NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
643318 |
6pqf   |
30630 | cing | 4-filtered-FRED | STAR | entry | full | 48 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6pqf
# This FRED archive file contains, for PDB entry <6pqf>:
#
# - 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_6pqf
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6pqf
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all other bound"
_Assembly.Molecular_mass 1590.76
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 $OlvA_BCS_ A . 1 1
stop_
save_
save_OlvA_BCS_
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "OlvA BCS "
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code ACGXGXGCAKXCAASCAAS
_Entity.Number_of_monomers 19
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 ALA . 1 1
2 CYS . 1 1
3 GLY . 1 1
4 . $. 1 1
5 GLY . 1 1
6 . $. 1 1
7 GLY . 1 1
8 CYS . 1 1
9 ALA . 1 1
10 LYS . 1 1
11 . $. 1 1
12 CYS . 1 1
13 ALA . 1 1
14 ALA . 1 1
15 SER . 1 1
16 CYS . 1 1
17 ALA . 1 1
18 ALA . 1 1
19 SER . 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
ALA 1 1 1 1
CYS 2 2 1 1
GLY 3 3 1 1
. 4 4 1 1
GLY 5 5 1 1
. 6 6 1 1
GLY 7 7 1 1
CYS 8 8 1 1
ALA 9 9 1 1
LYS 10 10 1 1
. 11 11 1 1
CYS 12 12 1 1
ALA 13 13 1 1
ALA 14 14 1 1
SER 15 15 1 1
CYS 16 16 1 1
ALA 17 17 1 1
ALA 18 18 1 1
SER 19 19 1 1
stop_
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_DYANA/DIANA_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
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 CYS HA . 2 CYS HA 1 1
1 1 2 1 1 14 ALA HA . 14 ALS HA 1 1
2 1 1 1 1 2 CYS QB . 2 CYS QB 1 1
2 1 2 1 1 14 ALA HA . 14 ALS HA 1 1
3 1 1 1 1 7 GLY H . 7 GLY H 1 1
3 1 2 1 1 8 CYS H . 8 CYS H 1 1
4 1 1 1 1 8 CYS H . 8 CYS H 1 1
4 1 2 1 1 8 CYS HB2 . 8 CYS HB2 1 1
5 1 1 1 1 8 CYS H . 8 CYS H 1 1
5 1 2 1 1 8 CYS QB . 8 CYS QB 1 1
6 1 1 1 1 8 CYS H . 8 CYS H 1 1
6 1 2 1 1 8 CYS HB3 . 8 CYS HB3 1 1
7 1 1 1 1 8 CYS H . 8 CYS H 1 1
7 1 2 1 1 9 ALA H . 9 ALA H 1 1
8 1 1 1 1 8 CYS HA . 8 CYS HA 1 1
8 1 2 1 1 9 ALA H . 9 ALA H 1 1
9 1 1 1 1 8 CYS QB . 8 CYS QB 1 1
9 1 2 1 1 9 ALA H . 9 ALA H 1 1
10 1 1 1 1 8 CYS QB . 8 CYS QB 1 1
10 1 2 1 1 15 SER QB . 15 SER QB 1 1
11 1 1 1 1 8 CYS HB2 . 8 CYS HB2 1 1
11 1 2 1 1 9 ALA H . 9 ALA H 1 1
12 1 1 1 1 8 CYS HB3 . 8 CYS HB3 1 1
12 1 2 1 1 9 ALA H . 9 ALA H 1 1
13 1 1 1 1 9 ALA H . 9 ALA H 1 1
13 1 2 1 1 9 ALA MB . 9 ALA HB1 1 1
14 1 1 1 1 9 ALA HA . 9 ALA HA 1 1
14 1 2 1 1 10 LYS H . 10 LYS H 1 1
15 1 1 1 1 9 ALA MB . 9 ALA QB 1 1
15 1 2 1 1 10 LYS H . 10 LYS H 1 1
16 1 1 1 1 9 ALA MB . 9 ALA HB1 1 1
16 1 2 1 1 14 ALA H . 14 ALS H 1 1
17 1 1 1 1 10 LYS H . 10 LYS H 1 1
17 1 2 1 1 10 LYS HB2 . 10 LYS HB2 1 1
18 1 1 1 1 10 LYS H . 10 LYS H 1 1
18 1 2 1 1 10 LYS QB . 10 LYS QB 1 1
19 1 1 1 1 10 LYS H . 10 LYS H 1 1
19 1 2 1 1 10 LYS HB3 . 10 LYS HB3 1 1
20 1 1 1 1 10 LYS H . 10 LYS H 1 1
20 1 2 1 1 10 LYS QD . 10 LYS QD 1 1
21 1 1 1 1 10 LYS H . 10 LYS H 1 1
21 1 2 1 1 10 LYS HG2 . 10 LYS HG2 1 1
22 1 1 1 1 10 LYS H . 10 LYS H 1 1
22 1 2 1 1 10 LYS QG . 10 LYS QG 1 1
23 1 1 1 1 10 LYS H . 10 LYS H 1 1
23 1 2 1 1 10 LYS HG3 . 10 LYS HG3 1 1
24 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
24 1 2 1 1 10 LYS HD2 . 10 LYS HD2 1 1
25 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
25 1 2 1 1 10 LYS QD . 10 LYS QD 1 1
26 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
26 1 2 1 1 10 LYS HD3 . 10 LYS HD3 1 1
27 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
27 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
28 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
28 1 2 1 1 15 SER QB . 15 SER QB 1 1
29 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
29 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
30 1 1 1 1 12 CYS HA . 12 CYS HA 1 1
30 1 2 1 1 14 ALA H . 14 ALS H 1 1
31 1 1 1 1 12 CYS HA . 12 CYS HA 1 1
31 1 2 1 1 16 CYS H . 16 CYS H 1 1
32 1 1 1 1 12 CYS HA . 12 CYS HA 1 1
32 1 2 1 1 16 CYS QB . 16 CYS QB 1 1
33 1 1 1 1 12 CYS HA . 12 CYS HA 1 1
33 1 2 1 1 18 ALA HA . 18 ALS HA 1 1
34 1 1 1 1 13 ALA H . 13 ALA H 1 1
34 1 2 1 1 14 ALA H . 14 ALS H 1 1
35 1 1 1 1 13 ALA MB . 13 ALA HB1 1 1
35 1 2 1 1 14 ALA H . 14 ALS H 1 1
36 1 1 1 1 14 ALA H . 14 ALS H 1 1
36 1 2 1 1 15 SER H . 15 SER H 1 1
37 1 1 1 1 15 SER H . 15 SER H 1 1
37 1 2 1 1 16 CYS H . 16 CYS H 1 1
38 1 1 1 1 15 SER QB . 15 SER QB 1 1
38 1 2 1 1 16 CYS H . 16 CYS H 1 1
39 1 1 1 1 15 SER HB2 . 15 SER HB2 1 1
39 1 2 1 1 16 CYS H . 16 CYS H 1 1
40 1 1 1 1 15 SER HB3 . 15 SER HB3 1 1
40 1 2 1 1 16 CYS H . 16 CYS H 1 1
41 1 1 1 1 16 CYS H . 16 CYS H 1 1
41 1 2 1 1 16 CYS QB . 16 CYS QB 1 1
42 1 1 1 1 16 CYS QB . 16 CYS QB 1 1
42 1 2 1 1 17 ALA H . 17 ALA H 1 1
43 1 1 1 1 16 CYS QB . 16 CYS QB 1 1
43 1 2 1 1 17 ALA HA . 17 ALA HA 1 1
44 1 1 1 1 16 CYS QB . 16 CYS QB 1 1
44 1 2 1 1 18 ALA H . 18 ALS H 1 1
45 1 1 1 1 17 ALA H . 17 ALA H 1 1
45 1 2 1 1 18 ALA H . 18 ALS H 1 1
46 1 1 1 1 17 ALA HA . 17 ALA HA 1 1
46 1 2 1 1 18 ALA HA . 18 ALS HA 1 1
47 1 1 1 1 17 ALA MB . 17 ALA QB 1 1
47 1 2 1 1 18 ALA H . 18 ALS H 1 1
48 1 1 1 1 17 ALA MB . 17 ALA QB 1 1
48 1 2 1 1 19 SER H . 19 SER H 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 . . . . . . . 5.2 1 1
2 1 . . . . . . . 3.47 1 1
3 1 . . . . . . . 3.91 1 1
4 1 . . . . . . . 3.52 1 1
5 1 . . . . . . . 2.98 1 1
6 1 . . . . . . . 3.52 1 1
7 1 . . . . . . . 5.03 1 1
8 1 . . . . . . . 2.94 1 1
9 1 . . . . . . . 3.91 1 1
10 1 . . . . . . . 4.76 1 1
11 1 . . . . . . . 4.54 1 1
12 1 . . . . . . . 4.54 1 1
13 1 . . . . . . . 3.07 1 1
14 1 . . . . . . . 2.84 1 1
15 1 . . . . . . . 3.45 1 1
16 1 . . . . . . . 5.0 1 1
17 1 . . . . . . . 3.71 1 1
18 1 . . . . . . . 3.02 1 1
19 1 . . . . . . . 3.71 1 1
20 1 . . . . . . . 4.84 1 1
21 1 . . . . . . . 4.75 1 1
22 1 . . . . . . . 4.07 1 1
23 1 . . . . . . . 4.75 1 1
24 1 . . . . . . . 5.5 1 1
25 1 . . . . . . . 4.42 1 1
26 1 . . . . . . . 5.5 1 1
27 1 . . . . . . . 5.2 1 1
28 1 . . . . . . . 4.55 1 1
29 1 . . . . . . . 5.2 1 1
30 1 . . . . . . . 3.95 1 1
31 1 . . . . . . . 4.06 1 1
32 1 . . . . . . . 3.59 1 1
33 1 . . . . . . . 5.5 1 1
34 1 . . . . . . . 4.58 1 1
35 1 . . . . . . . 4.68 1 1
36 1 . . . . . . . 5.21 1 1
37 1 . . . . . . . 3.63 1 1
38 1 . . . . . . . 4.48 1 1
39 1 . . . . . . . 5.14 1 1
40 1 . . . . . . . 5.14 1 1
41 1 . . . . . . . 3.09 1 1
42 1 . . . . . . . 3.87 1 1
43 1 . . . . . . . 5.34 1 1
44 1 . . . . . . . 3.75 1 1
45 1 . . . . . . . 4.33 1 1
46 1 . . . . . . . 5.5 1 1
47 1 . . . . . . . 3.64 1 1
48 1 . . . . . . . 4.49 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 ALA C C 3.508 -0.521 -1.015 1.00 . A A . 1 ALA C 1 1
1 2 1 1 1 ALA CA C 2.093 -0.001 -1.241 1.00 . A A . 1 ALA CA 1 1
1 3 1 1 1 ALA CB C 2.132 1.398 -1.838 1.00 . A A . 1 ALA CB 1 1
1 4 1 1 1 ALA H1 H 1.807 -0.001 0.855 1.00 . A A . 1 ALA H1 1 1
1 5 1 1 1 ALA HA H 1.589 -0.651 -1.943 1.00 . A A . 1 ALA HA 1 1
1 6 1 1 1 ALA HB1 H 2.818 1.413 -2.673 1.00 . A A . 1 ALA HB1 1 1
1 7 1 1 1 ALA HB2 H 1.144 1.672 -2.178 1.00 . A A . 1 ALA HB2 1 1
1 8 1 1 1 ALA HB3 H 2.463 2.100 -1.088 1.00 . A A . 1 ALA HB3 1 1
1 9 1 1 1 ALA N N 1.329 0.000 0.000 1.00 . A A . 1 ALA N 1 1
1 10 1 1 1 ALA O O 4.161 -0.168 -0.032 1.00 . A A . 1 ALA O 1 1
1 11 1 1 2 CYS C C 6.271 -1.255 -2.805 1.00 . A A . 2 CYS C 1 1
1 12 1 1 2 CYS CA C 5.316 -1.934 -1.828 1.00 . A A . 2 CYS CA 1 1
1 13 1 1 2 CYS CB C 5.273 -3.439 -2.103 1.00 . A A . 2 CYS CB 1 1
1 14 1 1 2 CYS H H 3.410 -1.608 -2.690 1.00 . A A . 2 CYS H 1 1
1 15 1 1 2 CYS HA H 5.672 -1.771 -0.823 1.00 . A A . 2 CYS HA 1 1
1 16 1 1 2 CYS HB2 H 4.348 -3.679 -2.607 1.00 . A A . 2 CYS HB2 1 1
1 17 1 1 2 CYS HB3 H 6.103 -3.704 -2.741 1.00 . A A . 2 CYS HB3 1 1
1 18 1 1 2 CYS N N 3.978 -1.364 -1.929 1.00 . A A . 2 CYS N 1 1
1 19 1 1 2 CYS O O 7.110 -0.447 -2.408 1.00 . A A . 2 CYS O 1 1
1 20 1 1 2 CYS SG S 5.371 -4.471 -0.605 1.00 . A A . 2 CYS SG 1 1
1 21 1 1 3 GLY C C 7.834 -2.038 -5.819 1.00 . A A . 3 GLY C 1 1
1 22 1 1 3 GLY CA C 6.994 -1.002 -5.098 1.00 . A A . 3 GLY CA 1 1
1 23 1 1 3 GLY H H 5.450 -2.238 -4.343 1.00 . A A . 3 GLY H 1 1
1 24 1 1 3 GLY HA2 H 6.379 -0.486 -5.821 1.00 . A A . 3 GLY HA2 1 1
1 25 1 1 3 GLY HA3 H 7.653 -0.287 -4.627 1.00 . A A . 3 GLY HA3 1 1
1 26 1 1 3 GLY N N 6.137 -1.588 -4.085 1.00 . A A . 3 GLY N 1 1
1 27 1 1 3 GLY O O 8.820 -1.714 -6.482 1.00 . A A . 3 GLY O 1 1
1 28 1 1 4 . C C 9.711 -4.324 -6.007 1.00 . A A . 4 DBB C 1 1
1 29 1 1 4 . CA C 8.211 -4.343 -6.350 1.00 . A A . 4 DBB CA 1 1
1 30 1 1 4 . CB C 7.565 -5.700 -6.003 1.00 . A A . 4 DBB CB 1 1
1 31 1 1 4 . CG C 8.196 -6.796 -6.847 1.00 . A A . 4 DBB CG 1 1
1 32 1 1 4 . H H 6.656 -3.517 -5.155 1.00 . A A . 4 DBB H 1 1
1 33 1 1 4 . HA H 8.108 -4.202 -7.408 1.00 . A A . 4 DBB HA 1 1
1 34 1 1 4 . HB2 H 6.544 -5.616 -6.310 1.00 . A A . 4 DBB HB2 1 1
1 35 1 1 4 . HG1 H 9.246 -6.863 -6.602 1.00 . A A . 4 DBB HG1 1 1
1 36 1 1 4 . HG2 H 8.083 -6.557 -7.893 1.00 . A A . 4 DBB HG2 1 1
1 37 1 1 4 . HG3 H 7.715 -7.737 -6.633 1.00 . A A . 4 DBB HG3 1 1
1 38 1 1 4 . N N 7.449 -3.293 -5.693 1.00 . A A . 4 DBB N 1 1
1 39 1 1 4 . O O 10.050 -3.965 -4.880 1.00 . A A . 4 DBB O 1 1
1 40 1 1 5 GLY C C 12.521 -6.218 -6.559 1.00 . A A . 5 GLY C 1 1
1 41 1 1 5 GLY CA C 11.998 -4.797 -6.632 1.00 . A A . 5 GLY CA 1 1
1 42 1 1 5 GLY H H 10.250 -5.017 -7.806 1.00 . A A . 5 GLY H 1 1
1 43 1 1 5 GLY HA2 H 12.534 -4.267 -7.405 1.00 . A A . 5 GLY HA2 1 1
1 44 1 1 5 GLY HA3 H 12.178 -4.311 -5.685 1.00 . A A . 5 GLY HA3 1 1
1 45 1 1 5 GLY N N 10.578 -4.743 -6.924 1.00 . A A . 5 GLY N 1 1
1 46 1 1 5 GLY O O 12.259 -7.080 -7.393 1.00 . A A . 5 GLY O 1 1
1 47 1 1 6 . C C 12.652 -8.881 -5.184 1.00 . A A . 6 IAS C 1 1
1 48 1 1 6 . CA C 13.778 -7.870 -5.299 1.00 . A A . 6 IAS CA 1 1
1 49 1 1 6 . CB C 14.747 -7.999 -4.110 1.00 . A A . 6 IAS CB 1 1
1 50 1 1 6 . CG C 14.190 -7.434 -2.810 1.00 . A A . 6 IAS CG 1 1
1 51 1 1 6 . H H 13.531 -5.818 -4.830 1.00 . A A . 6 IAS H 1 1
1 52 1 1 6 . HA H 14.298 -8.173 -6.199 1.00 . A A . 6 IAS HA 1 1
1 53 1 1 6 . HB2 H 15.631 -7.419 -4.333 1.00 . A A . 6 IAS HB2 1 1
1 54 1 1 6 . HB3 H 15.019 -9.037 -3.992 1.00 . A A . 6 IAS HB3 1 1
1 55 1 1 6 . HXT H 12.441 -9.874 -6.827 1.00 . A A . 6 IAS HXT 1 1
1 56 1 1 6 . N N 13.312 -6.510 -5.513 1.00 . A A . 6 IAS N 1 1
1 57 1 1 6 . O O 11.734 -8.797 -4.408 1.00 . A A . 6 IAS O 1 1
1 58 1 1 6 . OD1 O 14.524 -6.325 -2.393 1.00 . A A . 6 IAS OD1 1 1
1 59 1 1 6 . OXT O 12.868 -9.954 -5.960 1.00 . A A . 6 IAS OXT 1 1
1 60 1 1 7 GLY C C 11.226 -7.729 -0.982 1.00 . A A . 7 GLY C 1 1
1 61 1 1 7 GLY CA C 12.739 -7.800 -0.911 1.00 . A A . 7 GLY CA 1 1
1 62 1 1 7 GLY H H 13.105 -9.095 -2.545 1.00 . A A . 7 GLY H 1 1
1 63 1 1 7 GLY HA2 H 13.020 -8.500 -0.138 1.00 . A A . 7 GLY HA2 1 1
1 64 1 1 7 GLY HA3 H 13.121 -6.823 -0.654 1.00 . A A . 7 GLY HA3 1 1
1 65 1 1 7 GLY N N 13.334 -8.221 -2.165 1.00 . A A . 7 GLY N 1 1
1 66 1 1 7 GLY O O 10.543 -7.858 0.034 1.00 . A A . 7 GLY O 1 1
1 67 1 1 8 CYS C C 8.608 -8.807 -2.270 1.00 . A A . 8 CYS C 1 1
1 68 1 1 8 CYS CA C 9.260 -7.432 -2.385 1.00 . A A . 8 CYS CA 1 1
1 69 1 1 8 CYS CB C 8.952 -6.822 -3.754 1.00 . A A . 8 CYS CB 1 1
1 70 1 1 8 CYS H H 11.298 -7.427 -2.958 1.00 . A A . 8 CYS H 1 1
1 71 1 1 8 CYS HA H 8.857 -6.790 -1.617 1.00 . A A . 8 CYS HA 1 1
1 72 1 1 8 CYS HB2 H 9.663 -6.035 -3.958 1.00 . A A . 8 CYS HB2 1 1
1 73 1 1 8 CYS HB3 H 9.044 -7.588 -4.510 1.00 . A A . 8 CYS HB3 1 1
1 74 1 1 8 CYS N N 10.701 -7.522 -2.185 1.00 . A A . 8 CYS N 1 1
1 75 1 1 8 CYS O O 8.863 -9.696 -3.081 1.00 . A A . 8 CYS O 1 1
1 76 1 1 8 CYS SG S 7.282 -6.106 -3.891 1.00 . A A . 8 CYS SG 1 1
1 77 1 1 9 ALA C C 6.082 -10.523 -2.157 1.00 . A A . 9 ALA C 1 1
1 78 1 1 9 ALA CA C 7.074 -10.237 -1.035 1.00 . A A . 9 ALA CA 1 1
1 79 1 1 9 ALA CB C 6.363 -10.222 0.310 1.00 . A A . 9 ALA CB 1 1
1 80 1 1 9 ALA H H 7.603 -8.226 -0.643 1.00 . A A . 9 ALA H 1 1
1 81 1 1 9 ALA HA H 7.815 -11.023 -1.014 1.00 . A A . 9 ALA HA 1 1
1 82 1 1 9 ALA HB1 H 5.728 -9.350 0.370 1.00 . A A . 9 ALA HB1 1 1
1 83 1 1 9 ALA HB2 H 5.762 -11.113 0.409 1.00 . A A . 9 ALA HB2 1 1
1 84 1 1 9 ALA HB3 H 7.094 -10.191 1.103 1.00 . A A . 9 ALA HB3 1 1
1 85 1 1 9 ALA N N 7.765 -8.972 -1.256 1.00 . A A . 9 ALA N 1 1
1 86 1 1 9 ALA O O 5.707 -9.627 -2.913 1.00 . A A . 9 ALA O 1 1
1 87 1 1 10 LYS C C 3.317 -12.376 -2.700 1.00 . A A . 10 LYS C 1 1
1 88 1 1 10 LYS CA C 4.711 -12.185 -3.290 1.00 . A A . 10 LYS CA 1 1
1 89 1 1 10 LYS CB C 5.175 -13.481 -3.958 1.00 . A A . 10 LYS CB 1 1
1 90 1 1 10 LYS CD C 6.463 -14.430 -5.895 1.00 . A A . 10 LYS CD 1 1
1 91 1 1 10 LYS CE C 7.667 -14.258 -6.809 1.00 . A A . 10 LYS CE 1 1
1 92 1 1 10 LYS CG C 6.360 -13.295 -4.890 1.00 . A A . 10 LYS CG 1 1
1 93 1 1 10 LYS H H 5.995 -12.449 -1.628 1.00 . A A . 10 LYS H 1 1
1 94 1 1 10 LYS HA H 4.671 -11.402 -4.032 1.00 . A A . 10 LYS HA 1 1
1 95 1 1 10 LYS HB2 H 5.455 -14.188 -3.191 1.00 . A A . 10 LYS HB2 1 1
1 96 1 1 10 LYS HB3 H 4.355 -13.891 -4.531 1.00 . A A . 10 LYS HB3 1 1
1 97 1 1 10 LYS HD2 H 6.561 -15.364 -5.362 1.00 . A A . 10 LYS HD2 1 1
1 98 1 1 10 LYS HD3 H 5.565 -14.449 -6.497 1.00 . A A . 10 LYS HD3 1 1
1 99 1 1 10 LYS HE2 H 7.463 -13.458 -7.504 1.00 . A A . 10 LYS HE2 1 1
1 100 1 1 10 LYS HE3 H 8.525 -14.001 -6.206 1.00 . A A . 10 LYS HE3 1 1
1 101 1 1 10 LYS HG2 H 6.242 -12.364 -5.426 1.00 . A A . 10 LYS HG2 1 1
1 102 1 1 10 LYS HG3 H 7.266 -13.263 -4.303 1.00 . A A . 10 LYS HG3 1 1
1 103 1 1 10 LYS HZ1 H 8.752 -16.014 -7.127 1.00 . A A . 10 LYS HZ1 1 1
1 104 1 1 10 LYS HZ2 H 8.230 -15.264 -8.550 1.00 . A A . 10 LYS HZ2 1 1
1 105 1 1 10 LYS HZ3 H 7.129 -16.119 -7.592 1.00 . A A . 10 LYS HZ3 1 1
1 106 1 1 10 LYS N N 5.660 -11.779 -2.261 1.00 . A A . 10 LYS N 1 1
1 107 1 1 10 LYS NZ N 7.965 -15.501 -7.573 1.00 . A A . 10 LYS NZ 1 1
1 108 1 1 10 LYS O O 3.088 -12.156 -1.511 1.00 . A A . 10 LYS O 1 1
1 109 1 1 11 . C C 0.448 -11.766 -2.315 1.00 . A A . 11 DBB C 1 1
1 110 1 1 11 . CA C 1.027 -12.989 -3.047 1.00 . A A . 11 DBB CA 1 1
1 111 1 1 11 . CB C 0.142 -13.412 -4.237 1.00 . A A . 11 DBB CB 1 1
1 112 1 1 11 . CG C -1.224 -13.842 -3.728 1.00 . A A . 11 DBB CG 1 1
1 113 1 1 11 . H H 2.601 -12.954 -4.480 1.00 . A A . 11 DBB H 1 1
1 114 1 1 11 . HA H 1.050 -13.810 -2.359 1.00 . A A . 11 DBB HA 1 1
1 115 1 1 11 . HB2 H 0.612 -14.279 -4.648 1.00 . A A . 11 DBB HB2 1 1
1 116 1 1 11 . HG1 H -1.090 -14.572 -2.944 1.00 . A A . 11 DBB HG1 1 1
1 117 1 1 11 . HG2 H -1.789 -14.280 -4.538 1.00 . A A . 11 DBB HG2 1 1
1 118 1 1 11 . HG3 H -1.750 -12.986 -3.339 1.00 . A A . 11 DBB HG3 1 1
1 119 1 1 11 . N N 2.382 -12.788 -3.535 1.00 . A A . 11 DBB N 1 1
1 120 1 1 11 . O O 0.799 -10.643 -2.679 1.00 . A A . 11 DBB O 1 1
1 121 1 1 12 CYS C C -0.131 -10.254 0.383 1.00 . A A . 12 CYS C 1 1
1 122 1 1 12 CYS CA C -1.078 -10.856 -0.651 1.00 . A A . 12 CYS CA 1 1
1 123 1 1 12 CYS CB C -2.366 -11.324 0.031 1.00 . A A . 12 CYS CB 1 1
1 124 1 1 12 CYS H H -0.684 -12.886 -1.105 1.00 . A A . 12 CYS H 1 1
1 125 1 1 12 CYS HA H -1.323 -10.099 -1.381 1.00 . A A . 12 CYS HA 1 1
1 126 1 1 12 CYS HB2 H -2.973 -11.853 -0.688 1.00 . A A . 12 CYS HB2 1 1
1 127 1 1 12 CYS HB3 H -2.112 -11.991 0.841 1.00 . A A . 12 CYS HB3 1 1
1 128 1 1 12 CYS N N -0.445 -11.967 -1.351 1.00 . A A . 12 CYS N 1 1
1 129 1 1 12 CYS O O -0.434 -10.228 1.576 1.00 . A A . 12 CYS O 1 1
1 130 1 1 12 CYS SG S -3.375 -9.973 0.720 1.00 . A A . 12 CYS SG 1 1
1 131 1 1 13 ALA C C 2.434 -7.796 0.288 1.00 . A A . 13 ALA C 1 1
1 132 1 1 13 ALA CA C 2.006 -9.168 0.799 1.00 . A A . 13 ALA CA 1 1
1 133 1 1 13 ALA CB C 3.214 -10.082 0.940 1.00 . A A . 13 ALA CB 1 1
1 134 1 1 13 ALA H H 1.199 -9.821 -1.045 1.00 . A A . 13 ALA H 1 1
1 135 1 1 13 ALA HA H 1.557 -9.052 1.775 1.00 . A A . 13 ALA HA 1 1
1 136 1 1 13 ALA HB1 H 2.889 -11.059 1.267 1.00 . A A . 13 ALA HB1 1 1
1 137 1 1 13 ALA HB2 H 3.713 -10.168 -0.013 1.00 . A A . 13 ALA HB2 1 1
1 138 1 1 13 ALA HB3 H 3.896 -9.667 1.668 1.00 . A A . 13 ALA HB3 1 1
1 139 1 1 13 ALA N N 1.016 -9.771 -0.084 1.00 . A A . 13 ALA N 1 1
1 140 1 1 13 ALA O O 2.680 -6.895 1.088 1.00 . A A . 13 ALA O 1 1
1 141 1 1 14 ALA C C 2.643 -6.600 -3.236 1.00 . A A . 14 ALA C 1 1
1 142 1 1 14 ALA CA C 2.906 -6.425 -1.674 1.00 . A A . 14 ALA CA 1 1
1 143 1 1 14 ALA CB C 4.332 -6.070 -1.467 1.00 . A A . 14 ALA CB 1 1
1 144 1 1 14 ALA H H 2.302 -8.439 -1.581 1.00 . A A . 14 ALA H 1 1
1 145 1 1 14 ALA HA H 2.237 -5.641 -1.373 1.00 . A A . 14 ALA HA 1 1
1 146 1 1 14 ALA HB1 H 4.830 -6.850 -0.911 1.00 . A A . 14 ALA HB1 1 1
1 147 1 1 14 ALA HB2 H 4.781 -5.990 -2.446 1.00 . A A . 14 ALA HB2 1 1
1 148 1 1 14 ALA N N 2.517 -7.663 -1.023 1.00 . A A . 14 ALA N 1 1
1 149 1 1 14 ALA O O 2.181 -5.676 -3.905 1.00 . A A . 14 ALA O 1 1
1 150 1 1 15 SER C C 1.325 -8.173 -5.539 1.00 . A A . 15 SER C 1 1
1 151 1 1 15 SER CA C 2.803 -8.059 -5.178 1.00 . A A . 15 SER CA 1 1
1 152 1 1 15 SER CB C 3.533 -9.350 -5.554 1.00 . A A . 15 SER CB 1 1
1 153 1 1 15 SER H H 3.332 -8.476 -3.171 1.00 . A A . 15 SER H 1 1
1 154 1 1 15 SER HA H 3.234 -7.237 -5.730 1.00 . A A . 15 SER HA 1 1
1 155 1 1 15 SER HB2 H 4.579 -9.254 -5.305 1.00 . A A . 15 SER HB2 1 1
1 156 1 1 15 SER HB3 H 3.106 -10.175 -5.002 1.00 . A A . 15 SER HB3 1 1
1 157 1 1 15 SER HG H 4.250 -9.425 -7.375 1.00 . A A . 15 SER HG 1 1
1 158 1 1 15 SER N N 2.969 -7.779 -3.756 1.00 . A A . 15 SER N 1 1
1 159 1 1 15 SER O O 0.765 -7.297 -6.199 1.00 . A A . 15 SER O 1 1
1 160 1 1 15 SER OG O 3.415 -9.617 -6.940 1.00 . A A . 15 SER OG 1 1
1 161 1 1 16 CYS C C -1.594 -8.656 -4.456 1.00 . A A . 16 CYS C 1 1
1 162 1 1 16 CYS CA C -0.714 -9.493 -5.380 1.00 . A A . 16 CYS CA 1 1
1 163 1 1 16 CYS CB C -1.051 -10.976 -5.216 1.00 . A A . 16 CYS CB 1 1
1 164 1 1 16 CYS H H 1.198 -9.925 -4.582 1.00 . A A . 16 CYS H 1 1
1 165 1 1 16 CYS HA H -0.905 -9.200 -6.401 1.00 . A A . 16 CYS HA 1 1
1 166 1 1 16 CYS HB2 H -1.111 -11.210 -4.163 1.00 . A A . 16 CYS HB2 1 1
1 167 1 1 16 CYS HB3 H -2.006 -11.174 -5.679 1.00 . A A . 16 CYS HB3 1 1
1 168 1 1 16 CYS N N 0.698 -9.261 -5.103 1.00 . A A . 16 CYS N 1 1
1 169 1 1 16 CYS O O -1.211 -8.348 -3.328 1.00 . A A . 16 CYS O 1 1
1 170 1 1 16 CYS SG S 0.171 -12.103 -5.963 1.00 . A A . 16 CYS SG 1 1
1 171 1 1 17 ALA C C -4.830 -8.357 -3.592 1.00 . A A . 17 ALA C 1 1
1 172 1 1 17 ALA CA C -3.711 -7.492 -4.163 1.00 . A A . 17 ALA CA 1 1
1 173 1 1 17 ALA CB C -4.290 -6.372 -5.015 1.00 . A A . 17 ALA CB 1 1
1 174 1 1 17 ALA H H -3.024 -8.567 -5.851 1.00 . A A . 17 ALA H 1 1
1 175 1 1 17 ALA HA H -3.165 -7.043 -3.345 1.00 . A A . 17 ALA HA 1 1
1 176 1 1 17 ALA HB1 H -5.339 -6.253 -4.787 1.00 . A A . 17 ALA HB1 1 1
1 177 1 1 17 ALA HB2 H -3.768 -5.451 -4.803 1.00 . A A . 17 ALA HB2 1 1
1 178 1 1 17 ALA HB3 H -4.174 -6.620 -6.060 1.00 . A A . 17 ALA HB3 1 1
1 179 1 1 17 ALA N N -2.776 -8.291 -4.944 1.00 . A A . 17 ALA N 1 1
1 180 1 1 17 ALA O O -5.917 -8.406 -4.166 1.00 . A A . 17 ALA O 1 1
1 181 1 1 18 ALA C C -6.848 -9.054 -1.616 1.00 . A A . 18 ALA C 1 1
1 182 1 1 18 ALA CA C -5.500 -9.883 -1.811 1.00 . A A . 18 ALA CA 1 1
1 183 1 1 18 ALA CB C -5.035 -10.354 -0.483 1.00 . A A . 18 ALA CB 1 1
1 184 1 1 18 ALA H H -3.653 -8.917 -2.101 1.00 . A A . 18 ALA H 1 1
1 185 1 1 18 ALA HA H -5.772 -10.690 -2.464 1.00 . A A . 18 ALA HA 1 1
1 186 1 1 18 ALA HB1 H -5.782 -10.142 0.267 1.00 . A A . 18 ALA HB1 1 1
1 187 1 1 18 ALA HB2 H -4.900 -11.423 -0.559 1.00 . A A . 18 ALA HB2 1 1
1 188 1 1 18 ALA N N -4.548 -9.019 -2.486 1.00 . A A . 18 ALA N 1 1
1 189 1 1 18 ALA O O -6.932 -8.180 -0.753 1.00 . A A . 18 ALA O 1 1
1 190 1 1 19 SER C C -9.761 -8.796 -1.012 1.00 . A A . 19 SER C 1 1
1 191 1 1 19 SER CA C -9.120 -8.649 -2.388 1.00 . A A . 19 SER CA 1 1
1 192 1 1 19 SER CB C -10.068 -9.183 -3.464 1.00 . A A . 19 SER CB 1 1
1 193 1 1 19 SER H H -7.715 -10.058 -3.112 1.00 . A A . 19 SER H 1 1
1 194 1 1 19 SER HA H -8.931 -7.602 -2.575 1.00 . A A . 19 SER HA 1 1
1 195 1 1 19 SER HB2 H -9.494 -9.504 -4.319 1.00 . A A . 19 SER HB2 1 1
1 196 1 1 19 SER HB3 H -10.623 -10.021 -3.067 1.00 . A A . 19 SER HB3 1 1
1 197 1 1 19 SER HG H -11.661 -8.580 -4.431 1.00 . A A . 19 SER HG 1 1
1 198 1 1 19 SER N N -7.843 -9.351 -2.445 1.00 . A A . 19 SER N 1 1
1 199 1 1 19 SER O O -9.329 -9.612 -0.200 1.00 . A A . 19 SER O 1 1
1 200 1 1 19 SER OG O -10.984 -8.184 -3.878 1.00 . A A . 19 SER OG 1 1
2 201 1 1 1 ALA C C 2.880 0.133 -0.577 1.00 . A A . 1 ALA C 1 1
2 202 1 1 1 ALA CA C 1.574 0.891 -0.785 1.00 . A A . 1 ALA CA 1 1
2 203 1 1 1 ALA CB C 1.603 1.644 -2.107 1.00 . A A . 1 ALA CB 1 1
2 204 1 1 1 ALA H1 H 0.922 2.687 0.126 1.00 . A A . 1 ALA H1 1 1
2 205 1 1 1 ALA HA H 0.759 0.182 -0.820 1.00 . A A . 1 ALA HA 1 1
2 206 1 1 1 ALA HB1 H 1.061 2.573 -2.003 1.00 . A A . 1 ALA HB1 1 1
2 207 1 1 1 ALA HB2 H 2.627 1.853 -2.379 1.00 . A A . 1 ALA HB2 1 1
2 208 1 1 1 ALA HB3 H 1.141 1.041 -2.874 1.00 . A A . 1 ALA HB3 1 1
2 209 1 1 1 ALA N N 1.321 1.812 0.316 1.00 . A A . 1 ALA N 1 1
2 210 1 1 1 ALA O O 3.666 0.462 0.313 1.00 . A A . 1 ALA O 1 1
2 211 1 1 2 CYS C C 5.416 -1.129 -2.207 1.00 . A A . 2 CYS C 1 1
2 212 1 1 2 CYS CA C 4.318 -1.690 -1.308 1.00 . A A . 2 CYS CA 1 1
2 213 1 1 2 CYS CB C 4.021 -3.141 -1.692 1.00 . A A . 2 CYS CB 1 1
2 214 1 1 2 CYS H H 2.443 -1.097 -2.091 1.00 . A A . 2 CYS H 1 1
2 215 1 1 2 CYS HA H 4.658 -1.660 -0.284 1.00 . A A . 2 CYS HA 1 1
2 216 1 1 2 CYS HB2 H 2.959 -3.319 -1.601 1.00 . A A . 2 CYS HB2 1 1
2 217 1 1 2 CYS HB3 H 4.321 -3.303 -2.716 1.00 . A A . 2 CYS HB3 1 1
2 218 1 1 2 CYS N N 3.107 -0.884 -1.402 1.00 . A A . 2 CYS N 1 1
2 219 1 1 2 CYS O O 5.193 -0.870 -3.389 1.00 . A A . 2 CYS O 1 1
2 220 1 1 2 CYS SG S 4.877 -4.373 -0.659 1.00 . A A . 2 CYS SG 1 1
2 221 1 1 3 GLY C C 7.984 -1.211 -3.665 1.00 . A A . 3 GLY C 1 1
2 222 1 1 3 GLY CA C 7.718 -0.417 -2.402 1.00 . A A . 3 GLY CA 1 1
2 223 1 1 3 GLY H H 6.723 -1.169 -0.691 1.00 . A A . 3 GLY H 1 1
2 224 1 1 3 GLY HA2 H 7.503 0.607 -2.671 1.00 . A A . 3 GLY HA2 1 1
2 225 1 1 3 GLY HA3 H 8.605 -0.437 -1.785 1.00 . A A . 3 GLY HA3 1 1
2 226 1 1 3 GLY N N 6.603 -0.945 -1.638 1.00 . A A . 3 GLY N 1 1
2 227 1 1 3 GLY O O 8.258 -0.651 -4.727 1.00 . A A . 3 GLY O 1 1
2 228 1 1 4 . C C 9.645 -3.662 -4.957 1.00 . A A . 4 DBB C 1 1
2 229 1 1 4 . CA C 8.155 -3.351 -4.728 1.00 . A A . 4 DBB CA 1 1
2 230 1 1 4 . CB C 7.318 -4.640 -4.598 1.00 . A A . 4 DBB CB 1 1
2 231 1 1 4 . CG C 7.382 -5.424 -5.898 1.00 . A A . 4 DBB CG 1 1
2 232 1 1 4 . H H 7.684 -2.938 -2.695 1.00 . A A . 4 DBB H 1 1
2 233 1 1 4 . HA H 7.790 -2.819 -5.584 1.00 . A A . 4 DBB HA 1 1
2 234 1 1 4 . HB2 H 6.308 -4.312 -4.477 1.00 . A A . 4 DBB HB2 1 1
2 235 1 1 4 . HG1 H 8.351 -5.894 -5.974 1.00 . A A . 4 DBB HG1 1 1
2 236 1 1 4 . HG2 H 7.239 -4.753 -6.732 1.00 . A A . 4 DBB HG2 1 1
2 237 1 1 4 . HG3 H 6.613 -6.179 -5.901 1.00 . A A . 4 DBB HG3 1 1
2 238 1 1 4 . N N 7.905 -2.523 -3.559 1.00 . A A . 4 DBB N 1 1
2 239 1 1 4 . O O 10.338 -3.957 -3.984 1.00 . A A . 4 DBB O 1 1
2 240 1 1 5 GLY C C 11.636 -5.326 -7.178 1.00 . A A . 5 GLY C 1 1
2 241 1 1 5 GLY CA C 11.497 -3.989 -6.477 1.00 . A A . 5 GLY CA 1 1
2 242 1 1 5 GLY H H 9.514 -3.406 -6.938 1.00 . A A . 5 GLY H 1 1
2 243 1 1 5 GLY HA2 H 11.927 -3.221 -7.102 1.00 . A A . 5 GLY HA2 1 1
2 244 1 1 5 GLY HA3 H 12.039 -4.027 -5.544 1.00 . A A . 5 GLY HA3 1 1
2 245 1 1 5 GLY N N 10.113 -3.649 -6.202 1.00 . A A . 5 GLY N 1 1
2 246 1 1 5 GLY O O 11.234 -5.539 -8.318 1.00 . A A . 5 GLY O 1 1
2 247 1 1 6 . C C 11.091 -8.486 -6.763 1.00 . A A . 6 IAS C 1 1
2 248 1 1 6 . CA C 12.328 -7.648 -7.027 1.00 . A A . 6 IAS CA 1 1
2 249 1 1 6 . CB C 13.597 -8.400 -6.584 1.00 . A A . 6 IAS CB 1 1
2 250 1 1 6 . CG C 13.781 -8.440 -5.073 1.00 . A A . 6 IAS CG 1 1
2 251 1 1 6 . H H 12.570 -6.142 -5.556 1.00 . A A . 6 IAS H 1 1
2 252 1 1 6 . HA H 12.345 -7.554 -8.106 1.00 . A A . 6 IAS HA 1 1
2 253 1 1 6 . HB2 H 14.454 -7.871 -6.976 1.00 . A A . 6 IAS HB2 1 1
2 254 1 1 6 . HB3 H 13.572 -9.398 -6.995 1.00 . A A . 6 IAS HB3 1 1
2 255 1 1 6 . HXT H 9.993 -9.374 -8.080 1.00 . A A . 6 IAS HXT 1 1
2 256 1 1 6 . N N 12.239 -6.304 -6.482 1.00 . A A . 6 IAS N 1 1
2 257 1 1 6 . O O 10.427 -8.427 -5.760 1.00 . A A . 6 IAS O 1 1
2 258 1 1 6 . OD1 O 14.696 -7.832 -4.518 1.00 . A A . 6 IAS OD1 1 1
2 259 1 1 6 . OXT O 10.895 -9.399 -7.727 1.00 . A A . 6 IAS OXT 1 1
2 260 1 1 7 GLY C C 11.673 -8.905 -2.284 1.00 . A A . 7 GLY C 1 1
2 261 1 1 7 GLY CA C 12.967 -9.302 -2.966 1.00 . A A . 7 GLY CA 1 1
2 262 1 1 7 GLY H H 12.187 -9.640 -4.905 1.00 . A A . 7 GLY H 1 1
2 263 1 1 7 GLY HA2 H 13.195 -10.327 -2.715 1.00 . A A . 7 GLY HA2 1 1
2 264 1 1 7 GLY HA3 H 13.762 -8.668 -2.600 1.00 . A A . 7 GLY HA3 1 1
2 265 1 1 7 GLY N N 12.895 -9.177 -4.410 1.00 . A A . 7 GLY N 1 1
2 266 1 1 7 GLY O O 11.387 -9.348 -1.171 1.00 . A A . 7 GLY O 1 1
2 267 1 1 8 CYS C C 8.756 -8.788 -1.964 1.00 . A A . 8 CYS C 1 1
2 268 1 1 8 CYS CA C 9.617 -7.607 -2.404 1.00 . A A . 8 CYS CA 1 1
2 269 1 1 8 CYS CB C 8.864 -6.770 -3.439 1.00 . A A . 8 CYS CB 1 1
2 270 1 1 8 CYS H H 11.170 -7.747 -3.835 1.00 . A A . 8 CYS H 1 1
2 271 1 1 8 CYS HA H 9.830 -6.992 -1.542 1.00 . A A . 8 CYS HA 1 1
2 272 1 1 8 CYS HB2 H 9.563 -6.115 -3.939 1.00 . A A . 8 CYS HB2 1 1
2 273 1 1 8 CYS HB3 H 8.414 -7.429 -4.166 1.00 . A A . 8 CYS HB3 1 1
2 274 1 1 8 CYS N N 10.888 -8.066 -2.952 1.00 . A A . 8 CYS N 1 1
2 275 1 1 8 CYS O O 8.944 -9.912 -2.427 1.00 . A A . 8 CYS O 1 1
2 276 1 1 8 CYS SG S 7.541 -5.732 -2.737 1.00 . A A . 8 CYS SG 1 1
2 277 1 1 9 ALA C C 6.218 -10.281 -1.714 1.00 . A A . 9 ALA C 1 1
2 278 1 1 9 ALA CA C 6.919 -9.561 -0.568 1.00 . A A . 9 ALA CA 1 1
2 279 1 1 9 ALA CB C 5.897 -8.964 0.387 1.00 . A A . 9 ALA CB 1 1
2 280 1 1 9 ALA H H 7.710 -7.606 -0.737 1.00 . A A . 9 ALA H 1 1
2 281 1 1 9 ALA HA H 7.515 -10.276 -0.018 1.00 . A A . 9 ALA HA 1 1
2 282 1 1 9 ALA HB1 H 6.290 -8.050 0.809 1.00 . A A . 9 ALA HB1 1 1
2 283 1 1 9 ALA HB2 H 4.985 -8.750 -0.150 1.00 . A A . 9 ALA HB2 1 1
2 284 1 1 9 ALA HB3 H 5.692 -9.668 1.180 1.00 . A A . 9 ALA HB3 1 1
2 285 1 1 9 ALA N N 7.811 -8.522 -1.068 1.00 . A A . 9 ALA N 1 1
2 286 1 1 9 ALA O O 6.034 -9.720 -2.794 1.00 . A A . 9 ALA O 1 1
2 287 1 1 10 LYS C C 3.678 -12.527 -2.121 1.00 . A A . 10 LYS C 1 1
2 288 1 1 10 LYS CA C 5.146 -12.327 -2.485 1.00 . A A . 10 LYS CA 1 1
2 289 1 1 10 LYS CB C 5.833 -13.685 -2.642 1.00 . A A . 10 LYS CB 1 1
2 290 1 1 10 LYS CD C 6.799 -15.306 -4.301 1.00 . A A . 10 LYS CD 1 1
2 291 1 1 10 LYS CE C 7.052 -15.487 -5.789 1.00 . A A . 10 LYS CE 1 1
2 292 1 1 10 LYS CG C 5.723 -14.264 -4.042 1.00 . A A . 10 LYS CG 1 1
2 293 1 1 10 LYS H H 6.003 -11.922 -0.592 1.00 . A A . 10 LYS H 1 1
2 294 1 1 10 LYS HA H 5.202 -11.793 -3.422 1.00 . A A . 10 LYS HA 1 1
2 295 1 1 10 LYS HB2 H 6.881 -13.574 -2.402 1.00 . A A . 10 LYS HB2 1 1
2 296 1 1 10 LYS HB3 H 5.386 -14.383 -1.950 1.00 . A A . 10 LYS HB3 1 1
2 297 1 1 10 LYS HD2 H 7.716 -14.989 -3.827 1.00 . A A . 10 LYS HD2 1 1
2 298 1 1 10 LYS HD3 H 6.482 -16.250 -3.880 1.00 . A A . 10 LYS HD3 1 1
2 299 1 1 10 LYS HE2 H 7.106 -14.514 -6.253 1.00 . A A . 10 LYS HE2 1 1
2 300 1 1 10 LYS HE3 H 7.993 -16.001 -5.921 1.00 . A A . 10 LYS HE3 1 1
2 301 1 1 10 LYS HG2 H 4.754 -14.727 -4.155 1.00 . A A . 10 LYS HG2 1 1
2 302 1 1 10 LYS HG3 H 5.829 -13.464 -4.762 1.00 . A A . 10 LYS HG3 1 1
2 303 1 1 10 LYS HZ1 H 5.272 -16.578 -5.736 1.00 . A A . 10 LYS HZ1 1 1
2 304 1 1 10 LYS HZ2 H 6.374 -17.122 -6.898 1.00 . A A . 10 LYS HZ2 1 1
2 305 1 1 10 LYS HZ3 H 5.496 -15.701 -7.166 1.00 . A A . 10 LYS HZ3 1 1
2 306 1 1 10 LYS N N 5.828 -11.529 -1.473 1.00 . A A . 10 LYS N 1 1
2 307 1 1 10 LYS NZ N 5.973 -16.277 -6.444 1.00 . A A . 10 LYS NZ 1 1
2 308 1 1 10 LYS O O 3.231 -12.163 -1.033 1.00 . A A . 10 LYS O 1 1
2 309 1 1 11 . C C 0.762 -12.062 -2.330 1.00 . A A . 11 DBB C 1 1
2 310 1 1 11 . CA C 1.515 -13.333 -2.762 1.00 . A A . 11 DBB CA 1 1
2 311 1 1 11 . CB C 0.876 -13.976 -4.009 1.00 . A A . 11 DBB CB 1 1
2 312 1 1 11 . CG C -0.540 -14.423 -3.684 1.00 . A A . 11 DBB CG 1 1
2 313 1 1 11 . H H 3.316 -13.389 -3.893 1.00 . A A . 11 DBB H 1 1
2 314 1 1 11 . HA H 1.449 -14.047 -1.965 1.00 . A A . 11 DBB HA 1 1
2 315 1 1 11 . HB2 H 1.449 -14.858 -4.200 1.00 . A A . 11 DBB HB2 1 1
2 316 1 1 11 . HG1 H -1.161 -13.550 -3.556 1.00 . A A . 11 DBB HG1 1 1
2 317 1 1 11 . HG2 H -0.536 -15.001 -2.772 1.00 . A A . 11 DBB HG2 1 1
2 318 1 1 11 . HG3 H -0.923 -15.023 -4.494 1.00 . A A . 11 DBB HG3 1 1
2 319 1 1 11 . N N 2.926 -13.110 -3.034 1.00 . A A . 11 DBB N 1 1
2 320 1 1 11 . O O 1.118 -10.981 -2.800 1.00 . A A . 11 DBB O 1 1
2 321 1 1 12 CYS C C -0.338 -10.221 -0.029 1.00 . A A . 12 CYS C 1 1
2 322 1 1 12 CYS CA C -1.067 -11.034 -1.096 1.00 . A A . 12 CYS CA 1 1
2 323 1 1 12 CYS CB C -2.427 -11.489 -0.565 1.00 . A A . 12 CYS CB 1 1
2 324 1 1 12 CYS H H -0.507 -13.074 -1.162 1.00 . A A . 12 CYS H 1 1
2 325 1 1 12 CYS HA H -1.219 -10.411 -1.963 1.00 . A A . 12 CYS HA 1 1
2 326 1 1 12 CYS HB2 H -2.877 -12.162 -1.280 1.00 . A A . 12 CYS HB2 1 1
2 327 1 1 12 CYS HB3 H -2.284 -12.010 0.371 1.00 . A A . 12 CYS HB3 1 1
2 328 1 1 12 CYS N N -0.272 -12.185 -1.505 1.00 . A A . 12 CYS N 1 1
2 329 1 1 12 CYS O O -0.839 -10.045 1.081 1.00 . A A . 12 CYS O 1 1
2 330 1 1 12 CYS SG S -3.603 -10.130 -0.269 1.00 . A A . 12 CYS SG 1 1
2 331 1 1 13 ALA C C 2.079 -7.619 -0.089 1.00 . A A . 13 ALA C 1 1
2 332 1 1 13 ALA CA C 1.643 -8.933 0.551 1.00 . A A . 13 ALA CA 1 1
2 333 1 1 13 ALA CB C 2.856 -9.724 1.018 1.00 . A A . 13 ALA CB 1 1
2 334 1 1 13 ALA H H 1.192 -9.903 -1.275 1.00 . A A . 13 ALA H 1 1
2 335 1 1 13 ALA HA H 1.032 -8.715 1.415 1.00 . A A . 13 ALA HA 1 1
2 336 1 1 13 ALA HB1 H 3.487 -9.090 1.624 1.00 . A A . 13 ALA HB1 1 1
2 337 1 1 13 ALA HB2 H 2.530 -10.572 1.601 1.00 . A A . 13 ALA HB2 1 1
2 338 1 1 13 ALA HB3 H 3.412 -10.069 0.159 1.00 . A A . 13 ALA HB3 1 1
2 339 1 1 13 ALA N N 0.847 -9.729 -0.375 1.00 . A A . 13 ALA N 1 1
2 340 1 1 13 ALA O O 2.139 -6.598 0.594 1.00 . A A . 13 ALA O 1 1
2 341 1 1 14 ALA C C 2.841 -6.928 -3.672 1.00 . A A . 14 ALA C 1 1
2 342 1 1 14 ALA CA C 2.802 -6.507 -2.136 1.00 . A A . 14 ALA CA 1 1
2 343 1 1 14 ALA CB C 4.143 -6.004 -1.746 1.00 . A A . 14 ALA CB 1 1
2 344 1 1 14 ALA H H 2.297 -8.528 -1.835 1.00 . A A . 14 ALA H 1 1
2 345 1 1 14 ALA HA H 2.045 -5.748 -2.082 1.00 . A A . 14 ALA HA 1 1
2 346 1 1 14 ALA HB1 H 4.677 -6.765 -1.196 1.00 . A A . 14 ALA HB1 1 1
2 347 1 1 14 ALA HB2 H 4.675 -5.787 -2.660 1.00 . A A . 14 ALA HB2 1 1
2 348 1 1 14 ALA N N 2.375 -7.667 -1.374 1.00 . A A . 14 ALA N 1 1
2 349 1 1 14 ALA O O 2.459 -6.153 -4.549 1.00 . A A . 14 ALA O 1 1
2 350 1 1 15 SER C C 2.057 -8.912 -5.896 1.00 . A A . 15 SER C 1 1
2 351 1 1 15 SER CA C 3.435 -8.636 -5.302 1.00 . A A . 15 SER CA 1 1
2 352 1 1 15 SER CB C 4.282 -9.909 -5.336 1.00 . A A . 15 SER CB 1 1
2 353 1 1 15 SER H H 3.610 -8.711 -3.194 1.00 . A A . 15 SER H 1 1
2 354 1 1 15 SER HA H 3.922 -7.874 -5.892 1.00 . A A . 15 SER HA 1 1
2 355 1 1 15 SER HB2 H 4.084 -10.494 -4.451 1.00 . A A . 15 SER HB2 1 1
2 356 1 1 15 SER HB3 H 4.025 -10.486 -6.213 1.00 . A A . 15 SER HB3 1 1
2 357 1 1 15 SER HG H 5.999 -9.758 -6.266 1.00 . A A . 15 SER HG 1 1
2 358 1 1 15 SER N N 3.322 -8.139 -3.936 1.00 . A A . 15 SER N 1 1
2 359 1 1 15 SER O O 1.599 -8.199 -6.790 1.00 . A A . 15 SER O 1 1
2 360 1 1 15 SER OG O 5.664 -9.602 -5.380 1.00 . A A . 15 SER OG 1 1
2 361 1 1 16 CYS C C -0.997 -9.425 -5.261 1.00 . A A . 16 CYS C 1 1
2 362 1 1 16 CYS CA C 0.075 -10.324 -5.871 1.00 . A A . 16 CYS CA 1 1
2 363 1 1 16 CYS CB C -0.219 -11.787 -5.534 1.00 . A A . 16 CYS CB 1 1
2 364 1 1 16 CYS H H 1.818 -10.482 -4.680 1.00 . A A . 16 CYS H 1 1
2 365 1 1 16 CYS HA H 0.062 -10.201 -6.943 1.00 . A A . 16 CYS HA 1 1
2 366 1 1 16 CYS HB2 H -0.454 -11.866 -4.482 1.00 . A A . 16 CYS HB2 1 1
2 367 1 1 16 CYS HB3 H -1.069 -12.118 -6.113 1.00 . A A . 16 CYS HB3 1 1
2 368 1 1 16 CYS N N 1.400 -9.951 -5.392 1.00 . A A . 16 CYS N 1 1
2 369 1 1 16 CYS O O -0.811 -8.865 -4.181 1.00 . A A . 16 CYS O 1 1
2 370 1 1 16 CYS SG S 1.163 -12.922 -5.879 1.00 . A A . 16 CYS SG 1 1
2 371 1 1 17 ALA C C -4.371 -9.321 -4.973 1.00 . A A . 17 ALA C 1 1
2 372 1 1 17 ALA CA C -3.220 -8.463 -5.488 1.00 . A A . 17 ALA CA 1 1
2 373 1 1 17 ALA CB C -3.702 -7.542 -6.599 1.00 . A A . 17 ALA CB 1 1
2 374 1 1 17 ALA H H -2.207 -9.763 -6.816 1.00 . A A . 17 ALA H 1 1
2 375 1 1 17 ALA HA H -2.853 -7.849 -4.679 1.00 . A A . 17 ALA HA 1 1
2 376 1 1 17 ALA HB1 H -4.017 -8.134 -7.446 1.00 . A A . 17 ALA HB1 1 1
2 377 1 1 17 ALA HB2 H -4.534 -6.953 -6.242 1.00 . A A . 17 ALA HB2 1 1
2 378 1 1 17 ALA HB3 H -2.898 -6.886 -6.897 1.00 . A A . 17 ALA HB3 1 1
2 379 1 1 17 ALA N N -2.118 -9.291 -5.961 1.00 . A A . 17 ALA N 1 1
2 380 1 1 17 ALA O O -5.333 -9.555 -5.704 1.00 . A A . 17 ALA O 1 1
2 381 1 1 18 ALA C C -6.666 -9.868 -3.271 1.00 . A A . 18 ALA C 1 1
2 382 1 1 18 ALA CA C -5.261 -10.598 -3.095 1.00 . A A . 18 ALA CA 1 1
2 383 1 1 18 ALA CB C -5.013 -10.812 -1.648 1.00 . A A . 18 ALA CB 1 1
2 384 1 1 18 ALA H H -3.450 -9.533 -3.233 1.00 . A A . 18 ALA H 1 1
2 385 1 1 18 ALA HA H -5.364 -11.519 -3.637 1.00 . A A . 18 ALA HA 1 1
2 386 1 1 18 ALA HB1 H -5.887 -10.532 -1.078 1.00 . A A . 18 ALA HB1 1 1
2 387 1 1 18 ALA HB2 H -4.825 -11.867 -1.514 1.00 . A A . 18 ALA HB2 1 1
2 388 1 1 18 ALA N N -4.255 -9.772 -3.739 1.00 . A A . 18 ALA N 1 1
2 389 1 1 18 ALA O O -7.584 -10.406 -3.890 1.00 . A A . 18 ALA O 1 1
2 390 1 1 19 SER C C -8.303 -7.447 -4.187 1.00 . A A . 19 SER C 1 1
2 391 1 1 19 SER CA C -8.025 -7.914 -2.762 1.00 . A A . 19 SER CA 1 1
2 392 1 1 19 SER CB C -7.958 -6.708 -1.822 1.00 . A A . 19 SER CB 1 1
2 393 1 1 19 SER H H -6.015 -8.298 -2.217 1.00 . A A . 19 SER H 1 1
2 394 1 1 19 SER HA H -8.828 -8.562 -2.444 1.00 . A A . 19 SER HA 1 1
2 395 1 1 19 SER HB2 H -7.002 -6.220 -1.934 1.00 . A A . 19 SER HB2 1 1
2 396 1 1 19 SER HB3 H -8.748 -6.015 -2.074 1.00 . A A . 19 SER HB3 1 1
2 397 1 1 19 SER HG H -7.611 -6.515 0.096 1.00 . A A . 19 SER HG 1 1
2 398 1 1 19 SER N N -6.783 -8.675 -2.697 1.00 . A A . 19 SER N 1 1
2 399 1 1 19 SER O O -7.565 -6.634 -4.740 1.00 . A A . 19 SER O 1 1
2 400 1 1 19 SER OG O -8.113 -7.105 -0.471 1.00 . A A . 19 SER OG 1 1
3 401 1 1 1 ALA C C 2.843 -0.046 -0.200 1.00 . A A . 1 ALA C 1 1
3 402 1 1 1 ALA CA C 1.465 0.464 0.206 1.00 . A A . 1 ALA CA 1 1
3 403 1 1 1 ALA CB C 0.626 0.763 -1.028 1.00 . A A . 1 ALA CB 1 1
3 404 1 1 1 ALA H1 H 1.730 2.522 0.624 1.00 . A A . 1 ALA H1 1 1
3 405 1 1 1 ALA HA H 0.961 -0.304 0.776 1.00 . A A . 1 ALA HA 1 1
3 406 1 1 1 ALA HB1 H -0.299 0.206 -0.977 1.00 . A A . 1 ALA HB1 1 1
3 407 1 1 1 ALA HB2 H 0.409 1.820 -1.069 1.00 . A A . 1 ALA HB2 1 1
3 408 1 1 1 ALA HB3 H 1.172 0.472 -1.913 1.00 . A A . 1 ALA HB3 1 1
3 409 1 1 1 ALA N N 1.570 1.651 1.045 1.00 . A A . 1 ALA N 1 1
3 410 1 1 1 ALA O O 3.826 0.695 -0.161 1.00 . A A . 1 ALA O 1 1
3 411 1 1 2 CYS C C 4.757 -1.196 -2.203 1.00 . A A . 2 CYS C 1 1
3 412 1 1 2 CYS CA C 4.167 -1.925 -0.999 1.00 . A A . 2 CYS CA 1 1
3 413 1 1 2 CYS CB C 3.956 -3.402 -1.338 1.00 . A A . 2 CYS CB 1 1
3 414 1 1 2 CYS H H 2.090 -1.855 -0.597 1.00 . A A . 2 CYS H 1 1
3 415 1 1 2 CYS HA H 4.859 -1.849 -0.174 1.00 . A A . 2 CYS HA 1 1
3 416 1 1 2 CYS HB2 H 3.397 -3.870 -0.540 1.00 . A A . 2 CYS HB2 1 1
3 417 1 1 2 CYS HB3 H 3.392 -3.476 -2.256 1.00 . A A . 2 CYS HB3 1 1
3 418 1 1 2 CYS N N 2.909 -1.315 -0.588 1.00 . A A . 2 CYS N 1 1
3 419 1 1 2 CYS O O 4.029 -0.632 -3.019 1.00 . A A . 2 CYS O 1 1
3 420 1 1 2 CYS SG S 5.500 -4.344 -1.556 1.00 . A A . 2 CYS SG 1 1
3 421 1 1 3 GLY C C 7.064 -1.499 -4.552 1.00 . A A . 3 GLY C 1 1
3 422 1 1 3 GLY CA C 6.748 -0.550 -3.413 1.00 . A A . 3 GLY CA 1 1
3 423 1 1 3 GLY H H 6.613 -1.678 -1.627 1.00 . A A . 3 GLY H 1 1
3 424 1 1 3 GLY HA2 H 6.111 0.240 -3.782 1.00 . A A . 3 GLY HA2 1 1
3 425 1 1 3 GLY HA3 H 7.671 -0.116 -3.056 1.00 . A A . 3 GLY HA3 1 1
3 426 1 1 3 GLY N N 6.083 -1.212 -2.307 1.00 . A A . 3 GLY N 1 1
3 427 1 1 3 GLY O O 7.001 -1.132 -5.726 1.00 . A A . 3 GLY O 1 1
3 428 1 1 4 . C C 9.222 -3.708 -5.635 1.00 . A A . 4 DBB C 1 1
3 429 1 1 4 . CA C 7.731 -3.690 -5.253 1.00 . A A . 4 DBB CA 1 1
