Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
418257 | 2e4e RC | 15107 | cing | 4-filtered-FRED | STAR | entry | full | 113 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2e4e
# This FRED archive file contains, for PDB entry <2e4e>:
#
# - 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_2e4e
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2e4e
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 984.00
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 $GPM12 A . 1 1
stop_
save_
save_GPM12
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name GPM12
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GYDPATGTFG
_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 ALA . 1 1
6 THR . 1 1
7 GLY . 1 1
8 THR . 1 1
9 PHE . 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
ALA 5 5 1 1
THR 6 6 1 1
GLY 7 7 1 1
THR 8 8 1 1
PHE 9 9 1 1
GLY 10 10 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
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 2 TYR QD . 2 . HD# 1 1
3 1 1 1 1 2 TYR H . 2 . HN 1 1
3 1 2 1 1 2 TYR HA . 2 . HA 1 1
4 1 1 1 1 2 TYR H . 2 . HN 1 1
4 1 2 1 1 2 TYR HB2 . 2 . HB2 1 1
5 1 1 1 1 2 TYR H . 2 . HN 1 1
5 1 2 1 1 2 TYR HB3 . 2 . HB1 1 1
6 1 1 1 1 2 TYR H . 2 . HN 1 1
6 1 2 1 1 2 TYR QD . 2 . HD# 1 1
7 1 1 1 1 2 TYR H . 2 . HN 1 1
7 1 2 1 1 3 ASP H . 3 . HN 1 1
8 1 1 1 1 2 TYR HA . 2 . HA 1 1
8 1 2 1 1 2 TYR HB2 . 2 . HB2 1 1
9 1 1 1 1 2 TYR HA . 2 . HA 1 1
9 1 2 1 1 2 TYR HB3 . 2 . HB1 1 1
10 1 1 1 1 2 TYR HA . 2 . HA 1 1
10 1 2 1 1 2 TYR QD . 2 . HD# 1 1
11 1 1 1 1 2 TYR HA . 2 . HA 1 1
11 1 2 1 1 3 ASP H . 3 . HN 1 1
12 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
12 1 2 1 1 2 TYR QD . 2 . HD# 1 1
13 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1
13 1 2 1 1 9 PHE QE . 9 . HE# 1 1
14 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1
14 1 2 1 1 2 TYR QD . 2 . HD# 1 1
15 1 1 1 1 2 TYR HB3 . 2 . HB1 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 QD . 2 . HD# 1 1
17 1 2 1 1 4 PRO HA . 4 . HA 1 1
18 1 1 1 1 2 TYR QD . 2 . HD# 1 1
18 1 2 1 1 4 PRO QB . 4 . HB# 1 1
19 1 1 1 1 2 TYR QD . 2 . HD# 1 1
19 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
20 1 1 1 1 2 TYR QD . 2 . HD# 1 1
20 1 2 1 1 4 PRO QG . 4 . HG# 1 1
21 1 1 1 1 2 TYR QD . 2 . HD# 1 1
21 1 2 1 1 9 PHE HA . 9 . HA 1 1
22 1 1 1 1 2 TYR QE . 2 . HE# 1 1
22 1 2 1 1 3 ASP H . 3 . HN 1 1
23 1 1 1 1 2 TYR QE . 2 . HE# 1 1
23 1 2 1 1 3 ASP HB3 . 3 . HB1 1 1
24 1 1 1 1 2 TYR QE . 2 . HE# 1 1
24 1 2 1 1 4 PRO HA . 4 . HA 1 1
25 1 1 1 1 2 TYR QE . 2 . HE# 1 1
25 1 2 1 1 4 PRO QB . 4 . HB# 1 1
26 1 1 1 1 2 TYR QE . 2 . HE# 1 1
26 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
27 1 1 1 1 2 TYR QE . 2 . HE# 1 1
27 1 2 1 1 4 PRO QG . 4 . HG# 1 1
28 1 1 1 1 2 TYR QE . 2 . HE# 1 1
28 1 2 1 1 7 GLY HA2 . 7 . HA2 1 1
29 1 1 1 1 2 TYR QE . 2 . HE# 1 1
29 1 2 1 1 7 GLY HA3 . 7 . HA1 1 1
30 1 1 1 1 2 TYR QE . 2 . HE# 1 1
30 1 2 1 1 8 THR HA . 8 . HA 1 1
31 1 1 1 1 2 TYR QE . 2 . HE# 1 1
31 1 2 1 1 9 PHE QD . 9 . HD# 1 1
31 1 2 1 1 9 PHE HZ . 9 . HZ 1 1
32 1 1 1 1 3 ASP H . 3 . HN 1 1
32 1 2 1 1 3 ASP HA . 3 . HA 1 1
33 1 1 1 1 3 ASP H . 3 . HN 1 1
33 1 2 1 1 3 ASP HB2 . 3 . HB2 1 1
34 1 1 1 1 3 ASP H . 3 . HN 1 1
34 1 2 1 1 3 ASP HB3 . 3 . HB1 1 1
35 1 1 1 1 3 ASP H . 3 . HN 1 1
35 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
36 1 1 1 1 3 ASP H . 3 . HN 1 1
36 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
37 1 1 1 1 3 ASP H . 3 . HN 1 1
37 1 2 1 1 9 PHE HA . 9 . HA 1 1
38 1 1 1 1 3 ASP HA . 3 . HA 1 1
38 1 2 1 1 3 ASP HB2 . 3 . HB2 1 1
39 1 1 1 1 3 ASP HA . 3 . HA 1 1
39 1 2 1 1 3 ASP HB3 . 3 . HB1 1 1
40 1 1 1 1 3 ASP HA . 3 . HA 1 1
40 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
41 1 1 1 1 3 ASP HA . 3 . HA 1 1
41 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
42 1 1 1 1 3 ASP HA . 3 . HA 1 1
42 1 2 1 1 5 ALA H . 5 . HN 1 1
43 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
43 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
44 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
44 1 2 1 1 5 ALA H . 5 . HN 1 1
45 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
45 1 2 1 1 6 THR H . 6 . HN 1 1
46 1 1 1 1 3 ASP HB3 . 3 . HB1 1 1
46 1 2 1 1 8 THR H . 8 . HN 1 1
47 1 1 1 1 4 PRO HA . 4 . HA 1 1
47 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
48 1 1 1 1 4 PRO HA . 4 . HA 1 1
48 1 2 1 1 4 PRO QG . 4 . HG# 1 1
49 1 1 1 1 4 PRO HA . 4 . HA 1 1
49 1 2 1 1 5 ALA H . 5 . HN 1 1
50 1 1 1 1 4 PRO HA . 4 . HA 1 1
50 1 2 1 1 6 THR H . 6 . HN 1 1
51 1 1 1 1 4 PRO HA . 4 . HA 1 1
51 1 2 1 1 7 GLY H . 7 . HN 1 1
52 1 1 1 1 4 PRO QB . 4 . HB# 1 1
52 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1
53 1 1 1 1 4 PRO QB . 4 . HB# 1 1
53 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1
54 1 1 1 1 4 PRO QB . 4 . HB# 1 1
54 1 2 1 1 4 PRO QG . 4 . HG# 1 1
55 1 1 1 1 4 PRO QB . 4 . HB# 1 1
55 1 2 1 1 5 ALA H . 5 . HN 1 1
56 1 1 1 1 4 PRO QB . 4 . HB# 1 1
56 1 2 1 1 7 GLY H . 7 . HN 1 1
57 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1
57 1 2 1 1 4 PRO QG . 4 . HG# 1 1
58 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1
58 1 2 1 1 5 ALA H . 5 . HN 1 1
59 1 1 1 1 4 PRO HD3 . 4 . HD1 1 1
59 1 2 1 1 4 PRO QG . 4 . HG# 1 1
60 1 1 1 1 4 PRO QG . 4 . HG# 1 1
60 1 2 1 1 5 ALA H . 5 . HN 1 1
61 1 1 1 1 5 ALA H . 5 . HN 1 1
61 1 2 1 1 5 ALA HA . 5 . HA 1 1
62 1 1 1 1 5 ALA H . 5 . HN 1 1
62 1 2 1 1 5 ALA MB . 5 . HB# 1 1
63 1 1 1 1 5 ALA H . 5 . HN 1 1
63 1 2 1 1 6 THR H . 6 . HN 1 1
64 1 1 1 1 5 ALA H . 5 . HN 1 1
64 1 2 1 1 6 THR MG . 6 . HG2# 1 1
65 1 1 1 1 5 ALA HA . 5 . HA 1 1
65 1 2 1 1 5 ALA MB . 5 . HB# 1 1
66 1 1 1 1 5 ALA MB . 5 . HB# 1 1
66 1 2 1 1 6 THR H . 6 . HN 1 1
67 1 1 1 1 5 ALA MB . 5 . HB# 1 1
67 1 2 1 1 7 GLY H . 7 . HN 1 1
68 1 1 1 1 6 THR H . 6 . HN 1 1
68 1 2 1 1 6 THR HA . 6 . HA 1 1
69 1 1 1 1 6 THR H . 6 . HN 1 1
69 1 2 1 1 6 THR HB . 6 . HB 1 1
70 1 1 1 1 6 THR H . 6 . HN 1 1
70 1 2 1 1 6 THR MG . 6 . HG2# 1 1
71 1 1 1 1 6 THR H . 6 . HN 1 1
71 1 2 1 1 7 GLY H . 7 . HN 1 1
72 1 1 1 1 6 THR HA . 6 . HA 1 1
72 1 2 1 1 6 THR HB . 6 . HB 1 1
73 1 1 1 1 6 THR HA . 6 . HA 1 1
73 1 2 1 1 6 THR MG . 6 . HG2# 1 1
74 1 1 1 1 6 THR HA . 6 . HA 1 1
74 1 2 1 1 7 GLY H . 7 . HN 1 1
75 1 1 1 1 6 THR HB . 6 . HB 1 1
75 1 2 1 1 6 THR MG . 6 . HG2# 1 1
76 1 1 1 1 6 THR HB . 6 . HB 1 1
76 1 2 1 1 7 GLY H . 7 . HN 1 1
77 1 1 1 1 6 THR HB . 6 . HB 1 1
77 1 2 1 1 8 THR H . 8 . HN 1 1
78 1 1 1 1 6 THR MG . 6 . HG2# 1 1
78 1 2 1 1 7 GLY H . 7 . HN 1 1
79 1 1 1 1 7 GLY H . 7 . HN 1 1
79 1 2 1 1 7 GLY HA2 . 7 . HA2 1 1
80 1 1 1 1 7 GLY H . 7 . HN 1 1
80 1 2 1 1 7 GLY HA3 . 7 . HA1 1 1
81 1 1 1 1 7 GLY H . 7 . HN 1 1
81 1 2 1 1 8 THR H . 8 . HN 1 1
82 1 1 1 1 7 GLY HA2 . 7 . HA2 1 1
82 1 2 1 1 8 THR H . 8 . HN 1 1
83 1 1 1 1 7 GLY HA3 . 7 . HA1 1 1
83 1 2 1 1 8 THR H . 8 . HN 1 1
84 1 1 1 1 8 THR H . 8 . HN 1 1
84 1 2 1 1 8 THR HA . 8 . HA 1 1
85 1 1 1 1 8 THR H . 8 . HN 1 1
85 1 2 1 1 8 THR HB . 8 . HB 1 1
86 1 1 1 1 8 THR H . 8 . HN 1 1
86 1 2 1 1 8 THR MG . 8 . HG2# 1 1
87 1 1 1 1 8 THR H . 8 . HN 1 1
87 1 2 1 1 9 PHE H . 9 . HN 1 1
88 1 1 1 1 8 THR HA . 8 . HA 1 1
88 1 2 1 1 8 THR HB . 8 . HB 1 1
89 1 1 1 1 8 THR HA . 8 . HA 1 1
89 1 2 1 1 8 THR MG . 8 . HG2# 1 1
90 1 1 1 1 8 THR HA . 8 . HA 1 1
90 1 2 1 1 9 PHE H . 9 . HN 1 1
91 1 1 1 1 8 THR HA . 8 . HA 1 1
91 1 2 1 1 9 PHE QD . 9 . HD# 1 1
91 1 2 1 1 9 PHE HZ . 9 . HZ 1 1
92 1 1 1 1 8 THR HA . 8 . HA 1 1
92 1 2 1 1 10 GLY H . 10 . HN 1 1
93 1 1 1 1 8 THR HB . 8 . HB 1 1
93 1 2 1 1 8 THR MG . 8 . HG2# 1 1
94 1 1 1 1 8 THR HB . 8 . HB 1 1
94 1 2 1 1 9 PHE H . 9 . HN 1 1
95 1 1 1 1 8 THR MG . 8 . HG2# 1 1
95 1 2 1 1 9 PHE H . 9 . HN 1 1
96 1 1 1 1 8 THR MG . 8 . HG2# 1 1
96 1 2 1 1 10 GLY H . 10 . HN 1 1
97 1 1 1 1 9 PHE H . 9 . HN 1 1
97 1 2 1 1 9 PHE HA . 9 . HA 1 1
98 1 1 1 1 9 PHE H . 9 . HN 1 1
98 1 2 1 1 9 PHE HB2 . 9 . HB2 1 1
99 1 1 1 1 9 PHE H . 9 . HN 1 1
99 1 2 1 1 9 PHE HB3 . 9 . HB1 1 1
100 1 1 1 1 9 PHE H . 9 . HN 1 1
100 1 2 1 1 9 PHE QD . 9 . HD# 1 1
100 1 2 1 1 9 PHE HZ . 9 . HZ 1 1
101 1 1 1 1 9 PHE H . 9 . HN 1 1
101 1 2 1 1 10 GLY H . 10 . HN 1 1
102 1 1 1 1 9 PHE HA . 9 . HA 1 1
102 1 2 1 1 9 PHE HB2 . 9 . HB2 1 1
103 1 1 1 1 9 PHE HA . 9 . HA 1 1
103 1 2 1 1 9 PHE HB3 . 9 . HB1 1 1
104 1 1 1 1 9 PHE HA . 9 . HA 1 1
104 1 2 1 1 9 PHE QD . 9 . HD# 1 1
104 1 2 1 1 9 PHE HZ . 9 . HZ 1 1
105 1 1 1 1 9 PHE HA . 9 . HA 1 1
105 1 2 1 1 9 PHE QE . 9 . HE# 1 1
106 1 1 1 1 9 PHE HA . 9 . HA 1 1
106 1 2 1 1 10 GLY H . 10 . HN 1 1
107 1 1 1 1 9 PHE HB2 . 9 . HB2 1 1
107 1 2 1 1 9 PHE QD . 9 . HD# 1 1
107 1 2 1 1 9 PHE HZ . 9 . HZ 1 1
108 1 1 1 1 9 PHE HB2 . 9 . HB2 1 1
108 1 2 1 1 9 PHE QE . 9 . HE# 1 1
109 1 1 1 1 9 PHE HB2 . 9 . HB2 1 1
109 1 2 1 1 10 GLY H . 10 . HN 1 1
110 1 1 1 1 9 PHE HB3 . 9 . HB1 1 1
110 1 2 1 1 9 PHE QD . 9 . HD# 1 1
110 1 2 1 1 9 PHE HZ . 9 . HZ 1 1
111 1 1 1 1 9 PHE HB3 . 9 . HB1 1 1
111 1 2 1 1 9 PHE QE . 9 . HE# 1 1
112 1 1 1 1 9 PHE HB3 . 9 . HB1 1 1
112 1 2 1 1 10 GLY H . 10 . HN 1 1
113 1 1 1 1 10 GLY H . 10 . HN 1 1
113 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 . . . . . 2.0 1.5 2.8 1 1
2 1 . . . . . 5.0 2.5 6.0 1 1
3 1 . . . . . 2.0 1.5 2.8 1 1
4 1 . . . . . 2.0 1.5 2.8 1 1
5 1 . . . . . 2.0 1.5 2.8 1 1
6 1 . . . . . 3.5 2.0 4.5 1 1
7 1 . . . . . 3.5 2.0 4.5 1 1
8 1 . . . . . 2.5 1.5 3.5 1 1
9 1 . . . . . 2.5 1.5 3.5 1 1
10 1 . . . . . 2.0 1.5 2.8 1 1
11 1 . . . . . 2.0 1.5 2.8 1 1
12 1 . . . . . 2.0 1.5 2.8 1 1
13 1 . . . . . 2.5 1.5 3.5 1 1
14 1 . . . . . 2.0 1.5 2.8 1 1
15 1 . . . . . 3.5 2.0 4.5 1 1
16 1 . . . . . 2.5 1.5 3.5 1 1
17 1 . . . . . 3.5 2.0 4.5 1 1
18 1 . . . . . 2.5 1.5 3.5 1 1
19 1 . . . . . 2.5 1.5 3.5 1 1
20 1 . . . . . 5.0 2.5 6.0 1 1
21 1 . . . . . 3.5 2.0 4.5 1 1
22 1 . . . . . 5.0 2.5 6.0 1 1
23 1 . . . . . 5.0 2.5 6.0 1 1
24 1 . . . . . 2.5 1.5 3.5 1 1
25 1 . . . . . 3.5 2.0 4.5 1 1
26 1 . . . . . 5.0 2.5 6.0 1 1
27 1 . . . . . 2.5 1.5 3.5 1 1
28 1 . . . . . 2.5 1.5 3.5 1 1
29 1 . . . . . 5.0 2.5 6.0 1 1
30 1 . . . . . 3.5 2.0 4.5 1 1
31 1 . . . . . 2.5 1.5 3.5 1 1
32 1 . . . . . 2.0 1.5 2.8 1 1
33 1 . . . . . 2.0 1.5 2.8 1 1
34 1 . . . . . 2.0 1.5 2.8 1 1
35 1 . . . . . 5.0 2.5 6.0 1 1
36 1 . . . . . 5.0 2.5 6.0 1 1
37 1 . . . . . 3.5 2.0 4.5 1 1
38 1 . . . . . 2.5 1.5 3.5 1 1
39 1 . . . . . 2.5 1.5 3.5 1 1
40 1 . . . . . 2.0 1.5 2.8 1 1
41 1 . . . . . 2.0 1.5 2.8 1 1
42 1 . . . . . 3.5 2.0 4.5 1 1
43 1 . . . . . 5.0 2.5 6.0 1 1
44 1 . . . . . 3.5 2.0 4.5 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 . . . . . 2.0 1.5 2.8 1 1
49 1 . . . . . 2.5 1.5 3.5 1 1
50 1 . . . . . 5.0 2.5 6.0 1 1
51 1 . . . . . 2.5 1.5 3.5 1 1
52 1 . . . . . 2.0 1.5 2.8 1 1
53 1 . . . . . 2.5 1.5 3.5 1 1
54 1 . . . . . 2.0 1.5 2.8 1 1
55 1 . . . . . 2.0 1.5 2.8 1 1
56 1 . . . . . 5.0 2.5 6.0 1 1
57 1 . . . . . 5.0 2.5 6.0 1 1
58 1 . . . . . 2.5 1.5 3.5 1 1
59 1 . . . . . 2.5 1.5 3.5 1 1
60 1 . . . . . 5.0 2.5 6.0 1 1
61 1 . . . . . 2.0 1.5 2.8 1 1
62 1 . . . . . 2.0 1.5 2.8 1 1
63 1 . . . . . 2.0 1.5 2.8 1 1
64 1 . . . . . 5.0 2.5 6.0 1 1
65 1 . . . . . 2.0 1.5 2.8 1 1
66 1 . . . . . 2.5 1.5 3.5 1 1
67 1 . . . . . 3.5 2.0 4.5 1 1
68 1 . . . . . 2.0 1.5 2.8 1 1
69 1 . . . . . 2.0 1.5 2.8 1 1
70 1 . . . . . 2.5 1.5 3.5 1 1
71 1 . . . . . 2.0 1.5 2.8 1 1
72 1 . . . . . 2.5 1.5 3.5 1 1
73 1 . . . . . 2.0 1.5 2.8 1 1
74 1 . . . . . 2.5 1.5 3.5 1 1
75 1 . . . . . 2.0 1.5 2.8 1 1
76 1 . . . . . 2.5 1.5 3.5 1 1
77 1 . . . . . 3.5 2.0 4.5 1 1
78 1 . . . . . 2.5 1.5 3.5 1 1
79 1 . . . . . 2.0 1.5 2.8 1 1
80 1 . . . . . 2.0 1.5 2.8 1 1
81 1 . . . . . 2.0 1.5 2.8 1 1
82 1 . . . . . 2.0 1.5 2.8 1 1
83 1 . . . . . 2.5 1.5 3.5 1 1
84 1 . . . . . 2.0 1.5 2.8 1 1
85 1 . . . . . 2.0 1.5 2.8 1 1
86 1 . . . . . 2.5 1.5 3.5 1 1
87 1 . . . . . 2.5 1.5 3.5 1 1
88 1 . . . . . 2.5 1.5 3.5 1 1
89 1 . . . . . 2.0 1.5 2.8 1 1
90 1 . . . . . 2.0 1.5 2.8 1 1
91 1 . . . . . 2.5 1.5 3.5 1 1
92 1 . . . . . 5.0 2.5 6.0 1 1
93 1 . . . . . 2.0 1.5 2.8 1 1
94 1 . . . . . 2.0 1.5 2.8 1 1
95 1 . . . . . 2.5 1.5 3.5 1 1
96 1 . . . . . 5.0 2.5 6.0 1 1
97 1 . . . . . 2.0 1.5 2.8 1 1
98 1 . . . . . 2.5 1.5 3.5 1 1
99 1 . . . . . 2.5 1.5 3.5 1 1
100 1 . . . . . 2.5 1.5 3.5 1 1
101 1 . . . . . 2.5 1.5 3.5 1 1
102 1 . . . . . 2.5 1.5 3.5 1 1
103 1 . . . . . 2.5 1.5 3.5 1 1
104 1 . . . . . 2.5 1.5 3.5 1 1
105 1 . . . . . 5.0 2.5 6.0 1 1
106 1 . . . . . 2.0 1.5 2.8 1 1
107 1 . . . . . 2.0 1.5 2.8 1 1
108 1 . . . . . 3.5 2.0 4.5 1 1
109 1 . . . . . 2.5 1.5 3.5 1 1
110 1 . . . . . 2.0 1.5 2.8 1 1
111 1 . . . . . 3.5 2.0 4.5 1 1
112 1 . . . . . 3.5 2.0 4.5 1 1
113 1 . . . . . 2.0 1.5 2.8 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 -1.307 -5.155 0.383 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C -1.570 -6.645 0.308 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H 0.285 -7.516 -0.100 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY H2 H -0.672 -8.413 0.968 1.00 . A A . 1 GLY H2 1 1
1 5 1 1 1 GLY H3 H 0.105 -7.010 1.504 1.00 . A A . 1 GLY H3 1 1
1 6 1 1 1 GLY HA2 H -1.849 -6.900 -0.703 1.00 . A A . 1 GLY HA2 1 1
1 7 1 1 1 GLY HA3 H -2.388 -6.890 0.969 1.00 . A A . 1 GLY HA3 1 1
1 8 1 1 1 GLY N N -0.381 -7.452 0.697 1.00 . A A . 1 GLY N 1 1
1 9 1 1 1 GLY O O -1.508 -4.433 -0.594 1.00 . A A . 1 GLY O 1 1
1 10 1 1 2 TYR C C 0.530 -2.813 0.797 1.00 . A A . 2 TYR C 1 1
1 11 1 1 2 TYR CA C -0.566 -3.279 1.743 1.00 . A A . 2 TYR CA 1 1
1 12 1 1 2 TYR CB C -0.139 -3.019 3.189 1.00 . A A . 2 TYR CB 1 1
1 13 1 1 2 TYR CD1 C -0.841 -0.667 3.771 1.00 . A A . 2 TYR CD1 1 1
1 14 1 1 2 TYR CD2 C 1.481 -1.090 3.437 1.00 . A A . 2 TYR CD2 1 1
1 15 1 1 2 TYR CE1 C -0.566 0.663 4.026 1.00 . A A . 2 TYR CE1 1 1
1 16 1 1 2 TYR CE2 C 1.765 0.236 3.691 1.00 . A A . 2 TYR CE2 1 1
1 17 1 1 2 TYR CG C 0.174 -1.565 3.473 1.00 . A A . 2 TYR CG 1 1
1 18 1 1 2 TYR CZ C 0.740 1.109 3.985 1.00 . A A . 2 TYR CZ 1 1
1 19 1 1 2 TYR H H -0.717 -5.314 2.285 1.00 . A A . 2 TYR H 1 1
1 20 1 1 2 TYR HA H -1.467 -2.720 1.538 1.00 . A A . 2 TYR HA 1 1
1 21 1 1 2 TYR HB2 H -0.937 -3.322 3.853 1.00 . A A . 2 TYR HB2 1 1
1 22 1 1 2 TYR HB3 H 0.744 -3.599 3.407 1.00 . A A . 2 TYR HB3 1 1
1 23 1 1 2 TYR HD1 H -1.860 -1.019 3.800 1.00 . A A . 2 TYR HD1 1 1
1 24 1 1 2 TYR HD2 H 2.284 -1.773 3.207 1.00 . A A . 2 TYR HD2 1 1
1 25 1 1 2 TYR HE1 H -1.369 1.346 4.257 1.00 . A A . 2 TYR HE1 1 1
1 26 1 1 2 TYR HE2 H 2.788 0.583 3.656 1.00 . A A . 2 TYR HE2 1 1
1 27 1 1 2 TYR HH H 1.827 2.498 4.753 1.00 . A A . 2 TYR HH 1 1
1 28 1 1 2 TYR N N -0.857 -4.692 1.545 1.00 . A A . 2 TYR N 1 1
1 29 1 1 2 TYR O O 1.589 -3.430 0.707 1.00 . A A . 2 TYR O 1 1
1 30 1 1 2 TYR OH O 1.019 2.433 4.238 1.00 . A A . 2 TYR OH 1 1
1 31 1 1 3 ASP C C 2.107 -0.122 -0.107 1.00 . A A . 3 ASP C 1 1
1 32 1 1 3 ASP CA C 1.229 -1.141 -0.828 1.00 . A A . 3 ASP CA 1 1
1 33 1 1 3 ASP CB C 0.505 -0.473 -1.998 1.00 . A A . 3 ASP CB 1 1
1 34 1 1 3 ASP CG C 1.338 -0.464 -3.264 1.00 . A A . 3 ASP CG 1 1
1 35 1 1 3 ASP H H -0.588 -1.269 0.228 1.00 . A A . 3 ASP H 1 1
1 36 1 1 3 ASP HA H 1.840 -1.941 -1.200 1.00 . A A . 3 ASP HA 1 1
1 37 1 1 3 ASP HB2 H -0.413 -1.008 -2.198 1.00 . A A . 3 ASP HB2 1 1
1 38 1 1 3 ASP HB3 H 0.272 0.548 -1.733 1.00 . A A . 3 ASP HB3 1 1
1 39 1 1 3 ASP N N 0.268 -1.712 0.103 1.00 . A A . 3 ASP N 1 1
1 40 1 1 3 ASP O O 1.659 0.983 0.196 1.00 . A A . 3 ASP O 1 1
1 41 1 1 3 ASP OD1 O 2.286 -1.271 -3.360 1.00 . A A . 3 ASP OD1 1 1
1 42 1 1 3 ASP OD2 O 1.042 0.353 -4.164 1.00 . A A . 3 ASP OD2 1 1
1 43 1 1 4 PRO C C 4.825 1.530 0.068 1.00 . A A . 4 PRO C 1 1
1 44 1 1 4 PRO CA C 4.283 0.397 0.932 1.00 . A A . 4 PRO CA 1 1
1 45 1 1 4 PRO CB C 5.424 -0.534 1.362 1.00 . A A . 4 PRO CB 1 1
1 46 1 1 4 PRO CD C 3.992 -1.776 -0.066 1.00 . A A . 4 PRO CD 1 1
1 47 1 1 4 PRO CG C 4.908 -1.903 1.123 1.00 . A A . 4 PRO CG 1 1
1 48 1 1 4 PRO HA H 3.815 0.802 1.808 1.00 . A A . 4 PRO HA 1 1
1 49 1 1 4 PRO HB2 H 6.303 -0.334 0.771 1.00 . A A . 4 PRO HB2 1 1
1 50 1 1 4 PRO HB3 H 5.635 -0.376 2.409 1.00 . A A . 4 PRO HB3 1 1
1 51 1 1 4 PRO HD2 H 4.548 -1.746 -1.000 1.00 . A A . 4 PRO HD2 1 1
1 52 1 1 4 PRO HD3 H 3.267 -2.569 -0.074 1.00 . A A . 4 PRO HD3 1 1
1 53 1 1 4 PRO HG2 H 5.727 -2.584 0.929 1.00 . A A . 4 PRO HG2 1 1
1 54 1 1 4 PRO HG3 H 4.351 -2.218 1.988 1.00 . A A . 4 PRO HG3 1 1
1 55 1 1 4 PRO N N 3.363 -0.485 0.210 1.00 . A A . 4 PRO N 1 1
1 56 1 1 4 PRO O O 5.087 2.629 0.561 1.00 . A A . 4 PRO O 1 1
1 57 1 1 5 ALA C C 4.603 3.476 -2.189 1.00 . A A . 5 ALA C 1 1
1 58 1 1 5 ALA CA C 5.510 2.257 -2.149 1.00 . A A . 5 ALA CA 1 1
1 59 1 1 5 ALA CB C 5.657 1.660 -3.540 1.00 . A A . 5 ALA CB 1 1
1 60 1 1 5 ALA H H 4.769 0.368 -1.552 1.00 . A A . 5 ALA H 1 1
1 61 1 1 5 ALA HA H 6.490 2.558 -1.805 1.00 . A A . 5 ALA HA 1 1
1 62 1 1 5 ALA HB1 H 4.776 1.881 -4.121 1.00 . A A . 5 ALA HB1 1 1
1 63 1 1 5 ALA HB2 H 5.779 0.590 -3.461 1.00 . A A . 5 ALA HB2 1 1
1 64 1 1 5 ALA HB3 H 6.524 2.087 -4.024 1.00 . A A . 5 ALA HB3 1 1
1 65 1 1 5 ALA N N 4.995 1.258 -1.220 1.00 . A A . 5 ALA N 1 1
1 66 1 1 5 ALA O O 5.046 4.603 -1.961 1.00 . A A . 5 ALA O 1 1
1 67 1 1 6 THR C C 1.744 4.558 -1.167 1.00 . A A . 6 THR C 1 1
1 68 1 1 6 THR CA C 2.353 4.302 -2.546 1.00 . A A . 6 THR CA 1 1
1 69 1 1 6 THR CB C 1.272 3.924 -3.556 1.00 . A A . 6 THR CB 1 1
1 70 1 1 6 THR CG2 C 0.053 4.805 -3.493 1.00 . A A . 6 THR CG2 1 1
1 71 1 1 6 THR H H 3.037 2.330 -2.646 1.00 . A A . 6 THR H 1 1
1 72 1 1 6 THR HA H 2.857 5.191 -2.881 1.00 . A A . 6 THR HA 1 1
1 73 1 1 6 THR HB H 0.957 2.908 -3.365 1.00 . A A . 6 THR HB 1 1
1 74 1 1 6 THR HG1 H 1.480 3.224 -5.374 1.00 . A A . 6 THR HG1 1 1
1 75 1 1 6 THR HG21 H -0.252 4.915 -2.465 1.00 . A A . 6 THR HG21 1 1
1 76 1 1 6 THR HG22 H -0.746 4.352 -4.058 1.00 . A A . 6 THR HG22 1 1
1 77 1 1 6 THR HG23 H 0.288 5.773 -3.907 1.00 . A A . 6 THR HG23 1 1
1 78 1 1 6 THR N N 3.330 3.242 -2.476 1.00 . A A . 6 THR N 1 1
1 79 1 1 6 THR O O 1.312 5.669 -0.865 1.00 . A A . 6 THR O 1 1
1 80 1 1 6 THR OG1 O 1.778 3.992 -4.878 1.00 . A A . 6 THR OG1 1 1
1 81 1 1 7 GLY C C -0.327 3.454 1.037 1.00 . A A . 7 GLY C 1 1
1 82 1 1 7 GLY CA C 1.174 3.640 0.995 1.00 . A A . 7 GLY CA 1 1
1 83 1 1 7 GLY H H 2.083 2.662 -0.630 1.00 . A A . 7 GLY H 1 1
1 84 1 1 7 GLY HA2 H 1.626 2.889 1.620 1.00 . A A . 7 GLY HA2 1 1
1 85 1 1 7 GLY HA3 H 1.419 4.613 1.380 1.00 . A A . 7 GLY HA3 1 1
1 86 1 1 7 GLY N N 1.720 3.519 -0.337 1.00 . A A . 7 GLY N 1 1
1 87 1 1 7 GLY O O -1.019 4.082 1.839 1.00 . A A . 7 GLY O 1 1
1 88 1 1 8 THR C C -2.445 0.850 0.525 1.00 . A A . 8 THR C 1 1
1 89 1 1 8 THR CA C -2.212 2.286 0.091 1.00 . A A . 8 THR CA 1 1
1 90 1 1 8 THR CB C -2.665 2.525 -1.349 1.00 . A A . 8 THR CB 1 1
1 91 1 1 8 THR CG2 C -4.084 3.001 -1.440 1.00 . A A . 8 THR CG2 1 1
1 92 1 1 8 THR H H -0.247 2.117 -0.430 1.00 . A A . 8 THR H 1 1
1 93 1 1 8 THR HA H -2.749 2.936 0.740 1.00 . A A . 8 THR HA 1 1
1 94 1 1 8 THR HB H -2.582 1.605 -1.906 1.00 . A A . 8 THR HB 1 1
1 95 1 1 8 THR HG1 H -1.921 4.331 -1.503 1.00 . A A . 8 THR HG1 1 1
1 96 1 1 8 THR HG21 H -4.091 4.057 -1.656 1.00 . A A . 8 THR HG21 1 1
1 97 1 1 8 THR HG22 H -4.574 2.822 -0.499 1.00 . A A . 8 THR HG22 1 1
1 98 1 1 8 THR HG23 H -4.591 2.464 -2.224 1.00 . A A . 8 THR HG23 1 1
1 99 1 1 8 THR N N -0.827 2.582 0.175 1.00 . A A . 8 THR N 1 1
1 100 1 1 8 THR O O -1.870 0.377 1.503 1.00 . A A . 8 THR O 1 1
1 101 1 1 8 THR OG1 O -1.848 3.498 -1.976 1.00 . A A . 8 THR OG1 1 1
1 102 1 1 9 PHE C C -3.786 -2.000 -1.216 1.00 . A A . 9 PHE C 1 1
1 103 1 1 9 PHE CA C -3.628 -1.203 0.064 1.00 . A A . 9 PHE CA 1 1
1 104 1 1 9 PHE CB C -4.913 -1.242 0.854 1.00 . A A . 9 PHE CB 1 1
1 105 1 1 9 PHE CD1 C -4.643 0.023 3.004 1.00 . A A . 9 PHE CD1 1 1
1 106 1 1 9 PHE CD2 C -4.577 -2.360 3.076 1.00 . A A . 9 PHE CD2 1 1
1 107 1 1 9 PHE CE1 C -4.452 0.073 4.372 1.00 . A A . 9 PHE CE1 1 1
1 108 1 1 9 PHE CE2 C -4.385 -2.316 4.443 1.00 . A A . 9 PHE CE2 1 1
1 109 1 1 9 PHE CG C -4.708 -1.193 2.342 1.00 . A A . 9 PHE CG 1 1
1 110 1 1 9 PHE CZ C -4.322 -1.099 5.091 1.00 . A A . 9 PHE CZ 1 1
1 111 1 1 9 PHE H H -3.695 0.626 -0.946 1.00 . A A . 9 PHE H 1 1
1 112 1 1 9 PHE HA H -2.836 -1.621 0.631 1.00 . A A . 9 PHE HA 1 1
1 113 1 1 9 PHE HB2 H -5.504 -0.392 0.561 1.00 . A A . 9 PHE HB2 1 1
1 114 1 1 9 PHE HB3 H -5.444 -2.142 0.612 1.00 . A A . 9 PHE HB3 1 1
1 115 1 1 9 PHE HD1 H -4.744 0.939 2.442 1.00 . A A . 9 PHE HD1 1 1
1 116 1 1 9 PHE HD2 H -4.626 -3.312 2.568 1.00 . A A . 9 PHE HD2 1 1
1 117 1 1 9 PHE HE1 H -4.403 1.026 4.877 1.00 . A A . 9 PHE HE1 1 1
1 118 1 1 9 PHE HE2 H -4.283 -3.233 5.003 1.00 . A A . 9 PHE HE2 1 1
1 119 1 1 9 PHE HZ H -4.173 -1.064 6.161 1.00 . A A . 9 PHE HZ 1 1
1 120 1 1 9 PHE N N -3.288 0.178 -0.207 1.00 . A A . 9 PHE N 1 1
1 121 1 1 9 PHE O O -4.256 -3.138 -1.216 1.00 . A A . 9 PHE O 1 1
1 122 1 1 10 GLY C C -3.277 -0.996 -4.728 1.00 . A A . 10 GLY C 1 1
1 123 1 1 10 GLY CA C -3.467 -1.996 -3.604 1.00 . A A . 10 GLY CA 1 1
1 124 1 1 10 GLY H H -3.031 -0.480 -2.191 1.00 . A A . 10 GLY H 1 1
1 125 1 1 10 GLY HA2 H -2.703 -2.755 -3.678 1.00 . A A . 10 GLY HA2 1 1
1 126 1 1 10 GLY HA3 H -4.436 -2.462 -3.711 1.00 . A A . 10 GLY HA3 1 1
1 127 1 1 10 GLY N N -3.386 -1.377 -2.293 1.00 . A A . 10 GLY N 1 1
1 128 1 1 10 GLY O O -2.140 -0.507 -4.901 1.00 . A A . 10 GLY O 1 1
1 129 1 1 10 GLY OXT O -4.264 -0.703 -5.435 1.00 . A A . 10 GLY OXT 1 1
2 130 1 1 1 GLY C C -1.284 -5.086 0.686 1.00 . A A . 1 GLY C 1 1
2 131 1 1 1 GLY CA C -1.543 -6.580 0.711 1.00 . A A . 1 GLY CA 1 1
2 132 1 1 1 GLY H1 H -0.013 -7.079 -0.621 1.00 . A A . 1 GLY H1 1 1
2 133 1 1 1 GLY H2 H -0.579 -8.385 0.293 1.00 . A A . 1 GLY H2 1 1
2 134 1 1 1 GLY H3 H 0.422 -7.224 1.008 1.00 . A A . 1 GLY H3 1 1
2 135 1 1 1 GLY HA2 H -2.349 -6.805 0.028 1.00 . A A . 1 GLY HA2 1 1
2 136 1 1 1 GLY HA3 H -1.840 -6.865 1.709 1.00 . A A . 1 GLY HA3 1 1
2 137 1 1 1 GLY N N -0.345 -7.372 0.321 1.00 . A A . 1 GLY N 1 1
2 138 1 1 1 GLY O O -1.464 -4.435 -0.343 1.00 . A A . 1 GLY O 1 1
2 139 1 1 2 TYR C C 0.518 -2.707 0.950 1.00 . A A . 2 TYR C 1 1
2 140 1 1 2 TYR CA C -0.571 -3.119 1.929 1.00 . A A . 2 TYR CA 1 1
2 141 1 1 2 TYR CB C -0.134 -2.764 3.351 1.00 . A A . 2 TYR CB 1 1
2 142 1 1 2 TYR CD1 C -0.724 -0.347 3.748 1.00 . A A . 2 TYR CD1 1 1
2 143 1 1 2 TYR CD2 C 1.576 -0.896 3.440 1.00 . A A . 2 TYR CD2 1 1
2 144 1 1 2 TYR CE1 C -0.390 0.986 3.899 1.00 . A A . 2 TYR CE1 1 1
2 145 1 1 2 TYR CE2 C 1.918 0.433 3.590 1.00 . A A . 2 TYR CE2 1 1
2 146 1 1 2 TYR CG C 0.248 -1.309 3.517 1.00 . A A . 2 TYR CG 1 1
2 147 1 1 2 TYR CZ C 0.932 1.370 3.819 1.00 . A A . 2 TYR CZ 1 1
2 148 1 1 2 TYR H H -0.732 -5.113 2.606 1.00 . A A . 2 TYR H 1 1
2 149 1 1 2 TYR HA H -1.476 -2.577 1.695 1.00 . A A . 2 TYR HA 1 1
2 150 1 1 2 TYR HB2 H -0.946 -2.973 4.033 1.00 . A A . 2 TYR HB2 1 1
2 151 1 1 2 TYR HB3 H 0.720 -3.366 3.619 1.00 . A A . 2 TYR HB3 1 1
2 152 1 1 2 TYR HD1 H -1.758 -0.652 3.806 1.00 . A A . 2 TYR HD1 1 1
2 153 1 1 2 TYR HD2 H 2.349 -1.628 3.258 1.00 . A A . 2 TYR HD2 1 1
2 154 1 1 2 TYR HE1 H -1.162 1.719 4.077 1.00 . A A . 2 TYR HE1 1 1
2 155 1 1 2 TYR HE2 H 2.954 0.732 3.526 1.00 . A A . 2 TYR HE2 1 1
2 156 1 1 2 TYR HH H 1.321 2.910 4.903 1.00 . A A . 2 TYR HH 1 1
2 157 1 1 2 TYR N N -0.857 -4.543 1.822 1.00 . A A . 2 TYR N 1 1
2 158 1 1 2 TYR O O 1.588 -3.310 0.912 1.00 . A A . 2 TYR O 1 1
2 159 1 1 2 TYR OH O 1.271 2.696 3.969 1.00 . A A . 2 TYR OH 1 1
2 160 1 1 3 ASP C C 2.111 -0.127 -0.102 1.00 . A A . 3 ASP C 1 1
2 161 1 1 3 ASP CA C 1.199 -1.145 -0.784 1.00 . A A . 3 ASP CA 1 1
2 162 1 1 3 ASP CB C 0.473 -0.494 -1.963 1.00 . A A . 3 ASP CB 1 1
2 163 1 1 3 ASP CG C 1.294 -0.526 -3.236 1.00 . A A . 3 ASP CG 1 1
2 164 1 1 3 ASP H H -0.622 -1.224 0.271 1.00 . A A . 3 ASP H 1 1
2 165 1 1 3 ASP HA H 1.786 -1.971 -1.141 1.00 . A A . 3 ASP HA 1 1
2 166 1 1 3 ASP HB2 H -0.453 -1.019 -2.141 1.00 . A A . 3 ASP HB2 1 1
2 167 1 1 3 ASP HB3 H 0.257 0.536 -1.721 1.00 . A A . 3 ASP HB3 1 1
2 168 1 1 3 ASP N N 0.241 -1.664 0.179 1.00 . A A . 3 ASP N 1 1
2 169 1 1 3 ASP O O 1.691 0.992 0.183 1.00 . A A . 3 ASP O 1 1
2 170 1 1 3 ASP OD1 O 1.991 -1.536 -3.468 1.00 . A A . 3 ASP OD1 1 1
2 171 1 1 3 ASP OD2 O 1.243 0.460 -4.001 1.00 . A A . 3 ASP OD2 1 1
2 172 1 1 4 PRO C C 4.834 1.501 -0.003 1.00 . A A . 4 PRO C 1 1
2 173 1 1 4 PRO CA C 4.316 0.375 0.884 1.00 . A A . 4 PRO CA 1 1
2 174 1 1 4 PRO CB C 5.462 -0.562 1.283 1.00 . A A . 4 PRO CB 1 1
2 175 1 1 4 PRO CD C 3.963 -1.818 -0.057 1.00 . A A . 4 PRO CD 1 1
2 176 1 1 4 PRO CG C 4.914 -1.928 1.104 1.00 . A A . 4 PRO CG 1 1
2 177 1 1 4 PRO HA H 3.879 0.790 1.774 1.00 . A A . 4 PRO HA 1 1
2 178 1 1 4 PRO HB2 H 6.314 -0.390 0.644 1.00 . A A . 4 PRO HB2 1 1
2 179 1 1 4 PRO HB3 H 5.727 -0.383 2.313 1.00 . A A . 4 PRO HB3 1 1
2 180 1 1 4 PRO HD2 H 4.487 -1.826 -1.010 1.00 . A A . 4 PRO HD2 1 1
2 181 1 1 4 PRO HD3 H 3.223 -2.596 -0.018 1.00 . A A . 4 PRO HD3 1 1
2 182 1 1 4 PRO HG2 H 5.713 -2.632 0.904 1.00 . A A . 4 PRO HG2 1 1
2 183 1 1 4 PRO HG3 H 4.379 -2.207 1.996 1.00 . A A . 4 PRO HG3 1 1
2 184 1 1 4 PRO N N 3.365 -0.507 0.200 1.00 . A A . 4 PRO N 1 1
2 185 1 1 4 PRO O O 5.128 2.596 0.476 1.00 . A A . 4 PRO O 1 1
2 186 1 1 5 ALA C C 4.550 3.451 -2.249 1.00 . A A . 5 ALA C 1 1
2 187 1 1 5 ALA CA C 5.438 2.215 -2.248 1.00 . A A . 5 ALA CA 1 1
2 188 1 1 5 ALA CB C 5.513 1.613 -3.644 1.00 . A A . 5 ALA CB 1 1
2 189 1 1 5 ALA H H 4.702 0.334 -1.617 1.00 . A A . 5 ALA H 1 1
2 190 1 1 5 ALA HA H 6.436 2.499 -1.950 1.00 . A A . 5 ALA HA 1 1
2 191 1 1 5 ALA HB1 H 4.564 1.745 -4.143 1.00 . A A . 5 ALA HB1 1 1
2 192 1 1 5 ALA HB2 H 5.737 0.560 -3.571 1.00 . A A . 5 ALA HB2 1 1
2 193 1 1 5 ALA HB3 H 6.288 2.110 -4.208 1.00 . A A . 5 ALA HB3 1 1
2 194 1 1 5 ALA N N 4.951 1.225 -1.297 1.00 . A A . 5 ALA N 1 1
2 195 1 1 5 ALA O O 5.024 4.571 -2.057 1.00 . A A . 5 ALA O 1 1
2 196 1 1 6 THR C C 1.725 4.555 -1.090 1.00 . A A . 6 THR C 1 1
2 197 1 1 6 THR CA C 2.297 4.315 -2.489 1.00 . A A . 6 THR CA 1 1
2 198 1 1 6 THR CB C 1.185 3.973 -3.482 1.00 . A A . 6 THR CB 1 1
2 199 1 1 6 THR CG2 C -0.035 4.849 -3.354 1.00 . A A . 6 THR CG2 1 1
2 200 1 1 6 THR H H 2.941 2.330 -2.607 1.00 . A A . 6 THR H 1 1
2 201 1 1 6 THR HA H 2.806 5.201 -2.819 1.00 . A A . 6 THR HA 1 1
2 202 1 1 6 THR HB H 0.876 2.951 -3.319 1.00 . A A . 6 THR HB 1 1
2 203 1 1 6 THR HG1 H 2.183 3.315 -5.034 1.00 . A A . 6 THR HG1 1 1
2 204 1 1 6 THR HG21 H -0.873 4.364 -3.827 1.00 . A A . 6 THR HG21 1 1
2 205 1 1 6 THR HG22 H 0.152 5.796 -3.835 1.00 . A A . 6 THR HG22 1 1
2 206 1 1 6 THR HG23 H -0.251 5.009 -2.311 1.00 . A A . 6 THR HG23 1 1
2 207 1 1 6 THR N N 3.258 3.238 -2.463 1.00 . A A . 6 THR N 1 1
2 208 1 1 6 THR O O 1.306 5.664 -0.761 1.00 . A A . 6 THR O 1 1
2 209 1 1 6 THR OG1 O 1.653 4.085 -4.814 1.00 . A A . 6 THR OG1 1 1
2 210 1 1 7 GLY C C -0.287 3.398 1.154 1.00 . A A . 7 GLY C 1 1
2 211 1 1 7 GLY CA C 1.208 3.606 1.074 1.00 . A A . 7 GLY CA 1 1
2 212 1 1 7 GLY H H 2.069 2.652 -0.592 1.00 . A A . 7 GLY H 1 1
2 213 1 1 7 GLY HA2 H 1.687 2.852 1.675 1.00 . A A . 7 GLY HA2 1 1
2 214 1 1 7 GLY HA3 H 1.451 4.577 1.465 1.00 . A A . 7 GLY HA3 1 1
2 215 1 1 7 GLY N N 1.719 3.505 -0.276 1.00 . A A . 7 GLY N 1 1
2 216 1 1 7 GLY O O -0.963 3.982 2.000 1.00 . A A . 7 GLY O 1 1
