NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
629902 |
5v2b   |
30265 | cing | 4-filtered-FRED | STAR | entry | full | 211 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5v2b
# This FRED archive file contains, for PDB entry <5v2b>:
#
# - 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_5v2b
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 5v2b
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 2407.56
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 $Thrombospondin_related_sporozoite_protein A . 1 1
stop_
save_
save_Thrombospondin_related_sporozoite_protein
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Thrombospondin related sporozoite protein"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code SDTRYNKSFINNKHLNEHAH
_Entity.Number_of_monomers 20
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 SER . 1 1
2 ASP . 1 1
3 THR . 1 1
4 ARG . 1 1
5 TYR . 1 1
6 ASN . 1 1
7 LYS . 1 1
8 SER . 1 1
9 PHE . 1 1
10 ILE . 1 1
11 ASN . 1 1
12 ASN . 1 1
13 LYS . 1 1
14 HIS . 1 1
15 LEU . 1 1
16 ASN . 1 1
17 GLU . 1 1
18 HIS . 1 1
19 ALA . 1 1
20 HIS . 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
SER 1 1 1 1
ASP 2 2 1 1
THR 3 3 1 1
ARG 4 4 1 1
TYR 5 5 1 1
ASN 6 6 1 1
LYS 7 7 1 1
SER 8 8 1 1
PHE 9 9 1 1
ILE 10 10 1 1
ASN 11 11 1 1
ASN 12 12 1 1
LYS 13 13 1 1
HIS 14 14 1 1
LEU 15 15 1 1
ASN 16 16 1 1
GLU 17 17 1 1
HIS 18 18 1 1
ALA 19 19 1 1
HIS 20 20 1 1
stop_
save_
save_Discover_distance_constraints_5_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
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40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
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70 1 . . . 1 1
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72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
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78 1 . . . 1 1
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80 1 . . . 1 1
81 1 . . . 1 1
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84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
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127 1 . . . 1 1
128 1 . . . 1 1
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131 1 . . . 1 1
132 1 . . . 1 1
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134 1 . . . 1 1
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137 1 . . . 1 1
138 1 . . . 1 1
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140 1 . . . 1 1
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142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
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148 1 . . . 1 1
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150 1 . . . 1 1
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155 1 . . . 1 1
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157 1 . . . 1 1
158 1 . . . 1 1
159 1 . . . 1 1
160 1 . . . 1 1
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162 1 . . . 1 1
163 1 . . . 1 1
164 1 . . . 1 1
165 1 . . . 1 1
166 1 . . . 1 1
167 1 . . . 1 1
168 1 . . . 1 1
169 1 . . . 1 1
170 1 . . . 1 1
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172 1 . . . 1 1
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174 1 . . . 1 1
175 1 . . . 1 1
176 1 . . . 1 1
177 1 . . . 1 1
178 1 . . . 1 1
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180 1 . . . 1 1
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182 1 . . . 1 1
183 1 . . . 1 1
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185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 1 . . . 1 1
189 1 . . . 1 1
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 ASP H 1 2 ASP HN 1 1
1 1 2 1 1 2 ASP HA 1 2 ASP HA 1 1
2 1 1 1 1 3 THR H 1 3 THR HN 1 1
2 1 2 1 1 3 THR HA 1 3 THR HA 1 1
3 1 1 1 1 4 ARG H 1 4 ARG HN 1 1
3 1 2 1 1 4 ARG HA 1 4 ARG HA 1 1
4 1 1 1 1 5 TYR H 1 5 TYR HN 1 1
4 1 2 1 1 5 TYR HA 1 5 TYR HA 1 1
5 1 1 1 1 6 ASN H 1 6 ASN HN 1 1
5 1 2 1 1 6 ASN HA 1 6 ASN HA 1 1
6 1 1 1 1 7 LYS H 1 7 LYS HN 1 1
6 1 2 1 1 7 LYS HA 1 7 LYS HA 1 1
7 1 1 1 1 8 SER H 1 8 SER HN 1 1
7 1 2 1 1 8 SER HA 1 8 SER HA 1 1
8 1 1 1 1 9 PHE H 1 9 PHE HN 1 1
8 1 2 1 1 9 PHE HA 1 9 PHE HA 1 1
9 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
9 1 2 1 1 10 ILE HA 1 10 ILE HA 1 1
10 1 1 1 1 11 ASN H 1 11 ASN HN 1 1
10 1 2 1 1 11 ASN HA 1 11 ASN HA 1 1
11 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
11 1 2 1 1 12 ASN HA 1 12 ASN HA 1 1
12 1 1 1 1 13 LYS H 1 13 LYS HN 1 1
12 1 2 1 1 13 LYS HA 1 13 LYS HA 1 1
13 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
13 1 2 1 1 14 HIS HA 1 14 HIS HA 1 1
14 1 1 1 1 15 LEU H 1 15 LEU HN 1 1
14 1 2 1 1 15 LEU HA 1 15 LEU HA 1 1
15 1 1 1 1 16 ASN H 1 16 ASN HN 1 1
15 1 2 1 1 16 ASN HA 1 16 ASN HA 1 1
16 1 1 1 1 17 GLU H 1 17 GLU HN 1 1
16 1 2 1 1 17 GLU HA 1 17 GLU HA 1 1
17 1 1 1 1 18 HIS H 1 18 HIS HN 1 1
17 1 2 1 1 18 HIS HA 1 18 HIS HA 1 1
18 1 1 1 1 19 ALA H 1 19 ALA HN 1 1
18 1 2 1 1 19 ALA HA 1 19 ALA HA 1 1
19 1 1 1 1 20 HIS H 1 20 HIS HN 1 1
19 1 2 1 1 20 HIS HA 1 20 HIS HA 1 1
20 1 1 1 1 1 SER HA 1 1 SER HA 1 1
20 1 2 1 1 1 SER HB2 1 1 SER HBS 1 1
21 1 1 1 1 1 SER HA 1 1 SER HA 1 1
21 1 2 1 1 1 SER HB3 1 1 SER HBR 1 1
22 1 1 1 1 2 ASP H 1 2 ASP HN 1 1
22 1 2 1 1 2 ASP HB3 1 2 ASP HBR 1 1
23 1 1 1 1 2 ASP H 1 2 ASP HN 1 1
23 1 2 1 1 2 ASP HB2 1 2 ASP HBS 1 1
24 1 1 1 1 2 ASP HA 1 2 ASP HA 1 1
24 1 2 1 1 2 ASP HB3 1 2 ASP HBR 1 1
25 1 1 1 1 2 ASP HA 1 2 ASP HA 1 1
25 1 2 1 1 2 ASP HB2 1 2 ASP HBS 1 1
26 1 1 1 1 3 THR H 1 3 THR HN 1 1
26 1 2 1 1 3 THR HB 1 3 THR HB 1 1
27 1 1 1 1 3 THR H 1 3 THR HN 1 1
27 1 2 1 1 3 THR MG 1 3 THR HG2* 1 1
28 1 1 1 1 3 THR HA 1 3 THR HA 1 1
28 1 2 1 1 3 THR HB 1 3 THR HB 1 1
29 1 1 1 1 3 THR HA 1 3 THR HA 1 1
29 1 2 1 1 3 THR MG 1 3 THR HG2* 1 1
30 1 1 1 1 4 ARG H 1 4 ARG HN 1 1
30 1 2 1 1 4 ARG QB 1 4 ARG HB* 1 1
31 1 1 1 1 4 ARG H 1 4 ARG HN 1 1
31 1 2 1 1 4 ARG QG 1 4 ARG HG* 1 1
32 1 1 1 1 4 ARG H 1 4 ARG HN 1 1
32 1 2 1 1 4 ARG QD 1 4 ARG HD* 1 1
33 1 1 1 1 4 ARG HA 1 4 ARG HA 1 1
33 1 2 1 1 4 ARG QD 1 4 ARG HD* 1 1
34 1 1 1 1 4 ARG HA 1 4 ARG HA 1 1
34 1 2 1 1 4 ARG QG 1 4 ARG HG* 1 1
35 1 1 1 1 4 ARG QB 1 4 ARG HB* 1 1
35 1 2 1 1 4 ARG QD 1 4 ARG HD* 1 1
36 1 1 1 1 4 ARG QG 1 4 ARG HG* 1 1
36 1 2 1 1 4 ARG QH 1 4 ARG HH* 1 1
37 1 1 1 1 4 ARG QD 1 4 ARG HD* 1 1
37 1 2 1 1 4 ARG QH 1 4 ARG HH* 1 1
38 1 1 1 1 5 TYR H 1 5 TYR HN 1 1
38 1 2 1 1 5 TYR HB2 1 5 TYR HBR 1 1
39 1 1 1 1 5 TYR H 1 5 TYR HN 1 1
39 1 2 1 1 5 TYR HB3 1 5 TYR HBS 1 1
40 1 1 1 1 5 TYR HA 1 5 TYR HA 1 1
40 1 2 1 1 5 TYR HB2 1 5 TYR HBR 1 1
41 1 1 1 1 5 TYR HA 1 5 TYR HA 1 1
41 1 2 1 1 5 TYR HB3 1 5 TYR HBS 1 1
42 1 1 1 1 5 TYR HB3 1 5 TYR HBS 1 1
42 1 2 1 1 5 TYR QD 1 5 TYR HD* 1 1
43 1 1 1 1 5 TYR HB2 1 5 TYR HBR 1 1
43 1 2 1 1 5 TYR QD 1 5 TYR HD* 1 1
44 1 1 1 1 5 TYR HA 1 5 TYR HA 1 1
44 1 2 1 1 5 TYR QD 1 5 TYR HD* 1 1
45 1 1 1 1 6 ASN H 1 6 ASN HN 1 1
45 1 2 1 1 6 ASN HB2 1 6 ASN HBS 1 1
46 1 1 1 1 6 ASN H 1 6 ASN HN 1 1
46 1 2 1 1 6 ASN HB3 1 6 ASN HBR 1 1
47 1 1 1 1 6 ASN HA 1 6 ASN HA 1 1
47 1 2 1 1 6 ASN HB2 1 6 ASN HBS 1 1
48 1 1 1 1 6 ASN HA 1 6 ASN HA 1 1
48 1 2 1 1 6 ASN HB3 1 6 ASN HBR 1 1
49 1 1 1 1 7 LYS H 1 7 LYS HN 1 1
49 1 2 1 1 7 LYS QB 1 7 LYS HB* 1 1
50 1 1 1 1 7 LYS H 1 7 LYS HN 1 1
50 1 2 1 1 7 LYS QG 1 7 LYS HG* 1 1
51 1 1 1 1 7 LYS H 1 7 LYS HN 1 1
51 1 2 1 1 7 LYS QD 1 7 LYS HD* 1 1
52 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
52 1 2 1 1 7 LYS QG 1 7 LYS HG* 1 1
53 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
53 1 2 1 1 7 LYS QD 1 7 LYS HD* 1 1
54 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
54 1 2 1 1 7 LYS QE 1 7 LYS HE* 1 1
55 1 1 1 1 8 SER HA 1 8 SER HA 1 1
55 1 2 1 1 8 SER HB2 1 8 SER HBS 1 1
56 1 1 1 1 8 SER HA 1 8 SER HA 1 1
56 1 2 1 1 8 SER HB3 1 8 SER HBR 1 1
57 1 1 1 1 8 SER H 1 8 SER HN 1 1
57 1 2 1 1 8 SER HB3 1 8 SER HBR 1 1
58 1 1 1 1 8 SER H 1 8 SER HN 1 1
58 1 2 1 1 8 SER HB2 1 8 SER HBS 1 1
59 1 1 1 1 9 PHE H 1 9 PHE HN 1 1
59 1 2 1 1 9 PHE HB2 1 9 PHE HBR 1 1
60 1 1 1 1 9 PHE H 1 9 PHE HN 1 1
60 1 2 1 1 9 PHE HB3 1 9 PHE HBS 1 1
61 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1
61 1 2 1 1 9 PHE HB2 1 9 PHE HBR 1 1
62 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1
62 1 2 1 1 9 PHE HB3 1 9 PHE HBS 1 1
63 1 1 1 1 9 PHE HB3 1 9 PHE HBS 1 1
63 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1
64 1 1 1 1 9 PHE HB2 1 9 PHE HBR 1 1
64 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1
65 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1
65 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1
66 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
66 1 2 1 1 10 ILE HB 1 10 ILE HB 1 1
67 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
67 1 2 1 1 10 ILE HG12 1 10 ILE HG1R 1 1
68 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
68 1 2 1 1 10 ILE HG13 1 10 ILE HG1S 1 1
69 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
69 1 2 1 1 10 ILE MD 1 10 ILE HD1* 1 1
70 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
70 1 2 1 1 10 ILE HB 1 10 ILE HB 1 1
71 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
71 1 2 1 1 10 ILE HG12 1 10 ILE HG1R 1 1
72 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
72 1 2 1 1 10 ILE HG13 1 10 ILE HG1S 1 1
73 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
73 1 2 1 1 10 ILE MD 1 10 ILE HD1* 1 1
74 1 1 1 1 10 ILE HB 1 10 ILE HB 1 1
74 1 2 1 1 10 ILE HG12 1 10 ILE HG1R 1 1
75 1 1 1 1 10 ILE HB 1 10 ILE HB 1 1
75 1 2 1 1 10 ILE HG13 1 10 ILE HG1S 1 1
76 1 1 1 1 10 ILE HB 1 10 ILE HB 1 1
76 1 2 1 1 10 ILE MD 1 10 ILE HD1* 1 1
77 1 1 1 1 11 ASN H 1 11 ASN HN 1 1
77 1 2 1 1 11 ASN HB2 1 11 ASN HBS 1 1
78 1 1 1 1 11 ASN H 1 11 ASN HN 1 1
78 1 2 1 1 11 ASN HB3 1 11 ASN HBR 1 1
79 1 1 1 1 11 ASN HA 1 11 ASN HA 1 1
79 1 2 1 1 11 ASN HB2 1 11 ASN HBS 1 1
80 1 1 1 1 11 ASN HA 1 11 ASN HA 1 1
80 1 2 1 1 11 ASN HB3 1 11 ASN HBR 1 1
81 1 1 1 1 11 ASN HB3 1 11 ASN HBR 1 1
81 1 2 1 1 11 ASN HD22 1 11 ASN HD22 1 1
82 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
82 1 2 1 1 12 ASN HB2 1 12 ASN HBS 1 1
83 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
83 1 2 1 1 12 ASN HB3 1 12 ASN HBR 1 1
84 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
84 1 2 1 1 12 ASN HB2 1 12 ASN HBS 1 1
85 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
85 1 2 1 1 12 ASN HB3 1 12 ASN HBR 1 1
86 1 1 1 1 12 ASN HB3 1 12 ASN HBR 1 1
86 1 2 1 1 12 ASN HD22 1 12 ASN HD22 1 1
87 1 1 1 1 13 LYS H 1 13 LYS HN 1 1
87 1 2 1 1 13 LYS QB 1 13 LYS HB* 1 1
88 1 1 1 1 13 LYS H 1 13 LYS HN 1 1
88 1 2 1 1 13 LYS QG 1 13 LYS HG* 1 1
89 1 1 1 1 13 LYS H 1 13 LYS HN 1 1
89 1 2 1 1 13 LYS QD 1 13 LYS HD* 1 1
90 1 1 1 1 13 LYS HA 1 13 LYS HA 1 1
90 1 2 1 1 13 LYS QG 1 13 LYS HG* 1 1
91 1 1 1 1 13 LYS HA 1 13 LYS HA 1 1
91 1 2 1 1 13 LYS QD 1 13 LYS HD* 1 1
92 1 1 1 1 13 LYS HA 1 13 LYS HA 1 1
92 1 2 1 1 13 LYS QE 1 13 LYS HE* 1 1
93 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
93 1 2 1 1 14 HIS HB2 1 14 HIS HBS 1 1
94 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
94 1 2 1 1 14 HIS HB3 1 14 HIS HBR 1 1
95 1 1 1 1 14 HIS HB2 1 14 HIS HBS 1 1
95 1 2 1 1 14 HIS HD2 1 14 HIS HD2 1 1
96 1 1 1 1 14 HIS HB3 1 14 HIS HBR 1 1
96 1 2 1 1 14 HIS HD2 1 14 HIS HD2 1 1
97 1 1 1 1 15 LEU H 1 15 LEU HN 1 1
97 1 2 1 1 15 LEU QB 1 15 LEU HB* 1 1
98 1 1 1 1 15 LEU H 1 15 LEU HN 1 1
98 1 2 1 1 15 LEU HG 1 15 LEU HG 1 1
99 1 1 1 1 15 LEU H 1 15 LEU HN 1 1
99 1 2 1 1 15 LEU QD 1 15 LEU HDR* 1 1
100 1 1 1 1 15 LEU HA 1 15 LEU HA 1 1
100 1 2 1 1 15 LEU HG 1 15 LEU HG 1 1
101 1 1 1 1 15 LEU HA 1 15 LEU HA 1 1
101 1 2 1 1 15 LEU QD 1 15 LEU HDR* 1 1
102 1 1 1 1 15 LEU MD1 1 15 LEU HDR* 1 1
102 1 2 1 1 15 LEU MD2 1 15 LEU HDS* 1 1
103 1 1 1 1 16 ASN H 1 16 ASN HN 1 1
103 1 2 1 1 16 ASN HB2 1 16 ASN HBS 1 1
104 1 1 1 1 16 ASN H 1 16 ASN HN 1 1
104 1 2 1 1 16 ASN HB3 1 16 ASN HBR 1 1
105 1 1 1 1 16 ASN HA 1 16 ASN HA 1 1
105 1 2 1 1 16 ASN HB2 1 16 ASN HBS 1 1
106 1 1 1 1 16 ASN HA 1 16 ASN HA 1 1
106 1 2 1 1 16 ASN HB3 1 16 ASN HBR 1 1
107 1 1 1 1 16 ASN HB3 1 16 ASN HBR 1 1
107 1 2 1 1 16 ASN HD22 1 16 ASN HD22 1 1
108 1 1 1 1 17 GLU H 1 17 GLU HN 1 1
108 1 2 1 1 17 GLU HB2 1 17 GLU HBR 1 1
109 1 1 1 1 17 GLU H 1 17 GLU HN 1 1
109 1 2 1 1 17 GLU HB3 1 17 GLU HBS 1 1
110 1 1 1 1 17 GLU H 1 17 GLU HN 1 1
110 1 2 1 1 17 GLU HG2 1 17 GLU HGS 1 1
111 1 1 1 1 17 GLU H 1 17 GLU HN 1 1
111 1 2 1 1 17 GLU HG3 1 17 GLU HGR 1 1
112 1 1 1 1 17 GLU HA 1 17 GLU HA 1 1
112 1 2 1 1 17 GLU HB2 1 17 GLU HBR 1 1
113 1 1 1 1 17 GLU HA 1 17 GLU HA 1 1
113 1 2 1 1 17 GLU HB3 1 17 GLU HBS 1 1
114 1 1 1 1 17 GLU HA 1 17 GLU HA 1 1
114 1 2 1 1 17 GLU HG2 1 17 GLU HGS 1 1
115 1 1 1 1 17 GLU HA 1 17 GLU HA 1 1
115 1 2 1 1 17 GLU HG3 1 17 GLU HGR 1 1
116 1 1 1 1 18 HIS H 1 18 HIS HN 1 1
116 1 2 1 1 18 HIS HB2 1 18 HIS HBS 1 1
117 1 1 1 1 18 HIS H 1 18 HIS HN 1 1
117 1 2 1 1 18 HIS HB3 1 18 HIS HBR 1 1
118 1 1 1 1 18 HIS HB2 1 18 HIS HBS 1 1
118 1 2 1 1 18 HIS HD2 1 18 HIS HD2 1 1
119 1 1 1 1 18 HIS HB3 1 18 HIS HBR 1 1
119 1 2 1 1 18 HIS HD2 1 18 HIS HD2 1 1
120 1 1 1 1 19 ALA H 1 19 ALA HN 1 1
120 1 2 1 1 19 ALA MB 1 19 ALA HB* 1 1
121 1 1 1 1 20 HIS H 1 20 HIS HN 1 1
121 1 2 1 1 20 HIS HB2 1 20 HIS HBS 1 1
122 1 1 1 1 20 HIS H 1 20 HIS HN 1 1
122 1 2 1 1 20 HIS HB3 1 20 HIS HBR 1 1
123 1 1 1 1 20 HIS HB2 1 20 HIS HBS 1 1
123 1 2 1 1 20 HIS HD2 1 20 HIS HD2 1 1
124 1 1 1 1 20 HIS HB3 1 20 HIS HBR 1 1
124 1 2 1 1 20 HIS HD2 1 20 HIS HD2 1 1
125 1 1 1 1 2 ASP H 1 2 ASP HN 1 1
125 1 2 1 1 3 THR H 1 3 THR HN 1 1
126 1 1 1 1 3 THR H 1 3 THR HN 1 1
126 1 2 1 1 4 ARG H 1 4 ARG HN 1 1
127 1 1 1 1 4 ARG H 1 4 ARG HN 1 1
127 1 2 1 1 5 TYR H 1 5 TYR HN 1 1
128 1 1 1 1 5 TYR H 1 5 TYR HN 1 1
128 1 2 1 1 6 ASN H 1 6 ASN HN 1 1
129 1 1 1 1 6 ASN H 1 6 ASN HN 1 1
129 1 2 1 1 7 LYS H 1 7 LYS HN 1 1
130 1 1 1 1 7 LYS H 1 7 LYS HN 1 1
130 1 2 1 1 8 SER H 1 8 SER HN 1 1
131 1 1 1 1 8 SER H 1 8 SER HN 1 1
131 1 2 1 1 9 PHE H 1 9 PHE HN 1 1
132 1 1 1 1 9 PHE H 1 9 PHE HN 1 1
132 1 2 1 1 10 ILE H 1 10 ILE HN 1 1
133 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
133 1 2 1 1 11 ASN H 1 11 ASN HN 1 1
134 1 1 1 1 11 ASN H 1 11 ASN HN 1 1
134 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
135 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
135 1 2 1 1 13 LYS H 1 13 LYS HN 1 1
136 1 1 1 1 13 LYS H 1 13 LYS HN 1 1
136 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
137 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
137 1 2 1 1 15 LEU H 1 15 LEU HN 1 1
138 1 1 1 1 15 LEU H 1 15 LEU HN 1 1
138 1 2 1 1 16 ASN H 1 16 ASN HN 1 1
139 1 1 1 1 16 ASN H 1 16 ASN HN 1 1
139 1 2 1 1 17 GLU H 1 17 GLU HN 1 1
140 1 1 1 1 17 GLU H 1 17 GLU HN 1 1
140 1 2 1 1 18 HIS H 1 18 HIS HN 1 1
141 1 1 1 1 18 HIS H 1 18 HIS HN 1 1
141 1 2 1 1 19 ALA H 1 19 ALA HN 1 1
142 1 1 1 1 19 ALA H 1 19 ALA HN 1 1
142 1 2 1 1 20 HIS H 1 20 HIS HN 1 1
143 1 1 1 1 1 SER HA 1 1 SER HA 1 1
143 1 2 1 1 2 ASP H 1 2 ASP HN 1 1
144 1 1 1 1 2 ASP HA 1 2 ASP HA 1 1
144 1 2 1 1 3 THR H 1 3 THR HN 1 1
145 1 1 1 1 3 THR HA 1 3 THR HA 1 1
145 1 2 1 1 4 ARG H 1 4 ARG HN 1 1
146 1 1 1 1 4 ARG HA 1 4 ARG HA 1 1
146 1 2 1 1 5 TYR H 1 5 TYR HN 1 1
147 1 1 1 1 5 TYR HA 1 5 TYR HA 1 1
147 1 2 1 1 6 ASN H 1 6 ASN HN 1 1
148 1 1 1 1 6 ASN HA 1 6 ASN HA 1 1
148 1 2 1 1 7 LYS H 1 7 LYS HN 1 1
149 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
149 1 2 1 1 8 SER H 1 8 SER HN 1 1
150 1 1 1 1 8 SER HA 1 8 SER HA 1 1
150 1 2 1 1 9 PHE H 1 9 PHE HN 1 1
151 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1
151 1 2 1 1 10 ILE H 1 10 ILE HN 1 1
152 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
152 1 2 1 1 11 ASN H 1 11 ASN HN 1 1
153 1 1 1 1 11 ASN HA 1 11 ASN HA 1 1
153 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
154 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
154 1 2 1 1 13 LYS H 1 13 LYS HN 1 1
155 1 1 1 1 13 LYS HA 1 13 LYS HA 1 1
155 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
156 1 1 1 1 14 HIS HA 1 14 HIS HA 1 1
156 1 2 1 1 15 LEU H 1 15 LEU HN 1 1
157 1 1 1 1 15 LEU HA 1 15 LEU HA 1 1
157 1 2 1 1 16 ASN H 1 16 ASN HN 1 1
158 1 1 1 1 16 ASN HA 1 16 ASN HA 1 1
158 1 2 1 1 17 GLU H 1 17 GLU HN 1 1
159 1 1 1 1 17 GLU HA 1 17 GLU HA 1 1
159 1 2 1 1 18 HIS H 1 18 HIS HN 1 1
160 1 1 1 1 18 HIS HA 1 18 HIS HA 1 1
160 1 2 1 1 19 ALA H 1 19 ALA HN 1 1
161 1 1 1 1 19 ALA HA 1 19 ALA HA 1 1
161 1 2 1 1 20 HIS H 1 20 HIS HN 1 1
162 1 1 1 1 3 THR HA 1 3 THR HA 1 1
162 1 2 1 1 5 TYR H 1 5 TYR HN 1 1
163 1 1 1 1 4 ARG HA 1 4 ARG HA 1 1
163 1 2 1 1 6 ASN H 1 6 ASN HN 1 1
164 1 1 1 1 5 TYR HA 1 5 TYR HA 1 1
164 1 2 1 1 7 LYS H 1 7 LYS HN 1 1
165 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
165 1 2 1 1 9 PHE H 1 9 PHE HN 1 1
166 1 1 1 1 8 SER HA 1 8 SER HA 1 1
166 1 2 1 1 10 ILE H 1 10 ILE HN 1 1
167 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
167 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
168 1 1 1 1 11 ASN HA 1 11 ASN HA 1 1
168 1 2 1 1 13 LYS H 1 13 LYS HN 1 1
169 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
169 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
170 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
170 1 2 1 1 10 ILE H 1 10 ILE HN 1 1
171 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
171 1 2 1 1 13 LYS H 1 13 LYS HN 1 1
172 1 1 1 1 13 LYS HA 1 13 LYS HA 1 1
172 1 2 1 1 16 ASN H 1 16 ASN HN 1 1
173 1 1 1 1 14 HIS HA 1 14 HIS HA 1 1
173 1 2 1 1 17 GLU H 1 17 GLU HN 1 1
174 1 1 1 1 15 LEU HA 1 15 LEU HA 1 1
174 1 2 1 1 18 HIS H 1 18 HIS HN 1 1
175 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
175 1 2 1 1 15 LEU H 1 15 LEU HN 1 1
176 1 1 1 1 3 THR HA 1 3 THR HA 1 1
176 1 2 1 1 7 LYS H 1 7 LYS HN 1 1
177 1 1 1 1 4 ARG HA 1 4 ARG HA 1 1
177 1 2 1 1 8 SER H 1 8 SER HN 1 1
178 1 1 1 1 7 LYS HA 1 7 LYS HA 1 1
178 1 2 1 1 11 ASN H 1 11 ASN HN 1 1
179 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
179 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
180 1 1 1 1 8 SER HA 1 8 SER HA 1 1
180 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
181 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1
181 1 2 1 1 13 LYS H 1 13 LYS HN 1 1
182 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
182 1 2 1 1 16 ASN H 1 16 ASN HN 1 1
183 1 1 1 1 15 LEU HA 1 15 LEU HA 1 1
183 1 2 1 1 19 ALA H 1 19 ALA HN 1 1
184 1 1 1 1 11 ASN HA 1 11 ASN HA 1 1
184 1 2 1 1 15 LEU H 1 15 LEU HN 1 1
185 1 1 1 1 7 LYS QB 1 7 LYS HB* 1 1
185 1 2 1 1 10 ILE HA 1 10 ILE HA 1 1
186 1 1 1 1 14 HIS QB 1 14 HIS HB* 1 1
186 1 2 1 1 17 GLU HA 1 17 GLU HA 1 1
187 1 1 1 1 6 ASN QB 1 6 ASN HB* 1 1
187 1 2 1 1 9 PHE HA 1 9 PHE HA 1 1
188 1 1 1 1 15 LEU QB 1 15 LEU HB* 1 1
188 1 2 1 1 18 HIS HA 1 18 HIS HA 1 1
189 1 1 1 1 3 THR MG 1 3 THR HG2* 1 1
189 1 2 1 1 6 ASN HA 1 6 ASN HA 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.8 1.8 2.8 1 1
2 1 . . . . . 2.8 1.8 2.8 1 1
3 1 . . . . . 2.8 1.8 2.8 1 1
4 1 . . . . . 2.8 1.8 2.8 1 1
5 1 . . . . . 2.8 1.8 2.8 1 1
6 1 . . . . . 2.8 1.8 2.8 1 1
7 1 . . . . . 2.8 1.8 2.8 1 1
8 1 . . . . . 2.8 1.8 2.8 1 1
9 1 . . . . . 2.8 1.8 2.8 1 1
10 1 . . . . . 2.8 1.8 2.8 1 1
11 1 . . . . . 2.8 1.8 2.8 1 1
12 1 . . . . . 2.8 1.8 2.8 1 1
13 1 . . . . . 2.8 1.8 2.8 1 1
14 1 . . . . . 2.8 1.8 2.8 1 1
15 1 . . . . . 2.8 1.8 2.8 1 1
16 1 . . . . . 2.8 1.8 2.8 1 1
17 1 . . . . . 2.8 1.8 2.8 1 1
18 1 . . . . . 2.8 1.8 2.8 1 1
19 1 . . . . . 2.8 1.8 2.8 1 1
20 1 . . . . . 2.8 1.8 2.8 1 1
21 1 . . . . . 2.8 2.8 3.5 1 1
22 1 . . . . . 2.8 2.8 3.5 1 1
23 1 . . . . . 2.8 2.8 3.5 1 1
24 1 . . . . . 2.8 2.8 3.5 1 1
25 1 . . . . . 2.8 2.8 3.5 1 1
26 1 . . . . . 2.8 1.8 2.8 1 1
27 1 . . . . . 2.8 2.8 3.5 1 1
28 1 . . . . . 2.8 1.8 2.8 1 1
29 1 . . . . . 2.8 1.8 3.8 1 1
30 1 . . . . . 3.5 2.8 4.5 1 1
31 1 . . . . . 2.8 1.8 3.8 1 1
32 1 . . . . . 2.8 1.8 3.8 1 1
33 1 . . . . . 3.5 2.8 4.5 1 1
34 1 . . . . . 3.5 2.8 4.5 1 1
35 1 . . . . . 3.5 2.8 5.5 1 1
36 1 . . . . . 2.8 1.8 6.2 1 1
37 1 . . . . . 2.8 1.8 6.2 1 1
38 1 . . . . . 2.8 1.8 2.8 1 1
39 1 . . . . . 2.8 1.8 2.8 1 1
40 1 . . . . . 2.8 1.8 2.8 1 1
41 1 . . . . . 3.5 2.8 5.5 1 1
42 1 . . . . . 2.8 1.8 4.8 1 1
43 1 . . . . . 2.8 1.8 4.8 1 1
44 1 . . . . . 2.8 1.8 4.8 1 1
45 1 . . . . . 2.8 1.8 2.8 1 1
46 1 . . . . . 2.8 1.8 2.8 1 1
47 1 . . . . . 2.8 1.8 2.8 1 1
48 1 . . . . . 2.8 1.8 2.8 1 1
49 1 . . . . . 2.8 1.8 3.8 1 1
50 1 . . . . . 2.8 1.8 3.8 1 1
51 1 . . . . . 2.8 1.8 3.8 1 1
52 1 . . . . . 2.8 1.8 3.8 1 1
53 1 . . . . . 2.8 1.8 3.8 1 1
54 1 . . . . . 2.8 1.8 3.8 1 1
55 1 . . . . . 2.8 1.8 2.8 1 1
56 1 . . . . . 2.8 1.8 2.8 1 1
57 1 . . . . . 2.8 1.8 2.8 1 1
58 1 . . . . . 2.8 1.8 2.8 1 1
59 1 . . . . . 2.8 1.8 2.8 1 1
60 1 . . . . . 3.5 2.8 5.5 1 1
61 1 . . . . . 2.8 1.8 2.8 1 1
62 1 . . . . . 2.8 1.8 2.8 1 1
63 1 . . . . . 2.8 1.8 4.8 1 1
64 1 . . . . . 2.8 1.8 4.8 1 1
65 1 . . . . . 3.5 2.8 5.5 1 1
66 1 . . . . . 3.5 2.8 7.5 1 1
67 1 . . . . . 3.5 2.8 7.5 1 1
68 1 . . . . . 2.8 1.8 2.8 1 1
69 1 . . . . . 3.5 2.8 7.5 1 1
70 1 . . . . . 2.8 1.8 2.8 1 1
71 1 . . . . . 2.8 1.8 2.8 1 1
72 1 . . . . . 2.8 1.8 2.8 1 1
73 1 . . . . . 3.5 2.8 7.5 1 1
74 1 . . . . . 3.5 2.8 7.5 1 1
75 1 . . . . . 2.8 1.8 2.8 1 1
76 1 . . . . . 2.8 1.8 3.8 1 1
77 1 . . . . . 2.8 1.8 2.8 1 1
78 1 . . . . . 2.8 1.8 2.8 1 1
79 1 . . . . . 2.8 1.8 2.8 1 1
80 1 . . . . . 2.8 1.8 2.8 1 1
81 1 . . . . . 3.5 2.8 7.5 1 1
82 1 . . . . . 2.8 1.8 2.8 1 1
83 1 . . . . . 3.5 2.8 7.5 1 1
84 1 . . . . . 2.8 1.8 2.8 1 1
85 1 . . . . . 2.8 1.8 2.8 1 1
86 1 . . . . . 3.5 2.8 7.5 1 1
87 1 . . . . . 2.8 1.8 3.8 1 1
88 1 . . . . . 2.8 1.8 3.8 1 1
89 1 . . . . . 3.5 2.8 7.5 1 1
90 1 . . . . . 2.8 1.8 3.8 1 1
91 1 . . . . . 2.8 1.8 3.8 1 1
92 1 . . . . . 2.8 1.8 3.8 1 1
93 1 . . . . . 2.8 1.8 2.8 1 1
94 1 . . . . . 3.5 2.8 5.5 1 1
95 1 . . . . . 2.8 1.8 2.8 1 1
96 1 . . . . . 2.8 1.8 2.8 1 1
97 1 . . . . . 2.8 1.8 3.8 1 1
98 1 . . . . . 5.0 3.5 5.0 1 1
99 1 . . . . . 3.5 2.8 4.5 1 1
100 1 . . . . . 5.0 3.5 5.0 1 1
101 1 . . . . . 3.5 2.8 3.5 1 1
102 1 . . . . . 3.5 2.8 5.5 1 1
103 1 . . . . . 2.8 1.8 2.8 1 1
104 1 . . . . . 3.5 2.8 5.5 1 1
105 1 . . . . . 2.8 1.8 2.8 1 1
106 1 . . . . . 2.8 1.8 2.8 1 1
107 1 . . . . . 3.5 2.8 5.5 1 1
108 1 . . . . . 3.5 2.8 5.5 1 1
109 1 . . . . . 3.5 2.8 5.5 1 1
110 1 . . . . . 3.5 2.8 5.5 1 1
111 1 . . . . . 2.8 1.8 2.8 1 1
112 1 . . . . . 2.8 1.8 2.8 1 1
113 1 . . . . . 2.8 1.8 2.8 1 1
114 1 . . . . . 2.8 1.8 2.8 1 1
115 1 . . . . . 3.5 2.8 5.5 1 1
116 1 . . . . . 2.8 1.8 2.8 1 1
117 1 . . . . . 3.5 2.8 5.5 1 1
118 1 . . . . . 2.8 1.8 2.8 1 1
119 1 . . . . . 2.8 1.8 2.8 1 1
120 1 . . . . . 2.8 1.8 3.8 1 1
121 1 . . . . . 2.8 1.8 2.8 1 1
122 1 . . . . . 2.8 1.8 2.8 1 1
123 1 . . . . . 2.8 1.8 2.8 1 1
124 1 . . . . . 2.8 1.8 2.8 1 1
125 1 . . . . . 2.8 1.8 2.8 1 1
126 1 . . . . . 2.8 1.8 2.8 1 1
127 1 . . . . . 2.8 1.8 2.8 1 1
128 1 . . . . . 2.8 1.8 2.8 1 1
129 1 . . . . . 2.8 1.8 2.8 1 1
130 1 . . . . . 2.8 1.8 2.8 1 1
131 1 . . . . . 5.0 3.5 5.0 1 1
132 1 . . . . . 3.5 2.8 3.5 1 1
133 1 . . . . . 3.5 2.8 3.5 1 1
134 1 . . . . . 3.5 2.8 3.5 1 1
135 1 . . . . . 3.5 2.8 3.5 1 1
136 1 . . . . . 2.8 1.8 2.8 1 1
137 1 . . . . . 3.5 2.8 3.5 1 1
138 1 . . . . . 3.5 2.8 3.5 1 1
139 1 . . . . . 3.5 2.8 3.5 1 1
140 1 . . . . . 3.5 2.8 3.5 1 1
141 1 . . . . . 3.5 2.8 3.5 1 1
142 1 . . . . . 3.5 2.8 3.5 1 1
143 1 . . . . . 2.8 1.8 2.8 1 1
144 1 . . . . . 2.8 1.8 2.8 1 1
145 1 . . . . . 2.8 1.8 2.8 1 1
146 1 . . . . . 3.5 2.8 3.5 1 1
147 1 . . . . . 2.8 1.8 2.8 1 1
148 1 . . . . . 3.5 2.8 3.5 1 1
149 1 . . . . . 3.5 2.8 3.5 1 1
150 1 . . . . . 3.5 2.8 3.5 1 1
151 1 . . . . . 3.5 2.8 3.5 1 1
152 1 . . . . . 3.5 2.8 3.5 1 1
153 1 . . . . . 3.5 2.8 3.5 1 1
154 1 . . . . . 3.5 2.8 3.5 1 1
155 1 . . . . . 3.5 2.8 3.5 1 1
156 1 . . . . . 3.5 2.8 3.5 1 1
157 1 . . . . . 3.5 2.8 3.5 1 1
158 1 . . . . . 3.5 2.8 3.5 1 1
159 1 . . . . . 2.8 1.8 2.8 1 1
160 1 . . . . . 2.8 1.8 2.8 1 1
161 1 . . . . . 2.8 1.8 2.8 1 1
162 1 . . . . . 3.5 2.8 3.5 1 1
163 1 . . . . . 3.5 2.8 3.5 1 1
164 1 . . . . . 5.0 3.5 5.0 1 1
165 1 . . . . . 5.0 3.5 5.0 1 1
166 1 . . . . . 5.0 3.5 5.0 1 1
167 1 . . . . . 5.0 3.5 5.0 1 1
168 1 . . . . . 5.0 3.5 5.0 1 1
169 1 . . . . . 5.0 3.5 5.0 1 1
170 1 . . . . . 5.0 3.5 5.0 1 1
171 1 . . . . . 5.0 3.5 5.0 1 1
172 1 . . . . . 3.5 3.5 4.5 1 1
173 1 . . . . . 3.5 3.5 4.5 1 1
174 1 . . . . . 3.5 3.5 4.5 1 1
175 1 . . . . . 3.5 3.5 4.5 1 1
176 1 . . . . . 3.5 3.5 4.5 1 1
177 1 . . . . . 3.5 3.5 5.0 1 1
178 1 . . . . . 3.5 3.5 5.0 1 1
179 1 . . . . . 3.5 3.5 5.0 1 1
180 1 . . . . . 3.5 3.5 5.0 1 1
181 1 . . . . . 3.5 3.5 5.0 1 1
182 1 . . . . . 5.0 3.5 5.0 1 1
183 1 . . . . . 5.0 3.5 5.0 1 1
184 1 . . . . . 5.0 3.5 5.0 1 1
185 1 . . . . . 5.0 3.5 5.0 1 1
186 1 . . . . . 5.0 3.5 5.0 1 1
187 1 . . . . . 5.0 3.5 5.0 1 1
188 1 . . . . . 3.5 2.8 5.0 1 1
189 1 . . . . . 5.0 3.5 5.0 1 1
stop_
save_
save_Discover_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 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 8 SER O 1 8 SER O 1 2
1 1 2 1 1 12 ASN H 1 12 ASN HN 1 2
2 1 1 1 1 11 ASN O 1 11 ASN O 1 2
2 1 2 1 1 15 LEU H 1 15 LEU HN 1 2
3 1 1 1 1 13 LYS O 1 13 LYS O 1 2
3 1 2 1 1 17 GLU H 1 17 GLU HN 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 . . . . . . 1.8 2.5 1 2
2 1 . . . . . . 1.8 2.5 1 2
3 1 . . . . . . 1.8 2.5 1 2
stop_
save_
save_Discover_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 1 SER CA 1 1 1 SER C 1 1 2 ASP N 1 1 2 ASP CA 178.0 179.99998 1 1 SER CA 1 1 SER C 1 2 ASP N 1 2 ASP CA 1 1
2 . 1 1 2 ASP CA 1 1 2 ASP C 1 1 3 THR N 1 1 3 THR CA 178.0 179.99998 1 2 ASP CA 1 2 ASP C 1 3 THR N 1 3 THR CA 1 1
3 . 1 1 3 THR CA 1 1 3 THR C 1 1 4 ARG N 1 1 4 ARG CA 178.0 179.99998 1 3 THR CA 1 3 THR C 1 4 ARG N 1 4 ARG CA 1 1
4 . 1 1 4 ARG CA 1 1 4 ARG C 1 1 5 TYR N 1 1 5 TYR CA 178.0 179.99998 1 4 ARG CA 1 4 ARG C 1 5 TYR N 1 5 TYR CA 1 1
5 . 1 1 5 TYR CA 1 1 5 TYR C 1 1 6 ASN N 1 1 6 ASN CA 178.0 179.99998 1 5 TYR CA 1 5 TYR C 1 6 ASN N 1 6 ASN CA 1 1
6 . 1 1 6 ASN CA 1 1 6 ASN C 1 1 7 LYS N 1 1 7 LYS CA 178.0 179.99998 1 6 ASN CA 1 6 ASN C 1 7 LYS N 1 7 LYS CA 1 1
7 . 1 1 7 LYS CA 1 1 7 LYS C 1 1 8 SER N 1 1 8 SER CA 178.0 179.99998 1 7 LYS CA 1 7 LYS C 1 8 SER N 1 8 SER CA 1 1
8 . 1 1 8 SER CA 1 1 8 SER C 1 1 9 PHE N 1 1 9 PHE CA 178.0 179.99998 1 8 SER CA 1 8 SER C 1 9 PHE N 1 9 PHE CA 1 1
9 . 1 1 9 PHE CA 1 1 9 PHE C 1 1 10 ILE N 1 1 10 ILE CA 178.0 179.99998 1 9 PHE CA 1 9 PHE C 1 10 ILE N 1 10 ILE CA 1 1
10 . 1 1 10 ILE CA 1 1 10 ILE C 1 1 11 ASN N 1 1 11 ASN CA 178.0 179.99998 1 10 ILE CA 1 10 ILE C 1 11 ASN N 1 11 ASN CA 1 1
11 . 1 1 11 ASN CA 1 1 11 ASN C 1 1 12 ASN N 1 1 12 ASN CA 178.0 179.99998 1 11 ASN CA 1 11 ASN C 1 12 ASN N 1 12 ASN CA 1 1
12 . 1 1 12 ASN CA 1 1 12 ASN C 1 1 13 LYS N 1 1 13 LYS CA 178.0 179.99998 1 12 ASN CA 1 12 ASN C 1 13 LYS N 1 13 LYS CA 1 1
13 . 1 1 13 LYS CA 1 1 13 LYS C 1 1 14 HIS N 1 1 14 HIS CA 178.0 179.99998 1 13 LYS CA 1 13 LYS C 1 14 HIS N 1 14 HIS CA 1 1
14 . 1 1 14 HIS CA 1 1 14 HIS C 1 1 15 LEU N 1 1 15 LEU CA 178.0 179.99998 1 14 HIS CA 1 14 HIS C 1 15 LEU N 1 15 LEU CA 1 1
15 . 1 1 15 LEU CA 1 1 15 LEU C 1 1 16 ASN N 1 1 16 ASN CA 178.0 179.99998 1 15 LEU CA 1 15 LEU C 1 16 ASN N 1 16 ASN CA 1 1
16 . 1 1 16 ASN CA 1 1 16 ASN C 1 1 17 GLU N 1 1 17 GLU CA 178.0 179.99998 1 16 ASN CA 1 16 ASN C 1 17 GLU N 1 17 GLU CA 1 1
17 . 1 1 17 GLU CA 1 1 17 GLU C 1 1 18 HIS N 1 1 18 HIS CA 178.0 179.99998 1 17 GLU CA 1 17 GLU C 1 18 HIS N 1 18 HIS CA 1 1
18 . 1 1 18 HIS CA 1 1 18 HIS C 1 1 19 ALA N 1 1 19 ALA CA 178.0 179.99998 1 18 HIS CA 1 18 HIS C 1 19 ALA N 1 19 ALA CA 1 1
19 . 1 1 19 ALA CA 1 1 19 ALA C 1 1 20 HIS N 1 1 20 HIS CA 178.0 179.99998 1 19 ALA CA 1 19 ALA C 1 20 HIS N 1 20 HIS CA 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 SER C C -11.560 -3.844 -0.773 1.00 . A A . 1 SER C 1 1
1 2 1 1 1 SER CA C -10.552 -4.920 -0.245 1.00 . A A . 1 SER CA 1 1
1 3 1 1 1 SER CB C -10.913 -6.361 -0.681 1.00 . A A . 1 SER CB 1 1
1 4 1 1 1 SER H1 H -11.226 -5.213 1.822 1.00 . A A . 1 SER H1 1 1
1 5 1 1 1 SER HA H -9.576 -4.666 -0.700 1.00 . A A . 1 SER HA 1 1
1 6 1 1 1 SER HB2 H -10.295 -7.102 -0.137 1.00 . A A . 1 SER HB2 1 1
1 7 1 1 1 SER HB3 H -11.968 -6.598 -0.437 1.00 . A A . 1 SER HB3 1 1
1 8 1 1 1 SER HG H -11.278 -5.901 -2.513 1.00 . A A . 1 SER HG 1 1
1 9 1 1 1 SER N N -10.423 -4.973 1.240 1.00 . A A . 1 SER N 1 1
1 10 1 1 1 SER O O -12.215 -4.044 -1.803 1.00 . A A . 1 SER O 1 1
1 11 1 1 1 SER OG O -10.703 -6.535 -2.078 1.00 . A A . 1 SER OG 1 1
1 12 1 1 2 ASP C C -12.020 -0.287 0.279 1.00 . A A . 2 ASP C 1 1
1 13 1 1 2 ASP CA C -12.531 -1.557 -0.472 1.00 . A A . 2 ASP CA 1 1
1 14 1 1 2 ASP CB C -14.042 -1.873 -0.224 1.00 . A A . 2 ASP CB 1 1
1 15 1 1 2 ASP CG C -14.987 -0.969 -1.026 1.00 . A A . 2 ASP CG 1 1
1 16 1 1 2 ASP H H -10.962 -2.594 0.653 1.00 . A A . 2 ASP H 1 1
1 17 1 1 2 ASP HA H -12.355 -1.383 -1.552 1.00 . A A . 2 ASP HA 1 1
1 18 1 1 2 ASP HB2 H -14.290 -2.933 -0.445 1.00 . A A . 2 ASP HB2 1 1
1 19 1 1 2 ASP HB3 H -14.281 -1.776 0.852 1.00 . A A . 2 ASP HB3 1 1
1 20 1 1 2 ASP HD2 H -15.051 -2.446 -2.292 1.00 . A A . 2 ASP HD2 1 1
