NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
399633 |
1uao   |
5694 | cing | 4-filtered-FRED | STAR | entry | full | 171 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1uao
# This FRED archive file contains, for PDB entry <1uao>:
#
# - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
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.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_1uao
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1uao
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1080.06
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 $Chignolin A . 1 1
stop_
save_
save_Chignolin
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name Chignolin
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GYDPETGTWG
_Entity.Number_of_monomers 10
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 GLY . 1 1
2 TYR . 1 1
3 ASP . 1 1
4 PRO . 1 1
5 GLU . 1 1
6 THR . 1 1
7 GLY . 1 1
8 THR . 1 1
9 TRP . 1 1
10 GLY . 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
GLY 1 1 1 1
TYR 2 2 1 1
ASP 3 3 1 1
PRO 4 4 1 1
GLU 5 5 1 1
THR 6 6 1 1
GLY 7 7 1 1
THR 8 8 1 1
TRP 9 9 1 1
GLY 10 10 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 1 . . . 1 1
131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
136 1 . . . 1 1
137 1 . . . 1 1
138 1 . . . 1 1
139 1 . . . 1 1
140 1 . . . 1 1
141 1 . . . 1 1
142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
146 1 . . . 1 1
147 1 . . . 1 1
148 1 . . . 1 1
149 1 . . . 1 1
150 1 . . . 1 1
151 1 . . . 1 1
152 1 . . . 1 1
153 1 . . . 1 1
154 1 . . . 1 1
155 1 . . . 1 1
156 1 . . . 1 1
157 1 . . . 1 1
158 1 . . . 1 1
159 1 . . . 1 1
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 1 GLY QA . 1 . HA# 1 1
1 1 2 1 1 2 TYR H . 2 . HN 1 1
2 1 1 1 1 1 GLY QA . 1 . HA# 1 1
2 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
3 1 1 1 1 1 GLY QA . 1 . HA# 1 1
3 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1
4 1 1 1 1 2 TYR HA . 2 . HA 1 1
4 1 2 1 1 2 TYR HB3 . 2 . HB1 1 1
5 1 1 1 1 2 TYR HA . 2 . HA 1 1
5 1 2 1 1 2 TYR HB2 . 2 . HB2 1 1
6 1 1 1 1 2 TYR HA . 2 . HA 1 1
6 1 2 1 1 2 TYR QD . 2 . HD# 1 1
7 1 1 1 1 2 TYR HA . 2 . HA 1 1
7 1 2 1 1 2 TYR QE . 2 . HE# 1 1
8 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1
8 1 2 1 1 2 TYR QD . 2 . HD# 1 1
9 1 1 1 1 2 TYR H . 2 . HN 1 1
9 1 2 1 1 2 TYR HB3 . 2 . HB1 1 1
10 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
10 1 2 1 1 2 TYR QD . 2 . HD# 1 1
11 1 1 1 1 2 TYR H . 2 . HN 1 1
11 1 2 1 1 2 TYR HB2 . 2 . HB2 1 1
12 1 1 1 1 2 TYR H . 2 . HN 1 1
12 1 2 1 1 2 TYR QD . 2 . HD# 1 1
13 1 1 1 1 2 TYR HA . 2 . HA 1 1
13 1 2 1 1 3 ASP H . 3 . HN 1 1
14 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1
14 1 2 1 1 3 ASP H . 3 . HN 1 1
15 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
15 1 2 1 1 3 ASP H . 3 . HN 1 1
16 1 1 1 1 2 TYR QD . 2 . HD# 1 1
16 1 2 1 1 3 ASP H . 3 . HN 1 1
17 1 1 1 1 2 TYR QE . 2 . HE# 1 1
17 1 2 1 1 3 ASP HA . 3 . HA 1 1
18 1 1 1 1 2 TYR QE . 2 . HE# 1 1
18 1 2 1 1 3 ASP H . 3 . HN 1 1
19 1 1 1 1 2 TYR H . 2 . HN 1 1
19 1 2 1 1 3 ASP H . 3 . HN 1 1
20 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1
20 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
21 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
21 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
22 1 1 1 1 2 TYR QD . 2 . HD# 1 1
22 1 2 1 1 4 PRO HA . 4 . HA 1 1
23 1 1 1 1 2 TYR QD . 2 . HD# 1 1
23 1 2 1 1 4 PRO HB3 . 4 . HB1 1 1
24 1 1 1 1 2 TYR QD . 2 . HD# 1 1
24 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
25 1 1 1 1 2 TYR QD . 2 . HD# 1 1
25 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
26 1 1 1 1 2 TYR QD . 2 . HD# 1 1
26 1 2 1 1 4 PRO QG . 4 . HG# 1 1
27 1 1 1 1 2 TYR QE . 2 . HE# 1 1
27 1 2 1 1 4 PRO HA . 4 . HA 1 1
28 1 1 1 1 2 TYR QE . 2 . HE# 1 1
28 1 2 1 1 4 PRO HB3 . 4 . HB1 1 1
29 1 1 1 1 2 TYR QE . 2 . HE# 1 1
29 1 2 1 1 4 PRO HB2 . 4 . HB2 1 1
30 1 1 1 1 2 TYR QD . 2 . HD# 1 1
30 1 2 1 1 7 GLY H . 7 . HN 1 1
31 1 1 1 1 2 TYR QE . 2 . HE# 1 1
31 1 2 1 1 7 GLY HA3 . 7 . HA1 1 1
32 1 1 1 1 2 TYR QE . 2 . HE# 1 1
32 1 2 1 1 7 GLY HA2 . 7 . HA2 1 1
33 1 1 1 1 2 TYR QE . 2 . HE# 1 1
33 1 2 1 1 7 GLY H . 7 . HN 1 1
34 1 1 1 1 2 TYR QD . 2 . HD# 1 1
34 1 2 1 1 8 THR HA . 8 . HA 1 1
35 1 1 1 1 2 TYR QE . 2 . HE# 1 1
35 1 2 1 1 8 THR HA . 8 . HA 1 1
36 1 1 1 1 2 TYR QE . 2 . HE# 1 1
36 1 2 1 1 8 THR H . 8 . HN 1 1
37 1 1 1 1 2 TYR HA . 2 . HA 1 1
37 1 2 1 1 9 TRP HA . 9 . HA 1 1
38 1 1 1 1 2 TYR HA . 2 . HA 1 1
38 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
39 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1
39 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1
40 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
40 1 2 1 1 9 TRP HA . 9 . HA 1 1
41 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
41 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1
42 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
42 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
43 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
43 1 2 1 1 9 TRP HH2 . 9 . HH2 1 1
44 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
44 1 2 1 1 9 TRP HZ2 . 9 . HZ2 1 1
45 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
45 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1
46 1 1 1 1 2 TYR QD . 2 . HD# 1 1
46 1 2 1 1 9 TRP HA . 9 . HA 1 1
47 1 1 1 1 2 TYR QD . 2 . HD# 1 1
47 1 2 1 1 9 TRP HB3 . 9 . HB1 1 1
48 1 1 1 1 2 TYR QD . 2 . HD# 1 1
48 1 2 1 1 9 TRP HB2 . 9 . HB2 1 1
49 1 1 1 1 2 TYR QD . 2 . HD# 1 1
49 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
50 1 1 1 1 2 TYR QD . 2 . HD# 1 1
50 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1
51 1 1 1 1 2 TYR QD . 2 . HD# 1 1
51 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
52 1 1 1 1 2 TYR QD . 2 . HD# 1 1
52 1 2 1 1 9 TRP HH2 . 9 . HH2 1 1
53 1 1 1 1 2 TYR QD . 2 . HD# 1 1
53 1 2 1 1 9 TRP H . 9 . HN 1 1
54 1 1 1 1 2 TYR QD . 2 . HD# 1 1
54 1 2 1 1 9 TRP HZ2 . 9 . HZ2 1 1
55 1 1 1 1 2 TYR QD . 2 . HD# 1 1
55 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1
56 1 1 1 1 2 TYR QE . 2 . HE# 1 1
56 1 2 1 1 9 TRP HB2 . 9 . HB2 1 1
57 1 1 1 1 2 TYR QE . 2 . HE# 1 1
57 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
58 1 1 1 1 2 TYR QE . 2 . HE# 1 1
58 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1
59 1 1 1 1 2 TYR QE . 2 . HE# 1 1
59 1 2 1 1 9 TRP H . 9 . HN 1 1
60 1 1 1 1 2 TYR H . 2 . HN 1 1
60 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
61 1 1 1 1 2 TYR H . 2 . HN 1 1
61 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1
62 1 1 1 1 3 ASP H . 3 . HN 1 1
62 1 2 1 1 3 ASP HB3 . 3 . HB1 1 1
63 1 1 1 1 3 ASP H . 3 . HN 1 1
63 1 2 1 1 3 ASP HB2 . 3 . HB2 1 1
64 1 1 1 1 3 ASP HA . 3 . HA 1 1
64 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
65 1 1 1 1 3 ASP HA . 3 . HA 1 1
65 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
66 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
66 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
67 1 1 1 1 3 ASP HB2 . 3 . HB2 1 1
67 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
68 1 1 1 1 3 ASP H . 3 . HN 1 1
68 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
69 1 1 1 1 3 ASP HA . 3 . HA 1 1
69 1 2 1 1 5 GLU H . 5 . HN 1 1
70 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
70 1 2 1 1 5 GLU H . 5 . HN 1 1
71 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
71 1 2 1 1 6 THR MG . 6 . HG2# 1 1
72 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
72 1 2 1 1 6 THR H . 6 . HN 1 1
73 1 1 1 1 3 ASP HB2 . 3 . HB2 1 1
73 1 2 1 1 6 THR H . 6 . HN 1 1
74 1 1 1 1 3 ASP H . 3 . HN 1 1
74 1 2 1 1 6 THR MG . 6 . HG2# 1 1
75 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
75 1 2 1 1 7 GLY H . 7 . HN 1 1
76 1 1 1 1 3 ASP HB2 . 3 . HB2 1 1
76 1 2 1 1 7 GLY H . 7 . HN 1 1
77 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
77 1 2 1 1 8 THR HB . 8 . HB 1 1
78 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
78 1 2 1 1 8 THR H . 8 . HN 1 1
79 1 1 1 1 3 ASP HB2 . 3 . HB2 1 1
79 1 2 1 1 8 THR H . 8 . HN 1 1
80 1 1 1 1 3 ASP H . 3 . HN 1 1
80 1 2 1 1 8 THR H . 8 . HN 1 1
81 1 1 1 1 4 PRO HA . 4 . HA 1 1
81 1 2 1 1 4 PRO HB3 . 4 . HB1 1 1
82 1 1 1 1 4 PRO HA . 4 . HA 1 1
82 1 2 1 1 4 PRO HB2 . 4 . HB2 1 1
83 1 1 1 1 4 PRO HB3 . 4 . HB1 1 1
83 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
84 1 1 1 1 4 PRO HB3 . 4 . HB1 1 1
84 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
85 1 1 1 1 4 PRO HD3 . 4 . HD1 1 1
85 1 2 1 1 4 PRO QG . 4 . HG# 1 1
86 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1
86 1 2 1 1 4 PRO QG . 4 . HG# 1 1
87 1 1 1 1 4 PRO HA . 4 . HA 1 1
87 1 2 1 1 5 GLU H . 5 . HN 1 1
88 1 1 1 1 4 PRO HB3 . 4 . HB1 1 1
88 1 2 1 1 5 GLU H . 5 . HN 1 1
89 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1
89 1 2 1 1 5 GLU HA . 5 . HA 1 1
90 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1
90 1 2 1 1 5 GLU H . 5 . HN 1 1
91 1 1 1 1 4 PRO HD3 . 4 . HD1 1 1
91 1 2 1 1 5 GLU H . 5 . HN 1 1
92 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1
92 1 2 1 1 5 GLU H . 5 . HN 1 1
93 1 1 1 1 4 PRO QG . 4 . HG# 1 1
93 1 2 1 1 5 GLU HA . 5 . HA 1 1
94 1 1 1 1 4 PRO QG . 4 . HG# 1 1
94 1 2 1 1 5 GLU H . 5 . HN 1 1
95 1 1 1 1 4 PRO HA . 4 . HA 1 1
95 1 2 1 1 6 THR H . 6 . HN 1 1
96 1 1 1 1 4 PRO HA . 4 . HA 1 1
96 1 2 1 1 7 GLY H . 7 . HN 1 1
97 1 1 1 1 5 GLU HA . 5 . HA 1 1
97 1 2 1 1 5 GLU QB . 5 . HB# 1 1
98 1 1 1 1 5 GLU HA . 5 . HA 1 1
98 1 2 1 1 5 GLU QG . 5 . HG# 1 1
99 1 1 1 1 5 GLU H . 5 . HN 1 1
99 1 2 1 1 5 GLU HA . 5 . HA 1 1
100 1 1 1 1 5 GLU QB . 5 . HB# 1 1
100 1 2 1 1 5 GLU QG . 5 . HG# 1 1
101 1 1 1 1 5 GLU H . 5 . HN 1 1
101 1 2 1 1 5 GLU QB . 5 . HB# 1 1
102 1 1 1 1 5 GLU H . 5 . HN 1 1
102 1 2 1 1 5 GLU QG . 5 . HG# 1 1
103 1 1 1 1 5 GLU HA . 5 . HA 1 1
103 1 2 1 1 6 THR H . 6 . HN 1 1
104 1 1 1 1 5 GLU QB . 5 . HB# 1 1
104 1 2 1 1 6 THR MG . 6 . HG2# 1 1
105 1 1 1 1 5 GLU QB . 5 . HB# 1 1
105 1 2 1 1 6 THR H . 6 . HN 1 1
106 1 1 1 1 5 GLU QG . 5 . HG# 1 1
106 1 2 1 1 6 THR H . 6 . HN 1 1
107 1 1 1 1 5 GLU H . 5 . HN 1 1
107 1 2 1 1 6 THR MG . 6 . HG2# 1 1
108 1 1 1 1 5 GLU H . 5 . HN 1 1
108 1 2 1 1 6 THR H . 6 . HN 1 1
109 1 1 1 1 5 GLU HA . 5 . HA 1 1
109 1 2 1 1 7 GLY H . 7 . HN 1 1
110 1 1 1 1 5 GLU QB . 5 . HB# 1 1
110 1 2 1 1 7 GLY H . 7 . HN 1 1
111 1 1 1 1 6 THR HA . 6 . HA 1 1
111 1 2 1 1 6 THR MG . 6 . HG2# 1 1
112 1 1 1 1 6 THR H . 6 . HN 1 1
112 1 2 1 1 6 THR HB . 6 . HB 1 1
113 1 1 1 1 6 THR H . 6 . HN 1 1
113 1 2 1 1 6 THR MG . 6 . HG2# 1 1
114 1 1 1 1 6 THR HA . 6 . HA 1 1
114 1 2 1 1 7 GLY H . 7 . HN 1 1
115 1 1 1 1 6 THR HB . 6 . HB 1 1
115 1 2 1 1 7 GLY H . 7 . HN 1 1
116 1 1 1 1 6 THR MG . 6 . HG2# 1 1
116 1 2 1 1 7 GLY HA3 . 7 . HA1 1 1
117 1 1 1 1 6 THR MG . 6 . HG2# 1 1
117 1 2 1 1 7 GLY HA2 . 7 . HA2 1 1
118 1 1 1 1 6 THR MG . 6 . HG2# 1 1
118 1 2 1 1 7 GLY H . 7 . HN 1 1
119 1 1 1 1 6 THR H . 6 . HN 1 1
119 1 2 1 1 7 GLY HA2 . 7 . HA2 1 1
120 1 1 1 1 6 THR H . 6 . HN 1 1
120 1 2 1 1 7 GLY H . 7 . HN 1 1
121 1 1 1 1 6 THR HB . 6 . HB 1 1
121 1 2 1 1 8 THR H . 8 . HN 1 1
122 1 1 1 1 7 GLY H . 7 . HN 1 1
122 1 2 1 1 7 GLY HA3 . 7 . HA1 1 1
123 1 1 1 1 7 GLY H . 7 . HN 1 1
123 1 2 1 1 7 GLY HA2 . 7 . HA2 1 1
124 1 1 1 1 7 GLY HA3 . 7 . HA1 1 1
124 1 2 1 1 8 THR H . 8 . HN 1 1
125 1 1 1 1 7 GLY HA2 . 7 . HA2 1 1
125 1 2 1 1 8 THR H . 8 . HN 1 1
126 1 1 1 1 7 GLY H . 7 . HN 1 1
126 1 2 1 1 8 THR H . 8 . HN 1 1
127 1 1 1 1 8 THR HA . 8 . HA 1 1
127 1 2 1 1 8 THR MG . 8 . HG2# 1 1
128 1 1 1 1 8 THR H . 8 . HN 1 1
128 1 2 1 1 8 THR HA . 8 . HA 1 1
129 1 1 1 1 8 THR H . 8 . HN 1 1
129 1 2 1 1 8 THR HB . 8 . HB 1 1
130 1 1 1 1 8 THR H . 8 . HN 1 1
130 1 2 1 1 8 THR MG . 8 . HG2# 1 1
131 1 1 1 1 8 THR HA . 8 . HA 1 1
131 1 2 1 1 9 TRP HB2 . 9 . HB2 1 1
132 1 1 1 1 8 THR HA . 8 . HA 1 1
132 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
133 1 1 1 1 8 THR HA . 8 . HA 1 1
133 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
134 1 1 1 1 8 THR HA . 8 . HA 1 1
134 1 2 1 1 9 TRP H . 9 . HN 1 1
135 1 1 1 1 8 THR HB . 8 . HB 1 1
135 1 2 1 1 9 TRP HB2 . 9 . HB2 1 1
136 1 1 1 1 8 THR HB . 8 . HB 1 1
136 1 2 1 1 9 TRP H . 9 . HN 1 1
137 1 1 1 1 8 THR MG . 8 . HG2# 1 1
137 1 2 1 1 9 TRP HB2 . 9 . HB2 1 1
138 1 1 1 1 8 THR MG . 8 . HG2# 1 1
138 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
139 1 1 1 1 8 THR MG . 8 . HG2# 1 1
139 1 2 1 1 9 TRP H . 9 . HN 1 1
140 1 1 1 1 8 THR H . 8 . HN 1 1
140 1 2 1 1 9 TRP H . 9 . HN 1 1
141 1 1 1 1 8 THR HB . 8 . HB 1 1
141 1 2 1 1 10 GLY H . 10 . HN 1 1
142 1 1 1 1 9 TRP HA . 9 . HA 1 1
142 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
143 1 1 1 1 9 TRP HA . 9 . HA 1 1
143 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
144 1 1 1 1 9 TRP HB3 . 9 . HB1 1 1
144 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
145 1 1 1 1 9 TRP HB3 . 9 . HB1 1 1
145 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
146 1 1 1 1 9 TRP H . 9 . HN 1 1
146 1 2 1 1 9 TRP HB3 . 9 . HB1 1 1
147 1 1 1 1 9 TRP HB3 . 9 . HB1 1 1
147 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1
148 1 1 1 1 9 TRP HB2 . 9 . HB2 1 1
148 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
149 1 1 1 1 9 TRP HB2 . 9 . HB2 1 1
149 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1
150 1 1 1 1 9 TRP HB2 . 9 . HB2 1 1
150 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
151 1 1 1 1 9 TRP H . 9 . HN 1 1
151 1 2 1 1 9 TRP HB2 . 9 . HB2 1 1
152 1 1 1 1 9 TRP H . 9 . HN 1 1
152 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
153 1 1 1 1 9 TRP H . 9 . HN 1 1
153 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
154 1 1 1 1 9 TRP HA . 9 . HA 1 1
154 1 2 1 1 10 GLY H . 10 . HN 1 1
155 1 1 1 1 9 TRP HB3 . 9 . HB1 1 1
155 1 2 1 1 10 GLY H . 10 . HN 1 1
156 1 1 1 1 9 TRP HB2 . 9 . HB2 1 1
156 1 2 1 1 10 GLY H . 10 . HN 1 1
157 1 1 1 1 9 TRP HE3 . 9 . HE3 1 1
157 1 2 1 1 10 GLY H . 10 . HN 1 1
158 1 1 1 1 9 TRP H . 9 . HN 1 1
158 1 2 1 1 10 GLY H . 10 . HN 1 1
159 1 1 1 1 10 GLY H . 10 . HN 1 1
159 1 2 1 1 10 GLY QA . 10 . 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 . . . . . 2.5 1.5 3.5 1 1
2 1 . . . . . 3.5 2.0 4.5 1 1
3 1 . . . . . 3.5 2.0 4.5 1 1
4 1 . . . . . 2.5 1.5 3.5 1 1
5 1 . . . . . 2.5 1.5 3.5 1 1
6 1 . . . . . 2.5 1.5 3.5 1 1
7 1 . . . . . 5.0 2.5 6.0 1 1
8 1 . . . . . 2.5 1.5 3.5 1 1
9 1 . . . . . 2.5 1.5 3.5 1 1
10 1 . . . . . 2.5 1.5 3.5 1 1
11 1 . . . . . 2.5 1.5 3.5 1 1
12 1 . . . . . 3.5 2.0 4.5 1 1
13 1 . . . . . 2.0 1.5 2.8 1 1
14 1 . . . . . 5.0 2.5 6.0 1 1
15 1 . . . . . 3.5 2.0 4.5 1 1
16 1 . . . . . 3.5 2.0 4.5 1 1
17 1 . . . . . 5.0 2.5 6.0 1 1
18 1 . . . . . 5.0 2.5 6.0 1 1
19 1 . . . . . 5.0 2.5 6.0 1 1
20 1 . . . . . 3.5 2.0 4.5 1 1
21 1 . . . . . 5.0 2.5 6.0 1 1
22 1 . . . . . 3.5 2.0 4.5 1 1
23 1 . . . . . 5.0 2.5 6.0 1 1
24 1 . . . . . 3.5 2.0 4.5 1 1
25 1 . . . . . 5.0 2.5 6.0 1 1
26 1 . . . . . 3.5 2.0 4.5 1 1
27 1 . . . . . 2.5 1.5 3.5 1 1
28 1 . . . . . 3.5 2.0 4.5 1 1
29 1 . . . . . 3.5 2.0 4.5 1 1
30 1 . . . . . 5.0 2.5 6.0 1 1
31 1 . . . . . 3.5 2.0 4.5 1 1
32 1 . . . . . 3.5 2.0 4.5 1 1
33 1 . . . . . 5.0 2.5 6.0 1 1
34 1 . . . . . 5.0 2.5 6.0 1 1
35 1 . . . . . 3.5 2.0 4.5 1 1
36 1 . . . . . 5.0 2.5 6.0 1 1
37 1 . . . . . 3.5 2.0 4.5 1 1
38 1 . . . . . 3.5 2.0 4.5 1 1
39 1 . . . . . 5.0 2.5 6.0 1 1
40 1 . . . . . 5.0 2.5 6.0 1 1
41 1 . . . . . 5.0 2.5 6.0 1 1
42 1 . . . . . 5.0 2.5 6.0 1 1
43 1 . . . . . 3.5 2.0 4.5 1 1
44 1 . . . . . 5.0 2.5 6.0 1 1
45 1 . . . . . 3.5 2.0 4.5 1 1
46 1 . . . . . 3.5 2.0 4.5 1 1
47 1 . . . . . 5.0 2.5 6.0 1 1
48 1 . . . . . 5.0 2.5 6.0 1 1
49 1 . . . . . 3.5 2.0 4.5 1 1
50 1 . . . . . 3.5 2.0 4.5 1 1
51 1 . . . . . 5.0 2.5 6.0 1 1
52 1 . . . . . 5.0 2.5 6.0 1 1
53 1 . . . . . 5.0 2.5 6.0 1 1
54 1 . . . . . 5.0 2.5 6.0 1 1
55 1 . . . . . 5.0 2.5 6.0 1 1
56 1 . . . . . 5.0 2.5 6.0 1 1
57 1 . . . . . 5.0 2.5 6.0 1 1
58 1 . . . . . 5.0 2.5 6.0 1 1
59 1 . . . . . 5.0 2.5 6.0 1 1
60 1 . . . . . 5.0 2.5 6.0 1 1
61 1 . . . . . 5.0 2.5 6.0 1 1
62 1 . . . . . 2.5 1.5 3.5 1 1
63 1 . . . . . 2.5 1.5 3.5 1 1
64 1 . . . . . 3.5 2.0 4.5 1 1
65 1 . . . . . 3.5 2.0 4.5 1 1
66 1 . . . . . 5.0 2.5 6.0 1 1
67 1 . . . . . 5.0 2.5 6.0 1 1
68 1 . . . . . 5.0 2.5 6.0 1 1
69 1 . . . . . 3.5 2.0 4.5 1 1
70 1 . . . . . 5.0 2.5 6.0 1 1
71 1 . . . . . 3.5 2.0 4.5 1 1
72 1 . . . . . 3.5 2.0 4.5 1 1
73 1 . . . . . 5.0 2.5 6.0 1 1
74 1 . . . . . 5.0 2.5 6.0 1 1
75 1 . . . . . 3.5 2.0 4.5 1 1
76 1 . . . . . 5.0 2.5 6.0 1 1
77 1 . . . . . 5.0 2.5 6.0 1 1
78 1 . . . . . 3.5 2.0 4.5 1 1
79 1 . . . . . 5.0 2.5 6.0 1 1
80 1 . . . . . 3.5 2.0 4.5 1 1
81 1 . . . . . 2.5 1.5 3.5 1 1
82 1 . . . . . 2.5 1.5 3.5 1 1
83 1 . . . . . 3.5 2.0 4.5 1 1
84 1 . . . . . 3.5 2.0 4.5 1 1
85 1 . . . . . 2.5 1.5 3.5 1 1
86 1 . . . . . 2.5 1.5 3.5 1 1
87 1 . . . . . 3.5 2.0 4.5 1 1
88 1 . . . . . 5.0 2.5 6.0 1 1
89 1 . . . . . 5.0 2.5 6.0 1 1
90 1 . . . . . 3.5 2.0 4.5 1 1
91 1 . . . . . 5.0 2.5 6.0 1 1
92 1 . . . . . 3.5 2.0 4.5 1 1
93 1 . . . . . 5.0 2.5 6.0 1 1
94 1 . . . . . 3.5 2.0 4.5 1 1
95 1 . . . . . 5.0 2.5 6.0 1 1
96 1 . . . . . 3.5 2.0 4.5 1 1
97 1 . . . . . 2.5 1.5 3.5 1 1
98 1 . . . . . 3.5 2.0 4.5 1 1
99 1 . . . . . 2.5 1.5 3.5 1 1
100 1 . . . . . 2.0 1.5 2.8 1 1
101 1 . . . . . 2.5 1.5 3.5 1 1
102 1 . . . . . 3.5 2.0 4.5 1 1
103 1 . . . . . 3.5 2.0 4.5 1 1
104 1 . . . . . 5.0 2.5 6.0 1 1
105 1 . . . . . 2.5 1.5 3.5 1 1
106 1 . . . . . 5.0 2.5 6.0 1 1
107 1 . . . . . 5.0 2.5 6.0 1 1
108 1 . . . . . 2.5 1.5 3.5 1 1
109 1 . . . . . 5.0 2.5 6.0 1 1
110 1 . . . . . 5.0 2.5 6.0 1 1
111 1 . . . . . 2.5 1.5 3.5 1 1
112 1 . . . . . 3.5 2.0 4.5 1 1
113 1 . . . . . 3.5 2.0 4.5 1 1
114 1 . . . . . 3.5 2.0 4.5 1 1
115 1 . . . . . 3.5 2.0 4.5 1 1
116 1 . . . . . 5.0 2.5 6.0 1 1
117 1 . . . . . 5.0 2.5 6.0 1 1
118 1 . . . . . 5.0 2.5 6.0 1 1
119 1 . . . . . 5.0 2.5 6.0 1 1
120 1 . . . . . 2.5 1.5 3.5 1 1
121 1 . . . . . 5.0 2.5 6.0 1 1
122 1 . . . . . 2.5 1.5 3.5 1 1
123 1 . . . . . 2.5 1.5 3.5 1 1
124 1 . . . . . 3.5 2.0 4.5 1 1
125 1 . . . . . 3.5 2.0 4.5 1 1
126 1 . . . . . 2.5 1.5 3.5 1 1
127 1 . . . . . 3.5 2.0 4.5 1 1
128 1 . . . . . 2.5 1.5 3.5 1 1
129 1 . . . . . 3.5 2.0 4.5 1 1
130 1 . . . . . 3.5 2.0 4.5 1 1
131 1 . . . . . 5.0 2.5 6.0 1 1
132 1 . . . . . 5.0 2.5 6.0 1 1
133 1 . . . . . 5.0 2.5 6.0 1 1
134 1 . . . . . 2.5 1.5 3.5 1 1
135 1 . . . . . 5.0 2.5 6.0 1 1
136 1 . . . . . 2.5 1.5 3.5 1 1
137 1 . . . . . 5.0 2.5 6.0 1 1
138 1 . . . . . 5.0 2.5 6.0 1 1
139 1 . . . . . 3.5 2.0 4.5 1 1
140 1 . . . . . 3.5 2.0 4.5 1 1
141 1 . . . . . 5.0 2.5 6.0 1 1
142 1 . . . . . 5.0 2.5 6.0 1 1
143 1 . . . . . 3.5 2.0 4.5 1 1
144 1 . . . . . 3.5 2.0 4.5 1 1
145 1 . . . . . 2.5 1.5 3.5 1 1
146 1 . . . . . 3.5 2.0 4.5 1 1
147 1 . . . . . 5.0 2.5 6.0 1 1
148 1 . . . . . 3.5 2.0 4.5 1 1
149 1 . . . . . 5.0 2.5 6.0 1 1
150 1 . . . . . 3.5 2.0 4.5 1 1
151 1 . . . . . 2.5 1.5 3.5 1 1
152 1 . . . . . 3.5 2.0 4.5 1 1
153 1 . . . . . 3.5 2.0 4.5 1 1
154 1 . . . . . 2.5 1.5 3.5 1 1
155 1 . . . . . 3.5 2.0 4.5 1 1
156 1 . . . . . 5.0 2.5 6.0 1 1
157 1 . . . . . 5.0 2.5 6.0 1 1
158 1 . . . . . 3.5 2.0 4.5 1 1
159 1 . . . . . 2.5 1.5 3.5 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "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
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 3 ASP O . 3 . O 1 2
1 1 2 1 1 7 GLY N . 7 . N 1 2
2 1 1 1 1 3 ASP O . 3 . O 1 2
2 1 2 1 1 7 GLY H . 7 . 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 . . . . . 3.3 2.5 3.5 1 2
2 1 . . . . . 2.3 1.5 2.5 1 2
stop_
save_
save_CNS/XPLOR_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 2 TYR N 1 1 2 TYR CA 1 1 2 TYR CB 1 1 2 TYR CG 120.0 240.0 . 2 . N . 2 . CA . 2 . CB . 2 . CG 1 1
2 . 1 1 3 ASP N 1 1 3 ASP CA 1 1 3 ASP CB 1 1 3 ASP CG 120.0 240.0 . 3 . N . 3 . CA . 3 . CB . 3 . CG 1 1
3 . 1 1 9 TRP N 1 1 9 TRP CA 1 1 9 TRP CB 1 1 9 TRP CG -120.0 0.0 . 9 . N . 9 . CA . 9 . CB . 9 . CG 1 1
4 . 1 1 1 GLY C 1 1 2 TYR N 1 1 2 TYR CA 1 1 2 TYR C -190.0 -50.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1
5 . 1 1 2 TYR C 1 1 3 ASP N 1 1 3 ASP CA 1 1 3 ASP C -170.0 -70.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
6 . 1 1 4 PRO C 1 1 5 GLU N 1 1 5 GLU CA 1 1 5 GLU C -190.0 -50.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1
7 . 1 1 5 GLU C 1 1 6 THR N 1 1 6 THR CA 1 1 6 THR C -160.0 -80.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
8 . 1 1 6 THR C 1 1 7 GLY N 1 1 7 GLY CA 1 1 7 GLY C 10.0 170.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
9 . 1 1 7 GLY C 1 1 8 THR N 1 1 8 THR CA 1 1 8 THR C -160.0 -80.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
10 . 1 1 8 THR C 1 1 9 TRP N 1 1 9 TRP CA 1 1 9 TRP C -170.0 -70.0 . 8 . C . 9 . N . 9 . CA . 9 . C 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 GLY C C -5.557 -0.840 2.138 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C -6.878 -0.708 2.896 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H -5.778 -1.527 4.462 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY H2 H -7.214 -2.365 4.112 1.00 . A A . 1 GLY H2 1 1
1 5 1 1 1 GLY H3 H -7.273 -0.879 4.933 1.00 . A A . 1 GLY H3 1 1
1 6 1 1 1 GLY HA2 H -7.677 -1.140 2.309 1.00 . A A . 1 GLY HA2 1 1
1 7 1 1 1 GLY HA3 H -7.085 0.336 3.073 1.00 . A A . 1 GLY HA3 1 1
1 8 1 1 1 GLY N N -6.778 -1.424 4.200 1.00 . A A . 1 GLY N 1 1
1 9 1 1 1 GLY O O -4.640 -1.504 2.579 1.00 . A A . 1 GLY O 1 1
1 10 1 1 2 TYR C C -3.197 0.744 0.717 1.00 . A A . 2 TYR C 1 1
1 11 1 1 2 TYR CA C -4.189 -0.302 0.213 1.00 . A A . 2 TYR CA 1 1
1 12 1 1 2 TYR CB C -4.490 -0.048 -1.264 1.00 . A A . 2 TYR CB 1 1
1 13 1 1 2 TYR CD1 C -2.780 -1.383 -2.544 1.00 . A A . 2 TYR CD1 1 1
1 14 1 1 2 TYR CD2 C -2.474 1.015 -2.342 1.00 . A A . 2 TYR CD2 1 1
1 15 1 1 2 TYR CE1 C -1.601 -1.470 -3.293 1.00 . A A . 2 TYR CE1 1 1
1 16 1 1 2 TYR CE2 C -1.295 0.927 -3.091 1.00 . A A . 2 TYR CE2 1 1
1 17 1 1 2 TYR CG C -3.216 -0.141 -2.068 1.00 . A A . 2 TYR CG 1 1
1 18 1 1 2 TYR CZ C -0.858 -0.315 -3.568 1.00 . A A . 2 TYR CZ 1 1
1 19 1 1 2 TYR H H -6.203 0.317 0.660 1.00 . A A . 2 TYR H 1 1
1 20 1 1 2 TYR HA H -3.763 -1.288 0.328 1.00 . A A . 2 TYR HA 1 1
1 21 1 1 2 TYR HB2 H -5.189 -0.788 -1.616 1.00 . A A . 2 TYR HB2 1 1
1 22 1 1 2 TYR HB3 H -4.918 0.937 -1.380 1.00 . A A . 2 TYR HB3 1 1
1 23 1 1 2 TYR HD1 H -3.352 -2.273 -2.332 1.00 . A A . 2 TYR HD1 1 1
1 24 1 1 2 TYR HD2 H -2.811 1.973 -1.975 1.00 . A A . 2 TYR HD2 1 1
1 25 1 1 2 TYR HE1 H -1.265 -2.429 -3.660 1.00 . A A . 2 TYR HE1 1 1
1 26 1 1 2 TYR HE2 H -0.722 1.818 -3.303 1.00 . A A . 2 TYR HE2 1 1
1 27 1 1 2 TYR HH H 0.765 0.437 -4.234 1.00 . A A . 2 TYR HH 1 1
1 28 1 1 2 TYR N N -5.452 -0.212 0.999 1.00 . A A . 2 TYR N 1 1
1 29 1 1 2 TYR O O -3.252 1.898 0.342 1.00 . A A . 2 TYR O 1 1
1 30 1 1 2 TYR OH O 0.304 -0.402 -4.307 1.00 . A A . 2 TYR OH 1 1
1 31 1 1 3 ASP C C -0.301 1.677 0.964 1.00 . A A . 3 ASP C 1 1
1 32 1 1 3 ASP CA C -1.287 1.320 2.084 1.00 . A A . 3 ASP CA 1 1
1 33 1 1 3 ASP CB C -0.523 0.687 3.249 1.00 . A A . 3 ASP CB 1 1
1 34 1 1 3 ASP CG C 0.418 1.724 3.866 1.00 . A A . 3 ASP CG 1 1
1 35 1 1 3 ASP H H -2.259 -0.588 1.846 1.00 . A A . 3 ASP H 1 1
1 36 1 1 3 ASP HA H -1.795 2.207 2.427 1.00 . A A . 3 ASP HA 1 1
1 37 1 1 3 ASP HB2 H -1.224 0.346 3.997 1.00 . A A . 3 ASP HB2 1 1
1 38 1 1 3 ASP HB3 H 0.055 -0.151 2.889 1.00 . A A . 3 ASP HB3 1 1
1 39 1 1 3 ASP N N -2.287 0.349 1.560 1.00 . A A . 3 ASP N 1 1
1 40 1 1 3 ASP O O 0.433 0.826 0.502 1.00 . A A . 3 ASP O 1 1
1 41 1 1 3 ASP OD1 O -0.069 2.762 4.283 1.00 . A A . 3 ASP OD1 1 1
1 42 1 1 3 ASP OD2 O 1.609 1.463 3.911 1.00 . A A . 3 ASP OD2 1 1
1 43 1 1 4 PRO C C 2.002 3.580 0.021 1.00 . A A . 4 PRO C 1 1
1 44 1 1 4 PRO CA C 0.579 3.407 -0.513 1.00 . A A . 4 PRO CA 1 1
1 45 1 1 4 PRO CB C -0.033 4.752 -0.911 1.00 . A A . 4 PRO CB 1 1
1 46 1 1 4 PRO CD C -1.199 3.960 1.121 1.00 . A A . 4 PRO CD 1 1
1 47 1 1 4 PRO CG C -0.876 5.221 0.298 1.00 . A A . 4 PRO CG 1 1
1 48 1 1 4 PRO HA H 0.567 2.732 -1.353 1.00 . A A . 4 PRO HA 1 1