2 217 1 1 8 THR C C -2.373 0.757 0.433 1.00 . A A . 8 THR C 1 1
2 218 1 1 8 THR CA C -2.182 2.248 0.203 1.00 . A A . 8 THR CA 1 1
2 219 1 1 8 THR CB C -2.699 2.681 -1.166 1.00 . A A . 8 THR CB 1 1
2 220 1 1 8 THR CG2 C -4.127 3.130 -1.132 1.00 . A A . 8 THR CG2 1 1
2 221 1 1 8 THR H H -0.232 2.133 -0.375 1.00 . A A . 8 THR H 1 1
2 222 1 1 8 THR HA H -2.698 2.787 0.962 1.00 . A A . 8 THR HA 1 1
2 223 1 1 8 THR HB H -2.622 1.852 -1.852 1.00 . A A . 8 THR HB 1 1
2 224 1 1 8 THR HG1 H -2.035 4.523 -1.114 1.00 . A A . 8 THR HG1 1 1
2 225 1 1 8 THR HG21 H -4.571 2.815 -0.202 1.00 . A A . 8 THR HG21 1 1
2 226 1 1 8 THR HG22 H -4.661 2.690 -1.957 1.00 . A A . 8 THR HG22 1 1
2 227 1 1 8 THR HG23 H -4.161 4.204 -1.205 1.00 . A A . 8 THR HG23 1 1
2 228 1 1 8 THR N N -0.800 2.559 0.267 1.00 . A A . 8 THR N 1 1
2 229 1 1 8 THR O O -1.725 0.154 1.286 1.00 . A A . 8 THR O 1 1
2 230 1 1 8 THR OG1 O -1.928 3.753 -1.678 1.00 . A A . 8 THR OG1 1 1
2 231 1 1 9 PHE C C -3.501 -1.884 -1.636 1.00 . A A . 9 PHE C 1 1
2 232 1 1 9 PHE CA C -3.562 -1.236 -0.266 1.00 . A A . 9 PHE CA 1 1
2 233 1 1 9 PHE CB C -4.942 -1.429 0.332 1.00 . A A . 9 PHE CB 1 1
2 234 1 1 9 PHE CD1 C -4.198 -1.004 2.695 1.00 . A A . 9 PHE CD1 1 1
2 235 1 1 9 PHE CD2 C -5.655 -2.845 2.276 1.00 . A A . 9 PHE CD2 1 1
2 236 1 1 9 PHE CE1 C -4.187 -1.317 4.042 1.00 . A A . 9 PHE CE1 1 1
2 237 1 1 9 PHE CE2 C -5.648 -3.161 3.621 1.00 . A A . 9 PHE CE2 1 1
2 238 1 1 9 PHE CG C -4.932 -1.764 1.797 1.00 . A A . 9 PHE CG 1 1
2 239 1 1 9 PHE CZ C -4.913 -2.396 4.505 1.00 . A A . 9 PHE CZ 1 1
2 240 1 1 9 PHE H H -3.705 0.735 -0.983 1.00 . A A . 9 PHE H 1 1
2 241 1 1 9 PHE HA H -2.830 -1.684 0.351 1.00 . A A . 9 PHE HA 1 1
2 242 1 1 9 PHE HB2 H -5.492 -0.514 0.194 1.00 . A A . 9 PHE HB2 1 1
2 243 1 1 9 PHE HB3 H -5.446 -2.226 -0.192 1.00 . A A . 9 PHE HB3 1 1
2 244 1 1 9 PHE HD1 H -3.633 -0.158 2.337 1.00 . A A . 9 PHE HD1 1 1
2 245 1 1 9 PHE HD2 H -6.230 -3.444 1.586 1.00 . A A . 9 PHE HD2 1 1
2 246 1 1 9 PHE HE1 H -3.610 -0.718 4.730 1.00 . A A . 9 PHE HE1 1 1
2 247 1 1 9 PHE HE2 H -6.217 -4.007 3.981 1.00 . A A . 9 PHE HE2 1 1
2 248 1 1 9 PHE HZ H -4.906 -2.642 5.557 1.00 . A A . 9 PHE HZ 1 1
2 249 1 1 9 PHE N N -3.254 0.185 -0.340 1.00 . A A . 9 PHE N 1 1
2 250 1 1 9 PHE O O -3.842 -3.053 -1.816 1.00 . A A . 9 PHE O 1 1
2 251 1 1 10 GLY C C -2.635 -0.423 -4.915 1.00 . A A . 10 GLY C 1 1
2 252 1 1 10 GLY CA C -2.943 -1.554 -3.954 1.00 . A A . 10 GLY CA 1 1
2 253 1 1 10 GLY H H -2.821 -0.190 -2.338 1.00 . A A . 10 GLY H 1 1
2 254 1 1 10 GLY HA2 H -2.150 -2.286 -4.010 1.00 . A A . 10 GLY HA2 1 1
2 255 1 1 10 GLY HA3 H -3.871 -2.021 -4.251 1.00 . A A . 10 GLY HA3 1 1
2 256 1 1 10 GLY N N -3.065 -1.098 -2.583 1.00 . A A . 10 GLY N 1 1
2 257 1 1 10 GLY O O -3.555 0.003 -5.645 1.00 . A A . 10 GLY O 1 1
2 258 1 1 10 GLY OXT O -1.474 0.037 -4.937 1.00 . A A . 10 GLY OXT 1 1
3 259 1 1 1 GLY C C -1.227 -5.096 0.728 1.00 . A A . 1 GLY C 1 1
3 260 1 1 1 GLY CA C -1.487 -6.588 0.775 1.00 . A A . 1 GLY CA 1 1
3 261 1 1 1 GLY H1 H -2.760 -6.313 2.407 1.00 . A A . 1 GLY H1 1 1
3 262 1 1 1 GLY H2 H -2.640 -7.921 1.896 1.00 . A A . 1 GLY H2 1 1
3 263 1 1 1 GLY H3 H -3.551 -6.815 0.996 1.00 . A A . 1 GLY H3 1 1
3 264 1 1 1 GLY HA2 H -0.627 -7.078 1.209 1.00 . A A . 1 GLY HA2 1 1
3 265 1 1 1 GLY HA3 H -1.622 -6.950 -0.235 1.00 . A A . 1 GLY HA3 1 1
3 266 1 1 1 GLY N N -2.694 -6.933 1.574 1.00 . A A . 1 GLY N 1 1
3 267 1 1 1 GLY O O -1.396 -4.461 -0.312 1.00 . A A . 1 GLY O 1 1
3 268 1 1 2 TYR C C 0.558 -2.705 0.970 1.00 . A A . 2 TYR C 1 1
3 269 1 1 2 TYR CA C -0.535 -3.107 1.949 1.00 . A A . 2 TYR CA 1 1
3 270 1 1 2 TYR CB C -0.103 -2.733 3.368 1.00 . A A . 2 TYR CB 1 1
3 271 1 1 2 TYR CD1 C -0.685 -0.307 3.725 1.00 . A A . 2 TYR CD1 1 1
3 272 1 1 2 TYR CD2 C 1.617 -0.870 3.444 1.00 . A A . 2 TYR CD2 1 1
3 273 1 1 2 TYR CE1 C -0.345 1.026 3.861 1.00 . A A . 2 TYR CE1 1 1
3 274 1 1 2 TYR CE2 C 1.963 0.461 3.579 1.00 . A A . 2 TYR CE2 1 1
3 275 1 1 2 TYR CG C 0.286 -1.275 3.515 1.00 . A A . 2 TYR CG 1 1
3 276 1 1 2 TYR CZ C 0.979 1.405 3.789 1.00 . A A . 2 TYR CZ 1 1
3 277 1 1 2 TYR H H -0.701 -5.091 2.656 1.00 . A A . 2 TYR H 1 1
3 278 1 1 2 TYR HA H -1.439 -2.571 1.706 1.00 . A A . 2 TYR HA 1 1
3 279 1 1 2 TYR HB2 H -0.919 -2.927 4.049 1.00 . A A . 2 TYR HB2 1 1
3 280 1 1 2 TYR HB3 H 0.747 -3.335 3.650 1.00 . A A . 2 TYR HB3 1 1
3 281 1 1 2 TYR HD1 H -1.719 -0.607 3.779 1.00 . A A . 2 TYR HD1 1 1
3 282 1 1 2 TYR HD2 H 2.389 -1.608 3.278 1.00 . A A . 2 TYR HD2 1 1
3 283 1 1 2 TYR HE1 H -1.117 1.764 4.023 1.00 . A A . 2 TYR HE1 1 1
3 284 1 1 2 TYR HE2 H 2.999 0.756 3.520 1.00 . A A . 2 TYR HE2 1 1
3 285 1 1 2 TYR HH H 1.077 3.034 4.802 1.00 . A A . 2 TYR HH 1 1
3 286 1 1 2 TYR N N -0.816 -4.534 1.861 1.00 . A A . 2 TYR N 1 1
3 287 1 1 2 TYR O O 1.633 -3.301 0.949 1.00 . A A . 2 TYR O 1 1
3 288 1 1 2 TYR OH O 1.320 2.730 3.926 1.00 . A A . 2 TYR OH 1 1
3 289 1 1 3 ASP C C 2.142 -0.140 -0.111 1.00 . A A . 3 ASP C 1 1
3 290 1 1 3 ASP CA C 1.237 -1.169 -0.785 1.00 . A A . 3 ASP CA 1 1
3 291 1 1 3 ASP CB C 0.516 -0.535 -1.975 1.00 . A A . 3 ASP CB 1 1
3 292 1 1 3 ASP CG C 1.380 -0.494 -3.219 1.00 . A A . 3 ASP CG 1 1
3 293 1 1 3 ASP H H -0.589 -1.242 0.261 1.00 . A A . 3 ASP H 1 1
3 294 1 1 3 ASP HA H 1.829 -1.997 -1.127 1.00 . A A . 3 ASP HA 1 1
3 295 1 1 3 ASP HB2 H -0.372 -1.108 -2.196 1.00 . A A . 3 ASP HB2 1 1
3 296 1 1 3 ASP HB3 H 0.234 0.476 -1.722 1.00 . A A . 3 ASP HB3 1 1
3 297 1 1 3 ASP N N 0.277 -1.677 0.179 1.00 . A A . 3 ASP N 1 1
3 298 1 1 3 ASP O O 1.713 0.978 0.165 1.00 . A A . 3 ASP O 1 1
3 299 1 1 3 ASP OD1 O 2.360 -1.267 -3.287 1.00 . A A . 3 ASP OD1 1 1
3 300 1 1 3 ASP OD2 O 1.079 0.310 -4.126 1.00 . A A . 3 ASP OD2 1 1
3 301 1 1 4 PRO C C 4.848 1.514 -0.008 1.00 . A A . 4 PRO C 1 1
3 302 1 1 4 PRO CA C 4.340 0.385 0.881 1.00 . A A . 4 PRO CA 1 1
3 303 1 1 4 PRO CB C 5.493 -0.540 1.286 1.00 . A A . 4 PRO CB 1 1
3 304 1 1 4 PRO CD C 4.004 -1.820 -0.042 1.00 . A A . 4 PRO CD 1 1
3 305 1 1 4 PRO CG C 4.955 -1.912 1.120 1.00 . A A . 4 PRO CG 1 1
3 306 1 1 4 PRO HA H 3.898 0.799 1.769 1.00 . A A . 4 PRO HA 1 1
3 307 1 1 4 PRO HB2 H 6.344 -0.368 0.645 1.00 . A A . 4 PRO HB2 1 1
3 308 1 1 4 PRO HB3 H 5.759 -0.350 2.315 1.00 . A A . 4 PRO HB3 1 1
3 309 1 1 4 PRO HD2 H 4.528 -1.836 -0.995 1.00 . A A . 4 PRO HD2 1 1
3 310 1 1 4 PRO HD3 H 3.268 -2.601 0.006 1.00 . A A . 4 PRO HD3 1 1
3 311 1 1 4 PRO HG2 H 5.759 -2.612 0.925 1.00 . A A . 4 PRO HG2 1 1
3 312 1 1 4 PRO HG3 H 4.423 -2.188 2.014 1.00 . A A . 4 PRO HG3 1 1
3 313 1 1 4 PRO N N 3.397 -0.509 0.201 1.00 . A A . 4 PRO N 1 1
3 314 1 1 4 PRO O O 5.125 2.615 0.468 1.00 . A A . 4 PRO O 1 1
3 315 1 1 5 ALA C C 4.545 3.459 -2.248 1.00 . A A . 5 ALA C 1 1
3 316 1 1 5 ALA CA C 5.445 2.232 -2.253 1.00 . A A . 5 ALA CA 1 1
3 317 1 1 5 ALA CB C 5.522 1.634 -3.649 1.00 . A A . 5 ALA CB 1 1
3 318 1 1 5 ALA H H 4.730 0.343 -1.619 1.00 . A A . 5 ALA H 1 1
3 319 1 1 5 ALA HA H 6.443 2.527 -1.957 1.00 . A A . 5 ALA HA 1 1
3 320 1 1 5 ALA HB1 H 4.542 1.649 -4.102 1.00 . A A . 5 ALA HB1 1 1
3 321 1 1 5 ALA HB2 H 5.873 0.614 -3.587 1.00 . A A . 5 ALA HB2 1 1
3 322 1 1 5 ALA HB3 H 6.205 2.214 -4.252 1.00 . A A . 5 ALA HB3 1 1
3 323 1 1 5 ALA N N 4.968 1.236 -1.300 1.00 . A A . 5 ALA N 1 1
3 324 1 1 5 ALA O O 5.007 4.584 -2.054 1.00 . A A . 5 ALA O 1 1
3 325 1 1 6 THR C C 1.719 4.531 -1.078 1.00 . A A . 6 THR C 1 1
3 326 1 1 6 THR CA C 2.282 4.299 -2.481 1.00 . A A . 6 THR CA 1 1
3 327 1 1 6 THR CB C 1.167 3.942 -3.463 1.00 . A A . 6 THR CB 1 1
3 328 1 1 6 THR CG2 C -0.046 4.831 -3.350 1.00 . A A . 6 THR CG2 1 1
3 329 1 1 6 THR H H 2.947 2.322 -2.607 1.00 . A A . 6 THR H 1 1
3 330 1 1 6 THR HA H 2.778 5.192 -2.815 1.00 . A A . 6 THR HA 1 1
3 331 1 1 6 THR HB H 0.851 2.927 -3.275 1.00 . A A . 6 THR HB 1 1
3 332 1 1 6 THR HG1 H 2.166 3.249 -4.997 1.00 . A A . 6 THR HG1 1 1
3 333 1 1 6 THR HG21 H -0.239 5.038 -2.312 1.00 . A A . 6 THR HG21 1 1
3 334 1 1 6 THR HG22 H -0.896 4.328 -3.781 1.00 . A A . 6 THR HG22 1 1
3 335 1 1 6 THR HG23 H 0.136 5.753 -3.878 1.00 . A A . 6 THR HG23 1 1
3 336 1 1 6 THR N N 3.255 3.232 -2.460 1.00 . A A . 6 THR N 1 1
3 337 1 1 6 THR O O 1.305 5.638 -0.737 1.00 . A A . 6 THR O 1 1
3 338 1 1 6 THR OG1 O 1.633 4.021 -4.798 1.00 . A A . 6 THR OG1 1 1
3 339 1 1 7 GLY C C -0.289 3.370 1.162 1.00 . A A . 7 GLY C 1 1
3 340 1 1 7 GLY CA C 1.209 3.561 1.081 1.00 . A A . 7 GLY CA 1 1
3 341 1 1 7 GLY H H 2.058 2.623 -0.599 1.00 . A A . 7 GLY H 1 1
3 342 1 1 7 GLY HA2 H 1.682 2.793 1.669 1.00 . A A . 7 GLY HA2 1 1
3 343 1 1 7 GLY HA3 H 1.466 4.525 1.484 1.00 . A A . 7 GLY HA3 1 1
3 344 1 1 7 GLY N N 1.713 3.474 -0.272 1.00 . A A . 7 GLY N 1 1
3 345 1 1 7 GLY O O -0.954 3.952 2.018 1.00 . A A . 7 GLY O 1 1
3 346 1 1 8 THR C C -2.418 0.769 0.423 1.00 . A A . 8 THR C 1 1
3 347 1 1 8 THR CA C -2.199 2.257 0.201 1.00 . A A . 8 THR CA 1 1
3 348 1 1 8 THR CB C -2.709 2.706 -1.166 1.00 . A A . 8 THR CB 1 1
3 349 1 1 8 THR CG2 C -4.127 3.186 -1.128 1.00 . A A . 8 THR CG2 1 1
3 350 1 1 8 THR H H -0.252 2.123 -0.382 1.00 . A A . 8 THR H 1 1
3 351 1 1 8 THR HA H -2.708 2.800 0.962 1.00 . A A . 8 THR HA 1 1
3 352 1 1 8 THR HB H -2.650 1.877 -1.855 1.00 . A A . 8 THR HB 1 1
3 353 1 1 8 THR HG1 H -2.028 4.542 -1.127 1.00 . A A . 8 THR HG1 1 1
3 354 1 1 8 THR HG21 H -4.520 3.042 -0.136 1.00 . A A . 8 THR HG21 1 1
3 355 1 1 8 THR HG22 H -4.714 2.628 -1.837 1.00 . A A . 8 THR HG22 1 1
3 356 1 1 8 THR HG23 H -4.152 4.235 -1.379 1.00 . A A . 8 THR HG23 1 1
3 357 1 1 8 THR N N -0.812 2.549 0.267 1.00 . A A . 8 THR N 1 1
3 358 1 1 8 THR O O -1.790 0.151 1.283 1.00 . A A . 8 THR O 1 1
3 359 1 1 8 THR OG1 O -1.914 3.761 -1.675 1.00 . A A . 8 THR OG1 1 1
3 360 1 1 9 PHE C C -3.687 -1.821 -1.675 1.00 . A A . 9 PHE C 1 1
3 361 1 1 9 PHE CA C -3.636 -1.198 -0.292 1.00 . A A . 9 PHE CA 1 1
3 362 1 1 9 PHE CB C -4.976 -1.367 0.393 1.00 . A A . 9 PHE CB 1 1
3 363 1 1 9 PHE CD1 C -4.189 -0.916 2.738 1.00 . A A . 9 PHE CD1 1 1
3 364 1 1 9 PHE CD2 C -5.472 -2.883 2.330 1.00 . A A . 9 PHE CD2 1 1
3 365 1 1 9 PHE CE1 C -4.097 -1.250 4.076 1.00 . A A . 9 PHE CE1 1 1
3 366 1 1 9 PHE CE2 C -5.384 -3.223 3.667 1.00 . A A . 9 PHE CE2 1 1
3 367 1 1 9 PHE CG C -4.877 -1.728 1.849 1.00 . A A . 9 PHE CG 1 1
3 368 1 1 9 PHE CZ C -4.695 -2.404 4.540 1.00 . A A . 9 PHE CZ 1 1
3 369 1 1 9 PHE H H -3.739 0.775 -1.002 1.00 . A A . 9 PHE H 1 1
3 370 1 1 9 PHE HA H -2.876 -1.677 0.265 1.00 . A A . 9 PHE HA 1 1
3 371 1 1 9 PHE HB2 H -5.510 -0.437 0.307 1.00 . A A . 9 PHE HB2 1 1
3 372 1 1 9 PHE HB3 H -5.534 -2.143 -0.109 1.00 . A A . 9 PHE HB3 1 1
3 373 1 1 9 PHE HD1 H -3.721 -0.010 2.376 1.00 . A A . 9 PHE HD1 1 1
3 374 1 1 9 PHE HD2 H -6.011 -3.524 1.647 1.00 . A A . 9 PHE HD2 1 1
3 375 1 1 9 PHE HE1 H -3.556 -0.610 4.757 1.00 . A A . 9 PHE HE1 1 1
3 376 1 1 9 PHE HE2 H -5.853 -4.126 4.028 1.00 . A A . 9 PHE HE2 1 1
3 377 1 1 9 PHE HZ H -4.623 -2.666 5.586 1.00 . A A . 9 PHE HZ 1 1
3 378 1 1 9 PHE N N -3.302 0.215 -0.359 1.00 . A A . 9 PHE N 1 1
3 379 1 1 9 PHE O O -4.079 -2.975 -1.852 1.00 . A A . 9 PHE O 1 1
3 380 1 1 10 GLY C C -4.439 -0.914 -4.814 1.00 . A A . 10 GLY C 1 1
3 381 1 1 10 GLY CA C -3.272 -1.467 -4.020 1.00 . A A . 10 GLY CA 1 1
3 382 1 1 10 GLY H H -2.998 -0.138 -2.393 1.00 . A A . 10 GLY H 1 1
3 383 1 1 10 GLY HA2 H -2.351 -1.139 -4.478 1.00 . A A . 10 GLY HA2 1 1
3 384 1 1 10 GLY HA3 H -3.311 -2.546 -4.048 1.00 . A A . 10 GLY HA3 1 1
3 385 1 1 10 GLY N N -3.287 -1.033 -2.635 1.00 . A A . 10 GLY N 1 1
3 386 1 1 10 GLY O O -4.723 0.295 -4.688 1.00 . A A . 10 GLY O 1 1
3 387 1 1 10 GLY OXT O -5.068 -1.690 -5.564 1.00 . A A . 10 GLY OXT 1 1
4 388 1 1 1 GLY C C -1.371 -5.124 0.463 1.00 . A A . 1 GLY C 1 1
4 389 1 1 1 GLY CA C -1.642 -6.614 0.402 1.00 . A A . 1 GLY CA 1 1
4 390 1 1 1 GLY H1 H -0.040 -7.574 -0.534 1.00 . A A . 1 GLY H1 1 1
4 391 1 1 1 GLY H2 H -0.576 -8.348 0.872 1.00 . A A . 1 GLY H2 1 1
4 392 1 1 1 GLY H3 H 0.340 -6.929 0.984 1.00 . A A . 1 GLY H3 1 1
4 393 1 1 1 GLY HA2 H -2.178 -6.835 -0.510 1.00 . A A . 1 GLY HA2 1 1
4 394 1 1 1 GLY HA3 H -2.259 -6.892 1.245 1.00 . A A . 1 GLY HA3 1 1
4 395 1 1 1 GLY N N -0.392 -7.423 0.434 1.00 . A A . 1 GLY N 1 1
4 396 1 1 1 GLY O O -1.605 -4.403 -0.508 1.00 . A A . 1 GLY O 1 1
4 397 1 1 2 TYR C C 0.510 -2.789 0.832 1.00 . A A . 2 TYR C 1 1
4 398 1 1 2 TYR CA C -0.579 -3.247 1.791 1.00 . A A . 2 TYR CA 1 1
4 399 1 1 2 TYR CB C -0.141 -2.974 3.231 1.00 . A A . 2 TYR CB 1 1
4 400 1 1 2 TYR CD1 C -0.821 -0.612 3.793 1.00 . A A . 2 TYR CD1 1 1
4 401 1 1 2 TYR CD2 C 1.496 -1.056 3.444 1.00 . A A . 2 TYR CD2 1 1
4 402 1 1 2 TYR CE1 C -0.534 0.717 4.032 1.00 . A A . 2 TYR CE1 1 1
4 403 1 1 2 TYR CE2 C 1.791 0.271 3.682 1.00 . A A . 2 TYR CE2 1 1
4 404 1 1 2 TYR CG C 0.185 -1.520 3.496 1.00 . A A . 2 TYR CG 1 1
4 405 1 1 2 TYR CZ C 0.774 1.155 3.975 1.00 . A A . 2 TYR CZ 1 1
4 406 1 1 2 TYR H H -0.716 -5.280 2.343 1.00 . A A . 2 TYR H 1 1
4 407 1 1 2 TYR HA H -1.480 -2.688 1.588 1.00 . A A . 2 TYR HA 1 1
4 408 1 1 2 TYR HB2 H -0.935 -3.263 3.903 1.00 . A A . 2 TYR HB2 1 1
4 409 1 1 2 TYR HB3 H 0.741 -3.559 3.451 1.00 . A A . 2 TYR HB3 1 1
4 410 1 1 2 TYR HD1 H -1.842 -0.958 3.835 1.00 . A A . 2 TYR HD1 1 1
4 411 1 1 2 TYR HD2 H 2.292 -1.745 3.215 1.00 . A A . 2 TYR HD2 1 1
4 412 1 1 2 TYR HE1 H -1.333 1.409 4.261 1.00 . A A . 2 TYR HE1 1 1
4 413 1 1 2 TYR HE2 H 2.815 0.611 3.635 1.00 . A A . 2 TYR HE2 1 1
4 414 1 1 2 TYR HH H 1.803 2.540 4.822 1.00 . A A . 2 TYR HH 1 1
4 415 1 1 2 TYR N N -0.879 -4.660 1.607 1.00 . A A . 2 TYR N 1 1
4 416 1 1 2 TYR O O 1.565 -3.413 0.736 1.00 . A A . 2 TYR O 1 1
4 417 1 1 2 TYR OH O 1.065 2.479 4.211 1.00 . A A . 2 TYR OH 1 1
4 418 1 1 3 ASP C C 2.097 -0.117 -0.092 1.00 . A A . 3 ASP C 1 1
4 419 1 1 3 ASP CA C 1.202 -1.129 -0.804 1.00 . A A . 3 ASP CA 1 1
4 420 1 1 3 ASP CB C 0.473 -0.457 -1.968 1.00 . A A . 3 ASP CB 1 1
4 421 1 1 3 ASP CG C 1.294 -0.454 -3.242 1.00 . A A . 3 ASP CG 1 1
4 422 1 1 3 ASP H H -0.606 -1.243 0.267 1.00 . A A . 3 ASP H 1 1
4 423 1 1 3 ASP HA H 1.803 -1.934 -1.180 1.00 . A A . 3 ASP HA 1 1
4 424 1 1 3 ASP HB2 H -0.449 -0.986 -2.158 1.00 . A A . 3 ASP HB2 1 1
4 425 1 1 3 ASP HB3 H 0.249 0.564 -1.702 1.00 . A A . 3 ASP HB3 1 1
4 426 1 1 3 ASP N N 0.247 -1.691 0.136 1.00 . A A . 3 ASP N 1 1
4 427 1 1 3 ASP O O 1.660 0.994 0.215 1.00 . A A . 3 ASP O 1 1
4 428 1 1 3 ASP OD1 O 1.189 -1.426 -4.019 1.00 . A A . 3 ASP OD1 1 1
4 429 1 1 3 ASP OD2 O 2.042 0.522 -3.464 1.00 . A A . 3 ASP OD2 1 1
4 430 1 1 4 PRO C C 4.826 1.518 0.048 1.00 . A A . 4 PRO C 1 1
4 431 1 1 4 PRO CA C 4.290 0.388 0.919 1.00 . A A . 4 PRO CA 1 1
4 432 1 1 4 PRO CB C 5.429 -0.553 1.331 1.00 . A A . 4 PRO CB 1 1
4 433 1 1 4 PRO CD C 3.968 -1.783 -0.073 1.00 . A A . 4 PRO CD 1 1
4 434 1 1 4 PRO CG C 4.893 -1.917 1.106 1.00 . A A . 4 PRO CG 1 1
4 435 1 1 4 PRO HA H 3.838 0.796 1.803 1.00 . A A . 4 PRO HA 1 1
4 436 1 1 4 PRO HB2 H 6.300 -0.364 0.725 1.00 . A A . 4 PRO HB2 1 1
4 437 1 1 4 PRO HB3 H 5.660 -0.397 2.374 1.00 . A A . 4 PRO HB3 1 1
4 438 1 1 4 PRO HD2 H 4.512 -1.759 -1.014 1.00 . A A . 4 PRO HD2 1 1
4 439 1 1 4 PRO HD3 H 3.234 -2.569 -0.072 1.00 . A A . 4 PRO HD3 1 1
4 440 1 1 4 PRO HG2 H 5.700 -2.611 0.906 1.00 . A A . 4 PRO HG2 1 1
4 441 1 1 4 PRO HG3 H 4.342 -2.219 1.978 1.00 . A A . 4 PRO HG3 1 1
4 442 1 1 4 PRO N N 3.353 -0.487 0.210 1.00 . A A . 4 PRO N 1 1
4 443 1 1 4 PRO O O 5.099 2.614 0.535 1.00 . A A . 4 PRO O 1 1
4 444 1 1 5 ALA C C 4.584 3.462 -2.216 1.00 . A A . 5 ALA C 1 1
4 445 1 1 5 ALA CA C 5.485 2.236 -2.181 1.00 . A A . 5 ALA CA 1 1
4 446 1 1 5 ALA CB C 5.611 1.631 -3.573 1.00 . A A . 5 ALA CB 1 1
4 447 1 1 5 ALA H H 4.744 0.351 -1.570 1.00 . A A . 5 ALA H 1 1
4 448 1 1 5 ALA HA H 6.470 2.533 -1.853 1.00 . A A . 5 ALA HA 1 1
4 449 1 1 5 ALA HB1 H 6.598 1.209 -3.694 1.00 . A A . 5 ALA HB1 1 1
4 450 1 1 5 ALA HB2 H 5.454 2.401 -4.314 1.00 . A A . 5 ALA HB2 1 1
4 451 1 1 5 ALA HB3 H 4.871 0.855 -3.695 1.00 . A A . 5 ALA HB3 1 1
4 452 1 1 5 ALA N N 4.979 1.242 -1.243 1.00 . A A . 5 ALA N 1 1
4 453 1 1 5 ALA O O 5.039 4.588 -2.011 1.00 . A A . 5 ALA O 1 1
4 454 1 1 6 THR C C 1.733 4.562 -1.149 1.00 . A A . 6 THR C 1 1
4 455 1 1 6 THR CA C 2.332 4.303 -2.531 1.00 . A A . 6 THR CA 1 1
4 456 1 1 6 THR CB C 1.241 3.932 -3.537 1.00 . A A . 6 THR CB 1 1
4 457 1 1 6 THR CG2 C 0.016 4.805 -3.452 1.00 . A A . 6 THR CG2 1 1
4 458 1 1 6 THR H H 2.999 2.324 -2.622 1.00 . A A . 6 THR H 1 1
4 459 1 1 6 THR HA H 2.838 5.188 -2.869 1.00 . A A . 6 THR HA 1 1
4 460 1 1 6 THR HB H 0.932 2.911 -3.357 1.00 . A A . 6 THR HB 1 1
4 461 1 1 6 THR HG1 H 1.745 3.141 -5.258 1.00 . A A . 6 THR HG1 1 1
4 462 1 1 6 THR HG21 H -0.241 4.956 -2.417 1.00 . A A . 6 THR HG21 1 1
4 463 1 1 6 THR HG22 H -0.804 4.321 -3.959 1.00 . A A . 6 THR HG22 1 1
4 464 1 1 6 THR HG23 H 0.221 5.756 -3.917 1.00 . A A . 6 THR HG23 1 1
4 465 1 1 6 THR N N 3.303 3.235 -2.471 1.00 . A A . 6 THR N 1 1
4 466 1 1 6 THR O O 1.298 5.672 -0.846 1.00 . A A . 6 THR O 1 1
4 467 1 1 6 THR OG1 O 1.733 4.015 -4.862 1.00 . A A . 6 THR OG1 1 1
4 468 1 1 7 GLY C C -0.316 3.454 1.073 1.00 . A A . 7 GLY C 1 1
4 469 1 1 7 GLY CA C 1.184 3.650 1.022 1.00 . A A . 7 GLY CA 1 1
4 470 1 1 7 GLY H H 2.083 2.670 -0.607 1.00 . A A . 7 GLY H 1 1
4 471 1 1 7 GLY HA2 H 1.645 2.902 1.645 1.00 . A A . 7 GLY HA2 1 1
4 472 1 1 7 GLY HA3 H 1.426 4.625 1.405 1.00 . A A . 7 GLY HA3 1 1
4 473 1 1 7 GLY N N 1.720 3.526 -0.314 1.00 . A A . 7 GLY N 1 1
4 474 1 1 7 GLY O O -1.006 4.072 1.883 1.00 . A A . 7 GLY O 1 1
4 475 1 1 8 THR C C -2.414 0.827 0.502 1.00 . A A . 8 THR C 1 1
4 476 1 1 8 THR CA C -2.196 2.281 0.123 1.00 . A A . 8 THR CA 1 1
4 477 1 1 8 THR CB C -2.664 2.571 -1.302 1.00 . A A . 8 THR CB 1 1
4 478 1 1 8 THR CG2 C -4.092 3.018 -1.363 1.00 . A A . 8 THR CG2 1 1
4 479 1 1 8 THR H H -0.232 2.131 -0.405 1.00 . A A . 8 THR H 1 1
4 480 1 1 8 THR HA H -2.733 2.899 0.802 1.00 . A A . 8 THR HA 1 1
4 481 1 1 8 THR HB H -2.565 1.678 -1.900 1.00 . A A . 8 THR HB 1 1
4 482 1 1 8 THR HG1 H -1.965 4.397 -1.383 1.00 . A A . 8 THR HG1 1 1
4 483 1 1 8 THR HG21 H -4.124 4.085 -1.506 1.00 . A A . 8 THR HG21 1 1
4 484 1 1 8 THR HG22 H -4.580 2.764 -0.436 1.00 . A A . 8 THR HG22 1 1
4 485 1 1 8 THR HG23 H -4.588 2.525 -2.184 1.00 . A A . 8 THR HG23 1 1
4 486 1 1 8 THR N N -0.813 2.586 0.205 1.00 . A A . 8 THR N 1 1
4 487 1 1 8 THR O O -1.829 0.322 1.458 1.00 . A A . 8 THR O 1 1
4 488 1 1 8 THR OG1 O -1.875 3.589 -1.891 1.00 . A A . 8 THR OG1 1 1
4 489 1 1 9 PHE C C -3.716 -1.973 -1.345 1.00 . A A . 9 PHE C 1 1
4 490 1 1 9 PHE CA C -3.574 -1.222 -0.036 1.00 . A A . 9 PHE CA 1 1
4 491 1 1 9 PHE CB C -4.859 -1.312 0.749 1.00 . A A . 9 PHE CB 1 1
4 492 1 1 9 PHE CD1 C -4.505 -0.212 2.977 1.00 . A A . 9 PHE CD1 1 1
4 493 1 1 9 PHE CD2 C -4.609 -2.595 2.892 1.00 . A A . 9 PHE CD2 1 1
4 494 1 1 9 PHE CE1 C -4.315 -0.267 4.344 1.00 . A A . 9 PHE CE1 1 1
4 495 1 1 9 PHE CE2 C -4.419 -2.654 4.259 1.00 . A A . 9 PHE CE2 1 1
4 496 1 1 9 PHE CG C -4.655 -1.374 2.235 1.00 . A A . 9 PHE CG 1 1
4 497 1 1 9 PHE CZ C -4.272 -1.489 4.987 1.00 . A A . 9 PHE CZ 1 1
4 498 1 1 9 PHE H H -3.664 0.646 -0.976 1.00 . A A . 9 PHE H 1 1
4 499 1 1 9 PHE HA H -2.778 -1.650 0.516 1.00 . A A . 9 PHE HA 1 1
4 500 1 1 9 PHE HB2 H -5.445 -0.439 0.520 1.00 . A A . 9 PHE HB2 1 1
4 501 1 1 9 PHE HB3 H -5.397 -2.188 0.441 1.00 . A A . 9 PHE HB3 1 1
4 502 1 1 9 PHE HD1 H -4.539 0.744 2.477 1.00 . A A . 9 PHE HD1 1 1
4 503 1 1 9 PHE HD2 H -4.724 -3.505 2.323 1.00 . A A . 9 PHE HD2 1 1
4 504 1 1 9 PHE HE1 H -4.200 0.645 4.911 1.00 . A A . 9 PHE HE1 1 1
4 505 1 1 9 PHE HE2 H -4.384 -3.611 4.759 1.00 . A A . 9 PHE HE2 1 1
4 506 1 1 9 PHE HZ H -4.122 -1.534 6.055 1.00 . A A . 9 PHE HZ 1 1
4 507 1 1 9 PHE N N -3.251 0.174 -0.255 1.00 . A A . 9 PHE N 1 1
4 508 1 1 9 PHE O O -4.151 -3.124 -1.386 1.00 . A A . 9 PHE O 1 1
4 509 1 1 10 GLY C C -2.327 -2.904 -3.974 1.00 . A A . 10 GLY C 1 1
4 510 1 1 10 GLY CA C -3.410 -1.871 -3.731 1.00 . A A . 10 GLY CA 1 1
4 511 1 1 10 GLY H H -3.011 -0.397 -2.264 1.00 . A A . 10 GLY H 1 1
4 512 1 1 10 GLY HA2 H -4.375 -2.340 -3.860 1.00 . A A . 10 GLY HA2 1 1
4 513 1 1 10 GLY HA3 H -3.306 -1.078 -4.456 1.00 . A A . 10 GLY HA3 1 1
4 514 1 1 10 GLY N N -3.341 -1.300 -2.399 1.00 . A A . 10 GLY N 1 1
4 515 1 1 10 GLY O O -2.640 -3.969 -4.545 1.00 . A A . 10 GLY O 1 1
4 516 1 1 10 GLY OXT O -1.166 -2.646 -3.594 1.00 . A A . 10 GLY OXT 1 1
5 517 1 1 1 GLY C C -1.242 -5.181 0.507 1.00 . A A . 1 GLY C 1 1
5 518 1 1 1 GLY CA C -1.487 -6.678 0.479 1.00 . A A . 1 GLY CA 1 1
5 519 1 1 1 GLY H1 H -3.060 -6.312 1.804 1.00 . A A . 1 GLY H1 1 1
5 520 1 1 1 GLY H2 H -2.642 -7.946 1.670 1.00 . A A . 1 GLY H2 1 1
5 521 1 1 1 GLY H3 H -3.510 -7.191 0.431 1.00 . A A . 1 GLY H3 1 1
5 522 1 1 1 GLY HA2 H -0.670 -7.175 0.981 1.00 . A A . 1 GLY HA2 1 1
5 523 1 1 1 GLY HA3 H -1.516 -7.006 -0.549 1.00 . A A . 1 GLY HA3 1 1
5 524 1 1 1 GLY N N -2.764 -7.059 1.142 1.00 . A A . 1 GLY N 1 1
5 525 1 1 1 GLY O O -1.451 -4.493 -0.491 1.00 . A A . 1 GLY O 1 1
5 526 1 1 2 TYR C C 0.571 -2.804 0.854 1.00 . A A . 2 TYR C 1 1
5 527 1 1 2 TYR CA C -0.521 -3.258 1.811 1.00 . A A . 2 TYR CA 1 1
5 528 1 1 2 TYR CB C -0.100 -2.947 3.249 1.00 . A A . 2 TYR CB 1 1
5 529 1 1 2 TYR CD1 C -0.786 -0.572 3.743 1.00 . A A . 2 TYR CD1 1 1
5 530 1 1 2 TYR CD2 C 1.534 -1.022 3.432 1.00 . A A . 2 TYR CD2 1 1
5 531 1 1 2 TYR CE1 C -0.503 0.765 3.952 1.00 . A A . 2 TYR CE1 1 1
5 532 1 1 2 TYR CE2 C 1.825 0.311 3.639 1.00 . A A . 2 TYR CE2 1 1
5 533 1 1 2 TYR CG C 0.222 -1.486 3.480 1.00 . A A . 2 TYR CG 1 1
5 534 1 1 2 TYR CZ C 0.804 1.201 3.899 1.00 . A A . 2 TYR CZ 1 1
5 535 1 1 2 TYR H H -0.649 -5.277 2.413 1.00 . A A . 2 TYR H 1 1
5 536 1 1 2 TYR HA H -1.429 -2.716 1.587 1.00 . A A . 2 TYR HA 1 1
5 537 1 1 2 TYR HB2 H -0.903 -3.220 3.918 1.00 . A A . 2 TYR HB2 1 1
5 538 1 1 2 TYR HB3 H 0.780 -3.525 3.491 1.00 . A A . 2 TYR HB3 1 1
5 539 1 1 2 TYR HD1 H -1.809 -0.917 3.781 1.00 . A A . 2 TYR HD1 1 1
5 540 1 1 2 TYR HD2 H 2.332 -1.717 3.227 1.00 . A A . 2 TYR HD2 1 1
5 541 1 1 2 TYR HE1 H -1.304 1.461 4.155 1.00 . A A . 2 TYR HE1 1 1
5 542 1 1 2 TYR HE2 H 2.849 0.650 3.596 1.00 . A A . 2 TYR HE2 1 1
5 543 1 1 2 TYR HH H 1.887 2.608 4.637 1.00 . A A . 2 TYR HH 1 1
5 544 1 1 2 TYR N N -0.796 -4.679 1.654 1.00 . A A . 2 TYR N 1 1
5 545 1 1 2 TYR O O 1.641 -3.407 0.791 1.00 . A A . 2 TYR O 1 1
5 546 1 1 2 TYR OH O 1.091 2.531 4.107 1.00 . A A . 2 TYR OH 1 1
5 547 1 1 3 ASP C C 2.132 -0.141 -0.108 1.00 . A A . 3 ASP C 1 1
5 548 1 1 3 ASP CA C 1.253 -1.172 -0.814 1.00 . A A . 3 ASP CA 1 1
5 549 1 1 3 ASP CB C 0.527 -0.523 -1.995 1.00 . A A . 3 ASP CB 1 1
5 550 1 1 3 ASP CG C 1.367 -0.515 -3.258 1.00 . A A . 3 ASP CG 1 1
5 551 1 1 3 ASP H H -0.567 -1.295 0.234 1.00 . A A . 3 ASP H 1 1
5 552 1 1 3 ASP HA H 1.866 -1.977 -1.174 1.00 . A A . 3 ASP HA 1 1
5 553 1 1 3 ASP HB2 H -0.383 -1.069 -2.195 1.00 . A A . 3 ASP HB2 1 1
5 554 1 1 3 ASP HB3 H 0.281 0.498 -1.742 1.00 . A A . 3 ASP HB3 1 1
5 555 1 1 3 ASP N N 0.295 -1.730 0.126 1.00 . A A . 3 ASP N 1 1
5 556 1 1 3 ASP O O 1.682 0.966 0.181 1.00 . A A . 3 ASP O 1 1
5 557 1 1 3 ASP OD1 O 2.573 -0.202 -3.167 1.00 . A A . 3 ASP OD1 1 1
5 558 1 1 3 ASP OD2 O 0.818 -0.823 -4.337 1.00 . A A . 3 ASP OD2 1 1
5 559 1 1 4 PRO C C 4.834 1.531 0.046 1.00 . A A . 4 PRO C 1 1
5 560 1 1 4 PRO CA C 4.310 0.397 0.920 1.00 . A A . 4 PRO CA 1 1
5 561 1 1 4 PRO CB C 5.460 -0.523 1.345 1.00 . A A . 4 PRO CB 1 1
5 562 1 1 4 PRO CD C 4.021 -1.790 -0.050 1.00 . A A . 4 PRO CD 1 1
5 563 1 1 4 PRO CG C 4.946 -1.897 1.132 1.00 . A A . 4 PRO CG 1 1
5 564 1 1 4 PRO HA H 3.846 0.805 1.799 1.00 . A A . 4 PRO HA 1 1
5 565 1 1 4 PRO HB2 H 6.331 -0.326 0.738 1.00 . A A . 4 PRO HB2 1 1
5 566 1 1 4 PRO HB3 H 5.688 -0.351 2.385 1.00 . A A . 4 PRO HB3 1 1
5 567 1 1 4 PRO HD2 H 4.568 -1.773 -0.991 1.00 . A A . 4 PRO HD2 1 1
5 568 1 1 4 PRO HD3 H 3.298 -2.584 -0.042 1.00 . A A . 4 PRO HD3 1 1
5 569 1 1 4 PRO HG2 H 5.765 -2.580 0.940 1.00 . A A . 4 PRO HG2 1 1
5 570 1 1 4 PRO HG3 H 4.397 -2.201 2.006 1.00 . A A . 4 PRO HG3 1 1
5 571 1 1 4 PRO N N 3.390 -0.495 0.212 1.00 . A A . 4 PRO N 1 1
5 572 1 1 4 PRO O O 5.089 2.634 0.531 1.00 . A A . 4 PRO O 1 1
5 573 1 1 5 ALA C C 4.581 3.467 -2.215 1.00 . A A . 5 ALA C 1 1
5 574 1 1 5 ALA CA C 5.495 2.250 -2.180 1.00 . A A . 5 ALA CA 1 1
5 575 1 1 5 ALA CB C 5.629 1.645 -3.571 1.00 . A A . 5 ALA CB 1 1
5 576 1 1 5 ALA H H 4.776 0.358 -1.567 1.00 . A A . 5 ALA H 1 1
5 577 1 1 5 ALA HA H 6.477 2.556 -1.851 1.00 . A A . 5 ALA HA 1 1
5 578 1 1 5 ALA HB1 H 4.666 1.284 -3.900 1.00 . A A . 5 ALA HB1 1 1
5 579 1 1 5 ALA HB2 H 6.330 0.824 -3.541 1.00 . A A . 5 ALA HB2 1 1
5 580 1 1 5 ALA HB3 H 5.986 2.398 -4.258 1.00 . A A . 5 ALA HB3 1 1
5 581 1 1 5 ALA N N 4.997 1.253 -1.242 1.00 . A A . 5 ALA N 1 1
5 582 1 1 5 ALA O O 5.026 4.597 -2.012 1.00 . A A . 5 ALA O 1 1
5 583 1 1 6 THR C C 1.729 4.542 -1.145 1.00 . A A . 6 THR C 1 1
5 584 1 1 6 THR CA C 2.322 4.283 -2.531 1.00 . A A . 6 THR CA 1 1
5 585 1 1 6 THR CB C 1.231 3.898 -3.529 1.00 . A A . 6 THR CB 1 1
5 586 1 1 6 THR CG2 C 0.012 4.782 -3.461 1.00 . A A . 6 THR CG2 1 1
5 587 1 1 6 THR H H 3.009 2.310 -2.622 1.00 . A A . 6 THR H 1 1
5 588 1 1 6 THR HA H 2.818 5.172 -2.875 1.00 . A A . 6 THR HA 1 1
5 589 1 1 6 THR HB H 0.914 2.884 -3.325 1.00 . A A . 6 THR HB 1 1
5 590 1 1 6 THR HG1 H 1.188 3.385 -5.417 1.00 . A A . 6 THR HG1 1 1
5 591 1 1 6 THR HG21 H -0.250 4.944 -2.429 1.00 . A A . 6 THR HG21 1 1
5 592 1 1 6 THR HG22 H -0.806 4.301 -3.970 1.00 . A A . 6 THR HG22 1 1
5 593 1 1 6 THR HG23 H 0.230 5.727 -3.931 1.00 . A A . 6 THR HG23 1 1
5 594 1 1 6 THR N N 3.303 3.225 -2.471 1.00 . A A . 6 THR N 1 1
5 595 1 1 6 THR O O 1.305 5.655 -0.837 1.00 . A A . 6 THR O 1 1
5 596 1 1 6 THR OG1 O 1.723 3.950 -4.855 1.00 . A A . 6 THR OG1 1 1
5 597 1 1 7 GLY C C -0.325 3.447 1.080 1.00 . A A . 7 GLY C 1 1
5 598 1 1 7 GLY CA C 1.176 3.624 1.023 1.00 . A A . 7 GLY CA 1 1
5 599 1 1 7 GLY H H 2.064 2.645 -0.615 1.00 . A A . 7 GLY H 1 1
5 600 1 1 7 GLY HA2 H 1.630 2.866 1.640 1.00 . A A . 7 GLY HA2 1 1
5 601 1 1 7 GLY HA3 H 1.434 4.593 1.410 1.00 . A A . 7 GLY HA3 1 1
5 602 1 1 7 GLY N N 1.709 3.501 -0.316 1.00 . A A . 7 GLY N 1 1
5 603 1 1 7 GLY O O -1.004 4.068 1.897 1.00 . A A . 7 GLY O 1 1
5 604 1 1 8 THR C C -2.461 0.846 0.494 1.00 . A A . 8 THR C 1 1
5 605 1 1 8 THR CA C -2.227 2.307 0.137 1.00 . A A . 8 THR CA 1 1
5 606 1 1 8 THR CB C -2.704 2.627 -1.278 1.00 . A A . 8 THR CB 1 1
5 607 1 1 8 THR CG2 C -4.125 3.099 -1.316 1.00 . A A . 8 THR CG2 1 1
5 608 1 1 8 THR H H -0.269 2.132 -0.406 1.00 . A A . 8 THR H 1 1
5 609 1 1 8 THR HA H -2.748 2.920 0.831 1.00 . A A . 8 THR HA 1 1
5 610 1 1 8 THR HB H -2.626 1.742 -1.889 1.00 . A A . 8 THR HB 1 1
5 611 1 1 8 THR HG1 H -1.951 4.435 -1.323 1.00 . A A . 8 THR HG1 1 1
5 612 1 1 8 THR HG21 H -4.602 2.851 -0.383 1.00 . A A . 8 THR HG21 1 1
5 613 1 1 8 THR HG22 H -4.642 2.616 -2.128 1.00 . A A . 8 THR HG22 1 1
5 614 1 1 8 THR HG23 H -4.139 4.168 -1.458 1.00 . A A . 8 THR HG23 1 1
5 615 1 1 8 THR N N -0.840 2.592 0.211 1.00 . A A . 8 THR N 1 1
5 616 1 1 8 THR O O -1.870 0.316 1.431 1.00 . A A . 8 THR O 1 1
5 617 1 1 8 THR OG1 O -1.903 3.640 -1.859 1.00 . A A . 8 THR OG1 1 1
