 PHE HA H 7.392 0.928 -2.136 1.00 . A A . 4 PHE HA 1 1
2 371 1 1 4 PHE HB2 H 8.613 2.802 -3.019 1.00 . A A . 4 PHE HB2 1 1
2 372 1 1 4 PHE HB3 H 7.573 2.183 -4.297 1.00 . A A . 4 PHE HB3 1 1
2 373 1 1 4 PHE HD1 H 8.204 4.959 -2.010 1.00 . A A . 4 PHE HD1 1 1
2 374 1 1 4 PHE HD2 H 5.687 3.469 -5.100 1.00 . A A . 4 PHE HD2 1 1
2 375 1 1 4 PHE HE1 H 7.262 7.211 -2.324 1.00 . A A . 4 PHE HE1 1 1
2 376 1 1 4 PHE HE2 H 4.743 5.717 -5.421 1.00 . A A . 4 PHE HE2 1 1
2 377 1 1 4 PHE HZ H 5.529 7.591 -4.032 1.00 . A A . 4 PHE HZ 1 1
2 378 1 1 4 PHE N N 5.526 1.453 -2.833 1.00 . A A . 4 PHE N 1 1
2 379 1 1 4 PHE O O 7.587 2.539 -0.147 1.00 . A A . 4 PHE O 1 1
2 380 1 1 5 ARG C C 4.804 3.198 1.488 1.00 . A A . 5 ARG C 1 1
2 381 1 1 5 ARG CA C 5.342 4.078 0.364 1.00 . A A . 5 ARG CA 1 1
2 382 1 1 5 ARG CB C 4.361 5.211 0.070 1.00 . A A . 5 ARG CB 1 1
2 383 1 1 5 ARG CD C 3.848 7.542 0.849 1.00 . A A . 5 ARG CD 1 1
2 384 1 1 5 ARG CG C 4.075 6.099 1.268 1.00 . A A . 5 ARG CG 1 1
2 385 1 1 5 ARG CZ C 5.114 9.363 -0.224 1.00 . A A . 5 ARG CZ 1 1
2 386 1 1 5 ARG H H 4.922 3.310 -1.562 1.00 . A A . 5 ARG H 1 1
2 387 1 1 5 ARG HA H 6.282 4.505 0.680 1.00 . A A . 5 ARG HA 1 1
2 388 1 1 5 ARG HB2 H 4.767 5.829 -0.719 1.00 . A A . 5 ARG HB2 1 1
2 389 1 1 5 ARG HB3 H 3.429 4.783 -0.265 1.00 . A A . 5 ARG HB3 1 1
2 390 1 1 5 ARG HD2 H 3.098 7.565 0.074 1.00 . A A . 5 ARG HD2 1 1
2 391 1 1 5 ARG HD3 H 3.500 8.102 1.704 1.00 . A A . 5 ARG HD3 1 1
2 392 1 1 5 ARG HE H 5.905 7.651 0.428 1.00 . A A . 5 ARG HE 1 1
2 393 1 1 5 ARG HG2 H 3.189 5.737 1.769 1.00 . A A . 5 ARG HG2 1 1
2 394 1 1 5 ARG HG3 H 4.915 6.056 1.944 1.00 . A A . 5 ARG HG3 1 1
2 395 1 1 5 ARG HH11 H 3.132 9.722 -0.030 1.00 . A A . 5 ARG HH11 1 1
2 396 1 1 5 ARG HH12 H 4.045 10.986 -0.783 1.00 . A A . 5 ARG HH12 1 1
2 397 1 1 5 ARG HH21 H 7.106 9.313 -0.561 1.00 . A A . 5 ARG HH21 1 1
2 398 1 1 5 ARG HH22 H 6.300 10.753 -1.086 1.00 . A A . 5 ARG HH22 1 1
2 399 1 1 5 ARG N N 5.591 3.304 -0.845 1.00 . A A . 5 ARG N 1 1
2 400 1 1 5 ARG NE N 5.071 8.161 0.344 1.00 . A A . 5 ARG NE 1 1
2 401 1 1 5 ARG NH1 N 4.005 10.082 -0.356 1.00 . A A . 5 ARG NH1 1 1
2 402 1 1 5 ARG NH2 N 6.267 9.851 -0.659 1.00 . A A . 5 ARG NH2 1 1
2 403 1 1 5 ARG O O 5.164 3.373 2.651 1.00 . A A . 5 ARG O 1 1
2 404 1 1 6 HIS C C 4.407 0.415 2.690 1.00 . A A . 6 HIS C 1 1
2 405 1 1 6 HIS CA C 3.352 1.351 2.123 1.00 . A A . 6 HIS CA 1 1
2 406 1 1 6 HIS CB C 2.232 0.520 1.497 1.00 . A A . 6 HIS CB 1 1
2 407 1 1 6 HIS CD2 C 0.756 1.344 -0.449 1.00 . A A . 6 HIS CD2 1 1
2 408 1 1 6 HIS CE1 C -0.429 2.818 0.595 1.00 . A A . 6 HIS CE1 1 1
2 409 1 1 6 HIS CG C 1.171 1.338 0.839 1.00 . A A . 6 HIS CG 1 1
2 410 1 1 6 HIS H H 3.688 2.162 0.190 1.00 . A A . 6 HIS H 1 1
2 411 1 1 6 HIS HA H 2.945 1.949 2.924 1.00 . A A . 6 HIS HA 1 1
2 412 1 1 6 HIS HB2 H 2.656 -0.132 0.749 1.00 . A A . 6 HIS HB2 1 1
2 413 1 1 6 HIS HB3 H 1.765 -0.077 2.265 1.00 . A A . 6 HIS HB3 1 1
2 414 1 1 6 HIS HD1 H 0.468 2.515 2.441 1.00 . A A . 6 HIS HD1 1 1
2 415 1 1 6 HIS HD2 H 1.141 0.718 -1.242 1.00 . A A . 6 HIS HD2 1 1
2 416 1 1 6 HIS HE1 H -1.151 3.588 0.822 1.00 . A A . 6 HIS HE1 1 1
2 417 1 1 6 HIS N N 3.938 2.254 1.135 1.00 . A A . 6 HIS N 1 1
2 418 1 1 6 HIS ND1 N 0.409 2.280 1.492 1.00 . A A . 6 HIS ND1 1 1
2 419 1 1 6 HIS NE2 N -0.257 2.285 -0.598 1.00 . A A . 6 HIS NE2 1 1
2 420 1 1 6 HIS O O 4.444 0.151 3.893 1.00 . A A . 6 HIS O 1 1
2 421 1 1 7 HIS C C 7.615 -0.268 2.468 1.00 . A A . 7 HIS C 1 1
2 422 1 1 7 HIS CA C 6.312 -1.013 2.204 1.00 . A A . 7 HIS CA 1 1
2 423 1 1 7 HIS CB C 6.514 -2.067 1.115 1.00 . A A . 7 HIS CB 1 1
2 424 1 1 7 HIS CD2 C 4.190 -2.577 0.078 1.00 . A A . 7 HIS CD2 1 1
2 425 1 1 7 HIS CE1 C 3.892 -4.574 0.850 1.00 . A A . 7 HIS CE1 1 1
2 426 1 1 7 HIS CG C 5.285 -2.876 0.828 1.00 . A A . 7 HIS CG 1 1
2 427 1 1 7 HIS H H 5.167 0.154 0.864 1.00 . A A . 7 HIS H 1 1
2 428 1 1 7 HIS HA H 6.001 -1.503 3.114 1.00 . A A . 7 HIS HA 1 1
2 429 1 1 7 HIS HB2 H 6.811 -1.577 0.200 1.00 . A A . 7 HIS HB2 1 1
2 430 1 1 7 HIS HB3 H 7.297 -2.746 1.423 1.00 . A A . 7 HIS HB3 1 1
2 431 1 1 7 HIS HD1 H 5.683 -4.652 1.893 1.00 . A A . 7 HIS HD1 1 1
2 432 1 1 7 HIS HD2 H 4.001 -1.645 -0.433 1.00 . A A . 7 HIS HD2 1 1
2 433 1 1 7 HIS HE1 H 3.458 -5.536 1.075 1.00 . A A . 7 HIS HE1 1 1
2 434 1 1 7 HIS N N 5.256 -0.092 1.808 1.00 . A A . 7 HIS N 1 1
2 435 1 1 7 HIS ND1 N 5.075 -4.148 1.313 1.00 . A A . 7 HIS ND1 1 1
2 436 1 1 7 HIS NE2 N 3.319 -3.659 0.094 1.00 . A A . 7 HIS NE2 1 1
2 437 1 1 7 HIS O O 7.744 0.913 2.148 1.00 . A A . 7 HIS O 1 1
2 438 1 1 8 SER C C 10.898 -0.705 2.284 1.00 . A A . 8 SER C 1 1
2 439 1 1 8 SER CA C 9.876 -0.375 3.365 1.00 . A A . 8 SER CA 1 1
2 440 1 1 8 SER CB C 10.374 -0.870 4.723 1.00 . A A . 8 SER CB 1 1
2 441 1 1 8 SER H H 8.416 -1.905 3.287 1.00 . A A . 8 SER H 1 1
2 442 1 1 8 SER HA H 9.747 0.696 3.408 1.00 . A A . 8 SER HA 1 1
2 443 1 1 8 SER HB2 H 10.345 -1.950 4.743 1.00 . A A . 8 SER HB2 1 1
2 444 1 1 8 SER HB3 H 11.390 -0.535 4.877 1.00 . A A . 8 SER HB3 1 1
2 445 1 1 8 SER HG H 9.486 -1.042 6.461 1.00 . A A . 8 SER HG 1 1
2 446 1 1 8 SER N N 8.580 -0.968 3.055 1.00 . A A . 8 SER N 1 1
2 447 1 1 8 SER O O 10.882 -1.794 1.709 1.00 . A A . 8 SER O 1 1
2 448 1 1 8 SER OG O 9.568 -0.373 5.776 1.00 . A A . 8 SER OG 1 1
2 449 1 1 9 GLY C C 13.279 1.333 0.371 1.00 . A A . 9 GLY C 1 1
2 450 1 1 9 GLY CA C 12.807 0.034 0.998 1.00 . A A . 9 GLY CA 1 1
2 451 1 1 9 GLY H H 11.753 1.092 2.498 1.00 . A A . 9 GLY H 1 1
2 452 1 1 9 GLY HA2 H 13.652 -0.463 1.450 1.00 . A A . 9 GLY HA2 1 1
2 453 1 1 9 GLY HA3 H 12.404 -0.600 0.221 1.00 . A A . 9 GLY HA3 1 1
2 454 1 1 9 GLY N N 11.790 0.244 2.009 1.00 . A A . 9 GLY N 1 1
2 455 1 1 9 GLY O O 12.470 2.155 -0.054 1.00 . A A . 9 GLY O 1 1
2 456 1 1 10 TYR C C 15.114 2.683 -1.783 1.00 . A A . 10 TYR C 1 1
2 457 1 1 10 TYR CA C 15.176 2.724 -0.260 1.00 . A A . 10 TYR CA 1 1
2 458 1 1 10 TYR CB C 16.625 2.887 0.200 1.00 . A A . 10 TYR CB 1 1
2 459 1 1 10 TYR CD1 C 16.405 2.867 2.715 1.00 . A A . 10 TYR CD1 1 1
2 460 1 1 10 TYR CD2 C 17.250 4.838 1.675 1.00 . A A . 10 TYR CD2 1 1
2 461 1 1 10 TYR CE1 C 16.530 3.463 3.956 1.00 . A A . 10 TYR CE1 1 1
2 462 1 1 10 TYR CE2 C 17.379 5.441 2.913 1.00 . A A . 10 TYR CE2 1 1
2 463 1 1 10 TYR CG C 16.763 3.543 1.556 1.00 . A A . 10 TYR CG 1 1
2 464 1 1 10 TYR CZ C 17.017 4.749 4.049 1.00 . A A . 10 TYR CZ 1 1
2 465 1 1 10 TYR H H 15.190 0.824 0.673 1.00 . A A . 10 TYR H 1 1
2 466 1 1 10 TYR HA H 14.600 3.568 0.089 1.00 . A A . 10 TYR HA 1 1
2 467 1 1 10 TYR HB2 H 17.090 1.914 0.255 1.00 . A A . 10 TYR HB2 1 1
2 468 1 1 10 TYR HB3 H 17.156 3.494 -0.518 1.00 . A A . 10 TYR HB3 1 1
2 469 1 1 10 TYR HD1 H 16.024 1.860 2.639 1.00 . A A . 10 TYR HD1 1 1
2 470 1 1 10 TYR HD2 H 17.532 5.377 0.783 1.00 . A A . 10 TYR HD2 1 1
2 471 1 1 10 TYR HE1 H 16.246 2.920 4.846 1.00 . A A . 10 TYR HE1 1 1
2 472 1 1 10 TYR HE2 H 17.760 6.448 2.985 1.00 . A A . 10 TYR HE2 1 1
2 473 1 1 10 TYR HH H 16.899 6.272 5.217 1.00 . A A . 10 TYR HH 1 1
2 474 1 1 10 TYR N N 14.595 1.517 0.317 1.00 . A A . 10 TYR N 1 1
2 475 1 1 10 TYR O O 15.860 3.451 -2.424 1.00 . A A . 10 TYR O 1 1
2 476 1 1 10 TYR OH O 17.143 5.346 5.283 1.00 . A A . 10 TYR OH 1 1
2 477 1 1 11 NH2 HN1 H 13.690 1.231 -1.785 1.00 . A A . 11 NH2 HN1 1 1
2 478 1 1 11 NH2 HN2 H 14.207 1.779 -3.363 1.00 . A A . 11 NH2 HN2 1 1
2 479 1 1 11 NH2 N N 14.269 1.829 -2.357 1.00 . A A . 11 NH2 N 1 1
2 480 2 1 1 ASP C C -0.312 -5.576 -0.662 1.00 . B B . 1 ASP C 1 1
2 481 2 1 1 ASP CA C -0.390 -6.390 0.622 1.00 . B B . 1 ASP CA 1 1
2 482 2 1 1 ASP CB C -1.376 -5.738 1.599 1.00 . B B . 1 ASP CB 1 1
2 483 2 1 1 ASP CG C -1.073 -6.065 3.050 1.00 . B B . 1 ASP CG 1 1
2 484 2 1 1 ASP H1 H 1.641 -6.711 0.532 1.00 . B B . 1 ASP H1 1 1
2 485 2 1 1 ASP H2 H 0.894 -7.257 1.978 1.00 . B B . 1 ASP H2 1 1
2 486 2 1 1 ASP H3 H 1.149 -5.580 1.721 1.00 . B B . 1 ASP H3 1 1
2 487 2 1 1 ASP HA H -0.735 -7.383 0.382 1.00 . B B . 1 ASP HA 1 1
2 488 2 1 1 ASP HB2 H -1.340 -4.667 1.475 1.00 . B B . 1 ASP HB2 1 1
2 489 2 1 1 ASP HB3 H -2.373 -6.087 1.376 1.00 . B B . 1 ASP HB3 1 1
2 490 2 1 1 ASP N N 0.944 -6.494 1.271 1.00 . B B . 1 ASP N 1 1
2 491 2 1 1 ASP O O 0.771 -5.225 -1.124 1.00 . B B . 1 ASP O 1 1
2 492 2 1 1 ASP OD1 O -0.716 -7.226 3.336 1.00 . B B . 1 ASP OD1 1 1
2 493 2 1 1 ASP OD2 O -1.191 -5.157 3.900 1.00 . B B . 1 ASP OD2 1 1
2 494 2 1 2 ALA C C -2.301 -3.195 -2.232 1.00 . B B . 2 ALA C 1 1
2 495 2 1 2 ALA CA C -1.547 -4.500 -2.461 1.00 . B B . 2 ALA CA 1 1
2 496 2 1 2 ALA CB C -2.212 -5.315 -3.559 1.00 . B B . 2 ALA CB 1 1
2 497 2 1 2 ALA H H -2.299 -5.588 -0.813 1.00 . B B . 2 ALA H 1 1
2 498 2 1 2 ALA HA H -0.538 -4.271 -2.774 1.00 . B B . 2 ALA HA 1 1
2 499 2 1 2 ALA HB1 H -2.593 -6.235 -3.144 1.00 . B B . 2 ALA HB1 1 1
2 500 2 1 2 ALA HB2 H -1.489 -5.538 -4.329 1.00 . B B . 2 ALA HB2 1 1
2 501 2 1 2 ALA HB3 H -3.027 -4.749 -3.986 1.00 . B B . 2 ALA HB3 1 1
2 502 2 1 2 ALA N N -1.472 -5.277 -1.231 1.00 . B B . 2 ALA N 1 1
2 503 2 1 2 ALA O O -2.863 -2.969 -1.161 1.00 . B B . 2 ALA O 1 1
2 504 2 1 3 GLU C C -4.428 -1.203 -2.701 1.00 . B B . 3 GLU C 1 1
2 505 2 1 3 GLU CA C -2.983 -1.047 -3.164 1.00 . B B . 3 GLU CA 1 1
2 506 2 1 3 GLU CB C -2.947 -0.347 -4.524 1.00 . B B . 3 GLU CB 1 1
2 507 2 1 3 GLU CD C -2.130 1.994 -4.036 1.00 . B B . 3 GLU CD 1 1
2 508 2 1 3 GLU CG C -3.301 1.130 -4.461 1.00 . B B . 3 GLU CG 1 1
2 509 2 1 3 GLU H H -1.837 -2.577 -4.075 1.00 . B B . 3 GLU H 1 1
2 510 2 1 3 GLU HA H -2.451 -0.442 -2.446 1.00 . B B . 3 GLU HA 1 1
2 511 2 1 3 GLU HB2 H -1.953 -0.437 -4.935 1.00 . B B . 3 GLU HB2 1 1
2 512 2 1 3 GLU HB3 H -3.646 -0.835 -5.185 1.00 . B B . 3 GLU HB3 1 1
2 513 2 1 3 GLU HG2 H -3.629 1.451 -5.438 1.00 . B B . 3 GLU HG2 1 1
2 514 2 1 3 GLU HG3 H -4.104 1.264 -3.751 1.00 . B B . 3 GLU HG3 1 1
2 515 2 1 3 GLU N N -2.306 -2.339 -3.248 1.00 . B B . 3 GLU N 1 1
2 516 2 1 3 GLU O O -4.937 -0.379 -1.943 1.00 . B B . 3 GLU O 1 1
2 517 2 1 3 GLU OE1 O -1.199 1.457 -3.403 1.00 . B B . 3 GLU OE1 1 1
2 518 2 1 3 GLU OE2 O -2.142 3.203 -4.345 1.00 . B B . 3 GLU OE2 1 1
2 519 2 1 4 PHE C C -6.575 -2.906 -1.313 1.00 . B B . 4 PHE C 1 1
2 520 2 1 4 PHE CA C -6.475 -2.505 -2.782 1.00 . B B . 4 PHE CA 1 1
2 521 2 1 4 PHE CB C -7.097 -3.585 -3.675 1.00 . B B . 4 PHE CB 1 1
2 522 2 1 4 PHE CD1 C -7.275 -5.835 -2.573 1.00 . B B . 4 PHE CD1 1 1
2 523 2 1 4 PHE CD2 C -5.421 -5.425 -4.014 1.00 . B B . 4 PHE CD2 1 1
2 524 2 1 4 PHE CE1 C -6.813 -7.116 -2.336 1.00 . B B . 4 PHE CE1 1 1
2 525 2 1 4 PHE CE2 C -4.953 -6.705 -3.781 1.00 . B B . 4 PHE CE2 1 1
2 526 2 1 4 PHE CG C -6.585 -4.975 -3.413 1.00 . B B . 4 PHE CG 1 1
2 527 2 1 4 PHE CZ C -5.650 -7.552 -2.942 1.00 . B B . 4 PHE CZ 1 1
2 528 2 1 4 PHE H H -4.635 -2.887 -3.758 1.00 . B B . 4 PHE H 1 1
2 529 2 1 4 PHE HA H -7.019 -1.582 -2.922 1.00 . B B . 4 PHE HA 1 1
2 530 2 1 4 PHE HB2 H -8.165 -3.595 -3.520 1.00 . B B . 4 PHE HB2 1 1
2 531 2 1 4 PHE HB3 H -6.891 -3.344 -4.707 1.00 . B B . 4 PHE HB3 1 1
2 532 2 1 4 PHE HD1 H -8.185 -5.495 -2.098 1.00 . B B . 4 PHE HD1 1 1
2 533 2 1 4 PHE HD2 H -4.873 -4.764 -4.670 1.00 . B B . 4 PHE HD2 1 1
2 534 2 1 4 PHE HE1 H -7.361 -7.775 -1.679 1.00 . B B . 4 PHE HE1 1 1
2 535 2 1 4 PHE HE2 H -4.044 -7.043 -4.256 1.00 . B B . 4 PHE HE2 1 1
2 536 2 1 4 PHE HZ H -5.289 -8.552 -2.760 1.00 . B B . 4 PHE HZ 1 1
2 537 2 1 4 PHE N N -5.088 -2.260 -3.158 1.00 . B B . 4 PHE N 1 1
2 538 2 1 4 PHE O O -7.569 -2.620 -0.648 1.00 . B B . 4 PHE O 1 1
2 539 2 1 5 ARG C C -5.141 -2.840 1.496 1.00 . B B . 5 ARG C 1 1
2 540 2 1 5 ARG CA C -5.505 -3.999 0.576 1.00 . B B . 5 ARG CA 1 1
2 541 2 1 5 ARG CB C -4.520 -5.155 0.750 1.00 . B B . 5 ARG CB 1 1
2 542 2 1 5 ARG CD C -3.926 -7.533 0.132 1.00 . B B . 5 ARG CD 1 1
2 543 2 1 5 ARG CG C -4.894 -6.377 -0.072 1.00 . B B . 5 ARG CG 1 1
2 544 2 1 5 ARG CZ C -3.546 -9.704 -0.986 1.00 . B B . 5 ARG CZ 1 1
2 545 2 1 5 ARG H H -4.768 -3.760 -1.393 1.00 . B B . 5 ARG H 1 1
2 546 2 1 5 ARG HA H -6.496 -4.344 0.833 1.00 . B B . 5 ARG HA 1 1
2 547 2 1 5 ARG HB2 H -3.537 -4.824 0.448 1.00 . B B . 5 ARG HB2 1 1
2 548 2 1 5 ARG HB3 H -4.492 -5.440 1.791 1.00 . B B . 5 ARG HB3 1 1
2 549 2 1 5 ARG HD2 H -2.954 -7.243 -0.235 1.00 . B B . 5 ARG HD2 1 1
2 550 2 1 5 ARG HD3 H -3.864 -7.752 1.187 1.00 . B B . 5 ARG HD3 1 1
2 551 2 1 5 ARG HE H -5.322 -8.822 -0.764 1.00 . B B . 5 ARG HE 1 1
2 552 2 1 5 ARG HG2 H -5.879 -6.697 0.215 1.00 . B B . 5 ARG HG2 1 1
2 553 2 1 5 ARG HG3 H -4.894 -6.100 -1.117 1.00 . B B . 5 ARG HG3 1 1
2 554 2 1 5 ARG HH11 H -1.866 -8.835 -0.271 1.00 . B B . 5 ARG HH11 1 1
2 555 2 1 5 ARG HH12 H -1.636 -10.358 -1.064 1.00 . B B . 5 ARG HH12 1 1
2 556 2 1 5 ARG HH21 H -5.017 -10.823 -1.802 1.00 . B B . 5 ARG HH21 1 1
2 557 2 1 5 ARG HH22 H -3.423 -11.485 -1.931 1.00 . B B . 5 ARG HH22 1 1
2 558 2 1 5 ARG N N -5.536 -3.566 -0.814 1.00 . B B . 5 ARG N 1 1
2 559 2 1 5 ARG NE N -4.365 -8.734 -0.579 1.00 . B B . 5 ARG NE 1 1
2 560 2 1 5 ARG NH1 N -2.242 -9.625 -0.754 1.00 . B B . 5 ARG NH1 1 1
2 561 2 1 5 ARG NH2 N -4.036 -10.757 -1.625 1.00 . B B . 5 ARG NH2 1 1
2 562 2 1 5 ARG O O -5.709 -2.691 2.579 1.00 . B B . 5 ARG O 1 1
2 563 2 1 6 HIS C C -4.894 0.173 1.903 1.00 . B B . 6 HIS C 1 1
2 564 2 1 6 HIS CA C -3.776 -0.856 1.839 1.00 . B B . 6 HIS CA 1 1
2 565 2 1 6 HIS CB C -2.533 -0.208 1.225 1.00 . B B . 6 HIS CB 1 1
2 566 2 1 6 HIS CD2 C -0.826 -1.565 -0.152 1.00 . B B . 6 HIS CD2 1 1
2 567 2 1 6 HIS CE1 C 0.273 -2.510 1.452 1.00 . B B . 6 HIS CE1 1 1
2 568 2 1 6 HIS CG C -1.391 -1.148 1.006 1.00 . B B . 6 HIS CG 1 1
2 569 2 1 6 HIS H H -3.792 -2.177 0.177 1.00 . B B . 6 HIS H 1 1
2 570 2 1 6 HIS HA H -3.547 -1.192 2.839 1.00 . B B . 6 HIS HA 1 1
2 571 2 1 6 HIS HB2 H -2.799 0.213 0.266 1.00 . B B . 6 HIS HB2 1 1
2 572 2 1 6 HIS HB3 H -2.193 0.584 1.876 1.00 . B B . 6 HIS HB3 1 1
2 573 2 1 6 HIS HD1 H -0.846 -1.659 2.979 1.00 . B B . 6 HIS HD1 1 1
2 574 2 1 6 HIS HD2 H -1.134 -1.276 -1.147 1.00 . B B . 6 HIS HD2 1 1
2 575 2 1 6 HIS HE1 H 0.995 -3.100 2.000 1.00 . B B . 6 HIS HE1 1 1
2 576 2 1 6 HIS N N -4.200 -2.012 1.053 1.00 . B B . 6 HIS N 1 1
2 577 2 1 6 HIS ND1 N -0.683 -1.758 2.018 1.00 . B B . 6 HIS ND1 1 1
2 578 2 1 6 HIS NE2 N 0.225 -2.427 0.138 1.00 . B B . 6 HIS NE2 1 1
2 579 2 1 6 HIS O O -5.155 0.767 2.948 1.00 . B B . 6 HIS O 1 1
2 580 2 1 7 HIS C C -7.983 0.660 0.905 1.00 . B B . 7 HIS C 1 1
2 581 2 1 7 HIS CA C -6.638 1.338 0.660 1.00 . B B . 7 HIS CA 1 1
2 582 2 1 7 HIS CB C -6.626 1.995 -0.722 1.00 . B B . 7 HIS CB 1 1
2 583 2 1 7 HIS CD2 C -4.100 2.318 -1.217 1.00 . B B . 7 HIS CD2 1 1
2 584 2 1 7 HIS CE1 C -4.053 4.471 -1.405 1.00 . B B . 7 HIS CE1 1 1
2 585 2 1 7 HIS CG C -5.371 2.758 -1.015 1.00 . B B . 7 HIS CG 1 1
2 586 2 1 7 HIS H H -5.282 -0.127 -0.032 1.00 . B B . 7 HIS H 1 1
2 587 2 1 7 HIS HA H -6.487 2.098 1.412 1.00 . B B . 7 HIS HA 1 1
2 588 2 1 7 HIS HB2 H -6.734 1.230 -1.476 1.00 . B B . 7 HIS HB2 1 1
2 589 2 1 7 HIS HB3 H -7.458 2.682 -0.791 1.00 . B B . 7 HIS HB3 1 1
2 590 2 1 7 HIS HD1 H -6.076 4.745 -1.047 1.00 . B B . 7 HIS HD1 1 1
2 591 2 1 7 HIS HD2 H -3.771 1.288 -1.188 1.00 . B B . 7 HIS HD2 1 1
2 592 2 1 7 HIS HE1 H -3.712 5.486 -1.552 1.00 . B B . 7 HIS HE1 1 1
2 593 2 1 7 HIS N N -5.546 0.380 0.764 1.00 . B B . 7 HIS N 1 1
2 594 2 1 7 HIS ND1 N -5.320 4.129 -1.138 1.00 . B B . 7 HIS ND1 1 1
2 595 2 1 7 HIS NE2 N -3.273 3.409 -1.463 1.00 . B B . 7 HIS NE2 1 1
2 596 2 1 7 HIS O O -8.065 -0.566 0.985 1.00 . B B . 7 HIS O 1 1
2 597 2 1 8 SER C C -11.184 0.919 -0.035 1.00 . B B . 8 SER C 1 1
2 598 2 1 8 SER CA C -10.373 0.944 1.258 1.00 . B B . 8 SER CA 1 1
2 599 2 1 8 SER CB C -11.096 1.789 2.308 1.00 . B B . 8 SER CB 1 1
2 600 2 1 8 SER H H -8.901 2.434 0.950 1.00 . B B . 8 SER H 1 1
2 601 2 1 8 SER HA H -10.277 -0.066 1.628 1.00 . B B . 8 SER HA 1 1
2 602 2 1 8 SER HB2 H -11.021 2.833 2.042 1.00 . B B . 8 SER HB2 1 1
2 603 2 1 8 SER HB3 H -12.137 1.503 2.345 1.00 . B B . 8 SER HB3 1 1
2 604 2 1 8 SER HG H -10.343 2.460 3.987 1.00 . B B . 8 SER HG 1 1
2 605 2 1 8 SER N N -9.031 1.466 1.023 1.00 . B B . 8 SER N 1 1
2 606 2 1 8 SER O O -11.178 1.882 -0.800 1.00 . B B . 8 SER O 1 1
2 607 2 1 8 SER OG O -10.526 1.605 3.593 1.00 . B B . 8 SER OG 1 1
2 608 2 1 9 GLY C C -13.231 -1.724 -1.652 1.00 . B B . 9 GLY C 1 1
2 609 2 1 9 GLY CA C -12.684 -0.321 -1.470 1.00 . B B . 9 GLY CA 1 1
2 610 2 1 9 GLY H H -11.844 -0.925 0.378 1.00 . B B . 9 GLY H 1 1
2 611 2 1 9 GLY HA2 H -13.511 0.371 -1.413 1.00 . B B . 9 GLY HA2 1 1
2 612 2 1 9 GLY HA3 H -12.076 -0.069 -2.326 1.00 . B B . 9 GLY HA3 1 1
2 613 2 1 9 GLY N N -11.878 -0.190 -0.270 1.00 . B B . 9 GLY N 1 1
2 614 2 1 9 GLY O O -12.884 -2.634 -0.900 1.00 . B B . 9 GLY O 1 1
2 615 2 1 10 TYR C C -14.667 -3.498 -4.425 1.00 . B B . 10 TYR C 1 1
2 616 2 1 10 TYR CA C -14.683 -3.201 -2.930 1.00 . B B . 10 TYR CA 1 1
2 617 2 1 10 TYR CB C -16.120 -3.248 -2.405 1.00 . B B . 10 TYR CB 1 1
2 618 2 1 10 TYR CD1 C -17.014 -0.896 -2.599 1.00 . B B . 10 TYR CD1 1 1
2 619 2 1 10 TYR CD2 C -17.899 -2.559 -4.060 1.00 . B B . 10 TYR CD2 1 1
2 620 2 1 10 TYR CE1 C -17.844 0.051 -3.168 1.00 . B B . 10 TYR CE1 1 1
2 621 2 1 10 TYR CE2 C -18.730 -1.618 -4.635 1.00 . B B . 10 TYR CE2 1 1
2 622 2 1 10 TYR CG C -17.028 -2.216 -3.034 1.00 . B B . 10 TYR CG 1 1
2 623 2 1 10 TYR CZ C -18.699 -0.314 -4.186 1.00 . B B . 10 TYR CZ 1 1
2 624 2 1 10 TYR H H -14.325 -1.134 -3.217 1.00 . B B . 10 TYR H 1 1
2 625 2 1 10 TYR HA H -14.098 -3.949 -2.419 1.00 . B B . 10 TYR HA 1 1
2 626 2 1 10 TYR HB2 H -16.537 -4.224 -2.608 1.00 . B B . 10 TYR HB2 1 1
2 627 2 1 10 TYR HB3 H -16.112 -3.080 -1.340 1.00 . B B . 10 TYR HB3 1 1
2 628 2 1 10 TYR HD1 H -16.343 -0.614 -1.802 1.00 . B B . 10 TYR HD1 1 1
2 629 2 1 10 TYR HD2 H -17.922 -3.581 -4.409 1.00 . B B . 10 TYR HD2 1 1
2 630 2 1 10 TYR HE1 H -17.819 1.071 -2.816 1.00 . B B . 10 TYR HE1 1 1
2 631 2 1 10 TYR HE2 H -19.400 -1.905 -5.432 1.00 . B B . 10 TYR HE2 1 1
2 632 2 1 10 TYR HH H -19.056 1.460 -4.837 1.00 . B B . 10 TYR HH 1 1
2 633 2 1 10 TYR N N -14.088 -1.899 -2.651 1.00 . B B . 10 TYR N 1 1
2 634 2 1 10 TYR O O -14.239 -4.610 -4.801 1.00 . B B . 10 TYR O 1 1
2 635 2 1 10 TYR OH O -19.526 0.626 -4.757 1.00 . B B . 10 TYR OH 1 1
2 636 2 1 11 NH2 HN1 H -15.445 -1.679 -4.899 1.00 . B B . 11 NH2 HN1 1 1
2 637 2 1 11 NH2 HN2 H -15.111 -2.731 -6.256 1.00 . B B . 11 NH2 HN2 1 1
2 638 2 1 11 NH2 N N -15.110 -2.561 -5.261 1.00 . B B . 11 NH2 N 1 1
2 639 3 2 1 ZN ZN ZN 1.639 -3.381 -1.021 1.00 . C A . 101 ZN ZN 1 1
2 640 4 2 1 ZN ZN ZN -1.413 2.969 -2.164 1.00 . D A . 102 ZN ZN 1 1
3 641 1 1 1 ASP C C 0.497 5.270 -1.991 1.00 . A A . 1 ASP C 1 1
3 642 1 1 1 ASP CA C 0.453 6.407 -0.975 1.00 . A A . 1 ASP CA 1 1
3 643 1 1 1 ASP CB C 0.729 5.867 0.431 1.00 . A A . 1 ASP CB 1 1
3 644 1 1 1 ASP CG C 1.034 6.971 1.425 1.00 . A A . 1 ASP CG 1 1
3 645 1 1 1 ASP H1 H -1.091 7.352 -1.952 1.00 . A A . 1 ASP H1 1 1
3 646 1 1 1 ASP H2 H -0.806 7.910 -0.354 1.00 . A A . 1 ASP H2 1 1
3 647 1 1 1 ASP H3 H -1.573 6.397 -0.614 1.00 . A A . 1 ASP H3 1 1
3 648 1 1 1 ASP HA H 1.206 7.137 -1.229 1.00 . A A . 1 ASP HA 1 1
3 649 1 1 1 ASP HB2 H -0.140 5.328 0.778 1.00 . A A . 1 ASP HB2 1 1
3 650 1 1 1 ASP HB3 H 1.574 5.195 0.393 1.00 . A A . 1 ASP HB3 1 1
3 651 1 1 1 ASP N N -0.874 7.077 -0.974 1.00 . A A . 1 ASP N 1 1
3 652 1 1 1 ASP O O -0.540 4.793 -2.449 1.00 . A A . 1 ASP O 1 1
3 653 1 1 1 ASP OD1 O 1.405 8.080 0.984 1.00 . A A . 1 ASP OD1 1 1
3 654 1 1 1 ASP OD2 O 0.902 6.727 2.642 1.00 . A A . 1 ASP OD2 1 1
3 655 1 1 2 ALA C C 2.536 2.551 -2.635 1.00 . A A . 2 ALA C 1 1
3 656 1 1 2 ALA CA C 1.888 3.760 -3.295 1.00 . A A . 2 ALA CA 1 1
3 657 1 1 2 ALA CB C 2.732 4.230 -4.468 1.00 . A A . 2 ALA CB 1 1
3 658 1 1 2 ALA H H 2.494 5.262 -1.935 1.00 . A A . 2 ALA H 1 1
3 659 1 1 2 ALA HA H 0.915 3.475 -3.671 1.00 . A A . 2 ALA HA 1 1
3 660 1 1 2 ALA HB1 H 3.699 3.748 -4.430 1.00 . A A . 2 ALA HB1 1 1
3 661 1 1 2 ALA HB2 H 2.861 5.300 -4.415 1.00 . A A . 2 ALA HB2 1 1
3 662 1 1 2 ALA HB3 H 2.239 3.972 -5.393 1.00 . A A . 2 ALA HB3 1 1
3 663 1 1 2 ALA N N 1.705 4.842 -2.336 1.00 . A A . 2 ALA N 1 1
3 664 1 1 2 ALA O O 2.881 2.582 -1.454 1.00 . A A . 2 ALA O 1 1
3 665 1 1 3 GLU C C 4.686 0.521 -2.330 1.00 . A A . 3 GLU C 1 1
3 666 1 1 3 GLU CA C 3.299 0.258 -2.909 1.00 . A A . 3 GLU CA 1 1
3 667 1 1 3 GLU CB C 3.392 -0.783 -4.025 1.00 . A A . 3 GLU CB 1 1
3 668 1 1 3 GLU CD C 2.524 -3.126 -3.656 1.00 . A A . 3 GLU CD 1 1
3 669 1 1 3 GLU CG C 3.704 -2.183 -3.523 1.00 . A A . 3 GLU CG 1 1
3 670 1 1 3 GLU H H 2.400 1.525 -4.342 1.00 . A A . 3 GLU H 1 1
3 671 1 1 3 GLU HA H 2.665 -0.126 -2.124 1.00 . A A . 3 GLU HA 1 1
3 672 1 1 3 GLU HB2 H 2.449 -0.813 -4.550 1.00 . A A . 3 GLU HB2 1 1
3 673 1 1 3 GLU HB3 H 4.169 -0.488 -4.714 1.00 . A A . 3 GLU HB3 1 1
3 674 1 1 3 GLU HG2 H 4.529 -2.581 -4.093 1.00 . A A . 3 GLU HG2 1 1
3 675 1 1 3 GLU HG3 H 3.982 -2.124 -2.481 1.00 . A A . 3 GLU HG3 1 1
3 676 1 1 3 GLU N N 2.696 1.484 -3.409 1.00 . A A . 3 GLU N 1 1
3 677 1 1 3 GLU O O 5.106 -0.140 -1.381 1.00 . A A . 3 GLU O 1 1
3 678 1 1 3 GLU OE1 O 1.622 -3.072 -2.795 1.00 . A A . 3 GLU OE1 1 1
3 679 1 1 3 GLU OE2 O 2.503 -3.919 -4.622 1.00 . A A . 3 GLU OE2 1 1
3 680 1 1 4 PHE C C 6.676 2.718 -1.186 1.00 . A A . 4 PHE C 1 1
3 681 1 1 4 PHE CA C 6.735 1.819 -2.419 1.00 . A A . 4 PHE CA 1 1
3 682 1 1 4 PHE CB C 7.594 2.454 -3.525 1.00 . A A . 4 PHE CB 1 1
3 683 1 1 4 PHE CD1 C 7.596 4.164 -5.358 1.00 . A A . 4 PHE CD1 1 1
3 684 1 1 4 PHE CD2 C 5.935 4.368 -3.662 1.00 . A A . 4 PHE CD2 1 1
3 685 1 1 4 PHE CE1 C 7.102 5.292 -5.983 1.00 . A A . 4 PHE CE1 1 1
3 686 1 1 4 PHE CE2 C 5.437 5.497 -4.284 1.00 . A A . 4 PHE CE2 1 1
3 687 1 1 4 PHE CG C 7.022 3.685 -4.190 1.00 . A A . 4 PHE CG 1 1
3 688 1 1 4 PHE CZ C 6.021 5.960 -5.446 1.00 . A A . 4 PHE CZ 1 1
3 689 1 1 4 PHE H H 5.018 1.989 -3.651 1.00 . A A . 4 PHE H 1 1
3 690 1 1 4 PHE HA H 7.197 0.887 -2.126 1.00 . A A . 4 PHE HA 1 1
3 691 1 1 4 PHE HB2 H 8.546 2.732 -3.104 1.00 . A A . 4 PHE HB2 1 1
3 692 1 1 4 PHE HB3 H 7.761 1.715 -4.295 1.00 . A A . 4 PHE HB3 1 1
3 693 1 1 4 PHE HD1 H 8.442 3.644 -5.783 1.00 . A A . 4 PHE HD1 1 1
3 694 1 1 4 PHE HD2 H 5.473 4.012 -2.762 1.00 . A A . 4 PHE HD2 1 1
3 695 1 1 4 PHE HE1 H 7.562 5.652 -6.892 1.00 . A A . 4 PHE HE1 1 1
3 696 1 1 4 PHE HE2 H 4.592 6.018 -3.862 1.00 . A A . 4 PHE HE2 1 1
3 697 1 1 4 PHE HZ H 5.634 6.842 -5.932 1.00 . A A . 4 PHE HZ 1 1
3 698 1 1 4 PHE N N 5.398 1.489 -2.900 1.00 . A A . 4 PHE N 1 1
3 699 1 1 4 PHE O O 7.697 2.978 -0.550 1.00 . A A . 4 PHE O 1 1
3 700 1 1 5 ARG C C 4.753 3.239 1.490 1.00 . A A . 5 ARG C 1 1
3 701 1 1 5 ARG CA C 5.295 4.043 0.315 1.00 . A A . 5 ARG CA 1 1
3 702 1 1 5 ARG CB C 4.352 5.197 -0.018 1.00 . A A . 5 ARG CB 1 1
3 703 1 1 5 ARG CD C 5.508 6.813 1.513 1.00 . A A . 5 ARG CD 1 1
3 704 1 1 5 ARG CG C 4.180 6.183 1.122 1.00 . A A . 5 ARG CG 1 1
3 705 1 1 5 ARG CZ C 5.383 9.130 2.360 1.00 . A A . 5 ARG CZ 1 1
3 706 1 1 5 ARG H H 4.692 2.945 -1.384 1.00 . A A . 5 ARG H 1 1
3 707 1 1 5 ARG HA H 6.262 4.444 0.584 1.00 . A A . 5 ARG HA 1 1
3 708 1 1 5 ARG HB2 H 4.740 5.731 -0.873 1.00 . A A . 5 ARG HB2 1 1
3 709 1 1 5 ARG HB3 H 3.382 4.793 -0.266 1.00 . A A . 5 ARG HB3 1 1
3 710 1 1 5 ARG HD2 H 6.167 6.033 1.865 1.00 . A A . 5 ARG HD2 1 1
3 711 1 1 5 ARG HD3 H 5.940 7.280 0.642 1.00 . A A . 5 ARG HD3 1 1
3 712 1 1 5 ARG HE H 5.235 7.487 3.484 1.00 . A A . 5 ARG HE 1 1
3 713 1 1 5 ARG HG2 H 3.500 6.963 0.811 1.00 . A A . 5 ARG HG2 1 1
3 714 1 1 5 ARG HG3 H 3.771 5.664 1.975 1.00 . A A . 5 ARG HG3 1 1
3 715 1 1 5 ARG HH11 H 5.624 9.002 0.355 1.00 . A A . 5 ARG HH11 1 1
3 716 1 1 5 ARG HH12 H 5.551 10.610 0.993 1.00 . A A . 5 ARG HH12 1 1
3 717 1 1 5 ARG HH21 H 5.137 9.601 4.310 1.00 . A A . 5 ARG HH21 1 1
3 718 1 1 5 ARG HH22 H 5.275 10.949 3.233 1.00 . A A . 5 ARG HH22 1 1
3 719 1 1 5 ARG N N 5.476 3.186 -0.845 1.00 . A A . 5 ARG N 1 1
3 720 1 1 5 ARG NE N 5.356 7.812 2.567 1.00 . A A . 5 ARG NE 1 1
3 721 1 1 5 ARG NH1 N 5.531 9.620 1.135 1.00 . A A . 5 ARG NH1 1 1
3 722 1 1 5 ARG NH2 N 5.254 9.962 3.385 1.00 . A A . 5 ARG NH2 1 1
3 723 1 1 5 ARG O O 5.125 3.470 2.639 1.00 . A A . 5 ARG O 1 1
3 724 1 1 6 HIS C C 4.351 0.493 2.787 1.00 . A A . 6 HIS C 1 1
3 725 1 1 6 HIS CA C 3.295 1.432 2.225 1.00 . A A . 6 HIS CA 1 1
3 726 1 1 6 HIS CB C 2.135 0.607 1.665 1.00 . A A . 6 HIS CB 1 1
3 727 1 1 6 HIS CD2 C 0.731 1.402 -0.352 1.00 . A A . 6 HIS CD2 1 1
3 728 1 1 6 HIS CE1 C -0.504 2.880 0.631 1.00 . A A . 6 HIS CE1 1 1
3 729 1 1 6 HIS CG C 1.100 1.416 0.953 1.00 . A A . 6 HIS CG 1 1
3 730 1 1 6 HIS H H 3.626 2.138 0.252 1.00 . A A . 6 HIS H 1 1
3 731 1 1 6 HIS HA H 2.931 2.067 3.018 1.00 . A A . 6 HIS HA 1 1
3 732 1 1 6 HIS HB2 H 2.525 -0.118 0.966 1.00 . A A . 6 HIS HB2 1 1
3 733 1 1 6 HIS HB3 H 1.649 0.086 2.479 1.00 . A A . 6 HIS HB3 1 1
3 734 1 1 6 HIS HD1 H 0.331 2.609 2.511 1.00 . A A . 6 HIS HD1 1 1
3 735 1 1 6 HIS HD2 H 1.155 0.771 -1.122 1.00 . A A . 6 HIS HD2 1 1
3 736 1 1 6 HIS HE1 H -1.240 3.648 0.821 1.00 . A A . 6 HIS HE1 1 1
3 737 1 1 6 HIS N N 3.877 2.281 1.190 1.00 . A A . 6 HIS N 1 1
3 738 1 1 6 HIS ND1 N 0.307 2.362 1.564 1.00 . A A . 6 HIS ND1 1 1
3 739 1 1 6 HIS NE2 N -0.285 2.333 -0.549 1.00 . A A . 6 HIS NE2 1 1
3 740 1 1 6 HIS O O 4.446 0.288 3.997 1.00 . A A . 6 HIS O 1 1
3 741 1 1 7 HIS C C 7.495 -0.250 2.569 1.00 . A A . 7 HIS C 1 1
3 742 1 1 7 HIS CA C 6.203 -1.002 2.269 1.00 . A A . 7 HIS CA 1 1
3 743 1 1 7 HIS CB C 6.438 -2.021 1.153 1.00 . A A . 7 HIS CB 1 1
3 744 1 1 7 HIS CD2 C 4.139 -2.631 0.116 1.00 . A A . 7 HIS CD2 1 1
3 745 1 1 7 HIS CE1 C 3.938 -4.648 0.867 1.00 . A A . 7 HIS CE1 1 1
3 746 1 1 7 HIS CG C 5.247 -2.884 0.862 1.00 . A A . 7 HIS CG 1 1
3 747 1 1 7 HIS H H 5.013 0.127 0.939 1.00 . A A . 7 HIS H 1 1
3 748 1 1 7 HIS HA H 5.885 -1.523 3.161 1.00 . A A . 7 HIS HA 1 1
3 749 1 1 7 HIS HB2 H 6.694 -1.495 0.245 1.00 . A A . 7 HIS HB2 1 1
3 750 1 1 7 HIS HB3 H 7.257 -2.667 1.432 1.00 . A A . 7 HIS HB3 1 1
3 751 1 1 7 HIS HD1 H 5.733 -4.650 1.907 1.00 . A A . 7 HIS HD1 1 1
3 752 1 1 7 HIS HD2 H 3.910 -1.703 -0.391 1.00 . A A . 7 HIS HD2 1 1
3 753 1 1 7 HIS HE1 H 3.554 -5.635 1.081 1.00 . A A . 7 HIS HE1 1 1
3 754 1 1 7 HIS N N 5.145 -0.078 1.888 1.00 . A A . 7 HIS N 1 1
3 755 1 1 7 HIS ND1 N 5.100 -4.170 1.333 1.00 . A A . 7 HIS ND1 1 1
3 756 1 1 7 HIS NE2 N 3.319 -3.755 0.122 1.00 . A A . 7 HIS NE2 1 1
3 757 1 1 7 HIS O O 7.594 0.954 2.327 1.00 . A A . 7 HIS O 1 1
3 758 1 1 8 SER C C 10.897 -1.031 2.639 1.00 . A A . 8 SER C 1 1
3 759 1 1 8 SER CA C 9.770 -0.365 3.423 1.00 . A A . 8 SER CA 1 1
3 760 1 1 8 SER CB C 10.040 -0.481 4.925 1.00 . A A . 8 SER CB 1 1
3 761 1 1 8 SER H H 8.343 -1.921 3.260 1.00 . A A . 8 SER H 1 1
3 762 1 1 8 SER HA H 9.729 0.679 3.154 1.00 . A A . 8 SER HA 1 1
3 763 1 1 8 SER HB2 H 9.218 -0.042 5.470 1.00 . A A . 8 SER HB2 1 1
3 764 1 1 8 SER HB3 H 10.134 -1.523 5.192 1.00 . A A . 8 SER HB3 1 1
3 765 1 1 8 SER HG H 11.062 1.133 5.358 1.00 . A A . 8 SER HG 1 1
3 766 1 1 8 SER N N 8.482 -0.966 3.092 1.00 . A A . 8 SER N 1 1
3 767 1 1 8 SER O O 10.977 -2.257 2.567 1.00 . A A . 8 SER O 1 1
3 768 1 1 8 SER OG O 11.236 0.191 5.281 1.00 . A A . 8 SER OG 1 1
3 769 1 1 9 GLY C C 14.221 -0.401 1.889 1.00 . A A . 9 GLY C 1 1
3 770 1 1 9 GLY CA C 12.875 -0.738 1.279 1.00 . A A . 9 GLY CA 1 1
3 771 1 1 9 GLY H H 11.651 0.757 2.144 1.00 . A A . 9 GLY H 1 1
3 772 1 1 9 GLY HA2 H 12.779 -1.813 1.219 1.00 . A A . 9 GLY HA2 1 1
3 773 1 1 9 GLY HA3 H 12.831 -0.327 0.282 1.00 . A A . 9 GLY HA3 1 1
3 774 1 1 9 GLY N N 11.765 -0.214 2.051 1.00 . A A . 9 GLY N 1 1
3 775 1 1 9 GLY O O 14.500 -0.761 3.033 1.00 . A A . 9 GLY O 1 1
3 776 1 1 10 TYR C C 16.319 1.945 2.429 1.00 . A A . 10 TYR C 1 1
3 777 1 1 10 TYR CA C 16.385 0.673 1.589 1.00 . A A . 10 TYR CA 1 1
3 778 1 1 10 TYR CB C 17.324 0.880 0.401 1.00 . A A . 10 TYR CB 1 1
3 779 1 1 10 TYR CD1 C 16.604 -0.361 -1.675 1.00 . A A . 10 TYR CD1 1 1
3 780 1 1 10 TYR CD2 C 18.237 -1.376 -0.270 1.00 . A A . 10 TYR CD2 1 1
3 781 1 1 10 TYR CE1 C 16.658 -1.446 -2.529 1.00 . A A . 10 TYR CE1 1 1
3 782 1 1 10 TYR CE2 C 18.299 -2.465 -1.119 1.00 . A A . 10 TYR CE2 1 1
3 783 1 1 10 TYR CG C 17.390 -0.308 -0.532 1.00 . A A . 10 TYR CG 1 1
3 784 1 1 10 TYR CZ C 17.507 -2.495 -2.247 1.00 . A A . 10 TYR CZ 1 1
3 785 1 1 10 TYR H H 14.779 0.544 0.217 1.00 . A A . 10 TYR H 1 1
3 786 1 1 10 TYR HA H 16.766 -0.130 2.202 1.00 . A A . 10 TYR HA 1 1
3 787 1 1 10 TYR HB2 H 16.988 1.731 -0.171 1.00 . A A . 10 TYR HB2 1 1
3 788 1 1 10 TYR HB3 H 18.323 1.070 0.768 1.00 . A A . 10 TYR HB3 1 1
3 789 1 1 10 TYR HD1 H 15.938 0.462 -1.894 1.00 . A A . 10 TYR HD1 1 1
3 790 1 1 10 TYR HD2 H 18.856 -1.351 0.616 1.00 . A A . 10 TYR HD2 1 1
3 791 1 1 10 TYR HE1 H 16.037 -1.468 -3.414 1.00 . A A . 10 TYR HE1 1 1
3 792 1 1 10 TYR HE2 H 18.964 -3.286 -0.897 1.00 . A A . 10 TYR HE2 1 1
3 793 1 1 10 TYR HH H 17.368 -4.378 -2.606 1.00 . A A . 10 TYR HH 1 1
3 794 1 1 10 TYR N N 15.058 0.289 1.121 1.00 . A A . 10 TYR N 1 1
3 795 1 1 10 TYR O O 16.430 1.840 3.669 1.00 . A A . 10 TYR O 1 1
3 796 1 1 10 TYR OH O 17.566 -3.576 -3.096 1.00 . A A . 10 TYR OH 1 1
3 797 1 1 11 NH2 HN1 H 16.066 3.128 0.793 1.00 . A A . 11 NH2 HN1 1 1
3 798 1 1 11 NH2 HN2 H 16.102 3.965 2.329 1.00 . A A . 11 NH2 HN2 1 1
3 799 1 1 11 NH2 N N 16.149 3.106 1.800 1.00 . A A . 11 NH2 N 1 1
3 800 2 1 1 ASP C C -0.582 -5.677 -0.057 1.00 . B B . 1 ASP C 1 1
3 801 2 1 1 ASP CA C -0.883 -6.469 1.212 1.00 . B B . 1 ASP CA 1 1
3 802 2 1 1 ASP CB C -1.213 -5.510 2.360 1.00 . B B . 1 ASP CB 1 1
3 803 2 1 1 ASP CG C -1.785 -6.230 3.566 1.00 . B B . 1 ASP CG 1 1
3 804 2 1 1 ASP H1 H 0.258 -8.172 1.034 1.00 . B B . 1 ASP H1 1 1
3 805 2 1 1 ASP H2 H 0.182 -7.525 2.622 1.00 . B B . 1 ASP H2 1 1
3 806 2 1 1 ASP H3 H 1.144 -6.757 1.425 1.00 . B B . 1 ASP H3 1 1
3 807 2 1 1 ASP HA H -1.728 -7.115 1.032 1.00 . B B . 1 ASP HA 1 1
3 808 2 1 1 ASP HB2 H -0.312 -5.000 2.664 1.00 . B B . 1 ASP HB2 1 1
3 809 2 1 1 ASP HB3 H -1.937 -4.785 2.017 1.00 . B B . 1 ASP HB3 1 1
3 810 2 1 1 ASP N N 0.280 -7.306 1.610 1.00 . B B . 1 ASP N 1 1
3 811 2 1 1 ASP O O 0.576 -5.391 -0.360 1.00 . B B . 1 ASP O 1 1
3 812 2 1 1 ASP OD1 O -2.250 -7.379 3.408 1.00 . B B . 1 ASP OD1 1 1
3 813 2 1 1 ASP OD2 O -1.770 -5.643 4.668 1.00 . B B . 1 ASP OD2 1 1
3 814 2 1 2 ALA C C -2.206 -3.224 -1.926 1.00 . B B . 2 ALA C 1 1
3 815 2 1 2 ALA CA C -1.484 -4.561 -2.026 1.00 . B B . 2 ALA CA 1 1
3 816 2 1 2 ALA CB C -2.012 -5.362 -3.207 1.00 . B B . 2 ALA CB 1 1
3 817 2 1 2 ALA H H -2.530 -5.581 -0.495 1.00 . B B . 2 ALA H 1 1
3 818 2 1 2 ALA HA H -0.432 -4.380 -2.186 1.00 . B B . 2 ALA HA 1 1
3 819 2 1 2 ALA HB1 H -3.049 -5.116 -3.374 1.00 . B B . 2 ALA HB1 1 1
3 820 2 1 2 ALA HB2 H -1.922 -6.418 -2.996 1.00 . B B . 2 ALA HB2 1 1
3 821 2 1 2 ALA HB3 H -1.438 -5.121 -4.090 1.00 . B B . 2 ALA HB3 1 1
3 822 2 1 2 ALA N N -1.632 -5.324 -0.791 1.00 . B B . 2 ALA N 1 1
3 823 2 1 2 ALA O O -2.773 -2.890 -0.887 1.00 . B B . 2 ALA O 1 1
3 824 2 1 3 GLU C C -4.300 -1.269 -2.658 1.00 . B B . 3 GLU C 1 1
3 825 2 1 3 GLU CA C -2.830 -1.153 -3.045 1.00 . B B . 3 GLU CA 1 1
3 826 2 1 3 GLU CB C -2.703 -0.526 -4.434 1.00 . B B . 3 GLU CB 1 1
3 827 2 1 3 GLU CD C -2.044 1.885 -4.065 1.00 . B B . 3 GLU CD 1 1
3 828 2 1 3 GLU CG C -3.141 0.930 -4.491 1.00 . B B . 3 GLU CG 1 1
3 829 2 1 3 GLU H H -1.707 -2.780 -3.808 1.00 . B B . 3 GLU H 1 1
3 830 2 1 3 GLU HA H -2.333 -0.517 -2.327 1.00 . B B . 3 GLU HA 1 1
3 831 2 1 3 GLU HB2 H -1.672 -0.582 -4.747 1.00 . B B . 3 GLU HB2 1 1
3 832 2 1 3 GLU HB3 H -3.312 -1.089 -5.126 1.00 . B B . 3 GLU HB3 1 1
3 833 2 1 3 GLU HG2 H -3.428 1.167 -5.503 1.00 . B B . 3 GLU HG2 1 1
3 834 2 1 3 GLU HG3 H -3.989 1.064 -3.836 1.00 . B B . 3 GLU HG3 1 1
3 835 2 1 3 GLU N N -2.178 -2.459 -3.011 1.00 . B B . 3 GLU N 1 1
3 836 2 1 3 GLU O O -4.847 -0.396 -1.988 1.00 . B B . 3 GLU O 1 1
3 837 2 1 3 GLU OE1 O -1.104 1.441 -3.376 1.00 . B B . 3 GLU OE1 1 1
3 838 2 1 3 GLU OE2 O -2.122 3.077 -4.428 1.00 . B B . 3 GLU OE2 1 1
3 839 2 1 4 PHE C C -6.513 -2.875 -1.278 1.00 . B B . 4 PHE C 1 1
3 840 2 1 4 PHE CA C -6.339 -2.577 -2.763 1.00 . B B . 4 PHE CA 1 1
3 841 2 1 4 PHE CB C -6.902 -3.729 -3.602 1.00 . B B . 4 PHE CB 1 1
3 842 2 1 4 PHE CD1 C -6.824 -5.742 -2.105 1.00 . B B . 4 PHE CD1 1 1
3 843 2 1 4 PHE CD2 C -5.373 -5.680 -3.997 1.00 . B B . 4 PHE CD2 1 1
3 844 2 1 4 PHE CE1 C -6.325 -6.983 -1.759 1.00 . B B . 4 PHE CE1 1 1
3 845 2 1 4 PHE CE2 C -4.870 -6.920 -3.655 1.00 . B B . 4 PHE CE2 1 1
3 846 2 1 4 PHE CG C -6.354 -5.077 -3.227 1.00 . B B . 4 PHE CG 1 1
3 847 2 1 4 PHE CZ C -5.346 -7.573 -2.535 1.00 . B B . 4 PHE CZ 1 1
3 848 2 1 4 PHE H H -4.449 -3.023 -3.604 1.00 . B B . 4 PHE H 1 1
3 849 2 1 4 PHE HA H -6.876 -1.672 -2.999 1.00 . B B . 4 PHE HA 1 1
3 850 2 1 4 PHE HB2 H -7.974 -3.762 -3.479 1.00 . B B . 4 PHE HB2 1 1
3 851 2 1 4 PHE HB3 H -6.670 -3.551 -4.642 1.00 . B B . 4 PHE HB3 1 1
3 852 2 1 4 PHE HD1 H -7.588 -5.281 -1.498 1.00 . B B . 4 PHE HD1 1 1
3 853 2 1 4 PHE HD2 H -5.000 -5.171 -4.874 1.00 . B B . 4 PHE HD2 1 1
3 854 2 1 4 PHE HE1 H -6.698 -7.490 -0.882 1.00 . B B . 4 PHE HE1 1 1
3 855 2 1 4 PHE HE2 H -4.104 -7.379 -4.263 1.00 . B B . 4 PHE HE2 1 1
3 856 2 1 4 PHE HZ H -4.954 -8.542 -2.266 1.00 . B B . 4 PHE HZ 1 1
3 857 2 1 4 PHE N N -4.934 -2.355 -3.078 1.00 . B B . 4 PHE N 1 1
3 858 2 1 4 PHE O O -7.536 -2.540 -0.681 1.00 . B B . 4 PHE O 1 1
3 859 2 1 5 ARG C C -5.111 -2.664 1.587 1.00 . B B . 5 ARG C 1 1
3 860 2 1 5 ARG CA C -5.539 -3.850 0.728 1.00 . B B . 5 ARG CA 1 1
3 861 2 1 5 ARG CB C -4.633 -5.049 1.000 1.00 . B B . 5 ARG CB 1 1
3 862 2 1 5 ARG CD C -6.181 -6.374 2.467 1.00 . B B . 5 ARG CD 1 1
3 863 2 1 5 ARG CG C -4.840 -5.664 2.373 1.00 . B B . 5 ARG CG 1 1
3 864 2 1 5 ARG CZ C -5.916 -8.160 4.146 1.00 . B B . 5 ARG CZ 1 1
3 865 2 1 5 ARG H H -4.714 -3.746 -1.214 1.00 . B B . 5 ARG H 1 1
3 866 2 1 5 ARG HA H -6.555 -4.114 0.980 1.00 . B B . 5 ARG HA 1 1
3 867 2 1 5 ARG HB2 H -4.825 -5.808 0.257 1.00 . B B . 5 ARG HB2 1 1
3 868 2 1 5 ARG HB3 H -3.604 -4.733 0.924 1.00 . B B . 5 ARG HB3 1 1
3 869 2 1 5 ARG HD2 H -6.965 -5.656 2.278 1.00 . B B . 5 ARG HD2 1 1
3 870 2 1 5 ARG HD3 H -6.216 -7.150 1.718 1.00 . B B . 5 ARG HD3 1 1
3 871 2 1 5 ARG HE H -6.926 -6.462 4.430 1.00 . B B . 5 ARG HE 1 1
3 872 2 1 5 ARG HG2 H -4.052 -6.378 2.558 1.00 . B B . 5 ARG HG2 1 1
3 873 2 1 5 ARG HG3 H -4.802 -4.881 3.115 1.00 . B B . 5 ARG HG3 1 1
3 874 2 1 5 ARG HH11 H -4.992 -8.526 2.383 1.00 . B B . 5 ARG HH11 1 1
3 875 2 1 5 ARG HH12 H -4.830 -9.767 3.579 1.00 . B B . 5 ARG HH12 1 1
3 876 2 1 5 ARG HH21 H -6.711 -8.095 6.003 1.00 . B B . 5 ARG HH21 1 1
3 877 2 1 5 ARG HH22 H -5.805 -9.524 5.632 1.00 . B B . 5 ARG HH22 1 1
3 878 2 1 5 ARG N N -5.502 -3.507 -0.686 1.00 . B B . 5 ARG N 1 1
3 879 2 1 5 ARG NE N -6.394 -6.971 3.783 1.00 . B B . 5 ARG NE 1 1
3 880 2 1 5 ARG NH1 N -5.186 -8.876 3.300 1.00 . B B . 5 ARG NH1 1 1
3 881 2 1 5 ARG NH2 N -6.164 -8.631 5.360 1.00 . B B . 5 ARG NH2 1 1
3 882 2 1 5 ARG O O -5.674 -2.424 2.654 1.00 . B B . 5 ARG O 1 1
3 883 2 1 6 HIS C C -4.716 0.293 1.954 1.00 . B B . 6 HIS C 1 1
3 884 2 1 6 HIS CA C -3.621 -0.755 1.836 1.00 . B B . 6 HIS CA 1 1
3 885 2 1 6 HIS CB C -2.415 -0.138 1.120 1.00 . B B . 6 HIS CB 1 1
3 886 2 1 6 HIS CD2 C -0.612 -1.299 -0.315 1.00 . B B . 6 HIS CD2 1 1
3 887 2 1 6 HIS CE1 C 0.199 -2.667 1.148 1.00 . B B . 6 HIS CE1 1 1
3 888 2 1 6 HIS CG C -1.308 -1.101 0.831 1.00 . B B . 6 HIS CG 1 1
3 889 2 1 6 HIS H H -3.712 -2.156 0.249 1.00 . B B . 6 HIS H 1 1
3 890 2 1 6 HIS HA H -3.325 -1.073 2.824 1.00 . B B . 6 HIS HA 1 1
3 891 2 1 6 HIS HB2 H -2.742 0.276 0.180 1.00 . B B . 6 HIS HB2 1 1
3 892 2 1 6 HIS HB3 H -2.013 0.654 1.734 1.00 . B B . 6 HIS HB3 1 1
3 893 2 1 6 HIS HD1 H -1.071 -2.083 2.683 1.00 . B B . 6 HIS HD1 1 1
3 894 2 1 6 HIS HD2 H -0.761 -0.772 -1.246 1.00 . B B . 6 HIS HD2 1 1
3 895 2 1 6 HIS HE1 H 0.801 -3.427 1.626 1.00 . B B . 6 HIS HE1 1 1
3 896 2 1 6 HIS N N -4.115 -1.921 1.109 1.00 . B B . 6 HIS N 1 1
3 897 2 1 6 HIS ND1 N -0.781 -1.980 1.753 1.00 . B B . 6 HIS ND1 1 1
3 898 2 1 6 HIS NE2 N 0.340 -2.291 -0.109 1.00 . B B . 6 HIS NE2 1 1
3 899 2 1 6 HIS O O -4.869 0.941 2.988 1.00 . B B . 6 HIS O 1 1
3 900 2 1 7 HIS C C -7.884 0.766 1.177 1.00 . B B . 7 HIS C 1 1
3 901 2 1 7 HIS CA C -6.553 1.423 0.828 1.00 . B B . 7 HIS CA 1 1
3 902 2 1 7 HIS CB C -6.627 2.058 -0.561 1.00 . B B . 7 HIS CB 1 1
3 903 2 1 7 HIS CD2 C -4.128 2.307 -1.214 1.00 . B B . 7 HIS CD2 1 1
3 904 2 1 7 HIS CE1 C -4.049 4.452 -1.483 1.00 . B B . 7 HIS CE1 1 1
3 905 2 1 7 HIS CG C -5.377 2.783 -0.958 1.00 . B B . 7 HIS CG 1 1
3 906 2 1 7 HIS H H -5.288 -0.097 0.082 1.00 . B B . 7 HIS H 1 1
3 907 2 1 7 HIS HA H -6.342 2.192 1.556 1.00 . B B . 7 HIS HA 1 1
3 908 2 1 7 HIS HB2 H -6.810 1.286 -1.293 1.00 . B B . 7 HIS HB2 1 1
3 909 2 1 7 HIS HB3 H -7.443 2.765 -0.582 1.00 . B B . 7 HIS HB3 1 1
3 910 2 1 7 HIS HD1 H -6.044 4.782 -1.022 1.00 . B B . 7 HIS HD1 1 1
3 911 2 1 7 HIS HD2 H -3.817 1.274 -1.170 1.00 . B B . 7 HIS HD2 1 1
3 912 2 1 7 HIS HE1 H -3.698 5.453 -1.688 1.00 . B B . 7 HIS HE1 1 1
3 913 2 1 7 HIS N N -5.469 0.452 0.874 1.00 . B B . 7 HIS N 1 1
3 914 2 1 7 HIS ND1 N -5.305 4.147 -1.132 1.00 . B B . 7 HIS ND1 1 1
3 915 2 1 7 HIS NE2 N -3.295 3.371 -1.546 1.00 . B B . 7 HIS NE2 1 1
3 916 2 1 7 HIS O O -8.176 -0.344 0.733 1.00 . B B . 7 HIS O 1 1
3 917 2 1 8 SER C C -11.118 1.814 1.841 1.00 . B B . 8 SER C 1 1
3 918 2 1 8 SER CA C -9.990 0.945 2.387 1.00 . B B . 8 SER CA 1 1
3 919 2 1 8 SER CB C -10.075 0.877 3.912 1.00 . B B . 8 SER CB 1 1
3 920 2 1 8 SER H H -8.399 2.339 2.297 1.00 . B B . 8 SER H 1 1
3 921 2 1 8 SER HA H -10.093 -0.053 1.985 1.00 . B B . 8 SER HA 1 1
3 922 2 1 8 SER HB2 H -9.314 0.209 4.285 1.00 . B B . 8 SER HB2 1 1
3 923 2 1 8 SER HB3 H -9.921 1.865 4.324 1.00 . B B . 8 SER HB3 1 1
3 924 2 1 8 SER HG H -11.230 -0.391 4.859 1.00 . B B . 8 SER HG 1 1
3 925 2 1 8 SER N N -8.688 1.460 1.975 1.00 . B B . 8 SER N 1 1
3 926 2 1 8 SER O O -11.023 3.042 1.839 1.00 . B B . 8 SER O 1 1
3 927 2 1 8 SER OG O -11.343 0.403 4.332 1.00 . B B . 8 SER OG 1 1
3 928 2 1 9 GLY C C -13.408 1.779 -0.675 1.00 . B B . 9 GLY C 1 1
3 929 2 1 9 GLY CA C -13.313 1.897 0.833 1.00 . B B . 9 GLY CA 1 1
3 930 2 1 9 GLY H H -12.200 0.189 1.403 1.00 . B B . 9 GLY H 1 1
3 931 2 1 9 GLY HA2 H -14.221 1.510 1.271 1.00 . B B . 9 GLY HA2 1 1
3 932 2 1 9 GLY HA3 H -13.215 2.940 1.096 1.00 . B B . 9 GLY HA3 1 1
3 933 2 1 9 GLY N N -12.182 1.168 1.377 1.00 . B B . 9 GLY N 1 1
3 934 2 1 9 GLY O O -12.427 1.448 -1.341 1.00 . B B . 9 GLY O 1 1
3 935 2 1 10 TYR C C -14.817 3.362 -3.280 1.00 . B B . 10 TYR C 1 1
3 936 2 1 10 TYR CA C -14.811 1.971 -2.654 1.00 . B B . 10 TYR CA 1 1
3 937 2 1 10 TYR CB C -16.133 1.259 -2.949 1.00 . B B . 10 TYR CB 1 1
3 938 2 1 10 TYR CD1 C -17.819 1.719 -1.128 1.00 . B B . 10 TYR CD1 1 1
3 939 2 1 10 TYR CD2 C -18.012 2.931 -3.173 1.00 . B B . 10 TYR CD2 1 1
3 940 2 1 10 TYR CE1 C -18.925 2.379 -0.628 1.00 . B B . 10 TYR CE1 1 1
3 941 2 1 10 TYR CE2 C -19.119 3.594 -2.678 1.00 . B B . 10 TYR CE2 1 1
3 942 2 1 10 TYR CG C -17.344 1.983 -2.407 1.00 . B B . 10 TYR CG 1 1
3 943 2 1 10 TYR CZ C -19.572 3.314 -1.407 1.00 . B B . 10 TYR CZ 1 1
3 944 2 1 10 TYR H H -15.335 2.307 -0.632 1.00 . B B . 10 TYR H 1 1
3 945 2 1 10 TYR HA H -14.002 1.398 -3.083 1.00 . B B . 10 TYR HA 1 1
3 946 2 1 10 TYR HB2 H -16.253 1.169 -4.019 1.00 . B B . 10 TYR HB2 1 1
3 947 2 1 10 TYR HB3 H -16.110 0.274 -2.510 1.00 . B B . 10 TYR HB3 1 1
3 948 2 1 10 TYR HD1 H -17.310 0.985 -0.521 1.00 . B B . 10 TYR HD1 1 1
3 949 2 1 10 TYR HD2 H -17.656 3.146 -4.168 1.00 . B B . 10 TYR HD2 1 1
3 950 2 1 10 TYR HE1 H -19.279 2.159 0.369 1.00 . B B . 10 TYR HE1 1 1
3 951 2 1 10 TYR HE2 H -19.626 4.328 -3.289 1.00 . B B . 10 TYR HE2 1 1
3 952 2 1 10 TYR HH H -21.443 3.404 -0.977 1.00 . B B . 10 TYR HH 1 1
3 953 2 1 10 TYR N N -14.591 2.048 -1.215 1.00 . B B . 10 TYR N 1 1
3 954 2 1 10 TYR O O -14.767 3.448 -4.526 1.00 . B B . 10 TYR O 1 1
3 955 2 1 10 TYR OH O -20.674 3.974 -0.912 1.00 . B B . 10 TYR OH 1 1
3 956 2 1 11 NH2 HN1 H -14.914 4.285 -1.470 1.00 . B B . 11 NH2 HN1 1 1
3 957 2 1 11 NH2 HN2 H -14.881 5.351 -2.857 1.00 . B B . 11 NH2 HN2 1 1
3 958 2 1 11 NH2 N N -14.875 4.417 -2.471 1.00 . B B . 11 NH2 N 1 1
3 959 3 2 1 ZN ZN ZN 1.583 -3.715 -0.937 1.00 . C A . 101 ZN ZN 1 1
3 960 4 2 1 ZN ZN ZN -1.399 2.964 -2.170 1.00 . D A . 102 ZN ZN 1 1
4 961 1 1 1 ASP C C 0.480 5.270 -1.765 1.00 . A A . 1 ASP C 1 1
4 962 1 1 1 ASP CA C 0.426 6.367 -0.707 1.00 . A A . 1 ASP CA 1 1
4 963 1 1 1 ASP CB C 0.574 5.758 0.689 1.00 . A A . 1 ASP CB 1 1
4 964 1 1 1 ASP CG C 0.802 6.810 1.757 1.00 . A A . 1 ASP CG 1 1
4 965 1 1 1 ASP H1 H -1.630 6.406 -0.794 1.00 . A A . 1 ASP H1 1 1
4 966 1 1 1 ASP H2 H -0.853 7.688 -1.630 1.00 . A A . 1 ASP H2 1 1
4 967 1 1 1 ASP H3 H -0.928 7.699 0.084 1.00 . A A . 1 ASP H3 1 1
4 968 1 1 1 ASP HA H 1.232 7.064 -0.878 1.00 . A A . 1 ASP HA 1 1
4 969 1 1 1 ASP HB2 H -0.325 5.214 0.934 1.00 . A A . 1 ASP HB2 1 1
4 970 1 1 1 ASP HB3 H 1.415 5.078 0.691 1.00 . A A . 1 ASP HB3 1 1
4 971 1 1 1 ASP N N -0.862 7.106 -0.766 1.00 . A A . 1 ASP N 1 1
4 972 1 1 1 ASP O O -0.550 4.848 -2.289 1.00 . A A . 1 ASP O 1 1
4 973 1 1 1 ASP OD1 O 1.251 7.922 1.409 1.00 . A A . 1 ASP OD1 1 1
4 974 1 1 1 ASP OD2 O 0.531 6.521 2.941 1.00 . A A . 1 ASP OD2 1 1
4 975 1 1 2 ALA C C 2.607 2.565 -2.453 1.00 . A A . 2 ALA C 1 1
4 976 1 1 2 ALA CA C 1.880 3.759 -3.060 1.00 . A A . 2 ALA CA 1 1
4 977 1 1 2 ALA CB C 2.650 4.297 -4.257 1.00 . A A . 2 ALA CB 1 1
4 978 1 1 2 ALA H H 2.471 5.185 -1.614 1.00 . A A . 2 ALA H 1 1
4 979 1 1 2 ALA HA H 0.906 3.438 -3.402 1.00 . A A . 2 ALA HA 1 1
4 980 1 1 2 ALA HB1 H 3.632 3.851 -4.286 1.00 . A A . 2 ALA HB1 1 1
4 981 1 1 2 ALA HB2 H 2.745 5.370 -4.172 1.00 . A A . 2 ALA HB2 1 1
4 982 1 1 2 ALA HB3 H 2.119 4.056 -5.165 1.00 . A A . 2 ALA HB3 1 1
4 983 1 1 2 ALA N N 1.688 4.810 -2.069 1.00 . A A . 2 ALA N 1 1
4 984 1 1 2 ALA O O 3.011 2.597 -1.290 1.00 . A A . 2 ALA O 1 1
4 985 1 1 3 GLU C C 4.801 0.631 -2.172 1.00 . A A . 3 GLU C 1 1
4 986 1 1 3 GLU CA C 3.445 0.301 -2.788 1.00 . A A . 3 GLU CA 1 1
4 987 1 1 3 GLU CB C 3.623 -0.677 -3.951 1.00 . A A . 3 GLU CB 1 1
4 988 1 1 3 GLU CD C 2.569 -2.776 -3.024 1.00 . A A . 3 GLU CD 1 1
4 989 1 1 3 GLU CG C 3.842 -2.115 -3.513 1.00 . A A . 3 GLU CG 1 1
4 990 1 1 3 GLU H H 2.424 1.549 -4.163 1.00 . A A . 3 GLU H 1 1
4 991 1 1 3 GLU HA H 2.823 -0.159 -2.034 1.00 . A A . 3 GLU HA 1 1
4 992 1 1 3 GLU HB2 H 2.739 -0.643 -4.572 1.00 . A A . 3 GLU HB2 1 1
4 993 1 1 3 GLU HB3 H 4.474 -0.367 -4.538 1.00 . A A . 3 GLU HB3 1 1
4 994 1 1 3 GLU HG2 H 4.220 -2.680 -4.351 1.00 . A A . 3 GLU HG2 1 1
4 995 1 1 3 GLU HG3 H 4.567 -2.129 -2.713 1.00 . A A . 3 GLU HG3 1 1
4 996 1 1 3 GLU N N 2.769 1.512 -3.246 1.00 . A A . 3 GLU N 1 1
4 997 1 1 3 GLU O O 5.221 0.007 -1.198 1.00 . A A . 3 GLU O 1 1
4 998 1 1 3 GLU OE1 O 1.679 -2.052 -2.534 1.00 . A A . 3 GLU OE1 1 1
4 999 1 1 3 GLU OE2 O 2.462 -4.015 -3.139 1.00 . A A . 3 GLU OE2 1 1
4 1000 1 1 4 PHE C C 6.660 2.717 -0.887 1.00 . A A . 4 PHE C 1 1
4 1001 1 1 4 PHE CA C 6.789 2.026 -2.239 1.00 . A A . 4 PHE CA 1 1
4 1002 1 1 4 PHE CB C 7.478 2.957 -3.238 1.00 . A A . 4 PHE CB 1 1
4 1003 1 1 4 PHE CD1 C 6.775 5.258 -2.524 1.00 . A A . 4 PHE CD1 1 1
4 1004 1 1 4 PHE CD2 C 6.011 4.441 -4.631 1.00 . A A . 4 PHE CD2 1 1
4 1005 1 1 4 PHE CE1 C 6.096 6.443 -2.734 1.00 . A A . 4 PHE CE1 1 1
4 1006 1 1 4 PHE CE2 C 5.331 5.625 -4.846 1.00 . A A . 4 PHE CE2 1 1
4 1007 1 1 4 PHE CG C 6.739 4.244 -3.468 1.00 . A A . 4 PHE CG 1 1
4 1008 1 1 4 PHE CZ C 5.374 6.628 -3.897 1.00 . A A . 4 PHE CZ 1 1
4 1009 1 1 4 PHE H H 5.098 2.083 -3.511 1.00 . A A . 4 PHE H 1 1
4 1010 1 1 4 PHE HA H 7.388 1.136 -2.117 1.00 . A A . 4 PHE HA 1 1
4 1011 1 1 4 PHE HB2 H 8.464 3.201 -2.871 1.00 . A A . 4 PHE HB2 1 1
4 1012 1 1 4 PHE HB3 H 7.570 2.450 -4.188 1.00 . A A . 4 PHE HB3 1 1
4 1013 1 1 4 PHE HD1 H 7.340 5.114 -1.615 1.00 . A A . 4 PHE HD1 1 1
4 1014 1 1 4 PHE HD2 H 5.977 3.659 -5.374 1.00 . A A . 4 PHE HD2 1 1
4 1015 1 1 4 PHE HE1 H 6.132 7.225 -1.989 1.00 . A A . 4 PHE HE1 1 1
4 1016 1 1 4 PHE HE2 H 4.768 5.767 -5.757 1.00 . A A . 4 PHE HE2 1 1
4 1017 1 1 4 PHE HZ H 4.845 7.555 -4.063 1.00 . A A . 4 PHE HZ 1 1
4 1018 1 1 4 PHE N N 5.482 1.616 -2.740 1.00 . A A . 4 PHE N 1 1
4 1019 1 1 4 PHE O O 7.562 2.642 -0.052 1.00 . A A . 4 PHE O 1 1
4 1020 1 1 5 ARG C C 4.762 3.160 1.645 1.00 . A A . 5 ARG C 1 1
4 1021 1 1 5 ARG CA C 5.289 4.102 0.569 1.00 . A A . 5 ARG CA 1 1
4 1022 1 1 5 ARG CB C 4.295 5.240 0.339 1.00 . A A . 5 ARG CB 1 1
4 1023 1 1 5 ARG CD C 5.312 7.173 1.582 1.00 . A A . 5 ARG CD 1 1
4 1024 1 1 5 ARG CG C 4.163 6.179 1.526 1.00 . A A . 5 ARG CG 1 1
4 1025 1 1 5 ARG CZ C 5.854 9.181 2.906 1.00 . A A . 5 ARG CZ 1 1
4 1026 1 1 5 ARG H H 4.855 3.417 -1.383 1.00 . A A . 5 ARG H 1 1
4 1027 1 1 5 ARG HA H 6.226 4.520 0.902 1.00 . A A . 5 ARG HA 1 1
4 1028 1 1 5 ARG HB2 H 4.616 5.817 -0.516 1.00 . A A . 5 ARG HB2 1 1
4 1029 1 1 5 ARG HB3 H 3.323 4.817 0.134 1.00 . A A . 5 ARG HB3 1 1
4 1030 1 1 5 ARG HD2 H 6.244 6.629 1.563 1.00 . A A . 5 ARG HD2 1 1
4 1031 1 1 5 ARG HD3 H 5.254 7.819 0.718 1.00 . A A . 5 ARG HD3 1 1
4 1032 1 1 5 ARG HE H 4.769 7.639 3.559 1.00 . A A . 5 ARG HE 1 1
4 1033 1 1 5 ARG HG2 H 3.236 6.723 1.439 1.00 . A A . 5 ARG HG2 1 1
4 1034 1 1 5 ARG HG3 H 4.157 5.595 2.434 1.00 . A A . 5 ARG HG3 1 1
4 1035 1 1 5 ARG HH11 H 6.618 9.185 1.033 1.00 . A A . 5 ARG HH11 1 1
4 1036 1 1 5 ARG HH12 H 6.979 10.586 1.985 1.00 . A A . 5 ARG HH12 1 1
4 1037 1 1 5 ARG HH21 H 5.245 9.481 4.809 1.00 . A A . 5 ARG HH21 1 1
4 1038 1 1 5 ARG HH22 H 6.201 10.754 4.128 1.00 . A A . 5 ARG HH22 1 1
4 1039 1 1 5 ARG N N 5.536 3.393 -0.679 1.00 . A A . 5 ARG N 1 1
4 1040 1 1 5 ARG NE N 5.265 7.992 2.791 1.00 . A A . 5 ARG NE 1 1
4 1041 1 1 5 ARG NH1 N 6.540 9.692 1.891 1.00 . A A . 5 ARG NH1 1 1
4 1042 1 1 5 ARG NH2 N 5.759 9.860 4.041 1.00 . A A . 5 ARG NH2 1 1
4 1043 1 1 5 ARG O O 5.123 3.277 2.818 1.00 . A A . 5 ARG O 1 1
4 1044 1 1 6 HIS C C 4.395 0.322 2.714 1.00 . A A . 6 HIS C 1 1
4 1045 1 1 6 HIS CA C 3.328 1.267 2.183 1.00 . A A . 6 HIS CA 1 1
4 1046 1 1 6 HIS CB C 2.226 0.451 1.508 1.00 . A A . 6 HIS CB 1 1
4 1047 1 1 6 HIS CD2 C 0.780 1.345 -0.432 1.00 . A A . 6 HIS CD2 1 1
4 1048 1 1 6 HIS CE1 C -0.467 2.736 0.657 1.00 . A A . 6 HIS CE1 1 1
4 1049 1 1 6 HIS CG C 1.166 1.284 0.865 1.00 . A A . 6 HIS CG 1 1
4 1050 1 1 6 HIS H H 3.655 2.181 0.297 1.00 . A A . 6 HIS H 1 1
4 1051 1 1 6 HIS HA H 2.905 1.819 3.007 1.00 . A A . 6 HIS HA 1 1
4 1052 1 1 6 HIS HB2 H 2.666 -0.170 0.744 1.00 . A A . 6 HIS HB2 1 1
4 1053 1 1 6 HIS HB3 H 1.752 -0.180 2.247 1.00 . A A . 6 HIS HB3 1 1
4 1054 1 1 6 HIS HD1 H 0.395 2.360 2.505 1.00 . A A . 6 HIS HD1 1 1
4 1055 1 1 6 HIS HD2 H 1.200 0.772 -1.246 1.00 . A A . 6 HIS HD2 1 1
4 1056 1 1 6 HIS HE1 H -1.215 3.473 0.904 1.00 . A A . 6 HIS HE1 1 1
4 1057 1 1 6 HIS N N 3.905 2.226 1.245 1.00 . A A . 6 HIS N 1 1
4 1058 1 1 6 HIS ND1 N 0.364 2.173 1.544 1.00 . A A . 6 HIS ND1 1 1
4 1059 1 1 6 HIS NE2 N -0.252 2.269 -0.558 1.00 . A A . 6 HIS NE2 1 1
4 1060 1 1 6 HIS O O 4.407 -0.022 3.896 1.00 . A A . 6 HIS O 1 1
4 1061 1 1 7 HIS C C 7.659 -0.267 2.429 1.00 . A A . 7 HIS C 1 1
4 1062 1 1 7 HIS CA C 6.353 -1.018 2.191 1.00 . A A . 7 HIS CA 1 1
4 1063 1 1 7 HIS CB C 6.540 -2.063 1.093 1.00 . A A . 7 HIS CB 1 1
4 1064 1 1 7 HIS CD2 C 4.210 -2.535 0.058 1.00 . A A . 7 HIS CD2 1 1
4 1065 1 1 7 HIS CE1 C 3.887 -4.534 0.812 1.00 . A A . 7 HIS CE1 1 1
4 1066 1 1 7 HIS CG C 5.302 -2.854 0.801 1.00 . A A . 7 HIS CG 1 1
4 1067 1 1 7 HIS H H 5.211 0.206 0.897 1.00 . A A . 7 HIS H 1 1
4 1068 1 1 7 HIS HA H 6.066 -1.517 3.105 1.00 . A A . 7 HIS HA 1 1
4 1069 1 1 7 HIS HB2 H 6.840 -1.569 0.182 1.00 . A A . 7 HIS HB2 1 1
4 1070 1 1 7 HIS HB3 H 7.315 -2.755 1.392 1.00 . A A . 7 HIS HB3 1 1
4 1071 1 1 7 HIS HD1 H 5.678 -4.646 1.850 1.00 . A A . 7 HIS HD1 1 1
4 1072 1 1 7 HIS HD2 H 4.034 -1.595 -0.444 1.00 . A A . 7 HIS HD2 1 1
4 1073 1 1 7 HIS HE1 H 3.439 -5.492 1.032 1.00 . A A . 7 HIS HE1 1 1
4 1074 1 1 7 HIS N N 5.283 -0.102 1.826 1.00 . A A . 7 HIS N 1 1
4 1075 1 1 7 HIS ND1 N 5.075 -4.128 1.275 1.00 . A A . 7 HIS ND1 1 1
4 1076 1 1 7 HIS NE2 N 3.323 -3.605 0.067 1.00 . A A . 7 HIS NE2 1 1
4 1077 1 1 7 HIS O O 8.145 0.445 1.552 1.00 . A A . 7 HIS O 1 1
4 1078 1 1 8 SER C C 10.536 -0.796 4.361 1.00 . A A . 8 SER C 1 1
4 1079 1 1 8 SER CA C 9.471 0.227 3.978 1.00 . A A . 8 SER CA 1 1
4 1080 1 1 8 SER CB C 9.246 1.203 5.134 1.00 . A A . 8 SER CB 1 1
4 1081 1 1 8 SER H H 7.785 -1.016 4.279 1.00 . A A . 8 SER H 1 1
4 1082 1 1 8 SER HA H 9.813 0.778 3.114 1.00 . A A . 8 SER HA 1 1
4 1083 1 1 8 SER HB2 H 8.857 0.665 5.986 1.00 . A A . 8 SER HB2 1 1
4 1084 1 1 8 SER HB3 H 10.185 1.666 5.400 1.00 . A A . 8 SER HB3 1 1
4 1085 1 1 8 SER HG H 8.781 2.917 4.307 1.00 . A A . 8 SER HG 1 1
4 1086 1 1 8 SER N N 8.221 -0.434 3.622 1.00 . A A . 8 SER N 1 1
4 1087 1 1 8 SER O O 10.226 -1.862 4.892 1.00 . A A . 8 SER O 1 1
4 1088 1 1 8 SER OG O 8.323 2.215 4.775 1.00 . A A . 8 SER OG 1 1
4 1089 1 1 9 GLY C C 13.187 -2.333 3.285 1.00 . A A . 9 GLY C 1 1
4 1090 1 1 9 GLY CA C 12.885 -1.364 4.410 1.00 . A A . 9 GLY CA 1 1
4 1091 1 1 9 GLY H H 11.982 0.400 3.663 1.00 . A A . 9 GLY H 1 1
4 1092 1 1 9 GLY HA2 H 13.770 -0.780 4.616 1.00 . A A . 9 GLY HA2 1 1
4 1093 1 1 9 GLY HA3 H 12.623 -1.927 5.293 1.00 . A A . 9 GLY HA3 1 1
4 1094 1 1 9 GLY N N 11.793 -0.464 4.088 1.00 . A A . 9 GLY N 1 1
4 1095 1 1 9 GLY O O 12.508 -2.335 2.258 1.00 . A A . 9 GLY O 1 1
4 1096 1 1 10 TYR C C 13.767 -5.407 2.588 1.00 . A A . 10 TYR C 1 1
4 1097 1 1 10 TYR CA C 14.603 -4.137 2.467 1.00 . A A . 10 TYR CA 1 1
4 1098 1 1 10 TYR CB C 16.088 -4.474 2.603 1.00 . A A . 10 TYR CB 1 1
4 1099 1 1 10 TYR CD1 C 17.421 -2.413 3.196 1.00 . A A . 10 TYR CD1 1 1
4 1100 1 1 10 TYR CD2 C 17.454 -3.162 0.933 1.00 . A A . 10 TYR CD2 1 1
4 1101 1 1 10 TYR CE1 C 18.258 -1.365 2.865 1.00 . A A . 10 TYR CE1 1 1
4 1102 1 1 10 TYR CE2 C 18.293 -2.117 0.595 1.00 . A A . 10 TYR CE2 1 1
4 1103 1 1 10 TYR CG C 17.005 -3.328 2.237 1.00 . A A . 10 TYR CG 1 1
4 1104 1 1 10 TYR CZ C 18.691 -1.222 1.564 1.00 . A A . 10 TYR CZ 1 1
4 1105 1 1 10 TYR H H 14.715 -3.109 4.314 1.00 . A A . 10 TYR H 1 1
4 1106 1 1 10 TYR HA H 14.430 -3.698 1.496 1.00 . A A . 10 TYR HA 1 1
4 1107 1 1 10 TYR HB2 H 16.295 -4.751 3.625 1.00 . A A . 10 TYR HB2 1 1
4 1108 1 1 10 TYR HB3 H 16.321 -5.306 1.955 1.00 . A A . 10 TYR HB3 1 1
4 1109 1 1 10 TYR HD1 H 17.080 -2.528 4.214 1.00 . A A . 10 TYR HD1 1 1
4 1110 1 1 10 TYR HD2 H 17.140 -3.866 0.176 1.00 . A A . 10 TYR HD2 1 1
4 1111 1 1 10 TYR HE1 H 18.570 -0.663 3.625 1.00 . A A . 10 TYR HE1 1 1
4 1112 1 1 10 TYR HE2 H 18.632 -2.005 -0.426 1.00 . A A . 10 TYR HE2 1 1
4 1113 1 1 10 TYR HH H 20.439 -0.449 1.352 1.00 . A A . 10 TYR HH 1 1
4 1114 1 1 10 TYR N N 14.212 -3.158 3.476 1.00 . A A . 10 TYR N 1 1
4 1115 1 1 10 TYR O O 14.140 -6.283 3.396 1.00 . A A . 10 TYR O 1 1
4 1116 1 1 10 TYR OH O 19.525 -0.179 1.231 1.00 . A A . 10 TYR OH 1 1
4 1117 1 1 11 NH2 HN1 H 12.426 -4.777 1.194 1.00 . A A . 11 NH2 HN1 1 1
4 1118 1 1 11 NH2 HN2 H 12.106 -6.350 1.889 1.00 . A A . 11 NH2 HN2 1 1
4 1119 1 1 11 NH2 N N 12.679 -5.521 1.829 1.00 . A A . 11 NH2 N 1 1
4 1120 2 1 1 ASP C C -0.275 -5.630 -0.724 1.00 . B B . 1 ASP C 1 1
4 1121 2 1 1 ASP CA C -0.292 -6.489 0.534 1.00 . B B . 1 ASP CA 1 1
4 1122 2 1 1 ASP CB C -1.095 -5.795 1.635 1.00 . B B . 1 ASP CB 1 1
4 1123 2 1 1 ASP CG C -0.896 -6.436 2.995 1.00 . B B . 1 ASP CG 1 1
4 1124 2 1 1 ASP H1 H 1.047 -7.539 1.693 1.00 . B B . 1 ASP H1 1 1
4 1125 2 1 1 ASP H2 H 1.410 -5.871 1.514 1.00 . B B . 1 ASP H2 1 1
4 1126 2 1 1 ASP H3 H 1.688 -6.957 0.214 1.00 . B B . 1 ASP H3 1 1
4 1127 2 1 1 ASP HA H -0.750 -7.440 0.305 1.00 . B B . 1 ASP HA 1 1
4 1128 2 1 1 ASP HB2 H -0.796 -4.761 1.696 1.00 . B B . 1 ASP HB2 1 1
4 1129 2 1 1 ASP HB3 H -2.144 -5.846 1.387 1.00 . B B . 1 ASP HB3 1 1
4 1130 2 1 1 ASP N N 1.087 -6.736 1.034 1.00 . B B . 1 ASP N 1 1
4 1131 2 1 1 ASP O O 0.780 -5.170 -1.160 1.00 . B B . 1 ASP O 1 1
4 1132 2 1 1 ASP OD1 O -0.656 -7.661 3.046 1.00 . B B . 1 ASP OD1 1 1
4 1133 2 1 1 ASP OD2 O -0.981 -5.713 4.011 1.00 . B B . 1 ASP OD2 1 1
4 1134 2 1 2 ALA C C -2.297 -3.303 -2.238 1.00 . B B . 2 ALA C 1 1
4 1135 2 1 2 ALA CA C -1.569 -4.611 -2.515 1.00 . B B . 2 ALA CA 1 1
4 1136 2 1 2 ALA CB C -2.284 -5.397 -3.602 1.00 . B B . 2 ALA CB 1 1
4 1137 2 1 2 ALA H H -2.256 -5.810 -0.912 1.00 . B B . 2 ALA H 1 1
4 1138 2 1 2 ALA HA H -0.568 -4.386 -2.866 1.00 . B B . 2 ALA HA 1 1