1 49 1 1 4 PRO HB2 H 0.750 5.467 -1.123 1.00 . A A . 4 PRO HB2 1 1
1 50 1 1 4 PRO HB3 H -0.670 4.630 -1.773 1.00 . A A . 4 PRO HB3 1 1
1 51 1 1 4 PRO HD2 H -0.977 4.125 2.167 1.00 . A A . 4 PRO HD2 1 1
1 52 1 1 4 PRO HD3 H -2.232 3.677 0.991 1.00 . A A . 4 PRO HD3 1 1
1 53 1 1 4 PRO HG2 H -0.308 5.921 0.895 1.00 . A A . 4 PRO HG2 1 1
1 54 1 1 4 PRO HG3 H -1.792 5.679 -0.042 1.00 . A A . 4 PRO HG3 1 1
1 55 1 1 4 PRO N N -0.311 2.922 0.557 1.00 . A A . 4 PRO N 1 1
1 56 1 1 4 PRO O O 2.943 3.738 -0.731 1.00 . A A . 4 PRO O 1 1
1 57 1 1 5 GLU C C 4.420 2.567 1.368 1.00 . A A . 5 GLU C 1 1
1 58 1 1 5 GLU CA C 3.531 3.694 1.893 1.00 . A A . 5 GLU CA 1 1
1 59 1 1 5 GLU CB C 3.450 3.614 3.418 1.00 . A A . 5 GLU CB 1 1
1 60 1 1 5 GLU CD C 5.629 3.303 4.597 1.00 . A A . 5 GLU CD 1 1
1 61 1 1 5 GLU CG C 4.652 4.334 4.030 1.00 . A A . 5 GLU CG 1 1
1 62 1 1 5 GLU H H 1.397 3.406 1.904 1.00 . A A . 5 GLU H 1 1
1 63 1 1 5 GLU HA H 3.944 4.648 1.600 1.00 . A A . 5 GLU HA 1 1
1 64 1 1 5 GLU HB2 H 2.537 4.084 3.756 1.00 . A A . 5 GLU HB2 1 1
1 65 1 1 5 GLU HB3 H 3.457 2.580 3.727 1.00 . A A . 5 GLU HB3 1 1
1 66 1 1 5 GLU HG2 H 5.147 4.918 3.267 1.00 . A A . 5 GLU HG2 1 1
1 67 1 1 5 GLU HG3 H 4.318 4.985 4.823 1.00 . A A . 5 GLU HG3 1 1
1 68 1 1 5 GLU N N 2.168 3.542 1.315 1.00 . A A . 5 GLU N 1 1
1 69 1 1 5 GLU O O 5.577 2.766 1.055 1.00 . A A . 5 GLU O 1 1
1 70 1 1 5 GLU OE1 O 5.649 2.193 4.090 1.00 . A A . 5 GLU OE1 1 1
1 71 1 1 5 GLU OE2 O 6.341 3.640 5.529 1.00 . A A . 5 GLU OE2 1 1
1 72 1 1 6 THR C C 4.218 -0.101 -0.669 1.00 . A A . 6 THR C 1 1
1 73 1 1 6 THR CA C 4.684 0.239 0.748 1.00 . A A . 6 THR CA 1 1
1 74 1 1 6 THR CB C 4.486 -0.974 1.661 1.00 . A A . 6 THR CB 1 1
1 75 1 1 6 THR CG2 C 4.589 -0.535 3.123 1.00 . A A . 6 THR CG2 1 1
1 76 1 1 6 THR H H 2.944 1.248 1.514 1.00 . A A . 6 THR H 1 1
1 77 1 1 6 THR HA H 5.729 0.510 0.729 1.00 . A A . 6 THR HA 1 1
1 78 1 1 6 THR HB H 5.248 -1.709 1.456 1.00 . A A . 6 THR HB 1 1
1 79 1 1 6 THR HG1 H 3.211 -2.440 1.757 1.00 . A A . 6 THR HG1 1 1
1 80 1 1 6 THR HG21 H 5.309 0.265 3.208 1.00 . A A . 6 THR HG21 1 1
1 81 1 1 6 THR HG22 H 4.906 -1.371 3.728 1.00 . A A . 6 THR HG22 1 1
1 82 1 1 6 THR HG23 H 3.625 -0.188 3.464 1.00 . A A . 6 THR HG23 1 1
1 83 1 1 6 THR N N 3.881 1.383 1.261 1.00 . A A . 6 THR N 1 1
1 84 1 1 6 THR O O 4.941 -0.687 -1.449 1.00 . A A . 6 THR O 1 1
1 85 1 1 6 THR OG1 O 3.204 -1.540 1.423 1.00 . A A . 6 THR OG1 1 1
1 86 1 1 7 GLY C C 1.780 -1.368 -2.385 1.00 . A A . 7 GLY C 1 1
1 87 1 1 7 GLY CA C 2.498 -0.018 -2.375 1.00 . A A . 7 GLY CA 1 1
1 88 1 1 7 GLY H H 2.450 0.749 -0.363 1.00 . A A . 7 GLY H 1 1
1 89 1 1 7 GLY HA2 H 1.808 0.760 -2.670 1.00 . A A . 7 GLY HA2 1 1
1 90 1 1 7 GLY HA3 H 3.323 -0.049 -3.071 1.00 . A A . 7 GLY HA3 1 1
1 91 1 1 7 GLY N N 3.014 0.272 -1.008 1.00 . A A . 7 GLY N 1 1
1 92 1 1 7 GLY O O 1.815 -2.091 -3.362 1.00 . A A . 7 GLY O 1 1
1 93 1 1 8 THR C C -0.641 -3.013 -0.162 1.00 . A A . 8 THR C 1 1
1 94 1 1 8 THR CA C 0.411 -3.025 -1.274 1.00 . A A . 8 THR CA 1 1
1 95 1 1 8 THR CB C 1.418 -4.147 -1.011 1.00 . A A . 8 THR CB 1 1
1 96 1 1 8 THR CG2 C 1.682 -4.912 -2.308 1.00 . A A . 8 THR CG2 1 1
1 97 1 1 8 THR H H 1.108 -1.125 -0.531 1.00 . A A . 8 THR H 1 1
1 98 1 1 8 THR HA H -0.073 -3.195 -2.224 1.00 . A A . 8 THR HA 1 1
1 99 1 1 8 THR HB H 1.018 -4.825 -0.273 1.00 . A A . 8 THR HB 1 1
1 100 1 1 8 THR HG1 H 3.275 -4.296 -0.450 1.00 . A A . 8 THR HG1 1 1
1 101 1 1 8 THR HG21 H 0.813 -5.501 -2.562 1.00 . A A . 8 THR HG21 1 1
1 102 1 1 8 THR HG22 H 2.533 -5.563 -2.176 1.00 . A A . 8 THR HG22 1 1
1 103 1 1 8 THR HG23 H 1.885 -4.210 -3.104 1.00 . A A . 8 THR HG23 1 1
1 104 1 1 8 THR N N 1.127 -1.719 -1.310 1.00 . A A . 8 THR N 1 1
1 105 1 1 8 THR O O -0.633 -2.164 0.707 1.00 . A A . 8 THR O 1 1
1 106 1 1 8 THR OG1 O 2.633 -3.587 -0.532 1.00 . A A . 8 THR OG1 1 1
1 107 1 1 9 TRP C C -1.960 -4.395 2.205 1.00 . A A . 9 TRP C 1 1
1 108 1 1 9 TRP CA C -2.598 -4.011 0.868 1.00 . A A . 9 TRP CA 1 1
1 109 1 1 9 TRP CB C -3.640 -5.067 0.487 1.00 . A A . 9 TRP CB 1 1
1 110 1 1 9 TRP CD1 C -3.216 -5.882 -1.873 1.00 . A A . 9 TRP CD1 1 1
1 111 1 1 9 TRP CD2 C -4.743 -4.236 -1.786 1.00 . A A . 9 TRP CD2 1 1
1 112 1 1 9 TRP CE2 C -4.608 -4.591 -3.148 1.00 . A A . 9 TRP CE2 1 1
1 113 1 1 9 TRP CE3 C -5.648 -3.218 -1.454 1.00 . A A . 9 TRP CE3 1 1
1 114 1 1 9 TRP CG C -3.848 -5.068 -0.996 1.00 . A A . 9 TRP CG 1 1
1 115 1 1 9 TRP CH2 C -6.248 -2.947 -3.799 1.00 . A A . 9 TRP CH2 1 1
1 116 1 1 9 TRP CZ2 C -5.349 -3.958 -4.146 1.00 . A A . 9 TRP CZ2 1 1
1 117 1 1 9 TRP CZ3 C -6.398 -2.577 -2.455 1.00 . A A . 9 TRP CZ3 1 1
1 118 1 1 9 TRP H H -1.532 -4.627 -0.892 1.00 . A A . 9 TRP H 1 1
1 119 1 1 9 TRP HA H -3.075 -3.047 0.957 1.00 . A A . 9 TRP HA 1 1
1 120 1 1 9 TRP HB2 H -3.295 -6.041 0.800 1.00 . A A . 9 TRP HB2 1 1
1 121 1 1 9 TRP HB3 H -4.575 -4.843 0.980 1.00 . A A . 9 TRP HB3 1 1
1 122 1 1 9 TRP HD1 H -2.478 -6.628 -1.618 1.00 . A A . 9 TRP HD1 1 1
1 123 1 1 9 TRP HE1 H -3.364 -6.042 -3.968 1.00 . A A . 9 TRP HE1 1 1
1 124 1 1 9 TRP HE3 H -5.766 -2.927 -0.422 1.00 . A A . 9 TRP HE3 1 1
1 125 1 1 9 TRP HH2 H -6.827 -2.451 -4.564 1.00 . A A . 9 TRP HH2 1 1
1 126 1 1 9 TRP HZ2 H -5.228 -4.248 -5.180 1.00 . A A . 9 TRP HZ2 1 1
1 127 1 1 9 TRP HZ3 H -7.093 -1.796 -2.187 1.00 . A A . 9 TRP HZ3 1 1
1 128 1 1 9 TRP N N -1.545 -3.955 -0.184 1.00 . A A . 9 TRP N 1 1
1 129 1 1 9 TRP NE1 N -3.664 -5.596 -3.150 1.00 . A A . 9 TRP NE1 1 1
1 130 1 1 9 TRP O O -1.576 -5.528 2.417 1.00 . A A . 9 TRP O 1 1
1 131 1 1 10 GLY C C -1.877 -5.031 5.014 1.00 . A A . 10 GLY C 1 1
1 132 1 1 10 GLY CA C -1.229 -3.774 4.431 1.00 . A A . 10 GLY CA 1 1
1 133 1 1 10 GLY H H -2.159 -2.553 2.918 1.00 . A A . 10 GLY H 1 1
1 134 1 1 10 GLY HA2 H -0.169 -3.939 4.305 1.00 . A A . 10 GLY HA2 1 1
1 135 1 1 10 GLY HA3 H -1.387 -2.946 5.106 1.00 . A A . 10 GLY HA3 1 1
1 136 1 1 10 GLY N N -1.844 -3.461 3.109 1.00 . A A . 10 GLY N 1 1
1 137 1 1 10 GLY O O -1.289 -6.092 4.882 1.00 . A A . 10 GLY O 1 1
1 138 1 1 10 GLY OXT O -2.949 -4.912 5.584 1.00 . A A . 10 GLY OXT 1 1
2 139 1 1 1 GLY C C -5.810 -0.788 1.910 1.00 . A A . 1 GLY C 1 1
2 140 1 1 1 GLY CA C -7.108 -0.535 2.677 1.00 . A A . 1 GLY CA 1 1
2 141 1 1 1 GLY H1 H -6.981 -2.584 3.026 1.00 . A A . 1 GLY H1 1 1
2 142 1 1 1 GLY H2 H -8.526 -1.930 3.292 1.00 . A A . 1 GLY H2 1 1
2 143 1 1 1 GLY H3 H -7.282 -1.664 4.419 1.00 . A A . 1 GLY H3 1 1
2 144 1 1 1 GLY HA2 H -7.891 -0.262 1.984 1.00 . A A . 1 GLY HA2 1 1
2 145 1 1 1 GLY HA3 H -6.954 0.268 3.382 1.00 . A A . 1 GLY HA3 1 1
2 146 1 1 1 GLY N N -7.505 -1.771 3.409 1.00 . A A . 1 GLY N 1 1
2 147 1 1 1 GLY O O -5.080 -1.717 2.192 1.00 . A A . 1 GLY O 1 1
2 148 1 1 2 TYR C C -3.152 0.704 0.747 1.00 . A A . 2 TYR C 1 1
2 149 1 1 2 TYR CA C -4.264 -0.159 0.153 1.00 . A A . 2 TYR CA 1 1
2 150 1 1 2 TYR CB C -4.507 0.257 -1.299 1.00 . A A . 2 TYR CB 1 1
2 151 1 1 2 TYR CD1 C -2.861 -1.171 -2.566 1.00 . A A . 2 TYR CD1 1 1
2 152 1 1 2 TYR CD2 C -2.431 1.207 -2.362 1.00 . A A . 2 TYR CD2 1 1
2 153 1 1 2 TYR CE1 C -1.684 -1.320 -3.308 1.00 . A A . 2 TYR CE1 1 1
2 154 1 1 2 TYR CE2 C -1.252 1.058 -3.102 1.00 . A A . 2 TYR CE2 1 1
2 155 1 1 2 TYR CG C -3.235 0.093 -2.093 1.00 . A A . 2 TYR CG 1 1
2 156 1 1 2 TYR CZ C -0.879 -0.206 -3.576 1.00 . A A . 2 TYR CZ 1 1
2 157 1 1 2 TYR H H -6.118 0.776 0.728 1.00 . A A . 2 TYR H 1 1
2 158 1 1 2 TYR HA H -3.973 -1.199 0.187 1.00 . A A . 2 TYR HA 1 1
2 159 1 1 2 TYR HB2 H -5.278 -0.364 -1.727 1.00 . A A . 2 TYR HB2 1 1
2 160 1 1 2 TYR HB3 H -4.819 1.290 -1.330 1.00 . A A . 2 TYR HB3 1 1
2 161 1 1 2 TYR HD1 H -3.481 -2.033 -2.358 1.00 . A A . 2 TYR HD1 1 1
2 162 1 1 2 TYR HD2 H -2.719 2.182 -1.996 1.00 . A A . 2 TYR HD2 1 1
2 163 1 1 2 TYR HE1 H -1.398 -2.295 -3.673 1.00 . A A . 2 TYR HE1 1 1
2 164 1 1 2 TYR HE2 H -0.631 1.918 -3.307 1.00 . A A . 2 TYR HE2 1 1
2 165 1 1 2 TYR HH H 0.171 0.120 -5.136 1.00 . A A . 2 TYR HH 1 1
2 166 1 1 2 TYR N N -5.516 0.034 0.939 1.00 . A A . 2 TYR N 1 1
2 167 1 1 2 TYR O O -3.176 1.914 0.651 1.00 . A A . 2 TYR O 1 1
2 168 1 1 2 TYR OH O 0.282 -0.353 -4.308 1.00 . A A . 2 TYR OH 1 1
2 169 1 1 3 ASP C C -0.103 1.322 0.841 1.00 . A A . 3 ASP C 1 1
2 170 1 1 3 ASP CA C -1.061 0.880 1.956 1.00 . A A . 3 ASP CA 1 1
2 171 1 1 3 ASP CB C -0.304 0.005 2.958 1.00 . A A . 3 ASP CB 1 1
2 172 1 1 3 ASP CG C 0.697 0.865 3.732 1.00 . A A . 3 ASP CG 1 1
2 173 1 1 3 ASP H H -2.174 -0.885 1.423 1.00 . A A . 3 ASP H 1 1
2 174 1 1 3 ASP HA H -1.462 1.742 2.464 1.00 . A A . 3 ASP HA 1 1
2 175 1 1 3 ASP HB2 H -1.007 -0.440 3.648 1.00 . A A . 3 ASP HB2 1 1
2 176 1 1 3 ASP HB3 H 0.225 -0.773 2.430 1.00 . A A . 3 ASP HB3 1 1
2 177 1 1 3 ASP N N -2.176 0.092 1.359 1.00 . A A . 3 ASP N 1 1
2 178 1 1 3 ASP O O 0.536 0.497 0.222 1.00 . A A . 3 ASP O 1 1
2 179 1 1 3 ASP OD1 O 1.738 1.171 3.176 1.00 . A A . 3 ASP OD1 1 1
2 180 1 1 3 ASP OD2 O 0.404 1.204 4.867 1.00 . A A . 3 ASP OD2 1 1
2 181 1 1 4 PRO C C 2.288 3.233 0.061 1.00 . A A . 4 PRO C 1 1
2 182 1 1 4 PRO CA C 0.837 3.180 -0.429 1.00 . A A . 4 PRO CA 1 1
2 183 1 1 4 PRO CB C 0.277 4.589 -0.635 1.00 . A A . 4 PRO CB 1 1
2 184 1 1 4 PRO CD C -0.809 3.618 1.367 1.00 . A A . 4 PRO CD 1 1
2 185 1 1 4 PRO CG C -0.488 4.948 0.661 1.00 . A A . 4 PRO CG 1 1
2 186 1 1 4 PRO HA H 0.761 2.614 -1.342 1.00 . A A . 4 PRO HA 1 1
2 187 1 1 4 PRO HB2 H 1.085 5.287 -0.802 1.00 . A A . 4 PRO HB2 1 1
2 188 1 1 4 PRO HB3 H -0.403 4.599 -1.472 1.00 . A A . 4 PRO HB3 1 1
2 189 1 1 4 PRO HD2 H -0.487 3.652 2.400 1.00 . A A . 4 PRO HD2 1 1
2 190 1 1 4 PRO HD3 H -1.862 3.401 1.305 1.00 . A A . 4 PRO HD3 1 1
2 191 1 1 4 PRO HG2 H 0.132 5.569 1.295 1.00 . A A . 4 PRO HG2 1 1
2 192 1 1 4 PRO HG3 H -1.404 5.463 0.420 1.00 . A A . 4 PRO HG3 1 1
2 193 1 1 4 PRO N N -0.034 2.611 0.613 1.00 . A A . 4 PRO N 1 1
2 194 1 1 4 PRO O O 3.218 3.179 -0.719 1.00 . A A . 4 PRO O 1 1
2 195 1 1 5 GLU C C 4.682 2.220 1.325 1.00 . A A . 5 GLU C 1 1
2 196 1 1 5 GLU CA C 3.873 3.391 1.886 1.00 . A A . 5 GLU CA 1 1
2 197 1 1 5 GLU CB C 3.832 3.295 3.414 1.00 . A A . 5 GLU CB 1 1
2 198 1 1 5 GLU CD C 2.599 5.228 4.410 1.00 . A A . 5 GLU CD 1 1
2 199 1 1 5 GLU CG C 3.979 4.691 4.023 1.00 . A A . 5 GLU CG 1 1
2 200 1 1 5 GLU H H 1.721 3.377 1.959 1.00 . A A . 5 GLU H 1 1
2 201 1 1 5 GLU HA H 4.337 4.321 1.595 1.00 . A A . 5 GLU HA 1 1
2 202 1 1 5 GLU HB2 H 2.889 2.865 3.721 1.00 . A A . 5 GLU HB2 1 1
2 203 1 1 5 GLU HB3 H 4.642 2.669 3.756 1.00 . A A . 5 GLU HB3 1 1
2 204 1 1 5 GLU HG2 H 4.603 4.635 4.904 1.00 . A A . 5 GLU HG2 1 1
2 205 1 1 5 GLU HG3 H 4.432 5.354 3.303 1.00 . A A . 5 GLU HG3 1 1
2 206 1 1 5 GLU N N 2.486 3.337 1.347 1.00 . A A . 5 GLU N 1 1
2 207 1 1 5 GLU O O 5.819 2.372 0.924 1.00 . A A . 5 GLU O 1 1
2 208 1 1 5 GLU OE1 O 1.891 5.677 3.525 1.00 . A A . 5 GLU OE1 1 1
2 209 1 1 5 GLU OE2 O 2.275 5.179 5.585 1.00 . A A . 5 GLU OE2 1 1
2 210 1 1 6 THR C C 4.405 -0.389 -0.689 1.00 . A A . 6 THR C 1 1
2 211 1 1 6 THR CA C 4.838 -0.131 0.755 1.00 . A A . 6 THR CA 1 1
2 212 1 1 6 THR CB C 4.520 -1.361 1.609 1.00 . A A . 6 THR CB 1 1
2 213 1 1 6 THR CG2 C 4.799 -1.050 3.079 1.00 . A A . 6 THR CG2 1 1
2 214 1 1 6 THR H H 3.185 0.948 1.619 1.00 . A A . 6 THR H 1 1
2 215 1 1 6 THR HA H 5.899 0.063 0.784 1.00 . A A . 6 THR HA 1 1
2 216 1 1 6 THR HB H 5.140 -2.186 1.295 1.00 . A A . 6 THR HB 1 1
2 217 1 1 6 THR HG1 H 2.874 -2.192 2.226 1.00 . A A . 6 THR HG1 1 1
2 218 1 1 6 THR HG21 H 4.589 -1.923 3.677 1.00 . A A . 6 THR HG21 1 1
2 219 1 1 6 THR HG22 H 4.169 -0.233 3.399 1.00 . A A . 6 THR HG22 1 1
2 220 1 1 6 THR HG23 H 5.836 -0.772 3.197 1.00 . A A . 6 THR HG23 1 1
2 221 1 1 6 THR N N 4.103 1.050 1.291 1.00 . A A . 6 THR N 1 1
2 222 1 1 6 THR O O 5.089 -1.050 -1.444 1.00 . A A . 6 THR O 1 1
2 223 1 1 6 THR OG1 O 3.152 -1.707 1.446 1.00 . A A . 6 THR OG1 1 1
2 224 1 1 7 GLY C C 1.923 -1.342 -2.529 1.00 . A A . 7 GLY C 1 1
2 225 1 1 7 GLY CA C 2.797 -0.088 -2.475 1.00 . A A . 7 GLY CA 1 1
2 226 1 1 7 GLY H H 2.735 0.658 -0.456 1.00 . A A . 7 GLY H 1 1
2 227 1 1 7 GLY HA2 H 2.222 0.769 -2.796 1.00 . A A . 7 GLY HA2 1 1
2 228 1 1 7 GLY HA3 H 3.647 -0.217 -3.129 1.00 . A A . 7 GLY HA3 1 1
2 229 1 1 7 GLY N N 3.272 0.129 -1.080 1.00 . A A . 7 GLY N 1 1
2 230 1 1 7 GLY O O 1.783 -1.969 -3.561 1.00 . A A . 7 GLY O 1 1
2 231 1 1 8 THR C C -0.464 -2.882 -0.206 1.00 . A A . 8 THR C 1 1
2 232 1 1 8 THR CA C 0.470 -2.927 -1.416 1.00 . A A . 8 THR CA 1 1
2 233 1 1 8 THR CB C 1.347 -4.179 -1.338 1.00 . A A . 8 THR CB 1 1
2 234 1 1 8 THR CG2 C 1.320 -4.908 -2.682 1.00 . A A . 8 THR CG2 1 1
2 235 1 1 8 THR H H 1.461 -1.196 -0.604 1.00 . A A . 8 THR H 1 1
2 236 1 1 8 THR HA H -0.117 -2.957 -2.320 1.00 . A A . 8 THR HA 1 1
2 237 1 1 8 THR HB H 0.970 -4.836 -0.569 1.00 . A A . 8 THR HB 1 1
2 238 1 1 8 THR HG1 H 3.157 -4.591 -0.757 1.00 . A A . 8 THR HG1 1 1
2 239 1 1 8 THR HG21 H 1.800 -4.296 -3.432 1.00 . A A . 8 THR HG21 1 1
2 240 1 1 8 THR HG22 H 0.295 -5.091 -2.970 1.00 . A A . 8 THR HG22 1 1
2 241 1 1 8 THR HG23 H 1.844 -5.848 -2.593 1.00 . A A . 8 THR HG23 1 1
2 242 1 1 8 THR N N 1.335 -1.714 -1.426 1.00 . A A . 8 THR N 1 1
2 243 1 1 8 THR O O -0.343 -2.033 0.654 1.00 . A A . 8 THR O 1 1
2 244 1 1 8 THR OG1 O 2.682 -3.802 -1.028 1.00 . A A . 8 THR OG1 1 1
2 245 1 1 9 TRP C C -1.582 -4.213 2.284 1.00 . A A . 9 TRP C 1 1
2 246 1 1 9 TRP CA C -2.338 -3.815 1.014 1.00 . A A . 9 TRP CA 1 1
2 247 1 1 9 TRP CB C -3.438 -4.843 0.745 1.00 . A A . 9 TRP CB 1 1
2 248 1 1 9 TRP CD1 C -3.282 -5.654 -1.650 1.00 . A A . 9 TRP CD1 1 1
2 249 1 1 9 TRP CD2 C -4.778 -4.000 -1.388 1.00 . A A . 9 TRP CD2 1 1
2 250 1 1 9 TRP CE2 C -4.803 -4.354 -2.757 1.00 . A A . 9 TRP CE2 1 1
2 251 1 1 9 TRP CE3 C -5.632 -2.978 -0.953 1.00 . A A . 9 TRP CE3 1 1
2 252 1 1 9 TRP CG C -3.807 -4.837 -0.706 1.00 . A A . 9 TRP CG 1 1
2 253 1 1 9 TRP CH2 C -6.496 -2.697 -3.212 1.00 . A A . 9 TRP CH2 1 1
2 254 1 1 9 TRP CZ2 C -5.649 -3.713 -3.663 1.00 . A A . 9 TRP CZ2 1 1
2 255 1 1 9 TRP CZ3 C -6.486 -2.328 -1.859 1.00 . A A . 9 TRP CZ3 1 1
2 256 1 1 9 TRP H H -1.475 -4.464 -0.840 1.00 . A A . 9 TRP H 1 1
2 257 1 1 9 TRP HA H -2.778 -2.837 1.142 1.00 . A A . 9 TRP HA 1 1
2 258 1 1 9 TRP HB2 H -3.082 -5.825 1.018 1.00 . A A . 9 TRP HB2 1 1
2 259 1 1 9 TRP HB3 H -4.309 -4.601 1.337 1.00 . A A . 9 TRP HB3 1 1
2 260 1 1 9 TRP HD1 H -2.525 -6.403 -1.480 1.00 . A A . 9 TRP HD1 1 1
2 261 1 1 9 TRP HE1 H -3.668 -5.814 -3.714 1.00 . A A . 9 TRP HE1 1 1
2 262 1 1 9 TRP HE3 H -5.625 -2.688 0.085 1.00 . A A . 9 TRP HE3 1 1
2 263 1 1 9 TRP HH2 H -7.154 -2.195 -3.904 1.00 . A A . 9 TRP HH2 1 1
2 264 1 1 9 TRP HZ2 H -5.651 -4.001 -4.704 1.00 . A A . 9 TRP HZ2 1 1
2 265 1 1 9 TRP HZ3 H -7.141 -1.543 -1.512 1.00 . A A . 9 TRP HZ3 1 1
2 266 1 1 9 TRP N N -1.395 -3.793 -0.135 1.00 . A A . 9 TRP N 1 1
2 267 1 1 9 TRP NE1 N -3.871 -5.366 -2.867 1.00 . A A . 9 TRP NE1 1 1
2 268 1 1 9 TRP O O -1.201 -5.354 2.458 1.00 . A A . 9 TRP O 1 1
2 269 1 1 10 GLY C C -1.635 -4.010 5.515 1.00 . A A . 10 GLY C 1 1
2 270 1 1 10 GLY CA C -0.632 -3.613 4.430 1.00 . A A . 10 GLY CA 1 1
2 271 1 1 10 GLY H H -1.678 -2.369 3.015 1.00 . A A . 10 GLY H 1 1
2 272 1 1 10 GLY HA2 H 0.046 -4.434 4.247 1.00 . A A . 10 GLY HA2 1 1
2 273 1 1 10 GLY HA3 H -0.073 -2.750 4.760 1.00 . A A . 10 GLY HA3 1 1
2 274 1 1 10 GLY N N -1.362 -3.283 3.173 1.00 . A A . 10 GLY N 1 1
2 275 1 1 10 GLY O O -1.235 -4.090 6.664 1.00 . A A . 10 GLY O 1 1
2 276 1 1 10 GLY OXT O -2.787 -4.225 5.177 1.00 . A A . 10 GLY OXT 1 1
3 277 1 1 1 GLY C C -5.708 -0.656 2.178 1.00 . A A . 1 GLY C 1 1
3 278 1 1 1 GLY CA C -7.021 -0.411 2.924 1.00 . A A . 1 GLY CA 1 1
3 279 1 1 1 GLY H1 H -9.035 -0.887 2.684 1.00 . A A . 1 GLY H1 1 1
3 280 1 1 1 GLY H2 H -7.967 -2.025 2.011 1.00 . A A . 1 GLY H2 1 1
3 281 1 1 1 GLY H3 H -8.230 -0.538 1.233 1.00 . A A . 1 GLY H3 1 1
3 282 1 1 1 GLY HA2 H -7.184 0.652 3.031 1.00 . A A . 1 GLY HA2 1 1
3 283 1 1 1 GLY HA3 H -6.967 -0.868 3.900 1.00 . A A . 1 GLY HA3 1 1
3 284 1 1 1 GLY N N -8.148 -1.010 2.156 1.00 . A A . 1 GLY N 1 1
3 285 1 1 1 GLY O O -4.872 -1.424 2.609 1.00 . A A . 1 GLY O 1 1
3 286 1 1 2 TYR C C -3.165 0.691 0.861 1.00 . A A . 2 TYR C 1 1
3 287 1 1 2 TYR CA C -4.263 -0.204 0.286 1.00 . A A . 2 TYR CA 1 1
3 288 1 1 2 TYR CB C -4.503 0.171 -1.178 1.00 . A A . 2 TYR CB 1 1
3 289 1 1 2 TYR CD1 C -2.818 -1.205 -2.464 1.00 . A A . 2 TYR CD1 1 1
3 290 1 1 2 TYR CD2 C -2.419 1.172 -2.181 1.00 . A A . 2 TYR CD2 1 1
3 291 1 1 2 TYR CE1 C -1.628 -1.317 -3.194 1.00 . A A . 2 TYR CE1 1 1
3 292 1 1 2 TYR CE2 C -1.228 1.058 -2.909 1.00 . A A . 2 TYR CE2 1 1
3 293 1 1 2 TYR CG C -3.214 0.041 -1.957 1.00 . A A . 2 TYR CG 1 1
3 294 1 1 2 TYR CZ C -0.834 -0.185 -3.416 1.00 . A A . 2 TYR CZ 1 1
3 295 1 1 2 TYR H H -6.209 0.607 0.730 1.00 . A A . 2 TYR H 1 1
3 296 1 1 2 TYR HA H -3.957 -1.238 0.348 1.00 . A A . 2 TYR HA 1 1
3 297 1 1 2 TYR HB2 H -5.247 -0.485 -1.600 1.00 . A A . 2 TYR HB2 1 1
3 298 1 1 2 TYR HB3 H -4.851 1.192 -1.232 1.00 . A A . 2 TYR HB3 1 1
3 299 1 1 2 TYR HD1 H -3.428 -2.082 -2.290 1.00 . A A . 2 TYR HD1 1 1
3 300 1 1 2 TYR HD2 H -2.723 2.132 -1.790 1.00 . A A . 2 TYR HD2 1 1
3 301 1 1 2 TYR HE1 H -1.324 -2.274 -3.587 1.00 . A A . 2 TYR HE1 1 1
3 302 1 1 2 TYR HE2 H -0.615 1.930 -3.080 1.00 . A A . 2 TYR HE2 1 1
3 303 1 1 2 TYR HH H 0.522 0.558 -4.537 1.00 . A A . 2 TYR HH 1 1
3 304 1 1 2 TYR N N -5.521 -0.008 1.061 1.00 . A A . 2 TYR N 1 1
3 305 1 1 2 TYR O O -3.197 1.896 0.719 1.00 . A A . 2 TYR O 1 1
3 306 1 1 2 TYR OH O 0.339 -0.295 -4.135 1.00 . A A . 2 TYR OH 1 1
3 307 1 1 3 ASP C C -0.177 1.413 0.941 1.00 . A A . 3 ASP C 1 1
3 308 1 1 3 ASP CA C -1.090 0.934 2.077 1.00 . A A . 3 ASP CA 1 1
3 309 1 1 3 ASP CB C -0.278 0.084 3.058 1.00 . A A . 3 ASP CB 1 1
3 310 1 1 3 ASP CG C 0.448 0.999 4.044 1.00 . A A . 3 ASP CG 1 1
3 311 1 1 3 ASP H H -2.177 -0.863 1.604 1.00 . A A . 3 ASP H 1 1
3 312 1 1 3 ASP HA H -1.509 1.780 2.598 1.00 . A A . 3 ASP HA 1 1
3 313 1 1 3 ASP HB2 H -0.942 -0.575 3.597 1.00 . A A . 3 ASP HB2 1 1
3 314 1 1 3 ASP HB3 H 0.447 -0.502 2.512 1.00 . A A . 3 ASP HB3 1 1
3 315 1 1 3 ASP N N -2.189 0.112 1.503 1.00 . A A . 3 ASP N 1 1
3 316 1 1 3 ASP O O 0.473 0.612 0.300 1.00 . A A . 3 ASP O 1 1
3 317 1 1 3 ASP OD1 O 0.436 2.200 3.827 1.00 . A A . 3 ASP OD1 1 1
3 318 1 1 3 ASP OD2 O 1.003 0.485 5.001 1.00 . A A . 3 ASP OD2 1 1
3 319 1 1 4 PRO C C 2.140 3.349 0.094 1.00 . A A . 4 PRO C 1 1
3 320 1 1 4 PRO CA C 0.673 3.309 -0.338 1.00 . A A . 4 PRO CA 1 1
3 321 1 1 4 PRO CB C 0.100 4.721 -0.485 1.00 . A A . 4 PRO CB 1 1
3 322 1 1 4 PRO CD C -0.939 3.682 1.504 1.00 . A A . 4 PRO CD 1 1
3 323 1 1 4 PRO CG C -0.621 5.037 0.847 1.00 . A A . 4 PRO CG 1 1
3 324 1 1 4 PRO HA H 0.561 2.768 -1.263 1.00 . A A . 4 PRO HA 1 1
3 325 1 1 4 PRO HB2 H 0.900 5.429 -0.655 1.00 . A A . 4 PRO HB2 1 1
3 326 1 1 4 PRO HB3 H -0.608 4.753 -1.297 1.00 . A A . 4 PRO HB3 1 1
3 327 1 1 4 PRO HD2 H -0.625 3.682 2.540 1.00 . A A . 4 PRO HD2 1 1
3 328 1 1 4 PRO HD3 H -1.993 3.460 1.427 1.00 . A A . 4 PRO HD3 1 1
3 329 1 1 4 PRO HG2 H 0.027 5.621 1.488 1.00 . A A . 4 PRO HG2 1 1
3 330 1 1 4 PRO HG3 H -1.537 5.574 0.655 1.00 . A A . 4 PRO HG3 1 1
3 331 1 1 4 PRO N N -0.154 2.706 0.722 1.00 . A A . 4 PRO N 1 1
3 332 1 1 4 PRO O O 3.039 3.280 -0.722 1.00 . A A . 4 PRO O 1 1
3 333 1 1 5 GLU C C 4.484 2.169 1.473 1.00 . A A . 5 GLU C 1 1
3 334 1 1 5 GLU CA C 3.801 3.485 1.848 1.00 . A A . 5 GLU CA 1 1
3 335 1 1 5 GLU CB C 3.822 3.658 3.368 1.00 . A A . 5 GLU CB 1 1
3 336 1 1 5 GLU CD C 4.769 5.880 4.009 1.00 . A A . 5 GLU CD 1 1
3 337 1 1 5 GLU CG C 3.482 5.108 3.720 1.00 . A A . 5 GLU CG 1 1
3 338 1 1 5 GLU H H 1.654 3.499 2.014 1.00 . A A . 5 GLU H 1 1
3 339 1 1 5 GLU HA H 4.321 4.309 1.381 1.00 . A A . 5 GLU HA 1 1
3 340 1 1 5 GLU HB2 H 3.095 2.997 3.816 1.00 . A A . 5 GLU HB2 1 1
3 341 1 1 5 GLU HB3 H 4.806 3.421 3.744 1.00 . A A . 5 GLU HB3 1 1
3 342 1 1 5 GLU HG2 H 2.963 5.567 2.890 1.00 . A A . 5 GLU HG2 1 1
3 343 1 1 5 GLU HG3 H 2.848 5.127 4.594 1.00 . A A . 5 GLU HG3 1 1
3 344 1 1 5 GLU N N 2.392 3.451 1.370 1.00 . A A . 5 GLU N 1 1
3 345 1 1 5 GLU O O 5.653 2.136 1.139 1.00 . A A . 5 GLU O 1 1
3 346 1 1 5 GLU OE1 O 5.531 5.429 4.849 1.00 . A A . 5 GLU OE1 1 1
3 347 1 1 5 GLU OE2 O 4.974 6.909 3.386 1.00 . A A . 5 GLU OE2 1 1
3 348 1 1 6 THR C C 4.068 -0.529 -0.316 1.00 . A A . 6 THR C 1 1
3 349 1 1 6 THR CA C 4.361 -0.231 1.156 1.00 . A A . 6 THR CA 1 1
3 350 1 1 6 THR CB C 3.754 -1.330 2.030 1.00 . A A . 6 THR CB 1 1
3 351 1 1 6 THR CG2 C 4.451 -2.662 1.739 1.00 . A A . 6 THR CG2 1 1
3 352 1 1 6 THR H H 2.819 1.134 1.784 1.00 . A A . 6 THR H 1 1
3 353 1 1 6 THR HA H 5.430 -0.194 1.311 1.00 . A A . 6 THR HA 1 1
3 354 1 1 6 THR HB H 2.701 -1.425 1.811 1.00 . A A . 6 THR HB 1 1
3 355 1 1 6 THR HG1 H 3.853 -0.041 3.482 1.00 . A A . 6 THR HG1 1 1
3 356 1 1 6 THR HG21 H 5.225 -2.830 2.472 1.00 . A A . 6 THR HG21 1 1
3 357 1 1 6 THR HG22 H 4.890 -2.630 0.752 1.00 . A A . 6 THR HG22 1 1
3 358 1 1 6 THR HG23 H 3.729 -3.463 1.785 1.00 . A A . 6 THR HG23 1 1
3 359 1 1 6 THR N N 3.761 1.083 1.517 1.00 . A A . 6 THR N 1 1
3 360 1 1 6 THR O O 4.689 -1.377 -0.925 1.00 . A A . 6 THR O 1 1
3 361 1 1 6 THR OG1 O 3.926 -0.994 3.399 1.00 . A A . 6 THR OG1 1 1
3 362 1 1 7 GLY C C 1.961 -1.358 -2.443 1.00 . A A . 7 GLY C 1 1
3 363 1 1 7 GLY CA C 2.786 -0.076 -2.322 1.00 . A A . 7 GLY CA 1 1
3 364 1 1 7 GLY H H 2.635 0.843 -0.381 1.00 . A A . 7 GLY H 1 1
3 365 1 1 7 GLY HA2 H 2.214 0.759 -2.702 1.00 . A A . 7 GLY HA2 1 1
3 366 1 1 7 GLY HA3 H 3.695 -0.181 -2.895 1.00 . A A . 7 GLY HA3 1 1
3 367 1 1 7 GLY N N 3.123 0.164 -0.890 1.00 . A A . 7 GLY N 1 1
3 368 1 1 7 GLY O O 1.856 -1.944 -3.503 1.00 . A A . 7 GLY O 1 1
3 369 1 1 8 THR C C -0.377 -3.095 -0.211 1.00 . A A . 8 THR C 1 1
3 370 1 1 8 THR CA C 0.561 -3.045 -1.417 1.00 . A A . 8 THR CA 1 1
3 371 1 1 8 THR CB C 1.487 -4.265 -1.396 1.00 . A A . 8 THR CB 1 1
3 372 1 1 8 THR CG2 C 1.592 -4.851 -2.805 1.00 . A A . 8 THR CG2 1 1
3 373 1 1 8 THR H H 1.477 -1.316 -0.518 1.00 . A A . 8 THR H 1 1
3 374 1 1 8 THR HA H -0.022 -3.054 -2.324 1.00 . A A . 8 THR HA 1 1
3 375 1 1 8 THR HB H 1.084 -5.012 -0.729 1.00 . A A . 8 THR HB 1 1
3 376 1 1 8 THR HG1 H 3.316 -3.690 -1.718 1.00 . A A . 8 THR HG1 1 1
3 377 1 1 8 THR HG21 H 2.245 -4.233 -3.403 1.00 . A A . 8 THR HG21 1 1
3 378 1 1 8 THR HG22 H 0.611 -4.881 -3.257 1.00 . A A . 8 THR HG22 1 1
3 379 1 1 8 THR HG23 H 1.994 -5.852 -2.749 1.00 . A A . 8 THR HG23 1 1
3 380 1 1 8 THR N N 1.378 -1.801 -1.363 1.00 . A A . 8 THR N 1 1
3 381 1 1 8 THR O O -0.289 -2.290 0.694 1.00 . A A . 8 THR O 1 1
3 382 1 1 8 THR OG1 O 2.775 -3.872 -0.946 1.00 . A A . 8 THR OG1 1 1
3 383 1 1 9 TRP C C -1.464 -4.590 2.199 1.00 . A A . 9 TRP C 1 1
3 384 1 1 9 TRP CA C -2.223 -4.154 0.945 1.00 . A A . 9 TRP CA 1 1
3 385 1 1 9 TRP CB C -3.280 -5.204 0.604 1.00 . A A . 9 TRP CB 1 1
3 386 1 1 9 TRP CD1 C -3.164 -5.773 -1.863 1.00 . A A . 9 TRP CD1 1 1
3 387 1 1 9 TRP CD2 C -4.675 -4.177 -1.406 1.00 . A A . 9 TRP CD2 1 1
3 388 1 1 9 TRP CE2 C -4.728 -4.393 -2.802 1.00 . A A . 9 TRP CE2 1 1
3 389 1 1 9 TRP CE3 C -5.527 -3.218 -0.850 1.00 . A A . 9 TRP CE3 1 1
3 390 1 1 9 TRP CG C -3.680 -5.065 -0.831 1.00 . A A . 9 TRP CG 1 1
3 391 1 1 9 TRP CH2 C -6.450 -2.722 -3.046 1.00 . A A . 9 TRP CH2 1 1
3 392 1 1 9 TRP CZ2 C -5.603 -3.677 -3.618 1.00 . A A . 9 TRP CZ2 1 1
3 393 1 1 9 TRP CZ3 C -6.411 -2.492 -1.664 1.00 . A A . 9 TRP CZ3 1 1
3 394 1 1 9 TRP H H -1.331 -4.674 -0.934 1.00 . A A . 9 TRP H 1 1
3 395 1 1 9 TRP HA H -2.701 -3.202 1.119 1.00 . A A . 9 TRP HA 1 1
3 396 1 1 9 TRP HB2 H -2.872 -6.191 0.770 1.00 . A A . 9 TRP HB2 1 1
3 397 1 1 9 TRP HB3 H -4.145 -5.061 1.234 1.00 . A A . 9 TRP HB3 1 1
3 398 1 1 9 TRP HD1 H -2.394 -6.522 -1.785 1.00 . A A . 9 TRP HD1 1 1
3 399 1 1 9 TRP HE1 H -3.599 -5.737 -3.925 1.00 . A A . 9 TRP HE1 1 1
3 400 1 1 9 TRP HE3 H -5.495 -3.034 0.212 1.00 . A A . 9 TRP HE3 1 1
3 401 1 1 9 TRP HH2 H -7.131 -2.161 -3.670 1.00 . A A . 9 TRP HH2 1 1
3 402 1 1 9 TRP HZ2 H -5.629 -3.859 -4.683 1.00 . A A . 9 TRP HZ2 1 1