5 618 1 1 9 PHE C C -3.863 -1.887 -1.387 1.00 . A A . 9 PHE C 1 1
5 619 1 1 9 PHE CA C -3.665 -1.172 -0.064 1.00 . A A . 9 PHE CA 1 1
5 620 1 1 9 PHE CB C -4.929 -1.252 0.755 1.00 . A A . 9 PHE CB 1 1
5 621 1 1 9 PHE CD1 C -4.510 -0.178 2.985 1.00 . A A . 9 PHE CD1 1 1
5 622 1 1 9 PHE CD2 C -4.627 -2.558 2.877 1.00 . A A . 9 PHE CD2 1 1
5 623 1 1 9 PHE CE1 C -4.282 -0.248 4.348 1.00 . A A . 9 PHE CE1 1 1
5 624 1 1 9 PHE CE2 C -4.401 -2.633 4.239 1.00 . A A . 9 PHE CE2 1 1
5 625 1 1 9 PHE CG C -4.685 -1.330 2.236 1.00 . A A . 9 PHE CG 1 1
5 626 1 1 9 PHE CZ C -4.228 -1.477 4.975 1.00 . A A . 9 PHE CZ 1 1
5 627 1 1 9 PHE H H -3.737 0.715 -0.966 1.00 . A A . 9 PHE H 1 1
5 628 1 1 9 PHE HA H -2.860 -1.629 0.455 1.00 . A A . 9 PHE HA 1 1
5 629 1 1 9 PHE HB2 H -5.507 -0.368 0.551 1.00 . A A . 9 PHE HB2 1 1
5 630 1 1 9 PHE HB3 H -5.486 -2.118 0.455 1.00 . A A . 9 PHE HB3 1 1
5 631 1 1 9 PHE HD1 H -4.551 0.785 2.496 1.00 . A A . 9 PHE HD1 1 1
5 632 1 1 9 PHE HD2 H -4.762 -3.462 2.303 1.00 . A A . 9 PHE HD2 1 1
5 633 1 1 9 PHE HE1 H -4.148 0.657 4.920 1.00 . A A . 9 PHE HE1 1 1
5 634 1 1 9 PHE HE2 H -4.359 -3.596 4.726 1.00 . A A . 9 PHE HE2 1 1
5 635 1 1 9 PHE HZ H -4.051 -1.534 6.039 1.00 . A A . 9 PHE HZ 1 1
5 636 1 1 9 PHE N N -3.322 0.222 -0.261 1.00 . A A . 9 PHE N 1 1
5 637 1 1 9 PHE O O -4.335 -3.023 -1.444 1.00 . A A . 9 PHE O 1 1
5 638 1 1 10 GLY C C -2.271 -2.060 -4.397 1.00 . A A . 10 GLY C 1 1
5 639 1 1 10 GLY CA C -3.616 -1.737 -3.778 1.00 . A A . 10 GLY CA 1 1
5 640 1 1 10 GLY H H -3.134 -0.312 -2.288 1.00 . A A . 10 GLY H 1 1
5 641 1 1 10 GLY HA2 H -4.208 -2.640 -3.742 1.00 . A A . 10 GLY HA2 1 1
5 642 1 1 10 GLY HA3 H -4.122 -1.012 -4.399 1.00 . A A . 10 GLY HA3 1 1
5 643 1 1 10 GLY N N -3.494 -1.201 -2.435 1.00 . A A . 10 GLY N 1 1
5 644 1 1 10 GLY O O -1.360 -2.476 -3.652 1.00 . A A . 10 GLY O 1 1
5 645 1 1 10 GLY OXT O -2.129 -1.896 -5.627 1.00 . A A . 10 GLY OXT 1 1
6 646 1 1 1 GLY C C -1.340 -5.193 0.287 1.00 . A A . 1 GLY C 1 1
6 647 1 1 1 GLY CA C -1.606 -6.681 0.189 1.00 . A A . 1 GLY CA 1 1
6 648 1 1 1 GLY H1 H -3.541 -6.238 0.837 1.00 . A A . 1 GLY H1 1 1
6 649 1 1 1 GLY H2 H -3.156 -7.883 0.907 1.00 . A A . 1 GLY H2 1 1
6 650 1 1 1 GLY H3 H -3.488 -7.157 -0.584 1.00 . A A . 1 GLY H3 1 1
6 651 1 1 1 GLY HA2 H -1.045 -7.189 0.958 1.00 . A A . 1 GLY HA2 1 1
6 652 1 1 1 GLY HA3 H -1.273 -7.032 -0.777 1.00 . A A . 1 GLY HA3 1 1
6 653 1 1 1 GLY N N -3.050 -7.013 0.348 1.00 . A A . 1 GLY N 1 1
6 654 1 1 1 GLY O O -1.555 -4.450 -0.671 1.00 . A A . 1 GLY O 1 1
6 655 1 1 2 TYR C C 0.531 -2.867 0.742 1.00 . A A . 2 TYR C 1 1
6 656 1 1 2 TYR CA C -0.572 -3.346 1.673 1.00 . A A . 2 TYR CA 1 1
6 657 1 1 2 TYR CB C -0.155 -3.109 3.126 1.00 . A A . 2 TYR CB 1 1
6 658 1 1 2 TYR CD1 C -0.903 -0.787 3.763 1.00 . A A . 2 TYR CD1 1 1
6 659 1 1 2 TYR CD2 C 1.426 -1.154 3.421 1.00 . A A . 2 TYR CD2 1 1
6 660 1 1 2 TYR CE1 C -0.655 0.541 4.053 1.00 . A A . 2 TYR CE1 1 1
6 661 1 1 2 TYR CE2 C 1.683 0.171 3.710 1.00 . A A . 2 TYR CE2 1 1
6 662 1 1 2 TYR CG C 0.129 -1.657 3.443 1.00 . A A . 2 TYR CG 1 1
6 663 1 1 2 TYR CZ C 0.640 1.015 4.025 1.00 . A A . 2 TYR CZ 1 1
6 664 1 1 2 TYR H H -0.718 -5.391 2.174 1.00 . A A . 2 TYR H 1 1
6 665 1 1 2 TYR HA H -1.469 -2.781 1.472 1.00 . A A . 2 TYR HA 1 1
6 666 1 1 2 TYR HB2 H -0.946 -3.442 3.780 1.00 . A A . 2 TYR HB2 1 1
6 667 1 1 2 TYR HB3 H 0.741 -3.677 3.334 1.00 . A A . 2 TYR HB3 1 1
6 668 1 1 2 TYR HD1 H -1.916 -1.161 3.782 1.00 . A A . 2 TYR HD1 1 1
6 669 1 1 2 TYR HD2 H 2.243 -1.813 3.174 1.00 . A A . 2 TYR HD2 1 1
6 670 1 1 2 TYR HE1 H -1.473 1.201 4.301 1.00 . A A . 2 TYR HE1 1 1
6 671 1 1 2 TYR HE2 H 2.698 0.539 3.686 1.00 . A A . 2 TYR HE2 1 1
6 672 1 1 2 TYR HH H 1.492 2.698 3.658 1.00 . A A . 2 TYR HH 1 1
6 673 1 1 2 TYR N N -0.869 -4.754 1.450 1.00 . A A . 2 TYR N 1 1
6 674 1 1 2 TYR O O 1.586 -3.491 0.643 1.00 . A A . 2 TYR O 1 1
6 675 1 1 2 TYR OH O 0.891 2.336 4.314 1.00 . A A . 2 TYR OH 1 1
6 676 1 1 3 ASP C C 2.105 -0.138 -0.108 1.00 . A A . 3 ASP C 1 1
6 677 1 1 3 ASP CA C 1.249 -1.166 -0.843 1.00 . A A . 3 ASP CA 1 1
6 678 1 1 3 ASP CB C 0.537 -0.504 -2.024 1.00 . A A . 3 ASP CB 1 1
6 679 1 1 3 ASP CG C 1.393 -0.476 -3.275 1.00 . A A . 3 ASP CG 1 1
6 680 1 1 3 ASP H H -0.572 -1.302 0.203 1.00 . A A . 3 ASP H 1 1
6 681 1 1 3 ASP HA H 1.874 -1.958 -1.206 1.00 . A A . 3 ASP HA 1 1
6 682 1 1 3 ASP HB2 H -0.368 -1.051 -2.242 1.00 . A A . 3 ASP HB2 1 1
6 683 1 1 3 ASP HB3 H 0.285 0.512 -1.759 1.00 . A A . 3 ASP HB3 1 1
6 684 1 1 3 ASP N N 0.282 -1.749 0.070 1.00 . A A . 3 ASP N 1 1
6 685 1 1 3 ASP O O 1.642 0.963 0.189 1.00 . A A . 3 ASP O 1 1
6 686 1 1 3 ASP OD1 O 2.393 0.272 -3.292 1.00 . A A . 3 ASP OD1 1 1
6 687 1 1 3 ASP OD2 O 1.066 -1.203 -4.236 1.00 . A A . 3 ASP OD2 1 1
6 688 1 1 4 PRO C C 4.806 1.542 0.102 1.00 . A A . 4 PRO C 1 1
6 689 1 1 4 PRO CA C 4.263 0.405 0.958 1.00 . A A . 4 PRO CA 1 1
6 690 1 1 4 PRO CB C 5.406 -0.515 1.405 1.00 . A A . 4 PRO CB 1 1
6 691 1 1 4 PRO CD C 4.009 -1.770 -0.044 1.00 . A A . 4 PRO CD 1 1
6 692 1 1 4 PRO CG C 4.909 -1.888 1.156 1.00 . A A . 4 PRO CG 1 1
6 693 1 1 4 PRO HA H 3.779 0.805 1.829 1.00 . A A . 4 PRO HA 1 1
6 694 1 1 4 PRO HB2 H 6.292 -0.303 0.829 1.00 . A A . 4 PRO HB2 1 1
6 695 1 1 4 PRO HB3 H 5.599 -0.358 2.456 1.00 . A A . 4 PRO HB3 1 1
6 696 1 1 4 PRO HD2 H 4.575 -1.733 -0.972 1.00 . A A . 4 PRO HD2 1 1
6 697 1 1 4 PRO HD3 H 3.292 -2.570 -0.064 1.00 . A A . 4 PRO HD3 1 1
6 698 1 1 4 PRO HG2 H 5.738 -2.561 0.971 1.00 . A A . 4 PRO HG2 1 1
6 699 1 1 4 PRO HG3 H 4.344 -2.210 2.012 1.00 . A A . 4 PRO HG3 1 1
6 700 1 1 4 PRO N N 3.362 -0.486 0.225 1.00 . A A . 4 PRO N 1 1
6 701 1 1 4 PRO O O 5.049 2.644 0.596 1.00 . A A . 4 PRO O 1 1
6 702 1 1 5 ALA C C 4.591 3.478 -2.167 1.00 . A A . 5 ALA C 1 1
6 703 1 1 5 ALA CA C 5.514 2.270 -2.108 1.00 . A A . 5 ALA CA 1 1
6 704 1 1 5 ALA CB C 5.691 1.666 -3.492 1.00 . A A . 5 ALA CB 1 1
6 705 1 1 5 ALA H H 4.782 0.375 -1.516 1.00 . A A . 5 ALA H 1 1
6 706 1 1 5 ALA HA H 6.483 2.585 -1.749 1.00 . A A . 5 ALA HA 1 1
6 707 1 1 5 ALA HB1 H 4.772 1.770 -4.050 1.00 . A A . 5 ALA HB1 1 1
6 708 1 1 5 ALA HB2 H 5.941 0.621 -3.400 1.00 . A A . 5 ALA HB2 1 1
6 709 1 1 5 ALA HB3 H 6.485 2.183 -4.011 1.00 . A A . 5 ALA HB3 1 1
6 710 1 1 5 ALA N N 4.996 1.270 -1.183 1.00 . A A . 5 ALA N 1 1
6 711 1 1 5 ALA O O 5.012 4.608 -1.925 1.00 . A A . 5 ALA O 1 1
6 712 1 1 6 THR C C 1.732 4.559 -1.210 1.00 . A A . 6 THR C 1 1
6 713 1 1 6 THR CA C 2.340 4.275 -2.582 1.00 . A A . 6 THR CA 1 1
6 714 1 1 6 THR CB C 1.260 3.857 -3.580 1.00 . A A . 6 THR CB 1 1
6 715 1 1 6 THR CG2 C 0.040 4.739 -3.547 1.00 . A A . 6 THR CG2 1 1
6 716 1 1 6 THR H H 3.054 2.311 -2.670 1.00 . A A . 6 THR H 1 1
6 717 1 1 6 THR HA H 2.831 5.161 -2.942 1.00 . A A . 6 THR HA 1 1
6 718 1 1 6 THR HB H 0.948 2.849 -3.353 1.00 . A A . 6 THR HB 1 1
6 719 1 1 6 THR HG1 H 2.057 2.994 -5.148 1.00 . A A . 6 THR HG1 1 1
6 720 1 1 6 THR HG21 H -0.247 4.906 -2.523 1.00 . A A . 6 THR HG21 1 1
6 721 1 1 6 THR HG22 H -0.766 4.252 -4.073 1.00 . A A . 6 THR HG22 1 1
6 722 1 1 6 THR HG23 H 0.266 5.681 -4.019 1.00 . A A . 6 THR HG23 1 1
6 723 1 1 6 THR N N 3.331 3.227 -2.490 1.00 . A A . 6 THR N 1 1
6 724 1 1 6 THR O O 1.289 5.672 -0.932 1.00 . A A . 6 THR O 1 1
6 725 1 1 6 THR OG1 O 1.768 3.876 -4.903 1.00 . A A . 6 THR OG1 1 1
6 726 1 1 7 GLY C C -0.325 3.497 1.020 1.00 . A A . 7 GLY C 1 1
6 727 1 1 7 GLY CA C 1.175 3.687 0.975 1.00 . A A . 7 GLY CA 1 1
6 728 1 1 7 GLY H H 2.090 2.681 -0.630 1.00 . A A . 7 GLY H 1 1
6 729 1 1 7 GLY HA2 H 1.630 2.948 1.615 1.00 . A A . 7 GLY HA2 1 1
6 730 1 1 7 GLY HA3 H 1.417 4.667 1.342 1.00 . A A . 7 GLY HA3 1 1
6 731 1 1 7 GLY N N 1.720 3.539 -0.355 1.00 . A A . 7 GLY N 1 1
6 732 1 1 7 GLY O O -1.020 4.134 1.811 1.00 . A A . 7 GLY O 1 1
6 733 1 1 8 THR C C -2.435 0.885 0.554 1.00 . A A . 8 THR C 1 1
6 734 1 1 8 THR CA C -2.204 2.311 0.084 1.00 . A A . 8 THR CA 1 1
6 735 1 1 8 THR CB C -2.647 2.508 -1.365 1.00 . A A . 8 THR CB 1 1
6 736 1 1 8 THR CG2 C -4.056 3.006 -1.480 1.00 . A A . 8 THR CG2 1 1
6 737 1 1 8 THR H H -0.239 2.142 -0.430 1.00 . A A . 8 THR H 1 1
6 738 1 1 8 THR HA H -2.748 2.976 0.712 1.00 . A A . 8 THR HA 1 1
6 739 1 1 8 THR HB H -2.578 1.567 -1.890 1.00 . A A . 8 THR HB 1 1
6 740 1 1 8 THR HG1 H -1.923 4.309 -1.620 1.00 . A A . 8 THR HG1 1 1
6 741 1 1 8 THR HG21 H -4.712 2.341 -0.940 1.00 . A A . 8 THR HG21 1 1
6 742 1 1 8 THR HG22 H -4.342 3.036 -2.519 1.00 . A A . 8 THR HG22 1 1
6 743 1 1 8 THR HG23 H -4.114 3.995 -1.057 1.00 . A A . 8 THR HG23 1 1
6 744 1 1 8 THR N N -0.820 2.613 0.167 1.00 . A A . 8 THR N 1 1
6 745 1 1 8 THR O O -1.854 0.435 1.539 1.00 . A A . 8 THR O 1 1
6 746 1 1 8 THR OG1 O -1.811 3.444 -2.021 1.00 . A A . 8 THR OG1 1 1
6 747 1 1 9 PHE C C -3.732 -2.016 -1.116 1.00 . A A . 9 PHE C 1 1
6 748 1 1 9 PHE CA C -3.621 -1.178 0.144 1.00 . A A . 9 PHE CA 1 1
6 749 1 1 9 PHE CB C -4.929 -1.201 0.891 1.00 . A A . 9 PHE CB 1 1
6 750 1 1 9 PHE CD1 C -4.499 -2.128 3.182 1.00 . A A . 9 PHE CD1 1 1
6 751 1 1 9 PHE CD2 C -4.905 0.211 2.963 1.00 . A A . 9 PHE CD2 1 1
6 752 1 1 9 PHE CE1 C -4.352 -1.979 4.548 1.00 . A A . 9 PHE CE1 1 1
6 753 1 1 9 PHE CE2 C -4.758 0.368 4.328 1.00 . A A . 9 PHE CE2 1 1
6 754 1 1 9 PHE CG C -4.778 -1.036 2.376 1.00 . A A . 9 PHE CG 1 1
6 755 1 1 9 PHE CZ C -4.481 -0.729 5.121 1.00 . A A . 9 PHE CZ 1 1
6 756 1 1 9 PHE H H -3.691 0.628 -0.907 1.00 . A A . 9 PHE H 1 1
6 757 1 1 9 PHE HA H -2.847 -1.573 0.749 1.00 . A A . 9 PHE HA 1 1
6 758 1 1 9 PHE HB2 H -5.535 -0.392 0.518 1.00 . A A . 9 PHE HB2 1 1
6 759 1 1 9 PHE HB3 H -5.425 -2.132 0.699 1.00 . A A . 9 PHE HB3 1 1
6 760 1 1 9 PHE HD1 H -4.398 -3.106 2.733 1.00 . A A . 9 PHE HD1 1 1
6 761 1 1 9 PHE HD2 H -5.121 1.069 2.342 1.00 . A A . 9 PHE HD2 1 1
6 762 1 1 9 PHE HE1 H -4.135 -2.838 5.164 1.00 . A A . 9 PHE HE1 1 1
6 763 1 1 9 PHE HE2 H -4.859 1.346 4.774 1.00 . A A . 9 PHE HE2 1 1
6 764 1 1 9 PHE HZ H -4.366 -0.609 6.188 1.00 . A A . 9 PHE HZ 1 1
6 765 1 1 9 PHE N N -3.282 0.196 -0.160 1.00 . A A . 9 PHE N 1 1
6 766 1 1 9 PHE O O -4.199 -3.154 -1.095 1.00 . A A . 9 PHE O 1 1
6 767 1 1 10 GLY C C -4.693 -2.014 -4.144 1.00 . A A . 10 GLY C 1 1
6 768 1 1 10 GLY CA C -3.329 -2.091 -3.488 1.00 . A A . 10 GLY CA 1 1
6 769 1 1 10 GLY H H -2.944 -0.527 -2.113 1.00 . A A . 10 GLY H 1 1
6 770 1 1 10 GLY HA2 H -2.603 -1.626 -4.139 1.00 . A A . 10 GLY HA2 1 1
6 771 1 1 10 GLY HA3 H -3.064 -3.130 -3.355 1.00 . A A . 10 GLY HA3 1 1
6 772 1 1 10 GLY N N -3.296 -1.428 -2.199 1.00 . A A . 10 GLY N 1 1
6 773 1 1 10 GLY O O -5.672 -2.501 -3.539 1.00 . A A . 10 GLY O 1 1
6 774 1 1 10 GLY OXT O -4.785 -1.468 -5.264 1.00 . A A . 10 GLY OXT 1 1
7 775 1 1 1 GLY C C -1.256 -5.212 0.340 1.00 . A A . 1 GLY C 1 1
7 776 1 1 1 GLY CA C -1.513 -6.705 0.264 1.00 . A A . 1 GLY CA 1 1
7 777 1 1 1 GLY H1 H -3.065 -8.082 0.502 1.00 . A A . 1 GLY H1 1 1
7 778 1 1 1 GLY H2 H -3.585 -6.534 0.063 1.00 . A A . 1 GLY H2 1 1
7 779 1 1 1 GLY H3 H -3.073 -6.837 1.646 1.00 . A A . 1 GLY H3 1 1
7 780 1 1 1 GLY HA2 H -0.828 -7.211 0.927 1.00 . A A . 1 GLY HA2 1 1
7 781 1 1 1 GLY HA3 H -1.331 -7.040 -0.748 1.00 . A A . 1 GLY HA3 1 1
7 782 1 1 1 GLY N N -2.906 -7.065 0.645 1.00 . A A . 1 GLY N 1 1
7 783 1 1 1 GLY O O -1.440 -4.493 -0.642 1.00 . A A . 1 GLY O 1 1
7 784 1 1 2 TYR C C 0.554 -2.857 0.775 1.00 . A A . 2 TYR C 1 1
7 785 1 1 2 TYR CA C -0.545 -3.333 1.712 1.00 . A A . 2 TYR CA 1 1
7 786 1 1 2 TYR CB C -0.131 -3.072 3.161 1.00 . A A . 2 TYR CB 1 1
7 787 1 1 2 TYR CD1 C -0.865 -0.732 3.753 1.00 . A A . 2 TYR CD1 1 1
7 788 1 1 2 TYR CD2 C 1.464 -1.124 3.426 1.00 . A A . 2 TYR CD2 1 1
7 789 1 1 2 TYR CE1 C -0.608 0.599 4.018 1.00 . A A . 2 TYR CE1 1 1
7 790 1 1 2 TYR CE2 C 1.729 0.205 3.690 1.00 . A A . 2 TYR CE2 1 1
7 791 1 1 2 TYR CG C 0.163 -1.616 3.453 1.00 . A A . 2 TYR CG 1 1
7 792 1 1 2 TYR CZ C 0.690 1.063 3.986 1.00 . A A . 2 TYR CZ 1 1
7 793 1 1 2 TYR H H -0.701 -5.368 2.253 1.00 . A A . 2 TYR H 1 1
7 794 1 1 2 TYR HA H -1.449 -2.778 1.502 1.00 . A A . 2 TYR HA 1 1
7 795 1 1 2 TYR HB2 H -0.927 -3.387 3.820 1.00 . A A . 2 TYR HB2 1 1
7 796 1 1 2 TYR HB3 H 0.760 -3.642 3.382 1.00 . A A . 2 TYR HB3 1 1
7 797 1 1 2 TYR HD1 H -1.881 -1.099 3.775 1.00 . A A . 2 TYR HD1 1 1
7 798 1 1 2 TYR HD2 H 2.277 -1.793 3.194 1.00 . A A . 2 TYR HD2 1 1
7 799 1 1 2 TYR HE1 H -1.422 1.271 4.250 1.00 . A A . 2 TYR HE1 1 1
7 800 1 1 2 TYR HE2 H 2.747 0.566 3.663 1.00 . A A . 2 TYR HE2 1 1
7 801 1 1 2 TYR HH H 0.402 2.941 3.690 1.00 . A A . 2 TYR HH 1 1
7 802 1 1 2 TYR N N -0.830 -4.747 1.509 1.00 . A A . 2 TYR N 1 1
7 803 1 1 2 TYR O O 1.616 -3.471 0.688 1.00 . A A . 2 TYR O 1 1
7 804 1 1 2 TYR OH O 0.951 2.389 4.249 1.00 . A A . 2 TYR OH 1 1
7 805 1 1 3 ASP C C 2.117 -0.145 -0.104 1.00 . A A . 3 ASP C 1 1
7 806 1 1 3 ASP CA C 1.258 -1.174 -0.834 1.00 . A A . 3 ASP CA 1 1
7 807 1 1 3 ASP CB C 0.540 -0.514 -2.015 1.00 . A A . 3 ASP CB 1 1
7 808 1 1 3 ASP CG C 1.395 -0.481 -3.266 1.00 . A A . 3 ASP CG 1 1
7 809 1 1 3 ASP H H -0.564 -1.314 0.210 1.00 . A A . 3 ASP H 1 1
7 810 1 1 3 ASP HA H 1.881 -1.967 -1.199 1.00 . A A . 3 ASP HA 1 1
7 811 1 1 3 ASP HB2 H -0.362 -1.064 -2.233 1.00 . A A . 3 ASP HB2 1 1
7 812 1 1 3 ASP HB3 H 0.284 0.500 -1.749 1.00 . A A . 3 ASP HB3 1 1
7 813 1 1 3 ASP N N 0.293 -1.753 0.086 1.00 . A A . 3 ASP N 1 1
7 814 1 1 3 ASP O O 1.654 0.954 0.195 1.00 . A A . 3 ASP O 1 1
7 815 1 1 3 ASP OD1 O 2.162 -1.442 -3.488 1.00 . A A . 3 ASP OD1 1 1
7 816 1 1 3 ASP OD2 O 1.299 0.508 -4.024 1.00 . A A . 3 ASP OD2 1 1
7 817 1 1 4 PRO C C 4.814 1.542 0.090 1.00 . A A . 4 PRO C 1 1
7 818 1 1 4 PRO CA C 4.279 0.404 0.949 1.00 . A A . 4 PRO CA 1 1
7 819 1 1 4 PRO CB C 5.426 -0.515 1.389 1.00 . A A . 4 PRO CB 1 1
7 820 1 1 4 PRO CD C 4.025 -1.773 -0.053 1.00 . A A . 4 PRO CD 1 1
7 821 1 1 4 PRO CG C 4.929 -1.889 1.146 1.00 . A A . 4 PRO CG 1 1
7 822 1 1 4 PRO HA H 3.798 0.803 1.821 1.00 . A A . 4 PRO HA 1 1
7 823 1 1 4 PRO HB2 H 6.309 -0.303 0.805 1.00 . A A . 4 PRO HB2 1 1
7 824 1 1 4 PRO HB3 H 5.628 -0.356 2.437 1.00 . A A . 4 PRO HB3 1 1
7 825 1 1 4 PRO HD2 H 4.590 -1.732 -0.980 1.00 . A A . 4 PRO HD2 1 1
7 826 1 1 4 PRO HD3 H 3.311 -2.574 -0.071 1.00 . A A . 4 PRO HD3 1 1
7 827 1 1 4 PRO HG2 H 5.757 -2.563 0.959 1.00 . A A . 4 PRO HG2 1 1
7 828 1 1 4 PRO HG3 H 4.366 -2.210 2.004 1.00 . A A . 4 PRO HG3 1 1
7 829 1 1 4 PRO N N 3.375 -0.491 0.221 1.00 . A A . 4 PRO N 1 1
7 830 1 1 4 PRO O O 5.059 2.643 0.585 1.00 . A A . 4 PRO O 1 1
7 831 1 1 5 ALA C C 4.584 3.480 -2.173 1.00 . A A . 5 ALA C 1 1
7 832 1 1 5 ALA CA C 5.509 2.273 -2.122 1.00 . A A . 5 ALA CA 1 1
7 833 1 1 5 ALA CB C 5.677 1.674 -3.510 1.00 . A A . 5 ALA CB 1 1
7 834 1 1 5 ALA H H 4.783 0.376 -1.529 1.00 . A A . 5 ALA H 1 1
7 835 1 1 5 ALA HA H 6.481 2.589 -1.769 1.00 . A A . 5 ALA HA 1 1
7 836 1 1 5 ALA HB1 H 4.753 1.204 -3.814 1.00 . A A . 5 ALA HB1 1 1
7 837 1 1 5 ALA HB2 H 6.465 0.936 -3.490 1.00 . A A . 5 ALA HB2 1 1
7 838 1 1 5 ALA HB3 H 5.932 2.454 -4.211 1.00 . A A . 5 ALA HB3 1 1
7 839 1 1 5 ALA N N 4.996 1.271 -1.196 1.00 . A A . 5 ALA N 1 1
7 840 1 1 5 ALA O O 5.005 4.611 -1.929 1.00 . A A . 5 ALA O 1 1
7 841 1 1 6 THR C C 1.731 4.549 -1.193 1.00 . A A . 6 THR C 1 1
7 842 1 1 6 THR CA C 2.329 4.272 -2.571 1.00 . A A . 6 THR CA 1 1
7 843 1 1 6 THR CB C 1.244 3.853 -3.561 1.00 . A A . 6 THR CB 1 1
7 844 1 1 6 THR CG2 C 0.031 4.744 -3.535 1.00 . A A . 6 THR CG2 1 1
7 845 1 1 6 THR H H 3.046 2.311 -2.669 1.00 . A A . 6 THR H 1 1
7 846 1 1 6 THR HA H 2.814 5.161 -2.933 1.00 . A A . 6 THR HA 1 1
7 847 1 1 6 THR HB H 0.922 2.850 -3.322 1.00 . A A . 6 THR HB 1 1
7 848 1 1 6 THR HG1 H 1.342 3.136 -5.381 1.00 . A A . 6 THR HG1 1 1
7 849 1 1 6 THR HG21 H 0.254 5.669 -4.042 1.00 . A A . 6 THR HG21 1 1
7 850 1 1 6 THR HG22 H -0.235 4.948 -2.511 1.00 . A A . 6 THR HG22 1 1
7 851 1 1 6 THR HG23 H -0.788 4.247 -4.029 1.00 . A A . 6 THR HG23 1 1
7 852 1 1 6 THR N N 3.322 3.228 -2.489 1.00 . A A . 6 THR N 1 1
7 853 1 1 6 THR O O 1.296 5.663 -0.904 1.00 . A A . 6 THR O 1 1
7 854 1 1 6 THR OG1 O 1.745 3.853 -4.886 1.00 . A A . 6 THR OG1 1 1
7 855 1 1 7 GLY C C -0.322 3.481 1.035 1.00 . A A . 7 GLY C 1 1
7 856 1 1 7 GLY CA C 1.179 3.662 0.987 1.00 . A A . 7 GLY CA 1 1
7 857 1 1 7 GLY H H 2.079 2.664 -0.631 1.00 . A A . 7 GLY H 1 1
7 858 1 1 7 GLY HA2 H 1.632 2.914 1.616 1.00 . A A . 7 GLY HA2 1 1
7 859 1 1 7 GLY HA3 H 1.429 4.638 1.361 1.00 . A A . 7 GLY HA3 1 1
7 860 1 1 7 GLY N N 1.717 3.524 -0.347 1.00 . A A . 7 GLY N 1 1
7 861 1 1 7 GLY O O -1.009 4.115 1.835 1.00 . A A . 7 GLY O 1 1
7 862 1 1 8 THR C C -2.451 0.884 0.536 1.00 . A A . 8 THR C 1 1
7 863 1 1 8 THR CA C -2.211 2.318 0.092 1.00 . A A . 8 THR CA 1 1
7 864 1 1 8 THR CB C -2.655 2.544 -1.351 1.00 . A A . 8 THR CB 1 1
7 865 1 1 8 THR CG2 C -4.060 3.058 -1.454 1.00 . A A . 8 THR CG2 1 1
7 866 1 1 8 THR H H -0.247 2.141 -0.429 1.00 . A A . 8 THR H 1 1
7 867 1 1 8 THR HA H -2.748 2.975 0.734 1.00 . A A . 8 THR HA 1 1
7 868 1 1 8 THR HB H -2.597 1.612 -1.893 1.00 . A A . 8 THR HB 1 1
7 869 1 1 8 THR HG1 H -1.922 4.346 -1.588 1.00 . A A . 8 THR HG1 1 1
7 870 1 1 8 THR HG21 H -4.578 2.532 -2.237 1.00 . A A . 8 THR HG21 1 1
7 871 1 1 8 THR HG22 H -4.036 4.112 -1.676 1.00 . A A . 8 THR HG22 1 1
7 872 1 1 8 THR HG23 H -4.561 2.897 -0.513 1.00 . A A . 8 THR HG23 1 1
7 873 1 1 8 THR N N -0.825 2.609 0.176 1.00 . A A . 8 THR N 1 1
7 874 1 1 8 THR O O -1.868 0.411 1.511 1.00 . A A . 8 THR O 1 1
7 875 1 1 8 THR OG1 O -1.811 3.483 -1.995 1.00 . A A . 8 THR OG1 1 1
7 876 1 1 9 PHE C C -3.808 -1.965 -1.190 1.00 . A A . 9 PHE C 1 1
7 877 1 1 9 PHE CA C -3.654 -1.163 0.089 1.00 . A A . 9 PHE CA 1 1
7 878 1 1 9 PHE CB C -4.944 -1.190 0.868 1.00 . A A . 9 PHE CB 1 1
7 879 1 1 9 PHE CD1 C -4.557 -2.254 3.108 1.00 . A A . 9 PHE CD1 1 1
7 880 1 1 9 PHE CD2 C -4.762 0.120 2.998 1.00 . A A . 9 PHE CD2 1 1
7 881 1 1 9 PHE CE1 C -4.375 -2.177 4.475 1.00 . A A . 9 PHE CE1 1 1
7 882 1 1 9 PHE CE2 C -4.580 0.203 4.365 1.00 . A A . 9 PHE CE2 1 1
7 883 1 1 9 PHE CG C -4.752 -1.107 2.355 1.00 . A A . 9 PHE CG 1 1
7 884 1 1 9 PHE CZ C -4.386 -0.947 5.105 1.00 . A A . 9 PHE CZ 1 1
7 885 1 1 9 PHE H H -3.713 0.665 -0.925 1.00 . A A . 9 PHE H 1 1
7 886 1 1 9 PHE HA H -2.869 -1.582 0.663 1.00 . A A . 9 PHE HA 1 1
7 887 1 1 9 PHE HB2 H -5.537 -0.348 0.553 1.00 . A A . 9 PHE HB2 1 1
7 888 1 1 9 PHE HB3 H -5.471 -2.098 0.641 1.00 . A A . 9 PHE HB3 1 1
7 889 1 1 9 PHE HD1 H -4.547 -3.214 2.616 1.00 . A A . 9 PHE HD1 1 1
7 890 1 1 9 PHE HD2 H -4.913 1.020 2.420 1.00 . A A . 9 PHE HD2 1 1
7 891 1 1 9 PHE HE1 H -4.224 -3.079 5.051 1.00 . A A . 9 PHE HE1 1 1
7 892 1 1 9 PHE HE2 H -4.589 1.165 4.854 1.00 . A A . 9 PHE HE2 1 1
7 893 1 1 9 PHE HZ H -4.244 -0.885 6.174 1.00 . A A . 9 PHE HZ 1 1
7 894 1 1 9 PHE N N -3.304 0.215 -0.187 1.00 . A A . 9 PHE N 1 1
7 895 1 1 9 PHE O O -4.285 -3.100 -1.188 1.00 . A A . 9 PHE O 1 1
7 896 1 1 10 GLY C C -4.383 -1.224 -4.525 1.00 . A A . 10 GLY C 1 1
7 897 1 1 10 GLY CA C -3.471 -1.975 -3.575 1.00 . A A . 10 GLY CA 1 1
7 898 1 1 10 GLY H H -3.035 -0.455 -2.166 1.00 . A A . 10 GLY H 1 1
7 899 1 1 10 GLY HA2 H -2.479 -2.014 -4.000 1.00 . A A . 10 GLY HA2 1 1
7 900 1 1 10 GLY HA3 H -3.841 -2.984 -3.461 1.00 . A A . 10 GLY HA3 1 1
7 901 1 1 10 GLY N N -3.396 -1.351 -2.267 1.00 . A A . 10 GLY N 1 1
7 902 1 1 10 GLY O O -4.125 -0.029 -4.775 1.00 . A A . 10 GLY O 1 1
7 903 1 1 10 GLY OXT O -5.356 -1.831 -5.021 1.00 . A A . 10 GLY OXT 1 1
8 904 1 1 1 GLY C C -1.377 -5.057 0.694 1.00 . A A . 1 GLY C 1 1
8 905 1 1 1 GLY CA C -1.647 -6.550 0.713 1.00 . A A . 1 GLY CA 1 1
8 906 1 1 1 GLY H1 H -1.152 -8.172 -0.506 1.00 . A A . 1 GLY H1 1 1
8 907 1 1 1 GLY H2 H -0.717 -6.672 -1.153 1.00 . A A . 1 GLY H2 1 1
8 908 1 1 1 GLY H3 H -2.336 -7.157 -1.162 1.00 . A A . 1 GLY H3 1 1
8 909 1 1 1 GLY HA2 H -2.666 -6.716 1.030 1.00 . A A . 1 GLY HA2 1 1
8 910 1 1 1 GLY HA3 H -0.980 -7.016 1.423 1.00 . A A . 1 GLY HA3 1 1
8 911 1 1 1 GLY N N -1.449 -7.182 -0.620 1.00 . A A . 1 GLY N 1 1
8 912 1 1 1 GLY O O -1.590 -4.394 -0.320 1.00 . A A . 1 GLY O 1 1
8 913 1 1 2 TYR C C 0.479 -2.701 0.947 1.00 . A A . 2 TYR C 1 1
8 914 1 1 2 TYR CA C -0.608 -3.109 1.932 1.00 . A A . 2 TYR CA 1 1
8 915 1 1 2 TYR CB C -0.158 -2.766 3.354 1.00 . A A . 2 TYR CB 1 1
8 916 1 1 2 TYR CD1 C -0.740 -0.349 3.771 1.00 . A A . 2 TYR CD1 1 1
8 917 1 1 2 TYR CD2 C 1.557 -0.903 3.447 1.00 . A A . 2 TYR CD2 1 1
8 918 1 1 2 TYR CE1 C -0.401 0.980 3.927 1.00 . A A . 2 TYR CE1 1 1
8 919 1 1 2 TYR CE2 C 1.903 0.424 3.603 1.00 . A A . 2 TYR CE2 1 1
8 920 1 1 2 TYR CG C 0.229 -1.313 3.529 1.00 . A A . 2 TYR CG 1 1
8 921 1 1 2 TYR CZ C 0.920 1.362 3.842 1.00 . A A . 2 TYR CZ 1 1
8 922 1 1 2 TYR H H -0.758 -5.109 2.592 1.00 . A A . 2 TYR H 1 1
8 923 1 1 2 TYR HA H -1.508 -2.558 1.708 1.00 . A A . 2 TYR HA 1 1
8 924 1 1 2 TYR HB2 H -0.963 -2.979 4.040 1.00 . A A . 2 TYR HB2 1 1
8 925 1 1 2 TYR HB3 H 0.699 -3.372 3.610 1.00 . A A . 2 TYR HB3 1 1
8 926 1 1 2 TYR HD1 H -1.774 -0.654 3.833 1.00 . A A . 2 TYR HD1 1 1
8 927 1 1 2 TYR HD2 H 2.326 -1.636 3.256 1.00 . A A . 2 TYR HD2 1 1
8 928 1 1 2 TYR HE1 H -1.173 1.713 4.114 1.00 . A A . 2 TYR HE1 1 1
8 929 1 1 2 TYR HE2 H 2.939 0.721 3.536 1.00 . A A . 2 TYR HE2 1 1
8 930 1 1 2 TYR HH H 0.626 3.237 3.536 1.00 . A A . 2 TYR HH 1 1
8 931 1 1 2 TYR N N -0.908 -4.529 1.820 1.00 . A A . 2 TYR N 1 1
8 932 1 1 2 TYR O O 1.542 -3.314 0.897 1.00 . A A . 2 TYR O 1 1
8 933 1 1 2 TYR OH O 1.262 2.686 3.999 1.00 . A A . 2 TYR OH 1 1
8 934 1 1 3 ASP C C 2.083 -0.120 -0.100 1.00 . A A . 3 ASP C 1 1
8 935 1 1 3 ASP CA C 1.163 -1.132 -0.780 1.00 . A A . 3 ASP CA 1 1
8 936 1 1 3 ASP CB C 0.436 -0.474 -1.954 1.00 . A A . 3 ASP CB 1 1
8 937 1 1 3 ASP CG C 1.255 -0.501 -3.230 1.00 . A A . 3 ASP CG 1 1
8 938 1 1 3 ASP H H -0.651 -1.200 0.289 1.00 . A A . 3 ASP H 1 1
8 939 1 1 3 ASP HA H 1.745 -1.958 -1.140 1.00 . A A . 3 ASP HA 1 1
8 940 1 1 3 ASP HB2 H -0.492 -0.996 -2.134 1.00 . A A . 3 ASP HB2 1 1
8 941 1 1 3 ASP HB3 H 0.222 0.555 -1.706 1.00 . A A . 3 ASP HB3 1 1
8 942 1 1 3 ASP N N 0.207 -1.648 0.187 1.00 . A A . 3 ASP N 1 1
8 943 1 1 3 ASP O O 1.669 1.001 0.191 1.00 . A A . 3 ASP O 1 1
8 944 1 1 3 ASP OD1 O 2.233 0.270 -3.324 1.00 . A A . 3 ASP OD1 1 1
8 945 1 1 3 ASP OD2 O 0.919 -1.295 -4.133 1.00 . A A . 3 ASP OD2 1 1
8 946 1 1 4 PRO C C 4.819 1.491 -0.003 1.00 . A A . 4 PRO C 1 1
8 947 1 1 4 PRO CA C 4.296 0.365 0.882 1.00 . A A . 4 PRO CA 1 1
8 948 1 1 4 PRO CB C 5.437 -0.581 1.273 1.00 . A A . 4 PRO CB 1 1
8 949 1 1 4 PRO CD C 3.924 -1.821 -0.065 1.00 . A A . 4 PRO CD 1 1
8 950 1 1 4 PRO CG C 4.879 -1.943 1.092 1.00 . A A . 4 PRO CG 1 1
8 951 1 1 4 PRO HA H 3.866 0.779 1.775 1.00 . A A . 4 PRO HA 1 1
8 952 1 1 4 PRO HB2 H 6.287 -0.412 0.631 1.00 . A A . 4 PRO HB2 1 1
8 953 1 1 4 PRO HB3 H 5.707 -0.408 2.303 1.00 . A A . 4 PRO HB3 1 1
8 954 1 1 4 PRO HD2 H 4.445 -1.832 -1.020 1.00 . A A . 4 PRO HD2 1 1
8 955 1 1 4 PRO HD3 H 3.179 -2.596 -0.027 1.00 . A A . 4 PRO HD3 1 1
8 956 1 1 4 PRO HG2 H 5.672 -2.650 0.886 1.00 . A A . 4 PRO HG2 1 1
8 957 1 1 4 PRO HG3 H 4.345 -2.222 1.986 1.00 . A A . 4 PRO HG3 1 1
8 958 1 1 4 PRO N N 3.336 -0.508 0.199 1.00 . A A . 4 PRO N 1 1
8 959 1 1 4 PRO O O 5.124 2.581 0.481 1.00 . A A . 4 PRO O 1 1
8 960 1 1 5 ALA C C 4.540 3.450 -2.245 1.00 . A A . 5 ALA C 1 1
8 961 1 1 5 ALA CA C 5.422 2.209 -2.246 1.00 . A A . 5 ALA CA 1 1
8 962 1 1 5 ALA CB C 5.495 1.611 -3.643 1.00 . A A . 5 ALA CB 1 1
8 963 1 1 5 ALA H H 4.673 0.333 -1.621 1.00 . A A . 5 ALA H 1 1
8 964 1 1 5 ALA HA H 6.423 2.489 -1.947 1.00 . A A . 5 ALA HA 1 1
8 965 1 1 5 ALA HB1 H 6.483 1.209 -3.811 1.00 . A A . 5 ALA HB1 1 1
8 966 1 1 5 ALA HB2 H 5.291 2.380 -4.375 1.00 . A A . 5 ALA HB2 1 1
8 967 1 1 5 ALA HB3 H 4.764 0.822 -3.737 1.00 . A A . 5 ALA HB3 1 1
8 968 1 1 5 ALA N N 4.929 1.219 -1.297 1.00 . A A . 5 ALA N 1 1
8 969 1 1 5 ALA O O 5.018 4.567 -2.040 1.00 . A A . 5 ALA O 1 1
8 970 1 1 6 THR C C 1.723 4.567 -1.096 1.00 . A A . 6 THR C 1 1
8 971 1 1 6 THR CA C 2.294 4.327 -2.493 1.00 . A A . 6 THR CA 1 1
8 972 1 1 6 THR CB C 1.180 3.992 -3.489 1.00 . A A . 6 THR CB 1 1
8 973 1 1 6 THR CG2 C -0.042 4.863 -3.351 1.00 . A A . 6 THR CG2 1 1
8 974 1 1 6 THR H H 2.929 2.339 -2.622 1.00 . A A . 6 THR H 1 1
8 975 1 1 6 THR HA H 2.807 5.211 -2.823 1.00 . A A . 6 THR HA 1 1
8 976 1 1 6 THR HB H 0.874 2.967 -3.334 1.00 . A A . 6 THR HB 1 1
8 977 1 1 6 THR HG1 H 1.034 3.682 -5.417 1.00 . A A . 6 THR HG1 1 1
8 978 1 1 6 THR HG21 H -0.878 4.384 -3.834 1.00 . A A . 6 THR HG21 1 1
8 979 1 1 6 THR HG22 H 0.145 5.820 -3.814 1.00 . A A . 6 THR HG22 1 1
8 980 1 1 6 THR HG23 H -0.262 5.003 -2.305 1.00 . A A . 6 THR HG23 1 1
8 981 1 1 6 THR N N 3.249 3.245 -2.470 1.00 . A A . 6 THR N 1 1
8 982 1 1 6 THR O O 1.295 5.675 -0.769 1.00 . A A . 6 THR O 1 1
8 983 1 1 6 THR OG1 O 1.646 4.118 -4.821 1.00 . A A . 6 THR OG1 1 1
8 984 1 1 7 GLY C C -0.273 3.400 1.158 1.00 . A A . 7 GLY C 1 1
8 985 1 1 7 GLY CA C 1.220 3.624 1.074 1.00 . A A . 7 GLY CA 1 1
8 986 1 1 7 GLY H H 2.085 2.671 -0.589 1.00 . A A . 7 GLY H 1 1
8 987 1 1 7 GLY HA2 H 1.707 2.878 1.678 1.00 . A A . 7 GLY HA2 1 1
8 988 1 1 7 GLY HA3 H 1.455 4.599 1.459 1.00 . A A . 7 GLY HA3 1 1
8 989 1 1 7 GLY N N 1.728 3.522 -0.275 1.00 . A A . 7 GLY N 1 1
8 990 1 1 7 GLY O O -0.951 3.971 2.013 1.00 . A A . 7 GLY O 1 1
8 991 1 1 8 THR C C -2.336 0.745 0.437 1.00 . A A . 8 THR C 1 1
8 992 1 1 8 THR CA C -2.158 2.238 0.209 1.00 . A A . 8 THR CA 1 1
8 993 1 1 8 THR CB C -2.688 2.670 -1.156 1.00 . A A . 8 THR CB 1 1
8 994 1 1 8 THR CG2 C -4.126 3.085 -1.116 1.00 . A A . 8 THR CG2 1 1
8 995 1 1 8 THR H H -0.209 2.147 -0.377 1.00 . A A . 8 THR H 1 1
8 996 1 1 8 THR HA H -2.678 2.769 0.971 1.00 . A A . 8 THR HA 1 1
8 997 1 1 8 THR HB H -2.593 1.848 -1.851 1.00 . A A . 8 THR HB 1 1
8 998 1 1 8 THR HG1 H -2.072 4.528 -1.092 1.00 . A A . 8 THR HG1 1 1
8 999 1 1 8 THR HG21 H -4.573 2.706 -0.211 1.00 . A A . 8 THR HG21 1 1
8 1000 1 1 8 THR HG22 H -4.641 2.683 -1.972 1.00 . A A . 8 THR HG22 1 1
8 1001 1 1 8 THR HG23 H -4.183 4.161 -1.126 1.00 . A A . 8 THR HG23 1 1
8 1002 1 1 8 THR N N -0.781 2.564 0.269 1.00 . A A . 8 THR N 1 1
8 1003 1 1 8 THR O O -1.695 0.152 1.302 1.00 . A A . 8 THR O 1 1
8 1004 1 1 8 THR OG1 O -1.943 3.764 -1.660 1.00 . A A . 8 THR OG1 1 1
8 1005 1 1 9 PHE C C -3.407 -1.915 -1.642 1.00 . A A . 9 PHE C 1 1
8 1006 1 1 9 PHE CA C -3.487 -1.263 -0.276 1.00 . A A . 9 PHE CA 1 1
8 1007 1 1 9 PHE CB C -4.867 -1.471 0.313 1.00 . A A . 9 PHE CB 1 1
8 1008 1 1 9 PHE CD1 C -4.170 -1.017 2.685 1.00 . A A . 9 PHE CD1 1 1
8 1009 1 1 9 PHE CD2 C -5.557 -2.907 2.250 1.00 . A A . 9 PHE CD2 1 1
8 1010 1 1 9 PHE CE1 C -4.167 -1.327 4.033 1.00 . A A . 9 PHE CE1 1 1
8 1011 1 1 9 PHE CE2 C -5.559 -3.221 3.596 1.00 . A A . 9 PHE CE2 1 1
8 1012 1 1 9 PHE CG C -4.866 -1.803 1.779 1.00 . A A . 9 PHE CG 1 1
8 1013 1 1 9 PHE CZ C -4.862 -2.430 4.488 1.00 . A A . 9 PHE CZ 1 1
8 1014 1 1 9 PHE H H -3.644 0.702 -1.001 1.00 . A A . 9 PHE H 1 1
8 1015 1 1 9 PHE HA H -2.754 -1.702 0.350 1.00 . A A . 9 PHE HA 1 1
8 1016 1 1 9 PHE HB2 H -5.426 -0.562 0.169 1.00 . A A . 9 PHE HB2 1 1
8 1017 1 1 9 PHE HB3 H -5.359 -2.274 -0.214 1.00 . A A . 9 PHE HB3 1 1
8 1018 1 1 9 PHE HD1 H -3.629 -0.152 2.334 1.00 . A A . 9 PHE HD1 1 1
