NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
613749 |
5l34   |
30152 | cing | 4-filtered-FRED | STAR | entry | full | 75 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5l34
# This FRED archive file contains, for PDB entry <5l34>:
#
# - 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_5l34
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 5l34
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 863.06
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 . 1 $_D_Trp3__Contryphan_Vc2 A . 1 1
stop_
save_
save__D_Trp3__Contryphan_Vc2
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name " D Trp3 Contryphan Vc2"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code CRXTPVCX
_Entity.Number_of_monomers 8
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 CYS . 1 1
2 ARG . 1 1
3 DTR $DTR 1 1
4 THR . 1 1
5 PRO . 1 1
6 VAL . 1 1
7 CYS . 1 1
8 NH2 $NH2 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
CYS 1 1 1 1
ARG 2 2 1 1
DTR 3 3 1 1
THR 4 4 1 1
PRO 5 5 1 1
VAL 6 6 1 1
CYS 7 7 1 1
NH2 8 8 1 1
stop_
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_DTR
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID DTR
_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
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 1 CYS QB . 1 CYSS QB 1 1
1 1 2 1 1 2 ARG H . 2 ARG H 1 1
2 1 1 1 1 1 CYS HB2 . 1 CYSS HB2 1 1
2 1 2 1 1 2 ARG H . 2 ARG H 1 1
3 1 1 1 1 1 CYS HB3 . 1 CYSS HB3 1 1
3 1 2 1 1 2 ARG H . 2 ARG H 1 1
4 1 1 1 1 2 ARG H . 2 ARG H 1 1
4 1 2 1 1 2 ARG HB2 . 2 ARG HB2 1 1
5 1 1 1 1 2 ARG H . 2 ARG H 1 1
5 1 2 1 1 2 ARG QB . 2 ARG QB 1 1
6 1 1 1 1 2 ARG H . 2 ARG H 1 1
6 1 2 1 1 2 ARG HB3 . 2 ARG HB3 1 1
7 1 1 1 1 2 ARG H . 2 ARG H 1 1
7 1 2 1 1 2 ARG HD2 . 2 ARG HD2 1 1
8 1 1 1 1 2 ARG H . 2 ARG H 1 1
8 1 2 1 1 2 ARG HE . 2 ARG HE 1 1
9 1 1 1 1 2 ARG H . 2 ARG H 1 1
9 1 2 1 1 2 ARG QG . 2 ARG QG 1 1
10 1 1 1 1 2 ARG H . 2 ARG H 1 1
10 1 2 1 1 3 DTR H . 3 DTRP H 1 1
11 1 1 1 1 2 ARG HA . 2 ARG HA 1 1
11 1 2 1 1 2 ARG HD2 . 2 ARG HD2 1 1
12 1 1 1 1 2 ARG HA . 2 ARG HA 1 1
12 1 2 1 1 2 ARG HD3 . 2 ARG HD3 1 1
13 1 1 1 1 2 ARG HA . 2 ARG HA 1 1
13 1 2 1 1 2 ARG HE . 2 ARG HE 1 1
14 1 1 1 1 2 ARG HA . 2 ARG HA 1 1
14 1 2 1 1 3 DTR H . 3 DTRP H 1 1
15 1 1 1 1 2 ARG HA . 2 ARG HA 1 1
15 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
16 1 1 1 1 2 ARG QB . 2 ARG QB 1 1
16 1 2 1 1 2 ARG HD2 . 2 ARG HD2 1 1
17 1 1 1 1 2 ARG QB . 2 ARG QB 1 1
17 1 2 1 1 2 ARG HD3 . 2 ARG HD3 1 1
18 1 1 1 1 2 ARG QB . 2 ARG QB 1 1
18 1 2 1 1 3 DTR H . 3 DTRP H 1 1
19 1 1 1 1 2 ARG QB . 2 ARG QB 1 1
19 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
20 1 1 1 1 2 ARG HB2 . 2 ARG HB2 1 1
20 1 2 1 1 2 ARG HD2 . 2 ARG HD2 1 1
21 1 1 1 1 2 ARG HB2 . 2 ARG HB2 1 1
21 1 2 1 1 2 ARG HD3 . 2 ARG HD3 1 1
22 1 1 1 1 2 ARG HB2 . 2 ARG HB2 1 1
22 1 2 1 1 2 ARG HE . 2 ARG HE 1 1
23 1 1 1 1 2 ARG HB2 . 2 ARG HB2 1 1
23 1 2 1 1 3 DTR H . 3 DTRP H 1 1
24 1 1 1 1 2 ARG HB2 . 2 ARG HB2 1 1
24 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
25 1 1 1 1 2 ARG HB3 . 2 ARG HB3 1 1
25 1 2 1 1 2 ARG HD2 . 2 ARG HD2 1 1
26 1 1 1 1 2 ARG HB3 . 2 ARG HB3 1 1
26 1 2 1 1 2 ARG HD3 . 2 ARG HD3 1 1
27 1 1 1 1 2 ARG HB3 . 2 ARG HB3 1 1
27 1 2 1 1 2 ARG HE . 2 ARG HE 1 1
28 1 1 1 1 2 ARG HB3 . 2 ARG HB3 1 1
28 1 2 1 1 3 DTR H . 3 DTRP H 1 1
29 1 1 1 1 2 ARG HB3 . 2 ARG HB3 1 1
29 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
30 1 1 1 1 2 ARG HD2 . 2 ARG HD2 1 1
30 1 2 1 1 3 DTR HE1 . 3 DTRP HE1 1 1
31 1 1 1 1 2 ARG HD2 . 2 ARG HD2 1 1
31 1 2 1 1 3 DTR HZ2 . 3 DTRP HZ2 1 1
32 1 1 1 1 2 ARG HD3 . 2 ARG HD3 1 1
32 1 2 1 1 3 DTR HE1 . 3 DTRP HE1 1 1
33 1 1 1 1 2 ARG HE . 2 ARG HE 1 1
33 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
34 1 1 1 1 2 ARG HE . 2 ARG HE 1 1
34 1 2 1 1 3 DTR HE1 . 3 DTRP HE1 1 1
35 1 1 1 1 2 ARG QG . 2 ARG QG 1 1
35 1 2 1 1 3 DTR H . 3 DTRP H 1 1
36 1 1 1 1 2 ARG QG . 2 ARG QG 1 1
36 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
37 1 1 1 1 2 ARG QG . 2 ARG QG 1 1
37 1 2 1 1 3 DTR HE1 . 3 DTRP HE1 1 1
38 1 1 1 1 3 DTR H . 3 DTRP H 1 1
38 1 2 1 1 3 DTR HB3 . 3 DTRP HB3 1 1
39 1 1 1 1 3 DTR H . 3 DTRP H 1 1
39 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
40 1 1 1 1 3 DTR H . 3 DTRP H 1 1
40 1 2 1 1 3 DTR HE3 . 3 DTRP HE3 1 1
41 1 1 1 1 3 DTR H . 3 DTRP H 1 1
41 1 2 1 1 4 THR H . 4 THR H 1 1
42 1 1 1 1 3 DTR H . 3 DTRP H 1 1
42 1 2 1 1 4 THR MG . 4 THR QG2 1 1
43 1 1 1 1 3 DTR HA . 3 DTRP HA 1 1
43 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
44 1 1 1 1 3 DTR HB2 . 3 DTRP HB2 1 1
44 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
45 1 1 1 1 3 DTR HB2 . 3 DTRP HB2 1 1
45 1 2 1 1 3 DTR HE3 . 3 DTRP HE3 1 1
46 1 1 1 1 3 DTR HB3 . 3 DTRP HB3 1 1
46 1 2 1 1 3 DTR HD1 . 3 DTRP HD1 1 1
47 1 1 1 1 3 DTR HE3 . 3 DTRP HE3 1 1
47 1 2 1 1 4 THR MG . 4 THR QG2 1 1
48 1 1 1 1 3 DTR HE3 . 3 DTRP HE3 1 1
48 1 2 1 1 5 PRO QD . 5 PRO QD 1 1
49 1 1 1 1 3 DTR HH2 . 3 DTRP HH2 1 1
49 1 2 1 1 5 PRO HA . 5 PRO HA 1 1
50 1 1 1 1 3 DTR HH2 . 3 DTRP HH2 1 1
50 1 2 1 1 5 PRO QB . 5 PRO QB 1 1
51 1 1 1 1 3 DTR HH2 . 3 DTRP HH2 1 1
51 1 2 1 1 5 PRO QD . 5 PRO QD 1 1
52 1 1 1 1 3 DTR HZ3 . 3 DTRP HZ3 1 1
52 1 2 1 1 4 THR HA . 4 THR HA 1 1
53 1 1 1 1 3 DTR HZ3 . 3 DTRP HZ3 1 1
53 1 2 1 1 5 PRO HA . 5 PRO HA 1 1
54 1 1 1 1 3 DTR HZ3 . 3 DTRP HZ3 1 1
54 1 2 1 1 5 PRO QB . 5 PRO QB 1 1
55 1 1 1 1 3 DTR HZ3 . 3 DTRP HZ3 1 1
55 1 2 1 1 5 PRO QD . 5 PRO QD 1 1
56 1 1 1 1 4 THR H . 4 THR H 1 1
56 1 2 1 1 4 THR MG . 4 THR QG2 1 1
57 1 1 1 1 4 THR H . 4 THR H 1 1
57 1 2 1 1 5 PRO QD . 5 PRO QD 1 1
58 1 1 1 1 4 THR HA . 4 THR HA 1 1
58 1 2 1 1 4 THR MG . 4 THR QG2 1 1
59 1 1 1 1 4 THR HA . 4 THR HA 1 1
59 1 2 1 1 5 PRO QD . 5 PRO QD 1 1
60 1 1 1 1 4 THR HB . 4 THR HB 1 1
60 1 2 1 1 5 PRO QD . 5 PRO QD 1 1
61 1 1 1 1 4 THR HB . 4 THR HB 1 1
61 1 2 1 1 6 VAL H . 6 VAL H 1 1
62 1 1 1 1 4 THR MG . 4 THR QG2 1 1
62 1 2 1 1 6 VAL H . 6 VAL H 1 1
63 1 1 1 1 4 THR MG . 4 THR QG2 1 1
63 1 2 1 1 7 CYS H . 7 CYSS H 1 1
64 1 1 1 1 5 PRO QB . 5 PRO QB 1 1
64 1 2 1 1 6 VAL H . 6 VAL H 1 1
65 1 1 1 1 5 PRO QD . 5 PRO QD 1 1
65 1 2 1 1 6 VAL H . 6 VAL H 1 1
66 1 1 1 1 6 VAL H . 6 VAL H 1 1
66 1 2 1 1 6 VAL HB . 6 VAL HB 1 1
67 1 1 1 1 6 VAL H . 6 VAL H 1 1
67 1 2 1 1 6 VAL MG1 . 6 VAL QG1 1 1
68 1 1 1 1 6 VAL H . 6 VAL H 1 1
68 1 2 1 1 7 CYS H . 7 CYSS H 1 1
69 1 1 1 1 6 VAL HA . 6 VAL HA 1 1
69 1 2 1 1 6 VAL MG2 . 6 VAL QG2 1 1
70 1 1 1 1 6 VAL HB . 6 VAL HB 1 1
70 1 2 1 1 7 CYS H . 7 CYSS H 1 1
71 1 1 1 1 6 VAL MG1 . 6 VAL QG1 1 1
71 1 2 1 1 7 CYS H . 7 CYSS H 1 1
