NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
625104 |
6anf   |
30333 | cing | 4-filtered-FRED | STAR | entry | full | 125 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6anf
# This FRED archive file contains, for PDB entry <6anf>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.PDB_coordinate_file_version .
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_6anf
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6anf
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all other bound"
_Assembly.Molecular_mass 1624.95
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 $Capped_strapped_peptide A . 1 1
2 . 2 $3_3__dimethyl_1_1__biphenyl B . 1 1
stop_
loop_
_PDBX_nonpoly_scheme.Entity_assembly_ID
_PDBX_nonpoly_scheme.Entity_ID
_PDBX_nonpoly_scheme.Mon_ID
_PDBX_nonpoly_scheme.Comp_index_ID
_PDBX_nonpoly_scheme.Comp_ID
_PDBX_nonpoly_scheme.Entry_ID
_PDBX_nonpoly_scheme.Assembly_ID
2 2 . 1 . 1 1
stop_
save_
save_Capped_strapped_peptide
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Capped strapped peptide"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XTPRQARAARAAXCX
_Entity.Number_of_monomers 15
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . $. 1 1
2 THR . 1 1
3 PRO . 1 1
4 ARG . 1 1
5 GLN . 1 1
6 ALA . 1 1
7 ARG . 1 1
8 ALA . 1 1
9 ALA . 1 1
10 ARG . 1 1
11 ALA . 1 1
12 ALA . 1 1
13 DAL $DAL 1 1
14 CYS . 1 1
15 NH2 $NH2 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. 1 1 1 1
THR 2 2 1 1
PRO 3 3 1 1
ARG 4 4 1 1
GLN 5 5 1 1
ALA 6 6 1 1
ARG 7 7 1 1
ALA 8 8 1 1
ALA 9 9 1 1
ARG 10 10 1 1
ALA 11 11 1 1
ALA 12 12 1 1
DAL 13 13 1 1
CYS 14 14 1 1
NH2 15 15 1 1
stop_
save_
save_3_3__dimethyl_1_1__biphenyl
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "3 3 dimethyl 1 1 biphenyl"
_Entity.Type non-polymer
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . $. 1 2
stop_
save_
save_DAL
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID DAL
_Chem_comp.Type non-polymer
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 THR H . 2 . HN 1 1
1 1 2 1 1 2 THR HA . 2 . HA 1 1
2 1 1 1 1 2 THR H . 2 . HN 1 1
2 1 2 1 1 2 THR HB . 2 . HB 1 1
3 1 1 1 1 2 THR H . 2 . HN 1 1
3 1 2 1 1 2 THR MG . 2 . HG2* 1 1
4 1 1 1 1 2 THR H . 2 . HN 1 1
4 1 2 1 1 5 GLN H . 5 . HN 1 1
5 1 1 1 1 2 THR H . 2 . HN 1 1
5 1 2 1 1 5 GLN HB2 . 5 . HB2 1 1
6 1 1 1 1 2 THR H . 2 . HN 1 1
6 1 2 1 1 5 GLN HB3 . 5 . HB1 1 1
7 1 1 1 1 2 THR H . 2 . HN 1 1
7 1 2 1 1 5 GLN QG . 5 . HG* 1 1
8 1 1 1 1 2 THR HB . 2 . HB 1 1
8 1 2 1 1 4 ARG H . 4 . HN 1 1
9 1 1 1 1 2 THR MG . 2 . HG2* 1 1
9 1 2 1 1 4 ARG H . 4 . HN 1 1
10 1 1 1 1 2 THR MG . 2 . HG2* 1 1
10 1 2 1 1 5 GLN H . 5 . HN 1 1
11 1 1 1 1 2 THR MG . 2 . HG2* 1 1
11 1 2 1 1 5 GLN HE21 . 5 . HE21 1 1
12 1 1 1 1 3 PRO HA . 3 . HA 1 1
12 1 2 1 1 3 PRO QD . 3 . HD* 1 1
13 1 1 1 1 3 PRO HA . 3 . HA 1 1
13 1 2 1 1 3 PRO HG2 . 3 . HG1 1 1
14 1 1 1 1 3 PRO HA . 3 . HA 1 1
14 1 2 1 1 4 ARG H . 4 . HN 1 1
15 1 1 1 1 3 PRO HA . 3 . HA 1 1
15 1 2 1 1 6 ALA H . 6 . HN 1 1
16 1 1 1 1 3 PRO HA . 3 . HA 1 1
16 1 2 1 1 6 ALA MB . 6 . HB* 1 1
17 1 1 1 1 3 PRO HA . 3 . HA 1 1
17 1 2 1 1 7 ARG H . 7 . HN 1 1
18 1 1 1 1 3 PRO HB2 . 3 . HB1 1 1
18 1 2 1 1 3 PRO QD . 3 . HD* 1 1
19 1 1 1 1 3 PRO HB2 . 3 . HB1 1 1
19 1 2 1 1 4 ARG H . 4 . HN 1 1
20 1 1 1 1 3 PRO HB3 . 3 . HB2 1 1
20 1 2 1 1 3 PRO QD . 3 . HD* 1 1
21 1 1 1 1 3 PRO HB3 . 3 . HB2 1 1
21 1 2 1 1 4 ARG H . 4 . HN 1 1
22 1 1 1 1 3 PRO QD . 3 . HD* 1 1
22 1 2 1 1 3 PRO HG2 . 3 . HG1 1 1
23 1 1 1 1 3 PRO QD . 3 . HD* 1 1
23 1 2 1 1 3 PRO HG3 . 3 . HG2 1 1
24 1 1 1 1 3 PRO HG3 . 3 . HG2 1 1
24 1 2 1 1 4 ARG H . 4 . HN 1 1
25 1 1 1 1 4 ARG H . 4 . HN 1 1
25 1 2 1 1 4 ARG HA . 4 . HA 1 1
26 1 1 1 1 4 ARG H . 4 . HN 1 1
26 1 2 1 1 4 ARG QB . 4 . HB* 1 1
27 1 1 1 1 4 ARG H . 4 . HN 1 1
27 1 2 1 1 4 ARG HG2 . 4 . HG2 1 1
28 1 1 1 1 4 ARG H . 4 . HN 1 1
28 1 2 1 1 4 ARG HG3 . 4 . HG1 1 1
29 1 1 1 1 4 ARG H . 4 . HN 1 1
29 1 2 1 1 5 GLN H . 5 . HN 1 1
30 1 1 1 1 4 ARG HA . 4 . HA 1 1
30 1 2 1 1 4 ARG QB . 4 . HB* 1 1
31 1 1 1 1 4 ARG HA . 4 . HA 1 1
31 1 2 1 1 4 ARG HG2 . 4 . HG2 1 1
32 1 1 1 1 4 ARG HA . 4 . HA 1 1
32 1 2 1 1 4 ARG HG3 . 4 . HG1 1 1
33 1 1 1 1 4 ARG HA . 4 . HA 1 1
33 1 2 1 1 5 GLN H . 5 . HN 1 1
34 1 1 1 1 4 ARG HA . 4 . HA 1 1
34 1 2 1 1 8 ALA H . 8 . HN 1 1
35 1 1 1 1 4 ARG QB . 4 . HB* 1 1
35 1 2 1 1 5 GLN H . 5 . HN 1 1
36 1 1 1 1 4 ARG HG3 . 4 . HG1 1 1
36 1 2 1 1 5 GLN H . 5 . HN 1 1
37 1 1 1 1 5 GLN H . 5 . HN 1 1
37 1 2 1 1 5 GLN HA . 5 . HA 1 1
38 1 1 1 1 5 GLN H . 5 . HN 1 1
38 1 2 1 1 5 GLN HB2 . 5 . HB2 1 1
39 1 1 1 1 5 GLN H . 5 . HN 1 1
39 1 2 1 1 5 GLN HB3 . 5 . HB1 1 1
40 1 1 1 1 5 GLN H . 5 . HN 1 1
40 1 2 1 1 5 GLN QG . 5 . HG* 1 1
41 1 1 1 1 5 GLN HA . 5 . HA 1 1
41 1 2 1 1 5 GLN HB3 . 5 . HB1 1 1
42 1 1 1 1 5 GLN HA . 5 . HA 1 1
42 1 2 1 1 5 GLN QG . 5 . HG* 1 1
43 1 1 1 1 5 GLN HA . 5 . HA 1 1
43 1 2 1 1 6 ALA H . 6 . HN 1 1
44 1 1 1 1 5 GLN HA . 5 . HA 1 1
44 1 2 1 1 8 ALA H . 8 . HN 1 1
45 1 1 1 1 5 GLN HA . 5 . HA 1 1
45 1 2 1 1 8 ALA MB . 8 . HB* 1 1
46 1 1 1 1 5 GLN HA . 5 . HA 1 1
46 1 2 1 1 9 ALA H . 9 . HN 1 1
47 1 1 1 1 5 GLN HB2 . 5 . HB2 1 1
47 1 2 1 1 6 ALA H . 6 . HN 1 1
48 1 1 1 1 5 GLN HB3 . 5 . HB1 1 1
48 1 2 1 1 6 ALA H . 6 . HN 1 1
49 1 1 1 1 5 GLN HE21 . 5 . HE21 1 1
49 1 2 1 1 5 GLN QG . 5 . HG* 1 1
50 1 1 1 1 5 GLN HE22 . 5 . HE22 1 1
50 1 2 1 1 5 GLN QG . 5 . HG* 1 1
51 1 1 1 1 5 GLN QG . 5 . HG* 1 1
51 1 2 1 1 6 ALA H . 6 . HN 1 1
52 1 1 1 1 6 ALA H . 6 . HN 1 1
52 1 2 1 1 6 ALA HA . 6 . HA 1 1
53 1 1 1 1 6 ALA H . 6 . HN 1 1
53 1 2 1 1 6 ALA MB . 6 . HB* 1 1
54 1 1 1 1 6 ALA H . 6 . HN 1 1
54 1 2 1 1 7 ARG H . 7 . HN 1 1
55 1 1 1 1 6 ALA HA . 6 . HA 1 1
55 1 2 1 1 6 ALA MB . 6 . HB* 1 1
56 1 1 1 1 6 ALA HA . 6 . HA 1 1
56 1 2 1 1 8 ALA H . 8 . HN 1 1
57 1 1 1 1 6 ALA HA . 6 . HA 1 1
57 1 2 1 1 9 ALA H . 9 . HN 1 1
58 1 1 1 1 6 ALA HA . 6 . HA 1 1
58 1 2 1 1 9 ALA MB . 9 . HB* 1 1
59 1 1 1 1 6 ALA MB . 6 . HB* 1 1
59 1 2 1 1 7 ARG H . 7 . HN 1 1
60 1 1 1 1 7 ARG H . 7 . HN 1 1
60 1 2 1 1 7 ARG HA . 7 . HA 1 1
61 1 1 1 1 7 ARG H . 7 . HN 1 1
61 1 2 1 1 7 ARG QB . 7 . HB* 1 1
62 1 1 1 1 7 ARG H . 7 . HN 1 1
62 1 2 1 1 7 ARG QG . 7 . HG2 1 1
63 1 1 1 1 7 ARG H . 7 . HN 1 1
63 1 2 1 1 8 ALA H . 8 . HN 1 1
64 1 1 1 1 7 ARG HA . 7 . HA 1 1
64 1 2 1 1 7 ARG QG . 7 . HG2 1 1
65 1 1 1 1 7 ARG HA . 7 . HA 1 1
65 1 2 1 1 10 ARG H . 10 . HN 1 1
66 1 1 1 1 7 ARG HA . 7 . HA 1 1
66 1 2 1 1 11 ALA H . 11 . HN 1 1
67 1 1 1 1 7 ARG QB . 7 . HB* 1 1
67 1 2 1 1 7 ARG HE . 7 . HE 1 1
68 1 1 1 1 7 ARG QB . 7 . HB* 1 1
68 1 2 1 1 8 ALA H . 8 . HN 1 1
69 1 1 1 1 7 ARG QG . 7 . HG1 1 1
69 1 2 1 1 8 ALA H . 8 . HN 1 1
70 1 1 1 1 7 ARG QG . 7 . HG2 1 1
70 1 2 1 1 11 ALA H . 11 . HN 1 1
71 1 1 1 1 8 ALA H . 8 . HN 1 1
71 1 2 1 1 8 ALA HA . 8 . HA 1 1
72 1 1 1 1 8 ALA H . 8 . HN 1 1
72 1 2 1 1 8 ALA MB . 8 . HB* 1 1
73 1 1 1 1 8 ALA H . 8 . HN 1 1
73 1 2 1 1 9 ALA H . 9 . HN 1 1
74 1 1 1 1 8 ALA HA . 8 . HA 1 1
74 1 2 1 1 9 ALA H . 9 . HN 1 1
75 1 1 1 1 8 ALA MB . 8 . HB* 1 1
75 1 2 1 1 9 ALA H . 9 . HN 1 1
76 1 1 1 1 9 ALA H . 9 . HN 1 1
76 1 2 1 1 9 ALA MB . 9 . HB* 1 1
77 1 1 1 1 9 ALA H . 9 . HN 1 1
77 1 2 1 1 10 ARG H . 10 . HN 1 1
78 1 1 1 1 9 ALA HA . 9 . HA 1 1
78 1 2 1 1 12 ALA H . 12 . HN 1 1
79 1 1 1 1 9 ALA MB . 9 . HB* 1 1
79 1 2 1 1 10 ARG H . 10 . HN 1 1
80 1 1 1 1 9 ALA MB . 9 . HB* 1 1
80 1 2 1 1 14 CYS H . 14 . HN 1 1
81 1 1 1 1 9 ALA MB . 9 . HB* 1 1
81 1 2 1 1 14 CYS QB . 14 . HB* 1 1
82 1 1 1 1 10 ARG H . 10 . HN 1 1
82 1 2 1 1 10 ARG QB . 10 . HB* 1 1
83 1 1 1 1 10 ARG H . 10 . HN 1 1
83 1 2 1 1 10 ARG HG2 . 10 . HG1 1 1
84 1 1 1 1 10 ARG H . 10 . HN 1 1
84 1 2 1 1 10 ARG HG3 . 10 . HG2 1 1
85 1 1 1 1 10 ARG HA . 10 . HA 1 1
85 1 2 1 1 10 ARG QB . 10 . HB* 1 1
86 1 1 1 1 10 ARG HA . 10 . HA 1 1
86 1 2 1 1 10 ARG HG2 . 10 . HG1 1 1
87 1 1 1 1 10 ARG HA . 10 . HA 1 1
87 1 2 1 1 10 ARG HG3 . 10 . HG2 1 1
88 1 1 1 1 10 ARG HA . 10 . HA 1 1
88 1 2 1 1 11 ALA H . 11 . HN 1 1
89 1 1 1 1 10 ARG HA . 10 . HA 1 1
89 1 2 1 1 13 DAL HB1 . 13 . HB* 1 1
90 1 1 1 1 10 ARG HA . 10 . HA 1 1
90 1 2 1 1 14 CYS H . 14 . HN 1 1
91 1 1 1 1 10 ARG QB . 10 . HB* 1 1
91 1 2 1 1 10 ARG HE . 10 . HE 1 1
92 1 1 1 1 10 ARG QB . 10 . HB* 1 1
92 1 2 1 1 11 ALA H . 11 . HN 1 1
93 1 1 1 1 10 ARG HD3 . 10 . HD2 1 1
93 1 2 1 1 10 ARG HE . 10 . HE 1 1
94 1 1 1 1 11 ALA H . 11 . HN 1 1
94 1 2 1 1 11 ALA HA . 11 . HA 1 1
95 1 1 1 1 11 ALA H . 11 . HN 1 1
95 1 2 1 1 11 ALA MB . 11 . HB* 1 1
96 1 1 1 1 11 ALA H . 11 . HN 1 1
96 1 2 1 1 12 ALA H . 12 . HN 1 1
97 1 1 1 1 11 ALA HA . 11 . HA 1 1
97 1 2 1 1 11 ALA MB . 11 . HB* 1 1
98 1 1 1 1 11 ALA HA . 11 . HA 1 1
98 1 2 1 1 12 ALA H . 12 . HN 1 1
99 1 1 1 1 12 ALA H . 12 . HN 1 1
99 1 2 1 1 12 ALA HA . 12 . HA 1 1
100 1 1 1 1 12 ALA H . 12 . HN 1 1
100 1 2 1 1 12 ALA MB . 12 . HB* 1 1
101 1 1 1 1 12 ALA MB . 12 . HB* 1 1
101 1 2 1 1 14 CYS H . 14 . HN 1 1
102 1 1 1 1 13 DAL HA . 13 . HA 1 1
102 1 2 1 1 13 DAL HB1 . 13 . HB* 1 1
103 1 1 1 1 13 DAL HA . 13 . HA 1 1
103 1 2 1 1 14 CYS H . 14 . HN 1 1
104 1 1 1 1 13 DAL HB1 . 13 . HB* 1 1
104 1 2 1 1 14 CYS H . 14 . HN 1 1
105 1 1 1 1 14 CYS H . 14 . HN 1 1
105 1 2 1 1 14 CYS QB . 14 . HB* 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 . . . . . 2.93 1.8 4.06 1 1
2 1 . . . . . 3.55 1.79 5.31 1 1
3 1 . . . . . 2.58 1.8 3.36 1 1
4 1 . . . . . 3.45 1.79 5.11 1 1
5 1 . . . . . 2.63 1.79 3.47 1 1
6 1 . . . . . 3.57 1.8 5.34 1 1
7 1 . . . . . 3.25 1.8 4.7 1 1
8 1 . . . . . 3.03 1.8 4.26 1 1
9 1 . . . . . 3.55 1.8 5.3 1 1
10 1 . . . . . 3.88 1.8 5.96 1 1
11 1 . . . . . 3.65 1.79 5.51 1 1
12 1 . . . . . 3.39 1.79 4.99 1 1
13 1 . . . . . 3.0 1.8 4.2 1 1
14 1 . . . . . 3.29 1.8 4.78 1 1
15 1 . . . . . 3.27 1.8 4.74 1 1
16 1 . . . . . 2.8 1.79 3.81 1 1
17 1 . . . . . 3.68 1.8 5.56 1 1
18 1 . . . . . 2.91 1.8 4.02 1 1
19 1 . . . . . 3.44 1.8 5.08 1 1
20 1 . . . . . 2.82 1.8 3.84 1 1
21 1 . . . . . 2.84 1.79 3.89 1 1
22 1 . . . . . 2.49 1.79 3.19 1 1
23 1 . . . . . 2.44 1.8 3.08 1 1
24 1 . . . . . 3.74 1.79 5.69 1 1
25 1 . . . . . 2.67 1.8 3.54 1 1
26 1 . . . . . 2.71 1.79 3.63 1 1
27 1 . . . . . 3.15 1.79 4.51 1 1
28 1 . . . . . 2.69 1.79 3.59 1 1
29 1 . . . . . 2.79 1.79 3.79 1 1
30 1 . . . . . 2.49 1.8 3.18 1 1
31 1 . . . . . 3.02 1.8 4.24 1 1
32 1 . . . . . 2.72 1.8 3.64 1 1
33 1 . . . . . 3.43 1.79 5.07 1 1
34 1 . . . . . 3.43 1.79 5.07 1 1
35 1 . . . . . 3.02 1.8 4.24 1 1
36 1 . . . . . 2.86 1.8 3.92 1 1
37 1 . . . . . 2.9 1.8 4.0 1 1
38 1 . . . . . 2.61 1.8 3.42 1 1
39 1 . . . . . 3.18 1.79 4.57 1 1
40 1 . . . . . 2.6 1.8 3.4 1 1
41 1 . . . . . 2.89 1.79 3.99 1 1
42 1 . . . . . 2.61 1.79 3.43 1 1
43 1 . . . . . 3.56 1.79 5.33 1 1
44 1 . . . . . 2.9 1.8 4.0 1 1
45 1 . . . . . 2.69 1.79 3.59 1 1
46 1 . . . . . 3.88 1.8 5.96 1 1
47 1 . . . . . 2.91 1.8 4.02 1 1
48 1 . . . . . 3.9 1.8 6.0 1 1
49 1 . . . . . 2.78 1.79 3.77 1 1
50 1 . . . . . 2.68 1.8 3.56 1 1
51 1 . . . . . 3.9 1.8 6.0 1 1
52 1 . . . . . 2.93 1.79 4.07 1 1
53 1 . . . . . 2.55 1.8 3.3 1 1
54 1 . . . . . 2.77 1.8 3.74 1 1
55 1 . . . . . 2.43 1.79 3.07 1 1
56 1 . . . . . 3.2 1.8 4.6 1 1
57 1 . . . . . 3.13 1.8 4.46 1 1
58 1 . . . . . 2.69 1.8 3.58 1 1
59 1 . . . . . 3.55 1.8 5.3 1 1
60 1 . . . . . 2.81 1.79 3.83 1 1
61 1 . . . . . 2.71 1.79 3.63 1 1
62 1 . . . . . 3.15 1.79 4.51 1 1
63 1 . . . . . 2.72 1.79 3.65 1 1
64 1 . . . . . 2.77 1.8 3.33 1 1
65 1 . . . . . 3.7 1.8 5.6 1 1
66 1 . . . . . 3.9 1.8 6.0 1 1
67 1 . . . . . 3.08 1.79 4.37 1 1
68 1 . . . . . 3.02 1.8 4.24 1 1
69 1 . . . . . 3.25 1.79 4.71 1 1
70 1 . . . . . 3.75 1.79 5.71 1 1
71 1 . . . . . 2.84 1.8 3.88 1 1
72 1 . . . . . 2.44 1.79 3.09 1 1
73 1 . . . . . 2.69 1.8 3.58 1 1
74 1 . . . . . 3.33 1.8 4.86 1 1
75 1 . . . . . 2.68 1.8 3.56 1 1
76 1 . . . . . 2.51 1.8 3.22 1 1
77 1 . . . . . 2.84 1.79 3.89 1 1
78 1 . . . . . 3.82 1.79 5.85 1 1
79 1 . . . . . 3.05 1.79 4.31 1 1
80 1 . . . . . 3.61 1.8 5.42 1 1
81 1 . . . . . 3.33 1.79 4.87 1 1
82 1 . . . . . 2.65 1.79 3.51 1 1
83 1 . . . . . 3.13 1.8 4.46 1 1
84 1 . . . . . 3.9 1.8 6.0 1 1
85 1 . . . . . 2.51 1.79 3.23 1 1
86 1 . . . . . 3.03 1.79 4.27 1 1
87 1 . . . . . 2.81 1.79 3.83 1 1
88 1 . . . . . 3.32 1.8 4.84 1 1
89 1 . . . . . 2.95 1.79 4.11 1 1
90 1 . . . . . 3.13 1.79 4.47 1 1
91 1 . . . . . 3.08 1.79 4.37 1 1
92 1 . . . . . 2.69 1.79 3.59 1 1
93 1 . . . . . 2.94 1.8 4.08 1 1
94 1 . . . . . 2.8 1.8 3.8 1 1
95 1 . . . . . 2.47 1.8 3.14 1 1
96 1 . . . . . 2.69 1.79 3.59 1 1
97 1 . . . . . 2.41 1.79 3.03 1 1
98 1 . . . . . 3.09 1.8 4.38 1 1
99 1 . . . . . 2.83 1.79 3.87 1 1
100 1 . . . . . 2.52 1.79 3.25 1 1
101 1 . . . . . 3.18 1.8 4.56 1 1
102 1 . . . . . 2.73 1.79 3.67 1 1
103 1 . . . . . 3.36 1.79 4.93 1 1
104 1 . . . . . 2.9 1.8 4.0 1 1
105 1 . . . . . 2.61 1.8 3.42 1 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 2 THR C 1 1 3 PRO N 1 1 3 PRO CA 1 1 3 PRO C -61.229996 -49.73 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
2 . 1 1 3 PRO N 1 1 3 PRO CA 1 1 3 PRO C 1 1 4 ARG N -42.039997 -31.48 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1
3 . 1 1 3 PRO C 1 1 4 ARG N 1 1 4 ARG CA 1 1 4 ARG C -70.06 -54.36 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1
4 . 1 1 4 ARG N 1 1 4 ARG CA 1 1 4 ARG C 1 1 5 GLN N -48.81 -33.55 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1
5 . 1 1 4 ARG C 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C -69.49 -58.189995 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1
6 . 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C 1 1 6 ALA N -48.77 -23.73 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1
7 . 1 1 5 GLN C 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C -67.79 -56.009995 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
8 . 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C 1 1 7 ARG N -46.69 -34.21 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1
9 . 1 1 6 ALA C 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C -66.63 -58.189995 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
10 . 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C 1 1 8 ALA N -51.29 -31.39 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1
11 . 1 1 7 ARG C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -67.4 -58.34 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
12 . 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C 1 1 9 ALA N -43.9 -38.02 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1
13 . 1 1 8 ALA C 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C -69.27 -59.47 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1
14 . 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C 1 1 10 ARG N -44.049995 -36.11 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1
15 . 1 1 9 ALA C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -69.03 -57.27 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
16 . 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C 1 1 11 ALA N -52.47 -25.61 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1
17 . 1 1 10 ARG C 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C -69.8 -59.12 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
18 . 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C 1 1 12 ALA N -41.37 -19.709997 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1
19 . 1 1 11 ALA C 1 1 12 ALA N 1 1 12 ALA CA 1 1 12 ALA C -110.32 -69.84 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
20 . 1 1 12 ALA N 1 1 12 ALA CA 1 1 12 ALA C 1 1 13 DAL N -34.13 -1.83 . 12 . N . 12 . CA . 12 . C . 13 . N 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 . C C 3.178 -6.249 0.874 1.00 . A A . 1 H00 C 1 1
1 2 1 1 1 . CA C 2.092 -7.092 0.234 1.00 . A A . 1 H00 CA 1 1
1 3 1 1 1 . CB C 0.759 -6.852 0.924 1.00 . A A . 1 H00 CB 1 1
1 4 1 1 1 . CG C 0.000 -5.700 0.285 1.00 . A A . 1 H00 CG 1 1
1 5 1 1 1 . HA1 H 2.353 -8.137 0.325 1.00 . A A . 1 H00 HA1 1 1
1 6 1 1 1 . HA2 H 2.007 -6.832 -0.811 1.00 . A A . 1 H00 HA2 1 1
1 7 1 1 1 . HB1 H 0.940 -6.621 1.964 1.00 . A A . 1 H00 HB1 1 1
1 8 1 1 1 . HB2 H 0.159 -7.747 0.848 1.00 . A A . 1 H00 HB2 1 1
1 9 1 1 1 . HG1 H 0.570 -5.333 -0.556 1.00 . A A . 1 H00 HG1 1 1
1 10 1 1 1 . HG2 H -0.112 -4.911 1.016 1.00 . A A . 1 H00 HG2 1 1
1 11 1 1 1 . O O 3.445 -6.371 2.076 1.00 . A A . 1 H00 O 1 1
1 12 1 1 1 . SD S -1.639 -6.183 -0.293 1.00 . A A . 1 H00 SD 1 1
1 13 1 1 2 THR C C 4.262 -3.353 1.322 1.00 . A A . 2 THR C 1 1
1 14 1 1 2 THR CA C 4.865 -4.534 0.562 1.00 . A A . 2 THR CA 1 1
1 15 1 1 2 THR CB C 5.725 -4.010 -0.613 1.00 . A A . 2 THR CB 1 1
1 16 1 1 2 THR CG2 C 6.324 -5.165 -1.396 1.00 . A A . 2 THR CG2 1 1
1 17 1 1 2 THR H H 3.555 -5.348 -0.872 1.00 . A A . 2 THR H 1 1
1 18 1 1 2 THR HA H 5.496 -5.104 1.229 1.00 . A A . 2 THR HA 1 1
1 19 1 1 2 THR HB H 6.525 -3.405 -0.221 1.00 . A A . 2 THR HB 1 1
1 20 1 1 2 THR HG1 H 5.487 -2.815 -2.167 1.00 . A A . 2 THR HG1 1 1
1 21 1 1 2 THR HG21 H 6.920 -4.779 -2.209 1.00 . A A . 2 THR HG21 1 1
1 22 1 1 2 THR HG22 H 5.529 -5.778 -1.793 1.00 . A A . 2 THR HG22 1 1
1 23 1 1 2 THR HG23 H 6.945 -5.760 -0.744 1.00 . A A . 2 THR HG23 1 1
1 24 1 1 2 THR N N 3.808 -5.402 0.077 1.00 . A A . 2 THR N 1 1
1 25 1 1 2 THR O O 3.061 -3.084 1.194 1.00 . A A . 2 THR O 1 1
1 26 1 1 2 THR OG1 O 4.921 -3.211 -1.490 1.00 . A A . 2 THR OG1 1 1
1 27 1 1 3 PRO C C 3.836 -0.479 2.011 1.00 . A A . 3 PRO C 1 1
1 28 1 1 3 PRO CA C 4.600 -1.473 2.893 1.00 . A A . 3 PRO CA 1 1
1 29 1 1 3 PRO CB C 5.891 -0.827 3.437 1.00 . A A . 3 PRO CB 1 1
1 30 1 1 3 PRO CD C 6.475 -2.937 2.445 1.00 . A A . 3 PRO CD 1 1
1 31 1 1 3 PRO CG C 7.025 -1.597 2.831 1.00 . A A . 3 PRO CG 1 1
1 32 1 1 3 PRO HA H 3.969 -1.769 3.718 1.00 . A A . 3 PRO HA 1 1
1 33 1 1 3 PRO HB2 H 5.923 0.212 3.142 1.00 . A A . 3 PRO HB2 1 1
1 34 1 1 3 PRO HB3 H 5.901 -0.897 4.515 1.00 . A A . 3 PRO HB3 1 1
1 35 1 1 3 PRO HD2 H 6.991 -3.324 1.582 1.00 . A A . 3 PRO HD2 1 1
1 36 1 1 3 PRO HD3 H 6.552 -3.628 3.271 1.00 . A A . 3 PRO HD3 1 1
1 37 1 1 3 PRO HG2 H 7.394 -1.079 1.960 1.00 . A A . 3 PRO HG2 1 1
1 38 1 1 3 PRO HG3 H 7.816 -1.713 3.559 1.00 . A A . 3 PRO HG3 1 1
1 39 1 1 3 PRO N N 5.070 -2.639 2.145 1.00 . A A . 3 PRO N 1 1
1 40 1 1 3 PRO O O 2.801 0.048 2.418 1.00 . A A . 3 PRO O 1 1
1 41 1 1 4 ARG C C 2.363 0.102 -0.603 1.00 . A A . 4 ARG C 1 1
1 42 1 1 4 ARG CA C 3.666 0.689 -0.121 1.00 . A A . 4 ARG CA 1 1
1 43 1 1 4 ARG CB C 4.556 1.027 -1.312 1.00 . A A . 4 ARG CB 1 1
1 44 1 1 4 ARG CD C 6.667 2.110 -2.127 1.00 . A A . 4 ARG CD 1 1
1 45 1 1 4 ARG CG C 5.801 1.773 -0.924 1.00 . A A . 4 ARG CG 1 1
1 46 1 1 4 ARG CZ C 8.378 0.953 -3.482 1.00 . A A . 4 ARG CZ 1 1
1 47 1 1 4 ARG H H 5.166 -0.681 0.519 1.00 . A A . 4 ARG H 1 1
1 48 1 1 4 ARG HA H 3.453 1.597 0.424 1.00 . A A . 4 ARG HA 1 1
1 49 1 1 4 ARG HB2 H 4.847 0.110 -1.802 1.00 . A A . 4 ARG HB2 1 1
1 50 1 1 4 ARG HB3 H 3.995 1.636 -2.006 1.00 . A A . 4 ARG HB3 1 1
1 51 1 1 4 ARG HD2 H 6.051 2.579 -2.879 1.00 . A A . 4 ARG HD2 1 1
1 52 1 1 4 ARG HD3 H 7.439 2.799 -1.816 1.00 . A A . 4 ARG HD3 1 1
1 53 1 1 4 ARG HE H 6.887 0.055 -2.486 1.00 . A A . 4 ARG HE 1 1
1 54 1 1 4 ARG HG2 H 5.526 2.685 -0.415 1.00 . A A . 4 ARG HG2 1 1
1 55 1 1 4 ARG HG3 H 6.353 1.132 -0.256 1.00 . A A . 4 ARG HG3 1 1
1 56 1 1 4 ARG HH11 H 8.551 2.976 -3.489 1.00 . A A . 4 ARG HH11 1 1
1 57 1 1 4 ARG HH12 H 9.751 2.125 -4.401 1.00 . A A . 4 ARG HH12 1 1
1 58 1 1 4 ARG HH21 H 8.484 -1.058 -3.693 1.00 . A A . 4 ARG HH21 1 1
1 59 1 1 4 ARG HH22 H 9.709 -0.160 -4.527 1.00 . A A . 4 ARG HH22 1 1
1 60 1 1 4 ARG N N 4.337 -0.231 0.801 1.00 . A A . 4 ARG N 1 1
1 61 1 1 4 ARG NE N 7.296 0.926 -2.703 1.00 . A A . 4 ARG NE 1 1
1 62 1 1 4 ARG NH1 N 8.936 2.110 -3.815 1.00 . A A . 4 ARG NH1 1 1
1 63 1 1 4 ARG NH2 N 8.897 -0.176 -3.932 1.00 . A A . 4 ARG NH2 1 1
1 64 1 1 4 ARG O O 1.326 0.750 -0.539 1.00 . A A . 4 ARG O 1 1
1 65 1 1 5 GLN C C 0.113 -1.878 -0.528 1.00 . A A . 5 GLN C 1 1
1 66 1 1 5 GLN CA C 1.234 -1.839 -1.567 1.00 . A A . 5 GLN CA 1 1
1 67 1 1 5 GLN CB C 1.575 -3.267 -1.992 1.00 . A A . 5 GLN CB 1 1
1 68 1 1 5 GLN CD C 2.796 -4.805 -3.568 1.00 . A A . 5 GLN CD 1 1
1 69 1 1 5 GLN CG C 2.427 -3.369 -3.244 1.00 . A A . 5 GLN CG 1 1
1 70 1 1 5 GLN H H 3.297 -1.592 -1.057 1.00 . A A . 5 GLN H 1 1
1 71 1 1 5 GLN HA H 0.881 -1.296 -2.431 1.00 . A A . 5 GLN HA 1 1
1 72 1 1 5 GLN HB2 H 2.111 -3.748 -1.186 1.00 . A A . 5 GLN HB2 1 1
1 73 1 1 5 GLN HB3 H 0.652 -3.803 -2.168 1.00 . A A . 5 GLN HB3 1 1
1 74 1 1 5 GLN HE21 H 2.843 -4.379 -5.498 1.00 . A A . 5 GLN HE21 1 1
1 75 1 1 5 GLN HE22 H 3.195 -6.025 -5.074 1.00 . A A . 5 GLN HE22 1 1
1 76 1 1 5 GLN HG2 H 1.876 -2.956 -4.076 1.00 . A A . 5 GLN HG2 1 1
1 77 1 1 5 GLN HG3 H 3.335 -2.803 -3.095 1.00 . A A . 5 GLN HG3 1 1
1 78 1 1 5 GLN N N 2.422 -1.139 -1.059 1.00 . A A . 5 GLN N 1 1
1 79 1 1 5 GLN NE2 N 2.963 -5.099 -4.839 1.00 . A A . 5 GLN NE2 1 1
1 80 1 1 5 GLN O O -1.045 -1.652 -0.854 1.00 . A A . 5 GLN O 1 1
1 81 1 1 5 GLN OE1 O 2.929 -5.645 -2.672 1.00 . A A . 5 GLN OE1 1 1
1 82 1 1 6 ALA C C -1.212 -0.925 2.054 1.00 . A A . 6 ALA C 1 1
1 83 1 1 6 ALA CA C -0.521 -2.262 1.795 1.00 . A A . 6 ALA CA 1 1
1 84 1 1 6 ALA CB C 0.133 -2.776 3.070 1.00 . A A . 6 ALA CB 1 1
1 85 1 1 6 ALA H H 1.420 -2.308 0.926 1.00 . A A . 6 ALA H 1 1
1 86 1 1 6 ALA HA H -1.266 -2.980 1.488 1.00 . A A . 6 ALA HA 1 1
1 87 1 1 6 ALA HB1 H 0.622 -3.718 2.870 1.00 . A A . 6 ALA HB1 1 1
1 88 1 1 6 ALA HB2 H -0.621 -2.916 3.830 1.00 . A A . 6 ALA HB2 1 1
1 89 1 1 6 ALA HB3 H 0.863 -2.057 3.414 1.00 . A A . 6 ALA HB3 1 1
1 90 1 1 6 ALA N N 0.468 -2.160 0.722 1.00 . A A . 6 ALA N 1 1
1 91 1 1 6 ALA O O -2.433 -0.864 2.190 1.00 . A A . 6 ALA O 1 1
1 92 1 1 7 ARG C C -1.763 1.949 1.130 1.00 . A A . 7 ARG C 1 1
1 93 1 1 7 ARG CA C -0.978 1.478 2.332 1.00 . A A . 7 ARG CA 1 1
1 94 1 1 7 ARG CB C 0.136 2.459 2.664 1.00 . A A . 7 ARG CB 1 1
1 95 1 1 7 ARG CD C 2.075 2.982 4.167 1.00 . A A . 7 ARG CD 1 1
1 96 1 1 7 ARG CG C 0.848 2.116 3.949 1.00 . A A . 7 ARG CG 1 1
1 97 1 1 7 ARG CZ C 4.217 3.381 2.997 1.00 . A A . 7 ARG CZ 1 1
1 98 1 1 7 ARG H H 0.534 0.036 1.961 1.00 . A A . 7 ARG H 1 1
1 99 1 1 7 ARG HA H -1.649 1.411 3.176 1.00 . A A . 7 ARG HA 1 1
1 100 1 1 7 ARG HB2 H 0.858 2.457 1.860 1.00 . A A . 7 ARG HB2 1 1
1 101 1 1 7 ARG HB3 H -0.284 3.449 2.761 1.00 . A A . 7 ARG HB3 1 1
1 102 1 1 7 ARG HD2 H 1.808 4.015 4.004 1.00 . A A . 7 ARG HD2 1 1
1 103 1 1 7 ARG HD3 H 2.416 2.855 5.184 1.00 . A A . 7 ARG HD3 1 1
1 104 1 1 7 ARG HE H 3.076 1.738 2.820 1.00 . A A . 7 ARG HE 1 1
1 105 1 1 7 ARG HG2 H 0.168 2.239 4.779 1.00 . A A . 7 ARG HG2 1 1
1 106 1 1 7 ARG HG3 H 1.152 1.083 3.871 1.00 . A A . 7 ARG HG3 1 1
1 107 1 1 7 ARG HH11 H 3.626 4.922 4.174 1.00 . A A . 7 ARG HH11 1 1
1 108 1 1 7 ARG HH12 H 5.135 5.149 3.362 1.00 . A A . 7 ARG HH12 1 1
1 109 1 1 7 ARG HH21 H 5.086 2.048 1.743 1.00 . A A . 7 ARG HH21 1 1
1 110 1 1 7 ARG HH22 H 5.967 3.511 1.975 1.00 . A A . 7 ARG HH22 1 1
1 111 1 1 7 ARG N N -0.432 0.145 2.095 1.00 . A A . 7 ARG N 1 1
1 112 1 1 7 ARG NE N 3.156 2.620 3.254 1.00 . A A . 7 ARG NE 1 1
1 113 1 1 7 ARG NH1 N 4.335 4.576 3.554 1.00 . A A . 7 ARG NH1 1 1
1 114 1 1 7 ARG NH2 N 5.159 2.945 2.175 1.00 . A A . 7 ARG NH2 1 1
1 115 1 1 7 ARG O O -2.828 2.549 1.263 1.00 . A A . 7 ARG O 1 1
1 116 1 1 8 ALA C C -3.239 1.291 -1.400 1.00 . A A . 8 ALA C 1 1
1 117 1 1 8 ALA CA C -1.902 2.012 -1.289 1.00 . A A . 8 ALA CA 1 1
1 118 1 1 8 ALA CB C -1.018 1.678 -2.480 1.00 . A A . 8 ALA CB 1 1
1 119 1 1 8 ALA H H -0.367 1.195 -0.062 1.00 . A A . 8 ALA H 1 1
1 120 1 1 8 ALA HA H -2.078 3.078 -1.281 1.00 . A A . 8 ALA HA 1 1
1 121 1 1 8 ALA HB1 H -0.843 0.613 -2.510 1.00 . A A . 8 ALA HB1 1 1
1 122 1 1 8 ALA HB2 H -0.075 2.195 -2.385 1.00 . A A . 8 ALA HB2 1 1
1 123 1 1 8 ALA HB3 H -1.510 1.988 -3.390 1.00 . A A . 8 ALA HB3 1 1
1 124 1 1 8 ALA N N -1.238 1.658 -0.043 1.00 . A A . 8 ALA N 1 1
1 125 1 1 8 ALA O O -4.247 1.882 -1.800 1.00 . A A . 8 ALA O 1 1
1 126 1 1 9 ALA C C -5.461 -0.242 -0.052 1.00 . A A . 9 ALA C 1 1
1 127 1 1 9 ALA CA C -4.457 -0.782 -1.053 1.00 . A A . 9 ALA CA 1 1
1 128 1 1 9 ALA CB C -4.139 -2.239 -0.751 1.00 . A A . 9 ALA CB 1 1
1 129 1 1 9 ALA H H -2.402 -0.404 -0.747 1.00 . A A . 9 ALA H 1 1
1 130 1 1 9 ALA HA H -4.882 -0.723 -2.045 1.00 . A A . 9 ALA HA 1 1
1 131 1 1 9 ALA HB1 H -3.467 -2.625 -1.503 1.00 . A A . 9 ALA HB1 1 1
1 132 1 1 9 ALA HB2 H -5.051 -2.816 -0.750 1.00 . A A . 9 ALA HB2 1 1
1 133 1 1 9 ALA HB3 H -3.669 -2.308 0.219 1.00 . A A . 9 ALA HB3 1 1
1 134 1 1 9 ALA N N -3.245 0.016 -1.033 1.00 . A A . 9 ALA N 1 1
1 135 1 1 9 ALA O O -6.649 -0.145 -0.344 1.00 . A A . 9 ALA O 1 1
1 136 1 1 10 ARG C C -6.427 1.994 1.735 1.00 . A A . 10 ARG C 1 1
1 137 1 1 10 ARG CA C -5.806 0.672 2.173 1.00 . A A . 10 ARG CA 1 1
1 138 1 1 10 ARG CB C -4.977 0.878 3.435 1.00 . A A . 10 ARG CB 1 1
1 139 1 1 10 ARG CD C -4.919 1.388 5.877 1.00 . A A . 10 ARG CD 1 1
1 140 1 1 10 ARG CG C -5.785 1.312 4.637 1.00 . A A . 10 ARG CG 1 1
1 141 1 1 10 ARG CZ C -3.344 -0.088 7.090 1.00 . A A . 10 ARG CZ 1 1
1 142 1 1 10 ARG H H -4.012 0.006 1.299 1.00 . A A . 10 ARG H 1 1
1 143 1 1 10 ARG HA H -6.593 -0.036 2.382 1.00 . A A . 10 ARG HA 1 1
1 144 1 1 10 ARG HB2 H -4.479 -0.048 3.680 1.00 . A A . 10 ARG HB2 1 1
1 145 1 1 10 ARG HB3 H -4.231 1.634 3.239 1.00 . A A . 10 ARG HB3 1 1
1 146 1 1 10 ARG HD2 H -4.141 2.118 5.713 1.00 . A A . 10 ARG HD2 1 1
1 147 1 1 10 ARG HD3 H -5.531 1.692 6.713 1.00 . A A . 10 ARG HD3 1 1
1 148 1 1 10 ARG HE H -4.631 -0.683 5.675 1.00 . A A . 10 ARG HE 1 1
1 149 1 1 10 ARG HG2 H -6.214 2.285 4.443 1.00 . A A . 10 ARG HG2 1 1
1 150 1 1 10 ARG HG3 H -6.571 0.591 4.797 1.00 . A A . 10 ARG HG3 1 1
1 151 1 1 10 ARG HH11 H -3.235 1.863 7.640 1.00 . A A . 10 ARG HH11 1 1
1 152 1 1 10 ARG HH12 H -2.154 0.807 8.478 1.00 . A A . 10 ARG HH12 1 1
1 153 1 1 10 ARG HH21 H -3.205 -2.082 6.771 1.00 . A A . 10 ARG HH21 1 1
1 154 1 1 10 ARG HH22 H -2.135 -1.453 7.970 1.00 . A A . 10 ARG HH22 1 1
1 155 1 1 10 ARG N N -4.971 0.123 1.123 1.00 . A A . 10 ARG N 1 1
1 156 1 1 10 ARG NE N -4.302 0.096 6.183 1.00 . A A . 10 ARG NE 1 1
1 157 1 1 10 ARG NH1 N -2.874 0.941 7.790 1.00 . A A . 10 ARG NH1 1 1
1 158 1 1 10 ARG NH2 N -2.857 -1.299 7.294 1.00 . A A . 10 ARG NH2 1 1
1 159 1 1 10 ARG O O -7.600 2.254 1.990 1.00 . A A . 10 ARG O 1 1
1 160 1 1 11 ALA C C -7.174 3.946 -0.488 1.00 . A A . 11 ALA C 1 1
1 161 1 1 11 ALA CA C -6.098 4.110 0.584 1.00 . A A . 11 ALA CA 1 1
1 162 1 1 11 ALA CB C -4.930 4.925 0.047 1.00 . A A . 11 ALA CB 1 1
1 163 1 1 11 ALA H H -4.698 2.556 0.905 1.00 . A A . 11 ALA H 1 1
1 164 1 1 11 ALA HA H -6.522 4.642 1.423 1.00 . A A . 11 ALA HA 1 1
1 165 1 1 11 ALA HB1 H -4.505 4.424 -0.810 1.00 . A A . 11 ALA HB1 1 1
1 166 1 1 11 ALA HB2 H -4.178 5.025 0.815 1.00 . A A . 11 ALA HB2 1 1
1 167 1 1 11 ALA HB3 H -5.279 5.904 -0.244 1.00 . A A . 11 ALA HB3 1 1
1 168 1 1 11 ALA N N -5.633 2.819 1.067 1.00 . A A . 11 ALA N 1 1
1 169 1 1 11 ALA O O -8.078 4.774 -0.604 1.00 . A A . 11 ALA O 1 1
1 170 1 1 12 ALA C C -9.277 1.896 -1.768 1.00 . A A . 12 ALA C 1 1
1 171 1 1 12 ALA CA C -8.047 2.616 -2.315 1.00 . A A . 12 ALA CA 1 1
1 172 1 1 12 ALA CB C -7.407 1.807 -3.432 1.00 . A A . 12 ALA CB 1 1
1 173 1 1 12 ALA H H -6.336 2.250 -1.122 1.00 . A A . 12 ALA H 1 1
1 174 1 1 12 ALA HA H -8.356 3.569 -2.721 1.00 . A A . 12 ALA HA 1 1
1 175 1 1 12 ALA HB1 H -6.536 2.328 -3.801 1.00 . A A . 12 ALA HB1 1 1
1 176 1 1 12 ALA HB2 H -8.116 1.679 -4.236 1.00 . A A . 12 ALA HB2 1 1
1 177 1 1 12 ALA HB3 H -7.113 0.839 -3.053 1.00 . A A . 12 ALA HB3 1 1
1 178 1 1 12 ALA N N -7.079 2.876 -1.261 1.00 . A A . 12 ALA N 1 1
1 179 1 1 12 ALA O O -10.405 2.187 -2.161 1.00 . A A . 12 ALA O 1 1
1 180 1 1 13 DAL C C -10.053 -1.257 -0.598 1.00 . A A . 13 DAL C 1 1
1 181 1 1 13 DAL CA C -10.149 0.223 -0.247 1.00 . A A . 13 DAL CA 1 1
1 182 1 1 13 DAL CB C -10.159 0.408 1.261 1.00 . A A . 13 DAL CB 1 1
1 183 1 1 13 DAL H H -8.137 0.805 -0.550 1.00 . A A . 13 DAL H 1 1
1 184 1 1 13 DAL HA H -11.076 0.614 -0.639 1.00 . A A . 13 DAL HA 1 1
1 185 1 1 13 DAL HB1 H -11.005 -0.114 1.682 1.00 . A A . 13 DAL HB1 1 1
1 186 1 1 13 DAL HB2 H -10.231 1.460 1.494 1.00 . A A . 13 DAL HB2 1 1
1 187 1 1 13 DAL HB3 H -9.246 0.009 1.678 1.00 . A A . 13 DAL HB3 1 1
1 188 1 1 13 DAL N N -9.059 0.980 -0.843 1.00 . A A . 13 DAL N 1 1
1 189 1 1 13 DAL O O -11.047 -1.979 -0.563 1.00 . A A . 13 DAL O 1 1
1 190 1 1 14 CYS C C -8.250 -3.896 -0.035 1.00 . A A . 14 CYS C 1 1
1 191 1 1 14 CYS CA C -8.642 -3.099 -1.277 1.00 . A A . 14 CYS CA 1 1
1 192 1 1 14 CYS CB C -7.568 -3.226 -2.360 1.00 . A A . 14 CYS CB 1 1
1 193 1 1 14 CYS H H -8.097 -1.085 -0.961 1.00 . A A . 14 CYS H 1 1
1 194 1 1 14 CYS HA H -9.572 -3.491 -1.658 1.00 . A A . 14 CYS HA 1 1
1 195 1 1 14 CYS HB2 H -6.627 -3.467 -1.890 1.00 . A A . 14 CYS HB2 1 1
1 196 1 1 14 CYS HB3 H -7.841 -4.031 -3.026 1.00 . A A . 14 CYS HB3 1 1
1 197 1 1 14 CYS N N -8.860 -1.705 -0.938 1.00 . A A . 14 CYS N 1 1
1 198 1 1 14 CYS O O -7.065 -4.040 0.282 1.00 . A A . 14 CYS O 1 1
1 199 1 1 14 CYS SG S -7.340 -1.729 -3.348 1.00 . A A . 14 CYS SG 1 1
1 200 1 1 15 NH2 HN1 H -10.072 -3.874 0.719 1.00 . A A . 15 NH2 HN1 1 1
1 201 1 1 15 NH2 HN2 H -9.211 -5.354 0.885 1.00 . A A . 15 NH2 HN2 1 1
1 202 1 1 15 NH2 N N -9.243 -4.397 0.677 1.00 . A A . 15 NH2 N 1 1
1 203 2 2 1 . CB1 C -1.203 -7.217 -1.709 1.00 . B A . 101 B0I CB1 1 1
1 204 2 2 1 . CB2 C -6.467 -2.395 -4.782 1.00 . B A . 101 B0I CB2 1 1
1 205 2 2 1 . CD1 C -2.028 -5.319 -3.116 1.00 . B A . 101 B0I CD1 1 1
1 206 2 2 1 . CD2 C -0.712 -7.006 -4.158 1.00 . B A . 101 B0I CD2 1 1
1 207 2 2 1 . CD3 C -4.233 -3.514 -4.543 1.00 . B A . 101 B0I CD3 1 1
1 208 2 2 1 . CD4 C -4.307 -1.131 -4.583 1.00 . B A . 101 B0I CD4 1 1
1 209 2 2 1 . CE1 C -2.136 -4.652 -4.323 1.00 . B A . 101 B0I CE1 1 1
1 210 2 2 1 . CE2 C -0.815 -6.348 -5.367 1.00 . B A . 101 B0I CE2 1 1
1 211 2 2 1 . CE3 C -2.857 -3.473 -4.406 1.00 . B A . 101 B0I CE3 1 1
1 212 2 2 1 . CE4 C -2.931 -1.083 -4.446 1.00 . B A . 101 B0I CE4 1 1
1 213 2 2 1 . CG1 C -1.317 -6.498 -3.020 1.00 . B A . 101 B0I CG1 1 1
1 214 2 2 1 . CG2 C -4.972 -2.345 -4.632 1.00 . B A . 101 B0I CG2 1 1
1 215 2 2 1 . CZ1 C -1.527 -5.169 -5.450 1.00 . B A . 101 B0I CZ1 1 1
1 216 2 2 1 . CZ2 C -2.205 -2.255 -4.357 1.00 . B A . 101 B0I CZ2 1 1
1 217 2 2 1 . H1 H -0.182 -7.540 -1.599 1.00 . B A . 101 B0I H1 1 1
1 218 2 2 1 . H2 H -6.761 -3.425 -4.923 1.00 . B A . 101 B0I H2 1 1
1 219 2 2 1 . HB11 H -1.856 -8.077 -1.731 1.00 . B A . 101 B0I HB11 1 1
1 220 2 2 1 . HB21 H -6.740 -1.819 -5.653 1.00 . B A . 101 B0I HB21 1 1
1 221 2 2 1 . HD1 H -2.497 -4.923 -2.230 1.00 . B A . 101 B0I HD1 1 1
1 222 2 2 1 . HD2 H -0.155 -7.928 -4.094 1.00 . B A . 101 B0I HD2 1 1
1 223 2 2 1 . HD3 H -4.741 -4.466 -4.580 1.00 . B A . 101 B0I HD3 1 1
1 224 2 2 1 . HD4 H -4.872 -0.214 -4.652 1.00 . B A . 101 B0I HD4 1 1
1 225 2 2 1 . HE2 H -0.338 -6.755 -6.247 1.00 . B A . 101 B0I HE2 1 1
1 226 2 2 1 . HE4 H -2.426 -0.129 -4.408 1.00 . B A . 101 B0I HE4 1 1
1 227 2 2 1 . HZ1 H -1.609 -4.653 -6.395 1.00 . B A . 101 B0I HZ1 1 1
1 228 2 2 1 . HZ2 H -1.131 -2.221 -4.250 1.00 . B A . 101 B0I HZ2 1 1
2 229 1 1 1 . C C 5.943 -2.565 5.165 1.00 . A A . 1 H00 C 1 1
2 230 1 1 1 . CA C 5.130 -3.794 5.524 1.00 . A A . 1 H00 CA 1 1
2 231 1 1 1 . CB C 3.739 -3.387 5.997 1.00 . A A . 1 H00 CB 1 1
2 232 1 1 1 . CG C 2.893 -2.859 4.845 1.00 . A A . 1 H00 CG 1 1
2 233 1 1 1 . HA1 H 5.629 -4.334 6.316 1.00 . A A . 1 H00 HA1 1 1
2 234 1 1 1 . HA2 H 5.040 -4.429 4.653 1.00 . A A . 1 H00 HA2 1 1
2 235 1 1 1 . HB1 H 3.838 -2.613 6.744 1.00 . A A . 1 H00 HB1 1 1
2 236 1 1 1 . HB2 H 3.248 -4.247 6.429 1.00 . A A . 1 H00 HB2 1 1
2 237 1 1 1 . HG1 H 3.453 -2.970 3.928 1.00 . A A . 1 H00 HG1 1 1
2 238 1 1 1 . HG2 H 2.689 -1.812 5.017 1.00 . A A . 1 H00 HG2 1 1
2 239 1 1 1 . O O 6.198 -1.712 6.015 1.00 . A A . 1 H00 O 1 1
2 240 1 1 1 . SD S 1.317 -3.728 4.671 1.00 . A A . 1 H00 SD 1 1
2 241 1 1 2 THR C C 6.177 -0.157 3.196 1.00 . A A . 2 THR C 1 1
2 242 1 1 2 THR CA C 7.116 -1.335 3.444 1.00 . A A . 2 THR CA 1 1
2 243 1 1 2 THR CB C 7.860 -1.676 2.127 1.00 . A A . 2 THR CB 1 1
2 244 1 1 2 THR CG2 C 8.749 -2.894 2.313 1.00 . A A . 2 THR CG2 1 1
2 245 1 1 2 THR H H 6.124 -3.186 3.274 1.00 . A A . 2 THR H 1 1
2 246 1 1 2 THR HA H 7.840 -1.069 4.200 1.00 . A A . 2 THR HA 1 1
2 247 1 1 2 THR HB H 8.473 -0.836 1.839 1.00 . A A . 2 THR HB 1 1
2 248 1 1 2 THR HG1 H 7.270 -2.629 0.504 1.00 . A A . 2 THR HG1 1 1
2 249 1 1 2 THR HG21 H 8.141 -3.743 2.589 1.00 . A A . 2 THR HG21 1 1
2 250 1 1 2 THR HG22 H 9.470 -2.700 3.092 1.00 . A A . 2 THR HG22 1 1
2 251 1 1 2 THR HG23 H 9.266 -3.107 1.391 1.00 . A A . 2 THR HG23 1 1
2 252 1 1 2 THR N N 6.349 -2.472 3.912 1.00 . A A . 2 THR N 1 1
2 253 1 1 2 THR O O 4.968 -0.354 3.067 1.00 . A A . 2 THR O 1 1
2 254 1 1 2 THR OG1 O 6.913 -1.943 1.085 1.00 . A A . 2 THR OG1 1 1
2 255 1 1 3 PRO C C 5.142 2.105 1.518 1.00 . A A . 3 PRO C 1 1
2 256 1 1 3 PRO CA C 5.882 2.269 2.846 1.00 . A A . 3 PRO CA 1 1
2 257 1 1 3 PRO CB C 6.911 3.414 2.752 1.00 . A A . 3 PRO CB 1 1
2 258 1 1 3 PRO CD C 8.100 1.446 3.395 1.00 . A A . 3 PRO CD 1 1
2 259 1 1 3 PRO CG C 8.239 2.737 2.651 1.00 . A A . 3 PRO CG 1 1
2 260 1 1 3 PRO HA H 5.171 2.471 3.634 1.00 . A A . 3 PRO HA 1 1
2 261 1 1 3 PRO HB2 H 6.705 4.012 1.875 1.00 . A A . 3 PRO HB2 1 1
2 262 1 1 3 PRO HB3 H 6.849 4.029 3.637 1.00 . A A . 3 PRO HB3 1 1
2 263 1 1 3 PRO HD2 H 8.774 0.704 2.998 1.00 . A A . 3 PRO HD2 1 1
2 264 1 1 3 PRO HD3 H 8.276 1.596 4.450 1.00 . A A . 3 PRO HD3 1 1
2 265 1 1 3 PRO HG2 H 8.475 2.548 1.614 1.00 . A A . 3 PRO HG2 1 1
2 266 1 1 3 PRO HG3 H 9.002 3.352 3.104 1.00 . A A . 3 PRO HG3 1 1
2 267 1 1 3 PRO N N 6.700 1.086 3.145 1.00 . A A . 3 PRO N 1 1
2 268 1 1 3 PRO O O 4.017 2.584 1.350 1.00 . A A . 3 PRO O 1 1
2 269 1 1 4 ARG C C 4.006 0.200 -0.568 1.00 . A A . 4 ARG C 1 1
2 270 1 1 4 ARG CA C 5.200 1.128 -0.718 1.00 . A A . 4 ARG CA 1 1
2 271 1 1 4 ARG CB C 6.239 0.476 -1.626 1.00 . A A . 4 ARG CB 1 1
2 272 1 1 4 ARG CD C 8.526 0.543 -2.628 1.00 . A A . 4 ARG CD 1 1
2 273 1 1 4 ARG CG C 7.519 1.274 -1.764 1.00 . A A . 4 ARG CG 1 1
2 274 1 1 4 ARG CZ C 10.807 0.871 -3.517 1.00 . A A . 4 ARG CZ 1 1
2 275 1 1 4 ARG H H 6.672 1.056 0.795 1.00 . A A . 4 ARG H 1 1
2 276 1 1 4 ARG HA H 4.879 2.061 -1.154 1.00 . A A . 4 ARG HA 1 1
2 277 1 1 4 ARG HB2 H 6.488 -0.496 -1.227 1.00 . A A . 4 ARG HB2 1 1
2 278 1 1 4 ARG HB3 H 5.811 0.351 -2.610 1.00 . A A . 4 ARG HB3 1 1
2 279 1 1 4 ARG HD2 H 8.798 -0.378 -2.134 1.00 . A A . 4 ARG HD2 1 1
2 280 1 1 4 ARG HD3 H 8.069 0.318 -3.580 1.00 . A A . 4 ARG HD3 1 1
2 281 1 1 4 ARG HE H 9.747 2.249 -2.510 1.00 . A A . 4 ARG HE 1 1
2 282 1 1 4 ARG HG2 H 7.296 2.231 -2.211 1.00 . A A . 4 ARG HG2 1 1
2 283 1 1 4 ARG HG3 H 7.937 1.417 -0.778 1.00 . A A . 4 ARG HG3 1 1
2 284 1 1 4 ARG HH11 H 10.047 -0.990 -3.819 1.00 . A A . 4 ARG HH11 1 1
2 285 1 1 4 ARG HH12 H 11.626 -0.730 -4.467 1.00 . A A . 4 ARG HH12 1 1
2 286 1 1 4 ARG HH21 H 11.854 2.604 -3.373 1.00 . A A . 4 ARG HH21 1 1
2 287 1 1 4 ARG HH22 H 12.655 1.322 -4.215 1.00 . A A . 4 ARG HH22 1 1
2 288 1 1 4 ARG N N 5.780 1.402 0.588 1.00 . A A . 4 ARG N 1 1
2 289 1 1 4 ARG NE N 9.739 1.328 -2.857 1.00 . A A . 4 ARG NE 1 1
2 290 1 1 4 ARG NH1 N 10.829 -0.378 -3.969 1.00 . A A . 4 ARG NH1 1 1
2 291 1 1 4 ARG NH2 N 11.855 1.660 -3.716 1.00 . A A . 4 ARG NH2 1 1
2 292 1 1 4 ARG O O 2.921 0.466 -1.098 1.00 . A A . 4 ARG O 1 1
2 293 1 1 5 GLN C C 2.033 -1.234 1.229 1.00 . A A . 5 GLN C 1 1
2 294 1 1 5 GLN CA C 3.162 -1.860 0.426 1.00 . A A . 5 GLN CA 1 1
2 295 1 1 5 GLN CB C 3.723 -3.074 1.167 1.00 . A A . 5 GLN CB 1 1
2 296 1 1 5 GLN CD C 5.366 -4.989 1.143 1.00 . A A . 5 GLN CD 1 1
2 297 1 1 5 GLN CG C 4.633 -3.947 0.321 1.00 . A A . 5 GLN CG 1 1
2 298 1 1 5 GLN H H 5.109 -1.032 0.553 1.00 . A A . 5 GLN H 1 1
2 299 1 1 5 GLN HA H 2.772 -2.181 -0.528 1.00 . A A . 5 GLN HA 1 1
2 300 1 1 5 GLN HB2 H 4.290 -2.727 2.018 1.00 . A A . 5 GLN HB2 1 1
2 301 1 1 5 GLN HB3 H 2.898 -3.680 1.514 1.00 . A A . 5 GLN HB3 1 1
2 302 1 1 5 GLN HE21 H 5.373 -6.237 -0.396 1.00 . A A . 5 GLN HE21 1 1
2 303 1 1 5 GLN HE22 H 6.125 -6.817 1.052 1.00 . A A . 5 GLN HE22 1 1
2 304 1 1 5 GLN HG2 H 4.037 -4.454 -0.423 1.00 . A A . 5 GLN HG2 1 1
2 305 1 1 5 GLN HG3 H 5.361 -3.317 -0.168 1.00 . A A . 5 GLN HG3 1 1
2 306 1 1 5 GLN N N 4.214 -0.885 0.169 1.00 . A A . 5 GLN N 1 1
2 307 1 1 5 GLN NE2 N 5.650 -6.126 0.541 1.00 . A A . 5 GLN NE2 1 1
2 308 1 1 5 GLN O O 0.873 -1.509 0.983 1.00 . A A . 5 GLN O 1 1
2 309 1 1 5 GLN OE1 O 5.673 -4.769 2.317 1.00 . A A . 5 GLN OE1 1 1
2 310 1 1 6 ALA C C 0.498 1.184 2.159 1.00 . A A . 6 ALA C 1 1
2 311 1 1 6 ALA CA C 1.406 0.308 3.014 1.00 . A A . 6 ALA CA 1 1
2 312 1 1 6 ALA CB C 2.101 1.144 4.079 1.00 . A A . 6 ALA CB 1 1
2 313 1 1 6 ALA H H 3.348 -0.219 2.344 1.00 . A A . 6 ALA H 1 1
2 314 1 1 6 ALA HA H 0.804 -0.442 3.507 1.00 . A A . 6 ALA HA 1 1
2 315 1 1 6 ALA HB1 H 1.360 1.610 4.712 1.00 . A A . 6 ALA HB1 1 1
2 316 1 1 6 ALA HB2 H 2.699 1.908 3.604 1.00 . A A . 6 ALA HB2 1 1
2 317 1 1 6 ALA HB3 H 2.738 0.509 4.677 1.00 . A A . 6 ALA HB3 1 1
2 318 1 1 6 ALA N N 2.390 -0.381 2.185 1.00 . A A . 6 ALA N 1 1
2 319 1 1 6 ALA O O -0.714 1.241 2.374 1.00 . A A . 6 ALA O 1 1
2 320 1 1 7 ARG C C -0.594 1.859 -0.584 1.00 . A A . 7 ARG C 1 1
2 321 1 1 7 ARG CA C 0.352 2.698 0.274 1.00 . A A . 7 ARG CA 1 1
2 322 1 1 7 ARG CB C 1.333 3.490 -0.600 1.00 . A A . 7 ARG CB 1 1
2 323 1 1 7 ARG CD C -0.375 5.104 -1.485 1.00 . A A . 7 ARG CD 1 1
2 324 1 1 7 ARG CG C 0.713 4.100 -1.833 1.00 . A A . 7 ARG CG 1 1
2 325 1 1 7 ARG CZ C -2.346 5.882 -2.767 1.00 . A A . 7 ARG CZ 1 1
2 326 1 1 7 ARG H H 2.056 1.771 1.048 1.00 . A A . 7 ARG H 1 1
2 327 1 1 7 ARG HA H -0.229 3.390 0.864 1.00 . A A . 7 ARG HA 1 1
2 328 1 1 7 ARG HB2 H 1.753 4.289 -0.009 1.00 . A A . 7 ARG HB2 1 1
2 329 1 1 7 ARG HB3 H 2.130 2.830 -0.911 1.00 . A A . 7 ARG HB3 1 1
2 330 1 1 7 ARG HD2 H -1.109 4.617 -0.862 1.00 . A A . 7 ARG HD2 1 1
2 331 1 1 7 ARG HD3 H 0.071 5.925 -0.942 1.00 . A A . 7 ARG HD3 1 1
2 332 1 1 7 ARG HE H -0.460 5.807 -3.460 1.00 . A A . 7 ARG HE 1 1
2 333 1 1 7 ARG HG2 H 1.481 4.592 -2.411 1.00 . A A . 7 ARG HG2 1 1
2 334 1 1 7 ARG HG3 H 0.283 3.293 -2.403 1.00 . A A . 7 ARG HG3 1 1
2 335 1 1 7 ARG HH11 H -2.772 5.250 -0.885 1.00 . A A . 7 ARG HH11 1 1
2 336 1 1 7 ARG HH12 H -4.128 5.824 -1.787 1.00 . A A . 7 ARG HH12 1 1
2 337 1 1 7 ARG HH21 H -2.260 6.569 -4.675 1.00 . A A . 7 ARG HH21 1 1
2 338 1 1 7 ARG HH22 H -3.834 6.578 -3.966 1.00 . A A . 7 ARG HH22 1 1
2 339 1 1 7 ARG N N 1.089 1.852 1.178 1.00 . A A . 7 ARG N 1 1
2 340 1 1 7 ARG NE N -1.036 5.629 -2.681 1.00 . A A . 7 ARG NE 1 1
2 341 1 1 7 ARG NH1 N -3.144 5.630 -1.735 1.00 . A A . 7 ARG NH1 1 1
2 342 1 1 7 ARG NH2 N -2.854 6.381 -3.887 1.00 . A A . 7 ARG NH2 1 1
2 343 1 1 7 ARG O O -1.780 2.181 -0.717 1.00 . A A . 7 ARG O 1 1
2 344 1 1 8 ALA C C -1.948 -0.795 -1.151 1.00 . A A . 8 ALA C 1 1
2 345 1 1 8 ALA CA C -0.857 -0.116 -1.973 1.00 . A A . 8 ALA CA 1 1
2 346 1 1 8 ALA CB C 0.040 -1.151 -2.633 1.00 . A A . 8 ALA CB 1 1
2 347 1 1 8 ALA H H 0.880 0.574 -0.985 1.00 . A A . 8 ALA H 1 1
2 348 1 1 8 ALA HA H -1.322 0.477 -2.748 1.00 . A A . 8 ALA HA 1 1
2 349 1 1 8 ALA HB1 H 0.808 -0.650 -3.205 1.00 . A A . 8 ALA HB1 1 1
2 350 1 1 8 ALA HB2 H -0.550 -1.772 -3.291 1.00 . A A . 8 ALA HB2 1 1
2 351 1 1 8 ALA HB3 H 0.500 -1.765 -1.874 1.00 . A A . 8 ALA HB3 1 1
2 352 1 1 8 ALA N N -0.069 0.777 -1.140 1.00 . A A . 8 ALA N 1 1
2 353 1 1 8 ALA O O -3.065 -0.996 -1.627 1.00 . A A . 8 ALA O 1 1
2 354 1 1 9 ALA C C -3.767 -0.875 1.238 1.00 . A A . 9 ALA C 1 1
2 355 1 1 9 ALA CA C -2.559 -1.762 1.001 1.00 . A A . 9 ALA CA 1 1
2 356 1 1 9 ALA CB C -1.883 -2.097 2.324 1.00 . A A . 9 ALA CB 1 1
2 357 1 1 9 ALA H H -0.703 -0.949 0.406 1.00 . A A . 9 ALA H 1 1
2 358 1 1 9 ALA HA H -2.886 -2.685 0.545 1.00 . A A . 9 ALA HA 1 1
2 359 1 1 9 ALA HB1 H -1.028 -2.731 2.141 1.00 . A A . 9 ALA HB1 1 1
2 360 1 1 9 ALA HB2 H -2.582 -2.611 2.967 1.00 . A A . 9 ALA HB2 1 1
2 361 1 1 9 ALA HB3 H -1.558 -1.186 2.803 1.00 . A A . 9 ALA HB3 1 1
2 362 1 1 9 ALA N N -1.620 -1.126 0.093 1.00 . A A . 9 ALA N 1 1
2 363 1 1 9 ALA O O -4.902 -1.343 1.219 1.00 . A A . 9 ALA O 1 1
2 364 1 1 10 ARG C C -5.364 1.634 0.396 1.00 . A A . 10 ARG C 1 1
2 365 1 1 10 ARG CA C -4.597 1.354 1.684 1.00 . A A . 10 ARG CA 1 1
2 366 1 1 10 ARG CB C -4.057 2.650 2.282 1.00 . A A . 10 ARG CB 1 1
2 367 1 1 10 ARG CD C -2.928 3.781 4.219 1.00 . A A . 10 ARG CD 1 1
2 368 1 1 10 ARG CG C -3.385 2.460 3.631 1.00 . A A . 10 ARG CG 1 1
2 369 1 1 10 ARG CZ C -2.246 4.459 6.499 1.00 . A A . 10 ARG CZ 1 1
2 370 1 1 10 ARG H H -2.589 0.719 1.461 1.00 . A A . 10 ARG H 1 1
2 371 1 1 10 ARG HA H -5.276 0.902 2.392 1.00 . A A . 10 ARG HA 1 1
2 372 1 1 10 ARG HB2 H -3.337 3.076 1.600 1.00 . A A . 10 ARG HB2 1 1
2 373 1 1 10 ARG HB3 H -4.877 3.342 2.407 1.00 . A A . 10 ARG HB3 1 1
2 374 1 1 10 ARG HD2 H -2.272 4.269 3.513 1.00 . A A . 10 ARG HD2 1 1
2 375 1 1 10 ARG HD3 H -3.794 4.401 4.393 1.00 . A A . 10 ARG HD3 1 1
2 376 1 1 10 ARG HE H -1.673 2.777 5.570 1.00 . A A . 10 ARG HE 1 1
2 377 1 1 10 ARG HG2 H -4.086 2.000 4.311 1.00 . A A . 10 ARG HG2 1 1
2 378 1 1 10 ARG HG3 H -2.528 1.814 3.506 1.00 . A A . 10 ARG HG3 1 1
2 379 1 1 10 ARG HH11 H -3.524 5.760 5.598 1.00 . A A . 10 ARG HH11 1 1
2 380 1 1 10 ARG HH12 H -3.008 6.214 7.182 1.00 . A A . 10 ARG HH12 1 1
2 381 1 1 10 ARG HH21 H -0.991 3.374 7.663 1.00 . A A . 10 ARG HH21 1 1
2 382 1 1 10 ARG HH22 H -1.567 4.844 8.374 1.00 . A A . 10 ARG HH22 1 1
2 383 1 1 10 ARG N N -3.521 0.405 1.452 1.00 . A A . 10 ARG N 1 1
2 384 1 1 10 ARG NE N -2.214 3.596 5.483 1.00 . A A . 10 ARG NE 1 1