3 430 1 1 4 . CB C 7.245 -5.080 -4.794 1.00 . A A . 4 DBB CB 1 1
3 431 1 1 4 . CG C 7.367 -6.068 -5.943 1.00 . A A . 4 DBB CG 1 1
3 432 1 1 4 . H H 7.447 -2.985 -3.265 1.00 . A A . 4 DBB H 1 1
3 433 1 1 4 . HA H 7.166 -3.427 -6.125 1.00 . A A . 4 DBB HA 1 1
3 434 1 1 4 . HB2 H 6.203 -4.964 -4.588 1.00 . A A . 4 DBB HB2 1 1
3 435 1 1 4 . HG1 H 8.412 -6.212 -6.169 1.00 . A A . 4 DBB HG1 1 1
3 436 1 1 4 . HG2 H 6.859 -5.676 -6.811 1.00 . A A . 4 DBB HG2 1 1
3 437 1 1 4 . HG3 H 6.926 -7.009 -5.656 1.00 . A A . 4 DBB HG3 1 1
3 438 1 1 4 . N N 7.407 -2.726 -4.214 1.00 . A A . 4 DBB N 1 1
3 439 1 1 4 . O O 9.525 -3.569 -6.819 1.00 . A A . 4 DBB O 1 1
3 440 1 1 5 GLY C C 11.932 -4.782 -6.043 1.00 . A A . 5 GLY C 1 1
3 441 1 1 5 GLY CA C 11.544 -3.789 -4.966 1.00 . A A . 5 GLY CA 1 1
3 442 1 1 5 GLY H H 9.824 -3.931 -3.739 1.00 . A A . 5 GLY H 1 1
3 443 1 1 5 GLY HA2 H 11.808 -2.795 -5.295 1.00 . A A . 5 GLY HA2 1 1
3 444 1 1 5 GLY HA3 H 12.096 -4.018 -4.066 1.00 . A A . 5 GLY HA3 1 1
3 445 1 1 5 GLY N N 10.125 -3.823 -4.666 1.00 . A A . 5 GLY N 1 1
3 446 1 1 5 GLY O O 11.890 -4.530 -7.244 1.00 . A A . 5 GLY O 1 1
3 447 1 1 6 . C C 11.422 -7.872 -6.958 1.00 . A A . 6 IAS C 1 1
3 448 1 1 6 . CA C 12.635 -7.044 -6.579 1.00 . A A . 6 IAS CA 1 1
3 449 1 1 6 . CB C 13.799 -7.953 -6.142 1.00 . A A . 6 IAS CB 1 1
3 450 1 1 6 . CG C 13.609 -8.556 -4.757 1.00 . A A . 6 IAS CG 1 1
3 451 1 1 6 . H H 12.379 -6.206 -4.650 1.00 . A A . 6 IAS H 1 1
3 452 1 1 6 . HA H 12.909 -6.561 -7.510 1.00 . A A . 6 IAS HA 1 1
3 453 1 1 6 . HB2 H 14.693 -7.349 -6.086 1.00 . A A . 6 IAS HB2 1 1
3 454 1 1 6 . HB3 H 13.934 -8.726 -6.883 1.00 . A A . 6 IAS HB3 1 1
3 455 1 1 6 . HXT H 11.018 -9.092 -8.400 1.00 . A A . 6 IAS HXT 1 1
3 456 1 1 6 . N N 12.341 -5.990 -5.622 1.00 . A A . 6 IAS N 1 1
3 457 1 1 6 . O O 10.324 -7.735 -6.481 1.00 . A A . 6 IAS O 1 1
3 458 1 1 6 . OD1 O 13.304 -9.738 -4.604 1.00 . A A . 6 IAS OD1 1 1
3 459 1 1 6 . OXT O 11.744 -8.869 -7.798 1.00 . A A . 6 IAS OXT 1 1
3 460 1 1 7 GLY C C 12.221 -7.961 -1.851 1.00 . A A . 7 GLY C 1 1
3 461 1 1 7 GLY CA C 13.630 -8.169 -2.370 1.00 . A A . 7 GLY CA 1 1
3 462 1 1 7 GLY H H 14.031 -6.786 -3.922 1.00 . A A . 7 GLY H 1 1
3 463 1 1 7 GLY HA2 H 13.870 -9.220 -2.319 1.00 . A A . 7 GLY HA2 1 1
3 464 1 1 7 GLY HA3 H 14.317 -7.621 -1.741 1.00 . A A . 7 GLY HA3 1 1
3 465 1 1 7 GLY N N 13.789 -7.718 -3.740 1.00 . A A . 7 GLY N 1 1
3 466 1 1 7 GLY O O 11.995 -7.933 -0.641 1.00 . A A . 7 GLY O 1 1
3 467 1 1 8 CYS C C 9.156 -8.938 -2.215 1.00 . A A . 8 CYS C 1 1
3 468 1 1 8 CYS CA C 9.876 -7.605 -2.397 1.00 . A A . 8 CYS CA 1 1
3 469 1 1 8 CYS CB C 9.163 -6.769 -3.461 1.00 . A A . 8 CYS CB 1 1
3 470 1 1 8 CYS H H 11.512 -7.846 -3.718 1.00 . A A . 8 CYS H 1 1
3 471 1 1 8 CYS HA H 9.858 -7.070 -1.460 1.00 . A A . 8 CYS HA 1 1
3 472 1 1 8 CYS HB2 H 9.889 -6.151 -3.968 1.00 . A A . 8 CYS HB2 1 1
3 473 1 1 8 CYS HB3 H 8.699 -7.432 -4.178 1.00 . A A . 8 CYS HB3 1 1
3 474 1 1 8 CYS N N 11.270 -7.814 -2.767 1.00 . A A . 8 CYS N 1 1
3 475 1 1 8 CYS O O 9.558 -9.955 -2.780 1.00 . A A . 8 CYS O 1 1
3 476 1 1 8 CYS SG S 7.867 -5.672 -2.801 1.00 . A A . 8 CYS SG 1 1
3 477 1 1 9 ALA C C 6.479 -10.515 -2.386 1.00 . A A . 9 ALA C 1 1
3 478 1 1 9 ALA CA C 7.312 -10.132 -1.167 1.00 . A A . 9 ALA CA 1 1
3 479 1 1 9 ALA CB C 6.416 -9.936 0.047 1.00 . A A . 9 ALA CB 1 1
3 480 1 1 9 ALA H H 7.818 -8.084 -1.000 1.00 . A A . 9 ALA H 1 1
3 481 1 1 9 ALA HA H 8.003 -10.934 -0.949 1.00 . A A . 9 ALA HA 1 1
3 482 1 1 9 ALA HB1 H 5.652 -9.208 -0.185 1.00 . A A . 9 ALA HB1 1 1
3 483 1 1 9 ALA HB2 H 5.952 -10.876 0.307 1.00 . A A . 9 ALA HB2 1 1
3 484 1 1 9 ALA HB3 H 7.009 -9.584 0.878 1.00 . A A . 9 ALA HB3 1 1
3 485 1 1 9 ALA N N 8.089 -8.925 -1.422 1.00 . A A . 9 ALA N 1 1
3 486 1 1 9 ALA O O 6.301 -9.717 -3.305 1.00 . A A . 9 ALA O 1 1
3 487 1 1 10 LYS C C 3.701 -12.398 -3.062 1.00 . A A . 10 LYS C 1 1
3 488 1 1 10 LYS CA C 5.155 -12.234 -3.491 1.00 . A A . 10 LYS CA 1 1
3 489 1 1 10 LYS CB C 5.702 -13.569 -4.001 1.00 . A A . 10 LYS CB 1 1
3 490 1 1 10 LYS CD C 4.680 -15.691 -3.126 1.00 . A A . 10 LYS CD 1 1
3 491 1 1 10 LYS CE C 5.077 -16.724 -4.169 1.00 . A A . 10 LYS CE 1 1
3 492 1 1 10 LYS CG C 5.767 -14.647 -2.933 1.00 . A A . 10 LYS CG 1 1
3 493 1 1 10 LYS H H 6.148 -12.334 -1.624 1.00 . A A . 10 LYS H 1 1
3 494 1 1 10 LYS HA H 5.204 -11.507 -4.287 1.00 . A A . 10 LYS HA 1 1
3 495 1 1 10 LYS HB2 H 5.067 -13.922 -4.801 1.00 . A A . 10 LYS HB2 1 1
3 496 1 1 10 LYS HB3 H 6.699 -13.413 -4.387 1.00 . A A . 10 LYS HB3 1 1
3 497 1 1 10 LYS HD2 H 4.504 -16.193 -2.187 1.00 . A A . 10 LYS HD2 1 1
3 498 1 1 10 LYS HD3 H 3.773 -15.197 -3.447 1.00 . A A . 10 LYS HD3 1 1
3 499 1 1 10 LYS HE2 H 4.186 -17.222 -4.520 1.00 . A A . 10 LYS HE2 1 1
3 500 1 1 10 LYS HE3 H 5.555 -16.217 -4.995 1.00 . A A . 10 LYS HE3 1 1
3 501 1 1 10 LYS HG2 H 6.730 -15.134 -2.984 1.00 . A A . 10 LYS HG2 1 1
3 502 1 1 10 LYS HG3 H 5.645 -14.188 -1.963 1.00 . A A . 10 LYS HG3 1 1
3 503 1 1 10 LYS HZ1 H 5.753 -18.688 -3.952 1.00 . A A . 10 LYS HZ1 1 1
3 504 1 1 10 LYS HZ2 H 5.978 -17.730 -2.576 1.00 . A A . 10 LYS HZ2 1 1
3 505 1 1 10 LYS HZ3 H 6.987 -17.531 -3.919 1.00 . A A . 10 LYS HZ3 1 1
3 506 1 1 10 LYS N N 5.971 -11.743 -2.386 1.00 . A A . 10 LYS N 1 1
3 507 1 1 10 LYS NZ N 6.015 -17.739 -3.615 1.00 . A A . 10 LYS NZ 1 1
3 508 1 1 10 LYS O O 3.322 -12.070 -1.937 1.00 . A A . 10 LYS O 1 1
3 509 1 1 11 . C C 0.797 -11.815 -3.107 1.00 . A A . 11 DBB C 1 1
3 510 1 1 11 . CA C 1.479 -13.092 -3.628 1.00 . A A . 11 DBB CA 1 1
3 511 1 1 11 . CB C 0.756 -13.658 -4.868 1.00 . A A . 11 DBB CB 1 1
3 512 1 1 11 . CG C -0.658 -14.068 -4.491 1.00 . A A . 11 DBB CG 1 1
3 513 1 1 11 . H H 3.219 -13.160 -4.851 1.00 . A A . 11 DBB H 1 1
3 514 1 1 11 . HA H 1.424 -13.838 -2.860 1.00 . A A . 11 DBB HA 1 1
3 515 1 1 11 . HB2 H 1.285 -14.550 -5.124 1.00 . A A . 11 DBB HB2 1 1
3 516 1 1 11 . HG1 H -1.194 -13.196 -4.147 1.00 . A A . 11 DBB HG1 1 1
3 517 1 1 11 . HG2 H -0.622 -14.805 -3.703 1.00 . A A . 11 DBB HG2 1 1
3 518 1 1 11 . HG3 H -1.155 -14.480 -5.354 1.00 . A A . 11 DBB HG3 1 1
3 519 1 1 11 . N N 2.882 -12.909 -3.962 1.00 . A A . 11 DBB N 1 1
3 520 1 1 11 . O O 1.192 -10.726 -3.526 1.00 . A A . 11 DBB O 1 1
3 521 1 1 12 CYS C C -0.166 -10.065 -0.674 1.00 . A A . 12 CYS C 1 1
3 522 1 1 12 CYS CA C -0.953 -10.777 -1.771 1.00 . A A . 12 CYS CA 1 1
3 523 1 1 12 CYS CB C -2.324 -11.199 -1.238 1.00 . A A . 12 CYS CB 1 1
3 524 1 1 12 CYS H H -0.491 -12.833 -1.966 1.00 . A A . 12 CYS H 1 1
3 525 1 1 12 CYS HA H -1.092 -10.097 -2.597 1.00 . A A . 12 CYS HA 1 1
3 526 1 1 12 CYS HB2 H -2.199 -11.655 -0.267 1.00 . A A . 12 CYS HB2 1 1
3 527 1 1 12 CYS HB3 H -2.949 -10.324 -1.141 1.00 . A A . 12 CYS HB3 1 1
3 528 1 1 12 CYS N N -0.223 -11.938 -2.264 1.00 . A A . 12 CYS N 1 1
3 529 1 1 12 CYS O O -0.644 -9.916 0.450 1.00 . A A . 12 CYS O 1 1
3 530 1 1 12 CYS SG S -3.199 -12.392 -2.300 1.00 . A A . 12 CYS SG 1 1
3 531 1 1 13 ALA C C 2.391 -7.605 -0.630 1.00 . A A . 13 ALA C 1 1
3 532 1 1 13 ALA CA C 1.895 -8.928 -0.057 1.00 . A A . 13 ALA CA 1 1
3 533 1 1 13 ALA CB C 3.072 -9.807 0.341 1.00 . A A . 13 ALA CB 1 1
3 534 1 1 13 ALA H H 1.368 -9.775 -1.923 1.00 . A A . 13 ALA H 1 1
3 535 1 1 13 ALA HA H 1.310 -8.729 0.830 1.00 . A A . 13 ALA HA 1 1
3 536 1 1 13 ALA HB1 H 3.771 -9.227 0.927 1.00 . A A . 13 ALA HB1 1 1
3 537 1 1 13 ALA HB2 H 2.716 -10.641 0.927 1.00 . A A . 13 ALA HB2 1 1
3 538 1 1 13 ALA HB3 H 3.563 -10.174 -0.547 1.00 . A A . 13 ALA HB3 1 1
3 539 1 1 13 ALA N N 1.043 -9.627 -1.011 1.00 . A A . 13 ALA N 1 1
3 540 1 1 13 ALA O O 2.524 -6.631 0.110 1.00 . A A . 13 ALA O 1 1
3 541 1 1 14 ALA C C 3.042 -6.718 -4.188 1.00 . A A . 14 ALA C 1 1
3 542 1 1 14 ALA CA C 3.128 -6.413 -2.626 1.00 . A A . 14 ALA CA 1 1
3 543 1 1 14 ALA CB C 4.526 -6.046 -2.289 1.00 . A A . 14 ALA CB 1 1
3 544 1 1 14 ALA H H 2.516 -8.418 -2.432 1.00 . A A . 14 ALA H 1 1
3 545 1 1 14 ALA HA H 2.439 -5.605 -2.470 1.00 . A A . 14 ALA HA 1 1
3 546 1 1 14 ALA HB1 H 4.921 -6.733 -1.555 1.00 . A A . 14 ALA HB1 1 1
3 547 1 1 14 ALA HB2 H 5.101 -6.129 -3.199 1.00 . A A . 14 ALA HB2 1 1
3 548 1 1 14 ALA N N 2.653 -7.591 -1.923 1.00 . A A . 14 ALA N 1 1
3 549 1 1 14 ALA O O 2.663 -5.855 -4.980 1.00 . A A . 14 ALA O 1 1
3 550 1 1 15 SER C C 1.985 -8.511 -6.479 1.00 . A A . 15 SER C 1 1
3 551 1 1 15 SER CA C 3.412 -8.332 -5.972 1.00 . A A . 15 SER CA 1 1
3 552 1 1 15 SER CB C 4.198 -9.631 -6.159 1.00 . A A . 15 SER CB 1 1
3 553 1 1 15 SER H H 3.711 -8.579 -3.890 1.00 . A A . 15 SER H 1 1
3 554 1 1 15 SER HA H 3.889 -7.548 -6.541 1.00 . A A . 15 SER HA 1 1
3 555 1 1 15 SER HB2 H 5.219 -9.480 -5.842 1.00 . A A . 15 SER HB2 1 1
3 556 1 1 15 SER HB3 H 3.747 -10.411 -5.563 1.00 . A A . 15 SER HB3 1 1
3 557 1 1 15 SER HG H 4.453 -9.297 -8.073 1.00 . A A . 15 SER HG 1 1
3 558 1 1 15 SER N N 3.419 -7.935 -4.569 1.00 . A A . 15 SER N 1 1
3 559 1 1 15 SER O O 1.473 -7.683 -7.234 1.00 . A A . 15 SER O 1 1
3 560 1 1 15 SER OG O 4.197 -10.037 -7.517 1.00 . A A . 15 SER OG 1 1
3 561 1 1 16 CYS C C -1.014 -8.994 -5.729 1.00 . A A . 16 CYS C 1 1
3 562 1 1 16 CYS CA C -0.023 -9.888 -6.469 1.00 . A A . 16 CYS CA 1 1
3 563 1 1 16 CYS CB C -0.354 -11.359 -6.211 1.00 . A A . 16 CYS CB 1 1
3 564 1 1 16 CYS H H 1.806 -10.221 -5.457 1.00 . A A . 16 CYS H 1 1
3 565 1 1 16 CYS HA H -0.101 -9.691 -7.528 1.00 . A A . 16 CYS HA 1 1
3 566 1 1 16 CYS HB2 H -0.540 -11.498 -5.156 1.00 . A A . 16 CYS HB2 1 1
3 567 1 1 16 CYS HB3 H -1.242 -11.623 -6.765 1.00 . A A . 16 CYS HB3 1 1
3 568 1 1 16 CYS N N 1.346 -9.598 -6.059 1.00 . A A . 16 CYS N 1 1
3 569 1 1 16 CYS O O -0.722 -8.493 -4.644 1.00 . A A . 16 CYS O 1 1
3 570 1 1 16 CYS SG S 0.967 -12.515 -6.696 1.00 . A A . 16 CYS SG 1 1
3 571 1 1 17 ALA C C -4.420 -8.809 -5.295 1.00 . A A . 17 ALA C 1 1
3 572 1 1 17 ALA CA C -3.221 -7.969 -5.721 1.00 . A A . 17 ALA CA 1 1
3 573 1 1 17 ALA CB C -3.654 -6.880 -6.691 1.00 . A A . 17 ALA CB 1 1
3 574 1 1 17 ALA H H -2.359 -9.226 -7.189 1.00 . A A . 17 ALA H 1 1
3 575 1 1 17 ALA HA H -2.799 -7.493 -4.848 1.00 . A A . 17 ALA HA 1 1
3 576 1 1 17 ALA HB1 H -4.223 -7.321 -7.496 1.00 . A A . 17 ALA HB1 1 1
3 577 1 1 17 ALA HB2 H -4.267 -6.158 -6.171 1.00 . A A . 17 ALA HB2 1 1
3 578 1 1 17 ALA HB3 H -2.782 -6.388 -7.093 1.00 . A A . 17 ALA HB3 1 1
3 579 1 1 17 ALA N N -2.186 -8.800 -6.325 1.00 . A A . 17 ALA N 1 1
3 580 1 1 17 ALA O O -5.398 -8.897 -6.036 1.00 . A A . 17 ALA O 1 1
3 581 1 1 18 ALA C C -6.452 -9.271 -2.895 1.00 . A A . 18 ALA C 1 1
3 582 1 1 18 ALA CA C -5.378 -10.238 -3.567 1.00 . A A . 18 ALA CA 1 1
3 583 1 1 18 ALA CB C -4.896 -11.198 -2.543 1.00 . A A . 18 ALA CB 1 1
3 584 1 1 18 ALA H H -3.506 -9.278 -3.602 1.00 . A A . 18 ALA H 1 1
3 585 1 1 18 ALA HA H -5.910 -10.719 -4.366 1.00 . A A . 18 ALA HA 1 1
3 586 1 1 18 ALA HB1 H -4.848 -10.716 -1.578 1.00 . A A . 18 ALA HB1 1 1
3 587 1 1 18 ALA HB2 H -5.615 -12.003 -2.503 1.00 . A A . 18 ALA HB2 1 1
3 588 1 1 18 ALA N N -4.326 -9.407 -4.123 1.00 . A A . 18 ALA N 1 1
3 589 1 1 18 ALA O O -7.658 -9.462 -3.051 1.00 . A A . 18 ALA O 1 1
3 590 1 1 19 SER C C -6.447 -5.900 -1.778 1.00 . A A . 19 SER C 1 1
3 591 1 1 19 SER CA C -6.841 -7.340 -1.465 1.00 . A A . 19 SER CA 1 1
3 592 1 1 19 SER CB C -6.790 -7.578 0.045 1.00 . A A . 19 SER CB 1 1
3 593 1 1 19 SER H H -4.994 -8.180 -2.070 1.00 . A A . 19 SER H 1 1
3 594 1 1 19 SER HA H -7.849 -7.509 -1.814 1.00 . A A . 19 SER HA 1 1
3 595 1 1 19 SER HB2 H -6.828 -8.638 0.242 1.00 . A A . 19 SER HB2 1 1
3 596 1 1 19 SER HB3 H -5.871 -7.171 0.440 1.00 . A A . 19 SER HB3 1 1
3 597 1 1 19 SER HG H -8.675 -7.481 0.569 1.00 . A A . 19 SER HG 1 1
3 598 1 1 19 SER N N -5.965 -8.280 -2.155 1.00 . A A . 19 SER N 1 1
3 599 1 1 19 SER O O -5.290 -5.514 -1.618 1.00 . A A . 19 SER O 1 1
3 600 1 1 19 SER OG O -7.883 -6.954 0.697 1.00 . A A . 19 SER OG 1 1
4 601 1 1 1 ALA C C 3.091 -0.347 -0.306 1.00 . A A . 1 ALA C 1 1
4 602 1 1 1 ALA CA C 1.777 0.304 0.113 1.00 . A A . 1 ALA CA 1 1
4 603 1 1 1 ALA CB C 1.483 1.513 -0.762 1.00 . A A . 1 ALA CB 1 1
4 604 1 1 1 ALA H1 H 2.571 1.208 1.855 1.00 . A A . 1 ALA H1 1 1
4 605 1 1 1 ALA HA H 0.976 -0.408 -0.018 1.00 . A A . 1 ALA HA 1 1
4 606 1 1 1 ALA HB1 H 0.764 1.240 -1.522 1.00 . A A . 1 ALA HB1 1 1
4 607 1 1 1 ALA HB2 H 1.079 2.308 -0.154 1.00 . A A . 1 ALA HB2 1 1
4 608 1 1 1 ALA HB3 H 2.395 1.848 -1.233 1.00 . A A . 1 ALA HB3 1 1
4 609 1 1 1 ALA N N 1.808 0.693 1.518 1.00 . A A . 1 ALA N 1 1
4 610 1 1 1 ALA O O 4.153 -0.025 0.229 1.00 . A A . 1 ALA O 1 1
4 611 1 1 2 CYS C C 4.662 -1.373 -3.082 1.00 . A A . 2 CYS C 1 1
4 612 1 1 2 CYS CA C 4.195 -1.961 -1.754 1.00 . A A . 2 CYS CA 1 1
4 613 1 1 2 CYS CB C 3.900 -3.454 -1.920 1.00 . A A . 2 CYS CB 1 1
4 614 1 1 2 CYS H H 2.137 -1.477 -1.651 1.00 . A A . 2 CYS H 1 1
4 615 1 1 2 CYS HA H 4.980 -1.838 -1.024 1.00 . A A . 2 CYS HA 1 1
4 616 1 1 2 CYS HB2 H 3.390 -3.812 -1.038 1.00 . A A . 2 CYS HB2 1 1
4 617 1 1 2 CYS HB3 H 3.263 -3.593 -2.780 1.00 . A A . 2 CYS HB3 1 1
4 618 1 1 2 CYS N N 3.013 -1.264 -1.264 1.00 . A A . 2 CYS N 1 1
4 619 1 1 2 CYS O O 3.875 -0.792 -3.827 1.00 . A A . 2 CYS O 1 1
4 620 1 1 2 CYS SG S 5.385 -4.483 -2.156 1.00 . A A . 2 CYS SG 1 1
4 621 1 1 3 GLY C C 6.923 -2.108 -5.564 1.00 . A A . 3 GLY C 1 1
4 622 1 1 3 GLY CA C 6.501 -1.009 -4.610 1.00 . A A . 3 GLY CA 1 1
4 623 1 1 3 GLY H H 6.532 -2.002 -2.740 1.00 . A A . 3 GLY H 1 1
4 624 1 1 3 GLY HA2 H 5.755 -0.394 -5.092 1.00 . A A . 3 GLY HA2 1 1
4 625 1 1 3 GLY HA3 H 7.362 -0.399 -4.379 1.00 . A A . 3 GLY HA3 1 1
4 626 1 1 3 GLY N N 5.951 -1.529 -3.372 1.00 . A A . 3 GLY N 1 1
4 627 1 1 3 GLY O O 6.954 -1.921 -6.781 1.00 . A A . 3 GLY O 1 1
4 628 1 1 4 . C C 9.193 -4.404 -6.117 1.00 . A A . 4 DBB C 1 1
4 629 1 1 4 . CA C 7.674 -4.362 -5.872 1.00 . A A . 4 DBB CA 1 1
4 630 1 1 4 . CB C 7.160 -5.679 -5.257 1.00 . A A . 4 DBB CB 1 1
4 631 1 1 4 . CG C 7.391 -6.822 -6.231 1.00 . A A . 4 DBB CG 1 1
4 632 1 1 4 . H H 7.215 -3.377 -4.042 1.00 . A A . 4 DBB H 1 1
4 633 1 1 4 . HA H 7.186 -4.241 -6.819 1.00 . A A . 4 DBB HA 1 1
4 634 1 1 4 . HB2 H 6.103 -5.555 -5.161 1.00 . A A . 4 DBB HB2 1 1
4 635 1 1 4 . HG1 H 8.451 -6.920 -6.410 1.00 . A A . 4 DBB HG1 1 1
4 636 1 1 4 . HG2 H 6.885 -6.611 -7.162 1.00 . A A . 4 DBB HG2 1 1
4 637 1 1 4 . HG3 H 7.010 -7.738 -5.809 1.00 . A A . 4 DBB HG3 1 1
4 638 1 1 4 . N N 7.252 -3.263 -5.019 1.00 . A A . 4 DBB N 1 1
4 639 1 1 4 . O O 9.600 -4.419 -7.278 1.00 . A A . 4 DBB O 1 1
4 640 1 1 5 GLY C C 11.935 -5.478 -6.138 1.00 . A A . 5 GLY C 1 1
4 641 1 1 5 GLY CA C 11.447 -4.356 -5.243 1.00 . A A . 5 GLY CA 1 1
4 642 1 1 5 GLY H H 9.626 -4.364 -4.163 1.00 . A A . 5 GLY H 1 1
4 643 1 1 5 GLY HA2 H 11.734 -3.411 -5.679 1.00 . A A . 5 GLY HA2 1 1
4 644 1 1 5 GLY HA3 H 11.919 -4.452 -4.276 1.00 . A A . 5 GLY HA3 1 1
4 645 1 1 5 GLY N N 10.007 -4.374 -5.066 1.00 . A A . 5 GLY N 1 1
4 646 1 1 5 GLY O O 12.001 -5.389 -7.361 1.00 . A A . 5 GLY O 1 1
4 647 1 1 6 . C C 11.518 -8.665 -6.677 1.00 . A A . 6 IAS C 1 1
4 648 1 1 6 . CA C 12.692 -7.779 -6.300 1.00 . A A . 6 IAS CA 1 1
4 649 1 1 6 . CB C 13.807 -8.609 -5.639 1.00 . A A . 6 IAS CB 1 1
4 650 1 1 6 . CG C 13.487 -9.023 -4.209 1.00 . A A . 6 IAS CG 1 1
4 651 1 1 6 . H H 12.259 -6.696 -4.532 1.00 . A A . 6 IAS H 1 1
4 652 1 1 6 . HA H 13.053 -7.420 -7.257 1.00 . A A . 6 IAS HA 1 1
4 653 1 1 6 . HB2 H 14.693 -7.993 -5.581 1.00 . A A . 6 IAS HB2 1 1
4 654 1 1 6 . HB3 H 14.010 -9.473 -6.253 1.00 . A A . 6 IAS HB3 1 1
4 655 1 1 6 . HXT H 12.289 -10.182 -7.589 1.00 . A A . 6 IAS HXT 1 1
4 656 1 1 6 . N N 12.308 -6.612 -5.523 1.00 . A A . 6 IAS N 1 1
4 657 1 1 6 . O O 10.523 -8.800 -6.011 1.00 . A A . 6 IAS O 1 1
4 658 1 1 6 . OD1 O 13.152 -10.174 -3.930 1.00 . A A . 6 IAS OD1 1 1
4 659 1 1 6 . OXT O 11.773 -9.384 -7.781 1.00 . A A . 6 IAS OXT 1 1
4 660 1 1 7 GLY C C 11.869 -8.006 -1.532 1.00 . A A . 7 GLY C 1 1
4 661 1 1 7 GLY CA C 13.304 -8.325 -1.901 1.00 . A A . 7 GLY CA 1 1
4 662 1 1 7 GLY H H 13.862 -7.160 -3.579 1.00 . A A . 7 GLY H 1 1
4 663 1 1 7 GLY HA2 H 13.494 -9.369 -1.699 1.00 . A A . 7 GLY HA2 1 1
4 664 1 1 7 GLY HA3 H 13.963 -7.725 -1.291 1.00 . A A . 7 GLY HA3 1 1
4 665 1 1 7 GLY N N 13.590 -8.059 -3.299 1.00 . A A . 7 GLY N 1 1
4 666 1 1 7 GLY O O 11.571 -7.701 -0.377 1.00 . A A . 7 GLY O 1 1
4 667 1 1 8 CYS C C 8.800 -9.064 -1.952 1.00 . A A . 8 CYS C 1 1
4 668 1 1 8 CYS CA C 9.566 -7.788 -2.289 1.00 . A A . 8 CYS CA 1 1
4 669 1 1 8 CYS CB C 8.955 -7.124 -3.524 1.00 . A A . 8 CYS CB 1 1
4 670 1 1 8 CYS H H 11.277 -8.323 -3.416 1.00 . A A . 8 CYS H 1 1
4 671 1 1 8 CYS HA H 9.495 -7.108 -1.453 1.00 . A A . 8 CYS HA 1 1
4 672 1 1 8 CYS HB2 H 9.726 -6.577 -4.048 1.00 . A A . 8 CYS HB2 1 1
4 673 1 1 8 CYS HB3 H 8.558 -7.888 -4.176 1.00 . A A . 8 CYS HB3 1 1
4 674 1 1 8 CYS N N 10.978 -8.074 -2.515 1.00 . A A . 8 CYS N 1 1
4 675 1 1 8 CYS O O 9.076 -10.129 -2.502 1.00 . A A . 8 CYS O 1 1
4 676 1 1 8 CYS SG S 7.606 -5.957 -3.151 1.00 . A A . 8 CYS SG 1 1
4 677 1 1 9 ALA C C 6.197 -10.617 -1.800 1.00 . A A . 9 ALA C 1 1
4 678 1 1 9 ALA CA C 7.028 -10.088 -0.636 1.00 . A A . 9 ALA CA 1 1
4 679 1 1 9 ALA CB C 6.127 -9.707 0.529 1.00 . A A . 9 ALA CB 1 1
4 680 1 1 9 ALA H H 7.664 -8.070 -0.642 1.00 . A A . 9 ALA H 1 1
4 681 1 1 9 ALA HA H 7.697 -10.868 -0.301 1.00 . A A . 9 ALA HA 1 1
4 682 1 1 9 ALA HB1 H 5.277 -9.152 0.159 1.00 . A A . 9 ALA HB1 1 1
4 683 1 1 9 ALA HB2 H 5.784 -10.602 1.027 1.00 . A A . 9 ALA HB2 1 1
4 684 1 1 9 ALA HB3 H 6.679 -9.096 1.227 1.00 . A A . 9 ALA HB3 1 1
4 685 1 1 9 ALA N N 7.836 -8.946 -1.045 1.00 . A A . 9 ALA N 1 1
4 686 1 1 9 ALA O O 6.080 -9.967 -2.839 1.00 . A A . 9 ALA O 1 1
4 687 1 1 10 LYS C C 3.344 -12.513 -2.208 1.00 . A A . 10 LYS C 1 1
4 688 1 1 10 LYS CA C 4.799 -12.418 -2.654 1.00 . A A . 10 LYS CA 1 1
4 689 1 1 10 LYS CB C 5.332 -13.812 -2.993 1.00 . A A . 10 LYS CB 1 1
4 690 1 1 10 LYS CD C 6.664 -13.699 -5.120 1.00 . A A . 10 LYS CD 1 1
4 691 1 1 10 LYS CE C 8.011 -13.302 -5.705 1.00 . A A . 10 LYS CE 1 1
4 692 1 1 10 LYS CG C 6.722 -13.800 -3.605 1.00 . A A . 10 LYS CG 1 1
4 693 1 1 10 LYS H H 5.751 -12.271 -0.769 1.00 . A A . 10 LYS H 1 1
4 694 1 1 10 LYS HA H 4.854 -11.797 -3.535 1.00 . A A . 10 LYS HA 1 1
4 695 1 1 10 LYS HB2 H 5.364 -14.402 -2.089 1.00 . A A . 10 LYS HB2 1 1
4 696 1 1 10 LYS HB3 H 4.657 -14.281 -3.694 1.00 . A A . 10 LYS HB3 1 1
4 697 1 1 10 LYS HD2 H 6.377 -14.658 -5.525 1.00 . A A . 10 LYS HD2 1 1
4 698 1 1 10 LYS HD3 H 5.928 -12.955 -5.394 1.00 . A A . 10 LYS HD3 1 1
4 699 1 1 10 LYS HE2 H 8.122 -12.231 -5.624 1.00 . A A . 10 LYS HE2 1 1
4 700 1 1 10 LYS HE3 H 8.791 -13.788 -5.139 1.00 . A A . 10 LYS HE3 1 1
4 701 1 1 10 LYS HG2 H 7.268 -12.952 -3.219 1.00 . A A . 10 LYS HG2 1 1
4 702 1 1 10 LYS HG3 H 7.233 -14.713 -3.334 1.00 . A A . 10 LYS HG3 1 1
4 703 1 1 10 LYS HZ1 H 7.600 -13.032 -7.735 1.00 . A A . 10 LYS HZ1 1 1
4 704 1 1 10 LYS HZ2 H 7.752 -14.653 -7.276 1.00 . A A . 10 LYS HZ2 1 1
4 705 1 1 10 LYS HZ3 H 9.130 -13.684 -7.426 1.00 . A A . 10 LYS HZ3 1 1
4 706 1 1 10 LYS N N 5.621 -11.801 -1.620 1.00 . A A . 10 LYS N 1 1
4 707 1 1 10 LYS NZ N 8.132 -13.695 -7.136 1.00 . A A . 10 LYS NZ 1 1
4 708 1 1 10 LYS O O 2.964 -12.015 -1.148 1.00 . A A . 10 LYS O 1 1
4 709 1 1 11 . C C 0.437 -11.941 -2.363 1.00 . A A . 11 DBB C 1 1
4 710 1 1 11 . CA C 1.122 -13.285 -2.664 1.00 . A A . 11 DBB CA 1 1
4 711 1 1 11 . CB C 0.404 -14.048 -3.796 1.00 . A A . 11 DBB CB 1 1
4 712 1 1 11 . CG C -1.010 -14.394 -3.360 1.00 . A A . 11 DBB CG 1 1
4 713 1 1 11 . H H 2.865 -13.542 -3.859 1.00 . A A . 11 DBB H 1 1
4 714 1 1 11 . HA H 1.067 -13.894 -1.784 1.00 . A A . 11 DBB HA 1 1
4 715 1 1 11 . HB2 H 0.936 -14.970 -3.899 1.00 . A A . 11 DBB HB2 1 1
4 716 1 1 11 . HG1 H -1.559 -13.478 -3.201 1.00 . A A . 11 DBB HG1 1 1
4 717 1 1 11 . HG2 H -0.977 -14.961 -2.442 1.00 . A A . 11 DBB HG2 1 1
4 718 1 1 11 . HG3 H -1.492 -14.974 -4.130 1.00 . A A . 11 DBB HG3 1 1
4 719 1 1 11 . N N 2.527 -13.156 -3.019 1.00 . A A . 11 DBB N 1 1
4 720 1 1 11 . O O 0.847 -10.931 -2.936 1.00 . A A . 11 DBB O 1 1
4 721 1 1 12 CYS C C -0.569 -9.832 -0.253 1.00 . A A . 12 CYS C 1 1
4 722 1 1 12 CYS CA C -1.336 -10.704 -1.243 1.00 . A A . 12 CYS CA 1 1
4 723 1 1 12 CYS CB C -2.721 -11.035 -0.683 1.00 . A A . 12 CYS CB 1 1
4 724 1 1 12 CYS H H -0.882 -12.767 -1.107 1.00 . A A . 12 CYS H 1 1
4 725 1 1 12 CYS HA H -1.452 -10.159 -2.168 1.00 . A A . 12 CYS HA 1 1
4 726 1 1 12 CYS HB2 H -2.618 -11.357 0.343 1.00 . A A . 12 CYS HB2 1 1
4 727 1 1 12 CYS HB3 H -3.335 -10.147 -0.716 1.00 . A A . 12 CYS HB3 1 1
4 728 1 1 12 CYS N N -0.602 -11.930 -1.534 1.00 . A A . 12 CYS N 1 1
4 729 1 1 12 CYS O O -1.070 -9.511 0.825 1.00 . A A . 12 CYS O 1 1
4 730 1 1 12 CYS SG S -3.595 -12.351 -1.590 1.00 . A A . 12 CYS SG 1 1
4 731 1 1 13 ALA C C 2.038 -7.425 -0.545 1.00 . A A . 13 ALA C 1 1
4 732 1 1 13 ALA CA C 1.484 -8.618 0.228 1.00 . A A . 13 ALA CA 1 1
4 733 1 1 13 ALA CB C 2.619 -9.438 0.822 1.00 . A A . 13 ALA CB 1 1
4 734 1 1 13 ALA H H 0.993 -9.741 -1.497 1.00 . A A . 13 ALA H 1 1
4 735 1 1 13 ALA HA H 0.872 -8.254 1.041 1.00 . A A . 13 ALA HA 1 1
4 736 1 1 13 ALA HB1 H 3.273 -9.773 0.029 1.00 . A A . 13 ALA HB1 1 1
4 737 1 1 13 ALA HB2 H 3.178 -8.829 1.517 1.00 . A A . 13 ALA HB2 1 1
4 738 1 1 13 ALA HB3 H 2.212 -10.294 1.339 1.00 . A A . 13 ALA HB3 1 1
4 739 1 1 13 ALA N N 0.649 -9.453 -0.626 1.00 . A A . 13 ALA N 1 1
4 740 1 1 13 ALA O O 2.169 -6.339 0.019 1.00 . A A . 13 ALA O 1 1
4 741 1 1 14 ALA C C 2.809 -7.170 -4.176 1.00 . A A . 14 ALA C 1 1
4 742 1 1 14 ALA CA C 2.888 -6.617 -2.684 1.00 . A A . 14 ALA CA 1 1
4 743 1 1 14 ALA CB C 4.295 -6.257 -2.383 1.00 . A A . 14 ALA CB 1 1
4 744 1 1 14 ALA H H 2.213 -8.544 -2.170 1.00 . A A . 14 ALA H 1 1
4 745 1 1 14 ALA HA H 2.233 -5.767 -2.676 1.00 . A A . 14 ALA HA 1 1
4 746 1 1 14 ALA HB1 H 4.597 -6.699 -1.444 1.00 . A A . 14 ALA HB1 1 1
4 747 1 1 14 ALA HB2 H 4.901 -6.665 -3.178 1.00 . A A . 14 ALA HB2 1 1
4 748 1 1 14 ALA N N 2.352 -7.644 -1.808 1.00 . A A . 14 ALA N 1 1
4 749 1 1 14 ALA O O 2.457 -6.440 -5.102 1.00 . A A . 14 ALA O 1 1
4 750 1 1 15 SER C C 1.733 -9.278 -6.165 1.00 . A A . 15 SER C 1 1
4 751 1 1 15 SER CA C 3.160 -9.060 -5.670 1.00 . A A . 15 SER CA 1 1
4 752 1 1 15 SER CB C 3.908 -10.394 -5.631 1.00 . A A . 15 SER CB 1 1
4 753 1 1 15 SER H H 3.433 -8.971 -3.572 1.00 . A A . 15 SER H 1 1
4 754 1 1 15 SER HA H 3.666 -8.393 -6.351 1.00 . A A . 15 SER HA 1 1
4 755 1 1 15 SER HB2 H 4.931 -10.222 -5.335 1.00 . A A . 15 SER HB2 1 1
4 756 1 1 15 SER HB3 H 3.431 -11.050 -4.916 1.00 . A A . 15 SER HB3 1 1
4 757 1 1 15 SER HG H 4.518 -10.573 -7.484 1.00 . A A . 15 SER HG 1 1
4 758 1 1 15 SER N N 3.162 -8.440 -4.350 1.00 . A A . 15 SER N 1 1
4 759 1 1 15 SER O O 1.253 -8.564 -7.045 1.00 . A A . 15 SER O 1 1
4 760 1 1 15 SER OG O 3.900 -11.021 -6.902 1.00 . A A . 15 SER OG 1 1
4 761 1 1 16 CYS C C -1.286 -9.572 -5.384 1.00 . A A . 16 CYS C 1 1
4 762 1 1 16 CYS CA C -0.311 -10.586 -5.974 1.00 . A A . 16 CYS CA 1 1
4 763 1 1 16 CYS CB C -0.681 -11.996 -5.509 1.00 . A A . 16 CYS CB 1 1
4 764 1 1 16 CYS H H 1.497 -10.806 -4.896 1.00 . A A . 16 CYS H 1 1
4 765 1 1 16 CYS HA H -0.374 -10.544 -7.051 1.00 . A A . 16 CYS HA 1 1
4 766 1 1 16 CYS HB2 H -0.887 -11.974 -4.449 1.00 . A A . 16 CYS HB2 1 1
4 767 1 1 16 CYS HB3 H -1.566 -12.320 -6.036 1.00 . A A . 16 CYS HB3 1 1
4 768 1 1 16 CYS N N 1.060 -10.271 -5.593 1.00 . A A . 16 CYS N 1 1
4 769 1 1 16 CYS O O -1.011 -8.957 -4.354 1.00 . A A . 16 CYS O 1 1
4 770 1 1 16 CYS SG S 0.620 -13.238 -5.793 1.00 . A A . 16 CYS SG 1 1
4 771 1 1 17 ALA C C -4.676 -9.201 -5.069 1.00 . A A . 17 ALA C 1 1
4 772 1 1 17 ALA CA C -3.444 -8.465 -5.585 1.00 . A A . 17 ALA CA 1 1
4 773 1 1 17 ALA CB C -3.828 -7.511 -6.706 1.00 . A A . 17 ALA CB 1 1
4 774 1 1 17 ALA H H -2.589 -9.922 -6.860 1.00 . A A . 17 ALA H 1 1
4 775 1 1 17 ALA HA H -3.021 -7.882 -4.779 1.00 . A A . 17 ALA HA 1 1
4 776 1 1 17 ALA HB1 H -2.953 -6.966 -7.030 1.00 . A A . 17 ALA HB1 1 1
4 777 1 1 17 ALA HB2 H -4.229 -8.074 -7.536 1.00 . A A . 17 ALA HB2 1 1
4 778 1 1 17 ALA HB3 H -4.573 -6.816 -6.348 1.00 . A A . 17 ALA HB3 1 1
4 779 1 1 17 ALA N N -2.427 -9.402 -6.045 1.00 . A A . 17 ALA N 1 1
4 780 1 1 17 ALA O O -5.647 -9.360 -5.808 1.00 . A A . 17 ALA O 1 1
4 781 1 1 18 ALA C C -6.749 -9.263 -2.656 1.00 . A A . 18 ALA C 1 1
4 782 1 1 18 ALA CA C -5.704 -10.347 -3.177 1.00 . A A . 18 ALA CA 1 1
4 783 1 1 18 ALA CB C -5.266 -11.177 -2.028 1.00 . A A . 18 ALA CB 1 1
4 784 1 1 18 ALA H H -3.801 -9.458 -3.311 1.00 . A A . 18 ALA H 1 1
4 785 1 1 18 ALA HA H -6.245 -10.912 -3.913 1.00 . A A . 18 ALA HA 1 1
4 786 1 1 18 ALA HB1 H -5.238 -10.579 -1.129 1.00 . A A . 18 ALA HB1 1 1
4 787 1 1 18 ALA HB2 H -5.999 -11.962 -1.909 1.00 . A A . 18 ALA HB2 1 1
4 788 1 1 18 ALA N N -4.618 -9.633 -3.824 1.00 . A A . 18 ALA N 1 1
4 789 1 1 18 ALA O O -7.960 -9.483 -2.695 1.00 . A A . 18 ALA O 1 1
4 790 1 1 19 SER C C -7.670 -6.236 -2.762 1.00 . A A . 19 SER C 1 1
4 791 1 1 19 SER CA C -7.080 -7.078 -1.635 1.00 . A A . 19 SER CA 1 1
4 792 1 1 19 SER CB C -6.279 -6.188 -0.683 1.00 . A A . 19 SER CB 1 1
4 793 1 1 19 SER H H -5.260 -8.022 -2.164 1.00 . A A . 19 SER H 1 1
4 794 1 1 19 SER HA H -7.887 -7.542 -1.087 1.00 . A A . 19 SER HA 1 1
4 795 1 1 19 SER HB2 H -6.276 -6.630 0.302 1.00 . A A . 19 SER HB2 1 1
4 796 1 1 19 SER HB3 H -5.264 -6.102 -1.042 1.00 . A A . 19 SER HB3 1 1
4 797 1 1 19 SER HG H -7.529 -4.883 0.074 1.00 . A A . 19 SER HG 1 1
4 798 1 1 19 SER N N -6.234 -8.139 -2.168 1.00 . A A . 19 SER N 1 1
4 799 1 1 19 SER O O -7.049 -6.060 -3.809 1.00 . A A . 19 SER O 1 1
4 800 1 1 19 SER OG O -6.845 -4.891 -0.600 1.00 . A A . 19 SER OG 1 1
5 801 1 1 1 ALA C C 3.556 -0.044 -1.441 1.00 . A A . 1 ALA C 1 1
5 802 1 1 1 ALA CA C 2.493 0.543 -2.363 1.00 . A A . 1 ALA CA 1 1
5 803 1 1 1 ALA CB C 1.170 -0.185 -2.177 1.00 . A A . 1 ALA CB 1 1
5 804 1 1 1 ALA H1 H 2.233 0.466 -4.462 1.00 . A A . 1 ALA H1 1 1
5 805 1 1 1 ALA HA H 2.343 1.582 -2.107 1.00 . A A . 1 ALA HA 1 1
5 806 1 1 1 ALA HB1 H 1.093 -0.981 -2.904 1.00 . A A . 1 ALA HB1 1 1
5 807 1 1 1 ALA HB2 H 1.125 -0.600 -1.182 1.00 . A A . 1 ALA HB2 1 1
5 808 1 1 1 ALA HB3 H 0.355 0.509 -2.316 1.00 . A A . 1 ALA HB3 1 1
5 809 1 1 1 ALA N N 2.914 0.479 -3.757 1.00 . A A . 1 ALA N 1 1
5 810 1 1 1 ALA O O 4.162 0.669 -0.641 1.00 . A A . 1 ALA O 1 1
5 811 1 1 2 CYS C C 6.180 -1.577 -1.089 1.00 . A A . 2 CYS C 1 1
5 812 1 1 2 CYS CA C 4.768 -2.033 -0.734 1.00 . A A . 2 CYS CA 1 1
5 813 1 1 2 CYS CB C 4.651 -3.548 -0.912 1.00 . A A . 2 CYS CB 1 1
5 814 1 1 2 CYS H H 3.264 -1.865 -2.214 1.00 . A A . 2 CYS H 1 1
5 815 1 1 2 CYS HA H 4.571 -1.785 0.297 1.00 . A A . 2 CYS HA 1 1
5 816 1 1 2 CYS HB2 H 5.222 -4.039 -0.138 1.00 . A A . 2 CYS HB2 1 1
5 817 1 1 2 CYS HB3 H 3.613 -3.834 -0.822 1.00 . A A . 2 CYS HB3 1 1
5 818 1 1 2 CYS N N 3.779 -1.349 -1.558 1.00 . A A . 2 CYS N 1 1
5 819 1 1 2 CYS O O 7.095 -1.659 -0.270 1.00 . A A . 2 CYS O 1 1
5 820 1 1 2 CYS SG S 5.258 -4.158 -2.518 1.00 . A A . 2 CYS SG 1 1
5 821 1 1 3 GLY C C 8.170 -1.408 -3.952 1.00 . A A . 3 GLY C 1 1
5 822 1 1 3 GLY CA C 7.653 -0.631 -2.758 1.00 . A A . 3 GLY CA 1 1
5 823 1 1 3 GLY H H 5.584 -1.052 -2.927 1.00 . A A . 3 GLY H 1 1
5 824 1 1 3 GLY HA2 H 7.580 0.413 -3.025 1.00 . A A . 3 GLY HA2 1 1
5 825 1 1 3 GLY HA3 H 8.354 -0.736 -1.943 1.00 . A A . 3 GLY HA3 1 1
5 826 1 1 3 GLY N N 6.350 -1.094 -2.316 1.00 . A A . 3 GLY N 1 1
5 827 1 1 3 GLY O O 8.615 -0.832 -4.945 1.00 . A A . 3 GLY O 1 1
5 828 1 1 4 . C C 10.127 -3.747 -4.952 1.00 . A A . 4 DBB C 1 1
5 829 1 1 4 . CA C 8.603 -3.535 -4.967 1.00 . A A . 4 DBB CA 1 1
5 830 1 1 4 . CB C 7.841 -4.875 -4.955 1.00 . A A . 4 DBB CB 1 1
5 831 1 1 4 . CG C 8.162 -5.656 -6.218 1.00 . A A . 4 DBB CG 1 1
5 832 1 1 4 . H H 7.755 -3.150 -3.053 1.00 . A A . 4 DBB H 1 1
5 833 1 1 4 . HA H 8.345 -3.030 -5.876 1.00 . A A . 4 DBB HA 1 1
5 834 1 1 4 . HB2 H 6.805 -4.615 -5.000 1.00 . A A . 4 DBB HB2 1 1
5 835 1 1 4 . HG1 H 9.205 -5.933 -6.202 1.00 . A A . 4 DBB HG1 1 1
5 836 1 1 4 . HG2 H 7.965 -5.040 -7.083 1.00 . A A . 4 DBB HG2 1 1
5 837 1 1 4 . HG3 H 7.553 -6.545 -6.257 1.00 . A A . 4 DBB HG3 1 1
5 838 1 1 4 . N N 8.117 -2.723 -3.862 1.00 . A A . 4 DBB N 1 1
5 839 1 1 4 . O O 10.666 -4.051 -3.888 1.00 . A A . 4 DBB O 1 1
5 840 1 1 5 GLY C C 12.561 -5.221 -6.786 1.00 . A A . 5 GLY C 1 1
5 841 1 1 5 GLY CA C 12.224 -3.888 -6.148 1.00 . A A . 5 GLY CA 1 1
5 842 1 1 5 GLY H H 10.312 -3.398 -6.914 1.00 . A A . 5 GLY H 1 1
5 843 1 1 5 GLY HA2 H 12.693 -3.099 -6.716 1.00 . A A . 5 GLY HA2 1 1
5 844 1 1 5 GLY HA3 H 12.615 -3.875 -5.141 1.00 . A A . 5 GLY HA3 1 1
5 845 1 1 5 GLY N N 10.794 -3.643 -6.097 1.00 . A A . 5 GLY N 1 1
5 846 1 1 5 GLY O O 12.306 -5.496 -7.955 1.00 . A A . 5 GLY O 1 1
5 847 1 1 6 . C C 12.236 -8.382 -6.416 1.00 . A A . 6 IAS C 1 1
5 848 1 1 6 . CA C 13.442 -7.463 -6.488 1.00 . A A . 6 IAS CA 1 1
5 849 1 1 6 . CB C 14.665 -8.119 -5.819 1.00 . A A . 6 IAS CB 1 1
5 850 1 1 6 . CG C 14.591 -8.125 -4.298 1.00 . A A . 6 IAS CG 1 1
5 851 1 1 6 . H H 13.383 -5.909 -5.049 1.00 . A A . 6 IAS H 1 1
5 852 1 1 6 . HA H 13.637 -7.382 -7.551 1.00 . A A . 6 IAS HA 1 1
5 853 1 1 6 . HB2 H 15.538 -7.537 -6.074 1.00 . A A . 6 IAS HB2 1 1
5 854 1 1 6 . HB3 H 14.777 -9.121 -6.202 1.00 . A A . 6 IAS HB3 1 1
5 855 1 1 6 . HXT H 13.260 -9.705 -7.381 1.00 . A A . 6 IAS HXT 1 1
5 856 1 1 6 . N N 13.172 -6.122 -5.999 1.00 . A A . 6 IAS N 1 1
5 857 1 1 6 . O O 11.146 -8.048 -6.027 1.00 . A A . 6 IAS O 1 1
5 858 1 1 6 . OD1 O 15.357 -7.448 -3.612 1.00 . A A . 6 IAS OD1 1 1
5 859 1 1 6 . OXT O 12.560 -9.650 -6.713 1.00 . A A . 6 IAS OXT 1 1
5 860 1 1 7 GLY C C 12.057 -8.768 -1.901 1.00 . A A . 7 GLY C 1 1
5 861 1 1 7 GLY CA C 13.489 -9.010 -2.336 1.00 . A A . 7 GLY CA 1 1
5 862 1 1 7 GLY H H 13.073 -9.428 -4.370 1.00 . A A . 7 GLY H 1 1
5 863 1 1 7 GLY HA2 H 13.789 -9.997 -2.017 1.00 . A A . 7 GLY HA2 1 1
5 864 1 1 7 GLY HA3 H 14.126 -8.279 -1.861 1.00 . A A . 7 GLY HA3 1 1
5 865 1 1 7 GLY N N 13.655 -8.911 -3.775 1.00 . A A . 7 GLY N 1 1
5 866 1 1 7 GLY O O 11.626 -9.263 -0.859 1.00 . A A . 7 GLY O 1 1
5 867 1 1 8 CYS C C 9.137 -8.968 -2.108 1.00 . A A . 8 CYS C 1 1
5 868 1 1 8 CYS CA C 9.928 -7.694 -2.389 1.00 . A A . 8 CYS CA 1 1
5 869 1 1 8 CYS CB C 9.285 -6.926 -3.545 1.00 . A A . 8 CYS CB 1 1
5 870 1 1 8 CYS H H 11.719 -7.638 -3.515 1.00 . A A . 8 CYS H 1 1
5 871 1 1 8 CYS HA H 9.915 -7.074 -1.505 1.00 . A A . 8 CYS HA 1 1
5 872 1 1 8 CYS HB2 H 10.013 -6.247 -3.965 1.00 . A A . 8 CYS HB2 1 1
5 873 1 1 8 CYS HB3 H 8.976 -7.628 -4.305 1.00 . A A . 8 CYS HB3 1 1
5 874 1 1 8 CYS N N 11.319 -8.003 -2.698 1.00 . A A . 8 CYS N 1 1
5 875 1 1 8 CYS O O 9.532 -10.059 -2.518 1.00 . A A . 8 CYS O 1 1
5 876 1 1 8 CYS SG S 7.827 -5.946 -3.067 1.00 . A A . 8 CYS SG 1 1
5 877 1 1 9 ALA C C 6.187 -10.259 -2.197 1.00 . A A . 9 ALA C 1 1
5 878 1 1 9 ALA CA C 7.170 -9.958 -1.072 1.00 . A A . 9 ALA CA 1 1
5 879 1 1 9 ALA CB C 6.424 -9.696 0.228 1.00 . A A . 9 ALA CB 1 1
5 880 1 1 9 ALA H H 7.756 -7.925 -1.107 1.00 . A A . 9 ALA H 1 1
5 881 1 1 9 ALA HA H 7.808 -10.818 -0.925 1.00 . A A . 9 ALA HA 1 1
5 882 1 1 9 ALA HB1 H 5.756 -8.857 0.096 1.00 . A A . 9 ALA HB1 1 1
5 883 1 1 9 ALA HB2 H 5.853 -10.572 0.498 1.00 . A A . 9 ALA HB2 1 1
5 884 1 1 9 ALA HB3 H 7.133 -9.473 1.011 1.00 . A A . 9 ALA HB3 1 1
5 885 1 1 9 ALA N N 8.018 -8.821 -1.406 1.00 . A A . 9 ALA N 1 1
5 886 1 1 9 ALA O O 5.857 -9.384 -2.999 1.00 . A A . 9 ALA O 1 1
5 887 1 1 10 LYS C C 3.385 -12.131 -2.687 1.00 . A A . 10 LYS C 1 1
5 888 1 1 10 LYS CA C 4.774 -11.919 -3.281 1.00 . A A . 10 LYS CA 1 1
5 889 1 1 10 LYS CB C 5.255 -13.207 -3.953 1.00 . A A . 10 LYS CB 1 1
5 890 1 1 10 LYS CD C 6.952 -14.233 -5.495 1.00 . A A . 10 LYS CD 1 1
5 891 1 1 10 LYS CE C 7.493 -15.470 -4.793 1.00 . A A . 10 LYS CE 1 1
5 892 1 1 10 LYS CG C 6.666 -13.114 -4.508 1.00 . A A . 10 LYS CG 1 1
5 893 1 1 10 LYS H H 6.021 -12.155 -1.586 1.00 . A A . 10 LYS H 1 1
5 894 1 1 10 LYS HA H 4.720 -11.135 -4.021 1.00 . A A . 10 LYS HA 1 1
5 895 1 1 10 LYS HB2 H 5.227 -14.009 -3.230 1.00 . A A . 10 LYS HB2 1 1
5 896 1 1 10 LYS HB3 H 4.585 -13.445 -4.768 1.00 . A A . 10 LYS HB3 1 1
5 897 1 1 10 LYS HD2 H 6.038 -14.494 -6.006 1.00 . A A . 10 LYS HD2 1 1
5 898 1 1 10 LYS HD3 H 7.683 -13.890 -6.213 1.00 . A A . 10 LYS HD3 1 1
5 899 1 1 10 LYS HE2 H 8.564 -15.375 -4.698 1.00 . A A . 10 LYS HE2 1 1
5 900 1 1 10 LYS HE3 H 7.049 -15.532 -3.810 1.00 . A A . 10 LYS HE3 1 1
5 901 1 1 10 LYS HG2 H 6.783 -12.166 -5.012 1.00 . A A . 10 LYS HG2 1 1
5 902 1 1 10 LYS HG3 H 7.369 -13.178 -3.690 1.00 . A A . 10 LYS HG3 1 1
5 903 1 1 10 LYS HZ1 H 6.337 -17.173 -5.145 1.00 . A A . 10 LYS HZ1 1 1
5 904 1 1 10 LYS HZ2 H 7.980 -17.378 -5.488 1.00 . A A . 10 LYS HZ2 1 1
5 905 1 1 10 LYS HZ3 H 7.000 -16.494 -6.546 1.00 . A A . 10 LYS HZ3 1 1
5 906 1 1 10 LYS N N 5.721 -11.502 -2.253 1.00 . A A . 10 LYS N 1 1
5 907 1 1 10 LYS NZ N 7.181 -16.716 -5.546 1.00 . A A . 10 LYS NZ 1 1
5 908 1 1 10 LYS O O 3.122 -11.790 -1.533 1.00 . A A . 10 LYS O 1 1
5 909 1 1 11 . C C 0.446 -11.654 -2.479 1.00 . A A . 11 DBB C 1 1
5 910 1 1 11 . CA C 1.146 -12.929 -2.983 1.00 . A A . 11 DBB CA 1 1
5 911 1 1 11 . CB C 0.334 -13.621 -4.096 1.00 . A A . 11 DBB CB 1 1
5 912 1 1 11 . CG C -1.007 -14.076 -3.543 1.00 . A A . 11 DBB CG 1 1
5 913 1 1 11 . H H 2.739 -12.957 -4.394 1.00 . A A . 11 DBB H 1 1
5 914 1 1 11 . HA H 1.216 -13.618 -2.165 1.00 . A A . 11 DBB HA 1 1
5 915 1 1 11 . HB2 H 0.886 -14.501 -4.347 1.00 . A A . 11 DBB HB2 1 1
5 916 1 1 11 . HG1 H -0.836 -14.654 -2.648 1.00 . A A . 11 DBB HG1 1 1
5 917 1 1 11 . HG2 H -1.513 -14.685 -4.277 1.00 . A A . 11 DBB HG2 1 1
5 918 1 1 11 . HG3 H -1.610 -13.214 -3.307 1.00 . A A . 11 DBB HG3 1 1
5 919 1 1 11 . N N 2.494 -12.698 -3.477 1.00 . A A . 11 DBB N 1 1
5 920 1 1 11 . O O 0.749 -10.576 -2.992 1.00 . A A . 11 DBB O 1 1
5 921 1 1 12 CYS C C -0.394 -9.799 -0.082 1.00 . A A . 12 CYS C 1 1
5 922 1 1 12 CYS CA C -1.236 -10.616 -1.058 1.00 . A A . 12 CYS CA 1 1
5 923 1 1 12 CYS CB C -2.531 -11.067 -0.379 1.00 . A A . 12 CYS CB 1 1
5 924 1 1 12 CYS H H -0.688 -12.658 -1.173 1.00 . A A . 12 CYS H 1 1
5 925 1 1 12 CYS HA H -1.481 -9.998 -1.907 1.00 . A A . 12 CYS HA 1 1
5 926 1 1 12 CYS HB2 H -2.299 -11.443 0.607 1.00 . A A . 12 CYS HB2 1 1
5 927 1 1 12 CYS HB3 H -3.194 -10.220 -0.289 1.00 . A A . 12 CYS HB3 1 1
5 928 1 1 12 CYS N N -0.491 -11.772 -1.545 1.00 . A A . 12 CYS N 1 1
5 929 1 1 12 CYS O O -0.780 -9.599 1.070 1.00 . A A . 12 CYS O 1 1
5 930 1 1 12 CYS SG S -3.423 -12.378 -1.275 1.00 . A A . 12 CYS SG 1 1
5 931 1 1 13 ALA C C 2.095 -7.268 -0.449 1.00 . A A . 13 ALA C 1 1
5 932 1 1 13 ALA CA C 1.652 -8.533 0.279 1.00 . A A . 13 ALA CA 1 1
5 933 1 1 13 ALA CB C 2.862 -9.357 0.693 1.00 . A A . 13 ALA CB 1 1
5 934 1 1 13 ALA H H 1.010 -9.523 -1.478 1.00 . A A . 13 ALA H 1 1
5 935 1 1 13 ALA HA H 1.116 -8.252 1.174 1.00 . A A . 13 ALA HA 1 1
5 936 1 1 13 ALA HB1 H 2.549 -10.142 1.367 1.00 . A A . 13 ALA HB1 1 1
5 937 1 1 13 ALA HB2 H 3.316 -9.795 -0.184 1.00 . A A . 13 ALA HB2 1 1
5 938 1 1 13 ALA HB3 H 3.578 -8.720 1.190 1.00 . A A . 13 ALA HB3 1 1
5 939 1 1 13 ALA N N 0.757 -9.330 -0.551 1.00 . A A . 13 ALA N 1 1
5 940 1 1 13 ALA O O 2.258 -6.225 0.183 1.00 . A A . 13 ALA O 1 1
5 941 1 1 14 ALA C C 2.437 -6.696 -4.107 1.00 . A A . 14 ALA C 1 1
5 942 1 1 14 ALA CA C 2.699 -6.273 -2.593 1.00 . A A . 14 ALA CA 1 1
5 943 1 1 14 ALA CB C 4.131 -5.919 -2.438 1.00 . A A . 14 ALA CB 1 1
5 944 1 1 14 ALA H H 2.127 -8.254 -2.167 1.00 . A A . 14 ALA H 1 1
5 945 1 1 14 ALA HA H 2.046 -5.437 -2.429 1.00 . A A . 14 ALA HA 1 1
5 946 1 1 14 ALA HB1 H 4.492 -6.248 -1.474 1.00 . A A . 14 ALA HB1 1 1
5 947 1 1 14 ALA HB2 H 4.670 -6.441 -3.215 1.00 . A A . 14 ALA HB2 1 1
5 948 1 1 14 ALA N N 2.282 -7.380 -1.751 1.00 . A A . 14 ALA N 1 1
5 949 1 1 14 ALA O O 1.896 -5.920 -4.894 1.00 . A A . 14 ALA O 1 1
5 950 1 1 15 SER C C 1.225 -8.629 -6.151 1.00 . A A . 15 SER C 1 1