72 1 1 1 1 6 VAL MG1 . 6 VAL QG1 1 1
72 1 2 1 1 7 CYS HA . 7 CYSS HA 1 1
73 1 1 1 1 7 CYS H . 7 CYSS H 1 1
73 1 2 1 1 7 CYS QB . 7 CYSS QB 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 . . . . . . . 3.35 1 1
2 1 . . . . . . . 3.85 1 1
3 1 . . . . . . . 3.85 1 1
4 1 . . . . . . . 3.98 1 1
5 1 . . . . . . . 3.48 1 1
6 1 . . . . . . . 3.98 1 1
7 1 . . . . . . . 5.5 1 1
8 1 . . . . . . . 5.5 1 1
9 1 . . . . . . . 4.47 1 1
10 1 . . . . . . . 4.82 1 1
11 1 . . . . . . . 5.21 1 1
12 1 . . . . . . . 5.02 1 1
13 1 . . . . . . . 5.31 1 1
14 1 . . . . . . . 2.72 1 1
15 1 . . . . . . . 4.88 1 1
16 1 . . . . . . . 3.55 1 1
17 1 . . . . . . . 3.48 1 1
18 1 . . . . . . . 3.92 1 1
19 1 . . . . . . . 4.65 1 1
20 1 . . . . . . . 4.12 1 1
21 1 . . . . . . . 4.03 1 1
22 1 . . . . . . . 4.54 1 1
23 1 . . . . . . . 4.64 1 1
24 1 . . . . . . . 5.42 1 1
25 1 . . . . . . . 4.12 1 1
26 1 . . . . . . . 4.03 1 1
27 1 . . . . . . . 4.54 1 1
28 1 . . . . . . . 4.64 1 1
29 1 . . . . . . . 5.42 1 1
30 1 . . . . . . . 4.73 1 1
31 1 . . . . . . . 4.98 1 1
32 1 . . . . . . . 5.06 1 1
33 1 . . . . . . . 4.69 1 1
34 1 . . . . . . . 5.13 1 1
35 1 . . . . . . . 4.27 1 1
36 1 . . . . . . . 4.39 1 1
37 1 . . . . . . . 5.27 1 1
38 1 . . . . . . . 3.83 1 1
39 1 . . . . . . . 3.95 1 1
40 1 . . . . . . . 4.88 1 1
41 1 . . . . . . . 3.81 1 1
42 1 . . . . . . . 5.5 1 1
43 1 . . . . . . . 4.56 1 1
44 1 . . . . . . . 3.83 1 1
45 1 . . . . . . . 3.82 1 1
46 1 . . . . . . . 3.31 1 1
47 1 . . . . . . . 5.34 1 1
48 1 . . . . . . . 4.99 1 1
49 1 . . . . . . . 4.64 1 1
50 1 . . . . . . . 4.35 1 1
51 1 . . . . . . . 5.3 1 1
52 1 . . . . . . . 4.9 1 1
53 1 . . . . . . . 5.41 1 1
54 1 . . . . . . . 5.18 1 1
55 1 . . . . . . . 4.19 1 1
56 1 . . . . . . . 4.1 1 1
57 1 . . . . . . . 5.35 1 1
58 1 . . . . . . . 3.3 1 1
59 1 . . . . . . . 3.23 1 1
60 1 . . . . . . . 3.8 1 1
61 1 . . . . . . . 4.57 1 1
62 1 . . . . . . . 4.4 1 1
63 1 . . . . . . . 5.03 1 1
64 1 . . . . . . . 3.89 1 1
65 1 . . . . . . . 4.07 1 1
66 1 . . . . . . . 3.48 1 1
67 1 . . . . . . . 3.23 1 1
68 1 . . . . . . . 4.17 1 1
69 1 . . . . . . . 2.72 1 1
70 1 . . . . . . . 4.25 1 1
71 1 . . . . . . . 4.02 1 1
72 1 . . . . . . . 4.27 1 1
73 1 . . . . . . . 3.31 1 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 PHI 1 1 1 CYS C 1 1 2 ARG N 1 1 2 ARG CA 1 1 2 ARG C -80.0 200.0 . 2 ARG . . 2 ARG . . 2 ARG . . 2 ARG . 1 1
2 PHI 1 1 5 PRO C 1 1 6 VAL N 1 1 6 VAL CA 1 1 6 VAL C -80.0 200.0 . 6 VAL . . 6 VAL . . 6 VAL . . 6 VAL . 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 CYS C C 2.210 -2.412 -2.126 1.00 . A A . 1 CYS C 1 1
1 2 1 1 1 CYS CA C 2.066 -1.449 -0.953 1.00 . A A . 1 CYS CA 1 1
1 3 1 1 1 CYS CB C 1.892 -0.020 -1.471 1.00 . A A . 1 CYS CB 1 1
1 4 1 1 1 CYS H1 H 3.277 -2.406 0.444 1.00 . A A . 1 CYS H1 1 1
1 5 1 1 1 CYS H2 H 3.300 -0.711 0.552 1.00 . A A . 1 CYS H2 1 1
1 6 1 1 1 CYS H3 H 4.133 -1.495 -0.703 1.00 . A A . 1 CYS H3 1 1
1 7 1 1 1 CYS HA H 1.202 -1.726 -0.367 1.00 . A A . 1 CYS HA 1 1
1 8 1 1 1 CYS HB2 H 1.539 -0.048 -2.491 1.00 . A A . 1 CYS HB2 1 1
1 9 1 1 1 CYS HB3 H 1.172 0.499 -0.856 1.00 . A A . 1 CYS HB3 1 1
1 10 1 1 1 CYS N N 3.286 -1.520 -0.101 1.00 . A A . 1 CYS N 1 1
1 11 1 1 1 CYS O O 3.227 -2.410 -2.822 1.00 . A A . 1 CYS O 1 1
1 12 1 1 1 CYS SG S 3.481 0.844 -1.405 1.00 . A A . 1 CYS SG 1 1
1 13 1 1 2 ARG C C 0.766 -3.549 -4.735 1.00 . A A . 2 ARG C 1 1
1 14 1 1 2 ARG CA C 1.214 -4.197 -3.431 1.00 . A A . 2 ARG CA 1 1
1 15 1 1 2 ARG CB C 0.301 -5.373 -3.103 1.00 . A A . 2 ARG CB 1 1
1 16 1 1 2 ARG CD C 1.762 -7.391 -2.822 1.00 . A A . 2 ARG CD 1 1
1 17 1 1 2 ARG CG C 0.833 -6.639 -3.777 1.00 . A A . 2 ARG CG 1 1
1 18 1 1 2 ARG CZ C 1.467 -8.741 -0.825 1.00 . A A . 2 ARG CZ 1 1
1 19 1 1 2 ARG H H 0.404 -3.192 -1.755 1.00 . A A . 2 ARG H 1 1
1 20 1 1 2 ARG HA H 2.219 -4.564 -3.552 1.00 . A A . 2 ARG HA 1 1
1 21 1 1 2 ARG HB2 H 0.268 -5.516 -2.032 1.00 . A A . 2 ARG HB2 1 1
1 22 1 1 2 ARG HB3 H -0.695 -5.167 -3.467 1.00 . A A . 2 ARG HB3 1 1
1 23 1 1 2 ARG HD2 H 2.487 -7.948 -3.398 1.00 . A A . 2 ARG HD2 1 1
1 24 1 1 2 ARG HD3 H 2.279 -6.682 -2.191 1.00 . A A . 2 ARG HD3 1 1
1 25 1 1 2 ARG HE H 0.118 -8.623 -2.299 1.00 . A A . 2 ARG HE 1 1
1 26 1 1 2 ARG HG2 H 0.003 -7.265 -4.040 1.00 . A A . 2 ARG HG2 1 1
1 27 1 1 2 ARG HG3 H 1.381 -6.382 -4.669 1.00 . A A . 2 ARG HG3 1 1
1 28 1 1 2 ARG HH11 H -0.131 -9.877 -0.422 1.00 . A A . 2 ARG HH11 1 1
1 29 1 1 2 ARG HH12 H 1.118 -9.890 0.778 1.00 . A A . 2 ARG HH12 1 1
1 30 1 1 2 ARG HH21 H 3.174 -7.703 -0.960 1.00 . A A . 2 ARG HH21 1 1
1 31 1 1 2 ARG HH22 H 2.989 -8.659 0.473 1.00 . A A . 2 ARG HH22 1 1
1 32 1 1 2 ARG N N 1.188 -3.233 -2.340 1.00 . A A . 2 ARG N 1 1
1 33 1 1 2 ARG NE N 0.996 -8.314 -1.992 1.00 . A A . 2 ARG NE 1 1
1 34 1 1 2 ARG NH1 N 0.763 -9.568 -0.100 1.00 . A A . 2 ARG NH1 1 1
1 35 1 1 2 ARG NH2 N 2.635 -8.336 -0.404 1.00 . A A . 2 ARG NH2 1 1
1 36 1 1 2 ARG O O 0.785 -2.326 -4.872 1.00 . A A . 2 ARG O 1 1
1 37 1 1 3 DTR C C 1.068 -3.166 -7.690 1.00 . A A . 3 DTR C 1 1
1 38 1 1 3 DTR CA C -0.075 -3.891 -6.984 1.00 . A A . 3 DTR CA 1 1
1 39 1 1 3 DTR CB C -0.542 -5.068 -7.844 1.00 . A A . 3 DTR CB 1 1
1 40 1 1 3 DTR CD1 C -0.672 -7.239 -6.557 1.00 . A A . 3 DTR CD1 1 1
1 41 1 1 3 DTR CD2 C 1.379 -6.853 -7.391 1.00 . A A . 3 DTR CD2 1 1
1 42 1 1 3 DTR CE2 C 1.449 -8.085 -6.701 1.00 . A A . 3 DTR CE2 1 1
1 43 1 1 3 DTR CE3 C 2.546 -6.376 -8.013 1.00 . A A . 3 DTR CE3 1 1
1 44 1 1 3 DTR CG C 0.022 -6.337 -7.287 1.00 . A A . 3 DTR CG 1 1
1 45 1 1 3 DTR CH2 C 3.784 -8.328 -7.252 1.00 . A A . 3 DTR CH2 1 1
1 46 1 1 3 DTR CZ2 C 2.636 -8.817 -6.630 1.00 . A A . 3 DTR CZ2 1 1
1 47 1 1 3 DTR CZ3 C 3.739 -7.113 -7.942 1.00 . A A . 3 DTR CZ3 1 1
1 48 1 1 3 DTR H H 0.377 -5.340 -5.518 1.00 . A A . 3 DTR H 1 1
1 49 1 1 3 DTR HA H -0.897 -3.213 -6.840 1.00 . A A . 3 DTR HA 1 1
1 50 1 1 3 DTR HB2 H -0.195 -4.935 -8.858 1.00 . A A . 3 DTR HB2 1 1
1 51 1 1 3 DTR HB3 H -1.621 -5.116 -7.834 1.00 . A A . 3 DTR HB3 1 1
1 52 1 1 3 DTR HD1 H -1.714 -7.162 -6.288 1.00 . A A . 3 DTR HD1 1 1
1 53 1 1 3 DTR HE1 H -0.082 -9.064 -5.681 1.00 . A A . 3 DTR HE1 1 1
1 54 1 1 3 DTR HE3 H 2.524 -5.439 -8.549 1.00 . A A . 3 DTR HE3 1 1
1 55 1 1 3 DTR HH2 H 4.707 -8.887 -7.202 1.00 . A A . 3 DTR HH2 1 1
1 56 1 1 3 DTR HZ2 H 2.669 -9.753 -6.096 1.00 . A A . 3 DTR HZ2 1 1
1 57 1 1 3 DTR HZ3 H 4.627 -6.741 -8.421 1.00 . A A . 3 DTR HZ3 1 1
1 58 1 1 3 DTR N N 0.368 -4.379 -5.688 1.00 . A A . 3 DTR N 1 1
1 59 1 1 3 DTR NE1 N 0.174 -8.279 -6.210 1.00 . A A . 3 DTR NE1 1 1