2 385 1 1 10 ARG NH1 N -2.983 5.562 6.420 1.00 . A A . 10 ARG NH1 1 1
2 386 1 1 10 ARG NH2 N -1.546 4.209 7.599 1.00 . A A . 10 ARG NH2 1 1
2 387 1 1 10 ARG O O -6.567 1.862 0.422 1.00 . A A . 10 ARG O 1 1
2 388 1 1 11 ALA C C -6.233 0.683 -2.379 1.00 . A A . 11 ALA C 1 1
2 389 1 1 11 ALA CA C -5.287 1.832 -2.023 1.00 . A A . 11 ALA CA 1 1
2 390 1 1 11 ALA CB C -4.227 2.006 -3.098 1.00 . A A . 11 ALA CB 1 1
2 391 1 1 11 ALA H H -3.694 1.451 -0.682 1.00 . A A . 11 ALA H 1 1
2 392 1 1 11 ALA HA H -5.861 2.746 -1.961 1.00 . A A . 11 ALA HA 1 1
2 393 1 1 11 ALA HB1 H -4.705 2.229 -4.041 1.00 . A A . 11 ALA HB1 1 1
2 394 1 1 11 ALA HB2 H -3.656 1.094 -3.191 1.00 . A A . 11 ALA HB2 1 1
2 395 1 1 11 ALA HB3 H -3.568 2.818 -2.827 1.00 . A A . 11 ALA HB3 1 1
2 396 1 1 11 ALA N N -4.661 1.612 -0.726 1.00 . A A . 11 ALA N 1 1
2 397 1 1 11 ALA O O -7.358 0.905 -2.831 1.00 . A A . 11 ALA O 1 1
2 398 1 1 12 ALA C C -7.625 -1.971 -1.394 1.00 . A A . 12 ALA C 1 1
2 399 1 1 12 ALA CA C -6.565 -1.730 -2.466 1.00 . A A . 12 ALA CA 1 1
2 400 1 1 12 ALA CB C -5.666 -2.948 -2.611 1.00 . A A . 12 ALA CB 1 1
2 401 1 1 12 ALA H H -4.857 -0.656 -1.815 1.00 . A A . 12 ALA H 1 1
2 402 1 1 12 ALA HA H -7.061 -1.563 -3.412 1.00 . A A . 12 ALA HA 1 1
2 403 1 1 12 ALA HB1 H -4.925 -2.761 -3.373 1.00 . A A . 12 ALA HB1 1 1
2 404 1 1 12 ALA HB2 H -6.262 -3.804 -2.889 1.00 . A A . 12 ALA HB2 1 1
2 405 1 1 12 ALA HB3 H -5.173 -3.143 -1.670 1.00 . A A . 12 ALA HB3 1 1
2 406 1 1 12 ALA N N -5.769 -0.544 -2.168 1.00 . A A . 12 ALA N 1 1
2 407 1 1 12 ALA O O -8.664 -2.580 -1.655 1.00 . A A . 12 ALA O 1 1
2 408 1 1 13 DAL C C -8.022 -2.924 1.696 1.00 . A A . 13 DAL C 1 1
2 409 1 1 13 DAL CA C -8.304 -1.657 0.902 1.00 . A A . 13 DAL CA 1 1
2 410 1 1 13 DAL CB C -8.264 -0.442 1.815 1.00 . A A . 13 DAL CB 1 1
2 411 1 1 13 DAL H H -6.511 -1.037 -0.034 1.00 . A A . 13 DAL H 1 1
2 412 1 1 13 DAL HA H -9.294 -1.726 0.476 1.00 . A A . 13 DAL HA 1 1
2 413 1 1 13 DAL HB1 H -7.289 -0.368 2.273 1.00 . A A . 13 DAL HB1 1 1
2 414 1 1 13 DAL HB2 H -9.017 -0.544 2.582 1.00 . A A . 13 DAL HB2 1 1
2 415 1 1 13 DAL HB3 H -8.458 0.450 1.236 1.00 . A A . 13 DAL HB3 1 1
2 416 1 1 13 DAL N N -7.361 -1.501 -0.192 1.00 . A A . 13 DAL N 1 1
2 417 1 1 13 DAL O O -8.928 -3.712 1.966 1.00 . A A . 13 DAL O 1 1
2 418 1 1 14 CYS C C -6.777 -4.054 4.305 1.00 . A A . 14 CYS C 1 1
2 419 1 1 14 CYS CA C -6.369 -4.265 2.852 1.00 . A A . 14 CYS CA 1 1
2 420 1 1 14 CYS CB C -4.855 -4.491 2.755 1.00 . A A . 14 CYS CB 1 1
2 421 1 1 14 CYS H H -6.082 -2.473 1.770 1.00 . A A . 14 CYS H 1 1
2 422 1 1 14 CYS HA H -6.882 -5.132 2.467 1.00 . A A . 14 CYS HA 1 1
2 423 1 1 14 CYS HB2 H -4.396 -3.597 2.362 1.00 . A A . 14 CYS HB2 1 1
2 424 1 1 14 CYS HB3 H -4.469 -4.673 3.748 1.00 . A A . 14 CYS HB3 1 1
2 425 1 1 14 CYS N N -6.766 -3.120 2.053 1.00 . A A . 14 CYS N 1 1
2 426 1 1 14 CYS O O -6.093 -3.358 5.061 1.00 . A A . 14 CYS O 1 1
2 427 1 1 14 CYS SG S -4.375 -5.877 1.701 1.00 . A A . 14 CYS SG 1 1
2 428 1 1 15 NH2 HN1 H -7.844 -5.423 5.244 1.00 . A A . 15 NH2 HN1 1 1
2 429 1 1 15 NH2 HN2 H -8.719 -4.379 4.192 1.00 . A A . 15 NH2 HN2 1 1
2 430 1 1 15 NH2 N N -7.906 -4.620 4.685 1.00 . A A . 15 NH2 N 1 1
2 431 2 2 1 . CB1 C 1.884 -5.434 4.504 1.00 . B A . 101 B0I CB1 1 1
2 432 2 2 1 . CB2 C -4.111 -5.037 0.128 1.00 . B A . 101 B0I CB2 1 1
2 433 2 2 1 . CD1 C 0.778 -5.483 2.268 1.00 . B A . 101 B0I CD1 1 1
2 434 2 2 1 . CD2 C 2.621 -6.938 2.645 1.00 . B A . 101 B0I CD2 1 1
2 435 2 2 1 . CD3 C -1.667 -5.501 0.537 1.00 . B A . 101 B0I CD3 1 1
2 436 2 2 1 . CD4 C -2.312 -4.529 -1.545 1.00 . B A . 101 B0I CD4 1 1
2 437 2 2 1 . CE1 C 0.654 -5.967 0.976 1.00 . B A . 101 B0I CE1 1 1
2 438 2 2 1 . CE2 C 2.508 -7.428 1.360 1.00 . B A . 101 B0I CE2 1 1
2 439 2 2 1 . CE3 C -0.340 -5.481 0.136 1.00 . B A . 101 B0I CE3 1 1
2 440 2 2 1 . CE4 C -0.993 -4.509 -1.949 1.00 . B A . 101 B0I CE4 1 1
2 441 2 2 1 . CG1 C 1.758 -5.961 3.110 1.00 . B A . 101 B0I CG1 1 1
2 442 2 2 1 . CG2 C -2.668 -5.023 -0.301 1.00 . B A . 101 B0I CG2 1 1
2 443 2 2 1 . CZ1 C 1.523 -6.942 0.523 1.00 . B A . 101 B0I CZ1 1 1
2 444 2 2 1 . CZ2 C -0.006 -4.985 -1.108 1.00 . B A . 101 B0I CZ2 1 1
2 445 2 2 1 . H1 H 2.923 -5.480 4.775 1.00 . B A . 101 B0I H1 1 1
2 446 2 2 1 . H2 H -4.685 -5.539 -0.637 1.00 . B A . 101 B0I H2 1 1
2 447 2 2 1 . HB11 H 1.307 -6.063 5.165 1.00 . B A . 101 B0I HB11 1 1
2 448 2 2 1 . HB21 H -4.449 -4.016 0.219 1.00 . B A . 101 B0I HB21 1 1
2 449 2 2 1 . HD1 H 0.111 -4.721 2.636 1.00 . B A . 101 B0I HD1 1 1
2 450 2 2 1 . HD2 H 3.392 -7.318 3.299 1.00 . B A . 101 B0I HD2 1 1
2 451 2 2 1 . HD3 H -1.929 -5.889 1.510 1.00 . B A . 101 B0I HD3 1 1
2 452 2 2 1 . HD4 H -3.082 -4.156 -2.205 1.00 . B A . 101 B0I HD4 1 1
2 453 2 2 1 . HE2 H 3.188 -8.189 1.010 1.00 . B A . 101 B0I HE2 1 1
2 454 2 2 1 . HE4 H -0.732 -4.120 -2.922 1.00 . B A . 101 B0I HE4 1 1
2 455 2 2 1 . HZ1 H 1.431 -7.324 -0.483 1.00 . B A . 101 B0I HZ1 1 1
2 456 2 2 1 . HZ2 H 1.027 -4.968 -1.423 1.00 . B A . 101 B0I HZ2 1 1
3 457 1 1 1 . C C 6.028 -2.572 5.057 1.00 . A A . 1 H00 C 1 1
3 458 1 1 1 . CA C 5.195 -3.775 5.439 1.00 . A A . 1 H00 CA 1 1
3 459 1 1 1 . CB C 3.839 -3.333 5.965 1.00 . A A . 1 H00 CB 1 1
3 460 1 1 1 . CG C 2.970 -2.780 4.848 1.00 . A A . 1 H00 CG 1 1
3 461 1 1 1 . HA1 H 5.707 -4.336 6.209 1.00 . A A . 1 H00 HA1 1 1
3 462 1 1 1 . HA2 H 5.053 -4.402 4.569 1.00 . A A . 1 H00 HA2 1 1
3 463 1 1 1 . HB1 H 3.986 -2.564 6.711 1.00 . A A . 1 H00 HB1 1 1
3 464 1 1 1 . HB2 H 3.341 -4.182 6.409 1.00 . A A . 1 H00 HB2 1 1
3 465 1 1 1 . HG1 H 3.116 -3.386 3.964 1.00 . A A . 1 H00 HG1 1 1
3 466 1 1 1 . HG2 H 3.275 -1.764 4.643 1.00 . A A . 1 H00 HG2 1 1
3 467 1 1 1 . O O 6.329 -1.725 5.900 1.00 . A A . 1 H00 O 1 1
3 468 1 1 1 . SD S 1.212 -2.779 5.262 1.00 . A A . 1 H00 SD 1 1
3 469 1 1 2 THR C C 6.290 -0.158 3.092 1.00 . A A . 2 THR C 1 1
3 470 1 1 2 THR CA C 7.194 -1.369 3.311 1.00 . A A . 2 THR CA 1 1
3 471 1 1 2 THR CB C 7.903 -1.710 1.976 1.00 . A A . 2 THR CB 1 1
3 472 1 1 2 THR CG2 C 8.743 -2.970 2.112 1.00 . A A . 2 THR CG2 1 1
3 473 1 1 2 THR H H 6.145 -3.196 3.161 1.00 . A A . 2 THR H 1 1
3 474 1 1 2 THR HA H 7.940 -1.133 4.054 1.00 . A A . 2 THR HA 1 1
3 475 1 1 2 THR HB H 8.547 -0.888 1.705 1.00 . A A . 2 THR HB 1 1
3 476 1 1 2 THR HG1 H 7.323 -2.410 0.219 1.00 . A A . 2 THR HG1 1 1
3 477 1 1 2 THR HG21 H 8.105 -3.802 2.368 1.00 . A A . 2 THR HG21 1 1
3 478 1 1 2 THR HG22 H 9.480 -2.829 2.888 1.00 . A A . 2 THR HG22 1 1
3 479 1 1 2 THR HG23 H 9.242 -3.173 1.176 1.00 . A A . 2 THR HG23 1 1
3 480 1 1 2 THR N N 6.405 -2.490 3.792 1.00 . A A . 2 THR N 1 1
3 481 1 1 2 THR O O 5.071 -0.308 2.978 1.00 . A A . 2 THR O 1 1
3 482 1 1 2 THR OG1 O 6.930 -1.901 0.941 1.00 . A A . 2 THR OG1 1 1
3 483 1 1 3 PRO C C 5.228 2.155 1.517 1.00 . A A . 3 PRO C 1 1
3 484 1 1 3 PRO CA C 6.105 2.288 2.775 1.00 . A A . 3 PRO CA 1 1
3 485 1 1 3 PRO CB C 7.201 3.325 2.549 1.00 . A A . 3 PRO CB 1 1
3 486 1 1 3 PRO CD C 8.291 1.348 3.328 1.00 . A A . 3 PRO CD 1 1
3 487 1 1 3 PRO CG C 8.342 2.850 3.378 1.00 . A A . 3 PRO CG 1 1
3 488 1 1 3 PRO HA H 5.492 2.576 3.616 1.00 . A A . 3 PRO HA 1 1
3 489 1 1 3 PRO HB2 H 7.458 3.355 1.499 1.00 . A A . 3 PRO HB2 1 1
3 490 1 1 3 PRO HB3 H 6.856 4.295 2.873 1.00 . A A . 3 PRO HB3 1 1
3 491 1 1 3 PRO HD2 H 8.922 0.976 2.537 1.00 . A A . 3 PRO HD2 1 1
3 492 1 1 3 PRO HD3 H 8.591 0.930 4.278 1.00 . A A . 3 PRO HD3 1 1
3 493 1 1 3 PRO HG2 H 9.272 3.208 2.963 1.00 . A A . 3 PRO HG2 1 1
3 494 1 1 3 PRO HG3 H 8.225 3.195 4.396 1.00 . A A . 3 PRO HG3 1 1
3 495 1 1 3 PRO N N 6.865 1.061 3.054 1.00 . A A . 3 PRO N 1 1
3 496 1 1 3 PRO O O 4.108 2.678 1.468 1.00 . A A . 3 PRO O 1 1
3 497 1 1 4 ARG C C 3.865 0.251 -0.501 1.00 . A A . 4 ARG C 1 1
3 498 1 1 4 ARG CA C 5.001 1.221 -0.734 1.00 . A A . 4 ARG CA 1 1
3 499 1 1 4 ARG CB C 5.908 0.677 -1.827 1.00 . A A . 4 ARG CB 1 1
3 500 1 1 4 ARG CD C 7.842 1.051 -3.345 1.00 . A A . 4 ARG CD 1 1
3 501 1 1 4 ARG CG C 7.061 1.579 -2.161 1.00 . A A . 4 ARG CG 1 1
3 502 1 1 4 ARG CZ C 9.661 1.796 -4.832 1.00 . A A . 4 ARG CZ 1 1
3 503 1 1 4 ARG H H 6.647 1.074 0.605 1.00 . A A . 4 ARG H 1 1
3 504 1 1 4 ARG HA H 4.592 2.167 -1.055 1.00 . A A . 4 ARG HA 1 1
3 505 1 1 4 ARG HB2 H 6.306 -0.275 -1.506 1.00 . A A . 4 ARG HB2 1 1
3 506 1 1 4 ARG HB3 H 5.323 0.528 -2.722 1.00 . A A . 4 ARG HB3 1 1
3 507 1 1 4 ARG HD2 H 8.280 0.102 -3.076 1.00 . A A . 4 ARG HD2 1 1
3 508 1 1 4 ARG HD3 H 7.163 0.913 -4.174 1.00 . A A . 4 ARG HD3 1 1
3 509 1 1 4 ARG HE H 9.059 2.752 -3.182 1.00 . A A . 4 ARG HE 1 1
3 510 1 1 4 ARG HG2 H 6.691 2.567 -2.388 1.00 . A A . 4 ARG HG2 1 1
3 511 1 1 4 ARG HG3 H 7.705 1.617 -1.298 1.00 . A A . 4 ARG HG3 1 1
3 512 1 1 4 ARG HH11 H 8.769 0.057 -5.406 1.00 . A A . 4 ARG HH11 1 1
3 513 1 1 4 ARG HH12 H 10.043 0.608 -6.440 1.00 . A A . 4 ARG HH12 1 1
3 514 1 1 4 ARG HH21 H 10.739 3.486 -4.536 1.00 . A A . 4 ARG HH21 1 1
3 515 1 1 4 ARG HH22 H 11.173 2.571 -5.938 1.00 . A A . 4 ARG HH22 1 1
3 516 1 1 4 ARG N N 5.746 1.450 0.507 1.00 . A A . 4 ARG N 1 1
3 517 1 1 4 ARG NE N 8.904 1.964 -3.752 1.00 . A A . 4 ARG NE 1 1
3 518 1 1 4 ARG NH1 N 9.479 0.739 -5.620 1.00 . A A . 4 ARG NH1 1 1
3 519 1 1 4 ARG NH2 N 10.599 2.685 -5.125 1.00 . A A . 4 ARG NH2 1 1
3 520 1 1 4 ARG O O 2.734 0.492 -0.917 1.00 . A A . 4 ARG O 1 1
3 521 1 1 5 GLN C C 2.054 -1.276 1.336 1.00 . A A . 5 GLN C 1 1
3 522 1 1 5 GLN CA C 3.164 -1.865 0.481 1.00 . A A . 5 GLN CA 1 1
3 523 1 1 5 GLN CB C 3.789 -3.064 1.189 1.00 . A A . 5 GLN CB 1 1
3 524 1 1 5 GLN CD C 5.330 -5.051 1.043 1.00 . A A . 5 GLN CD 1 1
3 525 1 1 5 GLN CG C 4.686 -3.902 0.299 1.00 . A A . 5 GLN CG 1 1
3 526 1 1 5 GLN H H 5.106 -0.985 0.458 1.00 . A A . 5 GLN H 1 1
3 527 1 1 5 GLN HA H 2.736 -2.195 -0.454 1.00 . A A . 5 GLN HA 1 1
3 528 1 1 5 GLN HB2 H 4.380 -2.706 2.020 1.00 . A A . 5 GLN HB2 1 1
3 529 1 1 5 GLN HB3 H 2.997 -3.698 1.564 1.00 . A A . 5 GLN HB3 1 1
3 530 1 1 5 GLN HE21 H 5.352 -6.134 -0.616 1.00 . A A . 5 GLN HE21 1 1
3 531 1 1 5 GLN HE22 H 6.002 -6.900 0.797 1.00 . A A . 5 GLN HE22 1 1
3 532 1 1 5 GLN HG2 H 4.094 -4.305 -0.511 1.00 . A A . 5 GLN HG2 1 1
3 533 1 1 5 GLN HG3 H 5.463 -3.270 -0.103 1.00 . A A . 5 GLN HG3 1 1
3 534 1 1 5 GLN N N 4.172 -0.851 0.170 1.00 . A A . 5 GLN N 1 1
3 535 1 1 5 GLN NE2 N 5.589 -6.136 0.340 1.00 . A A . 5 GLN NE2 1 1
3 536 1 1 5 GLN O O 0.889 -1.604 1.159 1.00 . A A . 5 GLN O 1 1
3 537 1 1 5 GLN OE1 O 5.594 -4.960 2.248 1.00 . A A . 5 GLN OE1 1 1
3 538 1 1 6 ALA C C 0.537 1.135 2.267 1.00 . A A . 6 ALA C 1 1
3 539 1 1 6 ALA CA C 1.468 0.276 3.111 1.00 . A A . 6 ALA CA 1 1
3 540 1 1 6 ALA CB C 2.189 1.128 4.142 1.00 . A A . 6 ALA CB 1 1
3 541 1 1 6 ALA H H 3.389 -0.215 2.373 1.00 . A A . 6 ALA H 1 1
3 542 1 1 6 ALA HA H 0.887 -0.475 3.628 1.00 . A A . 6 ALA HA 1 1
3 543 1 1 6 ALA HB1 H 1.466 1.605 4.784 1.00 . A A . 6 ALA HB1 1 1
3 544 1 1 6 ALA HB2 H 2.776 1.882 3.639 1.00 . A A . 6 ALA HB2 1 1
3 545 1 1 6 ALA HB3 H 2.840 0.502 4.735 1.00 . A A . 6 ALA HB3 1 1
3 546 1 1 6 ALA N N 2.430 -0.401 2.259 1.00 . A A . 6 ALA N 1 1
3 547 1 1 6 ALA O O -0.673 1.162 2.484 1.00 . A A . 6 ALA O 1 1
3 548 1 1 7 ARG C C -0.594 1.805 -0.425 1.00 . A A . 7 ARG C 1 1
3 549 1 1 7 ARG CA C 0.378 2.646 0.383 1.00 . A A . 7 ARG CA 1 1
3 550 1 1 7 ARG CB C 1.359 3.319 -0.555 1.00 . A A . 7 ARG CB 1 1
3 551 1 1 7 ARG CD C 1.707 4.975 -2.375 1.00 . A A . 7 ARG CD 1 1
3 552 1 1 7 ARG CG C 0.700 4.178 -1.567 1.00 . A A . 7 ARG CG 1 1
3 553 1 1 7 ARG CZ C 3.406 6.731 -2.005 1.00 . A A . 7 ARG CZ 1 1
3 554 1 1 7 ARG H H 2.087 1.786 1.185 1.00 . A A . 7 ARG H 1 1
3 555 1 1 7 ARG HA H -0.154 3.402 0.938 1.00 . A A . 7 ARG HA 1 1
3 556 1 1 7 ARG HB2 H 2.035 3.928 0.022 1.00 . A A . 7 ARG HB2 1 1
3 557 1 1 7 ARG HB3 H 1.927 2.557 -1.071 1.00 . A A . 7 ARG HB3 1 1
3 558 1 1 7 ARG HD2 H 2.332 4.289 -2.924 1.00 . A A . 7 ARG HD2 1 1
3 559 1 1 7 ARG HD3 H 1.171 5.605 -3.070 1.00 . A A . 7 ARG HD3 1 1
3 560 1 1 7 ARG HE H 2.489 5.692 -0.558 1.00 . A A . 7 ARG HE 1 1
3 561 1 1 7 ARG HG2 H 0.116 3.554 -2.230 1.00 . A A . 7 ARG HG2 1 1
3 562 1 1 7 ARG HG3 H 0.058 4.831 -1.020 1.00 . A A . 7 ARG HG3 1 1
3 563 1 1 7 ARG HH11 H 2.998 6.352 -3.959 1.00 . A A . 7 ARG HH11 1 1
3 564 1 1 7 ARG HH12 H 4.160 7.600 -3.678 1.00 . A A . 7 ARG HH12 1 1
3 565 1 1 7 ARG HH21 H 4.051 7.329 -0.176 1.00 . A A . 7 ARG HH21 1 1
3 566 1 1 7 ARG HH22 H 4.771 8.155 -1.513 1.00 . A A . 7 ARG HH22 1 1
3 567 1 1 7 ARG N N 1.118 1.823 1.295 1.00 . A A . 7 ARG N 1 1
3 568 1 1 7 ARG NE N 2.557 5.817 -1.531 1.00 . A A . 7 ARG NE 1 1
3 569 1 1 7 ARG NH1 N 3.533 6.906 -3.316 1.00 . A A . 7 ARG NH1 1 1
3 570 1 1 7 ARG NH2 N 4.133 7.459 -1.167 1.00 . A A . 7 ARG NH2 1 1
3 571 1 1 7 ARG O O -1.788 2.105 -0.512 1.00 . A A . 7 ARG O 1 1
3 572 1 1 8 ALA C C -1.956 -0.821 -0.948 1.00 . A A . 8 ALA C 1 1
3 573 1 1 8 ALA CA C -0.845 -0.190 -1.784 1.00 . A A . 8 ALA CA 1 1
3 574 1 1 8 ALA CB C 0.064 -1.259 -2.364 1.00 . A A . 8 ALA CB 1 1
3 575 1 1 8 ALA H H 0.901 0.619 -0.900 1.00 . A A . 8 ALA H 1 1
3 576 1 1 8 ALA HA H -1.291 0.355 -2.601 1.00 . A A . 8 ALA HA 1 1
3 577 1 1 8 ALA HB1 H 0.511 -1.827 -1.561 1.00 . A A . 8 ALA HB1 1 1
3 578 1 1 8 ALA HB2 H 0.843 -0.792 -2.950 1.00 . A A . 8 ALA HB2 1 1
3 579 1 1 8 ALA HB3 H -0.513 -1.919 -2.994 1.00 . A A . 8 ALA HB3 1 1
3 580 1 1 8 ALA N N -0.066 0.749 -0.996 1.00 . A A . 8 ALA N 1 1
3 581 1 1 8 ALA O O -3.058 -1.056 -1.443 1.00 . A A . 8 ALA O 1 1
3 582 1 1 9 ALA C C -3.837 -0.748 1.395 1.00 . A A . 9 ALA C 1 1
3 583 1 1 9 ALA CA C -2.632 -1.659 1.240 1.00 . A A . 9 ALA CA 1 1
3 584 1 1 9 ALA CB C -1.993 -1.913 2.596 1.00 . A A . 9 ALA CB 1 1
3 585 1 1 9 ALA H H -0.752 -0.892 0.646 1.00 . A A . 9 ALA H 1 1
3 586 1 1 9 ALA HA H -2.955 -2.606 0.834 1.00 . A A . 9 ALA HA 1 1
3 587 1 1 9 ALA HB1 H -1.076 -2.465 2.459 1.00 . A A . 9 ALA HB1 1 1
3 588 1 1 9 ALA HB2 H -2.670 -2.487 3.212 1.00 . A A . 9 ALA HB2 1 1
3 589 1 1 9 ALA HB3 H -1.779 -0.970 3.075 1.00 . A A . 9 ALA HB3 1 1
3 590 1 1 9 ALA N N -1.661 -1.082 0.321 1.00 . A A . 9 ALA N 1 1
3 591 1 1 9 ALA O O -4.982 -1.206 1.379 1.00 . A A . 9 ALA O 1 1
3 592 1 1 10 ARG C C -5.406 1.681 0.371 1.00 . A A . 10 ARG C 1 1
3 593 1 1 10 ARG CA C -4.632 1.528 1.679 1.00 . A A . 10 ARG CA 1 1
3 594 1 1 10 ARG CB C -4.048 2.878 2.114 1.00 . A A . 10 ARG CB 1 1
3 595 1 1 10 ARG CD C -2.704 4.163 3.826 1.00 . A A . 10 ARG CD 1 1
3 596 1 1 10 ARG CG C -3.232 2.799 3.398 1.00 . A A . 10 ARG CG 1 1
3 597 1 1 10 ARG CZ C -0.521 4.926 2.914 1.00 . A A . 10 ARG CZ 1 1
3 598 1 1 10 ARG H H -2.636 0.839 1.533 1.00 . A A . 10 ARG H 1 1
3 599 1 1 10 ARG HA H -5.308 1.175 2.442 1.00 . A A . 10 ARG HA 1 1
3 600 1 1 10 ARG HB2 H -3.408 3.252 1.328 1.00 . A A . 10 ARG HB2 1 1
3 601 1 1 10 ARG HB3 H -4.858 3.575 2.270 1.00 . A A . 10 ARG HB3 1 1
3 602 1 1 10 ARG HD2 H -3.545 4.811 4.017 1.00 . A A . 10 ARG HD2 1 1
3 603 1 1 10 ARG HD3 H -2.136 4.043 4.736 1.00 . A A . 10 ARG HD3 1 1
3 604 1 1 10 ARG HE H -2.304 5.159 2.018 1.00 . A A . 10 ARG HE 1 1
3 605 1 1 10 ARG HG2 H -3.857 2.406 4.184 1.00 . A A . 10 ARG HG2 1 1
3 606 1 1 10 ARG HG3 H -2.395 2.135 3.236 1.00 . A A . 10 ARG HG3 1 1
3 607 1 1 10 ARG HH11 H -0.366 3.895 4.659 1.00 . A A . 10 ARG HH11 1 1
3 608 1 1 10 ARG HH12 H 1.121 4.502 4.027 1.00 . A A . 10 ARG HH12 1 1
3 609 1 1 10 ARG HH21 H -0.323 5.975 1.188 1.00 . A A . 10 ARG HH21 1 1
3 610 1 1 10 ARG HH22 H 1.157 5.685 2.040 1.00 . A A . 10 ARG HH22 1 1
3 611 1 1 10 ARG N N -3.574 0.542 1.530 1.00 . A A . 10 ARG N 1 1
3 612 1 1 10 ARG NE N -1.848 4.790 2.809 1.00 . A A . 10 ARG NE 1 1
3 613 1 1 10 ARG NH1 N 0.128 4.400 3.946 1.00 . A A . 10 ARG NH1 1 1
3 614 1 1 10 ARG NH2 N 0.158 5.579 1.976 1.00 . A A . 10 ARG NH2 1 1
3 615 1 1 10 ARG O O -6.627 1.822 0.371 1.00 . A A . 10 ARG O 1 1
3 616 1 1 11 ALA C C -6.180 0.581 -2.411 1.00 . A A . 11 ALA C 1 1
3 617 1 1 11 ALA CA C -5.279 1.768 -2.063 1.00 . A A . 11 ALA CA 1 1
3 618 1 1 11 ALA CB C -4.191 1.926 -3.115 1.00 . A A . 11 ALA CB 1 1
3 619 1 1 11 ALA H H -3.709 1.516 -0.666 1.00 . A A . 11 ALA H 1 1
3 620 1 1 11 ALA HA H -5.877 2.668 -2.065 1.00 . A A . 11 ALA HA 1 1
3 621 1 1 11 ALA HB1 H -4.645 2.107 -4.079 1.00 . A A . 11 ALA HB1 1 1
3 622 1 1 11 ALA HB2 H -3.601 1.022 -3.160 1.00 . A A . 11 ALA HB2 1 1
3 623 1 1 11 ALA HB3 H -3.554 2.758 -2.855 1.00 . A A . 11 ALA HB3 1 1
3 624 1 1 11 ALA N N -4.681 1.633 -0.740 1.00 . A A . 11 ALA N 1 1
3 625 1 1 11 ALA O O -7.305 0.758 -2.878 1.00 . A A . 11 ALA O 1 1
3 626 1 1 12 ALA C C -7.491 -2.188 -1.471 1.00 . A A . 12 ALA C 1 1
3 627 1 1 12 ALA CA C -6.425 -1.841 -2.511 1.00 . A A . 12 ALA CA 1 1
3 628 1 1 12 ALA CB C -5.468 -3.005 -2.704 1.00 . A A . 12 ALA CB 1 1
3 629 1 1 12 ALA H H -4.801 -0.706 -1.745 1.00 . A A . 12 ALA H 1 1
3 630 1 1 12 ALA HA H -6.919 -1.660 -3.454 1.00 . A A . 12 ALA HA 1 1
3 631 1 1 12 ALA HB1 H -4.955 -3.206 -1.776 1.00 . A A . 12 ALA HB1 1 1
3 632 1 1 12 ALA HB2 H -4.746 -2.754 -3.468 1.00 . A A . 12 ALA HB2 1 1
3 633 1 1 12 ALA HB3 H -6.022 -3.881 -3.007 1.00 . A A . 12 ALA HB3 1 1
3 634 1 1 12 ALA N N -5.689 -0.627 -2.164 1.00 . A A . 12 ALA N 1 1
3 635 1 1 12 ALA O O -8.310 -3.084 -1.688 1.00 . A A . 12 ALA O 1 1
3 636 1 1 13 DAL C C -8.150 -2.985 1.487 1.00 . A A . 13 DAL C 1 1
3 637 1 1 13 DAL CA C -8.457 -1.718 0.697 1.00 . A A . 13 DAL CA 1 1
3 638 1 1 13 DAL CB C -8.535 -0.517 1.623 1.00 . A A . 13 DAL CB 1 1
3 639 1 1 13 DAL H H -6.779 -0.811 -0.218 1.00 . A A . 13 DAL H 1 1
3 640 1 1 13 DAL HA H -9.420 -1.835 0.219 1.00 . A A . 13 DAL HA 1 1
3 641 1 1 13 DAL HB1 H -8.765 0.367 1.047 1.00 . A A . 13 DAL HB1 1 1
3 642 1 1 13 DAL HB2 H -7.585 -0.385 2.120 1.00 . A A . 13 DAL HB2 1 1
3 643 1 1 13 DAL HB3 H -9.309 -0.678 2.359 1.00 . A A . 13 DAL HB3 1 1
3 644 1 1 13 DAL N N -7.472 -1.493 -0.349 1.00 . A A . 13 DAL N 1 1
3 645 1 1 13 DAL O O -9.007 -3.859 1.638 1.00 . A A . 13 DAL O 1 1
3 646 1 1 14 CYS C C -6.836 -4.015 4.239 1.00 . A A . 14 CYS C 1 1
3 647 1 1 14 CYS CA C -6.524 -4.241 2.762 1.00 . A A . 14 CYS CA 1 1
3 648 1 1 14 CYS CB C -5.034 -4.535 2.567 1.00 . A A . 14 CYS CB 1 1
3 649 1 1 14 CYS H H -6.281 -2.369 1.808 1.00 . A A . 14 CYS H 1 1
3 650 1 1 14 CYS HA H -7.096 -5.089 2.416 1.00 . A A . 14 CYS HA 1 1
3 651 1 1 14 CYS HB2 H -4.571 -3.684 2.090 1.00 . A A . 14 CYS HB2 1 1
3 652 1 1 14 CYS HB3 H -4.582 -4.680 3.536 1.00 . A A . 14 CYS HB3 1 1
3 653 1 1 14 CYS N N -6.930 -3.090 1.976 1.00 . A A . 14 CYS N 1 1
3 654 1 1 14 CYS O O -7.879 -4.450 4.741 1.00 . A A . 14 CYS O 1 1
3 655 1 1 14 CYS SG S -4.697 -5.996 1.564 1.00 . A A . 14 CYS SG 1 1
3 656 1 1 15 NH2 HN1 H -5.100 -3.774 5.156 1.00 . A A . 15 NH2 HN1 1 1
3 657 1 1 15 NH2 HN2 H -6.076 -2.359 5.001 1.00 . A A . 15 NH2 HN2 1 1
3 658 1 1 15 NH2 N N -5.948 -3.330 4.935 1.00 . A A . 15 NH2 N 1 1
3 659 2 2 1 . CB1 C 0.826 -4.542 5.165 1.00 . B A . 101 B0I CB1 1 1
3 660 2 2 1 . CB2 C -4.322 -5.234 -0.024 1.00 . B A . 101 B0I CB2 1 1
3 661 2 2 1 . CD1 C 0.154 -4.876 2.798 1.00 . B A . 101 B0I CD1 1 1
3 662 2 2 1 . CD2 C 2.155 -5.913 3.539 1.00 . B A . 101 B0I CD2 1 1
3 663 2 2 1 . CD3 C -1.928 -5.314 0.747 1.00 . B A . 101 B0I CD3 1 1
3 664 2 2 1 . CD4 C -2.384 -4.616 -1.486 1.00 . B A . 101 B0I CD4 1 1
3 665 2 2 1 . CE1 C 0.340 -5.403 1.535 1.00 . B A . 101 B0I CE1 1 1
3 666 2 2 1 . CE2 C 2.355 -6.448 2.284 1.00 . B A . 101 B0I CE2 1 1
3 667 2 2 1 . CE3 C -0.573 -5.139 0.526 1.00 . B A . 101 B0I CE3 1 1
3 668 2 2 1 . CE4 C -1.036 -4.441 -1.711 1.00 . B A . 101 B0I CE4 1 1
3 669 2 2 1 . CG1 C 1.049 -5.122 3.805 1.00 . B A . 101 B0I CG1 1 1
3 670 2 2 1 . CG2 C -2.848 -5.052 -0.258 1.00 . B A . 101 B0I CG2 1 1
3 671 2 2 1 . CZ1 C 1.445 -6.193 1.279 1.00 . B A . 101 B0I CZ1 1 1
3 672 2 2 1 . CZ2 C -0.130 -4.702 -0.705 1.00 . B A . 101 B0I CZ2 1 1
3 673 2 2 1 . H1 H 1.446 -5.078 5.856 1.00 . B A . 101 B0I H1 1 1
3 674 2 2 1 . H2 H -4.716 -5.856 -0.813 1.00 . B A . 101 B0I H2 1 1
3 675 2 2 1 . HB11 H -0.212 -4.686 5.426 1.00 . B A . 101 B0I HB11 1 1
3 676 2 2 1 . HB21 H -4.792 -4.264 -0.059 1.00 . B A . 101 B0I HB21 1 1
3 677 2 2 1 . HD1 H -0.701 -4.262 3.018 1.00 . B A . 101 B0I HD1 1 1
3 678 2 2 1 . HD2 H 2.867 -6.112 4.327 1.00 . B A . 101 B0I HD2 1 1
3 679 2 2 1 . HD3 H -2.277 -5.656 1.710 1.00 . B A . 101 B0I HD3 1 1
3 680 2 2 1 . HD4 H -3.091 -4.411 -2.276 1.00 . B A . 101 B0I HD4 1 1
3 681 2 2 1 . HE2 H 3.219 -7.064 2.089 1.00 . B A . 101 B0I HE2 1 1
3 682 2 2 1 . HE4 H -0.690 -4.100 -2.674 1.00 . B A . 101 B0I HE4 1 1
3 683 2 2 1 . HZ1 H 1.596 -6.609 0.294 1.00 . B A . 101 B0I HZ1 1 1
3 684 2 2 1 . HZ2 H 0.927 -4.564 -0.881 1.00 . B A . 101 B0I HZ2 1 1
4 685 1 1 1 . C C 6.880 -4.837 0.650 1.00 . A A . 1 H00 C 1 1
4 686 1 1 1 . CA C 6.117 -6.145 0.690 1.00 . A A . 1 H00 CA 1 1
4 687 1 1 1 . CB C 5.179 -6.176 1.886 1.00 . A A . 1 H00 CB 1 1
4 688 1 1 1 . CG C 4.009 -5.221 1.700 1.00 . A A . 1 H00 CG 1 1
4 689 1 1 1 . HA1 H 6.817 -6.964 0.768 1.00 . A A . 1 H00 HA1 1 1
4 690 1 1 1 . HA2 H 5.539 -6.248 -0.218 1.00 . A A . 1 H00 HA2 1 1
4 691 1 1 1 . HB1 H 5.730 -5.893 2.771 1.00 . A A . 1 H00 HB1 1 1
4 692 1 1 1 . HB2 H 4.796 -7.179 2.003 1.00 . A A . 1 H00 HB2 1 1
4 693 1 1 1 . HG1 H 3.650 -5.309 0.685 1.00 . A A . 1 H00 HG1 1 1
4 694 1 1 1 . HG2 H 4.354 -4.212 1.875 1.00 . A A . 1 H00 HG2 1 1
4 695 1 1 1 . O O 7.414 -4.387 1.667 1.00 . A A . 1 H00 O 1 1
4 696 1 1 1 . SD S 2.643 -5.567 2.829 1.00 . A A . 1 H00 SD 1 1
4 697 1 1 2 THR C C 6.814 -1.810 -0.131 1.00 . A A . 2 THR C 1 1
4 698 1 1 2 THR CA C 7.639 -2.972 -0.689 1.00 . A A . 2 THR CA 1 1
4 699 1 1 2 THR CB C 7.934 -2.718 -2.178 1.00 . A A . 2 THR CB 1 1
4 700 1 1 2 THR CG2 C 8.946 -3.723 -2.704 1.00 . A A . 2 THR CG2 1 1
4 701 1 1 2 THR H H 6.487 -4.627 -1.295 1.00 . A A . 2 THR H 1 1
4 702 1 1 2 THR HA H 8.576 -3.033 -0.157 1.00 . A A . 2 THR HA 1 1
4 703 1 1 2 THR HB H 8.338 -1.723 -2.288 1.00 . A A . 2 THR HB 1 1
4 704 1 1 2 THR HG1 H 6.928 -2.759 -3.874 1.00 . A A . 2 THR HG1 1 1
4 705 1 1 2 THR HG21 H 9.865 -3.637 -2.143 1.00 . A A . 2 THR HG21 1 1
4 706 1 1 2 THR HG22 H 9.142 -3.526 -3.747 1.00 . A A . 2 THR HG22 1 1
4 707 1 1 2 THR HG23 H 8.550 -4.722 -2.593 1.00 . A A . 2 THR HG23 1 1
4 708 1 1 2 THR N N 6.936 -4.228 -0.517 1.00 . A A . 2 THR N 1 1
4 709 1 1 2 THR O O 5.608 -1.958 0.098 1.00 . A A . 2 THR O 1 1
4 710 1 1 2 THR OG1 O 6.719 -2.816 -2.934 1.00 . A A . 2 THR OG1 1 1
4 711 1 1 3 PRO C C 5.530 0.910 -0.241 1.00 . A A . 3 PRO C 1 1
4 712 1 1 3 PRO CA C 6.757 0.554 0.611 1.00 . A A . 3 PRO CA 1 1
4 713 1 1 3 PRO CB C 7.823 1.646 0.501 1.00 . A A . 3 PRO CB 1 1
4 714 1 1 3 PRO CD C 8.905 -0.405 -0.043 1.00 . A A . 3 PRO CD 1 1
4 715 1 1 3 PRO CG C 9.111 0.919 0.635 1.00 . A A . 3 PRO CG 1 1
4 716 1 1 3 PRO HA H 6.456 0.437 1.642 1.00 . A A . 3 PRO HA 1 1
4 717 1 1 3 PRO HB2 H 7.742 2.131 -0.461 1.00 . A A . 3 PRO HB2 1 1
4 718 1 1 3 PRO HB3 H 7.692 2.368 1.293 1.00 . A A . 3 PRO HB3 1 1
4 719 1 1 3 PRO HD2 H 9.178 -0.340 -1.085 1.00 . A A . 3 PRO HD2 1 1
4 720 1 1 3 PRO HD3 H 9.475 -1.176 0.451 1.00 . A A . 3 PRO HD3 1 1
4 721 1 1 3 PRO HG2 H 9.899 1.474 0.146 1.00 . A A . 3 PRO HG2 1 1
4 722 1 1 3 PRO HG3 H 9.344 0.772 1.680 1.00 . A A . 3 PRO HG3 1 1
4 723 1 1 3 PRO N N 7.451 -0.643 0.114 1.00 . A A . 3 PRO N 1 1
4 724 1 1 3 PRO O O 4.497 1.328 0.284 1.00 . A A . 3 PRO O 1 1
4 725 1 1 4 ARG C C 3.396 0.031 -2.226 1.00 . A A . 4 ARG C 1 1
4 726 1 1 4 ARG CA C 4.533 1.002 -2.465 1.00 . A A . 4 ARG CA 1 1
4 727 1 1 4 ARG CB C 4.976 0.920 -3.923 1.00 . A A . 4 ARG CB 1 1
4 728 1 1 4 ARG CD C 6.433 1.851 -5.740 1.00 . A A . 4 ARG CD 1 1
4 729 1 1 4 ARG CG C 6.147 1.809 -4.246 1.00 . A A . 4 ARG CG 1 1
4 730 1 1 4 ARG CZ C 5.473 2.931 -7.761 1.00 . A A . 4 ARG CZ 1 1
4 731 1 1 4 ARG H H 6.492 0.381 -1.916 1.00 . A A . 4 ARG H 1 1
4 732 1 1 4 ARG HA H 4.184 2.003 -2.259 1.00 . A A . 4 ARG HA 1 1
4 733 1 1 4 ARG HB2 H 5.254 -0.099 -4.146 1.00 . A A . 4 ARG HB2 1 1
4 734 1 1 4 ARG HB3 H 4.149 1.205 -4.556 1.00 . A A . 4 ARG HB3 1 1
4 735 1 1 4 ARG HD2 H 7.361 2.380 -5.901 1.00 . A A . 4 ARG HD2 1 1
4 736 1 1 4 ARG HD3 H 6.529 0.840 -6.103 1.00 . A A . 4 ARG HD3 1 1
4 737 1 1 4 ARG HE H 4.522 2.693 -6.004 1.00 . A A . 4 ARG HE 1 1
4 738 1 1 4 ARG HG2 H 5.927 2.807 -3.900 1.00 . A A . 4 ARG HG2 1 1
4 739 1 1 4 ARG HG3 H 7.007 1.422 -3.726 1.00 . A A . 4 ARG HG3 1 1
4 740 1 1 4 ARG HH11 H 7.368 2.228 -8.021 1.00 . A A . 4 ARG HH11 1 1
4 741 1 1 4 ARG HH12 H 6.674 3.007 -9.400 1.00 . A A . 4 ARG HH12 1 1
4 742 1 1 4 ARG HH21 H 3.611 3.739 -7.844 1.00 . A A . 4 ARG HH21 1 1
4 743 1 1 4 ARG HH22 H 4.535 3.866 -9.299 1.00 . A A . 4 ARG HH22 1 1
4 744 1 1 4 ARG N N 5.644 0.718 -1.557 1.00 . A A . 4 ARG N 1 1
4 745 1 1 4 ARG NE N 5.365 2.527 -6.488 1.00 . A A . 4 ARG NE 1 1
4 746 1 1 4 ARG NH1 N 6.593 2.703 -8.447 1.00 . A A . 4 ARG NH1 1 1
4 747 1 1 4 ARG NH2 N 4.461 3.560 -8.346 1.00 . A A . 4 ARG NH2 1 1
4 748 1 1 4 ARG O O 2.232 0.423 -2.163 1.00 . A A . 4 ARG O 1 1
4 749 1 1 5 GLN C C 2.091 -2.081 -0.477 1.00 . A A . 5 GLN C 1 1
4 750 1 1 5 GLN CA C 2.746 -2.277 -1.836 1.00 . A A . 5 GLN CA 1 1
4 751 1 1 5 GLN CB C 3.372 -3.667 -1.923 1.00 . A A . 5 GLN CB 1 1
4 752 1 1 5 GLN CD C 4.392 -5.449 -3.384 1.00 . A A . 5 GLN CD 1 1
4 753 1 1 5 GLN CG C 3.792 -4.062 -3.325 1.00 . A A . 5 GLN CG 1 1
4 754 1 1 5 GLN H H 4.690 -1.483 -2.162 1.00 . A A . 5 GLN H 1 1
4 755 1 1 5 GLN HA H 1.985 -2.190 -2.597 1.00 . A A . 5 GLN HA 1 1
4 756 1 1 5 GLN HB2 H 4.247 -3.695 -1.289 1.00 . A A . 5 GLN HB2 1 1
4 757 1 1 5 GLN HB3 H 2.654 -4.393 -1.567 1.00 . A A . 5 GLN HB3 1 1
4 758 1 1 5 GLN HE21 H 3.672 -5.698 -5.212 1.00 . A A . 5 GLN HE21 1 1
4 759 1 1 5 GLN HE22 H 4.570 -7.029 -4.565 1.00 . A A . 5 GLN HE22 1 1
4 760 1 1 5 GLN HG2 H 2.926 -4.034 -3.969 1.00 . A A . 5 GLN HG2 1 1
4 761 1 1 5 GLN HG3 H 4.525 -3.352 -3.679 1.00 . A A . 5 GLN HG3 1 1
4 762 1 1 5 GLN N N 3.740 -1.239 -2.090 1.00 . A A . 5 GLN N 1 1
4 763 1 1 5 GLN NE2 N 4.193 -6.126 -4.496 1.00 . A A . 5 GLN NE2 1 1
4 764 1 1 5 GLN O O 0.905 -2.342 -0.311 1.00 . A A . 5 GLN O 1 1
4 765 1 1 5 GLN OE1 O 5.021 -5.913 -2.428 1.00 . A A . 5 GLN OE1 1 1
4 766 1 1 6 ALA C C 1.285 -0.271 1.792 1.00 . A A . 6 ALA C 1 1
4 767 1 1 6 ALA CA C 2.361 -1.351 1.824 1.00 . A A . 6 ALA CA 1 1
4 768 1 1 6 ALA CB C 3.495 -0.949 2.752 1.00 . A A . 6 ALA CB 1 1
4 769 1 1 6 ALA H H 3.819 -1.439 0.294 1.00 . A A . 6 ALA H 1 1
4 770 1 1 6 ALA HA H 1.926 -2.268 2.195 1.00 . A A . 6 ALA HA 1 1
4 771 1 1 6 ALA HB1 H 3.928 -0.021 2.409 1.00 . A A . 6 ALA HB1 1 1
4 772 1 1 6 ALA HB2 H 4.251 -1.720 2.751 1.00 . A A . 6 ALA HB2 1 1
4 773 1 1 6 ALA HB3 H 3.113 -0.821 3.754 1.00 . A A . 6 ALA HB3 1 1
4 774 1 1 6 ALA N N 2.870 -1.608 0.487 1.00 . A A . 6 ALA N 1 1
4 775 1 1 6 ALA O O 0.241 -0.399 2.438 1.00 . A A . 6 ALA O 1 1
4 776 1 1 7 ARG C C -0.634 1.387 0.100 1.00 . A A . 7 ARG C 1 1
4 777 1 1 7 ARG CA C 0.564 1.867 0.881 1.00 . A A . 7 ARG CA 1 1
4 778 1 1 7 ARG CB C 1.188 3.067 0.185 1.00 . A A . 7 ARG CB 1 1
4 779 1 1 7 ARG CD C 2.862 4.923 0.270 1.00 . A A . 7 ARG CD 1 1
4 780 1 1 7 ARG CG C 2.313 3.690 0.967 1.00 . A A . 7 ARG CG 1 1
4 781 1 1 7 ARG CZ C 3.463 4.797 -2.134 1.00 . A A . 7 ARG CZ 1 1
4 782 1 1 7 ARG H H 2.392 0.839 0.551 1.00 . A A . 7 ARG H 1 1
4 783 1 1 7 ARG HA H 0.242 2.160 1.870 1.00 . A A . 7 ARG HA 1 1
4 784 1 1 7 ARG HB2 H 1.573 2.752 -0.773 1.00 . A A . 7 ARG HB2 1 1
4 785 1 1 7 ARG HB3 H 0.426 3.816 0.029 1.00 . A A . 7 ARG HB3 1 1
4 786 1 1 7 ARG HD2 H 2.035 5.509 -0.102 1.00 . A A . 7 ARG HD2 1 1
4 787 1 1 7 ARG HD3 H 3.418 5.506 0.988 1.00 . A A . 7 ARG HD3 1 1
4 788 1 1 7 ARG HE H 4.619 4.200 -0.607 1.00 . A A . 7 ARG HE 1 1
4 789 1 1 7 ARG HG2 H 1.957 3.960 1.950 1.00 . A A . 7 ARG HG2 1 1
4 790 1 1 7 ARG HG3 H 3.094 2.949 1.048 1.00 . A A . 7 ARG HG3 1 1
4 791 1 1 7 ARG HH11 H 1.570 5.452 -1.807 1.00 . A A . 7 ARG HH11 1 1
4 792 1 1 7 ARG HH12 H 2.065 5.431 -3.460 1.00 . A A . 7 ARG HH12 1 1
4 793 1 1 7 ARG HH21 H 5.280 4.186 -2.799 1.00 . A A . 7 ARG HH21 1 1
4 794 1 1 7 ARG HH22 H 4.172 4.690 -4.034 1.00 . A A . 7 ARG HH22 1 1
4 795 1 1 7 ARG N N 1.534 0.786 1.026 1.00 . A A . 7 ARG N 1 1
4 796 1 1 7 ARG NE N 3.743 4.582 -0.846 1.00 . A A . 7 ARG NE 1 1
4 797 1 1 7 ARG NH1 N 2.274 5.259 -2.494 1.00 . A A . 7 ARG NH1 1 1
4 798 1 1 7 ARG NH2 N 4.376 4.538 -3.061 1.00 . A A . 7 ARG NH2 1 1
4 799 1 1 7 ARG O O -1.773 1.720 0.417 1.00 . A A . 7 ARG O 1 1
4 800 1 1 8 ALA C C -2.338 -0.855 -0.897 1.00 . A A . 8 ALA C 1 1
4 801 1 1 8 ALA CA C -1.413 0.011 -1.746 1.00 . A A . 8 ALA CA 1 1
4 802 1 1 8 ALA CB C -0.804 -0.810 -2.871 1.00 . A A . 8 ALA CB 1 1
4 803 1 1 8 ALA H H 0.583 0.413 -1.128 1.00 . A A . 8 ALA H 1 1
4 804 1 1 8 ALA HA H -1.986 0.818 -2.181 1.00 . A A . 8 ALA HA 1 1
4 805 1 1 8 ALA HB1 H -0.133 -0.191 -3.445 1.00 . A A . 8 ALA HB1 1 1
4 806 1 1 8 ALA HB2 H -1.588 -1.182 -3.513 1.00 . A A . 8 ALA HB2 1 1
4 807 1 1 8 ALA HB3 H -0.257 -1.642 -2.452 1.00 . A A . 8 ALA HB3 1 1
4 808 1 1 8 ALA N N -0.363 0.596 -0.921 1.00 . A A . 8 ALA N 1 1
4 809 1 1 8 ALA O O -3.560 -0.833 -1.064 1.00 . A A . 8 ALA O 1 1
4 810 1 1 9 ALA C C -3.334 -1.623 1.870 1.00 . A A . 9 ALA C 1 1
4 811 1 1 9 ALA CA C -2.490 -2.462 0.923 1.00 . A A . 9 ALA CA 1 1
4 812 1 1 9 ALA CB C -1.544 -3.357 1.707 1.00 . A A . 9 ALA CB 1 1
4 813 1 1 9 ALA H H -0.760 -1.606 0.069 1.00 . A A . 9 ALA H 1 1
4 814 1 1 9 ALA HA H -3.142 -3.089 0.333 1.00 . A A . 9 ALA HA 1 1
4 815 1 1 9 ALA HB1 H -0.886 -2.745 2.307 1.00 . A A . 9 ALA HB1 1 1
4 816 1 1 9 ALA HB2 H -0.957 -3.949 1.020 1.00 . A A . 9 ALA HB2 1 1
4 817 1 1 9 ALA HB3 H -2.115 -4.009 2.350 1.00 . A A . 9 ALA HB3 1 1
4 818 1 1 9 ALA N N -1.742 -1.611 0.016 1.00 . A A . 9 ALA N 1 1
4 819 1 1 9 ALA O O -4.479 -1.959 2.159 1.00 . A A . 9 ALA O 1 1
4 820 1 1 10 ARG C C -4.640 1.039 2.515 1.00 . A A . 10 ARG C 1 1
4 821 1 1 10 ARG CA C -3.465 0.379 3.234 1.00 . A A . 10 ARG CA 1 1
4 822 1 1 10 ARG CB C -2.504 1.446 3.754 1.00 . A A . 10 ARG CB 1 1
4 823 1 1 10 ARG CD C -2.142 3.440 5.224 1.00 . A A . 10 ARG CD 1 1
4 824 1 1 10 ARG CG C -3.133 2.396 4.747 1.00 . A A . 10 ARG CG 1 1
4 825 1 1 10 ARG CZ C -2.058 5.241 6.915 1.00 . A A . 10 ARG CZ 1 1
4 826 1 1 10 ARG H H -1.843 -0.315 2.089 1.00 . A A . 10 ARG H 1 1
4 827 1 1 10 ARG HA H -3.838 -0.195 4.068 1.00 . A A . 10 ARG HA 1 1
4 828 1 1 10 ARG HB2 H -1.669 0.959 4.234 1.00 . A A . 10 ARG HB2 1 1
4 829 1 1 10 ARG HB3 H -2.140 2.024 2.917 1.00 . A A . 10 ARG HB3 1 1
4 830 1 1 10 ARG HD2 H -1.307 2.940 5.692 1.00 . A A . 10 ARG HD2 1 1
4 831 1 1 10 ARG HD3 H -1.792 4.002 4.371 1.00 . A A . 10 ARG HD3 1 1
4 832 1 1 10 ARG HE H -3.721 4.316 6.290 1.00 . A A . 10 ARG HE 1 1
4 833 1 1 10 ARG HG2 H -3.971 2.892 4.280 1.00 . A A . 10 ARG HG2 1 1
4 834 1 1 10 ARG HG3 H -3.475 1.819 5.591 1.00 . A A . 10 ARG HG3 1 1
4 835 1 1 10 ARG HH11 H -0.245 4.730 6.154 1.00 . A A . 10 ARG HH11 1 1
4 836 1 1 10 ARG HH12 H -0.216 5.990 7.338 1.00 . A A . 10 ARG HH12 1 1
4 837 1 1 10 ARG HH21 H -3.691 5.984 7.870 1.00 . A A . 10 ARG HH21 1 1
4 838 1 1 10 ARG HH22 H -2.183 6.703 8.316 1.00 . A A . 10 ARG HH22 1 1
4 839 1 1 10 ARG N N -2.766 -0.525 2.341 1.00 . A A . 10 ARG N 1 1
4 840 1 1 10 ARG NE N -2.743 4.362 6.186 1.00 . A A . 10 ARG NE 1 1
4 841 1 1 10 ARG NH1 N -0.737 5.326 6.793 1.00 . A A . 10 ARG NH1 1 1
4 842 1 1 10 ARG NH2 N -2.695 6.037 7.767 1.00 . A A . 10 ARG NH2 1 1
4 843 1 1 10 ARG O O -5.722 1.187 3.076 1.00 . A A . 10 ARG O 1 1
4 844 1 1 11 ALA C C -6.584 1.120 0.133 1.00 . A A . 11 ALA C 1 1
4 845 1 1 11 ALA CA C -5.430 2.071 0.458 1.00 . A A . 11 ALA CA 1 1
4 846 1 1 11 ALA CB C -4.808 2.608 -0.821 1.00 . A A . 11 ALA CB 1 1
4 847 1 1 11 ALA H H -3.518 1.280 0.886 1.00 . A A . 11 ALA H 1 1
4 848 1 1 11 ALA HA H -5.819 2.909 1.019 1.00 . A A . 11 ALA HA 1 1
4 849 1 1 11 ALA HB1 H -4.449 1.783 -1.420 1.00 . A A . 11 ALA HB1 1 1
4 850 1 1 11 ALA HB2 H -3.981 3.256 -0.572 1.00 . A A . 11 ALA HB2 1 1
4 851 1 1 11 ALA HB3 H -5.545 3.164 -1.378 1.00 . A A . 11 ALA HB3 1 1
4 852 1 1 11 ALA N N -4.412 1.424 1.271 1.00 . A A . 11 ALA N 1 1
4 853 1 1 11 ALA O O -7.741 1.541 0.027 1.00 . A A . 11 ALA O 1 1
4 854 1 1 12 ALA C C -7.975 -1.676 0.900 1.00 . A A . 12 ALA C 1 1
4 855 1 1 12 ALA CA C -7.278 -1.153 -0.354 1.00 . A A . 12 ALA CA 1 1
4 856 1 1 12 ALA CB C -6.658 -2.300 -1.137 1.00 . A A . 12 ALA CB 1 1
4 857 1 1 12 ALA H H -5.331 -0.433 0.069 1.00 . A A . 12 ALA H 1 1
4 858 1 1 12 ALA HA H -8.015 -0.677 -0.985 1.00 . A A . 12 ALA HA 1 1
4 859 1 1 12 ALA HB1 H -5.941 -2.814 -0.514 1.00 . A A . 12 ALA HB1 1 1
4 860 1 1 12 ALA HB2 H -6.160 -1.911 -2.013 1.00 . A A . 12 ALA HB2 1 1
4 861 1 1 12 ALA HB3 H -7.432 -2.990 -1.439 1.00 . A A . 12 ALA HB3 1 1
4 862 1 1 12 ALA N N -6.268 -0.157 -0.027 1.00 . A A . 12 ALA N 1 1
4 863 1 1 12 ALA O O -9.182 -1.921 0.895 1.00 . A A . 12 ALA O 1 1
4 864 1 1 13 DAL C C -7.276 -3.754 3.491 1.00 . A A . 13 DAL C 1 1
4 865 1 1 13 DAL CA C -7.769 -2.338 3.221 1.00 . A A . 13 DAL CA 1 1
4 866 1 1 13 DAL CB C -7.400 -1.416 4.375 1.00 . A A . 13 DAL CB 1 1
4 867 1 1 13 DAL H H -6.263 -1.617 1.923 1.00 . A A . 13 DAL H 1 1
4 868 1 1 13 DAL HA H -8.846 -2.355 3.130 1.00 . A A . 13 DAL HA 1 1
4 869 1 1 13 DAL HB1 H -7.750 -0.417 4.163 1.00 . A A . 13 DAL HB1 1 1
4 870 1 1 13 DAL HB2 H -6.327 -1.404 4.498 1.00 . A A . 13 DAL HB2 1 1
4 871 1 1 13 DAL HB3 H -7.862 -1.773 5.284 1.00 . A A . 13 DAL HB3 1 1
4 872 1 1 13 DAL N N -7.220 -1.835 1.972 1.00 . A A . 13 DAL N 1 1
4 873 1 1 13 DAL O O -8.058 -4.649 3.820 1.00 . A A . 13 DAL O 1 1
4 874 1 1 14 CYS C C -4.324 -5.154 4.672 1.00 . A A . 14 CYS C 1 1
4 875 1 1 14 CYS CA C -5.366 -5.246 3.562 1.00 . A A . 14 CYS CA 1 1
4 876 1 1 14 CYS CB C -4.722 -5.750 2.269 1.00 . A A . 14 CYS CB 1 1
4 877 1 1 14 CYS H H -5.413 -3.203 3.051 1.00 . A A . 14 CYS H 1 1
4 878 1 1 14 CYS HA H -6.139 -5.937 3.862 1.00 . A A . 14 CYS HA 1 1
4 879 1 1 14 CYS HB2 H -3.657 -5.575 2.320 1.00 . A A . 14 CYS HB2 1 1
4 880 1 1 14 CYS HB3 H -4.898 -6.811 2.181 1.00 . A A . 14 CYS HB3 1 1
4 881 1 1 14 CYS N N -5.982 -3.952 3.336 1.00 . A A . 14 CYS N 1 1
4 882 1 1 14 CYS O O -3.176 -4.787 4.430 1.00 . A A . 14 CYS O 1 1
4 883 1 1 14 CYS SG S -5.356 -4.945 0.782 1.00 . A A . 14 CYS SG 1 1
4 884 1 1 15 NH2 HN1 H -4.479 -4.866 6.621 1.00 . A A . 15 NH2 HN1 1 1
4 885 1 1 15 NH2 HN2 H -5.382 -6.191 5.984 1.00 . A A . 15 NH2 HN2 1 1
4 886 1 1 15 NH2 N N -4.729 -5.467 5.888 1.00 . A A . 15 NH2 N 1 1
4 887 2 2 1 . CB1 C 2.040 -7.142 2.177 1.00 . B A . 101 B0I CB1 1 1
4 888 2 2 1 . CB2 C -4.736 -6.049 -0.501 1.00 . B A . 101 B0I CB2 1 1
4 889 2 2 1 . CD1 C 0.492 -6.455 0.365 1.00 . B A . 101 B0I CD1 1 1
4 890 2 2 1 . CD2 C 2.460 -7.623 -0.250 1.00 . B A . 101 B0I CD2 1 1
4 891 2 2 1 . CD3 C -2.255 -6.187 -0.764 1.00 . B A . 101 B0I CD3 1 1
4 892 2 2 1 . CD4 C -3.428 -4.517 -1.987 1.00 . B A . 101 B0I CD4 1 1
4 893 2 2 1 . CE1 C 0.117 -6.378 -0.961 1.00 . B A . 101 B0I CE1 1 1
4 894 2 2 1 . CE2 C 2.097 -7.553 -1.580 1.00 . B A . 101 B0I CE2 1 1
4 895 2 2 1 . CE3 C -1.064 -5.754 -1.308 1.00 . B A . 101 B0I CE3 1 1
4 896 2 2 1 . CE4 C -2.239 -4.078 -2.536 1.00 . B A . 101 B0I CE4 1 1
4 897 2 2 1 . CG1 C 1.655 -7.070 0.734 1.00 . B A . 101 B0I CG1 1 1
4 898 2 2 1 . CG2 C -3.447 -5.575 -1.096 1.00 . B A . 101 B0I CG2 1 1
4 899 2 2 1 . CZ1 C 0.923 -6.929 -1.937 1.00 . B A . 101 B0I CZ1 1 1
4 900 2 2 1 . CZ2 C -1.055 -4.697 -2.196 1.00 . B A . 101 B0I CZ2 1 1
4 901 2 2 1 . H1 H 2.808 -7.883 2.279 1.00 . B A . 101 B0I H1 1 1
4 902 2 2 1 . H2 H -4.574 -7.026 -0.074 1.00 . B A . 101 B0I H2 1 1
4 903 2 2 1 . HB11 H 1.170 -7.442 2.743 1.00 . B A . 101 B0I HB11 1 1
4 904 2 2 1 . HB21 H -5.469 -6.115 -1.290 1.00 . B A . 101 B0I HB21 1 1
4 905 2 2 1 . HD1 H -0.127 -6.030 1.138 1.00 . B A . 101 B0I HD1 1 1
4 906 2 2 1 . HD2 H 3.380 -8.111 0.032 1.00 . B A . 101 B0I HD2 1 1
4 907 2 2 1 . HD3 H -2.259 -7.014 -0.070 1.00 . B A . 101 B0I HD3 1 1
4 908 2 2 1 . HD4 H -4.355 -4.031 -2.254 1.00 . B A . 101 B0I HD4 1 1
4 909 2 2 1 . HE2 H 2.732 -7.986 -2.339 1.00 . B A . 101 B0I HE2 1 1
4 910 2 2 1 . HE4 H -2.237 -3.251 -3.230 1.00 . B A . 101 B0I HE4 1 1
4 911 2 2 1 . HZ1 H 0.634 -6.870 -2.976 1.00 . B A . 101 B0I HZ1 1 1
4 912 2 2 1 . HZ2 H -0.123 -4.357 -2.623 1.00 . B A . 101 B0I HZ2 1 1
5 913 1 1 1 . C C 7.265 -4.793 0.817 1.00 . A A . 1 H00 C 1 1
5 914 1 1 1 . CA C 6.688 -6.191 0.943 1.00 . A A . 1 H00 CA 1 1
5 915 1 1 1 . CB C 5.421 -6.172 1.785 1.00 . A A . 1 H00 CB 1 1
5 916 1 1 1 . CG C 4.344 -5.299 1.155 1.00 . A A . 1 H00 CG 1 1
5 917 1 1 1 . HA1 H 7.416 -6.836 1.413 1.00 . A A . 1 H00 HA1 1 1
5 918 1 1 1 . HA2 H 6.456 -6.567 -0.042 1.00 . A A . 1 H00 HA2 1 1
5 919 1 1 1 . HB1 H 5.659 -5.787 2.766 1.00 . A A . 1 H00 HB1 1 1
5 920 1 1 1 . HB2 H 5.046 -7.181 1.875 1.00 . A A . 1 H00 HB2 1 1
5 921 1 1 1 . HG1 H 4.414 -5.390 0.080 1.00 . A A . 1 H00 HG1 1 1
5 922 1 1 1 . HG2 H 4.518 -4.272 1.443 1.00 . A A . 1 H00 HG2 1 1
5 923 1 1 1 . O O 7.682 -4.188 1.815 1.00 . A A . 1 H00 O 1 1
5 924 1 1 1 . SD S 2.677 -5.763 1.667 1.00 . A A . 1 H00 SD 1 1
5 925 1 1 2 THR C C 6.843 -1.880 -0.142 1.00 . A A . 2 THR C 1 1
5 926 1 1 2 THR CA C 7.810 -2.947 -0.658 1.00 . A A . 2 THR CA 1 1
5 927 1 1 2 THR CB C 8.060 -2.731 -2.168 1.00 . A A . 2 THR CB 1 1
5 928 1 1 2 THR CG2 C 9.328 -3.438 -2.615 1.00 . A A . 2 THR CG2 1 1
5 929 1 1 2 THR H H 6.934 -4.802 -1.150 1.00 . A A . 2 THR H 1 1
5 930 1 1 2 THR HA H 8.751 -2.852 -0.137 1.00 . A A . 2 THR HA 1 1
5 931 1 1 2 THR HB H 8.167 -1.672 -2.352 1.00 . A A . 2 THR HB 1 1
5 932 1 1 2 THR HG1 H 7.098 -4.152 -3.139 1.00 . A A . 2 THR HG1 1 1
5 933 1 1 2 THR HG21 H 9.468 -3.292 -3.675 1.00 . A A . 2 THR HG21 1 1
5 934 1 1 2 THR HG22 H 9.244 -4.493 -2.404 1.00 . A A . 2 THR HG22 1 1
5 935 1 1 2 THR HG23 H 10.173 -3.031 -2.081 1.00 . A A . 2 THR HG23 1 1
5 936 1 1 2 THR N N 7.289 -4.277 -0.402 1.00 . A A . 2 THR N 1 1
5 937 1 1 2 THR O O 5.631 -2.117 -0.071 1.00 . A A . 2 THR O 1 1
5 938 1 1 2 THR OG1 O 6.945 -3.224 -2.924 1.00 . A A . 2 THR OG1 1 1
5 939 1 1 3 PRO C C 5.409 0.759 -0.229 1.00 . A A . 3 PRO C 1 1
5 940 1 1 3 PRO CA C 6.542 0.419 0.730 1.00 . A A . 3 PRO CA 1 1
5 941 1 1 3 PRO CB C 7.530 1.598 0.832 1.00 . A A . 3 PRO CB 1 1
5 942 1 1 3 PRO CD C 8.788 -0.338 0.214 1.00 . A A . 3 PRO CD 1 1
5 943 1 1 3 PRO CG C 8.751 1.154 0.095 1.00 . A A . 3 PRO CG 1 1
5 944 1 1 3 PRO HA H 6.133 0.199 1.705 1.00 . A A . 3 PRO HA 1 1
5 945 1 1 3 PRO HB2 H 7.093 2.474 0.376 1.00 . A A . 3 PRO HB2 1 1
5 946 1 1 3 PRO HB3 H 7.749 1.797 1.870 1.00 . A A . 3 PRO HB3 1 1
5 947 1 1 3 PRO HD2 H 9.288 -0.773 -0.639 1.00 . A A . 3 PRO HD2 1 1
5 948 1 1 3 PRO HD3 H 9.269 -0.633 1.133 1.00 . A A . 3 PRO HD3 1 1
5 949 1 1 3 PRO HG2 H 8.678 1.445 -0.943 1.00 . A A . 3 PRO HG2 1 1
5 950 1 1 3 PRO HG3 H 9.631 1.588 0.547 1.00 . A A . 3 PRO HG3 1 1
5 951 1 1 3 PRO N N 7.365 -0.690 0.232 1.00 . A A . 3 PRO N 1 1
5 952 1 1 3 PRO O O 4.313 1.100 0.195 1.00 . A A . 3 PRO O 1 1
5 953 1 1 4 ARG C C 3.471 0.009 -2.371 1.00 . A A . 4 ARG C 1 1
5 954 1 1 4 ARG CA C 4.687 0.913 -2.563 1.00 . A A . 4 ARG CA 1 1
5 955 1 1 4 ARG CB C 5.290 0.680 -3.954 1.00 . A A . 4 ARG CB 1 1
5 956 1 1 4 ARG CD C 7.181 1.108 -5.568 1.00 . A A . 4 ARG CD 1 1
5 957 1 1 4 ARG CG C 6.641 1.349 -4.163 1.00 . A A . 4 ARG CG 1 1
5 958 1 1 4 ARG CZ C 6.714 1.841 -7.892 1.00 . A A . 4 ARG CZ 1 1
5 959 1 1 4 ARG H H 6.582 0.357 -1.792 1.00 . A A . 4 ARG H 1 1
5 960 1 1 4 ARG HA H 4.381 1.945 -2.474 1.00 . A A . 4 ARG HA 1 1
5 961 1 1 4 ARG HB2 H 5.414 -0.382 -4.102 1.00 . A A . 4 ARG HB2 1 1
5 962 1 1 4 ARG HB3 H 4.605 1.059 -4.698 1.00 . A A . 4 ARG HB3 1 1
5 963 1 1 4 ARG HD2 H 8.207 1.442 -5.607 1.00 . A A . 4 ARG HD2 1 1
5 964 1 1 4 ARG HD3 H 7.141 0.050 -5.778 1.00 . A A . 4 ARG HD3 1 1
5 965 1 1 4 ARG HE H 5.635 2.343 -6.273 1.00 . A A . 4 ARG HE 1 1
5 966 1 1 4 ARG HG2 H 6.533 2.412 -4.007 1.00 . A A . 4 ARG HG2 1 1
5 967 1 1 4 ARG HG3 H 7.340 0.949 -3.444 1.00 . A A . 4 ARG HG3 1 1
5 968 1 1 4 ARG HH11 H 8.278 0.553 -7.729 1.00 . A A . 4 ARG HH11 1 1
5 969 1 1 4 ARG HH12 H 7.960 1.121 -9.330 1.00 . A A . 4 ARG HH12 1 1
5 970 1 1 4 ARG HH21 H 5.206 3.104 -8.395 1.00 . A A . 4 ARG HH21 1 1
5 971 1 1 4 ARG HH22 H 6.211 2.599 -9.710 1.00 . A A . 4 ARG HH22 1 1
5 972 1 1 4 ARG N N 5.683 0.639 -1.527 1.00 . A A . 4 ARG N 1 1
5 973 1 1 4 ARG NE N 6.412 1.825 -6.588 1.00 . A A . 4 ARG NE 1 1
5 974 1 1 4 ARG NH1 N 7.732 1.117 -8.353 1.00 . A A . 4 ARG NH1 1 1
5 975 1 1 4 ARG NH2 N 5.985 2.568 -8.732 1.00 . A A . 4 ARG NH2 1 1
5 976 1 1 4 ARG O O 2.328 0.470 -2.367 1.00 . A A . 4 ARG O 1 1
5 977 1 1 5 GLN C C 1.991 -2.049 -0.648 1.00 . A A . 5 GLN C 1 1
5 978 1 1 5 GLN CA C 2.689 -2.268 -1.981 1.00 . A A . 5 GLN CA 1 1
5 979 1 1 5 GLN CB C 3.271 -3.676 -2.040 1.00 . A A . 5 GLN CB 1 1
5 980 1 1 5 GLN CD C 4.594 -5.357 -3.376 1.00 . A A . 5 GLN CD 1 1
5 981 1 1 5 GLN CG C 3.854 -4.036 -3.392 1.00 . A A . 5 GLN CG 1 1
5 982 1 1 5 GLN H H 4.673 -1.573 -2.178 1.00 . A A . 5 GLN H 1 1
5 983 1 1 5 GLN HA H 1.967 -2.154 -2.775 1.00 . A A . 5 GLN HA 1 1
5 984 1 1 5 GLN HB2 H 4.057 -3.758 -1.303 1.00 . A A . 5 GLN HB2 1 1
5 985 1 1 5 GLN HB3 H 2.490 -4.387 -1.807 1.00 . A A . 5 GLN HB3 1 1
5 986 1 1 5 GLN HE21 H 4.137 -5.657 -5.278 1.00 . A A . 5 GLN HE21 1 1
5 987 1 1 5 GLN HE22 H 5.074 -6.901 -4.518 1.00 . A A . 5 GLN HE22 1 1
5 988 1 1 5 GLN HG2 H 3.051 -4.102 -4.111 1.00 . A A . 5 GLN HG2 1 1
5 989 1 1 5 GLN HG3 H 4.541 -3.258 -3.689 1.00 . A A . 5 GLN HG3 1 1
5 990 1 1 5 GLN N N 3.738 -1.279 -2.185 1.00 . A A . 5 GLN N 1 1
5 991 1 1 5 GLN NE2 N 4.604 -6.039 -4.500 1.00 . A A . 5 GLN NE2 1 1
5 992 1 1 5 GLN O O 0.786 -2.239 -0.535 1.00 . A A . 5 GLN O 1 1
5 993 1 1 5 GLN OE1 O 5.163 -5.754 -2.355 1.00 . A A . 5 GLN OE1 1 1
5 994 1 1 6 ALA C C 1.211 -0.226 1.631 1.00 . A A . 6 ALA C 1 1