1 21 1 1 2 ASP N N -11.662 -2.691 -0.082 1.00 . A A . 2 ASP N 1 1
1 22 1 1 2 ASP O O -12.651 0.206 1.220 1.00 . A A . 2 ASP O 1 1
1 23 1 1 2 ASP OD1 O -15.313 0.162 -0.665 1.00 . A A . 2 ASP OD1 1 1
1 24 1 1 2 ASP OD2 O -15.416 -1.565 -2.184 1.00 . A A . 2 ASP OD2 1 1
1 25 1 1 3 THR C C -9.790 2.259 -0.881 1.00 . A A . 3 THR C 1 1
1 26 1 1 3 THR CA C -10.218 1.444 0.372 1.00 . A A . 3 THR CA 1 1
1 27 1 1 3 THR CB C -9.182 1.034 1.465 1.00 . A A . 3 THR CB 1 1
1 28 1 1 3 THR CG2 C -7.728 0.840 1.022 1.00 . A A . 3 THR CG2 1 1
1 29 1 1 3 THR H H -10.343 -0.239 -0.877 1.00 . A A . 3 THR H 1 1
1 30 1 1 3 THR HA H -10.968 2.058 0.873 1.00 . A A . 3 THR HA 1 1
1 31 1 1 3 THR HB H -9.500 0.067 1.898 1.00 . A A . 3 THR HB 1 1
1 32 1 1 3 THR HG1 H -10.128 2.012 2.824 1.00 . A A . 3 THR HG1 1 1
1 33 1 1 3 THR HG21 H -7.072 0.603 1.874 1.00 . A A . 3 THR HG21 1 1
1 34 1 1 3 THR HG22 H -7.651 0.047 0.262 1.00 . A A . 3 THR HG22 1 1
1 35 1 1 3 THR HG23 H -7.302 1.743 0.554 1.00 . A A . 3 THR HG23 1 1
1 36 1 1 3 THR N N -10.857 0.235 -0.157 1.00 . A A . 3 THR N 1 1
1 37 1 1 3 THR O O -8.646 2.266 -1.332 1.00 . A A . 3 THR O 1 1
1 38 1 1 3 THR OG1 O -9.217 1.983 2.524 1.00 . A A . 3 THR OG1 1 1
1 39 1 1 4 ARG C C -9.922 5.115 -2.282 1.00 . A A . 4 ARG C 1 1
1 40 1 1 4 ARG CA C -10.622 3.790 -2.666 1.00 . A A . 4 ARG CA 1 1
1 41 1 1 4 ARG CB C -11.965 4.049 -3.405 1.00 . A A . 4 ARG CB 1 1
1 42 1 1 4 ARG CD C -13.296 1.791 -3.383 1.00 . A A . 4 ARG CD 1 1
1 43 1 1 4 ARG CG C -12.556 2.867 -4.212 1.00 . A A . 4 ARG CG 1 1
1 44 1 1 4 ARG CZ C -13.284 -0.406 -4.609 1.00 . A A . 4 ARG CZ 1 1
1 45 1 1 4 ARG H H -11.681 2.468 -1.232 1.00 . A A . 4 ARG H 1 1
1 46 1 1 4 ARG HA H -9.907 3.266 -3.327 1.00 . A A . 4 ARG HA 1 1
1 47 1 1 4 ARG HB2 H -12.728 4.454 -2.710 1.00 . A A . 4 ARG HB2 1 1
1 48 1 1 4 ARG HB3 H -11.807 4.874 -4.127 1.00 . A A . 4 ARG HB3 1 1
1 49 1 1 4 ARG HD2 H -12.633 1.339 -2.623 1.00 . A A . 4 ARG HD2 1 1
1 50 1 1 4 ARG HD3 H -14.108 2.268 -2.804 1.00 . A A . 4 ARG HD3 1 1
1 51 1 1 4 ARG HG2 H -13.266 3.285 -4.951 1.00 . A A . 4 ARG HG2 1 1
1 52 1 1 4 ARG HG3 H -11.756 2.399 -4.817 1.00 . A A . 4 ARG HG3 1 1
1 53 1 1 4 ARG HH11 H -14.917 -0.985 -5.614 1.00 . A A . 4 ARG HH11 1 1
1 54 1 1 4 ARG HH12 H -13.473 -2.117 -5.632 1.00 . A A . 4 ARG HH12 1 1
1 55 1 1 4 ARG HH21 H -11.533 -0.056 -3.681 1.00 . A A . 4 ARG HH21 1 1
1 56 1 1 4 ARG HH22 H -11.686 -1.629 -4.612 1.00 . A A . 4 ARG HH22 1 1
1 57 1 1 4 ARG N N -10.796 2.910 -1.481 1.00 . A A . 4 ARG N 1 1
1 58 1 1 4 ARG NE N -13.898 0.736 -4.237 1.00 . A A . 4 ARG NE 1 1
1 59 1 1 4 ARG NH1 N -13.960 -1.255 -5.361 1.00 . A A . 4 ARG NH1 1 1
1 60 1 1 4 ARG NH2 N -12.039 -0.731 -4.265 1.00 . A A . 4 ARG NH2 1 1
1 61 1 1 4 ARG O O -8.995 5.528 -2.986 1.00 . A A . 4 ARG O 1 1
1 62 1 1 5 TYR C C -8.483 6.752 0.256 1.00 . A A . 5 TYR C 1 1
1 63 1 1 5 TYR CA C -9.734 7.020 -0.680 1.00 . A A . 5 TYR CA 1 1
1 64 1 1 5 TYR CB C -10.850 7.912 -0.059 1.00 . A A . 5 TYR CB 1 1
1 65 1 1 5 TYR CD1 C -10.287 9.889 1.457 1.00 . A A . 5 TYR CD1 1 1
1 66 1 1 5 TYR CD2 C -10.360 10.262 -0.928 1.00 . A A . 5 TYR CD2 1 1
1 67 1 1 5 TYR CE1 C -9.965 11.230 1.656 1.00 . A A . 5 TYR CE1 1 1
1 68 1 1 5 TYR CE2 C -10.039 11.603 -0.727 1.00 . A A . 5 TYR CE2 1 1
1 69 1 1 5 TYR CG C -10.481 9.392 0.163 1.00 . A A . 5 TYR CG 1 1
1 70 1 1 5 TYR CZ C -9.841 12.086 0.564 1.00 . A A . 5 TYR CZ 1 1
1 71 1 1 5 TYR H H -11.058 5.244 -0.654 1.00 . A A . 5 TYR H 1 1
1 72 1 1 5 TYR HA H -9.342 7.523 -1.562 1.00 . A A . 5 TYR HA 1 1
1 73 1 1 5 TYR HB2 H -11.748 7.896 -0.709 1.00 . A A . 5 TYR HB2 1 1
1 74 1 1 5 TYR HB3 H -11.196 7.451 0.888 1.00 . A A . 5 TYR HB3 1 1
1 75 1 1 5 TYR HD1 H -10.380 9.238 2.316 1.00 . A A . 5 TYR HD1 1 1
1 76 1 1 5 TYR HD2 H -10.513 9.901 -1.935 1.00 . A A . 5 TYR HD2 1 1
1 77 1 1 5 TYR HE1 H -9.814 11.602 2.659 1.00 . A A . 5 TYR HE1 1 1
1 78 1 1 5 TYR HE2 H -9.945 12.265 -1.576 1.00 . A A . 5 TYR HE2 1 1
1 79 1 1 5 TYR HH H -9.481 13.848 -0.090 1.00 . A A . 5 TYR HH 1 1
1 80 1 1 5 TYR N N -10.369 5.772 -1.188 1.00 . A A . 5 TYR N 1 1
1 81 1 1 5 TYR O O -8.121 7.560 1.115 1.00 . A A . 5 TYR O 1 1
1 82 1 1 5 TYR OH O -9.525 13.407 0.761 1.00 . A A . 5 TYR OH 1 1
1 83 1 1 6 ASN C C -5.607 4.406 -0.240 1.00 . A A . 6 ASN C 1 1
1 84 1 1 6 ASN CA C -6.614 5.109 0.718 1.00 . A A . 6 ASN CA 1 1
1 85 1 1 6 ASN CB C -7.072 4.324 1.950 1.00 . A A . 6 ASN CB 1 1
1 86 1 1 6 ASN CG C -6.020 3.885 2.989 1.00 . A A . 6 ASN CG 1 1
1 87 1 1 6 ASN H H -8.356 4.966 -0.535 1.00 . A A . 6 ASN H 1 1
1 88 1 1 6 ASN HA H -6.095 5.937 1.123 1.00 . A A . 6 ASN HA 1 1
1 89 1 1 6 ASN HB2 H -7.881 4.889 2.440 1.00 . A A . 6 ASN HB2 1 1
1 90 1 1 6 ASN HB3 H -7.582 3.450 1.576 1.00 . A A . 6 ASN HB3 1 1
1 91 1 1 6 ASN HD21 H -4.645 4.490 4.319 1.00 . A A . 6 ASN HD21 1 1
1 92 1 1 6 ASN HD22 H -5.527 5.792 3.373 1.00 . A A . 6 ASN HD22 1 1
1 93 1 1 6 ASN N N -7.804 5.615 0.013 1.00 . A A . 6 ASN N 1 1
1 94 1 1 6 ASN ND2 N -5.326 4.817 3.626 1.00 . A A . 6 ASN ND2 1 1
1 95 1 1 6 ASN O O -4.400 4.567 -0.043 1.00 . A A . 6 ASN O 1 1
1 96 1 1 6 ASN OD1 O -5.845 2.696 3.249 1.00 . A A . 6 ASN OD1 1 1
1 97 1 1 7 LYS C C -4.422 1.814 -1.621 1.00 . A A . 7 LYS C 1 1
1 98 1 1 7 LYS CA C -5.241 2.961 -2.285 1.00 . A A . 7 LYS CA 1 1
1 99 1 1 7 LYS CB C -4.426 3.970 -3.145 1.00 . A A . 7 LYS CB 1 1
1 100 1 1 7 LYS CD C -6.274 4.620 -4.919 1.00 . A A . 7 LYS CD 1 1
1 101 1 1 7 LYS CE C -5.659 3.983 -6.180 1.00 . A A . 7 LYS CE 1 1
1 102 1 1 7 LYS CG C -5.244 5.077 -3.863 1.00 . A A . 7 LYS CG 1 1
1 103 1 1 7 LYS H H -7.080 3.449 -1.226 1.00 . A A . 7 LYS H 1 1
1 104 1 1 7 LYS HA H -5.918 2.517 -3.030 1.00 . A A . 7 LYS HA 1 1
1 105 1 1 7 LYS HB2 H -3.672 4.461 -2.504 1.00 . A A . 7 LYS HB2 1 1
1 106 1 1 7 LYS HB3 H -3.846 3.407 -3.896 1.00 . A A . 7 LYS HB3 1 1
1 107 1 1 7 LYS HD2 H -7.002 3.929 -4.453 1.00 . A A . 7 LYS HD2 1 1
1 108 1 1 7 LYS HD3 H -6.872 5.505 -5.211 1.00 . A A . 7 LYS HD3 1 1
1 109 1 1 7 LYS HE2 H -4.939 4.677 -6.651 1.00 . A A . 7 LYS HE2 1 1
1 110 1 1 7 LYS HE3 H -5.089 3.073 -5.918 1.00 . A A . 7 LYS HE3 1 1
1 111 1 1 7 LYS HG2 H -5.782 5.666 -3.095 1.00 . A A . 7 LYS HG2 1 1
1 112 1 1 7 LYS HG3 H -4.544 5.794 -4.322 1.00 . A A . 7 LYS HG3 1 1
1 113 1 1 7 LYS HZ2 H -6.267 3.175 -7.980 1.00 . A A . 7 LYS HZ2 1 1
1 114 1 1 7 LYS HZ3 H -7.335 2.928 -6.767 1.00 . A A . 7 LYS HZ3 1 1
1 115 1 1 7 LYS N N -6.078 3.651 -1.265 1.00 . A A . 7 LYS N 1 1
1 116 1 1 7 LYS NZ N -6.696 3.626 -7.165 1.00 . A A . 7 LYS NZ 1 1
1 117 1 1 7 LYS O O -3.190 1.843 -1.677 1.00 . A A . 7 LYS O 1 1
1 118 1 1 8 SER C C -3.297 0.110 0.699 1.00 . A A . 8 SER C 1 1
1 119 1 1 8 SER CA C -4.434 -0.339 -0.295 1.00 . A A . 8 SER CA 1 1
1 120 1 1 8 SER CB C -4.117 -1.389 -1.376 1.00 . A A . 8 SER CB 1 1
1 121 1 1 8 SER H H -6.079 0.690 -1.257 1.00 . A A . 8 SER H 1 1
1 122 1 1 8 SER HA H -5.190 -0.861 0.302 1.00 . A A . 8 SER HA 1 1
1 123 1 1 8 SER HB2 H -5.055 -1.858 -1.738 1.00 . A A . 8 SER HB2 1 1
1 124 1 1 8 SER HB3 H -3.698 -0.859 -2.237 1.00 . A A . 8 SER HB3 1 1
1 125 1 1 8 SER HG H -3.113 -3.002 -1.678 1.00 . A A . 8 SER HG 1 1
1 126 1 1 8 SER N N -5.097 0.811 -0.984 1.00 . A A . 8 SER N 1 1
1 127 1 1 8 SER O O -2.167 -0.378 0.613 1.00 . A A . 8 SER O 1 1
1 128 1 1 8 SER OG O -3.242 -2.418 -0.927 1.00 . A A . 8 SER OG 1 1
1 129 1 1 9 PHE C C -1.376 2.278 1.999 1.00 . A A . 9 PHE C 1 1
1 130 1 1 9 PHE CA C -2.637 1.600 2.636 1.00 . A A . 9 PHE CA 1 1
1 131 1 1 9 PHE CB C -2.421 0.550 3.755 1.00 . A A . 9 PHE CB 1 1
1 132 1 1 9 PHE CD1 C -0.784 0.317 5.685 1.00 . A A . 9 PHE CD1 1 1
1 133 1 1 9 PHE CD2 C -2.436 2.073 5.824 1.00 . A A . 9 PHE CD2 1 1
1 134 1 1 9 PHE CE1 C -0.305 0.671 6.944 1.00 . A A . 9 PHE CE1 1 1
1 135 1 1 9 PHE CE2 C -1.946 2.432 7.078 1.00 . A A . 9 PHE CE2 1 1
1 136 1 1 9 PHE CG C -1.849 1.019 5.109 1.00 . A A . 9 PHE CG 1 1
1 137 1 1 9 PHE CZ C -0.881 1.732 7.636 1.00 . A A . 9 PHE CZ 1 1
1 138 1 1 9 PHE H H -4.567 1.376 1.704 1.00 . A A . 9 PHE H 1 1
1 139 1 1 9 PHE HA H -3.162 2.402 3.154 1.00 . A A . 9 PHE HA 1 1
1 140 1 1 9 PHE HB2 H -3.392 0.059 3.967 1.00 . A A . 9 PHE HB2 1 1
1 141 1 1 9 PHE HB3 H -1.795 -0.234 3.317 1.00 . A A . 9 PHE HB3 1 1
1 142 1 1 9 PHE HD1 H -0.327 -0.515 5.167 1.00 . A A . 9 PHE HD1 1 1
1 143 1 1 9 PHE HD2 H -3.281 2.612 5.421 1.00 . A A . 9 PHE HD2 1 1
1 144 1 1 9 PHE HE1 H 0.518 0.124 7.382 1.00 . A A . 9 PHE HE1 1 1
1 145 1 1 9 PHE HE2 H -2.400 3.248 7.621 1.00 . A A . 9 PHE HE2 1 1
1 146 1 1 9 PHE HZ H -0.505 2.008 8.610 1.00 . A A . 9 PHE HZ 1 1
1 147 1 1 9 PHE N N -3.597 1.059 1.632 1.00 . A A . 9 PHE N 1 1
1 148 1 1 9 PHE O O -0.251 2.012 2.427 1.00 . A A . 9 PHE O 1 1
1 149 1 1 10 ILE C C 0.391 2.832 -0.499 1.00 . A A . 10 ILE C 1 1
1 150 1 1 10 ILE CA C -0.486 3.899 0.258 1.00 . A A . 10 ILE CA 1 1
1 151 1 1 10 ILE CB C 0.257 4.970 1.137 1.00 . A A . 10 ILE CB 1 1
1 152 1 1 10 ILE CD1 C -0.170 6.744 3.020 1.00 . A A . 10 ILE CD1 1 1
1 153 1 1 10 ILE CG1 C -0.718 6.003 1.790 1.00 . A A . 10 ILE CG1 1 1
1 154 1 1 10 ILE CG2 C 1.356 5.749 0.361 1.00 . A A . 10 ILE CG2 1 1
1 155 1 1 10 ILE H H -2.542 3.250 0.640 1.00 . A A . 10 ILE H 1 1
1 156 1 1 10 ILE HA H -0.960 4.548 -0.478 1.00 . A A . 10 ILE HA 1 1
1 157 1 1 10 ILE HB H 0.750 4.402 1.932 1.00 . A A . 10 ILE HB 1 1
1 158 1 1 10 ILE HD11 H 0.708 7.369 2.775 1.00 . A A . 10 ILE HD11 1 1
1 159 1 1 10 ILE HD12 H 0.131 6.043 3.819 1.00 . A A . 10 ILE HD12 1 1
1 160 1 1 10 ILE HD13 H -0.935 7.417 3.449 1.00 . A A . 10 ILE HD13 1 1
1 161 1 1 10 ILE HG12 H -1.049 6.745 1.034 1.00 . A A . 10 ILE HG12 1 1
1 162 1 1 10 ILE HG13 H -1.644 5.489 2.111 1.00 . A A . 10 ILE HG13 1 1
1 163 1 1 10 ILE HG21 H 1.887 6.473 1.005 1.00 . A A . 10 ILE HG21 1 1
1 164 1 1 10 ILE HG22 H 0.934 6.317 -0.489 1.00 . A A . 10 ILE HG22 1 1
1 165 1 1 10 ILE HG23 H 2.139 5.090 -0.051 1.00 . A A . 10 ILE HG23 1 1
1 166 1 1 10 ILE N N -1.576 3.166 0.982 1.00 . A A . 10 ILE N 1 1
1 167 1 1 10 ILE O O 1.572 2.711 -0.169 1.00 . A A . 10 ILE O 1 1
1 168 1 1 11 ASN C C 1.441 0.042 -1.286 1.00 . A A . 11 ASN C 1 1
1 169 1 1 11 ASN CA C 0.597 0.979 -2.223 1.00 . A A . 11 ASN CA 1 1
1 170 1 1 11 ASN CB C 1.262 1.725 -3.407 1.00 . A A . 11 ASN CB 1 1
1 171 1 1 11 ASN CG C 2.252 0.977 -4.314 1.00 . A A . 11 ASN CG 1 1
1 172 1 1 11 ASN H H -1.017 2.348 -1.919 1.00 . A A . 11 ASN H 1 1
1 173 1 1 11 ASN HA H -0.113 0.330 -2.742 1.00 . A A . 11 ASN HA 1 1
1 174 1 1 11 ASN HB2 H 0.472 2.149 -4.059 1.00 . A A . 11 ASN HB2 1 1
1 175 1 1 11 ASN HB3 H 1.744 2.609 -2.983 1.00 . A A . 11 ASN HB3 1 1
1 176 1 1 11 ASN HD21 H 2.468 -0.474 -5.682 1.00 . A A . 11 ASN HD21 1 1
1 177 1 1 11 ASN HD22 H 0.784 -0.204 -5.004 1.00 . A A . 11 ASN HD22 1 1
1 178 1 1 11 ASN N N -0.162 2.025 -1.464 1.00 . A A . 11 ASN N 1 1
1 179 1 1 11 ASN ND2 N 1.787 0.000 -5.079 1.00 . A A . 11 ASN ND2 1 1
1 180 1 1 11 ASN O O 2.635 -0.146 -1.521 1.00 . A A . 11 ASN O 1 1
1 181 1 1 11 ASN OD1 O 3.439 1.296 -4.350 1.00 . A A . 11 ASN OD1 1 1
1 182 1 1 12 ASN C C 2.673 -0.710 1.477 1.00 . A A . 12 ASN C 1 1
1 183 1 1 12 ASN CA C 1.477 -1.430 0.776 1.00 . A A . 12 ASN CA 1 1
1 184 1 1 12 ASN CB C 1.730 -2.814 0.136 1.00 . A A . 12 ASN CB 1 1
1 185 1 1 12 ASN CG C 2.095 -3.961 1.099 1.00 . A A . 12 ASN CG 1 1
1 186 1 1 12 ASN H H -0.203 -0.408 -0.147 1.00 . A A . 12 ASN H 1 1
1 187 1 1 12 ASN HA H 0.759 -1.645 1.553 1.00 . A A . 12 ASN HA 1 1
1 188 1 1 12 ASN HB2 H 0.835 -3.094 -0.458 1.00 . A A . 12 ASN HB2 1 1
1 189 1 1 12 ASN HB3 H 2.536 -2.695 -0.593 1.00 . A A . 12 ASN HB3 1 1
1 190 1 1 12 ASN HD21 H 1.374 -5.377 2.324 1.00 . A A . 12 ASN HD21 1 1
1 191 1 1 12 ASN HD22 H 0.153 -4.311 1.464 1.00 . A A . 12 ASN HD22 1 1
1 192 1 1 12 ASN N N 0.813 -0.532 -0.216 1.00 . A A . 12 ASN N 1 1
1 193 1 1 12 ASN ND2 N 1.106 -4.616 1.689 1.00 . A A . 12 ASN ND2 1 1
1 194 1 1 12 ASN O O 3.756 -1.293 1.558 1.00 . A A . 12 ASN O 1 1
1 195 1 1 12 ASN OD1 O 3.267 -4.268 1.315 1.00 . A A . 12 ASN OD1 1 1
1 196 1 1 13 LYS C C 4.743 1.540 1.679 1.00 . A A . 13 LYS C 1 1
1 197 1 1 13 LYS CA C 3.562 1.329 2.695 1.00 . A A . 13 LYS CA 1 1
1 198 1 1 13 LYS CB C 3.987 0.740 4.074 1.00 . A A . 13 LYS CB 1 1
1 199 1 1 13 LYS CD C 3.009 2.161 6.066 1.00 . A A . 13 LYS CD 1 1
1 200 1 1 13 LYS CE C 2.597 3.495 5.410 1.00 . A A . 13 LYS CE 1 1
1 201 1 1 13 LYS CG C 2.954 0.865 5.219 1.00 . A A . 13 LYS CG 1 1
1 202 1 1 13 LYS H H 1.549 0.953 1.894 1.00 . A A . 13 LYS H 1 1
1 203 1 1 13 LYS HA H 3.161 2.325 2.901 1.00 . A A . 13 LYS HA 1 1
1 204 1 1 13 LYS HB2 H 4.244 -0.328 3.944 1.00 . A A . 13 LYS HB2 1 1
1 205 1 1 13 LYS HB3 H 4.930 1.208 4.409 1.00 . A A . 13 LYS HB3 1 1
1 206 1 1 13 LYS HD2 H 2.384 2.011 6.966 1.00 . A A . 13 LYS HD2 1 1
1 207 1 1 13 LYS HD3 H 4.035 2.275 6.463 1.00 . A A . 13 LYS HD3 1 1
1 208 1 1 13 LYS HE2 H 2.740 4.313 6.139 1.00 . A A . 13 LYS HE2 1 1
1 209 1 1 13 LYS HE3 H 3.268 3.741 4.568 1.00 . A A . 13 LYS HE3 1 1
1 210 1 1 13 LYS HG2 H 1.933 0.696 4.835 1.00 . A A . 13 LYS HG2 1 1
1 211 1 1 13 LYS HG3 H 3.127 0.021 5.913 1.00 . A A . 13 LYS HG3 1 1
1 212 1 1 13 LYS HZ2 H 1.034 2.775 4.268 1.00 . A A . 13 LYS HZ2 1 1
1 213 1 1 13 LYS HZ3 H 0.565 3.318 5.736 1.00 . A A . 13 LYS HZ3 1 1
1 214 1 1 13 LYS N N 2.479 0.531 2.023 1.00 . A A . 13 LYS N 1 1
1 215 1 1 13 LYS NZ N 1.195 3.522 4.952 1.00 . A A . 13 LYS NZ 1 1
1 216 1 1 13 LYS O O 5.910 1.413 2.061 1.00 . A A . 13 LYS O 1 1
1 217 1 1 14 HIS C C 6.271 0.755 -0.858 1.00 . A A . 14 HIS C 1 1
1 218 1 1 14 HIS CA C 5.458 2.087 -0.693 1.00 . A A . 14 HIS CA 1 1
1 219 1 1 14 HIS CB C 6.242 3.400 -0.465 1.00 . A A . 14 HIS CB 1 1
1 220 1 1 14 HIS CD2 C 7.691 5.115 -1.693 1.00 . A A . 14 HIS CD2 1 1
1 221 1 1 14 HIS CE1 C 7.653 4.320 -3.637 1.00 . A A . 14 HIS CE1 1 1
1 222 1 1 14 HIS CG C 6.936 3.938 -1.704 1.00 . A A . 14 HIS CG 1 1
1 223 1 1 14 HIS H H 3.472 2.174 0.207 1.00 . A A . 14 HIS H 1 1
1 224 1 1 14 HIS HA H 4.916 2.222 -1.630 1.00 . A A . 14 HIS HA 1 1
1 225 1 1 14 HIS HB2 H 5.537 4.178 -0.116 1.00 . A A . 14 HIS HB2 1 1
1 226 1 1 14 HIS HB3 H 6.980 3.286 0.352 1.00 . A A . 14 HIS HB3 1 1
1 227 1 1 14 HIS HD2 H 7.834 5.722 -0.812 1.00 . A A . 14 HIS HD2 1 1
1 228 1 1 14 HIS HE1 H 7.838 4.214 -4.697 1.00 . A A . 14 HIS HE1 1 1
1 229 1 1 14 HIS HE2 H 8.751 6.169 -3.291 1.00 . A A . 14 HIS HE2 1 1
1 230 1 1 14 HIS N N 4.444 1.890 0.386 1.00 . A A . 14 HIS N 1 1
1 231 1 1 14 HIS ND1 N 6.883 3.388 -2.979 1.00 . A A . 14 HIS ND1 1 1
1 232 1 1 14 HIS NE2 N 8.179 5.385 -2.955 1.00 . A A . 14 HIS NE2 1 1
1 233 1 1 14 HIS O O 7.500 0.812 -0.953 1.00 . A A . 14 HIS O 1 1
1 234 1 1 15 LEU C C 7.195 -1.974 0.204 1.00 . A A . 15 LEU C 1 1
1 235 1 1 15 LEU CA C 6.261 -1.773 -1.046 1.00 . A A . 15 LEU CA 1 1
1 236 1 1 15 LEU CB C 6.936 -2.037 -2.432 1.00 . A A . 15 LEU CB 1 1
1 237 1 1 15 LEU CD1 C 5.324 -3.848 -3.341 1.00 . A A . 15 LEU CD1 1 1
1 238 1 1 15 LEU CD2 C 5.007 -1.440 -4.031 1.00 . A A . 15 LEU CD2 1 1
1 239 1 1 15 LEU CG C 6.044 -2.495 -3.620 1.00 . A A . 15 LEU CG 1 1
1 240 1 1 15 LEU H H 4.556 -0.405 -0.847 1.00 . A A . 15 LEU H 1 1
1 241 1 1 15 LEU HA H 5.482 -2.525 -0.938 1.00 . A A . 15 LEU HA 1 1
1 242 1 1 15 LEU HB2 H 7.523 -1.149 -2.735 1.00 . A A . 15 LEU HB2 1 1
1 243 1 1 15 LEU HB3 H 7.701 -2.825 -2.312 1.00 . A A . 15 LEU HB3 1 1
1 244 1 1 15 LEU HD11 H 6.017 -4.643 -3.006 1.00 . A A . 15 LEU HD11 1 1
1 245 1 1 15 LEU HD12 H 4.554 -3.768 -2.545 1.00 . A A . 15 LEU HD12 1 1
1 246 1 1 15 LEU HD13 H 4.789 -4.241 -4.226 1.00 . A A . 15 LEU HD13 1 1
1 247 1 1 15 LEU HD21 H 5.482 -0.457 -4.206 1.00 . A A . 15 LEU HD21 1 1
1 248 1 1 15 LEU HD22 H 4.233 -1.299 -3.254 1.00 . A A . 15 LEU HD22 1 1
1 249 1 1 15 LEU HD23 H 4.485 -1.725 -4.962 1.00 . A A . 15 LEU HD23 1 1
1 250 1 1 15 LEU HG H 6.740 -2.588 -4.490 1.00 . A A . 15 LEU HG 1 1
1 251 1 1 15 LEU N N 5.590 -0.439 -0.928 1.00 . A A . 15 LEU N 1 1
1 252 1 1 15 LEU O O 8.310 -2.486 0.059 1.00 . A A . 15 LEU O 1 1
1 253 1 1 16 ASN C C 8.882 -0.923 2.521 1.00 . A A . 16 ASN C 1 1
1 254 1 1 16 ASN CA C 7.525 -1.707 2.707 1.00 . A A . 16 ASN CA 1 1
1 255 1 1 16 ASN CB C 7.572 -3.169 3.185 1.00 . A A . 16 ASN CB 1 1
1 256 1 1 16 ASN CG C 8.064 -3.394 4.628 1.00 . A A . 16 ASN CG 1 1
1 257 1 1 16 ASN H H 5.764 -1.259 1.512 1.00 . A A . 16 ASN H 1 1
1 258 1 1 16 ASN HA H 6.953 -1.196 3.487 1.00 . A A . 16 ASN HA 1 1
1 259 1 1 16 ASN HB2 H 6.559 -3.603 3.055 1.00 . A A . 16 ASN HB2 1 1
1 260 1 1 16 ASN HB3 H 8.219 -3.718 2.497 1.00 . A A . 16 ASN HB3 1 1
1 261 1 1 16 ASN HD21 H 7.527 -3.477 6.559 1.00 . A A . 16 ASN HD21 1 1
1 262 1 1 16 ASN HD22 H 6.207 -3.118 5.335 1.00 . A A . 16 ASN HD22 1 1
1 263 1 1 16 ASN N N 6.733 -1.604 1.447 1.00 . A A . 16 ASN N 1 1
1 264 1 1 16 ASN ND2 N 7.175 -3.322 5.607 1.00 . A A . 16 ASN ND2 1 1
1 265 1 1 16 ASN O O 9.950 -1.430 2.877 1.00 . A A . 16 ASN O 1 1
1 266 1 1 16 ASN OD1 O 9.246 -3.637 4.870 1.00 . A A . 16 ASN OD1 1 1
1 267 1 1 17 GLU C C 10.968 0.512 0.625 1.00 . A A . 17 GLU C 1 1
1 268 1 1 17 GLU CA C 9.997 1.183 1.666 1.00 . A A . 17 GLU CA 1 1
1 269 1 1 17 GLU CB C 10.653 1.749 2.946 1.00 . A A . 17 GLU CB 1 1
1 270 1 1 17 GLU CD C 10.329 3.006 5.154 1.00 . A A . 17 GLU CD 1 1
1 271 1 1 17 GLU CG C 9.721 2.637 3.800 1.00 . A A . 17 GLU CG 1 1
1 272 1 1 17 GLU H H 7.880 0.645 1.650 1.00 . A A . 17 GLU H 1 1
1 273 1 1 17 GLU HA H 9.611 2.076 1.167 1.00 . A A . 17 GLU HA 1 1
1 274 1 1 17 GLU HB2 H 11.013 0.896 3.526 1.00 . A A . 17 GLU HB2 1 1
1 275 1 1 17 GLU HB3 H 11.556 2.332 2.681 1.00 . A A . 17 GLU HB3 1 1
1 276 1 1 17 GLU HE2 H 11.490 4.360 5.936 1.00 . A A . 17 GLU HE2 1 1
1 277 1 1 17 GLU HG2 H 9.462 3.557 3.244 1.00 . A A . 17 GLU HG2 1 1
1 278 1 1 17 GLU HG3 H 8.757 2.115 3.961 1.00 . A A . 17 GLU HG3 1 1
1 279 1 1 17 GLU N N 8.817 0.316 1.942 1.00 . A A . 17 GLU N 1 1
1 280 1 1 17 GLU O O 12.187 0.520 0.822 1.00 . A A . 17 GLU O 1 1
1 281 1 1 17 GLU OE1 O 10.134 2.359 6.183 1.00 . A A . 17 GLU OE1 1 1
1 282 1 1 17 GLU OE2 O 11.110 4.132 5.084 1.00 . A A . 17 GLU OE2 1 1
1 283 1 1 18 HIS C C 12.052 -1.932 -1.051 1.00 . A A . 18 HIS C 1 1
1 284 1 1 18 HIS CA C 11.184 -0.743 -1.569 1.00 . A A . 18 HIS CA 1 1
1 285 1 1 18 HIS CB C 11.904 0.314 -2.436 1.00 . A A . 18 HIS CB 1 1
1 286 1 1 18 HIS CD2 C 12.947 0.665 -4.748 1.00 . A A . 18 HIS CD2 1 1
1 287 1 1 18 HIS CE1 C 12.595 -1.217 -5.613 1.00 . A A . 18 HIS CE1 1 1
1 288 1 1 18 HIS CG C 12.299 -0.162 -3.825 1.00 . A A . 18 HIS CG 1 1
1 289 1 1 18 HIS H H 9.398 0.005 -0.591 1.00 . A A . 18 HIS H 1 1
1 290 1 1 18 HIS HA H 10.416 -1.174 -2.242 1.00 . A A . 18 HIS HA 1 1
1 291 1 1 18 HIS HB2 H 11.220 1.175 -2.564 1.00 . A A . 18 HIS HB2 1 1
1 292 1 1 18 HIS HB3 H 12.793 0.720 -1.917 1.00 . A A . 18 HIS HB3 1 1
1 293 1 1 18 HIS HD2 H 13.211 1.691 -4.544 1.00 . A A . 18 HIS HD2 1 1
1 294 1 1 18 HIS HE1 H 12.577 -2.014 -6.343 1.00 . A A . 18 HIS HE1 1 1
1 295 1 1 18 HIS HE2 H 13.590 0.308 -6.808 1.00 . A A . 18 HIS HE2 1 1
1 296 1 1 18 HIS N N 10.420 -0.065 -0.487 1.00 . A A . 18 HIS N 1 1
1 297 1 1 18 HIS ND1 N 12.043 -1.416 -4.368 1.00 . A A . 18 HIS ND1 1 1
1 298 1 1 18 HIS NE2 N 13.158 -0.010 -5.933 1.00 . A A . 18 HIS NE2 1 1
1 299 1 1 18 HIS O O 13.259 -1.787 -0.830 1.00 . A A . 18 HIS O 1 1
1 300 1 1 19 ALA C C 11.159 -5.527 -0.733 1.00 . A A . 19 ALA C 1 1
1 301 1 1 19 ALA CA C 12.055 -4.322 -0.348 1.00 . A A . 19 ALA CA 1 1
1 302 1 1 19 ALA CB C 12.317 -4.267 1.175 1.00 . A A . 19 ALA CB 1 1
1 303 1 1 19 ALA H H 10.445 -3.129 -1.198 1.00 . A A . 19 ALA H 1 1
1 304 1 1 19 ALA HA H 13.029 -4.406 -0.859 1.00 . A A . 19 ALA HA 1 1
1 305 1 1 19 ALA HB1 H 11.385 -4.140 1.758 1.00 . A A . 19 ALA HB1 1 1
1 306 1 1 19 ALA HB2 H 12.805 -5.192 1.534 1.00 . A A . 19 ALA HB2 1 1
1 307 1 1 19 ALA HB3 H 12.987 -3.430 1.445 1.00 . A A . 19 ALA HB3 1 1
1 308 1 1 19 ALA N N 11.400 -3.092 -0.838 1.00 . A A . 19 ALA N 1 1
1 309 1 1 19 ALA O O 10.129 -5.783 -0.099 1.00 . A A . 19 ALA O 1 1
1 310 1 1 20 HIS C C 11.035 -8.706 -1.362 1.00 . A A . 20 HIS C 1 1
1 311 1 1 20 HIS CA C 10.839 -7.459 -2.282 1.00 . A A . 20 HIS CA 1 1
1 312 1 1 20 HIS CB C 11.198 -7.679 -3.776 1.00 . A A . 20 HIS CB 1 1
1 313 1 1 20 HIS CD2 C 10.429 -8.941 -5.873 1.00 . A A . 20 HIS CD2 1 1
1 314 1 1 20 HIS CE1 C 8.644 -9.794 -5.166 1.00 . A A . 20 HIS CE1 1 1
1 315 1 1 20 HIS CG C 10.242 -8.592 -4.531 1.00 . A A . 20 HIS CG 1 1
1 316 1 1 20 HIS H H 12.344 -5.870 -2.312 1.00 . A A . 20 HIS H 1 1
1 317 1 1 20 HIS HA H 9.769 -7.195 -2.277 1.00 . A A . 20 HIS HA 1 1
1 318 1 1 20 HIS HB2 H 11.204 -6.718 -4.326 1.00 . A A . 20 HIS HB2 1 1
1 319 1 1 20 HIS HB3 H 12.230 -8.064 -3.878 1.00 . A A . 20 HIS HB3 1 1
1 320 1 1 20 HIS HD2 H 11.257 -8.595 -6.472 1.00 . A A . 20 HIS HD2 1 1
1 321 1 1 20 HIS HE1 H 7.718 -10.351 -5.153 1.00 . A A . 20 HIS HE1 1 1
1 322 1 1 20 HIS HE2 H 9.216 -10.148 -7.237 1.00 . A A . 20 HIS HE2 1 1
1 323 1 1 20 HIS N N 11.574 -6.272 -1.777 1.00 . A A . 20 HIS N 1 1
1 324 1 1 20 HIS ND1 N 9.061 -9.133 -4.034 1.00 . A A . 20 HIS ND1 1 1
1 325 1 1 20 HIS NE2 N 9.392 -9.740 -6.312 1.00 . A A . 20 HIS NE2 1 1
1 326 1 1 20 HIS O O 10.102 -9.119 -0.674 1.00 . A A . 20 HIS O 1 1
2 327 1 1 1 SER C C -12.327 -3.564 -0.222 1.00 . A A . 1 SER C 1 1
2 328 1 1 1 SER CA C -12.699 -3.595 1.301 1.00 . A A . 1 SER CA 1 1
2 329 1 1 1 SER CB C -13.401 -4.904 1.735 1.00 . A A . 1 SER CB 1 1
2 330 1 1 1 SER H1 H -14.556 -2.440 1.456 1.00 . A A . 1 SER H1 1 1
2 331 1 1 1 SER HA H -11.737 -3.556 1.839 1.00 . A A . 1 SER HA 1 1
2 332 1 1 1 SER HB2 H -13.770 -4.830 2.777 1.00 . A A . 1 SER HB2 1 1
2 333 1 1 1 SER HB3 H -14.290 -5.107 1.103 1.00 . A A . 1 SER HB3 1 1
2 334 1 1 1 SER HG H -13.009 -6.776 1.944 1.00 . A A . 1 SER HG 1 1
2 335 1 1 1 SER N N -13.582 -2.482 1.764 1.00 . A A . 1 SER N 1 1
2 336 1 1 1 SER O O -12.116 -4.610 -0.845 1.00 . A A . 1 SER O 1 1
2 337 1 1 1 SER OG O -12.507 -6.009 1.658 1.00 . A A . 1 SER OG 1 1
2 338 1 1 2 ASP C C -11.317 -0.664 -2.349 1.00 . A A . 2 ASP C 1 1
2 339 1 1 2 ASP CA C -11.829 -2.135 -2.216 1.00 . A A . 2 ASP CA 1 1
2 340 1 1 2 ASP CB C -13.005 -2.490 -3.186 1.00 . A A . 2 ASP CB 1 1
2 341 1 1 2 ASP CG C -12.564 -2.666 -4.644 1.00 . A A . 2 ASP CG 1 1
2 342 1 1 2 ASP H H -12.319 -1.587 -0.142 1.00 . A A . 2 ASP H 1 1
2 343 1 1 2 ASP HA H -10.957 -2.791 -2.408 1.00 . A A . 2 ASP HA 1 1
2 344 1 1 2 ASP HB2 H -13.548 -3.410 -2.878 1.00 . A A . 2 ASP HB2 1 1
2 345 1 1 2 ASP HB3 H -13.783 -1.705 -3.137 1.00 . A A . 2 ASP HB3 1 1
2 346 1 1 2 ASP HD2 H -12.090 -4.475 -4.103 1.00 . A A . 2 ASP HD2 1 1
2 347 1 1 2 ASP N N -12.218 -2.356 -0.804 1.00 . A A . 2 ASP N 1 1
2 348 1 1 2 ASP O O -11.966 0.195 -2.956 1.00 . A A . 2 ASP O 1 1
2 349 1 1 2 ASP OD1 O -12.644 -1.775 -5.488 1.00 . A A . 2 ASP OD1 1 1
2 350 1 1 2 ASP OD2 O -12.071 -3.923 -4.888 1.00 . A A . 2 ASP OD2 1 1
2 351 1 1 3 THR C C -7.955 0.726 -1.927 1.00 . A A . 3 THR C 1 1
2 352 1 1 3 THR CA C -9.472 0.924 -1.781 1.00 . A A . 3 THR CA 1 1
2 353 1 1 3 THR CB C -10.020 1.788 -0.603 1.00 . A A . 3 THR CB 1 1
2 354 1 1 3 THR CG2 C -9.397 1.613 0.790 1.00 . A A . 3 THR CG2 1 1
2 355 1 1 3 THR H H -9.728 -1.073 -1.159 1.00 . A A . 3 THR H 1 1
2 356 1 1 3 THR HA H -9.709 1.453 -2.685 1.00 . A A . 3 THR HA 1 1
2 357 1 1 3 THR HB H -11.085 1.521 -0.493 1.00 . A A . 3 THR HB 1 1
2 358 1 1 3 THR HG1 H -8.992 3.357 -1.026 1.00 . A A . 3 THR HG1 1 1
2 359 1 1 3 THR HG21 H -9.953 2.178 1.554 1.00 . A A . 3 THR HG21 1 1
2 360 1 1 3 THR HG22 H -9.351 0.555 1.088 1.00 . A A . 3 THR HG22 1 1
2 361 1 1 3 THR HG23 H -8.369 2.001 0.823 1.00 . A A . 3 THR HG23 1 1
2 362 1 1 3 THR N N -10.129 -0.388 -1.774 1.00 . A A . 3 THR N 1 1
2 363 1 1 3 THR O O -7.211 1.193 -1.086 1.00 . A A . 3 THR O 1 1
2 364 1 1 3 THR OG1 O -9.929 3.165 -0.948 1.00 . A A . 3 THR OG1 1 1
2 365 1 1 4 ARG C C -5.109 1.183 -3.150 1.00 . A A . 4 ARG C 1 1
2 366 1 1 4 ARG CA C -5.989 -0.090 -3.262 1.00 . A A . 4 ARG CA 1 1
2 367 1 1 4 ARG CB C -5.726 -0.837 -4.606 1.00 . A A . 4 ARG CB 1 1
2 368 1 1 4 ARG CD C -6.169 -3.299 -3.828 1.00 . A A . 4 ARG CD 1 1
2 369 1 1 4 ARG CG C -6.462 -2.181 -4.849 1.00 . A A . 4 ARG CG 1 1
2 370 1 1 4 ARG CZ C -7.047 -5.592 -3.324 1.00 . A A . 4 ARG CZ 1 1
2 371 1 1 4 ARG H H -8.185 -0.306 -3.593 1.00 . A A . 4 ARG H 1 1
2 372 1 1 4 ARG HA H -5.623 -0.679 -2.395 1.00 . A A . 4 ARG HA 1 1
2 373 1 1 4 ARG HB2 H -5.981 -0.165 -5.452 1.00 . A A . 4 ARG HB2 1 1
2 374 1 1 4 ARG HB3 H -4.640 -1.014 -4.732 1.00 . A A . 4 ARG HB3 1 1
2 375 1 1 4 ARG HD2 H -5.090 -3.544 -3.829 1.00 . A A . 4 ARG HD2 1 1
2 376 1 1 4 ARG HD3 H -6.420 -2.953 -2.808 1.00 . A A . 4 ARG HD3 1 1
2 377 1 1 4 ARG HG2 H -7.551 -1.990 -4.890 1.00 . A A . 4 ARG HG2 1 1
2 378 1 1 4 ARG HG3 H -6.198 -2.538 -5.863 1.00 . A A . 4 ARG HG3 1 1
2 379 1 1 4 ARG HH11 H -8.214 -6.529 -4.655 1.00 . A A . 4 ARG HH11 1 1
2 380 1 1 4 ARG HH12 H -7.836 -7.418 -3.095 1.00 . A A . 4 ARG HH12 1 1
2 381 1 1 4 ARG HH21 H -6.616 -6.544 -1.603 1.00 . A A . 4 ARG HH21 1 1
2 382 1 1 4 ARG HH22 H -5.904 -4.868 -1.834 1.00 . A A . 4 ARG HH22 1 1
2 383 1 1 4 ARG N N -7.458 0.106 -3.016 1.00 . A A . 4 ARG N 1 1
2 384 1 1 4 ARG NE N -6.945 -4.524 -4.139 1.00 . A A . 4 ARG NE 1 1
2 385 1 1 4 ARG NH1 N -7.773 -6.617 -3.733 1.00 . A A . 4 ARG NH1 1 1
2 386 1 1 4 ARG NH2 N -6.462 -5.677 -2.130 1.00 . A A . 4 ARG NH2 1 1
2 387 1 1 4 ARG O O -3.937 1.073 -2.780 1.00 . A A . 4 ARG O 1 1
2 388 1 1 5 TYR C C -5.205 4.343 -1.920 1.00 . A A . 5 TYR C 1 1
2 389 1 1 5 TYR CA C -5.001 3.667 -3.340 1.00 . A A . 5 TYR CA 1 1
2 390 1 1 5 TYR CB C -5.401 4.547 -4.563 1.00 . A A . 5 TYR CB 1 1
2 391 1 1 5 TYR CD1 C -4.690 7.001 -4.546 1.00 . A A . 5 TYR CD1 1 1
2 392 1 1 5 TYR CD2 C -3.250 5.395 -5.631 1.00 . A A . 5 TYR CD2 1 1
2 393 1 1 5 TYR CE1 C -3.793 8.018 -4.863 1.00 . A A . 5 TYR CE1 1 1
2 394 1 1 5 TYR CE2 C -2.354 6.413 -5.949 1.00 . A A . 5 TYR CE2 1 1
2 395 1 1 5 TYR CG C -4.422 5.679 -4.919 1.00 . A A . 5 TYR CG 1 1
2 396 1 1 5 TYR CZ C -2.625 7.724 -5.564 1.00 . A A . 5 TYR CZ 1 1
2 397 1 1 5 TYR H H -6.663 2.252 -3.747 1.00 . A A . 5 TYR H 1 1
2 398 1 1 5 TYR HA H -3.946 3.435 -3.383 1.00 . A A . 5 TYR HA 1 1
2 399 1 1 5 TYR HB2 H -5.508 3.919 -5.470 1.00 . A A . 5 TYR HB2 1 1
2 400 1 1 5 TYR HB3 H -6.421 4.950 -4.406 1.00 . A A . 5 TYR HB3 1 1
2 401 1 1 5 TYR HD1 H -5.590 7.245 -4.000 1.00 . A A . 5 TYR HD1 1 1
2 402 1 1 5 TYR HD2 H -3.022 4.381 -5.931 1.00 . A A . 5 TYR HD2 1 1
2 403 1 1 5 TYR HE1 H -4.005 9.034 -4.562 1.00 . A A . 5 TYR HE1 1 1
2 404 1 1 5 TYR HE2 H -1.447 6.181 -6.489 1.00 . A A . 5 TYR HE2 1 1
2 405 1 1 5 TYR HH H -0.992 8.349 -6.343 1.00 . A A . 5 TYR HH 1 1
2 406 1 1 5 TYR N N -5.687 2.358 -3.468 1.00 . A A . 5 TYR N 1 1
2 407 1 1 5 TYR O O -5.021 5.552 -1.756 1.00 . A A . 5 TYR O 1 1
2 408 1 1 5 TYR OH O -1.736 8.725 -5.866 1.00 . A A . 5 TYR OH 1 1
2 409 1 1 6 ASN C C -5.826 2.708 1.551 1.00 . A A . 6 ASN C 1 1
2 410 1 1 6 ASN CA C -5.766 3.895 0.521 1.00 . A A . 6 ASN CA 1 1
2 411 1 1 6 ASN CB C -7.028 4.769 0.578 1.00 . A A . 6 ASN CB 1 1
2 412 1 1 6 ASN CG C -7.238 5.664 1.813 1.00 . A A . 6 ASN CG 1 1
2 413 1 1 6 ASN H H -5.965 2.701 -1.256 1.00 . A A . 6 ASN H 1 1
2 414 1 1 6 ASN HA H -4.950 4.515 0.827 1.00 . A A . 6 ASN HA 1 1
2 415 1 1 6 ASN HB2 H -7.072 5.380 -0.333 1.00 . A A . 6 ASN HB2 1 1
2 416 1 1 6 ASN HB3 H -7.851 4.070 0.475 1.00 . A A . 6 ASN HB3 1 1
2 417 1 1 6 ASN HD21 H -6.749 7.401 2.690 1.00 . A A . 6 ASN HD21 1 1
2 418 1 1 6 ASN HD22 H -5.988 7.040 1.059 1.00 . A A . 6 ASN HD22 1 1
2 419 1 1 6 ASN N N -5.519 3.525 -0.889 1.00 . A A . 6 ASN N 1 1
2 420 1 1 6 ASN ND2 N -6.592 6.820 1.859 1.00 . A A . 6 ASN ND2 1 1
2 421 1 1 6 ASN O O -5.946 3.017 2.741 1.00 . A A . 6 ASN O 1 1
2 422 1 1 6 ASN OD1 O -7.986 5.324 2.731 1.00 . A A . 6 ASN OD1 1 1
2 423 1 1 7 LYS C C -5.021 0.396 3.406 1.00 . A A . 7 LYS C 1 1
2 424 1 1 7 LYS CA C -5.783 0.204 2.072 1.00 . A A . 7 LYS CA 1 1
2 425 1 1 7 LYS CB C -5.284 -1.039 1.255 1.00 . A A . 7 LYS CB 1 1
2 426 1 1 7 LYS CD C -7.634 -2.191 0.873 1.00 . A A . 7 LYS CD 1 1
2 427 1 1 7 LYS CE C -7.564 -3.367 1.865 1.00 . A A . 7 LYS CE 1 1
2 428 1 1 7 LYS CG C -6.273 -1.750 0.309 1.00 . A A . 7 LYS CG 1 1
2 429 1 1 7 LYS H H -5.851 1.199 0.170 1.00 . A A . 7 LYS H 1 1
2 430 1 1 7 LYS HA H -6.834 0.078 2.339 1.00 . A A . 7 LYS HA 1 1
2 431 1 1 7 LYS HB2 H -4.396 -0.741 0.651 1.00 . A A . 7 LYS HB2 1 1
2 432 1 1 7 LYS HB3 H -4.874 -1.797 1.941 1.00 . A A . 7 LYS HB3 1 1
2 433 1 1 7 LYS HD2 H -8.135 -1.321 1.333 1.00 . A A . 7 LYS HD2 1 1
2 434 1 1 7 LYS HD3 H -8.269 -2.457 0.010 1.00 . A A . 7 LYS HD3 1 1
2 435 1 1 7 LYS HE2 H -7.063 -4.236 1.398 1.00 . A A . 7 LYS HE2 1 1
2 436 1 1 7 LYS HE3 H -6.956 -3.094 2.747 1.00 . A A . 7 LYS HE3 1 1
2 437 1 1 7 LYS HG2 H -6.479 -1.073 -0.523 1.00 . A A . 7 LYS HG2 1 1
2 438 1 1 7 LYS HG3 H -5.769 -2.616 -0.161 1.00 . A A . 7 LYS HG3 1 1
2 439 1 1 7 LYS HZ2 H -9.387 -2.977 2.750 1.00 . A A . 7 LYS HZ2 1 1
2 440 1 1 7 LYS HZ3 H -9.485 -4.031 1.505 1.00 . A A . 7 LYS HZ3 1 1
2 441 1 1 7 LYS N N -5.737 1.398 1.169 1.00 . A A . 7 LYS N 1 1
2 442 1 1 7 LYS NZ N -8.908 -3.771 2.313 1.00 . A A . 7 LYS NZ 1 1