1 60 1 1 3 DTR O O 0.912 -2.666 -8.804 1.00 . A A . 3 DTR O 1 1
1 61 1 1 4 THR C C 4.663 -3.028 -6.896 1.00 . A A . 4 THR C 1 1
1 62 1 1 4 THR CA C 3.404 -2.479 -7.586 1.00 . A A . 4 THR CA 1 1
1 63 1 1 4 THR CB C 3.326 -0.965 -7.369 1.00 . A A . 4 THR CB 1 1
1 64 1 1 4 THR CG2 C 2.739 -0.665 -5.990 1.00 . A A . 4 THR CG2 1 1
1 65 1 1 4 THR H H 2.281 -3.553 -6.149 1.00 . A A . 4 THR H 1 1
1 66 1 1 4 THR HA H 3.438 -2.673 -8.643 1.00 . A A . 4 THR HA 1 1
1 67 1 1 4 THR HB H 2.697 -0.527 -8.128 1.00 . A A . 4 THR HB 1 1
1 68 1 1 4 THR HG1 H 4.579 0.514 -7.204 1.00 . A A . 4 THR HG1 1 1
1 69 1 1 4 THR HG21 H 1.673 -0.515 -6.078 1.00 . A A . 4 THR HG21 1 1
1 70 1 1 4 THR HG22 H 3.196 0.228 -5.591 1.00 . A A . 4 THR HG22 1 1
1 71 1 1 4 THR HG23 H 2.932 -1.496 -5.328 1.00 . A A . 4 THR HG23 1 1
1 72 1 1 4 THR N N 2.221 -3.127 -7.029 1.00 . A A . 4 THR N 1 1
1 73 1 1 4 THR O O 4.834 -2.832 -5.693 1.00 . A A . 4 THR O 1 1
1 74 1 1 4 THR OG1 O 4.631 -0.410 -7.460 1.00 . A A . 4 THR OG1 1 1
1 75 1 1 5 PRO C C 7.852 -3.221 -6.770 1.00 . A A . 5 PRO C 1 1
1 76 1 1 5 PRO CA C 6.773 -4.278 -6.978 1.00 . A A . 5 PRO CA 1 1
1 77 1 1 5 PRO CB C 7.229 -5.340 -7.976 1.00 . A A . 5 PRO CB 1 1
1 78 1 1 5 PRO CD C 5.480 -4.023 -9.042 1.00 . A A . 5 PRO CD 1 1
1 79 1 1 5 PRO CG C 6.723 -4.880 -9.304 1.00 . A A . 5 PRO CG 1 1
1 80 1 1 5 PRO HA H 6.530 -4.751 -6.040 1.00 . A A . 5 PRO HA 1 1
1 81 1 1 5 PRO HB2 H 8.308 -5.401 -7.984 1.00 . A A . 5 PRO HB2 1 1
1 82 1 1 5 PRO HB3 H 6.798 -6.299 -7.727 1.00 . A A . 5 PRO HB3 1 1
1 83 1 1 5 PRO HD2 H 5.518 -3.116 -9.628 1.00 . A A . 5 PRO HD2 1 1
1 84 1 1 5 PRO HD3 H 4.585 -4.581 -9.266 1.00 . A A . 5 PRO HD3 1 1
1 85 1 1 5 PRO HG2 H 7.482 -4.291 -9.802 1.00 . A A . 5 PRO HG2 1 1
1 86 1 1 5 PRO HG3 H 6.455 -5.730 -9.911 1.00 . A A . 5 PRO HG3 1 1
1 87 1 1 5 PRO N N 5.542 -3.713 -7.600 1.00 . A A . 5 PRO N 1 1
1 88 1 1 5 PRO O O 9.026 -3.544 -6.586 1.00 . A A . 5 PRO O 1 1
1 89 1 1 6 VAL C C 7.785 0.206 -5.692 1.00 . A A . 6 VAL C 1 1
1 90 1 1 6 VAL CA C 8.383 -0.856 -6.611 1.00 . A A . 6 VAL CA 1 1
1 91 1 1 6 VAL CB C 8.728 -0.228 -7.962 1.00 . A A . 6 VAL CB 1 1
1 92 1 1 6 VAL CG1 C 7.447 0.250 -8.648 1.00 . A A . 6 VAL CG1 1 1
1 93 1 1 6 VAL CG2 C 9.664 0.964 -7.745 1.00 . A A . 6 VAL CG2 1 1
1 94 1 1 6 VAL H H 6.497 -1.762 -6.948 1.00 . A A . 6 VAL H 1 1
1 95 1 1 6 VAL HA H 9.287 -1.238 -6.164 1.00 . A A . 6 VAL HA 1 1
1 96 1 1 6 VAL HB H 9.218 -0.962 -8.586 1.00 . A A . 6 VAL HB 1 1
1 97 1 1 6 VAL HG11 H 7.084 1.139 -8.153 1.00 . A A . 6 VAL HG11 1 1
1 98 1 1 6 VAL HG12 H 6.698 -0.525 -8.592 1.00 . A A . 6 VAL HG12 1 1
1 99 1 1 6 VAL HG13 H 7.655 0.475 -9.684 1.00 . A A . 6 VAL HG13 1 1
1 100 1 1 6 VAL HG21 H 10.225 0.820 -6.834 1.00 . A A . 6 VAL HG21 1 1
1 101 1 1 6 VAL HG22 H 9.081 1.870 -7.669 1.00 . A A . 6 VAL HG22 1 1
1 102 1 1 6 VAL HG23 H 10.345 1.044 -8.578 1.00 . A A . 6 VAL HG23 1 1
1 103 1 1 6 VAL N N 7.445 -1.956 -6.799 1.00 . A A . 6 VAL N 1 1
1 104 1 1 6 VAL O O 8.468 0.738 -4.817 1.00 . A A . 6 VAL O 1 1
1 105 1 1 7 CYS C C 6.734 2.703 -4.827 1.00 . A A . 7 CYS C 1 1
1 106 1 1 7 CYS CA C 5.824 1.506 -5.082 1.00 . A A . 7 CYS CA 1 1
1 107 1 1 7 CYS CB C 5.399 0.892 -3.747 1.00 . A A . 7 CYS CB 1 1
1 108 1 1 7 CYS H H 6.013 0.049 -6.610 1.00 . A A . 7 CYS H 1 1
1 109 1 1 7 CYS HA H 4.942 1.843 -5.606 1.00 . A A . 7 CYS HA 1 1
1 110 1 1 7 CYS HB2 H 5.364 -0.184 -3.840 1.00 . A A . 7 CYS HB2 1 1
1 111 1 1 7 CYS HB3 H 6.112 1.164 -2.982 1.00 . A A . 7 CYS HB3 1 1
1 112 1 1 7 CYS N N 6.506 0.507 -5.898 1.00 . A A . 7 CYS N 1 1
1 113 1 1 7 CYS O O 6.620 3.367 -3.797 1.00 . A A . 7 CYS O 1 1
1 114 1 1 7 CYS SG S 3.760 1.512 -3.292 1.00 . A A . 7 CYS SG 1 1
1 115 1 1 8 NH2 HN1 H 7.728 2.494 -6.533 1.00 . A A . 8 NH2 HN1 1 1
1 116 1 1 8 NH2 HN2 H 8.227 3.790 -5.557 1.00 . A A . 8 NH2 HN2 1 1
1 117 1 1 8 NH2 N N 7.638 3.022 -5.712 1.00 . A A . 8 NH2 N 1 1
2 118 1 1 1 CYS C C 1.897 -1.855 -2.460 1.00 . A A . 1 CYS C 1 1
2 119 1 1 1 CYS CA C 1.585 -0.749 -1.459 1.00 . A A . 1 CYS CA 1 1
2 120 1 1 1 CYS CB C 2.673 -0.694 -0.386 1.00 . A A . 1 CYS CB 1 1
2 121 1 1 1 CYS H1 H -0.367 -1.471 -1.503 1.00 . A A . 1 CYS H1 1 1
2 122 1 1 1 CYS H2 H -0.149 -0.125 -0.489 1.00 . A A . 1 CYS H2 1 1
2 123 1 1 1 CYS H3 H 0.405 -1.657 -0.004 1.00 . A A . 1 CYS H3 1 1
2 124 1 1 1 CYS HA H 1.542 0.199 -1.975 1.00 . A A . 1 CYS HA 1 1
2 125 1 1 1 CYS HB2 H 2.218 -0.544 0.581 1.00 . A A . 1 CYS HB2 1 1
2 126 1 1 1 CYS HB3 H 3.224 -1.624 -0.384 1.00 . A A . 1 CYS HB3 1 1
2 127 1 1 1 CYS N N 0.269 -1.021 -0.815 1.00 . A A . 1 CYS N 1 1
2 128 1 1 1 CYS O O 2.853 -1.758 -3.229 1.00 . A A . 1 CYS O 1 1
2 129 1 1 1 CYS SG S 3.803 0.676 -0.741 1.00 . A A . 1 CYS SG 1 1
2 130 1 1 2 ARG C C 0.740 -3.706 -4.734 1.00 . A A . 2 ARG C 1 1
2 131 1 1 2 ARG CA C 1.288 -4.028 -3.351 1.00 . A A . 2 ARG CA 1 1
2 132 1 1 2 ARG CB C 0.595 -5.270 -2.801 1.00 . A A . 2 ARG CB 1 1
2 133 1 1 2 ARG CD C 2.391 -6.924 -2.225 1.00 . A A . 2 ARG CD 1 1
2 134 1 1 2 ARG CG C 1.342 -6.522 -3.265 1.00 . A A . 2 ARG CG 1 1
2 135 1 1 2 ARG CZ C 2.385 -8.002 -0.049 1.00 . A A . 2 ARG CZ 1 1
2 136 1 1 2 ARG H H 0.343 -2.935 -1.807 1.00 . A A . 2 ARG H 1 1
2 137 1 1 2 ARG HA H 2.341 -4.230 -3.434 1.00 . A A . 2 ARG HA 1 1
2 138 1 1 2 ARG HB2 H 0.588 -5.231 -1.721 1.00 . A A . 2 ARG HB2 1 1
2 139 1 1 2 ARG HB3 H -0.420 -5.305 -3.166 1.00 . A A . 2 ARG HB3 1 1
2 140 1 1 2 ARG HD2 H 3.202 -7.438 -2.720 1.00 . A A . 2 ARG HD2 1 1
2 141 1 1 2 ARG HD3 H 2.775 -6.037 -1.742 1.00 . A A . 2 ARG HD3 1 1
2 142 1 1 2 ARG HE H 0.956 -8.264 -1.426 1.00 . A A . 2 ARG HE 1 1
2 143 1 1 2 ARG HG2 H 0.636 -7.318 -3.391 1.00 . A A . 2 ARG HG2 1 1
2 144 1 1 2 ARG HG3 H 1.836 -6.331 -4.206 1.00 . A A . 2 ARG HG3 1 1
2 145 1 1 2 ARG HH11 H 0.975 -9.259 0.615 1.00 . A A . 2 ARG HH11 1 1
2 146 1 1 2 ARG HH12 H 2.276 -8.944 1.715 1.00 . A A . 2 ARG HH12 1 1
2 147 1 1 2 ARG HH21 H 3.928 -6.789 -0.443 1.00 . A A . 2 ARG HH21 1 1
2 148 1 1 2 ARG HH22 H 3.948 -7.546 1.115 1.00 . A A . 2 ARG HH22 1 1
2 149 1 1 2 ARG N N 1.088 -2.908 -2.443 1.00 . A A . 2 ARG N 1 1
2 150 1 1 2 ARG NE N 1.799 -7.807 -1.227 1.00 . A A . 2 ARG NE 1 1
2 151 1 1 2 ARG NH1 N 1.836 -8.797 0.828 1.00 . A A . 2 ARG NH1 1 1
2 152 1 1 2 ARG NH2 N 3.507 -7.399 0.230 1.00 . A A . 2 ARG NH2 1 1
2 153 1 1 2 ARG O O 0.558 -2.542 -5.088 1.00 . A A . 2 ARG O 1 1
2 154 1 1 3 DTR C C 0.978 -3.817 -7.718 1.00 . A A . 3 DTR C 1 1
2 155 1 1 3 DTR CA C -0.035 -4.575 -6.862 1.00 . A A . 3 DTR CA 1 1
2 156 1 1 3 DTR CB C -0.313 -5.943 -7.487 1.00 . A A . 3 DTR CB 1 1