3 403 1 1 9 TRP HZ3 H -7.065 -1.754 -1.223 1.00 . A A . 9 TRP HZ3 1 1
3 404 1 1 9 TRP N N -1.276 -4.039 -0.194 1.00 . A A . 9 TRP N 1 1
3 405 1 1 9 TRP NE1 N -3.787 -5.377 -3.033 1.00 . A A . 9 TRP NE1 1 1
3 406 1 1 9 TRP O O -0.975 -5.698 2.287 1.00 . A A . 9 TRP O 1 1
3 407 1 1 10 GLY C C -1.523 -3.806 5.632 1.00 . A A . 10 GLY C 1 1
3 408 1 1 10 GLY CA C -0.634 -4.091 4.420 1.00 . A A . 10 GLY CA 1 1
3 409 1 1 10 GLY H H -1.765 -2.837 3.082 1.00 . A A . 10 GLY H 1 1
3 410 1 1 10 GLY HA2 H -0.383 -5.142 4.395 1.00 . A A . 10 GLY HA2 1 1
3 411 1 1 10 GLY HA3 H 0.269 -3.506 4.495 1.00 . A A . 10 GLY HA3 1 1
3 412 1 1 10 GLY N N -1.362 -3.726 3.172 1.00 . A A . 10 GLY N 1 1
3 413 1 1 10 GLY O O -1.861 -4.749 6.329 1.00 . A A . 10 GLY O 1 1
3 414 1 1 10 GLY OXT O -1.850 -2.650 5.843 1.00 . A A . 10 GLY OXT 1 1
4 415 1 1 1 GLY C C -5.407 -1.146 2.232 1.00 . A A . 1 GLY C 1 1
4 416 1 1 1 GLY CA C -6.702 -1.086 3.041 1.00 . A A . 1 GLY CA 1 1
4 417 1 1 1 GLY H1 H -6.679 0.990 2.893 1.00 . A A . 1 GLY H1 1 1
4 418 1 1 1 GLY H2 H -6.185 0.397 4.406 1.00 . A A . 1 GLY H2 1 1
4 419 1 1 1 GLY H3 H -7.830 0.389 3.983 1.00 . A A . 1 GLY H3 1 1
4 420 1 1 1 GLY HA2 H -6.666 -1.817 3.836 1.00 . A A . 1 GLY HA2 1 1
4 421 1 1 1 GLY HA3 H -7.538 -1.300 2.392 1.00 . A A . 1 GLY HA3 1 1
4 422 1 1 1 GLY N N -6.861 0.276 3.625 1.00 . A A . 1 GLY N 1 1
4 423 1 1 1 GLY O O -4.487 -1.867 2.567 1.00 . A A . 1 GLY O 1 1
4 424 1 1 2 TYR C C -3.099 0.627 0.869 1.00 . A A . 2 TYR C 1 1
4 425 1 1 2 TYR CA C -4.087 -0.411 0.341 1.00 . A A . 2 TYR CA 1 1
4 426 1 1 2 TYR CB C -4.428 -0.073 -1.110 1.00 . A A . 2 TYR CB 1 1
4 427 1 1 2 TYR CD1 C -2.669 -1.303 -2.429 1.00 . A A . 2 TYR CD1 1 1
4 428 1 1 2 TYR CD2 C -2.484 1.104 -2.200 1.00 . A A . 2 TYR CD2 1 1
4 429 1 1 2 TYR CE1 C -1.495 -1.321 -3.190 1.00 . A A . 2 TYR CE1 1 1
4 430 1 1 2 TYR CE2 C -1.310 1.087 -2.962 1.00 . A A . 2 TYR CE2 1 1
4 431 1 1 2 TYR CG C -3.164 -0.092 -1.935 1.00 . A A . 2 TYR CG 1 1
4 432 1 1 2 TYR CZ C -0.815 -0.127 -3.457 1.00 . A A . 2 TYR CZ 1 1
4 433 1 1 2 TYR H H -6.077 0.180 0.914 1.00 . A A . 2 TYR H 1 1
4 434 1 1 2 TYR HA H -3.637 -1.392 0.384 1.00 . A A . 2 TYR HA 1 1
4 435 1 1 2 TYR HB2 H -5.122 -0.802 -1.497 1.00 . A A . 2 TYR HB2 1 1
4 436 1 1 2 TYR HB3 H -4.871 0.911 -1.155 1.00 . A A . 2 TYR HB3 1 1
4 437 1 1 2 TYR HD1 H -3.194 -2.226 -2.224 1.00 . A A . 2 TYR HD1 1 1
4 438 1 1 2 TYR HD2 H -2.867 2.038 -1.819 1.00 . A A . 2 TYR HD2 1 1
4 439 1 1 2 TYR HE1 H -1.113 -2.257 -3.571 1.00 . A A . 2 TYR HE1 1 1
4 440 1 1 2 TYR HE2 H -0.786 2.009 -3.166 1.00 . A A . 2 TYR HE2 1 1
4 441 1 1 2 TYR HH H 0.545 0.760 -4.461 1.00 . A A . 2 TYR HH 1 1
4 442 1 1 2 TYR N N -5.325 -0.394 1.168 1.00 . A A . 2 TYR N 1 1
4 443 1 1 2 TYR O O -3.243 1.811 0.631 1.00 . A A . 2 TYR O 1 1
4 444 1 1 2 TYR OH O 0.343 -0.144 -4.207 1.00 . A A . 2 TYR OH 1 1
4 445 1 1 3 ASP C C -0.219 1.654 0.935 1.00 . A A . 3 ASP C 1 1
4 446 1 1 3 ASP CA C -1.093 1.167 2.098 1.00 . A A . 3 ASP CA 1 1
4 447 1 1 3 ASP CB C -0.212 0.475 3.141 1.00 . A A . 3 ASP CB 1 1
4 448 1 1 3 ASP CG C 0.391 1.524 4.076 1.00 . A A . 3 ASP CG 1 1
4 449 1 1 3 ASP H H -1.986 -0.761 1.745 1.00 . A A . 3 ASP H 1 1
4 450 1 1 3 ASP HA H -1.604 1.999 2.553 1.00 . A A . 3 ASP HA 1 1
4 451 1 1 3 ASP HB2 H -0.810 -0.219 3.714 1.00 . A A . 3 ASP HB2 1 1
4 452 1 1 3 ASP HB3 H 0.582 -0.060 2.643 1.00 . A A . 3 ASP HB3 1 1
4 453 1 1 3 ASP N N -2.091 0.198 1.571 1.00 . A A . 3 ASP N 1 1
4 454 1 1 3 ASP O O 0.484 0.870 0.331 1.00 . A A . 3 ASP O 1 1
4 455 1 1 3 ASP OD1 O -0.082 2.648 4.057 1.00 . A A . 3 ASP OD1 1 1
4 456 1 1 3 ASP OD2 O 1.316 1.185 4.797 1.00 . A A . 3 ASP OD2 1 1
4 457 1 1 4 PRO C C 1.965 3.657 -0.040 1.00 . A A . 4 PRO C 1 1
4 458 1 1 4 PRO CA C 0.493 3.535 -0.443 1.00 . A A . 4 PRO CA 1 1
4 459 1 1 4 PRO CB C -0.153 4.911 -0.633 1.00 . A A . 4 PRO CB 1 1
4 460 1 1 4 PRO CD C -1.138 3.888 1.388 1.00 . A A . 4 PRO CD 1 1
4 461 1 1 4 PRO CG C -0.872 5.238 0.695 1.00 . A A . 4 PRO CG 1 1
4 462 1 1 4 PRO HA H 0.393 2.955 -1.346 1.00 . A A . 4 PRO HA 1 1
4 463 1 1 4 PRO HB2 H 0.608 5.650 -0.843 1.00 . A A . 4 PRO HB2 1 1
4 464 1 1 4 PRO HB3 H -0.871 4.876 -1.438 1.00 . A A . 4 PRO HB3 1 1
4 465 1 1 4 PRO HD2 H -0.848 3.933 2.428 1.00 . A A . 4 PRO HD2 1 1
4 466 1 1 4 PRO HD3 H -2.178 3.611 1.293 1.00 . A A . 4 PRO HD3 1 1
4 467 1 1 4 PRO HG2 H -0.239 5.858 1.315 1.00 . A A . 4 PRO HG2 1 1
4 468 1 1 4 PRO HG3 H -1.808 5.737 0.499 1.00 . A A . 4 PRO HG3 1 1
4 469 1 1 4 PRO N N -0.289 2.930 0.651 1.00 . A A . 4 PRO N 1 1
4 470 1 1 4 PRO O O 2.849 3.633 -0.874 1.00 . A A . 4 PRO O 1 1
4 471 1 1 5 GLU C C 4.349 2.537 1.409 1.00 . A A . 5 GLU C 1 1
4 472 1 1 5 GLU CA C 3.656 3.874 1.677 1.00 . A A . 5 GLU CA 1 1
4 473 1 1 5 GLU CB C 3.703 4.185 3.175 1.00 . A A . 5 GLU CB 1 1
4 474 1 1 5 GLU CD C 5.552 5.607 4.075 1.00 . A A . 5 GLU CD 1 1
4 475 1 1 5 GLU CG C 5.158 4.191 3.650 1.00 . A A . 5 GLU CG 1 1
4 476 1 1 5 GLU H H 1.514 3.776 1.891 1.00 . A A . 5 GLU H 1 1
4 477 1 1 5 GLU HA H 4.153 4.658 1.126 1.00 . A A . 5 GLU HA 1 1
4 478 1 1 5 GLU HB2 H 3.261 5.155 3.356 1.00 . A A . 5 GLU HB2 1 1
4 479 1 1 5 GLU HB3 H 3.153 3.431 3.718 1.00 . A A . 5 GLU HB3 1 1
4 480 1 1 5 GLU HG2 H 5.266 3.519 4.490 1.00 . A A . 5 GLU HG2 1 1
4 481 1 1 5 GLU HG3 H 5.801 3.867 2.846 1.00 . A A . 5 GLU HG3 1 1
4 482 1 1 5 GLU N N 2.238 3.771 1.231 1.00 . A A . 5 GLU N 1 1
4 483 1 1 5 GLU O O 5.552 2.464 1.260 1.00 . A A . 5 GLU O 1 1
4 484 1 1 5 GLU OE1 O 4.863 6.535 3.684 1.00 . A A . 5 GLU OE1 1 1
4 485 1 1 5 GLU OE2 O 6.536 5.739 4.785 1.00 . A A . 5 GLU OE2 1 1
4 486 1 1 6 THR C C 3.877 -0.266 -0.367 1.00 . A A . 6 THR C 1 1
4 487 1 1 6 THR CA C 4.181 0.139 1.077 1.00 . A A . 6 THR CA 1 1
4 488 1 1 6 THR CB C 3.570 -0.885 2.036 1.00 . A A . 6 THR CB 1 1
4 489 1 1 6 THR CG2 C 4.635 -1.903 2.445 1.00 . A A . 6 THR CG2 1 1
4 490 1 1 6 THR H H 2.619 1.566 1.461 1.00 . A A . 6 THR H 1 1
4 491 1 1 6 THR HA H 5.250 0.182 1.224 1.00 . A A . 6 THR HA 1 1
4 492 1 1 6 THR HB H 2.756 -1.398 1.546 1.00 . A A . 6 THR HB 1 1
4 493 1 1 6 THR HG1 H 2.385 0.381 2.917 1.00 . A A . 6 THR HG1 1 1
4 494 1 1 6 THR HG21 H 5.236 -2.158 1.584 1.00 . A A . 6 THR HG21 1 1
4 495 1 1 6 THR HG22 H 4.155 -2.793 2.826 1.00 . A A . 6 THR HG22 1 1
4 496 1 1 6 THR HG23 H 5.265 -1.477 3.210 1.00 . A A . 6 THR HG23 1 1
4 497 1 1 6 THR N N 3.587 1.478 1.342 1.00 . A A . 6 THR N 1 1
4 498 1 1 6 THR O O 4.521 -1.128 -0.932 1.00 . A A . 6 THR O 1 1
4 499 1 1 6 THR OG1 O 3.084 -0.217 3.192 1.00 . A A . 6 THR OG1 1 1
4 500 1 1 7 GLY C C 1.863 -1.346 -2.425 1.00 . A A . 7 GLY C 1 1
4 501 1 1 7 GLY CA C 2.549 0.019 -2.375 1.00 . A A . 7 GLY CA 1 1
4 502 1 1 7 GLY H H 2.399 1.051 -0.492 1.00 . A A . 7 GLY H 1 1
4 503 1 1 7 GLY HA2 H 1.880 0.773 -2.769 1.00 . A A . 7 GLY HA2 1 1
4 504 1 1 7 GLY HA3 H 3.447 -0.012 -2.973 1.00 . A A . 7 GLY HA3 1 1
4 505 1 1 7 GLY N N 2.901 0.357 -0.968 1.00 . A A . 7 GLY N 1 1
4 506 1 1 7 GLY O O 1.884 -2.024 -3.434 1.00 . A A . 7 GLY O 1 1
4 507 1 1 8 THR C C -0.444 -3.151 -0.212 1.00 . A A . 8 THR C 1 1
4 508 1 1 8 THR CA C 0.575 -3.086 -1.349 1.00 . A A . 8 THR CA 1 1
4 509 1 1 8 THR CB C 1.618 -4.191 -1.163 1.00 . A A . 8 THR CB 1 1
4 510 1 1 8 THR CG2 C 1.773 -4.975 -2.466 1.00 . A A . 8 THR CG2 1 1
4 511 1 1 8 THR H H 1.248 -1.205 -0.541 1.00 . A A . 8 THR H 1 1
4 512 1 1 8 THR HA H 0.069 -3.228 -2.292 1.00 . A A . 8 THR HA 1 1
4 513 1 1 8 THR HB H 1.298 -4.860 -0.379 1.00 . A A . 8 THR HB 1 1
4 514 1 1 8 THR HG1 H 3.269 -3.266 -1.609 1.00 . A A . 8 THR HG1 1 1
4 515 1 1 8 THR HG21 H 2.152 -5.963 -2.248 1.00 . A A . 8 THR HG21 1 1
4 516 1 1 8 THR HG22 H 2.464 -4.459 -3.116 1.00 . A A . 8 THR HG22 1 1
4 517 1 1 8 THR HG23 H 0.813 -5.057 -2.953 1.00 . A A . 8 THR HG23 1 1
4 518 1 1 8 THR N N 1.256 -1.762 -1.347 1.00 . A A . 8 THR N 1 1
4 519 1 1 8 THR O O -0.426 -2.350 0.702 1.00 . A A . 8 THR O 1 1
4 520 1 1 8 THR OG1 O 2.863 -3.607 -0.809 1.00 . A A . 8 THR OG1 1 1
4 521 1 1 9 TRP C C -1.671 -4.684 2.102 1.00 . A A . 9 TRP C 1 1
4 522 1 1 9 TRP CA C -2.354 -4.240 0.808 1.00 . A A . 9 TRP CA 1 1
4 523 1 1 9 TRP CB C -3.379 -5.295 0.390 1.00 . A A . 9 TRP CB 1 1
4 524 1 1 9 TRP CD1 C -3.039 -5.904 -2.045 1.00 . A A . 9 TRP CD1 1 1
4 525 1 1 9 TRP CD2 C -4.600 -4.315 -1.759 1.00 . A A . 9 TRP CD2 1 1
4 526 1 1 9 TRP CE2 C -4.518 -4.554 -3.149 1.00 . A A . 9 TRP CE2 1 1
4 527 1 1 9 TRP CE3 C -5.511 -3.353 -1.305 1.00 . A A . 9 TRP CE3 1 1
4 528 1 1 9 TRP CG C -3.652 -5.182 -1.078 1.00 . A A . 9 TRP CG 1 1
4 529 1 1 9 TRP CH2 C -6.224 -2.907 -3.590 1.00 . A A . 9 TRP CH2 1 1
4 530 1 1 9 TRP CZ2 C -5.317 -3.861 -4.059 1.00 . A A . 9 TRP CZ2 1 1
4 531 1 1 9 TRP CZ3 C -6.320 -2.652 -2.215 1.00 . A A . 9 TRP CZ3 1 1
4 532 1 1 9 TRP H H -1.327 -4.736 -1.008 1.00 . A A . 9 TRP H 1 1
4 533 1 1 9 TRP HA H -2.847 -3.292 0.962 1.00 . A A . 9 TRP HA 1 1
4 534 1 1 9 TRP HB2 H -2.990 -6.278 0.607 1.00 . A A . 9 TRP HB2 1 1
4 535 1 1 9 TRP HB3 H -4.297 -5.142 0.939 1.00 . A A . 9 TRP HB3 1 1
4 536 1 1 9 TRP HD1 H -2.273 -6.647 -1.883 1.00 . A A . 9 TRP HD1 1 1
4 537 1 1 9 TRP HE1 H -3.276 -5.900 -4.137 1.00 . A A . 9 TRP HE1 1 1
4 538 1 1 9 TRP HE3 H -5.586 -3.150 -0.248 1.00 . A A . 9 TRP HE3 1 1
4 539 1 1 9 TRP HH2 H -6.847 -2.365 -4.286 1.00 . A A . 9 TRP HH2 1 1
4 540 1 1 9 TRP HZ2 H -5.238 -4.063 -5.118 1.00 . A A . 9 TRP HZ2 1 1
4 541 1 1 9 TRP HZ3 H -7.021 -1.913 -1.852 1.00 . A A . 9 TRP HZ3 1 1
4 542 1 1 9 TRP N N -1.332 -4.105 -0.263 1.00 . A A . 9 TRP N 1 1
4 543 1 1 9 TRP NE1 N -3.550 -5.529 -3.274 1.00 . A A . 9 TRP NE1 1 1
4 544 1 1 9 TRP O O -0.460 -4.659 2.216 1.00 . A A . 9 TRP O 1 1
4 545 1 1 10 GLY C C -2.838 -5.397 5.496 1.00 . A A . 10 GLY C 1 1
4 546 1 1 10 GLY CA C -1.819 -5.538 4.363 1.00 . A A . 10 GLY CA 1 1
4 547 1 1 10 GLY H H -3.406 -5.105 2.970 1.00 . A A . 10 GLY H 1 1
4 548 1 1 10 GLY HA2 H -1.515 -6.571 4.276 1.00 . A A . 10 GLY HA2 1 1
4 549 1 1 10 GLY HA3 H -0.957 -4.925 4.582 1.00 . A A . 10 GLY HA3 1 1
4 550 1 1 10 GLY N N -2.432 -5.092 3.080 1.00 . A A . 10 GLY N 1 1
4 551 1 1 10 GLY O O -2.649 -4.529 6.332 1.00 . A A . 10 GLY O 1 1
4 552 1 1 10 GLY OXT O -3.789 -6.161 5.507 1.00 . A A . 10 GLY OXT 1 1
5 553 1 1 1 GLY C C -6.101 0.059 1.866 1.00 . A A . 1 GLY C 1 1
5 554 1 1 1 GLY CA C -7.446 0.444 2.482 1.00 . A A . 1 GLY CA 1 1
5 555 1 1 1 GLY H1 H -8.669 -1.182 2.922 1.00 . A A . 1 GLY H1 1 1
5 556 1 1 1 GLY H2 H -8.127 -1.137 1.312 1.00 . A A . 1 GLY H2 1 1
5 557 1 1 1 GLY H3 H -9.352 -0.080 1.830 1.00 . A A . 1 GLY H3 1 1
5 558 1 1 1 GLY HA2 H -7.746 1.416 2.116 1.00 . A A . 1 GLY HA2 1 1
5 559 1 1 1 GLY HA3 H -7.349 0.479 3.557 1.00 . A A . 1 GLY HA3 1 1
5 560 1 1 1 GLY N N -8.477 -0.565 2.108 1.00 . A A . 1 GLY N 1 1
5 561 1 1 1 GLY O O -5.311 -0.645 2.464 1.00 . A A . 1 GLY O 1 1
5 562 1 1 2 TYR C C -3.415 0.967 0.687 1.00 . A A . 2 TYR C 1 1
5 563 1 1 2 TYR CA C -4.540 0.178 0.017 1.00 . A A . 2 TYR CA 1 1
5 564 1 1 2 TYR CB C -4.614 0.544 -1.468 1.00 . A A . 2 TYR CB 1 1
5 565 1 1 2 TYR CD1 C -2.829 -1.005 -2.364 1.00 . A A . 2 TYR CD1 1 1
5 566 1 1 2 TYR CD2 C -2.479 1.395 -2.493 1.00 . A A . 2 TYR CD2 1 1
5 567 1 1 2 TYR CE1 C -1.589 -1.216 -2.980 1.00 . A A . 2 TYR CE1 1 1
5 568 1 1 2 TYR CE2 C -1.240 1.181 -3.107 1.00 . A A . 2 TYR CE2 1 1
5 569 1 1 2 TYR CG C -3.274 0.304 -2.121 1.00 . A A . 2 TYR CG 1 1
5 570 1 1 2 TYR CZ C -0.795 -0.123 -3.350 1.00 . A A . 2 TYR CZ 1 1
5 571 1 1 2 TYR H H -6.485 1.082 0.209 1.00 . A A . 2 TYR H 1 1
5 572 1 1 2 TYR HA H -4.347 -0.878 0.119 1.00 . A A . 2 TYR HA 1 1
5 573 1 1 2 TYR HB2 H -5.363 -0.063 -1.951 1.00 . A A . 2 TYR HB2 1 1
5 574 1 1 2 TYR HB3 H -4.878 1.586 -1.567 1.00 . A A . 2 TYR HB3 1 1
5 575 1 1 2 TYR HD1 H -3.440 -1.852 -2.077 1.00 . A A . 2 TYR HD1 1 1
5 576 1 1 2 TYR HD2 H -2.822 2.401 -2.305 1.00 . A A . 2 TYR HD2 1 1
5 577 1 1 2 TYR HE1 H -1.245 -2.223 -3.167 1.00 . A A . 2 TYR HE1 1 1
5 578 1 1 2 TYR HE2 H -0.626 2.024 -3.392 1.00 . A A . 2 TYR HE2 1 1
5 579 1 1 2 TYR HH H 0.426 0.148 -4.792 1.00 . A A . 2 TYR HH 1 1
5 580 1 1 2 TYR N N -5.835 0.515 0.673 1.00 . A A . 2 TYR N 1 1
5 581 1 1 2 TYR O O -3.544 2.144 0.953 1.00 . A A . 2 TYR O 1 1
5 582 1 1 2 TYR OH O 0.424 -0.331 -3.961 1.00 . A A . 2 TYR OH 1 1
5 583 1 1 3 ASP C C -0.189 1.505 0.547 1.00 . A A . 3 ASP C 1 1
5 584 1 1 3 ASP CA C -1.181 1.038 1.619 1.00 . A A . 3 ASP CA 1 1
5 585 1 1 3 ASP CB C -0.474 0.081 2.580 1.00 . A A . 3 ASP CB 1 1
5 586 1 1 3 ASP CG C -0.120 0.821 3.871 1.00 . A A . 3 ASP CG 1 1
5 587 1 1 3 ASP H H -2.233 -0.625 0.743 1.00 . A A . 3 ASP H 1 1
5 588 1 1 3 ASP HA H -1.558 1.885 2.170 1.00 . A A . 3 ASP HA 1 1
5 589 1 1 3 ASP HB2 H -1.128 -0.749 2.808 1.00 . A A . 3 ASP HB2 1 1
5 590 1 1 3 ASP HB3 H 0.430 -0.288 2.121 1.00 . A A . 3 ASP HB3 1 1
5 591 1 1 3 ASP N N -2.314 0.326 0.964 1.00 . A A . 3 ASP N 1 1
5 592 1 1 3 ASP O O 0.496 0.696 -0.046 1.00 . A A . 3 ASP O 1 1
5 593 1 1 3 ASP OD1 O -0.012 2.035 3.824 1.00 . A A . 3 ASP OD1 1 1
5 594 1 1 3 ASP OD2 O 0.037 0.162 4.885 1.00 . A A . 3 ASP OD2 1 1
5 595 1 1 4 PRO C C 2.199 3.435 -0.121 1.00 . A A . 4 PRO C 1 1
5 596 1 1 4 PRO CA C 0.769 3.390 -0.667 1.00 . A A . 4 PRO CA 1 1
5 597 1 1 4 PRO CB C 0.210 4.799 -0.870 1.00 . A A . 4 PRO CB 1 1
5 598 1 1 4 PRO CD C -0.966 3.782 1.054 1.00 . A A . 4 PRO CD 1 1
5 599 1 1 4 PRO CG C -0.609 5.130 0.400 1.00 . A A . 4 PRO CG 1 1
5 600 1 1 4 PRO HA H 0.731 2.839 -1.593 1.00 . A A . 4 PRO HA 1 1
5 601 1 1 4 PRO HB2 H 1.021 5.505 -0.989 1.00 . A A . 4 PRO HB2 1 1
5 602 1 1 4 PRO HB3 H -0.434 4.823 -1.735 1.00 . A A . 4 PRO HB3 1 1
5 603 1 1 4 PRO HD2 H -0.715 3.795 2.106 1.00 . A A . 4 PRO HD2 1 1
5 604 1 1 4 PRO HD3 H -2.012 3.561 0.917 1.00 . A A . 4 PRO HD3 1 1
5 605 1 1 4 PRO HG2 H -0.016 5.729 1.077 1.00 . A A . 4 PRO HG2 1 1
5 606 1 1 4 PRO HG3 H -1.512 5.655 0.133 1.00 . A A . 4 PRO HG3 1 1
5 607 1 1 4 PRO N N -0.136 2.796 0.330 1.00 . A A . 4 PRO N 1 1
5 608 1 1 4 PRO O O 3.159 3.384 -0.863 1.00 . A A . 4 PRO O 1 1
5 609 1 1 5 GLU C C 4.525 2.386 1.220 1.00 . A A . 5 GLU C 1 1
5 610 1 1 5 GLU CA C 3.715 3.565 1.762 1.00 . A A . 5 GLU CA 1 1
5 611 1 1 5 GLU CB C 3.621 3.459 3.286 1.00 . A A . 5 GLU CB 1 1
5 612 1 1 5 GLU CD C 4.027 4.836 5.330 1.00 . A A . 5 GLU CD 1 1
5 613 1 1 5 GLU CG C 3.506 4.859 3.891 1.00 . A A . 5 GLU CG 1 1
5 614 1 1 5 GLU H H 1.561 3.559 1.757 1.00 . A A . 5 GLU H 1 1
5 615 1 1 5 GLU HA H 4.199 4.492 1.492 1.00 . A A . 5 GLU HA 1 1
5 616 1 1 5 GLU HB2 H 2.751 2.877 3.554 1.00 . A A . 5 GLU HB2 1 1
5 617 1 1 5 GLU HB3 H 4.509 2.976 3.668 1.00 . A A . 5 GLU HB3 1 1
5 618 1 1 5 GLU HG2 H 4.091 5.554 3.306 1.00 . A A . 5 GLU HG2 1 1
5 619 1 1 5 GLU HG3 H 2.471 5.168 3.890 1.00 . A A . 5 GLU HG3 1 1
5 620 1 1 5 GLU N N 2.347 3.524 1.174 1.00 . A A . 5 GLU N 1 1
5 621 1 1 5 GLU O O 5.604 2.552 0.686 1.00 . A A . 5 GLU O 1 1
5 622 1 1 5 GLU OE1 O 4.862 3.995 5.623 1.00 . A A . 5 GLU OE1 1 1
5 623 1 1 5 GLU OE2 O 3.582 5.657 6.113 1.00 . A A . 5 GLU OE2 1 1
5 624 1 1 6 THR C C 4.155 -0.405 -0.517 1.00 . A A . 6 THR C 1 1
5 625 1 1 6 THR CA C 4.738 0.004 0.838 1.00 . A A . 6 THR CA 1 1
5 626 1 1 6 THR CB C 4.587 -1.152 1.831 1.00 . A A . 6 THR CB 1 1
5 627 1 1 6 THR CG2 C 3.105 -1.385 2.128 1.00 . A A . 6 THR CG2 1 1
5 628 1 1 6 THR H H 3.134 1.086 1.779 1.00 . A A . 6 THR H 1 1
5 629 1 1 6 THR HA H 5.784 0.245 0.721 1.00 . A A . 6 THR HA 1 1
5 630 1 1 6 THR HB H 5.099 -0.905 2.750 1.00 . A A . 6 THR HB 1 1
5 631 1 1 6 THR HG1 H 5.844 -2.635 1.869 1.00 . A A . 6 THR HG1 1 1
5 632 1 1 6 THR HG21 H 2.506 -0.917 1.361 1.00 . A A . 6 THR HG21 1 1
5 633 1 1 6 THR HG22 H 2.858 -0.958 3.089 1.00 . A A . 6 THR HG22 1 1
5 634 1 1 6 THR HG23 H 2.904 -2.446 2.144 1.00 . A A . 6 THR HG23 1 1
5 635 1 1 6 THR N N 4.007 1.196 1.349 1.00 . A A . 6 THR N 1 1
5 636 1 1 6 THR O O 4.673 -1.272 -1.192 1.00 . A A . 6 THR O 1 1
5 637 1 1 6 THR OG1 O 5.154 -2.329 1.276 1.00 . A A . 6 THR OG1 1 1
5 638 1 1 7 GLY C C 1.805 -1.506 -2.150 1.00 . A A . 7 GLY C 1 1
5 639 1 1 7 GLY CA C 2.465 -0.129 -2.236 1.00 . A A . 7 GLY CA 1 1
5 640 1 1 7 GLY H H 2.679 0.918 -0.367 1.00 . A A . 7 GLY H 1 1
5 641 1 1 7 GLY HA2 H 1.722 0.612 -2.491 1.00 . A A . 7 GLY HA2 1 1
5 642 1 1 7 GLY HA3 H 3.231 -0.149 -2.997 1.00 . A A . 7 GLY HA3 1 1
5 643 1 1 7 GLY N N 3.080 0.218 -0.924 1.00 . A A . 7 GLY N 1 1
5 644 1 1 7 GLY O O 1.777 -2.250 -3.110 1.00 . A A . 7 GLY O 1 1
5 645 1 1 8 THR C C -0.326 -3.191 0.321 1.00 . A A . 8 THR C 1 1
5 646 1 1 8 THR CA C 0.617 -3.185 -0.881 1.00 . A A . 8 THR CA 1 1
5 647 1 1 8 THR CB C 1.688 -4.263 -0.697 1.00 . A A . 8 THR CB 1 1
5 648 1 1 8 THR CG2 C 1.388 -5.446 -1.619 1.00 . A A . 8 THR CG2 1 1
5 649 1 1 8 THR H H 1.303 -1.243 -0.245 1.00 . A A . 8 THR H 1 1
5 650 1 1 8 THR HA H 0.049 -3.394 -1.775 1.00 . A A . 8 THR HA 1 1
5 651 1 1 8 THR HB H 1.687 -4.602 0.328 1.00 . A A . 8 THR HB 1 1
5 652 1 1 8 THR HG1 H 3.595 -4.057 -0.380 1.00 . A A . 8 THR HG1 1 1
5 653 1 1 8 THR HG21 H 2.273 -6.056 -1.720 1.00 . A A . 8 THR HG21 1 1
5 654 1 1 8 THR HG22 H 1.093 -5.078 -2.590 1.00 . A A . 8 THR HG22 1 1
5 655 1 1 8 THR HG23 H 0.588 -6.037 -1.198 1.00 . A A . 8 THR HG23 1 1
5 656 1 1 8 THR N N 1.273 -1.855 -1.010 1.00 . A A . 8 THR N 1 1
5 657 1 1 8 THR O O -0.175 -2.425 1.252 1.00 . A A . 8 THR O 1 1
5 658 1 1 8 THR OG1 O 2.961 -3.720 -1.017 1.00 . A A . 8 THR OG1 1 1
5 659 1 1 9 TRP C C -1.569 -4.678 2.673 1.00 . A A . 9 TRP C 1 1
5 660 1 1 9 TRP CA C -2.268 -4.135 1.424 1.00 . A A . 9 TRP CA 1 1
5 661 1 1 9 TRP CB C -3.397 -5.085 1.026 1.00 . A A . 9 TRP CB 1 1
5 662 1 1 9 TRP CD1 C -3.313 -5.534 -1.467 1.00 . A A . 9 TRP CD1 1 1
5 663 1 1 9 TRP CD2 C -4.694 -3.852 -0.931 1.00 . A A . 9 TRP CD2 1 1
5 664 1 1 9 TRP CE2 C -4.759 -3.991 -2.335 1.00 . A A . 9 TRP CE2 1 1
5 665 1 1 9 TRP CE3 C -5.468 -2.859 -0.326 1.00 . A A . 9 TRP CE3 1 1
5 666 1 1 9 TRP CG C -3.777 -4.842 -0.402 1.00 . A A . 9 TRP CG 1 1
5 667 1 1 9 TRP CH2 C -6.342 -2.178 -2.494 1.00 . A A . 9 TRP CH2 1 1
5 668 1 1 9 TRP CZ2 C -5.572 -3.167 -3.113 1.00 . A A . 9 TRP CZ2 1 1
5 669 1 1 9 TRP CZ3 C -6.289 -2.023 -1.101 1.00 . A A . 9 TRP CZ3 1 1
5 670 1 1 9 TRP H H -1.401 -4.658 -0.463 1.00 . A A . 9 TRP H 1 1
5 671 1 1 9 TRP HA H -2.671 -3.157 1.628 1.00 . A A . 9 TRP HA 1 1
5 672 1 1 9 TRP HB2 H -3.063 -6.105 1.140 1.00 . A A . 9 TRP HB2 1 1
5 673 1 1 9 TRP HB3 H -4.253 -4.912 1.661 1.00 . A A . 9 TRP HB3 1 1
5 674 1 1 9 TRP HD1 H -2.605 -6.342 -1.429 1.00 . A A . 9 TRP HD1 1 1
5 675 1 1 9 TRP HE1 H -3.734 -5.360 -3.526 1.00 . A A . 9 TRP HE1 1 1
5 676 1 1 9 TRP HE3 H -5.423 -2.733 0.743 1.00 . A A . 9 TRP HE3 1 1
5 677 1 1 9 TRP HH2 H -6.974 -1.534 -3.086 1.00 . A A . 9 TRP HH2 1 1
5 678 1 1 9 TRP HZ2 H -5.607 -3.292 -4.185 1.00 . A A . 9 TRP HZ2 1 1
5 679 1 1 9 TRP HZ3 H -6.884 -1.259 -0.622 1.00 . A A . 9 TRP HZ3 1 1
5 680 1 1 9 TRP N N -1.300 -4.057 0.301 1.00 . A A . 9 TRP N 1 1
5 681 1 1 9 TRP NE1 N -3.897 -5.031 -2.617 1.00 . A A . 9 TRP NE1 1 1
5 682 1 1 9 TRP O O -1.867 -4.283 3.784 1.00 . A A . 9 TRP O 1 1
5 683 1 1 10 GLY C C 1.343 -5.359 3.947 1.00 . A A . 10 GLY C 1 1
5 684 1 1 10 GLY CA C 0.066 -6.155 3.681 1.00 . A A . 10 GLY CA 1 1
5 685 1 1 10 GLY H H -0.426 -5.890 1.599 1.00 . A A . 10 GLY H 1 1
5 686 1 1 10 GLY HA2 H -0.578 -6.106 4.548 1.00 . A A . 10 GLY HA2 1 1
5 687 1 1 10 GLY HA3 H 0.322 -7.185 3.481 1.00 . A A . 10 GLY HA3 1 1
5 688 1 1 10 GLY N N -0.647 -5.584 2.502 1.00 . A A . 10 GLY N 1 1
5 689 1 1 10 GLY O O 2.107 -5.172 3.014 1.00 . A A . 10 GLY O 1 1
5 690 1 1 10 GLY OXT O 1.538 -4.950 5.080 1.00 . A A . 10 GLY OXT 1 1
6 691 1 1 1 GLY C C -5.868 -0.719 2.117 1.00 . A A . 1 GLY C 1 1
6 692 1 1 1 GLY CA C -7.240 -0.535 2.770 1.00 . A A . 1 GLY CA 1 1
6 693 1 1 1 GLY H1 H -7.638 -2.551 3.119 1.00 . A A . 1 GLY H1 1 1
6 694 1 1 1 GLY H2 H -8.385 -1.495 4.220 1.00 . A A . 1 GLY H2 1 1
6 695 1 1 1 GLY H3 H -6.720 -1.807 4.335 1.00 . A A . 1 GLY H3 1 1
6 696 1 1 1 GLY HA2 H -8.002 -0.490 2.005 1.00 . A A . 1 GLY HA2 1 1
6 697 1 1 1 GLY HA3 H -7.244 0.382 3.338 1.00 . A A . 1 GLY HA3 1 1
6 698 1 1 1 GLY N N -7.517 -1.684 3.679 1.00 . A A . 1 GLY N 1 1
6 699 1 1 1 GLY O O -4.998 -1.376 2.652 1.00 . A A . 1 GLY O 1 1
6 700 1 1 2 TYR C C -3.300 0.536 1.022 1.00 . A A . 2 TYR C 1 1
6 701 1 1 2 TYR CA C -4.355 -0.281 0.277 1.00 . A A . 2 TYR CA 1 1
6 702 1 1 2 TYR CB C -4.475 0.230 -1.159 1.00 . A A . 2 TYR CB 1 1
6 703 1 1 2 TYR CD1 C -2.723 -1.118 -2.372 1.00 . A A . 2 TYR CD1 1 1
6 704 1 1 2 TYR CD2 C -2.318 1.241 -1.974 1.00 . A A . 2 TYR CD2 1 1
6 705 1 1 2 TYR CE1 C -1.485 -1.221 -3.017 1.00 . A A . 2 TYR CE1 1 1
6 706 1 1 2 TYR CE2 C -1.080 1.138 -2.618 1.00 . A A . 2 TYR CE2 1 1
6 707 1 1 2 TYR CG C -3.138 0.115 -1.850 1.00 . A A . 2 TYR CG 1 1
6 708 1 1 2 TYR CZ C -0.663 -0.093 -3.140 1.00 . A A . 2 TYR CZ 1 1
6 709 1 1 2 TYR H H -6.385 0.386 0.551 1.00 . A A . 2 TYR H 1 1
6 710 1 1 2 TYR HA H -4.064 -1.320 0.266 1.00 . A A . 2 TYR HA 1 1
6 711 1 1 2 TYR HB2 H -5.205 -0.358 -1.692 1.00 . A A . 2 TYR HB2 1 1
6 712 1 1 2 TYR HB3 H -4.784 1.265 -1.149 1.00 . A A . 2 TYR HB3 1 1
6 713 1 1 2 TYR HD1 H -3.355 -1.991 -2.275 1.00 . A A . 2 TYR HD1 1 1
6 714 1 1 2 TYR HD2 H -2.639 2.191 -1.572 1.00 . A A . 2 TYR HD2 1 1
6 715 1 1 2 TYR HE1 H -1.164 -2.168 -3.422 1.00 . A A . 2 TYR HE1 1 1
6 716 1 1 2 TYR HE2 H -0.445 2.008 -2.713 1.00 . A A . 2 TYR HE2 1 1
6 717 1 1 2 TYR HH H 0.433 0.054 -4.695 1.00 . A A . 2 TYR HH 1 1
6 718 1 1 2 TYR N N -5.670 -0.141 0.964 1.00 . A A . 2 TYR N 1 1
6 719 1 1 2 TYR O O -3.612 1.357 1.860 1.00 . A A . 2 TYR O 1 1
6 720 1 1 2 TYR OH O 0.556 -0.195 -3.777 1.00 . A A . 2 TYR OH 1 1
6 721 1 1 3 ASP C C -0.067 1.728 0.344 1.00 . A A . 3 ASP C 1 1
6 722 1 1 3 ASP CA C -0.973 1.084 1.402 1.00 . A A . 3 ASP CA 1 1
6 723 1 1 3 ASP CB C -0.147 0.131 2.269 1.00 . A A . 3 ASP CB 1 1
6 724 1 1 3 ASP CG C 0.071 0.754 3.648 1.00 . A A . 3 ASP CG 1 1
6 725 1 1 3 ASP H H -1.821 -0.345 0.035 1.00 . A A . 3 ASP H 1 1
6 726 1 1 3 ASP HA H -1.413 1.846 2.026 1.00 . A A . 3 ASP HA 1 1
6 727 1 1 3 ASP HB2 H -0.676 -0.807 2.376 1.00 . A A . 3 ASP HB2 1 1
6 728 1 1 3 ASP HB3 H 0.809 -0.047 1.800 1.00 . A A . 3 ASP HB3 1 1
6 729 1 1 3 ASP N N -2.051 0.320 0.717 1.00 . A A . 3 ASP N 1 1
6 730 1 1 3 ASP O O 0.622 1.033 -0.373 1.00 . A A . 3 ASP O 1 1
6 731 1 1 3 ASP OD1 O -0.877 1.306 4.184 1.00 . A A . 3 ASP OD1 1 1
6 732 1 1 3 ASP OD2 O 1.181 0.671 4.145 1.00 . A A . 3 ASP OD2 1 1
6 733 1 1 4 PRO C C 2.170 3.883 -0.233 1.00 . A A . 4 PRO C 1 1
6 734 1 1 4 PRO CA C 0.715 3.785 -0.703 1.00 . A A . 4 PRO CA 1 1
6 735 1 1 4 PRO CB C 0.053 5.164 -0.734 1.00 . A A . 4 PRO CB 1 1
6 736 1 1 4 PRO CD C -0.939 3.883 1.137 1.00 . A A . 4 PRO CD 1 1
6 737 1 1 4 PRO CG C -0.718 5.309 0.599 1.00 . A A . 4 PRO CG 1 1
6 738 1 1 4 PRO HA H 0.659 3.329 -1.678 1.00 . A A . 4 PRO HA 1 1
6 739 1 1 4 PRO HB2 H 0.808 5.934 -0.818 1.00 . A A . 4 PRO HB2 1 1
6 740 1 1 4 PRO HB3 H -0.637 5.228 -1.562 1.00 . A A . 4 PRO HB3 1 1
6 741 1 1 4 PRO HD2 H -0.616 3.813 2.167 1.00 . A A . 4 PRO HD2 1 1
6 742 1 1 4 PRO HD3 H -1.976 3.598 1.043 1.00 . A A . 4 PRO HD3 1 1
6 743 1 1 4 PRO HG2 H -0.135 5.889 1.302 1.00 . A A . 4 PRO HG2 1 1
6 744 1 1 4 PRO HG3 H -1.671 5.785 0.425 1.00 . A A . 4 PRO HG3 1 1
6 745 1 1 4 PRO N N -0.098 3.034 0.270 1.00 . A A . 4 PRO N 1 1
6 746 1 1 4 PRO O O 3.090 3.807 -1.023 1.00 . A A . 4 PRO O 1 1
6 747 1 1 5 GLU C C 4.517 2.831 1.231 1.00 . A A . 5 GLU C 1 1
6 748 1 1 5 GLU CA C 3.787 4.136 1.550 1.00 . A A . 5 GLU CA 1 1
6 749 1 1 5 GLU CB C 3.776 4.362 3.063 1.00 . A A . 5 GLU CB 1 1
6 750 1 1 5 GLU CD C 5.407 5.914 4.160 1.00 . A A . 5 GLU CD 1 1
6 751 1 1 5 GLU CG C 5.213 4.516 3.567 1.00 . A A . 5 GLU CG 1 1
6 752 1 1 5 GLU H H 1.636 4.097 1.670 1.00 . A A . 5 GLU H 1 1
6 753 1 1 5 GLU HA H 4.293 4.958 1.065 1.00 . A A . 5 GLU HA 1 1
6 754 1 1 5 GLU HB2 H 3.214 5.258 3.288 1.00 . A A . 5 GLU HB2 1 1
6 755 1 1 5 GLU HB3 H 3.314 3.516 3.549 1.00 . A A . 5 GLU HB3 1 1
6 756 1 1 5 GLU HG2 H 5.408 3.772 4.327 1.00 . A A . 5 GLU HG2 1 1
6 757 1 1 5 GLU HG3 H 5.899 4.379 2.745 1.00 . A A . 5 GLU HG3 1 1