8 1019 1 1 9 PHE HD2 H -6.103 -3.526 1.552 1.00 . A A . 9 PHE HD2 1 1
8 1020 1 1 9 PHE HE1 H -3.621 -0.708 4.729 1.00 . A A . 9 PHE HE1 1 1
8 1021 1 1 9 PHE HE2 H -6.102 -4.085 3.948 1.00 . A A . 9 PHE HE2 1 1
8 1022 1 1 9 PHE HZ H -4.860 -2.675 5.540 1.00 . A A . 9 PHE HZ 1 1
8 1023 1 1 9 PHE N N -3.196 0.159 -0.350 1.00 . A A . 9 PHE N 1 1
8 1024 1 1 9 PHE O O -3.734 -3.088 -1.821 1.00 . A A . 9 PHE O 1 1
8 1025 1 1 10 GLY C C -4.106 -1.424 -4.755 1.00 . A A . 10 GLY C 1 1
8 1026 1 1 10 GLY CA C -2.829 -1.589 -3.955 1.00 . A A . 10 GLY CA 1 1
8 1027 1 1 10 GLY H H -2.737 -0.217 -2.343 1.00 . A A . 10 GLY H 1 1
8 1028 1 1 10 GLY HA2 H -2.041 -1.027 -4.434 1.00 . A A . 10 GLY HA2 1 1
8 1029 1 1 10 GLY HA3 H -2.556 -2.635 -3.946 1.00 . A A . 10 GLY HA3 1 1
8 1030 1 1 10 GLY N N -2.968 -1.129 -2.586 1.00 . A A . 10 GLY N 1 1
8 1031 1 1 10 GLY O O -4.189 -0.464 -5.551 1.00 . A A . 10 GLY O 1 1
8 1032 1 1 10 GLY OXT O -5.024 -2.255 -4.588 1.00 . A A . 10 GLY OXT 1 1
9 1033 1 1 1 GLY C C -1.074 -5.336 0.358 1.00 . A A . 1 GLY C 1 1
9 1034 1 1 1 GLY CA C -1.278 -6.837 0.306 1.00 . A A . 1 GLY CA 1 1
9 1035 1 1 1 GLY H1 H -3.329 -6.514 0.081 1.00 . A A . 1 GLY H1 1 1
9 1036 1 1 1 GLY H2 H -2.913 -7.296 1.522 1.00 . A A . 1 GLY H2 1 1
9 1037 1 1 1 GLY H3 H -2.886 -8.148 0.060 1.00 . A A . 1 GLY H3 1 1
9 1038 1 1 1 GLY HA2 H -0.677 -7.299 1.075 1.00 . A A . 1 GLY HA2 1 1
9 1039 1 1 1 GLY HA3 H -0.950 -7.200 -0.657 1.00 . A A . 1 GLY HA3 1 1
9 1040 1 1 1 GLY N N -2.701 -7.225 0.506 1.00 . A A . 1 GLY N 1 1
9 1041 1 1 1 GLY O O -1.264 -4.641 -0.639 1.00 . A A . 1 GLY O 1 1
9 1042 1 1 2 TYR C C 0.655 -2.916 0.784 1.00 . A A . 2 TYR C 1 1
9 1043 1 1 2 TYR CA C -0.452 -3.410 1.706 1.00 . A A . 2 TYR CA 1 1
9 1044 1 1 2 TYR CB C -0.076 -3.107 3.160 1.00 . A A . 2 TYR CB 1 1
9 1045 1 1 2 TYR CD1 C -0.860 -0.765 3.671 1.00 . A A . 2 TYR CD1 1 1
9 1046 1 1 2 TYR CD2 C 1.483 -1.127 3.413 1.00 . A A . 2 TYR CD2 1 1
9 1047 1 1 2 TYR CE1 C -0.628 0.577 3.908 1.00 . A A . 2 TYR CE1 1 1
9 1048 1 1 2 TYR CE2 C 1.721 0.211 3.650 1.00 . A A . 2 TYR CE2 1 1
9 1049 1 1 2 TYR CG C 0.188 -1.640 3.420 1.00 . A A . 2 TYR CG 1 1
9 1050 1 1 2 TYR CZ C 0.663 1.059 3.896 1.00 . A A . 2 TYR CZ 1 1
9 1051 1 1 2 TYR H H -0.547 -5.438 2.282 1.00 . A A . 2 TYR H 1 1
9 1052 1 1 2 TYR HA H -1.366 -2.889 1.467 1.00 . A A . 2 TYR HA 1 1
9 1053 1 1 2 TYR HB2 H -0.885 -3.418 3.806 1.00 . A A . 2 TYR HB2 1 1
9 1054 1 1 2 TYR HB3 H 0.817 -3.658 3.416 1.00 . A A . 2 TYR HB3 1 1
9 1055 1 1 2 TYR HD1 H -1.869 -1.148 3.679 1.00 . A A . 2 TYR HD1 1 1
9 1056 1 1 2 TYR HD2 H 2.313 -1.791 3.219 1.00 . A A . 2 TYR HD2 1 1
9 1057 1 1 2 TYR HE1 H -1.459 1.240 4.102 1.00 . A A . 2 TYR HE1 1 1
9 1058 1 1 2 TYR HE2 H 2.734 0.587 3.637 1.00 . A A . 2 TYR HE2 1 1
9 1059 1 1 2 TYR HH H 0.354 2.924 3.542 1.00 . A A . 2 TYR HH 1 1
9 1060 1 1 2 TYR N N -0.683 -4.836 1.525 1.00 . A A . 2 TYR N 1 1
9 1061 1 1 2 TYR O O 1.739 -3.493 0.738 1.00 . A A . 2 TYR O 1 1
9 1062 1 1 2 TYR OH O 0.896 2.395 4.132 1.00 . A A . 2 TYR OH 1 1
9 1063 1 1 3 ASP C C 2.161 -0.189 -0.114 1.00 . A A . 3 ASP C 1 1
9 1064 1 1 3 ASP CA C 1.337 -1.244 -0.846 1.00 . A A . 3 ASP CA 1 1
9 1065 1 1 3 ASP CB C 0.623 -0.613 -2.044 1.00 . A A . 3 ASP CB 1 1
9 1066 1 1 3 ASP CG C 1.493 -0.580 -3.284 1.00 . A A . 3 ASP CG 1 1
9 1067 1 1 3 ASP H H -0.505 -1.426 0.158 1.00 . A A . 3 ASP H 1 1
9 1068 1 1 3 ASP HA H 1.983 -2.027 -1.194 1.00 . A A . 3 ASP HA 1 1
9 1069 1 1 3 ASP HB2 H -0.268 -1.182 -2.265 1.00 . A A . 3 ASP HB2 1 1
9 1070 1 1 3 ASP HB3 H 0.345 0.401 -1.793 1.00 . A A . 3 ASP HB3 1 1
9 1071 1 1 3 ASP N N 0.371 -1.838 0.064 1.00 . A A . 3 ASP N 1 1
9 1072 1 1 3 ASP O O 1.670 0.905 0.166 1.00 . A A . 3 ASP O 1 1
9 1073 1 1 3 ASP OD1 O 1.823 -1.666 -3.805 1.00 . A A . 3 ASP OD1 1 1
9 1074 1 1 3 ASP OD2 O 1.846 0.530 -3.734 1.00 . A A . 3 ASP OD2 1 1
9 1075 1 1 4 PRO C C 4.811 1.560 0.109 1.00 . A A . 4 PRO C 1 1
9 1076 1 1 4 PRO CA C 4.294 0.415 0.970 1.00 . A A . 4 PRO CA 1 1
9 1077 1 1 4 PRO CB C 5.456 -0.472 1.432 1.00 . A A . 4 PRO CB 1 1
9 1078 1 1 4 PRO CD C 4.100 -1.777 -0.011 1.00 . A A . 4 PRO CD 1 1
9 1079 1 1 4 PRO CG C 4.991 -1.861 1.199 1.00 . A A . 4 PRO CG 1 1
9 1080 1 1 4 PRO HA H 3.790 0.810 1.832 1.00 . A A . 4 PRO HA 1 1
9 1081 1 1 4 PRO HB2 H 6.339 -0.248 0.857 1.00 . A A . 4 PRO HB2 1 1
9 1082 1 1 4 PRO HB3 H 5.641 -0.298 2.482 1.00 . A A . 4 PRO HB3 1 1
9 1083 1 1 4 PRO HD2 H 4.675 -1.738 -0.933 1.00 . A A . 4 PRO HD2 1 1
9 1084 1 1 4 PRO HD3 H 3.402 -2.593 -0.028 1.00 . A A . 4 PRO HD3 1 1
9 1085 1 1 4 PRO HG2 H 5.835 -2.517 1.030 1.00 . A A . 4 PRO HG2 1 1
9 1086 1 1 4 PRO HG3 H 4.425 -2.184 2.055 1.00 . A A . 4 PRO HG3 1 1
9 1087 1 1 4 PRO N N 3.421 -0.505 0.237 1.00 . A A . 4 PRO N 1 1
9 1088 1 1 4 PRO O O 5.018 2.673 0.596 1.00 . A A . 4 PRO O 1 1
9 1089 1 1 5 ALA C C 4.563 3.471 -2.179 1.00 . A A . 5 ALA C 1 1
9 1090 1 1 5 ALA CA C 5.520 2.289 -2.099 1.00 . A A . 5 ALA CA 1 1
9 1091 1 1 5 ALA CB C 5.728 1.682 -3.478 1.00 . A A . 5 ALA CB 1 1
9 1092 1 1 5 ALA H H 4.838 0.378 -1.500 1.00 . A A . 5 ALA H 1 1
9 1093 1 1 5 ALA HA H 6.476 2.637 -1.735 1.00 . A A . 5 ALA HA 1 1
9 1094 1 1 5 ALA HB1 H 6.591 2.133 -3.945 1.00 . A A . 5 ALA HB1 1 1
9 1095 1 1 5 ALA HB2 H 4.855 1.862 -4.087 1.00 . A A . 5 ALA HB2 1 1
9 1096 1 1 5 ALA HB3 H 5.887 0.618 -3.382 1.00 . A A . 5 ALA HB3 1 1
9 1097 1 1 5 ALA N N 5.022 1.283 -1.173 1.00 . A A . 5 ALA N 1 1
9 1098 1 1 5 ALA O O 4.952 4.618 -1.957 1.00 . A A . 5 ALA O 1 1
9 1099 1 1 6 THR C C 1.704 4.513 -1.226 1.00 . A A . 6 THR C 1 1
9 1100 1 1 6 THR CA C 2.291 4.196 -2.602 1.00 . A A . 6 THR CA 1 1
9 1101 1 1 6 THR CB C 1.201 3.715 -3.559 1.00 . A A . 6 THR CB 1 1
9 1102 1 1 6 THR CG2 C -0.018 4.597 -3.572 1.00 . A A . 6 THR CG2 1 1
9 1103 1 1 6 THR H H 3.057 2.253 -2.658 1.00 . A A . 6 THR H 1 1
9 1104 1 1 6 THR HA H 2.750 5.082 -3.004 1.00 . A A . 6 THR HA 1 1
9 1105 1 1 6 THR HB H 0.889 2.724 -3.261 1.00 . A A . 6 THR HB 1 1
9 1106 1 1 6 THR HG1 H 2.047 2.769 -5.050 1.00 . A A . 6 THR HG1 1 1
9 1107 1 1 6 THR HG21 H -0.853 4.044 -3.972 1.00 . A A . 6 THR HG21 1 1
9 1108 1 1 6 THR HG22 H 0.172 5.462 -4.185 1.00 . A A . 6 THR HG22 1 1
9 1109 1 1 6 THR HG23 H -0.240 4.909 -2.564 1.00 . A A . 6 THR HG23 1 1
9 1110 1 1 6 THR N N 3.309 3.179 -2.494 1.00 . A A . 6 THR N 1 1
9 1111 1 1 6 THR O O 1.283 5.638 -0.960 1.00 . A A . 6 THR O 1 1
9 1112 1 1 6 THR OG1 O 1.694 3.647 -4.885 1.00 . A A . 6 THR OG1 1 1
9 1113 1 1 7 GLY C C -0.337 3.531 1.052 1.00 . A A . 7 GLY C 1 1
9 1114 1 1 7 GLY CA C 1.166 3.683 0.980 1.00 . A A . 7 GLY CA 1 1
9 1115 1 1 7 GLY H H 2.043 2.639 -0.623 1.00 . A A . 7 GLY H 1 1
9 1116 1 1 7 GLY HA2 H 1.611 2.940 1.619 1.00 . A A . 7 GLY HA2 1 1
9 1117 1 1 7 GLY HA3 H 1.439 4.661 1.333 1.00 . A A . 7 GLY HA3 1 1
9 1118 1 1 7 GLY N N 1.689 3.507 -0.357 1.00 . A A . 7 GLY N 1 1
9 1119 1 1 7 GLY O O -1.001 4.186 1.857 1.00 . A A . 7 GLY O 1 1
9 1120 1 1 8 THR C C -2.514 0.948 0.543 1.00 . A A . 8 THR C 1 1
9 1121 1 1 8 THR CA C -2.264 2.395 0.154 1.00 . A A . 8 THR CA 1 1
9 1122 1 1 8 THR CB C -2.746 2.694 -1.264 1.00 . A A . 8 THR CB 1 1
9 1123 1 1 8 THR CG2 C -4.163 3.181 -1.302 1.00 . A A . 8 THR CG2 1 1
9 1124 1 1 8 THR H H -0.312 2.176 -0.398 1.00 . A A . 8 THR H 1 1
9 1125 1 1 8 THR HA H -2.770 3.031 0.840 1.00 . A A . 8 THR HA 1 1
9 1126 1 1 8 THR HB H -2.684 1.794 -1.859 1.00 . A A . 8 THR HB 1 1
9 1127 1 1 8 THR HG1 H -2.013 4.504 -1.378 1.00 . A A . 8 THR HG1 1 1
9 1128 1 1 8 THR HG21 H -4.630 2.974 -0.354 1.00 . A A . 8 THR HG21 1 1
9 1129 1 1 8 THR HG22 H -4.695 2.674 -2.089 1.00 . A A . 8 THR HG22 1 1
9 1130 1 1 8 THR HG23 H -4.163 4.244 -1.483 1.00 . A A . 8 THR HG23 1 1
9 1131 1 1 8 THR N N -0.870 2.660 0.210 1.00 . A A . 8 THR N 1 1
9 1132 1 1 8 THR O O -1.923 0.430 1.489 1.00 . A A . 8 THR O 1 1
9 1133 1 1 8 THR OG1 O -1.938 3.684 -1.872 1.00 . A A . 8 THR OG1 1 1
9 1134 1 1 9 PHE C C -3.930 -1.821 -1.263 1.00 . A A . 9 PHE C 1 1
9 1135 1 1 9 PHE CA C -3.749 -1.066 0.040 1.00 . A A . 9 PHE CA 1 1
9 1136 1 1 9 PHE CB C -5.027 -1.106 0.837 1.00 . A A . 9 PHE CB 1 1
9 1137 1 1 9 PHE CD1 C -4.589 -2.222 3.039 1.00 . A A . 9 PHE CD1 1 1
9 1138 1 1 9 PHE CD2 C -4.834 0.149 2.999 1.00 . A A . 9 PHE CD2 1 1
9 1139 1 1 9 PHE CE1 C -4.387 -2.183 4.406 1.00 . A A . 9 PHE CE1 1 1
9 1140 1 1 9 PHE CE2 C -4.632 0.196 4.366 1.00 . A A . 9 PHE CE2 1 1
9 1141 1 1 9 PHE CG C -4.814 -1.059 2.322 1.00 . A A . 9 PHE CG 1 1
9 1142 1 1 9 PHE CZ C -4.408 -0.971 5.070 1.00 . A A . 9 PHE CZ 1 1
9 1143 1 1 9 PHE H H -3.804 0.799 -0.903 1.00 . A A . 9 PHE H 1 1
9 1144 1 1 9 PHE HA H -2.960 -1.515 0.589 1.00 . A A . 9 PHE HA 1 1
9 1145 1 1 9 PHE HB2 H -5.619 -0.252 0.550 1.00 . A A . 9 PHE HB2 1 1
9 1146 1 1 9 PHE HB3 H -5.562 -2.004 0.595 1.00 . A A . 9 PHE HB3 1 1
9 1147 1 1 9 PHE HD1 H -4.572 -3.170 2.522 1.00 . A A . 9 PHE HD1 1 1
9 1148 1 1 9 PHE HD2 H -5.007 1.062 2.448 1.00 . A A . 9 PHE HD2 1 1
9 1149 1 1 9 PHE HE1 H -4.211 -3.096 4.953 1.00 . A A . 9 PHE HE1 1 1
9 1150 1 1 9 PHE HE2 H -4.650 1.145 4.883 1.00 . A A . 9 PHE HE2 1 1
9 1151 1 1 9 PHE HZ H -4.250 -0.936 6.138 1.00 . A A . 9 PHE HZ 1 1
9 1152 1 1 9 PHE N N -3.388 0.317 -0.191 1.00 . A A . 9 PHE N 1 1
9 1153 1 1 9 PHE O O -4.423 -2.949 -1.294 1.00 . A A . 9 PHE O 1 1
9 1154 1 1 10 GLY C C -3.560 -0.708 -4.747 1.00 . A A . 10 GLY C 1 1
9 1155 1 1 10 GLY CA C -3.627 -1.754 -3.651 1.00 . A A . 10 GLY CA 1 1
9 1156 1 1 10 GLY H H -3.151 -0.288 -2.198 1.00 . A A . 10 GLY H 1 1
9 1157 1 1 10 GLY HA2 H -2.818 -2.456 -3.788 1.00 . A A . 10 GLY HA2 1 1
9 1158 1 1 10 GLY HA3 H -4.566 -2.283 -3.729 1.00 . A A . 10 GLY HA3 1 1
9 1159 1 1 10 GLY N N -3.525 -1.175 -2.325 1.00 . A A . 10 GLY N 1 1
9 1160 1 1 10 GLY O O -4.516 0.086 -4.867 1.00 . A A . 10 GLY O 1 1
9 1161 1 1 10 GLY OXT O -2.553 -0.685 -5.483 1.00 . A A . 10 GLY OXT 1 1
10 1162 1 1 1 GLY C C -0.933 -5.423 0.406 1.00 . A A . 1 GLY C 1 1
10 1163 1 1 1 GLY CA C -1.115 -6.928 0.387 1.00 . A A . 1 GLY CA 1 1
10 1164 1 1 1 GLY H1 H 0.188 -8.511 0.787 1.00 . A A . 1 GLY H1 1 1
10 1165 1 1 1 GLY H2 H -0.560 -7.874 2.165 1.00 . A A . 1 GLY H2 1 1
10 1166 1 1 1 GLY H3 H 0.699 -7.026 1.418 1.00 . A A . 1 GLY H3 1 1
10 1167 1 1 1 GLY HA2 H -1.006 -7.280 -0.629 1.00 . A A . 1 GLY HA2 1 1
10 1168 1 1 1 GLY HA3 H -2.112 -7.163 0.732 1.00 . A A . 1 GLY HA3 1 1
10 1169 1 1 1 GLY N N -0.129 -7.634 1.249 1.00 . A A . 1 GLY N 1 1
10 1170 1 1 1 GLY O O -1.099 -4.758 -0.615 1.00 . A A . 1 GLY O 1 1
10 1171 1 1 2 TYR C C 0.726 -2.959 0.808 1.00 . A A . 2 TYR C 1 1
10 1172 1 1 2 TYR CA C -0.383 -3.453 1.726 1.00 . A A . 2 TYR CA 1 1
10 1173 1 1 2 TYR CB C -0.031 -3.115 3.177 1.00 . A A . 2 TYR CB 1 1
10 1174 1 1 2 TYR CD1 C -0.843 -0.770 3.626 1.00 . A A . 2 TYR CD1 1 1
10 1175 1 1 2 TYR CD2 C 1.507 -1.114 3.398 1.00 . A A . 2 TYR CD2 1 1
10 1176 1 1 2 TYR CE1 C -0.628 0.580 3.833 1.00 . A A . 2 TYR CE1 1 1
10 1177 1 1 2 TYR CE2 C 1.728 0.233 3.604 1.00 . A A . 2 TYR CE2 1 1
10 1178 1 1 2 TYR CG C 0.216 -1.639 3.406 1.00 . A A . 2 TYR CG 1 1
10 1179 1 1 2 TYR CZ C 0.659 1.075 3.822 1.00 . A A . 2 TYR CZ 1 1
10 1180 1 1 2 TYR H H -0.472 -5.469 2.349 1.00 . A A . 2 TYR H 1 1
10 1181 1 1 2 TYR HA H -1.304 -2.954 1.463 1.00 . A A . 2 TYR HA 1 1
10 1182 1 1 2 TYR HB2 H -0.845 -3.417 3.817 1.00 . A A . 2 TYR HB2 1 1
10 1183 1 1 2 TYR HB3 H 0.863 -3.650 3.457 1.00 . A A . 2 TYR HB3 1 1
10 1184 1 1 2 TYR HD1 H -1.849 -1.163 3.632 1.00 . A A . 2 TYR HD1 1 1
10 1185 1 1 2 TYR HD2 H 2.344 -1.772 3.227 1.00 . A A . 2 TYR HD2 1 1
10 1186 1 1 2 TYR HE1 H -1.467 1.238 4.003 1.00 . A A . 2 TYR HE1 1 1
10 1187 1 1 2 TYR HE2 H 2.737 0.619 3.593 1.00 . A A . 2 TYR HE2 1 1
10 1188 1 1 2 TYR HH H 1.655 2.536 4.577 1.00 . A A . 2 TYR HH 1 1
10 1189 1 1 2 TYR N N -0.590 -4.887 1.573 1.00 . A A . 2 TYR N 1 1
10 1190 1 1 2 TYR O O 1.822 -3.514 0.789 1.00 . A A . 2 TYR O 1 1
10 1191 1 1 2 TYR OH O 0.877 2.418 4.028 1.00 . A A . 2 TYR OH 1 1
10 1192 1 1 3 ASP C C 2.199 -0.232 -0.117 1.00 . A A . 3 ASP C 1 1
10 1193 1 1 3 ASP CA C 1.398 -1.307 -0.847 1.00 . A A . 3 ASP CA 1 1
10 1194 1 1 3 ASP CB C 0.691 -0.701 -2.061 1.00 . A A . 3 ASP CB 1 1
10 1195 1 1 3 ASP CG C 1.578 -0.664 -3.289 1.00 . A A . 3 ASP CG 1 1
10 1196 1 1 3 ASP H H -0.454 -1.505 0.133 1.00 . A A . 3 ASP H 1 1
10 1197 1 1 3 ASP HA H 2.060 -2.085 -1.175 1.00 . A A . 3 ASP HA 1 1
10 1198 1 1 3 ASP HB2 H -0.186 -1.290 -2.290 1.00 . A A . 3 ASP HB2 1 1
10 1199 1 1 3 ASP HB3 H 0.389 0.309 -1.825 1.00 . A A . 3 ASP HB3 1 1
10 1200 1 1 3 ASP N N 0.431 -1.901 0.062 1.00 . A A . 3 ASP N 1 1
10 1201 1 1 3 ASP O O 1.685 0.856 0.148 1.00 . A A . 3 ASP O 1 1
10 1202 1 1 3 ASP OD1 O 2.324 -1.640 -3.513 1.00 . A A . 3 ASP OD1 1 1
10 1203 1 1 3 ASP OD2 O 1.527 0.343 -4.026 1.00 . A A . 3 ASP OD2 1 1
10 1204 1 1 4 PRO C C 4.805 1.575 0.119 1.00 . A A . 4 PRO C 1 1
10 1205 1 1 4 PRO CA C 4.309 0.421 0.983 1.00 . A A . 4 PRO CA 1 1
10 1206 1 1 4 PRO CB C 5.487 -0.440 1.457 1.00 . A A . 4 PRO CB 1 1
10 1207 1 1 4 PRO CD C 4.163 -1.784 0.019 1.00 . A A . 4 PRO CD 1 1
10 1208 1 1 4 PRO CG C 5.047 -1.838 1.237 1.00 . A A . 4 PRO CG 1 1
10 1209 1 1 4 PRO HA H 3.793 0.809 1.840 1.00 . A A . 4 PRO HA 1 1
10 1210 1 1 4 PRO HB2 H 6.368 -0.204 0.882 1.00 . A A . 4 PRO HB2 1 1
10 1211 1 1 4 PRO HB3 H 5.666 -0.251 2.505 1.00 . A A . 4 PRO HB3 1 1
10 1212 1 1 4 PRO HD2 H 4.743 -1.745 -0.899 1.00 . A A . 4 PRO HD2 1 1
10 1213 1 1 4 PRO HD3 H 3.480 -2.614 0.009 1.00 . A A . 4 PRO HD3 1 1
10 1214 1 1 4 PRO HG2 H 5.905 -2.482 1.081 1.00 . A A . 4 PRO HG2 1 1
10 1215 1 1 4 PRO HG3 H 4.482 -2.163 2.092 1.00 . A A . 4 PRO HG3 1 1
10 1216 1 1 4 PRO N N 3.460 -0.522 0.249 1.00 . A A . 4 PRO N 1 1
10 1217 1 1 4 PRO O O 4.978 2.694 0.602 1.00 . A A . 4 PRO O 1 1
10 1218 1 1 5 ALA C C 4.520 3.464 -2.181 1.00 . A A . 5 ALA C 1 1
10 1219 1 1 5 ALA CA C 5.512 2.313 -2.085 1.00 . A A . 5 ALA CA 1 1
10 1220 1 1 5 ALA CB C 5.757 1.706 -3.459 1.00 . A A . 5 ALA CB 1 1
10 1221 1 1 5 ALA H H 4.877 0.387 -1.485 1.00 . A A . 5 ALA H 1 1
10 1222 1 1 5 ALA HA H 6.452 2.692 -1.711 1.00 . A A . 5 ALA HA 1 1
10 1223 1 1 5 ALA HB1 H 6.426 0.864 -3.366 1.00 . A A . 5 ALA HB1 1 1
10 1224 1 1 5 ALA HB2 H 6.200 2.448 -4.108 1.00 . A A . 5 ALA HB2 1 1
10 1225 1 1 5 ALA HB3 H 4.818 1.376 -3.879 1.00 . A A . 5 ALA HB3 1 1
10 1226 1 1 5 ALA N N 5.034 1.296 -1.158 1.00 . A A . 5 ALA N 1 1
10 1227 1 1 5 ALA O O 4.870 4.622 -1.959 1.00 . A A . 5 ALA O 1 1
10 1228 1 1 6 THR C C 1.667 4.468 -1.252 1.00 . A A . 6 THR C 1 1
10 1229 1 1 6 THR CA C 2.226 4.115 -2.629 1.00 . A A . 6 THR CA 1 1
10 1230 1 1 6 THR CB C 1.129 3.561 -3.535 1.00 . A A . 6 THR CB 1 1
10 1231 1 1 6 THR CG2 C -0.099 4.427 -3.586 1.00 . A A . 6 THR CG2 1 1
10 1232 1 1 6 THR H H 3.057 2.198 -2.669 1.00 . A A . 6 THR H 1 1
10 1233 1 1 6 THR HA H 2.648 4.996 -3.080 1.00 . A A . 6 THR HA 1 1
10 1234 1 1 6 THR HB H 0.832 2.589 -3.169 1.00 . A A . 6 THR HB 1 1
10 1235 1 1 6 THR HG1 H 1.098 2.722 -5.304 1.00 . A A . 6 THR HG1 1 1
10 1236 1 1 6 THR HG21 H -0.949 3.825 -3.861 1.00 . A A . 6 THR HG21 1 1
10 1237 1 1 6 THR HG22 H 0.044 5.209 -4.314 1.00 . A A . 6 THR HG22 1 1
10 1238 1 1 6 THR HG23 H -0.264 4.865 -2.614 1.00 . A A . 6 THR HG23 1 1
10 1239 1 1 6 THR N N 3.277 3.131 -2.508 1.00 . A A . 6 THR N 1 1
10 1240 1 1 6 THR O O 1.250 5.600 -1.009 1.00 . A A . 6 THR O 1 1
10 1241 1 1 6 THR OG1 O 1.601 3.410 -4.861 1.00 . A A . 6 THR OG1 1 1
10 1242 1 1 7 GLY C C -0.327 3.563 1.089 1.00 . A A . 7 GLY C 1 1
10 1243 1 1 7 GLY CA C 1.175 3.695 0.987 1.00 . A A . 7 GLY CA 1 1
10 1244 1 1 7 GLY H H 2.020 2.612 -0.609 1.00 . A A . 7 GLY H 1 1
10 1245 1 1 7 GLY HA2 H 1.622 2.957 1.631 1.00 . A A . 7 GLY HA2 1 1
10 1246 1 1 7 GLY HA3 H 1.467 4.675 1.316 1.00 . A A . 7 GLY HA3 1 1
10 1247 1 1 7 GLY N N 1.670 3.487 -0.357 1.00 . A A . 7 GLY N 1 1
10 1248 1 1 7 GLY O O -0.965 4.223 1.910 1.00 . A A . 7 GLY O 1 1
10 1249 1 1 8 THR C C -2.539 0.988 0.531 1.00 . A A . 8 THR C 1 1
10 1250 1 1 8 THR CA C -2.285 2.456 0.224 1.00 . A A . 8 THR CA 1 1
10 1251 1 1 8 THR CB C -2.804 2.845 -1.157 1.00 . A A . 8 THR CB 1 1
10 1252 1 1 8 THR CG2 C -4.223 3.325 -1.123 1.00 . A A . 8 THR CG2 1 1
10 1253 1 1 8 THR H H -0.348 2.215 -0.365 1.00 . A A . 8 THR H 1 1
10 1254 1 1 8 THR HA H -2.764 3.051 0.963 1.00 . A A . 8 THR HA 1 1
10 1255 1 1 8 THR HB H -2.753 1.989 -1.811 1.00 . A A . 8 THR HB 1 1
10 1256 1 1 8 THR HG1 H -2.390 4.152 -2.557 1.00 . A A . 8 THR HG1 1 1
10 1257 1 1 8 THR HG21 H -4.668 3.035 -0.187 1.00 . A A . 8 THR HG21 1 1
10 1258 1 1 8 THR HG22 H -4.769 2.882 -1.940 1.00 . A A . 8 THR HG22 1 1
10 1259 1 1 8 THR HG23 H -4.235 4.398 -1.215 1.00 . A A . 8 THR HG23 1 1
10 1260 1 1 8 THR N N -0.889 2.703 0.256 1.00 . A A . 8 THR N 1 1
10 1261 1 1 8 THR O O -1.927 0.408 1.426 1.00 . A A . 8 THR O 1 1
10 1262 1 1 8 THR OG1 O -2.016 3.881 -1.714 1.00 . A A . 8 THR OG1 1 1
10 1263 1 1 9 PHE C C -4.017 -1.658 -1.399 1.00 . A A . 9 PHE C 1 1
10 1264 1 1 9 PHE CA C -3.810 -0.979 -0.056 1.00 . A A . 9 PHE CA 1 1
10 1265 1 1 9 PHE CB C -5.077 -1.060 0.756 1.00 . A A . 9 PHE CB 1 1
10 1266 1 1 9 PHE CD1 C -4.641 -2.332 2.873 1.00 . A A . 9 PHE CD1 1 1
10 1267 1 1 9 PHE CD2 C -4.819 0.043 2.995 1.00 . A A . 9 PHE CD2 1 1
10 1268 1 1 9 PHE CE1 C -4.421 -2.389 4.237 1.00 . A A . 9 PHE CE1 1 1
10 1269 1 1 9 PHE CE2 C -4.599 -0.007 4.358 1.00 . A A . 9 PHE CE2 1 1
10 1270 1 1 9 PHE CG C -4.843 -1.118 2.238 1.00 . A A . 9 PHE CG 1 1
10 1271 1 1 9 PHE CZ C -4.400 -1.224 4.980 1.00 . A A . 9 PHE CZ 1 1
10 1272 1 1 9 PHE H H -3.872 0.939 -0.883 1.00 . A A . 9 PHE H 1 1
10 1273 1 1 9 PHE HA H -3.017 -1.466 0.452 1.00 . A A . 9 PHE HA 1 1
10 1274 1 1 9 PHE HB2 H -5.663 -0.182 0.537 1.00 . A A . 9 PHE HB2 1 1
10 1275 1 1 9 PHE HB3 H -5.628 -1.933 0.462 1.00 . A A . 9 PHE HB3 1 1
10 1276 1 1 9 PHE HD1 H -4.657 -3.243 2.294 1.00 . A A . 9 PHE HD1 1 1
10 1277 1 1 9 PHE HD2 H -4.974 0.995 2.509 1.00 . A A . 9 PHE HD2 1 1
10 1278 1 1 9 PHE HE1 H -4.264 -3.341 4.721 1.00 . A A . 9 PHE HE1 1 1
10 1279 1 1 9 PHE HE2 H -4.583 0.905 4.937 1.00 . A A . 9 PHE HE2 1 1
10 1280 1 1 9 PHE HZ H -4.227 -1.265 6.045 1.00 . A A . 9 PHE HZ 1 1
10 1281 1 1 9 PHE N N -3.441 0.411 -0.213 1.00 . A A . 9 PHE N 1 1
10 1282 1 1 9 PHE O O -4.511 -2.781 -1.485 1.00 . A A . 9 PHE O 1 1
10 1283 1 1 10 GLY C C -3.413 -0.407 -4.825 1.00 . A A . 10 GLY C 1 1
10 1284 1 1 10 GLY CA C -3.760 -1.453 -3.783 1.00 . A A . 10 GLY CA 1 1
10 1285 1 1 10 GLY H H -3.253 -0.073 -2.257 1.00 . A A . 10 GLY H 1 1
10 1286 1 1 10 GLY HA2 H -3.103 -2.300 -3.906 1.00 . A A . 10 GLY HA2 1 1
10 1287 1 1 10 GLY HA3 H -4.780 -1.776 -3.940 1.00 . A A . 10 GLY HA3 1 1
10 1288 1 1 10 GLY N N -3.632 -0.951 -2.428 1.00 . A A . 10 GLY N 1 1
10 1289 1 1 10 GLY O O -2.227 -0.022 -4.906 1.00 . A A . 10 GLY O 1 1
10 1290 1 1 10 GLY OXT O -4.325 0.025 -5.560 1.00 . A A . 10 GLY OXT 1 1
11 1291 1 1 1 GLY C C -0.936 -5.437 0.392 1.00 . A A . 1 GLY C 1 1
11 1292 1 1 1 GLY CA C -1.112 -6.942 0.364 1.00 . A A . 1 GLY CA 1 1
11 1293 1 1 1 GLY H1 H -3.008 -7.096 -0.500 1.00 . A A . 1 GLY H1 1 1
11 1294 1 1 1 GLY H2 H -3.036 -6.865 1.175 1.00 . A A . 1 GLY H2 1 1
11 1295 1 1 1 GLY H3 H -2.623 -8.375 0.537 1.00 . A A . 1 GLY H3 1 1
11 1296 1 1 1 GLY HA2 H -0.611 -7.368 1.219 1.00 . A A . 1 GLY HA2 1 1
11 1297 1 1 1 GLY HA3 H -0.660 -7.331 -0.537 1.00 . A A . 1 GLY HA3 1 1
11 1298 1 1 1 GLY N N -2.544 -7.348 0.396 1.00 . A A . 1 GLY N 1 1
11 1299 1 1 1 GLY O O -1.123 -4.763 -0.622 1.00 . A A . 1 GLY O 1 1
11 1300 1 1 2 TYR C C 0.735 -2.973 0.801 1.00 . A A . 2 TYR C 1 1
11 1301 1 1 2 TYR CA C -0.373 -3.474 1.715 1.00 . A A . 2 TYR CA 1 1
11 1302 1 1 2 TYR CB C -0.024 -3.139 3.167 1.00 . A A . 2 TYR CB 1 1
11 1303 1 1 2 TYR CD1 C -0.837 -0.795 3.621 1.00 . A A . 2 TYR CD1 1 1
11 1304 1 1 2 TYR CD2 C 1.513 -1.138 3.408 1.00 . A A . 2 TYR CD2 1 1
11 1305 1 1 2 TYR CE1 C -0.625 0.551 3.837 1.00 . A A . 2 TYR CE1 1 1
11 1306 1 1 2 TYR CE2 C 1.733 0.208 3.623 1.00 . A A . 2 TYR CE2 1 1
11 1307 1 1 2 TYR CG C 0.223 -1.664 3.403 1.00 . A A . 2 TYR CG 1 1
11 1308 1 1 2 TYR CZ C 0.661 1.050 3.838 1.00 . A A . 2 TYR CZ 1 1
11 1309 1 1 2 TYR H H -0.441 -5.495 2.326 1.00 . A A . 2 TYR H 1 1
11 1310 1 1 2 TYR HA H -1.294 -2.977 1.454 1.00 . A A . 2 TYR HA 1 1
11 1311 1 1 2 TYR HB2 H -0.838 -3.445 3.807 1.00 . A A . 2 TYR HB2 1 1
11 1312 1 1 2 TYR HB3 H 0.870 -3.676 3.449 1.00 . A A . 2 TYR HB3 1 1
11 1313 1 1 2 TYR HD1 H -1.844 -1.189 3.618 1.00 . A A . 2 TYR HD1 1 1
11 1314 1 1 2 TYR HD2 H 2.354 -1.795 3.240 1.00 . A A . 2 TYR HD2 1 1
11 1315 1 1 2 TYR HE1 H -1.466 1.209 4.004 1.00 . A A . 2 TYR HE1 1 1
11 1316 1 1 2 TYR HE2 H 2.741 0.596 3.621 1.00 . A A . 2 TYR HE2 1 1
11 1317 1 1 2 TYR HH H 0.806 2.580 4.991 1.00 . A A . 2 TYR HH 1 1
11 1318 1 1 2 TYR N N -0.575 -4.908 1.556 1.00 . A A . 2 TYR N 1 1
11 1319 1 1 2 TYR O O 1.832 -3.526 0.782 1.00 . A A . 2 TYR O 1 1
11 1320 1 1 2 TYR OH O 0.877 2.391 4.052 1.00 . A A . 2 TYR OH 1 1
11 1321 1 1 3 ASP C C 2.201 -0.240 -0.114 1.00 . A A . 3 ASP C 1 1
11 1322 1 1 3 ASP CA C 1.405 -1.317 -0.848 1.00 . A A . 3 ASP CA 1 1
11 1323 1 1 3 ASP CB C 0.696 -0.710 -2.060 1.00 . A A . 3 ASP CB 1 1
11 1324 1 1 3 ASP CG C 1.585 -0.665 -3.288 1.00 . A A . 3 ASP CG 1 1
11 1325 1 1 3 ASP H H -0.447 -1.521 0.130 1.00 . A A . 3 ASP H 1 1
11 1326 1 1 3 ASP HA H 2.071 -2.091 -1.177 1.00 . A A . 3 ASP HA 1 1
11 1327 1 1 3 ASP HB2 H -0.177 -1.301 -2.292 1.00 . A A . 3 ASP HB2 1 1
11 1328 1 1 3 ASP HB3 H 0.391 0.299 -1.823 1.00 . A A . 3 ASP HB3 1 1
11 1329 1 1 3 ASP N N 0.439 -1.915 0.057 1.00 . A A . 3 ASP N 1 1
11 1330 1 1 3 ASP O O 1.686 0.846 0.150 1.00 . A A . 3 ASP O 1 1
11 1331 1 1 3 ASP OD1 O 1.857 -1.739 -3.862 1.00 . A A . 3 ASP OD1 1 1
11 1332 1 1 3 ASP OD2 O 2.009 0.445 -3.674 1.00 . A A . 3 ASP OD2 1 1
11 1333 1 1 4 PRO C C 4.794 1.573 0.133 1.00 . A A . 4 PRO C 1 1
11 1334 1 1 4 PRO CA C 4.305 0.415 0.993 1.00 . A A . 4 PRO CA 1 1
11 1335 1 1 4 PRO CB C 5.487 -0.441 1.466 1.00 . A A . 4 PRO CB 1 1
11 1336 1 1 4 PRO CD C 4.169 -1.788 0.027 1.00 . A A . 4 PRO CD 1 1
11 1337 1 1 4 PRO CG C 5.056 -1.840 1.244 1.00 . A A . 4 PRO CG 1 1
11 1338 1 1 4 PRO HA H 3.788 0.798 1.852 1.00 . A A . 4 PRO HA 1 1
11 1339 1 1 4 PRO HB2 H 6.369 -0.199 0.891 1.00 . A A . 4 PRO HB2 1 1
11 1340 1 1 4 PRO HB3 H 5.666 -0.253 2.513 1.00 . A A . 4 PRO HB3 1 1
11 1341 1 1 4 PRO HD2 H 4.749 -1.748 -0.891 1.00 . A A . 4 PRO HD2 1 1
11 1342 1 1 4 PRO HD3 H 3.490 -2.621 0.016 1.00 . A A . 4 PRO HD3 1 1
11 1343 1 1 4 PRO HG2 H 5.916 -2.480 1.086 1.00 . A A . 4 PRO HG2 1 1
11 1344 1 1 4 PRO HG3 H 4.491 -2.170 2.099 1.00 . A A . 4 PRO HG3 1 1
11 1345 1 1 4 PRO N N 3.462 -0.529 0.256 1.00 . A A . 4 PRO N 1 1
11 1346 1 1 4 PRO O O 4.956 2.694 0.616 1.00 . A A . 4 PRO O 1 1
11 1347 1 1 5 ALA C C 4.495 3.455 -2.178 1.00 . A A . 5 ALA C 1 1
11 1348 1 1 5 ALA CA C 5.501 2.317 -2.073 1.00 . A A . 5 ALA CA 1 1
11 1349 1 1 5 ALA CB C 5.760 1.707 -3.442 1.00 . A A . 5 ALA CB 1 1
11 1350 1 1 5 ALA H H 4.881 0.386 -1.471 1.00 . A A . 5 ALA H 1 1
11 1351 1 1 5 ALA HA H 6.435 2.707 -1.694 1.00 . A A . 5 ALA HA 1 1
11 1352 1 1 5 ALA HB1 H 5.110 0.858 -3.587 1.00 . A A . 5 ALA HB1 1 1
11 1353 1 1 5 ALA HB2 H 6.790 1.387 -3.504 1.00 . A A . 5 ALA HB2 1 1
11 1354 1 1 5 ALA HB3 H 5.565 2.446 -4.207 1.00 . A A . 5 ALA HB3 1 1
11 1355 1 1 5 ALA N N 5.029 1.297 -1.145 1.00 . A A . 5 ALA N 1 1
11 1356 1 1 5 ALA O O 4.830 4.619 -1.959 1.00 . A A . 5 ALA O 1 1
11 1357 1 1 6 THR C C 1.646 4.454 -1.271 1.00 . A A . 6 THR C 1 1
11 1358 1 1 6 THR CA C 2.199 4.078 -2.645 1.00 . A A . 6 THR CA 1 1
11 1359 1 1 6 THR CB C 1.100 3.495 -3.532 1.00 . A A . 6 THR CB 1 1
11 1360 1 1 6 THR CG2 C -0.145 4.336 -3.579 1.00 . A A . 6 THR CG2 1 1
11 1361 1 1 6 THR H H 3.050 2.169 -2.671 1.00 . A A . 6 THR H 1 1
11 1362 1 1 6 THR HA H 2.609 4.955 -3.116 1.00 . A A . 6 THR HA 1 1
11 1363 1 1 6 THR HB H 0.827 2.520 -3.152 1.00 . A A . 6 THR HB 1 1
11 1364 1 1 6 THR HG1 H 0.909 2.857 -5.372 1.00 . A A . 6 THR HG1 1 1
11 1365 1 1 6 THR HG21 H -0.999 3.698 -3.738 1.00 . A A . 6 THR HG21 1 1
11 1366 1 1 6 THR HG22 H -0.066 5.045 -4.386 1.00 . A A . 6 THR HG22 1 1
11 1367 1 1 6 THR HG23 H -0.254 4.861 -2.645 1.00 . A A . 6 THR HG23 1 1
11 1368 1 1 6 THR N N 3.259 3.107 -2.512 1.00 . A A . 6 THR N 1 1
11 1369 1 1 6 THR O O 1.214 5.587 -1.050 1.00 . A A . 6 THR O 1 1
11 1370 1 1 6 THR OG1 O 1.562 3.338 -4.861 1.00 . A A . 6 THR OG1 1 1
11 1371 1 1 7 GLY C C -0.321 3.594 1.098 1.00 . A A . 7 GLY C 1 1
11 1372 1 1 7 GLY CA C 1.180 3.723 0.988 1.00 . A A . 7 GLY CA 1 1
11 1373 1 1 7 GLY H H 2.029 2.619 -0.590 1.00 . A A . 7 GLY H 1 1
11 1374 1 1 7 GLY HA2 H 1.631 2.997 1.642 1.00 . A A . 7 GLY HA2 1 1
11 1375 1 1 7 GLY HA3 H 1.475 4.709 1.301 1.00 . A A . 7 GLY HA3 1 1
11 1376 1 1 7 GLY N N 1.671 3.493 -0.354 1.00 . A A . 7 GLY N 1 1
11 1377 1 1 7 GLY O O -0.958 4.265 1.910 1.00 . A A . 7 GLY O 1 1
11 1378 1 1 8 THR C C -2.531 1.004 0.537 1.00 . A A . 8 THR C 1 1
11 1379 1 1 8 THR CA C -2.278 2.476 0.247 1.00 . A A . 8 THR CA 1 1
11 1380 1 1 8 THR CB C -2.802 2.882 -1.127 1.00 . A A . 8 THR CB 1 1
11 1381 1 1 8 THR CG2 C -4.223 3.354 -1.089 1.00 . A A . 8 THR CG2 1 1
11 1382 1 1 8 THR H H -0.343 2.229 -0.339 1.00 . A A . 8 THR H 1 1
11 1383 1 1 8 THR HA H -2.756 3.062 0.995 1.00 . A A . 8 THR HA 1 1
11 1384 1 1 8 THR HB H -2.746 2.036 -1.795 1.00 . A A . 8 THR HB 1 1
11 1385 1 1 8 THR HG1 H -2.092 4.707 -1.109 1.00 . A A . 8 THR HG1 1 1
11 1386 1 1 8 THR HG21 H -4.765 2.922 -1.913 1.00 . A A . 8 THR HG21 1 1
11 1387 1 1 8 THR HG22 H -4.241 4.428 -1.160 1.00 . A A . 8 THR HG22 1 1
11 1388 1 1 8 THR HG23 H -4.668 3.045 -0.158 1.00 . A A . 8 THR HG23 1 1
11 1389 1 1 8 THR N N -0.884 2.724 0.276 1.00 . A A . 8 THR N 1 1
11 1390 1 1 8 THR O O -1.917 0.414 1.425 1.00 . A A . 8 THR O 1 1
11 1391 1 1 8 THR OG1 O -2.022 3.931 -1.669 1.00 . A A . 8 THR OG1 1 1
11 1392 1 1 9 PHE C C -3.997 -1.621 -1.427 1.00 . A A . 9 PHE C 1 1
11 1393 1 1 9 PHE CA C -3.796 -0.960 -0.076 1.00 . A A . 9 PHE CA 1 1
11 1394 1 1 9 PHE CB C -5.066 -1.054 0.733 1.00 . A A . 9 PHE CB 1 1
11 1395 1 1 9 PHE CD1 C -4.638 -2.356 2.834 1.00 . A A . 9 PHE CD1 1 1
11 1396 1 1 9 PHE CD2 C -4.811 0.016 2.987 1.00 . A A . 9 PHE CD2 1 1
11 1397 1 1 9 PHE CE1 C -4.423 -2.432 4.198 1.00 . A A . 9 PHE CE1 1 1
11 1398 1 1 9 PHE CE2 C -4.595 -0.052 4.350 1.00 . A A . 9 PHE CE2 1 1
11 1399 1 1 9 PHE CG C -4.835 -1.133 2.215 1.00 . A A . 9 PHE CG 1 1
11 1400 1 1 9 PHE CZ C -4.401 -1.278 4.956 1.00 . A A . 9 PHE CZ 1 1
11 1401 1 1 9 PHE H H -3.863 0.969 -0.878 1.00 . A A . 9 PHE H 1 1
11 1402 1 1 9 PHE HA H -3.003 -1.448 0.428 1.00 . A A . 9 PHE HA 1 1
11 1403 1 1 9 PHE HB2 H -5.654 -0.175 0.526 1.00 . A A . 9 PHE HB2 1 1
11 1404 1 1 9 PHE HB3 H -5.612 -1.925 0.425 1.00 . A A . 9 PHE HB3 1 1
11 1405 1 1 9 PHE HD1 H -4.656 -3.259 2.242 1.00 . A A . 9 PHE HD1 1 1
11 1406 1 1 9 PHE HD2 H -4.962 0.977 2.514 1.00 . A A . 9 PHE HD2 1 1
11 1407 1 1 9 PHE HE1 H -4.271 -3.392 4.669 1.00 . A A . 9 PHE HE1 1 1
11 1408 1 1 9 PHE HE2 H -4.577 0.852 4.942 1.00 . A A . 9 PHE HE2 1 1
11 1409 1 1 9 PHE HZ H -4.232 -1.334 6.021 1.00 . A A . 9 PHE HZ 1 1
11 1410 1 1 9 PHE N N -3.431 0.435 -0.215 1.00 . A A . 9 PHE N 1 1