2 157 1 1 3 DTR CD1 C -0.082 -7.846 -5.840 1.00 . A A . 3 DTR CD1 1 1
2 158 1 1 3 DTR CD2 C 1.872 -7.302 -6.809 1.00 . A A . 3 DTR CD2 1 1
2 159 1 1 3 DTR CE2 C 2.144 -8.367 -5.920 1.00 . A A . 3 DTR CE2 1 1
2 160 1 1 3 DTR CE3 C 2.940 -6.768 -7.549 1.00 . A A . 3 DTR CE3 1 1
2 161 1 1 3 DTR CG C 0.451 -6.990 -6.741 1.00 . A A . 3 DTR CG 1 1
2 162 1 1 3 DTR CH2 C 4.481 -8.340 -6.512 1.00 . A A . 3 DTR CH2 1 1
2 163 1 1 3 DTR CZ2 C 3.433 -8.884 -5.770 1.00 . A A . 3 DTR CZ2 1 1
2 164 1 1 3 DTR CZ3 C 4.236 -7.287 -7.399 1.00 . A A . 3 DTR CZ3 1 1
2 165 1 1 3 DTR H H 0.650 -5.648 -5.179 1.00 . A A . 3 DTR H 1 1
2 166 1 1 3 DTR HA H -0.954 -4.016 -6.815 1.00 . A A . 3 DTR HA 1 1
2 167 1 1 3 DTR HB2 H -0.001 -5.938 -8.521 1.00 . A A . 3 DTR HB2 1 1
2 168 1 1 3 DTR HB3 H -1.370 -6.157 -7.430 1.00 . A A . 3 DTR HB3 1 1
2 169 1 1 3 DTR HD1 H -1.120 -7.883 -5.548 1.00 . A A . 3 DTR HD1 1 1
2 170 1 1 3 DTR HE1 H 0.799 -9.375 -4.688 1.00 . A A . 3 DTR HE1 1 1
2 171 1 1 3 DTR HE3 H 2.764 -5.955 -8.237 1.00 . A A . 3 DTR HE3 1 1
2 172 1 1 3 DTR HH2 H 5.482 -8.733 -6.404 1.00 . A A . 3 DTR HH2 1 1
2 173 1 1 3 DTR HZ2 H 3.620 -9.695 -5.085 1.00 . A A . 3 DTR HZ2 1 1
2 174 1 1 3 DTR HZ3 H 5.048 -6.873 -7.969 1.00 . A A . 3 DTR HZ3 1 1
2 175 1 1 3 DTR N N 0.484 -4.747 -5.515 1.00 . A A . 3 DTR N 1 1
2 176 1 1 3 DTR NE1 N 0.921 -8.666 -5.353 1.00 . A A . 3 DTR NE1 1 1
2 177 1 1 3 DTR O O 0.741 -3.556 -8.898 1.00 . A A . 3 DTR O 1 1
2 178 1 1 4 THR C C 4.510 -2.985 -7.082 1.00 . A A . 4 THR C 1 1
2 179 1 1 4 THR CA C 3.173 -2.763 -7.807 1.00 . A A . 4 THR CA 1 1
2 180 1 1 4 THR CB C 2.859 -1.265 -7.845 1.00 . A A . 4 THR CB 1 1
2 181 1 1 4 THR CG2 C 2.253 -0.828 -6.510 1.00 . A A . 4 THR CG2 1 1
2 182 1 1 4 THR H H 2.239 -3.725 -6.170 1.00 . A A . 4 THR H 1 1
2 183 1 1 4 THR HA H 3.227 -3.127 -8.818 1.00 . A A . 4 THR HA 1 1
2 184 1 1 4 THR HB H 2.155 -1.066 -8.637 1.00 . A A . 4 THR HB 1 1
2 185 1 1 4 THR HG1 H 4.593 -1.047 -8.697 1.00 . A A . 4 THR HG1 1 1
2 186 1 1 4 THR HG21 H 2.566 -1.508 -5.733 1.00 . A A . 4 THR HG21 1 1
2 187 1 1 4 THR HG22 H 1.176 -0.834 -6.584 1.00 . A A . 4 THR HG22 1 1
2 188 1 1 4 THR HG23 H 2.591 0.170 -6.272 1.00 . A A . 4 THR HG23 1 1
2 189 1 1 4 THR N N 2.111 -3.480 -7.109 1.00 . A A . 4 THR N 1 1
2 190 1 1 4 THR O O 4.659 -2.562 -5.935 1.00 . A A . 4 THR O 1 1
2 191 1 1 4 THR OG1 O 4.058 -0.540 -8.082 1.00 . A A . 4 THR OG1 1 1
2 192 1 1 5 PRO C C 7.697 -2.662 -7.048 1.00 . A A . 5 PRO C 1 1
2 193 1 1 5 PRO CA C 6.791 -3.891 -7.029 1.00 . A A . 5 PRO CA 1 1
2 194 1 1 5 PRO CB C 7.396 -5.027 -7.850 1.00 . A A . 5 PRO CB 1 1
2 195 1 1 5 PRO CD C 5.453 -4.197 -9.058 1.00 . A A . 5 PRO CD 1 1
2 196 1 1 5 PRO CG C 6.812 -4.885 -9.217 1.00 . A A . 5 PRO CG 1 1
2 197 1 1 5 PRO HA H 6.637 -4.223 -6.016 1.00 . A A . 5 PRO HA 1 1
2 198 1 1 5 PRO HB2 H 8.472 -4.927 -7.886 1.00 . A A . 5 PRO HB2 1 1
2 199 1 1 5 PRO HB3 H 7.120 -5.983 -7.426 1.00 . A A . 5 PRO HB3 1 1
2 200 1 1 5 PRO HD2 H 5.342 -3.407 -9.790 1.00 . A A . 5 PRO HD2 1 1
2 201 1 1 5 PRO HD3 H 4.654 -4.914 -9.151 1.00 . A A . 5 PRO HD3 1 1
2 202 1 1 5 PRO HG2 H 7.465 -4.282 -9.834 1.00 . A A . 5 PRO HG2 1 1
2 203 1 1 5 PRO HG3 H 6.675 -5.858 -9.663 1.00 . A A . 5 PRO HG3 1 1
2 204 1 1 5 PRO N N 5.481 -3.636 -7.692 1.00 . A A . 5 PRO N 1 1
2 205 1 1 5 PRO O O 8.905 -2.767 -6.836 1.00 . A A . 5 PRO O 1 1
2 206 1 1 6 VAL C C 7.943 0.373 -5.958 1.00 . A A . 6 VAL C 1 1
2 207 1 1 6 VAL CA C 7.869 -0.258 -7.345 1.00 . A A . 6 VAL CA 1 1
2 208 1 1 6 VAL CB C 7.219 0.722 -8.324 1.00 . A A . 6 VAL CB 1 1
2 209 1 1 6 VAL CG1 C 6.122 1.513 -7.609 1.00 . A A . 6 VAL CG1 1 1
2 210 1 1 6 VAL CG2 C 8.280 1.689 -8.853 1.00 . A A . 6 VAL CG2 1 1
2 211 1 1 6 VAL H H 6.139 -1.478 -7.464 1.00 . A A . 6 VAL H 1 1
2 212 1 1 6 VAL HA H 8.871 -0.475 -7.685 1.00 . A A . 6 VAL HA 1 1
2 213 1 1 6 VAL HB H 6.787 0.173 -9.148 1.00 . A A . 6 VAL HB 1 1
2 214 1 1 6 VAL HG11 H 5.578 0.857 -6.946 1.00 . A A . 6 VAL HG11 1 1
2 215 1 1 6 VAL HG12 H 5.444 1.930 -8.339 1.00 . A A . 6 VAL HG12 1 1
2 216 1 1 6 VAL HG13 H 6.568 2.314 -7.037 1.00 . A A . 6 VAL HG13 1 1
2 217 1 1 6 VAL HG21 H 8.938 1.167 -9.532 1.00 . A A . 6 VAL HG21 1 1
2 218 1 1 6 VAL HG22 H 8.854 2.082 -8.027 1.00 . A A . 6 VAL HG22 1 1
2 219 1 1 6 VAL HG23 H 7.798 2.503 -9.376 1.00 . A A . 6 VAL HG23 1 1
2 220 1 1 6 VAL N N 7.105 -1.500 -7.303 1.00 . A A . 6 VAL N 1 1
2 221 1 1 6 VAL O O 8.877 1.115 -5.653 1.00 . A A . 6 VAL O 1 1
2 222 1 1 7 CYS C C 7.763 -0.229 -2.829 1.00 . A A . 7 CYS C 1 1
2 223 1 1 7 CYS CA C 6.916 0.619 -3.771 1.00 . A A . 7 CYS CA 1 1
2 224 1 1 7 CYS CB C 5.473 0.662 -3.264 1.00 . A A . 7 CYS CB 1 1
2 225 1 1 7 CYS H H 6.235 -0.522 -5.423 1.00 . A A . 7 CYS H 1 1
2 226 1 1 7 CYS HA H 7.309 1.624 -3.787 1.00 . A A . 7 CYS HA 1 1
2 227 1 1 7 CYS HB2 H 5.167 1.690 -3.137 1.00 . A A . 7 CYS HB2 1 1
2 228 1 1 7 CYS HB3 H 4.825 0.179 -3.981 1.00 . A A . 7 CYS HB3 1 1
2 229 1 1 7 CYS N N 6.953 0.075 -5.124 1.00 . A A . 7 CYS N 1 1
2 230 1 1 7 CYS O O 8.376 0.293 -1.897 1.00 . A A . 7 CYS O 1 1
2 231 1 1 7 CYS SG S 5.366 -0.200 -1.676 1.00 . A A . 7 CYS SG 1 1
2 232 1 1 8 NH2 HN1 H 7.348 -1.935 -3.758 1.00 . A A . 8 NH2 HN1 1 1
2 233 1 1 8 NH2 HN2 H 8.377 -2.072 -2.415 1.00 . A A . 8 NH2 HN2 1 1
2 234 1 1 8 NH2 N N 7.835 -1.519 -3.016 1.00 . A A . 8 NH2 N 1 1
3 235 1 1 1 CYS C C 2.075 -2.060 -2.275 1.00 . A A . 1 CYS C 1 1
3 236 1 1 1 CYS CA C 1.828 -1.034 -1.175 1.00 . A A . 1 CYS CA 1 1
3 237 1 1 1 CYS CB C 1.428 0.308 -1.793 1.00 . A A . 1 CYS CB 1 1
3 238 1 1 1 CYS H1 H 3.101 0.105 0.016 1.00 . A A . 1 CYS H1 1 1
3 239 1 1 1 CYS H2 H 3.901 -1.009 -0.985 1.00 . A A . 1 CYS H2 1 1
3 240 1 1 1 CYS H3 H 3.085 -1.546 0.405 1.00 . A A . 1 CYS H3 1 1
3 241 1 1 1 CYS HA H 1.034 -1.383 -0.531 1.00 . A A . 1 CYS HA 1 1
3 242 1 1 1 CYS HB2 H 1.100 0.152 -2.810 1.00 . A A . 1 CYS HB2 1 1
3 243 1 1 1 CYS HB3 H 0.624 0.743 -1.218 1.00 . A A . 1 CYS HB3 1 1
3 244 1 1 1 CYS N N 3.072 -0.857 -0.374 1.00 . A A . 1 CYS N 1 1
3 245 1 1 1 CYS O O 3.056 -1.969 -3.013 1.00 . A A . 1 CYS O 1 1
3 246 1 1 1 CYS SG S 2.852 1.425 -1.783 1.00 . A A . 1 CYS SG 1 1
3 247 1 1 2 ARG C C 0.825 -3.583 -4.741 1.00 . A A . 2 ARG C 1 1
3 248 1 1 2 ARG CA C 1.312 -4.078 -3.387 1.00 . A A . 2 ARG CA 1 1
3 249 1 1 2 ARG CB C 0.506 -5.303 -2.971 1.00 . A A . 2 ARG CB 1 1
3 250 1 1 2 ARG CD C 2.175 -7.128 -2.562 1.00 . A A . 2 ARG CD 1 1
3 251 1 1 2 ARG CG C 1.157 -6.560 -3.552 1.00 . A A . 2 ARG CG 1 1
3 252 1 1 2 ARG CZ C 2.056 -8.353 -0.468 1.00 . A A . 2 ARG CZ 1 1
3 253 1 1 2 ARG H H 0.421 -3.062 -1.760 1.00 . A A . 2 ARG H 1 1