2 443 1 1 7 LYS O O -5.568 0.388 4.511 1.00 . A A . 7 LYS O 1 1
2 444 1 1 8 SER C C -1.960 2.107 3.555 1.00 . A A . 8 SER C 1 1
2 445 1 1 8 SER CA C -2.721 0.900 4.194 1.00 . A A . 8 SER CA 1 1
2 446 1 1 8 SER CB C -1.938 -0.389 4.434 1.00 . A A . 8 SER CB 1 1
2 447 1 1 8 SER H H -3.558 0.396 2.188 1.00 . A A . 8 SER H 1 1
2 448 1 1 8 SER HA H -3.198 1.145 5.127 1.00 . A A . 8 SER HA 1 1
2 449 1 1 8 SER HB2 H -2.642 -1.239 4.514 1.00 . A A . 8 SER HB2 1 1
2 450 1 1 8 SER HB3 H -1.317 -0.589 3.561 1.00 . A A . 8 SER HB3 1 1
2 451 1 1 8 SER HG H -1.719 -0.134 6.326 1.00 . A A . 8 SER HG 1 1
2 452 1 1 8 SER N N -3.737 0.609 3.175 1.00 . A A . 8 SER N 1 1
2 453 1 1 8 SER O O -0.747 2.014 3.354 1.00 . A A . 8 SER O 1 1
2 454 1 1 8 SER OG O -1.120 -0.292 5.593 1.00 . A A . 8 SER OG 1 1
2 455 1 1 9 PHE C C -1.370 4.026 1.235 1.00 . A A . 9 PHE C 1 1
2 456 1 1 9 PHE CA C -2.003 4.456 2.617 1.00 . A A . 9 PHE CA 1 1
2 457 1 1 9 PHE CB C -1.119 5.256 3.603 1.00 . A A . 9 PHE CB 1 1
2 458 1 1 9 PHE CD1 C -1.230 7.495 2.296 1.00 . A A . 9 PHE CD1 1 1
2 459 1 1 9 PHE CD2 C 0.619 7.082 3.793 1.00 . A A . 9 PHE CD2 1 1
2 460 1 1 9 PHE CE1 C -0.706 8.751 1.999 1.00 . A A . 9 PHE CE1 1 1
2 461 1 1 9 PHE CE2 C 1.136 8.341 3.500 1.00 . A A . 9 PHE CE2 1 1
2 462 1 1 9 PHE CG C -0.566 6.641 3.190 1.00 . A A . 9 PHE CG 1 1
2 463 1 1 9 PHE CZ C 0.475 9.173 2.602 1.00 . A A . 9 PHE CZ 1 1
2 464 1 1 9 PHE H H -3.540 3.426 3.717 1.00 . A A . 9 PHE H 1 1
2 465 1 1 9 PHE HA H -2.832 5.136 2.388 1.00 . A A . 9 PHE HA 1 1
2 466 1 1 9 PHE HB2 H -1.683 5.395 4.546 1.00 . A A . 9 PHE HB2 1 1
2 467 1 1 9 PHE HB3 H -0.289 4.592 3.859 1.00 . A A . 9 PHE HB3 1 1
2 468 1 1 9 PHE HD1 H -2.155 7.198 1.825 1.00 . A A . 9 PHE HD1 1 1
2 469 1 1 9 PHE HD2 H 1.147 6.453 4.496 1.00 . A A . 9 PHE HD2 1 1
2 470 1 1 9 PHE HE1 H -1.220 9.401 1.305 1.00 . A A . 9 PHE HE1 1 1
2 471 1 1 9 PHE HE2 H 2.052 8.672 3.968 1.00 . A A . 9 PHE HE2 1 1
2 472 1 1 9 PHE HZ H 0.879 10.149 2.373 1.00 . A A . 9 PHE HZ 1 1
2 473 1 1 9 PHE N N -2.632 3.269 3.262 1.00 . A A . 9 PHE N 1 1
2 474 1 1 9 PHE O O -0.184 4.266 0.998 1.00 . A A . 9 PHE O 1 1
2 475 1 1 10 ILE C C -0.956 1.514 -0.800 1.00 . A A . 10 ILE C 1 1
2 476 1 1 10 ILE CA C -1.753 2.852 -0.985 1.00 . A A . 10 ILE CA 1 1
2 477 1 1 10 ILE CB C -1.087 3.911 -1.938 1.00 . A A . 10 ILE CB 1 1
2 478 1 1 10 ILE CD1 C -1.025 6.497 -2.330 1.00 . A A . 10 ILE CD1 1 1
2 479 1 1 10 ILE CG1 C -1.868 5.253 -2.017 1.00 . A A . 10 ILE CG1 1 1
2 480 1 1 10 ILE CG2 C -0.839 3.376 -3.375 1.00 . A A . 10 ILE CG2 1 1
2 481 1 1 10 ILE H H -3.142 3.169 0.634 1.00 . A A . 10 ILE H 1 1
2 482 1 1 10 ILE HA H -2.691 2.632 -1.494 1.00 . A A . 10 ILE HA 1 1
2 483 1 1 10 ILE HB H -0.107 4.111 -1.496 1.00 . A A . 10 ILE HB 1 1
2 484 1 1 10 ILE HD11 H -0.258 6.674 -1.556 1.00 . A A . 10 ILE HD11 1 1
2 485 1 1 10 ILE HD12 H -0.508 6.413 -3.304 1.00 . A A . 10 ILE HD12 1 1
2 486 1 1 10 ILE HD13 H -1.658 7.402 -2.376 1.00 . A A . 10 ILE HD13 1 1
2 487 1 1 10 ILE HG12 H -2.664 5.164 -2.775 1.00 . A A . 10 ILE HG12 1 1
2 488 1 1 10 ILE HG13 H -2.402 5.427 -1.060 1.00 . A A . 10 ILE HG13 1 1
2 489 1 1 10 ILE HG21 H -0.186 2.486 -3.386 1.00 . A A . 10 ILE HG21 1 1
2 490 1 1 10 ILE HG22 H -0.342 4.128 -4.016 1.00 . A A . 10 ILE HG22 1 1
2 491 1 1 10 ILE HG23 H -1.780 3.090 -3.879 1.00 . A A . 10 ILE HG23 1 1
2 492 1 1 10 ILE N N -2.167 3.345 0.357 1.00 . A A . 10 ILE N 1 1
2 493 1 1 10 ILE O O 0.248 1.535 -1.064 1.00 . A A . 10 ILE O 1 1
2 494 1 1 11 ASN C C 0.562 -0.794 0.583 1.00 . A A . 11 ASN C 1 1
2 495 1 1 11 ASN CA C -0.818 -0.933 -0.154 1.00 . A A . 11 ASN CA 1 1
2 496 1 1 11 ASN CB C -0.906 -1.637 -1.534 1.00 . A A . 11 ASN CB 1 1
2 497 1 1 11 ASN CG C -0.145 -2.951 -1.776 1.00 . A A . 11 ASN CG 1 1
2 498 1 1 11 ASN H H -2.569 0.283 -0.364 1.00 . A A . 11 ASN H 1 1
2 499 1 1 11 ASN HA H -1.419 -1.609 0.457 1.00 . A A . 11 ASN HA 1 1
2 500 1 1 11 ASN HB2 H -1.971 -1.833 -1.771 1.00 . A A . 11 ASN HB2 1 1
2 501 1 1 11 ASN HB3 H -0.611 -0.893 -2.278 1.00 . A A . 11 ASN HB3 1 1
2 502 1 1 11 ASN HD21 H 0.080 -4.865 -1.216 1.00 . A A . 11 ASN HD21 1 1
2 503 1 1 11 ASN HD22 H -1.149 -3.860 -0.295 1.00 . A A . 11 ASN HD22 1 1
2 504 1 1 11 ASN N N -1.551 0.366 -0.332 1.00 . A A . 11 ASN N 1 1
2 505 1 1 11 ASN ND2 N -0.434 -3.999 -1.018 1.00 . A A . 11 ASN ND2 1 1
2 506 1 1 11 ASN O O 1.596 -1.218 0.065 1.00 . A A . 11 ASN O 1 1
2 507 1 1 11 ASN OD1 O 0.687 -3.039 -2.678 1.00 . A A . 11 ASN OD1 1 1
2 508 1 1 12 ASN C C 2.791 0.987 1.924 1.00 . A A . 12 ASN C 1 1
2 509 1 1 12 ASN CA C 1.752 0.080 2.642 1.00 . A A . 12 ASN CA 1 1
2 510 1 1 12 ASN CB C 2.228 -1.254 3.260 1.00 . A A . 12 ASN CB 1 1
2 511 1 1 12 ASN CG C 3.204 -1.147 4.447 1.00 . A A . 12 ASN CG 1 1
2 512 1 1 12 ASN H H -0.348 0.111 2.177 1.00 . A A . 12 ASN H 1 1
2 513 1 1 12 ASN HA H 1.418 0.638 3.506 1.00 . A A . 12 ASN HA 1 1
2 514 1 1 12 ASN HB2 H 1.330 -1.831 3.563 1.00 . A A . 12 ASN HB2 1 1
2 515 1 1 12 ASN HB3 H 2.698 -1.838 2.464 1.00 . A A . 12 ASN HB3 1 1
2 516 1 1 12 ASN HD21 H 3.363 -0.926 6.435 1.00 . A A . 12 ASN HD21 1 1
2 517 1 1 12 ASN HD22 H 1.671 -0.951 5.726 1.00 . A A . 12 ASN HD22 1 1
2 518 1 1 12 ASN N N 0.558 -0.165 1.789 1.00 . A A . 12 ASN N 1 1
2 519 1 1 12 ASN ND2 N 2.694 -0.992 5.660 1.00 . A A . 12 ASN ND2 1 1
2 520 1 1 12 ASN O O 3.969 0.624 1.907 1.00 . A A . 12 ASN O 1 1
2 521 1 1 12 ASN OD1 O 4.422 -1.208 4.283 1.00 . A A . 12 ASN OD1 1 1
2 522 1 1 13 LYS C C 4.027 2.319 -0.538 1.00 . A A . 13 LYS C 1 1
2 523 1 1 13 LYS CA C 3.343 3.098 0.646 1.00 . A A . 13 LYS CA 1 1
2 524 1 1 13 LYS CB C 4.328 3.819 1.622 1.00 . A A . 13 LYS CB 1 1
2 525 1 1 13 LYS CD C 3.964 6.409 1.689 1.00 . A A . 13 LYS CD 1 1
2 526 1 1 13 LYS CE C 3.368 6.648 0.286 1.00 . A A . 13 LYS CE 1 1
2 527 1 1 13 LYS CG C 3.731 5.037 2.367 1.00 . A A . 13 LYS CG 1 1
2 528 1 1 13 LYS H H 1.387 2.402 1.401 1.00 . A A . 13 LYS H 1 1
2 529 1 1 13 LYS HA H 2.755 3.893 0.177 1.00 . A A . 13 LYS HA 1 1
2 530 1 1 13 LYS HB2 H 4.721 3.098 2.363 1.00 . A A . 13 LYS HB2 1 1
2 531 1 1 13 LYS HB3 H 5.233 4.155 1.082 1.00 . A A . 13 LYS HB3 1 1
2 532 1 1 13 LYS HD2 H 3.604 7.201 2.369 1.00 . A A . 13 LYS HD2 1 1
2 533 1 1 13 LYS HD3 H 5.055 6.574 1.622 1.00 . A A . 13 LYS HD3 1 1
2 534 1 1 13 LYS HE2 H 3.716 7.627 -0.093 1.00 . A A . 13 LYS HE2 1 1
2 535 1 1 13 LYS HE3 H 3.753 5.902 -0.433 1.00 . A A . 13 LYS HE3 1 1
2 536 1 1 13 LYS HG2 H 2.654 4.886 2.573 1.00 . A A . 13 LYS HG2 1 1
2 537 1 1 13 LYS HG3 H 4.197 5.085 3.369 1.00 . A A . 13 LYS HG3 1 1
2 538 1 1 13 LYS HZ2 H 1.556 6.784 -0.693 1.00 . A A . 13 LYS HZ2 1 1
2 539 1 1 13 LYS HZ3 H 1.545 5.716 0.544 1.00 . A A . 13 LYS HZ3 1 1
2 540 1 1 13 LYS N N 2.395 2.183 1.377 1.00 . A A . 13 LYS N 1 1
2 541 1 1 13 LYS NZ N 1.895 6.639 0.265 1.00 . A A . 13 LYS NZ 1 1
2 542 1 1 13 LYS O O 5.233 2.459 -0.757 1.00 . A A . 13 LYS O 1 1
2 543 1 1 14 HIS C C 4.812 -0.318 -1.896 1.00 . A A . 14 HIS C 1 1
2 544 1 1 14 HIS CA C 3.738 0.677 -2.453 1.00 . A A . 14 HIS CA 1 1
2 545 1 1 14 HIS CB C 4.117 1.575 -3.654 1.00 . A A . 14 HIS CB 1 1
2 546 1 1 14 HIS CD2 C 4.494 1.494 -6.183 1.00 . A A . 14 HIS CD2 1 1
2 547 1 1 14 HIS CE1 C 4.083 -0.531 -6.563 1.00 . A A . 14 HIS CE1 1 1
2 548 1 1 14 HIS CG C 4.175 0.847 -4.986 1.00 . A A . 14 HIS CG 1 1
2 549 1 1 14 HIS H H 2.229 1.602 -1.186 1.00 . A A . 14 HIS H 1 1
2 550 1 1 14 HIS HA H 2.906 0.061 -2.795 1.00 . A A . 14 HIS HA 1 1
2 551 1 1 14 HIS HB2 H 3.358 2.376 -3.746 1.00 . A A . 14 HIS HB2 1 1
2 552 1 1 14 HIS HB3 H 5.075 2.097 -3.475 1.00 . A A . 14 HIS HB3 1 1
2 553 1 1 14 HIS HD2 H 4.720 2.548 -6.249 1.00 . A A . 14 HIS HD2 1 1
2 554 1 1 14 HIS HE1 H 3.942 -1.456 -7.103 1.00 . A A . 14 HIS HE1 1 1
2 555 1 1 14 HIS HE2 H 4.611 0.756 -8.239 1.00 . A A . 14 HIS HE2 1 1
2 556 1 1 14 HIS N N 3.243 1.509 -1.317 1.00 . A A . 14 HIS N 1 1
2 557 1 1 14 HIS ND1 N 3.889 -0.496 -5.201 1.00 . A A . 14 HIS ND1 1 1
2 558 1 1 14 HIS NE2 N 4.446 0.605 -7.238 1.00 . A A . 14 HIS NE2 1 1
2 559 1 1 14 HIS O O 5.872 -0.453 -2.512 1.00 . A A . 14 HIS O 1 1
2 560 1 1 15 LEU C C 6.808 -1.195 0.261 1.00 . A A . 15 LEU C 1 1
2 561 1 1 15 LEU CA C 5.505 -1.990 -0.126 1.00 . A A . 15 LEU CA 1 1
2 562 1 1 15 LEU CB C 5.752 -3.302 -0.942 1.00 . A A . 15 LEU CB 1 1
2 563 1 1 15 LEU CD1 C 4.572 -4.998 0.617 1.00 . A A . 15 LEU CD1 1 1
2 564 1 1 15 LEU CD2 C 3.333 -4.065 -1.376 1.00 . A A . 15 LEU CD2 1 1
2 565 1 1 15 LEU CG C 4.715 -4.455 -0.836 1.00 . A A . 15 LEU CG 1 1
2 566 1 1 15 LEU H H 3.609 -0.890 -0.302 1.00 . A A . 15 LEU H 1 1
2 567 1 1 15 LEU HA H 5.070 -2.294 0.824 1.00 . A A . 15 LEU HA 1 1
2 568 1 1 15 LEU HB2 H 5.914 -3.052 -2.007 1.00 . A A . 15 LEU HB2 1 1
2 569 1 1 15 LEU HB3 H 6.717 -3.742 -0.630 1.00 . A A . 15 LEU HB3 1 1
2 570 1 1 15 LEU HD11 H 3.928 -5.895 0.679 1.00 . A A . 15 LEU HD11 1 1
2 571 1 1 15 LEU HD12 H 4.112 -4.259 1.307 1.00 . A A . 15 LEU HD12 1 1
2 572 1 1 15 LEU HD13 H 5.542 -5.268 1.074 1.00 . A A . 15 LEU HD13 1 1
2 573 1 1 15 LEU HD21 H 3.401 -3.637 -2.392 1.00 . A A . 15 LEU HD21 1 1
2 574 1 1 15 LEU HD22 H 2.840 -3.313 -0.734 1.00 . A A . 15 LEU HD22 1 1
2 575 1 1 15 LEU HD23 H 2.658 -4.938 -1.429 1.00 . A A . 15 LEU HD23 1 1
2 576 1 1 15 LEU HG H 5.092 -5.253 -1.522 1.00 . A A . 15 LEU HG 1 1
2 577 1 1 15 LEU N N 4.531 -1.043 -0.760 1.00 . A A . 15 LEU N 1 1
2 578 1 1 15 LEU O O 7.917 -1.718 0.104 1.00 . A A . 15 LEU O 1 1
2 579 1 1 16 ASN C C 8.754 1.135 -0.075 1.00 . A A . 16 ASN C 1 1
2 580 1 1 16 ASN CA C 7.825 0.940 1.185 1.00 . A A . 16 ASN CA 1 1
2 581 1 1 16 ASN CB C 8.450 0.452 2.504 1.00 . A A . 16 ASN CB 1 1
2 582 1 1 16 ASN CG C 9.418 1.430 3.196 1.00 . A A . 16 ASN CG 1 1
2 583 1 1 16 ASN H H 5.727 0.407 0.978 1.00 . A A . 16 ASN H 1 1
2 584 1 1 16 ASN HA H 7.407 1.918 1.443 1.00 . A A . 16 ASN HA 1 1
2 585 1 1 16 ASN HB2 H 7.623 0.180 3.191 1.00 . A A . 16 ASN HB2 1 1
2 586 1 1 16 ASN HB3 H 8.976 -0.481 2.290 1.00 . A A . 16 ASN HB3 1 1
2 587 1 1 16 ASN HD21 H 9.574 2.970 4.472 1.00 . A A . 16 ASN HD21 1 1
2 588 1 1 16 ASN HD22 H 7.890 2.317 4.145 1.00 . A A . 16 ASN HD22 1 1
2 589 1 1 16 ASN N N 6.681 0.062 0.804 1.00 . A A . 16 ASN N 1 1
2 590 1 1 16 ASN ND2 N 8.909 2.331 4.022 1.00 . A A . 16 ASN ND2 1 1
2 591 1 1 16 ASN O O 9.979 1.016 0.028 1.00 . A A . 16 ASN O 1 1
2 592 1 1 16 ASN OD1 O 10.632 1.379 2.995 1.00 . A A . 16 ASN OD1 1 1
2 593 1 1 17 GLU C C 9.591 0.289 -3.007 1.00 . A A . 17 GLU C 1 1
2 594 1 1 17 GLU CA C 8.860 1.609 -2.559 1.00 . A A . 17 GLU CA 1 1
2 595 1 1 17 GLU CB C 9.700 2.905 -2.609 1.00 . A A . 17 GLU CB 1 1
2 596 1 1 17 GLU CD C 9.759 5.445 -2.280 1.00 . A A . 17 GLU CD 1 1
2 597 1 1 17 GLU CG C 8.880 4.203 -2.436 1.00 . A A . 17 GLU CG 1 1
2 598 1 1 17 GLU H H 7.109 1.470 -1.261 1.00 . A A . 17 GLU H 1 1
2 599 1 1 17 GLU HA H 8.088 1.782 -3.314 1.00 . A A . 17 GLU HA 1 1
2 600 1 1 17 GLU HB2 H 10.463 2.823 -1.831 1.00 . A A . 17 GLU HB2 1 1
2 601 1 1 17 GLU HB3 H 10.254 2.960 -3.566 1.00 . A A . 17 GLU HB3 1 1
2 602 1 1 17 GLU HE2 H 10.659 6.769 -3.388 1.00 . A A . 17 GLU HE2 1 1
2 603 1 1 17 GLU HG2 H 8.196 4.335 -3.296 1.00 . A A . 17 GLU HG2 1 1
2 604 1 1 17 GLU HG3 H 8.218 4.108 -1.552 1.00 . A A . 17 GLU HG3 1 1
2 605 1 1 17 GLU N N 8.144 1.420 -1.266 1.00 . A A . 17 GLU N 1 1
2 606 1 1 17 GLU O O 10.746 0.339 -3.441 1.00 . A A . 17 GLU O 1 1
2 607 1 1 17 GLU OE1 O 10.108 5.895 -1.189 1.00 . A A . 17 GLU OE1 1 1
2 608 1 1 17 GLU OE2 O 10.107 5.990 -3.490 1.00 . A A . 17 GLU OE2 1 1
2 609 1 1 18 HIS C C 10.750 -2.603 -2.509 1.00 . A A . 18 HIS C 1 1
2 610 1 1 18 HIS CA C 9.445 -2.230 -3.278 1.00 . A A . 18 HIS CA 1 1
2 611 1 1 18 HIS CB C 9.488 -2.358 -4.818 1.00 . A A . 18 HIS CB 1 1
2 612 1 1 18 HIS CD2 C 9.561 -4.089 -6.703 1.00 . A A . 18 HIS CD2 1 1
2 613 1 1 18 HIS CE1 C 9.528 -5.868 -5.585 1.00 . A A . 18 HIS CE1 1 1
2 614 1 1 18 HIS CG C 9.531 -3.786 -5.338 1.00 . A A . 18 HIS CG 1 1
2 615 1 1 18 HIS H H 7.938 -0.840 -2.567 1.00 . A A . 18 HIS H 1 1
2 616 1 1 18 HIS HA H 8.667 -2.953 -2.964 1.00 . A A . 18 HIS HA 1 1
2 617 1 1 18 HIS HB2 H 8.574 -1.885 -5.228 1.00 . A A . 18 HIS HB2 1 1
2 618 1 1 18 HIS HB3 H 10.331 -1.783 -5.245 1.00 . A A . 18 HIS HB3 1 1
2 619 1 1 18 HIS HD2 H 9.556 -3.340 -7.479 1.00 . A A . 18 HIS HD2 1 1
2 620 1 1 18 HIS HE1 H 9.513 -6.924 -5.354 1.00 . A A . 18 HIS HE1 1 1
2 621 1 1 18 HIS HE2 H 9.571 -6.005 -7.759 1.00 . A A . 18 HIS HE2 1 1
2 622 1 1 18 HIS N N 8.909 -0.892 -2.904 1.00 . A A . 18 HIS N 1 1
2 623 1 1 18 HIS ND1 N 9.500 -4.943 -4.568 1.00 . A A . 18 HIS ND1 1 1
2 624 1 1 18 HIS NE2 N 9.566 -5.456 -6.892 1.00 . A A . 18 HIS NE2 1 1
2 625 1 1 18 HIS O O 11.860 -2.448 -3.030 1.00 . A A . 18 HIS O 1 1
2 626 1 1 19 ALA C C 11.140 -4.419 0.712 1.00 . A A . 19 ALA C 1 1
2 627 1 1 19 ALA CA C 11.704 -3.472 -0.378 1.00 . A A . 19 ALA CA 1 1
2 628 1 1 19 ALA CB C 12.420 -2.249 0.240 1.00 . A A . 19 ALA CB 1 1
2 629 1 1 19 ALA H H 9.625 -3.295 -0.995 1.00 . A A . 19 ALA H 1 1
2 630 1 1 19 ALA HA H 12.434 -4.017 -1.000 1.00 . A A . 19 ALA HA 1 1
2 631 1 1 19 ALA HB1 H 13.254 -2.560 0.896 1.00 . A A . 19 ALA HB1 1 1
2 632 1 1 19 ALA HB2 H 12.856 -1.594 -0.537 1.00 . A A . 19 ALA HB2 1 1
2 633 1 1 19 ALA HB3 H 11.738 -1.625 0.848 1.00 . A A . 19 ALA HB3 1 1
2 634 1 1 19 ALA N N 10.585 -3.069 -1.255 1.00 . A A . 19 ALA N 1 1
2 635 1 1 19 ALA O O 10.501 -3.974 1.673 1.00 . A A . 19 ALA O 1 1
2 636 1 1 20 HIS C C 11.784 -6.806 2.810 1.00 . A A . 20 HIS C 1 1
2 637 1 1 20 HIS CA C 10.932 -6.778 1.502 1.00 . A A . 20 HIS CA 1 1
2 638 1 1 20 HIS CB C 10.833 -8.133 0.750 1.00 . A A . 20 HIS CB 1 1
2 639 1 1 20 HIS CD2 C 9.842 -10.491 0.959 1.00 . A A . 20 HIS CD2 1 1
2 640 1 1 20 HIS CE1 C 8.732 -10.277 2.730 1.00 . A A . 20 HIS CE1 1 1
2 641 1 1 20 HIS CG C 10.007 -9.195 1.462 1.00 . A A . 20 HIS CG 1 1
2 642 1 1 20 HIS H H 11.791 -5.988 -0.351 1.00 . A A . 20 HIS H 1 1
2 643 1 1 20 HIS HA H 9.896 -6.522 1.774 1.00 . A A . 20 HIS HA 1 1
2 644 1 1 20 HIS HB2 H 10.369 -7.998 -0.246 1.00 . A A . 20 HIS HB2 1 1
2 645 1 1 20 HIS HB3 H 11.841 -8.536 0.535 1.00 . A A . 20 HIS HB3 1 1
2 646 1 1 20 HIS HD2 H 10.284 -10.835 0.036 1.00 . A A . 20 HIS HD2 1 1
2 647 1 1 20 HIS HE1 H 8.075 -10.516 3.553 1.00 . A A . 20 HIS HE1 1 1
2 648 1 1 20 HIS HE2 H 8.676 -12.190 1.691 1.00 . A A . 20 HIS HE2 1 1
2 649 1 1 20 HIS N N 11.397 -5.733 0.555 1.00 . A A . 20 HIS N 1 1
2 650 1 1 20 HIS ND1 N 9.275 -9.016 2.631 1.00 . A A . 20 HIS ND1 1 1
2 651 1 1 20 HIS NE2 N 9.012 -11.225 1.781 1.00 . A A . 20 HIS NE2 1 1
2 652 1 1 20 HIS O O 11.298 -6.421 3.873 1.00 . A A . 20 HIS O 1 1
3 653 1 1 1 SER C C -11.498 -3.820 -0.831 1.00 . A A . 1 SER C 1 1
3 654 1 1 1 SER CA C -10.429 -4.886 -0.413 1.00 . A A . 1 SER CA 1 1
3 655 1 1 1 SER CB C -10.761 -6.312 -0.913 1.00 . A A . 1 SER CB 1 1
3 656 1 1 1 SER H1 H -10.993 -5.317 1.662 1.00 . A A . 1 SER H1 1 1
3 657 1 1 1 SER HA H -9.485 -4.572 -0.899 1.00 . A A . 1 SER HA 1 1
3 658 1 1 1 SER HB2 H -10.092 -7.059 -0.441 1.00 . A A . 1 SER HB2 1 1
3 659 1 1 1 SER HB3 H -11.794 -6.602 -0.633 1.00 . A A . 1 SER HB3 1 1
3 660 1 1 1 SER HG H -9.700 -6.181 -2.512 1.00 . A A . 1 SER HG 1 1
3 661 1 1 1 SER N N -10.227 -5.015 1.058 1.00 . A A . 1 SER N 1 1
3 662 1 1 1 SER O O -12.208 -3.993 -1.828 1.00 . A A . 1 SER O 1 1
3 663 1 1 1 SER OG O -10.615 -6.402 -2.326 1.00 . A A . 1 SER OG 1 1
3 664 1 1 2 ASP C C -11.988 -0.319 0.398 1.00 . A A . 2 ASP C 1 1
3 665 1 1 2 ASP CA C -12.511 -1.578 -0.365 1.00 . A A . 2 ASP CA 1 1
3 666 1 1 2 ASP CB C -13.988 -1.962 -0.015 1.00 . A A . 2 ASP CB 1 1
3 667 1 1 2 ASP CG C -15.030 -1.022 -0.633 1.00 . A A . 2 ASP CG 1 1
3 668 1 1 2 ASP H H -10.866 -2.629 0.633 1.00 . A A . 2 ASP H 1 1
3 669 1 1 2 ASP HA H -12.417 -1.354 -1.447 1.00 . A A . 2 ASP HA 1 1
3 670 1 1 2 ASP HB2 H -14.239 -3.001 -0.318 1.00 . A A . 2 ASP HB2 1 1
3 671 1 1 2 ASP HB3 H -14.122 -1.977 1.083 1.00 . A A . 2 ASP HB3 1 1
3 672 1 1 2 ASP HD2 H -14.709 -2.018 -2.274 1.00 . A A . 2 ASP HD2 1 1
3 673 1 1 2 ASP N N -11.590 -2.703 -0.083 1.00 . A A . 2 ASP N 1 1
3 674 1 1 2 ASP O O -12.585 0.139 1.379 1.00 . A A . 2 ASP O 1 1
3 675 1 1 2 ASP OD1 O -15.598 -0.133 0.000 1.00 . A A . 2 ASP OD1 1 1
3 676 1 1 2 ASP OD2 O -15.248 -1.288 -1.961 1.00 . A A . 2 ASP OD2 1 1
3 677 1 1 3 THR C C -9.810 2.270 -0.796 1.00 . A A . 3 THR C 1 1
3 678 1 1 3 THR CA C -10.216 1.444 0.458 1.00 . A A . 3 THR CA 1 1
3 679 1 1 3 THR CB C -9.161 1.028 1.529 1.00 . A A . 3 THR CB 1 1
3 680 1 1 3 THR CG2 C -7.714 0.840 1.061 1.00 . A A . 3 THR CG2 1 1
3 681 1 1 3 THR H H -10.355 -0.213 -0.818 1.00 . A A . 3 THR H 1 1
3 682 1 1 3 THR HA H -10.960 2.052 0.974 1.00 . A A . 3 THR HA 1 1
3 683 1 1 3 THR HB H -9.470 0.055 1.956 1.00 . A A . 3 THR HB 1 1
3 684 1 1 3 THR HG1 H -10.087 1.988 2.914 1.00 . A A . 3 THR HG1 1 1
3 685 1 1 3 THR HG21 H -7.044 0.594 1.900 1.00 . A A . 3 THR HG21 1 1
3 686 1 1 3 THR HG22 H -7.297 1.749 0.597 1.00 . A A . 3 THR HG22 1 1
3 687 1 1 3 THR HG23 H -7.649 0.057 0.291 1.00 . A A . 3 THR HG23 1 1
3 688 1 1 3 THR N N -10.857 0.239 -0.075 1.00 . A A . 3 THR N 1 1
3 689 1 1 3 THR O O -8.672 2.283 -1.264 1.00 . A A . 3 THR O 1 1
3 690 1 1 3 THR OG1 O -9.181 1.965 2.599 1.00 . A A . 3 THR OG1 1 1
3 691 1 1 4 ARG C C -9.962 5.135 -2.178 1.00 . A A . 4 ARG C 1 1
3 692 1 1 4 ARG CA C -10.668 3.812 -2.559 1.00 . A A . 4 ARG CA 1 1
3 693 1 1 4 ARG CB C -12.022 4.079 -3.272 1.00 . A A . 4 ARG CB 1 1
3 694 1 1 4 ARG CD C -13.276 1.731 -3.273 1.00 . A A . 4 ARG CD 1 1
3 695 1 1 4 ARG CG C -12.644 2.900 -4.068 1.00 . A A . 4 ARG CG 1 1
3 696 1 1 4 ARG CZ C -15.704 2.142 -2.740 1.00 . A A . 4 ARG CZ 1 1
3 697 1 1 4 ARG H H -11.708 2.485 -1.117 1.00 . A A . 4 ARG H 1 1
3 698 1 1 4 ARG HA H -9.964 3.292 -3.235 1.00 . A A . 4 ARG HA 1 1
3 699 1 1 4 ARG HB2 H -12.766 4.489 -2.560 1.00 . A A . 4 ARG HB2 1 1
3 700 1 1 4 ARG HB3 H -11.875 4.903 -3.997 1.00 . A A . 4 ARG HB3 1 1
3 701 1 1 4 ARG HD2 H -13.596 0.940 -3.978 1.00 . A A . 4 ARG HD2 1 1
3 702 1 1 4 ARG HD3 H -12.508 1.235 -2.654 1.00 . A A . 4 ARG HD3 1 1
3 703 1 1 4 ARG HG2 H -13.419 3.313 -4.742 1.00 . A A . 4 ARG HG2 1 1
3 704 1 1 4 ARG HG3 H -11.879 2.489 -4.752 1.00 . A A . 4 ARG HG3 1 1
3 705 1 1 4 ARG HH11 H -15.454 1.465 -4.618 1.00 . A A . 4 ARG HH11 1 1
3 706 1 1 4 ARG HH12 H -17.171 1.817 -4.077 1.00 . A A . 4 ARG HH12 1 1
3 707 1 1 4 ARG HH21 H -16.214 2.823 -0.928 1.00 . A A . 4 ARG HH21 1 1
3 708 1 1 4 ARG HH22 H -17.570 2.533 -2.130 1.00 . A A . 4 ARG HH22 1 1
3 709 1 1 4 ARG N N -10.825 2.924 -1.377 1.00 . A A . 4 ARG N 1 1
3 710 1 1 4 ARG NE N -14.401 2.140 -2.391 1.00 . A A . 4 ARG NE 1 1
3 711 1 1 4 ARG NH1 N -16.156 1.769 -3.935 1.00 . A A . 4 ARG NH1 1 1
3 712 1 1 4 ARG NH2 N -16.585 2.540 -1.841 1.00 . A A . 4 ARG NH2 1 1
3 713 1 1 4 ARG O O -9.046 5.553 -2.893 1.00 . A A . 4 ARG O 1 1
3 714 1 1 5 TYR C C -8.486 6.757 0.349 1.00 . A A . 5 TYR C 1 1
3 715 1 1 5 TYR CA C -9.750 7.031 -0.567 1.00 . A A . 5 TYR CA 1 1
3 716 1 1 5 TYR CB C -10.857 7.919 0.076 1.00 . A A . 5 TYR CB 1 1
3 717 1 1 5 TYR CD1 C -10.272 9.886 1.595 1.00 . A A . 5 TYR CD1 1 1
3 718 1 1 5 TYR CD2 C -10.381 10.273 -0.786 1.00 . A A . 5 TYR CD2 1 1
3 719 1 1 5 TYR CE1 C -9.947 11.226 1.797 1.00 . A A . 5 TYR CE1 1 1
3 720 1 1 5 TYR CE2 C -10.057 11.613 -0.583 1.00 . A A . 5 TYR CE2 1 1
3 721 1 1 5 TYR CG C -10.486 9.397 0.301 1.00 . A A . 5 TYR CG 1 1
3 722 1 1 5 TYR CZ C -9.840 12.089 0.709 1.00 . A A . 5 TYR CZ 1 1
3 723 1 1 5 TYR H H -11.070 5.252 -0.529 1.00 . A A . 5 TYR H 1 1
3 724 1 1 5 TYR HA H -9.372 7.538 -1.452 1.00 . A A . 5 TYR HA 1 1
3 725 1 1 5 TYR HB2 H -11.765 7.906 -0.561 1.00 . A A . 5 TYR HB2 1 1
3 726 1 1 5 TYR HB3 H -11.189 7.452 1.025 1.00 . A A . 5 TYR HB3 1 1
3 727 1 1 5 TYR HD1 H -10.352 9.230 2.451 1.00 . A A . 5 TYR HD1 1 1
3 728 1 1 5 TYR HD2 H -10.549 9.919 -1.794 1.00 . A A . 5 TYR HD2 1 1
3 729 1 1 5 TYR HE1 H -9.781 11.592 2.800 1.00 . A A . 5 TYR HE1 1 1
3 730 1 1 5 TYR HE2 H -9.976 12.280 -1.429 1.00 . A A . 5 TYR HE2 1 1
3 731 1 1 5 TYR HH H -9.407 13.564 1.849 1.00 . A A . 5 TYR HH 1 1
3 732 1 1 5 TYR N N -10.393 5.785 -1.073 1.00 . A A . 5 TYR N 1 1
3 733 1 1 5 TYR O O -8.111 7.560 1.207 1.00 . A A . 5 TYR O 1 1
3 734 1 1 5 TYR OH O -9.521 13.409 0.908 1.00 . A A . 5 TYR OH 1 1
3 735 1 1 6 ASN C C -5.618 4.415 -0.206 1.00 . A A . 6 ASN C 1 1
3 736 1 1 6 ASN CA C -6.610 5.112 0.772 1.00 . A A . 6 ASN CA 1 1
3 737 1 1 6 ASN CB C -7.050 4.318 2.006 1.00 . A A . 6 ASN CB 1 1
3 738 1 1 6 ASN CG C -5.983 3.870 3.024 1.00 . A A . 6 ASN CG 1 1
3 739 1 1 6 ASN H H -8.371 4.976 -0.455 1.00 . A A . 6 ASN H 1 1
3 740 1 1 6 ASN HA H -6.085 5.937 1.175 1.00 . A A . 6 ASN HA 1 1
3 741 1 1 6 ASN HB2 H -7.849 4.882 2.513 1.00 . A A . 6 ASN HB2 1 1
3 742 1 1 6 ASN HB3 H -7.570 3.449 1.634 1.00 . A A . 6 ASN HB3 1 1
3 743 1 1 6 ASN HD21 H -4.581 4.460 4.332 1.00 . A A . 6 ASN HD21 1 1
3 744 1 1 6 ASN HD22 H -5.470 5.771 3.406 1.00 . A A . 6 ASN HD22 1 1
3 745 1 1 6 ASN N N -7.810 5.622 0.089 1.00 . A A . 6 ASN N 1 1
3 746 1 1 6 ASN ND2 N -5.272 4.795 3.652 1.00 . A A . 6 ASN ND2 1 1
3 747 1 1 6 ASN O O -4.407 4.577 -0.026 1.00 . A A . 6 ASN O 1 1
3 748 1 1 6 ASN OD1 O -5.813 2.678 3.278 1.00 . A A . 6 ASN OD1 1 1
3 749 1 1 7 LYS C C -4.451 1.833 -1.622 1.00 . A A . 7 LYS C 1 1
3 750 1 1 7 LYS CA C -5.282 2.983 -2.264 1.00 . A A . 7 LYS CA 1 1
3 751 1 1 7 LYS CB C -4.482 3.999 -3.131 1.00 . A A . 7 LYS CB 1 1
3 752 1 1 7 LYS CD C -6.361 4.652 -4.874 1.00 . A A . 7 LYS CD 1 1
3 753 1 1 7 LYS CE C -5.825 3.954 -6.142 1.00 . A A . 7 LYS CE 1 1
3 754 1 1 7 LYS CG C -5.313 5.107 -3.829 1.00 . A A . 7 LYS CG 1 1
3 755 1 1 7 LYS H H -7.104 3.462 -1.173 1.00 . A A . 7 LYS H 1 1
3 756 1 1 7 LYS HA H -5.970 2.543 -3.001 1.00 . A A . 7 LYS HA 1 1
3 757 1 1 7 LYS HB2 H -3.719 4.487 -2.499 1.00 . A A . 7 LYS HB2 1 1
3 758 1 1 7 LYS HB3 H -3.914 3.441 -3.894 1.00 . A A . 7 LYS HB3 1 1
3 759 1 1 7 LYS HD2 H -7.086 3.979 -4.379 1.00 . A A . 7 LYS HD2 1 1
3 760 1 1 7 LYS HD3 H -6.968 5.528 -5.168 1.00 . A A . 7 LYS HD3 1 1
3 761 1 1 7 LYS HE2 H -5.214 3.073 -5.874 1.00 . A A . 7 LYS HE2 1 1
3 762 1 1 7 LYS HE3 H -6.677 3.556 -6.723 1.00 . A A . 7 LYS HE3 1 1
3 763 1 1 7 LYS HG2 H -5.840 5.692 -3.051 1.00 . A A . 7 LYS HG2 1 1
3 764 1 1 7 LYS HG3 H -4.620 5.828 -4.295 1.00 . A A . 7 LYS HG3 1 1
3 765 1 1 7 LYS HZ2 H -4.754 4.349 -7.864 1.00 . A A . 7 LYS HZ2 1 1
3 766 1 1 7 LYS HZ3 H -5.629 5.626 -7.340 1.00 . A A . 7 LYS HZ3 1 1
3 767 1 1 7 LYS N N -6.104 3.666 -1.227 1.00 . A A . 7 LYS N 1 1
3 768 1 1 7 LYS NZ N -5.042 4.849 -7.016 1.00 . A A . 7 LYS NZ 1 1
3 769 1 1 7 LYS O O -3.220 1.864 -1.695 1.00 . A A . 7 LYS O 1 1
3 770 1 1 8 SER C C -3.294 0.110 0.670 1.00 . A A . 8 SER C 1 1
3 771 1 1 8 SER CA C -4.442 -0.331 -0.314 1.00 . A A . 8 SER CA 1 1
3 772 1 1 8 SER CB C -4.137 -1.370 -1.408 1.00 . A A . 8 SER CB 1 1
3 773 1 1 8 SER H H -6.102 0.704 -1.242 1.00 . A A . 8 SER H 1 1
3 774 1 1 8 SER HA H -5.189 -0.860 0.288 1.00 . A A . 8 SER HA 1 1
3 775 1 1 8 SER HB2 H -5.079 -1.839 -1.762 1.00 . A A . 8 SER HB2 1 1
3 776 1 1 8 SER HB3 H -3.732 -0.832 -2.270 1.00 . A A . 8 SER HB3 1 1
3 777 1 1 8 SER HG H -3.692 -2.839 -0.247 1.00 . A A . 8 SER HG 1 1
3 778 1 1 8 SER N N -5.116 0.824 -0.984 1.00 . A A . 8 SER N 1 1
3 779 1 1 8 SER O O -2.163 -0.369 0.559 1.00 . A A . 8 SER O 1 1
3 780 1 1 8 SER OG O -3.253 -2.401 -0.980 1.00 . A A . 8 SER OG 1 1
3 781 1 1 9 PHE C C -1.362 2.272 1.983 1.00 . A A . 9 PHE C 1 1
3 782 1 1 9 PHE CA C -2.612 1.574 2.622 1.00 . A A . 9 PHE CA 1 1
3 783 1 1 9 PHE CB C -2.370 0.499 3.712 1.00 . A A . 9 PHE CB 1 1
3 784 1 1 9 PHE CD1 C -2.197 2.044 5.772 1.00 . A A . 9 PHE CD1 1 1
3 785 1 1 9 PHE CD2 C -0.870 0.028 5.699 1.00 . A A . 9 PHE CD2 1 1
3 786 1 1 9 PHE CE1 C -1.714 2.314 7.050 1.00 . A A . 9 PHE CE1 1 1
3 787 1 1 9 PHE CE2 C -0.397 0.294 6.982 1.00 . A A . 9 PHE CE2 1 1
3 788 1 1 9 PHE CG C -1.771 0.902 5.078 1.00 . A A . 9 PHE CG 1 1
3 789 1 1 9 PHE CZ C -0.819 1.437 7.656 1.00 . A A . 9 PHE CZ 1 1
3 790 1 1 9 PHE H H -4.554 1.360 1.708 1.00 . A A . 9 PHE H 1 1
3 791 1 1 9 PHE HA H -3.139 2.361 3.160 1.00 . A A . 9 PHE HA 1 1
3 792 1 1 9 PHE HB2 H -3.337 0.004 3.929 1.00 . A A . 9 PHE HB2 1 1
3 793 1 1 9 PHE HB3 H -1.752 -0.272 3.239 1.00 . A A . 9 PHE HB3 1 1
3 794 1 1 9 PHE HD1 H -2.918 2.721 5.339 1.00 . A A . 9 PHE HD1 1 1
3 795 1 1 9 PHE HD2 H -0.543 -0.874 5.200 1.00 . A A . 9 PHE HD2 1 1
3 796 1 1 9 PHE HE1 H -2.046 3.196 7.578 1.00 . A A . 9 PHE HE1 1 1
3 797 1 1 9 PHE HE2 H 0.296 -0.387 7.454 1.00 . A A . 9 PHE HE2 1 1
3 798 1 1 9 PHE HZ H -0.450 1.643 8.650 1.00 . A A . 9 PHE HZ 1 1
3 799 1 1 9 PHE N N -3.585 1.043 1.622 1.00 . A A . 9 PHE N 1 1
3 800 1 1 9 PHE O O -0.234 2.041 2.425 1.00 . A A . 9 PHE O 1 1
3 801 1 1 10 ILE C C 0.369 2.835 -0.554 1.00 . A A . 10 ILE C 1 1
3 802 1 1 10 ILE CA C -0.501 3.892 0.224 1.00 . A A . 10 ILE CA 1 1
3 803 1 1 10 ILE CB C 0.260 4.950 1.104 1.00 . A A . 10 ILE CB 1 1
3 804 1 1 10 ILE CD1 C -0.107 6.575 3.116 1.00 . A A . 10 ILE CD1 1 1
3 805 1 1 10 ILE CG1 C -0.692 5.948 1.839 1.00 . A A . 10 ILE CG1 1 1
3 806 1 1 10 ILE CG2 C 1.312 5.771 0.307 1.00 . A A . 10 ILE CG2 1 1
3 807 1 1 10 ILE H H -2.548 3.219 0.629 1.00 . A A . 10 ILE H 1 1
3 808 1 1 10 ILE HA H -0.989 4.545 -0.498 1.00 . A A . 10 ILE HA 1 1
3 809 1 1 10 ILE HB H 0.798 4.363 1.855 1.00 . A A . 10 ILE HB 1 1
3 810 1 1 10 ILE HD11 H -0.845 7.235 3.607 1.00 . A A . 10 ILE HD11 1 1
3 811 1 1 10 ILE HD12 H 0.183 5.803 3.853 1.00 . A A . 10 ILE HD12 1 1
3 812 1 1 10 ILE HD13 H 0.788 7.189 2.906 1.00 . A A . 10 ILE HD13 1 1
3 813 1 1 10 ILE HG12 H -1.015 6.754 1.148 1.00 . A A . 10 ILE HG12 1 1
3 814 1 1 10 ILE HG13 H -1.626 5.430 2.130 1.00 . A A . 10 ILE HG13 1 1
3 815 1 1 10 ILE HG21 H 1.858 6.484 0.952 1.00 . A A . 10 ILE HG21 1 1
3 816 1 1 10 ILE HG22 H 2.086 5.138 -0.159 1.00 . A A . 10 ILE HG22 1 1
3 817 1 1 10 ILE HG23 H 0.845 6.359 -0.505 1.00 . A A . 10 ILE HG23 1 1
3 818 1 1 10 ILE N N -1.577 3.143 0.955 1.00 . A A . 10 ILE N 1 1
3 819 1 1 10 ILE O O 1.564 2.743 -0.263 1.00 . A A . 10 ILE O 1 1
3 820 1 1 11 ASN C C 1.431 0.060 -1.329 1.00 . A A . 11 ASN C 1 1
3 821 1 1 11 ASN CA C 0.569 0.975 -2.272 1.00 . A A . 11 ASN CA 1 1
3 822 1 1 11 ASN CB C 1.218 1.718 -3.466 1.00 . A A . 11 ASN CB 1 1
3 823 1 1 11 ASN CG C 2.225 0.973 -4.358 1.00 . A A . 11 ASN CG 1 1
3 824 1 1 11 ASN H H -1.058 2.329 -1.941 1.00 . A A . 11 ASN H 1 1
3 825 1 1 11 ASN HA H -0.136 0.312 -2.780 1.00 . A A . 11 ASN HA 1 1
3 826 1 1 11 ASN HB2 H 0.419 2.118 -4.122 1.00 . A A . 11 ASN HB2 1 1
3 827 1 1 11 ASN HB3 H 1.682 2.617 -3.054 1.00 . A A . 11 ASN HB3 1 1
3 828 1 1 11 ASN HD21 H 2.460 -0.464 -5.738 1.00 . A A . 11 ASN HD21 1 1
3 829 1 1 11 ASN HD22 H 0.762 -0.183 -5.101 1.00 . A A . 11 ASN HD22 1 1
3 830 1 1 11 ASN N N -0.193 2.012 -1.501 1.00 . A A . 11 ASN N 1 1
3 831 1 1 11 ASN ND2 N 1.769 0.010 -5.146 1.00 . A A . 11 ASN ND2 1 1
3 832 1 1 11 ASN O O 2.629 -0.107 -1.562 1.00 . A A . 11 ASN O 1 1
3 833 1 1 11 ASN OD1 O 3.417 1.277 -4.357 1.00 . A A . 11 ASN OD1 1 1
3 834 1 1 12 ASN C C 2.680 -0.638 1.441 1.00 . A A . 12 ASN C 1 1
3 835 1 1 12 ASN CA C 1.497 -1.393 0.746 1.00 . A A . 12 ASN CA 1 1
3 836 1 1 12 ASN CB C 1.780 -2.776 0.119 1.00 . A A . 12 ASN CB 1 1
3 837 1 1 12 ASN CG C 2.175 -3.905 1.090 1.00 . A A . 12 ASN CG 1 1
3 838 1 1 12 ASN H H -0.203 -0.410 -0.182 1.00 . A A . 12 ASN H 1 1
3 839 1 1 12 ASN HA H 0.780 -1.609 1.527 1.00 . A A . 12 ASN HA 1 1
3 840 1 1 12 ASN HB2 H 0.890 -3.081 -0.468 1.00 . A A . 12 ASN HB2 1 1
3 841 1 1 12 ASN HB3 H 2.581 -2.644 -0.613 1.00 . A A . 12 ASN HB3 1 1
3 842 1 1 12 ASN HD21 H 1.492 -5.318 2.340 1.00 . A A . 12 ASN HD21 1 1
3 843 1 1 12 ASN HD22 H 0.244 -4.281 1.484 1.00 . A A . 12 ASN HD22 1 1
3 844 1 1 12 ASN N N 0.814 -0.518 -0.254 1.00 . A A . 12 ASN N 1 1
3 845 1 1 12 ASN ND2 N 1.204 -4.569 1.700 1.00 . A A . 12 ASN ND2 1 1
3 846 1 1 12 ASN O O 3.756 -1.217 1.600 1.00 . A A . 12 ASN O 1 1
3 847 1 1 12 ASN OD1 O 3.354 -4.192 1.294 1.00 . A A . 12 ASN OD1 1 1
3 848 1 1 13 LYS C C 4.728 1.637 1.560 1.00 . A A . 13 LYS C 1 1
3 849 1 1 13 LYS CA C 3.520 1.483 2.551 1.00 . A A . 13 LYS CA 1 1
3 850 1 1 13 LYS CB C 3.878 1.013 3.990 1.00 . A A . 13 LYS CB 1 1
3 851 1 1 13 LYS CD C 2.166 2.530 5.315 1.00 . A A . 13 LYS CD 1 1
3 852 1 1 13 LYS CE C 3.166 3.549 5.895 1.00 . A A . 13 LYS CE 1 1
3 853 1 1 13 LYS CG C 2.749 1.122 5.045 1.00 . A A . 13 LYS CG 1 1
3 854 1 1 13 LYS H H 1.540 1.033 1.719 1.00 . A A . 13 LYS H 1 1
3 855 1 1 13 LYS HA H 3.112 2.492 2.672 1.00 . A A . 13 LYS HA 1 1
3 856 1 1 13 LYS HB2 H 4.236 -0.033 3.958 1.00 . A A . 13 LYS HB2 1 1
3 857 1 1 13 LYS HB3 H 4.744 1.594 4.354 1.00 . A A . 13 LYS HB3 1 1
3 858 1 1 13 LYS HD2 H 1.707 2.928 4.390 1.00 . A A . 13 LYS HD2 1 1
3 859 1 1 13 LYS HD3 H 1.324 2.420 6.020 1.00 . A A . 13 LYS HD3 1 1
3 860 1 1 13 LYS HE2 H 3.617 3.159 6.826 1.00 . A A . 13 LYS HE2 1 1
3 861 1 1 13 LYS HE3 H 4.002 3.718 5.191 1.00 . A A . 13 LYS HE3 1 1
3 862 1 1 13 LYS HG2 H 1.921 0.454 4.743 1.00 . A A . 13 LYS HG2 1 1