4 1139 2 1 2 ALA HB1 H -1.616 -5.548 -4.437 1.00 . B B . 2 ALA HB1 1 1
4 1140 2 1 2 ALA HB2 H -3.155 -4.849 -3.929 1.00 . B B . 2 ALA HB2 1 1
4 1141 2 1 2 ALA HB3 H -2.589 -6.355 -3.209 1.00 . B B . 2 ALA HB3 1 1
4 1142 2 1 2 ALA N N -1.450 -5.416 -1.306 1.00 . B B . 2 ALA N 1 1
4 1143 2 1 2 ALA O O -2.779 -3.069 -1.129 1.00 . B B . 2 ALA O 1 1
4 1144 2 1 3 GLU C C -4.456 -1.301 -2.600 1.00 . B B . 3 GLU C 1 1
4 1145 2 1 3 GLU CA C -3.033 -1.156 -3.133 1.00 . B B . 3 GLU CA 1 1
4 1146 2 1 3 GLU CB C -3.057 -0.447 -4.489 1.00 . B B . 3 GLU CB 1 1
4 1147 2 1 3 GLU CD C -1.970 1.825 -4.329 1.00 . B B . 3 GLU CD 1 1
4 1148 2 1 3 GLU CG C -3.272 1.053 -4.386 1.00 . B B . 3 GLU CG 1 1
4 1149 2 1 3 GLU H H -1.965 -2.698 -4.111 1.00 . B B . 3 GLU H 1 1
4 1150 2 1 3 GLU HA H -2.463 -0.558 -2.439 1.00 . B B . 3 GLU HA 1 1
4 1151 2 1 3 GLU HB2 H -2.117 -0.621 -4.991 1.00 . B B . 3 GLU HB2 1 1
4 1152 2 1 3 GLU HB3 H -3.855 -0.864 -5.086 1.00 . B B . 3 GLU HB3 1 1
4 1153 2 1 3 GLU HG2 H -3.830 1.385 -5.249 1.00 . B B . 3 GLU HG2 1 1
4 1154 2 1 3 GLU HG3 H -3.837 1.263 -3.490 1.00 . B B . 3 GLU HG3 1 1
4 1155 2 1 3 GLU N N -2.371 -2.451 -3.255 1.00 . B B . 3 GLU N 1 1
4 1156 2 1 3 GLU O O -4.940 -0.445 -1.860 1.00 . B B . 3 GLU O 1 1
4 1157 2 1 3 GLU OE1 O -1.170 1.566 -3.407 1.00 . B B . 3 GLU OE1 1 1
4 1158 2 1 3 GLU OE2 O -1.750 2.687 -5.205 1.00 . B B . 3 GLU OE2 1 1
4 1159 2 1 4 PHE C C -6.520 -2.949 -1.041 1.00 . B B . 4 PHE C 1 1
4 1160 2 1 4 PHE CA C -6.491 -2.618 -2.528 1.00 . B B . 4 PHE CA 1 1
4 1161 2 1 4 PHE CB C -7.146 -3.742 -3.338 1.00 . B B . 4 PHE CB 1 1
4 1162 2 1 4 PHE CD1 C -7.074 -5.915 -2.087 1.00 . B B . 4 PHE CD1 1 1
4 1163 2 1 4 PHE CD2 C -5.504 -5.568 -3.847 1.00 . B B . 4 PHE CD2 1 1
4 1164 2 1 4 PHE CE1 C -6.542 -7.170 -1.857 1.00 . B B . 4 PHE CE1 1 1
4 1165 2 1 4 PHE CE2 C -4.967 -6.820 -3.620 1.00 . B B . 4 PHE CE2 1 1
4 1166 2 1 4 PHE CG C -6.560 -5.101 -3.083 1.00 . B B . 4 PHE CG 1 1
4 1167 2 1 4 PHE CZ C -5.488 -7.622 -2.624 1.00 . B B . 4 PHE CZ 1 1
4 1168 2 1 4 PHE H H -4.693 -3.035 -3.566 1.00 . B B . 4 PHE H 1 1
4 1169 2 1 4 PHE HA H -7.047 -1.706 -2.685 1.00 . B B . 4 PHE HA 1 1
4 1170 2 1 4 PHE HB2 H -8.196 -3.784 -3.096 1.00 . B B . 4 PHE HB2 1 1
4 1171 2 1 4 PHE HB3 H -7.035 -3.523 -4.391 1.00 . B B . 4 PHE HB3 1 1
4 1172 2 1 4 PHE HD1 H -7.898 -5.561 -1.485 1.00 . B B . 4 PHE HD1 1 1
4 1173 2 1 4 PHE HD2 H -5.095 -4.941 -4.626 1.00 . B B . 4 PHE HD2 1 1
4 1174 2 1 4 PHE HE1 H -6.951 -7.793 -1.075 1.00 . B B . 4 PHE HE1 1 1
4 1175 2 1 4 PHE HE2 H -4.142 -7.173 -4.222 1.00 . B B . 4 PHE HE2 1 1
4 1176 2 1 4 PHE HZ H -5.071 -8.602 -2.446 1.00 . B B . 4 PHE HZ 1 1
4 1177 2 1 4 PHE N N -5.125 -2.383 -2.979 1.00 . B B . 4 PHE N 1 1
4 1178 2 1 4 PHE O O -7.458 -2.584 -0.333 1.00 . B B . 4 PHE O 1 1
4 1179 2 1 5 ARG C C -5.066 -2.765 1.679 1.00 . B B . 5 ARG C 1 1
4 1180 2 1 5 ARG CA C -5.385 -3.991 0.838 1.00 . B B . 5 ARG CA 1 1
4 1181 2 1 5 ARG CB C -4.306 -5.049 1.045 1.00 . B B . 5 ARG CB 1 1
4 1182 2 1 5 ARG CD C -3.887 -7.523 1.167 1.00 . B B . 5 ARG CD 1 1
4 1183 2 1 5 ARG CG C -4.666 -6.410 0.481 1.00 . B B . 5 ARG CG 1 1
4 1184 2 1 5 ARG CZ C -4.651 -9.731 0.370 1.00 . B B . 5 ARG CZ 1 1
4 1185 2 1 5 ARG H H -4.754 -3.881 -1.182 1.00 . B B . 5 ARG H 1 1
4 1186 2 1 5 ARG HA H -6.338 -4.390 1.146 1.00 . B B . 5 ARG HA 1 1
4 1187 2 1 5 ARG HB2 H -3.398 -4.714 0.565 1.00 . B B . 5 ARG HB2 1 1
4 1188 2 1 5 ARG HB3 H -4.124 -5.158 2.104 1.00 . B B . 5 ARG HB3 1 1
4 1189 2 1 5 ARG HD2 H -2.992 -7.722 0.598 1.00 . B B . 5 ARG HD2 1 1
4 1190 2 1 5 ARG HD3 H -3.615 -7.193 2.159 1.00 . B B . 5 ARG HD3 1 1
4 1191 2 1 5 ARG HE H -5.230 -8.863 2.070 1.00 . B B . 5 ARG HE 1 1
4 1192 2 1 5 ARG HG2 H -5.719 -6.581 0.630 1.00 . B B . 5 ARG HG2 1 1
4 1193 2 1 5 ARG HG3 H -4.441 -6.422 -0.575 1.00 . B B . 5 ARG HG3 1 1
4 1194 2 1 5 ARG HH11 H -3.351 -8.806 -0.876 1.00 . B B . 5 ARG HH11 1 1
4 1195 2 1 5 ARG HH12 H -3.901 -10.362 -1.398 1.00 . B B . 5 ARG HH12 1 1
4 1196 2 1 5 ARG HH21 H -5.950 -10.905 1.379 1.00 . B B . 5 ARG HH21 1 1
4 1197 2 1 5 ARG HH22 H -5.375 -11.552 -0.122 1.00 . B B . 5 ARG HH22 1 1
4 1198 2 1 5 ARG N N -5.480 -3.629 -0.571 1.00 . B B . 5 ARG N 1 1
4 1199 2 1 5 ARG NE N -4.667 -8.754 1.276 1.00 . B B . 5 ARG NE 1 1
4 1200 2 1 5 ARG NH1 N -3.906 -9.624 -0.724 1.00 . B B . 5 ARG NH1 1 1
4 1201 2 1 5 ARG NH2 N -5.385 -10.819 0.558 1.00 . B B . 5 ARG NH2 1 1
4 1202 2 1 5 ARG O O -5.658 -2.546 2.735 1.00 . B B . 5 ARG O 1 1
4 1203 2 1 6 HIS C C -4.858 0.259 1.906 1.00 . B B . 6 HIS C 1 1
4 1204 2 1 6 HIS CA C -3.719 -0.750 1.888 1.00 . B B . 6 HIS CA 1 1
4 1205 2 1 6 HIS CB C -2.502 -0.123 1.208 1.00 . B B . 6 HIS CB 1 1
4 1206 2 1 6 HIS CD2 C -0.827 -1.538 -0.151 1.00 . B B . 6 HIS CD2 1 1
4 1207 2 1 6 HIS CE1 C 0.308 -2.418 1.464 1.00 . B B . 6 HIS CE1 1 1
4 1208 2 1 6 HIS CG C -1.362 -1.069 1.002 1.00 . B B . 6 HIS CG 1 1
4 1209 2 1 6 HIS H H -3.697 -2.199 0.339 1.00 . B B . 6 HIS H 1 1
4 1210 2 1 6 HIS HA H -3.464 -1.012 2.903 1.00 . B B . 6 HIS HA 1 1
4 1211 2 1 6 HIS HB2 H -2.798 0.250 0.239 1.00 . B B . 6 HIS HB2 1 1
4 1212 2 1 6 HIS HB3 H -2.146 0.701 1.810 1.00 . B B . 6 HIS HB3 1 1
4 1213 2 1 6 HIS HD1 H -0.769 -1.498 2.981 1.00 . B B . 6 HIS HD1 1 1
4 1214 2 1 6 HIS HD2 H -1.159 -1.291 -1.148 1.00 . B B . 6 HIS HD2 1 1
4 1215 2 1 6 HIS HE1 H 1.041 -2.989 2.018 1.00 . B B . 6 HIS HE1 1 1
4 1216 2 1 6 HIS N N -4.125 -1.965 1.192 1.00 . B B . 6 HIS N 1 1
4 1217 2 1 6 HIS ND1 N -0.630 -1.638 2.022 1.00 . B B . 6 HIS ND1 1 1
4 1218 2 1 6 HIS NE2 N 0.227 -2.393 0.149 1.00 . B B . 6 HIS NE2 1 1
4 1219 2 1 6 HIS O O -5.089 0.941 2.903 1.00 . B B . 6 HIS O 1 1
4 1220 2 1 7 HIS C C -8.011 0.546 0.836 1.00 . B B . 7 HIS C 1 1
4 1221 2 1 7 HIS CA C -6.682 1.271 0.651 1.00 . B B . 7 HIS CA 1 1
4 1222 2 1 7 HIS CB C -6.644 1.948 -0.720 1.00 . B B . 7 HIS CB 1 1
4 1223 2 1 7 HIS CD2 C -4.113 2.284 -1.176 1.00 . B B . 7 HIS CD2 1 1
4 1224 2 1 7 HIS CE1 C -4.064 4.444 -1.302 1.00 . B B . 7 HIS CE1 1 1
4 1225 2 1 7 HIS CG C -5.386 2.720 -0.977 1.00 . B B . 7 HIS CG 1 1
4 1226 2 1 7 HIS H H -5.323 -0.225 0.026 1.00 . B B . 7 HIS H 1 1
4 1227 2 1 7 HIS HA H -6.585 2.024 1.418 1.00 . B B . 7 HIS HA 1 1
4 1228 2 1 7 HIS HB2 H -6.733 1.194 -1.488 1.00 . B B . 7 HIS HB2 1 1
4 1229 2 1 7 HIS HB3 H -7.476 2.632 -0.798 1.00 . B B . 7 HIS HB3 1 1
4 1230 2 1 7 HIS HD1 H -6.092 4.706 -0.959 1.00 . B B . 7 HIS HD1 1 1
4 1231 2 1 7 HIS HD2 H -3.785 1.255 -1.173 1.00 . B B . 7 HIS HD2 1 1
4 1232 2 1 7 HIS HE1 H -3.723 5.461 -1.417 1.00 . B B . 7 HIS HE1 1 1
4 1233 2 1 7 HIS N N -5.564 0.347 0.785 1.00 . B B . 7 HIS N 1 1
4 1234 2 1 7 HIS ND1 N -5.334 4.094 -1.060 1.00 . B B . 7 HIS ND1 1 1
4 1235 2 1 7 HIS NE2 N -3.283 3.383 -1.383 1.00 . B B . 7 HIS NE2 1 1
4 1236 2 1 7 HIS O O -8.687 0.210 -0.135 1.00 . B B . 7 HIS O 1 1
4 1237 2 1 8 SER C C -10.392 0.347 3.500 1.00 . B B . 8 SER C 1 1
4 1238 2 1 8 SER CA C -9.623 -0.384 2.403 1.00 . B B . 8 SER CA 1 1
4 1239 2 1 8 SER CB C -9.341 -1.823 2.834 1.00 . B B . 8 SER CB 1 1
4 1240 2 1 8 SER H H -7.795 0.594 2.824 1.00 . B B . 8 SER H 1 1
4 1241 2 1 8 SER HA H -10.227 -0.398 1.507 1.00 . B B . 8 SER HA 1 1
4 1242 2 1 8 SER HB2 H -8.836 -2.345 2.034 1.00 . B B . 8 SER HB2 1 1
4 1243 2 1 8 SER HB3 H -8.711 -1.816 3.712 1.00 . B B . 8 SER HB3 1 1
4 1244 2 1 8 SER HG H -11.038 -2.664 2.332 1.00 . B B . 8 SER HG 1 1
4 1245 2 1 8 SER N N -8.376 0.304 2.091 1.00 . B B . 8 SER N 1 1
4 1246 2 1 8 SER O O -9.814 0.756 4.508 1.00 . B B . 8 SER O 1 1
4 1247 2 1 8 SER OG O -10.542 -2.510 3.140 1.00 . B B . 8 SER OG 1 1
4 1248 2 1 9 GLY C C -12.189 2.659 4.398 1.00 . B B . 9 GLY C 1 1
4 1249 2 1 9 GLY CA C -12.521 1.184 4.277 1.00 . B B . 9 GLY CA 1 1
4 1250 2 1 9 GLY H H -12.099 0.157 2.474 1.00 . B B . 9 GLY H 1 1
4 1251 2 1 9 GLY HA2 H -13.557 1.083 3.988 1.00 . B B . 9 GLY HA2 1 1
4 1252 2 1 9 GLY HA3 H -12.380 0.714 5.239 1.00 . B B . 9 GLY HA3 1 1
4 1253 2 1 9 GLY N N -11.695 0.506 3.296 1.00 . B B . 9 GLY N 1 1
4 1254 2 1 9 GLY O O -11.019 3.043 4.374 1.00 . B B . 9 GLY O 1 1
4 1255 2 1 10 TYR C C -13.365 5.395 6.070 1.00 . B B . 10 TYR C 1 1
4 1256 2 1 10 TYR CA C -13.037 4.926 4.656 1.00 . B B . 10 TYR CA 1 1
4 1257 2 1 10 TYR CB C -13.916 5.662 3.644 1.00 . B B . 10 TYR CB 1 1
4 1258 2 1 10 TYR CD1 C -15.821 4.177 2.914 1.00 . B B . 10 TYR CD1 1 1
4 1259 2 1 10 TYR CD2 C -16.282 5.908 4.489 1.00 . B B . 10 TYR CD2 1 1
4 1260 2 1 10 TYR CE1 C -17.147 3.789 2.947 1.00 . B B . 10 TYR CE1 1 1
4 1261 2 1 10 TYR CE2 C -17.610 5.526 4.526 1.00 . B B . 10 TYR CE2 1 1
4 1262 2 1 10 TYR CG C -15.366 5.241 3.684 1.00 . B B . 10 TYR CG 1 1
4 1263 2 1 10 TYR CZ C -18.037 4.465 3.753 1.00 . B B . 10 TYR CZ 1 1
4 1264 2 1 10 TYR H H -14.130 3.117 4.542 1.00 . B B . 10 TYR H 1 1
4 1265 2 1 10 TYR HA H -12.001 5.148 4.447 1.00 . B B . 10 TYR HA 1 1
4 1266 2 1 10 TYR HB2 H -13.872 6.722 3.844 1.00 . B B . 10 TYR HB2 1 1
4 1267 2 1 10 TYR HB3 H -13.540 5.474 2.648 1.00 . B B . 10 TYR HB3 1 1
4 1268 2 1 10 TYR HD1 H -15.122 3.649 2.285 1.00 . B B . 10 TYR HD1 1 1
4 1269 2 1 10 TYR HD2 H -15.945 6.737 5.092 1.00 . B B . 10 TYR HD2 1 1
4 1270 2 1 10 TYR HE1 H -17.481 2.958 2.342 1.00 . B B . 10 TYR HE1 1 1
4 1271 2 1 10 TYR HE2 H -18.307 6.055 5.158 1.00 . B B . 10 TYR HE2 1 1
4 1272 2 1 10 TYR HH H -19.646 3.848 2.903 1.00 . B B . 10 TYR HH 1 1
4 1273 2 1 10 TYR N N -13.220 3.485 4.530 1.00 . B B . 10 TYR N 1 1
4 1274 2 1 10 TYR O O -13.061 6.564 6.390 1.00 . B B . 10 TYR O 1 1
4 1275 2 1 10 TYR OH O -19.358 4.081 3.788 1.00 . B B . 10 TYR OH 1 1
4 1276 2 1 11 NH2 HN1 H -14.184 3.604 6.579 1.00 . B B . 11 NH2 HN1 1 1
4 1277 2 1 11 NH2 HN2 H -14.192 4.819 7.837 1.00 . B B . 11 NH2 HN2 1 1
4 1278 2 1 11 NH2 N N -13.962 4.537 6.895 1.00 . B B . 11 NH2 N 1 1
4 1279 3 2 1 ZN ZN ZN 1.636 -3.322 -1.035 1.00 . C A . 101 ZN ZN 1 1
4 1280 4 2 1 ZN ZN ZN -1.414 3.011 -2.098 1.00 . D A . 102 ZN ZN 1 1
5 1281 1 1 1 ASP C C 0.510 5.122 -2.020 1.00 . A A . 1 ASP C 1 1
5 1282 1 1 1 ASP CA C 0.452 6.281 -1.032 1.00 . A A . 1 ASP CA 1 1
5 1283 1 1 1 ASP CB C 0.415 5.743 0.401 1.00 . A A . 1 ASP CB 1 1
5 1284 1 1 1 ASP CG C 0.551 6.842 1.436 1.00 . A A . 1 ASP CG 1 1
5 1285 1 1 1 ASP H1 H -0.570 7.727 -2.078 1.00 . A A . 1 ASP H1 1 1
5 1286 1 1 1 ASP H2 H -0.915 7.683 -0.398 1.00 . A A . 1 ASP H2 1 1
5 1287 1 1 1 ASP H3 H -1.554 6.478 -1.440 1.00 . A A . 1 ASP H3 1 1
5 1288 1 1 1 ASP HA H 1.328 6.898 -1.158 1.00 . A A . 1 ASP HA 1 1
5 1289 1 1 1 ASP HB2 H -0.526 5.237 0.563 1.00 . A A . 1 ASP HB2 1 1
5 1290 1 1 1 ASP HB3 H 1.226 5.040 0.537 1.00 . A A . 1 ASP HB3 1 1
5 1291 1 1 1 ASP N N -0.756 7.117 -1.258 1.00 . A A . 1 ASP N 1 1
5 1292 1 1 1 ASP O O -0.521 4.655 -2.505 1.00 . A A . 1 ASP O 1 1
5 1293 1 1 1 ASP OD1 O 0.166 6.612 2.601 1.00 . A A . 1 ASP OD1 1 1
5 1294 1 1 1 ASP OD2 O 1.046 7.933 1.082 1.00 . A A . 1 ASP OD2 1 1
5 1295 1 1 2 ALA C C 2.623 2.392 -2.550 1.00 . A A . 2 ALA C 1 1
5 1296 1 1 2 ALA CA C 1.916 3.552 -3.238 1.00 . A A . 2 ALA CA 1 1
5 1297 1 1 2 ALA CB C 2.704 4.014 -4.455 1.00 . A A . 2 ALA CB 1 1
5 1298 1 1 2 ALA H H 2.505 5.074 -1.892 1.00 . A A . 2 ALA H 1 1
5 1299 1 1 2 ALA HA H 0.944 3.220 -3.573 1.00 . A A . 2 ALA HA 1 1
5 1300 1 1 2 ALA HB1 H 2.960 5.057 -4.344 1.00 . A A . 2 ALA HB1 1 1
5 1301 1 1 2 ALA HB2 H 2.104 3.883 -5.344 1.00 . A A . 2 ALA HB2 1 1
5 1302 1 1 2 ALA HB3 H 3.608 3.429 -4.543 1.00 . A A . 2 ALA HB3 1 1
5 1303 1 1 2 ALA N N 1.721 4.660 -2.312 1.00 . A A . 2 ALA N 1 1
5 1304 1 1 2 ALA O O 2.967 2.473 -1.372 1.00 . A A . 2 ALA O 1 1
5 1305 1 1 3 GLU C C 4.827 0.507 -2.090 1.00 . A A . 3 GLU C 1 1
5 1306 1 1 3 GLU CA C 3.503 0.132 -2.752 1.00 . A A . 3 GLU CA 1 1
5 1307 1 1 3 GLU CB C 3.744 -0.896 -3.860 1.00 . A A . 3 GLU CB 1 1
5 1308 1 1 3 GLU CD C 2.683 -3.005 -2.957 1.00 . A A . 3 GLU CD 1 1
5 1309 1 1 3 GLU CG C 3.974 -2.309 -3.345 1.00 . A A . 3 GLU CG 1 1
5 1310 1 1 3 GLU H H 2.540 1.309 -4.227 1.00 . A A . 3 GLU H 1 1
5 1311 1 1 3 GLU HA H 2.853 -0.301 -2.007 1.00 . A A . 3 GLU HA 1 1
5 1312 1 1 3 GLU HB2 H 2.887 -0.909 -4.516 1.00 . A A . 3 GLU HB2 1 1
5 1313 1 1 3 GLU HB3 H 4.614 -0.598 -4.427 1.00 . A A . 3 GLU HB3 1 1
5 1314 1 1 3 GLU HG2 H 4.456 -2.887 -4.118 1.00 . A A . 3 GLU HG2 1 1
5 1315 1 1 3 GLU HG3 H 4.613 -2.263 -2.477 1.00 . A A . 3 GLU HG3 1 1
5 1316 1 1 3 GLU N N 2.838 1.312 -3.293 1.00 . A A . 3 GLU N 1 1
5 1317 1 1 3 GLU O O 5.190 -0.039 -1.050 1.00 . A A . 3 GLU O 1 1
5 1318 1 1 3 GLU OE1 O 1.686 -2.301 -2.697 1.00 . A A . 3 GLU OE1 1 1
5 1319 1 1 3 GLU OE2 O 2.670 -4.252 -2.922 1.00 . A A . 3 GLU OE2 1 1
5 1320 1 1 4 PHE C C 6.607 2.689 -0.866 1.00 . A A . 4 PHE C 1 1
5 1321 1 1 4 PHE CA C 6.815 1.899 -2.152 1.00 . A A . 4 PHE CA 1 1
5 1322 1 1 4 PHE CB C 7.565 2.754 -3.176 1.00 . A A . 4 PHE CB 1 1
5 1323 1 1 4 PHE CD1 C 7.082 5.184 -2.777 1.00 . A A . 4 PHE CD1 1 1
5 1324 1 1 4 PHE CD2 C 6.001 4.100 -4.605 1.00 . A A . 4 PHE CD2 1 1
5 1325 1 1 4 PHE CE1 C 6.446 6.368 -3.098 1.00 . A A . 4 PHE CE1 1 1
5 1326 1 1 4 PHE CE2 C 5.362 5.281 -4.931 1.00 . A A . 4 PHE CE2 1 1
5 1327 1 1 4 PHE CG C 6.866 4.037 -3.524 1.00 . A A . 4 PHE CG 1 1
5 1328 1 1 4 PHE CZ C 5.586 6.417 -4.177 1.00 . A A . 4 PHE CZ 1 1
5 1329 1 1 4 PHE H H 5.196 1.858 -3.515 1.00 . A A . 4 PHE H 1 1
5 1330 1 1 4 PHE HA H 7.403 1.023 -1.928 1.00 . A A . 4 PHE HA 1 1
5 1331 1 1 4 PHE HB2 H 8.538 3.003 -2.781 1.00 . A A . 4 PHE HB2 1 1
5 1332 1 1 4 PHE HB3 H 7.689 2.185 -4.087 1.00 . A A . 4 PHE HB3 1 1
5 1333 1 1 4 PHE HD1 H 7.753 5.147 -1.931 1.00 . A A . 4 PHE HD1 1 1
5 1334 1 1 4 PHE HD2 H 5.826 3.214 -5.194 1.00 . A A . 4 PHE HD2 1 1
5 1335 1 1 4 PHE HE1 H 6.622 7.254 -2.506 1.00 . A A . 4 PHE HE1 1 1
5 1336 1 1 4 PHE HE2 H 4.690 5.317 -5.775 1.00 . A A . 4 PHE HE2 1 1
5 1337 1 1 4 PHE HZ H 5.087 7.340 -4.431 1.00 . A A . 4 PHE HZ 1 1
5 1338 1 1 4 PHE N N 5.539 1.451 -2.694 1.00 . A A . 4 PHE N 1 1
5 1339 1 1 4 PHE O O 7.436 2.646 0.042 1.00 . A A . 4 PHE O 1 1
5 1340 1 1 5 ARG C C 4.683 3.311 1.520 1.00 . A A . 5 ARG C 1 1
5 1341 1 1 5 ARG CA C 5.171 4.203 0.384 1.00 . A A . 5 ARG CA 1 1
5 1342 1 1 5 ARG CB C 4.109 5.248 0.043 1.00 . A A . 5 ARG CB 1 1
5 1343 1 1 5 ARG CD C 4.934 7.494 0.814 1.00 . A A . 5 ARG CD 1 1
5 1344 1 1 5 ARG CG C 3.979 6.342 1.088 1.00 . A A . 5 ARG CG 1 1
5 1345 1 1 5 ARG CZ C 4.448 9.021 2.688 1.00 . A A . 5 ARG CZ 1 1
5 1346 1 1 5 ARG H H 4.864 3.397 -1.546 1.00 . A A . 5 ARG H 1 1
5 1347 1 1 5 ARG HA H 6.072 4.705 0.699 1.00 . A A . 5 ARG HA 1 1
5 1348 1 1 5 ARG HB2 H 4.363 5.708 -0.900 1.00 . A A . 5 ARG HB2 1 1
5 1349 1 1 5 ARG HB3 H 3.153 4.755 -0.051 1.00 . A A . 5 ARG HB3 1 1
5 1350 1 1 5 ARG HD2 H 5.895 7.257 1.247 1.00 . A A . 5 ARG HD2 1 1
5 1351 1 1 5 ARG HD3 H 5.040 7.609 -0.253 1.00 . A A . 5 ARG HD3 1 1
5 1352 1 1 5 ARG HE H 4.113 9.428 0.762 1.00 . A A . 5 ARG HE 1 1
5 1353 1 1 5 ARG HG2 H 2.968 6.718 1.077 1.00 . A A . 5 ARG HG2 1 1
5 1354 1 1 5 ARG HG3 H 4.200 5.925 2.060 1.00 . A A . 5 ARG HG3 1 1
5 1355 1 1 5 ARG HH11 H 5.247 7.246 3.240 1.00 . A A . 5 ARG HH11 1 1
5 1356 1 1 5 ARG HH12 H 4.895 8.338 4.537 1.00 . A A . 5 ARG HH12 1 1
5 1357 1 1 5 ARG HH21 H 3.650 10.864 2.466 1.00 . A A . 5 ARG HH21 1 1
5 1358 1 1 5 ARG HH22 H 3.986 10.393 4.098 1.00 . A A . 5 ARG HH22 1 1
5 1359 1 1 5 ARG N N 5.490 3.407 -0.793 1.00 . A A . 5 ARG N 1 1
5 1360 1 1 5 ARG NE N 4.452 8.749 1.384 1.00 . A A . 5 ARG NE 1 1
5 1361 1 1 5 ARG NH1 N 4.901 8.128 3.560 1.00 . A A . 5 ARG NH1 1 1
5 1362 1 1 5 ARG NH2 N 3.991 10.187 3.120 1.00 . A A . 5 ARG NH2 1 1
5 1363 1 1 5 ARG O O 5.051 3.505 2.679 1.00 . A A . 5 ARG O 1 1
5 1364 1 1 6 HIS C C 4.417 0.477 2.679 1.00 . A A . 6 HIS C 1 1
5 1365 1 1 6 HIS CA C 3.320 1.399 2.166 1.00 . A A . 6 HIS CA 1 1
5 1366 1 1 6 HIS CB C 2.202 0.554 1.557 1.00 . A A . 6 HIS CB 1 1
5 1367 1 1 6 HIS CD2 C 0.697 1.409 -0.356 1.00 . A A . 6 HIS CD2 1 1
5 1368 1 1 6 HIS CE1 C -0.566 2.764 0.757 1.00 . A A . 6 HIS CE1 1 1
5 1369 1 1 6 HIS CG C 1.108 1.356 0.935 1.00 . A A . 6 HIS CG 1 1
5 1370 1 1 6 HIS H H 3.606 2.223 0.234 1.00 . A A . 6 HIS H 1 1
5 1371 1 1 6 HIS HA H 2.927 1.973 2.991 1.00 . A A . 6 HIS HA 1 1
5 1372 1 1 6 HIS HB2 H 2.621 -0.080 0.790 1.00 . A A . 6 HIS HB2 1 1
5 1373 1 1 6 HIS HB3 H 1.767 -0.063 2.330 1.00 . A A . 6 HIS HB3 1 1
5 1374 1 1 6 HIS HD1 H 0.337 2.411 2.591 1.00 . A A . 6 HIS HD1 1 1
5 1375 1 1 6 HIS HD2 H 1.118 0.845 -1.176 1.00 . A A . 6 HIS HD2 1 1
5 1376 1 1 6 HIS HE1 H -1.329 3.482 1.018 1.00 . A A . 6 HIS HE1 1 1
5 1377 1 1 6 HIS N N 3.856 2.327 1.177 1.00 . A A . 6 HIS N 1 1
5 1378 1 1 6 HIS ND1 N 0.295 2.223 1.629 1.00 . A A . 6 HIS ND1 1 1
5 1379 1 1 6 HIS NE2 N -0.363 2.304 -0.461 1.00 . A A . 6 HIS NE2 1 1
5 1380 1 1 6 HIS O O 4.557 0.260 3.883 1.00 . A A . 6 HIS O 1 1
5 1381 1 1 7 HIS C C 7.568 -0.216 2.322 1.00 . A A . 7 HIS C 1 1
5 1382 1 1 7 HIS CA C 6.270 -0.979 2.079 1.00 . A A . 7 HIS CA 1 1
5 1383 1 1 7 HIS CB C 6.461 -1.996 0.955 1.00 . A A . 7 HIS CB 1 1
5 1384 1 1 7 HIS CD2 C 4.138 -2.592 -0.041 1.00 . A A . 7 HIS CD2 1 1
5 1385 1 1 7 HIS CE1 C 3.907 -4.580 0.774 1.00 . A A . 7 HIS CE1 1 1
5 1386 1 1 7 HIS CG C 5.251 -2.844 0.701 1.00 . A A . 7 HIS CG 1 1
5 1387 1 1 7 HIS H H 5.014 0.144 0.805 1.00 . A A . 7 HIS H 1 1
5 1388 1 1 7 HIS HA H 5.999 -1.502 2.983 1.00 . A A . 7 HIS HA 1 1
5 1389 1 1 7 HIS HB2 H 6.696 -1.473 0.040 1.00 . A A . 7 HIS HB2 1 1
5 1390 1 1 7 HIS HB3 H 7.280 -2.653 1.208 1.00 . A A . 7 HIS HB3 1 1
5 1391 1 1 7 HIS HD1 H 5.713 -4.587 1.794 1.00 . A A . 7 HIS HD1 1 1
5 1392 1 1 7 HIS HD2 H 3.918 -1.674 -0.569 1.00 . A A . 7 HIS HD2 1 1
5 1393 1 1 7 HIS HE1 H 3.504 -5.550 1.023 1.00 . A A . 7 HIS HE1 1 1
5 1394 1 1 7 HIS N N 5.186 -0.067 1.746 1.00 . A A . 7 HIS N 1 1
5 1395 1 1 7 HIS ND1 N 5.083 -4.112 1.213 1.00 . A A . 7 HIS ND1 1 1
5 1396 1 1 7 HIS NE2 N 3.299 -3.697 0.009 1.00 . A A . 7 HIS NE2 1 1
5 1397 1 1 7 HIS O O 7.866 0.760 1.634 1.00 . A A . 7 HIS O 1 1
5 1398 1 1 8 SER C C 10.769 -0.751 2.969 1.00 . A A . 8 SER C 1 1
5 1399 1 1 8 SER CA C 9.604 -0.034 3.644 1.00 . A A . 8 SER CA 1 1
5 1400 1 1 8 SER CB C 9.804 -0.026 5.160 1.00 . A A . 8 SER CB 1 1
5 1401 1 1 8 SER H H 8.042 -1.452 3.817 1.00 . A A . 8 SER H 1 1
5 1402 1 1 8 SER HA H 9.569 0.985 3.289 1.00 . A A . 8 SER HA 1 1
5 1403 1 1 8 SER HB2 H 9.346 -0.905 5.587 1.00 . A A . 8 SER HB2 1 1
5 1404 1 1 8 SER HB3 H 10.862 -0.027 5.381 1.00 . A A . 8 SER HB3 1 1
5 1405 1 1 8 SER HG H 9.533 1.910 5.296 1.00 . A A . 8 SER HG 1 1
5 1406 1 1 8 SER N N 8.335 -0.670 3.306 1.00 . A A . 8 SER N 1 1
5 1407 1 1 8 SER O O 10.926 -1.965 3.103 1.00 . A A . 8 SER O 1 1
5 1408 1 1 8 SER OG O 9.217 1.124 5.746 1.00 . A A . 8 SER OG 1 1
5 1409 1 1 9 GLY C C 12.708 -0.297 0.070 1.00 . A A . 9 GLY C 1 1
5 1410 1 1 9 GLY CA C 12.726 -0.571 1.561 1.00 . A A . 9 GLY CA 1 1
5 1411 1 1 9 GLY H H 11.410 0.970 2.176 1.00 . A A . 9 GLY H 1 1
5 1412 1 1 9 GLY HA2 H 13.631 -0.157 1.982 1.00 . A A . 9 GLY HA2 1 1
5 1413 1 1 9 GLY HA3 H 12.723 -1.639 1.720 1.00 . A A . 9 GLY HA3 1 1
5 1414 1 1 9 GLY N N 11.584 0.008 2.245 1.00 . A A . 9 GLY N 1 1
5 1415 1 1 9 GLY O O 12.873 0.844 -0.361 1.00 . A A . 9 GLY O 1 1
5 1416 1 1 10 TYR C C 11.053 -1.402 -2.699 1.00 . A A . 10 TYR C 1 1
5 1417 1 1 10 TYR CA C 12.473 -1.216 -2.172 1.00 . A A . 10 TYR CA 1 1
5 1418 1 1 10 TYR CB C 13.408 -2.239 -2.819 1.00 . A A . 10 TYR CB 1 1
5 1419 1 1 10 TYR CD1 C 15.248 -2.399 -1.098 1.00 . A A . 10 TYR CD1 1 1
5 1420 1 1 10 TYR CD2 C 15.818 -1.652 -3.289 1.00 . A A . 10 TYR CD2 1 1
5 1421 1 1 10 TYR CE1 C 16.567 -2.267 -0.705 1.00 . A A . 10 TYR CE1 1 1
5 1422 1 1 10 TYR CE2 C 17.139 -1.517 -2.903 1.00 . A A . 10 TYR CE2 1 1
5 1423 1 1 10 TYR CG C 14.851 -2.094 -2.394 1.00 . A A . 10 TYR CG 1 1
5 1424 1 1 10 TYR CZ C 17.508 -1.826 -1.611 1.00 . A A . 10 TYR CZ 1 1
5 1425 1 1 10 TYR H H 12.385 -2.232 -0.316 1.00 . A A . 10 TYR H 1 1
5 1426 1 1 10 TYR HA H 12.811 -0.223 -2.424 1.00 . A A . 10 TYR HA 1 1
5 1427 1 1 10 TYR HB2 H 13.082 -3.234 -2.552 1.00 . A A . 10 TYR HB2 1 1
5 1428 1 1 10 TYR HB3 H 13.364 -2.128 -3.893 1.00 . A A . 10 TYR HB3 1 1
5 1429 1 1 10 TYR HD1 H 14.509 -2.744 -0.391 1.00 . A A . 10 TYR HD1 1 1
5 1430 1 1 10 TYR HD2 H 15.527 -1.411 -4.300 1.00 . A A . 10 TYR HD2 1 1
5 1431 1 1 10 TYR HE1 H 16.855 -2.509 0.308 1.00 . A A . 10 TYR HE1 1 1
5 1432 1 1 10 TYR HE2 H 17.876 -1.173 -3.613 1.00 . A A . 10 TYR HE2 1 1
5 1433 1 1 10 TYR HH H 18.940 -0.855 -0.772 1.00 . A A . 10 TYR HH 1 1
5 1434 1 1 10 TYR N N 12.509 -1.348 -0.720 1.00 . A A . 10 TYR N 1 1
5 1435 1 1 10 TYR O O 10.900 -1.623 -3.918 1.00 . A A . 10 TYR O 1 1
5 1436 1 1 10 TYR OH O 18.821 -1.695 -1.224 1.00 . A A . 10 TYR OH 1 1
5 1437 1 1 11 NH2 HN1 H 10.229 -1.138 -0.858 1.00 . A A . 11 NH2 HN1 1 1
5 1438 1 1 11 NH2 HN2 H 9.093 -1.438 -2.154 1.00 . A A . 11 NH2 HN2 1 1
5 1439 1 1 11 NH2 N N 10.044 -1.319 -1.834 1.00 . A A . 11 NH2 N 1 1
5 1440 2 1 1 ASP C C -0.403 -5.604 -0.655 1.00 . B B . 1 ASP C 1 1
5 1441 2 1 1 ASP CA C -0.533 -6.442 0.613 1.00 . B B . 1 ASP CA 1 1
5 1442 2 1 1 ASP CB C -0.835 -5.536 1.808 1.00 . B B . 1 ASP CB 1 1
5 1443 2 1 1 ASP CG C -1.189 -6.323 3.056 1.00 . B B . 1 ASP CG 1 1
5 1444 2 1 1 ASP H1 H 0.685 -7.511 1.880 1.00 . B B . 1 ASP H1 1 1
5 1445 2 1 1 ASP H2 H 1.518 -6.543 0.735 1.00 . B B . 1 ASP H2 1 1
5 1446 2 1 1 ASP H3 H 0.758 -7.998 0.237 1.00 . B B . 1 ASP H3 1 1
5 1447 2 1 1 ASP HA H -1.339 -7.149 0.488 1.00 . B B . 1 ASP HA 1 1
5 1448 2 1 1 ASP HB2 H 0.031 -4.929 2.022 1.00 . B B . 1 ASP HB2 1 1
5 1449 2 1 1 ASP HB3 H -1.669 -4.890 1.563 1.00 . B B . 1 ASP HB3 1 1
5 1450 2 1 1 ASP N N 0.720 -7.191 0.892 1.00 . B B . 1 ASP N 1 1
5 1451 2 1 1 ASP O O 0.702 -5.275 -1.083 1.00 . B B . 1 ASP O 1 1
5 1452 2 1 1 ASP OD1 O -1.568 -7.505 2.923 1.00 . B B . 1 ASP OD1 1 1
5 1453 2 1 1 ASP OD2 O -1.087 -5.756 4.164 1.00 . B B . 1 ASP OD2 1 1
5 1454 2 1 2 ALA C C -2.320 -3.158 -2.241 1.00 . B B . 2 ALA C 1 1
5 1455 2 1 2 ALA CA C -1.557 -4.458 -2.463 1.00 . B B . 2 ALA CA 1 1
5 1456 2 1 2 ALA CB C -2.169 -5.247 -3.611 1.00 . B B . 2 ALA CB 1 1
5 1457 2 1 2 ALA H H -2.390 -5.552 -0.858 1.00 . B B . 2 ALA H 1 1
5 1458 2 1 2 ALA HA H -0.532 -4.222 -2.724 1.00 . B B . 2 ALA HA 1 1
5 1459 2 1 2 ALA HB1 H -3.111 -4.800 -3.894 1.00 . B B . 2 ALA HB1 1 1
5 1460 2 1 2 ALA HB2 H -2.334 -6.267 -3.298 1.00 . B B . 2 ALA HB2 1 1
5 1461 2 1 2 ALA HB3 H -1.497 -5.234 -4.456 1.00 . B B . 2 ALA HB3 1 1
5 1462 2 1 2 ALA N N -1.541 -5.262 -1.248 1.00 . B B . 2 ALA N 1 1
5 1463 2 1 2 ALA O O -2.879 -2.930 -1.169 1.00 . B B . 2 ALA O 1 1
5 1464 2 1 3 GLU C C -4.465 -1.203 -2.699 1.00 . B B . 3 GLU C 1 1
5 1465 2 1 3 GLU CA C -3.029 -1.026 -3.179 1.00 . B B . 3 GLU CA 1 1
5 1466 2 1 3 GLU CB C -3.019 -0.332 -4.542 1.00 . B B . 3 GLU CB 1 1
5 1467 2 1 3 GLU CD C -2.025 1.908 -3.944 1.00 . B B . 3 GLU CD 1 1
5 1468 2 1 3 GLU CG C -3.244 1.169 -4.460 1.00 . B B . 3 GLU CG 1 1
5 1469 2 1 3 GLU H H -1.872 -2.547 -4.089 1.00 . B B . 3 GLU H 1 1
5 1470 2 1 3 GLU HA H -2.498 -0.408 -2.470 1.00 . B B . 3 GLU HA 1 1
5 1471 2 1 3 GLU HB2 H -2.066 -0.507 -5.015 1.00 . B B . 3 GLU HB2 1 1
5 1472 2 1 3 GLU HB3 H -3.801 -0.757 -5.154 1.00 . B B . 3 GLU HB3 1 1
5 1473 2 1 3 GLU HG2 H -3.479 1.539 -5.447 1.00 . B B . 3 GLU HG2 1 1
5 1474 2 1 3 GLU HG3 H -4.073 1.361 -3.796 1.00 . B B . 3 GLU HG3 1 1
5 1475 2 1 3 GLU N N -2.338 -2.307 -3.261 1.00 . B B . 3 GLU N 1 1
5 1476 2 1 3 GLU O O -4.989 -0.375 -1.953 1.00 . B B . 3 GLU O 1 1
5 1477 2 1 3 GLU OE1 O -1.209 1.280 -3.238 1.00 . B B . 3 GLU OE1 1 1
5 1478 2 1 3 GLU OE2 O -1.884 3.109 -4.253 1.00 . B B . 3 GLU OE2 1 1
5 1479 2 1 4 PHE C C -6.547 -2.939 -1.255 1.00 . B B . 4 PHE C 1 1
5 1480 2 1 4 PHE CA C -6.474 -2.568 -2.731 1.00 . B B . 4 PHE CA 1 1
5 1481 2 1 4 PHE CB C -7.060 -3.693 -3.586 1.00 . B B . 4 PHE CB 1 1
5 1482 2 1 4 PHE CD1 C -6.543 -5.804 -2.330 1.00 . B B . 4 PHE CD1 1 1
5 1483 2 1 4 PHE CD2 C -5.450 -5.430 -4.417 1.00 . B B . 4 PHE CD2 1 1
5 1484 2 1 4 PHE CE1 C -5.882 -7.009 -2.195 1.00 . B B . 4 PHE CE1 1 1
5 1485 2 1 4 PHE CE2 C -4.785 -6.634 -4.287 1.00 . B B . 4 PHE CE2 1 1
5 1486 2 1 4 PHE CG C -6.335 -5.002 -3.440 1.00 . B B . 4 PHE CG 1 1
5 1487 2 1 4 PHE CZ C -5.001 -7.425 -3.176 1.00 . B B . 4 PHE CZ 1 1
5 1488 2 1 4 PHE H H -4.632 -2.915 -3.714 1.00 . B B . 4 PHE H 1 1
5 1489 2 1 4 PHE HA H -7.050 -1.668 -2.890 1.00 . B B . 4 PHE HA 1 1
5 1490 2 1 4 PHE HB2 H -8.089 -3.852 -3.302 1.00 . B B . 4 PHE HB2 1 1
5 1491 2 1 4 PHE HB3 H -7.019 -3.404 -4.625 1.00 . B B . 4 PHE HB3 1 1
5 1492 2 1 4 PHE HD1 H -7.231 -5.479 -1.563 1.00 . B B . 4 PHE HD1 1 1
5 1493 2 1 4 PHE HD2 H -5.281 -4.813 -5.286 1.00 . B B . 4 PHE HD2 1 1
5 1494 2 1 4 PHE HE1 H -6.051 -7.625 -1.326 1.00 . B B . 4 PHE HE1 1 1
5 1495 2 1 4 PHE HE2 H -4.098 -6.957 -5.055 1.00 . B B . 4 PHE HE2 1 1
5 1496 2 1 4 PHE HZ H -4.483 -8.367 -3.073 1.00 . B B . 4 PHE HZ 1 1
5 1497 2 1 4 PHE N N -5.099 -2.288 -3.125 1.00 . B B . 4 PHE N 1 1
5 1498 2 1 4 PHE O O -7.536 -2.658 -0.581 1.00 . B B . 4 PHE O 1 1
5 1499 2 1 5 ARG C C -5.071 -2.804 1.536 1.00 . B B . 5 ARG C 1 1
5 1500 2 1 5 ARG CA C -5.432 -3.982 0.639 1.00 . B B . 5 ARG CA 1 1
5 1501 2 1 5 ARG CB C -4.413 -5.108 0.818 1.00 . B B . 5 ARG CB 1 1
5 1502 2 1 5 ARG CD C -5.642 -6.473 2.531 1.00 . B B . 5 ARG CD 1 1
5 1503 2 1 5 ARG CG C -4.381 -5.682 2.223 1.00 . B B . 5 ARG CG 1 1
5 1504 2 1 5 ARG CZ C -6.200 -8.442 3.907 1.00 . B B . 5 ARG CZ 1 1
5 1505 2 1 5 ARG H H -4.728 -3.768 -1.345 1.00 . B B . 5 ARG H 1 1
5 1506 2 1 5 ARG HA H -6.409 -4.345 0.918 1.00 . B B . 5 ARG HA 1 1
5 1507 2 1 5 ARG HB2 H -4.650 -5.906 0.130 1.00 . B B . 5 ARG HB2 1 1
5 1508 2 1 5 ARG HB3 H -3.430 -4.724 0.586 1.00 . B B . 5 ARG HB3 1 1
5 1509 2 1 5 ARG HD2 H -6.442 -5.781 2.748 1.00 . B B . 5 ARG HD2 1 1
5 1510 2 1 5 ARG HD3 H -5.900 -7.066 1.667 1.00 . B B . 5 ARG HD3 1 1
5 1511 2 1 5 ARG HE H -4.745 -7.138 4.312 1.00 . B B . 5 ARG HE 1 1
5 1512 2 1 5 ARG HG2 H -3.529 -6.336 2.312 1.00 . B B . 5 ARG HG2 1 1
5 1513 2 1 5 ARG HG3 H -4.292 -4.871 2.930 1.00 . B B . 5 ARG HG3 1 1
5 1514 2 1 5 ARG HH11 H -7.376 -8.201 2.279 1.00 . B B . 5 ARG HH11 1 1
5 1515 2 1 5 ARG HH12 H -7.735 -9.585 3.256 1.00 . B B . 5 ARG HH12 1 1
5 1516 2 1 5 ARG HH21 H -5.215 -8.959 5.594 1.00 . B B . 5 ARG HH21 1 1
5 1517 2 1 5 ARG HH22 H -6.509 -10.016 5.137 1.00 . B B . 5 ARG HH22 1 1
5 1518 2 1 5 ARG N N -5.489 -3.574 -0.758 1.00 . B B . 5 ARG N 1 1
5 1519 2 1 5 ARG NE N -5.460 -7.360 3.679 1.00 . B B . 5 ARG NE 1 1
5 1520 2 1 5 ARG NH1 N -7.184 -8.769 3.078 1.00 . B B . 5 ARG NH1 1 1
5 1521 2 1 5 ARG NH2 N -5.955 -9.201 4.966 1.00 . B B . 5 ARG NH2 1 1
5 1522 2 1 5 ARG O O -5.621 -2.649 2.626 1.00 . B B . 5 ARG O 1 1
5 1523 2 1 6 HIS C C -4.827 0.227 1.909 1.00 . B B . 6 HIS C 1 1
5 1524 2 1 6 HIS CA C -3.712 -0.806 1.830 1.00 . B B . 6 HIS CA 1 1
5 1525 2 1 6 HIS CB C -2.484 -0.165 1.184 1.00 . B B . 6 HIS CB 1 1
5 1526 2 1 6 HIS CD2 C -0.797 -1.496 -0.245 1.00 . B B . 6 HIS CD2 1 1
5 1527 2 1 6 HIS CE1 C 0.274 -2.532 1.321 1.00 . B B . 6 HIS CE1 1 1
5 1528 2 1 6 HIS CG C -1.358 -1.116 0.928 1.00 . B B . 6 HIS CG 1 1
5 1529 2 1 6 HIS H H -3.744 -2.149 0.190 1.00 . B B . 6 HIS H 1 1
5 1530 2 1 6 HIS HA H -3.460 -1.131 2.828 1.00 . B B . 6 HIS HA 1 1
5 1531 2 1 6 HIS HB2 H -2.772 0.264 0.236 1.00 . B B . 6 HIS HB2 1 1
5 1532 2 1 6 HIS HB3 H -2.116 0.619 1.830 1.00 . B B . 6 HIS HB3 1 1
5 1533 2 1 6 HIS HD1 H -0.833 -1.722 2.878 1.00 . B B . 6 HIS HD1 1 1
5 1534 2 1 6 HIS HD2 H -1.095 -1.161 -1.228 1.00 . B B . 6 HIS HD2 1 1
5 1535 2 1 6 HIS HE1 H 0.977 -3.163 1.846 1.00 . B B . 6 HIS HE1 1 1
5 1536 2 1 6 HIS N N -4.144 -1.973 1.068 1.00 . B B . 6 HIS N 1 1
5 1537 2 1 6 HIS ND1 N -0.667 -1.783 1.916 1.00 . B B . 6 HIS ND1 1 1
5 1538 2 1 6 HIS NE2 N 0.235 -2.392 0.011 1.00 . B B . 6 HIS NE2 1 1
5 1539 2 1 6 HIS O O -5.036 0.860 2.945 1.00 . B B . 6 HIS O 1 1
5 1540 2 1 7 HIS C C -7.966 0.694 1.025 1.00 . B B . 7 HIS C 1 1
5 1541 2 1 7 HIS CA C -6.626 1.358 0.723 1.00 . B B . 7 HIS CA 1 1
5 1542 2 1 7 HIS CB C -6.664 2.000 -0.664 1.00 . B B . 7 HIS CB 1 1
5 1543 2 1 7 HIS CD2 C -4.151 2.308 -1.228 1.00 . B B . 7 HIS CD2 1 1
5 1544 2 1 7 HIS CE1 C -4.108 4.454 -1.485 1.00 . B B . 7 HIS CE1 1 1
5 1545 2 1 7 HIS CG C -5.416 2.754 -1.010 1.00 . B B . 7 HIS CG 1 1
5 1546 2 1 7 HIS H H -5.313 -0.136 0.008 1.00 . B B . 7 HIS H 1 1
5 1547 2 1 7 HIS HA H -6.445 2.125 1.461 1.00 . B B . 7 HIS HA 1 1
5 1548 2 1 7 HIS HB2 H -6.801 1.229 -1.406 1.00 . B B . 7 HIS HB2 1 1
5 1549 2 1 7 HIS HB3 H -7.494 2.689 -0.711 1.00 . B B . 7 HIS HB3 1 1
5 1550 2 1 7 HIS HD1 H -6.123 4.739 -1.087 1.00 . B B . 7 HIS HD1 1 1
5 1551 2 1 7 HIS HD2 H -3.820 1.279 -1.175 1.00 . B B . 7 HIS HD2 1 1
5 1552 2 1 7 HIS HE1 H -3.773 5.463 -1.673 1.00 . B B . 7 HIS HE1 1 1
5 1553 2 1 7 HIS N N -5.536 0.396 0.800 1.00 . B B . 7 HIS N 1 1
5 1554 2 1 7 HIS ND1 N -5.369 4.120 -1.177 1.00 . B B . 7 HIS ND1 1 1
5 1555 2 1 7 HIS NE2 N -3.330 3.390 -1.528 1.00 . B B . 7 HIS NE2 1 1
5 1556 2 1 7 HIS O O -8.228 -0.426 0.588 1.00 . B B . 7 HIS O 1 1
5 1557 2 1 8 SER C C -11.214 1.900 1.808 1.00 . B B . 8 SER C 1 1
5 1558 2 1 8 SER CA C -10.127 0.880 2.130 1.00 . B B . 8 SER CA 1 1
5 1559 2 1 8 SER CB C -10.171 0.523 3.617 1.00 . B B . 8 SER CB 1 1
5 1560 2 1 8 SER H H -8.545 2.286 2.086 1.00 . B B . 8 SER H 1 1
5 1561 2 1 8 SER HA H -10.303 -0.013 1.548 1.00 . B B . 8 SER HA 1 1
5 1562 2 1 8 SER HB2 H -9.240 0.055 3.901 1.00 . B B . 8 SER HB2 1 1
5 1563 2 1 8 SER HB3 H -10.312 1.424 4.197 1.00 . B B . 8 SER HB3 1 1
5 1564 2 1 8 SER HG H -12.025 -0.081 3.436 1.00 . B B . 8 SER HG 1 1
5 1565 2 1 8 SER N N -8.812 1.397 1.771 1.00 . B B . 8 SER N 1 1
5 1566 2 1 8 SER O O -11.205 3.016 2.324 1.00 . B B . 8 SER O 1 1
5 1567 2 1 8 SER OG O -11.234 -0.371 3.896 1.00 . B B . 8 SER OG 1 1
5 1568 2 1 9 GLY C C -13.770 2.111 -0.812 1.00 . B B . 9 GLY C 1 1
5 1569 2 1 9 GLY CA C -13.232 2.401 0.575 1.00 . B B . 9 GLY CA 1 1
5 1570 2 1 9 GLY H H -12.110 0.606 0.570 1.00 . B B . 9 GLY H 1 1
5 1571 2 1 9 GLY HA2 H -14.035 2.297 1.289 1.00 . B B . 9 GLY HA2 1 1
5 1572 2 1 9 GLY HA3 H -12.870 3.417 0.604 1.00 . B B . 9 GLY HA3 1 1
5 1573 2 1 9 GLY N N -12.152 1.508 0.951 1.00 . B B . 9 GLY N 1 1
5 1574 2 1 9 GLY O O -13.363 1.142 -1.453 1.00 . B B . 9 GLY O 1 1
5 1575 2 1 10 TYR C C -14.234 2.980 -3.694 1.00 . B B . 10 TYR C 1 1
5 1576 2 1 10 TYR CA C -15.278 2.785 -2.599 1.00 . B B . 10 TYR CA 1 1
5 1577 2 1 10 TYR CB C -16.430 3.774 -2.795 1.00 . B B . 10 TYR CB 1 1
5 1578 2 1 10 TYR CD1 C -16.074 5.844 -1.393 1.00 . B B . 10 TYR CD1 1 1
5 1579 2 1 10 TYR CD2 C -15.578 5.962 -3.722 1.00 . B B . 10 TYR CD2 1 1
5 1580 2 1 10 TYR CE1 C -15.701 7.165 -1.242 1.00 . B B . 10 TYR CE1 1 1
5 1581 2 1 10 TYR CE2 C -15.202 7.285 -3.579 1.00 . B B . 10 TYR CE2 1 1
5 1582 2 1 10 TYR CG C -16.019 5.221 -2.634 1.00 . B B . 10 TYR CG 1 1
5 1583 2 1 10 TYR CZ C -15.265 7.881 -2.338 1.00 . B B . 10 TYR CZ 1 1
5 1584 2 1 10 TYR H H -14.968 3.709 -0.721 1.00 . B B . 10 TYR H 1 1
5 1585 2 1 10 TYR HA H -15.665 1.779 -2.662 1.00 . B B . 10 TYR HA 1 1
5 1586 2 1 10 TYR HB2 H -16.835 3.652 -3.788 1.00 . B B . 10 TYR HB2 1 1
5 1587 2 1 10 TYR HB3 H -17.202 3.563 -2.069 1.00 . B B . 10 TYR HB3 1 1
5 1588 2 1 10 TYR HD1 H -16.416 5.280 -0.537 1.00 . B B . 10 TYR HD1 1 1
5 1589 2 1 10 TYR HD2 H -15.529 5.492 -4.693 1.00 . B B . 10 TYR HD2 1 1
5 1590 2 1 10 TYR HE1 H -15.751 7.632 -0.269 1.00 . B B . 10 TYR HE1 1 1
5 1591 2 1 10 TYR HE2 H -14.862 7.845 -4.436 1.00 . B B . 10 TYR HE2 1 1
5 1592 2 1 10 TYR HH H -15.669 9.731 -2.003 1.00 . B B . 10 TYR HH 1 1
5 1593 2 1 10 TYR N N -14.684 2.953 -1.278 1.00 . B B . 10 TYR N 1 1
5 1594 2 1 10 TYR O O -14.627 3.046 -4.878 1.00 . B B . 10 TYR O 1 1
5 1595 2 1 10 TYR OH O -14.893 9.197 -2.190 1.00 . B B . 10 TYR OH 1 1
5 1596 2 1 11 NH2 HN1 H -12.697 3.006 -2.362 1.00 . B B . 11 NH2 HN1 1 1
5 1597 2 1 11 NH2 HN2 H -12.241 3.196 -4.040 1.00 . B B . 11 NH2 HN2 1 1
5 1598 2 1 11 NH2 N N -12.955 3.068 -3.337 1.00 . B B . 11 NH2 N 1 1
5 1599 3 2 1 ZN ZN ZN 1.612 -3.450 -1.103 1.00 . C A . 101 ZN ZN 1 1
5 1600 4 2 1 ZN ZN ZN -1.450 2.879 -2.122 1.00 . D A . 102 ZN ZN 1 1
6 1601 1 1 1 ASP C C 0.496 5.383 -1.641 1.00 . A A . 1 ASP C 1 1
6 1602 1 1 1 ASP CA C 0.421 6.455 -0.558 1.00 . A A . 1 ASP CA 1 1
6 1603 1 1 1 ASP CB C 0.845 5.878 0.796 1.00 . A A . 1 ASP CB 1 1
6 1604 1 1 1 ASP CG C 1.049 6.956 1.843 1.00 . A A . 1 ASP CG 1 1
6 1605 1 1 1 ASP H1 H -0.908 7.876 0.111 1.00 . A A . 1 ASP H1 1 1
6 1606 1 1 1 ASP H2 H -1.530 6.277 0.071 1.00 . A A . 1 ASP H2 1 1
6 1607 1 1 1 ASP H3 H -1.324 7.158 -1.388 1.00 . A A . 1 ASP H3 1 1
6 1608 1 1 1 ASP HA H 1.082 7.269 -0.820 1.00 . A A . 1 ASP HA 1 1
6 1609 1 1 1 ASP HB2 H 0.081 5.202 1.147 1.00 . A A . 1 ASP HB2 1 1
6 1610 1 1 1 ASP HB3 H 1.772 5.335 0.677 1.00 . A A . 1 ASP HB3 1 1
6 1611 1 1 1 ASP N N -0.959 6.990 -0.429 1.00 . A A . 1 ASP N 1 1
6 1612 1 1 1 ASP O O -0.528 4.964 -2.184 1.00 . A A . 1 ASP O 1 1
6 1613 1 1 1 ASP OD1 O 1.233 8.129 1.460 1.00 . A A . 1 ASP OD1 1 1
6 1614 1 1 1 ASP OD2 O 1.023 6.624 3.047 1.00 . A A . 1 ASP OD2 1 1
6 1615 1 1 2 ALA C C 2.594 2.687 -2.390 1.00 . A A . 2 ALA C 1 1
6 1616 1 1 2 ALA CA C 1.924 3.927 -2.976 1.00 . A A . 2 ALA CA 1 1
6 1617 1 1 2 ALA CB C 2.755 4.491 -4.119 1.00 . A A . 2 ALA CB 1 1
6 1618 1 1 2 ALA H H 2.490 5.322 -1.490 1.00 . A A . 2 ALA H 1 1
6 1619 1 1 2 ALA HA H 0.957 3.646 -3.370 1.00 . A A . 2 ALA HA 1 1
6 1620 1 1 2 ALA HB1 H 3.619 3.865 -4.281 1.00 . A A . 2 ALA HB1 1 1
6 1621 1 1 2 ALA HB2 H 3.078 5.491 -3.869 1.00 . A A . 2 ALA HB2 1 1
6 1622 1 1 2 ALA HB3 H 2.157 4.520 -5.018 1.00 . A A . 2 ALA HB3 1 1
6 1623 1 1 2 ALA N N 1.714 4.947 -1.955 1.00 . A A . 2 ALA N 1 1
6 1624 1 1 2 ALA O O 2.956 2.662 -1.215 1.00 . A A . 2 ALA O 1 1
6 1625 1 1 3 GLU C C 4.735 0.649 -2.162 1.00 . A A . 3 GLU C 1 1
6 1626 1 1 3 GLU CA C 3.371 0.409 -2.799 1.00 . A A . 3 GLU CA 1 1
6 1627 1 1 3 GLU CB C 3.512 -0.538 -3.991 1.00 . A A . 3 GLU CB 1 1
6 1628 1 1 3 GLU CD C 2.533 -2.679 -3.077 1.00 . A A . 3 GLU CD 1 1
6 1629 1 1 3 GLU CG C 3.774 -1.983 -3.596 1.00 . A A . 3 GLU CG 1 1
6 1630 1 1 3 GLU H H 2.437 1.749 -4.146 1.00 . A A . 3 GLU H 1 1
6 1631 1 1 3 GLU HA H 2.724 -0.048 -2.066 1.00 . A A . 3 GLU HA 1 1
6 1632 1 1 3 GLU HB2 H 2.603 -0.506 -4.572 1.00 . A A . 3 GLU HB2 1 1
6 1633 1 1 3 GLU HB3 H 4.333 -0.202 -4.606 1.00 . A A . 3 GLU HB3 1 1
6 1634 1 1 3 GLU HG2 H 4.131 -2.521 -4.462 1.00 . A A . 3 GLU HG2 1 1
6 1635 1 1 3 GLU HG3 H 4.529 -2.002 -2.826 1.00 . A A . 3 GLU HG3 1 1
6 1636 1 1 3 GLU N N 2.751 1.662 -3.221 1.00 . A A . 3 GLU N 1 1
6 1637 1 1 3 GLU O O 5.091 0.008 -1.174 1.00 . A A . 3 GLU O 1 1
6 1638 1 1 3 GLU OE1 O 1.702 -2.006 -2.433 1.00 . A A . 3 GLU OE1 1 1
6 1639 1 1 3 GLU OE2 O 2.386 -3.895 -3.321 1.00 . A A . 3 GLU OE2 1 1
6 1640 1 1 4 PHE C C 6.718 2.568 -0.851 1.00 . A A . 4 PHE C 1 1
6 1641 1 1 4 PHE CA C 6.823 1.883 -2.207 1.00 . A A . 4 PHE CA 1 1
6 1642 1 1 4 PHE CB C 7.594 2.772 -3.190 1.00 . A A . 4 PHE CB 1 1
6 1643 1 1 4 PHE CD1 C 7.653 5.187 -2.509 1.00 . A A . 4 PHE CD1 1 1
6 1644 1 1 4 PHE CD2 C 6.018 4.501 -4.106 1.00 . A A . 4 PHE CD2 1 1
6 1645 1 1 4 PHE CE1 C 7.184 6.484 -2.580 1.00 . A A . 4 PHE CE1 1 1
6 1646 1 1 4 PHE CE2 C 5.545 5.798 -4.181 1.00 . A A . 4 PHE CE2 1 1
6 1647 1 1 4 PHE CG C 7.077 4.182 -3.270 1.00 . A A . 4 PHE CG 1 1
6 1648 1 1 4 PHE CZ C 6.127 6.791 -3.417 1.00 . A A . 4 PHE CZ 1 1
6 1649 1 1 4 PHE H H 5.166 2.052 -3.513 1.00 . A A . 4 PHE H 1 1
6 1650 1 1 4 PHE HA H 7.356 0.951 -2.085 1.00 . A A . 4 PHE HA 1 1
6 1651 1 1 4 PHE HB2 H 8.628 2.816 -2.887 1.00 . A A . 4 PHE HB2 1 1
6 1652 1 1 4 PHE HB3 H 7.533 2.339 -4.178 1.00 . A A . 4 PHE HB3 1 1
6 1653 1 1 4 PHE HD1 H 8.478 4.949 -1.855 1.00 . A A . 4 PHE HD1 1 1
6 1654 1 1 4 PHE HD2 H 5.560 3.727 -4.701 1.00 . A A . 4 PHE HD2 1 1
6 1655 1 1 4 PHE HE1 H 7.641 7.258 -1.982 1.00 . A A . 4 PHE HE1 1 1
6 1656 1 1 4 PHE HE2 H 4.720 6.036 -4.836 1.00 . A A . 4 PHE HE2 1 1
6 1657 1 1 4 PHE HZ H 5.759 7.805 -3.474 1.00 . A A . 4 PHE HZ 1 1
6 1658 1 1 4 PHE N N 5.500 1.571 -2.730 1.00 . A A . 4 PHE N 1 1
6 1659 1 1 4 PHE O O 7.606 2.442 -0.007 1.00 . A A . 4 PHE O 1 1
6 1660 1 1 5 ARG C C 4.822 3.074 1.667 1.00 . A A . 5 ARG C 1 1
6 1661 1 1 5 ARG CA C 5.398 4.004 0.602 1.00 . A A . 5 ARG CA 1 1
6 1662 1 1 5 ARG CB C 4.457 5.185 0.373 1.00 . A A . 5 ARG CB 1 1
6 1663 1 1 5 ARG CD C 4.598 7.537 1.246 1.00 . A A . 5 ARG CD 1 1
6 1664 1 1 5 ARG CG C 4.306 6.086 1.589 1.00 . A A . 5 ARG CG 1 1
6 1665 1 1 5 ARG CZ C 6.627 8.362 0.099 1.00 . A A . 5 ARG CZ 1 1
6 1666 1 1 5 ARG H H 4.953 3.356 -1.361 1.00 . A A . 5 ARG H 1 1
6 1667 1 1 5 ARG HA H 6.350 4.376 0.948 1.00 . A A . 5 ARG HA 1 1
6 1668 1 1 5 ARG HB2 H 4.837 5.778 -0.445 1.00 . A A . 5 ARG HB2 1 1
6 1669 1 1 5 ARG HB3 H 3.483 4.805 0.109 1.00 . A A . 5 ARG HB3 1 1
6 1670 1 1 5 ARG HD2 H 4.132 7.771 0.303 1.00 . A A . 5 ARG HD2 1 1
6 1671 1 1 5 ARG HD3 H 4.180 8.167 2.018 1.00 . A A . 5 ARG HD3 1 1
6 1672 1 1 5 ARG HE H 6.592 7.525 1.910 1.00 . A A . 5 ARG HE 1 1
6 1673 1 1 5 ARG HG2 H 3.296 6.008 1.956 1.00 . A A . 5 ARG HG2 1 1
6 1674 1 1 5 ARG HG3 H 4.994 5.758 2.354 1.00 . A A . 5 ARG HG3 1 1
6 1675 1 1 5 ARG HH11 H 4.927 8.624 -0.967 1.00 . A A . 5 ARG HH11 1 1
6 1676 1 1 5 ARG HH12 H 6.375 9.174 -1.734 1.00 . A A . 5 ARG HH12 1 1
6 1677 1 1 5 ARG HH21 H 8.484 8.255 0.891 1.00 . A A . 5 ARG HH21 1 1
6 1678 1 1 5 ARG HH22 H 8.390 8.968 -0.685 1.00 . A A . 5 ARG HH22 1 1
6 1679 1 1 5 ARG N N 5.625 3.295 -0.648 1.00 . A A . 5 ARG N 1 1
6 1680 1 1 5 ARG NE N 6.036 7.795 1.151 1.00 . A A . 5 ARG NE 1 1
6 1681 1 1 5 ARG NH1 N 5.917 8.751 -0.953 1.00 . A A . 5 ARG NH1 1 1
6 1682 1 1 5 ARG NH2 N 7.941 8.544 0.101 1.00 . A A . 5 ARG NH2 1 1
6 1683 1 1 5 ARG O O 5.182 3.163 2.840 1.00 . A A . 5 ARG O 1 1
6 1684 1 1 6 HIS C C 4.347 0.281 2.738 1.00 . A A . 6 HIS C 1 1
6 1685 1 1 6 HIS CA C 3.307 1.239 2.178 1.00 . A A . 6 HIS CA 1 1
6 1686 1 1 6 HIS CB C 2.208 0.437 1.478 1.00 . A A . 6 HIS CB 1 1
6 1687 1 1 6 HIS CD2 C 0.772 1.273 -0.497 1.00 . A A . 6 HIS CD2 1 1
6 1688 1 1 6 HIS CE1 C -0.333 2.840 0.496 1.00 . A A . 6 HIS CE1 1 1
6 1689 1 1 6 HIS CG C 1.185 1.284 0.793 1.00 . A A . 6 HIS CG 1 1
6 1690 1 1 6 HIS H H 3.682 2.157 0.302 1.00 . A A . 6 HIS H 1 1
6 1691 1 1 6 HIS HA H 2.874 1.803 2.989 1.00 . A A . 6 HIS HA 1 1
6 1692 1 1 6 HIS HB2 H 2.659 -0.202 0.733 1.00 . A A . 6 HIS HB2 1 1
6 1693 1 1 6 HIS HB3 H 1.699 -0.174 2.208 1.00 . A A . 6 HIS HB3 1 1
6 1694 1 1 6 HIS HD1 H 0.542 2.548 2.354 1.00 . A A . 6 HIS HD1 1 1
6 1695 1 1 6 HIS HD2 H 1.120 0.600 -1.266 1.00 . A A . 6 HIS HD2 1 1
6 1696 1 1 6 HIS HE1 H -1.016 3.649 0.695 1.00 . A A . 6 HIS HE1 1 1
6 1697 1 1 6 HIS N N 3.928 2.182 1.251 1.00 . A A . 6 HIS N 1 1
6 1698 1 1 6 HIS ND1 N 0.473 2.286 1.412 1.00 . A A . 6 HIS ND1 1 1
6 1699 1 1 6 HIS NE2 N -0.185 2.262 -0.680 1.00 . A A . 6 HIS NE2 1 1
6 1700 1 1 6 HIS O O 4.330 -0.053 3.923 1.00 . A A . 6 HIS O 1 1
6 1701 1 1 7 HIS C C 7.606 -0.358 2.523 1.00 . A A . 7 HIS C 1 1
6 1702 1 1 7 HIS CA C 6.296 -1.092 2.260 1.00 . A A . 7 HIS CA 1 1
6 1703 1 1 7 HIS CB C 6.495 -2.143 1.170 1.00 . A A . 7 HIS CB 1 1
6 1704 1 1 7 HIS CD2 C 4.175 -2.616 0.116 1.00 . A A . 7 HIS CD2 1 1
6 1705 1 1 7 HIS CE1 C 3.842 -4.609 0.881 1.00 . A A . 7 HIS CE1 1 1
6 1706 1 1 7 HIS CG C 5.260 -2.935 0.869 1.00 . A A . 7 HIS CG 1 1
6 1707 1 1 7 HIS H H 5.198 0.139 0.939 1.00 . A A . 7 HIS H 1 1
6 1708 1 1 7 HIS HA H 5.983 -1.585 3.169 1.00 . A A . 7 HIS HA 1 1
6 1709 1 1 7 HIS HB2 H 6.803 -1.652 0.259 1.00 . A A . 7 HIS HB2 1 1
6 1710 1 1 7 HIS HB3 H 7.266 -2.832 1.480 1.00 . A A . 7 HIS HB3 1 1
6 1711 1 1 7 HIS HD1 H 5.627 -4.721 1.929 1.00 . A A . 7 HIS HD1 1 1
6 1712 1 1 7 HIS HD2 H 4.009 -1.680 -0.399 1.00 . A A . 7 HIS HD2 1 1
6 1713 1 1 7 HIS HE1 H 3.392 -5.567 1.101 1.00 . A A . 7 HIS HE1 1 1
6 1714 1 1 7 HIS N N 5.246 -0.163 1.870 1.00 . A A . 7 HIS N 1 1
6 1715 1 1 7 HIS ND1 N 5.028 -4.204 1.350 1.00 . A A . 7 HIS ND1 1 1
6 1716 1 1 7 HIS NE2 N 3.285 -3.684 0.126 1.00 . A A . 7 HIS NE2 1 1
6 1717 1 1 7 HIS O O 7.905 0.650 1.884 1.00 . A A . 7 HIS O 1 1
6 1718 1 1 8 SER C C 10.655 -1.339 4.278 1.00 . A A . 8 SER C 1 1
6 1719 1 1 8 SER CA C 9.666 -0.274 3.816 1.00 . A A . 8 SER CA 1 1
6 1720 1 1 8 SER CB C 9.479 0.780 4.911 1.00 . A A . 8 SER CB 1 1
6 1721 1 1 8 SER H H 8.091 -1.682 3.940 1.00 . A A . 8 SER H 1 1
6 1722 1 1 8 SER HA H 10.059 0.205 2.931 1.00 . A A . 8 SER HA 1 1
6 1723 1 1 8 SER HB2 H 8.473 0.717 5.299 1.00 . A A . 8 SER HB2 1 1
6 1724 1 1 8 SER HB3 H 10.184 0.601 5.708 1.00 . A A . 8 SER HB3 1 1
6 1725 1 1 8 SER HG H 9.316 2.730 5.007 1.00 . A A . 8 SER HG 1 1
6 1726 1 1 8 SER N N 8.384 -0.875 3.467 1.00 . A A . 8 SER N 1 1
6 1727 1 1 8 SER O O 10.866 -1.528 5.477 1.00 . A A . 8 SER O 1 1
6 1728 1 1 8 SER OG O 9.688 2.086 4.401 1.00 . A A . 8 SER OG 1 1
6 1729 1 1 9 GLY C C 13.337 -3.165 2.626 1.00 . A A . 9 GLY C 1 1
6 1730 1 1 9 GLY CA C 12.219 -3.069 3.645 1.00 . A A . 9 GLY CA 1 1
6 1731 1 1 9 GLY H H 11.052 -1.837 2.382 1.00 . A A . 9 GLY H 1 1
6 1732 1 1 9 GLY HA2 H 12.648 -2.857 4.615 1.00 . A A . 9 GLY HA2 1 1
6 1733 1 1 9 GLY HA3 H 11.706 -4.019 3.690 1.00 . A A . 9 GLY HA3 1 1
6 1734 1 1 9 GLY N N 11.259 -2.033 3.319 1.00 . A A . 9 GLY N 1 1
6 1735 1 1 9 GLY O O 13.172 -3.772 1.568 1.00 . A A . 9 GLY O 1 1
6 1736 1 1 10 TYR C C 16.429 -3.867 2.216 1.00 . A A . 10 TYR C 1 1
6 1737 1 1 10 TYR CA C 15.628 -2.581 2.048 1.00 . A A . 10 TYR CA 1 1
6 1738 1 1 10 TYR CB C 16.526 -1.369 2.312 1.00 . A A . 10 TYR CB 1 1
6 1739 1 1 10 TYR CD1 C 15.153 0.611 3.067 1.00 . A A . 10 TYR CD1 1 1
6 1740 1 1 10 TYR CD2 C 15.896 0.554 0.802 1.00 . A A . 10 TYR CD2 1 1
6 1741 1 1 10 TYR CE1 C 14.530 1.823 2.837 1.00 . A A . 10 TYR CE1 1 1
6 1742 1 1 10 TYR CE2 C 15.275 1.766 0.564 1.00 . A A . 10 TYR CE2 1 1
6 1743 1 1 10 TYR CG C 15.845 -0.043 2.057 1.00 . A A . 10 TYR CG 1 1
6 1744 1 1 10 TYR CZ C 14.594 2.396 1.584 1.00 . A A . 10 TYR CZ 1 1
6 1745 1 1 10 TYR H H 14.548 -2.094 3.802 1.00 . A A . 10 TYR H 1 1
6 1746 1 1 10 TYR HA H 15.260 -2.529 1.035 1.00 . A A . 10 TYR HA 1 1
6 1747 1 1 10 TYR HB2 H 16.843 -1.385 3.343 1.00 . A A . 10 TYR HB2 1 1
6 1748 1 1 10 TYR HB3 H 17.394 -1.427 1.672 1.00 . A A . 10 TYR HB3 1 1
6 1749 1 1 10 TYR HD1 H 15.105 0.161 4.048 1.00 . A A . 10 TYR HD1 1 1
6 1750 1 1 10 TYR HD2 H 16.429 0.057 0.006 1.00 . A A . 10 TYR HD2 1 1
6 1751 1 1 10 TYR HE1 H 13.998 2.317 3.635 1.00 . A A . 10 TYR HE1 1 1
6 1752 1 1 10 TYR HE2 H 15.326 2.213 -0.417 1.00 . A A . 10 TYR HE2 1 1
6 1753 1 1 10 TYR HH H 14.593 4.202 0.925 1.00 . A A . 10 TYR HH 1 1
6 1754 1 1 10 TYR N N 14.478 -2.562 2.944 1.00 . A A . 10 TYR N 1 1
6 1755 1 1 10 TYR O O 16.083 -4.665 3.112 1.00 . A A . 10 TYR O 1 1
6 1756 1 1 10 TYR OH O 13.976 3.603 1.350 1.00 . A A . 10 TYR OH 1 1
6 1757 1 1 11 NH2 HN1 H 17.689 -3.396 0.690 1.00 . A A . 11 NH2 HN1 1 1
6 1758 1 1 11 NH2 HN2 H 18.006 -4.922 1.483 1.00 . A A . 11 NH2 HN2 1 1
6 1759 1 1 11 NH2 N N 17.457 -4.079 1.397 1.00 . A A . 11 NH2 N 1 1
6 1760 2 1 1 ASP C C -0.321 -5.642 -0.856 1.00 . B B . 1 ASP C 1 1
6 1761 2 1 1 ASP CA C -0.404 -6.573 0.349 1.00 . B B . 1 ASP CA 1 1
6 1762 2 1 1 ASP CB C -0.835 -5.789 1.589 1.00 . B B . 1 ASP CB 1 1
6 1763 2 1 1 ASP CG C -1.321 -6.691 2.706 1.00 . B B . 1 ASP CG 1 1
6 1764 2 1 1 ASP H1 H 1.641 -6.483 0.560 1.00 . B B . 1 ASP H1 1 1
6 1765 2 1 1 ASP H2 H 1.052 -7.959 -0.088 1.00 . B B . 1 ASP H2 1 1
6 1766 2 1 1 ASP H3 H 0.867 -7.619 1.585 1.00 . B B . 1 ASP H3 1 1
6 1767 2 1 1 ASP HA H -1.131 -7.346 0.148 1.00 . B B . 1 ASP HA 1 1
6 1768 2 1 1 ASP HB2 H 0.004 -5.215 1.954 1.00 . B B . 1 ASP HB2 1 1
6 1769 2 1 1 ASP HB3 H -1.635 -5.115 1.320 1.00 . B B . 1 ASP HB3 1 1
6 1770 2 1 1 ASP N N 0.907 -7.216 0.627 1.00 . B B . 1 ASP N 1 1
6 1771 2 1 1 ASP O O 0.757 -5.176 -1.220 1.00 . B B . 1 ASP O 1 1
6 1772 2 1 1 ASP OD1 O -1.333 -6.241 3.871 1.00 . B B . 1 ASP OD1 1 1
6 1773 2 1 1 ASP OD2 O -1.692 -7.848 2.415 1.00 . B B . 1 ASP OD2 1 1
6 1774 2 1 2 ALA C C -2.300 -3.228 -2.328 1.00 . B B . 2 ALA C 1 1
6 1775 2 1 2 ALA CA C -1.530 -4.506 -2.636 1.00 . B B . 2 ALA CA 1 1
6 1776 2 1 2 ALA CB C -2.166 -5.235 -3.809 1.00 . B B . 2 ALA CB 1 1
6 1777 2 1 2 ALA H H -2.295 -5.782 -1.134 1.00 . B B . 2 ALA H 1 1
6 1778 2 1 2 ALA HA H -0.517 -4.244 -2.913 1.00 . B B . 2 ALA HA 1 1
6 1779 2 1 2 ALA HB1 H -1.557 -5.101 -4.691 1.00 . B B . 2 ALA HB1 1 1
6 1780 2 1 2 ALA HB2 H -3.153 -4.834 -3.987 1.00 . B B . 2 ALA HB2 1 1
6 1781 2 1 2 ALA HB3 H -2.242 -6.288 -3.579 1.00 . B B . 2 ALA HB3 1 1
6 1782 2 1 2 ALA N N -1.468 -5.378 -1.472 1.00 . B B . 2 ALA N 1 1
6 1783 2 1 2 ALA O O -2.807 -3.045 -1.220 1.00 . B B . 2 ALA O 1 1
6 1784 2 1 3 GLU C C -4.478 -1.267 -2.579 1.00 . B B . 3 GLU C 1 1
6 1785 2 1 3 GLU CA C -3.081 -1.074 -3.169 1.00 . B B . 3 GLU CA 1 1
6 1786 2 1 3 GLU CB C -3.185 -0.370 -4.522 1.00 . B B . 3 GLU CB 1 1
6 1787 2 1 3 GLU CD C -1.852 1.773 -4.570 1.00 . B B . 3 GLU CD 1 1
6 1788 2 1 3 GLU CG C -3.222 1.146 -4.416 1.00 . B B . 3 GLU CG 1 1
6 1789 2 1 3 GLU H H -1.952 -2.555 -4.174 1.00 . B B . 3 GLU H 1 1
6 1790 2 1 3 GLU HA H -2.506 -0.458 -2.497 1.00 . B B . 3 GLU HA 1 1
6 1791 2 1 3 GLU HB2 H -2.331 -0.645 -5.123 1.00 . B B . 3 GLU HB2 1 1
6 1792 2 1 3 GLU HB3 H -4.085 -0.696 -5.018 1.00 . B B . 3 GLU HB3 1 1
6 1793 2 1 3 GLU HG2 H -3.866 1.533 -5.191 1.00 . B B . 3 GLU HG2 1 1
6 1794 2 1 3 GLU HG3 H -3.619 1.417 -3.450 1.00 . B B . 3 GLU HG3 1 1
6 1795 2 1 3 GLU N N -2.381 -2.346 -3.318 1.00 . B B . 3 GLU N 1 1
6 1796 2 1 3 GLU O O -4.938 -0.457 -1.776 1.00 . B B . 3 GLU O 1 1
6 1797 2 1 3 GLU OE1 O -1.091 1.780 -3.580 1.00 . B B . 3 GLU OE1 1 1
6 1798 2 1 3 GLU OE2 O -1.540 2.257 -5.678 1.00 . B B . 3 GLU OE2 1 1
6 1799 2 1 4 PHE C C -6.447 -3.031 -1.019 1.00 . B B . 4 PHE C 1 1
6 1800 2 1 4 PHE CA C -6.490 -2.624 -2.487 1.00 . B B . 4 PHE CA 1 1
6 1801 2 1 4 PHE CB C -7.164 -3.714 -3.326 1.00 . B B . 4 PHE CB 1 1
6 1802 2 1 4 PHE CD1 C -6.933 -5.965 -2.238 1.00 . B B . 4 PHE CD1 1 1
6 1803 2 1 4 PHE CD2 C -5.505 -5.441 -4.074 1.00 . B B . 4 PHE CD2 1 1
6 1804 2 1 4 PHE CE1 C -6.346 -7.211 -2.133 1.00 . B B . 4 PHE CE1 1 1
6 1805 2 1 4 PHE CE2 C -4.915 -6.685 -3.974 1.00 . B B . 4 PHE CE2 1 1
6 1806 2 1 4 PHE CG C -6.519 -5.066 -3.208 1.00 . B B . 4 PHE CG 1 1
6 1807 2 1 4 PHE CZ C -5.334 -7.572 -3.001 1.00 . B B . 4 PHE CZ 1 1
6 1808 2 1 4 PHE H H -4.733 -2.954 -3.619 1.00 . B B . 4 PHE H 1 1
6 1809 2 1 4 PHE HA H -7.065 -1.715 -2.571 1.00 . B B . 4 PHE HA 1 1
6 1810 2 1 4 PHE HB2 H -8.193 -3.812 -3.014 1.00 . B B . 4 PHE HB2 1 1
6 1811 2 1 4 PHE HB3 H -7.136 -3.424 -4.366 1.00 . B B . 4 PHE HB3 1 1
6 1812 2 1 4 PHE HD1 H -7.723 -5.683 -1.557 1.00 . B B . 4 PHE HD1 1 1
6 1813 2 1 4 PHE HD2 H -5.175 -4.749 -4.835 1.00 . B B . 4 PHE HD2 1 1
6 1814 2 1 4 PHE HE1 H -6.677 -7.902 -1.370 1.00 . B B . 4 PHE HE1 1 1
6 1815 2 1 4 PHE HE2 H -4.123 -6.965 -4.654 1.00 . B B . 4 PHE HE2 1 1
6 1816 2 1 4 PHE HZ H -4.874 -8.546 -2.922 1.00 . B B . 4 PHE HZ 1 1
6 1817 2 1 4 PHE N N -5.148 -2.341 -2.981 1.00 . B B . 4 PHE N 1 1
6 1818 2 1 4 PHE O O -7.387 -2.775 -0.266 1.00 . B B . 4 PHE O 1 1
6 1819 2 1 5 ARG C C -4.932 -2.864 1.663 1.00 . B B . 5 ARG C 1 1
6 1820 2 1 5 ARG CA C -5.178 -4.072 0.774 1.00 . B B . 5 ARG CA 1 1
6 1821 2 1 5 ARG CB C -4.003 -5.038 0.903 1.00 . B B . 5 ARG CB 1 1
6 1822 2 1 5 ARG CD C -5.317 -7.176 0.986 1.00 . B B . 5 ARG CD 1 1
6 1823 2 1 5 ARG CG C -4.238 -6.391 0.259 1.00 . B B . 5 ARG CG 1 1
6 1824 2 1 5 ARG CZ C -5.910 -9.555 1.245 1.00 . B B . 5 ARG CZ 1 1
6 1825 2 1 5 ARG H H -4.621 -3.816 -1.255 1.00 . B B . 5 ARG H 1 1
6 1826 2 1 5 ARG HA H -6.085 -4.567 1.089 1.00 . B B . 5 ARG HA 1 1
6 1827 2 1 5 ARG HB2 H -3.139 -4.591 0.437 1.00 . B B . 5 ARG HB2 1 1
6 1828 2 1 5 ARG HB3 H -3.794 -5.194 1.952 1.00 . B B . 5 ARG HB3 1 1
6 1829 2 1 5 ARG HD2 H -5.098 -7.170 2.044 1.00 . B B . 5 ARG HD2 1 1
6 1830 2 1 5 ARG HD3 H -6.270 -6.698 0.815 1.00 . B B . 5 ARG HD3 1 1
6 1831 2 1 5 ARG HE H -5.034 -8.761 -0.362 1.00 . B B . 5 ARG HE 1 1
6 1832 2 1 5 ARG HG2 H -4.539 -6.240 -0.763 1.00 . B B . 5 ARG HG2 1 1
6 1833 2 1 5 ARG HG3 H -3.317 -6.953 0.285 1.00 . B B . 5 ARG HG3 1 1
6 1834 2 1 5 ARG HH11 H -6.392 -8.398 2.833 1.00 . B B . 5 ARG HH11 1 1
6 1835 2 1 5 ARG HH12 H -6.795 -10.075 2.987 1.00 . B B . 5 ARG HH12 1 1
6 1836 2 1 5 ARG HH21 H -5.564 -10.967 -0.159 1.00 . B B . 5 ARG HH21 1 1
6 1837 2 1 5 ARG HH22 H -6.325 -11.533 1.290 1.00 . B B . 5 ARG HH22 1 1
6 1838 2 1 5 ARG N N -5.345 -3.652 -0.612 1.00 . B B . 5 ARG N 1 1
6 1839 2 1 5 ARG NE N -5.391 -8.561 0.527 1.00 . B B . 5 ARG NE 1 1
6 1840 2 1 5 ARG NH1 N -6.407 -9.323 2.454 1.00 . B B . 5 ARG NH1 1 1
6 1841 2 1 5 ARG NH2 N -5.935 -10.785 0.751 1.00 . B B . 5 ARG NH2 1 1
6 1842 2 1 5 ARG O O -5.512 -2.735 2.741 1.00 . B B . 5 ARG O 1 1
6 1843 2 1 6 HIS C C -4.862 0.220 1.921 1.00 . B B . 6 HIS C 1 1
6 1844 2 1 6 HIS CA C -3.709 -0.776 1.931 1.00 . B B . 6 HIS CA 1 1
6 1845 2 1 6 HIS CB C -2.468 -0.128 1.318 1.00 . B B . 6 HIS CB 1 1
6 1846 2 1 6 HIS CD2 C -0.859 -1.590 -0.074 1.00 . B B . 6 HIS CD2 1 1
6 1847 2 1 6 HIS CE1 C 0.320 -2.455 1.518 1.00 . B B . 6 HIS CE1 1 1
6 1848 2 1 6 HIS CG C -1.344 -1.086 1.086 1.00 . B B . 6 HIS CG 1 1
6 1849 2 1 6 HIS H H -3.631 -2.155 0.325 1.00 . B B . 6 HIS H 1 1
6 1850 2 1 6 HIS HA H -3.495 -1.055 2.951 1.00 . B B . 6 HIS HA 1 1
6 1851 2 1 6 HIS HB2 H -2.733 0.303 0.365 1.00 . B B . 6 HIS HB2 1 1
6 1852 2 1 6 HIS HB3 H -2.114 0.651 1.976 1.00 . B B . 6 HIS HB3 1 1
6 1853 2 1 6 HIS HD1 H -0.686 -1.482 3.051 1.00 . B B . 6 HIS HD1 1 1
6 1854 2 1 6 HIS HD2 H -1.222 -1.360 -1.066 1.00 . B B . 6 HIS HD2 1 1
6 1855 2 1 6 HIS HE1 H 1.058 -3.029 2.059 1.00 . B B . 6 HIS HE1 1 1
6 1856 2 1 6 HIS N N -4.056 -1.984 1.194 1.00 . B B . 6 HIS N 1 1
6 1857 2 1 6 HIS ND1 N -0.584 -1.647 2.090 1.00 . B B . 6 HIS ND1 1 1
6 1858 2 1 6 HIS NE2 N 0.193 -2.455 0.207 1.00 . B B . 6 HIS NE2 1 1
6 1859 2 1 6 HIS O O -5.154 0.860 2.932 1.00 . B B . 6 HIS O 1 1
6 1860 2 1 7 HIS C C -7.954 0.552 0.833 1.00 . B B . 7 HIS C 1 1
6 1861 2 1 7 HIS CA C -6.625 1.268 0.615 1.00 . B B . 7 HIS CA 1 1
6 1862 2 1 7 HIS CB C -6.592 1.907 -0.775 1.00 . B B . 7 HIS CB 1 1
6 1863 2 1 7 HIS CD2 C -4.056 2.276 -1.170 1.00 . B B . 7 HIS CD2 1 1
6 1864 2 1 7 HIS CE1 C -4.049 4.423 -1.428 1.00 . B B . 7 HIS CE1 1 1
6 1865 2 1 7 HIS CG C -5.344 2.692 -1.042 1.00 . B B . 7 HIS CG 1 1
6 1866 2 1 7 HIS H H -5.222 -0.190 0.001 1.00 . B B . 7 HIS H 1 1
6 1867 2 1 7 HIS HA H -6.521 2.042 1.360 1.00 . B B . 7 HIS HA 1 1
6 1868 2 1 7 HIS HB2 H -6.663 1.130 -1.522 1.00 . B B . 7 HIS HB2 1 1
6 1869 2 1 7 HIS HB3 H -7.435 2.576 -0.876 1.00 . B B . 7 HIS HB3 1 1
6 1870 2 1 7 HIS HD1 H -6.092 4.659 -1.173 1.00 . B B . 7 HIS HD1 1 1
6 1871 2 1 7 HIS HD2 H -3.708 1.255 -1.097 1.00 . B B . 7 HIS HD2 1 1
6 1872 2 1 7 HIS HE1 H -3.725 5.440 -1.595 1.00 . B B . 7 HIS HE1 1 1
6 1873 2 1 7 HIS N N -5.507 0.347 0.769 1.00 . B B . 7 HIS N 1 1
6 1874 2 1 7 HIS ND1 N -5.319 4.059 -1.208 1.00 . B B . 7 HIS ND1 1 1
6 1875 2 1 7 HIS NE2 N -3.243 3.378 -1.416 1.00 . B B . 7 HIS NE2 1 1
6 1876 2 1 7 HIS O O -8.006 -0.676 0.904 1.00 . B B . 7 HIS O 1 1
6 1877 2 1 8 SER C C -11.184 0.821 -0.127 1.00 . B B . 8 SER C 1 1
6 1878 2 1 8 SER CA C -10.358 0.767 1.153 1.00 . B B . 8 SER CA 1 1
6 1879 2 1 8 SER CB C -11.078 1.524 2.270 1.00 . B B . 8 SER CB 1 1
6 1880 2 1 8 SER H H -8.922 2.300 0.877 1.00 . B B . 8 SER H 1 1
6 1881 2 1 8 SER HA H -10.238 -0.263 1.447 1.00 . B B . 8 SER HA 1 1
6 1882 2 1 8 SER HB2 H -10.518 1.428 3.188 1.00 . B B . 8 SER HB2 1 1
6 1883 2 1 8 SER HB3 H -11.157 2.567 2.003 1.00 . B B . 8 SER HB3 1 1
6 1884 2 1 8 SER HG H -13.028 1.607 2.100 1.00 . B B . 8 SER HG 1 1
6 1885 2 1 8 SER N N -9.027 1.328 0.941 1.00 . B B . 8 SER N 1 1
6 1886 2 1 8 SER O O -11.264 1.860 -0.784 1.00 . B B . 8 SER O 1 1
6 1887 2 1 8 SER OG O -12.382 1.006 2.478 1.00 . B B . 8 SER OG 1 1
6 1888 2 1 9 GLY C C -11.887 -1.024 -2.835 1.00 . B B . 9 GLY C 1 1
6 1889 2 1 9 GLY CA C -12.610 -0.365 -1.677 1.00 . B B . 9 GLY CA 1 1
6 1890 2 1 9 GLY H H -11.698 -1.099 0.086 1.00 . B B . 9 GLY H 1 1
6 1891 2 1 9 GLY HA2 H -13.508 -0.925 -1.462 1.00 . B B . 9 GLY HA2 1 1
6 1892 2 1 9 GLY HA3 H -12.886 0.639 -1.963 1.00 . B B . 9 GLY HA3 1 1
6 1893 2 1 9 GLY N N -11.797 -0.304 -0.477 1.00 . B B . 9 GLY N 1 1
6 1894 2 1 9 GLY O O -10.667 -0.916 -2.956 1.00 . B B . 9 GLY O 1 1
6 1895 2 1 10 TYR C C -12.498 -1.707 -6.142 1.00 . B B . 10 TYR C 1 1
6 1896 2 1 10 TYR CA C -12.071 -2.387 -4.845 1.00 . B B . 10 TYR CA 1 1
6 1897 2 1 10 TYR CB C -12.496 -3.855 -4.859 1.00 . B B . 10 TYR CB 1 1