11 1411 1 1 9 PHE O O -4.478 -2.748 -1.529 1.00 . A A . 9 PHE O 1 1
11 1412 1 1 10 GLY C C -3.101 -0.445 -4.816 1.00 . A A . 10 GLY C 1 1
11 1413 1 1 10 GLY CA C -3.740 -1.380 -3.809 1.00 . A A . 10 GLY CA 1 1
11 1414 1 1 10 GLY H H -3.247 -0.018 -2.263 1.00 . A A . 10 GLY H 1 1
11 1415 1 1 10 GLY HA2 H -3.264 -2.347 -3.880 1.00 . A A . 10 GLY HA2 1 1
11 1416 1 1 10 GLY HA3 H -4.788 -1.486 -4.049 1.00 . A A . 10 GLY HA3 1 1
11 1417 1 1 10 GLY N N -3.617 -0.897 -2.445 1.00 . A A . 10 GLY N 1 1
11 1418 1 1 10 GLY O O -3.719 0.591 -5.141 1.00 . A A . 10 GLY O 1 1
11 1419 1 1 10 GLY OXT O -1.979 -0.746 -5.277 1.00 . A A . 10 GLY OXT 1 1
12 1420 1 1 1 GLY C C -1.150 -5.314 0.407 1.00 . A A . 1 GLY C 1 1
12 1421 1 1 1 GLY CA C -1.368 -6.813 0.360 1.00 . A A . 1 GLY CA 1 1
12 1422 1 1 1 GLY H1 H -1.636 -7.660 2.250 1.00 . A A . 1 GLY H1 1 1
12 1423 1 1 1 GLY H2 H -2.848 -8.064 1.143 1.00 . A A . 1 GLY H2 1 1
12 1424 1 1 1 GLY H3 H -2.816 -6.522 1.838 1.00 . A A . 1 GLY H3 1 1
12 1425 1 1 1 GLY HA2 H -0.409 -7.308 0.416 1.00 . A A . 1 GLY HA2 1 1
12 1426 1 1 1 GLY HA3 H -1.838 -7.069 -0.579 1.00 . A A . 1 GLY HA3 1 1
12 1427 1 1 1 GLY N N -2.227 -7.298 1.476 1.00 . A A . 1 GLY N 1 1
12 1428 1 1 1 GLY O O -1.356 -4.619 -0.587 1.00 . A A . 1 GLY O 1 1
12 1429 1 1 2 TYR C C 0.620 -2.909 0.804 1.00 . A A . 2 TYR C 1 1
12 1430 1 1 2 TYR CA C -0.481 -3.390 1.738 1.00 . A A . 2 TYR CA 1 1
12 1431 1 1 2 TYR CB C -0.091 -3.087 3.187 1.00 . A A . 2 TYR CB 1 1
12 1432 1 1 2 TYR CD1 C -0.860 -0.741 3.703 1.00 . A A . 2 TYR CD1 1 1
12 1433 1 1 2 TYR CD2 C 1.478 -1.113 3.419 1.00 . A A . 2 TYR CD2 1 1
12 1434 1 1 2 TYR CE1 C -0.621 0.601 3.933 1.00 . A A . 2 TYR CE1 1 1
12 1435 1 1 2 TYR CE2 C 1.724 0.225 3.649 1.00 . A A . 2 TYR CE2 1 1
12 1436 1 1 2 TYR CG C 0.182 -1.619 3.442 1.00 . A A . 2 TYR CG 1 1
12 1437 1 1 2 TYR CZ C 0.673 1.080 3.906 1.00 . A A . 2 TYR CZ 1 1
12 1438 1 1 2 TYR H H -0.582 -5.418 2.319 1.00 . A A . 2 TYR H 1 1
12 1439 1 1 2 TYR HA H -1.395 -2.863 1.504 1.00 . A A . 2 TYR HA 1 1
12 1440 1 1 2 TYR HB2 H -0.893 -3.394 3.841 1.00 . A A . 2 TYR HB2 1 1
12 1441 1 1 2 TYR HB3 H 0.803 -3.641 3.435 1.00 . A A . 2 TYR HB3 1 1
12 1442 1 1 2 TYR HD1 H -1.871 -1.119 3.721 1.00 . A A . 2 TYR HD1 1 1
12 1443 1 1 2 TYR HD2 H 2.302 -1.780 3.218 1.00 . A A . 2 TYR HD2 1 1
12 1444 1 1 2 TYR HE1 H -1.447 1.269 4.134 1.00 . A A . 2 TYR HE1 1 1
12 1445 1 1 2 TYR HE2 H 2.739 0.597 3.624 1.00 . A A . 2 TYR HE2 1 1
12 1446 1 1 2 TYR HH H 0.334 2.945 3.582 1.00 . A A . 2 TYR HH 1 1
12 1447 1 1 2 TYR N N -0.729 -4.815 1.564 1.00 . A A . 2 TYR N 1 1
12 1448 1 1 2 TYR O O 1.698 -3.495 0.749 1.00 . A A . 2 TYR O 1 1
12 1449 1 1 2 TYR OH O 0.914 2.414 4.134 1.00 . A A . 2 TYR OH 1 1
12 1450 1 1 3 ASP C C 2.138 -0.192 -0.105 1.00 . A A . 3 ASP C 1 1
12 1451 1 1 3 ASP CA C 1.303 -1.244 -0.832 1.00 . A A . 3 ASP CA 1 1
12 1452 1 1 3 ASP CB C 0.588 -0.610 -2.027 1.00 . A A . 3 ASP CB 1 1
12 1453 1 1 3 ASP CG C 1.459 -0.573 -3.268 1.00 . A A . 3 ASP CG 1 1
12 1454 1 1 3 ASP H H -0.532 -1.408 0.188 1.00 . A A . 3 ASP H 1 1
12 1455 1 1 3 ASP HA H 1.943 -2.032 -1.180 1.00 . A A . 3 ASP HA 1 1
12 1456 1 1 3 ASP HB2 H -0.301 -1.181 -2.252 1.00 . A A . 3 ASP HB2 1 1
12 1457 1 1 3 ASP HB3 H 0.308 0.402 -1.776 1.00 . A A . 3 ASP HB3 1 1
12 1458 1 1 3 ASP N N 0.340 -1.829 0.087 1.00 . A A . 3 ASP N 1 1
12 1459 1 1 3 ASP O O 1.652 0.903 0.177 1.00 . A A . 3 ASP O 1 1
12 1460 1 1 3 ASP OD1 O 1.473 -1.574 -4.015 1.00 . A A . 3 ASP OD1 1 1
12 1461 1 1 3 ASP OD2 O 2.127 0.460 -3.494 1.00 . A A . 3 ASP OD2 1 1
12 1462 1 1 4 PRO C C 4.792 1.551 0.103 1.00 . A A . 4 PRO C 1 1
12 1463 1 1 4 PRO CA C 4.278 0.404 0.967 1.00 . A A . 4 PRO CA 1 1
12 1464 1 1 4 PRO CB C 5.442 -0.486 1.418 1.00 . A A . 4 PRO CB 1 1
12 1465 1 1 4 PRO CD C 4.070 -1.788 -0.013 1.00 . A A . 4 PRO CD 1 1
12 1466 1 1 4 PRO CG C 4.970 -1.873 1.191 1.00 . A A . 4 PRO CG 1 1
12 1467 1 1 4 PRO HA H 3.783 0.799 1.834 1.00 . A A . 4 PRO HA 1 1
12 1468 1 1 4 PRO HB2 H 6.321 -0.265 0.835 1.00 . A A . 4 PRO HB2 1 1
12 1469 1 1 4 PRO HB3 H 5.637 -0.310 2.466 1.00 . A A . 4 PRO HB3 1 1
12 1470 1 1 4 PRO HD2 H 4.640 -1.751 -0.940 1.00 . A A . 4 PRO HD2 1 1
12 1471 1 1 4 PRO HD3 H 3.371 -2.602 -0.024 1.00 . A A . 4 PRO HD3 1 1
12 1472 1 1 4 PRO HG2 H 5.811 -2.533 1.018 1.00 . A A . 4 PRO HG2 1 1
12 1473 1 1 4 PRO HG3 H 4.409 -2.193 2.050 1.00 . A A . 4 PRO HG3 1 1
12 1474 1 1 4 PRO N N 3.398 -0.514 0.238 1.00 . A A . 4 PRO N 1 1
12 1475 1 1 4 PRO O O 5.004 2.660 0.591 1.00 . A A . 4 PRO O 1 1
12 1476 1 1 5 ALA C C 4.528 3.461 -2.187 1.00 . A A . 5 ALA C 1 1
12 1477 1 1 5 ALA CA C 5.489 2.282 -2.108 1.00 . A A . 5 ALA CA 1 1
12 1478 1 1 5 ALA CB C 5.700 1.676 -3.485 1.00 . A A . 5 ALA CB 1 1
12 1479 1 1 5 ALA H H 4.807 0.371 -1.508 1.00 . A A . 5 ALA H 1 1
12 1480 1 1 5 ALA HA H 6.444 2.632 -1.743 1.00 . A A . 5 ALA HA 1 1
12 1481 1 1 5 ALA HB1 H 5.887 2.462 -4.202 1.00 . A A . 5 ALA HB1 1 1
12 1482 1 1 5 ALA HB2 H 4.817 1.125 -3.777 1.00 . A A . 5 ALA HB2 1 1
12 1483 1 1 5 ALA HB3 H 6.548 1.007 -3.458 1.00 . A A . 5 ALA HB3 1 1
12 1484 1 1 5 ALA N N 4.994 1.274 -1.178 1.00 . A A . 5 ALA N 1 1
12 1485 1 1 5 ALA O O 4.914 4.608 -1.961 1.00 . A A . 5 ALA O 1 1
12 1486 1 1 6 THR C C 1.689 4.516 -1.233 1.00 . A A . 6 THR C 1 1
12 1487 1 1 6 THR CA C 2.255 4.182 -2.612 1.00 . A A . 6 THR CA 1 1
12 1488 1 1 6 THR CB C 1.153 3.684 -3.546 1.00 . A A . 6 THR CB 1 1
12 1489 1 1 6 THR CG2 C -0.070 4.560 -3.552 1.00 . A A . 6 THR CG2 1 1
12 1490 1 1 6 THR H H 3.026 2.241 -2.671 1.00 . A A . 6 THR H 1 1
12 1491 1 1 6 THR HA H 2.705 5.061 -3.034 1.00 . A A . 6 THR HA 1 1
12 1492 1 1 6 THR HB H 0.850 2.695 -3.232 1.00 . A A . 6 THR HB 1 1
12 1493 1 1 6 THR HG1 H 1.337 2.771 -5.269 1.00 . A A . 6 THR HG1 1 1
12 1494 1 1 6 THR HG21 H 0.097 5.404 -4.200 1.00 . A A . 6 THR HG21 1 1
12 1495 1 1 6 THR HG22 H -0.263 4.905 -2.551 1.00 . A A . 6 THR HG22 1 1
12 1496 1 1 6 THR HG23 H -0.914 3.990 -3.909 1.00 . A A . 6 THR HG23 1 1
12 1497 1 1 6 THR N N 3.276 3.167 -2.505 1.00 . A A . 6 THR N 1 1
12 1498 1 1 6 THR O O 1.260 5.642 -0.979 1.00 . A A . 6 THR O 1 1
12 1499 1 1 6 THR OG1 O 1.626 3.599 -4.879 1.00 . A A . 6 THR OG1 1 1
12 1500 1 1 7 GLY C C -0.306 3.546 1.091 1.00 . A A . 7 GLY C 1 1
12 1501 1 1 7 GLY CA C 1.193 3.715 0.996 1.00 . A A . 7 GLY CA 1 1
12 1502 1 1 7 GLY H H 2.054 2.656 -0.606 1.00 . A A . 7 GLY H 1 1
12 1503 1 1 7 GLY HA2 H 1.657 2.988 1.640 1.00 . A A . 7 GLY HA2 1 1
12 1504 1 1 7 GLY HA3 H 1.459 4.702 1.329 1.00 . A A . 7 GLY HA3 1 1
12 1505 1 1 7 GLY N N 1.696 3.525 -0.346 1.00 . A A . 7 GLY N 1 1
12 1506 1 1 7 GLY O O -0.964 4.186 1.911 1.00 . A A . 7 GLY O 1 1
12 1507 1 1 8 THR C C -2.453 0.924 0.531 1.00 . A A . 8 THR C 1 1
12 1508 1 1 8 THR CA C -2.228 2.392 0.206 1.00 . A A . 8 THR CA 1 1
12 1509 1 1 8 THR CB C -2.741 2.750 -1.187 1.00 . A A . 8 THR CB 1 1
12 1510 1 1 8 THR CG2 C -4.169 3.201 -1.178 1.00 . A A . 8 THR CG2 1 1
12 1511 1 1 8 THR H H -0.281 2.205 -0.371 1.00 . A A . 8 THR H 1 1
12 1512 1 1 8 THR HA H -2.731 2.988 0.929 1.00 . A A . 8 THR HA 1 1
12 1513 1 1 8 THR HB H -2.665 1.885 -1.826 1.00 . A A . 8 THR HB 1 1
12 1514 1 1 8 THR HG1 H -2.071 4.589 -1.226 1.00 . A A . 8 THR HG1 1 1
12 1515 1 1 8 THR HG21 H -4.199 4.276 -1.246 1.00 . A A . 8 THR HG21 1 1
12 1516 1 1 8 THR HG22 H -4.630 2.884 -0.257 1.00 . A A . 8 THR HG22 1 1
12 1517 1 1 8 THR HG23 H -4.686 2.765 -2.015 1.00 . A A . 8 THR HG23 1 1
12 1518 1 1 8 THR N N -0.839 2.677 0.250 1.00 . A A . 8 THR N 1 1
12 1519 1 1 8 THR O O -1.842 0.372 1.444 1.00 . A A . 8 THR O 1 1
12 1520 1 1 8 THR OG1 O -1.969 3.792 -1.752 1.00 . A A . 8 THR OG1 1 1
12 1521 1 1 9 PHE C C -3.817 -1.784 -1.390 1.00 . A A . 9 PHE C 1 1
12 1522 1 1 9 PHE CA C -3.665 -1.083 -0.053 1.00 . A A . 9 PHE CA 1 1
12 1523 1 1 9 PHE CB C -4.952 -1.185 0.727 1.00 . A A . 9 PHE CB 1 1
12 1524 1 1 9 PHE CD1 C -4.708 -0.106 2.978 1.00 . A A . 9 PHE CD1 1 1
12 1525 1 1 9 PHE CD2 C -4.618 -2.484 2.847 1.00 . A A . 9 PHE CD2 1 1
12 1526 1 1 9 PHE CE1 C -4.525 -0.172 4.346 1.00 . A A . 9 PHE CE1 1 1
12 1527 1 1 9 PHE CE2 C -4.435 -2.557 4.215 1.00 . A A . 9 PHE CE2 1 1
12 1528 1 1 9 PHE CG C -4.757 -1.260 2.214 1.00 . A A . 9 PHE CG 1 1
12 1529 1 1 9 PHE CZ C -4.389 -1.398 4.965 1.00 . A A . 9 PHE CZ 1 1
12 1530 1 1 9 PHE H H -3.757 0.823 -0.907 1.00 . A A . 9 PHE H 1 1
12 1531 1 1 9 PHE HA H -2.874 -1.540 0.484 1.00 . A A . 9 PHE HA 1 1
12 1532 1 1 9 PHE HB2 H -5.541 -0.312 0.504 1.00 . A A . 9 PHE HB2 1 1
12 1533 1 1 9 PHE HB3 H -5.486 -2.061 0.408 1.00 . A A . 9 PHE HB3 1 1
12 1534 1 1 9 PHE HD1 H -4.815 0.854 2.495 1.00 . A A . 9 PHE HD1 1 1
12 1535 1 1 9 PHE HD2 H -4.653 -3.392 2.261 1.00 . A A . 9 PHE HD2 1 1
12 1536 1 1 9 PHE HE1 H -4.490 0.737 4.931 1.00 . A A . 9 PHE HE1 1 1
12 1537 1 1 9 PHE HE2 H -4.328 -3.518 4.696 1.00 . A A . 9 PHE HE2 1 1
12 1538 1 1 9 PHE HZ H -4.245 -1.452 6.035 1.00 . A A . 9 PHE HZ 1 1
12 1539 1 1 9 PHE N N -3.326 0.315 -0.221 1.00 . A A . 9 PHE N 1 1
12 1540 1 1 9 PHE O O -4.276 -2.923 -1.474 1.00 . A A . 9 PHE O 1 1
12 1541 1 1 10 GLY C C -2.231 -2.304 -4.197 1.00 . A A . 10 GLY C 1 1
12 1542 1 1 10 GLY CA C -3.504 -1.599 -3.770 1.00 . A A . 10 GLY CA 1 1
12 1543 1 1 10 GLY H H -3.079 -0.189 -2.250 1.00 . A A . 10 GLY H 1 1
12 1544 1 1 10 GLY HA2 H -4.326 -2.298 -3.829 1.00 . A A . 10 GLY HA2 1 1
12 1545 1 1 10 GLY HA3 H -3.694 -0.781 -4.450 1.00 . A A . 10 GLY HA3 1 1
12 1546 1 1 10 GLY N N -3.425 -1.080 -2.418 1.00 . A A . 10 GLY N 1 1
12 1547 1 1 10 GLY O O -2.284 -3.527 -4.445 1.00 . A A . 10 GLY O 1 1
12 1548 1 1 10 GLY OXT O -1.181 -1.633 -4.285 1.00 . A A . 10 GLY OXT 1 1
13 1549 1 1 1 GLY C C -1.649 -5.210 0.620 1.00 . A A . 1 GLY C 1 1
13 1550 1 1 1 GLY CA C -1.942 -6.696 0.688 1.00 . A A . 1 GLY CA 1 1
13 1551 1 1 1 GLY H1 H -2.885 -6.721 -1.176 1.00 . A A . 1 GLY H1 1 1
13 1552 1 1 1 GLY H2 H -3.956 -6.734 0.134 1.00 . A A . 1 GLY H2 1 1
13 1553 1 1 1 GLY H3 H -3.107 -8.138 -0.276 1.00 . A A . 1 GLY H3 1 1
13 1554 1 1 1 GLY HA2 H -2.210 -6.952 1.703 1.00 . A A . 1 GLY HA2 1 1
13 1555 1 1 1 GLY HA3 H -1.050 -7.241 0.416 1.00 . A A . 1 GLY HA3 1 1
13 1556 1 1 1 GLY N N -3.050 -7.100 -0.221 1.00 . A A . 1 GLY N 1 1
13 1557 1 1 1 GLY O O -2.090 -4.526 -0.304 1.00 . A A . 1 GLY O 1 1
13 1558 1 1 2 TYR C C 0.450 -2.950 0.561 1.00 . A A . 2 TYR C 1 1
13 1559 1 1 2 TYR CA C -0.552 -3.302 1.649 1.00 . A A . 2 TYR CA 1 1
13 1560 1 1 2 TYR CB C 0.033 -2.944 3.011 1.00 . A A . 2 TYR CB 1 1
13 1561 1 1 2 TYR CD1 C -0.988 -0.792 3.826 1.00 . A A . 2 TYR CD1 1 1
13 1562 1 1 2 TYR CD2 C 1.224 -0.714 2.948 1.00 . A A . 2 TYR CD2 1 1
13 1563 1 1 2 TYR CE1 C -0.944 0.568 4.067 1.00 . A A . 2 TYR CE1 1 1
13 1564 1 1 2 TYR CE2 C 1.280 0.641 3.188 1.00 . A A . 2 TYR CE2 1 1
13 1565 1 1 2 TYR CG C 0.091 -1.455 3.263 1.00 . A A . 2 TYR CG 1 1
13 1566 1 1 2 TYR CZ C 0.194 1.281 3.748 1.00 . A A . 2 TYR CZ 1 1
13 1567 1 1 2 TYR H H -0.582 -5.299 2.304 1.00 . A A . 2 TYR H 1 1
13 1568 1 1 2 TYR HA H -1.454 -2.729 1.500 1.00 . A A . 2 TYR HA 1 1
13 1569 1 1 2 TYR HB2 H -0.576 -3.389 3.785 1.00 . A A . 2 TYR HB2 1 1
13 1570 1 1 2 TYR HB3 H 1.039 -3.334 3.078 1.00 . A A . 2 TYR HB3 1 1
13 1571 1 1 2 TYR HD1 H -1.876 -1.356 4.069 1.00 . A A . 2 TYR HD1 1 1
13 1572 1 1 2 TYR HD2 H 2.071 -1.209 2.503 1.00 . A A . 2 TYR HD2 1 1
13 1573 1 1 2 TYR HE1 H -1.794 1.066 4.505 1.00 . A A . 2 TYR HE1 1 1
13 1574 1 1 2 TYR HE2 H 2.174 1.194 2.936 1.00 . A A . 2 TYR HE2 1 1
13 1575 1 1 2 TYR HH H -0.097 2.817 4.867 1.00 . A A . 2 TYR HH 1 1
13 1576 1 1 2 TYR N N -0.903 -4.708 1.599 1.00 . A A . 2 TYR N 1 1
13 1577 1 1 2 TYR O O 1.200 -3.801 0.085 1.00 . A A . 2 TYR O 1 1
13 1578 1 1 2 TYR OH O 0.244 2.635 3.989 1.00 . A A . 2 TYR OH 1 1
13 1579 1 1 3 ASP C C 2.256 -0.092 -0.258 1.00 . A A . 3 ASP C 1 1
13 1580 1 1 3 ASP CA C 1.361 -1.186 -0.833 1.00 . A A . 3 ASP CA 1 1
13 1581 1 1 3 ASP CB C 0.571 -0.646 -2.024 1.00 . A A . 3 ASP CB 1 1
13 1582 1 1 3 ASP CG C 1.399 -0.594 -3.293 1.00 . A A . 3 ASP CG 1 1
13 1583 1 1 3 ASP H H -0.158 -1.065 0.606 1.00 . A A . 3 ASP H 1 1
13 1584 1 1 3 ASP HA H 1.972 -2.006 -1.155 1.00 . A A . 3 ASP HA 1 1
13 1585 1 1 3 ASP HB2 H -0.284 -1.282 -2.198 1.00 . A A . 3 ASP HB2 1 1
13 1586 1 1 3 ASP HB3 H 0.229 0.353 -1.795 1.00 . A A . 3 ASP HB3 1 1
13 1587 1 1 3 ASP N N 0.457 -1.683 0.183 1.00 . A A . 3 ASP N 1 1
13 1588 1 1 3 ASP O O 1.996 1.094 -0.446 1.00 . A A . 3 ASP O 1 1
13 1589 1 1 3 ASP OD1 O 2.427 -1.300 -3.362 1.00 . A A . 3 ASP OD1 1 1
13 1590 1 1 3 ASP OD2 O 1.019 0.153 -4.219 1.00 . A A . 3 ASP OD2 1 1
13 1591 1 1 4 PRO C C 4.788 1.505 0.078 1.00 . A A . 4 PRO C 1 1
13 1592 1 1 4 PRO CA C 4.253 0.477 1.069 1.00 . A A . 4 PRO CA 1 1
13 1593 1 1 4 PRO CB C 5.393 -0.405 1.568 1.00 . A A . 4 PRO CB 1 1
13 1594 1 1 4 PRO CD C 3.714 -1.875 0.741 1.00 . A A . 4 PRO CD 1 1
13 1595 1 1 4 PRO CG C 4.780 -1.728 1.807 1.00 . A A . 4 PRO CG 1 1
13 1596 1 1 4 PRO HA H 3.802 0.986 1.906 1.00 . A A . 4 PRO HA 1 1
13 1597 1 1 4 PRO HB2 H 6.160 -0.461 0.815 1.00 . A A . 4 PRO HB2 1 1
13 1598 1 1 4 PRO HB3 H 5.793 0.008 2.478 1.00 . A A . 4 PRO HB3 1 1
13 1599 1 1 4 PRO HD2 H 4.113 -2.340 -0.157 1.00 . A A . 4 PRO HD2 1 1
13 1600 1 1 4 PRO HD3 H 2.874 -2.439 1.119 1.00 . A A . 4 PRO HD3 1 1
13 1601 1 1 4 PRO HG2 H 5.535 -2.504 1.725 1.00 . A A . 4 PRO HG2 1 1
13 1602 1 1 4 PRO HG3 H 4.341 -1.743 2.793 1.00 . A A . 4 PRO HG3 1 1
13 1603 1 1 4 PRO N N 3.325 -0.479 0.460 1.00 . A A . 4 PRO N 1 1
13 1604 1 1 4 PRO O O 5.169 2.613 0.461 1.00 . A A . 4 PRO O 1 1
13 1605 1 1 5 ALA C C 4.512 3.306 -2.301 1.00 . A A . 5 ALA C 1 1
13 1606 1 1 5 ALA CA C 5.323 2.019 -2.241 1.00 . A A . 5 ALA CA 1 1
13 1607 1 1 5 ALA CB C 5.296 1.313 -3.587 1.00 . A A . 5 ALA CB 1 1
13 1608 1 1 5 ALA H H 4.510 0.237 -1.440 1.00 . A A . 5 ALA H 1 1
13 1609 1 1 5 ALA HA H 6.349 2.261 -2.008 1.00 . A A . 5 ALA HA 1 1
13 1610 1 1 5 ALA HB1 H 6.209 0.750 -3.717 1.00 . A A . 5 ALA HB1 1 1
13 1611 1 1 5 ALA HB2 H 5.211 2.046 -4.375 1.00 . A A . 5 ALA HB2 1 1
13 1612 1 1 5 ALA HB3 H 4.450 0.642 -3.626 1.00 . A A . 5 ALA HB3 1 1
13 1613 1 1 5 ALA N N 4.823 1.132 -1.196 1.00 . A A . 5 ALA N 1 1
13 1614 1 1 5 ALA O O 5.061 4.405 -2.211 1.00 . A A . 5 ALA O 1 1
13 1615 1 1 6 THR C C 1.725 4.621 -1.159 1.00 . A A . 6 THR C 1 1
13 1616 1 1 6 THR CA C 2.313 4.299 -2.534 1.00 . A A . 6 THR CA 1 1
13 1617 1 1 6 THR CB C 1.202 4.000 -3.545 1.00 . A A . 6 THR CB 1 1
13 1618 1 1 6 THR CG2 C 0.015 4.921 -3.434 1.00 . A A . 6 THR CG2 1 1
13 1619 1 1 6 THR H H 2.824 2.270 -2.524 1.00 . A A . 6 THR H 1 1
13 1620 1 1 6 THR HA H 2.885 5.139 -2.878 1.00 . A A . 6 THR HA 1 1
13 1621 1 1 6 THR HB H 0.852 2.989 -3.389 1.00 . A A . 6 THR HB 1 1
13 1622 1 1 6 THR HG1 H 2.218 3.319 -5.075 1.00 . A A . 6 THR HG1 1 1
13 1623 1 1 6 THR HG21 H 0.284 5.902 -3.795 1.00 . A A . 6 THR HG21 1 1
13 1624 1 1 6 THR HG22 H -0.286 4.989 -2.402 1.00 . A A . 6 THR HG22 1 1
13 1625 1 1 6 THR HG23 H -0.798 4.530 -4.022 1.00 . A A . 6 THR HG23 1 1
13 1626 1 1 6 THR N N 3.203 3.163 -2.457 1.00 . A A . 6 THR N 1 1
13 1627 1 1 6 THR O O 1.323 5.755 -0.894 1.00 . A A . 6 THR O 1 1
13 1628 1 1 6 THR OG1 O 1.695 4.098 -4.870 1.00 . A A . 6 THR OG1 1 1
13 1629 1 1 7 GLY C C -0.342 3.572 1.112 1.00 . A A . 7 GLY C 1 1
13 1630 1 1 7 GLY CA C 1.151 3.797 1.041 1.00 . A A . 7 GLY CA 1 1
13 1631 1 1 7 GLY H H 2.018 2.741 -0.556 1.00 . A A . 7 GLY H 1 1
13 1632 1 1 7 GLY HA2 H 1.632 3.092 1.696 1.00 . A A . 7 GLY HA2 1 1
13 1633 1 1 7 GLY HA3 H 1.375 4.795 1.370 1.00 . A A . 7 GLY HA3 1 1
13 1634 1 1 7 GLY N N 1.682 3.616 -0.291 1.00 . A A . 7 GLY N 1 1
13 1635 1 1 7 GLY O O -1.039 4.190 1.916 1.00 . A A . 7 GLY O 1 1
13 1636 1 1 8 THR C C -2.377 0.869 0.534 1.00 . A A . 8 THR C 1 1
13 1637 1 1 8 THR CA C -2.203 2.341 0.198 1.00 . A A . 8 THR CA 1 1
13 1638 1 1 8 THR CB C -2.701 2.664 -1.209 1.00 . A A . 8 THR CB 1 1
13 1639 1 1 8 THR CG2 C -4.139 3.080 -1.233 1.00 . A A . 8 THR CG2 1 1
13 1640 1 1 8 THR H H -0.241 2.226 -0.342 1.00 . A A . 8 THR H 1 1
13 1641 1 1 8 THR HA H -2.744 2.923 0.905 1.00 . A A . 8 THR HA 1 1
13 1642 1 1 8 THR HB H -2.592 1.791 -1.834 1.00 . A A . 8 THR HB 1 1
13 1643 1 1 8 THR HG1 H -2.252 3.883 -2.672 1.00 . A A . 8 THR HG1 1 1
13 1644 1 1 8 THR HG21 H -4.197 4.144 -1.385 1.00 . A A . 8 THR HG21 1 1
13 1645 1 1 8 THR HG22 H -4.594 2.824 -0.291 1.00 . A A . 8 THR HG22 1 1
13 1646 1 1 8 THR HG23 H -4.647 2.569 -2.033 1.00 . A A . 8 THR HG23 1 1
13 1647 1 1 8 THR N N -0.827 2.678 0.266 1.00 . A A . 8 THR N 1 1
13 1648 1 1 8 THR O O -1.760 0.347 1.462 1.00 . A A . 8 THR O 1 1
13 1649 1 1 8 THR OG1 O -1.942 3.715 -1.780 1.00 . A A . 8 THR OG1 1 1
13 1650 1 1 9 PHE C C -3.562 -1.915 -1.377 1.00 . A A . 9 PHE C 1 1
13 1651 1 1 9 PHE CA C -3.503 -1.186 -0.048 1.00 . A A . 9 PHE CA 1 1
13 1652 1 1 9 PHE CB C -4.821 -1.326 0.671 1.00 . A A . 9 PHE CB 1 1
13 1653 1 1 9 PHE CD1 C -4.348 -2.406 2.885 1.00 . A A . 9 PHE CD1 1 1
13 1654 1 1 9 PHE CD2 C -4.929 -0.093 2.852 1.00 . A A . 9 PHE CD2 1 1
13 1655 1 1 9 PHE CE1 C -4.229 -2.360 4.261 1.00 . A A . 9 PHE CE1 1 1
13 1656 1 1 9 PHE CE2 C -4.812 -0.040 4.228 1.00 . A A . 9 PHE CE2 1 1
13 1657 1 1 9 PHE CG C -4.699 -1.275 2.167 1.00 . A A . 9 PHE CG 1 1
13 1658 1 1 9 PHE CZ C -4.462 -1.176 4.933 1.00 . A A . 9 PHE CZ 1 1
13 1659 1 1 9 PHE H H -3.655 0.705 -0.922 1.00 . A A . 9 PHE H 1 1
13 1660 1 1 9 PHE HA H -2.723 -1.600 0.534 1.00 . A A . 9 PHE HA 1 1
13 1661 1 1 9 PHE HB2 H -5.456 -0.517 0.352 1.00 . A A . 9 PHE HB2 1 1
13 1662 1 1 9 PHE HB3 H -5.272 -2.259 0.396 1.00 . A A . 9 PHE HB3 1 1
13 1663 1 1 9 PHE HD1 H -4.166 -3.331 2.359 1.00 . A A . 9 PHE HD1 1 1
13 1664 1 1 9 PHE HD2 H -5.202 0.796 2.301 1.00 . A A . 9 PHE HD2 1 1
13 1665 1 1 9 PHE HE1 H -3.953 -3.248 4.809 1.00 . A A . 9 PHE HE1 1 1
13 1666 1 1 9 PHE HE2 H -4.994 0.887 4.752 1.00 . A A . 9 PHE HE2 1 1
13 1667 1 1 9 PHE HZ H -4.369 -1.138 6.008 1.00 . A A . 9 PHE HZ 1 1
13 1668 1 1 9 PHE N N -3.216 0.221 -0.226 1.00 . A A . 9 PHE N 1 1
13 1669 1 1 9 PHE O O -3.977 -3.070 -1.463 1.00 . A A . 9 PHE O 1 1
13 1670 1 1 10 GLY C C -2.506 -0.821 -4.748 1.00 . A A . 10 GLY C 1 1
13 1671 1 1 10 GLY CA C -3.127 -1.766 -3.740 1.00 . A A . 10 GLY CA 1 1
13 1672 1 1 10 GLY H H -2.829 -0.312 -2.229 1.00 . A A . 10 GLY H 1 1
13 1673 1 1 10 GLY HA2 H -2.566 -2.689 -3.735 1.00 . A A . 10 GLY HA2 1 1
13 1674 1 1 10 GLY HA3 H -4.144 -1.977 -4.039 1.00 . A A . 10 GLY HA3 1 1
13 1675 1 1 10 GLY N N -3.138 -1.218 -2.397 1.00 . A A . 10 GLY N 1 1
13 1676 1 1 10 GLY O O -1.601 -1.256 -5.492 1.00 . A A . 10 GLY O 1 1
13 1677 1 1 10 GLY OXT O -2.925 0.355 -4.797 1.00 . A A . 10 GLY OXT 1 1
14 1678 1 1 1 GLY C C -1.070 -5.208 0.668 1.00 . A A . 1 GLY C 1 1
14 1679 1 1 1 GLY CA C -1.297 -6.706 0.709 1.00 . A A . 1 GLY CA 1 1
14 1680 1 1 1 GLY H1 H -2.584 -7.979 -0.331 1.00 . A A . 1 GLY H1 1 1
14 1681 1 1 1 GLY H2 H -1.158 -7.617 -1.165 1.00 . A A . 1 GLY H2 1 1
14 1682 1 1 1 GLY H3 H -2.389 -6.463 -1.054 1.00 . A A . 1 GLY H3 1 1
14 1683 1 1 1 GLY HA2 H -1.954 -6.936 1.534 1.00 . A A . 1 GLY HA2 1 1
14 1684 1 1 1 GLY HA3 H -0.348 -7.196 0.872 1.00 . A A . 1 GLY HA3 1 1
14 1685 1 1 1 GLY N N -1.899 -7.227 -0.548 1.00 . A A . 1 GLY N 1 1
14 1686 1 1 1 GLY O O -1.242 -4.576 -0.374 1.00 . A A . 1 GLY O 1 1
14 1687 1 1 2 TYR C C 0.662 -2.778 0.939 1.00 . A A . 2 TYR C 1 1
14 1688 1 1 2 TYR CA C -0.438 -3.205 1.899 1.00 . A A . 2 TYR CA 1 1
14 1689 1 1 2 TYR CB C -0.040 -2.819 3.326 1.00 . A A . 2 TYR CB 1 1
14 1690 1 1 2 TYR CD1 C -0.668 -0.402 3.662 1.00 . A A . 2 TYR CD1 1 1
14 1691 1 1 2 TYR CD2 C 1.647 -0.929 3.444 1.00 . A A . 2 TYR CD2 1 1
14 1692 1 1 2 TYR CE1 C -0.354 0.937 3.807 1.00 . A A . 2 TYR CE1 1 1
14 1693 1 1 2 TYR CE2 C 1.969 0.407 3.586 1.00 . A A . 2 TYR CE2 1 1
14 1694 1 1 2 TYR CG C 0.322 -1.357 3.480 1.00 . A A . 2 TYR CG 1 1
14 1695 1 1 2 TYR CZ C 0.965 1.335 3.768 1.00 . A A . 2 TYR CZ 1 1
14 1696 1 1 2 TYR H H -0.569 -5.193 2.602 1.00 . A A . 2 TYR H 1 1
14 1697 1 1 2 TYR HA H -1.350 -2.689 1.639 1.00 . A A . 2 TYR HA 1 1
14 1698 1 1 2 TYR HB2 H -0.864 -3.029 3.992 1.00 . A A . 2 TYR HB2 1 1
14 1699 1 1 2 TYR HB3 H 0.817 -3.407 3.626 1.00 . A A . 2 TYR HB3 1 1
14 1700 1 1 2 TYR HD1 H -1.701 -0.718 3.689 1.00 . A A . 2 TYR HD1 1 1
14 1701 1 1 2 TYR HD2 H 2.436 -1.655 3.298 1.00 . A A . 2 TYR HD2 1 1
14 1702 1 1 2 TYR HE1 H -1.140 1.663 3.948 1.00 . A A . 2 TYR HE1 1 1
14 1703 1 1 2 TYR HE2 H 3.002 0.718 3.556 1.00 . A A . 2 TYR HE2 1 1
14 1704 1 1 2 TYR HH H 0.609 3.205 3.491 1.00 . A A . 2 TYR HH 1 1
14 1705 1 1 2 TYR N N -0.687 -4.637 1.806 1.00 . A A . 2 TYR N 1 1
14 1706 1 1 2 TYR O O 1.751 -3.346 0.942 1.00 . A A . 2 TYR O 1 1
14 1707 1 1 2 TYR OH O 1.283 2.667 3.912 1.00 . A A . 2 TYR OH 1 1
14 1708 1 1 3 ASP C C 2.205 -0.183 -0.114 1.00 . A A . 3 ASP C 1 1
14 1709 1 1 3 ASP CA C 1.339 -1.231 -0.807 1.00 . A A . 3 ASP CA 1 1
14 1710 1 1 3 ASP CB C 0.627 -0.612 -2.012 1.00 . A A . 3 ASP CB 1 1
14 1711 1 1 3 ASP CG C 1.495 -0.605 -3.255 1.00 . A A . 3 ASP CG 1 1
14 1712 1 1 3 ASP H H -0.506 -1.347 0.201 1.00 . A A . 3 ASP H 1 1
14 1713 1 1 3 ASP HA H 1.956 -2.045 -1.138 1.00 . A A . 3 ASP HA 1 1
14 1714 1 1 3 ASP HB2 H -0.267 -1.180 -2.226 1.00 . A A . 3 ASP HB2 1 1
14 1715 1 1 3 ASP HB3 H 0.356 0.406 -1.778 1.00 . A A . 3 ASP HB3 1 1
14 1716 1 1 3 ASP N N 0.372 -1.761 0.139 1.00 . A A . 3 ASP N 1 1
14 1717 1 1 3 ASP O O 1.747 0.927 0.149 1.00 . A A . 3 ASP O 1 1
14 1718 1 1 3 ASP OD1 O 2.732 -0.492 -3.115 1.00 . A A . 3 ASP OD1 1 1
14 1719 1 1 3 ASP OD2 O 0.939 -0.712 -4.369 1.00 . A A . 3 ASP OD2 1 1
14 1720 1 1 4 PRO C C 4.849 1.535 0.046 1.00 . A A . 4 PRO C 1 1
14 1721 1 1 4 PRO CA C 4.366 0.388 0.925 1.00 . A A . 4 PRO CA 1 1
14 1722 1 1 4 PRO CB C 5.539 -0.505 1.344 1.00 . A A . 4 PRO CB 1 1
14 1723 1 1 4 PRO CD C 4.100 -1.824 -0.004 1.00 . A A . 4 PRO CD 1 1
14 1724 1 1 4 PRO CG C 5.042 -1.891 1.168 1.00 . A A . 4 PRO CG 1 1
14 1725 1 1 4 PRO HA H 3.898 0.785 1.807 1.00 . A A . 4 PRO HA 1 1
14 1726 1 1 4 PRO HB2 H 6.394 -0.306 0.715 1.00 . A A . 4 PRO HB2 1 1
14 1727 1 1 4 PRO HB3 H 5.785 -0.309 2.376 1.00 . A A . 4 PRO HB3 1 1
14 1728 1 1 4 PRO HD2 H 4.633 -1.831 -0.951 1.00 . A A . 4 PRO HD2 1 1
14 1729 1 1 4 PRO HD3 H 3.382 -2.623 0.039 1.00 . A A . 4 PRO HD3 1 1
14 1730 1 1 4 PRO HG2 H 5.868 -2.567 0.980 1.00 . A A . 4 PRO HG2 1 1
14 1731 1 1 4 PRO HG3 H 4.508 -2.185 2.057 1.00 . A A . 4 PRO HG3 1 1
14 1732 1 1 4 PRO N N 3.460 -0.527 0.227 1.00 . A A . 4 PRO N 1 1
14 1733 1 1 4 PRO O O 5.074 2.646 0.527 1.00 . A A . 4 PRO O 1 1
14 1734 1 1 5 ALA C C 4.490 3.447 -2.231 1.00 . A A . 5 ALA C 1 1
14 1735 1 1 5 ALA CA C 5.462 2.272 -2.187 1.00 . A A . 5 ALA CA 1 1
14 1736 1 1 5 ALA CB C 5.627 1.668 -3.574 1.00 . A A . 5 ALA CB 1 1
14 1737 1 1 5 ALA H H 4.807 0.359 -1.567 1.00 . A A . 5 ALA H 1 1
14 1738 1 1 5 ALA HA H 6.426 2.628 -1.856 1.00 . A A . 5 ALA HA 1 1
14 1739 1 1 5 ALA HB1 H 4.879 0.904 -3.725 1.00 . A A . 5 ALA HB1 1 1
14 1740 1 1 5 ALA HB2 H 6.611 1.231 -3.659 1.00 . A A . 5 ALA HB2 1 1
14 1741 1 1 5 ALA HB3 H 5.510 2.440 -4.319 1.00 . A A . 5 ALA HB3 1 1
14 1742 1 1 5 ALA N N 5.006 1.262 -1.243 1.00 . A A . 5 ALA N 1 1
14 1743 1 1 5 ALA O O 4.878 4.597 -2.032 1.00 . A A . 5 ALA O 1 1
14 1744 1 1 6 THR C C 1.647 4.451 -1.160 1.00 . A A . 6 THR C 1 1
14 1745 1 1 6 THR CA C 2.191 4.151 -2.557 1.00 . A A . 6 THR CA 1 1
14 1746 1 1 6 THR CB C 1.078 3.662 -3.486 1.00 . A A . 6 THR CB 1 1
14 1747 1 1 6 THR CG2 C -0.179 4.488 -3.416 1.00 . A A . 6 THR CG2 1 1
14 1748 1 1 6 THR H H 2.973 2.214 -2.638 1.00 . A A . 6 THR H 1 1
14 1749 1 1 6 THR HA H 2.627 5.044 -2.967 1.00 . A A . 6 THR HA 1 1
14 1750 1 1 6 THR HB H 0.822 2.647 -3.218 1.00 . A A . 6 THR HB 1 1
14 1751 1 1 6 THR HG1 H 1.112 2.931 -5.304 1.00 . A A . 6 THR HG1 1 1
14 1752 1 1 6 THR HG21 H -1.031 3.857 -3.617 1.00 . A A . 6 THR HG21 1 1
14 1753 1 1 6 THR HG22 H -0.132 5.278 -4.149 1.00 . A A . 6 THR HG22 1 1
14 1754 1 1 6 THR HG23 H -0.270 4.914 -2.430 1.00 . A A . 6 THR HG23 1 1
14 1755 1 1 6 THR N N 3.223 3.143 -2.490 1.00 . A A . 6 THR N 1 1
14 1756 1 1 6 THR O O 1.211 5.567 -0.877 1.00 . A A . 6 THR O 1 1
14 1757 1 1 6 THR OG1 O 1.516 3.665 -4.833 1.00 . A A . 6 THR OG1 1 1
14 1758 1 1 7 GLY C C -0.291 3.446 1.183 1.00 . A A . 7 GLY C 1 1
14 1759 1 1 7 GLY CA C 1.208 3.603 1.064 1.00 . A A . 7 GLY CA 1 1
14 1760 1 1 7 GLY H H 2.049 2.585 -0.576 1.00 . A A . 7 GLY H 1 1
14 1761 1 1 7 GLY HA2 H 1.674 2.851 1.676 1.00 . A A . 7 GLY HA2 1 1
14 1762 1 1 7 GLY HA3 H 1.490 4.576 1.420 1.00 . A A . 7 GLY HA3 1 1
14 1763 1 1 7 GLY N N 1.685 3.445 -0.293 1.00 . A A . 7 GLY N 1 1
14 1764 1 1 7 GLY O O -0.927 4.067 2.035 1.00 . A A . 7 GLY O 1 1
14 1765 1 1 8 THR C C -2.476 0.848 0.449 1.00 . A A . 8 THR C 1 1
14 1766 1 1 8 THR CA C -2.244 2.345 0.298 1.00 . A A . 8 THR CA 1 1
14 1767 1 1 8 THR CB C -2.796 2.874 -1.022 1.00 . A A . 8 THR CB 1 1
14 1768 1 1 8 THR CG2 C -4.220 3.322 -0.915 1.00 . A A . 8 THR CG2 1 1
14 1769 1 1 8 THR H H -0.314 2.157 -0.323 1.00 . A A . 8 THR H 1 1
14 1770 1 1 8 THR HA H -2.714 2.853 1.106 1.00 . A A . 8 THR HA 1 1
14 1771 1 1 8 THR HB H -2.741 2.095 -1.767 1.00 . A A . 8 THR HB 1 1
14 1772 1 1 8 THR HG1 H -2.124 4.707 -0.856 1.00 . A A . 8 THR HG1 1 1
14 1773 1 1 8 THR HG21 H -4.604 3.040 0.051 1.00 . A A . 8 THR HG21 1 1
14 1774 1 1 8 THR HG22 H -4.803 2.851 -1.690 1.00 . A A . 8 THR HG22 1 1
14 1775 1 1 8 THR HG23 H -4.263 4.393 -1.025 1.00 . A A . 8 THR HG23 1 1
14 1776 1 1 8 THR N N -0.852 2.610 0.324 1.00 . A A . 8 THR N 1 1
14 1777 1 1 8 THR O O -1.832 0.179 1.257 1.00 . A A . 8 THR O 1 1
14 1778 1 1 8 THR OG1 O -2.035 3.979 -1.476 1.00 . A A . 8 THR OG1 1 1
14 1779 1 1 9 PHE C C -3.819 -1.615 -1.744 1.00 . A A . 9 PHE C 1 1
14 1780 1 1 9 PHE CA C -3.740 -1.065 -0.332 1.00 . A A . 9 PHE CA 1 1
14 1781 1 1 9 PHE CB C -5.069 -1.257 0.367 1.00 . A A . 9 PHE CB 1 1
14 1782 1 1 9 PHE CD1 C -4.214 -0.946 2.711 1.00 . A A . 9 PHE CD1 1 1
14 1783 1 1 9 PHE CD2 C -5.564 -2.855 2.238 1.00 . A A . 9 PHE CD2 1 1
14 1784 1 1 9 PHE CE1 C -4.100 -1.351 4.028 1.00 . A A . 9 PHE CE1 1 1
14 1785 1 1 9 PHE CE2 C -5.454 -3.263 3.553 1.00 . A A . 9 PHE CE2 1 1
14 1786 1 1 9 PHE CG C -4.947 -1.693 1.801 1.00 . A A . 9 PHE CG 1 1
14 1787 1 1 9 PHE CZ C -4.720 -2.511 4.449 1.00 . A A . 9 PHE CZ 1 1
14 1788 1 1 9 PHE H H -3.837 0.943 -0.936 1.00 . A A . 9 PHE H 1 1
14 1789 1 1 9 PHE HA H -2.974 -1.579 0.186 1.00 . A A . 9 PHE HA 1 1
14 1790 1 1 9 PHE HB2 H -5.594 -0.318 0.339 1.00 . A A . 9 PHE HB2 1 1
14 1791 1 1 9 PHE HB3 H -5.644 -2.000 -0.163 1.00 . A A . 9 PHE HB3 1 1
14 1792 1 1 9 PHE HD1 H -3.730 -0.039 2.383 1.00 . A A . 9 PHE HD1 1 1
14 1793 1 1 9 PHE HD2 H -6.138 -3.445 1.538 1.00 . A A . 9 PHE HD2 1 1
14 1794 1 1 9 PHE HE1 H -3.524 -0.761 4.726 1.00 . A A . 9 PHE HE1 1 1
14 1795 1 1 9 PHE HE2 H -5.940 -4.171 3.881 1.00 . A A . 9 PHE HE2 1 1
14 1796 1 1 9 PHE HZ H -4.631 -2.828 5.477 1.00 . A A . 9 PHE HZ 1 1
14 1797 1 1 9 PHE N N -3.390 0.346 -0.335 1.00 . A A . 9 PHE N 1 1
14 1798 1 1 9 PHE O O -4.223 -2.757 -1.972 1.00 . A A . 9 PHE O 1 1
14 1799 1 1 10 GLY C C -2.872 -0.055 -4.960 1.00 . A A . 10 GLY C 1 1