3 863 1 1 13 LYS HG3 H 3.113 0.698 5.999 1.00 . A A . 13 LYS HG3 1 1
3 864 1 1 13 LYS HZ2 H 3.189 5.491 6.594 1.00 . A A . 13 LYS HZ2 1 1
3 865 1 1 13 LYS HZ3 H 1.779 4.715 6.883 1.00 . A A . 13 LYS HZ3 1 1
3 866 1 1 13 LYS N N 2.471 0.635 1.896 1.00 . A A . 13 LYS N 1 1
3 867 1 1 13 LYS NZ N 2.514 4.840 6.178 1.00 . A A . 13 LYS NZ 1 1
3 868 1 1 13 LYS O O 5.882 1.492 1.974 1.00 . A A . 13 LYS O 1 1
3 869 1 1 14 HIS C C 6.287 0.750 -0.931 1.00 . A A . 14 HIS C 1 1
3 870 1 1 14 HIS CA C 5.496 2.098 -0.815 1.00 . A A . 14 HIS CA 1 1
3 871 1 1 14 HIS CB C 6.298 3.404 -0.608 1.00 . A A . 14 HIS CB 1 1
3 872 1 1 14 HIS CD2 C 7.793 5.065 -1.856 1.00 . A A . 14 HIS CD2 1 1
3 873 1 1 14 HIS CE1 C 7.777 4.219 -3.779 1.00 . A A . 14 HIS CE1 1 1
3 874 1 1 14 HIS CG C 7.021 3.899 -1.849 1.00 . A A . 14 HIS CG 1 1
3 875 1 1 14 HIS H H 3.494 2.226 0.029 1.00 . A A . 14 HIS H 1 1
3 876 1 1 14 HIS HA H 4.973 2.217 -1.765 1.00 . A A . 14 HIS HA 1 1
3 877 1 1 14 HIS HB2 H 5.598 4.201 -0.293 1.00 . A A . 14 HIS HB2 1 1
3 878 1 1 14 HIS HB3 H 7.020 3.301 0.224 1.00 . A A . 14 HIS HB3 1 1
3 879 1 1 14 HIS HD2 H 7.931 5.692 -0.988 1.00 . A A . 14 HIS HD2 1 1
3 880 1 1 14 HIS HE1 H 7.977 4.083 -4.832 1.00 . A A . 14 HIS HE1 1 1
3 881 1 1 14 HIS HE2 H 8.896 6.060 -3.462 1.00 . A A . 14 HIS HE2 1 1
3 882 1 1 14 HIS N N 4.461 1.953 0.250 1.00 . A A . 14 HIS N 1 1
3 883 1 1 14 HIS ND1 N 6.982 3.316 -3.111 1.00 . A A . 14 HIS ND1 1 1
3 884 1 1 14 HIS NE2 N 8.307 5.294 -3.116 1.00 . A A . 14 HIS NE2 1 1
3 885 1 1 14 HIS O O 7.516 0.784 -1.024 1.00 . A A . 14 HIS O 1 1
3 886 1 1 15 LEU C C 7.171 -1.956 0.214 1.00 . A A . 15 LEU C 1 1
3 887 1 1 15 LEU CA C 6.233 -1.781 -1.037 1.00 . A A . 15 LEU CA 1 1
3 888 1 1 15 LEU CB C 6.894 -2.103 -2.418 1.00 . A A . 15 LEU CB 1 1
3 889 1 1 15 LEU CD1 C 5.246 -3.910 -3.267 1.00 . A A . 15 LEU CD1 1 1
3 890 1 1 15 LEU CD2 C 4.960 -1.516 -4.020 1.00 . A A . 15 LEU CD2 1 1
3 891 1 1 15 LEU CG C 5.984 -2.575 -3.587 1.00 . A A . 15 LEU CG 1 1
3 892 1 1 15 LEU H H 4.551 -0.376 -0.894 1.00 . A A . 15 LEU H 1 1
3 893 1 1 15 LEU HA H 5.442 -2.516 -0.899 1.00 . A A . 15 LEU HA 1 1
3 894 1 1 15 LEU HB2 H 7.499 -1.239 -2.751 1.00 . A A . 15 LEU HB2 1 1
3 895 1 1 15 LEU HB3 H 7.642 -2.905 -2.278 1.00 . A A . 15 LEU HB3 1 1
3 896 1 1 15 LEU HD11 H 4.695 -4.315 -4.136 1.00 . A A . 15 LEU HD11 1 1
3 897 1 1 15 LEU HD12 H 4.487 -3.798 -2.465 1.00 . A A . 15 LEU HD12 1 1
3 898 1 1 15 LEU HD13 H 5.930 -4.708 -2.922 1.00 . A A . 15 LEU HD13 1 1
3 899 1 1 15 LEU HD21 H 4.430 -1.816 -4.941 1.00 . A A . 15 LEU HD21 1 1
3 900 1 1 15 LEU HD22 H 4.191 -1.346 -3.244 1.00 . A A . 15 LEU HD22 1 1
3 901 1 1 15 LEU HD23 H 5.446 -0.544 -4.220 1.00 . A A . 15 LEU HD23 1 1
3 902 1 1 15 LEU HG H 6.671 -2.702 -4.460 1.00 . A A . 15 LEU HG 1 1
3 903 1 1 15 LEU N N 5.585 -0.433 -0.966 1.00 . A A . 15 LEU N 1 1
3 904 1 1 15 LEU O O 8.272 -2.500 0.085 1.00 . A A . 15 LEU O 1 1
3 905 1 1 16 ASN C C 8.886 -0.846 2.484 1.00 . A A . 16 ASN C 1 1
3 906 1 1 16 ASN CA C 7.516 -1.596 2.704 1.00 . A A . 16 ASN CA 1 1
3 907 1 1 16 ASN CB C 7.535 -3.041 3.235 1.00 . A A . 16 ASN CB 1 1
3 908 1 1 16 ASN CG C 8.029 -3.222 4.684 1.00 . A A . 16 ASN CG 1 1
3 909 1 1 16 ASN H H 5.766 -1.147 1.495 1.00 . A A . 16 ASN H 1 1
3 910 1 1 16 ASN HA H 6.956 -1.047 3.466 1.00 . A A . 16 ASN HA 1 1
3 911 1 1 16 ASN HB2 H 6.513 -3.456 3.124 1.00 . A A . 16 ASN HB2 1 1
3 912 1 1 16 ASN HB3 H 8.168 -3.628 2.566 1.00 . A A . 16 ASN HB3 1 1
3 913 1 1 16 ASN HD21 H 7.496 -3.230 6.618 1.00 . A A . 16 ASN HD21 1 1
3 914 1 1 16 ASN HD22 H 6.178 -2.894 5.386 1.00 . A A . 16 ASN HD22 1 1
3 915 1 1 16 ASN N N 6.723 -1.526 1.442 1.00 . A A . 16 ASN N 1 1
3 916 1 1 16 ASN ND2 N 7.144 -3.103 5.662 1.00 . A A . 16 ASN ND2 1 1
3 917 1 1 16 ASN O O 9.946 -1.362 2.849 1.00 . A A . 16 ASN O 1 1
3 918 1 1 16 ASN OD1 O 9.208 -3.474 4.932 1.00 . A A . 16 ASN OD1 1 1
3 919 1 1 17 GLU C C 10.987 0.486 0.532 1.00 . A A . 17 GLU C 1 1
3 920 1 1 17 GLU CA C 10.035 1.210 1.555 1.00 . A A . 17 GLU CA 1 1
3 921 1 1 17 GLU CB C 10.710 1.804 2.812 1.00 . A A . 17 GLU CB 1 1
3 922 1 1 17 GLU CD C 10.424 3.140 4.979 1.00 . A A . 17 GLU CD 1 1
3 923 1 1 17 GLU CG C 9.801 2.739 3.642 1.00 . A A . 17 GLU CG 1 1
3 924 1 1 17 GLU H H 7.908 0.713 1.569 1.00 . A A . 17 GLU H 1 1
3 925 1 1 17 GLU HA H 9.664 2.093 1.029 1.00 . A A . 17 GLU HA 1 1
3 926 1 1 17 GLU HB2 H 11.056 0.964 3.419 1.00 . A A . 17 GLU HB2 1 1
3 927 1 1 17 GLU HB3 H 11.622 2.361 2.523 1.00 . A A . 17 GLU HB3 1 1
3 928 1 1 17 GLU HE2 H 11.616 4.496 5.709 1.00 . A A . 17 GLU HE2 1 1
3 929 1 1 17 GLU HG2 H 9.557 3.645 3.056 1.00 . A A . 17 GLU HG2 1 1
3 930 1 1 17 GLU HG3 H 8.827 2.241 3.824 1.00 . A A . 17 GLU HG3 1 1
3 931 1 1 17 GLU N N 8.840 0.375 1.867 1.00 . A A . 17 GLU N 1 1
3 932 1 1 17 GLU O O 12.208 0.482 0.719 1.00 . A A . 17 GLU O 1 1
3 933 1 1 17 GLU OE1 O 10.223 2.532 6.030 1.00 . A A . 17 GLU OE1 1 1
3 934 1 1 17 GLU OE2 O 11.226 4.247 4.867 1.00 . A A . 17 GLU OE2 1 1
3 935 1 1 18 HIS C C 12.021 -2.034 -1.061 1.00 . A A . 18 HIS C 1 1
3 936 1 1 18 HIS CA C 11.168 -0.852 -1.617 1.00 . A A . 18 HIS CA 1 1
3 937 1 1 18 HIS CB C 11.898 0.162 -2.527 1.00 . A A . 18 HIS CB 1 1
3 938 1 1 18 HIS CD2 C 12.928 0.412 -4.856 1.00 . A A . 18 HIS CD2 1 1
3 939 1 1 18 HIS CE1 C 12.540 -1.494 -5.650 1.00 . A A . 18 HIS CE1 1 1
3 940 1 1 18 HIS CG C 12.275 -0.370 -3.900 1.00 . A A . 18 HIS CG 1 1
3 941 1 1 18 HIS H H 9.401 -0.040 -0.654 1.00 . A A . 18 HIS H 1 1
3 942 1 1 18 HIS HA H 10.388 -1.294 -2.267 1.00 . A A . 18 HIS HA 1 1
3 943 1 1 18 HIS HB2 H 11.226 1.029 -2.681 1.00 . A A . 18 HIS HB2 1 1
3 944 1 1 18 HIS HB3 H 12.796 0.572 -2.029 1.00 . A A . 18 HIS HB3 1 1
3 945 1 1 18 HIS HD2 H 13.210 1.441 -4.692 1.00 . A A . 18 HIS HD2 1 1
3 946 1 1 18 HIS HE1 H 12.505 -2.316 -6.350 1.00 . A A . 18 HIS HE1 1 1
3 947 1 1 18 HIS HE2 H 13.550 -0.030 -6.907 1.00 . A A . 18 HIS HE2 1 1
3 948 1 1 18 HIS N N 10.423 -0.122 -0.555 1.00 . A A . 18 HIS N 1 1
3 949 1 1 18 HIS ND1 N 11.995 -1.639 -4.395 1.00 . A A . 18 HIS ND1 1 1
3 950 1 1 18 HIS NE2 N 13.120 -0.308 -6.018 1.00 . A A . 18 HIS NE2 1 1
3 951 1 1 18 HIS O O 13.232 -1.901 -0.855 1.00 . A A . 18 HIS O 1 1
3 952 1 1 19 ALA C C 11.074 -5.601 -0.606 1.00 . A A . 19 ALA C 1 1
3 953 1 1 19 ALA CA C 11.992 -4.397 -0.272 1.00 . A A . 19 ALA CA 1 1
3 954 1 1 19 ALA CB C 12.268 -4.291 1.246 1.00 . A A . 19 ALA CB 1 1
3 955 1 1 19 ALA H H 10.394 -3.210 -1.152 1.00 . A A . 19 ALA H 1 1
3 956 1 1 19 ALA HA H 12.960 -4.515 -0.787 1.00 . A A . 19 ALA HA 1 1
3 957 1 1 19 ALA HB1 H 11.343 -4.128 1.831 1.00 . A A . 19 ALA HB1 1 1
3 958 1 1 19 ALA HB2 H 12.953 -3.455 1.480 1.00 . A A . 19 ALA HB2 1 1
3 959 1 1 19 ALA HB3 H 12.744 -5.210 1.634 1.00 . A A . 19 ALA HB3 1 1
3 960 1 1 19 ALA N N 11.352 -3.175 -0.801 1.00 . A A . 19 ALA N 1 1
3 961 1 1 19 ALA O O 10.044 -5.815 0.045 1.00 . A A . 19 ALA O 1 1
3 962 1 1 20 HIS C C 11.002 -8.803 -1.154 1.00 . A A . 20 HIS C 1 1
3 963 1 1 20 HIS CA C 10.713 -7.583 -2.077 1.00 . A A . 20 HIS CA 1 1
3 964 1 1 20 HIS CB C 11.062 -7.858 -3.562 1.00 . A A . 20 HIS CB 1 1
3 965 1 1 20 HIS CD2 C 10.260 -9.175 -5.613 1.00 . A A . 20 HIS CD2 1 1
3 966 1 1 20 HIS CE1 C 8.449 -9.947 -4.879 1.00 . A A . 20 HIS CE1 1 1
3 967 1 1 20 HIS CG C 10.084 -8.775 -4.283 1.00 . A A . 20 HIS CG 1 1
3 968 1 1 20 HIS H H 12.238 -6.020 -2.181 1.00 . A A . 20 HIS H 1 1
3 969 1 1 20 HIS HA H 9.644 -7.315 -2.062 1.00 . A A . 20 HIS HA 1 1
3 970 1 1 20 HIS HB2 H 11.084 -6.917 -4.145 1.00 . A A . 20 HIS HB2 1 1
3 971 1 1 20 HIS HB3 H 12.087 -8.267 -3.654 1.00 . A A . 20 HIS HB3 1 1
3 972 1 1 20 HIS HD2 H 11.096 -8.871 -6.224 1.00 . A A . 20 HIS HD2 1 1
3 973 1 1 20 HIS HE1 H 7.505 -10.472 -4.850 1.00 . A A . 20 HIS HE1 1 1
3 974 1 1 20 HIS HE2 H 9.010 -10.387 -6.937 1.00 . A A . 20 HIS HE2 1 1
3 975 1 1 20 HIS N N 11.470 -6.392 -1.622 1.00 . A A . 20 HIS N 1 1
3 976 1 1 20 HIS ND1 N 8.886 -9.260 -3.770 1.00 . A A . 20 HIS ND1 1 1
3 977 1 1 20 HIS NE2 N 9.199 -9.956 -6.025 1.00 . A A . 20 HIS NE2 1 1
3 978 1 1 20 HIS O O 12.119 -9.321 -1.085 1.00 . A A . 20 HIS O 1 1
4 979 1 1 1 SER C C -12.356 -3.638 0.212 1.00 . A A . 1 SER C 1 1
4 980 1 1 1 SER CA C -12.119 -5.080 0.776 1.00 . A A . 1 SER CA 1 1
4 981 1 1 1 SER CB C -13.415 -5.921 0.869 1.00 . A A . 1 SER CB 1 1
4 982 1 1 1 SER H1 H -12.042 -4.709 2.929 1.00 . A A . 1 SER H1 1 1
4 983 1 1 1 SER HA H -11.455 -5.582 0.050 1.00 . A A . 1 SER HA 1 1
4 984 1 1 1 SER HB2 H -13.238 -6.854 1.440 1.00 . A A . 1 SER HB2 1 1
4 985 1 1 1 SER HB3 H -14.210 -5.371 1.413 1.00 . A A . 1 SER HB3 1 1
4 986 1 1 1 SER HG H -14.060 -5.438 -0.877 1.00 . A A . 1 SER HG 1 1
4 987 1 1 1 SER N N -11.526 -5.113 2.145 1.00 . A A . 1 SER N 1 1
4 988 1 1 1 SER O O -13.337 -3.388 -0.497 1.00 . A A . 1 SER O 1 1
4 989 1 1 1 SER OG O -13.887 -6.268 -0.428 1.00 . A A . 1 SER OG 1 1
4 990 1 1 2 ASP C C -10.041 -0.705 0.128 1.00 . A A . 2 ASP C 1 1
4 991 1 1 2 ASP CA C -11.479 -1.304 0.016 1.00 . A A . 2 ASP CA 1 1
4 992 1 1 2 ASP CB C -12.566 -0.479 0.785 1.00 . A A . 2 ASP CB 1 1
4 993 1 1 2 ASP CG C -12.882 0.881 0.150 1.00 . A A . 2 ASP CG 1 1
4 994 1 1 2 ASP H H -10.637 -3.056 1.029 1.00 . A A . 2 ASP H 1 1
4 995 1 1 2 ASP HA H -11.718 -1.353 -1.065 1.00 . A A . 2 ASP HA 1 1
4 996 1 1 2 ASP HB2 H -13.521 -1.036 0.903 1.00 . A A . 2 ASP HB2 1 1
4 997 1 1 2 ASP HB3 H -12.236 -0.317 1.829 1.00 . A A . 2 ASP HB3 1 1
4 998 1 1 2 ASP HD2 H -13.851 1.620 -1.368 1.00 . A A . 2 ASP HD2 1 1
4 999 1 1 2 ASP N N -11.434 -2.700 0.504 1.00 . A A . 2 ASP N 1 1
4 1000 1 1 2 ASP O O -9.758 0.123 1.001 1.00 . A A . 2 ASP O 1 1
4 1001 1 1 2 ASP OD1 O -12.479 1.948 0.611 1.00 . A A . 2 ASP OD1 1 1
4 1002 1 1 2 ASP OD2 O -13.656 0.765 -0.976 1.00 . A A . 2 ASP OD2 1 1
4 1003 1 1 3 THR C C -7.431 0.710 -1.524 1.00 . A A . 3 THR C 1 1
4 1004 1 1 3 THR CA C -7.743 -0.621 -0.861 1.00 . A A . 3 THR CA 1 1
4 1005 1 1 3 THR CB C -6.771 -1.779 -1.241 1.00 . A A . 3 THR CB 1 1
4 1006 1 1 3 THR CG2 C -6.776 -2.181 -2.724 1.00 . A A . 3 THR CG2 1 1
4 1007 1 1 3 THR H H -9.424 -1.955 -1.301 1.00 . A A . 3 THR H 1 1
4 1008 1 1 3 THR HA H -7.465 -0.241 0.069 1.00 . A A . 3 THR HA 1 1
4 1009 1 1 3 THR HB H -7.033 -2.676 -0.648 1.00 . A A . 3 THR HB 1 1
4 1010 1 1 3 THR HG1 H -5.455 -1.243 0.059 1.00 . A A . 3 THR HG1 1 1
4 1011 1 1 3 THR HG21 H -7.786 -2.480 -3.059 1.00 . A A . 3 THR HG21 1 1
4 1012 1 1 3 THR HG22 H -6.442 -1.349 -3.370 1.00 . A A . 3 THR HG22 1 1
4 1013 1 1 3 THR HG23 H -6.097 -3.033 -2.906 1.00 . A A . 3 THR HG23 1 1
4 1014 1 1 3 THR N N -9.146 -1.120 -0.791 1.00 . A A . 3 THR N 1 1
4 1015 1 1 3 THR O O -6.381 1.294 -1.244 1.00 . A A . 3 THR O 1 1
4 1016 1 1 3 THR OG1 O -5.436 -1.431 -0.882 1.00 . A A . 3 THR OG1 1 1
4 1017 1 1 4 ARG C C -6.855 2.576 -3.859 1.00 . A A . 4 ARG C 1 1
4 1018 1 1 4 ARG CA C -8.159 2.527 -3.029 1.00 . A A . 4 ARG CA 1 1
4 1019 1 1 4 ARG CB C -8.407 3.782 -2.129 1.00 . A A . 4 ARG CB 1 1
4 1020 1 1 4 ARG CD C -11.003 4.014 -2.348 1.00 . A A . 4 ARG CD 1 1
4 1021 1 1 4 ARG CG C -9.778 3.902 -1.417 1.00 . A A . 4 ARG CG 1 1
4 1022 1 1 4 ARG CZ C -13.492 4.131 -2.064 1.00 . A A . 4 ARG CZ 1 1
4 1023 1 1 4 ARG H H -9.211 0.685 -2.245 1.00 . A A . 4 ARG H 1 1
4 1024 1 1 4 ARG HA H -8.813 2.478 -3.854 1.00 . A A . 4 ARG HA 1 1
4 1025 1 1 4 ARG HB2 H -7.620 3.832 -1.349 1.00 . A A . 4 ARG HB2 1 1
4 1026 1 1 4 ARG HB3 H -8.247 4.709 -2.715 1.00 . A A . 4 ARG HB3 1 1
4 1027 1 1 4 ARG HD2 H -10.869 4.852 -3.057 1.00 . A A . 4 ARG HD2 1 1
4 1028 1 1 4 ARG HD3 H -11.093 3.095 -2.957 1.00 . A A . 4 ARG HD3 1 1
4 1029 1 1 4 ARG HG2 H -9.909 3.046 -0.728 1.00 . A A . 4 ARG HG2 1 1
4 1030 1 1 4 ARG HG3 H -9.738 4.793 -0.761 1.00 . A A . 4 ARG HG3 1 1
4 1031 1 1 4 ARG HH11 H -15.446 4.266 -1.646 1.00 . A A . 4 ARG HH11 1 1
4 1032 1 1 4 ARG HH12 H -14.268 4.588 -0.275 1.00 . A A . 4 ARG HH12 1 1
4 1033 1 1 4 ARG HH21 H -14.760 3.773 -3.585 1.00 . A A . 4 ARG HH21 1 1
4 1034 1 1 4 ARG HH22 H -12.965 3.654 -3.946 1.00 . A A . 4 ARG HH22 1 1
4 1035 1 1 4 ARG N N -8.358 1.241 -2.303 1.00 . A A . 4 ARG N 1 1
4 1036 1 1 4 ARG NE N -12.244 4.234 -1.567 1.00 . A A . 4 ARG NE 1 1
4 1037 1 1 4 ARG NH1 N -14.505 4.351 -1.245 1.00 . A A . 4 ARG NH1 1 1
4 1038 1 1 4 ARG NH2 N -13.767 3.821 -3.329 1.00 . A A . 4 ARG NH2 1 1
4 1039 1 1 4 ARG O O -6.312 3.648 -4.142 1.00 . A A . 4 ARG O 1 1
4 1040 1 1 5 TYR C C -3.942 1.853 -4.432 1.00 . A A . 5 TYR C 1 1
4 1041 1 1 5 TYR CA C -5.188 1.172 -5.136 1.00 . A A . 5 TYR CA 1 1
4 1042 1 1 5 TYR CB C -5.634 1.416 -6.580 1.00 . A A . 5 TYR CB 1 1
4 1043 1 1 5 TYR CD1 C -3.899 0.423 -8.157 1.00 . A A . 5 TYR CD1 1 1
4 1044 1 1 5 TYR CD2 C -4.181 2.822 -8.122 1.00 . A A . 5 TYR CD2 1 1
4 1045 1 1 5 TYR CE1 C -2.903 0.555 -9.123 1.00 . A A . 5 TYR CE1 1 1
4 1046 1 1 5 TYR CE2 C -3.185 2.952 -9.087 1.00 . A A . 5 TYR CE2 1 1
4 1047 1 1 5 TYR CG C -4.544 1.556 -7.649 1.00 . A A . 5 TYR CG 1 1
4 1048 1 1 5 TYR CZ C -2.546 1.819 -9.588 1.00 . A A . 5 TYR CZ 1 1
4 1049 1 1 5 TYR H H -6.879 0.579 -3.873 1.00 . A A . 5 TYR H 1 1
4 1050 1 1 5 TYR HA H -4.954 0.096 -5.064 1.00 . A A . 5 TYR HA 1 1
4 1051 1 1 5 TYR HB2 H -6.302 0.564 -6.813 1.00 . A A . 5 TYR HB2 1 1
4 1052 1 1 5 TYR HB3 H -6.334 2.265 -6.567 1.00 . A A . 5 TYR HB3 1 1
4 1053 1 1 5 TYR HD1 H -4.164 -0.564 -7.803 1.00 . A A . 5 TYR HD1 1 1
4 1054 1 1 5 TYR HD2 H -4.664 3.710 -7.740 1.00 . A A . 5 TYR HD2 1 1
4 1055 1 1 5 TYR HE1 H -2.410 -0.326 -9.508 1.00 . A A . 5 TYR HE1 1 1
4 1056 1 1 5 TYR HE2 H -2.909 3.934 -9.445 1.00 . A A . 5 TYR HE2 1 1
4 1057 1 1 5 TYR HH H -1.447 2.879 -10.742 1.00 . A A . 5 TYR HH 1 1
4 1058 1 1 5 TYR N N -6.435 1.371 -4.346 1.00 . A A . 5 TYR N 1 1
4 1059 1 1 5 TYR O O -3.016 2.430 -5.004 1.00 . A A . 5 TYR O 1 1
4 1060 1 1 5 TYR OH O -1.565 1.948 -10.539 1.00 . A A . 5 TYR OH 1 1
4 1061 1 1 6 ASN C C -3.124 3.560 -1.624 1.00 . A A . 6 ASN C 1 1
4 1062 1 1 6 ASN CA C -3.250 2.036 -2.025 1.00 . A A . 6 ASN CA 1 1
4 1063 1 1 6 ASN CB C -2.420 0.972 -1.290 1.00 . A A . 6 ASN CB 1 1
4 1064 1 1 6 ASN CG C -1.538 0.066 -2.180 1.00 . A A . 6 ASN CG 1 1
4 1065 1 1 6 ASN H H -4.934 1.351 -2.712 1.00 . A A . 6 ASN H 1 1
4 1066 1 1 6 ASN HA H -4.016 1.542 -1.402 1.00 . A A . 6 ASN HA 1 1
4 1067 1 1 6 ASN HB2 H -1.985 1.562 -0.513 1.00 . A A . 6 ASN HB2 1 1
4 1068 1 1 6 ASN HB3 H -2.976 0.299 -0.568 1.00 . A A . 6 ASN HB3 1 1
4 1069 1 1 6 ASN HD21 H -1.621 -1.656 -3.221 1.00 . A A . 6 ASN HD21 1 1
4 1070 1 1 6 ASN HD22 H -3.124 -1.081 -2.313 1.00 . A A . 6 ASN HD22 1 1
4 1071 1 1 6 ASN N N -4.040 1.655 -3.110 1.00 . A A . 6 ASN N 1 1
4 1072 1 1 6 ASN ND2 N -2.126 -1.054 -2.560 1.00 . A A . 6 ASN ND2 1 1
4 1073 1 1 6 ASN O O -2.228 4.334 -1.959 1.00 . A A . 6 ASN O 1 1
4 1074 1 1 6 ASN OD1 O -0.408 0.354 -2.566 1.00 . A A . 6 ASN OD1 1 1
4 1075 1 1 7 LYS C C -4.758 4.206 1.246 1.00 . A A . 7 LYS C 1 1
4 1076 1 1 7 LYS CA C -4.608 5.027 -0.104 1.00 . A A . 7 LYS CA 1 1
4 1077 1 1 7 LYS CB C -5.808 5.897 -0.458 1.00 . A A . 7 LYS CB 1 1
4 1078 1 1 7 LYS CD C -4.735 7.170 -2.497 1.00 . A A . 7 LYS CD 1 1
4 1079 1 1 7 LYS CE C -4.421 8.541 -1.860 1.00 . A A . 7 LYS CE 1 1
4 1080 1 1 7 LYS CG C -5.936 6.388 -1.915 1.00 . A A . 7 LYS CG 1 1
4 1081 1 1 7 LYS H H -5.070 3.549 -1.312 1.00 . A A . 7 LYS H 1 1
4 1082 1 1 7 LYS HA H -3.772 5.685 0.086 1.00 . A A . 7 LYS HA 1 1
4 1083 1 1 7 LYS HB2 H -6.716 5.361 -0.152 1.00 . A A . 7 LYS HB2 1 1
4 1084 1 1 7 LYS HB3 H -5.724 6.770 0.222 1.00 . A A . 7 LYS HB3 1 1
4 1085 1 1 7 LYS HD2 H -3.834 6.534 -2.426 1.00 . A A . 7 LYS HD2 1 1
4 1086 1 1 7 LYS HD3 H -4.893 7.297 -3.585 1.00 . A A . 7 LYS HD3 1 1
4 1087 1 1 7 LYS HE2 H -4.268 8.439 -0.771 1.00 . A A . 7 LYS HE2 1 1
4 1088 1 1 7 LYS HE3 H -3.461 8.914 -2.260 1.00 . A A . 7 LYS HE3 1 1
4 1089 1 1 7 LYS HG2 H -6.121 5.512 -2.556 1.00 . A A . 7 LYS HG2 1 1
4 1090 1 1 7 LYS HG3 H -6.853 6.999 -2.008 1.00 . A A . 7 LYS HG3 1 1
4 1091 1 1 7 LYS HZ2 H -6.349 9.267 -1.695 1.00 . A A . 7 LYS HZ2 1 1
4 1092 1 1 7 LYS HZ3 H -5.210 10.440 -1.659 1.00 . A A . 7 LYS HZ3 1 1
4 1093 1 1 7 LYS N N -4.181 3.849 -0.874 1.00 . A A . 7 LYS N 1 1
4 1094 1 1 7 LYS NZ N -5.460 9.557 -2.118 1.00 . A A . 7 LYS NZ 1 1
4 1095 1 1 7 LYS O O -4.310 4.721 2.275 1.00 . A A . 7 LYS O 1 1
4 1096 1 1 8 SER C C -4.026 1.647 2.662 1.00 . A A . 8 SER C 1 1
4 1097 1 1 8 SER CA C -5.508 2.118 2.449 1.00 . A A . 8 SER CA 1 1
4 1098 1 1 8 SER CB C -6.512 0.980 2.291 1.00 . A A . 8 SER CB 1 1
4 1099 1 1 8 SER H H -5.860 2.756 0.373 1.00 . A A . 8 SER H 1 1
4 1100 1 1 8 SER HA H -5.870 2.745 3.207 1.00 . A A . 8 SER HA 1 1
4 1101 1 1 8 SER HB2 H -7.501 1.355 1.962 1.00 . A A . 8 SER HB2 1 1
4 1102 1 1 8 SER HB3 H -6.137 0.302 1.520 1.00 . A A . 8 SER HB3 1 1
4 1103 1 1 8 SER HG H -6.997 0.905 4.149 1.00 . A A . 8 SER HG 1 1
4 1104 1 1 8 SER N N -5.415 2.976 1.278 1.00 . A A . 8 SER N 1 1
4 1105 1 1 8 SER O O -3.423 0.942 1.838 1.00 . A A . 8 SER O 1 1
4 1106 1 1 8 SER OG O -6.663 0.269 3.513 1.00 . A A . 8 SER OG 1 1
4 1107 1 1 9 PHE C C -0.951 2.875 3.571 1.00 . A A . 9 PHE C 1 1
4 1108 1 1 9 PHE CA C -2.026 1.887 4.124 1.00 . A A . 9 PHE CA 1 1
4 1109 1 1 9 PHE CB C -1.787 0.367 4.314 1.00 . A A . 9 PHE CB 1 1
4 1110 1 1 9 PHE CD1 C -0.070 -1.347 5.062 1.00 . A A . 9 PHE CD1 1 1
4 1111 1 1 9 PHE CD2 C -0.695 0.367 6.643 1.00 . A A . 9 PHE CD2 1 1
4 1112 1 1 9 PHE CE1 C 0.699 -1.970 6.042 1.00 . A A . 9 PHE CE1 1 1
4 1113 1 1 9 PHE CE2 C 0.072 -0.260 7.623 1.00 . A A . 9 PHE CE2 1 1
4 1114 1 1 9 PHE CG C -0.770 -0.167 5.348 1.00 . A A . 9 PHE CG 1 1
4 1115 1 1 9 PHE CZ C 0.761 -1.431 7.323 1.00 . A A . 9 PHE CZ 1 1
4 1116 1 1 9 PHE H H -3.888 2.708 4.442 1.00 . A A . 9 PHE H 1 1
4 1117 1 1 9 PHE HA H -2.088 2.220 5.093 1.00 . A A . 9 PHE HA 1 1
4 1118 1 1 9 PHE HB2 H -2.763 -0.041 4.647 1.00 . A A . 9 PHE HB2 1 1
4 1119 1 1 9 PHE HB3 H -1.636 -0.066 3.326 1.00 . A A . 9 PHE HB3 1 1
4 1120 1 1 9 PHE HD1 H -0.151 -1.820 4.096 1.00 . A A . 9 PHE HD1 1 1
4 1121 1 1 9 PHE HD2 H -1.259 1.246 6.916 1.00 . A A . 9 PHE HD2 1 1
4 1122 1 1 9 PHE HE1 H 1.229 -2.883 5.813 1.00 . A A . 9 PHE HE1 1 1
4 1123 1 1 9 PHE HE2 H 0.118 0.154 8.620 1.00 . A A . 9 PHE HE2 1 1
4 1124 1 1 9 PHE HZ H 1.350 -1.919 8.085 1.00 . A A . 9 PHE HZ 1 1
4 1125 1 1 9 PHE N N -3.405 2.165 3.731 1.00 . A A . 9 PHE N 1 1
4 1126 1 1 9 PHE O O 0.222 2.718 3.901 1.00 . A A . 9 PHE O 1 1
4 1127 1 1 10 ILE C C 0.389 4.226 1.270 1.00 . A A . 10 ILE C 1 1
4 1128 1 1 10 ILE CA C -0.487 5.049 2.264 1.00 . A A . 10 ILE CA 1 1
4 1129 1 1 10 ILE CB C 0.231 5.992 3.279 1.00 . A A . 10 ILE CB 1 1
4 1130 1 1 10 ILE CD1 C -0.146 7.275 5.525 1.00 . A A . 10 ILE CD1 1 1
4 1131 1 1 10 ILE CG1 C -0.765 6.723 4.231 1.00 . A A . 10 ILE CG1 1 1
4 1132 1 1 10 ILE CG2 C 1.148 7.026 2.576 1.00 . A A . 10 ILE CG2 1 1
4 1133 1 1 10 ILE H H -2.355 4.021 2.695 1.00 . A A . 10 ILE H 1 1
4 1134 1 1 10 ILE HA H -1.197 5.706 1.748 1.00 . A A . 10 ILE HA 1 1
4 1135 1 1 10 ILE HB H 0.863 5.331 3.878 1.00 . A A . 10 ILE HB 1 1
4 1136 1 1 10 ILE HD11 H 0.344 6.478 6.115 1.00 . A A . 10 ILE HD11 1 1
4 1137 1 1 10 ILE HD12 H 0.610 8.056 5.325 1.00 . A A . 10 ILE HD12 1 1
4 1138 1 1 10 ILE HD13 H -0.919 7.730 6.170 1.00 . A A . 10 ILE HD13 1 1
4 1139 1 1 10 ILE HG12 H -1.277 7.545 3.690 1.00 . A A . 10 ILE HG12 1 1
4 1140 1 1 10 ILE HG13 H -1.572 6.025 4.530 1.00 . A A . 10 ILE HG13 1 1
4 1141 1 1 10 ILE HG21 H 1.913 6.545 1.941 1.00 . A A . 10 ILE HG21 1 1
4 1142 1 1 10 ILE HG22 H 0.573 7.713 1.927 1.00 . A A . 10 ILE HG22 1 1
4 1143 1 1 10 ILE HG23 H 1.703 7.649 3.301 1.00 . A A . 10 ILE HG23 1 1
4 1144 1 1 10 ILE N N -1.354 3.988 2.880 1.00 . A A . 10 ILE N 1 1
4 1145 1 1 10 ILE O O 1.567 3.987 1.551 1.00 . A A . 10 ILE O 1 1
4 1146 1 1 11 ASN C C 0.894 1.577 -0.140 1.00 . A A . 11 ASN C 1 1
4 1147 1 1 11 ASN CA C 0.448 2.906 -0.852 1.00 . A A . 11 ASN CA 1 1
4 1148 1 1 11 ASN CB C 1.433 3.776 -1.669 1.00 . A A . 11 ASN CB 1 1
4 1149 1 1 11 ASN CG C 2.163 3.140 -2.862 1.00 . A A . 11 ASN CG 1 1
4 1150 1 1 11 ASN H H -0.701 4.447 -0.389 1.00 . A A . 11 ASN H 1 1
4 1151 1 1 11 ASN HA H -0.301 2.637 -1.594 1.00 . A A . 11 ASN HA 1 1
4 1152 1 1 11 ASN HB2 H 0.905 4.674 -2.048 1.00 . A A . 11 ASN HB2 1 1
4 1153 1 1 11 ASN HB3 H 2.153 4.174 -0.956 1.00 . A A . 11 ASN HB3 1 1
4 1154 1 1 11 ASN HD21 H 1.958 2.358 -4.699 1.00 . A A . 11 ASN HD21 1 1
4 1155 1 1 11 ASN HD22 H 0.429 2.902 -3.844 1.00 . A A . 11 ASN HD22 1 1
4 1156 1 1 11 ASN N N -0.219 3.737 0.154 1.00 . A A . 11 ASN N 1 1
4 1157 1 1 11 ASN ND2 N 1.443 2.761 -3.909 1.00 . A A . 11 ASN ND2 1 1
4 1158 1 1 11 ASN O O 1.952 1.092 -0.544 1.00 . A A . 11 ASN O 1 1
4 1159 1 1 11 ASN OD1 O 3.387 3.026 -2.871 1.00 . A A . 11 ASN OD1 1 1
4 1160 1 1 12 ASN C C 2.080 -0.103 2.125 1.00 . A A . 12 ASN C 1 1
4 1161 1 1 12 ASN CA C 0.658 -0.334 1.489 1.00 . A A . 12 ASN CA 1 1
4 1162 1 1 12 ASN CB C 0.475 -1.532 0.531 1.00 . A A . 12 ASN CB 1 1
4 1163 1 1 12 ASN CG C 0.628 -2.934 1.152 1.00 . A A . 12 ASN CG 1 1
4 1164 1 1 12 ASN H H -0.865 1.251 1.072 1.00 . A A . 12 ASN H 1 1
4 1165 1 1 12 ASN HA H 0.032 -0.599 2.308 1.00 . A A . 12 ASN HA 1 1
4 1166 1 1 12 ASN HB2 H -0.522 -1.442 0.057 1.00 . A A . 12 ASN HB2 1 1
4 1167 1 1 12 ASN HB3 H 1.197 -1.424 -0.285 1.00 . A A . 12 ASN HB3 1 1
4 1168 1 1 12 ASN HD21 H -0.319 -4.436 2.086 1.00 . A A . 12 ASN HD21 1 1
4 1169 1 1 12 ASN HD22 H -1.316 -2.960 1.645 1.00 . A A . 12 ASN HD22 1 1
4 1170 1 1 12 ASN N N 0.133 0.927 0.843 1.00 . A A . 12 ASN N 1 1
4 1171 1 1 12 ASN ND2 N -0.445 -3.501 1.682 1.00 . A A . 12 ASN ND2 1 1
4 1172 1 1 12 ASN O O 2.991 -0.908 1.921 1.00 . A A . 12 ASN O 1 1
4 1173 1 1 12 ASN OD1 O 1.711 -3.520 1.153 1.00 . A A . 12 ASN OD1 1 1
4 1174 1 1 13 LYS C C 4.551 1.700 2.447 1.00 . A A . 13 LYS C 1 1
4 1175 1 1 13 LYS CA C 3.514 1.416 3.585 1.00 . A A . 13 LYS CA 1 1
4 1176 1 1 13 LYS CB C 3.992 0.448 4.709 1.00 . A A . 13 LYS CB 1 1
4 1177 1 1 13 LYS CD C 3.944 1.636 7.070 1.00 . A A . 13 LYS CD 1 1
4 1178 1 1 13 LYS CE C 3.901 3.140 6.728 1.00 . A A . 13 LYS CE 1 1
4 1179 1 1 13 LYS CG C 3.299 0.642 6.075 1.00 . A A . 13 LYS CG 1 1
4 1180 1 1 13 LYS H H 1.437 1.632 2.965 1.00 . A A . 13 LYS H 1 1
4 1181 1 1 13 LYS HA H 3.328 2.383 4.069 1.00 . A A . 13 LYS HA 1 1
4 1182 1 1 13 LYS HB2 H 3.855 -0.598 4.379 1.00 . A A . 13 LYS HB2 1 1
4 1183 1 1 13 LYS HB3 H 5.082 0.541 4.866 1.00 . A A . 13 LYS HB3 1 1
4 1184 1 1 13 LYS HD2 H 3.404 1.510 8.027 1.00 . A A . 13 LYS HD2 1 1
4 1185 1 1 13 LYS HD3 H 4.979 1.320 7.299 1.00 . A A . 13 LYS HD3 1 1
4 1186 1 1 13 LYS HE2 H 2.931 3.413 6.272 1.00 . A A . 13 LYS HE2 1 1
4 1187 1 1 13 LYS HE3 H 3.963 3.725 7.664 1.00 . A A . 13 LYS HE3 1 1
4 1188 1 1 13 LYS HG2 H 2.231 0.890 5.931 1.00 . A A . 13 LYS HG2 1 1
4 1189 1 1 13 LYS HG3 H 3.294 -0.343 6.576 1.00 . A A . 13 LYS HG3 1 1
4 1190 1 1 13 LYS HZ2 H 4.943 3.098 4.944 1.00 . A A . 13 LYS HZ2 1 1
4 1191 1 1 13 LYS HZ3 H 4.924 4.573 5.647 1.00 . A A . 13 LYS HZ3 1 1
4 1192 1 1 13 LYS N N 2.240 0.997 2.919 1.00 . A A . 13 LYS N 1 1
4 1193 1 1 13 LYS NZ N 5.008 3.571 5.852 1.00 . A A . 13 LYS NZ 1 1
4 1194 1 1 13 LYS O O 5.715 1.319 2.592 1.00 . A A . 13 LYS O 1 1
4 1195 1 1 14 HIS C C 5.659 1.335 -0.368 1.00 . A A . 14 HIS C 1 1
4 1196 1 1 14 HIS CA C 5.081 2.695 0.183 1.00 . A A . 14 HIS CA 1 1
4 1197 1 1 14 HIS CB C 6.090 3.811 0.541 1.00 . A A . 14 HIS CB 1 1
4 1198 1 1 14 HIS CD2 C 7.616 5.548 -0.557 1.00 . A A . 14 HIS CD2 1 1
4 1199 1 1 14 HIS CE1 C 7.145 5.237 -2.581 1.00 . A A . 14 HIS CE1 1 1
4 1200 1 1 14 HIS CG C 6.680 4.516 -0.668 1.00 . A A . 14 HIS CG 1 1
4 1201 1 1 14 HIS H H 3.254 2.913 1.388 1.00 . A A . 14 HIS H 1 1
4 1202 1 1 14 HIS HA H 4.465 3.096 -0.618 1.00 . A A . 14 HIS HA 1 1
4 1203 1 1 14 HIS HB2 H 5.582 4.581 1.154 1.00 . A A . 14 HIS HB2 1 1
4 1204 1 1 14 HIS HB3 H 6.904 3.420 1.180 1.00 . A A . 14 HIS HB3 1 1
4 1205 1 1 14 HIS HD2 H 7.989 5.914 0.388 1.00 . A A . 14 HIS HD2 1 1
4 1206 1 1 14 HIS HE1 H 7.142 5.358 -3.655 1.00 . A A . 14 HIS HE1 1 1
4 1207 1 1 14 HIS HE2 H 8.579 6.797 -2.074 1.00 . A A . 14 HIS HE2 1 1
4 1208 1 1 14 HIS N N 4.167 2.416 1.334 1.00 . A A . 14 HIS N 1 1
4 1209 1 1 14 HIS ND1 N 6.339 4.289 -1.996 1.00 . A A . 14 HIS ND1 1 1
4 1210 1 1 14 HIS NE2 N 7.944 6.036 -1.806 1.00 . A A . 14 HIS NE2 1 1
4 1211 1 1 14 HIS O O 6.854 1.259 -0.662 1.00 . A A . 14 HIS O 1 1
4 1212 1 1 15 LEU C C 6.222 -1.666 0.038 1.00 . A A . 15 LEU C 1 1
4 1213 1 1 15 LEU CA C 5.210 -1.083 -1.010 1.00 . A A . 15 LEU CA 1 1
4 1214 1 1 15 LEU CB C 5.655 -1.160 -2.506 1.00 . A A . 15 LEU CB 1 1
4 1215 1 1 15 LEU CD1 C 3.669 -2.570 -3.400 1.00 . A A . 15 LEU CD1 1 1
4 1216 1 1 15 LEU CD2 C 3.660 -0.066 -3.708 1.00 . A A . 15 LEU CD2 1 1
4 1217 1 1 15 LEU CG C 4.558 -1.305 -3.598 1.00 . A A . 15 LEU CG 1 1
4 1218 1 1 15 LEU H H 3.817 0.417 -0.250 1.00 . A A . 15 LEU H 1 1
4 1219 1 1 15 LEU HA H 4.330 -1.716 -0.930 1.00 . A A . 15 LEU HA 1 1
4 1220 1 1 15 LEU HB2 H 6.308 -0.300 -2.748 1.00 . A A . 15 LEU HB2 1 1
4 1221 1 1 15 LEU HB3 H 6.318 -2.035 -2.635 1.00 . A A . 15 LEU HB3 1 1
4 1222 1 1 15 LEU HD11 H 4.261 -3.492 -3.252 1.00 . A A . 15 LEU HD11 1 1
4 1223 1 1 15 LEU HD12 H 2.990 -2.755 -4.252 1.00 . A A . 15 LEU HD12 1 1
4 1224 1 1 15 LEU HD13 H 3.008 -2.494 -2.511 1.00 . A A . 15 LEU HD13 1 1
4 1225 1 1 15 LEU HD21 H 3.060 0.095 -2.792 1.00 . A A . 15 LEU HD21 1 1
4 1226 1 1 15 LEU HD22 H 4.264 0.843 -3.875 1.00 . A A . 15 LEU HD22 1 1
4 1227 1 1 15 LEU HD23 H 2.952 -0.148 -4.552 1.00 . A A . 15 LEU HD23 1 1
4 1228 1 1 15 LEU HG H 5.113 -1.360 -4.567 1.00 . A A . 15 LEU HG 1 1
4 1229 1 1 15 LEU N N 4.800 0.275 -0.536 1.00 . A A . 15 LEU N 1 1
4 1230 1 1 15 LEU O O 7.243 -2.235 -0.359 1.00 . A A . 15 LEU O 1 1
4 1231 1 1 16 ASN C C 8.272 -1.409 2.283 1.00 . A A . 16 ASN C 1 1
4 1232 1 1 16 ASN CA C 6.843 -2.055 2.466 1.00 . A A . 16 ASN CA 1 1
4 1233 1 1 16 ASN CB C 6.739 -3.587 2.592 1.00 . A A . 16 ASN CB 1 1
4 1234 1 1 16 ASN CG C 7.360 -4.209 3.857 1.00 . A A . 16 ASN CG 1 1
4 1235 1 1 16 ASN H H 5.026 -1.172 1.664 1.00 . A A . 16 ASN H 1 1
4 1236 1 1 16 ASN HA H 6.437 -1.684 3.410 1.00 . A A . 16 ASN HA 1 1
4 1237 1 1 16 ASN HB2 H 5.669 -3.871 2.517 1.00 . A A . 16 ASN HB2 1 1
4 1238 1 1 16 ASN HB3 H 7.219 -4.017 1.711 1.00 . A A . 16 ASN HB3 1 1
4 1239 1 1 16 ASN HD21 H 7.056 -4.678 5.784 1.00 . A A . 16 ASN HD21 1 1
4 1240 1 1 16 ASN HD22 H 5.673 -3.870 4.888 1.00 . A A . 16 ASN HD22 1 1
4 1241 1 1 16 ASN N N 5.936 -1.568 1.383 1.00 . A A . 16 ASN N 1 1
4 1242 1 1 16 ASN ND2 N 6.621 -4.257 4.955 1.00 . A A . 16 ASN ND2 1 1
4 1243 1 1 16 ASN O O 9.290 -2.097 2.401 1.00 . A A . 16 ASN O 1 1
4 1244 1 1 16 ASN OD1 O 8.508 -4.654 3.854 1.00 . A A . 16 ASN OD1 1 1
4 1245 1 1 17 GLU C C 10.339 0.155 0.482 1.00 . A A . 17 GLU C 1 1
4 1246 1 1 17 GLU CA C 9.575 0.696 1.745 1.00 . A A . 17 GLU CA 1 1
4 1247 1 1 17 GLU CB C 10.420 0.896 3.023 1.00 . A A . 17 GLU CB 1 1
4 1248 1 1 17 GLU CD C 10.479 1.686 5.459 1.00 . A A . 17 GLU CD 1 1
4 1249 1 1 17 GLU CG C 9.698 1.677 4.144 1.00 . A A . 17 GLU CG 1 1
4 1250 1 1 17 GLU H H 7.414 0.410 1.871 1.00 . A A . 17 GLU H 1 1
4 1251 1 1 17 GLU HA H 9.268 1.712 1.486 1.00 . A A . 17 GLU HA 1 1
4 1252 1 1 17 GLU HB2 H 10.714 -0.096 3.372 1.00 . A A . 17 GLU HB2 1 1
4 1253 1 1 17 GLU HB3 H 11.363 1.418 2.774 1.00 . A A . 17 GLU HB3 1 1
4 1254 1 1 17 GLU HE2 H 10.691 0.600 7.061 1.00 . A A . 17 GLU HE2 1 1
4 1255 1 1 17 GLU HG2 H 9.524 2.720 3.819 1.00 . A A . 17 GLU HG2 1 1
4 1256 1 1 17 GLU HG3 H 8.687 1.252 4.307 1.00 . A A . 17 GLU HG3 1 1
4 1257 1 1 17 GLU N N 8.323 -0.076 1.978 1.00 . A A . 17 GLU N 1 1
4 1258 1 1 17 GLU O O 11.549 -0.081 0.543 1.00 . A A . 17 GLU O 1 1
4 1259 1 1 17 GLU OE1 O 11.266 2.578 5.774 1.00 . A A . 17 GLU OE1 1 1
4 1260 1 1 17 GLU OE2 O 10.199 0.591 6.237 1.00 . A A . 17 GLU OE2 1 1
4 1261 1 1 18 HIS C C 10.810 -1.969 -1.806 1.00 . A A . 18 HIS C 1 1
4 1262 1 1 18 HIS CA C 10.176 -0.550 -1.947 1.00 . A A . 18 HIS CA 1 1
4 1263 1 1 18 HIS CB C 11.041 0.545 -2.607 1.00 . A A . 18 HIS CB 1 1
4 1264 1 1 18 HIS CD2 C 11.996 1.284 -4.863 1.00 . A A . 18 HIS CD2 1 1
4 1265 1 1 18 HIS CE1 C 11.248 -0.234 -6.108 1.00 . A A . 18 HIS CE1 1 1
4 1266 1 1 18 HIS CG C 11.258 0.374 -4.102 1.00 . A A . 18 HIS CG 1 1
4 1267 1 1 18 HIS H H 8.617 0.192 -0.633 1.00 . A A . 18 HIS H 1 1
4 1268 1 1 18 HIS HA H 9.304 -0.653 -2.623 1.00 . A A . 18 HIS HA 1 1
4 1269 1 1 18 HIS HB2 H 10.527 1.514 -2.454 1.00 . A A . 18 HIS HB2 1 1
4 1270 1 1 18 HIS HB3 H 12.019 0.647 -2.100 1.00 . A A . 18 HIS HB3 1 1
4 1271 1 1 18 HIS HD2 H 12.461 2.167 -4.450 1.00 . A A . 18 HIS HD2 1 1
4 1272 1 1 18 HIS HE1 H 11.041 -0.808 -7.000 1.00 . A A . 18 HIS HE1 1 1
4 1273 1 1 18 HIS HE2 H 12.444 1.351 -7.004 1.00 . A A . 18 HIS HE2 1 1
4 1274 1 1 18 HIS N N 9.620 -0.042 -0.663 1.00 . A A . 18 HIS N 1 1
4 1275 1 1 18 HIS ND1 N 10.741 -0.642 -4.896 1.00 . A A . 18 HIS ND1 1 1
4 1276 1 1 18 HIS NE2 N 12.009 0.903 -6.190 1.00 . A A . 18 HIS NE2 1 1
4 1277 1 1 18 HIS O O 12.033 -2.122 -1.731 1.00 . A A . 18 HIS O 1 1
4 1278 1 1 19 ALA C C 9.316 -5.203 -2.498 1.00 . A A . 19 ALA C 1 1