5 951 1 1 15 SER CA C 2.698 -8.407 -5.818 1.00 . A A . 15 SER CA 1 1
5 952 1 1 15 SER CB C 3.476 -9.712 -5.999 1.00 . A A . 15 SER CB 1 1
5 953 1 1 15 SER H H 3.278 -8.481 -3.784 1.00 . A A . 15 SER H 1 1
5 954 1 1 15 SER HA H 3.098 -7.663 -6.491 1.00 . A A . 15 SER HA 1 1
5 955 1 1 15 SER HB2 H 4.528 -9.525 -5.844 1.00 . A A . 15 SER HB2 1 1
5 956 1 1 15 SER HB3 H 3.129 -10.437 -5.277 1.00 . A A . 15 SER HB3 1 1
5 957 1 1 15 SER HG H 2.968 -11.141 -7.239 1.00 . A A . 15 SER HG 1 1
5 958 1 1 15 SER N N 2.854 -7.909 -4.457 1.00 . A A . 15 SER N 1 1
5 959 1 1 15 SER O O 0.626 -7.868 -6.910 1.00 . A A . 15 SER O 1 1
5 960 1 1 15 SER OG O 3.292 -10.239 -7.301 1.00 . A A . 15 SER OG 1 1
5 961 1 1 16 CYS C C -1.667 -9.098 -4.988 1.00 . A A . 16 CYS C 1 1
5 962 1 1 16 CYS CA C -0.754 -10.004 -5.809 1.00 . A A . 16 CYS CA 1 1
5 963 1 1 16 CYS CB C -1.024 -11.470 -5.461 1.00 . A A . 16 CYS CB 1 1
5 964 1 1 16 CYS H H 1.178 -10.250 -4.979 1.00 . A A . 16 CYS H 1 1
5 965 1 1 16 CYS HA H -0.961 -9.848 -6.857 1.00 . A A . 16 CYS HA 1 1
5 966 1 1 16 CYS HB2 H -1.112 -11.566 -4.389 1.00 . A A . 16 CYS HB2 1 1
5 967 1 1 16 CYS HB3 H -1.951 -11.776 -5.922 1.00 . A A . 16 CYS HB3 1 1
5 968 1 1 16 CYS N N 0.648 -9.679 -5.576 1.00 . A A . 16 CYS N 1 1
5 969 1 1 16 CYS O O -1.260 -8.558 -3.960 1.00 . A A . 16 CYS O 1 1
5 970 1 1 16 CYS SG S 0.278 -12.617 -6.015 1.00 . A A . 16 CYS SG 1 1
5 971 1 1 17 ALA C C -5.022 -8.935 -4.201 1.00 . A A . 17 ALA C 1 1
5 972 1 1 17 ALA CA C -3.874 -8.100 -4.757 1.00 . A A . 17 ALA CA 1 1
5 973 1 1 17 ALA CB C -4.406 -7.025 -5.693 1.00 . A A . 17 ALA CB 1 1
5 974 1 1 17 ALA H H -3.168 -9.395 -6.275 1.00 . A A . 17 ALA H 1 1
5 975 1 1 17 ALA HA H -3.368 -7.610 -3.937 1.00 . A A . 17 ALA HA 1 1
5 976 1 1 17 ALA HB1 H -3.914 -6.087 -5.481 1.00 . A A . 17 ALA HB1 1 1
5 977 1 1 17 ALA HB2 H -4.211 -7.311 -6.716 1.00 . A A . 17 ALA HB2 1 1
5 978 1 1 17 ALA HB3 H -5.470 -6.915 -5.546 1.00 . A A . 17 ALA HB3 1 1
5 979 1 1 17 ALA N N -2.903 -8.938 -5.449 1.00 . A A . 17 ALA N 1 1
5 980 1 1 17 ALA O O -6.066 -9.043 -4.842 1.00 . A A . 17 ALA O 1 1
5 981 1 1 18 ALA C C -6.772 -9.357 -1.554 1.00 . A A . 18 ALA C 1 1
5 982 1 1 18 ALA CA C -5.801 -10.331 -2.358 1.00 . A A . 18 ALA CA 1 1
5 983 1 1 18 ALA CB C -5.212 -11.307 -1.409 1.00 . A A . 18 ALA CB 1 1
5 984 1 1 18 ALA H H -3.947 -9.364 -2.593 1.00 . A A . 18 ALA H 1 1
5 985 1 1 18 ALA HA H -6.432 -10.797 -3.091 1.00 . A A . 18 ALA HA 1 1
5 986 1 1 18 ALA HB1 H -5.174 -10.881 -0.417 1.00 . A A . 18 ALA HB1 1 1
5 987 1 1 18 ALA HB2 H -5.863 -12.169 -1.399 1.00 . A A . 18 ALA HB2 1 1
5 988 1 1 18 ALA N N -4.812 -9.507 -3.030 1.00 . A A . 18 ALA N 1 1
5 989 1 1 18 ALA O O -6.376 -8.754 -0.556 1.00 . A A . 18 ALA O 1 1
5 990 1 1 19 SER C C -9.668 -9.044 -0.237 1.00 . A A . 19 SER C 1 1
5 991 1 1 19 SER CA C -8.982 -8.347 -1.408 1.00 . A A . 19 SER CA 1 1
5 992 1 1 19 SER CB C -10.027 -7.898 -2.431 1.00 . A A . 19 SER CB 1 1
5 993 1 1 19 SER H H -8.260 -9.735 -2.834 1.00 . A A . 19 SER H 1 1
5 994 1 1 19 SER HA H -8.457 -7.479 -1.038 1.00 . A A . 19 SER HA 1 1
5 995 1 1 19 SER HB2 H -10.590 -7.070 -2.028 1.00 . A A . 19 SER HB2 1 1
5 996 1 1 19 SER HB3 H -9.528 -7.586 -3.338 1.00 . A A . 19 SER HB3 1 1
5 997 1 1 19 SER HG H -11.467 -8.699 -3.491 1.00 . A A . 19 SER HG 1 1
5 998 1 1 19 SER N N -8.004 -9.227 -2.036 1.00 . A A . 19 SER N 1 1
5 999 1 1 19 SER O O -9.388 -8.749 0.924 1.00 . A A . 19 SER O 1 1
5 1000 1 1 19 SER OG O -10.923 -8.951 -2.741 1.00 . A A . 19 SER OG 1 1
6 1001 1 1 1 ALA C C 3.989 0.207 -1.438 1.00 . A A . 1 ALA C 1 1
6 1002 1 1 1 ALA CA C 2.979 1.101 -0.726 1.00 . A A . 1 ALA CA 1 1
6 1003 1 1 1 ALA CB C 1.608 0.970 -1.373 1.00 . A A . 1 ALA CB 1 1
6 1004 1 1 1 ALA H1 H 3.776 2.874 -1.562 1.00 . A A . 1 ALA H1 1 1
6 1005 1 1 1 ALA HA H 2.896 0.785 0.304 1.00 . A A . 1 ALA HA 1 1
6 1006 1 1 1 ALA HB1 H 0.844 1.203 -0.645 1.00 . A A . 1 ALA HB1 1 1
6 1007 1 1 1 ALA HB2 H 1.535 1.656 -2.203 1.00 . A A . 1 ALA HB2 1 1
6 1008 1 1 1 ALA HB3 H 1.472 -0.041 -1.726 1.00 . A A . 1 ALA HB3 1 1
6 1009 1 1 1 ALA N N 3.412 2.493 -0.736 1.00 . A A . 1 ALA N 1 1
6 1010 1 1 1 ALA O O 5.002 0.683 -1.952 1.00 . A A . 1 ALA O 1 1
6 1011 1 1 2 CYS C C 4.663 -1.801 -3.614 1.00 . A A . 2 CYS C 1 1
6 1012 1 1 2 CYS CA C 4.592 -2.053 -2.110 1.00 . A A . 2 CYS CA 1 1
6 1013 1 1 2 CYS CB C 4.109 -3.480 -1.844 1.00 . A A . 2 CYS CB 1 1
6 1014 1 1 2 CYS H H 2.885 -1.411 -1.036 1.00 . A A . 2 CYS H 1 1
6 1015 1 1 2 CYS HA H 5.578 -1.932 -1.690 1.00 . A A . 2 CYS HA 1 1
6 1016 1 1 2 CYS HB2 H 3.502 -3.486 -0.950 1.00 . A A . 2 CYS HB2 1 1
6 1017 1 1 2 CYS HB3 H 3.512 -3.813 -2.680 1.00 . A A . 2 CYS HB3 1 1
6 1018 1 1 2 CYS N N 3.708 -1.091 -1.463 1.00 . A A . 2 CYS N 1 1
6 1019 1 1 2 CYS O O 3.806 -1.125 -4.182 1.00 . A A . 2 CYS O 1 1
6 1020 1 1 2 CYS SG S 5.453 -4.687 -1.606 1.00 . A A . 2 CYS SG 1 1
6 1021 1 1 3 GLY C C 7.068 -2.907 -6.223 1.00 . A A . 3 GLY C 1 1
6 1022 1 1 3 GLY CA C 5.856 -2.174 -5.683 1.00 . A A . 3 GLY CA 1 1
6 1023 1 1 3 GLY H H 6.344 -2.879 -3.748 1.00 . A A . 3 GLY H 1 1
6 1024 1 1 3 GLY HA2 H 4.973 -2.542 -6.184 1.00 . A A . 3 GLY HA2 1 1
6 1025 1 1 3 GLY HA3 H 5.964 -1.120 -5.894 1.00 . A A . 3 GLY HA3 1 1
6 1026 1 1 3 GLY N N 5.691 -2.350 -4.252 1.00 . A A . 3 GLY N 1 1
6 1027 1 1 3 GLY O O 7.971 -2.306 -6.805 1.00 . A A . 3 GLY O 1 1
6 1028 1 1 4 . C C 9.590 -4.456 -6.014 1.00 . A A . 4 DBB C 1 1
6 1029 1 1 4 . CA C 8.232 -4.980 -6.514 1.00 . A A . 4 DBB CA 1 1
6 1030 1 1 4 . CB C 8.016 -6.458 -6.130 1.00 . A A . 4 DBB CB 1 1
6 1031 1 1 4 . CG C 9.068 -7.320 -6.808 1.00 . A A . 4 DBB CG 1 1
6 1032 1 1 4 . H H 6.357 -4.659 -5.561 1.00 . A A . 4 DBB H 1 1
6 1033 1 1 4 . HA H 8.226 -4.925 -7.585 1.00 . A A . 4 DBB HA 1 1
6 1034 1 1 4 . HB2 H 7.070 -6.726 -6.550 1.00 . A A . 4 DBB HB2 1 1
6 1035 1 1 4 . HG1 H 10.025 -7.129 -6.348 1.00 . A A . 4 DBB HG1 1 1
6 1036 1 1 4 . HG2 H 9.115 -7.074 -7.858 1.00 . A A . 4 DBB HG2 1 1
6 1037 1 1 4 . HG3 H 8.812 -8.361 -6.689 1.00 . A A . 4 DBB HG3 1 1
6 1038 1 1 4 . N N 7.096 -4.211 -6.031 1.00 . A A . 4 DBB N 1 1
6 1039 1 1 4 . O O 10.441 -4.145 -6.846 1.00 . A A . 4 DBB O 1 1
6 1040 1 1 5 GLY C C 12.233 -4.477 -4.740 1.00 . A A . 5 GLY C 1 1
6 1041 1 1 5 GLY CA C 11.013 -3.771 -4.184 1.00 . A A . 5 GLY CA 1 1
6 1042 1 1 5 GLY H H 9.058 -4.578 -4.088 1.00 . A A . 5 GLY H 1 1
6 1043 1 1 5 GLY HA2 H 11.070 -2.722 -4.436 1.00 . A A . 5 GLY HA2 1 1
6 1044 1 1 5 GLY HA3 H 11.013 -3.872 -3.108 1.00 . A A . 5 GLY HA3 1 1
6 1045 1 1 5 GLY N N 9.772 -4.313 -4.705 1.00 . A A . 5 GLY N 1 1
6 1046 1 1 5 GLY O O 12.800 -4.135 -5.775 1.00 . A A . 5 GLY O 1 1
6 1047 1 1 6 . C C 13.342 -7.482 -5.422 1.00 . A A . 6 IAS C 1 1
6 1048 1 1 6 . CA C 13.790 -6.329 -4.541 1.00 . A A . 6 IAS CA 1 1
6 1049 1 1 6 . CB C 14.735 -6.828 -3.433 1.00 . A A . 6 IAS CB 1 1
6 1050 1 1 6 . CG C 14.020 -7.580 -2.319 1.00 . A A . 6 IAS CG 1 1
6 1051 1 1 6 . H H 12.237 -5.811 -3.195 1.00 . A A . 6 IAS H 1 1
6 1052 1 1 6 . HA H 14.357 -5.703 -5.219 1.00 . A A . 6 IAS HA 1 1
6 1053 1 1 6 . HB2 H 15.191 -5.966 -2.968 1.00 . A A . 6 IAS HB2 1 1
6 1054 1 1 6 . HB3 H 15.502 -7.442 -3.880 1.00 . A A . 6 IAS HB3 1 1
6 1055 1 1 6 . HXT H 12.653 -7.775 -7.201 1.00 . A A . 6 IAS HXT 1 1
6 1056 1 1 6 . N N 12.690 -5.525 -4.036 1.00 . A A . 6 IAS N 1 1
6 1057 1 1 6 . O O 13.362 -8.640 -5.093 1.00 . A A . 6 IAS O 1 1
6 1058 1 1 6 . OD1 O 14.049 -8.808 -2.246 1.00 . A A . 6 IAS OD1 1 1
6 1059 1 1 6 . OXT O 13.044 -7.070 -6.664 1.00 . A A . 6 IAS OXT 1 1
6 1060 1 1 7 GLY C C 11.143 -7.472 -0.596 1.00 . A A . 7 GLY C 1 1
6 1061 1 1 7 GLY CA C 12.636 -7.416 -0.343 1.00 . A A . 7 GLY CA 1 1
6 1062 1 1 7 GLY H H 13.376 -5.845 -1.554 1.00 . A A . 7 GLY H 1 1
6 1063 1 1 7 GLY HA2 H 13.002 -8.419 -0.184 1.00 . A A . 7 GLY HA2 1 1
6 1064 1 1 7 GLY HA3 H 12.816 -6.833 0.549 1.00 . A A . 7 GLY HA3 1 1
6 1065 1 1 7 GLY N N 13.364 -6.819 -1.447 1.00 . A A . 7 GLY N 1 1
6 1066 1 1 7 GLY O O 10.342 -7.258 0.314 1.00 . A A . 7 GLY O 1 1
6 1067 1 1 8 CYS C C 8.824 -9.257 -2.011 1.00 . A A . 8 CYS C 1 1
6 1068 1 1 8 CYS CA C 9.358 -7.842 -2.210 1.00 . A A . 8 CYS CA 1 1
6 1069 1 1 8 CYS CB C 9.169 -7.414 -3.667 1.00 . A A . 8 CYS CB 1 1
6 1070 1 1 8 CYS H H 11.451 -7.921 -2.521 1.00 . A A . 8 CYS H 1 1
6 1071 1 1 8 CYS HA H 8.806 -7.169 -1.572 1.00 . A A . 8 CYS HA 1 1
6 1072 1 1 8 CYS HB2 H 9.857 -6.612 -3.891 1.00 . A A . 8 CYS HB2 1 1
6 1073 1 1 8 CYS HB3 H 9.382 -8.254 -4.311 1.00 . A A . 8 CYS HB3 1 1
6 1074 1 1 8 CYS N N 10.765 -7.760 -1.838 1.00 . A A . 8 CYS N 1 1
6 1075 1 1 8 CYS O O 9.477 -10.235 -2.373 1.00 . A A . 8 CYS O 1 1
6 1076 1 1 8 CYS SG S 7.490 -6.826 -4.057 1.00 . A A . 8 CYS SG 1 1
6 1077 1 1 9 ALA C C 6.144 -11.078 -2.367 1.00 . A A . 9 ALA C 1 1
6 1078 1 1 9 ALA CA C 7.009 -10.652 -1.186 1.00 . A A . 9 ALA CA 1 1
6 1079 1 1 9 ALA CB C 6.179 -10.605 0.089 1.00 . A A . 9 ALA CB 1 1
6 1080 1 1 9 ALA H H 7.160 -8.542 -1.165 1.00 . A A . 9 ALA H 1 1
6 1081 1 1 9 ALA HA H 7.795 -11.380 -1.047 1.00 . A A . 9 ALA HA 1 1
6 1082 1 1 9 ALA HB1 H 5.635 -9.673 0.129 1.00 . A A . 9 ALA HB1 1 1
6 1083 1 1 9 ALA HB2 H 5.482 -11.430 0.095 1.00 . A A . 9 ALA HB2 1 1
6 1084 1 1 9 ALA HB3 H 6.832 -10.678 0.946 1.00 . A A . 9 ALA HB3 1 1
6 1085 1 1 9 ALA N N 7.632 -9.358 -1.431 1.00 . A A . 9 ALA N 1 1
6 1086 1 1 9 ALA O O 6.044 -10.365 -3.366 1.00 . A A . 9 ALA O 1 1
6 1087 1 1 10 LYS C C 3.211 -12.840 -2.841 1.00 . A A . 10 LYS C 1 1
6 1088 1 1 10 LYS CA C 4.662 -12.767 -3.304 1.00 . A A . 10 LYS CA 1 1
6 1089 1 1 10 LYS CB C 5.141 -14.154 -3.739 1.00 . A A . 10 LYS CB 1 1
6 1090 1 1 10 LYS CD C 5.767 -15.582 -5.709 1.00 . A A . 10 LYS CD 1 1
6 1091 1 1 10 LYS CE C 7.139 -15.071 -6.121 1.00 . A A . 10 LYS CE 1 1
6 1092 1 1 10 LYS CG C 4.881 -14.455 -5.205 1.00 . A A . 10 LYS CG 1 1
6 1093 1 1 10 LYS H H 5.639 -12.768 -1.426 1.00 . A A . 10 LYS H 1 1
6 1094 1 1 10 LYS HA H 4.726 -12.094 -4.145 1.00 . A A . 10 LYS HA 1 1
6 1095 1 1 10 LYS HB2 H 6.203 -14.228 -3.561 1.00 . A A . 10 LYS HB2 1 1
6 1096 1 1 10 LYS HB3 H 4.632 -14.900 -3.145 1.00 . A A . 10 LYS HB3 1 1
6 1097 1 1 10 LYS HD2 H 5.889 -16.312 -4.922 1.00 . A A . 10 LYS HD2 1 1
6 1098 1 1 10 LYS HD3 H 5.294 -16.046 -6.562 1.00 . A A . 10 LYS HD3 1 1
6 1099 1 1 10 LYS HE2 H 7.604 -14.600 -5.269 1.00 . A A . 10 LYS HE2 1 1
6 1100 1 1 10 LYS HE3 H 7.739 -15.909 -6.442 1.00 . A A . 10 LYS HE3 1 1
6 1101 1 1 10 LYS HG2 H 3.847 -14.743 -5.327 1.00 . A A . 10 LYS HG2 1 1
6 1102 1 1 10 LYS HG3 H 5.080 -13.566 -5.786 1.00 . A A . 10 LYS HG3 1 1
6 1103 1 1 10 LYS HZ1 H 7.951 -14.052 -7.753 1.00 . A A . 10 LYS HZ1 1 1
6 1104 1 1 10 LYS HZ2 H 6.850 -13.136 -6.854 1.00 . A A . 10 LYS HZ2 1 1
6 1105 1 1 10 LYS HZ3 H 6.292 -14.351 -7.890 1.00 . A A . 10 LYS HZ3 1 1
6 1106 1 1 10 LYS N N 5.520 -12.245 -2.247 1.00 . A A . 10 LYS N 1 1
6 1107 1 1 10 LYS NZ N 7.052 -14.084 -7.233 1.00 . A A . 10 LYS NZ 1 1
6 1108 1 1 10 LYS O O 2.903 -12.652 -1.664 1.00 . A A . 10 LYS O 1 1
6 1109 1 1 11 . C C 0.345 -11.889 -2.829 1.00 . A A . 11 DBB C 1 1
6 1110 1 1 11 . CA C 0.911 -13.199 -3.405 1.00 . A A . 11 DBB CA 1 1
6 1111 1 1 11 . CB C 0.116 -13.667 -4.641 1.00 . A A . 11 DBB CB 1 1
6 1112 1 1 11 . CG C -1.317 -13.976 -4.240 1.00 . A A . 11 DBB CG 1 1
6 1113 1 1 11 . H H 2.598 -13.261 -4.701 1.00 . A A . 11 DBB H 1 1
6 1114 1 1 11 . HA H 0.815 -13.962 -2.658 1.00 . A A . 11 DBB HA 1 1
6 1115 1 1 11 . HB2 H 0.567 -14.590 -4.937 1.00 . A A . 11 DBB HB2 1 1
6 1116 1 1 11 . HG1 H -1.815 -14.456 -5.069 1.00 . A A . 11 DBB HG1 1 1
6 1117 1 1 11 . HG2 H -1.828 -13.058 -3.992 1.00 . A A . 11 DBB HG2 1 1
6 1118 1 1 11 . HG3 H -1.317 -14.636 -3.387 1.00 . A A . 11 DBB HG3 1 1
6 1119 1 1 11 . N N 2.316 -13.116 -3.769 1.00 . A A . 11 DBB N 1 1
6 1120 1 1 11 . O O 0.744 -10.822 -3.296 1.00 . A A . 11 DBB O 1 1
6 1121 1 1 12 CYS C C -0.280 -10.080 -0.334 1.00 . A A . 12 CYS C 1 1
6 1122 1 1 12 CYS CA C -1.211 -10.765 -1.332 1.00 . A A . 12 CYS CA 1 1
6 1123 1 1 12 CYS CB C -2.533 -11.122 -0.650 1.00 . A A . 12 CYS CB 1 1
6 1124 1 1 12 CYS H H -0.866 -12.842 -1.553 1.00 . A A . 12 CYS H 1 1
6 1125 1 1 12 CYS HA H -1.407 -10.085 -2.147 1.00 . A A . 12 CYS HA 1 1
6 1126 1 1 12 CYS HB2 H -2.325 -11.563 0.314 1.00 . A A . 12 CYS HB2 1 1
6 1127 1 1 12 CYS HB3 H -3.112 -10.221 -0.511 1.00 . A A . 12 CYS HB3 1 1
6 1128 1 1 12 CYS N N -0.588 -11.961 -1.885 1.00 . A A . 12 CYS N 1 1
6 1129 1 1 12 CYS O O -0.627 -9.903 0.833 1.00 . A A . 12 CYS O 1 1
6 1130 1 1 12 CYS SG S -3.558 -12.300 -1.587 1.00 . A A . 12 CYS SG 1 1
6 1131 1 1 13 ALA C C 2.370 -7.734 -0.594 1.00 . A A . 13 ALA C 1 1
6 1132 1 1 13 ALA CA C 1.881 -9.029 0.045 1.00 . A A . 13 ALA CA 1 1
6 1133 1 1 13 ALA CB C 3.054 -9.956 0.327 1.00 . A A . 13 ALA CB 1 1
6 1134 1 1 13 ALA H H 1.121 -9.865 -1.744 1.00 . A A . 13 ALA H 1 1
6 1135 1 1 13 ALA HA H 1.404 -8.796 0.986 1.00 . A A . 13 ALA HA 1 1
6 1136 1 1 13 ALA HB1 H 3.559 -10.188 -0.600 1.00 . A A . 13 ALA HB1 1 1
6 1137 1 1 13 ALA HB2 H 3.743 -9.469 1.001 1.00 . A A . 13 ALA HB2 1 1
6 1138 1 1 13 ALA HB3 H 2.692 -10.868 0.778 1.00 . A A . 13 ALA HB3 1 1
6 1139 1 1 13 ALA N N 0.902 -9.696 -0.804 1.00 . A A . 13 ALA N 1 1
6 1140 1 1 13 ALA O O 2.619 -6.759 0.114 1.00 . A A . 13 ALA O 1 1
6 1141 1 1 14 ALA C C 2.716 -6.923 -4.214 1.00 . A A . 14 ALA C 1 1
6 1142 1 1 14 ALA CA C 2.946 -6.594 -2.672 1.00 . A A . 14 ALA CA 1 1
6 1143 1 1 14 ALA CB C 4.378 -6.267 -2.464 1.00 . A A . 14 ALA CB 1 1
6 1144 1 1 14 ALA H H 2.274 -8.568 -2.388 1.00 . A A . 14 ALA H 1 1
6 1145 1 1 14 ALA HA H 2.299 -5.761 -2.474 1.00 . A A . 14 ALA HA 1 1
6 1146 1 1 14 ALA HB1 H 4.860 -7.055 -1.903 1.00 . A A . 14 ALA HB1 1 1
6 1147 1 1 14 ALA HB2 H 4.831 -6.200 -3.442 1.00 . A A . 14 ALA HB2 1 1
6 1148 1 1 14 ALA N N 2.497 -7.744 -1.907 1.00 . A A . 14 ALA N 1 1
6 1149 1 1 14 ALA O O 2.163 -6.112 -4.957 1.00 . A A . 14 ALA O 1 1
6 1150 1 1 15 SER C C 1.581 -8.627 -6.434 1.00 . A A . 15 SER C 1 1
6 1151 1 1 15 SER CA C 3.048 -8.509 -6.031 1.00 . A A . 15 SER CA 1 1
6 1152 1 1 15 SER CB C 3.759 -9.845 -6.256 1.00 . A A . 15 SER CB 1 1
6 1153 1 1 15 SER H H 3.604 -8.701 -3.997 1.00 . A A . 15 SER H 1 1
6 1154 1 1 15 SER HA H 3.518 -7.753 -6.643 1.00 . A A . 15 SER HA 1 1
6 1155 1 1 15 SER HB2 H 3.603 -10.166 -7.274 1.00 . A A . 15 SER HB2 1 1
6 1156 1 1 15 SER HB3 H 4.817 -9.721 -6.076 1.00 . A A . 15 SER HB3 1 1
6 1157 1 1 15 SER HG H 3.429 -10.583 -4.471 1.00 . A A . 15 SER HG 1 1
6 1158 1 1 15 SER N N 3.172 -8.098 -4.637 1.00 . A A . 15 SER N 1 1
6 1159 1 1 15 SER O O 1.092 -7.867 -7.271 1.00 . A A . 15 SER O 1 1
6 1160 1 1 15 SER OG O 3.261 -10.842 -5.380 1.00 . A A . 15 SER OG 1 1
6 1161 1 1 16 CYS C C -1.408 -8.886 -5.286 1.00 . A A . 16 CYS C 1 1
6 1162 1 1 16 CYS CA C -0.527 -9.805 -6.128 1.00 . A A . 16 CYS CA 1 1
6 1163 1 1 16 CYS CB C -0.902 -11.266 -5.871 1.00 . A A . 16 CYS CB 1 1
6 1164 1 1 16 CYS H H 1.329 -10.160 -5.174 1.00 . A A . 16 CYS H 1 1
6 1165 1 1 16 CYS HA H -0.687 -9.580 -7.172 1.00 . A A . 16 CYS HA 1 1
6 1166 1 1 16 CYS HB2 H -1.045 -11.411 -4.810 1.00 . A A . 16 CYS HB2 1 1
6 1167 1 1 16 CYS HB3 H -1.823 -11.489 -6.388 1.00 . A A . 16 CYS HB3 1 1
6 1168 1 1 16 CYS N N 0.884 -9.585 -5.833 1.00 . A A . 16 CYS N 1 1
6 1169 1 1 16 CYS O O -0.979 -8.373 -4.254 1.00 . A A . 16 CYS O 1 1
6 1170 1 1 16 CYS SG S 0.353 -12.464 -6.428 1.00 . A A . 16 CYS SG 1 1
6 1171 1 1 17 ALA C C -4.790 -8.629 -4.538 1.00 . A A . 17 ALA C 1 1
6 1172 1 1 17 ALA CA C -3.585 -7.831 -5.024 1.00 . A A . 17 ALA CA 1 1
6 1173 1 1 17 ALA CB C -4.034 -6.683 -5.915 1.00 . A A . 17 ALA CB 1 1
6 1174 1 1 17 ALA H H -2.926 -9.122 -6.566 1.00 . A A . 17 ALA H 1 1
6 1175 1 1 17 ALA HA H -3.075 -7.412 -4.168 1.00 . A A . 17 ALA HA 1 1
6 1176 1 1 17 ALA HB1 H -4.662 -6.011 -5.347 1.00 . A A . 17 ALA HB1 1 1
6 1177 1 1 17 ALA HB2 H -3.169 -6.147 -6.276 1.00 . A A . 17 ALA HB2 1 1
6 1178 1 1 17 ALA HB3 H -4.591 -7.074 -6.753 1.00 . A A . 17 ALA HB3 1 1
6 1179 1 1 17 ALA N N -2.642 -8.685 -5.736 1.00 . A A . 17 ALA N 1 1
6 1180 1 1 17 ALA O O -5.821 -8.648 -5.209 1.00 . A A . 17 ALA O 1 1
6 1181 1 1 18 ALA C C -6.727 -9.068 -2.104 1.00 . A A . 18 ALA C 1 1
6 1182 1 1 18 ALA CA C -5.692 -10.068 -2.788 1.00 . A A . 18 ALA CA 1 1
6 1183 1 1 18 ALA CB C -5.195 -11.016 -1.759 1.00 . A A . 18 ALA CB 1 1
6 1184 1 1 18 ALA H H -3.783 -9.193 -2.929 1.00 . A A . 18 ALA H 1 1
6 1185 1 1 18 ALA HA H -6.256 -10.556 -3.560 1.00 . A A . 18 ALA HA 1 1
6 1186 1 1 18 ALA HB1 H -5.050 -10.500 -0.821 1.00 . A A . 18 ALA HB1 1 1
6 1187 1 1 18 ALA HB2 H -5.955 -11.772 -1.634 1.00 . A A . 18 ALA HB2 1 1
6 1188 1 1 18 ALA N N -4.643 -9.268 -3.393 1.00 . A A . 18 ALA N 1 1
6 1189 1 1 18 ALA O O -7.940 -9.237 -2.223 1.00 . A A . 18 ALA O 1 1
6 1190 1 1 19 SER C C -6.473 -5.695 -0.845 1.00 . A A . 19 SER C 1 1
6 1191 1 1 19 SER CA C -7.038 -7.104 -0.699 1.00 . A A . 19 SER CA 1 1
6 1192 1 1 19 SER CB C -7.152 -7.470 0.782 1.00 . A A . 19 SER CB 1 1
6 1193 1 1 19 SER H H -5.225 -7.992 -1.339 1.00 . A A . 19 SER H 1 1
6 1194 1 1 19 SER HA H -8.020 -7.134 -1.146 1.00 . A A . 19 SER HA 1 1
6 1195 1 1 19 SER HB2 H -6.199 -7.833 1.135 1.00 . A A . 19 SER HB2 1 1
6 1196 1 1 19 SER HB3 H -7.435 -6.592 1.345 1.00 . A A . 19 SER HB3 1 1
6 1197 1 1 19 SER HG H -7.976 -8.905 1.830 1.00 . A A . 19 SER HG 1 1
6 1198 1 1 19 SER N N -6.200 -8.074 -1.396 1.00 . A A . 19 SER N 1 1
6 1199 1 1 19 SER O O -5.298 -5.455 -0.572 1.00 . A A . 19 SER O 1 1
6 1200 1 1 19 SER OG O -8.129 -8.476 0.985 1.00 . A A . 19 SER OG 1 1
7 1201 1 1 1 ALA C C 2.654 -2.333 -0.477 1.00 . A A . 1 ALA C 1 1
7 1202 1 1 1 ALA CA C 1.255 -2.930 -0.373 1.00 . A A . 1 ALA CA 1 1
7 1203 1 1 1 ALA CB C 0.572 -2.919 -1.733 1.00 . A A . 1 ALA CB 1 1
7 1204 1 1 1 ALA H1 H 0.556 -1.240 0.691 1.00 . A A . 1 ALA H1 1 1
7 1205 1 1 1 ALA HA H 1.336 -3.957 -0.047 1.00 . A A . 1 ALA HA 1 1
7 1206 1 1 1 ALA HB1 H 0.314 -1.903 -1.996 1.00 . A A . 1 ALA HB1 1 1
7 1207 1 1 1 ALA HB2 H 1.242 -3.325 -2.475 1.00 . A A . 1 ALA HB2 1 1
7 1208 1 1 1 ALA HB3 H -0.325 -3.519 -1.690 1.00 . A A . 1 ALA HB3 1 1
7 1209 1 1 1 ALA N N 0.448 -2.210 0.604 1.00 . A A . 1 ALA N 1 1
7 1210 1 1 1 ALA O O 2.957 -1.320 0.155 1.00 . A A . 1 ALA O 1 1
7 1211 1 1 2 CYS C C 5.040 -1.831 -2.825 1.00 . A A . 2 CYS C 1 1
7 1212 1 1 2 CYS CA C 4.873 -2.499 -1.463 1.00 . A A . 2 CYS CA 1 1
7 1213 1 1 2 CYS CB C 5.855 -3.665 -1.331 1.00 . A A . 2 CYS CB 1 1
7 1214 1 1 2 CYS H H 3.205 -3.769 -1.754 1.00 . A A . 2 CYS H 1 1
7 1215 1 1 2 CYS HA H 5.084 -1.774 -0.692 1.00 . A A . 2 CYS HA 1 1
7 1216 1 1 2 CYS HB2 H 5.833 -4.249 -2.240 1.00 . A A . 2 CYS HB2 1 1
7 1217 1 1 2 CYS HB3 H 6.851 -3.273 -1.186 1.00 . A A . 2 CYS HB3 1 1
7 1218 1 1 2 CYS N N 3.505 -2.967 -1.277 1.00 . A A . 2 CYS N 1 1
7 1219 1 1 2 CYS O O 5.479 -0.686 -2.917 1.00 . A A . 2 CYS O 1 1
7 1220 1 1 2 CYS SG S 5.493 -4.789 0.056 1.00 . A A . 2 CYS SG 1 1
7 1221 1 1 3 GLY C C 5.948 -2.637 -5.998 1.00 . A A . 3 GLY C 1 1
7 1222 1 1 3 GLY CA C 4.802 -2.019 -5.224 1.00 . A A . 3 GLY CA 1 1
7 1223 1 1 3 GLY H H 4.341 -3.465 -3.747 1.00 . A A . 3 GLY H 1 1
7 1224 1 1 3 GLY HA2 H 3.880 -2.204 -5.756 1.00 . A A . 3 GLY HA2 1 1
7 1225 1 1 3 GLY HA3 H 4.960 -0.952 -5.159 1.00 . A A . 3 GLY HA3 1 1
7 1226 1 1 3 GLY N N 4.685 -2.557 -3.881 1.00 . A A . 3 GLY N 1 1
7 1227 1 1 3 GLY O O 6.359 -2.133 -7.044 1.00 . A A . 3 GLY O 1 1
7 1228 1 1 4 . C C 8.965 -3.871 -5.727 1.00 . A A . 4 DBB C 1 1
7 1229 1 1 4 . CA C 7.583 -4.380 -6.175 1.00 . A A . 4 DBB CA 1 1
7 1230 1 1 4 . CB C 7.449 -5.904 -5.985 1.00 . A A . 4 DBB CB 1 1
7 1231 1 1 4 . CG C 8.460 -6.619 -6.867 1.00 . A A . 4 DBB CG 1 1
7 1232 1 1 4 . H H 6.121 -4.111 -4.652 1.00 . A A . 4 DBB H 1 1
7 1233 1 1 4 . HA H 7.476 -4.178 -7.222 1.00 . A A . 4 DBB HA 1 1
7 1234 1 1 4 . HB2 H 6.478 -6.153 -6.354 1.00 . A A . 4 DBB HB2 1 1
7 1235 1 1 4 . HG1 H 8.386 -7.681 -6.692 1.00 . A A . 4 DBB HG1 1 1
7 1236 1 1 4 . HG2 H 9.456 -6.280 -6.623 1.00 . A A . 4 DBB HG2 1 1
7 1237 1 1 4 . HG3 H 8.247 -6.408 -7.902 1.00 . A A . 4 DBB HG3 1 1
7 1238 1 1 4 . N N 6.474 -3.735 -5.490 1.00 . A A . 4 DBB N 1 1
7 1239 1 1 4 . O O 9.139 -3.619 -4.535 1.00 . A A . 4 DBB O 1 1
7 1240 1 1 5 GLY C C 12.286 -4.459 -6.395 1.00 . A A . 5 GLY C 1 1
7 1241 1 1 5 GLY CA C 11.265 -3.348 -6.256 1.00 . A A . 5 GLY CA 1 1
7 1242 1 1 5 GLY H H 9.733 -3.983 -7.572 1.00 . A A . 5 GLY H 1 1
7 1243 1 1 5 GLY HA2 H 11.562 -2.520 -6.883 1.00 . A A . 5 GLY HA2 1 1
7 1244 1 1 5 GLY HA3 H 11.247 -3.018 -5.227 1.00 . A A . 5 GLY HA3 1 1
7 1245 1 1 5 GLY N N 9.930 -3.769 -6.636 1.00 . A A . 5 GLY N 1 1
7 1246 1 1 5 GLY O O 13.273 -4.386 -7.122 1.00 . A A . 5 GLY O 1 1
7 1247 1 1 6 . C C 12.171 -8.039 -5.884 1.00 . A A . 6 IAS C 1 1
7 1248 1 1 6 . CA C 12.930 -6.726 -5.810 1.00 . A A . 6 IAS CA 1 1
7 1249 1 1 6 . CB C 14.034 -6.797 -4.739 1.00 . A A . 6 IAS CB 1 1
7 1250 1 1 6 . CG C 13.501 -6.724 -3.314 1.00 . A A . 6 IAS CG 1 1
7 1251 1 1 6 . H H 11.268 -5.637 -5.074 1.00 . A A . 6 IAS H 1 1
7 1252 1 1 6 . HA H 13.401 -6.654 -6.783 1.00 . A A . 6 IAS HA 1 1
7 1253 1 1 6 . HB2 H 14.676 -5.936 -4.863 1.00 . A A . 6 IAS HB2 1 1
7 1254 1 1 6 . HB3 H 14.608 -7.698 -4.889 1.00 . A A . 6 IAS HB3 1 1
7 1255 1 1 6 . HXT H 10.596 -8.205 -6.989 1.00 . A A . 6 IAS HXT 1 1
7 1256 1 1 6 . N N 12.066 -5.566 -5.667 1.00 . A A . 6 IAS N 1 1
7 1257 1 1 6 . O O 12.202 -8.894 -5.036 1.00 . A A . 6 IAS O 1 1
7 1258 1 1 6 . OD1 O 13.147 -5.659 -2.812 1.00 . A A . 6 IAS OD1 1 1
7 1259 1 1 6 . OXT O 11.562 -8.193 -7.069 1.00 . A A . 6 IAS OXT 1 1
7 1260 1 1 7 GLY C C 11.484 -7.677 -1.192 1.00 . A A . 7 GLY C 1 1
7 1261 1 1 7 GLY CA C 12.973 -7.945 -1.295 1.00 . A A . 7 GLY CA 1 1
7 1262 1 1 7 GLY H H 13.750 -8.700 -3.114 1.00 . A A . 7 GLY H 1 1
7 1263 1 1 7 GLY HA2 H 13.179 -8.927 -0.897 1.00 . A A . 7 GLY HA2 1 1
7 1264 1 1 7 GLY HA3 H 13.501 -7.210 -0.706 1.00 . A A . 7 GLY HA3 1 1
7 1265 1 1 7 GLY N N 13.455 -7.882 -2.663 1.00 . A A . 7 GLY N 1 1
7 1266 1 1 7 GLY O O 10.953 -7.496 -0.096 1.00 . A A . 7 GLY O 1 1
7 1267 1 1 8 CYS C C 8.590 -8.690 -2.158 1.00 . A A . 8 CYS C 1 1
7 1268 1 1 8 CYS CA C 9.374 -7.398 -2.371 1.00 . A A . 8 CYS CA 1 1
7 1269 1 1 8 CYS CB C 8.978 -6.763 -3.706 1.00 . A A . 8 CYS CB 1 1
7 1270 1 1 8 CYS H H 11.289 -7.799 -3.179 1.00 . A A . 8 CYS H 1 1
7 1271 1 1 8 CYS HA H 9.137 -6.712 -1.572 1.00 . A A . 8 CYS HA 1 1
7 1272 1 1 8 CYS HB2 H 9.408 -5.773 -3.766 1.00 . A A . 8 CYS HB2 1 1
7 1273 1 1 8 CYS HB3 H 9.365 -7.368 -4.512 1.00 . A A . 8 CYS HB3 1 1
7 1274 1 1 8 CYS N N 10.809 -7.648 -2.336 1.00 . A A . 8 CYS N 1 1
7 1275 1 1 8 CYS O O 8.739 -9.650 -2.914 1.00 . A A . 8 CYS O 1 1
7 1276 1 1 8 CYS SG S 7.180 -6.599 -3.947 1.00 . A A . 8 CYS SG 1 1
7 1277 1 1 9 ALA C C 6.191 -10.366 -2.044 1.00 . A A . 9 ALA C 1 1
7 1278 1 1 9 ALA CA C 6.947 -9.878 -0.813 1.00 . A A . 9 ALA CA 1 1
7 1279 1 1 9 ALA CB C 5.977 -9.565 0.316 1.00 . A A . 9 ALA CB 1 1
7 1280 1 1 9 ALA H H 7.681 -7.910 -0.558 1.00 . A A . 9 ALA H 1 1
7 1281 1 1 9 ALA HA H 7.611 -10.662 -0.477 1.00 . A A . 9 ALA HA 1 1
7 1282 1 1 9 ALA HB1 H 5.137 -9.011 -0.076 1.00 . A A . 9 ALA HB1 1 1
7 1283 1 1 9 ALA HB2 H 5.627 -10.488 0.756 1.00 . A A . 9 ALA HB2 1 1
7 1284 1 1 9 ALA HB3 H 6.479 -8.975 1.069 1.00 . A A . 9 ALA HB3 1 1
7 1285 1 1 9 ALA N N 7.756 -8.706 -1.124 1.00 . A A . 9 ALA N 1 1
7 1286 1 1 9 ALA O O 6.066 -9.645 -3.034 1.00 . A A . 9 ALA O 1 1
7 1287 1 1 10 LYS C C 3.464 -12.315 -2.732 1.00 . A A . 10 LYS C 1 1
7 1288 1 1 10 LYS CA C 4.942 -12.178 -3.083 1.00 . A A . 10 LYS CA 1 1
7 1289 1 1 10 LYS CB C 5.519 -13.548 -3.447 1.00 . A A . 10 LYS CB 1 1
7 1290 1 1 10 LYS CD C 6.382 -14.960 -5.337 1.00 . A A . 10 LYS CD 1 1
7 1291 1 1 10 LYS CE C 5.874 -16.357 -5.014 1.00 . A A . 10 LYS CE 1 1
7 1292 1 1 10 LYS CG C 5.382 -13.894 -4.920 1.00 . A A . 10 LYS CG 1 1
7 1293 1 1 10 LYS H H 5.820 -12.119 -1.158 1.00 . A A . 10 LYS H 1 1
7 1294 1 1 10 LYS HA H 5.038 -11.519 -3.933 1.00 . A A . 10 LYS HA 1 1
7 1295 1 1 10 LYS HB2 H 6.569 -13.562 -3.192 1.00 . A A . 10 LYS HB2 1 1
7 1296 1 1 10 LYS HB3 H 5.007 -14.306 -2.872 1.00 . A A . 10 LYS HB3 1 1
7 1297 1 1 10 LYS HD2 H 6.549 -14.887 -6.402 1.00 . A A . 10 LYS HD2 1 1
7 1298 1 1 10 LYS HD3 H 7.312 -14.794 -4.813 1.00 . A A . 10 LYS HD3 1 1
7 1299 1 1 10 LYS HE2 H 5.685 -16.421 -3.954 1.00 . A A . 10 LYS HE2 1 1
7 1300 1 1 10 LYS HE3 H 4.955 -16.525 -5.555 1.00 . A A . 10 LYS HE3 1 1
7 1301 1 1 10 LYS HG2 H 4.383 -14.262 -5.102 1.00 . A A . 10 LYS HG2 1 1
7 1302 1 1 10 LYS HG3 H 5.553 -13.003 -5.507 1.00 . A A . 10 LYS HG3 1 1
7 1303 1 1 10 LYS HZ1 H 7.776 -16.970 -5.623 1.00 . A A . 10 LYS HZ1 1 1
7 1304 1 1 10 LYS HZ2 H 6.521 -17.929 -6.228 1.00 . A A . 10 LYS HZ2 1 1
7 1305 1 1 10 LYS HZ3 H 6.992 -18.075 -4.609 1.00 . A A . 10 LYS HZ3 1 1
7 1306 1 1 10 LYS N N 5.687 -11.593 -1.975 1.00 . A A . 10 LYS N 1 1
7 1307 1 1 10 LYS NZ N 6.860 -17.406 -5.395 1.00 . A A . 10 LYS NZ 1 1
7 1308 1 1 10 LYS O O 3.050 -12.088 -1.595 1.00 . A A . 10 LYS O 1 1
7 1309 1 1 11 . C C 0.593 -11.590 -2.831 1.00 . A A . 11 DBB C 1 1
7 1310 1 1 11 . CA C 1.241 -12.838 -3.456 1.00 . A A . 11 DBB CA 1 1
7 1311 1 1 11 . CB C 0.550 -13.237 -4.776 1.00 . A A . 11 DBB CB 1 1
7 1312 1 1 11 . CG C -0.897 -13.615 -4.501 1.00 . A A . 11 DBB CG 1 1
7 1313 1 1 11 . H H 3.029 -12.863 -4.610 1.00 . A A . 11 DBB H 1 1
7 1314 1 1 11 . HA H 1.119 -13.655 -2.773 1.00 . A A . 11 DBB HA 1 1
7 1315 1 1 11 . HB2 H 1.050 -14.123 -5.103 1.00 . A A . 11 DBB HB2 1 1
7 1316 1 1 11 . HG1 H -1.420 -12.746 -4.131 1.00 . A A . 11 DBB HG1 1 1
7 1317 1 1 11 . HG2 H -0.930 -14.399 -3.759 1.00 . A A . 11 DBB HG2 1 1
7 1318 1 1 11 . HG3 H -1.360 -13.955 -5.413 1.00 . A A . 11 DBB HG3 1 1
7 1319 1 1 11 . N N 2.664 -12.690 -3.712 1.00 . A A . 11 DBB N 1 1
7 1320 1 1 11 . O O 1.074 -10.486 -3.091 1.00 . A A . 11 DBB O 1 1
7 1321 1 1 12 CYS C C -0.439 -10.071 -0.277 1.00 . A A . 12 CYS C 1 1
7 1322 1 1 12 CYS CA C -1.188 -10.607 -1.494 1.00 . A A . 12 CYS CA 1 1
7 1323 1 1 12 CYS CB C -2.611 -11.005 -1.097 1.00 . A A . 12 CYS CB 1 1
7 1324 1 1 12 CYS H H -0.824 -12.652 -1.902 1.00 . A A . 12 CYS H 1 1
7 1325 1 1 12 CYS HA H -1.236 -9.831 -2.242 1.00 . A A . 12 CYS HA 1 1
7 1326 1 1 12 CYS HB2 H -2.575 -11.576 -0.180 1.00 . A A . 12 CYS HB2 1 1
7 1327 1 1 12 CYS HB3 H -3.194 -10.111 -0.935 1.00 . A A . 12 CYS HB3 1 1
7 1328 1 1 12 CYS N N -0.488 -11.747 -2.074 1.00 . A A . 12 CYS N 1 1
7 1329 1 1 12 CYS O O -0.984 -10.017 0.825 1.00 . A A . 12 CYS O 1 1
7 1330 1 1 12 CYS SG S -3.476 -12.014 -2.342 1.00 . A A . 12 CYS SG 1 1
7 1331 1 1 13 ALA C C 2.253 -7.804 0.200 1.00 . A A . 13 ALA C 1 1
7 1332 1 1 13 ALA CA C 1.635 -9.142 0.592 1.00 . A A . 13 ALA CA 1 1
7 1333 1 1 13 ALA CB C 2.722 -10.138 0.969 1.00 . A A . 13 ALA CB 1 1
7 1334 1 1 13 ALA H H 1.190 -9.744 -1.387 1.00 . A A . 13 ALA H 1 1
7 1335 1 1 13 ALA HA H 1.000 -8.995 1.455 1.00 . A A . 13 ALA HA 1 1
7 1336 1 1 13 ALA HB1 H 2.265 -11.039 1.353 1.00 . A A . 13 ALA HB1 1 1
7 1337 1 1 13 ALA HB2 H 3.311 -10.375 0.096 1.00 . A A . 13 ALA HB2 1 1
7 1338 1 1 13 ALA HB3 H 3.358 -9.706 1.727 1.00 . A A . 13 ALA HB3 1 1
7 1339 1 1 13 ALA N N 0.812 -9.676 -0.486 1.00 . A A . 13 ALA N 1 1
7 1340 1 1 13 ALA O O 2.400 -6.927 1.050 1.00 . A A . 13 ALA O 1 1
7 1341 1 1 14 ALA C C 3.203 -6.596 -3.192 1.00 . A A . 14 ALA C 1 1
7 1342 1 1 14 ALA CA C 3.199 -6.463 -1.604 1.00 . A A . 14 ALA CA 1 1
7 1343 1 1 14 ALA CB C 4.590 -6.233 -1.142 1.00 . A A . 14 ALA CB 1 1
7 1344 1 1 14 ALA H H 2.445 -8.427 -1.670 1.00 . A A . 14 ALA H 1 1
7 1345 1 1 14 ALA HA H 2.553 -5.629 -1.404 1.00 . A A . 14 ALA HA 1 1
7 1346 1 1 14 ALA HB1 H 4.949 -7.100 -0.606 1.00 . A A . 14 ALA HB1 1 1
7 1347 1 1 14 ALA HB2 H 5.194 -6.086 -2.025 1.00 . A A . 14 ALA HB2 1 1
7 1348 1 1 14 ALA N N 2.602 -7.672 -1.066 1.00 . A A . 14 ALA N 1 1
7 1349 1 1 14 ALA O O 2.944 -5.628 -3.907 1.00 . A A . 14 ALA O 1 1
7 1350 1 1 15 SER C C 2.187 -8.057 -5.728 1.00 . A A . 15 SER C 1 1
7 1351 1 1 15 SER CA C 3.584 -8.038 -5.116 1.00 . A A . 15 SER CA 1 1
7 1352 1 1 15 SER CB C 4.294 -9.365 -5.394 1.00 . A A . 15 SER CB 1 1
7 1353 1 1 15 SER H H 3.715 -8.524 -3.059 1.00 . A A . 15 SER H 1 1
7 1354 1 1 15 SER HA H 4.150 -7.236 -5.565 1.00 . A A . 15 SER HA 1 1
7 1355 1 1 15 SER HB2 H 5.346 -9.260 -5.178 1.00 . A A . 15 SER HB2 1 1
7 1356 1 1 15 SER HB3 H 3.871 -10.135 -4.765 1.00 . A A . 15 SER HB3 1 1
7 1357 1 1 15 SER HG H 4.680 -10.525 -6.925 1.00 . A A . 15 SER HG 1 1
7 1358 1 1 15 SER N N 3.519 -7.791 -3.680 1.00 . A A . 15 SER N 1 1
7 1359 1 1 15 SER O O 1.782 -7.115 -6.409 1.00 . A A . 15 SER O 1 1
7 1360 1 1 15 SER OG O 4.143 -9.749 -6.750 1.00 . A A . 15 SER OG 1 1
7 1361 1 1 16 CYS C C -0.877 -8.396 -5.241 1.00 . A A . 16 CYS C 1 1
7 1362 1 1 16 CYS CA C 0.102 -9.282 -6.006 1.00 . A A . 16 CYS CA 1 1
7 1363 1 1 16 CYS CB C -0.345 -10.743 -5.925 1.00 . A A . 16 CYS CB 1 1
7 1364 1 1 16 CYS H H 1.832 -9.856 -4.930 1.00 . A A . 16 CYS H 1 1
7 1365 1 1 16 CYS HA H 0.114 -8.975 -7.041 1.00 . A A . 16 CYS HA 1 1
7 1366 1 1 16 CYS HB2 H -0.599 -10.978 -4.902 1.00 . A A . 16 CYS HB2 1 1
7 1367 1 1 16 CYS HB3 H -1.217 -10.879 -6.547 1.00 . A A . 16 CYS HB3 1 1
7 1368 1 1 16 CYS N N 1.454 -9.138 -5.480 1.00 . A A . 16 CYS N 1 1
7 1369 1 1 16 CYS O O -0.603 -7.978 -4.116 1.00 . A A . 16 CYS O 1 1
7 1370 1 1 16 CYS SG S 0.917 -11.939 -6.469 1.00 . A A . 16 CYS SG 1 1
7 1371 1 1 17 ALA C C -4.310 -8.078 -4.967 1.00 . A A . 17 ALA C 1 1
7 1372 1 1 17 ALA CA C -3.039 -7.280 -5.237 1.00 . A A . 17 ALA CA 1 1
7 1373 1 1 17 ALA CB C -3.345 -6.076 -6.116 1.00 . A A . 17 ALA CB 1 1
7 1374 1 1 17 ALA H H -2.179 -8.477 -6.756 1.00 . A A . 17 ALA H 1 1
7 1375 1 1 17 ALA HA H -2.647 -6.918 -4.297 1.00 . A A . 17 ALA HA 1 1
7 1376 1 1 17 ALA HB1 H -4.096 -5.464 -5.637 1.00 . A A . 17 ALA HB1 1 1
7 1377 1 1 17 ALA HB2 H -2.445 -5.497 -6.259 1.00 . A A . 17 ALA HB2 1 1
7 1378 1 1 17 ALA HB3 H -3.713 -6.414 -7.073 1.00 . A A . 17 ALA HB3 1 1
7 1379 1 1 17 ALA N N -2.019 -8.114 -5.860 1.00 . A A . 17 ALA N 1 1
7 1380 1 1 17 ALA O O -5.243 -8.030 -5.769 1.00 . A A . 17 ALA O 1 1
7 1381 1 1 18 ALA C C -6.496 -8.643 -2.709 1.00 . A A . 18 ALA C 1 1
7 1382 1 1 18 ALA CA C -5.460 -9.601 -3.449 1.00 . A A . 18 ALA CA 1 1
7 1383 1 1 18 ALA CB C -5.094 -10.708 -2.530 1.00 . A A . 18 ALA CB 1 1
7 1384 1 1 18 ALA H H -3.535 -8.765 -3.280 1.00 . A A . 18 ALA H 1 1
7 1385 1 1 18 ALA HA H -5.983 -9.944 -4.321 1.00 . A A . 18 ALA HA 1 1
7 1386 1 1 18 ALA HB1 H -5.089 -10.354 -1.509 1.00 . A A . 18 ALA HB1 1 1
7 1387 1 1 18 ALA HB2 H -5.853 -11.469 -2.638 1.00 . A A . 18 ALA HB2 1 1
7 1388 1 1 18 ALA N N -4.327 -8.790 -3.857 1.00 . A A . 18 ALA N 1 1
7 1389 1 1 18 ALA O O -7.708 -8.769 -2.883 1.00 . A A . 18 ALA O 1 1
7 1390 1 1 19 SER C C -7.315 -5.680 -2.025 1.00 . A A . 19 SER C 1 1
7 1391 1 1 19 SER CA C -6.813 -6.813 -1.136 1.00 . A A . 19 SER CA 1 1
7 1392 1 1 19 SER CB C -6.037 -6.239 0.051 1.00 . A A . 19 SER CB 1 1
7 1393 1 1 19 SER H H -4.999 -7.682 -1.796 1.00 . A A . 19 SER H 1 1
7 1394 1 1 19 SER HA H -7.662 -7.367 -0.765 1.00 . A A . 19 SER HA 1 1
7 1395 1 1 19 SER HB2 H -5.204 -5.657 -0.314 1.00 . A A . 19 SER HB2 1 1
7 1396 1 1 19 SER HB3 H -6.691 -5.605 0.633 1.00 . A A . 19 SER HB3 1 1
7 1397 1 1 19 SER HG H -6.260 -7.858 1.130 1.00 . A A . 19 SER HG 1 1
7 1398 1 1 19 SER N N -5.973 -7.733 -1.893 1.00 . A A . 19 SER N 1 1
7 1399 1 1 19 SER O O -6.965 -5.599 -3.201 1.00 . A A . 19 SER O 1 1
7 1400 1 1 19 SER OG O -5.541 -7.272 0.884 1.00 . A A . 19 SER OG 1 1
8 1401 1 1 1 ALA C C 2.523 -0.596 -1.149 1.00 . A A . 1 ALA C 1 1
8 1402 1 1 1 ALA CA C 1.317 0.275 -1.486 1.00 . A A . 1 ALA CA 1 1
8 1403 1 1 1 ALA CB C 1.646 1.744 -1.266 1.00 . A A . 1 ALA CB 1 1
8 1404 1 1 1 ALA H1 H -0.096 0.439 0.081 1.00 . A A . 1 ALA H1 1 1
8 1405 1 1 1 ALA HA H 1.068 0.139 -2.529 1.00 . A A . 1 ALA HA 1 1
8 1406 1 1 1 ALA HB1 H 2.510 1.826 -0.622 1.00 . A A . 1 ALA HB1 1 1
8 1407 1 1 1 ALA HB2 H 1.859 2.211 -2.216 1.00 . A A . 1 ALA HB2 1 1
8 1408 1 1 1 ALA HB3 H 0.804 2.236 -0.802 1.00 . A A . 1 ALA HB3 1 1
8 1409 1 1 1 ALA N N 0.155 -0.107 -0.693 1.00 . A A . 1 ALA N 1 1
8 1410 1 1 1 ALA O O 2.654 -1.085 -0.026 1.00 . A A . 1 ALA O 1 1
8 1411 1 1 2 CYS C C 5.706 -1.169 -2.889 1.00 . A A . 2 CYS C 1 1
8 1412 1 1 2 CYS CA C 4.596 -1.599 -1.935 1.00 . A A . 2 CYS CA 1 1
8 1413 1 1 2 CYS CB C 4.271 -3.079 -2.148 1.00 . A A . 2 CYS CB 1 1
8 1414 1 1 2 CYS H H 3.242 -0.370 -3.001 1.00 . A A . 2 CYS H 1 1
8 1415 1 1 2 CYS HA H 4.935 -1.456 -0.920 1.00 . A A . 2 CYS HA 1 1
8 1416 1 1 2 CYS HB2 H 3.315 -3.298 -1.695 1.00 . A A . 2 CYS HB2 1 1
8 1417 1 1 2 CYS HB3 H 4.216 -3.279 -3.208 1.00 . A A . 2 CYS HB3 1 1
8 1418 1 1 2 CYS N N 3.401 -0.786 -2.127 1.00 . A A . 2 CYS N 1 1
8 1419 1 1 2 CYS O O 5.485 -1.025 -4.091 1.00 . A A . 2 CYS O 1 1
8 1420 1 1 2 CYS SG S 5.497 -4.220 -1.430 1.00 . A A . 2 CYS SG 1 1
8 1421 1 1 3 GLY C C 8.300 -1.512 -4.302 1.00 . A A . 3 GLY C 1 1
8 1422 1 1 3 GLY CA C 8.028 -0.552 -3.161 1.00 . A A . 3 GLY CA 1 1
8 1423 1 1 3 GLY H H 7.019 -1.094 -1.380 1.00 . A A . 3 GLY H 1 1
8 1424 1 1 3 GLY HA2 H 7.825 0.427 -3.569 1.00 . A A . 3 GLY HA2 1 1
8 1425 1 1 3 GLY HA3 H 8.908 -0.495 -2.537 1.00 . A A . 3 GLY HA3 1 1
8 1426 1 1 3 GLY N N 6.902 -0.964 -2.344 1.00 . A A . 3 GLY N 1 1
8 1427 1 1 3 GLY O O 8.858 -1.138 -5.333 1.00 . A A . 3 GLY O 1 1
8 1428 1 1 4 . C C 9.615 -3.842 -5.603 1.00 . A A . 4 DBB C 1 1
8 1429 1 1 4 . CA C 8.141 -3.738 -5.173 1.00 . A A . 4 DBB CA 1 1
8 1430 1 1 4 . CB C 7.589 -5.098 -4.698 1.00 . A A . 4 DBB CB 1 1
8 1431 1 1 4 . CG C 7.616 -6.089 -5.850 1.00 . A A . 4 DBB CG 1 1
8 1432 1 1 4 . H H 7.464 -3.023 -3.286 1.00 . A A . 4 DBB H 1 1
8 1433 1 1 4 . HA H 7.564 -3.441 -6.026 1.00 . A A . 4 DBB HA 1 1
8 1434 1 1 4 . HB2 H 6.563 -4.921 -4.459 1.00 . A A . 4 DBB HB2 1 1
8 1435 1 1 4 . HG1 H 8.644 -6.307 -6.099 1.00 . A A . 4 DBB HG1 1 1
8 1436 1 1 4 . HG2 H 7.119 -5.661 -6.707 1.00 . A A . 4 DBB HG2 1 1
8 1437 1 1 4 . HG3 H 7.116 -6.998 -5.555 1.00 . A A . 4 DBB HG3 1 1
8 1438 1 1 4 . N N 7.907 -2.759 -4.124 1.00 . A A . 4 DBB N 1 1
8 1439 1 1 4 . O O 9.888 -3.725 -6.796 1.00 . A A . 4 DBB O 1 1
8 1440 1 1 5 GLY C C 12.245 -5.068 -6.095 1.00 . A A . 5 GLY C 1 1
8 1441 1 1 5 GLY CA C 11.949 -4.054 -5.008 1.00 . A A . 5 GLY CA 1 1
8 1442 1 1 5 GLY H H 10.265 -4.093 -3.726 1.00 . A A . 5 GLY H 1 1
8 1443 1 1 5 GLY HA2 H 12.259 -3.077 -5.348 1.00 . A A . 5 GLY HA2 1 1
8 1444 1 1 5 GLY HA3 H 12.516 -4.313 -4.126 1.00 . A A . 5 GLY HA3 1 1
8 1445 1 1 5 GLY N N 10.541 -4.005 -4.662 1.00 . A A . 5 GLY N 1 1
8 1446 1 1 5 GLY O O 12.182 -4.813 -7.294 1.00 . A A . 5 GLY O 1 1
8 1447 1 1 6 . C C 11.524 -8.128 -6.985 1.00 . A A . 6 IAS C 1 1
8 1448 1 1 6 . CA C 12.794 -7.368 -6.647 1.00 . A A . 6 IAS CA 1 1
8 1449 1 1 6 . CB C 13.919 -8.340 -6.249 1.00 . A A . 6 IAS CB 1 1
8 1450 1 1 6 . CG C 13.742 -8.932 -4.857 1.00 . A A . 6 IAS CG 1 1
8 1451 1 1 6 . H H 12.646 -6.516 -4.713 1.00 . A A . 6 IAS H 1 1
8 1452 1 1 6 . HA H 13.061 -6.901 -7.588 1.00 . A A . 6 IAS HA 1 1
8 1453 1 1 6 . HB2 H 14.846 -7.787 -6.224 1.00 . A A . 6 IAS HB2 1 1
8 1454 1 1 6 . HB3 H 13.986 -9.120 -6.992 1.00 . A A . 6 IAS HB3 1 1
8 1455 1 1 6 . HXT H 10.322 -7.738 -8.445 1.00 . A A . 6 IAS HXT 1 1
8 1456 1 1 6 . N N 12.592 -6.299 -5.684 1.00 . A A . 6 IAS N 1 1
8 1457 1 1 6 . O O 10.914 -8.818 -6.208 1.00 . A A . 6 IAS O 1 1
8 1458 1 1 6 . OD1 O 13.376 -10.095 -4.692 1.00 . A A . 6 IAS OD1 1 1
8 1459 1 1 6 . OXT O 11.228 -8.045 -8.291 1.00 . A A . 6 IAS OXT 1 1
8 1460 1 1 7 GLY C C 12.484 -8.282 -1.913 1.00 . A A . 7 GLY C 1 1
8 1461 1 1 7 GLY CA C 13.867 -8.549 -2.473 1.00 . A A . 7 GLY CA 1 1
8 1462 1 1 7 GLY H H 14.293 -7.190 -4.040 1.00 . A A . 7 GLY H 1 1
8 1463 1 1 7 GLY HA2 H 14.065 -9.609 -2.426 1.00 . A A . 7 GLY HA2 1 1
8 1464 1 1 7 GLY HA3 H 14.594 -8.030 -1.866 1.00 . A A . 7 GLY HA3 1 1
8 1465 1 1 7 GLY N N 14.004 -8.106 -3.848 1.00 . A A . 7 GLY N 1 1
8 1466 1 1 7 GLY O O 12.285 -8.288 -0.698 1.00 . A A . 7 GLY O 1 1