6 758 1 1 5 GLU N N 2.389 4.043 1.044 1.00 . A A . 5 GLU N 1 1
6 759 1 1 5 GLU O O 5.618 2.831 0.717 1.00 . A A . 5 GLU O 1 1
6 760 1 1 5 GLU OE1 O 4.521 6.736 3.994 1.00 . A A . 5 GLU OE1 1 1
6 761 1 1 5 GLU OE2 O 6.440 6.139 4.770 1.00 . A A . 5 GLU OE2 1 1
6 762 1 1 6 THR C C 4.345 0.074 -0.246 1.00 . A A . 6 THR C 1 1
6 763 1 1 6 THR CA C 4.551 0.408 1.231 1.00 . A A . 6 THR CA 1 1
6 764 1 1 6 THR CB C 3.908 -0.680 2.095 1.00 . A A . 6 THR CB 1 1
6 765 1 1 6 THR CG2 C 4.636 -2.006 1.872 1.00 . A A . 6 THR CG2 1 1
6 766 1 1 6 THR H H 3.014 1.742 1.932 1.00 . A A . 6 THR H 1 1
6 767 1 1 6 THR HA H 5.608 0.467 1.448 1.00 . A A . 6 THR HA 1 1
6 768 1 1 6 THR HB H 2.871 -0.792 1.819 1.00 . A A . 6 THR HB 1 1
6 769 1 1 6 THR HG1 H 3.819 0.630 3.530 1.00 . A A . 6 THR HG1 1 1
6 770 1 1 6 THR HG21 H 5.619 -1.955 2.315 1.00 . A A . 6 THR HG21 1 1
6 771 1 1 6 THR HG22 H 4.727 -2.191 0.812 1.00 . A A . 6 THR HG22 1 1
6 772 1 1 6 THR HG23 H 4.074 -2.805 2.332 1.00 . A A . 6 THR HG23 1 1
6 773 1 1 6 THR N N 3.905 1.717 1.525 1.00 . A A . 6 THR N 1 1
6 774 1 1 6 THR O O 5.285 -0.029 -1.010 1.00 . A A . 6 THR O 1 1
6 775 1 1 6 THR OG1 O 3.998 -0.311 3.464 1.00 . A A . 6 THR OG1 1 1
6 776 1 1 7 GLY C C 1.948 -1.653 -2.173 1.00 . A A . 7 GLY C 1 1
6 777 1 1 7 GLY CA C 2.832 -0.406 -2.081 1.00 . A A . 7 GLY CA 1 1
6 778 1 1 7 GLY H H 2.380 0.007 -0.017 1.00 . A A . 7 GLY H 1 1
6 779 1 1 7 GLY HA2 H 2.322 0.430 -2.539 1.00 . A A . 7 GLY HA2 1 1
6 780 1 1 7 GLY HA3 H 3.759 -0.589 -2.601 1.00 . A A . 7 GLY HA3 1 1
6 781 1 1 7 GLY N N 3.116 -0.087 -0.653 1.00 . A A . 7 GLY N 1 1
6 782 1 1 7 GLY O O 1.924 -2.332 -3.180 1.00 . A A . 7 GLY O 1 1
6 783 1 1 8 THR C C -0.735 -3.070 -0.096 1.00 . A A . 8 THR C 1 1
6 784 1 1 8 THR CA C 0.343 -3.170 -1.173 1.00 . A A . 8 THR CA 1 1
6 785 1 1 8 THR CB C 1.181 -4.429 -0.931 1.00 . A A . 8 THR CB 1 1
6 786 1 1 8 THR CG2 C 2.179 -4.181 0.206 1.00 . A A . 8 THR CG2 1 1
6 787 1 1 8 THR H H 1.249 -1.408 -0.327 1.00 . A A . 8 THR H 1 1
6 788 1 1 8 THR HA H -0.128 -3.238 -2.141 1.00 . A A . 8 THR HA 1 1
6 789 1 1 8 THR HB H 1.722 -4.678 -1.830 1.00 . A A . 8 THR HB 1 1
6 790 1 1 8 THR HG1 H 0.385 -5.649 0.361 1.00 . A A . 8 THR HG1 1 1
6 791 1 1 8 THR HG21 H 3.092 -4.724 0.007 1.00 . A A . 8 THR HG21 1 1
6 792 1 1 8 THR HG22 H 1.752 -4.522 1.137 1.00 . A A . 8 THR HG22 1 1
6 793 1 1 8 THR HG23 H 2.396 -3.125 0.276 1.00 . A A . 8 THR HG23 1 1
6 794 1 1 8 THR N N 1.219 -1.964 -1.132 1.00 . A A . 8 THR N 1 1
6 795 1 1 8 THR O O -0.721 -2.185 0.737 1.00 . A A . 8 THR O 1 1
6 796 1 1 8 THR OG1 O 0.320 -5.506 -0.585 1.00 . A A . 8 THR OG1 1 1
6 797 1 1 9 TRP C C -2.185 -4.304 2.276 1.00 . A A . 9 TRP C 1 1
6 798 1 1 9 TRP CA C -2.758 -3.960 0.901 1.00 . A A . 9 TRP CA 1 1
6 799 1 1 9 TRP CB C -3.805 -5.005 0.516 1.00 . A A . 9 TRP CB 1 1
6 800 1 1 9 TRP CD1 C -3.567 -5.713 -1.903 1.00 . A A . 9 TRP CD1 1 1
6 801 1 1 9 TRP CD2 C -4.972 -3.986 -1.637 1.00 . A A . 9 TRP CD2 1 1
6 802 1 1 9 TRP CE2 C -4.948 -4.275 -3.020 1.00 . A A . 9 TRP CE2 1 1
6 803 1 1 9 TRP CE3 C -5.780 -2.934 -1.193 1.00 . A A . 9 TRP CE3 1 1
6 804 1 1 9 TRP CG C -4.094 -4.913 -0.949 1.00 . A A . 9 TRP CG 1 1
6 805 1 1 9 TRP CH2 C -6.511 -2.495 -3.473 1.00 . A A . 9 TRP CH2 1 1
6 806 1 1 9 TRP CZ2 C -5.708 -3.543 -3.932 1.00 . A A . 9 TRP CZ2 1 1
6 807 1 1 9 TRP CZ3 C -6.547 -2.191 -2.104 1.00 . A A . 9 TRP CZ3 1 1
6 808 1 1 9 TRP H H -1.660 -4.676 -0.795 1.00 . A A . 9 TRP H 1 1
6 809 1 1 9 TRP HA H -3.212 -2.984 0.931 1.00 . A A . 9 TRP HA 1 1
6 810 1 1 9 TRP HB2 H -3.429 -5.990 0.746 1.00 . A A . 9 TRP HB2 1 1
6 811 1 1 9 TRP HB3 H -4.712 -4.828 1.073 1.00 . A A . 9 TRP HB3 1 1
6 812 1 1 9 TRP HD1 H -2.867 -6.514 -1.732 1.00 . A A . 9 TRP HD1 1 1
6 813 1 1 9 TRP HE1 H -3.857 -5.760 -3.990 1.00 . A A . 9 TRP HE1 1 1
6 814 1 1 9 TRP HE3 H -5.802 -2.694 -0.142 1.00 . A A . 9 TRP HE3 1 1
6 815 1 1 9 TRP HH2 H -7.104 -1.922 -4.170 1.00 . A A . 9 TRP HH2 1 1
6 816 1 1 9 TRP HZ2 H -5.677 -3.782 -4.985 1.00 . A A . 9 TRP HZ2 1 1
6 817 1 1 9 TRP HZ3 H -7.167 -1.382 -1.750 1.00 . A A . 9 TRP HZ3 1 1
6 818 1 1 9 TRP N N -1.671 -3.977 -0.110 1.00 . A A . 9 TRP N 1 1
6 819 1 1 9 TRP NE1 N -4.077 -5.338 -3.134 1.00 . A A . 9 TRP NE1 1 1
6 820 1 1 9 TRP O O -2.518 -3.689 3.270 1.00 . A A . 9 TRP O 1 1
6 821 1 1 10 GLY C C -1.252 -7.049 4.060 1.00 . A A . 10 GLY C 1 1
6 822 1 1 10 GLY CA C -0.731 -5.671 3.648 1.00 . A A . 10 GLY CA 1 1
6 823 1 1 10 GLY H H -1.076 -5.761 1.523 1.00 . A A . 10 GLY H 1 1
6 824 1 1 10 GLY HA2 H 0.346 -5.706 3.554 1.00 . A A . 10 GLY HA2 1 1
6 825 1 1 10 GLY HA3 H -1.005 -4.946 4.399 1.00 . A A . 10 GLY HA3 1 1
6 826 1 1 10 GLY N N -1.328 -5.282 2.338 1.00 . A A . 10 GLY N 1 1
6 827 1 1 10 GLY O O -0.906 -8.014 3.400 1.00 . A A . 10 GLY O 1 1
6 828 1 1 10 GLY OXT O -1.992 -7.114 5.030 1.00 . A A . 10 GLY OXT 1 1
7 829 1 1 1 GLY C C -5.523 -1.000 2.299 1.00 . A A . 1 GLY C 1 1
7 830 1 1 1 GLY CA C -6.816 -0.805 3.091 1.00 . A A . 1 GLY CA 1 1
7 831 1 1 1 GLY H1 H -7.969 -2.103 1.942 1.00 . A A . 1 GLY H1 1 1
7 832 1 1 1 GLY H2 H -7.941 -0.505 1.364 1.00 . A A . 1 GLY H2 1 1
7 833 1 1 1 GLY H3 H -8.865 -0.901 2.735 1.00 . A A . 1 GLY H3 1 1
7 834 1 1 1 GLY HA2 H -6.876 0.217 3.439 1.00 . A A . 1 GLY HA2 1 1
7 835 1 1 1 GLY HA3 H -6.820 -1.475 3.937 1.00 . A A . 1 GLY HA3 1 1
7 836 1 1 1 GLY N N -7.986 -1.101 2.217 1.00 . A A . 1 GLY N 1 1
7 837 1 1 1 GLY O O -4.836 -1.991 2.450 1.00 . A A . 1 GLY O 1 1
7 838 1 1 2 TYR C C -2.951 0.901 1.049 1.00 . A A . 2 TYR C 1 1
7 839 1 1 2 TYR CA C -3.934 -0.203 0.656 1.00 . A A . 2 TYR CA 1 1
7 840 1 1 2 TYR CB C -4.258 -0.086 -0.834 1.00 . A A . 2 TYR CB 1 1
7 841 1 1 2 TYR CD1 C -2.021 0.692 -1.692 1.00 . A A . 2 TYR CD1 1 1
7 842 1 1 2 TYR CD2 C -2.812 -1.511 -2.327 1.00 . A A . 2 TYR CD2 1 1
7 843 1 1 2 TYR CE1 C -0.853 0.488 -2.436 1.00 . A A . 2 TYR CE1 1 1
7 844 1 1 2 TYR CE2 C -1.644 -1.715 -3.071 1.00 . A A . 2 TYR CE2 1 1
7 845 1 1 2 TYR CG C -3.000 -0.306 -1.638 1.00 . A A . 2 TYR CG 1 1
7 846 1 1 2 TYR CZ C -0.664 -0.716 -3.125 1.00 . A A . 2 TYR CZ 1 1
7 847 1 1 2 TYR H H -5.751 0.727 1.346 1.00 . A A . 2 TYR H 1 1
7 848 1 1 2 TYR HA H -3.487 -1.167 0.852 1.00 . A A . 2 TYR HA 1 1
7 849 1 1 2 TYR HB2 H -4.993 -0.829 -1.102 1.00 . A A . 2 TYR HB2 1 1
7 850 1 1 2 TYR HB3 H -4.649 0.900 -1.041 1.00 . A A . 2 TYR HB3 1 1
7 851 1 1 2 TYR HD1 H -2.167 1.621 -1.161 1.00 . A A . 2 TYR HD1 1 1
7 852 1 1 2 TYR HD2 H -3.568 -2.281 -2.285 1.00 . A A . 2 TYR HD2 1 1
7 853 1 1 2 TYR HE1 H -0.098 1.258 -2.478 1.00 . A A . 2 TYR HE1 1 1
7 854 1 1 2 TYR HE2 H -1.498 -2.644 -3.603 1.00 . A A . 2 TYR HE2 1 1
7 855 1 1 2 TYR HH H 0.231 -1.184 -4.745 1.00 . A A . 2 TYR HH 1 1
7 856 1 1 2 TYR N N -5.184 -0.065 1.454 1.00 . A A . 2 TYR N 1 1
7 857 1 1 2 TYR O O -3.116 2.050 0.691 1.00 . A A . 2 TYR O 1 1
7 858 1 1 2 TYR OH O 0.487 -0.918 -3.858 1.00 . A A . 2 TYR OH 1 1
7 859 1 1 3 ASP C C -0.007 1.897 1.004 1.00 . A A . 3 ASP C 1 1
7 860 1 1 3 ASP CA C -0.932 1.590 2.190 1.00 . A A . 3 ASP CA 1 1
7 861 1 1 3 ASP CB C -0.101 1.052 3.358 1.00 . A A . 3 ASP CB 1 1
7 862 1 1 3 ASP CG C 0.290 2.207 4.282 1.00 . A A . 3 ASP CG 1 1
7 863 1 1 3 ASP H H -1.810 -0.372 2.056 1.00 . A A . 3 ASP H 1 1
7 864 1 1 3 ASP HA H -1.448 2.484 2.500 1.00 . A A . 3 ASP HA 1 1
7 865 1 1 3 ASP HB2 H -0.685 0.330 3.911 1.00 . A A . 3 ASP HB2 1 1
7 866 1 1 3 ASP HB3 H 0.792 0.579 2.978 1.00 . A A . 3 ASP HB3 1 1
7 867 1 1 3 ASP N N -1.927 0.561 1.780 1.00 . A A . 3 ASP N 1 1
7 868 1 1 3 ASP O O 0.738 1.040 0.571 1.00 . A A . 3 ASP O 1 1
7 869 1 1 3 ASP OD1 O -0.575 3.008 4.594 1.00 . A A . 3 ASP OD1 1 1
7 870 1 1 3 ASP OD2 O 1.448 2.270 4.661 1.00 . A A . 3 ASP OD2 1 1
7 871 1 1 4 PRO C C 2.174 3.829 -0.176 1.00 . A A . 4 PRO C 1 1
7 872 1 1 4 PRO CA C 0.741 3.545 -0.633 1.00 . A A . 4 PRO CA 1 1
7 873 1 1 4 PRO CB C 0.049 4.825 -1.109 1.00 . A A . 4 PRO CB 1 1
7 874 1 1 4 PRO CD C -0.986 4.152 1.035 1.00 . A A . 4 PRO CD 1 1
7 875 1 1 4 PRO CG C -0.768 5.352 0.094 1.00 . A A . 4 PRO CG 1 1
7 876 1 1 4 PRO HA H 0.729 2.806 -1.417 1.00 . A A . 4 PRO HA 1 1
7 877 1 1 4 PRO HB2 H 0.790 5.555 -1.408 1.00 . A A . 4 PRO HB2 1 1
7 878 1 1 4 PRO HB3 H -0.613 4.607 -1.931 1.00 . A A . 4 PRO HB3 1 1
7 879 1 1 4 PRO HD2 H -0.716 4.414 2.049 1.00 . A A . 4 PRO HD2 1 1
7 880 1 1 4 PRO HD3 H -2.010 3.816 0.988 1.00 . A A . 4 PRO HD3 1 1
7 881 1 1 4 PRO HG2 H -0.216 6.131 0.604 1.00 . A A . 4 PRO HG2 1 1
7 882 1 1 4 PRO HG3 H -1.721 5.730 -0.241 1.00 . A A . 4 PRO HG3 1 1
7 883 1 1 4 PRO N N -0.083 3.109 0.508 1.00 . A A . 4 PRO N 1 1
7 884 1 1 4 PRO O O 3.104 3.793 -0.958 1.00 . A A . 4 PRO O 1 1
7 885 1 1 5 GLU C C 4.654 3.226 1.205 1.00 . A A . 5 GLU C 1 1
7 886 1 1 5 GLU CA C 3.735 4.385 1.589 1.00 . A A . 5 GLU CA 1 1
7 887 1 1 5 GLU CB C 3.703 4.529 3.112 1.00 . A A . 5 GLU CB 1 1
7 888 1 1 5 GLU CD C 5.633 3.947 4.588 1.00 . A A . 5 GLU CD 1 1
7 889 1 1 5 GLU CG C 5.075 4.984 3.611 1.00 . A A . 5 GLU CG 1 1
7 890 1 1 5 GLU H H 1.599 4.126 1.702 1.00 . A A . 5 GLU H 1 1
7 891 1 1 5 GLU HA H 4.103 5.300 1.147 1.00 . A A . 5 GLU HA 1 1
7 892 1 1 5 GLU HB2 H 2.956 5.261 3.389 1.00 . A A . 5 GLU HB2 1 1
7 893 1 1 5 GLU HB3 H 3.457 3.578 3.558 1.00 . A A . 5 GLU HB3 1 1
7 894 1 1 5 GLU HG2 H 5.747 5.088 2.772 1.00 . A A . 5 GLU HG2 1 1
7 895 1 1 5 GLU HG3 H 4.979 5.934 4.114 1.00 . A A . 5 GLU HG3 1 1
7 896 1 1 5 GLU N N 2.360 4.106 1.086 1.00 . A A . 5 GLU N 1 1
7 897 1 1 5 GLU O O 5.852 3.385 1.077 1.00 . A A . 5 GLU O 1 1
7 898 1 1 5 GLU OE1 O 4.864 3.444 5.391 1.00 . A A . 5 GLU OE1 1 1
7 899 1 1 5 GLU OE2 O 6.820 3.675 4.518 1.00 . A A . 5 GLU OE2 1 1
7 900 1 1 6 THR C C 4.447 0.332 -0.700 1.00 . A A . 6 THR C 1 1
7 901 1 1 6 THR CA C 4.936 0.888 0.638 1.00 . A A . 6 THR CA 1 1
7 902 1 1 6 THR CB C 4.816 -0.194 1.715 1.00 . A A . 6 THR CB 1 1
7 903 1 1 6 THR CG2 C 5.206 0.391 3.074 1.00 . A A . 6 THR CG2 1 1
7 904 1 1 6 THR H H 3.131 1.956 1.125 1.00 . A A . 6 THR H 1 1
7 905 1 1 6 THR HA H 5.968 1.194 0.548 1.00 . A A . 6 THR HA 1 1
7 906 1 1 6 THR HB H 5.476 -1.014 1.478 1.00 . A A . 6 THR HB 1 1
7 907 1 1 6 THR HG1 H 3.305 -0.980 2.653 1.00 . A A . 6 THR HG1 1 1
7 908 1 1 6 THR HG21 H 4.319 0.738 3.583 1.00 . A A . 6 THR HG21 1 1
7 909 1 1 6 THR HG22 H 5.885 1.218 2.928 1.00 . A A . 6 THR HG22 1 1
7 910 1 1 6 THR HG23 H 5.688 -0.371 3.668 1.00 . A A . 6 THR HG23 1 1
7 911 1 1 6 THR N N 4.100 2.060 1.018 1.00 . A A . 6 THR N 1 1
7 912 1 1 6 THR O O 5.209 0.170 -1.632 1.00 . A A . 6 THR O 1 1
7 913 1 1 6 THR OG1 O 3.476 -0.662 1.764 1.00 . A A . 6 THR OG1 1 1
7 914 1 1 7 GLY C C 2.261 -1.973 -1.895 1.00 . A A . 7 GLY C 1 1
7 915 1 1 7 GLY CA C 2.639 -0.503 -2.082 1.00 . A A . 7 GLY CA 1 1
7 916 1 1 7 GLY H H 2.580 0.179 -0.040 1.00 . A A . 7 GLY H 1 1
7 917 1 1 7 GLY HA2 H 1.765 0.062 -2.372 1.00 . A A . 7 GLY HA2 1 1
7 918 1 1 7 GLY HA3 H 3.392 -0.424 -2.853 1.00 . A A . 7 GLY HA3 1 1
7 919 1 1 7 GLY N N 3.178 0.040 -0.803 1.00 . A A . 7 GLY N 1 1
7 920 1 1 7 GLY O O 2.817 -2.852 -2.523 1.00 . A A . 7 GLY O 1 1
7 921 1 1 8 THR C C -0.558 -3.720 -0.407 1.00 . A A . 8 THR C 1 1
7 922 1 1 8 THR CA C 0.907 -3.664 -0.812 1.00 . A A . 8 THR CA 1 1
7 923 1 1 8 THR CB C 1.770 -4.285 0.288 1.00 . A A . 8 THR CB 1 1
7 924 1 1 8 THR CG2 C 2.098 -5.734 -0.074 1.00 . A A . 8 THR CG2 1 1
7 925 1 1 8 THR H H 0.879 -1.527 -0.538 1.00 . A A . 8 THR H 1 1
7 926 1 1 8 THR HA H 1.028 -4.225 -1.725 1.00 . A A . 8 THR HA 1 1
7 927 1 1 8 THR HB H 1.232 -4.265 1.223 1.00 . A A . 8 THR HB 1 1
7 928 1 1 8 THR HG1 H 2.742 -2.641 0.654 1.00 . A A . 8 THR HG1 1 1
7 929 1 1 8 THR HG21 H 2.986 -5.758 -0.690 1.00 . A A . 8 THR HG21 1 1
7 930 1 1 8 THR HG22 H 1.271 -6.165 -0.617 1.00 . A A . 8 THR HG22 1 1
7 931 1 1 8 THR HG23 H 2.271 -6.300 0.829 1.00 . A A . 8 THR HG23 1 1
7 932 1 1 8 THR N N 1.317 -2.249 -1.035 1.00 . A A . 8 THR N 1 1
7 933 1 1 8 THR O O -1.079 -2.829 0.233 1.00 . A A . 8 THR O 1 1
7 934 1 1 8 THR OG1 O 2.974 -3.541 0.419 1.00 . A A . 8 THR OG1 1 1
7 935 1 1 9 TRP C C -2.809 -5.328 1.004 1.00 . A A . 9 TRP C 1 1
7 936 1 1 9 TRP CA C -2.655 -4.903 -0.458 1.00 . A A . 9 TRP CA 1 1
7 937 1 1 9 TRP CB C -3.280 -5.956 -1.371 1.00 . A A . 9 TRP CB 1 1
7 938 1 1 9 TRP CD1 C -4.655 -5.617 -3.460 1.00 . A A . 9 TRP CD1 1 1
7 939 1 1 9 TRP CD2 C -5.268 -4.262 -1.777 1.00 . A A . 9 TRP CD2 1 1
7 940 1 1 9 TRP CE2 C -6.125 -3.967 -2.862 1.00 . A A . 9 TRP CE2 1 1
7 941 1 1 9 TRP CE3 C -5.433 -3.548 -0.582 1.00 . A A . 9 TRP CE3 1 1
7 942 1 1 9 TRP CG C -4.355 -5.315 -2.179 1.00 . A A . 9 TRP CG 1 1
7 943 1 1 9 TRP CH2 C -7.271 -2.286 -1.564 1.00 . A A . 9 TRP CH2 1 1
7 944 1 1 9 TRP CZ2 C -7.117 -2.991 -2.763 1.00 . A A . 9 TRP CZ2 1 1
7 945 1 1 9 TRP CZ3 C -6.429 -2.563 -0.475 1.00 . A A . 9 TRP CZ3 1 1
7 946 1 1 9 TRP H H -0.783 -5.463 -1.313 1.00 . A A . 9 TRP H 1 1
7 947 1 1 9 TRP HA H -3.142 -3.956 -0.616 1.00 . A A . 9 TRP HA 1 1
7 948 1 1 9 TRP HB2 H -2.523 -6.358 -2.028 1.00 . A A . 9 TRP HB2 1 1
7 949 1 1 9 TRP HB3 H -3.701 -6.750 -0.773 1.00 . A A . 9 TRP HB3 1 1
7 950 1 1 9 TRP HD1 H -4.155 -6.360 -4.063 1.00 . A A . 9 TRP HD1 1 1
7 951 1 1 9 TRP HE1 H -6.129 -4.843 -4.755 1.00 . A A . 9 TRP HE1 1 1
7 952 1 1 9 TRP HE3 H -4.782 -3.756 0.258 1.00 . A A . 9 TRP HE3 1 1
7 953 1 1 9 TRP HH2 H -8.035 -1.527 -1.477 1.00 . A A . 9 TRP HH2 1 1
7 954 1 1 9 TRP HZ2 H -7.762 -2.781 -3.603 1.00 . A A . 9 TRP HZ2 1 1
7 955 1 1 9 TRP HZ3 H -6.550 -2.018 0.449 1.00 . A A . 9 TRP HZ3 1 1
7 956 1 1 9 TRP N N -1.225 -4.768 -0.792 1.00 . A A . 9 TRP N 1 1
7 957 1 1 9 TRP NE1 N -5.712 -4.820 -3.868 1.00 . A A . 9 TRP NE1 1 1
7 958 1 1 9 TRP O O -3.861 -5.180 1.595 1.00 . A A . 9 TRP O 1 1
7 959 1 1 10 GLY C C -2.302 -5.113 3.882 1.00 . A A . 10 GLY C 1 1
7 960 1 1 10 GLY CA C -1.860 -6.292 3.013 1.00 . A A . 10 GLY CA 1 1
7 961 1 1 10 GLY H H -0.933 -5.969 1.096 1.00 . A A . 10 GLY H 1 1
7 962 1 1 10 GLY HA2 H -2.580 -7.093 3.099 1.00 . A A . 10 GLY HA2 1 1
7 963 1 1 10 GLY HA3 H -0.894 -6.637 3.346 1.00 . A A . 10 GLY HA3 1 1
7 964 1 1 10 GLY N N -1.771 -5.857 1.591 1.00 . A A . 10 GLY N 1 1
7 965 1 1 10 GLY O O -1.436 -4.425 4.396 1.00 . A A . 10 GLY O 1 1
7 966 1 1 10 GLY OXT O -3.498 -4.918 4.019 1.00 . A A . 10 GLY OXT 1 1
8 967 1 1 1 GLY C C -5.453 -0.575 2.240 1.00 . A A . 1 GLY C 1 1
8 968 1 1 1 GLY CA C -6.740 -0.436 3.053 1.00 . A A . 1 GLY CA 1 1
8 969 1 1 1 GLY H1 H -6.931 1.558 2.483 1.00 . A A . 1 GLY H1 1 1
8 970 1 1 1 GLY H2 H -6.265 1.342 4.030 1.00 . A A . 1 GLY H2 1 1
8 971 1 1 1 GLY H3 H -7.930 1.112 3.779 1.00 . A A . 1 GLY H3 1 1
8 972 1 1 1 GLY HA2 H -6.645 -0.987 3.978 1.00 . A A . 1 GLY HA2 1 1
8 973 1 1 1 GLY HA3 H -7.567 -0.829 2.482 1.00 . A A . 1 GLY HA3 1 1
8 974 1 1 1 GLY N N -6.986 1.003 3.359 1.00 . A A . 1 GLY N 1 1
8 975 1 1 1 GLY O O -4.472 -1.123 2.702 1.00 . A A . 1 GLY O 1 1
8 976 1 1 2 TYR C C -3.136 0.733 0.742 1.00 . A A . 2 TYR C 1 1
8 977 1 1 2 TYR CA C -4.221 -0.193 0.191 1.00 . A A . 2 TYR CA 1 1
8 978 1 1 2 TYR CB C -4.547 0.213 -1.247 1.00 . A A . 2 TYR CB 1 1
8 979 1 1 2 TYR CD1 C -2.899 -1.024 -2.700 1.00 . A A . 2 TYR CD1 1 1
8 980 1 1 2 TYR CD2 C -2.501 1.320 -2.221 1.00 . A A . 2 TYR CD2 1 1
8 981 1 1 2 TYR CE1 C -1.728 -1.066 -3.466 1.00 . A A . 2 TYR CE1 1 1
8 982 1 1 2 TYR CE2 C -1.331 1.277 -2.987 1.00 . A A . 2 TYR CE2 1 1
8 983 1 1 2 TYR CG C -3.286 0.169 -2.076 1.00 . A A . 2 TYR CG 1 1
8 984 1 1 2 TYR CZ C -0.944 0.085 -3.609 1.00 . A A . 2 TYR CZ 1 1
8 985 1 1 2 TYR H H -6.249 0.353 0.675 1.00 . A A . 2 TYR H 1 1
8 986 1 1 2 TYR HA H -3.865 -1.213 0.204 1.00 . A A . 2 TYR HA 1 1
8 987 1 1 2 TYR HB2 H -5.275 -0.471 -1.658 1.00 . A A . 2 TYR HB2 1 1
8 988 1 1 2 TYR HB3 H -4.948 1.216 -1.255 1.00 . A A . 2 TYR HB3 1 1
8 989 1 1 2 TYR HD1 H -3.504 -1.913 -2.589 1.00 . A A . 2 TYR HD1 1 1
8 990 1 1 2 TYR HD2 H -2.799 2.240 -1.740 1.00 . A A . 2 TYR HD2 1 1
8 991 1 1 2 TYR HE1 H -1.429 -1.985 -3.945 1.00 . A A . 2 TYR HE1 1 1
8 992 1 1 2 TYR HE2 H -0.726 2.166 -3.098 1.00 . A A . 2 TYR HE2 1 1
8 993 1 1 2 TYR HH H 0.080 -0.594 -5.069 1.00 . A A . 2 TYR HH 1 1
8 994 1 1 2 TYR N N -5.446 -0.085 1.032 1.00 . A A . 2 TYR N 1 1
8 995 1 1 2 TYR O O -3.289 1.939 0.768 1.00 . A A . 2 TYR O 1 1
8 996 1 1 2 TYR OH O 0.210 0.044 -4.364 1.00 . A A . 2 TYR OH 1 1
8 997 1 1 3 ASP C C -0.123 1.602 0.550 1.00 . A A . 3 ASP C 1 1
8 998 1 1 3 ASP CA C -0.940 1.032 1.718 1.00 . A A . 3 ASP CA 1 1
8 999 1 1 3 ASP CB C -0.030 0.183 2.608 1.00 . A A . 3 ASP CB 1 1
8 1000 1 1 3 ASP CG C 0.783 1.097 3.527 1.00 . A A . 3 ASP CG 1 1
8 1001 1 1 3 ASP H H -1.929 -0.792 1.143 1.00 . A A . 3 ASP H 1 1
8 1002 1 1 3 ASP HA H -1.364 1.834 2.301 1.00 . A A . 3 ASP HA 1 1
8 1003 1 1 3 ASP HB2 H -0.633 -0.486 3.205 1.00 . A A . 3 ASP HB2 1 1
8 1004 1 1 3 ASP HB3 H 0.643 -0.392 1.990 1.00 . A A . 3 ASP HB3 1 1
8 1005 1 1 3 ASP N N -2.037 0.182 1.177 1.00 . A A . 3 ASP N 1 1
8 1006 1 1 3 ASP O O 0.515 0.860 -0.169 1.00 . A A . 3 ASP O 1 1
8 1007 1 1 3 ASP OD1 O 1.270 2.106 3.046 1.00 . A A . 3 ASP OD1 1 1
8 1008 1 1 3 ASP OD2 O 0.904 0.771 4.696 1.00 . A A . 3 ASP OD2 1 1
8 1009 1 1 4 PRO C C 2.049 3.716 -0.336 1.00 . A A . 4 PRO C 1 1
8 1010 1 1 4 PRO CA C 0.563 3.590 -0.689 1.00 . A A . 4 PRO CA 1 1
8 1011 1 1 4 PRO CB C -0.102 4.968 -0.753 1.00 . A A . 4 PRO CB 1 1
8 1012 1 1 4 PRO CD C -0.947 3.805 1.262 1.00 . A A . 4 PRO CD 1 1
8 1013 1 1 4 PRO CG C -0.765 5.195 0.626 1.00 . A A . 4 PRO CG 1 1
8 1014 1 1 4 PRO HA H 0.436 3.074 -1.627 1.00 . A A . 4 PRO HA 1 1
8 1015 1 1 4 PRO HB2 H 0.642 5.729 -0.942 1.00 . A A . 4 PRO HB2 1 1
8 1016 1 1 4 PRO HB3 H -0.856 4.981 -1.525 1.00 . A A . 4 PRO HB3 1 1
8 1017 1 1 4 PRO HD2 H -0.551 3.796 2.269 1.00 . A A . 4 PRO HD2 1 1
8 1018 1 1 4 PRO HD3 H -1.987 3.519 1.258 1.00 . A A . 4 PRO HD3 1 1
8 1019 1 1 4 PRO HG2 H -0.125 5.809 1.246 1.00 . A A . 4 PRO HG2 1 1
8 1020 1 1 4 PRO HG3 H -1.726 5.668 0.503 1.00 . A A . 4 PRO HG3 1 1
8 1021 1 1 4 PRO N N -0.167 2.902 0.390 1.00 . A A . 4 PRO N 1 1
8 1022 1 1 4 PRO O O 2.907 3.662 -1.194 1.00 . A A . 4 PRO O 1 1
8 1023 1 1 5 GLU C C 4.498 2.675 1.111 1.00 . A A . 5 GLU C 1 1
8 1024 1 1 5 GLU CA C 3.789 4.014 1.322 1.00 . A A . 5 GLU CA 1 1
8 1025 1 1 5 GLU CB C 3.870 4.411 2.797 1.00 . A A . 5 GLU CB 1 1
8 1026 1 1 5 GLU CD C 4.308 6.557 4.001 1.00 . A A . 5 GLU CD 1 1
8 1027 1 1 5 GLU CG C 3.427 5.866 2.958 1.00 . A A . 5 GLU CG 1 1
8 1028 1 1 5 GLU H H 1.655 3.927 1.599 1.00 . A A . 5 GLU H 1 1
8 1029 1 1 5 GLU HA H 4.265 4.773 0.718 1.00 . A A . 5 GLU HA 1 1
8 1030 1 1 5 GLU HB2 H 3.224 3.770 3.379 1.00 . A A . 5 GLU HB2 1 1
8 1031 1 1 5 GLU HB3 H 4.888 4.307 3.143 1.00 . A A . 5 GLU HB3 1 1
8 1032 1 1 5 GLU HG2 H 3.519 6.378 2.012 1.00 . A A . 5 GLU HG2 1 1
8 1033 1 1 5 GLU HG3 H 2.397 5.895 3.284 1.00 . A A . 5 GLU HG3 1 1
8 1034 1 1 5 GLU N N 2.359 3.886 0.920 1.00 . A A . 5 GLU N 1 1
8 1035 1 1 5 GLU O O 5.499 2.593 0.427 1.00 . A A . 5 GLU O 1 1
8 1036 1 1 5 GLU OE1 O 4.729 5.887 4.930 1.00 . A A . 5 GLU OE1 1 1
8 1037 1 1 5 GLU OE2 O 4.547 7.745 3.853 1.00 . A A . 5 GLU OE2 1 1
8 1038 1 1 6 THR C C 4.208 -0.297 0.171 1.00 . A A . 6 THR C 1 1
8 1039 1 1 6 THR CA C 4.627 0.292 1.519 1.00 . A A . 6 THR CA 1 1
8 1040 1 1 6 THR CB C 4.180 -0.641 2.646 1.00 . A A . 6 THR CB 1 1
8 1041 1 1 6 THR CG2 C 4.921 -1.973 2.530 1.00 . A A . 6 THR CG2 1 1
8 1042 1 1 6 THR H H 3.174 1.712 2.236 1.00 . A A . 6 THR H 1 1
8 1043 1 1 6 THR HA H 5.701 0.402 1.546 1.00 . A A . 6 THR HA 1 1
8 1044 1 1 6 THR HB H 3.118 -0.817 2.568 1.00 . A A . 6 THR HB 1 1
8 1045 1 1 6 THR HG1 H 4.471 -0.730 4.567 1.00 . A A . 6 THR HG1 1 1
8 1046 1 1 6 THR HG21 H 4.207 -2.784 2.533 1.00 . A A . 6 THR HG21 1 1
8 1047 1 1 6 THR HG22 H 5.594 -2.084 3.369 1.00 . A A . 6 THR HG22 1 1
8 1048 1 1 6 THR HG23 H 5.485 -1.992 1.610 1.00 . A A . 6 THR HG23 1 1
8 1049 1 1 6 THR N N 3.985 1.625 1.691 1.00 . A A . 6 THR N 1 1
8 1050 1 1 6 THR O O 4.872 -1.155 -0.378 1.00 . A A . 6 THR O 1 1
8 1051 1 1 6 THR OG1 O 4.472 -0.040 3.899 1.00 . A A . 6 THR OG1 1 1
8 1052 1 1 7 GLY C C 2.326 -1.855 -1.558 1.00 . A A . 7 GLY C 1 1
8 1053 1 1 7 GLY CA C 2.646 -0.365 -1.681 1.00 . A A . 7 GLY CA 1 1
8 1054 1 1 7 GLY H H 2.595 0.855 0.092 1.00 . A A . 7 GLY H 1 1
8 1055 1 1 7 GLY HA2 H 1.758 0.171 -1.988 1.00 . A A . 7 GLY HA2 1 1
8 1056 1 1 7 GLY HA3 H 3.421 -0.228 -2.419 1.00 . A A . 7 GLY HA3 1 1
8 1057 1 1 7 GLY N N 3.112 0.161 -0.368 1.00 . A A . 7 GLY N 1 1
8 1058 1 1 7 GLY O O 2.897 -2.681 -2.244 1.00 . A A . 7 GLY O 1 1
8 1059 1 1 8 THR C C -0.420 -3.781 -0.220 1.00 . A A . 8 THR C 1 1
8 1060 1 1 8 THR CA C 1.063 -3.648 -0.534 1.00 . A A . 8 THR CA 1 1
8 1061 1 1 8 THR CB C 1.884 -4.260 0.602 1.00 . A A . 8 THR CB 1 1
8 1062 1 1 8 THR CG2 C 2.158 -5.733 0.294 1.00 . A A . 8 THR CG2 1 1
8 1063 1 1 8 THR H H 0.964 -1.530 -0.150 1.00 . A A . 8 THR H 1 1
8 1064 1 1 8 THR HA H 1.269 -4.173 -1.451 1.00 . A A . 8 THR HA 1 1
8 1065 1 1 8 THR HB H 1.334 -4.187 1.527 1.00 . A A . 8 THR HB 1 1
8 1066 1 1 8 THR HG1 H 3.759 -3.990 0.158 1.00 . A A . 8 THR HG1 1 1
8 1067 1 1 8 THR HG21 H 1.575 -6.036 -0.564 1.00 . A A . 8 THR HG21 1 1
8 1068 1 1 8 THR HG22 H 1.884 -6.336 1.147 1.00 . A A . 8 THR HG22 1 1
8 1069 1 1 8 THR HG23 H 3.208 -5.868 0.081 1.00 . A A . 8 THR HG23 1 1
8 1070 1 1 8 THR N N 1.415 -2.209 -0.692 1.00 . A A . 8 THR N 1 1
8 1071 1 1 8 THR O O -1.024 -2.913 0.377 1.00 . A A . 8 THR O 1 1
8 1072 1 1 8 THR OG1 O 3.116 -3.560 0.725 1.00 . A A . 8 THR OG1 1 1
8 1073 1 1 9 TRP C C -2.656 -5.717 0.990 1.00 . A A . 9 TRP C 1 1
8 1074 1 1 9 TRP CA C -2.453 -5.058 -0.377 1.00 . A A . 9 TRP CA 1 1
8 1075 1 1 9 TRP CB C -3.043 -5.945 -1.472 1.00 . A A . 9 TRP CB 1 1
8 1076 1 1 9 TRP CD1 C -4.281 -5.276 -3.568 1.00 . A A . 9 TRP CD1 1 1
8 1077 1 1 9 TRP CD2 C -4.970 -4.148 -1.750 1.00 . A A . 9 TRP CD2 1 1
8 1078 1 1 9 TRP CE2 C -5.747 -3.679 -2.833 1.00 . A A . 9 TRP CE2 1 1
8 1079 1 1 9 TRP CE3 C -5.200 -3.599 -0.479 1.00 . A A . 9 TRP CE3 1 1
8 1080 1 1 9 TRP CG C -4.054 -5.163 -2.241 1.00 . A A . 9 TRP CG 1 1
8 1081 1 1 9 TRP CH2 C -6.940 -2.158 -1.388 1.00 . A A . 9 TRP CH2 1 1
8 1082 1 1 9 TRP CZ2 C -6.723 -2.696 -2.660 1.00 . A A . 9 TRP CZ2 1 1
8 1083 1 1 9 TRP CZ3 C -6.179 -2.609 -0.299 1.00 . A A . 9 TRP CZ3 1 1
8 1084 1 1 9 TRP H H -0.514 -5.543 -1.118 1.00 . A A . 9 TRP H 1 1
8 1085 1 1 9 TRP HA H -2.936 -4.098 -0.395 1.00 . A A . 9 TRP HA 1 1
8 1086 1 1 9 TRP HB2 H -2.255 -6.270 -2.137 1.00 . A A . 9 TRP HB2 1 1
8 1087 1 1 9 TRP HB3 H -3.516 -6.806 -1.023 1.00 . A A . 9 TRP HB3 1 1
8 1088 1 1 9 TRP HD1 H -3.762 -5.943 -4.239 1.00 . A A . 9 TRP HD1 1 1
8 1089 1 1 9 TRP HE1 H -5.652 -4.282 -4.827 1.00 . A A . 9 TRP HE1 1 1
8 1090 1 1 9 TRP HE3 H -4.611 -3.941 0.364 1.00 . A A . 9 TRP HE3 1 1
8 1091 1 1 9 TRP HH2 H -7.692 -1.397 -1.244 1.00 . A A . 9 TRP HH2 1 1
8 1092 1 1 9 TRP HZ2 H -7.306 -2.353 -3.502 1.00 . A A . 9 TRP HZ2 1 1
8 1093 1 1 9 TRP HZ3 H -6.349 -2.193 0.683 1.00 . A A . 9 TRP HZ3 1 1
8 1094 1 1 9 TRP N N -1.014 -4.864 -0.632 1.00 . A A . 9 TRP N 1 1
8 1095 1 1 9 TRP NE1 N -5.292 -4.396 -3.922 1.00 . A A . 9 TRP NE1 1 1
8 1096 1 1 9 TRP O O -3.517 -6.556 1.162 1.00 . A A . 9 TRP O 1 1
8 1097 1 1 10 GLY C C -1.022 -7.102 3.475 1.00 . A A . 10 GLY C 1 1
8 1098 1 1 10 GLY CA C -2.020 -5.954 3.315 1.00 . A A . 10 GLY CA 1 1
8 1099 1 1 10 GLY H H -1.180 -4.668 1.804 1.00 . A A . 10 GLY H 1 1
8 1100 1 1 10 GLY HA2 H -1.831 -5.203 4.069 1.00 . A A . 10 GLY HA2 1 1
8 1101 1 1 10 GLY HA3 H -3.023 -6.335 3.429 1.00 . A A . 10 GLY HA3 1 1
8 1102 1 1 10 GLY N N -1.870 -5.345 1.962 1.00 . A A . 10 GLY N 1 1
8 1103 1 1 10 GLY O O -0.340 -7.406 2.510 1.00 . A A . 10 GLY O 1 1
8 1104 1 1 10 GLY OXT O -0.958 -7.658 4.558 1.00 . A A . 10 GLY OXT 1 1
9 1105 1 1 1 GLY C C -5.636 -0.386 2.040 1.00 . A A . 1 GLY C 1 1
9 1106 1 1 1 GLY CA C -6.973 -0.092 2.720 1.00 . A A . 1 GLY CA 1 1
9 1107 1 1 1 GLY H1 H -7.680 0.219 4.655 1.00 . A A . 1 GLY H1 1 1
9 1108 1 1 1 GLY H2 H -6.084 0.747 4.406 1.00 . A A . 1 GLY H2 1 1