4 1279 1 1 19 ALA CA C 10.305 -4.402 -1.612 1.00 . A A . 19 ALA CA 1 1
4 1280 1 1 19 ALA CB C 10.458 -4.738 -0.100 1.00 . A A . 19 ALA CB 1 1
4 1281 1 1 19 ALA H H 8.953 -2.764 -1.897 1.00 . A A . 19 ALA H 1 1
4 1282 1 1 19 ALA HA H 11.263 -4.597 -2.071 1.00 . A A . 19 ALA HA 1 1
4 1283 1 1 19 ALA HB1 H 11.241 -4.123 0.382 1.00 . A A . 19 ALA HB1 1 1
4 1284 1 1 19 ALA HB2 H 9.520 -4.576 0.464 1.00 . A A . 19 ALA HB2 1 1
4 1285 1 1 19 ALA HB3 H 10.750 -5.794 0.047 1.00 . A A . 19 ALA HB3 1 1
4 1286 1 1 19 ALA N N 9.933 -2.987 -1.747 1.00 . A A . 19 ALA N 1 1
4 1287 1 1 19 ALA O O 9.282 -5.046 -3.723 1.00 . A A . 19 ALA O 1 1
4 1288 1 1 20 HIS C C 6.221 -6.107 -2.803 1.00 . A A . 20 HIS C 1 1
4 1289 1 1 20 HIS CA C 7.513 -6.922 -2.498 1.00 . A A . 20 HIS CA 1 1
4 1290 1 1 20 HIS CB C 7.254 -8.148 -1.586 1.00 . A A . 20 HIS CB 1 1
4 1291 1 1 20 HIS CD2 C 6.184 -10.481 -1.597 1.00 . A A . 20 HIS CD2 1 1
4 1292 1 1 20 HIS CE1 C 5.691 -10.659 -3.631 1.00 . A A . 20 HIS CE1 1 1
4 1293 1 1 20 HIS CG C 6.546 -9.309 -2.272 1.00 . A A . 20 HIS CG 1 1
4 1294 1 1 20 HIS H H 8.937 -6.197 -0.931 1.00 . A A . 20 HIS H 1 1
4 1295 1 1 20 HIS HA H 7.966 -7.317 -3.422 1.00 . A A . 20 HIS HA 1 1
4 1296 1 1 20 HIS HB2 H 8.204 -8.558 -1.194 1.00 . A A . 20 HIS HB2 1 1
4 1297 1 1 20 HIS HB3 H 6.686 -7.851 -0.684 1.00 . A A . 20 HIS HB3 1 1
4 1298 1 1 20 HIS HD2 H 6.373 -10.650 -0.547 1.00 . A A . 20 HIS HD2 1 1
4 1299 1 1 20 HIS HE1 H 5.329 -11.084 -4.556 1.00 . A A . 20 HIS HE1 1 1
4 1300 1 1 20 HIS HE2 H 5.260 -12.332 -2.305 1.00 . A A . 20 HIS HE2 1 1
4 1301 1 1 20 HIS N N 8.527 -6.056 -1.852 1.00 . A A . 20 HIS N 1 1
4 1302 1 1 20 HIS ND1 N 6.243 -9.399 -3.625 1.00 . A A . 20 HIS ND1 1 1
4 1303 1 1 20 HIS NE2 N 5.610 -11.382 -2.470 1.00 . A A . 20 HIS NE2 1 1
4 1304 1 1 20 HIS O O 5.513 -5.644 -1.907 1.00 . A A . 20 HIS O 1 1
5 1305 1 1 1 SER C C -13.612 -3.322 0.934 1.00 . A A . 1 SER C 1 1
5 1306 1 1 1 SER CA C -13.409 -3.978 2.343 1.00 . A A . 1 SER CA 1 1
5 1307 1 1 1 SER CB C -14.415 -5.117 2.639 1.00 . A A . 1 SER CB 1 1
5 1308 1 1 1 SER H1 H -14.393 -2.591 3.734 1.00 . A A . 1 SER H1 1 1
5 1309 1 1 1 SER HA H -12.399 -4.428 2.316 1.00 . A A . 1 SER HA 1 1
5 1310 1 1 1 SER HB2 H -14.339 -5.445 3.695 1.00 . A A . 1 SER HB2 1 1
5 1311 1 1 1 SER HB3 H -15.459 -4.772 2.496 1.00 . A A . 1 SER HB3 1 1
5 1312 1 1 1 SER HG H -13.274 -6.523 1.992 1.00 . A A . 1 SER HG 1 1
5 1313 1 1 1 SER N N -13.505 -3.038 3.497 1.00 . A A . 1 SER N 1 1
5 1314 1 1 1 SER O O -14.110 -3.962 0.001 1.00 . A A . 1 SER O 1 1
5 1315 1 1 1 SER OG O -14.172 -6.241 1.803 1.00 . A A . 1 SER OG 1 1
5 1316 1 1 2 ASP C C -12.298 -0.077 -0.312 1.00 . A A . 2 ASP C 1 1
5 1317 1 1 2 ASP CA C -13.260 -1.290 -0.485 1.00 . A A . 2 ASP CA 1 1
5 1318 1 1 2 ASP CB C -14.724 -0.881 -0.849 1.00 . A A . 2 ASP CB 1 1
5 1319 1 1 2 ASP CG C -14.879 -0.447 -2.313 1.00 . A A . 2 ASP CG 1 1
5 1320 1 1 2 ASP H H -12.696 -1.690 1.592 1.00 . A A . 2 ASP H 1 1
5 1321 1 1 2 ASP HA H -12.836 -1.946 -1.274 1.00 . A A . 2 ASP HA 1 1
5 1322 1 1 2 ASP HB2 H -15.449 -1.694 -0.638 1.00 . A A . 2 ASP HB2 1 1
5 1323 1 1 2 ASP HB3 H -15.065 -0.059 -0.190 1.00 . A A . 2 ASP HB3 1 1
5 1324 1 1 2 ASP HD2 H -15.015 -2.353 -2.685 1.00 . A A . 2 ASP HD2 1 1
5 1325 1 1 2 ASP N N -13.194 -2.052 0.780 1.00 . A A . 2 ASP N 1 1
5 1326 1 1 2 ASP O O -12.717 1.057 -0.059 1.00 . A A . 2 ASP O 1 1
5 1327 1 1 2 ASP OD1 O -14.863 0.729 -2.676 1.00 . A A . 2 ASP OD1 1 1
5 1328 1 1 2 ASP OD2 O -15.030 -1.517 -3.157 1.00 . A A . 2 ASP OD2 1 1
5 1329 1 1 3 THR C C -9.372 1.005 -1.812 1.00 . A A . 3 THR C 1 1
5 1330 1 1 3 THR CA C -9.904 0.636 -0.392 1.00 . A A . 3 THR CA 1 1
5 1331 1 1 3 THR CB C -8.963 -0.122 0.580 1.00 . A A . 3 THR CB 1 1
5 1332 1 1 3 THR CG2 C -7.727 0.649 0.936 1.00 . A A . 3 THR CG2 1 1
5 1333 1 1 3 THR H H -10.593 -1.235 -0.303 1.00 . A A . 3 THR H 1 1
5 1334 1 1 3 THR HA H -10.206 1.554 0.107 1.00 . A A . 3 THR HA 1 1
5 1335 1 1 3 THR HB H -8.645 -1.045 0.088 1.00 . A A . 3 THR HB 1 1
5 1336 1 1 3 THR HG1 H -10.352 -0.981 1.613 1.00 . A A . 3 THR HG1 1 1
5 1337 1 1 3 THR HG21 H -8.037 1.589 1.423 1.00 . A A . 3 THR HG21 1 1
5 1338 1 1 3 THR HG22 H -7.098 0.060 1.614 1.00 . A A . 3 THR HG22 1 1
5 1339 1 1 3 THR HG23 H -7.150 0.866 0.023 1.00 . A A . 3 THR HG23 1 1
5 1340 1 1 3 THR N N -10.991 -0.334 -0.502 1.00 . A A . 3 THR N 1 1
5 1341 1 1 3 THR O O -8.185 0.932 -2.135 1.00 . A A . 3 THR O 1 1
5 1342 1 1 3 THR OG1 O -9.586 -0.445 1.830 1.00 . A A . 3 THR OG1 1 1
5 1343 1 1 4 ARG C C -9.474 3.303 -4.075 1.00 . A A . 4 ARG C 1 1
5 1344 1 1 4 ARG CA C -10.096 1.890 -4.034 1.00 . A A . 4 ARG CA 1 1
5 1345 1 1 4 ARG CB C -11.396 1.839 -4.889 1.00 . A A . 4 ARG CB 1 1
5 1346 1 1 4 ARG CD C -11.277 -0.689 -5.644 1.00 . A A . 4 ARG CD 1 1
5 1347 1 1 4 ARG CG C -12.099 0.464 -5.031 1.00 . A A . 4 ARG CG 1 1
5 1348 1 1 4 ARG CZ C -9.748 -0.209 -7.593 1.00 . A A . 4 ARG CZ 1 1
5 1349 1 1 4 ARG H H -11.221 1.059 -2.292 1.00 . A A . 4 ARG H 1 1
5 1350 1 1 4 ARG HA H -9.323 1.216 -4.443 1.00 . A A . 4 ARG HA 1 1
5 1351 1 1 4 ARG HB2 H -12.138 2.556 -4.480 1.00 . A A . 4 ARG HB2 1 1
5 1352 1 1 4 ARG HB3 H -11.189 2.227 -5.906 1.00 . A A . 4 ARG HB3 1 1
5 1353 1 1 4 ARG HD2 H -10.373 -0.886 -5.037 1.00 . A A . 4 ARG HD2 1 1
5 1354 1 1 4 ARG HD3 H -11.869 -1.619 -5.559 1.00 . A A . 4 ARG HD3 1 1
5 1355 1 1 4 ARG HG2 H -12.448 0.143 -4.032 1.00 . A A . 4 ARG HG2 1 1
5 1356 1 1 4 ARG HG3 H -13.030 0.599 -5.614 1.00 . A A . 4 ARG HG3 1 1
5 1357 1 1 4 ARG HH11 H -7.780 0.143 -7.369 1.00 . A A . 4 ARG HH11 1 1
5 1358 1 1 4 ARG HH12 H -8.749 -0.190 -5.847 1.00 . A A . 4 ARG HH12 1 1
5 1359 1 1 4 ARG HH21 H -10.505 -0.170 -9.446 1.00 . A A . 4 ARG HH21 1 1
5 1360 1 1 4 ARG HH22 H -8.708 0.153 -9.265 1.00 . A A . 4 ARG HH22 1 1
5 1361 1 1 4 ARG N N -10.332 1.431 -2.642 1.00 . A A . 4 ARG N 1 1
5 1362 1 1 4 ARG NE N -10.966 -0.489 -7.085 1.00 . A A . 4 ARG NE 1 1
5 1363 1 1 4 ARG NH1 N -8.645 -0.071 -6.861 1.00 . A A . 4 ARG NH1 1 1
5 1364 1 1 4 ARG NH2 N -9.643 -0.060 -8.901 1.00 . A A . 4 ARG NH2 1 1
5 1365 1 1 4 ARG O O -8.524 3.519 -4.835 1.00 . A A . 4 ARG O 1 1
5 1366 1 1 5 TYR C C -8.350 5.740 -2.077 1.00 . A A . 5 TYR C 1 1
5 1367 1 1 5 TYR CA C -9.477 5.631 -3.179 1.00 . A A . 5 TYR CA 1 1
5 1368 1 1 5 TYR CB C -10.678 6.609 -3.009 1.00 . A A . 5 TYR CB 1 1
5 1369 1 1 5 TYR CD1 C -10.313 9.011 -2.221 1.00 . A A . 5 TYR CD1 1 1
5 1370 1 1 5 TYR CD2 C -10.168 8.549 -4.587 1.00 . A A . 5 TYR CD2 1 1
5 1371 1 1 5 TYR CE1 C -10.046 10.355 -2.468 1.00 . A A . 5 TYR CE1 1 1
5 1372 1 1 5 TYR CE2 C -9.902 9.894 -4.832 1.00 . A A . 5 TYR CE2 1 1
5 1373 1 1 5 TYR CG C -10.370 8.094 -3.277 1.00 . A A . 5 TYR CG 1 1
5 1374 1 1 5 TYR CZ C -9.840 10.797 -3.773 1.00 . A A . 5 TYR CZ 1 1
5 1375 1 1 5 TYR H H -10.657 3.873 -2.579 1.00 . A A . 5 TYR H 1 1
5 1376 1 1 5 TYR HA H -9.004 5.840 -4.139 1.00 . A A . 5 TYR HA 1 1
5 1377 1 1 5 TYR HB2 H -11.499 6.314 -3.692 1.00 . A A . 5 TYR HB2 1 1
5 1378 1 1 5 TYR HB3 H -11.113 6.478 -1.998 1.00 . A A . 5 TYR HB3 1 1
5 1379 1 1 5 TYR HD1 H -10.471 8.685 -1.202 1.00 . A A . 5 TYR HD1 1 1
5 1380 1 1 5 TYR HD2 H -10.215 7.860 -5.419 1.00 . A A . 5 TYR HD2 1 1
5 1381 1 1 5 TYR HE1 H -10.000 11.054 -1.644 1.00 . A A . 5 TYR HE1 1 1
5 1382 1 1 5 TYR HE2 H -9.745 10.233 -5.846 1.00 . A A . 5 TYR HE2 1 1
5 1383 1 1 5 TYR HH H -9.573 12.597 -3.182 1.00 . A A . 5 TYR HH 1 1
5 1384 1 1 5 TYR N N -10.021 4.251 -3.280 1.00 . A A . 5 TYR N 1 1
5 1385 1 1 5 TYR O O -8.216 6.748 -1.378 1.00 . A A . 5 TYR O 1 1
5 1386 1 1 5 TYR OH O -9.579 12.122 -4.016 1.00 . A A . 5 TYR OH 1 1
5 1387 1 1 6 ASN C C -5.226 3.671 -1.611 1.00 . A A . 6 ASN C 1 1
5 1388 1 1 6 ASN CA C -6.388 4.540 -1.040 1.00 . A A . 6 ASN CA 1 1
5 1389 1 1 6 ASN CB C -6.927 4.044 0.308 1.00 . A A . 6 ASN CB 1 1
5 1390 1 1 6 ASN CG C -6.063 4.249 1.567 1.00 . A A . 6 ASN CG 1 1
5 1391 1 1 6 ASN H H -7.896 3.844 -2.401 1.00 . A A . 6 ASN H 1 1
5 1392 1 1 6 ASN HA H -5.999 5.511 -0.843 1.00 . A A . 6 ASN HA 1 1
5 1393 1 1 6 ASN HB2 H -7.938 4.451 0.486 1.00 . A A . 6 ASN HB2 1 1
5 1394 1 1 6 ASN HB3 H -7.088 2.985 0.157 1.00 . A A . 6 ASN HB3 1 1
5 1395 1 1 6 ASN HD21 H -5.264 5.588 2.830 1.00 . A A . 6 ASN HD21 1 1
5 1396 1 1 6 ASN HD22 H -6.229 6.242 1.412 1.00 . A A . 6 ASN HD22 1 1
5 1397 1 1 6 ASN N N -7.511 4.687 -1.983 1.00 . A A . 6 ASN N 1 1
5 1398 1 1 6 ASN ND2 N -5.828 5.486 1.978 1.00 . A A . 6 ASN ND2 1 1
5 1399 1 1 6 ASN O O -4.063 3.986 -1.343 1.00 . A A . 6 ASN O 1 1
5 1400 1 1 6 ASN OD1 O -5.634 3.289 2.205 1.00 . A A . 6 ASN OD1 1 1
5 1401 1 1 7 LYS C C -3.866 0.798 -1.878 1.00 . A A . 7 LYS C 1 1
5 1402 1 1 7 LYS CA C -4.556 1.652 -2.987 1.00 . A A . 7 LYS CA 1 1
5 1403 1 1 7 LYS CB C -3.606 2.363 -3.994 1.00 . A A . 7 LYS CB 1 1
5 1404 1 1 7 LYS CD C -5.148 2.355 -6.142 1.00 . A A . 7 LYS CD 1 1
5 1405 1 1 7 LYS CE C -4.351 1.378 -7.028 1.00 . A A . 7 LYS CE 1 1
5 1406 1 1 7 LYS CG C -4.289 3.157 -5.140 1.00 . A A . 7 LYS CG 1 1
5 1407 1 1 7 LYS H H -6.529 2.381 -2.443 1.00 . A A . 7 LYS H 1 1
5 1408 1 1 7 LYS HA H -5.119 0.964 -3.637 1.00 . A A . 7 LYS HA 1 1
5 1409 1 1 7 LYS HB2 H -2.948 3.056 -3.440 1.00 . A A . 7 LYS HB2 1 1
5 1410 1 1 7 LYS HB3 H -2.929 1.611 -4.433 1.00 . A A . 7 LYS HB3 1 1
5 1411 1 1 7 LYS HD2 H -5.949 1.817 -5.600 1.00 . A A . 7 LYS HD2 1 1
5 1412 1 1 7 LYS HD3 H -5.680 3.081 -6.786 1.00 . A A . 7 LYS HD3 1 1
5 1413 1 1 7 LYS HE2 H -3.548 1.914 -7.568 1.00 . A A . 7 LYS HE2 1 1
5 1414 1 1 7 LYS HE3 H -3.850 0.611 -6.409 1.00 . A A . 7 LYS HE3 1 1
5 1415 1 1 7 LYS HG2 H -4.930 3.939 -4.689 1.00 . A A . 7 LYS HG2 1 1
5 1416 1 1 7 LYS HG3 H -3.515 3.717 -5.691 1.00 . A A . 7 LYS HG3 1 1
5 1417 1 1 7 LYS HZ2 H -5.691 1.399 -8.598 1.00 . A A . 7 LYS HZ2 1 1
5 1418 1 1 7 LYS HZ3 H -5.969 0.197 -7.525 1.00 . A A . 7 LYS HZ3 1 1
5 1419 1 1 7 LYS N N -5.534 2.586 -2.367 1.00 . A A . 7 LYS N 1 1
5 1420 1 1 7 LYS NZ N -5.220 0.704 -8.009 1.00 . A A . 7 LYS NZ 1 1
5 1421 1 1 7 LYS O O -2.635 0.809 -1.792 1.00 . A A . 7 LYS O 1 1
5 1422 1 1 8 SER C C -3.053 -0.043 0.985 1.00 . A A . 8 SER C 1 1
5 1423 1 1 8 SER CA C -4.112 -0.782 0.084 1.00 . A A . 8 SER CA 1 1
5 1424 1 1 8 SER CB C -3.743 -2.143 -0.534 1.00 . A A . 8 SER CB 1 1
5 1425 1 1 8 SER H H -5.590 -0.159 -1.363 1.00 . A A . 8 SER H 1 1
5 1426 1 1 8 SER HA H -4.949 -1.057 0.737 1.00 . A A . 8 SER HA 1 1
5 1427 1 1 8 SER HB2 H -4.661 -2.685 -0.842 1.00 . A A . 8 SER HB2 1 1
5 1428 1 1 8 SER HB3 H -3.189 -1.946 -1.456 1.00 . A A . 8 SER HB3 1 1
5 1429 1 1 8 SER HG H -3.562 -3.127 1.110 1.00 . A A . 8 SER HG 1 1
5 1430 1 1 8 SER N N -4.648 0.064 -1.025 1.00 . A A . 8 SER N 1 1
5 1431 1 1 8 SER O O -1.954 -0.558 1.206 1.00 . A A . 8 SER O 1 1
5 1432 1 1 8 SER OG O -3.000 -2.981 0.345 1.00 . A A . 8 SER OG 1 1
5 1433 1 1 9 PHE C C -1.140 2.397 1.671 1.00 . A A . 9 PHE C 1 1
5 1434 1 1 9 PHE CA C -2.500 2.015 2.350 1.00 . A A . 9 PHE CA 1 1
5 1435 1 1 9 PHE CB C -2.465 1.412 3.777 1.00 . A A . 9 PHE CB 1 1
5 1436 1 1 9 PHE CD1 C -1.131 1.735 5.911 1.00 . A A . 9 PHE CD1 1 1
5 1437 1 1 9 PHE CD2 C -2.499 3.580 5.166 1.00 . A A . 9 PHE CD2 1 1
5 1438 1 1 9 PHE CE1 C -0.767 2.464 7.041 1.00 . A A . 9 PHE CE1 1 1
5 1439 1 1 9 PHE CE2 C -2.124 4.311 6.291 1.00 . A A . 9 PHE CE2 1 1
5 1440 1 1 9 PHE CG C -1.995 2.288 4.958 1.00 . A A . 9 PHE CG 1 1
5 1441 1 1 9 PHE CZ C -1.260 3.752 7.228 1.00 . A A . 9 PHE CZ 1 1
5 1442 1 1 9 PHE H H -4.335 1.522 1.324 1.00 . A A . 9 PHE H 1 1
5 1443 1 1 9 PHE HA H -3.027 2.959 2.492 1.00 . A A . 9 PHE HA 1 1
5 1444 1 1 9 PHE HB2 H -3.484 1.056 4.029 1.00 . A A . 9 PHE HB2 1 1
5 1445 1 1 9 PHE HB3 H -1.856 0.506 3.702 1.00 . A A . 9 PHE HB3 1 1
5 1446 1 1 9 PHE HD1 H -0.745 0.733 5.791 1.00 . A A . 9 PHE HD1 1 1
5 1447 1 1 9 PHE HD2 H -3.196 4.022 4.469 1.00 . A A . 9 PHE HD2 1 1
5 1448 1 1 9 PHE HE1 H -0.098 2.031 7.771 1.00 . A A . 9 PHE HE1 1 1
5 1449 1 1 9 PHE HE2 H -2.514 5.307 6.443 1.00 . A A . 9 PHE HE2 1 1
5 1450 1 1 9 PHE HZ H -0.973 4.318 8.102 1.00 . A A . 9 PHE HZ 1 1
5 1451 1 1 9 PHE N N -3.386 1.178 1.490 1.00 . A A . 9 PHE N 1 1
5 1452 1 1 9 PHE O O -0.085 2.290 2.300 1.00 . A A . 9 PHE O 1 1
5 1453 1 1 10 ILE C C 0.901 1.974 -0.642 1.00 . A A . 10 ILE C 1 1
5 1454 1 1 10 ILE CA C 0.025 3.263 -0.415 1.00 . A A . 10 ILE CA 1 1
5 1455 1 1 10 ILE CB C 0.748 4.554 0.118 1.00 . A A . 10 ILE CB 1 1
5 1456 1 1 10 ILE CD1 C 0.260 6.859 1.255 1.00 . A A . 10 ILE CD1 1 1
5 1457 1 1 10 ILE CG1 C -0.214 5.776 0.273 1.00 . A A . 10 ILE CG1 1 1
5 1458 1 1 10 ILE CG2 C 1.958 4.987 -0.757 1.00 . A A . 10 ILE CG2 1 1
5 1459 1 1 10 ILE H H -2.098 2.841 -0.071 1.00 . A A . 10 ILE H 1 1
5 1460 1 1 10 ILE HA H -0.330 3.621 -1.381 1.00 . A A . 10 ILE HA 1 1
5 1461 1 1 10 ILE HB H 1.132 4.282 1.106 1.00 . A A . 10 ILE HB 1 1
5 1462 1 1 10 ILE HD11 H 0.422 6.446 2.267 1.00 . A A . 10 ILE HD11 1 1
5 1463 1 1 10 ILE HD12 H -0.491 7.664 1.348 1.00 . A A . 10 ILE HD12 1 1
5 1464 1 1 10 ILE HD13 H 1.204 7.333 0.932 1.00 . A A . 10 ILE HD13 1 1
5 1465 1 1 10 ILE HG12 H -0.407 6.238 -0.717 1.00 . A A . 10 ILE HG12 1 1
5 1466 1 1 10 ILE HG13 H -1.203 5.428 0.627 1.00 . A A . 10 ILE HG13 1 1
5 1467 1 1 10 ILE HG21 H 1.650 5.235 -1.790 1.00 . A A . 10 ILE HG21 1 1
5 1468 1 1 10 ILE HG22 H 2.735 4.207 -0.833 1.00 . A A . 10 ILE HG22 1 1
5 1469 1 1 10 ILE HG23 H 2.471 5.876 -0.348 1.00 . A A . 10 ILE HG23 1 1
5 1470 1 1 10 ILE N N -1.178 2.860 0.386 1.00 . A A . 10 ILE N 1 1
5 1471 1 1 10 ILE O O 2.039 1.956 -0.169 1.00 . A A . 10 ILE O 1 1
5 1472 1 1 11 ASN C C 1.846 -0.929 -0.249 1.00 . A A . 11 ASN C 1 1
5 1473 1 1 11 ASN CA C 1.158 -0.383 -1.551 1.00 . A A . 11 ASN CA 1 1
5 1474 1 1 11 ASN CB C 1.982 -0.133 -2.839 1.00 . A A . 11 ASN CB 1 1
5 1475 1 1 11 ASN CG C 3.014 -1.178 -3.293 1.00 . A A . 11 ASN CG 1 1
5 1476 1 1 11 ASN H H -0.390 1.043 -1.942 1.00 . A A . 11 ASN H 1 1
5 1477 1 1 11 ASN HA H 0.466 -1.162 -1.880 1.00 . A A . 11 ASN HA 1 1
5 1478 1 1 11 ASN HB2 H 1.287 0.029 -3.687 1.00 . A A . 11 ASN HB2 1 1
5 1479 1 1 11 ASN HB3 H 2.468 0.838 -2.719 1.00 . A A . 11 ASN HB3 1 1
5 1480 1 1 11 ASN HD21 H 3.281 -3.031 -4.014 1.00 . A A . 11 ASN HD21 1 1
5 1481 1 1 11 ASN HD22 H 1.556 -2.500 -3.687 1.00 . A A . 11 ASN HD22 1 1
5 1482 1 1 11 ASN N N 0.393 0.883 -1.306 1.00 . A A . 11 ASN N 1 1
5 1483 1 1 11 ASN ND2 N 2.572 -2.357 -3.707 1.00 . A A . 11 ASN ND2 1 1
5 1484 1 1 11 ASN O O 3.045 -1.215 -0.261 1.00 . A A . 11 ASN O 1 1
5 1485 1 1 11 ASN OD1 O 4.216 -0.919 -3.297 1.00 . A A . 11 ASN OD1 1 1
5 1486 1 1 12 ASN C C 2.747 -0.636 2.721 1.00 . A A . 12 ASN C 1 1
5 1487 1 1 12 ASN CA C 1.586 -1.543 2.196 1.00 . A A . 12 ASN CA 1 1
5 1488 1 1 12 ASN CB C 1.820 -3.069 2.135 1.00 . A A . 12 ASN CB 1 1
5 1489 1 1 12 ASN CG C 2.017 -3.788 3.484 1.00 . A A . 12 ASN CG 1 1
5 1490 1 1 12 ASN H H 0.073 -0.898 0.777 1.00 . A A . 12 ASN H 1 1
5 1491 1 1 12 ASN HA H 0.780 -1.442 2.909 1.00 . A A . 12 ASN HA 1 1
5 1492 1 1 12 ASN HB2 H 0.974 -3.531 1.585 1.00 . A A . 12 ASN HB2 1 1
5 1493 1 1 12 ASN HB3 H 2.702 -3.241 1.512 1.00 . A A . 12 ASN HB3 1 1
5 1494 1 1 12 ASN HD21 H 1.093 -4.639 5.049 1.00 . A A . 12 ASN HD21 1 1
5 1495 1 1 12 ASN HD22 H 0.031 -3.939 3.726 1.00 . A A . 12 ASN HD22 1 1
5 1496 1 1 12 ASN N N 1.081 -1.059 0.876 1.00 . A A . 12 ASN N 1 1
5 1497 1 1 12 ASN ND2 N 0.937 -4.160 4.155 1.00 . A A . 12 ASN ND2 1 1
5 1498 1 1 12 ASN O O 3.770 -1.166 3.159 1.00 . A A . 12 ASN O 1 1
5 1499 1 1 12 ASN OD1 O 3.141 -4.019 3.929 1.00 . A A . 12 ASN OD1 1 1
5 1500 1 1 13 LYS C C 4.926 1.479 2.312 1.00 . A A . 13 LYS C 1 1
5 1501 1 1 13 LYS CA C 3.629 1.698 3.173 1.00 . A A . 13 LYS CA 1 1
5 1502 1 1 13 LYS CB C 3.856 1.687 4.713 1.00 . A A . 13 LYS CB 1 1
5 1503 1 1 13 LYS CD C 2.448 3.656 5.774 1.00 . A A . 13 LYS CD 1 1
5 1504 1 1 13 LYS CE C 1.624 4.335 4.661 1.00 . A A . 13 LYS CE 1 1
5 1505 1 1 13 LYS CG C 2.680 2.134 5.614 1.00 . A A . 13 LYS CG 1 1
5 1506 1 1 13 LYS H H 1.697 1.079 2.332 1.00 . A A . 13 LYS H 1 1
5 1507 1 1 13 LYS HA H 3.282 2.704 2.928 1.00 . A A . 13 LYS HA 1 1
5 1508 1 1 13 LYS HB2 H 4.154 0.666 5.016 1.00 . A A . 13 LYS HB2 1 1
5 1509 1 1 13 LYS HB3 H 4.732 2.315 4.958 1.00 . A A . 13 LYS HB3 1 1
5 1510 1 1 13 LYS HD2 H 1.920 3.801 6.736 1.00 . A A . 13 LYS HD2 1 1
5 1511 1 1 13 LYS HD3 H 3.417 4.174 5.906 1.00 . A A . 13 LYS HD3 1 1
5 1512 1 1 13 LYS HE2 H 2.180 4.356 3.709 1.00 . A A . 13 LYS HE2 1 1
5 1513 1 1 13 LYS HE3 H 0.695 3.770 4.467 1.00 . A A . 13 LYS HE3 1 1
5 1514 1 1 13 LYS HG2 H 1.746 1.625 5.314 1.00 . A A . 13 LYS HG2 1 1
5 1515 1 1 13 LYS HG3 H 2.889 1.737 6.625 1.00 . A A . 13 LYS HG3 1 1
5 1516 1 1 13 LYS HZ2 H 0.689 5.724 5.868 1.00 . A A . 13 LYS HZ2 1 1
5 1517 1 1 13 LYS HZ3 H 0.694 6.139 4.287 1.00 . A A . 13 LYS HZ3 1 1
5 1518 1 1 13 LYS N N 2.579 0.723 2.723 1.00 . A A . 13 LYS N 1 1
5 1519 1 1 13 LYS NZ N 1.272 5.719 5.023 1.00 . A A . 13 LYS NZ 1 1
5 1520 1 1 13 LYS O O 6.032 1.471 2.861 1.00 . A A . 13 LYS O 1 1
5 1521 1 1 14 HIS C C 6.657 -0.244 0.449 1.00 . A A . 14 HIS C 1 1
5 1522 1 1 14 HIS CA C 5.928 1.077 0.015 1.00 . A A . 14 HIS CA 1 1
5 1523 1 1 14 HIS CB C 6.778 2.358 -0.150 1.00 . A A . 14 HIS CB 1 1
5 1524 1 1 14 HIS CD2 C 8.450 3.464 -1.739 1.00 . A A . 14 HIS CD2 1 1
5 1525 1 1 14 HIS CE1 C 8.471 2.059 -3.301 1.00 . A A . 14 HIS CE1 1 1
5 1526 1 1 14 HIS CG C 7.607 2.396 -1.421 1.00 . A A . 14 HIS CG 1 1
5 1527 1 1 14 HIS H H 3.868 1.540 0.560 1.00 . A A . 14 HIS H 1 1
5 1528 1 1 14 HIS HA H 5.498 0.872 -0.966 1.00 . A A . 14 HIS HA 1 1
5 1529 1 1 14 HIS HB2 H 6.103 3.235 -0.173 1.00 . A A . 14 HIS HB2 1 1
5 1530 1 1 14 HIS HB3 H 7.432 2.515 0.728 1.00 . A A . 14 HIS HB3 1 1
5 1531 1 1 14 HIS HD2 H 8.574 4.332 -1.110 1.00 . A A . 14 HIS HD2 1 1
5 1532 1 1 14 HIS HE1 H 8.712 1.590 -4.243 1.00 . A A . 14 HIS HE1 1 1
5 1533 1 1 14 HIS HE2 H 9.687 3.855 -3.501 1.00 . A A . 14 HIS HE2 1 1
5 1534 1 1 14 HIS N N 4.794 1.327 0.954 1.00 . A A . 14 HIS N 1 1
5 1535 1 1 14 HIS ND1 N 7.587 1.451 -2.439 1.00 . A A . 14 HIS ND1 1 1
5 1536 1 1 14 HIS NE2 N 9.040 3.261 -2.971 1.00 . A A . 14 HIS NE2 1 1
5 1537 1 1 14 HIS O O 7.890 -0.267 0.478 1.00 . A A . 14 HIS O 1 1
5 1538 1 1 15 LEU C C 7.258 -2.398 2.556 1.00 . A A . 15 LEU C 1 1
5 1539 1 1 15 LEU CA C 6.475 -2.655 1.214 1.00 . A A . 15 LEU CA 1 1
5 1540 1 1 15 LEU CB C 7.270 -3.431 0.116 1.00 . A A . 15 LEU CB 1 1
5 1541 1 1 15 LEU CD1 C 5.630 -5.388 -0.306 1.00 . A A . 15 LEU CD1 1 1
5 1542 1 1 15 LEU CD2 C 5.591 -3.376 -1.833 1.00 . A A . 15 LEU CD2 1 1
5 1543 1 1 15 LEU CG C 6.484 -4.251 -0.944 1.00 . A A . 15 LEU CG 1 1
5 1544 1 1 15 LEU H H 4.866 -1.256 0.687 1.00 . A A . 15 LEU H 1 1
5 1545 1 1 15 LEU HA H 5.640 -3.298 1.487 1.00 . A A . 15 LEU HA 1 1
5 1546 1 1 15 LEU HB2 H 7.955 -2.734 -0.400 1.00 . A A . 15 LEU HB2 1 1
5 1547 1 1 15 LEU HB3 H 7.950 -4.151 0.608 1.00 . A A . 15 LEU HB3 1 1
5 1548 1 1 15 LEU HD11 H 5.164 -6.049 -1.060 1.00 . A A . 15 LEU HD11 1 1
5 1549 1 1 15 LEU HD12 H 6.215 -6.037 0.372 1.00 . A A . 15 LEU HD12 1 1
5 1550 1 1 15 LEU HD13 H 4.788 -4.999 0.304 1.00 . A A . 15 LEU HD13 1 1
5 1551 1 1 15 LEU HD21 H 6.159 -2.536 -2.271 1.00 . A A . 15 LEU HD21 1 1
5 1552 1 1 15 LEU HD22 H 4.746 -2.943 -1.266 1.00 . A A . 15 LEU HD22 1 1
5 1553 1 1 15 LEU HD23 H 5.158 -3.955 -2.667 1.00 . A A . 15 LEU HD23 1 1
5 1554 1 1 15 LEU HG H 7.264 -4.675 -1.624 1.00 . A A . 15 LEU HG 1 1
5 1555 1 1 15 LEU N N 5.898 -1.352 0.751 1.00 . A A . 15 LEU N 1 1
5 1556 1 1 15 LEU O O 8.323 -2.984 2.764 1.00 . A A . 15 LEU O 1 1
5 1557 1 1 16 ASN C C 8.799 -0.585 4.489 1.00 . A A . 16 ASN C 1 1
5 1558 1 1 16 ASN CA C 7.381 -1.208 4.793 1.00 . A A . 16 ASN CA 1 1
5 1559 1 1 16 ASN CB C 7.291 -2.394 5.771 1.00 . A A . 16 ASN CB 1 1
5 1560 1 1 16 ASN CG C 7.676 -2.107 7.234 1.00 . A A . 16 ASN CG 1 1
5 1561 1 1 16 ASN H H 5.772 -1.196 3.322 1.00 . A A . 16 ASN H 1 1
5 1562 1 1 16 ASN HA H 6.774 -0.431 5.264 1.00 . A A . 16 ASN HA 1 1
5 1563 1 1 16 ASN HB2 H 6.260 -2.800 5.716 1.00 . A A . 16 ASN HB2 1 1
5 1564 1 1 16 ASN HB3 H 7.939 -3.184 5.384 1.00 . A A . 16 ASN HB3 1 1
5 1565 1 1 16 ASN HD21 H 7.026 -1.431 9.007 1.00 . A A . 16 ASN HD21 1 1
5 1566 1 1 16 ASN HD22 H 5.822 -1.448 7.623 1.00 . A A . 16 ASN HD22 1 1
5 1567 1 1 16 ASN N N 6.719 -1.558 3.501 1.00 . A A . 16 ASN N 1 1
5 1568 1 1 16 ASN ND2 N 6.746 -1.611 8.036 1.00 . A A . 16 ASN ND2 1 1
5 1569 1 1 16 ASN O O 9.783 -0.919 5.155 1.00 . A A . 16 ASN O 1 1
5 1570 1 1 16 ASN OD1 O 8.811 -2.334 7.653 1.00 . A A . 16 ASN OD1 1 1
5 1571 1 1 17 GLU C C 11.185 -0.037 2.452 1.00 . A A . 17 GLU C 1 1
5 1572 1 1 17 GLU CA C 10.146 0.995 3.035 1.00 . A A . 17 GLU CA 1 1
5 1573 1 1 17 GLU CB C 10.700 2.000 4.071 1.00 . A A . 17 GLU CB 1 1
5 1574 1 1 17 GLU CD C 10.243 4.027 5.569 1.00 . A A . 17 GLU CD 1 1
5 1575 1 1 17 GLU CG C 9.745 3.168 4.405 1.00 . A A . 17 GLU CG 1 1
5 1576 1 1 17 GLU H H 8.002 0.554 2.982 1.00 . A A . 17 GLU H 1 1
5 1577 1 1 17 GLU HA H 9.873 1.630 2.189 1.00 . A A . 17 GLU HA 1 1
5 1578 1 1 17 GLU HB2 H 10.944 1.431 4.971 1.00 . A A . 17 GLU HB2 1 1
5 1579 1 1 17 GLU HB3 H 11.660 2.419 3.714 1.00 . A A . 17 GLU HB3 1 1
5 1580 1 1 17 GLU HE2 H 11.225 5.008 4.204 1.00 . A A . 17 GLU HE2 1 1
5 1581 1 1 17 GLU HG2 H 9.596 3.801 3.511 1.00 . A A . 17 GLU HG2 1 1
5 1582 1 1 17 GLU HG3 H 8.741 2.768 4.649 1.00 . A A . 17 GLU HG3 1 1
5 1583 1 1 17 GLU N N 8.885 0.329 3.474 1.00 . A A . 17 GLU N 1 1
5 1584 1 1 17 GLU O O 12.386 0.068 2.720 1.00 . A A . 17 GLU O 1 1
5 1585 1 1 17 GLU OE1 O 9.915 3.837 6.740 1.00 . A A . 17 GLU OE1 1 1
5 1586 1 1 17 GLU OE2 O 11.091 5.022 5.154 1.00 . A A . 17 GLU OE2 1 1
5 1587 1 1 18 HIS C C 11.439 -1.875 -0.530 1.00 . A A . 18 HIS C 1 1
5 1588 1 1 18 HIS CA C 11.549 -2.061 1.006 1.00 . A A . 18 HIS CA 1 1
5 1589 1 1 18 HIS CB C 11.255 -3.477 1.619 1.00 . A A . 18 HIS CB 1 1
5 1590 1 1 18 HIS CD2 C 10.972 -4.906 3.722 1.00 . A A . 18 HIS CD2 1 1
5 1591 1 1 18 HIS CE1 C 11.797 -3.656 5.193 1.00 . A A . 18 HIS CE1 1 1
5 1592 1 1 18 HIS CG C 11.431 -3.726 3.123 1.00 . A A . 18 HIS CG 1 1
5 1593 1 1 18 HIS H H 9.702 -1.106 1.555 1.00 . A A . 18 HIS H 1 1
5 1594 1 1 18 HIS HA H 12.582 -1.888 1.202 1.00 . A A . 18 HIS HA 1 1
5 1595 1 1 18 HIS HB2 H 10.225 -3.767 1.343 1.00 . A A . 18 HIS HB2 1 1
5 1596 1 1 18 HIS HB3 H 11.883 -4.232 1.113 1.00 . A A . 18 HIS HB3 1 1
5 1597 1 1 18 HIS HD2 H 10.523 -5.718 3.171 1.00 . A A . 18 HIS HD2 1 1
5 1598 1 1 18 HIS HE1 H 12.118 -3.298 6.160 1.00 . A A . 18 HIS HE1 1 1
5 1599 1 1 18 HIS HE2 H 10.976 -5.577 5.804 1.00 . A A . 18 HIS HE2 1 1
5 1600 1 1 18 HIS N N 10.715 -1.016 1.631 1.00 . A A . 18 HIS N 1 1
5 1601 1 1 18 HIS ND1 N 12.013 -2.890 4.073 1.00 . A A . 18 HIS ND1 1 1
5 1602 1 1 18 HIS NE2 N 11.191 -4.878 5.084 1.00 . A A . 18 HIS NE2 1 1
5 1603 1 1 18 HIS O O 12.051 -0.974 -1.111 1.00 . A A . 18 HIS O 1 1
5 1604 1 1 19 ALA C C 11.578 -3.090 -3.484 1.00 . A A . 19 ALA C 1 1
5 1605 1 1 19 ALA CA C 10.332 -2.802 -2.596 1.00 . A A . 19 ALA CA 1 1
5 1606 1 1 19 ALA CB C 9.532 -1.568 -3.069 1.00 . A A . 19 ALA CB 1 1
5 1607 1 1 19 ALA H H 10.342 -3.403 -0.409 1.00 . A A . 19 ALA H 1 1
5 1608 1 1 19 ALA HA H 9.628 -3.649 -2.711 1.00 . A A . 19 ALA HA 1 1
5 1609 1 1 19 ALA HB1 H 9.213 -1.671 -4.122 1.00 . A A . 19 ALA HB1 1 1
5 1610 1 1 19 ALA HB2 H 10.120 -0.633 -2.998 1.00 . A A . 19 ALA HB2 1 1
5 1611 1 1 19 ALA HB3 H 8.613 -1.423 -2.471 1.00 . A A . 19 ALA HB3 1 1
5 1612 1 1 19 ALA N N 10.644 -2.751 -1.140 1.00 . A A . 19 ALA N 1 1
5 1613 1 1 19 ALA O O 12.329 -2.173 -3.837 1.00 . A A . 19 ALA O 1 1
5 1614 1 1 20 HIS C C 12.626 -4.543 -6.194 1.00 . A A . 20 HIS C 1 1
5 1615 1 1 20 HIS CA C 12.912 -4.820 -4.689 1.00 . A A . 20 HIS CA 1 1
5 1616 1 1 20 HIS CB C 13.189 -6.317 -4.396 1.00 . A A . 20 HIS CB 1 1
5 1617 1 1 20 HIS CD2 C 14.961 -8.143 -4.725 1.00 . A A . 20 HIS CD2 1 1
5 1618 1 1 20 HIS CE1 C 16.528 -7.005 -5.540 1.00 . A A . 20 HIS CE1 1 1
5 1619 1 1 20 HIS CG C 14.553 -6.811 -4.859 1.00 . A A . 20 HIS CG 1 1
5 1620 1 1 20 HIS H H 11.175 -5.055 -3.386 1.00 . A A . 20 HIS H 1 1
5 1621 1 1 20 HIS HA H 13.805 -4.274 -4.345 1.00 . A A . 20 HIS HA 1 1
5 1622 1 1 20 HIS HB2 H 13.143 -6.523 -3.309 1.00 . A A . 20 HIS HB2 1 1
5 1623 1 1 20 HIS HB3 H 12.397 -6.955 -4.834 1.00 . A A . 20 HIS HB3 1 1
5 1624 1 1 20 HIS HD2 H 14.347 -8.917 -4.290 1.00 . A A . 20 HIS HD2 1 1
5 1625 1 1 20 HIS HE1 H 17.499 -6.751 -5.940 1.00 . A A . 20 HIS HE1 1 1
5 1626 1 1 20 HIS HE2 H 16.856 -9.130 -5.196 1.00 . A A . 20 HIS HE2 1 1
5 1627 1 1 20 HIS N N 11.776 -4.373 -3.848 1.00 . A A . 20 HIS N 1 1
5 1628 1 1 20 HIS ND1 N 15.572 -6.027 -5.386 1.00 . A A . 20 HIS ND1 1 1
5 1629 1 1 20 HIS NE2 N 16.257 -8.297 -5.175 1.00 . A A . 20 HIS NE2 1 1
5 1630 1 1 20 HIS O O 11.721 -5.116 -6.804 1.00 . A A . 20 HIS O 1 1
6 1631 1 1 1 SER C C -11.221 -3.929 1.156 1.00 . A A . 1 SER C 1 1
6 1632 1 1 1 SER CA C -11.593 -3.372 2.573 1.00 . A A . 1 SER CA 1 1
6 1633 1 1 1 SER CB C -11.989 -4.475 3.582 1.00 . A A . 1 SER CB 1 1
6 1634 1 1 1 SER H1 H -13.658 -2.688 2.330 1.00 . A A . 1 SER H1 1 1
6 1635 1 1 1 SER HA H -10.671 -2.903 2.959 1.00 . A A . 1 SER HA 1 1
6 1636 1 1 1 SER HB2 H -12.398 -4.032 4.512 1.00 . A A . 1 SER HB2 1 1
6 1637 1 1 1 SER HB3 H -12.787 -5.125 3.170 1.00 . A A . 1 SER HB3 1 1
6 1638 1 1 1 SER HG H -11.181 -5.926 4.553 1.00 . A A . 1 SER HG 1 1
6 1639 1 1 1 SER N N -12.715 -2.387 2.582 1.00 . A A . 1 SER N 1 1
6 1640 1 1 1 SER O O -10.823 -5.090 1.015 1.00 . A A . 1 SER O 1 1
6 1641 1 1 1 SER OG O -10.862 -5.273 3.925 1.00 . A A . 1 SER OG 1 1
6 1642 1 1 2 ASP C C -10.588 -2.120 -2.049 1.00 . A A . 2 ASP C 1 1
6 1643 1 1 2 ASP CA C -10.969 -3.429 -1.282 1.00 . A A . 2 ASP CA 1 1
6 1644 1 1 2 ASP CB C -12.115 -4.258 -1.953 1.00 . A A . 2 ASP CB 1 1
6 1645 1 1 2 ASP CG C -11.675 -4.994 -3.224 1.00 . A A . 2 ASP CG 1 1
6 1646 1 1 2 ASP H H -11.598 -2.139 0.386 1.00 . A A . 2 ASP H 1 1
6 1647 1 1 2 ASP HA H -10.042 -4.029 -1.227 1.00 . A A . 2 ASP HA 1 1
6 1648 1 1 2 ASP HB2 H -12.563 -5.005 -1.261 1.00 . A A . 2 ASP HB2 1 1
6 1649 1 1 2 ASP HB3 H -12.963 -3.591 -2.200 1.00 . A A . 2 ASP HB3 1 1
6 1650 1 1 2 ASP HD2 H -10.779 -6.642 -3.743 1.00 . A A . 2 ASP HD2 1 1
6 1651 1 1 2 ASP N N -11.325 -3.083 0.114 1.00 . A A . 2 ASP N 1 1
6 1652 1 1 2 ASP O O -11.273 -1.690 -2.984 1.00 . A A . 2 ASP O 1 1
6 1653 1 1 2 ASP OD1 O -11.859 -4.556 -4.359 1.00 . A A . 2 ASP OD1 1 1
6 1654 1 1 2 ASP OD2 O -11.054 -6.185 -2.945 1.00 . A A . 2 ASP OD2 1 1
6 1655 1 1 3 THR C C -7.380 -0.345 -2.148 1.00 . A A . 3 THR C 1 1
6 1656 1 1 3 THR CA C -8.914 -0.264 -2.214 1.00 . A A . 3 THR CA 1 1
6 1657 1 1 3 THR CB C -9.641 0.968 -1.596 1.00 . A A . 3 THR CB 1 1
6 1658 1 1 3 THR CG2 C -9.182 1.491 -0.228 1.00 . A A . 3 THR CG2 1 1
6 1659 1 1 3 THR H H -9.050 -1.791 -0.775 1.00 . A A . 3 THR H 1 1
6 1660 1 1 3 THR HA H -9.093 -0.232 -3.271 1.00 . A A . 3 THR HA 1 1
6 1661 1 1 3 THR HB H -10.692 0.661 -1.461 1.00 . A A . 3 THR HB 1 1
6 1662 1 1 3 THR HG1 H -8.663 2.289 -2.595 1.00 . A A . 3 THR HG1 1 1
6 1663 1 1 3 THR HG21 H -9.844 2.290 0.142 1.00 . A A . 3 THR HG21 1 1
6 1664 1 1 3 THR HG22 H -9.139 0.688 0.523 1.00 . A A . 3 THR HG22 1 1
6 1665 1 1 3 THR HG23 H -8.178 1.935 -0.279 1.00 . A A . 3 THR HG23 1 1
6 1666 1 1 3 THR N N -9.462 -1.500 -1.643 1.00 . A A . 3 THR N 1 1
6 1667 1 1 3 THR O O -6.766 0.511 -1.541 1.00 . A A . 3 THR O 1 1
6 1668 1 1 3 THR OG1 O -9.590 2.055 -2.514 1.00 . A A . 3 THR OG1 1 1
6 1669 1 1 4 ARG C C -4.411 -0.214 -3.147 1.00 . A A . 4 ARG C 1 1
6 1670 1 1 4 ARG CA C -5.234 -1.481 -2.803 1.00 . A A . 4 ARG CA 1 1
6 1671 1 1 4 ARG CB C -4.783 -2.692 -3.677 1.00 . A A . 4 ARG CB 1 1
6 1672 1 1 4 ARG CD C -5.222 -4.646 -1.990 1.00 . A A . 4 ARG CD 1 1
6 1673 1 1 4 ARG CG C -5.436 -4.072 -3.405 1.00 . A A . 4 ARG CG 1 1
6 1674 1 1 4 ARG CZ C -5.993 -6.639 -0.681 1.00 . A A . 4 ARG CZ 1 1
6 1675 1 1 4 ARG H H -7.360 -1.999 -3.222 1.00 . A A . 4 ARG H 1 1
6 1676 1 1 4 ARG HA H -4.963 -1.629 -1.736 1.00 . A A . 4 ARG HA 1 1
6 1677 1 1 4 ARG HB2 H -4.955 -2.451 -4.747 1.00 . A A . 4 ARG HB2 1 1
6 1678 1 1 4 ARG HB3 H -3.684 -2.814 -3.611 1.00 . A A . 4 ARG HB3 1 1
6 1679 1 1 4 ARG HD2 H -4.142 -4.769 -1.789 1.00 . A A . 4 ARG HD2 1 1
6 1680 1 1 4 ARG HD3 H -5.613 -3.941 -1.233 1.00 . A A . 4 ARG HD3 1 1
6 1681 1 1 4 ARG HG2 H -6.519 -4.005 -3.621 1.00 . A A . 4 ARG HG2 1 1
6 1682 1 1 4 ARG HG3 H -5.042 -4.789 -4.150 1.00 . A A . 4 ARG HG3 1 1
6 1683 1 1 4 ARG HH11 H -6.685 -8.298 0.201 1.00 . A A . 4 ARG HH11 1 1
6 1684 1 1 4 ARG HH12 H -7.009 -8.103 -1.595 1.00 . A A . 4 ARG HH12 1 1
6 1685 1 1 4 ARG HH21 H -5.624 -6.826 1.289 1.00 . A A . 4 ARG HH21 1 1
6 1686 1 1 4 ARG HH22 H -4.999 -5.312 0.461 1.00 . A A . 4 ARG HH22 1 1
6 1687 1 1 4 ARG N N -6.727 -1.322 -2.809 1.00 . A A . 4 ARG N 1 1
6 1688 1 1 4 ARG NE N -5.900 -5.956 -1.839 1.00 . A A . 4 ARG NE 1 1
6 1689 1 1 4 ARG NH1 N -6.627 -7.797 -0.693 1.00 . A A . 4 ARG NH1 1 1
6 1690 1 1 4 ARG NH2 N -5.486 -6.215 0.476 1.00 . A A . 4 ARG NH2 1 1
6 1691 1 1 4 ARG O O -3.295 -0.068 -2.643 1.00 . A A . 4 ARG O 1 1