6 1898 2 1 10 TYR CD1 C -14.761 -4.138 -3.781 1.00 . B B . 10 TYR CD1 1 1
6 1899 2 1 10 TYR CD2 C -14.640 -4.147 -6.163 1.00 . B B . 10 TYR CD2 1 1
6 1900 2 1 10 TYR CE1 C -16.131 -4.315 -3.847 1.00 . B B . 10 TYR CE1 1 1
6 1901 2 1 10 TYR CE2 C -16.009 -4.323 -6.236 1.00 . B B . 10 TYR CE2 1 1
6 1902 2 1 10 TYR CG C -13.995 -4.050 -4.936 1.00 . B B . 10 TYR CG 1 1
6 1903 2 1 10 TYR CZ C -16.749 -4.408 -5.076 1.00 . B B . 10 TYR CZ 1 1
6 1904 2 1 10 TYR H H -13.611 -1.754 -3.536 1.00 . B B . 10 TYR H 1 1
6 1905 2 1 10 TYR HA H -10.995 -2.333 -4.761 1.00 . B B . 10 TYR HA 1 1
6 1906 2 1 10 TYR HB2 H -12.056 -4.342 -5.718 1.00 . B B . 10 TYR HB2 1 1
6 1907 2 1 10 TYR HB3 H -12.144 -4.335 -3.959 1.00 . B B . 10 TYR HB3 1 1
6 1908 2 1 10 TYR HD1 H -14.275 -4.064 -2.820 1.00 . B B . 10 TYR HD1 1 1
6 1909 2 1 10 TYR HD2 H -14.057 -4.081 -7.070 1.00 . B B . 10 TYR HD2 1 1
6 1910 2 1 10 TYR HE1 H -16.710 -4.380 -2.938 1.00 . B B . 10 TYR HE1 1 1
6 1911 2 1 10 TYR HE2 H -16.493 -4.396 -7.199 1.00 . B B . 10 TYR HE2 1 1
6 1912 2 1 10 TYR HH H -18.472 -4.029 -5.841 1.00 . B B . 10 TYR HH 1 1
6 1913 2 1 10 TYR N N -12.643 -1.707 -3.688 1.00 . B B . 10 TYR N 1 1
6 1914 2 1 10 TYR O O -13.697 -1.381 -6.270 1.00 . B B . 10 TYR O 1 1
6 1915 2 1 10 TYR OH O -18.111 -4.585 -5.145 1.00 . B B . 10 TYR OH 1 1
6 1916 2 1 11 NH2 HN1 H -10.618 -1.778 -6.915 1.00 . B B . 11 NH2 HN1 1 1
6 1917 2 1 11 NH2 HN2 H -11.827 -1.044 -7.944 1.00 . B B . 11 NH2 HN2 1 1
6 1918 2 1 11 NH2 N N -11.573 -1.492 -7.075 1.00 . B B . 11 NH2 N 1 1
6 1919 3 2 1 ZN ZN ZN 1.620 -3.340 -0.993 1.00 . C A . 101 ZN ZN 1 1
6 1920 4 2 1 ZN ZN ZN -1.364 3.104 -2.153 1.00 . D A . 102 ZN ZN 1 1
7 1921 1 1 1 ASP C C 0.540 5.220 -1.919 1.00 . A A . 1 ASP C 1 1
7 1922 1 1 1 ASP CA C 0.519 6.337 -0.882 1.00 . A A . 1 ASP CA 1 1
7 1923 1 1 1 ASP CB C 0.510 5.743 0.529 1.00 . A A . 1 ASP CB 1 1
7 1924 1 1 1 ASP CG C 0.763 6.786 1.598 1.00 . A A . 1 ASP CG 1 1
7 1925 1 1 1 ASP H1 H -1.509 6.651 -0.723 1.00 . A A . 1 ASP H1 1 1
7 1926 1 1 1 ASP H2 H -0.762 7.445 -2.049 1.00 . A A . 1 ASP H2 1 1
7 1927 1 1 1 ASP H3 H -0.547 8.045 -0.456 1.00 . A A . 1 ASP H3 1 1
7 1928 1 1 1 ASP HA H 1.400 6.948 -1.005 1.00 . A A . 1 ASP HA 1 1
7 1929 1 1 1 ASP HB2 H -0.452 5.290 0.715 1.00 . A A . 1 ASP HB2 1 1
7 1930 1 1 1 ASP HB3 H 1.279 4.986 0.598 1.00 . A A . 1 ASP HB3 1 1
7 1931 1 1 1 ASP N N -0.683 7.197 -1.041 1.00 . A A . 1 ASP N 1 1
7 1932 1 1 1 ASP O O -0.505 4.798 -2.414 1.00 . A A . 1 ASP O 1 1
7 1933 1 1 1 ASP OD1 O 0.428 6.525 2.772 1.00 . A A . 1 ASP OD1 1 1
7 1934 1 1 1 ASP OD2 O 1.295 7.864 1.262 1.00 . A A . 1 ASP OD2 1 1
7 1935 1 1 2 ALA C C 2.585 2.466 -2.602 1.00 . A A . 2 ALA C 1 1
7 1936 1 1 2 ALA CA C 1.896 3.675 -3.223 1.00 . A A . 2 ALA CA 1 1
7 1937 1 1 2 ALA CB C 2.680 4.174 -4.425 1.00 . A A . 2 ALA CB 1 1
7 1938 1 1 2 ALA H H 2.532 5.122 -1.817 1.00 . A A . 2 ALA H 1 1
7 1939 1 1 2 ALA HA H 0.910 3.380 -3.561 1.00 . A A . 2 ALA HA 1 1
7 1940 1 1 2 ALA HB1 H 2.648 5.253 -4.453 1.00 . A A . 2 ALA HB1 1 1
7 1941 1 1 2 ALA HB2 H 2.243 3.778 -5.330 1.00 . A A . 2 ALA HB2 1 1
7 1942 1 1 2 ALA HB3 H 3.705 3.845 -4.347 1.00 . A A . 2 ALA HB3 1 1
7 1943 1 1 2 ALA N N 1.735 4.744 -2.245 1.00 . A A . 2 ALA N 1 1
7 1944 1 1 2 ALA O O 2.973 2.491 -1.434 1.00 . A A . 2 ALA O 1 1
7 1945 1 1 3 GLU C C 4.742 0.472 -2.313 1.00 . A A . 3 GLU C 1 1
7 1946 1 1 3 GLU CA C 3.373 0.183 -2.925 1.00 . A A . 3 GLU CA 1 1
7 1947 1 1 3 GLU CB C 3.517 -0.811 -4.080 1.00 . A A . 3 GLU CB 1 1
7 1948 1 1 3 GLU CD C 2.643 -2.969 -3.104 1.00 . A A . 3 GLU CD 1 1
7 1949 1 1 3 GLU CG C 3.853 -2.224 -3.631 1.00 . A A . 3 GLU CG 1 1
7 1950 1 1 3 GLU H H 2.400 1.451 -4.312 1.00 . A A . 3 GLU H 1 1
7 1951 1 1 3 GLU HA H 2.739 -0.252 -2.167 1.00 . A A . 3 GLU HA 1 1
7 1952 1 1 3 GLU HB2 H 2.589 -0.841 -4.631 1.00 . A A . 3 GLU HB2 1 1
7 1953 1 1 3 GLU HB3 H 4.304 -0.469 -4.736 1.00 . A A . 3 GLU HB3 1 1
7 1954 1 1 3 GLU HG2 H 4.251 -2.770 -4.472 1.00 . A A . 3 GLU HG2 1 1
7 1955 1 1 3 GLU HG3 H 4.594 -2.174 -2.850 1.00 . A A . 3 GLU HG3 1 1
7 1956 1 1 3 GLU N N 2.734 1.409 -3.392 1.00 . A A . 3 GLU N 1 1
7 1957 1 1 3 GLU O O 5.211 -0.260 -1.443 1.00 . A A . 3 GLU O 1 1
7 1958 1 1 3 GLU OE1 O 1.711 -2.308 -2.602 1.00 . A A . 3 GLU OE1 1 1
7 1959 1 1 3 GLU OE2 O 2.625 -4.214 -3.198 1.00 . A A . 3 GLU OE2 1 1
7 1960 1 1 4 PHE C C 6.580 2.654 -0.933 1.00 . A A . 4 PHE C 1 1
7 1961 1 1 4 PHE CA C 6.696 1.914 -2.263 1.00 . A A . 4 PHE CA 1 1
7 1962 1 1 4 PHE CB C 7.439 2.782 -3.281 1.00 . A A . 4 PHE CB 1 1
7 1963 1 1 4 PHE CD1 C 6.881 5.128 -2.583 1.00 . A A . 4 PHE CD1 1 1
7 1964 1 1 4 PHE CD2 C 6.099 4.358 -4.701 1.00 . A A . 4 PHE CD2 1 1
7 1965 1 1 4 PHE CE1 C 6.288 6.356 -2.808 1.00 . A A . 4 PHE CE1 1 1
7 1966 1 1 4 PHE CE2 C 5.504 5.584 -4.930 1.00 . A A . 4 PHE CE2 1 1
7 1967 1 1 4 PHE CG C 6.793 4.116 -3.526 1.00 . A A . 4 PHE CG 1 1
7 1968 1 1 4 PHE CZ C 5.599 6.585 -3.982 1.00 . A A . 4 PHE CZ 1 1
7 1969 1 1 4 PHE H H 4.964 2.091 -3.468 1.00 . A A . 4 PHE H 1 1
7 1970 1 1 4 PHE HA H 7.255 1.006 -2.103 1.00 . A A . 4 PHE HA 1 1
7 1971 1 1 4 PHE HB2 H 8.443 2.962 -2.926 1.00 . A A . 4 PHE HB2 1 1
7 1972 1 1 4 PHE HB3 H 7.487 2.256 -4.223 1.00 . A A . 4 PHE HB3 1 1
7 1973 1 1 4 PHE HD1 H 7.419 4.950 -1.664 1.00 . A A . 4 PHE HD1 1 1
7 1974 1 1 4 PHE HD2 H 6.023 3.577 -5.443 1.00 . A A . 4 PHE HD2 1 1
7 1975 1 1 4 PHE HE1 H 6.365 7.136 -2.065 1.00 . A A . 4 PHE HE1 1 1
7 1976 1 1 4 PHE HE2 H 4.965 5.760 -5.849 1.00 . A A . 4 PHE HE2 1 1
7 1977 1 1 4 PHE HZ H 5.135 7.544 -4.160 1.00 . A A . 4 PHE HZ 1 1
7 1978 1 1 4 PHE N N 5.382 1.542 -2.772 1.00 . A A . 4 PHE N 1 1
7 1979 1 1 4 PHE O O 7.489 2.605 -0.104 1.00 . A A . 4 PHE O 1 1
7 1980 1 1 5 ARG C C 4.714 3.186 1.604 1.00 . A A . 5 ARG C 1 1
7 1981 1 1 5 ARG CA C 5.233 4.094 0.494 1.00 . A A . 5 ARG CA 1 1
7 1982 1 1 5 ARG CB C 4.243 5.230 0.243 1.00 . A A . 5 ARG CB 1 1
7 1983 1 1 5 ARG CD C 5.296 6.779 1.915 1.00 . A A . 5 ARG CD 1 1
7 1984 1 1 5 ARG CG C 4.009 6.110 1.458 1.00 . A A . 5 ARG CG 1 1
7 1985 1 1 5 ARG CZ C 6.049 8.349 3.659 1.00 . A A . 5 ARG CZ 1 1
7 1986 1 1 5 ARG H H 4.771 3.347 -1.431 1.00 . A A . 5 ARG H 1 1
7 1987 1 1 5 ARG HA H 6.177 4.514 0.802 1.00 . A A . 5 ARG HA 1 1
7 1988 1 1 5 ARG HB2 H 4.617 5.850 -0.559 1.00 . A A . 5 ARG HB2 1 1
7 1989 1 1 5 ARG HB3 H 3.295 4.807 -0.055 1.00 . A A . 5 ARG HB3 1 1
7 1990 1 1 5 ARG HD2 H 6.016 6.013 2.165 1.00 . A A . 5 ARG HD2 1 1
7 1991 1 1 5 ARG HD3 H 5.681 7.382 1.106 1.00 . A A . 5 ARG HD3 1 1
7 1992 1 1 5 ARG HE H 4.183 7.670 3.459 1.00 . A A . 5 ARG HE 1 1
7 1993 1 1 5 ARG HG2 H 3.290 6.873 1.204 1.00 . A A . 5 ARG HG2 1 1
7 1994 1 1 5 ARG HG3 H 3.623 5.502 2.262 1.00 . A A . 5 ARG HG3 1 1
7 1995 1 1 5 ARG HH11 H 7.502 7.749 2.385 1.00 . A A . 5 ARG HH11 1 1
7 1996 1 1 5 ARG HH12 H 8.005 8.860 3.615 1.00 . A A . 5 ARG HH12 1 1
7 1997 1 1 5 ARG HH21 H 4.842 9.132 5.077 1.00 . A A . 5 ARG HH21 1 1
7 1998 1 1 5 ARG HH22 H 6.497 9.644 5.144 1.00 . A A . 5 ARG HH22 1 1
7 1999 1 1 5 ARG N N 5.460 3.342 -0.734 1.00 . A A . 5 ARG N 1 1
7 2000 1 1 5 ARG NE N 5.088 7.630 3.084 1.00 . A A . 5 ARG NE 1 1
7 2001 1 1 5 ARG NH1 N 7.288 8.316 3.180 1.00 . A A . 5 ARG NH1 1 1
7 2002 1 1 5 ARG NH2 N 5.773 9.104 4.713 1.00 . A A . 5 ARG NH2 1 1
7 2003 1 1 5 ARG O O 5.102 3.324 2.764 1.00 . A A . 5 ARG O 1 1
7 2004 1 1 6 HIS C C 4.331 0.397 2.754 1.00 . A A . 6 HIS C 1 1
7 2005 1 1 6 HIS CA C 3.260 1.331 2.213 1.00 . A A . 6 HIS CA 1 1
7 2006 1 1 6 HIS CB C 2.144 0.507 1.572 1.00 . A A . 6 HIS CB 1 1
7 2007 1 1 6 HIS CD2 C 0.722 1.393 -0.394 1.00 . A A . 6 HIS CD2 1 1
7 2008 1 1 6 HIS CE1 C -0.546 2.779 0.677 1.00 . A A . 6 HIS CE1 1 1
7 2009 1 1 6 HIS CG C 1.088 1.332 0.910 1.00 . A A . 6 HIS CG 1 1
7 2010 1 1 6 HIS H H 3.563 2.195 0.302 1.00 . A A . 6 HIS H 1 1
7 2011 1 1 6 HIS HA H 2.851 1.907 3.028 1.00 . A A . 6 HIS HA 1 1
7 2012 1 1 6 HIS HB2 H 2.572 -0.142 0.823 1.00 . A A . 6 HIS HB2 1 1
7 2013 1 1 6 HIS HB3 H 1.669 -0.095 2.332 1.00 . A A . 6 HIS HB3 1 1
7 2014 1 1 6 HIS HD1 H 0.290 2.410 2.538 1.00 . A A . 6 HIS HD1 1 1
7 2015 1 1 6 HIS HD2 H 1.156 0.818 -1.200 1.00 . A A . 6 HIS HD2 1 1
7 2016 1 1 6 HIS HE1 H -1.300 3.516 0.912 1.00 . A A . 6 HIS HE1 1 1
7 2017 1 1 6 HIS N N 3.833 2.259 1.243 1.00 . A A . 6 HIS N 1 1
7 2018 1 1 6 HIS ND1 N 0.274 2.220 1.577 1.00 . A A . 6 HIS ND1 1 1
7 2019 1 1 6 HIS NE2 N -0.314 2.312 -0.535 1.00 . A A . 6 HIS NE2 1 1
7 2020 1 1 6 HIS O O 4.373 0.101 3.949 1.00 . A A . 6 HIS O 1 1
7 2021 1 1 7 HIS C C 7.556 -0.210 2.494 1.00 . A A . 7 HIS C 1 1
7 2022 1 1 7 HIS CA C 6.266 -0.978 2.231 1.00 . A A . 7 HIS CA 1 1
7 2023 1 1 7 HIS CB C 6.484 -2.008 1.124 1.00 . A A . 7 HIS CB 1 1
7 2024 1 1 7 HIS CD2 C 4.171 -2.577 0.096 1.00 . A A . 7 HIS CD2 1 1
7 2025 1 1 7 HIS CE1 C 3.936 -4.589 0.852 1.00 . A A . 7 HIS CE1 1 1
7 2026 1 1 7 HIS CG C 5.278 -2.850 0.838 1.00 . A A . 7 HIS CG 1 1
7 2027 1 1 7 HIS H H 5.096 0.202 0.921 1.00 . A A . 7 HIS H 1 1
7 2028 1 1 7 HIS HA H 5.971 -1.489 3.135 1.00 . A A . 7 HIS HA 1 1
7 2029 1 1 7 HIS HB2 H 6.754 -1.495 0.212 1.00 . A A . 7 HIS HB2 1 1
7 2030 1 1 7 HIS HB3 H 7.290 -2.668 1.411 1.00 . A A . 7 HIS HB3 1 1
7 2031 1 1 7 HIS HD1 H 5.733 -4.622 1.886 1.00 . A A . 7 HIS HD1 1 1
7 2032 1 1 7 HIS HD2 H 3.953 -1.645 -0.405 1.00 . A A . 7 HIS HD2 1 1
7 2033 1 1 7 HIS HE1 H 3.531 -5.565 1.073 1.00 . A A . 7 HIS HE1 1 1
7 2034 1 1 7 HIS N N 5.190 -0.070 1.859 1.00 . A A . 7 HIS N 1 1
7 2035 1 1 7 HIS ND1 N 5.107 -4.132 1.314 1.00 . A A . 7 HIS ND1 1 1
7 2036 1 1 7 HIS NE2 N 3.331 -3.686 0.107 1.00 . A A . 7 HIS NE2 1 1
7 2037 1 1 7 HIS O O 7.989 0.597 1.671 1.00 . A A . 7 HIS O 1 1
7 2038 1 1 8 SER C C 10.478 -0.806 4.414 1.00 . A A . 8 SER C 1 1
7 2039 1 1 8 SER CA C 9.407 0.206 4.020 1.00 . A A . 8 SER CA 1 1
7 2040 1 1 8 SER CB C 9.158 1.178 5.175 1.00 . A A . 8 SER CB 1 1
7 2041 1 1 8 SER H H 7.771 -1.116 4.263 1.00 . A A . 8 SER H 1 1
7 2042 1 1 8 SER HA H 9.753 0.763 3.162 1.00 . A A . 8 SER HA 1 1
7 2043 1 1 8 SER HB2 H 8.782 0.632 6.027 1.00 . A A . 8 SER HB2 1 1
7 2044 1 1 8 SER HB3 H 10.085 1.664 5.439 1.00 . A A . 8 SER HB3 1 1
7 2045 1 1 8 SER HG H 8.118 2.800 5.529 1.00 . A A . 8 SER HG 1 1
7 2046 1 1 8 SER N N 8.166 -0.464 3.647 1.00 . A A . 8 SER N 1 1
7 2047 1 1 8 SER O O 10.171 -1.885 4.920 1.00 . A A . 8 SER O 1 1
7 2048 1 1 8 SER OG O 8.211 2.169 4.813 1.00 . A A . 8 SER OG 1 1
7 2049 1 1 9 GLY C C 13.976 -1.244 3.520 1.00 . A A . 9 GLY C 1 1
7 2050 1 1 9 GLY CA C 12.835 -1.335 4.513 1.00 . A A . 9 GLY CA 1 1
7 2051 1 1 9 GLY H H 11.920 0.425 3.772 1.00 . A A . 9 GLY H 1 1
7 2052 1 1 9 GLY HA2 H 13.204 -1.077 5.494 1.00 . A A . 9 GLY HA2 1 1
7 2053 1 1 9 GLY HA3 H 12.470 -2.352 4.533 1.00 . A A . 9 GLY HA3 1 1
7 2054 1 1 9 GLY N N 11.736 -0.449 4.177 1.00 . A A . 9 GLY N 1 1
7 2055 1 1 9 GLY O O 14.762 -0.297 3.553 1.00 . A A . 9 GLY O 1 1
7 2056 1 1 10 TYR C C 14.891 -1.180 0.570 1.00 . A A . 10 TYR C 1 1
7 2057 1 1 10 TYR CA C 15.120 -2.256 1.626 1.00 . A A . 10 TYR CA 1 1
7 2058 1 1 10 TYR CB C 15.187 -3.632 0.961 1.00 . A A . 10 TYR CB 1 1
7 2059 1 1 10 TYR CD1 C 14.844 -5.466 2.664 1.00 . A A . 10 TYR CD1 1 1
7 2060 1 1 10 TYR CD2 C 17.067 -5.007 1.937 1.00 . A A . 10 TYR CD2 1 1
7 2061 1 1 10 TYR CE1 C 15.318 -6.461 3.497 1.00 . A A . 10 TYR CE1 1 1
7 2062 1 1 10 TYR CE2 C 17.548 -6.001 2.765 1.00 . A A . 10 TYR CE2 1 1
7 2063 1 1 10 TYR CG C 15.708 -4.722 1.872 1.00 . A A . 10 TYR CG 1 1
7 2064 1 1 10 TYR CZ C 16.670 -6.725 3.544 1.00 . A A . 10 TYR CZ 1 1
7 2065 1 1 10 TYR H H 13.410 -2.957 2.658 1.00 . A A . 10 TYR H 1 1
7 2066 1 1 10 TYR HA H 16.060 -2.061 2.123 1.00 . A A . 10 TYR HA 1 1
7 2067 1 1 10 TYR HB2 H 14.196 -3.916 0.639 1.00 . A A . 10 TYR HB2 1 1
7 2068 1 1 10 TYR HB3 H 15.837 -3.577 0.101 1.00 . A A . 10 TYR HB3 1 1
7 2069 1 1 10 TYR HD1 H 13.784 -5.256 2.626 1.00 . A A . 10 TYR HD1 1 1
7 2070 1 1 10 TYR HD2 H 17.752 -4.437 1.326 1.00 . A A . 10 TYR HD2 1 1
7 2071 1 1 10 TYR HE1 H 14.628 -7.029 4.106 1.00 . A A . 10 TYR HE1 1 1
7 2072 1 1 10 TYR HE2 H 18.608 -6.208 2.802 1.00 . A A . 10 TYR HE2 1 1
7 2073 1 1 10 TYR HH H 17.987 -7.446 4.746 1.00 . A A . 10 TYR HH 1 1
7 2074 1 1 10 TYR N N 14.067 -2.231 2.634 1.00 . A A . 10 TYR N 1 1
7 2075 1 1 10 TYR O O 13.720 -0.798 0.362 1.00 . A A . 10 TYR O 1 1
7 2076 1 1 10 TYR OH O 17.145 -7.717 4.371 1.00 . A A . 10 TYR OH 1 1
7 2077 1 1 11 NH2 HN1 H 16.873 -1.044 0.133 1.00 . A A . 11 NH2 HN1 1 1
7 2078 1 1 11 NH2 HN2 H 15.826 0.017 -0.783 1.00 . A A . 11 NH2 HN2 1 1
7 2079 1 1 11 NH2 N N 15.948 -0.697 -0.079 1.00 . A A . 11 NH2 N 1 1
7 2080 2 1 1 ASP C C -0.383 -5.697 -0.648 1.00 . B B . 1 ASP C 1 1
7 2081 2 1 1 ASP CA C -0.548 -6.611 0.562 1.00 . B B . 1 ASP CA 1 1
7 2082 2 1 1 ASP CB C -1.072 -5.814 1.757 1.00 . B B . 1 ASP CB 1 1
7 2083 2 1 1 ASP CG C -1.530 -6.708 2.892 1.00 . B B . 1 ASP CG 1 1
7 2084 2 1 1 ASP H1 H 0.974 -7.954 0.223 1.00 . B B . 1 ASP H1 1 1
7 2085 2 1 1 ASP H2 H 0.619 -7.676 1.880 1.00 . B B . 1 ASP H2 1 1
7 2086 2 1 1 ASP H3 H 1.465 -6.491 0.970 1.00 . B B . 1 ASP H3 1 1
7 2087 2 1 1 ASP HA H -1.252 -7.393 0.320 1.00 . B B . 1 ASP HA 1 1
7 2088 2 1 1 ASP HB2 H -0.286 -5.171 2.124 1.00 . B B . 1 ASP HB2 1 1
7 2089 2 1 1 ASP HB3 H -1.906 -5.209 1.438 1.00 . B B . 1 ASP HB3 1 1
7 2090 2 1 1 ASP N N 0.744 -7.239 0.944 1.00 . B B . 1 ASP N 1 1
7 2091 2 1 1 ASP O O 0.727 -5.270 -0.966 1.00 . B B . 1 ASP O 1 1
7 2092 2 1 1 ASP OD1 O -1.617 -6.215 4.037 1.00 . B B . 1 ASP OD1 1 1
7 2093 2 1 1 ASP OD2 O -1.803 -7.899 2.637 1.00 . B B . 1 ASP OD2 1 1
7 2094 2 1 2 ALA C C -2.194 -3.230 -2.233 1.00 . B B . 2 ALA C 1 1
7 2095 2 1 2 ALA CA C -1.468 -4.544 -2.495 1.00 . B B . 2 ALA CA 1 1
7 2096 2 1 2 ALA CB C -2.091 -5.261 -3.682 1.00 . B B . 2 ALA CB 1 1
7 2097 2 1 2 ALA H H -2.347 -5.777 -1.018 1.00 . B B . 2 ALA H 1 1
7 2098 2 1 2 ALA HA H -0.436 -4.330 -2.736 1.00 . B B . 2 ALA HA 1 1
7 2099 2 1 2 ALA HB1 H -2.347 -6.270 -3.398 1.00 . B B . 2 ALA HB1 1 1
7 2100 2 1 2 ALA HB2 H -1.386 -5.284 -4.500 1.00 . B B . 2 ALA HB2 1 1
7 2101 2 1 2 ALA HB3 H -2.983 -4.736 -3.991 1.00 . B B . 2 ALA HB3 1 1
7 2102 2 1 2 ALA N N -1.492 -5.404 -1.319 1.00 . B B . 2 ALA N 1 1
7 2103 2 1 2 ALA O O -2.703 -2.995 -1.138 1.00 . B B . 2 ALA O 1 1
7 2104 2 1 3 GLU C C -4.327 -1.228 -2.649 1.00 . B B . 3 GLU C 1 1
7 2105 2 1 3 GLU CA C -2.891 -1.083 -3.149 1.00 . B B . 3 GLU CA 1 1
7 2106 2 1 3 GLU CB C -2.882 -0.378 -4.507 1.00 . B B . 3 GLU CB 1 1
7 2107 2 1 3 GLU CD C -2.121 1.981 -4.018 1.00 . B B . 3 GLU CD 1 1
7 2108 2 1 3 GLU CG C -3.273 1.090 -4.439 1.00 . B B . 3 GLU CG 1 1
7 2109 2 1 3 GLU H H -1.809 -2.633 -4.097 1.00 . B B . 3 GLU H 1 1
7 2110 2 1 3 GLU HA H -2.336 -0.486 -2.441 1.00 . B B . 3 GLU HA 1 1
7 2111 2 1 3 GLU HB2 H -1.888 -0.442 -4.924 1.00 . B B . 3 GLU HB2 1 1
7 2112 2 1 3 GLU HB3 H -3.572 -0.882 -5.165 1.00 . B B . 3 GLU HB3 1 1
7 2113 2 1 3 GLU HG2 H -3.613 1.405 -5.413 1.00 . B B . 3 GLU HG2 1 1
7 2114 2 1 3 GLU HG3 H -4.075 1.203 -3.724 1.00 . B B . 3 GLU HG3 1 1
7 2115 2 1 3 GLU N N -2.235 -2.380 -3.252 1.00 . B B . 3 GLU N 1 1
7 2116 2 1 3 GLU O O -4.814 -0.397 -1.883 1.00 . B B . 3 GLU O 1 1
7 2117 2 1 3 GLU OE1 O -1.190 1.474 -3.362 1.00 . B B . 3 GLU OE1 1 1
7 2118 2 1 3 GLU OE2 O -2.149 3.185 -4.353 1.00 . B B . 3 GLU OE2 1 1
7 2119 2 1 4 PHE C C -6.439 -2.916 -1.193 1.00 . B B . 4 PHE C 1 1
7 2120 2 1 4 PHE CA C -6.377 -2.522 -2.665 1.00 . B B . 4 PHE CA 1 1
7 2121 2 1 4 PHE CB C -7.041 -3.591 -3.541 1.00 . B B . 4 PHE CB 1 1
7 2122 2 1 4 PHE CD1 C -6.720 -5.896 -2.597 1.00 . B B . 4 PHE CD1 1 1
7 2123 2 1 4 PHE CD2 C -5.354 -5.221 -4.430 1.00 . B B . 4 PHE CD2 1 1
7 2124 2 1 4 PHE CE1 C -6.099 -7.131 -2.585 1.00 . B B . 4 PHE CE1 1 1
7 2125 2 1 4 PHE CE2 C -4.729 -6.455 -4.422 1.00 . B B . 4 PHE CE2 1 1
7 2126 2 1 4 PHE CG C -6.354 -4.929 -3.519 1.00 . B B . 4 PHE CG 1 1
7 2127 2 1 4 PHE CZ C -5.103 -7.410 -3.499 1.00 . B B . 4 PHE CZ 1 1
7 2128 2 1 4 PHE H H -4.566 -2.919 -3.685 1.00 . B B . 4 PHE H 1 1
7 2129 2 1 4 PHE HA H -6.914 -1.594 -2.787 1.00 . B B . 4 PHE HA 1 1
7 2130 2 1 4 PHE HB2 H -8.055 -3.738 -3.206 1.00 . B B . 4 PHE HB2 1 1
7 2131 2 1 4 PHE HB3 H -7.056 -3.243 -4.564 1.00 . B B . 4 PHE HB3 1 1
7 2132 2 1 4 PHE HD1 H -7.499 -5.679 -1.881 1.00 . B B . 4 PHE HD1 1 1
7 2133 2 1 4 PHE HD2 H -5.058 -4.476 -5.152 1.00 . B B . 4 PHE HD2 1 1
7 2134 2 1 4 PHE HE1 H -6.394 -7.876 -1.863 1.00 . B B . 4 PHE HE1 1 1
7 2135 2 1 4 PHE HE2 H -3.949 -6.670 -5.138 1.00 . B B . 4 PHE HE2 1 1
7 2136 2 1 4 PHE HZ H -4.617 -8.375 -3.492 1.00 . B B . 4 PHE HZ 1 1
7 2137 2 1 4 PHE N N -5.001 -2.285 -3.081 1.00 . B B . 4 PHE N 1 1
7 2138 2 1 4 PHE O O -7.415 -2.625 -0.503 1.00 . B B . 4 PHE O 1 1
7 2139 2 1 5 ARG C C -5.022 -2.784 1.579 1.00 . B B . 5 ARG C 1 1
7 2140 2 1 5 ARG CA C -5.315 -3.977 0.686 1.00 . B B . 5 ARG CA 1 1
7 2141 2 1 5 ARG CB C -4.227 -5.028 0.884 1.00 . B B . 5 ARG CB 1 1
7 2142 2 1 5 ARG CD C -5.847 -6.936 1.004 1.00 . B B . 5 ARG CD 1 1
7 2143 2 1 5 ARG CG C -4.589 -6.395 0.344 1.00 . B B . 5 ARG CG 1 1
7 2144 2 1 5 ARG CZ C -5.508 -9.358 1.321 1.00 . B B . 5 ARG CZ 1 1
7 2145 2 1 5 ARG H H -4.626 -3.757 -1.307 1.00 . B B . 5 ARG H 1 1
7 2146 2 1 5 ARG HA H -6.271 -4.398 0.959 1.00 . B B . 5 ARG HA 1 1
7 2147 2 1 5 ARG HB2 H -3.332 -4.695 0.382 1.00 . B B . 5 ARG HB2 1 1
7 2148 2 1 5 ARG HB3 H -4.022 -5.124 1.940 1.00 . B B . 5 ARG HB3 1 1
7 2149 2 1 5 ARG HD2 H -5.748 -6.836 2.074 1.00 . B B . 5 ARG HD2 1 1
7 2150 2 1 5 ARG HD3 H -6.692 -6.354 0.667 1.00 . B B . 5 ARG HD3 1 1
7 2151 2 1 5 ARG HE H -6.704 -8.540 -0.051 1.00 . B B . 5 ARG HE 1 1
7 2152 2 1 5 ARG HG2 H -4.752 -6.312 -0.718 1.00 . B B . 5 ARG HG2 1 1
7 2153 2 1 5 ARG HG3 H -3.770 -7.073 0.533 1.00 . B B . 5 ARG HG3 1 1
7 2154 2 1 5 ARG HH11 H -4.438 -8.196 2.584 1.00 . B B . 5 ARG HH11 1 1
7 2155 2 1 5 ARG HH12 H -4.231 -9.902 2.790 1.00 . B B . 5 ARG HH12 1 1
7 2156 2 1 5 ARG HH21 H -6.432 -10.781 0.222 1.00 . B B . 5 ARG HH21 1 1
7 2157 2 1 5 ARG HH22 H -5.361 -11.370 1.450 1.00 . B B . 5 ARG HH22 1 1
7 2158 2 1 5 ARG N N -5.383 -3.565 -0.712 1.00 . B B . 5 ARG N 1 1
7 2159 2 1 5 ARG NE N -6.082 -8.342 0.680 1.00 . B B . 5 ARG NE 1 1
7 2160 2 1 5 ARG NH1 N -4.656 -9.133 2.314 1.00 . B B . 5 ARG NH1 1 1
7 2161 2 1 5 ARG NH2 N -5.790 -10.605 0.968 1.00 . B B . 5 ARG NH2 1 1
7 2162 2 1 5 ARG O O -5.633 -2.612 2.635 1.00 . B B . 5 ARG O 1 1
7 2163 2 1 6 HIS C C -4.806 0.239 1.931 1.00 . B B . 6 HIS C 1 1
7 2164 2 1 6 HIS CA C -3.679 -0.780 1.897 1.00 . B B . 6 HIS CA 1 1
7 2165 2 1 6 HIS CB C -2.439 -0.140 1.276 1.00 . B B . 6 HIS CB 1 1
7 2166 2 1 6 HIS CD2 C -0.738 -1.460 -0.146 1.00 . B B . 6 HIS CD2 1 1
7 2167 2 1 6 HIS CE1 C 0.288 -2.543 1.418 1.00 . B B . 6 HIS CE1 1 1
7 2168 2 1 6 HIS CG C -1.318 -1.097 1.023 1.00 . B B . 6 HIS CG 1 1
7 2169 2 1 6 HIS H H -3.629 -2.168 0.291 1.00 . B B . 6 HIS H 1 1
7 2170 2 1 6 HIS HA H -3.450 -1.087 2.906 1.00 . B B . 6 HIS HA 1 1
7 2171 2 1 6 HIS HB2 H -2.712 0.302 0.328 1.00 . B B . 6 HIS HB2 1 1
7 2172 2 1 6 HIS HB3 H -2.075 0.633 1.935 1.00 . B B . 6 HIS HB3 1 1
7 2173 2 1 6 HIS HD1 H -0.840 -1.750 2.972 1.00 . B B . 6 HIS HD1 1 1
7 2174 2 1 6 HIS HD2 H -1.010 -1.100 -1.127 1.00 . B B . 6 HIS HD2 1 1
7 2175 2 1 6 HIS HE1 H 0.972 -3.194 1.943 1.00 . B B . 6 HIS HE1 1 1
7 2176 2 1 6 HIS N N -4.075 -1.965 1.144 1.00 . B B . 6 HIS N 1 1
7 2177 2 1 6 HIS ND1 N -0.656 -1.794 2.009 1.00 . B B . 6 HIS ND1 1 1
7 2178 2 1 6 HIS NE2 N 0.275 -2.376 0.111 1.00 . B B . 6 HIS NE2 1 1
7 2179 2 1 6 HIS O O -5.045 0.890 2.948 1.00 . B B . 6 HIS O 1 1
7 2180 2 1 7 HIS C C -7.925 0.676 0.983 1.00 . B B . 7 HIS C 1 1
7 2181 2 1 7 HIS CA C -6.583 1.337 0.687 1.00 . B B . 7 HIS CA 1 1
7 2182 2 1 7 HIS CB C -6.596 1.950 -0.715 1.00 . B B . 7 HIS CB 1 1
7 2183 2 1 7 HIS CD2 C -4.089 2.346 -1.242 1.00 . B B . 7 HIS CD2 1 1
7 2184 2 1 7 HIS CE1 C -4.104 4.501 -1.422 1.00 . B B . 7 HIS CE1 1 1
7 2185 2 1 7 HIS CG C -5.368 2.751 -1.026 1.00 . B B . 7 HIS CG 1 1
7 2186 2 1 7 HIS H H -5.239 -0.157 0.023 1.00 . B B . 7 HIS H 1 1
7 2187 2 1 7 HIS HA H -6.417 2.122 1.409 1.00 . B B . 7 HIS HA 1 1
7 2188 2 1 7 HIS HB2 H -6.671 1.158 -1.445 1.00 . B B . 7 HIS HB2 1 1
7 2189 2 1 7 HIS HB3 H -7.452 2.602 -0.807 1.00 . B B . 7 HIS HB3 1 1
7 2190 2 1 7 HIS HD1 H -6.132 4.716 -1.042 1.00 . B B . 7 HIS HD1 1 1
7 2191 2 1 7 HIS HD2 H -3.730 1.328 -1.219 1.00 . B B . 7 HIS HD2 1 1
7 2192 2 1 7 HIS HE1 H -3.793 5.526 -1.568 1.00 . B B . 7 HIS HE1 1 1
7 2193 2 1 7 HIS N N -5.488 0.385 0.802 1.00 . B B . 7 HIS N 1 1
7 2194 2 1 7 HIS ND1 N -5.358 4.122 -1.143 1.00 . B B . 7 HIS ND1 1 1
7 2195 2 1 7 HIS NE2 N -3.295 3.462 -1.492 1.00 . B B . 7 HIS NE2 1 1
7 2196 2 1 7 HIS O O -8.454 -0.074 0.162 1.00 . B B . 7 HIS O 1 1
7 2197 2 1 8 SER C C -10.276 1.113 3.818 1.00 . B B . 8 SER C 1 1
7 2198 2 1 8 SER CA C -9.753 0.409 2.569 1.00 . B B . 8 SER CA 1 1
7 2199 2 1 8 SER CB C -9.621 -1.093 2.833 1.00 . B B . 8 SER CB 1 1
7 2200 2 1 8 SER H H -8.000 1.575 2.766 1.00 . B B . 8 SER H 1 1
7 2201 2 1 8 SER HA H -10.456 0.563 1.763 1.00 . B B . 8 SER HA 1 1
7 2202 2 1 8 SER HB2 H -9.292 -1.588 1.931 1.00 . B B . 8 SER HB2 1 1
7 2203 2 1 8 SER HB3 H -8.896 -1.256 3.617 1.00 . B B . 8 SER HB3 1 1
7 2204 2 1 8 SER HG H -10.735 -2.172 4.031 1.00 . B B . 8 SER HG 1 1
7 2205 2 1 8 SER N N -8.470 0.966 2.159 1.00 . B B . 8 SER N 1 1
7 2206 2 1 8 SER O O -9.510 1.421 4.733 1.00 . B B . 8 SER O 1 1
7 2207 2 1 8 SER OG O -10.860 -1.652 3.233 1.00 . B B . 8 SER OG 1 1
7 2208 2 1 9 GLY C C -13.427 2.805 4.631 1.00 . B B . 9 GLY C 1 1
7 2209 2 1 9 GLY CA C -12.176 2.031 4.994 1.00 . B B . 9 GLY CA 1 1
7 2210 2 1 9 GLY H H -12.141 1.096 3.094 1.00 . B B . 9 GLY H 1 1
7 2211 2 1 9 GLY HA2 H -12.428 1.288 5.736 1.00 . B B . 9 GLY HA2 1 1
7 2212 2 1 9 GLY HA3 H -11.452 2.713 5.416 1.00 . B B . 9 GLY HA3 1 1
7 2213 2 1 9 GLY N N -11.580 1.365 3.851 1.00 . B B . 9 GLY N 1 1
7 2214 2 1 9 GLY O O -13.932 2.696 3.513 1.00 . B B . 9 GLY O 1 1
7 2215 2 1 10 TYR C C -14.822 5.605 4.490 1.00 . B B . 10 TYR C 1 1
7 2216 2 1 10 TYR CA C -15.130 4.387 5.356 1.00 . B B . 10 TYR CA 1 1
7 2217 2 1 10 TYR CB C -15.726 4.834 6.693 1.00 . B B . 10 TYR CB 1 1
7 2218 2 1 10 TYR CD1 C -13.905 5.214 8.400 1.00 . B B . 10 TYR CD1 1 1
7 2219 2 1 10 TYR CD2 C -14.864 7.119 7.335 1.00 . B B . 10 TYR CD2 1 1
7 2220 2 1 10 TYR CE1 C -13.071 6.038 9.133 1.00 . B B . 10 TYR CE1 1 1
7 2221 2 1 10 TYR CE2 C -14.034 7.950 8.064 1.00 . B B . 10 TYR CE2 1 1
7 2222 2 1 10 TYR CG C -14.815 5.739 7.491 1.00 . B B . 10 TYR CG 1 1
7 2223 2 1 10 TYR CZ C -13.139 7.405 8.960 1.00 . B B . 10 TYR CZ 1 1
7 2224 2 1 10 TYR H H -13.481 3.634 6.449 1.00 . B B . 10 TYR H 1 1
7 2225 2 1 10 TYR HA H -15.848 3.767 4.841 1.00 . B B . 10 TYR HA 1 1
7 2226 2 1 10 TYR HB2 H -16.644 5.370 6.507 1.00 . B B . 10 TYR HB2 1 1
7 2227 2 1 10 TYR HB3 H -15.938 3.962 7.294 1.00 . B B . 10 TYR HB3 1 1
7 2228 2 1 10 TYR HD1 H -13.855 4.144 8.534 1.00 . B B . 10 TYR HD1 1 1
7 2229 2 1 10 TYR HD2 H -15.566 7.543 6.632 1.00 . B B . 10 TYR HD2 1 1
7 2230 2 1 10 TYR HE1 H -12.371 5.610 9.835 1.00 . B B . 10 TYR HE1 1 1
7 2231 2 1 10 TYR HE2 H -14.087 9.019 7.927 1.00 . B B . 10 TYR HE2 1 1
7 2232 2 1 10 TYR HH H -11.880 8.852 9.096 1.00 . B B . 10 TYR HH 1 1
7 2233 2 1 10 TYR N N -13.929 3.590 5.579 1.00 . B B . 10 TYR N 1 1
7 2234 2 1 10 TYR O O -15.497 5.779 3.455 1.00 . B B . 10 TYR O 1 1
7 2235 2 1 10 TYR OH O -12.310 8.229 9.686 1.00 . B B . 10 TYR OH 1 1
7 2236 2 1 11 NH2 HN1 H -13.336 6.233 5.731 1.00 . B B . 11 NH2 HN1 1 1
7 2237 2 1 11 NH2 HN2 H -13.621 7.240 4.329 1.00 . B B . 11 NH2 HN2 1 1
7 2238 2 1 11 NH2 N N -13.848 6.425 4.882 1.00 . B B . 11 NH2 N 1 1
7 2239 3 2 1 ZN ZN ZN 1.642 -3.446 -1.002 1.00 . C A . 101 ZN ZN 1 1
7 2240 4 2 1 ZN ZN ZN -1.422 2.996 -2.139 1.00 . D A . 102 ZN ZN 1 1
8 2241 1 1 1 ASP C C 0.527 5.147 -2.035 1.00 . A A . 1 ASP C 1 1
8 2242 1 1 1 ASP CA C 0.446 6.316 -1.058 1.00 . A A . 1 ASP CA 1 1
8 2243 1 1 1 ASP CB C 0.567 5.813 0.382 1.00 . A A . 1 ASP CB 1 1
8 2244 1 1 1 ASP CG C 0.617 6.947 1.386 1.00 . A A . 1 ASP CG 1 1
8 2245 1 1 1 ASP H1 H -1.605 6.392 -0.919 1.00 . A A . 1 ASP H1 1 1
8 2246 1 1 1 ASP H2 H -0.938 7.328 -2.195 1.00 . A A . 1 ASP H2 1 1
8 2247 1 1 1 ASP H3 H -0.811 7.870 -0.571 1.00 . A A . 1 ASP H3 1 1
8 2248 1 1 1 ASP HA H 1.253 7.004 -1.265 1.00 . A A . 1 ASP HA 1 1
8 2249 1 1 1 ASP HB2 H -0.285 5.192 0.611 1.00 . A A . 1 ASP HB2 1 1
8 2250 1 1 1 ASP HB3 H 1.471 5.228 0.480 1.00 . A A . 1 ASP HB3 1 1
8 2251 1 1 1 ASP N N -0.842 7.042 -1.199 1.00 . A A . 1 ASP N 1 1
8 2252 1 1 1 ASP O O -0.496 4.661 -2.520 1.00 . A A . 1 ASP O 1 1
8 2253 1 1 1 ASP OD1 O 0.936 8.085 0.982 1.00 . A A . 1 ASP OD1 1 1
8 2254 1 1 1 ASP OD2 O 0.337 6.697 2.578 1.00 . A A . 1 ASP OD2 1 1
8 2255 1 1 2 ALA C C 2.660 2.430 -2.541 1.00 . A A . 2 ALA C 1 1
8 2256 1 1 2 ALA CA C 1.961 3.592 -3.240 1.00 . A A . 2 ALA CA 1 1
8 2257 1 1 2 ALA CB C 2.769 4.052 -4.443 1.00 . A A . 2 ALA CB 1 1
8 2258 1 1 2 ALA H H 2.524 5.133 -1.904 1.00 . A A . 2 ALA H 1 1
8 2259 1 1 2 ALA HA H 0.996 3.255 -3.590 1.00 . A A . 2 ALA HA 1 1
8 2260 1 1 2 ALA HB1 H 2.220 3.839 -5.349 1.00 . A A . 2 ALA HB1 1 1
8 2261 1 1 2 ALA HB2 H 3.715 3.530 -4.467 1.00 . A A . 2 ALA HB2 1 1
8 2262 1 1 2 ALA HB3 H 2.947 5.115 -4.372 1.00 . A A . 2 ALA HB3 1 1
8 2263 1 1 2 ALA N N 1.747 4.702 -2.320 1.00 . A A . 2 ALA N 1 1
8 2264 1 1 2 ALA O O 2.988 2.511 -1.356 1.00 . A A . 2 ALA O 1 1
8 2265 1 1 3 GLU C C 4.862 0.532 -2.066 1.00 . A A . 3 GLU C 1 1
8 2266 1 1 3 GLU CA C 3.541 0.166 -2.738 1.00 . A A . 3 GLU CA 1 1
8 2267 1 1 3 GLU CB C 3.786 -0.858 -3.848 1.00 . A A . 3 GLU CB 1 1
8 2268 1 1 3 GLU CD C 2.538 -2.853 -2.932 1.00 . A A . 3 GLU CD 1 1
8 2269 1 1 3 GLU CG C 3.882 -2.290 -3.348 1.00 . A A . 3 GLU CG 1 1
8 2270 1 1 3 GLU H H 2.596 1.350 -4.219 1.00 . A A . 3 GLU H 1 1
8 2271 1 1 3 GLU HA H 2.884 -0.267 -1.999 1.00 . A A . 3 GLU HA 1 1
8 2272 1 1 3 GLU HB2 H 2.975 -0.803 -4.558 1.00 . A A . 3 GLU HB2 1 1
8 2273 1 1 3 GLU HB3 H 4.710 -0.612 -4.350 1.00 . A A . 3 GLU HB3 1 1
8 2274 1 1 3 GLU HG2 H 4.283 -2.909 -4.136 1.00 . A A . 3 GLU HG2 1 1
8 2275 1 1 3 GLU HG3 H 4.546 -2.318 -2.496 1.00 . A A . 3 GLU HG3 1 1
8 2276 1 1 3 GLU N N 2.883 1.351 -3.282 1.00 . A A . 3 GLU N 1 1
8 2277 1 1 3 GLU O O 5.204 -0.003 -1.013 1.00 . A A . 3 GLU O 1 1
8 2278 1 1 3 GLU OE1 O 1.647 -2.054 -2.579 1.00 . A A . 3 GLU OE1 1 1
8 2279 1 1 3 GLU OE2 O 2.375 -4.091 -2.965 1.00 . A A . 3 GLU OE2 1 1
8 2280 1 1 4 PHE C C 6.653 2.661 -0.826 1.00 . A A . 4 PHE C 1 1
8 2281 1 1 4 PHE CA C 6.870 1.893 -2.124 1.00 . A A . 4 PHE CA 1 1
8 2282 1 1 4 PHE CB C 7.611 2.776 -3.132 1.00 . A A . 4 PHE CB 1 1
8 2283 1 1 4 PHE CD1 C 6.984 5.150 -2.619 1.00 . A A . 4 PHE CD1 1 1
8 2284 1 1 4 PHE CD2 C 6.115 4.153 -4.603 1.00 . A A . 4 PHE CD2 1 1
8 2285 1 1 4 PHE CE1 C 6.321 6.327 -2.917 1.00 . A A . 4 PHE CE1 1 1
8 2286 1 1 4 PHE CE2 C 5.451 5.326 -4.906 1.00 . A A . 4 PHE CE2 1 1
8 2287 1 1 4 PHE CG C 6.889 4.052 -3.458 1.00 . A A . 4 PHE CG 1 1
8 2288 1 1 4 PHE CZ C 5.555 6.415 -4.061 1.00 . A A . 4 PHE CZ 1 1
8 2289 1 1 4 PHE H H 5.268 1.854 -3.506 1.00 . A A . 4 PHE H 1 1
8 2290 1 1 4 PHE HA H 7.463 1.016 -1.917 1.00 . A A . 4 PHE HA 1 1
8 2291 1 1 4 PHE HB2 H 8.579 3.036 -2.729 1.00 . A A . 4 PHE HB2 1 1
8 2292 1 1 4 PHE HB3 H 7.746 2.224 -4.051 1.00 . A A . 4 PHE HB3 1 1
8 2293 1 1 4 PHE HD1 H 7.583 5.083 -1.724 1.00 . A A . 4 PHE HD1 1 1
8 2294 1 1 4 PHE HD2 H 6.033 3.303 -5.263 1.00 . A A . 4 PHE HD2 1 1
8 2295 1 1 4 PHE HE1 H 6.405 7.176 -2.254 1.00 . A A . 4 PHE HE1 1 1
8 2296 1 1 4 PHE HE2 H 4.851 5.393 -5.801 1.00 . A A . 4 PHE HE2 1 1
8 2297 1 1 4 PHE HZ H 5.035 7.333 -4.296 1.00 . A A . 4 PHE HZ 1 1
8 2298 1 1 4 PHE N N 5.594 1.454 -2.675 1.00 . A A . 4 PHE N 1 1
8 2299 1 1 4 PHE O O 7.465 2.590 0.095 1.00 . A A . 4 PHE O 1 1
8 2300 1 1 5 ARG C C 4.703 3.273 1.533 1.00 . A A . 5 ARG C 1 1
8 2301 1 1 5 ARG CA C 5.208 4.175 0.414 1.00 . A A . 5 ARG CA 1 1
8 2302 1 1 5 ARG CB C 4.153 5.222 0.061 1.00 . A A . 5 ARG CB 1 1
8 2303 1 1 5 ARG CD C 4.174 7.685 0.562 1.00 . A A . 5 ARG CD 1 1
8 2304 1 1 5 ARG CG C 3.969 6.289 1.129 1.00 . A A . 5 ARG CG 1 1
8 2305 1 1 5 ARG CZ C 3.508 10.004 1.063 1.00 . A A . 5 ARG CZ 1 1
8 2306 1 1 5 ARG H H 4.938 3.401 -1.535 1.00 . A A . 5 ARG H 1 1
8 2307 1 1 5 ARG HA H 6.103 4.676 0.747 1.00 . A A . 5 ARG HA 1 1
8 2308 1 1 5 ARG HB2 H 4.438 5.708 -0.860 1.00 . A A . 5 ARG HB2 1 1
8 2309 1 1 5 ARG HB3 H 3.207 4.723 -0.087 1.00 . A A . 5 ARG HB3 1 1
8 2310 1 1 5 ARG HD2 H 5.226 7.924 0.602 1.00 . A A . 5 ARG HD2 1 1
8 2311 1 1 5 ARG HD3 H 3.843 7.694 -0.466 1.00 . A A . 5 ARG HD3 1 1
8 2312 1 1 5 ARG HE H 2.842 8.387 2.028 1.00 . A A . 5 ARG HE 1 1
8 2313 1 1 5 ARG HG2 H 2.968 6.216 1.527 1.00 . A A . 5 ARG HG2 1 1
8 2314 1 1 5 ARG HG3 H 4.684 6.120 1.917 1.00 . A A . 5 ARG HG3 1 1
8 2315 1 1 5 ARG HH11 H 4.827 9.819 -0.460 1.00 . A A . 5 ARG HH11 1 1
8 2316 1 1 5 ARG HH12 H 4.345 11.441 -0.085 1.00 . A A . 5 ARG HH12 1 1
8 2317 1 1 5 ARG HH21 H 2.207 10.519 2.521 1.00 . A A . 5 ARG HH21 1 1
8 2318 1 1 5 ARG HH22 H 2.860 11.838 1.607 1.00 . A A . 5 ARG HH22 1 1
8 2319 1 1 5 ARG N N 5.546 3.391 -0.766 1.00 . A A . 5 ARG N 1 1
8 2320 1 1 5 ARG NE N 3.430 8.697 1.307 1.00 . A A . 5 ARG NE 1 1
8 2321 1 1 5 ARG NH1 N 4.291 10.458 0.093 1.00 . A A . 5 ARG NH1 1 1
8 2322 1 1 5 ARG NH2 N 2.800 10.858 1.790 1.00 . A A . 5 ARG NH2 1 1
8 2323 1 1 5 ARG O O 5.052 3.456 2.699 1.00 . A A . 5 ARG O 1 1
8 2324 1 1 6 HIS C C 4.410 0.423 2.661 1.00 . A A . 6 HIS C 1 1
8 2325 1 1 6 HIS CA C 3.327 1.356 2.139 1.00 . A A . 6 HIS CA 1 1
8 2326 1 1 6 HIS CB C 2.217 0.521 1.502 1.00 . A A . 6 HIS CB 1 1
8 2327 1 1 6 HIS CD2 C 0.711 1.397 -0.400 1.00 . A A . 6 HIS CD2 1 1
8 2328 1 1 6 HIS CE1 C -0.550 2.743 0.728 1.00 . A A . 6 HIS CE1 1 1
8 2329 1 1 6 HIS CG C 1.123 1.332 0.889 1.00 . A A . 6 HIS CG 1 1
8 2330 1 1 6 HIS H H 3.645 2.200 0.220 1.00 . A A . 6 HIS H 1 1
8 2331 1 1 6 HIS HA H 2.920 1.922 2.961 1.00 . A A . 6 HIS HA 1 1
8 2332 1 1 6 HIS HB2 H 2.645 -0.094 0.723 1.00 . A A . 6 HIS HB2 1 1
8 2333 1 1 6 HIS HB3 H 1.779 -0.115 2.256 1.00 . A A . 6 HIS HB3 1 1
8 2334 1 1 6 HIS HD1 H 0.358 2.371 2.555 1.00 . A A . 6 HIS HD1 1 1
8 2335 1 1 6 HIS HD2 H 1.129 0.843 -1.228 1.00 . A A . 6 HIS HD2 1 1
8 2336 1 1 6 HIS HE1 H -1.309 3.460 0.996 1.00 . A A . 6 HIS HE1 1 1
8 2337 1 1 6 HIS N N 3.881 2.295 1.168 1.00 . A A . 6 HIS N 1 1
8 2338 1 1 6 HIS ND1 N 0.313 2.193 1.593 1.00 . A A . 6 HIS ND1 1 1
8 2339 1 1 6 HIS NE2 N -0.349 2.295 -0.497 1.00 . A A . 6 HIS NE2 1 1
8 2340 1 1 6 HIS O O 4.506 0.170 3.862 1.00 . A A . 6 HIS O 1 1
8 2341 1 1 7 HIS C C 7.589 -0.273 2.338 1.00 . A A . 7 HIS C 1 1
8 2342 1 1 7 HIS CA C 6.282 -1.017 2.085 1.00 . A A . 7 HIS CA 1 1
8 2343 1 1 7 HIS CB C 6.470 -2.039 0.965 1.00 . A A . 7 HIS CB 1 1
8 2344 1 1 7 HIS CD2 C 4.142 -2.578 -0.043 1.00 . A A . 7 HIS CD2 1 1
8 2345 1 1 7 HIS CE1 C 3.870 -4.572 0.745 1.00 . A A . 7 HIS CE1 1 1
8 2346 1 1 7 HIS CG C 5.248 -2.863 0.695 1.00 . A A . 7 HIS CG 1 1
8 2347 1 1 7 HIS H H 5.071 0.142 0.801 1.00 . A A . 7 HIS H 1 1
8 2348 1 1 7 HIS HA H 5.997 -1.536 2.989 1.00 . A A . 7 HIS HA 1 1
8 2349 1 1 7 HIS HB2 H 6.728 -1.520 0.054 1.00 . A A . 7 HIS HB2 1 1
8 2350 1 1 7 HIS HB3 H 7.273 -2.711 1.232 1.00 . A A . 7 HIS HB3 1 1
8 2351 1 1 7 HIS HD1 H 5.676 -4.630 1.763 1.00 . A A . 7 HIS HD1 1 1
8 2352 1 1 7 HIS HD2 H 3.943 -1.651 -0.563 1.00 . A A . 7 HIS HD2 1 1
8 2353 1 1 7 HIS HE1 H 3.449 -5.537 0.982 1.00 . A A . 7 HIS HE1 1 1
8 2354 1 1 7 HIS N N 5.211 -0.095 1.742 1.00 . A A . 7 HIS N 1 1
8 2355 1 1 7 HIS ND1 N 5.056 -4.134 1.188 1.00 . A A . 7 HIS ND1 1 1
8 2356 1 1 7 HIS NE2 N 3.278 -3.667 -0.008 1.00 . A A . 7 HIS NE2 1 1
8 2357 1 1 7 HIS O O 7.804 0.824 1.821 1.00 . A A . 7 HIS O 1 1
8 2358 1 1 8 SER C C 10.860 -1.329 3.383 1.00 . A A . 8 SER C 1 1
8 2359 1 1 8 SER CA C 9.748 -0.287 3.462 1.00 . A A . 8 SER CA 1 1
8 2360 1 1 8 SER CB C 9.710 0.328 4.862 1.00 . A A . 8 SER CB 1 1
8 2361 1 1 8 SER H H 8.226 -1.756 3.513 1.00 . A A . 8 SER H 1 1
8 2362 1 1 8 SER HA H 9.947 0.492 2.740 1.00 . A A . 8 SER HA 1 1
8 2363 1 1 8 SER HB2 H 10.603 0.912 5.021 1.00 . A A . 8 SER HB2 1 1
8 2364 1 1 8 SER HB3 H 8.842 0.965 4.949 1.00 . A A . 8 SER HB3 1 1
8 2365 1 1 8 SER HG H 8.842 -0.555 6.382 1.00 . A A . 8 SER HG 1 1
8 2366 1 1 8 SER N N 8.459 -0.882 3.135 1.00 . A A . 8 SER N 1 1
8 2367 1 1 8 SER O O 10.603 -2.531 3.455 1.00 . A A . 8 SER O 1 1
8 2368 1 1 8 SER OG O 9.638 -0.677 5.859 1.00 . A A . 8 SER OG 1 1
8 2369 1 1 9 GLY C C 13.141 -2.681 1.936 1.00 . A A . 9 GLY C 1 1
8 2370 1 1 9 GLY CA C 13.224 -1.768 3.142 1.00 . A A . 9 GLY CA 1 1
8 2371 1 1 9 GLY H H 12.239 0.107 3.178 1.00 . A A . 9 GLY H 1 1
8 2372 1 1 9 GLY HA2 H 14.133 -1.188 3.079 1.00 . A A . 9 GLY HA2 1 1
8 2373 1 1 9 GLY HA3 H 13.258 -2.372 4.037 1.00 . A A . 9 GLY HA3 1 1
8 2374 1 1 9 GLY N N 12.094 -0.861 3.231 1.00 . A A . 9 GLY N 1 1
8 2375 1 1 9 GLY O O 12.751 -2.252 0.850 1.00 . A A . 9 GLY O 1 1
8 2376 1 1 10 TYR C C 12.205 -5.767 1.114 1.00 . A A . 10 TYR C 1 1
8 2377 1 1 10 TYR CA C 13.472 -4.922 1.044 1.00 . A A . 10 TYR CA 1 1
8 2378 1 1 10 TYR CB C 14.706 -5.824 1.101 1.00 . A A . 10 TYR CB 1 1
8 2379 1 1 10 TYR CD1 C 16.672 -4.585 2.087 1.00 . A A . 10 TYR CD1 1 1
8 2380 1 1 10 TYR CD2 C 16.584 -4.856 -0.280 1.00 . A A . 10 TYR CD2 1 1
8 2381 1 1 10 TYR CE1 C 17.866 -3.898 1.968 1.00 . A A . 10 TYR CE1 1 1
8 2382 1 1 10 TYR CE2 C 17.779 -4.171 -0.406 1.00 . A A . 10 TYR CE2 1 1
8 2383 1 1 10 TYR CG C 16.013 -5.075 0.968 1.00 . A A . 10 TYR CG 1 1
8 2384 1 1 10 TYR CZ C 18.415 -3.695 0.720 1.00 . A A . 10 TYR CZ 1 1
8 2385 1 1 10 TYR H H 13.809 -4.227 3.016 1.00 . A A . 10 TYR H 1 1
8 2386 1 1 10 TYR HA H 13.478 -4.380 0.110 1.00 . A A . 10 TYR HA 1 1
8 2387 1 1 10 TYR HB2 H 14.719 -6.344 2.048 1.00 . A A . 10 TYR HB2 1 1
8 2388 1 1 10 TYR HB3 H 14.653 -6.546 0.301 1.00 . A A . 10 TYR HB3 1 1
8 2389 1 1 10 TYR HD1 H 16.240 -4.746 3.064 1.00 . A A . 10 TYR HD1 1 1
8 2390 1 1 10 TYR HD2 H 16.083 -5.232 -1.160 1.00 . A A . 10 TYR HD2 1 1
8 2391 1 1 10 TYR HE1 H 18.364 -3.525 2.851 1.00 . A A . 10 TYR HE1 1 1
8 2392 1 1 10 TYR HE2 H 18.207 -4.012 -1.385 1.00 . A A . 10 TYR HE2 1 1
8 2393 1 1 10 TYR HH H 19.603 -2.261 1.195 1.00 . A A . 10 TYR HH 1 1
8 2394 1 1 10 TYR N N 13.507 -3.945 2.125 1.00 . A A . 10 TYR N 1 1
8 2395 1 1 10 TYR O O 11.929 -6.329 2.195 1.00 . A A . 10 TYR O 1 1
8 2396 1 1 10 TYR OH O 19.603 -3.013 0.598 1.00 . A A . 10 TYR OH 1 1
8 2397 1 1 11 NH2 HN1 H 11.726 -5.388 -0.827 1.00 . A A . 11 NH2 HN1 1 1
8 2398 1 1 11 NH2 HN2 H 10.607 -6.419 0.036 1.00 . A A . 11 NH2 HN2 1 1
8 2399 1 1 11 NH2 N N 11.452 -5.866 0.020 1.00 . A A . 11 NH2 N 1 1
8 2400 2 1 1 ASP C C -0.350 -5.556 -0.786 1.00 . B B . 1 ASP C 1 1
8 2401 2 1 1 ASP CA C -0.395 -6.374 0.499 1.00 . B B . 1 ASP CA 1 1
8 2402 2 1 1 ASP CB C -0.543 -5.445 1.705 1.00 . B B . 1 ASP CB 1 1
8 2403 2 1 1 ASP CG C -0.840 -6.201 2.986 1.00 . B B . 1 ASP CG 1 1
8 2404 2 1 1 ASP H1 H 1.652 -6.565 0.441 1.00 . B B . 1 ASP H1 1 1
8 2405 2 1 1 ASP H2 H 0.788 -7.984 0.012 1.00 . B B . 1 ASP H2 1 1
8 2406 2 1 1 ASP H3 H 0.883 -7.498 1.656 1.00 . B B . 1 ASP H3 1 1
8 2407 2 1 1 ASP HA H -1.241 -7.046 0.461 1.00 . B B . 1 ASP HA 1 1
8 2408 2 1 1 ASP HB2 H 0.376 -4.895 1.841 1.00 . B B . 1 ASP HB2 1 1
8 2409 2 1 1 ASP HB3 H -1.351 -4.750 1.520 1.00 . B B . 1 ASP HB3 1 1
8 2410 2 1 1 ASP N N 0.844 -7.178 0.667 1.00 . B B . 1 ASP N 1 1
8 2411 2 1 1 ASP O O 0.723 -5.190 -1.264 1.00 . B B . 1 ASP O 1 1
8 2412 2 1 1 ASP OD1 O -0.611 -5.636 4.076 1.00 . B B . 1 ASP OD1 1 1
8 2413 2 1 1 ASP OD2 O -1.300 -7.358 2.898 1.00 . B B . 1 ASP OD2 1 1
8 2414 2 1 2 ALA C C -2.360 -3.178 -2.315 1.00 . B B . 2 ALA C 1 1
8 2415 2 1 2 ALA CA C -1.617 -4.485 -2.565 1.00 . B B . 2 ALA CA 1 1
8 2416 2 1 2 ALA CB C -2.310 -5.293 -3.654 1.00 . B B . 2 ALA CB 1 1
8 2417 2 1 2 ALA H H -2.345 -5.584 -0.909 1.00 . B B . 2 ALA H 1 1
8 2418 2 1 2 ALA HA H -0.612 -4.261 -2.896 1.00 . B B . 2 ALA HA 1 1
8 2419 2 1 2 ALA HB1 H -1.629 -5.438 -4.482 1.00 . B B . 2 ALA HB1 1 1
8 2420 2 1 2 ALA HB2 H -3.185 -4.762 -3.998 1.00 . B B . 2 ALA HB2 1 1
8 2421 2 1 2 ALA HB3 H -2.604 -6.253 -3.258 1.00 . B B . 2 ALA HB3 1 1
8 2422 2 1 2 ALA N N -1.522 -5.266 -1.339 1.00 . B B . 2 ALA N 1 1
8 2423 2 1 2 ALA O O -2.915 -2.967 -1.237 1.00 . B B . 2 ALA O 1 1
8 2424 2 1 3 GLU C C -4.459 -1.181 -2.670 1.00 . B B . 3 GLU C 1 1
8 2425 2 1 3 GLU CA C -3.037 -1.012 -3.200 1.00 . B B . 3 GLU CA 1 1
8 2426 2 1 3 GLU CB C -3.066 -0.308 -4.558 1.00 . B B . 3 GLU CB 1 1
8 2427 2 1 3 GLU CD C -2.049 1.925 -3.968 1.00 . B B . 3 GLU CD 1 1
8 2428 2 1 3 GLU CG C -3.280 1.193 -4.463 1.00 . B B . 3 GLU CG 1 1
8 2429 2 1 3 GLU H H -1.904 -2.528 -4.150 1.00 . B B . 3 GLU H 1 1
8 2430 2 1 3 GLU HA H -2.476 -0.407 -2.504 1.00 . B B . 3 GLU HA 1 1
8 2431 2 1 3 GLU HB2 H -2.128 -0.485 -5.062 1.00 . B B . 3 GLU HB2 1 1
8 2432 2 1 3 GLU HB3 H -3.867 -0.727 -5.150 1.00 . B B . 3 GLU HB3 1 1
8 2433 2 1 3 GLU HG2 H -3.533 1.571 -5.442 1.00 . B B . 3 GLU HG2 1 1
8 2434 2 1 3 GLU HG3 H -4.095 1.386 -3.780 1.00 . B B . 3 GLU HG3 1 1
8 2435 2 1 3 GLU N N -2.365 -2.302 -3.316 1.00 . B B . 3 GLU N 1 1
8 2436 2 1 3 GLU O O -4.953 -0.347 -1.912 1.00 . B B . 3 GLU O 1 1
8 2437 2 1 3 GLU OE1 O -1.227 1.296 -3.269 1.00 . B B . 3 GLU OE1 1 1
8 2438 2 1 3 GLU OE2 O -1.905 3.126 -4.281 1.00 . B B . 3 GLU OE2 1 1
8 2439 2 1 4 PHE C C -6.490 -2.940 -1.157 1.00 . B B . 4 PHE C 1 1
8 2440 2 1 4 PHE CA C -6.469 -2.545 -2.629 1.00 . B B . 4 PHE CA 1 1
8 2441 2 1 4 PHE CB C -7.091 -3.655 -3.477 1.00 . B B . 4 PHE CB 1 1
8 2442 2 1 4 PHE CD1 C -6.524 -5.761 -2.237 1.00 . B B . 4 PHE CD1 1 1
8 2443 2 1 4 PHE CD2 C -5.561 -5.420 -4.391 1.00 . B B . 4 PHE CD2 1 1
8 2444 2 1 4 PHE CE1 C -5.870 -6.974 -2.133 1.00 . B B . 4 PHE CE1 1 1
8 2445 2 1 4 PHE CE2 C -4.904 -6.633 -4.293 1.00 . B B . 4 PHE CE2 1 1
8 2446 2 1 4 PHE CG C -6.377 -4.971 -3.366 1.00 . B B . 4 PHE CG 1 1
8 2447 2 1 4 PHE CZ C -5.059 -7.410 -3.161 1.00 . B B . 4 PHE CZ 1 1
8 2448 2 1 4 PHE H H -4.660 -2.898 -3.669 1.00 . B B . 4 PHE H 1 1
8 2449 2 1 4 PHE HA H -7.046 -1.642 -2.754 1.00 . B B . 4 PHE HA 1 1
8 2450 2 1 4 PHE HB2 H -8.113 -3.807 -3.166 1.00 . B B . 4 PHE HB2 1 1
8 2451 2 1 4 PHE HB3 H -7.077 -3.355 -4.515 1.00 . B B . 4 PHE HB3 1 1
8 2452 2 1 4 PHE HD1 H -7.158 -5.421 -1.432 1.00 . B B . 4 PHE HD1 1 1
8 2453 2 1 4 PHE HD2 H -5.438 -4.814 -5.277 1.00 . B B . 4 PHE HD2 1 1
8 2454 2 1 4 PHE HE1 H -5.993 -7.581 -1.248 1.00 . B B . 4 PHE HE1 1 1
8 2455 2 1 4 PHE HE2 H -4.270 -6.971 -5.099 1.00 . B B . 4 PHE HE2 1 1
8 2456 2 1 4 PHE HZ H -4.547 -8.358 -3.083 1.00 . B B . 4 PHE HZ 1 1
8 2457 2 1 4 PHE N N -5.108 -2.267 -3.070 1.00 . B B . 4 PHE N 1 1
8 2458 2 1 4 PHE O O -7.451 -2.657 -0.441 1.00 . B B . 4 PHE O 1 1
8 2459 2 1 5 ARG C C -5.004 -2.836 1.581 1.00 . B B . 5 ARG C 1 1
8 2460 2 1 5 ARG CA C -5.315 -4.021 0.677 1.00 . B B . 5 ARG CA 1 1
8 2461 2 1 5 ARG CB C -4.230 -5.089 0.818 1.00 . B B . 5 ARG CB 1 1
8 2462 2 1 5 ARG CD C -5.091 -7.030 2.163 1.00 . B B . 5 ARG CD 1 1
8 2463 2 1 5 ARG CG C -4.228 -5.778 2.173 1.00 . B B . 5 ARG CG 1 1
8 2464 2 1 5 ARG CZ C -3.505 -8.906 2.370 1.00 . B B . 5 ARG CZ 1 1
8 2465 2 1 5 ARG H H -4.683 -3.782 -1.327 1.00 . B B . 5 ARG H 1 1
8 2466 2 1 5 ARG HA H -6.264 -4.442 0.967 1.00 . B B . 5 ARG HA 1 1
8 2467 2 1 5 ARG HB2 H -4.379 -5.840 0.057 1.00 . B B . 5 ARG HB2 1 1
8 2468 2 1 5 ARG HB3 H -3.265 -4.627 0.673 1.00 . B B . 5 ARG HB3 1 1
8 2469 2 1 5 ARG HD2 H -6.038 -6.803 2.630 1.00 . B B . 5 ARG HD2 1 1
8 2470 2 1 5 ARG HD3 H -5.258 -7.329 1.140 1.00 . B B . 5 ARG HD3 1 1
8 2471 2 1 5 ARG HE H -4.762 -8.306 3.800 1.00 . B B . 5 ARG HE 1 1
8 2472 2 1 5 ARG HG2 H -3.217 -6.052 2.423 1.00 . B B . 5 ARG HG2 1 1
8 2473 2 1 5 ARG HG3 H -4.612 -5.092 2.914 1.00 . B B . 5 ARG HG3 1 1
8 2474 2 1 5 ARG HH11 H -3.455 -7.959 0.583 1.00 . B B . 5 ARG HH11 1 1
8 2475 2 1 5 ARG HH12 H -2.353 -9.283 0.753 1.00 . B B . 5 ARG HH12 1 1
8 2476 2 1 5 ARG HH21 H -3.311 -10.047 4.026 1.00 . B B . 5 ARG HH21 1 1
8 2477 2 1 5 ARG HH22 H -2.270 -10.468 2.706 1.00 . B B . 5 ARG HH22 1 1
8 2478 2 1 5 ARG N N -5.421 -3.591 -0.710 1.00 . B B . 5 ARG N 1 1
8 2479 2 1 5 ARG NE N -4.460 -8.133 2.884 1.00 . B B . 5 ARG NE 1 1
8 2480 2 1 5 ARG NH1 N -3.069 -8.699 1.134 1.00 . B B . 5 ARG NH1 1 1
8 2481 2 1 5 ARG NH2 N -2.987 -9.887 3.093 1.00 . B B . 5 ARG NH2 1 1
8 2482 2 1 5 ARG O O -5.575 -2.698 2.664 1.00 . B B . 5 ARG O 1 1
8 2483 2 1 6 HIS C C -4.849 0.217 1.918 1.00 . B B . 6 HIS C 1 1
8 2484 2 1 6 HIS CA C -3.711 -0.796 1.885 1.00 . B B . 6 HIS CA 1 1
8 2485 2 1 6 HIS CB C -2.476 -0.145 1.264 1.00 . B B . 6 HIS CB 1 1
8 2486 2 1 6 HIS CD2 C -0.865 -1.567 -0.161 1.00 . B B . 6 HIS CD2 1 1
8 2487 2 1 6 HIS CE1 C 0.318 -2.463 1.410 1.00 . B B . 6 HIS CE1 1 1
8 2488 2 1 6 HIS CG C -1.352 -1.097 1.011 1.00 . B B . 6 HIS CG 1 1
8 2489 2 1 6 HIS H H -3.684 -2.144 0.250 1.00 . B B . 6 HIS H 1 1
8 2490 2 1 6 HIS HA H -3.481 -1.103 2.894 1.00 . B B . 6 HIS HA 1 1
8 2491 2 1 6 HIS HB2 H -2.752 0.296 0.317 1.00 . B B . 6 HIS HB2 1 1
8 2492 2 1 6 HIS HB3 H -2.116 0.631 1.925 1.00 . B B . 6 HIS HB3 1 1
8 2493 2 1 6 HIS HD1 H -0.694 -1.536 2.966 1.00 . B B . 6 HIS HD1 1 1
8 2494 2 1 6 HIS HD2 H -1.227 -1.312 -1.146 1.00 . B B . 6 HIS HD2 1 1
8 2495 2 1 6 HIS HE1 H 1.062 -3.045 1.938 1.00 . B B . 6 HIS HE1 1 1
8 2496 2 1 6 HIS N N -4.098 -1.978 1.124 1.00 . B B . 6 HIS N 1 1
8 2497 2 1 6 HIS ND1 N -0.590 -1.675 2.002 1.00 . B B . 6 HIS ND1 1 1
8 2498 2 1 6 HIS NE2 N 0.192 -2.434 0.099 1.00 . B B . 6 HIS NE2 1 1
8 2499 2 1 6 HIS O O -5.120 0.834 2.947 1.00 . B B . 6 HIS O 1 1
8 2500 2 1 7 HIS C C -7.941 0.623 0.936 1.00 . B B . 7 HIS C 1 1
8 2501 2 1 7 HIS CA C -6.612 1.316 0.654 1.00 . B B . 7 HIS CA 1 1
8 2502 2 1 7 HIS CB C -6.626 1.929 -0.748 1.00 . B B . 7 HIS CB 1 1
8 2503 2 1 7 HIS CD2 C -4.108 2.311 -1.244 1.00 . B B . 7 HIS CD2 1 1
8 2504 2 1 7 HIS CE1 C -4.126 4.457 -1.523 1.00 . B B . 7 HIS CE1 1 1
8 2505 2 1 7 HIS CG C -5.393 2.720 -1.069 1.00 . B B . 7 HIS CG 1 1
8 2506 2 1 7 HIS H H -5.234 -0.142 -0.006 1.00 . B B . 7 HIS H 1 1
8 2507 2 1 7 HIS HA H -6.466 2.101 1.379 1.00 . B B . 7 HIS HA 1 1
8 2508 2 1 7 HIS HB2 H -6.712 1.140 -1.478 1.00 . B B . 7 HIS HB2 1 1
8 2509 2 1 7 HIS HB3 H -7.477 2.589 -0.836 1.00 . B B . 7 HIS HB3 1 1
8 2510 2 1 7 HIS HD1 H -6.161 4.681 -1.189 1.00 . B B . 7 HIS HD1 1 1
8 2511 2 1 7 HIS HD2 H -3.747 1.296 -1.171 1.00 . B B . 7 HIS HD2 1 1
8 2512 2 1 7 HIS HE1 H -3.817 5.474 -1.712 1.00 . B B . 7 HIS HE1 1 1
8 2513 2 1 7 HIS N N -5.505 0.380 0.777 1.00 . B B . 7 HIS N 1 1
8 2514 2 1 7 HIS ND1 N -5.383 4.086 -1.251 1.00 . B B . 7 HIS ND1 1 1
8 2515 2 1 7 HIS NE2 N -3.312 3.417 -1.532 1.00 . B B . 7 HIS NE2 1 1
8 2516 2 1 7 HIS O O -8.058 -0.594 0.799 1.00 . B B . 7 HIS O 1 1
8 2517 2 1 8 SER C C -11.186 0.985 0.435 1.00 . B B . 8 SER C 1 1
8 2518 2 1 8 SER CA C -10.256 0.864 1.639 1.00 . B B . 8 SER CA 1 1
8 2519 2 1 8 SER CB C -10.863 1.589 2.841 1.00 . B B . 8 SER CB 1 1
8 2520 2 1 8 SER H H -8.781 2.367 1.426 1.00 . B B . 8 SER H 1 1
8 2521 2 1 8 SER HA H -10.138 -0.181 1.882 1.00 . B B . 8 SER HA 1 1
8 2522 2 1 8 SER HB2 H -10.117 1.687 3.615 1.00 . B B . 8 SER HB2 1 1
8 2523 2 1 8 SER HB3 H -11.196 2.571 2.536 1.00 . B B . 8 SER HB3 1 1
8 2524 2 1 8 SER HG H -12.752 1.066 2.841 1.00 . B B . 8 SER HG 1 1
8 2525 2 1 8 SER N N -8.937 1.404 1.334 1.00 . B B . 8 SER N 1 1
8 2526 2 1 8 SER O O -11.419 2.080 -0.075 1.00 . B B . 8 SER O 1 1
8 2527 2 1 8 SER OG O -11.969 0.874 3.363 1.00 . B B . 8 SER OG 1 1
8 2528 2 1 9 GLY C C -13.329 -1.475 -1.326 1.00 . B B . 9 GLY C 1 1
8 2529 2 1 9 GLY CA C -12.614 -0.151 -1.152 1.00 . B B . 9 GLY CA 1 1
8 2530 2 1 9 GLY H H -11.494 -0.993 0.435 1.00 . B B . 9 GLY H 1 1
8 2531 2 1 9 GLY HA2 H -13.349 0.629 -1.016 1.00 . B B . 9 GLY HA2 1 1
8 2532 2 1 9 GLY HA3 H -12.043 0.059 -2.046 1.00 . B B . 9 GLY HA3 1 1
8 2533 2 1 9 GLY N N -11.716 -0.150 -0.012 1.00 . B B . 9 GLY N 1 1
8 2534 2 1 9 GLY O O -12.753 -2.438 -1.831 1.00 . B B . 9 GLY O 1 1
8 2535 2 1 10 TYR C C -15.901 -2.925 -2.442 1.00 . B B . 10 TYR C 1 1
8 2536 2 1 10 TYR CA C -15.385 -2.741 -1.017 1.00 . B B . 10 TYR CA 1 1
8 2537 2 1 10 TYR CB C -16.561 -2.699 -0.040 1.00 . B B . 10 TYR CB 1 1
8 2538 2 1 10 TYR CD1 C -17.334 -0.322 0.322 1.00 . B B . 10 TYR CD1 1 1
8 2539 2 1 10 TYR CD2 C -18.606 -1.708 -1.142 1.00 . B B . 10 TYR CD2 1 1
8 2540 2 1 10 TYR CE1 C -18.207 0.726 0.095 1.00 . B B . 10 TYR CE1 1 1
8 2541 2 1 10 TYR CE2 C -19.481 -0.666 -1.375 1.00 . B B . 10 TYR CE2 1 1
8 2542 2 1 10 TYR CG C -17.518 -1.554 -0.291 1.00 . B B . 10 TYR CG 1 1
8 2543 2 1 10 TYR CZ C -19.279 0.549 -0.754 1.00 . B B . 10 TYR CZ 1 1
8 2544 2 1 10 TYR H H -14.994 -0.723 -0.511 1.00 . B B . 10 TYR H 1 1
8 2545 2 1 10 TYR HA H -14.749 -3.577 -0.767 1.00 . B B . 10 TYR HA 1 1
8 2546 2 1 10 TYR HB2 H -17.118 -3.619 -0.116 1.00 . B B . 10 TYR HB2 1 1
8 2547 2 1 10 TYR HB3 H -16.178 -2.597 0.967 1.00 . B B . 10 TYR HB3 1 1
8 2548 2 1 10 TYR HD1 H -16.493 -0.186 0.986 1.00 . B B . 10 TYR HD1 1 1
8 2549 2 1 10 TYR HD2 H -18.762 -2.660 -1.627 1.00 . B B . 10 TYR HD2 1 1
8 2550 2 1 10 TYR HE1 H -18.046 1.677 0.582 1.00 . B B . 10 TYR HE1 1 1
8 2551 2 1 10 TYR HE2 H -20.321 -0.805 -2.039 1.00 . B B . 10 TYR HE2 1 1
8 2552 2 1 10 TYR HH H -19.859 2.087 -1.750 1.00 . B B . 10 TYR HH 1 1
8 2553 2 1 10 TYR N N -14.589 -1.524 -0.906 1.00 . B B . 10 TYR N 1 1
8 2554 2 1 10 TYR O O -16.001 -4.087 -2.889 1.00 . B B . 10 TYR O 1 1
8 2555 2 1 10 TYR OH O -20.148 1.589 -0.982 1.00 . B B . 10 TYR OH 1 1
8 2556 2 1 11 NH2 HN1 H -16.116 -0.923 -2.728 1.00 . B B . 11 NH2 HN1 1 1
8 2557 2 1 11 NH2 HN2 H -16.562 -1.929 -4.088 1.00 . B B . 11 NH2 HN2 1 1
8 2558 2 1 11 NH2 N N -16.219 -1.838 -3.142 1.00 . B B . 11 NH2 N 1 1
8 2559 3 2 1 ZN ZN ZN 1.593 -3.352 -1.104 1.00 . C A . 101 ZN ZN 1 1
8 2560 4 2 1 ZN ZN ZN -1.442 2.892 -2.142 1.00 . D A . 102 ZN ZN 1 1
9 2561 1 1 1 ASP C C 0.585 5.173 -2.026 1.00 . A A . 1 ASP C 1 1
9 2562 1 1 1 ASP CA C 0.555 6.322 -1.024 1.00 . A A . 1 ASP CA 1 1
9 2563 1 1 1 ASP CB C 0.542 5.776 0.405 1.00 . A A . 1 ASP CB 1 1
9 2564 1 1 1 ASP CG C 0.578 6.879 1.445 1.00 . A A . 1 ASP CG 1 1
9 2565 1 1 1 ASP H1 H -1.464 6.661 -0.811 1.00 . A A . 1 ASP H1 1 1
9 2566 1 1 1 ASP H2 H -0.775 7.316 -2.240 1.00 . A A . 1 ASP H2 1 1
9 2567 1 1 1 ASP H3 H -0.489 8.070 -0.725 1.00 . A A . 1 ASP H3 1 1
9 2568 1 1 1 ASP HA H 1.432 6.936 -1.163 1.00 . A A . 1 ASP HA 1 1
9 2569 1 1 1 ASP HB2 H -0.357 5.196 0.556 1.00 . A A . 1 ASP HB2 1 1
9 2570 1 1 1 ASP HB3 H 1.405 5.141 0.551 1.00 . A A . 1 ASP HB3 1 1
9 2571 1 1 1 ASP N N -0.652 7.168 -1.217 1.00 . A A . 1 ASP N 1 1
9 2572 1 1 1 ASP O O -0.457 4.726 -2.503 1.00 . A A . 1 ASP O 1 1
9 2573 1 1 1 ASP OD1 O 0.187 6.618 2.603 1.00 . A A . 1 ASP OD1 1 1
9 2574 1 1 1 ASP OD2 O 0.997 8.005 1.103 1.00 . A A . 1 ASP OD2 1 1
9 2575 1 1 2 ALA C C 2.635 2.410 -2.625 1.00 . A A . 2 ALA C 1 1
9 2576 1 1 2 ALA CA C 1.952 3.602 -3.284 1.00 . A A . 2 ALA CA 1 1
9 2577 1 1 2 ALA CB C 2.751 4.062 -4.493 1.00 . A A . 2 ALA CB 1 1
9 2578 1 1 2 ALA H H 2.581 5.097 -1.927 1.00 . A A . 2 ALA H 1 1
9 2579 1 1 2 ALA HA H 0.972 3.298 -3.625 1.00 . A A . 2 ALA HA 1 1
9 2580 1 1 2 ALA HB1 H 3.729 4.386 -4.173 1.00 . A A . 2 ALA HB1 1 1
9 2581 1 1 2 ALA HB2 H 2.238 4.883 -4.972 1.00 . A A . 2 ALA HB2 1 1
9 2582 1 1 2 ALA HB3 H 2.853 3.245 -5.190 1.00 . A A . 2 ALA HB3 1 1
9 2583 1 1 2 ALA N N 1.787 4.699 -2.340 1.00 . A A . 2 ALA N 1 1
9 2584 1 1 2 ALA O O 2.939 2.435 -1.432 1.00 . A A . 2 ALA O 1 1
9 2585 1 1 3 GLU C C 4.846 0.478 -2.243 1.00 . A A . 3 GLU C 1 1
9 2586 1 1 3 GLU CA C 3.513 0.158 -2.913 1.00 . A A . 3 GLU CA 1 1
9 2587 1 1 3 GLU CB C 3.725 -0.836 -4.057 1.00 . A A . 3 GLU CB 1 1
9 2588 1 1 3 GLU CD C 2.606 -2.883 -3.090 1.00 . A A . 3 GLU CD 1 1
9 2589 1 1 3 GLU CG C 3.900 -2.274 -3.592 1.00 . A A . 3 GLU CG 1 1
9 2590 1 1 3 GLU H H 2.600 1.414 -4.352 1.00 . A A . 3 GLU H 1 1
9 2591 1 1 3 GLU HA H 2.855 -0.287 -2.181 1.00 . A A . 3 GLU HA 1 1
9 2592 1 1 3 GLU HB2 H 2.873 -0.796 -4.717 1.00 . A A . 3 GLU HB2 1 1
9 2593 1 1 3 GLU HB3 H 4.609 -0.550 -4.607 1.00 . A A . 3 GLU HB3 1 1
9 2594 1 1 3 GLU HG2 H 4.258 -2.866 -4.420 1.00 . A A . 3 GLU HG2 1 1
9 2595 1 1 3 GLU HG3 H 4.625 -2.295 -2.793 1.00 . A A . 3 GLU HG3 1 1
9 2596 1 1 3 GLU N N 2.870 1.369 -3.412 1.00 . A A . 3 GLU N 1 1
9 2597 1 1 3 GLU O O 5.268 -0.216 -1.319 1.00 . A A . 3 GLU O 1 1
9 2598 1 1 3 GLU OE1 O 1.736 -2.120 -2.622 1.00 . A A . 3 GLU OE1 1 1
9 2599 1 1 3 GLU OE2 O 2.462 -4.121 -3.170 1.00 . A A . 3 GLU OE2 1 1
9 2600 1 1 4 PHE C C 6.595 2.676 -0.825 1.00 . A A . 4 PHE C 1 1
9 2601 1 1 4 PHE CA C 6.791 1.924 -2.138 1.00 . A A . 4 PHE CA 1 1
9 2602 1 1 4 PHE CB C 7.583 2.783 -3.130 1.00 . A A . 4 PHE CB 1 1
9 2603 1 1 4 PHE CD1 C 7.280 5.176 -2.434 1.00 . A A . 4 PHE CD1 1 1
9 2604 1 1 4 PHE CD2 C 6.230 4.441 -4.445 1.00 . A A . 4 PHE CD2 1 1
9 2605 1 1 4 PHE CE1 C 6.769 6.445 -2.626 1.00 . A A . 4 PHE CE1 1 1
9 2606 1 1 4 PHE CE2 C 5.716 5.710 -4.642 1.00 . A A . 4 PHE CE2 1 1
9 2607 1 1 4 PHE CG C 7.016 4.161 -3.339 1.00 . A A . 4 PHE CG 1 1
9 2608 1 1 4 PHE CZ C 5.986 6.712 -3.732 1.00 . A A . 4 PHE CZ 1 1
9 2609 1 1 4 PHE H H 5.128 2.050 -3.445 1.00 . A A . 4 PHE H 1 1
9 2610 1 1 4 PHE HA H 7.348 1.022 -1.936 1.00 . A A . 4 PHE HA 1 1
9 2611 1 1 4 PHE HB2 H 8.594 2.894 -2.768 1.00 . A A . 4 PHE HB2 1 1
9 2612 1 1 4 PHE HB3 H 7.605 2.284 -4.087 1.00 . A A . 4 PHE HB3 1 1
9 2613 1 1 4 PHE HD1 H 7.893 4.969 -1.569 1.00 . A A . 4 PHE HD1 1 1
9 2614 1 1 4 PHE HD2 H 6.016 3.658 -5.156 1.00 . A A . 4 PHE HD2 1 1
9 2615 1 1 4 PHE HE1 H 6.981 7.227 -1.913 1.00 . A A . 4 PHE HE1 1 1
9 2616 1 1 4 PHE HE2 H 5.102 5.915 -5.507 1.00 . A A . 4 PHE HE2 1 1
9 2617 1 1 4 PHE HZ H 5.585 7.704 -3.884 1.00 . A A . 4 PHE HZ 1 1
9 2618 1 1 4 PHE N N 5.509 1.529 -2.708 1.00 . A A . 4 PHE N 1 1
9 2619 1 1 4 PHE O O 7.465 2.662 0.045 1.00 . A A . 4 PHE O 1 1
9 2620 1 1 5 ARG C C 4.597 3.182 1.619 1.00 . A A . 5 ARG C 1 1
9 2621 1 1 5 ARG CA C 5.138 4.090 0.520 1.00 . A A . 5 ARG CA 1 1
9 2622 1 1 5 ARG CB C 4.124 5.190 0.208 1.00 . A A . 5 ARG CB 1 1
9 2623 1 1 5 ARG CD C 3.900 7.558 1.022 1.00 . A A . 5 ARG CD 1 1
9 2624 1 1 5 ARG CG C 3.816 6.087 1.396 1.00 . A A . 5 ARG CG 1 1
9 2625 1 1 5 ARG CZ C 5.926 8.805 0.350 1.00 . A A . 5 ARG CZ 1 1
9 2626 1 1 5 ARG H H 4.790 3.307 -1.416 1.00 . A A . 5 ARG H 1 1
9 2627 1 1 5 ARG HA H 6.054 4.545 0.866 1.00 . A A . 5 ARG HA 1 1
9 2628 1 1 5 ARG HB2 H 4.513 5.806 -0.592 1.00 . A A . 5 ARG HB2 1 1
9 2629 1 1 5 ARG HB3 H 3.203 4.732 -0.117 1.00 . A A . 5 ARG HB3 1 1
9 2630 1 1 5 ARG HD2 H 3.647 7.663 -0.021 1.00 . A A . 5 ARG HD2 1 1
9 2631 1 1 5 ARG HD3 H 3.190 8.110 1.621 1.00 . A A . 5 ARG HD3 1 1
9 2632 1 1 5 ARG HE H 5.653 7.924 2.121 1.00 . A A . 5 ARG HE 1 1
9 2633 1 1 5 ARG HG2 H 2.819 5.871 1.748 1.00 . A A . 5 ARG HG2 1 1
9 2634 1 1 5 ARG HG3 H 4.529 5.883 2.182 1.00 . A A . 5 ARG HG3 1 1
9 2635 1 1 5 ARG HH11 H 4.486 8.764 -1.070 1.00 . A A . 5 ARG HH11 1 1
9 2636 1 1 5 ARG HH12 H 5.931 9.611 -1.502 1.00 . A A . 5 ARG HH12 1 1
9 2637 1 1 5 ARG HH21 H 7.542 9.039 1.542 1.00 . A A . 5 ARG HH21 1 1
9 2638 1 1 5 ARG HH22 H 7.663 9.768 -0.025 1.00 . A A . 5 ARG HH22 1 1
9 2639 1 1 5 ARG N N 5.446 3.333 -0.688 1.00 . A A . 5 ARG N 1 1
9 2640 1 1 5 ARG NE N 5.238 8.100 1.250 1.00 . A A . 5 ARG NE 1 1
9 2641 1 1 5 ARG NH1 N 5.404 9.082 -0.838 1.00 . A A . 5 ARG NH1 1 1
9 2642 1 1 5 ARG NH2 N 7.143 9.240 0.648 1.00 . A A . 5 ARG NH2 1 1
9 2643 1 1 5 ARG O O 4.934 3.342 2.791 1.00 . A A . 5 ARG O 1 1
9 2644 1 1 6 HIS C C 4.230 0.361 2.751 1.00 . A A . 6 HIS C 1 1
9 2645 1 1 6 HIS CA C 3.168 1.295 2.190 1.00 . A A . 6 HIS CA 1 1
9 2646 1 1 6 HIS CB C 2.066 0.469 1.527 1.00 . A A . 6 HIS CB 1 1
9 2647 1 1 6 HIS CD2 C 0.648 1.396 -0.419 1.00 . A A . 6 HIS CD2 1 1
9 2648 1 1 6 HIS CE1 C -0.652 2.724 0.684 1.00 . A A . 6 HIS CE1 1 1
9 2649 1 1 6 HIS CG C 1.002 1.296 0.885 1.00 . A A . 6 HIS CG 1 1
9 2650 1 1 6 HIS H H 3.527 2.150 0.282 1.00 . A A . 6 HIS H 1 1
9 2651 1 1 6 HIS HA H 2.743 1.869 2.998 1.00 . A A . 6 HIS HA 1 1
9 2652 1 1 6 HIS HB2 H 2.506 -0.155 0.764 1.00 . A A . 6 HIS HB2 1 1
9 2653 1 1 6 HIS HB3 H 1.599 -0.157 2.273 1.00 . A A . 6 HIS HB3 1 1
9 2654 1 1 6 HIS HD1 H 0.169 2.301 2.541 1.00 . A A . 6 HIS HD1 1 1
9 2655 1 1 6 HIS HD2 H 1.100 0.857 -1.240 1.00 . A A . 6 HIS HD2 1 1
9 2656 1 1 6 HIS HE1 H -1.420 3.442 0.937 1.00 . A A . 6 HIS HE1 1 1
9 2657 1 1 6 HIS N N 3.756 2.228 1.232 1.00 . A A . 6 HIS N 1 1