5 995 1 1 6 ALA CA C 2.209 -1.378 1.682 1.00 . A A . 6 ALA CA 1 1
5 996 1 1 6 ALA CB C 3.325 -1.077 2.670 1.00 . A A . 6 ALA CB 1 1
5 997 1 1 6 ALA H H 3.720 -1.524 0.205 1.00 . A A . 6 ALA H 1 1
5 998 1 1 6 ALA HA H 1.694 -2.270 2.010 1.00 . A A . 6 ALA HA 1 1
5 999 1 1 6 ALA HB1 H 3.842 -0.178 2.364 1.00 . A A . 6 ALA HB1 1 1
5 1000 1 1 6 ALA HB2 H 4.021 -1.903 2.690 1.00 . A A . 6 ALA HB2 1 1
5 1001 1 1 6 ALA HB3 H 2.906 -0.933 3.655 1.00 . A A . 6 ALA HB3 1 1
5 1002 1 1 6 ALA N N 2.757 -1.642 0.358 1.00 . A A . 6 ALA N 1 1
5 1003 1 1 6 ALA O O 0.135 -0.296 2.225 1.00 . A A . 6 ALA O 1 1
5 1004 1 1 7 ARG C C -0.575 1.561 0.008 1.00 . A A . 7 ARG C 1 1
5 1005 1 1 7 ARG CA C 0.688 1.983 0.733 1.00 . A A . 7 ARG CA 1 1
5 1006 1 1 7 ARG CB C 1.393 3.081 -0.064 1.00 . A A . 7 ARG CB 1 1
5 1007 1 1 7 ARG CD C 3.428 4.512 -0.356 1.00 . A A . 7 ARG CD 1 1
5 1008 1 1 7 ARG CG C 2.686 3.554 0.560 1.00 . A A . 7 ARG CG 1 1
5 1009 1 1 7 ARG CZ C 5.722 5.438 -0.539 1.00 . A A . 7 ARG CZ 1 1
5 1010 1 1 7 ARG H H 2.448 0.826 0.463 1.00 . A A . 7 ARG H 1 1
5 1011 1 1 7 ARG HA H 0.430 2.359 1.711 1.00 . A A . 7 ARG HA 1 1
5 1012 1 1 7 ARG HB2 H 1.611 2.707 -1.053 1.00 . A A . 7 ARG HB2 1 1
5 1013 1 1 7 ARG HB3 H 0.728 3.927 -0.148 1.00 . A A . 7 ARG HB3 1 1
5 1014 1 1 7 ARG HD2 H 3.564 4.038 -1.317 1.00 . A A . 7 ARG HD2 1 1
5 1015 1 1 7 ARG HD3 H 2.835 5.405 -0.477 1.00 . A A . 7 ARG HD3 1 1
5 1016 1 1 7 ARG HE H 4.889 4.697 1.138 1.00 . A A . 7 ARG HE 1 1
5 1017 1 1 7 ARG HG2 H 2.469 4.052 1.493 1.00 . A A . 7 ARG HG2 1 1
5 1018 1 1 7 ARG HG3 H 3.306 2.687 0.742 1.00 . A A . 7 ARG HG3 1 1
5 1019 1 1 7 ARG HH11 H 4.674 5.475 -2.284 1.00 . A A . 7 ARG HH11 1 1
5 1020 1 1 7 ARG HH12 H 6.278 6.109 -2.380 1.00 . A A . 7 ARG HH12 1 1
5 1021 1 1 7 ARG HH21 H 7.032 5.543 1.012 1.00 . A A . 7 ARG HH21 1 1
5 1022 1 1 7 ARG HH22 H 7.617 6.161 -0.493 1.00 . A A . 7 ARG HH22 1 1
5 1023 1 1 7 ARG N N 1.567 0.827 0.900 1.00 . A A . 7 ARG N 1 1
5 1024 1 1 7 ARG NE N 4.740 4.880 0.180 1.00 . A A . 7 ARG NE 1 1
5 1025 1 1 7 ARG NH1 N 5.544 5.695 -1.834 1.00 . A A . 7 ARG NH1 1 1
5 1026 1 1 7 ARG NH2 N 6.880 5.735 0.037 1.00 . A A . 7 ARG NH2 1 1
5 1027 1 1 7 ARG O O -1.683 1.978 0.357 1.00 . A A . 7 ARG O 1 1
5 1028 1 1 8 ALA C C -2.402 -0.680 -0.917 1.00 . A A . 8 ALA C 1 1
5 1029 1 1 8 ALA CA C -1.498 0.199 -1.777 1.00 . A A . 8 ALA CA 1 1
5 1030 1 1 8 ALA CB C -0.970 -0.586 -2.962 1.00 . A A . 8 ALA CB 1 1
5 1031 1 1 8 ALA H H 0.526 0.455 -1.226 1.00 . A A . 8 ALA H 1 1
5 1032 1 1 8 ALA HA H -2.070 1.036 -2.151 1.00 . A A . 8 ALA HA 1 1
5 1033 1 1 8 ALA HB1 H -0.306 0.040 -3.539 1.00 . A A . 8 ALA HB1 1 1
5 1034 1 1 8 ALA HB2 H -1.795 -0.903 -3.580 1.00 . A A . 8 ALA HB2 1 1
5 1035 1 1 8 ALA HB3 H -0.430 -1.453 -2.608 1.00 . A A . 8 ALA HB3 1 1
5 1036 1 1 8 ALA N N -0.393 0.722 -0.997 1.00 . A A . 8 ALA N 1 1
5 1037 1 1 8 ALA O O -3.633 -0.603 -1.008 1.00 . A A . 8 ALA O 1 1
5 1038 1 1 9 ALA C C -3.338 -1.590 1.812 1.00 . A A . 9 ALA C 1 1
5 1039 1 1 9 ALA CA C -2.513 -2.389 0.816 1.00 . A A . 9 ALA CA 1 1
5 1040 1 1 9 ALA CB C -1.552 -3.318 1.544 1.00 . A A . 9 ALA CB 1 1
5 1041 1 1 9 ALA H H -0.802 -1.536 -0.081 1.00 . A A . 9 ALA H 1 1
5 1042 1 1 9 ALA HA H -3.180 -2.994 0.218 1.00 . A A . 9 ALA HA 1 1
5 1043 1 1 9 ALA HB1 H -2.111 -3.999 2.168 1.00 . A A . 9 ALA HB1 1 1
5 1044 1 1 9 ALA HB2 H -0.883 -2.733 2.159 1.00 . A A . 9 ALA HB2 1 1
5 1045 1 1 9 ALA HB3 H -0.979 -3.881 0.822 1.00 . A A . 9 ALA HB3 1 1
5 1046 1 1 9 ALA N N -1.786 -1.506 -0.081 1.00 . A A . 9 ALA N 1 1
5 1047 1 1 9 ALA O O -4.477 -1.938 2.106 1.00 . A A . 9 ALA O 1 1
5 1048 1 1 10 ARG C C -4.612 1.083 2.589 1.00 . A A . 10 ARG C 1 1
5 1049 1 1 10 ARG CA C -3.459 0.356 3.268 1.00 . A A . 10 ARG CA 1 1
5 1050 1 1 10 ARG CB C -2.498 1.366 3.895 1.00 . A A . 10 ARG CB 1 1
5 1051 1 1 10 ARG CD C -0.462 1.783 5.292 1.00 . A A . 10 ARG CD 1 1
5 1052 1 1 10 ARG CG C -1.395 0.733 4.723 1.00 . A A . 10 ARG CG 1 1
5 1053 1 1 10 ARG CZ C 1.709 1.866 6.469 1.00 . A A . 10 ARG CZ 1 1
5 1054 1 1 10 ARG H H -1.837 -0.294 2.060 1.00 . A A . 10 ARG H 1 1
5 1055 1 1 10 ARG HA H -3.862 -0.274 4.049 1.00 . A A . 10 ARG HA 1 1
5 1056 1 1 10 ARG HB2 H -2.038 1.943 3.106 1.00 . A A . 10 ARG HB2 1 1
5 1057 1 1 10 ARG HB3 H -3.062 2.030 4.533 1.00 . A A . 10 ARG HB3 1 1
5 1058 1 1 10 ARG HD2 H -0.086 2.391 4.483 1.00 . A A . 10 ARG HD2 1 1
5 1059 1 1 10 ARG HD3 H -1.017 2.403 5.980 1.00 . A A . 10 ARG HD3 1 1
5 1060 1 1 10 ARG HE H 0.646 0.206 6.122 1.00 . A A . 10 ARG HE 1 1
5 1061 1 1 10 ARG HG2 H -1.841 0.181 5.538 1.00 . A A . 10 ARG HG2 1 1
5 1062 1 1 10 ARG HG3 H -0.829 0.060 4.097 1.00 . A A . 10 ARG HG3 1 1
5 1063 1 1 10 ARG HH11 H 1.004 3.689 5.917 1.00 . A A . 10 ARG HH11 1 1
5 1064 1 1 10 ARG HH12 H 2.542 3.706 6.705 1.00 . A A . 10 ARG HH12 1 1
5 1065 1 1 10 ARG HH21 H 2.657 0.220 7.170 1.00 . A A . 10 ARG HH21 1 1
5 1066 1 1 10 ARG HH22 H 3.492 1.717 7.429 1.00 . A A . 10 ARG HH22 1 1
5 1067 1 1 10 ARG N N -2.761 -0.509 2.321 1.00 . A A . 10 ARG N 1 1
5 1068 1 1 10 ARG NE N 0.667 1.184 5.999 1.00 . A A . 10 ARG NE 1 1
5 1069 1 1 10 ARG NH1 N 1.755 3.189 6.355 1.00 . A A . 10 ARG NH1 1 1
5 1070 1 1 10 ARG NH2 N 2.698 1.220 7.070 1.00 . A A . 10 ARG NH2 1 1
5 1071 1 1 10 ARG O O -5.610 1.422 3.226 1.00 . A A . 10 ARG O 1 1
5 1072 1 1 11 ALA C C -6.712 1.066 0.366 1.00 . A A . 11 ALA C 1 1
5 1073 1 1 11 ALA CA C -5.503 1.987 0.520 1.00 . A A . 11 ALA CA 1 1
5 1074 1 1 11 ALA CB C -4.971 2.408 -0.843 1.00 . A A . 11 ALA CB 1 1
5 1075 1 1 11 ALA H H -3.616 1.100 0.860 1.00 . A A . 11 ALA H 1 1
5 1076 1 1 11 ALA HA H -5.810 2.874 1.053 1.00 . A A . 11 ALA HA 1 1
5 1077 1 1 11 ALA HB1 H -4.667 1.531 -1.396 1.00 . A A . 11 ALA HB1 1 1
5 1078 1 1 11 ALA HB2 H -4.121 3.062 -0.711 1.00 . A A . 11 ALA HB2 1 1
5 1079 1 1 11 ALA HB3 H -5.745 2.928 -1.388 1.00 . A A . 11 ALA HB3 1 1
5 1080 1 1 11 ALA N N -4.459 1.343 1.299 1.00 . A A . 11 ALA N 1 1
5 1081 1 1 11 ALA O O -7.853 1.484 0.562 1.00 . A A . 11 ALA O 1 1
5 1082 1 1 12 ALA C C -8.057 -1.657 1.186 1.00 . A A . 12 ALA C 1 1
5 1083 1 1 12 ALA CA C -7.515 -1.171 -0.156 1.00 . A A . 12 ALA CA 1 1
5 1084 1 1 12 ALA CB C -7.015 -2.343 -0.988 1.00 . A A . 12 ALA CB 1 1
5 1085 1 1 12 ALA H H -5.517 -0.464 -0.105 1.00 . A A . 12 ALA H 1 1
5 1086 1 1 12 ALA HA H -8.316 -0.689 -0.698 1.00 . A A . 12 ALA HA 1 1
5 1087 1 1 12 ALA HB1 H -7.830 -3.027 -1.173 1.00 . A A . 12 ALA HB1 1 1
5 1088 1 1 12 ALA HB2 H -6.230 -2.855 -0.453 1.00 . A A . 12 ALA HB2 1 1
5 1089 1 1 12 ALA HB3 H -6.630 -1.978 -1.929 1.00 . A A . 12 ALA HB3 1 1
5 1090 1 1 12 ALA N N -6.451 -0.191 0.029 1.00 . A A . 12 ALA N 1 1
5 1091 1 1 12 ALA O O -9.242 -1.972 1.315 1.00 . A A . 12 ALA O 1 1
5 1092 1 1 13 DAL C C -7.219 -3.595 3.757 1.00 . A A . 13 DAL C 1 1
5 1093 1 1 13 DAL CA C -7.576 -2.138 3.513 1.00 . A A . 13 DAL CA 1 1
5 1094 1 1 13 DAL CB C -6.904 -1.257 4.554 1.00 . A A . 13 DAL CB 1 1
5 1095 1 1 13 DAL H H -6.248 -1.485 2.005 1.00 . A A . 13 DAL H 1 1
5 1096 1 1 13 DAL HA H -8.644 -2.015 3.606 1.00 . A A . 13 DAL HA 1 1
5 1097 1 1 13 DAL HB1 H -7.158 -0.223 4.369 1.00 . A A . 13 DAL HB1 1 1
5 1098 1 1 13 DAL HB2 H -5.833 -1.380 4.493 1.00 . A A . 13 DAL HB2 1 1
5 1099 1 1 13 DAL HB3 H -7.242 -1.539 5.539 1.00 . A A . 13 DAL HB3 1 1
5 1100 1 1 13 DAL N N -7.186 -1.719 2.177 1.00 . A A . 13 DAL N 1 1
5 1101 1 1 13 DAL O O -7.868 -4.279 4.550 1.00 . A A . 13 DAL O 1 1
5 1102 1 1 14 CYS C C -4.693 -5.495 4.348 1.00 . A A . 14 CYS C 1 1
5 1103 1 1 14 CYS CA C -5.744 -5.434 3.244 1.00 . A A . 14 CYS CA 1 1
5 1104 1 1 14 CYS CB C -5.177 -5.978 1.930 1.00 . A A . 14 CYS CB 1 1
5 1105 1 1 14 CYS H H -5.739 -3.492 2.424 1.00 . A A . 14 CYS H 1 1
5 1106 1 1 14 CYS HA H -6.593 -6.033 3.537 1.00 . A A . 14 CYS HA 1 1
5 1107 1 1 14 CYS HB2 H -4.189 -6.371 2.116 1.00 . A A . 14 CYS HB2 1 1
5 1108 1 1 14 CYS HB3 H -5.813 -6.779 1.583 1.00 . A A . 14 CYS HB3 1 1
5 1109 1 1 14 CYS N N -6.202 -4.070 3.070 1.00 . A A . 14 CYS N 1 1
5 1110 1 1 14 CYS O O -4.993 -5.855 5.488 1.00 . A A . 14 CYS O 1 1
5 1111 1 1 14 CYS SG S -5.055 -4.747 0.618 1.00 . A A . 14 CYS SG 1 1
5 1112 1 1 15 NH2 HN1 H -2.936 -5.730 3.469 1.00 . A A . 15 NH2 HN1 1 1
5 1113 1 1 15 NH2 HN2 H -3.094 -4.338 4.477 1.00 . A A . 15 NH2 HN2 1 1
5 1114 1 1 15 NH2 N N -3.469 -5.121 4.022 1.00 . A A . 15 NH2 N 1 1
5 1115 2 2 1 . CB1 C 2.494 -7.350 0.829 1.00 . B A . 101 B0I CB1 1 1
5 1116 2 2 1 . CB2 C -4.647 -5.798 -0.789 1.00 . B A . 101 B0I CB2 1 1
5 1117 2 2 1 . CD1 C 0.698 -6.511 -0.667 1.00 . B A . 101 B0I CD1 1 1
5 1118 2 2 1 . CD2 C 2.419 -7.839 -1.625 1.00 . B A . 101 B0I CD2 1 1
5 1119 2 2 1 . CD3 C -2.223 -6.067 -1.378 1.00 . B A . 101 B0I CD3 1 1
5 1120 2 2 1 . CD4 C -3.421 -4.234 -2.316 1.00 . B A . 101 B0I CD4 1 1
5 1121 2 2 1 . CE1 C 0.093 -6.392 -1.905 1.00 . B A . 101 B0I CE1 1 1
5 1122 2 2 1 . CE2 C 1.825 -7.727 -2.866 1.00 . B A . 101 B0I CE2 1 1
5 1123 2 2 1 . CE3 C -1.079 -5.666 -2.042 1.00 . B A . 101 B0I CE3 1 1
5 1124 2 2 1 . CE4 C -2.282 -3.827 -2.981 1.00 . B A . 101 B0I CE4 1 1
5 1125 2 2 1 . CG1 C 1.856 -7.230 -0.515 1.00 . B A . 101 B0I CG1 1 1
5 1126 2 2 1 . CG2 C -3.405 -5.357 -1.508 1.00 . B A . 101 B0I CG2 1 1
5 1127 2 2 1 . CZ1 C 0.661 -7.002 -3.007 1.00 . B A . 101 B0I CZ1 1 1
5 1128 2 2 1 . CZ2 C -1.109 -4.543 -2.845 1.00 . B A . 101 B0I CZ2 1 1
5 1129 2 2 1 . H1 H 3.464 -7.786 0.692 1.00 . B A . 101 B0I H1 1 1
5 1130 2 2 1 . H2 H -4.491 -6.806 -0.437 1.00 . B A . 101 B0I H2 1 1
5 1131 2 2 1 . HB11 H 1.884 -7.999 1.439 1.00 . B A . 101 B0I HB11 1 1
5 1132 2 2 1 . HB21 H -5.470 -5.781 -1.487 1.00 . B A . 101 B0I HB21 1 1
5 1133 2 2 1 . HD1 H 0.273 -6.041 0.204 1.00 . B A . 101 B0I HD1 1 1
5 1134 2 2 1 . HD2 H 3.330 -8.406 -1.512 1.00 . B A . 101 B0I HD2 1 1
5 1135 2 2 1 . HD3 H -2.199 -6.946 -0.751 1.00 . B A . 101 B0I HD3 1 1
5 1136 2 2 1 . HD4 H -4.337 -3.672 -2.426 1.00 . B A . 101 B0I HD4 1 1
5 1137 2 2 1 . HE2 H 2.272 -8.207 -3.725 1.00 . B A . 101 B0I HE2 1 1
5 1138 2 2 1 . HE4 H -2.309 -2.949 -3.608 1.00 . B A . 101 B0I HE4 1 1
5 1139 2 2 1 . HZ1 H 0.194 -6.912 -3.976 1.00 . B A . 101 B0I HZ1 1 1
5 1140 2 2 1 . HZ2 H -0.217 -4.224 -3.364 1.00 . B A . 101 B0I HZ2 1 1
6 1141 1 1 1 . C C 7.247 -4.832 0.820 1.00 . A A . 1 H00 C 1 1
6 1142 1 1 1 . CA C 6.543 -6.146 1.086 1.00 . A A . 1 H00 CA 1 1
6 1143 1 1 1 . CB C 5.453 -5.957 2.128 1.00 . A A . 1 H00 CB 1 1
6 1144 1 1 1 . CG C 4.327 -5.080 1.599 1.00 . A A . 1 H00 CG 1 1
6 1145 1 1 1 . HA1 H 7.260 -6.868 1.451 1.00 . A A . 1 H00 HA1 1 1
6 1146 1 1 1 . HA2 H 6.102 -6.507 0.168 1.00 . A A . 1 H00 HA2 1 1
6 1147 1 1 1 . HB1 H 5.883 -5.488 3.002 1.00 . A A . 1 H00 HB1 1 1
6 1148 1 1 1 . HB2 H 5.050 -6.923 2.394 1.00 . A A . 1 H00 HB2 1 1
6 1149 1 1 1 . HG1 H 4.033 -5.447 0.625 1.00 . A A . 1 H00 HG1 1 1
6 1150 1 1 1 . HG2 H 4.692 -4.067 1.507 1.00 . A A . 1 H00 HG2 1 1
6 1151 1 1 1 . O O 7.950 -4.305 1.692 1.00 . A A . 1 H00 O 1 1
6 1152 1 1 1 . SD S 2.881 -5.073 2.676 1.00 . A A . 1 H00 SD 1 1
6 1153 1 1 2 THR C C 6.853 -1.871 -0.181 1.00 . A A . 2 THR C 1 1
6 1154 1 1 2 THR CA C 7.677 -3.036 -0.737 1.00 . A A . 2 THR CA 1 1
6 1155 1 1 2 THR CB C 7.798 -2.899 -2.273 1.00 . A A . 2 THR CB 1 1
6 1156 1 1 2 THR CG2 C 8.614 -4.047 -2.851 1.00 . A A . 2 THR CG2 1 1
6 1157 1 1 2 THR H H 6.491 -4.756 -1.029 1.00 . A A . 2 THR H 1 1
6 1158 1 1 2 THR HA H 8.667 -3.008 -0.307 1.00 . A A . 2 THR HA 1 1
6 1159 1 1 2 THR HB H 8.293 -1.967 -2.502 1.00 . A A . 2 THR HB 1 1
6 1160 1 1 2 THR HG1 H 6.509 -3.437 -3.670 1.00 . A A . 2 THR HG1 1 1
6 1161 1 1 2 THR HG21 H 8.122 -4.983 -2.633 1.00 . A A . 2 THR HG21 1 1
6 1162 1 1 2 THR HG22 H 9.599 -4.046 -2.409 1.00 . A A . 2 THR HG22 1 1
6 1163 1 1 2 THR HG23 H 8.700 -3.926 -3.920 1.00 . A A . 2 THR HG23 1 1
6 1164 1 1 2 THR N N 7.063 -4.296 -0.373 1.00 . A A . 2 THR N 1 1
6 1165 1 1 2 THR O O 5.666 -2.039 0.130 1.00 . A A . 2 THR O 1 1
6 1166 1 1 2 THR OG1 O 6.493 -2.895 -2.869 1.00 . A A . 2 THR OG1 1 1
6 1167 1 1 3 PRO C C 5.520 0.821 -0.349 1.00 . A A . 3 PRO C 1 1
6 1168 1 1 3 PRO CA C 6.762 0.510 0.476 1.00 . A A . 3 PRO CA 1 1
6 1169 1 1 3 PRO CB C 7.797 1.632 0.328 1.00 . A A . 3 PRO CB 1 1
6 1170 1 1 3 PRO CD C 8.884 -0.387 -0.322 1.00 . A A . 3 PRO CD 1 1
6 1171 1 1 3 PRO CG C 9.109 0.931 0.357 1.00 . A A . 3 PRO CG 1 1
6 1172 1 1 3 PRO HA H 6.488 0.395 1.514 1.00 . A A . 3 PRO HA 1 1
6 1173 1 1 3 PRO HB2 H 7.641 2.146 -0.610 1.00 . A A . 3 PRO HB2 1 1
6 1174 1 1 3 PRO HB3 H 7.702 2.326 1.150 1.00 . A A . 3 PRO HB3 1 1
6 1175 1 1 3 PRO HD2 H 9.051 -0.297 -1.386 1.00 . A A . 3 PRO HD2 1 1
6 1176 1 1 3 PRO HD3 H 9.526 -1.145 0.101 1.00 . A A . 3 PRO HD3 1 1
6 1177 1 1 3 PRO HG2 H 9.848 1.511 -0.177 1.00 . A A . 3 PRO HG2 1 1
6 1178 1 1 3 PRO HG3 H 9.419 0.777 1.379 1.00 . A A . 3 PRO HG3 1 1
6 1179 1 1 3 PRO N N 7.465 -0.674 -0.030 1.00 . A A . 3 PRO N 1 1
6 1180 1 1 3 PRO O O 4.480 1.192 0.191 1.00 . A A . 3 PRO O 1 1
6 1181 1 1 4 ARG C C 3.386 -0.070 -2.319 1.00 . A A . 4 ARG C 1 1
6 1182 1 1 4 ARG CA C 4.533 0.889 -2.582 1.00 . A A . 4 ARG CA 1 1
6 1183 1 1 4 ARG CB C 5.016 0.751 -4.020 1.00 . A A . 4 ARG CB 1 1
6 1184 1 1 4 ARG CD C 6.640 1.505 -5.788 1.00 . A A . 4 ARG CD 1 1
6 1185 1 1 4 ARG CG C 6.161 1.679 -4.355 1.00 . A A . 4 ARG CG 1 1
6 1186 1 1 4 ARG CZ C 8.633 2.374 -6.994 1.00 . A A . 4 ARG CZ 1 1
6 1187 1 1 4 ARG H H 6.487 0.307 -2.014 1.00 . A A . 4 ARG H 1 1
6 1188 1 1 4 ARG HA H 4.191 1.900 -2.421 1.00 . A A . 4 ARG HA 1 1
6 1189 1 1 4 ARG HB2 H 5.344 -0.265 -4.180 1.00 . A A . 4 ARG HB2 1 1
6 1190 1 1 4 ARG HB3 H 4.196 0.965 -4.689 1.00 . A A . 4 ARG HB3 1 1
6 1191 1 1 4 ARG HD2 H 7.117 0.541 -5.881 1.00 . A A . 4 ARG HD2 1 1
6 1192 1 1 4 ARG HD3 H 5.789 1.553 -6.450 1.00 . A A . 4 ARG HD3 1 1
6 1193 1 1 4 ARG HE H 7.451 3.441 -5.783 1.00 . A A . 4 ARG HE 1 1
6 1194 1 1 4 ARG HG2 H 5.846 2.702 -4.208 1.00 . A A . 4 ARG HG2 1 1
6 1195 1 1 4 ARG HG3 H 6.972 1.445 -3.680 1.00 . A A . 4 ARG HG3 1 1
6 1196 1 1 4 ARG HH11 H 8.272 0.402 -7.341 1.00 . A A . 4 ARG HH11 1 1
6 1197 1 1 4 ARG HH12 H 9.649 1.057 -8.155 1.00 . A A . 4 ARG HH12 1 1
6 1198 1 1 4 ARG HH21 H 9.262 4.301 -6.873 1.00 . A A . 4 ARG HH21 1 1
6 1199 1 1 4 ARG HH22 H 10.214 3.276 -7.895 1.00 . A A . 4 ARG HH22 1 1
6 1200 1 1 4 ARG N N 5.634 0.635 -1.660 1.00 . A A . 4 ARG N 1 1
6 1201 1 1 4 ARG NE N 7.599 2.549 -6.168 1.00 . A A . 4 ARG NE 1 1
6 1202 1 1 4 ARG NH1 N 8.868 1.185 -7.540 1.00 . A A . 4 ARG NH1 1 1
6 1203 1 1 4 ARG NH2 N 9.432 3.397 -7.276 1.00 . A A . 4 ARG NH2 1 1
6 1204 1 1 4 ARG O O 2.221 0.339 -2.263 1.00 . A A . 4 ARG O 1 1
6 1205 1 1 5 GLN C C 2.012 -2.078 -0.541 1.00 . A A . 5 GLN C 1 1
6 1206 1 1 5 GLN CA C 2.721 -2.370 -1.855 1.00 . A A . 5 GLN CA 1 1
6 1207 1 1 5 GLN CB C 3.363 -3.754 -1.787 1.00 . A A . 5 GLN CB 1 1
6 1208 1 1 5 GLN CD C 4.472 -5.657 -2.998 1.00 . A A . 5 GLN CD 1 1
6 1209 1 1 5 GLN CG C 3.724 -4.347 -3.135 1.00 . A A . 5 GLN CG 1 1
6 1210 1 1 5 GLN H H 4.667 -1.596 -2.241 1.00 . A A . 5 GLN H 1 1
6 1211 1 1 5 GLN HA H 1.992 -2.363 -2.651 1.00 . A A . 5 GLN HA 1 1
6 1212 1 1 5 GLN HB2 H 4.269 -3.686 -1.200 1.00 . A A . 5 GLN HB2 1 1
6 1213 1 1 5 GLN HB3 H 2.677 -4.428 -1.293 1.00 . A A . 5 GLN HB3 1 1
6 1214 1 1 5 GLN HE21 H 3.661 -6.326 -4.678 1.00 . A A . 5 GLN HE21 1 1
6 1215 1 1 5 GLN HE22 H 4.750 -7.407 -3.874 1.00 . A A . 5 GLN HE22 1 1
6 1216 1 1 5 GLN HG2 H 2.815 -4.523 -3.694 1.00 . A A . 5 GLN HG2 1 1
6 1217 1 1 5 GLN HG3 H 4.346 -3.645 -3.670 1.00 . A A . 5 GLN HG3 1 1
6 1218 1 1 5 GLN N N 3.721 -1.343 -2.153 1.00 . A A . 5 GLN N 1 1
6 1219 1 1 5 GLN NE2 N 4.275 -6.551 -3.943 1.00 . A A . 5 GLN NE2 1 1
6 1220 1 1 5 GLN O O 0.793 -2.178 -0.452 1.00 . A A . 5 GLN O 1 1
6 1221 1 1 5 GLN OE1 O 5.216 -5.863 -2.037 1.00 . A A . 5 GLN OE1 1 1
6 1222 1 1 6 ALA C C 1.238 -0.250 1.735 1.00 . A A . 6 ALA C 1 1
6 1223 1 1 6 ALA CA C 2.237 -1.407 1.792 1.00 . A A . 6 ALA CA 1 1
6 1224 1 1 6 ALA CB C 3.356 -1.095 2.769 1.00 . A A . 6 ALA CB 1 1
6 1225 1 1 6 ALA H H 3.756 -1.643 0.330 1.00 . A A . 6 ALA H 1 1
6 1226 1 1 6 ALA HA H 1.721 -2.290 2.140 1.00 . A A . 6 ALA HA 1 1
6 1227 1 1 6 ALA HB1 H 3.888 -0.217 2.436 1.00 . A A . 6 ALA HB1 1 1
6 1228 1 1 6 ALA HB2 H 4.036 -1.933 2.816 1.00 . A A . 6 ALA HB2 1 1
6 1229 1 1 6 ALA HB3 H 2.939 -0.914 3.748 1.00 . A A . 6 ALA HB3 1 1
6 1230 1 1 6 ALA N N 2.785 -1.706 0.472 1.00 . A A . 6 ALA N 1 1
6 1231 1 1 6 ALA O O 0.184 -0.297 2.374 1.00 . A A . 6 ALA O 1 1
6 1232 1 1 7 ARG C C -0.582 1.534 0.086 1.00 . A A . 7 ARG C 1 1
6 1233 1 1 7 ARG CA C 0.684 1.940 0.811 1.00 . A A . 7 ARG CA 1 1
6 1234 1 1 7 ARG CB C 1.386 3.056 0.043 1.00 . A A . 7 ARG CB 1 1
6 1235 1 1 7 ARG CD C 3.358 4.590 -0.120 1.00 . A A . 7 ARG CD 1 1
6 1236 1 1 7 ARG CG C 2.655 3.530 0.705 1.00 . A A . 7 ARG CG 1 1
6 1237 1 1 7 ARG CZ C 5.381 6.003 0.046 1.00 . A A . 7 ARG CZ 1 1
6 1238 1 1 7 ARG H H 2.429 0.766 0.490 1.00 . A A . 7 ARG H 1 1
6 1239 1 1 7 ARG HA H 0.425 2.295 1.797 1.00 . A A . 7 ARG HA 1 1
6 1240 1 1 7 ARG HB2 H 1.631 2.699 -0.946 1.00 . A A . 7 ARG HB2 1 1
6 1241 1 1 7 ARG HB3 H 0.714 3.895 -0.043 1.00 . A A . 7 ARG HB3 1 1
6 1242 1 1 7 ARG HD2 H 3.594 4.175 -1.088 1.00 . A A . 7 ARG HD2 1 1
6 1243 1 1 7 ARG HD3 H 2.697 5.434 -0.241 1.00 . A A . 7 ARG HD3 1 1
6 1244 1 1 7 ARG HE H 4.851 4.589 1.355 1.00 . A A . 7 ARG HE 1 1
6 1245 1 1 7 ARG HG2 H 2.415 3.940 1.674 1.00 . A A . 7 ARG HG2 1 1
6 1246 1 1 7 ARG HG3 H 3.309 2.678 0.817 1.00 . A A . 7 ARG HG3 1 1
6 1247 1 1 7 ARG HH11 H 4.222 6.413 -1.572 1.00 . A A . 7 ARG HH11 1 1
6 1248 1 1 7 ARG HH12 H 5.648 7.379 -1.419 1.00 . A A . 7 ARG HH12 1 1
6 1249 1 1 7 ARG HH21 H 6.742 5.851 1.545 1.00 . A A . 7 ARG HH21 1 1
6 1250 1 1 7 ARG HH22 H 7.093 7.046 0.345 1.00 . A A . 7 ARG HH22 1 1
6 1251 1 1 7 ARG N N 1.569 0.782 0.964 1.00 . A A . 7 ARG N 1 1
6 1252 1 1 7 ARG NE N 4.594 5.040 0.518 1.00 . A A . 7 ARG NE 1 1
6 1253 1 1 7 ARG NH1 N 5.058 6.644 -1.070 1.00 . A A . 7 ARG NH1 1 1
6 1254 1 1 7 ARG NH2 N 6.489 6.327 0.695 1.00 . A A . 7 ARG NH2 1 1
6 1255 1 1 7 ARG O O -1.684 1.943 0.453 1.00 . A A . 7 ARG O 1 1
6 1256 1 1 8 ALA C C -2.448 -0.649 -0.850 1.00 . A A . 8 ALA C 1 1
6 1257 1 1 8 ALA CA C -1.536 0.218 -1.717 1.00 . A A . 8 ALA CA 1 1
6 1258 1 1 8 ALA CB C -1.035 -0.567 -2.919 1.00 . A A . 8 ALA CB 1 1
6 1259 1 1 8 ALA H H 0.502 0.446 -1.176 1.00 . A A . 8 ALA H 1 1
6 1260 1 1 8 ALA HA H -2.099 1.068 -2.075 1.00 . A A . 8 ALA HA 1 1
6 1261 1 1 8 ALA HB1 H -1.875 -0.890 -3.513 1.00 . A A . 8 ALA HB1 1 1
6 1262 1 1 8 ALA HB2 H -0.479 -1.428 -2.580 1.00 . A A . 8 ALA HB2 1 1
6 1263 1 1 8 ALA HB3 H -0.392 0.063 -3.516 1.00 . A A . 8 ALA HB3 1 1
6 1264 1 1 8 ALA N N -0.413 0.717 -0.938 1.00 . A A . 8 ALA N 1 1
6 1265 1 1 8 ALA O O -3.673 -0.551 -0.925 1.00 . A A . 8 ALA O 1 1
6 1266 1 1 9 ALA C C -3.339 -1.516 1.910 1.00 . A A . 9 ALA C 1 1
6 1267 1 1 9 ALA CA C -2.574 -2.349 0.893 1.00 . A A . 9 ALA CA 1 1
6 1268 1 1 9 ALA CB C -1.631 -3.312 1.595 1.00 . A A . 9 ALA CB 1 1
6 1269 1 1 9 ALA H H -0.853 -1.537 -0.029 1.00 . A A . 9 ALA H 1 1
6 1270 1 1 9 ALA HA H -3.279 -2.926 0.310 1.00 . A A . 9 ALA HA 1 1
6 1271 1 1 9 ALA HB1 H -0.912 -2.752 2.175 1.00 . A A . 9 ALA HB1 1 1
6 1272 1 1 9 ALA HB2 H -1.113 -3.909 0.860 1.00 . A A . 9 ALA HB2 1 1
6 1273 1 1 9 ALA HB3 H -2.196 -3.958 2.251 1.00 . A A . 9 ALA HB3 1 1
6 1274 1 1 9 ALA N N -1.836 -1.489 -0.020 1.00 . A A . 9 ALA N 1 1
6 1275 1 1 9 ALA O O -4.454 -1.860 2.296 1.00 . A A . 9 ALA O 1 1
6 1276 1 1 10 ARG C C -4.618 1.090 2.693 1.00 . A A . 10 ARG C 1 1
6 1277 1 1 10 ARG CA C -3.337 0.500 3.278 1.00 . A A . 10 ARG CA 1 1
6 1278 1 1 10 ARG CB C -2.349 1.622 3.609 1.00 . A A . 10 ARG CB 1 1
6 1279 1 1 10 ARG CD C -1.896 3.788 4.784 1.00 . A A . 10 ARG CD 1 1
6 1280 1 1 10 ARG CG C -2.858 2.619 4.628 1.00 . A A . 10 ARG CG 1 1
6 1281 1 1 10 ARG CZ C -0.986 5.623 3.375 1.00 . A A . 10 ARG CZ 1 1
6 1282 1 1 10 ARG H H -1.825 -0.217 2.007 1.00 . A A . 10 ARG H 1 1
6 1283 1 1 10 ARG HA H -3.571 -0.043 4.181 1.00 . A A . 10 ARG HA 1 1
6 1284 1 1 10 ARG HB2 H -1.442 1.183 3.996 1.00 . A A . 10 ARG HB2 1 1
6 1285 1 1 10 ARG HB3 H -2.117 2.156 2.700 1.00 . A A . 10 ARG HB3 1 1
6 1286 1 1 10 ARG HD2 H -2.298 4.475 5.514 1.00 . A A . 10 ARG HD2 1 1
6 1287 1 1 10 ARG HD3 H -0.944 3.413 5.130 1.00 . A A . 10 ARG HD3 1 1
6 1288 1 1 10 ARG HE H -2.128 4.111 2.719 1.00 . A A . 10 ARG HE 1 1
6 1289 1 1 10 ARG HG2 H -3.820 2.991 4.308 1.00 . A A . 10 ARG HG2 1 1
6 1290 1 1 10 ARG HG3 H -2.959 2.112 5.574 1.00 . A A . 10 ARG HG3 1 1
6 1291 1 1 10 ARG HH11 H -0.493 5.784 5.340 1.00 . A A . 10 ARG HH11 1 1
6 1292 1 1 10 ARG HH12 H 0.124 7.038 4.320 1.00 . A A . 10 ARG HH12 1 1
6 1293 1 1 10 ARG HH21 H -1.297 5.759 1.371 1.00 . A A . 10 ARG HH21 1 1
6 1294 1 1 10 ARG HH22 H -0.340 7.027 2.058 1.00 . A A . 10 ARG HH22 1 1
6 1295 1 1 10 ARG N N -2.728 -0.417 2.334 1.00 . A A . 10 ARG N 1 1
6 1296 1 1 10 ARG NE N -1.697 4.500 3.517 1.00 . A A . 10 ARG NE 1 1
6 1297 1 1 10 ARG NH1 N -0.407 6.191 4.428 1.00 . A A . 10 ARG NH1 1 1
6 1298 1 1 10 ARG NH2 N -0.862 6.178 2.174 1.00 . A A . 10 ARG NH2 1 1
6 1299 1 1 10 ARG O O -5.651 1.151 3.364 1.00 . A A . 10 ARG O 1 1
6 1300 1 1 11 ALA C C -6.761 1.060 0.491 1.00 . A A . 11 ALA C 1 1
6 1301 1 1 11 ALA CA C -5.675 2.102 0.746 1.00 . A A . 11 ALA CA 1 1
6 1302 1 1 11 ALA CB C -5.226 2.720 -0.567 1.00 . A A . 11 ALA CB 1 1
6 1303 1 1 11 ALA H H -3.677 1.453 0.970 1.00 . A A . 11 ALA H 1 1
6 1304 1 1 11 ALA HA H -6.081 2.887 1.367 1.00 . A A . 11 ALA HA 1 1
6 1305 1 1 11 ALA HB1 H -4.467 3.463 -0.378 1.00 . A A . 11 ALA HB1 1 1
6 1306 1 1 11 ALA HB2 H -6.072 3.183 -1.054 1.00 . A A . 11 ALA HB2 1 1
6 1307 1 1 11 ALA HB3 H -4.822 1.948 -1.205 1.00 . A A . 11 ALA HB3 1 1
6 1308 1 1 11 ALA N N -4.536 1.522 1.441 1.00 . A A . 11 ALA N 1 1
6 1309 1 1 11 ALA O O -7.943 1.305 0.744 1.00 . A A . 11 ALA O 1 1
6 1310 1 1 12 ALA C C -7.945 -1.756 0.923 1.00 . A A . 12 ALA C 1 1
6 1311 1 1 12 ALA CA C -7.286 -1.170 -0.326 1.00 . A A . 12 ALA CA 1 1
6 1312 1 1 12 ALA CB C -6.588 -2.254 -1.132 1.00 . A A . 12 ALA CB 1 1
6 1313 1 1 12 ALA H H -5.390 -0.243 -0.155 1.00 . A A . 12 ALA H 1 1
6 1314 1 1 12 ALA HA H -8.060 -0.742 -0.948 1.00 . A A . 12 ALA HA 1 1
6 1315 1 1 12 ALA HB1 H -7.315 -2.983 -1.460 1.00 . A A . 12 ALA HB1 1 1
6 1316 1 1 12 ALA HB2 H -5.846 -2.740 -0.516 1.00 . A A . 12 ALA HB2 1 1
6 1317 1 1 12 ALA HB3 H -6.108 -1.813 -1.992 1.00 . A A . 12 ALA HB3 1 1
6 1318 1 1 12 ALA N N -6.351 -0.102 0.002 1.00 . A A . 12 ALA N 1 1
6 1319 1 1 12 ALA O O -9.112 -2.142 0.892 1.00 . A A . 12 ALA O 1 1
6 1320 1 1 13 DAL C C -7.239 -3.753 3.543 1.00 . A A . 13 DAL C 1 1
6 1321 1 1 13 DAL CA C -7.737 -2.338 3.270 1.00 . A A . 13 DAL CA 1 1
6 1322 1 1 13 DAL CB C -7.372 -1.417 4.422 1.00 . A A . 13 DAL CB 1 1
6 1323 1 1 13 DAL H H -6.270 -1.504 1.983 1.00 . A A . 13 DAL H 1 1
6 1324 1 1 13 DAL HA H -8.813 -2.360 3.186 1.00 . A A . 13 DAL HA 1 1
6 1325 1 1 13 DAL HB1 H -7.729 -0.420 4.212 1.00 . A A . 13 DAL HB1 1 1
6 1326 1 1 13 DAL HB2 H -6.299 -1.398 4.542 1.00 . A A . 13 DAL HB2 1 1
6 1327 1 1 13 DAL HB3 H -7.830 -1.780 5.329 1.00 . A A . 13 DAL HB3 1 1
6 1328 1 1 13 DAL N N -7.202 -1.817 2.016 1.00 . A A . 13 DAL N 1 1
6 1329 1 1 13 DAL O O -7.888 -4.528 4.247 1.00 . A A . 13 DAL O 1 1
6 1330 1 1 14 CYS C C -4.536 -5.398 4.355 1.00 . A A . 14 CYS C 1 1
6 1331 1 1 14 CYS CA C -5.506 -5.401 3.178 1.00 . A A . 14 CYS CA 1 1
6 1332 1 1 14 CYS CB C -4.797 -5.851 1.904 1.00 . A A . 14 CYS CB 1 1
6 1333 1 1 14 CYS H H -5.615 -3.427 2.436 1.00 . A A . 14 CYS H 1 1
6 1334 1 1 14 CYS HA H -6.310 -6.091 3.393 1.00 . A A . 14 CYS HA 1 1
6 1335 1 1 14 CYS HB2 H -3.732 -5.729 2.038 1.00 . A A . 14 CYS HB2 1 1
6 1336 1 1 14 CYS HB3 H -5.011 -6.896 1.736 1.00 . A A . 14 CYS HB3 1 1
6 1337 1 1 14 CYS N N -6.091 -4.085 2.989 1.00 . A A . 14 CYS N 1 1
6 1338 1 1 14 CYS O O -3.361 -5.043 4.210 1.00 . A A . 14 CYS O 1 1
6 1339 1 1 14 CYS SG S -5.285 -4.934 0.433 1.00 . A A . 14 CYS SG 1 1
6 1340 1 1 15 NH2 HN1 H -4.743 -6.636 5.879 1.00 . A A . 15 NH2 HN1 1 1
6 1341 1 1 15 NH2 HN2 H -5.793 -5.269 5.872 1.00 . A A . 15 NH2 HN2 1 1
6 1342 1 1 15 NH2 N N -5.025 -5.769 5.521 1.00 . A A . 15 NH2 N 1 1
6 1343 2 2 1 . CB1 C 2.261 -6.752 2.435 1.00 . B A . 101 B0I CB1 1 1
6 1344 2 2 1 . CB2 C -4.600 -5.987 -0.859 1.00 . B A . 101 B0I CB2 1 1
6 1345 2 2 1 . CD1 C 0.710 -6.338 0.549 1.00 . B A . 101 B0I CD1 1 1
6 1346 2 2 1 . CD2 C 2.448 -7.918 0.222 1.00 . B A . 101 B0I CD2 1 1
6 1347 2 2 1 . CD3 C -2.111 -6.250 -0.823 1.00 . B A . 101 B0I CD3 1 1
6 1348 2 2 1 . CD4 C -3.045 -4.493 -2.132 1.00 . B A . 101 B0I CD4 1 1
6 1349 2 2 1 . CE1 C 0.259 -6.556 -0.737 1.00 . B A . 101 B0I CE1 1 1
6 1350 2 2 1 . CE2 C 2.009 -8.147 -1.067 1.00 . B A . 101 B0I CE2 1 1
6 1351 2 2 1 . CE3 C -0.842 -5.867 -1.207 1.00 . B A . 101 B0I CE3 1 1
6 1352 2 2 1 . CE4 C -1.780 -4.105 -2.520 1.00 . B A . 101 B0I CE4 1 1
6 1353 2 2 1 . CG1 C 1.796 -7.007 1.039 1.00 . B A . 101 B0I CG1 1 1
6 1354 2 2 1 . CG2 C -3.226 -5.569 -1.280 1.00 . B A . 101 B0I CG2 1 1
6 1355 2 2 1 . CZ1 C 0.910 -7.463 -1.549 1.00 . B A . 101 B0I CZ1 1 1
6 1356 2 2 1 . CZ2 C -0.675 -4.793 -2.057 1.00 . B A . 101 B0I CZ2 1 1
6 1357 2 2 1 . H1 H 3.045 -7.450 2.655 1.00 . B A . 101 B0I H1 1 1
6 1358 2 2 1 . H2 H -4.546 -6.999 -0.489 1.00 . B A . 101 B0I H2 1 1
6 1359 2 2 1 . HB11 H 1.431 -6.916 3.105 1.00 . B A . 101 B0I HB11 1 1
6 1360 2 2 1 . HB21 H -5.247 -5.949 -1.721 1.00 . B A . 101 B0I HB21 1 1
6 1361 2 2 1 . HD1 H 0.213 -5.633 1.195 1.00 . B A . 101 B0I HD1 1 1
6 1362 2 2 1 . HD2 H 3.308 -8.451 0.601 1.00 . B A . 101 B0I HD2 1 1
6 1363 2 2 1 . HD3 H -2.241 -7.092 -0.159 1.00 . B A . 101 B0I HD3 1 1
6 1364 2 2 1 . HD4 H -3.908 -3.954 -2.495 1.00 . B A . 101 B0I HD4 1 1
6 1365 2 2 1 . HE2 H 2.524 -8.858 -1.697 1.00 . B A . 101 B0I HE2 1 1
6 1366 2 2 1 . HE4 H -1.653 -3.263 -3.183 1.00 . B A . 101 B0I HE4 1 1
6 1367 2 2 1 . HZ1 H 0.561 -7.638 -2.556 1.00 . B A . 101 B0I HZ1 1 1
6 1368 2 2 1 . HZ2 H 0.316 -4.490 -2.360 1.00 . B A . 101 B0I HZ2 1 1
7 1369 1 1 1 . C C 4.945 -5.601 0.095 1.00 . A A . 1 H00 C 1 1
7 1370 1 1 1 . CA C 3.869 -6.387 -0.620 1.00 . A A . 1 H00 CA 1 1
7 1371 1 1 1 . CB C 2.630 -6.492 0.255 1.00 . A A . 1 H00 CB 1 1
7 1372 1 1 1 . CG C 1.928 -5.150 0.388 1.00 . A A . 1 H00 CG 1 1
7 1373 1 1 1 . HA1 H 4.236 -7.379 -0.838 1.00 . A A . 1 H00 HA1 1 1
7 1374 1 1 1 . HA2 H 3.614 -5.884 -1.543 1.00 . A A . 1 H00 HA2 1 1
7 1375 1 1 1 . HB1 H 2.924 -6.835 1.237 1.00 . A A . 1 H00 HB1 1 1
7 1376 1 1 1 . HB2 H 1.948 -7.201 -0.188 1.00 . A A . 1 H00 HB2 1 1
7 1377 1 1 1 . HG1 H 1.948 -4.653 -0.571 1.00 . A A . 1 H00 HG1 1 1
7 1378 1 1 1 . HG2 H 2.457 -4.552 1.116 1.00 . A A . 1 H00 HG2 1 1
7 1379 1 1 1 . O O 5.421 -6.009 1.162 1.00 . A A . 1 H00 O 1 1
7 1380 1 1 1 . SD S 0.209 -5.312 0.919 1.00 . A A . 1 H00 SD 1 1
7 1381 1 1 2 THR C C 5.689 -2.719 1.160 1.00 . A A . 2 THR C 1 1
7 1382 1 1 2 THR CA C 6.335 -3.631 0.116 1.00 . A A . 2 THR CA 1 1
7 1383 1 1 2 THR CB C 7.044 -2.771 -0.955 1.00 . A A . 2 THR CB 1 1
7 1384 1 1 2 THR CG2 C 7.754 -3.654 -1.970 1.00 . A A . 2 THR CG2 1 1
7 1385 1 1 2 THR H H 4.928 -4.218 -1.339 1.00 . A A . 2 THR H 1 1
7 1386 1 1 2 THR HA H 7.068 -4.260 0.599 1.00 . A A . 2 THR HA 1 1
7 1387 1 1 2 THR HB H 7.773 -2.137 -0.473 1.00 . A A . 2 THR HB 1 1
7 1388 1 1 2 THR HG1 H 5.943 -2.301 -2.517 1.00 . A A . 2 THR HG1 1 1
7 1389 1 1 2 THR HG21 H 8.497 -4.255 -1.469 1.00 . A A . 2 THR HG21 1 1
7 1390 1 1 2 THR HG22 H 8.233 -3.035 -2.713 1.00 . A A . 2 THR HG22 1 1
7 1391 1 1 2 THR HG23 H 7.033 -4.300 -2.451 1.00 . A A . 2 THR HG23 1 1
7 1392 1 1 2 THR N N 5.332 -4.482 -0.482 1.00 . A A . 2 THR N 1 1
7 1393 1 1 2 THR O O 4.471 -2.497 1.124 1.00 . A A . 2 THR O 1 1
7 1394 1 1 2 THR OG1 O 6.087 -1.947 -1.631 1.00 . A A . 2 THR OG1 1 1
7 1395 1 1 3 PRO C C 5.211 -0.099 2.560 1.00 . A A . 3 PRO C 1 1
7 1396 1 1 3 PRO CA C 5.981 -1.281 3.153 1.00 . A A . 3 PRO CA 1 1
7 1397 1 1 3 PRO CB C 7.260 -0.786 3.859 1.00 . A A . 3 PRO CB 1 1
7 1398 1 1 3 PRO CD C 7.919 -2.449 2.276 1.00 . A A . 3 PRO CD 1 1
7 1399 1 1 3 PRO CG C 8.393 -1.220 2.983 1.00 . A A . 3 PRO CG 1 1
7 1400 1 1 3 PRO HA H 5.351 -1.800 3.860 1.00 . A A . 3 PRO HA 1 1
7 1401 1 1 3 PRO HB2 H 7.227 0.290 3.953 1.00 . A A . 3 PRO HB2 1 1
7 1402 1 1 3 PRO HB3 H 7.327 -1.237 4.839 1.00 . A A . 3 PRO HB3 1 1
7 1403 1 1 3 PRO HD2 H 8.412 -2.551 1.322 1.00 . A A . 3 PRO HD2 1 1
7 1404 1 1 3 PRO HD3 H 8.085 -3.325 2.885 1.00 . A A . 3 PRO HD3 1 1
7 1405 1 1 3 PRO HG2 H 8.622 -0.443 2.269 1.00 . A A . 3 PRO HG2 1 1
7 1406 1 1 3 PRO HG3 H 9.260 -1.445 3.587 1.00 . A A . 3 PRO HG3 1 1
7 1407 1 1 3 PRO N N 6.484 -2.189 2.114 1.00 . A A . 3 PRO N 1 1
7 1408 1 1 3 PRO O O 4.255 0.392 3.153 1.00 . A A . 3 PRO O 1 1
7 1409 1 1 4 ARG C C 3.618 1.032 0.177 1.00 . A A . 4 ARG C 1 1
7 1410 1 1 4 ARG CA C 4.985 1.451 0.697 1.00 . A A . 4 ARG CA 1 1
7 1411 1 1 4 ARG CB C 5.858 1.948 -0.452 1.00 . A A . 4 ARG CB 1 1
7 1412 1 1 4 ARG CD C 8.076 2.885 -1.163 1.00 . A A . 4 ARG CD 1 1
7 1413 1 1 4 ARG CG C 7.278 2.263 -0.032 1.00 . A A . 4 ARG CG 1 1
7 1414 1 1 4 ARG CZ C 10.197 4.159 -1.323 1.00 . A A . 4 ARG CZ 1 1
7 1415 1 1 4 ARG H H 6.392 -0.108 0.955 1.00 . A A . 4 ARG H 1 1
7 1416 1 1 4 ARG HA H 4.856 2.250 1.413 1.00 . A A . 4 ARG HA 1 1
7 1417 1 1 4 ARG HB2 H 5.891 1.189 -1.220 1.00 . A A . 4 ARG HB2 1 1
7 1418 1 1 4 ARG HB3 H 5.418 2.845 -0.861 1.00 . A A . 4 ARG HB3 1 1
7 1419 1 1 4 ARG HD2 H 8.121 2.184 -1.983 1.00 . A A . 4 ARG HD2 1 1
7 1420 1 1 4 ARG HD3 H 7.576 3.784 -1.486 1.00 . A A . 4 ARG HD3 1 1
7 1421 1 1 4 ARG HE H 9.816 2.702 0.000 1.00 . A A . 4 ARG HE 1 1
7 1422 1 1 4 ARG HG2 H 7.252 2.949 0.800 1.00 . A A . 4 ARG HG2 1 1
7 1423 1 1 4 ARG HG3 H 7.752 1.341 0.272 1.00 . A A . 4 ARG HG3 1 1
7 1424 1 1 4 ARG HH11 H 8.766 4.767 -2.634 1.00 . A A . 4 ARG HH11 1 1
7 1425 1 1 4 ARG HH12 H 10.272 5.602 -2.749 1.00 . A A . 4 ARG HH12 1 1
7 1426 1 1 4 ARG HH21 H 11.811 3.820 -0.143 1.00 . A A . 4 ARG HH21 1 1
7 1427 1 1 4 ARG HH22 H 12.011 5.069 -1.322 1.00 . A A . 4 ARG HH22 1 1
7 1428 1 1 4 ARG N N 5.631 0.339 1.379 1.00 . A A . 4 ARG N 1 1
7 1429 1 1 4 ARG NE N 9.442 3.221 -0.748 1.00 . A A . 4 ARG NE 1 1
7 1430 1 1 4 ARG NH1 N 9.707 4.901 -2.312 1.00 . A A . 4 ARG NH1 1 1
7 1431 1 1 4 ARG NH2 N 11.437 4.366 -0.897 1.00 . A A . 4 ARG NH2 1 1
7 1432 1 1 4 ARG O O 2.625 1.732 0.373 1.00 . A A . 4 ARG O 1 1
7 1433 1 1 5 GLN C C 1.308 -0.913 0.080 1.00 . A A . 5 GLN C 1 1
7 1434 1 1 5 GLN CA C 2.333 -0.670 -1.015 1.00 . A A . 5 GLN CA 1 1
7 1435 1 1 5 GLN CB C 2.599 -1.961 -1.774 1.00 . A A . 5 GLN CB 1 1
7 1436 1 1 5 GLN CD C 3.777 -3.071 -3.696 1.00 . A A . 5 GLN CD 1 1
7 1437 1 1 5 GLN CG C 3.337 -1.762 -3.082 1.00 . A A . 5 GLN CG 1 1
7 1438 1 1 5 GLN H H 4.410 -0.639 -0.575 1.00 . A A . 5 GLN H 1 1
7 1439 1 1 5 GLN HA H 1.934 0.061 -1.703 1.00 . A A . 5 GLN HA 1 1
7 1440 1 1 5 GLN HB2 H 3.191 -2.615 -1.149 1.00 . A A . 5 GLN HB2 1 1
7 1441 1 1 5 GLN HB3 H 1.653 -2.438 -1.989 1.00 . A A . 5 GLN HB3 1 1
7 1442 1 1 5 GLN HE21 H 3.585 -2.305 -5.509 1.00 . A A . 5 GLN HE21 1 1
7 1443 1 1 5 GLN HE22 H 4.104 -3.958 -5.433 1.00 . A A . 5 GLN HE22 1 1
7 1444 1 1 5 GLN HG2 H 2.684 -1.256 -3.776 1.00 . A A . 5 GLN HG2 1 1
7 1445 1 1 5 GLN HG3 H 4.211 -1.153 -2.899 1.00 . A A . 5 GLN HG3 1 1
7 1446 1 1 5 GLN N N 3.577 -0.129 -0.467 1.00 . A A . 5 GLN N 1 1
7 1447 1 1 5 GLN NE2 N 3.830 -3.115 -5.008 1.00 . A A . 5 GLN NE2 1 1
7 1448 1 1 5 GLN O O 0.115 -0.747 -0.137 1.00 . A A . 5 GLN O 1 1
7 1449 1 1 5 GLN OE1 O 4.066 -4.034 -2.987 1.00 . A A . 5 GLN OE1 1 1
7 1450 1 1 6 ALA C C 0.167 -0.260 2.768 1.00 . A A . 6 ALA C 1 1
7 1451 1 1 6 ALA CA C 0.907 -1.539 2.396 1.00 . A A . 6 ALA CA 1 1
7 1452 1 1 6 ALA CB C 1.712 -2.047 3.581 1.00 . A A . 6 ALA CB 1 1
7 1453 1 1 6 ALA H H 2.749 -1.456 1.352 1.00 . A A . 6 ALA H 1 1
7 1454 1 1 6 ALA HA H 0.188 -2.296 2.120 1.00 . A A . 6 ALA HA 1 1
7 1455 1 1 6 ALA HB1 H 1.045 -2.270 4.401 1.00 . A A . 6 ALA HB1 1 1
7 1456 1 1 6 ALA HB2 H 2.417 -1.288 3.888 1.00 . A A . 6 ALA HB2 1 1
7 1457 1 1 6 ALA HB3 H 2.247 -2.941 3.297 1.00 . A A . 6 ALA HB3 1 1
7 1458 1 1 6 ALA N N 1.783 -1.308 1.255 1.00 . A A . 6 ALA N 1 1
7 1459 1 1 6 ALA O O -1.036 -0.276 3.045 1.00 . A A . 6 ALA O 1 1
7 1460 1 1 7 ARG C C -0.658 2.565 1.973 1.00 . A A . 7 ARG C 1 1
7 1461 1 1 7 ARG CA C 0.322 2.150 3.061 1.00 . A A . 7 ARG CA 1 1
7 1462 1 1 7 ARG CB C 1.428 3.202 3.177 1.00 . A A . 7 ARG CB 1 1
7 1463 1 1 7 ARG CD C 3.671 3.850 4.084 1.00 . A A . 7 ARG CD 1 1
7 1464 1 1 7 ARG CG C 2.565 2.809 4.102 1.00 . A A . 7 ARG CG 1 1
7 1465 1 1 7 ARG CZ C 5.943 4.162 5.015 1.00 . A A . 7 ARG CZ 1 1
7 1466 1 1 7 ARG H H 1.840 0.789 2.499 1.00 . A A . 7 ARG H 1 1
7 1467 1 1 7 ARG HA H -0.199 2.074 4.003 1.00 . A A . 7 ARG HA 1 1
7 1468 1 1 7 ARG HB2 H 1.840 3.380 2.195 1.00 . A A . 7 ARG HB2 1 1
7 1469 1 1 7 ARG HB3 H 0.994 4.120 3.545 1.00 . A A . 7 ARG HB3 1 1
7 1470 1 1 7 ARG HD2 H 3.930 4.064 3.058 1.00 . A A . 7 ARG HD2 1 1
7 1471 1 1 7 ARG HD3 H 3.304 4.749 4.556 1.00 . A A . 7 ARG HD3 1 1
7 1472 1 1 7 ARG HE H 4.873 2.465 5.107 1.00 . A A . 7 ARG HE 1 1
7 1473 1 1 7 ARG HG2 H 2.185 2.716 5.108 1.00 . A A . 7 ARG HG2 1 1
7 1474 1 1 7 ARG HG3 H 2.967 1.861 3.776 1.00 . A A . 7 ARG HG3 1 1
7 1475 1 1 7 ARG HH11 H 5.165 5.827 4.143 1.00 . A A . 7 ARG HH11 1 1
7 1476 1 1 7 ARG HH12 H 6.760 6.014 4.775 1.00 . A A . 7 ARG HH12 1 1
7 1477 1 1 7 ARG HH21 H 6.988 2.700 5.955 1.00 . A A . 7 ARG HH21 1 1
7 1478 1 1 7 ARG HH22 H 7.800 4.223 5.826 1.00 . A A . 7 ARG HH22 1 1
7 1479 1 1 7 ARG N N 0.892 0.850 2.743 1.00 . A A . 7 ARG N 1 1
7 1480 1 1 7 ARG NE N 4.870 3.399 4.790 1.00 . A A . 7 ARG NE 1 1
7 1481 1 1 7 ARG NH1 N 5.958 5.433 4.614 1.00 . A A . 7 ARG NH1 1 1
7 1482 1 1 7 ARG NH2 N 6.993 3.657 5.646 1.00 . A A . 7 ARG NH2 1 1
7 1483 1 1 7 ARG O O -1.725 3.109 2.253 1.00 . A A . 7 ARG O 1 1
7 1484 1 1 8 ALA C C -2.400 1.817 -0.425 1.00 . A A . 8 ALA C 1 1
7 1485 1 1 8 ALA CA C -1.111 2.634 -0.417 1.00 . A A . 8 ALA CA 1 1
7 1486 1 1 8 ALA CB C -0.336 2.422 -1.709 1.00 . A A . 8 ALA CB 1 1
7 1487 1 1 8 ALA H H 0.588 1.867 0.580 1.00 . A A . 8 ALA H 1 1
7 1488 1 1 8 ALA HA H -1.365 3.681 -0.345 1.00 . A A . 8 ALA HA 1 1
7 1489 1 1 8 ALA HB1 H 0.573 3.006 -1.684 1.00 . A A . 8 ALA HB1 1 1
7 1490 1 1 8 ALA HB2 H -0.941 2.733 -2.548 1.00 . A A . 8 ALA HB2 1 1
7 1491 1 1 8 ALA HB3 H -0.089 1.376 -1.812 1.00 . A A . 8 ALA HB3 1 1
7 1492 1 1 8 ALA N N -0.283 2.298 0.729 1.00 . A A . 8 ALA N 1 1
7 1493 1 1 8 ALA O O -3.486 2.354 -0.670 1.00 . A A . 8 ALA O 1 1
7 1494 1 1 9 ALA C C -4.413 0.034 0.955 1.00 . A A . 9 ALA C 1 1
7 1495 1 1 9 ALA CA C -3.420 -0.375 -0.118 1.00 . A A . 9 ALA CA 1 1
7 1496 1 1 9 ALA CB C -2.958 -1.803 0.114 1.00 . A A . 9 ALA CB 1 1
7 1497 1 1 9 ALA H H -1.379 0.163 0.040 1.00 . A A . 9 ALA H 1 1
7 1498 1 1 9 ALA HA H -3.904 -0.329 -1.082 1.00 . A A . 9 ALA HA 1 1
7 1499 1 1 9 ALA HB1 H -3.805 -2.471 0.057 1.00 . A A . 9 ALA HB1 1 1
7 1500 1 1 9 ALA HB2 H -2.504 -1.880 1.091 1.00 . A A . 9 ALA HB2 1 1
7 1501 1 1 9 ALA HB3 H -2.235 -2.072 -0.641 1.00 . A A . 9 ALA HB3 1 1
7 1502 1 1 9 ALA N N -2.276 0.526 -0.145 1.00 . A A . 9 ALA N 1 1
7 1503 1 1 9 ALA O O -5.616 0.100 0.706 1.00 . A A . 9 ALA O 1 1
7 1504 1 1 10 ARG C C -5.375 2.105 2.994 1.00 . A A . 10 ARG C 1 1
7 1505 1 1 10 ARG CA C -4.756 0.739 3.247 1.00 . A A . 10 ARG CA 1 1
7 1506 1 1 10 ARG CB C -3.975 0.728 4.560 1.00 . A A . 10 ARG CB 1 1
7 1507 1 1 10 ARG CD C -2.807 -0.644 6.310 1.00 . A A . 10 ARG CD 1 1
7 1508 1 1 10 ARG CG C -3.664 -0.672 5.059 1.00 . A A . 10 ARG CG 1 1
7 1509 1 1 10 ARG CZ C -1.556 -2.445 7.467 1.00 . A A . 10 ARG CZ 1 1
7 1510 1 1 10 ARG H H -2.934 0.275 2.272 1.00 . A A . 10 ARG H 1 1
7 1511 1 1 10 ARG HA H -5.556 0.016 3.318 1.00 . A A . 10 ARG HA 1 1
7 1512 1 1 10 ARG HB2 H -3.043 1.254 4.416 1.00 . A A . 10 ARG HB2 1 1
7 1513 1 1 10 ARG HB3 H -4.554 1.237 5.316 1.00 . A A . 10 ARG HB3 1 1
7 1514 1 1 10 ARG HD2 H -1.828 -0.275 6.048 1.00 . A A . 10 ARG HD2 1 1
7 1515 1 1 10 ARG HD3 H -3.262 0.019 7.031 1.00 . A A . 10 ARG HD3 1 1
7 1516 1 1 10 ARG HE H -3.473 -2.544 6.887 1.00 . A A . 10 ARG HE 1 1
7 1517 1 1 10 ARG HG2 H -4.591 -1.177 5.283 1.00 . A A . 10 ARG HG2 1 1
7 1518 1 1 10 ARG HG3 H -3.139 -1.211 4.284 1.00 . A A . 10 ARG HG3 1 1
7 1519 1 1 10 ARG HH11 H -0.444 -0.789 7.080 1.00 . A A . 10 ARG HH11 1 1
7 1520 1 1 10 ARG HH12 H 0.387 -2.054 7.915 1.00 . A A . 10 ARG HH12 1 1
7 1521 1 1 10 ARG HH21 H -2.375 -4.232 7.985 1.00 . A A . 10 ARG HH21 1 1
7 1522 1 1 10 ARG HH22 H -0.715 -4.024 8.430 1.00 . A A . 10 ARG HH22 1 1
7 1523 1 1 10 ARG N N -3.906 0.333 2.139 1.00 . A A . 10 ARG N 1 1
7 1524 1 1 10 ARG NE N -2.670 -1.975 6.904 1.00 . A A . 10 ARG NE 1 1
7 1525 1 1 10 ARG NH1 N -0.452 -1.706 7.488 1.00 . A A . 10 ARG NH1 1 1
7 1526 1 1 10 ARG NH2 N -1.548 -3.662 8.002 1.00 . A A . 10 ARG NH2 1 1
7 1527 1 1 10 ARG O O -6.481 2.384 3.442 1.00 . A A . 10 ARG O 1 1
7 1528 1 1 11 ALA C C -6.324 4.160 0.948 1.00 . A A . 11 ALA C 1 1
7 1529 1 1 11 ALA CA C -5.155 4.270 1.921 1.00 . A A . 11 ALA CA 1 1
7 1530 1 1 11 ALA CB C -4.046 5.115 1.323 1.00 . A A . 11 ALA CB 1 1
7 1531 1 1 11 ALA H H -3.757 2.685 1.982 1.00 . A A . 11 ALA H 1 1
7 1532 1 1 11 ALA HA H -5.498 4.749 2.827 1.00 . A A . 11 ALA HA 1 1
7 1533 1 1 11 ALA HB1 H -3.682 4.642 0.423 1.00 . A A . 11 ALA HB1 1 1
7 1534 1 1 11 ALA HB2 H -3.239 5.206 2.035 1.00 . A A . 11 ALA HB2 1 1
7 1535 1 1 11 ALA HB3 H -4.429 6.095 1.084 1.00 . A A . 11 ALA HB3 1 1
7 1536 1 1 11 ALA N N -4.654 2.952 2.276 1.00 . A A . 11 ALA N 1 1
7 1537 1 1 11 ALA O O -7.316 4.873 1.070 1.00 . A A . 11 ALA O 1 1
7 1538 1 1 12 ALA C C -8.415 2.274 -0.438 1.00 . A A . 12 ALA C 1 1
7 1539 1 1 12 ALA CA C -7.236 3.054 -1.016 1.00 . A A . 12 ALA CA 1 1
7 1540 1 1 12 ALA CB C -6.666 2.345 -2.236 1.00 . A A . 12 ALA CB 1 1
7 1541 1 1 12 ALA H H -5.380 2.713 -0.058 1.00 . A A . 12 ALA H 1 1
7 1542 1 1 12 ALA HA H -7.586 4.028 -1.325 1.00 . A A . 12 ALA HA 1 1
7 1543 1 1 12 ALA HB1 H -7.428 2.267 -2.997 1.00 . A A . 12 ALA HB1 1 1
7 1544 1 1 12 ALA HB2 H -6.336 1.355 -1.955 1.00 . A A . 12 ALA HB2 1 1
7 1545 1 1 12 ALA HB3 H -5.828 2.906 -2.621 1.00 . A A . 12 ALA HB3 1 1
7 1546 1 1 12 ALA N N -6.198 3.256 -0.016 1.00 . A A . 12 ALA N 1 1
7 1547 1 1 12 ALA O O -9.571 2.546 -0.762 1.00 . A A . 12 ALA O 1 1
7 1548 1 1 13 DAL C C -9.054 -0.955 0.657 1.00 . A A . 13 DAL C 1 1
7 1549 1 1 13 DAL CA C -9.163 0.512 1.052 1.00 . A A . 13 DAL CA 1 1
7 1550 1 1 13 DAL CB C -9.098 0.657 2.564 1.00 . A A . 13 DAL CB 1 1
7 1551 1 1 13 DAL H H -7.180 1.133 0.639 1.00 . A A . 13 DAL H 1 1
7 1552 1 1 13 DAL HA H -10.117 0.892 0.720 1.00 . A A . 13 DAL HA 1 1
7 1553 1 1 13 DAL HB1 H -8.157 0.267 2.923 1.00 . A A . 13 DAL HB1 1 1
7 1554 1 1 13 DAL HB2 H -9.910 0.107 3.014 1.00 . A A . 13 DAL HB2 1 1
7 1555 1 1 13 DAL HB3 H -9.179 1.701 2.829 1.00 . A A . 13 DAL HB3 1 1
7 1556 1 1 13 DAL N N -8.121 1.312 0.421 1.00 . A A . 13 DAL N 1 1
7 1557 1 1 13 DAL O O -9.959 -1.749 0.923 1.00 . A A . 13 DAL O 1 1
7 1558 1 1 14 CYS C C -7.332 -3.559 0.793 1.00 . A A . 14 CYS C 1 1
7 1559 1 1 14 CYS CA C -7.711 -2.681 -0.396 1.00 . A A . 14 CYS CA 1 1
7 1560 1 1 14 CYS CB C -6.611 -2.712 -1.455 1.00 . A A . 14 CYS CB 1 1
7 1561 1 1 14 CYS H H -7.258 -0.637 -0.154 1.00 . A A . 14 CYS H 1 1
7 1562 1 1 14 CYS HA H -8.626 -3.056 -0.830 1.00 . A A . 14 CYS HA 1 1
7 1563 1 1 14 CYS HB2 H -5.681 -2.990 -0.982 1.00 . A A . 14 CYS HB2 1 1
7 1564 1 1 14 CYS HB3 H -6.863 -3.453 -2.198 1.00 . A A . 14 CYS HB3 1 1
7 1565 1 1 14 CYS N N -7.947 -1.312 0.030 1.00 . A A . 14 CYS N 1 1
7 1566 1 1 14 CYS O O -6.161 -3.645 1.170 1.00 . A A . 14 CYS O 1 1
7 1567 1 1 14 CYS SG S -6.371 -1.130 -2.293 1.00 . A A . 14 CYS SG 1 1
7 1568 1 1 15 NH2 HN1 H -8.092 -4.905 2.026 1.00 . A A . 15 NH2 HN1 1 1
7 1569 1 1 15 NH2 HN2 H -9.215 -3.787 1.343 1.00 . A A . 15 NH2 HN2 1 1
7 1570 1 1 15 NH2 N N -8.323 -4.192 1.394 1.00 . A A . 15 NH2 N 1 1
7 1571 2 2 1 . CB1 C -0.539 -6.097 -0.531 1.00 . B A . 101 B0I CB1 1 1
7 1572 2 2 1 . CB2 C -5.520 -1.658 -3.792 1.00 . B A . 101 B0I CB2 1 1
7 1573 2 2 1 . CD1 C -1.161 -4.220 -2.034 1.00 . B A . 101 B0I CD1 1 1
7 1574 2 2 1 . CD2 C 0.595 -5.657 -2.727 1.00 . B A . 101 B0I CD2 1 1
7 1575 2 2 1 . CD3 C -3.203 -2.551 -3.490 1.00 . B A . 101 B0I CD3 1 1
7 1576 2 2 1 . CD4 C -3.474 -0.215 -3.870 1.00 . B A . 101 B0I CD4 1 1
7 1577 2 2 1 . CE1 C -1.018 -3.479 -3.191 1.00 . B A . 101 B0I CE1 1 1
7 1578 2 2 1 . CE2 C 0.747 -4.925 -3.885 1.00 . B A . 101 B0I CE2 1 1
7 1579 2 2 1 . CE3 C -1.835 -2.385 -3.419 1.00 . B A . 101 B0I CE3 1 1
7 1580 2 2 1 . CE4 C -2.106 -0.040 -3.801 1.00 . B A . 101 B0I CE4 1 1
7 1581 2 2 1 . CG1 C -0.365 -5.307 -1.790 1.00 . B A . 101 B0I CG1 1 1
7 1582 2 2 1 . CG2 C -4.036 -1.471 -3.716 1.00 . B A . 101 B0I CG2 1 1
7 1583 2 2 1 . CZ1 C -0.062 -3.832 -4.118 1.00 . B A . 101 B0I CZ1 1 1
7 1584 2 2 1 . CZ2 C -1.284 -1.126 -3.574 1.00 . B A . 101 B0I CZ2 1 1
7 1585 2 2 1 . H1 H -0.094 -7.061 -0.681 1.00 . B A . 101 B0I H1 1 1
7 1586 2 2 1 . H2 H -5.722 -2.706 -3.958 1.00 . B A . 101 B0I H2 1 1
7 1587 2 2 1 . HB11 H -1.598 -6.214 -0.355 1.00 . B A . 101 B0I HB11 1 1
7 1588 2 2 1 . HB21 H -5.892 -1.080 -4.624 1.00 . B A . 101 B0I HB21 1 1
7 1589 2 2 1 . HD1 H -1.904 -3.959 -1.300 1.00 . B A . 101 B0I HD1 1 1
7 1590 2 2 1 . HD2 H 1.228 -6.512 -2.543 1.00 . B A . 101 B0I HD2 1 1
7 1591 2 2 1 . HD3 H -3.632 -3.535 -3.369 1.00 . B A . 101 B0I HD3 1 1
7 1592 2 2 1 . HD4 H -4.117 0.635 -4.047 1.00 . B A . 101 B0I HD4 1 1
7 1593 2 2 1 . HE2 H 1.498 -5.207 -4.608 1.00 . B A . 101 B0I HE2 1 1
7 1594 2 2 1 . HE4 H -1.682 0.946 -3.923 1.00 . B A . 101 B0I HE4 1 1