6 1692 1 1 5 TYR C C -4.742 3.152 -3.390 1.00 . A A . 5 TYR C 1 1
6 1693 1 1 5 TYR CA C -4.341 1.963 -4.359 1.00 . A A . 5 TYR CA 1 1
6 1694 1 1 5 TYR CB C -4.599 2.221 -5.875 1.00 . A A . 5 TYR CB 1 1
6 1695 1 1 5 TYR CD1 C -3.945 4.505 -6.816 1.00 . A A . 5 TYR CD1 1 1
6 1696 1 1 5 TYR CD2 C -2.344 2.701 -6.958 1.00 . A A . 5 TYR CD2 1 1
6 1697 1 1 5 TYR CE1 C -3.032 5.361 -7.429 1.00 . A A . 5 TYR CE1 1 1
6 1698 1 1 5 TYR CE2 C -1.434 3.558 -7.572 1.00 . A A . 5 TYR CE2 1 1
6 1699 1 1 5 TYR CG C -3.604 3.170 -6.566 1.00 . A A . 5 TYR CG 1 1
6 1700 1 1 5 TYR CZ C -1.777 4.888 -7.807 1.00 . A A . 5 TYR CZ 1 1
6 1701 1 1 5 TYR H H -5.904 0.381 -4.298 1.00 . A A . 5 TYR H 1 1
6 1702 1 1 5 TYR HA H -3.285 1.815 -4.188 1.00 . A A . 5 TYR HA 1 1
6 1703 1 1 5 TYR HB2 H -4.575 1.266 -6.438 1.00 . A A . 5 TYR HB2 1 1
6 1704 1 1 5 TYR HB3 H -5.639 2.577 -6.015 1.00 . A A . 5 TYR HB3 1 1
6 1705 1 1 5 TYR HD1 H -4.913 4.888 -6.526 1.00 . A A . 5 TYR HD1 1 1
6 1706 1 1 5 TYR HD2 H -2.060 1.674 -6.776 1.00 . A A . 5 TYR HD2 1 1
6 1707 1 1 5 TYR HE1 H -3.301 6.392 -7.609 1.00 . A A . 5 TYR HE1 1 1
6 1708 1 1 5 TYR HE2 H -0.460 3.189 -7.861 1.00 . A A . 5 TYR HE2 1 1
6 1709 1 1 5 TYR HH H -0.069 5.249 -8.589 1.00 . A A . 5 TYR HH 1 1
6 1710 1 1 5 TYR N N -4.973 0.670 -3.994 1.00 . A A . 5 TYR N 1 1
6 1711 1 1 5 TYR O O -4.607 4.330 -3.733 1.00 . A A . 5 TYR O 1 1
6 1712 1 1 5 TYR OH O -0.875 5.735 -8.400 1.00 . A A . 5 TYR OH 1 1
6 1713 1 1 6 ASN C C -5.762 3.070 0.360 1.00 . A A . 6 ASN C 1 1
6 1714 1 1 6 ASN CA C -5.605 3.720 -1.065 1.00 . A A . 6 ASN CA 1 1
6 1715 1 1 6 ASN CB C -6.891 4.429 -1.518 1.00 . A A . 6 ASN CB 1 1
6 1716 1 1 6 ASN CG C -7.290 5.733 -0.803 1.00 . A A . 6 ASN CG 1 1
6 1717 1 1 6 ASN H H -5.538 1.881 -2.179 1.00 . A A . 6 ASN H 1 1
6 1718 1 1 6 ASN HA H -4.854 4.476 -0.968 1.00 . A A . 6 ASN HA 1 1
6 1719 1 1 6 ASN HB2 H -6.834 4.602 -2.602 1.00 . A A . 6 ASN HB2 1 1
6 1720 1 1 6 ASN HB3 H -7.672 3.685 -1.409 1.00 . A A . 6 ASN HB3 1 1
6 1721 1 1 6 ASN HD21 H -6.963 7.709 -0.678 1.00 . A A . 6 ASN HD21 1 1
6 1722 1 1 6 ASN HD22 H -5.974 6.771 -1.907 1.00 . A A . 6 ASN HD22 1 1
6 1723 1 1 6 ASN N N -5.168 2.817 -2.151 1.00 . A A . 6 ASN N 1 1
6 1724 1 1 6 ASN ND2 N -6.680 6.852 -1.167 1.00 . A A . 6 ASN ND2 1 1
6 1725 1 1 6 ASN O O -6.026 3.838 1.290 1.00 . A A . 6 ASN O 1 1
6 1726 1 1 6 ASN OD1 O -8.151 5.743 0.076 1.00 . A A . 6 ASN OD1 1 1
6 1727 1 1 7 LYS C C -5.148 1.793 3.098 1.00 . A A . 7 LYS C 1 1
6 1728 1 1 7 LYS CA C -5.733 1.021 1.890 1.00 . A A . 7 LYS CA 1 1
6 1729 1 1 7 LYS CB C -5.126 -0.417 1.733 1.00 . A A . 7 LYS CB 1 1
6 1730 1 1 7 LYS CD C -7.403 -1.766 1.645 1.00 . A A . 7 LYS CD 1 1
6 1731 1 1 7 LYS CE C -7.498 -2.388 3.052 1.00 . A A . 7 LYS CE 1 1
6 1732 1 1 7 LYS CG C -5.987 -1.523 1.086 1.00 . A A . 7 LYS CG 1 1
6 1733 1 1 7 LYS H H -5.605 1.128 -0.254 1.00 . A A . 7 LYS H 1 1
6 1734 1 1 7 LYS HA H -6.804 0.955 2.077 1.00 . A A . 7 LYS HA 1 1
6 1735 1 1 7 LYS HB2 H -4.177 -0.345 1.154 1.00 . A A . 7 LYS HB2 1 1
6 1736 1 1 7 LYS HB3 H -4.790 -0.789 2.714 1.00 . A A . 7 LYS HB3 1 1
6 1737 1 1 7 LYS HD2 H -7.948 -0.807 1.641 1.00 . A A . 7 LYS HD2 1 1
6 1738 1 1 7 LYS HD3 H -7.955 -2.386 0.916 1.00 . A A . 7 LYS HD3 1 1
6 1739 1 1 7 LYS HE2 H -6.889 -1.814 3.775 1.00 . A A . 7 LYS HE2 1 1
6 1740 1 1 7 LYS HE3 H -8.539 -2.312 3.414 1.00 . A A . 7 LYS HE3 1 1
6 1741 1 1 7 LYS HG2 H -6.097 -1.278 0.027 1.00 . A A . 7 LYS HG2 1 1
6 1742 1 1 7 LYS HG3 H -5.419 -2.472 1.087 1.00 . A A . 7 LYS HG3 1 1
6 1743 1 1 7 LYS HZ2 H -7.712 -4.361 2.479 1.00 . A A . 7 LYS HZ2 1 1
6 1744 1 1 7 LYS HZ3 H -7.222 -4.187 4.029 1.00 . A A . 7 LYS HZ3 1 1
6 1745 1 1 7 LYS N N -5.603 1.729 0.576 1.00 . A A . 7 LYS N 1 1
6 1746 1 1 7 LYS NZ N -7.096 -3.807 3.084 1.00 . A A . 7 LYS NZ 1 1
6 1747 1 1 7 LYS O O -5.825 2.186 4.051 1.00 . A A . 7 LYS O 1 1
6 1748 1 1 8 SER C C -2.171 3.618 2.815 1.00 . A A . 8 SER C 1 1
6 1749 1 1 8 SER CA C -2.972 2.737 3.830 1.00 . A A . 8 SER CA 1 1
6 1750 1 1 8 SER CB C -2.195 1.707 4.646 1.00 . A A . 8 SER CB 1 1
6 1751 1 1 8 SER H H -3.551 1.458 2.111 1.00 . A A . 8 SER H 1 1
6 1752 1 1 8 SER HA H -3.556 3.303 4.536 1.00 . A A . 8 SER HA 1 1
6 1753 1 1 8 SER HB2 H -2.889 0.919 4.995 1.00 . A A . 8 SER HB2 1 1
6 1754 1 1 8 SER HB3 H -1.479 1.211 3.994 1.00 . A A . 8 SER HB3 1 1
6 1755 1 1 8 SER HG H -2.194 2.715 6.283 1.00 . A A . 8 SER HG 1 1
6 1756 1 1 8 SER N N -3.854 1.989 2.930 1.00 . A A . 8 SER N 1 1
6 1757 1 1 8 SER O O -0.943 3.513 2.766 1.00 . A A . 8 SER O 1 1
6 1758 1 1 8 SER OG O -1.514 2.313 5.737 1.00 . A A . 8 SER OG 1 1
6 1759 1 1 9 PHE C C -1.345 4.466 -0.012 1.00 . A A . 9 PHE C 1 1
6 1760 1 1 9 PHE CA C -2.172 5.369 0.985 1.00 . A A . 9 PHE CA 1 1
6 1761 1 1 9 PHE CB C -1.445 6.568 1.645 1.00 . A A . 9 PHE CB 1 1
6 1762 1 1 9 PHE CD1 C -2.911 7.961 3.213 1.00 . A A . 9 PHE CD1 1 1
6 1763 1 1 9 PHE CD2 C -2.493 8.797 0.985 1.00 . A A . 9 PHE CD2 1 1
6 1764 1 1 9 PHE CE1 C -3.690 9.083 3.486 1.00 . A A . 9 PHE CE1 1 1
6 1765 1 1 9 PHE CE2 C -3.274 9.917 1.261 1.00 . A A . 9 PHE CE2 1 1
6 1766 1 1 9 PHE CG C -2.312 7.804 1.956 1.00 . A A . 9 PHE CG 1 1
6 1767 1 1 9 PHE CZ C -3.873 10.059 2.509 1.00 . A A . 9 PHE CZ 1 1
6 1768 1 1 9 PHE H H -3.700 4.898 2.391 1.00 . A A . 9 PHE H 1 1
6 1769 1 1 9 PHE HA H -2.982 5.812 0.382 1.00 . A A . 9 PHE HA 1 1
6 1770 1 1 9 PHE HB2 H -1.033 6.181 2.580 1.00 . A A . 9 PHE HB2 1 1
6 1771 1 1 9 PHE HB3 H -0.571 6.881 1.043 1.00 . A A . 9 PHE HB3 1 1
6 1772 1 1 9 PHE HD1 H -2.769 7.222 3.989 1.00 . A A . 9 PHE HD1 1 1
6 1773 1 1 9 PHE HD2 H -2.023 8.712 0.016 1.00 . A A . 9 PHE HD2 1 1
6 1774 1 1 9 PHE HE1 H -4.150 9.198 4.457 1.00 . A A . 9 PHE HE1 1 1
6 1775 1 1 9 PHE HE2 H -3.410 10.679 0.507 1.00 . A A . 9 PHE HE2 1 1
6 1776 1 1 9 PHE HZ H -4.476 10.929 2.723 1.00 . A A . 9 PHE HZ 1 1
6 1777 1 1 9 PHE N N -2.835 4.513 2.008 1.00 . A A . 9 PHE N 1 1
6 1778 1 1 9 PHE O O -0.154 4.703 -0.225 1.00 . A A . 9 PHE O 1 1
6 1779 1 1 10 ILE C C -0.586 1.365 -0.720 1.00 . A A . 10 ILE C 1 1
6 1780 1 1 10 ILE CA C -1.394 2.431 -1.537 1.00 . A A . 10 ILE CA 1 1
6 1781 1 1 10 ILE CB C -0.639 3.038 -2.775 1.00 . A A . 10 ILE CB 1 1
6 1782 1 1 10 ILE CD1 C -0.566 5.226 -4.197 1.00 . A A . 10 ILE CD1 1 1
6 1783 1 1 10 ILE CG1 C -1.428 4.168 -3.493 1.00 . A A . 10 ILE CG1 1 1
6 1784 1 1 10 ILE CG2 C -0.206 1.970 -3.816 1.00 . A A . 10 ILE CG2 1 1
6 1785 1 1 10 ILE H H -2.987 3.277 -0.364 1.00 . A A . 10 ILE H 1 1
6 1786 1 1 10 ILE HA H -2.255 1.949 -1.996 1.00 . A A . 10 ILE HA 1 1
6 1787 1 1 10 ILE HB H 0.275 3.472 -2.361 1.00 . A A . 10 ILE HB 1 1
6 1788 1 1 10 ILE HD11 H 0.101 5.746 -3.485 1.00 . A A . 10 ILE HD11 1 1
6 1789 1 1 10 ILE HD12 H -1.199 5.995 -4.677 1.00 . A A . 10 ILE HD12 1 1
6 1790 1 1 10 ILE HD13 H 0.065 4.785 -4.989 1.00 . A A . 10 ILE HD13 1 1
6 1791 1 1 10 ILE HG12 H -2.118 3.716 -4.226 1.00 . A A . 10 ILE HG12 1 1
6 1792 1 1 10 ILE HG13 H -2.086 4.682 -2.762 1.00 . A A . 10 ILE HG13 1 1
6 1793 1 1 10 ILE HG21 H -1.073 1.435 -4.246 1.00 . A A . 10 ILE HG21 1 1
6 1794 1 1 10 ILE HG22 H 0.351 2.417 -4.660 1.00 . A A . 10 ILE HG22 1 1
6 1795 1 1 10 ILE HG23 H 0.460 1.204 -3.381 1.00 . A A . 10 ILE HG23 1 1
6 1796 1 1 10 ILE N N -1.991 3.403 -0.581 1.00 . A A . 10 ILE N 1 1
6 1797 1 1 10 ILE O O 0.642 1.386 -0.834 1.00 . A A . 10 ILE O 1 1
6 1798 1 1 11 ASN C C 0.821 -0.061 1.631 1.00 . A A . 11 ASN C 1 1
6 1799 1 1 11 ASN CA C -0.439 -0.603 0.865 1.00 . A A . 11 ASN CA 1 1
6 1800 1 1 11 ASN CB C -0.313 -1.794 -0.121 1.00 . A A . 11 ASN CB 1 1
6 1801 1 1 11 ASN CG C 0.550 -3.012 0.250 1.00 . A A . 11 ASN CG 1 1
6 1802 1 1 11 ASN H H -2.202 0.294 0.029 1.00 . A A . 11 ASN H 1 1
6 1803 1 1 11 ASN HA H -1.086 -1.043 1.626 1.00 . A A . 11 ASN HA 1 1
6 1804 1 1 11 ASN HB2 H -1.328 -2.177 -0.354 1.00 . A A . 11 ASN HB2 1 1
6 1805 1 1 11 ASN HB3 H 0.024 -1.374 -1.072 1.00 . A A . 11 ASN HB3 1 1
6 1806 1 1 11 ASN HD21 H 0.816 -4.524 1.542 1.00 . A A . 11 ASN HD21 1 1
6 1807 1 1 11 ASN HD22 H -0.579 -3.377 1.869 1.00 . A A . 11 ASN HD22 1 1
6 1808 1 1 11 ASN N N -1.195 0.453 0.109 1.00 . A A . 11 ASN N 1 1
6 1809 1 1 11 ASN ND2 N 0.229 -3.709 1.331 1.00 . A A . 11 ASN ND2 1 1
6 1810 1 1 11 ASN O O 1.937 -0.540 1.427 1.00 . A A . 11 ASN O 1 1
6 1811 1 1 11 ASN OD1 O 1.494 -3.354 -0.460 1.00 . A A . 11 ASN OD1 1 1
6 1812 1 1 12 ASN C C 2.742 2.330 2.421 1.00 . A A . 12 ASN C 1 1
6 1813 1 1 12 ASN CA C 1.667 1.639 3.307 1.00 . A A . 12 ASN CA 1 1
6 1814 1 1 12 ASN CB C 2.129 0.687 4.432 1.00 . A A . 12 ASN CB 1 1
6 1815 1 1 12 ASN CG C 2.918 1.327 5.591 1.00 . A A . 12 ASN CG 1 1
6 1816 1 1 12 ASN H H -0.343 1.293 2.629 1.00 . A A . 12 ASN H 1 1
6 1817 1 1 12 ASN HA H 1.180 2.436 3.854 1.00 . A A . 12 ASN HA 1 1
6 1818 1 1 12 ASN HB2 H 1.231 0.170 4.829 1.00 . A A . 12 ASN HB2 1 1
6 1819 1 1 12 ASN HB3 H 2.741 -0.094 3.973 1.00 . A A . 12 ASN HB3 1 1
6 1820 1 1 12 ASN HD21 H 2.779 2.283 7.350 1.00 . A A . 12 ASN HD21 1 1
6 1821 1 1 12 ASN HD22 H 1.210 1.820 6.520 1.00 . A A . 12 ASN HD22 1 1
6 1822 1 1 12 ASN N N 0.618 0.971 2.492 1.00 . A A . 12 ASN N 1 1
6 1823 1 1 12 ASN ND2 N 2.232 1.865 6.589 1.00 . A A . 12 ASN ND2 1 1
6 1824 1 1 12 ASN O O 3.932 2.144 2.684 1.00 . A A . 12 ASN O 1 1
6 1825 1 1 12 ASN OD1 O 4.149 1.338 5.599 1.00 . A A . 12 ASN OD1 1 1
6 1826 1 1 13 LYS C C 4.224 2.792 -0.221 1.00 . A A . 13 LYS C 1 1
6 1827 1 1 13 LYS CA C 3.312 3.861 0.488 1.00 . A A . 13 LYS CA 1 1
6 1828 1 1 13 LYS CB C 4.091 5.010 1.198 1.00 . A A . 13 LYS CB 1 1
6 1829 1 1 13 LYS CD C 2.504 7.068 0.743 1.00 . A A . 13 LYS CD 1 1
6 1830 1 1 13 LYS CE C 3.408 7.890 -0.196 1.00 . A A . 13 LYS CE 1 1
6 1831 1 1 13 LYS CG C 3.261 6.190 1.764 1.00 . A A . 13 LYS CG 1 1
6 1832 1 1 13 LYS H H 1.339 3.254 1.235 1.00 . A A . 13 LYS H 1 1
6 1833 1 1 13 LYS HA H 2.734 4.341 -0.308 1.00 . A A . 13 LYS HA 1 1
6 1834 1 1 13 LYS HB2 H 4.687 4.581 2.025 1.00 . A A . 13 LYS HB2 1 1
6 1835 1 1 13 LYS HB3 H 4.842 5.419 0.500 1.00 . A A . 13 LYS HB3 1 1
6 1836 1 1 13 LYS HD2 H 1.813 6.440 0.152 1.00 . A A . 13 LYS HD2 1 1
6 1837 1 1 13 LYS HD3 H 1.851 7.759 1.310 1.00 . A A . 13 LYS HD3 1 1
6 1838 1 1 13 LYS HE2 H 4.098 8.525 0.390 1.00 . A A . 13 LYS HE2 1 1
6 1839 1 1 13 LYS HE3 H 4.044 7.224 -0.808 1.00 . A A . 13 LYS HE3 1 1
6 1840 1 1 13 LYS HG2 H 2.534 5.797 2.498 1.00 . A A . 13 LYS HG2 1 1
6 1841 1 1 13 LYS HG3 H 3.931 6.838 2.360 1.00 . A A . 13 LYS HG3 1 1
6 1842 1 1 13 LYS HZ2 H 2.019 9.377 -0.547 1.00 . A A . 13 LYS HZ2 1 1
6 1843 1 1 13 LYS HZ3 H 1.970 8.172 -1.650 1.00 . A A . 13 LYS HZ3 1 1
6 1844 1 1 13 LYS N N 2.349 3.167 1.410 1.00 . A A . 13 LYS N 1 1
6 1845 1 1 13 LYS NZ N 2.614 8.746 -1.096 1.00 . A A . 13 LYS NZ 1 1
6 1846 1 1 13 LYS O O 5.438 2.987 -0.327 1.00 . A A . 13 LYS O 1 1
6 1847 1 1 14 HIS C C 5.368 -0.057 -0.366 1.00 . A A . 14 HIS C 1 1
6 1848 1 1 14 HIS CA C 4.344 0.541 -1.390 1.00 . A A . 14 HIS CA 1 1
6 1849 1 1 14 HIS CB C 4.861 0.984 -2.778 1.00 . A A . 14 HIS CB 1 1
6 1850 1 1 14 HIS CD2 C 5.667 0.048 -5.018 1.00 . A A . 14 HIS CD2 1 1
6 1851 1 1 14 HIS CE1 C 5.432 -2.011 -4.673 1.00 . A A . 14 HIS CE1 1 1
6 1852 1 1 14 HIS CG C 5.181 -0.159 -3.724 1.00 . A A . 14 HIS CG 1 1
6 1853 1 1 14 HIS H H 2.602 1.673 -0.755 1.00 . A A . 14 HIS H 1 1
6 1854 1 1 14 HIS HA H 3.615 -0.248 -1.580 1.00 . A A . 14 HIS HA 1 1
6 1855 1 1 14 HIS HB2 H 4.082 1.606 -3.260 1.00 . A A . 14 HIS HB2 1 1
6 1856 1 1 14 HIS HB3 H 5.745 1.643 -2.681 1.00 . A A . 14 HIS HB3 1 1
6 1857 1 1 14 HIS HD2 H 5.843 1.027 -5.438 1.00 . A A . 14 HIS HD2 1 1
6 1858 1 1 14 HIS HE1 H 5.432 -3.077 -4.845 1.00 . A A . 14 HIS HE1 1 1
6 1859 1 1 14 HIS HE2 H 6.173 -1.359 -6.615 1.00 . A A . 14 HIS HE2 1 1
6 1860 1 1 14 HIS N N 3.627 1.665 -0.722 1.00 . A A . 14 HIS N 1 1
6 1861 1 1 14 HIS ND1 N 5.002 -1.512 -3.465 1.00 . A A . 14 HIS ND1 1 1
6 1862 1 1 14 HIS NE2 N 5.847 -1.159 -5.663 1.00 . A A . 14 HIS NE2 1 1
6 1863 1 1 14 HIS O O 6.516 -0.296 -0.749 1.00 . A A . 14 HIS O 1 1
6 1864 1 1 15 LEU C C 7.053 0.147 2.185 1.00 . A A . 15 LEU C 1 1
6 1865 1 1 15 LEU CA C 5.870 -0.874 1.976 1.00 . A A . 15 LEU CA 1 1
6 1866 1 1 15 LEU CB C 6.307 -2.358 1.755 1.00 . A A . 15 LEU CB 1 1
6 1867 1 1 15 LEU CD1 C 5.004 -3.481 3.689 1.00 . A A . 15 LEU CD1 1 1
6 1868 1 1 15 LEU CD2 C 4.032 -3.491 1.358 1.00 . A A . 15 LEU CD2 1 1
6 1869 1 1 15 LEU CG C 5.336 -3.498 2.167 1.00 . A A . 15 LEU CG 1 1
6 1870 1 1 15 LEU H H 3.961 -0.136 1.162 1.00 . A A . 15 LEU H 1 1
6 1871 1 1 15 LEU HA H 5.321 -0.862 2.914 1.00 . A A . 15 LEU HA 1 1
6 1872 1 1 15 LEU HB2 H 6.599 -2.495 0.700 1.00 . A A . 15 LEU HB2 1 1
6 1873 1 1 15 LEU HB3 H 7.243 -2.547 2.313 1.00 . A A . 15 LEU HB3 1 1
6 1874 1 1 15 LEU HD11 H 5.908 -3.452 4.326 1.00 . A A . 15 LEU HD11 1 1
6 1875 1 1 15 LEU HD12 H 4.401 -2.597 3.985 1.00 . A A . 15 LEU HD12 1 1
6 1876 1 1 15 LEU HD13 H 4.413 -4.358 4.009 1.00 . A A . 15 LEU HD13 1 1
6 1877 1 1 15 LEU HD21 H 4.227 -3.462 0.271 1.00 . A A . 15 LEU HD21 1 1
6 1878 1 1 15 LEU HD22 H 3.405 -2.614 1.603 1.00 . A A . 15 LEU HD22 1 1
6 1879 1 1 15 LEU HD23 H 3.424 -4.391 1.562 1.00 . A A . 15 LEU HD23 1 1
6 1880 1 1 15 LEU HG H 5.859 -4.445 1.885 1.00 . A A . 15 LEU HG 1 1
6 1881 1 1 15 LEU N N 4.952 -0.339 0.917 1.00 . A A . 15 LEU N 1 1
6 1882 1 1 15 LEU O O 8.196 -0.269 2.396 1.00 . A A . 15 LEU O 1 1
6 1883 1 1 16 ASN C C 8.896 2.386 1.198 1.00 . A A . 16 ASN C 1 1
6 1884 1 1 16 ASN CA C 7.800 2.569 2.317 1.00 . A A . 16 ASN CA 1 1
6 1885 1 1 16 ASN CB C 8.244 2.679 3.787 1.00 . A A . 16 ASN CB 1 1
6 1886 1 1 16 ASN CG C 9.034 3.948 4.160 1.00 . A A . 16 ASN CG 1 1
6 1887 1 1 16 ASN H H 5.790 1.766 2.080 1.00 . A A . 16 ASN H 1 1
6 1888 1 1 16 ASN HA H 7.292 3.521 2.133 1.00 . A A . 16 ASN HA 1 1
6 1889 1 1 16 ASN HB2 H 7.338 2.591 4.421 1.00 . A A . 16 ASN HB2 1 1
6 1890 1 1 16 ASN HB3 H 8.851 1.800 4.014 1.00 . A A . 16 ASN HB3 1 1
6 1891 1 1 16 ASN HD21 H 8.899 5.857 4.763 1.00 . A A . 16 ASN HD21 1 1
6 1892 1 1 16 ASN HD22 H 7.328 4.940 4.520 1.00 . A A . 16 ASN HD22 1 1
6 1893 1 1 16 ASN N N 6.779 1.493 2.167 1.00 . A A . 16 ASN N 1 1
6 1894 1 1 16 ASN ND2 N 8.351 5.025 4.517 1.00 . A A . 16 ASN ND2 1 1
6 1895 1 1 16 ASN O O 10.096 2.431 1.487 1.00 . A A . 16 ASN O 1 1
6 1896 1 1 16 ASN OD1 O 10.264 3.967 4.132 1.00 . A A . 16 ASN OD1 1 1
6 1897 1 1 17 GLU C C 10.217 0.629 -1.122 1.00 . A A . 17 GLU C 1 1
6 1898 1 1 17 GLU CA C 9.361 1.944 -1.251 1.00 . A A . 17 GLU CA 1 1
6 1899 1 1 17 GLU CB C 10.137 3.214 -1.670 1.00 . A A . 17 GLU CB 1 1
6 1900 1 1 17 GLU CD C 10.031 5.696 -2.296 1.00 . A A . 17 GLU CD 1 1
6 1901 1 1 17 GLU CG C 9.241 4.403 -2.085 1.00 . A A . 17 GLU CG 1 1
6 1902 1 1 17 GLU H H 7.438 2.118 -0.227 1.00 . A A . 17 GLU H 1 1
6 1903 1 1 17 GLU HA H 8.700 1.759 -2.101 1.00 . A A . 17 GLU HA 1 1
6 1904 1 1 17 GLU HB2 H 10.778 3.489 -0.829 1.00 . A A . 17 GLU HB2 1 1
6 1905 1 1 17 GLU HB3 H 10.823 2.980 -2.505 1.00 . A A . 17 GLU HB3 1 1
6 1906 1 1 17 GLU HE2 H 11.019 6.613 -3.701 1.00 . A A . 17 GLU HE2 1 1
6 1907 1 1 17 GLU HG2 H 8.683 4.152 -3.007 1.00 . A A . 17 GLU HG2 1 1
6 1908 1 1 17 GLU HG3 H 8.464 4.570 -1.313 1.00 . A A . 17 GLU HG3 1 1
6 1909 1 1 17 GLU N N 8.463 2.161 -0.080 1.00 . A A . 17 GLU N 1 1
6 1910 1 1 17 GLU O O 11.412 0.624 -1.433 1.00 . A A . 17 GLU O 1 1
6 1911 1 1 17 GLU OE1 O 10.199 6.538 -1.415 1.00 . A A . 17 GLU OE1 1 1
6 1912 1 1 17 GLU OE2 O 10.524 5.801 -3.572 1.00 . A A . 17 GLU OE2 1 1
6 1913 1 1 18 HIS C C 9.415 -2.869 -1.297 1.00 . A A . 18 HIS C 1 1
6 1914 1 1 18 HIS CA C 10.225 -1.802 -0.513 1.00 . A A . 18 HIS CA 1 1
6 1915 1 1 18 HIS CB C 10.557 -2.006 0.997 1.00 . A A . 18 HIS CB 1 1
6 1916 1 1 18 HIS CD2 C 11.998 -3.455 2.546 1.00 . A A . 18 HIS CD2 1 1
6 1917 1 1 18 HIS CE1 C 12.892 -4.735 1.139 1.00 . A A . 18 HIS CE1 1 1
6 1918 1 1 18 HIS CG C 11.582 -3.100 1.259 1.00 . A A . 18 HIS CG 1 1
6 1919 1 1 18 HIS H H 8.695 -0.342 -0.210 1.00 . A A . 18 HIS H 1 1
6 1920 1 1 18 HIS HA H 11.178 -1.817 -0.995 1.00 . A A . 18 HIS HA 1 1
6 1921 1 1 18 HIS HB2 H 10.935 -1.065 1.437 1.00 . A A . 18 HIS HB2 1 1
6 1922 1 1 18 HIS HB3 H 9.647 -2.238 1.581 1.00 . A A . 18 HIS HB3 1 1
6 1923 1 1 18 HIS HD2 H 11.654 -2.960 3.442 1.00 . A A . 18 HIS HD2 1 1
6 1924 1 1 18 HIS HE1 H 13.488 -5.537 0.728 1.00 . A A . 18 HIS HE1 1 1
6 1925 1 1 18 HIS HE2 H 13.330 -5.041 3.250 1.00 . A A . 18 HIS HE2 1 1
6 1926 1 1 18 HIS N N 9.580 -0.491 -0.692 1.00 . A A . 18 HIS N 1 1
6 1927 1 1 18 HIS ND1 N 12.162 -3.925 0.301 1.00 . A A . 18 HIS ND1 1 1
6 1928 1 1 18 HIS NE2 N 12.864 -4.528 2.493 1.00 . A A . 18 HIS NE2 1 1
6 1929 1 1 18 HIS O O 9.451 -2.925 -2.529 1.00 . A A . 18 HIS O 1 1
6 1930 1 1 19 ALA C C 8.716 -5.975 -1.619 1.00 . A A . 19 ALA C 1 1
6 1931 1 1 19 ALA CA C 7.861 -4.828 -1.003 1.00 . A A . 19 ALA CA 1 1
6 1932 1 1 19 ALA CB C 6.692 -4.373 -1.907 1.00 . A A . 19 ALA CB 1 1
6 1933 1 1 19 ALA H H 8.926 -3.444 0.438 1.00 . A A . 19 ALA H 1 1
6 1934 1 1 19 ALA HA H 7.371 -5.227 -0.093 1.00 . A A . 19 ALA HA 1 1
6 1935 1 1 19 ALA HB1 H 6.082 -3.587 -1.424 1.00 . A A . 19 ALA HB1 1 1
6 1936 1 1 19 ALA HB2 H 7.041 -3.968 -2.874 1.00 . A A . 19 ALA HB2 1 1
6 1937 1 1 19 ALA HB3 H 6.008 -5.212 -2.135 1.00 . A A . 19 ALA HB3 1 1
6 1938 1 1 19 ALA N N 8.720 -3.706 -0.531 1.00 . A A . 19 ALA N 1 1
6 1939 1 1 19 ALA O O 8.901 -6.044 -2.839 1.00 . A A . 19 ALA O 1 1
6 1940 1 1 20 HIS C C 9.178 -9.205 -1.641 1.00 . A A . 20 HIS C 1 1
6 1941 1 1 20 HIS CA C 10.069 -8.022 -1.163 1.00 . A A . 20 HIS CA 1 1
6 1942 1 1 20 HIS CB C 11.000 -8.402 0.016 1.00 . A A . 20 HIS CB 1 1
6 1943 1 1 20 HIS CD2 C 13.102 -9.767 0.568 1.00 . A A . 20 HIS CD2 1 1
6 1944 1 1 20 HIS CE1 C 13.681 -10.363 -1.362 1.00 . A A . 20 HIS CE1 1 1
6 1945 1 1 20 HIS CG C 12.181 -9.283 -0.369 1.00 . A A . 20 HIS CG 1 1
6 1946 1 1 20 HIS H H 9.128 -6.636 0.235 1.00 . A A . 20 HIS H 1 1
6 1947 1 1 20 HIS HA H 10.732 -7.669 -1.969 1.00 . A A . 20 HIS HA 1 1
6 1948 1 1 20 HIS HB2 H 11.434 -7.498 0.487 1.00 . A A . 20 HIS HB2 1 1
6 1949 1 1 20 HIS HB3 H 10.426 -8.890 0.827 1.00 . A A . 20 HIS HB3 1 1
6 1950 1 1 20 HIS HD2 H 13.046 -9.560 1.626 1.00 . A A . 20 HIS HD2 1 1
6 1951 1 1 20 HIS HE1 H 14.256 -10.816 -2.157 1.00 . A A . 20 HIS HE1 1 1
6 1952 1 1 20 HIS HE2 H 14.923 -10.955 0.326 1.00 . A A . 20 HIS HE2 1 1
6 1953 1 1 20 HIS N N 9.232 -6.871 -0.752 1.00 . A A . 20 HIS N 1 1
6 1954 1 1 20 HIS ND1 N 12.542 -9.651 -1.660 1.00 . A A . 20 HIS ND1 1 1
6 1955 1 1 20 HIS NE2 N 14.095 -10.490 -0.062 1.00 . A A . 20 HIS NE2 1 1
6 1956 1 1 20 HIS O O 8.427 -9.810 -0.873 1.00 . A A . 20 HIS O 1 1
7 1957 1 1 1 SER C C -13.029 -3.073 -0.369 1.00 . A A . 1 SER C 1 1
7 1958 1 1 1 SER CA C -13.735 -2.358 -1.570 1.00 . A A . 1 SER CA 1 1
7 1959 1 1 1 SER CB C -15.221 -2.760 -1.732 1.00 . A A . 1 SER CB 1 1
7 1960 1 1 1 SER H1 H -13.063 -3.561 -3.276 1.00 . A A . 1 SER H1 1 1
7 1961 1 1 1 SER HA H -13.705 -1.276 -1.338 1.00 . A A . 1 SER HA 1 1
7 1962 1 1 1 SER HB2 H -15.625 -2.387 -2.694 1.00 . A A . 1 SER HB2 1 1
7 1963 1 1 1 SER HB3 H -15.335 -3.863 -1.757 1.00 . A A . 1 SER HB3 1 1
7 1964 1 1 1 SER HG H -15.649 -2.602 0.136 1.00 . A A . 1 SER HG 1 1
7 1965 1 1 1 SER N N -13.105 -2.614 -2.896 1.00 . A A . 1 SER N 1 1
7 1966 1 1 1 SER O O -13.685 -3.497 0.589 1.00 . A A . 1 SER O 1 1
7 1967 1 1 1 SER OG O -16.009 -2.229 -0.673 1.00 . A A . 1 SER OG 1 1
7 1968 1 1 2 ASP C C -9.389 -3.306 0.448 1.00 . A A . 2 ASP C 1 1
7 1969 1 1 2 ASP CA C -10.859 -3.784 0.659 1.00 . A A . 2 ASP CA 1 1
7 1970 1 1 2 ASP CB C -11.014 -5.341 0.695 1.00 . A A . 2 ASP CB 1 1
7 1971 1 1 2 ASP CG C -10.520 -5.971 2.004 1.00 . A A . 2 ASP CG 1 1
7 1972 1 1 2 ASP H H -11.260 -2.697 -1.201 1.00 . A A . 2 ASP H 1 1
7 1973 1 1 2 ASP HA H -11.207 -3.342 1.613 1.00 . A A . 2 ASP HA 1 1
7 1974 1 1 2 ASP HB2 H -12.063 -5.664 0.521 1.00 . A A . 2 ASP HB2 1 1
7 1975 1 1 2 ASP HB3 H -10.465 -5.796 -0.151 1.00 . A A . 2 ASP HB3 1 1
7 1976 1 1 2 ASP HD2 H -12.366 -5.793 2.592 1.00 . A A . 2 ASP HD2 1 1
7 1977 1 1 2 ASP N N -11.686 -3.181 -0.411 1.00 . A A . 2 ASP N 1 1
7 1978 1 1 2 ASP O O -8.526 -4.062 -0.011 1.00 . A A . 2 ASP O 1 1
7 1979 1 1 2 ASP OD1 O -9.351 -6.307 2.194 1.00 . A A . 2 ASP OD1 1 1
7 1980 1 1 2 ASP OD2 O -11.525 -6.113 2.926 1.00 . A A . 2 ASP OD2 1 1
7 1981 1 1 3 THR C C -7.334 -0.755 2.077 1.00 . A A . 3 THR C 1 1
7 1982 1 1 3 THR CA C -7.784 -1.397 0.722 1.00 . A A . 3 THR CA 1 1
7 1983 1 1 3 THR CB C -7.783 -0.444 -0.519 1.00 . A A . 3 THR CB 1 1
7 1984 1 1 3 THR CG2 C -8.296 0.991 -0.306 1.00 . A A . 3 THR CG2 1 1
7 1985 1 1 3 THR H H -9.932 -1.465 1.015 1.00 . A A . 3 THR H 1 1
7 1986 1 1 3 THR HA H -7.062 -2.185 0.527 1.00 . A A . 3 THR HA 1 1
7 1987 1 1 3 THR HB H -8.397 -0.896 -1.322 1.00 . A A . 3 THR HB 1 1
7 1988 1 1 3 THR HG1 H -5.945 0.065 -0.329 1.00 . A A . 3 THR HG1 1 1
7 1989 1 1 3 THR HG21 H -8.400 1.521 -1.267 1.00 . A A . 3 THR HG21 1 1
7 1990 1 1 3 THR HG22 H -7.593 1.590 0.304 1.00 . A A . 3 THR HG22 1 1
7 1991 1 1 3 THR HG23 H -9.270 0.999 0.213 1.00 . A A . 3 THR HG23 1 1
7 1992 1 1 3 THR N N -9.123 -2.032 0.801 1.00 . A A . 3 THR N 1 1
7 1993 1 1 3 THR O O -6.623 0.255 2.078 1.00 . A A . 3 THR O 1 1
7 1994 1 1 3 THR OG1 O -6.465 -0.343 -1.025 1.00 . A A . 3 THR OG1 1 1
7 1995 1 1 4 ARG C C -5.804 -0.863 4.969 1.00 . A A . 4 ARG C 1 1
7 1996 1 1 4 ARG CA C -7.293 -0.845 4.569 1.00 . A A . 4 ARG CA 1 1
7 1997 1 1 4 ARG CB C -8.191 -1.438 5.691 1.00 . A A . 4 ARG CB 1 1
7 1998 1 1 4 ARG CD C -10.603 -1.918 4.782 1.00 . A A . 4 ARG CD 1 1
7 1999 1 1 4 ARG CG C -9.689 -1.045 5.670 1.00 . A A . 4 ARG CG 1 1
7 2000 1 1 4 ARG CZ C -13.080 -2.137 4.432 1.00 . A A . 4 ARG CZ 1 1
7 2001 1 1 4 ARG H H -8.170 -2.248 3.121 1.00 . A A . 4 ARG H 1 1
7 2002 1 1 4 ARG HA H -7.477 0.250 4.422 1.00 . A A . 4 ARG HA 1 1
7 2003 1 1 4 ARG HB2 H -8.083 -2.540 5.739 1.00 . A A . 4 ARG HB2 1 1
7 2004 1 1 4 ARG HB3 H -7.793 -1.093 6.664 1.00 . A A . 4 ARG HB3 1 1
7 2005 1 1 4 ARG HD2 H -10.282 -1.880 3.726 1.00 . A A . 4 ARG HD2 1 1
7 2006 1 1 4 ARG HD3 H -10.524 -2.976 5.097 1.00 . A A . 4 ARG HD3 1 1
7 2007 1 1 4 ARG HG2 H -10.063 -1.104 6.710 1.00 . A A . 4 ARG HG2 1 1
7 2008 1 1 4 ARG HG3 H -9.785 0.022 5.390 1.00 . A A . 4 ARG HG3 1 1
7 2009 1 1 4 ARG HH11 H -13.899 -3.756 3.563 1.00 . A A . 4 ARG HH11 1 1
7 2010 1 1 4 ARG HH12 H -12.074 -3.743 3.756 1.00 . A A . 4 ARG HH12 1 1
7 2011 1 1 4 ARG HH21 H -14.301 -0.665 5.023 1.00 . A A . 4 ARG HH21 1 1
7 2012 1 1 4 ARG HH22 H -15.072 -2.130 4.233 1.00 . A A . 4 ARG HH22 1 1
7 2013 1 1 4 ARG N N -7.658 -1.376 3.233 1.00 . A A . 4 ARG N 1 1
7 2014 1 1 4 ARG NE N -12.009 -1.451 4.876 1.00 . A A . 4 ARG NE 1 1
7 2015 1 1 4 ARG NH1 N -13.010 -3.336 3.858 1.00 . A A . 4 ARG NH1 1 1
7 2016 1 1 4 ARG NH2 N -14.272 -1.588 4.577 1.00 . A A . 4 ARG NH2 1 1
7 2017 1 1 4 ARG O O -5.446 -0.086 5.860 1.00 . A A . 4 ARG O 1 1
7 2018 1 1 5 TYR C C -2.888 -0.701 3.610 1.00 . A A . 5 TYR C 1 1
7 2019 1 1 5 TYR CA C -3.482 -1.743 4.665 1.00 . A A . 5 TYR CA 1 1
7 2020 1 1 5 TYR CB C -2.956 -3.195 4.507 1.00 . A A . 5 TYR CB 1 1
7 2021 1 1 5 TYR CD1 C -0.923 -3.207 6.067 1.00 . A A . 5 TYR CD1 1 1
7 2022 1 1 5 TYR CD2 C -0.571 -3.631 3.716 1.00 . A A . 5 TYR CD2 1 1
7 2023 1 1 5 TYR CE1 C 0.453 -3.265 6.281 1.00 . A A . 5 TYR CE1 1 1
7 2024 1 1 5 TYR CE2 C 0.803 -3.690 3.931 1.00 . A A . 5 TYR CE2 1 1
7 2025 1 1 5 TYR CG C -1.446 -3.373 4.779 1.00 . A A . 5 TYR CG 1 1
7 2026 1 1 5 TYR CZ C 1.315 -3.497 5.212 1.00 . A A . 5 TYR CZ 1 1
7 2027 1 1 5 TYR H H -5.314 -2.216 3.580 1.00 . A A . 5 TYR H 1 1
7 2028 1 1 5 TYR HA H -3.319 -1.404 5.691 1.00 . A A . 5 TYR HA 1 1
7 2029 1 1 5 TYR HB2 H -3.542 -3.852 5.174 1.00 . A A . 5 TYR HB2 1 1
7 2030 1 1 5 TYR HB3 H -3.201 -3.568 3.492 1.00 . A A . 5 TYR HB3 1 1
7 2031 1 1 5 TYR HD1 H -1.579 -3.000 6.901 1.00 . A A . 5 TYR HD1 1 1
7 2032 1 1 5 TYR HD2 H -0.948 -3.753 2.710 1.00 . A A . 5 TYR HD2 1 1
7 2033 1 1 5 TYR HE1 H 0.849 -3.112 7.275 1.00 . A A . 5 TYR HE1 1 1
7 2034 1 1 5 TYR HE2 H 1.470 -3.863 3.099 1.00 . A A . 5 TYR HE2 1 1
7 2035 1 1 5 TYR HH H 2.851 -3.343 6.340 1.00 . A A . 5 TYR HH 1 1
7 2036 1 1 5 TYR N N -4.951 -1.742 4.391 1.00 . A A . 5 TYR N 1 1
7 2037 1 1 5 TYR O O -1.968 -0.969 2.839 1.00 . A A . 5 TYR O 1 1
7 2038 1 1 5 TYR OH O 2.671 -3.502 5.411 1.00 . A A . 5 TYR OH 1 1
7 2039 1 1 6 ASN C C -3.049 1.528 1.420 1.00 . A A . 6 ASN C 1 1
7 2040 1 1 6 ASN CA C -3.364 1.712 2.887 1.00 . A A . 6 ASN CA 1 1
7 2041 1 1 6 ASN CB C -2.685 2.842 3.678 1.00 . A A . 6 ASN CB 1 1
7 2042 1 1 6 ASN CG C -2.820 4.324 3.271 1.00 . A A . 6 ASN CG 1 1
7 2043 1 1 6 ASN H H -4.312 0.504 4.224 1.00 . A A . 6 ASN H 1 1
7 2044 1 1 6 ASN HA H -4.408 2.082 2.842 1.00 . A A . 6 ASN HA 1 1
7 2045 1 1 6 ASN HB2 H -3.010 2.867 4.720 1.00 . A A . 6 ASN HB2 1 1
7 2046 1 1 6 ASN HB3 H -1.671 2.502 3.679 1.00 . A A . 6 ASN HB3 1 1
7 2047 1 1 6 ASN HD21 H -4.043 5.783 2.639 1.00 . A A . 6 ASN HD21 1 1
7 2048 1 1 6 ASN HD22 H -4.752 4.096 2.780 1.00 . A A . 6 ASN HD22 1 1
7 2049 1 1 6 ASN N N -3.509 0.497 3.640 1.00 . A A . 6 ASN N 1 1
7 2050 1 1 6 ASN ND2 N -3.991 4.781 2.854 1.00 . A A . 6 ASN ND2 1 1
7 2051 1 1 6 ASN O O -2.161 2.240 0.950 1.00 . A A . 6 ASN O 1 1
7 2052 1 1 6 ASN OD1 O -1.887 5.106 3.432 1.00 . A A . 6 ASN OD1 1 1
7 2053 1 1 7 LYS C C -3.944 1.860 -1.477 1.00 . A A . 7 LYS C 1 1
7 2054 1 1 7 LYS CA C -3.419 0.546 -0.812 1.00 . A A . 7 LYS CA 1 1
7 2055 1 1 7 LYS CB C -3.525 -0.597 -1.842 1.00 . A A . 7 LYS CB 1 1
7 2056 1 1 7 LYS CD C -2.462 -2.574 -0.479 1.00 . A A . 7 LYS CD 1 1
7 2057 1 1 7 LYS CE C -1.124 -2.704 -1.229 1.00 . A A . 7 LYS CE 1 1
7 2058 1 1 7 LYS CG C -3.630 -2.053 -1.341 1.00 . A A . 7 LYS CG 1 1
7 2059 1 1 7 LYS H H -4.260 -0.091 1.208 1.00 . A A . 7 LYS H 1 1
7 2060 1 1 7 LYS HA H -2.327 0.671 -0.806 1.00 . A A . 7 LYS HA 1 1
7 2061 1 1 7 LYS HB2 H -4.314 -0.346 -2.582 1.00 . A A . 7 LYS HB2 1 1
7 2062 1 1 7 LYS HB3 H -2.635 -0.423 -2.509 1.00 . A A . 7 LYS HB3 1 1
7 2063 1 1 7 LYS HD2 H -2.339 -1.927 0.409 1.00 . A A . 7 LYS HD2 1 1
7 2064 1 1 7 LYS HD3 H -2.753 -3.563 -0.077 1.00 . A A . 7 LYS HD3 1 1
7 2065 1 1 7 LYS HE2 H -1.234 -3.355 -2.116 1.00 . A A . 7 LYS HE2 1 1
7 2066 1 1 7 LYS HE3 H -0.786 -1.721 -1.603 1.00 . A A . 7 LYS HE3 1 1
7 2067 1 1 7 LYS HG2 H -4.564 -2.159 -0.761 1.00 . A A . 7 LYS HG2 1 1
7 2068 1 1 7 LYS HG3 H -3.764 -2.721 -2.213 1.00 . A A . 7 LYS HG3 1 1
7 2069 1 1 7 LYS HZ2 H 0.808 -3.315 -0.845 1.00 . A A . 7 LYS HZ2 1 1
7 2070 1 1 7 LYS HZ3 H 0.074 -2.634 0.448 1.00 . A A . 7 LYS HZ3 1 1
7 2071 1 1 7 LYS N N -3.723 0.589 0.661 1.00 . A A . 7 LYS N 1 1
7 2072 1 1 7 LYS NZ N -0.088 -3.262 -0.347 1.00 . A A . 7 LYS NZ 1 1
7 2073 1 1 7 LYS O O -3.853 1.983 -2.708 1.00 . A A . 7 LYS O 1 1
7 2074 1 1 8 SER C C -3.476 4.694 -1.330 1.00 . A A . 8 SER C 1 1
7 2075 1 1 8 SER CA C -4.962 4.144 -1.231 1.00 . A A . 8 SER CA 1 1
7 2076 1 1 8 SER CB C -5.985 4.892 -0.380 1.00 . A A . 8 SER CB 1 1
7 2077 1 1 8 SER H H -5.003 2.428 0.160 1.00 . A A . 8 SER H 1 1
7 2078 1 1 8 SER HA H -5.380 4.029 -2.212 1.00 . A A . 8 SER HA 1 1
7 2079 1 1 8 SER HB2 H -6.932 4.321 -0.306 1.00 . A A . 8 SER HB2 1 1
7 2080 1 1 8 SER HB3 H -5.586 4.998 0.629 1.00 . A A . 8 SER HB3 1 1
7 2081 1 1 8 SER HG H -6.883 6.591 -0.341 1.00 . A A . 8 SER HG 1 1
7 2082 1 1 8 SER N N -4.561 2.831 -0.701 1.00 . A A . 8 SER N 1 1
7 2083 1 1 8 SER O O -2.898 4.265 -2.322 1.00 . A A . 8 SER O 1 1
7 2084 1 1 8 SER OG O -6.248 6.175 -0.930 1.00 . A A . 8 SER OG 1 1
7 2085 1 1 9 PHE C C -0.619 6.244 -1.667 1.00 . A A . 9 PHE C 1 1
7 2086 1 1 9 PHE CA C -1.371 5.835 -0.293 1.00 . A A . 9 PHE CA 1 1
7 2087 1 1 9 PHE CB C -0.424 4.935 0.559 1.00 . A A . 9 PHE CB 1 1
7 2088 1 1 9 PHE CD1 C 0.932 6.922 1.576 1.00 . A A . 9 PHE CD1 1 1
7 2089 1 1 9 PHE CD2 C 1.174 4.710 2.510 1.00 . A A . 9 PHE CD2 1 1
7 2090 1 1 9 PHE CE1 C 1.782 7.428 2.558 1.00 . A A . 9 PHE CE1 1 1
7 2091 1 1 9 PHE CE2 C 2.025 5.216 3.488 1.00 . A A . 9 PHE CE2 1 1
7 2092 1 1 9 PHE CG C 0.602 5.558 1.549 1.00 . A A . 9 PHE CG 1 1
7 2093 1 1 9 PHE CZ C 2.323 6.575 3.515 1.00 . A A . 9 PHE CZ 1 1
7 2094 1 1 9 PHE H H -3.437 5.462 0.480 1.00 . A A . 9 PHE H 1 1
7 2095 1 1 9 PHE HA H -1.496 6.642 0.434 1.00 . A A . 9 PHE HA 1 1
7 2096 1 1 9 PHE HB2 H -1.044 4.262 1.166 1.00 . A A . 9 PHE HB2 1 1
7 2097 1 1 9 PHE HB3 H 0.110 4.266 -0.119 1.00 . A A . 9 PHE HB3 1 1
7 2098 1 1 9 PHE HD1 H 0.531 7.608 0.847 1.00 . A A . 9 PHE HD1 1 1
7 2099 1 1 9 PHE HD2 H 0.951 3.653 2.527 1.00 . A A . 9 PHE HD2 1 1
7 2100 1 1 9 PHE HE1 H 2.023 8.481 2.574 1.00 . A A . 9 PHE HE1 1 1
7 2101 1 1 9 PHE HE2 H 2.453 4.555 4.227 1.00 . A A . 9 PHE HE2 1 1
7 2102 1 1 9 PHE HZ H 2.984 6.967 4.274 1.00 . A A . 9 PHE HZ 1 1
7 2103 1 1 9 PHE N N -2.815 5.327 -0.318 1.00 . A A . 9 PHE N 1 1
7 2104 1 1 9 PHE O O -0.059 7.323 -1.858 1.00 . A A . 9 PHE O 1 1
7 2105 1 1 10 ILE C C 0.392 3.461 -3.704 1.00 . A A . 10 ILE C 1 1
7 2106 1 1 10 ILE CA C -0.211 4.866 -3.894 1.00 . A A . 10 ILE CA 1 1
7 2107 1 1 10 ILE CB C 0.442 5.978 -4.748 1.00 . A A . 10 ILE CB 1 1