8 1467 1 1 8 CYS C C 9.374 -9.070 -2.194 1.00 . A A . 8 CYS C 1 1
8 1468 1 1 8 CYS CA C 10.152 -7.772 -2.390 1.00 . A A . 8 CYS CA 1 1
8 1469 1 1 8 CYS CB C 9.450 -6.896 -3.430 1.00 . A A . 8 CYS CB 1 1
8 1470 1 1 8 CYS H H 11.744 -8.053 -3.757 1.00 . A A . 8 CYS H 1 1
8 1471 1 1 8 CYS HA H 10.186 -7.242 -1.450 1.00 . A A . 8 CYS HA 1 1
8 1472 1 1 8 CYS HB2 H 10.192 -6.316 -3.960 1.00 . A A . 8 CYS HB2 1 1
8 1473 1 1 8 CYS HB3 H 8.929 -7.531 -4.132 1.00 . A A . 8 CYS HB3 1 1
8 1474 1 1 8 CYS N N 11.524 -8.044 -2.801 1.00 . A A . 8 CYS N 1 1
8 1475 1 1 8 CYS O O 9.823 -10.141 -2.601 1.00 . A A . 8 CYS O 1 1
8 1476 1 1 8 CYS SG S 8.238 -5.733 -2.727 1.00 . A A . 8 CYS SG 1 1
8 1477 1 1 9 ALA C C 6.386 -10.353 -2.468 1.00 . A A . 9 ALA C 1 1
8 1478 1 1 9 ALA CA C 7.365 -10.129 -1.321 1.00 . A A . 9 ALA CA 1 1
8 1479 1 1 9 ALA CB C 6.615 -9.968 -0.007 1.00 . A A . 9 ALA CB 1 1
8 1480 1 1 9 ALA H H 7.903 -8.083 -1.269 1.00 . A A . 9 ALA H 1 1
8 1481 1 1 9 ALA HA H 8.008 -10.994 -1.237 1.00 . A A . 9 ALA HA 1 1
8 1482 1 1 9 ALA HB1 H 6.081 -9.029 -0.012 1.00 . A A . 9 ALA HB1 1 1
8 1483 1 1 9 ALA HB2 H 5.914 -10.781 0.108 1.00 . A A . 9 ALA HB2 1 1
8 1484 1 1 9 ALA HB3 H 7.318 -9.979 0.812 1.00 . A A . 9 ALA HB3 1 1
8 1485 1 1 9 ALA N N 8.206 -8.965 -1.569 1.00 . A A . 9 ALA N 1 1
8 1486 1 1 9 ALA O O 6.021 -9.416 -3.179 1.00 . A A . 9 ALA O 1 1
8 1487 1 1 10 LYS C C 3.629 -12.190 -3.139 1.00 . A A . 10 LYS C 1 1
8 1488 1 1 10 LYS CA C 5.025 -11.948 -3.705 1.00 . A A . 10 LYS CA 1 1
8 1489 1 1 10 LYS CB C 5.507 -13.194 -4.452 1.00 . A A . 10 LYS CB 1 1
8 1490 1 1 10 LYS CD C 5.557 -15.703 -4.342 1.00 . A A . 10 LYS CD 1 1
8 1491 1 1 10 LYS CE C 6.384 -16.817 -3.718 1.00 . A A . 10 LYS CE 1 1
8 1492 1 1 10 LYS CG C 5.686 -14.408 -3.557 1.00 . A A . 10 LYS CG 1 1
8 1493 1 1 10 LYS H H 6.289 -12.305 -2.045 1.00 . A A . 10 LYS H 1 1
8 1494 1 1 10 LYS HA H 4.982 -11.119 -4.395 1.00 . A A . 10 LYS HA 1 1
8 1495 1 1 10 LYS HB2 H 4.787 -13.440 -5.218 1.00 . A A . 10 LYS HB2 1 1
8 1496 1 1 10 LYS HB3 H 6.456 -12.974 -4.919 1.00 . A A . 10 LYS HB3 1 1
8 1497 1 1 10 LYS HD2 H 4.521 -16.004 -4.356 1.00 . A A . 10 LYS HD2 1 1
8 1498 1 1 10 LYS HD3 H 5.899 -15.536 -5.354 1.00 . A A . 10 LYS HD3 1 1
8 1499 1 1 10 LYS HE2 H 6.182 -16.847 -2.659 1.00 . A A . 10 LYS HE2 1 1
8 1500 1 1 10 LYS HE3 H 6.095 -17.756 -4.167 1.00 . A A . 10 LYS HE3 1 1
8 1501 1 1 10 LYS HG2 H 6.665 -14.370 -3.105 1.00 . A A . 10 LYS HG2 1 1
8 1502 1 1 10 LYS HG3 H 4.929 -14.390 -2.785 1.00 . A A . 10 LYS HG3 1 1
8 1503 1 1 10 LYS HZ1 H 8.293 -17.500 -4.220 1.00 . A A . 10 LYS HZ1 1 1
8 1504 1 1 10 LYS HZ2 H 8.288 -16.282 -3.046 1.00 . A A . 10 LYS HZ2 1 1
8 1505 1 1 10 LYS HZ3 H 8.000 -15.895 -4.668 1.00 . A A . 10 LYS HZ3 1 1
8 1506 1 1 10 LYS N N 5.963 -11.600 -2.644 1.00 . A A . 10 LYS N 1 1
8 1507 1 1 10 LYS NZ N 7.844 -16.609 -3.928 1.00 . A A . 10 LYS NZ 1 1
8 1508 1 1 10 LYS O O 3.374 -11.987 -1.951 1.00 . A A . 10 LYS O 1 1
8 1509 1 1 11 . C C 0.706 -11.654 -2.867 1.00 . A A . 11 DBB C 1 1
8 1510 1 1 11 . CA C 1.367 -12.877 -3.527 1.00 . A A . 11 DBB CA 1 1
8 1511 1 1 11 . CB C 0.536 -13.400 -4.716 1.00 . A A . 11 DBB CB 1 1
8 1512 1 1 11 . CG C -0.819 -13.879 -4.220 1.00 . A A . 11 DBB CG 1 1
8 1513 1 1 11 . H H 2.961 -12.778 -4.934 1.00 . A A . 11 DBB H 1 1
8 1514 1 1 11 . HA H 1.415 -13.664 -2.801 1.00 . A A . 11 DBB HA 1 1
8 1515 1 1 11 . HB2 H 1.062 -14.259 -5.075 1.00 . A A . 11 DBB HB2 1 1
8 1516 1 1 11 . HG1 H -1.414 -13.020 -3.950 1.00 . A A . 11 DBB HG1 1 1
8 1517 1 1 11 . HG2 H -0.684 -14.512 -3.356 1.00 . A A . 11 DBB HG2 1 1
8 1518 1 1 11 . HG3 H -1.314 -14.431 -5.003 1.00 . A A . 11 DBB HG3 1 1
8 1519 1 1 11 . N N 2.722 -12.627 -3.991 1.00 . A A . 11 DBB N 1 1
8 1520 1 1 11 . O O 1.034 -10.530 -3.250 1.00 . A A . 11 DBB O 1 1
8 1521 1 1 12 CYS C C -0.074 -10.089 -0.245 1.00 . A A . 12 CYS C 1 1
8 1522 1 1 12 CYS CA C -0.937 -10.750 -1.315 1.00 . A A . 12 CYS CA 1 1
8 1523 1 1 12 CYS CB C -2.248 -11.242 -0.696 1.00 . A A . 12 CYS CB 1 1
8 1524 1 1 12 CYS H H -0.447 -12.777 -1.679 1.00 . A A . 12 CYS H 1 1
8 1525 1 1 12 CYS HA H -1.162 -10.022 -2.080 1.00 . A A . 12 CYS HA 1 1
8 1526 1 1 12 CYS HB2 H -2.032 -11.730 0.243 1.00 . A A . 12 CYS HB2 1 1
8 1527 1 1 12 CYS HB3 H -2.892 -10.394 -0.516 1.00 . A A . 12 CYS HB3 1 1
8 1528 1 1 12 CYS N N -0.228 -11.858 -1.944 1.00 . A A . 12 CYS N 1 1
8 1529 1 1 12 CYS O O -0.458 -10.018 0.922 1.00 . A A . 12 CYS O 1 1
8 1530 1 1 12 CYS SG S -3.163 -12.425 -1.736 1.00 . A A . 12 CYS SG 1 1
8 1531 1 1 13 ALA C C 2.455 -7.592 -0.268 1.00 . A A . 13 ALA C 1 1
8 1532 1 1 13 ALA CA C 2.013 -8.948 0.271 1.00 . A A . 13 ALA CA 1 1
8 1533 1 1 13 ALA CB C 3.222 -9.834 0.533 1.00 . A A . 13 ALA CB 1 1
8 1534 1 1 13 ALA H H 1.347 -9.692 -1.595 1.00 . A A . 13 ALA H 1 1
8 1535 1 1 13 ALA HA H 1.495 -8.800 1.208 1.00 . A A . 13 ALA HA 1 1
8 1536 1 1 13 ALA HB1 H 2.890 -10.801 0.880 1.00 . A A . 13 ALA HB1 1 1
8 1537 1 1 13 ALA HB2 H 3.787 -9.952 -0.380 1.00 . A A . 13 ALA HB2 1 1
8 1538 1 1 13 ALA HB3 H 3.846 -9.376 1.286 1.00 . A A . 13 ALA HB3 1 1
8 1539 1 1 13 ALA N N 1.096 -9.606 -0.652 1.00 . A A . 13 ALA N 1 1
8 1540 1 1 13 ALA O O 2.639 -6.656 0.509 1.00 . A A . 13 ALA O 1 1
8 1541 1 1 14 ALA C C 2.809 -6.510 -3.813 1.00 . A A . 14 ALA C 1 1
8 1542 1 1 14 ALA CA C 3.030 -6.292 -2.250 1.00 . A A . 14 ALA CA 1 1
8 1543 1 1 14 ALA CB C 4.452 -5.937 -2.015 1.00 . A A . 14 ALA CB 1 1
8 1544 1 1 14 ALA H H 2.447 -8.309 -2.114 1.00 . A A . 14 ALA H 1 1
8 1545 1 1 14 ALA HA H 2.358 -5.496 -1.991 1.00 . A A . 14 ALA HA 1 1
8 1546 1 1 14 ALA HB1 H 4.878 -6.594 -1.271 1.00 . A A . 14 ALA HB1 1 1
8 1547 1 1 14 ALA HB2 H 4.970 -6.078 -2.952 1.00 . A A . 14 ALA HB2 1 1
8 1548 1 1 14 ALA N N 2.618 -7.509 -1.575 1.00 . A A . 14 ALA N 1 1
8 1549 1 1 14 ALA O O 2.361 -5.607 -4.520 1.00 . A A . 14 ALA O 1 1
8 1550 1 1 15 SER C C 1.561 -8.176 -6.102 1.00 . A A . 15 SER C 1 1
8 1551 1 1 15 SER CA C 3.027 -8.020 -5.710 1.00 . A A . 15 SER CA 1 1
8 1552 1 1 15 SER CB C 3.793 -9.303 -6.037 1.00 . A A . 15 SER CB 1 1
8 1553 1 1 15 SER H H 3.506 -8.379 -3.680 1.00 . A A . 15 SER H 1 1
8 1554 1 1 15 SER HA H 3.453 -7.203 -6.274 1.00 . A A . 15 SER HA 1 1
8 1555 1 1 15 SER HB2 H 4.842 -9.156 -5.828 1.00 . A A . 15 SER HB2 1 1
8 1556 1 1 15 SER HB3 H 3.415 -10.110 -5.427 1.00 . A A . 15 SER HB3 1 1
8 1557 1 1 15 SER HG H 4.207 -10.404 -7.603 1.00 . A A . 15 SER HG 1 1
8 1558 1 1 15 SER N N 3.155 -7.701 -4.293 1.00 . A A . 15 SER N 1 1
8 1559 1 1 15 SER O O 0.984 -7.305 -6.753 1.00 . A A . 15 SER O 1 1
8 1560 1 1 15 SER OG O 3.644 -9.653 -7.402 1.00 . A A . 15 SER OG 1 1
8 1561 1 1 16 CYS C C -1.359 -8.726 -5.132 1.00 . A A . 16 CYS C 1 1
8 1562 1 1 16 CYS CA C -0.435 -9.566 -6.009 1.00 . A A . 16 CYS CA 1 1
8 1563 1 1 16 CYS CB C -0.741 -11.052 -5.813 1.00 . A A . 16 CYS CB 1 1
8 1564 1 1 16 CYS H H 1.476 -9.951 -5.184 1.00 . A A . 16 CYS H 1 1
8 1565 1 1 16 CYS HA H -0.604 -9.306 -7.042 1.00 . A A . 16 CYS HA 1 1
8 1566 1 1 16 CYS HB2 H -0.824 -11.259 -4.756 1.00 . A A . 16 CYS HB2 1 1
8 1567 1 1 16 CYS HB3 H -1.679 -11.285 -6.295 1.00 . A A . 16 CYS HB3 1 1
8 1568 1 1 16 CYS N N 0.964 -9.293 -5.701 1.00 . A A . 16 CYS N 1 1
8 1569 1 1 16 CYS O O -0.943 -8.195 -4.103 1.00 . A A . 16 CYS O 1 1
8 1570 1 1 16 CYS SG S 0.526 -12.169 -6.496 1.00 . A A . 16 CYS SG 1 1
8 1571 1 1 17 ALA C C -4.744 -8.723 -4.320 1.00 . A A . 17 ALA C 1 1
8 1572 1 1 17 ALA CA C -3.600 -7.837 -4.801 1.00 . A A . 17 ALA CA 1 1
8 1573 1 1 17 ALA CB C -4.136 -6.697 -5.656 1.00 . A A . 17 ALA CB 1 1
8 1574 1 1 17 ALA H H -2.888 -9.057 -6.377 1.00 . A A . 17 ALA H 1 1
8 1575 1 1 17 ALA HA H -3.105 -7.408 -3.942 1.00 . A A . 17 ALA HA 1 1
8 1576 1 1 17 ALA HB1 H -3.690 -5.767 -5.334 1.00 . A A . 17 ALA HB1 1 1
8 1577 1 1 17 ALA HB2 H -3.887 -6.877 -6.691 1.00 . A A . 17 ALA HB2 1 1
8 1578 1 1 17 ALA HB3 H -5.208 -6.640 -5.547 1.00 . A A . 17 ALA HB3 1 1
8 1579 1 1 17 ALA N N -2.616 -8.610 -5.548 1.00 . A A . 17 ALA N 1 1
8 1580 1 1 17 ALA O O -5.781 -8.793 -4.979 1.00 . A A . 17 ALA O 1 1
8 1581 1 1 18 ALA C C -6.494 -9.361 -1.700 1.00 . A A . 18 ALA C 1 1
8 1582 1 1 18 ALA CA C -5.527 -10.258 -2.594 1.00 . A A . 18 ALA CA 1 1
8 1583 1 1 18 ALA CB C -4.935 -11.317 -1.740 1.00 . A A . 18 ALA CB 1 1
8 1584 1 1 18 ALA H H -3.681 -9.258 -2.737 1.00 . A A . 18 ALA H 1 1
8 1585 1 1 18 ALA HA H -6.162 -10.655 -3.364 1.00 . A A . 18 ALA HA 1 1
8 1586 1 1 18 ALA HB1 H -4.866 -10.972 -0.718 1.00 . A A . 18 ALA HB1 1 1
8 1587 1 1 18 ALA HB2 H -5.601 -12.166 -1.783 1.00 . A A . 18 ALA HB2 1 1
8 1588 1 1 18 ALA N N -4.541 -9.377 -3.192 1.00 . A A . 18 ALA N 1 1
8 1589 1 1 18 ALA O O -6.092 -8.849 -0.654 1.00 . A A . 18 ALA O 1 1
8 1590 1 1 19 SER C C -8.874 -8.852 -0.013 1.00 . A A . 19 SER C 1 1
8 1591 1 1 19 SER CA C -8.703 -8.371 -1.451 1.00 . A A . 19 SER CA 1 1
8 1592 1 1 19 SER CB C -10.051 -8.402 -2.174 1.00 . A A . 19 SER CB 1 1
8 1593 1 1 19 SER H H -7.989 -9.624 -3.000 1.00 . A A . 19 SER H 1 1
8 1594 1 1 19 SER HA H -8.335 -7.355 -1.437 1.00 . A A . 19 SER HA 1 1
8 1595 1 1 19 SER HB2 H -10.831 -8.106 -1.490 1.00 . A A . 19 SER HB2 1 1
8 1596 1 1 19 SER HB3 H -10.025 -7.716 -3.009 1.00 . A A . 19 SER HB3 1 1
8 1597 1 1 19 SER HG H -11.068 -9.657 -3.283 1.00 . A A . 19 SER HG 1 1
8 1598 1 1 19 SER N N -7.728 -9.190 -2.161 1.00 . A A . 19 SER N 1 1
8 1599 1 1 19 SER O O -9.424 -8.143 0.828 1.00 . A A . 19 SER O 1 1
8 1600 1 1 19 SER OG O -10.339 -9.702 -2.660 1.00 . A A . 19 SER OG 1 1
9 1601 1 1 1 ALA C C 3.520 -0.495 0.840 1.00 . A A . 1 ALA C 1 1
9 1602 1 1 1 ALA CA C 2.183 0.160 1.170 1.00 . A A . 1 ALA CA 1 1
9 1603 1 1 1 ALA CB C 2.023 1.458 0.393 1.00 . A A . 1 ALA CB 1 1
9 1604 1 1 1 ALA H1 H 1.861 1.315 2.913 1.00 . A A . 1 ALA H1 1 1
9 1605 1 1 1 ALA HA H 1.385 -0.507 0.876 1.00 . A A . 1 ALA HA 1 1
9 1606 1 1 1 ALA HB1 H 2.634 2.226 0.848 1.00 . A A . 1 ALA HB1 1 1
9 1607 1 1 1 ALA HB2 H 2.337 1.307 -0.629 1.00 . A A . 1 ALA HB2 1 1
9 1608 1 1 1 ALA HB3 H 0.988 1.764 0.412 1.00 . A A . 1 ALA HB3 1 1
9 1609 1 1 1 ALA N N 2.059 0.408 2.601 1.00 . A A . 1 ALA N 1 1
9 1610 1 1 1 ALA O O 4.514 -0.286 1.537 1.00 . A A . 1 ALA O 1 1
9 1611 1 1 2 CYS C C 5.494 -1.169 -1.707 1.00 . A A . 2 CYS C 1 1
9 1612 1 1 2 CYS CA C 4.752 -1.977 -0.647 1.00 . A A . 2 CYS CA 1 1
9 1613 1 1 2 CYS CB C 4.414 -3.366 -1.192 1.00 . A A . 2 CYS CB 1 1
9 1614 1 1 2 CYS H H 2.713 -1.417 -0.740 1.00 . A A . 2 CYS H 1 1
9 1615 1 1 2 CYS HA H 5.390 -2.085 0.218 1.00 . A A . 2 CYS HA 1 1
9 1616 1 1 2 CYS HB2 H 3.519 -3.726 -0.706 1.00 . A A . 2 CYS HB2 1 1
9 1617 1 1 2 CYS HB3 H 4.236 -3.293 -2.255 1.00 . A A . 2 CYS HB3 1 1
9 1618 1 1 2 CYS N N 3.538 -1.289 -0.225 1.00 . A A . 2 CYS N 1 1
9 1619 1 1 2 CYS O O 4.896 -0.364 -2.420 1.00 . A A . 2 CYS O 1 1
9 1620 1 1 2 CYS SG S 5.722 -4.606 -0.931 1.00 . A A . 2 CYS SG 1 1
9 1621 1 1 3 GLY C C 7.728 -1.426 -4.091 1.00 . A A . 3 GLY C 1 1
9 1622 1 1 3 GLY CA C 7.604 -0.675 -2.780 1.00 . A A . 3 GLY CA 1 1
9 1623 1 1 3 GLY H H 7.225 -2.044 -1.209 1.00 . A A . 3 GLY H 1 1
9 1624 1 1 3 GLY HA2 H 7.150 0.286 -2.969 1.00 . A A . 3 GLY HA2 1 1
9 1625 1 1 3 GLY HA3 H 8.592 -0.521 -2.372 1.00 . A A . 3 GLY HA3 1 1
9 1626 1 1 3 GLY N N 6.802 -1.390 -1.805 1.00 . A A . 3 GLY N 1 1
9 1627 1 1 3 GLY O O 8.056 -0.851 -5.129 1.00 . A A . 3 GLY O 1 1
9 1628 1 1 4 . C C 8.955 -3.419 -5.943 1.00 . A A . 4 DBB C 1 1
9 1629 1 1 4 . CA C 7.573 -3.506 -5.271 1.00 . A A . 4 DBB CA 1 1
9 1630 1 1 4 . CB C 7.192 -4.963 -4.941 1.00 . A A . 4 DBB CB 1 1
9 1631 1 1 4 . CG C 7.077 -5.764 -6.228 1.00 . A A . 4 DBB CG 1 1
9 1632 1 1 4 . H H 7.208 -3.146 -3.205 1.00 . A A . 4 DBB H 1 1
9 1633 1 1 4 . HA H 6.842 -3.133 -5.960 1.00 . A A . 4 DBB HA 1 1
9 1634 1 1 4 . HB2 H 6.213 -4.912 -4.514 1.00 . A A . 4 DBB HB2 1 1
9 1635 1 1 4 . HG1 H 8.069 -6.012 -6.573 1.00 . A A . 4 DBB HG1 1 1
9 1636 1 1 4 . HG2 H 6.570 -5.174 -6.976 1.00 . A A . 4 DBB HG2 1 1
9 1637 1 1 4 . HG3 H 6.523 -6.669 -6.040 1.00 . A A . 4 DBB HG3 1 1
9 1638 1 1 4 . N N 7.468 -2.719 -4.052 1.00 . A A . 4 DBB N 1 1
9 1639 1 1 4 . O O 9.011 -3.085 -7.126 1.00 . A A . 4 DBB O 1 1
9 1640 1 1 5 GLY C C 11.575 -4.463 -6.959 1.00 . A A . 5 GLY C 1 1
9 1641 1 1 5 GLY CA C 11.364 -3.537 -5.778 1.00 . A A . 5 GLY CA 1 1
9 1642 1 1 5 GLY H H 9.930 -3.922 -4.269 1.00 . A A . 5 GLY H 1 1
9 1643 1 1 5 GLY HA2 H 11.513 -2.517 -6.102 1.00 . A A . 5 GLY HA2 1 1
9 1644 1 1 5 GLY HA3 H 12.094 -3.772 -5.017 1.00 . A A . 5 GLY HA3 1 1
9 1645 1 1 5 GLY N N 10.036 -3.659 -5.207 1.00 . A A . 5 GLY N 1 1
9 1646 1 1 5 GLY O O 11.127 -4.243 -8.081 1.00 . A A . 5 GLY O 1 1
9 1647 1 1 6 . C C 11.270 -7.492 -7.919 1.00 . A A . 6 IAS C 1 1
9 1648 1 1 6 . CA C 12.468 -6.571 -7.767 1.00 . A A . 6 IAS CA 1 1
9 1649 1 1 6 . CB C 13.765 -7.388 -7.619 1.00 . A A . 6 IAS CB 1 1
9 1650 1 1 6 . CG C 13.919 -8.036 -6.250 1.00 . A A . 6 IAS CG 1 1
9 1651 1 1 6 . H H 12.666 -5.760 -5.820 1.00 . A A . 6 IAS H 1 1
9 1652 1 1 6 . HA H 12.501 -6.044 -8.713 1.00 . A A . 6 IAS HA 1 1
9 1653 1 1 6 . HB2 H 14.600 -6.712 -7.726 1.00 . A A . 6 IAS HB2 1 1
9 1654 1 1 6 . HB3 H 13.801 -8.130 -8.402 1.00 . A A . 6 IAS HB3 1 1
9 1655 1 1 6 . HXT H 11.015 -8.828 -9.289 1.00 . A A . 6 IAS HXT 1 1
9 1656 1 1 6 . N N 12.298 -5.571 -6.727 1.00 . A A . 6 IAS N 1 1
9 1657 1 1 6 . O O 10.626 -7.931 -7.001 1.00 . A A . 6 IAS O 1 1
9 1658 1 1 6 . OD1 O 14.783 -7.666 -5.455 1.00 . A A . 6 IAS OD1 1 1
9 1659 1 1 6 . OXT O 11.091 -7.867 -9.195 1.00 . A A . 6 IAS OXT 1 1
9 1660 1 1 7 GLY C C 11.964 -9.353 -3.803 1.00 . A A . 7 GLY C 1 1
9 1661 1 1 7 GLY CA C 13.115 -9.724 -4.716 1.00 . A A . 7 GLY CA 1 1
9 1662 1 1 7 GLY H H 12.398 -9.273 -6.657 1.00 . A A . 7 GLY H 1 1
9 1663 1 1 7 GLY HA2 H 13.084 -10.786 -4.904 1.00 . A A . 7 GLY HA2 1 1
9 1664 1 1 7 GLY HA3 H 14.044 -9.483 -4.220 1.00 . A A . 7 GLY HA3 1 1
9 1665 1 1 7 GLY N N 13.066 -9.021 -5.985 1.00 . A A . 7 GLY N 1 1
9 1666 1 1 7 GLY O O 11.806 -9.928 -2.725 1.00 . A A . 7 GLY O 1 1
9 1667 1 1 8 CYS C C 9.139 -9.120 -3.035 1.00 . A A . 8 CYS C 1 1
9 1668 1 1 8 CYS CA C 10.014 -7.939 -3.446 1.00 . A A . 8 CYS CA 1 1
9 1669 1 1 8 CYS CB C 9.186 -6.929 -4.242 1.00 . A A . 8 CYS CB 1 1
9 1670 1 1 8 CYS H H 11.334 -7.968 -5.101 1.00 . A A . 8 CYS H 1 1
9 1671 1 1 8 CYS HA H 10.392 -7.460 -2.556 1.00 . A A . 8 CYS HA 1 1
9 1672 1 1 8 CYS HB2 H 9.850 -6.327 -4.846 1.00 . A A . 8 CYS HB2 1 1
9 1673 1 1 8 CYS HB3 H 8.505 -7.463 -4.889 1.00 . A A . 8 CYS HB3 1 1
9 1674 1 1 8 CYS N N 11.157 -8.389 -4.233 1.00 . A A . 8 CYS N 1 1
9 1675 1 1 8 CYS O O 9.222 -10.200 -3.618 1.00 . A A . 8 CYS O 1 1
9 1676 1 1 8 CYS SG S 8.200 -5.798 -3.209 1.00 . A A . 8 CYS SG 1 1
9 1677 1 1 9 ALA C C 6.544 -10.503 -2.665 1.00 . A A . 9 ALA C 1 1
9 1678 1 1 9 ALA CA C 7.409 -9.949 -1.538 1.00 . A A . 9 ALA CA 1 1
9 1679 1 1 9 ALA CB C 6.536 -9.414 -0.413 1.00 . A A . 9 ALA CB 1 1
9 1680 1 1 9 ALA H H 8.282 -8.022 -1.601 1.00 . A A . 9 ALA H 1 1
9 1681 1 1 9 ALA HA H 8.018 -10.748 -1.139 1.00 . A A . 9 ALA HA 1 1
9 1682 1 1 9 ALA HB1 H 7.083 -8.665 0.142 1.00 . A A . 9 ALA HB1 1 1
9 1683 1 1 9 ALA HB2 H 5.643 -8.972 -0.830 1.00 . A A . 9 ALA HB2 1 1
9 1684 1 1 9 ALA HB3 H 6.263 -10.223 0.247 1.00 . A A . 9 ALA HB3 1 1
9 1685 1 1 9 ALA N N 8.301 -8.905 -2.026 1.00 . A A . 9 ALA N 1 1
9 1686 1 1 9 ALA O O 6.359 -9.855 -3.695 1.00 . A A . 9 ALA O 1 1
9 1687 1 1 10 LYS C C 3.738 -12.485 -2.953 1.00 . A A . 10 LYS C 1 1
9 1688 1 1 10 LYS CA C 5.169 -12.347 -3.461 1.00 . A A . 10 LYS CA 1 1
9 1689 1 1 10 LYS CB C 5.728 -13.725 -3.824 1.00 . A A . 10 LYS CB 1 1
9 1690 1 1 10 LYS CD C 5.144 -14.877 -1.669 1.00 . A A . 10 LYS CD 1 1
9 1691 1 1 10 LYS CE C 5.490 -16.129 -0.878 1.00 . A A . 10 LYS CE 1 1
9 1692 1 1 10 LYS CG C 6.259 -14.499 -2.630 1.00 . A A . 10 LYS CG 1 1
9 1693 1 1 10 LYS H H 6.200 -12.172 -1.620 1.00 . A A . 10 LYS H 1 1
9 1694 1 1 10 LYS HA H 5.167 -11.725 -4.343 1.00 . A A . 10 LYS HA 1 1
9 1695 1 1 10 LYS HB2 H 4.944 -14.308 -4.285 1.00 . A A . 10 LYS HB2 1 1
9 1696 1 1 10 LYS HB3 H 6.534 -13.598 -4.531 1.00 . A A . 10 LYS HB3 1 1
9 1697 1 1 10 LYS HD2 H 4.984 -14.061 -0.979 1.00 . A A . 10 LYS HD2 1 1
9 1698 1 1 10 LYS HD3 H 4.240 -15.056 -2.233 1.00 . A A . 10 LYS HD3 1 1
9 1699 1 1 10 LYS HE2 H 5.530 -16.967 -1.556 1.00 . A A . 10 LYS HE2 1 1
9 1700 1 1 10 LYS HE3 H 6.457 -15.991 -0.417 1.00 . A A . 10 LYS HE3 1 1
9 1701 1 1 10 LYS HG2 H 6.737 -15.402 -2.981 1.00 . A A . 10 LYS HG2 1 1
9 1702 1 1 10 LYS HG3 H 6.980 -13.887 -2.107 1.00 . A A . 10 LYS HG3 1 1
9 1703 1 1 10 LYS HZ1 H 4.914 -16.975 0.943 1.00 . A A . 10 LYS HZ1 1 1
9 1704 1 1 10 LYS HZ2 H 3.683 -16.941 -0.216 1.00 . A A . 10 LYS HZ2 1 1
9 1705 1 1 10 LYS HZ3 H 4.128 -15.519 0.585 1.00 . A A . 10 LYS HZ3 1 1
9 1706 1 1 10 LYS N N 6.016 -11.705 -2.463 1.00 . A A . 10 LYS N 1 1
9 1707 1 1 10 LYS NZ N 4.483 -16.410 0.183 1.00 . A A . 10 LYS NZ 1 1
9 1708 1 1 10 LYS O O 3.438 -12.200 -1.792 1.00 . A A . 10 LYS O 1 1
9 1709 1 1 11 . C C 0.860 -11.809 -2.787 1.00 . A A . 11 DBB C 1 1
9 1710 1 1 11 . CA C 1.463 -13.079 -3.414 1.00 . A A . 11 DBB CA 1 1
9 1711 1 1 11 . CB C 0.648 -13.554 -4.633 1.00 . A A . 11 DBB CB 1 1
9 1712 1 1 11 . CG C -0.755 -13.936 -4.191 1.00 . A A . 11 DBB CG 1 1
9 1713 1 1 11 . H H 3.124 -13.143 -4.743 1.00 . A A . 11 DBB H 1 1
9 1714 1 1 11 . HA H 1.428 -13.862 -2.682 1.00 . A A . 11 DBB HA 1 1
9 1715 1 1 11 . HB2 H 1.128 -14.449 -4.966 1.00 . A A . 11 DBB HB2 1 1
9 1716 1 1 11 . HG1 H -1.282 -14.363 -5.032 1.00 . A A . 11 DBB HG1 1 1
9 1717 1 1 11 . HG2 H -1.278 -13.056 -3.846 1.00 . A A . 11 DBB HG2 1 1
9 1718 1 1 11 . HG3 H -0.697 -14.661 -3.396 1.00 . A A . 11 DBB HG3 1 1
9 1719 1 1 11 . N N 2.850 -12.925 -3.823 1.00 . A A . 11 DBB N 1 1
9 1720 1 1 11 . O O 1.242 -10.713 -3.199 1.00 . A A . 11 DBB O 1 1
9 1721 1 1 12 CYS C C 0.158 -10.134 -0.217 1.00 . A A . 12 CYS C 1 1
9 1722 1 1 12 CYS CA C -0.740 -10.788 -1.263 1.00 . A A . 12 CYS CA 1 1
9 1723 1 1 12 CYS CB C -2.067 -11.203 -0.625 1.00 . A A . 12 CYS CB 1 1
9 1724 1 1 12 CYS H H -0.345 -12.845 -1.574 1.00 . A A . 12 CYS H 1 1
9 1725 1 1 12 CYS HA H -0.935 -10.074 -2.049 1.00 . A A . 12 CYS HA 1 1
9 1726 1 1 12 CYS HB2 H -2.640 -11.772 -1.342 1.00 . A A . 12 CYS HB2 1 1
9 1727 1 1 12 CYS HB3 H -1.865 -11.820 0.238 1.00 . A A . 12 CYS HB3 1 1
9 1728 1 1 12 CYS N N -0.083 -11.944 -1.862 1.00 . A A . 12 CYS N 1 1
9 1729 1 1 12 CYS O O -0.208 -10.031 0.953 1.00 . A A . 12 CYS O 1 1
9 1730 1 1 12 CYS SG S -3.098 -9.804 -0.078 1.00 . A A . 12 CYS SG 1 1
9 1731 1 1 13 ALA C C 2.749 -7.708 -0.313 1.00 . A A . 13 ALA C 1 1
9 1732 1 1 13 ALA CA C 2.285 -9.047 0.249 1.00 . A A . 13 ALA CA 1 1
9 1733 1 1 13 ALA CB C 3.478 -9.958 0.501 1.00 . A A . 13 ALA CB 1 1
9 1734 1 1 13 ALA H H 1.571 -9.804 -1.593 1.00 . A A . 13 ALA H 1 1
9 1735 1 1 13 ALA HA H 1.788 -8.877 1.194 1.00 . A A . 13 ALA HA 1 1
9 1736 1 1 13 ALA HB1 H 3.166 -10.801 1.101 1.00 . A A . 13 ALA HB1 1 1
9 1737 1 1 13 ALA HB2 H 3.866 -10.311 -0.443 1.00 . A A . 13 ALA HB2 1 1
9 1738 1 1 13 ALA HB3 H 4.246 -9.408 1.023 1.00 . A A . 13 ALA HB3 1 1
9 1739 1 1 13 ALA N N 1.336 -9.693 -0.648 1.00 . A A . 13 ALA N 1 1
9 1740 1 1 13 ALA O O 2.957 -6.764 0.448 1.00 . A A . 13 ALA O 1 1
9 1741 1 1 14 ALA C C 3.165 -6.714 -3.881 1.00 . A A . 14 ALA C 1 1
9 1742 1 1 14 ALA CA C 3.332 -6.449 -2.319 1.00 . A A . 14 ALA CA 1 1
9 1743 1 1 14 ALA CB C 4.744 -6.081 -2.047 1.00 . A A . 14 ALA CB 1 1
9 1744 1 1 14 ALA H H 2.712 -8.453 -2.148 1.00 . A A . 14 ALA H 1 1
9 1745 1 1 14 ALA HA H 2.649 -5.649 -2.105 1.00 . A A . 14 ALA HA 1 1
9 1746 1 1 14 ALA HB1 H 5.269 -6.922 -1.619 1.00 . A A . 14 ALA HB1 1 1
9 1747 1 1 14 ALA HB2 H 5.192 -5.830 -2.997 1.00 . A A . 14 ALA HB2 1 1
9 1748 1 1 14 ALA N N 2.902 -7.648 -1.623 1.00 . A A . 14 ALA N 1 1
9 1749 1 1 14 ALA O O 2.747 -5.830 -4.630 1.00 . A A . 14 ALA O 1 1
9 1750 1 1 15 SER C C 1.985 -8.408 -6.169 1.00 . A A . 15 SER C 1 1
9 1751 1 1 15 SER CA C 3.438 -8.282 -5.723 1.00 . A A . 15 SER CA 1 1
9 1752 1 1 15 SER CB C 4.177 -9.597 -5.977 1.00 . A A . 15 SER CB 1 1
9 1753 1 1 15 SER H H 3.844 -8.582 -3.667 1.00 . A A . 15 SER H 1 1
9 1754 1 1 15 SER HA H 3.911 -7.497 -6.294 1.00 . A A . 15 SER HA 1 1
9 1755 1 1 15 SER HB2 H 4.098 -10.226 -5.103 1.00 . A A . 15 SER HB2 1 1
9 1756 1 1 15 SER HB3 H 3.733 -10.099 -6.824 1.00 . A A . 15 SER HB3 1 1
9 1757 1 1 15 SER HG H 5.971 -10.195 -6.489 1.00 . A A . 15 SER HG 1 1
9 1758 1 1 15 SER N N 3.518 -7.920 -4.313 1.00 . A A . 15 SER N 1 1
9 1759 1 1 15 SER O O 1.480 -7.576 -6.924 1.00 . A A . 15 SER O 1 1
9 1760 1 1 15 SER OG O 5.549 -9.367 -6.250 1.00 . A A . 15 SER OG 1 1
9 1761 1 1 16 CYS C C -1.005 -8.795 -5.230 1.00 . A A . 16 CYS C 1 1
9 1762 1 1 16 CYS CA C -0.079 -9.693 -6.046 1.00 . A A . 16 CYS CA 1 1
9 1763 1 1 16 CYS CB C -0.441 -11.161 -5.816 1.00 . A A . 16 CYS CB 1 1
9 1764 1 1 16 CYS H H 1.773 -10.084 -5.099 1.00 . A A . 16 CYS H 1 1
9 1765 1 1 16 CYS HA H -0.204 -9.460 -7.093 1.00 . A A . 16 CYS HA 1 1
9 1766 1 1 16 CYS HB2 H -0.567 -11.331 -4.756 1.00 . A A . 16 CYS HB2 1 1
9 1767 1 1 16 CYS HB3 H -1.370 -11.379 -6.322 1.00 . A A . 16 CYS HB3 1 1
9 1768 1 1 16 CYS N N 1.316 -9.455 -5.697 1.00 . A A . 16 CYS N 1 1
9 1769 1 1 16 CYS O O -0.673 -8.394 -4.115 1.00 . A A . 16 CYS O 1 1
9 1770 1 1 16 CYS SG S 0.810 -12.339 -6.420 1.00 . A A . 16 CYS SG 1 1
9 1771 1 1 17 ALA C C -4.295 -8.463 -4.561 1.00 . A A . 17 ALA C 1 1
9 1772 1 1 17 ALA CA C -3.142 -7.636 -5.119 1.00 . A A . 17 ALA CA 1 1
9 1773 1 1 17 ALA CB C -3.665 -6.572 -6.072 1.00 . A A . 17 ALA CB 1 1
9 1774 1 1 17 ALA H H -2.375 -8.834 -6.686 1.00 . A A . 17 ALA H 1 1
9 1775 1 1 17 ALA HA H -2.641 -7.138 -4.301 1.00 . A A . 17 ALA HA 1 1
9 1776 1 1 17 ALA HB1 H -3.146 -5.641 -5.890 1.00 . A A . 17 ALA HB1 1 1
9 1777 1 1 17 ALA HB2 H -3.496 -6.886 -7.091 1.00 . A A . 17 ALA HB2 1 1
9 1778 1 1 17 ALA HB3 H -4.723 -6.432 -5.908 1.00 . A A . 17 ALA HB3 1 1
9 1779 1 1 17 ALA N N -2.167 -8.484 -5.794 1.00 . A A . 17 ALA N 1 1
9 1780 1 1 17 ALA O O -5.347 -8.549 -5.194 1.00 . A A . 17 ALA O 1 1
9 1781 1 1 18 ALA C C -6.430 -9.032 -2.671 1.00 . A A . 18 ALA C 1 1
9 1782 1 1 18 ALA CA C -5.076 -9.870 -2.728 1.00 . A A . 18 ALA CA 1 1
9 1783 1 1 18 ALA CB C -4.693 -10.250 -1.345 1.00 . A A . 18 ALA CB 1 1
9 1784 1 1 18 ALA H H -3.211 -8.924 -2.969 1.00 . A A . 18 ALA H 1 1
9 1785 1 1 18 ALA HA H -5.309 -10.720 -3.341 1.00 . A A . 18 ALA HA 1 1
9 1786 1 1 18 ALA HB1 H -5.479 -9.978 -0.656 1.00 . A A . 18 ALA HB1 1 1
9 1787 1 1 18 ALA HB2 H -4.570 -11.323 -1.337 1.00 . A A . 18 ALA HB2 1 1
9 1788 1 1 18 ALA N N -4.082 -9.051 -3.399 1.00 . A A . 18 ALA N 1 1
9 1789 1 1 18 ALA O O -6.564 -8.102 -1.876 1.00 . A A . 18 ALA O 1 1
9 1790 1 1 19 SER C C -9.549 -9.073 -2.434 1.00 . A A . 19 SER C 1 1
9 1791 1 1 19 SER CA C -8.651 -8.684 -3.605 1.00 . A A . 19 SER CA 1 1
9 1792 1 1 19 SER CB C -9.356 -8.991 -4.927 1.00 . A A . 19 SER CB 1 1
9 1793 1 1 19 SER H H -7.209 -10.137 -4.145 1.00 . A A . 19 SER H 1 1
9 1794 1 1 19 SER HA H -8.449 -7.624 -3.552 1.00 . A A . 19 SER HA 1 1
9 1795 1 1 19 SER HB2 H -10.000 -9.848 -4.799 1.00 . A A . 19 SER HB2 1 1
9 1796 1 1 19 SER HB3 H -9.948 -8.137 -5.223 1.00 . A A . 19 SER HB3 1 1
9 1797 1 1 19 SER HG H -8.147 -10.193 -5.892 1.00 . A A . 19 SER HG 1 1
9 1798 1 1 19 SER N N -7.375 -9.386 -3.536 1.00 . A A . 19 SER N 1 1
9 1799 1 1 19 SER O O -9.921 -10.236 -2.285 1.00 . A A . 19 SER O 1 1
9 1800 1 1 19 SER OG O -8.418 -9.274 -5.951 1.00 . A A . 19 SER OG 1 1
10 1801 1 1 1 ALA C C 5.466 -0.324 0.376 1.00 . A A . 1 ALA C 1 1
10 1802 1 1 1 ALA CA C 4.895 0.730 1.320 1.00 . A A . 1 ALA CA 1 1
10 1803 1 1 1 ALA CB C 5.514 2.090 1.032 1.00 . A A . 1 ALA CB 1 1
10 1804 1 1 1 ALA H1 H 5.639 0.953 3.288 1.00 . A A . 1 ALA H1 1 1
10 1805 1 1 1 ALA HA H 3.830 0.804 1.157 1.00 . A A . 1 ALA HA 1 1
10 1806 1 1 1 ALA HB1 H 4.742 2.845 1.047 1.00 . A A . 1 ALA HB1 1 1
10 1807 1 1 1 ALA HB2 H 6.254 2.315 1.785 1.00 . A A . 1 ALA HB2 1 1
10 1808 1 1 1 ALA HB3 H 5.983 2.073 0.060 1.00 . A A . 1 ALA HB3 1 1
10 1809 1 1 1 ALA N N 5.113 0.360 2.713 1.00 . A A . 1 ALA N 1 1
10 1810 1 1 1 ALA O O 6.670 -0.583 0.375 1.00 . A A . 1 ALA O 1 1
10 1811 1 1 2 CYS C C 4.709 -1.528 -2.805 1.00 . A A . 2 CYS C 1 1
10 1812 1 1 2 CYS CA C 5.013 -1.955 -1.372 1.00 . A A . 2 CYS CA 1 1
10 1813 1 1 2 CYS CB C 4.311 -3.279 -1.063 1.00 . A A . 2 CYS CB 1 1
10 1814 1 1 2 CYS H H 3.648 -0.679 -0.377 1.00 . A A . 2 CYS H 1 1
10 1815 1 1 2 CYS HA H 6.078 -2.090 -1.268 1.00 . A A . 2 CYS HA 1 1
10 1816 1 1 2 CYS HB2 H 3.722 -3.165 -0.165 1.00 . A A . 2 CYS HB2 1 1
10 1817 1 1 2 CYS HB3 H 3.659 -3.533 -1.886 1.00 . A A . 2 CYS HB3 1 1
10 1818 1 1 2 CYS N N 4.596 -0.929 -0.424 1.00 . A A . 2 CYS N 1 1
10 1819 1 1 2 CYS O O 3.805 -0.730 -3.048 1.00 . A A . 2 CYS O 1 1
10 1820 1 1 2 CYS SG S 5.447 -4.680 -0.803 1.00 . A A . 2 CYS SG 1 1
10 1821 1 1 3 GLY C C 6.260 -2.423 -6.062 1.00 . A A . 3 GLY C 1 1
10 1822 1 1 3 GLY CA C 5.269 -1.730 -5.149 1.00 . A A . 3 GLY CA 1 1
10 1823 1 1 3 GLY H H 6.178 -2.697 -3.499 1.00 . A A . 3 GLY H 1 1
10 1824 1 1 3 GLY HA2 H 4.269 -2.018 -5.436 1.00 . A A . 3 GLY HA2 1 1
10 1825 1 1 3 GLY HA3 H 5.373 -0.661 -5.268 1.00 . A A . 3 GLY HA3 1 1
10 1826 1 1 3 GLY N N 5.472 -2.067 -3.752 1.00 . A A . 3 GLY N 1 1
10 1827 1 1 3 GLY O O 6.852 -1.806 -6.949 1.00 . A A . 3 GLY O 1 1
10 1828 1 1 4 . C C 8.830 -3.893 -6.613 1.00 . A A . 4 DBB C 1 1
10 1829 1 1 4 . CA C 7.393 -4.440 -6.684 1.00 . A A . 4 DBB CA 1 1
10 1830 1 1 4 . CB C 7.332 -5.931 -6.294 1.00 . A A . 4 DBB CB 1 1
10 1831 1 1 4 . CG C 8.137 -6.752 -7.288 1.00 . A A . 4 DBB CG 1 1
10 1832 1 1 4 . H H 5.961 -4.172 -5.133 1.00 . A A . 4 DBB H 1 1
10 1833 1 1 4 . HA H 7.055 -4.362 -7.698 1.00 . A A . 4 DBB HA 1 1
10 1834 1 1 4 . HB2 H 6.308 -6.213 -6.409 1.00 . A A . 4 DBB HB2 1 1
10 1835 1 1 4 . HG1 H 8.411 -7.688 -6.826 1.00 . A A . 4 DBB HG1 1 1
10 1836 1 1 4 . HG2 H 9.029 -6.210 -7.565 1.00 . A A . 4 DBB HG2 1 1
10 1837 1 1 4 . HG3 H 7.539 -6.942 -8.165 1.00 . A A . 4 DBB HG3 1 1
10 1838 1 1 4 . N N 6.451 -3.711 -5.851 1.00 . A A . 4 DBB N 1 1
10 1839 1 1 4 . O O 9.432 -3.687 -7.666 1.00 . A A . 4 DBB O 1 1
10 1840 1 1 5 GLY C C 11.728 -3.878 -6.010 1.00 . A A . 5 GLY C 1 1
10 1841 1 1 5 GLY CA C 10.677 -3.049 -5.299 1.00 . A A . 5 GLY CA 1 1
10 1842 1 1 5 GLY H H 8.821 -3.803 -4.613 1.00 . A A . 5 GLY H 1 1
10 1843 1 1 5 GLY HA2 H 10.670 -2.055 -5.721 1.00 . A A . 5 GLY HA2 1 1
10 1844 1 1 5 GLY HA3 H 10.935 -2.983 -4.252 1.00 . A A . 5 GLY HA3 1 1
10 1845 1 1 5 GLY N N 9.347 -3.618 -5.419 1.00 . A A . 5 GLY N 1 1
10 1846 1 1 5 GLY O O 12.194 -3.584 -7.107 1.00 . A A . 5 GLY O 1 1
10 1847 1 1 6 . C C 12.371 -7.055 -6.701 1.00 . A A . 6 IAS C 1 1
10 1848 1 1 6 . CA C 13.076 -5.897 -6.017 1.00 . A A . 6 IAS CA 1 1
10 1849 1 1 6 . CB C 14.175 -6.414 -5.071 1.00 . A A . 6 IAS CB 1 1
10 1850 1 1 6 . CG C 13.631 -7.019 -3.783 1.00 . A A . 6 IAS CG 1 1
10 1851 1 1 6 . H H 11.776 -5.231 -4.482 1.00 . A A . 6 IAS H 1 1
10 1852 1 1 6 . HA H 13.548 -5.353 -6.826 1.00 . A A . 6 IAS HA 1 1
10 1853 1 1 6 . HB2 H 14.782 -5.572 -4.772 1.00 . A A . 6 IAS HB2 1 1
10 1854 1 1 6 . HB3 H 14.786 -7.127 -5.602 1.00 . A A . 6 IAS HB3 1 1
10 1855 1 1 6 . HXT H 11.892 -6.828 -8.557 1.00 . A A . 6 IAS HXT 1 1
10 1856 1 1 6 . N N 12.147 -4.984 -5.373 1.00 . A A . 6 IAS N 1 1
10 1857 1 1 6 . O O 11.736 -7.903 -6.127 1.00 . A A . 6 IAS O 1 1
10 1858 1 1 6 . OD1 O 13.246 -6.314 -2.852 1.00 . A A . 6 IAS OD1 1 1
10 1859 1 1 6 . OXT O 12.647 -7.099 -8.013 1.00 . A A . 6 IAS OXT 1 1
10 1860 1 1 7 GLY C C 11.689 -8.681 -2.231 1.00 . A A . 7 GLY C 1 1
10 1861 1 1 7 GLY CA C 13.121 -9.046 -2.567 1.00 . A A . 7 GLY CA 1 1
10 1862 1 1 7 GLY H H 13.930 -8.858 -4.515 1.00 . A A . 7 GLY H 1 1
10 1863 1 1 7 GLY HA2 H 13.180 -10.109 -2.743 1.00 . A A . 7 GLY HA2 1 1
10 1864 1 1 7 GLY HA3 H 13.751 -8.795 -1.725 1.00 . A A . 7 GLY HA3 1 1
10 1865 1 1 7 GLY N N 13.610 -8.348 -3.742 1.00 . A A . 7 GLY N 1 1
10 1866 1 1 7 GLY O O 11.237 -8.885 -1.103 1.00 . A A . 7 GLY O 1 1
10 1867 1 1 8 CYS C C 8.769 -8.891 -2.422 1.00 . A A . 8 CYS C 1 1
10 1868 1 1 8 CYS CA C 9.583 -7.744 -3.013 1.00 . A A . 8 CYS CA 1 1
10 1869 1 1 8 CYS CB C 8.966 -7.295 -4.339 1.00 . A A . 8 CYS CB 1 1
10 1870 1 1 8 CYS H H 11.388 -8.002 -4.087 1.00 . A A . 8 CYS H 1 1
10 1871 1 1 8 CYS HA H 9.569 -6.916 -2.321 1.00 . A A . 8 CYS HA 1 1
10 1872 1 1 8 CYS HB2 H 9.689 -6.705 -4.883 1.00 . A A . 8 CYS HB2 1 1
10 1873 1 1 8 CYS HB3 H 8.710 -8.168 -4.921 1.00 . A A . 8 CYS HB3 1 1
10 1874 1 1 8 CYS N N 10.972 -8.140 -3.210 1.00 . A A . 8 CYS N 1 1
10 1875 1 1 8 CYS O O 9.055 -10.062 -2.673 1.00 . A A . 8 CYS O 1 1
10 1876 1 1 8 CYS SG S 7.459 -6.288 -4.154 1.00 . A A . 8 CYS SG 1 1
10 1877 1 1 9 ALA C C 6.101 -10.319 -2.060 1.00 . A A . 9 ALA C 1 1
10 1878 1 1 9 ALA CA C 6.897 -9.547 -1.013 1.00 . A A . 9 ALA CA 1 1
10 1879 1 1 9 ALA CB C 5.957 -8.888 -0.014 1.00 . A A . 9 ALA CB 1 1
10 1880 1 1 9 ALA H H 7.576 -7.597 -1.475 1.00 . A A . 9 ALA H 1 1
10 1881 1 1 9 ALA HA H 7.529 -10.238 -0.474 1.00 . A A . 9 ALA HA 1 1
10 1882 1 1 9 ALA HB1 H 5.006 -8.697 -0.488 1.00 . A A . 9 ALA HB1 1 1
10 1883 1 1 9 ALA HB2 H 5.814 -9.544 0.832 1.00 . A A . 9 ALA HB2 1 1
10 1884 1 1 9 ALA HB3 H 6.386 -7.956 0.322 1.00 . A A . 9 ALA HB3 1 1
10 1885 1 1 9 ALA N N 7.754 -8.547 -1.637 1.00 . A A . 9 ALA N 1 1
10 1886 1 1 9 ALA O O 5.648 -9.751 -3.054 1.00 . A A . 9 ALA O 1 1
10 1887 1 1 10 LYS C C 3.742 -12.620 -2.309 1.00 . A A . 10 LYS C 1 1
10 1888 1 1 10 LYS CA C 5.193 -12.468 -2.755 1.00 . A A . 10 LYS CA 1 1
10 1889 1 1 10 LYS CB C 5.854 -13.844 -2.855 1.00 . A A . 10 LYS CB 1 1
10 1890 1 1 10 LYS CD C 4.794 -15.525 -4.392 1.00 . A A . 10 LYS CD 1 1
10 1891 1 1 10 LYS CE C 5.227 -16.586 -5.392 1.00 . A A . 10 LYS CE 1 1
10 1892 1 1 10 LYS CG C 5.836 -14.427 -4.257 1.00 . A A . 10 LYS CG 1 1
10 1893 1 1 10 LYS H H 6.319 -12.013 -1.021 1.00 . A A . 10 LYS H 1 1
10 1894 1 1 10 LYS HA H 5.211 -11.998 -3.726 1.00 . A A . 10 LYS HA 1 1
10 1895 1 1 10 LYS HB2 H 6.882 -13.761 -2.535 1.00 . A A . 10 LYS HB2 1 1
10 1896 1 1 10 LYS HB3 H 5.336 -14.528 -2.197 1.00 . A A . 10 LYS HB3 1 1
10 1897 1 1 10 LYS HD2 H 4.650 -15.993 -3.429 1.00 . A A . 10 LYS HD2 1 1
10 1898 1 1 10 LYS HD3 H 3.863 -15.088 -4.724 1.00 . A A . 10 LYS HD3 1 1
10 1899 1 1 10 LYS HE2 H 4.347 -17.044 -5.815 1.00 . A A . 10 LYS HE2 1 1
10 1900 1 1 10 LYS HE3 H 5.798 -16.110 -6.176 1.00 . A A . 10 LYS HE3 1 1
10 1901 1 1 10 LYS HG2 H 5.607 -13.641 -4.961 1.00 . A A . 10 LYS HG2 1 1
10 1902 1 1 10 LYS HG3 H 6.810 -14.839 -4.479 1.00 . A A . 10 LYS HG3 1 1
10 1903 1 1 10 LYS HZ1 H 5.805 -18.576 -5.129 1.00 . A A . 10 LYS HZ1 1 1
10 1904 1 1 10 LYS HZ2 H 5.918 -17.639 -3.726 1.00 . A A . 10 LYS HZ2 1 1
10 1905 1 1 10 LYS HZ3 H 7.070 -17.466 -4.952 1.00 . A A . 10 LYS HZ3 1 1
10 1906 1 1 10 LYS N N 5.934 -11.617 -1.832 1.00 . A A . 10 LYS N 1 1
10 1907 1 1 10 LYS NZ N 6.064 -17.640 -4.755 1.00 . A A . 10 LYS NZ 1 1
10 1908 1 1 10 LYS O O 3.398 -12.377 -1.152 1.00 . A A . 10 LYS O 1 1
10 1909 1 1 11 . C C 0.853 -11.931 -2.263 1.00 . A A . 11 DBB C 1 1
10 1910 1 1 11 . CA C 1.487 -13.190 -2.881 1.00 . A A . 11 DBB CA 1 1
10 1911 1 1 11 . CB C 0.725 -13.652 -4.140 1.00 . A A . 11 DBB CB 1 1
10 1912 1 1 11 . CG C -0.693 -14.045 -3.762 1.00 . A A . 11 DBB CG 1 1
10 1913 1 1 11 . H H 3.199 -13.211 -4.144 1.00 . A A . 11 DBB H 1 1
10 1914 1 1 11 . HA H 1.424 -13.983 -2.162 1.00 . A A . 11 DBB HA 1 1
10 1915 1 1 11 . HB2 H 1.223 -14.540 -4.464 1.00 . A A . 11 DBB HB2 1 1
10 1916 1 1 11 . HG1 H -0.669 -14.583 -2.827 1.00 . A A . 11 DBB HG1 1 1
10 1917 1 1 11 . HG2 H -1.110 -14.677 -4.532 1.00 . A A . 11 DBB HG2 1 1
10 1918 1 1 11 . HG3 H -1.296 -13.158 -3.653 1.00 . A A . 11 DBB HG3 1 1
10 1919 1 1 11 . N N 2.889 -13.025 -3.229 1.00 . A A . 11 DBB N 1 1
10 1920 1 1 11 . O O 1.344 -10.835 -2.532 1.00 . A A . 11 DBB O 1 1
10 1921 1 1 12 CYS C C -0.032 -10.215 0.094 1.00 . A A . 12 CYS C 1 1
10 1922 1 1 12 CYS CA C -0.916 -10.922 -0.930 1.00 . A A . 12 CYS CA 1 1
10 1923 1 1 12 CYS CB C -2.226 -11.360 -0.272 1.00 . A A . 12 CYS CB 1 1
10 1924 1 1 12 CYS H H -0.573 -12.973 -1.324 1.00 . A A . 12 CYS H 1 1
10 1925 1 1 12 CYS HA H -1.138 -10.234 -1.731 1.00 . A A . 12 CYS HA 1 1
10 1926 1 1 12 CYS HB2 H -2.795 -11.948 -0.978 1.00 . A A . 12 CYS HB2 1 1
10 1927 1 1 12 CYS HB3 H -2.001 -11.966 0.593 1.00 . A A . 12 CYS HB3 1 1
10 1928 1 1 12 CYS N N -0.228 -12.072 -1.503 1.00 . A A . 12 CYS N 1 1
10 1929 1 1 12 CYS O O 0.052 -10.631 1.249 1.00 . A A . 12 CYS O 1 1
10 1930 1 1 12 CYS SG S -3.282 -9.980 0.275 1.00 . A A . 12 CYS SG 1 1
10 1931 1 1 13 ALA C C 2.066 -7.157 -0.178 1.00 . A A . 13 ALA C 1 1
10 1932 1 1 13 ALA CA C 1.499 -8.377 0.540 1.00 . A A . 13 ALA CA 1 1
10 1933 1 1 13 ALA CB C 2.626 -9.257 1.060 1.00 . A A . 13 ALA CB 1 1
10 1934 1 1 13 ALA H H 0.516 -8.861 -1.271 1.00 . A A . 13 ALA H 1 1
10 1935 1 1 13 ALA HA H 0.915 -8.045 1.386 1.00 . A A . 13 ALA HA 1 1
10 1936 1 1 13 ALA HB1 H 2.256 -9.877 1.863 1.00 . A A . 13 ALA HB1 1 1
10 1937 1 1 13 ALA HB2 H 2.992 -9.883 0.260 1.00 . A A . 13 ALA HB2 1 1
10 1938 1 1 13 ALA HB3 H 3.428 -8.634 1.426 1.00 . A A . 13 ALA HB3 1 1
10 1939 1 1 13 ALA N N 0.624 -9.143 -0.339 1.00 . A A . 13 ALA N 1 1
10 1940 1 1 13 ALA O O 2.205 -6.098 0.433 1.00 . A A . 13 ALA O 1 1
10 1941 1 1 14 ALA C C 2.756 -6.707 -3.799 1.00 . A A . 14 ALA C 1 1
10 1942 1 1 14 ALA CA C 2.927 -6.263 -2.278 1.00 . A A . 14 ALA CA 1 1
10 1943 1 1 14 ALA CB C 4.363 -5.990 -2.020 1.00 . A A . 14 ALA CB 1 1
10 1944 1 1 14 ALA H H 2.234 -8.204 -1.851 1.00 . A A . 14 ALA H 1 1
10 1945 1 1 14 ALA HA H 2.316 -5.386 -2.181 1.00 . A A . 14 ALA HA 1 1
10 1946 1 1 14 ALA HB1 H 4.857 -6.893 -1.693 1.00 . A A . 14 ALA HB1 1 1
10 1947 1 1 14 ALA HB2 H 4.795 -5.669 -2.956 1.00 . A A . 14 ALA HB2 1 1
10 1948 1 1 14 ALA N N 2.381 -7.322 -1.449 1.00 . A A . 14 ALA N 1 1
10 1949 1 1 14 ALA O O 2.048 -6.058 -4.570 1.00 . A A . 14 ALA O 1 1
10 1950 1 1 15 SER C C 1.939 -8.525 -5.982 1.00 . A A . 15 SER C 1 1
10 1951 1 1 15 SER CA C 3.381 -8.284 -5.544 1.00 . A A . 15 SER CA 1 1
10 1952 1 1 15 SER CB C 4.187 -9.578 -5.671 1.00 . A A . 15 SER CB 1 1
10 1953 1 1 15 SER H H 3.977 -8.263 -3.513 1.00 . A A . 15 SER H 1 1
10 1954 1 1 15 SER HA H 3.818 -7.533 -6.185 1.00 . A A . 15 SER HA 1 1
10 1955 1 1 15 SER HB2 H 4.073 -9.974 -6.668 1.00 . A A . 15 SER HB2 1 1
10 1956 1 1 15 SER HB3 H 5.231 -9.368 -5.484 1.00 . A A . 15 SER HB3 1 1
10 1957 1 1 15 SER HG H 4.091 -10.343 -3.870 1.00 . A A . 15 SER HG 1 1
10 1958 1 1 15 SER N N 3.431 -7.789 -4.174 1.00 . A A . 15 SER N 1 1
10 1959 1 1 15 SER O O 1.435 -7.865 -6.891 1.00 . A A . 15 SER O 1 1
10 1960 1 1 15 SER OG O 3.743 -10.549 -4.740 1.00 . A A . 15 SER OG 1 1
10 1961 1 1 16 CYS C C -1.069 -8.927 -4.864 1.00 . A A . 16 CYS C 1 1
10 1962 1 1 16 CYS CA C -0.103 -9.808 -5.650 1.00 . A A . 16 CYS CA 1 1
10 1963 1 1 16 CYS CB C -0.379 -11.282 -5.348 1.00 . A A . 16 CYS CB 1 1
10 1964 1 1 16 CYS H H 1.736 -9.970 -4.614 1.00 . A A . 16 CYS H 1 1
10 1965 1 1 16 CYS HA H -0.250 -9.632 -6.705 1.00 . A A . 16 CYS HA 1 1
10 1966 1 1 16 CYS HB2 H -0.490 -11.409 -4.281 1.00 . A A . 16 CYS HB2 1 1
10 1967 1 1 16 CYS HB3 H -1.296 -11.576 -5.838 1.00 . A A . 16 CYS HB3 1 1
10 1968 1 1 16 CYS N N 1.281 -9.477 -5.330 1.00 . A A . 16 CYS N 1 1
10 1969 1 1 16 CYS O O -0.764 -8.490 -3.755 1.00 . A A . 16 CYS O 1 1
10 1970 1 1 16 CYS SG S 0.935 -12.415 -5.905 1.00 . A A . 16 CYS SG 1 1
10 1971 1 1 17 ALA C C -4.393 -8.695 -4.268 1.00 . A A . 17 ALA C 1 1
10 1972 1 1 17 ALA CA C -3.247 -7.843 -4.802 1.00 . A A . 17 ALA CA 1 1
10 1973 1 1 17 ALA CB C -3.773 -6.797 -5.774 1.00 . A A . 17 ALA CB 1 1
10 1974 1 1 17 ALA H H -2.419 -9.046 -6.333 1.00 . A A . 17 ALA H 1 1
10 1975 1 1 17 ALA HA H -2.779 -7.328 -3.975 1.00 . A A . 17 ALA HA 1 1
10 1976 1 1 17 ALA HB1 H -4.839 -6.687 -5.640 1.00 . A A . 17 ALA HB1 1 1