7 1595 2 2 1 . HZ1 H 0.053 -3.255 -5.023 1.00 . B A . 101 B0I HZ1 1 1
7 1596 2 2 1 . HZ2 H -0.213 -0.994 -3.519 1.00 . B A . 101 B0I HZ2 1 1
8 1597 1 1 1 . C C 4.945 -5.587 0.312 1.00 . A A . 1 H00 C 1 1
8 1598 1 1 1 . CA C 4.037 -6.435 -0.551 1.00 . A A . 1 H00 CA 1 1
8 1599 1 1 1 . CB C 2.619 -6.407 -0.003 1.00 . A A . 1 H00 CB 1 1
8 1600 1 1 1 . CG C 1.992 -5.032 -0.158 1.00 . A A . 1 H00 CG 1 1
8 1601 1 1 1 . HA1 H 4.395 -7.455 -0.556 1.00 . A A . 1 H00 HA1 1 1
8 1602 1 1 1 . HA2 H 4.038 -6.046 -1.560 1.00 . A A . 1 H00 HA2 1 1
8 1603 1 1 1 . HB1 H 2.645 -6.666 1.046 1.00 . A A . 1 H00 HB1 1 1
8 1604 1 1 1 . HB2 H 2.021 -7.128 -0.540 1.00 . A A . 1 H00 HB2 1 1
8 1605 1 1 1 . HG1 H 2.175 -4.680 -1.163 1.00 . A A . 1 H00 HG1 1 1
8 1606 1 1 1 . HG2 H 2.455 -4.358 0.550 1.00 . A A . 1 H00 HG2 1 1
8 1607 1 1 1 . O O 5.112 -5.857 1.508 1.00 . A A . 1 H00 O 1 1
8 1608 1 1 1 . SD S 0.212 -5.040 0.135 1.00 . A A . 1 H00 SD 1 1
8 1609 1 1 2 THR C C 5.604 -2.677 1.275 1.00 . A A . 2 THR C 1 1
8 1610 1 1 2 THR CA C 6.410 -3.665 0.433 1.00 . A A . 2 THR CA 1 1
8 1611 1 1 2 THR CB C 7.307 -2.894 -0.551 1.00 . A A . 2 THR CB 1 1
8 1612 1 1 2 THR CG2 C 8.414 -3.792 -1.082 1.00 . A A . 2 THR CG2 1 1
8 1613 1 1 2 THR H H 5.356 -4.392 -1.233 1.00 . A A . 2 THR H 1 1
8 1614 1 1 2 THR HA H 7.038 -4.255 1.084 1.00 . A A . 2 THR HA 1 1
8 1615 1 1 2 THR HB H 7.751 -2.055 -0.036 1.00 . A A . 2 THR HB 1 1
8 1616 1 1 2 THR HG1 H 6.974 -2.586 -2.470 1.00 . A A . 2 THR HG1 1 1
8 1617 1 1 2 THR HG21 H 9.007 -4.160 -0.258 1.00 . A A . 2 THR HG21 1 1
8 1618 1 1 2 THR HG22 H 9.044 -3.227 -1.753 1.00 . A A . 2 THR HG22 1 1
8 1619 1 1 2 THR HG23 H 7.979 -4.625 -1.613 1.00 . A A . 2 THR HG23 1 1
8 1620 1 1 2 THR N N 5.528 -4.562 -0.282 1.00 . A A . 2 THR N 1 1
8 1621 1 1 2 THR O O 4.416 -2.455 1.006 1.00 . A A . 2 THR O 1 1
8 1622 1 1 2 THR OG1 O 6.514 -2.407 -1.642 1.00 . A A . 2 THR OG1 1 1
8 1623 1 1 3 PRO C C 4.842 -0.015 2.411 1.00 . A A . 3 PRO C 1 1
8 1624 1 1 3 PRO CA C 5.566 -1.115 3.191 1.00 . A A . 3 PRO CA 1 1
8 1625 1 1 3 PRO CB C 6.708 -0.514 4.035 1.00 . A A . 3 PRO CB 1 1
8 1626 1 1 3 PRO CD C 7.606 -2.345 2.746 1.00 . A A . 3 PRO CD 1 1
8 1627 1 1 3 PRO CG C 7.979 -1.110 3.511 1.00 . A A . 3 PRO CG 1 1
8 1628 1 1 3 PRO HA H 4.858 -1.605 3.842 1.00 . A A . 3 PRO HA 1 1
8 1629 1 1 3 PRO HB2 H 6.708 0.561 3.922 1.00 . A A . 3 PRO HB2 1 1
8 1630 1 1 3 PRO HB3 H 6.555 -0.768 5.074 1.00 . A A . 3 PRO HB3 1 1
8 1631 1 1 3 PRO HD2 H 8.258 -2.473 1.895 1.00 . A A . 3 PRO HD2 1 1
8 1632 1 1 3 PRO HD3 H 7.650 -3.212 3.387 1.00 . A A . 3 PRO HD3 1 1
8 1633 1 1 3 PRO HG2 H 8.475 -0.406 2.864 1.00 . A A . 3 PRO HG2 1 1
8 1634 1 1 3 PRO HG3 H 8.623 -1.368 4.340 1.00 . A A . 3 PRO HG3 1 1
8 1635 1 1 3 PRO N N 6.228 -2.083 2.318 1.00 . A A . 3 PRO N 1 1
8 1636 1 1 3 PRO O O 3.719 0.346 2.751 1.00 . A A . 3 PRO O 1 1
8 1637 1 1 4 ARG C C 3.538 1.071 -0.068 1.00 . A A . 4 ARG C 1 1
8 1638 1 1 4 ARG CA C 4.863 1.548 0.534 1.00 . A A . 4 ARG CA 1 1
8 1639 1 1 4 ARG CB C 5.819 2.030 -0.580 1.00 . A A . 4 ARG CB 1 1
8 1640 1 1 4 ARG CD C 7.048 1.535 -2.722 1.00 . A A . 4 ARG CD 1 1
8 1641 1 1 4 ARG CG C 6.189 0.964 -1.605 1.00 . A A . 4 ARG CG 1 1
8 1642 1 1 4 ARG CZ C 7.344 0.754 -5.062 1.00 . A A . 4 ARG CZ 1 1
8 1643 1 1 4 ARG H H 6.377 0.173 1.128 1.00 . A A . 4 ARG H 1 1
8 1644 1 1 4 ARG HA H 4.651 2.380 1.191 1.00 . A A . 4 ARG HA 1 1
8 1645 1 1 4 ARG HB2 H 5.349 2.849 -1.105 1.00 . A A . 4 ARG HB2 1 1
8 1646 1 1 4 ARG HB3 H 6.728 2.391 -0.122 1.00 . A A . 4 ARG HB3 1 1
8 1647 1 1 4 ARG HD2 H 6.513 2.349 -3.187 1.00 . A A . 4 ARG HD2 1 1
8 1648 1 1 4 ARG HD3 H 7.968 1.906 -2.296 1.00 . A A . 4 ARG HD3 1 1
8 1649 1 1 4 ARG HE H 7.616 -0.368 -3.416 1.00 . A A . 4 ARG HE 1 1
8 1650 1 1 4 ARG HG2 H 6.733 0.172 -1.113 1.00 . A A . 4 ARG HG2 1 1
8 1651 1 1 4 ARG HG3 H 5.279 0.566 -2.029 1.00 . A A . 4 ARG HG3 1 1
8 1652 1 1 4 ARG HH11 H 6.786 2.703 -4.907 1.00 . A A . 4 ARG HH11 1 1
8 1653 1 1 4 ARG HH12 H 6.997 2.124 -6.521 1.00 . A A . 4 ARG HH12 1 1
8 1654 1 1 4 ARG HH21 H 7.902 -1.129 -5.564 1.00 . A A . 4 ARG HH21 1 1
8 1655 1 1 4 ARG HH22 H 7.636 -0.065 -6.899 1.00 . A A . 4 ARG HH22 1 1
8 1656 1 1 4 ARG N N 5.477 0.499 1.352 1.00 . A A . 4 ARG N 1 1
8 1657 1 1 4 ARG NE N 7.366 0.528 -3.741 1.00 . A A . 4 ARG NE 1 1
8 1658 1 1 4 ARG NH1 N 7.017 1.952 -5.532 1.00 . A A . 4 ARG NH1 1 1
8 1659 1 1 4 ARG NH2 N 7.651 -0.222 -5.907 1.00 . A A . 4 ARG NH2 1 1
8 1660 1 1 4 ARG O O 2.532 1.776 -0.016 1.00 . A A . 4 ARG O 1 1
8 1661 1 1 5 GLN C C 1.297 -1.025 -0.179 1.00 . A A . 5 GLN C 1 1
8 1662 1 1 5 GLN CA C 2.354 -0.712 -1.224 1.00 . A A . 5 GLN CA 1 1
8 1663 1 1 5 GLN CB C 2.707 -1.962 -2.022 1.00 . A A . 5 GLN CB 1 1
8 1664 1 1 5 GLN CD C 3.884 -2.926 -4.036 1.00 . A A . 5 GLN CD 1 1
8 1665 1 1 5 GLN CG C 3.488 -1.670 -3.292 1.00 . A A . 5 GLN CG 1 1
8 1666 1 1 5 GLN H H 4.370 -0.667 -0.597 1.00 . A A . 5 GLN H 1 1
8 1667 1 1 5 GLN HA H 1.951 0.027 -1.902 1.00 . A A . 5 GLN HA 1 1
8 1668 1 1 5 GLN HB2 H 3.306 -2.613 -1.401 1.00 . A A . 5 GLN HB2 1 1
8 1669 1 1 5 GLN HB3 H 1.795 -2.472 -2.295 1.00 . A A . 5 GLN HB3 1 1
8 1670 1 1 5 GLN HE21 H 3.708 -1.974 -5.765 1.00 . A A . 5 GLN HE21 1 1
8 1671 1 1 5 GLN HE22 H 4.171 -3.645 -5.860 1.00 . A A . 5 GLN HE22 1 1
8 1672 1 1 5 GLN HG2 H 2.876 -1.064 -3.943 1.00 . A A . 5 GLN HG2 1 1
8 1673 1 1 5 GLN HG3 H 4.383 -1.126 -3.032 1.00 . A A . 5 GLN HG3 1 1
8 1674 1 1 5 GLN N N 3.543 -0.139 -0.615 1.00 . A A . 5 GLN N 1 1
8 1675 1 1 5 GLN NE2 N 3.929 -2.840 -5.351 1.00 . A A . 5 GLN NE2 1 1
8 1676 1 1 5 GLN O O 0.104 -0.902 -0.437 1.00 . A A . 5 GLN O 1 1
8 1677 1 1 5 GLN OE1 O 4.138 -3.970 -3.434 1.00 . A A . 5 GLN OE1 1 1
8 1678 1 1 6 ALA C C 0.099 -0.475 2.555 1.00 . A A . 6 ALA C 1 1
8 1679 1 1 6 ALA CA C 0.834 -1.730 2.097 1.00 . A A . 6 ALA CA 1 1
8 1680 1 1 6 ALA CB C 1.596 -2.357 3.253 1.00 . A A . 6 ALA CB 1 1
8 1681 1 1 6 ALA H H 2.711 -1.512 1.143 1.00 . A A . 6 ALA H 1 1
8 1682 1 1 6 ALA HA H 0.111 -2.447 1.735 1.00 . A A . 6 ALA HA 1 1
8 1683 1 1 6 ALA HB1 H 0.902 -2.637 4.032 1.00 . A A . 6 ALA HB1 1 1
8 1684 1 1 6 ALA HB2 H 2.306 -1.644 3.643 1.00 . A A . 6 ALA HB2 1 1
8 1685 1 1 6 ALA HB3 H 2.120 -3.235 2.906 1.00 . A A . 6 ALA HB3 1 1
8 1686 1 1 6 ALA N N 1.743 -1.420 1.005 1.00 . A A . 6 ALA N 1 1
8 1687 1 1 6 ALA O O -1.111 -0.495 2.779 1.00 . A A . 6 ALA O 1 1
8 1688 1 1 7 ARG C C -0.646 2.423 1.971 1.00 . A A . 7 ARG C 1 1
8 1689 1 1 7 ARG CA C 0.259 1.901 3.071 1.00 . A A . 7 ARG CA 1 1
8 1690 1 1 7 ARG CB C 1.363 2.916 3.366 1.00 . A A . 7 ARG CB 1 1
8 1691 1 1 7 ARG CD C 3.528 3.384 4.540 1.00 . A A . 7 ARG CD 1 1
8 1692 1 1 7 ARG CG C 2.348 2.439 4.407 1.00 . A A . 7 ARG CG 1 1
8 1693 1 1 7 ARG CZ C 5.807 3.292 5.510 1.00 . A A . 7 ARG CZ 1 1
8 1694 1 1 7 ARG H H 1.801 0.567 2.482 1.00 . A A . 7 ARG H 1 1
8 1695 1 1 7 ARG HA H -0.326 1.740 3.963 1.00 . A A . 7 ARG HA 1 1
8 1696 1 1 7 ARG HB2 H 1.903 3.118 2.452 1.00 . A A . 7 ARG HB2 1 1
8 1697 1 1 7 ARG HB3 H 0.911 3.831 3.718 1.00 . A A . 7 ARG HB3 1 1
8 1698 1 1 7 ARG HD2 H 3.962 3.540 3.564 1.00 . A A . 7 ARG HD2 1 1
8 1699 1 1 7 ARG HD3 H 3.178 4.327 4.934 1.00 . A A . 7 ARG HD3 1 1
8 1700 1 1 7 ARG HE H 4.283 2.091 6.014 1.00 . A A . 7 ARG HE 1 1
8 1701 1 1 7 ARG HG2 H 1.847 2.363 5.359 1.00 . A A . 7 ARG HG2 1 1
8 1702 1 1 7 ARG HG3 H 2.709 1.466 4.106 1.00 . A A . 7 ARG HG3 1 1
8 1703 1 1 7 ARG HH11 H 5.571 4.744 4.109 1.00 . A A . 7 ARG HH11 1 1
8 1704 1 1 7 ARG HH12 H 7.152 4.639 4.805 1.00 . A A . 7 ARG HH12 1 1
8 1705 1 1 7 ARG HH21 H 6.377 1.960 6.932 1.00 . A A . 7 ARG HH21 1 1
8 1706 1 1 7 ARG HH22 H 7.611 3.058 6.410 1.00 . A A . 7 ARG HH22 1 1
8 1707 1 1 7 ARG N N 0.837 0.622 2.669 1.00 . A A . 7 ARG N 1 1
8 1708 1 1 7 ARG NE N 4.552 2.844 5.437 1.00 . A A . 7 ARG NE 1 1
8 1709 1 1 7 ARG NH1 N 6.206 4.303 4.749 1.00 . A A . 7 ARG NH1 1 1
8 1710 1 1 7 ARG NH2 N 6.663 2.726 6.348 1.00 . A A . 7 ARG NH2 1 1
8 1711 1 1 7 ARG O O -1.713 2.970 2.234 1.00 . A A . 7 ARG O 1 1
8 1712 1 1 8 ALA C C -2.302 1.888 -0.490 1.00 . A A . 8 ALA C 1 1
8 1713 1 1 8 ALA CA C -0.986 2.654 -0.424 1.00 . A A . 8 ALA CA 1 1
8 1714 1 1 8 ALA CB C -0.189 2.446 -1.703 1.00 . A A . 8 ALA CB 1 1
8 1715 1 1 8 ALA H H 0.674 1.824 0.603 1.00 . A A . 8 ALA H 1 1
8 1716 1 1 8 ALA HA H -1.200 3.708 -0.324 1.00 . A A . 8 ALA HA 1 1
8 1717 1 1 8 ALA HB1 H 0.749 2.976 -1.632 1.00 . A A . 8 ALA HB1 1 1
8 1718 1 1 8 ALA HB2 H -0.752 2.821 -2.543 1.00 . A A . 8 ALA HB2 1 1
8 1719 1 1 8 ALA HB3 H 0.004 1.392 -1.838 1.00 . A A . 8 ALA HB3 1 1
8 1720 1 1 8 ALA N N -0.209 2.240 0.734 1.00 . A A . 8 ALA N 1 1
8 1721 1 1 8 ALA O O -3.352 2.455 -0.798 1.00 . A A . 8 ALA O 1 1
8 1722 1 1 9 ALA C C -4.359 0.133 0.939 1.00 . A A . 9 ALA C 1 1
8 1723 1 1 9 ALA CA C -3.418 -0.245 -0.197 1.00 . A A . 9 ALA CA 1 1
8 1724 1 1 9 ALA CB C -3.021 -1.706 -0.098 1.00 . A A . 9 ALA CB 1 1
8 1725 1 1 9 ALA H H -1.366 0.201 0.026 1.00 . A A . 9 ALA H 1 1
8 1726 1 1 9 ALA HA H -3.930 -0.097 -1.137 1.00 . A A . 9 ALA HA 1 1
8 1727 1 1 9 ALA HB1 H -2.380 -1.959 -0.929 1.00 . A A . 9 ALA HB1 1 1
8 1728 1 1 9 ALA HB2 H -3.907 -2.324 -0.123 1.00 . A A . 9 ALA HB2 1 1
8 1729 1 1 9 ALA HB3 H -2.491 -1.872 0.827 1.00 . A A . 9 ALA HB3 1 1
8 1730 1 1 9 ALA N N -2.239 0.599 -0.194 1.00 . A A . 9 ALA N 1 1
8 1731 1 1 9 ALA O O -5.576 0.174 0.760 1.00 . A A . 9 ALA O 1 1
8 1732 1 1 10 ARG C C -5.261 2.153 3.012 1.00 . A A . 10 ARG C 1 1
8 1733 1 1 10 ARG CA C -4.571 0.813 3.265 1.00 . A A . 10 ARG CA 1 1
8 1734 1 1 10 ARG CB C -3.674 0.917 4.498 1.00 . A A . 10 ARG CB 1 1
8 1735 1 1 10 ARG CD C -3.493 1.432 6.945 1.00 . A A . 10 ARG CD 1 1
8 1736 1 1 10 ARG CG C -4.435 1.178 5.783 1.00 . A A . 10 ARG CG 1 1
8 1737 1 1 10 ARG CZ C -1.517 2.867 7.345 1.00 . A A . 10 ARG CZ 1 1
8 1738 1 1 10 ARG H H -2.815 0.336 2.200 1.00 . A A . 10 ARG H 1 1
8 1739 1 1 10 ARG HA H -5.322 0.058 3.439 1.00 . A A . 10 ARG HA 1 1
8 1740 1 1 10 ARG HB2 H -3.127 -0.008 4.609 1.00 . A A . 10 ARG HB2 1 1
8 1741 1 1 10 ARG HB3 H -2.972 1.724 4.349 1.00 . A A . 10 ARG HB3 1 1
8 1742 1 1 10 ARG HD2 H -4.074 1.570 7.845 1.00 . A A . 10 ARG HD2 1 1
8 1743 1 1 10 ARG HD3 H -2.848 0.575 7.063 1.00 . A A . 10 ARG HD3 1 1
8 1744 1 1 10 ARG HE H -3.001 3.266 6.059 1.00 . A A . 10 ARG HE 1 1
8 1745 1 1 10 ARG HG2 H -5.070 2.041 5.649 1.00 . A A . 10 ARG HG2 1 1
8 1746 1 1 10 ARG HG3 H -5.039 0.310 5.999 1.00 . A A . 10 ARG HG3 1 1
8 1747 1 1 10 ARG HH11 H -1.557 1.186 8.492 1.00 . A A . 10 ARG HH11 1 1
8 1748 1 1 10 ARG HH12 H -0.177 2.207 8.724 1.00 . A A . 10 ARG HH12 1 1
8 1749 1 1 10 ARG HH21 H -1.181 4.617 6.368 1.00 . A A . 10 ARG HH21 1 1
8 1750 1 1 10 ARG HH22 H 0.036 4.167 7.511 1.00 . A A . 10 ARG HH22 1 1
8 1751 1 1 10 ARG N N -3.790 0.414 2.106 1.00 . A A . 10 ARG N 1 1
8 1752 1 1 10 ARG NE N -2.669 2.618 6.724 1.00 . A A . 10 ARG NE 1 1
8 1753 1 1 10 ARG NH1 N -1.048 2.021 8.257 1.00 . A A . 10 ARG NH1 1 1
8 1754 1 1 10 ARG NH2 N -0.834 3.969 7.053 1.00 . A A . 10 ARG NH2 1 1
8 1755 1 1 10 ARG O O -6.395 2.368 3.435 1.00 . A A . 10 ARG O 1 1
8 1756 1 1 11 ALA C C -6.283 4.242 1.035 1.00 . A A . 11 ALA C 1 1
8 1757 1 1 11 ALA CA C -5.106 4.353 1.996 1.00 . A A . 11 ALA CA 1 1
8 1758 1 1 11 ALA CB C -4.022 5.242 1.405 1.00 . A A . 11 ALA CB 1 1
8 1759 1 1 11 ALA H H -3.656 2.816 2.029 1.00 . A A . 11 ALA H 1 1
8 1760 1 1 11 ALA HA H -5.450 4.807 2.914 1.00 . A A . 11 ALA HA 1 1
8 1761 1 1 11 ALA HB1 H -4.426 6.225 1.213 1.00 . A A . 11 ALA HB1 1 1
8 1762 1 1 11 ALA HB2 H -3.668 4.810 0.481 1.00 . A A . 11 ALA HB2 1 1
8 1763 1 1 11 ALA HB3 H -3.200 5.320 2.101 1.00 . A A . 11 ALA HB3 1 1
8 1764 1 1 11 ALA N N -4.566 3.044 2.319 1.00 . A A . 11 ALA N 1 1
8 1765 1 1 11 ALA O O -7.250 4.994 1.135 1.00 . A A . 11 ALA O 1 1
8 1766 1 1 12 ALA C C -8.406 2.290 -0.271 1.00 . A A . 12 ALA C 1 1
8 1767 1 1 12 ALA CA C -7.260 3.103 -0.863 1.00 . A A . 12 ALA CA 1 1
8 1768 1 1 12 ALA CB C -6.720 2.429 -2.111 1.00 . A A . 12 ALA CB 1 1
8 1769 1 1 12 ALA H H -5.397 2.735 0.073 1.00 . A A . 12 ALA H 1 1
8 1770 1 1 12 ALA HA H -7.634 4.078 -1.141 1.00 . A A . 12 ALA HA 1 1
8 1771 1 1 12 ALA HB1 H -7.516 2.321 -2.833 1.00 . A A . 12 ALA HB1 1 1
8 1772 1 1 12 ALA HB2 H -6.328 1.456 -1.856 1.00 . A A . 12 ALA HB2 1 1
8 1773 1 1 12 ALA HB3 H -5.934 3.035 -2.533 1.00 . A A . 12 ALA HB3 1 1
8 1774 1 1 12 ALA N N -6.197 3.301 0.107 1.00 . A A . 12 ALA N 1 1
8 1775 1 1 12 ALA O O -9.576 2.565 -0.540 1.00 . A A . 12 ALA O 1 1
8 1776 1 1 13 DAL C C -9.034 -0.962 0.637 1.00 . A A . 13 DAL C 1 1
8 1777 1 1 13 DAL CA C -9.087 0.466 1.169 1.00 . A A . 13 DAL CA 1 1
8 1778 1 1 13 DAL CB C -8.928 0.477 2.679 1.00 . A A . 13 DAL CB 1 1
8 1779 1 1 13 DAL H H -7.125 1.135 0.734 1.00 . A A . 13 DAL H 1 1
8 1780 1 1 13 DAL HA H -10.054 0.887 0.933 1.00 . A A . 13 DAL HA 1 1
8 1781 1 1 13 DAL HB1 H -8.981 1.494 3.038 1.00 . A A . 13 DAL HB1 1 1
8 1782 1 1 13 DAL HB2 H -7.971 0.051 2.942 1.00 . A A . 13 DAL HB2 1 1
8 1783 1 1 13 DAL HB3 H -9.717 -0.106 3.128 1.00 . A A . 13 DAL HB3 1 1
8 1784 1 1 13 DAL N N -8.075 1.304 0.544 1.00 . A A . 13 DAL N 1 1
8 1785 1 1 13 DAL O O -10.018 -1.694 0.704 1.00 . A A . 13 DAL O 1 1
8 1786 1 1 14 CYS C C -7.111 -3.628 0.608 1.00 . A A . 14 CYS C 1 1
8 1787 1 1 14 CYS CA C -7.715 -2.690 -0.437 1.00 . A A . 14 CYS CA 1 1
8 1788 1 1 14 CYS CB C -6.838 -2.651 -1.690 1.00 . A A . 14 CYS CB 1 1
8 1789 1 1 14 CYS H H -7.131 -0.725 0.073 1.00 . A A . 14 CYS H 1 1
8 1790 1 1 14 CYS HA H -8.693 -3.062 -0.707 1.00 . A A . 14 CYS HA 1 1
8 1791 1 1 14 CYS HB2 H -5.890 -3.117 -1.465 1.00 . A A . 14 CYS HB2 1 1
8 1792 1 1 14 CYS HB3 H -7.326 -3.211 -2.473 1.00 . A A . 14 CYS HB3 1 1
8 1793 1 1 14 CYS N N -7.888 -1.351 0.105 1.00 . A A . 14 CYS N 1 1
8 1794 1 1 14 CYS O O -7.806 -4.471 1.180 1.00 . A A . 14 CYS O 1 1
8 1795 1 1 14 CYS SG S -6.511 -0.986 -2.306 1.00 . A A . 14 CYS SG 1 1
8 1796 1 1 15 NH2 HN1 H -5.559 -2.915 1.608 1.00 . A A . 15 NH2 HN1 1 1
8 1797 1 1 15 NH2 HN2 H -5.197 -4.097 0.407 1.00 . A A . 15 NH2 HN2 1 1
8 1798 1 1 15 NH2 N N -5.820 -3.487 0.855 1.00 . A A . 15 NH2 N 1 1
8 1799 2 2 1 . CB1 C -0.376 -5.837 -1.376 1.00 . B A . 101 B0I CB1 1 1
8 1800 2 2 1 . CB2 C -5.741 -1.360 -3.895 1.00 . B A . 101 B0I CB2 1 1
8 1801 2 2 1 . CD1 C -1.168 -3.874 -2.663 1.00 . B A . 101 B0I CD1 1 1
8 1802 2 2 1 . CD2 C 0.598 -5.161 -3.586 1.00 . B A . 101 B0I CD2 1 1
8 1803 2 2 1 . CD3 C -3.369 -2.178 -3.826 1.00 . B A . 101 B0I CD3 1 1
8 1804 2 2 1 . CD4 C -3.754 0.168 -3.966 1.00 . B A . 101 B0I CD4 1 1
8 1805 2 2 1 . CE1 C -1.130 -3.027 -3.753 1.00 . B A . 101 B0I CE1 1 1
8 1806 2 2 1 . CE2 C 0.648 -4.323 -4.684 1.00 . B A . 101 B0I CE2 1 1
8 1807 2 2 1 . CE3 C -2.004 -1.957 -3.826 1.00 . B A . 101 B0I CE3 1 1
8 1808 2 2 1 . CE4 C -2.391 0.397 -3.967 1.00 . B A . 101 B0I CE4 1 1
8 1809 2 2 1 . CG1 C -0.315 -4.938 -2.567 1.00 . B A . 101 B0I CG1 1 1
8 1810 2 2 1 . CG2 C -4.257 -1.118 -3.895 1.00 . B A . 101 B0I CG2 1 1
8 1811 2 2 1 . CZ1 C -0.220 -3.252 -4.767 1.00 . B A . 101 B0I CZ1 1 1
8 1812 2 2 1 . CZ2 C -1.515 -0.667 -3.897 1.00 . B A . 101 B0I CZ2 1 1
8 1813 2 2 1 . H1 H 0.232 -6.697 -1.580 1.00 . B A . 101 B0I H1 1 1
8 1814 2 2 1 . H2 H -5.915 -2.398 -4.131 1.00 . B A . 101 B0I H2 1 1
8 1815 2 2 1 . HB11 H -1.401 -6.144 -1.235 1.00 . B A . 101 B0I HB11 1 1
8 1816 2 2 1 . HB21 H -6.187 -0.736 -4.655 1.00 . B A . 101 B0I HB21 1 1
8 1817 2 2 1 . HD1 H -1.871 -3.715 -1.864 1.00 . B A . 101 B0I HD1 1 1
8 1818 2 2 1 . HD2 H 1.274 -5.999 -3.518 1.00 . B A . 101 B0I HD2 1 1
8 1819 2 2 1 . HD3 H -3.750 -3.187 -3.770 1.00 . B A . 101 B0I HD3 1 1
8 1820 2 2 1 . HD4 H -4.438 1.001 -4.018 1.00 . B A . 101 B0I HD4 1 1
8 1821 2 2 1 . HE2 H 1.361 -4.504 -5.473 1.00 . B A . 101 B0I HE2 1 1
8 1822 2 2 1 . HE4 H -2.012 1.406 -4.022 1.00 . B A . 101 B0I HE4 1 1
8 1823 2 2 1 . HZ1 H -0.185 -2.593 -5.622 1.00 . B A . 101 B0I HZ1 1 1
8 1824 2 2 1 . HZ2 H -0.450 -0.492 -3.899 1.00 . B A . 101 B0I HZ2 1 1
9 1825 1 1 1 . C C 4.327 -2.549 6.027 1.00 . A A . 1 H00 C 1 1
9 1826 1 1 1 . CA C 3.187 -3.480 6.394 1.00 . A A . 1 H00 CA 1 1
9 1827 1 1 1 . CB C 1.880 -2.707 6.481 1.00 . A A . 1 H00 CB 1 1
9 1828 1 1 1 . CG C 1.424 -2.228 5.111 1.00 . A A . 1 H00 CG 1 1
9 1829 1 1 1 . HA1 H 3.393 -3.936 7.352 1.00 . A A . 1 H00 HA1 1 1
9 1830 1 1 1 . HA2 H 3.097 -4.248 5.639 1.00 . A A . 1 H00 HA2 1 1
9 1831 1 1 1 . HB1 H 2.023 -1.850 7.124 1.00 . A A . 1 H00 HB1 1 1
9 1832 1 1 1 . HB2 H 1.119 -3.350 6.898 1.00 . A A . 1 H00 HB2 1 1
9 1833 1 1 1 . HG1 H 1.463 -3.061 4.423 1.00 . A A . 1 H00 HG1 1 1
9 1834 1 1 1 . HG2 H 2.095 -1.451 4.774 1.00 . A A . 1 H00 HG2 1 1
9 1835 1 1 1 . O O 4.605 -1.581 6.740 1.00 . A A . 1 H00 O 1 1
9 1836 1 1 1 . SD S -0.257 -1.569 5.125 1.00 . A A . 1 H00 SD 1 1
9 1837 1 1 2 THR C C 5.567 -0.741 3.797 1.00 . A A . 2 THR C 1 1
9 1838 1 1 2 THR CA C 6.088 -2.019 4.452 1.00 . A A . 2 THR CA 1 1
9 1839 1 1 2 THR CB C 6.944 -2.798 3.435 1.00 . A A . 2 THR CB 1 1
9 1840 1 1 2 THR CG2 C 7.651 -3.966 4.107 1.00 . A A . 2 THR CG2 1 1
9 1841 1 1 2 THR H H 4.715 -3.609 4.380 1.00 . A A . 2 THR H 1 1
9 1842 1 1 2 THR HA H 6.705 -1.762 5.301 1.00 . A A . 2 THR HA 1 1
9 1843 1 1 2 THR HB H 7.683 -2.132 3.018 1.00 . A A . 2 THR HB 1 1
9 1844 1 1 2 THR HG1 H 6.590 -3.961 1.877 1.00 . A A . 2 THR HG1 1 1
9 1845 1 1 2 THR HG21 H 8.295 -3.593 4.889 1.00 . A A . 2 THR HG21 1 1
9 1846 1 1 2 THR HG22 H 8.242 -4.497 3.376 1.00 . A A . 2 THR HG22 1 1
9 1847 1 1 2 THR HG23 H 6.917 -4.634 4.532 1.00 . A A . 2 THR HG23 1 1
9 1848 1 1 2 THR N N 4.982 -2.833 4.917 1.00 . A A . 2 THR N 1 1
9 1849 1 1 2 THR O O 4.411 -0.695 3.364 1.00 . A A . 2 THR O 1 1
9 1850 1 1 2 THR OG1 O 6.108 -3.288 2.377 1.00 . A A . 2 THR OG1 1 1
9 1851 1 1 3 PRO C C 5.542 1.372 1.642 1.00 . A A . 3 PRO C 1 1
9 1852 1 1 3 PRO CA C 6.018 1.586 3.079 1.00 . A A . 3 PRO CA 1 1
9 1853 1 1 3 PRO CB C 7.313 2.424 3.102 1.00 . A A . 3 PRO CB 1 1
9 1854 1 1 3 PRO CD C 7.766 0.384 4.265 1.00 . A A . 3 PRO CD 1 1
9 1855 1 1 3 PRO CG C 8.403 1.459 3.438 1.00 . A A . 3 PRO CG 1 1
9 1856 1 1 3 PRO HA H 5.244 2.090 3.638 1.00 . A A . 3 PRO HA 1 1
9 1857 1 1 3 PRO HB2 H 7.470 2.872 2.131 1.00 . A A . 3 PRO HB2 1 1
9 1858 1 1 3 PRO HB3 H 7.229 3.198 3.851 1.00 . A A . 3 PRO HB3 1 1
9 1859 1 1 3 PRO HD2 H 8.284 -0.553 4.134 1.00 . A A . 3 PRO HD2 1 1
9 1860 1 1 3 PRO HD3 H 7.750 0.667 5.307 1.00 . A A . 3 PRO HD3 1 1
9 1861 1 1 3 PRO HG2 H 8.814 1.039 2.531 1.00 . A A . 3 PRO HG2 1 1
9 1862 1 1 3 PRO HG3 H 9.175 1.960 4.005 1.00 . A A . 3 PRO HG3 1 1
9 1863 1 1 3 PRO N N 6.402 0.321 3.720 1.00 . A A . 3 PRO N 1 1
9 1864 1 1 3 PRO O O 4.660 2.079 1.159 1.00 . A A . 3 PRO O 1 1
9 1865 1 1 4 ARG C C 4.308 -0.439 -0.443 1.00 . A A . 4 ARG C 1 1
9 1866 1 1 4 ARG CA C 5.750 0.040 -0.396 1.00 . A A . 4 ARG CA 1 1
9 1867 1 1 4 ARG CB C 6.657 -1.066 -0.941 1.00 . A A . 4 ARG CB 1 1
9 1868 1 1 4 ARG CD C 8.959 -1.940 -1.363 1.00 . A A . 4 ARG CD 1 1
9 1869 1 1 4 ARG CG C 8.138 -0.758 -0.868 1.00 . A A . 4 ARG CG 1 1
9 1870 1 1 4 ARG CZ C 11.336 -2.598 -1.585 1.00 . A A . 4 ARG CZ 1 1
9 1871 1 1 4 ARG H H 6.825 -0.141 1.423 1.00 . A A . 4 ARG H 1 1
9 1872 1 1 4 ARG HA H 5.856 0.922 -1.008 1.00 . A A . 4 ARG HA 1 1
9 1873 1 1 4 ARG HB2 H 6.475 -1.969 -0.379 1.00 . A A . 4 ARG HB2 1 1
9 1874 1 1 4 ARG HB3 H 6.399 -1.243 -1.976 1.00 . A A . 4 ARG HB3 1 1
9 1875 1 1 4 ARG HD2 H 8.760 -2.790 -0.728 1.00 . A A . 4 ARG HD2 1 1
9 1876 1 1 4 ARG HD3 H 8.655 -2.171 -2.373 1.00 . A A . 4 ARG HD3 1 1
9 1877 1 1 4 ARG HE H 10.683 -0.746 -1.165 1.00 . A A . 4 ARG HE 1 1
9 1878 1 1 4 ARG HG2 H 8.353 0.107 -1.478 1.00 . A A . 4 ARG HG2 1 1
9 1879 1 1 4 ARG HG3 H 8.393 -0.556 0.161 1.00 . A A . 4 ARG HG3 1 1
9 1880 1 1 4 ARG HH11 H 10.020 -4.124 -1.828 1.00 . A A . 4 ARG HH11 1 1
9 1881 1 1 4 ARG HH12 H 11.683 -4.560 -1.989 1.00 . A A . 4 ARG HH12 1 1
9 1882 1 1 4 ARG HH21 H 12.893 -1.312 -1.398 1.00 . A A . 4 ARG HH21 1 1
9 1883 1 1 4 ARG HH22 H 13.330 -2.948 -1.757 1.00 . A A . 4 ARG HH22 1 1
9 1884 1 1 4 ARG N N 6.124 0.376 0.975 1.00 . A A . 4 ARG N 1 1
9 1885 1 1 4 ARG NE N 10.400 -1.672 -1.351 1.00 . A A . 4 ARG NE 1 1
9 1886 1 1 4 ARG NH1 N 10.984 -3.858 -1.821 1.00 . A A . 4 ARG NH1 1 1
9 1887 1 1 4 ARG NH2 N 12.621 -2.263 -1.578 1.00 . A A . 4 ARG NH2 1 1
9 1888 1 1 4 ARG O O 3.499 0.050 -1.238 1.00 . A A . 4 ARG O 1 1
9 1889 1 1 5 GLN C C 1.656 -0.921 1.011 1.00 . A A . 5 GLN C 1 1
9 1890 1 1 5 GLN CA C 2.649 -1.952 0.497 1.00 . A A . 5 GLN CA 1 1
9 1891 1 1 5 GLN CB C 2.633 -3.197 1.378 1.00 . A A . 5 GLN CB 1 1
9 1892 1 1 5 GLN CD C 3.475 -5.551 1.731 1.00 . A A . 5 GLN CD 1 1
9 1893 1 1 5 GLN CG C 3.490 -4.330 0.839 1.00 . A A . 5 GLN CG 1 1
9 1894 1 1 5 GLN H H 4.686 -1.719 1.036 1.00 . A A . 5 GLN H 1 1
9 1895 1 1 5 GLN HA H 2.361 -2.231 -0.506 1.00 . A A . 5 GLN HA 1 1
9 1896 1 1 5 GLN HB2 H 2.999 -2.933 2.360 1.00 . A A . 5 GLN HB2 1 1
9 1897 1 1 5 GLN HB3 H 1.615 -3.553 1.462 1.00 . A A . 5 GLN HB3 1 1
9 1898 1 1 5 GLN HE21 H 3.782 -6.721 0.160 1.00 . A A . 5 GLN HE21 1 1
9 1899 1 1 5 GLN HE22 H 3.646 -7.528 1.686 1.00 . A A . 5 GLN HE22 1 1
9 1900 1 1 5 GLN HG2 H 3.120 -4.612 -0.135 1.00 . A A . 5 GLN HG2 1 1
9 1901 1 1 5 GLN HG3 H 4.508 -3.980 0.748 1.00 . A A . 5 GLN HG3 1 1
9 1902 1 1 5 GLN N N 3.991 -1.389 0.425 1.00 . A A . 5 GLN N 1 1
9 1903 1 1 5 GLN NE2 N 3.651 -6.716 1.135 1.00 . A A . 5 GLN NE2 1 1
9 1904 1 1 5 GLN O O 0.517 -0.860 0.550 1.00 . A A . 5 GLN O 1 1
9 1905 1 1 5 GLN OE1 O 3.315 -5.447 2.950 1.00 . A A . 5 GLN OE1 1 1
9 1906 1 1 6 ALA C C 0.901 1.943 1.417 1.00 . A A . 6 ALA C 1 1
9 1907 1 1 6 ALA CA C 1.265 0.951 2.508 1.00 . A A . 6 ALA CA 1 1
9 1908 1 1 6 ALA CB C 1.978 1.655 3.651 1.00 . A A . 6 ALA CB 1 1
9 1909 1 1 6 ALA H H 3.009 -0.230 2.311 1.00 . A A . 6 ALA H 1 1
9 1910 1 1 6 ALA HA H 0.360 0.502 2.892 1.00 . A A . 6 ALA HA 1 1
9 1911 1 1 6 ALA HB1 H 2.234 0.935 4.414 1.00 . A A . 6 ALA HB1 1 1
9 1912 1 1 6 ALA HB2 H 1.329 2.410 4.071 1.00 . A A . 6 ALA HB2 1 1
9 1913 1 1 6 ALA HB3 H 2.879 2.121 3.280 1.00 . A A . 6 ALA HB3 1 1
9 1914 1 1 6 ALA N N 2.098 -0.108 1.962 1.00 . A A . 6 ALA N 1 1
9 1915 1 1 6 ALA O O -0.244 2.376 1.314 1.00 . A A . 6 ALA O 1 1
9 1916 1 1 7 ARG C C 0.675 2.576 -1.498 1.00 . A A . 7 ARG C 1 1
9 1917 1 1 7 ARG CA C 1.676 3.177 -0.513 1.00 . A A . 7 ARG CA 1 1
9 1918 1 1 7 ARG CB C 3.014 3.454 -1.201 1.00 . A A . 7 ARG CB 1 1
9 1919 1 1 7 ARG CD C 2.317 5.598 -2.284 1.00 . A A . 7 ARG CD 1 1
9 1920 1 1 7 ARG CG C 2.886 4.206 -2.497 1.00 . A A . 7 ARG CG 1 1
9 1921 1 1 7 ARG CZ C 2.007 7.638 -3.644 1.00 . A A . 7 ARG CZ 1 1
9 1922 1 1 7 ARG H H 2.780 1.912 0.713 1.00 . A A . 7 ARG H 1 1
9 1923 1 1 7 ARG HA H 1.280 4.102 -0.124 1.00 . A A . 7 ARG HA 1 1
9 1924 1 1 7 ARG HB2 H 3.636 4.034 -0.535 1.00 . A A . 7 ARG HB2 1 1
9 1925 1 1 7 ARG HB3 H 3.503 2.512 -1.402 1.00 . A A . 7 ARG HB3 1 1
9 1926 1 1 7 ARG HD2 H 1.358 5.510 -1.795 1.00 . A A . 7 ARG HD2 1 1
9 1927 1 1 7 ARG HD3 H 2.991 6.157 -1.653 1.00 . A A . 7 ARG HD3 1 1
9 1928 1 1 7 ARG HE H 2.105 5.768 -4.362 1.00 . A A . 7 ARG HE 1 1
9 1929 1 1 7 ARG HG2 H 3.855 4.279 -2.969 1.00 . A A . 7 ARG HG2 1 1
9 1930 1 1 7 ARG HG3 H 2.214 3.637 -3.116 1.00 . A A . 7 ARG HG3 1 1
9 1931 1 1 7 ARG HH11 H 2.210 7.993 -1.652 1.00 . A A . 7 ARG HH11 1 1
9 1932 1 1 7 ARG HH12 H 1.959 9.398 -2.629 1.00 . A A . 7 ARG HH12 1 1
9 1933 1 1 7 ARG HH21 H 1.781 7.630 -5.664 1.00 . A A . 7 ARG HH21 1 1
9 1934 1 1 7 ARG HH22 H 1.727 9.189 -4.924 1.00 . A A . 7 ARG HH22 1 1
9 1935 1 1 7 ARG N N 1.881 2.280 0.587 1.00 . A A . 7 ARG N 1 1
9 1936 1 1 7 ARG NE N 2.139 6.315 -3.544 1.00 . A A . 7 ARG NE 1 1
9 1937 1 1 7 ARG NH1 N 2.065 8.403 -2.555 1.00 . A A . 7 ARG NH1 1 1
9 1938 1 1 7 ARG NH2 N 1.824 8.196 -4.833 1.00 . A A . 7 ARG NH2 1 1
9 1939 1 1 7 ARG O O -0.225 3.265 -1.979 1.00 . A A . 7 ARG O 1 1
9 1940 1 1 8 ALA C C -1.487 0.575 -2.135 1.00 . A A . 8 ALA C 1 1
9 1941 1 1 8 ALA CA C -0.063 0.576 -2.678 1.00 . A A . 8 ALA CA 1 1
9 1942 1 1 8 ALA CB C 0.426 -0.849 -2.895 1.00 . A A . 8 ALA CB 1 1
9 1943 1 1 8 ALA H H 1.574 0.797 -1.356 1.00 . A A . 8 ALA H 1 1
9 1944 1 1 8 ALA HA H -0.050 1.090 -3.628 1.00 . A A . 8 ALA HA 1 1
9 1945 1 1 8 ALA HB1 H 1.437 -0.832 -3.273 1.00 . A A . 8 ALA HB1 1 1
9 1946 1 1 8 ALA HB2 H -0.216 -1.344 -3.609 1.00 . A A . 8 ALA HB2 1 1
9 1947 1 1 8 ALA HB3 H 0.401 -1.385 -1.957 1.00 . A A . 8 ALA HB3 1 1
9 1948 1 1 8 ALA N N 0.831 1.285 -1.773 1.00 . A A . 8 ALA N 1 1
9 1949 1 1 8 ALA O O -2.453 0.716 -2.888 1.00 . A A . 8 ALA O 1 1
9 1950 1 1 9 ALA C C -3.553 1.804 -0.257 1.00 . A A . 9 ALA C 1 1
9 1951 1 1 9 ALA CA C -2.901 0.433 -0.159 1.00 . A A . 9 ALA CA 1 1
9 1952 1 1 9 ALA CB C -2.751 0.019 1.297 1.00 . A A . 9 ALA CB 1 1
9 1953 1 1 9 ALA H H -0.794 0.301 -0.281 1.00 . A A . 9 ALA H 1 1
9 1954 1 1 9 ALA HA H -3.531 -0.292 -0.654 1.00 . A A . 9 ALA HA 1 1
9 1955 1 1 9 ALA HB1 H -2.140 0.743 1.816 1.00 . A A . 9 ALA HB1 1 1
9 1956 1 1 9 ALA HB2 H -2.279 -0.951 1.347 1.00 . A A . 9 ALA HB2 1 1
9 1957 1 1 9 ALA HB3 H -3.725 -0.028 1.760 1.00 . A A . 9 ALA HB3 1 1
9 1958 1 1 9 ALA N N -1.607 0.428 -0.821 1.00 . A A . 9 ALA N 1 1
9 1959 1 1 9 ALA O O -4.741 1.918 -0.538 1.00 . A A . 9 ALA O 1 1
9 1960 1 1 10 ARG C C -3.682 4.568 -1.528 1.00 . A A . 10 ARG C 1 1
9 1961 1 1 10 ARG CA C -3.262 4.214 -0.104 1.00 . A A . 10 ARG CA 1 1
9 1962 1 1 10 ARG CB C -2.195 5.188 0.395 1.00 . A A . 10 ARG CB 1 1
9 1963 1 1 10 ARG CD C -0.655 5.862 2.261 1.00 . A A . 10 ARG CD 1 1
9 1964 1 1 10 ARG CG C -1.803 4.963 1.845 1.00 . A A . 10 ARG CG 1 1
9 1965 1 1 10 ARG CZ C 1.023 5.913 4.080 1.00 . A A . 10 ARG CZ 1 1
9 1966 1 1 10 ARG H H -1.822 2.683 0.188 1.00 . A A . 10 ARG H 1 1
9 1967 1 1 10 ARG HA H -4.127 4.283 0.538 1.00 . A A . 10 ARG HA 1 1
9 1968 1 1 10 ARG HB2 H -1.312 5.080 -0.216 1.00 . A A . 10 ARG HB2 1 1
9 1969 1 1 10 ARG HB3 H -2.568 6.196 0.298 1.00 . A A . 10 ARG HB3 1 1
9 1970 1 1 10 ARG HD2 H 0.146 5.759 1.544 1.00 . A A . 10 ARG HD2 1 1
9 1971 1 1 10 ARG HD3 H -0.999 6.885 2.274 1.00 . A A . 10 ARG HD3 1 1
9 1972 1 1 10 ARG HE H -0.727 4.934 4.141 1.00 . A A . 10 ARG HE 1 1
9 1973 1 1 10 ARG HG2 H -2.655 5.172 2.475 1.00 . A A . 10 ARG HG2 1 1
9 1974 1 1 10 ARG HG3 H -1.507 3.931 1.970 1.00 . A A . 10 ARG HG3 1 1
9 1975 1 1 10 ARG HH11 H 1.522 7.030 2.459 1.00 . A A . 10 ARG HH11 1 1
9 1976 1 1 10 ARG HH12 H 2.694 7.022 3.730 1.00 . A A . 10 ARG HH12 1 1
9 1977 1 1 10 ARG HH21 H 0.829 4.902 5.830 1.00 . A A . 10 ARG HH21 1 1
9 1978 1 1 10 ARG HH22 H 2.293 5.803 5.660 1.00 . A A . 10 ARG HH22 1 1
9 1979 1 1 10 ARG N N -2.766 2.843 -0.036 1.00 . A A . 10 ARG N 1 1
9 1980 1 1 10 ARG NE N -0.151 5.514 3.590 1.00 . A A . 10 ARG NE 1 1
9 1981 1 1 10 ARG NH1 N 1.806 6.717 3.368 1.00 . A A . 10 ARG NH1 1 1
9 1982 1 1 10 ARG NH2 N 1.411 5.510 5.281 1.00 . A A . 10 ARG NH2 1 1
9 1983 1 1 10 ARG O O -4.647 5.310 -1.739 1.00 . A A . 10 ARG O 1 1
9 1984 1 1 11 ALA C C -4.567 3.569 -4.290 1.00 . A A . 11 ALA C 1 1
9 1985 1 1 11 ALA CA C -3.260 4.261 -3.903 1.00 . A A . 11 ALA CA 1 1
9 1986 1 1 11 ALA CB C -2.118 3.767 -4.780 1.00 . A A . 11 ALA CB 1 1
9 1987 1 1 11 ALA H H -2.167 3.496 -2.261 1.00 . A A . 11 ALA H 1 1
9 1988 1 1 11 ALA HA H -3.370 5.325 -4.057 1.00 . A A . 11 ALA HA 1 1
9 1989 1 1 11 ALA HB1 H -1.202 4.258 -4.488 1.00 . A A . 11 ALA HB1 1 1
9 1990 1 1 11 ALA HB2 H -2.334 3.993 -5.814 1.00 . A A . 11 ALA HB2 1 1
9 1991 1 1 11 ALA HB3 H -2.009 2.699 -4.661 1.00 . A A . 11 ALA HB3 1 1
9 1992 1 1 11 ALA N N -2.949 4.043 -2.498 1.00 . A A . 11 ALA N 1 1
9 1993 1 1 11 ALA O O -5.430 4.164 -4.942 1.00 . A A . 11 ALA O 1 1
9 1994 1 1 12 ALA C C -7.114 1.947 -3.386 1.00 . A A . 12 ALA C 1 1
9 1995 1 1 12 ALA CA C -5.890 1.516 -4.195 1.00 . A A . 12 ALA CA 1 1
9 1996 1 1 12 ALA CB C -5.602 0.040 -3.978 1.00 . A A . 12 ALA CB 1 1
9 1997 1 1 12 ALA H H -3.997 1.913 -3.325 1.00 . A A . 12 ALA H 1 1
9 1998 1 1 12 ALA HA H -6.103 1.663 -5.244 1.00 . A A . 12 ALA HA 1 1
9 1999 1 1 12 ALA HB1 H -4.741 -0.249 -4.563 1.00 . A A . 12 ALA HB1 1 1
9 2000 1 1 12 ALA HB2 H -6.458 -0.543 -4.284 1.00 . A A . 12 ALA HB2 1 1
9 2001 1 1 12 ALA HB3 H -5.401 -0.137 -2.931 1.00 . A A . 12 ALA HB3 1 1
9 2002 1 1 12 ALA N N -4.711 2.315 -3.868 1.00 . A A . 12 ALA N 1 1
9 2003 1 1 12 ALA O O -8.251 1.814 -3.845 1.00 . A A . 12 ALA O 1 1
9 2004 1 1 13 DAL C C -8.284 1.911 -0.231 1.00 . A A . 13 DAL C 1 1
9 2005 1 1 13 DAL CA C -7.971 2.912 -1.336 1.00 . A A . 13 DAL CA 1 1
9 2006 1 1 13 DAL CB C -7.634 4.267 -0.735 1.00 . A A . 13 DAL CB 1 1
9 2007 1 1 13 DAL H H -5.959 2.496 -1.857 1.00 . A A . 13 DAL H 1 1
9 2008 1 1 13 DAL HA H -8.848 3.029 -1.956 1.00 . A A . 13 DAL HA 1 1
9 2009 1 1 13 DAL HB1 H -8.473 4.622 -0.156 1.00 . A A . 13 DAL HB1 1 1
9 2010 1 1 13 DAL HB2 H -7.420 4.969 -1.526 1.00 . A A . 13 DAL HB2 1 1
9 2011 1 1 13 DAL HB3 H -6.769 4.171 -0.095 1.00 . A A . 13 DAL HB3 1 1
9 2012 1 1 13 DAL N N -6.884 2.446 -2.186 1.00 . A A . 13 DAL N 1 1
9 2013 1 1 13 DAL O O -9.446 1.709 0.124 1.00 . A A . 13 DAL O 1 1
9 2014 1 1 14 CYS C C -6.841 0.903 2.684 1.00 . A A . 14 CYS C 1 1
9 2015 1 1 14 CYS CA C -7.415 0.335 1.389 1.00 . A A . 14 CYS CA 1 1
9 2016 1 1 14 CYS CB C -6.734 -0.993 1.048 1.00 . A A . 14 CYS CB 1 1
9 2017 1 1 14 CYS H H -6.349 1.460 -0.044 1.00 . A A . 14 CYS H 1 1
9 2018 1 1 14 CYS HA H -8.472 0.164 1.523 1.00 . A A . 14 CYS HA 1 1
9 2019 1 1 14 CYS HB2 H -5.879 -1.120 1.694 1.00 . A A . 14 CYS HB2 1 1
9 2020 1 1 14 CYS HB3 H -7.432 -1.798 1.230 1.00 . A A . 14 CYS HB3 1 1
9 2021 1 1 14 CYS N N -7.253 1.286 0.302 1.00 . A A . 14 CYS N 1 1
9 2022 1 1 14 CYS O O -5.669 0.695 3.002 1.00 . A A . 14 CYS O 1 1
9 2023 1 1 14 CYS SG S -6.168 -1.114 -0.661 1.00 . A A . 14 CYS SG 1 1
9 2024 1 1 15 NH2 HN1 H -8.076 1.206 4.199 1.00 . A A . 15 NH2 HN1 1 1
9 2025 1 1 15 NH2 HN2 H -7.958 2.494 3.057 1.00 . A A . 15 NH2 HN2 1 1
9 2026 1 1 15 NH2 N N -7.659 1.634 3.422 1.00 . A A . 15 NH2 N 1 1
9 2027 2 2 1 . CB1 C -1.231 -3.092 5.075 1.00 . B A . 101 B0I CB1 1 1
9 2028 2 2 1 . CB2 C -5.733 -2.862 -0.746 1.00 . B A . 101 B0I CB2 1 1
9 2029 2 2 1 . CD1 C -1.700 -3.458 2.663 1.00 . B A . 101 B0I CD1 1 1
9 2030 2 2 1 . CD2 C -0.256 -4.992 3.759 1.00 . B A . 101 B0I CD2 1 1
9 2031 2 2 1 . CD3 C -3.579 -3.517 0.359 1.00 . B A . 101 B0I CD3 1 1
9 2032 2 2 1 . CD4 C -3.530 -2.895 -1.941 1.00 . B A . 101 B0I CD4 1 1
9 2033 2 2 1 . CE1 C -1.556 -4.159 1.479 1.00 . B A . 101 B0I CE1 1 1
9 2034 2 2 1 . CE2 C -0.104 -5.701 2.584 1.00 . B A . 101 B0I CE2 1 1
9 2035 2 2 1 . CE3 C -2.214 -3.735 0.333 1.00 . B A . 101 B0I CE3 1 1
9 2036 2 2 1 . CE4 C -2.167 -3.110 -1.974 1.00 . B A . 101 B0I CE4 1 1
9 2037 2 2 1 . CG1 C -1.059 -3.862 3.805 1.00 . B A . 101 B0I CG1 1 1
9 2038 2 2 1 . CG2 C -4.251 -3.095 -0.777 1.00 . B A . 101 B0I CG2 1 1
9 2039 2 2 1 . CZ1 C -0.755 -5.284 1.440 1.00 . B A . 101 B0I CZ1 1 1
9 2040 2 2 1 . CZ2 C -1.507 -3.530 -0.836 1.00 . B A . 101 B0I CZ2 1 1
9 2041 2 2 1 . H1 H -0.936 -3.726 5.889 1.00 . B A . 101 B0I H1 1 1
9 2042 2 2 1 . H2 H -6.137 -3.366 0.120 1.00 . B A . 101 B0I H2 1 1
9 2043 2 2 1 . HB11 H -2.277 -2.840 5.177 1.00 . B A . 101 B0I HB11 1 1
9 2044 2 2 1 . HB21 H -6.160 -3.286 -1.642 1.00 . B A . 101 B0I HB21 1 1
9 2045 2 2 1 . HD1 H -2.321 -2.580 2.711 1.00 . B A . 101 B0I HD1 1 1
9 2046 2 2 1 . HD2 H 0.253 -5.318 4.654 1.00 . B A . 101 B0I HD2 1 1
9 2047 2 2 1 . HD3 H -4.131 -3.677 1.273 1.00 . B A . 101 B0I HD3 1 1
9 2048 2 2 1 . HD4 H -4.044 -2.566 -2.832 1.00 . B A . 101 B0I HD4 1 1
9 2049 2 2 1 . HE2 H 0.524 -6.579 2.559 1.00 . B A . 101 B0I HE2 1 1
9 2050 2 2 1 . HE4 H -1.617 -2.950 -2.890 1.00 . B A . 101 B0I HE4 1 1
9 2051 2 2 1 . HZ1 H -0.639 -5.835 0.519 1.00 . B A . 101 B0I HZ1 1 1
9 2052 2 2 1 . HZ2 H -0.441 -3.699 -0.860 1.00 . B A . 101 B0I HZ2 1 1
10 2053 1 1 1 . C C 4.463 -2.474 6.040 1.00 . A A . 1 H00 C 1 1
10 2054 1 1 1 . CA C 3.199 -3.107 6.581 1.00 . A A . 1 H00 CA 1 1
10 2055 1 1 1 . CB C 2.077 -2.085 6.616 1.00 . A A . 1 H00 CB 1 1
10 2056 1 1 1 . CG C 1.692 -1.637 5.216 1.00 . A A . 1 H00 CG 1 1
10 2057 1 1 1 . HA1 H 3.379 -3.469 7.583 1.00 . A A . 1 H00 HA1 1 1
10 2058 1 1 1 . HA2 H 2.910 -3.931 5.944 1.00 . A A . 1 H00 HA2 1 1
10 2059 1 1 1 . HB1 H 2.404 -1.225 7.183 1.00 . A A . 1 H00 HB1 1 1
10 2060 1 1 1 . HB2 H 1.214 -2.527 7.091 1.00 . A A . 1 H00 HB2 1 1
10 2061 1 1 1 . HG1 H 1.707 -2.498 4.561 1.00 . A A . 1 H00 HG1 1 1
10 2062 1 1 1 . HG2 H 2.416 -0.911 4.874 1.00 . A A . 1 H00 HG2 1 1
10 2063 1 1 1 . O O 4.999 -1.537 6.637 1.00 . A A . 1 H00 O 1 1
10 2064 1 1 1 . SD S 0.053 -0.889 5.150 1.00 . A A . 1 H00 SD 1 1
10 2065 1 1 2 THR C C 5.843 -1.089 3.630 1.00 . A A . 2 THR C 1 1
10 2066 1 1 2 THR CA C 6.134 -2.442 4.291 1.00 . A A . 2 THR CA 1 1
10 2067 1 1 2 THR CB C 6.704 -3.429 3.248 1.00 . A A . 2 THR CB 1 1
10 2068 1 1 2 THR CG2 C 7.222 -4.687 3.929 1.00 . A A . 2 THR CG2 1 1
10 2069 1 1 2 THR H H 4.463 -3.715 4.480 1.00 . A A . 2 THR H 1 1
10 2070 1 1 2 THR HA H 6.870 -2.299 5.069 1.00 . A A . 2 THR HA 1 1
10 2071 1 1 2 THR HB H 7.522 -2.951 2.729 1.00 . A A . 2 THR HB 1 1
10 2072 1 1 2 THR HG1 H 5.146 -4.491 2.664 1.00 . A A . 2 THR HG1 1 1
10 2073 1 1 2 THR HG21 H 6.422 -5.145 4.490 1.00 . A A . 2 THR HG21 1 1
10 2074 1 1 2 THR HG22 H 8.030 -4.430 4.597 1.00 . A A . 2 THR HG22 1 1
10 2075 1 1 2 THR HG23 H 7.578 -5.379 3.181 1.00 . A A . 2 THR HG23 1 1
10 2076 1 1 2 THR N N 4.935 -2.973 4.911 1.00 . A A . 2 THR N 1 1
10 2077 1 1 2 THR O O 4.688 -0.794 3.305 1.00 . A A . 2 THR O 1 1
10 2078 1 1 2 THR OG1 O 5.692 -3.782 2.297 1.00 . A A . 2 THR OG1 1 1
10 2079 1 1 3 PRO C C 5.972 1.062 1.503 1.00 . A A . 3 PRO C 1 1
10 2080 1 1 3 PRO CA C 6.730 1.091 2.833 1.00 . A A . 3 PRO CA 1 1
10 2081 1 1 3 PRO CB C 8.176 1.541 2.612 1.00 . A A . 3 PRO CB 1 1
10 2082 1 1 3 PRO CD C 8.287 -0.524 3.798 1.00 . A A . 3 PRO CD 1 1
10 2083 1 1 3 PRO CG C 8.955 0.812 3.644 1.00 . A A . 3 PRO CG 1 1
10 2084 1 1 3 PRO HA H 6.238 1.770 3.511 1.00 . A A . 3 PRO HA 1 1
10 2085 1 1 3 PRO HB2 H 8.491 1.272 1.614 1.00 . A A . 3 PRO HB2 1 1
10 2086 1 1 3 PRO HB3 H 8.251 2.610 2.746 1.00 . A A . 3 PRO HB3 1 1
10 2087 1 1 3 PRO HD2 H 8.726 -1.244 3.123 1.00 . A A . 3 PRO HD2 1 1
10 2088 1 1 3 PRO HD3 H 8.360 -0.866 4.819 1.00 . A A . 3 PRO HD3 1 1
10 2089 1 1 3 PRO HG2 H 9.976 0.685 3.313 1.00 . A A . 3 PRO HG2 1 1
10 2090 1 1 3 PRO HG3 H 8.926 1.354 4.577 1.00 . A A . 3 PRO HG3 1 1
10 2091 1 1 3 PRO N N 6.883 -0.247 3.434 1.00 . A A . 3 PRO N 1 1
10 2092 1 1 3 PRO O O 5.110 1.907 1.249 1.00 . A A . 3 PRO O 1 1
10 2093 1 1 4 ARG C C 4.165 -0.376 -0.442 1.00 . A A . 4 ARG C 1 1
10 2094 1 1 4 ARG CA C 5.653 -0.072 -0.597 1.00 . A A . 4 ARG CA 1 1
10 2095 1 1 4 ARG CB C 6.344 -1.187 -1.347 1.00 . A A . 4 ARG CB 1 1
10 2096 1 1 4 ARG CD C 6.555 -2.295 -3.560 1.00 . A A . 4 ARG CD 1 1
10 2097 1 1 4 ARG CG C 5.656 -1.536 -2.608 1.00 . A A . 4 ARG CG 1 1
10 2098 1 1 4 ARG CZ C 7.612 -4.531 -3.620 1.00 . A A . 4 ARG CZ 1 1
10 2099 1 1 4 ARG H H 6.982 -0.556 0.891 1.00 . A A . 4 ARG H 1 1
10 2100 1 1 4 ARG HA H 5.774 0.844 -1.154 1.00 . A A . 4 ARG HA 1 1
10 2101 1 1 4 ARG HB2 H 7.353 -0.882 -1.583 1.00 . A A . 4 ARG HB2 1 1
10 2102 1 1 4 ARG HB3 H 6.375 -2.064 -0.720 1.00 . A A . 4 ARG HB3 1 1
10 2103 1 1 4 ARG HD2 H 5.979 -2.581 -4.426 1.00 . A A . 4 ARG HD2 1 1
10 2104 1 1 4 ARG HD3 H 7.365 -1.649 -3.865 1.00 . A A . 4 ARG HD3 1 1
10 2105 1 1 4 ARG HE H 7.124 -3.525 -1.959 1.00 . A A . 4 ARG HE 1 1
10 2106 1 1 4 ARG HG2 H 4.779 -2.128 -2.379 1.00 . A A . 4 ARG HG2 1 1
10 2107 1 1 4 ARG HG3 H 5.369 -0.597 -3.023 1.00 . A A . 4 ARG HG3 1 1
10 2108 1 1 4 ARG HH11 H 7.170 -3.784 -5.463 1.00 . A A . 4 ARG HH11 1 1
10 2109 1 1 4 ARG HH12 H 7.954 -5.326 -5.463 1.00 . A A . 4 ARG HH12 1 1
10 2110 1 1 4 ARG HH21 H 8.148 -5.553 -1.958 1.00 . A A . 4 ARG HH21 1 1
10 2111 1 1 4 ARG HH22 H 8.512 -6.339 -3.456 1.00 . A A . 4 ARG HH22 1 1
10 2112 1 1 4 ARG N N 6.285 0.083 0.668 1.00 . A A . 4 ARG N 1 1
10 2113 1 1 4 ARG NE N 7.114 -3.497 -2.945 1.00 . A A . 4 ARG NE 1 1
10 2114 1 1 4 ARG NH1 N 7.575 -4.548 -4.952 1.00 . A A . 4 ARG NH1 1 1
10 2115 1 1 4 ARG NH2 N 8.130 -5.555 -2.963 1.00 . A A . 4 ARG NH2 1 1
10 2116 1 1 4 ARG O O 3.318 0.286 -1.043 1.00 . A A . 4 ARG O 1 1
10 2117 1 1 5 GLN C C 1.687 -0.621 1.259 1.00 . A A . 5 GLN C 1 1
10 2118 1 1 5 GLN CA C 2.483 -1.765 0.648 1.00 . A A . 5 GLN CA 1 1
10 2119 1 1 5 GLN CB C 2.443 -2.980 1.572 1.00 . A A . 5 GLN CB 1 1
10 2120 1 1 5 GLN CD C 2.996 -5.417 1.898 1.00 . A A . 5 GLN CD 1 1
10 2121 1 1 5 GLN CG C 2.879 -4.275 0.911 1.00 . A A . 5 GLN CG 1 1
10 2122 1 1 5 GLN H H 4.597 -1.851 0.805 1.00 . A A . 5 GLN H 1 1
10 2123 1 1 5 GLN HA H 2.030 -2.033 -0.295 1.00 . A A . 5 GLN HA 1 1
10 2124 1 1 5 GLN HB2 H 3.095 -2.796 2.414 1.00 . A A . 5 GLN HB2 1 1
10 2125 1 1 5 GLN HB3 H 1.431 -3.108 1.932 1.00 . A A . 5 GLN HB3 1 1
10 2126 1 1 5 GLN HE21 H 2.478 -6.714 0.493 1.00 . A A . 5 GLN HE21 1 1
10 2127 1 1 5 GLN HE22 H 2.790 -7.381 2.062 1.00 . A A . 5 GLN HE22 1 1
10 2128 1 1 5 GLN HG2 H 2.153 -4.543 0.158 1.00 . A A . 5 GLN HG2 1 1
10 2129 1 1 5 GLN HG3 H 3.841 -4.120 0.444 1.00 . A A . 5 GLN HG3 1 1
10 2130 1 1 5 GLN N N 3.864 -1.366 0.379 1.00 . A A . 5 GLN N 1 1
10 2131 1 1 5 GLN NE2 N 2.731 -6.622 1.439 1.00 . A A . 5 GLN NE2 1 1
10 2132 1 1 5 GLN O O 0.496 -0.479 0.997 1.00 . A A . 5 GLN O 1 1
10 2133 1 1 5 GLN OE1 O 3.325 -5.211 3.074 1.00 . A A . 5 GLN OE1 1 1
10 2134 1 1 6 ALA C C 1.214 2.319 1.653 1.00 . A A . 6 ALA C 1 1
10 2135 1 1 6 ALA CA C 1.706 1.334 2.703 1.00 . A A . 6 ALA CA 1 1
10 2136 1 1 6 ALA CB C 2.663 2.016 3.667 1.00 . A A . 6 ALA CB 1 1
10 2137 1 1 6 ALA H H 3.303 0.019 2.248 1.00 . A A . 6 ALA H 1 1
10 2138 1 1 6 ALA HA H 0.859 0.968 3.265 1.00 . A A . 6 ALA HA 1 1
10 2139 1 1 6 ALA HB1 H 3.012 1.300 4.395 1.00 . A A . 6 ALA HB1 1 1
10 2140 1 1 6 ALA HB2 H 2.152 2.823 4.171 1.00 . A A . 6 ALA HB2 1 1
10 2141 1 1 6 ALA HB3 H 3.506 2.410 3.117 1.00 . A A . 6 ALA HB3 1 1
10 2142 1 1 6 ALA N N 2.352 0.194 2.070 1.00 . A A . 6 ALA N 1 1
10 2143 1 1 6 ALA O O 0.095 2.828 1.738 1.00 . A A . 6 ALA O 1 1
10 2144 1 1 7 ARG C C 0.639 2.833 -1.308 1.00 . A A . 7 ARG C 1 1
10 2145 1 1 7 ARG CA C 1.695 3.469 -0.430 1.00 . A A . 7 ARG CA 1 1
10 2146 1 1 7 ARG CB C 2.923 3.806 -1.267 1.00 . A A . 7 ARG CB 1 1
10 2147 1 1 7 ARG CD C 5.218 4.805 -1.371 1.00 . A A . 7 ARG CD 1 1
10 2148 1 1 7 ARG CG C 4.025 4.480 -0.487 1.00 . A A . 7 ARG CG 1 1
10 2149 1 1 7 ARG CZ C 6.046 3.156 -3.041 1.00 . A A . 7 ARG CZ 1 1
10 2150 1 1 7 ARG H H 2.931 2.139 0.657 1.00 . A A . 7 ARG H 1 1
10 2151 1 1 7 ARG HA H 1.300 4.378 -0.001 1.00 . A A . 7 ARG HA 1 1
10 2152 1 1 7 ARG HB2 H 3.318 2.894 -1.691 1.00 . A A . 7 ARG HB2 1 1
10 2153 1 1 7 ARG HB3 H 2.625 4.464 -2.071 1.00 . A A . 7 ARG HB3 1 1
10 2154 1 1 7 ARG HD2 H 4.864 5.319 -2.252 1.00 . A A . 7 ARG HD2 1 1
10 2155 1 1 7 ARG HD3 H 5.886 5.455 -0.824 1.00 . A A . 7 ARG HD3 1 1
10 2156 1 1 7 ARG HE H 6.433 3.120 -1.068 1.00 . A A . 7 ARG HE 1 1
10 2157 1 1 7 ARG HG2 H 3.644 5.393 -0.053 1.00 . A A . 7 ARG HG2 1 1
10 2158 1 1 7 ARG HG3 H 4.337 3.804 0.296 1.00 . A A . 7 ARG HG3 1 1
10 2159 1 1 7 ARG HH11 H 4.798 4.554 -3.825 1.00 . A A . 7 ARG HH11 1 1
10 2160 1 1 7 ARG HH12 H 5.445 3.429 -4.964 1.00 . A A . 7 ARG HH12 1 1
10 2161 1 1 7 ARG HH21 H 7.307 1.638 -2.578 1.00 . A A . 7 ARG HH21 1 1
10 2162 1 1 7 ARG HH22 H 6.885 1.747 -4.252 1.00 . A A . 7 ARG HH22 1 1
10 2163 1 1 7 ARG N N 2.050 2.571 0.658 1.00 . A A . 7 ARG N 1 1
10 2164 1 1 7 ARG NE N 5.953 3.603 -1.782 1.00 . A A . 7 ARG NE 1 1
10 2165 1 1 7 ARG NH1 N 5.379 3.759 -4.018 1.00 . A A . 7 ARG NH1 1 1
10 2166 1 1 7 ARG NH2 N 6.803 2.098 -3.315 1.00 . A A . 7 ARG NH2 1 1
10 2167 1 1 7 ARG O O -0.339 3.476 -1.692 1.00 . A A . 7 ARG O 1 1
10 2168 1 1 8 ALA C C -1.492 0.789 -1.847 1.00 . A A . 8 ALA C 1 1
10 2169 1 1 8 ALA CA C -0.087 0.804 -2.445 1.00 . A A . 8 ALA CA 1 1
10 2170 1 1 8 ALA CB C 0.421 -0.615 -2.645 1.00 . A A . 8 ALA CB 1 1
10 2171 1 1 8 ALA H H 1.649 1.119 -1.260 1.00 . A A . 8 ALA H 1 1
10 2172 1 1 8 ALA HA H -0.128 1.287 -3.409 1.00 . A A . 8 ALA HA 1 1
10 2173 1 1 8 ALA HB1 H 0.426 -1.132 -1.697 1.00 . A A . 8 ALA HB1 1 1
10 2174 1 1 8 ALA HB2 H 1.424 -0.584 -3.044 1.00 . A A . 8 ALA HB2 1 1
10 2175 1 1 8 ALA HB3 H -0.226 -1.134 -3.336 1.00 . A A . 8 ALA HB3 1 1
10 2176 1 1 8 ALA N N 0.838 1.560 -1.608 1.00 . A A . 8 ALA N 1 1
10 2177 1 1 8 ALA O O -2.481 0.915 -2.567 1.00 . A A . 8 ALA O 1 1
10 2178 1 1 9 ALA C C -3.601 1.942 -0.015 1.00 . A A . 9 ALA C 1 1
10 2179 1 1 9 ALA CA C -2.851 0.628 0.169 1.00 . A A . 9 ALA CA 1 1
10 2180 1 1 9 ALA CB C -2.641 0.344 1.646 1.00 . A A . 9 ALA CB 1 1
10 2181 1 1 9 ALA H H -0.742 0.537 -0.011 1.00 . A A . 9 ALA H 1 1
10 2182 1 1 9 ALA HA H -3.445 -0.174 -0.248 1.00 . A A . 9 ALA HA 1 1
10 2183 1 1 9 ALA HB1 H -2.061 -0.559 1.756 1.00 . A A . 9 ALA HB1 1 1
10 2184 1 1 9 ALA HB2 H -3.598 0.221 2.130 1.00 . A A . 9 ALA HB2 1 1
10 2185 1 1 9 ALA HB3 H -2.110 1.168 2.099 1.00 . A A . 9 ALA HB3 1 1
10 2186 1 1 9 ALA N N -1.571 0.646 -0.530 1.00 . A A . 9 ALA N 1 1
10 2187 1 1 9 ALA O O -4.816 1.951 -0.238 1.00 . A A . 9 ALA O 1 1
10 2188 1 1 10 ARG C C -3.842 4.613 -1.549 1.00 . A A . 10 ARG C 1 1
10 2189 1 1 10 ARG CA C -3.469 4.372 -0.092 1.00 . A A . 10 ARG CA 1 1
10 2190 1 1 10 ARG CB C -2.506 5.461 0.382 1.00 . A A . 10 ARG CB 1 1
10 2191 1 1 10 ARG CD C -1.127 6.432 2.237 1.00 . A A . 10 ARG CD 1 1
10 2192 1 1 10 ARG CG C -1.960 5.245 1.784 1.00 . A A . 10 ARG CG 1 1
10 2193 1 1 10 ARG CZ C -0.695 6.747 4.660 1.00 . A A . 10 ARG CZ 1 1
10 2194 1 1 10 ARG H H -1.907 2.974 0.231 1.00 . A A . 10 ARG H 1 1
10 2195 1 1 10 ARG HA H -4.366 4.407 0.509 1.00 . A A . 10 ARG HA 1 1