3 254 1 1 2 ARG HA H 2.346 -4.361 -3.473 1.00 . A A . 2 ARG HA 1 1
3 255 1 1 2 ARG HB2 H 0.483 -5.371 -1.893 1.00 . A A . 2 ARG HB2 1 1
3 256 1 1 2 ARG HB3 H -0.501 -5.216 -3.348 1.00 . A A . 2 ARG HB3 1 1
3 257 1 1 2 ARG HD2 H 2.955 -7.637 -3.109 1.00 . A A . 2 ARG HD2 1 1
3 258 1 1 2 ARG HD3 H 2.612 -6.319 -1.992 1.00 . A A . 2 ARG HD3 1 1
3 259 1 1 2 ARG HE H 0.693 -8.503 -1.926 1.00 . A A . 2 ARG HE 1 1
3 260 1 1 2 ARG HG2 H 0.392 -7.287 -3.740 1.00 . A A . 2 ARG HG2 1 1
3 261 1 1 2 ARG HG3 H 1.659 -6.321 -4.477 1.00 . A A . 2 ARG HG3 1 1
3 262 1 1 2 ARG HH11 H 0.607 -9.637 0.040 1.00 . A A . 2 ARG HH11 1 1
3 263 1 1 2 ARG HH12 H 1.855 -9.414 1.218 1.00 . A A . 2 ARG HH12 1 1
3 264 1 1 2 ARG HH21 H 3.626 -7.134 -0.703 1.00 . A A . 2 ARG HH21 1 1
3 265 1 1 2 ARG HH22 H 3.565 -7.996 0.797 1.00 . A A . 2 ARG HH22 1 1
3 266 1 1 2 ARG N N 1.181 -3.038 -2.376 1.00 . A A . 2 ARG N 1 1
3 267 1 1 2 ARG NE N 1.530 -8.070 -1.655 1.00 . A A . 2 ARG NE 1 1
3 268 1 1 2 ARG NH1 N 1.460 -9.201 0.324 1.00 . A A . 2 ARG NH1 1 1
3 269 1 1 2 ARG NH2 N 3.169 -7.783 -0.096 1.00 . A A . 2 ARG NH2 1 1
3 270 1 1 2 ARG O O 0.811 -2.381 -5.009 1.00 . A A . 2 ARG O 1 1
3 271 1 1 3 DTR C C 1.040 -3.421 -7.687 1.00 . A A . 3 DTR C 1 1
3 272 1 1 3 DTR CA C -0.041 -4.180 -6.925 1.00 . A A . 3 DTR CA 1 1
3 273 1 1 3 DTR CB C -0.415 -5.452 -7.688 1.00 . A A . 3 DTR CB 1 1
3 274 1 1 3 DTR CD1 C -0.362 -7.509 -6.220 1.00 . A A . 3 DTR CD1 1 1
3 275 1 1 3 DTR CD2 C 1.631 -7.064 -7.157 1.00 . A A . 3 DTR CD2 1 1
3 276 1 1 3 DTR CE2 C 1.805 -8.227 -6.371 1.00 . A A . 3 DTR CE2 1 1
3 277 1 1 3 DTR CE3 C 2.741 -6.568 -7.858 1.00 . A A . 3 DTR CE3 1 1
3 278 1 1 3 DTR CG C 0.247 -6.629 -7.045 1.00 . A A . 3 DTR CG 1 1
3 279 1 1 3 DTR CH2 C 4.132 -8.365 -6.987 1.00 . A A . 3 DTR CH2 1 1
3 280 1 1 3 DTR CZ2 C 3.040 -8.872 -6.284 1.00 . A A . 3 DTR CZ2 1 1
3 281 1 1 3 DTR CZ3 C 3.983 -7.215 -7.772 1.00 . A A . 3 DTR CZ3 1 1
3 282 1 1 3 DTR H H 0.474 -5.457 -5.327 1.00 . A A . 3 DTR H 1 1
3 283 1 1 3 DTR HA H -0.916 -3.559 -6.832 1.00 . A A . 3 DTR HA 1 1
3 284 1 1 3 DTR HB2 H -0.083 -5.368 -8.713 1.00 . A A . 3 DTR HB2 1 1
3 285 1 1 3 DTR HB3 H -1.486 -5.585 -7.666 1.00 . A A . 3 DTR HB3 1 1
3 286 1 1 3 DTR HD1 H -1.398 -7.476 -5.922 1.00 . A A . 3 DTR HD1 1 1
3 287 1 1 3 DTR HE1 H 0.375 -9.212 -5.220 1.00 . A A . 3 DTR HE1 1 1
3 288 1 1 3 DTR HE3 H 2.638 -5.682 -8.466 1.00 . A A . 3 DTR HE3 1 1
3 289 1 1 3 DTR HH2 H 5.092 -8.857 -6.926 1.00 . A A . 3 DTR HH2 1 1
3 290 1 1 3 DTR HZ2 H 3.151 -9.757 -5.678 1.00 . A A . 3 DTR HZ2 1 1
3 291 1 1 3 DTR HZ3 H 4.828 -6.827 -8.313 1.00 . A A . 3 DTR HZ3 1 1
3 292 1 1 3 DTR N N 0.436 -4.520 -5.595 1.00 . A A . 3 DTR N 1 1
3 293 1 1 3 DTR NE1 N 0.561 -8.460 -5.821 1.00 . A A . 3 DTR NE1 1 1
3 294 1 1 3 DTR O O 0.824 -2.967 -8.810 1.00 . A A . 3 DTR O 1 1
3 295 1 1 4 THR C C 4.641 -3.015 -6.981 1.00 . A A . 4 THR C 1 1
3 296 1 1 4 THR CA C 3.332 -2.588 -7.664 1.00 . A A . 4 THR CA 1 1
3 297 1 1 4 THR CB C 3.147 -1.078 -7.491 1.00 . A A . 4 THR CB 1 1
3 298 1 1 4 THR CG2 C 2.753 -0.449 -8.827 1.00 . A A . 4 THR CG2 1 1
3 299 1 1 4 THR H H 2.312 -3.678 -6.165 1.00 . A A . 4 THR H 1 1
3 300 1 1 4 THR HA H 3.362 -2.816 -8.715 1.00 . A A . 4 THR HA 1 1
3 301 1 1 4 THR HB H 4.071 -0.639 -7.150 1.00 . A A . 4 THR HB 1 1
3 302 1 1 4 THR HG1 H 2.540 -0.490 -5.738 1.00 . A A . 4 THR HG1 1 1
3 303 1 1 4 THR HG21 H 3.527 -0.637 -9.556 1.00 . A A . 4 THR HG21 1 1
3 304 1 1 4 THR HG22 H 2.628 0.616 -8.700 1.00 . A A . 4 THR HG22 1 1
3 305 1 1 4 THR HG23 H 1.824 -0.880 -9.168 1.00 . A A . 4 THR HG23 1 1
3 306 1 1 4 THR N N 2.206 -3.291 -7.058 1.00 . A A . 4 THR N 1 1
3 307 1 1 4 THR O O 4.829 -2.736 -5.796 1.00 . A A . 4 THR O 1 1
3 308 1 1 4 THR OG1 O 2.127 -0.836 -6.532 1.00 . A A . 4 THR OG1 1 1
3 309 1 1 5 PRO C C 7.846 -2.986 -6.955 1.00 . A A . 5 PRO C 1 1
3 310 1 1 5 PRO CA C 6.831 -4.123 -7.052 1.00 . A A . 5 PRO CA 1 1
3 311 1 1 5 PRO CB C 7.326 -5.219 -7.993 1.00 . A A . 5 PRO CB 1 1
3 312 1 1 5 PRO CD C 5.470 -4.083 -9.088 1.00 . A A . 5 PRO CD 1 1
3 313 1 1 5 PRO CG C 6.756 -4.879 -9.332 1.00 . A A . 5 PRO CG 1 1
3 314 1 1 5 PRO HA H 6.649 -4.543 -6.078 1.00 . A A . 5 PRO HA 1 1
3 315 1 1 5 PRO HB2 H 8.407 -5.217 -8.032 1.00 . A A . 5 PRO HB2 1 1
3 316 1 1 5 PRO HB3 H 6.963 -6.183 -7.670 1.00 . A A . 5 PRO HB3 1 1
3 317 1 1 5 PRO HD2 H 5.441 -3.213 -9.730 1.00 . A A . 5 PRO HD2 1 1
3 318 1 1 5 PRO HD3 H 4.606 -4.704 -9.253 1.00 . A A . 5 PRO HD3 1 1
3 319 1 1 5 PRO HG2 H 7.464 -4.282 -9.891 1.00 . A A . 5 PRO HG2 1 1
3 320 1 1 5 PRO HG3 H 6.525 -5.783 -9.875 1.00 . A A . 5 PRO HG3 1 1
3 321 1 1 5 PRO N N 5.549 -3.680 -7.669 1.00 . A A . 5 PRO N 1 1
3 322 1 1 5 PRO O O 9.030 -3.219 -6.710 1.00 . A A . 5 PRO O 1 1
3 323 1 1 6 VAL C C 7.824 0.317 -5.923 1.00 . A A . 6 VAL C 1 1
3 324 1 1 6 VAL CA C 8.236 -0.586 -7.081 1.00 . A A . 6 VAL CA 1 1
3 325 1 1 6 VAL CB C 8.156 0.197 -8.393 1.00 . A A . 6 VAL CB 1 1
3 326 1 1 6 VAL CG1 C 6.690 0.404 -8.775 1.00 . A A . 6 VAL CG1 1 1
3 327 1 1 6 VAL CG2 C 8.833 1.557 -8.214 1.00 . A A . 6 VAL CG2 1 1
3 328 1 1 6 VAL H H 6.416 -1.639 -7.338 1.00 . A A . 6 VAL H 1 1
3 329 1 1 6 VAL HA H 9.255 -0.906 -6.929 1.00 . A A . 6 VAL HA 1 1
3 330 1 1 6 VAL HB H 8.657 -0.357 -9.173 1.00 . A A . 6 VAL HB 1 1
3 331 1 1 6 VAL HG11 H 6.341 -0.450 -9.337 1.00 . A A . 6 VAL HG11 1 1
3 332 1 1 6 VAL HG12 H 6.599 1.295 -9.380 1.00 . A A . 6 VAL HG12 1 1
3 333 1 1 6 VAL HG13 H 6.097 0.513 -7.880 1.00 . A A . 6 VAL HG13 1 1
3 334 1 1 6 VAL HG21 H 8.144 2.245 -7.745 1.00 . A A . 6 VAL HG21 1 1
3 335 1 1 6 VAL HG22 H 9.126 1.943 -9.179 1.00 . A A . 6 VAL HG22 1 1
3 336 1 1 6 VAL HG23 H 9.709 1.445 -7.591 1.00 . A A . 6 VAL HG23 1 1
3 337 1 1 6 VAL N N 7.370 -1.759 -7.148 1.00 . A A . 6 VAL N 1 1
3 338 1 1 6 VAL O O 8.604 1.156 -5.469 1.00 . A A . 6 VAL O 1 1
3 339 1 1 7 CYS C C 7.164 1.122 -3.274 1.00 . A A . 7 CYS C 1 1
3 340 1 1 7 CYS CA C 6.090 0.944 -4.342 1.00 . A A . 7 CYS CA 1 1
3 341 1 1 7 CYS CB C 4.862 0.272 -3.726 1.00 . A A . 7 CYS CB 1 1
3 342 1 1 7 CYS H H 6.020 -0.544 -5.849 1.00 . A A . 7 CYS H 1 1
3 343 1 1 7 CYS HA H 5.804 1.915 -4.716 1.00 . A A . 7 CYS HA 1 1
3 344 1 1 7 CYS HB2 H 4.591 -0.592 -4.315 1.00 . A A . 7 CYS HB2 1 1
3 345 1 1 7 CYS HB3 H 5.089 -0.037 -2.717 1.00 . A A . 7 CYS HB3 1 1
3 346 1 1 7 CYS N N 6.595 0.139 -5.448 1.00 . A A . 7 CYS N 1 1
3 347 1 1 7 CYS O O 7.100 2.053 -2.472 1.00 . A A . 7 CYS O 1 1
3 348 1 1 7 CYS SG S 3.482 1.442 -3.702 1.00 . A A . 7 CYS SG 1 1