10 1977 1 1 17 ALA HB2 H -3.286 -5.852 -5.583 1.00 . A A . 17 ALA HB2 1 1
10 1978 1 1 17 ALA HB3 H -3.567 -7.111 -6.786 1.00 . A A . 17 ALA HB3 1 1
10 1979 1 1 17 ALA N N -2.235 -8.670 -5.448 1.00 . A A . 17 ALA N 1 1
10 1980 1 1 17 ALA O O -5.420 -8.824 -4.933 1.00 . A A . 17 ALA O 1 1
10 1981 1 1 18 ALA C C -6.573 -9.300 -2.444 1.00 . A A . 18 ALA C 1 1
10 1982 1 1 18 ALA CA C -5.191 -10.094 -2.436 1.00 . A A . 18 ALA CA 1 1
10 1983 1 1 18 ALA CB C -4.846 -10.435 -1.034 1.00 . A A . 18 ALA CB 1 1
10 1984 1 1 18 ALA H H -3.349 -9.096 -2.633 1.00 . A A . 18 ALA H 1 1
10 1985 1 1 18 ALA HA H -5.375 -10.963 -3.039 1.00 . A A . 18 ALA HA 1 1
10 1986 1 1 18 ALA HB1 H -5.645 -10.132 -0.372 1.00 . A A . 18 ALA HB1 1 1
10 1987 1 1 18 ALA HB2 H -4.737 -11.508 -0.989 1.00 . A A . 18 ALA HB2 1 1
10 1988 1 1 18 ALA N N -4.201 -9.257 -3.089 1.00 . A A . 18 ALA N 1 1
10 1989 1 1 18 ALA O O -6.763 -8.357 -1.677 1.00 . A A . 18 ALA O 1 1
10 1990 1 1 19 SER C C -9.886 -9.928 -2.905 1.00 . A A . 19 SER C 1 1
10 1991 1 1 19 SER CA C -8.771 -9.046 -3.459 1.00 . A A . 19 SER CA 1 1
10 1992 1 1 19 SER CB C -9.053 -8.708 -4.924 1.00 . A A . 19 SER CB 1 1
10 1993 1 1 19 SER H H -7.266 -10.463 -3.916 1.00 . A A . 19 SER H 1 1
10 1994 1 1 19 SER HA H -8.735 -8.130 -2.888 1.00 . A A . 19 SER HA 1 1
10 1995 1 1 19 SER HB2 H -8.127 -8.452 -5.416 1.00 . A A . 19 SER HB2 1 1
10 1996 1 1 19 SER HB3 H -9.494 -9.566 -5.410 1.00 . A A . 19 SER HB3 1 1
10 1997 1 1 19 SER HG H -10.790 -7.920 -5.369 1.00 . A A . 19 SER HG 1 1
10 1998 1 1 19 SER N N -7.476 -9.705 -3.331 1.00 . A A . 19 SER N 1 1
10 1999 1 1 19 SER O O -9.886 -11.142 -3.101 1.00 . A A . 19 SER O 1 1
10 2000 1 1 19 SER OG O -9.946 -7.613 -5.032 1.00 . A A . 19 SER OG 1 1
11 2001 1 1 1 ALA C C 2.902 -0.402 -0.026 1.00 . A A . 1 ALA C 1 1
11 2002 1 1 1 ALA CA C 1.582 0.358 -0.087 1.00 . A A . 1 ALA CA 1 1
11 2003 1 1 1 ALA CB C 1.810 1.840 0.171 1.00 . A A . 1 ALA CB 1 1
11 2004 1 1 1 ALA H1 H 0.942 -0.503 1.737 1.00 . A A . 1 ALA H1 1 1
11 2005 1 1 1 ALA HA H 1.162 0.251 -1.077 1.00 . A A . 1 ALA HA 1 1
11 2006 1 1 1 ALA HB1 H 1.540 2.073 1.191 1.00 . A A . 1 ALA HB1 1 1
11 2007 1 1 1 ALA HB2 H 2.852 2.077 0.011 1.00 . A A . 1 ALA HB2 1 1
11 2008 1 1 1 ALA HB3 H 1.201 2.421 -0.505 1.00 . A A . 1 ALA HB3 1 1
11 2009 1 1 1 ALA N N 0.622 -0.179 0.869 1.00 . A A . 1 ALA N 1 1
11 2010 1 1 1 ALA O O 3.533 -0.487 1.029 1.00 . A A . 1 ALA O 1 1
11 2011 1 1 2 CYS C C 5.556 -1.023 -2.171 1.00 . A A . 2 CYS C 1 1
11 2012 1 1 2 CYS CA C 4.561 -1.707 -1.237 1.00 . A A . 2 CYS CA 1 1
11 2013 1 1 2 CYS CB C 4.290 -3.133 -1.720 1.00 . A A . 2 CYS CB 1 1
11 2014 1 1 2 CYS H H 2.770 -0.851 -1.970 1.00 . A A . 2 CYS H 1 1
11 2015 1 1 2 CYS HA H 4.986 -1.747 -0.246 1.00 . A A . 2 CYS HA 1 1
11 2016 1 1 2 CYS HB2 H 3.352 -3.473 -1.304 1.00 . A A . 2 CYS HB2 1 1
11 2017 1 1 2 CYS HB3 H 4.221 -3.134 -2.798 1.00 . A A . 2 CYS HB3 1 1
11 2018 1 1 2 CYS N N 3.316 -0.953 -1.162 1.00 . A A . 2 CYS N 1 1
11 2019 1 1 2 CYS O O 5.171 -0.433 -3.180 1.00 . A A . 2 CYS O 1 1
11 2020 1 1 2 CYS SG S 5.573 -4.336 -1.245 1.00 . A A . 2 CYS SG 1 1
11 2021 1 1 3 GLY C C 8.058 -1.205 -3.969 1.00 . A A . 3 GLY C 1 1
11 2022 1 1 3 GLY CA C 7.867 -0.493 -2.644 1.00 . A A . 3 GLY CA 1 1
11 2023 1 1 3 GLY H H 7.085 -1.591 -1.012 1.00 . A A . 3 GLY H 1 1
11 2024 1 1 3 GLY HA2 H 7.594 0.534 -2.836 1.00 . A A . 3 GLY HA2 1 1
11 2025 1 1 3 GLY HA3 H 8.800 -0.512 -2.101 1.00 . A A . 3 GLY HA3 1 1
11 2026 1 1 3 GLY N N 6.837 -1.108 -1.827 1.00 . A A . 3 GLY N 1 1
11 2027 1 1 3 GLY O O 8.172 -0.577 -5.022 1.00 . A A . 3 GLY O 1 1
11 2028 1 1 4 . C C 9.763 -3.473 -5.537 1.00 . A A . 4 DBB C 1 1
11 2029 1 1 4 . CA C 8.285 -3.274 -5.156 1.00 . A A . 4 DBB CA 1 1
11 2030 1 1 4 . CB C 7.546 -4.621 -5.020 1.00 . A A . 4 DBB CB 1 1
11 2031 1 1 4 . CG C 7.535 -5.334 -6.362 1.00 . A A . 4 DBB CG 1 1
11 2032 1 1 4 . H H 8.003 -2.993 -3.065 1.00 . A A . 4 DBB H 1 1
11 2033 1 1 4 . HA H 7.807 -2.726 -5.944 1.00 . A A . 4 DBB HA 1 1
11 2034 1 1 4 . HB2 H 6.533 -4.368 -4.789 1.00 . A A . 4 DBB HB2 1 1
11 2035 1 1 4 . HG1 H 7.501 -6.399 -6.190 1.00 . A A . 4 DBB HG1 1 1
11 2036 1 1 4 . HG2 H 8.430 -5.084 -6.911 1.00 . A A . 4 DBB HG2 1 1
11 2037 1 1 4 . HG3 H 6.666 -5.031 -6.924 1.00 . A A . 4 DBB HG3 1 1
11 2038 1 1 4 . N N 8.097 -2.523 -3.925 1.00 . A A . 4 DBB N 1 1
11 2039 1 1 4 . O O 10.147 -3.061 -6.630 1.00 . A A . 4 DBB O 1 1
11 2040 1 1 5 GLY C C 12.237 -4.846 -6.286 1.00 . A A . 5 GLY C 1 1
11 2041 1 1 5 GLY CA C 11.990 -4.199 -4.938 1.00 . A A . 5 GLY CA 1 1
11 2042 1 1 5 GLY H H 10.214 -4.349 -3.794 1.00 . A A . 5 GLY H 1 1
11 2043 1 1 5 GLY HA2 H 12.462 -3.228 -4.924 1.00 . A A . 5 GLY HA2 1 1
11 2044 1 1 5 GLY HA3 H 12.434 -4.814 -4.169 1.00 . A A . 5 GLY HA3 1 1
11 2045 1 1 5 GLY N N 10.577 -4.038 -4.650 1.00 . A A . 5 GLY N 1 1
11 2046 1 1 5 GLY O O 12.377 -4.211 -7.327 1.00 . A A . 5 GLY O 1 1
11 2047 1 1 6 . C C 11.101 -7.274 -8.185 1.00 . A A . 6 IAS C 1 1
11 2048 1 1 6 . CA C 12.433 -6.905 -7.557 1.00 . A A . 6 IAS CA 1 1
11 2049 1 1 6 . CB C 13.347 -8.141 -7.460 1.00 . A A . 6 IAS CB 1 1
11 2050 1 1 6 . CG C 12.942 -9.108 -6.356 1.00 . A A . 6 IAS CG 1 1
11 2051 1 1 6 . H H 12.191 -6.714 -5.461 1.00 . A A . 6 IAS H 1 1
11 2052 1 1 6 . HA H 12.864 -6.216 -8.274 1.00 . A A . 6 IAS HA 1 1
11 2053 1 1 6 . HB2 H 14.342 -7.802 -7.210 1.00 . A A . 6 IAS HB2 1 1
11 2054 1 1 6 . HB3 H 13.367 -8.637 -8.418 1.00 . A A . 6 IAS HB3 1 1
11 2055 1 1 6 . HXT H 11.492 -7.686 -10.030 1.00 . A A . 6 IAS HXT 1 1
11 2056 1 1 6 . N N 12.303 -6.188 -6.300 1.00 . A A . 6 IAS N 1 1
11 2057 1 1 6 . O O 10.027 -6.936 -7.756 1.00 . A A . 6 IAS O 1 1
11 2058 1 1 6 . OD1 O 12.278 -10.117 -6.594 1.00 . A A . 6 IAS OD1 1 1
11 2059 1 1 6 . OXT O 11.253 -8.133 -9.204 1.00 . A A . 6 IAS OXT 1 1
11 2060 1 1 7 GLY C C 11.886 -9.048 -3.163 1.00 . A A . 7 GLY C 1 1
11 2061 1 1 7 GLY CA C 13.019 -9.618 -3.994 1.00 . A A . 7 GLY CA 1 1
11 2062 1 1 7 GLY H H 13.874 -7.964 -5.003 1.00 . A A . 7 GLY H 1 1
11 2063 1 1 7 GLY HA2 H 12.733 -10.596 -4.350 1.00 . A A . 7 GLY HA2 1 1
11 2064 1 1 7 GLY HA3 H 13.895 -9.715 -3.369 1.00 . A A . 7 GLY HA3 1 1
11 2065 1 1 7 GLY N N 13.347 -8.781 -5.133 1.00 . A A . 7 GLY N 1 1
11 2066 1 1 7 GLY O O 11.913 -9.116 -1.934 1.00 . A A . 7 GLY O 1 1
11 2067 1 1 8 CYS C C 8.771 -8.981 -2.689 1.00 . A A . 8 CYS C 1 1
11 2068 1 1 8 CYS CA C 9.742 -7.897 -3.151 1.00 . A A . 8 CYS CA 1 1
11 2069 1 1 8 CYS CB C 9.021 -6.911 -4.073 1.00 . A A . 8 CYS CB 1 1
11 2070 1 1 8 CYS H H 10.924 -8.460 -4.814 1.00 . A A . 8 CYS H 1 1
11 2071 1 1 8 CYS HA H 10.107 -7.366 -2.285 1.00 . A A . 8 CYS HA 1 1
11 2072 1 1 8 CYS HB2 H 9.757 -6.334 -4.615 1.00 . A A . 8 CYS HB2 1 1
11 2073 1 1 8 CYS HB3 H 8.416 -7.464 -4.776 1.00 . A A . 8 CYS HB3 1 1
11 2074 1 1 8 CYS N N 10.888 -8.484 -3.834 1.00 . A A . 8 CYS N 1 1
11 2075 1 1 8 CYS O O 8.755 -10.086 -3.231 1.00 . A A . 8 CYS O 1 1
11 2076 1 1 8 CYS SG S 7.932 -5.739 -3.202 1.00 . A A . 8 CYS SG 1 1
11 2077 1 1 9 ALA C C 6.088 -10.141 -2.258 1.00 . A A . 9 ALA C 1 1
11 2078 1 1 9 ALA CA C 6.988 -9.598 -1.153 1.00 . A A . 9 ALA CA 1 1
11 2079 1 1 9 ALA CB C 6.154 -8.937 -0.066 1.00 . A A . 9 ALA CB 1 1
11 2080 1 1 9 ALA H H 8.023 -7.758 -1.296 1.00 . A A . 9 ALA H 1 1
11 2081 1 1 9 ALA HA H 7.529 -10.421 -0.707 1.00 . A A . 9 ALA HA 1 1
11 2082 1 1 9 ALA HB1 H 5.244 -8.547 -0.499 1.00 . A A . 9 ALA HB1 1 1
11 2083 1 1 9 ALA HB2 H 5.908 -9.666 0.692 1.00 . A A . 9 ALA HB2 1 1
11 2084 1 1 9 ALA HB3 H 6.716 -8.130 0.379 1.00 . A A . 9 ALA HB3 1 1
11 2085 1 1 9 ALA N N 7.963 -8.655 -1.686 1.00 . A A . 9 ALA N 1 1
11 2086 1 1 9 ALA O O 5.462 -9.377 -2.994 1.00 . A A . 9 ALA O 1 1
11 2087 1 1 10 LYS C C 3.782 -12.325 -2.874 1.00 . A A . 10 LYS C 1 1
11 2088 1 1 10 LYS CA C 5.203 -12.109 -3.384 1.00 . A A . 10 LYS CA 1 1
11 2089 1 1 10 LYS CB C 5.819 -13.449 -3.794 1.00 . A A . 10 LYS CB 1 1
11 2090 1 1 10 LYS CD C 6.289 -15.810 -3.078 1.00 . A A . 10 LYS CD 1 1
11 2091 1 1 10 LYS CE C 6.690 -16.714 -1.922 1.00 . A A . 10 LYS CE 1 1
11 2092 1 1 10 LYS CG C 6.097 -14.374 -2.622 1.00 . A A . 10 LYS CG 1 1
11 2093 1 1 10 LYS H H 6.549 -12.019 -1.753 1.00 . A A . 10 LYS H 1 1
11 2094 1 1 10 LYS HA H 5.168 -11.460 -4.246 1.00 . A A . 10 LYS HA 1 1
11 2095 1 1 10 LYS HB2 H 5.142 -13.951 -4.469 1.00 . A A . 10 LYS HB2 1 1
11 2096 1 1 10 LYS HB3 H 6.751 -13.261 -4.306 1.00 . A A . 10 LYS HB3 1 1
11 2097 1 1 10 LYS HD2 H 5.363 -16.172 -3.499 1.00 . A A . 10 LYS HD2 1 1
11 2098 1 1 10 LYS HD3 H 7.064 -15.839 -3.832 1.00 . A A . 10 LYS HD3 1 1
11 2099 1 1 10 LYS HE2 H 7.650 -16.394 -1.549 1.00 . A A . 10 LYS HE2 1 1
11 2100 1 1 10 LYS HE3 H 5.951 -16.624 -1.140 1.00 . A A . 10 LYS HE3 1 1
11 2101 1 1 10 LYS HG2 H 6.995 -14.044 -2.120 1.00 . A A . 10 LYS HG2 1 1
11 2102 1 1 10 LYS HG3 H 5.263 -14.332 -1.936 1.00 . A A . 10 LYS HG3 1 1
11 2103 1 1 10 LYS HZ1 H 7.687 -18.313 -2.824 1.00 . A A . 10 LYS HZ1 1 1
11 2104 1 1 10 LYS HZ2 H 6.005 -18.374 -2.990 1.00 . A A . 10 LYS HZ2 1 1
11 2105 1 1 10 LYS HZ3 H 6.723 -18.761 -1.508 1.00 . A A . 10 LYS HZ3 1 1
11 2106 1 1 10 LYS N N 6.027 -11.463 -2.369 1.00 . A A . 10 LYS N 1 1
11 2107 1 1 10 LYS NZ N 6.782 -18.140 -2.340 1.00 . A A . 10 LYS NZ 1 1
11 2108 1 1 10 LYS O O 3.491 -12.147 -1.691 1.00 . A A . 10 LYS O 1 1
11 2109 1 1 11 . C C 0.823 -11.673 -2.815 1.00 . A A . 11 DBB C 1 1
11 2110 1 1 11 . CA C 1.517 -12.935 -3.359 1.00 . A A . 11 DBB CA 1 1
11 2111 1 1 11 . CB C 0.747 -13.537 -4.553 1.00 . A A . 11 DBB CB 1 1
11 2112 1 1 11 . CG C -0.631 -13.986 -4.097 1.00 . A A . 11 DBB CG 1 1
11 2113 1 1 11 . H H 3.162 -12.845 -4.707 1.00 . A A . 11 DBB H 1 1
11 2114 1 1 11 . HA H 1.527 -13.673 -2.582 1.00 . A A . 11 DBB HA 1 1
11 2115 1 1 11 . HB2 H 1.290 -14.416 -4.827 1.00 . A A . 11 DBB HB2 1 1
11 2116 1 1 11 . HG1 H -0.527 -14.566 -3.192 1.00 . A A . 11 DBB HG1 1 1
11 2117 1 1 11 . HG2 H -1.086 -14.593 -4.865 1.00 . A A . 11 DBB HG2 1 1
11 2118 1 1 11 . HG3 H -1.246 -13.122 -3.904 1.00 . A A . 11 DBB HG3 1 1
11 2119 1 1 11 . N N 2.894 -12.712 -3.769 1.00 . A A . 11 DBB N 1 1
11 2120 1 1 11 . O O 1.188 -10.575 -3.236 1.00 . A A . 11 DBB O 1 1
11 2121 1 1 12 CYS C C -0.115 -9.954 -0.352 1.00 . A A . 12 CYS C 1 1
11 2122 1 1 12 CYS CA C -0.915 -10.676 -1.433 1.00 . A A . 12 CYS CA 1 1
11 2123 1 1 12 CYS CB C -2.264 -11.126 -0.870 1.00 . A A . 12 CYS CB 1 1
11 2124 1 1 12 CYS H H -0.419 -12.722 -1.651 1.00 . A A . 12 CYS H 1 1
11 2125 1 1 12 CYS HA H -1.086 -9.994 -2.253 1.00 . A A . 12 CYS HA 1 1
11 2126 1 1 12 CYS HB2 H -2.110 -11.563 0.106 1.00 . A A . 12 CYS HB2 1 1
11 2127 1 1 12 CYS HB3 H -2.911 -10.267 -0.776 1.00 . A A . 12 CYS HB3 1 1
11 2128 1 1 12 CYS N N -0.174 -11.820 -1.950 1.00 . A A . 12 CYS N 1 1
11 2129 1 1 12 CYS O O -0.569 -9.818 0.783 1.00 . A A . 12 CYS O 1 1
11 2130 1 1 12 CYS SG S -3.124 -12.359 -1.899 1.00 . A A . 12 CYS SG 1 1
11 2131 1 1 13 ALA C C 2.433 -7.469 -0.373 1.00 . A A . 13 ALA C 1 1
11 2132 1 1 13 ALA CA C 1.939 -8.782 0.223 1.00 . A A . 13 ALA CA 1 1
11 2133 1 1 13 ALA CB C 3.116 -9.658 0.625 1.00 . A A . 13 ALA CB 1 1
11 2134 1 1 13 ALA H H 1.384 -9.631 -1.635 1.00 . A A . 13 ALA H 1 1
11 2135 1 1 13 ALA HA H 1.361 -8.568 1.111 1.00 . A A . 13 ALA HA 1 1
11 2136 1 1 13 ALA HB1 H 3.576 -10.070 -0.262 1.00 . A A . 13 ALA HB1 1 1
11 2137 1 1 13 ALA HB2 H 3.839 -9.064 1.163 1.00 . A A . 13 ALA HB2 1 1
11 2138 1 1 13 ALA HB3 H 2.768 -10.462 1.256 1.00 . A A . 13 ALA HB3 1 1
11 2139 1 1 13 ALA N N 1.077 -9.492 -0.715 1.00 . A A . 13 ALA N 1 1
11 2140 1 1 13 ALA O O 2.577 -6.485 0.352 1.00 . A A . 13 ALA O 1 1
11 2141 1 1 14 ALA C C 3.017 -6.619 -3.949 1.00 . A A . 14 ALA C 1 1
11 2142 1 1 14 ALA CA C 3.156 -6.307 -2.393 1.00 . A A . 14 ALA CA 1 1
11 2143 1 1 14 ALA CB C 4.569 -5.961 -2.100 1.00 . A A . 14 ALA CB 1 1
11 2144 1 1 14 ALA H H 2.539 -8.307 -2.164 1.00 . A A . 14 ALA H 1 1
11 2145 1 1 14 ALA HA H 2.485 -5.487 -2.220 1.00 . A A . 14 ALA HA 1 1
11 2146 1 1 14 ALA HB1 H 5.012 -6.719 -1.471 1.00 . A A . 14 ALA HB1 1 1
11 2147 1 1 14 ALA HB2 H 5.089 -5.938 -3.047 1.00 . A A . 14 ALA HB2 1 1
11 2148 1 1 14 ALA N N 2.683 -7.474 -1.669 1.00 . A A . 14 ALA N 1 1
11 2149 1 1 14 ALA O O 2.621 -5.756 -4.733 1.00 . A A . 14 ALA O 1 1
11 2150 1 1 15 SER C C 1.870 -8.417 -6.195 1.00 . A A . 15 SER C 1 1
11 2151 1 1 15 SER CA C 3.315 -8.244 -5.736 1.00 . A A . 15 SER CA 1 1
11 2152 1 1 15 SER CB C 4.087 -9.548 -5.944 1.00 . A A . 15 SER CB 1 1
11 2153 1 1 15 SER H H 3.678 -8.484 -3.664 1.00 . A A . 15 SER H 1 1
11 2154 1 1 15 SER HA H 3.776 -7.465 -6.325 1.00 . A A . 15 SER HA 1 1
11 2155 1 1 15 SER HB2 H 3.869 -10.226 -5.132 1.00 . A A . 15 SER HB2 1 1
11 2156 1 1 15 SER HB3 H 3.785 -9.998 -6.879 1.00 . A A . 15 SER HB3 1 1
11 2157 1 1 15 SER HG H 5.655 -8.458 -6.380 1.00 . A A . 15 SER HG 1 1
11 2158 1 1 15 SER N N 3.370 -7.840 -4.336 1.00 . A A . 15 SER N 1 1
11 2159 1 1 15 SER O O 1.332 -7.580 -6.921 1.00 . A A . 15 SER O 1 1
11 2160 1 1 15 SER OG O 5.484 -9.314 -5.980 1.00 . A A . 15 SER OG 1 1
11 2161 1 1 16 CYS C C -1.099 -8.899 -5.360 1.00 . A A . 16 CYS C 1 1
11 2162 1 1 16 CYS CA C -0.136 -9.795 -6.132 1.00 . A A . 16 CYS CA 1 1
11 2163 1 1 16 CYS CB C -0.463 -11.265 -5.864 1.00 . A A . 16 CYS CB 1 1
11 2164 1 1 16 CYS H H 1.728 -10.140 -5.190 1.00 . A A . 16 CYS H 1 1
11 2165 1 1 16 CYS HA H -0.248 -9.597 -7.188 1.00 . A A . 16 CYS HA 1 1
11 2166 1 1 16 CYS HB2 H -0.604 -11.407 -4.802 1.00 . A A . 16 CYS HB2 1 1
11 2167 1 1 16 CYS HB3 H -1.376 -11.523 -6.380 1.00 . A A . 16 CYS HB3 1 1
11 2168 1 1 16 CYS N N 1.246 -9.510 -5.767 1.00 . A A . 16 CYS N 1 1
11 2169 1 1 16 CYS O O -0.743 -8.332 -4.327 1.00 . A A . 16 CYS O 1 1
11 2170 1 1 16 CYS SG S 0.830 -12.427 -6.409 1.00 . A A . 16 CYS SG 1 1
11 2171 1 1 17 ALA C C -4.517 -8.797 -4.761 1.00 . A A . 17 ALA C 1 1
11 2172 1 1 17 ALA CA C -3.336 -7.951 -5.225 1.00 . A A . 17 ALA CA 1 1
11 2173 1 1 17 ALA CB C -3.807 -6.859 -6.174 1.00 . A A . 17 ALA CB 1 1
11 2174 1 1 17 ALA H H -2.545 -9.252 -6.694 1.00 . A A . 17 ALA H 1 1
11 2175 1 1 17 ALA HA H -2.886 -7.477 -4.365 1.00 . A A . 17 ALA HA 1 1
11 2176 1 1 17 ALA HB1 H -3.512 -7.107 -7.183 1.00 . A A . 17 ALA HB1 1 1
11 2177 1 1 17 ALA HB2 H -4.882 -6.777 -6.123 1.00 . A A . 17 ALA HB2 1 1
11 2178 1 1 17 ALA HB3 H -3.360 -5.918 -5.889 1.00 . A A . 17 ALA HB3 1 1
11 2179 1 1 17 ALA N N -2.321 -8.776 -5.868 1.00 . A A . 17 ALA N 1 1
11 2180 1 1 17 ALA O O -5.516 -8.894 -5.473 1.00 . A A . 17 ALA O 1 1
11 2181 1 1 18 ALA C C -6.412 -9.269 -2.202 1.00 . A A . 18 ALA C 1 1
11 2182 1 1 18 ALA CA C -5.416 -10.224 -2.999 1.00 . A A . 18 ALA CA 1 1
11 2183 1 1 18 ALA CB C -4.886 -11.247 -2.064 1.00 . A A . 18 ALA CB 1 1
11 2184 1 1 18 ALA H H -3.551 -9.252 -3.093 1.00 . A A . 18 ALA H 1 1
11 2185 1 1 18 ALA HA H -6.017 -10.651 -3.780 1.00 . A A . 18 ALA HA 1 1
11 2186 1 1 18 ALA HB1 H -4.879 -10.858 -1.056 1.00 . A A . 18 ALA HB1 1 1
11 2187 1 1 18 ALA HB2 H -5.553 -12.094 -2.113 1.00 . A A . 18 ALA HB2 1 1
11 2188 1 1 18 ALA N N -4.386 -9.388 -3.589 1.00 . A A . 18 ALA N 1 1
11 2189 1 1 18 ALA O O -6.056 -8.712 -1.163 1.00 . A A . 18 ALA O 1 1
11 2190 1 1 19 SER C C -8.950 -8.709 -0.708 1.00 . A A . 19 SER C 1 1
11 2191 1 1 19 SER CA C -8.614 -8.235 -2.119 1.00 . A A . 19 SER CA 1 1
11 2192 1 1 19 SER CB C -9.884 -8.194 -2.971 1.00 . A A . 19 SER CB 1 1
11 2193 1 1 19 SER H H -7.842 -9.574 -3.565 1.00 . A A . 19 SER H 1 1
11 2194 1 1 19 SER HA H -8.197 -7.240 -2.061 1.00 . A A . 19 SER HA 1 1
11 2195 1 1 19 SER HB2 H -10.646 -7.634 -2.450 1.00 . A A . 19 SER HB2 1 1
11 2196 1 1 19 SER HB3 H -9.665 -7.714 -3.914 1.00 . A A . 19 SER HB3 1 1
11 2197 1 1 19 SER HG H -10.259 -10.041 -2.440 1.00 . A A . 19 SER HG 1 1
11 2198 1 1 19 SER N N -7.618 -9.103 -2.735 1.00 . A A . 19 SER N 1 1
11 2199 1 1 19 SER O O -10.103 -8.662 -0.285 1.00 . A A . 19 SER O 1 1
11 2200 1 1 19 SER OG O -10.370 -9.500 -3.225 1.00 . A A . 19 SER OG 1 1
12 2201 1 1 1 ALA C C 3.595 0.460 -1.140 1.00 . A A . 1 ALA C 1 1
12 2202 1 1 1 ALA CA C 2.307 1.247 -0.924 1.00 . A A . 1 ALA CA 1 1
12 2203 1 1 1 ALA CB C 2.611 2.597 -0.291 1.00 . A A . 1 ALA CB 1 1
12 2204 1 1 1 ALA H1 H 0.705 0.990 0.435 1.00 . A A . 1 ALA H1 1 1
12 2205 1 1 1 ALA HA H 1.840 1.424 -1.883 1.00 . A A . 1 ALA HA 1 1
12 2206 1 1 1 ALA HB1 H 3.289 2.460 0.539 1.00 . A A . 1 ALA HB1 1 1
12 2207 1 1 1 ALA HB2 H 3.067 3.245 -1.025 1.00 . A A . 1 ALA HB2 1 1
12 2208 1 1 1 ALA HB3 H 1.693 3.043 0.063 1.00 . A A . 1 ALA HB3 1 1
12 2209 1 1 1 ALA N N 1.367 0.501 -0.097 1.00 . A A . 1 ALA N 1 1
12 2210 1 1 1 ALA O O 4.683 1.033 -1.196 1.00 . A A . 1 ALA O 1 1
12 2211 1 1 2 CYS C C 5.444 -1.254 -2.660 1.00 . A A . 2 CYS C 1 1
12 2212 1 1 2 CYS CA C 4.618 -1.725 -1.466 1.00 . A A . 2 CYS CA 1 1
12 2213 1 1 2 CYS CB C 4.163 -3.169 -1.684 1.00 . A A . 2 CYS CB 1 1
12 2214 1 1 2 CYS H H 2.570 -1.256 -1.205 1.00 . A A . 2 CYS H 1 1
12 2215 1 1 2 CYS HA H 5.231 -1.679 -0.580 1.00 . A A . 2 CYS HA 1 1
12 2216 1 1 2 CYS HB2 H 3.260 -3.343 -1.117 1.00 . A A . 2 CYS HB2 1 1
12 2217 1 1 2 CYS HB3 H 3.958 -3.320 -2.734 1.00 . A A . 2 CYS HB3 1 1
12 2218 1 1 2 CYS N N 3.464 -0.857 -1.258 1.00 . A A . 2 CYS N 1 1
12 2219 1 1 2 CYS O O 4.922 -1.084 -3.761 1.00 . A A . 2 CYS O 1 1
12 2220 1 1 2 CYS SG S 5.386 -4.419 -1.172 1.00 . A A . 2 CYS SG 1 1
12 2221 1 1 3 GLY C C 7.756 -1.626 -4.604 1.00 . A A . 3 GLY C 1 1
12 2222 1 1 3 GLY CA C 7.615 -0.599 -3.498 1.00 . A A . 3 GLY CA 1 1
12 2223 1 1 3 GLY H H 7.098 -1.200 -1.534 1.00 . A A . 3 GLY H 1 1
12 2224 1 1 3 GLY HA2 H 7.218 0.314 -3.917 1.00 . A A . 3 GLY HA2 1 1
12 2225 1 1 3 GLY HA3 H 8.592 -0.397 -3.083 1.00 . A A . 3 GLY HA3 1 1
12 2226 1 1 3 GLY N N 6.737 -1.047 -2.433 1.00 . A A . 3 GLY N 1 1
12 2227 1 1 3 GLY O O 8.148 -1.306 -5.727 1.00 . A A . 3 GLY O 1 1
12 2228 1 1 4 . C C 8.978 -4.056 -5.873 1.00 . A A . 4 DBB C 1 1
12 2229 1 1 4 . CA C 7.556 -3.909 -5.302 1.00 . A A . 4 DBB CA 1 1
12 2230 1 1 4 . CB C 7.047 -5.232 -4.695 1.00 . A A . 4 DBB CB 1 1
12 2231 1 1 4 . CG C 6.948 -6.288 -5.784 1.00 . A A . 4 DBB CG 1 1
12 2232 1 1 4 . H H 7.129 -3.088 -3.386 1.00 . A A . 4 DBB H 1 1
12 2233 1 1 4 . HA H 6.898 -3.653 -6.108 1.00 . A A . 4 DBB HA 1 1
12 2234 1 1 4 . HB2 H 6.051 -5.028 -4.363 1.00 . A A . 4 DBB HB2 1 1
12 2235 1 1 4 . HG1 H 7.908 -6.378 -6.270 1.00 . A A . 4 DBB HG1 1 1
12 2236 1 1 4 . HG2 H 6.202 -5.993 -6.507 1.00 . A A . 4 DBB HG2 1 1
12 2237 1 1 4 . HG3 H 6.676 -7.233 -5.344 1.00 . A A . 4 DBB HG3 1 1
12 2238 1 1 4 . N N 7.439 -2.868 -4.294 1.00 . A A . 4 DBB N 1 1
12 2239 1 1 4 . O O 9.129 -3.998 -7.093 1.00 . A A . 4 DBB O 1 1
12 2240 1 1 5 GLY C C 11.529 -5.345 -6.572 1.00 . A A . 5 GLY C 1 1
12 2241 1 1 5 GLY CA C 11.358 -4.279 -5.508 1.00 . A A . 5 GLY CA 1 1
12 2242 1 1 5 GLY H H 9.812 -4.233 -4.062 1.00 . A A . 5 GLY H 1 1
12 2243 1 1 5 GLY HA2 H 11.644 -3.324 -5.921 1.00 . A A . 5 GLY HA2 1 1
12 2244 1 1 5 GLY HA3 H 12.008 -4.510 -4.677 1.00 . A A . 5 GLY HA3 1 1
12 2245 1 1 5 GLY N N 9.993 -4.192 -5.024 1.00 . A A . 5 GLY N 1 1
12 2246 1 1 5 GLY O O 11.353 -5.140 -7.770 1.00 . A A . 5 GLY O 1 1
12 2247 1 1 6 . C C 10.671 -8.420 -7.248 1.00 . A A . 6 IAS C 1 1
12 2248 1 1 6 . CA C 11.983 -7.677 -7.073 1.00 . A A . 6 IAS CA 1 1
12 2249 1 1 6 . CB C 13.122 -8.658 -6.740 1.00 . A A . 6 IAS CB 1 1
12 2250 1 1 6 . CG C 13.073 -9.181 -5.311 1.00 . A A . 6 IAS CG 1 1
12 2251 1 1 6 . H H 12.040 -6.741 -5.173 1.00 . A A . 6 IAS H 1 1
12 2252 1 1 6 . HA H 12.168 -7.257 -8.055 1.00 . A A . 6 IAS HA 1 1
12 2253 1 1 6 . HB2 H 14.059 -8.127 -6.832 1.00 . A A . 6 IAS HB2 1 1
12 2254 1 1 6 . HB3 H 13.100 -9.471 -7.448 1.00 . A A . 6 IAS HB3 1 1
12 2255 1 1 6 . HXT H 10.193 -9.980 -6.215 1.00 . A A . 6 IAS HXT 1 1
12 2256 1 1 6 . N N 11.894 -6.564 -6.142 1.00 . A A . 6 IAS N 1 1
12 2257 1 1 6 . O O 9.994 -8.385 -8.244 1.00 . A A . 6 IAS O 1 1
12 2258 1 1 6 . OD1 O 12.689 -10.321 -5.054 1.00 . A A . 6 IAS OD1 1 1
12 2259 1 1 6 . OXT O 10.286 -9.021 -6.112 1.00 . A A . 6 IAS OXT 1 1
12 2260 1 1 7 GLY C C 12.168 -8.305 -2.275 1.00 . A A . 7 GLY C 1 1
12 2261 1 1 7 GLY CA C 13.456 -8.697 -2.973 1.00 . A A . 7 GLY CA 1 1
12 2262 1 1 7 GLY H H 13.760 -7.425 -4.638 1.00 . A A . 7 GLY H 1 1
12 2263 1 1 7 GLY HA2 H 13.582 -9.767 -2.897 1.00 . A A . 7 GLY HA2 1 1
12 2264 1 1 7 GLY HA3 H 14.283 -8.211 -2.477 1.00 . A A . 7 GLY HA3 1 1
12 2265 1 1 7 GLY N N 13.464 -8.321 -4.375 1.00 . A A . 7 GLY N 1 1
12 2266 1 1 7 GLY O O 12.146 -8.112 -1.059 1.00 . A A . 7 GLY O 1 1
12 2267 1 1 8 CYS C C 8.996 -9.048 -2.097 1.00 . A A . 8 CYS C 1 1
12 2268 1 1 8 CYS CA C 9.795 -7.810 -2.495 1.00 . A A . 8 CYS CA 1 1
12 2269 1 1 8 CYS CB C 9.005 -6.984 -3.512 1.00 . A A . 8 CYS CB 1 1
12 2270 1 1 8 CYS H H 11.173 -8.351 -4.009 1.00 . A A . 8 CYS H 1 1
12 2271 1 1 8 CYS HA H 9.969 -7.211 -1.614 1.00 . A A . 8 CYS HA 1 1
12 2272 1 1 8 CYS HB2 H 9.698 -6.453 -4.149 1.00 . A A . 8 CYS HB2 1 1
12 2273 1 1 8 CYS HB3 H 8.406 -7.649 -4.116 1.00 . A A . 8 CYS HB3 1 1
12 2274 1 1 8 CYS N N 11.092 -8.184 -3.045 1.00 . A A . 8 CYS N 1 1
12 2275 1 1 8 CYS O O 9.343 -10.169 -2.467 1.00 . A A . 8 CYS O 1 1
12 2276 1 1 8 CYS SG S 7.889 -5.754 -2.764 1.00 . A A . 8 CYS SG 1 1
12 2277 1 1 9 ALA C C 6.262 -10.503 -2.054 1.00 . A A . 9 ALA C 1 1
12 2278 1 1 9 ALA CA C 7.073 -9.932 -0.896 1.00 . A A . 9 ALA CA 1 1
12 2279 1 1 9 ALA CB C 6.148 -9.463 0.218 1.00 . A A . 9 ALA CB 1 1
12 2280 1 1 9 ALA H H 7.698 -7.918 -1.080 1.00 . A A . 9 ALA H 1 1
12 2281 1 1 9 ALA HA H 7.711 -10.708 -0.499 1.00 . A A . 9 ALA HA 1 1
12 2282 1 1 9 ALA HB1 H 5.475 -8.711 -0.167 1.00 . A A . 9 ALA HB1 1 1
12 2283 1 1 9 ALA HB2 H 5.578 -10.302 0.588 1.00 . A A . 9 ALA HB2 1 1
12 2284 1 1 9 ALA HB3 H 6.736 -9.044 1.020 1.00 . A A . 9 ALA HB3 1 1
12 2285 1 1 9 ALA N N 7.923 -8.835 -1.342 1.00 . A A . 9 ALA N 1 1
12 2286 1 1 9 ALA O O 5.981 -9.809 -3.032 1.00 . A A . 9 ALA O 1 1
12 2287 1 1 10 LYS C C 3.673 -12.669 -2.514 1.00 . A A . 10 LYS C 1 1
12 2288 1 1 10 LYS CA C 5.109 -12.439 -2.976 1.00 . A A . 10 LYS CA 1 1
12 2289 1 1 10 LYS CB C 5.756 -13.774 -3.351 1.00 . A A . 10 LYS CB 1 1
12 2290 1 1 10 LYS CD C 7.244 -14.925 -5.015 1.00 . A A . 10 LYS CD 1 1
12 2291 1 1 10 LYS CE C 8.132 -15.850 -4.198 1.00 . A A . 10 LYS CE 1 1
12 2292 1 1 10 LYS CG C 6.955 -13.631 -4.272 1.00 . A A . 10 LYS CG 1 1
12 2293 1 1 10 LYS H H 6.143 -12.275 -1.136 1.00 . A A . 10 LYS H 1 1
12 2294 1 1 10 LYS HA H 5.096 -11.798 -3.845 1.00 . A A . 10 LYS HA 1 1
12 2295 1 1 10 LYS HB2 H 6.079 -14.270 -2.448 1.00 . A A . 10 LYS HB2 1 1
12 2296 1 1 10 LYS HB3 H 5.019 -14.391 -3.846 1.00 . A A . 10 LYS HB3 1 1
12 2297 1 1 10 LYS HD2 H 6.311 -15.428 -5.221 1.00 . A A . 10 LYS HD2 1 1
12 2298 1 1 10 LYS HD3 H 7.742 -14.691 -5.946 1.00 . A A . 10 LYS HD3 1 1
12 2299 1 1 10 LYS HE2 H 8.890 -15.260 -3.707 1.00 . A A . 10 LYS HE2 1 1
12 2300 1 1 10 LYS HE3 H 7.525 -16.346 -3.454 1.00 . A A . 10 LYS HE3 1 1
12 2301 1 1 10 LYS HG2 H 6.753 -12.852 -4.993 1.00 . A A . 10 LYS HG2 1 1
12 2302 1 1 10 LYS HG3 H 7.820 -13.364 -3.683 1.00 . A A . 10 LYS HG3 1 1
12 2303 1 1 10 LYS HZ1 H 8.264 -17.774 -5.001 1.00 . A A . 10 LYS HZ1 1 1
12 2304 1 1 10 LYS HZ2 H 9.764 -17.046 -4.717 1.00 . A A . 10 LYS HZ2 1 1
12 2305 1 1 10 LYS HZ3 H 8.825 -16.559 -6.037 1.00 . A A . 10 LYS HZ3 1 1
12 2306 1 1 10 LYS N N 5.888 -11.773 -1.939 1.00 . A A . 10 LYS N 1 1
12 2307 1 1 10 LYS NZ N 8.793 -16.879 -5.048 1.00 . A A . 10 LYS NZ 1 1
12 2308 1 1 10 LYS O O 3.387 -12.732 -1.318 1.00 . A A . 10 LYS O 1 1
12 2309 1 1 11 . C C 0.674 -11.755 -2.569 1.00 . A A . 11 DBB C 1 1
12 2310 1 1 11 . CA C 1.377 -13.016 -3.102 1.00 . A A . 11 DBB CA 1 1
12 2311 1 1 11 . CB C 0.644 -13.602 -4.326 1.00 . A A . 11 DBB CB 1 1
12 2312 1 1 11 . CG C -0.751 -14.047 -3.919 1.00 . A A . 11 DBB CG 1 1
12 2313 1 1 11 . H H 3.033 -12.742 -4.411 1.00 . A A . 11 DBB H 1 1
12 2314 1 1 11 . HA H 1.358 -13.760 -2.332 1.00 . A A . 11 DBB HA 1 1
12 2315 1 1 11 . HB2 H 1.190 -14.482 -4.591 1.00 . A A . 11 DBB HB2 1 1
12 2316 1 1 11 . HG1 H -0.668 -14.776 -3.128 1.00 . A A . 11 DBB HG1 1 1
12 2317 1 1 11 . HG2 H -1.251 -14.490 -4.768 1.00 . A A . 11 DBB HG2 1 1
12 2318 1 1 11 . HG3 H -1.313 -13.196 -3.569 1.00 . A A . 11 DBB HG3 1 1
12 2319 1 1 11 . N N 2.769 -12.797 -3.465 1.00 . A A . 11 DBB N 1 1
12 2320 1 1 11 . O O 1.010 -10.660 -3.021 1.00 . A A . 11 DBB O 1 1
12 2321 1 1 12 CYS C C -0.241 -9.999 -0.123 1.00 . A A . 12 CYS C 1 1
12 2322 1 1 12 CYS CA C -1.051 -10.758 -1.171 1.00 . A A . 12 CYS CA 1 1
12 2323 1 1 12 CYS CB C -2.379 -11.219 -0.569 1.00 . A A . 12 CYS CB 1 1
12 2324 1 1 12 CYS H H -0.524 -12.800 -1.356 1.00 . A A . 12 CYS H 1 1
12 2325 1 1 12 CYS HA H -1.252 -10.097 -2.000 1.00 . A A . 12 CYS HA 1 1
12 2326 1 1 12 CYS HB2 H -2.197 -11.630 0.414 1.00 . A A . 12 CYS HB2 1 1
12 2327 1 1 12 CYS HB3 H -3.041 -10.370 -0.481 1.00 . A A . 12 CYS HB3 1 1
12 2328 1 1 12 CYS N N -0.302 -11.900 -1.679 1.00 . A A . 12 CYS N 1 1
12 2329 1 1 12 CYS O O -0.674 -9.846 1.019 1.00 . A A . 12 CYS O 1 1
12 2330 1 1 12 CYS SG S -3.238 -12.492 -1.549 1.00 . A A . 12 CYS SG 1 1
12 2331 1 1 13 ALA C C 2.268 -7.477 -0.253 1.00 . A A . 13 ALA C 1 1
12 2332 1 1 13 ALA CA C 1.805 -8.783 0.383 1.00 . A A . 13 ALA CA 1 1
12 2333 1 1 13 ALA CB C 3.003 -9.633 0.782 1.00 . A A . 13 ALA CB 1 1
12 2334 1 1 13 ALA H H 1.226 -9.682 -1.443 1.00 . A A . 13 ALA H 1 1
12 2335 1 1 13 ALA HA H 1.242 -8.557 1.277 1.00 . A A . 13 ALA HA 1 1
12 2336 1 1 13 ALA HB1 H 3.564 -9.900 -0.102 1.00 . A A . 13 ALA HB1 1 1
12 2337 1 1 13 ALA HB2 H 3.635 -9.071 1.453 1.00 . A A . 13 ALA HB2 1 1
12 2338 1 1 13 ALA HB3 H 2.660 -10.530 1.275 1.00 . A A . 13 ALA HB3 1 1
12 2339 1 1 13 ALA N N 0.936 -9.527 -0.520 1.00 . A A . 13 ALA N 1 1
12 2340 1 1 13 ALA O O 2.409 -6.474 0.445 1.00 . A A . 13 ALA O 1 1
12 2341 1 1 14 ALA C C 2.740 -6.692 -3.858 1.00 . A A . 14 ALA C 1 1
12 2342 1 1 14 ALA CA C 2.938 -6.355 -2.313 1.00 . A A . 14 ALA CA 1 1
12 2343 1 1 14 ALA CB C 4.360 -6.001 -2.080 1.00 . A A . 14 ALA CB 1 1
12 2344 1 1 14 ALA H H 2.356 -8.357 -2.025 1.00 . A A . 14 ALA H 1 1
12 2345 1 1 14 ALA HA H 2.272 -5.533 -2.128 1.00 . A A . 14 ALA HA 1 1
12 2346 1 1 14 ALA HB1 H 4.852 -6.792 -1.533 1.00 . A A . 14 ALA HB1 1 1
12 2347 1 1 14 ALA HB2 H 4.822 -5.901 -3.051 1.00 . A A . 14 ALA HB2 1 1
12 2348 1 1 14 ALA N N 2.496 -7.510 -1.552 1.00 . A A . 14 ALA N 1 1
12 2349 1 1 14 ALA O O 2.183 -5.894 -4.611 1.00 . A A . 14 ALA O 1 1
12 2350 1 1 15 SER C C 1.681 -8.482 -6.074 1.00 . A A . 15 SER C 1 1
12 2351 1 1 15 SER CA C 3.136 -8.275 -5.664 1.00 . A A . 15 SER CA 1 1
12 2352 1 1 15 SER CB C 3.929 -9.564 -5.887 1.00 . A A . 15 SER CB 1 1
12 2353 1 1 15 SER H H 3.661 -8.451 -3.621 1.00 . A A . 15 SER H 1 1
12 2354 1 1 15 SER HA H 3.561 -7.491 -6.273 1.00 . A A . 15 SER HA 1 1
12 2355 1 1 15 SER HB2 H 3.767 -9.914 -6.894 1.00 . A A . 15 SER HB2 1 1
12 2356 1 1 15 SER HB3 H 4.981 -9.365 -5.740 1.00 . A A . 15 SER HB3 1 1
12 2357 1 1 15 SER HG H 3.776 -10.325 -4.088 1.00 . A A . 15 SER HG 1 1
12 2358 1 1 15 SER N N 3.228 -7.858 -4.270 1.00 . A A . 15 SER N 1 1
12 2359 1 1 15 SER O O 1.124 -7.703 -6.849 1.00 . A A . 15 SER O 1 1
12 2360 1 1 15 SER OG O 3.524 -10.575 -4.980 1.00 . A A . 15 SER OG 1 1
12 2361 1 1 16 CYS C C -1.269 -9.001 -5.022 1.00 . A A . 16 CYS C 1 1
12 2362 1 1 16 CYS CA C -0.319 -9.852 -5.860 1.00 . A A . 16 CYS CA 1 1
12 2363 1 1 16 CYS CB C -0.597 -11.337 -5.615 1.00 . A A . 16 CYS CB 1 1
12 2364 1 1 16 CYS H H 1.567 -10.124 -4.938 1.00 . A A . 16 CYS H 1 1
12 2365 1 1 16 CYS HA H -0.484 -9.632 -6.903 1.00 . A A . 16 CYS HA 1 1
12 2366 1 1 16 CYS HB2 H -0.750 -11.497 -4.557 1.00 . A A . 16 CYS HB2 1 1
12 2367 1 1 16 CYS HB3 H -1.491 -11.621 -6.149 1.00 . A A . 16 CYS HB3 1 1
12 2368 1 1 16 CYS N N 1.070 -9.539 -5.550 1.00 . A A . 16 CYS N 1 1
12 2369 1 1 16 CYS O O -0.910 -8.532 -3.942 1.00 . A A . 16 CYS O 1 1
12 2370 1 1 16 CYS SG S 0.747 -12.443 -6.152 1.00 . A A . 16 CYS SG 1 1
12 2371 1 1 17 ALA C C -4.661 -8.879 -4.388 1.00 . A A . 17 ALA C 1 1
12 2372 1 1 17 ALA CA C -3.484 -8.014 -4.825 1.00 . A A . 17 ALA CA 1 1
12 2373 1 1 17 ALA CB C -3.966 -6.871 -5.706 1.00 . A A . 17 ALA CB 1 1
12 2374 1 1 17 ALA H H -2.709 -9.205 -6.393 1.00 . A A . 17 ALA H 1 1
12 2375 1 1 17 ALA HA H -3.018 -7.587 -3.948 1.00 . A A . 17 ALA HA 1 1
12 2376 1 1 17 ALA HB1 H -3.679 -7.061 -6.730 1.00 . A A . 17 ALA HB1 1 1
12 2377 1 1 17 ALA HB2 H -5.041 -6.795 -5.641 1.00 . A A . 17 ALA HB2 1 1
12 2378 1 1 17 ALA HB3 H -3.518 -5.946 -5.373 1.00 . A A . 17 ALA HB3 1 1
12 2379 1 1 17 ALA N N -2.482 -8.806 -5.527 1.00 . A A . 17 ALA N 1 1
12 2380 1 1 17 ALA O O -5.669 -8.940 -5.091 1.00 . A A . 17 ALA O 1 1
12 2381 1 1 18 ALA C C -6.580 -9.461 -1.913 1.00 . A A . 18 ALA C 1 1
12 2382 1 1 18 ALA CA C -5.540 -10.389 -2.686 1.00 . A A . 18 ALA CA 1 1
12 2383 1 1 18 ALA CB C -5.009 -11.401 -1.739 1.00 . A A . 18 ALA CB 1 1
12 2384 1 1 18 ALA H H -3.675 -9.416 -2.756 1.00 . A A . 18 ALA H 1 1
12 2385 1 1 18 ALA HA H -6.110 -10.829 -3.483 1.00 . A A . 18 ALA HA 1 1
12 2386 1 1 18 ALA HB1 H -5.019 -11.006 -0.733 1.00 . A A . 18 ALA HB1 1 1
12 2387 1 1 18 ALA HB2 H -5.666 -12.256 -1.791 1.00 . A A . 18 ALA HB2 1 1
12 2388 1 1 18 ALA N N -4.516 -9.527 -3.247 1.00 . A A . 18 ALA N 1 1
12 2389 1 1 18 ALA O O -6.261 -8.889 -0.871 1.00 . A A . 18 ALA O 1 1
12 2390 1 1 19 SER C C -10.051 -9.314 -1.535 1.00 . A A . 19 SER C 1 1
12 2391 1 1 19 SER CA C -8.813 -8.492 -1.878 1.00 . A A . 19 SER CA 1 1
12 2392 1 1 19 SER CB C -9.188 -7.359 -2.835 1.00 . A A . 19 SER CB 1 1
12 2393 1 1 19 SER H H -7.973 -9.815 -3.303 1.00 . A A . 19 SER H 1 1
12 2394 1 1 19 SER HA H -8.413 -8.068 -0.969 1.00 . A A . 19 SER HA 1 1
12 2395 1 1 19 SER HB2 H -9.822 -6.653 -2.321 1.00 . A A . 19 SER HB2 1 1
12 2396 1 1 19 SER HB3 H -8.289 -6.860 -3.168 1.00 . A A . 19 SER HB3 1 1
12 2397 1 1 19 SER HG H -9.327 -7.767 -4.746 1.00 . A A . 19 SER HG 1 1
12 2398 1 1 19 SER N N -7.779 -9.334 -2.471 1.00 . A A . 19 SER N 1 1
12 2399 1 1 19 SER O O -11.179 -8.877 -1.757 1.00 . A A . 19 SER O 1 1
12 2400 1 1 19 SER OG O -9.881 -7.855 -3.967 1.00 . A A . 19 SER OG 1 1
13 2401 1 1 1 ALA C C 2.461 -0.978 -1.206 1.00 . A A . 1 ALA C 1 1
13 2402 1 1 1 ALA CA C 1.031 -0.904 -1.731 1.00 . A A . 1 ALA CA 1 1
13 2403 1 1 1 ALA CB C 0.726 0.498 -2.239 1.00 . A A . 1 ALA CB 1 1
13 2404 1 1 1 ALA H1 H 0.070 -0.808 0.151 1.00 . A A . 1 ALA H1 1 1
13 2405 1 1 1 ALA HA H 0.927 -1.591 -2.559 1.00 . A A . 1 ALA HA 1 1
13 2406 1 1 1 ALA HB1 H -0.150 0.879 -1.735 1.00 . A A . 1 ALA HB1 1 1
13 2407 1 1 1 ALA HB2 H 1.567 1.144 -2.039 1.00 . A A . 1 ALA HB2 1 1
13 2408 1 1 1 ALA HB3 H 0.543 0.463 -3.303 1.00 . A A . 1 ALA HB3 1 1
13 2409 1 1 1 ALA N N 0.073 -1.288 -0.703 1.00 . A A . 1 ALA N 1 1
13 2410 1 1 1 ALA O O 2.814 -0.303 -0.238 1.00 . A A . 1 ALA O 1 1
13 2411 1 1 2 CYS C C 5.600 -1.169 -2.357 1.00 . A A . 2 CYS C 1 1
13 2412 1 1 2 CYS CA C 4.672 -1.967 -1.446 1.00 . A A . 2 CYS CA 1 1
13 2413 1 1 2 CYS CB C 5.061 -3.446 -1.472 1.00 . A A . 2 CYS CB 1 1
13 2414 1 1 2 CYS H H 2.941 -2.315 -2.613 1.00 . A A . 2 CYS H 1 1
13 2415 1 1 2 CYS HA H 4.772 -1.596 -0.437 1.00 . A A . 2 CYS HA 1 1
13 2416 1 1 2 CYS HB2 H 5.998 -3.573 -0.949 1.00 . A A . 2 CYS HB2 1 1
13 2417 1 1 2 CYS HB3 H 4.296 -4.021 -0.973 1.00 . A A . 2 CYS HB3 1 1
13 2418 1 1 2 CYS N N 3.281 -1.803 -1.849 1.00 . A A . 2 CYS N 1 1
13 2419 1 1 2 CYS O O 5.149 -0.344 -3.151 1.00 . A A . 2 CYS O 1 1
13 2420 1 1 2 CYS SG S 5.267 -4.131 -3.147 1.00 . A A . 2 CYS SG 1 1
13 2421 1 1 3 GLY C C 8.349 -1.552 -4.229 1.00 . A A . 3 GLY C 1 1
13 2422 1 1 3 GLY CA C 7.871 -0.720 -3.056 1.00 . A A . 3 GLY CA 1 1
13 2423 1 1 3 GLY H H 7.202 -2.091 -1.587 1.00 . A A . 3 GLY H 1 1
13 2424 1 1 3 GLY HA2 H 7.421 0.187 -3.431 1.00 . A A . 3 GLY HA2 1 1
13 2425 1 1 3 GLY HA3 H 8.722 -0.461 -2.443 1.00 . A A . 3 GLY HA3 1 1
13 2426 1 1 3 GLY N N 6.900 -1.422 -2.237 1.00 . A A . 3 GLY N 1 1
13 2427 1 1 3 GLY O O 8.575 -1.039 -5.326 1.00 . A A . 3 GLY O 1 1
13 2428 1 1 4 . C C 10.480 -4.008 -5.023 1.00 . A A . 4 DBB C 1 1
13 2429 1 1 4 . CA C 8.973 -3.701 -5.084 1.00 . A A . 4 DBB CA 1 1
13 2430 1 1 4 . CB C 8.129 -4.992 -5.072 1.00 . A A . 4 DBB CB 1 1
13 2431 1 1 4 . CG C 8.435 -5.813 -6.314 1.00 . A A . 4 DBB CG 1 1
13 2432 1 1 4 . H H 8.319 -3.218 -3.117 1.00 . A A . 4 DBB H 1 1
13 2433 1 1 4 . HA H 8.771 -3.197 -6.008 1.00 . A A . 4 DBB HA 1 1
13 2434 1 1 4 . HB2 H 7.113 -4.669 -5.150 1.00 . A A . 4 DBB HB2 1 1
13 2435 1 1 4 . HG1 H 9.479 -6.085 -6.303 1.00 . A A . 4 DBB HG1 1 1
13 2436 1 1 4 . HG2 H 8.222 -5.227 -7.196 1.00 . A A . 4 DBB HG2 1 1
13 2437 1 1 4 . HG3 H 7.829 -6.705 -6.314 1.00 . A A . 4 DBB HG3 1 1
13 2438 1 1 4 . N N 8.509 -2.842 -4.006 1.00 . A A . 4 DBB N 1 1
13 2439 1 1 4 . O O 10.964 -4.360 -3.948 1.00 . A A . 4 DBB O 1 1
13 2440 1 1 5 GLY C C 12.873 -5.629 -6.745 1.00 . A A . 5 GLY C 1 1
13 2441 1 1 5 GLY CA C 12.603 -4.260 -6.153 1.00 . A A . 5 GLY CA 1 1
13 2442 1 1 5 GLY H H 10.751 -3.640 -6.972 1.00 . A A . 5 GLY H 1 1
13 2443 1 1 5 GLY HA2 H 13.133 -3.517 -6.731 1.00 . A A . 5 GLY HA2 1 1
13 2444 1 1 5 GLY HA3 H 12.972 -4.240 -5.137 1.00 . A A . 5 GLY HA3 1 1
13 2445 1 1 5 GLY N N 11.190 -3.928 -6.144 1.00 . A A . 5 GLY N 1 1
13 2446 1 1 5 GLY O O 12.649 -5.916 -7.917 1.00 . A A . 5 GLY O 1 1
13 2447 1 1 6 . C C 12.314 -8.741 -6.257 1.00 . A A . 6 IAS C 1 1
13 2448 1 1 6 . CA C 13.585 -7.917 -6.357 1.00 . A A . 6 IAS CA 1 1
13 2449 1 1 6 . CB C 14.749 -8.627 -5.641 1.00 . A A . 6 IAS CB 1 1
13 2450 1 1 6 . CG C 14.661 -8.555 -4.123 1.00 . A A . 6 IAS CG 1 1
13 2451 1 1 6 . H H 13.574 -6.326 -4.958 1.00 . A A . 6 IAS H 1 1
13 2452 1 1 6 . HA H 13.806 -7.878 -7.417 1.00 . A A . 6 IAS HA 1 1
13 2453 1 1 6 . HB2 H 15.665 -8.123 -5.912 1.00 . A A . 6 IAS HB2 1 1
13 2454 1 1 6 . HB3 H 14.791 -9.652 -5.976 1.00 . A A . 6 IAS HB3 1 1
13 2455 1 1 6 . HXT H 12.124 -10.645 -6.515 1.00 . A A . 6 IAS HXT 1 1
13 2456 1 1 6 . N N 13.387 -6.548 -5.911 1.00 . A A . 6 IAS N 1 1
13 2457 1 1 6 . O O 11.399 -8.499 -5.511 1.00 . A A . 6 IAS O 1 1
13 2458 1 1 6 . OD1 O 15.473 -7.912 -3.459 1.00 . A A . 6 IAS OD1 1 1
13 2459 1 1 6 . OXT O 12.382 -9.851 -7.008 1.00 . A A . 6 IAS OXT 1 1
13 2460 1 1 7 GLY C C 12.048 -8.912 -1.735 1.00 . A A . 7 GLY C 1 1
13 2461 1 1 7 GLY CA C 13.469 -9.253 -2.138 1.00 . A A . 7 GLY CA 1 1
13 2462 1 1 7 GLY H H 13.040 -9.731 -4.156 1.00 . A A . 7 GLY H 1 1
13 2463 1 1 7 GLY HA2 H 13.712 -10.237 -1.766 1.00 . A A . 7 GLY HA2 1 1
13 2464 1 1 7 GLY HA3 H 14.140 -8.535 -1.690 1.00 . A A . 7 GLY HA3 1 1
13 2465 1 1 7 GLY N N 13.657 -9.236 -3.577 1.00 . A A . 7 GLY N 1 1
13 2466 1 1 7 GLY O O 11.591 -9.297 -0.658 1.00 . A A . 7 GLY O 1 1
13 2467 1 1 8 CYS C C 9.125 -9.000 -1.939 1.00 . A A . 8 CYS C 1 1
13 2468 1 1 8 CYS CA C 9.971 -7.792 -2.329 1.00 . A A . 8 CYS CA 1 1
13 2469 1 1 8 CYS CB C 9.364 -7.105 -3.554 1.00 . A A . 8 CYS CB 1 1
13 2470 1 1 8 CYS H H 11.767 -7.910 -3.442 1.00 . A A . 8 CYS H 1 1
13 2471 1 1 8 CYS HA H 9.982 -7.095 -1.505 1.00 . A A . 8 CYS HA 1 1
13 2472 1 1 8 CYS HB2 H 10.121 -6.496 -4.027 1.00 . A A . 8 CYS HB2 1 1
13 2473 1 1 8 CYS HB3 H 9.029 -7.859 -4.250 1.00 . A A . 8 CYS HB3 1 1
13 2474 1 1 8 CYS N N 11.347 -8.187 -2.600 1.00 . A A . 8 CYS N 1 1
13 2475 1 1 8 CYS O O 9.482 -10.141 -2.230 1.00 . A A . 8 CYS O 1 1
13 2476 1 1 8 CYS SG S 7.945 -6.027 -3.176 1.00 . A A . 8 CYS SG 1 1
13 2477 1 1 9 ALA C C 6.123 -10.177 -1.960 1.00 . A A . 9 ALA C 1 1
13 2478 1 1 9 ALA CA C 7.102 -9.806 -0.851 1.00 . A A . 9 ALA CA 1 1
13 2479 1 1 9 ALA CB C 6.349 -9.389 0.403 1.00 . A A . 9 ALA CB 1 1
13 2480 1 1 9 ALA H H 7.769 -7.811 -1.076 1.00 . A A . 9 ALA H 1 1
13 2481 1 1 9 ALA HA H 7.702 -10.672 -0.610 1.00 . A A . 9 ALA HA 1 1
13 2482 1 1 9 ALA HB1 H 5.757 -8.511 0.191 1.00 . A A . 9 ALA HB1 1 1
13 2483 1 1 9 ALA HB2 H 5.700 -10.194 0.717 1.00 . A A . 9 ALA HB2 1 1
13 2484 1 1 9 ALA HB3 H 7.054 -9.167 1.189 1.00 . A A . 9 ALA HB3 1 1