9 1109 1 1 1 GLY H3 H -6.420 -0.912 4.553 1.00 . A A . 1 GLY H3 1 1
9 1110 1 1 1 GLY HA2 H -7.674 -0.885 2.500 1.00 . A A . 1 GLY HA2 1 1
9 1111 1 1 1 GLY HA3 H -7.362 0.845 2.352 1.00 . A A . 1 GLY HA3 1 1
9 1112 1 1 1 GLY N N -6.774 -0.003 4.195 1.00 . A A . 1 GLY N 1 1
9 1113 1 1 1 GLY O O -4.821 -1.131 2.547 1.00 . A A . 1 GLY O 1 1
9 1114 1 1 2 TYR C C -3.064 0.945 0.667 1.00 . A A . 2 TYR C 1 1
9 1115 1 1 2 TYR CA C -4.116 -0.054 0.183 1.00 . A A . 2 TYR CA 1 1
9 1116 1 1 2 TYR CB C -4.325 0.123 -1.321 1.00 . A A . 2 TYR CB 1 1
9 1117 1 1 2 TYR CD1 C -2.042 0.922 -2.031 1.00 . A A . 2 TYR CD1 1 1
9 1118 1 1 2 TYR CD2 C -2.770 -1.286 -2.719 1.00 . A A . 2 TYR CD2 1 1
9 1119 1 1 2 TYR CE1 C -0.827 0.729 -2.698 1.00 . A A . 2 TYR CE1 1 1
9 1120 1 1 2 TYR CE2 C -1.554 -1.479 -3.386 1.00 . A A . 2 TYR CE2 1 1
9 1121 1 1 2 TYR CG C -3.013 -0.086 -2.041 1.00 . A A . 2 TYR CG 1 1
9 1122 1 1 2 TYR CZ C -0.583 -0.472 -3.375 1.00 . A A . 2 TYR CZ 1 1
9 1123 1 1 2 TYR H H -6.072 0.791 0.502 1.00 . A A . 2 TYR H 1 1
9 1124 1 1 2 TYR HA H -3.779 -1.060 0.385 1.00 . A A . 2 TYR HA 1 1
9 1125 1 1 2 TYR HB2 H -5.047 -0.599 -1.672 1.00 . A A . 2 TYR HB2 1 1
9 1126 1 1 2 TYR HB3 H -4.687 1.121 -1.519 1.00 . A A . 2 TYR HB3 1 1
9 1127 1 1 2 TYR HD1 H -2.229 1.848 -1.508 1.00 . A A . 2 TYR HD1 1 1
9 1128 1 1 2 TYR HD2 H -3.520 -2.063 -2.726 1.00 . A A . 2 TYR HD2 1 1
9 1129 1 1 2 TYR HE1 H -0.077 1.506 -2.690 1.00 . A A . 2 TYR HE1 1 1
9 1130 1 1 2 TYR HE2 H -1.366 -2.405 -3.908 1.00 . A A . 2 TYR HE2 1 1
9 1131 1 1 2 TYR HH H 0.489 -1.358 -4.682 1.00 . A A . 2 TYR HH 1 1
9 1132 1 1 2 TYR N N -5.402 0.193 0.895 1.00 . A A . 2 TYR N 1 1
9 1133 1 1 2 TYR O O -3.133 2.122 0.376 1.00 . A A . 2 TYR O 1 1
9 1134 1 1 2 TYR OH O 0.615 -0.662 -4.034 1.00 . A A . 2 TYR OH 1 1
9 1135 1 1 3 ASP C C -0.112 1.800 0.733 1.00 . A A . 3 ASP C 1 1
9 1136 1 1 3 ASP CA C -1.031 1.408 1.899 1.00 . A A . 3 ASP CA 1 1
9 1137 1 1 3 ASP CB C -0.207 0.699 2.978 1.00 . A A . 3 ASP CB 1 1
9 1138 1 1 3 ASP CG C 0.653 1.724 3.719 1.00 . A A . 3 ASP CG 1 1
9 1139 1 1 3 ASP H H -2.049 -0.469 1.622 1.00 . A A . 3 ASP H 1 1
9 1140 1 1 3 ASP HA H -1.491 2.288 2.320 1.00 . A A . 3 ASP HA 1 1
9 1141 1 1 3 ASP HB2 H -0.873 0.213 3.676 1.00 . A A . 3 ASP HB2 1 1
9 1142 1 1 3 ASP HB3 H 0.431 -0.038 2.516 1.00 . A A . 3 ASP HB3 1 1
9 1143 1 1 3 ASP N N -2.088 0.484 1.402 1.00 . A A . 3 ASP N 1 1
9 1144 1 1 3 ASP O O 0.583 0.962 0.196 1.00 . A A . 3 ASP O 1 1
9 1145 1 1 3 ASP OD1 O 0.376 2.905 3.590 1.00 . A A . 3 ASP OD1 1 1
9 1146 1 1 3 ASP OD2 O 1.573 1.309 4.405 1.00 . A A . 3 ASP OD2 1 1
9 1147 1 1 4 PRO C C 2.140 3.766 -0.280 1.00 . A A . 4 PRO C 1 1
9 1148 1 1 4 PRO CA C 0.689 3.580 -0.734 1.00 . A A . 4 PRO CA 1 1
9 1149 1 1 4 PRO CB C 0.041 4.926 -1.064 1.00 . A A . 4 PRO CB 1 1
9 1150 1 1 4 PRO CD C -0.984 4.079 1.023 1.00 . A A . 4 PRO CD 1 1
9 1151 1 1 4 PRO CG C -0.739 5.358 0.201 1.00 . A A . 4 PRO CG 1 1
9 1152 1 1 4 PRO HA H 0.637 2.926 -1.588 1.00 . A A . 4 PRO HA 1 1
9 1153 1 1 4 PRO HB2 H 0.804 5.655 -1.302 1.00 . A A . 4 PRO HB2 1 1
9 1154 1 1 4 PRO HB3 H -0.641 4.818 -1.893 1.00 . A A . 4 PRO HB3 1 1
9 1155 1 1 4 PRO HD2 H -0.680 4.229 2.051 1.00 . A A . 4 PRO HD2 1 1
9 1156 1 1 4 PRO HD3 H -2.022 3.789 0.972 1.00 . A A . 4 PRO HD3 1 1
9 1157 1 1 4 PRO HG2 H -0.153 6.065 0.772 1.00 . A A . 4 PRO HG2 1 1
9 1158 1 1 4 PRO HG3 H -1.683 5.798 -0.078 1.00 . A A . 4 PRO HG3 1 1
9 1159 1 1 4 PRO N N -0.137 3.060 0.372 1.00 . A A . 4 PRO N 1 1
9 1160 1 1 4 PRO O O 3.059 3.709 -1.073 1.00 . A A . 4 PRO O 1 1
9 1161 1 1 5 GLU C C 4.612 2.991 1.030 1.00 . A A . 5 GLU C 1 1
9 1162 1 1 5 GLU CA C 3.751 4.174 1.480 1.00 . A A . 5 GLU CA 1 1
9 1163 1 1 5 GLU CB C 3.748 4.256 3.009 1.00 . A A . 5 GLU CB 1 1
9 1164 1 1 5 GLU CD C 4.191 5.951 4.791 1.00 . A A . 5 GLU CD 1 1
9 1165 1 1 5 GLU CG C 4.684 5.379 3.460 1.00 . A A . 5 GLU CG 1 1
9 1166 1 1 5 GLU H H 1.605 4.028 1.614 1.00 . A A . 5 GLU H 1 1
9 1167 1 1 5 GLU HA H 4.156 5.088 1.072 1.00 . A A . 5 GLU HA 1 1
9 1168 1 1 5 GLU HB2 H 2.745 4.460 3.356 1.00 . A A . 5 GLU HB2 1 1
9 1169 1 1 5 GLU HB3 H 4.088 3.319 3.420 1.00 . A A . 5 GLU HB3 1 1
9 1170 1 1 5 GLU HG2 H 5.683 4.986 3.583 1.00 . A A . 5 GLU HG2 1 1
9 1171 1 1 5 GLU HG3 H 4.693 6.162 2.716 1.00 . A A . 5 GLU HG3 1 1
9 1172 1 1 5 GLU N N 2.357 3.986 0.987 1.00 . A A . 5 GLU N 1 1
9 1173 1 1 5 GLU O O 5.616 3.159 0.366 1.00 . A A . 5 GLU O 1 1
9 1174 1 1 5 GLU OE1 O 4.044 5.179 5.726 1.00 . A A . 5 GLU OE1 1 1
9 1175 1 1 5 GLU OE2 O 3.968 7.148 4.853 1.00 . A A . 5 GLU OE2 1 1
9 1176 1 1 6 THR C C 4.487 0.074 -0.368 1.00 . A A . 6 THR C 1 1
9 1177 1 1 6 THR CA C 5.023 0.603 0.964 1.00 . A A . 6 THR CA 1 1
9 1178 1 1 6 THR CB C 4.909 -0.495 2.026 1.00 . A A . 6 THR CB 1 1
9 1179 1 1 6 THR CG2 C 4.945 0.130 3.421 1.00 . A A . 6 THR CG2 1 1
9 1180 1 1 6 THR H H 3.412 1.676 1.912 1.00 . A A . 6 THR H 1 1
9 1181 1 1 6 THR HA H 6.060 0.886 0.847 1.00 . A A . 6 THR HA 1 1
9 1182 1 1 6 THR HB H 5.736 -1.180 1.923 1.00 . A A . 6 THR HB 1 1
9 1183 1 1 6 THR HG1 H 3.415 -1.540 2.703 1.00 . A A . 6 THR HG1 1 1
9 1184 1 1 6 THR HG21 H 5.647 0.950 3.431 1.00 . A A . 6 THR HG21 1 1
9 1185 1 1 6 THR HG22 H 5.251 -0.615 4.141 1.00 . A A . 6 THR HG22 1 1
9 1186 1 1 6 THR HG23 H 3.961 0.494 3.677 1.00 . A A . 6 THR HG23 1 1
9 1187 1 1 6 THR N N 4.227 1.792 1.380 1.00 . A A . 6 THR N 1 1
9 1188 1 1 6 THR O O 5.233 -0.351 -1.226 1.00 . A A . 6 THR O 1 1
9 1189 1 1 6 THR OG1 O 3.687 -1.196 1.848 1.00 . A A . 6 THR OG1 1 1
9 1190 1 1 7 GLY C C 2.246 -1.888 -1.660 1.00 . A A . 7 GLY C 1 1
9 1191 1 1 7 GLY CA C 2.604 -0.409 -1.816 1.00 . A A . 7 GLY CA 1 1
9 1192 1 1 7 GLY H H 2.610 0.440 0.164 1.00 . A A . 7 GLY H 1 1
9 1193 1 1 7 GLY HA2 H 1.713 0.158 -2.048 1.00 . A A . 7 GLY HA2 1 1
9 1194 1 1 7 GLY HA3 H 3.321 -0.297 -2.615 1.00 . A A . 7 GLY HA3 1 1
9 1195 1 1 7 GLY N N 3.194 0.094 -0.544 1.00 . A A . 7 GLY N 1 1
9 1196 1 1 7 GLY O O 2.841 -2.749 -2.276 1.00 . A A . 7 GLY O 1 1
9 1197 1 1 8 THR C C -0.593 -3.695 -0.288 1.00 . A A . 8 THR C 1 1
9 1198 1 1 8 THR CA C 0.884 -3.613 -0.642 1.00 . A A . 8 THR CA 1 1
9 1199 1 1 8 THR CB C 1.720 -4.226 0.485 1.00 . A A . 8 THR CB 1 1
9 1200 1 1 8 THR CG2 C 1.909 -5.722 0.227 1.00 . A A . 8 THR CG2 1 1
9 1201 1 1 8 THR H H 0.811 -1.480 -0.349 1.00 . A A . 8 THR H 1 1
9 1202 1 1 8 THR HA H 1.049 -4.164 -1.554 1.00 . A A . 8 THR HA 1 1
9 1203 1 1 8 THR HB H 1.211 -4.090 1.427 1.00 . A A . 8 THR HB 1 1
9 1204 1 1 8 THR HG1 H 3.336 -3.552 -0.360 1.00 . A A . 8 THR HG1 1 1
9 1205 1 1 8 THR HG21 H 2.277 -5.871 -0.777 1.00 . A A . 8 THR HG21 1 1
9 1206 1 1 8 THR HG22 H 0.963 -6.230 0.343 1.00 . A A . 8 THR HG22 1 1
9 1207 1 1 8 THR HG23 H 2.620 -6.122 0.934 1.00 . A A . 8 THR HG23 1 1
9 1208 1 1 8 THR N N 1.278 -2.189 -0.838 1.00 . A A . 8 THR N 1 1
9 1209 1 1 8 THR O O -1.167 -2.779 0.267 1.00 . A A . 8 THR O 1 1
9 1210 1 1 8 THR OG1 O 2.987 -3.587 0.534 1.00 . A A . 8 THR OG1 1 1
9 1211 1 1 9 TRP C C -2.844 -5.401 1.117 1.00 . A A . 9 TRP C 1 1
9 1212 1 1 9 TRP CA C -2.654 -4.938 -0.327 1.00 . A A . 9 TRP CA 1 1
9 1213 1 1 9 TRP CB C -3.257 -5.964 -1.285 1.00 . A A . 9 TRP CB 1 1
9 1214 1 1 9 TRP CD1 C -4.557 -5.577 -3.415 1.00 . A A . 9 TRP CD1 1 1
9 1215 1 1 9 TRP CD2 C -5.208 -4.233 -1.736 1.00 . A A . 9 TRP CD2 1 1
9 1216 1 1 9 TRP CE2 C -6.020 -3.910 -2.848 1.00 . A A . 9 TRP CE2 1 1
9 1217 1 1 9 TRP CE3 C -5.408 -3.530 -0.538 1.00 . A A . 9 TRP CE3 1 1
9 1218 1 1 9 TRP CG C -4.296 -5.295 -2.119 1.00 . A A . 9 TRP CG 1 1
9 1219 1 1 9 TRP CH2 C -7.187 -2.227 -1.571 1.00 . A A . 9 TRP CH2 1 1
9 1220 1 1 9 TRP CZ2 C -7.000 -2.919 -2.772 1.00 . A A . 9 TRP CZ2 1 1
9 1221 1 1 9 TRP CZ3 C -6.391 -2.530 -0.456 1.00 . A A . 9 TRP CZ3 1 1
9 1222 1 1 9 TRP H H -0.738 -5.505 -1.076 1.00 . A A . 9 TRP H 1 1
9 1223 1 1 9 TRP HA H -3.133 -3.990 -0.469 1.00 . A A . 9 TRP HA 1 1
9 1224 1 1 9 TRP HB2 H -2.481 -6.362 -1.923 1.00 . A A . 9 TRP HB2 1 1
9 1225 1 1 9 TRP HB3 H -3.708 -6.766 -0.720 1.00 . A A . 9 TRP HB3 1 1
9 1226 1 1 9 TRP HD1 H -4.049 -6.321 -4.010 1.00 . A A . 9 TRP HD1 1 1
9 1227 1 1 9 TRP HE1 H -5.972 -4.763 -4.750 1.00 . A A . 9 TRP HE1 1 1
9 1228 1 1 9 TRP HE3 H -4.793 -3.757 0.324 1.00 . A A . 9 TRP HE3 1 1
9 1229 1 1 9 TRP HH2 H -7.943 -1.458 -1.503 1.00 . A A . 9 TRP HH2 1 1
9 1230 1 1 9 TRP HZ2 H -7.610 -2.690 -3.633 1.00 . A A . 9 TRP HZ2 1 1
9 1231 1 1 9 TRP HZ3 H -6.537 -1.994 0.470 1.00 . A A . 9 TRP HZ3 1 1
9 1232 1 1 9 TRP N N -1.216 -4.788 -0.621 1.00 . A A . 9 TRP N 1 1
9 1233 1 1 9 TRP NE1 N -5.586 -4.758 -3.849 1.00 . A A . 9 TRP NE1 1 1
9 1234 1 1 9 TRP O O -3.526 -4.770 1.899 1.00 . A A . 9 TRP O 1 1
9 1235 1 1 10 GLY C C -1.006 -7.346 3.435 1.00 . A A . 10 GLY C 1 1
9 1236 1 1 10 GLY CA C -2.387 -7.010 2.868 1.00 . A A . 10 GLY CA 1 1
9 1237 1 1 10 GLY H H -1.701 -6.991 0.825 1.00 . A A . 10 GLY H 1 1
9 1238 1 1 10 GLY HA2 H -2.855 -6.252 3.480 1.00 . A A . 10 GLY HA2 1 1
9 1239 1 1 10 GLY HA3 H -2.997 -7.900 2.866 1.00 . A A . 10 GLY HA3 1 1
9 1240 1 1 10 GLY N N -2.244 -6.500 1.475 1.00 . A A . 10 GLY N 1 1
9 1241 1 1 10 GLY O O -0.791 -7.090 4.609 1.00 . A A . 10 GLY O 1 1
9 1242 1 1 10 GLY OXT O -0.188 -7.853 2.686 1.00 . A A . 10 GLY OXT 1 1
10 1243 1 1 1 GLY C C -5.444 -0.310 1.960 1.00 . A A . 1 GLY C 1 1
10 1244 1 1 1 GLY CA C -6.779 -0.195 2.697 1.00 . A A . 1 GLY CA 1 1
10 1245 1 1 1 GLY H1 H -7.266 0.007 4.711 1.00 . A A . 1 GLY H1 1 1
10 1246 1 1 1 GLY H2 H -6.627 1.415 4.007 1.00 . A A . 1 GLY H2 1 1
10 1247 1 1 1 GLY H3 H -5.604 0.113 4.388 1.00 . A A . 1 GLY H3 1 1
10 1248 1 1 1 GLY HA2 H -7.224 -1.176 2.791 1.00 . A A . 1 GLY HA2 1 1
10 1249 1 1 1 GLY HA3 H -7.440 0.449 2.138 1.00 . A A . 1 GLY HA3 1 1
10 1250 1 1 1 GLY N N -6.552 0.379 4.053 1.00 . A A . 1 GLY N 1 1
10 1251 1 1 1 GLY O O -4.448 -0.723 2.520 1.00 . A A . 1 GLY O 1 1
10 1252 1 1 2 TYR C C -3.119 0.939 0.520 1.00 . A A . 2 TYR C 1 1
10 1253 1 1 2 TYR CA C -4.143 -0.034 -0.065 1.00 . A A . 2 TYR CA 1 1
10 1254 1 1 2 TYR CB C -4.409 0.326 -1.529 1.00 . A A . 2 TYR CB 1 1
10 1255 1 1 2 TYR CD1 C -2.598 -0.887 -2.793 1.00 . A A . 2 TYR CD1 1 1
10 1256 1 1 2 TYR CD2 C -2.409 1.512 -2.501 1.00 . A A . 2 TYR CD2 1 1
10 1257 1 1 2 TYR CE1 C -1.390 -0.897 -3.501 1.00 . A A . 2 TYR CE1 1 1
10 1258 1 1 2 TYR CE2 C -1.202 1.504 -3.210 1.00 . A A . 2 TYR CE2 1 1
10 1259 1 1 2 TYR CG C -3.107 0.316 -2.293 1.00 . A A . 2 TYR CG 1 1
10 1260 1 1 2 TYR CZ C -0.693 0.299 -3.710 1.00 . A A . 2 TYR CZ 1 1
10 1261 1 1 2 TYR H H -6.228 0.384 0.274 1.00 . A A . 2 TYR H 1 1
10 1262 1 1 2 TYR HA H -3.756 -1.041 -0.008 1.00 . A A . 2 TYR HA 1 1
10 1263 1 1 2 TYR HB2 H -5.085 -0.395 -1.961 1.00 . A A . 2 TYR HB2 1 1
10 1264 1 1 2 TYR HB3 H -4.848 1.311 -1.582 1.00 . A A . 2 TYR HB3 1 1
10 1265 1 1 2 TYR HD1 H -3.137 -1.810 -2.632 1.00 . A A . 2 TYR HD1 1 1
10 1266 1 1 2 TYR HD2 H -2.802 2.441 -2.114 1.00 . A A . 2 TYR HD2 1 1
10 1267 1 1 2 TYR HE1 H -0.998 -1.826 -3.888 1.00 . A A . 2 TYR HE1 1 1
10 1268 1 1 2 TYR HE2 H -0.663 2.426 -3.370 1.00 . A A . 2 TYR HE2 1 1
10 1269 1 1 2 TYR HH H 0.653 1.178 -4.740 1.00 . A A . 2 TYR HH 1 1
10 1270 1 1 2 TYR N N -5.414 0.055 0.707 1.00 . A A . 2 TYR N 1 1
10 1271 1 1 2 TYR O O -3.334 2.134 0.558 1.00 . A A . 2 TYR O 1 1
10 1272 1 1 2 TYR OH O 0.497 0.290 -4.409 1.00 . A A . 2 TYR OH 1 1
10 1273 1 1 3 ASP C C -0.098 1.903 0.423 1.00 . A A . 3 ASP C 1 1
10 1274 1 1 3 ASP CA C -0.964 1.333 1.554 1.00 . A A . 3 ASP CA 1 1
10 1275 1 1 3 ASP CB C -0.081 0.532 2.513 1.00 . A A . 3 ASP CB 1 1
10 1276 1 1 3 ASP CG C -0.061 1.217 3.881 1.00 . A A . 3 ASP CG 1 1
10 1277 1 1 3 ASP H H -1.848 -0.529 0.933 1.00 . A A . 3 ASP H 1 1
10 1278 1 1 3 ASP HA H -1.443 2.135 2.094 1.00 . A A . 3 ASP HA 1 1
10 1279 1 1 3 ASP HB2 H -0.477 -0.468 2.617 1.00 . A A . 3 ASP HB2 1 1
10 1280 1 1 3 ASP HB3 H 0.924 0.483 2.122 1.00 . A A . 3 ASP HB3 1 1
10 1281 1 1 3 ASP N N -2.002 0.437 0.974 1.00 . A A . 3 ASP N 1 1
10 1282 1 1 3 ASP O O 0.613 1.169 -0.232 1.00 . A A . 3 ASP O 1 1
10 1283 1 1 3 ASP OD1 O -0.268 2.418 3.922 1.00 . A A . 3 ASP OD1 1 1
10 1284 1 1 3 ASP OD2 O 0.163 0.529 4.863 1.00 . A A . 3 ASP OD2 1 1
10 1285 1 1 4 PRO C C 2.046 4.067 -0.383 1.00 . A A . 4 PRO C 1 1
10 1286 1 1 4 PRO CA C 0.592 3.883 -0.825 1.00 . A A . 4 PRO CA 1 1
10 1287 1 1 4 PRO CB C -0.115 5.234 -0.967 1.00 . A A . 4 PRO CB 1 1
10 1288 1 1 4 PRO CD C -1.045 4.091 1.022 1.00 . A A . 4 PRO CD 1 1
10 1289 1 1 4 PRO CG C -0.872 5.472 0.361 1.00 . A A . 4 PRO CG 1 1
10 1290 1 1 4 PRO HA H 0.539 3.339 -1.754 1.00 . A A . 4 PRO HA 1 1
10 1291 1 1 4 PRO HB2 H 0.614 6.017 -1.127 1.00 . A A . 4 PRO HB2 1 1
10 1292 1 1 4 PRO HB3 H -0.817 5.203 -1.785 1.00 . A A . 4 PRO HB3 1 1
10 1293 1 1 4 PRO HD2 H -0.715 4.122 2.052 1.00 . A A . 4 PRO HD2 1 1
10 1294 1 1 4 PRO HD3 H -2.072 3.769 0.961 1.00 . A A . 4 PRO HD3 1 1
10 1295 1 1 4 PRO HG2 H -0.295 6.123 1.003 1.00 . A A . 4 PRO HG2 1 1
10 1296 1 1 4 PRO HG3 H -1.840 5.905 0.165 1.00 . A A . 4 PRO HG3 1 1
10 1297 1 1 4 PRO N N -0.181 3.196 0.224 1.00 . A A . 4 PRO N 1 1
10 1298 1 1 4 PRO O O 2.909 4.395 -1.174 1.00 . A A . 4 PRO O 1 1
10 1299 1 1 5 GLU C C 4.505 2.724 1.104 1.00 . A A . 5 GLU C 1 1
10 1300 1 1 5 GLU CA C 3.723 4.015 1.364 1.00 . A A . 5 GLU CA 1 1
10 1301 1 1 5 GLU CB C 3.706 4.307 2.867 1.00 . A A . 5 GLU CB 1 1
10 1302 1 1 5 GLU CD C 4.940 5.732 4.506 1.00 . A A . 5 GLU CD 1 1
10 1303 1 1 5 GLU CG C 4.287 5.698 3.124 1.00 . A A . 5 GLU CG 1 1
10 1304 1 1 5 GLU H H 1.615 3.588 1.495 1.00 . A A . 5 GLU H 1 1
10 1305 1 1 5 GLU HA H 4.196 4.833 0.843 1.00 . A A . 5 GLU HA 1 1
10 1306 1 1 5 GLU HB2 H 2.688 4.267 3.229 1.00 . A A . 5 GLU HB2 1 1
10 1307 1 1 5 GLU HB3 H 4.301 3.569 3.384 1.00 . A A . 5 GLU HB3 1 1
10 1308 1 1 5 GLU HG2 H 5.027 5.923 2.369 1.00 . A A . 5 GLU HG2 1 1
10 1309 1 1 5 GLU HG3 H 3.496 6.432 3.083 1.00 . A A . 5 GLU HG3 1 1
10 1310 1 1 5 GLU N N 2.325 3.854 0.873 1.00 . A A . 5 GLU N 1 1
10 1311 1 1 5 GLU O O 5.565 2.739 0.510 1.00 . A A . 5 GLU O 1 1
10 1312 1 1 5 GLU OE1 O 5.881 4.984 4.713 1.00 . A A . 5 GLU OE1 1 1
10 1313 1 1 5 GLU OE2 O 4.487 6.504 5.335 1.00 . A A . 5 GLU OE2 1 1
10 1314 1 1 6 THR C C 4.365 -0.212 -0.081 1.00 . A A . 6 THR C 1 1
10 1315 1 1 6 THR CA C 4.703 0.318 1.315 1.00 . A A . 6 THR CA 1 1
10 1316 1 1 6 THR CB C 4.266 -0.701 2.371 1.00 . A A . 6 THR CB 1 1
10 1317 1 1 6 THR CG2 C 4.558 -0.146 3.766 1.00 . A A . 6 THR CG2 1 1
10 1318 1 1 6 THR H H 3.133 1.616 2.016 1.00 . A A . 6 THR H 1 1
10 1319 1 1 6 THR HA H 5.769 0.479 1.390 1.00 . A A . 6 THR HA 1 1
10 1320 1 1 6 THR HB H 4.812 -1.620 2.232 1.00 . A A . 6 THR HB 1 1
10 1321 1 1 6 THR HG1 H 2.410 -0.409 2.882 1.00 . A A . 6 THR HG1 1 1
10 1322 1 1 6 THR HG21 H 3.646 -0.125 4.344 1.00 . A A . 6 THR HG21 1 1
10 1323 1 1 6 THR HG22 H 4.953 0.854 3.679 1.00 . A A . 6 THR HG22 1 1
10 1324 1 1 6 THR HG23 H 5.282 -0.777 4.259 1.00 . A A . 6 THR HG23 1 1
10 1325 1 1 6 THR N N 3.990 1.607 1.541 1.00 . A A . 6 THR N 1 1
10 1326 1 1 6 THR O O 5.232 -0.626 -0.825 1.00 . A A . 6 THR O 1 1
10 1327 1 1 6 THR OG1 O 2.872 -0.950 2.238 1.00 . A A . 6 THR OG1 1 1
10 1328 1 1 7 GLY C C 2.411 -2.195 -1.722 1.00 . A A . 7 GLY C 1 1
10 1329 1 1 7 GLY CA C 2.721 -0.698 -1.793 1.00 . A A . 7 GLY CA 1 1
10 1330 1 1 7 GLY H H 2.427 0.142 0.169 1.00 . A A . 7 GLY H 1 1
10 1331 1 1 7 GLY HA2 H 1.845 -0.164 -2.135 1.00 . A A . 7 GLY HA2 1 1
10 1332 1 1 7 GLY HA3 H 3.534 -0.536 -2.486 1.00 . A A . 7 GLY HA3 1 1
10 1333 1 1 7 GLY N N 3.111 -0.199 -0.444 1.00 . A A . 7 GLY N 1 1
10 1334 1 1 7 GLY O O 3.064 -3.004 -2.352 1.00 . A A . 7 GLY O 1 1
10 1335 1 1 8 THR C C -0.376 -4.161 -0.395 1.00 . A A . 8 THR C 1 1
10 1336 1 1 8 THR CA C 1.065 -4.016 -0.860 1.00 . A A . 8 THR CA 1 1
10 1337 1 1 8 THR CB C 1.995 -4.707 0.140 1.00 . A A . 8 THR CB 1 1
10 1338 1 1 8 THR CG2 C 2.020 -6.211 -0.139 1.00 . A A . 8 THR CG2 1 1
10 1339 1 1 8 THR H H 0.900 -1.903 -0.467 1.00 . A A . 8 THR H 1 1
10 1340 1 1 8 THR HA H 1.166 -4.481 -1.826 1.00 . A A . 8 THR HA 1 1
10 1341 1 1 8 THR HB H 1.632 -4.538 1.141 1.00 . A A . 8 THR HB 1 1
10 1342 1 1 8 THR HG1 H 3.763 -4.309 0.845 1.00 . A A . 8 THR HG1 1 1
10 1343 1 1 8 THR HG21 H 1.968 -6.381 -1.204 1.00 . A A . 8 THR HG21 1 1
10 1344 1 1 8 THR HG22 H 1.174 -6.680 0.343 1.00 . A A . 8 THR HG22 1 1
10 1345 1 1 8 THR HG23 H 2.935 -6.633 0.250 1.00 . A A . 8 THR HG23 1 1
10 1346 1 1 8 THR N N 1.417 -2.571 -0.964 1.00 . A A . 8 THR N 1 1
10 1347 1 1 8 THR O O -0.923 -3.294 0.258 1.00 . A A . 8 THR O 1 1
10 1348 1 1 8 THR OG1 O 3.307 -4.175 0.012 1.00 . A A . 8 THR OG1 1 1
10 1349 1 1 9 TRP C C -2.449 -6.246 0.981 1.00 . A A . 9 TRP C 1 1
10 1350 1 1 9 TRP CA C -2.401 -5.456 -0.329 1.00 . A A . 9 TRP CA 1 1
10 1351 1 1 9 TRP CB C -3.138 -6.226 -1.426 1.00 . A A . 9 TRP CB 1 1
10 1352 1 1 9 TRP CD1 C -4.503 -5.330 -3.351 1.00 . A A . 9 TRP CD1 1 1
10 1353 1 1 9 TRP CD2 C -4.985 -4.326 -1.401 1.00 . A A . 9 TRP CD2 1 1
10 1354 1 1 9 TRP CE2 C -5.818 -3.732 -2.376 1.00 . A A . 9 TRP CE2 1 1
10 1355 1 1 9 TRP CE3 C -5.085 -3.872 -0.075 1.00 . A A . 9 TRP CE3 1 1
10 1356 1 1 9 TRP CG C -4.164 -5.337 -2.043 1.00 . A A . 9 TRP CG 1 1
10 1357 1 1 9 TRP CH2 C -6.810 -2.281 -0.722 1.00 . A A . 9 TRP CH2 1 1
10 1358 1 1 9 TRP CZ2 C -6.722 -2.721 -2.047 1.00 . A A . 9 TRP CZ2 1 1
10 1359 1 1 9 TRP CZ3 C -5.993 -2.856 0.263 1.00 . A A . 9 TRP CZ3 1 1
10 1360 1 1 9 TRP H H -0.545 -5.929 -1.267 1.00 . A A . 9 TRP H 1 1
10 1361 1 1 9 TRP HA H -2.859 -4.495 -0.195 1.00 . A A . 9 TRP HA 1 1
10 1362 1 1 9 TRP HB2 H -2.434 -6.544 -2.180 1.00 . A A . 9 TRP HB2 1 1
10 1363 1 1 9 TRP HB3 H -3.622 -7.090 -0.996 1.00 . A A . 9 TRP HB3 1 1
10 1364 1 1 9 TRP HD1 H -4.076 -5.964 -4.114 1.00 . A A . 9 TRP HD1 1 1
10 1365 1 1 9 TRP HE1 H -5.909 -4.172 -4.411 1.00 . A A . 9 TRP HE1 1 1
10 1366 1 1 9 TRP HE3 H -4.454 -4.310 0.687 1.00 . A A . 9 TRP HE3 1 1
10 1367 1 1 9 TRP HH2 H -7.508 -1.500 -0.458 1.00 . A A . 9 TRP HH2 1 1
10 1368 1 1 9 TRP HZ2 H -7.348 -2.283 -2.809 1.00 . A A . 9 TRP HZ2 1 1
10 1369 1 1 9 TRP HZ3 H -6.063 -2.515 1.285 1.00 . A A . 9 TRP HZ3 1 1
10 1370 1 1 9 TRP N N -0.998 -5.251 -0.736 1.00 . A A . 9 TRP N 1 1
10 1371 1 1 9 TRP NE1 N -5.487 -4.377 -3.552 1.00 . A A . 9 TRP NE1 1 1
10 1372 1 1 9 TRP O O -2.508 -7.459 0.983 1.00 . A A . 9 TRP O 1 1
10 1373 1 1 10 GLY C C -1.281 -7.245 3.500 1.00 . A A . 10 GLY C 1 1
10 1374 1 1 10 GLY CA C -2.465 -6.281 3.403 1.00 . A A . 10 GLY CA 1 1
10 1375 1 1 10 GLY H H -2.374 -4.588 2.073 1.00 . A A . 10 GLY H 1 1
10 1376 1 1 10 GLY HA2 H -2.412 -5.561 4.207 1.00 . A A . 10 GLY HA2 1 1
10 1377 1 1 10 GLY HA3 H -3.385 -6.839 3.479 1.00 . A A . 10 GLY HA3 1 1
10 1378 1 1 10 GLY N N -2.422 -5.567 2.095 1.00 . A A . 10 GLY N 1 1
10 1379 1 1 10 GLY O O -1.377 -8.198 4.255 1.00 . A A . 10 GLY O 1 1
10 1380 1 1 10 GLY OXT O -0.297 -7.013 2.816 1.00 . A A . 10 GLY OXT 1 1
11 1381 1 1 1 GLY C C -5.367 -0.277 2.233 1.00 . A A . 1 GLY C 1 1
11 1382 1 1 1 GLY CA C -6.702 -0.200 2.974 1.00 . A A . 1 GLY CA 1 1
11 1383 1 1 1 GLY H1 H -7.268 0.179 4.942 1.00 . A A . 1 GLY H1 1 1
11 1384 1 1 1 GLY H2 H -5.595 0.286 4.668 1.00 . A A . 1 GLY H2 1 1
11 1385 1 1 1 GLY H3 H -6.350 -1.233 4.747 1.00 . A A . 1 GLY H3 1 1
11 1386 1 1 1 GLY HA2 H -7.324 -1.035 2.686 1.00 . A A . 1 GLY HA2 1 1
11 1387 1 1 1 GLY HA3 H -7.198 0.724 2.718 1.00 . A A . 1 GLY HA3 1 1
11 1388 1 1 1 GLY N N -6.461 -0.245 4.443 1.00 . A A . 1 GLY N 1 1
11 1389 1 1 1 GLY O O -4.355 -0.650 2.792 1.00 . A A . 1 GLY O 1 1
11 1390 1 1 2 TYR C C -3.156 1.141 0.647 1.00 . A A . 2 TYR C 1 1
11 1391 1 1 2 TYR CA C -4.086 0.014 0.196 1.00 . A A . 2 TYR CA 1 1
11 1392 1 1 2 TYR CB C -4.394 0.176 -1.292 1.00 . A A . 2 TYR CB 1 1
11 1393 1 1 2 TYR CD1 C -2.109 0.923 -2.055 1.00 . A A . 2 TYR CD1 1 1
11 1394 1 1 2 TYR CD2 C -2.983 -1.185 -2.878 1.00 . A A . 2 TYR CD2 1 1
11 1395 1 1 2 TYR CE1 C -0.938 0.728 -2.800 1.00 . A A . 2 TYR CE1 1 1
11 1396 1 1 2 TYR CE2 C -1.813 -1.378 -3.623 1.00 . A A . 2 TYR CE2 1 1
11 1397 1 1 2 TYR CG C -3.131 -0.034 -2.094 1.00 . A A . 2 TYR CG 1 1
11 1398 1 1 2 TYR CZ C -0.790 -0.422 -3.583 1.00 . A A . 2 TYR CZ 1 1
11 1399 1 1 2 TYR H H -6.184 0.366 0.542 1.00 . A A . 2 TYR H 1 1
11 1400 1 1 2 TYR HA H -3.604 -0.937 0.362 1.00 . A A . 2 TYR HA 1 1
11 1401 1 1 2 TYR HB2 H -5.133 -0.553 -1.586 1.00 . A A . 2 TYR HB2 1 1
11 1402 1 1 2 TYR HB3 H -4.774 1.170 -1.476 1.00 . A A . 2 TYR HB3 1 1
11 1403 1 1 2 TYR HD1 H -2.223 1.810 -1.450 1.00 . A A . 2 TYR HD1 1 1
11 1404 1 1 2 TYR HD2 H -3.771 -1.922 -2.909 1.00 . A A . 2 TYR HD2 1 1
11 1405 1 1 2 TYR HE1 H -0.150 1.466 -2.769 1.00 . A A . 2 TYR HE1 1 1
11 1406 1 1 2 TYR HE2 H -1.698 -2.267 -4.227 1.00 . A A . 2 TYR HE2 1 1
11 1407 1 1 2 TYR HH H 0.692 -1.496 -4.126 1.00 . A A . 2 TYR HH 1 1
11 1408 1 1 2 TYR N N -5.356 0.070 0.975 1.00 . A A . 2 TYR N 1 1
11 1409 1 1 2 TYR O O -3.335 2.289 0.293 1.00 . A A . 2 TYR O 1 1
11 1410 1 1 2 TYR OH O 0.362 -0.615 -4.317 1.00 . A A . 2 TYR OH 1 1
11 1411 1 1 3 ASP C C -0.139 2.095 0.821 1.00 . A A . 3 ASP C 1 1
11 1412 1 1 3 ASP CA C -1.212 1.867 1.893 1.00 . A A . 3 ASP CA 1 1
11 1413 1 1 3 ASP CB C -0.542 1.402 3.188 1.00 . A A . 3 ASP CB 1 1
11 1414 1 1 3 ASP CG C 0.348 2.521 3.732 1.00 . A A . 3 ASP CG 1 1
11 1415 1 1 3 ASP H H -2.032 -0.114 1.691 1.00 . A A . 3 ASP H 1 1
11 1416 1 1 3 ASP HA H -1.752 2.782 2.077 1.00 . A A . 3 ASP HA 1 1
11 1417 1 1 3 ASP HB2 H -1.301 1.156 3.917 1.00 . A A . 3 ASP HB2 1 1
11 1418 1 1 3 ASP HB3 H 0.062 0.529 2.987 1.00 . A A . 3 ASP HB3 1 1
11 1419 1 1 3 ASP N N -2.159 0.818 1.422 1.00 . A A . 3 ASP N 1 1
11 1420 1 1 3 ASP O O 0.608 1.190 0.503 1.00 . A A . 3 ASP O 1 1
11 1421 1 1 3 ASP OD1 O 0.125 3.662 3.364 1.00 . A A . 3 ASP OD1 1 1
11 1422 1 1 3 ASP OD2 O 1.237 2.217 4.509 1.00 . A A . 3 ASP OD2 1 1
11 1423 1 1 4 PRO C C 2.269 3.882 -0.116 1.00 . A A . 4 PRO C 1 1
11 1424 1 1 4 PRO CA C 0.893 3.654 -0.745 1.00 . A A . 4 PRO CA 1 1
11 1425 1 1 4 PRO CB C 0.331 4.948 -1.338 1.00 . A A . 4 PRO CB 1 1
11 1426 1 1 4 PRO CD C -0.993 4.396 0.678 1.00 . A A . 4 PRO CD 1 1
11 1427 1 1 4 PRO CG C -0.605 5.550 -0.265 1.00 . A A . 4 PRO CG 1 1
11 1428 1 1 4 PRO HA H 0.942 2.890 -1.505 1.00 . A A . 4 PRO HA 1 1
11 1429 1 1 4 PRO HB2 H 1.138 5.633 -1.561 1.00 . A A . 4 PRO HB2 1 1
11 1430 1 1 4 PRO HB3 H -0.232 4.733 -2.234 1.00 . A A . 4 PRO HB3 1 1
11 1431 1 1 4 PRO HD2 H -0.830 4.680 1.708 1.00 . A A . 4 PRO HD2 1 1
11 1432 1 1 4 PRO HD3 H -2.021 4.107 0.521 1.00 . A A . 4 PRO HD3 1 1
11 1433 1 1 4 PRO HG2 H -0.088 6.325 0.285 1.00 . A A . 4 PRO HG2 1 1
11 1434 1 1 4 PRO HG3 H -1.491 5.953 -0.730 1.00 . A A . 4 PRO HG3 1 1
11 1435 1 1 4 PRO N N -0.088 3.293 0.293 1.00 . A A . 4 PRO N 1 1
11 1436 1 1 4 PRO O O 3.279 3.890 -0.793 1.00 . A A . 4 PRO O 1 1
11 1437 1 1 5 GLU C C 4.416 2.964 1.836 1.00 . A A . 5 GLU C 1 1
11 1438 1 1 5 GLU CA C 3.630 4.276 1.847 1.00 . A A . 5 GLU CA 1 1
11 1439 1 1 5 GLU CB C 3.396 4.722 3.292 1.00 . A A . 5 GLU CB 1 1
11 1440 1 1 5 GLU CD C 4.413 6.999 3.452 1.00 . A A . 5 GLU CD 1 1
11 1441 1 1 5 GLU CG C 4.605 5.518 3.784 1.00 . A A . 5 GLU CG 1 1
11 1442 1 1 5 GLU H H 1.493 4.043 1.704 1.00 . A A . 5 GLU H 1 1
11 1443 1 1 5 GLU HA H 4.186 5.036 1.318 1.00 . A A . 5 GLU HA 1 1
11 1444 1 1 5 GLU HB2 H 2.512 5.342 3.339 1.00 . A A . 5 GLU HB2 1 1
11 1445 1 1 5 GLU HB3 H 3.259 3.854 3.919 1.00 . A A . 5 GLU HB3 1 1
11 1446 1 1 5 GLU HG2 H 4.705 5.397 4.853 1.00 . A A . 5 GLU HG2 1 1
11 1447 1 1 5 GLU HG3 H 5.498 5.155 3.296 1.00 . A A . 5 GLU HG3 1 1
11 1448 1 1 5 GLU N N 2.318 4.059 1.175 1.00 . A A . 5 GLU N 1 1
11 1449 1 1 5 GLU O O 5.612 2.942 2.050 1.00 . A A . 5 GLU O 1 1
11 1450 1 1 5 GLU OE1 O 3.886 7.285 2.390 1.00 . A A . 5 GLU OE1 1 1
11 1451 1 1 5 GLU OE2 O 4.797 7.822 4.267 1.00 . A A . 5 GLU OE2 1 1
11 1452 1 1 6 THR C C 4.357 -0.031 0.143 1.00 . A A . 6 THR C 1 1
11 1453 1 1 6 THR CA C 4.448 0.556 1.553 1.00 . A A . 6 THR CA 1 1
11 1454 1 1 6 THR CB C 3.781 -0.396 2.549 1.00 . A A . 6 THR CB 1 1
11 1455 1 1 6 THR CG2 C 4.603 -1.682 2.659 1.00 . A A . 6 THR CG2 1 1