3 349 1 1 8 NH2 HN1 H 8.207 -0.464 -3.856 1.00 . A A . 8 NH2 HN1 1 1
3 350 1 1 8 NH2 HN2 H 8.852 0.383 -2.533 1.00 . A A . 8 NH2 HN2 1 1
3 351 1 1 8 NH2 N N 8.157 0.276 -3.216 1.00 . A A . 8 NH2 N 1 1
4 352 1 1 1 CYS C C 1.929 -1.856 -2.454 1.00 . A A . 1 CYS C 1 1
4 353 1 1 1 CYS CA C 1.611 -0.750 -1.454 1.00 . A A . 1 CYS CA 1 1
4 354 1 1 1 CYS CB C 2.660 -0.735 -0.342 1.00 . A A . 1 CYS CB 1 1
4 355 1 1 1 CYS H1 H 0.082 -0.289 -0.118 1.00 . A A . 1 CYS H1 1 1
4 356 1 1 1 CYS H2 H 0.234 -1.947 -0.451 1.00 . A A . 1 CYS H2 1 1
4 357 1 1 1 CYS H3 H -0.460 -0.909 -1.601 1.00 . A A . 1 CYS H3 1 1
4 358 1 1 1 CYS HA H 1.612 0.203 -1.962 1.00 . A A . 1 CYS HA 1 1
4 359 1 1 1 CYS HB2 H 2.178 -0.543 0.605 1.00 . A A . 1 CYS HB2 1 1
4 360 1 1 1 CYS HB3 H 3.159 -1.692 -0.304 1.00 . A A . 1 CYS HB3 1 1
4 361 1 1 1 CYS N N 0.265 -0.992 -0.861 1.00 . A A . 1 CYS N 1 1
4 362 1 1 1 CYS O O 2.898 -1.764 -3.209 1.00 . A A . 1 CYS O 1 1
4 363 1 1 1 CYS SG S 3.875 0.566 -0.675 1.00 . A A . 1 CYS SG 1 1
4 364 1 1 2 ARG C C 0.789 -3.690 -4.753 1.00 . A A . 2 ARG C 1 1
4 365 1 1 2 ARG CA C 1.313 -4.020 -3.362 1.00 . A A . 2 ARG CA 1 1
4 366 1 1 2 ARG CB C 0.601 -5.256 -2.829 1.00 . A A . 2 ARG CB 1 1
4 367 1 1 2 ARG CD C 2.402 -6.906 -2.267 1.00 . A A . 2 ARG CD 1 1
4 368 1 1 2 ARG CG C 1.341 -6.511 -3.295 1.00 . A A . 2 ARG CG 1 1
4 369 1 1 2 ARG CZ C 2.378 -7.931 -0.065 1.00 . A A . 2 ARG CZ 1 1
4 370 1 1 2 ARG H H 0.354 -2.922 -1.830 1.00 . A A . 2 ARG H 1 1
4 371 1 1 2 ARG HA H 2.365 -4.233 -3.431 1.00 . A A . 2 ARG HA 1 1
4 372 1 1 2 ARG HB2 H 0.585 -5.225 -1.748 1.00 . A A . 2 ARG HB2 1 1
4 373 1 1 2 ARG HB3 H -0.411 -5.278 -3.203 1.00 . A A . 2 ARG HB3 1 1
4 374 1 1 2 ARG HD2 H 3.216 -7.406 -2.772 1.00 . A A . 2 ARG HD2 1 1
4 375 1 1 2 ARG HD3 H 2.779 -6.017 -1.780 1.00 . A A . 2 ARG HD3 1 1
4 376 1 1 2 ARG HE H 1.029 -8.323 -1.492 1.00 . A A . 2 ARG HE 1 1
4 377 1 1 2 ARG HG2 H 0.632 -7.307 -3.408 1.00 . A A . 2 ARG HG2 1 1
4 378 1 1 2 ARG HG3 H 1.822 -6.323 -4.242 1.00 . A A . 2 ARG HG3 1 1
4 379 1 1 2 ARG HH11 H 1.029 -9.265 0.575 1.00 . A A . 2 ARG HH11 1 1
4 380 1 1 2 ARG HH12 H 2.259 -8.836 1.717 1.00 . A A . 2 ARG HH12 1 1
4 381 1 1 2 ARG HH21 H 3.851 -6.625 -0.429 1.00 . A A . 2 ARG HH21 1 1
4 382 1 1 2 ARG HH22 H 3.857 -7.341 1.148 1.00 . A A . 2 ARG HH22 1 1
4 383 1 1 2 ARG N N 1.109 -2.901 -2.454 1.00 . A A . 2 ARG N 1 1
4 384 1 1 2 ARG NE N 1.831 -7.804 -1.270 1.00 . A A . 2 ARG NE 1 1
4 385 1 1 2 ARG NH1 N 1.847 -8.741 0.811 1.00 . A A . 2 ARG NH1 1 1
4 386 1 1 2 ARG NH2 N 3.445 -7.245 0.242 1.00 . A A . 2 ARG NH2 1 1
4 387 1 1 2 ARG O O 0.688 -2.523 -5.133 1.00 . A A . 2 ARG O 1 1
4 388 1 1 3 DTR C C 0.977 -3.772 -7.704 1.00 . A A . 3 DTR C 1 1
4 389 1 1 3 DTR CA C -0.034 -4.551 -6.866 1.00 . A A . 3 DTR CA 1 1
4 390 1 1 3 DTR CB C -0.297 -5.915 -7.507 1.00 . A A . 3 DTR CB 1 1
4 391 1 1 3 DTR CD1 C -0.071 -7.817 -5.859 1.00 . A A . 3 DTR CD1 1 1
4 392 1 1 3 DTR CD2 C 1.879 -7.288 -6.841 1.00 . A A . 3 DTR CD2 1 1
4 393 1 1 3 DTR CE2 C 2.150 -8.354 -5.953 1.00 . A A . 3 DTR CE2 1 1
4 394 1 1 3 DTR CE3 C 2.944 -6.762 -7.589 1.00 . A A . 3 DTR CE3 1 1
4 395 1 1 3 DTR CG C 0.462 -6.966 -6.763 1.00 . A A . 3 DTR CG 1 1
4 396 1 1 3 DTR CH2 C 4.483 -8.344 -6.564 1.00 . A A . 3 DTR CH2 1 1
4 397 1 1 3 DTR CZ2 C 3.436 -8.879 -5.813 1.00 . A A . 3 DTR CZ2 1 1
4 398 1 1 3 DTR CZ3 C 4.237 -7.289 -7.450 1.00 . A A . 3 DTR CZ3 1 1
4 399 1 1 3 DTR H H 0.575 -5.632 -5.157 1.00 . A A . 3 DTR H 1 1
4 400 1 1 3 DTR HA H -0.959 -4.002 -6.822 1.00 . A A . 3 DTR HA 1 1
4 401 1 1 3 DTR HB2 H 0.028 -5.897 -8.537 1.00 . A A . 3 DTR HB2 1 1
4 402 1 1 3 DTR HB3 H -1.354 -6.135 -7.467 1.00 . A A . 3 DTR HB3 1 1
4 403 1 1 3 DTR HD1 H -1.108 -7.847 -5.561 1.00 . A A . 3 DTR HD1 1 1
4 404 1 1 3 DTR HE1 H 0.807 -9.350 -4.710 1.00 . A A . 3 DTR HE1 1 1
4 405 1 1 3 DTR HE3 H 2.766 -5.948 -8.276 1.00 . A A . 3 DTR HE3 1 1
4 406 1 1 3 DTR HH2 H 5.481 -8.742 -6.462 1.00 . A A . 3 DTR HH2 1 1
4 407 1 1 3 DTR HZ2 H 3.622 -9.691 -5.128 1.00 . A A . 3 DTR HZ2 1 1
4 408 1 1 3 DTR HZ3 H 5.047 -6.878 -8.028 1.00 . A A . 3 DTR HZ3 1 1
4 409 1 1 3 DTR N N 0.467 -4.730 -5.513 1.00 . A A . 3 DTR N 1 1
4 410 1 1 3 DTR NE1 N 0.930 -8.643 -5.378 1.00 . A A . 3 DTR NE1 1 1
4 411 1 1 3 DTR O O 0.725 -3.453 -8.866 1.00 . A A . 3 DTR O 1 1
4 412 1 1 4 THR C C 4.524 -2.983 -7.061 1.00 . A A . 4 THR C 1 1
4 413 1 1 4 THR CA C 3.185 -2.735 -7.776 1.00 . A A . 4 THR CA 1 1
4 414 1 1 4 THR CB C 2.877 -1.232 -7.745 1.00 . A A . 4 THR CB 1 1
4 415 1 1 4 THR CG2 C 1.668 -0.918 -8.632 1.00 . A A . 4 THR CG2 1 1
4 416 1 1 4 THR H H 2.263 -3.760 -6.173 1.00 . A A . 4 THR H 1 1
4 417 1 1 4 THR HA H 3.240 -3.060 -8.800 1.00 . A A . 4 THR HA 1 1
4 418 1 1 4 THR HB H 3.734 -0.684 -8.106 1.00 . A A . 4 THR HB 1 1
4 419 1 1 4 THR HG1 H 2.300 0.074 -6.424 1.00 . A A . 4 THR HG1 1 1
4 420 1 1 4 THR HG21 H 0.763 -1.215 -8.126 1.00 . A A . 4 THR HG21 1 1
4 421 1 1 4 THR HG22 H 1.752 -1.455 -9.566 1.00 . A A . 4 THR HG22 1 1
4 422 1 1 4 THR HG23 H 1.636 0.143 -8.831 1.00 . A A . 4 THR HG23 1 1
4 423 1 1 4 THR N N 2.124 -3.474 -7.098 1.00 . A A . 4 THR N 1 1
4 424 1 1 4 THR O O 4.681 -2.578 -5.909 1.00 . A A . 4 THR O 1 1
4 425 1 1 4 THR OG1 O 2.597 -0.839 -6.409 1.00 . A A . 4 THR OG1 1 1
4 426 1 1 5 PRO C C 7.710 -2.682 -7.039 1.00 . A A . 5 PRO C 1 1
4 427 1 1 5 PRO CA C 6.798 -3.905 -7.033 1.00 . A A . 5 PRO CA 1 1
4 428 1 1 5 PRO CB C 7.392 -5.035 -7.870 1.00 . A A . 5 PRO CB 1 1
4 429 1 1 5 PRO CD C 5.450 -4.174 -9.058 1.00 . A A . 5 PRO CD 1 1
4 430 1 1 5 PRO CG C 6.800 -4.876 -9.231 1.00 . A A . 5 PRO CG 1 1
4 431 1 1 5 PRO HA H 6.646 -4.250 -6.022 1.00 . A A . 5 PRO HA 1 1
4 432 1 1 5 PRO HB2 H 8.468 -4.940 -7.912 1.00 . A A . 5 PRO HB2 1 1
4 433 1 1 5 PRO HB3 H 7.116 -5.993 -7.454 1.00 . A A . 5 PRO HB3 1 1
4 434 1 1 5 PRO HD2 H 5.347 -3.374 -9.780 1.00 . A A . 5 PRO HD2 1 1
4 435 1 1 5 PRO HD3 H 4.643 -4.879 -9.160 1.00 . A A . 5 PRO HD3 1 1
4 436 1 1 5 PRO HG2 H 7.455 -4.276 -9.848 1.00 . A A . 5 PRO HG2 1 1
4 437 1 1 5 PRO HG3 H 6.649 -5.843 -9.684 1.00 . A A . 5 PRO HG3 1 1
4 438 1 1 5 PRO N N 5.487 -3.633 -7.685 1.00 . A A . 5 PRO N 1 1
4 439 1 1 5 PRO O O 8.915 -2.792 -6.809 1.00 . A A . 5 PRO O 1 1
4 440 1 1 6 VAL C C 7.895 0.389 -5.964 1.00 . A A . 6 VAL C 1 1
4 441 1 1 6 VAL CA C 7.898 -0.279 -7.336 1.00 . A A . 6 VAL CA 1 1
4 442 1 1 6 VAL CB C 7.305 0.677 -8.373 1.00 . A A . 6 VAL CB 1 1
4 443 1 1 6 VAL CG1 C 5.904 1.106 -7.931 1.00 . A A . 6 VAL CG1 1 1
4 444 1 1 6 VAL CG2 C 8.200 1.913 -8.495 1.00 . A A . 6 VAL CG2 1 1