10 2196 1 1 10 ARG HB2 H -1.670 5.506 -0.300 1.00 . A A . 10 ARG HB2 1 1
10 2197 1 1 10 ARG HB3 H -3.021 6.410 0.362 1.00 . A A . 10 ARG HB3 1 1
10 2198 1 1 10 ARG HD2 H -0.404 6.660 1.468 1.00 . A A . 10 ARG HD2 1 1
10 2199 1 1 10 ARG HD3 H -1.780 7.281 2.376 1.00 . A A . 10 ARG HD3 1 1
10 2200 1 1 10 ARG HE H 0.347 5.547 3.437 1.00 . A A . 10 ARG HE 1 1
10 2201 1 1 10 ARG HG2 H -2.786 5.115 2.467 1.00 . A A . 10 ARG HG2 1 1
10 2202 1 1 10 ARG HG3 H -1.342 4.359 1.789 1.00 . A A . 10 ARG HG3 1 1
10 2203 1 1 10 ARG HH11 H -2.360 7.707 4.000 1.00 . A A . 10 ARG HH11 1 1
10 2204 1 1 10 ARG HH12 H -1.965 7.978 5.660 1.00 . A A . 10 ARG HH12 1 1
10 2205 1 1 10 ARG HH21 H 0.858 5.891 5.643 1.00 . A A . 10 ARG HH21 1 1
10 2206 1 1 10 ARG HH22 H -0.129 6.943 6.597 1.00 . A A . 10 ARG HH22 1 1
10 2207 1 1 10 ARG N N -2.873 3.049 0.066 1.00 . A A . 10 ARG N 1 1
10 2208 1 1 10 ARG NE N -0.414 6.170 3.489 1.00 . A A . 10 ARG NE 1 1
10 2209 1 1 10 ARG NH1 N -1.754 7.538 4.783 1.00 . A A . 10 ARG NH1 1 1
10 2210 1 1 10 ARG NH2 N 0.069 6.507 5.714 1.00 . A A . 10 ARG NH2 1 1
10 2211 1 1 10 ARG O O -4.859 5.246 -1.852 1.00 . A A . 10 ARG O 1 1
10 2212 1 1 11 ALA C C -4.469 3.452 -4.302 1.00 . A A . 11 ALA C 1 1
10 2213 1 1 11 ALA CA C -3.239 4.242 -3.872 1.00 . A A . 11 ALA CA 1 1
10 2214 1 1 11 ALA CB C -2.014 3.781 -4.645 1.00 . A A . 11 ALA CB 1 1
10 2215 1 1 11 ALA H H -2.205 3.636 -2.136 1.00 . A A . 11 ALA H 1 1
10 2216 1 1 11 ALA HA H -3.403 5.287 -4.088 1.00 . A A . 11 ALA HA 1 1
10 2217 1 1 11 ALA HB1 H -1.849 2.729 -4.465 1.00 . A A . 11 ALA HB1 1 1
10 2218 1 1 11 ALA HB2 H -1.151 4.343 -4.320 1.00 . A A . 11 ALA HB2 1 1
10 2219 1 1 11 ALA HB3 H -2.175 3.945 -5.699 1.00 . A A . 11 ALA HB3 1 1
10 2220 1 1 11 ALA N N -3.010 4.109 -2.447 1.00 . A A . 11 ALA N 1 1
10 2221 1 1 11 ALA O O -5.301 3.945 -5.070 1.00 . A A . 11 ALA O 1 1
10 2222 1 1 12 ALA C C -6.976 1.840 -3.441 1.00 . A A . 12 ALA C 1 1
10 2223 1 1 12 ALA CA C -5.702 1.364 -4.127 1.00 . A A . 12 ALA CA 1 1
10 2224 1 1 12 ALA CB C -5.393 -0.071 -3.736 1.00 . A A . 12 ALA CB 1 1
10 2225 1 1 12 ALA H H -3.874 1.893 -3.201 1.00 . A A . 12 ALA H 1 1
10 2226 1 1 12 ALA HA H -5.847 1.398 -5.197 1.00 . A A . 12 ALA HA 1 1
10 2227 1 1 12 ALA HB1 H -6.218 -0.707 -4.017 1.00 . A A . 12 ALA HB1 1 1
10 2228 1 1 12 ALA HB2 H -5.244 -0.127 -2.667 1.00 . A A . 12 ALA HB2 1 1
10 2229 1 1 12 ALA HB3 H -4.496 -0.397 -4.242 1.00 . A A . 12 ALA HB3 1 1
10 2230 1 1 12 ALA N N -4.579 2.228 -3.802 1.00 . A A . 12 ALA N 1 1
10 2231 1 1 12 ALA O O -8.058 1.798 -4.026 1.00 . A A . 12 ALA O 1 1
10 2232 1 1 13 DAL C C -8.655 1.675 -0.702 1.00 . A A . 13 DAL C 1 1
10 2233 1 1 13 DAL CA C -7.983 2.802 -1.468 1.00 . A A . 13 DAL CA 1 1
10 2234 1 1 13 DAL CB C -7.558 3.908 -0.516 1.00 . A A . 13 DAL CB 1 1
10 2235 1 1 13 DAL H H -5.952 2.318 -1.797 1.00 . A A . 13 DAL H 1 1
10 2236 1 1 13 DAL HA H -8.689 3.216 -2.172 1.00 . A A . 13 DAL HA 1 1
10 2237 1 1 13 DAL HB1 H -8.428 4.306 -0.016 1.00 . A A . 13 DAL HB1 1 1
10 2238 1 1 13 DAL HB2 H -7.071 4.695 -1.072 1.00 . A A . 13 DAL HB2 1 1
10 2239 1 1 13 DAL HB3 H -6.874 3.509 0.217 1.00 . A A . 13 DAL HB3 1 1
10 2240 1 1 13 DAL N N -6.842 2.310 -2.217 1.00 . A A . 13 DAL N 1 1
10 2241 1 1 13 DAL O O -9.867 1.483 -0.796 1.00 . A A . 13 DAL O 1 1
10 2242 1 1 14 CYS C C -8.689 0.304 2.259 1.00 . A A . 14 CYS C 1 1
10 2243 1 1 14 CYS CA C -8.396 -0.169 0.839 1.00 . A A . 14 CYS CA 1 1
10 2244 1 1 14 CYS CB C -7.411 -1.338 0.860 1.00 . A A . 14 CYS CB 1 1
10 2245 1 1 14 CYS H H -6.900 1.092 0.045 1.00 . A A . 14 CYS H 1 1
10 2246 1 1 14 CYS HA H -9.318 -0.495 0.383 1.00 . A A . 14 CYS HA 1 1
10 2247 1 1 14 CYS HB2 H -6.928 -1.367 1.825 1.00 . A A . 14 CYS HB2 1 1
10 2248 1 1 14 CYS HB3 H -7.959 -2.257 0.714 1.00 . A A . 14 CYS HB3 1 1
10 2249 1 1 14 CYS N N -7.867 0.921 0.039 1.00 . A A . 14 CYS N 1 1
10 2250 1 1 14 CYS O O -7.832 0.225 3.142 1.00 . A A . 14 CYS O 1 1
10 2251 1 1 14 CYS SG S -6.133 -1.236 -0.407 1.00 . A A . 14 CYS SG 1 1
10 2252 1 1 15 NH2 HN1 H -10.004 1.390 3.259 1.00 . A A . 15 NH2 HN1 1 1
10 2253 1 1 15 NH2 HN2 H -10.541 0.765 1.747 1.00 . A A . 15 NH2 HN2 1 1
10 2254 1 1 15 NH2 N N -9.889 0.808 2.478 1.00 . A A . 15 NH2 N 1 1
10 2255 2 2 1 . CB1 C -0.999 -2.341 5.393 1.00 . B A . 101 B0I CB1 1 1
10 2256 2 2 1 . CB2 C -5.603 -2.958 -0.490 1.00 . B A . 101 B0I CB2 1 1
10 2257 2 2 1 . CD1 C -1.536 -3.014 3.068 1.00 . B A . 101 B0I CD1 1 1
10 2258 2 2 1 . CD2 C -0.264 -4.520 4.387 1.00 . B A . 101 B0I CD2 1 1
10 2259 2 2 1 . CD3 C -3.480 -3.432 0.754 1.00 . B A . 101 B0I CD3 1 1
10 2260 2 2 1 . CD4 C -3.341 -2.917 -1.568 1.00 . B A . 101 B0I CD4 1 1
10 2261 2 2 1 . CE1 C -1.490 -3.893 2.004 1.00 . B A . 101 B0I CE1 1 1
10 2262 2 2 1 . CE2 C -0.209 -5.410 3.333 1.00 . B A . 101 B0I CE2 1 1
10 2263 2 2 1 . CE3 C -2.106 -3.569 0.809 1.00 . B A . 101 B0I CE3 1 1
10 2264 2 2 1 . CE4 C -1.968 -3.050 -1.520 1.00 . B A . 101 B0I CE4 1 1
10 2265 2 2 1 . CG1 C -0.932 -3.311 4.257 1.00 . B A . 101 B0I CG1 1 1
10 2266 2 2 1 . CG2 C -4.112 -3.106 -0.434 1.00 . B A . 101 B0I CG2 1 1
10 2267 2 2 1 . CZ1 C -0.824 -5.097 2.137 1.00 . B A . 101 B0I CZ1 1 1
10 2268 2 2 1 . CZ2 C -1.349 -3.377 -0.331 1.00 . B A . 101 B0I CZ2 1 1
10 2269 2 2 1 . H1 H -0.694 -2.853 6.286 1.00 . B A . 101 B0I H1 1 1
10 2270 2 2 1 . H2 H -6.031 -3.497 0.343 1.00 . B A . 101 B0I H2 1 1
10 2271 2 2 1 . HB11 H -2.022 -2.015 5.497 1.00 . B A . 101 B0I HB11 1 1
10 2272 2 2 1 . HB21 H -5.952 -3.388 -1.417 1.00 . B A . 101 B0I HB21 1 1
10 2273 2 2 1 . HD1 H -2.052 -2.074 2.983 1.00 . B A . 101 B0I HD1 1 1
10 2274 2 2 1 . HD2 H 0.216 -4.764 5.323 1.00 . B A . 101 B0I HD2 1 1
10 2275 2 2 1 . HD3 H -4.071 -3.582 1.646 1.00 . B A . 101 B0I HD3 1 1
10 2276 2 2 1 . HD4 H -3.824 -2.661 -2.500 1.00 . B A . 101 B0I HD4 1 1
10 2277 2 2 1 . HE2 H 0.313 -6.350 3.443 1.00 . B A . 101 B0I HE2 1 1
10 2278 2 2 1 . HE4 H -1.378 -2.901 -2.412 1.00 . B A . 101 B0I HE4 1 1
10 2279 2 2 1 . HZ1 H -0.785 -5.789 1.309 1.00 . B A . 101 B0I HZ1 1 1
10 2280 2 2 1 . HZ2 H -0.274 -3.482 -0.290 1.00 . B A . 101 B0I HZ2 1 1
11 2281 1 1 1 . C C 4.294 -2.703 5.935 1.00 . A A . 1 H00 C 1 1
11 2282 1 1 1 . CA C 3.048 -3.461 6.331 1.00 . A A . 1 H00 CA 1 1
11 2283 1 1 1 . CB C 1.889 -2.498 6.530 1.00 . A A . 1 H00 CB 1 1
11 2284 1 1 1 . CG C 1.444 -1.889 5.210 1.00 . A A . 1 H00 CG 1 1
11 2285 1 1 1 . HA1 H 3.230 -3.991 7.254 1.00 . A A . 1 H00 HA1 1 1
11 2286 1 1 1 . HA2 H 2.796 -4.168 5.552 1.00 . A A . 1 H00 HA2 1 1
11 2287 1 1 1 . HB1 H 2.202 -1.706 7.195 1.00 . A A . 1 H00 HB1 1 1
11 2288 1 1 1 . HB2 H 1.059 -3.032 6.968 1.00 . A A . 1 H00 HB2 1 1
11 2289 1 1 1 . HG1 H 1.488 -2.653 4.447 1.00 . A A . 1 H00 HG1 1 1
11 2290 1 1 1 . HG2 H 2.119 -1.085 4.955 1.00 . A A . 1 H00 HG2 1 1
11 2291 1 1 1 . O O 4.740 -1.805 6.656 1.00 . A A . 1 H00 O 1 1
11 2292 1 1 1 . SD S -0.236 -1.230 5.274 1.00 . A A . 1 H00 SD 1 1
11 2293 1 1 2 THR C C 5.698 -1.031 3.714 1.00 . A A . 2 THR C 1 1
11 2294 1 1 2 THR CA C 6.051 -2.398 4.306 1.00 . A A . 2 THR CA 1 1
11 2295 1 1 2 THR CB C 6.761 -3.266 3.241 1.00 . A A . 2 THR CB 1 1
11 2296 1 1 2 THR CG2 C 7.216 -4.586 3.845 1.00 . A A . 2 THR CG2 1 1
11 2297 1 1 2 THR H H 4.455 -3.772 4.255 1.00 . A A . 2 THR H 1 1
11 2298 1 1 2 THR HA H 6.722 -2.258 5.142 1.00 . A A . 2 THR HA 1 1
11 2299 1 1 2 THR HB H 7.626 -2.733 2.875 1.00 . A A . 2 THR HB 1 1
11 2300 1 1 2 THR HG1 H 5.998 -4.435 1.851 1.00 . A A . 2 THR HG1 1 1
11 2301 1 1 2 THR HG21 H 7.887 -4.395 4.669 1.00 . A A . 2 THR HG21 1 1
11 2302 1 1 2 THR HG22 H 7.726 -5.169 3.095 1.00 . A A . 2 THR HG22 1 1
11 2303 1 1 2 THR HG23 H 6.355 -5.133 4.202 1.00 . A A . 2 THR HG23 1 1
11 2304 1 1 2 THR N N 4.858 -3.054 4.794 1.00 . A A . 2 THR N 1 1
11 2305 1 1 2 THR O O 4.531 -0.779 3.383 1.00 . A A . 2 THR O 1 1
11 2306 1 1 2 THR OG1 O 5.871 -3.526 2.150 1.00 . A A . 2 THR OG1 1 1
11 2307 1 1 3 PRO C C 5.734 1.186 1.695 1.00 . A A . 3 PRO C 1 1
11 2308 1 1 3 PRO CA C 6.471 1.220 3.031 1.00 . A A . 3 PRO CA 1 1
11 2309 1 1 3 PRO CB C 7.891 1.755 2.837 1.00 . A A . 3 PRO CB 1 1
11 2310 1 1 3 PRO CD C 8.092 -0.317 4.006 1.00 . A A . 3 PRO CD 1 1
11 2311 1 1 3 PRO CG C 8.693 1.055 3.874 1.00 . A A . 3 PRO CG 1 1
11 2312 1 1 3 PRO HA H 5.934 1.856 3.721 1.00 . A A . 3 PRO HA 1 1
11 2313 1 1 3 PRO HB2 H 8.234 1.518 1.842 1.00 . A A . 3 PRO HB2 1 1
11 2314 1 1 3 PRO HB3 H 7.901 2.825 2.986 1.00 . A A . 3 PRO HB3 1 1
11 2315 1 1 3 PRO HD2 H 8.595 -1.012 3.351 1.00 . A A . 3 PRO HD2 1 1
11 2316 1 1 3 PRO HD3 H 8.145 -0.656 5.030 1.00 . A A . 3 PRO HD3 1 1
11 2317 1 1 3 PRO HG2 H 9.722 0.986 3.558 1.00 . A A . 3 PRO HG2 1 1
11 2318 1 1 3 PRO HG3 H 8.621 1.586 4.813 1.00 . A A . 3 PRO HG3 1 1
11 2319 1 1 3 PRO N N 6.689 -0.120 3.589 1.00 . A A . 3 PRO N 1 1
11 2320 1 1 3 PRO O O 4.817 1.973 1.465 1.00 . A A . 3 PRO O 1 1
11 2321 1 1 4 ARG C C 4.045 -0.345 -0.360 1.00 . A A . 4 ARG C 1 1
11 2322 1 1 4 ARG CA C 5.486 0.140 -0.479 1.00 . A A . 4 ARG CA 1 1
11 2323 1 1 4 ARG CB C 6.291 -0.767 -1.420 1.00 . A A . 4 ARG CB 1 1
11 2324 1 1 4 ARG CD C 7.079 -3.052 -2.050 1.00 . A A . 4 ARG CD 1 1
11 2325 1 1 4 ARG CG C 6.334 -2.231 -1.016 1.00 . A A . 4 ARG CG 1 1
11 2326 1 1 4 ARG CZ C 7.328 -5.436 -2.642 1.00 . A A . 4 ARG CZ 1 1
11 2327 1 1 4 ARG H H 6.838 -0.366 1.075 1.00 . A A . 4 ARG H 1 1
11 2328 1 1 4 ARG HA H 5.464 1.135 -0.901 1.00 . A A . 4 ARG HA 1 1
11 2329 1 1 4 ARG HB2 H 5.858 -0.708 -2.406 1.00 . A A . 4 ARG HB2 1 1
11 2330 1 1 4 ARG HB3 H 7.307 -0.400 -1.465 1.00 . A A . 4 ARG HB3 1 1
11 2331 1 1 4 ARG HD2 H 6.617 -2.894 -3.013 1.00 . A A . 4 ARG HD2 1 1
11 2332 1 1 4 ARG HD3 H 8.105 -2.716 -2.086 1.00 . A A . 4 ARG HD3 1 1
11 2333 1 1 4 ARG HE H 6.835 -4.742 -0.824 1.00 . A A . 4 ARG HE 1 1
11 2334 1 1 4 ARG HG2 H 6.834 -2.323 -0.063 1.00 . A A . 4 ARG HG2 1 1
11 2335 1 1 4 ARG HG3 H 5.323 -2.601 -0.932 1.00 . A A . 4 ARG HG3 1 1
11 2336 1 1 4 ARG HH11 H 7.617 -4.153 -4.198 1.00 . A A . 4 ARG HH11 1 1
11 2337 1 1 4 ARG HH12 H 7.806 -5.826 -4.583 1.00 . A A . 4 ARG HH12 1 1
11 2338 1 1 4 ARG HH21 H 7.090 -6.966 -1.330 1.00 . A A . 4 ARG HH21 1 1
11 2339 1 1 4 ARG HH22 H 7.511 -7.439 -2.938 1.00 . A A . 4 ARG HH22 1 1
11 2340 1 1 4 ARG N N 6.115 0.251 0.828 1.00 . A A . 4 ARG N 1 1
11 2341 1 1 4 ARG NE N 7.059 -4.481 -1.749 1.00 . A A . 4 ARG NE 1 1
11 2342 1 1 4 ARG NH1 N 7.608 -5.111 -3.905 1.00 . A A . 4 ARG NH1 1 1
11 2343 1 1 4 ARG NH2 N 7.309 -6.709 -2.277 1.00 . A A . 4 ARG NH2 1 1
11 2344 1 1 4 ARG O O 3.172 0.125 -1.078 1.00 . A A . 4 ARG O 1 1
11 2345 1 1 5 GLN C C 1.530 -0.707 1.294 1.00 . A A . 5 GLN C 1 1
11 2346 1 1 5 GLN CA C 2.453 -1.795 0.779 1.00 . A A . 5 GLN CA 1 1
11 2347 1 1 5 GLN CB C 2.471 -2.974 1.753 1.00 . A A . 5 GLN CB 1 1
11 2348 1 1 5 GLN CD C 3.103 -5.382 2.171 1.00 . A A . 5 GLN CD 1 1
11 2349 1 1 5 GLN CG C 2.981 -4.271 1.146 1.00 . A A . 5 GLN CG 1 1
11 2350 1 1 5 GLN H H 4.532 -1.601 1.127 1.00 . A A . 5 GLN H 1 1
11 2351 1 1 5 GLN HA H 2.081 -2.137 -0.176 1.00 . A A . 5 GLN HA 1 1
11 2352 1 1 5 GLN HB2 H 3.108 -2.722 2.589 1.00 . A A . 5 GLN HB2 1 1
11 2353 1 1 5 GLN HB3 H 1.466 -3.141 2.113 1.00 . A A . 5 GLN HB3 1 1
11 2354 1 1 5 GLN HE21 H 2.646 -6.731 0.793 1.00 . A A . 5 GLN HE21 1 1
11 2355 1 1 5 GLN HE22 H 2.938 -7.351 2.385 1.00 . A A . 5 GLN HE22 1 1
11 2356 1 1 5 GLN HG2 H 2.294 -4.586 0.376 1.00 . A A . 5 GLN HG2 1 1
11 2357 1 1 5 GLN HG3 H 3.953 -4.092 0.710 1.00 . A A . 5 GLN HG3 1 1
11 2358 1 1 5 GLN N N 3.797 -1.270 0.567 1.00 . A A . 5 GLN N 1 1
11 2359 1 1 5 GLN NE2 N 2.877 -6.610 1.742 1.00 . A A . 5 GLN NE2 1 1
11 2360 1 1 5 GLN O O 0.371 -0.631 0.902 1.00 . A A . 5 GLN O 1 1
11 2361 1 1 5 GLN OE1 O 3.389 -5.137 3.345 1.00 . A A . 5 GLN OE1 1 1
11 2362 1 1 6 ALA C C 0.897 2.234 1.631 1.00 . A A . 6 ALA C 1 1
11 2363 1 1 6 ALA CA C 1.287 1.243 2.721 1.00 . A A . 6 ALA CA 1 1
11 2364 1 1 6 ALA CB C 2.079 1.942 3.818 1.00 . A A . 6 ALA CB 1 1
11 2365 1 1 6 ALA H H 2.992 0.017 2.445 1.00 . A A . 6 ALA H 1 1
11 2366 1 1 6 ALA HA H 0.389 0.832 3.160 1.00 . A A . 6 ALA HA 1 1
11 2367 1 1 6 ALA HB1 H 2.977 2.368 3.397 1.00 . A A . 6 ALA HB1 1 1
11 2368 1 1 6 ALA HB2 H 2.345 1.225 4.581 1.00 . A A . 6 ALA HB2 1 1
11 2369 1 1 6 ALA HB3 H 1.477 2.726 4.253 1.00 . A A . 6 ALA HB3 1 1
11 2370 1 1 6 ALA N N 2.057 0.142 2.165 1.00 . A A . 6 ALA N 1 1
11 2371 1 1 6 ALA O O -0.243 2.703 1.580 1.00 . A A . 6 ALA O 1 1
11 2372 1 1 7 ARG C C 0.669 2.843 -1.372 1.00 . A A . 7 ARG C 1 1
11 2373 1 1 7 ARG CA C 1.596 3.468 -0.346 1.00 . A A . 7 ARG CA 1 1
11 2374 1 1 7 ARG CB C 2.912 3.880 -0.998 1.00 . A A . 7 ARG CB 1 1
11 2375 1 1 7 ARG CD C 5.208 4.841 -0.688 1.00 . A A . 7 ARG CD 1 1
11 2376 1 1 7 ARG CG C 3.894 4.486 -0.021 1.00 . A A . 7 ARG CG 1 1
11 2377 1 1 7 ARG CZ C 7.397 5.805 -0.050 1.00 . A A . 7 ARG CZ 1 1
11 2378 1 1 7 ARG H H 2.729 2.129 0.849 1.00 . A A . 7 ARG H 1 1
11 2379 1 1 7 ARG HA H 1.118 4.345 0.065 1.00 . A A . 7 ARG HA 1 1
11 2380 1 1 7 ARG HB2 H 3.369 3.010 -1.446 1.00 . A A . 7 ARG HB2 1 1
11 2381 1 1 7 ARG HB3 H 2.708 4.608 -1.769 1.00 . A A . 7 ARG HB3 1 1
11 2382 1 1 7 ARG HD2 H 5.613 3.955 -1.152 1.00 . A A . 7 ARG HD2 1 1
11 2383 1 1 7 ARG HD3 H 5.022 5.591 -1.443 1.00 . A A . 7 ARG HD3 1 1
11 2384 1 1 7 ARG HE H 5.906 5.375 1.220 1.00 . A A . 7 ARG HE 1 1
11 2385 1 1 7 ARG HG2 H 3.463 5.379 0.406 1.00 . A A . 7 ARG HG2 1 1
11 2386 1 1 7 ARG HG3 H 4.077 3.760 0.758 1.00 . A A . 7 ARG HG3 1 1
11 2387 1 1 7 ARG HH11 H 7.195 5.458 -2.036 1.00 . A A . 7 ARG HH11 1 1
11 2388 1 1 7 ARG HH12 H 8.713 6.127 -1.554 1.00 . A A . 7 ARG HH12 1 1
11 2389 1 1 7 ARG HH21 H 7.923 6.264 1.855 1.00 . A A . 7 ARG HH21 1 1
11 2390 1 1 7 ARG HH22 H 9.133 6.580 0.657 1.00 . A A . 7 ARG HH22 1 1
11 2391 1 1 7 ARG N N 1.841 2.539 0.753 1.00 . A A . 7 ARG N 1 1
11 2392 1 1 7 ARG NE N 6.180 5.362 0.273 1.00 . A A . 7 ARG NE 1 1
11 2393 1 1 7 ARG NH1 N 7.798 5.796 -1.313 1.00 . A A . 7 ARG NH1 1 1
11 2394 1 1 7 ARG NH2 N 8.213 6.253 0.893 1.00 . A A . 7 ARG NH2 1 1
11 2395 1 1 7 ARG O O -0.265 3.486 -1.858 1.00 . A A . 7 ARG O 1 1
11 2396 1 1 8 ALA C C -1.349 0.791 -2.137 1.00 . A A . 8 ALA C 1 1
11 2397 1 1 8 ALA CA C 0.090 0.844 -2.630 1.00 . A A . 8 ALA CA 1 1
11 2398 1 1 8 ALA CB C 0.633 -0.562 -2.836 1.00 . A A . 8 ALA CB 1 1
11 2399 1 1 8 ALA H H 1.703 1.138 -1.281 1.00 . A A . 8 ALA H 1 1
11 2400 1 1 8 ALA HA H 0.118 1.365 -3.577 1.00 . A A . 8 ALA HA 1 1
11 2401 1 1 8 ALA HB1 H 0.025 -1.082 -3.562 1.00 . A A . 8 ALA HB1 1 1
11 2402 1 1 8 ALA HB2 H 0.608 -1.098 -1.898 1.00 . A A . 8 ALA HB2 1 1
11 2403 1 1 8 ALA HB3 H 1.651 -0.508 -3.191 1.00 . A A . 8 ALA HB3 1 1
11 2404 1 1 8 ALA N N 0.923 1.582 -1.689 1.00 . A A . 8 ALA N 1 1
11 2405 1 1 8 ALA O O -2.293 0.950 -2.917 1.00 . A A . 8 ALA O 1 1
11 2406 1 1 9 ALA C C -3.518 1.883 -0.327 1.00 . A A . 9 ALA C 1 1
11 2407 1 1 9 ALA CA C -2.818 0.538 -0.207 1.00 . A A . 9 ALA CA 1 1
11 2408 1 1 9 ALA CB C -2.696 0.139 1.256 1.00 . A A . 9 ALA CB 1 1
11 2409 1 1 9 ALA H H -0.709 0.434 -0.275 1.00 . A A . 9 ALA H 1 1
11 2410 1 1 9 ALA HA H -3.407 -0.211 -0.716 1.00 . A A . 9 ALA HA 1 1
11 2411 1 1 9 ALA HB1 H -3.680 0.077 1.696 1.00 . A A . 9 ALA HB1 1 1
11 2412 1 1 9 ALA HB2 H -2.111 0.877 1.783 1.00 . A A . 9 ALA HB2 1 1
11 2413 1 1 9 ALA HB3 H -2.209 -0.823 1.326 1.00 . A A . 9 ALA HB3 1 1
11 2414 1 1 9 ALA N N -1.507 0.581 -0.832 1.00 . A A . 9 ALA N 1 1
11 2415 1 1 9 ALA O O -4.722 1.945 -0.538 1.00 . A A . 9 ALA O 1 1
11 2416 1 1 10 ARG C C -3.816 4.550 -1.720 1.00 . A A . 10 ARG C 1 1
11 2417 1 1 10 ARG CA C -3.295 4.300 -0.309 1.00 . A A . 10 ARG CA 1 1
11 2418 1 1 10 ARG CB C -2.227 5.329 0.053 1.00 . A A . 10 ARG CB 1 1
11 2419 1 1 10 ARG CD C -1.680 7.726 0.541 1.00 . A A . 10 ARG CD 1 1
11 2420 1 1 10 ARG CG C -2.710 6.761 -0.019 1.00 . A A . 10 ARG CG 1 1
11 2421 1 1 10 ARG CZ C 0.710 8.288 0.223 1.00 . A A . 10 ARG CZ 1 1
11 2422 1 1 10 ARG H H -1.798 2.849 -0.015 1.00 . A A . 10 ARG H 1 1
11 2423 1 1 10 ARG HA H -4.116 4.387 0.386 1.00 . A A . 10 ARG HA 1 1
11 2424 1 1 10 ARG HB2 H -1.886 5.139 1.058 1.00 . A A . 10 ARG HB2 1 1
11 2425 1 1 10 ARG HB3 H -1.394 5.219 -0.626 1.00 . A A . 10 ARG HB3 1 1
11 2426 1 1 10 ARG HD2 H -2.058 8.732 0.434 1.00 . A A . 10 ARG HD2 1 1
11 2427 1 1 10 ARG HD3 H -1.534 7.508 1.588 1.00 . A A . 10 ARG HD3 1 1
11 2428 1 1 10 ARG HE H -0.348 7.044 -0.939 1.00 . A A . 10 ARG HE 1 1
11 2429 1 1 10 ARG HG2 H -2.909 7.015 -1.049 1.00 . A A . 10 ARG HG2 1 1
11 2430 1 1 10 ARG HG3 H -3.618 6.835 0.558 1.00 . A A . 10 ARG HG3 1 1
11 2431 1 1 10 ARG HH11 H -0.153 9.189 1.826 1.00 . A A . 10 ARG HH11 1 1
11 2432 1 1 10 ARG HH12 H 1.513 9.570 1.578 1.00 . A A . 10 ARG HH12 1 1
11 2433 1 1 10 ARG HH21 H 1.860 7.548 -1.279 1.00 . A A . 10 ARG HH21 1 1
11 2434 1 1 10 ARG HH22 H 2.663 8.645 -0.206 1.00 . A A . 10 ARG HH22 1 1
11 2435 1 1 10 ARG N N -2.754 2.959 -0.197 1.00 . A A . 10 ARG N 1 1
11 2436 1 1 10 ARG NE N -0.391 7.631 -0.149 1.00 . A A . 10 ARG NE 1 1
11 2437 1 1 10 ARG NH1 N 0.688 9.078 1.291 1.00 . A A . 10 ARG NH1 1 1
11 2438 1 1 10 ARG NH2 N 1.832 8.149 -0.472 1.00 . A A . 10 ARG NH2 1 1
11 2439 1 1 10 ARG O O -4.887 5.125 -1.905 1.00 . A A . 10 ARG O 1 1
11 2440 1 1 11 ALA C C -4.674 3.405 -4.410 1.00 . A A . 11 ALA C 1 1
11 2441 1 1 11 ALA CA C -3.451 4.262 -4.096 1.00 . A A . 11 ALA CA 1 1
11 2442 1 1 11 ALA CB C -2.296 3.903 -5.016 1.00 . A A . 11 ALA CB 1 1
11 2443 1 1 11 ALA H H -2.199 3.677 -2.495 1.00 . A A . 11 ALA H 1 1
11 2444 1 1 11 ALA HA H -3.703 5.300 -4.257 1.00 . A A . 11 ALA HA 1 1
11 2445 1 1 11 ALA HB1 H -2.027 2.867 -4.867 1.00 . A A . 11 ALA HB1 1 1
11 2446 1 1 11 ALA HB2 H -1.447 4.531 -4.790 1.00 . A A . 11 ALA HB2 1 1
11 2447 1 1 11 ALA HB3 H -2.593 4.054 -6.043 1.00 . A A . 11 ALA HB3 1 1
11 2448 1 1 11 ALA N N -3.055 4.111 -2.707 1.00 . A A . 11 ALA N 1 1
11 2449 1 1 11 ALA O O -5.609 3.860 -5.069 1.00 . A A . 11 ALA O 1 1
11 2450 1 1 12 ALA C C -7.029 1.626 -3.409 1.00 . A A . 12 ALA C 1 1
11 2451 1 1 12 ALA CA C -5.760 1.226 -4.162 1.00 . A A . 12 ALA CA 1 1
11 2452 1 1 12 ALA CB C -5.336 -0.183 -3.778 1.00 . A A . 12 ALA CB 1 1
11 2453 1 1 12 ALA H H -3.896 1.875 -3.384 1.00 . A A . 12 ALA H 1 1
11 2454 1 1 12 ALA HA H -5.972 1.234 -5.221 1.00 . A A . 12 ALA HA 1 1
11 2455 1 1 12 ALA HB1 H -4.438 -0.448 -4.315 1.00 . A A . 12 ALA HB1 1 1
11 2456 1 1 12 ALA HB2 H -6.124 -0.878 -4.029 1.00 . A A . 12 ALA HB2 1 1
11 2457 1 1 12 ALA HB3 H -5.145 -0.224 -2.716 1.00 . A A . 12 ALA HB3 1 1
11 2458 1 1 12 ALA N N -4.666 2.167 -3.920 1.00 . A A . 12 ALA N 1 1
11 2459 1 1 12 ALA O O -8.143 1.420 -3.895 1.00 . A A . 12 ALA O 1 1
11 2460 1 1 13 DAL C C -8.257 1.669 -0.267 1.00 . A A . 13 DAL C 1 1
11 2461 1 1 13 DAL CA C -7.992 2.629 -1.424 1.00 . A A . 13 DAL CA 1 1
11 2462 1 1 13 DAL CB C -7.747 4.033 -0.900 1.00 . A A . 13 DAL CB 1 1
11 2463 1 1 13 DAL H H -5.950 2.301 -1.876 1.00 . A A . 13 DAL H 1 1
11 2464 1 1 13 DAL HA H -8.861 2.654 -2.064 1.00 . A A . 13 DAL HA 1 1
11 2465 1 1 13 DAL HB1 H -8.611 4.364 -0.345 1.00 . A A . 13 DAL HB1 1 1
11 2466 1 1 13 DAL HB2 H -7.573 4.702 -1.730 1.00 . A A . 13 DAL HB2 1 1
11 2467 1 1 13 DAL HB3 H -6.882 4.030 -0.253 1.00 . A A . 13 DAL HB3 1 1
11 2468 1 1 13 DAL N N -6.860 2.187 -2.227 1.00 . A A . 13 DAL N 1 1
11 2469 1 1 13 DAL O O -9.406 1.322 0.016 1.00 . A A . 13 DAL O 1 1
11 2470 1 1 14 CYS C C -6.760 0.995 2.787 1.00 . A A . 14 CYS C 1 1
11 2471 1 1 14 CYS CA C -7.296 0.334 1.519 1.00 . A A . 14 CYS CA 1 1
11 2472 1 1 14 CYS CB C -6.534 -0.961 1.231 1.00 . A A . 14 CYS CB 1 1
11 2473 1 1 14 CYS H H -6.301 1.531 0.095 1.00 . A A . 14 CYS H 1 1
11 2474 1 1 14 CYS HA H -8.340 0.101 1.664 1.00 . A A . 14 CYS HA 1 1
11 2475 1 1 14 CYS HB2 H -5.607 -0.951 1.785 1.00 . A A . 14 CYS HB2 1 1
11 2476 1 1 14 CYS HB3 H -7.131 -1.797 1.563 1.00 . A A . 14 CYS HB3 1 1
11 2477 1 1 14 CYS N N -7.193 1.238 0.386 1.00 . A A . 14 CYS N 1 1
11 2478 1 1 14 CYS O O -5.553 0.967 3.057 1.00 . A A . 14 CYS O 1 1
11 2479 1 1 14 CYS SG S -6.147 -1.202 -0.516 1.00 . A A . 14 CYS SG 1 1
11 2480 1 1 15 NH2 HN1 H -7.318 2.240 4.224 1.00 . A A . 15 NH2 HN1 1 1
11 2481 1 1 15 NH2 HN2 H -8.595 1.498 3.332 1.00 . A A . 15 NH2 HN2 1 1
11 2482 1 1 15 NH2 N N -7.645 1.600 3.556 1.00 . A A . 15 NH2 N 1 1
11 2483 2 2 1 . CB1 C -1.201 -2.751 5.420 1.00 . B A . 101 B0I CB1 1 1
11 2484 2 2 1 . CB2 C -5.653 -2.936 -0.529 1.00 . B A . 101 B0I CB2 1 1
11 2485 2 2 1 . CD1 C -1.665 -3.270 3.041 1.00 . B A . 101 B0I CD1 1 1
11 2486 2 2 1 . CD2 C -0.387 -4.833 4.284 1.00 . B A . 101 B0I CD2 1 1
11 2487 2 2 1 . CD3 C -3.541 -3.512 0.688 1.00 . B A . 101 B0I CD3 1 1
11 2488 2 2 1 . CD4 C -3.389 -2.893 -1.608 1.00 . B A . 101 B0I CD4 1 1
11 2489 2 2 1 . CE1 C -1.570 -4.071 1.920 1.00 . B A . 101 B0I CE1 1 1
11 2490 2 2 1 . CE2 C -0.282 -5.645 3.172 1.00 . B A . 101 B0I CE2 1 1
11 2491 2 2 1 . CE3 C -2.172 -3.680 0.738 1.00 . B A . 101 B0I CE3 1 1
11 2492 2 2 1 . CE4 C -2.017 -3.059 -1.566 1.00 . B A . 101 B0I CE4 1 1
11 2493 2 2 1 . CG1 C -1.082 -3.636 4.222 1.00 . B A . 101 B0I CG1 1 1
11 2494 2 2 1 . CG2 C -4.165 -3.118 -0.483 1.00 . B A . 101 B0I CG2 1 1
11 2495 2 2 1 . CZ1 C -0.876 -5.264 1.985 1.00 . B A . 101 B0I CZ1 1 1
11 2496 2 2 1 . CZ2 C -1.407 -3.453 -0.391 1.00 . B A . 101 B0I CZ2 1 1
11 2497 2 2 1 . H1 H -0.862 -3.304 6.274 1.00 . B A . 101 B0I H1 1 1
11 2498 2 2 1 . H2 H -6.084 -3.429 0.330 1.00 . B A . 101 B0I H2 1 1
11 2499 2 2 1 . HB11 H -2.243 -2.493 5.547 1.00 . B A . 101 B0I HB11 1 1
11 2500 2 2 1 . HB21 H -6.023 -3.396 -1.433 1.00 . B A . 101 B0I HB21 1 1
11 2501 2 2 1 . HD1 H -2.204 -2.338 3.007 1.00 . B A . 101 B0I HD1 1 1
11 2502 2 2 1 . HD2 H 0.077 -5.131 5.213 1.00 . B A . 101 B0I HD2 1 1
11 2503 2 2 1 . HD3 H -4.137 -3.690 1.570 1.00 . B A . 101 B0I HD3 1 1
11 2504 2 2 1 . HD4 H -3.865 -2.584 -2.526 1.00 . B A . 101 B0I HD4 1 1
11 2505 2 2 1 . HE2 H 0.263 -6.576 3.230 1.00 . B A . 101 B0I HE2 1 1
11 2506 2 2 1 . HE4 H -1.422 -2.881 -2.450 1.00 . B A . 101 B0I HE4 1 1
11 2507 2 2 1 . HZ1 H -0.798 -5.894 1.112 1.00 . B A . 101 B0I HZ1 1 1
11 2508 2 2 1 . HZ2 H -0.335 -3.584 -0.354 1.00 . B A . 101 B0I HZ2 1 1
12 2509 1 1 1 . C C 3.575 -6.530 0.609 1.00 . A A . 1 H00 C 1 1
12 2510 1 1 1 . CA C 2.547 -7.398 -0.086 1.00 . A A . 1 H00 CA 1 1
12 2511 1 1 1 . CB C 1.199 -7.271 0.605 1.00 . A A . 1 H00 CB 1 1
12 2512 1 1 1 . CG C 0.612 -5.879 0.424 1.00 . A A . 1 H00 CG 1 1
12 2513 1 1 1 . HA1 H 2.867 -8.430 -0.050 1.00 . A A . 1 H00 HA1 1 1
12 2514 1 1 1 . HA2 H 2.453 -7.084 -1.115 1.00 . A A . 1 H00 HA2 1 1
12 2515 1 1 1 . HB1 H 1.328 -7.465 1.661 1.00 . A A . 1 H00 HB1 1 1
12 2516 1 1 1 . HB2 H 0.519 -7.996 0.184 1.00 . A A . 1 H00 HB2 1 1
12 2517 1 1 1 . HG1 H 0.857 -5.526 -0.568 1.00 . A A . 1 H00 HG1 1 1
12 2518 1 1 1 . HG2 H 1.054 -5.219 1.158 1.00 . A A . 1 H00 HG2 1 1
12 2519 1 1 1 . O O 3.954 -6.797 1.755 1.00 . A A . 1 H00 O 1 1
12 2520 1 1 1 . SD S -1.181 -5.844 0.625 1.00 . A A . 1 H00 SD 1 1
12 2521 1 1 2 THR C C 4.290 -3.491 1.295 1.00 . A A . 2 THR C 1 1
12 2522 1 1 2 THR CA C 5.001 -4.587 0.497 1.00 . A A . 2 THR CA 1 1
12 2523 1 1 2 THR CB C 5.880 -3.945 -0.597 1.00 . A A . 2 THR CB 1 1
12 2524 1 1 2 THR CG2 C 6.741 -4.994 -1.276 1.00 . A A . 2 THR CG2 1 1
12 2525 1 1 2 THR H H 3.713 -5.352 -0.992 1.00 . A A . 2 THR H 1 1
12 2526 1 1 2 THR HA H 5.636 -5.151 1.164 1.00 . A A . 2 THR HA 1 1
12 2527 1 1 2 THR HB H 6.524 -3.211 -0.138 1.00 . A A . 2 THR HB 1 1
12 2528 1 1 2 THR HG1 H 4.611 -3.985 -2.100 1.00 . A A . 2 THR HG1 1 1
12 2529 1 1 2 THR HG21 H 7.344 -4.526 -2.040 1.00 . A A . 2 THR HG21 1 1
12 2530 1 1 2 THR HG22 H 6.106 -5.743 -1.726 1.00 . A A . 2 THR HG22 1 1
12 2531 1 1 2 THR HG23 H 7.383 -5.460 -0.545 1.00 . A A . 2 THR HG23 1 1
12 2532 1 1 2 THR N N 4.034 -5.502 -0.075 1.00 . A A . 2 THR N 1 1
12 2533 1 1 2 THR O O 3.108 -3.218 1.059 1.00 . A A . 2 THR O 1 1
12 2534 1 1 2 THR OG1 O 5.058 -3.306 -1.573 1.00 . A A . 2 THR OG1 1 1
12 2535 1 1 3 PRO C C 3.756 -0.678 2.272 1.00 . A A . 3 PRO C 1 1
12 2536 1 1 3 PRO CA C 4.421 -1.790 3.094 1.00 . A A . 3 PRO CA 1 1
12 2537 1 1 3 PRO CB C 5.634 -1.243 3.847 1.00 . A A . 3 PRO CB 1 1
12 2538 1 1 3 PRO CD C 6.399 -3.142 2.623 1.00 . A A . 3 PRO CD 1 1
12 2539 1 1 3 PRO CG C 6.578 -2.391 3.910 1.00 . A A . 3 PRO CG 1 1
12 2540 1 1 3 PRO HA H 3.706 -2.188 3.798 1.00 . A A . 3 PRO HA 1 1
12 2541 1 1 3 PRO HB2 H 6.054 -0.412 3.300 1.00 . A A . 3 PRO HB2 1 1
12 2542 1 1 3 PRO HB3 H 5.336 -0.924 4.834 1.00 . A A . 3 PRO HB3 1 1
12 2543 1 1 3 PRO HD2 H 7.081 -2.769 1.872 1.00 . A A . 3 PRO HD2 1 1
12 2544 1 1 3 PRO HD3 H 6.549 -4.199 2.780 1.00 . A A . 3 PRO HD3 1 1
12 2545 1 1 3 PRO HG2 H 7.593 -2.029 3.997 1.00 . A A . 3 PRO HG2 1 1
12 2546 1 1 3 PRO HG3 H 6.331 -3.025 4.750 1.00 . A A . 3 PRO HG3 1 1
12 2547 1 1 3 PRO N N 4.994 -2.855 2.256 1.00 . A A . 3 PRO N 1 1
12 2548 1 1 3 PRO O O 2.704 -0.161 2.655 1.00 . A A . 3 PRO O 1 1
12 2549 1 1 4 ARG C C 2.546 0.263 -0.395 1.00 . A A . 4 ARG C 1 1
12 2550 1 1 4 ARG CA C 3.822 0.727 0.277 1.00 . A A . 4 ARG CA 1 1
12 2551 1 1 4 ARG CB C 4.833 1.142 -0.777 1.00 . A A . 4 ARG CB 1 1
12 2552 1 1 4 ARG CD C 7.001 2.268 -1.282 1.00 . A A . 4 ARG CD 1 1
12 2553 1 1 4 ARG CG C 6.132 1.649 -0.203 1.00 . A A . 4 ARG CG 1 1
12 2554 1 1 4 ARG CZ C 6.694 3.881 -3.141 1.00 . A A . 4 ARG CZ 1 1
12 2555 1 1 4 ARG H H 5.197 -0.777 0.884 1.00 . A A . 4 ARG H 1 1
12 2556 1 1 4 ARG HA H 3.593 1.579 0.899 1.00 . A A . 4 ARG HA 1 1
12 2557 1 1 4 ARG HB2 H 5.051 0.292 -1.406 1.00 . A A . 4 ARG HB2 1 1
12 2558 1 1 4 ARG HB3 H 4.403 1.926 -1.381 1.00 . A A . 4 ARG HB3 1 1
12 2559 1 1 4 ARG HD2 H 7.891 2.676 -0.824 1.00 . A A . 4 ARG HD2 1 1
12 2560 1 1 4 ARG HD3 H 7.277 1.502 -1.991 1.00 . A A . 4 ARG HD3 1 1
12 2561 1 1 4 ARG HE H 5.457 3.659 -1.578 1.00 . A A . 4 ARG HE 1 1
12 2562 1 1 4 ARG HG2 H 5.922 2.387 0.558 1.00 . A A . 4 ARG HG2 1 1
12 2563 1 1 4 ARG HG3 H 6.647 0.806 0.233 1.00 . A A . 4 ARG HG3 1 1
12 2564 1 1 4 ARG HH11 H 8.413 2.809 -3.260 1.00 . A A . 4 ARG HH11 1 1
12 2565 1 1 4 ARG HH12 H 8.142 3.914 -4.564 1.00 . A A . 4 ARG HH12 1 1
12 2566 1 1 4 ARG HH21 H 5.086 5.102 -3.308 1.00 . A A . 4 ARG HH21 1 1
12 2567 1 1 4 ARG HH22 H 6.235 5.224 -4.593 1.00 . A A . 4 ARG HH22 1 1
12 2568 1 1 4 ARG N N 4.366 -0.322 1.141 1.00 . A A . 4 ARG N 1 1
12 2569 1 1 4 ARG NE N 6.295 3.339 -1.989 1.00 . A A . 4 ARG NE 1 1
12 2570 1 1 4 ARG NH1 N 7.839 3.504 -3.699 1.00 . A A . 4 ARG NH1 1 1
12 2571 1 1 4 ARG NH2 N 5.950 4.809 -3.726 1.00 . A A . 4 ARG NH2 1 1
12 2572 1 1 4 ARG O O 1.555 1.000 -0.453 1.00 . A A . 4 ARG O 1 1
12 2573 1 1 5 GLN C C 0.251 -1.655 -0.549 1.00 . A A . 5 GLN C 1 1
12 2574 1 1 5 GLN CA C 1.397 -1.555 -1.539 1.00 . A A . 5 GLN CA 1 1
12 2575 1 1 5 GLN CB C 1.724 -2.933 -2.099 1.00 . A A . 5 GLN CB 1 1
12 2576 1 1 5 GLN CD C 3.044 -4.273 -3.762 1.00 . A A . 5 GLN CD 1 1
12 2577 1 1 5 GLN CG C 2.531 -2.903 -3.384 1.00 . A A . 5 GLN CG 1 1
12 2578 1 1 5 GLN H H 3.413 -1.468 -0.854 1.00 . A A . 5 GLN H 1 1
12 2579 1 1 5 GLN HA H 1.095 -0.907 -2.351 1.00 . A A . 5 GLN HA 1 1
12 2580 1 1 5 GLN HB2 H 2.290 -3.481 -1.361 1.00 . A A . 5 GLN HB2 1 1
12 2581 1 1 5 GLN HB3 H 0.798 -3.455 -2.294 1.00 . A A . 5 GLN HB3 1 1
12 2582 1 1 5 GLN HE21 H 2.910 -3.822 -5.686 1.00 . A A . 5 GLN HE21 1 1
12 2583 1 1 5 GLN HE22 H 3.488 -5.414 -5.312 1.00 . A A . 5 GLN HE22 1 1
12 2584 1 1 5 GLN HG2 H 1.904 -2.534 -4.182 1.00 . A A . 5 GLN HG2 1 1
12 2585 1 1 5 GLN HG3 H 3.373 -2.241 -3.251 1.00 . A A . 5 GLN HG3 1 1
12 2586 1 1 5 GLN N N 2.574 -0.958 -0.904 1.00 . A A . 5 GLN N 1 1
12 2587 1 1 5 GLN NE2 N 3.159 -4.527 -5.047 1.00 . A A . 5 GLN NE2 1 1
12 2588 1 1 5 GLN O O -0.904 -1.432 -0.900 1.00 . A A . 5 GLN O 1 1
12 2589 1 1 5 GLN OE1 O 3.334 -5.098 -2.891 1.00 . A A . 5 GLN OE1 1 1
12 2590 1 1 6 ALA C C -1.084 -0.711 1.938 1.00 . A A . 6 ALA C 1 1
12 2591 1 1 6 ALA CA C -0.413 -2.064 1.752 1.00 . A A . 6 ALA CA 1 1
12 2592 1 1 6 ALA CB C 0.228 -2.526 3.053 1.00 . A A . 6 ALA CB 1 1
12 2593 1 1 6 ALA H H 1.520 -2.193 0.903 1.00 . A A . 6 ALA H 1 1
12 2594 1 1 6 ALA HA H -1.158 -2.790 1.458 1.00 . A A . 6 ALA HA 1 1
12 2595 1 1 6 ALA HB1 H -0.530 -2.607 3.818 1.00 . A A . 6 ALA HB1 1 1
12 2596 1 1 6 ALA HB2 H 0.975 -1.809 3.359 1.00 . A A . 6 ALA HB2 1 1
12 2597 1 1 6 ALA HB3 H 0.693 -3.489 2.903 1.00 . A A . 6 ALA HB3 1 1
12 2598 1 1 6 ALA N N 0.581 -1.986 0.696 1.00 . A A . 6 ALA N 1 1
12 2599 1 1 6 ALA O O -2.301 -0.625 2.061 1.00 . A A . 6 ALA O 1 1
12 2600 1 1 7 ARG C C -1.754 2.019 0.925 1.00 . A A . 7 ARG C 1 1
12 2601 1 1 7 ARG CA C -0.790 1.717 2.055 1.00 . A A . 7 ARG CA 1 1
12 2602 1 1 7 ARG CB C 0.353 2.732 2.004 1.00 . A A . 7 ARG CB 1 1
12 2603 1 1 7 ARG CD C 2.433 3.672 3.003 1.00 . A A . 7 ARG CD 1 1
12 2604 1 1 7 ARG CG C 1.377 2.584 3.097 1.00 . A A . 7 ARG CG 1 1
12 2605 1 1 7 ARG CZ C 4.353 4.513 4.317 1.00 . A A . 7 ARG CZ 1 1
12 2606 1 1 7 ARG H H 0.690 0.211 1.823 1.00 . A A . 7 ARG H 1 1
12 2607 1 1 7 ARG HA H -1.302 1.803 3.001 1.00 . A A . 7 ARG HA 1 1
12 2608 1 1 7 ARG HB2 H 0.861 2.624 1.058 1.00 . A A . 7 ARG HB2 1 1
12 2609 1 1 7 ARG HB3 H -0.063 3.727 2.060 1.00 . A A . 7 ARG HB3 1 1
12 2610 1 1 7 ARG HD2 H 2.975 3.551 2.077 1.00 . A A . 7 ARG HD2 1 1
12 2611 1 1 7 ARG HD3 H 1.942 4.633 3.006 1.00 . A A . 7 ARG HD3 1 1
12 2612 1 1 7 ARG HE H 3.272 2.881 4.753 1.00 . A A . 7 ARG HE 1 1
12 2613 1 1 7 ARG HG2 H 0.889 2.638 4.058 1.00 . A A . 7 ARG HG2 1 1
12 2614 1 1 7 ARG HG3 H 1.852 1.621 2.983 1.00 . A A . 7 ARG HG3 1 1
12 2615 1 1 7 ARG HH11 H 3.928 5.624 2.670 1.00 . A A . 7 ARG HH11 1 1
12 2616 1 1 7 ARG HH12 H 5.254 6.194 3.615 1.00 . A A . 7 ARG HH12 1 1
12 2617 1 1 7 ARG HH21 H 5.026 3.631 6.012 1.00 . A A . 7 ARG HH21 1 1
12 2618 1 1 7 ARG HH22 H 5.884 5.054 5.536 1.00 . A A . 7 ARG HH22 1 1
12 2619 1 1 7 ARG N N -0.277 0.352 1.925 1.00 . A A . 7 ARG N 1 1
12 2620 1 1 7 ARG NE N 3.380 3.621 4.114 1.00 . A A . 7 ARG NE 1 1
12 2621 1 1 7 ARG NH1 N 4.525 5.521 3.469 1.00 . A A . 7 ARG NH1 1 1
12 2622 1 1 7 ARG NH2 N 5.150 4.391 5.368 1.00 . A A . 7 ARG NH2 1 1
12 2623 1 1 7 ARG O O -2.854 2.528 1.143 1.00 . A A . 7 ARG O 1 1
12 2624 1 1 8 ALA C C -3.443 1.156 -1.414 1.00 . A A . 8 ALA C 1 1
12 2625 1 1 8 ALA CA C -2.130 1.924 -1.475 1.00 . A A . 8 ALA CA 1 1
12 2626 1 1 8 ALA CB C -1.344 1.544 -2.720 1.00 . A A . 8 ALA CB 1 1
12 2627 1 1 8 ALA H H -0.446 1.266 -0.370 1.00 . A A . 8 ALA H 1 1
12 2628 1 1 8 ALA HA H -2.349 2.981 -1.524 1.00 . A A . 8 ALA HA 1 1
12 2629 1 1 8 ALA HB1 H -0.414 2.092 -2.740 1.00 . A A . 8 ALA HB1 1 1
12 2630 1 1 8 ALA HB2 H -1.924 1.786 -3.598 1.00 . A A . 8 ALA HB2 1 1
12 2631 1 1 8 ALA HB3 H -1.138 0.484 -2.705 1.00 . A A . 8 ALA HB3 1 1
12 2632 1 1 8 ALA N N -1.331 1.688 -0.284 1.00 . A A . 8 ALA N 1 1
12 2633 1 1 8 ALA O O -4.502 1.697 -1.724 1.00 . A A . 8 ALA O 1 1
12 2634 1 1 9 ALA C C -5.541 -0.364 0.115 1.00 . A A . 9 ALA C 1 1
12 2635 1 1 9 ALA CA C -4.542 -0.948 -0.875 1.00 . A A . 9 ALA CA 1 1
12 2636 1 1 9 ALA CB C -4.137 -2.347 -0.449 1.00 . A A . 9 ALA CB 1 1
12 2637 1 1 9 ALA H H -2.486 -0.472 -0.763 1.00 . A A . 9 ALA H 1 1
12 2638 1 1 9 ALA HA H -5.008 -1.011 -1.848 1.00 . A A . 9 ALA HA 1 1
12 2639 1 1 9 ALA HB1 H -3.683 -2.307 0.531 1.00 . A A . 9 ALA HB1 1 1
12 2640 1 1 9 ALA HB2 H -3.427 -2.746 -1.158 1.00 . A A . 9 ALA HB2 1 1
12 2641 1 1 9 ALA HB3 H -5.010 -2.981 -0.416 1.00 . A A . 9 ALA HB3 1 1
12 2642 1 1 9 ALA N N -3.366 -0.099 -0.993 1.00 . A A . 9 ALA N 1 1
12 2643 1 1 9 ALA O O -6.741 -0.319 -0.152 1.00 . A A . 9 ALA O 1 1
12 2644 1 1 10 ARG C C -6.527 1.968 1.785 1.00 . A A . 10 ARG C 1 1
12 2645 1 1 10 ARG CA C -5.878 0.684 2.285 1.00 . A A . 10 ARG CA 1 1
12 2646 1 1 10 ARG CB C -5.057 0.959 3.542 1.00 . A A . 10 ARG CB 1 1
12 2647 1 1 10 ARG CD C -3.463 0.049 5.250 1.00 . A A . 10 ARG CD 1 1
12 2648 1 1 10 ARG CG C -4.441 -0.288 4.143 1.00 . A A . 10 ARG CG 1 1
12 2649 1 1 10 ARG CZ C -1.642 -1.079 6.489 1.00 . A A . 10 ARG CZ 1 1
12 2650 1 1 10 ARG H H -4.065 0.035 1.396 1.00 . A A . 10 ARG H 1 1
12 2651 1 1 10 ARG HA H -6.654 -0.028 2.522 1.00 . A A . 10 ARG HA 1 1
12 2652 1 1 10 ARG HB2 H -4.260 1.646 3.294 1.00 . A A . 10 ARG HB2 1 1
12 2653 1 1 10 ARG HB3 H -5.695 1.415 4.283 1.00 . A A . 10 ARG HB3 1 1
12 2654 1 1 10 ARG HD2 H -2.789 0.817 4.899 1.00 . A A . 10 ARG HD2 1 1
12 2655 1 1 10 ARG HD3 H -4.015 0.414 6.104 1.00 . A A . 10 ARG HD3 1 1
12 2656 1 1 10 ARG HE H -2.952 -1.986 5.264 1.00 . A A . 10 ARG HE 1 1
12 2657 1 1 10 ARG HG2 H -5.228 -0.907 4.548 1.00 . A A . 10 ARG HG2 1 1
12 2658 1 1 10 ARG HG3 H -3.921 -0.827 3.365 1.00 . A A . 10 ARG HG3 1 1
12 2659 1 1 10 ARG HH11 H -1.771 0.920 6.822 1.00 . A A . 10 ARG HH11 1 1
12 2660 1 1 10 ARG HH12 H -0.497 0.119 7.670 1.00 . A A . 10 ARG HH12 1 1
12 2661 1 1 10 ARG HH21 H -1.249 -3.072 6.381 1.00 . A A . 10 ARG HH21 1 1
12 2662 1 1 10 ARG HH22 H -0.194 -2.173 7.411 1.00 . A A . 10 ARG HH22 1 1
12 2663 1 1 10 ARG N N -5.036 0.095 1.249 1.00 . A A . 10 ARG N 1 1
12 2664 1 1 10 ARG NE N -2.681 -1.122 5.654 1.00 . A A . 10 ARG NE 1 1
12 2665 1 1 10 ARG NH1 N -1.272 0.076 7.035 1.00 . A A . 10 ARG NH1 1 1
12 2666 1 1 10 ARG NH2 N -0.976 -2.193 6.783 1.00 . A A . 10 ARG NH2 1 1
12 2667 1 1 10 ARG O O -7.691 2.228 2.055 1.00 . A A . 10 ARG O 1 1
12 2668 1 1 11 ALA C C -7.330 3.744 -0.579 1.00 . A A . 11 ALA C 1 1
12 2669 1 1 11 ALA CA C -6.268 4.006 0.491 1.00 . A A . 11 ALA CA 1 1
12 2670 1 1 11 ALA CB C -5.123 4.823 -0.088 1.00 . A A . 11 ALA CB 1 1
12 2671 1 1 11 ALA H H -4.829 2.505 0.887 1.00 . A A . 11 ALA H 1 1
12 2672 1 1 11 ALA HA H -6.715 4.573 1.294 1.00 . A A . 11 ALA HA 1 1
12 2673 1 1 11 ALA HB1 H -4.663 4.276 -0.897 1.00 . A A . 11 ALA HB1 1 1
12 2674 1 1 11 ALA HB2 H -4.389 5.012 0.683 1.00 . A A . 11 ALA HB2 1 1
12 2675 1 1 11 ALA HB3 H -5.505 5.762 -0.460 1.00 . A A . 11 ALA HB3 1 1
12 2676 1 1 11 ALA N N -5.765 2.760 1.051 1.00 . A A . 11 ALA N 1 1
12 2677 1 1 11 ALA O O -8.375 4.403 -0.611 1.00 . A A . 11 ALA O 1 1
12 2678 1 1 12 ALA C C -9.248 1.765 -2.026 1.00 . A A . 12 ALA C 1 1
12 2679 1 1 12 ALA CA C -7.968 2.430 -2.538 1.00 . A A . 12 ALA CA 1 1
12 2680 1 1 12 ALA CB C -7.266 1.537 -3.548 1.00 . A A . 12 ALA CB 1 1
12 2681 1 1 12 ALA H H -6.216 2.274 -1.356 1.00 . A A . 12 ALA H 1 1
12 2682 1 1 12 ALA HA H -8.237 3.350 -3.036 1.00 . A A . 12 ALA HA 1 1
12 2683 1 1 12 ALA HB1 H -6.366 2.022 -3.895 1.00 . A A . 12 ALA HB1 1 1
12 2684 1 1 12 ALA HB2 H -7.923 1.356 -4.386 1.00 . A A . 12 ALA HB2 1 1
12 2685 1 1 12 ALA HB3 H -7.012 0.597 -3.082 1.00 . A A . 12 ALA HB3 1 1
12 2686 1 1 12 ALA N N -7.060 2.772 -1.446 1.00 . A A . 12 ALA N 1 1
12 2687 1 1 12 ALA O O -10.288 1.802 -2.694 1.00 . A A . 12 ALA O 1 1
12 2688 1 1 13 DAL C C -10.282 -0.996 -0.350 1.00 . A A . 13 DAL C 1 1
12 2689 1 1 13 DAL CA C -10.335 0.525 -0.249 1.00 . A A . 13 DAL CA 1 1
12 2690 1 1 13 DAL CB C -10.463 0.954 1.204 1.00 . A A . 13 DAL CB 1 1
12 2691 1 1 13 DAL H H -8.304 1.111 -0.393 1.00 . A A . 13 DAL H 1 1
12 2692 1 1 13 DAL HA H -11.207 0.879 -0.777 1.00 . A A . 13 DAL HA 1 1
12 2693 1 1 13 DAL HB1 H -11.367 0.543 1.624 1.00 . A A . 13 DAL HB1 1 1
12 2694 1 1 13 DAL HB2 H -10.498 2.032 1.258 1.00 . A A . 13 DAL HB2 1 1
12 2695 1 1 13 DAL HB3 H -9.610 0.595 1.761 1.00 . A A . 13 DAL HB3 1 1
12 2696 1 1 13 DAL N N -9.168 1.149 -0.858 1.00 . A A . 13 DAL N 1 1
12 2697 1 1 13 DAL O O -11.236 -1.686 0.026 1.00 . A A . 13 DAL O 1 1
12 2698 1 1 14 CYS C C -8.569 -3.556 0.350 1.00 . A A . 14 CYS C 1 1
12 2699 1 1 14 CYS CA C -9.007 -2.950 -0.984 1.00 . A A . 14 CYS CA 1 1
12 2700 1 1 14 CYS CB C -7.987 -3.261 -2.080 1.00 . A A . 14 CYS CB 1 1
12 2701 1 1 14 CYS H H -8.454 -0.922 -1.145 1.00 . A A . 14 CYS H 1 1
12 2702 1 1 14 CYS HA H -9.961 -3.373 -1.259 1.00 . A A . 14 CYS HA 1 1
12 2703 1 1 14 CYS HB2 H -7.064 -3.582 -1.618 1.00 . A A . 14 CYS HB2 1 1
12 2704 1 1 14 CYS HB3 H -8.367 -4.064 -2.694 1.00 . A A . 14 CYS HB3 1 1
12 2705 1 1 14 CYS N N -9.181 -1.514 -0.854 1.00 . A A . 14 CYS N 1 1
12 2706 1 1 14 CYS O O -9.403 -3.987 1.154 1.00 . A A . 14 CYS O 1 1
12 2707 1 1 14 CYS SG S -7.619 -1.858 -3.152 1.00 . A A . 14 CYS SG 1 1
12 2708 1 1 15 NH2 HN1 H -6.914 -2.874 1.195 1.00 . A A . 15 NH2 HN1 1 1
12 2709 1 1 15 NH2 HN2 H -6.715 -4.227 0.140 1.00 . A A . 15 NH2 HN2 1 1
12 2710 1 1 15 NH2 N N -7.274 -3.566 0.603 1.00 . A A . 15 NH2 N 1 1
12 2711 2 2 1 . CB1 C -1.714 -6.744 -0.848 1.00 . B A . 101 B0I CB1 1 1
12 2712 2 2 1 . CB2 C -6.690 -2.670 -4.468 1.00 . B A . 101 B0I CB2 1 1
12 2713 2 2 1 . CD1 C -2.319 -4.960 -2.463 1.00 . B A . 101 B0I CD1 1 1
12 2714 2 2 1 . CD2 C -0.426 -6.302 -2.955 1.00 . B A . 101 B0I CD2 1 1
12 2715 2 2 1 . CD3 C -4.342 -3.443 -4.048 1.00 . B A . 101 B0I CD3 1 1
12 2716 2 2 1 . CD4 C -4.696 -1.154 -4.613 1.00 . B A . 101 B0I CD4 1 1
12 2717 2 2 1 . CE1 C -2.125 -4.247 -3.630 1.00 . B A . 101 B0I CE1 1 1
12 2718 2 2 1 . CE2 C -0.220 -5.598 -4.124 1.00 . B A . 101 B0I CE2 1 1
12 2719 2 2 1 . CE3 C -2.983 -3.213 -3.960 1.00 . B A . 101 B0I CE3 1 1
12 2720 2 2 1 . CE4 C -3.337 -0.919 -4.527 1.00 . B A . 101 B0I CE4 1 1
12 2721 2 2 1 . CG1 C -1.482 -5.984 -2.115 1.00 . B A . 101 B0I CG1 1 1
12 2722 2 2 1 . CG2 C -5.213 -2.417 -4.376 1.00 . B A . 101 B0I CG2 1 1
12 2723 2 2 1 . CZ1 C -1.072 -4.569 -4.463 1.00 . B A . 101 B0I CZ1 1 1
12 2724 2 2 1 . CZ2 C -2.480 -1.949 -4.200 1.00 . B A . 101 B0I CZ2 1 1
12 2725 2 2 1 . H1 H -1.174 -7.669 -0.914 1.00 . B A . 101 B0I H1 1 1
12 2726 2 2 1 . H2 H -6.858 -3.735 -4.411 1.00 . B A . 101 B0I H2 1 1
12 2727 2 2 1 . HB11 H -2.772 -6.950 -0.768 1.00 . B A . 101 B0I HB11 1 1
12 2728 2 2 1 . HB21 H -7.038 -2.299 -5.420 1.00 . B A . 101 B0I HB21 1 1
12 2729 2 2 1 . HD1 H -3.136 -4.724 -1.802 1.00 . B A . 101 B0I HD1 1 1
12 2730 2 2 1 . HD2 H 0.241 -7.107 -2.687 1.00 . B A . 101 B0I HD2 1 1
12 2731 2 2 1 . HD3 H -4.733 -4.432 -3.862 1.00 . B A . 101 B0I HD3 1 1
12 2732 2 2 1 . HD4 H -5.365 -0.347 -4.870 1.00 . B A . 101 B0I HD4 1 1
12 2733 2 2 1 . HE2 H 0.605 -5.854 -4.772 1.00 . B A . 101 B0I HE2 1 1
12 2734 2 2 1 . HE4 H -2.944 0.069 -4.714 1.00 . B A . 101 B0I HE4 1 1
12 2735 2 2 1 . HZ1 H -0.916 -4.015 -5.376 1.00 . B A . 101 B0I HZ1 1 1
12 2736 2 2 1 . HZ2 H -1.418 -1.768 -4.129 1.00 . B A . 101 B0I HZ2 1 1
13 2737 1 1 1 . C C 4.634 -5.419 5.346 1.00 . A A . 1 H00 C 1 1
13 2738 1 1 1 . CA C 3.428 -6.242 5.758 1.00 . A A . 1 H00 CA 1 1
13 2739 1 1 1 . CB C 2.243 -5.333 6.052 1.00 . A A . 1 H00 CB 1 1
13 2740 1 1 1 . CG C 1.623 -4.789 4.771 1.00 . A A . 1 H00 CG 1 1
13 2741 1 1 1 . HA1 H 3.668 -6.809 6.645 1.00 . A A . 1 H00 HA1 1 1
13 2742 1 1 1 . HA2 H 3.168 -6.918 4.956 1.00 . A A . 1 H00 HA2 1 1
13 2743 1 1 1 . HB1 H 2.580 -4.505 6.658 1.00 . A A . 1 H00 HB1 1 1
13 2744 1 1 1 . HB2 H 1.494 -5.896 6.589 1.00 . A A . 1 H00 HB2 1 1
13 2745 1 1 1 . HG1 H 1.558 -5.592 4.050 1.00 . A A . 1 H00 HG1 1 1
13 2746 1 1 1 . HG2 H 2.260 -4.007 4.383 1.00 . A A . 1 H00 HG2 1 1
13 2747 1 1 1 . O O 5.274 -4.775 6.184 1.00 . A A . 1 H00 O 1 1
13 2748 1 1 1 . SD S -0.031 -4.108 5.030 1.00 . A A . 1 H00 SD 1 1
13 2749 1 1 2 THR C C 5.599 -3.275 3.153 1.00 . A A . 2 THR C 1 1
13 2750 1 1 2 THR CA C 6.060 -4.683 3.539 1.00 . A A . 2 THR CA 1 1
13 2751 1 1 2 THR CB C 6.649 -5.385 2.306 1.00 . A A . 2 THR CB 1 1
13 2752 1 1 2 THR CG2 C 7.388 -6.655 2.705 1.00 . A A . 2 THR CG2 1 1
13 2753 1 1 2 THR H H 4.418 -5.984 3.444 1.00 . A A . 2 THR H 1 1
13 2754 1 1 2 THR HA H 6.821 -4.617 4.301 1.00 . A A . 2 THR HA 1 1
13 2755 1 1 2 THR HB H 7.339 -4.712 1.820 1.00 . A A . 2 THR HB 1 1
13 2756 1 1 2 THR HG1 H 5.967 -6.044 0.576 1.00 . A A . 2 THR HG1 1 1
13 2757 1 1 2 THR HG21 H 8.198 -6.405 3.374 1.00 . A A . 2 THR HG21 1 1
13 2758 1 1 2 THR HG22 H 7.785 -7.133 1.821 1.00 . A A . 2 THR HG22 1 1
13 2759 1 1 2 THR HG23 H 6.705 -7.328 3.202 1.00 . A A . 2 THR HG23 1 1
13 2760 1 1 2 THR N N 4.948 -5.442 4.067 1.00 . A A . 2 THR N 1 1
13 2761 1 1 2 THR O O 4.402 -3.051 2.939 1.00 . A A . 2 THR O 1 1
13 2762 1 1 2 THR OG1 O 5.592 -5.710 1.400 1.00 . A A . 2 THR OG1 1 1
13 2763 1 1 3 PRO C C 5.430 -0.834 1.388 1.00 . A A . 3 PRO C 1 1
13 2764 1 1 3 PRO CA C 6.204 -0.918 2.698 1.00 . A A . 3 PRO CA 1 1
13 2765 1 1 3 PRO CB C 7.571 -0.252 2.552 1.00 . A A . 3 PRO CB 1 1
13 2766 1 1 3 PRO CD C 7.977 -2.462 3.337 1.00 . A A . 3 PRO CD 1 1
13 2767 1 1 3 PRO CG C 8.460 -1.044 3.437 1.00 . A A . 3 PRO CG 1 1
13 2768 1 1 3 PRO HA H 5.641 -0.429 3.478 1.00 . A A . 3 PRO HA 1 1
13 2769 1 1 3 PRO HB2 H 7.889 -0.300 1.520 1.00 . A A . 3 PRO HB2 1 1
13 2770 1 1 3 PRO HB3 H 7.511 0.778 2.872 1.00 . A A . 3 PRO HB3 1 1
13 2771 1 1 3 PRO HD2 H 8.471 -2.974 2.524 1.00 . A A . 3 PRO HD2 1 1
13 2772 1 1 3 PRO HD3 H 8.137 -2.983 4.268 1.00 . A A . 3 PRO HD3 1 1
13 2773 1 1 3 PRO HG2 H 9.481 -0.965 3.096 1.00 . A A . 3 PRO HG2 1 1
13 2774 1 1 3 PRO HG3 H 8.373 -0.690 4.454 1.00 . A A . 3 PRO HG3 1 1
13 2775 1 1 3 PRO N N 6.535 -2.301 3.065 1.00 . A A . 3 PRO N 1 1
13 2776 1 1 3 PRO O O 4.503 -0.043 1.264 1.00 . A A . 3 PRO O 1 1
13 2777 1 1 4 ARG C C 3.661 -2.017 -0.697 1.00 . A A . 4 ARG C 1 1
13 2778 1 1 4 ARG CA C 5.128 -1.679 -0.877 1.00 . A A . 4 ARG CA 1 1
13 2779 1 1 4 ARG CB C 5.766 -2.693 -1.824 1.00 . A A . 4 ARG CB 1 1
13 2780 1 1 4 ARG CD C 7.772 -3.442 -3.113 1.00 . A A . 4 ARG CD 1 1
13 2781 1 1 4 ARG CG C 7.249 -2.487 -2.052 1.00 . A A . 4 ARG CG 1 1
13 2782 1 1 4 ARG CZ C 9.887 -4.002 -4.266 1.00 . A A . 4 ARG CZ 1 1
13 2783 1 1 4 ARG H H 6.548 -2.283 0.581 1.00 . A A . 4 ARG H 1 1
13 2784 1 1 4 ARG HA H 5.211 -0.692 -1.307 1.00 . A A . 4 ARG HA 1 1
13 2785 1 1 4 ARG HB2 H 5.623 -3.681 -1.415 1.00 . A A . 4 ARG HB2 1 1
13 2786 1 1 4 ARG HB3 H 5.266 -2.635 -2.780 1.00 . A A . 4 ARG HB3 1 1