11 1456 1 1 6 THR H H 2.785 1.916 1.414 1.00 . A A . 6 THR H 1 1
11 1457 1 1 6 THR HA H 5.485 0.692 1.823 1.00 . A A . 6 THR HA 1 1
11 1458 1 1 6 THR HB H 2.788 -0.639 2.206 1.00 . A A . 6 THR HB 1 1
11 1459 1 1 6 THR HG1 H 4.466 0.804 3.918 1.00 . A A . 6 THR HG1 1 1
11 1460 1 1 6 THR HG21 H 4.308 -2.366 1.878 1.00 . A A . 6 THR HG21 1 1
11 1461 1 1 6 THR HG22 H 4.428 -2.138 3.623 1.00 . A A . 6 THR HG22 1 1
11 1462 1 1 6 THR HG23 H 5.652 -1.448 2.555 1.00 . A A . 6 THR HG23 1 1
11 1463 1 1 6 THR N N 3.749 1.871 1.584 1.00 . A A . 6 THR N 1 1
11 1464 1 1 6 THR O O 5.353 -0.369 -0.465 1.00 . A A . 6 THR O 1 1
11 1465 1 1 6 THR OG1 O 3.703 0.229 3.823 1.00 . A A . 6 THR OG1 1 1
11 1466 1 1 7 GLY C C 2.584 -2.182 -1.669 1.00 . A A . 7 GLY C 1 1
11 1467 1 1 7 GLY CA C 3.011 -0.714 -1.755 1.00 . A A . 7 GLY CA 1 1
11 1468 1 1 7 GLY H H 2.378 0.128 0.124 1.00 . A A . 7 GLY H 1 1
11 1469 1 1 7 GLY HA2 H 2.259 -0.151 -2.289 1.00 . A A . 7 GLY HA2 1 1
11 1470 1 1 7 GLY HA3 H 3.951 -0.646 -2.281 1.00 . A A . 7 GLY HA3 1 1
11 1471 1 1 7 GLY N N 3.168 -0.152 -0.383 1.00 . A A . 7 GLY N 1 1
11 1472 1 1 7 GLY O O 3.198 -3.051 -2.256 1.00 . A A . 7 GLY O 1 1
11 1473 1 1 8 THR C C -0.385 -3.910 -0.395 1.00 . A A . 8 THR C 1 1
11 1474 1 1 8 THR CA C 1.072 -3.879 -0.827 1.00 . A A . 8 THR CA 1 1
11 1475 1 1 8 THR CB C 1.926 -4.625 0.201 1.00 . A A . 8 THR CB 1 1
11 1476 1 1 8 THR CG2 C 2.131 -6.069 -0.258 1.00 . A A . 8 THR CG2 1 1
11 1477 1 1 8 THR H H 1.053 -1.752 -0.480 1.00 . A A . 8 THR H 1 1
11 1478 1 1 8 THR HA H 1.154 -4.366 -1.785 1.00 . A A . 8 THR HA 1 1
11 1479 1 1 8 THR HB H 1.421 -4.624 1.156 1.00 . A A . 8 THR HB 1 1
11 1480 1 1 8 THR HG1 H 3.729 -4.244 -0.416 1.00 . A A . 8 THR HG1 1 1
11 1481 1 1 8 THR HG21 H 2.964 -6.502 0.275 1.00 . A A . 8 THR HG21 1 1
11 1482 1 1 8 THR HG22 H 2.334 -6.085 -1.318 1.00 . A A . 8 THR HG22 1 1
11 1483 1 1 8 THR HG23 H 1.237 -6.642 -0.055 1.00 . A A . 8 THR HG23 1 1
11 1484 1 1 8 THR N N 1.536 -2.466 -0.944 1.00 . A A . 8 THR N 1 1
11 1485 1 1 8 THR O O -0.880 -3.006 0.248 1.00 . A A . 8 THR O 1 1
11 1486 1 1 8 THR OG1 O 3.184 -3.980 0.329 1.00 . A A . 8 THR OG1 1 1
11 1487 1 1 9 TRP C C -2.634 -5.642 1.013 1.00 . A A . 9 TRP C 1 1
11 1488 1 1 9 TRP CA C -2.504 -5.055 -0.392 1.00 . A A . 9 TRP CA 1 1
11 1489 1 1 9 TRP CB C -3.209 -5.963 -1.398 1.00 . A A . 9 TRP CB 1 1
11 1490 1 1 9 TRP CD1 C -4.629 -5.322 -3.381 1.00 . A A . 9 TRP CD1 1 1
11 1491 1 1 9 TRP CD2 C -5.113 -4.137 -1.537 1.00 . A A . 9 TRP CD2 1 1
11 1492 1 1 9 TRP CE2 C -5.985 -3.676 -2.549 1.00 . A A . 9 TRP CE2 1 1
11 1493 1 1 9 TRP CE3 C -5.202 -3.555 -0.262 1.00 . A A . 9 TRP CE3 1 1
11 1494 1 1 9 TRP CG C -4.271 -5.182 -2.088 1.00 . A A . 9 TRP CG 1 1
11 1495 1 1 9 TRP CH2 C -6.995 -2.097 -1.028 1.00 . A A . 9 TRP CH2 1 1
11 1496 1 1 9 TRP CZ2 C -6.918 -2.668 -2.304 1.00 . A A . 9 TRP CZ2 1 1
11 1497 1 1 9 TRP CZ3 C -6.137 -2.539 -0.009 1.00 . A A . 9 TRP CZ3 1 1
11 1498 1 1 9 TRP H H -0.661 -5.657 -1.282 1.00 . A A . 9 TRP H 1 1
11 1499 1 1 9 TRP HA H -2.944 -4.078 -0.422 1.00 . A A . 9 TRP HA 1 1
11 1500 1 1 9 TRP HB2 H -2.493 -6.321 -2.125 1.00 . A A . 9 TRP HB2 1 1
11 1501 1 1 9 TRP HB3 H -3.652 -6.800 -0.882 1.00 . A A . 9 TRP HB3 1 1
11 1502 1 1 9 TRP HD1 H -4.189 -6.017 -4.081 1.00 . A A . 9 TRP HD1 1 1
11 1503 1 1 9 TRP HE1 H -6.098 -4.332 -4.527 1.00 . A A . 9 TRP HE1 1 1
11 1504 1 1 9 TRP HE3 H -4.538 -3.891 0.524 1.00 . A A . 9 TRP HE3 1 1
11 1505 1 1 9 TRP HH2 H -7.712 -1.315 -0.827 1.00 . A A . 9 TRP HH2 1 1
11 1506 1 1 9 TRP HZ2 H -7.577 -2.332 -3.090 1.00 . A A . 9 TRP HZ2 1 1
11 1507 1 1 9 TRP HZ3 H -6.198 -2.097 0.975 1.00 . A A . 9 TRP HZ3 1 1
11 1508 1 1 9 TRP N N -1.080 -4.949 -0.758 1.00 . A A . 9 TRP N 1 1
11 1509 1 1 9 TRP NE1 N -5.652 -4.430 -3.659 1.00 . A A . 9 TRP NE1 1 1
11 1510 1 1 9 TRP O O -2.961 -4.952 1.958 1.00 . A A . 9 TRP O 1 1
11 1511 1 1 10 GLY C C -1.085 -7.872 3.020 1.00 . A A . 10 GLY C 1 1
11 1512 1 1 10 GLY CA C -2.485 -7.548 2.497 1.00 . A A . 10 GLY CA 1 1
11 1513 1 1 10 GLY H H -2.118 -7.444 0.376 1.00 . A A . 10 GLY H 1 1
11 1514 1 1 10 GLY HA2 H -2.979 -6.870 3.179 1.00 . A A . 10 GLY HA2 1 1
11 1515 1 1 10 GLY HA3 H -3.056 -8.461 2.418 1.00 . A A . 10 GLY HA3 1 1
11 1516 1 1 10 GLY N N -2.380 -6.910 1.154 1.00 . A A . 10 GLY N 1 1
11 1517 1 1 10 GLY O O -0.973 -8.771 3.837 1.00 . A A . 10 GLY O 1 1
11 1518 1 1 10 GLY OXT O -0.149 -7.214 2.596 1.00 . A A . 10 GLY OXT 1 1
12 1519 1 1 1 GLY C C -5.452 -0.950 2.341 1.00 . A A . 1 GLY C 1 1
12 1520 1 1 1 GLY CA C -6.783 -0.846 3.089 1.00 . A A . 1 GLY CA 1 1
12 1521 1 1 1 GLY H1 H -7.837 0.592 4.165 1.00 . A A . 1 GLY H1 1 1
12 1522 1 1 1 GLY H2 H -6.902 1.224 2.895 1.00 . A A . 1 GLY H2 1 1
12 1523 1 1 1 GLY H3 H -6.152 0.704 4.328 1.00 . A A . 1 GLY H3 1 1
12 1524 1 1 1 GLY HA2 H -6.807 -1.574 3.887 1.00 . A A . 1 GLY HA2 1 1
12 1525 1 1 1 GLY HA3 H -7.593 -1.036 2.402 1.00 . A A . 1 GLY HA3 1 1
12 1526 1 1 1 GLY N N -6.929 0.522 3.663 1.00 . A A . 1 GLY N 1 1
12 1527 1 1 1 GLY O O -4.549 -1.645 2.760 1.00 . A A . 1 GLY O 1 1
12 1528 1 1 2 TYR C C -3.071 0.719 1.008 1.00 . A A . 2 TYR C 1 1
12 1529 1 1 2 TYR CA C -4.048 -0.327 0.469 1.00 . A A . 2 TYR CA 1 1
12 1530 1 1 2 TYR CB C -4.325 -0.046 -1.009 1.00 . A A . 2 TYR CB 1 1
12 1531 1 1 2 TYR CD1 C -2.326 1.200 -1.903 1.00 . A A . 2 TYR CD1 1 1
12 1532 1 1 2 TYR CD2 C -2.503 -1.181 -2.330 1.00 . A A . 2 TYR CD2 1 1
12 1533 1 1 2 TYR CE1 C -1.115 1.235 -2.604 1.00 . A A . 2 TYR CE1 1 1
12 1534 1 1 2 TYR CE2 C -1.292 -1.146 -3.031 1.00 . A A . 2 TYR CE2 1 1
12 1535 1 1 2 TYR CG C -3.020 -0.008 -1.766 1.00 . A A . 2 TYR CG 1 1
12 1536 1 1 2 TYR CZ C -0.597 0.063 -3.168 1.00 . A A . 2 TYR CZ 1 1
12 1537 1 1 2 TYR H H -6.063 0.292 0.916 1.00 . A A . 2 TYR H 1 1
12 1538 1 1 2 TYR HA H -3.614 -1.311 0.572 1.00 . A A . 2 TYR HA 1 1
12 1539 1 1 2 TYR HB2 H -4.954 -0.827 -1.412 1.00 . A A . 2 TYR HB2 1 1
12 1540 1 1 2 TYR HB3 H -4.825 0.906 -1.107 1.00 . A A . 2 TYR HB3 1 1
12 1541 1 1 2 TYR HD1 H -2.724 2.104 -1.468 1.00 . A A . 2 TYR HD1 1 1
12 1542 1 1 2 TYR HD2 H -3.039 -2.113 -2.224 1.00 . A A . 2 TYR HD2 1 1
12 1543 1 1 2 TYR HE1 H -0.580 2.167 -2.710 1.00 . A A . 2 TYR HE1 1 1
12 1544 1 1 2 TYR HE2 H -0.892 -2.050 -3.466 1.00 . A A . 2 TYR HE2 1 1
12 1545 1 1 2 TYR HH H 0.755 1.007 -4.129 1.00 . A A . 2 TYR HH 1 1
12 1546 1 1 2 TYR N N -5.322 -0.263 1.239 1.00 . A A . 2 TYR N 1 1
12 1547 1 1 2 TYR O O -3.391 1.887 1.113 1.00 . A A . 2 TYR O 1 1
12 1548 1 1 2 TYR OH O 0.596 0.099 -3.859 1.00 . A A . 2 TYR OH 1 1
12 1549 1 1 3 ASP C C -0.079 1.870 0.709 1.00 . A A . 3 ASP C 1 1
12 1550 1 1 3 ASP CA C -0.878 1.278 1.878 1.00 . A A . 3 ASP CA 1 1
12 1551 1 1 3 ASP CB C 0.076 0.548 2.827 1.00 . A A . 3 ASP CB 1 1
12 1552 1 1 3 ASP CG C 0.879 1.570 3.632 1.00 . A A . 3 ASP CG 1 1
12 1553 1 1 3 ASP H H -1.642 -0.636 1.254 1.00 . A A . 3 ASP H 1 1
12 1554 1 1 3 ASP HA H -1.388 2.063 2.415 1.00 . A A . 3 ASP HA 1 1
12 1555 1 1 3 ASP HB2 H -0.495 -0.074 3.501 1.00 . A A . 3 ASP HB2 1 1
12 1556 1 1 3 ASP HB3 H 0.751 -0.068 2.254 1.00 . A A . 3 ASP HB3 1 1
12 1557 1 1 3 ASP N N -1.879 0.309 1.348 1.00 . A A . 3 ASP N 1 1
12 1558 1 1 3 ASP O O 0.655 1.162 0.050 1.00 . A A . 3 ASP O 1 1
12 1559 1 1 3 ASP OD1 O 0.659 2.755 3.437 1.00 . A A . 3 ASP OD1 1 1
12 1560 1 1 3 ASP OD2 O 1.703 1.152 4.429 1.00 . A A . 3 ASP OD2 1 1
12 1561 1 1 4 PRO C C 1.910 4.134 -0.211 1.00 . A A . 4 PRO C 1 1
12 1562 1 1 4 PRO CA C 0.458 3.854 -0.605 1.00 . A A . 4 PRO CA 1 1
12 1563 1 1 4 PRO CB C -0.331 5.158 -0.758 1.00 . A A . 4 PRO CB 1 1
12 1564 1 1 4 PRO CD C -1.134 4.014 1.285 1.00 . A A . 4 PRO CD 1 1
12 1565 1 1 4 PRO CG C -1.061 5.385 0.586 1.00 . A A . 4 PRO CG 1 1
12 1566 1 1 4 PRO HA H 0.413 3.286 -1.519 1.00 . A A . 4 PRO HA 1 1
12 1567 1 1 4 PRO HB2 H 0.345 5.976 -0.962 1.00 . A A . 4 PRO HB2 1 1
12 1568 1 1 4 PRO HB3 H -1.053 5.063 -1.554 1.00 . A A . 4 PRO HB3 1 1
12 1569 1 1 4 PRO HD2 H -0.776 4.090 2.302 1.00 . A A . 4 PRO HD2 1 1
12 1570 1 1 4 PRO HD3 H -2.142 3.630 1.263 1.00 . A A . 4 PRO HD3 1 1
12 1571 1 1 4 PRO HG2 H -0.506 6.086 1.194 1.00 . A A . 4 PRO HG2 1 1
12 1572 1 1 4 PRO HG3 H -2.059 5.756 0.408 1.00 . A A . 4 PRO HG3 1 1
12 1573 1 1 4 PRO N N -0.243 3.150 0.483 1.00 . A A . 4 PRO N 1 1
12 1574 1 1 4 PRO O O 2.717 4.542 -1.024 1.00 . A A . 4 PRO O 1 1
12 1575 1 1 5 GLU C C 4.525 2.970 1.085 1.00 . A A . 5 GLU C 1 1
12 1576 1 1 5 GLU CA C 3.652 4.165 1.470 1.00 . A A . 5 GLU CA 1 1
12 1577 1 1 5 GLU CB C 3.687 4.356 2.987 1.00 . A A . 5 GLU CB 1 1
12 1578 1 1 5 GLU CD C 3.987 6.828 2.797 1.00 . A A . 5 GLU CD 1 1
12 1579 1 1 5 GLU CG C 4.602 5.532 3.330 1.00 . A A . 5 GLU CG 1 1
12 1580 1 1 5 GLU H H 1.588 3.584 1.670 1.00 . A A . 5 GLU H 1 1
12 1581 1 1 5 GLU HA H 4.027 5.056 0.986 1.00 . A A . 5 GLU HA 1 1
12 1582 1 1 5 GLU HB2 H 2.689 4.556 3.349 1.00 . A A . 5 GLU HB2 1 1
12 1583 1 1 5 GLU HB3 H 4.066 3.459 3.453 1.00 . A A . 5 GLU HB3 1 1
12 1584 1 1 5 GLU HG2 H 4.716 5.600 4.402 1.00 . A A . 5 GLU HG2 1 1
12 1585 1 1 5 GLU HG3 H 5.568 5.381 2.874 1.00 . A A . 5 GLU HG3 1 1
12 1586 1 1 5 GLU N N 2.251 3.915 1.030 1.00 . A A . 5 GLU N 1 1
12 1587 1 1 5 GLU O O 5.506 3.106 0.382 1.00 . A A . 5 GLU O 1 1
12 1588 1 1 5 GLU OE1 O 2.771 6.913 2.763 1.00 . A A . 5 GLU OE1 1 1
12 1589 1 1 5 GLU OE2 O 4.744 7.711 2.430 1.00 . A A . 5 GLU OE2 1 1
12 1590 1 1 6 THR C C 4.524 0.034 -0.148 1.00 . A A . 6 THR C 1 1
12 1591 1 1 6 THR CA C 4.985 0.594 1.200 1.00 . A A . 6 THR CA 1 1
12 1592 1 1 6 THR CB C 4.798 -0.469 2.286 1.00 . A A . 6 THR CB 1 1
12 1593 1 1 6 THR CG2 C 5.388 -1.797 1.811 1.00 . A A . 6 THR CG2 1 1
12 1594 1 1 6 THR H H 3.379 1.710 2.106 1.00 . A A . 6 THR H 1 1
12 1595 1 1 6 THR HA H 6.027 0.867 1.140 1.00 . A A . 6 THR HA 1 1
12 1596 1 1 6 THR HB H 3.745 -0.598 2.487 1.00 . A A . 6 THR HB 1 1
12 1597 1 1 6 THR HG1 H 5.001 -0.441 4.221 1.00 . A A . 6 THR HG1 1 1
12 1598 1 1 6 THR HG21 H 4.587 -2.469 1.538 1.00 . A A . 6 THR HG21 1 1
12 1599 1 1 6 THR HG22 H 5.971 -2.237 2.606 1.00 . A A . 6 THR HG22 1 1
12 1600 1 1 6 THR HG23 H 6.021 -1.624 0.953 1.00 . A A . 6 THR HG23 1 1
12 1601 1 1 6 THR N N 4.175 1.798 1.541 1.00 . A A . 6 THR N 1 1
12 1602 1 1 6 THR O O 5.325 -0.296 -0.999 1.00 . A A . 6 THR O 1 1
12 1603 1 1 6 THR OG1 O 5.459 -0.052 3.473 1.00 . A A . 6 THR OG1 1 1
12 1604 1 1 7 GLY C C 2.414 -2.097 -1.492 1.00 . A A . 7 GLY C 1 1
12 1605 1 1 7 GLY CA C 2.731 -0.608 -1.643 1.00 . A A . 7 GLY CA 1 1
12 1606 1 1 7 GLY H H 2.609 0.202 0.349 1.00 . A A . 7 GLY H 1 1
12 1607 1 1 7 GLY HA2 H 1.833 -0.074 -1.926 1.00 . A A . 7 GLY HA2 1 1
12 1608 1 1 7 GLY HA3 H 3.482 -0.480 -2.407 1.00 . A A . 7 GLY HA3 1 1
12 1609 1 1 7 GLY N N 3.240 -0.071 -0.350 1.00 . A A . 7 GLY N 1 1
12 1610 1 1 7 GLY O O 3.107 -2.945 -2.015 1.00 . A A . 7 GLY O 1 1
12 1611 1 1 8 THR C C -0.485 -3.978 -0.329 1.00 . A A . 8 THR C 1 1
12 1612 1 1 8 THR CA C 1.006 -3.854 -0.598 1.00 . A A . 8 THR CA 1 1
12 1613 1 1 8 THR CB C 1.786 -4.439 0.581 1.00 . A A . 8 THR CB 1 1
12 1614 1 1 8 THR CG2 C 1.905 -5.955 0.416 1.00 . A A . 8 THR CG2 1 1
12 1615 1 1 8 THR H H 0.821 -1.720 -0.368 1.00 . A A . 8 THR H 1 1
12 1616 1 1 8 THR HA H 1.242 -4.403 -1.493 1.00 . A A . 8 THR HA 1 1
12 1617 1 1 8 THR HB H 1.262 -4.223 1.499 1.00 . A A . 8 THR HB 1 1
12 1618 1 1 8 THR HG1 H 3.520 -4.047 -0.210 1.00 . A A . 8 THR HG1 1 1
12 1619 1 1 8 THR HG21 H 2.542 -6.353 1.192 1.00 . A A . 8 THR HG21 1 1
12 1620 1 1 8 THR HG22 H 2.331 -6.180 -0.550 1.00 . A A . 8 THR HG22 1 1
12 1621 1 1 8 THR HG23 H 0.925 -6.403 0.490 1.00 . A A . 8 THR HG23 1 1
12 1622 1 1 8 THR N N 1.368 -2.421 -0.781 1.00 . A A . 8 THR N 1 1
12 1623 1 1 8 THR O O -1.115 -3.074 0.184 1.00 . A A . 8 THR O 1 1
12 1624 1 1 8 THR OG1 O 3.084 -3.860 0.624 1.00 . A A . 8 THR OG1 1 1
12 1625 1 1 9 TRP C C -2.739 -5.967 0.881 1.00 . A A . 9 TRP C 1 1
12 1626 1 1 9 TRP CA C -2.503 -5.275 -0.463 1.00 . A A . 9 TRP CA 1 1
12 1627 1 1 9 TRP CB C -3.079 -6.126 -1.594 1.00 . A A . 9 TRP CB 1 1
12 1628 1 1 9 TRP CD1 C -4.203 -5.366 -3.724 1.00 . A A . 9 TRP CD1 1 1
12 1629 1 1 9 TRP CD2 C -4.944 -4.273 -1.906 1.00 . A A . 9 TRP CD2 1 1
12 1630 1 1 9 TRP CE2 C -5.659 -3.752 -3.007 1.00 . A A . 9 TRP CE2 1 1
12 1631 1 1 9 TRP CE3 C -5.214 -3.756 -0.630 1.00 . A A . 9 TRP CE3 1 1
12 1632 1 1 9 TRP CG C -4.033 -5.298 -2.386 1.00 . A A . 9 TRP CG 1 1
12 1633 1 1 9 TRP CH2 C -6.874 -2.243 -1.568 1.00 . A A . 9 TRP CH2 1 1
12 1634 1 1 9 TRP CZ2 C -6.615 -2.748 -2.847 1.00 . A A . 9 TRP CZ2 1 1
12 1635 1 1 9 TRP CZ3 C -6.174 -2.746 -0.461 1.00 . A A . 9 TRP CZ3 1 1
12 1636 1 1 9 TRP H H -0.538 -5.798 -1.101 1.00 . A A . 9 TRP H 1 1
12 1637 1 1 9 TRP HA H -2.974 -4.310 -0.466 1.00 . A A . 9 TRP HA 1 1
12 1638 1 1 9 TRP HB2 H -2.277 -6.466 -2.234 1.00 . A A . 9 TRP HB2 1 1
12 1639 1 1 9 TRP HB3 H -3.597 -6.977 -1.178 1.00 . A A . 9 TRP HB3 1 1
12 1640 1 1 9 TRP HD1 H -3.672 -6.028 -4.391 1.00 . A A . 9 TRP HD1 1 1
12 1641 1 1 9 TRP HE1 H -5.488 -4.300 -5.012 1.00 . A A . 9 TRP HE1 1 1
12 1642 1 1 9 TRP HE3 H -4.672 -4.139 0.227 1.00 . A A . 9 TRP HE3 1 1
12 1643 1 1 9 TRP HH2 H -7.611 -1.466 -1.434 1.00 . A A . 9 TRP HH2 1 1
12 1644 1 1 9 TRP HZ2 H -7.151 -2.365 -3.702 1.00 . A A . 9 TRP HZ2 1 1
12 1645 1 1 9 TRP HZ3 H -6.375 -2.355 0.525 1.00 . A A . 9 TRP HZ3 1 1
12 1646 1 1 9 TRP N N -1.057 -5.090 -0.683 1.00 . A A . 9 TRP N 1 1
12 1647 1 1 9 TRP NE1 N -5.173 -4.450 -4.096 1.00 . A A . 9 TRP NE1 1 1
12 1648 1 1 9 TRP O O -3.343 -7.019 0.952 1.00 . A A . 9 TRP O 1 1
12 1649 1 1 10 GLY C C -3.898 -6.511 3.416 1.00 . A A . 10 GLY C 1 1
12 1650 1 1 10 GLY CA C -2.459 -6.008 3.288 1.00 . A A . 10 GLY CA 1 1
12 1651 1 1 10 GLY H H -1.780 -4.536 1.868 1.00 . A A . 10 GLY H 1 1
12 1652 1 1 10 GLY HA2 H -1.775 -6.835 3.402 1.00 . A A . 10 GLY HA2 1 1
12 1653 1 1 10 GLY HA3 H -2.271 -5.274 4.058 1.00 . A A . 10 GLY HA3 1 1
12 1654 1 1 10 GLY N N -2.265 -5.384 1.949 1.00 . A A . 10 GLY N 1 1
12 1655 1 1 10 GLY O O -4.802 -5.739 3.141 1.00 . A A . 10 GLY O 1 1
12 1656 1 1 10 GLY OXT O -4.071 -7.661 3.785 1.00 . A A . 10 GLY OXT 1 1
13 1657 1 1 1 GLY C C -5.507 -0.983 2.272 1.00 . A A . 1 GLY C 1 1
13 1658 1 1 1 GLY CA C -6.770 -0.896 3.130 1.00 . A A . 1 GLY CA 1 1
13 1659 1 1 1 GLY H1 H -5.360 -0.514 4.614 1.00 . A A . 1 GLY H1 1 1
13 1660 1 1 1 GLY H2 H -6.734 -1.350 5.161 1.00 . A A . 1 GLY H2 1 1
13 1661 1 1 1 GLY H3 H -6.826 0.312 4.825 1.00 . A A . 1 GLY H3 1 1
13 1662 1 1 1 GLY HA2 H -7.296 -1.839 3.096 1.00 . A A . 1 GLY HA2 1 1
13 1663 1 1 1 GLY HA3 H -7.407 -0.114 2.748 1.00 . A A . 1 GLY HA3 1 1
13 1664 1 1 1 GLY N N -6.394 -0.589 4.539 1.00 . A A . 1 GLY N 1 1
13 1665 1 1 1 GLY O O -4.714 -1.893 2.409 1.00 . A A . 1 GLY O 1 1
13 1666 1 1 2 TYR C C -3.112 0.998 0.987 1.00 . A A . 2 TYR C 1 1
13 1667 1 1 2 TYR CA C -4.100 -0.075 0.523 1.00 . A A . 2 TYR CA 1 1
13 1668 1 1 2 TYR CB C -4.501 0.195 -0.928 1.00 . A A . 2 TYR CB 1 1
13 1669 1 1 2 TYR CD1 C -2.344 1.025 -1.930 1.00 . A A . 2 TYR CD1 1 1
13 1670 1 1 2 TYR CD2 C -3.147 -1.177 -2.554 1.00 . A A . 2 TYR CD2 1 1
13 1671 1 1 2 TYR CE1 C -1.231 0.855 -2.764 1.00 . A A . 2 TYR CE1 1 1
13 1672 1 1 2 TYR CE2 C -2.034 -1.346 -3.387 1.00 . A A . 2 TYR CE2 1 1
13 1673 1 1 2 TYR CG C -3.301 0.010 -1.826 1.00 . A A . 2 TYR CG 1 1
13 1674 1 1 2 TYR CZ C -1.076 -0.330 -3.492 1.00 . A A . 2 TYR CZ 1 1
13 1675 1 1 2 TYR H H -5.964 0.684 1.293 1.00 . A A . 2 TYR H 1 1
13 1676 1 1 2 TYR HA H -3.634 -1.047 0.593 1.00 . A A . 2 TYR HA 1 1
13 1677 1 1 2 TYR HB2 H -5.280 -0.494 -1.220 1.00 . A A . 2 TYR HB2 1 1
13 1678 1 1 2 TYR HB3 H -4.864 1.208 -1.018 1.00 . A A . 2 TYR HB3 1 1
13 1679 1 1 2 TYR HD1 H -2.463 1.940 -1.368 1.00 . A A . 2 TYR HD1 1 1
13 1680 1 1 2 TYR HD2 H -3.885 -1.962 -2.474 1.00 . A A . 2 TYR HD2 1 1
13 1681 1 1 2 TYR HE1 H -0.493 1.639 -2.844 1.00 . A A . 2 TYR HE1 1 1
13 1682 1 1 2 TYR HE2 H -1.915 -2.261 -3.949 1.00 . A A . 2 TYR HE2 1 1
13 1683 1 1 2 TYR HH H -0.186 -0.107 -5.165 1.00 . A A . 2 TYR HH 1 1
13 1684 1 1 2 TYR N N -5.313 -0.043 1.388 1.00 . A A . 2 TYR N 1 1
13 1685 1 1 2 TYR O O -3.354 2.181 0.847 1.00 . A A . 2 TYR O 1 1
13 1686 1 1 2 TYR OH O 0.020 -0.497 -4.313 1.00 . A A . 2 TYR OH 1 1
13 1687 1 1 3 ASP C C 0.045 1.819 0.901 1.00 . A A . 3 ASP C 1 1
13 1688 1 1 3 ASP CA C -0.994 1.588 2.006 1.00 . A A . 3 ASP CA 1 1
13 1689 1 1 3 ASP CB C -0.292 1.047 3.253 1.00 . A A . 3 ASP CB 1 1
13 1690 1 1 3 ASP CG C -0.073 2.186 4.251 1.00 . A A . 3 ASP CG 1 1
13 1691 1 1 3 ASP H H -1.823 -0.364 1.637 1.00 . A A . 3 ASP H 1 1
13 1692 1 1 3 ASP HA H -1.492 2.514 2.247 1.00 . A A . 3 ASP HA 1 1
13 1693 1 1 3 ASP HB2 H -0.905 0.282 3.708 1.00 . A A . 3 ASP HB2 1 1
13 1694 1 1 3 ASP HB3 H 0.663 0.627 2.975 1.00 . A A . 3 ASP HB3 1 1
13 1695 1 1 3 ASP N N -1.999 0.594 1.536 1.00 . A A . 3 ASP N 1 1
13 1696 1 1 3 ASP O O 0.737 0.901 0.510 1.00 . A A . 3 ASP O 1 1
13 1697 1 1 3 ASP OD1 O 0.675 3.094 3.930 1.00 . A A . 3 ASP OD1 1 1
13 1698 1 1 3 ASP OD2 O -0.658 2.130 5.321 1.00 . A A . 3 ASP OD2 1 1
13 1699 1 1 4 PRO C C 2.489 3.574 -0.053 1.00 . A A . 4 PRO C 1 1
13 1700 1 1 4 PRO CA C 1.081 3.408 -0.635 1.00 . A A . 4 PRO CA 1 1
13 1701 1 1 4 PRO CB C 0.542 4.743 -1.155 1.00 . A A . 4 PRO CB 1 1
13 1702 1 1 4 PRO CD C -0.713 4.158 0.898 1.00 . A A . 4 PRO CD 1 1
13 1703 1 1 4 PRO CG C -0.326 5.334 -0.019 1.00 . A A . 4 PRO CG 1 1
13 1704 1 1 4 PRO HA H 1.076 2.674 -1.424 1.00 . A A . 4 PRO HA 1 1
13 1705 1 1 4 PRO HB2 H 1.363 5.408 -1.386 1.00 . A A . 4 PRO HB2 1 1
13 1706 1 1 4 PRO HB3 H -0.066 4.583 -2.032 1.00 . A A . 4 PRO HB3 1 1
13 1707 1 1 4 PRO HD2 H -0.490 4.394 1.929 1.00 . A A . 4 PRO HD2 1 1
13 1708 1 1 4 PRO HD3 H -1.757 3.913 0.781 1.00 . A A . 4 PRO HD3 1 1
13 1709 1 1 4 PRO HG2 H 0.243 6.069 0.535 1.00 . A A . 4 PRO HG2 1 1
13 1710 1 1 4 PRO HG3 H -1.217 5.786 -0.429 1.00 . A A . 4 PRO HG3 1 1
13 1711 1 1 4 PRO N N 0.128 3.039 0.427 1.00 . A A . 4 PRO N 1 1
13 1712 1 1 4 PRO O O 3.475 3.463 -0.753 1.00 . A A . 4 PRO O 1 1
13 1713 1 1 5 GLU C C 4.799 2.787 1.525 1.00 . A A . 5 GLU C 1 1
13 1714 1 1 5 GLU CA C 3.932 4.006 1.845 1.00 . A A . 5 GLU CA 1 1
13 1715 1 1 5 GLU CB C 3.779 4.137 3.362 1.00 . A A . 5 GLU CB 1 1
13 1716 1 1 5 GLU CD C 4.544 6.508 3.550 1.00 . A A . 5 GLU CD 1 1
13 1717 1 1 5 GLU CG C 3.352 5.564 3.713 1.00 . A A . 5 GLU CG 1 1
13 1718 1 1 5 GLU H H 1.779 3.920 1.769 1.00 . A A . 5 GLU H 1 1
13 1719 1 1 5 GLU HA H 4.401 4.895 1.452 1.00 . A A . 5 GLU HA 1 1
13 1720 1 1 5 GLU HB2 H 3.029 3.440 3.709 1.00 . A A . 5 GLU HB2 1 1
13 1721 1 1 5 GLU HB3 H 4.722 3.918 3.839 1.00 . A A . 5 GLU HB3 1 1
13 1722 1 1 5 GLU HG2 H 2.553 5.873 3.054 1.00 . A A . 5 GLU HG2 1 1
13 1723 1 1 5 GLU HG3 H 3.007 5.596 4.735 1.00 . A A . 5 GLU HG3 1 1
13 1724 1 1 5 GLU N N 2.588 3.837 1.222 1.00 . A A . 5 GLU N 1 1
13 1725 1 1 5 GLU O O 6.011 2.841 1.587 1.00 . A A . 5 GLU O 1 1
13 1726 1 1 5 GLU OE1 O 5.649 6.015 3.394 1.00 . A A . 5 GLU OE1 1 1
13 1727 1 1 5 GLU OE2 O 4.333 7.709 3.584 1.00 . A A . 5 GLU OE2 1 1
13 1728 1 1 6 THR C C 4.509 -0.092 -0.488 1.00 . A A . 6 THR C 1 1
13 1729 1 1 6 THR CA C 4.973 0.465 0.860 1.00 . A A . 6 THR CA 1 1
13 1730 1 1 6 THR CB C 4.756 -0.587 1.951 1.00 . A A . 6 THR CB 1 1
13 1731 1 1 6 THR CG2 C 4.608 0.105 3.308 1.00 . A A . 6 THR CG2 1 1
13 1732 1 1 6 THR H H 3.207 1.665 1.140 1.00 . A A . 6 THR H 1 1
13 1733 1 1 6 THR HA H 6.023 0.716 0.804 1.00 . A A . 6 THR HA 1 1
13 1734 1 1 6 THR HB H 5.604 -1.254 1.983 1.00 . A A . 6 THR HB 1 1
13 1735 1 1 6 THR HG1 H 3.380 -1.874 2.430 1.00 . A A . 6 THR HG1 1 1
13 1736 1 1 6 THR HG21 H 5.021 -0.527 4.081 1.00 . A A . 6 THR HG21 1 1
13 1737 1 1 6 THR HG22 H 3.562 0.282 3.509 1.00 . A A . 6 THR HG22 1 1
13 1738 1 1 6 THR HG23 H 5.137 1.046 3.291 1.00 . A A . 6 THR HG23 1 1
13 1739 1 1 6 THR N N 4.186 1.686 1.184 1.00 . A A . 6 THR N 1 1
13 1740 1 1 6 THR O O 5.307 -0.409 -1.348 1.00 . A A . 6 THR O 1 1
13 1741 1 1 6 THR OG1 O 3.579 -1.330 1.665 1.00 . A A . 6 THR OG1 1 1
13 1742 1 1 7 GLY C C 2.335 -2.212 -1.816 1.00 . A A . 7 GLY C 1 1
13 1743 1 1 7 GLY CA C 2.706 -0.737 -1.973 1.00 . A A . 7 GLY CA 1 1
13 1744 1 1 7 GLY H H 2.598 0.059 0.026 1.00 . A A . 7 GLY H 1 1
13 1745 1 1 7 GLY HA2 H 1.830 -0.175 -2.266 1.00 . A A . 7 GLY HA2 1 1
13 1746 1 1 7 GLY HA3 H 3.467 -0.640 -2.731 1.00 . A A . 7 GLY HA3 1 1
13 1747 1 1 7 GLY N N 3.223 -0.207 -0.680 1.00 . A A . 7 GLY N 1 1
13 1748 1 1 7 GLY O O 2.930 -3.079 -2.425 1.00 . A A . 7 GLY O 1 1
13 1749 1 1 8 THR C C -0.543 -4.009 -0.531 1.00 . A A . 8 THR C 1 1
13 1750 1 1 8 THR CA C 0.948 -3.930 -0.824 1.00 . A A . 8 THR CA 1 1
13 1751 1 1 8 THR CB C 1.731 -4.549 0.335 1.00 . A A . 8 THR CB 1 1
13 1752 1 1 8 THR CG2 C 1.885 -6.051 0.095 1.00 . A A . 8 THR CG2 1 1
13 1753 1 1 8 THR H H 0.882 -1.797 -0.527 1.00 . A A . 8 THR H 1 1
13 1754 1 1 8 THR HA H 1.150 -4.480 -1.726 1.00 . A A . 8 THR HA 1 1
13 1755 1 1 8 THR HB H 1.196 -4.389 1.258 1.00 . A A . 8 THR HB 1 1
13 1756 1 1 8 THR HG1 H 3.614 -4.573 0.818 1.00 . A A . 8 THR HG1 1 1
13 1757 1 1 8 THR HG21 H 1.930 -6.242 -0.967 1.00 . A A . 8 THR HG21 1 1
13 1758 1 1 8 THR HG22 H 1.037 -6.572 0.517 1.00 . A A . 8 THR HG22 1 1
13 1759 1 1 8 THR HG23 H 2.793 -6.400 0.563 1.00 . A A . 8 THR HG23 1 1
13 1760 1 1 8 THR N N 1.353 -2.508 -1.008 1.00 . A A . 8 THR N 1 1
13 1761 1 1 8 THR O O -1.133 -3.100 0.017 1.00 . A A . 8 THR O 1 1
13 1762 1 1 8 THR OG1 O 3.013 -3.943 0.416 1.00 . A A . 8 THR OG1 1 1
13 1763 1 1 9 TRP C C -2.853 -5.906 0.677 1.00 . A A . 9 TRP C 1 1
13 1764 1 1 9 TRP CA C -2.608 -5.234 -0.676 1.00 . A A . 9 TRP CA 1 1
13 1765 1 1 9 TRP CB C -3.216 -6.081 -1.793 1.00 . A A . 9 TRP CB 1 1
13 1766 1 1 9 TRP CD1 C -4.353 -5.310 -3.910 1.00 . A A . 9 TRP CD1 1 1
13 1767 1 1 9 TRP CD2 C -5.048 -4.198 -2.088 1.00 . A A . 9 TRP CD2 1 1
13 1768 1 1 9 TRP CE2 C -5.769 -3.666 -3.180 1.00 . A A . 9 TRP CE2 1 1
13 1769 1 1 9 TRP CE3 C -5.291 -3.673 -0.809 1.00 . A A . 9 TRP CE3 1 1
13 1770 1 1 9 TRP CG C -4.164 -5.240 -2.575 1.00 . A A . 9 TRP CG 1 1
13 1771 1 1 9 TRP CH2 C -6.934 -2.131 -1.728 1.00 . A A . 9 TRP CH2 1 1
13 1772 1 1 9 TRP CZ2 C -6.703 -2.644 -3.009 1.00 . A A . 9 TRP CZ2 1 1
13 1773 1 1 9 TRP CZ3 C -6.228 -2.644 -0.629 1.00 . A A . 9 TRP CZ3 1 1
13 1774 1 1 9 TRP H H -0.670 -5.803 -1.360 1.00 . A A . 9 TRP H 1 1
13 1775 1 1 9 TRP HA H -3.054 -4.258 -0.684 1.00 . A A . 9 TRP HA 1 1
13 1776 1 1 9 TRP HB2 H -2.431 -6.443 -2.442 1.00 . A A . 9 TRP HB2 1 1
13 1777 1 1 9 TRP HB3 H -3.746 -6.919 -1.365 1.00 . A A . 9 TRP HB3 1 1
13 1778 1 1 9 TRP HD1 H -3.842 -5.983 -4.581 1.00 . A A . 9 TRP HD1 1 1
13 1779 1 1 9 TRP HE1 H -5.635 -4.225 -5.184 1.00 . A A . 9 TRP HE1 1 1
13 1780 1 1 9 TRP HE3 H -4.744 -4.065 0.041 1.00 . A A . 9 TRP HE3 1 1
13 1781 1 1 9 TRP HH2 H -7.655 -1.339 -1.585 1.00 . A A . 9 TRP HH2 1 1
13 1782 1 1 9 TRP HZ2 H -7.243 -2.254 -3.858 1.00 . A A . 9 TRP HZ2 1 1
13 1783 1 1 9 TRP HZ3 H -6.409 -2.247 0.359 1.00 . A A . 9 TRP HZ3 1 1
13 1784 1 1 9 TRP N N -1.160 -5.091 -0.911 1.00 . A A . 9 TRP N 1 1
13 1785 1 1 9 TRP NE1 N -5.310 -4.377 -4.273 1.00 . A A . 9 TRP NE1 1 1
13 1786 1 1 9 TRP O O -3.696 -6.773 0.808 1.00 . A A . 9 TRP O 1 1
13 1787 1 1 10 GLY C C -1.587 -5.301 4.085 1.00 . A A . 10 GLY C 1 1
13 1788 1 1 10 GLY CA C -2.319 -6.131 3.030 1.00 . A A . 10 GLY CA 1 1
13 1789 1 1 10 GLY H H -1.452 -4.814 1.562 1.00 . A A . 10 GLY H 1 1
13 1790 1 1 10 GLY HA2 H -3.374 -6.163 3.262 1.00 . A A . 10 GLY HA2 1 1
13 1791 1 1 10 GLY HA3 H -1.921 -7.135 3.026 1.00 . A A . 10 GLY HA3 1 1
13 1792 1 1 10 GLY N N -2.125 -5.514 1.687 1.00 . A A . 10 GLY N 1 1
13 1793 1 1 10 GLY O O -1.753 -4.091 4.078 1.00 . A A . 10 GLY O 1 1
13 1794 1 1 10 GLY OXT O -0.873 -5.886 4.882 1.00 . A A . 10 GLY OXT 1 1
14 1795 1 1 1 GLY C C -4.978 -1.543 2.514 1.00 . A A . 1 GLY C 1 1
14 1796 1 1 1 GLY CA C -6.222 -1.602 3.402 1.00 . A A . 1 GLY CA 1 1
14 1797 1 1 1 GLY H1 H -6.237 0.479 3.348 1.00 . A A . 1 GLY H1 1 1
14 1798 1 1 1 GLY H2 H -7.552 -0.203 4.180 1.00 . A A . 1 GLY H2 1 1