7 2108 1 1 10 ILE CD1 C -0.058 8.480 -5.261 1.00 . A A . 10 ILE CD1 1 1
7 2109 1 1 10 ILE CG1 C -0.627 7.070 -5.049 1.00 . A A . 10 ILE CG1 1 1
7 2110 1 1 10 ILE CG2 C 1.103 5.472 -6.051 1.00 . A A . 10 ILE CG2 1 1
7 2111 1 1 10 ILE H H -1.516 4.740 -2.306 1.00 . A A . 10 ILE H 1 1
7 2112 1 1 10 ILE HA H -1.207 4.637 -4.303 1.00 . A A . 10 ILE HA 1 1
7 2113 1 1 10 ILE HB H 1.222 6.391 -4.105 1.00 . A A . 10 ILE HB 1 1
7 2114 1 1 10 ILE HD11 H -0.867 9.211 -5.444 1.00 . A A . 10 ILE HD11 1 1
7 2115 1 1 10 ILE HD12 H 0.504 8.829 -4.375 1.00 . A A . 10 ILE HD12 1 1
7 2116 1 1 10 ILE HD13 H 0.624 8.523 -6.129 1.00 . A A . 10 ILE HD13 1 1
7 2117 1 1 10 ILE HG12 H -1.234 6.783 -5.933 1.00 . A A . 10 ILE HG12 1 1
7 2118 1 1 10 ILE HG13 H -1.352 7.097 -4.201 1.00 . A A . 10 ILE HG13 1 1
7 2119 1 1 10 ILE HG21 H 1.905 4.740 -5.846 1.00 . A A . 10 ILE HG21 1 1
7 2120 1 1 10 ILE HG22 H 1.569 6.297 -6.621 1.00 . A A . 10 ILE HG22 1 1
7 2121 1 1 10 ILE HG23 H 0.373 4.980 -6.721 1.00 . A A . 10 ILE HG23 1 1
7 2122 1 1 10 ILE N N -0.631 5.200 -2.512 1.00 . A A . 10 ILE N 1 1
7 2123 1 1 10 ILE O O 1.599 3.367 -3.469 1.00 . A A . 10 ILE O 1 1
7 2124 1 1 11 ASN C C 0.659 0.863 -2.213 1.00 . A A . 11 ASN C 1 1
7 2125 1 1 11 ASN CA C -0.017 0.964 -3.619 1.00 . A A . 11 ASN CA 1 1
7 2126 1 1 11 ASN CB C 0.723 0.458 -4.879 1.00 . A A . 11 ASN CB 1 1
7 2127 1 1 11 ASN CG C 1.222 -0.999 -4.899 1.00 . A A . 11 ASN CG 1 1
7 2128 1 1 11 ASN H H -1.039 2.307 -4.668 1.00 . A A . 11 ASN H 1 1
7 2129 1 1 11 ASN HA H -0.916 0.356 -3.572 1.00 . A A . 11 ASN HA 1 1
7 2130 1 1 11 ASN HB2 H 0.083 0.604 -5.771 1.00 . A A . 11 ASN HB2 1 1
7 2131 1 1 11 ASN HB3 H 1.565 1.134 -5.033 1.00 . A A . 11 ASN HB3 1 1
7 2132 1 1 11 ASN HD21 H 0.687 -2.933 -4.892 1.00 . A A . 11 ASN HD21 1 1
7 2133 1 1 11 ASN HD22 H -0.660 -1.689 -4.818 1.00 . A A . 11 ASN HD22 1 1
7 2134 1 1 11 ASN N N -0.451 2.362 -3.827 1.00 . A A . 11 ASN N 1 1
7 2135 1 1 11 ASN ND2 N 0.324 -1.973 -4.866 1.00 . A A . 11 ASN ND2 1 1
7 2136 1 1 11 ASN O O 1.614 0.093 -2.085 1.00 . A A . 11 ASN O 1 1
7 2137 1 1 11 ASN OD1 O 2.422 -1.256 -4.970 1.00 . A A . 11 ASN OD1 1 1
7 2138 1 1 12 ASN C C 2.320 2.006 0.083 1.00 . A A . 12 ASN C 1 1
7 2139 1 1 12 ASN CA C 0.821 1.550 0.202 1.00 . A A . 12 ASN CA 1 1
7 2140 1 1 12 ASN CB C 0.513 0.206 0.888 1.00 . A A . 12 ASN CB 1 1
7 2141 1 1 12 ASN CG C 1.014 0.005 2.335 1.00 . A A . 12 ASN CG 1 1
7 2142 1 1 12 ASN H H -0.721 2.172 -1.333 1.00 . A A . 12 ASN H 1 1
7 2143 1 1 12 ASN HA H 0.351 2.256 0.856 1.00 . A A . 12 ASN HA 1 1
7 2144 1 1 12 ASN HB2 H -0.582 0.072 0.817 1.00 . A A . 12 ASN HB2 1 1
7 2145 1 1 12 ASN HB3 H 0.945 -0.587 0.272 1.00 . A A . 12 ASN HB3 1 1
7 2146 1 1 12 ASN HD21 H 0.897 0.618 4.241 1.00 . A A . 12 ASN HD21 1 1
7 2147 1 1 12 ASN HD22 H -0.157 1.486 3.015 1.00 . A A . 12 ASN HD22 1 1
7 2148 1 1 12 ASN N N 0.163 1.605 -1.151 1.00 . A A . 12 ASN N 1 1
7 2149 1 1 12 ASN ND2 N 0.536 0.782 3.295 1.00 . A A . 12 ASN ND2 1 1
7 2150 1 1 12 ASN O O 3.207 1.316 0.589 1.00 . A A . 12 ASN O 1 1
7 2151 1 1 12 ASN OD1 O 1.851 -0.857 2.600 1.00 . A A . 12 ASN OD1 1 1
7 2152 1 1 13 LYS C C 4.804 2.672 -1.600 1.00 . A A . 13 LYS C 1 1
7 2153 1 1 13 LYS CA C 3.978 3.721 -0.780 1.00 . A A . 13 LYS CA 1 1
7 2154 1 1 13 LYS CB C 4.642 4.237 0.535 1.00 . A A . 13 LYS CB 1 1
7 2155 1 1 13 LYS CD C 5.338 6.681 -0.172 1.00 . A A . 13 LYS CD 1 1
7 2156 1 1 13 LYS CE C 6.870 6.486 -0.172 1.00 . A A . 13 LYS CE 1 1
7 2157 1 1 13 LYS CG C 4.496 5.757 0.744 1.00 . A A . 13 LYS CG 1 1
7 2158 1 1 13 LYS H H 1.799 3.697 -0.946 1.00 . A A . 13 LYS H 1 1
7 2159 1 1 13 LYS HA H 3.891 4.581 -1.453 1.00 . A A . 13 LYS HA 1 1
7 2160 1 1 13 LYS HB2 H 4.220 3.716 1.416 1.00 . A A . 13 LYS HB2 1 1
7 2161 1 1 13 LYS HB3 H 5.715 3.981 0.583 1.00 . A A . 13 LYS HB3 1 1
7 2162 1 1 13 LYS HD2 H 4.981 6.570 -1.212 1.00 . A A . 13 LYS HD2 1 1
7 2163 1 1 13 LYS HD3 H 5.107 7.733 0.082 1.00 . A A . 13 LYS HD3 1 1
7 2164 1 1 13 LYS HE2 H 7.130 5.453 -0.467 1.00 . A A . 13 LYS HE2 1 1
7 2165 1 1 13 LYS HE3 H 7.314 7.131 -0.952 1.00 . A A . 13 LYS HE3 1 1
7 2166 1 1 13 LYS HG2 H 3.430 6.016 0.609 1.00 . A A . 13 LYS HG2 1 1
7 2167 1 1 13 LYS HG3 H 4.718 5.987 1.799 1.00 . A A . 13 LYS HG3 1 1
7 2168 1 1 13 LYS HZ2 H 7.342 7.790 1.358 1.00 . A A . 13 LYS HZ2 1 1
7 2169 1 1 13 LYS HZ3 H 8.524 6.705 1.045 1.00 . A A . 13 LYS HZ3 1 1
7 2170 1 1 13 LYS N N 2.598 3.184 -0.560 1.00 . A A . 13 LYS N 1 1
7 2171 1 1 13 LYS NZ N 7.506 6.806 1.120 1.00 . A A . 13 LYS NZ 1 1
7 2172 1 1 13 LYS O O 5.996 2.501 -1.338 1.00 . A A . 13 LYS O 1 1
7 2173 1 1 14 HIS C C 5.386 -0.177 -2.511 1.00 . A A . 14 HIS C 1 1
7 2174 1 1 14 HIS CA C 4.868 0.962 -3.462 1.00 . A A . 14 HIS CA 1 1
7 2175 1 1 14 HIS CB C 5.873 1.605 -4.445 1.00 . A A . 14 HIS CB 1 1
7 2176 1 1 14 HIS CD2 C 7.115 1.129 -6.632 1.00 . A A . 14 HIS CD2 1 1
7 2177 1 1 14 HIS CE1 C 6.345 -0.770 -7.098 1.00 . A A . 14 HIS CE1 1 1
7 2178 1 1 14 HIS CG C 6.224 0.726 -5.633 1.00 . A A . 14 HIS CG 1 1
7 2179 1 1 14 HIS H H 3.274 2.375 -2.938 1.00 . A A . 14 HIS H 1 1
7 2180 1 1 14 HIS HA H 4.099 0.502 -4.081 1.00 . A A . 14 HIS HA 1 1
7 2181 1 1 14 HIS HB2 H 5.437 2.541 -4.844 1.00 . A A . 14 HIS HB2 1 1
7 2182 1 1 14 HIS HB3 H 6.799 1.913 -3.924 1.00 . A A . 14 HIS HB3 1 1
7 2183 1 1 14 HIS HD2 H 7.617 2.085 -6.631 1.00 . A A . 14 HIS HD2 1 1
7 2184 1 1 14 HIS HE1 H 6.168 -1.692 -7.631 1.00 . A A . 14 HIS HE1 1 1
7 2185 1 1 14 HIS HE2 H 7.765 0.144 -8.474 1.00 . A A . 14 HIS HE2 1 1
7 2186 1 1 14 HIS N N 4.195 2.007 -2.636 1.00 . A A . 14 HIS N 1 1
7 2187 1 1 14 HIS ND1 N 5.689 -0.526 -5.913 1.00 . A A . 14 HIS ND1 1 1
7 2188 1 1 14 HIS NE2 N 7.217 0.157 -7.606 1.00 . A A . 14 HIS NE2 1 1
7 2189 1 1 14 HIS O O 6.539 -0.596 -2.646 1.00 . A A . 14 HIS O 1 1
7 2190 1 1 15 LEU C C 6.062 -1.185 0.327 1.00 . A A . 15 LEU C 1 1
7 2191 1 1 15 LEU CA C 4.916 -1.747 -0.582 1.00 . A A . 15 LEU CA 1 1
7 2192 1 1 15 LEU CB C 5.182 -3.148 -1.226 1.00 . A A . 15 LEU CB 1 1
7 2193 1 1 15 LEU CD1 C 3.161 -4.439 -0.297 1.00 . A A . 15 LEU CD1 1 1
7 2194 1 1 15 LEU CD2 C 3.018 -3.431 -2.612 1.00 . A A . 15 LEU CD2 1 1
7 2195 1 1 15 LEU CG C 3.964 -4.049 -1.570 1.00 . A A . 15 LEU CG 1 1
7 2196 1 1 15 LEU H H 3.588 -0.265 -1.475 1.00 . A A . 15 LEU H 1 1
7 2197 1 1 15 LEU HA H 4.075 -1.873 0.093 1.00 . A A . 15 LEU HA 1 1
7 2198 1 1 15 LEU HB2 H 5.814 -3.032 -2.126 1.00 . A A . 15 LEU HB2 1 1
7 2199 1 1 15 LEU HB3 H 5.814 -3.741 -0.540 1.00 . A A . 15 LEU HB3 1 1
7 2200 1 1 15 LEU HD11 H 2.686 -3.563 0.193 1.00 . A A . 15 LEU HD11 1 1
7 2201 1 1 15 LEU HD12 H 2.334 -5.142 -0.507 1.00 . A A . 15 LEU HD12 1 1
7 2202 1 1 15 LEU HD13 H 3.793 -4.905 0.481 1.00 . A A . 15 LEU HD13 1 1
7 2203 1 1 15 LEU HD21 H 3.568 -3.132 -3.522 1.00 . A A . 15 LEU HD21 1 1
7 2204 1 1 15 LEU HD22 H 2.233 -4.144 -2.924 1.00 . A A . 15 LEU HD22 1 1
7 2205 1 1 15 LEU HD23 H 2.502 -2.531 -2.227 1.00 . A A . 15 LEU HD23 1 1
7 2206 1 1 15 LEU HG H 4.396 -4.956 -2.061 1.00 . A A . 15 LEU HG 1 1
7 2207 1 1 15 LEU N N 4.530 -0.689 -1.564 1.00 . A A . 15 LEU N 1 1
7 2208 1 1 15 LEU O O 7.017 -1.911 0.610 1.00 . A A . 15 LEU O 1 1
7 2209 1 1 16 ASN C C 8.391 0.713 0.921 1.00 . A A . 16 ASN C 1 1
7 2210 1 1 16 ASN CA C 7.009 0.736 1.681 1.00 . A A . 16 ASN CA 1 1
7 2211 1 1 16 ASN CB C 6.943 0.165 3.111 1.00 . A A . 16 ASN CB 1 1
7 2212 1 1 16 ASN CG C 7.748 0.910 4.192 1.00 . A A . 16 ASN CG 1 1
7 2213 1 1 16 ASN H H 5.106 0.631 0.643 1.00 . A A . 16 ASN H 1 1
7 2214 1 1 16 ASN HA H 6.722 1.784 1.794 1.00 . A A . 16 ASN HA 1 1
7 2215 1 1 16 ASN HB2 H 5.876 0.103 3.407 1.00 . A A . 16 ASN HB2 1 1
7 2216 1 1 16 ASN HB3 H 7.294 -0.867 3.061 1.00 . A A . 16 ASN HB3 1 1
7 2217 1 1 16 ASN HD21 H 7.748 2.446 5.481 1.00 . A A . 16 ASN HD21 1 1
7 2218 1 1 16 ASN HD22 H 6.255 2.227 4.437 1.00 . A A . 16 ASN HD22 1 1
7 2219 1 1 16 ASN N N 5.961 0.090 0.836 1.00 . A A . 16 ASN N 1 1
7 2220 1 1 16 ASN ND2 N 7.193 1.969 4.762 1.00 . A A . 16 ASN ND2 1 1
7 2221 1 1 16 ASN O O 9.436 0.462 1.527 1.00 . A A . 16 ASN O 1 1
7 2222 1 1 16 ASN OD1 O 8.870 0.532 4.527 1.00 . A A . 16 ASN OD1 1 1
7 2223 1 1 17 GLU C C 10.210 -0.451 -1.336 1.00 . A A . 17 GLU C 1 1
7 2224 1 1 17 GLU CA C 9.564 0.981 -1.311 1.00 . A A . 17 GLU CA 1 1
7 2225 1 1 17 GLU CB C 10.514 2.172 -1.055 1.00 . A A . 17 GLU CB 1 1
7 2226 1 1 17 GLU CD C 10.752 4.718 -0.826 1.00 . A A . 17 GLU CD 1 1
7 2227 1 1 17 GLU CG C 9.871 3.559 -1.292 1.00 . A A . 17 GLU CG 1 1
7 2228 1 1 17 GLU H H 7.436 1.155 -0.835 1.00 . A A . 17 GLU H 1 1
7 2229 1 1 17 GLU HA H 9.200 1.160 -2.326 1.00 . A A . 17 GLU HA 1 1
7 2230 1 1 17 GLU HB2 H 10.871 2.083 -0.026 1.00 . A A . 17 GLU HB2 1 1
7 2231 1 1 17 GLU HB3 H 11.414 2.080 -1.694 1.00 . A A . 17 GLU HB3 1 1
7 2232 1 1 17 GLU HE2 H 11.598 4.555 -2.572 1.00 . A A . 17 GLU HE2 1 1
7 2233 1 1 17 GLU HG2 H 9.627 3.684 -2.364 1.00 . A A . 17 GLU HG2 1 1
7 2234 1 1 17 GLU HG3 H 8.897 3.613 -0.766 1.00 . A A . 17 GLU HG3 1 1
7 2235 1 1 17 GLU N N 8.370 0.981 -0.421 1.00 . A A . 17 GLU N 1 1
7 2236 1 1 17 GLU O O 11.421 -0.590 -1.139 1.00 . A A . 17 GLU O 1 1
7 2237 1 1 17 GLU OE1 O 10.642 5.251 0.278 1.00 . A A . 17 GLU OE1 1 1
7 2238 1 1 17 GLU OE2 O 11.668 5.089 -1.777 1.00 . A A . 17 GLU OE2 1 1
7 2239 1 1 18 HIS C C 10.453 -3.410 -0.269 1.00 . A A . 18 HIS C 1 1
7 2240 1 1 18 HIS CA C 9.826 -2.940 -1.624 1.00 . A A . 18 HIS CA 1 1
7 2241 1 1 18 HIS CB C 10.636 -3.187 -2.913 1.00 . A A . 18 HIS CB 1 1
7 2242 1 1 18 HIS CD2 C 11.391 -5.041 -4.506 1.00 . A A . 18 HIS CD2 1 1
7 2243 1 1 18 HIS CE1 C 10.533 -6.716 -3.572 1.00 . A A . 18 HIS CE1 1 1
7 2244 1 1 18 HIS CG C 10.720 -4.640 -3.347 1.00 . A A . 18 HIS CG 1 1
7 2245 1 1 18 HIS H H 8.388 -1.312 -1.732 1.00 . A A . 18 HIS H 1 1
7 2246 1 1 18 HIS HA H 8.900 -3.531 -1.760 1.00 . A A . 18 HIS HA 1 1
7 2247 1 1 18 HIS HB2 H 10.141 -2.622 -3.727 1.00 . A A . 18 HIS HB2 1 1
7 2248 1 1 18 HIS HB3 H 11.655 -2.763 -2.837 1.00 . A A . 18 HIS HB3 1 1
7 2249 1 1 18 HIS HD2 H 11.892 -4.354 -5.170 1.00 . A A . 18 HIS HD2 1 1
7 2250 1 1 18 HIS HE1 H 10.248 -7.742 -3.386 1.00 . A A . 18 HIS HE1 1 1
7 2251 1 1 18 HIS HE2 H 11.650 -7.012 -5.419 1.00 . A A . 18 HIS HE2 1 1
7 2252 1 1 18 HIS N N 9.386 -1.516 -1.575 1.00 . A A . 18 HIS N 1 1
7 2253 1 1 18 HIS ND1 N 10.133 -5.725 -2.706 1.00 . A A . 18 HIS ND1 1 1
7 2254 1 1 18 HIS NE2 N 11.287 -6.407 -4.674 1.00 . A A . 18 HIS NE2 1 1
7 2255 1 1 18 HIS O O 11.653 -3.680 -0.167 1.00 . A A . 18 HIS O 1 1
7 2256 1 1 19 ALA C C 8.642 -4.482 2.738 1.00 . A A . 19 ALA C 1 1
7 2257 1 1 19 ALA CA C 9.935 -3.876 2.134 1.00 . A A . 19 ALA CA 1 1
7 2258 1 1 19 ALA CB C 10.661 -2.715 2.874 1.00 . A A . 19 ALA CB 1 1
7 2259 1 1 19 ALA H H 8.611 -3.309 0.531 1.00 . A A . 19 ALA H 1 1
7 2260 1 1 19 ALA HA H 10.619 -4.710 2.130 1.00 . A A . 19 ALA HA 1 1
7 2261 1 1 19 ALA HB1 H 11.601 -2.426 2.368 1.00 . A A . 19 ALA HB1 1 1
7 2262 1 1 19 ALA HB2 H 10.034 -1.806 2.946 1.00 . A A . 19 ALA HB2 1 1
7 2263 1 1 19 ALA HB3 H 10.932 -3.006 3.906 1.00 . A A . 19 ALA HB3 1 1
7 2264 1 1 19 ALA N N 9.590 -3.469 0.763 1.00 . A A . 19 ALA N 1 1
7 2265 1 1 19 ALA O O 8.187 -5.556 2.327 1.00 . A A . 19 ALA O 1 1
7 2266 1 1 20 HIS C C 5.570 -3.914 3.534 1.00 . A A . 20 HIS C 1 1
7 2267 1 1 20 HIS CA C 6.830 -4.161 4.419 1.00 . A A . 20 HIS CA 1 1
7 2268 1 1 20 HIS CB C 6.778 -3.384 5.760 1.00 . A A . 20 HIS CB 1 1
7 2269 1 1 20 HIS CD2 C 5.519 -3.315 7.993 1.00 . A A . 20 HIS CD2 1 1
7 2270 1 1 20 HIS CE1 C 4.437 -5.112 7.872 1.00 . A A . 20 HIS CE1 1 1
7 2271 1 1 20 HIS CG C 5.788 -3.942 6.772 1.00 . A A . 20 HIS CG 1 1
7 2272 1 1 20 HIS H H 8.789 -3.139 4.054 1.00 . A A . 20 HIS H 1 1
7 2273 1 1 20 HIS HA H 6.928 -5.229 4.684 1.00 . A A . 20 HIS HA 1 1
7 2274 1 1 20 HIS HB2 H 7.763 -3.384 6.265 1.00 . A A . 20 HIS HB2 1 1
7 2275 1 1 20 HIS HB3 H 6.562 -2.315 5.568 1.00 . A A . 20 HIS HB3 1 1
7 2276 1 1 20 HIS HD2 H 6.000 -2.404 8.314 1.00 . A A . 20 HIS HD2 1 1
7 2277 1 1 20 HIS HE1 H 3.777 -5.923 8.146 1.00 . A A . 20 HIS HE1 1 1
7 2278 1 1 20 HIS HE2 H 4.238 -3.898 9.668 1.00 . A A . 20 HIS HE2 1 1
7 2279 1 1 20 HIS N N 8.068 -3.769 3.703 1.00 . A A . 20 HIS N 1 1
7 2280 1 1 20 HIS ND1 N 5.103 -5.147 6.668 1.00 . A A . 20 HIS ND1 1 1
7 2281 1 1 20 HIS NE2 N 4.619 -4.060 8.729 1.00 . A A . 20 HIS NE2 1 1
7 2282 1 1 20 HIS O O 5.215 -2.783 3.197 1.00 . A A . 20 HIS O 1 1
8 2283 1 1 1 SER C C -14.336 0.080 0.515 1.00 . A A . 1 SER C 1 1
8 2284 1 1 1 SER CA C -14.904 -0.687 1.756 1.00 . A A . 1 SER CA 1 1
8 2285 1 1 1 SER CB C -14.978 0.177 3.037 1.00 . A A . 1 SER CB 1 1
8 2286 1 1 1 SER H1 H -13.130 -1.782 2.436 1.00 . A A . 1 SER H1 1 1
8 2287 1 1 1 SER HA H -15.941 -0.984 1.501 1.00 . A A . 1 SER HA 1 1
8 2288 1 1 1 SER HB2 H -15.204 -0.452 3.920 1.00 . A A . 1 SER HB2 1 1
8 2289 1 1 1 SER HB3 H -14.006 0.667 3.246 1.00 . A A . 1 SER HB3 1 1
8 2290 1 1 1 SER HG H -15.738 1.713 2.164 1.00 . A A . 1 SER HG 1 1
8 2291 1 1 1 SER N N -14.098 -1.884 2.126 1.00 . A A . 1 SER N 1 1
8 2292 1 1 1 SER O O -14.277 1.314 0.501 1.00 . A A . 1 SER O 1 1
8 2293 1 1 1 SER OG O -15.988 1.173 2.917 1.00 . A A . 1 SER OG 1 1
8 2294 1 1 2 ASP C C -12.111 0.726 -1.630 1.00 . A A . 2 ASP C 1 1
8 2295 1 1 2 ASP CA C -13.395 -0.150 -1.824 1.00 . A A . 2 ASP CA 1 1
8 2296 1 1 2 ASP CB C -14.562 0.498 -2.635 1.00 . A A . 2 ASP CB 1 1
8 2297 1 1 2 ASP CG C -14.228 0.844 -4.091 1.00 . A A . 2 ASP CG 1 1
8 2298 1 1 2 ASP H H -13.929 -1.663 -0.334 1.00 . A A . 2 ASP H 1 1
8 2299 1 1 2 ASP HA H -13.038 -1.048 -2.380 1.00 . A A . 2 ASP HA 1 1
8 2300 1 1 2 ASP HB2 H -15.499 -0.107 -2.638 1.00 . A A . 2 ASP HB2 1 1
8 2301 1 1 2 ASP HB3 H -14.861 1.406 -2.090 1.00 . A A . 2 ASP HB3 1 1
8 2302 1 1 2 ASP HD2 H -14.066 -0.037 -5.819 1.00 . A A . 2 ASP HD2 1 1
8 2303 1 1 2 ASP N N -13.959 -0.669 -0.547 1.00 . A A . 2 ASP N 1 1
8 2304 1 1 2 ASP O O -12.100 1.927 -1.918 1.00 . A A . 2 ASP O 1 1
8 2305 1 1 2 ASP OD1 O -13.950 1.981 -4.472 1.00 . A A . 2 ASP OD1 1 1
8 2306 1 1 2 ASP OD2 O -14.276 -0.256 -4.908 1.00 . A A . 2 ASP OD2 1 1
8 2307 1 1 3 THR C C -8.512 -0.138 -1.394 1.00 . A A . 3 THR C 1 1
8 2308 1 1 3 THR CA C -9.722 0.708 -0.873 1.00 . A A . 3 THR CA 1 1
8 2309 1 1 3 THR CB C -9.676 1.078 0.641 1.00 . A A . 3 THR CB 1 1
8 2310 1 1 3 THR CG2 C -9.364 -0.060 1.626 1.00 . A A . 3 THR CG2 1 1
8 2311 1 1 3 THR H H -11.232 -0.828 -0.733 1.00 . A A . 3 THR H 1 1
8 2312 1 1 3 THR HA H -9.693 1.638 -1.434 1.00 . A A . 3 THR HA 1 1
8 2313 1 1 3 THR HB H -10.662 1.489 0.925 1.00 . A A . 3 THR HB 1 1
8 2314 1 1 3 THR HG1 H -7.865 1.712 0.602 1.00 . A A . 3 THR HG1 1 1
8 2315 1 1 3 THR HG21 H -10.038 -0.920 1.471 1.00 . A A . 3 THR HG21 1 1
8 2316 1 1 3 THR HG22 H -9.469 0.285 2.668 1.00 . A A . 3 THR HG22 1 1
8 2317 1 1 3 THR HG23 H -8.326 -0.426 1.514 1.00 . A A . 3 THR HG23 1 1
8 2318 1 1 3 THR N N -11.037 0.079 -1.137 1.00 . A A . 3 THR N 1 1
8 2319 1 1 3 THR O O -7.447 -0.149 -0.768 1.00 . A A . 3 THR O 1 1
8 2320 1 1 3 THR OG1 O -8.710 2.097 0.844 1.00 . A A . 3 THR OG1 1 1
8 2321 1 1 4 ARG C C -6.301 -0.888 -3.698 1.00 . A A . 4 ARG C 1 1
8 2322 1 1 4 ARG CA C -7.552 -1.619 -3.165 1.00 . A A . 4 ARG CA 1 1
8 2323 1 1 4 ARG CB C -8.113 -2.620 -4.224 1.00 . A A . 4 ARG CB 1 1
8 2324 1 1 4 ARG CD C -9.311 -4.299 -2.615 1.00 . A A . 4 ARG CD 1 1
8 2325 1 1 4 ARG CG C -9.395 -3.425 -3.882 1.00 . A A . 4 ARG CG 1 1
8 2326 1 1 4 ARG CZ C -11.541 -4.535 -1.470 1.00 . A A . 4 ARG CZ 1 1
8 2327 1 1 4 ARG H H -9.541 -0.696 -3.020 1.00 . A A . 4 ARG H 1 1
8 2328 1 1 4 ARG HA H -7.150 -2.135 -2.256 1.00 . A A . 4 ARG HA 1 1
8 2329 1 1 4 ARG HB2 H -8.321 -2.070 -5.165 1.00 . A A . 4 ARG HB2 1 1
8 2330 1 1 4 ARG HB3 H -7.321 -3.339 -4.510 1.00 . A A . 4 ARG HB3 1 1
8 2331 1 1 4 ARG HD2 H -8.531 -5.069 -2.754 1.00 . A A . 4 ARG HD2 1 1
8 2332 1 1 4 ARG HD3 H -8.977 -3.699 -1.748 1.00 . A A . 4 ARG HD3 1 1
8 2333 1 1 4 ARG HG2 H -10.243 -2.719 -3.789 1.00 . A A . 4 ARG HG2 1 1
8 2334 1 1 4 ARG HG3 H -9.650 -4.062 -4.750 1.00 . A A . 4 ARG HG3 1 1
8 2335 1 1 4 ARG HH11 H -12.231 -3.169 -0.164 1.00 . A A . 4 ARG HH11 1 1
8 2336 1 1 4 ARG HH12 H -10.586 -2.853 -0.914 1.00 . A A . 4 ARG HH12 1 1
8 2337 1 1 4 ARG HH21 H -12.691 -6.128 -1.858 1.00 . A A . 4 ARG HH21 1 1
8 2338 1 1 4 ARG HH22 H -13.338 -4.895 -0.663 1.00 . A A . 4 ARG HH22 1 1
8 2339 1 1 4 ARG N N -8.630 -0.778 -2.577 1.00 . A A . 4 ARG N 1 1
8 2340 1 1 4 ARG NE N -10.596 -4.986 -2.321 1.00 . A A . 4 ARG NE 1 1
8 2341 1 1 4 ARG NH1 N -11.443 -3.402 -0.778 1.00 . A A . 4 ARG NH1 1 1
8 2342 1 1 4 ARG NH2 N -12.634 -5.259 -1.315 1.00 . A A . 4 ARG NH2 1 1
8 2343 1 1 4 ARG O O -5.251 -1.533 -3.783 1.00 . A A . 4 ARG O 1 1
8 2344 1 1 5 TYR C C -4.567 1.853 -3.225 1.00 . A A . 5 TYR C 1 1
8 2345 1 1 5 TYR CA C -5.207 1.199 -4.540 1.00 . A A . 5 TYR CA 1 1
8 2346 1 1 5 TYR CB C -5.673 2.216 -5.616 1.00 . A A . 5 TYR CB 1 1
8 2347 1 1 5 TYR CD1 C -3.897 2.139 -7.445 1.00 . A A . 5 TYR CD1 1 1
8 2348 1 1 5 TYR CD2 C -4.136 4.178 -6.172 1.00 . A A . 5 TYR CD2 1 1
8 2349 1 1 5 TYR CE1 C -2.870 2.722 -8.184 1.00 . A A . 5 TYR CE1 1 1
8 2350 1 1 5 TYR CE2 C -3.109 4.759 -6.912 1.00 . A A . 5 TYR CE2 1 1
8 2351 1 1 5 TYR CG C -4.536 2.861 -6.429 1.00 . A A . 5 TYR CG 1 1
8 2352 1 1 5 TYR CZ C -2.476 4.032 -7.917 1.00 . A A . 5 TYR CZ 1 1
8 2353 1 1 5 TYR H H -7.207 0.871 -3.726 1.00 . A A . 5 TYR H 1 1
8 2354 1 1 5 TYR HA H -4.494 0.505 -4.988 1.00 . A A . 5 TYR HA 1 1
8 2355 1 1 5 TYR HB2 H -6.364 1.712 -6.319 1.00 . A A . 5 TYR HB2 1 1
8 2356 1 1 5 TYR HB3 H -6.303 2.995 -5.143 1.00 . A A . 5 TYR HB3 1 1
8 2357 1 1 5 TYR HD1 H -4.192 1.123 -7.663 1.00 . A A . 5 TYR HD1 1 1
8 2358 1 1 5 TYR HD2 H -4.617 4.757 -5.396 1.00 . A A . 5 TYR HD2 1 1
8 2359 1 1 5 TYR HE1 H -2.382 2.156 -8.964 1.00 . A A . 5 TYR HE1 1 1
8 2360 1 1 5 TYR HE2 H -2.806 5.775 -6.703 1.00 . A A . 5 TYR HE2 1 1
8 2361 1 1 5 TYR HH H -1.144 3.970 -9.290 1.00 . A A . 5 TYR HH 1 1
8 2362 1 1 5 TYR N N -6.397 0.401 -4.101 1.00 . A A . 5 TYR N 1 1
8 2363 1 1 5 TYR O O -4.187 3.023 -3.139 1.00 . A A . 5 TYR O 1 1
8 2364 1 1 5 TYR OH O -1.464 4.605 -8.646 1.00 . A A . 5 TYR OH 1 1
8 2365 1 1 6 ASN C C -4.226 2.110 0.029 1.00 . A A . 6 ASN C 1 1
8 2366 1 1 6 ASN CA C -4.063 0.967 -0.892 1.00 . A A . 6 ASN CA 1 1
8 2367 1 1 6 ASN CB C -2.913 0.039 -0.530 1.00 . A A . 6 ASN CB 1 1
8 2368 1 1 6 ASN CG C -2.489 -1.142 -1.434 1.00 . A A . 6 ASN CG 1 1
8 2369 1 1 6 ASN H H -4.786 0.027 -2.244 1.00 . A A . 6 ASN H 1 1
8 2370 1 1 6 ASN HA H -4.828 0.246 -0.498 1.00 . A A . 6 ASN HA 1 1
8 2371 1 1 6 ASN HB2 H -2.099 0.693 -0.352 1.00 . A A . 6 ASN HB2 1 1
8 2372 1 1 6 ASN HB3 H -3.141 -0.320 0.489 1.00 . A A . 6 ASN HB3 1 1
8 2373 1 1 6 ASN HD21 H -2.780 -3.083 -1.845 1.00 . A A . 6 ASN HD21 1 1
8 2374 1 1 6 ASN HD22 H -3.778 -2.352 -0.489 1.00 . A A . 6 ASN HD22 1 1
8 2375 1 1 6 ASN N N -4.487 0.975 -2.215 1.00 . A A . 6 ASN N 1 1
8 2376 1 1 6 ASN ND2 N -3.074 -2.313 -1.234 1.00 . A A . 6 ASN ND2 1 1
8 2377 1 1 6 ASN O O -3.245 2.569 0.616 1.00 . A A . 6 ASN O 1 1
8 2378 1 1 6 ASN OD1 O -1.638 -1.004 -2.312 1.00 . A A . 6 ASN OD1 1 1
8 2379 1 1 7 LYS C C -5.269 2.843 2.660 1.00 . A A . 7 LYS C 1 1
8 2380 1 1 7 LYS CA C -5.614 3.650 1.264 1.00 . A A . 7 LYS CA 1 1
8 2381 1 1 7 LYS CB C -6.827 4.575 1.346 1.00 . A A . 7 LYS CB 1 1
8 2382 1 1 7 LYS CD C -6.582 5.877 -0.933 1.00 . A A . 7 LYS CD 1 1
8 2383 1 1 7 LYS CE C -6.173 7.264 -0.401 1.00 . A A . 7 LYS CE 1 1
8 2384 1 1 7 LYS CG C -7.476 5.058 0.025 1.00 . A A . 7 LYS CG 1 1
8 2385 1 1 7 LYS H H -6.071 2.460 -0.631 1.00 . A A . 7 LYS H 1 1
8 2386 1 1 7 LYS HA H -4.813 4.381 1.070 1.00 . A A . 7 LYS HA 1 1
8 2387 1 1 7 LYS HB2 H -7.566 4.099 1.997 1.00 . A A . 7 LYS HB2 1 1
8 2388 1 1 7 LYS HB3 H -6.461 5.458 1.913 1.00 . A A . 7 LYS HB3 1 1
8 2389 1 1 7 LYS HD2 H -5.683 5.288 -1.195 1.00 . A A . 7 LYS HD2 1 1
8 2390 1 1 7 LYS HD3 H -7.132 6.003 -1.885 1.00 . A A . 7 LYS HD3 1 1
8 2391 1 1 7 LYS HE2 H -7.069 7.858 -0.142 1.00 . A A . 7 LYS HE2 1 1
8 2392 1 1 7 LYS HE3 H -5.585 7.167 0.530 1.00 . A A . 7 LYS HE3 1 1
8 2393 1 1 7 LYS HG2 H -7.859 4.179 -0.525 1.00 . A A . 7 LYS HG2 1 1
8 2394 1 1 7 LYS HG3 H -8.380 5.648 0.269 1.00 . A A . 7 LYS HG3 1 1
8 2395 1 1 7 LYS HZ2 H -5.142 8.939 -1.029 1.00 . A A . 7 LYS HZ2 1 1
8 2396 1 1 7 LYS HZ3 H -5.927 8.170 -2.239 1.00 . A A . 7 LYS HZ3 1 1
8 2397 1 1 7 LYS N N -5.478 2.599 0.204 1.00 . A A . 7 LYS N 1 1
8 2398 1 1 7 LYS NZ N -5.373 8.007 -1.391 1.00 . A A . 7 LYS NZ 1 1
8 2399 1 1 7 LYS O O -5.031 3.476 3.690 1.00 . A A . 7 LYS O 1 1
8 2400 1 1 8 SER C C -3.265 0.513 3.610 1.00 . A A . 8 SER C 1 1
8 2401 1 1 8 SER CA C -4.835 0.514 3.682 1.00 . A A . 8 SER CA 1 1
8 2402 1 1 8 SER CB C -5.494 -0.854 3.471 1.00 . A A . 8 SER CB 1 1
8 2403 1 1 8 SER H H -5.531 1.019 1.728 1.00 . A A . 8 SER H 1 1
8 2404 1 1 8 SER HA H -5.217 0.858 4.591 1.00 . A A . 8 SER HA 1 1
8 2405 1 1 8 SER HB2 H -6.598 -0.763 3.430 1.00 . A A . 8 SER HB2 1 1
8 2406 1 1 8 SER HB3 H -5.166 -1.266 2.510 1.00 . A A . 8 SER HB3 1 1
8 2407 1 1 8 SER HG H -5.579 -2.580 4.313 1.00 . A A . 8 SER HG 1 1
8 2408 1 1 8 SER N N -5.207 1.441 2.624 1.00 . A A . 8 SER N 1 1
8 2409 1 1 8 SER O O -2.637 -0.233 2.849 1.00 . A A . 8 SER O 1 1
8 2410 1 1 8 SER OG O -5.142 -1.750 4.518 1.00 . A A . 8 SER OG 1 1
8 2411 1 1 9 PHE C C -0.470 2.632 3.513 1.00 . A A . 9 PHE C 1 1
8 2412 1 1 9 PHE CA C -1.195 1.654 4.470 1.00 . A A . 9 PHE CA 1 1
8 2413 1 1 9 PHE CB C -0.424 0.416 5.003 1.00 . A A . 9 PHE CB 1 1
8 2414 1 1 9 PHE CD1 C 0.709 1.681 6.978 1.00 . A A . 9 PHE CD1 1 1
8 2415 1 1 9 PHE CD2 C 0.504 -0.722 7.061 1.00 . A A . 9 PHE CD2 1 1
8 2416 1 1 9 PHE CE1 C 1.330 1.670 8.224 1.00 . A A . 9 PHE CE1 1 1
8 2417 1 1 9 PHE CE2 C 1.134 -0.732 8.303 1.00 . A A . 9 PHE CE2 1 1
8 2418 1 1 9 PHE CG C 0.274 0.485 6.386 1.00 . A A . 9 PHE CG 1 1
8 2419 1 1 9 PHE CZ C 1.544 0.464 8.884 1.00 . A A . 9 PHE CZ 1 1
8 2420 1 1 9 PHE H H -3.102 1.892 5.142 1.00 . A A . 9 PHE H 1 1
8 2421 1 1 9 PHE HA H -1.298 2.303 5.274 1.00 . A A . 9 PHE HA 1 1
8 2422 1 1 9 PHE HB2 H -1.162 -0.405 5.058 1.00 . A A . 9 PHE HB2 1 1
8 2423 1 1 9 PHE HB3 H 0.308 0.109 4.248 1.00 . A A . 9 PHE HB3 1 1
8 2424 1 1 9 PHE HD1 H 0.580 2.629 6.478 1.00 . A A . 9 PHE HD1 1 1
8 2425 1 1 9 PHE HD2 H 0.197 -1.664 6.627 1.00 . A A . 9 PHE HD2 1 1
8 2426 1 1 9 PHE HE1 H 1.662 2.596 8.671 1.00 . A A . 9 PHE HE1 1 1
8 2427 1 1 9 PHE HE2 H 1.306 -1.668 8.814 1.00 . A A . 9 PHE HE2 1 1
8 2428 1 1 9 PHE HZ H 2.035 0.455 9.846 1.00 . A A . 9 PHE HZ 1 1
8 2429 1 1 9 PHE N N -2.639 1.437 4.361 1.00 . A A . 9 PHE N 1 1
8 2430 1 1 9 PHE O O 0.755 2.744 3.562 1.00 . A A . 9 PHE O 1 1
8 2431 1 1 10 ILE C C 0.039 3.620 0.739 1.00 . A A . 10 ILE C 1 1
8 2432 1 1 10 ILE CA C -0.750 4.486 1.781 1.00 . A A . 10 ILE CA 1 1
8 2433 1 1 10 ILE CB C -0.017 5.720 2.398 1.00 . A A . 10 ILE CB 1 1
8 2434 1 1 10 ILE CD1 C -0.101 7.382 4.415 1.00 . A A . 10 ILE CD1 1 1
8 2435 1 1 10 ILE CG1 C -0.884 6.474 3.453 1.00 . A A . 10 ILE CG1 1 1
8 2436 1 1 10 ILE CG2 C 0.480 6.709 1.312 1.00 . A A . 10 ILE CG2 1 1
8 2437 1 1 10 ILE H H -2.229 3.289 2.884 1.00 . A A . 10 ILE H 1 1
8 2438 1 1 10 ILE HA H -1.686 4.906 1.399 1.00 . A A . 10 ILE HA 1 1
8 2439 1 1 10 ILE HB H 0.859 5.306 2.903 1.00 . A A . 10 ILE HB 1 1
8 2440 1 1 10 ILE HD11 H 0.404 8.211 3.887 1.00 . A A . 10 ILE HD11 1 1
8 2441 1 1 10 ILE HD12 H 0.672 6.818 4.969 1.00 . A A . 10 ILE HD12 1 1
8 2442 1 1 10 ILE HD13 H -0.773 7.837 5.165 1.00 . A A . 10 ILE HD13 1 1
8 2443 1 1 10 ILE HG12 H -1.671 7.069 2.946 1.00 . A A . 10 ILE HG12 1 1
8 2444 1 1 10 ILE HG13 H -1.431 5.738 4.076 1.00 . A A . 10 ILE HG13 1 1
8 2445 1 1 10 ILE HG21 H 1.151 6.222 0.581 1.00 . A A . 10 ILE HG21 1 1
8 2446 1 1 10 ILE HG22 H -0.358 7.148 0.739 1.00 . A A . 10 ILE HG22 1 1
8 2447 1 1 10 ILE HG23 H 1.056 7.546 1.744 1.00 . A A . 10 ILE HG23 1 1
8 2448 1 1 10 ILE N N -1.234 3.468 2.770 1.00 . A A . 10 ILE N 1 1
8 2449 1 1 10 ILE O O 1.269 3.553 0.821 1.00 . A A . 10 ILE O 1 1
8 2450 1 1 11 ASN C C 0.628 0.827 -0.436 1.00 . A A . 11 ASN C 1 1
8 2451 1 1 11 ASN CA C -0.073 2.027 -1.196 1.00 . A A . 11 ASN CA 1 1
8 2452 1 1 11 ASN CB C 0.628 2.897 -2.264 1.00 . A A . 11 ASN CB 1 1
8 2453 1 1 11 ASN CG C 1.332 2.207 -3.441 1.00 . A A . 11 ASN CG 1 1
8 2454 1 1 11 ASN H H -1.472 3.386 -0.587 1.00 . A A . 11 ASN H 1 1
8 2455 1 1 11 ASN HA H -0.888 1.587 -1.772 1.00 . A A . 11 ASN HA 1 1
8 2456 1 1 11 ASN HB2 H -0.109 3.603 -2.695 1.00 . A A . 11 ASN HB2 1 1
8 2457 1 1 11 ASN HB3 H 1.312 3.546 -1.723 1.00 . A A . 11 ASN HB3 1 1
8 2458 1 1 11 ASN HD21 H 1.068 1.130 -5.114 1.00 . A A . 11 ASN HD21 1 1
8 2459 1 1 11 ASN HD22 H -0.432 1.563 -4.150 1.00 . A A . 11 ASN HD22 1 1
8 2460 1 1 11 ASN N N -0.664 2.915 -0.186 1.00 . A A . 11 ASN N 1 1
8 2461 1 1 11 ASN ND2 N 0.579 1.568 -4.325 1.00 . A A . 11 ASN ND2 1 1
8 2462 1 1 11 ASN O O 1.648 0.385 -0.966 1.00 . A A . 11 ASN O 1 1
8 2463 1 1 11 ASN OD1 O 2.550 2.280 -3.587 1.00 . A A . 11 ASN OD1 1 1
8 2464 1 1 12 ASN C C 2.307 -0.461 1.804 1.00 . A A . 12 ASN C 1 1
8 2465 1 1 12 ASN CA C 0.848 -0.886 1.426 1.00 . A A . 12 ASN CA 1 1
8 2466 1 1 12 ASN CB C 0.650 -2.200 0.638 1.00 . A A . 12 ASN CB 1 1
8 2467 1 1 12 ASN CG C 1.030 -3.501 1.370 1.00 . A A . 12 ASN CG 1 1
8 2468 1 1 12 ASN H H -0.831 0.486 1.136 1.00 . A A . 12 ASN H 1 1
8 2469 1 1 12 ASN HA H 0.356 -1.095 2.358 1.00 . A A . 12 ASN HA 1 1
8 2470 1 1 12 ASN HB2 H -0.407 -2.253 0.309 1.00 . A A . 12 ASN HB2 1 1
8 2471 1 1 12 ASN HB3 H 1.236 -2.128 -0.283 1.00 . A A . 12 ASN HB3 1 1
8 2472 1 1 12 ASN HD21 H 0.392 -4.935 2.620 1.00 . A A . 12 ASN HD21 1 1
8 2473 1 1 12 ASN HD22 H -0.792 -3.597 2.204 1.00 . A A . 12 ASN HD22 1 1
8 2474 1 1 12 ASN N N 0.124 0.241 0.739 1.00 . A A . 12 ASN N 1 1
8 2475 1 1 12 ASN ND2 N 0.116 -4.069 2.144 1.00 . A A . 12 ASN ND2 1 1
8 2476 1 1 12 ASN O O 3.259 -1.183 1.502 1.00 . A A . 12 ASN O 1 1
8 2477 1 1 12 ASN OD1 O 2.144 -4.007 1.242 1.00 . A A . 12 ASN OD1 1 1
8 2478 1 1 13 LYS C C 4.576 1.603 1.602 1.00 . A A . 13 LYS C 1 1
8 2479 1 1 13 LYS CA C 3.769 1.302 2.910 1.00 . A A . 13 LYS CA 1 1
8 2480 1 1 13 LYS CB C 4.528 0.442 3.964 1.00 . A A . 13 LYS CB 1 1
8 2481 1 1 13 LYS CD C 4.515 1.567 6.334 1.00 . A A . 13 LYS CD 1 1
8 2482 1 1 13 LYS CE C 4.135 3.020 5.986 1.00 . A A . 13 LYS CE 1 1
8 2483 1 1 13 LYS CG C 3.957 0.473 5.398 1.00 . A A . 13 LYS CG 1 1
8 2484 1 1 13 LYS H H 1.621 1.294 2.571 1.00 . A A . 13 LYS H 1 1
8 2485 1 1 13 LYS HA H 3.565 2.274 3.375 1.00 . A A . 13 LYS HA 1 1
8 2486 1 1 13 LYS HB2 H 4.562 -0.607 3.618 1.00 . A A . 13 LYS HB2 1 1
8 2487 1 1 13 LYS HB3 H 5.587 0.750 4.009 1.00 . A A . 13 LYS HB3 1 1
8 2488 1 1 13 LYS HD2 H 4.157 1.336 7.354 1.00 . A A . 13 LYS HD2 1 1
8 2489 1 1 13 LYS HD3 H 5.616 1.475 6.383 1.00 . A A . 13 LYS HD3 1 1
8 2490 1 1 13 LYS HE2 H 4.617 3.328 5.041 1.00 . A A . 13 LYS HE2 1 1
8 2491 1 1 13 LYS HE3 H 3.045 3.111 5.825 1.00 . A A . 13 LYS HE3 1 1
8 2492 1 1 13 LYS HG2 H 2.855 0.516 5.366 1.00 . A A . 13 LYS HG2 1 1
8 2493 1 1 13 LYS HG3 H 4.179 -0.503 5.868 1.00 . A A . 13 LYS HG3 1 1
8 2494 1 1 13 LYS HZ2 H 5.563 3.936 7.162 1.00 . A A . 13 LYS HZ2 1 1
8 2495 1 1 13 LYS HZ3 H 4.313 4.918 6.778 1.00 . A A . 13 LYS HZ3 1 1
8 2496 1 1 13 LYS N N 2.460 0.710 2.490 1.00 . A A . 13 LYS N 1 1
8 2497 1 1 13 LYS NZ N 4.543 3.955 7.049 1.00 . A A . 13 LYS NZ 1 1
8 2498 1 1 13 LYS O O 5.791 1.394 1.591 1.00 . A A . 13 LYS O 1 1
8 2499 1 1 14 HIS C C 5.287 1.095 -1.309 1.00 . A A . 14 HIS C 1 1
8 2500 1 1 14 HIS CA C 4.622 2.428 -0.787 1.00 . A A . 14 HIS CA 1 1
8 2501 1 1 14 HIS CB C 5.516 3.686 -0.684 1.00 . A A . 14 HIS CB 1 1
8 2502 1 1 14 HIS CD2 C 6.620 5.472 -2.149 1.00 . A A . 14 HIS CD2 1 1
8 2503 1 1 14 HIS CE1 C 5.906 4.900 -4.041 1.00 . A A . 14 HIS CE1 1 1
8 2504 1 1 14 HIS CG C 5.825 4.329 -2.025 1.00 . A A . 14 HIS CG 1 1
8 2505 1 1 14 HIS H H 2.989 2.549 0.686 1.00 . A A . 14 HIS H 1 1
8 2506 1 1 14 HIS HA H 3.847 2.670 -1.507 1.00 . A A . 14 HIS HA 1 1
8 2507 1 1 14 HIS HB2 H 5.006 4.448 -0.064 1.00 . A A . 14 HIS HB2 1 1
8 2508 1 1 14 HIS HB3 H 6.460 3.462 -0.153 1.00 . A A . 14 HIS HB3 1 1
8 2509 1 1 14 HIS HD2 H 7.074 5.974 -1.308 1.00 . A A . 14 HIS HD2 1 1
8 2510 1 1 14 HIS HE1 H 5.732 4.908 -5.108 1.00 . A A . 14 HIS HE1 1 1
8 2511 1 1 14 HIS HE2 H 7.177 6.664 -3.897 1.00 . A A . 14 HIS HE2 1 1
8 2512 1 1 14 HIS N N 3.935 2.151 0.512 1.00 . A A . 14 HIS N 1 1
8 2513 1 1 14 HIS ND1 N 5.328 3.927 -3.260 1.00 . A A . 14 HIS ND1 1 1
8 2514 1 1 14 HIS NE2 N 6.695 5.865 -3.470 1.00 . A A . 14 HIS NE2 1 1
8 2515 1 1 14 HIS O O 6.434 1.129 -1.759 1.00 . A A . 14 HIS O 1 1
8 2516 1 1 15 LEU C C 6.278 -1.769 -0.757 1.00 . A A . 15 LEU C 1 1
8 2517 1 1 15 LEU CA C 5.073 -1.408 -1.699 1.00 . A A . 15 LEU CA 1 1
8 2518 1 1 15 LEU CB C 5.341 -1.560 -3.232 1.00 . A A . 15 LEU CB 1 1
8 2519 1 1 15 LEU CD1 C 3.471 -3.283 -3.746 1.00 . A A . 15 LEU CD1 1 1
8 2520 1 1 15 LEU CD2 C 3.091 -0.839 -4.241 1.00 . A A . 15 LEU CD2 1 1
8 2521 1 1 15 LEU CG C 4.152 -1.943 -4.156 1.00 . A A . 15 LEU CG 1 1
8 2522 1 1 15 LEU H H 3.605 -0.021 -0.865 1.00 . A A . 15 LEU H 1 1