13 2787 1 1 4 ARG HD2 H 7.615 -4.455 -2.777 1.00 . A A . 4 ARG HD2 1 1
13 2788 1 1 4 ARG HD3 H 7.215 -3.279 -4.024 1.00 . A A . 4 ARG HD3 1 1
13 2789 1 1 4 ARG HE H 9.662 -2.541 -2.901 1.00 . A A . 4 ARG HE 1 1
13 2790 1 1 4 ARG HG2 H 7.423 -1.469 -2.367 1.00 . A A . 4 ARG HG2 1 1
13 2791 1 1 4 ARG HG3 H 7.758 -2.677 -1.120 1.00 . A A . 4 ARG HG3 1 1
13 2792 1 1 4 ARG HH11 H 8.291 -5.125 -4.822 1.00 . A A . 4 ARG HH11 1 1
13 2793 1 1 4 ARG HH12 H 9.780 -5.542 -5.589 1.00 . A A . 4 ARG HH12 1 1
13 2794 1 1 4 ARG HH21 H 11.659 -3.055 -3.969 1.00 . A A . 4 ARG HH21 1 1
13 2795 1 1 4 ARG HH22 H 11.696 -4.341 -5.119 1.00 . A A . 4 ARG HH22 1 1
13 2796 1 1 4 ARG N N 5.806 -1.666 0.417 1.00 . A A . 4 ARG N 1 1
13 2797 1 1 4 ARG NE N 9.200 -3.256 -3.393 1.00 . A A . 4 ARG NE 1 1
13 2798 1 1 4 ARG NH1 N 9.273 -4.958 -4.949 1.00 . A A . 4 ARG NH1 1 1
13 2799 1 1 4 ARG NH2 N 11.179 -3.781 -4.466 1.00 . A A . 4 ARG NH2 1 1
13 2800 1 1 4 ARG O O 2.786 -1.316 -1.196 1.00 . A A . 4 ARG O 1 1
13 2801 1 1 5 GLN C C 1.276 -2.520 1.137 1.00 . A A . 5 GLN C 1 1
13 2802 1 1 5 GLN CA C 2.043 -3.538 0.301 1.00 . A A . 5 GLN CA 1 1
13 2803 1 1 5 GLN CB C 2.050 -4.894 1.007 1.00 . A A . 5 GLN CB 1 1
13 2804 1 1 5 GLN CD C 2.695 -7.336 0.919 1.00 . A A . 5 GLN CD 1 1
13 2805 1 1 5 GLN CG C 2.687 -6.005 0.191 1.00 . A A . 5 GLN CG 1 1
13 2806 1 1 5 GLN H H 4.160 -3.585 0.423 1.00 . A A . 5 GLN H 1 1
13 2807 1 1 5 GLN HA H 1.546 -3.645 -0.651 1.00 . A A . 5 GLN HA 1 1
13 2808 1 1 5 GLN HB2 H 2.599 -4.800 1.933 1.00 . A A . 5 GLN HB2 1 1
13 2809 1 1 5 GLN HB3 H 1.031 -5.177 1.228 1.00 . A A . 5 GLN HB3 1 1
13 2810 1 1 5 GLN HE21 H 2.627 -8.298 -0.812 1.00 . A A . 5 GLN HE21 1 1
13 2811 1 1 5 GLN HE22 H 2.669 -9.294 0.606 1.00 . A A . 5 GLN HE22 1 1
13 2812 1 1 5 GLN HG2 H 2.132 -6.119 -0.727 1.00 . A A . 5 GLN HG2 1 1
13 2813 1 1 5 GLN HG3 H 3.706 -5.728 -0.037 1.00 . A A . 5 GLN HG3 1 1
13 2814 1 1 5 GLN N N 3.405 -3.086 0.042 1.00 . A A . 5 GLN N 1 1
13 2815 1 1 5 GLN NE2 N 2.658 -8.419 0.165 1.00 . A A . 5 GLN NE2 1 1
13 2816 1 1 5 GLN O O 0.089 -2.301 0.922 1.00 . A A . 5 GLN O 1 1
13 2817 1 1 5 GLN OE1 O 2.741 -7.387 2.151 1.00 . A A . 5 GLN OE1 1 1
13 2818 1 1 6 ALA C C 0.895 0.316 2.143 1.00 . A A . 6 ALA C 1 1
13 2819 1 1 6 ALA CA C 1.353 -0.897 2.949 1.00 . A A . 6 ALA CA 1 1
13 2820 1 1 6 ALA CB C 2.326 -0.475 4.039 1.00 . A A . 6 ALA CB 1 1
13 2821 1 1 6 ALA H H 2.914 -2.127 2.212 1.00 . A A . 6 ALA H 1 1
13 2822 1 1 6 ALA HA H 0.492 -1.349 3.419 1.00 . A A . 6 ALA HA 1 1
13 2823 1 1 6 ALA HB1 H 2.628 -1.341 4.609 1.00 . A A . 6 ALA HB1 1 1
13 2824 1 1 6 ALA HB2 H 1.847 0.238 4.692 1.00 . A A . 6 ALA HB2 1 1
13 2825 1 1 6 ALA HB3 H 3.196 -0.021 3.587 1.00 . A A . 6 ALA HB3 1 1
13 2826 1 1 6 ALA N N 1.966 -1.897 2.084 1.00 . A A . 6 ALA N 1 1
13 2827 1 1 6 ALA O O -0.204 0.840 2.356 1.00 . A A . 6 ALA O 1 1
13 2828 1 1 7 ARG C C 0.337 1.486 -0.641 1.00 . A A . 7 ARG C 1 1
13 2829 1 1 7 ARG CA C 1.405 1.890 0.358 1.00 . A A . 7 ARG CA 1 1
13 2830 1 1 7 ARG CB C 2.641 2.395 -0.383 1.00 . A A . 7 ARG CB 1 1
13 2831 1 1 7 ARG CD C 5.004 3.221 -0.273 1.00 . A A . 7 ARG CD 1 1
13 2832 1 1 7 ARG CG C 3.790 2.774 0.525 1.00 . A A . 7 ARG CG 1 1
13 2833 1 1 7 ARG CZ C 6.611 1.754 -1.475 1.00 . A A . 7 ARG CZ 1 1
13 2834 1 1 7 ARG H H 2.613 0.316 1.117 1.00 . A A . 7 ARG H 1 1
13 2835 1 1 7 ARG HA H 1.018 2.681 0.982 1.00 . A A . 7 ARG HA 1 1
13 2836 1 1 7 ARG HB2 H 2.982 1.620 -1.053 1.00 . A A . 7 ARG HB2 1 1
13 2837 1 1 7 ARG HB3 H 2.367 3.262 -0.964 1.00 . A A . 7 ARG HB3 1 1
13 2838 1 1 7 ARG HD2 H 4.776 4.159 -0.757 1.00 . A A . 7 ARG HD2 1 1
13 2839 1 1 7 ARG HD3 H 5.833 3.359 0.406 1.00 . A A . 7 ARG HD3 1 1
13 2840 1 1 7 ARG HE H 4.666 1.931 -1.900 1.00 . A A . 7 ARG HE 1 1
13 2841 1 1 7 ARG HG2 H 3.477 3.578 1.174 1.00 . A A . 7 ARG HG2 1 1
13 2842 1 1 7 ARG HG3 H 4.053 1.908 1.114 1.00 . A A . 7 ARG HG3 1 1
13 2843 1 1 7 ARG HH11 H 7.447 2.747 0.094 1.00 . A A . 7 ARG HH11 1 1
13 2844 1 1 7 ARG HH12 H 8.530 1.743 -0.801 1.00 . A A . 7 ARG HH12 1 1
13 2845 1 1 7 ARG HH21 H 6.105 0.622 -3.082 1.00 . A A . 7 ARG HH21 1 1
13 2846 1 1 7 ARG HH22 H 7.767 0.541 -2.610 1.00 . A A . 7 ARG HH22 1 1
13 2847 1 1 7 ARG N N 1.740 0.760 1.219 1.00 . A A . 7 ARG N 1 1
13 2848 1 1 7 ARG NE N 5.381 2.237 -1.295 1.00 . A A . 7 ARG NE 1 1
13 2849 1 1 7 ARG NH1 N 7.604 2.110 -0.665 1.00 . A A . 7 ARG NH1 1 1
13 2850 1 1 7 ARG NH2 N 6.846 0.907 -2.462 1.00 . A A . 7 ARG NH2 1 1
13 2851 1 1 7 ARG O O -0.623 2.221 -0.878 1.00 . A A . 7 ARG O 1 1
13 2852 1 1 8 ALA C C -1.816 -0.418 -1.586 1.00 . A A . 8 ALA C 1 1
13 2853 1 1 8 ALA CA C -0.433 -0.229 -2.197 1.00 . A A . 8 ALA CA 1 1
13 2854 1 1 8 ALA CB C 0.077 -1.541 -2.772 1.00 . A A . 8 ALA CB 1 1
13 2855 1 1 8 ALA H H 1.303 -0.230 -0.979 1.00 . A A . 8 ALA H 1 1
13 2856 1 1 8 ALA HA H -0.507 0.486 -3.003 1.00 . A A . 8 ALA HA 1 1
13 2857 1 1 8 ALA HB1 H 1.054 -1.389 -3.207 1.00 . A A . 8 ALA HB1 1 1
13 2858 1 1 8 ALA HB2 H -0.606 -1.891 -3.532 1.00 . A A . 8 ALA HB2 1 1
13 2859 1 1 8 ALA HB3 H 0.145 -2.276 -1.984 1.00 . A A . 8 ALA HB3 1 1
13 2860 1 1 8 ALA N N 0.508 0.301 -1.217 1.00 . A A . 8 ALA N 1 1
13 2861 1 1 8 ALA O O -2.827 -0.263 -2.264 1.00 . A A . 8 ALA O 1 1
13 2862 1 1 9 ALA C C -3.893 0.383 0.432 1.00 . A A . 9 ALA C 1 1
13 2863 1 1 9 ALA CA C -3.109 -0.922 0.409 1.00 . A A . 9 ALA CA 1 1
13 2864 1 1 9 ALA CB C -2.860 -1.418 1.826 1.00 . A A . 9 ALA CB 1 1
13 2865 1 1 9 ALA H H -1.007 -0.900 0.178 1.00 . A A . 9 ALA H 1 1
13 2866 1 1 9 ALA HA H -3.688 -1.669 -0.117 1.00 . A A . 9 ALA HA 1 1
13 2867 1 1 9 ALA HB1 H -3.805 -1.586 2.322 1.00 . A A . 9 ALA HB1 1 1
13 2868 1 1 9 ALA HB2 H -2.294 -0.677 2.371 1.00 . A A . 9 ALA HB2 1 1
13 2869 1 1 9 ALA HB3 H -2.302 -2.342 1.792 1.00 . A A . 9 ALA HB3 1 1
13 2870 1 1 9 ALA N N -1.853 -0.750 -0.302 1.00 . A A . 9 ALA N 1 1
13 2871 1 1 9 ALA O O -5.109 0.393 0.243 1.00 . A A . 9 ALA O 1 1
13 2872 1 1 10 ARG C C -4.184 3.226 -0.735 1.00 . A A . 10 ARG C 1 1
13 2873 1 1 10 ARG CA C -3.814 2.802 0.677 1.00 . A A . 10 ARG CA 1 1
13 2874 1 1 10 ARG CB C -2.872 3.837 1.301 1.00 . A A . 10 ARG CB 1 1
13 2875 1 1 10 ARG CD C -3.622 3.419 3.663 1.00 . A A . 10 ARG CD 1 1
13 2876 1 1 10 ARG CG C -2.436 3.506 2.718 1.00 . A A . 10 ARG CG 1 1
13 2877 1 1 10 ARG CZ C -3.971 2.249 5.813 1.00 . A A . 10 ARG CZ 1 1
13 2878 1 1 10 ARG H H -2.222 1.406 0.808 1.00 . A A . 10 ARG H 1 1
13 2879 1 1 10 ARG HA H -4.713 2.738 1.270 1.00 . A A . 10 ARG HA 1 1
13 2880 1 1 10 ARG HB2 H -1.988 3.915 0.686 1.00 . A A . 10 ARG HB2 1 1
13 2881 1 1 10 ARG HB3 H -3.372 4.794 1.315 1.00 . A A . 10 ARG HB3 1 1
13 2882 1 1 10 ARG HD2 H -4.088 4.391 3.730 1.00 . A A . 10 ARG HD2 1 1
13 2883 1 1 10 ARG HD3 H -4.331 2.707 3.268 1.00 . A A . 10 ARG HD3 1 1
13 2884 1 1 10 ARG HE H -2.320 3.270 5.301 1.00 . A A . 10 ARG HE 1 1
13 2885 1 1 10 ARG HG2 H -1.923 2.556 2.714 1.00 . A A . 10 ARG HG2 1 1
13 2886 1 1 10 ARG HG3 H -1.764 4.277 3.066 1.00 . A A . 10 ARG HG3 1 1
13 2887 1 1 10 ARG HH11 H -5.573 2.187 4.561 1.00 . A A . 10 ARG HH11 1 1
13 2888 1 1 10 ARG HH12 H -5.770 1.334 6.054 1.00 . A A . 10 ARG HH12 1 1
13 2889 1 1 10 ARG HH21 H -2.586 2.152 7.296 1.00 . A A . 10 ARG HH21 1 1
13 2890 1 1 10 ARG HH22 H -4.060 1.301 7.608 1.00 . A A . 10 ARG HH22 1 1
13 2891 1 1 10 ARG N N -3.189 1.483 0.657 1.00 . A A . 10 ARG N 1 1
13 2892 1 1 10 ARG NE N -3.218 2.993 5.001 1.00 . A A . 10 ARG NE 1 1
13 2893 1 1 10 ARG NH1 N -5.199 1.896 5.446 1.00 . A A . 10 ARG NH1 1 1
13 2894 1 1 10 ARG NH2 N -3.503 1.876 6.999 1.00 . A A . 10 ARG NH2 1 1
13 2895 1 1 10 ARG O O -5.206 3.871 -0.957 1.00 . A A . 10 ARG O 1 1
13 2896 1 1 11 ALA C C -4.784 2.449 -3.636 1.00 . A A . 11 ALA C 1 1
13 2897 1 1 11 ALA CA C -3.560 3.177 -3.080 1.00 . A A . 11 ALA CA 1 1
13 2898 1 1 11 ALA CB C -2.325 2.834 -3.893 1.00 . A A . 11 ALA CB 1 1
13 2899 1 1 11 ALA H H -2.534 2.355 -1.431 1.00 . A A . 11 ALA H 1 1
13 2900 1 1 11 ALA HA H -3.725 4.242 -3.151 1.00 . A A . 11 ALA HA 1 1
13 2901 1 1 11 ALA HB1 H -2.476 3.130 -4.920 1.00 . A A . 11 ALA HB1 1 1
13 2902 1 1 11 ALA HB2 H -2.149 1.770 -3.847 1.00 . A A . 11 ALA HB2 1 1
13 2903 1 1 11 ALA HB3 H -1.471 3.358 -3.489 1.00 . A A . 11 ALA HB3 1 1
13 2904 1 1 11 ALA N N -3.341 2.855 -1.683 1.00 . A A . 11 ALA N 1 1
13 2905 1 1 11 ALA O O -5.566 3.024 -4.395 1.00 . A A . 11 ALA O 1 1
13 2906 1 1 12 ALA C C -7.345 0.719 -2.978 1.00 . A A . 12 ALA C 1 1
13 2907 1 1 12 ALA CA C -6.060 0.389 -3.732 1.00 . A A . 12 ALA CA 1 1
13 2908 1 1 12 ALA CB C -5.737 -1.092 -3.614 1.00 . A A . 12 ALA CB 1 1
13 2909 1 1 12 ALA H H -4.281 0.784 -2.655 1.00 . A A . 12 ALA H 1 1
13 2910 1 1 12 ALA HA H -6.206 0.618 -4.778 1.00 . A A . 12 ALA HA 1 1
13 2911 1 1 12 ALA HB1 H -4.816 -1.303 -4.139 1.00 . A A . 12 ALA HB1 1 1
13 2912 1 1 12 ALA HB2 H -6.538 -1.672 -4.046 1.00 . A A . 12 ALA HB2 1 1
13 2913 1 1 12 ALA HB3 H -5.624 -1.354 -2.572 1.00 . A A . 12 ALA HB3 1 1
13 2914 1 1 12 ALA N N -4.943 1.190 -3.257 1.00 . A A . 12 ALA N 1 1
13 2915 1 1 12 ALA O O -8.424 0.762 -3.566 1.00 . A A . 12 ALA O 1 1
13 2916 1 1 13 DAL C C -8.712 0.191 0.123 1.00 . A A . 13 DAL C 1 1
13 2917 1 1 13 DAL CA C -8.389 1.299 -0.872 1.00 . A A . 13 DAL CA 1 1
13 2918 1 1 13 DAL CB C -8.162 2.611 -0.149 1.00 . A A . 13 DAL CB 1 1
13 2919 1 1 13 DAL H H -6.340 0.926 -1.266 1.00 . A A . 13 DAL H 1 1
13 2920 1 1 13 DAL HA H -9.231 1.423 -1.537 1.00 . A A . 13 DAL HA 1 1
13 2921 1 1 13 DAL HB1 H -7.911 3.376 -0.867 1.00 . A A . 13 DAL HB1 1 1
13 2922 1 1 13 DAL HB2 H -7.353 2.498 0.557 1.00 . A A . 13 DAL HB2 1 1
13 2923 1 1 13 DAL HB3 H -9.063 2.892 0.375 1.00 . A A . 13 DAL HB3 1 1
13 2924 1 1 13 DAL N N -7.227 0.965 -1.685 1.00 . A A . 13 DAL N 1 1
13 2925 1 1 13 DAL O O -9.852 0.052 0.569 1.00 . A A . 13 DAL O 1 1
13 2926 1 1 14 CYS C C -7.488 -1.219 2.817 1.00 . A A . 14 CYS C 1 1
13 2927 1 1 14 CYS CA C -7.882 -1.677 1.414 1.00 . A A . 14 CYS CA 1 1
13 2928 1 1 14 CYS CB C -7.050 -2.889 0.996 1.00 . A A . 14 CYS CB 1 1
13 2929 1 1 14 CYS H H -6.825 -0.449 0.066 1.00 . A A . 14 CYS H 1 1
13 2930 1 1 14 CYS HA H -8.927 -1.952 1.418 1.00 . A A . 14 CYS HA 1 1
13 2931 1 1 14 CYS HB2 H -6.371 -3.137 1.799 1.00 . A A . 14 CYS HB2 1 1
13 2932 1 1 14 CYS HB3 H -7.712 -3.724 0.826 1.00 . A A . 14 CYS HB3 1 1
13 2933 1 1 14 CYS N N -7.711 -0.597 0.463 1.00 . A A . 14 CYS N 1 1
13 2934 1 1 14 CYS O O -8.344 -0.972 3.667 1.00 . A A . 14 CYS O 1 1
13 2935 1 1 14 CYS SG S -6.076 -2.629 -0.500 1.00 . A A . 14 CYS SG 1 1
13 2936 1 1 15 NH2 HN1 H -5.666 -0.556 2.433 1.00 . A A . 15 NH2 HN1 1 1
13 2937 1 1 15 NH2 HN2 H -5.789 -1.728 3.692 1.00 . A A . 15 NH2 HN2 1 1
13 2938 1 1 15 NH2 N N -6.192 -1.099 3.057 1.00 . A A . 15 NH2 N 1 1
13 2939 2 2 1 . CB1 C -1.021 -5.617 5.074 1.00 . B A . 101 B0I CB1 1 1
13 2940 2 2 1 . CB2 C -5.628 -4.328 -0.906 1.00 . B A . 101 B0I CB2 1 1
13 2941 2 2 1 . CD1 C -1.635 -5.604 2.666 1.00 . B A . 101 B0I CD1 1 1
13 2942 2 2 1 . CD2 C -0.724 -7.601 3.574 1.00 . B A . 101 B0I CD2 1 1
13 2943 2 2 1 . CD3 C -3.620 -5.274 0.262 1.00 . B A . 101 B0I CD3 1 1
13 2944 2 2 1 . CD4 C -3.295 -4.125 -1.801 1.00 . B A . 101 B0I CD4 1 1
13 2945 2 2 1 . CE1 C -1.745 -6.211 1.428 1.00 . B A . 101 B0I CE1 1 1
13 2946 2 2 1 . CE2 C -0.828 -8.218 2.343 1.00 . B A . 101 B0I CE2 1 1
13 2947 2 2 1 . CE3 C -2.261 -5.510 0.349 1.00 . B A . 101 B0I CE3 1 1
13 2948 2 2 1 . CE4 C -1.936 -4.356 -1.720 1.00 . B A . 101 B0I CE4 1 1
13 2949 2 2 1 . CG1 C -1.128 -6.287 3.743 1.00 . B A . 101 B0I CG1 1 1
13 2950 2 2 1 . CG2 C -4.151 -4.579 -0.813 1.00 . B A . 101 B0I CG2 1 1
13 2951 2 2 1 . CZ1 C -1.340 -7.521 1.269 1.00 . B A . 101 B0I CZ1 1 1
13 2952 2 2 1 . CZ2 C -1.418 -5.049 -0.645 1.00 . B A . 101 B0I CZ2 1 1
13 2953 2 2 1 . H1 H -0.568 -6.312 5.754 1.00 . B A . 101 B0I H1 1 1
13 2954 2 2 1 . H2 H -6.130 -4.996 -0.222 1.00 . B A . 101 B0I H2 1 1
13 2955 2 2 1 . HB11 H -2.016 -5.373 5.415 1.00 . B A . 101 B0I HB11 1 1
13 2956 2 2 1 . HB21 H -5.945 -4.540 -1.917 1.00 . B A . 101 B0I HB21 1 1
13 2957 2 2 1 . HD1 H -1.945 -4.583 2.812 1.00 . B A . 101 B0I HD1 1 1
13 2958 2 2 1 . HD2 H -0.324 -8.145 4.417 1.00 . B A . 101 B0I HD2 1 1
13 2959 2 2 1 . HD3 H -4.278 -5.634 1.039 1.00 . B A . 101 B0I HD3 1 1
13 2960 2 2 1 . HD4 H -3.699 -3.582 -2.643 1.00 . B A . 101 B0I HD4 1 1
13 2961 2 2 1 . HE2 H -0.510 -9.243 2.222 1.00 . B A . 101 B0I HE2 1 1
13 2962 2 2 1 . HE4 H -1.281 -3.995 -2.499 1.00 . B A . 101 B0I HE4 1 1
13 2963 2 2 1 . HZ1 H -1.425 -7.998 0.305 1.00 . B A . 101 B0I HZ1 1 1
13 2964 2 2 1 . HZ2 H -0.355 -5.231 -0.580 1.00 . B A . 101 B0I HZ2 1 1
14 2965 1 1 1 . C C 4.309 -5.442 5.314 1.00 . A A . 1 H00 C 1 1
14 2966 1 1 1 . CA C 3.102 -6.333 5.537 1.00 . A A . 1 H00 CA 1 1
14 2967 1 1 1 . CB C 1.858 -5.488 5.767 1.00 . A A . 1 H00 CB 1 1
14 2968 1 1 1 . CG C 1.533 -4.635 4.551 1.00 . A A . 1 H00 CG 1 1
14 2969 1 1 1 . HA1 H 3.271 -6.954 6.404 1.00 . A A . 1 H00 HA1 1 1
14 2970 1 1 1 . HA2 H 2.954 -6.957 4.667 1.00 . A A . 1 H00 HA2 1 1
14 2971 1 1 1 . HB1 H 2.026 -4.841 6.616 1.00 . A A . 1 H00 HB1 1 1
14 2972 1 1 1 . HB2 H 1.023 -6.142 5.968 1.00 . A A . 1 H00 HB2 1 1
14 2973 1 1 1 . HG1 H 1.520 -5.270 3.676 1.00 . A A . 1 H00 HG1 1 1
14 2974 1 1 1 . HG2 H 2.303 -3.884 4.439 1.00 . A A . 1 H00 HG2 1 1
14 2975 1 1 1 . O O 4.747 -4.732 6.228 1.00 . A A . 1 H00 O 1 1
14 2976 1 1 1 . SD S -0.062 -3.804 4.686 1.00 . A A . 1 H00 SD 1 1
14 2977 1 1 2 THR C C 5.528 -3.266 3.328 1.00 . A A . 2 THR C 1 1
14 2978 1 1 2 THR CA C 5.986 -4.658 3.768 1.00 . A A . 2 THR CA 1 1
14 2979 1 1 2 THR CB C 6.810 -5.324 2.651 1.00 . A A . 2 THR CB 1 1
14 2980 1 1 2 THR CG2 C 7.527 -6.556 3.182 1.00 . A A . 2 THR CG2 1 1
14 2981 1 1 2 THR H H 4.460 -6.061 3.423 1.00 . A A . 2 THR H 1 1
14 2982 1 1 2 THR HA H 6.606 -4.563 4.646 1.00 . A A . 2 THR HA 1 1
14 2983 1 1 2 THR HB H 7.544 -4.621 2.288 1.00 . A A . 2 THR HB 1 1
14 2984 1 1 2 THR HG1 H 6.280 -6.513 1.169 1.00 . A A . 2 THR HG1 1 1
14 2985 1 1 2 THR HG21 H 8.108 -7.007 2.393 1.00 . A A . 2 THR HG21 1 1
14 2986 1 1 2 THR HG22 H 6.799 -7.268 3.545 1.00 . A A . 2 THR HG22 1 1
14 2987 1 1 2 THR HG23 H 8.183 -6.269 3.991 1.00 . A A . 2 THR HG23 1 1
14 2988 1 1 2 THR N N 4.845 -5.474 4.112 1.00 . A A . 2 THR N 1 1
14 2989 1 1 2 THR O O 4.370 -3.090 2.933 1.00 . A A . 2 THR O 1 1
14 2990 1 1 2 THR OG1 O 5.947 -5.700 1.570 1.00 . A A . 2 THR OG1 1 1
14 2991 1 1 3 PRO C C 5.450 -0.761 1.643 1.00 . A A . 3 PRO C 1 1
14 2992 1 1 3 PRO CA C 6.094 -0.870 3.030 1.00 . A A . 3 PRO CA 1 1
14 2993 1 1 3 PRO CB C 7.451 -0.143 3.057 1.00 . A A . 3 PRO CB 1 1
14 2994 1 1 3 PRO CD C 7.798 -2.363 3.888 1.00 . A A . 3 PRO CD 1 1
14 2995 1 1 3 PRO CG C 8.480 -1.221 3.201 1.00 . A A . 3 PRO CG 1 1
14 2996 1 1 3 PRO HA H 5.432 -0.419 3.755 1.00 . A A . 3 PRO HA 1 1
14 2997 1 1 3 PRO HB2 H 7.583 0.406 2.137 1.00 . A A . 3 PRO HB2 1 1
14 2998 1 1 3 PRO HB3 H 7.478 0.538 3.895 1.00 . A A . 3 PRO HB3 1 1
14 2999 1 1 3 PRO HD2 H 8.241 -3.302 3.593 1.00 . A A . 3 PRO HD2 1 1
14 3000 1 1 3 PRO HD3 H 7.844 -2.241 4.960 1.00 . A A . 3 PRO HD3 1 1
14 3001 1 1 3 PRO HG2 H 8.830 -1.525 2.226 1.00 . A A . 3 PRO HG2 1 1
14 3002 1 1 3 PRO HG3 H 9.305 -0.861 3.800 1.00 . A A . 3 PRO HG3 1 1
14 3003 1 1 3 PRO N N 6.418 -2.251 3.407 1.00 . A A . 3 PRO N 1 1
14 3004 1 1 3 PRO O O 4.489 -0.017 1.461 1.00 . A A . 3 PRO O 1 1
14 3005 1 1 4 ARG C C 3.950 -1.932 -0.679 1.00 . A A . 4 ARG C 1 1
14 3006 1 1 4 ARG CA C 5.417 -1.486 -0.681 1.00 . A A . 4 ARG CA 1 1
14 3007 1 1 4 ARG CB C 6.240 -2.363 -1.644 1.00 . A A . 4 ARG CB 1 1
14 3008 1 1 4 ARG CD C 6.852 -4.679 -2.408 1.00 . A A . 4 ARG CD 1 1
14 3009 1 1 4 ARG CG C 6.218 -3.845 -1.311 1.00 . A A . 4 ARG CG 1 1
14 3010 1 1 4 ARG CZ C 6.265 -7.035 -2.903 1.00 . A A . 4 ARG CZ 1 1
14 3011 1 1 4 ARG H H 6.735 -2.095 0.873 1.00 . A A . 4 ARG H 1 1
14 3012 1 1 4 ARG HA H 5.458 -0.461 -1.021 1.00 . A A . 4 ARG HA 1 1
14 3013 1 1 4 ARG HB2 H 5.852 -2.240 -2.643 1.00 . A A . 4 ARG HB2 1 1
14 3014 1 1 4 ARG HB3 H 7.267 -2.028 -1.626 1.00 . A A . 4 ARG HB3 1 1
14 3015 1 1 4 ARG HD2 H 6.331 -4.489 -3.334 1.00 . A A . 4 ARG HD2 1 1
14 3016 1 1 4 ARG HD3 H 7.889 -4.393 -2.510 1.00 . A A . 4 ARG HD3 1 1
14 3017 1 1 4 ARG HE H 7.133 -6.381 -1.218 1.00 . A A . 4 ARG HE 1 1
14 3018 1 1 4 ARG HG2 H 6.758 -4.008 -0.391 1.00 . A A . 4 ARG HG2 1 1
14 3019 1 1 4 ARG HG3 H 5.192 -4.155 -1.185 1.00 . A A . 4 ARG HG3 1 1
14 3020 1 1 4 ARG HH11 H 5.863 -5.761 -4.435 1.00 . A A . 4 ARG HH11 1 1
14 3021 1 1 4 ARG HH12 H 5.423 -7.409 -4.707 1.00 . A A . 4 ARG HH12 1 1
14 3022 1 1 4 ARG HH21 H 6.555 -8.552 -1.596 1.00 . A A . 4 ARG HH21 1 1
14 3023 1 1 4 ARG HH22 H 5.822 -9.007 -3.094 1.00 . A A . 4 ARG HH22 1 1
14 3024 1 1 4 ARG N N 5.969 -1.516 0.673 1.00 . A A . 4 ARG N 1 1
14 3025 1 1 4 ARG NE N 6.780 -6.106 -2.097 1.00 . A A . 4 ARG NE 1 1
14 3026 1 1 4 ARG NH1 N 5.817 -6.707 -4.109 1.00 . A A . 4 ARG NH1 1 1
14 3027 1 1 4 ARG NH2 N 6.211 -8.295 -2.503 1.00 . A A . 4 ARG NH2 1 1
14 3028 1 1 4 ARG O O 3.104 -1.336 -1.348 1.00 . A A . 4 ARG O 1 1
14 3029 1 1 5 GLN C C 1.409 -2.516 0.931 1.00 . A A . 5 GLN C 1 1
14 3030 1 1 5 GLN CA C 2.305 -3.498 0.194 1.00 . A A . 5 GLN CA 1 1
14 3031 1 1 5 GLN CB C 2.309 -4.847 0.904 1.00 . A A . 5 GLN CB 1 1
14 3032 1 1 5 GLN CD C 3.127 -7.233 0.910 1.00 . A A . 5 GLN CD 1 1
14 3033 1 1 5 GLN CG C 3.019 -5.942 0.129 1.00 . A A . 5 GLN CG 1 1
14 3034 1 1 5 GLN H H 4.374 -3.407 0.602 1.00 . A A . 5 GLN H 1 1
14 3035 1 1 5 GLN HA H 1.923 -3.631 -0.807 1.00 . A A . 5 GLN HA 1 1
14 3036 1 1 5 GLN HB2 H 2.804 -4.734 1.858 1.00 . A A . 5 GLN HB2 1 1
14 3037 1 1 5 GLN HB3 H 1.287 -5.158 1.069 1.00 . A A . 5 GLN HB3 1 1
14 3038 1 1 5 GLN HE21 H 3.040 -8.275 -0.772 1.00 . A A . 5 GLN HE21 1 1
14 3039 1 1 5 GLN HE22 H 3.183 -9.199 0.685 1.00 . A A . 5 GLN HE22 1 1
14 3040 1 1 5 GLN HG2 H 2.472 -6.136 -0.782 1.00 . A A . 5 GLN HG2 1 1
14 3041 1 1 5 GLN HG3 H 4.015 -5.604 -0.116 1.00 . A A . 5 GLN HG3 1 1
14 3042 1 1 5 GLN N N 3.657 -2.978 0.086 1.00 . A A . 5 GLN N 1 1
14 3043 1 1 5 GLN NE2 N 3.116 -8.345 0.209 1.00 . A A . 5 GLN NE2 1 1
14 3044 1 1 5 GLN O O 0.246 -2.344 0.583 1.00 . A A . 5 GLN O 1 1
14 3045 1 1 5 GLN OE1 O 3.217 -7.227 2.141 1.00 . A A . 5 GLN OE1 1 1
14 3046 1 1 6 ALA C C 0.801 0.291 1.875 1.00 . A A . 6 ALA C 1 1
14 3047 1 1 6 ALA CA C 1.231 -0.892 2.735 1.00 . A A . 6 ALA CA 1 1
14 3048 1 1 6 ALA CB C 2.075 -0.420 3.906 1.00 . A A . 6 ALA CB 1 1
14 3049 1 1 6 ALA H H 2.907 -2.052 2.167 1.00 . A A . 6 ALA H 1 1
14 3050 1 1 6 ALA HA H 0.349 -1.380 3.124 1.00 . A A . 6 ALA HA 1 1
14 3051 1 1 6 ALA HB1 H 2.347 -1.267 4.518 1.00 . A A . 6 ALA HB1 1 1
14 3052 1 1 6 ALA HB2 H 1.512 0.288 4.495 1.00 . A A . 6 ALA HB2 1 1
14 3053 1 1 6 ALA HB3 H 2.971 0.056 3.533 1.00 . A A . 6 ALA HB3 1 1
14 3054 1 1 6 ALA N N 1.968 -1.865 1.942 1.00 . A A . 6 ALA N 1 1
14 3055 1 1 6 ALA O O -0.341 0.761 1.968 1.00 . A A . 6 ALA O 1 1
14 3056 1 1 7 ARG C C 0.399 1.426 -0.909 1.00 . A A . 7 ARG C 1 1
14 3057 1 1 7 ARG CA C 1.417 1.866 0.125 1.00 . A A . 7 ARG CA 1 1
14 3058 1 1 7 ARG CB C 2.694 2.351 -0.565 1.00 . A A . 7 ARG CB 1 1
14 3059 1 1 7 ARG CD C 5.043 3.216 -0.310 1.00 . A A . 7 ARG CD 1 1
14 3060 1 1 7 ARG CG C 3.775 2.781 0.405 1.00 . A A . 7 ARG CG 1 1
14 3061 1 1 7 ARG CZ C 7.358 3.880 0.303 1.00 . A A . 7 ARG CZ 1 1
14 3062 1 1 7 ARG H H 2.608 0.358 1.027 1.00 . A A . 7 ARG H 1 1
14 3063 1 1 7 ARG HA H 0.998 2.674 0.707 1.00 . A A . 7 ARG HA 1 1
14 3064 1 1 7 ARG HB2 H 3.086 1.553 -1.177 1.00 . A A . 7 ARG HB2 1 1
14 3065 1 1 7 ARG HB3 H 2.453 3.193 -1.197 1.00 . A A . 7 ARG HB3 1 1
14 3066 1 1 7 ARG HD2 H 5.406 2.394 -0.909 1.00 . A A . 7 ARG HD2 1 1
14 3067 1 1 7 ARG HD3 H 4.811 4.055 -0.950 1.00 . A A . 7 ARG HD3 1 1
14 3068 1 1 7 ARG HE H 5.826 3.688 1.583 1.00 . A A . 7 ARG HE 1 1
14 3069 1 1 7 ARG HG2 H 3.407 3.600 1.003 1.00 . A A . 7 ARG HG2 1 1
14 3070 1 1 7 ARG HG3 H 4.000 1.937 1.042 1.00 . A A . 7 ARG HG3 1 1
14 3071 1 1 7 ARG HH11 H 7.097 3.521 -1.678 1.00 . A A . 7 ARG HH11 1 1
14 3072 1 1 7 ARG HH12 H 8.695 3.992 -1.224 1.00 . A A . 7 ARG HH12 1 1
14 3073 1 1 7 ARG HH21 H 7.955 4.299 2.201 1.00 . A A . 7 ARG HH21 1 1
14 3074 1 1 7 ARG HH22 H 9.189 4.423 0.997 1.00 . A A . 7 ARG HH22 1 1
14 3075 1 1 7 ARG N N 1.710 0.761 1.031 1.00 . A A . 7 ARG N 1 1
14 3076 1 1 7 ARG NE N 6.090 3.616 0.638 1.00 . A A . 7 ARG NE 1 1
14 3077 1 1 7 ARG NH1 N 7.748 3.789 -0.964 1.00 . A A . 7 ARG NH1 1 1
14 3078 1 1 7 ARG NH2 N 8.235 4.229 1.241 1.00 . A A . 7 ARG NH2 1 1
14 3079 1 1 7 ARG O O -0.516 2.173 -1.260 1.00 . A A . 7 ARG O 1 1
14 3080 1 1 8 ALA C C -1.764 -0.499 -1.784 1.00 . A A . 8 ALA C 1 1
14 3081 1 1 8 ALA CA C -0.358 -0.373 -2.361 1.00 . A A . 8 ALA CA 1 1
14 3082 1 1 8 ALA CB C 0.146 -1.726 -2.832 1.00 . A A . 8 ALA CB 1 1
14 3083 1 1 8 ALA H H 1.322 -0.331 -1.062 1.00 . A A . 8 ALA H 1 1
14 3084 1 1 8 ALA HA H -0.390 0.293 -3.210 1.00 . A A . 8 ALA HA 1 1
14 3085 1 1 8 ALA HB1 H -0.505 -2.103 -3.606 1.00 . A A . 8 ALA HB1 1 1
14 3086 1 1 8 ALA HB2 H 0.155 -2.416 -2.001 1.00 . A A . 8 ALA HB2 1 1
14 3087 1 1 8 ALA HB3 H 1.145 -1.619 -3.222 1.00 . A A . 8 ALA HB3 1 1
14 3088 1 1 8 ALA N N 0.556 0.200 -1.381 1.00 . A A . 8 ALA N 1 1
14 3089 1 1 8 ALA O O -2.759 -0.270 -2.483 1.00 . A A . 8 ALA O 1 1
14 3090 1 1 9 ALA C C -3.815 0.368 0.243 1.00 . A A . 9 ALA C 1 1
14 3091 1 1 9 ALA CA C -3.113 -0.978 0.185 1.00 . A A . 9 ALA CA 1 1
14 3092 1 1 9 ALA CB C -2.906 -1.530 1.588 1.00 . A A . 9 ALA CB 1 1
14 3093 1 1 9 ALA H H -1.011 -1.060 -0.019 1.00 . A A . 9 ALA H 1 1
14 3094 1 1 9 ALA HA H -3.730 -1.673 -0.367 1.00 . A A . 9 ALA HA 1 1
14 3095 1 1 9 ALA HB1 H -2.324 -0.828 2.167 1.00 . A A . 9 ALA HB1 1 1
14 3096 1 1 9 ALA HB2 H -2.378 -2.469 1.528 1.00 . A A . 9 ALA HB2 1 1
14 3097 1 1 9 ALA HB3 H -3.864 -1.682 2.062 1.00 . A A . 9 ALA HB3 1 1
14 3098 1 1 9 ALA N N -1.841 -0.857 -0.507 1.00 . A A . 9 ALA N 1 1
14 3099 1 1 9 ALA O O -5.028 0.457 0.069 1.00 . A A . 9 ALA O 1 1
14 3100 1 1 10 ARG C C -4.075 3.189 -0.853 1.00 . A A . 10 ARG C 1 1
14 3101 1 1 10 ARG CA C -3.564 2.763 0.525 1.00 . A A . 10 ARG CA 1 1
14 3102 1 1 10 ARG CB C -2.477 3.728 0.989 1.00 . A A . 10 ARG CB 1 1
14 3103 1 1 10 ARG CD C -1.808 6.121 1.314 1.00 . A A . 10 ARG CD 1 1
14 3104 1 1 10 ARG CG C -2.961 5.151 1.145 1.00 . A A . 10 ARG CG 1 1
14 3105 1 1 10 ARG CZ C -1.968 8.491 0.599 1.00 . A A . 10 ARG CZ 1 1
14 3106 1 1 10 ARG H H -2.082 1.278 0.631 1.00 . A A . 10 ARG H 1 1
14 3107 1 1 10 ARG HA H -4.381 2.785 1.230 1.00 . A A . 10 ARG HA 1 1
14 3108 1 1 10 ARG HB2 H -2.098 3.393 1.944 1.00 . A A . 10 ARG HB2 1 1
14 3109 1 1 10 ARG HB3 H -1.672 3.720 0.270 1.00 . A A . 10 ARG HB3 1 1
14 3110 1 1 10 ARG HD2 H -1.253 5.850 2.200 1.00 . A A . 10 ARG HD2 1 1
14 3111 1 1 10 ARG HD3 H -1.163 6.047 0.454 1.00 . A A . 10 ARG HD3 1 1
14 3112 1 1 10 ARG HE H -2.852 7.693 2.221 1.00 . A A . 10 ARG HE 1 1
14 3113 1 1 10 ARG HG2 H -3.528 5.427 0.269 1.00 . A A . 10 ARG HG2 1 1
14 3114 1 1 10 ARG HG3 H -3.594 5.195 2.016 1.00 . A A . 10 ARG HG3 1 1
14 3115 1 1 10 ARG HH11 H -0.829 7.336 -0.636 1.00 . A A . 10 ARG HH11 1 1
14 3116 1 1 10 ARG HH12 H -0.961 8.996 -1.100 1.00 . A A . 10 ARG HH12 1 1
14 3117 1 1 10 ARG HH21 H -3.029 9.907 1.602 1.00 . A A . 10 ARG HH21 1 1
14 3118 1 1 10 ARG HH22 H -2.221 10.465 0.180 1.00 . A A . 10 ARG HH22 1 1
14 3119 1 1 10 ARG N N -3.040 1.416 0.476 1.00 . A A . 10 ARG N 1 1
14 3120 1 1 10 ARG NE N -2.274 7.502 1.445 1.00 . A A . 10 ARG NE 1 1
14 3121 1 1 10 ARG NH1 N -1.192 8.255 -0.460 1.00 . A A . 10 ARG NH1 1 1
14 3122 1 1 10 ARG NH2 N -2.441 9.716 0.810 1.00 . A A . 10 ARG NH2 1 1
14 3123 1 1 10 ARG O O -5.094 3.866 -0.968 1.00 . A A . 10 ARG O 1 1
14 3124 1 1 11 ALA C C -5.025 2.471 -3.686 1.00 . A A . 11 ALA C 1 1
14 3125 1 1 11 ALA CA C -3.717 3.132 -3.263 1.00 . A A . 11 ALA CA 1 1
14 3126 1 1 11 ALA CB C -2.597 2.747 -4.218 1.00 . A A . 11 ALA CB 1 1
14 3127 1 1 11 ALA H H -2.548 2.249 -1.730 1.00 . A A . 11 ALA H 1 1
14 3128 1 1 11 ALA HA H -3.842 4.203 -3.310 1.00 . A A . 11 ALA HA 1 1
14 3129 1 1 11 ALA HB1 H -1.684 3.238 -3.918 1.00 . A A . 11 ALA HB1 1 1
14 3130 1 1 11 ALA HB2 H -2.859 3.052 -5.221 1.00 . A A . 11 ALA HB2 1 1
14 3131 1 1 11 ALA HB3 H -2.455 1.677 -4.193 1.00 . A A . 11 ALA HB3 1 1
14 3132 1 1 11 ALA N N -3.355 2.787 -1.892 1.00 . A A . 11 ALA N 1 1
14 3133 1 1 11 ALA O O -5.844 3.083 -4.369 1.00 . A A . 11 ALA O 1 1
14 3134 1 1 12 ALA C C -7.574 0.825 -2.682 1.00 . A A . 12 ALA C 1 1
14 3135 1 1 12 ALA CA C -6.429 0.499 -3.633 1.00 . A A . 12 ALA CA 1 1
14 3136 1 1 12 ALA CB C -6.163 -0.997 -3.654 1.00 . A A . 12 ALA CB 1 1
14 3137 1 1 12 ALA H H -4.539 0.792 -2.719 1.00 . A A . 12 ALA H 1 1
14 3138 1 1 12 ALA HA H -6.712 0.805 -4.630 1.00 . A A . 12 ALA HA 1 1
14 3139 1 1 12 ALA HB1 H -7.061 -1.518 -3.950 1.00 . A A . 12 ALA HB1 1 1
14 3140 1 1 12 ALA HB2 H -5.865 -1.326 -2.669 1.00 . A A . 12 ALA HB2 1 1
14 3141 1 1 12 ALA HB3 H -5.374 -1.214 -4.359 1.00 . A A . 12 ALA HB3 1 1
14 3142 1 1 12 ALA N N -5.221 1.230 -3.273 1.00 . A A . 12 ALA N 1 1
14 3143 1 1 12 ALA O O -8.734 0.865 -3.088 1.00 . A A . 12 ALA O 1 1
14 3144 1 1 13 DAL C C -8.596 0.133 0.377 1.00 . A A . 13 DAL C 1 1
14 3145 1 1 13 DAL CA C -8.246 1.375 -0.425 1.00 . A A . 13 DAL CA 1 1
14 3146 1 1 13 DAL CB C -7.746 2.478 0.497 1.00 . A A . 13 DAL CB 1 1
14 3147 1 1 13 DAL H H -6.300 1.017 -1.163 1.00 . A A . 13 DAL H 1 1
14 3148 1 1 13 DAL HA H -9.132 1.729 -0.932 1.00 . A A . 13 DAL HA 1 1
14 3149 1 1 13 DAL HB1 H -8.506 2.712 1.226 1.00 . A A . 13 DAL HB1 1 1
14 3150 1 1 13 DAL HB2 H -7.522 3.359 -0.086 1.00 . A A . 13 DAL HB2 1 1
14 3151 1 1 13 DAL HB3 H -6.852 2.145 1.004 1.00 . A A . 13 DAL HB3 1 1
14 3152 1 1 13 DAL N N -7.245 1.063 -1.429 1.00 . A A . 13 DAL N 1 1
14 3153 1 1 13 DAL O O -9.771 -0.189 0.572 1.00 . A A . 13 DAL O 1 1
14 3154 1 1 14 CYS C C -7.328 -1.539 3.054 1.00 . A A . 14 CYS C 1 1
14 3155 1 1 14 CYS CA C -7.749 -1.777 1.610 1.00 . A A . 14 CYS CA 1 1
14 3156 1 1 14 CYS CB C -6.931 -2.916 1.003 1.00 . A A . 14 CYS CB 1 1
14 3157 1 1 14 CYS H H -6.659 -0.269 0.620 1.00 . A A . 14 CYS H 1 1
14 3158 1 1 14 CYS HA H -8.796 -2.043 1.586 1.00 . A A . 14 CYS HA 1 1
14 3159 1 1 14 CYS HB2 H -6.137 -3.177 1.688 1.00 . A A . 14 CYS HB2 1 1
14 3160 1 1 14 CYS HB3 H -7.572 -3.773 0.868 1.00 . A A . 14 CYS HB3 1 1
14 3161 1 1 14 CYS N N -7.572 -0.569 0.825 1.00 . A A . 14 CYS N 1 1
14 3162 1 1 14 CYS O O -6.193 -1.826 3.438 1.00 . A A . 14 CYS O 1 1
14 3163 1 1 14 CYS SG S -6.189 -2.508 -0.590 1.00 . A A . 14 CYS SG 1 1
14 3164 1 1 15 NH2 HN1 H -8.162 -0.044 4.034 1.00 . A A . 15 NH2 HN1 1 1
14 3165 1 1 15 NH2 HN2 H -9.053 -1.517 4.012 1.00 . A A . 15 NH2 HN2 1 1
14 3166 1 1 15 NH2 N N -8.234 -1.004 3.850 1.00 . A A . 15 NH2 N 1 1
14 3167 2 2 1 . CB1 C -1.199 -5.195 4.488 1.00 . B A . 101 B0I CB1 1 1
14 3168 2 2 1 . CB2 C -5.795 -4.148 -1.214 1.00 . B A . 101 B0I CB2 1 1
14 3169 2 2 1 . CD1 C -1.733 -5.264 2.063 1.00 . B A . 101 B0I CD1 1 1
14 3170 2 2 1 . CD2 C -0.404 -7.017 2.955 1.00 . B A . 101 B0I CD2 1 1
14 3171 2 2 1 . CD3 C -3.662 -5.000 -0.212 1.00 . B A . 101 B0I CD3 1 1
14 3172 2 2 1 . CD4 C -3.590 -4.070 -2.404 1.00 . B A . 101 B0I CD4 1 1
14 3173 2 2 1 . CE1 C -1.663 -5.841 0.808 1.00 . B A . 101 B0I CE1 1 1
14 3174 2 2 1 . CE2 C -0.326 -7.604 1.708 1.00 . B A . 101 B0I CE2 1 1
14 3175 2 2 1 . CE3 C -2.304 -5.246 -0.268 1.00 . B A . 101 B0I CE3 1 1
14 3176 2 2 1 . CE4 C -2.233 -4.313 -2.468 1.00 . B A . 101 B0I CE4 1 1
14 3177 2 2 1 . CG1 C -1.111 -5.838 3.140 1.00 . B A . 101 B0I CG1 1 1
14 3178 2 2 1 . CG2 C -4.319 -4.410 -1.278 1.00 . B A . 101 B0I CG2 1 1
14 3179 2 2 1 . CZ1 C -0.957 -7.015 0.632 1.00 . B A . 101 B0I CZ1 1 1
14 3180 2 2 1 . CZ2 C -1.588 -4.902 -1.399 1.00 . B A . 101 B0I CZ2 1 1
14 3181 2 2 1 . H1 H -0.979 -5.941 5.227 1.00 . B A . 101 B0I H1 1 1
14 3182 2 2 1 . H2 H -6.244 -4.886 -0.569 1.00 . B A . 101 B0I H2 1 1
14 3183 2 2 1 . HB11 H -2.211 -4.839 4.624 1.00 . B A . 101 B0I HB11 1 1
14 3184 2 2 1 . HB21 H -6.198 -4.247 -2.210 1.00 . B A . 101 B0I HB21 1 1
14 3185 2 2 1 . HD1 H -2.279 -4.351 2.219 1.00 . B A . 101 B0I HD1 1 1
14 3186 2 2 1 . HD2 H 0.089 -7.478 3.799 1.00 . B A . 101 B0I HD2 1 1
14 3187 2 2 1 . HD3 H -4.221 -5.269 0.672 1.00 . B A . 101 B0I HD3 1 1
14 3188 2 2 1 . HD4 H -4.094 -3.610 -3.242 1.00 . B A . 101 B0I HD4 1 1
14 3189 2 2 1 . HE2 H 0.227 -8.522 1.575 1.00 . B A . 101 B0I HE2 1 1
14 3190 2 2 1 . HE4 H -1.677 -4.043 -3.353 1.00 . B A . 101 B0I HE4 1 1
14 3191 2 2 1 . HZ1 H -0.899 -7.471 -0.346 1.00 . B A . 101 B0I HZ1 1 1
14 3192 2 2 1 . HZ2 H -0.525 -5.093 -1.445 1.00 . B A . 101 B0I HZ2 1 1
15 3193 1 1 1 . C C 4.509 -5.212 5.337 1.00 . A A . 1 H00 C 1 1
15 3194 1 1 1 . CA C 3.348 -6.117 5.689 1.00 . A A . 1 H00 CA 1 1
15 3195 1 1 1 . CB C 2.101 -5.291 5.962 1.00 . A A . 1 H00 CB 1 1
15 3196 1 1 1 . CG C 1.571 -4.656 4.688 1.00 . A A . 1 H00 CG 1 1
15 3197 1 1 1 . HA1 H 3.594 -6.690 6.572 1.00 . A A . 1 H00 HA1 1 1
15 3198 1 1 1 . HA2 H 3.158 -6.788 4.865 1.00 . A A . 1 H00 HA2 1 1
15 3199 1 1 1 . HB1 H 2.347 -4.510 6.669 1.00 . A A . 1 H00 HB1 1 1
15 3200 1 1 1 . HB2 H 1.337 -5.931 6.378 1.00 . A A . 1 H00 HB2 1 1
15 3201 1 1 1 . HG1 H 1.561 -5.406 3.909 1.00 . A A . 1 H00 HG1 1 1
15 3202 1 1 1 . HG2 H 2.229 -3.849 4.404 1.00 . A A . 1 H00 HG2 1 1
15 3203 1 1 1 . O O 4.920 -4.372 6.145 1.00 . A A . 1 H00 O 1 1
15 3204 1 1 1 . SD S -0.097 -3.999 4.878 1.00 . A A . 1 H00 SD 1 1
15 3205 1 1 2 THR C C 5.644 -3.175 3.265 1.00 . A A . 2 THR C 1 1
15 3206 1 1 2 THR CA C 6.147 -4.561 3.678 1.00 . A A . 2 THR CA 1 1
15 3207 1 1 2 THR CB C 6.870 -5.227 2.481 1.00 . A A . 2 THR CB 1 1
15 3208 1 1 2 THR CG2 C 7.464 -6.569 2.888 1.00 . A A . 2 THR CG2 1 1
15 3209 1 1 2 THR H H 4.668 -6.053 3.531 1.00 . A A . 2 THR H 1 1
15 3210 1 1 2 THR HA H 6.848 -4.457 4.494 1.00 . A A . 2 THR HA 1 1
15 3211 1 1 2 THR HB H 7.668 -4.577 2.152 1.00 . A A . 2 THR HB 1 1
15 3212 1 1 2 THR HG1 H 6.305 -6.083 0.793 1.00 . A A . 2 THR HG1 1 1
15 3213 1 1 2 THR HG21 H 6.675 -7.223 3.228 1.00 . A A . 2 THR HG21 1 1
15 3214 1 1 2 THR HG22 H 8.178 -6.421 3.685 1.00 . A A . 2 THR HG22 1 1
15 3215 1 1 2 THR HG23 H 7.960 -7.015 2.039 1.00 . A A . 2 THR HG23 1 1
15 3216 1 1 2 THR N N 5.038 -5.374 4.135 1.00 . A A . 2 THR N 1 1
15 3217 1 1 2 THR O O 4.442 -2.999 3.017 1.00 . A A . 2 THR O 1 1
15 3218 1 1 2 THR OG1 O 5.950 -5.420 1.400 1.00 . A A . 2 THR OG1 1 1
15 3219 1 1 3 PRO C C 5.425 -0.790 1.467 1.00 . A A . 3 PRO C 1 1
15 3220 1 1 3 PRO CA C 6.177 -0.808 2.794 1.00 . A A . 3 PRO CA 1 1
15 3221 1 1 3 PRO CB C 7.528 -0.107 2.651 1.00 . A A . 3 PRO CB 1 1
15 3222 1 1 3 PRO CD C 7.981 -2.274 3.531 1.00 . A A . 3 PRO CD 1 1
15 3223 1 1 3 PRO CG C 8.429 -0.841 3.579 1.00 . A A . 3 PRO CG 1 1
15 3224 1 1 3 PRO HA H 5.585 -0.315 3.552 1.00 . A A . 3 PRO HA 1 1
15 3225 1 1 3 PRO HB2 H 7.866 -0.179 1.626 1.00 . A A . 3 PRO HB2 1 1
15 3226 1 1 3 PRO HB3 H 7.433 0.932 2.934 1.00 . A A . 3 PRO HB3 1 1
15 3227 1 1 3 PRO HD2 H 8.520 -2.809 2.763 1.00 . A A . 3 PRO HD2 1 1
15 3228 1 1 3 PRO HD3 H 8.121 -2.747 4.492 1.00 . A A . 3 PRO HD3 1 1
15 3229 1 1 3 PRO HG2 H 9.453 -0.754 3.245 1.00 . A A . 3 PRO HG2 1 1
15 3230 1 1 3 PRO HG3 H 8.323 -0.449 4.579 1.00 . A A . 3 PRO HG3 1 1
15 3231 1 1 3 PRO N N 6.544 -2.169 3.197 1.00 . A A . 3 PRO N 1 1
15 3232 1 1 3 PRO O O 4.458 -0.054 1.305 1.00 . A A . 3 PRO O 1 1
15 3233 1 1 4 ARG C C 3.765 -2.096 -0.648 1.00 . A A . 4 ARG C 1 1
15 3234 1 1 4 ARG CA C 5.234 -1.723 -0.784 1.00 . A A . 4 ARG CA 1 1
15 3235 1 1 4 ARG CB C 5.931 -2.779 -1.640 1.00 . A A . 4 ARG CB 1 1
15 3236 1 1 4 ARG CD C 8.018 -3.682 -2.663 1.00 . A A . 4 ARG CD 1 1
15 3237 1 1 4 ARG CG C 7.424 -2.585 -1.796 1.00 . A A . 4 ARG CG 1 1
15 3238 1 1 4 ARG CZ C 10.220 -4.443 -3.480 1.00 . A A . 4 ARG CZ 1 1
15 3239 1 1 4 ARG H H 6.626 -2.208 0.741 1.00 . A A . 4 ARG H 1 1
15 3240 1 1 4 ARG HA H 5.317 -0.762 -1.270 1.00 . A A . 4 ARG HA 1 1
15 3241 1 1 4 ARG HB2 H 5.767 -3.747 -1.193 1.00 . A A . 4 ARG HB2 1 1
15 3242 1 1 4 ARG HB3 H 5.485 -2.771 -2.623 1.00 . A A . 4 ARG HB3 1 1
15 3243 1 1 4 ARG HD2 H 7.827 -4.634 -2.193 1.00 . A A . 4 ARG HD2 1 1
15 3244 1 1 4 ARG HD3 H 7.535 -3.659 -3.628 1.00 . A A . 4 ARG HD3 1 1
15 3245 1 1 4 ARG HE H 9.879 -2.720 -2.496 1.00 . A A . 4 ARG HE 1 1
15 3246 1 1 4 ARG HG2 H 7.615 -1.625 -2.253 1.00 . A A . 4 ARG HG2 1 1
15 3247 1 1 4 ARG HG3 H 7.877 -2.623 -0.816 1.00 . A A . 4 ARG HG3 1 1
15 3248 1 1 4 ARG HH11 H 8.682 -5.719 -3.864 1.00 . A A . 4 ARG HH11 1 1
15 3249 1 1 4 ARG HH12 H 10.231 -6.239 -4.432 1.00 . A A . 4 ARG HH12 1 1
15 3250 1 1 4 ARG HH21 H 11.957 -3.404 -3.269 1.00 . A A . 4 ARG HH21 1 1
15 3251 1 1 4 ARG HH22 H 12.099 -4.922 -4.092 1.00 . A A . 4 ARG HH22 1 1
15 3252 1 1 4 ARG N N 5.864 -1.633 0.533 1.00 . A A . 4 ARG N 1 1
15 3253 1 1 4 ARG NE N 9.462 -3.537 -2.853 1.00 . A A . 4 ARG NE 1 1
15 3254 1 1 4 ARG NH1 N 9.667 -5.553 -3.965 1.00 . A A . 4 ARG NH1 1 1
15 3255 1 1 4 ARG NH2 N 11.528 -4.240 -3.626 1.00 . A A . 4 ARG NH2 1 1
15 3256 1 1 4 ARG O O 2.889 -1.436 -1.204 1.00 . A A . 4 ARG O 1 1
15 3257 1 1 5 GLN C C 1.292 -2.615 1.040 1.00 . A A . 5 GLN C 1 1
15 3258 1 1 5 GLN CA C 2.158 -3.648 0.328 1.00 . A A . 5 GLN CA 1 1
15 3259 1 1 5 GLN CB C 2.194 -4.938 1.144 1.00 . A A . 5 GLN CB 1 1
15 3260 1 1 5 GLN CD C 3.146 -7.259 1.421 1.00 . A A . 5 GLN CD 1 1
15 3261 1 1 5 GLN CG C 3.011 -6.052 0.513 1.00 . A A . 5 GLN CG 1 1
15 3262 1 1 5 GLN H H 4.266 -3.598 0.559 1.00 . A A . 5 GLN H 1 1
15 3263 1 1 5 GLN HA H 1.729 -3.859 -0.638 1.00 . A A . 5 GLN HA 1 1
15 3264 1 1 5 GLN HB2 H 2.618 -4.721 2.114 1.00 . A A . 5 GLN HB2 1 1
15 3265 1 1 5 GLN HB3 H 1.181 -5.294 1.275 1.00 . A A . 5 GLN HB3 1 1
15 3266 1 1 5 GLN HE21 H 3.321 -8.452 -0.149 1.00 . A A . 5 GLN HE21 1 1
15 3267 1 1 5 GLN HE22 H 3.392 -9.219 1.402 1.00 . A A . 5 GLN HE22 1 1
15 3268 1 1 5 GLN HG2 H 2.529 -6.362 -0.403 1.00 . A A . 5 GLN HG2 1 1
15 3269 1 1 5 GLN HG3 H 3.999 -5.674 0.289 1.00 . A A . 5 GLN HG3 1 1
15 3270 1 1 5 GLN N N 3.512 -3.146 0.119 1.00 . A A . 5 GLN N 1 1
15 3271 1 1 5 GLN NE2 N 3.301 -8.423 0.835 1.00 . A A . 5 GLN NE2 1 1
15 3272 1 1 5 GLN O O 0.144 -2.394 0.663 1.00 . A A . 5 GLN O 1 1
15 3273 1 1 5 GLN OE1 O 3.122 -7.136 2.646 1.00 . A A . 5 GLN OE1 1 1
15 3274 1 1 6 ALA C C 0.700 0.206 1.985 1.00 . A A . 6 ALA C 1 1
15 3275 1 1 6 ALA CA C 1.125 -0.986 2.843 1.00 . A A . 6 ALA CA 1 1
15 3276 1 1 6 ALA CB C 1.968 -0.518 4.020 1.00 . A A . 6 ALA CB 1 1
15 3277 1 1 6 ALA H H 2.787 -2.184 2.296 1.00 . A A . 6 ALA H 1 1
15 3278 1 1 6 ALA HA H 0.238 -1.463 3.233 1.00 . A A . 6 ALA HA 1 1
15 3279 1 1 6 ALA HB1 H 2.851 -0.017 3.653 1.00 . A A . 6 ALA HB1 1 1
15 3280 1 1 6 ALA HB2 H 2.259 -1.371 4.614 1.00 . A A . 6 ALA HB2 1 1
15 3281 1 1 6 ALA HB3 H 1.392 0.164 4.627 1.00 . A A . 6 ALA HB3 1 1
15 3282 1 1 6 ALA N N 1.855 -1.978 2.060 1.00 . A A . 6 ALA N 1 1
15 3283 1 1 6 ALA O O -0.440 0.674 2.075 1.00 . A A . 6 ALA O 1 1
15 3284 1 1 7 ARG C C 0.353 1.413 -0.821 1.00 . A A . 7 ARG C 1 1
15 3285 1 1 7 ARG CA C 1.323 1.818 0.271 1.00 . A A . 7 ARG CA 1 1
15 3286 1 1 7 ARG CB C 2.609 2.361 -0.338 1.00 . A A . 7 ARG CB 1 1
15 3287 1 1 7 ARG CD C 4.960 3.121 0.075 1.00 . A A . 7 ARG CD 1 1
15 3288 1 1 7 ARG CG C 3.633 2.750 0.701 1.00 . A A . 7 ARG CG 1 1
15 3289 1 1 7 ARG CZ C 7.300 3.099 0.874 1.00 . A A . 7 ARG CZ 1 1
15 3290 1 1 7 ARG H H 2.502 0.268 1.120 1.00 . A A . 7 ARG H 1 1
15 3291 1 1 7 ARG HA H 0.865 2.590 0.872 1.00 . A A . 7 ARG HA 1 1
15 3292 1 1 7 ARG HB2 H 3.042 1.604 -0.977 1.00 . A A . 7 ARG HB2 1 1
15 3293 1 1 7 ARG HB3 H 2.377 3.234 -0.930 1.00 . A A . 7 ARG HB3 1 1
15 3294 1 1 7 ARG HD2 H 5.258 2.333 -0.601 1.00 . A A . 7 ARG HD2 1 1
15 3295 1 1 7 ARG HD3 H 4.843 4.043 -0.475 1.00 . A A . 7 ARG HD3 1 1
15 3296 1 1 7 ARG HE H 5.696 3.569 1.986 1.00 . A A . 7 ARG HE 1 1
15 3297 1 1 7 ARG HG2 H 3.261 3.592 1.266 1.00 . A A . 7 ARG HG2 1 1
15 3298 1 1 7 ARG HG3 H 3.774 1.904 1.356 1.00 . A A . 7 ARG HG3 1 1
15 3299 1 1 7 ARG HH11 H 7.085 2.621 -1.087 1.00 . A A . 7 ARG HH11 1 1
15 3300 1 1 7 ARG HH12 H 8.708 2.580 -0.490 1.00 . A A . 7 ARG HH12 1 1
15 3301 1 1 7 ARG HH21 H 7.859 3.510 2.784 1.00 . A A . 7 ARG HH21 1 1
15 3302 1 1 7 ARG HH22 H 9.149 3.097 1.706 1.00 . A A . 7 ARG HH22 1 1
15 3303 1 1 7 ARG N N 1.610 0.684 1.147 1.00 . A A . 7 ARG N 1 1
15 3304 1 1 7 ARG NE N 6.000 3.299 1.088 1.00 . A A . 7 ARG NE 1 1
15 3305 1 1 7 ARG NH1 N 7.730 2.743 -0.328 1.00 . A A . 7 ARG NH1 1 1
15 3306 1 1 7 ARG NH2 N 8.169 3.249 1.867 1.00 . A A . 7 ARG NH2 1 1
15 3307 1 1 7 ARG O O -0.531 2.185 -1.199 1.00 . A A . 7 ARG O 1 1
15 3308 1 1 8 ALA C C -1.781 -0.495 -1.811 1.00 . A A . 8 ALA C 1 1
15 3309 1 1 8 ALA CA C -0.365 -0.335 -2.349 1.00 . A A . 8 ALA CA 1 1
15 3310 1 1 8 ALA CB C 0.159 -1.663 -2.870 1.00 . A A . 8 ALA CB 1 1
15 3311 1 1 8 ALA H H 1.263 -0.353 -0.984 1.00 . A A . 8 ALA H 1 1
15 3312 1 1 8 ALA HA H -0.382 0.371 -3.167 1.00 . A A . 8 ALA HA 1 1
15 3313 1 1 8 ALA HB1 H 1.162 -1.528 -3.247 1.00 . A A . 8 ALA HB1 1 1
15 3314 1 1 8 ALA HB2 H -0.481 -2.016 -3.664 1.00 . A A . 8 ALA HB2 1 1
15 3315 1 1 8 ALA HB3 H 0.171 -2.385 -2.068 1.00 . A A . 8 ALA HB3 1 1
15 3316 1 1 8 ALA N N 0.517 0.198 -1.318 1.00 . A A . 8 ALA N 1 1
15 3317 1 1 8 ALA O O -2.758 -0.209 -2.509 1.00 . A A . 8 ALA O 1 1
15 3318 1 1 9 ALA C C -3.859 0.251 0.210 1.00 . A A . 9 ALA C 1 1
15 3319 1 1 9 ALA CA C -3.170 -1.096 0.096 1.00 . A A . 9 ALA CA 1 1
15 3320 1 1 9 ALA CB C -2.990 -1.718 1.475 1.00 . A A . 9 ALA CB 1 1
15 3321 1 1 9 ALA H H -1.066 -1.194 -0.076 1.00 . A A . 9 ALA H 1 1
15 3322 1 1 9 ALA HA H -3.781 -1.757 -0.502 1.00 . A A . 9 ALA HA 1 1
15 3323 1 1 9 ALA HB1 H -2.502 -2.676 1.377 1.00 . A A . 9 ALA HB1 1 1
15 3324 1 1 9 ALA HB2 H -3.956 -1.850 1.940 1.00 . A A . 9 ALA HB2 1 1
15 3325 1 1 9 ALA HB3 H -2.384 -1.066 2.087 1.00 . A A . 9 ALA HB3 1 1
15 3326 1 1 9 ALA N N -1.883 -0.943 -0.562 1.00 . A A . 9 ALA N 1 1
15 3327 1 1 9 ALA O O -5.049 0.380 -0.074 1.00 . A A . 9 ALA O 1 1
15 3328 1 1 10 ARG C C -4.066 3.135 -0.615 1.00 . A A . 10 ARG C 1 1
15 3329 1 1 10 ARG CA C -3.597 2.611 0.739 1.00 . A A . 10 ARG CA 1 1
15 3330 1 1 10 ARG CB C -2.502 3.518 1.294 1.00 . A A . 10 ARG CB 1 1
15 3331 1 1 10 ARG CD C -1.785 5.813 1.982 1.00 . A A . 10 ARG CD 1 1
15 3332 1 1 10 ARG CG C -2.934 4.955 1.490 1.00 . A A . 10 ARG CG 1 1
15 3333 1 1 10 ARG CZ C 0.617 6.020 1.419 1.00 . A A . 10 ARG CZ 1 1
15 3334 1 1 10 ARG H H -2.158 1.082 0.846 1.00 . A A . 10 ARG H 1 1
15 3335 1 1 10 ARG HA H -4.429 2.602 1.425 1.00 . A A . 10 ARG HA 1 1
15 3336 1 1 10 ARG HB2 H -2.178 3.132 2.248 1.00 . A A . 10 ARG HB2 1 1
15 3337 1 1 10 ARG HB3 H -1.664 3.508 0.612 1.00 . A A . 10 ARG HB3 1 1
15 3338 1 1 10 ARG HD2 H -2.129 6.832 2.081 1.00 . A A . 10 ARG HD2 1 1
15 3339 1 1 10 ARG HD3 H -1.466 5.445 2.946 1.00 . A A . 10 ARG HD3 1 1
15 3340 1 1 10 ARG HE H -0.836 5.565 0.121 1.00 . A A . 10 ARG HE 1 1
15 3341 1 1 10 ARG HG2 H -3.291 5.347 0.549 1.00 . A A . 10 ARG HG2 1 1
15 3342 1 1 10 ARG HG3 H -3.728 4.971 2.219 1.00 . A A . 10 ARG HG3 1 1
15 3343 1 1 10 ARG HH11 H 0.182 6.410 3.359 1.00 . A A . 10 ARG HH11 1 1
15 3344 1 1 10 ARG HH12 H 1.856 6.510 2.945 1.00 . A A . 10 ARG HH12 1 1
15 3345 1 1 10 ARG HH21 H 1.375 5.709 -0.434 1.00 . A A . 10 ARG HH21 1 1
15 3346 1 1 10 ARG HH22 H 2.541 6.112 0.783 1.00 . A A . 10 ARG HH22 1 1
15 3347 1 1 10 ARG N N -3.094 1.257 0.614 1.00 . A A . 10 ARG N 1 1
15 3348 1 1 10 ARG NE N -0.645 5.783 1.060 1.00 . A A . 10 ARG NE 1 1
15 3349 1 1 10 ARG NH1 N 0.905 6.340 2.669 1.00 . A A . 10 ARG NH1 1 1
15 3350 1 1 10 ARG NH2 N 1.586 5.943 0.520 1.00 . A A . 10 ARG NH2 1 1
15 3351 1 1 10 ARG O O -5.079 3.820 -0.711 1.00 . A A . 10 ARG O 1 1
15 3352 1 1 11 ALA C C -4.946 2.603 -3.482 1.00 . A A . 11 ALA C 1 1
15 3353 1 1 11 ALA CA C -3.649 3.239 -2.999 1.00 . A A . 11 ALA CA 1 1
15 3354 1 1 11 ALA CB C -2.516 2.896 -3.946 1.00 . A A . 11 ALA CB 1 1
15 3355 1 1 11 ALA H H -2.522 2.251 -1.512 1.00 . A A . 11 ALA H 1 1
15 3356 1 1 11 ALA HA H -3.766 4.312 -2.986 1.00 . A A . 11 ALA HA 1 1
15 3357 1 1 11 ALA HB1 H -2.755 3.247 -4.938 1.00 . A A . 11 ALA HB1 1 1
15 3358 1 1 11 ALA HB2 H -2.376 1.825 -3.965 1.00 . A A . 11 ALA HB2 1 1
15 3359 1 1 11 ALA HB3 H -1.607 3.370 -3.605 1.00 . A A . 11 ALA HB3 1 1
15 3360 1 1 11 ALA N N -3.321 2.804 -1.654 1.00 . A A . 11 ALA N 1 1
15 3361 1 1 11 ALA O O -5.821 3.285 -4.020 1.00 . A A . 11 ALA O 1 1
15 3362 1 1 12 ALA C C -7.473 0.911 -2.878 1.00 . A A . 12 ALA C 1 1
15 3363 1 1 12 ALA CA C -6.243 0.567 -3.712 1.00 . A A . 12 ALA CA 1 1
15 3364 1 1 12 ALA CB C -5.969 -0.924 -3.663 1.00 . A A . 12 ALA CB 1 1
15 3365 1 1 12 ALA H H -4.348 0.824 -2.810 1.00 . A A . 12 ALA H 1 1
15 3366 1 1 12 ALA HA H -6.435 0.837 -4.739 1.00 . A A . 12 ALA HA 1 1
15 3367 1 1 12 ALA HB1 H -5.089 -1.149 -4.249 1.00 . A A . 12 ALA HB1 1 1
15 3368 1 1 12 ALA HB2 H -6.817 -1.457 -4.066 1.00 . A A . 12 ALA HB2 1 1
15 3369 1 1 12 ALA HB3 H -5.808 -1.228 -2.639 1.00 . A A . 12 ALA HB3 1 1
15 3370 1 1 12 ALA N N -5.071 1.304 -3.271 1.00 . A A . 12 ALA N 1 1
15 3371 1 1 12 ALA O O -8.582 1.016 -3.406 1.00 . A A . 12 ALA O 1 1
15 3372 1 1 13 DAL C C -8.634 0.312 0.300 1.00 . A A . 13 DAL C 1 1
15 3373 1 1 13 DAL CA C -8.378 1.435 -0.697 1.00 . A A . 13 DAL CA 1 1
15 3374 1 1 13 DAL CB C -8.098 2.739 0.031 1.00 . A A . 13 DAL CB 1 1
15 3375 1 1 13 DAL H H -6.369 1.019 -1.220 1.00 . A A . 13 DAL H 1 1
15 3376 1 1 13 DAL HA H -9.264 1.571 -1.302 1.00 . A A . 13 DAL HA 1 1
15 3377 1 1 13 DAL HB1 H -7.215 2.626 0.642 1.00 . A A . 13 DAL HB1 1 1
15 3378 1 1 13 DAL HB2 H -8.940 2.989 0.658 1.00 . A A . 13 DAL HB2 1 1