14 1799 1 1 1 GLY H3 H -7.503 -0.243 2.482 1.00 . A A . 1 GLY H3 1 1
14 1800 1 1 1 GLY HA2 H -5.930 -1.812 4.421 1.00 . A A . 1 GLY HA2 1 1
14 1801 1 1 1 GLY HA3 H -6.876 -2.383 3.045 1.00 . A A . 1 GLY HA3 1 1
14 1802 1 1 1 GLY N N -6.933 -0.293 3.349 1.00 . A A . 1 GLY N 1 1
14 1803 1 1 1 GLY O O -4.050 -2.312 2.677 1.00 . A A . 1 GLY O 1 1
14 1804 1 1 2 TYR C C -2.863 0.608 1.159 1.00 . A A . 2 TYR C 1 1
14 1805 1 1 2 TYR CA C -3.764 -0.531 0.680 1.00 . A A . 2 TYR CA 1 1
14 1806 1 1 2 TYR CB C -4.229 -0.245 -0.750 1.00 . A A . 2 TYR CB 1 1
14 1807 1 1 2 TYR CD1 C -2.219 0.909 -1.738 1.00 . A A . 2 TYR CD1 1 1
14 1808 1 1 2 TYR CD2 C -2.744 -1.344 -2.468 1.00 . A A . 2 TYR CD2 1 1
14 1809 1 1 2 TYR CE1 C -1.112 0.929 -2.594 1.00 . A A . 2 TYR CE1 1 1
14 1810 1 1 2 TYR CE2 C -1.637 -1.323 -3.325 1.00 . A A . 2 TYR CE2 1 1
14 1811 1 1 2 TYR CG C -3.035 -0.227 -1.674 1.00 . A A . 2 TYR CG 1 1
14 1812 1 1 2 TYR CZ C -0.821 -0.187 -3.388 1.00 . A A . 2 TYR CZ 1 1
14 1813 1 1 2 TYR H H -5.708 -0.027 1.462 1.00 . A A . 2 TYR H 1 1
14 1814 1 1 2 TYR HA H -3.213 -1.459 0.700 1.00 . A A . 2 TYR HA 1 1
14 1815 1 1 2 TYR HB2 H -4.916 -1.014 -1.065 1.00 . A A . 2 TYR HB2 1 1
14 1816 1 1 2 TYR HB3 H -4.722 0.715 -0.782 1.00 . A A . 2 TYR HB3 1 1
14 1817 1 1 2 TYR HD1 H -2.443 1.769 -1.125 1.00 . A A . 2 TYR HD1 1 1
14 1818 1 1 2 TYR HD2 H -3.374 -2.221 -2.420 1.00 . A A . 2 TYR HD2 1 1
14 1819 1 1 2 TYR HE1 H -0.482 1.806 -2.644 1.00 . A A . 2 TYR HE1 1 1
14 1820 1 1 2 TYR HE2 H -1.413 -2.184 -3.937 1.00 . A A . 2 TYR HE2 1 1
14 1821 1 1 2 TYR HH H 0.882 -0.850 -3.944 1.00 . A A . 2 TYR HH 1 1
14 1822 1 1 2 TYR N N -4.949 -0.638 1.577 1.00 . A A . 2 TYR N 1 1
14 1823 1 1 2 TYR O O -3.263 1.754 1.201 1.00 . A A . 2 TYR O 1 1
14 1824 1 1 2 TYR OH O 0.270 -0.168 -4.233 1.00 . A A . 2 TYR OH 1 1
14 1825 1 1 3 ASP C C 0.097 1.894 0.801 1.00 . A A . 3 ASP C 1 1
14 1826 1 1 3 ASP CA C -0.721 1.368 1.989 1.00 . A A . 3 ASP CA 1 1
14 1827 1 1 3 ASP CB C 0.229 0.786 3.040 1.00 . A A . 3 ASP CB 1 1
14 1828 1 1 3 ASP CG C 0.400 1.787 4.184 1.00 . A A . 3 ASP CG 1 1
14 1829 1 1 3 ASP H H -1.341 -0.627 1.474 1.00 . A A . 3 ASP H 1 1
14 1830 1 1 3 ASP HA H -1.293 2.169 2.429 1.00 . A A . 3 ASP HA 1 1
14 1831 1 1 3 ASP HB2 H -0.183 -0.136 3.425 1.00 . A A . 3 ASP HB2 1 1
14 1832 1 1 3 ASP HB3 H 1.189 0.591 2.588 1.00 . A A . 3 ASP HB3 1 1
14 1833 1 1 3 ASP N N -1.646 0.303 1.517 1.00 . A A . 3 ASP N 1 1
14 1834 1 1 3 ASP O O 0.844 1.151 0.196 1.00 . A A . 3 ASP O 1 1
14 1835 1 1 3 ASP OD1 O 1.292 2.614 4.092 1.00 . A A . 3 ASP OD1 1 1
14 1836 1 1 3 ASP OD2 O -0.364 1.709 5.132 1.00 . A A . 3 ASP OD2 1 1
14 1837 1 1 4 PRO C C 2.105 4.087 -0.216 1.00 . A A . 4 PRO C 1 1
14 1838 1 1 4 PRO CA C 0.653 3.804 -0.614 1.00 . A A . 4 PRO CA 1 1
14 1839 1 1 4 PRO CB C -0.119 5.106 -0.838 1.00 . A A . 4 PRO CB 1 1
14 1840 1 1 4 PRO CD C -0.971 4.065 1.237 1.00 . A A . 4 PRO CD 1 1
14 1841 1 1 4 PRO CG C -0.863 5.404 0.484 1.00 . A A . 4 PRO CG 1 1
14 1842 1 1 4 PRO HA H 0.613 3.192 -1.500 1.00 . A A . 4 PRO HA 1 1
14 1843 1 1 4 PRO HB2 H 0.568 5.908 -1.072 1.00 . A A . 4 PRO HB2 1 1
14 1844 1 1 4 PRO HB3 H -0.834 4.982 -1.637 1.00 . A A . 4 PRO HB3 1 1
14 1845 1 1 4 PRO HD2 H -0.644 4.181 2.262 1.00 . A A . 4 PRO HD2 1 1
14 1846 1 1 4 PRO HD3 H -1.982 3.691 1.200 1.00 . A A . 4 PRO HD3 1 1
14 1847 1 1 4 PRO HG2 H -0.301 6.118 1.070 1.00 . A A . 4 PRO HG2 1 1
14 1848 1 1 4 PRO HG3 H -1.850 5.787 0.278 1.00 . A A . 4 PRO HG3 1 1
14 1849 1 1 4 PRO N N -0.065 3.160 0.500 1.00 . A A . 4 PRO N 1 1
14 1850 1 1 4 PRO O O 2.973 4.229 -1.053 1.00 . A A . 4 PRO O 1 1
14 1851 1 1 5 GLU C C 4.651 3.240 1.146 1.00 . A A . 5 GLU C 1 1
14 1852 1 1 5 GLU CA C 3.766 4.433 1.512 1.00 . A A . 5 GLU CA 1 1
14 1853 1 1 5 GLU CB C 3.776 4.632 3.029 1.00 . A A . 5 GLU CB 1 1
14 1854 1 1 5 GLU CD C 5.576 6.315 3.441 1.00 . A A . 5 GLU CD 1 1
14 1855 1 1 5 GLU CG C 4.064 6.100 3.350 1.00 . A A . 5 GLU CG 1 1
14 1856 1 1 5 GLU H H 1.658 4.043 1.718 1.00 . A A . 5 GLU H 1 1
14 1857 1 1 5 GLU HA H 4.140 5.323 1.028 1.00 . A A . 5 GLU HA 1 1
14 1858 1 1 5 GLU HB2 H 2.813 4.356 3.436 1.00 . A A . 5 GLU HB2 1 1
14 1859 1 1 5 GLU HB3 H 4.544 4.012 3.470 1.00 . A A . 5 GLU HB3 1 1
14 1860 1 1 5 GLU HG2 H 3.657 6.724 2.567 1.00 . A A . 5 GLU HG2 1 1
14 1861 1 1 5 GLU HG3 H 3.608 6.359 4.293 1.00 . A A . 5 GLU HG3 1 1
14 1862 1 1 5 GLU N N 2.372 4.164 1.058 1.00 . A A . 5 GLU N 1 1
14 1863 1 1 5 GLU O O 5.753 3.398 0.661 1.00 . A A . 5 GLU O 1 1
14 1864 1 1 5 GLU OE1 O 6.168 5.827 4.388 1.00 . A A . 5 GLU OE1 1 1
14 1865 1 1 5 GLU OE2 O 6.115 6.965 2.560 1.00 . A A . 5 GLU OE2 1 1
14 1866 1 1 6 THR C C 4.459 0.233 -0.267 1.00 . A A . 6 THR C 1 1
14 1867 1 1 6 THR CA C 4.982 0.842 1.035 1.00 . A A . 6 THR CA 1 1
14 1868 1 1 6 THR CB C 4.863 -0.185 2.164 1.00 . A A . 6 THR CB 1 1
14 1869 1 1 6 THR CG2 C 5.447 -1.522 1.706 1.00 . A A . 6 THR CG2 1 1
14 1870 1 1 6 THR H H 3.280 1.943 1.763 1.00 . A A . 6 THR H 1 1
14 1871 1 1 6 THR HA H 6.017 1.124 0.912 1.00 . A A . 6 THR HA 1 1
14 1872 1 1 6 THR HB H 3.822 -0.321 2.419 1.00 . A A . 6 THR HB 1 1
14 1873 1 1 6 THR HG1 H 6.507 0.116 3.158 1.00 . A A . 6 THR HG1 1 1
14 1874 1 1 6 THR HG21 H 6.268 -1.797 2.351 1.00 . A A . 6 THR HG21 1 1
14 1875 1 1 6 THR HG22 H 5.802 -1.430 0.690 1.00 . A A . 6 THR HG22 1 1
14 1876 1 1 6 THR HG23 H 4.682 -2.284 1.752 1.00 . A A . 6 THR HG23 1 1
14 1877 1 1 6 THR N N 4.174 2.047 1.372 1.00 . A A . 6 THR N 1 1
14 1878 1 1 6 THR O O 5.183 0.092 -1.233 1.00 . A A . 6 THR O 1 1
14 1879 1 1 6 THR OG1 O 5.573 0.280 3.304 1.00 . A A . 6 THR OG1 1 1
14 1880 1 1 7 GLY C C 2.204 -2.168 -1.270 1.00 . A A . 7 GLY C 1 1
14 1881 1 1 7 GLY CA C 2.634 -0.725 -1.543 1.00 . A A . 7 GLY CA 1 1
14 1882 1 1 7 GLY H H 2.638 -0.004 0.488 1.00 . A A . 7 GLY H 1 1
14 1883 1 1 7 GLY HA2 H 1.778 -0.145 -1.858 1.00 . A A . 7 GLY HA2 1 1
14 1884 1 1 7 GLY HA3 H 3.381 -0.717 -2.322 1.00 . A A . 7 GLY HA3 1 1
14 1885 1 1 7 GLY N N 3.205 -0.128 -0.302 1.00 . A A . 7 GLY N 1 1
14 1886 1 1 7 GLY O O 2.900 -3.106 -1.604 1.00 . A A . 7 GLY O 1 1
14 1887 1 1 8 THR C C -0.931 -3.766 -0.308 1.00 . A A . 8 THR C 1 1
14 1888 1 1 8 THR CA C 0.588 -3.741 -0.385 1.00 . A A . 8 THR CA 1 1
14 1889 1 1 8 THR CB C 1.175 -4.227 0.941 1.00 . A A . 8 THR CB 1 1
14 1890 1 1 8 THR CG2 C 1.333 -5.749 0.903 1.00 . A A . 8 THR CG2 1 1
14 1891 1 1 8 THR H H 0.509 -1.587 -0.411 1.00 . A A . 8 THR H 1 1
14 1892 1 1 8 THR HA H 0.900 -4.398 -1.178 1.00 . A A . 8 THR HA 1 1
14 1893 1 1 8 THR HB H 0.512 -3.960 1.748 1.00 . A A . 8 THR HB 1 1
14 1894 1 1 8 THR HG1 H 2.647 -3.672 2.085 1.00 . A A . 8 THR HG1 1 1
14 1895 1 1 8 THR HG21 H 0.645 -6.164 0.182 1.00 . A A . 8 THR HG21 1 1
14 1896 1 1 8 THR HG22 H 1.121 -6.157 1.880 1.00 . A A . 8 THR HG22 1 1
14 1897 1 1 8 THR HG23 H 2.345 -5.999 0.620 1.00 . A A . 8 THR HG23 1 1
14 1898 1 1 8 THR N N 1.058 -2.355 -0.671 1.00 . A A . 8 THR N 1 1
14 1899 1 1 8 THR O O -1.568 -2.801 0.067 1.00 . A A . 8 THR O 1 1
14 1900 1 1 8 THR OG1 O 2.443 -3.621 1.148 1.00 . A A . 8 THR OG1 1 1
14 1901 1 1 9 TRP C C -3.444 -5.469 0.729 1.00 . A A . 9 TRP C 1 1
14 1902 1 1 9 TRP CA C -2.984 -4.979 -0.647 1.00 . A A . 9 TRP CA 1 1
14 1903 1 1 9 TRP CB C -3.425 -5.969 -1.723 1.00 . A A . 9 TRP CB 1 1
14 1904 1 1 9 TRP CD1 C -4.346 -5.493 -4.022 1.00 . A A . 9 TRP CD1 1 1
14 1905 1 1 9 TRP CD2 C -5.268 -4.214 -2.425 1.00 . A A . 9 TRP CD2 1 1
14 1906 1 1 9 TRP CE2 C -5.884 -3.841 -3.641 1.00 . A A . 9 TRP CE2 1 1
14 1907 1 1 9 TRP CE3 C -5.660 -3.560 -1.249 1.00 . A A . 9 TRP CE3 1 1
14 1908 1 1 9 TRP CG C -4.306 -5.264 -2.692 1.00 . A A . 9 TRP CG 1 1
14 1909 1 1 9 TRP CH2 C -7.248 -2.206 -2.506 1.00 . A A . 9 TRP CH2 1 1
14 1910 1 1 9 TRP CZ2 C -6.864 -2.850 -3.687 1.00 . A A . 9 TRP CZ2 1 1
14 1911 1 1 9 TRP CZ3 C -6.645 -2.559 -1.288 1.00 . A A . 9 TRP CZ3 1 1
14 1912 1 1 9 TRP H H -0.980 -5.624 -0.982 1.00 . A A . 9 TRP H 1 1
14 1913 1 1 9 TRP HA H -3.410 -4.012 -0.852 1.00 . A A . 9 TRP HA 1 1
14 1914 1 1 9 TRP HB2 H -2.556 -6.355 -2.236 1.00 . A A . 9 TRP HB2 1 1
14 1915 1 1 9 TRP HB3 H -3.968 -6.783 -1.266 1.00 . A A . 9 TRP HB3 1 1
14 1916 1 1 9 TRP HD1 H -3.743 -6.215 -4.550 1.00 . A A . 9 TRP HD1 1 1
14 1917 1 1 9 TRP HE1 H -5.518 -4.619 -5.541 1.00 . A A . 9 TRP HE1 1 1
14 1918 1 1 9 TRP HE3 H -5.191 -3.829 -0.310 1.00 . A A . 9 TRP HE3 1 1
14 1919 1 1 9 TRP HH2 H -8.004 -1.435 -2.531 1.00 . A A . 9 TRP HH2 1 1
14 1920 1 1 9 TRP HZ2 H -7.323 -2.582 -4.627 1.00 . A A . 9 TRP HZ2 1 1
14 1921 1 1 9 TRP HZ3 H -6.942 -2.062 -0.376 1.00 . A A . 9 TRP HZ3 1 1
14 1922 1 1 9 TRP N N -1.514 -4.869 -0.676 1.00 . A A . 9 TRP N 1 1
14 1923 1 1 9 TRP NE1 N -5.288 -4.652 -4.590 1.00 . A A . 9 TRP NE1 1 1
14 1924 1 1 9 TRP O O -4.600 -5.781 0.933 1.00 . A A . 9 TRP O 1 1
14 1925 1 1 10 GLY C C -1.682 -6.177 3.895 1.00 . A A . 10 GLY C 1 1
14 1926 1 1 10 GLY CA C -2.935 -6.011 3.033 1.00 . A A . 10 GLY CA 1 1
14 1927 1 1 10 GLY H H -1.619 -5.286 1.490 1.00 . A A . 10 GLY H 1 1
14 1928 1 1 10 GLY HA2 H -3.594 -5.286 3.491 1.00 . A A . 10 GLY HA2 1 1
14 1929 1 1 10 GLY HA3 H -3.442 -6.961 2.956 1.00 . A A . 10 GLY HA3 1 1
14 1930 1 1 10 GLY N N -2.547 -5.541 1.674 1.00 . A A . 10 GLY N 1 1
14 1931 1 1 10 GLY O O -0.725 -5.459 3.657 1.00 . A A . 10 GLY O 1 1
14 1932 1 1 10 GLY OXT O -1.701 -7.019 4.776 1.00 . A A . 10 GLY OXT 1 1
15 1933 1 1 1 GLY C C -4.986 -1.238 2.056 1.00 . A A . 1 GLY C 1 1
15 1934 1 1 1 GLY CA C -6.282 -1.221 2.867 1.00 . A A . 1 GLY CA 1 1
15 1935 1 1 1 GLY H1 H -5.162 -0.523 4.478 1.00 . A A . 1 GLY H1 1 1
15 1936 1 1 1 GLY H2 H -5.705 -2.124 4.653 1.00 . A A . 1 GLY H2 1 1
15 1937 1 1 1 GLY H3 H -6.789 -0.830 4.849 1.00 . A A . 1 GLY H3 1 1
15 1938 1 1 1 GLY HA2 H -6.852 -2.116 2.657 1.00 . A A . 1 GLY HA2 1 1
15 1939 1 1 1 GLY HA3 H -6.861 -0.352 2.596 1.00 . A A . 1 GLY HA3 1 1
15 1940 1 1 1 GLY N N -5.960 -1.171 4.322 1.00 . A A . 1 GLY N 1 1
15 1941 1 1 1 GLY O O -4.073 -1.987 2.343 1.00 . A A . 1 GLY O 1 1
15 1942 1 1 2 TYR C C -2.715 0.692 0.747 1.00 . A A . 2 TYR C 1 1
15 1943 1 1 2 TYR CA C -3.657 -0.388 0.216 1.00 . A A . 2 TYR CA 1 1
15 1944 1 1 2 TYR CB C -4.017 -0.068 -1.235 1.00 . A A . 2 TYR CB 1 1
15 1945 1 1 2 TYR CD1 C -2.077 1.224 -2.186 1.00 . A A . 2 TYR CD1 1 1
15 1946 1 1 2 TYR CD2 C -2.266 -1.138 -2.706 1.00 . A A . 2 TYR CD2 1 1
15 1947 1 1 2 TYR CE1 C -0.907 1.299 -2.951 1.00 . A A . 2 TYR CE1 1 1
15 1948 1 1 2 TYR CE2 C -1.096 -1.062 -3.471 1.00 . A A . 2 TYR CE2 1 1
15 1949 1 1 2 TYR CG C -2.756 0.007 -2.063 1.00 . A A . 2 TYR CG 1 1
15 1950 1 1 2 TYR CZ C -0.417 0.157 -3.593 1.00 . A A . 2 TYR CZ 1 1
15 1951 1 1 2 TYR H H -5.644 0.179 0.830 1.00 . A A . 2 TYR H 1 1
15 1952 1 1 2 TYR HA H -3.168 -1.350 0.264 1.00 . A A . 2 TYR HA 1 1
15 1953 1 1 2 TYR HB2 H -4.661 -0.841 -1.627 1.00 . A A . 2 TYR HB2 1 1
15 1954 1 1 2 TYR HB3 H -4.528 0.883 -1.276 1.00 . A A . 2 TYR HB3 1 1
15 1955 1 1 2 TYR HD1 H -2.455 2.105 -1.689 1.00 . A A . 2 TYR HD1 1 1
15 1956 1 1 2 TYR HD2 H -2.790 -2.081 -2.613 1.00 . A A . 2 TYR HD2 1 1
15 1957 1 1 2 TYR HE1 H -0.384 2.240 -3.044 1.00 . A A . 2 TYR HE1 1 1
15 1958 1 1 2 TYR HE2 H -0.717 -1.943 -3.968 1.00 . A A . 2 TYR HE2 1 1
15 1959 1 1 2 TYR HH H 1.381 -0.365 -3.962 1.00 . A A . 2 TYR HH 1 1
15 1960 1 1 2 TYR N N -4.896 -0.418 1.044 1.00 . A A . 2 TYR N 1 1
15 1961 1 1 2 TYR O O -2.975 1.872 0.621 1.00 . A A . 2 TYR O 1 1
15 1962 1 1 2 TYR OH O 0.736 0.231 -4.347 1.00 . A A . 2 TYR OH 1 1
15 1963 1 1 3 ASP C C 0.070 1.970 0.690 1.00 . A A . 3 ASP C 1 1
15 1964 1 1 3 ASP CA C -0.664 1.311 1.865 1.00 . A A . 3 ASP CA 1 1
15 1965 1 1 3 ASP CB C 0.354 0.619 2.773 1.00 . A A . 3 ASP CB 1 1
15 1966 1 1 3 ASP CG C 0.673 1.524 3.964 1.00 . A A . 3 ASP CG 1 1
15 1967 1 1 3 ASP H H -1.425 -0.655 1.424 1.00 . A A . 3 ASP H 1 1
15 1968 1 1 3 ASP HA H -1.203 2.055 2.429 1.00 . A A . 3 ASP HA 1 1
15 1969 1 1 3 ASP HB2 H -0.057 -0.315 3.129 1.00 . A A . 3 ASP HB2 1 1
15 1970 1 1 3 ASP HB3 H 1.260 0.425 2.219 1.00 . A A . 3 ASP HB3 1 1
15 1971 1 1 3 ASP N N -1.620 0.301 1.335 1.00 . A A . 3 ASP N 1 1
15 1972 1 1 3 ASP O O 0.811 1.314 -0.014 1.00 . A A . 3 ASP O 1 1
15 1973 1 1 3 ASP OD1 O 0.118 2.609 4.023 1.00 . A A . 3 ASP OD1 1 1
15 1974 1 1 3 ASP OD2 O 1.467 1.117 4.797 1.00 . A A . 3 ASP OD2 1 1
15 1975 1 1 4 PRO C C 1.948 4.294 -0.240 1.00 . A A . 4 PRO C 1 1
15 1976 1 1 4 PRO CA C 0.483 4.009 -0.581 1.00 . A A . 4 PRO CA 1 1
15 1977 1 1 4 PRO CB C -0.337 5.300 -0.647 1.00 . A A . 4 PRO CB 1 1
15 1978 1 1 4 PRO CD C -1.051 4.052 1.363 1.00 . A A . 4 PRO CD 1 1
15 1979 1 1 4 PRO CG C -1.013 5.457 0.734 1.00 . A A . 4 PRO CG 1 1
15 1980 1 1 4 PRO HA H 0.405 3.475 -1.514 1.00 . A A . 4 PRO HA 1 1
15 1981 1 1 4 PRO HB2 H 0.313 6.141 -0.847 1.00 . A A . 4 PRO HB2 1 1
15 1982 1 1 4 PRO HB3 H -1.092 5.222 -1.414 1.00 . A A . 4 PRO HB3 1 1
15 1983 1 1 4 PRO HD2 H -0.682 4.083 2.379 1.00 . A A . 4 PRO HD2 1 1
15 1984 1 1 4 PRO HD3 H -2.052 3.648 1.333 1.00 . A A . 4 PRO HD3 1 1
15 1985 1 1 4 PRO HG2 H -0.436 6.129 1.355 1.00 . A A . 4 PRO HG2 1 1
15 1986 1 1 4 PRO HG3 H -2.019 5.831 0.616 1.00 . A A . 4 PRO HG3 1 1
15 1987 1 1 4 PRO N N -0.153 3.248 0.508 1.00 . A A . 4 PRO N 1 1
15 1988 1 1 4 PRO O O 2.714 4.734 -1.073 1.00 . A A . 4 PRO O 1 1
15 1989 1 1 5 GLU C C 4.610 3.095 0.888 1.00 . A A . 5 GLU C 1 1
15 1990 1 1 5 GLU CA C 3.763 4.274 1.364 1.00 . A A . 5 GLU CA 1 1
15 1991 1 1 5 GLU CB C 3.862 4.398 2.886 1.00 . A A . 5 GLU CB 1 1
15 1992 1 1 5 GLU CD C 4.444 6.048 4.671 1.00 . A A . 5 GLU CD 1 1
15 1993 1 1 5 GLU CG C 3.827 5.875 3.282 1.00 . A A . 5 GLU CG 1 1
15 1994 1 1 5 GLU H H 1.713 3.669 1.630 1.00 . A A . 5 GLU H 1 1
15 1995 1 1 5 GLU HA H 4.115 5.184 0.901 1.00 . A A . 5 GLU HA 1 1
15 1996 1 1 5 GLU HB2 H 3.032 3.880 3.344 1.00 . A A . 5 GLU HB2 1 1
15 1997 1 1 5 GLU HB3 H 4.791 3.959 3.222 1.00 . A A . 5 GLU HB3 1 1
15 1998 1 1 5 GLU HG2 H 4.388 6.454 2.562 1.00 . A A . 5 GLU HG2 1 1
15 1999 1 1 5 GLU HG3 H 2.803 6.218 3.299 1.00 . A A . 5 GLU HG3 1 1
15 2000 1 1 5 GLU N N 2.345 4.033 0.975 1.00 . A A . 5 GLU N 1 1
15 2001 1 1 5 GLU O O 5.709 3.260 0.396 1.00 . A A . 5 GLU O 1 1
15 2002 1 1 5 GLU OE1 O 3.987 5.385 5.587 1.00 . A A . 5 GLU OE1 1 1
15 2003 1 1 5 GLU OE2 O 5.364 6.840 4.794 1.00 . A A . 5 GLU OE2 1 1
15 2004 1 1 6 THR C C 4.142 0.092 -0.634 1.00 . A A . 6 THR C 1 1
15 2005 1 1 6 THR CA C 4.857 0.703 0.572 1.00 . A A . 6 THR CA 1 1
15 2006 1 1 6 THR CB C 4.914 -0.324 1.706 1.00 . A A . 6 THR CB 1 1
15 2007 1 1 6 THR CG2 C 5.395 -1.669 1.159 1.00 . A A . 6 THR CG2 1 1
15 2008 1 1 6 THR H H 3.207 1.796 1.416 1.00 . A A . 6 THR H 1 1
15 2009 1 1 6 THR HA H 5.859 0.992 0.291 1.00 . A A . 6 THR HA 1 1
15 2010 1 1 6 THR HB H 3.931 -0.444 2.133 1.00 . A A . 6 THR HB 1 1
15 2011 1 1 6 THR HG1 H 5.562 -0.279 3.541 1.00 . A A . 6 THR HG1 1 1
15 2012 1 1 6 THR HG21 H 5.485 -2.375 1.971 1.00 . A A . 6 THR HG21 1 1
15 2013 1 1 6 THR HG22 H 6.355 -1.542 0.683 1.00 . A A . 6 THR HG22 1 1
15 2014 1 1 6 THR HG23 H 4.681 -2.040 0.438 1.00 . A A . 6 THR HG23 1 1
15 2015 1 1 6 THR N N 4.098 1.902 1.024 1.00 . A A . 6 THR N 1 1
15 2016 1 1 6 THR O O 4.731 -0.131 -1.672 1.00 . A A . 6 THR O 1 1
15 2017 1 1 6 THR OG1 O 5.813 0.131 2.709 1.00 . A A . 6 THR OG1 1 1
15 2018 1 1 7 GLY C C 1.853 -2.245 -1.368 1.00 . A A . 7 GLY C 1 1
15 2019 1 1 7 GLY CA C 2.107 -0.762 -1.637 1.00 . A A . 7 GLY CA 1 1
15 2020 1 1 7 GLY H H 2.417 0.021 0.344 1.00 . A A . 7 GLY H 1 1
15 2021 1 1 7 GLY HA2 H 1.163 -0.247 -1.742 1.00 . A A . 7 GLY HA2 1 1
15 2022 1 1 7 GLY HA3 H 2.677 -0.658 -2.548 1.00 . A A . 7 GLY HA3 1 1
15 2023 1 1 7 GLY N N 2.871 -0.172 -0.503 1.00 . A A . 7 GLY N 1 1
15 2024 1 1 7 GLY O O 2.591 -3.099 -1.814 1.00 . A A . 7 GLY O 1 1
15 2025 1 1 8 THR C C -0.934 -4.154 0.062 1.00 . A A . 8 THR C 1 1
15 2026 1 1 8 THR CA C 0.524 -3.991 -0.353 1.00 . A A . 8 THR CA 1 1
15 2027 1 1 8 THR CB C 1.434 -4.481 0.780 1.00 . A A . 8 THR CB 1 1
15 2028 1 1 8 THR CG2 C 2.225 -5.713 0.330 1.00 . A A . 8 THR CG2 1 1
15 2029 1 1 8 THR H H 0.228 -1.858 -0.290 1.00 . A A . 8 THR H 1 1
15 2030 1 1 8 THR HA H 0.698 -4.577 -1.238 1.00 . A A . 8 THR HA 1 1
15 2031 1 1 8 THR HB H 0.829 -4.740 1.635 1.00 . A A . 8 THR HB 1 1
15 2032 1 1 8 THR HG1 H 1.831 -2.739 1.551 1.00 . A A . 8 THR HG1 1 1
15 2033 1 1 8 THR HG21 H 1.916 -6.004 -0.662 1.00 . A A . 8 THR HG21 1 1
15 2034 1 1 8 THR HG22 H 2.041 -6.527 1.016 1.00 . A A . 8 THR HG22 1 1
15 2035 1 1 8 THR HG23 H 3.280 -5.481 0.326 1.00 . A A . 8 THR HG23 1 1
15 2036 1 1 8 THR N N 0.814 -2.559 -0.642 1.00 . A A . 8 THR N 1 1
15 2037 1 1 8 THR O O -1.460 -3.399 0.854 1.00 . A A . 8 THR O 1 1
15 2038 1 1 8 THR OG1 O 2.337 -3.444 1.138 1.00 . A A . 8 THR OG1 1 1
15 2039 1 1 9 TRP C C -3.101 -6.079 1.217 1.00 . A A . 9 TRP C 1 1
15 2040 1 1 9 TRP CA C -3.007 -5.372 -0.137 1.00 . A A . 9 TRP CA 1 1
15 2041 1 1 9 TRP CB C -3.646 -6.242 -1.221 1.00 . A A . 9 TRP CB 1 1
15 2042 1 1 9 TRP CD1 C -4.112 -5.537 -3.607 1.00 . A A . 9 TRP CD1 1 1
15 2043 1 1 9 TRP CD2 C -5.064 -4.178 -2.094 1.00 . A A . 9 TRP CD2 1 1
15 2044 1 1 9 TRP CE2 C -5.414 -3.671 -3.366 1.00 . A A . 9 TRP CE2 1 1
15 2045 1 1 9 TRP CE3 C -5.534 -3.505 -0.958 1.00 . A A . 9 TRP CE3 1 1
15 2046 1 1 9 TRP CG C -4.245 -5.364 -2.273 1.00 . A A . 9 TRP CG 1 1
15 2047 1 1 9 TRP CH2 C -6.670 -1.872 -2.363 1.00 . A A . 9 TRP CH2 1 1
15 2048 1 1 9 TRP CZ2 C -6.207 -2.532 -3.505 1.00 . A A . 9 TRP CZ2 1 1
15 2049 1 1 9 TRP CZ3 C -6.332 -2.358 -1.089 1.00 . A A . 9 TRP CZ3 1 1
15 2050 1 1 9 TRP H H -1.145 -5.730 -1.114 1.00 . A A . 9 TRP H 1 1
15 2051 1 1 9 TRP HA H -3.513 -4.427 -0.087 1.00 . A A . 9 TRP HA 1 1
15 2052 1 1 9 TRP HB2 H -2.894 -6.875 -1.667 1.00 . A A . 9 TRP HB2 1 1
15 2053 1 1 9 TRP HB3 H -4.419 -6.855 -0.782 1.00 . A A . 9 TRP HB3 1 1
15 2054 1 1 9 TRP HD1 H -3.557 -6.328 -4.086 1.00 . A A . 9 TRP HD1 1 1
15 2055 1 1 9 TRP HE1 H -4.877 -4.432 -5.231 1.00 . A A . 9 TRP HE1 1 1
15 2056 1 1 9 TRP HE3 H -5.271 -3.873 0.021 1.00 . A A . 9 TRP HE3 1 1
15 2057 1 1 9 TRP HH2 H -7.284 -0.989 -2.458 1.00 . A A . 9 TRP HH2 1 1
15 2058 1 1 9 TRP HZ2 H -6.462 -2.163 -4.487 1.00 . A A . 9 TRP HZ2 1 1
15 2059 1 1 9 TRP HZ3 H -6.690 -1.848 -0.207 1.00 . A A . 9 TRP HZ3 1 1
15 2060 1 1 9 TRP N N -1.589 -5.141 -0.478 1.00 . A A . 9 TRP N 1 1
15 2061 1 1 9 TRP NE1 N -4.810 -4.534 -4.259 1.00 . A A . 9 TRP NE1 1 1
15 2062 1 1 9 TRP O O -3.126 -7.290 1.297 1.00 . A A . 9 TRP O 1 1
15 2063 1 1 10 GLY C C -3.555 -4.876 4.675 1.00 . A A . 10 GLY C 1 1
15 2064 1 1 10 GLY CA C -3.242 -5.952 3.634 1.00 . A A . 10 GLY CA 1 1
15 2065 1 1 10 GLY H H -3.129 -4.351 2.196 1.00 . A A . 10 GLY H 1 1
15 2066 1 1 10 GLY HA2 H -4.027 -6.695 3.633 1.00 . A A . 10 GLY HA2 1 1
15 2067 1 1 10 GLY HA3 H -2.302 -6.421 3.878 1.00 . A A . 10 GLY HA3 1 1
15 2068 1 1 10 GLY N N -3.152 -5.327 2.284 1.00 . A A . 10 GLY N 1 1
15 2069 1 1 10 GLY O O -4.596 -4.975 5.304 1.00 . A A . 10 GLY O 1 1
15 2070 1 1 10 GLY OXT O -2.751 -3.972 4.825 1.00 . A A . 10 GLY OXT 1 1
16 2071 1 1 1 GLY C C -5.646 -0.420 1.808 1.00 . A A . 1 GLY C 1 1
16 2072 1 1 1 GLY CA C -7.032 -0.328 2.448 1.00 . A A . 1 GLY CA 1 1
16 2073 1 1 1 GLY H1 H -5.924 -0.680 4.176 1.00 . A A . 1 GLY H1 1 1
16 2074 1 1 1 GLY H2 H -7.416 -1.492 4.132 1.00 . A A . 1 GLY H2 1 1
16 2075 1 1 1 GLY H3 H -7.363 0.177 4.441 1.00 . A A . 1 GLY H3 1 1
16 2076 1 1 1 GLY HA2 H -7.689 -1.058 1.994 1.00 . A A . 1 GLY HA2 1 1
16 2077 1 1 1 GLY HA3 H -7.431 0.662 2.294 1.00 . A A . 1 GLY HA3 1 1
16 2078 1 1 1 GLY N N -6.926 -0.601 3.910 1.00 . A A . 1 GLY N 1 1
16 2079 1 1 1 GLY O O -4.744 -1.032 2.343 1.00 . A A . 1 GLY O 1 1
16 2080 1 1 2 TYR C C -3.194 1.135 0.656 1.00 . A A . 2 TYR C 1 1
16 2081 1 1 2 TYR CA C -4.142 0.136 -0.008 1.00 . A A . 2 TYR CA 1 1
16 2082 1 1 2 TYR CB C -4.306 0.499 -1.486 1.00 . A A . 2 TYR CB 1 1
16 2083 1 1 2 TYR CD1 C -2.497 -0.724 -2.750 1.00 . A A . 2 TYR CD1 1 1
16 2084 1 1 2 TYR CD2 C -2.174 1.621 -2.224 1.00 . A A . 2 TYR CD2 1 1
16 2085 1 1 2 TYR CE1 C -1.249 -0.755 -3.384 1.00 . A A . 2 TYR CE1 1 1
16 2086 1 1 2 TYR CE2 C -0.926 1.591 -2.858 1.00 . A A . 2 TYR CE2 1 1
16 2087 1 1 2 TYR CG C -2.960 0.464 -2.170 1.00 . A A . 2 TYR CG 1 1
16 2088 1 1 2 TYR CZ C -0.464 0.404 -3.438 1.00 . A A . 2 TYR CZ 1 1
16 2089 1 1 2 TYR H H -6.211 0.676 0.252 1.00 . A A . 2 TYR H 1 1
16 2090 1 1 2 TYR HA H -3.732 -0.860 0.074 1.00 . A A . 2 TYR HA 1 1
16 2091 1 1 2 TYR HB2 H -4.970 -0.208 -1.959 1.00 . A A . 2 TYR HB2 1 1
16 2092 1 1 2 TYR HB3 H -4.722 1.493 -1.567 1.00 . A A . 2 TYR HB3 1 1
16 2093 1 1 2 TYR HD1 H -3.103 -1.618 -2.708 1.00 . A A . 2 TYR HD1 1 1
16 2094 1 1 2 TYR HD2 H -2.530 2.538 -1.777 1.00 . A A . 2 TYR HD2 1 1
16 2095 1 1 2 TYR HE1 H -0.893 -1.670 -3.832 1.00 . A A . 2 TYR HE1 1 1
16 2096 1 1 2 TYR HE2 H -0.319 2.484 -2.900 1.00 . A A . 2 TYR HE2 1 1
16 2097 1 1 2 TYR HH H 1.025 1.279 -4.251 1.00 . A A . 2 TYR HH 1 1
16 2098 1 1 2 TYR N N -5.469 0.187 0.666 1.00 . A A . 2 TYR N 1 1
16 2099 1 1 2 TYR O O -3.572 2.243 0.981 1.00 . A A . 2 TYR O 1 1
16 2100 1 1 2 TYR OH O 0.766 0.374 -4.063 1.00 . A A . 2 TYR OH 1 1
16 2101 1 1 3 ASP C C -0.061 2.258 0.421 1.00 . A A . 3 ASP C 1 1
16 2102 1 1 3 ASP CA C -0.992 1.684 1.497 1.00 . A A . 3 ASP CA 1 1
16 2103 1 1 3 ASP CB C -0.164 0.919 2.531 1.00 . A A . 3 ASP CB 1 1
16 2104 1 1 3 ASP CG C 0.248 1.869 3.656 1.00 . A A . 3 ASP CG 1 1
16 2105 1 1 3 ASP H H -1.677 -0.144 0.585 1.00 . A A . 3 ASP H 1 1
16 2106 1 1 3 ASP HA H -1.529 2.480 1.985 1.00 . A A . 3 ASP HA 1 1
16 2107 1 1 3 ASP HB2 H -0.755 0.111 2.939 1.00 . A A . 3 ASP HB2 1 1
16 2108 1 1 3 ASP HB3 H 0.720 0.517 2.059 1.00 . A A . 3 ASP HB3 1 1
16 2109 1 1 3 ASP N N -1.963 0.754 0.857 1.00 . A A . 3 ASP N 1 1
16 2110 1 1 3 ASP O O 0.667 1.523 -0.215 1.00 . A A . 3 ASP O 1 1
16 2111 1 1 3 ASP OD1 O 0.745 2.940 3.347 1.00 . A A . 3 ASP OD1 1 1
16 2112 1 1 3 ASP OD2 O 0.060 1.511 4.808 1.00 . A A . 3 ASP OD2 1 1
16 2113 1 1 4 PRO C C 2.169 4.362 -0.256 1.00 . A A . 4 PRO C 1 1
16 2114 1 1 4 PRO CA C 0.725 4.248 -0.754 1.00 . A A . 4 PRO CA 1 1
16 2115 1 1 4 PRO CB C 0.073 5.627 -0.880 1.00 . A A . 4 PRO CB 1 1
16 2116 1 1 4 PRO CD C -0.991 4.454 1.019 1.00 . A A . 4 PRO CD 1 1
16 2117 1 1 4 PRO CG C -0.728 5.850 0.423 1.00 . A A . 4 PRO CG 1 1
16 2118 1 1 4 PRO HA H 0.689 3.735 -1.702 1.00 . A A . 4 PRO HA 1 1
16 2119 1 1 4 PRO HB2 H 0.834 6.388 -0.989 1.00 . A A . 4 PRO HB2 1 1
16 2120 1 1 4 PRO HB3 H -0.596 5.645 -1.727 1.00 . A A . 4 PRO HB3 1 1
16 2121 1 1 4 PRO HD2 H -0.729 4.435 2.067 1.00 . A A . 4 PRO HD2 1 1
16 2122 1 1 4 PRO HD3 H -2.024 4.172 0.879 1.00 . A A . 4 PRO HD3 1 1
16 2123 1 1 4 PRO HG2 H -0.150 6.448 1.114 1.00 . A A . 4 PRO HG2 1 1
16 2124 1 1 4 PRO HG3 H -1.666 6.336 0.205 1.00 . A A . 4 PRO HG3 1 1
16 2125 1 1 4 PRO N N -0.110 3.557 0.244 1.00 . A A . 4 PRO N 1 1
16 2126 1 1 4 PRO O O 3.062 4.739 -0.989 1.00 . A A . 4 PRO O 1 1
16 2127 1 1 5 GLU C C 4.544 2.828 1.170 1.00 . A A . 5 GLU C 1 1
16 2128 1 1 5 GLU CA C 3.792 4.112 1.524 1.00 . A A . 5 GLU CA 1 1
16 2129 1 1 5 GLU CB C 3.741 4.270 3.045 1.00 . A A . 5 GLU CB 1 1
16 2130 1 1 5 GLU CD C 5.102 6.355 3.263 1.00 . A A . 5 GLU CD 1 1
16 2131 1 1 5 GLU CG C 3.700 5.758 3.401 1.00 . A A . 5 GLU CG 1 1
16 2132 1 1 5 GLU H H 1.674 3.723 1.558 1.00 . A A . 5 GLU H 1 1
16 2133 1 1 5 GLU HA H 4.301 4.959 1.089 1.00 . A A . 5 GLU HA 1 1
16 2134 1 1 5 GLU HB2 H 2.856 3.783 3.427 1.00 . A A . 5 GLU HB2 1 1
16 2135 1 1 5 GLU HB3 H 4.619 3.821 3.484 1.00 . A A . 5 GLU HB3 1 1
16 2136 1 1 5 GLU HG2 H 3.023 6.269 2.734 1.00 . A A . 5 GLU HG2 1 1
16 2137 1 1 5 GLU HG3 H 3.360 5.875 4.419 1.00 . A A . 5 GLU HG3 1 1
16 2138 1 1 5 GLU N N 2.406 4.030 0.984 1.00 . A A . 5 GLU N 1 1
16 2139 1 1 5 GLU O O 5.643 2.861 0.654 1.00 . A A . 5 GLU O 1 1
16 2140 1 1 5 GLU OE1 O 5.965 5.975 4.037 1.00 . A A . 5 GLU OE1 1 1
16 2141 1 1 5 GLU OE2 O 5.289 7.181 2.385 1.00 . A A . 5 GLU OE2 1 1
16 2142 1 1 6 THR C C 4.054 -0.148 -0.188 1.00 . A A . 6 THR C 1 1