4 445 1 1 6 VAL H H 6.164 -1.490 -7.478 1.00 . A A . 6 VAL H 1 1
4 446 1 1 6 VAL HA H 8.916 -0.506 -7.614 1.00 . A A . 6 VAL HA 1 1
4 447 1 1 6 VAL HB H 7.243 0.178 -9.329 1.00 . A A . 6 VAL HB 1 1
4 448 1 1 6 VAL HG11 H 5.557 0.447 -7.148 1.00 . A A . 6 VAL HG11 1 1
4 449 1 1 6 VAL HG12 H 5.230 1.053 -8.772 1.00 . A A . 6 VAL HG12 1 1
4 450 1 1 6 VAL HG13 H 5.939 2.119 -7.559 1.00 . A A . 6 VAL HG13 1 1
4 451 1 1 6 VAL HG21 H 8.101 2.518 -7.606 1.00 . A A . 6 VAL HG21 1 1
4 452 1 1 6 VAL HG22 H 7.902 2.488 -9.359 1.00 . A A . 6 VAL HG22 1 1
4 453 1 1 6 VAL HG23 H 9.228 1.602 -8.605 1.00 . A A . 6 VAL HG23 1 1
4 454 1 1 6 VAL N N 7.128 -1.518 -7.303 1.00 . A A . 6 VAL N 1 1
4 455 1 1 6 VAL O O 8.756 1.216 -5.665 1.00 . A A . 6 VAL O 1 1
4 456 1 1 7 CYS C C 7.735 -0.144 -2.828 1.00 . A A . 7 CYS C 1 1
4 457 1 1 7 CYS CA C 6.818 0.594 -3.797 1.00 . A A . 7 CYS CA 1 1
4 458 1 1 7 CYS CB C 5.372 0.505 -3.304 1.00 . A A . 7 CYS CB 1 1
4 459 1 1 7 CYS H H 6.264 -0.641 -5.429 1.00 . A A . 7 CYS H 1 1
4 460 1 1 7 CYS HA H 7.110 1.632 -3.835 1.00 . A A . 7 CYS HA 1 1
4 461 1 1 7 CYS HB2 H 4.974 1.501 -3.175 1.00 . A A . 7 CYS HB2 1 1
4 462 1 1 7 CYS HB3 H 4.776 -0.031 -4.028 1.00 . A A . 7 CYS HB3 1 1
4 463 1 1 7 CYS N N 6.923 0.024 -5.136 1.00 . A A . 7 CYS N 1 1
4 464 1 1 7 CYS O O 8.195 -1.248 -3.120 1.00 . A A . 7 CYS O 1 1
4 465 1 1 7 CYS SG S 5.329 -0.371 -1.720 1.00 . A A . 7 CYS SG 1 1
4 466 1 1 8 NH2 HN1 H 7.664 1.283 -1.449 1.00 . A A . 8 NH2 HN1 1 1
4 467 1 1 8 NH2 HN2 H 8.619 -0.063 -1.052 1.00 . A A . 8 NH2 HN2 1 1
4 468 1 1 8 NH2 N N 8.030 0.404 -1.681 1.00 . A A . 8 NH2 N 1 1
5 469 1 1 1 CYS C C 2.090 -2.082 -2.253 1.00 . A A . 1 CYS C 1 1
5 470 1 1 1 CYS CA C 1.849 -1.064 -1.144 1.00 . A A . 1 CYS CA 1 1
5 471 1 1 1 CYS CB C 1.391 0.266 -1.747 1.00 . A A . 1 CYS CB 1 1
5 472 1 1 1 CYS H1 H 3.862 -0.547 -1.033 1.00 . A A . 1 CYS H1 1 1
5 473 1 1 1 CYS H2 H 3.390 -1.744 0.078 1.00 . A A . 1 CYS H2 1 1
5 474 1 1 1 CYS H3 H 2.962 -0.120 0.340 1.00 . A A . 1 CYS H3 1 1
5 475 1 1 1 CYS HA H 1.085 -1.437 -0.476 1.00 . A A . 1 CYS HA 1 1
5 476 1 1 1 CYS HB2 H 1.007 0.097 -2.742 1.00 . A A . 1 CYS HB2 1 1
5 477 1 1 1 CYS HB3 H 0.616 0.694 -1.128 1.00 . A A . 1 CYS HB3 1 1
5 478 1 1 1 CYS N N 3.111 -0.853 -0.382 1.00 . A A . 1 CYS N 1 1
5 479 1 1 1 CYS O O 3.072 -1.990 -2.989 1.00 . A A . 1 CYS O 1 1
5 480 1 1 1 CYS SG S 2.796 1.406 -1.829 1.00 . A A . 1 CYS SG 1 1
5 481 1 1 2 ARG C C 0.833 -3.570 -4.737 1.00 . A A . 2 ARG C 1 1
5 482 1 1 2 ARG CA C 1.313 -4.083 -3.386 1.00 . A A . 2 ARG CA 1 1
5 483 1 1 2 ARG CB C 0.499 -5.306 -2.984 1.00 . A A . 2 ARG CB 1 1
5 484 1 1 2 ARG CD C 2.156 -7.147 -2.596 1.00 . A A . 2 ARG CD 1 1
5 485 1 1 2 ARG CG C 1.140 -6.561 -3.578 1.00 . A A . 2 ARG CG 1 1
5 486 1 1 2 ARG CZ C 2.051 -8.429 -0.536 1.00 . A A . 2 ARG CZ 1 1
5 487 1 1 2 ARG H H 0.427 -3.077 -1.752 1.00 . A A . 2 ARG H 1 1
5 488 1 1 2 ARG HA H 2.346 -4.372 -3.474 1.00 . A A . 2 ARG HA 1 1
5 489 1 1 2 ARG HB2 H 0.475 -5.386 -1.907 1.00 . A A . 2 ARG HB2 1 1
5 490 1 1 2 ARG HB3 H -0.508 -5.208 -3.361 1.00 . A A . 2 ARG HB3 1 1
5 491 1 1 2 ARG HD2 H 2.933 -7.653 -3.151 1.00 . A A . 2 ARG HD2 1 1
5 492 1 1 2 ARG HD3 H 2.596 -6.347 -2.016 1.00 . A A . 2 ARG HD3 1 1
5 493 1 1 2 ARG HE H 0.650 -8.498 -1.965 1.00 . A A . 2 ARG HE 1 1
5 494 1 1 2 ARG HG2 H 0.370 -7.281 -3.774 1.00 . A A . 2 ARG HG2 1 1
5 495 1 1 2 ARG HG3 H 1.643 -6.317 -4.501 1.00 . A A . 2 ARG HG3 1 1
5 496 1 1 2 ARG HH11 H 0.577 -9.685 -0.029 1.00 . A A . 2 ARG HH11 1 1
5 497 1 1 2 ARG HH12 H 1.860 -9.532 1.124 1.00 . A A . 2 ARG HH12 1 1
5 498 1 1 2 ARG HH21 H 3.650 -7.250 -0.775 1.00 . A A . 2 ARG HH21 1 1
5 499 1 1 2 ARG HH22 H 3.600 -8.152 0.701 1.00 . A A . 2 ARG HH22 1 1
5 500 1 1 2 ARG N N 1.189 -3.052 -2.366 1.00 . A A . 2 ARG N 1 1
5 501 1 1 2 ARG NE N 1.505 -8.097 -1.701 1.00 . A A . 2 ARG NE 1 1
5 502 1 1 2 ARG NH1 N 1.449 -9.282 0.247 1.00 . A A . 2 ARG NH1 1 1
5 503 1 1 2 ARG NH2 N 3.189 -7.903 -0.176 1.00 . A A . 2 ARG NH2 1 1
5 504 1 1 2 ARG O O 0.830 -2.366 -4.993 1.00 . A A . 2 ARG O 1 1
5 505 1 1 3 DTR C C 1.051 -3.381 -7.680 1.00 . A A . 3 DTR C 1 1
5 506 1 1 3 DTR CA C -0.038 -4.138 -6.925 1.00 . A A . 3 DTR CA 1 1
5 507 1 1 3 DTR CB C -0.424 -5.399 -7.701 1.00 . A A . 3 DTR CB 1 1
5 508 1 1 3 DTR CD1 C -0.388 -7.472 -6.255 1.00 . A A . 3 DTR CD1 1 1
5 509 1 1 3 DTR CD2 C 1.608 -7.035 -7.192 1.00 . A A . 3 DTR CD2 1 1
5 510 1 1 3 DTR CE2 C 1.773 -8.208 -6.418 1.00 . A A . 3 DTR CE2 1 1
5 511 1 1 3 DTR CE3 C 2.720 -6.541 -7.889 1.00 . A A . 3 DTR CE3 1 1
5 512 1 1 3 DTR CG C 0.228 -6.588 -7.072 1.00 . A A . 3 DTR CG 1 1
5 513 1 1 3 DTR CH2 C 4.097 -8.359 -7.040 1.00 . A A . 3 DTR CH2 1 1
5 514 1 1 3 DTR CZ2 C 3.001 -8.865 -6.340 1.00 . A A . 3 DTR CZ2 1 1
5 515 1 1 3 DTR CZ3 C 3.956 -7.201 -7.812 1.00 . A A . 3 DTR CZ3 1 1
5 516 1 1 3 DTR H H 0.466 -5.434 -5.340 1.00 . A A . 3 DTR H 1 1
5 517 1 1 3 DTR HA H -0.906 -3.509 -6.827 1.00 . A A . 3 DTR HA 1 1
5 518 1 1 3 DTR HB2 H -0.094 -5.308 -8.726 1.00 . A A . 3 DTR HB2 1 1
5 519 1 1 3 DTR HB3 H -1.496 -5.522 -7.678 1.00 . A A . 3 DTR HB3 1 1
5 520 1 1 3 DTR HD1 H -1.423 -7.432 -5.954 1.00 . A A . 3 DTR HD1 1 1
5 521 1 1 3 DTR HE1 H 0.335 -9.191 -5.275 1.00 . A A . 3 DTR HE1 1 1
5 522 1 1 3 DTR HE3 H 2.623 -5.649 -8.488 1.00 . A A . 3 DTR HE3 1 1
5 523 1 1 3 DTR HH2 H 5.052 -8.860 -6.986 1.00 . A A . 3 DTR HH2 1 1
5 524 1 1 3 DTR HZ2 H 3.106 -9.757 -5.742 1.00 . A A . 3 DTR HZ2 1 1
5 525 1 1 3 DTR HZ3 H 4.803 -6.813 -8.351 1.00 . A A . 3 DTR HZ3 1 1
5 526 1 1 3 DTR N N 0.435 -4.496 -5.599 1.00 . A A . 3 DTR N 1 1
5 527 1 1 3 DTR NE1 N 0.527 -8.435 -5.867 1.00 . A A . 3 DTR NE1 1 1
5 528 1 1 3 DTR O O 0.839 -2.917 -8.801 1.00 . A A . 3 DTR O 1 1
5 529 1 1 4 THR C C 4.657 -3.013 -6.976 1.00 . A A . 4 THR C 1 1
5 530 1 1 4 THR CA C 3.349 -2.566 -7.650 1.00 . A A . 4 THR CA 1 1
5 531 1 1 4 THR CB C 3.180 -1.057 -7.458 1.00 . A A . 4 THR CB 1 1
5 532 1 1 4 THR CG2 C 2.781 -0.409 -8.784 1.00 . A A . 4 THR CG2 1 1
5 533 1 1 4 THR H H 2.320 -3.661 -6.160 1.00 . A A . 4 THR H 1 1
5 534 1 1 4 THR HA H 3.375 -2.781 -8.703 1.00 . A A . 4 THR HA 1 1
5 535 1 1 4 THR HB H 4.111 -0.631 -7.119 1.00 . A A . 4 THR HB 1 1
5 536 1 1 4 THR HG1 H 1.999 0.128 -6.465 1.00 . A A . 4 THR HG1 1 1
5 537 1 1 4 THR HG21 H 1.846 -0.828 -9.124 1.00 . A A . 4 THR HG21 1 1
5 538 1 1 4 THR HG22 H 3.548 -0.595 -9.521 1.00 . A A . 4 THR HG22 1 1
5 539 1 1 4 THR HG23 H 2.668 0.656 -8.644 1.00 . A A . 4 THR HG23 1 1
5 540 1 1 4 THR N N 2.217 -3.266 -7.051 1.00 . A A . 4 THR N 1 1