14 1800 1 1 10 GLY CA C -3.441 -1.145 -4.074 1.00 . A A . 10 GLY CA 1 1
14 1801 1 1 10 GLY H H -3.128 0.096 -2.386 1.00 . A A . 10 GLY H 1 1
14 1802 1 1 10 GLY HA2 H -2.858 -2.045 -4.207 1.00 . A A . 10 GLY HA2 1 1
14 1803 1 1 10 GLY HA3 H -4.460 -1.342 -4.376 1.00 . A A . 10 GLY HA3 1 1
14 1804 1 1 10 GLY N N -3.430 -0.783 -2.668 1.00 . A A . 10 GLY N 1 1
14 1805 1 1 10 GLY O O -1.639 0.144 -4.936 1.00 . A A . 10 GLY O 1 1
14 1806 1 1 10 GLY OXT O -3.657 0.599 -5.676 1.00 . A A . 10 GLY OXT 1 1
15 1807 1 1 1 GLY C C -1.064 -5.336 0.361 1.00 . A A . 1 GLY C 1 1
15 1808 1 1 1 GLY CA C -1.272 -6.837 0.312 1.00 . A A . 1 GLY CA 1 1
15 1809 1 1 1 GLY H1 H -3.068 -7.387 -0.600 1.00 . A A . 1 GLY H1 1 1
15 1810 1 1 1 GLY H2 H -3.267 -6.453 0.795 1.00 . A A . 1 GLY H2 1 1
15 1811 1 1 1 GLY H3 H -2.833 -8.082 0.926 1.00 . A A . 1 GLY H3 1 1
15 1812 1 1 1 GLY HA2 H -0.763 -7.287 1.152 1.00 . A A . 1 GLY HA2 1 1
15 1813 1 1 1 GLY HA3 H -0.842 -7.219 -0.602 1.00 . A A . 1 GLY HA3 1 1
15 1814 1 1 1 GLY N N -2.710 -7.216 0.361 1.00 . A A . 1 GLY N 1 1
15 1815 1 1 1 GLY O O -1.250 -4.644 -0.639 1.00 . A A . 1 GLY O 1 1
15 1816 1 1 2 TYR C C 0.659 -2.916 0.786 1.00 . A A . 2 TYR C 1 1
15 1817 1 1 2 TYR CA C -0.448 -3.407 1.708 1.00 . A A . 2 TYR CA 1 1
15 1818 1 1 2 TYR CB C -0.074 -3.101 3.161 1.00 . A A . 2 TYR CB 1 1
15 1819 1 1 2 TYR CD1 C -0.861 -0.761 3.668 1.00 . A A . 2 TYR CD1 1 1
15 1820 1 1 2 TYR CD2 C 1.482 -1.121 3.416 1.00 . A A . 2 TYR CD2 1 1
15 1821 1 1 2 TYR CE1 C -0.633 0.581 3.905 1.00 . A A . 2 TYR CE1 1 1
15 1822 1 1 2 TYR CE2 C 1.718 0.218 3.652 1.00 . A A . 2 TYR CE2 1 1
15 1823 1 1 2 TYR CG C 0.188 -1.634 3.421 1.00 . A A . 2 TYR CG 1 1
15 1824 1 1 2 TYR CZ C 0.660 1.066 3.896 1.00 . A A . 2 TYR CZ 1 1
15 1825 1 1 2 TYR H H -0.549 -5.433 2.289 1.00 . A A . 2 TYR H 1 1
15 1826 1 1 2 TYR HA H -1.362 -2.887 1.465 1.00 . A A . 2 TYR HA 1 1
15 1827 1 1 2 TYR HB2 H -0.883 -3.413 3.806 1.00 . A A . 2 TYR HB2 1 1
15 1828 1 1 2 TYR HB3 H 0.819 -3.651 3.419 1.00 . A A . 2 TYR HB3 1 1
15 1829 1 1 2 TYR HD1 H -1.871 -1.143 3.673 1.00 . A A . 2 TYR HD1 1 1
15 1830 1 1 2 TYR HD2 H 2.313 -1.783 3.225 1.00 . A A . 2 TYR HD2 1 1
15 1831 1 1 2 TYR HE1 H -1.464 1.245 4.097 1.00 . A A . 2 TYR HE1 1 1
15 1832 1 1 2 TYR HE2 H 2.731 0.595 3.644 1.00 . A A . 2 TYR HE2 1 1
15 1833 1 1 2 TYR HH H 0.404 2.929 3.493 1.00 . A A . 2 TYR HH 1 1
15 1834 1 1 2 TYR N N -0.680 -4.833 1.530 1.00 . A A . 2 TYR N 1 1
15 1835 1 1 2 TYR O O 1.744 -3.492 0.744 1.00 . A A . 2 TYR O 1 1
15 1836 1 1 2 TYR OH O 0.891 2.401 4.132 1.00 . A A . 2 TYR OH 1 1
15 1837 1 1 3 ASP C C 2.165 -0.190 -0.116 1.00 . A A . 3 ASP C 1 1
15 1838 1 1 3 ASP CA C 1.344 -1.249 -0.848 1.00 . A A . 3 ASP CA 1 1
15 1839 1 1 3 ASP CB C 0.634 -0.624 -2.050 1.00 . A A . 3 ASP CB 1 1
15 1840 1 1 3 ASP CG C 1.510 -0.593 -3.287 1.00 . A A . 3 ASP CG 1 1
15 1841 1 1 3 ASP H H -0.500 -1.429 0.151 1.00 . A A . 3 ASP H 1 1
15 1842 1 1 3 ASP HA H 1.994 -2.033 -1.190 1.00 . A A . 3 ASP HA 1 1
15 1843 1 1 3 ASP HB2 H -0.253 -1.197 -2.275 1.00 . A A . 3 ASP HB2 1 1
15 1844 1 1 3 ASP HB3 H 0.350 0.389 -1.805 1.00 . A A . 3 ASP HB3 1 1
15 1845 1 1 3 ASP N N 0.376 -1.841 0.062 1.00 . A A . 3 ASP N 1 1
15 1846 1 1 3 ASP O O 1.671 0.903 0.158 1.00 . A A . 3 ASP O 1 1
15 1847 1 1 3 ASP OD1 O 1.695 -1.659 -3.912 1.00 . A A . 3 ASP OD1 1 1
15 1848 1 1 3 ASP OD2 O 2.011 0.498 -3.633 1.00 . A A . 3 ASP OD2 1 1
15 1849 1 1 4 PRO C C 4.808 1.565 0.108 1.00 . A A . 4 PRO C 1 1
15 1850 1 1 4 PRO CA C 4.293 0.420 0.972 1.00 . A A . 4 PRO CA 1 1
15 1851 1 1 4 PRO CB C 5.457 -0.463 1.439 1.00 . A A . 4 PRO CB 1 1
15 1852 1 1 4 PRO CD C 4.106 -1.776 -0.001 1.00 . A A . 4 PRO CD 1 1
15 1853 1 1 4 PRO CG C 4.994 -1.853 1.210 1.00 . A A . 4 PRO CG 1 1
15 1854 1 1 4 PRO HA H 3.788 0.816 1.834 1.00 . A A . 4 PRO HA 1 1
15 1855 1 1 4 PRO HB2 H 6.340 -0.238 0.863 1.00 . A A . 4 PRO HB2 1 1
15 1856 1 1 4 PRO HB3 H 5.640 -0.285 2.488 1.00 . A A . 4 PRO HB3 1 1
15 1857 1 1 4 PRO HD2 H 4.682 -1.739 -0.923 1.00 . A A . 4 PRO HD2 1 1
15 1858 1 1 4 PRO HD3 H 3.410 -2.593 -0.016 1.00 . A A . 4 PRO HD3 1 1
15 1859 1 1 4 PRO HG2 H 5.840 -2.509 1.046 1.00 . A A . 4 PRO HG2 1 1
15 1860 1 1 4 PRO HG3 H 4.428 -2.174 2.066 1.00 . A A . 4 PRO HG3 1 1
15 1861 1 1 4 PRO N N 3.424 -0.503 0.240 1.00 . A A . 4 PRO N 1 1
15 1862 1 1 4 PRO O O 5.011 2.679 0.593 1.00 . A A . 4 PRO O 1 1
15 1863 1 1 5 ALA C C 4.560 3.470 -2.181 1.00 . A A . 5 ALA C 1 1
15 1864 1 1 5 ALA CA C 5.518 2.291 -2.101 1.00 . A A . 5 ALA CA 1 1
15 1865 1 1 5 ALA CB C 5.725 1.681 -3.479 1.00 . A A . 5 ALA CB 1 1
15 1866 1 1 5 ALA H H 4.842 0.380 -1.497 1.00 . A A . 5 ALA H 1 1
15 1867 1 1 5 ALA HA H 6.475 2.638 -1.738 1.00 . A A . 5 ALA HA 1 1
15 1868 1 1 5 ALA HB1 H 6.131 0.686 -3.375 1.00 . A A . 5 ALA HB1 1 1
15 1869 1 1 5 ALA HB2 H 6.412 2.293 -4.044 1.00 . A A . 5 ALA HB2 1 1
15 1870 1 1 5 ALA HB3 H 4.778 1.632 -3.996 1.00 . A A . 5 ALA HB3 1 1
15 1871 1 1 5 ALA N N 5.022 1.285 -1.171 1.00 . A A . 5 ALA N 1 1
15 1872 1 1 5 ALA O O 4.949 4.617 -1.957 1.00 . A A . 5 ALA O 1 1
15 1873 1 1 6 THR C C 1.703 4.509 -1.226 1.00 . A A . 6 THR C 1 1
15 1874 1 1 6 THR CA C 2.286 4.193 -2.602 1.00 . A A . 6 THR CA 1 1
15 1875 1 1 6 THR CB C 1.196 3.709 -3.555 1.00 . A A . 6 THR CB 1 1
15 1876 1 1 6 THR CG2 C -0.021 4.593 -3.572 1.00 . A A . 6 THR CG2 1 1
15 1877 1 1 6 THR H H 3.055 2.252 -2.658 1.00 . A A . 6 THR H 1 1
15 1878 1 1 6 THR HA H 2.742 5.080 -3.005 1.00 . A A . 6 THR HA 1 1
15 1879 1 1 6 THR HB H 0.882 2.720 -3.252 1.00 . A A . 6 THR HB 1 1
15 1880 1 1 6 THR HG1 H 1.368 2.826 -5.294 1.00 . A A . 6 THR HG1 1 1
15 1881 1 1 6 THR HG21 H -0.859 4.041 -3.963 1.00 . A A . 6 THR HG21 1 1
15 1882 1 1 6 THR HG22 H 0.170 5.452 -4.196 1.00 . A A . 6 THR HG22 1 1
15 1883 1 1 6 THR HG23 H -0.238 4.918 -2.567 1.00 . A A . 6 THR HG23 1 1
15 1884 1 1 6 THR N N 3.306 3.179 -2.495 1.00 . A A . 6 THR N 1 1
15 1885 1 1 6 THR O O 1.282 5.634 -0.958 1.00 . A A . 6 THR O 1 1
15 1886 1 1 6 THR OG1 O 1.688 3.632 -4.881 1.00 . A A . 6 THR OG1 1 1
15 1887 1 1 7 GLY C C -0.332 3.526 1.056 1.00 . A A . 7 GLY C 1 1
15 1888 1 1 7 GLY CA C 1.170 3.676 0.983 1.00 . A A . 7 GLY CA 1 1
15 1889 1 1 7 GLY H H 2.043 2.636 -0.625 1.00 . A A . 7 GLY H 1 1
15 1890 1 1 7 GLY HA2 H 1.616 2.930 1.618 1.00 . A A . 7 GLY HA2 1 1
15 1891 1 1 7 GLY HA3 H 1.447 4.652 1.338 1.00 . A A . 7 GLY HA3 1 1
15 1892 1 1 7 GLY N N 1.691 3.502 -0.357 1.00 . A A . 7 GLY N 1 1
15 1893 1 1 7 GLY O O -0.994 4.178 1.865 1.00 . A A . 7 GLY O 1 1
15 1894 1 1 8 THR C C -2.512 0.948 0.539 1.00 . A A . 8 THR C 1 1
15 1895 1 1 8 THR CA C -2.261 2.395 0.153 1.00 . A A . 8 THR CA 1 1
15 1896 1 1 8 THR CB C -2.743 2.695 -1.264 1.00 . A A . 8 THR CB 1 1
15 1897 1 1 8 THR CG2 C -4.154 3.197 -1.300 1.00 . A A . 8 THR CG2 1 1
15 1898 1 1 8 THR H H -0.311 2.176 -0.400 1.00 . A A . 8 THR H 1 1
15 1899 1 1 8 THR HA H -2.767 3.031 0.840 1.00 . A A . 8 THR HA 1 1
15 1900 1 1 8 THR HB H -2.690 1.795 -1.856 1.00 . A A . 8 THR HB 1 1
15 1901 1 1 8 THR HG1 H -1.961 4.489 -1.361 1.00 . A A . 8 THR HG1 1 1
15 1902 1 1 8 THR HG21 H -4.226 4.008 -2.007 1.00 . A A . 8 THR HG21 1 1
15 1903 1 1 8 THR HG22 H -4.426 3.548 -0.319 1.00 . A A . 8 THR HG22 1 1
15 1904 1 1 8 THR HG23 H -4.811 2.396 -1.596 1.00 . A A . 8 THR HG23 1 1
15 1905 1 1 8 THR N N -0.869 2.659 0.211 1.00 . A A . 8 THR N 1 1
15 1906 1 1 8 THR O O -1.918 0.424 1.480 1.00 . A A . 8 THR O 1 1
15 1907 1 1 8 THR OG1 O -1.926 3.678 -1.874 1.00 . A A . 8 THR OG1 1 1
15 1908 1 1 9 PHE C C -3.943 -1.810 -1.270 1.00 . A A . 9 PHE C 1 1
15 1909 1 1 9 PHE CA C -3.758 -1.060 0.037 1.00 . A A . 9 PHE CA 1 1
15 1910 1 1 9 PHE CB C -5.035 -1.101 0.835 1.00 . A A . 9 PHE CB 1 1
15 1911 1 1 9 PHE CD1 C -4.597 -2.235 3.030 1.00 . A A . 9 PHE CD1 1 1
15 1912 1 1 9 PHE CD2 C -4.832 0.139 3.005 1.00 . A A . 9 PHE CD2 1 1
15 1913 1 1 9 PHE CE1 C -4.390 -2.204 4.396 1.00 . A A . 9 PHE CE1 1 1
15 1914 1 1 9 PHE CE2 C -4.628 0.175 4.372 1.00 . A A . 9 PHE CE2 1 1
15 1915 1 1 9 PHE CG C -4.819 -1.066 2.320 1.00 . A A . 9 PHE CG 1 1
15 1916 1 1 9 PHE CZ C -4.407 -0.997 5.067 1.00 . A A . 9 PHE CZ 1 1
15 1917 1 1 9 PHE H H -3.813 0.807 -0.899 1.00 . A A . 9 PHE H 1 1
15 1918 1 1 9 PHE HA H -2.969 -1.513 0.581 1.00 . A A . 9 PHE HA 1 1
15 1919 1 1 9 PHE HB2 H -5.625 -0.245 0.554 1.00 . A A . 9 PHE HB2 1 1
15 1920 1 1 9 PHE HB3 H -5.572 -1.996 0.588 1.00 . A A . 9 PHE HB3 1 1
15 1921 1 1 9 PHE HD1 H -4.584 -3.179 2.505 1.00 . A A . 9 PHE HD1 1 1
15 1922 1 1 9 PHE HD2 H -5.004 1.055 2.461 1.00 . A A . 9 PHE HD2 1 1
15 1923 1 1 9 PHE HE1 H -4.218 -3.122 4.936 1.00 . A A . 9 PHE HE1 1 1
15 1924 1 1 9 PHE HE2 H -4.641 1.120 4.894 1.00 . A A . 9 PHE HE2 1 1
15 1925 1 1 9 PHE HZ H -4.247 -0.971 6.136 1.00 . A A . 9 PHE HZ 1 1
15 1926 1 1 9 PHE N N -3.394 0.323 -0.192 1.00 . A A . 9 PHE N 1 1
15 1927 1 1 9 PHE O O -4.435 -2.938 -1.303 1.00 . A A . 9 PHE O 1 1
15 1928 1 1 10 GLY C C -4.520 -0.906 -4.580 1.00 . A A . 10 GLY C 1 1
15 1929 1 1 10 GLY CA C -3.646 -1.735 -3.659 1.00 . A A . 10 GLY CA 1 1
15 1930 1 1 10 GLY H H -3.166 -0.274 -2.201 1.00 . A A . 10 GLY H 1 1
15 1931 1 1 10 GLY HA2 H -2.658 -1.808 -4.087 1.00 . A A . 10 GLY HA2 1 1
15 1932 1 1 10 GLY HA3 H -4.066 -2.726 -3.578 1.00 . A A . 10 GLY HA3 1 1
15 1933 1 1 10 GLY N N -3.541 -1.161 -2.330 1.00 . A A . 10 GLY N 1 1
15 1934 1 1 10 GLY O O -5.540 -1.438 -5.068 1.00 . A A . 10 GLY O 1 1
15 1935 1 1 10 GLY OXT O -4.185 0.274 -4.812 1.00 . A A . 10 GLY OXT 1 1
16 1936 1 1 1 GLY C C -1.103 -5.336 0.323 1.00 . A A . 1 GLY C 1 1
16 1937 1 1 1 GLY CA C -1.317 -6.835 0.257 1.00 . A A . 1 GLY CA 1 1
16 1938 1 1 1 GLY H1 H 0.726 -7.095 -0.094 1.00 . A A . 1 GLY H1 1 1
16 1939 1 1 1 GLY H2 H -0.148 -8.541 -0.034 1.00 . A A . 1 GLY H2 1 1
16 1940 1 1 1 GLY H3 H 0.203 -7.706 1.394 1.00 . A A . 1 GLY H3 1 1
16 1941 1 1 1 GLY HA2 H -1.774 -7.081 -0.690 1.00 . A A . 1 GLY HA2 1 1
16 1942 1 1 1 GLY HA3 H -1.985 -7.127 1.053 1.00 . A A . 1 GLY HA3 1 1
16 1943 1 1 1 GLY N N -0.045 -7.599 0.390 1.00 . A A . 1 GLY N 1 1
16 1944 1 1 1 GLY O O -1.294 -4.630 -0.669 1.00 . A A . 1 GLY O 1 1
16 1945 1 1 2 TYR C C 0.644 -2.931 0.766 1.00 . A A . 2 TYR C 1 1
16 1946 1 1 2 TYR CA C -0.464 -3.424 1.686 1.00 . A A . 2 TYR CA 1 1
16 1947 1 1 2 TYR CB C -0.088 -3.137 3.140 1.00 . A A . 2 TYR CB 1 1
16 1948 1 1 2 TYR CD1 C -0.884 -0.805 3.680 1.00 . A A . 2 TYR CD1 1 1
16 1949 1 1 2 TYR CD2 C 1.460 -1.153 3.420 1.00 . A A . 2 TYR CD2 1 1
16 1950 1 1 2 TYR CE1 C -0.660 0.535 3.932 1.00 . A A . 2 TYR CE1 1 1
16 1951 1 1 2 TYR CE2 C 1.692 0.183 3.672 1.00 . A A . 2 TYR CE2 1 1
16 1952 1 1 2 TYR CG C 0.168 -1.671 3.419 1.00 . A A . 2 TYR CG 1 1
16 1953 1 1 2 TYR CZ C 0.630 1.025 3.927 1.00 . A A . 2 TYR CZ 1 1
16 1954 1 1 2 TYR H H -0.569 -5.459 2.243 1.00 . A A . 2 TYR H 1 1
16 1955 1 1 2 TYR HA H -1.376 -2.898 1.449 1.00 . A A . 2 TYR HA 1 1
16 1956 1 1 2 TYR HB2 H -0.893 -3.460 3.785 1.00 . A A . 2 TYR HB2 1 1
16 1957 1 1 2 TYR HB3 H 0.809 -3.685 3.389 1.00 . A A . 2 TYR HB3 1 1
16 1958 1 1 2 TYR HD1 H -1.892 -1.191 3.679 1.00 . A A . 2 TYR HD1 1 1
16 1959 1 1 2 TYR HD2 H 2.292 -1.810 3.217 1.00 . A A . 2 TYR HD2 1 1
16 1960 1 1 2 TYR HE1 H -1.493 1.192 4.132 1.00 . A A . 2 TYR HE1 1 1
16 1961 1 1 2 TYR HE2 H 2.704 0.564 3.666 1.00 . A A . 2 TYR HE2 1 1
16 1962 1 1 2 TYR HH H 1.553 2.678 3.601 1.00 . A A . 2 TYR HH 1 1
16 1963 1 1 2 TYR N N -0.705 -4.848 1.493 1.00 . A A . 2 TYR N 1 1
16 1964 1 1 2 TYR O O 1.727 -3.512 0.719 1.00 . A A . 2 TYR O 1 1
16 1965 1 1 2 TYR OH O 0.858 2.358 4.179 1.00 . A A . 2 TYR OH 1 1
16 1966 1 1 3 ASP C C 2.152 -0.196 -0.112 1.00 . A A . 3 ASP C 1 1
16 1967 1 1 3 ASP CA C 1.335 -1.252 -0.852 1.00 . A A . 3 ASP CA 1 1
16 1968 1 1 3 ASP CB C 0.627 -0.620 -2.052 1.00 . A A . 3 ASP CB 1 1
16 1969 1 1 3 ASP CG C 1.506 -0.582 -3.288 1.00 . A A . 3 ASP CG 1 1
16 1970 1 1 3 ASP H H -0.509 -1.433 0.149 1.00 . A A . 3 ASP H 1 1
16 1971 1 1 3 ASP HA H 1.986 -2.033 -1.194 1.00 . A A . 3 ASP HA 1 1
16 1972 1 1 3 ASP HB2 H -0.259 -1.193 -2.283 1.00 . A A . 3 ASP HB2 1 1
16 1973 1 1 3 ASP HB3 H 0.343 0.391 -1.803 1.00 . A A . 3 ASP HB3 1 1
16 1974 1 1 3 ASP N N 0.365 -1.848 0.054 1.00 . A A . 3 ASP N 1 1
16 1975 1 1 3 ASP O O 1.656 0.895 0.165 1.00 . A A . 3 ASP O 1 1
16 1976 1 1 3 ASP OD1 O 2.728 -0.366 -3.139 1.00 . A A . 3 ASP OD1 1 1
16 1977 1 1 3 ASP OD2 O 0.974 -0.765 -4.401 1.00 . A A . 3 ASP OD2 1 1
16 1978 1 1 4 PRO C C 4.792 1.564 0.125 1.00 . A A . 4 PRO C 1 1
16 1979 1 1 4 PRO CA C 4.275 0.415 0.984 1.00 . A A . 4 PRO CA 1 1
16 1980 1 1 4 PRO CB C 5.439 -0.468 1.451 1.00 . A A . 4 PRO CB 1 1
16 1981 1 1 4 PRO CD C 4.097 -1.777 -0.002 1.00 . A A . 4 PRO CD 1 1
16 1982 1 1 4 PRO CG C 4.981 -1.857 1.213 1.00 . A A . 4 PRO CG 1 1
16 1983 1 1 4 PRO HA H 3.766 0.807 1.843 1.00 . A A . 4 PRO HA 1 1
16 1984 1 1 4 PRO HB2 H 6.325 -0.238 0.881 1.00 . A A . 4 PRO HB2 1 1
16 1985 1 1 4 PRO HB3 H 5.617 -0.294 2.501 1.00 . A A . 4 PRO HB3 1 1
16 1986 1 1 4 PRO HD2 H 4.675 -1.734 -0.921 1.00 . A A . 4 PRO HD2 1 1
16 1987 1 1 4 PRO HD3 H 3.402 -2.596 -0.022 1.00 . A A . 4 PRO HD3 1 1
16 1988 1 1 4 PRO HG2 H 5.830 -2.510 1.048 1.00 . A A . 4 PRO HG2 1 1
16 1989 1 1 4 PRO HG3 H 4.413 -2.185 2.066 1.00 . A A . 4 PRO HG3 1 1
16 1990 1 1 4 PRO N N 3.411 -0.508 0.244 1.00 . A A . 4 PRO N 1 1
16 1991 1 1 4 PRO O O 4.988 2.677 0.614 1.00 . A A . 4 PRO O 1 1
16 1992 1 1 5 ALA C C 4.542 3.468 -2.170 1.00 . A A . 5 ALA C 1 1
16 1993 1 1 5 ALA CA C 5.511 2.297 -2.078 1.00 . A A . 5 ALA CA 1 1
16 1994 1 1 5 ALA CB C 5.744 1.689 -3.453 1.00 . A A . 5 ALA CB 1 1
16 1995 1 1 5 ALA H H 4.837 0.382 -1.484 1.00 . A A . 5 ALA H 1 1
16 1996 1 1 5 ALA HA H 6.458 2.656 -1.703 1.00 . A A . 5 ALA HA 1 1
16 1997 1 1 5 ALA HB1 H 5.083 0.844 -3.589 1.00 . A A . 5 ALA HB1 1 1
16 1998 1 1 5 ALA HB2 H 6.769 1.362 -3.533 1.00 . A A . 5 ALA HB2 1 1
16 1999 1 1 5 ALA HB3 H 5.541 2.428 -4.213 1.00 . A A . 5 ALA HB3 1 1
16 2000 1 1 5 ALA N N 5.013 1.287 -1.154 1.00 . A A . 5 ALA N 1 1
16 2001 1 1 5 ALA O O 4.912 4.617 -1.938 1.00 . A A . 5 ALA O 1 1
16 2002 1 1 6 THR C C 1.692 4.505 -1.255 1.00 . A A . 6 THR C 1 1
16 2003 1 1 6 THR CA C 2.267 4.165 -2.629 1.00 . A A . 6 THR CA 1 1
16 2004 1 1 6 THR CB C 1.174 3.652 -3.563 1.00 . A A . 6 THR CB 1 1
16 2005 1 1 6 THR CG2 C -0.044 4.532 -3.598 1.00 . A A . 6 THR CG2 1 1
16 2006 1 1 6 THR H H 3.059 2.234 -2.677 1.00 . A A . 6 THR H 1 1
16 2007 1 1 6 THR HA H 2.712 5.048 -3.055 1.00 . A A . 6 THR HA 1 1
16 2008 1 1 6 THR HB H 0.864 2.672 -3.231 1.00 . A A . 6 THR HB 1 1
16 2009 1 1 6 THR HG1 H 1.384 2.699 -5.260 1.00 . A A . 6 THR HG1 1 1
16 2010 1 1 6 THR HG21 H -0.273 4.858 -2.598 1.00 . A A . 6 THR HG21 1 1
16 2011 1 1 6 THR HG22 H -0.875 3.973 -3.996 1.00 . A A . 6 THR HG22 1 1
16 2012 1 1 6 THR HG23 H 0.151 5.389 -4.223 1.00 . A A . 6 THR HG23 1 1
16 2013 1 1 6 THR N N 3.296 3.161 -2.508 1.00 . A A . 6 THR N 1 1
16 2014 1 1 6 THR O O 1.266 5.633 -1.007 1.00 . A A . 6 THR O 1 1
16 2015 1 1 6 THR OG1 O 1.660 3.539 -4.888 1.00 . A A . 6 THR OG1 1 1
16 2016 1 1 7 GLY C C -0.319 3.555 1.064 1.00 . A A . 7 GLY C 1 1
16 2017 1 1 7 GLY CA C 1.182 3.711 0.972 1.00 . A A . 7 GLY CA 1 1
16 2018 1 1 7 GLY H H 2.050 2.646 -0.621 1.00 . A A . 7 GLY H 1 1
16 2019 1 1 7 GLY HA2 H 1.637 2.979 1.618 1.00 . A A . 7 GLY HA2 1 1
16 2020 1 1 7 GLY HA3 H 1.456 4.696 1.308 1.00 . A A . 7 GLY HA3 1 1
16 2021 1 1 7 GLY N N 1.693 3.517 -0.367 1.00 . A A . 7 GLY N 1 1
16 2022 1 1 7 GLY O O -0.974 4.207 1.876 1.00 . A A . 7 GLY O 1 1
16 2023 1 1 8 THR C C -2.486 0.952 0.554 1.00 . A A . 8 THR C 1 1
16 2024 1 1 8 THR CA C -2.249 2.407 0.187 1.00 . A A . 8 THR CA 1 1
16 2025 1 1 8 THR CB C -2.755 2.726 -1.217 1.00 . A A . 8 THR CB 1 1
16 2026 1 1 8 THR CG2 C -4.178 3.196 -1.225 1.00 . A A . 8 THR CG2 1 1
16 2027 1 1 8 THR H H -0.302 2.197 -0.385 1.00 . A A . 8 THR H 1 1
16 2028 1 1 8 THR HA H -2.750 3.027 0.891 1.00 . A A . 8 THR HA 1 1
16 2029 1 1 8 THR HB H -2.690 1.840 -1.830 1.00 . A A . 8 THR HB 1 1
16 2030 1 1 8 THR HG1 H -2.333 3.965 -2.675 1.00 . A A . 8 THR HG1 1 1
16 2031 1 1 8 THR HG21 H -4.196 4.264 -1.367 1.00 . A A . 8 THR HG21 1 1
16 2032 1 1 8 THR HG22 H -4.633 2.949 -0.280 1.00 . A A . 8 THR HG22 1 1
16 2033 1 1 8 THR HG23 H -4.710 2.710 -2.025 1.00 . A A . 8 THR HG23 1 1
16 2034 1 1 8 THR N N -0.857 2.681 0.229 1.00 . A A . 8 THR N 1 1
16 2035 1 1 8 THR O O -1.879 0.422 1.484 1.00 . A A . 8 THR O 1 1
16 2036 1 1 8 THR OG1 O -1.967 3.740 -1.816 1.00 . A A . 8 THR OG1 1 1
16 2037 1 1 9 PHE C C -3.866 -1.804 -1.280 1.00 . A A . 9 PHE C 1 1
16 2038 1 1 9 PHE CA C -3.713 -1.061 0.033 1.00 . A A . 9 PHE CA 1 1
16 2039 1 1 9 PHE CB C -5.003 -1.127 0.812 1.00 . A A . 9 PHE CB 1 1
16 2040 1 1 9 PHE CD1 C -4.589 -2.284 2.999 1.00 . A A . 9 PHE CD1 1 1
16 2041 1 1 9 PHE CD2 C -4.843 0.086 3.002 1.00 . A A . 9 PHE CD2 1 1
16 2042 1 1 9 PHE CE1 C -4.405 -2.270 4.369 1.00 . A A . 9 PHE CE1 1 1
16 2043 1 1 9 PHE CE2 C -4.661 0.107 4.373 1.00 . A A . 9 PHE CE2 1 1
16 2044 1 1 9 PHE CG C -4.809 -1.108 2.302 1.00 . A A . 9 PHE CG 1 1
16 2045 1 1 9 PHE CZ C -4.442 -1.072 5.056 1.00 . A A . 9 PHE CZ 1 1
16 2046 1 1 9 PHE H H -3.792 0.819 -0.877 1.00 . A A . 9 PHE H 1 1
16 2047 1 1 9 PHE HA H -2.927 -1.507 0.587 1.00 . A A . 9 PHE HA 1 1
16 2048 1 1 9 PHE HB2 H -5.597 -0.272 0.534 1.00 . A A . 9 PHE HB2 1 1
16 2049 1 1 9 PHE HB3 H -5.527 -2.023 0.546 1.00 . A A . 9 PHE HB3 1 1
16 2050 1 1 9 PHE HD1 H -4.560 -3.222 2.462 1.00 . A A . 9 PHE HD1 1 1
16 2051 1 1 9 PHE HD2 H -5.014 1.009 2.468 1.00 . A A . 9 PHE HD2 1 1
16 2052 1 1 9 PHE HE1 H -4.233 -3.194 4.901 1.00 . A A . 9 PHE HE1 1 1
16 2053 1 1 9 PHE HE2 H -4.690 1.045 4.908 1.00 . A A . 9 PHE HE2 1 1
16 2054 1 1 9 PHE HZ H -4.298 -1.059 6.126 1.00 . A A . 9 PHE HZ 1 1
16 2055 1 1 9 PHE N N -3.364 0.328 -0.178 1.00 . A A . 9 PHE N 1 1
16 2056 1 1 9 PHE O O -4.340 -2.938 -1.329 1.00 . A A . 9 PHE O 1 1
16 2057 1 1 10 GLY C C -2.608 -1.012 -4.641 1.00 . A A . 10 GLY C 1 1
16 2058 1 1 10 GLY CA C -3.534 -1.707 -3.663 1.00 . A A . 10 GLY CA 1 1
16 2059 1 1 10 GLY H H -3.099 -0.249 -2.188 1.00 . A A . 10 GLY H 1 1
16 2060 1 1 10 GLY HA2 H -3.270 -2.752 -3.613 1.00 . A A . 10 GLY HA2 1 1
16 2061 1 1 10 GLY HA3 H -4.549 -1.618 -4.022 1.00 . A A . 10 GLY HA3 1 1
16 2062 1 1 10 GLY N N -3.458 -1.140 -2.329 1.00 . A A . 10 GLY N 1 1
16 2063 1 1 10 GLY O O -2.591 0.236 -4.662 1.00 . A A . 10 GLY O 1 1
16 2064 1 1 10 GLY OXT O -1.898 -1.719 -5.387 1.00 . A A . 10 GLY OXT 1 1
17 2065 1 1 1 GLY C C -1.346 -5.022 0.719 1.00 . A A . 1 GLY C 1 1
17 2066 1 1 1 GLY CA C -1.622 -6.511 0.748 1.00 . A A . 1 GLY CA 1 1
17 2067 1 1 1 GLY H1 H -0.614 -6.686 -1.073 1.00 . A A . 1 GLY H1 1 1
17 2068 1 1 1 GLY H2 H -2.253 -7.094 -1.157 1.00 . A A . 1 GLY H2 1 1
17 2069 1 1 1 GLY H3 H -1.152 -8.162 -0.443 1.00 . A A . 1 GLY H3 1 1
17 2070 1 1 1 GLY HA2 H -2.650 -6.670 1.041 1.00 . A A . 1 GLY HA2 1 1
17 2071 1 1 1 GLY HA3 H -0.975 -6.973 1.479 1.00 . A A . 1 GLY HA3 1 1
17 2072 1 1 1 GLY N N -1.395 -7.159 -0.574 1.00 . A A . 1 GLY N 1 1
17 2073 1 1 1 GLY O O -1.533 -4.368 -0.308 1.00 . A A . 1 GLY O 1 1
17 2074 1 1 2 TYR C C 0.491 -2.665 0.961 1.00 . A A . 2 TYR C 1 1
17 2075 1 1 2 TYR CA C -0.595 -3.063 1.950 1.00 . A A . 2 TYR CA 1 1
17 2076 1 1 2 TYR CB C -0.141 -2.709 3.369 1.00 . A A . 2 TYR CB 1 1
17 2077 1 1 2 TYR CD1 C -0.700 -0.284 3.761 1.00 . A A . 2 TYR CD1 1 1
17 2078 1 1 2 TYR CD2 C 1.590 -0.860 3.437 1.00 . A A . 2 TYR CD2 1 1
17 2079 1 1 2 TYR CE1 C -0.352 1.044 3.905 1.00 . A A . 2 TYR CE1 1 1
17 2080 1 1 2 TYR CE2 C 1.947 0.466 3.578 1.00 . A A . 2 TYR CE2 1 1
17 2081 1 1 2 TYR CG C 0.258 -1.258 3.527 1.00 . A A . 2 TYR CG 1 1
17 2082 1 1 2 TYR CZ C 0.974 1.415 3.813 1.00 . A A . 2 TYR CZ 1 1
17 2083 1 1 2 TYR H H -0.770 -5.054 2.631 1.00 . A A . 2 TYR H 1 1
17 2084 1 1 2 TYR HA H -1.495 -2.512 1.724 1.00 . A A . 2 TYR HA 1 1
17 2085 1 1 2 TYR HB2 H -0.950 -2.907 4.058 1.00 . A A . 2 TYR HB2 1 1
17 2086 1 1 2 TYR HB3 H 0.709 -3.320 3.631 1.00 . A A . 2 TYR HB3 1 1
17 2087 1 1 2 TYR HD1 H -1.737 -0.579 3.831 1.00 . A A . 2 TYR HD1 1 1
17 2088 1 1 2 TYR HD2 H 2.353 -1.601 3.250 1.00 . A A . 2 TYR HD2 1 1
17 2089 1 1 2 TYR HE1 H -1.116 1.784 4.087 1.00 . A A . 2 TYR HE1 1 1
17 2090 1 1 2 TYR HE2 H 2.985 0.754 3.506 1.00 . A A . 2 TYR HE2 1 1
17 2091 1 1 2 TYR HH H 0.671 3.292 3.525 1.00 . A A . 2 TYR HH 1 1
17 2092 1 1 2 TYR N N -0.899 -4.483 1.848 1.00 . A A . 2 TYR N 1 1
17 2093 1 1 2 TYR O O 1.552 -3.280 0.915 1.00 . A A . 2 TYR O 1 1
17 2094 1 1 2 TYR OH O 1.326 2.737 3.955 1.00 . A A . 2 TYR OH 1 1
17 2095 1 1 3 ASP C C 2.104 -0.107 -0.108 1.00 . A A . 3 ASP C 1 1
17 2096 1 1 3 ASP CA C 1.174 -1.114 -0.781 1.00 . A A . 3 ASP CA 1 1
17 2097 1 1 3 ASP CB C 0.445 -0.455 -1.954 1.00 . A A . 3 ASP CB 1 1
17 2098 1 1 3 ASP CG C 1.260 -0.489 -3.233 1.00 . A A . 3 ASP CG 1 1
17 2099 1 1 3 ASP H H -0.639 -1.170 0.290 1.00 . A A . 3 ASP H 1 1
17 2100 1 1 3 ASP HA H 1.748 -1.947 -1.142 1.00 . A A . 3 ASP HA 1 1
17 2101 1 1 3 ASP HB2 H -0.486 -0.974 -2.130 1.00 . A A . 3 ASP HB2 1 1
17 2102 1 1 3 ASP HB3 H 0.238 0.576 -1.708 1.00 . A A . 3 ASP HB3 1 1
17 2103 1 1 3 ASP N N 0.220 -1.619 0.191 1.00 . A A . 3 ASP N 1 1
17 2104 1 1 3 ASP O O 1.698 1.017 0.182 1.00 . A A . 3 ASP O 1 1
17 2105 1 1 3 ASP OD1 O 1.506 -1.598 -3.751 1.00 . A A . 3 ASP OD1 1 1
17 2106 1 1 3 ASP OD2 O 1.654 0.594 -3.715 1.00 . A A . 3 ASP OD2 1 1
17 2107 1 1 4 PRO C C 4.848 1.491 -0.030 1.00 . A A . 4 PRO C 1 1
17 2108 1 1 4 PRO CA C 4.322 0.371 0.861 1.00 . A A . 4 PRO CA 1 1
17 2109 1 1 4 PRO CB C 5.461 -0.581 1.247 1.00 . A A . 4 PRO CB 1 1
17 2110 1 1 4 PRO CD C 3.936 -1.819 -0.078 1.00 . A A . 4 PRO CD 1 1
17 2111 1 1 4 PRO CG C 4.895 -1.939 1.076 1.00 . A A . 4 PRO CG 1 1
17 2112 1 1 4 PRO HA H 3.899 0.788 1.754 1.00 . A A . 4 PRO HA 1 1
17 2113 1 1 4 PRO HB2 H 6.308 -0.419 0.598 1.00 . A A . 4 PRO HB2 1 1
17 2114 1 1 4 PRO HB3 H 5.740 -0.404 2.274 1.00 . A A . 4 PRO HB3 1 1
17 2115 1 1 4 PRO HD2 H 4.451 -1.835 -1.035 1.00 . A A . 4 PRO HD2 1 1
17 2116 1 1 4 PRO HD3 H 3.186 -2.588 -0.032 1.00 . A A . 4 PRO HD3 1 1
17 2117 1 1 4 PRO HG2 H 5.682 -2.654 0.870 1.00 . A A . 4 PRO HG2 1 1
17 2118 1 1 4 PRO HG3 H 4.364 -2.211 1.973 1.00 . A A . 4 PRO HG3 1 1
17 2119 1 1 4 PRO N N 3.355 -0.501 0.183 1.00 . A A . 4 PRO N 1 1
17 2120 1 1 4 PRO O O 5.165 2.579 0.448 1.00 . A A . 4 PRO O 1 1
17 2121 1 1 5 ALA C C 4.579 3.457 -2.256 1.00 . A A . 5 ALA C 1 1
17 2122 1 1 5 ALA CA C 5.438 2.200 -2.279 1.00 . A A . 5 ALA CA 1 1
17 2123 1 1 5 ALA CB C 5.470 1.606 -3.680 1.00 . A A . 5 ALA CB 1 1
17 2124 1 1 5 ALA H H 4.678 0.331 -1.645 1.00 . A A . 5 ALA H 1 1
17 2125 1 1 5 ALA HA H 6.447 2.460 -2.000 1.00 . A A . 5 ALA HA 1 1
17 2126 1 1 5 ALA HB1 H 5.846 2.342 -4.375 1.00 . A A . 5 ALA HB1 1 1
17 2127 1 1 5 ALA HB2 H 4.472 1.313 -3.972 1.00 . A A . 5 ALA HB2 1 1
17 2128 1 1 5 ALA HB3 H 6.116 0.740 -3.689 1.00 . A A . 5 ALA HB3 1 1
17 2129 1 1 5 ALA N N 4.944 1.216 -1.325 1.00 . A A . 5 ALA N 1 1
17 2130 1 1 5 ALA O O 5.085 4.565 -2.077 1.00 . A A . 5 ALA O 1 1
17 2131 1 1 6 THR C C 1.752 4.578 -1.043 1.00 . A A . 6 THR C 1 1
17 2132 1 1 6 THR CA C 2.344 4.377 -2.438 1.00 . A A . 6 THR CA 1 1
17 2133 1 1 6 THR CB C 1.241 4.100 -3.463 1.00 . A A . 6 THR CB 1 1
17 2134 1 1 6 THR CG2 C 0.035 4.992 -3.309 1.00 . A A . 6 THR CG2 1 1
17 2135 1 1 6 THR H H 2.936 2.377 -2.575 1.00 . A A . 6 THR H 1 1
17 2136 1 1 6 THR HA H 2.880 5.260 -2.727 1.00 . A A . 6 THR HA 1 1
17 2137 1 1 6 THR HB H 0.911 3.076 -3.351 1.00 . A A . 6 THR HB 1 1
17 2138 1 1 6 THR HG1 H 1.463 3.515 -5.317 1.00 . A A . 6 THR HG1 1 1
17 2139 1 1 6 THR HG21 H -0.244 5.036 -2.269 1.00 . A A . 6 THR HG21 1 1
17 2140 1 1 6 THR HG22 H -0.783 4.588 -3.885 1.00 . A A . 6 THR HG22 1 1
17 2141 1 1 6 THR HG23 H 0.274 5.983 -3.662 1.00 . A A . 6 THR HG23 1 1
17 2142 1 1 6 THR N N 3.278 3.275 -2.438 1.00 . A A . 6 THR N 1 1
17 2143 1 1 6 THR O O 1.333 5.678 -0.686 1.00 . A A . 6 THR O 1 1
17 2144 1 1 6 THR OG1 O 1.730 4.265 -4.780 1.00 . A A . 6 THR OG1 1 1
17 2145 1 1 7 GLY C C -0.302 3.352 1.131 1.00 . A A . 7 GLY C 1 1
17 2146 1 1 7 GLY CA C 1.195 3.566 1.083 1.00 . A A . 7 GLY CA 1 1
17 2147 1 1 7 GLY H H 2.077 2.659 -0.597 1.00 . A A . 7 GLY H 1 1
17 2148 1 1 7 GLY HA2 H 1.666 2.798 1.673 1.00 . A A . 7 GLY HA2 1 1
17 2149 1 1 7 GLY HA3 H 1.429 4.526 1.503 1.00 . A A . 7 GLY HA3 1 1
17 2150 1 1 7 GLY N N 1.728 3.503 -0.260 1.00 . A A . 7 GLY N 1 1
17 2151 1 1 7 GLY O O -0.996 3.927 1.969 1.00 . A A . 7 GLY O 1 1
17 2152 1 1 8 THR C C -2.380 0.729 0.422 1.00 . A A . 8 THR C 1 1
17 2153 1 1 8 THR CA C -2.174 2.208 0.134 1.00 . A A . 8 THR CA 1 1
17 2154 1 1 8 THR CB C -2.649 2.582 -1.269 1.00 . A A . 8 THR CB 1 1
17 2155 1 1 8 THR CG2 C -4.069 3.057 -1.293 1.00 . A A . 8 THR CG2 1 1
17 2156 1 1 8 THR H H -0.213 2.100 -0.407 1.00 . A A . 8 THR H 1 1
17 2157 1 1 8 THR HA H -2.713 2.781 0.852 1.00 . A A . 8 THR HA 1 1
17 2158 1 1 8 THR HB H -2.572 1.718 -1.911 1.00 . A A . 8 THR HB 1 1
17 2159 1 1 8 THR HG1 H -1.961 4.414 -1.301 1.00 . A A . 8 THR HG1 1 1
17 2160 1 1 8 THR HG21 H -4.153 3.896 -1.963 1.00 . A A . 8 THR HG21 1 1
17 2161 1 1 8 THR HG22 H -4.354 3.359 -0.298 1.00 . A A . 8 THR HG22 1 1
17 2162 1 1 8 THR HG23 H -4.709 2.257 -1.628 1.00 . A A . 8 THR HG23 1 1
17 2163 1 1 8 THR N N -0.795 2.520 0.226 1.00 . A A . 8 THR N 1 1
17 2164 1 1 8 THR O O -1.763 0.160 1.322 1.00 . A A . 8 THR O 1 1
17 2165 1 1 8 THR OG1 O -1.845 3.612 -1.813 1.00 . A A . 8 THR OG1 1 1
17 2166 1 1 9 PHE C C -3.560 -1.975 -1.577 1.00 . A A . 9 PHE C 1 1
17 2167 1 1 9 PHE CA C -3.560 -1.286 -0.227 1.00 . A A . 9 PHE CA 1 1
17 2168 1 1 9 PHE CB C -4.918 -1.441 0.428 1.00 . A A . 9 PHE CB 1 1
17 2169 1 1 9 PHE CD1 C -4.165 -0.931 2.772 1.00 . A A . 9 PHE CD1 1 1
17 2170 1 1 9 PHE CD2 C -5.493 -2.878 2.401 1.00 . A A . 9 PHE CD2 1 1
17 2171 1 1 9 PHE CE1 C -4.109 -1.225 4.122 1.00 . A A . 9 PHE CE1 1 1
17 2172 1 1 9 PHE CE2 C -5.440 -3.175 3.750 1.00 . A A . 9 PHE CE2 1 1
17 2173 1 1 9 PHE CG C -4.857 -1.754 1.897 1.00 . A A . 9 PHE CG 1 1
17 2174 1 1 9 PHE CZ C -4.747 -2.348 4.612 1.00 . A A . 9 PHE CZ 1 1
17 2175 1 1 9 PHE H H -3.668 0.652 -1.032 1.00 . A A . 9 PHE H 1 1
17 2176 1 1 9 PHE HA H -2.811 -1.725 0.376 1.00 . A A . 9 PHE HA 1 1
17 2177 1 1 9 PHE HB2 H -5.454 -0.517 0.296 1.00 . A A . 9 PHE HB2 1 1
17 2178 1 1 9 PHE HB3 H -5.458 -2.236 -0.064 1.00 . A A . 9 PHE HB3 1 1
17 2179 1 1 9 PHE HD1 H -3.667 -0.051 2.393 1.00 . A A . 9 PHE HD1 1 1
17 2180 1 1 9 PHE HD2 H -6.036 -3.526 1.728 1.00 . A A . 9 PHE HD2 1 1
17 2181 1 1 9 PHE HE1 H -3.566 -0.577 4.793 1.00 . A A . 9 PHE HE1 1 1
17 2182 1 1 9 PHE HE2 H -5.940 -4.054 4.129 1.00 . A A . 9 PHE HE2 1 1
17 2183 1 1 9 PHE HZ H -4.704 -2.579 5.665 1.00 . A A . 9 PHE HZ 1 1
17 2184 1 1 9 PHE N N -3.240 0.127 -0.353 1.00 . A A . 9 PHE N 1 1
17 2185 1 1 9 PHE O O -3.921 -3.145 -1.708 1.00 . A A . 9 PHE O 1 1
17 2186 1 1 10 GLY C C -3.812 -0.829 -4.906 1.00 . A A . 10 GLY C 1 1
17 2187 1 1 10 GLY CA C -3.085 -1.727 -3.924 1.00 . A A . 10 GLY CA 1 1
17 2188 1 1 10 GLY H H -2.885 -0.315 -2.356 1.00 . A A . 10 GLY H 1 1
17 2189 1 1 10 GLY HA2 H -2.050 -1.799 -4.221 1.00 . A A . 10 GLY HA2 1 1