9 2658 1 1 6 HIS ND1 N 0.166 2.147 1.572 1.00 . A A . 6 HIS ND1 1 1
9 2659 1 1 6 HIS NE2 N -0.400 2.304 -0.539 1.00 . A A . 6 HIS NE2 1 1
9 2660 1 1 6 HIS O O 4.229 0.041 3.939 1.00 . A A . 6 HIS O 1 1
9 2661 1 1 7 HIS C C 7.471 -0.207 2.600 1.00 . A A . 7 HIS C 1 1
9 2662 1 1 7 HIS CA C 6.196 -0.981 2.275 1.00 . A A . 7 HIS CA 1 1
9 2663 1 1 7 HIS CB C 6.461 -1.988 1.156 1.00 . A A . 7 HIS CB 1 1
9 2664 1 1 7 HIS CD2 C 4.172 -2.537 0.064 1.00 . A A . 7 HIS CD2 1 1
9 2665 1 1 7 HIS CE1 C 3.943 -4.580 0.731 1.00 . A A . 7 HIS CE1 1 1
9 2666 1 1 7 HIS CG C 5.271 -2.830 0.812 1.00 . A A . 7 HIS CG 1 1
9 2667 1 1 7 HIS H H 5.067 0.214 0.947 1.00 . A A . 7 HIS H 1 1
9 2668 1 1 7 HIS HA H 5.875 -1.512 3.158 1.00 . A A . 7 HIS HA 1 1
9 2669 1 1 7 HIS HB2 H 6.760 -1.456 0.266 1.00 . A A . 7 HIS HB2 1 1
9 2670 1 1 7 HIS HB3 H 7.261 -2.650 1.460 1.00 . A A . 7 HIS HB3 1 1
9 2671 1 1 7 HIS HD1 H 5.727 -4.642 1.791 1.00 . A A . 7 HIS HD1 1 1
9 2672 1 1 7 HIS HD2 H 3.954 -1.587 -0.404 1.00 . A A . 7 HIS HD2 1 1
9 2673 1 1 7 HIS HE1 H 3.547 -5.569 0.904 1.00 . A A . 7 HIS HE1 1 1
9 2674 1 1 7 HIS N N 5.127 -0.076 1.881 1.00 . A A . 7 HIS N 1 1
9 2675 1 1 7 HIS ND1 N 5.105 -4.132 1.230 1.00 . A A . 7 HIS ND1 1 1
9 2676 1 1 7 HIS NE2 N 3.342 -3.652 0.016 1.00 . A A . 7 HIS NE2 1 1
9 2677 1 1 7 HIS O O 8.030 0.474 1.742 1.00 . A A . 7 HIS O 1 1
9 2678 1 1 8 SER C C 10.246 -0.618 4.580 1.00 . A A . 8 SER C 1 1
9 2679 1 1 8 SER CA C 9.126 0.375 4.287 1.00 . A A . 8 SER CA 1 1
9 2680 1 1 8 SER CB C 8.832 1.212 5.533 1.00 . A A . 8 SER CB 1 1
9 2681 1 1 8 SER H H 7.429 -0.873 4.484 1.00 . A A . 8 SER H 1 1
9 2682 1 1 8 SER HA H 9.443 1.030 3.490 1.00 . A A . 8 SER HA 1 1
9 2683 1 1 8 SER HB2 H 8.420 0.576 6.302 1.00 . A A . 8 SER HB2 1 1
9 2684 1 1 8 SER HB3 H 9.750 1.658 5.889 1.00 . A A . 8 SER HB3 1 1
9 2685 1 1 8 SER HG H 7.739 2.756 6.044 1.00 . A A . 8 SER HG 1 1
9 2686 1 1 8 SER N N 7.921 -0.316 3.846 1.00 . A A . 8 SER N 1 1
9 2687 1 1 8 SER O O 9.994 -1.745 5.008 1.00 . A A . 8 SER O 1 1
9 2688 1 1 8 SER OG O 7.904 2.244 5.247 1.00 . A A . 8 SER OG 1 1
9 2689 1 1 9 GLY C C 13.410 -1.343 3.330 1.00 . A A . 9 GLY C 1 1
9 2690 1 1 9 GLY CA C 12.624 -1.053 4.594 1.00 . A A . 9 GLY CA 1 1
9 2691 1 1 9 GLY H H 11.622 0.718 4.009 1.00 . A A . 9 GLY H 1 1
9 2692 1 1 9 GLY HA2 H 13.277 -0.573 5.309 1.00 . A A . 9 GLY HA2 1 1
9 2693 1 1 9 GLY HA3 H 12.275 -1.986 5.010 1.00 . A A . 9 GLY HA3 1 1
9 2694 1 1 9 GLY N N 11.483 -0.191 4.349 1.00 . A A . 9 GLY N 1 1
9 2695 1 1 9 GLY O O 13.871 -2.464 3.121 1.00 . A A . 9 GLY O 1 1
9 2696 1 1 10 TYR C C 13.682 -1.569 0.367 1.00 . A A . 10 TYR C 1 1
9 2697 1 1 10 TYR CA C 14.299 -0.477 1.234 1.00 . A A . 10 TYR CA 1 1
9 2698 1 1 10 TYR CB C 15.767 -0.801 1.519 1.00 . A A . 10 TYR CB 1 1
9 2699 1 1 10 TYR CD1 C 16.139 0.721 3.498 1.00 . A A . 10 TYR CD1 1 1
9 2700 1 1 10 TYR CD2 C 17.575 0.958 1.611 1.00 . A A . 10 TYR CD2 1 1
9 2701 1 1 10 TYR CE1 C 16.812 1.739 4.145 1.00 . A A . 10 TYR CE1 1 1
9 2702 1 1 10 TYR CE2 C 18.254 1.977 2.251 1.00 . A A . 10 TYR CE2 1 1
9 2703 1 1 10 TYR CG C 16.507 0.313 2.222 1.00 . A A . 10 TYR CG 1 1
9 2704 1 1 10 TYR CZ C 17.869 2.364 3.517 1.00 . A A . 10 TYR CZ 1 1
9 2705 1 1 10 TYR H H 13.173 0.543 2.709 1.00 . A A . 10 TYR H 1 1
9 2706 1 1 10 TYR HA H 14.244 0.462 0.705 1.00 . A A . 10 TYR HA 1 1
9 2707 1 1 10 TYR HB2 H 15.819 -1.681 2.145 1.00 . A A . 10 TYR HB2 1 1
9 2708 1 1 10 TYR HB3 H 16.272 -1.000 0.586 1.00 . A A . 10 TYR HB3 1 1
9 2709 1 1 10 TYR HD1 H 15.310 0.229 3.988 1.00 . A A . 10 TYR HD1 1 1
9 2710 1 1 10 TYR HD2 H 17.873 0.654 0.618 1.00 . A A . 10 TYR HD2 1 1
9 2711 1 1 10 TYR HE1 H 16.511 2.042 5.136 1.00 . A A . 10 TYR HE1 1 1
9 2712 1 1 10 TYR HE2 H 19.082 2.466 1.758 1.00 . A A . 10 TYR HE2 1 1
9 2713 1 1 10 TYR HH H 18.469 4.186 3.644 1.00 . A A . 10 TYR HH 1 1
9 2714 1 1 10 TYR N N 13.564 -0.327 2.486 1.00 . A A . 10 TYR N 1 1
9 2715 1 1 10 TYR O O 12.902 -1.228 -0.546 1.00 . A A . 10 TYR O 1 1
9 2716 1 1 10 TYR OH O 18.543 3.378 4.158 1.00 . A A . 10 TYR OH 1 1
9 2717 1 1 11 NH2 HN1 H 14.645 -3.051 1.374 1.00 . A A . 11 NH2 HN1 1 1
9 2718 1 1 11 NH2 HN2 H 13.614 -3.580 0.063 1.00 . A A . 11 NH2 HN2 1 1
9 2719 1 1 11 NH2 N N 14.007 -2.835 0.622 1.00 . A A . 11 NH2 N 1 1
9 2720 2 1 1 ASP C C -0.296 -5.654 -0.829 1.00 . B B . 1 ASP C 1 1
9 2721 2 1 1 ASP CA C -0.375 -6.578 0.380 1.00 . B B . 1 ASP CA 1 1
9 2722 2 1 1 ASP CB C -0.848 -5.798 1.607 1.00 . B B . 1 ASP CB 1 1
9 2723 2 1 1 ASP CG C -1.417 -6.700 2.685 1.00 . B B . 1 ASP CG 1 1
9 2724 2 1 1 ASP H1 H 1.269 -7.686 -0.169 1.00 . B B . 1 ASP H1 1 1
9 2725 2 1 1 ASP H2 H 0.821 -7.839 1.481 1.00 . B B . 1 ASP H2 1 1
9 2726 2 1 1 ASP H3 H 1.601 -6.413 0.929 1.00 . B B . 1 ASP H3 1 1
9 2727 2 1 1 ASP HA H -1.076 -7.371 0.172 1.00 . B B . 1 ASP HA 1 1
9 2728 2 1 1 ASP HB2 H -0.013 -5.255 2.024 1.00 . B B . 1 ASP HB2 1 1
9 2729 2 1 1 ASP HB3 H -1.612 -5.097 1.307 1.00 . B B . 1 ASP HB3 1 1
9 2730 2 1 1 ASP N N 0.947 -7.184 0.683 1.00 . B B . 1 ASP N 1 1
9 2731 2 1 1 ASP O O 0.784 -5.201 -1.206 1.00 . B B . 1 ASP O 1 1
9 2732 2 1 1 ASP OD1 O -1.619 -6.217 3.819 1.00 . B B . 1 ASP OD1 1 1
9 2733 2 1 1 ASP OD2 O -1.664 -7.890 2.395 1.00 . B B . 1 ASP OD2 1 1
9 2734 2 1 2 ALA C C -2.232 -3.204 -2.281 1.00 . B B . 2 ALA C 1 1
9 2735 2 1 2 ALA CA C -1.513 -4.509 -2.602 1.00 . B B . 2 ALA CA 1 1
9 2736 2 1 2 ALA CB C -2.206 -5.224 -3.750 1.00 . B B . 2 ALA CB 1 1
9 2737 2 1 2 ALA H H -2.274 -5.770 -1.085 1.00 . B B . 2 ALA H 1 1
9 2738 2 1 2 ALA HA H -0.501 -4.283 -2.908 1.00 . B B . 2 ALA HA 1 1
9 2739 2 1 2 ALA HB1 H -3.127 -4.712 -3.991 1.00 . B B . 2 ALA HB1 1 1
9 2740 2 1 2 ALA HB2 H -2.426 -6.242 -3.460 1.00 . B B . 2 ALA HB2 1 1
9 2741 2 1 2 ALA HB3 H -1.560 -5.228 -4.615 1.00 . B B . 2 ALA HB3 1 1
9 2742 2 1 2 ALA N N -1.447 -5.378 -1.433 1.00 . B B . 2 ALA N 1 1
9 2743 2 1 2 ALA O O -2.692 -2.994 -1.159 1.00 . B B . 2 ALA O 1 1
9 2744 2 1 3 GLU C C -4.385 -1.200 -2.541 1.00 . B B . 3 GLU C 1 1
9 2745 2 1 3 GLU CA C -2.981 -1.039 -3.119 1.00 . B B . 3 GLU CA 1 1
9 2746 2 1 3 GLU CB C -3.052 -0.314 -4.465 1.00 . B B . 3 GLU CB 1 1
9 2747 2 1 3 GLU CD C -2.126 1.979 -3.956 1.00 . B B . 3 GLU CD 1 1
9 2748 2 1 3 GLU CG C -3.349 1.172 -4.343 1.00 . B B . 3 GLU CG 1 1
9 2749 2 1 3 GLU H H -1.934 -2.564 -4.149 1.00 . B B . 3 GLU H 1 1
9 2750 2 1 3 GLU HA H -2.389 -0.450 -2.435 1.00 . B B . 3 GLU HA 1 1
9 2751 2 1 3 GLU HB2 H -2.107 -0.430 -4.974 1.00 . B B . 3 GLU HB2 1 1
9 2752 2 1 3 GLU HB3 H -3.829 -0.767 -5.062 1.00 . B B . 3 GLU HB3 1 1
9 2753 2 1 3 GLU HG2 H -3.711 1.534 -5.293 1.00 . B B . 3 GLU HG2 1 1
9 2754 2 1 3 GLU HG3 H -4.110 1.315 -3.591 1.00 . B B . 3 GLU HG3 1 1
9 2755 2 1 3 GLU N N -2.323 -2.333 -3.280 1.00 . B B . 3 GLU N 1 1
9 2756 2 1 3 GLU O O -4.831 -0.382 -1.738 1.00 . B B . 3 GLU O 1 1
9 2757 2 1 3 GLU OE1 O -1.195 1.393 -3.367 1.00 . B B . 3 GLU OE1 1 1
9 2758 2 1 3 GLU OE2 O -2.097 3.192 -4.246 1.00 . B B . 3 GLU OE2 1 1
9 2759 2 1 4 PHE C C -6.396 -2.923 -0.994 1.00 . B B . 4 PHE C 1 1
9 2760 2 1 4 PHE CA C -6.426 -2.512 -2.462 1.00 . B B . 4 PHE CA 1 1
9 2761 2 1 4 PHE CB C -7.115 -3.586 -3.306 1.00 . B B . 4 PHE CB 1 1
9 2762 2 1 4 PHE CD1 C -6.947 -5.838 -2.215 1.00 . B B . 4 PHE CD1 1 1
9 2763 2 1 4 PHE CD2 C -5.489 -5.351 -4.037 1.00 . B B . 4 PHE CD2 1 1
9 2764 2 1 4 PHE CE1 C -6.390 -7.098 -2.103 1.00 . B B . 4 PHE CE1 1 1
9 2765 2 1 4 PHE CE2 C -4.928 -6.608 -3.930 1.00 . B B . 4 PHE CE2 1 1
9 2766 2 1 4 PHE CG C -6.504 -4.951 -3.182 1.00 . B B . 4 PHE CG 1 1
9 2767 2 1 4 PHE CZ C -5.379 -7.484 -2.961 1.00 . B B . 4 PHE CZ 1 1
9 2768 2 1 4 PHE H H -4.669 -2.878 -3.587 1.00 . B B . 4 PHE H 1 1
9 2769 2 1 4 PHE HA H -6.981 -1.590 -2.548 1.00 . B B . 4 PHE HA 1 1
9 2770 2 1 4 PHE HB2 H -8.149 -3.660 -3.004 1.00 . B B . 4 PHE HB2 1 1
9 2771 2 1 4 PHE HB3 H -7.072 -3.295 -4.346 1.00 . B B . 4 PHE HB3 1 1
9 2772 2 1 4 PHE HD1 H -7.737 -5.537 -1.543 1.00 . B B . 4 PHE HD1 1 1
9 2773 2 1 4 PHE HD2 H -5.137 -4.667 -4.795 1.00 . B B . 4 PHE HD2 1 1
9 2774 2 1 4 PHE HE1 H -6.745 -7.780 -1.344 1.00 . B B . 4 PHE HE1 1 1
9 2775 2 1 4 PHE HE2 H -4.138 -6.907 -4.602 1.00 . B B . 4 PHE HE2 1 1
9 2776 2 1 4 PHE HZ H -4.944 -8.468 -2.875 1.00 . B B . 4 PHE HZ 1 1
9 2777 2 1 4 PHE N N -5.076 -2.257 -2.950 1.00 . B B . 4 PHE N 1 1
9 2778 2 1 4 PHE O O -7.333 -2.650 -0.244 1.00 . B B . 4 PHE O 1 1
9 2779 2 1 5 ARG C C -4.873 -2.791 1.690 1.00 . B B . 5 ARG C 1 1
9 2780 2 1 5 ARG CA C -5.153 -3.994 0.801 1.00 . B B . 5 ARG CA 1 1
9 2781 2 1 5 ARG CB C -4.007 -4.995 0.935 1.00 . B B . 5 ARG CB 1 1
9 2782 2 1 5 ARG CD C -5.365 -7.110 0.958 1.00 . B B . 5 ARG CD 1 1
9 2783 2 1 5 ARG CG C -4.263 -6.329 0.259 1.00 . B B . 5 ARG CG 1 1
9 2784 2 1 5 ARG CZ C -6.359 -9.365 0.892 1.00 . B B . 5 ARG CZ 1 1
9 2785 2 1 5 ARG H H -4.583 -3.744 -1.224 1.00 . B B . 5 ARG H 1 1
9 2786 2 1 5 ARG HA H -6.074 -4.459 1.115 1.00 . B B . 5 ARG HA 1 1
9 2787 2 1 5 ARG HB2 H -3.122 -4.562 0.495 1.00 . B B . 5 ARG HB2 1 1
9 2788 2 1 5 ARG HB3 H -3.823 -5.175 1.984 1.00 . B B . 5 ARG HB3 1 1
9 2789 2 1 5 ARG HD2 H -5.156 -7.133 2.018 1.00 . B B . 5 ARG HD2 1 1
9 2790 2 1 5 ARG HD3 H -6.308 -6.611 0.788 1.00 . B B . 5 ARG HD3 1 1
9 2791 2 1 5 ARG HE H -4.814 -8.763 -0.217 1.00 . B B . 5 ARG HE 1 1
9 2792 2 1 5 ARG HG2 H -4.551 -6.151 -0.763 1.00 . B B . 5 ARG HG2 1 1
9 2793 2 1 5 ARG HG3 H -3.353 -6.911 0.282 1.00 . B B . 5 ARG HG3 1 1
9 2794 2 1 5 ARG HH11 H -7.243 -8.099 2.198 1.00 . B B . 5 ARG HH11 1 1
9 2795 2 1 5 ARG HH12 H -7.923 -9.691 2.131 1.00 . B B . 5 ARG HH12 1 1
9 2796 2 1 5 ARG HH21 H -5.705 -10.857 -0.305 1.00 . B B . 5 ARG HH21 1 1
9 2797 2 1 5 ARG HH22 H -7.050 -11.256 0.711 1.00 . B B . 5 ARG HH22 1 1
9 2798 2 1 5 ARG N N -5.307 -3.567 -0.584 1.00 . B B . 5 ARG N 1 1
9 2799 2 1 5 ARG NE N -5.457 -8.483 0.466 1.00 . B B . 5 ARG NE 1 1
9 2800 2 1 5 ARG NH1 N -7.247 -9.023 1.816 1.00 . B B . 5 ARG NH1 1 1
9 2801 2 1 5 ARG NH2 N -6.373 -10.593 0.392 1.00 . B B . 5 ARG NH2 1 1
9 2802 2 1 5 ARG O O -5.442 -2.649 2.771 1.00 . B B . 5 ARG O 1 1
9 2803 2 1 6 HIS C C -4.738 0.288 1.953 1.00 . B B . 6 HIS C 1 1
9 2804 2 1 6 HIS CA C -3.603 -0.727 1.948 1.00 . B B . 6 HIS CA 1 1
9 2805 2 1 6 HIS CB C -2.359 -0.098 1.321 1.00 . B B . 6 HIS CB 1 1
9 2806 2 1 6 HIS CD2 C -0.737 -1.456 -0.162 1.00 . B B . 6 HIS CD2 1 1
9 2807 2 1 6 HIS CE1 C 0.315 -2.563 1.367 1.00 . B B . 6 HIS CE1 1 1
9 2808 2 1 6 HIS CG C -1.267 -1.078 1.028 1.00 . B B . 6 HIS CG 1 1
9 2809 2 1 6 HIS H H -3.566 -2.109 0.342 1.00 . B B . 6 HIS H 1 1
9 2810 2 1 6 HIS HA H -3.382 -1.012 2.965 1.00 . B B . 6 HIS HA 1 1
9 2811 2 1 6 HIS HB2 H -2.638 0.370 0.390 1.00 . B B . 6 HIS HB2 1 1
9 2812 2 1 6 HIS HB3 H -1.967 0.651 1.992 1.00 . B B . 6 HIS HB3 1 1
9 2813 2 1 6 HIS HD1 H -0.737 -1.744 2.958 1.00 . B B . 6 HIS HD1 1 1
9 2814 2 1 6 HIS HD2 H -1.034 -1.091 -1.133 1.00 . B B . 6 HIS HD2 1 1
9 2815 2 1 6 HIS HE1 H 1.001 -3.232 1.869 1.00 . B B . 6 HIS HE1 1 1
9 2816 2 1 6 HIS N N -3.982 -1.929 1.214 1.00 . B B . 6 HIS N 1 1
9 2817 2 1 6 HIS ND1 N -0.588 -1.791 1.992 1.00 . B B . 6 HIS ND1 1 1
9 2818 2 1 6 HIS NE2 N 0.262 -2.396 0.061 1.00 . B B . 6 HIS NE2 1 1
9 2819 2 1 6 HIS O O -4.999 0.943 2.962 1.00 . B B . 6 HIS O 1 1
9 2820 2 1 7 HIS C C -7.838 0.696 1.014 1.00 . B B . 7 HIS C 1 1
9 2821 2 1 7 HIS CA C -6.509 1.357 0.670 1.00 . B B . 7 HIS CA 1 1
9 2822 2 1 7 HIS CB C -6.553 1.906 -0.757 1.00 . B B . 7 HIS CB 1 1
9 2823 2 1 7 HIS CD2 C -4.062 2.369 -1.303 1.00 . B B . 7 HIS CD2 1 1
9 2824 2 1 7 HIS CE1 C -4.165 4.501 -1.650 1.00 . B B . 7 HIS CE1 1 1
9 2825 2 1 7 HIS CG C -5.357 2.734 -1.120 1.00 . B B . 7 HIS CG 1 1
9 2826 2 1 7 HIS H H -5.143 -0.131 0.043 1.00 . B B . 7 HIS H 1 1
9 2827 2 1 7 HIS HA H -6.339 2.173 1.355 1.00 . B B . 7 HIS HA 1 1
9 2828 2 1 7 HIS HB2 H -6.608 1.082 -1.451 1.00 . B B . 7 HIS HB2 1 1
9 2829 2 1 7 HIS HB3 H -7.431 2.524 -0.870 1.00 . B B . 7 HIS HB3 1 1
9 2830 2 1 7 HIS HD1 H -6.201 4.659 -1.287 1.00 . B B . 7 HIS HD1 1 1
9 2831 2 1 7 HIS HD2 H -3.661 1.371 -1.203 1.00 . B B . 7 HIS HD2 1 1
9 2832 2 1 7 HIS HE1 H -3.899 5.522 -1.875 1.00 . B B . 7 HIS HE1 1 1
9 2833 2 1 7 HIS N N -5.405 0.417 0.811 1.00 . B B . 7 HIS N 1 1
9 2834 2 1 7 HIS ND1 N -5.404 4.092 -1.343 1.00 . B B . 7 HIS ND1 1 1
9 2835 2 1 7 HIS NE2 N -3.313 3.493 -1.640 1.00 . B B . 7 HIS NE2 1 1
9 2836 2 1 7 HIS O O -8.074 -0.464 0.673 1.00 . B B . 7 HIS O 1 1
9 2837 2 1 8 SER C C -11.110 1.508 1.191 1.00 . B B . 8 SER C 1 1
9 2838 2 1 8 SER CA C -10.014 0.930 2.081 1.00 . B B . 8 SER CA 1 1
9 2839 2 1 8 SER CB C -10.298 1.267 3.545 1.00 . B B . 8 SER CB 1 1
9 2840 2 1 8 SER H H -8.457 2.357 1.932 1.00 . B B . 8 SER H 1 1
9 2841 2 1 8 SER HA H -9.999 -0.143 1.964 1.00 . B B . 8 SER HA 1 1
9 2842 2 1 8 SER HB2 H -9.554 0.799 4.172 1.00 . B B . 8 SER HB2 1 1
9 2843 2 1 8 SER HB3 H -10.261 2.339 3.680 1.00 . B B . 8 SER HB3 1 1
9 2844 2 1 8 SER HG H -12.257 1.312 3.482 1.00 . B B . 8 SER HG 1 1
9 2845 2 1 8 SER N N -8.705 1.442 1.691 1.00 . B B . 8 SER N 1 1
9 2846 2 1 8 SER O O -11.302 2.721 1.135 1.00 . B B . 8 SER O 1 1
9 2847 2 1 8 SER OG O -11.580 0.803 3.936 1.00 . B B . 8 SER OG 1 1
9 2848 2 1 9 GLY C C -14.224 0.401 -0.063 1.00 . B B . 9 GLY C 1 1
9 2849 2 1 9 GLY CA C -12.897 1.068 -0.377 1.00 . B B . 9 GLY CA 1 1
9 2850 2 1 9 GLY H H -11.630 -0.328 0.585 1.00 . B B . 9 GLY H 1 1
9 2851 2 1 9 GLY HA2 H -13.013 2.138 -0.277 1.00 . B B . 9 GLY HA2 1 1
9 2852 2 1 9 GLY HA3 H -12.627 0.841 -1.398 1.00 . B B . 9 GLY HA3 1 1
9 2853 2 1 9 GLY N N -11.827 0.628 0.499 1.00 . B B . 9 GLY N 1 1
9 2854 2 1 9 GLY O O -15.126 0.380 -0.899 1.00 . B B . 9 GLY O 1 1
9 2855 2 1 10 TYR C C -16.582 0.194 2.097 1.00 . B B . 10 TYR C 1 1
9 2856 2 1 10 TYR CA C -15.570 -0.812 1.561 1.00 . B B . 10 TYR CA 1 1
9 2857 2 1 10 TYR CB C -15.265 -1.865 2.629 1.00 . B B . 10 TYR CB 1 1
9 2858 2 1 10 TYR CD1 C -12.948 -2.838 2.391 1.00 . B B . 10 TYR CD1 1 1
9 2859 2 1 10 TYR CD2 C -14.784 -4.069 1.496 1.00 . B B . 10 TYR CD2 1 1
9 2860 2 1 10 TYR CE1 C -12.076 -3.823 1.966 1.00 . B B . 10 TYR CE1 1 1
9 2861 2 1 10 TYR CE2 C -13.917 -5.059 1.070 1.00 . B B . 10 TYR CE2 1 1
9 2862 2 1 10 TYR CG C -14.314 -2.944 2.163 1.00 . B B . 10 TYR CG 1 1
9 2863 2 1 10 TYR CZ C -12.566 -4.930 1.306 1.00 . B B . 10 TYR CZ 1 1
9 2864 2 1 10 TYR H H -13.590 -0.094 1.769 1.00 . B B . 10 TYR H 1 1
9 2865 2 1 10 TYR HA H -15.991 -1.301 0.694 1.00 . B B . 10 TYR HA 1 1
9 2866 2 1 10 TYR HB2 H -14.822 -1.381 3.485 1.00 . B B . 10 TYR HB2 1 1
9 2867 2 1 10 TYR HB3 H -16.188 -2.340 2.928 1.00 . B B . 10 TYR HB3 1 1
9 2868 2 1 10 TYR HD1 H -12.568 -1.969 2.908 1.00 . B B . 10 TYR HD1 1 1
9 2869 2 1 10 TYR HD2 H -15.843 -4.166 1.312 1.00 . B B . 10 TYR HD2 1 1
9 2870 2 1 10 TYR HE1 H -11.016 -3.723 2.153 1.00 . B B . 10 TYR HE1 1 1
9 2871 2 1 10 TYR HE2 H -14.302 -5.925 0.552 1.00 . B B . 10 TYR HE2 1 1
9 2872 2 1 10 TYR HH H -11.555 -6.541 1.595 1.00 . B B . 10 TYR HH 1 1
9 2873 2 1 10 TYR N N -14.343 -0.143 1.144 1.00 . B B . 10 TYR N 1 1
9 2874 2 1 10 TYR O O -17.601 0.429 1.414 1.00 . B B . 10 TYR O 1 1
9 2875 2 1 10 TYR OH O -11.700 -5.913 0.884 1.00 . B B . 10 TYR OH 1 1
9 2876 2 1 11 NH2 HN1 H -15.492 0.547 3.778 1.00 . B B . 11 NH2 HN1 1 1
9 2877 2 1 11 NH2 HN2 H -16.987 1.446 3.649 1.00 . B B . 11 NH2 HN2 1 1
9 2878 2 1 11 NH2 N N -16.333 0.776 3.269 1.00 . B B . 11 NH2 N 1 1
9 2879 3 2 1 ZN ZN ZN 1.665 -3.365 -1.101 1.00 . C A . 101 ZN ZN 1 1
9 2880 4 2 1 ZN ZN ZN -1.431 2.960 -2.204 1.00 . D A . 102 ZN ZN 1 1
10 2881 1 1 1 ASP C C 0.500 5.160 -2.075 1.00 . A A . 1 ASP C 1 1
10 2882 1 1 1 ASP CA C 0.465 6.336 -1.105 1.00 . A A . 1 ASP CA 1 1
10 2883 1 1 1 ASP CB C 0.615 5.834 0.333 1.00 . A A . 1 ASP CB 1 1
10 2884 1 1 1 ASP CG C 0.876 6.960 1.313 1.00 . A A . 1 ASP CG 1 1
10 2885 1 1 1 ASP H1 H -0.872 7.735 -0.406 1.00 . A A . 1 ASP H1 1 1
10 2886 1 1 1 ASP H2 H -1.590 6.391 -1.196 1.00 . A A . 1 ASP H2 1 1
10 2887 1 1 1 ASP H3 H -0.799 7.606 -2.114 1.00 . A A . 1 ASP H3 1 1
10 2888 1 1 1 ASP HA H 1.278 7.007 -1.335 1.00 . A A . 1 ASP HA 1 1
10 2889 1 1 1 ASP HB2 H -0.292 5.330 0.628 1.00 . A A . 1 ASP HB2 1 1
10 2890 1 1 1 ASP HB3 H 1.441 5.137 0.381 1.00 . A A . 1 ASP HB3 1 1
10 2891 1 1 1 ASP N N -0.814 7.085 -1.216 1.00 . A A . 1 ASP N 1 1
10 2892 1 1 1 ASP O O -0.538 4.710 -2.559 1.00 . A A . 1 ASP O 1 1
10 2893 1 1 1 ASP OD1 O 1.312 8.043 0.871 1.00 . A A . 1 ASP OD1 1 1
10 2894 1 1 1 ASP OD2 O 0.646 6.757 2.525 1.00 . A A . 1 ASP OD2 1 1
10 2895 1 1 2 ALA C C 2.606 2.394 -2.568 1.00 . A A . 2 ALA C 1 1
10 2896 1 1 2 ALA CA C 1.878 3.540 -3.259 1.00 . A A . 2 ALA CA 1 1
10 2897 1 1 2 ALA CB C 2.637 3.977 -4.502 1.00 . A A . 2 ALA CB 1 1
10 2898 1 1 2 ALA H H 2.493 5.067 -1.931 1.00 . A A . 2 ALA H 1 1
10 2899 1 1 2 ALA HA H 0.900 3.198 -3.564 1.00 . A A . 2 ALA HA 1 1
10 2900 1 1 2 ALA HB1 H 2.458 5.027 -4.684 1.00 . A A . 2 ALA HB1 1 1
10 2901 1 1 2 ALA HB2 H 2.297 3.401 -5.351 1.00 . A A . 2 ALA HB2 1 1
10 2902 1 1 2 ALA HB3 H 3.693 3.811 -4.354 1.00 . A A . 2 ALA HB3 1 1
10 2903 1 1 2 ALA N N 1.703 4.666 -2.351 1.00 . A A . 2 ALA N 1 1
10 2904 1 1 2 ALA O O 2.962 2.488 -1.394 1.00 . A A . 2 ALA O 1 1
10 2905 1 1 3 GLU C C 4.852 0.513 -2.161 1.00 . A A . 3 GLU C 1 1
10 2906 1 1 3 GLU CA C 3.501 0.139 -2.766 1.00 . A A . 3 GLU CA 1 1
10 2907 1 1 3 GLU CB C 3.696 -0.908 -3.865 1.00 . A A . 3 GLU CB 1 1
10 2908 1 1 3 GLU CD C 2.655 -3.024 -2.965 1.00 . A A . 3 GLU CD 1 1
10 2909 1 1 3 GLU CG C 3.939 -2.311 -3.333 1.00 . A A . 3 GLU CG 1 1
10 2910 1 1 3 GLU H H 2.508 1.300 -4.233 1.00 . A A . 3 GLU H 1 1
10 2911 1 1 3 GLU HA H 2.876 -0.279 -1.992 1.00 . A A . 3 GLU HA 1 1
10 2912 1 1 3 GLU HB2 H 2.812 -0.931 -4.485 1.00 . A A . 3 GLU HB2 1 1
10 2913 1 1 3 GLU HB3 H 4.544 -0.624 -4.471 1.00 . A A . 3 GLU HB3 1 1
10 2914 1 1 3 GLU HG2 H 4.448 -2.888 -4.091 1.00 . A A . 3 GLU HG2 1 1
10 2915 1 1 3 GLU HG3 H 4.563 -2.246 -2.453 1.00 . A A . 3 GLU HG3 1 1
10 2916 1 1 3 GLU N N 2.820 1.311 -3.304 1.00 . A A . 3 GLU N 1 1
10 2917 1 1 3 GLU O O 5.267 -0.049 -1.149 1.00 . A A . 3 GLU O 1 1
10 2918 1 1 3 GLU OE1 O 1.627 -2.338 -2.788 1.00 . A A . 3 GLU OE1 1 1
10 2919 1 1 3 GLU OE2 O 2.677 -4.268 -2.854 1.00 . A A . 3 GLU OE2 1 1
10 2920 1 1 4 PHE C C 6.700 2.674 -0.988 1.00 . A A . 4 PHE C 1 1
10 2921 1 1 4 PHE CA C 6.836 1.904 -2.296 1.00 . A A . 4 PHE CA 1 1
10 2922 1 1 4 PHE CB C 7.539 2.769 -3.346 1.00 . A A . 4 PHE CB 1 1
10 2923 1 1 4 PHE CD1 C 6.969 5.135 -2.733 1.00 . A A . 4 PHE CD1 1 1
10 2924 1 1 4 PHE CD2 C 6.084 4.246 -4.761 1.00 . A A . 4 PHE CD2 1 1
10 2925 1 1 4 PHE CE1 C 6.340 6.340 -2.984 1.00 . A A . 4 PHE CE1 1 1
10 2926 1 1 4 PHE CE2 C 5.452 5.448 -5.017 1.00 . A A . 4 PHE CE2 1 1
10 2927 1 1 4 PHE CG C 6.848 4.075 -3.618 1.00 . A A . 4 PHE CG 1 1
10 2928 1 1 4 PHE CZ C 5.580 6.496 -4.127 1.00 . A A . 4 PHE CZ 1 1
10 2929 1 1 4 PHE H H 5.155 1.881 -3.584 1.00 . A A . 4 PHE H 1 1
10 2930 1 1 4 PHE HA H 7.432 1.023 -2.115 1.00 . A A . 4 PHE HA 1 1
10 2931 1 1 4 PHE HB2 H 8.540 2.988 -3.008 1.00 . A A . 4 PHE HB2 1 1
10 2932 1 1 4 PHE HB3 H 7.592 2.221 -4.275 1.00 . A A . 4 PHE HB3 1 1
10 2933 1 1 4 PHE HD1 H 7.561 5.014 -1.838 1.00 . A A . 4 PHE HD1 1 1
10 2934 1 1 4 PHE HD2 H 5.983 3.426 -5.456 1.00 . A A . 4 PHE HD2 1 1
10 2935 1 1 4 PHE HE1 H 6.441 7.158 -2.286 1.00 . A A . 4 PHE HE1 1 1
10 2936 1 1 4 PHE HE2 H 4.859 5.567 -5.912 1.00 . A A . 4 PHE HE2 1 1
10 2937 1 1 4 PHE HZ H 5.089 7.437 -4.325 1.00 . A A . 4 PHE HZ 1 1
10 2938 1 1 4 PHE N N 5.534 1.465 -2.784 1.00 . A A . 4 PHE N 1 1
10 2939 1 1 4 PHE O O 7.600 2.656 -0.148 1.00 . A A . 4 PHE O 1 1
10 2940 1 1 5 ARG C C 4.768 3.256 1.507 1.00 . A A . 5 ARG C 1 1
10 2941 1 1 5 ARG CA C 5.321 4.132 0.386 1.00 . A A . 5 ARG CA 1 1
10 2942 1 1 5 ARG CB C 4.349 5.273 0.086 1.00 . A A . 5 ARG CB 1 1
10 2943 1 1 5 ARG CD C 5.408 7.289 1.148 1.00 . A A . 5 ARG CD 1 1
10 2944 1 1 5 ARG CG C 4.257 6.297 1.203 1.00 . A A . 5 ARG CG 1 1
10 2945 1 1 5 ARG CZ C 4.448 9.562 1.150 1.00 . A A . 5 ARG CZ 1 1
10 2946 1 1 5 ARG H H 4.889 3.333 -1.524 1.00 . A A . 5 ARG H 1 1
10 2947 1 1 5 ARG HA H 6.262 4.550 0.706 1.00 . A A . 5 ARG HA 1 1
10 2948 1 1 5 ARG HB2 H 4.672 5.781 -0.812 1.00 . A A . 5 ARG HB2 1 1
10 2949 1 1 5 ARG HB3 H 3.365 4.860 -0.078 1.00 . A A . 5 ARG HB3 1 1
10 2950 1 1 5 ARG HD2 H 5.738 7.496 2.155 1.00 . A A . 5 ARG HD2 1 1
10 2951 1 1 5 ARG HD3 H 6.219 6.847 0.588 1.00 . A A . 5 ARG HD3 1 1
10 2952 1 1 5 ARG HE H 5.193 8.633 -0.452 1.00 . A A . 5 ARG HE 1 1
10 2953 1 1 5 ARG HG2 H 3.327 6.835 1.109 1.00 . A A . 5 ARG HG2 1 1
10 2954 1 1 5 ARG HG3 H 4.282 5.780 2.153 1.00 . A A . 5 ARG HG3 1 1
10 2955 1 1 5 ARG HH11 H 4.430 8.652 2.957 1.00 . A A . 5 ARG HH11 1 1
10 2956 1 1 5 ARG HH12 H 3.767 10.250 2.924 1.00 . A A . 5 ARG HH12 1 1
10 2957 1 1 5 ARG HH21 H 4.317 10.732 -0.491 1.00 . A A . 5 ARG HH21 1 1
10 2958 1 1 5 ARG HH22 H 3.701 11.430 0.968 1.00 . A A . 5 ARG HH22 1 1
10 2959 1 1 5 ARG N N 5.571 3.354 -0.820 1.00 . A A . 5 ARG N 1 1
10 2960 1 1 5 ARG NE N 5.019 8.543 0.508 1.00 . A A . 5 ARG NE 1 1
10 2961 1 1 5 ARG NH1 N 4.194 9.480 2.451 1.00 . A A . 5 ARG NH1 1 1
10 2962 1 1 5 ARG NH2 N 4.129 10.666 0.488 1.00 . A A . 5 ARG NH2 1 1
10 2963 1 1 5 ARG O O 5.114 3.437 2.673 1.00 . A A . 5 ARG O 1 1
10 2964 1 1 6 HIS C C 4.360 0.466 2.704 1.00 . A A . 6 HIS C 1 1
10 2965 1 1 6 HIS CA C 3.312 1.408 2.132 1.00 . A A . 6 HIS CA 1 1
10 2966 1 1 6 HIS CB C 2.190 0.582 1.502 1.00 . A A . 6 HIS CB 1 1
10 2967 1 1 6 HIS CD2 C 0.679 1.430 -0.409 1.00 . A A . 6 HIS CD2 1 1
10 2968 1 1 6 HIS CE1 C -0.517 2.860 0.684 1.00 . A A . 6 HIS CE1 1 1
10 2969 1 1 6 HIS CG C 1.112 1.403 0.873 1.00 . A A . 6 HIS CG 1 1
10 2970 1 1 6 HIS H H 3.672 2.208 0.200 1.00 . A A . 6 HIS H 1 1
10 2971 1 1 6 HIS HA H 2.905 2.008 2.931 1.00 . A A . 6 HIS HA 1 1
10 2972 1 1 6 HIS HB2 H 2.608 -0.054 0.736 1.00 . A A . 6 HIS HB2 1 1
10 2973 1 1 6 HIS HB3 H 1.737 -0.036 2.264 1.00 . A A . 6 HIS HB3 1 1
10 2974 1 1 6 HIS HD1 H 0.411 2.532 2.509 1.00 . A A . 6 HIS HD1 1 1
10 2975 1 1 6 HIS HD2 H 1.066 0.831 -1.221 1.00 . A A . 6 HIS HD2 1 1
10 2976 1 1 6 HIS HE1 H -1.250 3.611 0.937 1.00 . A A . 6 HIS HE1 1 1
10 2977 1 1 6 HIS N N 3.909 2.307 1.146 1.00 . A A . 6 HIS N 1 1
10 2978 1 1 6 HIS ND1 N 0.343 2.317 1.556 1.00 . A A . 6 HIS ND1 1 1
10 2979 1 1 6 HIS NE2 N -0.352 2.356 -0.524 1.00 . A A . 6 HIS NE2 1 1
10 2980 1 1 6 HIS O O 4.424 0.246 3.914 1.00 . A A . 6 HIS O 1 1
10 2981 1 1 7 HIS C C 7.503 -0.288 2.567 1.00 . A A . 7 HIS C 1 1
10 2982 1 1 7 HIS CA C 6.215 -1.026 2.215 1.00 . A A . 7 HIS CA 1 1
10 2983 1 1 7 HIS CB C 6.472 -2.030 1.092 1.00 . A A . 7 HIS CB 1 1
10 2984 1 1 7 HIS CD2 C 4.171 -2.519 -0.005 1.00 . A A . 7 HIS CD2 1 1
10 2985 1 1 7 HIS CE1 C 3.920 -4.576 0.607 1.00 . A A . 7 HIS CE1 1 1
10 2986 1 1 7 HIS CG C 5.267 -2.846 0.730 1.00 . A A . 7 HIS CG 1 1
10 2987 1 1 7 HIS H H 5.059 0.121 0.870 1.00 . A A . 7 HIS H 1 1
10 2988 1 1 7 HIS HA H 5.871 -1.558 3.089 1.00 . A A . 7 HIS HA 1 1
10 2989 1 1 7 HIS HB2 H 6.790 -1.497 0.208 1.00 . A A . 7 HIS HB2 1 1
10 2990 1 1 7 HIS HB3 H 7.255 -2.709 1.398 1.00 . A A . 7 HIS HB3 1 1
10 2991 1 1 7 HIS HD1 H 5.705 -4.689 1.658 1.00 . A A . 7 HIS HD1 1 1
10 2992 1 1 7 HIS HD2 H 3.963 -1.555 -0.447 1.00 . A A . 7 HIS HD2 1 1
10 2993 1 1 7 HIS HE1 H 3.510 -5.564 0.756 1.00 . A A . 7 HIS HE1 1 1
10 2994 1 1 7 HIS N N 5.171 -0.095 1.819 1.00 . A A . 7 HIS N 1 1
10 2995 1 1 7 HIS ND1 N 5.088 -4.157 1.113 1.00 . A A . 7 HIS ND1 1 1
10 2996 1 1 7 HIS NE2 N 3.327 -3.622 -0.081 1.00 . A A . 7 HIS NE2 1 1
10 2997 1 1 7 HIS O O 7.870 0.688 1.912 1.00 . A A . 7 HIS O 1 1
10 2998 1 1 8 SER C C 10.583 -1.139 3.970 1.00 . A A . 8 SER C 1 1
10 2999 1 1 8 SER CA C 9.427 -0.146 4.051 1.00 . A A . 8 SER CA 1 1
10 3000 1 1 8 SER CB C 9.283 0.368 5.484 1.00 . A A . 8 SER CB 1 1
10 3001 1 1 8 SER H H 7.832 -1.538 4.088 1.00 . A A . 8 SER H 1 1
10 3002 1 1 8 SER HA H 9.639 0.687 3.398 1.00 . A A . 8 SER HA 1 1
10 3003 1 1 8 SER HB2 H 8.580 1.188 5.501 1.00 . A A . 8 SER HB2 1 1
10 3004 1 1 8 SER HB3 H 8.920 -0.429 6.116 1.00 . A A . 8 SER HB3 1 1
10 3005 1 1 8 SER HG H 11.022 0.077 6.337 1.00 . A A . 8 SER HG 1 1
10 3006 1 1 8 SER N N 8.180 -0.759 3.607 1.00 . A A . 8 SER N 1 1
10 3007 1 1 8 SER O O 10.483 -2.263 4.461 1.00 . A A . 8 SER O 1 1
10 3008 1 1 8 SER OG O 10.526 0.823 5.990 1.00 . A A . 8 SER OG 1 1
10 3009 1 1 9 GLY C C 12.655 -2.634 2.146 1.00 . A A . 9 GLY C 1 1
10 3010 1 1 9 GLY CA C 12.838 -1.576 3.216 1.00 . A A . 9 GLY CA 1 1
10 3011 1 1 9 GLY H H 11.700 0.193 2.979 1.00 . A A . 9 GLY H 1 1
10 3012 1 1 9 GLY HA2 H 13.696 -0.970 2.965 1.00 . A A . 9 GLY HA2 1 1
10 3013 1 1 9 GLY HA3 H 13.020 -2.064 4.161 1.00 . A A . 9 GLY HA3 1 1
10 3014 1 1 9 GLY N N 11.678 -0.714 3.350 1.00 . A A . 9 GLY N 1 1
10 3015 1 1 9 GLY O O 11.553 -2.817 1.627 1.00 . A A . 9 GLY O 1 1
10 3016 1 1 10 TYR C C 14.769 -5.430 1.056 1.00 . A A . 10 TYR C 1 1
10 3017 1 1 10 TYR CA C 13.691 -4.379 0.802 1.00 . A A . 10 TYR CA 1 1
10 3018 1 1 10 TYR CB C 13.866 -3.782 -0.597 1.00 . A A . 10 TYR CB 1 1
10 3019 1 1 10 TYR CD1 C 16.067 -2.685 -0.017 1.00 . A A . 10 TYR CD1 1 1
10 3020 1 1 10 TYR CD2 C 14.512 -1.457 -1.342 1.00 . A A . 10 TYR CD2 1 1
10 3021 1 1 10 TYR CE1 C 16.953 -1.623 -0.067 1.00 . A A . 10 TYR CE1 1 1
10 3022 1 1 10 TYR CE2 C 15.392 -0.393 -1.397 1.00 . A A . 10 TYR CE2 1 1
10 3023 1 1 10 TYR CG C 14.833 -2.619 -0.653 1.00 . A A . 10 TYR CG 1 1
10 3024 1 1 10 TYR CZ C 16.610 -0.480 -0.758 1.00 . A A . 10 TYR CZ 1 1
10 3025 1 1 10 TYR H H 14.585 -3.140 2.267 1.00 . A A . 10 TYR H 1 1
10 3026 1 1 10 TYR HA H 12.723 -4.855 0.861 1.00 . A A . 10 TYR HA 1 1
10 3027 1 1 10 TYR HB2 H 14.233 -4.547 -1.265 1.00 . A A . 10 TYR HB2 1 1
10 3028 1 1 10 TYR HB3 H 12.908 -3.433 -0.953 1.00 . A A . 10 TYR HB3 1 1
10 3029 1 1 10 TYR HD1 H 16.332 -3.580 0.524 1.00 . A A . 10 TYR HD1 1 1
10 3030 1 1 10 TYR HD2 H 13.556 -1.391 -1.842 1.00 . A A . 10 TYR HD2 1 1
10 3031 1 1 10 TYR HE1 H 17.907 -1.693 0.434 1.00 . A A . 10 TYR HE1 1 1
10 3032 1 1 10 TYR HE2 H 15.123 0.503 -1.939 1.00 . A A . 10 TYR HE2 1 1
10 3033 1 1 10 TYR HH H 17.000 1.402 -0.793 1.00 . A A . 10 TYR HH 1 1
10 3034 1 1 10 TYR N N 13.737 -3.332 1.816 1.00 . A A . 10 TYR N 1 1
10 3035 1 1 10 TYR O O 15.422 -5.360 2.117 1.00 . A A . 10 TYR O 1 1
10 3036 1 1 10 TYR OH O 17.489 0.576 -0.810 1.00 . A A . 10 TYR OH 1 1
10 3037 1 1 11 NH2 HN1 H 14.397 -6.380 -0.705 1.00 . A A . 11 NH2 HN1 1 1
10 3038 1 1 11 NH2 HN2 H 15.663 -7.082 0.276 1.00 . A A . 11 NH2 HN2 1 1
10 3039 1 1 11 NH2 N N 14.958 -6.373 0.135 1.00 . A A . 11 NH2 N 1 1
10 3040 2 1 1 ASP C C -0.372 -5.677 -0.702 1.00 . B B . 1 ASP C 1 1
10 3041 2 1 1 ASP CA C -0.514 -6.589 0.513 1.00 . B B . 1 ASP CA 1 1
10 3042 2 1 1 ASP CB C -1.023 -5.793 1.715 1.00 . B B . 1 ASP CB 1 1
10 3043 2 1 1 ASP CG C -1.460 -6.686 2.859 1.00 . B B . 1 ASP CG 1 1
10 3044 2 1 1 ASP H1 H 1.339 -6.508 1.408 1.00 . B B . 1 ASP H1 1 1
10 3045 2 1 1 ASP H2 H 1.269 -7.475 -0.009 1.00 . B B . 1 ASP H2 1 1
10 3046 2 1 1 ASP H3 H 0.588 -8.047 1.459 1.00 . B B . 1 ASP H3 1 1
10 3047 2 1 1 ASP HA H -1.217 -7.376 0.283 1.00 . B B . 1 ASP HA 1 1
10 3048 2 1 1 ASP HB2 H -0.237 -5.144 2.069 1.00 . B B . 1 ASP HB2 1 1
10 3049 2 1 1 ASP HB3 H -1.865 -5.192 1.406 1.00 . B B . 1 ASP HB3 1 1
10 3050 2 1 1 ASP N N 0.788 -7.211 0.876 1.00 . B B . 1 ASP N 1 1
10 3051 2 1 1 ASP O O 0.733 -5.276 -1.061 1.00 . B B . 1 ASP O 1 1
10 3052 2 1 1 ASP OD1 O -1.533 -6.191 4.004 1.00 . B B . 1 ASP OD1 1 1
10 3053 2 1 1 ASP OD2 O -1.730 -7.879 2.611 1.00 . B B . 1 ASP OD2 1 1
10 3054 2 1 2 ALA C C -2.260 -3.199 -2.242 1.00 . B B . 2 ALA C 1 1
10 3055 2 1 2 ALA CA C -1.498 -4.493 -2.504 1.00 . B B . 2 ALA CA 1 1
10 3056 2 1 2 ALA CB C -2.094 -5.225 -3.695 1.00 . B B . 2 ALA CB 1 1
10 3057 2 1 2 ALA H H -2.350 -5.708 -0.996 1.00 . B B . 2 ALA H 1 1
10 3058 2 1 2 ALA HA H -0.470 -4.248 -2.740 1.00 . B B . 2 ALA HA 1 1
10 3059 2 1 2 ALA HB1 H -1.924 -6.286 -3.587 1.00 . B B . 2 ALA HB1 1 1
10 3060 2 1 2 ALA HB2 H -1.625 -4.875 -4.604 1.00 . B B . 2 ALA HB2 1 1
10 3061 2 1 2 ALA HB3 H -3.154 -5.032 -3.739 1.00 . B B . 2 ALA HB3 1 1
10 3062 2 1 2 ALA N N -1.498 -5.355 -1.329 1.00 . B B . 2 ALA N 1 1
10 3063 2 1 2 ALA O O -2.769 -2.975 -1.144 1.00 . B B . 2 ALA O 1 1
10 3064 2 1 3 GLU C C -4.438 -1.236 -2.619 1.00 . B B . 3 GLU C 1 1
10 3065 2 1 3 GLU CA C -3.020 -1.069 -3.161 1.00 . B B . 3 GLU CA 1 1
10 3066 2 1 3 GLU CB C -3.064 -0.386 -4.529 1.00 . B B . 3 GLU CB 1 1
10 3067 2 1 3 GLU CD C -2.145 1.905 -4.003 1.00 . B B . 3 GLU CD 1 1
10 3068 2 1 3 GLU CG C -3.348 1.106 -4.457 1.00 . B B . 3 GLU CG 1 1
10 3069 2 1 3 GLU H H -1.899 -2.594 -4.110 1.00 . B B . 3 GLU H 1 1
10 3070 2 1 3 GLU HA H -2.460 -0.447 -2.480 1.00 . B B . 3 GLU HA 1 1
10 3071 2 1 3 GLU HB2 H -2.112 -0.526 -5.020 1.00 . B B . 3 GLU HB2 1 1
10 3072 2 1 3 GLU HB3 H -3.839 -0.848 -5.124 1.00 . B B . 3 GLU HB3 1 1
10 3073 2 1 3 GLU HG2 H -3.640 1.452 -5.438 1.00 . B B . 3 GLU HG2 1 1
10 3074 2 1 3 GLU HG3 H -4.157 1.273 -3.761 1.00 . B B . 3 GLU HG3 1 1
10 3075 2 1 3 GLU N N -2.331 -2.352 -3.263 1.00 . B B . 3 GLU N 1 1
10 3076 2 1 3 GLU O O -4.910 -0.412 -1.836 1.00 . B B . 3 GLU O 1 1
10 3077 2 1 3 GLU OE1 O -1.307 1.344 -3.266 1.00 . B B . 3 GLU OE1 1 1
10 3078 2 1 3 GLU OE2 O -2.036 3.088 -4.386 1.00 . B B . 3 GLU OE2 1 1
10 3079 2 1 4 PHE C C -6.484 -2.951 -1.111 1.00 . B B . 4 PHE C 1 1
10 3080 2 1 4 PHE CA C -6.474 -2.552 -2.583 1.00 . B B . 4 PHE CA 1 1
10 3081 2 1 4 PHE CB C -7.144 -3.633 -3.440 1.00 . B B . 4 PHE CB 1 1
10 3082 2 1 4 PHE CD1 C -7.082 -5.869 -2.301 1.00 . B B . 4 PHE CD1 1 1
10 3083 2 1 4 PHE CD2 C -5.525 -5.448 -4.058 1.00 . B B . 4 PHE CD2 1 1
10 3084 2 1 4 PHE CE1 C -6.561 -7.139 -2.139 1.00 . B B . 4 PHE CE1 1 1
10 3085 2 1 4 PHE CE2 C -4.999 -6.716 -3.901 1.00 . B B . 4 PHE CE2 1 1
10 3086 2 1 4 PHE CG C -6.571 -5.009 -3.261 1.00 . B B . 4 PHE CG 1 1
10 3087 2 1 4 PHE CZ C -5.518 -7.562 -2.940 1.00 . B B . 4 PHE CZ 1 1
10 3088 2 1 4 PHE H H -4.688 -2.924 -3.659 1.00 . B B . 4 PHE H 1 1
10 3089 2 1 4 PHE HA H -7.028 -1.632 -2.689 1.00 . B B . 4 PHE HA 1 1
10 3090 2 1 4 PHE HB2 H -8.194 -3.679 -3.189 1.00 . B B . 4 PHE HB2 1 1
10 3091 2 1 4 PHE HB3 H -7.042 -3.364 -4.482 1.00 . B B . 4 PHE HB3 1 1
10 3092 2 1 4 PHE HD1 H -7.897 -5.538 -1.674 1.00 . B B . 4 PHE HD1 1 1
10 3093 2 1 4 PHE HD2 H -5.119 -4.786 -4.807 1.00 . B B . 4 PHE HD2 1 1
10 3094 2 1 4 PHE HE1 H -6.968 -7.799 -1.389 1.00 . B B . 4 PHE HE1 1 1
10 3095 2 1 4 PHE HE2 H -4.184 -7.044 -4.527 1.00 . B B . 4 PHE HE2 1 1
10 3096 2 1 4 PHE HZ H -5.109 -8.555 -2.817 1.00 . B B . 4 PHE HZ 1 1
10 3097 2 1 4 PHE N N -5.113 -2.298 -3.037 1.00 . B B . 4 PHE N 1 1
10 3098 2 1 4 PHE O O -7.446 -2.683 -0.391 1.00 . B B . 4 PHE O 1 1
10 3099 2 1 5 ARG C C -4.967 -2.794 1.610 1.00 . B B . 5 ARG C 1 1
10 3100 2 1 5 ARG CA C -5.275 -3.993 0.725 1.00 . B B . 5 ARG CA 1 1
10 3101 2 1 5 ARG CB C -4.161 -5.026 0.875 1.00 . B B . 5 ARG CB 1 1
10 3102 2 1 5 ARG CD C -5.633 -7.060 0.948 1.00 . B B . 5 ARG CD 1 1
10 3103 2 1 5 ARG CG C -4.475 -6.369 0.245 1.00 . B B . 5 ARG CG 1 1
10 3104 2 1 5 ARG CZ C -4.709 -8.692 2.553 1.00 . B B . 5 ARG CZ 1 1
10 3105 2 1 5 ARG H H -4.659 -3.749 -1.284 1.00 . B B . 5 ARG H 1 1
10 3106 2 1 5 ARG HA H -6.212 -4.429 1.033 1.00 . B B . 5 ARG HA 1 1
10 3107 2 1 5 ARG HB2 H -3.270 -4.637 0.405 1.00 . B B . 5 ARG HB2 1 1
10 3108 2 1 5 ARG HB3 H -3.967 -5.181 1.925 1.00 . B B . 5 ARG HB3 1 1
10 3109 2 1 5 ARG HD2 H -6.456 -6.365 1.025 1.00 . B B . 5 ARG HD2 1 1
10 3110 2 1 5 ARG HD3 H -5.939 -7.912 0.361 1.00 . B B . 5 ARG HD3 1 1
10 3111 2 1 5 ARG HE H -5.446 -6.901 3.035 1.00 . B B . 5 ARG HE 1 1
10 3112 2 1 5 ARG HG2 H -4.728 -6.215 -0.789 1.00 . B B . 5 ARG HG2 1 1
10 3113 2 1 5 ARG HG3 H -3.598 -6.997 0.312 1.00 . B B . 5 ARG HG3 1 1
10 3114 2 1 5 ARG HH11 H -4.669 -9.309 0.627 1.00 . B B . 5 ARG HH11 1 1
10 3115 2 1 5 ARG HH12 H -4.030 -10.431 1.779 1.00 . B B . 5 ARG HH12 1 1
10 3116 2 1 5 ARG HH21 H -4.599 -8.376 4.546 1.00 . B B . 5 ARG HH21 1 1
10 3117 2 1 5 ARG HH22 H -3.989 -9.903 4.002 1.00 . B B . 5 ARG HH22 1 1
10 3118 2 1 5 ARG N N -5.399 -3.576 -0.666 1.00 . B B . 5 ARG N 1 1
10 3119 2 1 5 ARG NE N -5.267 -7.510 2.289 1.00 . B B . 5 ARG NE 1 1
10 3120 2 1 5 ARG NH1 N -4.449 -9.547 1.571 1.00 . B B . 5 ARG NH1 1 1
10 3121 2 1 5 ARG NH2 N -4.408 -9.017 3.803 1.00 . B B . 5 ARG NH2 1 1
10 3122 2 1 5 ARG O O -5.539 -2.636 2.689 1.00 . B B . 5 ARG O 1 1
10 3123 2 1 6 HIS C C -4.784 0.249 1.921 1.00 . B B . 6 HIS C 1 1
10 3124 2 1 6 HIS CA C -3.649 -0.765 1.874 1.00 . B B . 6 HIS CA 1 1
10 3125 2 1 6 HIS CB C -2.424 -0.124 1.222 1.00 . B B . 6 HIS CB 1 1
10 3126 2 1 6 HIS CD2 C -0.759 -1.428 -0.261 1.00 . B B . 6 HIS CD2 1 1
10 3127 2 1 6 HIS CE1 C 0.274 -2.566 1.259 1.00 . B B . 6 HIS CE1 1 1
10 3128 2 1 6 HIS CG C -1.318 -1.088 0.925 1.00 . B B . 6 HIS CG 1 1
10 3129 2 1 6 HIS H H -3.637 -2.147 0.268 1.00 . B B . 6 HIS H 1 1
10 3130 2 1 6 HIS HA H -3.400 -1.061 2.880 1.00 . B B . 6 HIS HA 1 1
10 3131 2 1 6 HIS HB2 H -2.721 0.329 0.288 1.00 . B B . 6 HIS HB2 1 1
10 3132 2 1 6 HIS HB3 H -2.034 0.639 1.878 1.00 . B B . 6 HIS HB3 1 1
10 3133 2 1 6 HIS HD1 H -0.822 -1.802 2.848 1.00 . B B . 6 HIS HD1 1 1
10 3134 2 1 6 HIS HD2 H -1.039 -1.037 -1.229 1.00 . B B . 6 HIS HD2 1 1
10 3135 2 1 6 HIS HE1 H 0.956 -3.241 1.756 1.00 . B B . 6 HIS HE1 1 1
10 3136 2 1 6 HIS N N -4.053 -1.956 1.137 1.00 . B B . 6 HIS N 1 1
10 3137 2 1 6 HIS ND1 N -0.651 -1.821 1.883 1.00 . B B . 6 HIS ND1 1 1
10 3138 2 1 6 HIS NE2 N 0.246 -2.364 -0.043 1.00 . B B . 6 HIS NE2 1 1
10 3139 2 1 6 HIS O O -5.012 0.899 2.941 1.00 . B B . 6 HIS O 1 1
10 3140 2 1 7 HIS C C -7.925 0.624 0.985 1.00 . B B . 7 HIS C 1 1
10 3141 2 1 7 HIS CA C -6.597 1.318 0.702 1.00 . B B . 7 HIS CA 1 1
10 3142 2 1 7 HIS CB C -6.622 1.954 -0.690 1.00 . B B . 7 HIS CB 1 1
10 3143 2 1 7 HIS CD2 C -4.123 2.368 -1.242 1.00 . B B . 7 HIS CD2 1 1
10 3144 2 1 7 HIS CE1 C -4.147 4.526 -1.391 1.00 . B B . 7 HIS CE1 1 1
10 3145 2 1 7 HIS CG C -5.401 2.764 -1.003 1.00 . B B . 7 HIS CG 1 1
10 3146 2 1 7 HIS H H -5.250 -0.166 0.024 1.00 . B B . 7 HIS H 1 1
10 3147 2 1 7 HIS HA H -6.445 2.094 1.439 1.00 . B B . 7 HIS HA 1 1
10 3148 2 1 7 HIS HB2 H -6.701 1.173 -1.432 1.00 . B B . 7 HIS HB2 1 1
10 3149 2 1 7 HIS HB3 H -7.482 2.603 -0.766 1.00 . B B . 7 HIS HB3 1 1
10 3150 2 1 7 HIS HD1 H -6.169 4.727 -0.976 1.00 . B B . 7 HIS HD1 1 1
10 3151 2 1 7 HIS HD2 H -3.761 1.351 -1.244 1.00 . B B . 7 HIS HD2 1 1
10 3152 2 1 7 HIS HE1 H -3.843 5.553 -1.526 1.00 . B B . 7 HIS HE1 1 1
10 3153 2 1 7 HIS N N -5.487 0.380 0.804 1.00 . B B . 7 HIS N 1 1
10 3154 2 1 7 HIS ND1 N -5.396 4.138 -1.098 1.00 . B B . 7 HIS ND1 1 1
10 3155 2 1 7 HIS NE2 N -3.336 3.490 -1.490 1.00 . B B . 7 HIS NE2 1 1
10 3156 2 1 7 HIS O O -8.247 -0.395 0.373 1.00 . B B . 7 HIS O 1 1
10 3157 2 1 8 SER C C -11.058 1.006 1.278 1.00 . B B . 8 SER C 1 1
10 3158 2 1 8 SER CA C -9.984 0.612 2.286 1.00 . B B . 8 SER CA 1 1
10 3159 2 1 8 SER CB C -10.389 1.077 3.686 1.00 . B B . 8 SER CB 1 1
10 3160 2 1 8 SER H H -8.378 1.990 2.373 1.00 . B B . 8 SER H 1 1
10 3161 2 1 8 SER HA H -9.885 -0.462 2.288 1.00 . B B . 8 SER HA 1 1
10 3162 2 1 8 SER HB2 H -9.554 0.954 4.360 1.00 . B B . 8 SER HB2 1 1
10 3163 2 1 8 SER HB3 H -10.672 2.119 3.650 1.00 . B B . 8 SER HB3 1 1
10 3164 2 1 8 SER HG H -12.250 0.470 3.621 1.00 . B B . 8 SER HG 1 1
10 3165 2 1 8 SER N N -8.691 1.179 1.919 1.00 . B B . 8 SER N 1 1
10 3166 2 1 8 SER O O -11.092 2.140 0.803 1.00 . B B . 8 SER O 1 1
10 3167 2 1 8 SER OG O -11.482 0.323 4.177 1.00 . B B . 8 SER OG 1 1
10 3168 2 1 9 GLY C C -14.167 1.059 0.632 1.00 . B B . 9 GLY C 1 1
10 3169 2 1 9 GLY CA C -12.997 0.325 0.004 1.00 . B B . 9 GLY CA 1 1
10 3170 2 1 9 GLY H H -11.857 -0.827 1.366 1.00 . B B . 9 GLY H 1 1
10 3171 2 1 9 GLY HA2 H -12.602 0.925 -0.801 1.00 . B B . 9 GLY HA2 1 1
10 3172 2 1 9 GLY HA3 H -13.350 -0.613 -0.397 1.00 . B B . 9 GLY HA3 1 1
10 3173 2 1 9 GLY N N -11.934 0.060 0.955 1.00 . B B . 9 GLY N 1 1
10 3174 2 1 9 GLY O O -14.101 1.469 1.791 1.00 . B B . 9 GLY O 1 1
10 3175 2 1 10 TYR C C -17.138 1.087 1.420 1.00 . B B . 10 TYR C 1 1
10 3176 2 1 10 TYR CA C -16.430 1.912 0.351 1.00 . B B . 10 TYR CA 1 1
10 3177 2 1 10 TYR CB C -17.388 2.197 -0.805 1.00 . B B . 10 TYR CB 1 1
10 3178 2 1 10 TYR CD1 C -16.116 2.504 -2.965 1.00 . B B . 10 TYR CD1 1 1
10 3179 2 1 10 TYR CD2 C -16.897 4.451 -1.832 1.00 . B B . 10 TYR CD2 1 1
10 3180 2 1 10 TYR CE1 C -15.567 3.295 -3.955 1.00 . B B . 10 TYR CE1 1 1
10 3181 2 1 10 TYR CE2 C -16.349 5.249 -2.818 1.00 . B B . 10 TYR CE2 1 1
10 3182 2 1 10 TYR CG C -16.790 3.068 -1.888 1.00 . B B . 10 TYR CG 1 1
10 3183 2 1 10 TYR CZ C -15.686 4.666 -3.878 1.00 . B B . 10 TYR CZ 1 1
10 3184 2 1 10 TYR H H -15.231 0.873 -1.050 1.00 . B B . 10 TYR H 1 1
10 3185 2 1 10 TYR HA H -16.115 2.849 0.787 1.00 . B B . 10 TYR HA 1 1
10 3186 2 1 10 TYR HB2 H -17.685 1.262 -1.257 1.00 . B B . 10 TYR HB2 1 1
10 3187 2 1 10 TYR HB3 H -18.265 2.699 -0.422 1.00 . B B . 10 TYR HB3 1 1
10 3188 2 1 10 TYR HD1 H -16.026 1.429 -3.024 1.00 . B B . 10 TYR HD1 1 1
10 3189 2 1 10 TYR HD2 H -17.415 4.905 -1.000 1.00 . B B . 10 TYR HD2 1 1
10 3190 2 1 10 TYR HE1 H -15.049 2.838 -4.786 1.00 . B B . 10 TYR HE1 1 1
10 3191 2 1 10 TYR HE2 H -16.442 6.323 -2.756 1.00 . B B . 10 TYR HE2 1 1
10 3192 2 1 10 TYR HH H -14.322 5.848 -4.544 1.00 . B B . 10 TYR HH 1 1
10 3193 2 1 10 TYR N N -15.241 1.223 -0.135 1.00 . B B . 10 TYR N 1 1
10 3194 2 1 10 TYR O O -16.521 0.129 1.934 1.00 . B B . 10 TYR O 1 1
10 3195 2 1 10 TYR OH O -15.140 5.459 -4.862 1.00 . B B . 10 TYR OH 1 1
10 3196 2 1 11 NH2 HN1 H -18.829 2.212 1.312 1.00 . B B . 11 NH2 HN1 1 1
10 3197 2 1 11 NH2 HN2 H -18.873 0.899 2.467 1.00 . B B . 11 NH2 HN2 1 1
10 3198 2 1 11 NH2 N N -18.380 1.427 1.760 1.00 . B B . 11 NH2 N 1 1
10 3199 3 2 1 ZN ZN ZN 1.612 -3.437 -1.159 1.00 . C A . 101 ZN ZN 1 1
10 3200 4 2 1 ZN ZN ZN -1.485 2.950 -2.146 1.00 . D A . 102 ZN ZN 1 1
11 3201 1 1 1 ASP C C 0.583 5.185 -1.856 1.00 . A A . 1 ASP C 1 1
11 3202 1 1 1 ASP CA C 0.611 6.305 -0.821 1.00 . A A . 1 ASP CA 1 1
11 3203 1 1 1 ASP CB C 0.538 5.721 0.589 1.00 . A A . 1 ASP CB 1 1
11 3204 1 1 1 ASP CG C 0.592 6.789 1.664 1.00 . A A . 1 ASP CG 1 1
11 3205 1 1 1 ASP H1 H -0.638 7.410 -2.028 1.00 . A A . 1 ASP H1 1 1
11 3206 1 1 1 ASP H2 H -0.317 8.114 -0.496 1.00 . A A . 1 ASP H2 1 1
11 3207 1 1 1 ASP H3 H -1.383 6.775 -0.620 1.00 . A A . 1 ASP H3 1 1
11 3208 1 1 1 ASP HA H 1.528 6.863 -0.929 1.00 . A A . 1 ASP HA 1 1
11 3209 1 1 1 ASP HB2 H -0.388 5.175 0.699 1.00 . A A . 1 ASP HB2 1 1
11 3210 1 1 1 ASP HB3 H 1.370 5.046 0.737 1.00 . A A . 1 ASP HB3 1 1
11 3211 1 1 1 ASP N N -0.534 7.234 -1.009 1.00 . A A . 1 ASP N 1 1
11 3212 1 1 1 ASP O O -0.484 4.768 -2.304 1.00 . A A . 1 ASP O 1 1
11 3213 1 1 1 ASP OD1 O 0.169 6.507 2.805 1.00 . A A . 1 ASP OD1 1 1
11 3214 1 1 1 ASP OD2 O 1.057 7.909 1.364 1.00 . A A . 1 ASP OD2 1 1
11 3215 1 1 2 ALA C C 2.572 2.413 -2.608 1.00 . A A . 2 ALA C 1 1
11 3216 1 1 2 ALA CA C 1.876 3.627 -3.209 1.00 . A A . 2 ALA CA 1 1
11 3217 1 1 2 ALA CB C 2.626 4.115 -4.440 1.00 . A A . 2 ALA CB 1 1
11 3218 1 1 2 ALA H H 2.579 5.075 -1.836 1.00 . A A . 2 ALA H 1 1
11 3219 1 1 2 ALA HA H 0.878 3.344 -3.514 1.00 . A A . 2 ALA HA 1 1
11 3220 1 1 2 ALA HB1 H 3.557 3.575 -4.531 1.00 . A A . 2 ALA HB1 1 1
11 3221 1 1 2 ALA HB2 H 2.829 5.171 -4.342 1.00 . A A . 2 ALA HB2 1 1
11 3222 1 1 2 ALA HB3 H 2.024 3.944 -5.320 1.00 . A A . 2 ALA HB3 1 1
11 3223 1 1 2 ALA N N 1.763 4.701 -2.230 1.00 . A A . 2 ALA N 1 1
11 3224 1 1 2 ALA O O 2.992 2.432 -1.452 1.00 . A A . 2 ALA O 1 1
11 3225 1 1 3 GLU C C 4.715 0.413 -2.362 1.00 . A A . 3 GLU C 1 1
11 3226 1 1 3 GLU CA C 3.337 0.125 -2.954 1.00 . A A . 3 GLU CA 1 1
11 3227 1 1 3 GLU CB C 3.465 -0.862 -4.116 1.00 . A A . 3 GLU CB 1 1
11 3228 1 1 3 GLU CD C 2.671 -3.035 -3.107 1.00 . A A . 3 GLU CD 1 1
11 3229 1 1 3 GLU CG C 3.844 -2.268 -3.682 1.00 . A A . 3 GLU CG 1 1
11 3230 1 1 3 GLU H H 2.336 1.402 -4.316 1.00 . A A . 3 GLU H 1 1
11 3231 1 1 3 GLU HA H 2.715 -0.314 -2.189 1.00 . A A . 3 GLU HA 1 1
11 3232 1 1 3 GLU HB2 H 2.520 -0.912 -4.635 1.00 . A A . 3 GLU HB2 1 1
11 3233 1 1 3 GLU HB3 H 4.222 -0.503 -4.797 1.00 . A A . 3 GLU HB3 1 1
11 3234 1 1 3 GLU HG2 H 4.219 -2.808 -4.539 1.00 . A A . 3 GLU HG2 1 1
11 3235 1 1 3 GLU HG3 H 4.616 -2.203 -2.931 1.00 . A A . 3 GLU HG3 1 1
11 3236 1 1 3 GLU N N 2.692 1.355 -3.405 1.00 . A A . 3 GLU N 1 1
11 3237 1 1 3 GLU O O 5.198 -0.324 -1.503 1.00 . A A . 3 GLU O 1 1
11 3238 1 1 3 GLU OE1 O 1.731 -2.387 -2.600 1.00 . A A . 3 GLU OE1 1 1
11 3239 1 1 3 GLU OE2 O 2.688 -4.282 -3.166 1.00 . A A . 3 GLU OE2 1 1
11 3240 1 1 4 PHE C C 6.544 2.644 -1.016 1.00 . A A . 4 PHE C 1 1
11 3241 1 1 4 PHE CA C 6.660 1.863 -2.322 1.00 . A A . 4 PHE CA 1 1
11 3242 1 1 4 PHE CB C 7.413 2.693 -3.364 1.00 . A A . 4 PHE CB 1 1
11 3243 1 1 4 PHE CD1 C 6.992 5.112 -2.846 1.00 . A A . 4 PHE CD1 1 1
11 3244 1 1 4 PHE CD2 C 5.941 4.164 -4.766 1.00 . A A . 4 PHE CD2 1 1
11 3245 1 1 4 PHE CE1 C 6.402 6.331 -3.122 1.00 . A A . 4 PHE CE1 1 1
11 3246 1 1 4 PHE CE2 C 5.349 5.380 -5.047 1.00 . A A . 4 PHE CE2 1 1
11 3247 1 1 4 PHE CG C 6.768 4.016 -3.664 1.00 . A A . 4 PHE CG 1 1
11 3248 1 1 4 PHE CZ C 5.580 6.465 -4.223 1.00 . A A . 4 PHE CZ 1 1
11 3249 1 1 4 PHE H H 4.912 2.044 -3.503 1.00 . A A . 4 PHE H 1 1
11 3250 1 1 4 PHE HA H 7.211 0.954 -2.132 1.00 . A A . 4 PHE HA 1 1
11 3251 1 1 4 PHE HB2 H 8.413 2.886 -3.005 1.00 . A A . 4 PHE HB2 1 1
11 3252 1 1 4 PHE HB3 H 7.470 2.133 -4.286 1.00 . A A . 4 PHE HB3 1 1
11 3253 1 1 4 PHE HD1 H 7.634 5.007 -1.986 1.00 . A A . 4 PHE HD1 1 1
11 3254 1 1 4 PHE HD2 H 5.761 3.316 -5.411 1.00 . A A . 4 PHE HD2 1 1
11 3255 1 1 4 PHE HE1 H 6.584 7.177 -2.476 1.00 . A A . 4 PHE HE1 1 1
11 3256 1 1 4 PHE HE2 H 4.707 5.482 -5.910 1.00 . A A . 4 PHE HE2 1 1
11 3257 1 1 4 PHE HZ H 5.117 7.417 -4.441 1.00 . A A . 4 PHE HZ 1 1
11 3258 1 1 4 PHE N N 5.344 1.488 -2.820 1.00 . A A . 4 PHE N 1 1
11 3259 1 1 4 PHE O O 7.468 2.651 -0.203 1.00 . A A . 4 PHE O 1 1
11 3260 1 1 5 ARG C C 4.708 3.205 1.535 1.00 . A A . 5 ARG C 1 1
11 3261 1 1 5 ARG CA C 5.175 4.090 0.383 1.00 . A A . 5 ARG CA 1 1
11 3262 1 1 5 ARG CB C 4.140 5.182 0.113 1.00 . A A . 5 ARG CB 1 1
11 3263 1 1 5 ARG CD C 4.550 7.566 0.811 1.00 . A A . 5 ARG CD 1 1
11 3264 1 1 5 ARG CG C 4.027 6.202 1.234 1.00 . A A . 5 ARG CG 1 1
11 3265 1 1 5 ARG CZ C 6.606 8.887 1.124 1.00 . A A . 5 ARG CZ 1 1
11 3266 1 1 5 ARG H H 4.705 3.265 -1.507 1.00 . A A . 5 ARG H 1 1
11 3267 1 1 5 ARG HA H 6.108 4.554 0.661 1.00 . A A . 5 ARG HA 1 1
11 3268 1 1 5 ARG HB2 H 4.409 5.699 -0.795 1.00 . A A . 5 ARG HB2 1 1
11 3269 1 1 5 ARG HB3 H 3.174 4.717 -0.019 1.00 . A A . 5 ARG HB3 1 1
11 3270 1 1 5 ARG HD2 H 4.756 7.548 -0.248 1.00 . A A . 5 ARG HD2 1 1
11 3271 1 1 5 ARG HD3 H 3.792 8.307 1.016 1.00 . A A . 5 ARG HD3 1 1
11 3272 1 1 5 ARG HE H 5.981 7.438 2.345 1.00 . A A . 5 ARG HE 1 1
11 3273 1 1 5 ARG HG2 H 2.990 6.298 1.516 1.00 . A A . 5 ARG HG2 1 1
11 3274 1 1 5 ARG HG3 H 4.599 5.853 2.081 1.00 . A A . 5 ARG HG3 1 1
11 3275 1 1 5 ARG HH11 H 5.537 9.377 -0.522 1.00 . A A . 5 ARG HH11 1 1
11 3276 1 1 5 ARG HH12 H 6.988 10.293 -0.279 1.00 . A A . 5 ARG HH12 1 1
11 3277 1 1 5 ARG HH21 H 7.889 8.642 2.666 1.00 . A A . 5 ARG HH21 1 1
11 3278 1 1 5 ARG HH22 H 8.322 9.875 1.530 1.00 . A A . 5 ARG HH22 1 1
11 3279 1 1 5 ARG N N 5.407 3.305 -0.822 1.00 . A A . 5 ARG N 1 1
11 3280 1 1 5 ARG NE N 5.773 7.931 1.525 1.00 . A A . 5 ARG NE 1 1
11 3281 1 1 5 ARG NH1 N 6.356 9.575 0.016 1.00 . A A . 5 ARG NH1 1 1
11 3282 1 1 5 ARG NH2 N 7.695 9.157 1.831 1.00 . A A . 5 ARG NH2 1 1
11 3283 1 1 5 ARG O O 5.120 3.390 2.680 1.00 . A A . 5 ARG O 1 1
11 3284 1 1 6 HIS C C 4.416 0.418 2.753 1.00 . A A . 6 HIS C 1 1
11 3285 1 1 6 HIS CA C 3.317 1.334 2.237 1.00 . A A . 6 HIS CA 1 1
11 3286 1 1 6 HIS CB C 2.182 0.490 1.659 1.00 . A A . 6 HIS CB 1 1
11 3287 1 1 6 HIS CD2 C 0.764 1.367 -0.313 1.00 . A A . 6 HIS CD2 1 1
11 3288 1 1 6 HIS CE1 C -0.557 2.700 0.760 1.00 . A A . 6 HIS CE1 1 1
11 3289 1 1 6 HIS CG C 1.113 1.295 0.995 1.00 . A A . 6 HIS CG 1 1
11 3290 1 1 6 HIS H H 3.551 2.148 0.293 1.00 . A A . 6 HIS H 1 1
11 3291 1 1 6 HIS HA H 2.938 1.926 3.055 1.00 . A A . 6 HIS HA 1 1
11 3292 1 1 6 HIS HB2 H 2.588 -0.189 0.923 1.00 . A A . 6 HIS HB2 1 1
11 3293 1 1 6 HIS HB3 H 1.725 -0.080 2.454 1.00 . A A . 6 HIS HB3 1 1
11 3294 1 1 6 HIS HD1 H 0.260 2.321 2.628 1.00 . A A . 6 HIS HD1 1 1
11 3295 1 1 6 HIS HD2 H 1.228 0.819 -1.122 1.00 . A A . 6 HIS HD2 1 1
11 3296 1 1 6 HIS HE1 H -1.333 3.415 0.995 1.00 . A A . 6 HIS HE1 1 1
11 3297 1 1 6 HIS N N 3.841 2.246 1.224 1.00 . A A . 6 HIS N 1 1
11 3298 1 1 6 HIS ND1 N 0.264 2.149 1.663 1.00 . A A . 6 HIS ND1 1 1
11 3299 1 1 6 HIS NE2 N -0.293 2.261 -0.456 1.00 . A A . 6 HIS NE2 1 1
11 3300 1 1 6 HIS O O 4.497 0.134 3.948 1.00 . A A . 6 HIS O 1 1
11 3301 1 1 7 HIS C C 7.653 -0.147 2.364 1.00 . A A . 7 HIS C 1 1
11 3302 1 1 7 HIS CA C 6.355 -0.932 2.189 1.00 . A A . 7 HIS CA 1 1
11 3303 1 1 7 HIS CB C 6.529 -1.998 1.107 1.00 . A A . 7 HIS CB 1 1
11 3304 1 1 7 HIS CD2 C 4.192 -2.550 0.125 1.00 . A A . 7 HIS CD2 1 1
11 3305 1 1 7 HIS CE1 C 3.916 -4.524 0.962 1.00 . A A . 7 HIS CE1 1 1
11 3306 1 1 7 HIS CG C 5.299 -2.820 0.868 1.00 . A A . 7 HIS CG 1 1
11 3307 1 1 7 HIS H H 5.136 0.222 0.902 1.00 . A A . 7 HIS H 1 1
11 3308 1 1 7 HIS HA H 6.109 -1.414 3.122 1.00 . A A . 7 HIS HA 1 1
11 3309 1 1 7 HIS HB2 H 6.791 -1.516 0.177 1.00 . A A . 7 HIS HB2 1 1
11 3310 1 1 7 HIS HB3 H 7.326 -2.668 1.397 1.00 . A A . 7 HIS HB3 1 1
11 3311 1 1 7 HIS HD1 H 5.720 -4.559 1.983 1.00 . A A . 7 HIS HD1 1 1
11 3312 1 1 7 HIS HD2 H 3.992 -1.633 -0.411 1.00 . A A . 7 HIS HD2 1 1
11 3313 1 1 7 HIS HE1 H 3.490 -5.480 1.225 1.00 . A A . 7 HIS HE1 1 1
11 3314 1 1 7 HIS N N 5.259 -0.042 1.838 1.00 . A A . 7 HIS N 1 1
11 3315 1 1 7 HIS ND1 N 5.102 -4.076 1.396 1.00 . A A . 7 HIS ND1 1 1
11 3316 1 1 7 HIS NE2 N 3.328 -3.637 0.184 1.00 . A A . 7 HIS NE2 1 1
11 3317 1 1 7 HIS O O 8.198 0.393 1.403 1.00 . A A . 7 HIS O 1 1
11 3318 1 1 8 SER C C 10.517 -0.336 4.205 1.00 . A A . 8 SER C 1 1
11 3319 1 1 8 SER CA C 9.376 0.630 3.901 1.00 . A A . 8 SER CA 1 1
11 3320 1 1 8 SER CB C 9.162 1.574 5.085 1.00 . A A . 8 SER CB 1 1
11 3321 1 1 8 SER H H 7.662 -0.541 4.325 1.00 . A A . 8 SER H 1 1
11 3322 1 1 8 SER HA H 9.638 1.211 3.031 1.00 . A A . 8 SER HA 1 1
11 3323 1 1 8 SER HB2 H 8.550 1.084 5.828 1.00 . A A . 8 SER HB2 1 1
11 3324 1 1 8 SER HB3 H 10.119 1.827 5.517 1.00 . A A . 8 SER HB3 1 1
11 3325 1 1 8 SER HG H 7.651 2.820 5.089 1.00 . A A . 8 SER HG 1 1
11 3326 1 1 8 SER N N 8.142 -0.090 3.599 1.00 . A A . 8 SER N 1 1
11 3327 1 1 8 SER O O 11.511 0.040 4.828 1.00 . A A . 8 SER O 1 1
11 3328 1 1 8 SER OG O 8.516 2.766 4.676 1.00 . A A . 8 SER OG 1 1
11 3329 1 1 9 GLY C C 12.512 -2.516 2.972 1.00 . A A . 9 GLY C 1 1
11 3330 1 1 9 GLY CA C 11.400 -2.576 4.001 1.00 . A A . 9 GLY CA 1 1
11 3331 1 1 9 GLY H H 9.560 -1.826 3.273 1.00 . A A . 9 GLY H 1 1
11 3332 1 1 9 GLY HA2 H 11.822 -2.416 4.982 1.00 . A A . 9 GLY HA2 1 1
11 3333 1 1 9 GLY HA3 H 10.950 -3.558 3.971 1.00 . A A . 9 GLY HA3 1 1
11 3334 1 1 9 GLY N N 10.372 -1.581 3.765 1.00 . A A . 9 GLY N 1 1
11 3335 1 1 9 GLY O O 12.685 -1.503 2.295 1.00 . A A . 9 GLY O 1 1
11 3336 1 1 10 TYR C C 13.890 -3.358 0.487 1.00 . A A . 10 TYR C 1 1
11 3337 1 1 10 TYR CA C 14.370 -3.674 1.902 1.00 . A A . 10 TYR CA 1 1
11 3338 1 1 10 TYR CB C 15.013 -5.060 1.934 1.00 . A A . 10 TYR CB 1 1
11 3339 1 1 10 TYR CD1 C 15.725 -5.290 4.347 1.00 . A A . 10 TYR CD1 1 1
11 3340 1 1 10 TYR CD2 C 17.419 -5.280 2.669 1.00 . A A . 10 TYR CD2 1 1
11 3341 1 1 10 TYR CE1 C 16.692 -5.431 5.325 1.00 . A A . 10 TYR CE1 1 1
11 3342 1 1 10 TYR CE2 C 18.389 -5.420 3.642 1.00 . A A . 10 TYR CE2 1 1
11 3343 1 1 10 TYR CG C 16.071 -5.213 3.005 1.00 . A A . 10 TYR CG 1 1
11 3344 1 1 10 TYR CZ C 18.021 -5.495 4.968 1.00 . A A . 10 TYR CZ 1 1
11 3345 1 1 10 TYR H H 13.079 -4.380 3.424 1.00 . A A . 10 TYR H 1 1
11 3346 1 1 10 TYR HA H 15.104 -2.938 2.191 1.00 . A A . 10 TYR HA 1 1
11 3347 1 1 10 TYR HB2 H 14.249 -5.800 2.118 1.00 . A A . 10 TYR HB2 1 1
11 3348 1 1 10 TYR HB3 H 15.476 -5.257 0.979 1.00 . A A . 10 TYR HB3 1 1
11 3349 1 1 10 TYR HD1 H 14.683 -5.239 4.624 1.00 . A A . 10 TYR HD1 1 1
11 3350 1 1 10 TYR HD2 H 17.705 -5.221 1.629 1.00 . A A . 10 TYR HD2 1 1
11 3351 1 1 10 TYR HE1 H 16.402 -5.489 6.365 1.00 . A A . 10 TYR HE1 1 1
11 3352 1 1 10 TYR HE2 H 19.431 -5.471 3.361 1.00 . A A . 10 TYR HE2 1 1
11 3353 1 1 10 TYR HH H 19.754 -5.108 5.708 1.00 . A A . 10 TYR HH 1 1
11 3354 1 1 10 TYR N N 13.268 -3.604 2.855 1.00 . A A . 10 TYR N 1 1
11 3355 1 1 10 TYR O O 14.705 -2.863 -0.318 1.00 . A A . 10 TYR O 1 1
11 3356 1 1 10 TYR OH O 18.986 -5.635 5.941 1.00 . A A . 10 TYR OH 1 1
11 3357 1 1 11 NH2 HN1 H 12.008 -4.030 0.871 1.00 . A A . 11 NH2 HN1 1 1
11 3358 1 1 11 NH2 HN2 H 12.277 -3.431 -0.751 1.00 . A A . 11 NH2 HN2 1 1
11 3359 1 1 11 NH2 N N 12.623 -3.628 0.177 1.00 . A A . 11 NH2 N 1 1
11 3360 2 1 1 ASP C C -0.444 -5.661 -0.523 1.00 . B B . 1 ASP C 1 1
11 3361 2 1 1 ASP CA C -0.665 -6.578 0.675 1.00 . B B . 1 ASP CA 1 1
11 3362 2 1 1 ASP CB C -1.160 -5.770 1.875 1.00 . B B . 1 ASP CB 1 1
11 3363 2 1 1 ASP CG C -1.765 -6.647 2.954 1.00 . B B . 1 ASP CG 1 1
11 3364 2 1 1 ASP H1 H 0.334 -8.088 1.653 1.00 . B B . 1 ASP H1 1 1
11 3365 2 1 1 ASP H2 H 1.180 -6.597 1.584 1.00 . B B . 1 ASP H2 1 1
11 3366 2 1 1 ASP H3 H 1.062 -7.584 0.185 1.00 . B B . 1 ASP H3 1 1
11 3367 2 1 1 ASP HA H -1.405 -7.321 0.418 1.00 . B B . 1 ASP HA 1 1
11 3368 2 1 1 ASP HB2 H -0.330 -5.226 2.301 1.00 . B B . 1 ASP HB2 1 1
11 3369 2 1 1 ASP HB3 H -1.910 -5.068 1.542 1.00 . B B . 1 ASP HB3 1 1
11 3370 2 1 1 ASP N N 0.592 -7.274 1.059 1.00 . B B . 1 ASP N 1 1
11 3371 2 1 1 ASP O O 0.670 -5.200 -0.767 1.00 . B B . 1 ASP O 1 1
11 3372 2 1 1 ASP OD1 O -1.853 -6.187 4.112 1.00 . B B . 1 ASP OD1 1 1
11 3373 2 1 1 ASP OD2 O -2.154 -7.791 2.641 1.00 . B B . 1 ASP OD2 1 1
11 3374 2 1 2 ALA C C -2.168 -3.221 -2.207 1.00 . B B . 2 ALA C 1 1
11 3375 2 1 2 ALA CA C -1.441 -4.540 -2.442 1.00 . B B . 2 ALA CA 1 1
11 3376 2 1 2 ALA CB C -2.023 -5.255 -3.652 1.00 . B B . 2 ALA CB 1 1
11 3377 2 1 2 ALA H H -2.374 -5.798 -1.021 1.00 . B B . 2 ALA H 1 1
11 3378 2 1 2 ALA HA H -0.400 -4.332 -2.644 1.00 . B B . 2 ALA HA 1 1
11 3379 2 1 2 ALA HB1 H -1.304 -5.241 -4.458 1.00 . B B . 2 ALA HB1 1 1
11 3380 2 1 2 ALA HB2 H -2.927 -4.754 -3.965 1.00 . B B . 2 ALA HB2 1 1
11 3381 2 1 2 ALA HB3 H -2.251 -6.278 -3.391 1.00 . B B . 2 ALA HB3 1 1
11 3382 2 1 2 ALA N N -1.514 -5.400 -1.268 1.00 . B B . 2 ALA N 1 1
11 3383 2 1 2 ALA O O -2.667 -2.959 -1.114 1.00 . B B . 2 ALA O 1 1
11 3384 2 1 3 GLU C C -4.320 -1.243 -2.685 1.00 . B B . 3 GLU C 1 1
11 3385 2 1 3 GLU CA C -2.882 -1.099 -3.170 1.00 . B B . 3 GLU CA 1 1
11 3386 2 1 3 GLU CB C -2.858 -0.409 -4.534 1.00 . B B . 3 GLU CB 1 1
11 3387 2 1 3 GLU CD C -2.136 1.954 -4.021 1.00 . B B . 3 GLU CD 1 1
11 3388 2 1 3 GLU CG C -3.263 1.055 -4.486 1.00 . B B . 3 GLU CG 1 1
11 3389 2 1 3 GLU H H -1.800 -2.669 -4.089 1.00 . B B . 3 GLU H 1 1
11 3390 2 1 3 GLU HA H -2.337 -0.492 -2.463 1.00 . B B . 3 GLU HA 1 1
11 3391 2 1 3 GLU HB2 H -1.857 -0.469 -4.937 1.00 . B B . 3 GLU HB2 1 1
11 3392 2 1 3 GLU HB3 H -3.535 -0.927 -5.198 1.00 . B B . 3 GLU HB3 1 1
11 3393 2 1 3 GLU HG2 H -3.565 1.365 -5.476 1.00 . B B . 3 GLU HG2 1 1
11 3394 2 1 3 GLU HG3 H -4.094 1.162 -3.807 1.00 . B B . 3 GLU HG3 1 1
11 3395 2 1 3 GLU N N -2.221 -2.398 -3.247 1.00 . B B . 3 GLU N 1 1
11 3396 2 1 3 GLU O O -4.815 -0.413 -1.924 1.00 . B B . 3 GLU O 1 1
11 3397 2 1 3 GLU OE1 O -1.269 1.472 -3.264 1.00 . B B . 3 GLU OE1 1 1
11 3398 2 1 3 GLU OE2 O -2.117 3.137 -4.421 1.00 . B B . 3 GLU OE2 1 1
11 3399 2 1 4 PHE C C -6.431 -2.931 -1.246 1.00 . B B . 4 PHE C 1 1
11 3400 2 1 4 PHE CA C -6.369 -2.543 -2.718 1.00 . B B . 4 PHE CA 1 1
11 3401 2 1 4 PHE CB C -7.009 -3.629 -3.587 1.00 . B B . 4 PHE CB 1 1
11 3402 2 1 4 PHE CD1 C -6.838 -5.895 -2.521 1.00 . B B . 4 PHE CD1 1 1
11 3403 2 1 4 PHE CD2 C -5.298 -5.338 -4.255 1.00 . B B . 4 PHE CD2 1 1
11 3404 2 1 4 PHE CE1 C -6.254 -7.141 -2.397 1.00 . B B . 4 PHE CE1 1 1
11 3405 2 1 4 PHE CE2 C -4.709 -6.581 -4.134 1.00 . B B . 4 PHE CE2 1 1
11 3406 2 1 4 PHE CG C -6.367 -4.980 -3.449 1.00 . B B . 4 PHE CG 1 1
11 3407 2 1 4 PHE CZ C -5.187 -7.485 -3.205 1.00 . B B . 4 PHE CZ 1 1
11 3408 2 1 4 PHE H H -4.546 -2.936 -3.720 1.00 . B B . 4 PHE H 1 1