13 2485 1 1 9 ALA N N 8.001 -8.741 -1.279 1.00 . A A . 9 ALA N 1 1
13 2486 1 1 9 ALA O O 5.786 -9.350 -2.807 1.00 . A A . 9 ALA O 1 1
13 2487 1 1 10 LYS C C 3.333 -12.060 -2.362 1.00 . A A . 10 LYS C 1 1
13 2488 1 1 10 LYS CA C 4.730 -11.908 -2.954 1.00 . A A . 10 LYS CA 1 1
13 2489 1 1 10 LYS CB C 5.202 -13.247 -3.525 1.00 . A A . 10 LYS CB 1 1
13 2490 1 1 10 LYS CD C 6.806 -14.312 -5.139 1.00 . A A . 10 LYS CD 1 1
13 2491 1 1 10 LYS CE C 5.948 -14.118 -6.380 1.00 . A A . 10 LYS CE 1 1
13 2492 1 1 10 LYS CG C 6.592 -13.192 -4.135 1.00 . A A . 10 LYS CG 1 1
13 2493 1 1 10 LYS H H 5.977 -12.040 -1.249 1.00 . A A . 10 LYS H 1 1
13 2494 1 1 10 LYS HA H 4.693 -11.180 -3.751 1.00 . A A . 10 LYS HA 1 1
13 2495 1 1 10 LYS HB2 H 5.208 -13.981 -2.732 1.00 . A A . 10 LYS HB2 1 1
13 2496 1 1 10 LYS HB3 H 4.509 -13.563 -4.291 1.00 . A A . 10 LYS HB3 1 1
13 2497 1 1 10 LYS HD2 H 7.845 -14.329 -5.432 1.00 . A A . 10 LYS HD2 1 1
13 2498 1 1 10 LYS HD3 H 6.545 -15.254 -4.676 1.00 . A A . 10 LYS HD3 1 1
13 2499 1 1 10 LYS HE2 H 4.914 -14.277 -6.116 1.00 . A A . 10 LYS HE2 1 1
13 2500 1 1 10 LYS HE3 H 6.078 -13.107 -6.737 1.00 . A A . 10 LYS HE3 1 1
13 2501 1 1 10 LYS HG2 H 6.719 -12.245 -4.637 1.00 . A A . 10 LYS HG2 1 1
13 2502 1 1 10 LYS HG3 H 7.325 -13.284 -3.346 1.00 . A A . 10 LYS HG3 1 1
13 2503 1 1 10 LYS HZ1 H 7.357 -15.104 -7.567 1.00 . A A . 10 LYS HZ1 1 1
13 2504 1 1 10 LYS HZ2 H 5.908 -14.757 -8.369 1.00 . A A . 10 LYS HZ2 1 1
13 2505 1 1 10 LYS HZ3 H 5.971 -16.020 -7.245 1.00 . A A . 10 LYS HZ3 1 1
13 2506 1 1 10 LYS N N 5.671 -11.426 -1.950 1.00 . A A . 10 LYS N 1 1
13 2507 1 1 10 LYS NZ N 6.322 -15.067 -7.466 1.00 . A A . 10 LYS NZ 1 1
13 2508 1 1 10 LYS O O 3.066 -11.646 -1.233 1.00 . A A . 10 LYS O 1 1
13 2509 1 1 11 . C C 0.432 -11.534 -2.131 1.00 . A A . 11 DBB C 1 1
13 2510 1 1 11 . CA C 1.082 -12.836 -2.631 1.00 . A A . 11 DBB CA 1 1
13 2511 1 1 11 . CB C 0.244 -13.499 -3.743 1.00 . A A . 11 DBB CB 1 1
13 2512 1 1 11 . CG C -1.113 -13.901 -3.189 1.00 . A A . 11 DBB CG 1 1
13 2513 1 1 11 . H H 2.686 -12.976 -4.023 1.00 . A A . 11 DBB H 1 1
13 2514 1 1 11 . HA H 1.126 -13.524 -1.811 1.00 . A A . 11 DBB HA 1 1
13 2515 1 1 11 . HB2 H 0.763 -14.401 -3.991 1.00 . A A . 11 DBB HB2 1 1
13 2516 1 1 11 . HG1 H -1.639 -14.474 -3.936 1.00 . A A . 11 DBB HG1 1 1
13 2517 1 1 11 . HG2 H -1.680 -13.015 -2.946 1.00 . A A . 11 DBB HG2 1 1
13 2518 1 1 11 . HG3 H -0.976 -14.500 -2.303 1.00 . A A . 11 DBB HG3 1 1
13 2519 1 1 11 . N N 2.438 -12.657 -3.125 1.00 . A A . 11 DBB N 1 1
13 2520 1 1 11 . O O 0.649 -10.493 -2.752 1.00 . A A . 11 DBB O 1 1
13 2521 1 1 12 CYS C C -0.134 -9.538 0.250 1.00 . A A . 12 CYS C 1 1
13 2522 1 1 12 CYS CA C -1.071 -10.411 -0.580 1.00 . A A . 12 CYS CA 1 1
13 2523 1 1 12 CYS CB C -2.282 -10.821 0.260 1.00 . A A . 12 CYS CB 1 1
13 2524 1 1 12 CYS H H -0.509 -12.451 -0.623 1.00 . A A . 12 CYS H 1 1
13 2525 1 1 12 CYS HA H -1.411 -9.842 -1.432 1.00 . A A . 12 CYS HA 1 1
13 2526 1 1 12 CYS HB2 H -2.873 -11.532 -0.298 1.00 . A A . 12 CYS HB2 1 1
13 2527 1 1 12 CYS HB3 H -1.936 -11.286 1.172 1.00 . A A . 12 CYS HB3 1 1
13 2528 1 1 12 CYS N N -0.376 -11.592 -1.078 1.00 . A A . 12 CYS N 1 1
13 2529 1 1 12 CYS O O -0.399 -9.264 1.420 1.00 . A A . 12 CYS O 1 1
13 2530 1 1 12 CYS SG S -3.372 -9.436 0.721 1.00 . A A . 12 CYS SG 1 1
13 2531 1 1 13 ALA C C 2.342 -7.077 -0.556 1.00 . A A . 13 ALA C 1 1
13 2532 1 1 13 ALA CA C 1.936 -8.261 0.316 1.00 . A A . 13 ALA CA 1 1
13 2533 1 1 13 ALA CB C 3.160 -9.077 0.704 1.00 . A A . 13 ALA CB 1 1
13 2534 1 1 13 ALA H H 1.117 -9.356 -1.299 1.00 . A A . 13 ALA H 1 1
13 2535 1 1 13 ALA HA H 1.480 -7.888 1.222 1.00 . A A . 13 ALA HA 1 1
13 2536 1 1 13 ALA HB1 H 2.864 -9.875 1.369 1.00 . A A . 13 ALA HB1 1 1
13 2537 1 1 13 ALA HB2 H 3.610 -9.496 -0.184 1.00 . A A . 13 ALA HB2 1 1
13 2538 1 1 13 ALA HB3 H 3.874 -8.439 1.203 1.00 . A A . 13 ALA HB3 1 1
13 2539 1 1 13 ALA N N 0.961 -9.104 -0.365 1.00 . A A . 13 ALA N 1 1
13 2540 1 1 13 ALA O O 2.575 -5.987 -0.035 1.00 . A A . 13 ALA O 1 1
13 2541 1 1 14 ALA C C 2.507 -6.886 -4.273 1.00 . A A . 14 ALA C 1 1
13 2542 1 1 14 ALA CA C 2.787 -6.291 -2.821 1.00 . A A . 14 ALA CA 1 1
13 2543 1 1 14 ALA CB C 4.211 -5.883 -2.740 1.00 . A A . 14 ALA CB 1 1
13 2544 1 1 14 ALA H H 2.215 -8.211 -2.175 1.00 . A A . 14 ALA H 1 1
13 2545 1 1 14 ALA HA H 2.113 -5.459 -2.736 1.00 . A A . 14 ALA HA 1 1
13 2546 1 1 14 ALA HB1 H 4.581 -6.031 -1.736 1.00 . A A . 14 ALA HB1 1 1
13 2547 1 1 14 ALA HB2 H 4.760 -6.521 -3.418 1.00 . A A . 14 ALA HB2 1 1
13 2548 1 1 14 ALA N N 2.419 -7.308 -1.853 1.00 . A A . 14 ALA N 1 1
13 2549 1 1 14 ALA O O 1.797 -6.282 -5.076 1.00 . A A . 14 ALA O 1 1
13 2550 1 1 15 SER C C 1.469 -8.872 -6.199 1.00 . A A . 15 SER C 1 1
13 2551 1 1 15 SER CA C 2.944 -8.681 -5.858 1.00 . A A . 15 SER CA 1 1
13 2552 1 1 15 SER CB C 3.661 -10.032 -5.875 1.00 . A A . 15 SER CB 1 1
13 2553 1 1 15 SER H H 3.652 -8.476 -3.873 1.00 . A A . 15 SER H 1 1
13 2554 1 1 15 SER HA H 3.392 -8.036 -6.598 1.00 . A A . 15 SER HA 1 1
13 2555 1 1 15 SER HB2 H 4.697 -9.890 -5.604 1.00 . A A . 15 SER HB2 1 1
13 2556 1 1 15 SER HB3 H 3.191 -10.696 -5.164 1.00 . A A . 15 SER HB3 1 1
13 2557 1 1 15 SER HG H 4.491 -10.711 -7.515 1.00 . A A . 15 SER HG 1 1
13 2558 1 1 15 SER N N 3.097 -8.043 -4.556 1.00 . A A . 15 SER N 1 1
13 2559 1 1 15 SER O O 0.980 -8.355 -7.204 1.00 . A A . 15 SER O 1 1
13 2560 1 1 15 SER OG O 3.603 -10.624 -7.161 1.00 . A A . 15 SER OG 1 1
13 2561 1 1 16 CYS C C -1.511 -8.901 -4.763 1.00 . A A . 16 CYS C 1 1
13 2562 1 1 16 CYS CA C -0.655 -9.878 -5.564 1.00 . A A . 16 CYS CA 1 1
13 2563 1 1 16 CYS CB C -0.994 -11.316 -5.166 1.00 . A A . 16 CYS CB 1 1
13 2564 1 1 16 CYS H H 1.210 -10.002 -4.569 1.00 . A A . 16 CYS H 1 1
13 2565 1 1 16 CYS HA H -0.865 -9.745 -6.614 1.00 . A A . 16 CYS HA 1 1
13 2566 1 1 16 CYS HB2 H -1.081 -11.373 -4.090 1.00 . A A . 16 CYS HB2 1 1
13 2567 1 1 16 CYS HB3 H -1.938 -11.591 -5.612 1.00 . A A . 16 CYS HB3 1 1
13 2568 1 1 16 CYS N N 0.764 -9.617 -5.354 1.00 . A A . 16 CYS N 1 1
13 2569 1 1 16 CYS O O -1.052 -8.315 -3.783 1.00 . A A . 16 CYS O 1 1
13 2570 1 1 16 CYS SG S 0.246 -12.544 -5.687 1.00 . A A . 16 CYS SG 1 1
13 2571 1 1 17 ALA C C -4.793 -8.603 -3.811 1.00 . A A . 17 ALA C 1 1
13 2572 1 1 17 ALA CA C -3.681 -7.829 -4.511 1.00 . A A . 17 ALA CA 1 1
13 2573 1 1 17 ALA CB C -4.269 -6.834 -5.501 1.00 . A A . 17 ALA CB 1 1
13 2574 1 1 17 ALA H H -3.067 -9.227 -5.975 1.00 . A A . 17 ALA H 1 1
13 2575 1 1 17 ALA HA H -3.121 -7.274 -3.771 1.00 . A A . 17 ALA HA 1 1
13 2576 1 1 17 ALA HB1 H -4.132 -7.205 -6.506 1.00 . A A . 17 ALA HB1 1 1
13 2577 1 1 17 ALA HB2 H -5.323 -6.711 -5.303 1.00 . A A . 17 ALA HB2 1 1
13 2578 1 1 17 ALA HB3 H -3.768 -5.883 -5.396 1.00 . A A . 17 ALA HB3 1 1
13 2579 1 1 17 ALA N N -2.759 -8.732 -5.188 1.00 . A A . 17 ALA N 1 1
13 2580 1 1 17 ALA O O -5.879 -8.750 -4.370 1.00 . A A . 17 ALA O 1 1
13 2581 1 1 18 ALA C C -6.810 -8.999 -1.755 1.00 . A A . 18 ALA C 1 1
13 2582 1 1 18 ALA CA C -5.454 -9.834 -1.812 1.00 . A A . 18 ALA CA 1 1
13 2583 1 1 18 ALA CB C -4.988 -10.082 -0.425 1.00 . A A . 18 ALA CB 1 1
13 2584 1 1 18 ALA H H -3.613 -8.911 -2.250 1.00 . A A . 18 ALA H 1 1
13 2585 1 1 18 ALA HA H -5.714 -10.739 -2.328 1.00 . A A . 18 ALA HA 1 1
13 2586 1 1 18 ALA HB1 H -5.759 -9.802 0.279 1.00 . A A . 18 ALA HB1 1 1
13 2587 1 1 18 ALA HB2 H -4.800 -11.142 -0.341 1.00 . A A . 18 ALA HB2 1 1
13 2588 1 1 18 ALA N N -4.508 -9.079 -2.614 1.00 . A A . 18 ALA N 1 1
13 2589 1 1 18 ALA O O -6.903 -7.994 -1.051 1.00 . A A . 18 ALA O 1 1
13 2590 1 1 19 SER C C -9.817 -8.851 -1.242 1.00 . A A . 19 SER C 1 1
13 2591 1 1 19 SER CA C -9.087 -8.754 -2.578 1.00 . A A . 19 SER CA 1 1
13 2592 1 1 19 SER CB C -9.956 -9.345 -3.690 1.00 . A A . 19 SER CB 1 1
13 2593 1 1 19 SER H H -7.668 -10.250 -3.058 1.00 . A A . 19 SER H 1 1
13 2594 1 1 19 SER HA H -8.896 -7.714 -2.796 1.00 . A A . 19 SER HA 1 1
13 2595 1 1 19 SER HB2 H -10.740 -8.646 -3.941 1.00 . A A . 19 SER HB2 1 1
13 2596 1 1 19 SER HB3 H -9.344 -9.527 -4.562 1.00 . A A . 19 SER HB3 1 1
13 2597 1 1 19 SER HG H -10.423 -11.227 -3.968 1.00 . A A . 19 SER HG 1 1
13 2598 1 1 19 SER N N -7.803 -9.442 -2.519 1.00 . A A . 19 SER N 1 1
13 2599 1 1 19 SER O O -10.906 -8.302 -1.077 1.00 . A A . 19 SER O 1 1
13 2600 1 1 19 SER OG O -10.546 -10.567 -3.282 1.00 . A A . 19 SER OG 1 1
14 2601 1 1 1 ALA C C 1.827 -2.748 -2.462 1.00 . A A . 1 ALA C 1 1
14 2602 1 1 1 ALA CA C 1.007 -3.357 -3.595 1.00 . A A . 1 ALA CA 1 1
14 2603 1 1 1 ALA CB C 0.860 -2.362 -4.736 1.00 . A A . 1 ALA CB 1 1
14 2604 1 1 1 ALA H1 H -0.621 -3.477 -2.248 1.00 . A A . 1 ALA H1 1 1
14 2605 1 1 1 ALA HA H 1.526 -4.227 -3.973 1.00 . A A . 1 ALA HA 1 1
14 2606 1 1 1 ALA HB1 H 1.733 -1.727 -4.774 1.00 . A A . 1 ALA HB1 1 1
14 2607 1 1 1 ALA HB2 H 0.761 -2.897 -5.669 1.00 . A A . 1 ALA HB2 1 1
14 2608 1 1 1 ALA HB3 H -0.019 -1.756 -4.573 1.00 . A A . 1 ALA HB3 1 1
14 2609 1 1 1 ALA N N -0.304 -3.784 -3.123 1.00 . A A . 1 ALA N 1 1
14 2610 1 1 1 ALA O O 1.396 -1.792 -1.815 1.00 . A A . 1 ALA O 1 1
14 2611 1 1 2 CYS C C 4.956 -1.888 -1.738 1.00 . A A . 2 CYS C 1 1
14 2612 1 1 2 CYS CA C 3.889 -2.819 -1.170 1.00 . A A . 2 CYS CA 1 1
14 2613 1 1 2 CYS CB C 4.553 -3.993 -0.449 1.00 . A A . 2 CYS CB 1 1
14 2614 1 1 2 CYS H H 3.298 -4.066 -2.776 1.00 . A A . 2 CYS H 1 1
14 2615 1 1 2 CYS HA H 3.286 -2.268 -0.464 1.00 . A A . 2 CYS HA 1 1
14 2616 1 1 2 CYS HB2 H 5.010 -3.634 0.462 1.00 . A A . 2 CYS HB2 1 1
14 2617 1 1 2 CYS HB3 H 3.799 -4.727 -0.202 1.00 . A A . 2 CYS HB3 1 1
14 2618 1 1 2 CYS N N 3.009 -3.306 -2.226 1.00 . A A . 2 CYS N 1 1
14 2619 1 1 2 CYS O O 5.485 -1.029 -1.033 1.00 . A A . 2 CYS O 1 1
14 2620 1 1 2 CYS SG S 5.844 -4.831 -1.423 1.00 . A A . 2 CYS SG 1 1
14 2621 1 1 3 GLY C C 6.997 -1.958 -4.774 1.00 . A A . 3 GLY C 1 1
14 2622 1 1 3 GLY CA C 6.269 -1.233 -3.660 1.00 . A A . 3 GLY CA 1 1
14 2623 1 1 3 GLY H H 4.813 -2.765 -3.532 1.00 . A A . 3 GLY H 1 1
14 2624 1 1 3 GLY HA2 H 5.787 -0.358 -4.069 1.00 . A A . 3 GLY HA2 1 1
14 2625 1 1 3 GLY HA3 H 6.990 -0.921 -2.919 1.00 . A A . 3 GLY HA3 1 1
14 2626 1 1 3 GLY N N 5.267 -2.064 -3.019 1.00 . A A . 3 GLY N 1 1
14 2627 1 1 3 GLY O O 7.491 -1.345 -5.721 1.00 . A A . 3 GLY O 1 1
14 2628 1 1 4 . C C 9.271 -3.746 -5.768 1.00 . A A . 4 DBB C 1 1
14 2629 1 1 4 . CA C 7.761 -4.033 -5.697 1.00 . A A . 4 DBB CA 1 1
14 2630 1 1 4 . CB C 7.477 -5.531 -5.463 1.00 . A A . 4 DBB CB 1 1
14 2631 1 1 4 . CG C 7.998 -6.339 -6.640 1.00 . A A . 4 DBB CG 1 1
14 2632 1 1 4 . H H 6.665 -3.729 -3.898 1.00 . A A . 4 DBB H 1 1
14 2633 1 1 4 . HA H 7.326 -3.770 -6.640 1.00 . A A . 4 DBB HA 1 1
14 2634 1 1 4 . HB2 H 6.413 -5.623 -5.464 1.00 . A A . 4 DBB HB2 1 1
14 2635 1 1 4 . HG1 H 9.051 -6.525 -6.497 1.00 . A A . 4 DBB HG1 1 1
14 2636 1 1 4 . HG2 H 7.849 -5.782 -7.554 1.00 . A A . 4 DBB HG2 1 1
14 2637 1 1 4 . HG3 H 7.469 -7.277 -6.695 1.00 . A A . 4 DBB HG3 1 1
14 2638 1 1 4 . N N 7.071 -3.271 -4.669 1.00 . A A . 4 DBB N 1 1
14 2639 1 1 4 . O O 9.769 -3.492 -6.864 1.00 . A A . 4 DBB O 1 1
14 2640 1 1 5 GLY C C 12.182 -4.323 -5.558 1.00 . A A . 5 GLY C 1 1
14 2641 1 1 5 GLY CA C 11.385 -3.414 -4.642 1.00 . A A . 5 GLY CA 1 1
14 2642 1 1 5 GLY H H 9.520 -3.945 -3.791 1.00 . A A . 5 GLY H 1 1
14 2643 1 1 5 GLY HA2 H 11.511 -2.393 -4.967 1.00 . A A . 5 GLY HA2 1 1
14 2644 1 1 5 GLY HA3 H 11.768 -3.512 -3.637 1.00 . A A . 5 GLY HA3 1 1
14 2645 1 1 5 GLY N N 9.970 -3.734 -4.637 1.00 . A A . 5 GLY N 1 1
14 2646 1 1 5 GLY O O 12.415 -4.062 -6.735 1.00 . A A . 5 GLY O 1 1
14 2647 1 1 6 . C C 12.382 -7.384 -6.570 1.00 . A A . 6 IAS C 1 1
14 2648 1 1 6 . CA C 13.325 -6.446 -5.839 1.00 . A A . 6 IAS CA 1 1
14 2649 1 1 6 . CB C 14.394 -7.243 -5.069 1.00 . A A . 6 IAS CB 1 1
14 2650 1 1 6 . CG C 13.862 -7.909 -3.808 1.00 . A A . 6 IAS CG 1 1
14 2651 1 1 6 . H H 12.457 -5.684 -4.062 1.00 . A A . 6 IAS H 1 1
14 2652 1 1 6 . HA H 13.812 -5.906 -6.642 1.00 . A A . 6 IAS HA 1 1
14 2653 1 1 6 . HB2 H 15.157 -6.551 -4.743 1.00 . A A . 6 IAS HB2 1 1
14 2654 1 1 6 . HB3 H 14.832 -7.972 -5.734 1.00 . A A . 6 IAS HB3 1 1
14 2655 1 1 6 . HXT H 10.888 -8.542 -6.177 1.00 . A A . 6 IAS HXT 1 1
14 2656 1 1 6 . N N 12.641 -5.463 -5.016 1.00 . A A . 6 IAS N 1 1
14 2657 1 1 6 . O O 12.271 -7.443 -7.768 1.00 . A A . 6 IAS O 1 1
14 2658 1 1 6 . OD1 O 13.839 -7.321 -2.728 1.00 . A A . 6 IAS OD1 1 1
14 2659 1 1 6 . OXT O 11.587 -8.051 -5.720 1.00 . A A . 6 IAS OXT 1 1
14 2660 1 1 7 GLY C C 11.626 -9.317 -2.292 1.00 . A A . 7 GLY C 1 1
14 2661 1 1 7 GLY CA C 12.914 -9.908 -2.831 1.00 . A A . 7 GLY CA 1 1
14 2662 1 1 7 GLY H H 13.480 -9.579 -4.844 1.00 . A A . 7 GLY H 1 1
14 2663 1 1 7 GLY HA2 H 12.729 -10.925 -3.141 1.00 . A A . 7 GLY HA2 1 1
14 2664 1 1 7 GLY HA3 H 13.652 -9.911 -2.042 1.00 . A A . 7 GLY HA3 1 1
14 2665 1 1 7 GLY N N 13.437 -9.160 -3.959 1.00 . A A . 7 GLY N 1 1
14 2666 1 1 7 GLY O O 11.464 -9.163 -1.081 1.00 . A A . 7 GLY O 1 1
14 2667 1 1 8 CYS C C 8.442 -9.494 -2.386 1.00 . A A . 8 CYS C 1 1
14 2668 1 1 8 CYS CA C 9.428 -8.405 -2.801 1.00 . A A . 8 CYS CA 1 1
14 2669 1 1 8 CYS CB C 8.843 -7.584 -3.953 1.00 . A A . 8 CYS CB 1 1
14 2670 1 1 8 CYS H H 10.895 -9.131 -4.144 1.00 . A A . 8 CYS H 1 1
14 2671 1 1 8 CYS HA H 9.601 -7.754 -1.958 1.00 . A A . 8 CYS HA 1 1
14 2672 1 1 8 CYS HB2 H 9.651 -7.202 -4.559 1.00 . A A . 8 CYS HB2 1 1
14 2673 1 1 8 CYS HB3 H 8.217 -8.223 -4.558 1.00 . A A . 8 CYS HB3 1 1
14 2674 1 1 8 CYS N N 10.707 -8.984 -3.192 1.00 . A A . 8 CYS N 1 1
14 2675 1 1 8 CYS O O 8.384 -10.559 -2.999 1.00 . A A . 8 CYS O 1 1
14 2676 1 1 8 CYS SG S 7.835 -6.165 -3.417 1.00 . A A . 8 CYS SG 1 1
14 2677 1 1 9 ALA C C 5.749 -10.624 -1.961 1.00 . A A . 9 ALA C 1 1
14 2678 1 1 9 ALA CA C 6.684 -10.171 -0.846 1.00 . A A . 9 ALA CA 1 1
14 2679 1 1 9 ALA CB C 5.888 -9.561 0.299 1.00 . A A . 9 ALA CB 1 1
14 2680 1 1 9 ALA H H 7.762 -8.350 -0.894 1.00 . A A . 9 ALA H 1 1
14 2681 1 1 9 ALA HA H 7.216 -11.031 -0.464 1.00 . A A . 9 ALA HA 1 1
14 2682 1 1 9 ALA HB1 H 6.507 -8.851 0.828 1.00 . A A . 9 ALA HB1 1 1
14 2683 1 1 9 ALA HB2 H 5.019 -9.057 -0.096 1.00 . A A . 9 ALA HB2 1 1
14 2684 1 1 9 ALA HB3 H 5.576 -10.342 0.976 1.00 . A A . 9 ALA HB3 1 1
14 2685 1 1 9 ALA N N 7.669 -9.217 -1.341 1.00 . A A . 9 ALA N 1 1
14 2686 1 1 9 ALA O O 5.274 -9.812 -2.756 1.00 . A A . 9 ALA O 1 1
14 2687 1 1 10 LYS C C 3.164 -12.532 -2.541 1.00 . A A . 10 LYS C 1 1
14 2688 1 1 10 LYS CA C 4.607 -12.487 -3.034 1.00 . A A . 10 LYS CA 1 1
14 2689 1 1 10 LYS CB C 5.070 -13.894 -3.417 1.00 . A A . 10 LYS CB 1 1
14 2690 1 1 10 LYS CD C 7.329 -13.271 -4.321 1.00 . A A . 10 LYS CD 1 1
14 2691 1 1 10 LYS CE C 8.453 -13.900 -5.131 1.00 . A A . 10 LYS CE 1 1
14 2692 1 1 10 LYS CG C 5.991 -13.924 -4.624 1.00 . A A . 10 LYS CG 1 1
14 2693 1 1 10 LYS H H 5.894 -12.523 -1.354 1.00 . A A . 10 LYS H 1 1
14 2694 1 1 10 LYS HA H 4.658 -11.851 -3.904 1.00 . A A . 10 LYS HA 1 1
14 2695 1 1 10 LYS HB2 H 5.595 -14.328 -2.579 1.00 . A A . 10 LYS HB2 1 1
14 2696 1 1 10 LYS HB3 H 4.202 -14.498 -3.638 1.00 . A A . 10 LYS HB3 1 1
14 2697 1 1 10 LYS HD2 H 7.271 -12.220 -4.563 1.00 . A A . 10 LYS HD2 1 1
14 2698 1 1 10 LYS HD3 H 7.547 -13.388 -3.269 1.00 . A A . 10 LYS HD3 1 1
14 2699 1 1 10 LYS HE2 H 9.337 -13.952 -4.515 1.00 . A A . 10 LYS HE2 1 1
14 2700 1 1 10 LYS HE3 H 8.156 -14.897 -5.419 1.00 . A A . 10 LYS HE3 1 1
14 2701 1 1 10 LYS HG2 H 6.161 -14.951 -4.912 1.00 . A A . 10 LYS HG2 1 1
14 2702 1 1 10 LYS HG3 H 5.519 -13.393 -5.439 1.00 . A A . 10 LYS HG3 1 1
14 2703 1 1 10 LYS HZ1 H 9.783 -12.926 -6.414 1.00 . A A . 10 LYS HZ1 1 1
14 2704 1 1 10 LYS HZ2 H 8.256 -12.204 -6.334 1.00 . A A . 10 LYS HZ2 1 1
14 2705 1 1 10 LYS HZ3 H 8.467 -13.639 -7.203 1.00 . A A . 10 LYS HZ3 1 1
14 2706 1 1 10 LYS N N 5.486 -11.925 -2.016 1.00 . A A . 10 LYS N 1 1
14 2707 1 1 10 LYS NZ N 8.761 -13.112 -6.357 1.00 . A A . 10 LYS NZ 1 1
14 2708 1 1 10 LYS O O 2.858 -12.138 -1.415 1.00 . A A . 10 LYS O 1 1
14 2709 1 1 11 . C C 0.308 -11.746 -2.493 1.00 . A A . 11 DBB C 1 1
14 2710 1 1 11 . CA C 0.877 -13.087 -2.990 1.00 . A A . 11 DBB CA 1 1
14 2711 1 1 11 . CB C 0.065 -13.646 -4.176 1.00 . A A . 11 DBB CB 1 1
14 2712 1 1 11 . CG C -1.357 -13.941 -3.726 1.00 . A A . 11 DBB CG 1 1
14 2713 1 1 11 . H H 2.554 -13.322 -4.278 1.00 . A A . 11 DBB H 1 1
14 2714 1 1 11 . HA H 0.804 -13.798 -2.191 1.00 . A A . 11 DBB HA 1 1
14 2715 1 1 11 . HB2 H 0.520 -14.583 -4.416 1.00 . A A . 11 DBB HB2 1 1
14 2716 1 1 11 . HG1 H -1.889 -14.410 -4.540 1.00 . A A . 11 DBB HG1 1 1
14 2717 1 1 11 . HG2 H -1.849 -13.018 -3.456 1.00 . A A . 11 DBB HG2 1 1
14 2718 1 1 11 . HG3 H -1.336 -14.605 -2.878 1.00 . A A . 11 DBB HG3 1 1
14 2719 1 1 11 . N N 2.274 -13.016 -3.386 1.00 . A A . 11 DBB N 1 1
14 2720 1 1 11 . O O 0.783 -10.704 -2.945 1.00 . A A . 11 DBB O 1 1
14 2721 1 1 12 CYS C C -0.474 -9.861 -0.099 1.00 . A A . 12 CYS C 1 1
14 2722 1 1 12 CYS CA C -1.334 -10.537 -1.163 1.00 . A A . 12 CYS CA 1 1
14 2723 1 1 12 CYS CB C -2.724 -10.834 -0.598 1.00 . A A . 12 CYS CB 1 1
14 2724 1 1 12 CYS H H -1.042 -12.629 -1.310 1.00 . A A . 12 CYS H 1 1
14 2725 1 1 12 CYS HA H -1.432 -9.870 -2.006 1.00 . A A . 12 CYS HA 1 1
14 2726 1 1 12 CYS HB2 H -2.618 -11.297 0.372 1.00 . A A . 12 CYS HB2 1 1
14 2727 1 1 12 CYS HB3 H -3.267 -9.907 -0.491 1.00 . A A . 12 CYS HB3 1 1
14 2728 1 1 12 CYS N N -0.706 -11.766 -1.635 1.00 . A A . 12 CYS N 1 1
14 2729 1 1 12 CYS O O -0.920 -9.643 1.027 1.00 . A A . 12 CYS O 1 1
14 2730 1 1 12 CYS SG S -3.726 -11.948 -1.635 1.00 . A A . 12 CYS SG 1 1
14 2731 1 1 13 ALA C C 2.315 -7.647 -0.181 1.00 . A A . 13 ALA C 1 1
14 2732 1 1 13 ALA CA C 1.682 -8.880 0.457 1.00 . A A . 13 ALA CA 1 1
14 2733 1 1 13 ALA CB C 2.759 -9.856 0.906 1.00 . A A . 13 ALA CB 1 1
14 2734 1 1 13 ALA H H 1.058 -9.732 -1.377 1.00 . A A . 13 ALA H 1 1
14 2735 1 1 13 ALA HA H 1.122 -8.574 1.329 1.00 . A A . 13 ALA HA 1 1
14 2736 1 1 13 ALA HB1 H 2.295 -10.715 1.368 1.00 . A A . 13 ALA HB1 1 1
14 2737 1 1 13 ALA HB2 H 3.336 -10.174 0.050 1.00 . A A . 13 ALA HB2 1 1
14 2738 1 1 13 ALA HB3 H 3.410 -9.371 1.618 1.00 . A A . 13 ALA HB3 1 1
14 2739 1 1 13 ALA N N 0.761 -9.532 -0.465 1.00 . A A . 13 ALA N 1 1
14 2740 1 1 13 ALA O O 2.550 -6.655 0.509 1.00 . A A . 13 ALA O 1 1
14 2741 1 1 14 ALA C C 3.005 -6.992 -3.777 1.00 . A A . 14 ALA C 1 1
14 2742 1 1 14 ALA CA C 3.175 -6.645 -2.231 1.00 . A A . 14 ALA CA 1 1
14 2743 1 1 14 ALA CB C 4.617 -6.445 -1.944 1.00 . A A . 14 ALA CB 1 1
14 2744 1 1 14 ALA H H 2.355 -8.561 -1.937 1.00 . A A . 14 ALA H 1 1
14 2745 1 1 14 ALA HA H 2.597 -5.751 -2.089 1.00 . A A . 14 ALA HA 1 1
14 2746 1 1 14 ALA HB1 H 4.926 -7.091 -1.135 1.00 . A A . 14 ALA HB1 1 1
14 2747 1 1 14 ALA HB2 H 5.157 -6.715 -2.840 1.00 . A A . 14 ALA HB2 1 1
14 2748 1 1 14 ALA N N 2.578 -7.728 -1.471 1.00 . A A . 14 ALA N 1 1
14 2749 1 1 14 ALA O O 2.681 -6.124 -4.587 1.00 . A A . 14 ALA O 1 1
14 2750 1 1 15 SER C C 1.704 -8.731 -5.973 1.00 . A A . 15 SER C 1 1
14 2751 1 1 15 SER CA C 3.158 -8.692 -5.513 1.00 . A A . 15 SER CA 1 1
14 2752 1 1 15 SER CB C 3.793 -10.074 -5.674 1.00 . A A . 15 SER CB 1 1
14 2753 1 1 15 SER H H 3.507 -8.897 -3.434 1.00 . A A . 15 SER H 1 1
14 2754 1 1 15 SER HA H 3.698 -7.984 -6.124 1.00 . A A . 15 SER HA 1 1
14 2755 1 1 15 SER HB2 H 3.319 -10.767 -4.996 1.00 . A A . 15 SER HB2 1 1
14 2756 1 1 15 SER HB3 H 3.655 -10.414 -6.691 1.00 . A A . 15 SER HB3 1 1
14 2757 1 1 15 SER HG H 5.608 -9.397 -5.967 1.00 . A A . 15 SER HG 1 1
14 2758 1 1 15 SER N N 3.252 -8.251 -4.126 1.00 . A A . 15 SER N 1 1
14 2759 1 1 15 SER O O 1.258 -7.871 -6.733 1.00 . A A . 15 SER O 1 1
14 2760 1 1 15 SER OG O 5.181 -10.034 -5.390 1.00 . A A . 15 SER OG 1 1
14 2761 1 1 16 CYS C C -1.303 -8.885 -5.117 1.00 . A A . 16 CYS C 1 1
14 2762 1 1 16 CYS CA C -0.434 -9.889 -5.869 1.00 . A A . 16 CYS CA 1 1
14 2763 1 1 16 CYS CB C -0.907 -11.313 -5.571 1.00 . A A . 16 CYS CB 1 1
14 2764 1 1 16 CYS H H 1.382 -10.390 -4.904 1.00 . A A . 16 CYS H 1 1
14 2765 1 1 16 CYS HA H -0.526 -9.703 -6.929 1.00 . A A . 16 CYS HA 1 1
14 2766 1 1 16 CYS HB2 H -1.076 -11.413 -4.509 1.00 . A A . 16 CYS HB2 1 1
14 2767 1 1 16 CYS HB3 H -1.832 -11.495 -6.097 1.00 . A A . 16 CYS HB3 1 1
14 2768 1 1 16 CYS N N 0.969 -9.735 -5.507 1.00 . A A . 16 CYS N 1 1
14 2769 1 1 16 CYS O O -0.947 -8.432 -4.030 1.00 . A A . 16 CYS O 1 1
14 2770 1 1 16 CYS SG S 0.276 -12.608 -6.065 1.00 . A A . 16 CYS SG 1 1
14 2771 1 1 17 ALA C C -4.641 -8.291 -4.625 1.00 . A A . 17 ALA C 1 1
14 2772 1 1 17 ALA CA C -3.367 -7.595 -5.090 1.00 . A A . 17 ALA CA 1 1
14 2773 1 1 17 ALA CB C -3.700 -6.475 -6.065 1.00 . A A . 17 ALA CB 1 1
14 2774 1 1 17 ALA H H -2.674 -8.939 -6.571 1.00 . A A . 17 ALA H 1 1
14 2775 1 1 17 ALA HA H -2.874 -7.159 -4.233 1.00 . A A . 17 ALA HA 1 1
14 2776 1 1 17 ALA HB1 H -2.812 -5.891 -6.257 1.00 . A A . 17 ALA HB1 1 1
14 2777 1 1 17 ALA HB2 H -4.060 -6.899 -6.990 1.00 . A A . 17 ALA HB2 1 1
14 2778 1 1 17 ALA HB3 H -4.463 -5.842 -5.638 1.00 . A A . 17 ALA HB3 1 1
14 2779 1 1 17 ALA N N -2.445 -8.543 -5.705 1.00 . A A . 17 ALA N 1 1
14 2780 1 1 17 ALA O O -5.642 -8.274 -5.340 1.00 . A A . 17 ALA O 1 1
14 2781 1 1 18 ALA C C -6.638 -8.505 -2.152 1.00 . A A . 18 ALA C 1 1
14 2782 1 1 18 ALA CA C -5.709 -9.590 -2.858 1.00 . A A . 18 ALA CA 1 1
14 2783 1 1 18 ALA CB C -5.309 -10.603 -1.849 1.00 . A A . 18 ALA CB 1 1
14 2784 1 1 18 ALA H H -3.741 -8.847 -2.951 1.00 . A A . 18 ALA H 1 1
14 2785 1 1 18 ALA HA H -6.319 -10.003 -3.638 1.00 . A A . 18 ALA HA 1 1
14 2786 1 1 18 ALA HB1 H -5.210 -10.138 -0.879 1.00 . A A . 18 ALA HB1 1 1
14 2787 1 1 18 ALA HB2 H -6.100 -11.338 -1.812 1.00 . A A . 18 ALA HB2 1 1
14 2788 1 1 18 ALA N N -4.585 -8.887 -3.449 1.00 . A A . 18 ALA N 1 1
14 2789 1 1 18 ALA O O -7.854 -8.496 -2.342 1.00 . A A . 18 ALA O 1 1
14 2790 1 1 19 SER C C -7.583 -5.756 -1.580 1.00 . A A . 19 SER C 1 1
14 2791 1 1 19 SER CA C -6.764 -6.616 -0.621 1.00 . A A . 19 SER CA 1 1
14 2792 1 1 19 SER CB C -5.803 -5.735 0.178 1.00 . A A . 19 SER CB 1 1
14 2793 1 1 19 SER H H -5.053 -7.700 -1.237 1.00 . A A . 19 SER H 1 1
14 2794 1 1 19 SER HA H -7.437 -7.113 0.062 1.00 . A A . 19 SER HA 1 1
14 2795 1 1 19 SER HB2 H -5.361 -6.317 0.972 1.00 . A A . 19 SER HB2 1 1
14 2796 1 1 19 SER HB3 H -5.025 -5.370 -0.476 1.00 . A A . 19 SER HB3 1 1
14 2797 1 1 19 SER HG H -6.591 -4.769 1.689 1.00 . A A . 19 SER HG 1 1
14 2798 1 1 19 SER N N -6.025 -7.643 -1.347 1.00 . A A . 19 SER N 1 1
14 2799 1 1 19 SER O O -7.132 -5.432 -2.677 1.00 . A A . 19 SER O 1 1
14 2800 1 1 19 SER OG O -6.479 -4.627 0.746 1.00 . A A . 19 SER OG 1 1
15 2801 1 1 1 ALA C C 2.671 -1.042 0.052 1.00 . A A . 1 ALA C 1 1
15 2802 1 1 1 ALA CA C 1.410 -0.246 0.370 1.00 . A A . 1 ALA CA 1 1
15 2803 1 1 1 ALA CB C 0.884 -0.618 1.749 1.00 . A A . 1 ALA CB 1 1
15 2804 1 1 1 ALA H1 H 0.027 0.301 -1.135 1.00 . A A . 1 ALA H1 1 1
15 2805 1 1 1 ALA HA H 1.653 0.807 0.376 1.00 . A A . 1 ALA HA 1 1
15 2806 1 1 1 ALA HB1 H 1.709 -0.686 2.442 1.00 . A A . 1 ALA HB1 1 1
15 2807 1 1 1 ALA HB2 H 0.192 0.140 2.086 1.00 . A A . 1 ALA HB2 1 1
15 2808 1 1 1 ALA HB3 H 0.378 -1.570 1.696 1.00 . A A . 1 ALA HB3 1 1
15 2809 1 1 1 ALA N N 0.382 -0.466 -0.639 1.00 . A A . 1 ALA N 1 1
15 2810 1 1 1 ALA O O 3.270 -1.656 0.936 1.00 . A A . 1 ALA O 1 1
15 2811 1 1 2 CYS C C 4.835 -1.131 -2.923 1.00 . A A . 2 CYS C 1 1
15 2812 1 1 2 CYS CA C 4.259 -1.749 -1.652 1.00 . A A . 2 CYS CA 1 1
15 2813 1 1 2 CYS CB C 3.928 -3.223 -1.894 1.00 . A A . 2 CYS CB 1 1
15 2814 1 1 2 CYS H H 2.550 -0.520 -1.875 1.00 . A A . 2 CYS H 1 1
15 2815 1 1 2 CYS HA H 4.996 -1.679 -0.867 1.00 . A A . 2 CYS HA 1 1
15 2816 1 1 2 CYS HB2 H 3.205 -3.547 -1.159 1.00 . A A . 2 CYS HB2 1 1
15 2817 1 1 2 CYS HB3 H 3.503 -3.332 -2.881 1.00 . A A . 2 CYS HB3 1 1
15 2818 1 1 2 CYS N N 3.070 -1.028 -1.216 1.00 . A A . 2 CYS N 1 1
15 2819 1 1 2 CYS O O 4.117 -0.503 -3.700 1.00 . A A . 2 CYS O 1 1
15 2820 1 1 2 CYS SG S 5.365 -4.337 -1.781 1.00 . A A . 2 CYS SG 1 1
15 2821 1 1 3 GLY C C 7.117 -1.835 -5.330 1.00 . A A . 3 GLY C 1 1
15 2822 1 1 3 GLY CA C 6.786 -0.769 -4.304 1.00 . A A . 3 GLY CA 1 1
15 2823 1 1 3 GLY H H 6.658 -1.823 -2.473 1.00 . A A . 3 GLY H 1 1
15 2824 1 1 3 GLY HA2 H 6.132 -0.039 -4.757 1.00 . A A . 3 GLY HA2 1 1
15 2825 1 1 3 GLY HA3 H 7.700 -0.279 -4.002 1.00 . A A . 3 GLY HA3 1 1
15 2826 1 1 3 GLY N N 6.136 -1.314 -3.127 1.00 . A A . 3 GLY N 1 1
15 2827 1 1 3 GLY O O 7.124 -1.582 -6.535 1.00 . A A . 3 GLY O 1 1
15 2828 1 1 4 . C C 9.225 -4.159 -6.150 1.00 . A A . 4 DBB C 1 1
15 2829 1 1 4 . CA C 7.731 -4.106 -5.783 1.00 . A A . 4 DBB CA 1 1
15 2830 1 1 4 . CB C 7.246 -5.438 -5.176 1.00 . A A . 4 DBB CB 1 1
15 2831 1 1 4 . CG C 7.380 -6.546 -6.208 1.00 . A A . 4 DBB CG 1 1
15 2832 1 1 4 . H H 7.381 -3.201 -3.888 1.00 . A A . 4 DBB H 1 1
15 2833 1 1 4 . HA H 7.171 -3.942 -6.682 1.00 . A A . 4 DBB HA 1 1
15 2834 1 1 4 . HB2 H 6.202 -5.304 -4.992 1.00 . A A . 4 DBB HB2 1 1
15 2835 1 1 4 . HG1 H 8.428 -6.727 -6.392 1.00 . A A . 4 DBB HG1 1 1
15 2836 1 1 4 . HG2 H 6.897 -6.245 -7.126 1.00 . A A . 4 DBB HG2 1 1
15 2837 1 1 4 . HG3 H 6.919 -7.445 -5.832 1.00 . A A . 4 DBB HG3 1 1
15 2838 1 1 4 . N N 7.396 -3.034 -4.858 1.00 . A A . 4 DBB N 1 1
15 2839 1 1 4 . O O 9.536 -4.165 -7.340 1.00 . A A . 4 DBB O 1 1
15 2840 1 1 5 GLY C C 11.948 -5.265 -6.391 1.00 . A A . 5 GLY C 1 1
15 2841 1 1 5 GLY CA C 11.542 -4.139 -5.461 1.00 . A A . 5 GLY CA 1 1
15 2842 1 1 5 GLY H H 9.815 -4.141 -4.237 1.00 . A A . 5 GLY H 1 1
15 2843 1 1 5 GLY HA2 H 11.799 -3.196 -5.921 1.00 . A A . 5 GLY HA2 1 1
15 2844 1 1 5 GLY HA3 H 12.090 -4.237 -4.535 1.00 . A A . 5 GLY HA3 1 1
15 2845 1 1 5 GLY N N 10.121 -4.146 -5.168 1.00 . A A . 5 GLY N 1 1
15 2846 1 1 5 GLY O O 11.900 -5.184 -7.615 1.00 . A A . 5 GLY O 1 1
15 2847 1 1 6 . C C 11.488 -8.447 -6.891 1.00 . A A . 6 IAS C 1 1
15 2848 1 1 6 . CA C 12.692 -7.566 -6.608 1.00 . A A . 6 IAS CA 1 1
15 2849 1 1 6 . CB C 13.853 -8.401 -6.038 1.00 . A A . 6 IAS CB 1 1
15 2850 1 1 6 . CG C 13.646 -8.814 -4.587 1.00 . A A . 6 IAS CG 1 1
15 2851 1 1 6 . H H 12.421 -6.473 -4.814 1.00 . A A . 6 IAS H 1 1
15 2852 1 1 6 . HA H 12.976 -7.212 -7.592 1.00 . A A . 6 IAS HA 1 1
15 2853 1 1 6 . HB2 H 14.743 -7.788 -6.050 1.00 . A A . 6 IAS HB2 1 1
15 2854 1 1 6 . HB3 H 14.003 -9.265 -6.666 1.00 . A A . 6 IAS HB3 1 1
15 2855 1 1 6 . HXT H 10.569 -8.106 -8.555 1.00 . A A . 6 IAS HXT 1 1
15 2856 1 1 6 . N N 12.379 -6.395 -5.806 1.00 . A A . 6 IAS N 1 1
15 2857 1 1 6 . O O 10.842 -9.012 -6.046 1.00 . A A . 6 IAS O 1 1
15 2858 1 1 6 . OD1 O 13.335 -9.965 -4.282 1.00 . A A . 6 IAS OD1 1 1
15 2859 1 1 6 . OXT O 11.306 -8.631 -8.208 1.00 . A A . 6 IAS OXT 1 1
15 2860 1 1 7 GLY C C 12.197 -7.975 -1.831 1.00 . A A . 7 GLY C 1 1
15 2861 1 1 7 GLY CA C 13.640 -8.114 -2.272 1.00 . A A . 7 GLY CA 1 1
15 2862 1 1 7 GLY H H 14.064 -6.950 -3.989 1.00 . A A . 7 GLY H 1 1
15 2863 1 1 7 GLY HA2 H 13.975 -9.119 -2.061 1.00 . A A . 7 GLY HA2 1 1
15 2864 1 1 7 GLY HA3 H 14.245 -7.418 -1.709 1.00 . A A . 7 GLY HA3 1 1
15 2865 1 1 7 GLY N N 13.816 -7.849 -3.688 1.00 . A A . 7 GLY N 1 1
15 2866 1 1 7 GLY O O 11.898 -8.010 -0.637 1.00 . A A . 7 GLY O 1 1
15 2867 1 1 8 CYS C C 9.229 -9.026 -2.254 1.00 . A A . 8 CYS C 1 1
15 2868 1 1 8 CYS CA C 9.878 -7.667 -2.503 1.00 . A A . 8 CYS CA 1 1
15 2869 1 1 8 CYS CB C 9.168 -6.955 -3.656 1.00 . A A . 8 CYS CB 1 1
15 2870 1 1 8 CYS H H 11.597 -7.795 -3.731 1.00 . A A . 8 CYS H 1 1
15 2871 1 1 8 CYS HA H 9.784 -7.069 -1.610 1.00 . A A . 8 CYS HA 1 1
15 2872 1 1 8 CYS HB2 H 9.894 -6.387 -4.219 1.00 . A A . 8 CYS HB2 1 1
15 2873 1 1 8 CYS HB3 H 8.717 -7.694 -4.302 1.00 . A A . 8 CYS HB3 1 1
15 2874 1 1 8 CYS N N 11.298 -7.815 -2.797 1.00 . A A . 8 CYS N 1 1
15 2875 1 1 8 CYS O O 9.862 -10.068 -2.427 1.00 . A A . 8 CYS O 1 1
15 2876 1 1 8 CYS SG S 7.858 -5.806 -3.126 1.00 . A A . 8 CYS SG 1 1
15 2877 1 1 9 ALA C C 6.341 -10.616 -2.757 1.00 . A A . 9 ALA C 1 1
15 2878 1 1 9 ALA CA C 7.230 -10.237 -1.578 1.00 . A A . 9 ALA CA 1 1
15 2879 1 1 9 ALA CB C 6.396 -10.087 -0.313 1.00 . A A . 9 ALA CB 1 1
15 2880 1 1 9 ALA H H 7.514 -8.145 -1.728 1.00 . A A . 9 ALA H 1 1
15 2881 1 1 9 ALA HA H 7.949 -11.026 -1.414 1.00 . A A . 9 ALA HA 1 1
15 2882 1 1 9 ALA HB1 H 5.770 -9.210 -0.398 1.00 . A A . 9 ALA HB1 1 1
15 2883 1 1 9 ALA HB2 H 5.777 -10.961 -0.185 1.00 . A A . 9 ALA HB2 1 1
15 2884 1 1 9 ALA HB3 H 7.051 -9.981 0.538 1.00 . A A . 9 ALA HB3 1 1
15 2885 1 1 9 ALA N N 7.964 -9.007 -1.848 1.00 . A A . 9 ALA N 1 1
15 2886 1 1 9 ALA O O 6.050 -9.787 -3.621 1.00 . A A . 9 ALA O 1 1
15 2887 1 1 10 LYS C C 3.622 -12.546 -3.375 1.00 . A A . 10 LYS C 1 1
15 2888 1 1 10 LYS CA C 5.056 -12.363 -3.863 1.00 . A A . 10 LYS CA 1 1
15 2889 1 1 10 LYS CB C 5.593 -13.688 -4.407 1.00 . A A . 10 LYS CB 1 1
15 2890 1 1 10 LYS CD C 5.344 -14.872 -2.206 1.00 . A A . 10 LYS CD 1 1
15 2891 1 1 10 LYS CE C 6.841 -14.934 -1.943 1.00 . A A . 10 LYS CE 1 1
15 2892 1 1 10 LYS CG C 5.038 -14.909 -3.694 1.00 . A A . 10 LYS CG 1 1
15 2893 1 1 10 LYS H H 6.178 -12.487 -2.072 1.00 . A A . 10 LYS H 1 1
15 2894 1 1 10 LYS HA H 5.063 -11.629 -4.654 1.00 . A A . 10 LYS HA 1 1
15 2895 1 1 10 LYS HB2 H 5.340 -13.763 -5.454 1.00 . A A . 10 LYS HB2 1 1
15 2896 1 1 10 LYS HB3 H 6.669 -13.696 -4.305 1.00 . A A . 10 LYS HB3 1 1
15 2897 1 1 10 LYS HD2 H 4.955 -13.955 -1.789 1.00 . A A . 10 LYS HD2 1 1
15 2898 1 1 10 LYS HD3 H 4.869 -15.718 -1.729 1.00 . A A . 10 LYS HD3 1 1
15 2899 1 1 10 LYS HE2 H 7.239 -15.822 -2.409 1.00 . A A . 10 LYS HE2 1 1
15 2900 1 1 10 LYS HE3 H 7.306 -14.061 -2.378 1.00 . A A . 10 LYS HE3 1 1
15 2901 1 1 10 LYS HG2 H 3.967 -14.938 -3.829 1.00 . A A . 10 LYS HG2 1 1
15 2902 1 1 10 LYS HG3 H 5.481 -15.797 -4.122 1.00 . A A . 10 LYS HG3 1 1
15 2903 1 1 10 LYS HZ1 H 7.270 -15.956 -0.173 1.00 . A A . 10 LYS HZ1 1 1
15 2904 1 1 10 LYS HZ2 H 6.370 -14.543 0.054 1.00 . A A . 10 LYS HZ2 1 1
15 2905 1 1 10 LYS HZ3 H 8.023 -14.445 -0.291 1.00 . A A . 10 LYS HZ3 1 1
15 2906 1 1 10 LYS N N 5.912 -11.873 -2.789 1.00 . A A . 10 LYS N 1 1
15 2907 1 1 10 LYS NZ N 7.148 -14.972 -0.486 1.00 . A A . 10 LYS NZ 1 1
15 2908 1 1 10 LYS O O 3.324 -12.397 -2.189 1.00 . A A . 10 LYS O 1 1
15 2909 1 1 11 . C C 0.696 -11.799 -3.298 1.00 . A A . 11 DBB C 1 1
15 2910 1 1 11 . CA C 1.343 -13.058 -3.904 1.00 . A A . 11 DBB CA 1 1
15 2911 1 1 11 . CB C 0.560 -13.564 -5.132 1.00 . A A . 11 DBB CB 1 1
15 2912 1 1 11 . CG C -0.839 -13.980 -4.710 1.00 . A A . 11 DBB CG 1 1
15 2913 1 1 11 . H H 3.005 -12.981 -5.230 1.00 . A A . 11 DBB H 1 1
15 2914 1 1 11 . HA H 1.316 -13.835 -3.166 1.00 . A A . 11 DBB HA 1 1
15 2915 1 1 11 . HB2 H 1.069 -14.449 -5.449 1.00 . A A . 11 DBB HB2 1 1
15 2916 1 1 11 . HG1 H -1.331 -14.451 -5.548 1.00 . A A . 11 DBB HG1 1 1
15 2917 1 1 11 . HG2 H -1.399 -13.108 -4.405 1.00 . A A . 11 DBB HG2 1 1
15 2918 1 1 11 . HG3 H -0.776 -14.677 -3.890 1.00 . A A . 11 DBB HG3 1 1
15 2919 1 1 11 . N N 2.731 -12.870 -4.291 1.00 . A A . 11 DBB N 1 1
15 2920 1 1 11 . O O 1.054 -10.697 -3.715 1.00 . A A . 11 DBB O 1 1
15 2921 1 1 12 CYS C C -0.083 -10.111 -0.765 1.00 . A A . 12 CYS C 1 1
15 2922 1 1 12 CYS CA C -0.953 -10.809 -1.807 1.00 . A A . 12 CYS CA 1 1
15 2923 1 1 12 CYS CB C -2.271 -11.256 -1.170 1.00 . A A . 12 CYS CB 1 1
15 2924 1 1 12 CYS H H -0.499 -12.856 -2.092 1.00 . A A . 12 CYS H 1 1
15 2925 1 1 12 CYS HA H -1.167 -10.113 -2.604 1.00 . A A . 12 CYS HA 1 1
15 2926 1 1 12 CYS HB2 H -2.061 -11.724 -0.219 1.00 . A A . 12 CYS HB2 1 1
15 2927 1 1 12 CYS HB3 H -2.896 -10.391 -1.010 1.00 . A A . 12 CYS HB3 1 1
15 2928 1 1 12 CYS N N -0.257 -11.952 -2.385 1.00 . A A . 12 CYS N 1 1
15 2929 1 1 12 CYS O O -0.459 -10.006 0.402 1.00 . A A . 12 CYS O 1 1
15 2930 1 1 12 CYS SG S -3.216 -12.446 -2.175 1.00 . A A . 12 CYS SG 1 1
15 2931 1 1 13 ALA C C 2.417 -7.596 -0.877 1.00 . A A . 13 ALA C 1 1
15 2932 1 1 13 ALA CA C 2.003 -8.947 -0.303 1.00 . A A . 13 ALA CA 1 1
15 2933 1 1 13 ALA CB C 3.229 -9.810 -0.043 1.00 . A A . 13 ALA CB 1 1
15 2934 1 1 13 ALA H H 1.324 -9.752 -2.139 1.00 . A A . 13 ALA H 1 1
15 2935 1 1 13 ALA HA H 1.499 -8.788 0.639 1.00 . A A . 13 ALA HA 1 1
15 2936 1 1 13 ALA HB1 H 3.825 -9.868 -0.942 1.00 . A A . 13 ALA HB1 1 1
15 2937 1 1 13 ALA HB2 H 3.815 -9.372 0.751 1.00 . A A . 13 ALA HB2 1 1
15 2938 1 1 13 ALA HB3 H 2.916 -10.802 0.246 1.00 . A A . 13 ALA HB3 1 1
15 2939 1 1 13 ALA N N 1.081 -9.637 -1.197 1.00 . A A . 13 ALA N 1 1
15 2940 1 1 13 ALA O O 2.590 -6.640 -0.123 1.00 . A A . 13 ALA O 1 1
15 2941 1 1 14 ALA C C 2.728 -6.592 -4.449 1.00 . A A . 14 ALA C 1 1
15 2942 1 1 14 ALA CA C 2.953 -6.332 -2.893 1.00 . A A . 14 ALA CA 1 1
15 2943 1 1 14 ALA CB C 4.369 -5.945 -2.675 1.00 . A A . 14 ALA CB 1 1
15 2944 1 1 14 ALA H H 2.407 -8.357 -2.706 1.00 . A A . 14 ALA H 1 1
15 2945 1 1 14 ALA HA H 2.267 -5.544 -2.649 1.00 . A A . 14 ALA HA 1 1
15 2946 1 1 14 ALA HB1 H 4.884 -6.722 -2.129 1.00 . A A . 14 ALA HB1 1 1
15 2947 1 1 14 ALA HB2 H 4.820 -5.838 -3.650 1.00 . A A . 14 ALA HB2 1 1
15 2948 1 1 14 ALA N N 2.568 -7.541 -2.187 1.00 . A A . 14 ALA N 1 1
15 2949 1 1 14 ALA O O 2.202 -5.738 -5.162 1.00 . A A . 14 ALA O 1 1
15 2950 1 1 15 SER C C 1.574 -8.319 -6.710 1.00 . A A . 15 SER C 1 1
15 2951 1 1 15 SER CA C 3.036 -8.111 -6.327 1.00 . A A . 15 SER CA 1 1
15 2952 1 1 15 SER CB C 3.840 -9.377 -6.631 1.00 . A A . 15 SER CB 1 1
15 2953 1 1 15 SER H H 3.570 -8.400 -4.298 1.00 . A A . 15 SER H 1 1
15 2954 1 1 15 SER HA H 3.435 -7.293 -6.907 1.00 . A A . 15 SER HA 1 1
15 2955 1 1 15 SER HB2 H 3.651 -9.684 -7.648 1.00 . A A . 15 SER HB2 1 1
15 2956 1 1 15 SER HB3 H 4.893 -9.169 -6.506 1.00 . A A . 15 SER HB3 1 1
15 2957 1 1 15 SER HG H 3.340 -11.236 -6.268 1.00 . A A . 15 SER HG 1 1
15 2958 1 1 15 SER N N 3.158 -7.760 -4.916 1.00 . A A . 15 SER N 1 1
15 2959 1 1 15 SER O O 0.985 -7.506 -7.422 1.00 . A A . 15 SER O 1 1
15 2960 1 1 15 SER OG O 3.477 -10.433 -5.759 1.00 . A A . 15 SER OG 1 1
15 2961 1 1 16 CYS C C -1.339 -8.899 -5.659 1.00 . A A . 16 CYS C 1 1
15 2962 1 1 16 CYS CA C -0.398 -9.734 -6.523 1.00 . A A . 16 CYS CA 1 1
15 2963 1 1 16 CYS CB C -0.662 -11.223 -6.293 1.00 . A A . 16 CYS CB 1 1
15 2964 1 1 16 CYS H H 1.516 -10.026 -5.669 1.00 . A A . 16 CYS H 1 1
15 2965 1 1 16 CYS HA H -0.582 -9.501 -7.561 1.00 . A A . 16 CYS HA 1 1
15 2966 1 1 16 CYS HB2 H -0.773 -11.401 -5.233 1.00 . A A . 16 CYS HB2 1 1
15 2967 1 1 16 CYS HB3 H -1.576 -11.501 -6.796 1.00 . A A . 16 CYS HB3 1 1
15 2968 1 1 16 CYS N N 0.994 -9.415 -6.232 1.00 . A A . 16 CYS N 1 1
15 2969 1 1 16 CYS O O -0.979 -8.477 -4.561 1.00 . A A . 16 CYS O 1 1
15 2970 1 1 16 CYS SG S 0.662 -12.316 -6.901 1.00 . A A . 16 CYS SG 1 1
15 2971 1 1 17 ALA C C -4.694 -8.765 -4.967 1.00 . A A . 17 ALA C 1 1
15 2972 1 1 17 ALA CA C -3.540 -7.885 -5.437 1.00 . A A . 17 ALA CA 1 1
15 2973 1 1 17 ALA CB C -4.060 -6.751 -6.308 1.00 . A A . 17 ALA CB 1 1
15 2974 1 1 17 ALA H H -2.775 -9.030 -7.044 1.00 . A A . 17 ALA H 1 1
15 2975 1 1 17 ALA HA H -3.057 -7.451 -4.574 1.00 . A A . 17 ALA HA 1 1
15 2976 1 1 17 ALA HB1 H -3.226 -6.174 -6.681 1.00 . A A . 17 ALA HB1 1 1
15 2977 1 1 17 ALA HB2 H -4.614 -7.161 -7.139 1.00 . A A . 17 ALA HB2 1 1
15 2978 1 1 17 ALA HB3 H -4.705 -6.114 -5.723 1.00 . A A . 17 ALA HB3 1 1
15 2979 1 1 17 ALA N N -2.547 -8.666 -6.163 1.00 . A A . 17 ALA N 1 1
15 2980 1 1 17 ALA O O -5.728 -8.823 -5.632 1.00 . A A . 17 ALA O 1 1
15 2981 1 1 18 ALA C C -6.567 -9.385 -2.510 1.00 . A A . 18 ALA C 1 1
15 2982 1 1 18 ALA CA C -5.498 -10.303 -3.254 1.00 . A A . 18 ALA CA 1 1
15 2983 1 1 18 ALA CB C -4.935 -11.267 -2.276 1.00 . A A . 18 ALA CB 1 1
15 2984 1 1 18 ALA H H -3.643 -9.317 -3.381 1.00 . A A . 18 ALA H 1 1
15 2985 1 1 18 ALA HA H -6.053 -10.786 -4.036 1.00 . A A . 18 ALA HA 1 1
15 2986 1 1 18 ALA HB1 H -4.820 -10.791 -1.313 1.00 . A A . 18 ALA HB1 1 1
15 2987 1 1 18 ALA HB2 H -5.644 -12.077 -2.188 1.00 . A A . 18 ALA HB2 1 1
15 2988 1 1 18 ALA N N -4.501 -9.427 -3.842 1.00 . A A . 18 ALA N 1 1