8 2523 1 1 15 LEU HA H 4.304 -2.138 -1.456 1.00 . A A . 15 LEU HA 1 1
8 2524 1 1 15 LEU HB2 H 5.835 -0.650 -3.620 1.00 . A A . 15 LEU HB2 1 1
8 2525 1 1 15 LEU HB3 H 6.097 -2.352 -3.384 1.00 . A A . 15 LEU HB3 1 1
8 2526 1 1 15 LEU HD11 H 2.725 -3.629 -4.484 1.00 . A A . 15 LEU HD11 1 1
8 2527 1 1 15 LEU HD12 H 4.194 -4.107 -3.603 1.00 . A A . 15 LEU HD12 1 1
8 2528 1 1 15 LEU HD13 H 2.916 -3.204 -2.786 1.00 . A A . 15 LEU HD13 1 1
8 2529 1 1 15 LEU HD21 H 2.592 -0.669 -3.268 1.00 . A A . 15 LEU HD21 1 1
8 2530 1 1 15 LEU HD22 H 2.303 -1.087 -4.974 1.00 . A A . 15 LEU HD22 1 1
8 2531 1 1 15 LEU HD23 H 3.543 0.118 -4.556 1.00 . A A . 15 LEU HD23 1 1
8 2532 1 1 15 LEU HG H 4.589 -2.019 -5.182 1.00 . A A . 15 LEU HG 1 1
8 2533 1 1 15 LEU N N 4.555 -0.070 -1.274 1.00 . A A . 15 LEU N 1 1
8 2534 1 1 15 LEU O O 7.302 -2.259 -1.246 1.00 . A A . 15 LEU O 1 1
8 2535 1 1 16 ASN C C 8.556 -1.076 1.142 1.00 . A A . 16 ASN C 1 1
8 2536 1 1 16 ASN CA C 7.248 -1.843 1.585 1.00 . A A . 16 ASN CA 1 1
8 2537 1 1 16 ASN CB C 7.343 -3.355 1.868 1.00 . A A . 16 ASN CB 1 1
8 2538 1 1 16 ASN CG C 8.164 -3.764 3.105 1.00 . A A . 16 ASN CG 1 1
8 2539 1 1 16 ASN H H 5.243 -1.268 0.971 1.00 . A A . 16 ASN H 1 1
8 2540 1 1 16 ASN HA H 6.928 -1.417 2.540 1.00 . A A . 16 ASN HA 1 1
8 2541 1 1 16 ASN HB2 H 6.315 -3.765 1.951 1.00 . A A . 16 ASN HB2 1 1
8 2542 1 1 16 ASN HB3 H 7.774 -3.824 0.981 1.00 . A A . 16 ASN HB3 1 1
8 2543 1 1 16 ASN HD21 H 8.135 -4.009 5.096 1.00 . A A . 16 ASN HD21 1 1
8 2544 1 1 16 ASN HD22 H 6.589 -3.423 4.301 1.00 . A A . 16 ASN HD22 1 1
8 2545 1 1 16 ASN N N 6.158 -1.570 0.601 1.00 . A A . 16 ASN N 1 1
8 2546 1 1 16 ASN ND2 N 7.568 -3.728 4.288 1.00 . A A . 16 ASN ND2 1 1
8 2547 1 1 16 ASN O O 9.651 -1.646 1.159 1.00 . A A . 16 ASN O 1 1
8 2548 1 1 16 ASN OD1 O 9.336 -4.123 3.006 1.00 . A A . 16 ASN OD1 1 1
8 2549 1 1 17 GLU C C 10.166 0.520 -1.075 1.00 . A A . 17 GLU C 1 1
8 2550 1 1 17 GLU CA C 9.531 1.086 0.249 1.00 . A A . 17 GLU CA 1 1
8 2551 1 1 17 GLU CB C 10.523 1.478 1.368 1.00 . A A . 17 GLU CB 1 1
8 2552 1 1 17 GLU CD C 10.847 2.477 3.704 1.00 . A A . 17 GLU CD 1 1
8 2553 1 1 17 GLU CG C 9.889 2.278 2.528 1.00 . A A . 17 GLU CG 1 1
8 2554 1 1 17 GLU H H 7.452 0.606 0.725 1.00 . A A . 17 GLU H 1 1
8 2555 1 1 17 GLU HA H 9.080 2.041 -0.031 1.00 . A A . 17 GLU HA 1 1
8 2556 1 1 17 GLU HB2 H 10.974 0.554 1.737 1.00 . A A . 17 GLU HB2 1 1
8 2557 1 1 17 GLU HB3 H 11.357 2.069 0.942 1.00 . A A . 17 GLU HB3 1 1
8 2558 1 1 17 GLU HE2 H 11.408 1.559 5.327 1.00 . A A . 17 GLU HE2 1 1
8 2559 1 1 17 GLU HG2 H 9.555 3.266 2.161 1.00 . A A . 17 GLU HG2 1 1
8 2560 1 1 17 GLU HG3 H 8.966 1.770 2.873 1.00 . A A . 17 GLU HG3 1 1
8 2561 1 1 17 GLU N N 8.414 0.221 0.726 1.00 . A A . 17 GLU N 1 1
8 2562 1 1 17 GLU O O 11.394 0.464 -1.201 1.00 . A A . 17 GLU O 1 1
8 2563 1 1 17 GLU OE1 O 11.567 3.467 3.831 1.00 . A A . 17 GLU OE1 1 1
8 2564 1 1 17 GLU OE2 O 10.806 1.431 4.590 1.00 . A A . 17 GLU OE2 1 1
8 2565 1 1 18 HIS C C 10.703 -1.678 -3.268 1.00 . A A . 18 HIS C 1 1
8 2566 1 1 18 HIS CA C 9.738 -0.454 -3.379 1.00 . A A . 18 HIS CA 1 1
8 2567 1 1 18 HIS CB C 10.187 0.704 -4.303 1.00 . A A . 18 HIS CB 1 1
8 2568 1 1 18 HIS CD2 C 10.535 1.313 -6.766 1.00 . A A . 18 HIS CD2 1 1
8 2569 1 1 18 HIS CE1 C 9.895 -0.463 -7.689 1.00 . A A . 18 HIS CE1 1 1
8 2570 1 1 18 HIS CG C 10.158 0.386 -5.789 1.00 . A A . 18 HIS CG 1 1
8 2571 1 1 18 HIS H H 8.311 0.204 -1.879 1.00 . A A . 18 HIS H 1 1
8 2572 1 1 18 HIS HA H 8.809 -0.839 -3.842 1.00 . A A . 18 HIS HA 1 1
8 2573 1 1 18 HIS HB2 H 9.514 1.569 -4.144 1.00 . A A . 18 HIS HB2 1 1
8 2574 1 1 18 HIS HB3 H 11.194 1.067 -4.021 1.00 . A A . 18 HIS HB3 1 1
8 2575 1 1 18 HIS HD2 H 10.873 2.313 -6.540 1.00 . A A . 18 HIS HD2 1 1
8 2576 1 1 18 HIS HE1 H 9.645 -1.173 -8.464 1.00 . A A . 18 HIS HE1 1 1
8 2577 1 1 18 HIS HE2 H 10.547 1.190 -8.950 1.00 . A A . 18 HIS HE2 1 1
8 2578 1 1 18 HIS N N 9.319 0.109 -2.065 1.00 . A A . 18 HIS N 1 1
8 2579 1 1 18 HIS ND1 N 9.720 -0.800 -6.367 1.00 . A A . 18 HIS ND1 1 1
8 2580 1 1 18 HIS NE2 N 10.378 0.774 -8.027 1.00 . A A . 18 HIS NE2 1 1
8 2581 1 1 18 HIS O O 11.872 -1.597 -3.657 1.00 . A A . 18 HIS O 1 1
8 2582 1 1 19 ALA C C 12.186 -3.939 -1.613 1.00 . A A . 19 ALA C 1 1
8 2583 1 1 19 ALA CA C 10.928 -4.078 -2.525 1.00 . A A . 19 ALA CA 1 1
8 2584 1 1 19 ALA CB C 11.235 -4.785 -3.865 1.00 . A A . 19 ALA CB 1 1
8 2585 1 1 19 ALA H H 9.194 -2.717 -2.452 1.00 . A A . 19 ALA H 1 1
8 2586 1 1 19 ALA HA H 10.218 -4.753 -2.009 1.00 . A A . 19 ALA HA 1 1
8 2587 1 1 19 ALA HB1 H 11.938 -4.207 -4.494 1.00 . A A . 19 ALA HB1 1 1
8 2588 1 1 19 ALA HB2 H 11.689 -5.780 -3.702 1.00 . A A . 19 ALA HB2 1 1
8 2589 1 1 19 ALA HB3 H 10.318 -4.947 -4.462 1.00 . A A . 19 ALA HB3 1 1
8 2590 1 1 19 ALA N N 10.181 -2.802 -2.724 1.00 . A A . 19 ALA N 1 1
8 2591 1 1 19 ALA O O 13.287 -3.659 -2.100 1.00 . A A . 19 ALA O 1 1
8 2592 1 1 20 HIS C C 13.973 -5.348 0.694 1.00 . A A . 20 HIS C 1 1
8 2593 1 1 20 HIS CA C 13.111 -4.050 0.700 1.00 . A A . 20 HIS CA 1 1
8 2594 1 1 20 HIS CB C 12.513 -3.737 2.095 1.00 . A A . 20 HIS CB 1 1
8 2595 1 1 20 HIS CD2 C 13.174 -2.915 4.434 1.00 . A A . 20 HIS CD2 1 1
8 2596 1 1 20 HIS CE1 C 15.187 -2.412 4.103 1.00 . A A . 20 HIS CE1 1 1
8 2597 1 1 20 HIS CG C 13.518 -3.207 3.109 1.00 . A A . 20 HIS CG 1 1
8 2598 1 1 20 HIS H H 11.043 -4.240 0.015 1.00 . A A . 20 HIS H 1 1
8 2599 1 1 20 HIS HA H 13.715 -3.169 0.427 1.00 . A A . 20 HIS HA 1 1
8 2600 1 1 20 HIS HB2 H 11.719 -2.971 2.020 1.00 . A A . 20 HIS HB2 1 1
8 2601 1 1 20 HIS HB3 H 12.009 -4.630 2.510 1.00 . A A . 20 HIS HB3 1 1
8 2602 1 1 20 HIS HD2 H 12.180 -3.045 4.836 1.00 . A A . 20 HIS HD2 1 1
8 2603 1 1 20 HIS HE1 H 16.188 -2.050 4.286 1.00 . A A . 20 HIS HE1 1 1
8 2604 1 1 20 HIS HE2 H 14.339 -2.065 6.078 1.00 . A A . 20 HIS HE2 1 1
8 2605 1 1 20 HIS N N 12.012 -4.147 -0.292 1.00 . A A . 20 HIS N 1 1
8 2606 1 1 20 HIS ND1 N 14.844 -2.874 2.853 1.00 . A A . 20 HIS ND1 1 1
8 2607 1 1 20 HIS NE2 N 14.260 -2.399 5.111 1.00 . A A . 20 HIS NE2 1 1
8 2608 1 1 20 HIS O O 13.516 -6.437 1.045 1.00 . A A . 20 HIS O 1 1
9 2609 1 1 1 SER C C -11.153 -3.774 -1.107 1.00 . A A . 1 SER C 1 1
9 2610 1 1 1 SER CA C -9.921 -4.714 -0.867 1.00 . A A . 1 SER CA 1 1
9 2611 1 1 1 SER CB C -10.138 -6.155 -1.390 1.00 . A A . 1 SER CB 1 1
9 2612 1 1 1 SER H1 H -10.081 -5.359 1.223 1.00 . A A . 1 SER H1 1 1
9 2613 1 1 1 SER HA H -9.103 -4.275 -1.463 1.00 . A A . 1 SER HA 1 1
9 2614 1 1 1 SER HB2 H -9.303 -6.818 -1.086 1.00 . A A . 1 SER HB2 1 1
9 2615 1 1 1 SER HB3 H -11.060 -6.598 -0.963 1.00 . A A . 1 SER HB3 1 1
9 2616 1 1 1 SER HG H -10.973 -5.620 -3.038 1.00 . A A . 1 SER HG 1 1
9 2617 1 1 1 SER N N -9.491 -4.856 0.557 1.00 . A A . 1 SER N 1 1
9 2618 1 1 1 SER O O -11.926 -3.968 -2.052 1.00 . A A . 1 SER O 1 1
9 2619 1 1 1 SER OG O -10.222 -6.174 -2.811 1.00 . A A . 1 SER OG 1 1
9 2620 1 1 2 ASP C C -11.933 -0.471 0.455 1.00 . A A . 2 ASP C 1 1
9 2621 1 1 2 ASP CA C -12.383 -1.722 -0.365 1.00 . A A . 2 ASP CA 1 1
9 2622 1 1 2 ASP CB C -13.764 -2.309 0.079 1.00 . A A . 2 ASP CB 1 1
9 2623 1 1 2 ASP CG C -14.960 -1.456 -0.360 1.00 . A A . 2 ASP CG 1 1
9 2624 1 1 2 ASP H H -10.538 -2.646 0.396 1.00 . A A . 2 ASP H 1 1
9 2625 1 1 2 ASP HA H -12.419 -1.407 -1.427 1.00 . A A . 2 ASP HA 1 1
9 2626 1 1 2 ASP HB2 H -13.920 -3.347 -0.288 1.00 . A A . 2 ASP HB2 1 1
9 2627 1 1 2 ASP HB3 H -13.788 -2.420 1.180 1.00 . A A . 2 ASP HB3 1 1
9 2628 1 1 2 ASP HD2 H -16.091 -1.188 -1.922 1.00 . A A . 2 ASP HD2 1 1
9 2629 1 1 2 ASP N N -11.310 -2.738 -0.264 1.00 . A A . 2 ASP N 1 1
9 2630 1 1 2 ASP O O -12.490 -0.160 1.514 1.00 . A A . 2 ASP O 1 1
9 2631 1 1 2 ASP OD1 O -15.505 -0.626 0.368 1.00 . A A . 2 ASP OD1 1 1
9 2632 1 1 2 ASP OD2 O -15.343 -1.724 -1.650 1.00 . A A . 2 ASP OD2 1 1
9 2633 1 1 3 THR C C -9.948 2.391 -0.615 1.00 . A A . 3 THR C 1 1
9 2634 1 1 3 THR CA C -10.342 1.455 0.559 1.00 . A A . 3 THR CA 1 1
9 2635 1 1 3 THR CB C -9.288 1.041 1.629 1.00 . A A . 3 THR CB 1 1
9 2636 1 1 3 THR CG2 C -7.835 0.873 1.176 1.00 . A A . 3 THR CG2 1 1
9 2637 1 1 3 THR H H -10.394 -0.100 -0.836 1.00 . A A . 3 THR H 1 1
9 2638 1 1 3 THR HA H -11.127 1.982 1.098 1.00 . A A . 3 THR HA 1 1
9 2639 1 1 3 THR HB H -9.592 0.055 2.025 1.00 . A A . 3 THR HB 1 1
9 2640 1 1 3 THR HG1 H -10.240 1.973 3.016 1.00 . A A . 3 THR HG1 1 1
9 2641 1 1 3 THR HG21 H -7.172 0.629 2.021 1.00 . A A . 3 THR HG21 1 1
9 2642 1 1 3 THR HG22 H -7.750 0.099 0.399 1.00 . A A . 3 THR HG22 1 1
9 2643 1 1 3 THR HG23 H -7.426 1.794 0.730 1.00 . A A . 3 THR HG23 1 1
9 2644 1 1 3 THR N N -10.913 0.252 -0.052 1.00 . A A . 3 THR N 1 1
9 2645 1 1 3 THR O O -8.798 2.501 -1.034 1.00 . A A . 3 THR O 1 1
9 2646 1 1 3 THR OG1 O -9.330 1.964 2.710 1.00 . A A . 3 THR OG1 1 1
9 2647 1 1 4 ARG C C -10.137 5.328 -1.821 1.00 . A A . 4 ARG C 1 1
9 2648 1 1 4 ARG CA C -10.813 4.010 -2.308 1.00 . A A . 4 ARG CA 1 1
9 2649 1 1 4 ARG CB C -12.183 4.245 -3.072 1.00 . A A . 4 ARG CB 1 1
9 2650 1 1 4 ARG CD C -14.073 4.034 -1.266 1.00 . A A . 4 ARG CD 1 1
9 2651 1 1 4 ARG CG C -13.367 4.913 -2.320 1.00 . A A . 4 ARG CG 1 1
9 2652 1 1 4 ARG CZ C -16.145 4.128 0.138 1.00 . A A . 4 ARG CZ 1 1
9 2653 1 1 4 ARG H H -11.849 2.558 -0.981 1.00 . A A . 4 ARG H 1 1
9 2654 1 1 4 ARG HA H -10.018 3.548 -2.947 1.00 . A A . 4 ARG HA 1 1
9 2655 1 1 4 ARG HB2 H -12.025 4.879 -3.968 1.00 . A A . 4 ARG HB2 1 1
9 2656 1 1 4 ARG HB3 H -12.586 3.309 -3.514 1.00 . A A . 4 ARG HB3 1 1
9 2657 1 1 4 ARG HD2 H -14.335 3.054 -1.710 1.00 . A A . 4 ARG HD2 1 1
9 2658 1 1 4 ARG HD3 H -13.392 3.826 -0.422 1.00 . A A . 4 ARG HD3 1 1
9 2659 1 1 4 ARG HG2 H -13.039 5.866 -1.866 1.00 . A A . 4 ARG HG2 1 1
9 2660 1 1 4 ARG HG3 H -14.112 5.209 -3.084 1.00 . A A . 4 ARG HG3 1 1
9 2661 1 1 4 ARG HH11 H -17.829 4.379 1.192 1.00 . A A . 4 ARG HH11 1 1
9 2662 1 1 4 ARG HH12 H -17.296 5.765 0.114 1.00 . A A . 4 ARG HH12 1 1
9 2663 1 1 4 ARG HH21 H -16.704 2.590 1.311 1.00 . A A . 4 ARG HH21 1 1
9 2664 1 1 4 ARG HH22 H -15.163 2.381 0.337 1.00 . A A . 4 ARG HH22 1 1
9 2665 1 1 4 ARG N N -10.973 3.028 -1.200 1.00 . A A . 4 ARG N 1 1
9 2666 1 1 4 ARG NE N -15.295 4.690 -0.744 1.00 . A A . 4 ARG NE 1 1
9 2667 1 1 4 ARG NH1 N -17.197 4.828 0.520 1.00 . A A . 4 ARG NH1 1 1
9 2668 1 1 4 ARG NH2 N -15.988 2.906 0.648 1.00 . A A . 4 ARG NH2 1 1
9 2669 1 1 4 ARG O O -9.287 5.861 -2.541 1.00 . A A . 4 ARG O 1 1
9 2670 1 1 5 TYR C C -8.592 6.741 0.846 1.00 . A A . 5 TYR C 1 1
9 2671 1 1 5 TYR CA C -9.882 7.048 -0.020 1.00 . A A . 5 TYR CA 1 1
9 2672 1 1 5 TYR CB C -11.002 7.846 0.713 1.00 . A A . 5 TYR CB 1 1
9 2673 1 1 5 TYR CD1 C -10.609 10.278 0.044 1.00 . A A . 5 TYR CD1 1 1
9 2674 1 1 5 TYR CD2 C -10.447 9.697 2.382 1.00 . A A . 5 TYR CD2 1 1
9 2675 1 1 5 TYR CE1 C -10.320 11.605 0.354 1.00 . A A . 5 TYR CE1 1 1
9 2676 1 1 5 TYR CE2 C -10.157 11.024 2.691 1.00 . A A . 5 TYR CE2 1 1
9 2677 1 1 5 TYR CG C -10.669 9.311 1.055 1.00 . A A . 5 TYR CG 1 1
9 2678 1 1 5 TYR CZ C -10.094 11.978 1.677 1.00 . A A . 5 TYR CZ 1 1
9 2679 1 1 5 TYR H H -11.190 5.267 -0.126 1.00 . A A . 5 TYR H 1 1
9 2680 1 1 5 TYR HA H -9.528 7.637 -0.862 1.00 . A A . 5 TYR HA 1 1
9 2681 1 1 5 TYR HB2 H -11.920 7.859 0.092 1.00 . A A . 5 TYR HB2 1 1
9 2682 1 1 5 TYR HB3 H -11.303 7.292 1.624 1.00 . A A . 5 TYR HB3 1 1
9 2683 1 1 5 TYR HD1 H -10.784 10.004 -0.987 1.00 . A A . 5 TYR HD1 1 1
9 2684 1 1 5 TYR HD2 H -10.492 8.970 3.181 1.00 . A A . 5 TYR HD2 1 1
9 2685 1 1 5 TYR HE1 H -10.273 12.342 -0.435 1.00 . A A . 5 TYR HE1 1 1
9 2686 1 1 5 TYR HE2 H -9.983 11.310 3.718 1.00 . A A . 5 TYR HE2 1 1
9 2687 1 1 5 TYR HH H -9.806 13.801 1.172 1.00 . A A . 5 TYR HH 1 1
9 2688 1 1 5 TYR N N -10.502 5.835 -0.619 1.00 . A A . 5 TYR N 1 1
9 2689 1 1 5 TYR O O -8.206 7.506 1.733 1.00 . A A . 5 TYR O 1 1
9 2690 1 1 5 TYR OH O -9.809 13.285 1.982 1.00 . A A . 5 TYR OH 1 1
9 2691 1 1 6 ASN C C -5.706 4.453 0.130 1.00 . A A . 6 ASN C 1 1
9 2692 1 1 6 ASN CA C -6.684 5.109 1.151 1.00 . A A . 6 ASN CA 1 1
9 2693 1 1 6 ASN CB C -7.063 4.270 2.377 1.00 . A A . 6 ASN CB 1 1
9 2694 1 1 6 ASN CG C -5.963 3.905 3.392 1.00 . A A . 6 ASN CG 1 1
9 2695 1 1 6 ASN H H -8.472 5.009 -0.053 1.00 . A A . 6 ASN H 1 1
9 2696 1 1 6 ASN HA H -6.159 5.936 1.555 1.00 . A A . 6 ASN HA 1 1
9 2697 1 1 6 ASN HB2 H -7.911 4.756 2.888 1.00 . A A . 6 ASN HB2 1 1
9 2698 1 1 6 ASN HB3 H -7.491 3.357 1.999 1.00 . A A . 6 ASN HB3 1 1
9 2699 1 1 6 ASN HD21 H -4.674 4.599 4.763 1.00 . A A . 6 ASN HD21 1 1
9 2700 1 1 6 ASN HD22 H -5.717 5.832 3.891 1.00 . A A . 6 ASN HD22 1 1
9 2701 1 1 6 ASN N N -7.909 5.629 0.516 1.00 . A A . 6 ASN N 1 1
9 2702 1 1 6 ASN ND2 N -5.393 4.878 4.086 1.00 . A A . 6 ASN ND2 1 1
9 2703 1 1 6 ASN O O -4.493 4.597 0.304 1.00 . A A . 6 ASN O 1 1
9 2704 1 1 6 ASN OD1 O -5.640 2.733 3.580 1.00 . A A . 6 ASN OD1 1 1
9 2705 1 1 7 LYS C C -4.568 1.934 -1.424 1.00 . A A . 7 LYS C 1 1
9 2706 1 1 7 LYS CA C -5.403 3.117 -1.999 1.00 . A A . 7 LYS CA 1 1
9 2707 1 1 7 LYS CB C -4.613 4.170 -2.828 1.00 . A A . 7 LYS CB 1 1
9 2708 1 1 7 LYS CD C -6.515 4.920 -4.505 1.00 . A A . 7 LYS CD 1 1
9 2709 1 1 7 LYS CE C -5.947 4.338 -5.814 1.00 . A A . 7 LYS CE 1 1
9 2710 1 1 7 LYS CG C -5.448 5.315 -3.461 1.00 . A A . 7 LYS CG 1 1
9 2711 1 1 7 LYS H H -7.211 3.553 -0.862 1.00 . A A . 7 LYS H 1 1
9 2712 1 1 7 LYS HA H -6.103 2.713 -2.746 1.00 . A A . 7 LYS HA 1 1
9 2713 1 1 7 LYS HB2 H -3.838 4.624 -2.185 1.00 . A A . 7 LYS HB2 1 1
9 2714 1 1 7 LYS HB3 H -4.058 3.647 -3.625 1.00 . A A . 7 LYS HB3 1 1
9 2715 1 1 7 LYS HD2 H -7.235 4.213 -4.049 1.00 . A A . 7 LYS HD2 1 1
9 2716 1 1 7 LYS HD3 H -7.112 5.823 -4.734 1.00 . A A . 7 LYS HD3 1 1
9 2717 1 1 7 LYS HE2 H -5.234 5.047 -6.273 1.00 . A A . 7 LYS HE2 1 1
9 2718 1 1 7 LYS HE3 H -5.378 3.411 -5.613 1.00 . A A . 7 LYS HE3 1 1
9 2719 1 1 7 LYS HG2 H -5.957 5.866 -2.646 1.00 . A A . 7 LYS HG2 1 1
9 2720 1 1 7 LYS HG3 H -4.758 6.052 -3.905 1.00 . A A . 7 LYS HG3 1 1
9 2721 1 1 7 LYS HZ2 H -7.651 3.329 -6.396 1.00 . A A . 7 LYS HZ2 1 1
9 2722 1 1 7 LYS HZ3 H -6.619 3.624 -7.630 1.00 . A A . 7 LYS HZ3 1 1
9 2723 1 1 7 LYS N N -6.209 3.756 -0.921 1.00 . A A . 7 LYS N 1 1
9 2724 1 1 7 LYS NZ N -7.018 4.039 -6.781 1.00 . A A . 7 LYS NZ 1 1
9 2725 1 1 7 LYS O O -3.339 1.956 -1.530 1.00 . A A . 7 LYS O 1 1
9 2726 1 1 8 SER C C -3.360 0.102 0.753 1.00 . A A . 8 SER C 1 1
9 2727 1 1 8 SER CA C -4.553 -0.281 -0.201 1.00 . A A . 8 SER CA 1 1
9 2728 1 1 8 SER CB C -4.312 -1.289 -1.338 1.00 . A A . 8 SER CB 1 1
9 2729 1 1 8 SER H H -6.220 0.805 -1.049 1.00 . A A . 8 SER H 1 1
9 2730 1 1 8 SER HA H -5.289 -0.814 0.411 1.00 . A A . 8 SER HA 1 1
9 2731 1 1 8 SER HB2 H -5.279 -1.711 -1.686 1.00 . A A . 8 SER HB2 1 1
9 2732 1 1 8 SER HB3 H -3.906 -0.734 -2.188 1.00 . A A . 8 SER HB3 1 1
9 2733 1 1 8 SER HG H -3.377 -2.920 -1.746 1.00 . A A . 8 SER HG 1 1
9 2734 1 1 8 SER N N -5.227 0.907 -0.809 1.00 . A A . 8 SER N 1 1
9 2735 1 1 8 SER O O -2.247 -0.405 0.591 1.00 . A A . 8 SER O 1 1
9 2736 1 1 8 SER OG O -3.459 -2.366 -0.966 1.00 . A A . 8 SER OG 1 1
9 2737 1 1 9 PHE C C -1.329 2.175 2.047 1.00 . A A . 9 PHE C 1 1
9 2738 1 1 9 PHE CA C -2.574 1.497 2.715 1.00 . A A . 9 PHE CA 1 1
9 2739 1 1 9 PHE CB C -2.328 0.392 3.774 1.00 . A A . 9 PHE CB 1 1
9 2740 1 1 9 PHE CD1 C -2.125 1.855 5.883 1.00 . A A . 9 PHE CD1 1 1
9 2741 1 1 9 PHE CD2 C -0.683 -0.068 5.650 1.00 . A A . 9 PHE CD2 1 1
9 2742 1 1 9 PHE CE1 C -1.574 2.114 7.136 1.00 . A A . 9 PHE CE1 1 1
9 2743 1 1 9 PHE CE2 C -0.143 0.187 6.908 1.00 . A A . 9 PHE CE2 1 1
9 2744 1 1 9 PHE CG C -1.675 0.767 5.121 1.00 . A A . 9 PHE CG 1 1
9 2745 1 1 9 PHE CZ C -0.585 1.280 7.648 1.00 . A A . 9 PHE CZ 1 1
9 2746 1 1 9 PHE H H -4.552 1.353 1.865 1.00 . A A . 9 PHE H 1 1
9 2747 1 1 9 PHE HA H -3.058 2.287 3.289 1.00 . A A . 9 PHE HA 1 1
9 2748 1 1 9 PHE HB2 H -3.300 -0.084 4.013 1.00 . A A . 9 PHE HB2 1 1
9 2749 1 1 9 PHE HB3 H -1.747 -0.383 3.265 1.00 . A A . 9 PHE HB3 1 1
9 2750 1 1 9 PHE HD1 H -2.913 2.498 5.520 1.00 . A A . 9 PHE HD1 1 1
9 2751 1 1 9 PHE HD2 H -0.332 -0.928 5.096 1.00 . A A . 9 PHE HD2 1 1
9 2752 1 1 9 PHE HE1 H -1.923 2.957 7.716 1.00 . A A . 9 PHE HE1 1 1
9 2753 1 1 9 PHE HE2 H 0.623 -0.461 7.309 1.00 . A A . 9 PHE HE2 1 1
9 2754 1 1 9 PHE HZ H -0.162 1.479 8.621 1.00 . A A . 9 PHE HZ 1 1
9 2755 1 1 9 PHE N N -3.594 1.017 1.737 1.00 . A A . 9 PHE N 1 1
9 2756 1 1 9 PHE O O -0.191 1.883 2.422 1.00 . A A . 9 PHE O 1 1
9 2757 1 1 10 ILE C C 0.326 2.777 -0.521 1.00 . A A . 10 ILE C 1 1
9 2758 1 1 10 ILE CA C -0.487 3.834 0.316 1.00 . A A . 10 ILE CA 1 1
9 2759 1 1 10 ILE CB C 0.327 4.851 1.197 1.00 . A A . 10 ILE CB 1 1
9 2760 1 1 10 ILE CD1 C 0.049 6.511 3.200 1.00 . A A . 10 ILE CD1 1 1
9 2761 1 1 10 ILE CG1 C -0.584 5.871 1.955 1.00 . A A . 10 ILE CG1 1 1
9 2762 1 1 10 ILE CG2 C 1.394 5.646 0.393 1.00 . A A . 10 ILE CG2 1 1
9 2763 1 1 10 ILE H H -2.537 3.210 0.775 1.00 . A A . 10 ILE H 1 1
9 2764 1 1 10 ILE HA H -0.981 4.520 -0.372 1.00 . A A . 10 ILE HA 1 1
9 2765 1 1 10 ILE HB H 0.854 4.237 1.934 1.00 . A A . 10 ILE HB 1 1
9 2766 1 1 10 ILE HD11 H 0.938 7.118 2.953 1.00 . A A . 10 ILE HD11 1 1
9 2767 1 1 10 ILE HD12 H -0.669 7.181 3.709 1.00 . A A . 10 ILE HD12 1 1
9 2768 1 1 10 ILE HD13 H 0.359 5.747 3.936 1.00 . A A . 10 ILE HD13 1 1
9 2769 1 1 10 ILE HG12 H -0.921 6.670 1.263 1.00 . A A . 10 ILE HG12 1 1
9 2770 1 1 10 ILE HG13 H -1.512 5.367 2.286 1.00 . A A . 10 ILE HG13 1 1
9 2771 1 1 10 ILE HG21 H 2.139 4.993 -0.093 1.00 . A A . 10 ILE HG21 1 1
9 2772 1 1 10 ILE HG22 H 0.934 6.259 -0.405 1.00 . A A . 10 ILE HG22 1 1
9 2773 1 1 10 ILE HG23 H 1.975 6.331 1.036 1.00 . A A . 10 ILE HG23 1 1
9 2774 1 1 10 ILE N N -1.557 3.096 1.064 1.00 . A A . 10 ILE N 1 1
9 2775 1 1 10 ILE O O 1.523 2.631 -0.266 1.00 . A A . 10 ILE O 1 1
9 2776 1 1 11 ASN C C 1.279 -0.004 -1.436 1.00 . A A . 11 ASN C 1 1
9 2777 1 1 11 ASN CA C 0.406 0.972 -2.306 1.00 . A A . 11 ASN CA 1 1
9 2778 1 1 11 ASN CB C 1.028 1.739 -3.500 1.00 . A A . 11 ASN CB 1 1
9 2779 1 1 11 ASN CG C 1.965 1.000 -4.469 1.00 . A A . 11 ASN CG 1 1
9 2780 1 1 11 ASN H H -1.164 2.361 -1.876 1.00 . A A . 11 ASN H 1 1
9 2781 1 1 11 ASN HA H -0.340 0.350 -2.807 1.00 . A A . 11 ASN HA 1 1
9 2782 1 1 11 ASN HB2 H 0.213 2.183 -4.107 1.00 . A A . 11 ASN HB2 1 1
9 2783 1 1 11 ASN HB3 H 1.538 2.610 -3.084 1.00 . A A . 11 ASN HB3 1 1
9 2784 1 1 11 ASN HD21 H 2.093 -0.407 -5.894 1.00 . A A . 11 ASN HD21 1 1
9 2785 1 1 11 ASN HD22 H 0.442 -0.117 -5.147 1.00 . A A . 11 ASN HD22 1 1
9 2786 1 1 11 ASN N N -0.293 2.006 -1.477 1.00 . A A . 11 ASN N 1 1
9 2787 1 1 11 ASN ND2 N 1.447 0.063 -5.250 1.00 . A A . 11 ASN ND2 1 1
9 2788 1 1 11 ASN O O 2.457 -0.205 -1.733 1.00 . A A . 11 ASN O 1 1
9 2789 1 1 11 ASN OD1 O 3.159 1.287 -4.535 1.00 . A A . 11 ASN OD1 1 1
9 2790 1 1 12 ASN C C 2.628 -0.844 1.246 1.00 . A A . 12 ASN C 1 1
9 2791 1 1 12 ASN CA C 1.389 -1.530 0.584 1.00 . A A . 12 ASN CA 1 1
9 2792 1 1 12 ASN CB C 1.590 -2.900 -0.102 1.00 . A A . 12 ASN CB 1 1
9 2793 1 1 12 ASN CG C 1.983 -4.076 0.812 1.00 . A A . 12 ASN CG 1 1
9 2794 1 1 12 ASN H H -0.316 -0.459 -0.232 1.00 . A A . 12 ASN H 1 1
9 2795 1 1 12 ASN HA H 0.703 -1.753 1.389 1.00 . A A . 12 ASN HA 1 1
9 2796 1 1 12 ASN HB2 H 0.665 -3.152 -0.660 1.00 . A A . 12 ASN HB2 1 1
9 2797 1 1 12 ASN HB3 H 2.363 -2.771 -0.865 1.00 . A A . 12 ASN HB3 1 1
9 2798 1 1 12 ASN HD21 H 1.302 -5.511 2.037 1.00 . A A . 12 ASN HD21 1 1
9 2799 1 1 12 ASN HD22 H 0.057 -4.404 1.267 1.00 . A A . 12 ASN HD22 1 1
9 2800 1 1 12 ASN N N 0.693 -0.596 -0.352 1.00 . A A . 12 ASN N 1 1
9 2801 1 1 12 ASN ND2 N 1.015 -4.731 1.436 1.00 . A A . 12 ASN ND2 1 1
9 2802 1 1 12 ASN O O 3.698 -1.453 1.288 1.00 . A A . 12 ASN O 1 1
9 2803 1 1 12 ASN OD1 O 3.159 -4.408 0.960 1.00 . A A . 12 ASN OD1 1 1
9 2804 1 1 13 LYS C C 4.748 1.363 1.383 1.00 . A A . 13 LYS C 1 1
9 2805 1 1 13 LYS CA C 3.600 1.171 2.441 1.00 . A A . 13 LYS CA 1 1
9 2806 1 1 13 LYS CB C 4.059 0.575 3.803 1.00 . A A . 13 LYS CB 1 1
9 2807 1 1 13 LYS CD C 2.860 1.913 5.741 1.00 . A A . 13 LYS CD 1 1
9 2808 1 1 13 LYS CE C 1.887 2.933 5.114 1.00 . A A . 13 LYS CE 1 1
9 2809 1 1 13 LYS CG C 3.040 0.585 4.968 1.00 . A A . 13 LYS CG 1 1
9 2810 1 1 13 LYS H H 1.555 0.836 1.715 1.00 . A A . 13 LYS H 1 1
9 2811 1 1 13 LYS HA H 3.235 2.176 2.660 1.00 . A A . 13 LYS HA 1 1
9 2812 1 1 13 LYS HB2 H 4.384 -0.469 3.638 1.00 . A A . 13 LYS HB2 1 1
9 2813 1 1 13 LYS HB3 H 4.972 1.098 4.142 1.00 . A A . 13 LYS HB3 1 1
9 2814 1 1 13 LYS HD2 H 2.487 1.651 6.750 1.00 . A A . 13 LYS HD2 1 1
9 2815 1 1 13 LYS HD3 H 3.846 2.383 5.920 1.00 . A A . 13 LYS HD3 1 1
9 2816 1 1 13 LYS HE2 H 2.291 3.346 4.175 1.00 . A A . 13 LYS HE2 1 1
9 2817 1 1 13 LYS HE3 H 0.929 2.447 4.854 1.00 . A A . 13 LYS HE3 1 1
9 2818 1 1 13 LYS HG2 H 2.064 0.190 4.634 1.00 . A A . 13 LYS HG2 1 1
9 2819 1 1 13 LYS HG3 H 3.394 -0.163 5.702 1.00 . A A . 13 LYS HG3 1 1
9 2820 1 1 13 LYS HZ2 H 1.231 3.696 6.916 1.00 . A A . 13 LYS HZ2 1 1
9 2821 1 1 13 LYS HZ3 H 2.493 4.521 6.285 1.00 . A A . 13 LYS HZ3 1 1
9 2822 1 1 13 LYS N N 2.481 0.399 1.804 1.00 . A A . 13 LYS N 1 1
9 2823 1 1 13 LYS NZ N 1.616 4.051 6.034 1.00 . A A . 13 LYS NZ 1 1
9 2824 1 1 13 LYS O O 5.924 1.191 1.717 1.00 . A A . 13 LYS O 1 1
9 2825 1 1 14 HIS C C 6.146 0.579 -1.230 1.00 . A A . 14 HIS C 1 1
9 2826 1 1 14 HIS CA C 5.381 1.929 -1.008 1.00 . A A . 14 HIS CA 1 1
9 2827 1 1 14 HIS CB C 6.212 3.215 -0.789 1.00 . A A . 14 HIS CB 1 1
9 2828 1 1 14 HIS CD2 C 7.657 4.913 -2.046 1.00 . A A . 14 HIS CD2 1 1
9 2829 1 1 14 HIS CE1 C 7.518 4.156 -4.000 1.00 . A A . 14 HIS CE1 1 1
9 2830 1 1 14 HIS CG C 6.870 3.758 -2.046 1.00 . A A . 14 HIS CG 1 1
9 2831 1 1 14 HIS H H 3.436 2.049 -0.033 1.00 . A A . 14 HIS H 1 1
9 2832 1 1 14 HIS HA H 4.807 2.097 -1.919 1.00 . A A . 14 HIS HA 1 1
9 2833 1 1 14 HIS HB2 H 5.544 4.005 -0.397 1.00 . A A . 14 HIS HB2 1 1
9 2834 1 1 14 HIS HB3 H 6.979 3.065 -0.006 1.00 . A A . 14 HIS HB3 1 1
9 2835 1 1 14 HIS HD2 H 7.854 5.499 -1.160 1.00 . A A . 14 HIS HD2 1 1
9 2836 1 1 14 HIS HE1 H 7.656 4.066 -5.068 1.00 . A A . 14 HIS HE1 1 1
9 2837 1 1 14 HIS HE2 H 8.680 5.967 -3.666 1.00 . A A . 14 HIS HE2 1 1
9 2838 1 1 14 HIS N N 4.408 1.744 0.109 1.00 . A A . 14 HIS N 1 1
9 2839 1 1 14 HIS ND1 N 6.749 3.233 -3.328 1.00 . A A . 14 HIS ND1 1 1
9 2840 1 1 14 HIS NE2 N 8.101 5.194 -3.322 1.00 . A A . 14 HIS NE2 1 1
9 2841 1 1 14 HIS O O 7.369 0.604 -1.381 1.00 . A A . 14 HIS O 1 1
9 2842 1 1 15 LEU C C 7.044 -2.194 -0.261 1.00 . A A . 15 LEU C 1 1
9 2843 1 1 15 LEU CA C 6.056 -1.944 -1.461 1.00 . A A . 15 LEU CA 1 1
9 2844 1 1 15 LEU CB C 6.655 -2.200 -2.882 1.00 . A A . 15 LEU CB 1 1
9 2845 1 1 15 LEU CD1 C 4.951 -3.946 -3.750 1.00 . A A . 15 LEU CD1 1 1
9 2846 1 1 15 LEU CD2 C 4.669 -1.515 -4.374 1.00 . A A . 15 LEU CD2 1 1
9 2847 1 1 15 LEU CG C 5.694 -2.606 -4.035 1.00 . A A . 15 LEU CG 1 1
9 2848 1 1 15 LEU H H 4.399 -0.532 -1.165 1.00 . A A . 15 LEU H 1 1
9 2849 1 1 15 LEU HA H 5.260 -2.674 -1.328 1.00 . A A . 15 LEU HA 1 1
9 2850 1 1 15 LEU HB2 H 7.255 -1.325 -3.196 1.00 . A A . 15 LEU HB2 1 1
9 2851 1 1 15 LEU HB3 H 7.401 -3.014 -2.814 1.00 . A A . 15 LEU HB3 1 1
9 2852 1 1 15 LEU HD11 H 5.637 -4.767 -3.468 1.00 . A A . 15 LEU HD11 1 1
9 2853 1 1 15 LEU HD12 H 4.362 -4.302 -4.615 1.00 . A A . 15 LEU HD12 1 1
9 2854 1 1 15 LEU HD13 H 4.225 -3.863 -2.914 1.00 . A A . 15 LEU HD13 1 1
9 2855 1 1 15 LEU HD21 H 3.936 -1.371 -3.559 1.00 . A A . 15 LEU HD21 1 1
9 2856 1 1 15 LEU HD22 H 4.097 -1.764 -5.285 1.00 . A A . 15 LEU HD22 1 1
9 2857 1 1 15 LEU HD23 H 5.162 -0.541 -4.549 1.00 . A A . 15 LEU HD23 1 1
9 2858 1 1 15 LEU HG H 6.345 -2.699 -4.939 1.00 . A A . 15 LEU HG 1 1
9 2859 1 1 15 LEU N N 5.428 -0.594 -1.291 1.00 . A A . 15 LEU N 1 1
9 2860 1 1 15 LEU O O 8.130 -2.747 -0.464 1.00 . A A . 15 LEU O 1 1
9 2861 1 1 16 ASN C C 8.875 -1.237 1.979 1.00 . A A . 16 ASN C 1 1
9 2862 1 1 16 ASN CA C 7.497 -1.962 2.228 1.00 . A A . 16 ASN CA 1 1
9 2863 1 1 16 ASN CB C 7.511 -3.424 2.707 1.00 . A A . 16 ASN CB 1 1
9 2864 1 1 16 ASN CG C 8.003 -3.640 4.150 1.00 . A A . 16 ASN CG 1 1
9 2865 1 1 16 ASN H H 5.702 -1.443 1.119 1.00 . A A . 16 ASN H 1 1
9 2866 1 1 16 ASN HA H 6.981 -1.431 3.034 1.00 . A A . 16 ASN HA 1 1
9 2867 1 1 16 ASN HB2 H 6.491 -3.841 2.580 1.00 . A A . 16 ASN HB2 1 1
9 2868 1 1 16 ASN HB3 H 8.148 -3.986 2.020 1.00 . A A . 16 ASN HB3 1 1
9 2869 1 1 16 ASN HD21 H 7.454 -3.746 6.077 1.00 . A A . 16 ASN HD21 1 1
9 2870 1 1 16 ASN HD22 H 6.138 -3.406 4.844 1.00 . A A . 16 ASN HD22 1 1
9 2871 1 1 16 ASN N N 6.654 -1.820 1.005 1.00 . A A . 16 ASN N 1 1
9 2872 1 1 16 ASN ND2 N 7.105 -3.605 5.123 1.00 . A A . 16 ASN ND2 1 1
9 2873 1 1 16 ASN O O 9.937 -1.795 2.274 1.00 . A A . 16 ASN O 1 1
9 2874 1 1 16 ASN OD1 O 9.191 -3.840 4.400 1.00 . A A . 16 ASN OD1 1 1
9 2875 1 1 17 GLU C C 10.895 0.137 -0.045 1.00 . A A . 17 GLU C 1 1
9 2876 1 1 17 GLU CA C 10.038 0.823 1.083 1.00 . A A . 17 GLU CA 1 1
9 2877 1 1 17 GLU CB C 10.812 1.316 2.327 1.00 . A A . 17 GLU CB 1 1
9 2878 1 1 17 GLU CD C 10.701 2.511 4.590 1.00 . A A . 17 GLU CD 1 1
9 2879 1 1 17 GLU CG C 9.984 2.216 3.271 1.00 . A A . 17 GLU CG 1 1
9 2880 1 1 17 GLU H H 7.901 0.387 1.179 1.00 . A A . 17 GLU H 1 1
9 2881 1 1 17 GLU HA H 9.666 1.750 0.639 1.00 . A A . 17 GLU HA 1 1
9 2882 1 1 17 GLU HB2 H 11.172 0.430 2.854 1.00 . A A . 17 GLU HB2 1 1
9 2883 1 1 17 GLU HB3 H 11.720 1.867 2.014 1.00 . A A . 17 GLU HB3 1 1
9 2884 1 1 17 GLU HE2 H 10.917 1.734 6.362 1.00 . A A . 17 GLU HE2 1 1
9 2885 1 1 17 GLU HG2 H 9.749 3.171 2.765 1.00 . A A . 17 GLU HG2 1 1
9 2886 1 1 17 GLU HG3 H 9.001 1.745 3.471 1.00 . A A . 17 GLU HG3 1 1
9 2887 1 1 17 GLU N N 8.836 0.008 1.413 1.00 . A A . 17 GLU N 1 1
9 2888 1 1 17 GLU O O 12.120 0.042 0.079 1.00 . A A . 17 GLU O 1 1
9 2889 1 1 17 GLU OE1 O 11.405 3.504 4.771 1.00 . A A . 17 GLU OE1 1 1
9 2890 1 1 17 GLU OE2 O 10.466 1.546 5.536 1.00 . A A . 17 GLU OE2 1 1
9 2891 1 1 18 HIS C C 11.593 -2.316 -1.998 1.00 . A A . 18 HIS C 1 1
9 2892 1 1 18 HIS CA C 10.883 -0.969 -2.330 1.00 . A A . 18 HIS CA 1 1
9 2893 1 1 18 HIS CB C 11.725 0.069 -3.102 1.00 . A A . 18 HIS CB 1 1
9 2894 1 1 18 HIS CD2 C 12.726 0.561 -5.405 1.00 . A A . 18 HIS CD2 1 1
9 2895 1 1 18 HIS CE1 C 12.099 -1.141 -6.465 1.00 . A A . 18 HIS CE1 1 1
9 2896 1 1 18 HIS CG C 12.002 -0.280 -4.555 1.00 . A A . 18 HIS CG 1 1
9 2897 1 1 18 HIS H H 9.226 -0.182 -1.194 1.00 . A A . 18 HIS H 1 1
9 2898 1 1 18 HIS HA H 10.040 -1.190 -3.015 1.00 . A A . 18 HIS HA 1 1
9 2899 1 1 18 HIS HB2 H 11.161 1.022 -3.089 1.00 . A A . 18 HIS HB2 1 1
9 2900 1 1 18 HIS HB3 H 12.679 0.282 -2.584 1.00 . A A . 18 HIS HB3 1 1
9 2901 1 1 18 HIS HD2 H 13.135 1.511 -5.094 1.00 . A A . 18 HIS HD2 1 1
9 2902 1 1 18 HIS HE1 H 11.954 -1.835 -7.280 1.00 . A A . 18 HIS HE1 1 1
9 2903 1 1 18 HIS HE2 H 13.256 0.374 -7.519 1.00 . A A . 18 HIS HE2 1 1
9 2904 1 1 18 HIS N N 10.242 -0.335 -1.150 1.00 . A A . 18 HIS N 1 1
9 2905 1 1 18 HIS ND1 N 11.562 -1.414 -5.228 1.00 . A A . 18 HIS ND1 1 1
9 2906 1 1 18 HIS NE2 N 12.809 0.013 -6.669 1.00 . A A . 18 HIS NE2 1 1
9 2907 1 1 18 HIS O O 12.713 -2.330 -1.481 1.00 . A A . 18 HIS O 1 1
9 2908 1 1 19 ALA C C 11.425 -5.265 -0.650 1.00 . A A . 19 ALA C 1 1
9 2909 1 1 19 ALA CA C 11.403 -4.827 -2.142 1.00 . A A . 19 ALA CA 1 1
9 2910 1 1 19 ALA CB C 12.742 -5.126 -2.858 1.00 . A A . 19 ALA CB 1 1
9 2911 1 1 19 ALA H H 9.981 -3.251 -2.721 1.00 . A A . 19 ALA H 1 1
9 2912 1 1 19 ALA HA H 10.663 -5.456 -2.676 1.00 . A A . 19 ALA HA 1 1
9 2913 1 1 19 ALA HB1 H 12.702 -4.848 -3.928 1.00 . A A . 19 ALA HB1 1 1
9 2914 1 1 19 ALA HB2 H 12.988 -6.204 -2.818 1.00 . A A . 19 ALA HB2 1 1
9 2915 1 1 19 ALA HB3 H 13.595 -4.585 -2.409 1.00 . A A . 19 ALA HB3 1 1
9 2916 1 1 19 ALA N N 10.909 -3.434 -2.325 1.00 . A A . 19 ALA N 1 1
9 2917 1 1 19 ALA O O 12.309 -4.863 0.114 1.00 . A A . 19 ALA O 1 1
9 2918 1 1 20 HIS C C 11.283 -7.834 1.338 1.00 . A A . 20 HIS C 1 1
9 2919 1 1 20 HIS CA C 10.317 -6.632 1.122 1.00 . A A . 20 HIS CA 1 1
9 2920 1 1 20 HIS CB C 8.830 -6.993 1.371 1.00 . A A . 20 HIS CB 1 1
9 2921 1 1 20 HIS CD2 C 7.156 -7.522 3.241 1.00 . A A . 20 HIS CD2 1 1
9 2922 1 1 20 HIS CE1 C 8.394 -7.320 4.925 1.00 . A A . 20 HIS CE1 1 1
9 2923 1 1 20 HIS CG C 8.456 -7.204 2.832 1.00 . A A . 20 HIS CG 1 1
9 2924 1 1 20 HIS H H 9.703 -6.256 -0.939 1.00 . A A . 20 HIS H 1 1
9 2925 1 1 20 HIS HA H 10.548 -5.802 1.810 1.00 . A A . 20 HIS HA 1 1
9 2926 1 1 20 HIS HB2 H 8.170 -6.190 0.987 1.00 . A A . 20 HIS HB2 1 1
9 2927 1 1 20 HIS HB3 H 8.540 -7.893 0.795 1.00 . A A . 20 HIS HB3 1 1
9 2928 1 1 20 HIS HD2 H 6.329 -7.659 2.560 1.00 . A A . 20 HIS HD2 1 1
9 2929 1 1 20 HIS HE1 H 8.709 -7.288 5.959 1.00 . A A . 20 HIS HE1 1 1
9 2930 1 1 20 HIS HE2 H 6.294 -7.807 5.231 1.00 . A A . 20 HIS HE2 1 1
9 2931 1 1 20 HIS N N 10.449 -6.109 -0.258 1.00 . A A . 20 HIS N 1 1
9 2932 1 1 20 HIS ND1 N 9.302 -7.061 3.925 1.00 . A A . 20 HIS ND1 1 1
9 2933 1 1 20 HIS NE2 N 7.091 -7.606 4.617 1.00 . A A . 20 HIS NE2 1 1
9 2934 1 1 20 HIS O O 11.134 -8.907 0.749 1.00 . A A . 20 HIS O 1 1
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