11 3409 2 1 4 PHE HA H -6.914 -1.621 -2.853 1.00 . B B . 4 PHE HA 1 1
11 3410 2 1 4 PHE HB2 H -8.048 -3.729 -3.315 1.00 . B B . 4 PHE HB2 1 1
11 3411 2 1 4 PHE HB3 H -6.941 -3.334 -4.624 1.00 . B B . 4 PHE HB3 1 1
11 3412 2 1 4 PHE HD1 H -7.671 -5.626 -1.888 1.00 . B B . 4 PHE HD1 1 1
11 3413 2 1 4 PHE HD2 H -4.923 -4.633 -4.982 1.00 . B B . 4 PHE HD2 1 1
11 3414 2 1 4 PHE HE1 H -6.630 -7.844 -1.668 1.00 . B B . 4 PHE HE1 1 1
11 3415 2 1 4 PHE HE2 H -3.875 -6.849 -4.769 1.00 . B B . 4 PHE HE2 1 1
11 3416 2 1 4 PHE HZ H -4.729 -8.458 -3.110 1.00 . B B . 4 PHE HZ 1 1
11 3417 2 1 4 PHE N N -4.989 -2.303 -3.122 1.00 . B B . 4 PHE N 1 1
11 3418 2 1 4 PHE O O -7.409 -2.644 -0.557 1.00 . B B . 4 PHE O 1 1
11 3419 2 1 5 ARG C C -5.029 -2.780 1.523 1.00 . B B . 5 ARG C 1 1
11 3420 2 1 5 ARG CA C -5.296 -3.984 0.634 1.00 . B B . 5 ARG CA 1 1
11 3421 2 1 5 ARG CB C -4.184 -5.011 0.830 1.00 . B B . 5 ARG CB 1 1
11 3422 2 1 5 ARG CD C -5.735 -6.981 0.715 1.00 . B B . 5 ARG CD 1 1
11 3423 2 1 5 ARG CG C -4.459 -6.352 0.182 1.00 . B B . 5 ARG CG 1 1
11 3424 2 1 5 ARG CZ C -6.401 -9.182 1.601 1.00 . B B . 5 ARG CZ 1 1
11 3425 2 1 5 ARG H H -4.613 -3.763 -1.358 1.00 . B B . 5 ARG H 1 1
11 3426 2 1 5 ARG HA H -6.243 -4.425 0.907 1.00 . B B . 5 ARG HA 1 1
11 3427 2 1 5 ARG HB2 H -3.274 -4.615 0.406 1.00 . B B . 5 ARG HB2 1 1
11 3428 2 1 5 ARG HB3 H -4.039 -5.169 1.890 1.00 . B B . 5 ARG HB3 1 1
11 3429 2 1 5 ARG HD2 H -5.940 -6.573 1.694 1.00 . B B . 5 ARG HD2 1 1
11 3430 2 1 5 ARG HD3 H -6.549 -6.739 0.046 1.00 . B B . 5 ARG HD3 1 1
11 3431 2 1 5 ARG HE H -4.931 -8.873 0.288 1.00 . B B . 5 ARG HE 1 1
11 3432 2 1 5 ARG HG2 H -4.554 -6.207 -0.882 1.00 . B B . 5 ARG HG2 1 1
11 3433 2 1 5 ARG HG3 H -3.630 -7.013 0.383 1.00 . B B . 5 ARG HG3 1 1
11 3434 2 1 5 ARG HH11 H -7.497 -7.632 2.303 1.00 . B B . 5 ARG HH11 1 1
11 3435 2 1 5 ARG HH12 H -7.937 -9.191 2.916 1.00 . B B . 5 ARG HH12 1 1
11 3436 2 1 5 ARG HH21 H -5.508 -10.922 1.096 1.00 . B B . 5 ARG HH21 1 1
11 3437 2 1 5 ARG HH22 H -6.808 -11.058 2.233 1.00 . B B . 5 ARG HH22 1 1
11 3438 2 1 5 ARG N N -5.370 -3.573 -0.763 1.00 . B B . 5 ARG N 1 1
11 3439 2 1 5 ARG NE N -5.624 -8.433 0.822 1.00 . B B . 5 ARG NE 1 1
11 3440 2 1 5 ARG NH1 N -7.356 -8.623 2.333 1.00 . B B . 5 ARG NH1 1 1
11 3441 2 1 5 ARG NH2 N -6.225 -10.496 1.646 1.00 . B B . 5 ARG NH2 1 1
11 3442 2 1 5 ARG O O -5.641 -2.619 2.580 1.00 . B B . 5 ARG O 1 1
11 3443 2 1 6 HIS C C -4.887 0.251 1.855 1.00 . B B . 6 HIS C 1 1
11 3444 2 1 6 HIS CA C -3.733 -0.741 1.828 1.00 . B B . 6 HIS CA 1 1
11 3445 2 1 6 HIS CB C -2.508 -0.075 1.199 1.00 . B B . 6 HIS CB 1 1
11 3446 2 1 6 HIS CD2 C -0.721 -1.341 -0.169 1.00 . B B . 6 HIS CD2 1 1
11 3447 2 1 6 HIS CE1 C 0.278 -2.404 1.427 1.00 . B B . 6 HIS CE1 1 1
11 3448 2 1 6 HIS CG C -1.353 -1.001 0.981 1.00 . B B . 6 HIS CG 1 1
11 3449 2 1 6 HIS H H -3.652 -2.130 0.230 1.00 . B B . 6 HIS H 1 1
11 3450 2 1 6 HIS HA H -3.497 -1.034 2.839 1.00 . B B . 6 HIS HA 1 1
11 3451 2 1 6 HIS HB2 H -2.788 0.332 0.239 1.00 . B B . 6 HIS HB2 1 1
11 3452 2 1 6 HIS HB3 H -2.176 0.728 1.840 1.00 . B B . 6 HIS HB3 1 1
11 3453 2 1 6 HIS HD1 H -0.928 -1.654 2.941 1.00 . B B . 6 HIS HD1 1 1
11 3454 2 1 6 HIS HD2 H -0.968 -0.982 -1.157 1.00 . B B . 6 HIS HD2 1 1
11 3455 2 1 6 HIS HE1 H 0.961 -3.040 1.971 1.00 . B B . 6 HIS HE1 1 1
11 3456 2 1 6 HIS N N -4.101 -1.938 1.082 1.00 . B B . 6 HIS N 1 1
11 3457 2 1 6 HIS ND1 N -0.708 -1.685 1.987 1.00 . B B . 6 HIS ND1 1 1
11 3458 2 1 6 HIS NE2 N 0.308 -2.229 0.121 1.00 . B B . 6 HIS NE2 1 1
11 3459 2 1 6 HIS O O -5.146 0.897 2.871 1.00 . B B . 6 HIS O 1 1
11 3460 2 1 7 HIS C C -8.021 0.545 0.744 1.00 . B B . 7 HIS C 1 1
11 3461 2 1 7 HIS CA C -6.696 1.286 0.602 1.00 . B B . 7 HIS CA 1 1
11 3462 2 1 7 HIS CB C -6.638 2.006 -0.747 1.00 . B B . 7 HIS CB 1 1
11 3463 2 1 7 HIS CD2 C -4.109 2.374 -1.192 1.00 . B B . 7 HIS CD2 1 1
11 3464 2 1 7 HIS CE1 C -4.055 4.536 -1.145 1.00 . B B . 7 HIS CE1 1 1
11 3465 2 1 7 HIS CG C -5.380 2.794 -0.952 1.00 . B B . 7 HIS CG 1 1
11 3466 2 1 7 HIS H H -5.307 -0.172 -0.050 1.00 . B B . 7 HIS H 1 1
11 3467 2 1 7 HIS HA H -6.618 2.017 1.394 1.00 . B B . 7 HIS HA 1 1
11 3468 2 1 7 HIS HB2 H -6.703 1.275 -1.539 1.00 . B B . 7 HIS HB2 1 1
11 3469 2 1 7 HIS HB3 H -7.474 2.686 -0.821 1.00 . B B . 7 HIS HB3 1 1
11 3470 2 1 7 HIS HD1 H -6.081 4.775 -0.770 1.00 . B B . 7 HIS HD1 1 1
11 3471 2 1 7 HIS HD2 H -3.783 1.348 -1.275 1.00 . B B . 7 HIS HD2 1 1
11 3472 2 1 7 HIS HE1 H -3.712 5.559 -1.179 1.00 . B B . 7 HIS HE1 1 1
11 3473 2 1 7 HIS N N -5.571 0.369 0.724 1.00 . B B . 7 HIS N 1 1
11 3474 2 1 7 HIS ND1 N -5.324 4.170 -0.924 1.00 . B B . 7 HIS ND1 1 1
11 3475 2 1 7 HIS NE2 N -3.277 3.483 -1.314 1.00 . B B . 7 HIS NE2 1 1
11 3476 2 1 7 HIS O O -8.337 -0.340 -0.053 1.00 . B B . 7 HIS O 1 1
11 3477 2 1 8 SER C C -10.970 1.177 2.866 1.00 . B B . 8 SER C 1 1
11 3478 2 1 8 SER CA C -10.082 0.280 2.012 1.00 . B B . 8 SER CA 1 1
11 3479 2 1 8 SER CB C -9.888 -1.071 2.704 1.00 . B B . 8 SER CB 1 1
11 3480 2 1 8 SER H H -8.483 1.621 2.363 1.00 . B B . 8 SER H 1 1
11 3481 2 1 8 SER HA H -10.562 0.119 1.058 1.00 . B B . 8 SER HA 1 1
11 3482 2 1 8 SER HB2 H -9.294 -1.715 2.073 1.00 . B B . 8 SER HB2 1 1
11 3483 2 1 8 SER HB3 H -9.377 -0.920 3.645 1.00 . B B . 8 SER HB3 1 1
11 3484 2 1 8 SER HG H -11.640 -1.740 2.142 1.00 . B B . 8 SER HG 1 1
11 3485 2 1 8 SER N N -8.791 0.910 1.762 1.00 . B B . 8 SER N 1 1
11 3486 2 1 8 SER O O -10.481 1.968 3.671 1.00 . B B . 8 SER O 1 1
11 3487 2 1 8 SER OG O -11.132 -1.699 2.955 1.00 . B B . 8 SER OG 1 1
11 3488 2 1 9 GLY C C -14.660 1.468 3.185 1.00 . B B . 9 GLY C 1 1
11 3489 2 1 9 GLY CA C -13.217 1.852 3.447 1.00 . B B . 9 GLY CA 1 1
11 3490 2 1 9 GLY H H -12.615 0.400 2.030 1.00 . B B . 9 GLY H 1 1
11 3491 2 1 9 GLY HA2 H -13.009 1.725 4.500 1.00 . B B . 9 GLY HA2 1 1
11 3492 2 1 9 GLY HA3 H -13.079 2.890 3.186 1.00 . B B . 9 GLY HA3 1 1
11 3493 2 1 9 GLY N N -12.281 1.048 2.686 1.00 . B B . 9 GLY N 1 1
11 3494 2 1 9 GLY O O -14.952 0.736 2.237 1.00 . B B . 9 GLY O 1 1
11 3495 2 1 10 TYR C C -17.805 2.953 3.832 1.00 . B B . 10 TYR C 1 1
11 3496 2 1 10 TYR CA C -16.985 1.669 3.878 1.00 . B B . 10 TYR CA 1 1
11 3497 2 1 10 TYR CB C -17.462 0.785 5.032 1.00 . B B . 10 TYR CB 1 1
11 3498 2 1 10 TYR CD1 C -15.927 1.214 6.989 1.00 . B B . 10 TYR CD1 1 1
11 3499 2 1 10 TYR CD2 C -18.151 2.067 7.096 1.00 . B B . 10 TYR CD2 1 1
11 3500 2 1 10 TYR CE1 C -15.660 1.743 8.237 1.00 . B B . 10 TYR CE1 1 1
11 3501 2 1 10 TYR CE2 C -17.890 2.599 8.345 1.00 . B B . 10 TYR CE2 1 1
11 3502 2 1 10 TYR CG C -17.174 1.367 6.398 1.00 . B B . 10 TYR CG 1 1
11 3503 2 1 10 TYR CZ C -16.644 2.434 8.911 1.00 . B B . 10 TYR CZ 1 1
11 3504 2 1 10 TYR H H -15.269 2.540 4.758 1.00 . B B . 10 TYR H 1 1
11 3505 2 1 10 TYR HA H -17.120 1.135 2.949 1.00 . B B . 10 TYR HA 1 1
11 3506 2 1 10 TYR HB2 H -18.529 0.644 4.950 1.00 . B B . 10 TYR HB2 1 1
11 3507 2 1 10 TYR HB3 H -16.970 -0.175 4.969 1.00 . B B . 10 TYR HB3 1 1
11 3508 2 1 10 TYR HD1 H -15.157 0.674 6.458 1.00 . B B . 10 TYR HD1 1 1
11 3509 2 1 10 TYR HD2 H -19.126 2.194 6.651 1.00 . B B . 10 TYR HD2 1 1
11 3510 2 1 10 TYR HE1 H -14.683 1.614 8.681 1.00 . B B . 10 TYR HE1 1 1
11 3511 2 1 10 TYR HE2 H -18.662 3.140 8.873 1.00 . B B . 10 TYR HE2 1 1
11 3512 2 1 10 TYR HH H -16.063 3.862 10.059 1.00 . B B . 10 TYR HH 1 1
11 3513 2 1 10 TYR N N -15.564 1.962 4.023 1.00 . B B . 10 TYR N 1 1
11 3514 2 1 10 TYR O O -18.705 3.049 2.971 1.00 . B B . 10 TYR O 1 1
11 3515 2 1 10 TYR OH O -16.382 2.962 10.155 1.00 . B B . 10 TYR OH 1 1
11 3516 2 1 11 NH2 HN1 H -16.783 3.779 5.385 1.00 . B B . 11 NH2 HN1 1 1
11 3517 2 1 11 NH2 HN2 H -18.050 4.775 4.704 1.00 . B B . 11 NH2 HN2 1 1
11 3518 2 1 11 NH2 N N -17.523 3.913 4.711 1.00 . B B . 11 NH2 N 1 1
11 3519 3 2 1 ZN ZN ZN 1.636 -3.412 -0.926 1.00 . C A . 101 ZN ZN 1 1
11 3520 4 2 1 ZN ZN ZN -1.433 2.985 -2.020 1.00 . D A . 102 ZN ZN 1 1
12 3521 1 1 1 ASP C C 0.526 5.168 -1.938 1.00 . A A . 1 ASP C 1 1
12 3522 1 1 1 ASP CA C 0.459 6.296 -0.914 1.00 . A A . 1 ASP CA 1 1
12 3523 1 1 1 ASP CB C 0.581 5.726 0.501 1.00 . A A . 1 ASP CB 1 1
12 3524 1 1 1 ASP CG C 0.808 6.804 1.541 1.00 . A A . 1 ASP CG 1 1
12 3525 1 1 1 ASP H1 H -1.589 6.341 -1.101 1.00 . A A . 1 ASP H1 1 1
12 3526 1 1 1 ASP H2 H -0.772 7.644 -1.863 1.00 . A A . 1 ASP H2 1 1
12 3527 1 1 1 ASP H3 H -0.930 7.610 -0.154 1.00 . A A . 1 ASP H3 1 1
12 3528 1 1 1 ASP HA H 1.273 6.984 -1.092 1.00 . A A . 1 ASP HA 1 1
12 3529 1 1 1 ASP HB2 H -0.328 5.200 0.749 1.00 . A A . 1 ASP HB2 1 1
12 3530 1 1 1 ASP HB3 H 1.413 5.035 0.535 1.00 . A A . 1 ASP HB3 1 1
12 3531 1 1 1 ASP N N -0.823 7.040 -1.018 1.00 . A A . 1 ASP N 1 1
12 3532 1 1 1 ASP O O -0.502 4.688 -2.413 1.00 . A A . 1 ASP O 1 1
12 3533 1 1 1 ASP OD1 O 0.550 6.542 2.735 1.00 . A A . 1 ASP OD1 1 1
12 3534 1 1 1 ASP OD2 O 1.246 7.912 1.162 1.00 . A A . 1 ASP OD2 1 1
12 3535 1 1 2 ALA C C 2.637 2.487 -2.581 1.00 . A A . 2 ALA C 1 1
12 3536 1 1 2 ALA CA C 1.942 3.674 -3.234 1.00 . A A . 2 ALA CA 1 1
12 3537 1 1 2 ALA CB C 2.745 4.175 -4.426 1.00 . A A . 2 ALA CB 1 1
12 3538 1 1 2 ALA H H 2.523 5.170 -1.856 1.00 . A A . 2 ALA H 1 1
12 3539 1 1 2 ALA HA H 0.970 3.357 -3.590 1.00 . A A . 2 ALA HA 1 1
12 3540 1 1 2 ALA HB1 H 3.699 3.669 -4.456 1.00 . A A . 2 ALA HB1 1 1
12 3541 1 1 2 ALA HB2 H 2.904 5.238 -4.331 1.00 . A A . 2 ALA HB2 1 1
12 3542 1 1 2 ALA HB3 H 2.201 3.972 -5.337 1.00 . A A . 2 ALA HB3 1 1
12 3543 1 1 2 ALA N N 1.741 4.749 -2.270 1.00 . A A . 2 ALA N 1 1
12 3544 1 1 2 ALA O O 3.001 2.537 -1.405 1.00 . A A . 2 ALA O 1 1
12 3545 1 1 3 GLU C C 4.811 0.543 -2.201 1.00 . A A . 3 GLU C 1 1
12 3546 1 1 3 GLU CA C 3.466 0.211 -2.843 1.00 . A A . 3 GLU CA 1 1
12 3547 1 1 3 GLU CB C 3.660 -0.796 -3.979 1.00 . A A . 3 GLU CB 1 1
12 3548 1 1 3 GLU CD C 2.541 -2.833 -2.989 1.00 . A A . 3 GLU CD 1 1
12 3549 1 1 3 GLU CG C 3.833 -2.230 -3.499 1.00 . A A . 3 GLU CG 1 1
12 3550 1 1 3 GLU H H 2.503 1.438 -4.276 1.00 . A A . 3 GLU H 1 1
12 3551 1 1 3 GLU HA H 2.822 -0.221 -2.094 1.00 . A A . 3 GLU HA 1 1
12 3552 1 1 3 GLU HB2 H 2.799 -0.759 -4.627 1.00 . A A . 3 GLU HB2 1 1
12 3553 1 1 3 GLU HB3 H 4.537 -0.521 -4.543 1.00 . A A . 3 GLU HB3 1 1
12 3554 1 1 3 GLU HG2 H 4.191 -2.829 -4.323 1.00 . A A . 3 GLU HG2 1 1
12 3555 1 1 3 GLU HG3 H 4.560 -2.244 -2.701 1.00 . A A . 3 GLU HG3 1 1
12 3556 1 1 3 GLU N N 2.816 1.418 -3.349 1.00 . A A . 3 GLU N 1 1
12 3557 1 1 3 GLU O O 5.192 -0.050 -1.192 1.00 . A A . 3 GLU O 1 1
12 3558 1 1 3 GLU OE1 O 1.688 -2.071 -2.488 1.00 . A A . 3 GLU OE1 1 1
12 3559 1 1 3 GLU OE2 O 2.378 -4.067 -3.097 1.00 . A A . 3 GLU OE2 1 1
12 3560 1 1 4 PHE C C 6.662 2.650 -0.945 1.00 . A A . 4 PHE C 1 1
12 3561 1 1 4 PHE CA C 6.821 1.905 -2.266 1.00 . A A . 4 PHE CA 1 1
12 3562 1 1 4 PHE CB C 7.543 2.795 -3.278 1.00 . A A . 4 PHE CB 1 1
12 3563 1 1 4 PHE CD1 C 6.859 5.131 -2.675 1.00 . A A . 4 PHE CD1 1 1
12 3564 1 1 4 PHE CD2 C 6.099 4.229 -4.748 1.00 . A A . 4 PHE CD2 1 1
12 3565 1 1 4 PHE CE1 C 6.194 6.313 -2.941 1.00 . A A . 4 PHE CE1 1 1
12 3566 1 1 4 PHE CE2 C 5.433 5.408 -5.019 1.00 . A A . 4 PHE CE2 1 1
12 3567 1 1 4 PHE CG C 6.819 4.077 -3.574 1.00 . A A . 4 PHE CG 1 1
12 3568 1 1 4 PHE CZ C 5.481 6.451 -4.115 1.00 . A A . 4 PHE CZ 1 1
12 3569 1 1 4 PHE H H 5.165 1.937 -3.584 1.00 . A A . 4 PHE H 1 1
12 3570 1 1 4 PHE HA H 7.406 1.016 -2.096 1.00 . A A . 4 PHE HA 1 1
12 3571 1 1 4 PHE HB2 H 8.521 3.045 -2.894 1.00 . A A . 4 PHE HB2 1 1
12 3572 1 1 4 PHE HB3 H 7.654 2.253 -4.207 1.00 . A A . 4 PHE HB3 1 1
12 3573 1 1 4 PHE HD1 H 7.418 5.025 -1.756 1.00 . A A . 4 PHE HD1 1 1
12 3574 1 1 4 PHE HD2 H 6.060 3.413 -5.454 1.00 . A A . 4 PHE HD2 1 1
12 3575 1 1 4 PHE HE1 H 6.232 7.127 -2.233 1.00 . A A . 4 PHE HE1 1 1
12 3576 1 1 4 PHE HE2 H 4.874 5.514 -5.938 1.00 . A A . 4 PHE HE2 1 1
12 3577 1 1 4 PHE HZ H 4.959 7.374 -4.326 1.00 . A A . 4 PHE HZ 1 1
12 3578 1 1 4 PHE N N 5.523 1.495 -2.786 1.00 . A A . 4 PHE N 1 1
12 3579 1 1 4 PHE O O 7.521 2.570 -0.067 1.00 . A A . 4 PHE O 1 1
12 3580 1 1 5 ARG C C 4.798 3.236 1.519 1.00 . A A . 5 ARG C 1 1
12 3581 1 1 5 ARG CA C 5.283 4.143 0.394 1.00 . A A . 5 ARG CA 1 1
12 3582 1 1 5 ARG CB C 4.239 5.223 0.105 1.00 . A A . 5 ARG CB 1 1
12 3583 1 1 5 ARG CD C 5.301 7.079 1.424 1.00 . A A . 5 ARG CD 1 1
12 3584 1 1 5 ARG CG C 4.063 6.216 1.240 1.00 . A A . 5 ARG CG 1 1
12 3585 1 1 5 ARG CZ C 5.865 9.199 2.546 1.00 . A A . 5 ARG CZ 1 1
12 3586 1 1 5 ARG H H 4.911 3.402 -1.550 1.00 . A A . 5 ARG H 1 1
12 3587 1 1 5 ARG HA H 6.202 4.618 0.702 1.00 . A A . 5 ARG HA 1 1
12 3588 1 1 5 ARG HB2 H 4.536 5.767 -0.778 1.00 . A A . 5 ARG HB2 1 1
12 3589 1 1 5 ARG HB3 H 3.288 4.746 -0.078 1.00 . A A . 5 ARG HB3 1 1
12 3590 1 1 5 ARG HD2 H 6.123 6.448 1.725 1.00 . A A . 5 ARG HD2 1 1
12 3591 1 1 5 ARG HD3 H 5.537 7.552 0.481 1.00 . A A . 5 ARG HD3 1 1
12 3592 1 1 5 ARG HE H 4.362 7.993 3.067 1.00 . A A . 5 ARG HE 1 1
12 3593 1 1 5 ARG HG2 H 3.222 6.855 1.018 1.00 . A A . 5 ARG HG2 1 1
12 3594 1 1 5 ARG HG3 H 3.874 5.673 2.154 1.00 . A A . 5 ARG HG3 1 1
12 3595 1 1 5 ARG HH11 H 7.072 8.726 0.994 1.00 . A A . 5 ARG HH11 1 1
12 3596 1 1 5 ARG HH12 H 7.446 10.212 1.798 1.00 . A A . 5 ARG HH12 1 1
12 3597 1 1 5 ARG HH21 H 4.853 9.949 4.126 1.00 . A A . 5 ARG HH21 1 1
12 3598 1 1 5 ARG HH22 H 6.187 10.907 3.579 1.00 . A A . 5 ARG HH22 1 1
12 3599 1 1 5 ARG N N 5.557 3.379 -0.814 1.00 . A A . 5 ARG N 1 1
12 3600 1 1 5 ARG NE N 5.103 8.114 2.436 1.00 . A A . 5 ARG NE 1 1
12 3601 1 1 5 ARG NH1 N 6.878 9.394 1.711 1.00 . A A . 5 ARG NH1 1 1
12 3602 1 1 5 ARG NH2 N 5.614 10.091 3.495 1.00 . A A . 5 ARG NH2 1 1
12 3603 1 1 5 ARG O O 5.174 3.411 2.678 1.00 . A A . 5 ARG O 1 1
12 3604 1 1 6 HIS C C 4.511 0.407 2.666 1.00 . A A . 6 HIS C 1 1
12 3605 1 1 6 HIS CA C 3.421 1.330 2.148 1.00 . A A . 6 HIS CA 1 1
12 3606 1 1 6 HIS CB C 2.305 0.490 1.527 1.00 . A A . 6 HIS CB 1 1
12 3607 1 1 6 HIS CD2 C 0.792 1.360 -0.372 1.00 . A A . 6 HIS CD2 1 1
12 3608 1 1 6 HIS CE1 C -0.463 2.711 0.755 1.00 . A A . 6 HIS CE1 1 1
12 3609 1 1 6 HIS CG C 1.209 1.298 0.915 1.00 . A A . 6 HIS CG 1 1
12 3610 1 1 6 HIS H H 3.699 2.178 0.226 1.00 . A A . 6 HIS H 1 1
12 3611 1 1 6 HIS HA H 3.019 1.899 2.972 1.00 . A A . 6 HIS HA 1 1
12 3612 1 1 6 HIS HB2 H 2.727 -0.132 0.753 1.00 . A A . 6 HIS HB2 1 1
12 3613 1 1 6 HIS HB3 H 1.870 -0.138 2.291 1.00 . A A . 6 HIS HB3 1 1
12 3614 1 1 6 HIS HD1 H 0.450 2.344 2.582 1.00 . A A . 6 HIS HD1 1 1
12 3615 1 1 6 HIS HD2 H 1.209 0.802 -1.199 1.00 . A A . 6 HIS HD2 1 1
12 3616 1 1 6 HIS HE1 H -1.223 3.430 1.024 1.00 . A A . 6 HIS HE1 1 1
12 3617 1 1 6 HIS N N 3.959 2.267 1.167 1.00 . A A . 6 HIS N 1 1
12 3618 1 1 6 HIS ND1 N 0.403 2.164 1.619 1.00 . A A . 6 HIS ND1 1 1
12 3619 1 1 6 HIS NE2 N -0.266 2.258 -0.466 1.00 . A A . 6 HIS NE2 1 1
12 3620 1 1 6 HIS O O 4.607 0.144 3.865 1.00 . A A . 6 HIS O 1 1
12 3621 1 1 7 HIS C C 7.726 -0.242 2.231 1.00 . A A . 7 HIS C 1 1
12 3622 1 1 7 HIS CA C 6.409 -0.996 2.089 1.00 . A A . 7 HIS CA 1 1
12 3623 1 1 7 HIS CB C 6.538 -2.082 1.021 1.00 . A A . 7 HIS CB 1 1
12 3624 1 1 7 HIS CD2 C 4.177 -2.573 0.059 1.00 . A A . 7 HIS CD2 1 1
12 3625 1 1 7 HIS CE1 C 3.835 -4.517 0.940 1.00 . A A . 7 HIS CE1 1 1
12 3626 1 1 7 HIS CG C 5.278 -2.865 0.803 1.00 . A A . 7 HIS CG 1 1
12 3627 1 1 7 HIS H H 5.187 0.155 0.806 1.00 . A A . 7 HIS H 1 1
12 3628 1 1 7 HIS HA H 6.168 -1.459 3.033 1.00 . A A . 7 HIS HA 1 1
12 3629 1 1 7 HIS HB2 H 6.809 -1.623 0.082 1.00 . A A . 7 HIS HB2 1 1
12 3630 1 1 7 HIS HB3 H 7.313 -2.774 1.313 1.00 . A A . 7 HIS HB3 1 1
12 3631 1 1 7 HIS HD1 H 5.645 -4.595 1.953 1.00 . A A . 7 HIS HD1 1 1
12 3632 1 1 7 HIS HD2 H 4.005 -1.661 -0.494 1.00 . A A . 7 HIS HD2 1 1
12 3633 1 1 7 HIS HE1 H 3.381 -5.453 1.223 1.00 . A A . 7 HIS HE1 1 1
12 3634 1 1 7 HIS N N 5.325 -0.090 1.744 1.00 . A A . 7 HIS N 1 1
12 3635 1 1 7 HIS ND1 N 5.039 -4.103 1.359 1.00 . A A . 7 HIS ND1 1 1
12 3636 1 1 7 HIS NE2 N 3.274 -3.626 0.148 1.00 . A A . 7 HIS NE2 1 1
12 3637 1 1 7 HIS O O 7.899 0.839 1.669 1.00 . A A . 7 HIS O 1 1
12 3638 1 1 8 SER C C 11.079 -1.142 2.784 1.00 . A A . 8 SER C 1 1
12 3639 1 1 8 SER CA C 9.955 -0.204 3.211 1.00 . A A . 8 SER CA 1 1
12 3640 1 1 8 SER CB C 10.120 0.174 4.684 1.00 . A A . 8 SER CB 1 1
12 3641 1 1 8 SER H H 8.451 -1.681 3.411 1.00 . A A . 8 SER H 1 1
12 3642 1 1 8 SER HA H 10.003 0.692 2.610 1.00 . A A . 8 SER HA 1 1
12 3643 1 1 8 SER HB2 H 11.091 0.623 4.831 1.00 . A A . 8 SER HB2 1 1
12 3644 1 1 8 SER HB3 H 9.351 0.880 4.960 1.00 . A A . 8 SER HB3 1 1
12 3645 1 1 8 SER HG H 10.717 -1.586 5.305 1.00 . A A . 8 SER HG 1 1
12 3646 1 1 8 SER N N 8.650 -0.820 2.989 1.00 . A A . 8 SER N 1 1
12 3647 1 1 8 SER O O 10.904 -2.360 2.745 1.00 . A A . 8 SER O 1 1
12 3648 1 1 8 SER OG O 10.015 -0.968 5.518 1.00 . A A . 8 SER OG 1 1
12 3649 1 1 9 GLY C C 14.141 -0.724 0.907 1.00 . A A . 9 GLY C 1 1
12 3650 1 1 9 GLY CA C 13.370 -1.365 2.044 1.00 . A A . 9 GLY CA 1 1
12 3651 1 1 9 GLY H H 12.315 0.409 2.514 1.00 . A A . 9 GLY H 1 1
12 3652 1 1 9 GLY HA2 H 14.034 -1.497 2.885 1.00 . A A . 9 GLY HA2 1 1
12 3653 1 1 9 GLY HA3 H 13.016 -2.333 1.724 1.00 . A A . 9 GLY HA3 1 1
12 3654 1 1 9 GLY N N 12.234 -0.566 2.465 1.00 . A A . 9 GLY N 1 1
12 3655 1 1 9 GLY O O 14.220 -1.277 -0.189 1.00 . A A . 9 GLY O 1 1
12 3656 1 1 10 TYR C C 16.979 0.911 0.330 1.00 . A A . 10 TYR C 1 1
12 3657 1 1 10 TYR CA C 15.486 1.164 0.158 1.00 . A A . 10 TYR CA 1 1
12 3658 1 1 10 TYR CB C 15.198 2.669 0.224 1.00 . A A . 10 TYR CB 1 1
12 3659 1 1 10 TYR CD1 C 15.921 2.854 2.640 1.00 . A A . 10 TYR CD1 1 1
12 3660 1 1 10 TYR CD2 C 13.995 4.075 1.943 1.00 . A A . 10 TYR CD2 1 1
12 3661 1 1 10 TYR CE1 C 15.775 3.349 3.923 1.00 . A A . 10 TYR CE1 1 1
12 3662 1 1 10 TYR CE2 C 13.843 4.571 3.223 1.00 . A A . 10 TYR CE2 1 1
12 3663 1 1 10 TYR CG C 15.036 3.208 1.628 1.00 . A A . 10 TYR CG 1 1
12 3664 1 1 10 TYR CZ C 14.734 4.205 4.209 1.00 . A A . 10 TYR CZ 1 1
12 3665 1 1 10 TYR H H 14.617 0.836 2.063 1.00 . A A . 10 TYR H 1 1
12 3666 1 1 10 TYR HA H 15.182 0.793 -0.809 1.00 . A A . 10 TYR HA 1 1
12 3667 1 1 10 TYR HB2 H 16.014 3.202 -0.240 1.00 . A A . 10 TYR HB2 1 1
12 3668 1 1 10 TYR HB3 H 14.287 2.875 -0.319 1.00 . A A . 10 TYR HB3 1 1
12 3669 1 1 10 TYR HD1 H 16.735 2.182 2.414 1.00 . A A . 10 TYR HD1 1 1
12 3670 1 1 10 TYR HD2 H 13.298 4.359 1.169 1.00 . A A . 10 TYR HD2 1 1
12 3671 1 1 10 TYR HE1 H 16.474 3.062 4.695 1.00 . A A . 10 TYR HE1 1 1
12 3672 1 1 10 TYR HE2 H 13.026 5.243 3.446 1.00 . A A . 10 TYR HE2 1 1
12 3673 1 1 10 TYR HH H 13.865 4.240 5.924 1.00 . A A . 10 TYR HH 1 1
12 3674 1 1 10 TYR N N 14.714 0.447 1.169 1.00 . A A . 10 TYR N 1 1
12 3675 1 1 10 TYR O O 17.357 0.259 1.327 1.00 . A A . 10 TYR O 1 1
12 3676 1 1 10 TYR OH O 14.584 4.700 5.485 1.00 . A A . 10 TYR OH 1 1
12 3677 1 1 11 NH2 HN1 H 17.448 1.918 -1.375 1.00 . A A . 11 NH2 HN1 1 1
12 3678 1 1 11 NH2 HN2 H 18.806 1.246 -0.501 1.00 . A A . 11 NH2 HN2 1 1
12 3679 1 1 11 NH2 N N 17.811 1.397 -0.589 1.00 . A A . 11 NH2 N 1 1
12 3680 2 1 1 ASP C C -0.355 -5.564 -0.661 1.00 . B B . 1 ASP C 1 1
12 3681 2 1 1 ASP CA C -0.417 -6.380 0.626 1.00 . B B . 1 ASP CA 1 1
12 3682 2 1 1 ASP CB C -1.267 -5.648 1.674 1.00 . B B . 1 ASP CB 1 1
12 3683 2 1 1 ASP CG C -0.919 -6.044 3.097 1.00 . B B . 1 ASP CG 1 1
12 3684 2 1 1 ASP H1 H 1.272 -5.707 1.591 1.00 . B B . 1 ASP H1 1 1
12 3685 2 1 1 ASP H2 H 1.559 -6.908 0.397 1.00 . B B . 1 ASP H2 1 1
12 3686 2 1 1 ASP H3 H 0.874 -7.344 1.907 1.00 . B B . 1 ASP H3 1 1
12 3687 2 1 1 ASP HA H -0.863 -7.338 0.412 1.00 . B B . 1 ASP HA 1 1
12 3688 2 1 1 ASP HB2 H -1.116 -4.584 1.570 1.00 . B B . 1 ASP HB2 1 1
12 3689 2 1 1 ASP HB3 H -2.309 -5.875 1.503 1.00 . B B . 1 ASP HB3 1 1
12 3690 2 1 1 ASP N N 0.945 -6.605 1.180 1.00 . B B . 1 ASP N 1 1
12 3691 2 1 1 ASP O O 0.721 -5.157 -1.094 1.00 . B B . 1 ASP O 1 1
12 3692 2 1 1 ASP OD1 O -0.710 -5.138 3.931 1.00 . B B . 1 ASP OD1 1 1
12 3693 2 1 1 ASP OD2 O -0.855 -7.260 3.376 1.00 . B B . 1 ASP OD2 1 1
12 3694 2 1 2 ALA C C -2.319 -3.243 -2.277 1.00 . B B . 2 ALA C 1 1
12 3695 2 1 2 ALA CA C -1.586 -4.561 -2.502 1.00 . B B . 2 ALA CA 1 1
12 3696 2 1 2 ALA CB C -2.268 -5.374 -3.592 1.00 . B B . 2 ALA CB 1 1
12 3697 2 1 2 ALA H H -2.337 -5.681 -0.874 1.00 . B B . 2 ALA H 1 1
12 3698 2 1 2 ALA HA H -0.575 -4.348 -2.824 1.00 . B B . 2 ALA HA 1 1
12 3699 2 1 2 ALA HB1 H -1.555 -5.603 -4.370 1.00 . B B . 2 ALA HB1 1 1
12 3700 2 1 2 ALA HB2 H -3.084 -4.805 -4.010 1.00 . B B . 2 ALA HB2 1 1
12 3701 2 1 2 ALA HB3 H -2.648 -6.292 -3.169 1.00 . B B . 2 ALA HB3 1 1
12 3702 2 1 2 ALA N N -1.513 -5.330 -1.267 1.00 . B B . 2 ALA N 1 1
12 3703 2 1 2 ALA O O -2.864 -3.002 -1.200 1.00 . B B . 2 ALA O 1 1
12 3704 2 1 3 GLU C C -4.426 -1.228 -2.728 1.00 . B B . 3 GLU C 1 1
12 3705 2 1 3 GLU CA C -2.985 -1.092 -3.212 1.00 . B B . 3 GLU CA 1 1
12 3706 2 1 3 GLU CB C -2.957 -0.396 -4.573 1.00 . B B . 3 GLU CB 1 1
12 3707 2 1 3 GLU CD C -2.079 1.900 -3.998 1.00 . B B . 3 GLU CD 1 1
12 3708 2 1 3 GLU CG C -3.258 1.093 -4.502 1.00 . B B . 3 GLU CG 1 1
12 3709 2 1 3 GLU H H -1.872 -2.644 -4.129 1.00 . B B . 3 GLU H 1 1
12 3710 2 1 3 GLU HA H -2.436 -0.492 -2.502 1.00 . B B . 3 GLU HA 1 1
12 3711 2 1 3 GLU HB2 H -1.978 -0.523 -5.009 1.00 . B B . 3 GLU HB2 1 1
12 3712 2 1 3 GLU HB3 H -3.690 -0.859 -5.216 1.00 . B B . 3 GLU HB3 1 1
12 3713 2 1 3 GLU HG2 H -3.516 1.442 -5.490 1.00 . B B . 3 GLU HG2 1 1
12 3714 2 1 3 GLU HG3 H -4.093 1.247 -3.837 1.00 . B B . 3 GLU HG3 1 1
12 3715 2 1 3 GLU N N -2.326 -2.393 -3.298 1.00 . B B . 3 GLU N 1 1
12 3716 2 1 3 GLU O O -4.913 -0.395 -1.964 1.00 . B B . 3 GLU O 1 1
12 3717 2 1 3 GLU OE1 O -1.271 1.347 -3.225 1.00 . B B . 3 GLU OE1 1 1
12 3718 2 1 3 GLU OE2 O -1.961 3.082 -4.382 1.00 . B B . 3 GLU OE2 1 1
12 3719 2 1 4 PHE C C -6.568 -2.898 -1.306 1.00 . B B . 4 PHE C 1 1
12 3720 2 1 4 PHE CA C -6.491 -2.501 -2.775 1.00 . B B . 4 PHE CA 1 1
12 3721 2 1 4 PHE CB C -7.141 -3.574 -3.655 1.00 . B B . 4 PHE CB 1 1
12 3722 2 1 4 PHE CD1 C -7.276 -5.826 -2.558 1.00 . B B . 4 PHE CD1 1 1
12 3723 2 1 4 PHE CD2 C -5.470 -5.405 -4.057 1.00 . B B . 4 PHE CD2 1 1
12 3724 2 1 4 PHE CE1 C -6.803 -7.107 -2.341 1.00 . B B . 4 PHE CE1 1 1
12 3725 2 1 4 PHE CE2 C -4.991 -6.683 -3.844 1.00 . B B . 4 PHE CE2 1 1
12 3726 2 1 4 PHE CG C -6.616 -4.963 -3.418 1.00 . B B . 4 PHE CG 1 1
12 3727 2 1 4 PHE CZ C -5.659 -7.535 -2.985 1.00 . B B . 4 PHE CZ 1 1
12 3728 2 1 4 PHE H H -4.672 -2.909 -3.778 1.00 . B B . 4 PHE H 1 1
12 3729 2 1 4 PHE HA H -7.023 -1.571 -2.907 1.00 . B B . 4 PHE HA 1 1
12 3730 2 1 4 PHE HB2 H -8.204 -3.587 -3.465 1.00 . B B . 4 PHE HB2 1 1
12 3731 2 1 4 PHE HB3 H -6.972 -3.327 -4.692 1.00 . B B . 4 PHE HB3 1 1
12 3732 2 1 4 PHE HD1 H -8.170 -5.493 -2.054 1.00 . B B . 4 PHE HD1 1 1
12 3733 2 1 4 PHE HD2 H -4.947 -4.739 -4.727 1.00 . B B . 4 PHE HD2 1 1
12 3734 2 1 4 PHE HE1 H -7.325 -7.771 -1.669 1.00 . B B . 4 PHE HE1 1 1
12 3735 2 1 4 PHE HE2 H -4.096 -7.016 -4.349 1.00 . B B . 4 PHE HE2 1 1
12 3736 2 1 4 PHE HZ H -5.285 -8.536 -2.818 1.00 . B B . 4 PHE HZ 1 1
12 3737 2 1 4 PHE N N -5.107 -2.277 -3.174 1.00 . B B . 4 PHE N 1 1
12 3738 2 1 4 PHE O O -7.542 -2.590 -0.618 1.00 . B B . 4 PHE O 1 1
12 3739 2 1 5 ARG C C -5.165 -2.820 1.476 1.00 . B B . 5 ARG C 1 1
12 3740 2 1 5 ARG CA C -5.476 -4.002 0.568 1.00 . B B . 5 ARG CA 1 1
12 3741 2 1 5 ARG CB C -4.425 -5.094 0.754 1.00 . B B . 5 ARG CB 1 1
12 3742 2 1 5 ARG CD C -3.808 -7.511 0.414 1.00 . B B . 5 ARG CD 1 1
12 3743 2 1 5 ARG CG C -4.756 -6.386 0.028 1.00 . B B . 5 ARG CG 1 1
12 3744 2 1 5 ARG CZ C -3.245 -9.780 -0.360 1.00 . B B . 5 ARG CZ 1 1
12 3745 2 1 5 ARG H H -4.777 -3.782 -1.419 1.00 . B B . 5 ARG H 1 1
12 3746 2 1 5 ARG HA H -6.446 -4.397 0.830 1.00 . B B . 5 ARG HA 1 1
12 3747 2 1 5 ARG HB2 H -3.477 -4.731 0.384 1.00 . B B . 5 ARG HB2 1 1
12 3748 2 1 5 ARG HB3 H -4.330 -5.311 1.808 1.00 . B B . 5 ARG HB3 1 1
12 3749 2 1 5 ARG HD2 H -2.795 -7.192 0.221 1.00 . B B . 5 ARG HD2 1 1
12 3750 2 1 5 ARG HD3 H -3.924 -7.716 1.468 1.00 . B B . 5 ARG HD3 1 1
12 3751 2 1 5 ARG HE H -4.897 -8.776 -0.862 1.00 . B B . 5 ARG HE 1 1
12 3752 2 1 5 ARG HG2 H -5.761 -6.677 0.284 1.00 . B B . 5 ARG HG2 1 1
12 3753 2 1 5 ARG HG3 H -4.686 -6.216 -1.036 1.00 . B B . 5 ARG HG3 1 1
12 3754 2 1 5 ARG HH11 H -1.884 -8.959 0.889 1.00 . B B . 5 ARG HH11 1 1
12 3755 2 1 5 ARG HH12 H -1.504 -10.550 0.322 1.00 . B B . 5 ARG HH12 1 1
12 3756 2 1 5 ARG HH21 H -4.399 -10.872 -1.611 1.00 . B B . 5 ARG HH21 1 1
12 3757 2 1 5 ARG HH22 H -2.932 -11.636 -1.096 1.00 . B B . 5 ARG HH22 1 1
12 3758 2 1 5 ARG N N -5.528 -3.574 -0.825 1.00 . B B . 5 ARG N 1 1
12 3759 2 1 5 ARG NE N -4.068 -8.734 -0.340 1.00 . B B . 5 ARG NE 1 1
12 3760 2 1 5 ARG NH1 N -2.118 -9.761 0.341 1.00 . B B . 5 ARG NH1 1 1
12 3761 2 1 5 ARG NH2 N -3.551 -10.851 -1.082 1.00 . B B . 5 ARG NH2 1 1
12 3762 2 1 5 ARG O O -5.762 -2.665 2.541 1.00 . B B . 5 ARG O 1 1
12 3763 2 1 6 HIS C C -4.976 0.203 1.836 1.00 . B B . 6 HIS C 1 1
12 3764 2 1 6 HIS CA C -3.838 -0.807 1.807 1.00 . B B . 6 HIS CA 1 1
12 3765 2 1 6 HIS CB C -2.600 -0.148 1.197 1.00 . B B . 6 HIS CB 1 1
12 3766 2 1 6 HIS CD2 C -0.885 -1.538 -0.137 1.00 . B B . 6 HIS CD2 1 1
12 3767 2 1 6 HIS CE1 C 0.264 -2.368 1.495 1.00 . B B . 6 HIS CE1 1 1
12 3768 2 1 6 HIS CG C -1.439 -1.070 1.007 1.00 . B B . 6 HIS CG 1 1
12 3769 2 1 6 HIS H H -3.794 -2.163 0.176 1.00 . B B . 6 HIS H 1 1
12 3770 2 1 6 HIS HA H -3.615 -1.119 2.816 1.00 . B B . 6 HIS HA 1 1
12 3771 2 1 6 HIS HB2 H -2.862 0.251 0.228 1.00 . B B . 6 HIS HB2 1 1
12 3772 2 1 6 HIS HB3 H -2.282 0.662 1.838 1.00 . B B . 6 HIS HB3 1 1
12 3773 2 1 6 HIS HD1 H -0.848 -1.461 2.995 1.00 . B B . 6 HIS HD1 1 1
12 3774 2 1 6 HIS HD2 H -1.217 -1.311 -1.139 1.00 . B B . 6 HIS HD2 1 1
12 3775 2 1 6 HIS HE1 H 1.008 -2.912 2.060 1.00 . B B . 6 HIS HE1 1 1
12 3776 2 1 6 HIS N N -4.228 -1.985 1.039 1.00 . B B . 6 HIS N 1 1
12 3777 2 1 6 HIS ND1 N -0.699 -1.609 2.037 1.00 . B B . 6 HIS ND1 1 1
12 3778 2 1 6 HIS NE2 N 0.191 -2.358 0.179 1.00 . B B . 6 HIS NE2 1 1
12 3779 2 1 6 HIS O O -5.244 0.831 2.859 1.00 . B B . 6 HIS O 1 1
12 3780 2 1 7 HIS C C -8.079 0.579 0.690 1.00 . B B . 7 HIS C 1 1
12 3781 2 1 7 HIS CA C -6.739 1.294 0.558 1.00 . B B . 7 HIS CA 1 1
12 3782 2 1 7 HIS CB C -6.658 2.007 -0.792 1.00 . B B . 7 HIS CB 1 1
12 3783 2 1 7 HIS CD2 C -4.115 2.327 -1.190 1.00 . B B . 7 HIS CD2 1 1
12 3784 2 1 7 HIS CE1 C -4.034 4.488 -1.217 1.00 . B B . 7 HIS CE1 1 1
12 3785 2 1 7 HIS CG C -5.386 2.771 -0.995 1.00 . B B . 7 HIS CG 1 1
12 3786 2 1 7 HIS H H -5.359 -0.171 -0.086 1.00 . B B . 7 HIS H 1 1
12 3787 2 1 7 HIS HA H -6.653 2.025 1.347 1.00 . B B . 7 HIS HA 1 1
12 3788 2 1 7 HIS HB2 H -6.735 1.275 -1.582 1.00 . B B . 7 HIS HB2 1 1
12 3789 2 1 7 HIS HB3 H -7.481 2.703 -0.873 1.00 . B B . 7 HIS HB3 1 1
12 3790 2 1 7 HIS HD1 H -6.065 4.764 -0.898 1.00 . B B . 7 HIS HD1 1 1
12 3791 2 1 7 HIS HD2 H -3.800 1.295 -1.230 1.00 . B B . 7 HIS HD2 1 1
12 3792 2 1 7 HIS HE1 H -3.678 5.506 -1.280 1.00 . B B . 7 HIS HE1 1 1
12 3793 2 1 7 HIS N N -5.632 0.358 0.692 1.00 . B B . 7 HIS N 1 1
12 3794 2 1 7 HIS ND1 N -5.313 4.145 -1.012 1.00 . B B . 7 HIS ND1 1 1
12 3795 2 1 7 HIS NE2 N -3.268 3.420 -1.332 1.00 . B B . 7 HIS NE2 1 1
12 3796 2 1 7 HIS O O -8.133 -0.645 0.807 1.00 . B B . 7 HIS O 1 1
12 3797 2 1 8 SER C C -11.224 0.848 -0.560 1.00 . B B . 8 SER C 1 1
12 3798 2 1 8 SER CA C -10.501 0.795 0.782 1.00 . B B . 8 SER CA 1 1
12 3799 2 1 8 SER CB C -11.305 1.556 1.838 1.00 . B B . 8 SER CB 1 1
12 3800 2 1 8 SER H H -9.051 2.322 0.570 1.00 . B B . 8 SER H 1 1
12 3801 2 1 8 SER HA H -10.407 -0.236 1.087 1.00 . B B . 8 SER HA 1 1
12 3802 2 1 8 SER HB2 H -11.323 2.606 1.586 1.00 . B B . 8 SER HB2 1 1
12 3803 2 1 8 SER HB3 H -12.316 1.175 1.862 1.00 . B B . 8 SER HB3 1 1
12 3804 2 1 8 SER HG H -10.092 2.109 3.273 1.00 . B B . 8 SER HG 1 1
12 3805 2 1 8 SER N N -9.159 1.353 0.668 1.00 . B B . 8 SER N 1 1
12 3806 2 1 8 SER O O -11.263 1.888 -1.215 1.00 . B B . 8 SER O 1 1
12 3807 2 1 8 SER OG O -10.731 1.406 3.124 1.00 . B B . 8 SER OG 1 1
12 3808 2 1 9 GLY C C -12.859 -1.762 -2.629 1.00 . B B . 9 GLY C 1 1
12 3809 2 1 9 GLY CA C -12.502 -0.343 -2.230 1.00 . B B . 9 GLY CA 1 1
12 3810 2 1 9 GLY H H -11.726 -1.083 -0.403 1.00 . B B . 9 GLY H 1 1
12 3811 2 1 9 GLY HA2 H -13.410 0.235 -2.147 1.00 . B B . 9 GLY HA2 1 1
12 3812 2 1 9 GLY HA3 H -11.881 0.090 -3.000 1.00 . B B . 9 GLY HA3 1 1
12 3813 2 1 9 GLY N N -11.791 -0.284 -0.965 1.00 . B B . 9 GLY N 1 1
12 3814 2 1 9 GLY O O -12.816 -2.676 -1.807 1.00 . B B . 9 GLY O 1 1
12 3815 2 1 10 TYR C C -12.529 -3.784 -5.375 1.00 . B B . 10 TYR C 1 1
12 3816 2 1 10 TYR CA C -13.586 -3.258 -4.408 1.00 . B B . 10 TYR CA 1 1
12 3817 2 1 10 TYR CB C -14.945 -3.189 -5.103 1.00 . B B . 10 TYR CB 1 1
12 3818 2 1 10 TYR CD1 C -16.310 -1.435 -3.907 1.00 . B B . 10 TYR CD1 1 1
12 3819 2 1 10 TYR CD2 C -16.904 -3.725 -3.602 1.00 . B B . 10 TYR CD2 1 1
12 3820 2 1 10 TYR CE1 C -17.340 -1.052 -3.069 1.00 . B B . 10 TYR CE1 1 1
12 3821 2 1 10 TYR CE2 C -17.936 -3.349 -2.763 1.00 . B B . 10 TYR CE2 1 1
12 3822 2 1 10 TYR CG C -16.073 -2.775 -4.187 1.00 . B B . 10 TYR CG 1 1
12 3823 2 1 10 TYR CZ C -18.149 -2.013 -2.500 1.00 . B B . 10 TYR CZ 1 1
12 3824 2 1 10 TYR H H -13.231 -1.174 -4.503 1.00 . B B . 10 TYR H 1 1
12 3825 2 1 10 TYR HA H -13.655 -3.932 -3.568 1.00 . B B . 10 TYR HA 1 1
12 3826 2 1 10 TYR HB2 H -14.893 -2.473 -5.911 1.00 . B B . 10 TYR HB2 1 1
12 3827 2 1 10 TYR HB3 H -15.184 -4.163 -5.508 1.00 . B B . 10 TYR HB3 1 1
12 3828 2 1 10 TYR HD1 H -15.675 -0.685 -4.354 1.00 . B B . 10 TYR HD1 1 1
12 3829 2 1 10 TYR HD2 H -16.733 -4.771 -3.809 1.00 . B B . 10 TYR HD2 1 1
12 3830 2 1 10 TYR HE1 H -17.508 -0.006 -2.864 1.00 . B B . 10 TYR HE1 1 1
12 3831 2 1 10 TYR HE2 H -18.570 -4.102 -2.319 1.00 . B B . 10 TYR HE2 1 1
12 3832 2 1 10 TYR HH H -19.691 -0.943 -2.084 1.00 . B B . 10 TYR HH 1 1
12 3833 2 1 10 TYR N N -13.217 -1.942 -3.896 1.00 . B B . 10 TYR N 1 1
12 3834 2 1 10 TYR O O -12.040 -4.911 -5.160 1.00 . B B . 10 TYR O 1 1
12 3835 2 1 10 TYR OH O -19.176 -1.635 -1.665 1.00 . B B . 10 TYR OH 1 1
12 3836 2 1 11 NH2 HN1 H -12.612 -2.109 -6.527 1.00 . B B . 11 NH2 HN1 1 1
12 3837 2 1 11 NH2 HN2 H -11.484 -3.335 -7.061 1.00 . B B . 11 NH2 HN2 1 1
12 3838 2 1 11 NH2 N N -12.180 -3.014 -6.404 1.00 . B B . 11 NH2 N 1 1
12 3839 3 2 1 ZN ZN ZN 1.604 -3.323 -0.975 1.00 . C A . 101 ZN ZN 1 1
12 3840 4 2 1 ZN ZN ZN -1.430 2.909 -2.044 1.00 . D A . 102 ZN ZN 1 1
13 3841 1 1 1 ASP C C 0.512 5.374 -1.668 1.00 . A A . 1 ASP C 1 1
13 3842 1 1 1 ASP CA C 0.431 6.446 -0.587 1.00 . A A . 1 ASP CA 1 1
13 3843 1 1 1 ASP CB C 0.467 5.798 0.799 1.00 . A A . 1 ASP CB 1 1
13 3844 1 1 1 ASP CG C 0.636 6.816 1.910 1.00 . A A . 1 ASP CG 1 1
13 3845 1 1 1 ASP H1 H -0.706 8.103 -0.147 1.00 . A A . 1 ASP H1 1 1
13 3846 1 1 1 ASP H2 H -1.600 6.650 -0.338 1.00 . A A . 1 ASP H2 1 1
13 3847 1 1 1 ASP H3 H -0.962 7.455 -1.713 1.00 . A A . 1 ASP H3 1 1
13 3848 1 1 1 ASP HA H 1.273 7.116 -0.689 1.00 . A A . 1 ASP HA 1 1
13 3849 1 1 1 ASP HB2 H -0.458 5.267 0.963 1.00 . A A . 1 ASP HB2 1 1
13 3850 1 1 1 ASP HB3 H 1.291 5.101 0.843 1.00 . A A . 1 ASP HB3 1 1
13 3851 1 1 1 ASP N N -0.822 7.235 -0.708 1.00 . A A . 1 ASP N 1 1
13 3852 1 1 1 ASP O O -0.503 4.978 -2.239 1.00 . A A . 1 ASP O 1 1
13 3853 1 1 1 ASP OD1 O 0.306 6.491 3.069 1.00 . A A . 1 ASP OD1 1 1
13 3854 1 1 1 ASP OD2 O 1.101 7.940 1.620 1.00 . A A . 1 ASP OD2 1 1
13 3855 1 1 2 ALA C C 2.651 2.671 -2.357 1.00 . A A . 2 ALA C 1 1
13 3856 1 1 2 ALA CA C 1.938 3.879 -2.954 1.00 . A A . 2 ALA CA 1 1
13 3857 1 1 2 ALA CB C 2.730 4.442 -4.122 1.00 . A A . 2 ALA CB 1 1
13 3858 1 1 2 ALA H H 2.499 5.261 -1.455 1.00 . A A . 2 ALA H 1 1
13 3859 1 1 2 ALA HA H 0.970 3.567 -3.321 1.00 . A A . 2 ALA HA 1 1
13 3860 1 1 2 ALA HB1 H 2.992 5.470 -3.916 1.00 . A A . 2 ALA HB1 1 1
13 3861 1 1 2 ALA HB2 H 2.131 4.397 -5.019 1.00 . A A . 2 ALA HB2 1 1
13 3862 1 1 2 ALA HB3 H 3.632 3.863 -4.261 1.00 . A A . 2 ALA HB3 1 1
13 3863 1 1 2 ALA N N 1.726 4.906 -1.943 1.00 . A A . 2 ALA N 1 1
13 3864 1 1 2 ALA O O 3.067 2.693 -1.199 1.00 . A A . 2 ALA O 1 1
13 3865 1 1 3 GLU C C 4.777 0.704 -2.025 1.00 . A A . 3 GLU C 1 1
13 3866 1 1 3 GLU CA C 3.446 0.393 -2.703 1.00 . A A . 3 GLU CA 1 1
13 3867 1 1 3 GLU CB C 3.672 -0.555 -3.883 1.00 . A A . 3 GLU CB 1 1
13 3868 1 1 3 GLU CD C 2.302 -2.669 -3.713 1.00 . A A . 3 GLU CD 1 1
13 3869 1 1 3 GLU CG C 3.656 -2.024 -3.495 1.00 . A A . 3 GLU CG 1 1
13 3870 1 1 3 GLU H H 2.432 1.657 -4.066 1.00 . A A . 3 GLU H 1 1
13 3871 1 1 3 GLU HA H 2.798 -0.089 -1.987 1.00 . A A . 3 GLU HA 1 1
13 3872 1 1 3 GLU HB2 H 2.896 -0.389 -4.615 1.00 . A A . 3 GLU HB2 1 1
13 3873 1 1 3 GLU HB3 H 4.630 -0.334 -4.331 1.00 . A A . 3 GLU HB3 1 1
13 3874 1 1 3 GLU HG2 H 4.386 -2.550 -4.090 1.00 . A A . 3 GLU HG2 1 1
13 3875 1 1 3 GLU HG3 H 3.914 -2.111 -2.450 1.00 . A A . 3 GLU HG3 1 1
13 3876 1 1 3 GLU N N 2.786 1.615 -3.153 1.00 . A A . 3 GLU N 1 1
13 3877 1 1 3 GLU O O 5.147 0.072 -1.037 1.00 . A A . 3 GLU O 1 1
13 3878 1 1 3 GLU OE1 O 1.490 -2.675 -2.765 1.00 . A A . 3 GLU OE1 1 1
13 3879 1 1 3 GLU OE2 O 2.055 -3.168 -4.831 1.00 . A A . 3 GLU OE2 1 1
13 3880 1 1 4 PHE C C 6.591 2.765 -0.651 1.00 . A A . 4 PHE C 1 1
13 3881 1 1 4 PHE CA C 6.780 2.078 -1.999 1.00 . A A . 4 PHE CA 1 1
13 3882 1 1 4 PHE CB C 7.527 3.003 -2.960 1.00 . A A . 4 PHE CB 1 1
13 3883 1 1 4 PHE CD1 C 7.024 5.375 -2.308 1.00 . A A . 4 PHE CD1 1 1
13 3884 1 1 4 PHE CD2 C 6.023 4.510 -4.291 1.00 . A A . 4 PHE CD2 1 1
13 3885 1 1 4 PHE CE1 C 6.402 6.590 -2.521 1.00 . A A . 4 PHE CE1 1 1
13 3886 1 1 4 PHE CE2 C 5.396 5.722 -4.508 1.00 . A A . 4 PHE CE2 1 1
13 3887 1 1 4 PHE CG C 6.842 4.322 -3.190 1.00 . A A . 4 PHE CG 1 1
13 3888 1 1 4 PHE CZ C 5.586 6.764 -3.621 1.00 . A A . 4 PHE CZ 1 1
13 3889 1 1 4 PHE H H 5.148 2.158 -3.344 1.00 . A A . 4 PHE H 1 1
13 3890 1 1 4 PHE HA H 7.361 1.180 -1.852 1.00 . A A . 4 PHE HA 1 1
13 3891 1 1 4 PHE HB2 H 8.508 3.207 -2.561 1.00 . A A . 4 PHE HB2 1 1
13 3892 1 1 4 PHE HB3 H 7.629 2.511 -3.916 1.00 . A A . 4 PHE HB3 1 1
13 3893 1 1 4 PHE HD1 H 7.661 5.241 -1.447 1.00 . A A . 4 PHE HD1 1 1
13 3894 1 1 4 PHE HD2 H 5.873 3.695 -4.984 1.00 . A A . 4 PHE HD2 1 1
13 3895 1 1 4 PHE HE1 H 6.552 7.403 -1.826 1.00 . A A . 4 PHE HE1 1 1
13 3896 1 1 4 PHE HE2 H 4.760 5.855 -5.370 1.00 . A A . 4 PHE HE2 1 1
13 3897 1 1 4 PHE HZ H 5.098 7.713 -3.790 1.00 . A A . 4 PHE HZ 1 1
13 3898 1 1 4 PHE N N 5.493 1.685 -2.560 1.00 . A A . 4 PHE N 1 1
13 3899 1 1 4 PHE O O 7.436 2.652 0.238 1.00 . A A . 4 PHE O 1 1
13 3900 1 1 5 ARG C C 4.641 3.216 1.788 1.00 . A A . 5 ARG C 1 1
13 3901 1 1 5 ARG CA C 5.176 4.178 0.731 1.00 . A A . 5 ARG CA 1 1
13 3902 1 1 5 ARG CB C 4.156 5.287 0.473 1.00 . A A . 5 ARG CB 1 1
13 3903 1 1 5 ARG CD C 5.105 7.374 1.499 1.00 . A A . 5 ARG CD 1 1
13 3904 1 1 5 ARG CG C 4.047 6.287 1.610 1.00 . A A . 5 ARG CG 1 1
13 3905 1 1 5 ARG CZ C 5.637 9.458 2.702 1.00 . A A . 5 ARG CZ 1 1
13 3906 1 1 5 ARG H H 4.842 3.523 -1.250 1.00 . A A . 5 ARG H 1 1
13 3907 1 1 5 ARG HA H 6.091 4.620 1.094 1.00 . A A . 5 ARG HA 1 1
13 3908 1 1 5 ARG HB2 H 4.439 5.821 -0.423 1.00 . A A . 5 ARG HB2 1 1
13 3909 1 1 5 ARG HB3 H 3.186 4.838 0.323 1.00 . A A . 5 ARG HB3 1 1
13 3910 1 1 5 ARG HD2 H 6.070 6.907 1.373 1.00 . A A . 5 ARG HD2 1 1
13 3911 1 1 5 ARG HD3 H 4.885 7.985 0.637 1.00 . A A . 5 ARG HD3 1 1
13 3912 1 1 5 ARG HE H 4.772 7.857 3.518 1.00 . A A . 5 ARG HE 1 1
13 3913 1 1 5 ARG HG2 H 3.071 6.745 1.578 1.00 . A A . 5 ARG HG2 1 1
13 3914 1 1 5 ARG HG3 H 4.175 5.767 2.546 1.00 . A A . 5 ARG HG3 1 1
13 3915 1 1 5 ARG HH11 H 6.159 9.466 0.747 1.00 . A A . 5 ARG HH11 1 1
13 3916 1 1 5 ARG HH12 H 6.519 10.920 1.616 1.00 . A A . 5 ARG HH12 1 1
13 3917 1 1 5 ARG HH21 H 5.244 9.767 4.660 1.00 . A A . 5 ARG HH21 1 1
13 3918 1 1 5 ARG HH22 H 6.000 11.091 3.837 1.00 . A A . 5 ARG HH22 1 1
13 3919 1 1 5 ARG N N 5.477 3.474 -0.506 1.00 . A A . 5 ARG N 1 1
13 3920 1 1 5 ARG NE N 5.140 8.224 2.687 1.00 . A A . 5 ARG NE 1 1
13 3921 1 1 5 ARG NH1 N 6.146 9.992 1.598 1.00 . A A . 5 ARG NH1 1 1
13 3922 1 1 5 ARG NH2 N 5.627 10.164 3.825 1.00 . A A . 5 ARG NH2 1 1
13 3923 1 1 5 ARG O O 4.979 3.321 2.967 1.00 . A A . 5 ARG O 1 1
13 3924 1 1 6 HIS C C 4.282 0.347 2.784 1.00 . A A . 6 HIS C 1 1
13 3925 1 1 6 HIS CA C 3.217 1.299 2.263 1.00 . A A . 6 HIS CA 1 1
13 3926 1 1 6 HIS CB C 2.130 0.494 1.552 1.00 . A A . 6 HIS CB 1 1
13 3927 1 1 6 HIS CD2 C 0.771 1.421 -0.436 1.00 . A A . 6 HIS CD2 1 1
13 3928 1 1 6 HIS CE1 C -0.534 2.781 0.621 1.00 . A A . 6 HIS CE1 1 1
13 3929 1 1 6 HIS CG C 1.094 1.334 0.877 1.00 . A A . 6 HIS CG 1 1
13 3930 1 1 6 HIS H H 3.571 2.250 0.402 1.00 . A A . 6 HIS H 1 1
13 3931 1 1 6 HIS HA H 2.779 1.829 3.095 1.00 . A A . 6 HIS HA 1 1
13 3932 1 1 6 HIS HB2 H 2.590 -0.126 0.798 1.00 . A A . 6 HIS HB2 1 1
13 3933 1 1 6 HIS HB3 H 1.630 -0.136 2.272 1.00 . A A . 6 HIS HB3 1 1
13 3934 1 1 6 HIS HD1 H 0.240 2.372 2.501 1.00 . A A . 6 HIS HD1 1 1
13 3935 1 1 6 HIS HD2 H 1.233 0.866 -1.241 1.00 . A A . 6 HIS HD2 1 1
13 3936 1 1 6 HIS HE1 H -1.299 3.510 0.848 1.00 . A A . 6 HIS HE1 1 1
13 3937 1 1 6 HIS N N 3.802 2.281 1.355 1.00 . A A . 6 HIS N 1 1
13 3938 1 1 6 HIS ND1 N 0.257 2.204 1.535 1.00 . A A . 6 HIS ND1 1 1
13 3939 1 1 6 HIS NE2 N -0.260 2.342 -0.592 1.00 . A A . 6 HIS NE2 1 1
13 3940 1 1 6 HIS O O 4.322 0.026 3.972 1.00 . A A . 6 HIS O 1 1
13 3941 1 1 7 HIS C C 7.490 -0.290 2.559 1.00 . A A . 7 HIS C 1 1
13 3942 1 1 7 HIS CA C 6.202 -1.035 2.230 1.00 . A A . 7 HIS CA 1 1
13 3943 1 1 7 HIS CB C 6.437 -2.017 1.082 1.00 . A A . 7 HIS CB 1 1
13 3944 1 1 7 HIS CD2 C 4.129 -2.552 0.028 1.00 . A A . 7 HIS CD2 1 1
13 3945 1 1 7 HIS CE1 C 3.893 -4.589 0.712 1.00 . A A . 7 HIS CE1 1 1
13 3946 1 1 7 HIS CG C 5.236 -2.853 0.758 1.00 . A A . 7 HIS CG 1 1
13 3947 1 1 7 HIS H H 5.043 0.182 0.947 1.00 . A A . 7 HIS H 1 1
13 3948 1 1 7 HIS HA H 5.887 -1.586 3.102 1.00 . A A . 7 HIS HA 1 1
13 3949 1 1 7 HIS HB2 H 6.707 -1.465 0.195 1.00 . A A . 7 HIS HB2 1 1
13 3950 1 1 7 HIS HB3 H 7.246 -2.683 1.346 1.00 . A A . 7 HIS HB3 1 1
13 3951 1 1 7 HIS HD1 H 5.694 -4.662 1.738 1.00 . A A . 7 HIS HD1 1 1
13 3952 1 1 7 HIS HD2 H 3.915 -1.605 -0.444 1.00 . A A . 7 HIS HD2 1 1
13 3953 1 1 7 HIS HE1 H 3.486 -5.571 0.900 1.00 . A A . 7 HIS HE1 1 1
13 3954 1 1 7 HIS N N 5.136 -0.108 1.879 1.00 . A A . 7 HIS N 1 1
13 3955 1 1 7 HIS ND1 N 5.068 -4.151 1.186 1.00 . A A . 7 HIS ND1 1 1
13 3956 1 1 7 HIS NE2 N 3.288 -3.659 0.003 1.00 . A A . 7 HIS NE2 1 1
13 3957 1 1 7 HIS O O 7.872 0.651 1.862 1.00 . A A . 7 HIS O 1 1
13 3958 1 1 8 SER C C 10.542 -1.103 4.045 1.00 . A A . 8 SER C 1 1
13 3959 1 1 8 SER CA C 9.399 -0.095 4.056 1.00 . A A . 8 SER CA 1 1
13 3960 1 1 8 SER CB C 9.240 0.497 5.459 1.00 . A A . 8 SER CB 1 1
13 3961 1 1 8 SER H H 7.795 -1.472 4.141 1.00 . A A . 8 SER H 1 1
13 3962 1 1 8 SER HA H 9.630 0.701 3.362 1.00 . A A . 8 SER HA 1 1
13 3963 1 1 8 SER HB2 H 8.436 1.220 5.452 1.00 . A A . 8 SER HB2 1 1
13 3964 1 1 8 SER HB3 H 9.009 -0.293 6.156 1.00 . A A . 8 SER HB3 1 1
13 3965 1 1 8 SER HG H 10.747 1.718 5.177 1.00 . A A . 8 SER HG 1 1
13 3966 1 1 8 SER N N 8.154 -0.718 3.627 1.00 . A A . 8 SER N 1 1
13 3967 1 1 8 SER O O 10.372 -2.254 4.447 1.00 . A A . 8 SER O 1 1
13 3968 1 1 8 SER OG O 10.430 1.143 5.878 1.00 . A A . 8 SER OG 1 1
13 3969 1 1 9 GLY C C 13.349 -1.769 2.110 1.00 . A A . 9 GLY C 1 1
13 3970 1 1 9 GLY CA C 12.864 -1.541 3.527 1.00 . A A . 9 GLY CA 1 1
13 3971 1 1 9 GLY H H 11.784 0.263 3.275 1.00 . A A . 9 GLY H 1 1
13 3972 1 1 9 GLY HA2 H 13.663 -1.100 4.103 1.00 . A A . 9 GLY HA2 1 1
13 3973 1 1 9 GLY HA3 H 12.601 -2.493 3.963 1.00 . A A . 9 GLY HA3 1 1
13 3974 1 1 9 GLY N N 11.707 -0.664 3.582 1.00 . A A . 9 GLY N 1 1
13 3975 1 1 9 GLY O O 12.607 -1.561 1.149 1.00 . A A . 9 GLY O 1 1
13 3976 1 1 10 TYR C C 15.423 -3.941 0.452 1.00 . A A . 10 TYR C 1 1
13 3977 1 1 10 TYR CA C 15.189 -2.450 0.666 1.00 . A A . 10 TYR CA 1 1
13 3978 1 1 10 TYR CB C 16.506 -1.688 0.526 1.00 . A A . 10 TYR CB 1 1
13 3979 1 1 10 TYR CD1 C 16.387 0.422 1.905 1.00 . A A . 10 TYR CD1 1 1
13 3980 1 1 10 TYR CD2 C 16.172 0.611 -0.462 1.00 . A A . 10 TYR CD2 1 1
13 3981 1 1 10 TYR CE1 C 16.244 1.790 2.031 1.00 . A A . 10 TYR CE1 1 1
13 3982 1 1 10 TYR CE2 C 16.030 1.980 -0.345 1.00 . A A . 10 TYR CE2 1 1
13 3983 1 1 10 TYR CG C 16.352 -0.191 0.658 1.00 . A A . 10 TYR CG 1 1
13 3984 1 1 10 TYR CZ C 16.067 2.566 0.903 1.00 . A A . 10 TYR CZ 1 1
13 3985 1 1 10 TYR H H 15.144 -2.340 2.780 1.00 . A A . 10 TYR H 1 1
13 3986 1 1 10 TYR HA H 14.497 -2.095 -0.082 1.00 . A A . 10 TYR HA 1 1
13 3987 1 1 10 TYR HB2 H 17.191 -2.019 1.294 1.00 . A A . 10 TYR HB2 1 1
13 3988 1 1 10 TYR HB3 H 16.933 -1.895 -0.444 1.00 . A A . 10 TYR HB3 1 1
13 3989 1 1 10 TYR HD1 H 16.524 -0.188 2.786 1.00 . A A . 10 TYR HD1 1 1
13 3990 1 1 10 TYR HD2 H 16.142 0.148 -1.437 1.00 . A A . 10 TYR HD2 1 1
13 3991 1 1 10 TYR HE1 H 16.274 2.249 3.008 1.00 . A A . 10 TYR HE1 1 1
13 3992 1 1 10 TYR HE2 H 15.891 2.585 -1.228 1.00 . A A . 10 TYR HE2 1 1
13 3993 1 1 10 TYR HH H 16.476 4.248 1.742 1.00 . A A . 10 TYR HH 1 1
13 3994 1 1 10 TYR N N 14.601 -2.195 1.977 1.00 . A A . 10 TYR N 1 1
13 3995 1 1 10 TYR O O 15.387 -4.695 1.448 1.00 . A A . 10 TYR O 1 1
13 3996 1 1 10 TYR OH O 15.925 3.929 1.024 1.00 . A A . 10 TYR OH 1 1
13 3997 1 1 11 NH2 HN1 H 15.668 -3.716 -1.555 1.00 . A A . 11 NH2 HN1 1 1
13 3998 1 1 11 NH2 HN2 H 15.809 -5.355 -0.959 1.00 . A A . 11 NH2 HN2 1 1
13 3999 1 1 11 NH2 N N 15.652 -4.372 -0.787 1.00 . A A . 11 NH2 N 1 1
13 4000 2 1 1 ASP C C -0.451 -5.751 -0.253 1.00 . B B . 1 ASP C 1 1
13 4001 2 1 1 ASP CA C -0.556 -6.535 1.051 1.00 . B B . 1 ASP CA 1 1
13 4002 2 1 1 ASP CB C -1.197 -5.671 2.137 1.00 . B B . 1 ASP CB 1 1
13 4003 2 1 1 ASP CG C -1.608 -6.480 3.352 1.00 . B B . 1 ASP CG 1 1
13 4004 2 1 1 ASP H1 H 0.682 -7.292 2.510 1.00 . B B . 1 ASP H1 1 1
13 4005 2 1 1 ASP H2 H 1.427 -6.163 1.454 1.00 . B B . 1 ASP H2 1 1
13 4006 2 1 1 ASP H3 H 1.092 -7.758 0.912 1.00 . B B . 1 ASP H3 1 1
13 4007 2 1 1 ASP HA H -1.167 -7.411 0.886 1.00 . B B . 1 ASP HA 1 1
13 4008 2 1 1 ASP HB2 H -0.493 -4.916 2.451 1.00 . B B . 1 ASP HB2 1 1
13 4009 2 1 1 ASP HB3 H -2.075 -5.192 1.734 1.00 . B B . 1 ASP HB3 1 1
13 4010 2 1 1 ASP N N 0.782 -6.976 1.524 1.00 . B B . 1 ASP N 1 1
13 4011 2 1 1 ASP O O 0.644 -5.385 -0.681 1.00 . B B . 1 ASP O 1 1
13 4012 2 1 1 ASP OD1 O -1.932 -7.676 3.188 1.00 . B B . 1 ASP OD1 1 1
13 4013 2 1 1 ASP OD2 O -1.604 -5.920 4.468 1.00 . B B . 1 ASP OD2 1 1
13 4014 2 1 2 ALA C C -2.323 -3.412 -1.977 1.00 . B B . 2 ALA C 1 1
13 4015 2 1 2 ALA CA C -1.630 -4.760 -2.139 1.00 . B B . 2 ALA CA 1 1
13 4016 2 1 2 ALA CB C -2.327 -5.586 -3.210 1.00 . B B . 2 ALA CB 1 1
13 4017 2 1 2 ALA H H -2.435 -5.816 -0.491 1.00 . B B . 2 ALA H 1 1
13 4018 2 1 2 ALA HA H -0.611 -4.591 -2.456 1.00 . B B . 2 ALA HA 1 1
13 4019 2 1 2 ALA HB1 H -3.159 -5.028 -3.612 1.00 . B B . 2 ALA HB1 1 1
13 4020 2 1 2 ALA HB2 H -2.686 -6.507 -2.777 1.00 . B B . 2 ALA HB2 1 1
13 4021 2 1 2 ALA HB3 H -1.628 -5.812 -4.004 1.00 . B B . 2 ALA HB3 1 1
13 4022 2 1 2 ALA N N -1.594 -5.497 -0.881 1.00 . B B . 2 ALA N 1 1
13 4023 2 1 2 ALA O O -2.801 -3.071 -0.895 1.00 . B B . 2 ALA O 1 1
13 4024 2 1 3 GLU C C -4.424 -1.395 -2.539 1.00 . B B . 3 GLU C 1 1
13 4025 2 1 3 GLU CA C -2.993 -1.330 -3.061 1.00 . B B . 3 GLU CA 1 1
13 4026 2 1 3 GLU CB C -2.982 -0.738 -4.472 1.00 . B B . 3 GLU CB 1 1
13 4027 2 1 3 GLU CD C -1.624 1.390 -4.564 1.00 . B B . 3 GLU CD 1 1
13 4028 2 1 3 GLU CG C -3.011 0.782 -4.494 1.00 . B B . 3 GLU CG 1 1
13 4029 2 1 3 GLU H H -1.964 -2.982 -3.894 1.00 . B B . 3 GLU H 1 1
13 4030 2 1 3 GLU HA H -2.416 -0.691 -2.413 1.00 . B B . 3 GLU HA 1 1
13 4031 2 1 3 GLU HB2 H -2.088 -1.066 -4.980 1.00 . B B . 3 GLU HB2 1 1
13 4032 2 1 3 GLU HB3 H -3.846 -1.100 -5.009 1.00 . B B . 3 GLU HB3 1 1
13 4033 2 1 3 GLU HG2 H -3.573 1.106 -5.356 1.00 . B B . 3 GLU HG2 1 1
13 4034 2 1 3 GLU HG3 H -3.497 1.133 -3.596 1.00 . B B . 3 GLU HG3 1 1
13 4035 2 1 3 GLU N N -2.367 -2.648 -3.065 1.00 . B B . 3 GLU N 1 1
13 4036 2 1 3 GLU O O -4.873 -0.500 -1.823 1.00 . B B . 3 GLU O 1 1
13 4037 2 1 3 GLU OE1 O -1.074 1.736 -3.497 1.00 . B B . 3 GLU OE1 1 1
13 4038 2 1 3 GLU OE2 O -1.088 1.517 -5.685 1.00 . B B . 3 GLU OE2 1 1
13 4039 2 1 4 PHE C C -6.565 -2.916 -0.959 1.00 . B B . 4 PHE C 1 1
13 4040 2 1 4 PHE CA C -6.515 -2.620 -2.454 1.00 . B B . 4 PHE CA 1 1
13 4041 2 1 4 PHE CB C -7.209 -3.732 -3.249 1.00 . B B . 4 PHE CB 1 1
13 4042 2 1 4 PHE CD1 C -7.362 -5.927 -2.042 1.00 . B B . 4 PHE CD1 1 1
13 4043 2 1 4 PHE CD2 C -5.566 -5.601 -3.576 1.00 . B B . 4 PHE CD2 1 1
13 4044 2 1 4 PHE CE1 C -6.901 -7.200 -1.767 1.00 . B B . 4 PHE CE1 1 1
13 4045 2 1 4 PHE CE2 C -5.099 -6.873 -3.304 1.00 . B B . 4 PHE CE2 1 1
13 4046 2 1 4 PHE CG C -6.701 -5.114 -2.948 1.00 . B B . 4 PHE CG 1 1
13 4047 2 1 4 PHE CZ C -5.768 -7.674 -2.399 1.00 . B B . 4 PHE CZ 1 1
13 4048 2 1 4 PHE H H -4.730 -3.137 -3.465 1.00 . B B . 4 PHE H 1 1
13 4049 2 1 4 PHE HA H -7.030 -1.688 -2.636 1.00 . B B . 4 PHE HA 1 1
13 4050 2 1 4 PHE HB2 H -8.265 -3.714 -3.026 1.00 . B B . 4 PHE HB2 1 1
13 4051 2 1 4 PHE HB3 H -7.068 -3.548 -4.304 1.00 . B B . 4 PHE HB3 1 1
13 4052 2 1 4 PHE HD1 H -8.248 -5.557 -1.547 1.00 . B B . 4 PHE HD1 1 1
13 4053 2 1 4 PHE HD2 H -5.042 -4.975 -4.282 1.00 . B B . 4 PHE HD2 1 1
13 4054 2 1 4 PHE HE1 H -7.426 -7.824 -1.060 1.00 . B B . 4 PHE HE1 1 1
13 4055 2 1 4 PHE HE2 H -4.213 -7.242 -3.800 1.00 . B B . 4 PHE HE2 1 1
13 4056 2 1 4 PHE HZ H -5.405 -8.669 -2.186 1.00 . B B . 4 PHE HZ 1 1
13 4057 2 1 4 PHE N N -5.138 -2.453 -2.897 1.00 . B B . 4 PHE N 1 1
13 4058 2 1 4 PHE O O -7.530 -2.565 -0.279 1.00 . B B . 4 PHE O 1 1
13 4059 2 1 5 ARG C C -5.059 -2.641 1.775 1.00 . B B . 5 ARG C 1 1
13 4060 2 1 5 ARG CA C -5.434 -3.876 0.968 1.00 . B B . 5 ARG CA 1 1
13 4061 2 1 5 ARG CB C -4.395 -4.970 1.205 1.00 . B B . 5 ARG CB 1 1
13 4062 2 1 5 ARG CD C -5.988 -6.914 1.283 1.00 . B B . 5 ARG CD 1 1
13 4063 2 1 5 ARG CG C -4.764 -6.314 0.605 1.00 . B B . 5 ARG CG 1 1
13 4064 2 1 5 ARG CZ C -5.736 -8.865 2.779 1.00 . B B . 5 ARG CZ 1 1
13 4065 2 1 5 ARG H H -4.770 -3.794 -1.041 1.00 . B B . 5 ARG H 1 1
13 4066 2 1 5 ARG HA H -6.401 -4.226 1.288 1.00 . B B . 5 ARG HA 1 1
13 4067 2 1 5 ARG HB2 H -3.461 -4.656 0.769 1.00 . B B . 5 ARG HB2 1 1
13 4068 2 1 5 ARG HB3 H -4.260 -5.098 2.269 1.00 . B B . 5 ARG HB3 1 1
13 4069 2 1 5 ARG HD2 H -6.702 -6.126 1.467 1.00 . B B . 5 ARG HD2 1 1
13 4070 2 1 5 ARG HD3 H -6.423 -7.646 0.623 1.00 . B B . 5 ARG HD3 1 1
13 4071 2 1 5 ARG HE H -5.348 -6.974 3.284 1.00 . B B . 5 ARG HE 1 1
13 4072 2 1 5 ARG HG2 H -4.970 -6.180 -0.443 1.00 . B B . 5 ARG HG2 1 1
13 4073 2 1 5 ARG HG3 H -3.930 -6.989 0.726 1.00 . B B . 5 ARG HG3 1 1
13 4074 2 1 5 ARG HH11 H -6.385 -9.340 0.922 1.00 . B B . 5 ARG HH11 1 1
13 4075 2 1 5 ARG HH12 H -6.199 -10.675 2.005 1.00 . B B . 5 ARG HH12 1 1
13 4076 2 1 5 ARG HH21 H -5.107 -8.737 4.695 1.00 . B B . 5 ARG HH21 1 1
13 4077 2 1 5 ARG HH22 H -5.475 -10.335 4.142 1.00 . B B . 5 ARG HH22 1 1
13 4078 2 1 5 ARG N N -5.515 -3.550 -0.451 1.00 . B B . 5 ARG N 1 1
13 4079 2 1 5 ARG NE N -5.652 -7.554 2.555 1.00 . B B . 5 ARG NE 1 1
13 4080 2 1 5 ARG NH1 N -6.140 -9.694 1.823 1.00 . B B . 5 ARG NH1 1 1
13 4081 2 1 5 ARG NH2 N -5.413 -9.353 3.970 1.00 . B B . 5 ARG NH2 1 1
13 4082 2 1 5 ARG O O -5.618 -2.388 2.842 1.00 . B B . 5 ARG O 1 1
13 4083 2 1 6 HIS C C -4.764 0.376 1.960 1.00 . B B . 6 HIS C 1 1
13 4084 2 1 6 HIS CA C -3.651 -0.661 1.921 1.00 . B B . 6 HIS CA 1 1
13 4085 2 1 6 HIS CB C -2.437 -0.073 1.199 1.00 . B B . 6 HIS CB 1 1
13 4086 2 1 6 HIS CD2 C -0.772 -1.434 -0.232 1.00 . B B . 6 HIS CD2 1 1
13 4087 2 1 6 HIS CE1 C 0.239 -2.537 1.327 1.00 . B B . 6 HIS CE1 1 1
13 4088 2 1 6 HIS CG C -1.338 -1.056 0.941 1.00 . B B . 6 HIS CG 1 1
13 4089 2 1 6 HIS H H -3.704 -2.134 0.397 1.00 . B B . 6 HIS H 1 1
13 4090 2 1 6 HIS HA H -3.373 -0.919 2.930 1.00 . B B . 6 HIS HA 1 1
13 4091 2 1 6 HIS HB2 H -2.755 0.319 0.245 1.00 . B B . 6 HIS HB2 1 1
13 4092 2 1 6 HIS HB3 H -2.031 0.732 1.794 1.00 . B B . 6 HIS HB3 1 1
13 4093 2 1 6 HIS HD1 H -0.861 -1.719 2.886 1.00 . B B . 6 HIS HD1 1 1
13 4094 2 1 6 HIS HD2 H -1.039 -1.066 -1.210 1.00 . B B . 6 HIS HD2 1 1
13 4095 2 1 6 HIS HE1 H 0.916 -3.200 1.848 1.00 . B B . 6 HIS HE1 1 1
13 4096 2 1 6 HIS N N -4.107 -1.876 1.253 1.00 . B B . 6 HIS N 1 1
13 4097 2 1 6 HIS ND1 N -0.683 -1.767 1.924 1.00 . B B . 6 HIS ND1 1 1
13 4098 2 1 6 HIS NE2 N 0.223 -2.370 0.021 1.00 . B B . 6 HIS NE2 1 1
13 4099 2 1 6 HIS O O -4.955 1.067 2.961 1.00 . B B . 6 HIS O 1 1
13 4100 2 1 7 HIS C C -7.928 0.754 1.009 1.00 . B B . 7 HIS C 1 1
13 4101 2 1 7 HIS CA C -6.588 1.431 0.744 1.00 . B B . 7 HIS CA 1 1
13 4102 2 1 7 HIS CB C -6.593 2.069 -0.645 1.00 . B B . 7 HIS CB 1 1
13 4103 2 1 7 HIS CD2 C -4.098 2.383 -1.277 1.00 . B B . 7 HIS CD2 1 1
13 4104 2 1 7 HIS CE1 C -4.012 4.545 -1.297 1.00 . B B . 7 HIS CE1 1 1
13 4105 2 1 7 HIS CG C -5.343 2.831 -0.961 1.00 . B B . 7 HIS CG 1 1
13 4106 2 1 7 HIS H H -5.284 -0.100 0.092 1.00 . B B . 7 HIS H 1 1
13 4107 2 1 7 HIS HA H -6.435 2.203 1.484 1.00 . B B . 7 HIS HA 1 1
13 4108 2 1 7 HIS HB2 H -6.703 1.293 -1.389 1.00 . B B . 7 HIS HB2 1 1
13 4109 2 1 7 HIS HB3 H -7.427 2.751 -0.719 1.00 . B B . 7 HIS HB3 1 1
13 4110 2 1 7 HIS HD1 H -6.003 4.826 -0.789 1.00 . B B . 7 HIS HD1 1 1
13 4111 2 1 7 HIS HD2 H -3.795 1.349 -1.352 1.00 . B B . 7 HIS HD2 1 1
13 4112 2 1 7 HIS HE1 H -3.659 5.562 -1.385 1.00 . B B . 7 HIS HE1 1 1
13 4113 2 1 7 HIS N N -5.493 0.478 0.855 1.00 . B B . 7 HIS N 1 1
13 4114 2 1 7 HIS ND1 N -5.269 4.206 -0.977 1.00 . B B . 7 HIS ND1 1 1
13 4115 2 1 7 HIS NE2 N -3.263 3.476 -1.488 1.00 . B B . 7 HIS NE2 1 1
13 4116 2 1 7 HIS O O -8.048 -0.465 0.915 1.00 . B B . 7 HIS O 1 1
13 4117 2 1 8 SER C C -11.317 1.810 0.813 1.00 . B B . 8 SER C 1 1
13 4118 2 1 8 SER CA C -10.268 1.042 1.609 1.00 . B B . 8 SER CA 1 1
13 4119 2 1 8 SER CB C -10.577 1.130 3.104 1.00 . B B . 8 SER CB 1 1
13 4120 2 1 8 SER H H -8.773 2.523 1.391 1.00 . B B . 8 SER H 1 1
13 4121 2 1 8 SER HA H -10.290 0.006 1.306 1.00 . B B . 8 SER HA 1 1
13 4122 2 1 8 SER HB2 H -10.428 2.146 3.440 1.00 . B B . 8 SER HB2 1 1
13 4123 2 1 8 SER HB3 H -11.603 0.841 3.275 1.00 . B B . 8 SER HB3 1 1
13 4124 2 1 8 SER HG H -8.830 0.351 3.527 1.00 . B B . 8 SER HG 1 1
13 4125 2 1 8 SER N N -8.933 1.559 1.335 1.00 . B B . 8 SER N 1 1
13 4126 2 1 8 SER O O -11.240 3.031 0.682 1.00 . B B . 8 SER O 1 1
13 4127 2 1 8 SER OG O -9.730 0.275 3.852 1.00 . B B . 8 SER OG 1 1
13 4128 2 1 9 GLY C C -14.717 1.141 -0.198 1.00 . B B . 9 GLY C 1 1
13 4129 2 1 9 GLY CA C -13.346 1.718 -0.495 1.00 . B B . 9 GLY CA 1 1
13 4130 2 1 9 GLY H H -12.308 0.116 0.419 1.00 . B B . 9 GLY H 1 1
13 4131 2 1 9 GLY HA2 H -13.358 2.776 -0.272 1.00 . B B . 9 GLY HA2 1 1
13 4132 2 1 9 GLY HA3 H -13.131 1.585 -1.545 1.00 . B B . 9 GLY HA3 1 1
13 4133 2 1 9 GLY N N -12.297 1.086 0.283 1.00 . B B . 9 GLY N 1 1
13 4134 2 1 9 GLY O O -14.830 0.033 0.325 1.00 . B B . 9 GLY O 1 1
13 4135 2 1 10 TYR C C -17.662 0.680 -1.503 1.00 . B B . 10 TYR C 1 1
13 4136 2 1 10 TYR CA C -17.127 1.450 -0.300 1.00 . B B . 10 TYR CA 1 1
13 4137 2 1 10 TYR CB C -18.029 2.649 -0.005 1.00 . B B . 10 TYR CB 1 1
13 4138 2 1 10 TYR CD1 C -16.810 4.360 1.395 1.00 . B B . 10 TYR CD1 1 1
13 4139 2 1 10 TYR CD2 C -18.366 2.918 2.483 1.00 . B B . 10 TYR CD2 1 1
13 4140 2 1 10 TYR CE1 C -16.533 4.976 2.600 1.00 . B B . 10 TYR CE1 1 1
13 4141 2 1 10 TYR CE2 C -18.095 3.531 3.692 1.00 . B B . 10 TYR CE2 1 1
13 4142 2 1 10 TYR CG C -17.730 3.322 1.315 1.00 . B B . 10 TYR CG 1 1
13 4143 2 1 10 TYR CZ C -17.177 4.559 3.744 1.00 . B B . 10 TYR CZ 1 1
13 4144 2 1 10 TYR H H -15.604 2.767 -0.949 1.00 . B B . 10 TYR H 1 1
13 4145 2 1 10 TYR HA H -17.122 0.795 0.557 1.00 . B B . 10 TYR HA 1 1
13 4146 2 1 10 TYR HB2 H -17.908 3.384 -0.787 1.00 . B B . 10 TYR HB2 1 1
13 4147 2 1 10 TYR HB3 H -19.059 2.320 0.015 1.00 . B B . 10 TYR HB3 1 1
13 4148 2 1 10 TYR HD1 H -16.307 4.685 0.497 1.00 . B B . 10 TYR HD1 1 1
13 4149 2 1 10 TYR HD2 H -19.083 2.112 2.438 1.00 . B B . 10 TYR HD2 1 1
13 4150 2 1 10 TYR HE1 H -15.814 5.783 2.641 1.00 . B B . 10 TYR HE1 1 1
13 4151 2 1 10 TYR HE2 H -18.599 3.202 4.589 1.00 . B B . 10 TYR HE2 1 1
13 4152 2 1 10 TYR HH H -15.981 5.037 5.172 1.00 . B B . 10 TYR HH 1 1
13 4153 2 1 10 TYR N N -15.759 1.894 -0.534 1.00 . B B . 10 TYR N 1 1
13 4154 2 1 10 TYR O O -18.561 -0.165 -1.312 1.00 . B B . 10 TYR O 1 1
13 4155 2 1 10 TYR OH O -16.905 5.171 4.946 1.00 . B B . 10 TYR OH 1 1
13 4156 2 1 11 NH2 HN1 H -16.419 1.640 -2.796 1.00 . B B . 11 NH2 HN1 1 1