15 2989 1 1 18 ALA O O -7.774 -9.591 -2.639 1.00 . A A . 18 ALA O 1 1
15 2990 1 1 19 SER C C -7.827 -6.704 -1.925 1.00 . A A . 19 SER C 1 1
15 2991 1 1 19 SER CA C -6.946 -7.525 -0.987 1.00 . A A . 19 SER CA 1 1
15 2992 1 1 19 SER CB C -6.114 -6.592 -0.105 1.00 . A A . 19 SER CB 1 1
15 2993 1 1 19 SER H H -5.104 -8.304 -1.680 1.00 . A A . 19 SER H 1 1
15 2994 1 1 19 SER HA H -7.579 -8.132 -0.357 1.00 . A A . 19 SER HA 1 1
15 2995 1 1 19 SER HB2 H -5.478 -5.983 -0.729 1.00 . A A . 19 SER HB2 1 1
15 2996 1 1 19 SER HB3 H -6.775 -5.956 0.466 1.00 . A A . 19 SER HB3 1 1
15 2997 1 1 19 SER HG H -4.381 -7.095 0.657 1.00 . A A . 19 SER HG 1 1
15 2998 1 1 19 SER N N -6.076 -8.418 -1.742 1.00 . A A . 19 SER N 1 1
15 2999 1 1 19 SER O O -7.425 -6.373 -3.038 1.00 . A A . 19 SER O 1 1
15 3000 1 1 19 SER OG O -5.302 -7.329 0.792 1.00 . A A . 19 SER OG 1 1
16 3001 1 1 1 ALA C C 3.771 -0.293 -1.676 1.00 . A A . 1 ALA C 1 1
16 3002 1 1 1 ALA CA C 2.285 0.050 -1.642 1.00 . A A . 1 ALA CA 1 1
16 3003 1 1 1 ALA CB C 1.720 -0.181 -0.249 1.00 . A A . 1 ALA CB 1 1
16 3004 1 1 1 ALA H1 H 1.622 -1.708 -2.616 1.00 . A A . 1 ALA H1 1 1
16 3005 1 1 1 ALA HA H 2.162 1.095 -1.886 1.00 . A A . 1 ALA HA 1 1
16 3006 1 1 1 ALA HB1 H 2.438 0.146 0.489 1.00 . A A . 1 ALA HB1 1 1
16 3007 1 1 1 ALA HB2 H 0.804 0.380 -0.135 1.00 . A A . 1 ALA HB2 1 1
16 3008 1 1 1 ALA HB3 H 1.518 -1.233 -0.113 1.00 . A A . 1 ALA HB3 1 1
16 3009 1 1 1 ALA N N 1.544 -0.732 -2.625 1.00 . A A . 1 ALA N 1 1
16 3010 1 1 1 ALA O O 4.624 0.587 -1.556 1.00 . A A . 1 ALA O 1 1
16 3011 1 1 2 CYS C C 6.258 -1.241 -2.914 1.00 . A A . 2 CYS C 1 1
16 3012 1 1 2 CYS CA C 5.457 -2.036 -1.887 1.00 . A A . 2 CYS CA 1 1
16 3013 1 1 2 CYS CB C 5.509 -3.527 -2.226 1.00 . A A . 2 CYS CB 1 1
16 3014 1 1 2 CYS H H 3.349 -2.231 -1.929 1.00 . A A . 2 CYS H 1 1
16 3015 1 1 2 CYS HA H 5.892 -1.882 -0.912 1.00 . A A . 2 CYS HA 1 1
16 3016 1 1 2 CYS HB2 H 4.637 -3.786 -2.809 1.00 . A A . 2 CYS HB2 1 1
16 3017 1 1 2 CYS HB3 H 6.397 -3.725 -2.808 1.00 . A A . 2 CYS HB3 1 1
16 3018 1 1 2 CYS N N 4.074 -1.576 -1.839 1.00 . A A . 2 CYS N 1 1
16 3019 1 1 2 CYS O O 7.064 -0.382 -2.559 1.00 . A A . 2 CYS O 1 1
16 3020 1 1 2 CYS SG S 5.544 -4.619 -0.769 1.00 . A A . 2 CYS SG 1 1
16 3021 1 1 3 GLY C C 7.674 -1.753 -6.019 1.00 . A A . 3 GLY C 1 1
16 3022 1 1 3 GLY CA C 6.739 -0.840 -5.250 1.00 . A A . 3 GLY CA 1 1
16 3023 1 1 3 GLY H H 5.377 -2.230 -4.415 1.00 . A A . 3 GLY H 1 1
16 3024 1 1 3 GLY HA2 H 6.018 -0.421 -5.935 1.00 . A A . 3 GLY HA2 1 1
16 3025 1 1 3 GLY HA3 H 7.316 -0.037 -4.815 1.00 . A A . 3 GLY HA3 1 1
16 3026 1 1 3 GLY N N 6.031 -1.535 -4.191 1.00 . A A . 3 GLY N 1 1
16 3027 1 1 3 GLY O O 8.592 -1.298 -6.701 1.00 . A A . 3 GLY O 1 1
16 3028 1 1 4 . C C 9.805 -3.788 -6.319 1.00 . A A . 4 DBB C 1 1
16 3029 1 1 4 . CA C 8.308 -3.985 -6.616 1.00 . A A . 4 DBB CA 1 1
16 3030 1 1 4 . CB C 7.844 -5.416 -6.279 1.00 . A A . 4 DBB CB 1 1
16 3031 1 1 4 . CG C 8.576 -6.411 -7.166 1.00 . A A . 4 DBB CG 1 1
16 3032 1 1 4 . H H 6.703 -3.376 -5.357 1.00 . A A . 4 DBB H 1 1
16 3033 1 1 4 . HA H 8.153 -3.838 -7.666 1.00 . A A . 4 DBB HA 1 1
16 3034 1 1 4 . HB2 H 6.811 -5.452 -6.551 1.00 . A A . 4 DBB HB2 1 1
16 3035 1 1 4 . HG1 H 9.628 -6.383 -6.926 1.00 . A A . 4 DBB HG1 1 1
16 3036 1 1 4 . HG2 H 8.433 -6.144 -8.202 1.00 . A A . 4 DBB HG2 1 1
16 3037 1 1 4 . HG3 H 8.191 -7.402 -6.988 1.00 . A A . 4 DBB HG3 1 1
16 3038 1 1 4 . N N 7.447 -3.048 -5.912 1.00 . A A . 4 DBB N 1 1
16 3039 1 1 4 . O O 10.570 -3.599 -7.263 1.00 . A A . 4 DBB O 1 1
16 3040 1 1 5 GLY C C 12.542 -4.451 -5.481 1.00 . A A . 5 GLY C 1 1
16 3041 1 1 5 GLY CA C 11.598 -3.547 -4.714 1.00 . A A . 5 GLY CA 1 1
16 3042 1 1 5 GLY H H 9.551 -3.940 -4.339 1.00 . A A . 5 GLY H 1 1
16 3043 1 1 5 GLY HA2 H 11.841 -2.518 -4.936 1.00 . A A . 5 GLY HA2 1 1
16 3044 1 1 5 GLY HA3 H 11.734 -3.718 -3.656 1.00 . A A . 5 GLY HA3 1 1
16 3045 1 1 5 GLY N N 10.206 -3.783 -5.051 1.00 . A A . 5 GLY N 1 1
16 3046 1 1 5 GLY O O 13.005 -4.168 -6.582 1.00 . A A . 5 GLY O 1 1
16 3047 1 1 6 . C C 12.866 -7.587 -6.400 1.00 . A A . 6 IAS C 1 1
16 3048 1 1 6 . CA C 13.679 -6.593 -5.592 1.00 . A A . 6 IAS CA 1 1
16 3049 1 1 6 . CB C 14.673 -7.326 -4.671 1.00 . A A . 6 IAS CB 1 1
16 3050 1 1 6 . CG C 14.013 -7.974 -3.462 1.00 . A A . 6 IAS CG 1 1
16 3051 1 1 6 . H H 12.494 -5.854 -3.998 1.00 . A A . 6 IAS H 1 1
16 3052 1 1 6 . HA H 14.243 -6.057 -6.346 1.00 . A A . 6 IAS HA 1 1
16 3053 1 1 6 . HB2 H 15.366 -6.596 -4.279 1.00 . A A . 6 IAS HB2 1 1
16 3054 1 1 6 . HB3 H 15.213 -8.057 -5.253 1.00 . A A . 6 IAS HB3 1 1
16 3055 1 1 6 . HXT H 11.767 -9.136 -6.050 1.00 . A A . 6 IAS HXT 1 1
16 3056 1 1 6 . N N 12.865 -5.614 -4.892 1.00 . A A . 6 IAS N 1 1
16 3057 1 1 6 . O O 12.853 -7.641 -7.603 1.00 . A A . 6 IAS O 1 1
16 3058 1 1 6 . OD1 O 13.858 -9.192 -3.387 1.00 . A A . 6 IAS OD1 1 1
16 3059 1 1 6 . OXT O 12.056 -8.318 -5.618 1.00 . A A . 6 IAS OXT 1 1
16 3060 1 1 7 GLY C C 11.461 -7.455 -1.352 1.00 . A A . 7 GLY C 1 1
16 3061 1 1 7 GLY CA C 12.966 -7.628 -1.310 1.00 . A A . 7 GLY CA 1 1
16 3062 1 1 7 GLY H H 13.766 -6.173 -2.624 1.00 . A A . 7 GLY H 1 1
16 3063 1 1 7 GLY HA2 H 13.195 -8.677 -1.195 1.00 . A A . 7 GLY HA2 1 1
16 3064 1 1 7 GLY HA3 H 13.355 -7.090 -0.457 1.00 . A A . 7 GLY HA3 1 1
16 3065 1 1 7 GLY N N 13.616 -7.135 -2.510 1.00 . A A . 7 GLY N 1 1
16 3066 1 1 7 GLY O O 10.823 -7.250 -0.319 1.00 . A A . 7 GLY O 1 1
16 3067 1 1 8 CYS C C 8.741 -8.724 -2.568 1.00 . A A . 8 CYS C 1 1
16 3068 1 1 8 CYS CA C 9.452 -7.383 -2.724 1.00 . A A . 8 CYS CA 1 1
16 3069 1 1 8 CYS CB C 9.144 -6.787 -4.099 1.00 . A A . 8 CYS CB 1 1
16 3070 1 1 8 CYS H H 11.453 -7.699 -3.337 1.00 . A A . 8 CYS H 1 1
16 3071 1 1 8 CYS HA H 9.094 -6.709 -1.961 1.00 . A A . 8 CYS HA 1 1
16 3072 1 1 8 CYS HB2 H 9.942 -6.115 -4.379 1.00 . A A . 8 CYS HB2 1 1
16 3073 1 1 8 CYS HB3 H 9.082 -7.585 -4.824 1.00 . A A . 8 CYS HB3 1 1
16 3074 1 1 8 CYS N N 10.891 -7.535 -2.550 1.00 . A A . 8 CYS N 1 1
16 3075 1 1 8 CYS O O 8.913 -9.628 -3.385 1.00 . A A . 8 CYS O 1 1
16 3076 1 1 8 CYS SG S 7.583 -5.850 -4.171 1.00 . A A . 8 CYS SG 1 1
16 3077 1 1 9 ALA C C 6.359 -10.475 -2.456 1.00 . A A . 9 ALA C 1 1
16 3078 1 1 9 ALA CA C 7.203 -10.074 -1.251 1.00 . A A . 9 ALA CA 1 1
16 3079 1 1 9 ALA CB C 6.325 -9.909 -0.020 1.00 . A A . 9 ALA CB 1 1
16 3080 1 1 9 ALA H H 7.846 -8.089 -0.897 1.00 . A A . 9 ALA H 1 1
16 3081 1 1 9 ALA HA H 7.920 -10.857 -1.049 1.00 . A A . 9 ALA HA 1 1
16 3082 1 1 9 ALA HB1 H 5.555 -9.178 -0.223 1.00 . A A . 9 ALA HB1 1 1
16 3083 1 1 9 ALA HB2 H 5.867 -10.856 0.225 1.00 . A A . 9 ALA HB2 1 1
16 3084 1 1 9 ALA HB3 H 6.928 -9.575 0.811 1.00 . A A . 9 ALA HB3 1 1
16 3085 1 1 9 ALA N N 7.942 -8.845 -1.513 1.00 . A A . 9 ALA N 1 1
16 3086 1 1 9 ALA O O 6.060 -9.650 -3.319 1.00 . A A . 9 ALA O 1 1
16 3087 1 1 10 LYS C C 3.755 -12.584 -3.135 1.00 . A A . 10 LYS C 1 1
16 3088 1 1 10 LYS CA C 5.168 -12.258 -3.607 1.00 . A A . 10 LYS CA 1 1
16 3089 1 1 10 LYS CB C 5.817 -13.507 -4.209 1.00 . A A . 10 LYS CB 1 1
16 3090 1 1 10 LYS CD C 4.862 -15.664 -3.347 1.00 . A A . 10 LYS CD 1 1
16 3091 1 1 10 LYS CE C 5.231 -16.776 -4.317 1.00 . A A . 10 LYS CE 1 1
16 3092 1 1 10 LYS CG C 5.981 -14.645 -3.216 1.00 . A A . 10 LYS CG 1 1
16 3093 1 1 10 LYS H H 6.249 -12.357 -1.790 1.00 . A A . 10 LYS H 1 1
16 3094 1 1 10 LYS HA H 5.114 -11.491 -4.365 1.00 . A A . 10 LYS HA 1 1
16 3095 1 1 10 LYS HB2 H 5.206 -13.856 -5.028 1.00 . A A . 10 LYS HB2 1 1
16 3096 1 1 10 LYS HB3 H 6.794 -13.243 -4.587 1.00 . A A . 10 LYS HB3 1 1
16 3097 1 1 10 LYS HD2 H 4.667 -16.098 -2.377 1.00 . A A . 10 LYS HD2 1 1
16 3098 1 1 10 LYS HD3 H 3.972 -15.166 -3.706 1.00 . A A . 10 LYS HD3 1 1
16 3099 1 1 10 LYS HE2 H 6.285 -16.984 -4.221 1.00 . A A . 10 LYS HE2 1 1
16 3100 1 1 10 LYS HE3 H 4.665 -17.660 -4.062 1.00 . A A . 10 LYS HE3 1 1
16 3101 1 1 10 LYS HG2 H 6.925 -15.137 -3.399 1.00 . A A . 10 LYS HG2 1 1
16 3102 1 1 10 LYS HG3 H 5.972 -14.240 -2.214 1.00 . A A . 10 LYS HG3 1 1
16 3103 1 1 10 LYS HZ1 H 4.150 -15.722 -5.760 1.00 . A A . 10 LYS HZ1 1 1
16 3104 1 1 10 LYS HZ2 H 4.674 -17.246 -6.274 1.00 . A A . 10 LYS HZ2 1 1
16 3105 1 1 10 LYS HZ3 H 5.775 -15.966 -6.164 1.00 . A A . 10 LYS HZ3 1 1
16 3106 1 1 10 LYS N N 5.978 -11.747 -2.509 1.00 . A A . 10 LYS N 1 1
16 3107 1 1 10 LYS NZ N 4.937 -16.402 -5.728 1.00 . A A . 10 LYS NZ 1 1
16 3108 1 1 10 LYS O O 3.516 -12.841 -1.955 1.00 . A A . 10 LYS O 1 1
16 3109 1 1 11 . C C 0.747 -11.727 -2.927 1.00 . A A . 11 DBB C 1 1
16 3110 1 1 11 . CA C 1.441 -12.872 -3.686 1.00 . A A . 11 DBB CA 1 1
16 3111 1 1 11 . CB C 0.665 -13.263 -4.960 1.00 . A A . 11 DBB CB 1 1
16 3112 1 1 11 . CG C -0.708 -13.791 -4.580 1.00 . A A . 11 DBB CG 1 1
16 3113 1 1 11 . H H 3.041 -12.366 -4.994 1.00 . A A . 11 DBB H 1 1
16 3114 1 1 11 . HA H 1.460 -13.733 -3.048 1.00 . A A . 11 DBB HA 1 1
16 3115 1 1 11 . HB2 H 1.209 -14.079 -5.386 1.00 . A A . 11 DBB HB2 1 1
16 3116 1 1 11 . HG1 H -1.229 -14.086 -5.477 1.00 . A A . 11 DBB HG1 1 1
16 3117 1 1 11 . HG2 H -1.266 -13.016 -4.075 1.00 . A A . 11 DBB HG2 1 1
16 3118 1 1 11 . HG3 H -0.598 -14.643 -3.929 1.00 . A A . 11 DBB HG3 1 1
16 3119 1 1 11 . N N 2.814 -12.575 -4.060 1.00 . A A . 11 DBB N 1 1
16 3120 1 1 11 . O O 1.051 -10.568 -3.209 1.00 . A A . 11 DBB O 1 1
16 3121 1 1 12 CYS C C -0.082 -10.407 -0.193 1.00 . A A . 12 CYS C 1 1
16 3122 1 1 12 CYS CA C -0.927 -11.001 -1.317 1.00 . A A . 12 CYS CA 1 1
16 3123 1 1 12 CYS CB C -2.224 -11.577 -0.745 1.00 . A A . 12 CYS CB 1 1
16 3124 1 1 12 CYS H H -0.386 -12.976 -1.852 1.00 . A A . 12 CYS H 1 1
16 3125 1 1 12 CYS HA H -1.171 -10.218 -2.019 1.00 . A A . 12 CYS HA 1 1
16 3126 1 1 12 CYS HB2 H -1.994 -12.141 0.148 1.00 . A A . 12 CYS HB2 1 1
16 3127 1 1 12 CYS HB3 H -2.888 -10.765 -0.490 1.00 . A A . 12 CYS HB3 1 1
16 3128 1 1 12 CYS N N -0.188 -12.032 -2.034 1.00 . A A . 12 CYS N 1 1
16 3129 1 1 12 CYS O O -0.468 -10.446 0.974 1.00 . A A . 12 CYS O 1 1
16 3130 1 1 12 CYS SG S -3.112 -12.685 -1.886 1.00 . A A . 12 CYS SG 1 1
16 3131 1 1 13 ALA C C 2.415 -7.866 -0.027 1.00 . A A . 13 ALA C 1 1
16 3132 1 1 13 ALA CA C 1.972 -9.255 0.420 1.00 . A A . 13 ALA CA 1 1
16 3133 1 1 13 ALA CB C 3.181 -10.150 0.647 1.00 . A A . 13 ALA CB 1 1
16 3134 1 1 13 ALA H H 1.326 -9.858 -1.503 1.00 . A A . 13 ALA H 1 1
16 3135 1 1 13 ALA HA H 1.438 -9.168 1.356 1.00 . A A . 13 ALA HA 1 1
16 3136 1 1 13 ALA HB1 H 2.860 -11.084 1.085 1.00 . A A . 13 ALA HB1 1 1
16 3137 1 1 13 ALA HB2 H 3.669 -10.342 -0.297 1.00 . A A . 13 ALA HB2 1 1
16 3138 1 1 13 ALA HB3 H 3.872 -9.658 1.316 1.00 . A A . 13 ALA HB3 1 1
16 3139 1 1 13 ALA N N 1.073 -9.859 -0.556 1.00 . A A . 13 ALA N 1 1
16 3140 1 1 13 ALA O O 2.580 -6.979 0.810 1.00 . A A . 13 ALA O 1 1
16 3141 1 1 14 ALA C C 2.733 -6.531 -3.481 1.00 . A A . 14 ALA C 1 1
16 3142 1 1 14 ALA CA C 3.016 -6.444 -1.915 1.00 . A A . 14 ALA CA 1 1
16 3143 1 1 14 ALA CB C 4.454 -6.139 -1.707 1.00 . A A . 14 ALA CB 1 1
16 3144 1 1 14 ALA H H 2.443 -8.469 -1.913 1.00 . A A . 14 ALA H 1 1
16 3145 1 1 14 ALA HA H 2.373 -5.658 -1.567 1.00 . A A . 14 ALA HA 1 1
16 3146 1 1 14 ALA HB1 H 4.937 -6.964 -1.203 1.00 . A A . 14 ALA HB1 1 1
16 3147 1 1 14 ALA HB2 H 4.894 -6.015 -2.686 1.00 . A A . 14 ALA HB2 1 1
16 3148 1 1 14 ALA N N 2.599 -7.702 -1.323 1.00 . A A . 14 ALA N 1 1
16 3149 1 1 14 ALA O O 2.102 -5.647 -4.058 1.00 . A A . 14 ALA O 1 1
16 3150 1 1 15 SER C C 1.592 -7.932 -5.906 1.00 . A A . 15 SER C 1 1
16 3151 1 1 15 SER CA C 3.067 -7.778 -5.545 1.00 . A A . 15 SER CA 1 1
16 3152 1 1 15 SER CB C 3.850 -9.005 -6.015 1.00 . A A . 15 SER CB 1 1
16 3153 1 1 15 SER H H 3.727 -8.263 -3.592 1.00 . A A . 15 SER H 1 1
16 3154 1 1 15 SER HA H 3.457 -6.901 -6.040 1.00 . A A . 15 SER HA 1 1
16 3155 1 1 15 SER HB2 H 3.642 -9.183 -7.059 1.00 . A A . 15 SER HB2 1 1
16 3156 1 1 15 SER HB3 H 4.907 -8.826 -5.884 1.00 . A A . 15 SER HB3 1 1
16 3157 1 1 15 SER HG H 3.743 -10.042 -4.357 1.00 . A A . 15 SER HG 1 1
16 3158 1 1 15 SER N N 3.233 -7.591 -4.108 1.00 . A A . 15 SER N 1 1
16 3159 1 1 15 SER O O 0.998 -7.051 -6.528 1.00 . A A . 15 SER O 1 1
16 3160 1 1 15 SER OG O 3.486 -10.157 -5.274 1.00 . A A . 15 SER OG 1 1
16 3161 1 1 16 CYS C C -1.298 -8.656 -4.761 1.00 . A A . 16 CYS C 1 1
16 3162 1 1 16 CYS CA C -0.397 -9.330 -5.792 1.00 . A A . 16 CYS CA 1 1
16 3163 1 1 16 CYS CB C -0.653 -10.838 -5.802 1.00 . A A . 16 CYS CB 1 1
16 3164 1 1 16 CYS H H 1.534 -9.722 -5.018 1.00 . A A . 16 CYS H 1 1
16 3165 1 1 16 CYS HA H -0.624 -8.928 -6.767 1.00 . A A . 16 CYS HA 1 1
16 3166 1 1 16 CYS HB2 H -0.768 -11.183 -4.785 1.00 . A A . 16 CYS HB2 1 1
16 3167 1 1 16 CYS HB3 H -1.563 -11.037 -6.348 1.00 . A A . 16 CYS HB3 1 1
16 3168 1 1 16 CYS N N 1.008 -9.057 -5.511 1.00 . A A . 16 CYS N 1 1
16 3169 1 1 16 CYS O O -0.896 -8.435 -3.620 1.00 . A A . 16 CYS O 1 1
16 3170 1 1 16 CYS SG S 0.680 -11.814 -6.570 1.00 . A A . 16 CYS SG 1 1
16 3171 1 1 17 ALA C C -4.644 -8.619 -3.966 1.00 . A A . 17 ALA C 1 1
16 3172 1 1 17 ALA CA C -3.480 -7.688 -4.285 1.00 . A A . 17 ALA CA 1 1
16 3173 1 1 17 ALA CB C -3.989 -6.397 -4.908 1.00 . A A . 17 ALA CB 1 1
16 3174 1 1 17 ALA H H -2.783 -8.536 -6.095 1.00 . A A . 17 ALA H 1 1
16 3175 1 1 17 ALA HA H -2.969 -7.439 -3.366 1.00 . A A . 17 ALA HA 1 1
16 3176 1 1 17 ALA HB1 H -3.208 -5.957 -5.511 1.00 . A A . 17 ALA HB1 1 1
16 3177 1 1 17 ALA HB2 H -4.846 -6.611 -5.529 1.00 . A A . 17 ALA HB2 1 1
16 3178 1 1 17 ALA HB3 H -4.272 -5.708 -4.127 1.00 . A A . 17 ALA HB3 1 1
16 3179 1 1 17 ALA N N -2.520 -8.334 -5.173 1.00 . A A . 17 ALA N 1 1
16 3180 1 1 17 ALA O O -5.686 -8.540 -4.617 1.00 . A A . 17 ALA O 1 1
16 3181 1 1 18 ALA C C -6.458 -9.660 -1.572 1.00 . A A . 18 ALA C 1 1
16 3182 1 1 18 ALA CA C -5.459 -10.428 -2.547 1.00 . A A . 18 ALA CA 1 1
16 3183 1 1 18 ALA CB C -4.897 -11.597 -1.827 1.00 . A A . 18 ALA CB 1 1
16 3184 1 1 18 ALA H H -3.588 -9.465 -2.520 1.00 . A A . 18 ALA H 1 1
16 3185 1 1 18 ALA HA H -6.065 -10.712 -3.386 1.00 . A A . 18 ALA HA 1 1
16 3186 1 1 18 ALA HB1 H -4.888 -11.408 -0.763 1.00 . A A . 18 ALA HB1 1 1
16 3187 1 1 18 ALA HB2 H -5.546 -12.435 -2.033 1.00 . A A . 18 ALA HB2 1 1
16 3188 1 1 18 ALA N N -4.453 -9.476 -2.981 1.00 . A A . 18 ALA N 1 1
16 3189 1 1 18 ALA O O -6.110 -9.339 -0.435 1.00 . A A . 18 ALA O 1 1
16 3190 1 1 19 SER C C -9.809 -9.575 -0.894 1.00 . A A . 19 SER C 1 1
16 3191 1 1 19 SER CA C -8.657 -8.655 -1.287 1.00 . A A . 19 SER CA 1 1
16 3192 1 1 19 SER CB C -9.191 -7.462 -2.082 1.00 . A A . 19 SER CB 1 1
16 3193 1 1 19 SER H H -7.878 -9.659 -2.980 1.00 . A A . 19 SER H 1 1
16 3194 1 1 19 SER HA H -8.178 -8.293 -0.389 1.00 . A A . 19 SER HA 1 1
16 3195 1 1 19 SER HB2 H -9.579 -6.722 -1.399 1.00 . A A . 19 SER HB2 1 1
16 3196 1 1 19 SER HB3 H -8.387 -7.030 -2.661 1.00 . A A . 19 SER HB3 1 1
16 3197 1 1 19 SER HG H -10.007 -8.706 -3.356 1.00 . A A . 19 SER HG 1 1
16 3198 1 1 19 SER N N -7.659 -9.377 -2.067 1.00 . A A . 19 SER N 1 1
16 3199 1 1 19 SER O O -10.776 -9.142 -0.268 1.00 . A A . 19 SER O 1 1
16 3200 1 1 19 SER OG O -10.227 -7.859 -2.963 1.00 . A A . 19 SER OG 1 1
17 3201 1 1 1 ALA C C 2.362 -0.181 -0.911 1.00 . A A . 1 ALA C 1 1
17 3202 1 1 1 ALA CA C 0.993 0.451 -1.137 1.00 . A A . 1 ALA CA 1 1
17 3203 1 1 1 ALA CB C 0.927 1.094 -2.514 1.00 . A A . 1 ALA CB 1 1
17 3204 1 1 1 ALA H1 H 0.792 2.389 -0.309 1.00 . A A . 1 ALA H1 1 1
17 3205 1 1 1 ALA HA H 0.239 -0.321 -1.091 1.00 . A A . 1 ALA HA 1 1
17 3206 1 1 1 ALA HB1 H 0.057 1.733 -2.571 1.00 . A A . 1 ALA HB1 1 1
17 3207 1 1 1 ALA HB2 H 1.817 1.682 -2.680 1.00 . A A . 1 ALA HB2 1 1
17 3208 1 1 1 ALA HB3 H 0.858 0.324 -3.268 1.00 . A A . 1 ALA HB3 1 1
17 3209 1 1 1 ALA N N 0.693 1.436 -0.104 1.00 . A A . 1 ALA N 1 1
17 3210 1 1 1 ALA O O 3.250 0.431 -0.316 1.00 . A A . 1 ALA O 1 1
17 3211 1 1 2 CYS C C 4.914 -1.406 -1.974 1.00 . A A . 2 CYS C 1 1
17 3212 1 1 2 CYS CA C 3.788 -2.126 -1.239 1.00 . A A . 2 CYS CA 1 1
17 3213 1 1 2 CYS CB C 3.652 -3.556 -1.767 1.00 . A A . 2 CYS CB 1 1
17 3214 1 1 2 CYS H H 1.782 -1.846 -1.855 1.00 . A A . 2 CYS H 1 1
17 3215 1 1 2 CYS HA H 4.026 -2.162 -0.187 1.00 . A A . 2 CYS HA 1 1
17 3216 1 1 2 CYS HB2 H 2.708 -3.965 -1.438 1.00 . A A . 2 CYS HB2 1 1
17 3217 1 1 2 CYS HB3 H 3.673 -3.536 -2.847 1.00 . A A . 2 CYS HB3 1 1
17 3218 1 1 2 CYS N N 2.527 -1.410 -1.389 1.00 . A A . 2 CYS N 1 1
17 3219 1 1 2 CYS O O 4.676 -0.684 -2.942 1.00 . A A . 2 CYS O 1 1
17 3220 1 1 2 CYS SG S 4.968 -4.684 -1.207 1.00 . A A . 2 CYS SG 1 1
17 3221 1 1 3 GLY C C 7.636 -1.589 -3.471 1.00 . A A . 3 GLY C 1 1
17 3222 1 1 3 GLY CA C 7.287 -0.971 -2.132 1.00 . A A . 3 GLY CA 1 1
17 3223 1 1 3 GLY H H 6.273 -2.193 -0.732 1.00 . A A . 3 GLY H 1 1
17 3224 1 1 3 GLY HA2 H 7.068 0.077 -2.277 1.00 . A A . 3 GLY HA2 1 1
17 3225 1 1 3 GLY HA3 H 8.139 -1.062 -1.474 1.00 . A A . 3 GLY HA3 1 1
17 3226 1 1 3 GLY N N 6.143 -1.607 -1.507 1.00 . A A . 3 GLY N 1 1
17 3227 1 1 3 GLY O O 8.168 -0.926 -4.362 1.00 . A A . 3 GLY O 1 1
17 3228 1 1 4 . C C 9.127 -3.397 -5.294 1.00 . A A . 4 DBB C 1 1
17 3229 1 1 4 . CA C 7.651 -3.528 -4.878 1.00 . A A . 4 DBB CA 1 1
17 3230 1 1 4 . CB C 7.220 -5.005 -4.767 1.00 . A A . 4 DBB CB 1 1
17 3231 1 1 4 . CG C 7.327 -5.671 -6.129 1.00 . A A . 4 DBB CG 1 1
17 3232 1 1 4 . H H 6.913 -3.364 -2.888 1.00 . A A . 4 DBB H 1 1
17 3233 1 1 4 . HA H 7.047 -3.076 -5.640 1.00 . A A . 4 DBB HA 1 1
17 3234 1 1 4 . HB2 H 6.183 -4.980 -4.508 1.00 . A A . 4 DBB HB2 1 1
17 3235 1 1 4 . HG1 H 7.319 -6.742 -5.995 1.00 . A A . 4 DBB HG1 1 1
17 3236 1 1 4 . HG2 H 8.249 -5.373 -6.606 1.00 . A A . 4 DBB HG2 1 1
17 3237 1 1 4 . HG3 H 6.489 -5.377 -6.740 1.00 . A A . 4 DBB HG3 1 1
17 3238 1 1 4 . N N 7.339 -2.865 -3.622 1.00 . A A . 4 DBB N 1 1
17 3239 1 1 4 . O O 9.383 -3.127 -6.467 1.00 . A A . 4 DBB O 1 1
17 3240 1 1 5 GLY C C 11.892 -4.209 -5.874 1.00 . A A . 5 GLY C 1 1
17 3241 1 1 5 GLY CA C 11.468 -3.362 -4.690 1.00 . A A . 5 GLY CA 1 1
17 3242 1 1 5 GLY H H 9.801 -3.747 -3.442 1.00 . A A . 5 GLY H 1 1
17 3243 1 1 5 GLY HA2 H 11.650 -2.323 -4.920 1.00 . A A . 5 GLY HA2 1 1
17 3244 1 1 5 GLY HA3 H 12.063 -3.640 -3.833 1.00 . A A . 5 GLY HA3 1 1
17 3245 1 1 5 GLY N N 10.064 -3.531 -4.361 1.00 . A A . 5 GLY N 1 1
17 3246 1 1 5 GLY O O 12.114 -3.749 -6.991 1.00 . A A . 5 GLY O 1 1
17 3247 1 1 6 . C C 11.110 -7.195 -7.244 1.00 . A A . 6 IAS C 1 1
17 3248 1 1 6 . CA C 12.323 -6.434 -6.743 1.00 . A A . 6 IAS CA 1 1
17 3249 1 1 6 . CB C 13.479 -7.402 -6.429 1.00 . A A . 6 IAS CB 1 1
17 3250 1 1 6 . CG C 13.275 -8.191 -5.143 1.00 . A A . 6 IAS CG 1 1
17 3251 1 1 6 . H H 11.844 -5.910 -4.747 1.00 . A A . 6 IAS H 1 1
17 3252 1 1 6 . HA H 12.608 -5.825 -7.593 1.00 . A A . 6 IAS HA 1 1
17 3253 1 1 6 . HB2 H 14.375 -6.817 -6.282 1.00 . A A . 6 IAS HB2 1 1
17 3254 1 1 6 . HB3 H 13.617 -8.065 -7.269 1.00 . A A . 6 IAS HB3 1 1
17 3255 1 1 6 . HXT H 10.353 -6.675 -8.943 1.00 . A A . 6 IAS HXT 1 1
17 3256 1 1 6 . N N 12.022 -5.526 -5.649 1.00 . A A . 6 IAS N 1 1
17 3257 1 1 6 . O O 10.928 -8.375 -7.081 1.00 . A A . 6 IAS O 1 1
17 3258 1 1 6 . OD1 O 13.540 -7.710 -4.042 1.00 . A A . 6 IAS OD1 1 1
17 3259 1 1 6 . OXT O 10.320 -6.424 -8.008 1.00 . A A . 6 IAS OXT 1 1
17 3260 1 1 7 GLY C C 11.456 -9.770 -3.261 1.00 . A A . 7 GLY C 1 1
17 3261 1 1 7 GLY CA C 12.572 -10.281 -4.150 1.00 . A A . 7 GLY CA 1 1
17 3262 1 1 7 GLY H H 12.610 -9.755 -6.201 1.00 . A A . 7 GLY H 1 1
17 3263 1 1 7 GLY HA2 H 12.316 -11.270 -4.499 1.00 . A A . 7 GLY HA2 1 1
17 3264 1 1 7 GLY HA3 H 13.481 -10.339 -3.570 1.00 . A A . 7 GLY HA3 1 1
17 3265 1 1 7 GLY N N 12.803 -9.424 -5.299 1.00 . A A . 7 GLY N 1 1
17 3266 1 1 7 GLY O O 11.335 -10.180 -2.106 1.00 . A A . 7 GLY O 1 1
17 3267 1 1 8 CYS C C 8.585 -9.394 -2.554 1.00 . A A . 8 CYS C 1 1
17 3268 1 1 8 CYS CA C 9.528 -8.300 -3.045 1.00 . A A . 8 CYS CA 1 1
17 3269 1 1 8 CYS CB C 8.759 -7.298 -3.909 1.00 . A A . 8 CYS CB 1 1
17 3270 1 1 8 CYS H H 10.786 -8.582 -4.724 1.00 . A A . 8 CYS H 1 1
17 3271 1 1 8 CYS HA H 9.937 -7.784 -2.189 1.00 . A A . 8 CYS HA 1 1
17 3272 1 1 8 CYS HB2 H 9.447 -6.825 -4.595 1.00 . A A . 8 CYS HB2 1 1
17 3273 1 1 8 CYS HB3 H 8.004 -7.826 -4.472 1.00 . A A . 8 CYS HB3 1 1
17 3274 1 1 8 CYS N N 10.639 -8.870 -3.797 1.00 . A A . 8 CYS N 1 1
17 3275 1 1 8 CYS O O 8.634 -10.529 -3.027 1.00 . A A . 8 CYS O 1 1
17 3276 1 1 8 CYS SG S 7.929 -5.982 -2.962 1.00 . A A . 8 CYS SG 1 1
17 3277 1 1 9 ALA C C 5.984 -10.690 -2.155 1.00 . A A . 9 ALA C 1 1
17 3278 1 1 9 ALA CA C 6.769 -9.994 -1.048 1.00 . A A . 9 ALA CA 1 1
17 3279 1 1 9 ALA CB C 5.822 -9.291 -0.088 1.00 . A A . 9 ALA CB 1 1
17 3280 1 1 9 ALA H H 7.735 -8.124 -1.265 1.00 . A A . 9 ALA H 1 1
17 3281 1 1 9 ALA HA H 7.322 -10.738 -0.491 1.00 . A A . 9 ALA HA 1 1
17 3282 1 1 9 ALA HB1 H 4.910 -9.034 -0.607 1.00 . A A . 9 ALA HB1 1 1
17 3283 1 1 9 ALA HB2 H 5.594 -9.949 0.738 1.00 . A A . 9 ALA HB2 1 1
17 3284 1 1 9 ALA HB3 H 6.290 -8.393 0.286 1.00 . A A . 9 ALA HB3 1 1
17 3285 1 1 9 ALA N N 7.726 -9.044 -1.602 1.00 . A A . 9 ALA N 1 1
17 3286 1 1 9 ALA O O 5.822 -10.150 -3.250 1.00 . A A . 9 ALA O 1 1
17 3287 1 1 10 LYS C C 3.274 -12.798 -2.389 1.00 . A A . 10 LYS C 1 1
17 3288 1 1 10 LYS CA C 4.728 -12.662 -2.833 1.00 . A A . 10 LYS CA 1 1
17 3289 1 1 10 LYS CB C 5.347 -14.049 -3.020 1.00 . A A . 10 LYS CB 1 1
17 3290 1 1 10 LYS CD C 6.767 -15.494 -4.504 1.00 . A A . 10 LYS CD 1 1
17 3291 1 1 10 LYS CE C 8.205 -15.641 -4.976 1.00 . A A . 10 LYS CE 1 1
17 3292 1 1 10 LYS CG C 6.477 -14.079 -4.034 1.00 . A A . 10 LYS CG 1 1
17 3293 1 1 10 LYS H H 5.659 -12.269 -0.973 1.00 . A A . 10 LYS H 1 1
17 3294 1 1 10 LYS HA H 4.756 -12.134 -3.774 1.00 . A A . 10 LYS HA 1 1
17 3295 1 1 10 LYS HB2 H 5.734 -14.388 -2.070 1.00 . A A . 10 LYS HB2 1 1
17 3296 1 1 10 LYS HB3 H 4.577 -14.732 -3.349 1.00 . A A . 10 LYS HB3 1 1
17 3297 1 1 10 LYS HD2 H 6.597 -16.178 -3.686 1.00 . A A . 10 LYS HD2 1 1
17 3298 1 1 10 LYS HD3 H 6.102 -15.736 -5.322 1.00 . A A . 10 LYS HD3 1 1
17 3299 1 1 10 LYS HE2 H 8.291 -16.552 -5.548 1.00 . A A . 10 LYS HE2 1 1
17 3300 1 1 10 LYS HE3 H 8.452 -14.798 -5.604 1.00 . A A . 10 LYS HE3 1 1
17 3301 1 1 10 LYS HG2 H 6.199 -13.478 -4.887 1.00 . A A . 10 LYS HG2 1 1
17 3302 1 1 10 LYS HG3 H 7.368 -13.671 -3.579 1.00 . A A . 10 LYS HG3 1 1
17 3303 1 1 10 LYS HZ1 H 8.646 -15.614 -2.935 1.00 . A A . 10 LYS HZ1 1 1
17 3304 1 1 10 LYS HZ2 H 9.840 -14.907 -3.903 1.00 . A A . 10 LYS HZ2 1 1
17 3305 1 1 10 LYS HZ3 H 9.684 -16.591 -3.847 1.00 . A A . 10 LYS HZ3 1 1
17 3306 1 1 10 LYS N N 5.497 -11.892 -1.863 1.00 . A A . 10 LYS N 1 1
17 3307 1 1 10 LYS NZ N 9.161 -15.692 -3.836 1.00 . A A . 10 LYS NZ 1 1
17 3308 1 1 10 LYS O O 2.903 -12.411 -1.281 1.00 . A A . 10 LYS O 1 1
17 3309 1 1 11 . C C 0.374 -12.207 -2.445 1.00 . A A . 11 DBB C 1 1
17 3310 1 1 11 . CA C 1.047 -13.511 -2.908 1.00 . A A . 11 DBB CA 1 1
17 3311 1 1 11 . CB C 0.315 -14.132 -4.115 1.00 . A A . 11 DBB CB 1 1
17 3312 1 1 11 . CG C -1.099 -14.517 -3.711 1.00 . A A . 11 DBB CG 1 1
17 3313 1 1 11 . H H 2.781 -13.649 -4.134 1.00 . A A . 11 DBB H 1 1
17 3314 1 1 11 . HA H 0.994 -14.219 -2.104 1.00 . A A . 11 DBB HA 1 1
17 3315 1 1 11 . HB2 H 0.838 -15.039 -4.330 1.00 . A A . 11 DBB HB2 1 1
17 3316 1 1 11 . HG1 H -1.671 -13.617 -3.544 1.00 . A A . 11 DBB HG1 1 1
17 3317 1 1 11 . HG2 H -1.069 -15.100 -2.803 1.00 . A A . 11 DBB HG2 1 1
17 3318 1 1 11 . HG3 H -1.554 -15.093 -4.500 1.00 . A A . 11 DBB HG3 1 1
17 3319 1 1 11 . N N 2.450 -13.351 -3.257 1.00 . A A . 11 DBB N 1 1
17 3320 1 1 11 . O O 0.703 -11.152 -2.988 1.00 . A A . 11 DBB O 1 1
17 3321 1 1 12 CYS C C -0.458 -10.295 -0.062 1.00 . A A . 12 CYS C 1 1
17 3322 1 1 12 CYS CA C -1.291 -11.091 -1.063 1.00 . A A . 12 CYS CA 1 1
17 3323 1 1 12 CYS CB C -2.625 -11.489 -0.430 1.00 . A A . 12 CYS CB 1 1
17 3324 1 1 12 CYS H H -0.788 -13.147 -1.116 1.00 . A A . 12 CYS H 1 1
17 3325 1 1 12 CYS HA H -1.482 -10.472 -1.926 1.00 . A A . 12 CYS HA 1 1
17 3326 1 1 12 CYS HB2 H -3.085 -12.260 -1.033 1.00 . A A . 12 CYS HB2 1 1
17 3327 1 1 12 CYS HB3 H -2.444 -11.875 0.562 1.00 . A A . 12 CYS HB3 1 1
17 3328 1 1 12 CYS N N -0.570 -12.276 -1.512 1.00 . A A . 12 CYS N 1 1
17 3329 1 1 12 CYS O O -0.890 -10.049 1.063 1.00 . A A . 12 CYS O 1 1
17 3330 1 1 12 CYS SG S -3.817 -10.119 -0.284 1.00 . A A . 12 CYS SG 1 1
17 3331 1 1 13 ALA C C 2.096 -7.851 -0.318 1.00 . A A . 13 ALA C 1 1
17 3332 1 1 13 ALA CA C 1.631 -9.126 0.377 1.00 . A A . 13 ALA CA 1 1
17 3333 1 1 13 ALA CB C 2.826 -9.972 0.789 1.00 . A A . 13 ALA CB 1 1
17 3334 1 1 13 ALA H H 1.027 -10.123 -1.389 1.00 . A A . 13 ALA H 1 1
17 3335 1 1 13 ALA HA H 1.085 -8.858 1.271 1.00 . A A . 13 ALA HA 1 1
17 3336 1 1 13 ALA HB1 H 3.368 -10.282 -0.094 1.00 . A A . 13 ALA HB1 1 1
17 3337 1 1 13 ALA HB2 H 3.477 -9.390 1.425 1.00 . A A . 13 ALA HB2 1 1
17 3338 1 1 13 ALA HB3 H 2.483 -10.843 1.325 1.00 . A A . 13 ALA HB3 1 1
17 3339 1 1 13 ALA N N 0.738 -9.896 -0.481 1.00 . A A . 13 ALA N 1 1
17 3340 1 1 13 ALA O O 2.261 -6.823 0.337 1.00 . A A . 13 ALA O 1 1
17 3341 1 1 14 ALA C C 2.686 -7.281 -3.957 1.00 . A A . 14 ALA C 1 1
17 3342 1 1 14 ALA CA C 2.738 -6.818 -2.433 1.00 . A A . 14 ALA CA 1 1
17 3343 1 1 14 ALA CB C 4.115 -6.363 -2.119 1.00 . A A . 14 ALA CB 1 1
17 3344 1 1 14 ALA H H 2.140 -8.800 -2.056 1.00 . A A . 14 ALA H 1 1
17 3345 1 1 14 ALA HA H 2.016 -6.026 -2.366 1.00 . A A . 14 ALA HA 1 1
17 3346 1 1 14 ALA HB1 H 4.617 -7.099 -1.509 1.00 . A A . 14 ALA HB1 1 1
17 3347 1 1 14 ALA HB2 H 4.636 -6.266 -3.060 1.00 . A A . 14 ALA HB2 1 1
17 3348 1 1 14 ALA N N 2.298 -7.937 -1.620 1.00 . A A . 14 ALA N 1 1
17 3349 1 1 14 ALA O O 2.270 -6.523 -4.833 1.00 . A A . 14 ALA O 1 1
17 3350 1 1 15 SER C C 1.751 -9.225 -6.113 1.00 . A A . 15 SER C 1 1
17 3351 1 1 15 SER CA C 3.165 -9.041 -5.568 1.00 . A A . 15 SER CA 1 1
17 3352 1 1 15 SER CB C 3.912 -10.376 -5.595 1.00 . A A . 15 SER CB 1 1
17 3353 1 1 15 SER H H 3.452 -9.062 -3.471 1.00 . A A . 15 SER H 1 1
17 3354 1 1 15 SER HA H 3.689 -8.332 -6.192 1.00 . A A . 15 SER HA 1 1
17 3355 1 1 15 SER HB2 H 4.954 -10.207 -5.373 1.00 . A A . 15 SER HB2 1 1
17 3356 1 1 15 SER HB3 H 3.488 -11.037 -4.853 1.00 . A A . 15 SER HB3 1 1
17 3357 1 1 15 SER HG H 4.412 -11.738 -6.912 1.00 . A A . 15 SER HG 1 1
17 3358 1 1 15 SER N N 3.133 -8.506 -4.212 1.00 . A A . 15 SER N 1 1
17 3359 1 1 15 SER O O 1.332 -8.523 -7.034 1.00 . A A . 15 SER O 1 1
17 3360 1 1 15 SER OG O 3.810 -10.991 -6.868 1.00 . A A . 15 SER OG 1 1
17 3361 1 1 16 CYS C C -1.325 -9.476 -5.318 1.00 . A A . 16 CYS C 1 1
17 3362 1 1 16 CYS CA C -0.345 -10.452 -5.962 1.00 . A A . 16 CYS CA 1 1
17 3363 1 1 16 CYS CB C -0.730 -11.889 -5.603 1.00 . A A . 16 CYS CB 1 1
17 3364 1 1 16 CYS H H 1.411 -10.700 -4.806 1.00 . A A . 16 CYS H 1 1
17 3365 1 1 16 CYS HA H -0.390 -10.334 -7.034 1.00 . A A . 16 CYS HA 1 1
17 3366 1 1 16 CYS HB2 H -0.913 -11.950 -4.540 1.00 . A A . 16 CYS HB2 1 1
17 3367 1 1 16 CYS HB3 H -1.632 -12.155 -6.134 1.00 . A A . 16 CYS HB3 1 1
17 3368 1 1 16 CYS N N 1.021 -10.174 -5.536 1.00 . A A . 16 CYS N 1 1
17 3369 1 1 16 CYS O O -1.429 -9.401 -4.094 1.00 . A A . 16 CYS O 1 1
17 3370 1 1 16 CYS SG S 0.543 -13.125 -6.017 1.00 . A A . 16 CYS SG 1 1
17 3371 1 1 17 ALA C C -4.254 -8.456 -5.111 1.00 . A A . 17 ALA C 1 1
17 3372 1 1 17 ALA CA C -3.016 -7.760 -5.665 1.00 . A A . 17 ALA CA 1 1
17 3373 1 1 17 ALA CB C -3.402 -6.797 -6.777 1.00 . A A . 17 ALA CB 1 1
17 3374 1 1 17 ALA H H -1.915 -8.836 -7.118 1.00 . A A . 17 ALA H 1 1
17 3375 1 1 17 ALA HA H -2.551 -7.190 -4.873 1.00 . A A . 17 ALA HA 1 1
17 3376 1 1 17 ALA HB1 H -2.511 -6.344 -7.186 1.00 . A A . 17 ALA HB1 1 1
17 3377 1 1 17 ALA HB2 H -3.922 -7.335 -7.556 1.00 . A A . 17 ALA HB2 1 1
17 3378 1 1 17 ALA HB3 H -4.047 -6.028 -6.379 1.00 . A A . 17 ALA HB3 1 1
17 3379 1 1 17 ALA N N -2.042 -8.730 -6.152 1.00 . A A . 17 ALA N 1 1
17 3380 1 1 17 ALA O O -5.284 -8.498 -5.784 1.00 . A A . 17 ALA O 1 1
17 3381 1 1 18 ALA C C -6.231 -8.575 -2.689 1.00 . A A . 18 ALA C 1 1
17 3382 1 1 18 ALA CA C -5.220 -9.679 -3.234 1.00 . A A . 18 ALA CA 1 1
17 3383 1 1 18 ALA CB C -4.769 -10.516 -2.095 1.00 . A A . 18 ALA CB 1 1
17 3384 1 1 18 ALA H H -3.275 -8.902 -3.448 1.00 . A A . 18 ALA H 1 1
17 3385 1 1 18 ALA HA H -5.789 -10.235 -3.955 1.00 . A A . 18 ALA HA 1 1
17 3386 1 1 18 ALA HB1 H -5.605 -11.061 -1.683 1.00 . A A . 18 ALA HB1 1 1
17 3387 1 1 18 ALA HB2 H -4.047 -11.217 -2.487 1.00 . A A . 18 ALA HB2 1 1
17 3388 1 1 18 ALA N N -4.137 -8.986 -3.908 1.00 . A A . 18 ALA N 1 1
17 3389 1 1 18 ALA O O -7.449 -8.746 -2.757 1.00 . A A . 18 ALA O 1 1
17 3390 1 1 19 SER C C -6.896 -5.420 -2.671 1.00 . A A . 19 SER C 1 1
17 3391 1 1 19 SER CA C -6.496 -6.420 -1.589 1.00 . A A . 19 SER CA 1 1
17 3392 1 1 19 SER CB C -5.736 -5.703 -0.472 1.00 . A A . 19 SER CB 1 1
17 3393 1 1 19 SER H H -4.705 -7.414 -2.124 1.00 . A A . 19 SER H 1 1
17 3394 1 1 19 SER HA H -7.391 -6.863 -1.177 1.00 . A A . 19 SER HA 1 1
17 3395 1 1 19 SER HB2 H -6.359 -4.925 -0.057 1.00 . A A . 19 SER HB2 1 1
17 3396 1 1 19 SER HB3 H -5.483 -6.413 0.301 1.00 . A A . 19 SER HB3 1 1
17 3397 1 1 19 SER HG H -3.862 -5.163 -0.286 1.00 . A A . 19 SER HG 1 1
17 3398 1 1 19 SER N N -5.682 -7.492 -2.149 1.00 . A A . 19 SER N 1 1
17 3399 1 1 19 SER O O -8.009 -4.898 -2.667 1.00 . A A . 19 SER O 1 1
17 3400 1 1 19 SER OG O -4.542 -5.118 -0.963 1.00 . A A . 19 SER OG 1 1
18 3401 1 1 1 ALA C C 3.712 -1.045 0.296 1.00 . A A . 1 ALA C 1 1
18 3402 1 1 1 ALA CA C 2.955 0.062 1.023 1.00 . A A . 1 ALA CA 1 1
18 3403 1 1 1 ALA CB C 3.174 1.398 0.328 1.00 . A A . 1 ALA CB 1 1
18 3404 1 1 1 ALA H1 H 4.279 0.412 2.636 1.00 . A A . 1 ALA H1 1 1
18 3405 1 1 1 ALA HA H 1.898 -0.161 0.995 1.00 . A A . 1 ALA HA 1 1
18 3406 1 1 1 ALA HB1 H 2.421 2.100 0.656 1.00 . A A . 1 ALA HB1 1 1
18 3407 1 1 1 ALA HB2 H 4.154 1.776 0.579 1.00 . A A . 1 ALA HB2 1 1
18 3408 1 1 1 ALA HB3 H 3.101 1.264 -0.740 1.00 . A A . 1 ALA HB3 1 1
18 3409 1 1 1 ALA N N 3.361 0.145 2.420 1.00 . A A . 1 ALA N 1 1
18 3410 1 1 1 ALA O O 4.659 -1.620 0.833 1.00 . A A . 1 ALA O 1 1
18 3411 1 1 2 CYS C C 3.732 -2.111 -3.219 1.00 . A A . 2 CYS C 1 1
18 3412 1 1 2 CYS CA C 3.925 -2.378 -1.729 1.00 . A A . 2 CYS CA 1 1
18 3413 1 1 2 CYS CB C 3.355 -3.751 -1.368 1.00 . A A . 2 CYS CB 1 1
18 3414 1 1 2 CYS H H 2.528 -0.846 -1.304 1.00 . A A . 2 CYS H 1 1
18 3415 1 1 2 CYS HA H 4.981 -2.367 -1.508 1.00 . A A . 2 CYS HA 1 1
18 3416 1 1 2 CYS HB2 H 2.589 -3.628 -0.616 1.00 . A A . 2 CYS HB2 1 1
18 3417 1 1 2 CYS HB3 H 2.917 -4.194 -2.251 1.00 . A A . 2 CYS HB3 1 1
18 3418 1 1 2 CYS N N 3.288 -1.340 -0.929 1.00 . A A . 2 CYS N 1 1
18 3419 1 1 2 CYS O O 2.629 -1.804 -3.668 1.00 . A A . 2 CYS O 1 1
18 3420 1 1 2 CYS SG S 4.589 -4.920 -0.714 1.00 . A A . 2 CYS SG 1 1
18 3421 1 1 3 GLY C C 5.776 -2.802 -6.181 1.00 . A A . 3 GLY C 1 1
18 3422 1 1 3 GLY CA C 4.744 -1.999 -5.413 1.00 . A A . 3 GLY CA 1 1
18 3423 1 1 3 GLY H H 5.669 -2.478 -3.569 1.00 . A A . 3 GLY H 1 1
18 3424 1 1 3 GLY HA2 H 3.759 -2.270 -5.762 1.00 . A A . 3 GLY HA2 1 1
18 3425 1 1 3 GLY HA3 H 4.907 -0.949 -5.604 1.00 . A A . 3 GLY HA3 1 1
18 3426 1 1 3 GLY N N 4.815 -2.231 -3.982 1.00 . A A . 3 GLY N 1 1
18 3427 1 1 3 GLY O O 6.144 -2.459 -7.305 1.00 . A A . 3 GLY O 1 1
18 3428 1 1 4 . C C 8.696 -4.332 -5.872 1.00 . A A . 4 DBB C 1 1
18 3429 1 1 4 . CA C 7.248 -4.690 -6.254 1.00 . A A . 4 DBB CA 1 1
18 3430 1 1 4 . CB C 6.935 -6.173 -5.971 1.00 . A A . 4 DBB CB 1 1
18 3431 1 1 4 . CG C 7.821 -7.055 -6.835 1.00 . A A . 4 DBB CG 1 1
18 3432 1 1 4 . H H 5.933 -4.119 -4.681 1.00 . A A . 4 DBB H 1 1
18 3433 1 1 4 . HA H 7.132 -4.535 -7.308 1.00 . A A . 4 DBB HA 1 1
18 3434 1 1 4 . HB2 H 5.928 -6.319 -6.299 1.00 . A A . 4 DBB HB2 1 1
18 3435 1 1 4 . HG1 H 8.808 -7.090 -6.401 1.00 . A A . 4 DBB HG1 1 1
18 3436 1 1 4 . HG2 H 7.878 -6.643 -7.832 1.00 . A A . 4 DBB HG2 1 1
18 3437 1 1 4 . HG3 H 7.408 -8.050 -6.875 1.00 . A A . 4 DBB HG3 1 1
18 3438 1 1 4 . N N 6.250 -3.875 -5.580 1.00 . A A . 4 DBB N 1 1
18 3439 1 1 4 . O O 8.901 -3.803 -4.781 1.00 . A A . 4 DBB O 1 1
18 3440 1 1 5 GLY C C 11.710 -5.546 -5.649 1.00 . A A . 5 GLY C 1 1
18 3441 1 1 5 GLY CA C 11.059 -4.389 -6.379 1.00 . A A . 5 GLY CA 1 1
18 3442 1 1 5 GLY H H 9.450 -5.073 -7.572 1.00 . A A . 5 GLY H 1 1
18 3443 1 1 5 GLY HA2 H 11.608 -4.196 -7.289 1.00 . A A . 5 GLY HA2 1 1
18 3444 1 1 5 GLY HA3 H 11.104 -3.511 -5.751 1.00 . A A . 5 GLY HA3 1 1
18 3445 1 1 5 GLY N N 9.673 -4.653 -6.715 1.00 . A A . 5 GLY N 1 1
18 3446 1 1 5 GLY O O 11.312 -5.976 -4.570 1.00 . A A . 5 GLY O 1 1
18 3447 1 1 6 . C C 12.721 -8.307 -5.015 1.00 . A A . 6 IAS C 1 1
18 3448 1 1 6 . CA C 13.530 -7.152 -5.577 1.00 . A A . 6 IAS CA 1 1
18 3449 1 1 6 . CB C 14.512 -6.613 -4.521 1.00 . A A . 6 IAS CB 1 1
18 3450 1 1 6 . CG C 13.838 -5.788 -3.433 1.00 . A A . 6 IAS CG 1 1
18 3451 1 1 6 . H H 13.107 -5.765 -7.122 1.00 . A A . 6 IAS H 1 1
18 3452 1 1 6 . HA H 14.098 -7.672 -6.340 1.00 . A A . 6 IAS HA 1 1
18 3453 1 1 6 . HB2 H 15.203 -5.947 -5.017 1.00 . A A . 6 IAS HB2 1 1
18 3454 1 1 6 . HB3 H 15.055 -7.442 -4.094 1.00 . A A . 6 IAS HB3 1 1
18 3455 1 1 6 . HXT H 11.500 -9.327 -6.111 1.00 . A A . 6 IAS HXT 1 1
18 3456 1 1 6 . N N 12.775 -6.106 -6.246 1.00 . A A . 6 IAS N 1 1
18 3457 1 1 6 . O O 13.113 -9.066 -4.166 1.00 . A A . 6 IAS O 1 1
18 3458 1 1 6 . OD1 O 13.969 -4.566 -3.376 1.00 . A A . 6 IAS OD1 1 1
18 3459 1 1 6 . OXT O 11.560 -8.466 -5.670 1.00 . A A . 6 IAS OXT 1 1
18 3460 1 1 7 GLY C C 10.921 -5.966 -1.550 1.00 . A A . 7 GLY C 1 1
18 3461 1 1 7 GLY CA C 12.427 -5.809 -1.470 1.00 . A A . 7 GLY CA 1 1
18 3462 1 1 7 GLY H H 13.044 -7.452 -2.654 1.00 . A A . 7 GLY H 1 1
18 3463 1 1 7 GLY HA2 H 12.772 -6.221 -0.533 1.00 . A A . 7 GLY HA2 1 1
18 3464 1 1 7 GLY HA3 H 12.669 -4.757 -1.500 1.00 . A A . 7 GLY HA3 1 1
18 3465 1 1 7 GLY N N 13.113 -6.479 -2.559 1.00 . A A . 7 GLY N 1 1
18 3466 1 1 7 GLY O O 10.174 -5.127 -1.045 1.00 . A A . 7 GLY O 1 1
18 3467 1 1 8 CYS C C 8.738 -8.781 -2.085 1.00 . A A . 8 CYS C 1 1
18 3468 1 1 8 CYS CA C 9.047 -7.307 -2.333 1.00 . A A . 8 CYS CA 1 1
18 3469 1 1 8 CYS CB C 8.573 -6.903 -3.730 1.00 . A A . 8 CYS CB 1 1
18 3470 1 1 8 CYS H H 11.118 -7.677 -2.567 1.00 . A A . 8 CYS H 1 1
18 3471 1 1 8 CYS HA H 8.522 -6.714 -1.599 1.00 . A A . 8 CYS HA 1 1
18 3472 1 1 8 CYS HB2 H 9.021 -5.956 -3.994 1.00 . A A . 8 CYS HB2 1 1
18 3473 1 1 8 CYS HB3 H 8.888 -7.654 -4.440 1.00 . A A . 8 CYS HB3 1 1
18 3474 1 1 8 CYS N N 10.473 -7.043 -2.186 1.00 . A A . 8 CYS N 1 1
18 3475 1 1 8 CYS O O 9.495 -9.661 -2.494 1.00 . A A . 8 CYS O 1 1
18 3476 1 1 8 CYS SG S 6.767 -6.721 -3.879 1.00 . A A . 8 CYS SG 1 1
18 3477 1 1 9 ALA C C 6.303 -10.960 -2.206 1.00 . A A . 9 ALA C 1 1
18 3478 1 1 9 ALA CA C 7.211 -10.408 -1.113 1.00 . A A . 9 ALA CA 1 1
18 3479 1 1 9 ALA CB C 6.512 -10.464 0.237 1.00 . A A . 9 ALA CB 1 1
18 3480 1 1 9 ALA H H 7.060 -8.297 -1.113 1.00 . A A . 9 ALA H 1 1
18 3481 1 1 9 ALA HA H 8.101 -11.018 -1.056 1.00 . A A . 9 ALA HA 1 1
18 3482 1 1 9 ALA HB1 H 5.705 -9.746 0.253 1.00 . A A . 9 ALA HB1 1 1
18 3483 1 1 9 ALA HB2 H 6.115 -11.456 0.395 1.00 . A A . 9 ALA HB2 1 1
18 3484 1 1 9 ALA HB3 H 7.219 -10.230 1.018 1.00 . A A . 9 ALA HB3 1 1
18 3485 1 1 9 ALA N N 7.622 -9.041 -1.413 1.00 . A A . 9 ALA N 1 1
18 3486 1 1 9 ALA O O 6.076 -10.311 -3.227 1.00 . A A . 9 ALA O 1 1
18 3487 1 1 10 LYS C C 3.469 -12.860 -2.425 1.00 . A A . 10 LYS C 1 1
18 3488 1 1 10 LYS CA C 4.900 -12.805 -2.951 1.00 . A A . 10 LYS CA 1 1
18 3489 1 1 10 LYS CB C 5.393 -14.219 -3.265 1.00 . A A . 10 LYS CB 1 1
18 3490 1 1 10 LYS CD C 6.233 -15.575 -5.206 1.00 . A A . 10 LYS CD 1 1
18 3491 1 1 10 LYS CE C 7.404 -14.797 -5.785 1.00 . A A . 10 LYS CE 1 1
18 3492 1 1 10 LYS CG C 5.142 -14.646 -4.701 1.00 . A A . 10 LYS CG 1 1
18 3493 1 1 10 LYS H H 6.003 -12.633 -1.152 1.00 . A A . 10 LYS H 1 1
18 3494 1 1 10 LYS HA H 4.915 -12.218 -3.856 1.00 . A A . 10 LYS HA 1 1
18 3495 1 1 10 LYS HB2 H 6.456 -14.267 -3.078 1.00 . A A . 10 LYS HB2 1 1
18 3496 1 1 10 LYS HB3 H 4.890 -14.917 -2.611 1.00 . A A . 10 LYS HB3 1 1