15 3379 1 1 13 DAL HB3 H -7.937 3.528 -0.690 1.00 . A A . 13 DAL HB3 1 1
15 3380 1 1 13 DAL N N -7.277 1.104 -1.588 1.00 . A A . 13 DAL N 1 1
15 3381 1 1 13 DAL O O -9.724 0.203 0.863 1.00 . A A . 13 DAL O 1 1
15 3382 1 1 14 CYS C C -7.431 -1.154 2.866 1.00 . A A . 14 CYS C 1 1
15 3383 1 1 14 CYS CA C -7.736 -1.624 1.446 1.00 . A A . 14 CYS CA 1 1
15 3384 1 1 14 CYS CB C -6.781 -2.749 1.042 1.00 . A A . 14 CYS CB 1 1
15 3385 1 1 14 CYS H H -6.788 -0.396 0.022 1.00 . A A . 14 CYS H 1 1
15 3386 1 1 14 CYS HA H -8.749 -1.992 1.412 1.00 . A A . 14 CYS HA 1 1
15 3387 1 1 14 CYS HB2 H -5.928 -2.733 1.703 1.00 . A A . 14 CYS HB2 1 1
15 3388 1 1 14 CYS HB3 H -7.290 -3.695 1.151 1.00 . A A . 14 CYS HB3 1 1
15 3389 1 1 14 CYS N N -7.630 -0.520 0.510 1.00 . A A . 14 CYS N 1 1
15 3390 1 1 14 CYS O O -6.291 -1.246 3.336 1.00 . A A . 14 CYS O 1 1
15 3391 1 1 14 CYS SG S -6.181 -2.624 -0.654 1.00 . A A . 14 CYS SG 1 1
15 3392 1 1 15 NH2 HN1 H -8.565 -0.935 4.469 1.00 . A A . 15 NH2 HN1 1 1
15 3393 1 1 15 NH2 HN2 H -9.127 -0.156 3.037 1.00 . A A . 15 NH2 HN2 1 1
15 3394 1 1 15 NH2 N N -8.440 -0.642 3.543 1.00 . A A . 15 NH2 N 1 1
15 3395 2 2 1 . CB1 C -1.076 -5.513 4.786 1.00 . B A . 101 B0I CB1 1 1
15 3396 2 2 1 . CB2 C -5.734 -4.338 -0.983 1.00 . B A . 101 B0I CB2 1 1
15 3397 2 2 1 . CD1 C -1.653 -5.502 2.373 1.00 . B A . 101 B0I CD1 1 1
15 3398 2 2 1 . CD2 C -0.446 -7.363 3.218 1.00 . B A . 101 B0I CD2 1 1
15 3399 2 2 1 . CD3 C -3.627 -5.211 0.058 1.00 . B A . 101 B0I CD3 1 1
15 3400 2 2 1 . CD4 C -3.477 -4.100 -2.044 1.00 . B A . 101 B0I CD4 1 1
15 3401 2 2 1 . CE1 C -1.650 -6.066 1.110 1.00 . B A . 101 B0I CE1 1 1
15 3402 2 2 1 . CE2 C -0.435 -7.938 1.962 1.00 . B A . 101 B0I CE2 1 1
15 3403 2 2 1 . CE3 C -2.258 -5.409 0.055 1.00 . B A . 101 B0I CE3 1 1
15 3404 2 2 1 . CE4 C -2.111 -4.296 -2.053 1.00 . B A . 101 B0I CE4 1 1
15 3405 2 2 1 . CG1 C -1.057 -6.138 3.429 1.00 . B A . 101 B0I CG1 1 1
15 3406 2 2 1 . CG2 C -4.249 -4.555 -0.990 1.00 . B A . 101 B0I CG2 1 1
15 3407 2 2 1 . CZ1 C -1.039 -7.288 0.906 1.00 . B A . 101 B0I CZ1 1 1
15 3408 2 2 1 . CZ2 C -1.499 -4.950 -1.004 1.00 . B A . 101 B0I CZ2 1 1
15 3409 2 2 1 . H1 H -0.685 -6.227 5.484 1.00 . B A . 101 B0I H1 1 1
15 3410 2 2 1 . H2 H -6.165 -4.965 -0.220 1.00 . B A . 101 B0I H2 1 1
15 3411 2 2 1 . HB11 H -2.100 -5.283 5.040 1.00 . B A . 101 B0I HB11 1 1
15 3412 2 2 1 . HB21 H -6.123 -4.623 -1.949 1.00 . B A . 101 B0I HB21 1 1
15 3413 2 2 1 . HD1 H -2.124 -4.552 2.552 1.00 . B A . 101 B0I HD1 1 1
15 3414 2 2 1 . HD2 H 0.025 -7.870 4.046 1.00 . B A . 101 B0I HD2 1 1
15 3415 2 2 1 . HD3 H -4.220 -5.569 0.885 1.00 . B A . 101 B0I HD3 1 1
15 3416 2 2 1 . HD4 H -3.952 -3.588 -2.866 1.00 . B A . 101 B0I HD4 1 1
15 3417 2 2 1 . HE2 H 0.045 -8.894 1.808 1.00 . B A . 101 B0I HE2 1 1
15 3418 2 2 1 . HE4 H -1.520 -3.936 -2.883 1.00 . B A . 101 B0I HE4 1 1
15 3419 2 2 1 . HZ1 H -1.033 -7.732 -0.078 1.00 . B A . 101 B0I HZ1 1 1
15 3420 2 2 1 . HZ2 H -0.431 -5.103 -1.008 1.00 . B A . 101 B0I HZ2 1 1
16 3421 1 1 1 . C C 5.018 -4.116 4.419 1.00 . A A . 1 H00 C 1 1
16 3422 1 1 1 . CA C 4.165 -5.369 4.378 1.00 . A A . 1 H00 CA 1 1
16 3423 1 1 1 . CB C 2.765 -5.072 4.896 1.00 . A A . 1 H00 CB 1 1
16 3424 1 1 1 . CG C 1.959 -4.266 3.887 1.00 . A A . 1 H00 CG 1 1
16 3425 1 1 1 . HA1 H 4.617 -6.129 4.999 1.00 . A A . 1 H00 HA1 1 1
16 3426 1 1 1 . HA2 H 4.101 -5.725 3.359 1.00 . A A . 1 H00 HA2 1 1
16 3427 1 1 1 . HB1 H 2.844 -4.507 5.814 1.00 . A A . 1 H00 HB1 1 1
16 3428 1 1 1 . HB2 H 2.254 -6.004 5.086 1.00 . A A . 1 H00 HB2 1 1
16 3429 1 1 1 . HG1 H 2.205 -4.612 2.893 1.00 . A A . 1 H00 HG1 1 1
16 3430 1 1 1 . HG2 H 2.228 -3.224 3.982 1.00 . A A . 1 H00 HG2 1 1
16 3431 1 1 1 . O O 5.186 -3.504 5.477 1.00 . A A . 1 H00 O 1 1
16 3432 1 1 1 . SD S 0.176 -4.425 4.130 1.00 . A A . 1 H00 SD 1 1
16 3433 1 1 2 THR C C 5.505 -1.297 3.124 1.00 . A A . 2 THR C 1 1
16 3434 1 1 2 THR CA C 6.386 -2.546 3.186 1.00 . A A . 2 THR CA 1 1
16 3435 1 1 2 THR CB C 7.277 -2.591 1.924 1.00 . A A . 2 THR CB 1 1
16 3436 1 1 2 THR CG2 C 8.121 -3.858 1.904 1.00 . A A . 2 THR CG2 1 1
16 3437 1 1 2 THR H H 5.390 -4.260 2.462 1.00 . A A . 2 THR H 1 1
16 3438 1 1 2 THR HA H 7.018 -2.502 4.060 1.00 . A A . 2 THR HA 1 1
16 3439 1 1 2 THR HB H 7.933 -1.733 1.930 1.00 . A A . 2 THR HB 1 1
16 3440 1 1 2 THR HG1 H 6.937 -2.925 0.003 1.00 . A A . 2 THR HG1 1 1
16 3441 1 1 2 THR HG21 H 8.763 -3.878 2.772 1.00 . A A . 2 THR HG21 1 1
16 3442 1 1 2 THR HG22 H 8.724 -3.874 1.008 1.00 . A A . 2 THR HG22 1 1
16 3443 1 1 2 THR HG23 H 7.473 -4.722 1.916 1.00 . A A . 2 THR HG23 1 1
16 3444 1 1 2 THR N N 5.557 -3.733 3.275 1.00 . A A . 2 THR N 1 1
16 3445 1 1 2 THR O O 4.308 -1.396 2.835 1.00 . A A . 2 THR O 1 1
16 3446 1 1 2 THR OG1 O 6.455 -2.546 0.751 1.00 . A A . 2 THR OG1 1 1
16 3447 1 1 3 PRO C C 4.723 1.347 1.916 1.00 . A A . 3 PRO C 1 1
16 3448 1 1 3 PRO CA C 5.331 1.162 3.306 1.00 . A A . 3 PRO CA 1 1
16 3449 1 1 3 PRO CB C 6.402 2.228 3.561 1.00 . A A . 3 PRO CB 1 1
16 3450 1 1 3 PRO CD C 7.466 0.111 3.844 1.00 . A A . 3 PRO CD 1 1
16 3451 1 1 3 PRO CG C 7.452 1.526 4.346 1.00 . A A . 3 PRO CG 1 1
16 3452 1 1 3 PRO HA H 4.556 1.226 4.055 1.00 . A A . 3 PRO HA 1 1
16 3453 1 1 3 PRO HB2 H 6.786 2.586 2.616 1.00 . A A . 3 PRO HB2 1 1
16 3454 1 1 3 PRO HB3 H 5.974 3.048 4.119 1.00 . A A . 3 PRO HB3 1 1
16 3455 1 1 3 PRO HD2 H 8.157 0.012 3.020 1.00 . A A . 3 PRO HD2 1 1
16 3456 1 1 3 PRO HD3 H 7.724 -0.571 4.641 1.00 . A A . 3 PRO HD3 1 1
16 3457 1 1 3 PRO HG2 H 8.411 1.993 4.177 1.00 . A A . 3 PRO HG2 1 1
16 3458 1 1 3 PRO HG3 H 7.201 1.547 5.396 1.00 . A A . 3 PRO HG3 1 1
16 3459 1 1 3 PRO N N 6.075 -0.101 3.397 1.00 . A A . 3 PRO N 1 1
16 3460 1 1 3 PRO O O 3.640 1.920 1.769 1.00 . A A . 3 PRO O 1 1
16 3461 1 1 4 ARG C C 3.733 0.056 -0.676 1.00 . A A . 4 ARG C 1 1
16 3462 1 1 4 ARG CA C 4.975 0.915 -0.481 1.00 . A A . 4 ARG CA 1 1
16 3463 1 1 4 ARG CB C 6.078 0.434 -1.426 1.00 . A A . 4 ARG CB 1 1
16 3464 1 1 4 ARG CD C 8.460 0.584 -2.187 1.00 . A A . 4 ARG CD 1 1
16 3465 1 1 4 ARG CG C 7.421 1.108 -1.210 1.00 . A A . 4 ARG CG 1 1
16 3466 1 1 4 ARG CZ C 10.834 0.968 -2.772 1.00 . A A . 4 ARG CZ 1 1
16 3467 1 1 4 ARG H H 6.270 0.382 1.108 1.00 . A A . 4 ARG H 1 1
16 3468 1 1 4 ARG HA H 4.738 1.944 -0.703 1.00 . A A . 4 ARG HA 1 1
16 3469 1 1 4 ARG HB2 H 6.210 -0.628 -1.290 1.00 . A A . 4 ARG HB2 1 1
16 3470 1 1 4 ARG HB3 H 5.767 0.619 -2.443 1.00 . A A . 4 ARG HB3 1 1
16 3471 1 1 4 ARG HD2 H 8.552 -0.484 -2.054 1.00 . A A . 4 ARG HD2 1 1
16 3472 1 1 4 ARG HD3 H 8.125 0.790 -3.192 1.00 . A A . 4 ARG HD3 1 1
16 3473 1 1 4 ARG HE H 9.869 1.808 -1.222 1.00 . A A . 4 ARG HE 1 1
16 3474 1 1 4 ARG HG2 H 7.309 2.174 -1.346 1.00 . A A . 4 ARG HG2 1 1
16 3475 1 1 4 ARG HG3 H 7.749 0.902 -0.202 1.00 . A A . 4 ARG HG3 1 1
16 3476 1 1 4 ARG HH11 H 9.848 -0.278 -4.044 1.00 . A A . 4 ARG HH11 1 1
16 3477 1 1 4 ARG HH12 H 11.515 -0.013 -4.420 1.00 . A A . 4 ARG HH12 1 1
16 3478 1 1 4 ARG HH21 H 12.095 2.166 -1.718 1.00 . A A . 4 ARG HH21 1 1
16 3479 1 1 4 ARG HH22 H 12.805 1.374 -3.078 1.00 . A A . 4 ARG HH22 1 1
16 3480 1 1 4 ARG N N 5.425 0.834 0.905 1.00 . A A . 4 ARG N 1 1
16 3481 1 1 4 ARG NE N 9.774 1.197 -1.989 1.00 . A A . 4 ARG NE 1 1
16 3482 1 1 4 ARG NH1 N 10.723 0.163 -3.827 1.00 . A A . 4 ARG NH1 1 1
16 3483 1 1 4 ARG NH2 N 11.998 1.549 -2.504 1.00 . A A . 4 ARG NH2 1 1
16 3484 1 1 4 ARG O O 2.741 0.495 -1.260 1.00 . A A . 4 ARG O 1 1
16 3485 1 1 5 GLN C C 1.500 -1.607 0.550 1.00 . A A . 5 GLN C 1 1
16 3486 1 1 5 GLN CA C 2.678 -2.103 -0.268 1.00 . A A . 5 GLN CA 1 1
16 3487 1 1 5 GLN CB C 3.098 -3.490 0.202 1.00 . A A . 5 GLN CB 1 1
16 3488 1 1 5 GLN CD C 4.651 -5.439 -0.142 1.00 . A A . 5 GLN CD 1 1
16 3489 1 1 5 GLN CG C 4.064 -4.183 -0.739 1.00 . A A . 5 GLN CG 1 1
16 3490 1 1 5 GLN H H 4.628 -1.463 0.264 1.00 . A A . 5 GLN H 1 1
16 3491 1 1 5 GLN HA H 2.380 -2.161 -1.304 1.00 . A A . 5 GLN HA 1 1
16 3492 1 1 5 GLN HB2 H 3.573 -3.400 1.168 1.00 . A A . 5 GLN HB2 1 1
16 3493 1 1 5 GLN HB3 H 2.216 -4.107 0.297 1.00 . A A . 5 GLN HB3 1 1
16 3494 1 1 5 GLN HE21 H 4.744 -6.269 -1.937 1.00 . A A . 5 GLN HE21 1 1
16 3495 1 1 5 GLN HE22 H 5.319 -7.241 -0.621 1.00 . A A . 5 GLN HE22 1 1
16 3496 1 1 5 GLN HG2 H 3.541 -4.444 -1.646 1.00 . A A . 5 GLN HG2 1 1
16 3497 1 1 5 GLN HG3 H 4.868 -3.500 -0.972 1.00 . A A . 5 GLN HG3 1 1
16 3498 1 1 5 GLN N N 3.798 -1.173 -0.178 1.00 . A A . 5 GLN N 1 1
16 3499 1 1 5 GLN NE2 N 4.933 -6.413 -0.981 1.00 . A A . 5 GLN NE2 1 1
16 3500 1 1 5 GLN O O 0.356 -1.715 0.125 1.00 . A A . 5 GLN O 1 1
16 3501 1 1 5 GLN OE1 O 4.840 -5.535 1.073 1.00 . A A . 5 GLN OE1 1 1
16 3502 1 1 6 ALA C C 0.051 0.648 1.888 1.00 . A A . 6 ALA C 1 1
16 3503 1 1 6 ALA CA C 0.761 -0.504 2.586 1.00 . A A . 6 ALA CA 1 1
16 3504 1 1 6 ALA CB C 1.368 -0.035 3.899 1.00 . A A . 6 ALA CB 1 1
16 3505 1 1 6 ALA H H 2.728 -1.041 2.021 1.00 . A A . 6 ALA H 1 1
16 3506 1 1 6 ALA HA H 0.044 -1.284 2.798 1.00 . A A . 6 ALA HA 1 1
16 3507 1 1 6 ALA HB1 H 1.852 -0.866 4.390 1.00 . A A . 6 ALA HB1 1 1
16 3508 1 1 6 ALA HB2 H 0.589 0.357 4.536 1.00 . A A . 6 ALA HB2 1 1
16 3509 1 1 6 ALA HB3 H 2.095 0.739 3.702 1.00 . A A . 6 ALA HB3 1 1
16 3510 1 1 6 ALA N N 1.791 -1.059 1.722 1.00 . A A . 6 ALA N 1 1
16 3511 1 1 6 ALA O O -1.169 0.776 1.961 1.00 . A A . 6 ALA O 1 1
16 3512 1 1 7 ARG C C -0.642 2.113 -0.621 1.00 . A A . 7 ARG C 1 1
16 3513 1 1 7 ARG CA C 0.301 2.595 0.466 1.00 . A A . 7 ARG CA 1 1
16 3514 1 1 7 ARG CB C 1.447 3.338 -0.173 1.00 . A A . 7 ARG CB 1 1
16 3515 1 1 7 ARG CD C 2.173 5.302 -1.502 1.00 . A A . 7 ARG CD 1 1
16 3516 1 1 7 ARG CG C 1.009 4.563 -0.882 1.00 . A A . 7 ARG CG 1 1
16 3517 1 1 7 ARG CZ C 4.030 4.396 -2.868 1.00 . A A . 7 ARG CZ 1 1
16 3518 1 1 7 ARG H H 1.797 1.349 1.196 1.00 . A A . 7 ARG H 1 1
16 3519 1 1 7 ARG HA H -0.218 3.255 1.143 1.00 . A A . 7 ARG HA 1 1
16 3520 1 1 7 ARG HB2 H 2.156 3.618 0.592 1.00 . A A . 7 ARG HB2 1 1
16 3521 1 1 7 ARG HB3 H 1.934 2.687 -0.885 1.00 . A A . 7 ARG HB3 1 1
16 3522 1 1 7 ARG HD2 H 1.832 6.267 -1.847 1.00 . A A . 7 ARG HD2 1 1
16 3523 1 1 7 ARG HD3 H 2.940 5.436 -0.753 1.00 . A A . 7 ARG HD3 1 1
16 3524 1 1 7 ARG HE H 2.080 4.162 -3.250 1.00 . A A . 7 ARG HE 1 1
16 3525 1 1 7 ARG HG2 H 0.303 4.286 -1.652 1.00 . A A . 7 ARG HG2 1 1
16 3526 1 1 7 ARG HG3 H 0.529 5.164 -0.146 1.00 . A A . 7 ARG HG3 1 1
16 3527 1 1 7 ARG HH11 H 4.660 5.432 -1.237 1.00 . A A . 7 ARG HH11 1 1
16 3528 1 1 7 ARG HH12 H 5.917 4.783 -2.232 1.00 . A A . 7 ARG HH12 1 1
16 3529 1 1 7 ARG HH21 H 3.740 3.316 -4.559 1.00 . A A . 7 ARG HH21 1 1
16 3530 1 1 7 ARG HH22 H 5.394 3.587 -4.130 1.00 . A A . 7 ARG HH22 1 1
16 3531 1 1 7 ARG N N 0.828 1.479 1.202 1.00 . A A . 7 ARG N 1 1
16 3532 1 1 7 ARG NE N 2.731 4.560 -2.628 1.00 . A A . 7 ARG NE 1 1
16 3533 1 1 7 ARG NH1 N 4.938 4.911 -2.047 1.00 . A A . 7 ARG NH1 1 1
16 3534 1 1 7 ARG NH2 N 4.418 3.711 -3.933 1.00 . A A . 7 ARG NH2 1 1
16 3535 1 1 7 ARG O O -1.771 2.588 -0.746 1.00 . A A . 7 ARG O 1 1
16 3536 1 1 8 ALA C C -2.184 -0.118 -1.923 1.00 . A A . 8 ALA C 1 1
16 3537 1 1 8 ALA CA C -0.922 0.551 -2.467 1.00 . A A . 8 ALA CA 1 1
16 3538 1 1 8 ALA CB C -0.062 -0.460 -3.210 1.00 . A A . 8 ALA CB 1 1
16 3539 1 1 8 ALA H H 0.781 0.921 -1.250 1.00 . A A . 8 ALA H 1 1
16 3540 1 1 8 ALA HA H -1.211 1.326 -3.162 1.00 . A A . 8 ALA HA 1 1
16 3541 1 1 8 ALA HB1 H 0.218 -1.257 -2.537 1.00 . A A . 8 ALA HB1 1 1
16 3542 1 1 8 ALA HB2 H 0.829 0.028 -3.579 1.00 . A A . 8 ALA HB2 1 1
16 3543 1 1 8 ALA HB3 H -0.618 -0.868 -4.039 1.00 . A A . 8 ALA HB3 1 1
16 3544 1 1 8 ALA N N -0.154 1.174 -1.394 1.00 . A A . 8 ALA N 1 1
16 3545 1 1 8 ALA O O -3.255 -0.020 -2.521 1.00 . A A . 8 ALA O 1 1
16 3546 1 1 9 ALA C C -4.230 -0.417 0.260 1.00 . A A . 9 ALA C 1 1
16 3547 1 1 9 ALA CA C -3.177 -1.441 -0.136 1.00 . A A . 9 ALA CA 1 1
16 3548 1 1 9 ALA CB C -2.707 -2.215 1.086 1.00 . A A . 9 ALA CB 1 1
16 3549 1 1 9 ALA H H -1.157 -0.859 -0.375 1.00 . A A . 9 ALA H 1 1
16 3550 1 1 9 ALA HA H -3.610 -2.139 -0.838 1.00 . A A . 9 ALA HA 1 1
16 3551 1 1 9 ALA HB1 H -3.548 -2.718 1.539 1.00 . A A . 9 ALA HB1 1 1
16 3552 1 1 9 ALA HB2 H -2.269 -1.532 1.798 1.00 . A A . 9 ALA HB2 1 1
16 3553 1 1 9 ALA HB3 H -1.969 -2.945 0.788 1.00 . A A . 9 ALA HB3 1 1
16 3554 1 1 9 ALA N N -2.049 -0.788 -0.785 1.00 . A A . 9 ALA N 1 1
16 3555 1 1 9 ALA O O -5.426 -0.652 0.125 1.00 . A A . 9 ALA O 1 1
16 3556 1 1 10 ARG C C -5.293 2.463 -0.083 1.00 . A A . 10 ARG C 1 1
16 3557 1 1 10 ARG CA C -4.671 1.794 1.137 1.00 . A A . 10 ARG CA 1 1
16 3558 1 1 10 ARG CB C -3.930 2.816 1.987 1.00 . A A . 10 ARG CB 1 1
16 3559 1 1 10 ARG CD C -2.788 3.349 4.151 1.00 . A A . 10 ARG CD 1 1
16 3560 1 1 10 ARG CG C -3.541 2.298 3.360 1.00 . A A . 10 ARG CG 1 1
16 3561 1 1 10 ARG CZ C -3.119 5.678 4.906 1.00 . A A . 10 ARG CZ 1 1
16 3562 1 1 10 ARG H H -2.805 0.844 0.839 1.00 . A A . 10 ARG H 1 1
16 3563 1 1 10 ARG HA H -5.461 1.357 1.729 1.00 . A A . 10 ARG HA 1 1
16 3564 1 1 10 ARG HB2 H -3.028 3.108 1.468 1.00 . A A . 10 ARG HB2 1 1
16 3565 1 1 10 ARG HB3 H -4.555 3.684 2.115 1.00 . A A . 10 ARG HB3 1 1
16 3566 1 1 10 ARG HD2 H -2.557 2.952 5.128 1.00 . A A . 10 ARG HD2 1 1
16 3567 1 1 10 ARG HD3 H -1.870 3.583 3.632 1.00 . A A . 10 ARG HD3 1 1
16 3568 1 1 10 ARG HE H -4.481 4.574 3.938 1.00 . A A . 10 ARG HE 1 1
16 3569 1 1 10 ARG HG2 H -4.436 2.028 3.900 1.00 . A A . 10 ARG HG2 1 1
16 3570 1 1 10 ARG HG3 H -2.912 1.428 3.242 1.00 . A A . 10 ARG HG3 1 1
16 3571 1 1 10 ARG HH11 H -1.315 4.888 5.386 1.00 . A A . 10 ARG HH11 1 1
16 3572 1 1 10 ARG HH12 H -1.556 6.525 5.887 1.00 . A A . 10 ARG HH12 1 1
16 3573 1 1 10 ARG HH21 H -4.812 6.752 4.584 1.00 . A A . 10 ARG HH21 1 1
16 3574 1 1 10 ARG HH22 H -3.560 7.587 5.433 1.00 . A A . 10 ARG HH22 1 1
16 3575 1 1 10 ARG N N -3.776 0.722 0.741 1.00 . A A . 10 ARG N 1 1
16 3576 1 1 10 ARG NE N -3.568 4.577 4.309 1.00 . A A . 10 ARG NE 1 1
16 3577 1 1 10 ARG NH1 N -1.903 5.699 5.433 1.00 . A A . 10 ARG NH1 1 1
16 3578 1 1 10 ARG NH2 N -3.889 6.754 4.978 1.00 . A A . 10 ARG NH2 1 1
16 3579 1 1 10 ARG O O -6.442 2.894 -0.046 1.00 . A A . 10 ARG O 1 1
16 3580 1 1 11 ALA C C -6.092 2.258 -3.025 1.00 . A A . 11 ALA C 1 1
16 3581 1 1 11 ALA CA C -5.011 3.132 -2.399 1.00 . A A . 11 ALA CA 1 1
16 3582 1 1 11 ALA CB C -3.863 3.332 -3.373 1.00 . A A . 11 ALA CB 1 1
16 3583 1 1 11 ALA H H -3.599 2.227 -1.109 1.00 . A A . 11 ALA H 1 1
16 3584 1 1 11 ALA HA H -5.433 4.100 -2.170 1.00 . A A . 11 ALA HA 1 1
16 3585 1 1 11 ALA HB1 H -4.227 3.824 -4.264 1.00 . A A . 11 ALA HB1 1 1
16 3586 1 1 11 ALA HB2 H -3.445 2.372 -3.637 1.00 . A A . 11 ALA HB2 1 1
16 3587 1 1 11 ALA HB3 H -3.101 3.942 -2.911 1.00 . A A . 11 ALA HB3 1 1
16 3588 1 1 11 ALA N N -4.526 2.551 -1.156 1.00 . A A . 11 ALA N 1 1
16 3589 1 1 11 ALA O O -7.042 2.759 -3.622 1.00 . A A . 11 ALA O 1 1
16 3590 1 1 12 ALA C C -8.089 -0.185 -2.500 1.00 . A A . 12 ALA C 1 1
16 3591 1 1 12 ALA CA C -6.895 0.001 -3.433 1.00 . A A . 12 ALA CA 1 1
16 3592 1 1 12 ALA CB C -6.221 -1.331 -3.709 1.00 . A A . 12 ALA CB 1 1
16 3593 1 1 12 ALA H H -5.147 0.611 -2.408 1.00 . A A . 12 ALA H 1 1
16 3594 1 1 12 ALA HA H -7.249 0.401 -4.371 1.00 . A A . 12 ALA HA 1 1
16 3595 1 1 12 ALA HB1 H -6.931 -2.004 -4.167 1.00 . A A . 12 ALA HB1 1 1
16 3596 1 1 12 ALA HB2 H -5.870 -1.756 -2.780 1.00 . A A . 12 ALA HB2 1 1
16 3597 1 1 12 ALA HB3 H -5.385 -1.181 -4.376 1.00 . A A . 12 ALA HB3 1 1
16 3598 1 1 12 ALA N N -5.937 0.949 -2.884 1.00 . A A . 12 ALA N 1 1
16 3599 1 1 12 ALA O O -9.189 -0.527 -2.940 1.00 . A A . 12 ALA O 1 1
16 3600 1 1 13 DAL C C -8.939 -1.479 0.395 1.00 . A A . 13 DAL C 1 1
16 3601 1 1 13 DAL CA C -8.930 -0.095 -0.232 1.00 . A A . 13 DAL CA 1 1
16 3602 1 1 13 DAL CB C -8.792 0.972 0.843 1.00 . A A . 13 DAL CB 1 1
16 3603 1 1 13 DAL H H -6.967 0.279 -0.923 1.00 . A A . 13 DAL H 1 1
16 3604 1 1 13 DAL HA H -9.870 0.061 -0.740 1.00 . A A . 13 DAL HA 1 1
16 3605 1 1 13 DAL HB1 H -8.787 1.949 0.383 1.00 . A A . 13 DAL HB1 1 1
16 3606 1 1 13 DAL HB2 H -7.868 0.823 1.381 1.00 . A A . 13 DAL HB2 1 1
16 3607 1 1 13 DAL HB3 H -9.623 0.901 1.529 1.00 . A A . 13 DAL HB3 1 1
16 3608 1 1 13 DAL N N -7.869 0.032 -1.216 1.00 . A A . 13 DAL N 1 1
16 3609 1 1 13 DAL O O -9.994 -2.097 0.540 1.00 . A A . 13 DAL O 1 1
16 3610 1 1 14 CYS C C -6.801 -3.139 2.661 1.00 . A A . 14 CYS C 1 1
16 3611 1 1 14 CYS CA C -7.650 -3.261 1.394 1.00 . A A . 14 CYS CA 1 1
16 3612 1 1 14 CYS CB C -7.046 -4.295 0.431 1.00 . A A . 14 CYS CB 1 1
16 3613 1 1 14 CYS H H -6.951 -1.459 0.548 1.00 . A A . 14 CYS H 1 1
16 3614 1 1 14 CYS HA H -8.643 -3.579 1.673 1.00 . A A . 14 CYS HA 1 1
16 3615 1 1 14 CYS HB2 H -6.385 -4.944 0.988 1.00 . A A . 14 CYS HB2 1 1
16 3616 1 1 14 CYS HB3 H -7.846 -4.887 0.013 1.00 . A A . 14 CYS HB3 1 1
16 3617 1 1 14 CYS N N -7.768 -1.971 0.744 1.00 . A A . 14 CYS N 1 1
16 3618 1 1 14 CYS O O -7.293 -2.713 3.713 1.00 . A A . 14 CYS O 1 1
16 3619 1 1 14 CYS SG S -6.108 -3.574 -0.931 1.00 . A A . 14 CYS SG 1 1
16 3620 1 1 15 NH2 HN1 H -5.141 -3.526 1.660 1.00 . A A . 15 NH2 HN1 1 1
16 3621 1 1 15 NH2 HN2 H -5.075 -3.817 3.358 1.00 . A A . 15 NH2 HN2 1 1
16 3622 1 1 15 NH2 N N -5.527 -3.473 2.559 1.00 . A A . 15 NH2 N 1 1
16 3623 2 2 1 . CB1 C -0.103 -6.113 3.544 1.00 . B A . 101 B0I CB1 1 1
16 3624 2 2 1 . CB2 C -5.259 -5.031 -1.574 1.00 . B A . 101 B0I CB2 1 1
16 3625 2 2 1 . CD1 C -0.779 -5.676 1.195 1.00 . B A . 101 B0I CD1 1 1
16 3626 2 2 1 . CD2 C 1.163 -6.992 1.564 1.00 . B A . 101 B0I CD2 1 1
16 3627 2 2 1 . CD3 C -2.873 -5.405 -0.886 1.00 . B A . 101 B0I CD3 1 1
16 3628 2 2 1 . CD4 C -3.304 -4.006 -2.768 1.00 . B A . 101 B0I CD4 1 1
16 3629 2 2 1 . CE1 C -0.614 -5.802 -0.173 1.00 . B A . 101 B0I CE1 1 1
16 3630 2 2 1 . CE2 C 1.342 -7.127 0.200 1.00 . B A . 101 B0I CE2 1 1
16 3631 2 2 1 . CE3 C -1.513 -5.201 -1.042 1.00 . B A . 101 B0I CE3 1 1
16 3632 2 2 1 . CE4 C -1.948 -3.798 -2.928 1.00 . B A . 101 B0I CE4 1 1
16 3633 2 2 1 . CG1 C 0.097 -6.262 2.070 1.00 . B A . 101 B0I CG1 1 1
16 3634 2 2 1 . CG2 C -3.782 -4.810 -1.746 1.00 . B A . 101 B0I CG2 1 1
16 3635 2 2 1 . CZ1 C 0.451 -6.531 -0.671 1.00 . B A . 101 B0I CZ1 1 1
16 3636 2 2 1 . CZ2 C -1.052 -4.396 -2.065 1.00 . B A . 101 B0I CZ2 1 1
16 3637 2 2 1 . H1 H 0.581 -6.775 4.038 1.00 . B A . 101 B0I H1 1 1
16 3638 2 2 1 . H2 H -5.403 -5.852 -0.888 1.00 . B A . 101 B0I H2 1 1
16 3639 2 2 1 . HB11 H -1.117 -6.400 3.778 1.00 . B A . 101 B0I HB11 1 1
16 3640 2 2 1 . HB21 H -5.679 -5.285 -2.536 1.00 . B A . 101 B0I HB21 1 1
16 3641 2 2 1 . HD1 H -1.602 -5.113 1.602 1.00 . B A . 101 B0I HD1 1 1
16 3642 2 2 1 . HD2 H 1.859 -7.458 2.246 1.00 . B A . 101 B0I HD2 1 1
16 3643 2 2 1 . HD3 H -3.233 -6.035 -0.086 1.00 . B A . 101 B0I HD3 1 1
16 3644 2 2 1 . HD4 H -4.003 -3.537 -3.445 1.00 . B A . 101 B0I HD4 1 1
16 3645 2 2 1 . HE2 H 2.175 -7.697 -0.182 1.00 . B A . 101 B0I HE2 1 1
16 3646 2 2 1 . HE4 H -1.588 -3.169 -3.728 1.00 . B A . 101 B0I HE4 1 1
16 3647 2 2 1 . HZ1 H 0.586 -6.633 -1.738 1.00 . B A . 101 B0I HZ1 1 1
16 3648 2 2 1 . HZ2 H 0.009 -4.234 -2.188 1.00 . B A . 101 B0I HZ2 1 1
17 3649 1 1 1 . C C 4.922 -4.246 4.416 1.00 . A A . 1 H00 C 1 1
17 3650 1 1 1 . CA C 3.995 -5.438 4.345 1.00 . A A . 1 H00 CA 1 1
17 3651 1 1 1 . CB C 2.607 -5.051 4.821 1.00 . A A . 1 H00 CB 1 1
17 3652 1 1 1 . CG C 1.901 -4.163 3.809 1.00 . A A . 1 H00 CG 1 1
17 3653 1 1 1 . HA1 H 4.378 -6.228 4.975 1.00 . A A . 1 H00 HA1 1 1
17 3654 1 1 1 . HA2 H 3.938 -5.787 3.323 1.00 . A A . 1 H00 HA2 1 1
17 3655 1 1 1 . HB1 H 2.696 -4.517 5.756 1.00 . A A . 1 H00 HB1 1 1
17 3656 1 1 1 . HB2 H 2.024 -5.948 4.970 1.00 . A A . 1 H00 HB2 1 1
17 3657 1 1 1 . HG1 H 2.163 -4.497 2.814 1.00 . A A . 1 H00 HG1 1 1
17 3658 1 1 1 . HG2 H 2.235 -3.145 3.947 1.00 . A A . 1 H00 HG2 1 1
17 3659 1 1 1 . O O 5.112 -3.659 5.484 1.00 . A A . 1 H00 O 1 1
17 3660 1 1 1 . SD S 0.106 -4.207 3.979 1.00 . A A . 1 H00 SD 1 1
17 3661 1 1 2 THR C C 5.604 -1.458 3.063 1.00 . A A . 2 THR C 1 1
17 3662 1 1 2 THR CA C 6.397 -2.754 3.224 1.00 . A A . 2 THR CA 1 1
17 3663 1 1 2 THR CB C 7.392 -2.908 2.060 1.00 . A A . 2 THR CB 1 1
17 3664 1 1 2 THR CG2 C 8.426 -3.974 2.379 1.00 . A A . 2 THR CG2 1 1
17 3665 1 1 2 THR H H 5.324 -4.395 2.468 1.00 . A A . 2 THR H 1 1
17 3666 1 1 2 THR HA H 6.952 -2.713 4.149 1.00 . A A . 2 THR HA 1 1
17 3667 1 1 2 THR HB H 7.895 -1.967 1.907 1.00 . A A . 2 THR HB 1 1
17 3668 1 1 2 THR HG1 H 7.086 -4.055 0.483 1.00 . A A . 2 THR HG1 1 1
17 3669 1 1 2 THR HG21 H 8.943 -3.714 3.290 1.00 . A A . 2 THR HG21 1 1
17 3670 1 1 2 THR HG22 H 9.138 -4.036 1.569 1.00 . A A . 2 THR HG22 1 1
17 3671 1 1 2 THR HG23 H 7.935 -4.928 2.502 1.00 . A A . 2 THR HG23 1 1
17 3672 1 1 2 THR N N 5.502 -3.887 3.289 1.00 . A A . 2 THR N 1 1
17 3673 1 1 2 THR O O 4.427 -1.496 2.688 1.00 . A A . 2 THR O 1 1
17 3674 1 1 2 THR OG1 O 6.687 -3.262 0.861 1.00 . A A . 2 THR OG1 1 1
17 3675 1 1 3 PRO C C 4.854 1.203 1.902 1.00 . A A . 3 PRO C 1 1
17 3676 1 1 3 PRO CA C 5.566 1.015 3.243 1.00 . A A . 3 PRO CA 1 1
17 3677 1 1 3 PRO CB C 6.724 2.004 3.371 1.00 . A A . 3 PRO CB 1 1
17 3678 1 1 3 PRO CD C 7.614 -0.157 3.864 1.00 . A A . 3 PRO CD 1 1
17 3679 1 1 3 PRO CG C 7.715 1.301 4.226 1.00 . A A . 3 PRO CG 1 1
17 3680 1 1 3 PRO HA H 4.863 1.173 4.046 1.00 . A A . 3 PRO HA 1 1
17 3681 1 1 3 PRO HB2 H 7.126 2.219 2.390 1.00 . A A . 3 PRO HB2 1 1
17 3682 1 1 3 PRO HB3 H 6.377 2.915 3.836 1.00 . A A . 3 PRO HB3 1 1
17 3683 1 1 3 PRO HD2 H 8.333 -0.403 3.099 1.00 . A A . 3 PRO HD2 1 1
17 3684 1 1 3 PRO HD3 H 7.764 -0.773 4.738 1.00 . A A . 3 PRO HD3 1 1
17 3685 1 1 3 PRO HG2 H 8.709 1.671 4.019 1.00 . A A . 3 PRO HG2 1 1
17 3686 1 1 3 PRO HG3 H 7.469 1.445 5.268 1.00 . A A . 3 PRO HG3 1 1
17 3687 1 1 3 PRO N N 6.228 -0.290 3.357 1.00 . A A . 3 PRO N 1 1
17 3688 1 1 3 PRO O O 3.728 1.681 1.863 1.00 . A A . 3 PRO O 1 1
17 3689 1 1 4 ARG C C 3.645 0.100 -0.630 1.00 . A A . 4 ARG C 1 1
17 3690 1 1 4 ARG CA C 4.903 0.932 -0.524 1.00 . A A . 4 ARG CA 1 1
17 3691 1 1 4 ARG CB C 5.882 0.514 -1.614 1.00 . A A . 4 ARG CB 1 1
17 3692 1 1 4 ARG CD C 8.044 0.947 -2.803 1.00 . A A . 4 ARG CD 1 1
17 3693 1 1 4 ARG CG C 7.152 1.324 -1.629 1.00 . A A . 4 ARG CG 1 1
17 3694 1 1 4 ARG CZ C 8.052 1.354 -5.250 1.00 . A A . 4 ARG CZ 1 1
17 3695 1 1 4 ARG H H 6.393 0.400 0.904 1.00 . A A . 4 ARG H 1 1
17 3696 1 1 4 ARG HA H 4.643 1.972 -0.666 1.00 . A A . 4 ARG HA 1 1
17 3697 1 1 4 ARG HB2 H 6.145 -0.524 -1.467 1.00 . A A . 4 ARG HB2 1 1
17 3698 1 1 4 ARG HB3 H 5.401 0.620 -2.576 1.00 . A A . 4 ARG HB3 1 1
17 3699 1 1 4 ARG HD2 H 8.950 1.532 -2.753 1.00 . A A . 4 ARG HD2 1 1
17 3700 1 1 4 ARG HD3 H 8.292 -0.102 -2.724 1.00 . A A . 4 ARG HD3 1 1
17 3701 1 1 4 ARG HE H 6.405 1.205 -4.106 1.00 . A A . 4 ARG HE 1 1
17 3702 1 1 4 ARG HG2 H 6.904 2.373 -1.693 1.00 . A A . 4 ARG HG2 1 1
17 3703 1 1 4 ARG HG3 H 7.674 1.124 -0.707 1.00 . A A . 4 ARG HG3 1 1
17 3704 1 1 4 ARG HH11 H 9.903 1.246 -4.414 1.00 . A A . 4 ARG HH11 1 1
17 3705 1 1 4 ARG HH12 H 9.878 1.488 -6.126 1.00 . A A . 4 ARG HH12 1 1
17 3706 1 1 4 ARG HH21 H 6.376 1.530 -6.388 1.00 . A A . 4 ARG HH21 1 1
17 3707 1 1 4 ARG HH22 H 7.871 1.639 -7.253 1.00 . A A . 4 ARG HH22 1 1
17 3708 1 1 4 ARG N N 5.502 0.797 0.809 1.00 . A A . 4 ARG N 1 1
17 3709 1 1 4 ARG NE N 7.393 1.186 -4.099 1.00 . A A . 4 ARG NE 1 1
17 3710 1 1 4 ARG NH1 N 9.381 1.364 -5.264 1.00 . A A . 4 ARG NH1 1 1
17 3711 1 1 4 ARG NH2 N 7.381 1.524 -6.384 1.00 . A A . 4 ARG NH2 1 1
17 3712 1 1 4 ARG O O 2.601 0.586 -1.064 1.00 . A A . 4 ARG O 1 1
17 3713 1 1 5 GLN C C 1.470 -1.557 0.622 1.00 . A A . 5 GLN C 1 1
17 3714 1 1 5 GLN CA C 2.617 -2.073 -0.243 1.00 . A A . 5 GLN CA 1 1
17 3715 1 1 5 GLN CB C 3.043 -3.464 0.224 1.00 . A A . 5 GLN CB 1 1
17 3716 1 1 5 GLN CD C 4.478 -5.500 -0.194 1.00 . A A . 5 GLN CD 1 1
17 3717 1 1 5 GLN CG C 3.999 -4.164 -0.728 1.00 . A A . 5 GLN CG 1 1
17 3718 1 1 5 GLN H H 4.620 -1.459 0.125 1.00 . A A . 5 GLN H 1 1
17 3719 1 1 5 GLN HA H 2.274 -2.137 -1.264 1.00 . A A . 5 GLN HA 1 1
17 3720 1 1 5 GLN HB2 H 3.533 -3.374 1.184 1.00 . A A . 5 GLN HB2 1 1
17 3721 1 1 5 GLN HB3 H 2.161 -4.079 0.332 1.00 . A A . 5 GLN HB3 1 1
17 3722 1 1 5 GLN HE21 H 4.607 -6.211 -2.039 1.00 . A A . 5 GLN HE21 1 1
17 3723 1 1 5 GLN HE22 H 5.054 -7.310 -0.776 1.00 . A A . 5 GLN HE22 1 1
17 3724 1 1 5 GLN HG2 H 3.492 -4.331 -1.667 1.00 . A A . 5 GLN HG2 1 1
17 3725 1 1 5 GLN HG3 H 4.856 -3.528 -0.890 1.00 . A A . 5 GLN HG3 1 1
17 3726 1 1 5 GLN N N 3.750 -1.151 -0.213 1.00 . A A . 5 GLN N 1 1
17 3727 1 1 5 GLN NE2 N 4.738 -6.433 -1.090 1.00 . A A . 5 GLN NE2 1 1
17 3728 1 1 5 GLN O O 0.306 -1.678 0.257 1.00 . A A . 5 GLN O 1 1
17 3729 1 1 5 GLN OE1 O 4.605 -5.690 1.017 1.00 . A A . 5 GLN OE1 1 1
17 3730 1 1 6 ALA C C 0.092 0.776 2.031 1.00 . A A . 6 ALA C 1 1
17 3731 1 1 6 ALA CA C 0.818 -0.412 2.668 1.00 . A A . 6 ALA CA 1 1
17 3732 1 1 6 ALA CB C 1.473 0.004 3.974 1.00 . A A . 6 ALA CB 1 1
17 3733 1 1 6 ALA H H 2.765 -0.910 1.999 1.00 . A A . 6 ALA H 1 1
17 3734 1 1 6 ALA HA H 0.096 -1.187 2.881 1.00 . A A . 6 ALA HA 1 1
17 3735 1 1 6 ALA HB1 H 2.186 0.792 3.784 1.00 . A A . 6 ALA HB1 1 1
17 3736 1 1 6 ALA HB2 H 1.981 -0.845 4.408 1.00 . A A . 6 ALA HB2 1 1
17 3737 1 1 6 ALA HB3 H 0.716 0.359 4.658 1.00 . A A . 6 ALA HB3 1 1
17 3738 1 1 6 ALA N N 1.813 -0.966 1.760 1.00 . A A . 6 ALA N 1 1
17 3739 1 1 6 ALA O O -1.115 0.955 2.215 1.00 . A A . 6 ALA O 1 1
17 3740 1 1 7 ARG C C -0.633 2.256 -0.545 1.00 . A A . 7 ARG C 1 1
17 3741 1 1 7 ARG CA C 0.254 2.732 0.590 1.00 . A A . 7 ARG CA 1 1
17 3742 1 1 7 ARG CB C 1.354 3.637 0.044 1.00 . A A . 7 ARG CB 1 1
17 3743 1 1 7 ARG CD C 3.502 4.837 0.498 1.00 . A A . 7 ARG CD 1 1
17 3744 1 1 7 ARG CG C 2.304 4.136 1.106 1.00 . A A . 7 ARG CG 1 1
17 3745 1 1 7 ARG CZ C 5.762 5.509 1.238 1.00 . A A . 7 ARG CZ 1 1
17 3746 1 1 7 ARG H H 1.794 1.399 1.193 1.00 . A A . 7 ARG H 1 1
17 3747 1 1 7 ARG HA H -0.345 3.286 1.298 1.00 . A A . 7 ARG HA 1 1
17 3748 1 1 7 ARG HB2 H 1.925 3.087 -0.691 1.00 . A A . 7 ARG HB2 1 1
17 3749 1 1 7 ARG HB3 H 0.899 4.492 -0.434 1.00 . A A . 7 ARG HB3 1 1
17 3750 1 1 7 ARG HD2 H 3.959 4.181 -0.227 1.00 . A A . 7 ARG HD2 1 1
17 3751 1 1 7 ARG HD3 H 3.168 5.738 0.007 1.00 . A A . 7 ARG HD3 1 1
17 3752 1 1 7 ARG HE H 4.194 5.185 2.447 1.00 . A A . 7 ARG HE 1 1
17 3753 1 1 7 ARG HG2 H 1.782 4.824 1.755 1.00 . A A . 7 ARG HG2 1 1
17 3754 1 1 7 ARG HG3 H 2.644 3.283 1.675 1.00 . A A . 7 ARG HG3 1 1
17 3755 1 1 7 ARG HH11 H 5.570 5.288 -0.768 1.00 . A A . 7 ARG HH11 1 1
17 3756 1 1 7 ARG HH12 H 7.142 5.756 -0.225 1.00 . A A . 7 ARG HH12 1 1
17 3757 1 1 7 ARG HH21 H 6.292 5.816 3.175 1.00 . A A . 7 ARG HH21 1 1
17 3758 1 1 7 ARG HH22 H 7.550 6.060 2.021 1.00 . A A . 7 ARG HH22 1 1
17 3759 1 1 7 ARG N N 0.832 1.582 1.281 1.00 . A A . 7 ARG N 1 1
17 3760 1 1 7 ARG NE N 4.497 5.190 1.511 1.00 . A A . 7 ARG NE 1 1
17 3761 1 1 7 ARG NH1 N 6.190 5.518 -0.015 1.00 . A A . 7 ARG NH1 1 1
17 3762 1 1 7 ARG NH2 N 6.595 5.818 2.219 1.00 . A A . 7 ARG NH2 1 1
17 3763 1 1 7 ARG O O -1.738 2.773 -0.752 1.00 . A A . 7 ARG O 1 1
17 3764 1 1 8 ALA C C -2.177 0.030 -1.864 1.00 . A A . 8 ALA C 1 1
17 3765 1 1 8 ALA CA C -0.891 0.670 -2.374 1.00 . A A . 8 ALA CA 1 1
17 3766 1 1 8 ALA CB C -0.036 -0.355 -3.103 1.00 . A A . 8 ALA CB 1 1
17 3767 1 1 8 ALA H H 0.753 0.916 -1.054 1.00 . A A . 8 ALA H 1 1
17 3768 1 1 8 ALA HA H -1.143 1.461 -3.065 1.00 . A A . 8 ALA HA 1 1
17 3769 1 1 8 ALA HB1 H -0.587 -0.751 -3.944 1.00 . A A . 8 ALA HB1 1 1
17 3770 1 1 8 ALA HB2 H 0.218 -1.160 -2.429 1.00 . A A . 8 ALA HB2 1 1
17 3771 1 1 8 ALA HB3 H 0.869 0.117 -3.456 1.00 . A A . 8 ALA HB3 1 1
17 3772 1 1 8 ALA N N -0.146 1.261 -1.269 1.00 . A A . 8 ALA N 1 1
17 3773 1 1 8 ALA O O -3.228 0.117 -2.509 1.00 . A A . 8 ALA O 1 1
17 3774 1 1 9 ALA C C -4.292 -0.172 0.265 1.00 . A A . 9 ALA C 1 1
17 3775 1 1 9 ALA CA C -3.241 -1.221 -0.065 1.00 . A A . 9 ALA CA 1 1
17 3776 1 1 9 ALA CB C -2.821 -1.967 1.193 1.00 . A A . 9 ALA CB 1 1
17 3777 1 1 9 ALA H H -1.212 -0.668 -0.257 1.00 . A A . 9 ALA H 1 1
17 3778 1 1 9 ALA HA H -3.663 -1.934 -0.760 1.00 . A A . 9 ALA HA 1 1
17 3779 1 1 9 ALA HB1 H -3.679 -2.461 1.623 1.00 . A A . 9 ALA HB1 1 1
17 3780 1 1 9 ALA HB2 H -2.416 -1.265 1.908 1.00 . A A . 9 ALA HB2 1 1
17 3781 1 1 9 ALA HB3 H -2.070 -2.700 0.942 1.00 . A A . 9 ALA HB3 1 1
17 3782 1 1 9 ALA N N -2.088 -0.603 -0.698 1.00 . A A . 9 ALA N 1 1
17 3783 1 1 9 ALA O O -5.483 -0.394 0.077 1.00 . A A . 9 ALA O 1 1
17 3784 1 1 10 ARG C C -5.407 2.602 -0.196 1.00 . A A . 10 ARG C 1 1
17 3785 1 1 10 ARG CA C -4.732 2.073 1.068 1.00 . A A . 10 ARG CA 1 1
17 3786 1 1 10 ARG CB C -3.962 3.198 1.755 1.00 . A A . 10 ARG CB 1 1
17 3787 1 1 10 ARG CD C -4.019 5.524 2.700 1.00 . A A . 10 ARG CD 1 1
17 3788 1 1 10 ARG CG C -4.833 4.377 2.132 1.00 . A A . 10 ARG CG 1 1
17 3789 1 1 10 ARG CZ C -2.926 6.094 4.839 1.00 . A A . 10 ARG CZ 1 1
17 3790 1 1 10 ARG H H -2.878 1.089 0.907 1.00 . A A . 10 ARG H 1 1
17 3791 1 1 10 ARG HA H -5.489 1.702 1.742 1.00 . A A . 10 ARG HA 1 1
17 3792 1 1 10 ARG HB2 H -3.507 2.811 2.654 1.00 . A A . 10 ARG HB2 1 1
17 3793 1 1 10 ARG HB3 H -3.187 3.547 1.089 1.00 . A A . 10 ARG HB3 1 1
17 3794 1 1 10 ARG HD2 H -3.241 5.779 1.997 1.00 . A A . 10 ARG HD2 1 1
17 3795 1 1 10 ARG HD3 H -4.670 6.374 2.836 1.00 . A A . 10 ARG HD3 1 1
17 3796 1 1 10 ARG HE H -3.350 4.235 4.221 1.00 . A A . 10 ARG HE 1 1
17 3797 1 1 10 ARG HG2 H -5.361 4.720 1.254 1.00 . A A . 10 ARG HG2 1 1
17 3798 1 1 10 ARG HG3 H -5.542 4.042 2.873 1.00 . A A . 10 ARG HG3 1 1
17 3799 1 1 10 ARG HH11 H -3.335 7.699 3.658 1.00 . A A . 10 ARG HH11 1 1
17 3800 1 1 10 ARG HH12 H -2.607 8.072 5.184 1.00 . A A . 10 ARG HH12 1 1
17 3801 1 1 10 ARG HH21 H -2.380 4.729 6.235 1.00 . A A . 10 ARG HH21 1 1
17 3802 1 1 10 ARG HH22 H -2.054 6.379 6.646 1.00 . A A . 10 ARG HH22 1 1
17 3803 1 1 10 ARG N N -3.839 0.977 0.748 1.00 . A A . 10 ARG N 1 1
17 3804 1 1 10 ARG NE N -3.403 5.189 3.983 1.00 . A A . 10 ARG NE 1 1
17 3805 1 1 10 ARG NH1 N -2.958 7.390 4.535 1.00 . A A . 10 ARG NH1 1 1
17 3806 1 1 10 ARG NH2 N -2.413 5.703 5.995 1.00 . A A . 10 ARG NH2 1 1
17 3807 1 1 10 ARG O O -6.579 2.973 -0.178 1.00 . A A . 10 ARG O 1 1
17 3808 1 1 11 ALA C C -6.247 2.185 -3.112 1.00 . A A . 11 ALA C 1 1
17 3809 1 1 11 ALA CA C -5.171 3.118 -2.557 1.00 . A A . 11 ALA CA 1 1
17 3810 1 1 11 ALA CB C -4.036 3.281 -3.559 1.00 . A A . 11 ALA CB 1 1
17 3811 1 1 11 ALA H H -3.727 2.322 -1.233 1.00 . A A . 11 ALA H 1 1
17 3812 1 1 11 ALA HA H -5.610 4.089 -2.385 1.00 . A A . 11 ALA HA 1 1
17 3813 1 1 11 ALA HB1 H -3.585 2.319 -3.751 1.00 . A A . 11 ALA HB1 1 1
17 3814 1 1 11 ALA HB2 H -3.292 3.952 -3.155 1.00 . A A . 11 ALA HB2 1 1
17 3815 1 1 11 ALA HB3 H -4.425 3.687 -4.481 1.00 . A A . 11 ALA HB3 1 1
17 3816 1 1 11 ALA N N -4.657 2.635 -1.286 1.00 . A A . 11 ALA N 1 1
17 3817 1 1 11 ALA O O -7.283 2.641 -3.602 1.00 . A A . 11 ALA O 1 1
17 3818 1 1 12 ALA C C -8.109 -0.338 -2.587 1.00 . A A . 12 ALA C 1 1
17 3819 1 1 12 ALA CA C -6.937 -0.111 -3.540 1.00 . A A . 12 ALA CA 1 1
17 3820 1 1 12 ALA CB C -6.213 -1.418 -3.814 1.00 . A A . 12 ALA CB 1 1
17 3821 1 1 12 ALA H H -5.169 0.583 -2.599 1.00 . A A . 12 ALA H 1 1
17 3822 1 1 12 ALA HA H -7.323 0.260 -4.478 1.00 . A A . 12 ALA HA 1 1
17 3823 1 1 12 ALA HB1 H -5.388 -1.239 -4.487 1.00 . A A . 12 ALA HB1 1 1
17 3824 1 1 12 ALA HB2 H -6.898 -2.122 -4.263 1.00 . A A . 12 ALA HB2 1 1
17 3825 1 1 12 ALA HB3 H -5.839 -1.824 -2.885 1.00 . A A . 12 ALA HB3 1 1
17 3826 1 1 12 ALA N N -6.003 0.884 -3.021 1.00 . A A . 12 ALA N 1 1
17 3827 1 1 12 ALA O O -9.225 -0.651 -3.017 1.00 . A A . 12 ALA O 1 1
17 3828 1 1 13 DAL C C -8.777 -1.738 0.354 1.00 . A A . 13 DAL C 1 1
17 3829 1 1 13 DAL CA C -8.887 -0.365 -0.293 1.00 . A A . 13 DAL CA 1 1
17 3830 1 1 13 DAL CB C -8.797 0.728 0.759 1.00 . A A . 13 DAL CB 1 1
17 3831 1 1 13 DAL H H -6.944 0.038 -1.016 1.00 . A A . 13 DAL H 1 1
17 3832 1 1 13 DAL HA H -9.848 -0.286 -0.781 1.00 . A A . 13 DAL HA 1 1
17 3833 1 1 13 DAL HB1 H -9.612 0.624 1.460 1.00 . A A . 13 DAL HB1 1 1
17 3834 1 1 13 DAL HB2 H -8.854 1.695 0.280 1.00 . A A . 13 DAL HB2 1 1
17 3835 1 1 13 DAL HB3 H -7.857 0.644 1.285 1.00 . A A . 13 DAL HB3 1 1
17 3836 1 1 13 DAL N N -7.855 -0.187 -1.301 1.00 . A A . 13 DAL N 1 1
17 3837 1 1 13 DAL O O -9.743 -2.501 0.386 1.00 . A A . 13 DAL O 1 1
17 3838 1 1 14 CYS C C -6.670 -3.128 2.847 1.00 . A A . 14 CYS C 1 1
17 3839 1 1 14 CYS CA C -7.351 -3.334 1.493 1.00 . A A . 14 CYS CA 1 1
17 3840 1 1 14 CYS CB C -6.492 -4.227 0.594 1.00 . A A . 14 CYS CB 1 1
17 3841 1 1 14 CYS H H -6.849 -1.423 0.753 1.00 . A A . 14 CYS H 1 1
17 3842 1 1 14 CYS HA H -8.305 -3.811 1.652 1.00 . A A . 14 CYS HA 1 1
17 3843 1 1 14 CYS HB2 H -5.507 -4.311 1.027 1.00 . A A . 14 CYS HB2 1 1
17 3844 1 1 14 CYS HB3 H -6.939 -5.208 0.548 1.00 . A A . 14 CYS HB3 1 1
17 3845 1 1 14 CYS N N -7.593 -2.058 0.842 1.00 . A A . 14 CYS N 1 1
17 3846 1 1 14 CYS O O -5.442 -3.177 2.954 1.00 . A A . 14 CYS O 1 1
17 3847 1 1 14 CYS SG S -6.315 -3.610 -1.096 1.00 . A A . 14 CYS SG 1 1
17 3848 1 1 15 NH2 HN1 H -8.429 -2.848 3.702 1.00 . A A . 15 NH2 HN1 1 1
17 3849 1 1 15 NH2 HN2 H -7.084 -2.974 4.773 1.00 . A A . 15 NH2 HN2 1 1
17 3850 1 1 15 NH2 N N -7.463 -2.887 3.874 1.00 . A A . 15 NH2 N 1 1
17 3851 2 2 1 . CB1 C -0.257 -5.869 3.381 1.00 . B A . 101 B0I CB1 1 1
17 3852 2 2 1 . CB2 C -5.363 -4.940 -1.849 1.00 . B A . 101 B0I CB2 1 1
17 3853 2 2 1 . CD1 C -0.923 -5.416 1.043 1.00 . B A . 101 B0I CD1 1 1
17 3854 2 2 1 . CD2 C 1.011 -6.736 1.407 1.00 . B A . 101 B0I CD2 1 1
17 3855 2 2 1 . CD3 C -2.993 -5.213 -1.095 1.00 . B A . 101 B0I CD3 1 1
17 3856 2 2 1 . CD4 C -3.437 -3.730 -2.906 1.00 . B A . 101 B0I CD4 1 1
17 3857 2 2 1 . CE1 C -0.753 -5.529 -0.320 1.00 . B A . 101 B0I CE1 1 1
17 3858 2 2 1 . CE2 C 1.193 -6.860 0.046 1.00 . B A . 101 B0I CE2 1 1
17 3859 2 2 1 . CE3 C -1.646 -4.924 -1.184 1.00 . B A . 101 B0I CE3 1 1
17 3860 2 2 1 . CE4 C -2.091 -3.437 -3.001 1.00 . B A . 101 B0I CE4 1 1
17 3861 2 2 1 . CG1 C -0.053 -6.011 1.913 1.00 . B A . 101 B0I CG1 1 1
17 3862 2 2 1 . CG2 C -3.902 -4.621 -1.952 1.00 . B A . 101 B0I CG2 1 1
17 3863 2 2 1 . CZ1 C 0.309 -6.253 -0.821 1.00 . B A . 101 B0I CZ1 1 1
17 3864 2 2 1 . CZ2 C -1.194 -4.033 -2.139 1.00 . B A . 101 B0I CZ2 1 1
17 3865 2 2 1 . H1 H 0.387 -6.570 3.875 1.00 . B A . 101 B0I H1 1 1
17 3866 2 2 1 . H2 H -5.474 -5.833 -1.253 1.00 . B A . 101 B0I H2 1 1
17 3867 2 2 1 . HB11 H -1.288 -6.104 3.603 1.00 . B A . 101 B0I HB11 1 1
17 3868 2 2 1 . HB21 H -5.740 -5.120 -2.845 1.00 . B A . 101 B0I HB21 1 1
17 3869 2 2 1 . HD1 H -1.746 -4.854 1.450 1.00 . B A . 101 B0I HD1 1 1
17 3870 2 2 1 . HD2 H 1.702 -7.209 2.090 1.00 . B A . 101 B0I HD2 1 1
17 3871 2 2 1 . HD3 H -3.345 -5.908 -0.347 1.00 . B A . 101 B0I HD3 1 1
17 3872 2 2 1 . HD4 H -4.139 -3.263 -3.581 1.00 . B A . 101 B0I HD4 1 1
17 3873 2 2 1 . HE2 H 2.026 -7.428 -0.340 1.00 . B A . 101 B0I HE2 1 1
17 3874 2 2 1 . HE4 H -1.740 -2.740 -3.748 1.00 . B A . 101 B0I HE4 1 1
17 3875 2 2 1 . HZ1 H 0.446 -6.343 -1.887 1.00 . B A . 101 B0I HZ1 1 1
17 3876 2 2 1 . HZ2 H -0.141 -3.806 -2.210 1.00 . B A . 101 B0I HZ2 1 1
18 3877 1 1 1 . C C 4.375 -4.234 2.836 1.00 . A A . 1 H00 C 1 1
18 3878 1 1 1 . CA C 3.431 -5.404 2.659 1.00 . A A . 1 H00 CA 1 1
18 3879 1 1 1 . CB C 2.053 -5.050 3.195 1.00 . A A . 1 H00 CB 1 1
18 3880 1 1 1 . CG C 1.447 -3.882 2.435 1.00 . A A . 1 H00 CG 1 1
18 3881 1 1 1 . HA1 H 3.812 -6.258 3.200 1.00 . A A . 1 H00 HA1 1 1
18 3882 1 1 1 . HA2 H 3.354 -5.645 1.608 1.00 . A A . 1 H00 HA2 1 1
18 3883 1 1 1 . HB1 H 2.142 -4.783 4.237 1.00 . A A . 1 H00 HB1 1 1
18 3884 1 1 1 . HB2 H 1.404 -5.907 3.092 1.00 . A A . 1 H00 HB2 1 1
18 3885 1 1 1 . HG1 H 1.408 -4.136 1.385 1.00 . A A . 1 H00 HG1 1 1
18 3886 1 1 1 . HG2 H 2.077 -3.015 2.573 1.00 . A A . 1 H00 HG2 1 1
18 3887 1 1 1 . O O 4.675 -3.833 3.967 1.00 . A A . 1 H00 O 1 1
18 3888 1 1 1 . SD S -0.221 -3.473 2.994 1.00 . A A . 1 H00 SD 1 1
18 3889 1 1 2 THR C C 4.940 -1.263 2.013 1.00 . A A . 2 THR C 1 1
18 3890 1 1 2 THR CA C 5.742 -2.545 1.779 1.00 . A A . 2 THR CA 1 1
18 3891 1 1 2 THR CB C 6.552 -2.414 0.467 1.00 . A A . 2 THR CB 1 1
18 3892 1 1 2 THR CG2 C 7.472 -3.611 0.279 1.00 . A A . 2 THR CG2 1 1
18 3893 1 1 2 THR H H 4.585 -4.050 0.858 1.00 . A A . 2 THR H 1 1
18 3894 1 1 2 THR HA H 6.429 -2.690 2.599 1.00 . A A . 2 THR HA 1 1
18 3895 1 1 2 THR HB H 7.152 -1.517 0.519 1.00 . A A . 2 THR HB 1 1
18 3896 1 1 2 THR HG1 H 5.896 -2.986 -1.302 1.00 . A A . 2 THR HG1 1 1
18 3897 1 1 2 THR HG21 H 8.030 -3.497 -0.639 1.00 . A A . 2 THR HG21 1 1
18 3898 1 1 2 THR HG22 H 6.882 -4.513 0.231 1.00 . A A . 2 THR HG22 1 1
18 3899 1 1 2 THR HG23 H 8.158 -3.674 1.111 1.00 . A A . 2 THR HG23 1 1
18 3900 1 1 2 THR N N 4.848 -3.685 1.732 1.00 . A A . 2 THR N 1 1
18 3901 1 1 2 THR O O 3.732 -1.232 1.759 1.00 . A A . 2 THR O 1 1
18 3902 1 1 2 THR OG1 O 5.660 -2.316 -0.651 1.00 . A A . 2 THR OG1 1 1
18 3903 1 1 3 PRO C C 4.244 1.625 1.487 1.00 . A A . 3 PRO C 1 1
18 3904 1 1 3 PRO CA C 4.921 1.099 2.751 1.00 . A A . 3 PRO CA 1 1
18 3905 1 1 3 PRO CB C 6.068 2.022 3.167 1.00 . A A . 3 PRO CB 1 1
18 3906 1 1 3 PRO CD C 7.012 -0.148 2.900 1.00 . A A . 3 PRO CD 1 1
18 3907 1 1 3 PRO CG C 7.102 1.106 3.719 1.00 . A A . 3 PRO CG 1 1
18 3908 1 1 3 PRO HA H 4.194 1.028 3.547 1.00 . A A . 3 PRO HA 1 1
18 3909 1 1 3 PRO HB2 H 6.433 2.558 2.302 1.00 . A A . 3 PRO HB2 1 1
18 3910 1 1 3 PRO HB3 H 5.721 2.720 3.915 1.00 . A A . 3 PRO HB3 1 1
18 3911 1 1 3 PRO HD2 H 7.649 -0.077 2.031 1.00 . A A . 3 PRO HD2 1 1
18 3912 1 1 3 PRO HD3 H 7.274 -1.009 3.496 1.00 . A A . 3 PRO HD3 1 1
18 3913 1 1 3 PRO HG2 H 8.081 1.551 3.619 1.00 . A A . 3 PRO HG2 1 1
18 3914 1 1 3 PRO HG3 H 6.888 0.892 4.756 1.00 . A A . 3 PRO HG3 1 1
18 3915 1 1 3 PRO N N 5.589 -0.190 2.512 1.00 . A A . 3 PRO N 1 1
18 3916 1 1 3 PRO O O 3.199 2.275 1.552 1.00 . A A . 3 PRO O 1 1
18 3917 1 1 4 ARG C C 2.991 1.015 -1.207 1.00 . A A . 4 ARG C 1 1
18 3918 1 1 4 ARG CA C 4.307 1.722 -0.953 1.00 . A A . 4 ARG CA 1 1
18 3919 1 1 4 ARG CB C 5.293 1.379 -2.067 1.00 . A A . 4 ARG CB 1 1
18 3920 1 1 4 ARG CD C 7.637 1.509 -2.932 1.00 . A A . 4 ARG CD 1 1
18 3921 1 1 4 ARG CG C 6.684 1.914 -1.826 1.00 . A A . 4 ARG CG 1 1
18 3922 1 1 4 ARG CZ C 10.064 1.618 -3.385 1.00 . A A . 4 ARG CZ 1 1
18 3923 1 1 4 ARG H H 5.678 0.802 0.371 1.00 . A A . 4 ARG H 1 1
18 3924 1 1 4 ARG HA H 4.145 2.789 -0.937 1.00 . A A . 4 ARG HA 1 1
18 3925 1 1 4 ARG HB2 H 5.355 0.304 -2.158 1.00 . A A . 4 ARG HB2 1 1
18 3926 1 1 4 ARG HB3 H 4.927 1.789 -2.996 1.00 . A A . 4 ARG HB3 1 1
18 3927 1 1 4 ARG HD2 H 7.629 0.434 -3.022 1.00 . A A . 4 ARG HD2 1 1
18 3928 1 1 4 ARG HD3 H 7.301 1.949 -3.860 1.00 . A A . 4 ARG HD3 1 1
18 3929 1 1 4 ARG HE H 9.120 2.548 -1.883 1.00 . A A . 4 ARG HE 1 1
18 3930 1 1 4 ARG HG2 H 6.643 2.991 -1.773 1.00 . A A . 4 ARG HG2 1 1
18 3931 1 1 4 ARG HG3 H 7.044 1.517 -0.889 1.00 . A A . 4 ARG HG3 1 1
18 3932 1 1 4 ARG HH11 H 9.034 0.451 -4.694 1.00 . A A . 4 ARG HH11 1 1
18 3933 1 1 4 ARG HH12 H 10.734 0.563 -4.986 1.00 . A A . 4 ARG HH12 1 1
18 3934 1 1 4 ARG HH21 H 11.377 2.684 -2.261 1.00 . A A . 4 ARG HH21 1 1
18 3935 1 1 4 ARG HH22 H 12.067 1.834 -3.597 1.00 . A A . 4 ARG HH22 1 1
18 3936 1 1 4 ARG N N 4.846 1.318 0.340 1.00 . A A . 4 ARG N 1 1
18 3937 1 1 4 ARG NE N 9.000 1.956 -2.660 1.00 . A A . 4 ARG NE 1 1
18 3938 1 1 4 ARG NH1 N 9.933 0.813 -4.437 1.00 . A A . 4 ARG NH1 1 1
18 3939 1 1 4 ARG NH2 N 11.260 2.081 -3.055 1.00 . A A . 4 ARG NH2 1 1
18 3940 1 1 4 ARG O O 1.995 1.641 -1.567 1.00 . A A . 4 ARG O 1 1
18 3941 1 1 5 GLN C C 0.726 -0.708 -0.195 1.00 . A A . 5 GLN C 1 1
18 3942 1 1 5 GLN CA C 1.803 -1.110 -1.187 1.00 . A A . 5 GLN CA 1 1
18 3943 1 1 5 GLN CB C 2.138 -2.593 -1.029 1.00 . A A . 5 GLN CB 1 1
18 3944 1 1 5 GLN CD C 3.465 -4.563 -1.887 1.00 . A A . 5 GLN CD 1 1
18 3945 1 1 5 GLN CG C 2.970 -3.157 -2.165 1.00 . A A . 5 GLN CG 1 1
18 3946 1 1 5 GLN H H 3.831 -0.732 -0.728 1.00 . A A . 5 GLN H 1 1
18 3947 1 1 5 GLN HA H 1.435 -0.940 -2.187 1.00 . A A . 5 GLN HA 1 1
18 3948 1 1 5 GLN HB2 H 2.690 -2.727 -0.109 1.00 . A A . 5 GLN HB2 1 1
18 3949 1 1 5 GLN HB3 H 1.215 -3.154 -0.972 1.00 . A A . 5 GLN HB3 1 1
18 3950 1 1 5 GLN HE21 H 3.384 -4.991 -3.819 1.00 . A A . 5 GLN HE21 1 1
18 3951 1 1 5 GLN HE22 H 3.920 -6.271 -2.782 1.00 . A A . 5 GLN HE22 1 1
18 3952 1 1 5 GLN HG2 H 2.366 -3.177 -3.061 1.00 . A A . 5 GLN HG2 1 1
18 3953 1 1 5 GLN HG3 H 3.823 -2.514 -2.322 1.00 . A A . 5 GLN HG3 1 1
18 3954 1 1 5 GLN N N 2.996 -0.297 -1.006 1.00 . A A . 5 GLN N 1 1
18 3955 1 1 5 GLN NE2 N 3.605 -5.353 -2.931 1.00 . A A . 5 GLN NE2 1 1
18 3956 1 1 5 GLN O O -0.447 -0.651 -0.536 1.00 . A A . 5 GLN O 1 1
18 3957 1 1 5 GLN OE1 O 3.720 -4.931 -0.735 1.00 . A A . 5 GLN OE1 1 1
18 3958 1 1 6 ALA C C -0.460 1.315 1.704 1.00 . A A . 6 ALA C 1 1
18 3959 1 1 6 ALA CA C 0.209 -0.004 2.075 1.00 . A A . 6 ALA CA 1 1
18 3960 1 1 6 ALA CB C 0.937 0.124 3.403 1.00 . A A . 6 ALA CB 1 1
18 3961 1 1 6 ALA H H 2.093 -0.505 1.247 1.00 . A A . 6 ALA H 1 1
18 3962 1 1 6 ALA HA H -0.548 -0.768 2.172 1.00 . A A . 6 ALA HA 1 1
18 3963 1 1 6 ALA HB1 H 0.233 0.404 4.172 1.00 . A A . 6 ALA HB1 1 1
18 3964 1 1 6 ALA HB2 H 1.702 0.882 3.323 1.00 . A A . 6 ALA HB2 1 1
18 3965 1 1 6 ALA HB3 H 1.391 -0.822 3.658 1.00 . A A . 6 ALA HB3 1 1
18 3966 1 1 6 ALA N N 1.137 -0.422 1.034 1.00 . A A . 6 ALA N 1 1
18 3967 1 1 6 ALA O O -1.671 1.479 1.861 1.00 . A A . 6 ALA O 1 1
18 3968 1 1 7 ARG C C -1.098 3.364 -0.413 1.00 . A A . 7 ARG C 1 1
18 3969 1 1 7 ARG CA C -0.152 3.524 0.768 1.00 . A A . 7 ARG CA 1 1
18 3970 1 1 7 ARG CB C 1.029 4.395 0.369 1.00 . A A . 7 ARG CB 1 1
18 3971 1 1 7 ARG CD C 1.786 6.636 -0.431 1.00 . A A . 7 ARG CD 1 1