13 4157 2 1 11 NH2 HN2 H -17.481 0.450 -3.517 1.00 . B B . 11 NH2 HN2 1 1
13 4158 2 1 11 NH2 N N -17.146 0.945 -2.702 1.00 . B B . 11 NH2 N 1 1
13 4159 3 2 1 ZN ZN ZN 1.531 -3.580 -1.020 1.00 . C A . 101 ZN ZN 1 1
13 4160 4 2 1 ZN ZN ZN -1.369 3.132 -2.146 1.00 . D A . 102 ZN ZN 1 1
14 4161 1 1 1 ASP C C 0.458 5.313 -1.883 1.00 . A A . 1 ASP C 1 1
14 4162 1 1 1 ASP CA C 0.373 6.416 -0.834 1.00 . A A . 1 ASP CA 1 1
14 4163 1 1 1 ASP CB C 0.583 5.830 0.564 1.00 . A A . 1 ASP CB 1 1
14 4164 1 1 1 ASP CG C 0.854 6.896 1.605 1.00 . A A . 1 ASP CG 1 1
14 4165 1 1 1 ASP H1 H -1.089 7.468 -1.829 1.00 . A A . 1 ASP H1 1 1
14 4166 1 1 1 ASP H2 H -0.936 7.856 -0.164 1.00 . A A . 1 ASP H2 1 1
14 4167 1 1 1 ASP H3 H -1.675 6.382 -0.638 1.00 . A A . 1 ASP H3 1 1
14 4168 1 1 1 ASP HA H 1.139 7.151 -1.030 1.00 . A A . 1 ASP HA 1 1
14 4169 1 1 1 ASP HB2 H -0.303 5.288 0.856 1.00 . A A . 1 ASP HB2 1 1
14 4170 1 1 1 ASP HB3 H 1.424 5.150 0.541 1.00 . A A . 1 ASP HB3 1 1
14 4171 1 1 1 ASP N N -0.951 7.091 -0.869 1.00 . A A . 1 ASP N 1 1
14 4172 1 1 1 ASP O O -0.557 4.870 -2.417 1.00 . A A . 1 ASP O 1 1
14 4173 1 1 1 ASP OD1 O 1.253 8.016 1.220 1.00 . A A . 1 ASP OD1 1 1
14 4174 1 1 1 ASP OD2 O 0.670 6.614 2.808 1.00 . A A . 1 ASP OD2 1 1
14 4175 1 1 2 ALA C C 2.579 2.615 -2.512 1.00 . A A . 2 ALA C 1 1
14 4176 1 1 2 ALA CA C 1.901 3.821 -3.153 1.00 . A A . 2 ALA CA 1 1
14 4177 1 1 2 ALA CB C 2.730 4.346 -4.314 1.00 . A A . 2 ALA CB 1 1
14 4178 1 1 2 ALA H H 2.451 5.267 -1.712 1.00 . A A . 2 ALA H 1 1
14 4179 1 1 2 ALA HA H 0.938 3.516 -3.539 1.00 . A A . 2 ALA HA 1 1
14 4180 1 1 2 ALA HB1 H 3.777 4.205 -4.100 1.00 . A A . 2 ALA HB1 1 1
14 4181 1 1 2 ALA HB2 H 2.529 5.397 -4.456 1.00 . A A . 2 ALA HB2 1 1
14 4182 1 1 2 ALA HB3 H 2.471 3.807 -5.214 1.00 . A A . 2 ALA HB3 1 1
14 4183 1 1 2 ALA N N 1.680 4.874 -2.173 1.00 . A A . 2 ALA N 1 1
14 4184 1 1 2 ALA O O 2.919 2.638 -1.330 1.00 . A A . 2 ALA O 1 1
14 4185 1 1 3 GLU C C 4.727 0.623 -2.124 1.00 . A A . 3 GLU C 1 1
14 4186 1 1 3 GLU CA C 3.395 0.338 -2.815 1.00 . A A . 3 GLU CA 1 1
14 4187 1 1 3 GLU CB C 3.606 -0.641 -3.971 1.00 . A A . 3 GLU CB 1 1
14 4188 1 1 3 GLU CD C 2.579 -2.757 -3.045 1.00 . A A . 3 GLU CD 1 1
14 4189 1 1 3 GLU CG C 3.845 -2.075 -3.520 1.00 . A A . 3 GLU CG 1 1
14 4190 1 1 3 GLU H H 2.469 1.608 -4.233 1.00 . A A . 3 GLU H 1 1
14 4191 1 1 3 GLU HA H 2.724 -0.111 -2.098 1.00 . A A . 3 GLU HA 1 1
14 4192 1 1 3 GLU HB2 H 2.732 -0.628 -4.603 1.00 . A A . 3 GLU HB2 1 1
14 4193 1 1 3 GLU HB3 H 4.462 -0.321 -4.546 1.00 . A A . 3 GLU HB3 1 1
14 4194 1 1 3 GLU HG2 H 4.247 -2.636 -4.350 1.00 . A A . 3 GLU HG2 1 1
14 4195 1 1 3 GLU HG3 H 4.560 -2.070 -2.710 1.00 . A A . 3 GLU HG3 1 1
14 4196 1 1 3 GLU N N 2.768 1.563 -3.301 1.00 . A A . 3 GLU N 1 1
14 4197 1 1 3 GLU O O 5.061 -0.005 -1.121 1.00 . A A . 3 GLU O 1 1
14 4198 1 1 3 GLU OE1 O 1.702 -2.061 -2.493 1.00 . A A . 3 GLU OE1 1 1
14 4199 1 1 3 GLU OE2 O 2.460 -3.986 -3.233 1.00 . A A . 3 GLU OE2 1 1
14 4200 1 1 4 PHE C C 6.598 2.621 -0.745 1.00 . A A . 4 PHE C 1 1
14 4201 1 1 4 PHE CA C 6.780 1.913 -2.083 1.00 . A A . 4 PHE CA 1 1
14 4202 1 1 4 PHE CB C 7.590 2.792 -3.043 1.00 . A A . 4 PHE CB 1 1
14 4203 1 1 4 PHE CD1 C 7.582 5.179 -2.265 1.00 . A A . 4 PHE CD1 1 1
14 4204 1 1 4 PHE CD2 C 6.170 4.580 -4.090 1.00 . A A . 4 PHE CD2 1 1
14 4205 1 1 4 PHE CE1 C 7.140 6.485 -2.347 1.00 . A A . 4 PHE CE1 1 1
14 4206 1 1 4 PHE CE2 C 5.724 5.886 -4.177 1.00 . A A . 4 PHE CE2 1 1
14 4207 1 1 4 PHE CG C 7.102 4.212 -3.134 1.00 . A A . 4 PHE CG 1 1
14 4208 1 1 4 PHE CZ C 6.211 6.840 -3.304 1.00 . A A . 4 PHE CZ 1 1
14 4209 1 1 4 PHE H H 5.176 2.038 -3.462 1.00 . A A . 4 PHE H 1 1
14 4210 1 1 4 PHE HA H 7.321 0.992 -1.912 1.00 . A A . 4 PHE HA 1 1
14 4211 1 1 4 PHE HB2 H 8.618 2.818 -2.714 1.00 . A A . 4 PHE HB2 1 1
14 4212 1 1 4 PHE HB3 H 7.546 2.362 -4.033 1.00 . A A . 4 PHE HB3 1 1
14 4213 1 1 4 PHE HD1 H 8.309 4.902 -1.516 1.00 . A A . 4 PHE HD1 1 1
14 4214 1 1 4 PHE HD2 H 5.788 3.836 -4.772 1.00 . A A . 4 PHE HD2 1 1
14 4215 1 1 4 PHE HE1 H 7.522 7.228 -1.663 1.00 . A A . 4 PHE HE1 1 1
14 4216 1 1 4 PHE HE2 H 4.997 6.160 -4.926 1.00 . A A . 4 PHE HE2 1 1
14 4217 1 1 4 PHE HZ H 5.864 7.861 -3.371 1.00 . A A . 4 PHE HZ 1 1
14 4218 1 1 4 PHE N N 5.488 1.567 -2.663 1.00 . A A . 4 PHE N 1 1
14 4219 1 1 4 PHE O O 7.415 2.478 0.164 1.00 . A A . 4 PHE O 1 1
14 4220 1 1 5 ARG C C 4.666 3.191 1.661 1.00 . A A . 5 ARG C 1 1
14 4221 1 1 5 ARG CA C 5.223 4.121 0.588 1.00 . A A . 5 ARG CA 1 1
14 4222 1 1 5 ARG CB C 4.230 5.247 0.299 1.00 . A A . 5 ARG CB 1 1
14 4223 1 1 5 ARG CD C 5.313 6.855 1.893 1.00 . A A . 5 ARG CD 1 1
14 4224 1 1 5 ARG CG C 4.015 6.183 1.476 1.00 . A A . 5 ARG CG 1 1
14 4225 1 1 5 ARG CZ C 4.906 9.286 1.817 1.00 . A A . 5 ARG CZ 1 1
14 4226 1 1 5 ARG H H 4.904 3.460 -1.392 1.00 . A A . 5 ARG H 1 1
14 4227 1 1 5 ARG HA H 6.144 4.552 0.946 1.00 . A A . 5 ARG HA 1 1
14 4228 1 1 5 ARG HB2 H 4.594 5.829 -0.534 1.00 . A A . 5 ARG HB2 1 1
14 4229 1 1 5 ARG HB3 H 3.278 4.812 0.034 1.00 . A A . 5 ARG HB3 1 1
14 4230 1 1 5 ARG HD2 H 5.820 6.219 2.605 1.00 . A A . 5 ARG HD2 1 1
14 4231 1 1 5 ARG HD3 H 5.936 6.982 1.020 1.00 . A A . 5 ARG HD3 1 1
14 4232 1 1 5 ARG HE H 5.064 8.204 3.485 1.00 . A A . 5 ARG HE 1 1
14 4233 1 1 5 ARG HG2 H 3.302 6.942 1.192 1.00 . A A . 5 ARG HG2 1 1
14 4234 1 1 5 ARG HG3 H 3.629 5.614 2.308 1.00 . A A . 5 ARG HG3 1 1
14 4235 1 1 5 ARG HH11 H 5.058 8.407 0.001 1.00 . A A . 5 ARG HH11 1 1
14 4236 1 1 5 ARG HH12 H 4.782 10.116 -0.024 1.00 . A A . 5 ARG HH12 1 1
14 4237 1 1 5 ARG HH21 H 4.703 10.451 3.454 1.00 . A A . 5 ARG HH21 1 1
14 4238 1 1 5 ARG HH22 H 4.581 11.276 1.936 1.00 . A A . 5 ARG HH22 1 1
14 4239 1 1 5 ARG N N 5.518 3.389 -0.634 1.00 . A A . 5 ARG N 1 1
14 4240 1 1 5 ARG NE N 5.083 8.161 2.507 1.00 . A A . 5 ARG NE 1 1
14 4241 1 1 5 ARG NH1 N 4.916 9.266 0.489 1.00 . A A . 5 ARG NH1 1 1
14 4242 1 1 5 ARG NH2 N 4.714 10.431 2.454 1.00 . A A . 5 ARG NH2 1 1
14 4243 1 1 5 ARG O O 5.004 3.313 2.838 1.00 . A A . 5 ARG O 1 1
14 4244 1 1 6 HIS C C 4.265 0.366 2.730 1.00 . A A . 6 HIS C 1 1
14 4245 1 1 6 HIS CA C 3.209 1.309 2.172 1.00 . A A . 6 HIS CA 1 1
14 4246 1 1 6 HIS CB C 2.124 0.494 1.469 1.00 . A A . 6 HIS CB 1 1
14 4247 1 1 6 HIS CD2 C 0.701 1.378 -0.493 1.00 . A A . 6 HIS CD2 1 1
14 4248 1 1 6 HIS CE1 C -0.525 2.809 0.565 1.00 . A A . 6 HIS CE1 1 1
14 4249 1 1 6 HIS CG C 1.076 1.328 0.807 1.00 . A A . 6 HIS CG 1 1
14 4250 1 1 6 HIS H H 3.584 2.214 0.292 1.00 . A A . 6 HIS H 1 1
14 4251 1 1 6 HIS HA H 2.767 1.864 2.985 1.00 . A A . 6 HIS HA 1 1
14 4252 1 1 6 HIS HB2 H 2.584 -0.121 0.709 1.00 . A A . 6 HIS HB2 1 1
14 4253 1 1 6 HIS HB3 H 1.636 -0.142 2.193 1.00 . A A . 6 HIS HB3 1 1
14 4254 1 1 6 HIS HD1 H 0.316 2.446 2.426 1.00 . A A . 6 HIS HD1 1 1
14 4255 1 1 6 HIS HD2 H 1.114 0.781 -1.294 1.00 . A A . 6 HIS HD2 1 1
14 4256 1 1 6 HIS HE1 H -1.260 3.565 0.796 1.00 . A A . 6 HIS HE1 1 1
14 4257 1 1 6 HIS N N 3.811 2.262 1.245 1.00 . A A . 6 HIS N 1 1
14 4258 1 1 6 HIS ND1 N 0.288 2.243 1.468 1.00 . A A . 6 HIS ND1 1 1
14 4259 1 1 6 HIS NE2 N -0.313 2.318 -0.640 1.00 . A A . 6 HIS NE2 1 1
14 4260 1 1 6 HIS O O 4.281 0.064 3.922 1.00 . A A . 6 HIS O 1 1
14 4261 1 1 7 HIS C C 7.488 -0.255 2.551 1.00 . A A . 7 HIS C 1 1
14 4262 1 1 7 HIS CA C 6.203 -1.016 2.237 1.00 . A A . 7 HIS CA 1 1
14 4263 1 1 7 HIS CB C 6.452 -2.032 1.122 1.00 . A A . 7 HIS CB 1 1
14 4264 1 1 7 HIS CD2 C 4.150 -2.604 0.072 1.00 . A A . 7 HIS CD2 1 1
14 4265 1 1 7 HIS CE1 C 3.942 -4.639 0.769 1.00 . A A . 7 HIS CE1 1 1
14 4266 1 1 7 HIS CG C 5.260 -2.883 0.806 1.00 . A A . 7 HIS CG 1 1
14 4267 1 1 7 HIS H H 5.066 0.179 0.912 1.00 . A A . 7 HIS H 1 1
14 4268 1 1 7 HIS HA H 5.882 -1.539 3.124 1.00 . A A . 7 HIS HA 1 1
14 4269 1 1 7 HIS HB2 H 6.729 -1.504 0.221 1.00 . A A . 7 HIS HB2 1 1
14 4270 1 1 7 HIS HB3 H 7.261 -2.684 1.414 1.00 . A A . 7 HIS HB3 1 1
14 4271 1 1 7 HIS HD1 H 5.740 -4.679 1.802 1.00 . A A . 7 HIS HD1 1 1
14 4272 1 1 7 HIS HD2 H 3.924 -1.662 -0.408 1.00 . A A . 7 HIS HD2 1 1
14 4273 1 1 7 HIS HE1 H 3.552 -5.628 0.959 1.00 . A A . 7 HIS HE1 1 1
14 4274 1 1 7 HIS N N 5.140 -0.099 1.850 1.00 . A A . 7 HIS N 1 1
14 4275 1 1 7 HIS ND1 N 5.108 -4.179 1.244 1.00 . A A . 7 HIS ND1 1 1
14 4276 1 1 7 HIS NE2 N 3.325 -3.723 0.050 1.00 . A A . 7 HIS NE2 1 1
14 4277 1 1 7 HIS O O 7.988 0.505 1.723 1.00 . A A . 7 HIS O 1 1
14 4278 1 1 8 SER C C 10.470 -0.543 3.674 1.00 . A A . 8 SER C 1 1
14 4279 1 1 8 SER CA C 9.239 0.202 4.178 1.00 . A A . 8 SER CA 1 1
14 4280 1 1 8 SER CB C 9.284 0.309 5.704 1.00 . A A . 8 SER CB 1 1
14 4281 1 1 8 SER H H 7.568 -1.081 4.370 1.00 . A A . 8 SER H 1 1
14 4282 1 1 8 SER HA H 9.238 1.196 3.756 1.00 . A A . 8 SER HA 1 1
14 4283 1 1 8 SER HB2 H 8.437 0.885 6.047 1.00 . A A . 8 SER HB2 1 1
14 4284 1 1 8 SER HB3 H 9.244 -0.681 6.134 1.00 . A A . 8 SER HB3 1 1
14 4285 1 1 8 SER HG H 11.234 0.430 5.859 1.00 . A A . 8 SER HG 1 1
14 4286 1 1 8 SER N N 8.015 -0.465 3.753 1.00 . A A . 8 SER N 1 1
14 4287 1 1 8 SER O O 10.574 -1.761 3.818 1.00 . A A . 8 SER O 1 1
14 4288 1 1 8 SER OG O 10.473 0.947 6.137 1.00 . A A . 8 SER OG 1 1
14 4289 1 1 9 GLY C C 13.429 0.554 1.722 1.00 . A A . 9 GLY C 1 1
14 4290 1 1 9 GLY CA C 12.612 -0.409 2.563 1.00 . A A . 9 GLY CA 1 1
14 4291 1 1 9 GLY H H 11.264 1.163 2.993 1.00 . A A . 9 GLY H 1 1
14 4292 1 1 9 GLY HA2 H 13.216 -0.747 3.391 1.00 . A A . 9 GLY HA2 1 1
14 4293 1 1 9 GLY HA3 H 12.345 -1.261 1.956 1.00 . A A . 9 GLY HA3 1 1
14 4294 1 1 9 GLY N N 11.401 0.197 3.080 1.00 . A A . 9 GLY N 1 1
14 4295 1 1 9 GLY O O 13.101 1.736 1.626 1.00 . A A . 9 GLY O 1 1
14 4296 1 1 10 TYR C C 14.794 0.990 -1.137 1.00 . A A . 10 TYR C 1 1
14 4297 1 1 10 TYR CA C 15.359 0.869 0.274 1.00 . A A . 10 TYR CA 1 1
14 4298 1 1 10 TYR CB C 16.769 0.275 0.224 1.00 . A A . 10 TYR CB 1 1
14 4299 1 1 10 TYR CD1 C 16.688 -2.234 0.485 1.00 . A A . 10 TYR CD1 1 1
14 4300 1 1 10 TYR CD2 C 16.985 -1.340 -1.704 1.00 . A A . 10 TYR CD2 1 1
14 4301 1 1 10 TYR CE1 C 16.730 -3.517 -0.028 1.00 . A A . 10 TYR CE1 1 1
14 4302 1 1 10 TYR CE2 C 17.028 -2.620 -2.225 1.00 . A A . 10 TYR CE2 1 1
14 4303 1 1 10 TYR CG C 16.815 -1.127 -0.343 1.00 . A A . 10 TYR CG 1 1
14 4304 1 1 10 TYR CZ C 16.900 -3.704 -1.384 1.00 . A A . 10 TYR CZ 1 1
14 4305 1 1 10 TYR H H 14.704 -0.905 1.226 1.00 . A A . 10 TYR H 1 1
14 4306 1 1 10 TYR HA H 15.409 1.853 0.716 1.00 . A A . 10 TYR HA 1 1
14 4307 1 1 10 TYR HB2 H 17.394 0.903 -0.393 1.00 . A A . 10 TYR HB2 1 1
14 4308 1 1 10 TYR HB3 H 17.174 0.243 1.224 1.00 . A A . 10 TYR HB3 1 1
14 4309 1 1 10 TYR HD1 H 16.556 -2.084 1.547 1.00 . A A . 10 TYR HD1 1 1
14 4310 1 1 10 TYR HD2 H 17.085 -0.489 -2.361 1.00 . A A . 10 TYR HD2 1 1
14 4311 1 1 10 TYR HE1 H 16.630 -4.367 0.632 1.00 . A A . 10 TYR HE1 1 1
14 4312 1 1 10 TYR HE2 H 17.160 -2.766 -3.287 1.00 . A A . 10 TYR HE2 1 1
14 4313 1 1 10 TYR HH H 16.161 -5.463 -1.620 1.00 . A A . 10 TYR HH 1 1
14 4314 1 1 10 TYR N N 14.494 0.046 1.112 1.00 . A A . 10 TYR N 1 1
14 4315 1 1 10 TYR O O 15.336 1.797 -1.923 1.00 . A A . 10 TYR O 1 1
14 4316 1 1 10 TYR OH O 16.942 -4.980 -1.899 1.00 . A A . 10 TYR OH 1 1
14 4317 1 1 11 NH2 HN1 H 13.354 -0.404 -0.788 1.00 . A A . 11 NH2 HN1 1 1
14 4318 1 1 11 NH2 HN2 H 13.356 0.291 -2.394 1.00 . A A . 11 NH2 HN2 1 1
14 4319 1 1 11 NH2 N N 13.750 0.231 -1.466 1.00 . A A . 11 NH2 N 1 1
14 4320 2 1 1 ASP C C -0.281 -5.689 -0.890 1.00 . B B . 1 ASP C 1 1
14 4321 2 1 1 ASP CA C -0.355 -6.606 0.327 1.00 . B B . 1 ASP CA 1 1
14 4322 2 1 1 ASP CB C -0.851 -5.827 1.546 1.00 . B B . 1 ASP CB 1 1
14 4323 2 1 1 ASP CG C -1.222 -6.736 2.700 1.00 . B B . 1 ASP CG 1 1
14 4324 2 1 1 ASP H1 H 1.311 -7.695 -0.197 1.00 . B B . 1 ASP H1 1 1
14 4325 2 1 1 ASP H2 H 0.855 -7.830 1.454 1.00 . B B . 1 ASP H2 1 1
14 4326 2 1 1 ASP H3 H 1.615 -6.399 0.885 1.00 . B B . 1 ASP H3 1 1
14 4327 2 1 1 ASP HA H -1.039 -7.413 0.118 1.00 . B B . 1 ASP HA 1 1
14 4328 2 1 1 ASP HB2 H -0.075 -5.154 1.876 1.00 . B B . 1 ASP HB2 1 1
14 4329 2 1 1 ASP HB3 H -1.723 -5.255 1.266 1.00 . B B . 1 ASP HB3 1 1
14 4330 2 1 1 ASP N N 0.976 -7.184 0.646 1.00 . B B . 1 ASP N 1 1
14 4331 2 1 1 ASP O O 0.800 -5.243 -1.278 1.00 . B B . 1 ASP O 1 1
14 4332 2 1 1 ASP OD1 O -1.275 -6.248 3.848 1.00 . B B . 1 ASP OD1 1 1
14 4333 2 1 1 ASP OD2 O -1.461 -7.938 2.457 1.00 . B B . 1 ASP OD2 1 1
14 4334 2 1 2 ALA C C -2.231 -3.252 -2.363 1.00 . B B . 2 ALA C 1 1
14 4335 2 1 2 ALA CA C -1.498 -4.554 -2.665 1.00 . B B . 2 ALA CA 1 1
14 4336 2 1 2 ALA CB C -2.176 -5.282 -3.812 1.00 . B B . 2 ALA CB 1 1
14 4337 2 1 2 ALA H H -2.263 -5.799 -1.136 1.00 . B B . 2 ALA H 1 1
14 4338 2 1 2 ALA HA H -0.486 -4.322 -2.966 1.00 . B B . 2 ALA HA 1 1
14 4339 2 1 2 ALA HB1 H -1.472 -5.421 -4.619 1.00 . B B . 2 ALA HB1 1 1
14 4340 2 1 2 ALA HB2 H -3.016 -4.699 -4.164 1.00 . B B . 2 ALA HB2 1 1
14 4341 2 1 2 ALA HB3 H -2.526 -6.246 -3.470 1.00 . B B . 2 ALA HB3 1 1
14 4342 2 1 2 ALA N N -1.435 -5.413 -1.489 1.00 . B B . 2 ALA N 1 1
14 4343 2 1 2 ALA O O -2.739 -3.051 -1.260 1.00 . B B . 2 ALA O 1 1
14 4344 2 1 3 GLU C C -4.373 -1.249 -2.704 1.00 . B B . 3 GLU C 1 1
14 4345 2 1 3 GLU CA C -2.947 -1.084 -3.221 1.00 . B B . 3 GLU CA 1 1
14 4346 2 1 3 GLU CB C -2.964 -0.356 -4.567 1.00 . B B . 3 GLU CB 1 1
14 4347 2 1 3 GLU CD C -1.900 1.924 -4.360 1.00 . B B . 3 GLU CD 1 1
14 4348 2 1 3 GLU CG C -3.194 1.142 -4.450 1.00 . B B . 3 GLU CG 1 1
14 4349 2 1 3 GLU H H -1.856 -2.601 -4.213 1.00 . B B . 3 GLU H 1 1
14 4350 2 1 3 GLU HA H -2.385 -0.495 -2.512 1.00 . B B . 3 GLU HA 1 1
14 4351 2 1 3 GLU HB2 H -2.017 -0.514 -5.061 1.00 . B B . 3 GLU HB2 1 1
14 4352 2 1 3 GLU HB3 H -3.751 -0.773 -5.177 1.00 . B B . 3 GLU HB3 1 1
14 4353 2 1 3 GLU HG2 H -3.741 1.478 -5.317 1.00 . B B . 3 GLU HG2 1 1
14 4354 2 1 3 GLU HG3 H -3.777 1.334 -3.561 1.00 . B B . 3 GLU HG3 1 1
14 4355 2 1 3 GLU N N -2.280 -2.373 -3.360 1.00 . B B . 3 GLU N 1 1
14 4356 2 1 3 GLU O O -4.887 -0.387 -1.992 1.00 . B B . 3 GLU O 1 1
14 4357 2 1 3 GLU OE1 O -1.043 1.560 -3.528 1.00 . B B . 3 GLU OE1 1 1
14 4358 2 1 3 GLU OE2 O -1.743 2.901 -5.123 1.00 . B B . 3 GLU OE2 1 1
14 4359 2 1 4 PHE C C -6.411 -3.063 -1.174 1.00 . B B . 4 PHE C 1 1
14 4360 2 1 4 PHE CA C -6.377 -2.616 -2.631 1.00 . B B . 4 PHE CA 1 1
14 4361 2 1 4 PHE CB C -7.050 -3.662 -3.527 1.00 . B B . 4 PHE CB 1 1
14 4362 2 1 4 PHE CD1 C -6.455 -5.972 -2.739 1.00 . B B . 4 PHE CD1 1 1
14 4363 2 1 4 PHE CD2 C -5.418 -5.149 -4.723 1.00 . B B . 4 PHE CD2 1 1
14 4364 2 1 4 PHE CE1 C -5.768 -7.166 -2.873 1.00 . B B . 4 PHE CE1 1 1
14 4365 2 1 4 PHE CE2 C -4.728 -6.339 -4.860 1.00 . B B . 4 PHE CE2 1 1
14 4366 2 1 4 PHE CG C -6.288 -4.952 -3.661 1.00 . B B . 4 PHE CG 1 1
14 4367 2 1 4 PHE CZ C -4.904 -7.348 -3.933 1.00 . B B . 4 PHE CZ 1 1
14 4368 2 1 4 PHE H H -4.554 -3.009 -3.633 1.00 . B B . 4 PHE H 1 1
14 4369 2 1 4 PHE HA H -6.923 -1.688 -2.714 1.00 . B B . 4 PHE HA 1 1
14 4370 2 1 4 PHE HB2 H -8.021 -3.898 -3.119 1.00 . B B . 4 PHE HB2 1 1
14 4371 2 1 4 PHE HB3 H -7.174 -3.246 -4.515 1.00 . B B . 4 PHE HB3 1 1
14 4372 2 1 4 PHE HD1 H -7.128 -5.829 -1.907 1.00 . B B . 4 PHE HD1 1 1
14 4373 2 1 4 PHE HD2 H -5.279 -4.360 -5.447 1.00 . B B . 4 PHE HD2 1 1
14 4374 2 1 4 PHE HE1 H -5.907 -7.953 -2.148 1.00 . B B . 4 PHE HE1 1 1
14 4375 2 1 4 PHE HE2 H -4.052 -6.479 -5.690 1.00 . B B . 4 PHE HE2 1 1
14 4376 2 1 4 PHE HZ H -4.367 -8.279 -4.040 1.00 . B B . 4 PHE HZ 1 1
14 4377 2 1 4 PHE N N -5.011 -2.356 -3.066 1.00 . B B . 4 PHE N 1 1
14 4378 2 1 4 PHE O O -7.409 -2.869 -0.480 1.00 . B B . 4 PHE O 1 1
14 4379 2 1 5 ARG C C -4.949 -2.947 1.609 1.00 . B B . 5 ARG C 1 1
14 4380 2 1 5 ARG CA C -5.226 -4.112 0.672 1.00 . B B . 5 ARG CA 1 1
14 4381 2 1 5 ARG CB C -4.120 -5.155 0.818 1.00 . B B . 5 ARG CB 1 1
14 4382 2 1 5 ARG CD C -5.585 -7.184 0.576 1.00 . B B . 5 ARG CD 1 1
14 4383 2 1 5 ARG CG C -4.371 -6.436 0.046 1.00 . B B . 5 ARG CG 1 1
14 4384 2 1 5 ARG CZ C -6.190 -8.581 2.514 1.00 . B B . 5 ARG CZ 1 1
14 4385 2 1 5 ARG H H -4.544 -3.775 -1.306 1.00 . B B . 5 ARG H 1 1
14 4386 2 1 5 ARG HA H -6.172 -4.558 0.936 1.00 . B B . 5 ARG HA 1 1
14 4387 2 1 5 ARG HB2 H -3.197 -4.725 0.462 1.00 . B B . 5 ARG HB2 1 1
14 4388 2 1 5 ARG HB3 H -4.011 -5.404 1.864 1.00 . B B . 5 ARG HB3 1 1
14 4389 2 1 5 ARG HD2 H -6.366 -6.470 0.794 1.00 . B B . 5 ARG HD2 1 1
14 4390 2 1 5 ARG HD3 H -5.929 -7.869 -0.183 1.00 . B B . 5 ARG HD3 1 1
14 4391 2 1 5 ARG HE H -4.341 -7.963 2.081 1.00 . B B . 5 ARG HE 1 1
14 4392 2 1 5 ARG HG2 H -4.533 -6.189 -0.989 1.00 . B B . 5 ARG HG2 1 1
14 4393 2 1 5 ARG HG3 H -3.502 -7.072 0.134 1.00 . B B . 5 ARG HG3 1 1
14 4394 2 1 5 ARG HH11 H -7.750 -8.068 1.333 1.00 . B B . 5 ARG HH11 1 1
14 4395 2 1 5 ARG HH12 H -8.147 -9.051 2.702 1.00 . B B . 5 ARG HH12 1 1
14 4396 2 1 5 ARG HH21 H -4.863 -9.258 3.880 1.00 . B B . 5 ARG HH21 1 1
14 4397 2 1 5 ARG HH22 H -6.508 -9.726 4.148 1.00 . B B . 5 ARG HH22 1 1
14 4398 2 1 5 ARG N N -5.314 -3.653 -0.710 1.00 . B B . 5 ARG N 1 1
14 4399 2 1 5 ARG NE N -5.277 -7.936 1.790 1.00 . B B . 5 ARG NE 1 1
14 4400 2 1 5 ARG NH1 N -7.467 -8.566 2.153 1.00 . B B . 5 ARG NH1 1 1
14 4401 2 1 5 ARG NH2 N -5.823 -9.242 3.604 1.00 . B B . 5 ARG NH2 1 1
14 4402 2 1 5 ARG O O -5.539 -2.842 2.685 1.00 . B B . 5 ARG O 1 1
14 4403 2 1 6 HIS C C -4.800 0.106 2.027 1.00 . B B . 6 HIS C 1 1
14 4404 2 1 6 HIS CA C -3.668 -0.911 1.993 1.00 . B B . 6 HIS CA 1 1
14 4405 2 1 6 HIS CB C -2.411 -0.254 1.424 1.00 . B B . 6 HIS CB 1 1
14 4406 2 1 6 HIS CD2 C -0.808 -1.626 -0.065 1.00 . B B . 6 HIS CD2 1 1
14 4407 2 1 6 HIS CE1 C 0.323 -2.650 1.466 1.00 . B B . 6 HIS CE1 1 1
14 4408 2 1 6 HIS CG C -1.307 -1.217 1.127 1.00 . B B . 6 HIS CG 1 1
14 4409 2 1 6 HIS H H -3.604 -2.217 0.324 1.00 . B B . 6 HIS H 1 1
14 4410 2 1 6 HIS HA H -3.467 -1.247 2.997 1.00 . B B . 6 HIS HA 1 1
14 4411 2 1 6 HIS HB2 H -2.666 0.247 0.501 1.00 . B B . 6 HIS HB2 1 1
14 4412 2 1 6 HIS HB3 H -2.041 0.472 2.131 1.00 . B B . 6 HIS HB3 1 1
14 4413 2 1 6 HIS HD1 H -0.693 -1.796 3.061 1.00 . B B . 6 HIS HD1 1 1
14 4414 2 1 6 HIS HD2 H -1.149 -1.304 -1.037 1.00 . B B . 6 HIS HD2 1 1
14 4415 2 1 6 HIS HE1 H 1.042 -3.282 1.966 1.00 . B B . 6 HIS HE1 1 1
14 4416 2 1 6 HIS N N -4.038 -2.074 1.192 1.00 . B B . 6 HIS N 1 1
14 4417 2 1 6 HIS ND1 N -0.577 -1.877 2.091 1.00 . B B . 6 HIS ND1 1 1
14 4418 2 1 6 HIS NE2 N 0.220 -2.533 0.158 1.00 . B B . 6 HIS NE2 1 1
14 4419 2 1 6 HIS O O -5.131 0.653 3.080 1.00 . B B . 6 HIS O 1 1
14 4420 2 1 7 HIS C C -7.814 0.688 1.149 1.00 . B B . 7 HIS C 1 1
14 4421 2 1 7 HIS CA C -6.478 1.310 0.743 1.00 . B B . 7 HIS CA 1 1
14 4422 2 1 7 HIS CB C -6.557 1.836 -0.690 1.00 . B B . 7 HIS CB 1 1
14 4423 2 1 7 HIS CD2 C -4.069 2.252 -1.288 1.00 . B B . 7 HIS CD2 1 1
14 4424 2 1 7 HIS CE1 C -4.154 4.375 -1.691 1.00 . B B . 7 HIS CE1 1 1
14 4425 2 1 7 HIS CG C -5.359 2.637 -1.099 1.00 . B B . 7 HIS CG 1 1
14 4426 2 1 7 HIS H H -5.069 -0.115 0.063 1.00 . B B . 7 HIS H 1 1
14 4427 2 1 7 HIS HA H -6.266 2.137 1.405 1.00 . B B . 7 HIS HA 1 1
14 4428 2 1 7 HIS HB2 H -6.645 1.000 -1.369 1.00 . B B . 7 HIS HB2 1 1
14 4429 2 1 7 HIS HB3 H -7.428 2.466 -0.788 1.00 . B B . 7 HIS HB3 1 1
14 4430 2 1 7 HIS HD1 H -6.183 4.567 -1.311 1.00 . B B . 7 HIS HD1 1 1
14 4431 2 1 7 HIS HD2 H -3.682 1.250 -1.168 1.00 . B B . 7 HIS HD2 1 1
14 4432 2 1 7 HIS HE1 H -3.877 5.388 -1.946 1.00 . B B . 7 HIS HE1 1 1
14 4433 2 1 7 HIS N N -5.385 0.355 0.864 1.00 . B B . 7 HIS N 1 1
14 4434 2 1 7 HIS ND1 N -5.393 3.989 -1.358 1.00 . B B . 7 HIS ND1 1 1
14 4435 2 1 7 HIS NE2 N -3.313 3.358 -1.661 1.00 . B B . 7 HIS NE2 1 1
14 4436 2 1 7 HIS O O -8.811 1.394 1.306 1.00 . B B . 7 HIS O 1 1
14 4437 2 1 8 SER C C -10.165 -1.081 0.693 1.00 . B B . 8 SER C 1 1
14 4438 2 1 8 SER CA C -9.050 -1.335 1.704 1.00 . B B . 8 SER CA 1 1
14 4439 2 1 8 SER CB C -9.493 -0.893 3.102 1.00 . B B . 8 SER CB 1 1
14 4440 2 1 8 SER H H -7.008 -1.144 1.179 1.00 . B B . 8 SER H 1 1
14 4441 2 1 8 SER HA H -8.829 -2.392 1.722 1.00 . B B . 8 SER HA 1 1
14 4442 2 1 8 SER HB2 H -8.749 -0.237 3.523 1.00 . B B . 8 SER HB2 1 1
14 4443 2 1 8 SER HB3 H -10.436 -0.371 3.031 1.00 . B B . 8 SER HB3 1 1
14 4444 2 1 8 SER HG H -9.661 -1.713 4.874 1.00 . B B . 8 SER HG 1 1
14 4445 2 1 8 SER N N -7.831 -0.631 1.317 1.00 . B B . 8 SER N 1 1
14 4446 2 1 8 SER O O -11.325 -0.900 1.063 1.00 . B B . 8 SER O 1 1
14 4447 2 1 8 SER OG O -9.654 -2.010 3.960 1.00 . B B . 8 SER OG 1 1
14 4448 2 1 9 GLY C C -11.804 -1.948 -1.731 1.00 . B B . 9 GLY C 1 1
14 4449 2 1 9 GLY CA C -10.781 -0.834 -1.632 1.00 . B B . 9 GLY CA 1 1
14 4450 2 1 9 GLY H H -8.864 -1.217 -0.821 1.00 . B B . 9 GLY H 1 1
14 4451 2 1 9 GLY HA2 H -11.296 0.093 -1.427 1.00 . B B . 9 GLY HA2 1 1
14 4452 2 1 9 GLY HA3 H -10.267 -0.747 -2.578 1.00 . B B . 9 GLY HA3 1 1
14 4453 2 1 9 GLY N N -9.803 -1.068 -0.586 1.00 . B B . 9 GLY N 1 1
14 4454 2 1 9 GLY O O -11.533 -3.086 -1.348 1.00 . B B . 9 GLY O 1 1
14 4455 2 1 10 TYR C C -13.982 -3.279 -3.759 1.00 . B B . 10 TYR C 1 1
14 4456 2 1 10 TYR CA C -14.053 -2.597 -2.396 1.00 . B B . 10 TYR CA 1 1
14 4457 2 1 10 TYR CB C -15.414 -1.921 -2.222 1.00 . B B . 10 TYR CB 1 1
14 4458 2 1 10 TYR CD1 C -15.078 -0.033 -0.581 1.00 . B B . 10 TYR CD1 1 1
14 4459 2 1 10 TYR CD2 C -16.313 -1.942 0.138 1.00 . B B . 10 TYR CD2 1 1
14 4460 2 1 10 TYR CE1 C -15.250 0.551 0.661 1.00 . B B . 10 TYR CE1 1 1
14 4461 2 1 10 TYR CE2 C -16.490 -1.364 1.381 1.00 . B B . 10 TYR CE2 1 1
14 4462 2 1 10 TYR CG C -15.605 -1.287 -0.863 1.00 . B B . 10 TYR CG 1 1
14 4463 2 1 10 TYR CZ C -15.956 -0.118 1.637 1.00 . B B . 10 TYR CZ 1 1
14 4464 2 1 10 TYR H H -13.138 -0.695 -2.533 1.00 . B B . 10 TYR H 1 1
14 4465 2 1 10 TYR HA H -13.932 -3.344 -1.627 1.00 . B B . 10 TYR HA 1 1
14 4466 2 1 10 TYR HB2 H -15.522 -1.146 -2.966 1.00 . B B . 10 TYR HB2 1 1
14 4467 2 1 10 TYR HB3 H -16.194 -2.656 -2.359 1.00 . B B . 10 TYR HB3 1 1
14 4468 2 1 10 TYR HD1 H -14.524 0.489 -1.347 1.00 . B B . 10 TYR HD1 1 1
14 4469 2 1 10 TYR HD2 H -16.730 -2.917 -0.066 1.00 . B B . 10 TYR HD2 1 1
14 4470 2 1 10 TYR HE1 H -14.831 1.526 0.860 1.00 . B B . 10 TYR HE1 1 1
14 4471 2 1 10 TYR HE2 H -17.043 -1.888 2.146 1.00 . B B . 10 TYR HE2 1 1
14 4472 2 1 10 TYR HH H -15.273 0.587 3.290 1.00 . B B . 10 TYR HH 1 1
14 4473 2 1 10 TYR N N -12.983 -1.619 -2.246 1.00 . B B . 10 TYR N 1 1
14 4474 2 1 10 TYR O O -13.589 -2.606 -4.736 1.00 . B B . 10 TYR O 1 1
14 4475 2 1 10 TYR OH O -16.129 0.459 2.874 1.00 . B B . 10 TYR OH 1 1
14 4476 2 1 11 NH2 HN1 H -14.649 -5.052 -3.019 1.00 . B B . 11 NH2 HN1 1 1
14 4477 2 1 11 NH2 HN2 H -14.302 -5.036 -4.734 1.00 . B B . 11 NH2 HN2 1 1
14 4478 2 1 11 NH2 N N -14.340 -4.559 -3.844 1.00 . B B . 11 NH2 N 1 1
14 4479 3 2 1 ZN ZN ZN 1.648 -3.400 -1.055 1.00 . C A . 101 ZN ZN 1 1
14 4480 4 2 1 ZN ZN ZN -1.396 3.016 -2.255 1.00 . D A . 102 ZN ZN 1 1
15 4481 1 1 1 ASP C C 0.588 5.167 -1.974 1.00 . A A . 1 ASP C 1 1
15 4482 1 1 1 ASP CA C 0.560 6.300 -0.955 1.00 . A A . 1 ASP CA 1 1
15 4483 1 1 1 ASP CB C 0.516 5.732 0.465 1.00 . A A . 1 ASP CB 1 1
15 4484 1 1 1 ASP CG C 0.483 6.817 1.524 1.00 . A A . 1 ASP CG 1 1
15 4485 1 1 1 ASP H1 H -0.621 7.496 -2.140 1.00 . A A . 1 ASP H1 1 1
15 4486 1 1 1 ASP H2 H -0.552 7.968 -0.492 1.00 . A A . 1 ASP H2 1 1
15 4487 1 1 1 ASP H3 H -1.475 6.598 -0.957 1.00 . A A . 1 ASP H3 1 1
15 4488 1 1 1 ASP HA H 1.449 6.901 -1.071 1.00 . A A . 1 ASP HA 1 1
15 4489 1 1 1 ASP HB2 H -0.369 5.124 0.574 1.00 . A A . 1 ASP HB2 1 1
15 4490 1 1 1 ASP HB3 H 1.392 5.119 0.630 1.00 . A A . 1 ASP HB3 1 1
15 4491 1 1 1 ASP N N -0.630 7.168 -1.154 1.00 . A A . 1 ASP N 1 1
15 4492 1 1 1 ASP O O -0.456 4.717 -2.445 1.00 . A A . 1 ASP O 1 1
15 4493 1 1 1 ASP OD1 O 0.674 7.999 1.171 1.00 . A A . 1 ASP OD1 1 1
15 4494 1 1 1 ASP OD2 O 0.265 6.483 2.708 1.00 . A A . 1 ASP OD2 1 1
15 4495 1 1 2 ALA C C 2.633 2.424 -2.634 1.00 . A A . 2 ALA C 1 1
15 4496 1 1 2 ALA CA C 1.957 3.630 -3.276 1.00 . A A . 2 ALA CA 1 1
15 4497 1 1 2 ALA CB C 2.758 4.110 -4.477 1.00 . A A . 2 ALA CB 1 1
15 4498 1 1 2 ALA H H 2.585 5.113 -1.905 1.00 . A A . 2 ALA H 1 1
15 4499 1 1 2 ALA HA H 0.976 3.334 -3.623 1.00 . A A . 2 ALA HA 1 1
15 4500 1 1 2 ALA HB1 H 2.902 5.179 -4.407 1.00 . A A . 2 ALA HB1 1 1
15 4501 1 1 2 ALA HB2 H 2.223 3.877 -5.384 1.00 . A A . 2 ALA HB2 1 1
15 4502 1 1 2 ALA HB3 H 3.720 3.620 -4.489 1.00 . A A . 2 ALA HB3 1 1
15 4503 1 1 2 ALA N N 1.790 4.712 -2.313 1.00 . A A . 2 ALA N 1 1
15 4504 1 1 2 ALA O O 2.959 2.439 -1.447 1.00 . A A . 2 ALA O 1 1
15 4505 1 1 3 GLU C C 4.812 0.456 -2.275 1.00 . A A . 3 GLU C 1 1
15 4506 1 1 3 GLU CA C 3.473 0.156 -2.945 1.00 . A A . 3 GLU CA 1 1
15 4507 1 1 3 GLU CB C 3.675 -0.828 -4.101 1.00 . A A . 3 GLU CB 1 1
15 4508 1 1 3 GLU CD C 2.620 -2.911 -3.135 1.00 . A A . 3 GLU CD 1 1
15 4509 1 1 3 GLU CG C 3.889 -2.264 -3.650 1.00 . A A . 3 GLU CG 1 1
15 4510 1 1 3 GLU H H 2.554 1.431 -4.364 1.00 . A A . 3 GLU H 1 1
15 4511 1 1 3 GLU HA H 2.814 -0.290 -2.217 1.00 . A A . 3 GLU HA 1 1
15 4512 1 1 3 GLU HB2 H 2.803 -0.799 -4.737 1.00 . A A . 3 GLU HB2 1 1
15 4513 1 1 3 GLU HB3 H 4.538 -0.519 -4.673 1.00 . A A . 3 GLU HB3 1 1
15 4514 1 1 3 GLU HG2 H 4.253 -2.839 -4.488 1.00 . A A . 3 GLU HG2 1 1
15 4515 1 1 3 GLU HG3 H 4.627 -2.274 -2.861 1.00 . A A . 3 GLU HG3 1 1
15 4516 1 1 3 GLU N N 2.839 1.380 -3.428 1.00 . A A . 3 GLU N 1 1
15 4517 1 1 3 GLU O O 5.235 -0.257 -1.367 1.00 . A A . 3 GLU O 1 1
15 4518 1 1 3 GLU OE1 O 1.750 -2.182 -2.618 1.00 . A A . 3 GLU OE1 1 1
15 4519 1 1 3 GLU OE2 O 2.496 -4.148 -3.251 1.00 . A A . 3 GLU OE2 1 1
15 4520 1 1 4 PHE C C 6.565 2.682 -0.856 1.00 . A A . 4 PHE C 1 1
15 4521 1 1 4 PHE CA C 6.760 1.898 -2.151 1.00 . A A . 4 PHE CA 1 1
15 4522 1 1 4 PHE CB C 7.570 2.724 -3.154 1.00 . A A . 4 PHE CB 1 1
15 4523 1 1 4 PHE CD1 C 7.389 5.174 -2.640 1.00 . A A . 4 PHE CD1 1 1
15 4524 1 1 4 PHE CD2 C 6.087 4.295 -4.431 1.00 . A A . 4 PHE CD2 1 1
15 4525 1 1 4 PHE CE1 C 6.872 6.432 -2.877 1.00 . A A . 4 PHE CE1 1 1
15 4526 1 1 4 PHE CE2 C 5.565 5.550 -4.674 1.00 . A A . 4 PHE CE2 1 1
15 4527 1 1 4 PHE CG C 7.003 4.091 -3.413 1.00 . A A . 4 PHE CG 1 1
15 4528 1 1 4 PHE CZ C 5.958 6.622 -3.895 1.00 . A A . 4 PHE CZ 1 1
15 4529 1 1 4 PHE H H 5.091 2.053 -3.445 1.00 . A A . 4 PHE H 1 1
15 4530 1 1 4 PHE HA H 7.302 0.991 -1.926 1.00 . A A . 4 PHE HA 1 1
15 4531 1 1 4 PHE HB2 H 8.575 2.849 -2.779 1.00 . A A . 4 PHE HB2 1 1
15 4532 1 1 4 PHE HB3 H 7.608 2.196 -4.096 1.00 . A A . 4 PHE HB3 1 1
15 4533 1 1 4 PHE HD1 H 8.105 5.027 -1.843 1.00 . A A . 4 PHE HD1 1 1
15 4534 1 1 4 PHE HD2 H 5.778 3.458 -5.041 1.00 . A A . 4 PHE HD2 1 1
15 4535 1 1 4 PHE HE1 H 7.182 7.268 -2.266 1.00 . A A . 4 PHE HE1 1 1
15 4536 1 1 4 PHE HE2 H 4.851 5.696 -5.470 1.00 . A A . 4 PHE HE2 1 1
15 4537 1 1 4 PHE HZ H 5.552 7.605 -4.083 1.00 . A A . 4 PHE HZ 1 1
15 4538 1 1 4 PHE N N 5.475 1.515 -2.722 1.00 . A A . 4 PHE N 1 1
15 4539 1 1 4 PHE O O 7.444 2.702 0.005 1.00 . A A . 4 PHE O 1 1
15 4540 1 1 5 ARG C C 4.590 3.218 1.591 1.00 . A A . 5 ARG C 1 1
15 4541 1 1 5 ARG CA C 5.099 4.110 0.462 1.00 . A A . 5 ARG CA 1 1
15 4542 1 1 5 ARG CB C 4.057 5.180 0.132 1.00 . A A . 5 ARG CB 1 1
15 4543 1 1 5 ARG CD C 3.834 7.608 0.766 1.00 . A A . 5 ARG CD 1 1
15 4544 1 1 5 ARG CG C 3.817 6.168 1.262 1.00 . A A . 5 ARG CG 1 1
15 4545 1 1 5 ARG CZ C 5.133 9.670 1.117 1.00 . A A . 5 ARG CZ 1 1
15 4546 1 1 5 ARG H H 4.748 3.271 -1.448 1.00 . A A . 5 ARG H 1 1
15 4547 1 1 5 ARG HA H 6.007 4.595 0.786 1.00 . A A . 5 ARG HA 1 1
15 4548 1 1 5 ARG HB2 H 4.386 5.730 -0.738 1.00 . A A . 5 ARG HB2 1 1
15 4549 1 1 5 ARG HB3 H 3.122 4.692 -0.096 1.00 . A A . 5 ARG HB3 1 1
15 4550 1 1 5 ARG HD2 H 3.968 7.606 -0.306 1.00 . A A . 5 ARG HD2 1 1
15 4551 1 1 5 ARG HD3 H 2.887 8.068 1.008 1.00 . A A . 5 ARG HD3 1 1
15 4552 1 1 5 ARG HE H 5.494 7.925 2.014 1.00 . A A . 5 ARG HE 1 1
15 4553 1 1 5 ARG HG2 H 2.856 5.964 1.707 1.00 . A A . 5 ARG HG2 1 1
15 4554 1 1 5 ARG HG3 H 4.592 6.045 2.004 1.00 . A A . 5 ARG HG3 1 1
15 4555 1 1 5 ARG HH11 H 3.607 9.856 -0.198 1.00 . A A . 5 ARG HH11 1 1
15 4556 1 1 5 ARG HH12 H 4.537 11.293 0.067 1.00 . A A . 5 ARG HH12 1 1
15 4557 1 1 5 ARG HH21 H 6.717 9.814 2.364 1.00 . A A . 5 ARG HH21 1 1
15 4558 1 1 5 ARG HH22 H 6.303 11.268 1.522 1.00 . A A . 5 ARG HH22 1 1
15 4559 1 1 5 ARG N N 5.408 3.326 -0.726 1.00 . A A . 5 ARG N 1 1
15 4560 1 1 5 ARG NE N 4.909 8.385 1.377 1.00 . A A . 5 ARG NE 1 1
15 4561 1 1 5 ARG NH1 N 4.363 10.326 0.259 1.00 . A A . 5 ARG NH1 1 1
15 4562 1 1 5 ARG NH2 N 6.134 10.303 1.717 1.00 . A A . 5 ARG NH2 1 1
15 4563 1 1 5 ARG O O 4.943 3.410 2.753 1.00 . A A . 5 ARG O 1 1
15 4564 1 1 6 HIS C C 4.280 0.397 2.769 1.00 . A A . 6 HIS C 1 1
15 4565 1 1 6 HIS CA C 3.200 1.321 2.225 1.00 . A A . 6 HIS CA 1 1
15 4566 1 1 6 HIS CB C 2.084 0.481 1.606 1.00 . A A . 6 HIS CB 1 1
15 4567 1 1 6 HIS CD2 C 0.697 1.389 -0.374 1.00 . A A . 6 HIS CD2 1 1
15 4568 1 1 6 HIS CE1 C -0.671 2.670 0.705 1.00 . A A . 6 HIS CE1 1 1
15 4569 1 1 6 HIS CG C 1.018 1.288 0.940 1.00 . A A . 6 HIS CG 1 1
15 4570 1 1 6 HIS H H 3.515 2.139 0.294 1.00 . A A . 6 HIS H 1 1
15 4571 1 1 6 HIS HA H 2.795 1.904 3.037 1.00 . A A . 6 HIS HA 1 1
15 4572 1 1 6 HIS HB2 H 2.511 -0.177 0.864 1.00 . A A . 6 HIS HB2 1 1
15 4573 1 1 6 HIS HB3 H 1.619 -0.113 2.378 1.00 . A A . 6 HIS HB3 1 1
15 4574 1 1 6 HIS HD1 H 0.112 2.253 2.579 1.00 . A A . 6 HIS HD1 1 1
15 4575 1 1 6 HIS HD2 H 1.186 0.870 -1.186 1.00 . A A . 6 HIS HD2 1 1
15 4576 1 1 6 HIS HE1 H -1.465 3.361 0.942 1.00 . A A . 6 HIS HE1 1 1
15 4577 1 1 6 HIS N N 3.757 2.243 1.238 1.00 . A A . 6 HIS N 1 1
15 4578 1 1 6 HIS ND1 N 0.139 2.108 1.612 1.00 . A A . 6 HIS ND1 1 1
15 4579 1 1 6 HIS NE2 N -0.373 2.266 -0.515 1.00 . A A . 6 HIS NE2 1 1
15 4580 1 1 6 HIS O O 4.328 0.112 3.965 1.00 . A A . 6 HIS O 1 1
15 4581 1 1 7 HIS C C 7.495 -0.200 2.549 1.00 . A A . 7 HIS C 1 1
15 4582 1 1 7 HIS CA C 6.217 -0.975 2.248 1.00 . A A . 7 HIS CA 1 1
15 4583 1 1 7 HIS CB C 6.463 -1.984 1.127 1.00 . A A . 7 HIS CB 1 1
15 4584 1 1 7 HIS CD2 C 4.168 -2.563 0.062 1.00 . A A . 7 HIS CD2 1 1
15 4585 1 1 7 HIS CE1 C 3.948 -4.590 0.781 1.00 . A A . 7 HIS CE1 1 1
15 4586 1 1 7 HIS CG C 5.272 -2.836 0.810 1.00 . A A . 7 HIS CG 1 1
15 4587 1 1 7 HIS H H 5.037 0.189 0.935 1.00 . A A . 7 HIS H 1 1
15 4588 1 1 7 HIS HA H 5.912 -1.507 3.138 1.00 . A A . 7 HIS HA 1 1
15 4589 1 1 7 HIS HB2 H 6.738 -1.452 0.227 1.00 . A A . 7 HIS HB2 1 1
15 4590 1 1 7 HIS HB3 H 7.274 -2.639 1.412 1.00 . A A . 7 HIS HB3 1 1
15 4591 1 1 7 HIS HD1 H 5.738 -4.622 1.831 1.00 . A A . 7 HIS HD1 1 1
15 4592 1 1 7 HIS HD2 H 3.944 -1.626 -0.426 1.00 . A A . 7 HIS HD2 1 1
15 4593 1 1 7 HIS HE1 H 3.555 -5.576 0.978 1.00 . A A . 7 HIS HE1 1 1
15 4594 1 1 7 HIS N N 5.136 -0.073 1.874 1.00 . A A . 7 HIS N 1 1
15 4595 1 1 7 HIS ND1 N 5.111 -4.127 1.260 1.00 . A A . 7 HIS ND1 1 1
15 4596 1 1 7 HIS NE2 N 3.341 -3.681 0.046 1.00 . A A . 7 HIS NE2 1 1
15 4597 1 1 7 HIS O O 7.875 0.702 1.803 1.00 . A A . 7 HIS O 1 1
15 4598 1 1 8 SER C C 10.543 -0.879 4.109 1.00 . A A . 8 SER C 1 1
15 4599 1 1 8 SER CA C 9.384 0.111 4.052 1.00 . A A . 8 SER CA 1 1
15 4600 1 1 8 SER CB C 9.204 0.782 5.416 1.00 . A A . 8 SER CB 1 1
15 4601 1 1 8 SER H H 7.793 -1.279 4.204 1.00 . A A . 8 SER H 1 1
15 4602 1 1 8 SER HA H 9.608 0.868 3.315 1.00 . A A . 8 SER HA 1 1
15 4603 1 1 8 SER HB2 H 8.786 0.069 6.112 1.00 . A A . 8 SER HB2 1 1
15 4604 1 1 8 SER HB3 H 10.164 1.119 5.779 1.00 . A A . 8 SER HB3 1 1
15 4605 1 1 8 SER HG H 7.617 1.795 5.959 1.00 . A A . 8 SER HG 1 1
15 4606 1 1 8 SER N N 8.149 -0.554 3.650 1.00 . A A . 8 SER N 1 1
15 4607 1 1 8 SER O O 10.425 -1.957 4.691 1.00 . A A . 8 SER O 1 1
15 4608 1 1 8 SER OG O 8.332 1.895 5.325 1.00 . A A . 8 SER OG 1 1
15 4609 1 1 9 GLY C C 13.994 -0.762 2.737 1.00 . A A . 9 GLY C 1 1
15 4610 1 1 9 GLY CA C 12.829 -1.368 3.494 1.00 . A A . 9 GLY CA 1 1
15 4611 1 1 9 GLY H H 11.700 0.368 3.054 1.00 . A A . 9 GLY H 1 1
15 4612 1 1 9 GLY HA2 H 13.133 -1.553 4.514 1.00 . A A . 9 GLY HA2 1 1
15 4613 1 1 9 GLY HA3 H 12.563 -2.308 3.033 1.00 . A A . 9 GLY HA3 1 1
15 4614 1 1 9 GLY N N 11.664 -0.504 3.501 1.00 . A A . 9 GLY N 1 1
15 4615 1 1 9 GLY O O 13.891 0.341 2.202 1.00 . A A . 9 GLY O 1 1
15 4616 1 1 10 TYR C C 16.585 -1.866 0.764 1.00 . A A . 10 TYR C 1 1
15 4617 1 1 10 TYR CA C 16.301 -1.014 1.997 1.00 . A A . 10 TYR CA 1 1
15 4618 1 1 10 TYR CB C 17.508 -1.038 2.936 1.00 . A A . 10 TYR CB 1 1
15 4619 1 1 10 TYR CD1 C 16.438 0.132 4.899 1.00 . A A . 10 TYR CD1 1 1
15 4620 1 1 10 TYR CD2 C 18.495 0.995 4.061 1.00 . A A . 10 TYR CD2 1 1
15 4621 1 1 10 TYR CE1 C 16.408 1.125 5.861 1.00 . A A . 10 TYR CE1 1 1
15 4622 1 1 10 TYR CE2 C 18.473 1.991 5.018 1.00 . A A . 10 TYR CE2 1 1
15 4623 1 1 10 TYR CG C 17.479 0.050 3.985 1.00 . A A . 10 TYR CG 1 1
15 4624 1 1 10 TYR CZ C 17.429 2.052 5.916 1.00 . A A . 10 TYR CZ 1 1
15 4625 1 1 10 TYR H H 15.130 -2.358 3.139 1.00 . A A . 10 TYR H 1 1
15 4626 1 1 10 TYR HA H 16.120 0.003 1.684 1.00 . A A . 10 TYR HA 1 1
15 4627 1 1 10 TYR HB2 H 17.540 -1.988 3.446 1.00 . A A . 10 TYR HB2 1 1
15 4628 1 1 10 TYR HB3 H 18.410 -0.917 2.354 1.00 . A A . 10 TYR HB3 1 1
15 4629 1 1 10 TYR HD1 H 15.640 -0.595 4.854 1.00 . A A . 10 TYR HD1 1 1
15 4630 1 1 10 TYR HD2 H 19.313 0.946 3.356 1.00 . A A . 10 TYR HD2 1 1
15 4631 1 1 10 TYR HE1 H 15.590 1.172 6.562 1.00 . A A . 10 TYR HE1 1 1
15 4632 1 1 10 TYR HE2 H 19.272 2.717 5.062 1.00 . A A . 10 TYR HE2 1 1
15 4633 1 1 10 TYR HH H 16.536 3.456 6.880 1.00 . A A . 10 TYR HH 1 1
15 4634 1 1 10 TYR N N 15.109 -1.486 2.694 1.00 . A A . 10 TYR N 1 1
15 4635 1 1 10 TYR O O 16.274 -3.075 0.797 1.00 . A A . 10 TYR O 1 1
15 4636 1 1 10 TYR OH O 17.402 3.042 6.871 1.00 . A A . 10 TYR OH 1 1
15 4637 1 1 11 NH2 HN1 H 17.379 -0.297 -0.260 1.00 . A A . 11 NH2 HN1 1 1
15 4638 1 1 11 NH2 HN2 H 17.349 -1.819 -1.121 1.00 . A A . 11 NH2 HN2 1 1
15 4639 1 1 11 NH2 N N 17.150 -1.280 -0.291 1.00 . A A . 11 NH2 N 1 1
15 4640 2 1 1 ASP C C -0.307 -5.636 -0.734 1.00 . B B . 1 ASP C 1 1
15 4641 2 1 1 ASP CA C -0.383 -6.519 0.508 1.00 . B B . 1 ASP CA 1 1
15 4642 2 1 1 ASP CB C -0.950 -5.724 1.684 1.00 . B B . 1 ASP CB 1 1
15 4643 2 1 1 ASP CG C -1.323 -6.611 2.856 1.00 . B B . 1 ASP CG 1 1
15 4644 2 1 1 ASP H1 H 1.629 -6.238 0.833 1.00 . B B . 1 ASP H1 1 1
15 4645 2 1 1 ASP H2 H 1.214 -7.782 0.209 1.00 . B B . 1 ASP H2 1 1
15 4646 2 1 1 ASP H3 H 0.897 -7.404 1.853 1.00 . B B . 1 ASP H3 1 1
15 4647 2 1 1 ASP HA H -1.027 -7.360 0.303 1.00 . B B . 1 ASP HA 1 1
15 4648 2 1 1 ASP HB2 H -0.215 -5.010 2.019 1.00 . B B . 1 ASP HB2 1 1
15 4649 2 1 1 ASP HB3 H -1.834 -5.198 1.359 1.00 . B B . 1 ASP HB3 1 1
15 4650 2 1 1 ASP N N 0.960 -7.032 0.885 1.00 . B B . 1 ASP N 1 1
15 4651 2 1 1 ASP O O 0.776 -5.235 -1.157 1.00 . B B . 1 ASP O 1 1
15 4652 2 1 1 ASP OD1 O -1.434 -6.089 3.985 1.00 . B B . 1 ASP OD1 1 1
15 4653 2 1 1 ASP OD2 O -1.507 -7.829 2.645 1.00 . B B . 1 ASP OD2 1 1
15 4654 2 1 2 ALA C C -2.255 -3.192 -2.227 1.00 . B B . 2 ALA C 1 1
15 4655 2 1 2 ALA CA C -1.533 -4.506 -2.508 1.00 . B B . 2 ALA CA 1 1
15 4656 2 1 2 ALA CB C -2.223 -5.258 -3.635 1.00 . B B . 2 ALA CB 1 1
15 4657 2 1 2 ALA H H -2.297 -5.690 -0.928 1.00 . B B . 2 ALA H 1 1
15 4658 2 1 2 ALA HA H -0.521 -4.288 -2.819 1.00 . B B . 2 ALA HA 1 1
15 4659 2 1 2 ALA HB1 H -1.538 -5.375 -4.462 1.00 . B B . 2 ALA HB1 1 1
15 4660 2 1 2 ALA HB2 H -3.090 -4.703 -3.963 1.00 . B B . 2 ALA HB2 1 1
15 4661 2 1 2 ALA HB3 H -2.531 -6.232 -3.283 1.00 . B B . 2 ALA HB3 1 1
15 4662 2 1 2 ALA N N -1.467 -5.339 -1.312 1.00 . B B . 2 ALA N 1 1
15 4663 2 1 2 ALA O O -2.750 -2.965 -1.122 1.00 . B B . 2 ALA O 1 1
15 4664 2 1 3 GLU C C -4.384 -1.171 -2.581 1.00 . B B . 3 GLU C 1 1
15 4665 2 1 3 GLU CA C -2.961 -1.032 -3.116 1.00 . B B . 3 GLU CA 1 1
15 4666 2 1 3 GLU CB C -2.983 -0.324 -4.472 1.00 . B B . 3 GLU CB 1 1
15 4667 2 1 3 GLU CD C -2.071 1.972 -3.959 1.00 . B B . 3 GLU CD 1 1
15 4668 2 1 3 GLU CG C -3.280 1.163 -4.379 1.00 . B B . 3 GLU CG 1 1
15 4669 2 1 3 GLU H H -1.893 -2.578 -4.092 1.00 . B B . 3 GLU H 1 1
15 4670 2 1 3 GLU HA H -2.387 -0.439 -2.422 1.00 . B B . 3 GLU HA 1 1
15 4671 2 1 3 GLU HB2 H -2.020 -0.447 -4.944 1.00 . B B . 3 GLU HB2 1 1
15 4672 2 1 3 GLU HB3 H -3.739 -0.782 -5.091 1.00 . B B . 3 GLU HB3 1 1
15 4673 2 1 3 GLU HG2 H -3.609 1.513 -5.345 1.00 . B B . 3 GLU HG2 1 1
15 4674 2 1 3 GLU HG3 H -4.066 1.316 -3.654 1.00 . B B . 3 GLU HG3 1 1
15 4675 2 1 3 GLU N N -2.308 -2.331 -3.238 1.00 . B B . 3 GLU N 1 1
15 4676 2 1 3 GLU O O -4.844 -0.344 -1.798 1.00 . B B . 3 GLU O 1 1
15 4677 2 1 3 GLU OE1 O -1.145 1.387 -3.359 1.00 . B B . 3 GLU OE1 1 1
15 4678 2 1 3 GLU OE2 O -2.045 3.190 -4.235 1.00 . B B . 3 GLU OE2 1 1
15 4679 2 1 4 PHE C C -6.464 -2.851 -1.086 1.00 . B B . 4 PHE C 1 1
15 4680 2 1 4 PHE CA C -6.445 -2.448 -2.557 1.00 . B B . 4 PHE CA 1 1
15 4681 2 1 4 PHE CB C -7.128 -3.516 -3.417 1.00 . B B . 4 PHE CB 1 1
15 4682 2 1 4 PHE CD1 C -7.208 -5.772 -2.323 1.00 . B B . 4 PHE CD1 1 1
15 4683 2 1 4 PHE CD2 C -5.477 -5.343 -3.905 1.00 . B B . 4 PHE CD2 1 1
15 4684 2 1 4 PHE CE1 C -6.722 -7.051 -2.133 1.00 . B B . 4 PHE CE1 1 1
15 4685 2 1 4 PHE CE2 C -4.985 -6.620 -3.719 1.00 . B B . 4 PHE CE2 1 1
15 4686 2 1 4 PHE CG C -6.593 -4.904 -3.210 1.00 . B B . 4 PHE CG 1 1
15 4687 2 1 4 PHE CZ C -5.608 -7.477 -2.832 1.00 . B B . 4 PHE CZ 1 1
15 4688 2 1 4 PHE H H -4.663 -2.852 -3.627 1.00 . B B . 4 PHE H 1 1
15 4689 2 1 4 PHE HA H -6.983 -1.517 -2.664 1.00 . B B . 4 PHE HA 1 1
15 4690 2 1 4 PHE HB2 H -8.182 -3.534 -3.185 1.00 . B B . 4 PHE HB2 1 1
15 4691 2 1 4 PHE HB3 H -6.999 -3.263 -4.459 1.00 . B B . 4 PHE HB3 1 1
15 4692 2 1 4 PHE HD1 H -8.079 -5.442 -1.777 1.00 . B B . 4 PHE HD1 1 1
15 4693 2 1 4 PHE HD2 H -4.989 -4.674 -4.598 1.00 . B B . 4 PHE HD2 1 1
15 4694 2 1 4 PHE HE1 H -7.212 -7.717 -1.440 1.00 . B B . 4 PHE HE1 1 1
15 4695 2 1 4 PHE HE2 H -4.114 -6.950 -4.266 1.00 . B B . 4 PHE HE2 1 1
15 4696 2 1 4 PHE HZ H -5.227 -8.475 -2.684 1.00 . B B . 4 PHE HZ 1 1
15 4697 2 1 4 PHE N N -5.078 -2.219 -3.005 1.00 . B B . 4 PHE N 1 1
15 4698 2 1 4 PHE O O -7.413 -2.551 -0.361 1.00 . B B . 4 PHE O 1 1
15 4699 2 1 5 ARG C C -4.969 -2.752 1.633 1.00 . B B . 5 ARG C 1 1
15 4700 2 1 5 ARG CA C -5.285 -3.942 0.741 1.00 . B B . 5 ARG CA 1 1
15 4701 2 1 5 ARG CB C -4.178 -4.985 0.888 1.00 . B B . 5 ARG CB 1 1
15 4702 2 1 5 ARG CD C -5.691 -6.991 0.935 1.00 . B B . 5 ARG CD 1 1
15 4703 2 1 5 ARG CG C -4.504 -6.326 0.256 1.00 . B B . 5 ARG CG 1 1
15 4704 2 1 5 ARG CZ C -4.944 -9.327 1.188 1.00 . B B . 5 ARG CZ 1 1
15 4705 2 1 5 ARG H H -4.668 -3.712 -1.270 1.00 . B B . 5 ARG H 1 1
15 4706 2 1 5 ARG HA H -6.227 -4.374 1.043 1.00 . B B . 5 ARG HA 1 1
15 4707 2 1 5 ARG HB2 H -3.285 -4.604 0.420 1.00 . B B . 5 ARG HB2 1 1
15 4708 2 1 5 ARG HB3 H -3.985 -5.143 1.938 1.00 . B B . 5 ARG HB3 1 1
15 4709 2 1 5 ARG HD2 H -5.602 -6.854 2.002 1.00 . B B . 5 ARG HD2 1 1
15 4710 2 1 5 ARG HD3 H -6.598 -6.521 0.586 1.00 . B B . 5 ARG HD3 1 1
15 4711 2 1 5 ARG HE H -6.439 -8.725 0.012 1.00 . B B . 5 ARG HE 1 1
15 4712 2 1 5 ARG HG2 H -4.734 -6.171 -0.785 1.00 . B B . 5 ARG HG2 1 1
15 4713 2 1 5 ARG HG3 H -3.641 -6.970 0.343 1.00 . B B . 5 ARG HG3 1 1
15 4714 2 1 5 ARG HH11 H -3.909 -7.991 2.301 1.00 . B B . 5 ARG HH11 1 1
15 4715 2 1 5 ARG HH12 H -3.401 -9.639 2.457 1.00 . B B . 5 ARG HH12 1 1
15 4716 2 1 5 ARG HH21 H -5.773 -10.892 0.216 1.00 . B B . 5 ARG HH21 1 1
15 4717 2 1 5 ARG HH22 H -4.458 -11.287 1.274 1.00 . B B . 5 ARG HH22 1 1
15 4718 2 1 5 ARG N N -5.400 -3.516 -0.648 1.00 . B B . 5 ARG N 1 1
15 4719 2 1 5 ARG NE N -5.757 -8.422 0.645 1.00 . B B . 5 ARG NE 1 1
15 4720 2 1 5 ARG NH1 N -4.008 -8.955 2.053 1.00 . B B . 5 ARG NH1 1 1
15 4721 2 1 5 ARG NH2 N -5.070 -10.607 0.867 1.00 . B B . 5 ARG NH2 1 1
15 4722 2 1 5 ARG O O -5.545 -2.590 2.709 1.00 . B B . 5 ARG O 1 1
15 4723 2 1 6 HIS C C -4.747 0.292 1.949 1.00 . B B . 6 HIS C 1 1
15 4724 2 1 6 HIS CA C -3.626 -0.738 1.912 1.00 . B B . 6 HIS CA 1 1
15 4725 2 1 6 HIS CB C -2.385 -0.117 1.273 1.00 . B B . 6 HIS CB 1 1
15 4726 2 1 6 HIS CD2 C -0.736 -1.474 -0.178 1.00 . B B . 6 HIS CD2 1 1
15 4727 2 1 6 HIS CE1 C 0.302 -2.569 1.370 1.00 . B B . 6 HIS CE1 1 1
15 4728 2 1 6 HIS CG C -1.285 -1.094 1.001 1.00 . B B . 6 HIS CG 1 1
15 4729 2 1 6 HIS H H -3.620 -2.116 0.303 1.00 . B B . 6 HIS H 1 1
15 4730 2 1 6 HIS HA H -3.391 -1.041 2.923 1.00 . B B . 6 HIS HA 1 1
15 4731 2 1 6 HIS HB2 H -2.664 0.331 0.332 1.00 . B B . 6 HIS HB2 1 1
15 4732 2 1 6 HIS HB3 H -1.996 0.649 1.929 1.00 . B B . 6 HIS HB3 1 1
15 4733 2 1 6 HIS HD1 H -0.779 -1.750 2.943 1.00 . B B . 6 HIS HD1 1 1
15 4734 2 1 6 HIS HD2 H -1.021 -1.115 -1.156 1.00 . B B . 6 HIS HD2 1 1
15 4735 2 1 6 HIS HE1 H 0.985 -3.230 1.884 1.00 . B B . 6 HIS HE1 1 1
15 4736 2 1 6 HIS N N -4.040 -1.924 1.170 1.00 . B B . 6 HIS N 1 1
15 4737 2 1 6 HIS ND1 N -0.616 -1.800 1.977 1.00 . B B . 6 HIS ND1 1 1
15 4738 2 1 6 HIS NE2 N 0.266 -2.407 0.063 1.00 . B B . 6 HIS NE2 1 1
15 4739 2 1 6 HIS O O -4.977 0.944 2.968 1.00 . B B . 6 HIS O 1 1
15 4740 2 1 7 HIS C C -7.861 0.731 1.067 1.00 . B B . 7 HIS C 1 1
15 4741 2 1 7 HIS CA C -6.531 1.387 0.711 1.00 . B B . 7 HIS CA 1 1
15 4742 2 1 7 HIS CB C -6.588 1.956 -0.708 1.00 . B B . 7 HIS CB 1 1
15 4743 2 1 7 HIS CD2 C -4.080 2.336 -1.246 1.00 . B B . 7 HIS CD2 1 1
15 4744 2 1 7 HIS CE1 C -4.128 4.458 -1.668 1.00 . B B . 7 HIS CE1 1 1
15 4745 2 1 7 HIS CG C -5.370 2.739 -1.090 1.00 . B B . 7 HIS CG 1 1
15 4746 2 1 7 HIS H H -5.197 -0.114 0.047 1.00 . B B . 7 HIS H 1 1
15 4747 2 1 7 HIS HA H -6.343 2.193 1.406 1.00 . B B . 7 HIS HA 1 1
15 4748 2 1 7 HIS HB2 H -6.693 1.142 -1.410 1.00 . B B . 7 HIS HB2 1 1
15 4749 2 1 7 HIS HB3 H -7.445 2.610 -0.791 1.00 . B B . 7 HIS HB3 1 1
15 4750 2 1 7 HIS HD1 H -6.164 4.677 -1.332 1.00 . B B . 7 HIS HD1 1 1
15 4751 2 1 7 HIS HD2 H -3.704 1.333 -1.107 1.00 . B B . 7 HIS HD2 1 1
15 4752 2 1 7 HIS HE1 H -3.835 5.465 -1.925 1.00 . B B . 7 HIS HE1 1 1
15 4753 2 1 7 HIS N N -5.435 0.435 0.824 1.00 . B B . 7 HIS N 1 1
15 4754 2 1 7 HIS ND1 N -5.379 4.089 -1.360 1.00 . B B . 7 HIS ND1 1 1
15 4755 2 1 7 HIS NE2 N -3.302 3.431 -1.613 1.00 . B B . 7 HIS NE2 1 1
15 4756 2 1 7 HIS O O -8.126 -0.408 0.682 1.00 . B B . 7 HIS O 1 1
15 4757 2 1 8 SER C C -11.116 1.598 1.422 1.00 . B B . 8 SER C 1 1
15 4758 2 1 8 SER CA C -9.994 0.944 2.220 1.00 . B B . 8 SER CA 1 1
15 4759 2 1 8 SER CB C -10.209 1.185 3.716 1.00 . B B . 8 SER CB 1 1
15 4760 2 1 8 SER H H -8.422 2.355 2.086 1.00 . B B . 8 SER H 1 1
15 4761 2 1 8 SER HA H -10.006 -0.119 2.032 1.00 . B B . 8 SER HA 1 1
15 4762 2 1 8 SER HB2 H -9.528 0.566 4.281 1.00 . B B . 8 SER HB2 1 1
15 4763 2 1 8 SER HB3 H -10.021 2.225 3.941 1.00 . B B . 8 SER HB3 1 1
15 4764 2 1 8 SER HG H -11.674 -0.078 4.025 1.00 . B B . 8 SER HG 1 1
15 4765 2 1 8 SER N N -8.692 1.455 1.809 1.00 . B B . 8 SER N 1 1
15 4766 2 1 8 SER O O -11.095 2.804 1.177 1.00 . B B . 8 SER O 1 1
15 4767 2 1 8 SER OG O -11.536 0.868 4.098 1.00 . B B . 8 SER OG 1 1
15 4768 2 1 9 GLY C C -14.332 1.828 1.135 1.00 . B B . 9 GLY C 1 1
15 4769 2 1 9 GLY CA C -13.212 1.312 0.252 1.00 . B B . 9 GLY CA 1 1
15 4770 2 1 9 GLY H H -12.057 -0.159 1.245 1.00 . B B . 9 GLY H 1 1
15 4771 2 1 9 GLY HA2 H -12.861 2.117 -0.374 1.00 . B B . 9 GLY HA2 1 1
15 4772 2 1 9 GLY HA3 H -13.598 0.524 -0.376 1.00 . B B . 9 GLY HA3 1 1
15 4773 2 1 9 GLY N N -12.095 0.795 1.019 1.00 . B B . 9 GLY N 1 1
15 4774 2 1 9 GLY O O -14.203 1.860 2.358 1.00 . B B . 9 GLY O 1 1
15 4775 2 1 10 TYR C C -17.269 1.643 2.034 1.00 . B B . 10 TYR C 1 1
15 4776 2 1 10 TYR CA C -16.581 2.752 1.244 1.00 . B B . 10 TYR CA 1 1
15 4777 2 1 10 TYR CB C -17.576 3.402 0.281 1.00 . B B . 10 TYR CB 1 1
15 4778 2 1 10 TYR CD1 C -16.126 4.980 -1.053 1.00 . B B . 10 TYR CD1 1 1
15 4779 2 1 10 TYR CD2 C -17.841 5.912 0.314 1.00 . B B . 10 TYR CD2 1 1
15 4780 2 1 10 TYR CE1 C -15.754 6.247 -1.460 1.00 . B B . 10 TYR CE1 1 1
15 4781 2 1 10 TYR CE2 C -17.477 7.182 -0.089 1.00 . B B . 10 TYR CE2 1 1
15 4782 2 1 10 TYR CG C -17.173 4.791 -0.161 1.00 . B B . 10 TYR CG 1 1
15 4783 2 1 10 TYR CZ C -16.434 7.346 -0.975 1.00 . B B . 10 TYR CZ 1 1
15 4784 2 1 10 TYR H H -15.474 2.183 -0.467 1.00 . B B . 10 TYR H 1 1
15 4785 2 1 10 TYR HA H -16.223 3.500 1.935 1.00 . B B . 10 TYR HA 1 1
15 4786 2 1 10 TYR HB2 H -17.665 2.786 -0.602 1.00 . B B . 10 TYR HB2 1 1
15 4787 2 1 10 TYR HB3 H -18.540 3.472 0.764 1.00 . B B . 10 TYR HB3 1 1
15 4788 2 1 10 TYR HD1 H -15.597 4.117 -1.433 1.00 . B B . 10 TYR HD1 1 1
15 4789 2 1 10 TYR HD2 H -18.658 5.782 1.008 1.00 . B B . 10 TYR HD2 1 1
15 4790 2 1 10 TYR HE1 H -14.938 6.374 -2.155 1.00 . B B . 10 TYR HE1 1 1
15 4791 2 1 10 TYR HE2 H -18.008 8.043 0.292 1.00 . B B . 10 TYR HE2 1 1
15 4792 2 1 10 TYR HH H -15.831 8.593 -2.308 1.00 . B B . 10 TYR HH 1 1
15 4793 2 1 10 TYR N N -15.433 2.234 0.510 1.00 . B B . 10 TYR N 1 1
15 4794 2 1 10 TYR O O -17.633 0.618 1.419 1.00 . B B . 10 TYR O 1 1
15 4795 2 1 10 TYR OH O -16.067 8.609 -1.378 1.00 . B B . 10 TYR OH 1 1
15 4796 2 1 11 NH2 HN1 H -17.135 2.670 3.784 1.00 . B B . 11 NH2 HN1 1 1
15 4797 2 1 11 NH2 HN2 H -17.903 1.102 3.890 1.00 . B B . 11 NH2 HN2 1 1
15 4798 2 1 11 NH2 N N -17.450 1.819 3.341 1.00 . B B . 11 NH2 N 1 1
15 4799 3 2 1 ZN ZN ZN 1.668 -3.402 -1.079 1.00 . C A . 101 ZN ZN 1 1
15 4800 4 2 1 ZN ZN ZN -1.408 2.933 -2.175 1.00 . D A . 102 ZN ZN 1 1
16 4801 1 1 1 ASP C C 0.527 5.150 -2.009 1.00 . A A . 1 ASP C 1 1
16 4802 1 1 1 ASP CA C 0.458 6.280 -0.987 1.00 . A A . 1 ASP CA 1 1
16 4803 1 1 1 ASP CB C 0.482 5.705 0.431 1.00 . A A . 1 ASP CB 1 1
16 4804 1 1 1 ASP CG C 0.667 6.778 1.487 1.00 . A A . 1 ASP CG 1 1
16 4805 1 1 1 ASP H1 H -1.593 6.437 -1.025 1.00 . A A . 1 ASP H1 1 1
16 4806 1 1 1 ASP H2 H -0.774 7.483 -2.112 1.00 . A A . 1 ASP H2 1 1
16 4807 1 1 1 ASP H3 H -0.781 7.825 -0.431 1.00 . A A . 1 ASP H3 1 1
16 4808 1 1 1 ASP HA H 1.308 6.931 -1.122 1.00 . A A . 1 ASP HA 1 1
16 4809 1 1 1 ASP HB2 H -0.451 5.197 0.622 1.00 . A A . 1 ASP HB2 1 1
16 4810 1 1 1 ASP HB3 H 1.296 4.999 0.514 1.00 . A A . 1 ASP HB3 1 1
16 4811 1 1 1 ASP N N -0.784 7.078 -1.153 1.00 . A A . 1 ASP N 1 1
16 4812 1 1 1 ASP O O -0.498 4.667 -2.485 1.00 . A A . 1 ASP O 1 1
16 4813 1 1 1 ASP OD1 O 1.141 7.879 1.138 1.00 . A A . 1 ASP OD1 1 1
16 4814 1 1 1 ASP OD2 O 0.337 6.516 2.663 1.00 . A A . 1 ASP OD2 1 1
16 4815 1 1 2 ALA C C 2.625 2.462 -2.649 1.00 . A A . 2 ALA C 1 1
16 4816 1 1 2 ALA CA C 1.947 3.659 -3.305 1.00 . A A . 2 ALA CA 1 1
16 4817 1 1 2 ALA CB C 2.770 4.157 -4.484 1.00 . A A . 2 ALA CB 1 1
16 4818 1 1 2 ALA H H 2.524 5.158 -1.928 1.00 . A A . 2 ALA H 1 1
16 4819 1 1 2 ALA HA H 0.978 3.353 -3.676 1.00 . A A . 2 ALA HA 1 1
16 4820 1 1 2 ALA HB1 H 2.302 3.848 -5.406 1.00 . A A . 2 ALA HB1 1 1
16 4821 1 1 2 ALA HB2 H 3.766 3.741 -4.428 1.00 . A A . 2 ALA HB2 1 1
16 4822 1 1 2 ALA HB3 H 2.828 5.234 -4.453 1.00 . A A . 2 ALA HB3 1 1
16 4823 1 1 2 ALA N N 1.743 4.734 -2.342 1.00 . A A . 2 ALA N 1 1
16 4824 1 1 2 ALA O O 2.959 2.496 -1.466 1.00 . A A . 2 ALA O 1 1
16 4825 1 1 3 GLU C C 4.813 0.507 -2.292 1.00 . A A . 3 GLU C 1 1
16 4826 1 1 3 GLU CA C 3.460 0.192 -2.928 1.00 . A A . 3 GLU CA 1 1
16 4827 1 1 3 GLU CB C 3.640 -0.817 -4.065 1.00 . A A . 3 GLU CB 1 1
16 4828 1 1 3 GLU CD C 2.582 -2.880 -3.064 1.00 . A A . 3 GLU CD 1 1
16 4829 1 1 3 GLU CG C 3.854 -2.244 -3.586 1.00 . A A . 3 GLU CG 1 1
16 4830 1 1 3 GLU H H 2.532 1.442 -4.363 1.00 . A A . 3 GLU H 1 1
16 4831 1 1 3 GLU HA H 2.814 -0.236 -2.177 1.00 . A A . 3 GLU HA 1 1
16 4832 1 1 3 GLU HB2 H 2.758 -0.799 -4.688 1.00 . A A . 3 GLU HB2 1 1
16 4833 1 1 3 GLU HB3 H 4.495 -0.526 -4.657 1.00 . A A . 3 GLU HB3 1 1
16 4834 1 1 3 GLU HG2 H 4.219 -2.836 -4.412 1.00 . A A . 3 GLU HG2 1 1
16 4835 1 1 3 GLU HG3 H 4.589 -2.239 -2.795 1.00 . A A . 3 GLU HG3 1 1
16 4836 1 1 3 GLU N N 2.823 1.405 -3.429 1.00 . A A . 3 GLU N 1 1
16 4837 1 1 3 GLU O O 5.259 -0.190 -1.381 1.00 . A A . 3 GLU O 1 1
16 4838 1 1 3 GLU OE1 O 1.707 -2.139 -2.571 1.00 . A A . 3 GLU OE1 1 1
16 4839 1 1 3 GLU OE2 O 2.460 -4.121 -3.151 1.00 . A A . 3 GLU OE2 1 1
16 4840 1 1 4 PHE C C 6.607 2.719 -0.930 1.00 . A A . 4 PHE C 1 1
16 4841 1 1 4 PHE CA C 6.761 1.957 -2.245 1.00 . A A . 4 PHE CA 1 1
16 4842 1 1 4 PHE CB C 7.514 2.817 -3.263 1.00 . A A . 4 PHE CB 1 1
16 4843 1 1 4 PHE CD1 C 6.912 5.175 -2.649 1.00 . A A . 4 PHE CD1 1 1
16 4844 1 1 4 PHE CD2 C 6.155 4.322 -4.743 1.00 . A A . 4 PHE CD2 1 1
16 4845 1 1 4 PHE CE1 C 6.301 6.385 -2.917 1.00 . A A . 4 PHE CE1 1 1
16 4846 1 1 4 PHE CE2 C 5.541 5.530 -5.016 1.00 . A A . 4 PHE CE2 1 1
16 4847 1 1 4 PHE CG C 6.845 4.131 -3.556 1.00 . A A . 4 PHE CG 1 1
16 4848 1 1 4 PHE CZ C 5.615 6.563 -4.102 1.00 . A A . 4 PHE CZ 1 1
16 4849 1 1 4 PHE H H 5.060 2.079 -3.500 1.00 . A A . 4 PHE H 1 1
16 4850 1 1 4 PHE HA H 7.329 1.059 -2.058 1.00 . A A . 4 PHE HA 1 1
16 4851 1 1 4 PHE HB2 H 8.503 3.027 -2.885 1.00 . A A . 4 PHE HB2 1 1
16 4852 1 1 4 PHE HB3 H 7.597 2.271 -4.192 1.00 . A A . 4 PHE HB3 1 1
16 4853 1 1 4 PHE HD1 H 7.448 5.037 -1.721 1.00 . A A . 4 PHE HD1 1 1
16 4854 1 1 4 PHE HD2 H 6.096 3.515 -5.458 1.00 . A A . 4 PHE HD2 1 1
16 4855 1 1 4 PHE HE1 H 6.360 7.191 -2.200 1.00 . A A . 4 PHE HE1 1 1
16 4856 1 1 4 PHE HE2 H 5.005 5.666 -5.944 1.00 . A A . 4 PHE HE2 1 1
16 4857 1 1 4 PHE HZ H 5.137 7.509 -4.314 1.00 . A A . 4 PHE HZ 1 1
16 4858 1 1 4 PHE N N 5.463 1.559 -2.775 1.00 . A A . 4 PHE N 1 1
16 4859 1 1 4 PHE O O 7.516 2.728 -0.099 1.00 . A A . 4 PHE O 1 1
16 4860 1 1 5 ARG C C 4.686 3.225 1.584 1.00 . A A . 5 ARG C 1 1
16 4861 1 1 5 ARG CA C 5.190 4.127 0.460 1.00 . A A . 5 ARG CA 1 1
16 4862 1 1 5 ARG CB C 4.165 5.223 0.172 1.00 . A A . 5 ARG CB 1 1
16 4863 1 1 5 ARG CD C 5.077 6.795 1.907 1.00 . A A . 5 ARG CD 1 1
16 4864 1 1 5 ARG CG C 3.840 6.089 1.377 1.00 . A A . 5 ARG CG 1 1
16 4865 1 1 5 ARG CZ C 5.634 8.247 3.819 1.00 . A A . 5 ARG CZ 1 1
16 4866 1 1 5 ARG H H 4.771 3.319 -1.450 1.00 . A A . 5 ARG H 1 1
16 4867 1 1 5 ARG HA H 6.115 4.585 0.771 1.00 . A A . 5 ARG HA 1 1
16 4868 1 1 5 ARG HB2 H 4.547 5.863 -0.610 1.00 . A A . 5 ARG HB2 1 1
16 4869 1 1 5 ARG HB3 H 3.250 4.763 -0.168 1.00 . A A . 5 ARG HB3 1 1
16 4870 1 1 5 ARG HD2 H 5.751 6.056 2.315 1.00 . A A . 5 ARG HD2 1 1
16 4871 1 1 5 ARG HD3 H 5.560 7.309 1.090 1.00 . A A . 5 ARG HD3 1 1
16 4872 1 1 5 ARG HE H 3.821 8.073 3.005 1.00 . A A . 5 ARG HE 1 1
16 4873 1 1 5 ARG HG2 H 3.112 6.831 1.090 1.00 . A A . 5 ARG HG2 1 1
16 4874 1 1 5 ARG HG3 H 3.432 5.462 2.157 1.00 . A A . 5 ARG HG3 1 1
16 4875 1 1 5 ARG HH11 H 7.194 7.183 3.095 1.00 . A A . 5 ARG HH11 1 1
16 4876 1 1 5 ARG HH12 H 7.559 8.216 4.435 1.00 . A A . 5 ARG HH12 1 1
16 4877 1 1 5 ARG HH21 H 4.299 9.434 4.766 1.00 . A A . 5 ARG HH21 1 1
16 4878 1 1 5 ARG HH22 H 5.916 9.494 5.384 1.00 . A A . 5 ARG HH22 1 1
16 4879 1 1 5 ARG N N 5.456 3.359 -0.751 1.00 . A A . 5 ARG N 1 1
16 4880 1 1 5 ARG NE N 4.749 7.763 2.951 1.00 . A A . 5 ARG NE 1 1
16 4881 1 1 5 ARG NH1 N 6.900 7.849 3.779 1.00 . A A . 5 ARG NH1 1 1
16 4882 1 1 5 ARG NH2 N 5.252 9.130 4.731 1.00 . A A . 5 ARG NH2 1 1
16 4883 1 1 5 ARG O O 5.049 3.404 2.746 1.00 . A A . 5 ARG O 1 1
16 4884 1 1 6 HIS C C 4.362 0.403 2.754 1.00 . A A . 6 HIS C 1 1
16 4885 1 1 6 HIS CA C 3.287 1.334 2.214 1.00 . A A . 6 HIS CA 1 1
16 4886 1 1 6 HIS CB C 2.169 0.498 1.591 1.00 . A A . 6 HIS CB 1 1
16 4887 1 1 6 HIS CD2 C 0.732 1.365 -0.368 1.00 . A A . 6 HIS CD2 1 1
16 4888 1 1 6 HIS CE1 C -0.565 2.719 0.710 1.00 . A A . 6 HIS CE1 1 1
16 4889 1 1 6 HIS CG C 1.101 1.309 0.934 1.00 . A A . 6 HIS CG 1 1
16 4890 1 1 6 HIS H H 3.590 2.167 0.287 1.00 . A A . 6 HIS H 1 1
16 4891 1 1 6 HIS HA H 2.883 1.915 3.028 1.00 . A A . 6 HIS HA 1 1
16 4892 1 1 6 HIS HB2 H 2.593 -0.155 0.844 1.00 . A A . 6 HIS HB2 1 1
16 4893 1 1 6 HIS HB3 H 1.706 -0.100 2.363 1.00 . A A . 6 HIS HB3 1 1
16 4894 1 1 6 HIS HD1 H 0.283 2.362 2.567 1.00 . A A . 6 HIS HD1 1 1
16 4895 1 1 6 HIS HD2 H 1.180 0.807 -1.179 1.00 . A A . 6 HIS HD2 1 1
16 4896 1 1 6 HIS HE1 H -1.333 3.439 0.948 1.00 . A A . 6 HIS HE1 1 1
16 4897 1 1 6 HIS N N 3.844 2.259 1.230 1.00 . A A . 6 HIS N 1 1
16 4898 1 1 6 HIS ND1 N 0.268 2.177 1.606 1.00 . A A . 6 HIS ND1 1 1
16 4899 1 1 6 HIS NE2 N -0.326 2.261 -0.504 1.00 . A A . 6 HIS NE2 1 1
16 4900 1 1 6 HIS O O 4.402 0.105 3.947 1.00 . A A . 6 HIS O 1 1
16 4901 1 1 7 HIS C C 7.591 -0.216 2.502 1.00 . A A . 7 HIS C 1 1
16 4902 1 1 7 HIS CA C 6.295 -0.974 2.236 1.00 . A A . 7 HIS CA 1 1
16 4903 1 1 7 HIS CB C 6.504 -2.010 1.133 1.00 . A A . 7 HIS CB 1 1
16 4904 1 1 7 HIS CD2 C 4.186 -2.525 0.087 1.00 . A A . 7 HIS CD2 1 1
16 4905 1 1 7 HIS CE1 C 3.895 -4.529 0.845 1.00 . A A . 7 HIS CE1 1 1
16 4906 1 1 7 HIS CG C 5.281 -2.825 0.837 1.00 . A A . 7 HIS CG 1 1