17 2190 1 1 10 GLY HA3 H -3.528 -2.711 -3.957 1.00 . A A . 10 GLY HA3 1 1
17 2191 1 1 10 GLY N N -3.148 -1.225 -2.564 1.00 . A A . 10 GLY N 1 1
17 2192 1 1 10 GLY O O -3.179 -0.385 -5.887 1.00 . A A . 10 GLY O 1 1
17 2193 1 1 10 GLY OXT O -5.016 -0.572 -4.696 1.00 . A A . 10 GLY OXT 1 1
18 2194 1 1 1 GLY C C -1.201 -5.218 0.509 1.00 . A A . 1 GLY C 1 1
18 2195 1 1 1 GLY CA C -1.434 -6.716 0.483 1.00 . A A . 1 GLY CA 1 1
18 2196 1 1 1 GLY H1 H -3.356 -6.662 -0.334 1.00 . A A . 1 GLY H1 1 1
18 2197 1 1 1 GLY H2 H -3.332 -6.694 1.357 1.00 . A A . 1 GLY H2 1 1
18 2198 1 1 1 GLY H3 H -2.998 -8.101 0.479 1.00 . A A . 1 GLY H3 1 1
18 2199 1 1 1 GLY HA2 H -0.958 -7.158 1.346 1.00 . A A . 1 GLY HA2 1 1
18 2200 1 1 1 GLY HA3 H -0.985 -7.124 -0.411 1.00 . A A . 1 GLY HA3 1 1
18 2201 1 1 1 GLY N N -2.880 -7.068 0.497 1.00 . A A . 1 GLY N 1 1
18 2202 1 1 1 GLY O O -1.410 -4.533 -0.492 1.00 . A A . 1 GLY O 1 1
18 2203 1 1 2 TYR C C 0.590 -2.825 0.861 1.00 . A A . 2 TYR C 1 1
18 2204 1 1 2 TYR CA C -0.505 -3.285 1.812 1.00 . A A . 2 TYR CA 1 1
18 2205 1 1 2 TYR CB C -0.095 -2.970 3.252 1.00 . A A . 2 TYR CB 1 1
18 2206 1 1 2 TYR CD1 C -0.797 -0.597 3.732 1.00 . A A . 2 TYR CD1 1 1
18 2207 1 1 2 TYR CD2 C 1.528 -1.037 3.444 1.00 . A A . 2 TYR CD2 1 1
18 2208 1 1 2 TYR CE1 C -0.521 0.741 3.940 1.00 . A A . 2 TYR CE1 1 1
18 2209 1 1 2 TYR CE2 C 1.813 0.297 3.651 1.00 . A A . 2 TYR CE2 1 1
18 2210 1 1 2 TYR CG C 0.219 -1.508 3.481 1.00 . A A . 2 TYR CG 1 1
18 2211 1 1 2 TYR CZ C 0.784 1.183 3.900 1.00 . A A . 2 TYR CZ 1 1
18 2212 1 1 2 TYR H H -0.619 -5.304 2.417 1.00 . A A . 2 TYR H 1 1
18 2213 1 1 2 TYR HA H -1.415 -2.752 1.582 1.00 . A A . 2 TYR HA 1 1
18 2214 1 1 2 TYR HB2 H -0.901 -3.246 3.916 1.00 . A A . 2 TYR HB2 1 1
18 2215 1 1 2 TYR HB3 H 0.785 -3.544 3.502 1.00 . A A . 2 TYR HB3 1 1
18 2216 1 1 2 TYR HD1 H -1.818 -0.947 3.762 1.00 . A A . 2 TYR HD1 1 1
18 2217 1 1 2 TYR HD2 H 2.335 -1.729 3.248 1.00 . A A . 2 TYR HD2 1 1
18 2218 1 1 2 TYR HE1 H -1.327 1.434 4.134 1.00 . A A . 2 TYR HE1 1 1
18 2219 1 1 2 TYR HE2 H 2.836 0.643 3.617 1.00 . A A . 2 TYR HE2 1 1
18 2220 1 1 2 TYR HH H 1.868 2.598 4.623 1.00 . A A . 2 TYR HH 1 1
18 2221 1 1 2 TYR N N -0.768 -4.709 1.657 1.00 . A A . 2 TYR N 1 1
18 2222 1 1 2 TYR O O 1.666 -3.418 0.809 1.00 . A A . 2 TYR O 1 1
18 2223 1 1 2 TYR OH O 1.063 2.515 4.105 1.00 . A A . 2 TYR OH 1 1
18 2224 1 1 3 ASP C C 2.136 -0.154 -0.101 1.00 . A A . 3 ASP C 1 1
18 2225 1 1 3 ASP CA C 1.270 -1.193 -0.810 1.00 . A A . 3 ASP CA 1 1
18 2226 1 1 3 ASP CB C 0.547 -0.554 -1.997 1.00 . A A . 3 ASP CB 1 1
18 2227 1 1 3 ASP CG C 1.397 -0.540 -3.253 1.00 . A A . 3 ASP CG 1 1
18 2228 1 1 3 ASP H H -0.558 -1.330 0.226 1.00 . A A . 3 ASP H 1 1
18 2229 1 1 3 ASP HA H 1.890 -1.994 -1.163 1.00 . A A . 3 ASP HA 1 1
18 2230 1 1 3 ASP HB2 H -0.357 -1.110 -2.202 1.00 . A A . 3 ASP HB2 1 1
18 2231 1 1 3 ASP HB3 H 0.288 0.465 -1.747 1.00 . A A . 3 ASP HB3 1 1
18 2232 1 1 3 ASP N N 0.311 -1.756 0.127 1.00 . A A . 3 ASP N 1 1
18 2233 1 1 3 ASP O O 1.675 0.953 0.183 1.00 . A A . 3 ASP O 1 1
18 2234 1 1 3 ASP OD1 O 2.636 -0.647 -3.131 1.00 . A A . 3 ASP OD1 1 1
18 2235 1 1 3 ASP OD2 O 0.824 -0.425 -4.355 1.00 . A A . 3 ASP OD2 1 1
18 2236 1 1 4 PRO C C 4.823 1.538 0.060 1.00 . A A . 4 PRO C 1 1
18 2237 1 1 4 PRO CA C 4.305 0.402 0.934 1.00 . A A . 4 PRO CA 1 1
18 2238 1 1 4 PRO CB C 5.461 -0.509 1.365 1.00 . A A . 4 PRO CB 1 1
18 2239 1 1 4 PRO CD C 4.035 -1.790 -0.031 1.00 . A A . 4 PRO CD 1 1
18 2240 1 1 4 PRO CG C 4.957 -1.887 1.154 1.00 . A A . 4 PRO CG 1 1
18 2241 1 1 4 PRO HA H 3.835 0.806 1.811 1.00 . A A . 4 PRO HA 1 1
18 2242 1 1 4 PRO HB2 H 6.332 -0.307 0.762 1.00 . A A . 4 PRO HB2 1 1
18 2243 1 1 4 PRO HB3 H 5.682 -0.334 2.408 1.00 . A A . 4 PRO HB3 1 1
18 2244 1 1 4 PRO HD2 H 4.584 -1.772 -0.970 1.00 . A A . 4 PRO HD2 1 1
18 2245 1 1 4 PRO HD3 H 3.317 -2.589 -0.021 1.00 . A A . 4 PRO HD3 1 1
18 2246 1 1 4 PRO HG2 H 5.780 -2.565 0.965 1.00 . A A . 4 PRO HG2 1 1
18 2247 1 1 4 PRO HG3 H 4.408 -2.193 2.026 1.00 . A A . 4 PRO HG3 1 1
18 2248 1 1 4 PRO N N 3.394 -0.500 0.225 1.00 . A A . 4 PRO N 1 1
18 2249 1 1 4 PRO O O 5.068 2.644 0.545 1.00 . A A . 4 PRO O 1 1
18 2250 1 1 5 ALA C C 4.550 3.465 -2.204 1.00 . A A . 5 ALA C 1 1
18 2251 1 1 5 ALA CA C 5.482 2.262 -2.165 1.00 . A A . 5 ALA CA 1 1
18 2252 1 1 5 ALA CB C 5.629 1.659 -3.555 1.00 . A A . 5 ALA CB 1 1
18 2253 1 1 5 ALA H H 4.777 0.364 -1.553 1.00 . A A . 5 ALA H 1 1
18 2254 1 1 5 ALA HA H 6.457 2.584 -1.831 1.00 . A A . 5 ALA HA 1 1
18 2255 1 1 5 ALA HB1 H 5.611 2.448 -4.292 1.00 . A A . 5 ALA HB1 1 1
18 2256 1 1 5 ALA HB2 H 4.815 0.975 -3.739 1.00 . A A . 5 ALA HB2 1 1
18 2257 1 1 5 ALA HB3 H 6.567 1.129 -3.619 1.00 . A A . 5 ALA HB3 1 1
18 2258 1 1 5 ALA N N 4.990 1.261 -1.227 1.00 . A A . 5 ALA N 1 1
18 2259 1 1 5 ALA O O 4.969 4.599 -1.973 1.00 . A A . 5 ALA O 1 1
18 2260 1 1 6 THR C C 1.713 4.523 -1.168 1.00 . A A . 6 THR C 1 1
18 2261 1 1 6 THR CA C 2.283 4.245 -2.558 1.00 . A A . 6 THR CA 1 1
18 2262 1 1 6 THR CB C 1.177 3.816 -3.523 1.00 . A A . 6 THR CB 1 1
18 2263 1 1 6 THR CG2 C -0.038 4.703 -3.479 1.00 . A A . 6 THR CG2 1 1
18 2264 1 1 6 THR H H 3.008 2.288 -2.663 1.00 . A A . 6 THR H 1 1
18 2265 1 1 6 THR HA H 2.756 5.134 -2.933 1.00 . A A . 6 THR HA 1 1
18 2266 1 1 6 THR HB H 0.863 2.813 -3.270 1.00 . A A . 6 THR HB 1 1
18 2267 1 1 6 THR HG1 H 1.056 3.295 -5.407 1.00 . A A . 6 THR HG1 1 1
18 2268 1 1 6 THR HG21 H -0.880 4.176 -3.898 1.00 . A A . 6 THR HG21 1 1
18 2269 1 1 6 THR HG22 H 0.151 5.598 -4.049 1.00 . A A . 6 THR HG22 1 1
18 2270 1 1 6 THR HG23 H -0.249 4.963 -2.455 1.00 . A A . 6 THR HG23 1 1
18 2271 1 1 6 THR N N 3.283 3.206 -2.493 1.00 . A A . 6 THR N 1 1
18 2272 1 1 6 THR O O 1.299 5.642 -0.867 1.00 . A A . 6 THR O 1 1
18 2273 1 1 6 THR OG1 O 1.652 3.808 -4.858 1.00 . A A . 6 THR OG1 1 1
18 2274 1 1 7 GLY C C -0.303 3.459 1.105 1.00 . A A . 7 GLY C 1 1
18 2275 1 1 7 GLY CA C 1.197 3.631 1.020 1.00 . A A . 7 GLY CA 1 1
18 2276 1 1 7 GLY H H 2.052 2.632 -0.621 1.00 . A A . 7 GLY H 1 1
18 2277 1 1 7 GLY HA2 H 1.658 2.879 1.636 1.00 . A A . 7 GLY HA2 1 1
18 2278 1 1 7 GLY HA3 H 1.462 4.604 1.393 1.00 . A A . 7 GLY HA3 1 1
18 2279 1 1 7 GLY N N 1.705 3.494 -0.326 1.00 . A A . 7 GLY N 1 1
18 2280 1 1 7 GLY O O -0.965 4.073 1.942 1.00 . A A . 7 GLY O 1 1
18 2281 1 1 8 THR C C -2.452 0.864 0.492 1.00 . A A . 8 THR C 1 1
18 2282 1 1 8 THR CA C -2.224 2.334 0.181 1.00 . A A . 8 THR CA 1 1
18 2283 1 1 8 THR CB C -2.731 2.704 -1.211 1.00 . A A . 8 THR CB 1 1
18 2284 1 1 8 THR CG2 C -4.152 3.175 -1.202 1.00 . A A . 8 THR CG2 1 1
18 2285 1 1 8 THR H H -0.276 2.163 -0.398 1.00 . A A . 8 THR H 1 1
18 2286 1 1 8 THR HA H -2.730 2.924 0.908 1.00 . A A . 8 THR HA 1 1
18 2287 1 1 8 THR HB H -2.665 1.839 -1.855 1.00 . A A . 8 THR HB 1 1
18 2288 1 1 8 THR HG1 H -2.010 4.524 -1.225 1.00 . A A . 8 THR HG1 1 1
18 2289 1 1 8 THR HG21 H -4.616 2.875 -0.278 1.00 . A A . 8 THR HG21 1 1
18 2290 1 1 8 THR HG22 H -4.680 2.734 -2.032 1.00 . A A . 8 THR HG22 1 1
18 2291 1 1 8 THR HG23 H -4.168 4.249 -1.287 1.00 . A A . 8 THR HG23 1 1
18 2292 1 1 8 THR N N -0.835 2.616 0.235 1.00 . A A . 8 THR N 1 1
18 2293 1 1 8 THR O O -1.844 0.301 1.402 1.00 . A A . 8 THR O 1 1
18 2294 1 1 8 THR OG1 O -1.943 3.738 -1.772 1.00 . A A . 8 THR OG1 1 1
18 2295 1 1 9 PHE C C -3.856 -1.816 -1.456 1.00 . A A . 9 PHE C 1 1
18 2296 1 1 9 PHE CA C -3.664 -1.137 -0.113 1.00 . A A . 9 PHE CA 1 1
18 2297 1 1 9 PHE CB C -4.932 -1.243 0.699 1.00 . A A . 9 PHE CB 1 1
18 2298 1 1 9 PHE CD1 C -4.526 -0.243 2.966 1.00 . A A . 9 PHE CD1 1 1
18 2299 1 1 9 PHE CD2 C -4.641 -2.618 2.778 1.00 . A A . 9 PHE CD2 1 1
18 2300 1 1 9 PHE CE1 C -4.306 -0.358 4.326 1.00 . A A . 9 PHE CE1 1 1
18 2301 1 1 9 PHE CE2 C -4.422 -2.740 4.137 1.00 . A A . 9 PHE CE2 1 1
18 2302 1 1 9 PHE CG C -4.696 -1.371 2.179 1.00 . A A . 9 PHE CG 1 1
18 2303 1 1 9 PHE CZ C -4.254 -1.609 4.912 1.00 . A A . 9 PHE CZ 1 1
18 2304 1 1 9 PHE H H -3.753 0.779 -0.950 1.00 . A A . 9 PHE H 1 1
18 2305 1 1 9 PHE HA H -2.862 -1.607 0.395 1.00 . A A . 9 PHE HA 1 1
18 2306 1 1 9 PHE HB2 H -5.511 -0.354 0.520 1.00 . A A . 9 PHE HB2 1 1
18 2307 1 1 9 PHE HB3 H -5.489 -2.101 0.367 1.00 . A A . 9 PHE HB3 1 1
18 2308 1 1 9 PHE HD1 H -4.566 0.734 2.509 1.00 . A A . 9 PHE HD1 1 1
18 2309 1 1 9 PHE HD2 H -4.772 -3.504 2.173 1.00 . A A . 9 PHE HD2 1 1
18 2310 1 1 9 PHE HE1 H -4.175 0.527 4.929 1.00 . A A . 9 PHE HE1 1 1
18 2311 1 1 9 PHE HE2 H -4.380 -3.718 4.592 1.00 . A A . 9 PHE HE2 1 1
18 2312 1 1 9 PHE HZ H -4.082 -1.702 5.974 1.00 . A A . 9 PHE HZ 1 1
18 2313 1 1 9 PHE N N -3.323 0.263 -0.269 1.00 . A A . 9 PHE N 1 1
18 2314 1 1 9 PHE O O -4.324 -2.951 -1.545 1.00 . A A . 9 PHE O 1 1
18 2315 1 1 10 GLY C C -2.406 -2.428 -4.259 1.00 . A A . 10 GLY C 1 1
18 2316 1 1 10 GLY CA C -3.603 -1.597 -3.840 1.00 . A A . 10 GLY CA 1 1
18 2317 1 1 10 GLY H H -3.129 -0.212 -2.309 1.00 . A A . 10 GLY H 1 1
18 2318 1 1 10 GLY HA2 H -4.493 -2.205 -3.913 1.00 . A A . 10 GLY HA2 1 1
18 2319 1 1 10 GLY HA3 H -3.697 -0.758 -4.514 1.00 . A A . 10 GLY HA3 1 1
18 2320 1 1 10 GLY N N -3.486 -1.098 -2.482 1.00 . A A . 10 GLY N 1 1
18 2321 1 1 10 GLY O O -1.324 -1.842 -4.476 1.00 . A A . 10 GLY O 1 1
18 2322 1 1 10 GLY OXT O -2.550 -3.664 -4.367 1.00 . A A . 10 GLY OXT 1 1
19 2323 1 1 1 GLY C C -1.223 -5.230 0.277 1.00 . A A . 1 GLY C 1 1
19 2324 1 1 1 GLY CA C -1.475 -6.722 0.187 1.00 . A A . 1 GLY CA 1 1
19 2325 1 1 1 GLY H1 H 0.469 -7.462 -0.012 1.00 . A A . 1 GLY H1 1 1
19 2326 1 1 1 GLY H2 H -0.592 -8.523 0.770 1.00 . A A . 1 GLY H2 1 1
19 2327 1 1 1 GLY H3 H 0.006 -7.171 1.589 1.00 . A A . 1 GLY H3 1 1
19 2328 1 1 1 GLY HA2 H -1.674 -6.981 -0.844 1.00 . A A . 1 GLY HA2 1 1
19 2329 1 1 1 GLY HA3 H -2.341 -6.969 0.782 1.00 . A A . 1 GLY HA3 1 1
19 2330 1 1 1 GLY N N -0.317 -7.525 0.667 1.00 . A A . 1 GLY N 1 1
19 2331 1 1 1 GLY O O -1.398 -4.505 -0.701 1.00 . A A . 1 GLY O 1 1
19 2332 1 1 2 TYR C C 0.571 -2.874 0.748 1.00 . A A . 2 TYR C 1 1
19 2333 1 1 2 TYR CA C -0.537 -3.358 1.672 1.00 . A A . 2 TYR CA 1 1
19 2334 1 1 2 TYR CB C -0.138 -3.103 3.127 1.00 . A A . 2 TYR CB 1 1
19 2335 1 1 2 TYR CD1 C -0.900 -0.776 3.727 1.00 . A A . 2 TYR CD1 1 1
19 2336 1 1 2 TYR CD2 C 1.436 -1.145 3.428 1.00 . A A . 2 TYR CD2 1 1
19 2337 1 1 2 TYR CE1 C -0.657 0.555 4.008 1.00 . A A . 2 TYR CE1 1 1
19 2338 1 1 2 TYR CE2 C 1.687 0.183 3.709 1.00 . A A . 2 TYR CE2 1 1
19 2339 1 1 2 TYR CG C 0.138 -1.647 3.433 1.00 . A A . 2 TYR CG 1 1
19 2340 1 1 2 TYR CZ C 0.638 1.030 3.999 1.00 . A A . 2 TYR CZ 1 1
19 2341 1 1 2 TYR H H -0.691 -5.398 2.197 1.00 . A A . 2 TYR H 1 1
19 2342 1 1 2 TYR HA H -1.439 -2.806 1.453 1.00 . A A . 2 TYR HA 1 1
19 2343 1 1 2 TYR HB2 H -0.939 -3.432 3.775 1.00 . A A . 2 TYR HB2 1 1
19 2344 1 1 2 TYR HB3 H 0.755 -3.667 3.352 1.00 . A A . 2 TYR HB3 1 1
19 2345 1 1 2 TYR HD1 H -1.913 -1.151 3.731 1.00 . A A . 2 TYR HD1 1 1
19 2346 1 1 2 TYR HD2 H 2.257 -1.805 3.201 1.00 . A A . 2 TYR HD2 1 1
19 2347 1 1 2 TYR HE1 H -1.481 1.218 4.236 1.00 . A A . 2 TYR HE1 1 1
19 2348 1 1 2 TYR HE2 H 2.702 0.552 3.698 1.00 . A A . 2 TYR HE2 1 1
19 2349 1 1 2 TYR HH H 0.774 2.875 3.481 1.00 . A A . 2 TYR HH 1 1
19 2350 1 1 2 TYR N N -0.813 -4.771 1.456 1.00 . A A . 2 TYR N 1 1
19 2351 1 1 2 TYR O O 1.639 -3.480 0.676 1.00 . A A . 2 TYR O 1 1
19 2352 1 1 2 TYR OH O 0.884 2.353 4.280 1.00 . A A . 2 TYR OH 1 1
19 2353 1 1 3 ASP C C 2.124 -0.149 -0.116 1.00 . A A . 3 ASP C 1 1
19 2354 1 1 3 ASP CA C 1.282 -1.188 -0.854 1.00 . A A . 3 ASP CA 1 1
19 2355 1 1 3 ASP CB C 0.574 -0.544 -2.046 1.00 . A A . 3 ASP CB 1 1
19 2356 1 1 3 ASP CG C 1.440 -0.522 -3.291 1.00 . A A . 3 ASP CG 1 1
19 2357 1 1 3 ASP H H -0.552 -1.340 0.168 1.00 . A A . 3 ASP H 1 1
19 2358 1 1 3 ASP HA H 1.918 -1.978 -1.204 1.00 . A A . 3 ASP HA 1 1
19 2359 1 1 3 ASP HB2 H -0.326 -1.101 -2.266 1.00 . A A . 3 ASP HB2 1 1
19 2360 1 1 3 ASP HB3 H 0.311 0.471 -1.795 1.00 . A A . 3 ASP HB3 1 1
19 2361 1 1 3 ASP N N 0.311 -1.773 0.056 1.00 . A A . 3 ASP N 1 1
19 2362 1 1 3 ASP O O 1.647 0.950 0.171 1.00 . A A . 3 ASP O 1 1
19 2363 1 1 3 ASP OD1 O 2.404 0.270 -3.330 1.00 . A A . 3 ASP OD1 1 1
19 2364 1 1 3 ASP OD2 O 1.153 -1.298 -4.226 1.00 . A A . 3 ASP OD2 1 1
19 2365 1 1 4 PRO C C 4.808 1.555 0.104 1.00 . A A . 4 PRO C 1 1
19 2366 1 1 4 PRO CA C 4.269 0.418 0.963 1.00 . A A . 4 PRO CA 1 1
19 2367 1 1 4 PRO CB C 5.417 -0.491 1.422 1.00 . A A . 4 PRO CB 1 1
19 2368 1 1 4 PRO CD C 4.040 -1.763 -0.032 1.00 . A A . 4 PRO CD 1 1
19 2369 1 1 4 PRO CG C 4.931 -1.868 1.176 1.00 . A A . 4 PRO CG 1 1
19 2370 1 1 4 PRO HA H 3.776 0.819 1.827 1.00 . A A . 4 PRO HA 1 1
19 2371 1 1 4 PRO HB2 H 6.305 -0.275 0.852 1.00 . A A . 4 PRO HB2 1 1
19 2372 1 1 4 PRO HB3 H 5.600 -0.327 2.474 1.00 . A A . 4 PRO HB3 1 1
19 2373 1 1 4 PRO HD2 H 4.615 -1.724 -0.954 1.00 . A A . 4 PRO HD2 1 1
19 2374 1 1 4 PRO HD3 H 3.331 -2.569 -0.053 1.00 . A A . 4 PRO HD3 1 1
19 2375 1 1 4 PRO HG2 H 5.766 -2.537 1.001 1.00 . A A . 4 PRO HG2 1 1
19 2376 1 1 4 PRO HG3 H 4.361 -2.192 2.030 1.00 . A A . 4 PRO HG3 1 1
19 2377 1 1 4 PRO N N 3.380 -0.484 0.228 1.00 . A A . 4 PRO N 1 1
19 2378 1 1 4 PRO O O 5.038 2.661 0.592 1.00 . A A . 4 PRO O 1 1
19 2379 1 1 5 ALA C C 4.596 3.475 -2.175 1.00 . A A . 5 ALA C 1 1
19 2380 1 1 5 ALA CA C 5.527 2.273 -2.105 1.00 . A A . 5 ALA CA 1 1
19 2381 1 1 5 ALA CB C 5.717 1.665 -3.486 1.00 . A A . 5 ALA CB 1 1
19 2382 1 1 5 ALA H H 4.809 0.376 -1.507 1.00 . A A . 5 ALA H 1 1
19 2383 1 1 5 ALA HA H 6.492 2.597 -1.744 1.00 . A A . 5 ALA HA 1 1
19 2384 1 1 5 ALA HB1 H 6.528 2.167 -3.993 1.00 . A A . 5 ALA HB1 1 1
19 2385 1 1 5 ALA HB2 H 4.808 1.781 -4.059 1.00 . A A . 5 ALA HB2 1 1
19 2386 1 1 5 ALA HB3 H 5.947 0.614 -3.388 1.00 . A A . 5 ALA HB3 1 1
19 2387 1 1 5 ALA N N 5.011 1.275 -1.177 1.00 . A A . 5 ALA N 1 1
19 2388 1 1 5 ALA O O 5.012 4.610 -1.949 1.00 . A A . 5 ALA O 1 1
19 2389 1 1 6 THR C C 1.731 4.544 -1.213 1.00 . A A . 6 THR C 1 1
19 2390 1 1 6 THR CA C 2.340 4.255 -2.585 1.00 . A A . 6 THR CA 1 1
19 2391 1 1 6 THR CB C 1.260 3.828 -3.577 1.00 . A A . 6 THR CB 1 1
19 2392 1 1 6 THR CG2 C 0.043 4.713 -3.557 1.00 . A A . 6 THR CG2 1 1
19 2393 1 1 6 THR H H 3.061 2.295 -2.653 1.00 . A A . 6 THR H 1 1
19 2394 1 1 6 THR HA H 2.825 5.141 -2.951 1.00 . A A . 6 THR HA 1 1
19 2395 1 1 6 THR HB H 0.942 2.823 -3.336 1.00 . A A . 6 THR HB 1 1
19 2396 1 1 6 THR HG1 H 1.944 4.728 -5.176 1.00 . A A . 6 THR HG1 1 1
19 2397 1 1 6 THR HG21 H -0.260 4.875 -2.536 1.00 . A A . 6 THR HG21 1 1
19 2398 1 1 6 THR HG22 H -0.757 4.233 -4.099 1.00 . A A . 6 THR HG22 1 1
19 2399 1 1 6 THR HG23 H 0.280 5.657 -4.020 1.00 . A A . 6 THR HG23 1 1
19 2400 1 1 6 THR N N 3.334 3.212 -2.486 1.00 . A A . 6 THR N 1 1
19 2401 1 1 6 THR O O 1.302 5.663 -0.935 1.00 . A A . 6 THR O 1 1
19 2402 1 1 6 THR OG1 O 1.767 3.825 -4.900 1.00 . A A . 6 THR OG1 1 1
19 2403 1 1 7 GLY C C -0.336 3.497 1.024 1.00 . A A . 7 GLY C 1 1
19 2404 1 1 7 GLY CA C 1.165 3.675 0.972 1.00 . A A . 7 GLY CA 1 1
19 2405 1 1 7 GLY H H 2.071 2.662 -0.636 1.00 . A A . 7 GLY H 1 1
19 2406 1 1 7 GLY HA2 H 1.616 2.932 1.609 1.00 . A A . 7 GLY HA2 1 1
19 2407 1 1 7 GLY HA3 H 1.419 4.653 1.339 1.00 . A A . 7 GLY HA3 1 1
19 2408 1 1 7 GLY N N 1.708 3.524 -0.360 1.00 . A A . 7 GLY N 1 1
19 2409 1 1 7 GLY O O -1.019 4.136 1.825 1.00 . A A . 7 GLY O 1 1
19 2410 1 1 8 THR C C -2.470 0.902 0.557 1.00 . A A . 8 THR C 1 1
19 2411 1 1 8 THR CA C -2.233 2.332 0.101 1.00 . A A . 8 THR CA 1 1
19 2412 1 1 8 THR CB C -2.692 2.551 -1.338 1.00 . A A . 8 THR CB 1 1
19 2413 1 1 8 THR CG2 C -4.109 3.036 -1.426 1.00 . A A . 8 THR CG2 1 1
19 2414 1 1 8 THR H H -0.272 2.146 -0.429 1.00 . A A . 8 THR H 1 1
19 2415 1 1 8 THR HA H -2.762 2.993 0.745 1.00 . A A . 8 THR HA 1 1
19 2416 1 1 8 THR HB H -2.622 1.621 -1.881 1.00 . A A . 8 THR HB 1 1
19 2417 1 1 8 THR HG1 H -2.202 3.661 -2.876 1.00 . A A . 8 THR HG1 1 1
19 2418 1 1 8 THR HG21 H -4.107 4.089 -1.661 1.00 . A A . 8 THR HG21 1 1
19 2419 1 1 8 THR HG22 H -4.593 2.878 -0.477 1.00 . A A . 8 THR HG22 1 1
19 2420 1 1 8 THR HG23 H -4.627 2.491 -2.196 1.00 . A A . 8 THR HG23 1 1
19 2421 1 1 8 THR N N -0.845 2.620 0.173 1.00 . A A . 8 THR N 1 1
19 2422 1 1 8 THR O O -1.886 0.440 1.536 1.00 . A A . 8 THR O 1 1
19 2423 1 1 8 THR OG1 O -1.873 3.506 -1.989 1.00 . A A . 8 THR OG1 1 1
19 2424 1 1 9 PHE C C -3.804 -1.975 -1.127 1.00 . A A . 9 PHE C 1 1
19 2425 1 1 9 PHE CA C -3.671 -1.148 0.138 1.00 . A A . 9 PHE CA 1 1
19 2426 1 1 9 PHE CB C -4.970 -1.167 0.901 1.00 . A A . 9 PHE CB 1 1
19 2427 1 1 9 PHE CD1 C -4.516 -2.111 3.178 1.00 . A A . 9 PHE CD1 1 1
19 2428 1 1 9 PHE CD2 C -4.916 0.232 2.982 1.00 . A A . 9 PHE CD2 1 1
19 2429 1 1 9 PHE CE1 C -4.351 -1.972 4.544 1.00 . A A . 9 PHE CE1 1 1
19 2430 1 1 9 PHE CE2 C -4.753 0.377 4.346 1.00 . A A . 9 PHE CE2 1 1
19 2431 1 1 9 PHE CG C -4.799 -1.013 2.384 1.00 . A A . 9 PHE CG 1 1
19 2432 1 1 9 PHE CZ C -4.469 -0.726 5.129 1.00 . A A . 9 PHE CZ 1 1
19 2433 1 1 9 PHE H H -3.736 0.666 -0.896 1.00 . A A . 9 PHE H 1 1
19 2434 1 1 9 PHE HA H -2.892 -1.555 0.732 1.00 . A A . 9 PHE HA 1 1
19 2435 1 1 9 PHE HB2 H -5.574 -0.351 0.540 1.00 . A A . 9 PHE HB2 1 1
19 2436 1 1 9 PHE HB3 H -5.475 -2.093 0.707 1.00 . A A . 9 PHE HB3 1 1
19 2437 1 1 9 PHE HD1 H -4.421 -3.085 2.723 1.00 . A A . 9 PHE HD1 1 1
19 2438 1 1 9 PHE HD2 H -5.137 1.093 2.370 1.00 . A A . 9 PHE HD2 1 1
19 2439 1 1 9 PHE HE1 H -4.130 -2.837 5.152 1.00 . A A . 9 PHE HE1 1 1
19 2440 1 1 9 PHE HE2 H -4.846 1.352 4.801 1.00 . A A . 9 PHE HE2 1 1
19 2441 1 1 9 PHE HZ H -4.343 -0.615 6.195 1.00 . A A . 9 PHE HZ 1 1
19 2442 1 1 9 PHE N N -3.324 0.226 -0.155 1.00 . A A . 9 PHE N 1 1
19 2443 1 1 9 PHE O O -4.285 -3.107 -1.111 1.00 . A A . 9 PHE O 1 1
19 2444 1 1 10 GLY C C -2.055 -2.408 -4.025 1.00 . A A . 10 GLY C 1 1
19 2445 1 1 10 GLY CA C -3.429 -2.036 -3.504 1.00 . A A . 10 GLY CA 1 1
19 2446 1 1 10 GLY H H -3.011 -0.487 -2.120 1.00 . A A . 10 GLY H 1 1
19 2447 1 1 10 GLY HA2 H -4.024 -2.933 -3.418 1.00 . A A . 10 GLY HA2 1 1
19 2448 1 1 10 GLY HA3 H -3.901 -1.368 -4.209 1.00 . A A . 10 GLY HA3 1 1
19 2449 1 1 10 GLY N N -3.373 -1.383 -2.208 1.00 . A A . 10 GLY N 1 1
19 2450 1 1 10 GLY O O -1.703 -3.604 -3.972 1.00 . A A . 10 GLY O 1 1
19 2451 1 1 10 GLY OXT O -1.330 -1.501 -4.488 1.00 . A A . 10 GLY OXT 1 1
20 2452 1 1 1 GLY C C -1.125 -5.318 0.406 1.00 . A A . 1 GLY C 1 1
20 2453 1 1 1 GLY CA C -1.333 -6.820 0.359 1.00 . A A . 1 GLY CA 1 1
20 2454 1 1 1 GLY H1 H -3.377 -6.502 0.644 1.00 . A A . 1 GLY H1 1 1
20 2455 1 1 1 GLY H2 H -2.631 -7.343 1.909 1.00 . A A . 1 GLY H2 1 1
20 2456 1 1 1 GLY H3 H -2.957 -8.130 0.448 1.00 . A A . 1 GLY H3 1 1
20 2457 1 1 1 GLY HA2 H -0.568 -7.297 0.954 1.00 . A A . 1 GLY HA2 1 1
20 2458 1 1 1 GLY HA3 H -1.237 -7.154 -0.664 1.00 . A A . 1 GLY HA3 1 1
20 2459 1 1 1 GLY N N -2.668 -7.228 0.876 1.00 . A A . 1 GLY N 1 1
20 2460 1 1 1 GLY O O -1.342 -4.623 -0.587 1.00 . A A . 1 GLY O 1 1
20 2461 1 1 2 TYR C C 0.639 -2.908 0.807 1.00 . A A . 2 TYR C 1 1
20 2462 1 1 2 TYR CA C -0.465 -3.393 1.736 1.00 . A A . 2 TYR CA 1 1
20 2463 1 1 2 TYR CB C -0.083 -3.084 3.186 1.00 . A A . 2 TYR CB 1 1
20 2464 1 1 2 TYR CD1 C -0.851 -0.734 3.687 1.00 . A A . 2 TYR CD1 1 1
20 2465 1 1 2 TYR CD2 C 1.489 -1.113 3.427 1.00 . A A . 2 TYR CD2 1 1
20 2466 1 1 2 TYR CE1 C -0.613 0.607 3.917 1.00 . A A . 2 TYR CE1 1 1
20 2467 1 1 2 TYR CE2 C 1.735 0.226 3.655 1.00 . A A . 2 TYR CE2 1 1
20 2468 1 1 2 TYR CG C 0.191 -1.617 3.439 1.00 . A A . 2 TYR CG 1 1
20 2469 1 1 2 TYR CZ C 0.682 1.082 3.900 1.00 . A A . 2 TYR CZ 1 1
20 2470 1 1 2 TYR H H -0.548 -5.420 2.316 1.00 . A A . 2 TYR H 1 1
20 2471 1 1 2 TYR HA H -1.379 -2.871 1.496 1.00 . A A . 2 TYR HA 1 1
20 2472 1 1 2 TYR HB2 H -0.891 -3.387 3.836 1.00 . A A . 2 TYR HB2 1 1
20 2473 1 1 2 TYR HB3 H 0.807 -3.639 3.442 1.00 . A A . 2 TYR HB3 1 1
20 2474 1 1 2 TYR HD1 H -1.863 -1.110 3.697 1.00 . A A . 2 TYR HD1 1 1
20 2475 1 1 2 TYR HD2 H 2.314 -1.781 3.236 1.00 . A A . 2 TYR HD2 1 1
20 2476 1 1 2 TYR HE1 H -1.438 1.276 4.108 1.00 . A A . 2 TYR HE1 1 1
20 2477 1 1 2 TYR HE2 H 2.750 0.597 3.641 1.00 . A A . 2 TYR HE2 1 1
20 2478 1 1 2 TYR HH H 0.913 2.588 5.074 1.00 . A A . 2 TYR HH 1 1
20 2479 1 1 2 TYR N N -0.702 -4.817 1.562 1.00 . A A . 2 TYR N 1 1
20 2480 1 1 2 TYR O O 1.721 -3.487 0.763 1.00 . A A . 2 TYR O 1 1
20 2481 1 1 2 TYR OH O 0.924 2.417 4.129 1.00 . A A . 2 TYR OH 1 1
20 2482 1 1 3 ASP C C 2.151 -0.192 -0.109 1.00 . A A . 3 ASP C 1 1
20 2483 1 1 3 ASP CA C 1.320 -1.247 -0.835 1.00 . A A . 3 ASP CA 1 1
20 2484 1 1 3 ASP CB C 0.603 -0.619 -2.030 1.00 . A A . 3 ASP CB 1 1
20 2485 1 1 3 ASP CG C 1.466 -0.596 -3.277 1.00 . A A . 3 ASP CG 1 1
20 2486 1 1 3 ASP H H -0.519 -1.419 0.174 1.00 . A A . 3 ASP H 1 1
20 2487 1 1 3 ASP HA H 1.963 -2.035 -1.181 1.00 . A A . 3 ASP HA 1 1
20 2488 1 1 3 ASP HB2 H -0.291 -1.185 -2.246 1.00 . A A . 3 ASP HB2 1 1
20 2489 1 1 3 ASP HB3 H 0.329 0.398 -1.785 1.00 . A A . 3 ASP HB3 1 1
20 2490 1 1 3 ASP N N 0.356 -1.833 0.082 1.00 . A A . 3 ASP N 1 1
20 2491 1 1 3 ASP O O 1.665 0.903 0.168 1.00 . A A . 3 ASP O 1 1
20 2492 1 1 3 ASP OD1 O 2.320 0.310 -3.391 1.00 . A A . 3 ASP OD1 1 1
20 2493 1 1 3 ASP OD2 O 1.288 -1.481 -4.139 1.00 . A A . 3 ASP OD2 1 1
20 2494 1 1 4 PRO C C 4.800 1.553 0.101 1.00 . A A . 4 PRO C 1 1
20 2495 1 1 4 PRO CA C 4.288 0.408 0.968 1.00 . A A . 4 PRO CA 1 1
20 2496 1 1 4 PRO CB C 5.453 -0.479 1.425 1.00 . A A . 4 PRO CB 1 1
20 2497 1 1 4 PRO CD C 4.085 -1.788 -0.003 1.00 . A A . 4 PRO CD 1 1
20 2498 1 1 4 PRO CG C 4.985 -1.866 1.201 1.00 . A A . 4 PRO CG 1 1
20 2499 1 1 4 PRO HA H 3.791 0.804 1.834 1.00 . A A . 4 PRO HA 1 1
20 2500 1 1 4 PRO HB2 H 6.333 -0.257 0.842 1.00 . A A . 4 PRO HB2 1 1
20 2501 1 1 4 PRO HB3 H 5.647 -0.301 2.472 1.00 . A A . 4 PRO HB3 1 1
20 2502 1 1 4 PRO HD2 H 4.654 -1.756 -0.930 1.00 . A A . 4 PRO HD2 1 1
20 2503 1 1 4 PRO HD3 H 3.387 -2.603 -0.010 1.00 . A A . 4 PRO HD3 1 1
20 2504 1 1 4 PRO HG2 H 5.827 -2.526 1.030 1.00 . A A . 4 PRO HG2 1 1
20 2505 1 1 4 PRO HG3 H 4.424 -2.186 2.062 1.00 . A A . 4 PRO HG3 1 1
20 2506 1 1 4 PRO N N 3.411 -0.513 0.240 1.00 . A A . 4 PRO N 1 1
20 2507 1 1 4 PRO O O 5.005 2.667 0.584 1.00 . A A . 4 PRO O 1 1
20 2508 1 1 5 ALA C C 4.535 3.455 -2.195 1.00 . A A . 5 ALA C 1 1
20 2509 1 1 5 ALA CA C 5.497 2.278 -2.113 1.00 . A A . 5 ALA CA 1 1
20 2510 1 1 5 ALA CB C 5.704 1.663 -3.490 1.00 . A A . 5 ALA CB 1 1
20 2511 1 1 5 ALA H H 4.823 0.366 -1.504 1.00 . A A . 5 ALA H 1 1
20 2512 1 1 5 ALA HA H 6.453 2.629 -1.753 1.00 . A A . 5 ALA HA 1 1
20 2513 1 1 5 ALA HB1 H 4.812 1.131 -3.784 1.00 . A A . 5 ALA HB1 1 1
20 2514 1 1 5 ALA HB2 H 6.538 0.978 -3.455 1.00 . A A . 5 ALA HB2 1 1
20 2515 1 1 5 ALA HB3 H 5.909 2.446 -4.205 1.00 . A A . 5 ALA HB3 1 1
20 2516 1 1 5 ALA N N 5.006 1.271 -1.179 1.00 . A A . 5 ALA N 1 1
20 2517 1 1 5 ALA O O 4.922 4.604 -1.988 1.00 . A A . 5 ALA O 1 1
20 2518 1 1 6 THR C C 1.687 4.507 -1.228 1.00 . A A . 6 THR C 1 1
20 2519 1 1 6 THR CA C 2.256 4.171 -2.607 1.00 . A A . 6 THR CA 1 1
20 2520 1 1 6 THR CB C 1.157 3.673 -3.544 1.00 . A A . 6 THR CB 1 1
20 2521 1 1 6 THR CG2 C -0.076 4.537 -3.544 1.00 . A A . 6 THR CG2 1 1
20 2522 1 1 6 THR H H 3.028 2.230 -2.650 1.00 . A A . 6 THR H 1 1
20 2523 1 1 6 THR HA H 2.709 5.052 -3.028 1.00 . A A . 6 THR HA 1 1
20 2524 1 1 6 THR HB H 0.863 2.679 -3.237 1.00 . A A . 6 THR HB 1 1
20 2525 1 1 6 THR HG1 H 1.790 4.492 -5.206 1.00 . A A . 6 THR HG1 1 1
20 2526 1 1 6 THR HG21 H 0.066 5.362 -4.222 1.00 . A A . 6 THR HG21 1 1
20 2527 1 1 6 THR HG22 H -0.246 4.911 -2.548 1.00 . A A . 6 THR HG22 1 1
20 2528 1 1 6 THR HG23 H -0.923 3.949 -3.858 1.00 . A A . 6 THR HG23 1 1
20 2529 1 1 6 THR N N 3.277 3.158 -2.497 1.00 . A A . 6 THR N 1 1
20 2530 1 1 6 THR O O 1.265 5.635 -0.976 1.00 . A A . 6 THR O 1 1
20 2531 1 1 6 THR OG1 O 1.630 3.605 -4.877 1.00 . A A . 6 THR OG1 1 1
20 2532 1 1 7 GLY C C -0.319 3.551 1.090 1.00 . A A . 7 GLY C 1 1
20 2533 1 1 7 GLY CA C 1.180 3.712 0.998 1.00 . A A . 7 GLY CA 1 1
20 2534 1 1 7 GLY H H 2.041 2.646 -0.599 1.00 . A A . 7 GLY H 1 1
20 2535 1 1 7 GLY HA2 H 1.638 2.982 1.644 1.00 . A A . 7 GLY HA2 1 1
20 2536 1 1 7 GLY HA3 H 1.452 4.696 1.332 1.00 . A A . 7 GLY HA3 1 1
20 2537 1 1 7 GLY N N 1.688 3.517 -0.342 1.00 . A A . 7 GLY N 1 1
20 2538 1 1 7 GLY O O -0.977 4.198 1.905 1.00 . A A . 7 GLY O 1 1
20 2539 1 1 8 THR C C -2.474 0.934 0.531 1.00 . A A . 8 THR C 1 1
20 2540 1 1 8 THR CA C -2.246 2.402 0.208 1.00 . A A . 8 THR CA 1 1
20 2541 1 1 8 THR CB C -2.757 2.764 -1.183 1.00 . A A . 8 THR CB 1 1
20 2542 1 1 8 THR CG2 C -4.185 3.215 -1.175 1.00 . A A . 8 THR CG2 1 1
20 2543 1 1 8 THR H H -0.299 2.202 -0.362 1.00 . A A . 8 THR H 1 1
20 2544 1 1 8 THR HA H -2.747 2.998 0.934 1.00 . A A . 8 THR HA 1 1
20 2545 1 1 8 THR HB H -2.681 1.900 -1.826 1.00 . A A . 8 THR HB 1 1
20 2546 1 1 8 THR HG1 H -2.072 4.598 -1.210 1.00 . A A . 8 THR HG1 1 1
20 2547 1 1 8 THR HG21 H -4.642 2.916 -0.246 1.00 . A A . 8 THR HG21 1 1
20 2548 1 1 8 THR HG22 H -4.708 2.762 -2.000 1.00 . A A . 8 THR HG22 1 1
20 2549 1 1 8 THR HG23 H -4.216 4.289 -1.266 1.00 . A A . 8 THR HG23 1 1
20 2550 1 1 8 THR N N -0.855 2.679 0.253 1.00 . A A . 8 THR N 1 1
20 2551 1 1 8 THR O O -1.862 0.378 1.441 1.00 . A A . 8 THR O 1 1
20 2552 1 1 8 THR OG1 O -1.984 3.807 -1.747 1.00 . A A . 8 THR OG1 1 1
20 2553 1 1 9 PHE C C -3.843 -1.771 -1.391 1.00 . A A . 9 PHE C 1 1
20 2554 1 1 9 PHE CA C -3.687 -1.072 -0.053 1.00 . A A . 9 PHE CA 1 1
20 2555 1 1 9 PHE CB C -4.972 -1.176 0.731 1.00 . A A . 9 PHE CB 1 1
20 2556 1 1 9 PHE CD1 C -4.711 -0.099 2.982 1.00 . A A . 9 PHE CD1 1 1
20 2557 1 1 9 PHE CD2 C -4.629 -2.478 2.848 1.00 . A A . 9 PHE CD2 1 1
20 2558 1 1 9 PHE CE1 C -4.520 -0.166 4.349 1.00 . A A . 9 PHE CE1 1 1
20 2559 1 1 9 PHE CE2 C -4.437 -2.552 4.213 1.00 . A A . 9 PHE CE2 1 1
20 2560 1 1 9 PHE CG C -4.768 -1.252 2.216 1.00 . A A . 9 PHE CG 1 1
20 2561 1 1 9 PHE CZ C -4.383 -1.395 4.966 1.00 . A A . 9 PHE CZ 1 1
20 2562 1 1 9 PHE H H -3.780 0.837 -0.906 1.00 . A A . 9 PHE H 1 1
20 2563 1 1 9 PHE HA H -2.894 -1.529 0.479 1.00 . A A . 9 PHE HA 1 1
20 2564 1 1 9 PHE HB2 H -5.563 -0.303 0.511 1.00 . A A . 9 PHE HB2 1 1
20 2565 1 1 9 PHE HB3 H -5.505 -2.052 0.414 1.00 . A A . 9 PHE HB3 1 1
20 2566 1 1 9 PHE HD1 H -4.818 0.863 2.501 1.00 . A A . 9 PHE HD1 1 1
20 2567 1 1 9 PHE HD2 H -4.672 -3.384 2.261 1.00 . A A . 9 PHE HD2 1 1
20 2568 1 1 9 PHE HE1 H -4.476 0.741 4.935 1.00 . A A . 9 PHE HE1 1 1
20 2569 1 1 9 PHE HE2 H -4.330 -3.514 4.693 1.00 . A A . 9 PHE HE2 1 1
20 2570 1 1 9 PHE HZ H -4.232 -1.450 6.033 1.00 . A A . 9 PHE HZ 1 1
20 2571 1 1 9 PHE N N -3.349 0.327 -0.222 1.00 . A A . 9 PHE N 1 1
20 2572 1 1 9 PHE O O -4.295 -2.913 -1.475 1.00 . A A . 9 PHE O 1 1
20 2573 1 1 10 GLY C C -4.580 -0.857 -4.610 1.00 . A A . 10 GLY C 1 1
20 2574 1 1 10 GLY CA C -3.542 -1.581 -3.773 1.00 . A A . 10 GLY CA 1 1
20 2575 1 1 10 GLY H H -3.117 -0.169 -2.251 1.00 . A A . 10 GLY H 1 1
20 2576 1 1 10 GLY HA2 H -2.578 -1.476 -4.245 1.00 . A A . 10 GLY HA2 1 1
20 2577 1 1 10 GLY HA3 H -3.798 -2.629 -3.730 1.00 . A A . 10 GLY HA3 1 1
20 2578 1 1 10 GLY N N -3.461 -1.062 -2.420 1.00 . A A . 10 GLY N 1 1