16 2143 1 1 6 THR CA C 4.630 0.407 1.117 1.00 . A A . 6 THR CA 1 1
16 2144 1 1 6 THR CB C 4.389 -0.594 2.249 1.00 . A A . 6 THR CB 1 1
16 2145 1 1 6 THR CG2 C 4.891 -1.976 1.827 1.00 . A A . 6 THR CG2 1 1
16 2146 1 1 6 THR H H 3.067 1.691 1.854 1.00 . A A . 6 THR H 1 1
16 2147 1 1 6 THR HA H 5.690 0.574 1.001 1.00 . A A . 6 THR HA 1 1
16 2148 1 1 6 THR HB H 3.333 -0.649 2.463 1.00 . A A . 6 THR HB 1 1
16 2149 1 1 6 THR HG1 H 4.587 -0.451 4.179 1.00 . A A . 6 THR HG1 1 1
16 2150 1 1 6 THR HG21 H 4.807 -2.659 2.658 1.00 . A A . 6 THR HG21 1 1
16 2151 1 1 6 THR HG22 H 5.925 -1.905 1.523 1.00 . A A . 6 THR HG22 1 1
16 2152 1 1 6 THR HG23 H 4.298 -2.338 1.001 1.00 . A A . 6 THR HG23 1 1
16 2153 1 1 6 THR N N 3.956 1.694 1.441 1.00 . A A . 6 THR N 1 1
16 2154 1 1 6 THR O O 4.779 -0.527 -1.087 1.00 . A A . 6 THR O 1 1
16 2155 1 1 6 THR OG1 O 5.088 -0.168 3.410 1.00 . A A . 6 THR OG1 1 1
16 2156 1 1 7 GLY C C 1.879 -2.223 -1.400 1.00 . A A . 7 GLY C 1 1
16 2157 1 1 7 GLY CA C 2.131 -0.722 -1.546 1.00 . A A . 7 GLY CA 1 1
16 2158 1 1 7 GLY H H 2.189 0.118 0.437 1.00 . A A . 7 GLY H 1 1
16 2159 1 1 7 GLY HA2 H 1.195 -0.213 -1.721 1.00 . A A . 7 GLY HA2 1 1
16 2160 1 1 7 GLY HA3 H 2.795 -0.552 -2.380 1.00 . A A . 7 GLY HA3 1 1
16 2161 1 1 7 GLY N N 2.755 -0.196 -0.299 1.00 . A A . 7 GLY N 1 1
16 2162 1 1 7 GLY O O 2.404 -3.025 -2.146 1.00 . A A . 7 GLY O 1 1
16 2163 1 1 8 THR C C -0.692 -4.263 0.014 1.00 . A A . 8 THR C 1 1
16 2164 1 1 8 THR CA C 0.791 -4.062 -0.262 1.00 . A A . 8 THR CA 1 1
16 2165 1 1 8 THR CB C 1.608 -4.605 0.913 1.00 . A A . 8 THR CB 1 1
16 2166 1 1 8 THR CG2 C 1.941 -6.076 0.663 1.00 . A A . 8 THR CG2 1 1
16 2167 1 1 8 THR H H 0.660 -1.950 0.145 1.00 . A A . 8 THR H 1 1
16 2168 1 1 8 THR HA H 1.052 -4.597 -1.158 1.00 . A A . 8 THR HA 1 1
16 2169 1 1 8 THR HB H 1.031 -4.521 1.821 1.00 . A A . 8 THR HB 1 1
16 2170 1 1 8 THR HG1 H 3.476 -4.273 0.488 1.00 . A A . 8 THR HG1 1 1
16 2171 1 1 8 THR HG21 H 2.704 -6.148 -0.099 1.00 . A A . 8 THR HG21 1 1
16 2172 1 1 8 THR HG22 H 1.054 -6.596 0.333 1.00 . A A . 8 THR HG22 1 1
16 2173 1 1 8 THR HG23 H 2.303 -6.525 1.577 1.00 . A A . 8 THR HG23 1 1
16 2174 1 1 8 THR N N 1.076 -2.612 -0.447 1.00 . A A . 8 THR N 1 1
16 2175 1 1 8 THR O O -1.354 -3.412 0.574 1.00 . A A . 8 THR O 1 1
16 2176 1 1 8 THR OG1 O 2.809 -3.858 1.039 1.00 . A A . 8 THR OG1 1 1
16 2177 1 1 9 TRP C C -2.834 -6.542 1.066 1.00 . A A . 9 TRP C 1 1
16 2178 1 1 9 TRP CA C -2.656 -5.640 -0.157 1.00 . A A . 9 TRP CA 1 1
16 2179 1 1 9 TRP CB C -3.252 -6.318 -1.392 1.00 . A A . 9 TRP CB 1 1
16 2180 1 1 9 TRP CD1 C -4.168 -5.238 -3.485 1.00 . A A . 9 TRP CD1 1 1
16 2181 1 1 9 TRP CD2 C -4.966 -4.303 -1.604 1.00 . A A . 9 TRP CD2 1 1
16 2182 1 1 9 TRP CE2 C -5.560 -3.609 -2.683 1.00 . A A . 9 TRP CE2 1 1
16 2183 1 1 9 TRP CE3 C -5.299 -3.910 -0.298 1.00 . A A . 9 TRP CE3 1 1
16 2184 1 1 9 TRP CG C -4.091 -5.334 -2.139 1.00 . A A . 9 TRP CG 1 1
16 2185 1 1 9 TRP CH2 C -6.778 -2.181 -1.166 1.00 . A A . 9 TRP CH2 1 1
16 2186 1 1 9 TRP CZ2 C -6.456 -2.560 -2.472 1.00 . A A . 9 TRP CZ2 1 1
16 2187 1 1 9 TRP CZ3 C -6.199 -2.855 -0.080 1.00 . A A . 9 TRP CZ3 1 1
16 2188 1 1 9 TRP H H -0.677 -6.050 -0.835 1.00 . A A . 9 TRP H 1 1
16 2189 1 1 9 TRP HA H -3.144 -4.702 0.009 1.00 . A A . 9 TRP HA 1 1
16 2190 1 1 9 TRP HB2 H -2.455 -6.670 -2.031 1.00 . A A . 9 TRP HB2 1 1
16 2191 1 1 9 TRP HB3 H -3.864 -7.153 -1.084 1.00 . A A . 9 TRP HB3 1 1
16 2192 1 1 9 TRP HD1 H -3.637 -5.860 -4.191 1.00 . A A . 9 TRP HD1 1 1
16 2193 1 1 9 TRP HE1 H -5.278 -3.942 -4.722 1.00 . A A . 9 TRP HE1 1 1
16 2194 1 1 9 TRP HE3 H -4.854 -4.424 0.543 1.00 . A A . 9 TRP HE3 1 1
16 2195 1 1 9 TRP HH2 H -7.469 -1.370 -0.993 1.00 . A A . 9 TRP HH2 1 1
16 2196 1 1 9 TRP HZ2 H -6.898 -2.045 -3.313 1.00 . A A . 9 TRP HZ2 1 1
16 2197 1 1 9 TRP HZ3 H -6.449 -2.561 0.929 1.00 . A A . 9 TRP HZ3 1 1
16 2198 1 1 9 TRP N N -1.221 -5.385 -0.383 1.00 . A A . 9 TRP N 1 1
16 2199 1 1 9 TRP NE1 N -5.043 -4.216 -3.810 1.00 . A A . 9 TRP NE1 1 1
16 2200 1 1 9 TRP O O -3.906 -7.051 1.323 1.00 . A A . 9 TRP O 1 1
16 2201 1 1 10 GLY C C -1.366 -6.864 4.247 1.00 . A A . 10 GLY C 1 1
16 2202 1 1 10 GLY CA C -1.900 -7.613 3.027 1.00 . A A . 10 GLY CA 1 1
16 2203 1 1 10 GLY H H -0.933 -6.324 1.597 1.00 . A A . 10 GLY H 1 1
16 2204 1 1 10 GLY HA2 H -2.937 -7.874 3.187 1.00 . A A . 10 GLY HA2 1 1
16 2205 1 1 10 GLY HA3 H -1.321 -8.512 2.877 1.00 . A A . 10 GLY HA3 1 1
16 2206 1 1 10 GLY N N -1.790 -6.744 1.821 1.00 . A A . 10 GLY N 1 1
16 2207 1 1 10 GLY O O -0.913 -7.521 5.170 1.00 . A A . 10 GLY O 1 1
16 2208 1 1 10 GLY OXT O -1.418 -5.645 4.240 1.00 . A A . 10 GLY OXT 1 1
17 2209 1 1 1 GLY C C -5.303 -0.861 1.928 1.00 . A A . 1 GLY C 1 1
17 2210 1 1 1 GLY CA C -6.649 -0.849 2.654 1.00 . A A . 1 GLY CA 1 1
17 2211 1 1 1 GLY H1 H -7.397 -2.769 2.348 1.00 . A A . 1 GLY H1 1 1
17 2212 1 1 1 GLY H2 H -7.643 -2.171 3.920 1.00 . A A . 1 GLY H2 1 1
17 2213 1 1 1 GLY H3 H -6.101 -2.699 3.440 1.00 . A A . 1 GLY H3 1 1
17 2214 1 1 1 GLY HA2 H -7.423 -0.510 1.979 1.00 . A A . 1 GLY HA2 1 1
17 2215 1 1 1 GLY HA3 H -6.591 -0.182 3.501 1.00 . A A . 1 GLY HA3 1 1
17 2216 1 1 1 GLY N N -6.972 -2.225 3.126 1.00 . A A . 1 GLY N 1 1
17 2217 1 1 1 GLY O O -4.362 -1.501 2.353 1.00 . A A . 1 GLY O 1 1
17 2218 1 1 2 TYR C C -2.988 0.911 0.704 1.00 . A A . 2 TYR C 1 1
17 2219 1 1 2 TYR CA C -3.920 -0.128 0.080 1.00 . A A . 2 TYR CA 1 1
17 2220 1 1 2 TYR CB C -4.191 0.242 -1.380 1.00 . A A . 2 TYR CB 1 1
17 2221 1 1 2 TYR CD1 C -2.176 1.542 -2.151 1.00 . A A . 2 TYR CD1 1 1
17 2222 1 1 2 TYR CD2 C -2.375 -0.788 -2.795 1.00 . A A . 2 TYR CD2 1 1
17 2223 1 1 2 TYR CE1 C -0.962 1.630 -2.842 1.00 . A A . 2 TYR CE1 1 1
17 2224 1 1 2 TYR CE2 C -1.160 -0.700 -3.486 1.00 . A A . 2 TYR CE2 1 1
17 2225 1 1 2 TYR CG C -2.882 0.335 -2.127 1.00 . A A . 2 TYR CG 1 1
17 2226 1 1 2 TYR CZ C -0.454 0.509 -3.509 1.00 . A A . 2 TYR CZ 1 1
17 2227 1 1 2 TYR H H -5.976 0.353 0.507 1.00 . A A . 2 TYR H 1 1
17 2228 1 1 2 TYR HA H -3.455 -1.102 0.124 1.00 . A A . 2 TYR HA 1 1
17 2229 1 1 2 TYR HB2 H -4.814 -0.516 -1.833 1.00 . A A . 2 TYR HB2 1 1
17 2230 1 1 2 TYR HB3 H -4.697 1.195 -1.422 1.00 . A A . 2 TYR HB3 1 1
17 2231 1 1 2 TYR HD1 H -2.567 2.408 -1.636 1.00 . A A . 2 TYR HD1 1 1
17 2232 1 1 2 TYR HD2 H -2.920 -1.721 -2.777 1.00 . A A . 2 TYR HD2 1 1
17 2233 1 1 2 TYR HE1 H -0.417 2.562 -2.860 1.00 . A A . 2 TYR HE1 1 1
17 2234 1 1 2 TYR HE2 H -0.768 -1.565 -4.001 1.00 . A A . 2 TYR HE2 1 1
17 2235 1 1 2 TYR HH H 0.551 0.598 -5.130 1.00 . A A . 2 TYR HH 1 1
17 2236 1 1 2 TYR N N -5.205 -0.157 0.833 1.00 . A A . 2 TYR N 1 1
17 2237 1 1 2 TYR O O -3.385 2.022 0.993 1.00 . A A . 2 TYR O 1 1
17 2238 1 1 2 TYR OH O 0.744 0.594 -4.190 1.00 . A A . 2 TYR OH 1 1
17 2239 1 1 3 ASP C C 0.050 2.167 0.409 1.00 . A A . 3 ASP C 1 1
17 2240 1 1 3 ASP CA C -0.793 1.525 1.519 1.00 . A A . 3 ASP CA 1 1
17 2241 1 1 3 ASP CB C 0.129 0.783 2.489 1.00 . A A . 3 ASP CB 1 1
17 2242 1 1 3 ASP CG C 0.289 1.603 3.769 1.00 . A A . 3 ASP CG 1 1
17 2243 1 1 3 ASP H H -1.450 -0.344 0.673 1.00 . A A . 3 ASP H 1 1
17 2244 1 1 3 ASP HA H -1.340 2.283 2.054 1.00 . A A . 3 ASP HA 1 1
17 2245 1 1 3 ASP HB2 H -0.300 -0.180 2.728 1.00 . A A . 3 ASP HB2 1 1
17 2246 1 1 3 ASP HB3 H 1.096 0.642 2.031 1.00 . A A . 3 ASP HB3 1 1
17 2247 1 1 3 ASP N N -1.750 0.558 0.913 1.00 . A A . 3 ASP N 1 1
17 2248 1 1 3 ASP O O 0.803 1.486 -0.259 1.00 . A A . 3 ASP O 1 1
17 2249 1 1 3 ASP OD1 O 0.296 2.819 3.673 1.00 . A A . 3 ASP OD1 1 1
17 2250 1 1 3 ASP OD2 O 0.403 1.002 4.826 1.00 . A A . 3 ASP OD2 1 1
17 2251 1 1 4 PRO C C 2.096 4.432 -0.321 1.00 . A A . 4 PRO C 1 1
17 2252 1 1 4 PRO CA C 0.651 4.212 -0.778 1.00 . A A . 4 PRO CA 1 1
17 2253 1 1 4 PRO CB C -0.108 5.539 -0.877 1.00 . A A . 4 PRO CB 1 1
17 2254 1 1 4 PRO CD C -1.008 4.290 1.059 1.00 . A A . 4 PRO CD 1 1
17 2255 1 1 4 PRO CG C -0.878 5.700 0.454 1.00 . A A . 4 PRO CG 1 1
17 2256 1 1 4 PRO HA H 0.624 3.699 -1.725 1.00 . A A . 4 PRO HA 1 1
17 2257 1 1 4 PRO HB2 H 0.590 6.356 -1.009 1.00 . A A . 4 PRO HB2 1 1
17 2258 1 1 4 PRO HB3 H -0.804 5.508 -1.699 1.00 . A A . 4 PRO HB3 1 1
17 2259 1 1 4 PRO HD2 H -0.698 4.293 2.095 1.00 . A A . 4 PRO HD2 1 1
17 2260 1 1 4 PRO HD3 H -2.020 3.929 0.965 1.00 . A A . 4 PRO HD3 1 1
17 2261 1 1 4 PRO HG2 H -0.326 6.345 1.125 1.00 . A A . 4 PRO HG2 1 1
17 2262 1 1 4 PRO HG3 H -1.859 6.109 0.267 1.00 . A A . 4 PRO HG3 1 1
17 2263 1 1 4 PRO N N -0.095 3.460 0.246 1.00 . A A . 4 PRO N 1 1
17 2264 1 1 4 PRO O O 2.915 4.956 -1.049 1.00 . A A . 4 PRO O 1 1
17 2265 1 1 5 GLU C C 4.647 2.995 0.957 1.00 . A A . 5 GLU C 1 1
17 2266 1 1 5 GLU CA C 3.806 4.200 1.381 1.00 . A A . 5 GLU CA 1 1
17 2267 1 1 5 GLU CB C 3.786 4.299 2.908 1.00 . A A . 5 GLU CB 1 1
17 2268 1 1 5 GLU CD C 5.770 5.818 2.929 1.00 . A A . 5 GLU CD 1 1
17 2269 1 1 5 GLU CG C 5.214 4.483 3.427 1.00 . A A . 5 GLU CG 1 1
17 2270 1 1 5 GLU H H 1.739 3.599 1.446 1.00 . A A . 5 GLU H 1 1
17 2271 1 1 5 GLU HA H 4.230 5.101 0.965 1.00 . A A . 5 GLU HA 1 1
17 2272 1 1 5 GLU HB2 H 3.183 5.145 3.206 1.00 . A A . 5 GLU HB2 1 1
17 2273 1 1 5 GLU HB3 H 3.369 3.394 3.323 1.00 . A A . 5 GLU HB3 1 1
17 2274 1 1 5 GLU HG2 H 5.207 4.475 4.508 1.00 . A A . 5 GLU HG2 1 1
17 2275 1 1 5 GLU HG3 H 5.836 3.678 3.064 1.00 . A A . 5 GLU HG3 1 1
17 2276 1 1 5 GLU N N 2.415 4.025 0.877 1.00 . A A . 5 GLU N 1 1
17 2277 1 1 5 GLU O O 5.727 3.135 0.419 1.00 . A A . 5 GLU O 1 1
17 2278 1 1 5 GLU OE1 O 6.037 5.920 1.743 1.00 . A A . 5 GLU OE1 1 1
17 2279 1 1 5 GLU OE2 O 5.921 6.714 3.741 1.00 . A A . 5 GLU OE2 1 1
17 2280 1 1 6 THR C C 4.239 -0.062 -0.405 1.00 . A A . 6 THR C 1 1
17 2281 1 1 6 THR CA C 4.918 0.591 0.801 1.00 . A A . 6 THR CA 1 1
17 2282 1 1 6 THR CB C 4.941 -0.398 1.970 1.00 . A A . 6 THR CB 1 1
17 2283 1 1 6 THR CG2 C 5.079 0.368 3.287 1.00 . A A . 6 THR CG2 1 1
17 2284 1 1 6 THR H H 3.280 1.720 1.625 1.00 . A A . 6 THR H 1 1
17 2285 1 1 6 THR HA H 5.929 0.867 0.541 1.00 . A A . 6 THR HA 1 1
17 2286 1 1 6 THR HB H 5.778 -1.068 1.859 1.00 . A A . 6 THR HB 1 1
17 2287 1 1 6 THR HG1 H 3.072 -0.636 2.456 1.00 . A A . 6 THR HG1 1 1
17 2288 1 1 6 THR HG21 H 5.741 1.209 3.146 1.00 . A A . 6 THR HG21 1 1
17 2289 1 1 6 THR HG22 H 5.484 -0.288 4.043 1.00 . A A . 6 THR HG22 1 1
17 2290 1 1 6 THR HG23 H 4.108 0.722 3.601 1.00 . A A . 6 THR HG23 1 1
17 2291 1 1 6 THR N N 4.155 1.809 1.194 1.00 . A A . 6 THR N 1 1
17 2292 1 1 6 THR O O 4.888 -0.507 -1.330 1.00 . A A . 6 THR O 1 1
17 2293 1 1 6 THR OG1 O 3.732 -1.145 1.978 1.00 . A A . 6 THR OG1 1 1
17 2294 1 1 7 GLY C C 1.896 -2.199 -1.233 1.00 . A A . 7 GLY C 1 1
17 2295 1 1 7 GLY CA C 2.211 -0.736 -1.550 1.00 . A A . 7 GLY CA 1 1
17 2296 1 1 7 GLY H H 2.430 0.252 0.353 1.00 . A A . 7 GLY H 1 1
17 2297 1 1 7 GLY HA2 H 1.289 -0.198 -1.725 1.00 . A A . 7 GLY HA2 1 1
17 2298 1 1 7 GLY HA3 H 2.829 -0.688 -2.433 1.00 . A A . 7 GLY HA3 1 1
17 2299 1 1 7 GLY N N 2.934 -0.117 -0.403 1.00 . A A . 7 GLY N 1 1
17 2300 1 1 7 GLY O O 2.579 -3.100 -1.679 1.00 . A A . 7 GLY O 1 1
17 2301 1 1 8 THR C C -0.985 -3.967 0.112 1.00 . A A . 8 THR C 1 1
17 2302 1 1 8 THR CA C 0.514 -3.854 -0.132 1.00 . A A . 8 THR CA 1 1
17 2303 1 1 8 THR CB C 1.272 -4.291 1.122 1.00 . A A . 8 THR CB 1 1
17 2304 1 1 8 THR CG2 C 1.751 -5.734 0.952 1.00 . A A . 8 THR CG2 1 1
17 2305 1 1 8 THR H H 0.325 -1.707 -0.121 1.00 . A A . 8 THR H 1 1
17 2306 1 1 8 THR HA H 0.777 -4.496 -0.954 1.00 . A A . 8 THR HA 1 1
17 2307 1 1 8 THR HB H 0.618 -4.232 1.979 1.00 . A A . 8 THR HB 1 1
17 2308 1 1 8 THR HG1 H 2.267 -2.971 2.149 1.00 . A A . 8 THR HG1 1 1
17 2309 1 1 8 THR HG21 H 1.065 -6.267 0.312 1.00 . A A . 8 THR HG21 1 1
17 2310 1 1 8 THR HG22 H 1.793 -6.215 1.918 1.00 . A A . 8 THR HG22 1 1
17 2311 1 1 8 THR HG23 H 2.735 -5.735 0.506 1.00 . A A . 8 THR HG23 1 1
17 2312 1 1 8 THR N N 0.866 -2.446 -0.469 1.00 . A A . 8 THR N 1 1
17 2313 1 1 8 THR O O -1.631 -3.032 0.544 1.00 . A A . 8 THR O 1 1
17 2314 1 1 8 THR OG1 O 2.391 -3.436 1.318 1.00 . A A . 8 THR OG1 1 1
17 2315 1 1 9 TRP C C -3.255 -6.005 1.350 1.00 . A A . 9 TRP C 1 1
17 2316 1 1 9 TRP CA C -2.995 -5.287 0.024 1.00 . A A . 9 TRP CA 1 1
17 2317 1 1 9 TRP CB C -3.563 -6.111 -1.133 1.00 . A A . 9 TRP CB 1 1
17 2318 1 1 9 TRP CD1 C -4.338 -5.291 -3.396 1.00 . A A . 9 TRP CD1 1 1
17 2319 1 1 9 TRP CD2 C -5.201 -4.105 -1.694 1.00 . A A . 9 TRP CD2 1 1
17 2320 1 1 9 TRP CE2 C -5.721 -3.542 -2.882 1.00 . A A . 9 TRP CE2 1 1
17 2321 1 1 9 TRP CE3 C -5.585 -3.543 -0.468 1.00 . A A . 9 TRP CE3 1 1
17 2322 1 1 9 TRP CG C -4.331 -5.214 -2.046 1.00 . A A . 9 TRP CG 1 1
17 2323 1 1 9 TRP CH2 C -6.970 -1.906 -1.624 1.00 . A A . 9 TRP CH2 1 1
17 2324 1 1 9 TRP CZ2 C -6.595 -2.456 -2.854 1.00 . A A . 9 TRP CZ2 1 1
17 2325 1 1 9 TRP CZ3 C -6.464 -2.448 -0.432 1.00 . A A . 9 TRP CZ3 1 1
17 2326 1 1 9 TRP H H -1.013 -5.839 -0.528 1.00 . A A . 9 TRP H 1 1
17 2327 1 1 9 TRP HA H -3.458 -4.321 0.036 1.00 . A A . 9 TRP HA 1 1
17 2328 1 1 9 TRP HB2 H -2.753 -6.573 -1.679 1.00 . A A . 9 TRP HB2 1 1
17 2329 1 1 9 TRP HB3 H -4.218 -6.876 -0.744 1.00 . A A . 9 TRP HB3 1 1
17 2330 1 1 9 TRP HD1 H -3.788 -6.008 -3.986 1.00 . A A . 9 TRP HD1 1 1
17 2331 1 1 9 TRP HE1 H -5.347 -4.139 -4.844 1.00 . A A . 9 TRP HE1 1 1
17 2332 1 1 9 TRP HE3 H -5.194 -3.954 0.453 1.00 . A A . 9 TRP HE3 1 1
17 2333 1 1 9 TRP HH2 H -7.645 -1.064 -1.590 1.00 . A A . 9 TRP HH2 1 1
17 2334 1 1 9 TRP HZ2 H -6.981 -2.043 -3.774 1.00 . A A . 9 TRP HZ2 1 1
17 2335 1 1 9 TRP HZ3 H -6.756 -2.023 0.516 1.00 . A A . 9 TRP HZ3 1 1
17 2336 1 1 9 TRP N N -1.546 -5.107 -0.175 1.00 . A A . 9 TRP N 1 1
17 2337 1 1 9 TRP NE1 N -5.165 -4.300 -3.894 1.00 . A A . 9 TRP NE1 1 1
17 2338 1 1 9 TRP O O -4.302 -5.863 1.949 1.00 . A A . 9 TRP O 1 1
17 2339 1 1 10 GLY C C -1.339 -7.194 4.045 1.00 . A A . 10 GLY C 1 1
17 2340 1 1 10 GLY CA C -2.504 -7.500 3.102 1.00 . A A . 10 GLY CA 1 1
17 2341 1 1 10 GLY H H -1.470 -6.876 1.317 1.00 . A A . 10 GLY H 1 1
17 2342 1 1 10 GLY HA2 H -3.431 -7.180 3.557 1.00 . A A . 10 GLY HA2 1 1
17 2343 1 1 10 GLY HA3 H -2.542 -8.562 2.915 1.00 . A A . 10 GLY HA3 1 1
17 2344 1 1 10 GLY N N -2.308 -6.775 1.815 1.00 . A A . 10 GLY N 1 1
17 2345 1 1 10 GLY O O -0.295 -7.803 3.881 1.00 . A A . 10 GLY O 1 1
17 2346 1 1 10 GLY OXT O -1.510 -6.355 4.915 1.00 . A A . 10 GLY OXT 1 1
18 2347 1 1 1 GLY C C -5.376 -1.165 2.325 1.00 . A A . 1 GLY C 1 1
18 2348 1 1 1 GLY CA C -6.728 -1.165 3.039 1.00 . A A . 1 GLY CA 1 1
18 2349 1 1 1 GLY H1 H -6.028 -1.352 4.992 1.00 . A A . 1 GLY H1 1 1
18 2350 1 1 1 GLY H2 H -7.489 -0.496 4.858 1.00 . A A . 1 GLY H2 1 1
18 2351 1 1 1 GLY H3 H -6.025 0.240 4.407 1.00 . A A . 1 GLY H3 1 1
18 2352 1 1 1 GLY HA2 H -7.120 -2.171 3.072 1.00 . A A . 1 GLY HA2 1 1
18 2353 1 1 1 GLY HA3 H -7.413 -0.527 2.503 1.00 . A A . 1 GLY HA3 1 1
18 2354 1 1 1 GLY N N -6.554 -0.654 4.429 1.00 . A A . 1 GLY N 1 1
18 2355 1 1 1 GLY O O -4.452 -1.846 2.726 1.00 . A A . 1 GLY O 1 1
18 2356 1 1 2 TYR C C -3.056 0.702 1.165 1.00 . A A . 2 TYR C 1 1
18 2357 1 1 2 TYR CA C -3.958 -0.361 0.536 1.00 . A A . 2 TYR CA 1 1
18 2358 1 1 2 TYR CB C -4.214 -0.011 -0.932 1.00 . A A . 2 TYR CB 1 1
18 2359 1 1 2 TYR CD1 C -2.152 1.181 -1.765 1.00 . A A . 2 TYR CD1 1 1
18 2360 1 1 2 TYR CD2 C -2.436 -1.169 -2.296 1.00 . A A . 2 TYR CD2 1 1
18 2361 1 1 2 TYR CE1 C -0.937 1.191 -2.459 1.00 . A A . 2 TYR CE1 1 1
18 2362 1 1 2 TYR CE2 C -1.220 -1.157 -2.990 1.00 . A A . 2 TYR CE2 1 1
18 2363 1 1 2 TYR CG C -2.903 0.001 -1.683 1.00 . A A . 2 TYR CG 1 1
18 2364 1 1 2 TYR CZ C -0.471 0.022 -3.071 1.00 . A A . 2 TYR CZ 1 1
18 2365 1 1 2 TYR H H -6.008 0.137 0.966 1.00 . A A . 2 TYR H 1 1
18 2366 1 1 2 TYR HA H -3.474 -1.324 0.598 1.00 . A A . 2 TYR HA 1 1
18 2367 1 1 2 TYR HB2 H -4.872 -0.749 -1.368 1.00 . A A . 2 TYR HB2 1 1
18 2368 1 1 2 TYR HB3 H -4.674 0.964 -0.996 1.00 . A A . 2 TYR HB3 1 1
18 2369 1 1 2 TYR HD1 H -2.512 2.083 -1.292 1.00 . A A . 2 TYR HD1 1 1
18 2370 1 1 2 TYR HD2 H -3.015 -2.080 -2.235 1.00 . A A . 2 TYR HD2 1 1
18 2371 1 1 2 TYR HE1 H -0.359 2.101 -2.522 1.00 . A A . 2 TYR HE1 1 1
18 2372 1 1 2 TYR HE2 H -0.860 -2.060 -3.463 1.00 . A A . 2 TYR HE2 1 1
18 2373 1 1 2 TYR HH H 1.258 0.757 -3.411 1.00 . A A . 2 TYR HH 1 1
18 2374 1 1 2 TYR N N -5.251 -0.405 1.272 1.00 . A A . 2 TYR N 1 1
18 2375 1 1 2 TYR O O -3.524 1.658 1.751 1.00 . A A . 2 TYR O 1 1
18 2376 1 1 2 TYR OH O 0.729 0.033 -3.754 1.00 . A A . 2 TYR OH 1 1
18 2377 1 1 3 ASP C C 0.073 2.111 0.542 1.00 . A A . 3 ASP C 1 1
18 2378 1 1 3 ASP CA C -0.838 1.549 1.642 1.00 . A A . 3 ASP CA 1 1
18 2379 1 1 3 ASP CB C 0.022 0.876 2.714 1.00 . A A . 3 ASP CB 1 1
18 2380 1 1 3 ASP CG C 0.866 1.933 3.428 1.00 . A A . 3 ASP CG 1 1
18 2381 1 1 3 ASP H H -1.408 -0.232 0.572 1.00 . A A . 3 ASP H 1 1
18 2382 1 1 3 ASP HA H -1.410 2.344 2.090 1.00 . A A . 3 ASP HA 1 1
18 2383 1 1 3 ASP HB2 H -0.619 0.382 3.431 1.00 . A A . 3 ASP HB2 1 1
18 2384 1 1 3 ASP HB3 H 0.674 0.150 2.252 1.00 . A A . 3 ASP HB3 1 1
18 2385 1 1 3 ASP N N -1.765 0.546 1.049 1.00 . A A . 3 ASP N 1 1
18 2386 1 1 3 ASP O O 0.844 1.380 -0.047 1.00 . A A . 3 ASP O 1 1
18 2387 1 1 3 ASP OD1 O 0.497 3.094 3.373 1.00 . A A . 3 ASP OD1 1 1
18 2388 1 1 3 ASP OD2 O 1.867 1.563 4.019 1.00 . A A . 3 ASP OD2 1 1
18 2389 1 1 4 PRO C C 2.189 4.320 -0.208 1.00 . A A . 4 PRO C 1 1
18 2390 1 1 4 PRO CA C 0.771 4.073 -0.731 1.00 . A A . 4 PRO CA 1 1
18 2391 1 1 4 PRO CB C 0.033 5.395 -0.958 1.00 . A A . 4 PRO CB 1 1
18 2392 1 1 4 PRO CD C -0.975 4.287 1.011 1.00 . A A . 4 PRO CD 1 1
18 2393 1 1 4 PRO CG C -0.802 5.652 0.317 1.00 . A A . 4 PRO CG 1 1
18 2394 1 1 4 PRO HA H 0.793 3.499 -1.642 1.00 . A A . 4 PRO HA 1 1
18 2395 1 1 4 PRO HB2 H 0.745 6.196 -1.108 1.00 . A A . 4 PRO HB2 1 1
18 2396 1 1 4 PRO HB3 H -0.621 5.313 -1.812 1.00 . A A . 4 PRO HB3 1 1
18 2397 1 1 4 PRO HD2 H -0.709 4.360 2.057 1.00 . A A . 4 PRO HD2 1 1
18 2398 1 1 4 PRO HD3 H -1.987 3.930 0.899 1.00 . A A . 4 PRO HD3 1 1
18 2399 1 1 4 PRO HG2 H -0.279 6.340 0.970 1.00 . A A . 4 PRO HG2 1 1
18 2400 1 1 4 PRO HG3 H -1.768 6.051 0.054 1.00 . A A . 4 PRO HG3 1 1
18 2401 1 1 4 PRO N N -0.039 3.395 0.296 1.00 . A A . 4 PRO N 1 1
18 2402 1 1 4 PRO O O 3.073 4.712 -0.943 1.00 . A A . 4 PRO O 1 1
18 2403 1 1 5 GLU C C 4.678 3.145 1.215 1.00 . A A . 5 GLU C 1 1
18 2404 1 1 5 GLU CA C 3.770 4.304 1.630 1.00 . A A . 5 GLU CA 1 1
18 2405 1 1 5 GLU CB C 3.677 4.362 3.157 1.00 . A A . 5 GLU CB 1 1
18 2406 1 1 5 GLU CD C 3.914 6.793 3.691 1.00 . A A . 5 GLU CD 1 1
18 2407 1 1 5 GLU CG C 4.627 5.439 3.686 1.00 . A A . 5 GLU CG 1 1
18 2408 1 1 5 GLU H H 1.683 3.770 1.631 1.00 . A A . 5 GLU H 1 1
18 2409 1 1 5 GLU HA H 4.175 5.232 1.256 1.00 . A A . 5 GLU HA 1 1
18 2410 1 1 5 GLU HB2 H 2.663 4.601 3.446 1.00 . A A . 5 GLU HB2 1 1
18 2411 1 1 5 GLU HB3 H 3.955 3.406 3.572 1.00 . A A . 5 GLU HB3 1 1
18 2412 1 1 5 GLU HG2 H 4.931 5.188 4.693 1.00 . A A . 5 GLU HG2 1 1
18 2413 1 1 5 GLU HG3 H 5.498 5.495 3.050 1.00 . A A . 5 GLU HG3 1 1
18 2414 1 1 5 GLU N N 2.410 4.089 1.057 1.00 . A A . 5 GLU N 1 1
18 2415 1 1 5 GLU O O 5.839 3.330 0.907 1.00 . A A . 5 GLU O 1 1
18 2416 1 1 5 GLU OE1 O 2.792 6.847 4.168 1.00 . A A . 5 GLU OE1 1 1
18 2417 1 1 5 GLU OE2 O 4.502 7.752 3.220 1.00 . A A . 5 GLU OE2 1 1
18 2418 1 1 6 THR C C 4.385 0.159 -0.469 1.00 . A A . 6 THR C 1 1
18 2419 1 1 6 THR CA C 4.980 0.776 0.798 1.00 . A A . 6 THR CA 1 1
18 2420 1 1 6 THR CB C 4.977 -0.264 1.921 1.00 . A A . 6 THR CB 1 1
18 2421 1 1 6 THR CG2 C 5.538 -1.587 1.398 1.00 . A A . 6 THR CG2 1 1
18 2422 1 1 6 THR H H 3.214 1.824 1.446 1.00 . A A . 6 THR H 1 1
18 2423 1 1 6 THR HA H 5.993 1.096 0.602 1.00 . A A . 6 THR HA 1 1
18 2424 1 1 6 THR HB H 3.966 -0.419 2.266 1.00 . A A . 6 THR HB 1 1
18 2425 1 1 6 THR HG1 H 6.428 0.813 2.642 1.00 . A A . 6 THR HG1 1 1
18 2426 1 1 6 THR HG21 H 5.536 -2.319 2.191 1.00 . A A . 6 THR HG21 1 1
18 2427 1 1 6 THR HG22 H 6.549 -1.436 1.050 1.00 . A A . 6 THR HG22 1 1
18 2428 1 1 6 THR HG23 H 4.925 -1.940 0.582 1.00 . A A . 6 THR HG23 1 1
18 2429 1 1 6 THR N N 4.155 1.949 1.199 1.00 . A A . 6 THR N 1 1
18 2430 1 1 6 THR O O 5.054 0.005 -1.472 1.00 . A A . 6 THR O 1 1
18 2431 1 1 6 THR OG1 O 5.779 0.201 2.998 1.00 . A A . 6 THR OG1 1 1
18 2432 1 1 7 GLY C C 2.199 -2.277 -1.369 1.00 . A A . 7 GLY C 1 1
18 2433 1 1 7 GLY CA C 2.485 -0.797 -1.630 1.00 . A A . 7 GLY CA 1 1
18 2434 1 1 7 GLY H H 2.608 -0.058 0.388 1.00 . A A . 7 GLY H 1 1
18 2435 1 1 7 GLY HA2 H 1.559 -0.280 -1.837 1.00 . A A . 7 GLY HA2 1 1
18 2436 1 1 7 GLY HA3 H 3.147 -0.706 -2.478 1.00 . A A . 7 GLY HA3 1 1
18 2437 1 1 7 GLY N N 3.130 -0.193 -0.431 1.00 . A A . 7 GLY N 1 1
18 2438 1 1 7 GLY O O 2.976 -3.141 -1.722 1.00 . A A . 7 GLY O 1 1
18 2439 1 1 8 THR C C -0.752 -4.157 -0.308 1.00 . A A . 8 THR C 1 1
18 2440 1 1 8 THR CA C 0.751 -4.003 -0.478 1.00 . A A . 8 THR CA 1 1
18 2441 1 1 8 THR CB C 1.453 -4.464 0.798 1.00 . A A . 8 THR CB 1 1
18 2442 1 1 8 THR CG2 C 1.672 -5.976 0.734 1.00 . A A . 8 THR CG2 1 1
18 2443 1 1 8 THR H H 0.469 -1.867 -0.481 1.00 . A A . 8 THR H 1 1
18 2444 1 1 8 THR HA H 1.067 -4.615 -1.304 1.00 . A A . 8 THR HA 1 1
18 2445 1 1 8 THR HB H 0.836 -4.232 1.651 1.00 . A A . 8 THR HB 1 1
18 2446 1 1 8 THR HG1 H 3.330 -4.241 0.339 1.00 . A A . 8 THR HG1 1 1
18 2447 1 1 8 THR HG21 H 2.470 -6.197 0.040 1.00 . A A . 8 THR HG21 1 1
18 2448 1 1 8 THR HG22 H 0.763 -6.457 0.403 1.00 . A A . 8 THR HG22 1 1
18 2449 1 1 8 THR HG23 H 1.935 -6.344 1.715 1.00 . A A . 8 THR HG23 1 1
18 2450 1 1 8 THR N N 1.085 -2.577 -0.756 1.00 . A A . 8 THR N 1 1
18 2451 1 1 8 THR O O -1.441 -3.248 0.108 1.00 . A A . 8 THR O 1 1
18 2452 1 1 8 THR OG1 O 2.704 -3.802 0.919 1.00 . A A . 8 THR OG1 1 1
18 2453 1 1 9 TRP C C -3.011 -6.343 0.749 1.00 . A A . 9 TRP C 1 1
18 2454 1 1 9 TRP CA C -2.715 -5.526 -0.511 1.00 . A A . 9 TRP CA 1 1
18 2455 1 1 9 TRP CB C -3.215 -6.279 -1.741 1.00 . A A . 9 TRP CB 1 1
18 2456 1 1 9 TRP CD1 C -4.104 -5.327 -3.897 1.00 . A A . 9 TRP CD1 1 1
18 2457 1 1 9 TRP CD2 C -5.009 -4.366 -2.081 1.00 . A A . 9 TRP CD2 1 1
18 2458 1 1 9 TRP CE2 C -5.603 -3.743 -3.202 1.00 . A A . 9 TRP CE2 1 1
18 2459 1 1 9 TRP CE3 C -5.399 -3.947 -0.800 1.00 . A A . 9 TRP CE3 1 1
18 2460 1 1 9 TRP CG C -4.071 -5.369 -2.549 1.00 . A A . 9 TRP CG 1 1
18 2461 1 1 9 TRP CH2 C -6.934 -2.325 -1.771 1.00 . A A . 9 TRP CH2 1 1
18 2462 1 1 9 TRP CZ2 C -6.556 -2.733 -3.055 1.00 . A A . 9 TRP CZ2 1 1
18 2463 1 1 9 TRP CZ3 C -6.355 -2.930 -0.645 1.00 . A A . 9 TRP CZ3 1 1
18 2464 1 1 9 TRP H H -0.696 -6.017 -0.979 1.00 . A A . 9 TRP H 1 1
18 2465 1 1 9 TRP HA H -3.200 -4.572 -0.451 1.00 . A A . 9 TRP HA 1 1
18 2466 1 1 9 TRP HB2 H -2.372 -6.604 -2.333 1.00 . A A . 9 TRP HB2 1 1
18 2467 1 1 9 TRP HB3 H -3.792 -7.137 -1.429 1.00 . A A . 9 TRP HB3 1 1
18 2468 1 1 9 TRP HD1 H -3.517 -5.947 -4.556 1.00 . A A . 9 TRP HD1 1 1
18 2469 1 1 9 TRP HE1 H -5.237 -4.137 -5.217 1.00 . A A . 9 TRP HE1 1 1
18 2470 1 1 9 TRP HE3 H -4.951 -4.409 0.070 1.00 . A A . 9 TRP HE3 1 1
18 2471 1 1 9 TRP HH2 H -7.670 -1.544 -1.647 1.00 . A A . 9 TRP HH2 1 1
18 2472 1 1 9 TRP HZ2 H -6.997 -2.270 -3.925 1.00 . A A . 9 TRP HZ2 1 1
18 2473 1 1 9 TRP HZ3 H -6.649 -2.614 0.345 1.00 . A A . 9 TRP HZ3 1 1
18 2474 1 1 9 TRP N N -1.264 -5.305 -0.639 1.00 . A A . 9 TRP N 1 1
18 2475 1 1 9 TRP NE1 N -5.018 -4.364 -4.289 1.00 . A A . 9 TRP NE1 1 1
18 2476 1 1 9 TRP O O -3.232 -7.536 0.688 1.00 . A A . 9 TRP O 1 1
18 2477 1 1 10 GLY C C -3.991 -5.521 4.147 1.00 . A A . 10 GLY C 1 1
18 2478 1 1 10 GLY CA C -3.303 -6.453 3.150 1.00 . A A . 10 GLY CA 1 1
18 2479 1 1 10 GLY H H -2.839 -4.748 1.918 1.00 . A A . 10 GLY H 1 1
18 2480 1 1 10 GLY HA2 H -3.950 -7.293 2.934 1.00 . A A . 10 GLY HA2 1 1
18 2481 1 1 10 GLY HA3 H -2.378 -6.811 3.574 1.00 . A A . 10 GLY HA3 1 1
18 2482 1 1 10 GLY N N -3.018 -5.711 1.890 1.00 . A A . 10 GLY N 1 1
18 2483 1 1 10 GLY O O -4.661 -4.603 3.705 1.00 . A A . 10 GLY O 1 1
18 2484 1 1 10 GLY OXT O -3.835 -5.740 5.337 1.00 . A A . 10 GLY OXT 1 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, May 15, 2024 7:28:05 PM GMT (wattos1)