16 4907 1 1 7 HIS H H 5.131 0.207 0.923 1.00 . A A . 7 HIS H 1 1
16 4908 1 1 7 HIS HA H 5.995 -1.481 3.141 1.00 . A A . 7 HIS HA 1 1
16 4909 1 1 7 HIS HB2 H 6.795 -1.505 0.224 1.00 . A A . 7 HIS HB2 1 1
16 4910 1 1 7 HIS HB3 H 7.291 -2.687 1.431 1.00 . A A . 7 HIS HB3 1 1
16 4911 1 1 7 HIS HD1 H 5.686 -4.607 1.888 1.00 . A A . 7 HIS HD1 1 1
16 4912 1 1 7 HIS HD2 H 3.996 -1.589 -0.418 1.00 . A A . 7 HIS HD2 1 1
16 4913 1 1 7 HIS HE1 H 3.466 -5.494 1.064 1.00 . A A . 7 HIS HE1 1 1
16 4914 1 1 7 HIS N N 5.223 -0.062 1.861 1.00 . A A . 7 HIS N 1 1
16 4915 1 1 7 HIS ND1 N 5.076 -4.101 1.311 1.00 . A A . 7 HIS ND1 1 1
16 4916 1 1 7 HIS NE2 N 3.317 -3.611 0.095 1.00 . A A . 7 HIS NE2 1 1
16 4917 1 1 7 HIS O O 8.288 0.191 1.572 1.00 . A A . 7 HIS O 1 1
16 4918 1 1 8 SER C C 9.561 0.238 5.573 1.00 . A A . 8 SER C 1 1
16 4919 1 1 8 SER CA C 9.121 0.669 4.179 1.00 . A A . 8 SER CA 1 1
16 4920 1 1 8 SER CB C 8.890 2.181 4.148 1.00 . A A . 8 SER CB 1 1
16 4921 1 1 8 SER H H 7.311 -0.386 4.474 1.00 . A A . 8 SER H 1 1
16 4922 1 1 8 SER HA H 9.898 0.417 3.473 1.00 . A A . 8 SER HA 1 1
16 4923 1 1 8 SER HB2 H 8.518 2.467 3.175 1.00 . A A . 8 SER HB2 1 1
16 4924 1 1 8 SER HB3 H 8.165 2.449 4.903 1.00 . A A . 8 SER HB3 1 1
16 4925 1 1 8 SER HG H 10.018 3.781 4.058 1.00 . A A . 8 SER HG 1 1
16 4926 1 1 8 SER N N 7.908 -0.035 3.780 1.00 . A A . 8 SER N 1 1
16 4927 1 1 8 SER O O 8.731 -0.004 6.449 1.00 . A A . 8 SER O 1 1
16 4928 1 1 8 SER OG O 10.093 2.887 4.400 1.00 . A A . 8 SER OG 1 1
16 4929 1 1 9 GLY C C 12.693 0.438 7.414 1.00 . A A . 9 GLY C 1 1
16 4930 1 1 9 GLY CA C 11.395 -0.262 7.065 1.00 . A A . 9 GLY CA 1 1
16 4931 1 1 9 GLY H H 11.487 0.346 5.039 1.00 . A A . 9 GLY H 1 1
16 4932 1 1 9 GLY HA2 H 10.662 -0.035 7.825 1.00 . A A . 9 GLY HA2 1 1
16 4933 1 1 9 GLY HA3 H 11.566 -1.329 7.054 1.00 . A A . 9 GLY HA3 1 1
16 4934 1 1 9 GLY N N 10.872 0.142 5.773 1.00 . A A . 9 GLY N 1 1
16 4935 1 1 9 GLY O O 13.369 0.979 6.539 1.00 . A A . 9 GLY O 1 1
16 4936 1 1 10 TYR C C 15.437 0.084 9.128 1.00 . A A . 10 TYR C 1 1
16 4937 1 1 10 TYR CA C 14.268 1.063 9.162 1.00 . A A . 10 TYR CA 1 1
16 4938 1 1 10 TYR CB C 14.079 1.600 10.581 1.00 . A A . 10 TYR CB 1 1
16 4939 1 1 10 TYR CD1 C 11.776 2.597 10.857 1.00 . A A . 10 TYR CD1 1 1
16 4940 1 1 10 TYR CD2 C 13.614 4.081 10.541 1.00 . A A . 10 TYR CD2 1 1
16 4941 1 1 10 TYR CE1 C 10.914 3.674 10.930 1.00 . A A . 10 TYR CE1 1 1
16 4942 1 1 10 TYR CE2 C 12.758 5.164 10.614 1.00 . A A . 10 TYR CE2 1 1
16 4943 1 1 10 TYR CG C 13.139 2.781 10.662 1.00 . A A . 10 TYR CG 1 1
16 4944 1 1 10 TYR CZ C 11.409 4.954 10.809 1.00 . A A . 10 TYR CZ 1 1
16 4945 1 1 10 TYR H H 12.461 -0.023 9.345 1.00 . A A . 10 TYR H 1 1
16 4946 1 1 10 TYR HA H 14.485 1.888 8.500 1.00 . A A . 10 TYR HA 1 1
16 4947 1 1 10 TYR HB2 H 13.677 0.815 11.205 1.00 . A A . 10 TYR HB2 1 1
16 4948 1 1 10 TYR HB3 H 15.037 1.910 10.973 1.00 . A A . 10 TYR HB3 1 1
16 4949 1 1 10 TYR HD1 H 11.391 1.592 10.952 1.00 . A A . 10 TYR HD1 1 1
16 4950 1 1 10 TYR HD2 H 14.671 4.241 10.388 1.00 . A A . 10 TYR HD2 1 1
16 4951 1 1 10 TYR HE1 H 9.857 3.510 11.083 1.00 . A A . 10 TYR HE1 1 1
16 4952 1 1 10 TYR HE2 H 13.147 6.167 10.518 1.00 . A A . 10 TYR HE2 1 1
16 4953 1 1 10 TYR HH H 10.505 6.340 11.789 1.00 . A A . 10 TYR HH 1 1
16 4954 1 1 10 TYR N N 13.042 0.426 8.696 1.00 . A A . 10 TYR N 1 1
16 4955 1 1 10 TYR O O 16.597 0.548 9.139 1.00 . A A . 10 TYR O 1 1
16 4956 1 1 10 TYR OH O 10.554 6.029 10.881 1.00 . A A . 10 TYR OH 1 1
16 4957 1 1 11 NH2 HN1 H 14.208 -1.536 9.081 1.00 . A A . 11 NH2 HN1 1 1
16 4958 1 1 11 NH2 HN2 H 15.921 -1.891 9.065 1.00 . A A . 11 NH2 HN2 1 1
16 4959 1 1 11 NH2 N N 15.167 -1.219 9.088 1.00 . A A . 11 NH2 N 1 1
16 4960 2 1 1 ASP C C -0.343 -5.604 -0.688 1.00 . B B . 1 ASP C 1 1
16 4961 2 1 1 ASP CA C -0.446 -6.475 0.560 1.00 . B B . 1 ASP CA 1 1
16 4962 2 1 1 ASP CB C -0.867 -5.627 1.760 1.00 . B B . 1 ASP CB 1 1
16 4963 2 1 1 ASP CG C -1.209 -6.470 2.973 1.00 . B B . 1 ASP CG 1 1
16 4964 2 1 1 ASP H1 H 1.478 -6.400 1.284 1.00 . B B . 1 ASP H1 1 1
16 4965 2 1 1 ASP H2 H 1.246 -7.489 -0.023 1.00 . B B . 1 ASP H2 1 1
16 4966 2 1 1 ASP H3 H 0.674 -7.892 1.544 1.00 . B B . 1 ASP H3 1 1
16 4967 2 1 1 ASP HA H -1.183 -7.246 0.392 1.00 . B B . 1 ASP HA 1 1
16 4968 2 1 1 ASP HB2 H -0.059 -4.962 2.023 1.00 . B B . 1 ASP HB2 1 1
16 4969 2 1 1 ASP HB3 H -1.735 -5.045 1.491 1.00 . B B . 1 ASP HB3 1 1
16 4970 2 1 1 ASP N N 0.855 -7.123 0.869 1.00 . B B . 1 ASP N 1 1
16 4971 2 1 1 ASP O O 0.746 -5.179 -1.070 1.00 . B B . 1 ASP O 1 1
16 4972 2 1 1 ASP OD1 O -1.196 -5.925 4.096 1.00 . B B . 1 ASP OD1 1 1
16 4973 2 1 1 ASP OD2 O -1.490 -7.675 2.800 1.00 . B B . 1 ASP OD2 1 1
16 4974 2 1 2 ALA C C -2.259 -3.213 -2.280 1.00 . B B . 2 ALA C 1 1
16 4975 2 1 2 ALA CA C -1.514 -4.520 -2.522 1.00 . B B . 2 ALA CA 1 1
16 4976 2 1 2 ALA CB C -2.156 -5.290 -3.665 1.00 . B B . 2 ALA CB 1 1
16 4977 2 1 2 ALA H H -2.321 -5.707 -0.967 1.00 . B B . 2 ALA H 1 1
16 4978 2 1 2 ALA HA H -0.494 -4.294 -2.801 1.00 . B B . 2 ALA HA 1 1
16 4979 2 1 2 ALA HB1 H -2.439 -6.274 -3.321 1.00 . B B . 2 ALA HB1 1 1
16 4980 2 1 2 ALA HB2 H -1.452 -5.381 -4.479 1.00 . B B . 2 ALA HB2 1 1
16 4981 2 1 2 ALA HB3 H -3.034 -4.762 -4.006 1.00 . B B . 2 ALA HB3 1 1
16 4982 2 1 2 ALA N N -1.482 -5.340 -1.318 1.00 . B B . 2 ALA N 1 1
16 4983 2 1 2 ALA O O -2.768 -2.968 -1.188 1.00 . B B . 2 ALA O 1 1
16 4984 2 1 3 GLU C C -4.418 -1.252 -2.696 1.00 . B B . 3 GLU C 1 1
16 4985 2 1 3 GLU CA C -2.996 -1.091 -3.226 1.00 . B B . 3 GLU CA 1 1
16 4986 2 1 3 GLU CB C -3.021 -0.416 -4.601 1.00 . B B . 3 GLU CB 1 1
16 4987 2 1 3 GLU CD C -2.110 1.876 -4.051 1.00 . B B . 3 GLU CD 1 1
16 4988 2 1 3 GLU CG C -3.300 1.077 -4.544 1.00 . B B . 3 GLU CG 1 1
16 4989 2 1 3 GLU H H -1.891 -2.638 -4.157 1.00 . B B . 3 GLU H 1 1
16 4990 2 1 3 GLU HA H -2.438 -0.471 -2.542 1.00 . B B . 3 GLU HA 1 1
16 4991 2 1 3 GLU HB2 H -2.064 -0.563 -5.078 1.00 . B B . 3 GLU HB2 1 1
16 4992 2 1 3 GLU HB3 H -3.788 -0.881 -5.202 1.00 . B B . 3 GLU HB3 1 1
16 4993 2 1 3 GLU HG2 H -3.555 1.421 -5.535 1.00 . B B . 3 GLU HG2 1 1
16 4994 2 1 3 GLU HG3 H -4.132 1.251 -3.878 1.00 . B B . 3 GLU HG3 1 1
16 4995 2 1 3 GLU N N -2.317 -2.380 -3.313 1.00 . B B . 3 GLU N 1 1
16 4996 2 1 3 GLU O O -4.928 -0.382 -1.992 1.00 . B B . 3 GLU O 1 1
16 4997 2 1 3 GLU OE1 O -1.317 1.328 -3.259 1.00 . B B . 3 GLU OE1 1 1
16 4998 2 1 3 GLU OE2 O -1.971 3.048 -4.459 1.00 . B B . 3 GLU OE2 1 1
16 4999 2 1 4 PHE C C -6.427 -3.011 -1.098 1.00 . B B . 4 PHE C 1 1
16 5000 2 1 4 PHE CA C -6.414 -2.628 -2.574 1.00 . B B . 4 PHE CA 1 1
16 5001 2 1 4 PHE CB C -7.080 -3.719 -3.418 1.00 . B B . 4 PHE CB 1 1
16 5002 2 1 4 PHE CD1 C -6.646 -5.993 -2.448 1.00 . B B . 4 PHE CD1 1 1
16 5003 2 1 4 PHE CD2 C -5.405 -5.324 -4.372 1.00 . B B . 4 PHE CD2 1 1
16 5004 2 1 4 PHE CE1 C -5.993 -7.211 -2.446 1.00 . B B . 4 PHE CE1 1 1
16 5005 2 1 4 PHE CE2 C -4.747 -6.540 -4.373 1.00 . B B . 4 PHE CE2 1 1
16 5006 2 1 4 PHE CG C -6.359 -5.037 -3.409 1.00 . B B . 4 PHE CG 1 1
16 5007 2 1 4 PHE CZ C -5.041 -7.484 -3.409 1.00 . B B . 4 PHE CZ 1 1
16 5008 2 1 4 PHE H H -4.600 -3.032 -3.589 1.00 . B B . 4 PHE H 1 1
16 5009 2 1 4 PHE HA H -6.974 -1.711 -2.691 1.00 . B B . 4 PHE HA 1 1
16 5010 2 1 4 PHE HB2 H -8.080 -3.890 -3.047 1.00 . B B . 4 PHE HB2 1 1
16 5011 2 1 4 PHE HB3 H -7.140 -3.381 -4.444 1.00 . B B . 4 PHE HB3 1 1
16 5012 2 1 4 PHE HD1 H -7.388 -5.779 -1.694 1.00 . B B . 4 PHE HD1 1 1
16 5013 2 1 4 PHE HD2 H -5.172 -4.586 -5.124 1.00 . B B . 4 PHE HD2 1 1
16 5014 2 1 4 PHE HE1 H -6.225 -7.946 -1.693 1.00 . B B . 4 PHE HE1 1 1
16 5015 2 1 4 PHE HE2 H -4.003 -6.751 -5.127 1.00 . B B . 4 PHE HE2 1 1
16 5016 2 1 4 PHE HZ H -4.530 -8.436 -3.410 1.00 . B B . 4 PHE HZ 1 1
16 5017 2 1 4 PHE N N -5.055 -2.369 -3.031 1.00 . B B . 4 PHE N 1 1
16 5018 2 1 4 PHE O O -7.404 -2.763 -0.392 1.00 . B B . 4 PHE O 1 1
16 5019 2 1 5 ARG C C -4.955 -2.779 1.644 1.00 . B B . 5 ARG C 1 1
16 5020 2 1 5 ARG CA C -5.218 -3.996 0.771 1.00 . B B . 5 ARG CA 1 1
16 5021 2 1 5 ARG CB C -4.088 -5.005 0.956 1.00 . B B . 5 ARG CB 1 1
16 5022 2 1 5 ARG CD C -5.619 -6.989 1.023 1.00 . B B . 5 ARG CD 1 1
16 5023 2 1 5 ARG CG C -4.386 -6.372 0.379 1.00 . B B . 5 ARG CG 1 1
16 5024 2 1 5 ARG CZ C -4.984 -9.352 1.317 1.00 . B B . 5 ARG CZ 1 1
16 5025 2 1 5 ARG H H -4.576 -3.763 -1.235 1.00 . B B . 5 ARG H 1 1
16 5026 2 1 5 ARG HA H -6.152 -4.449 1.069 1.00 . B B . 5 ARG HA 1 1
16 5027 2 1 5 ARG HB2 H -3.203 -4.621 0.472 1.00 . B B . 5 ARG HB2 1 1
16 5028 2 1 5 ARG HB3 H -3.890 -5.117 2.013 1.00 . B B . 5 ARG HB3 1 1
16 5029 2 1 5 ARG HD2 H -5.558 -6.849 2.091 1.00 . B B . 5 ARG HD2 1 1
16 5030 2 1 5 ARG HD3 H -6.495 -6.484 0.645 1.00 . B B . 5 ARG HD3 1 1
16 5031 2 1 5 ARG HE H -6.409 -8.696 0.085 1.00 . B B . 5 ARG HE 1 1
16 5032 2 1 5 ARG HG2 H -4.551 -6.270 -0.679 1.00 . B B . 5 ARG HG2 1 1
16 5033 2 1 5 ARG HG3 H -3.538 -7.017 0.554 1.00 . B B . 5 ARG HG3 1 1
16 5034 2 1 5 ARG HH11 H -3.924 -8.054 2.449 1.00 . B B . 5 ARG HH11 1 1
16 5035 2 1 5 ARG HH12 H -3.501 -9.722 2.639 1.00 . B B . 5 ARG HH12 1 1
16 5036 2 1 5 ARG HH21 H -5.854 -10.889 0.333 1.00 . B B . 5 ARG HH21 1 1
16 5037 2 1 5 ARG HH22 H -4.595 -11.331 1.437 1.00 . B B . 5 ARG HH22 1 1
16 5038 2 1 5 ARG N N -5.330 -3.602 -0.630 1.00 . B B . 5 ARG N 1 1
16 5039 2 1 5 ARG NE N -5.734 -8.417 0.738 1.00 . B B . 5 ARG NE 1 1
16 5040 2 1 5 ARG NH1 N -4.061 -9.015 2.208 1.00 . B B . 5 ARG NH1 1 1
16 5041 2 1 5 ARG NH2 N -5.159 -10.629 1.004 1.00 . B B . 5 ARG NH2 1 1
16 5042 2 1 5 ARG O O -5.546 -2.620 2.711 1.00 . B B . 5 ARG O 1 1
16 5043 2 1 6 HIS C C -4.844 0.274 1.910 1.00 . B B . 6 HIS C 1 1
16 5044 2 1 6 HIS CA C -3.688 -0.717 1.903 1.00 . B B . 6 HIS CA 1 1
16 5045 2 1 6 HIS CB C -2.458 -0.069 1.270 1.00 . B B . 6 HIS CB 1 1
16 5046 2 1 6 HIS CD2 C -0.799 -1.451 -0.146 1.00 . B B . 6 HIS CD2 1 1
16 5047 2 1 6 HIS CE1 C 0.311 -2.421 1.436 1.00 . B B . 6 HIS CE1 1 1
16 5048 2 1 6 HIS CG C -1.331 -1.021 1.024 1.00 . B B . 6 HIS CG 1 1
16 5049 2 1 6 HIS H H -3.617 -2.122 0.317 1.00 . B B . 6 HIS H 1 1
16 5050 2 1 6 HIS HA H -3.457 -0.995 2.920 1.00 . B B . 6 HIS HA 1 1
16 5051 2 1 6 HIS HB2 H -2.739 0.361 0.320 1.00 . B B . 6 HIS HB2 1 1
16 5052 2 1 6 HIS HB3 H -2.098 0.715 1.920 1.00 . B B . 6 HIS HB3 1 1
16 5053 2 1 6 HIS HD1 H -0.756 -1.545 2.985 1.00 . B B . 6 HIS HD1 1 1
16 5054 2 1 6 HIS HD2 H -1.121 -1.158 -1.134 1.00 . B B . 6 HIS HD2 1 1
16 5055 2 1 6 HIS HE1 H 1.026 -3.031 1.969 1.00 . B B . 6 HIS HE1 1 1
16 5056 2 1 6 HIS N N -4.052 -1.928 1.176 1.00 . B B . 6 HIS N 1 1
16 5057 2 1 6 HIS ND1 N -0.615 -1.647 2.021 1.00 . B B . 6 HIS ND1 1 1
16 5058 2 1 6 HIS NE2 N 0.239 -2.337 0.122 1.00 . B B . 6 HIS NE2 1 1
16 5059 2 1 6 HIS O O -5.107 0.934 2.915 1.00 . B B . 6 HIS O 1 1
16 5060 2 1 7 HIS C C -7.975 0.554 0.831 1.00 . B B . 7 HIS C 1 1
16 5061 2 1 7 HIS CA C -6.653 1.289 0.638 1.00 . B B . 7 HIS CA 1 1
16 5062 2 1 7 HIS CB C -6.622 1.957 -0.738 1.00 . B B . 7 HIS CB 1 1
16 5063 2 1 7 HIS CD2 C -4.110 2.347 -1.251 1.00 . B B . 7 HIS CD2 1 1
16 5064 2 1 7 HIS CE1 C -4.082 4.510 -1.247 1.00 . B B . 7 HIS CE1 1 1
16 5065 2 1 7 HIS CG C -5.379 2.756 -0.988 1.00 . B B . 7 HIS CG 1 1
16 5066 2 1 7 HIS H H -5.261 -0.177 0.010 1.00 . B B . 7 HIS H 1 1
16 5067 2 1 7 HIS HA H -6.561 2.048 1.400 1.00 . B B . 7 HIS HA 1 1
16 5068 2 1 7 HIS HB2 H -6.685 1.196 -1.501 1.00 . B B . 7 HIS HB2 1 1
16 5069 2 1 7 HIS HB3 H -7.469 2.621 -0.827 1.00 . B B . 7 HIS HB3 1 1
16 5070 2 1 7 HIS HD1 H -6.100 4.731 -0.827 1.00 . B B . 7 HIS HD1 1 1
16 5071 2 1 7 HIS HD2 H -3.773 1.323 -1.320 1.00 . B B . 7 HIS HD2 1 1
16 5072 2 1 7 HIS HE1 H -3.752 5.536 -1.308 1.00 . B B . 7 HIS HE1 1 1
16 5073 2 1 7 HIS N N -5.526 0.376 0.776 1.00 . B B . 7 HIS N 1 1
16 5074 2 1 7 HIS ND1 N -5.341 4.133 -0.988 1.00 . B B . 7 HIS ND1 1 1
16 5075 2 1 7 HIS NE2 N -3.296 3.463 -1.414 1.00 . B B . 7 HIS NE2 1 1
16 5076 2 1 7 HIS O O -8.170 -0.540 0.303 1.00 . B B . 7 HIS O 1 1
16 5077 2 1 8 SER C C -11.254 1.169 0.952 1.00 . B B . 8 SER C 1 1
16 5078 2 1 8 SER CA C -10.183 0.560 1.851 1.00 . B B . 8 SER CA 1 1
16 5079 2 1 8 SER CB C -10.569 0.743 3.319 1.00 . B B . 8 SER CB 1 1
16 5080 2 1 8 SER H H -8.668 2.032 1.984 1.00 . B B . 8 SER H 1 1
16 5081 2 1 8 SER HA H -10.109 -0.496 1.636 1.00 . B B . 8 SER HA 1 1
16 5082 2 1 8 SER HB2 H -9.828 0.269 3.945 1.00 . B B . 8 SER HB2 1 1
16 5083 2 1 8 SER HB3 H -10.611 1.797 3.549 1.00 . B B . 8 SER HB3 1 1
16 5084 2 1 8 SER HG H -12.510 0.618 3.083 1.00 . B B . 8 SER HG 1 1
16 5085 2 1 8 SER N N -8.881 1.161 1.589 1.00 . B B . 8 SER N 1 1
16 5086 2 1 8 SER O O -11.503 2.374 0.993 1.00 . B B . 8 SER O 1 1
16 5087 2 1 8 SER OG O -11.833 0.164 3.592 1.00 . B B . 8 SER OG 1 1
16 5088 2 1 9 GLY C C -13.772 -0.332 -1.308 1.00 . B B . 9 GLY C 1 1
16 5089 2 1 9 GLY CA C -12.924 0.799 -0.758 1.00 . B B . 9 GLY CA 1 1
16 5090 2 1 9 GLY H H -11.646 -0.623 0.151 1.00 . B B . 9 GLY H 1 1
16 5091 2 1 9 GLY HA2 H -13.562 1.487 -0.223 1.00 . B B . 9 GLY HA2 1 1
16 5092 2 1 9 GLY HA3 H -12.461 1.320 -1.583 1.00 . B B . 9 GLY HA3 1 1
16 5093 2 1 9 GLY N N -11.886 0.327 0.140 1.00 . B B . 9 GLY N 1 1
16 5094 2 1 9 GLY O O -13.301 -1.135 -2.113 1.00 . B B . 9 GLY O 1 1
16 5095 2 1 10 TYR C C -17.220 -0.828 -1.887 1.00 . B B . 10 TYR C 1 1
16 5096 2 1 10 TYR CA C -15.941 -1.437 -1.321 1.00 . B B . 10 TYR CA 1 1
16 5097 2 1 10 TYR CB C -16.280 -2.381 -0.167 1.00 . B B . 10 TYR CB 1 1
16 5098 2 1 10 TYR CD1 C -16.274 -1.047 1.976 1.00 . B B . 10 TYR CD1 1 1
16 5099 2 1 10 TYR CD2 C -18.376 -1.715 1.074 1.00 . B B . 10 TYR CD2 1 1
16 5100 2 1 10 TYR CE1 C -16.919 -0.425 3.029 1.00 . B B . 10 TYR CE1 1 1
16 5101 2 1 10 TYR CE2 C -19.029 -1.096 2.123 1.00 . B B . 10 TYR CE2 1 1
16 5102 2 1 10 TYR CG C -16.990 -1.702 0.982 1.00 . B B . 10 TYR CG 1 1
16 5103 2 1 10 TYR CZ C -18.296 -0.453 3.097 1.00 . B B . 10 TYR CZ 1 1
16 5104 2 1 10 TYR H H -15.341 0.273 -0.226 1.00 . B B . 10 TYR H 1 1
16 5105 2 1 10 TYR HA H -15.448 -1.998 -2.100 1.00 . B B . 10 TYR HA 1 1
16 5106 2 1 10 TYR HB2 H -16.920 -3.169 -0.531 1.00 . B B . 10 TYR HB2 1 1
16 5107 2 1 10 TYR HB3 H -15.366 -2.812 0.216 1.00 . B B . 10 TYR HB3 1 1
16 5108 2 1 10 TYR HD1 H -15.196 -1.026 1.920 1.00 . B B . 10 TYR HD1 1 1
16 5109 2 1 10 TYR HD2 H -18.947 -2.221 0.309 1.00 . B B . 10 TYR HD2 1 1
16 5110 2 1 10 TYR HE1 H -16.345 0.079 3.792 1.00 . B B . 10 TYR HE1 1 1
16 5111 2 1 10 TYR HE2 H -20.107 -1.118 2.176 1.00 . B B . 10 TYR HE2 1 1
16 5112 2 1 10 TYR HH H -19.625 -0.415 4.486 1.00 . B B . 10 TYR HH 1 1
16 5113 2 1 10 TYR N N -15.025 -0.395 -0.869 1.00 . B B . 10 TYR N 1 1
16 5114 2 1 10 TYR O O -17.506 -1.059 -3.081 1.00 . B B . 10 TYR O 1 1
16 5115 2 1 10 TYR OH O -18.941 0.166 4.144 1.00 . B B . 10 TYR OH 1 1
16 5116 2 1 11 NH2 HN1 H -17.690 0.072 -0.124 1.00 . B B . 11 NH2 HN1 1 1
16 5117 2 1 11 NH2 HN2 H -18.825 0.336 -1.429 1.00 . B B . 11 NH2 HN2 1 1
16 5118 2 1 11 NH2 N N -17.972 -0.080 -1.082 1.00 . B B . 11 NH2 N 1 1
16 5119 3 2 1 ZN ZN ZN 1.635 -3.343 -1.018 1.00 . C A . 101 ZN ZN 1 1
16 5120 4 2 1 ZN ZN ZN -1.461 2.910 -2.102 1.00 . D A . 102 ZN ZN 1 1
17 5121 1 1 1 ASP C C 0.530 5.276 -1.853 1.00 . A A . 1 ASP C 1 1
17 5122 1 1 1 ASP CA C 0.537 6.417 -0.843 1.00 . A A . 1 ASP CA 1 1
17 5123 1 1 1 ASP CB C 0.658 5.858 0.576 1.00 . A A . 1 ASP CB 1 1
17 5124 1 1 1 ASP CG C 0.925 6.941 1.603 1.00 . A A . 1 ASP CG 1 1
17 5125 1 1 1 ASP H1 H -0.797 7.563 -1.910 1.00 . A A . 1 ASP H1 1 1
17 5126 1 1 1 ASP H2 H -0.626 8.011 -0.261 1.00 . A A . 1 ASP H2 1 1
17 5127 1 1 1 ASP H3 H -1.506 6.598 -0.683 1.00 . A A . 1 ASP H3 1 1
17 5128 1 1 1 ASP HA H 1.379 7.062 -1.046 1.00 . A A . 1 ASP HA 1 1
17 5129 1 1 1 ASP HB2 H -0.261 5.357 0.839 1.00 . A A . 1 ASP HB2 1 1
17 5130 1 1 1 ASP HB3 H 1.474 5.148 0.608 1.00 . A A . 1 ASP HB3 1 1
17 5131 1 1 1 ASP N N -0.711 7.219 -0.932 1.00 . A A . 1 ASP N 1 1
17 5132 1 1 1 ASP O O -0.529 4.825 -2.291 1.00 . A A . 1 ASP O 1 1
17 5133 1 1 1 ASP OD1 O 0.673 6.697 2.802 1.00 . A A . 1 ASP OD1 1 1
17 5134 1 1 1 ASP OD2 O 1.385 8.033 1.209 1.00 . A A . 1 ASP OD2 1 1
17 5135 1 1 2 ALA C C 2.574 2.530 -2.539 1.00 . A A . 2 ALA C 1 1
17 5136 1 1 2 ALA CA C 1.857 3.717 -3.173 1.00 . A A . 2 ALA CA 1 1
17 5137 1 1 2 ALA CB C 2.600 4.189 -4.412 1.00 . A A . 2 ALA CB 1 1
17 5138 1 1 2 ALA H H 2.528 5.209 -1.833 1.00 . A A . 2 ALA H 1 1
17 5139 1 1 2 ALA HA H 0.865 3.407 -3.471 1.00 . A A . 2 ALA HA 1 1
17 5140 1 1 2 ALA HB1 H 3.525 3.640 -4.509 1.00 . A A . 2 ALA HB1 1 1
17 5141 1 1 2 ALA HB2 H 2.816 5.243 -4.322 1.00 . A A . 2 ALA HB2 1 1
17 5142 1 1 2 ALA HB3 H 1.988 4.021 -5.285 1.00 . A A . 2 ALA HB3 1 1
17 5143 1 1 2 ALA N N 1.721 4.809 -2.219 1.00 . A A . 2 ALA N 1 1
17 5144 1 1 2 ALA O O 3.014 2.597 -1.392 1.00 . A A . 2 ALA O 1 1
17 5145 1 1 3 GLU C C 4.713 0.555 -2.206 1.00 . A A . 3 GLU C 1 1
17 5146 1 1 3 GLU CA C 3.350 0.235 -2.817 1.00 . A A . 3 GLU CA 1 1
17 5147 1 1 3 GLU CB C 3.518 -0.762 -3.965 1.00 . A A . 3 GLU CB 1 1
17 5148 1 1 3 GLU CD C 2.588 -2.899 -3.000 1.00 . A A . 3 GLU CD 1 1
17 5149 1 1 3 GLU CG C 3.820 -2.179 -3.505 1.00 . A A . 3 GLU CG 1 1
17 5150 1 1 3 GLU H H 2.318 1.457 -4.204 1.00 . A A . 3 GLU H 1 1
17 5151 1 1 3 GLU HA H 2.725 -0.206 -2.059 1.00 . A A . 3 GLU HA 1 1
17 5152 1 1 3 GLU HB2 H 2.607 -0.782 -4.545 1.00 . A A . 3 GLU HB2 1 1
17 5153 1 1 3 GLU HB3 H 4.329 -0.433 -4.599 1.00 . A A . 3 GLU HB3 1 1
17 5154 1 1 3 GLU HG2 H 4.226 -2.736 -4.337 1.00 . A A . 3 GLU HG2 1 1
17 5155 1 1 3 GLU HG3 H 4.548 -2.139 -2.709 1.00 . A A . 3 GLU HG3 1 1
17 5156 1 1 3 GLU N N 2.689 1.446 -3.297 1.00 . A A . 3 GLU N 1 1
17 5157 1 1 3 GLU O O 5.112 -0.042 -1.207 1.00 . A A . 3 GLU O 1 1
17 5158 1 1 3 GLU OE1 O 1.678 -2.221 -2.480 1.00 . A A . 3 GLU OE1 1 1
17 5159 1 1 3 GLU OE2 O 2.527 -4.139 -3.130 1.00 . A A . 3 GLU OE2 1 1
17 5160 1 1 4 PHE C C 6.627 2.644 -1.001 1.00 . A A . 4 PHE C 1 1
17 5161 1 1 4 PHE CA C 6.736 1.895 -2.325 1.00 . A A . 4 PHE CA 1 1
17 5162 1 1 4 PHE CB C 7.449 2.769 -3.360 1.00 . A A . 4 PHE CB 1 1
17 5163 1 1 4 PHE CD1 C 7.055 5.171 -2.750 1.00 . A A . 4 PHE CD1 1 1
17 5164 1 1 4 PHE CD2 C 5.900 4.277 -4.635 1.00 . A A . 4 PHE CD2 1 1
17 5165 1 1 4 PHE CE1 C 6.450 6.396 -2.957 1.00 . A A . 4 PHE CE1 1 1
17 5166 1 1 4 PHE CE2 C 5.291 5.500 -4.846 1.00 . A A . 4 PHE CE2 1 1
17 5167 1 1 4 PHE CG C 6.786 4.098 -3.586 1.00 . A A . 4 PHE CG 1 1
17 5168 1 1 4 PHE CZ C 5.566 6.560 -4.006 1.00 . A A . 4 PHE CZ 1 1
17 5169 1 1 4 PHE H H 5.050 1.942 -3.602 1.00 . A A . 4 PHE H 1 1
17 5170 1 1 4 PHE HA H 7.314 0.997 -2.168 1.00 . A A . 4 PHE HA 1 1
17 5171 1 1 4 PHE HB2 H 8.460 2.954 -3.028 1.00 . A A . 4 PHE HB2 1 1
17 5172 1 1 4 PHE HB3 H 7.476 2.245 -4.304 1.00 . A A . 4 PHE HB3 1 1
17 5173 1 1 4 PHE HD1 H 7.744 5.043 -1.929 1.00 . A A . 4 PHE HD1 1 1
17 5174 1 1 4 PHE HD2 H 5.684 3.448 -5.292 1.00 . A A . 4 PHE HD2 1 1
17 5175 1 1 4 PHE HE1 H 6.667 7.225 -2.298 1.00 . A A . 4 PHE HE1 1 1
17 5176 1 1 4 PHE HE2 H 4.601 5.625 -5.667 1.00 . A A . 4 PHE HE2 1 1
17 5177 1 1 4 PHE HZ H 5.092 7.517 -4.170 1.00 . A A . 4 PHE HZ 1 1
17 5178 1 1 4 PHE N N 5.422 1.499 -2.812 1.00 . A A . 4 PHE N 1 1
17 5179 1 1 4 PHE O O 7.508 2.546 -0.146 1.00 . A A . 4 PHE O 1 1
17 5180 1 1 5 ARG C C 4.853 3.266 1.512 1.00 . A A . 5 ARG C 1 1
17 5181 1 1 5 ARG CA C 5.322 4.166 0.376 1.00 . A A . 5 ARG CA 1 1
17 5182 1 1 5 ARG CB C 4.296 5.271 0.125 1.00 . A A . 5 ARG CB 1 1
17 5183 1 1 5 ARG CD C 5.348 6.874 1.746 1.00 . A A . 5 ARG CD 1 1
17 5184 1 1 5 ARG CG C 4.067 6.173 1.323 1.00 . A A . 5 ARG CG 1 1
17 5185 1 1 5 ARG CZ C 4.623 8.970 2.820 1.00 . A A . 5 ARG CZ 1 1
17 5186 1 1 5 ARG H H 4.876 3.435 -1.559 1.00 . A A . 5 ARG H 1 1
17 5187 1 1 5 ARG HA H 6.262 4.619 0.656 1.00 . A A . 5 ARG HA 1 1
17 5188 1 1 5 ARG HB2 H 4.634 5.881 -0.700 1.00 . A A . 5 ARG HB2 1 1
17 5189 1 1 5 ARG HB3 H 3.354 4.814 -0.140 1.00 . A A . 5 ARG HB3 1 1
17 5190 1 1 5 ARG HD2 H 6.085 6.125 2.000 1.00 . A A . 5 ARG HD2 1 1
17 5191 1 1 5 ARG HD3 H 5.709 7.466 0.918 1.00 . A A . 5 ARG HD3 1 1
17 5192 1 1 5 ARG HE H 5.403 7.402 3.779 1.00 . A A . 5 ARG HE 1 1
17 5193 1 1 5 ARG HG2 H 3.332 6.918 1.064 1.00 . A A . 5 ARG HG2 1 1
17 5194 1 1 5 ARG HG3 H 3.705 5.576 2.146 1.00 . A A . 5 ARG HG3 1 1
17 5195 1 1 5 ARG HH11 H 4.366 8.925 0.814 1.00 . A A . 5 ARG HH11 1 1
17 5196 1 1 5 ARG HH12 H 3.867 10.387 1.593 1.00 . A A . 5 ARG HH12 1 1
17 5197 1 1 5 ARG HH21 H 4.747 9.328 4.804 1.00 . A A . 5 ARG HH21 1 1
17 5198 1 1 5 ARG HH22 H 4.084 10.617 3.858 1.00 . A A . 5 ARG HH22 1 1
17 5199 1 1 5 ARG N N 5.543 3.396 -0.841 1.00 . A A . 5 ARG N 1 1
17 5200 1 1 5 ARG NE N 5.142 7.746 2.898 1.00 . A A . 5 ARG NE 1 1
17 5201 1 1 5 ARG NH1 N 4.255 9.467 1.645 1.00 . A A . 5 ARG NH1 1 1
17 5202 1 1 5 ARG NH2 N 4.472 9.698 3.918 1.00 . A A . 5 ARG NH2 1 1
17 5203 1 1 5 ARG O O 5.268 3.428 2.660 1.00 . A A . 5 ARG O 1 1
17 5204 1 1 6 HIS C C 4.554 0.457 2.671 1.00 . A A . 6 HIS C 1 1
17 5205 1 1 6 HIS CA C 3.458 1.387 2.175 1.00 . A A . 6 HIS CA 1 1
17 5206 1 1 6 HIS CB C 2.327 0.552 1.579 1.00 . A A . 6 HIS CB 1 1
17 5207 1 1 6 HIS CD2 C 0.844 1.370 -0.367 1.00 . A A . 6 HIS CD2 1 1
17 5208 1 1 6 HIS CE1 C -0.377 2.807 0.688 1.00 . A A . 6 HIS CE1 1 1
17 5209 1 1 6 HIS CG C 1.256 1.360 0.925 1.00 . A A . 6 HIS CG 1 1
17 5210 1 1 6 HIS H H 3.695 2.236 0.249 1.00 . A A . 6 HIS H 1 1
17 5211 1 1 6 HIS HA H 3.079 1.960 3.007 1.00 . A A . 6 HIS HA 1 1
17 5212 1 1 6 HIS HB2 H 2.738 -0.113 0.834 1.00 . A A . 6 HIS HB2 1 1
17 5213 1 1 6 HIS HB3 H 1.870 -0.034 2.364 1.00 . A A . 6 HIS HB3 1 1
17 5214 1 1 6 HIS HD1 H 0.520 2.507 2.534 1.00 . A A . 6 HIS HD1 1 1
17 5215 1 1 6 HIS HD2 H 1.247 0.762 -1.163 1.00 . A A . 6 HIS HD2 1 1
17 5216 1 1 6 HIS HE1 H -1.119 3.554 0.919 1.00 . A A . 6 HIS HE1 1 1
17 5217 1 1 6 HIS N N 3.985 2.316 1.182 1.00 . A A . 6 HIS N 1 1
17 5218 1 1 6 HIS ND1 N 0.470 2.279 1.582 1.00 . A A . 6 HIS ND1 1 1
17 5219 1 1 6 HIS NE2 N -0.189 2.290 -0.509 1.00 . A A . 6 HIS NE2 1 1
17 5220 1 1 6 HIS O O 4.698 0.225 3.872 1.00 . A A . 6 HIS O 1 1
17 5221 1 1 7 HIS C C 7.728 -0.262 2.180 1.00 . A A . 7 HIS C 1 1
17 5222 1 1 7 HIS CA C 6.399 -1.000 2.054 1.00 . A A . 7 HIS CA 1 1
17 5223 1 1 7 HIS CB C 6.510 -2.080 0.978 1.00 . A A . 7 HIS CB 1 1
17 5224 1 1 7 HIS CD2 C 4.149 -2.637 0.066 1.00 . A A . 7 HIS CD2 1 1
17 5225 1 1 7 HIS CE1 C 3.855 -4.563 1.004 1.00 . A A . 7 HIS CE1 1 1
17 5226 1 1 7 HIS CG C 5.262 -2.888 0.804 1.00 . A A . 7 HIS CG 1 1
17 5227 1 1 7 HIS H H 5.142 0.142 0.790 1.00 . A A . 7 HIS H 1 1
17 5228 1 1 7 HIS HA H 6.167 -1.468 2.998 1.00 . A A . 7 HIS HA 1 1
17 5229 1 1 7 HIS HB2 H 6.734 -1.612 0.031 1.00 . A A . 7 HIS HB2 1 1
17 5230 1 1 7 HIS HB3 H 7.312 -2.755 1.238 1.00 . A A . 7 HIS HB3 1 1
17 5231 1 1 7 HIS HD1 H 5.675 -4.578 1.999 1.00 . A A . 7 HIS HD1 1 1
17 5232 1 1 7 HIS HD2 H 3.955 -1.743 -0.507 1.00 . A A . 7 HIS HD2 1 1
17 5233 1 1 7 HIS HE1 H 3.419 -5.498 1.319 1.00 . A A . 7 HIS HE1 1 1
17 5234 1 1 7 HIS N N 5.318 -0.081 1.729 1.00 . A A . 7 HIS N 1 1
17 5235 1 1 7 HIS ND1 N 5.054 -4.115 1.397 1.00 . A A . 7 HIS ND1 1 1
17 5236 1 1 7 HIS NE2 N 3.267 -3.705 0.193 1.00 . A A . 7 HIS NE2 1 1
17 5237 1 1 7 HIS O O 8.027 0.642 1.400 1.00 . A A . 7 HIS O 1 1
17 5238 1 1 8 SER C C 10.944 -0.980 2.937 1.00 . A A . 8 SER C 1 1
17 5239 1 1 8 SER CA C 9.827 -0.048 3.393 1.00 . A A . 8 SER CA 1 1
17 5240 1 1 8 SER CB C 10.003 0.294 4.874 1.00 . A A . 8 SER CB 1 1
17 5241 1 1 8 SER H H 8.230 -1.390 3.750 1.00 . A A . 8 SER H 1 1
17 5242 1 1 8 SER HA H 9.873 0.861 2.812 1.00 . A A . 8 SER HA 1 1
17 5243 1 1 8 SER HB2 H 9.508 -0.452 5.475 1.00 . A A . 8 SER HB2 1 1
17 5244 1 1 8 SER HB3 H 11.056 0.310 5.114 1.00 . A A . 8 SER HB3 1 1
17 5245 1 1 8 SER HG H 8.592 1.648 4.746 1.00 . A A . 8 SER HG 1 1
17 5246 1 1 8 SER N N 8.524 -0.661 3.165 1.00 . A A . 8 SER N 1 1
17 5247 1 1 8 SER O O 11.104 -2.079 3.469 1.00 . A A . 8 SER O 1 1
17 5248 1 1 8 SER OG O 9.447 1.563 5.174 1.00 . A A . 8 SER OG 1 1
17 5249 1 1 9 GLY C C 12.306 -2.451 0.509 1.00 . A A . 9 GLY C 1 1
17 5250 1 1 9 GLY CA C 12.796 -1.354 1.433 1.00 . A A . 9 GLY CA 1 1
17 5251 1 1 9 GLY H H 11.533 0.341 1.554 1.00 . A A . 9 GLY H 1 1
17 5252 1 1 9 GLY HA2 H 13.482 -0.721 0.888 1.00 . A A . 9 GLY HA2 1 1
17 5253 1 1 9 GLY HA3 H 13.319 -1.803 2.264 1.00 . A A . 9 GLY HA3 1 1
17 5254 1 1 9 GLY N N 11.710 -0.540 1.945 1.00 . A A . 9 GLY N 1 1
17 5255 1 1 9 GLY O O 11.210 -2.361 -0.045 1.00 . A A . 9 GLY O 1 1
17 5256 1 1 10 TYR C C 11.611 -5.419 0.089 1.00 . A A . 10 TYR C 1 1
17 5257 1 1 10 TYR CA C 12.752 -4.611 -0.521 1.00 . A A . 10 TYR CA 1 1
17 5258 1 1 10 TYR CB C 13.962 -5.515 -0.760 1.00 . A A . 10 TYR CB 1 1
17 5259 1 1 10 TYR CD1 C 16.107 -4.186 -0.849 1.00 . A A . 10 TYR CD1 1 1
17 5260 1 1 10 TYR CD2 C 15.112 -4.857 -2.910 1.00 . A A . 10 TYR CD2 1 1
17 5261 1 1 10 TYR CE1 C 17.131 -3.569 -1.540 1.00 . A A . 10 TYR CE1 1 1
17 5262 1 1 10 TYR CE2 C 16.133 -4.240 -3.607 1.00 . A A . 10 TYR CE2 1 1
17 5263 1 1 10 TYR CG C 15.081 -4.840 -1.520 1.00 . A A . 10 TYR CG 1 1
17 5264 1 1 10 TYR CZ C 17.140 -3.598 -2.919 1.00 . A A . 10 TYR CZ 1 1
17 5265 1 1 10 TYR H H 13.976 -3.509 0.810 1.00 . A A . 10 TYR H 1 1
17 5266 1 1 10 TYR HA H 12.424 -4.205 -1.467 1.00 . A A . 10 TYR HA 1 1
17 5267 1 1 10 TYR HB2 H 14.356 -5.838 0.193 1.00 . A A . 10 TYR HB2 1 1
17 5268 1 1 10 TYR HB3 H 13.649 -6.380 -1.325 1.00 . A A . 10 TYR HB3 1 1
17 5269 1 1 10 TYR HD1 H 16.098 -4.165 0.231 1.00 . A A . 10 TYR HD1 1 1
17 5270 1 1 10 TYR HD2 H 14.322 -5.360 -3.445 1.00 . A A . 10 TYR HD2 1 1
17 5271 1 1 10 TYR HE1 H 17.921 -3.065 -1.000 1.00 . A A . 10 TYR HE1 1 1
17 5272 1 1 10 TYR HE2 H 16.139 -4.265 -4.687 1.00 . A A . 10 TYR HE2 1 1
17 5273 1 1 10 TYR HH H 18.940 -3.540 -3.590 1.00 . A A . 10 TYR HH 1 1
17 5274 1 1 10 TYR N N 13.115 -3.493 0.342 1.00 . A A . 10 TYR N 1 1
17 5275 1 1 10 TYR O O 10.710 -5.835 -0.670 1.00 . A A . 10 TYR O 1 1
17 5276 1 1 10 TYR OH O 18.158 -2.983 -3.611 1.00 . A A . 10 TYR OH 1 1
17 5277 1 1 11 NH2 HN1 H 12.386 -5.285 1.966 1.00 . A A . 11 NH2 HN1 1 1
17 5278 1 1 11 NH2 HN2 H 10.888 -6.179 1.832 1.00 . A A . 11 NH2 HN2 1 1
17 5279 1 1 11 NH2 N N 11.630 -5.646 1.401 1.00 . A A . 11 NH2 N 1 1
17 5280 2 1 1 ASP C C -0.398 -5.714 -0.667 1.00 . B B . 1 ASP C 1 1
17 5281 2 1 1 ASP CA C -0.533 -6.629 0.544 1.00 . B B . 1 ASP CA 1 1
17 5282 2 1 1 ASP CB C -1.461 -5.992 1.585 1.00 . B B . 1 ASP CB 1 1
17 5283 2 1 1 ASP CG C -1.170 -6.461 2.999 1.00 . B B . 1 ASP CG 1 1
17 5284 2 1 1 ASP H1 H 1.460 -7.125 0.407 1.00 . B B . 1 ASP H1 1 1
17 5285 2 1 1 ASP H2 H 0.681 -7.680 1.831 1.00 . B B . 1 ASP H2 1 1
17 5286 2 1 1 ASP H3 H 1.085 -6.021 1.663 1.00 . B B . 1 ASP H3 1 1
17 5287 2 1 1 ASP HA H -0.951 -7.572 0.224 1.00 . B B . 1 ASP HA 1 1
17 5288 2 1 1 ASP HB2 H -1.349 -4.919 1.551 1.00 . B B . 1 ASP HB2 1 1
17 5289 2 1 1 ASP HB3 H -2.481 -6.250 1.346 1.00 . B B . 1 ASP HB3 1 1
17 5290 2 1 1 ASP N N 0.793 -6.886 1.167 1.00 . B B . 1 ASP N 1 1
17 5291 2 1 1 ASP O O 0.696 -5.258 -0.994 1.00 . B B . 1 ASP O 1 1
17 5292 2 1 1 ASP OD1 O -1.166 -7.688 3.229 1.00 . B B . 1 ASP OD1 1 1
17 5293 2 1 1 ASP OD2 O -0.945 -5.599 3.875 1.00 . B B . 1 ASP OD2 1 1
17 5294 2 1 2 ALA C C -2.268 -3.287 -2.248 1.00 . B B . 2 ALA C 1 1
17 5295 2 1 2 ALA CA C -1.522 -4.591 -2.511 1.00 . B B . 2 ALA CA 1 1
17 5296 2 1 2 ALA CB C -2.141 -5.323 -3.691 1.00 . B B . 2 ALA CB 1 1
17 5297 2 1 2 ALA H H -2.361 -5.844 -1.024 1.00 . B B . 2 ALA H 1 1
17 5298 2 1 2 ALA HA H -0.496 -4.360 -2.759 1.00 . B B . 2 ALA HA 1 1
17 5299 2 1 2 ALA HB1 H -1.429 -5.362 -4.503 1.00 . B B . 2 ALA HB1 1 1
17 5300 2 1 2 ALA HB2 H -3.026 -4.798 -4.015 1.00 . B B . 2 ALA HB2 1 1
17 5301 2 1 2 ALA HB3 H -2.404 -6.327 -3.394 1.00 . B B . 2 ALA HB3 1 1
17 5302 2 1 2 ALA N N -1.518 -5.450 -1.331 1.00 . B B . 2 ALA N 1 1
17 5303 2 1 2 ALA O O -2.821 -3.080 -1.168 1.00 . B B . 2 ALA O 1 1
17 5304 2 1 3 GLU C C -4.391 -1.269 -2.694 1.00 . B B . 3 GLU C 1 1
17 5305 2 1 3 GLU CA C -2.942 -1.118 -3.145 1.00 . B B . 3 GLU CA 1 1
17 5306 2 1 3 GLU CB C -2.891 -0.391 -4.490 1.00 . B B . 3 GLU CB 1 1
17 5307 2 1 3 GLU CD C -2.100 1.969 -4.063 1.00 . B B . 3 GLU CD 1 1
17 5308 2 1 3 GLU CG C -3.275 1.077 -4.407 1.00 . B B . 3 GLU CG 1 1
17 5309 2 1 3 GLU H H -1.813 -2.643 -4.082 1.00 . B B . 3 GLU H 1 1
17 5310 2 1 3 GLU HA H -2.410 -0.530 -2.412 1.00 . B B . 3 GLU HA 1 1
17 5311 2 1 3 GLU HB2 H -1.887 -0.456 -4.883 1.00 . B B . 3 GLU HB2 1 1
17 5312 2 1 3 GLU HB3 H -3.568 -0.879 -5.176 1.00 . B B . 3 GLU HB3 1 1
17 5313 2 1 3 GLU HG2 H -3.674 1.387 -5.360 1.00 . B B . 3 GLU HG2 1 1
17 5314 2 1 3 GLU HG3 H -4.031 1.195 -3.645 1.00 . B B . 3 GLU HG3 1 1
17 5315 2 1 3 GLU N N -2.275 -2.413 -3.249 1.00 . B B . 3 GLU N 1 1
17 5316 2 1 3 GLU O O -4.912 -0.428 -1.962 1.00 . B B . 3 GLU O 1 1
17 5317 2 1 3 GLU OE1 O -1.220 1.521 -3.300 1.00 . B B . 3 GLU OE1 1 1
17 5318 2 1 3 GLU OE2 O -2.058 3.114 -4.559 1.00 . B B . 3 GLU OE2 1 1
17 5319 2 1 4 PHE C C -6.538 -2.936 -1.283 1.00 . B B . 4 PHE C 1 1
17 5320 2 1 4 PHE CA C -6.431 -2.579 -2.759 1.00 . B B . 4 PHE CA 1 1
17 5321 2 1 4 PHE CB C -7.049 -3.686 -3.619 1.00 . B B . 4 PHE CB 1 1
17 5322 2 1 4 PHE CD1 C -6.897 -5.904 -2.454 1.00 . B B . 4 PHE CD1 1 1
17 5323 2 1 4 PHE CD2 C -5.358 -5.441 -4.216 1.00 . B B . 4 PHE CD2 1 1
17 5324 2 1 4 PHE CE1 C -6.326 -7.150 -2.278 1.00 . B B . 4 PHE CE1 1 1
17 5325 2 1 4 PHE CE2 C -4.782 -6.684 -4.042 1.00 . B B . 4 PHE CE2 1 1
17 5326 2 1 4 PHE CG C -6.420 -5.037 -3.423 1.00 . B B . 4 PHE CG 1 1
17 5327 2 1 4 PHE CZ C -5.267 -7.541 -3.073 1.00 . B B . 4 PHE CZ 1 1
17 5328 2 1 4 PHE H H -4.582 -2.981 -3.710 1.00 . B B . 4 PHE H 1 1
17 5329 2 1 4 PHE HA H -6.975 -1.662 -2.928 1.00 . B B . 4 PHE HA 1 1
17 5330 2 1 4 PHE HB2 H -8.098 -3.774 -3.380 1.00 . B B . 4 PHE HB2 1 1
17 5331 2 1 4 PHE HB3 H -6.945 -3.419 -4.662 1.00 . B B . 4 PHE HB3 1 1
17 5332 2 1 4 PHE HD1 H -7.724 -5.599 -1.831 1.00 . B B . 4 PHE HD1 1 1
17 5333 2 1 4 PHE HD2 H -4.978 -4.773 -4.973 1.00 . B B . 4 PHE HD2 1 1
17 5334 2 1 4 PHE HE1 H -6.707 -7.817 -1.519 1.00 . B B . 4 PHE HE1 1 1
17 5335 2 1 4 PHE HE2 H -3.953 -6.988 -4.666 1.00 . B B . 4 PHE HE2 1 1
17 5336 2 1 4 PHE HZ H -4.819 -8.514 -2.938 1.00 . B B . 4 PHE HZ 1 1
17 5337 2 1 4 PHE N N -5.042 -2.341 -3.131 1.00 . B B . 4 PHE N 1 1
17 5338 2 1 4 PHE O O -7.509 -2.579 -0.616 1.00 . B B . 4 PHE O 1 1
17 5339 2 1 5 ARG C C -5.195 -2.813 1.511 1.00 . B B . 5 ARG C 1 1
17 5340 2 1 5 ARG CA C -5.510 -4.016 0.634 1.00 . B B . 5 ARG CA 1 1
17 5341 2 1 5 ARG CB C -4.479 -5.114 0.878 1.00 . B B . 5 ARG CB 1 1
17 5342 2 1 5 ARG CD C -4.553 -7.603 1.217 1.00 . B B . 5 ARG CD 1 1
17 5343 2 1 5 ARG CG C -4.864 -6.451 0.274 1.00 . B B . 5 ARG CG 1 1
17 5344 2 1 5 ARG CZ C -6.777 -8.659 1.334 1.00 . B B . 5 ARG CZ 1 1
17 5345 2 1 5 ARG H H -4.771 -3.876 -1.348 1.00 . B B . 5 ARG H 1 1
17 5346 2 1 5 ARG HA H -6.490 -4.388 0.889 1.00 . B B . 5 ARG HA 1 1
17 5347 2 1 5 ARG HB2 H -3.535 -4.809 0.449 1.00 . B B . 5 ARG HB2 1 1
17 5348 2 1 5 ARG HB3 H -4.354 -5.245 1.943 1.00 . B B . 5 ARG HB3 1 1
17 5349 2 1 5 ARG HD2 H -3.548 -7.947 1.024 1.00 . B B . 5 ARG HD2 1 1
17 5350 2 1 5 ARG HD3 H -4.621 -7.246 2.234 1.00 . B B . 5 ARG HD3 1 1
17 5351 2 1 5 ARG HE H -5.114 -9.559 0.693 1.00 . B B . 5 ARG HE 1 1
17 5352 2 1 5 ARG HG2 H -5.921 -6.446 0.065 1.00 . B B . 5 ARG HG2 1 1
17 5353 2 1 5 ARG HG3 H -4.314 -6.589 -0.645 1.00 . B B . 5 ARG HG3 1 1
17 5354 2 1 5 ARG HH11 H -6.732 -6.731 1.944 1.00 . B B . 5 ARG HH11 1 1
17 5355 2 1 5 ARG HH12 H -8.282 -7.497 2.020 1.00 . B B . 5 ARG HH12 1 1
17 5356 2 1 5 ARG HH21 H -7.154 -10.569 0.793 1.00 . B B . 5 ARG HH21 1 1
17 5357 2 1 5 ARG HH22 H -8.522 -9.677 1.369 1.00 . B B . 5 ARG HH22 1 1
17 5358 2 1 5 ARG N N -5.526 -3.630 -0.772 1.00 . B B . 5 ARG N 1 1
17 5359 2 1 5 ARG NE N -5.479 -8.719 1.044 1.00 . B B . 5 ARG NE 1 1
17 5360 2 1 5 ARG NH1 N -7.307 -7.537 1.805 1.00 . B B . 5 ARG NH1 1 1
17 5361 2 1 5 ARG NH2 N -7.547 -9.722 1.150 1.00 . B B . 5 ARG NH2 1 1
17 5362 2 1 5 ARG O O -5.822 -2.603 2.549 1.00 . B B . 5 ARG O 1 1
17 5363 2 1 6 HIS C C -4.960 0.184 1.827 1.00 . B B . 6 HIS C 1 1
17 5364 2 1 6 HIS CA C -3.825 -0.829 1.816 1.00 . B B . 6 HIS CA 1 1
17 5365 2 1 6 HIS CB C -2.589 -0.187 1.184 1.00 . B B . 6 HIS CB 1 1
17 5366 2 1 6 HIS CD2 C -0.862 -1.584 -0.126 1.00 . B B . 6 HIS CD2 1 1
17 5367 2 1 6 HIS CE1 C 0.248 -2.439 1.520 1.00 . B B . 6 HIS CE1 1 1
17 5368 2 1 6 HIS CG C -1.433 -1.120 1.010 1.00 . B B . 6 HIS CG 1 1
17 5369 2 1 6 HIS H H -3.768 -2.244 0.235 1.00 . B B . 6 HIS H 1 1
17 5370 2 1 6 HIS HA H -3.597 -1.119 2.830 1.00 . B B . 6 HIS HA 1 1
17 5371 2 1 6 HIS HB2 H -2.853 0.190 0.208 1.00 . B B . 6 HIS HB2 1 1
17 5372 2 1 6 HIS HB3 H -2.264 0.635 1.805 1.00 . B B . 6 HIS HB3 1 1
17 5373 2 1 6 HIS HD1 H -0.883 -1.532 3.006 1.00 . B B . 6 HIS HD1 1 1
17 5374 2 1 6 HIS HD2 H -1.172 -1.346 -1.132 1.00 . B B . 6 HIS HD2 1 1
17 5375 2 1 6 HIS HE1 H 0.977 -2.994 2.094 1.00 . B B . 6 HIS HE1 1 1
17 5376 2 1 6 HIS N N -4.223 -2.022 1.077 1.00 . B B . 6 HIS N 1 1
17 5377 2 1 6 HIS ND1 N -0.717 -1.672 2.050 1.00 . B B . 6 HIS ND1 1 1
17 5378 2 1 6 HIS NE2 N 0.199 -2.419 0.204 1.00 . B B . 6 HIS NE2 1 1
17 5379 2 1 6 HIS O O -5.217 0.841 2.835 1.00 . B B . 6 HIS O 1 1
17 5380 2 1 7 HIS C C -8.077 0.503 0.632 1.00 . B B . 7 HIS C 1 1
17 5381 2 1 7 HIS CA C -6.741 1.234 0.545 1.00 . B B . 7 HIS CA 1 1
17 5382 2 1 7 HIS CB C -6.634 1.970 -0.793 1.00 . B B . 7 HIS CB 1 1
17 5383 2 1 7 HIS CD2 C -4.085 2.308 -1.134 1.00 . B B . 7 HIS CD2 1 1
17 5384 2 1 7 HIS CE1 C -4.014 4.471 -1.126 1.00 . B B . 7 HIS CE1 1 1
17 5385 2 1 7 HIS CG C -5.361 2.744 -0.954 1.00 . B B . 7 HIS CG 1 1
17 5386 2 1 7 HIS H H -5.370 -0.252 -0.077 1.00 . B B . 7 HIS H 1 1
17 5387 2 1 7 HIS HA H -6.681 1.951 1.348 1.00 . B B . 7 HIS HA 1 1
17 5388 2 1 7 HIS HB2 H -6.690 1.251 -1.596 1.00 . B B . 7 HIS HB2 1 1
17 5389 2 1 7 HIS HB3 H -7.459 2.663 -0.879 1.00 . B B . 7 HIS HB3 1 1
17 5390 2 1 7 HIS HD1 H -6.051 4.733 -0.840 1.00 . B B . 7 HIS HD1 1 1
17 5391 2 1 7 HIS HD2 H -3.763 1.277 -1.182 1.00 . B B . 7 HIS HD2 1 1
17 5392 2 1 7 HIS HE1 H -3.661 5.491 -1.165 1.00 . B B . 7 HIS HE1 1 1
17 5393 2 1 7 HIS N N -5.631 0.303 0.689 1.00 . B B . 7 HIS N 1 1
17 5394 2 1 7 HIS ND1 N -5.295 4.119 -0.950 1.00 . B B . 7 HIS ND1 1 1
17 5395 2 1 7 HIS NE2 N -3.239 3.409 -1.242 1.00 . B B . 7 HIS NE2 1 1
17 5396 2 1 7 HIS O O -8.552 -0.062 -0.355 1.00 . B B . 7 HIS O 1 1
17 5397 2 1 8 SER C C -10.803 0.618 3.048 1.00 . B B . 8 SER C 1 1
17 5398 2 1 8 SER CA C -9.962 -0.144 2.031 1.00 . B B . 8 SER CA 1 1
17 5399 2 1 8 SER CB C -9.744 -1.582 2.503 1.00 . B B . 8 SER CB 1 1
17 5400 2 1 8 SER H H -8.251 0.985 2.564 1.00 . B B . 8 SER H 1 1
17 5401 2 1 8 SER HA H -10.486 -0.160 1.087 1.00 . B B . 8 SER HA 1 1
17 5402 2 1 8 SER HB2 H -9.096 -1.581 3.368 1.00 . B B . 8 SER HB2 1 1
17 5403 2 1 8 SER HB3 H -10.696 -2.020 2.768 1.00 . B B . 8 SER HB3 1 1
17 5404 2 1 8 SER HG H -9.811 -2.941 1.094 1.00 . B B . 8 SER HG 1 1
17 5405 2 1 8 SER N N -8.679 0.517 1.816 1.00 . B B . 8 SER N 1 1
17 5406 2 1 8 SER O O -10.274 1.370 3.868 1.00 . B B . 8 SER O 1 1
17 5407 2 1 8 SER OG O -9.148 -2.369 1.487 1.00 . B B . 8 SER OG 1 1
17 5408 2 1 9 GLY C C -14.189 1.741 3.219 1.00 . B B . 9 GLY C 1 1
17 5409 2 1 9 GLY CA C -13.008 1.093 3.917 1.00 . B B . 9 GLY CA 1 1
17 5410 2 1 9 GLY H H -12.482 -0.193 2.318 1.00 . B B . 9 GLY H 1 1
17 5411 2 1 9 GLY HA2 H -13.378 0.374 4.632 1.00 . B B . 9 GLY HA2 1 1
17 5412 2 1 9 GLY HA3 H -12.453 1.856 4.444 1.00 . B B . 9 GLY HA3 1 1
17 5413 2 1 9 GLY N N -12.117 0.418 2.992 1.00 . B B . 9 GLY N 1 1
17 5414 2 1 9 GLY O O -14.236 2.962 3.068 1.00 . B B . 9 GLY O 1 1
17 5415 2 1 10 TYR C C -17.154 2.315 3.030 1.00 . B B . 10 TYR C 1 1
17 5416 2 1 10 TYR CA C -16.330 1.422 2.108 1.00 . B B . 10 TYR CA 1 1
17 5417 2 1 10 TYR CB C -17.187 0.258 1.607 1.00 . B B . 10 TYR CB 1 1
17 5418 2 1 10 TYR CD1 C -16.940 -1.748 3.120 1.00 . B B . 10 TYR CD1 1 1
17 5419 2 1 10 TYR CD2 C -18.897 -0.405 3.342 1.00 . B B . 10 TYR CD2 1 1
17 5420 2 1 10 TYR CE1 C -17.391 -2.579 4.129 1.00 . B B . 10 TYR CE1 1 1
17 5421 2 1 10 TYR CE2 C -19.355 -1.231 4.351 1.00 . B B . 10 TYR CE2 1 1
17 5422 2 1 10 TYR CG C -17.684 -0.648 2.711 1.00 . B B . 10 TYR CG 1 1
17 5423 2 1 10 TYR CZ C -18.598 -2.317 4.740 1.00 . B B . 10 TYR CZ 1 1
17 5424 2 1 10 TYR H H -15.050 -0.042 2.943 1.00 . B B . 10 TYR H 1 1
17 5425 2 1 10 TYR HA H -16.003 2.006 1.262 1.00 . B B . 10 TYR HA 1 1
17 5426 2 1 10 TYR HB2 H -18.049 0.652 1.088 1.00 . B B . 10 TYR HB2 1 1
17 5427 2 1 10 TYR HB3 H -16.603 -0.340 0.923 1.00 . B B . 10 TYR HB3 1 1
17 5428 2 1 10 TYR HD1 H -15.995 -1.951 2.639 1.00 . B B . 10 TYR HD1 1 1
17 5429 2 1 10 TYR HD2 H -19.487 0.446 3.035 1.00 . B B . 10 TYR HD2 1 1
17 5430 2 1 10 TYR HE1 H -16.798 -3.430 4.433 1.00 . B B . 10 TYR HE1 1 1
17 5431 2 1 10 TYR HE2 H -20.300 -1.025 4.831 1.00 . B B . 10 TYR HE2 1 1
17 5432 2 1 10 TYR HH H -19.431 -3.934 5.361 1.00 . B B . 10 TYR HH 1 1
17 5433 2 1 10 TYR N N -15.144 0.922 2.792 1.00 . B B . 10 TYR N 1 1
17 5434 2 1 10 TYR O O -17.938 3.137 2.512 1.00 . B B . 10 TYR O 1 1
17 5435 2 1 10 TYR OH O -19.050 -3.142 5.745 1.00 . B B . 10 TYR OH 1 1
17 5436 2 1 11 NH2 HN1 H -16.352 1.489 4.707 1.00 . B B . 11 NH2 HN1 1 1
17 5437 2 1 11 NH2 HN2 H -17.534 2.749 4.981 1.00 . B B . 11 NH2 HN2 1 1
17 5438 2 1 11 NH2 N N -17.001 2.173 4.345 1.00 . B B . 11 NH2 N 1 1
17 5439 3 2 1 ZN ZN ZN 1.595 -3.427 -0.932 1.00 . C A . 101 ZN ZN 1 1
17 5440 4 2 1 ZN ZN ZN -1.402 3.001 -2.020 1.00 . D A . 102 ZN ZN 1 1
18 5441 1 1 1 ASP C C 0.483 5.164 -1.973 1.00 . A A . 1 ASP C 1 1
18 5442 1 1 1 ASP CA C 0.406 6.319 -0.981 1.00 . A A . 1 ASP CA 1 1
18 5443 1 1 1 ASP CB C 0.666 5.813 0.440 1.00 . A A . 1 ASP CB 1 1
18 5444 1 1 1 ASP CG C 0.770 6.942 1.445 1.00 . A A . 1 ASP CG 1 1
18 5445 1 1 1 ASP H1 H -0.894 7.810 -0.412 1.00 . A A . 1 ASP H1 1 1
18 5446 1 1 1 ASP H2 H -1.625 6.274 -0.653 1.00 . A A . 1 ASP H2 1 1
18 5447 1 1 1 ASP H3 H -1.139 7.218 -2.002 1.00 . A A . 1 ASP H3 1 1
18 5448 1 1 1 ASP HA H 1.150 7.057 -1.239 1.00 . A A . 1 ASP HA 1 1
18 5449 1 1 1 ASP HB2 H -0.144 5.165 0.737 1.00 . A A . 1 ASP HB2 1 1
18 5450 1 1 1 ASP HB3 H 1.593 5.255 0.454 1.00 . A A . 1 ASP HB3 1 1
18 5451 1 1 1 ASP N N -0.933 6.964 -1.015 1.00 . A A . 1 ASP N 1 1
18 5452 1 1 1 ASP O O -0.540 4.654 -2.427 1.00 . A A . 1 ASP O 1 1
18 5453 1 1 1 ASP OD1 O 0.634 6.673 2.657 1.00 . A A . 1 ASP OD1 1 1
18 5454 1 1 1 ASP OD2 O 0.983 8.098 1.021 1.00 . A A . 1 ASP OD2 1 1
18 5455 1 1 2 ALA C C 2.630 2.495 -2.569 1.00 . A A . 2 ALA C 1 1
18 5456 1 1 2 ALA CA C 1.915 3.659 -3.243 1.00 . A A . 2 ALA CA 1 1
18 5457 1 1 2 ALA CB C 2.703 4.141 -4.451 1.00 . A A . 2 ALA CB 1 1
18 5458 1 1 2 ALA H H 2.481 5.203 -1.911 1.00 . A A . 2 ALA H 1 1
18 5459 1 1 2 ALA HA H 0.946 3.321 -3.586 1.00 . A A . 2 ALA HA 1 1
18 5460 1 1 2 ALA HB1 H 3.695 3.715 -4.427 1.00 . A A . 2 ALA HB1 1 1
18 5461 1 1 2 ALA HB2 H 2.773 5.219 -4.429 1.00 . A A . 2 ALA HB2 1 1
18 5462 1 1 2 ALA HB3 H 2.200 3.832 -5.355 1.00 . A A . 2 ALA HB3 1 1
18 5463 1 1 2 ALA N N 1.703 4.756 -2.307 1.00 . A A . 2 ALA N 1 1
18 5464 1 1 2 ALA O O 2.994 2.572 -1.396 1.00 . A A . 2 ALA O 1 1
18 5465 1 1 3 GLU C C 4.844 0.582 -2.178 1.00 . A A . 3 GLU C 1 1
18 5466 1 1 3 GLU CA C 3.495 0.228 -2.798 1.00 . A A . 3 GLU CA 1 1
18 5467 1 1 3 GLU CB C 3.690 -0.802 -3.914 1.00 . A A . 3 GLU CB 1 1
18 5468 1 1 3 GLU CD C 2.535 -2.811 -2.916 1.00 . A A . 3 GLU CD 1 1
18 5469 1 1 3 GLU CG C 3.842 -2.229 -3.410 1.00 . A A . 3 GLU CG 1 1
18 5470 1 1 3 GLU H H 2.512 1.418 -4.247 1.00 . A A . 3 GLU H 1 1
18 5471 1 1 3 GLU HA H 2.864 -0.198 -2.035 1.00 . A A . 3 GLU HA 1 1
18 5472 1 1 3 GLU HB2 H 2.835 -0.766 -4.573 1.00 . A A . 3 GLU HB2 1 1
18 5473 1 1 3 GLU HB3 H 4.576 -0.545 -4.474 1.00 . A A . 3 GLU HB3 1 1
18 5474 1 1 3 GLU HG2 H 4.210 -2.845 -4.215 1.00 . A A . 3 GLU HG2 1 1
18 5475 1 1 3 GLU HG3 H 4.553 -2.235 -2.597 1.00 . A A . 3 GLU HG3 1 1
18 5476 1 1 3 GLU N N 2.827 1.417 -3.320 1.00 . A A . 3 GLU N 1 1
18 5477 1 1 3 GLU O O 5.253 -0.008 -1.179 1.00 . A A . 3 GLU O 1 1
18 5478 1 1 3 GLU OE1 O 1.678 -2.031 -2.448 1.00 . A A . 3 GLU OE1 1 1
18 5479 1 1 3 GLU OE2 O 2.363 -4.044 -3.003 1.00 . A A . 3 GLU OE2 1 1
18 5480 1 1 4 PHE C C 6.675 2.714 -0.943 1.00 . A A . 4 PHE C 1 1
18 5481 1 1 4 PHE CA C 6.828 1.980 -2.269 1.00 . A A . 4 PHE CA 1 1
18 5482 1 1 4 PHE CB C 7.523 2.884 -3.290 1.00 . A A . 4 PHE CB 1 1
18 5483 1 1 4 PHE CD1 C 6.826 5.203 -2.630 1.00 . A A . 4 PHE CD1 1 1
18 5484 1 1 4 PHE CD2 C 6.067 4.344 -4.721 1.00 . A A . 4 PHE CD2 1 1
18 5485 1 1 4 PHE CE1 C 6.155 6.387 -2.869 1.00 . A A . 4 PHE CE1 1 1
18 5486 1 1 4 PHE CE2 C 5.393 5.525 -4.964 1.00 . A A . 4 PHE CE2 1 1
18 5487 1 1 4 PHE CG C 6.790 4.169 -3.553 1.00 . A A . 4 PHE CG 1 1
18 5488 1 1 4 PHE CZ C 5.436 6.548 -4.037 1.00 . A A . 4 PHE CZ 1 1
18 5489 1 1 4 PHE H H 5.152 1.989 -3.563 1.00 . A A . 4 PHE H 1 1
18 5490 1 1 4 PHE HA H 7.431 1.098 -2.112 1.00 . A A . 4 PHE HA 1 1
18 5491 1 1 4 PHE HB2 H 8.509 3.133 -2.927 1.00 . A A . 4 PHE HB2 1 1
18 5492 1 1 4 PHE HB3 H 7.613 2.355 -4.227 1.00 . A A . 4 PHE HB3 1 1
18 5493 1 1 4 PHE HD1 H 7.386 5.078 -1.715 1.00 . A A . 4 PHE HD1 1 1
18 5494 1 1 4 PHE HD2 H 6.032 3.545 -5.447 1.00 . A A . 4 PHE HD2 1 1
18 5495 1 1 4 PHE HE1 H 6.190 7.185 -2.142 1.00 . A A . 4 PHE HE1 1 1
18 5496 1 1 4 PHE HE2 H 4.833 5.649 -5.879 1.00 . A A . 4 PHE HE2 1 1
18 5497 1 1 4 PHE HZ H 4.910 7.472 -4.225 1.00 . A A . 4 PHE HZ 1 1
18 5498 1 1 4 PHE N N 5.530 1.550 -2.772 1.00 . A A . 4 PHE N 1 1
18 5499 1 1 4 PHE O O 7.541 2.633 -0.071 1.00 . A A . 4 PHE O 1 1
18 5500 1 1 5 ARG C C 4.814 3.255 1.534 1.00 . A A . 5 ARG C 1 1
18 5501 1 1 5 ARG CA C 5.292 4.180 0.421 1.00 . A A . 5 ARG CA 1 1
18 5502 1 1 5 ARG CB C 4.248 5.265 0.149 1.00 . A A . 5 ARG CB 1 1
18 5503 1 1 5 ARG CD C 3.662 7.556 1.002 1.00 . A A . 5 ARG CD 1 1
18 5504 1 1 5 ARG CG C 3.903 6.100 1.372 1.00 . A A . 5 ARG CG 1 1
18 5505 1 1 5 ARG CZ C 4.976 9.578 0.500 1.00 . A A . 5 ARG CZ 1 1
18 5506 1 1 5 ARG H H 4.913 3.452 -1.529 1.00 . A A . 5 ARG H 1 1
18 5507 1 1 5 ARG HA H 6.212 4.651 0.732 1.00 . A A . 5 ARG HA 1 1
18 5508 1 1 5 ARG HB2 H 4.623 5.926 -0.618 1.00 . A A . 5 ARG HB2 1 1
18 5509 1 1 5 ARG HB3 H 3.344 4.794 -0.204 1.00 . A A . 5 ARG HB3 1 1
18 5510 1 1 5 ARG HD2 H 3.089 7.591 0.087 1.00 . A A . 5 ARG HD2 1 1
18 5511 1 1 5 ARG HD3 H 3.102 8.026 1.795 1.00 . A A . 5 ARG HD3 1 1
18 5512 1 1 5 ARG HE H 5.749 7.784 0.905 1.00 . A A . 5 ARG HE 1 1
18 5513 1 1 5 ARG HG2 H 3.010 5.703 1.828 1.00 . A A . 5 ARG HG2 1 1
18 5514 1 1 5 ARG HG3 H 4.723 6.048 2.073 1.00 . A A . 5 ARG HG3 1 1
18 5515 1 1 5 ARG HH11 H 2.973 9.854 0.475 1.00 . A A . 5 ARG HH11 1 1
18 5516 1 1 5 ARG HH12 H 3.920 11.261 0.127 1.00 . A A . 5 ARG HH12 1 1
18 5517 1 1 5 ARG HH21 H 6.995 9.633 0.447 1.00 . A A . 5 ARG HH21 1 1
18 5518 1 1 5 ARG HH22 H 6.203 11.135 0.110 1.00 . A A . 5 ARG HH22 1 1
18 5519 1 1 5 ARG N N 5.566 3.431 -0.799 1.00 . A A . 5 ARG N 1 1
18 5520 1 1 5 ARG NE N 4.912 8.284 0.805 1.00 . A A . 5 ARG NE 1 1
18 5521 1 1 5 ARG NH1 N 3.864 10.289 0.355 1.00 . A A . 5 ARG NH1 1 1
18 5522 1 1 5 ARG NH2 N 6.156 10.163 0.339 1.00 . A A . 5 ARG NH2 1 1
18 5523 1 1 5 ARG O O 5.194 3.412 2.694 1.00 . A A . 5 ARG O 1 1
18 5524 1 1 6 HIS C C 4.550 0.409 2.640 1.00 . A A . 6 HIS C 1 1
18 5525 1 1 6 HIS CA C 3.450 1.331 2.139 1.00 . A A . 6 HIS CA 1 1
18 5526 1 1 6 HIS CB C 2.341 0.489 1.509 1.00 . A A . 6 HIS CB 1 1
18 5527 1 1 6 HIS CD2 C 0.812 1.331 -0.390 1.00 . A A . 6 HIS CD2 1 1
18 5528 1 1 6 HIS CE1 C -0.432 2.701 0.729 1.00 . A A . 6 HIS CE1 1 1
18 5529 1 1 6 HIS CG C 1.242 1.292 0.893 1.00 . A A . 6 HIS CG 1 1
18 5530 1 1 6 HIS H H 3.715 2.211 0.229 1.00 . A A . 6 HIS H 1 1
18 5531 1 1 6 HIS HA H 3.044 1.885 2.972 1.00 . A A . 6 HIS HA 1 1
18 5532 1 1 6 HIS HB2 H 2.769 -0.129 0.733 1.00 . A A . 6 HIS HB2 1 1
18 5533 1 1 6 HIS HB3 H 1.906 -0.146 2.266 1.00 . A A . 6 HIS HB3 1 1
18 5534 1 1 6 HIS HD1 H 0.503 2.367 2.550 1.00 . A A . 6 HIS HD1 1 1
18 5535 1 1 6 HIS HD2 H 1.218 0.761 -1.212 1.00 . A A . 6 HIS HD2 1 1
18 5536 1 1 6 HIS HE1 H -1.189 3.422 0.994 1.00 . A A . 6 HIS HE1 1 1
18 5537 1 1 6 HIS N N 3.978 2.286 1.171 1.00 . A A . 6 HIS N 1 1
18 5538 1 1 6 HIS ND1 N 0.442 2.167 1.592 1.00 . A A . 6 HIS ND1 1 1
18 5539 1 1 6 HIS NE2 N -0.248 2.228 -0.488 1.00 . A A . 6 HIS NE2 1 1
18 5540 1 1 6 HIS O O 4.650 0.130 3.836 1.00 . A A . 6 HIS O 1 1
18 5541 1 1 7 HIS C C 7.780 -0.230 2.138 1.00 . A A . 7 HIS C 1 1
18 5542 1 1 7 HIS CA C 6.454 -0.977 2.040 1.00 . A A . 7 HIS CA 1 1
18 5543 1 1 7 HIS CB C 6.557 -2.078 0.984 1.00 . A A . 7 HIS CB 1 1
18 5544 1 1 7 HIS CD2 C 4.182 -2.563 0.060 1.00 . A A . 7 HIS CD2 1 1
18 5545 1 1 7 HIS CE1 C 3.843 -4.500 0.958 1.00 . A A . 7 HIS CE1 1 1
18 5546 1 1 7 HIS CG C 5.288 -2.854 0.793 1.00 . A A . 7 HIS CG 1 1
18 5547 1 1 7 HIS H H 5.220 0.184 0.775 1.00 . A A . 7 HIS H 1 1
18 5548 1 1 7 HIS HA H 6.236 -1.427 2.996 1.00 . A A . 7 HIS HA 1 1
18 5549 1 1 7 HIS HB2 H 6.818 -1.633 0.036 1.00 . A A . 7 HIS HB2 1 1
18 5550 1 1 7 HIS HB3 H 7.332 -2.773 1.275 1.00 . A A . 7 HIS HB3 1 1
18 5551 1 1 7 HIS HD1 H 5.662 -4.577 1.952 1.00 . A A . 7 HIS HD1 1 1
18 5552 1 1 7 HIS HD2 H 4.006 -1.654 -0.497 1.00 . A A . 7 HIS HD2 1 1
18 5553 1 1 7 HIS HE1 H 3.388 -5.433 1.252 1.00 . A A . 7 HIS HE1 1 1
18 5554 1 1 7 HIS N N 5.363 -0.072 1.709 1.00 . A A . 7 HIS N 1 1
18 5555 1 1 7 HIS ND1 N 5.054 -4.087 1.359 1.00 . A A . 7 HIS ND1 1 1
18 5556 1 1 7 HIS NE2 N 3.276 -3.612 0.165 1.00 . A A . 7 HIS NE2 1 1
18 5557 1 1 7 HIS O O 8.070 0.652 1.329 1.00 . A A . 7 HIS O 1 1
18 5558 1 1 8 SER C C 10.993 -1.014 3.333 1.00 . A A . 8 SER C 1 1
18 5559 1 1 8 SER CA C 9.884 0.035 3.334 1.00 . A A . 8 SER CA 1 1
18 5560 1 1 8 SER CB C 9.900 0.809 4.654 1.00 . A A . 8 SER CB 1 1
18 5561 1 1 8 SER H H 8.298 -1.306 3.739 1.00 . A A . 8 SER H 1 1
18 5562 1 1 8 SER HA H 10.053 0.722 2.520 1.00 . A A . 8 SER HA 1 1
18 5563 1 1 8 SER HB2 H 9.176 0.380 5.330 1.00 . A A . 8 SER HB2 1 1
18 5564 1 1 8 SER HB3 H 10.884 0.747 5.094 1.00 . A A . 8 SER HB3 1 1
18 5565 1 1 8 SER HG H 8.660 2.247 4.172 1.00 . A A . 8 SER HG 1 1
18 5566 1 1 8 SER N N 8.584 -0.595 3.131 1.00 . A A . 8 SER N 1 1
18 5567 1 1 8 SER O O 11.215 -1.699 4.331 1.00 . A A . 8 SER O 1 1
18 5568 1 1 8 SER OG O 9.577 2.173 4.447 1.00 . A A . 8 SER OG 1 1
18 5569 1 1 9 GLY C C 12.244 -3.512 1.871 1.00 . A A . 9 GLY C 1 1
18 5570 1 1 9 GLY CA C 12.759 -2.103 2.092 1.00 . A A . 9 GLY CA 1 1
18 5571 1 1 9 GLY H H 11.461 -0.562 1.440 1.00 . A A . 9 GLY H 1 1
18 5572 1 1 9 GLY HA2 H 13.393 -1.828 1.262 1.00 . A A . 9 GLY HA2 1 1
18 5573 1 1 9 GLY HA3 H 13.343 -2.084 3.001 1.00 . A A . 9 GLY HA3 1 1
18 5574 1 1 9 GLY N N 11.685 -1.134 2.203 1.00 . A A . 9 GLY N 1 1
18 5575 1 1 9 GLY O O 11.044 -3.718 1.677 1.00 . A A . 9 GLY O 1 1
18 5576 1 1 10 TYR C C 11.940 -6.392 2.870 1.00 . A A . 10 TYR C 1 1
18 5577 1 1 10 TYR CA C 12.777 -5.881 1.701 1.00 . A A . 10 TYR CA 1 1
18 5578 1 1 10 TYR CB C 14.027 -6.746 1.537 1.00 . A A . 10 TYR CB 1 1
18 5579 1 1 10 TYR CD1 C 15.750 -5.570 0.117 1.00 . A A . 10 TYR CD1 1 1
18 5580 1 1 10 TYR CD2 C 14.432 -7.277 -0.898 1.00 . A A . 10 TYR CD2 1 1
18 5581 1 1 10 TYR CE1 C 16.413 -5.365 -1.079 1.00 . A A . 10 TYR CE1 1 1
18 5582 1 1 10 TYR CE2 C 15.090 -7.078 -2.097 1.00 . A A . 10 TYR CE2 1 1
18 5583 1 1 10 TYR CG C 14.750 -6.526 0.227 1.00 . A A . 10 TYR CG 1 1
18 5584 1 1 10 TYR CZ C 16.079 -6.122 -2.182 1.00 . A A . 10 TYR CZ 1 1
18 5585 1 1 10 TYR H H 14.089 -4.259 2.060 1.00 . A A . 10 TYR H 1 1
18 5586 1 1 10 TYR HA H 12.187 -5.940 0.799 1.00 . A A . 10 TYR HA 1 1
18 5587 1 1 10 TYR HB2 H 14.716 -6.525 2.337 1.00 . A A . 10 TYR HB2 1 1
18 5588 1 1 10 TYR HB3 H 13.743 -7.788 1.590 1.00 . A A . 10 TYR HB3 1 1
18 5589 1 1 10 TYR HD1 H 16.009 -4.978 0.983 1.00 . A A . 10 TYR HD1 1 1
18 5590 1 1 10 TYR HD2 H 13.655 -8.023 -0.830 1.00 . A A . 10 TYR HD2 1 1
18 5591 1 1 10 TYR HE1 H 17.189 -4.615 -1.144 1.00 . A A . 10 TYR HE1 1 1
18 5592 1 1 10 TYR HE2 H 14.828 -7.670 -2.962 1.00 . A A . 10 TYR HE2 1 1
18 5593 1 1 10 TYR HH H 17.365 -6.634 -3.517 1.00 . A A . 10 TYR HH 1 1
18 5594 1 1 10 TYR N N 13.149 -4.483 1.899 1.00 . A A . 10 TYR N 1 1
18 5595 1 1 10 TYR O O 12.381 -6.227 4.028 1.00 . A A . 10 TYR O 1 1
18 5596 1 1 10 TYR OH O 16.738 -5.921 -3.373 1.00 . A A . 10 TYR OH 1 1
18 5597 1 1 11 NH2 HN1 H 10.475 -7.092 1.645 1.00 . A A . 11 NH2 HN1 1 1
18 5598 1 1 11 NH2 HN2 H 10.205 -7.336 3.355 1.00 . A A . 11 NH2 HN2 1 1
18 5599 1 1 11 NH2 N N 10.780 -6.988 2.602 1.00 . A A . 11 NH2 N 1 1
18 5600 2 1 1 ASP C C -0.368 -5.546 -0.673 1.00 . B B . 1 ASP C 1 1
18 5601 2 1 1 ASP CA C -0.450 -6.391 0.593 1.00 . B B . 1 ASP CA 1 1
18 5602 2 1 1 ASP CB C -1.294 -5.672 1.653 1.00 . B B . 1 ASP CB 1 1
18 5603 2 1 1 ASP CG C -0.894 -6.034 3.072 1.00 . B B . 1 ASP CG 1 1
18 5604 2 1 1 ASP H1 H 0.823 -7.400 1.859 1.00 . B B . 1 ASP H1 1 1
18 5605 2 1 1 ASP H2 H 1.250 -5.763 1.570 1.00 . B B . 1 ASP H2 1 1
18 5606 2 1 1 ASP H3 H 1.518 -6.949 0.359 1.00 . B B . 1 ASP H3 1 1
18 5607 2 1 1 ASP HA H -0.909 -7.338 0.353 1.00 . B B . 1 ASP HA 1 1
18 5608 2 1 1 ASP HB2 H -1.185 -4.605 1.529 1.00 . B B . 1 ASP HB2 1 1
18 5609 2 1 1 ASP HB3 H -2.332 -5.939 1.516 1.00 . B B . 1 ASP HB3 1 1
18 5610 2 1 1 ASP N N 0.908 -6.649 1.145 1.00 . B B . 1 ASP N 1 1
18 5611 2 1 1 ASP O O 0.714 -5.131 -1.081 1.00 . B B . 1 ASP O 1 1
18 5612 2 1 1 ASP OD1 O -0.755 -5.110 3.903 1.00 . B B . 1 ASP OD1 1 1
18 5613 2 1 1 ASP OD2 O -0.719 -7.238 3.352 1.00 . B B . 1 ASP OD2 1 1
18 5614 2 1 2 ALA C C -2.330 -3.192 -2.276 1.00 . B B . 2 ALA C 1 1
18 5615 2 1 2 ALA CA C -1.568 -4.492 -2.507 1.00 . B B . 2 ALA CA 1 1
18 5616 2 1 2 ALA CB C -2.202 -5.289 -3.637 1.00 . B B . 2 ALA CB 1 1
18 5617 2 1 2 ALA H H -2.350 -5.649 -0.919 1.00 . B B . 2 ALA H 1 1
18 5618 2 1 2 ALA HA H -0.552 -4.254 -2.792 1.00 . B B . 2 ALA HA 1 1
18 5619 2 1 2 ALA HB1 H -2.530 -6.245 -3.260 1.00 . B B . 2 ALA HB1 1 1
18 5620 2 1 2 ALA HB2 H -1.476 -5.440 -4.421 1.00 . B B . 2 ALA HB2 1 1
18 5621 2 1 2 ALA HB3 H -3.049 -4.746 -4.030 1.00 . B B . 2 ALA HB3 1 1
18 5622 2 1 2 ALA N N -1.517 -5.291 -1.290 1.00 . B B . 2 ALA N 1 1
18 5623 2 1 2 ALA O O -2.884 -2.967 -1.200 1.00 . B B . 2 ALA O 1 1
18 5624 2 1 3 GLU C C -4.476 -1.222 -2.726 1.00 . B B . 3 GLU C 1 1
18 5625 2 1 3 GLU CA C -3.037 -1.050 -3.207 1.00 . B B . 3 GLU CA 1 1
18 5626 2 1 3 GLU CB C -3.028 -0.354 -4.571 1.00 . B B . 3 GLU CB 1 1
18 5627 2 1 3 GLU CD C -2.075 1.906 -3.972 1.00 . B B . 3 GLU CD 1 1
18 5628 2 1 3 GLU CG C -3.276 1.144 -4.493 1.00 . B B . 3 GLU CG 1 1
18 5629 2 1 3 GLU H H -1.888 -2.574 -4.124 1.00 . B B . 3 GLU H 1 1
18 5630 2 1 3 GLU HA H -2.504 -0.438 -2.498 1.00 . B B . 3 GLU HA 1 1
18 5631 2 1 3 GLU HB2 H -2.065 -0.512 -5.034 1.00 . B B . 3 GLU HB2 1 1
18 5632 2 1 3 GLU HB3 H -3.794 -0.792 -5.191 1.00 . B B . 3 GLU HB3 1 1
18 5633 2 1 3 GLU HG2 H -3.512 1.508 -5.482 1.00 . B B . 3 GLU HG2 1 1
18 5634 2 1 3 GLU HG3 H -4.114 1.325 -3.834 1.00 . B B . 3 GLU HG3 1 1
18 5635 2 1 3 GLU N N -2.350 -2.337 -3.294 1.00 . B B . 3 GLU N 1 1
18 5636 2 1 3 GLU O O -4.984 -0.405 -1.959 1.00 . B B . 3 GLU O 1 1
18 5637 2 1 3 GLU OE1 O -1.268 1.304 -3.235 1.00 . B B . 3 GLU OE1 1 1
18 5638 2 1 3 GLU OE2 O -1.939 3.102 -4.306 1.00 . B B . 3 GLU OE2 1 1
18 5639 2 1 4 PHE C C -6.575 -2.959 -1.316 1.00 . B B . 4 PHE C 1 1
18 5640 2 1 4 PHE CA C -6.503 -2.553 -2.784 1.00 . B B . 4 PHE CA 1 1
18 5641 2 1 4 PHE CB C -7.113 -3.643 -3.669 1.00 . B B . 4 PHE CB 1 1
18 5642 2 1 4 PHE CD1 C -7.029 -5.889 -2.547 1.00 . B B . 4 PHE CD1 1 1
18 5643 2 1 4 PHE CD2 C -5.402 -5.396 -4.218 1.00 . B B . 4 PHE CD2 1 1
18 5644 2 1 4 PHE CE1 C -6.473 -7.141 -2.370 1.00 . B B . 4 PHE CE1 1 1
18 5645 2 1 4 PHE CE2 C -4.840 -6.646 -4.045 1.00 . B B . 4 PHE CE2 1 1
18 5646 2 1 4 PHE CG C -6.501 -5.004 -3.472 1.00 . B B . 4 PHE CG 1 1
18 5647 2 1 4 PHE CZ C -5.377 -7.520 -3.121 1.00 . B B . 4 PHE CZ 1 1
18 5648 2 1 4 PHE H H -4.671 -2.905 -3.782 1.00 . B B . 4 PHE H 1 1
18 5649 2 1 4 PHE HA H -7.065 -1.641 -2.916 1.00 . B B . 4 PHE HA 1 1
18 5650 2 1 4 PHE HB2 H -8.168 -3.722 -3.454 1.00 . B B . 4 PHE HB2 1 1
18 5651 2 1 4 PHE HB3 H -6.983 -3.368 -4.705 1.00 . B B . 4 PHE HB3 1 1
18 5652 2 1 4 PHE HD1 H -7.885 -5.593 -1.960 1.00 . B B . 4 PHE HD1 1 1
18 5653 2 1 4 PHE HD2 H -4.981 -4.713 -4.941 1.00 . B B . 4 PHE HD2 1 1
18 5654 2 1 4 PHE HE1 H -6.894 -7.823 -1.646 1.00 . B B . 4 PHE HE1 1 1