20 2579 1 1 10 GLY O O -5.621 -0.457 -4.048 1.00 . A A . 10 GLY O 1 1
20 2580 1 1 10 GLY OXT O -4.350 -0.690 -5.825 1.00 . A A . 10 GLY OXT 1 1
21 2581 1 1 1 GLY C C -1.390 -5.099 0.514 1.00 . A A . 1 GLY C 1 1
21 2582 1 1 1 GLY CA C -1.655 -6.592 0.467 1.00 . A A . 1 GLY CA 1 1
21 2583 1 1 1 GLY H1 H -1.400 -7.442 -1.424 1.00 . A A . 1 GLY H1 1 1
21 2584 1 1 1 GLY H2 H -0.507 -8.202 -0.206 1.00 . A A . 1 GLY H2 1 1
21 2585 1 1 1 GLY H3 H -0.006 -6.705 -0.811 1.00 . A A . 1 GLY H3 1 1
21 2586 1 1 1 GLY HA2 H -2.700 -6.754 0.248 1.00 . A A . 1 GLY HA2 1 1
21 2587 1 1 1 GLY HA3 H -1.430 -7.017 1.433 1.00 . A A . 1 GLY HA3 1 1
21 2588 1 1 1 GLY N N -0.835 -7.283 -0.566 1.00 . A A . 1 GLY N 1 1
21 2589 1 1 1 GLY O O -1.643 -4.386 -0.457 1.00 . A A . 1 GLY O 1 1
21 2590 1 1 2 TYR C C 0.504 -2.763 0.851 1.00 . A A . 2 TYR C 1 1
21 2591 1 1 2 TYR CA C -0.580 -3.214 1.819 1.00 . A A . 2 TYR CA 1 1
21 2592 1 1 2 TYR CB C -0.135 -2.929 3.254 1.00 . A A . 2 TYR CB 1 1
21 2593 1 1 2 TYR CD1 C -0.784 -0.553 3.792 1.00 . A A . 2 TYR CD1 1 1
21 2594 1 1 2 TYR CD2 C 1.525 -1.027 3.438 1.00 . A A . 2 TYR CD2 1 1
21 2595 1 1 2 TYR CE1 C -0.480 0.776 4.015 1.00 . A A . 2 TYR CE1 1 1
21 2596 1 1 2 TYR CE2 C 1.837 0.299 3.659 1.00 . A A . 2 TYR CE2 1 1
21 2597 1 1 2 TYR CG C 0.210 -1.477 3.501 1.00 . A A . 2 TYR CG 1 1
21 2598 1 1 2 TYR CZ C 0.832 1.198 3.948 1.00 . A A . 2 TYR CZ 1 1
21 2599 1 1 2 TYR H H -0.701 -5.244 2.383 1.00 . A A . 2 TYR H 1 1
21 2600 1 1 2 TYR HA H -1.482 -2.656 1.618 1.00 . A A . 2 TYR HA 1 1
21 2601 1 1 2 TYR HB2 H -0.930 -3.202 3.932 1.00 . A A . 2 TYR HB2 1 1
21 2602 1 1 2 TYR HB3 H 0.741 -3.523 3.476 1.00 . A A . 2 TYR HB3 1 1
21 2603 1 1 2 TYR HD1 H -1.810 -0.886 3.842 1.00 . A A . 2 TYR HD1 1 1
21 2604 1 1 2 TYR HD2 H 2.313 -1.729 3.212 1.00 . A A . 2 TYR HD2 1 1
21 2605 1 1 2 TYR HE1 H -1.269 1.479 4.242 1.00 . A A . 2 TYR HE1 1 1
21 2606 1 1 2 TYR HE2 H 2.865 0.626 3.604 1.00 . A A . 2 TYR HE2 1 1
21 2607 1 1 2 TYR HH H 1.917 2.581 4.727 1.00 . A A . 2 TYR HH 1 1
21 2608 1 1 2 TYR N N -0.880 -4.628 1.646 1.00 . A A . 2 TYR N 1 1
21 2609 1 1 2 TYR O O 1.561 -3.385 0.760 1.00 . A A . 2 TYR O 1 1
21 2610 1 1 2 TYR OH O 1.139 2.520 4.169 1.00 . A A . 2 TYR OH 1 1
21 2611 1 1 3 ASP C C 2.095 -0.108 -0.099 1.00 . A A . 3 ASP C 1 1
21 2612 1 1 3 ASP CA C 1.189 -1.116 -0.805 1.00 . A A . 3 ASP CA 1 1
21 2613 1 1 3 ASP CB C 0.451 -0.439 -1.962 1.00 . A A . 3 ASP CB 1 1
21 2614 1 1 3 ASP CG C 1.269 -0.429 -3.240 1.00 . A A . 3 ASP CG 1 1
21 2615 1 1 3 ASP H H -0.617 -1.224 0.274 1.00 . A A . 3 ASP H 1 1
21 2616 1 1 3 ASP HA H 1.780 -1.925 -1.186 1.00 . A A . 3 ASP HA 1 1
21 2617 1 1 3 ASP HB2 H -0.470 -0.966 -2.152 1.00 . A A . 3 ASP HB2 1 1
21 2618 1 1 3 ASP HB3 H 0.230 0.583 -1.690 1.00 . A A . 3 ASP HB3 1 1
21 2619 1 1 3 ASP N N 0.237 -1.672 0.145 1.00 . A A . 3 ASP N 1 1
21 2620 1 1 3 ASP O O 1.668 1.004 0.211 1.00 . A A . 3 ASP O 1 1
21 2621 1 1 3 ASP OD1 O 2.508 -0.558 -3.153 1.00 . A A . 3 ASP OD1 1 1
21 2622 1 1 3 ASP OD2 O 0.669 -0.293 -4.327 1.00 . A A . 3 ASP OD2 1 1
21 2623 1 1 4 PRO C C 4.840 1.510 0.024 1.00 . A A . 4 PRO C 1 1
21 2624 1 1 4 PRO CA C 4.300 0.382 0.895 1.00 . A A . 4 PRO CA 1 1
21 2625 1 1 4 PRO CB C 5.436 -0.566 1.298 1.00 . A A . 4 PRO CB 1 1
21 2626 1 1 4 PRO CD C 3.956 -1.789 -0.094 1.00 . A A . 4 PRO CD 1 1
21 2627 1 1 4 PRO CG C 4.892 -1.927 1.077 1.00 . A A . 4 PRO CG 1 1
21 2628 1 1 4 PRO HA H 3.858 0.791 1.783 1.00 . A A . 4 PRO HA 1 1
21 2629 1 1 4 PRO HB2 H 6.303 -0.380 0.683 1.00 . A A . 4 PRO HB2 1 1
21 2630 1 1 4 PRO HB3 H 5.679 -0.411 2.338 1.00 . A A . 4 PRO HB3 1 1
21 2631 1 1 4 PRO HD2 H 4.492 -1.768 -1.039 1.00 . A A . 4 PRO HD2 1 1
21 2632 1 1 4 PRO HD3 H 3.219 -2.569 -0.086 1.00 . A A . 4 PRO HD3 1 1
21 2633 1 1 4 PRO HG2 H 5.694 -2.625 0.869 1.00 . A A . 4 PRO HG2 1 1
21 2634 1 1 4 PRO HG3 H 4.346 -2.229 1.954 1.00 . A A . 4 PRO HG3 1 1
21 2635 1 1 4 PRO N N 3.351 -0.488 0.194 1.00 . A A . 4 PRO N 1 1
21 2636 1 1 4 PRO O O 5.136 2.600 0.514 1.00 . A A . 4 PRO O 1 1
21 2637 1 1 5 ALA C C 4.618 3.478 -2.214 1.00 . A A . 5 ALA C 1 1
21 2638 1 1 5 ALA CA C 5.487 2.228 -2.209 1.00 . A A . 5 ALA CA 1 1
21 2639 1 1 5 ALA CB C 5.569 1.636 -3.608 1.00 . A A . 5 ALA CB 1 1
21 2640 1 1 5 ALA H H 4.723 0.353 -1.599 1.00 . A A . 5 ALA H 1 1
21 2641 1 1 5 ALA HA H 6.486 2.498 -1.899 1.00 . A A . 5 ALA HA 1 1
21 2642 1 1 5 ALA HB1 H 6.534 1.171 -3.745 1.00 . A A . 5 ALA HB1 1 1
21 2643 1 1 5 ALA HB2 H 5.438 2.419 -4.339 1.00 . A A . 5 ALA HB2 1 1
21 2644 1 1 5 ALA HB3 H 4.792 0.895 -3.731 1.00 . A A . 5 ALA HB3 1 1
21 2645 1 1 5 ALA N N 4.973 1.239 -1.269 1.00 . A A . 5 ALA N 1 1
21 2646 1 1 5 ALA O O 5.105 4.590 -2.012 1.00 . A A . 5 ALA O 1 1
21 2647 1 1 6 THR C C 1.752 4.586 -1.099 1.00 . A A . 6 THR C 1 1
21 2648 1 1 6 THR CA C 2.382 4.379 -2.476 1.00 . A A . 6 THR CA 1 1
21 2649 1 1 6 THR CB C 1.311 4.090 -3.531 1.00 . A A . 6 THR CB 1 1
21 2650 1 1 6 THR CG2 C 0.083 4.953 -3.399 1.00 . A A . 6 THR CG2 1 1
21 2651 1 1 6 THR H H 2.996 2.383 -2.597 1.00 . A A . 6 THR H 1 1
21 2652 1 1 6 THR HA H 2.921 5.266 -2.755 1.00 . A A . 6 THR HA 1 1
21 2653 1 1 6 THR HB H 1.001 3.059 -3.437 1.00 . A A . 6 THR HB 1 1
21 2654 1 1 6 THR HG1 H 2.034 5.208 -4.967 1.00 . A A . 6 THR HG1 1 1
21 2655 1 1 6 THR HG21 H 0.314 5.957 -3.718 1.00 . A A . 6 THR HG21 1 1
21 2656 1 1 6 THR HG22 H -0.233 4.967 -2.369 1.00 . A A . 6 THR HG22 1 1
21 2657 1 1 6 THR HG23 H -0.706 4.549 -4.014 1.00 . A A . 6 THR HG23 1 1
21 2658 1 1 6 THR N N 3.326 3.285 -2.444 1.00 . A A . 6 THR N 1 1
21 2659 1 1 6 THR O O 1.299 5.682 -0.771 1.00 . A A . 6 THR O 1 1
21 2660 1 1 6 THR OG1 O 1.830 4.279 -4.835 1.00 . A A . 6 THR OG1 1 1
21 2661 1 1 7 GLY C C -0.335 3.403 1.039 1.00 . A A . 7 GLY C 1 1
21 2662 1 1 7 GLY CA C 1.165 3.601 1.029 1.00 . A A . 7 GLY CA 1 1
21 2663 1 1 7 GLY H H 2.110 2.682 -0.610 1.00 . A A . 7 GLY H 1 1
21 2664 1 1 7 GLY HA2 H 1.614 2.832 1.638 1.00 . A A . 7 GLY HA2 1 1
21 2665 1 1 7 GLY HA3 H 1.396 4.562 1.449 1.00 . A A . 7 GLY HA3 1 1
21 2666 1 1 7 GLY N N 1.732 3.524 -0.299 1.00 . A A . 7 GLY N 1 1
21 2667 1 1 7 GLY O O -1.047 4.006 1.841 1.00 . A A . 7 GLY O 1 1
21 2668 1 1 8 THR C C -2.436 0.815 0.480 1.00 . A A . 8 THR C 1 1
21 2669 1 1 8 THR CA C -2.193 2.245 0.026 1.00 . A A . 8 THR CA 1 1
21 2670 1 1 8 THR CB C -2.602 2.454 -1.431 1.00 . A A . 8 THR CB 1 1
21 2671 1 1 8 THR CG2 C -4.016 2.933 -1.575 1.00 . A A . 8 THR CG2 1 1
21 2672 1 1 8 THR H H -0.215 2.100 -0.459 1.00 . A A . 8 THR H 1 1
21 2673 1 1 8 THR HA H -2.750 2.905 0.647 1.00 . A A . 8 THR HA 1 1
21 2674 1 1 8 THR HB H -2.508 1.520 -1.966 1.00 . A A . 8 THR HB 1 1
21 2675 1 1 8 THR HG1 H -1.929 4.276 -1.679 1.00 . A A . 8 THR HG1 1 1
21 2676 1 1 8 THR HG21 H -4.366 2.722 -2.572 1.00 . A A . 8 THR HG21 1 1
21 2677 1 1 8 THR HG22 H -4.047 3.993 -1.394 1.00 . A A . 8 THR HG22 1 1
21 2678 1 1 8 THR HG23 H -4.635 2.424 -0.855 1.00 . A A . 8 THR HG23 1 1
21 2679 1 1 8 THR N N -0.811 2.548 0.146 1.00 . A A . 8 THR N 1 1
21 2680 1 1 8 THR O O -1.886 0.360 1.483 1.00 . A A . 8 THR O 1 1
21 2681 1 1 8 THR OG1 O -1.763 3.409 -2.055 1.00 . A A . 8 THR OG1 1 1
21 2682 1 1 9 PHE C C -3.789 -2.052 -1.250 1.00 . A A . 9 PHE C 1 1
21 2683 1 1 9 PHE CA C -3.607 -1.247 0.023 1.00 . A A . 9 PHE CA 1 1
21 2684 1 1 9 PHE CB C -4.880 -1.267 0.829 1.00 . A A . 9 PHE CB 1 1
21 2685 1 1 9 PHE CD1 C -4.497 -0.019 2.972 1.00 . A A . 9 PHE CD1 1 1
21 2686 1 1 9 PHE CD2 C -4.591 -2.402 3.049 1.00 . A A . 9 PHE CD2 1 1
21 2687 1 1 9 PHE CE1 C -4.284 0.020 4.336 1.00 . A A . 9 PHE CE1 1 1
21 2688 1 1 9 PHE CE2 C -4.377 -2.368 4.414 1.00 . A A . 9 PHE CE2 1 1
21 2689 1 1 9 PHE CG C -4.653 -1.229 2.314 1.00 . A A . 9 PHE CG 1 1
21 2690 1 1 9 PHE CZ C -4.224 -1.157 5.058 1.00 . A A . 9 PHE CZ 1 1
21 2691 1 1 9 PHE H H -3.644 0.566 -1.021 1.00 . A A . 9 PHE H 1 1
21 2692 1 1 9 PHE HA H -2.811 -1.669 0.581 1.00 . A A . 9 PHE HA 1 1
21 2693 1 1 9 PHE HB2 H -5.458 -0.404 0.547 1.00 . A A . 9 PHE HB2 1 1
21 2694 1 1 9 PHE HB3 H -5.430 -2.156 0.589 1.00 . A A . 9 PHE HB3 1 1
21 2695 1 1 9 PHE HD1 H -4.543 0.900 2.408 1.00 . A A . 9 PHE HD1 1 1
21 2696 1 1 9 PHE HD2 H -4.711 -3.349 2.546 1.00 . A A . 9 PHE HD2 1 1
21 2697 1 1 9 PHE HE1 H -4.165 0.968 4.837 1.00 . A A . 9 PHE HE1 1 1
21 2698 1 1 9 PHE HE2 H -4.331 -3.290 4.976 1.00 . A A . 9 PHE HE2 1 1
21 2699 1 1 9 PHE HZ H -4.058 -1.127 6.125 1.00 . A A . 9 PHE HZ 1 1
21 2700 1 1 9 PHE N N -3.257 0.129 -0.263 1.00 . A A . 9 PHE N 1 1
21 2701 1 1 9 PHE O O -4.267 -3.187 -1.233 1.00 . A A . 9 PHE O 1 1
21 2702 1 1 10 GLY C C -4.520 -1.388 -4.536 1.00 . A A . 10 GLY C 1 1
21 2703 1 1 10 GLY CA C -3.506 -2.073 -3.640 1.00 . A A . 10 GLY CA 1 1
21 2704 1 1 10 GLY H H -3.036 -0.549 -2.249 1.00 . A A . 10 GLY H 1 1
21 2705 1 1 10 GLY HA2 H -2.540 -2.045 -4.121 1.00 . A A . 10 GLY HA2 1 1
21 2706 1 1 10 GLY HA3 H -3.798 -3.104 -3.508 1.00 . A A . 10 GLY HA3 1 1
21 2707 1 1 10 GLY N N -3.401 -1.443 -2.338 1.00 . A A . 10 GLY N 1 1
21 2708 1 1 10 GLY O O -4.888 -0.231 -4.242 1.00 . A A . 10 GLY O 1 1
21 2709 1 1 10 GLY OXT O -4.946 -2.009 -5.533 1.00 . A A . 10 GLY OXT 1 1
22 2710 1 1 1 GLY C C -1.159 -5.282 0.354 1.00 . A A . 1 GLY C 1 1
22 2711 1 1 1 GLY CA C -1.383 -6.781 0.290 1.00 . A A . 1 GLY CA 1 1
22 2712 1 1 1 GLY H1 H -2.221 -8.315 1.432 1.00 . A A . 1 GLY H1 1 1
22 2713 1 1 1 GLY H2 H -3.226 -6.968 1.255 1.00 . A A . 1 GLY H2 1 1
22 2714 1 1 1 GLY H3 H -1.904 -6.904 2.309 1.00 . A A . 1 GLY H3 1 1
22 2715 1 1 1 GLY HA2 H -0.425 -7.278 0.342 1.00 . A A . 1 GLY HA2 1 1
22 2716 1 1 1 GLY HA3 H -1.851 -7.024 -0.651 1.00 . A A . 1 GLY HA3 1 1
22 2717 1 1 1 GLY N N -2.243 -7.276 1.399 1.00 . A A . 1 GLY N 1 1
22 2718 1 1 1 GLY O O -1.362 -4.576 -0.633 1.00 . A A . 1 GLY O 1 1
22 2719 1 1 2 TYR C C 0.619 -2.891 0.781 1.00 . A A . 2 TYR C 1 1
22 2720 1 1 2 TYR CA C -0.488 -3.376 1.707 1.00 . A A . 2 TYR CA 1 1
22 2721 1 1 2 TYR CB C -0.101 -3.089 3.160 1.00 . A A . 2 TYR CB 1 1
22 2722 1 1 2 TYR CD1 C -0.868 -0.749 3.696 1.00 . A A . 2 TYR CD1 1 1
22 2723 1 1 2 TYR CD2 C 1.472 -1.123 3.428 1.00 . A A . 2 TYR CD2 1 1
22 2724 1 1 2 TYR CE1 C -0.627 0.590 3.945 1.00 . A A . 2 TYR CE1 1 1
22 2725 1 1 2 TYR CE2 C 1.719 0.212 3.678 1.00 . A A . 2 TYR CE2 1 1
22 2726 1 1 2 TYR CG C 0.174 -1.626 3.434 1.00 . A A . 2 TYR CG 1 1
22 2727 1 1 2 TYR CZ C 0.667 1.065 3.936 1.00 . A A . 2 TYR CZ 1 1
22 2728 1 1 2 TYR H H -0.593 -5.409 2.266 1.00 . A A . 2 TYR H 1 1
22 2729 1 1 2 TYR HA H -1.396 -2.843 1.474 1.00 . A A . 2 TYR HA 1 1
22 2730 1 1 2 TYR HB2 H -0.908 -3.402 3.808 1.00 . A A . 2 TYR HB2 1 1
22 2731 1 1 2 TYR HB3 H 0.789 -3.648 3.407 1.00 . A A . 2 TYR HB3 1 1
22 2732 1 1 2 TYR HD1 H -1.879 -1.123 3.701 1.00 . A A . 2 TYR HD1 1 1
22 2733 1 1 2 TYR HD2 H 2.296 -1.789 3.225 1.00 . A A . 2 TYR HD2 1 1
22 2734 1 1 2 TYR HE1 H -1.453 1.256 4.148 1.00 . A A . 2 TYR HE1 1 1
22 2735 1 1 2 TYR HE2 H 2.735 0.582 3.668 1.00 . A A . 2 TYR HE2 1 1
22 2736 1 1 2 TYR HH H 0.877 2.557 5.131 1.00 . A A . 2 TYR HH 1 1
22 2737 1 1 2 TYR N N -0.738 -4.798 1.518 1.00 . A A . 2 TYR N 1 1
22 2738 1 1 2 TYR O O 1.696 -3.482 0.725 1.00 . A A . 2 TYR O 1 1
22 2739 1 1 2 TYR OH O 0.911 2.395 4.184 1.00 . A A . 2 TYR OH 1 1
22 2740 1 1 3 ASP C C 2.146 -0.170 -0.114 1.00 . A A . 3 ASP C 1 1
22 2741 1 1 3 ASP CA C 1.312 -1.221 -0.845 1.00 . A A . 3 ASP CA 1 1
22 2742 1 1 3 ASP CB C 0.599 -0.586 -2.040 1.00 . A A . 3 ASP CB 1 1
22 2743 1 1 3 ASP CG C 1.464 -0.565 -3.284 1.00 . A A . 3 ASP CG 1 1
22 2744 1 1 3 ASP H H -0.526 -1.384 0.169 1.00 . A A . 3 ASP H 1 1
22 2745 1 1 3 ASP HA H 1.952 -2.008 -1.192 1.00 . A A . 3 ASP HA 1 1
22 2746 1 1 3 ASP HB2 H -0.298 -1.148 -2.257 1.00 . A A . 3 ASP HB2 1 1
22 2747 1 1 3 ASP HB3 H 0.330 0.431 -1.792 1.00 . A A . 3 ASP HB3 1 1
22 2748 1 1 3 ASP N N 0.345 -1.807 0.069 1.00 . A A . 3 ASP N 1 1
22 2749 1 1 3 ASP O O 1.662 0.926 0.166 1.00 . A A . 3 ASP O 1 1
22 2750 1 1 3 ASP OD1 O 2.372 0.289 -3.363 1.00 . A A . 3 ASP OD1 1 1
22 2751 1 1 3 ASP OD2 O 1.234 -1.404 -4.182 1.00 . A A . 3 ASP OD2 1 1
22 2752 1 1 4 PRO C C 4.811 1.559 0.100 1.00 . A A . 4 PRO C 1 1
22 2753 1 1 4 PRO CA C 4.285 0.419 0.964 1.00 . A A . 4 PRO CA 1 1
22 2754 1 1 4 PRO CB C 5.441 -0.477 1.425 1.00 . A A . 4 PRO CB 1 1
22 2755 1 1 4 PRO CD C 4.072 -1.772 -0.015 1.00 . A A . 4 PRO CD 1 1
22 2756 1 1 4 PRO CG C 4.967 -1.862 1.193 1.00 . A A . 4 PRO CG 1 1
22 2757 1 1 4 PRO HA H 3.788 0.819 1.828 1.00 . A A . 4 PRO HA 1 1
22 2758 1 1 4 PRO HB2 H 6.327 -0.258 0.850 1.00 . A A . 4 PRO HB2 1 1
22 2759 1 1 4 PRO HB3 H 5.629 -0.304 2.474 1.00 . A A . 4 PRO HB3 1 1
22 2760 1 1 4 PRO HD2 H 4.646 -1.737 -0.939 1.00 . A A . 4 PRO HD2 1 1
22 2761 1 1 4 PRO HD3 H 3.368 -2.584 -0.029 1.00 . A A . 4 PRO HD3 1 1
22 2762 1 1 4 PRO HG2 H 5.807 -2.523 1.021 1.00 . A A . 4 PRO HG2 1 1
22 2763 1 1 4 PRO HG3 H 4.401 -2.182 2.049 1.00 . A A . 4 PRO HG3 1 1
22 2764 1 1 4 PRO N N 3.404 -0.496 0.234 1.00 . A A . 4 PRO N 1 1
22 2765 1 1 4 PRO O O 5.026 2.669 0.586 1.00 . A A . 4 PRO O 1 1
22 2766 1 1 5 ALA C C 4.575 3.472 -2.181 1.00 . A A . 5 ALA C 1 1
22 2767 1 1 5 ALA CA C 5.519 2.281 -2.111 1.00 . A A . 5 ALA CA 1 1
22 2768 1 1 5 ALA CB C 5.710 1.673 -3.492 1.00 . A A . 5 ALA CB 1 1
22 2769 1 1 5 ALA H H 4.825 0.376 -1.507 1.00 . A A . 5 ALA H 1 1
22 2770 1 1 5 ALA HA H 6.482 2.617 -1.752 1.00 . A A . 5 ALA HA 1 1
22 2771 1 1 5 ALA HB1 H 6.584 2.106 -3.957 1.00 . A A . 5 ALA HB1 1 1
22 2772 1 1 5 ALA HB2 H 4.841 1.877 -4.099 1.00 . A A . 5 ALA HB2 1 1
22 2773 1 1 5 ALA HB3 H 5.843 0.605 -3.400 1.00 . A A . 5 ALA HB3 1 1
22 2774 1 1 5 ALA N N 5.016 1.279 -1.180 1.00 . A A . 5 ALA N 1 1
22 2775 1 1 5 ALA O O 4.977 4.614 -1.953 1.00 . A A . 5 ALA O 1 1
22 2776 1 1 6 THR C C 1.719 4.524 -1.213 1.00 . A A . 6 THR C 1 1
22 2777 1 1 6 THR CA C 2.309 4.224 -2.590 1.00 . A A . 6 THR CA 1 1
22 2778 1 1 6 THR CB C 1.220 3.768 -3.559 1.00 . A A . 6 THR CB 1 1
22 2779 1 1 6 THR CG2 C 0.009 4.661 -3.563 1.00 . A A . 6 THR CG2 1 1
22 2780 1 1 6 THR H H 3.055 2.274 -2.661 1.00 . A A . 6 THR H 1 1
22 2781 1 1 6 THR HA H 2.778 5.110 -2.977 1.00 . A A . 6 THR HA 1 1
22 2782 1 1 6 THR HB H 0.898 2.775 -3.280 1.00 . A A . 6 THR HB 1 1
22 2783 1 1 6 THR HG1 H 1.926 4.604 -5.184 1.00 . A A . 6 THR HG1 1 1
22 2784 1 1 6 THR HG21 H -0.806 4.153 -4.049 1.00 . A A . 6 THR HG21 1 1
22 2785 1 1 6 THR HG22 H 0.239 5.571 -4.093 1.00 . A A . 6 THR HG22 1 1
22 2786 1 1 6 THR HG23 H -0.261 4.892 -2.546 1.00 . A A . 6 THR HG23 1 1
22 2787 1 1 6 THR N N 3.316 3.196 -2.492 1.00 . A A . 6 THR N 1 1
22 2788 1 1 6 THR O O 1.299 5.648 -0.935 1.00 . A A . 6 THR O 1 1
22 2789 1 1 6 THR OG1 O 1.718 3.716 -4.884 1.00 . A A . 6 THR OG1 1 1
22 2790 1 1 7 GLY C C -0.331 3.506 1.048 1.00 . A A . 7 GLY C 1 1
22 2791 1 1 7 GLY CA C 1.171 3.667 0.981 1.00 . A A . 7 GLY CA 1 1
22 2792 1 1 7 GLY H H 2.050 2.643 -0.633 1.00 . A A . 7 GLY H 1 1
22 2793 1 1 7 GLY HA2 H 1.621 2.919 1.613 1.00 . A A . 7 GLY HA2 1 1
22 2794 1 1 7 GLY HA3 H 1.439 4.643 1.344 1.00 . A A . 7 GLY HA3 1 1
22 2795 1 1 7 GLY N N 1.699 3.508 -0.356 1.00 . A A . 7 GLY N 1 1
22 2796 1 1 7 GLY O O -0.999 4.150 1.858 1.00 . A A . 7 GLY O 1 1
22 2797 1 1 8 THR C C -2.493 0.922 0.540 1.00 . A A . 8 THR C 1 1
22 2798 1 1 8 THR CA C -2.250 2.366 0.137 1.00 . A A . 8 THR CA 1 1
22 2799 1 1 8 THR CB C -2.730 2.647 -1.285 1.00 . A A . 8 THR CB 1 1
22 2800 1 1 8 THR CG2 C -4.146 3.135 -1.332 1.00 . A A . 8 THR CG2 1 1
22 2801 1 1 8 THR H H -0.296 2.162 -0.412 1.00 . A A . 8 THR H 1 1
22 2802 1 1 8 THR HA H -2.763 3.007 0.814 1.00 . A A . 8 THR HA 1 1
22 2803 1 1 8 THR HB H -2.667 1.740 -1.867 1.00 . A A . 8 THR HB 1 1
22 2804 1 1 8 THR HG1 H -2.266 3.829 -2.776 1.00 . A A . 8 THR HG1 1 1
22 2805 1 1 8 THR HG21 H -4.149 4.195 -1.521 1.00 . A A . 8 THR HG21 1 1
22 2806 1 1 8 THR HG22 H -4.617 2.937 -0.383 1.00 . A A . 8 THR HG22 1 1
22 2807 1 1 8 THR HG23 H -4.676 2.622 -2.116 1.00 . A A . 8 THR HG23 1 1
22 2808 1 1 8 THR N N -0.859 2.640 0.198 1.00 . A A . 8 THR N 1 1
22 2809 1 1 8 THR O O -1.898 0.417 1.491 1.00 . A A . 8 THR O 1 1
22 2810 1 1 8 THR OG1 O -1.920 3.630 -1.905 1.00 . A A . 8 THR OG1 1 1
22 2811 1 1 9 PHE C C -3.881 -1.876 -1.237 1.00 . A A . 9 PHE C 1 1
22 2812 1 1 9 PHE CA C -3.716 -1.102 0.059 1.00 . A A . 9 PHE CA 1 1
22 2813 1 1 9 PHE CB C -5.000 -1.146 0.846 1.00 . A A . 9 PHE CB 1 1
22 2814 1 1 9 PHE CD1 C -4.587 -2.253 3.059 1.00 . A A . 9 PHE CD1 1 1
22 2815 1 1 9 PHE CD2 C -4.814 0.122 3.003 1.00 . A A . 9 PHE CD2 1 1
22 2816 1 1 9 PHE CE1 C -4.396 -2.205 4.427 1.00 . A A . 9 PHE CE1 1 1
22 2817 1 1 9 PHE CE2 C -4.622 0.175 4.371 1.00 . A A . 9 PHE CE2 1 1
22 2818 1 1 9 PHE CG C -4.798 -1.091 2.333 1.00 . A A . 9 PHE CG 1 1
22 2819 1 1 9 PHE CZ C -4.413 -0.990 5.084 1.00 . A A . 9 PHE CZ 1 1
22 2820 1 1 9 PHE H H -3.781 0.752 -0.905 1.00 . A A . 9 PHE H 1 1
22 2821 1 1 9 PHE HA H -2.928 -1.540 0.618 1.00 . A A . 9 PHE HA 1 1
22 2822 1 1 9 PHE HB2 H -5.595 -0.297 0.552 1.00 . A A . 9 PHE HB2 1 1
22 2823 1 1 9 PHE HB3 H -5.528 -2.047 0.605 1.00 . A A . 9 PHE HB3 1 1
22 2824 1 1 9 PHE HD1 H -4.573 -3.203 2.546 1.00 . A A . 9 PHE HD1 1 1
22 2825 1 1 9 PHE HD2 H -4.977 1.032 2.446 1.00 . A A . 9 PHE HD2 1 1
22 2826 1 1 9 PHE HE1 H -4.231 -3.117 4.981 1.00 . A A . 9 PHE HE1 1 1
22 2827 1 1 9 PHE HE2 H -4.637 1.127 4.881 1.00 . A A . 9 PHE HE2 1 1
22 2828 1 1 9 PHE HZ H -4.262 -0.949 6.152 1.00 . A A . 9 PHE HZ 1 1
22 2829 1 1 9 PHE N N -3.364 0.280 -0.187 1.00 . A A . 9 PHE N 1 1
22 2830 1 1 9 PHE O O -4.357 -3.010 -1.255 1.00 . A A . 9 PHE O 1 1
22 2831 1 1 10 GLY C C -2.915 -0.981 -4.692 1.00 . A A . 10 GLY C 1 1
22 2832 1 1 10 GLY CA C -3.567 -1.837 -3.624 1.00 . A A . 10 GLY CA 1 1
22 2833 1 1 10 GLY H H -3.117 -0.345 -2.187 1.00 . A A . 10 GLY H 1 1
22 2834 1 1 10 GLY HA2 H -3.079 -2.800 -3.603 1.00 . A A . 10 GLY HA2 1 1
22 2835 1 1 10 GLY HA3 H -4.608 -1.977 -3.875 1.00 . A A . 10 GLY HA3 1 1
22 2836 1 1 10 GLY N N -3.480 -1.239 -2.303 1.00 . A A . 10 GLY N 1 1
22 2837 1 1 10 GLY O O -2.377 0.093 -4.348 1.00 . A A . 10 GLY O 1 1
22 2838 1 1 10 GLY OXT O -2.941 -1.385 -5.874 1.00 . A A . 10 GLY OXT 1 1
23 2839 1 1 1 GLY C C -1.663 -5.194 0.494 1.00 . A A . 1 GLY C 1 1
23 2840 1 1 1 GLY CA C -1.982 -6.675 0.525 1.00 . A A . 1 GLY CA 1 1
23 2841 1 1 1 GLY H1 H -4.010 -6.702 0.024 1.00 . A A . 1 GLY H1 1 1
23 2842 1 1 1 GLY H2 H -3.158 -8.065 -0.501 1.00 . A A . 1 GLY H2 1 1
23 2843 1 1 1 GLY H3 H -2.976 -6.591 -1.311 1.00 . A A . 1 GLY H3 1 1
23 2844 1 1 1 GLY HA2 H -2.242 -6.955 1.535 1.00 . A A . 1 GLY HA2 1 1
23 2845 1 1 1 GLY HA3 H -1.105 -7.228 0.224 1.00 . A A . 1 GLY HA3 1 1
23 2846 1 1 1 GLY N N -3.110 -7.033 -0.379 1.00 . A A . 1 GLY N 1 1
23 2847 1 1 1 GLY O O -2.079 -4.482 -0.421 1.00 . A A . 1 GLY O 1 1
23 2848 1 1 2 TYR C C 0.472 -2.969 0.514 1.00 . A A . 2 TYR C 1 1
23 2849 1 1 2 TYR CA C -0.550 -3.327 1.580 1.00 . A A . 2 TYR CA 1 1
23 2850 1 1 2 TYR CB C 0.018 -3.003 2.956 1.00 . A A . 2 TYR CB 1 1
23 2851 1 1 2 TYR CD1 C -1.023 -0.883 3.824 1.00 . A A . 2 TYR CD1 1 1
23 2852 1 1 2 TYR CD2 C 1.187 -0.761 2.944 1.00 . A A . 2 TYR CD2 1 1
23 2853 1 1 2 TYR CE1 C -0.991 0.472 4.099 1.00 . A A . 2 TYR CE1 1 1
23 2854 1 1 2 TYR CE2 C 1.227 0.591 3.213 1.00 . A A . 2 TYR CE2 1 1
23 2855 1 1 2 TYR CG C 0.063 -1.521 3.246 1.00 . A A . 2 TYR CG 1 1
23 2856 1 1 2 TYR CZ C 0.137 1.204 3.792 1.00 . A A . 2 TYR CZ 1 1
23 2857 1 1 2 TYR H H -0.624 -5.337 2.192 1.00 . A A . 2 TYR H 1 1
23 2858 1 1 2 TYR HA H -1.441 -2.739 1.427 1.00 . A A . 2 TYR HA 1 1
23 2859 1 1 2 TYR HB2 H -0.595 -3.471 3.713 1.00 . A A . 2 TYR HB2 1 1
23 2860 1 1 2 TYR HB3 H 1.025 -3.387 3.024 1.00 . A A . 2 TYR HB3 1 1
23 2861 1 1 2 TYR HD1 H -1.904 -1.462 4.056 1.00 . A A . 2 TYR HD1 1 1
23 2862 1 1 2 TYR HD2 H 2.037 -1.235 2.483 1.00 . A A . 2 TYR HD2 1 1
23 2863 1 1 2 TYR HE1 H -1.847 0.950 4.550 1.00 . A A . 2 TYR HE1 1 1
23 2864 1 1 2 TYR HE2 H 2.114 1.158 2.974 1.00 . A A . 2 TYR HE2 1 1
23 2865 1 1 2 TYR HH H -0.493 3.003 3.541 1.00 . A A . 2 TYR HH 1 1
23 2866 1 1 2 TYR N N -0.924 -4.728 1.495 1.00 . A A . 2 TYR N 1 1
23 2867 1 1 2 TYR O O 1.249 -3.811 0.068 1.00 . A A . 2 TYR O 1 1
23 2868 1 1 2 TYR OH O 0.174 2.552 4.064 1.00 . A A . 2 TYR OH 1 1
23 2869 1 1 3 ASP C C 2.265 -0.104 -0.271 1.00 . A A . 3 ASP C 1 1
23 2870 1 1 3 ASP CA C 1.391 -1.202 -0.870 1.00 . A A . 3 ASP CA 1 1
23 2871 1 1 3 ASP CB C 0.625 -0.665 -2.078 1.00 . A A . 3 ASP CB 1 1
23 2872 1 1 3 ASP CG C 1.482 -0.604 -3.327 1.00 . A A . 3 ASP CG 1 1
23 2873 1 1 3 ASP H H -0.168 -1.095 0.528 1.00 . A A . 3 ASP H 1 1
23 2874 1 1 3 ASP HA H 2.015 -2.019 -1.178 1.00 . A A . 3 ASP HA 1 1
23 2875 1 1 3 ASP HB2 H -0.220 -1.309 -2.275 1.00 . A A . 3 ASP HB2 1 1
23 2876 1 1 3 ASP HB3 H 0.270 0.330 -1.856 1.00 . A A . 3 ASP HB3 1 1
23 2877 1 1 3 ASP N N 0.468 -1.706 0.127 1.00 . A A . 3 ASP N 1 1
23 2878 1 1 3 ASP O O 1.996 1.081 -0.455 1.00 . A A . 3 ASP O 1 1
23 2879 1 1 3 ASP OD1 O 2.521 -1.296 -3.370 1.00 . A A . 3 ASP OD1 1 1
23 2880 1 1 3 ASP OD2 O 1.114 0.138 -4.263 1.00 . A A . 3 ASP OD2 1 1
23 2881 1 1 4 PRO C C 4.770 1.515 0.122 1.00 . A A . 4 PRO C 1 1
23 2882 1 1 4 PRO CA C 4.230 0.476 1.100 1.00 . A A . 4 PRO CA 1 1
23 2883 1 1 4 PRO CB C 5.369 -0.399 1.615 1.00 . A A . 4 PRO CB 1 1
23 2884 1 1 4 PRO CD C 3.721 -1.880 0.745 1.00 . A A . 4 PRO CD 1 1
23 2885 1 1 4 PRO CG C 4.764 -1.730 1.834 1.00 . A A . 4 PRO CG 1 1
23 2886 1 1 4 PRO HA H 3.756 0.974 1.929 1.00 . A A . 4 PRO HA 1 1
23 2887 1 1 4 PRO HB2 H 6.152 -0.441 0.878 1.00 . A A . 4 PRO HB2 1 1
23 2888 1 1 4 PRO HB3 H 5.745 0.013 2.535 1.00 . A A . 4 PRO HB3 1 1
23 2889 1 1 4 PRO HD2 H 4.142 -2.336 -0.146 1.00 . A A . 4 PRO HD2 1 1
23 2890 1 1 4 PRO HD3 H 2.879 -2.455 1.103 1.00 . A A . 4 PRO HD3 1 1
23 2891 1 1 4 PRO HG2 H 5.529 -2.498 1.762 1.00 . A A . 4 PRO HG2 1 1
23 2892 1 1 4 PRO HG3 H 4.307 -1.756 2.810 1.00 . A A . 4 PRO HG3 1 1
23 2893 1 1 4 PRO N N 3.323 -0.486 0.466 1.00 . A A . 4 PRO N 1 1
23 2894 1 1 4 PRO O O 5.119 2.628 0.518 1.00 . A A . 4 PRO O 1 1
23 2895 1 1 5 ALA C C 4.496 3.306 -2.278 1.00 . A A . 5 ALA C 1 1
23 2896 1 1 5 ALA CA C 5.349 2.048 -2.179 1.00 . A A . 5 ALA CA 1 1
23 2897 1 1 5 ALA CB C 5.403 1.337 -3.523 1.00 . A A . 5 ALA CB 1 1
23 2898 1 1 5 ALA H H 4.553 0.247 -1.405 1.00 . A A . 5 ALA H 1 1
23 2899 1 1 5 ALA HA H 6.357 2.329 -1.908 1.00 . A A . 5 ALA HA 1 1
23 2900 1 1 5 ALA HB1 H 5.873 1.979 -4.253 1.00 . A A . 5 ALA HB1 1 1
23 2901 1 1 5 ALA HB2 H 4.399 1.100 -3.845 1.00 . A A . 5 ALA HB2 1 1
23 2902 1 1 5 ALA HB3 H 5.974 0.425 -3.425 1.00 . A A . 5 ALA HB3 1 1
23 2903 1 1 5 ALA N N 4.843 1.147 -1.151 1.00 . A A . 5 ALA N 1 1
23 2904 1 1 5 ALA O O 5.003 4.423 -2.174 1.00 . A A . 5 ALA O 1 1
23 2905 1 1 6 THR C C 1.697 4.588 -1.224 1.00 . A A . 6 THR C 1 1
23 2906 1 1 6 THR CA C 2.271 4.220 -2.592 1.00 . A A . 6 THR CA 1 1
23 2907 1 1 6 THR CB C 1.157 3.840 -3.570 1.00 . A A . 6 THR CB 1 1
23 2908 1 1 6 THR CG2 C -0.047 4.746 -3.504 1.00 . A A . 6 THR CG2 1 1
23 2909 1 1 6 THR H H 2.853 2.210 -2.554 1.00 . A A . 6 THR H 1 1
23 2910 1 1 6 THR HA H 2.812 5.060 -2.985 1.00 . A A . 6 THR HA 1 1
23 2911 1 1 6 THR HB H 0.826 2.835 -3.348 1.00 . A A . 6 THR HB 1 1
23 2912 1 1 6 THR HG1 H 1.458 3.018 -5.322 1.00 . A A . 6 THR HG1 1 1
23 2913 1 1 6 THR HG21 H -0.303 4.921 -2.472 1.00 . A A . 6 THR HG21 1 1
23 2914 1 1 6 THR HG22 H -0.876 4.276 -4.007 1.00 . A A . 6 THR HG22 1 1
23 2915 1 1 6 THR HG23 H 0.184 5.684 -3.982 1.00 . A A . 6 THR HG23 1 1
23 2916 1 1 6 THR N N 3.198 3.115 -2.478 1.00 . A A . 6 THR N 1 1
23 2917 1 1 6 THR O O 1.290 5.726 -0.995 1.00 . A A . 6 THR O 1 1
23 2918 1 1 6 THR OG1 O 1.634 3.864 -4.904 1.00 . A A . 6 THR OG1 1 1
23 2919 1 1 7 GLY C C -0.330 3.614 1.113 1.00 . A A . 7 GLY C 1 1
23 2920 1 1 7 GLY CA C 1.161 3.839 1.013 1.00 . A A . 7 GLY CA 1 1
23 2921 1 1 7 GLY H H 2.016 2.733 -0.557 1.00 . A A . 7 GLY H 1 1
23 2922 1 1 7 GLY HA2 H 1.652 3.156 1.686 1.00 . A A . 7 GLY HA2 1 1
23 2923 1 1 7 GLY HA3 H 1.388 4.847 1.307 1.00 . A A . 7 GLY HA3 1 1
23 2924 1 1 7 GLY N N 1.675 3.614 -0.319 1.00 . A A . 7 GLY N 1 1
23 2925 1 1 7 GLY O O -1.014 4.249 1.917 1.00 . A A . 7 GLY O 1 1
23 2926 1 1 8 THR C C -2.366 0.889 0.576 1.00 . A A . 8 THR C 1 1
23 2927 1 1 8 THR CA C -2.204 2.365 0.257 1.00 . A A . 8 THR CA 1 1
23 2928 1 1 8 THR CB C -2.735 2.707 -1.133 1.00 . A A . 8 THR CB 1 1
23 2929 1 1 8 THR CG2 C -4.174 3.121 -1.116 1.00 . A A . 8 THR CG2 1 1
23 2930 1 1 8 THR H H -0.253 2.241 -0.314 1.00 . A A . 8 THR H 1 1
23 2931 1 1 8 THR HA H -2.728 2.936 0.986 1.00 . A A . 8 THR HA 1 1
23 2932 1 1 8 THR HB H -2.639 1.843 -1.772 1.00 . A A . 8 THR HB 1 1
23 2933 1 1 8 THR HG1 H -2.147 4.574 -1.208 1.00 . A A . 8 THR HG1 1 1
23 2934 1 1 8 THR HG21 H -4.236 4.189 -1.244 1.00 . A A . 8 THR HG21 1 1
23 2935 1 1 8 THR HG22 H -4.607 2.846 -0.170 1.00 . A A . 8 THR HG22 1 1
23 2936 1 1 8 THR HG23 H -4.697 2.626 -1.915 1.00 . A A . 8 THR HG23 1 1
23 2937 1 1 8 THR N N -0.828 2.704 0.295 1.00 . A A . 8 THR N 1 1
23 2938 1 1 8 THR O O -1.722 0.354 1.478 1.00 . A A . 8 THR O 1 1
23 2939 1 1 8 THR OG1 O -1.993 3.768 -1.706 1.00 . A A . 8 THR OG1 1 1
23 2940 1 1 9 PHE C C -3.570 -1.874 -1.344 1.00 . A A . 9 PHE C 1 1
23 2941 1 1 9 PHE CA C -3.504 -1.161 -0.007 1.00 . A A . 9 PHE CA 1 1
23 2942 1 1 9 PHE CB C -4.814 -1.318 0.722 1.00 . A A . 9 PHE CB 1 1
23 2943 1 1 9 PHE CD1 C -4.348 -2.474 2.899 1.00 . A A . 9 PHE CD1 1 1
23 2944 1 1 9 PHE CD2 C -4.869 -0.147 2.940 1.00 . A A . 9 PHE CD2 1 1
23 2945 1 1 9 PHE CE1 C -4.215 -2.472 4.273 1.00 . A A . 9 PHE CE1 1 1
23 2946 1 1 9 PHE CE2 C -4.739 -0.140 4.316 1.00 . A A . 9 PHE CE2 1 1
23 2947 1 1 9 PHE CG C -4.676 -1.313 2.217 1.00 . A A . 9 PHE CG 1 1
23 2948 1 1 9 PHE CZ C -4.410 -1.303 4.983 1.00 . A A . 9 PHE CZ 1 1
23 2949 1 1 9 PHE H H -3.682 0.744 -0.847 1.00 . A A . 9 PHE H 1 1
23 2950 1 1 9 PHE HA H -2.716 -1.579 0.564 1.00 . A A . 9 PHE HA 1 1
23 2951 1 1 9 PHE HB2 H -5.450 -0.496 0.436 1.00 . A A . 9 PHE HB2 1 1
23 2952 1 1 9 PHE HB3 H -5.272 -2.242 0.424 1.00 . A A . 9 PHE HB3 1 1
23 2953 1 1 9 PHE HD1 H -4.195 -3.389 2.345 1.00 . A A . 9 PHE HD1 1 1
23 2954 1 1 9 PHE HD2 H -5.125 0.763 2.417 1.00 . A A . 9 PHE HD2 1 1
23 2955 1 1 9 PHE HE1 H -3.958 -3.384 4.793 1.00 . A A . 9 PHE HE1 1 1
23 2956 1 1 9 PHE HE2 H -4.892 0.776 4.868 1.00 . A A . 9 PHE HE2 1 1
23 2957 1 1 9 PHE HZ H -4.308 -1.300 6.059 1.00 . A A . 9 PHE HZ 1 1
23 2958 1 1 9 PHE N N -3.224 0.249 -0.171 1.00 . A A . 9 PHE N 1 1
23 2959 1 1 9 PHE O O -3.977 -3.032 -1.439 1.00 . A A . 9 PHE O 1 1
23 2960 1 1 10 GLY C C -1.822 -2.295 -4.091 1.00 . A A . 10 GLY C 1 1
23 2961 1 1 10 GLY CA C -3.159 -1.690 -3.709 1.00 . A A . 10 GLY CA 1 1
23 2962 1 1 10 GLY H H -2.859 -0.255 -2.180 1.00 . A A . 10 GLY H 1 1
23 2963 1 1 10 GLY HA2 H -3.921 -2.450 -3.788 1.00 . A A . 10 GLY HA2 1 1
23 2964 1 1 10 GLY HA3 H -3.389 -0.891 -4.398 1.00 . A A . 10 GLY HA3 1 1
23 2965 1 1 10 GLY N N -3.162 -1.160 -2.359 1.00 . A A . 10 GLY N 1 1
23 2966 1 1 10 GLY O O -1.595 -3.482 -3.774 1.00 . A A . 10 GLY O 1 1
23 2967 1 1 10 GLY OXT O -1.001 -1.583 -4.707 1.00 . A A . 10 GLY OXT 1 1
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