18 3497 1 1 10 LYS HD2 H 6.588 -16.179 -4.384 1.00 . A A . 10 LYS HD2 1 1
18 3498 1 1 10 LYS HD3 H 5.822 -16.215 -5.974 1.00 . A A . 10 LYS HD3 1 1
18 3499 1 1 10 LYS HE2 H 7.729 -14.067 -5.059 1.00 . A A . 10 LYS HE2 1 1
18 3500 1 1 10 LYS HE3 H 8.211 -15.485 -5.989 1.00 . A A . 10 LYS HE3 1 1
18 3501 1 1 10 LYS HG2 H 4.194 -15.160 -4.754 1.00 . A A . 10 LYS HG2 1 1
18 3502 1 1 10 LYS HG3 H 5.112 -13.766 -5.328 1.00 . A A . 10 LYS HG3 1 1
18 3503 1 1 10 LYS HZ1 H 6.707 -13.131 -6.834 1.00 . A A . 10 LYS HZ1 1 1
18 3504 1 1 10 LYS HZ2 H 6.273 -14.610 -7.531 1.00 . A A . 10 LYS HZ2 1 1
18 3505 1 1 10 LYS HZ3 H 7.858 -14.039 -7.678 1.00 . A A . 10 LYS HZ3 1 1
18 3506 1 1 10 LYS N N 5.785 -12.164 -1.986 1.00 . A A . 10 LYS N 1 1
18 3507 1 1 10 LYS NZ N 7.035 -14.095 -7.046 1.00 . A A . 10 LYS NZ 1 1
18 3508 1 1 10 LYS O O 3.187 -12.467 -1.292 1.00 . A A . 10 LYS O 1 1
18 3509 1 1 11 . C C 0.573 -12.071 -2.424 1.00 . A A . 11 DBB C 1 1
18 3510 1 1 11 . CA C 1.176 -13.431 -2.820 1.00 . A A . 11 DBB CA 1 1
18 3511 1 1 11 . CB C 0.362 -14.111 -3.939 1.00 . A A . 11 DBB CB 1 1
18 3512 1 1 11 . CG C -1.042 -14.410 -3.438 1.00 . A A . 11 DBB CG 1 1
18 3513 1 1 11 . H H 2.825 -13.655 -4.147 1.00 . A A . 11 DBB H 1 1
18 3514 1 1 11 . HA H 1.140 -14.074 -1.963 1.00 . A A . 11 DBB HA 1 1
18 3515 1 1 11 . HB2 H 0.842 -15.050 -4.110 1.00 . A A . 11 DBB HB2 1 1
18 3516 1 1 11 . HG1 H -1.527 -15.073 -4.138 1.00 . A A . 11 DBB HG1 1 1
18 3517 1 1 11 . HG2 H -1.602 -13.491 -3.362 1.00 . A A . 11 DBB HG2 1 1
18 3518 1 1 11 . HG3 H -0.985 -14.884 -2.471 1.00 . A A . 11 DBB HG3 1 1
18 3519 1 1 11 . N N 2.564 -13.350 -3.248 1.00 . A A . 11 DBB N 1 1
18 3520 1 1 11 . O O 1.033 -11.052 -2.941 1.00 . A A . 11 DBB O 1 1
18 3521 1 1 12 CYS C C -0.153 -9.895 -0.442 1.00 . A A . 12 CYS C 1 1
18 3522 1 1 12 CYS CA C -1.110 -10.809 -1.201 1.00 . A A . 12 CYS CA 1 1
18 3523 1 1 12 CYS CB C -2.343 -11.100 -0.343 1.00 . A A . 12 CYS CB 1 1
18 3524 1 1 12 CYS H H -0.774 -12.898 -1.199 1.00 . A A . 12 CYS H 1 1
18 3525 1 1 12 CYS HA H -1.422 -10.310 -2.106 1.00 . A A . 12 CYS HA 1 1
18 3526 1 1 12 CYS HB2 H -2.053 -11.725 0.489 1.00 . A A . 12 CYS HB2 1 1
18 3527 1 1 12 CYS HB3 H -2.738 -10.168 0.034 1.00 . A A . 12 CYS HB3 1 1
18 3528 1 1 12 CYS N N -0.452 -12.053 -1.579 1.00 . A A . 12 CYS N 1 1
18 3529 1 1 12 CYS O O -0.438 -8.716 -0.233 1.00 . A A . 12 CYS O 1 1
18 3530 1 1 12 CYS SG S -3.685 -11.952 -1.233 1.00 . A A . 12 CYS SG 1 1
18 3531 1 1 13 ALA C C 2.246 -8.338 0.034 1.00 . A A . 13 ALA C 1 1
18 3532 1 1 13 ALA CA C 1.985 -9.684 0.701 1.00 . A A . 13 ALA CA 1 1
18 3533 1 1 13 ALA CB C 3.278 -10.478 0.814 1.00 . A A . 13 ALA CB 1 1
18 3534 1 1 13 ALA H H 1.154 -11.393 -0.229 1.00 . A A . 13 ALA H 1 1
18 3535 1 1 13 ALA HA H 1.609 -9.512 1.700 1.00 . A A . 13 ALA HA 1 1
18 3536 1 1 13 ALA HB1 H 3.050 -11.499 1.084 1.00 . A A . 13 ALA HB1 1 1
18 3537 1 1 13 ALA HB2 H 3.793 -10.463 -0.135 1.00 . A A . 13 ALA HB2 1 1
18 3538 1 1 13 ALA HB3 H 3.906 -10.037 1.573 1.00 . A A . 13 ALA HB3 1 1
18 3539 1 1 13 ALA N N 0.984 -10.448 -0.032 1.00 . A A . 13 ALA N 1 1
18 3540 1 1 13 ALA O O 2.377 -7.328 0.725 1.00 . A A . 13 ALA O 1 1
18 3541 1 1 14 ALA C C 2.450 -7.562 -3.610 1.00 . A A . 14 ALA C 1 1
18 3542 1 1 14 ALA CA C 2.552 -7.150 -2.074 1.00 . A A . 14 ALA CA 1 1
18 3543 1 1 14 ALA CB C 3.882 -6.535 -1.834 1.00 . A A . 14 ALA CB 1 1
18 3544 1 1 14 ALA H H 2.197 -9.199 -1.749 1.00 . A A . 14 ALA H 1 1
18 3545 1 1 14 ALA HA H 1.745 -6.459 -1.925 1.00 . A A . 14 ALA HA 1 1
18 3546 1 1 14 ALA HB1 H 4.563 -7.273 -1.436 1.00 . A A . 14 ALA HB1 1 1
18 3547 1 1 14 ALA HB2 H 4.248 -6.193 -2.791 1.00 . A A . 14 ALA HB2 1 1
18 3548 1 1 14 ALA N N 2.315 -8.344 -1.284 1.00 . A A . 14 ALA N 1 1
18 3549 1 1 14 ALA O O 1.741 -6.924 -4.389 1.00 . A A . 14 ALA O 1 1
18 3550 1 1 15 SER C C 1.778 -9.214 -5.911 1.00 . A A . 15 SER C 1 1
18 3551 1 1 15 SER CA C 3.197 -9.068 -5.371 1.00 . A A . 15 SER CA 1 1
18 3552 1 1 15 SER CB C 3.935 -10.404 -5.475 1.00 . A A . 15 SER CB 1 1
18 3553 1 1 15 SER H H 3.726 -9.073 -3.320 1.00 . A A . 15 SER H 1 1
18 3554 1 1 15 SER HA H 3.721 -8.331 -5.961 1.00 . A A . 15 SER HA 1 1
18 3555 1 1 15 SER HB2 H 4.984 -10.250 -5.273 1.00 . A A . 15 SER HB2 1 1
18 3556 1 1 15 SER HB3 H 3.526 -11.095 -4.752 1.00 . A A . 15 SER HB3 1 1
18 3557 1 1 15 SER HG H 4.497 -11.602 -6.920 1.00 . A A . 15 SER HG 1 1
18 3558 1 1 15 SER N N 3.182 -8.605 -3.988 1.00 . A A . 15 SER N 1 1
18 3559 1 1 15 SER O O 1.307 -8.379 -6.684 1.00 . A A . 15 SER O 1 1
18 3560 1 1 15 SER OG O 3.797 -10.963 -6.770 1.00 . A A . 15 SER OG 1 1
18 3561 1 1 16 CYS C C -1.228 -9.507 -5.357 1.00 . A A . 16 CYS C 1 1
18 3562 1 1 16 CYS CA C -0.264 -10.537 -5.938 1.00 . A A . 16 CYS CA 1 1
18 3563 1 1 16 CYS CB C -0.698 -11.946 -5.527 1.00 . A A . 16 CYS CB 1 1
18 3564 1 1 16 CYS H H 1.531 -10.909 -4.880 1.00 . A A . 16 CYS H 1 1
18 3565 1 1 16 CYS HA H -0.285 -10.464 -7.015 1.00 . A A . 16 CYS HA 1 1
18 3566 1 1 16 CYS HB2 H -0.868 -11.965 -4.460 1.00 . A A . 16 CYS HB2 1 1
18 3567 1 1 16 CYS HB3 H -1.617 -12.194 -6.037 1.00 . A A . 16 CYS HB3 1 1
18 3568 1 1 16 CYS N N 1.101 -10.280 -5.497 1.00 . A A . 16 CYS N 1 1
18 3569 1 1 16 CYS O O -1.246 -9.271 -4.149 1.00 . A A . 16 CYS O 1 1
18 3570 1 1 16 CYS SG S 0.521 -13.243 -5.915 1.00 . A A . 16 CYS SG 1 1
18 3571 1 1 17 ALA C C -4.210 -8.543 -5.149 1.00 . A A . 17 ALA C 1 1
18 3572 1 1 17 ALA CA C -2.994 -7.892 -5.799 1.00 . A A . 17 ALA CA 1 1
18 3573 1 1 17 ALA CB C -3.421 -7.034 -6.981 1.00 . A A . 17 ALA CB 1 1
18 3574 1 1 17 ALA H H -1.965 -9.126 -7.176 1.00 . A A . 17 ALA H 1 1
18 3575 1 1 17 ALA HA H -2.512 -7.250 -5.075 1.00 . A A . 17 ALA HA 1 1
18 3576 1 1 17 ALA HB1 H -2.730 -6.211 -7.095 1.00 . A A . 17 ALA HB1 1 1
18 3577 1 1 17 ALA HB2 H -3.419 -7.633 -7.879 1.00 . A A . 17 ALA HB2 1 1
18 3578 1 1 17 ALA HB3 H -4.414 -6.649 -6.806 1.00 . A A . 17 ALA HB3 1 1
18 3579 1 1 17 ALA N N -2.026 -8.895 -6.226 1.00 . A A . 17 ALA N 1 1
18 3580 1 1 17 ALA O O -5.280 -8.579 -5.755 1.00 . A A . 17 ALA O 1 1
18 3581 1 1 18 ALA C C -6.233 -8.616 -2.942 1.00 . A A . 18 ALA C 1 1
18 3582 1 1 18 ALA CA C -5.081 -9.690 -3.180 1.00 . A A . 18 ALA CA 1 1
18 3583 1 1 18 ALA CB C -4.630 -10.205 -1.864 1.00 . A A . 18 ALA CB 1 1
18 3584 1 1 18 ALA H H -3.138 -8.965 -3.538 1.00 . A A . 18 ALA H 1 1
18 3585 1 1 18 ALA HA H -5.540 -10.449 -3.786 1.00 . A A . 18 ALA HA 1 1
18 3586 1 1 18 ALA HB1 H -3.955 -9.498 -1.402 1.00 . A A . 18 ALA HB1 1 1
18 3587 1 1 18 ALA HB2 H -5.511 -10.309 -1.248 1.00 . A A . 18 ALA HB2 1 1
18 3588 1 1 18 ALA N N -4.028 -9.041 -3.941 1.00 . A A . 18 ALA N 1 1
18 3589 1 1 18 ALA O O -7.419 -8.942 -2.988 1.00 . A A . 18 ALA O 1 1
18 3590 1 1 19 SER C C -7.063 -5.500 -3.677 1.00 . A A . 19 SER C 1 1
18 3591 1 1 19 SER CA C -6.787 -6.305 -2.411 1.00 . A A . 19 SER CA 1 1
18 3592 1 1 19 SER CB C -6.258 -5.382 -1.311 1.00 . A A . 19 SER CB 1 1
18 3593 1 1 19 SER H H -4.873 -7.179 -2.652 1.00 . A A . 19 SER H 1 1
18 3594 1 1 19 SER HA H -7.709 -6.757 -2.077 1.00 . A A . 19 SER HA 1 1
18 3595 1 1 19 SER HB2 H -6.535 -5.781 -0.347 1.00 . A A . 19 SER HB2 1 1
18 3596 1 1 19 SER HB3 H -5.182 -5.323 -1.381 1.00 . A A . 19 SER HB3 1 1
18 3597 1 1 19 SER HG H -7.658 -4.044 -1.016 1.00 . A A . 19 SER HG 1 1
18 3598 1 1 19 SER N N -5.833 -7.377 -2.674 1.00 . A A . 19 SER N 1 1
18 3599 1 1 19 SER O O -6.159 -4.892 -4.247 1.00 . A A . 19 SER O 1 1
18 3600 1 1 19 SER OG O -6.797 -4.078 -1.438 1.00 . A A . 19 SER OG 1 1
19 3601 1 1 1 ALA C C 5.997 -0.506 -0.780 1.00 . A A . 1 ALA C 1 1
19 3602 1 1 1 ALA CA C 5.213 0.485 0.073 1.00 . A A . 1 ALA CA 1 1
19 3603 1 1 1 ALA CB C 4.688 1.625 -0.787 1.00 . A A . 1 ALA CB 1 1
19 3604 1 1 1 ALA H1 H 6.975 0.741 1.217 1.00 . A A . 1 ALA H1 1 1
19 3605 1 1 1 ALA HA H 4.365 -0.023 0.510 1.00 . A A . 1 ALA HA 1 1
19 3606 1 1 1 ALA HB1 H 4.701 1.327 -1.825 1.00 . A A . 1 ALA HB1 1 1
19 3607 1 1 1 ALA HB2 H 3.677 1.863 -0.492 1.00 . A A . 1 ALA HB2 1 1
19 3608 1 1 1 ALA HB3 H 5.316 2.494 -0.654 1.00 . A A . 1 ALA HB3 1 1
19 3609 1 1 1 ALA N N 6.034 1.007 1.159 1.00 . A A . 1 ALA N 1 1
19 3610 1 1 1 ALA O O 7.215 -0.392 -0.922 1.00 . A A . 1 ALA O 1 1
19 3611 1 1 2 CYS C C 5.915 -2.065 -3.651 1.00 . A A . 2 CYS C 1 1
19 3612 1 1 2 CYS CA C 5.921 -2.492 -2.186 1.00 . A A . 2 CYS CA 1 1
19 3613 1 1 2 CYS CB C 5.201 -3.833 -2.031 1.00 . A A . 2 CYS CB 1 1
19 3614 1 1 2 CYS H H 4.323 -1.518 -1.197 1.00 . A A . 2 CYS H 1 1
19 3615 1 1 2 CYS HA H 6.944 -2.603 -1.861 1.00 . A A . 2 CYS HA 1 1
19 3616 1 1 2 CYS HB2 H 4.437 -3.736 -1.272 1.00 . A A . 2 CYS HB2 1 1
19 3617 1 1 2 CYS HB3 H 4.737 -4.094 -2.970 1.00 . A A . 2 CYS HB3 1 1
19 3618 1 1 2 CYS N N 5.292 -1.479 -1.347 1.00 . A A . 2 CYS N 1 1
19 3619 1 1 2 CYS O O 4.935 -2.274 -4.365 1.00 . A A . 2 CYS O 1 1
19 3620 1 1 2 CYS SG S 6.290 -5.210 -1.546 1.00 . A A . 2 CYS SG 1 1
19 3621 1 1 3 GLY C C 7.276 -2.170 -6.442 1.00 . A A . 3 GLY C 1 1
19 3622 1 1 3 GLY CA C 7.118 -1.019 -5.469 1.00 . A A . 3 GLY CA 1 1
19 3623 1 1 3 GLY H H 7.767 -1.325 -3.477 1.00 . A A . 3 GLY H 1 1
19 3624 1 1 3 GLY HA2 H 6.225 -0.466 -5.723 1.00 . A A . 3 GLY HA2 1 1
19 3625 1 1 3 GLY HA3 H 7.972 -0.365 -5.562 1.00 . A A . 3 GLY HA3 1 1
19 3626 1 1 3 GLY N N 7.017 -1.465 -4.092 1.00 . A A . 3 GLY N 1 1
19 3627 1 1 3 GLY O O 6.922 -2.067 -7.617 1.00 . A A . 3 GLY O 1 1
19 3628 1 1 4 . C C 9.361 -4.429 -7.553 1.00 . A A . 4 DBB C 1 1
19 3629 1 1 4 . CA C 7.999 -4.420 -6.836 1.00 . A A . 4 DBB CA 1 1
19 3630 1 1 4 . CB C 7.781 -5.704 -6.011 1.00 . A A . 4 DBB CB 1 1
19 3631 1 1 4 . CG C 7.753 -6.908 -6.939 1.00 . A A . 4 DBB CG 1 1
19 3632 1 1 4 . H H 8.081 -3.323 -5.015 1.00 . A A . 4 DBB H 1 1
19 3633 1 1 4 . HA H 7.230 -4.386 -7.582 1.00 . A A . 4 DBB HA 1 1
19 3634 1 1 4 . HB2 H 6.804 -5.609 -5.589 1.00 . A A . 4 DBB HB2 1 1
19 3635 1 1 4 . HG1 H 8.557 -7.575 -6.669 1.00 . A A . 4 DBB HG1 1 1
19 3636 1 1 4 . HG2 H 7.882 -6.580 -7.960 1.00 . A A . 4 DBB HG2 1 1
19 3637 1 1 4 . HG3 H 6.809 -7.419 -6.837 1.00 . A A . 4 DBB HG3 1 1
19 3638 1 1 4 . N N 7.810 -3.276 -5.959 1.00 . A A . 4 DBB N 1 1
19 3639 1 1 4 . O O 9.379 -4.542 -8.777 1.00 . A A . 4 DBB O 1 1
19 3640 1 1 5 GLY C C 12.889 -4.022 -6.456 1.00 . A A . 5 GLY C 1 1
19 3641 1 1 5 GLY CA C 11.768 -4.211 -7.457 1.00 . A A . 5 GLY CA 1 1
19 3642 1 1 5 GLY H H 10.388 -4.180 -5.852 1.00 . A A . 5 GLY H 1 1
19 3643 1 1 5 GLY HA2 H 11.932 -5.131 -7.997 1.00 . A A . 5 GLY HA2 1 1
19 3644 1 1 5 GLY HA3 H 11.782 -3.388 -8.156 1.00 . A A . 5 GLY HA3 1 1
19 3645 1 1 5 GLY N N 10.462 -4.265 -6.825 1.00 . A A . 5 GLY N 1 1
19 3646 1 1 5 GLY O O 13.814 -3.230 -6.615 1.00 . A A . 5 GLY O 1 1
19 3647 1 1 6 . C C 15.181 -5.446 -4.829 1.00 . A A . 6 IAS C 1 1
19 3648 1 1 6 . CA C 13.914 -4.744 -4.376 1.00 . A A . 6 IAS CA 1 1
19 3649 1 1 6 . CB C 13.492 -5.234 -2.979 1.00 . A A . 6 IAS CB 1 1
19 3650 1 1 6 . CG C 12.878 -6.627 -2.986 1.00 . A A . 6 IAS CG 1 1
19 3651 1 1 6 . H H 12.087 -5.423 -5.207 1.00 . A A . 6 IAS H 1 1
19 3652 1 1 6 . HA H 14.237 -3.713 -4.295 1.00 . A A . 6 IAS HA 1 1
19 3653 1 1 6 . HB2 H 12.723 -4.570 -2.610 1.00 . A A . 6 IAS HB2 1 1
19 3654 1 1 6 . HB3 H 14.347 -5.193 -2.322 1.00 . A A . 6 IAS HB3 1 1
19 3655 1 1 6 . HXT H 15.619 -6.760 -6.174 1.00 . A A . 6 IAS HXT 1 1
19 3656 1 1 6 . N N 12.833 -4.777 -5.347 1.00 . A A . 6 IAS N 1 1
19 3657 1 1 6 . O O 16.295 -5.017 -4.667 1.00 . A A . 6 IAS O 1 1
19 3658 1 1 6 . OD1 O 12.319 -7.082 -3.983 1.00 . A A . 6 IAS OD1 1 1
19 3659 1 1 6 . OXT O 14.909 -6.544 -5.551 1.00 . A A . 6 IAS OXT 1 1
19 3660 1 1 7 GLY C C 10.927 -8.632 -1.550 1.00 . A A . 7 GLY C 1 1
19 3661 1 1 7 GLY CA C 12.433 -8.640 -1.721 1.00 . A A . 7 GLY CA 1 1
19 3662 1 1 7 GLY H H 13.441 -6.890 -1.082 1.00 . A A . 7 GLY H 1 1
19 3663 1 1 7 GLY HA2 H 12.682 -9.203 -2.608 1.00 . A A . 7 GLY HA2 1 1
19 3664 1 1 7 GLY HA3 H 12.879 -9.122 -0.863 1.00 . A A . 7 GLY HA3 1 1
19 3665 1 1 7 GLY N N 12.984 -7.303 -1.845 1.00 . A A . 7 GLY N 1 1
19 3666 1 1 7 GLY O O 10.413 -8.992 -0.490 1.00 . A A . 7 GLY O 1 1
19 3667 1 1 8 CYS C C 8.167 -9.562 -2.399 1.00 . A A . 8 CYS C 1 1
19 3668 1 1 8 CYS CA C 8.760 -8.165 -2.555 1.00 . A A . 8 CYS CA 1 1
19 3669 1 1 8 CYS CB C 8.220 -7.508 -3.827 1.00 . A A . 8 CYS CB 1 1
19 3670 1 1 8 CYS H H 10.683 -7.946 -3.412 1.00 . A A . 8 CYS H 1 1
19 3671 1 1 8 CYS HA H 8.474 -7.568 -1.703 1.00 . A A . 8 CYS HA 1 1
19 3672 1 1 8 CYS HB2 H 8.397 -8.166 -4.666 1.00 . A A . 8 CYS HB2 1 1
19 3673 1 1 8 CYS HB3 H 7.157 -7.350 -3.718 1.00 . A A . 8 CYS HB3 1 1
19 3674 1 1 8 CYS N N 10.217 -8.220 -2.594 1.00 . A A . 8 CYS N 1 1
19 3675 1 1 8 CYS O O 8.368 -10.431 -3.247 1.00 . A A . 8 CYS O 1 1
19 3676 1 1 8 CYS SG S 8.983 -5.900 -4.216 1.00 . A A . 8 CYS SG 1 1
19 3677 1 1 9 ALA C C 5.704 -11.352 -2.051 1.00 . A A . 9 ALA C 1 1
19 3678 1 1 9 ALA CA C 6.810 -11.059 -1.043 1.00 . A A . 9 ALA CA 1 1
19 3679 1 1 9 ALA CB C 6.259 -11.096 0.375 1.00 . A A . 9 ALA CB 1 1
19 3680 1 1 9 ALA H H 7.311 -9.037 -0.670 1.00 . A A . 9 ALA H 1 1
19 3681 1 1 9 ALA HA H 7.571 -11.822 -1.127 1.00 . A A . 9 ALA HA 1 1
19 3682 1 1 9 ALA HB1 H 5.852 -10.128 0.627 1.00 . A A . 9 ALA HB1 1 1
19 3683 1 1 9 ALA HB2 H 5.481 -11.842 0.439 1.00 . A A . 9 ALA HB2 1 1
19 3684 1 1 9 ALA HB3 H 7.054 -11.343 1.063 1.00 . A A . 9 ALA HB3 1 1
19 3685 1 1 9 ALA N N 7.435 -9.769 -1.310 1.00 . A A . 9 ALA N 1 1
19 3686 1 1 9 ALA O O 5.332 -10.491 -2.848 1.00 . A A . 9 ALA O 1 1
19 3687 1 1 10 LYS C C 2.747 -12.809 -2.265 1.00 . A A . 10 LYS C 1 1
19 3688 1 1 10 LYS CA C 4.115 -12.979 -2.919 1.00 . A A . 10 LYS CA 1 1
19 3689 1 1 10 LYS CB C 4.310 -14.436 -3.346 1.00 . A A . 10 LYS CB 1 1
19 3690 1 1 10 LYS CD C 5.486 -14.001 -5.522 1.00 . A A . 10 LYS CD 1 1
19 3691 1 1 10 LYS CE C 6.809 -14.088 -6.269 1.00 . A A . 10 LYS CE 1 1
19 3692 1 1 10 LYS CG C 5.571 -14.668 -4.159 1.00 . A A . 10 LYS CG 1 1
19 3693 1 1 10 LYS H H 5.518 -13.215 -1.351 1.00 . A A . 10 LYS H 1 1
19 3694 1 1 10 LYS HA H 4.165 -12.347 -3.792 1.00 . A A . 10 LYS HA 1 1
19 3695 1 1 10 LYS HB2 H 4.358 -15.054 -2.461 1.00 . A A . 10 LYS HB2 1 1
19 3696 1 1 10 LYS HB3 H 3.462 -14.740 -3.942 1.00 . A A . 10 LYS HB3 1 1
19 3697 1 1 10 LYS HD2 H 4.723 -14.493 -6.107 1.00 . A A . 10 LYS HD2 1 1
19 3698 1 1 10 LYS HD3 H 5.226 -12.961 -5.389 1.00 . A A . 10 LYS HD3 1 1
19 3699 1 1 10 LYS HE2 H 7.582 -13.651 -5.656 1.00 . A A . 10 LYS HE2 1 1
19 3700 1 1 10 LYS HE3 H 7.037 -15.128 -6.450 1.00 . A A . 10 LYS HE3 1 1
19 3701 1 1 10 LYS HG2 H 6.415 -14.259 -3.623 1.00 . A A . 10 LYS HG2 1 1
19 3702 1 1 10 LYS HG3 H 5.710 -15.731 -4.296 1.00 . A A . 10 LYS HG3 1 1
19 3703 1 1 10 LYS HZ1 H 6.617 -12.351 -7.412 1.00 . A A . 10 LYS HZ1 1 1
19 3704 1 1 10 LYS HZ2 H 5.972 -13.730 -8.149 1.00 . A A . 10 LYS HZ2 1 1
19 3705 1 1 10 LYS HZ3 H 7.648 -13.507 -8.091 1.00 . A A . 10 LYS HZ3 1 1
19 3706 1 1 10 LYS N N 5.180 -12.572 -2.010 1.00 . A A . 10 LYS N 1 1
19 3707 1 1 10 LYS NZ N 6.758 -13.369 -7.571 1.00 . A A . 10 LYS NZ 1 1
19 3708 1 1 10 LYS O O 2.633 -12.353 -1.127 1.00 . A A . 10 LYS O 1 1
19 3709 1 1 11 . C C 0.059 -11.626 -1.911 1.00 . A A . 11 DBB C 1 1
19 3710 1 1 11 . CA C 0.369 -13.041 -2.433 1.00 . A A . 11 DBB CA 1 1
19 3711 1 1 11 . CB C -0.647 -13.487 -3.504 1.00 . A A . 11 DBB CB 1 1
19 3712 1 1 11 . CG C -2.034 -13.568 -2.889 1.00 . A A . 11 DBB CG 1 1
19 3713 1 1 11 . H H 1.835 -13.537 -3.893 1.00 . A A . 11 DBB H 1 1
19 3714 1 1 11 . HA H 0.288 -13.725 -1.612 1.00 . A A . 11 DBB HA 1 1
19 3715 1 1 11 . HB2 H -0.362 -14.482 -3.770 1.00 . A A . 11 DBB HB2 1 1
19 3716 1 1 11 . HG1 H -2.691 -14.078 -3.577 1.00 . A A . 11 DBB HG1 1 1
19 3717 1 1 11 . HG2 H -2.406 -12.571 -2.705 1.00 . A A . 11 DBB HG2 1 1
19 3718 1 1 11 . HG3 H -1.986 -14.116 -1.962 1.00 . A A . 11 DBB HG3 1 1
19 3719 1 1 11 . N N 1.707 -13.177 -2.987 1.00 . A A . 11 DBB N 1 1
19 3720 1 1 11 . O O 0.584 -10.665 -2.473 1.00 . A A . 11 DBB O 1 1
19 3721 1 1 12 CYS C C -0.092 -9.607 0.499 1.00 . A A . 12 CYS C 1 1
19 3722 1 1 12 CYS CA C -1.186 -10.185 -0.394 1.00 . A A . 12 CYS CA 1 1
19 3723 1 1 12 CYS CB C -2.497 -10.285 0.387 1.00 . A A . 12 CYS CB 1 1
19 3724 1 1 12 CYS H H -1.186 -12.300 -0.498 1.00 . A A . 12 CYS H 1 1
19 3725 1 1 12 CYS HA H -1.329 -9.528 -1.239 1.00 . A A . 12 CYS HA 1 1
19 3726 1 1 12 CYS HB2 H -3.117 -11.048 -0.062 1.00 . A A . 12 CYS HB2 1 1
19 3727 1 1 12 CYS HB3 H -2.279 -10.561 1.408 1.00 . A A . 12 CYS HB3 1 1
19 3728 1 1 12 CYS N N -0.801 -11.495 -0.906 1.00 . A A . 12 CYS N 1 1
19 3729 1 1 12 CYS O O -0.324 -9.314 1.671 1.00 . A A . 12 CYS O 1 1
19 3730 1 1 12 CYS SG S -3.461 -8.740 0.422 1.00 . A A . 12 CYS SG 1 1
19 3731 1 1 13 ALA C C 2.864 -7.731 -0.066 1.00 . A A . 13 ALA C 1 1
19 3732 1 1 13 ALA CA C 2.230 -8.901 0.678 1.00 . A A . 13 ALA CA 1 1
19 3733 1 1 13 ALA CB C 3.264 -9.986 0.938 1.00 . A A . 13 ALA CB 1 1
19 3734 1 1 13 ALA H H 1.224 -9.698 -1.004 1.00 . A A . 13 ALA H 1 1
19 3735 1 1 13 ALA HA H 1.864 -8.551 1.633 1.00 . A A . 13 ALA HA 1 1
19 3736 1 1 13 ALA HB1 H 3.879 -10.115 0.059 1.00 . A A . 13 ALA HB1 1 1
19 3737 1 1 13 ALA HB2 H 3.885 -9.699 1.774 1.00 . A A . 13 ALA HB2 1 1
19 3738 1 1 13 ALA HB3 H 2.762 -10.915 1.165 1.00 . A A . 13 ALA HB3 1 1
19 3739 1 1 13 ALA N N 1.101 -9.446 -0.065 1.00 . A A . 13 ALA N 1 1
19 3740 1 1 13 ALA O O 3.316 -6.777 0.567 1.00 . A A . 13 ALA O 1 1
19 3741 1 1 14 ALA C C 3.066 -7.160 -3.743 1.00 . A A . 14 ALA C 1 1
19 3742 1 1 14 ALA CA C 3.451 -6.795 -2.241 1.00 . A A . 14 ALA CA 1 1
19 3743 1 1 14 ALA CB C 4.928 -6.684 -2.141 1.00 . A A . 14 ALA CB 1 1
19 3744 1 1 14 ALA H H 2.504 -8.622 -1.798 1.00 . A A . 14 ALA H 1 1
19 3745 1 1 14 ALA HA H 2.954 -5.863 -2.052 1.00 . A A . 14 ALA HA 1 1
19 3746 1 1 14 ALA HB1 H 5.315 -7.466 -1.505 1.00 . A A . 14 ALA HB1 1 1
19 3747 1 1 14 ALA HB2 H 5.321 -6.812 -3.139 1.00 . A A . 14 ALA HB2 1 1
19 3748 1 1 14 ALA N N 2.889 -7.822 -1.382 1.00 . A A . 14 ALA N 1 1
19 3749 1 1 14 ALA O O 2.740 -6.282 -4.542 1.00 . A A . 14 ALA O 1 1
19 3750 1 1 15 SER C C 1.342 -8.811 -5.707 1.00 . A A . 15 SER C 1 1
19 3751 1 1 15 SER CA C 2.837 -8.909 -5.421 1.00 . A A . 15 SER CA 1 1
19 3752 1 1 15 SER CB C 3.310 -10.352 -5.605 1.00 . A A . 15 SER CB 1 1
19 3753 1 1 15 SER H H 3.405 -9.098 -3.390 1.00 . A A . 15 SER H 1 1
19 3754 1 1 15 SER HA H 3.367 -8.274 -6.115 1.00 . A A . 15 SER HA 1 1
19 3755 1 1 15 SER HB2 H 3.082 -10.919 -4.715 1.00 . A A . 15 SER HB2 1 1
19 3756 1 1 15 SER HB3 H 2.800 -10.790 -6.451 1.00 . A A . 15 SER HB3 1 1
19 3757 1 1 15 SER HG H 4.875 -10.801 -6.694 1.00 . A A . 15 SER HG 1 1
19 3758 1 1 15 SER N N 3.139 -8.446 -4.071 1.00 . A A . 15 SER N 1 1
19 3759 1 1 15 SER O O 0.899 -7.953 -6.470 1.00 . A A . 15 SER O 1 1
19 3760 1 1 15 SER OG O 4.707 -10.406 -5.836 1.00 . A A . 15 SER OG 1 1
19 3761 1 1 16 CYS C C -1.541 -8.590 -4.485 1.00 . A A . 16 CYS C 1 1
19 3762 1 1 16 CYS CA C -0.877 -9.714 -5.276 1.00 . A A . 16 CYS CA 1 1
19 3763 1 1 16 CYS CB C -1.453 -11.064 -4.846 1.00 . A A . 16 CYS CB 1 1
19 3764 1 1 16 CYS H H 0.980 -10.358 -4.492 1.00 . A A . 16 CYS H 1 1
19 3765 1 1 16 CYS HA H -1.078 -9.564 -6.326 1.00 . A A . 16 CYS HA 1 1
19 3766 1 1 16 CYS HB2 H -1.485 -11.106 -3.767 1.00 . A A . 16 CYS HB2 1 1
19 3767 1 1 16 CYS HB3 H -2.456 -11.159 -5.235 1.00 . A A . 16 CYS HB3 1 1
19 3768 1 1 16 CYS N N 0.568 -9.698 -5.089 1.00 . A A . 16 CYS N 1 1
19 3769 1 1 16 CYS O O -0.948 -8.035 -3.560 1.00 . A A . 16 CYS O 1 1
19 3770 1 1 16 CYS SG S -0.494 -12.500 -5.426 1.00 . A A . 16 CYS SG 1 1
19 3771 1 1 17 ALA C C -4.510 -7.790 -3.177 1.00 . A A . 17 ALA C 1 1
19 3772 1 1 17 ALA CA C -3.519 -7.207 -4.179 1.00 . A A . 17 ALA CA 1 1
19 3773 1 1 17 ALA CB C -4.243 -6.337 -5.196 1.00 . A A . 17 ALA CB 1 1
19 3774 1 1 17 ALA H H -3.193 -8.741 -5.599 1.00 . A A . 17 ALA H 1 1
19 3775 1 1 17 ALA HA H -2.811 -6.585 -3.649 1.00 . A A . 17 ALA HA 1 1
19 3776 1 1 17 ALA HB1 H -3.638 -6.246 -6.086 1.00 . A A . 17 ALA HB1 1 1
19 3777 1 1 17 ALA HB2 H -5.190 -6.791 -5.448 1.00 . A A . 17 ALA HB2 1 1
19 3778 1 1 17 ALA HB3 H -4.414 -5.358 -4.775 1.00 . A A . 17 ALA HB3 1 1
19 3779 1 1 17 ALA N N -2.774 -8.262 -4.855 1.00 . A A . 17 ALA N 1 1
19 3780 1 1 17 ALA O O -5.285 -7.044 -2.580 1.00 . A A . 17 ALA O 1 1
19 3781 1 1 18 ALA C C -6.841 -9.383 -2.425 1.00 . A A . 18 ALA C 1 1
19 3782 1 1 18 ALA CA C -5.342 -9.812 -2.097 1.00 . A A . 18 ALA CA 1 1
19 3783 1 1 18 ALA CB C -5.065 -9.520 -0.668 1.00 . A A . 18 ALA CB 1 1
19 3784 1 1 18 ALA H H -3.818 -9.611 -3.535 1.00 . A A . 18 ALA H 1 1
19 3785 1 1 18 ALA HA H -5.307 -10.862 -2.318 1.00 . A A . 18 ALA HA 1 1
19 3786 1 1 18 ALA HB1 H -5.811 -8.843 -0.278 1.00 . A A . 18 ALA HB1 1 1
19 3787 1 1 18 ALA HB2 H -5.126 -10.459 -0.138 1.00 . A A . 18 ALA HB2 1 1
19 3788 1 1 18 ALA N N -4.471 -9.099 -3.013 1.00 . A A . 18 ALA N 1 1
19 3789 1 1 18 ALA O O -7.350 -8.403 -1.882 1.00 . A A . 18 ALA O 1 1
19 3790 1 1 19 SER C C -9.782 -9.802 -2.524 1.00 . A A . 19 SER C 1 1
19 3791 1 1 19 SER CA C -8.848 -9.825 -3.730 1.00 . A A . 19 SER CA 1 1
19 3792 1 1 19 SER CB C -9.338 -10.856 -4.749 1.00 . A A . 19 SER CB 1 1
19 3793 1 1 19 SER H H -7.021 -10.896 -3.720 1.00 . A A . 19 SER H 1 1
19 3794 1 1 19 SER HA H -8.848 -8.848 -4.190 1.00 . A A . 19 SER HA 1 1
19 3795 1 1 19 SER HB2 H -10.398 -10.730 -4.904 1.00 . A A . 19 SER HB2 1 1
19 3796 1 1 19 SER HB3 H -8.817 -10.709 -5.684 1.00 . A A . 19 SER HB3 1 1
19 3797 1 1 19 SER HG H -9.449 -12.804 -4.930 1.00 . A A . 19 SER HG 1 1
19 3798 1 1 19 SER N N -7.481 -10.127 -3.322 1.00 . A A . 19 SER N 1 1
19 3799 1 1 19 SER O O -10.383 -10.815 -2.172 1.00 . A A . 19 SER O 1 1
19 3800 1 1 19 SER OG O -9.097 -12.177 -4.295 1.00 . A A . 19 SER OG 1 1
20 3801 1 1 1 ALA C C 3.059 -0.930 -2.459 1.00 . A A . 1 ALA C 1 1
20 3802 1 1 1 ALA CA C 2.596 0.513 -2.287 1.00 . A A . 1 ALA CA 1 1
20 3803 1 1 1 ALA CB C 2.290 0.800 -0.824 1.00 . A A . 1 ALA CB 1 1
20 3804 1 1 1 ALA H1 H 0.649 1.227 -2.707 1.00 . A A . 1 ALA H1 1 1
20 3805 1 1 1 ALA HA H 3.391 1.175 -2.599 1.00 . A A . 1 ALA HA 1 1
20 3806 1 1 1 ALA HB1 H 3.158 1.239 -0.355 1.00 . A A . 1 ALA HB1 1 1
20 3807 1 1 1 ALA HB2 H 1.459 1.486 -0.759 1.00 . A A . 1 ALA HB2 1 1
20 3808 1 1 1 ALA HB3 H 2.036 -0.122 -0.322 1.00 . A A . 1 ALA HB3 1 1
20 3809 1 1 1 ALA N N 1.427 0.791 -3.112 1.00 . A A . 1 ALA N 1 1
20 3810 1 1 1 ALA O O 2.271 -1.808 -2.810 1.00 . A A . 1 ALA O 1 1
20 3811 1 1 2 CYS C C 4.791 -3.011 -3.773 1.00 . A A . 2 CYS C 1 1
20 3812 1 1 2 CYS CA C 4.912 -2.504 -2.339 1.00 . A A . 2 CYS CA 1 1
20 3813 1 1 2 CYS CB C 4.214 -3.473 -1.382 1.00 . A A . 2 CYS CB 1 1
20 3814 1 1 2 CYS H H 4.922 -0.426 -1.933 1.00 . A A . 2 CYS H 1 1
20 3815 1 1 2 CYS HA H 5.958 -2.445 -2.078 1.00 . A A . 2 CYS HA 1 1
20 3816 1 1 2 CYS HB2 H 3.812 -2.916 -0.548 1.00 . A A . 2 CYS HB2 1 1
20 3817 1 1 2 CYS HB3 H 3.406 -3.962 -1.905 1.00 . A A . 2 CYS HB3 1 1
20 3818 1 1 2 CYS N N 4.343 -1.168 -2.210 1.00 . A A . 2 CYS N 1 1
20 3819 1 1 2 CYS O O 4.541 -4.193 -4.005 1.00 . A A . 2 CYS O 1 1
20 3820 1 1 2 CYS SG S 5.304 -4.767 -0.708 1.00 . A A . 2 CYS SG 1 1
20 3821 1 1 3 GLY C C 6.157 -3.109 -6.649 1.00 . A A . 3 GLY C 1 1
20 3822 1 1 3 GLY CA C 4.878 -2.482 -6.131 1.00 . A A . 3 GLY CA 1 1
20 3823 1 1 3 GLY H H 5.168 -1.179 -4.487 1.00 . A A . 3 GLY H 1 1
20 3824 1 1 3 GLY HA2 H 4.069 -3.187 -6.250 1.00 . A A . 3 GLY HA2 1 1
20 3825 1 1 3 GLY HA3 H 4.662 -1.599 -6.714 1.00 . A A . 3 GLY HA3 1 1
20 3826 1 1 3 GLY N N 4.971 -2.108 -4.732 1.00 . A A . 3 GLY N 1 1
20 3827 1 1 3 GLY O O 6.758 -2.632 -7.612 1.00 . A A . 3 GLY O 1 1
20 3828 1 1 4 . C C 9.077 -4.262 -5.796 1.00 . A A . 4 DBB C 1 1
20 3829 1 1 4 . CA C 7.807 -4.835 -6.449 1.00 . A A . 4 DBB CA 1 1
20 3830 1 1 4 . CB C 7.669 -6.349 -6.192 1.00 . A A . 4 DBB CB 1 1
20 3831 1 1 4 . CG C 8.833 -7.084 -6.836 1.00 . A A . 4 DBB CG 1 1
20 3832 1 1 4 . H H 6.077 -4.538 -5.246 1.00 . A A . 4 DBB H 1 1
20 3833 1 1 4 . HA H 7.885 -4.697 -7.509 1.00 . A A . 4 DBB HA 1 1
20 3834 1 1 4 . HB2 H 6.783 -6.647 -6.712 1.00 . A A . 4 DBB HB2 1 1
20 3835 1 1 4 . HG1 H 9.729 -6.883 -6.269 1.00 . A A . 4 DBB HG1 1 1
20 3836 1 1 4 . HG2 H 8.962 -6.738 -7.851 1.00 . A A . 4 DBB HG2 1 1
20 3837 1 1 4 . HG3 H 8.635 -8.144 -6.835 1.00 . A A . 4 DBB HG3 1 1
20 3838 1 1 4 . N N 6.583 -4.184 -6.012 1.00 . A A . 4 DBB N 1 1
20 3839 1 1 4 . O O 8.989 -3.778 -4.668 1.00 . A A . 4 DBB O 1 1
20 3840 1 1 5 GLY C C 12.545 -4.944 -5.843 1.00 . A A . 5 GLY C 1 1
20 3841 1 1 5 GLY CA C 11.464 -3.881 -5.861 1.00 . A A . 5 GLY CA 1 1
20 3842 1 1 5 GLY H H 10.238 -4.751 -7.352 1.00 . A A . 5 GLY H 1 1
20 3843 1 1 5 GLY HA2 H 11.819 -3.031 -6.424 1.00 . A A . 5 GLY HA2 1 1
20 3844 1 1 5 GLY HA3 H 11.266 -3.570 -4.846 1.00 . A A . 5 GLY HA3 1 1
20 3845 1 1 5 GLY N N 10.228 -4.356 -6.455 1.00 . A A . 5 GLY N 1 1
20 3846 1 1 5 GLY O O 13.095 -5.368 -6.856 1.00 . A A . 5 GLY O 1 1
20 3847 1 1 6 . C C 13.198 -7.885 -4.621 1.00 . A A . 6 IAS C 1 1
20 3848 1 1 6 . CA C 13.843 -6.514 -4.523 1.00 . A A . 6 IAS CA 1 1
20 3849 1 1 6 . CB C 14.730 -6.420 -3.268 1.00 . A A . 6 IAS CB 1 1
20 3850 1 1 6 . CG C 13.937 -6.288 -1.975 1.00 . A A . 6 IAS CG 1 1
20 3851 1 1 6 . H H 12.453 -5.085 -3.808 1.00 . A A . 6 IAS H 1 1
20 3852 1 1 6 . HA H 14.482 -6.473 -5.397 1.00 . A A . 6 IAS HA 1 1
20 3853 1 1 6 . HB2 H 15.327 -5.523 -3.346 1.00 . A A . 6 IAS HB2 1 1
20 3854 1 1 6 . HB3 H 15.379 -7.282 -3.234 1.00 . A A . 6 IAS HB3 1 1
20 3855 1 1 6 . HXT H 12.072 -8.868 -5.843 1.00 . A A . 6 IAS HXT 1 1
20 3856 1 1 6 . N N 12.892 -5.421 -4.636 1.00 . A A . 6 IAS N 1 1
20 3857 1 1 6 . O O 13.498 -8.831 -3.938 1.00 . A A . 6 IAS O 1 1
20 3858 1 1 6 . OD1 O 13.952 -5.252 -1.311 1.00 . A A . 6 IAS OD1 1 1
20 3859 1 1 6 . OXT O 12.341 -7.957 -5.650 1.00 . A A . 6 IAS OXT 1 1
20 3860 1 1 7 GLY C C 10.979 -7.616 -0.669 1.00 . A A . 7 GLY C 1 1
20 3861 1 1 7 GLY CA C 12.450 -7.367 -0.402 1.00 . A A . 7 GLY CA 1 1
20 3862 1 1 7 GLY H H 13.266 -8.162 -2.187 1.00 . A A . 7 GLY H 1 1
20 3863 1 1 7 GLY HA2 H 12.822 -8.139 0.254 1.00 . A A . 7 GLY HA2 1 1
20 3864 1 1 7 GLY HA3 H 12.558 -6.410 0.086 1.00 . A A . 7 GLY HA3 1 1
20 3865 1 1 7 GLY N N 13.241 -7.364 -1.619 1.00 . A A . 7 GLY N 1 1
20 3866 1 1 7 GLY O O 10.267 -8.147 0.185 1.00 . A A . 7 GLY O 1 1
20 3867 1 1 8 CYS C C 8.725 -8.885 -2.148 1.00 . A A . 8 CYS C 1 1
20 3868 1 1 8 CYS CA C 9.124 -7.414 -2.232 1.00 . A A . 8 CYS CA 1 1
20 3869 1 1 8 CYS CB C 8.883 -6.889 -3.649 1.00 . A A . 8 CYS CB 1 1
20 3870 1 1 8 CYS H H 11.137 -6.815 -2.494 1.00 . A A . 8 CYS H 1 1
20 3871 1 1 8 CYS HA H 8.517 -6.850 -1.540 1.00 . A A . 8 CYS HA 1 1
20 3872 1 1 8 CYS HB2 H 9.218 -5.864 -3.706 1.00 . A A . 8 CYS HB2 1 1
20 3873 1 1 8 CYS HB3 H 9.450 -7.487 -4.347 1.00 . A A . 8 CYS HB3 1 1
20 3874 1 1 8 CYS N N 10.520 -7.232 -1.855 1.00 . A A . 8 CYS N 1 1
20 3875 1 1 8 CYS O O 9.282 -9.730 -2.848 1.00 . A A . 8 CYS O 1 1
20 3876 1 1 8 CYS SG S 7.138 -6.930 -4.170 1.00 . A A . 8 CYS SG 1 1
20 3877 1 1 9 ALA C C 6.347 -10.953 -2.246 1.00 . A A . 9 ALA C 1 1
20 3878 1 1 9 ALA CA C 7.283 -10.549 -1.113 1.00 . A A . 9 ALA CA 1 1
20 3879 1 1 9 ALA CB C 6.584 -10.698 0.230 1.00 . A A . 9 ALA CB 1 1
20 3880 1 1 9 ALA H H 7.353 -8.464 -0.757 1.00 . A A . 9 ALA H 1 1
20 3881 1 1 9 ALA HA H 8.142 -11.204 -1.118 1.00 . A A . 9 ALA HA 1 1
20 3882 1 1 9 ALA HB1 H 5.997 -9.813 0.430 1.00 . A A . 9 ALA HB1 1 1
20 3883 1 1 9 ALA HB2 H 5.936 -11.562 0.205 1.00 . A A . 9 ALA HB2 1 1
20 3884 1 1 9 ALA HB3 H 7.322 -10.823 1.008 1.00 . A A . 9 ALA HB3 1 1
20 3885 1 1 9 ALA N N 7.758 -9.182 -1.287 1.00 . A A . 9 ALA N 1 1
20 3886 1 1 9 ALA O O 6.125 -10.189 -3.186 1.00 . A A . 9 ALA O 1 1
20 3887 1 1 10 LYS C C 3.482 -12.844 -2.601 1.00 . A A . 10 LYS C 1 1
20 3888 1 1 10 LYS CA C 4.886 -12.668 -3.170 1.00 . A A . 10 LYS CA 1 1
20 3889 1 1 10 LYS CB C 5.395 -14.000 -3.724 1.00 . A A . 10 LYS CB 1 1
20 3890 1 1 10 LYS CD C 5.946 -13.608 -6.143 1.00 . A A . 10 LYS CD 1 1
20 3891 1 1 10 LYS CE C 5.700 -14.917 -6.879 1.00 . A A . 10 LYS CE 1 1
20 3892 1 1 10 LYS CG C 6.504 -13.849 -4.750 1.00 . A A . 10 LYS CG 1 1
20 3893 1 1 10 LYS H H 6.015 -12.724 -1.380 1.00 . A A . 10 LYS H 1 1
20 3894 1 1 10 LYS HA H 4.848 -11.946 -3.972 1.00 . A A . 10 LYS HA 1 1
20 3895 1 1 10 LYS HB2 H 5.769 -14.597 -2.905 1.00 . A A . 10 LYS HB2 1 1
20 3896 1 1 10 LYS HB3 H 4.571 -14.521 -4.189 1.00 . A A . 10 LYS HB3 1 1
20 3897 1 1 10 LYS HD2 H 5.011 -13.074 -6.059 1.00 . A A . 10 LYS HD2 1 1
20 3898 1 1 10 LYS HD3 H 6.652 -13.015 -6.707 1.00 . A A . 10 LYS HD3 1 1
20 3899 1 1 10 LYS HE2 H 6.603 -15.506 -6.850 1.00 . A A . 10 LYS HE2 1 1
20 3900 1 1 10 LYS HE3 H 4.905 -15.451 -6.379 1.00 . A A . 10 LYS HE3 1 1
20 3901 1 1 10 LYS HG2 H 7.126 -13.011 -4.474 1.00 . A A . 10 LYS HG2 1 1
20 3902 1 1 10 LYS HG3 H 7.097 -14.752 -4.761 1.00 . A A . 10 LYS HG3 1 1
20 3903 1 1 10 LYS HZ1 H 4.316 -14.948 -8.443 1.00 . A A . 10 LYS HZ1 1 1
20 3904 1 1 10 LYS HZ2 H 5.904 -15.272 -8.927 1.00 . A A . 10 LYS HZ2 1 1
20 3905 1 1 10 LYS HZ3 H 5.442 -13.689 -8.549 1.00 . A A . 10 LYS HZ3 1 1
20 3906 1 1 10 LYS N N 5.799 -12.161 -2.153 1.00 . A A . 10 LYS N 1 1
20 3907 1 1 10 LYS NZ N 5.314 -14.690 -8.299 1.00 . A A . 10 LYS NZ 1 1
20 3908 1 1 10 LYS O O 3.245 -12.654 -1.408 1.00 . A A . 10 LYS O 1 1
20 3909 1 1 11 . C C 0.604 -12.163 -2.273 1.00 . A A . 11 DBB C 1 1
20 3910 1 1 11 . CA C 1.183 -13.395 -2.990 1.00 . A A . 11 DBB CA 1 1
20 3911 1 1 11 . CB C 0.312 -13.816 -4.192 1.00 . A A . 11 DBB CB 1 1
20 3912 1 1 11 . CG C -1.066 -14.230 -3.703 1.00 . A A . 11 DBB CG 1 1
20 3913 1 1 11 . H H 2.773 -13.353 -4.405 1.00 . A A . 11 DBB H 1 1
20 3914 1 1 11 . HA H 1.187 -14.214 -2.298 1.00 . A A . 11 DBB HA 1 1
20 3915 1 1 11 . HB2 H 0.781 -14.689 -4.591 1.00 . A A . 11 DBB HB2 1 1
20 3916 1 1 11 . HG1 H -1.572 -14.759 -4.495 1.00 . A A . 11 DBB HG1 1 1
20 3917 1 1 11 . HG2 H -1.633 -13.351 -3.434 1.00 . A A . 11 DBB HG2 1 1
20 3918 1 1 11 . HG3 H -0.964 -14.875 -2.845 1.00 . A A . 11 DBB HG3 1 1
20 3919 1 1 11 . N N 2.548 -13.210 -3.457 1.00 . A A . 11 DBB N 1 1
20 3920 1 1 11 . O O 0.906 -11.045 -2.692 1.00 . A A . 11 DBB O 1 1
20 3921 1 1 12 CYS C C 0.110 -10.571 0.394 1.00 . A A . 12 CYS C 1 1
20 3922 1 1 12 CYS CA C -0.867 -11.235 -0.571 1.00 . A A . 12 CYS CA 1 1
20 3923 1 1 12 CYS CB C -2.106 -11.712 0.189 1.00 . A A . 12 CYS CB 1 1
20 3924 1 1 12 CYS H H -0.438 -13.268 -0.974 1.00 . A A . 12 CYS H 1 1
20 3925 1 1 12 CYS HA H -1.168 -10.512 -1.314 1.00 . A A . 12 CYS HA 1 1
20 3926 1 1 12 CYS HB2 H -1.810 -12.456 0.915 1.00 . A A . 12 CYS HB2 1 1
20 3927 1 1 12 CYS HB3 H -2.549 -10.873 0.704 1.00 . A A . 12 CYS HB3 1 1
20 3928 1 1 12 CYS N N -0.236 -12.353 -1.262 1.00 . A A . 12 CYS N 1 1
20 3929 1 1 12 CYS O O -0.138 -10.504 1.598 1.00 . A A . 12 CYS O 1 1
20 3930 1 1 12 CYS SG S -3.389 -12.454 -0.870 1.00 . A A . 12 CYS SG 1 1
20 3931 1 1 13 ALA C C 2.612 -8.063 0.081 1.00 . A A . 13 ALA C 1 1
20 3932 1 1 13 ALA CA C 2.236 -9.420 0.669 1.00 . A A . 13 ALA CA 1 1
20 3933 1 1 13 ALA CB C 3.469 -10.302 0.795 1.00 . A A . 13 ALA CB 1 1
20 3934 1 1 13 ALA H H 1.364 -10.165 -1.109 1.00 . A A . 13 ALA H 1 1
20 3935 1 1 13 ALA HA H 1.827 -9.271 1.658 1.00 . A A . 13 ALA HA 1 1
20 3936 1 1 13 ALA HB1 H 3.912 -10.443 -0.181 1.00 . A A . 13 ALA HB1 1 1
20 3937 1 1 13 ALA HB2 H 4.185 -9.829 1.451 1.00 . A A . 13 ALA HB2 1 1
20 3938 1 1 13 ALA HB3 H 3.186 -11.260 1.203 1.00 . A A . 13 ALA HB3 1 1
20 3939 1 1 13 ALA N N 1.223 -10.081 -0.143 1.00 . A A . 13 ALA N 1 1
20 3940 1 1 13 ALA O O 2.869 -7.123 0.831 1.00 . A A . 13 ALA O 1 1
20 3941 1 1 14 ALA C C 2.751 -7.053 -3.508 1.00 . A A . 14 ALA C 1 1
20 3942 1 1 14 ALA CA C 2.971 -6.770 -1.955 1.00 . A A . 14 ALA CA 1 1
20 3943 1 1 14 ALA CB C 4.371 -6.323 -1.747 1.00 . A A . 14 ALA CB 1 1
20 3944 1 1 14 ALA H H 2.418 -8.790 -1.751 1.00 . A A . 14 ALA H 1 1
20 3945 1 1 14 ALA HA H 2.254 -6.007 -1.715 1.00 . A A . 14 ALA HA 1 1
20 3946 1 1 14 ALA HB1 H 4.954 -7.123 -1.315 1.00 . A A . 14 ALA HB1 1 1
20 3947 1 1 14 ALA HB2 H 4.771 -6.077 -2.719 1.00 . A A . 14 ALA HB2 1 1
20 3948 1 1 14 ALA N N 2.638 -7.986 -1.236 1.00 . A A . 14 ALA N 1 1
20 3949 1 1 14 ALA O O 2.195 -6.224 -4.228 1.00 . A A . 14 ALA O 1 1
20 3950 1 1 15 SER C C 1.640 -8.720 -5.778 1.00 . A A . 15 SER C 1 1
20 3951 1 1 15 SER CA C 3.103 -8.581 -5.370 1.00 . A A . 15 SER CA 1 1
20 3952 1 1 15 SER CB C 3.846 -9.892 -5.636 1.00 . A A . 15 SER CB 1 1
20 3953 1 1 15 SER H H 3.651 -8.831 -3.340 1.00 . A A . 15 SER H 1 1
20 3954 1 1 15 SER HA H 3.555 -7.795 -5.957 1.00 . A A . 15 SER HA 1 1
20 3955 1 1 15 SER HB2 H 4.906 -9.735 -5.504 1.00 . A A . 15 SER HB2 1 1
20 3956 1 1 15 SER HB3 H 3.503 -10.644 -4.940 1.00 . A A . 15 SER HB3 1 1
20 3957 1 1 15 SER HG H 4.421 -10.728 -7.312 1.00 . A A . 15 SER HG 1 1
20 3958 1 1 15 SER N N 3.218 -8.211 -3.964 1.00 . A A . 15 SER N 1 1
20 3959 1 1 15 SER O O 1.153 -7.994 -6.644 1.00 . A A . 15 SER O 1 1
20 3960 1 1 15 SER OG O 3.613 -10.351 -6.957 1.00 . A A . 15 SER OG 1 1
20 3961 1 1 16 CYS C C -1.359 -9.025 -4.565 1.00 . A A . 16 CYS C 1 1
20 3962 1 1 16 CYS CA C -0.465 -9.897 -5.442 1.00 . A A . 16 CYS CA 1 1
20 3963 1 1 16 CYS CB C -0.810 -11.372 -5.233 1.00 . A A . 16 CYS CB 1 1
20 3964 1 1 16 CYS H H 1.387 -10.207 -4.464 1.00 . A A . 16 CYS H 1 1
20 3965 1 1 16 CYS HA H -0.635 -9.639 -6.476 1.00 . A A . 16 CYS HA 1 1
20 3966 1 1 16 CYS HB2 H -0.880 -11.571 -4.173 1.00 . A A . 16 CYS HB2 1 1
20 3967 1 1 16 CYS HB3 H -1.762 -11.581 -5.697 1.00 . A A . 16 CYS HB3 1 1
20 3968 1 1 16 CYS N N 0.943 -9.659 -5.146 1.00 . A A . 16 CYS N 1 1
20 3969 1 1 16 CYS O O -1.150 -8.922 -3.357 1.00 . A A . 16 CYS O 1 1
20 3970 1 1 16 CYS SG S 0.413 -12.528 -5.932 1.00 . A A . 16 CYS SG 1 1
20 3971 1 1 17 ALA C C -3.858 -8.253 -3.241 1.00 . A A . 17 ALA C 1 1
20 3972 1 1 17 ALA CA C -3.283 -7.539 -4.460 1.00 . A A . 17 ALA CA 1 1
20 3973 1 1 17 ALA CB C -4.403 -7.078 -5.380 1.00 . A A . 17 ALA CB 1 1
20 3974 1 1 17 ALA H H -2.471 -8.522 -6.149 1.00 . A A . 17 ALA H 1 1
20 3975 1 1 17 ALA HA H -2.739 -6.666 -4.129 1.00 . A A . 17 ALA HA 1 1
20 3976 1 1 17 ALA HB1 H -5.251 -6.768 -4.787 1.00 . A A . 17 ALA HB1 1 1
20 3977 1 1 17 ALA HB2 H -4.058 -6.247 -5.978 1.00 . A A . 17 ALA HB2 1 1
20 3978 1 1 17 ALA HB3 H -4.694 -7.891 -6.028 1.00 . A A . 17 ALA HB3 1 1
20 3979 1 1 17 ALA N N -2.356 -8.400 -5.183 1.00 . A A . 17 ALA N 1 1
20 3980 1 1 17 ALA O O -3.649 -7.804 -2.115 1.00 . A A . 17 ALA O 1 1
20 3981 1 1 18 ALA C C -6.283 -9.238 -1.727 1.00 . A A . 18 ALA C 1 1
20 3982 1 1 18 ALA CA C -5.178 -10.140 -2.437 1.00 . A A . 18 ALA CA 1 1
20 3983 1 1 18 ALA CB C -4.215 -10.610 -1.410 1.00 . A A . 18 ALA CB 1 1
20 3984 1 1 18 ALA H H -4.677 -9.622 -4.415 1.00 . A A . 18 ALA H 1 1
20 3985 1 1 18 ALA HA H -5.731 -10.945 -2.884 1.00 . A A . 18 ALA HA 1 1
20 3986 1 1 18 ALA HB1 H -3.276 -10.087 -1.517 1.00 . A A . 18 ALA HB1 1 1
20 3987 1 1 18 ALA HB2 H -4.644 -10.377 -0.447 1.00 . A A . 18 ALA HB2 1 1
20 3988 1 1 18 ALA N N -4.565 -9.341 -3.483 1.00 . A A . 18 ALA N 1 1
20 3989 1 1 18 ALA O O -6.733 -9.544 -0.623 1.00 . A A . 18 ALA O 1 1
20 3990 1 1 19 SER C C -9.024 -7.478 -2.433 1.00 . A A . 19 SER C 1 1
20 3991 1 1 19 SER CA C -7.644 -7.223 -1.834 1.00 . A A . 19 SER CA 1 1
20 3992 1 1 19 SER CB C -7.220 -5.776 -2.096 1.00 . A A . 19 SER CB 1 1
20 3993 1 1 19 SER H H -6.264 -7.957 -3.262 1.00 . A A . 19 SER H 1 1
20 3994 1 1 19 SER HA H -7.692 -7.387 -0.768 1.00 . A A . 19 SER HA 1 1
20 3995 1 1 19 SER HB2 H -6.572 -5.444 -1.300 1.00 . A A . 19 SER HB2 1 1
20 3996 1 1 19 SER HB3 H -6.692 -5.724 -3.037 1.00 . A A . 19 SER HB3 1 1
20 3997 1 1 19 SER HG H -8.054 -4.004 -2.140 1.00 . A A . 19 SER HG 1 1
20 3998 1 1 19 SER N N -6.659 -8.147 -2.385 1.00 . A A . 19 SER N 1 1
20 3999 1 1 19 SER O O -9.154 -8.162 -3.447 1.00 . A A . 19 SER O 1 1
20 4000 1 1 19 SER OG O -8.346 -4.918 -2.156 1.00 . A A . 19 SER OG 1 1
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