18 5655 2 1 4 PHE HE2 H -3.983 -6.940 -4.634 1.00 . B B . 4 PHE HE2 1 1
18 5656 2 1 4 PHE HZ H -4.941 -8.499 -2.985 1.00 . B B . 4 PHE HZ 1 1
18 5657 2 1 4 PHE N N -5.126 -2.286 -3.176 1.00 . B B . 4 PHE N 1 1
18 5658 2 1 4 PHE O O -7.567 -2.692 -0.636 1.00 . B B . 4 PHE O 1 1
18 5659 2 1 5 ARG C C -5.152 -2.865 1.477 1.00 . B B . 5 ARG C 1 1
18 5660 2 1 5 ARG CA C -5.463 -4.038 0.556 1.00 . B B . 5 ARG CA 1 1
18 5661 2 1 5 ARG CB C -4.417 -5.138 0.728 1.00 . B B . 5 ARG CB 1 1
18 5662 2 1 5 ARG CD C -3.852 -7.562 0.335 1.00 . B B . 5 ARG CD 1 1
18 5663 2 1 5 ARG CG C -4.719 -6.387 -0.083 1.00 . B B . 5 ARG CG 1 1
18 5664 2 1 5 ARG CZ C -3.901 -9.260 2.123 1.00 . B B . 5 ARG CZ 1 1
18 5665 2 1 5 ARG H H -4.755 -3.783 -1.423 1.00 . B B . 5 ARG H 1 1
18 5666 2 1 5 ARG HA H -6.434 -4.434 0.816 1.00 . B B . 5 ARG HA 1 1
18 5667 2 1 5 ARG HB2 H -3.456 -4.755 0.419 1.00 . B B . 5 ARG HB2 1 1
18 5668 2 1 5 ARG HB3 H -4.369 -5.415 1.771 1.00 . B B . 5 ARG HB3 1 1
18 5669 2 1 5 ARG HD2 H -3.997 -8.367 -0.369 1.00 . B B . 5 ARG HD2 1 1
18 5670 2 1 5 ARG HD3 H -2.819 -7.256 0.319 1.00 . B B . 5 ARG HD3 1 1
18 5671 2 1 5 ARG HE H -4.659 -7.420 2.271 1.00 . B B . 5 ARG HE 1 1
18 5672 2 1 5 ARG HG2 H -5.752 -6.651 0.063 1.00 . B B . 5 ARG HG2 1 1
18 5673 2 1 5 ARG HG3 H -4.543 -6.174 -1.128 1.00 . B B . 5 ARG HG3 1 1
18 5674 2 1 5 ARG HH11 H -2.982 -9.861 0.425 1.00 . B B . 5 ARG HH11 1 1
18 5675 2 1 5 ARG HH12 H -3.042 -11.038 1.692 1.00 . B B . 5 ARG HH12 1 1
18 5676 2 1 5 ARG HH21 H -4.741 -8.968 3.938 1.00 . B B . 5 ARG HH21 1 1
18 5677 2 1 5 ARG HH22 H -4.040 -10.532 3.687 1.00 . B B . 5 ARG HH22 1 1
18 5678 2 1 5 ARG N N -5.518 -3.602 -0.833 1.00 . B B . 5 ARG N 1 1
18 5679 2 1 5 ARG NE N -4.188 -8.039 1.676 1.00 . B B . 5 ARG NE 1 1
18 5680 2 1 5 ARG NH1 N -3.255 -10.123 1.349 1.00 . B B . 5 ARG NH1 1 1
18 5681 2 1 5 ARG NH2 N -4.256 -9.615 3.350 1.00 . B B . 5 ARG NH2 1 1
18 5682 2 1 5 ARG O O -5.735 -2.736 2.555 1.00 . B B . 5 ARG O 1 1
18 5683 2 1 6 HIS C C -4.998 0.172 1.857 1.00 . B B . 6 HIS C 1 1
18 5684 2 1 6 HIS CA C -3.856 -0.836 1.826 1.00 . B B . 6 HIS CA 1 1
18 5685 2 1 6 HIS CB C -2.616 -0.164 1.237 1.00 . B B . 6 HIS CB 1 1
18 5686 2 1 6 HIS CD2 C -0.886 -1.536 -0.092 1.00 . B B . 6 HIS CD2 1 1
18 5687 2 1 6 HIS CE1 C 0.265 -2.361 1.542 1.00 . B B . 6 HIS CE1 1 1
18 5688 2 1 6 HIS CG C -1.450 -1.078 1.050 1.00 . B B . 6 HIS CG 1 1
18 5689 2 1 6 HIS H H -3.812 -2.160 0.169 1.00 . B B . 6 HIS H 1 1
18 5690 2 1 6 HIS HA H -3.643 -1.158 2.833 1.00 . B B . 6 HIS HA 1 1
18 5691 2 1 6 HIS HB2 H -2.869 0.246 0.270 1.00 . B B . 6 HIS HB2 1 1
18 5692 2 1 6 HIS HB3 H -2.310 0.640 1.890 1.00 . B B . 6 HIS HB3 1 1
18 5693 2 1 6 HIS HD1 H -0.863 -1.471 3.039 1.00 . B B . 6 HIS HD1 1 1
18 5694 2 1 6 HIS HD2 H -1.216 -1.309 -1.096 1.00 . B B . 6 HIS HD2 1 1
18 5695 2 1 6 HIS HE1 H 1.012 -2.898 2.107 1.00 . B B . 6 HIS HE1 1 1
18 5696 2 1 6 HIS N N -4.236 -2.007 1.042 1.00 . B B . 6 HIS N 1 1
18 5697 2 1 6 HIS ND1 N -0.708 -1.612 2.082 1.00 . B B . 6 HIS ND1 1 1
18 5698 2 1 6 HIS NE2 N 0.196 -2.348 0.225 1.00 . B B . 6 HIS NE2 1 1
18 5699 2 1 6 HIS O O -5.268 0.797 2.881 1.00 . B B . 6 HIS O 1 1
18 5700 2 1 7 HIS C C -8.105 0.535 0.704 1.00 . B B . 7 HIS C 1 1
18 5701 2 1 7 HIS CA C -6.766 1.258 0.584 1.00 . B B . 7 HIS CA 1 1
18 5702 2 1 7 HIS CB C -6.687 1.980 -0.762 1.00 . B B . 7 HIS CB 1 1
18 5703 2 1 7 HIS CD2 C -4.137 2.264 -1.151 1.00 . B B . 7 HIS CD2 1 1
18 5704 2 1 7 HIS CE1 C -4.033 4.423 -1.232 1.00 . B B . 7 HIS CE1 1 1
18 5705 2 1 7 HIS CG C -5.403 2.726 -0.972 1.00 . B B . 7 HIS CG 1 1
18 5706 2 1 7 HIS H H -5.384 -0.203 -0.066 1.00 . B B . 7 HIS H 1 1
18 5707 2 1 7 HIS HA H -6.688 1.984 1.378 1.00 . B B . 7 HIS HA 1 1
18 5708 2 1 7 HIS HB2 H -6.780 1.256 -1.557 1.00 . B B . 7 HIS HB2 1 1
18 5709 2 1 7 HIS HB3 H -7.499 2.688 -0.831 1.00 . B B . 7 HIS HB3 1 1
18 5710 2 1 7 HIS HD1 H -6.062 4.729 -0.931 1.00 . B B . 7 HIS HD1 1 1
18 5711 2 1 7 HIS HD2 H -3.832 1.227 -1.162 1.00 . B B . 7 HIS HD2 1 1
18 5712 2 1 7 HIS HE1 H -3.665 5.435 -1.318 1.00 . B B . 7 HIS HE1 1 1
18 5713 2 1 7 HIS N N -5.657 0.324 0.714 1.00 . B B . 7 HIS N 1 1
18 5714 2 1 7 HIS ND1 N -5.317 4.100 -1.025 1.00 . B B . 7 HIS ND1 1 1
18 5715 2 1 7 HIS NE2 N -3.277 3.345 -1.316 1.00 . B B . 7 HIS NE2 1 1
18 5716 2 1 7 HIS O O -8.411 -0.358 -0.085 1.00 . B B . 7 HIS O 1 1
18 5717 2 1 8 SER C C -11.323 1.295 1.548 1.00 . B B . 8 SER C 1 1
18 5718 2 1 8 SER CA C -10.206 0.322 1.913 1.00 . B B . 8 SER CA 1 1
18 5719 2 1 8 SER CB C -10.350 -0.115 3.372 1.00 . B B . 8 SER CB 1 1
18 5720 2 1 8 SER H H -8.599 1.650 2.289 1.00 . B B . 8 SER H 1 1
18 5721 2 1 8 SER HA H -10.278 -0.546 1.275 1.00 . B B . 8 SER HA 1 1
18 5722 2 1 8 SER HB2 H -11.328 -0.549 3.520 1.00 . B B . 8 SER HB2 1 1
18 5723 2 1 8 SER HB3 H -9.592 -0.851 3.601 1.00 . B B . 8 SER HB3 1 1
18 5724 2 1 8 SER HG H -10.836 0.908 4.970 1.00 . B B . 8 SER HG 1 1
18 5725 2 1 8 SER N N -8.898 0.931 1.693 1.00 . B B . 8 SER N 1 1
18 5726 2 1 8 SER O O -11.436 2.372 2.134 1.00 . B B . 8 SER O 1 1
18 5727 2 1 8 SER OG O -10.202 0.983 4.252 1.00 . B B . 8 SER OG 1 1
18 5728 2 1 9 GLY C C -13.260 1.976 -1.348 1.00 . B B . 9 GLY C 1 1
18 5729 2 1 9 GLY CA C -13.241 1.759 0.153 1.00 . B B . 9 GLY CA 1 1
18 5730 2 1 9 GLY H H -12.006 0.040 0.147 1.00 . B B . 9 GLY H 1 1
18 5731 2 1 9 GLY HA2 H -14.173 1.302 0.451 1.00 . B B . 9 GLY HA2 1 1
18 5732 2 1 9 GLY HA3 H -13.150 2.718 0.642 1.00 . B B . 9 GLY HA3 1 1
18 5733 2 1 9 GLY N N -12.144 0.909 0.579 1.00 . B B . 9 GLY N 1 1
18 5734 2 1 9 GLY O O -12.703 1.180 -2.104 1.00 . B B . 9 GLY O 1 1
18 5735 2 1 10 TYR C C -12.708 4.039 -3.690 1.00 . B B . 10 TYR C 1 1
18 5736 2 1 10 TYR CA C -13.991 3.376 -3.199 1.00 . B B . 10 TYR CA 1 1
18 5737 2 1 10 TYR CB C -15.186 4.294 -3.463 1.00 . B B . 10 TYR CB 1 1
18 5738 2 1 10 TYR CD1 C -17.070 4.027 -1.804 1.00 . B B . 10 TYR CD1 1 1
18 5739 2 1 10 TYR CD2 C -17.197 2.820 -3.856 1.00 . B B . 10 TYR CD2 1 1
18 5740 2 1 10 TYR CE1 C -18.279 3.488 -1.407 1.00 . B B . 10 TYR CE1 1 1
18 5741 2 1 10 TYR CE2 C -18.407 2.278 -3.466 1.00 . B B . 10 TYR CE2 1 1
18 5742 2 1 10 TYR CG C -16.509 3.703 -3.033 1.00 . B B . 10 TYR CG 1 1
18 5743 2 1 10 TYR CZ C -18.944 2.615 -2.242 1.00 . B B . 10 TYR CZ 1 1
18 5744 2 1 10 TYR H H -14.326 3.653 -1.128 1.00 . B B . 10 TYR H 1 1
18 5745 2 1 10 TYR HA H -14.134 2.450 -3.738 1.00 . B B . 10 TYR HA 1 1
18 5746 2 1 10 TYR HB2 H -15.046 5.218 -2.921 1.00 . B B . 10 TYR HB2 1 1
18 5747 2 1 10 TYR HB3 H -15.243 4.506 -4.519 1.00 . B B . 10 TYR HB3 1 1
18 5748 2 1 10 TYR HD1 H -16.549 4.712 -1.153 1.00 . B B . 10 TYR HD1 1 1
18 5749 2 1 10 TYR HD2 H -16.775 2.557 -4.814 1.00 . B B . 10 TYR HD2 1 1
18 5750 2 1 10 TYR HE1 H -18.699 3.753 -0.449 1.00 . B B . 10 TYR HE1 1 1
18 5751 2 1 10 TYR HE2 H -18.927 1.592 -4.120 1.00 . B B . 10 TYR HE2 1 1
18 5752 2 1 10 TYR HH H -20.019 1.540 -1.064 1.00 . B B . 10 TYR HH 1 1
18 5753 2 1 10 TYR N N -13.901 3.056 -1.779 1.00 . B B . 10 TYR N 1 1
18 5754 2 1 10 TYR O O -11.860 4.384 -2.840 1.00 . B B . 10 TYR O 1 1
18 5755 2 1 10 TYR OH O -20.148 2.076 -1.850 1.00 . B B . 10 TYR OH 1 1
18 5756 2 1 11 NH2 HN1 H -13.274 3.915 -5.640 1.00 . B B . 11 NH2 HN1 1 1
18 5757 2 1 11 NH2 HN2 H -11.713 4.652 -5.354 1.00 . B B . 11 NH2 HN2 1 1
18 5758 2 1 11 NH2 N N -12.552 4.216 -5.000 1.00 . B B . 11 NH2 N 1 1
18 5759 3 2 1 ZN ZN ZN 1.601 -3.299 -0.947 1.00 . C A . 101 ZN ZN 1 1
18 5760 4 2 1 ZN ZN ZN -1.440 2.862 -2.050 1.00 . D A . 102 ZN ZN 1 1
19 5761 1 1 1 ASP C C 0.553 5.266 -1.959 1.00 . A A . 1 ASP C 1 1
19 5762 1 1 1 ASP CA C 0.491 6.390 -0.931 1.00 . A A . 1 ASP CA 1 1
19 5763 1 1 1 ASP CB C 0.567 5.811 0.483 1.00 . A A . 1 ASP CB 1 1
19 5764 1 1 1 ASP CG C 0.767 6.881 1.538 1.00 . A A . 1 ASP CG 1 1
19 5765 1 1 1 ASP H1 H -0.636 8.071 -0.568 1.00 . A A . 1 ASP H1 1 1
19 5766 1 1 1 ASP H2 H -1.531 6.607 -0.618 1.00 . A A . 1 ASP H2 1 1
19 5767 1 1 1 ASP H3 H -0.951 7.312 -2.072 1.00 . A A . 1 ASP H3 1 1
19 5768 1 1 1 ASP HA H 1.325 7.059 -1.087 1.00 . A A . 1 ASP HA 1 1
19 5769 1 1 1 ASP HB2 H -0.351 5.287 0.700 1.00 . A A . 1 ASP HB2 1 1
19 5770 1 1 1 ASP HB3 H 1.395 5.115 0.537 1.00 . A A . 1 ASP HB3 1 1
19 5771 1 1 1 ASP N N -0.771 7.166 -1.058 1.00 . A A . 1 ASP N 1 1
19 5772 1 1 1 ASP O O -0.478 4.778 -2.422 1.00 . A A . 1 ASP O 1 1
19 5773 1 1 1 ASP OD1 O 0.471 6.612 2.721 1.00 . A A . 1 ASP OD1 1 1
19 5774 1 1 1 ASP OD2 O 1.223 7.988 1.182 1.00 . A A . 1 ASP OD2 1 1
19 5775 1 1 2 ALA C C 2.607 2.573 -2.612 1.00 . A A . 2 ALA C 1 1
19 5776 1 1 2 ALA CA C 1.969 3.788 -3.275 1.00 . A A . 2 ALA CA 1 1
19 5777 1 1 2 ALA CB C 2.827 4.277 -4.431 1.00 . A A . 2 ALA CB 1 1
19 5778 1 1 2 ALA H H 2.552 5.285 -1.900 1.00 . A A . 2 ALA H 1 1
19 5779 1 1 2 ALA HA H 1.002 3.503 -3.667 1.00 . A A . 2 ALA HA 1 1
19 5780 1 1 2 ALA HB1 H 3.563 3.526 -4.677 1.00 . A A . 2 ALA HB1 1 1
19 5781 1 1 2 ALA HB2 H 3.325 5.190 -4.146 1.00 . A A . 2 ALA HB2 1 1
19 5782 1 1 2 ALA HB3 H 2.200 4.461 -5.291 1.00 . A A . 2 ALA HB3 1 1
19 5783 1 1 2 ALA N N 1.768 4.858 -2.307 1.00 . A A . 2 ALA N 1 1
19 5784 1 1 2 ALA O O 2.937 2.602 -1.426 1.00 . A A . 2 ALA O 1 1
19 5785 1 1 3 GLU C C 4.713 0.552 -2.193 1.00 . A A . 3 GLU C 1 1
19 5786 1 1 3 GLU CA C 3.373 0.277 -2.871 1.00 . A A . 3 GLU CA 1 1
19 5787 1 1 3 GLU CB C 3.560 -0.732 -4.006 1.00 . A A . 3 GLU CB 1 1
19 5788 1 1 3 GLU CD C 2.503 -2.799 -3.012 1.00 . A A . 3 GLU CD 1 1
19 5789 1 1 3 GLU CG C 3.777 -2.159 -3.526 1.00 . A A . 3 GLU CG 1 1
19 5790 1 1 3 GLU H H 2.493 1.547 -4.321 1.00 . A A . 3 GLU H 1 1
19 5791 1 1 3 GLU HA H 2.695 -0.138 -2.142 1.00 . A A . 3 GLU HA 1 1
19 5792 1 1 3 GLU HB2 H 2.682 -0.717 -4.635 1.00 . A A . 3 GLU HB2 1 1
19 5793 1 1 3 GLU HB3 H 4.417 -0.440 -4.595 1.00 . A A . 3 GLU HB3 1 1
19 5794 1 1 3 GLU HG2 H 4.150 -2.750 -4.349 1.00 . A A . 3 GLU HG2 1 1
19 5795 1 1 3 GLU HG3 H 4.505 -2.149 -2.729 1.00 . A A . 3 GLU HG3 1 1
19 5796 1 1 3 GLU N N 2.778 1.507 -3.384 1.00 . A A . 3 GLU N 1 1
19 5797 1 1 3 GLU O O 5.033 -0.043 -1.166 1.00 . A A . 3 GLU O 1 1
19 5798 1 1 3 GLU OE1 O 1.666 -2.075 -2.433 1.00 . A A . 3 GLU OE1 1 1
19 5799 1 1 3 GLU OE2 O 2.340 -4.024 -3.194 1.00 . A A . 3 GLU OE2 1 1
19 5800 1 1 4 PHE C C 6.628 2.575 -0.907 1.00 . A A . 4 PHE C 1 1
19 5801 1 1 4 PHE CA C 6.792 1.804 -2.213 1.00 . A A . 4 PHE CA 1 1
19 5802 1 1 4 PHE CB C 7.605 2.628 -3.216 1.00 . A A . 4 PHE CB 1 1
19 5803 1 1 4 PHE CD1 C 7.614 5.057 -2.585 1.00 . A A . 4 PHE CD1 1 1
19 5804 1 1 4 PHE CD2 C 6.166 4.353 -4.345 1.00 . A A . 4 PHE CD2 1 1
19 5805 1 1 4 PHE CE1 C 7.172 6.358 -2.737 1.00 . A A . 4 PHE CE1 1 1
19 5806 1 1 4 PHE CE2 C 5.722 5.652 -4.501 1.00 . A A . 4 PHE CE2 1 1
19 5807 1 1 4 PHE CG C 7.118 4.041 -3.385 1.00 . A A . 4 PHE CG 1 1
19 5808 1 1 4 PHE CZ C 6.225 6.655 -3.697 1.00 . A A . 4 PHE CZ 1 1
19 5809 1 1 4 PHE H H 5.184 1.904 -3.586 1.00 . A A . 4 PHE H 1 1
19 5810 1 1 4 PHE HA H 7.318 0.884 -2.007 1.00 . A A . 4 PHE HA 1 1
19 5811 1 1 4 PHE HB2 H 8.632 2.672 -2.885 1.00 . A A . 4 PHE HB2 1 1
19 5812 1 1 4 PHE HB3 H 7.565 2.144 -4.181 1.00 . A A . 4 PHE HB3 1 1
19 5813 1 1 4 PHE HD1 H 8.355 4.825 -1.834 1.00 . A A . 4 PHE HD1 1 1
19 5814 1 1 4 PHE HD2 H 5.771 3.569 -4.973 1.00 . A A . 4 PHE HD2 1 1
19 5815 1 1 4 PHE HE1 H 7.568 7.140 -2.107 1.00 . A A . 4 PHE HE1 1 1
19 5816 1 1 4 PHE HE2 H 4.982 5.882 -5.253 1.00 . A A . 4 PHE HE2 1 1
19 5817 1 1 4 PHE HZ H 5.879 7.672 -3.818 1.00 . A A . 4 PHE HZ 1 1
19 5818 1 1 4 PHE N N 5.491 1.457 -2.771 1.00 . A A . 4 PHE N 1 1
19 5819 1 1 4 PHE O O 7.460 2.477 -0.005 1.00 . A A . 4 PHE O 1 1
19 5820 1 1 5 ARG C C 4.767 3.243 1.508 1.00 . A A . 5 ARG C 1 1
19 5821 1 1 5 ARG CA C 5.266 4.133 0.376 1.00 . A A . 5 ARG CA 1 1
19 5822 1 1 5 ARG CB C 4.229 5.210 0.061 1.00 . A A . 5 ARG CB 1 1
19 5823 1 1 5 ARG CD C 5.210 7.084 1.419 1.00 . A A . 5 ARG CD 1 1
19 5824 1 1 5 ARG CG C 4.001 6.189 1.198 1.00 . A A . 5 ARG CG 1 1
19 5825 1 1 5 ARG CZ C 5.745 9.155 2.642 1.00 . A A . 5 ARG CZ 1 1
19 5826 1 1 5 ARG H H 4.920 3.377 -1.568 1.00 . A A . 5 ARG H 1 1
19 5827 1 1 5 ARG HA H 6.185 4.608 0.684 1.00 . A A . 5 ARG HA 1 1
19 5828 1 1 5 ARG HB2 H 4.558 5.768 -0.805 1.00 . A A . 5 ARG HB2 1 1
19 5829 1 1 5 ARG HB3 H 3.289 4.731 -0.168 1.00 . A A . 5 ARG HB3 1 1
19 5830 1 1 5 ARG HD2 H 5.938 6.545 2.008 1.00 . A A . 5 ARG HD2 1 1
19 5831 1 1 5 ARG HD3 H 5.637 7.332 0.459 1.00 . A A . 5 ARG HD3 1 1
19 5832 1 1 5 ARG HE H 3.902 8.534 2.195 1.00 . A A . 5 ARG HE 1 1
19 5833 1 1 5 ARG HG2 H 3.150 6.807 0.961 1.00 . A A . 5 ARG HG2 1 1
19 5834 1 1 5 ARG HG3 H 3.805 5.633 2.103 1.00 . A A . 5 ARG HG3 1 1
19 5835 1 1 5 ARG HH11 H 7.359 8.066 2.095 1.00 . A A . 5 ARG HH11 1 1
19 5836 1 1 5 ARG HH12 H 7.707 9.528 2.953 1.00 . A A . 5 ARG HH12 1 1
19 5837 1 1 5 ARG HH21 H 4.358 10.458 3.322 1.00 . A A . 5 ARG HH21 1 1
19 5838 1 1 5 ARG HH22 H 6.003 10.887 3.651 1.00 . A A . 5 ARG HH22 1 1
19 5839 1 1 5 ARG N N 5.547 3.344 -0.816 1.00 . A A . 5 ARG N 1 1
19 5840 1 1 5 ARG NE N 4.855 8.317 2.116 1.00 . A A . 5 ARG NE 1 1
19 5841 1 1 5 ARG NH1 N 7.043 8.895 2.556 1.00 . A A . 5 ARG NH1 1 1
19 5842 1 1 5 ARG NH2 N 5.335 10.258 3.255 1.00 . A A . 5 ARG NH2 1 1
19 5843 1 1 5 ARG O O 5.141 3.426 2.667 1.00 . A A . 5 ARG O 1 1
19 5844 1 1 6 HIS C C 4.447 0.417 2.671 1.00 . A A . 6 HIS C 1 1
19 5845 1 1 6 HIS CA C 3.369 1.354 2.148 1.00 . A A . 6 HIS CA 1 1
19 5846 1 1 6 HIS CB C 2.242 0.529 1.531 1.00 . A A . 6 HIS CB 1 1
19 5847 1 1 6 HIS CD2 C 0.762 1.408 -0.388 1.00 . A A . 6 HIS CD2 1 1
19 5848 1 1 6 HIS CE1 C -0.472 2.798 0.715 1.00 . A A . 6 HIS CE1 1 1
19 5849 1 1 6 HIS CG C 1.167 1.350 0.903 1.00 . A A . 6 HIS CG 1 1
19 5850 1 1 6 HIS H H 3.664 2.185 0.220 1.00 . A A . 6 HIS H 1 1
19 5851 1 1 6 HIS HA H 2.977 1.934 2.970 1.00 . A A . 6 HIS HA 1 1
19 5852 1 1 6 HIS HB2 H 2.656 -0.111 0.766 1.00 . A A . 6 HIS HB2 1 1
19 5853 1 1 6 HIS HB3 H 1.791 -0.082 2.300 1.00 . A A . 6 HIS HB3 1 1
19 5854 1 1 6 HIS HD1 H 0.418 2.431 2.552 1.00 . A A . 6 HIS HD1 1 1
19 5855 1 1 6 HIS HD2 H 1.170 0.832 -1.205 1.00 . A A . 6 HIS HD2 1 1
19 5856 1 1 6 HIS HE1 H -1.218 3.534 0.970 1.00 . A A . 6 HIS HE1 1 1
19 5857 1 1 6 HIS N N 3.922 2.278 1.164 1.00 . A A . 6 HIS N 1 1
19 5858 1 1 6 HIS ND1 N 0.373 2.241 1.592 1.00 . A A . 6 HIS ND1 1 1
19 5859 1 1 6 HIS NE2 N -0.275 2.329 -0.502 1.00 . A A . 6 HIS NE2 1 1
19 5860 1 1 6 HIS O O 4.546 0.170 3.874 1.00 . A A . 6 HIS O 1 1
19 5861 1 1 7 HIS C C 7.633 -0.288 2.311 1.00 . A A . 7 HIS C 1 1
19 5862 1 1 7 HIS CA C 6.318 -1.028 2.105 1.00 . A A . 7 HIS CA 1 1
19 5863 1 1 7 HIS CB C 6.478 -2.085 1.011 1.00 . A A . 7 HIS CB 1 1
19 5864 1 1 7 HIS CD2 C 4.128 -2.639 0.061 1.00 . A A . 7 HIS CD2 1 1
19 5865 1 1 7 HIS CE1 C 3.870 -4.617 0.895 1.00 . A A . 7 HIS CE1 1 1
19 5866 1 1 7 HIS CG C 5.247 -2.909 0.786 1.00 . A A . 7 HIS CG 1 1
19 5867 1 1 7 HIS H H 5.108 0.129 0.810 1.00 . A A . 7 HIS H 1 1
19 5868 1 1 7 HIS HA H 6.043 -1.518 3.027 1.00 . A A . 7 HIS HA 1 1
19 5869 1 1 7 HIS HB2 H 6.723 -1.595 0.080 1.00 . A A . 7 HIS HB2 1 1
19 5870 1 1 7 HIS HB3 H 7.281 -2.752 1.283 1.00 . A A . 7 HIS HB3 1 1
19 5871 1 1 7 HIS HD1 H 5.691 -4.653 1.887 1.00 . A A . 7 HIS HD1 1 1
19 5872 1 1 7 HIS HD2 H 3.918 -1.722 -0.469 1.00 . A A . 7 HIS HD2 1 1
19 5873 1 1 7 HIS HE1 H 3.452 -5.577 1.159 1.00 . A A . 7 HIS HE1 1 1
19 5874 1 1 7 HIS N N 5.247 -0.106 1.752 1.00 . A A . 7 HIS N 1 1
19 5875 1 1 7 HIS ND1 N 5.062 -4.169 1.312 1.00 . A A . 7 HIS ND1 1 1
19 5876 1 1 7 HIS NE2 N 3.267 -3.728 0.131 1.00 . A A . 7 HIS NE2 1 1
19 5877 1 1 7 HIS O O 7.964 0.634 1.566 1.00 . A A . 7 HIS O 1 1
19 5878 1 1 8 SER C C 10.811 -1.059 3.407 1.00 . A A . 8 SER C 1 1
19 5879 1 1 8 SER CA C 9.665 -0.079 3.636 1.00 . A A . 8 SER CA 1 1
19 5880 1 1 8 SER CB C 9.683 0.414 5.085 1.00 . A A . 8 SER CB 1 1
19 5881 1 1 8 SER H H 8.064 -1.440 3.886 1.00 . A A . 8 SER H 1 1
19 5882 1 1 8 SER HA H 9.792 0.766 2.976 1.00 . A A . 8 SER HA 1 1
19 5883 1 1 8 SER HB2 H 8.903 1.150 5.222 1.00 . A A . 8 SER HB2 1 1
19 5884 1 1 8 SER HB3 H 9.511 -0.420 5.748 1.00 . A A . 8 SER HB3 1 1
19 5885 1 1 8 SER HG H 11.046 1.807 4.891 1.00 . A A . 8 SER HG 1 1
19 5886 1 1 8 SER N N 8.381 -0.700 3.328 1.00 . A A . 8 SER N 1 1
19 5887 1 1 8 SER O O 10.850 -2.134 4.007 1.00 . A A . 8 SER O 1 1
19 5888 1 1 8 SER OG O 10.929 1.007 5.407 1.00 . A A . 8 SER OG 1 1
19 5889 1 1 9 GLY C C 14.176 -0.991 2.791 1.00 . A A . 9 GLY C 1 1
19 5890 1 1 9 GLY CA C 12.874 -1.541 2.243 1.00 . A A . 9 GLY CA 1 1
19 5891 1 1 9 GLY H H 11.656 0.184 2.088 1.00 . A A . 9 GLY H 1 1
19 5892 1 1 9 GLY HA2 H 12.697 -2.513 2.674 1.00 . A A . 9 GLY HA2 1 1
19 5893 1 1 9 GLY HA3 H 12.963 -1.645 1.172 1.00 . A A . 9 GLY HA3 1 1
19 5894 1 1 9 GLY N N 11.741 -0.683 2.536 1.00 . A A . 9 GLY N 1 1
19 5895 1 1 9 GLY O O 14.466 0.197 2.646 1.00 . A A . 9 GLY O 1 1
19 5896 1 1 10 TYR C C 16.058 -0.328 5.005 1.00 . A A . 10 TYR C 1 1
19 5897 1 1 10 TYR CA C 16.242 -1.455 3.992 1.00 . A A . 10 TYR CA 1 1
19 5898 1 1 10 TYR CB C 17.199 -1.011 2.885 1.00 . A A . 10 TYR CB 1 1
19 5899 1 1 10 TYR CD1 C 17.112 -3.076 1.437 1.00 . A A . 10 TYR CD1 1 1
19 5900 1 1 10 TYR CD2 C 19.241 -2.330 2.205 1.00 . A A . 10 TYR CD2 1 1
19 5901 1 1 10 TYR CE1 C 17.714 -4.128 0.775 1.00 . A A . 10 TYR CE1 1 1
19 5902 1 1 10 TYR CE2 C 19.852 -3.380 1.545 1.00 . A A . 10 TYR CE2 1 1
19 5903 1 1 10 TYR CG C 17.864 -2.161 2.162 1.00 . A A . 10 TYR CG 1 1
19 5904 1 1 10 TYR CZ C 19.084 -4.276 0.831 1.00 . A A . 10 TYR CZ 1 1
19 5905 1 1 10 TYR H H 14.677 -2.791 3.502 1.00 . A A . 10 TYR H 1 1
19 5906 1 1 10 TYR HA H 16.663 -2.311 4.498 1.00 . A A . 10 TYR HA 1 1
19 5907 1 1 10 TYR HB2 H 16.652 -0.432 2.157 1.00 . A A . 10 TYR HB2 1 1
19 5908 1 1 10 TYR HB3 H 17.976 -0.395 3.316 1.00 . A A . 10 TYR HB3 1 1
19 5909 1 1 10 TYR HD1 H 16.039 -2.958 1.395 1.00 . A A . 10 TYR HD1 1 1
19 5910 1 1 10 TYR HD2 H 19.841 -1.627 2.765 1.00 . A A . 10 TYR HD2 1 1
19 5911 1 1 10 TYR HE1 H 17.112 -4.830 0.216 1.00 . A A . 10 TYR HE1 1 1
19 5912 1 1 10 TYR HE2 H 20.924 -3.495 1.589 1.00 . A A . 10 TYR HE2 1 1
19 5913 1 1 10 TYR HH H 19.650 -6.111 0.719 1.00 . A A . 10 TYR HH 1 1
19 5914 1 1 10 TYR N N 14.962 -1.859 3.420 1.00 . A A . 10 TYR N 1 1
19 5915 1 1 10 TYR O O 14.901 0.086 5.225 1.00 . A A . 10 TYR O 1 1
19 5916 1 1 10 TYR OH O 19.688 -5.323 0.173 1.00 . A A . 10 TYR OH 1 1
19 5917 1 1 11 NH2 HN1 H 18.052 -0.216 5.390 1.00 . A A . 11 NH2 HN1 1 1
19 5918 1 1 11 NH2 HN2 H 17.049 0.906 6.283 1.00 . A A . 11 NH2 HN2 1 1
19 5919 1 1 11 NH2 N N 17.140 0.160 5.608 1.00 . A A . 11 NH2 N 1 1
19 5920 2 1 1 ASP C C -0.354 -5.691 -0.821 1.00 . B B . 1 ASP C 1 1
19 5921 2 1 1 ASP CA C -0.446 -6.617 0.387 1.00 . B B . 1 ASP CA 1 1
19 5922 2 1 1 ASP CB C -1.042 -5.870 1.580 1.00 . B B . 1 ASP CB 1 1
19 5923 2 1 1 ASP CG C -1.558 -6.808 2.652 1.00 . B B . 1 ASP CG 1 1
19 5924 2 1 1 ASP H1 H 0.748 -7.972 1.372 1.00 . B B . 1 ASP H1 1 1
19 5925 2 1 1 ASP H2 H 1.387 -6.381 1.292 1.00 . B B . 1 ASP H2 1 1
19 5926 2 1 1 ASP H3 H 1.400 -7.384 -0.100 1.00 . B B . 1 ASP H3 1 1
19 5927 2 1 1 ASP HA H -1.080 -7.455 0.140 1.00 . B B . 1 ASP HA 1 1
19 5928 2 1 1 ASP HB2 H -0.282 -5.239 2.017 1.00 . B B . 1 ASP HB2 1 1
19 5929 2 1 1 ASP HB3 H -1.861 -5.256 1.238 1.00 . B B . 1 ASP HB3 1 1
19 5930 2 1 1 ASP N N 0.894 -7.135 0.773 1.00 . B B . 1 ASP N 1 1
19 5931 2 1 1 ASP O O 0.728 -5.231 -1.181 1.00 . B B . 1 ASP O 1 1
19 5932 2 1 1 ASP OD1 O -1.718 -6.360 3.808 1.00 . B B . 1 ASP OD1 1 1
19 5933 2 1 1 ASP OD2 O -1.806 -7.991 2.336 1.00 . B B . 1 ASP OD2 1 1
19 5934 2 1 2 ALA C C -2.271 -3.246 -2.300 1.00 . B B . 2 ALA C 1 1
19 5935 2 1 2 ALA CA C -1.547 -4.552 -2.611 1.00 . B B . 2 ALA CA 1 1
19 5936 2 1 2 ALA CB C -2.222 -5.268 -3.771 1.00 . B B . 2 ALA CB 1 1
19 5937 2 1 2 ALA H H -2.328 -5.819 -1.108 1.00 . B B . 2 ALA H 1 1
19 5938 2 1 2 ALA HA H -0.531 -4.326 -2.902 1.00 . B B . 2 ALA HA 1 1
19 5939 2 1 2 ALA HB1 H -1.522 -5.371 -4.587 1.00 . B B . 2 ALA HB1 1 1
19 5940 2 1 2 ALA HB2 H -3.077 -4.696 -4.100 1.00 . B B . 2 ALA HB2 1 1
19 5941 2 1 2 ALA HB3 H -2.547 -6.246 -3.449 1.00 . B B . 2 ALA HB3 1 1
19 5942 2 1 2 ALA N N -1.498 -5.421 -1.442 1.00 . B B . 2 ALA N 1 1
19 5943 2 1 2 ALA O O -2.807 -3.066 -1.206 1.00 . B B . 2 ALA O 1 1
19 5944 2 1 3 GLU C C -4.369 -1.199 -2.620 1.00 . B B . 3 GLU C 1 1
19 5945 2 1 3 GLU CA C -2.933 -1.042 -3.112 1.00 . B B . 3 GLU CA 1 1
19 5946 2 1 3 GLU CB C -2.919 -0.278 -4.439 1.00 . B B . 3 GLU CB 1 1
19 5947 2 1 3 GLU CD C -2.018 2.015 -3.886 1.00 . B B . 3 GLU CD 1 1
19 5948 2 1 3 GLU CG C -3.231 1.203 -4.293 1.00 . B B . 3 GLU CG 1 1
19 5949 2 1 3 GLU H H -1.837 -2.548 -4.120 1.00 . B B . 3 GLU H 1 1
19 5950 2 1 3 GLU HA H -2.375 -0.480 -2.380 1.00 . B B . 3 GLU HA 1 1
19 5951 2 1 3 GLU HB2 H -1.940 -0.375 -4.885 1.00 . B B . 3 GLU HB2 1 1
19 5952 2 1 3 GLU HB3 H -3.651 -0.715 -5.100 1.00 . B B . 3 GLU HB3 1 1
19 5953 2 1 3 GLU HG2 H -3.594 1.576 -5.238 1.00 . B B . 3 GLU HG2 1 1
19 5954 2 1 3 GLU HG3 H -3.996 1.323 -3.540 1.00 . B B . 3 GLU HG3 1 1
19 5955 2 1 3 GLU N N -2.282 -2.340 -3.272 1.00 . B B . 3 GLU N 1 1
19 5956 2 1 3 GLU O O -4.854 -0.391 -1.829 1.00 . B B . 3 GLU O 1 1
19 5957 2 1 3 GLU OE1 O -1.068 1.425 -3.332 1.00 . B B . 3 GLU OE1 1 1
19 5958 2 1 3 GLU OE2 O -2.014 3.240 -4.130 1.00 . B B . 3 GLU OE2 1 1
19 5959 2 1 4 PHE C C -6.475 -2.926 -1.222 1.00 . B B . 4 PHE C 1 1
19 5960 2 1 4 PHE CA C -6.424 -2.488 -2.680 1.00 . B B . 4 PHE CA 1 1
19 5961 2 1 4 PHE CB C -7.076 -3.544 -3.581 1.00 . B B . 4 PHE CB 1 1
19 5962 2 1 4 PHE CD1 C -7.127 -5.799 -2.484 1.00 . B B . 4 PHE CD1 1 1
19 5963 2 1 4 PHE CD2 C -5.444 -5.374 -4.118 1.00 . B B . 4 PHE CD2 1 1
19 5964 2 1 4 PHE CE1 C -6.639 -7.079 -2.308 1.00 . B B . 4 PHE CE1 1 1
19 5965 2 1 4 PHE CE2 C -4.949 -6.653 -3.947 1.00 . B B . 4 PHE CE2 1 1
19 5966 2 1 4 PHE CG C -6.537 -4.933 -3.390 1.00 . B B . 4 PHE CG 1 1
19 5967 2 1 4 PHE CZ C -5.547 -7.507 -3.040 1.00 . B B . 4 PHE CZ 1 1
19 5968 2 1 4 PHE H H -4.610 -2.856 -3.711 1.00 . B B . 4 PHE H 1 1
19 5969 2 1 4 PHE HA H -6.966 -1.561 -2.780 1.00 . B B . 4 PHE HA 1 1
19 5970 2 1 4 PHE HB2 H -8.136 -3.572 -3.377 1.00 . B B . 4 PHE HB2 1 1
19 5971 2 1 4 PHE HB3 H -6.922 -3.267 -4.614 1.00 . B B . 4 PHE HB3 1 1
19 5972 2 1 4 PHE HD1 H -7.980 -5.467 -1.910 1.00 . B B . 4 PHE HD1 1 1
19 5973 2 1 4 PHE HD2 H -4.976 -4.706 -4.827 1.00 . B B . 4 PHE HD2 1 1
19 5974 2 1 4 PHE HE1 H -7.108 -7.746 -1.600 1.00 . B B . 4 PHE HE1 1 1
19 5975 2 1 4 PHE HE2 H -4.097 -6.984 -4.519 1.00 . B B . 4 PHE HE2 1 1
19 5976 2 1 4 PHE HZ H -5.163 -8.507 -2.904 1.00 . B B . 4 PHE HZ 1 1
19 5977 2 1 4 PHE N N -5.046 -2.241 -3.087 1.00 . B B . 4 PHE N 1 1
19 5978 2 1 4 PHE O O -7.447 -2.659 -0.515 1.00 . B B . 4 PHE O 1 1
19 5979 2 1 5 ARG C C -5.064 -2.864 1.536 1.00 . B B . 5 ARG C 1 1
19 5980 2 1 5 ARG CA C -5.326 -4.042 0.609 1.00 . B B . 5 ARG CA 1 1
19 5981 2 1 5 ARG CB C -4.205 -5.066 0.761 1.00 . B B . 5 ARG CB 1 1
19 5982 2 1 5 ARG CD C -5.570 -7.173 0.690 1.00 . B B . 5 ARG CD 1 1
19 5983 2 1 5 ARG CG C -4.457 -6.373 0.033 1.00 . B B . 5 ARG CG 1 1
19 5984 2 1 5 ARG CZ C -5.897 -8.568 2.696 1.00 . B B . 5 ARG CZ 1 1
19 5985 2 1 5 ARG H H -4.659 -3.754 -1.378 1.00 . B B . 5 ARG H 1 1
19 5986 2 1 5 ARG HA H -6.267 -4.499 0.874 1.00 . B B . 5 ARG HA 1 1
19 5987 2 1 5 ARG HB2 H -3.294 -4.638 0.372 1.00 . B B . 5 ARG HB2 1 1
19 5988 2 1 5 ARG HB3 H -4.070 -5.283 1.811 1.00 . B B . 5 ARG HB3 1 1
19 5989 2 1 5 ARG HD2 H -6.357 -6.497 0.987 1.00 . B B . 5 ARG HD2 1 1
19 5990 2 1 5 ARG HD3 H -5.957 -7.884 -0.026 1.00 . B B . 5 ARG HD3 1 1
19 5991 2 1 5 ARG HE H -4.136 -7.883 2.054 1.00 . B B . 5 ARG HE 1 1
19 5992 2 1 5 ARG HG2 H -4.734 -6.155 -0.985 1.00 . B B . 5 ARG HG2 1 1
19 5993 2 1 5 ARG HG3 H -3.552 -6.960 0.042 1.00 . B B . 5 ARG HG3 1 1
19 5994 2 1 5 ARG HH11 H -7.599 -8.134 1.693 1.00 . B B . 5 ARG HH11 1 1
19 5995 2 1 5 ARG HH12 H -7.801 -9.114 3.107 1.00 . B B . 5 ARG HH12 1 1
19 5996 2 1 5 ARG HH21 H -4.399 -9.174 3.910 1.00 . B B . 5 ARG HH21 1 1
19 5997 2 1 5 ARG HH22 H -5.984 -9.704 4.366 1.00 . B B . 5 ARG HH22 1 1
19 5998 2 1 5 ARG N N -5.412 -3.585 -0.771 1.00 . B B . 5 ARG N 1 1
19 5999 2 1 5 ARG NE N -5.099 -7.897 1.869 1.00 . B B . 5 ARG NE 1 1
19 6000 2 1 5 ARG NH1 N -7.205 -8.608 2.480 1.00 . B B . 5 ARG NH1 1 1
19 6001 2 1 5 ARG NH2 N -5.385 -9.200 3.744 1.00 . B B . 5 ARG NH2 1 1
19 6002 2 1 5 ARG O O -5.681 -2.733 2.593 1.00 . B B . 5 ARG O 1 1
19 6003 2 1 6 HIS C C -4.901 0.195 1.890 1.00 . B B . 6 HIS C 1 1
19 6004 2 1 6 HIS CA C -3.773 -0.832 1.904 1.00 . B B . 6 HIS CA 1 1
19 6005 2 1 6 HIS CB C -2.502 -0.191 1.343 1.00 . B B . 6 HIS CB 1 1
19 6006 2 1 6 HIS CD2 C -0.871 -1.623 -0.055 1.00 . B B . 6 HIS CD2 1 1
19 6007 2 1 6 HIS CE1 C 0.271 -2.539 1.535 1.00 . B B . 6 HIS CE1 1 1
19 6008 2 1 6 HIS CG C -1.383 -1.156 1.110 1.00 . B B . 6 HIS CG 1 1
19 6009 2 1 6 HIS H H -3.683 -2.173 0.268 1.00 . B B . 6 HIS H 1 1
19 6010 2 1 6 HIS HA H -3.594 -1.144 2.921 1.00 . B B . 6 HIS HA 1 1
19 6011 2 1 6 HIS HB2 H -2.736 0.273 0.397 1.00 . B B . 6 HIS HB2 1 1
19 6012 2 1 6 HIS HB3 H -2.155 0.564 2.032 1.00 . B B . 6 HIS HB3 1 1
19 6013 2 1 6 HIS HD1 H -0.772 -1.618 3.076 1.00 . B B . 6 HIS HD1 1 1
19 6014 2 1 6 HIS HD2 H -1.211 -1.361 -1.045 1.00 . B B . 6 HIS HD2 1 1
19 6015 2 1 6 HIS HE1 H 1.003 -3.125 2.073 1.00 . B B . 6 HIS HE1 1 1
19 6016 2 1 6 HIS N N -4.135 -2.008 1.124 1.00 . B B . 6 HIS N 1 1
19 6017 2 1 6 HIS ND1 N -0.647 -1.750 2.113 1.00 . B B . 6 HIS ND1 1 1
19 6018 2 1 6 HIS NE2 N 0.174 -2.497 0.222 1.00 . B B . 6 HIS NE2 1 1
19 6019 2 1 6 HIS O O -5.189 0.835 2.900 1.00 . B B . 6 HIS O 1 1
19 6020 2 1 7 HIS C C -7.965 0.648 0.820 1.00 . B B . 7 HIS C 1 1
19 6021 2 1 7 HIS CA C -6.613 1.303 0.560 1.00 . B B . 7 HIS CA 1 1
19 6022 2 1 7 HIS CB C -6.586 1.890 -0.852 1.00 . B B . 7 HIS CB 1 1
19 6023 2 1 7 HIS CD2 C -4.052 2.290 -1.226 1.00 . B B . 7 HIS CD2 1 1
19 6024 2 1 7 HIS CE1 C -4.087 4.413 -1.643 1.00 . B B . 7 HIS CE1 1 1
19 6025 2 1 7 HIS CG C -5.351 2.683 -1.151 1.00 . B B . 7 HIS CG 1 1
19 6026 2 1 7 HIS H H -5.239 -0.187 -0.040 1.00 . B B . 7 HIS H 1 1
19 6027 2 1 7 HIS HA H -6.469 2.100 1.274 1.00 . B B . 7 HIS HA 1 1
19 6028 2 1 7 HIS HB2 H -6.644 1.086 -1.570 1.00 . B B . 7 HIS HB2 1 1
19 6029 2 1 7 HIS HB3 H -7.439 2.541 -0.980 1.00 . B B . 7 HIS HB3 1 1
19 6030 2 1 7 HIS HD1 H -6.141 4.617 -1.436 1.00 . B B . 7 HIS HD1 1 1
19 6031 2 1 7 HIS HD2 H -3.680 1.287 -1.070 1.00 . B B . 7 HIS HD2 1 1
19 6032 2 1 7 HIS HE1 H -3.785 5.422 -1.876 1.00 . B B . 7 HIS HE1 1 1
19 6033 2 1 7 HIS N N -5.525 0.350 0.728 1.00 . B B . 7 HIS N 1 1
19 6034 2 1 7 HIS ND1 N -5.353 4.034 -1.416 1.00 . B B . 7 HIS ND1 1 1
19 6035 2 1 7 HIS NE2 N -3.259 3.391 -1.539 1.00 . B B . 7 HIS NE2 1 1
19 6036 2 1 7 HIS O O -8.196 -0.500 0.440 1.00 . B B . 7 HIS O 1 1
19 6037 2 1 8 SER C C -11.086 0.936 0.542 1.00 . B B . 8 SER C 1 1
19 6038 2 1 8 SER CA C -10.191 0.887 1.775 1.00 . B B . 8 SER CA 1 1
19 6039 2 1 8 SER CB C -10.818 1.704 2.907 1.00 . B B . 8 SER CB 1 1
19 6040 2 1 8 SER H H -8.613 2.298 1.741 1.00 . B B . 8 SER H 1 1
19 6041 2 1 8 SER HA H -10.094 -0.140 2.095 1.00 . B B . 8 SER HA 1 1
19 6042 2 1 8 SER HB2 H -10.888 2.739 2.607 1.00 . B B . 8 SER HB2 1 1
19 6043 2 1 8 SER HB3 H -11.806 1.323 3.119 1.00 . B B . 8 SER HB3 1 1
19 6044 2 1 8 SER HG H -9.850 0.705 4.287 1.00 . B B . 8 SER HG 1 1
19 6045 2 1 8 SER N N -8.857 1.388 1.467 1.00 . B B . 8 SER N 1 1
19 6046 2 1 8 SER O O -10.908 1.784 -0.333 1.00 . B B . 8 SER O 1 1
19 6047 2 1 8 SER OG O -10.035 1.625 4.086 1.00 . B B . 8 SER OG 1 1
19 6048 2 1 9 GLY C C -12.443 -0.910 -1.772 1.00 . B B . 9 GLY C 1 1
19 6049 2 1 9 GLY CA C -12.954 -0.022 -0.657 1.00 . B B . 9 GLY CA 1 1
19 6050 2 1 9 GLY H H -12.141 -0.631 1.203 1.00 . B B . 9 GLY H 1 1
19 6051 2 1 9 GLY HA2 H -13.911 -0.394 -0.323 1.00 . B B . 9 GLY HA2 1 1
19 6052 2 1 9 GLY HA3 H -13.080 0.980 -1.040 1.00 . B B . 9 GLY HA3 1 1
19 6053 2 1 9 GLY N N -12.047 0.021 0.476 1.00 . B B . 9 GLY N 1 1
19 6054 2 1 9 GLY O O -11.852 -1.960 -1.518 1.00 . B B . 9 GLY O 1 1
19 6055 2 1 10 TYR C C -11.020 -0.613 -4.827 1.00 . B B . 10 TYR C 1 1
19 6056 2 1 10 TYR CA C -12.236 -1.263 -4.172 1.00 . B B . 10 TYR CA 1 1
19 6057 2 1 10 TYR CB C -13.373 -1.384 -5.186 1.00 . B B . 10 TYR CB 1 1
19 6058 2 1 10 TYR CD1 C -15.611 -1.227 -4.031 1.00 . B B . 10 TYR CD1 1 1
19 6059 2 1 10 TYR CD2 C -14.820 -3.386 -4.659 1.00 . B B . 10 TYR CD2 1 1
19 6060 2 1 10 TYR CE1 C -16.757 -1.795 -3.507 1.00 . B B . 10 TYR CE1 1 1
19 6061 2 1 10 TYR CE2 C -15.963 -3.962 -4.138 1.00 . B B . 10 TYR CE2 1 1
19 6062 2 1 10 TYR CG C -14.625 -2.012 -4.615 1.00 . B B . 10 TYR CG 1 1
19 6063 2 1 10 TYR CZ C -16.928 -3.162 -3.563 1.00 . B B . 10 TYR CZ 1 1
19 6064 2 1 10 TYR H H -13.154 0.350 -3.153 1.00 . B B . 10 TYR H 1 1
19 6065 2 1 10 TYR HA H -11.962 -2.249 -3.830 1.00 . B B . 10 TYR HA 1 1
19 6066 2 1 10 TYR HB2 H -13.630 -0.401 -5.548 1.00 . B B . 10 TYR HB2 1 1
19 6067 2 1 10 TYR HB3 H -13.044 -1.993 -6.014 1.00 . B B . 10 TYR HB3 1 1
19 6068 2 1 10 TYR HD1 H -15.474 -0.157 -3.990 1.00 . B B . 10 TYR HD1 1 1
19 6069 2 1 10 TYR HD2 H -14.062 -4.009 -5.111 1.00 . B B . 10 TYR HD2 1 1
19 6070 2 1 10 TYR HE1 H -17.512 -1.168 -3.057 1.00 . B B . 10 TYR HE1 1 1
19 6071 2 1 10 TYR HE2 H -16.096 -5.033 -4.182 1.00 . B B . 10 TYR HE2 1 1
19 6072 2 1 10 TYR HH H -18.145 -3.497 -2.113 1.00 . B B . 10 TYR HH 1 1
19 6073 2 1 10 TYR N N -12.675 -0.494 -3.013 1.00 . B B . 10 TYR N 1 1
19 6074 2 1 10 TYR O O -9.888 -1.054 -4.537 1.00 . B B . 10 TYR O 1 1
19 6075 2 1 10 TYR OH O -18.066 -3.731 -3.042 1.00 . B B . 10 TYR OH 1 1
19 6076 2 1 11 NH2 HN1 H -12.166 0.702 -5.874 1.00 . B B . 11 NH2 HN1 1 1
19 6077 2 1 11 NH2 HN2 H -10.441 0.839 -6.128 1.00 . B B . 11 NH2 HN2 1 1
19 6078 2 1 11 NH2 N N -11.226 0.390 -5.678 1.00 . B B . 11 NH2 N 1 1
19 6079 3 2 1 ZN ZN ZN 1.594 -3.396 -0.978 1.00 . C A . 101 ZN ZN 1 1
19 6080 4 2 1 ZN ZN ZN -1.362 2.961 -2.139 1.00 . D A . 102 ZN ZN 1 1
20 6081 1 1 1 ASP C C 0.589 5.459 -1.420 1.00 . A A . 1 ASP C 1 1
20 6082 1 1 1 ASP CA C 0.602 6.520 -0.323 1.00 . A A . 1 ASP CA 1 1
20 6083 1 1 1 ASP CB C 0.707 5.857 1.051 1.00 . A A . 1 ASP CB 1 1
20 6084 1 1 1 ASP CG C 0.817 6.870 2.174 1.00 . A A . 1 ASP CG 1 1
20 6085 1 1 1 ASP H1 H -0.674 7.821 -1.280 1.00 . A A . 1 ASP H1 1 1
20 6086 1 1 1 ASP H2 H -0.587 8.025 0.422 1.00 . A A . 1 ASP H2 1 1
20 6087 1 1 1 ASP H3 H -1.447 6.696 -0.242 1.00 . A A . 1 ASP H3 1 1
20 6088 1 1 1 ASP HA H 1.449 7.172 -0.473 1.00 . A A . 1 ASP HA 1 1
20 6089 1 1 1 ASP HB2 H -0.170 5.252 1.221 1.00 . A A . 1 ASP HB2 1 1
20 6090 1 1 1 ASP HB3 H 1.586 5.226 1.074 1.00 . A A . 1 ASP HB3 1 1
20 6091 1 1 1 ASP N N -0.639 7.340 -0.360 1.00 . A A . 1 ASP N 1 1
20 6092 1 1 1 ASP O O -0.469 5.067 -1.906 1.00 . A A . 1 ASP O 1 1
20 6093 1 1 1 ASP OD1 O 0.532 6.505 3.334 1.00 . A A . 1 ASP OD1 1 1
20 6094 1 1 1 ASP OD2 O 1.187 8.030 1.893 1.00 . A A . 1 ASP OD2 1 1
20 6095 1 1 2 ALA C C 2.569 2.726 -2.292 1.00 . A A . 2 ALA C 1 1
20 6096 1 1 2 ALA CA C 1.905 3.982 -2.840 1.00 . A A . 2 ALA CA 1 1
20 6097 1 1 2 ALA CB C 2.696 4.529 -4.020 1.00 . A A . 2 ALA CB 1 1
20 6098 1 1 2 ALA H H 2.584 5.351 -1.378 1.00 . A A . 2 ALA H 1 1
20 6099 1 1 2 ALA HA H 0.914 3.727 -3.188 1.00 . A A . 2 ALA HA 1 1
20 6100 1 1 2 ALA HB1 H 2.840 5.593 -3.894 1.00 . A A . 2 ALA HB1 1 1
20 6101 1 1 2 ALA HB2 H 2.152 4.346 -4.933 1.00 . A A . 2 ALA HB2 1 1
20 6102 1 1 2 ALA HB3 H 3.657 4.041 -4.067 1.00 . A A . 2 ALA HB3 1 1
20 6103 1 1 2 ALA N N 1.775 4.999 -1.803 1.00 . A A . 2 ALA N 1 1
20 6104 1 1 2 ALA O O 2.902 2.653 -1.109 1.00 . A A . 2 ALA O 1 1
20 6105 1 1 3 GLU C C 4.733 0.723 -2.103 1.00 . A A . 3 GLU C 1 1
20 6106 1 1 3 GLU CA C 3.380 0.476 -2.762 1.00 . A A . 3 GLU CA 1 1
20 6107 1 1 3 GLU CB C 3.549 -0.438 -3.977 1.00 . A A . 3 GLU CB 1 1
20 6108 1 1 3 GLU CD C 2.331 -2.599 -3.524 1.00 . A A . 3 GLU CD 1 1
20 6109 1 1 3 GLU CG C 3.675 -1.910 -3.618 1.00 . A A . 3 GLU CG 1 1
20 6110 1 1 3 GLU H H 2.467 1.856 -4.086 1.00 . A A . 3 GLU H 1 1
20 6111 1 1 3 GLU HA H 2.730 -0.004 -2.048 1.00 . A A . 3 GLU HA 1 1
20 6112 1 1 3 GLU HB2 H 2.694 -0.318 -4.624 1.00 . A A . 3 GLU HB2 1 1
20 6113 1 1 3 GLU HB3 H 4.441 -0.143 -4.511 1.00 . A A . 3 GLU HB3 1 1
20 6114 1 1 3 GLU HG2 H 4.263 -2.403 -4.375 1.00 . A A . 3 GLU HG2 1 1
20 6115 1 1 3 GLU HG3 H 4.173 -1.993 -2.663 1.00 . A A . 3 GLU HG3 1 1
20 6116 1 1 3 GLU N N 2.758 1.737 -3.158 1.00 . A A . 3 GLU N 1 1
20 6117 1 1 3 GLU O O 5.106 0.035 -1.154 1.00 . A A . 3 GLU O 1 1
20 6118 1 1 3 GLU OE1 O 1.612 -2.363 -2.531 1.00 . A A . 3 GLU OE1 1 1
20 6119 1 1 3 GLU OE2 O 1.995 -3.376 -4.443 1.00 . A A . 3 GLU OE2 1 1
20 6120 1 1 4 PHE C C 6.625 2.670 -0.675 1.00 . A A . 4 PHE C 1 1
20 6121 1 1 4 PHE CA C 6.768 2.050 -2.059 1.00 . A A . 4 PHE CA 1 1
20 6122 1 1 4 PHE CB C 7.507 3.013 -2.989 1.00 . A A . 4 PHE CB 1 1
20 6123 1 1 4 PHE CD1 C 6.865 5.309 -2.205 1.00 . A A . 4 PHE CD1 1 1
20 6124 1 1 4 PHE CD2 C 6.068 4.574 -4.330 1.00 . A A . 4 PHE CD2 1 1
20 6125 1 1 4 PHE CE1 C 6.216 6.517 -2.376 1.00 . A A . 4 PHE CE1 1 1
20 6126 1 1 4 PHE CE2 C 5.416 5.779 -4.506 1.00 . A A . 4 PHE CE2 1 1
20 6127 1 1 4 PHE CG C 6.799 4.324 -3.179 1.00 . A A . 4 PHE CG 1 1
20 6128 1 1 4 PHE CZ C 5.490 6.753 -3.528 1.00 . A A . 4 PHE CZ 1 1
20 6129 1 1 4 PHE H H 5.109 2.230 -3.361 1.00 . A A . 4 PHE H 1 1
20 6130 1 1 4 PHE HA H 7.336 1.137 -1.974 1.00 . A A . 4 PHE HA 1 1
20 6131 1 1 4 PHE HB2 H 8.483 3.220 -2.580 1.00 . A A . 4 PHE HB2 1 1
20 6132 1 1 4 PHE HB3 H 7.618 2.551 -3.959 1.00 . A A . 4 PHE HB3 1 1
20 6133 1 1 4 PHE HD1 H 7.432 5.127 -1.305 1.00 . A A . 4 PHE HD1 1 1
20 6134 1 1 4 PHE HD2 H 6.010 3.813 -5.093 1.00 . A A . 4 PHE HD2 1 1
20 6135 1 1 4 PHE HE1 H 6.276 7.276 -1.610 1.00 . A A . 4 PHE HE1 1 1
20 6136 1 1 4 PHE HE2 H 4.850 5.960 -5.407 1.00 . A A . 4 PHE HE2 1 1
20 6137 1 1 4 PHE HZ H 4.981 7.695 -3.665 1.00 . A A . 4 PHE HZ 1 1
20 6138 1 1 4 PHE N N 5.460 1.711 -2.607 1.00 . A A . 4 PHE N 1 1
20 6139 1 1 4 PHE O O 7.496 2.513 0.181 1.00 . A A . 4 PHE O 1 1
20 6140 1 1 5 ARG C C 4.646 3.030 1.808 1.00 . A A . 5 ARG C 1 1
20 6141 1 1 5 ARG CA C 5.258 4.017 0.821 1.00 . A A . 5 ARG CA 1 1
20 6142 1 1 5 ARG CB C 4.329 5.216 0.636 1.00 . A A . 5 ARG CB 1 1
20 6143 1 1 5 ARG CD C 4.546 7.506 1.655 1.00 . A A . 5 ARG CD 1 1
20 6144 1 1 5 ARG CG C 4.164 6.053 1.895 1.00 . A A . 5 ARG CG 1 1
20 6145 1 1 5 ARG CZ C 6.593 8.864 1.456 1.00 . A A . 5 ARG CZ 1 1
20 6146 1 1 5 ARG H H 4.859 3.461 -1.181 1.00 . A A . 5 ARG H 1 1
20 6147 1 1 5 ARG HA H 6.202 4.362 1.214 1.00 . A A . 5 ARG HA 1 1
20 6148 1 1 5 ARG HB2 H 4.725 5.848 -0.145 1.00 . A A . 5 ARG HB2 1 1
20 6149 1 1 5 ARG HB3 H 3.356 4.857 0.338 1.00 . A A . 5 ARG HB3 1 1
20 6150 1 1 5 ARG HD2 H 4.093 7.837 0.732 1.00 . A A . 5 ARG HD2 1 1
20 6151 1 1 5 ARG HD3 H 4.172 8.102 2.474 1.00 . A A . 5 ARG HD3 1 1
20 6152 1 1 5 ARG HE H 6.548 6.873 1.578 1.00 . A A . 5 ARG HE 1 1
20 6153 1 1 5 ARG HG2 H 3.132 6.011 2.208 1.00 . A A . 5 ARG HG2 1 1
20 6154 1 1 5 ARG HG3 H 4.795 5.647 2.669 1.00 . A A . 5 ARG HG3 1 1
20 6155 1 1 5 ARG HH11 H 4.877 9.935 1.492 1.00 . A A . 5 ARG HH11 1 1
20 6156 1 1 5 ARG HH12 H 6.331 10.866 1.354 1.00 . A A . 5 ARG HH12 1 1
20 6157 1 1 5 ARG HH21 H 8.460 8.096 1.395 1.00 . A A . 5 ARG HH21 1 1
20 6158 1 1 5 ARG HH22 H 8.366 9.822 1.298 1.00 . A A . 5 ARG HH22 1 1
20 6159 1 1 5 ARG N N 5.518 3.375 -0.461 1.00 . A A . 5 ARG N 1 1
20 6160 1 1 5 ARG NE N 5.993 7.681 1.561 1.00 . A A . 5 ARG NE 1 1
20 6161 1 1 5 ARG NH1 N 5.873 9.979 1.432 1.00 . A A . 5 ARG NH1 1 1
20 6162 1 1 5 ARG NH2 N 7.914 8.933 1.377 1.00 . A A . 5 ARG NH2 1 1
20 6163 1 1 5 ARG O O 4.965 3.048 2.998 1.00 . A A . 5 ARG O 1 1
20 6164 1 1 6 HIS C C 4.157 0.222 2.735 1.00 . A A . 6 HIS C 1 1
20 6165 1 1 6 HIS CA C 3.121 1.166 2.145 1.00 . A A . 6 HIS CA 1 1
20 6166 1 1 6 HIS CB C 2.099 0.364 1.334 1.00 . A A . 6 HIS CB 1 1
20 6167 1 1 6 HIS CD2 C 0.714 1.013 -0.750 1.00 . A A . 6 HIS CD2 1 1
20 6168 1 1 6 HIS CE1 C -0.136 2.875 -0.054 1.00 . A A . 6 HIS CE1 1 1
20 6169 1 1 6 HIS CG C 1.177 1.209 0.510 1.00 . A A . 6 HIS CG 1 1
20 6170 1 1 6 HIS H H 3.563 2.197 0.350 1.00 . A A . 6 HIS H 1 1
20 6171 1 1 6 HIS HA H 2.612 1.680 2.947 1.00 . A A . 6 HIS HA 1 1
20 6172 1 1 6 HIS HB2 H 2.626 -0.297 0.663 1.00 . A A . 6 HIS HB2 1 1
20 6173 1 1 6 HIS HB3 H 1.496 -0.223 2.011 1.00 . A A . 6 HIS HB3 1 1
20 6174 1 1 6 HIS HD1 H 0.771 2.817 1.813 1.00 . A A . 6 HIS HD1 1 1
20 6175 1 1 6 HIS HD2 H 0.943 0.173 -1.385 1.00 . A A . 6 HIS HD2 1 1
20 6176 1 1 6 HIS HE1 H -0.699 3.793 0.000 1.00 . A A . 6 HIS HE1 1 1
20 6177 1 1 6 HIS N N 3.771 2.165 1.306 1.00 . A A . 6 HIS N 1 1
20 6178 1 1 6 HIS ND1 N 0.628 2.396 0.939 1.00 . A A . 6 HIS ND1 1 1
20 6179 1 1 6 HIS NE2 N -0.116 2.073 -1.100 1.00 . A A . 6 HIS NE2 1 1
20 6180 1 1 6 HIS O O 4.069 -0.173 3.898 1.00 . A A . 6 HIS O 1 1
20 6181 1 1 7 HIS C C 7.483 -0.265 2.634 1.00 . A A . 7 HIS C 1 1
20 6182 1 1 7 HIS CA C 6.202 -1.039 2.337 1.00 . A A . 7 HIS CA 1 1
20 6183 1 1 7 HIS CB C 6.463 -2.084 1.254 1.00 . A A . 7 HIS CB 1 1
20 6184 1 1 7 HIS CD2 C 4.172 -2.610 0.167 1.00 . A A . 7 HIS CD2 1 1
20 6185 1 1 7 HIS CE1 C 3.893 -4.628 0.887 1.00 . A A . 7 HIS CE1 1 1
20 6186 1 1 7 HIS CG C 5.259 -2.910 0.923 1.00 . A A . 7 HIS CG 1 1
20 6187 1 1 7 HIS H H 5.142 0.214 0.999 1.00 . A A . 7 HIS H 1 1
20 6188 1 1 7 HIS HA H 5.878 -1.537 3.238 1.00 . A A . 7 HIS HA 1 1
20 6189 1 1 7 HIS HB2 H 6.782 -1.587 0.350 1.00 . A A . 7 HIS HB2 1 1
20 6190 1 1 7 HIS HB3 H 7.245 -2.751 1.588 1.00 . A A . 7 HIS HB3 1 1
20 6191 1 1 7 HIS HD1 H 5.674 -4.707 1.948 1.00 . A A . 7 HIS HD1 1 1
20 6192 1 1 7 HIS HD2 H 3.984 -1.669 -0.332 1.00 . A A . 7 HIS HD2 1 1
20 6193 1 1 7 HIS HE1 H 3.471 -5.601 1.086 1.00 . A A . 7 HIS HE1 1 1
20 6194 1 1 7 HIS N N 5.138 -0.137 1.915 1.00 . A A . 7 HIS N 1 1
20 6195 1 1 7 HIS ND1 N 5.064 -4.197 1.374 1.00 . A A . 7 HIS ND1 1 1
20 6196 1 1 7 HIS NE2 N 3.314 -3.703 0.149 1.00 . A A . 7 HIS NE2 1 1
20 6197 1 1 7 HIS O O 7.579 0.928 2.350 1.00 . A A . 7 HIS O 1 1
20 6198 1 1 8 SER C C 10.888 -1.016 2.806 1.00 . A A . 8 SER C 1 1
20 6199 1 1 8 SER CA C 9.739 -0.336 3.544 1.00 . A A . 8 SER CA 1 1
20 6200 1 1 8 SER CB C 9.978 -0.400 5.054 1.00 . A A . 8 SER CB 1 1
20 6201 1 1 8 SER H H 8.325 -1.904 3.408 1.00 . A A . 8 SER H 1 1
20 6202 1 1 8 SER HA H 9.695 0.700 3.240 1.00 . A A . 8 SER HA 1 1
20 6203 1 1 8 SER HB2 H 9.182 0.120 5.564 1.00 . A A . 8 SER HB2 1 1
20 6204 1 1 8 SER HB3 H 9.995 -1.432 5.368 1.00 . A A . 8 SER HB3 1 1
20 6205 1 1 8 SER HG H 11.925 -0.222 4.920 1.00 . A A . 8 SER HG 1 1
20 6206 1 1 8 SER N N 8.464 -0.955 3.207 1.00 . A A . 8 SER N 1 1
20 6207 1 1 8 SER O O 10.997 -2.242 2.806 1.00 . A A . 8 SER O 1 1
20 6208 1 1 8 SER OG O 11.213 0.204 5.402 1.00 . A A . 8 SER OG 1 1
20 6209 1 1 9 GLY C C 13.857 0.315 1.030 1.00 . A A . 9 GLY C 1 1
20 6210 1 1 9 GLY CA C 12.867 -0.755 1.443 1.00 . A A . 9 GLY CA 1 1
20 6211 1 1 9 GLY H H 11.600 0.757 2.211 1.00 . A A . 9 GLY H 1 1
20 6212 1 1 9 GLY HA2 H 13.373 -1.477 2.066 1.00 . A A . 9 GLY HA2 1 1
20 6213 1 1 9 GLY HA3 H 12.501 -1.253 0.557 1.00 . A A . 9 GLY HA3 1 1
20 6214 1 1 9 GLY N N 11.739 -0.212 2.176 1.00 . A A . 9 GLY N 1 1
20 6215 1 1 9 GLY O O 13.682 1.490 1.349 1.00 . A A . 9 GLY O 1 1
20 6216 1 1 10 TYR C C 15.436 1.638 -1.345 1.00 . A A . 10 TYR C 1 1
20 6217 1 1 10 TYR CA C 15.927 0.841 -0.140 1.00 . A A . 10 TYR CA 1 1
20 6218 1 1 10 TYR CB C 17.208 0.087 -0.500 1.00 . A A . 10 TYR CB 1 1
20 6219 1 1 10 TYR CD1 C 17.504 -1.932 0.986 1.00 . A A . 10 TYR CD1 1 1
20 6220 1 1 10 TYR CD2 C 18.785 0.019 1.471 1.00 . A A . 10 TYR CD2 1 1
20 6221 1 1 10 TYR CE1 C 18.081 -2.583 2.060 1.00 . A A . 10 TYR CE1 1 1
20 6222 1 1 10 TYR CE2 C 19.368 -0.626 2.546 1.00 . A A . 10 TYR CE2 1 1
20 6223 1 1 10 TYR CG C 17.844 -0.622 0.675 1.00 . A A . 10 TYR CG 1 1
20 6224 1 1 10 TYR CZ C 19.012 -1.927 2.836 1.00 . A A . 10 TYR CZ 1 1
20 6225 1 1 10 TYR H H 14.989 -1.043 0.094 1.00 . A A . 10 TYR H 1 1
20 6226 1 1 10 TYR HA H 16.136 1.524 0.667 1.00 . A A . 10 TYR HA 1 1
20 6227 1 1 10 TYR HB2 H 16.983 -0.654 -1.253 1.00 . A A . 10 TYR HB2 1 1
20 6228 1 1 10 TYR HB3 H 17.929 0.787 -0.896 1.00 . A A . 10 TYR HB3 1 1
20 6229 1 1 10 TYR HD1 H 16.773 -2.444 0.376 1.00 . A A . 10 TYR HD1 1 1
20 6230 1 1 10 TYR HD2 H 19.060 1.037 1.243 1.00 . A A . 10 TYR HD2 1 1
20 6231 1 1 10 TYR HE1 H 17.802 -3.602 2.286 1.00 . A A . 10 TYR HE1 1 1
20 6232 1 1 10 TYR HE2 H 20.097 -0.111 3.153 1.00 . A A . 10 TYR HE2 1 1
20 6233 1 1 10 TYR HH H 20.530 -2.376 3.926 1.00 . A A . 10 TYR HH 1 1
20 6234 1 1 10 TYR N N 14.903 -0.093 0.317 1.00 . A A . 10 TYR N 1 1
20 6235 1 1 10 TYR O O 15.956 2.752 -1.567 1.00 . A A . 10 TYR O 1 1
20 6236 1 1 10 TYR OH O 19.590 -2.572 3.904 1.00 . A A . 10 TYR OH 1 1
20 6237 1 1 11 NH2 HN1 H 14.096 0.202 -1.875 1.00 . A A . 11 NH2 HN1 1 1
20 6238 1 1 11 NH2 HN2 H 14.135 1.613 -2.908 1.00 . A A . 11 NH2 HN2 1 1
20 6239 1 1 11 NH2 N N 14.479 1.108 -2.104 1.00 . A A . 11 NH2 N 1 1
20 6240 2 1 1 ASP C C -0.349 -5.766 -0.478 1.00 . B B . 1 ASP C 1 1
20 6241 2 1 1 ASP CA C -0.442 -6.613 0.783 1.00 . B B . 1 ASP CA 1 1
20 6242 2 1 1 ASP CB C -1.544 -6.074 1.698 1.00 . B B . 1 ASP CB 1 1
20 6243 2 1 1 ASP CG C -1.481 -6.659 3.095 1.00 . B B . 1 ASP CG 1 1
20 6244 2 1 1 ASP H1 H 0.796 -7.366 2.244 1.00 . B B . 1 ASP H1 1 1
20 6245 2 1 1 ASP H2 H 0.950 -5.677 1.975 1.00 . B B . 1 ASP H2 1 1
20 6246 2 1 1 ASP H3 H 1.607 -6.792 0.846 1.00 . B B . 1 ASP H3 1 1
20 6247 2 1 1 ASP HA H -0.681 -7.627 0.504 1.00 . B B . 1 ASP HA 1 1
20 6248 2 1 1 ASP HB2 H -1.453 -5.000 1.771 1.00 . B B . 1 ASP HB2 1 1
20 6249 2 1 1 ASP HB3 H -2.503 -6.320 1.269 1.00 . B B . 1 ASP HB3 1 1
20 6250 2 1 1 ASP N N 0.844 -6.611 1.530 1.00 . B B . 1 ASP N 1 1
20 6251 2 1 1 ASP O O 0.736 -5.351 -0.882 1.00 . B B . 1 ASP O 1 1
20 6252 2 1 1 ASP OD1 O -1.023 -7.813 3.235 1.00 . B B . 1 ASP OD1 1 1
20 6253 2 1 1 ASP OD2 O -1.891 -5.966 4.049 1.00 . B B . 1 ASP OD2 1 1
20 6254 2 1 2 ALA C C -2.253 -3.389 -2.077 1.00 . B B . 2 ALA C 1 1
20 6255 2 1 2 ALA CA C -1.555 -4.725 -2.319 1.00 . B B . 2 ALA CA 1 1
20 6256 2 1 2 ALA CB C -2.264 -5.501 -3.418 1.00 . B B . 2 ALA CB 1 1
20 6257 2 1 2 ALA H H -2.325 -5.886 -0.723 1.00 . B B . 2 ALA H 1 1
20 6258 2 1 2 ALA HA H -0.540 -4.534 -2.642 1.00 . B B . 2 ALA HA 1 1
20 6259 2 1 2 ALA HB1 H -2.629 -6.435 -3.017 1.00 . B B . 2 ALA HB1 1 1
20 6260 2 1 2 ALA HB2 H -1.571 -5.701 -4.222 1.00 . B B . 2 ALA HB2 1 1
20 6261 2 1 2 ALA HB3 H -3.092 -4.921 -3.792 1.00 . B B . 2 ALA HB3 1 1
20 6262 2 1 2 ALA N N -1.496 -5.520 -1.098 1.00 . B B . 2 ALA N 1 1
20 6263 2 1 2 ALA O O -2.767 -3.132 -0.988 1.00 . B B . 2 ALA O 1 1
20 6264 2 1 3 GLU C C -4.336 -1.325 -2.549 1.00 . B B . 3 GLU C 1 1
20 6265 2 1 3 GLU CA C -2.887 -1.228 -3.018 1.00 . B B . 3 GLU CA 1 1
20 6266 2 1 3 GLU CB C -2.828 -0.526 -4.375 1.00 . B B . 3 GLU CB 1 1
20 6267 2 1 3 GLU CD C -2.061 1.845 -4.791 1.00 . B B . 3 GLU CD 1 1
20 6268 2 1 3 GLU CG C -3.185 0.949 -4.311 1.00 . B B . 3 GLU CG 1 1
20 6269 2 1 3 GLU H H -1.832 -2.812 -3.943 1.00 . B B . 3 GLU H 1 1
20 6270 2 1 3 GLU HA H -2.331 -0.646 -2.301 1.00 . B B . 3 GLU HA 1 1
20 6271 2 1 3 GLU HB2 H -1.827 -0.616 -4.770 1.00 . B B . 3 GLU HB2 1 1
20 6272 2 1 3 GLU HB3 H -3.519 -1.012 -5.049 1.00 . B B . 3 GLU HB3 1 1
20 6273 2 1 3 GLU HG2 H -4.053 1.126 -4.929 1.00 . B B . 3 GLU HG2 1 1
20 6274 2 1 3 GLU HG3 H -3.416 1.207 -3.286 1.00 . B B . 3 GLU HG3 1 1
20 6275 2 1 3 GLU N N -2.262 -2.545 -3.104 1.00 . B B . 3 GLU N 1 1
20 6276 2 1 3 GLU O O -4.820 -0.456 -1.825 1.00 . B B . 3 GLU O 1 1
20 6277 2 1 3 GLU OE1 O -1.271 2.309 -3.944 1.00 . B B . 3 GLU OE1 1 1
20 6278 2 1 3 GLU OE2 O -1.972 2.082 -6.014 1.00 . B B . 3 GLU OE2 1 1
20 6279 2 1 4 PHE C C -6.532 -2.902 -1.097 1.00 . B B . 4 PHE C 1 1
20 6280 2 1 4 PHE CA C -6.421 -2.564 -2.580 1.00 . B B . 4 PHE CA 1 1
20 6281 2 1 4 PHE CB C -7.081 -3.655 -3.431 1.00 . B B . 4 PHE CB 1 1
20 6282 2 1 4 PHE CD1 C -7.247 -5.850 -2.226 1.00 . B B . 4 PHE CD1 1 1
20 6283 2 1 4 PHE CD2 C -5.474 -5.548 -3.792 1.00 . B B . 4 PHE CD2 1 1
20 6284 2 1 4 PHE CE1 C -6.801 -7.132 -1.965 1.00 . B B . 4 PHE CE1 1 1
20 6285 2 1 4 PHE CE2 C -5.024 -6.830 -3.534 1.00 . B B . 4 PHE CE2 1 1
20 6286 2 1 4 PHE CG C -6.589 -5.045 -3.143 1.00 . B B . 4 PHE CG 1 1
20 6287 2 1 4 PHE CZ C -5.689 -7.622 -2.619 1.00 . B B . 4 PHE CZ 1 1
20 6288 2 1 4 PHE H H -4.595 -3.041 -3.539 1.00 . B B . 4 PHE H 1 1
20 6289 2 1 4 PHE HA H -6.933 -1.630 -2.754 1.00 . B B . 4 PHE HA 1 1
20 6290 2 1 4 PHE HB2 H -8.147 -3.640 -3.253 1.00 . B B . 4 PHE HB2 1 1
20 6291 2 1 4 PHE HB3 H -6.894 -3.445 -4.473 1.00 . B B . 4 PHE HB3 1 1
20 6292 2 1 4 PHE HD1 H -8.117 -5.469 -1.714 1.00 . B B . 4 PHE HD1 1 1
20 6293 2 1 4 PHE HD2 H -4.952 -4.929 -4.507 1.00 . B B . 4 PHE HD2 1 1
20 6294 2 1 4 PHE HE1 H -7.324 -7.750 -1.249 1.00 . B B . 4 PHE HE1 1 1
20 6295 2 1 4 PHE HE2 H -4.153 -7.210 -4.046 1.00 . B B . 4 PHE HE2 1 1
20 6296 2 1 4 PHE HZ H -5.339 -8.624 -2.417 1.00 . B B . 4 PHE HZ 1 1
20 6297 2 1 4 PHE N N -5.027 -2.380 -2.964 1.00 . B B . 4 PHE N 1 1
20 6298 2 1 4 PHE O O -7.517 -2.555 -0.445 1.00 . B B . 4 PHE O 1 1
20 6299 2 1 5 ARG C C -5.134 -2.741 1.706 1.00 . B B . 5 ARG C 1 1
20 6300 2 1 5 ARG CA C -5.501 -3.939 0.843 1.00 . B B . 5 ARG CA 1 1
20 6301 2 1 5 ARG CB C -4.515 -5.076 1.094 1.00 . B B . 5 ARG CB 1 1
20 6302 2 1 5 ARG CD C -4.684 -7.569 1.374 1.00 . B B . 5 ARG CD 1 1
20 6303 2 1 5 ARG CG C -4.927 -6.386 0.450 1.00 . B B . 5 ARG CG 1 1
20 6304 2 1 5 ARG CZ C -5.828 -9.681 1.925 1.00 . B B . 5 ARG CZ 1 1
20 6305 2 1 5 ARG H H -4.751 -3.813 -1.136 1.00 . B B . 5 ARG H 1 1
20 6306 2 1 5 ARG HA H -6.494 -4.269 1.108 1.00 . B B . 5 ARG HA 1 1
20 6307 2 1 5 ARG HB2 H -3.551 -4.791 0.699 1.00 . B B . 5 ARG HB2 1 1
20 6308 2 1 5 ARG HB3 H -4.426 -5.233 2.158 1.00 . B B . 5 ARG HB3 1 1
20 6309 2 1 5 ARG HD2 H -3.662 -7.899 1.258 1.00 . B B . 5 ARG HD2 1 1
20 6310 2 1 5 ARG HD3 H -4.846 -7.251 2.394 1.00 . B B . 5 ARG HD3 1 1
20 6311 2 1 5 ARG HE H -6.016 -8.695 0.201 1.00 . B B . 5 ARG HE 1 1
20 6312 2 1 5 ARG HG2 H -5.976 -6.340 0.209 1.00 . B B . 5 ARG HG2 1 1
20 6313 2 1 5 ARG HG3 H -4.353 -6.524 -0.456 1.00 . B B . 5 ARG HG3 1 1
20 6314 2 1 5 ARG HH11 H -4.629 -8.972 3.392 1.00 . B B . 5 ARG HH11 1 1
20 6315 2 1 5 ARG HH12 H -5.445 -10.456 3.753 1.00 . B B . 5 ARG HH12 1 1
20 6316 2 1 5 ARG HH21 H -7.091 -10.644 0.675 1.00 . B B . 5 ARG HH21 1 1
20 6317 2 1 5 ARG HH22 H -6.843 -11.406 2.211 1.00 . B B . 5 ARG HH22 1 1
20 6318 2 1 5 ARG N N -5.513 -3.571 -0.567 1.00 . B B . 5 ARG N 1 1
20 6319 2 1 5 ARG NE N -5.578 -8.687 1.078 1.00 . B B . 5 ARG NE 1 1
20 6320 2 1 5 ARG NH1 N -5.253 -9.705 3.122 1.00 . B B . 5 ARG NH1 1 1
20 6321 2 1 5 ARG NH2 N -6.656 -10.657 1.575 1.00 . B B . 5 ARG NH2 1 1
20 6322 2 1 5 ARG O O -5.732 -2.511 2.758 1.00 . B B . 5 ARG O 1 1
20 6323 2 1 6 HIS C C -4.808 0.253 2.014 1.00 . B B . 6 HIS C 1 1
20 6324 2 1 6 HIS CA C -3.704 -0.793 1.977 1.00 . B B . 6 HIS CA 1 1
20 6325 2 1 6 HIS CB C -2.463 -0.187 1.320 1.00 . B B . 6 HIS CB 1 1
20 6326 2 1 6 HIS CD2 C -0.791 -1.577 -0.068 1.00 . B B . 6 HIS CD2 1 1
20 6327 2 1 6 HIS CE1 C 0.270 -2.579 1.524 1.00 . B B . 6 HIS CE1 1 1
20 6328 2 1 6 HIS CG C -1.347 -1.158 1.093 1.00 . B B . 6 HIS CG 1 1
20 6329 2 1 6 HIS H H -3.719 -2.213 0.399 1.00 . B B . 6 HIS H 1 1
20 6330 2 1 6 HIS HA H -3.464 -1.090 2.987 1.00 . B B . 6 HIS HA 1 1
20 6331 2 1 6 HIS HB2 H -2.742 0.220 0.360 1.00 . B B . 6 HIS HB2 1 1
20 6332 2 1 6 HIS HB3 H -2.088 0.610 1.946 1.00 . B B . 6 HIS HB3 1 1
20 6333 2 1 6 HIS HD1 H -0.828 -1.715 3.060 1.00 . B B . 6 HIS HD1 1 1
20 6334 2 1 6 HIS HD2 H -1.083 -1.264 -1.059 1.00 . B B . 6 HIS HD2 1 1
20 6335 2 1 6 HIS HE1 H 0.972 -3.199 2.065 1.00 . B B . 6 HIS HE1 1 1
20 6336 2 1 6 HIS N N -4.150 -1.977 1.248 1.00 . B B . 6 HIS N 1 1
20 6337 2 1 6 HIS ND1 N -0.663 -1.805 2.098 1.00 . B B . 6 HIS ND1 1 1
20 6338 2 1 6 HIS NE2 N 0.229 -2.475 0.211 1.00 . B B . 6 HIS NE2 1 1
20 6339 2 1 6 HIS O O -5.018 0.922 3.025 1.00 . B B . 6 HIS O 1 1
20 6340 2 1 7 HIS C C -7.941 0.695 0.991 1.00 . B B . 7 HIS C 1 1
20 6341 2 1 7 HIS CA C -6.586 1.357 0.770 1.00 . B B . 7 HIS CA 1 1
20 6342 2 1 7 HIS CB C -6.542 2.016 -0.610 1.00 . B B . 7 HIS CB 1 1
20 6343 2 1 7 HIS CD2 C -4.013 2.321 -1.094 1.00 . B B . 7 HIS CD2 1 1
20 6344 2 1 7 HIS CE1 C -3.931 4.480 -1.183 1.00 . B B . 7 HIS CE1 1 1
20 6345 2 1 7 HIS CG C -5.277 2.772 -0.873 1.00 . B B . 7 HIS CG 1 1
20 6346 2 1 7 HIS H H -5.278 -0.173 0.122 1.00 . B B . 7 HIS H 1 1
20 6347 2 1 7 HIS HA H -6.440 2.115 1.524 1.00 . B B . 7 HIS HA 1 1
20 6348 2 1 7 HIS HB2 H -6.637 1.253 -1.368 1.00 . B B . 7 HIS HB2 1 1
20 6349 2 1 7 HIS HB3 H -7.368 2.707 -0.697 1.00 . B B . 7 HIS HB3 1 1
20 6350 2 1 7 HIS HD1 H -5.951 4.769 -0.813 1.00 . B B . 7 HIS HD1 1 1
20 6351 2 1 7 HIS HD2 H -3.701 1.287 -1.115 1.00 . B B . 7 HIS HD2 1 1
20 6352 2 1 7 HIS HE1 H -3.575 5.494 -1.284 1.00 . B B . 7 HIS HE1 1 1
20 6353 2 1 7 HIS N N -5.504 0.389 0.892 1.00 . B B . 7 HIS N 1 1
20 6354 2 1 7 HIS ND1 N -5.204 4.146 -0.933 1.00 . B B . 7 HIS ND1 1 1
20 6355 2 1 7 HIS NE2 N -3.169 3.409 -1.289 1.00 . B B . 7 HIS NE2 1 1
20 6356 2 1 7 HIS O O -8.239 -0.345 0.403 1.00 . B B . 7 HIS O 1 1
20 6357 2 1 8 SER C C -11.074 1.129 1.030 1.00 . B B . 8 SER C 1 1
20 6358 2 1 8 SER CA C -10.088 0.777 2.137 1.00 . B B . 8 SER CA 1 1
20 6359 2 1 8 SER CB C -10.589 1.323 3.476 1.00 . B B . 8 SER CB 1 1
20 6360 2 1 8 SER H H -8.468 2.133 2.276 1.00 . B B . 8 SER H 1 1
20 6361 2 1 8 SER HA H -10.008 -0.297 2.204 1.00 . B B . 8 SER HA 1 1
20 6362 2 1 8 SER HB2 H -10.433 2.391 3.509 1.00 . B B . 8 SER HB2 1 1
20 6363 2 1 8 SER HB3 H -11.644 1.110 3.575 1.00 . B B . 8 SER HB3 1 1
20 6364 2 1 8 SER HG H -9.548 1.414 5.133 1.00 . B B . 8 SER HG 1 1
20 6365 2 1 8 SER N N -8.761 1.306 1.840 1.00 . B B . 8 SER N 1 1
20 6366 2 1 8 SER O O -10.822 2.022 0.221 1.00 . B B . 8 SER O 1 1
20 6367 2 1 8 SER OG O -9.898 0.728 4.561 1.00 . B B . 8 SER OG 1 1
20 6368 2 1 9 GLY C C -14.151 -0.497 -0.200 1.00 . B B . 9 GLY C 1 1
20 6369 2 1 9 GLY CA C -13.206 0.674 -0.016 1.00 . B B . 9 GLY CA 1 1
20 6370 2 1 9 GLY H H -12.345 -0.279 1.668 1.00 . B B . 9 GLY H 1 1
20 6371 2 1 9 GLY HA2 H -13.779 1.543 0.271 1.00 . B B . 9 GLY HA2 1 1
20 6372 2 1 9 GLY HA3 H -12.712 0.875 -0.955 1.00 . B B . 9 GLY HA3 1 1
20 6373 2 1 9 GLY N N -12.198 0.422 0.997 1.00 . B B . 9 GLY N 1 1
20 6374 2 1 9 GLY O O -14.487 -0.862 -1.326 1.00 . B B . 9 GLY O 1 1
20 6375 2 1 10 TYR C C -16.906 -1.802 1.255 1.00 . B B . 10 TYR C 1 1
20 6376 2 1 10 TYR CA C -15.493 -2.224 0.869 1.00 . B B . 10 TYR CA 1 1
20 6377 2 1 10 TYR CB C -15.004 -3.329 1.807 1.00 . B B . 10 TYR CB 1 1
20 6378 2 1 10 TYR CD1 C -13.652 -2.356 3.704 1.00 . B B . 10 TYR CD1 1 1
20 6379 2 1 10 TYR CD2 C -15.912 -2.986 4.138 1.00 . B B . 10 TYR CD2 1 1
20 6380 2 1 10 TYR CE1 C -13.511 -1.946 5.016 1.00 . B B . 10 TYR CE1 1 1
20 6381 2 1 10 TYR CE2 C -15.777 -2.577 5.452 1.00 . B B . 10 TYR CE2 1 1
20 6382 2 1 10 TYR CG C -14.853 -2.882 3.244 1.00 . B B . 10 TYR CG 1 1
20 6383 2 1 10 TYR CZ C -14.575 -2.059 5.886 1.00 . B B . 10 TYR CZ 1 1
20 6384 2 1 10 TYR H H -14.278 -0.750 1.779 1.00 . B B . 10 TYR H 1 1
20 6385 2 1 10 TYR HA H -15.505 -2.602 -0.143 1.00 . B B . 10 TYR HA 1 1
20 6386 2 1 10 TYR HB2 H -15.710 -4.147 1.786 1.00 . B B . 10 TYR HB2 1 1
20 6387 2 1 10 TYR HB3 H -14.042 -3.682 1.466 1.00 . B B . 10 TYR HB3 1 1
20 6388 2 1 10 TYR HD1 H -12.821 -2.270 3.021 1.00 . B B . 10 TYR HD1 1 1
20 6389 2 1 10 TYR HD2 H -16.851 -3.392 3.796 1.00 . B B . 10 TYR HD2 1 1
20 6390 2 1 10 TYR HE1 H -12.569 -1.539 5.356 1.00 . B B . 10 TYR HE1 1 1
20 6391 2 1 10 TYR HE2 H -16.610 -2.664 6.132 1.00 . B B . 10 TYR HE2 1 1
20 6392 2 1 10 TYR HH H -14.042 -2.358 7.708 1.00 . B B . 10 TYR HH 1 1
20 6393 2 1 10 TYR N N -14.581 -1.086 0.910 1.00 . B B . 10 TYR N 1 1
20 6394 2 1 10 TYR O O -17.859 -2.231 0.571 1.00 . B B . 10 TYR O 1 1
20 6395 2 1 10 TYR OH O -14.437 -1.652 7.193 1.00 . B B . 10 TYR OH 1 1
20 6396 2 1 11 NH2 HN1 H -16.253 -0.679 2.820 1.00 . B B . 11 NH2 HN1 1 1
20 6397 2 1 11 NH2 HN2 H -17.986 -0.700 2.581 1.00 . B B . 11 NH2 HN2 1 1
20 6398 2 1 11 NH2 N N -17.061 -0.995 2.303 1.00 . B B . 11 NH2 N 1 1
20 6399 3 2 1 ZN ZN ZN 1.603 -3.506 -0.931 1.00 . C A . 101 ZN ZN 1 1
20 6400 4 2 1 ZN ZN ZN -1.370 3.267 -2.231 1.00 . D A . 102 ZN ZN 1 1
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