18 3972 1 1 7 ARG CG C 0.616 5.682 -0.262 1.00 . A A . 7 ARG CG 1 1
18 3973 1 1 7 ARG CZ C 4.012 6.633 -1.518 1.00 . A A . 7 ARG CZ 1 1
18 3974 1 1 7 ARG H H 1.296 2.086 1.118 1.00 . A A . 7 ARG H 1 1
18 3975 1 1 7 ARG HA H -0.671 3.992 1.589 1.00 . A A . 7 ARG HA 1 1
18 3976 1 1 7 ARG HB2 H 1.613 4.618 1.249 1.00 . A A . 7 ARG HB2 1 1
18 3977 1 1 7 ARG HB3 H 1.643 3.852 -0.334 1.00 . A A . 7 ARG HB3 1 1
18 3978 1 1 7 ARG HD2 H 1.424 7.559 -0.856 1.00 . A A . 7 ARG HD2 1 1
18 3979 1 1 7 ARG HD3 H 2.220 6.831 0.538 1.00 . A A . 7 ARG HD3 1 1
18 3980 1 1 7 ARG HE H 2.591 5.244 -1.778 1.00 . A A . 7 ARG HE 1 1
18 3981 1 1 7 ARG HG2 H 0.180 5.473 -1.230 1.00 . A A . 7 ARG HG2 1 1
18 3982 1 1 7 ARG HG3 H -0.121 6.102 0.386 1.00 . A A . 7 ARG HG3 1 1
18 3983 1 1 7 ARG HH11 H 3.693 8.242 -0.317 1.00 . A A . 7 ARG HH11 1 1
18 3984 1 1 7 ARG HH12 H 5.242 8.195 -1.076 1.00 . A A . 7 ARG HH12 1 1
18 3985 1 1 7 ARG HH21 H 4.631 5.183 -2.790 1.00 . A A . 7 ARG HH21 1 1
18 3986 1 1 7 ARG HH22 H 5.783 6.438 -2.493 1.00 . A A . 7 ARG HH22 1 1
18 3987 1 1 7 ARG N N 0.337 2.248 1.198 1.00 . A A . 7 ARG N 1 1
18 3988 1 1 7 ARG NE N 2.814 6.083 -1.311 1.00 . A A . 7 ARG NE 1 1
18 3989 1 1 7 ARG NH1 N 4.340 7.778 -0.923 1.00 . A A . 7 ARG NH1 1 1
18 3990 1 1 7 ARG NH2 N 4.876 6.040 -2.331 1.00 . A A . 7 ARG NH2 1 1
18 3991 1 1 7 ARG O O -2.207 3.902 -0.420 1.00 . A A . 7 ARG O 1 1
18 3992 1 1 8 ALA C C -2.732 1.640 -2.267 1.00 . A A . 8 ALA C 1 1
18 3993 1 1 8 ALA CA C -1.423 2.348 -2.598 1.00 . A A . 8 ALA CA 1 1
18 3994 1 1 8 ALA CB C -0.607 1.529 -3.585 1.00 . A A . 8 ALA CB 1 1
18 3995 1 1 8 ALA H H 0.259 2.248 -1.318 1.00 . A A . 8 ALA H 1 1
18 3996 1 1 8 ALA HA H -1.652 3.298 -3.060 1.00 . A A . 8 ALA HA 1 1
18 3997 1 1 8 ALA HB1 H 0.316 2.046 -3.806 1.00 . A A . 8 ALA HB1 1 1
18 3998 1 1 8 ALA HB2 H -1.172 1.395 -4.496 1.00 . A A . 8 ALA HB2 1 1
18 3999 1 1 8 ALA HB3 H -0.384 0.564 -3.154 1.00 . A A . 8 ALA HB3 1 1
18 4000 1 1 8 ALA N N -0.646 2.617 -1.398 1.00 . A A . 8 ALA N 1 1
18 4001 1 1 8 ALA O O -3.753 1.907 -2.887 1.00 . A A . 8 ALA O 1 1
18 4002 1 1 9 ALA C C -4.937 0.977 -0.333 1.00 . A A . 9 ALA C 1 1
18 4003 1 1 9 ALA CA C -3.887 0.016 -0.859 1.00 . A A . 9 ALA CA 1 1
18 4004 1 1 9 ALA CB C -3.534 -1.010 0.204 1.00 . A A . 9 ALA CB 1 1
18 4005 1 1 9 ALA H H -1.835 0.548 -0.846 1.00 . A A . 9 ALA H 1 1
18 4006 1 1 9 ALA HA H -4.287 -0.505 -1.717 1.00 . A A . 9 ALA HA 1 1
18 4007 1 1 9 ALA HB1 H -3.174 -0.504 1.087 1.00 . A A . 9 ALA HB1 1 1
18 4008 1 1 9 ALA HB2 H -2.764 -1.663 -0.175 1.00 . A A . 9 ALA HB2 1 1
18 4009 1 1 9 ALA HB3 H -4.411 -1.591 0.452 1.00 . A A . 9 ALA HB3 1 1
18 4010 1 1 9 ALA N N -2.693 0.741 -1.288 1.00 . A A . 9 ALA N 1 1
18 4011 1 1 9 ALA O O -6.119 0.873 -0.668 1.00 . A A . 9 ALA O 1 1
18 4012 1 1 10 ARG C C -5.882 3.858 -0.054 1.00 . A A . 10 ARG C 1 1
18 4013 1 1 10 ARG CA C -5.389 2.924 1.041 1.00 . A A . 10 ARG CA 1 1
18 4014 1 1 10 ARG CB C -4.677 3.727 2.129 1.00 . A A . 10 ARG CB 1 1
18 4015 1 1 10 ARG CD C -3.503 3.751 4.345 1.00 . A A . 10 ARG CD 1 1
18 4016 1 1 10 ARG CG C -4.246 2.901 3.328 1.00 . A A . 10 ARG CG 1 1
18 4017 1 1 10 ARG CZ C -2.442 3.494 6.568 1.00 . A A . 10 ARG CZ 1 1
18 4018 1 1 10 ARG H H -3.545 1.937 0.721 1.00 . A A . 10 ARG H 1 1
18 4019 1 1 10 ARG HA H -6.236 2.414 1.476 1.00 . A A . 10 ARG HA 1 1
18 4020 1 1 10 ARG HB2 H -3.796 4.183 1.702 1.00 . A A . 10 ARG HB2 1 1
18 4021 1 1 10 ARG HB3 H -5.341 4.504 2.475 1.00 . A A . 10 ARG HB3 1 1
18 4022 1 1 10 ARG HD2 H -2.623 4.164 3.874 1.00 . A A . 10 ARG HD2 1 1
18 4023 1 1 10 ARG HD3 H -4.149 4.556 4.662 1.00 . A A . 10 ARG HD3 1 1
18 4024 1 1 10 ARG HE H -3.313 2.019 5.515 1.00 . A A . 10 ARG HE 1 1
18 4025 1 1 10 ARG HG2 H -5.123 2.480 3.798 1.00 . A A . 10 ARG HG2 1 1
18 4026 1 1 10 ARG HG3 H -3.597 2.105 2.992 1.00 . A A . 10 ARG HG3 1 1
18 4027 1 1 10 ARG HH11 H -2.423 5.396 5.851 1.00 . A A . 10 ARG HH11 1 1
18 4028 1 1 10 ARG HH12 H -1.661 5.185 7.388 1.00 . A A . 10 ARG HH12 1 1
18 4029 1 1 10 ARG HH21 H -2.316 1.730 7.561 1.00 . A A . 10 ARG HH21 1 1
18 4030 1 1 10 ARG HH22 H -1.603 3.084 8.371 1.00 . A A . 10 ARG HH22 1 1
18 4031 1 1 10 ARG N N -4.498 1.920 0.484 1.00 . A A . 10 ARG N 1 1
18 4032 1 1 10 ARG NE N -3.093 2.979 5.518 1.00 . A A . 10 ARG NE 1 1
18 4033 1 1 10 ARG NH1 N -2.153 4.794 6.605 1.00 . A A . 10 ARG NH1 1 1
18 4034 1 1 10 ARG NH2 N -2.093 2.711 7.580 1.00 . A A . 10 ARG NH2 1 1
18 4035 1 1 10 ARG O O -7.041 4.265 -0.063 1.00 . A A . 10 ARG O 1 1
18 4036 1 1 11 ALA C C -6.313 4.408 -3.046 1.00 . A A . 11 ALA C 1 1
18 4037 1 1 11 ALA CA C -5.321 5.067 -2.087 1.00 . A A . 11 ALA CA 1 1
18 4038 1 1 11 ALA CB C -4.058 5.481 -2.829 1.00 . A A . 11 ALA CB 1 1
18 4039 1 1 11 ALA H H -4.074 3.845 -0.896 1.00 . A A . 11 ALA H 1 1
18 4040 1 1 11 ALA HA H -5.776 5.958 -1.679 1.00 . A A . 11 ALA HA 1 1
18 4041 1 1 11 ALA HB1 H -3.369 5.943 -2.138 1.00 . A A . 11 ALA HB1 1 1
18 4042 1 1 11 ALA HB2 H -4.312 6.184 -3.609 1.00 . A A . 11 ALA HB2 1 1
18 4043 1 1 11 ALA HB3 H -3.597 4.609 -3.268 1.00 . A A . 11 ALA HB3 1 1
18 4044 1 1 11 ALA N N -4.991 4.192 -0.975 1.00 . A A . 11 ALA N 1 1
18 4045 1 1 11 ALA O O -7.217 5.064 -3.559 1.00 . A A . 11 ALA O 1 1
18 4046 1 1 12 ALA C C -8.335 2.033 -3.535 1.00 . A A . 12 ALA C 1 1
18 4047 1 1 12 ALA CA C -7.011 2.383 -4.201 1.00 . A A . 12 ALA CA 1 1
18 4048 1 1 12 ALA CB C -6.317 1.125 -4.704 1.00 . A A . 12 ALA CB 1 1
18 4049 1 1 12 ALA H H -5.395 2.642 -2.852 1.00 . A A . 12 ALA H 1 1
18 4050 1 1 12 ALA HA H -7.209 3.020 -5.050 1.00 . A A . 12 ALA HA 1 1
18 4051 1 1 12 ALA HB1 H -5.379 1.391 -5.167 1.00 . A A . 12 ALA HB1 1 1
18 4052 1 1 12 ALA HB2 H -6.948 0.630 -5.427 1.00 . A A . 12 ALA HB2 1 1
18 4053 1 1 12 ALA HB3 H -6.132 0.460 -3.873 1.00 . A A . 12 ALA HB3 1 1
18 4054 1 1 12 ALA N N -6.138 3.117 -3.290 1.00 . A A . 12 ALA N 1 1
18 4055 1 1 12 ALA O O -9.392 2.081 -4.167 1.00 . A A . 12 ALA O 1 1
18 4056 1 1 13 DAL C C -9.549 -0.150 -1.275 1.00 . A A . 13 DAL C 1 1
18 4057 1 1 13 DAL CA C -9.475 1.348 -1.520 1.00 . A A . 13 DAL CA 1 1
18 4058 1 1 13 DAL CB C -9.514 2.099 -0.201 1.00 . A A . 13 DAL CB 1 1
18 4059 1 1 13 DAL H H -7.407 1.668 -1.812 1.00 . A A . 13 DAL H 1 1
18 4060 1 1 13 DAL HA H -10.331 1.649 -2.106 1.00 . A A . 13 DAL HA 1 1
18 4061 1 1 13 DAL HB1 H -10.437 1.876 0.314 1.00 . A A . 13 DAL HB1 1 1
18 4062 1 1 13 DAL HB2 H -9.454 3.161 -0.388 1.00 . A A . 13 DAL HB2 1 1
18 4063 1 1 13 DAL HB3 H -8.678 1.794 0.412 1.00 . A A . 13 DAL HB3 1 1
18 4064 1 1 13 DAL N N -8.279 1.694 -2.264 1.00 . A A . 13 DAL N 1 1
18 4065 1 1 13 DAL O O -10.617 -0.755 -1.375 1.00 . A A . 13 DAL O 1 1
18 4066 1 1 14 CYS C C -8.209 -2.378 0.824 1.00 . A A . 14 CYS C 1 1
18 4067 1 1 14 CYS CA C -8.356 -2.161 -0.676 1.00 . A A . 14 CYS CA 1 1
18 4068 1 1 14 CYS CB C -7.194 -2.810 -1.425 1.00 . A A . 14 CYS CB 1 1
18 4069 1 1 14 CYS H H -7.583 -0.221 -0.948 1.00 . A A . 14 CYS H 1 1
18 4070 1 1 14 CYS HA H -9.282 -2.608 -1.005 1.00 . A A . 14 CYS HA 1 1
18 4071 1 1 14 CYS HB2 H -6.438 -3.100 -0.710 1.00 . A A . 14 CYS HB2 1 1
18 4072 1 1 14 CYS HB3 H -7.555 -3.694 -1.929 1.00 . A A . 14 CYS HB3 1 1
18 4073 1 1 14 CYS N N -8.415 -0.745 -0.970 1.00 . A A . 14 CYS N 1 1
18 4074 1 1 14 CYS O O -7.094 -2.450 1.350 1.00 . A A . 14 CYS O 1 1
18 4075 1 1 14 CYS SG S -6.425 -1.736 -2.653 1.00 . A A . 14 CYS SG 1 1
18 4076 1 1 15 NH2 HN1 H -10.055 -1.837 1.286 1.00 . A A . 15 NH2 HN1 1 1
18 4077 1 1 15 NH2 HN2 H -9.442 -3.217 2.125 1.00 . A A . 15 NH2 HN2 1 1
18 4078 1 1 15 NH2 N N -9.328 -2.454 1.519 1.00 . A A . 15 NH2 N 1 1
18 4079 2 2 1 . CB1 C -1.164 -4.874 2.345 1.00 . B A . 101 B0I CB1 1 1
18 4080 2 2 1 . CB2 C -5.504 -2.942 -3.621 1.00 . B A . 101 B0I CB2 1 1
18 4081 2 2 1 . CD1 C -1.573 -4.263 -0.031 1.00 . B A . 101 B0I CD1 1 1
18 4082 2 2 1 . CD2 C -0.186 -6.136 0.406 1.00 . B A . 101 B0I CD2 1 1
18 4083 2 2 1 . CD3 C -3.391 -3.691 -2.501 1.00 . B A . 101 B0I CD3 1 1
18 4084 2 2 1 . CD4 C -3.269 -1.916 -4.086 1.00 . B A . 101 B0I CD4 1 1
18 4085 2 2 1 . CE1 C -1.409 -4.453 -1.392 1.00 . B A . 101 B0I CE1 1 1
18 4086 2 2 1 . CE2 C -0.013 -6.336 -0.948 1.00 . B A . 101 B0I CE2 1 1
18 4087 2 2 1 . CE3 C -2.028 -3.604 -2.293 1.00 . B A . 101 B0I CE3 1 1
18 4088 2 2 1 . CE4 C -1.907 -1.823 -3.884 1.00 . B A . 101 B0I CE4 1 1
18 4089 2 2 1 . CG1 C -0.969 -5.093 0.875 1.00 . B A . 101 B0I CG1 1 1
18 4090 2 2 1 . CG2 C -4.025 -2.849 -3.399 1.00 . B A . 101 B0I CG2 1 1
18 4091 2 2 1 . CZ1 C -0.626 -5.492 -1.849 1.00 . B A . 101 B0I CZ1 1 1
18 4092 2 2 1 . CZ2 C -1.285 -2.668 -2.986 1.00 . B A . 101 B0I CZ2 1 1
18 4093 2 2 1 . H1 H -0.862 -5.769 2.855 1.00 . B A . 101 B0I H1 1 1
18 4094 2 2 1 . H2 H -5.827 -3.934 -3.345 1.00 . B A . 101 B0I H2 1 1
18 4095 2 2 1 . HB11 H -2.214 -4.696 2.522 1.00 . B A . 101 B0I HB11 1 1
18 4096 2 2 1 . HB21 H -5.702 -2.774 -4.670 1.00 . B A . 101 B0I HB21 1 1
18 4097 2 2 1 . HD1 H -2.179 -3.458 0.346 1.00 . B A . 101 B0I HD1 1 1
18 4098 2 2 1 . HD2 H 0.294 -6.795 1.113 1.00 . B A . 101 B0I HD2 1 1
18 4099 2 2 1 . HD3 H -3.971 -4.424 -1.961 1.00 . B A . 101 B0I HD3 1 1
18 4100 2 2 1 . HD4 H -3.754 -1.254 -4.788 1.00 . B A . 101 B0I HD4 1 1
18 4101 2 2 1 . HE2 H 0.600 -7.152 -1.301 1.00 . B A . 101 B0I HE2 1 1
18 4102 2 2 1 . HE4 H -1.331 -1.089 -4.428 1.00 . B A . 101 B0I HE4 1 1
18 4103 2 2 1 . HZ1 H -0.496 -5.644 -2.910 1.00 . B A . 101 B0I HZ1 1 1
18 4104 2 2 1 . HZ2 H -0.219 -2.597 -2.825 1.00 . B A . 101 B0I HZ2 1 1
19 4105 1 1 1 . C C 4.162 -4.124 2.921 1.00 . A A . 1 H00 C 1 1
19 4106 1 1 1 . CA C 3.148 -5.236 2.744 1.00 . A A . 1 H00 CA 1 1
19 4107 1 1 1 . CB C 1.792 -4.809 3.292 1.00 . A A . 1 H00 CB 1 1
19 4108 1 1 1 . CG C 1.160 -3.728 2.429 1.00 . A A . 1 H00 CG 1 1
19 4109 1 1 1 . HA1 H 3.485 -6.112 3.277 1.00 . A A . 1 H00 HA1 1 1
19 4110 1 1 1 . HA2 H 3.052 -5.466 1.692 1.00 . A A . 1 H00 HA2 1 1
19 4111 1 1 1 . HB1 H 1.925 -4.428 4.294 1.00 . A A . 1 H00 HB1 1 1
19 4112 1 1 1 . HB2 H 1.136 -5.668 3.316 1.00 . A A . 1 H00 HB2 1 1
19 4113 1 1 1 . HG1 H 1.779 -3.578 1.555 1.00 . A A . 1 H00 HG1 1 1
19 4114 1 1 1 . HG2 H 1.117 -2.812 3.000 1.00 . A A . 1 H00 HG2 1 1
19 4115 1 1 1 . O O 4.438 -3.695 4.046 1.00 . A A . 1 H00 O 1 1
19 4116 1 1 1 . SD S -0.514 -4.141 1.888 1.00 . A A . 1 H00 SD 1 1
19 4117 1 1 2 THR C C 4.988 -1.241 2.018 1.00 . A A . 2 THR C 1 1
19 4118 1 1 2 THR CA C 5.701 -2.586 1.861 1.00 . A A . 2 THR CA 1 1
19 4119 1 1 2 THR CB C 6.565 -2.571 0.580 1.00 . A A . 2 THR CB 1 1
19 4120 1 1 2 THR CG2 C 7.445 -3.812 0.507 1.00 . A A . 2 THR CG2 1 1
19 4121 1 1 2 THR H H 4.484 -4.055 0.952 1.00 . A A . 2 THR H 1 1
19 4122 1 1 2 THR HA H 6.345 -2.746 2.713 1.00 . A A . 2 THR HA 1 1
19 4123 1 1 2 THR HB H 7.195 -1.696 0.599 1.00 . A A . 2 THR HB 1 1
19 4124 1 1 2 THR HG1 H 5.504 -3.414 -0.850 1.00 . A A . 2 THR HG1 1 1
19 4125 1 1 2 THR HG21 H 6.823 -4.694 0.497 1.00 . A A . 2 THR HG21 1 1
19 4126 1 1 2 THR HG22 H 8.098 -3.842 1.366 1.00 . A A . 2 THR HG22 1 1
19 4127 1 1 2 THR HG23 H 8.037 -3.780 -0.396 1.00 . A A . 2 THR HG23 1 1
19 4128 1 1 2 THR N N 4.729 -3.664 1.820 1.00 . A A . 2 THR N 1 1
19 4129 1 1 2 THR O O 3.790 -1.144 1.748 1.00 . A A . 2 THR O 1 1
19 4130 1 1 2 THR OG1 O 5.722 -2.515 -0.576 1.00 . A A . 2 THR OG1 1 1
19 4131 1 1 3 PRO C C 4.400 1.626 1.384 1.00 . A A . 3 PRO C 1 1
19 4132 1 1 3 PRO CA C 5.127 1.154 2.643 1.00 . A A . 3 PRO CA 1 1
19 4133 1 1 3 PRO CB C 6.350 2.033 2.906 1.00 . A A . 3 PRO CB 1 1
19 4134 1 1 3 PRO CD C 7.126 -0.226 2.878 1.00 . A A . 3 PRO CD 1 1
19 4135 1 1 3 PRO CG C 7.341 1.114 3.526 1.00 . A A . 3 PRO CG 1 1
19 4136 1 1 3 PRO HA H 4.455 1.194 3.487 1.00 . A A . 3 PRO HA 1 1
19 4137 1 1 3 PRO HB2 H 6.713 2.438 1.972 1.00 . A A . 3 PRO HB2 1 1
19 4138 1 1 3 PRO HB3 H 6.085 2.837 3.577 1.00 . A A . 3 PRO HB3 1 1
19 4139 1 1 3 PRO HD2 H 7.771 -0.336 2.020 1.00 . A A . 3 PRO HD2 1 1
19 4140 1 1 3 PRO HD3 H 7.303 -1.021 3.588 1.00 . A A . 3 PRO HD3 1 1
19 4141 1 1 3 PRO HG2 H 8.343 1.467 3.332 1.00 . A A . 3 PRO HG2 1 1
19 4142 1 1 3 PRO HG3 H 7.164 1.047 4.589 1.00 . A A . 3 PRO HG3 1 1
19 4143 1 1 3 PRO N N 5.707 -0.188 2.473 1.00 . A A . 3 PRO N 1 1
19 4144 1 1 3 PRO O O 3.306 2.181 1.460 1.00 . A A . 3 PRO O 1 1
19 4145 1 1 4 ARG C C 3.097 1.049 -1.260 1.00 . A A . 4 ARG C 1 1
19 4146 1 1 4 ARG CA C 4.424 1.755 -1.053 1.00 . A A . 4 ARG CA 1 1
19 4147 1 1 4 ARG CB C 5.373 1.397 -2.194 1.00 . A A . 4 ARG CB 1 1
19 4148 1 1 4 ARG CD C 7.658 1.589 -3.195 1.00 . A A . 4 ARG CD 1 1
19 4149 1 1 4 ARG CG C 6.711 2.092 -2.117 1.00 . A A . 4 ARG CG 1 1
19 4150 1 1 4 ARG CZ C 10.098 2.070 -3.107 1.00 . A A . 4 ARG CZ 1 1
19 4151 1 1 4 ARG H H 5.874 0.913 0.244 1.00 . A A . 4 ARG H 1 1
19 4152 1 1 4 ARG HA H 4.262 2.823 -1.048 1.00 . A A . 4 ARG HA 1 1
19 4153 1 1 4 ARG HB2 H 5.544 0.330 -2.179 1.00 . A A . 4 ARG HB2 1 1
19 4154 1 1 4 ARG HB3 H 4.906 1.662 -3.131 1.00 . A A . 4 ARG HB3 1 1
19 4155 1 1 4 ARG HD2 H 7.981 0.592 -2.937 1.00 . A A . 4 ARG HD2 1 1
19 4156 1 1 4 ARG HD3 H 7.125 1.558 -4.133 1.00 . A A . 4 ARG HD3 1 1
19 4157 1 1 4 ARG HE H 8.678 3.359 -3.687 1.00 . A A . 4 ARG HE 1 1
19 4158 1 1 4 ARG HG2 H 6.569 3.156 -2.231 1.00 . A A . 4 ARG HG2 1 1
19 4159 1 1 4 ARG HG3 H 7.132 1.876 -1.146 1.00 . A A . 4 ARG HG3 1 1
19 4160 1 1 4 ARG HH11 H 9.612 0.237 -2.382 1.00 . A A . 4 ARG HH11 1 1
19 4161 1 1 4 ARG HH12 H 11.303 0.590 -2.420 1.00 . A A . 4 ARG HH12 1 1
19 4162 1 1 4 ARG HH21 H 10.918 3.818 -3.740 1.00 . A A . 4 ARG HH21 1 1
19 4163 1 1 4 ARG HH22 H 12.047 2.633 -3.175 1.00 . A A . 4 ARG HH22 1 1
19 4164 1 1 4 ARG N N 5.009 1.373 0.229 1.00 . A A . 4 ARG N 1 1
19 4165 1 1 4 ARG NE N 8.837 2.448 -3.349 1.00 . A A . 4 ARG NE 1 1
19 4166 1 1 4 ARG NH1 N 10.356 0.872 -2.597 1.00 . A A . 4 ARG NH1 1 1
19 4167 1 1 4 ARG NH2 N 11.100 2.904 -3.362 1.00 . A A . 4 ARG NH2 1 1
19 4168 1 1 4 ARG O O 2.086 1.675 -1.560 1.00 . A A . 4 ARG O 1 1
19 4169 1 1 5 GLN C C 0.838 -0.702 -0.226 1.00 . A A . 5 GLN C 1 1
19 4170 1 1 5 GLN CA C 1.918 -1.082 -1.232 1.00 . A A . 5 GLN CA 1 1
19 4171 1 1 5 GLN CB C 2.266 -2.558 -1.076 1.00 . A A . 5 GLN CB 1 1
19 4172 1 1 5 GLN CD C 3.648 -4.496 -1.884 1.00 . A A . 5 GLN CD 1 1
19 4173 1 1 5 GLN CG C 3.093 -3.127 -2.213 1.00 . A A . 5 GLN CG 1 1
19 4174 1 1 5 GLN H H 3.963 -0.677 -0.808 1.00 . A A . 5 GLN H 1 1
19 4175 1 1 5 GLN HA H 1.537 -0.918 -2.229 1.00 . A A . 5 GLN HA 1 1
19 4176 1 1 5 GLN HB2 H 2.825 -2.686 -0.160 1.00 . A A . 5 GLN HB2 1 1
19 4177 1 1 5 GLN HB3 H 1.347 -3.125 -1.009 1.00 . A A . 5 GLN HB3 1 1
19 4178 1 1 5 GLN HE21 H 3.563 -5.017 -3.792 1.00 . A A . 5 GLN HE21 1 1
19 4179 1 1 5 GLN HE22 H 4.162 -6.221 -2.702 1.00 . A A . 5 GLN HE22 1 1
19 4180 1 1 5 GLN HG2 H 2.470 -3.207 -3.092 1.00 . A A . 5 GLN HG2 1 1
19 4181 1 1 5 GLN HG3 H 3.915 -2.457 -2.414 1.00 . A A . 5 GLN HG3 1 1
19 4182 1 1 5 GLN N N 3.114 -0.257 -1.069 1.00 . A A . 5 GLN N 1 1
19 4183 1 1 5 GLN NE2 N 3.808 -5.325 -2.891 1.00 . A A . 5 GLN NE2 1 1
19 4184 1 1 5 GLN O O -0.337 -0.634 -0.569 1.00 . A A . 5 GLN O 1 1
19 4185 1 1 5 GLN OE1 O 3.936 -4.799 -0.723 1.00 . A A . 5 GLN OE1 1 1
19 4186 1 1 6 ALA C C -0.434 1.181 1.777 1.00 . A A . 6 ALA C 1 1
19 4187 1 1 6 ALA CA C 0.318 -0.107 2.079 1.00 . A A . 6 ALA CA 1 1
19 4188 1 1 6 ALA CB C 1.055 0.012 3.406 1.00 . A A . 6 ALA CB 1 1
19 4189 1 1 6 ALA H H 2.213 -0.495 1.213 1.00 . A A . 6 ALA H 1 1
19 4190 1 1 6 ALA HA H -0.395 -0.914 2.164 1.00 . A A . 6 ALA HA 1 1
19 4191 1 1 6 ALA HB1 H 0.342 0.167 4.201 1.00 . A A . 6 ALA HB1 1 1
19 4192 1 1 6 ALA HB2 H 1.736 0.850 3.364 1.00 . A A . 6 ALA HB2 1 1
19 4193 1 1 6 ALA HB3 H 1.613 -0.894 3.593 1.00 . A A . 6 ALA HB3 1 1
19 4194 1 1 6 ALA N N 1.250 -0.446 1.011 1.00 . A A . 6 ALA N 1 1
19 4195 1 1 6 ALA O O -1.644 1.262 1.978 1.00 . A A . 6 ALA O 1 1
19 4196 1 1 7 ARG C C -1.172 3.317 -0.302 1.00 . A A . 7 ARG C 1 1
19 4197 1 1 7 ARG CA C -0.339 3.461 0.957 1.00 . A A . 7 ARG CA 1 1
19 4198 1 1 7 ARG CB C 0.717 4.541 0.767 1.00 . A A . 7 ARG CB 1 1
19 4199 1 1 7 ARG CD C 2.709 5.746 1.696 1.00 . A A . 7 ARG CD 1 1
19 4200 1 1 7 ARG CG C 1.639 4.703 1.958 1.00 . A A . 7 ARG CG 1 1
19 4201 1 1 7 ARG CZ C 4.731 5.698 0.261 1.00 . A A . 7 ARG CZ 1 1
19 4202 1 1 7 ARG H H 1.250 2.070 1.178 1.00 . A A . 7 ARG H 1 1
19 4203 1 1 7 ARG HA H -0.990 3.742 1.772 1.00 . A A . 7 ARG HA 1 1
19 4204 1 1 7 ARG HB2 H 1.317 4.291 -0.094 1.00 . A A . 7 ARG HB2 1 1
19 4205 1 1 7 ARG HB3 H 0.224 5.485 0.590 1.00 . A A . 7 ARG HB3 1 1
19 4206 1 1 7 ARG HD2 H 2.238 6.714 1.630 1.00 . A A . 7 ARG HD2 1 1
19 4207 1 1 7 ARG HD3 H 3.410 5.738 2.516 1.00 . A A . 7 ARG HD3 1 1
19 4208 1 1 7 ARG HE H 2.898 5.132 -0.301 1.00 . A A . 7 ARG HE 1 1
19 4209 1 1 7 ARG HG2 H 1.058 5.000 2.819 1.00 . A A . 7 ARG HG2 1 1
19 4210 1 1 7 ARG HG3 H 2.113 3.750 2.149 1.00 . A A . 7 ARG HG3 1 1
19 4211 1 1 7 ARG HH11 H 5.088 6.365 2.148 1.00 . A A . 7 ARG HH11 1 1
19 4212 1 1 7 ARG HH12 H 6.468 6.329 1.109 1.00 . A A . 7 ARG HH12 1 1
19 4213 1 1 7 ARG HH21 H 4.700 5.098 -1.675 1.00 . A A . 7 ARG HH21 1 1
19 4214 1 1 7 ARG HH22 H 6.249 5.604 -1.087 1.00 . A A . 7 ARG HH22 1 1
19 4215 1 1 7 ARG N N 0.281 2.186 1.302 1.00 . A A . 7 ARG N 1 1
19 4216 1 1 7 ARG NE N 3.430 5.483 0.449 1.00 . A A . 7 ARG NE 1 1
19 4217 1 1 7 ARG NH1 N 5.487 6.166 1.249 1.00 . A A . 7 ARG NH1 1 1
19 4218 1 1 7 ARG NH2 N 5.271 5.447 -0.926 1.00 . A A . 7 ARG NH2 1 1
19 4219 1 1 7 ARG O O -2.295 3.816 -0.380 1.00 . A A . 7 ARG O 1 1
19 4220 1 1 8 ALA C C -2.612 1.658 -2.350 1.00 . A A . 8 ALA C 1 1
19 4221 1 1 8 ALA CA C -1.292 2.386 -2.555 1.00 . A A . 8 ALA CA 1 1
19 4222 1 1 8 ALA CB C -0.396 1.606 -3.506 1.00 . A A . 8 ALA CB 1 1
19 4223 1 1 8 ALA H H 0.286 2.246 -1.147 1.00 . A A . 8 ALA H 1 1
19 4224 1 1 8 ALA HA H -1.496 3.351 -2.997 1.00 . A A . 8 ALA HA 1 1
19 4225 1 1 8 ALA HB1 H 0.535 2.137 -3.641 1.00 . A A . 8 ALA HB1 1 1
19 4226 1 1 8 ALA HB2 H -0.890 1.497 -4.460 1.00 . A A . 8 ALA HB2 1 1
19 4227 1 1 8 ALA HB3 H -0.196 0.629 -3.090 1.00 . A A . 8 ALA HB3 1 1
19 4228 1 1 8 ALA N N -0.615 2.616 -1.283 1.00 . A A . 8 ALA N 1 1
19 4229 1 1 8 ALA O O -3.610 1.973 -2.997 1.00 . A A . 8 ALA O 1 1
19 4230 1 1 9 ALA C C -4.895 0.852 -0.582 1.00 . A A . 9 ALA C 1 1
19 4231 1 1 9 ALA CA C -3.819 -0.068 -1.135 1.00 . A A . 9 ALA CA 1 1
19 4232 1 1 9 ALA CB C -3.507 -1.175 -0.137 1.00 . A A . 9 ALA CB 1 1
19 4233 1 1 9 ALA H H -1.776 0.459 -0.983 1.00 . A A . 9 ALA H 1 1
19 4234 1 1 9 ALA HA H -4.177 -0.522 -2.048 1.00 . A A . 9 ALA HA 1 1
19 4235 1 1 9 ALA HB1 H -2.757 -1.832 -0.553 1.00 . A A . 9 ALA HB1 1 1
19 4236 1 1 9 ALA HB2 H -4.405 -1.738 0.071 1.00 . A A . 9 ALA HB2 1 1
19 4237 1 1 9 ALA HB3 H -3.137 -0.739 0.779 1.00 . A A . 9 ALA HB3 1 1
19 4238 1 1 9 ALA N N -2.615 0.685 -1.446 1.00 . A A . 9 ALA N 1 1
19 4239 1 1 9 ALA O O -6.052 0.800 -1.001 1.00 . A A . 9 ALA O 1 1
19 4240 1 1 10 ARG C C -5.934 3.660 -0.088 1.00 . A A . 10 ARG C 1 1
19 4241 1 1 10 ARG CA C -5.426 2.661 0.944 1.00 . A A . 10 ARG CA 1 1
19 4242 1 1 10 ARG CB C -4.755 3.393 2.105 1.00 . A A . 10 ARG CB 1 1
19 4243 1 1 10 ARG CD C -5.406 1.664 3.810 1.00 . A A . 10 ARG CD 1 1
19 4244 1 1 10 ARG CG C -4.267 2.474 3.217 1.00 . A A . 10 ARG CG 1 1
19 4245 1 1 10 ARG CZ C -5.289 -0.425 5.138 1.00 . A A . 10 ARG CZ 1 1
19 4246 1 1 10 ARG H H -3.556 1.730 0.604 1.00 . A A . 10 ARG H 1 1
19 4247 1 1 10 ARG HA H -6.266 2.098 1.322 1.00 . A A . 10 ARG HA 1 1
19 4248 1 1 10 ARG HB2 H -3.906 3.942 1.724 1.00 . A A . 10 ARG HB2 1 1
19 4249 1 1 10 ARG HB3 H -5.461 4.091 2.528 1.00 . A A . 10 ARG HB3 1 1
19 4250 1 1 10 ARG HD2 H -6.176 2.346 4.136 1.00 . A A . 10 ARG HD2 1 1
19 4251 1 1 10 ARG HD3 H -5.802 1.011 3.049 1.00 . A A . 10 ARG HD3 1 1
19 4252 1 1 10 ARG HE H -4.436 1.321 5.638 1.00 . A A . 10 ARG HE 1 1
19 4253 1 1 10 ARG HG2 H -3.534 1.793 2.811 1.00 . A A . 10 ARG HG2 1 1
19 4254 1 1 10 ARG HG3 H -3.814 3.069 3.994 1.00 . A A . 10 ARG HG3 1 1
19 4255 1 1 10 ARG HH11 H -6.287 -0.635 3.375 1.00 . A A . 10 ARG HH11 1 1
19 4256 1 1 10 ARG HH12 H -6.218 -2.051 4.360 1.00 . A A . 10 ARG HH12 1 1
19 4257 1 1 10 ARG HH21 H -4.362 -0.568 6.941 1.00 . A A . 10 ARG HH21 1 1
19 4258 1 1 10 ARG HH22 H -5.128 -2.020 6.383 1.00 . A A . 10 ARG HH22 1 1
19 4259 1 1 10 ARG N N -4.500 1.721 0.333 1.00 . A A . 10 ARG N 1 1
19 4260 1 1 10 ARG NE N -4.975 0.860 4.955 1.00 . A A . 10 ARG NE 1 1
19 4261 1 1 10 ARG NH1 N -5.986 -1.084 4.219 1.00 . A A . 10 ARG NH1 1 1
19 4262 1 1 10 ARG NH2 N -4.895 -1.054 6.241 1.00 . A A . 10 ARG NH2 1 1
19 4263 1 1 10 ARG O O -7.113 4.007 -0.102 1.00 . A A . 10 ARG O 1 1
19 4264 1 1 11 ALA C C -6.323 4.423 -3.038 1.00 . A A . 11 ALA C 1 1
19 4265 1 1 11 ALA CA C -5.383 5.053 -2.007 1.00 . A A . 11 ALA CA 1 1
19 4266 1 1 11 ALA CB C -4.125 5.573 -2.682 1.00 . A A . 11 ALA CB 1 1
19 4267 1 1 11 ALA H H -4.106 3.797 -0.880 1.00 . A A . 11 ALA H 1 1
19 4268 1 1 11 ALA HA H -5.888 5.889 -1.544 1.00 . A A . 11 ALA HA 1 1
19 4269 1 1 11 ALA HB1 H -3.615 4.756 -3.169 1.00 . A A . 11 ALA HB1 1 1
19 4270 1 1 11 ALA HB2 H -3.472 6.012 -1.940 1.00 . A A . 11 ALA HB2 1 1
19 4271 1 1 11 ALA HB3 H -4.391 6.320 -3.415 1.00 . A A . 11 ALA HB3 1 1
19 4272 1 1 11 ALA N N -5.038 4.106 -0.955 1.00 . A A . 11 ALA N 1 1
19 4273 1 1 11 ALA O O -7.117 5.118 -3.672 1.00 . A A . 11 ALA O 1 1
19 4274 1 1 12 ALA C C -8.428 2.067 -3.544 1.00 . A A . 12 ALA C 1 1
19 4275 1 1 12 ALA CA C -7.072 2.401 -4.152 1.00 . A A . 12 ALA CA 1 1
19 4276 1 1 12 ALA CB C -6.380 1.136 -4.632 1.00 . A A . 12 ALA CB 1 1
19 4277 1 1 12 ALA H H -5.568 2.611 -2.676 1.00 . A A . 12 ALA H 1 1
19 4278 1 1 12 ALA HA H -7.224 3.046 -5.004 1.00 . A A . 12 ALA HA 1 1
19 4279 1 1 12 ALA HB1 H -6.247 0.461 -3.800 1.00 . A A . 12 ALA HB1 1 1
19 4280 1 1 12 ALA HB2 H -5.417 1.387 -5.048 1.00 . A A . 12 ALA HB2 1 1
19 4281 1 1 12 ALA HB3 H -6.986 0.658 -5.388 1.00 . A A . 12 ALA HB3 1 1
19 4282 1 1 12 ALA N N -6.229 3.112 -3.201 1.00 . A A . 12 ALA N 1 1
19 4283 1 1 12 ALA O O -9.456 2.134 -4.219 1.00 . A A . 12 ALA O 1 1
19 4284 1 1 13 DAL C C -9.615 -0.036 -1.019 1.00 . A A . 13 DAL C 1 1
19 4285 1 1 13 DAL CA C -9.670 1.379 -1.582 1.00 . A A . 13 DAL CA 1 1
19 4286 1 1 13 DAL CB C -9.956 2.380 -0.476 1.00 . A A . 13 DAL CB 1 1
19 4287 1 1 13 DAL H H -7.584 1.690 -1.776 1.00 . A A . 13 DAL H 1 1
19 4288 1 1 13 DAL HA H -10.474 1.435 -2.302 1.00 . A A . 13 DAL HA 1 1
19 4289 1 1 13 DAL HB1 H -10.903 2.146 -0.012 1.00 . A A . 13 DAL HB1 1 1
19 4290 1 1 13 DAL HB2 H -9.998 3.376 -0.893 1.00 . A A . 13 DAL HB2 1 1
19 4291 1 1 13 DAL HB3 H -9.172 2.333 0.265 1.00 . A A . 13 DAL HB3 1 1
19 4292 1 1 13 DAL N N -8.432 1.720 -2.269 1.00 . A A . 13 DAL N 1 1
19 4293 1 1 13 DAL O O -10.631 -0.585 -0.588 1.00 . A A . 13 DAL O 1 1
19 4294 1 1 14 CYS C C -8.011 -1.942 0.990 1.00 . A A . 14 CYS C 1 1
19 4295 1 1 14 CYS CA C -8.237 -1.964 -0.520 1.00 . A A . 14 CYS CA 1 1
19 4296 1 1 14 CYS CB C -7.053 -2.626 -1.227 1.00 . A A . 14 CYS CB 1 1
19 4297 1 1 14 CYS H H -7.658 -0.137 -1.387 1.00 . A A . 14 CYS H 1 1
19 4298 1 1 14 CYS HA H -9.130 -2.531 -0.729 1.00 . A A . 14 CYS HA 1 1
19 4299 1 1 14 CYS HB2 H -6.195 -2.592 -0.571 1.00 . A A . 14 CYS HB2 1 1
19 4300 1 1 14 CYS HB3 H -7.298 -3.657 -1.428 1.00 . A A . 14 CYS HB3 1 1
19 4301 1 1 14 CYS N N -8.434 -0.620 -1.029 1.00 . A A . 14 CYS N 1 1
19 4302 1 1 14 CYS O O -6.946 -1.537 1.468 1.00 . A A . 14 CYS O 1 1
19 4303 1 1 14 CYS SG S -6.602 -1.838 -2.788 1.00 . A A . 14 CYS SG 1 1
19 4304 1 1 15 NH2 HN1 H -8.827 -2.599 2.667 1.00 . A A . 15 NH2 HN1 1 1
19 4305 1 1 15 NH2 HN2 H -9.927 -2.230 1.391 1.00 . A A . 15 NH2 HN2 1 1
19 4306 1 1 15 NH2 N N -9.018 -2.350 1.740 1.00 . A A . 15 NH2 N 1 1
19 4307 2 2 1 . CB1 C -0.225 -5.716 1.055 1.00 . B A . 101 B0I CB1 1 1
19 4308 2 2 1 . CB2 C -5.701 -3.173 -3.597 1.00 . B A . 101 B0I CB2 1 1
19 4309 2 2 1 . CD1 C -1.102 -4.690 -1.042 1.00 . B A . 101 B0I CD1 1 1
19 4310 2 2 1 . CD2 C 0.497 -6.437 -1.231 1.00 . B A . 101 B0I CD2 1 1
19 4311 2 2 1 . CD3 C -3.362 -3.860 -3.012 1.00 . B A . 101 B0I CD3 1 1
19 4312 2 2 1 . CD4 C -3.672 -1.831 -4.221 1.00 . B A . 101 B0I CD4 1 1
19 4313 2 2 1 . CE1 C -1.158 -4.587 -2.420 1.00 . B A . 101 B0I CE1 1 1
19 4314 2 2 1 . CE2 C 0.448 -6.343 -2.606 1.00 . B A . 101 B0I CE2 1 1
19 4315 2 2 1 . CE3 C -1.995 -3.661 -3.019 1.00 . B A . 101 B0I CE3 1 1
19 4316 2 2 1 . CE4 C -2.304 -1.625 -4.233 1.00 . B A . 101 B0I CE4 1 1
19 4317 2 2 1 . CG1 C -0.279 -5.610 -0.437 1.00 . B A . 101 B0I CG1 1 1
19 4318 2 2 1 . CG2 C -4.215 -2.950 -3.610 1.00 . B A . 101 B0I CG2 1 1
19 4319 2 2 1 . CZ1 C -0.381 -5.417 -3.202 1.00 . B A . 101 B0I CZ1 1 1
19 4320 2 2 1 . CZ2 C -1.465 -2.541 -3.630 1.00 . B A . 101 B0I CZ2 1 1
19 4321 2 2 1 . H1 H 0.753 -6.072 1.319 1.00 . B A . 101 B0I H1 1 1
19 4322 2 2 1 . H2 H -5.901 -4.098 -3.076 1.00 . B A . 101 B0I H2 1 1
19 4323 2 2 1 . HB11 H -0.973 -6.426 1.376 1.00 . B A . 101 B0I HB11 1 1
19 4324 2 2 1 . HB21 H -6.039 -3.253 -4.620 1.00 . B A . 101 B0I HB21 1 1
19 4325 2 2 1 . HD1 H -1.701 -4.048 -0.417 1.00 . B A . 101 B0I HD1 1 1
19 4326 2 2 1 . HD2 H 1.147 -7.164 -0.765 1.00 . B A . 101 B0I HD2 1 1
19 4327 2 2 1 . HD3 H -3.773 -4.736 -2.533 1.00 . B A . 101 B0I HD3 1 1
19 4328 2 2 1 . HD4 H -4.329 -1.114 -4.692 1.00 . B A . 101 B0I HD4 1 1
19 4329 2 2 1 . HE2 H 1.058 -6.994 -3.214 1.00 . B A . 101 B0I HE2 1 1
19 4330 2 2 1 . HE4 H -1.894 -0.748 -4.712 1.00 . B A . 101 B0I HE4 1 1
19 4331 2 2 1 . HZ1 H -0.423 -5.340 -4.277 1.00 . B A . 101 B0I HZ1 1 1
19 4332 2 2 1 . HZ2 H -0.397 -2.383 -3.638 1.00 . B A . 101 B0I HZ2 1 1
20 4333 1 1 1 . C C 4.285 -4.299 2.881 1.00 . A A . 1 H00 C 1 1
20 4334 1 1 1 . CA C 3.365 -5.459 2.561 1.00 . A A . 1 H00 CA 1 1
20 4335 1 1 1 . CB C 1.928 -5.105 2.912 1.00 . A A . 1 H00 CB 1 1
20 4336 1 1 1 . CG C 1.369 -4.054 1.969 1.00 . A A . 1 H00 CG 1 1
20 4337 1 1 1 . HA1 H 3.667 -6.324 3.135 1.00 . A A . 1 H00 HA1 1 1
20 4338 1 1 1 . HA2 H 3.430 -5.683 1.506 1.00 . A A . 1 H00 HA2 1 1
20 4339 1 1 1 . HB1 H 1.899 -4.723 3.921 1.00 . A A . 1 H00 HB1 1 1
20 4340 1 1 1 . HB2 H 1.320 -5.996 2.842 1.00 . A A . 1 H00 HB2 1 1
20 4341 1 1 1 . HG1 H 1.517 -4.390 0.952 1.00 . A A . 1 H00 HG1 1 1
20 4342 1 1 1 . HG2 H 1.907 -3.130 2.124 1.00 . A A . 1 H00 HG2 1 1
20 4343 1 1 1 . O O 4.507 -3.974 4.050 1.00 . A A . 1 H00 O 1 1
20 4344 1 1 1 . SD S -0.391 -3.743 2.225 1.00 . A A . 1 H00 SD 1 1
20 4345 1 1 2 THR C C 4.889 -1.260 2.183 1.00 . A A . 2 THR C 1 1
20 4346 1 1 2 THR CA C 5.709 -2.543 2.040 1.00 . A A . 2 THR CA 1 1
20 4347 1 1 2 THR CB C 6.689 -2.398 0.856 1.00 . A A . 2 THR CB 1 1
20 4348 1 1 2 THR CG2 C 7.670 -3.560 0.824 1.00 . A A . 2 THR CG2 1 1
20 4349 1 1 2 THR H H 4.630 -3.983 0.941 1.00 . A A . 2 THR H 1 1
20 4350 1 1 2 THR HA H 6.277 -2.704 2.944 1.00 . A A . 2 THR HA 1 1
20 4351 1 1 2 THR HB H 7.241 -1.478 0.973 1.00 . A A . 2 THR HB 1 1
20 4352 1 1 2 THR HG1 H 6.316 -3.009 -0.989 1.00 . A A . 2 THR HG1 1 1
20 4353 1 1 2 THR HG21 H 8.235 -3.582 1.745 1.00 . A A . 2 THR HG21 1 1
20 4354 1 1 2 THR HG22 H 8.345 -3.437 -0.010 1.00 . A A . 2 THR HG22 1 1
20 4355 1 1 2 THR HG23 H 7.127 -4.487 0.714 1.00 . A A . 2 THR HG23 1 1
20 4356 1 1 2 THR N N 4.829 -3.678 1.853 1.00 . A A . 2 THR N 1 1
20 4357 1 1 2 THR O O 3.733 -1.212 1.751 1.00 . A A . 2 THR O 1 1
20 4358 1 1 2 THR OG1 O 5.959 -2.350 -0.378 1.00 . A A . 2 THR OG1 1 1
20 4359 1 1 3 PRO C C 4.240 1.629 1.652 1.00 . A A . 3 PRO C 1 1
20 4360 1 1 3 PRO CA C 4.787 1.088 2.972 1.00 . A A . 3 PRO CA 1 1
20 4361 1 1 3 PRO CB C 5.894 2.000 3.502 1.00 . A A . 3 PRO CB 1 1
20 4362 1 1 3 PRO CD C 6.817 -0.197 3.403 1.00 . A A . 3 PRO CD 1 1
20 4363 1 1 3 PRO CG C 6.831 1.078 4.197 1.00 . A A . 3 PRO CG 1 1
20 4364 1 1 3 PRO HA H 3.987 1.022 3.695 1.00 . A A . 3 PRO HA 1 1
20 4365 1 1 3 PRO HB2 H 6.372 2.505 2.675 1.00 . A A . 3 PRO HB2 1 1
20 4366 1 1 3 PRO HB3 H 5.475 2.725 4.184 1.00 . A A . 3 PRO HB3 1 1
20 4367 1 1 3 PRO HD2 H 7.582 -0.174 2.641 1.00 . A A . 3 PRO HD2 1 1
20 4368 1 1 3 PRO HD3 H 6.954 -1.049 4.054 1.00 . A A . 3 PRO HD3 1 1
20 4369 1 1 3 PRO HG2 H 7.824 1.503 4.210 1.00 . A A . 3 PRO HG2 1 1
20 4370 1 1 3 PRO HG3 H 6.485 0.894 5.205 1.00 . A A . 3 PRO HG3 1 1
20 4371 1 1 3 PRO N N 5.468 -0.206 2.800 1.00 . A A . 3 PRO N 1 1
20 4372 1 1 3 PRO O O 3.201 2.292 1.623 1.00 . A A . 3 PRO O 1 1
20 4373 1 1 4 ARG C C 3.212 1.080 -1.137 1.00 . A A . 4 ARG C 1 1
20 4374 1 1 4 ARG CA C 4.525 1.756 -0.769 1.00 . A A . 4 ARG CA 1 1
20 4375 1 1 4 ARG CB C 5.592 1.387 -1.800 1.00 . A A . 4 ARG CB 1 1
20 4376 1 1 4 ARG CD C 8.008 1.406 -2.473 1.00 . A A . 4 ARG CD 1 1
20 4377 1 1 4 ARG CG C 6.980 1.888 -1.459 1.00 . A A . 4 ARG CG 1 1
20 4378 1 1 4 ARG CZ C 9.140 -0.802 -2.303 1.00 . A A . 4 ARG CZ 1 1
20 4379 1 1 4 ARG H H 5.765 0.808 0.663 1.00 . A A . 4 ARG H 1 1
20 4380 1 1 4 ARG HA H 4.389 2.826 -0.761 1.00 . A A . 4 ARG HA 1 1
20 4381 1 1 4 ARG HB2 H 5.634 0.312 -1.887 1.00 . A A . 4 ARG HB2 1 1
20 4382 1 1 4 ARG HB3 H 5.308 1.803 -2.757 1.00 . A A . 4 ARG HB3 1 1
20 4383 1 1 4 ARG HD2 H 7.747 1.803 -3.443 1.00 . A A . 4 ARG HD2 1 1
20 4384 1 1 4 ARG HD3 H 8.980 1.774 -2.185 1.00 . A A . 4 ARG HD3 1 1
20 4385 1 1 4 ARG HE H 7.225 -0.513 -2.832 1.00 . A A . 4 ARG HE 1 1
20 4386 1 1 4 ARG HG2 H 6.974 2.968 -1.447 1.00 . A A . 4 ARG HG2 1 1
20 4387 1 1 4 ARG HG3 H 7.247 1.513 -0.482 1.00 . A A . 4 ARG HG3 1 1
20 4388 1 1 4 ARG HH11 H 10.338 0.772 -1.825 1.00 . A A . 4 ARG HH11 1 1
20 4389 1 1 4 ARG HH12 H 11.094 -0.779 -1.743 1.00 . A A . 4 ARG HH12 1 1
20 4390 1 1 4 ARG HH21 H 8.232 -2.576 -2.709 1.00 . A A . 4 ARG HH21 1 1
20 4391 1 1 4 ARG HH22 H 9.893 -2.690 -2.240 1.00 . A A . 4 ARG HH22 1 1
20 4392 1 1 4 ARG N N 4.944 1.332 0.562 1.00 . A A . 4 ARG N 1 1
20 4393 1 1 4 ARG NE N 8.055 -0.060 -2.557 1.00 . A A . 4 ARG NE 1 1
20 4394 1 1 4 ARG NH1 N 10.277 -0.224 -1.925 1.00 . A A . 4 ARG NH1 1 1
20 4395 1 1 4 ARG NH2 N 9.083 -2.123 -2.425 1.00 . A A . 4 ARG NH2 1 1
20 4396 1 1 4 ARG O O 2.250 1.735 -1.542 1.00 . A A . 4 ARG O 1 1
20 4397 1 1 5 GLN C C 0.835 -0.636 -0.361 1.00 . A A . 5 GLN C 1 1
20 4398 1 1 5 GLN CA C 1.988 -1.030 -1.268 1.00 . A A . 5 GLN CA 1 1
20 4399 1 1 5 GLN CB C 2.284 -2.516 -1.102 1.00 . A A . 5 GLN CB 1 1
20 4400 1 1 5 GLN CD C 3.676 -4.499 -1.780 1.00 . A A . 5 GLN CD 1 1
20 4401 1 1 5 GLN CG C 3.317 -3.057 -2.069 1.00 . A A . 5 GLN CG 1 1
20 4402 1 1 5 GLN H H 3.976 -0.690 -0.622 1.00 . A A . 5 GLN H 1 1
20 4403 1 1 5 GLN HA H 1.710 -0.839 -2.293 1.00 . A A . 5 GLN HA 1 1
20 4404 1 1 5 GLN HB2 H 2.645 -2.686 -0.098 1.00 . A A . 5 GLN HB2 1 1
20 4405 1 1 5 GLN HB3 H 1.366 -3.069 -1.244 1.00 . A A . 5 GLN HB3 1 1
20 4406 1 1 5 GLN HE21 H 4.019 -4.817 -3.703 1.00 . A A . 5 GLN HE21 1 1
20 4407 1 1 5 GLN HE22 H 4.258 -6.177 -2.657 1.00 . A A . 5 GLN HE22 1 1
20 4408 1 1 5 GLN HG2 H 2.924 -2.994 -3.072 1.00 . A A . 5 GLN HG2 1 1
20 4409 1 1 5 GLN HG3 H 4.211 -2.455 -1.993 1.00 . A A . 5 GLN HG3 1 1
20 4410 1 1 5 GLN N N 3.177 -0.237 -0.966 1.00 . A A . 5 GLN N 1 1
20 4411 1 1 5 GLN NE2 N 4.016 -5.239 -2.813 1.00 . A A . 5 GLN NE2 1 1
20 4412 1 1 5 GLN O O -0.301 -0.517 -0.806 1.00 . A A . 5 GLN O 1 1
20 4413 1 1 5 GLN OE1 O 3.642 -4.943 -0.629 1.00 . A A . 5 GLN OE1 1 1
20 4414 1 1 6 ALA C C -0.483 1.302 1.531 1.00 . A A . 6 ALA C 1 1
20 4415 1 1 6 ALA CA C 0.140 -0.039 1.895 1.00 . A A . 6 ALA CA 1 1
20 4416 1 1 6 ALA CB C 0.755 0.019 3.286 1.00 . A A . 6 ALA CB 1 1
20 4417 1 1 6 ALA H H 2.074 -0.550 1.203 1.00 . A A . 6 ALA H 1 1
20 4418 1 1 6 ALA HA H -0.633 -0.794 1.898 1.00 . A A . 6 ALA HA 1 1
20 4419 1 1 6 ALA HB1 H 1.188 -0.940 3.529 1.00 . A A . 6 ALA HB1 1 1
20 4420 1 1 6 ALA HB2 H -0.010 0.262 4.009 1.00 . A A . 6 ALA HB2 1 1
20 4421 1 1 6 ALA HB3 H 1.524 0.776 3.307 1.00 . A A . 6 ALA HB3 1 1
20 4422 1 1 6 ALA N N 1.143 -0.429 0.914 1.00 . A A . 6 ALA N 1 1
20 4423 1 1 6 ALA O O -1.682 1.513 1.716 1.00 . A A . 6 ALA O 1 1
20 4424 1 1 7 ARG C C -1.012 3.371 -0.638 1.00 . A A . 7 ARG C 1 1
20 4425 1 1 7 ARG CA C -0.124 3.495 0.595 1.00 . A A . 7 ARG CA 1 1
20 4426 1 1 7 ARG CB C 1.076 4.393 0.307 1.00 . A A . 7 ARG CB 1 1
20 4427 1 1 7 ARG CD C -0.074 6.526 0.912 1.00 . A A . 7 ARG CD 1 1
20 4428 1 1 7 ARG CG C 0.701 5.771 -0.158 1.00 . A A . 7 ARG CG 1 1
20 4429 1 1 7 ARG CZ C 0.116 6.798 3.370 1.00 . A A . 7 ARG CZ 1 1
20 4430 1 1 7 ARG H H 1.278 1.992 0.864 1.00 . A A . 7 ARG H 1 1
20 4431 1 1 7 ARG HA H -0.696 3.920 1.405 1.00 . A A . 7 ARG HA 1 1
20 4432 1 1 7 ARG HB2 H 1.664 4.488 1.208 1.00 . A A . 7 ARG HB2 1 1
20 4433 1 1 7 ARG HB3 H 1.680 3.929 -0.459 1.00 . A A . 7 ARG HB3 1 1
20 4434 1 1 7 ARG HD2 H -0.270 7.528 0.560 1.00 . A A . 7 ARG HD2 1 1
20 4435 1 1 7 ARG HD3 H -1.009 6.016 1.088 1.00 . A A . 7 ARG HD3 1 1
20 4436 1 1 7 ARG HE H 1.648 6.501 2.110 1.00 . A A . 7 ARG HE 1 1
20 4437 1 1 7 ARG HG2 H 1.592 6.322 -0.421 1.00 . A A . 7 ARG HG2 1 1
20 4438 1 1 7 ARG HG3 H 0.074 5.639 -1.021 1.00 . A A . 7 ARG HG3 1 1
20 4439 1 1 7 ARG HH11 H -1.784 6.902 2.665 1.00 . A A . 7 ARG HH11 1 1
20 4440 1 1 7 ARG HH12 H -1.626 7.098 4.377 1.00 . A A . 7 ARG HH12 1 1
20 4441 1 1 7 ARG HH21 H 1.878 6.734 4.382 1.00 . A A . 7 ARG HH21 1 1
20 4442 1 1 7 ARG HH22 H 0.475 6.997 5.357 1.00 . A A . 7 ARG HH22 1 1
20 4443 1 1 7 ARG N N 0.333 2.201 0.999 1.00 . A A . 7 ARG N 1 1
20 4444 1 1 7 ARG NE N 0.670 6.603 2.171 1.00 . A A . 7 ARG NE 1 1
20 4445 1 1 7 ARG NH1 N -1.200 6.941 3.482 1.00 . A A . 7 ARG NH1 1 1
20 4446 1 1 7 ARG NH2 N 0.880 6.845 4.453 1.00 . A A . 7 ARG NH2 1 1
20 4447 1 1 7 ARG O O -2.067 3.998 -0.722 1.00 . A A . 7 ARG O 1 1
20 4448 1 1 8 ALA C C -2.663 1.628 -2.499 1.00 . A A . 8 ALA C 1 1
20 4449 1 1 8 ALA CA C -1.331 2.311 -2.801 1.00 . A A . 8 ALA CA 1 1
20 4450 1 1 8 ALA CB C -0.509 1.478 -3.771 1.00 . A A . 8 ALA CB 1 1
20 4451 1 1 8 ALA H H 0.274 2.075 -1.448 1.00 . A A . 8 ALA H 1 1
20 4452 1 1 8 ALA HA H -1.526 3.271 -3.259 1.00 . A A . 8 ALA HA 1 1
20 4453 1 1 8 ALA HB1 H -1.049 1.372 -4.701 1.00 . A A . 8 ALA HB1 1 1
20 4454 1 1 8 ALA HB2 H -0.332 0.501 -3.345 1.00 . A A . 8 ALA HB2 1 1
20 4455 1 1 8 ALA HB3 H 0.435 1.967 -3.956 1.00 . A A . 8 ALA HB3 1 1
20 4456 1 1 8 ALA N N -0.582 2.544 -1.579 1.00 . A A . 8 ALA N 1 1
20 4457 1 1 8 ALA O O -3.677 1.900 -3.149 1.00 . A A . 8 ALA O 1 1
20 4458 1 1 9 ALA C C -4.870 1.000 -0.516 1.00 . A A . 9 ALA C 1 1
20 4459 1 1 9 ALA CA C -3.846 0.035 -1.086 1.00 . A A . 9 ALA CA 1 1
20 4460 1 1 9 ALA CB C -3.498 -1.030 -0.060 1.00 . A A . 9 ALA CB 1 1
20 4461 1 1 9 ALA H H -1.799 0.554 -1.051 1.00 . A A . 9 ALA H 1 1
20 4462 1 1 9 ALA HA H -4.267 -0.453 -1.953 1.00 . A A . 9 ALA HA 1 1
20 4463 1 1 9 ALA HB1 H -4.376 -1.616 0.167 1.00 . A A . 9 ALA HB1 1 1
20 4464 1 1 9 ALA HB2 H -3.140 -0.556 0.842 1.00 . A A . 9 ALA HB2 1 1
20 4465 1 1 9 ALA HB3 H -2.728 -1.673 -0.459 1.00 . A A . 9 ALA HB3 1 1
20 4466 1 1 9 ALA N N -2.651 0.744 -1.506 1.00 . A A . 9 ALA N 1 1
20 4467 1 1 9 ALA O O -6.053 0.927 -0.846 1.00 . A A . 9 ALA O 1 1
20 4468 1 1 10 ARG C C -5.794 3.883 -0.120 1.00 . A A . 10 ARG C 1 1
20 4469 1 1 10 ARG CA C -5.283 2.912 0.933 1.00 . A A . 10 ARG CA 1 1
20 4470 1 1 10 ARG CB C -4.559 3.680 2.041 1.00 . A A . 10 ARG CB 1 1
20 4471 1 1 10 ARG CD C -3.527 3.669 4.324 1.00 . A A . 10 ARG CD 1 1
20 4472 1 1 10 ARG CG C -4.149 2.824 3.227 1.00 . A A . 10 ARG CG 1 1
20 4473 1 1 10 ARG CZ C -3.007 3.291 6.719 1.00 . A A . 10 ARG CZ 1 1
20 4474 1 1 10 ARG H H -3.451 1.915 0.556 1.00 . A A . 10 ARG H 1 1
20 4475 1 1 10 ARG HA H -6.126 2.391 1.362 1.00 . A A . 10 ARG HA 1 1
20 4476 1 1 10 ARG HB2 H -3.668 4.127 1.626 1.00 . A A . 10 ARG HB2 1 1
20 4477 1 1 10 ARG HB3 H -5.207 4.466 2.399 1.00 . A A . 10 ARG HB3 1 1
20 4478 1 1 10 ARG HD2 H -2.682 4.202 3.914 1.00 . A A . 10 ARG HD2 1 1
20 4479 1 1 10 ARG HD3 H -4.262 4.379 4.674 1.00 . A A . 10 ARG HD3 1 1
20 4480 1 1 10 ARG HE H -2.787 1.936 5.253 1.00 . A A . 10 ARG HE 1 1
20 4481 1 1 10 ARG HG2 H -5.023 2.328 3.620 1.00 . A A . 10 ARG HG2 1 1
20 4482 1 1 10 ARG HG3 H -3.431 2.088 2.897 1.00 . A A . 10 ARG HG3 1 1
20 4483 1 1 10 ARG HH11 H -3.776 5.131 6.322 1.00 . A A . 10 ARG HH11 1 1
20 4484 1 1 10 ARG HH12 H -3.370 4.849 7.977 1.00 . A A . 10 ARG HH12 1 1
20 4485 1 1 10 ARG HH21 H -2.254 1.553 7.449 1.00 . A A . 10 ARG HH21 1 1
20 4486 1 1 10 ARG HH22 H -2.492 2.803 8.623 1.00 . A A . 10 ARG HH22 1 1
20 4487 1 1 10 ARG N N -4.407 1.915 0.329 1.00 . A A . 10 ARG N 1 1
20 4488 1 1 10 ARG NE N -3.071 2.858 5.455 1.00 . A A . 10 ARG NE 1 1
20 4489 1 1 10 ARG NH1 N -3.415 4.520 7.029 1.00 . A A . 10 ARG NH1 1 1
20 4490 1 1 10 ARG NH2 N -2.550 2.487 7.672 1.00 . A A . 10 ARG NH2 1 1
20 4491 1 1 10 ARG O O -6.904 4.395 -0.015 1.00 . A A . 10 ARG O 1 1
20 4492 1 1 11 ALA C C -6.494 4.451 -3.038 1.00 . A A . 11 ALA C 1 1
20 4493 1 1 11 ALA CA C -5.346 5.027 -2.215 1.00 . A A . 11 ALA CA 1 1
20 4494 1 1 11 ALA CB C -4.146 5.302 -3.102 1.00 . A A . 11 ALA CB 1 1
20 4495 1 1 11 ALA H H -4.093 3.708 -1.145 1.00 . A A . 11 ALA H 1 1
20 4496 1 1 11 ALA HA H -5.665 5.963 -1.778 1.00 . A A . 11 ALA HA 1 1
20 4497 1 1 11 ALA HB1 H -4.413 6.028 -3.855 1.00 . A A . 11 ALA HB1 1 1
20 4498 1 1 11 ALA HB2 H -3.836 4.384 -3.580 1.00 . A A . 11 ALA HB2 1 1
20 4499 1 1 11 ALA HB3 H -3.335 5.686 -2.501 1.00 . A A . 11 ALA HB3 1 1
20 4500 1 1 11 ALA N N -4.977 4.132 -1.131 1.00 . A A . 11 ALA N 1 1
20 4501 1 1 11 ALA O O -7.431 5.167 -3.405 1.00 . A A . 11 ALA O 1 1
20 4502 1 1 12 ALA C C -8.656 2.133 -3.238 1.00 . A A . 12 ALA C 1 1
20 4503 1 1 12 ALA CA C -7.451 2.494 -4.103 1.00 . A A . 12 ALA CA 1 1
20 4504 1 1 12 ALA CB C -6.884 1.256 -4.779 1.00 . A A . 12 ALA CB 1 1
20 4505 1 1 12 ALA H H -5.650 2.642 -2.999 1.00 . A A . 12 ALA H 1 1
20 4506 1 1 12 ALA HA H -7.772 3.180 -4.872 1.00 . A A . 12 ALA HA 1 1
20 4507 1 1 12 ALA HB1 H -6.029 1.532 -5.379 1.00 . A A . 12 ALA HB1 1 1
20 4508 1 1 12 ALA HB2 H -7.639 0.813 -5.412 1.00 . A A . 12 ALA HB2 1 1
20 4509 1 1 12 ALA HB3 H -6.580 0.542 -4.027 1.00 . A A . 12 ALA HB3 1 1
20 4510 1 1 12 ALA N N -6.421 3.158 -3.321 1.00 . A A . 12 ALA N 1 1
20 4511 1 1 12 ALA O O -9.802 2.237 -3.678 1.00 . A A . 12 ALA O 1 1
20 4512 1 1 13 DAL C C -9.506 -0.137 -0.836 1.00 . A A . 13 DAL C 1 1
20 4513 1 1 13 DAL CA C -9.464 1.366 -1.084 1.00 . A A . 13 DAL CA 1 1
20 4514 1 1 13 DAL CB C -9.296 2.110 0.230 1.00 . A A . 13 DAL CB 1 1
20 4515 1 1 13 DAL H H -7.462 1.655 -1.712 1.00 . A A . 13 DAL H 1 1
20 4516 1 1 13 DAL HA H -10.400 1.672 -1.526 1.00 . A A . 13 DAL HA 1 1
20 4517 1 1 13 DAL HB1 H -10.125 1.881 0.882 1.00 . A A . 13 DAL HB1 1 1
20 4518 1 1 13 DAL HB2 H -9.271 3.173 0.040 1.00 . A A . 13 DAL HB2 1 1
20 4519 1 1 13 DAL HB3 H -8.372 1.807 0.701 1.00 . A A . 13 DAL HB3 1 1
20 4520 1 1 13 DAL N N -8.397 1.724 -2.009 1.00 . A A . 13 DAL N 1 1
20 4521 1 1 13 DAL O O -10.569 -0.705 -0.582 1.00 . A A . 13 DAL O 1 1
20 4522 1 1 14 CYS C C -7.660 -2.483 0.691 1.00 . A A . 14 CYS C 1 1
20 4523 1 1 14 CYS CA C -8.269 -2.207 -0.677 1.00 . A A . 14 CYS CA 1 1
20 4524 1 1 14 CYS CB C -7.441 -2.875 -1.773 1.00 . A A . 14 CYS CB 1 1
20 4525 1 1 14 CYS H H -7.538 -0.282 -1.141 1.00 . A A . 14 CYS H 1 1
20 4526 1 1 14 CYS HA H -9.272 -2.608 -0.701 1.00 . A A . 14 CYS HA 1 1
20 4527 1 1 14 CYS HB2 H -6.611 -3.392 -1.314 1.00 . A A . 14 CYS HB2 1 1
20 4528 1 1 14 CYS HB3 H -8.061 -3.596 -2.288 1.00 . A A . 14 CYS HB3 1 1
20 4529 1 1 14 CYS N N -8.356 -0.778 -0.914 1.00 . A A . 14 CYS N 1 1
20 4530 1 1 14 CYS O O -6.471 -2.789 0.807 1.00 . A A . 14 CYS O 1 1
20 4531 1 1 14 CYS SG S -6.780 -1.727 -2.993 1.00 . A A . 14 CYS SG 1 1
20 4532 1 1 15 NH2 HN1 H -9.433 -2.350 1.545 1.00 . A A . 15 NH2 HN1 1 1
20 4533 1 1 15 NH2 HN2 H -8.081 -2.058 2.570 1.00 . A A . 15 NH2 HN2 1 1
20 4534 1 1 15 NH2 N N -8.469 -2.371 1.727 1.00 . A A . 15 NH2 N 1 1
20 4535 2 2 1 . CB1 C -1.129 -5.099 1.284 1.00 . B A . 101 B0I CB1 1 1
20 4536 2 2 1 . CB2 C -5.854 -2.857 -4.045 1.00 . B A . 101 B0I CB2 1 1
20 4537 2 2 1 . CD1 C -1.644 -4.188 -0.975 1.00 . B A . 101 B0I CD1 1 1
20 4538 2 2 1 . CD2 C 0.141 -5.740 -0.784 1.00 . B A . 101 B0I CD2 1 1
20 4539 2 2 1 . CD3 C -3.575 -3.462 -3.190 1.00 . B A . 101 B0I CD3 1 1
20 4540 2 2 1 . CD4 C -3.775 -1.610 -4.677 1.00 . B A . 101 B0I CD4 1 1
20 4541 2 2 1 . CE1 C -1.422 -4.092 -2.338 1.00 . B A . 101 B0I CE1 1 1
20 4542 2 2 1 . CE2 C 0.373 -5.655 -2.141 1.00 . B A . 101 B0I CE2 1 1
20 4543 2 2 1 . CE3 C -2.210 -3.261 -3.119 1.00 . B A . 101 B0I CE3 1 1
20 4544 2 2 1 . CE4 C -2.412 -1.405 -4.610 1.00 . B A . 101 B0I CE4 1 1
20 4545 2 2 1 . CG1 C -0.871 -5.005 -0.190 1.00 . B A . 101 B0I CG1 1 1
20 4546 2 2 1 . CG2 C -4.372 -2.639 -3.969 1.00 . B A . 101 B0I CG2 1 1
20 4547 2 2 1 . CZ1 C -0.410 -4.829 -2.920 1.00 . B A . 101 B0I CZ1 1 1
20 4548 2 2 1 . CZ2 C -1.628 -2.230 -3.830 1.00 . B A . 101 B0I CZ2 1 1
20 4549 2 2 1 . H1 H -0.725 -6.030 1.631 1.00 . B A . 101 B0I H1 1 1
20 4550 2 2 1 . H2 H -6.064 -3.872 -3.741 1.00 . B A . 101 B0I H2 1 1
20 4551 2 2 1 . HB11 H -2.197 -5.088 1.441 1.00 . B A . 101 B0I HB11 1 1
20 4552 2 2 1 . HB21 H -6.165 -2.713 -5.068 1.00 . B A . 101 B0I HB21 1 1
20 4553 2 2 1 . HD1 H -2.430 -3.622 -0.504 1.00 . B A . 101 B0I HD1 1 1
20 4554 2 2 1 . HD2 H 0.754 -6.386 -0.173 1.00 . B A . 101 B0I HD2 1 1
20 4555 2 2 1 . HD3 H -4.031 -4.266 -2.633 1.00 . B A . 101 B0I HD3 1 1
20 4556 2 2 1 . HD4 H -4.386 -0.962 -5.287 1.00 . B A . 101 B0I HD4 1 1
20 4557 2 2 1 . HE2 H 1.166 -6.233 -2.592 1.00 . B A . 101 B0I HE2 1 1
20 4558 2 2 1 . HE4 H -1.959 -0.598 -5.167 1.00 . B A . 101 B0I HE4 1 1
20 4559 2 2 1 . HZ1 H -0.233 -4.760 -3.983 1.00 . B A . 101 B0I HZ1 1 1
20 4560 2 2 1 . HZ2 H -0.562 -2.072 -3.776 1.00 . B A . 101 B0I HZ2 1 1
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