5 541 1 1 4 THR O O 4.850 -2.750 -5.789 1.00 . A A . 4 THR O 1 1
5 542 1 1 4 THR OG1 O 2.167 -0.816 -6.489 1.00 . A A . 4 THR OG1 1 1
5 543 1 1 5 PRO C C 7.863 -3.017 -6.963 1.00 . A A . 5 PRO C 1 1
5 544 1 1 5 PRO CA C 6.835 -4.142 -7.067 1.00 . A A . 5 PRO CA 1 1
5 545 1 1 5 PRO CB C 7.315 -5.233 -8.020 1.00 . A A . 5 PRO CB 1 1
5 546 1 1 5 PRO CD C 5.468 -4.067 -9.096 1.00 . A A . 5 PRO CD 1 1
5 547 1 1 5 PRO CG C 6.745 -4.875 -9.353 1.00 . A A . 5 PRO CG 1 1
5 548 1 1 5 PRO HA H 6.653 -4.570 -6.095 1.00 . A A . 5 PRO HA 1 1
5 549 1 1 5 PRO HB2 H 8.396 -5.241 -8.062 1.00 . A A . 5 PRO HB2 1 1
5 550 1 1 5 PRO HB3 H 6.944 -6.197 -7.703 1.00 . A A . 5 PRO HB3 1 1
5 551 1 1 5 PRO HD2 H 5.447 -3.190 -9.729 1.00 . A A . 5 PRO HD2 1 1
5 552 1 1 5 PRO HD3 H 4.597 -4.677 -9.265 1.00 . A A . 5 PRO HD3 1 1
5 553 1 1 5 PRO HG2 H 7.457 -4.281 -9.910 1.00 . A A . 5 PRO HG2 1 1
5 554 1 1 5 PRO HG3 H 6.500 -5.771 -9.903 1.00 . A A . 5 PRO HG3 1 1
5 555 1 1 5 PRO N N 5.555 -3.680 -7.674 1.00 . A A . 5 PRO N 1 1
5 556 1 1 5 PRO O O 9.050 -3.268 -6.758 1.00 . A A . 5 PRO O 1 1
5 557 1 1 6 VAL C C 7.783 0.352 -5.960 1.00 . A A . 6 VAL C 1 1
5 558 1 1 6 VAL CA C 8.273 -0.617 -7.030 1.00 . A A . 6 VAL CA 1 1
5 559 1 1 6 VAL CB C 8.317 0.094 -8.383 1.00 . A A . 6 VAL CB 1 1
5 560 1 1 6 VAL CG1 C 6.913 0.575 -8.754 1.00 . A A . 6 VAL CG1 1 1
5 561 1 1 6 VAL CG2 C 9.259 1.297 -8.295 1.00 . A A . 6 VAL CG2 1 1
5 562 1 1 6 VAL H H 6.437 -1.647 -7.270 1.00 . A A . 6 VAL H 1 1
5 563 1 1 6 VAL HA H 9.270 -0.944 -6.777 1.00 . A A . 6 VAL HA 1 1
5 564 1 1 6 VAL HB H 8.673 -0.592 -9.138 1.00 . A A . 6 VAL HB 1 1
5 565 1 1 6 VAL HG11 H 6.659 0.219 -9.741 1.00 . A A . 6 VAL HG11 1 1
5 566 1 1 6 VAL HG12 H 6.887 1.654 -8.742 1.00 . A A . 6 VAL HG12 1 1
5 567 1 1 6 VAL HG13 H 6.200 0.189 -8.040 1.00 . A A . 6 VAL HG13 1 1
5 568 1 1 6 VAL HG21 H 9.559 1.592 -9.290 1.00 . A A . 6 VAL HG21 1 1
5 569 1 1 6 VAL HG22 H 10.133 1.028 -7.720 1.00 . A A . 6 VAL HG22 1 1
5 570 1 1 6 VAL HG23 H 8.750 2.118 -7.813 1.00 . A A . 6 VAL HG23 1 1
5 571 1 1 6 VAL N N 7.393 -1.780 -7.108 1.00 . A A . 6 VAL N 1 1
5 572 1 1 6 VAL O O 8.481 1.302 -5.603 1.00 . A A . 6 VAL O 1 1
5 573 1 1 7 CYS C C 7.059 1.329 -3.381 1.00 . A A . 7 CYS C 1 1
5 574 1 1 7 CYS CA C 6.006 0.966 -4.423 1.00 . A A . 7 CYS CA 1 1
5 575 1 1 7 CYS CB C 4.837 0.254 -3.742 1.00 . A A . 7 CYS CB 1 1
5 576 1 1 7 CYS H H 6.070 -0.664 -5.776 1.00 . A A . 7 CYS H 1 1
5 577 1 1 7 CYS HA H 5.642 1.871 -4.885 1.00 . A A . 7 CYS HA 1 1
5 578 1 1 7 CYS HB2 H 4.614 -0.661 -4.272 1.00 . A A . 7 CYS HB2 1 1
5 579 1 1 7 CYS HB3 H 5.101 0.023 -2.721 1.00 . A A . 7 CYS HB3 1 1
5 580 1 1 7 CYS N N 6.580 0.107 -5.453 1.00 . A A . 7 CYS N 1 1
5 581 1 1 7 CYS O O 7.404 0.511 -2.529 1.00 . A A . 7 CYS O 1 1
5 582 1 1 7 CYS SG S 3.382 1.331 -3.761 1.00 . A A . 7 CYS SG 1 1
5 583 1 1 8 NH2 HN1 H 7.318 3.171 -4.076 1.00 . A A . 8 NH2 HN1 1 1
5 584 1 1 8 NH2 HN2 H 8.271 2.763 -2.733 1.00 . A A . 8 NH2 HN2 1 1
5 585 1 1 8 NH2 N N 7.593 2.520 -3.399 1.00 . A A . 8 NH2 N 1 1
6 586 1 1 1 CYS C C 1.935 -1.862 -2.456 1.00 . A A . 1 CYS C 1 1
6 587 1 1 1 CYS CA C 1.622 -0.759 -1.451 1.00 . A A . 1 CYS CA 1 1
6 588 1 1 1 CYS CB C 2.677 -0.748 -0.343 1.00 . A A . 1 CYS CB 1 1
6 589 1 1 1 CYS H1 H -0.345 -1.435 -1.563 1.00 . A A . 1 CYS H1 1 1
6 590 1 1 1 CYS H2 H -0.127 -0.098 -0.537 1.00 . A A . 1 CYS H2 1 1
6 591 1 1 1 CYS H3 H 0.372 -1.643 -0.040 1.00 . A A . 1 CYS H3 1 1
6 592 1 1 1 CYS HA H 1.622 0.196 -1.955 1.00 . A A . 1 CYS HA 1 1
6 593 1 1 1 CYS HB2 H 2.197 -0.569 0.608 1.00 . A A . 1 CYS HB2 1 1
6 594 1 1 1 CYS HB3 H 3.182 -1.702 -0.317 1.00 . A A . 1 CYS HB3 1 1
6 595 1 1 1 CYS N N 0.279 -1.002 -0.853 1.00 . A A . 1 CYS N 1 1
6 596 1 1 1 CYS O O 2.902 -1.769 -3.213 1.00 . A A . 1 CYS O 1 1
6 597 1 1 1 CYS SG S 3.881 0.564 -0.669 1.00 . A A . 1 CYS SG 1 1
6 598 1 1 2 ARG C C 0.784 -3.687 -4.757 1.00 . A A . 2 ARG C 1 1
6 599 1 1 2 ARG CA C 1.313 -4.022 -3.370 1.00 . A A . 2 ARG CA 1 1
6 600 1 1 2 ARG CB C 0.602 -5.259 -2.836 1.00 . A A . 2 ARG CB 1 1
6 601 1 1 2 ARG CD C 2.403 -6.913 -2.284 1.00 . A A . 2 ARG CD 1 1
6 602 1 1 2 ARG CG C 1.340 -6.513 -3.308 1.00 . A A . 2 ARG CG 1 1
6 603 1 1 2 ARG CZ C 2.392 -7.954 -0.090 1.00 . A A . 2 ARG CZ 1 1
6 604 1 1 2 ARG H H 0.362 -2.929 -1.830 1.00 . A A . 2 ARG H 1 1
6 605 1 1 2 ARG HA H 2.365 -4.236 -3.442 1.00 . A A . 2 ARG HA 1 1
6 606 1 1 2 ARG HB2 H 0.589 -5.231 -1.756 1.00 . A A . 2 ARG HB2 1 1
6 607 1 1 2 ARG HB3 H -0.411 -5.281 -3.207 1.00 . A A . 2 ARG HB3 1 1
6 608 1 1 2 ARG HD2 H 3.215 -7.412 -2.793 1.00 . A A . 2 ARG HD2 1 1
6 609 1 1 2 ARG HD3 H 2.781 -6.026 -1.796 1.00 . A A . 2 ARG HD3 1 1
6 610 1 1 2 ARG HE H 1.025 -8.323 -1.506 1.00 . A A . 2 ARG HE 1 1
6 611 1 1 2 ARG HG2 H 0.629 -7.309 -3.421 1.00 . A A . 2 ARG HG2 1 1
6 612 1 1 2 ARG HG3 H 1.817 -6.324 -4.257 1.00 . A A . 2 ARG HG3 1 1
6 613 1 1 2 ARG HH11 H 1.040 -9.282 0.554 1.00 . A A . 2 ARG HH11 1 1
6 614 1 1 2 ARG HH12 H 2.285 -8.873 1.685 1.00 . A A . 2 ARG HH12 1 1
6 615 1 1 2 ARG HH21 H 3.873 -6.659 -0.460 1.00 . A A . 2 ARG HH21 1 1
6 616 1 1 2 ARG HH22 H 3.889 -7.387 1.112 1.00 . A A . 2 ARG HH22 1 1
6 617 1 1 2 ARG N N 1.114 -2.906 -2.456 1.00 . A A . 2 ARG N 1 1
6 618 1 1 2 ARG NE N 1.833 -7.814 -1.288 1.00 . A A . 2 ARG NE 1 1
6 619 1 1 2 ARG NH1 N 1.865 -8.767 0.785 1.00 . A A . 2 ARG NH1 1 1
6 620 1 1 2 ARG NH2 N 3.469 -7.281 0.211 1.00 . A A . 2 ARG NH2 1 1
6 621 1 1 2 ARG O O 0.678 -2.518 -5.129 1.00 . A A . 2 ARG O 1 1
6 622 1 1 3 DTR C C 0.968 -3.752 -7.698 1.00 . A A . 3 DTR C 1 1
6 623 1 1 3 DTR CA C -0.041 -4.538 -6.869 1.00 . A A . 3 DTR CA 1 1
6 624 1 1 3 DTR CB C -0.300 -5.899 -7.522 1.00 . A A . 3 DTR CB 1 1
6 625 1 1 3 DTR CD1 C -0.080 -7.806 -5.877 1.00 . A A . 3 DTR CD1 1 1
6 626 1 1 3 DTR CD2 C 1.872 -7.280 -6.859 1.00 . A A . 3 DTR CD2 1 1
6 627 1 1 3 DTR CE2 C 2.141 -8.349 -5.973 1.00 . A A . 3 DTR CE2 1 1
6 628 1 1 3 DTR CE3 C 2.938 -6.757 -7.606 1.00 . A A . 3 DTR CE3 1 1
6 629 1 1 3 DTR CG C 0.456 -6.954 -6.780 1.00 . A A . 3 DTR CG 1 1
6 630 1 1 3 DTR CH2 C 4.473 -8.345 -6.585 1.00 . A A . 3 DTR CH2 1 1
6 631 1 1 3 DTR CZ2 C 3.426 -8.878 -5.834 1.00 . A A . 3 DTR CZ2 1 1
6 632 1 1 3 DTR CZ3 C 4.230 -7.287 -7.469 1.00 . A A . 3 DTR CZ3 1 1
6 633 1 1 3 DTR H H 0.576 -5.626 -5.172 1.00 . A A . 3 DTR H 1 1
6 634 1 1 3 DTR HA H -0.968 -3.992 -6.822 1.00 . A A . 3 DTR HA 1 1
6 635 1 1 3 DTR HB2 H 0.031 -5.875 -8.549 1.00 . A A . 3 DTR HB2 1 1
6 636 1 1 3 DTR HB3 H -1.355 -6.121 -7.488 1.00 . A A . 3 DTR HB3 1 1
6 637 1 1 3 DTR HD1 H -1.116 -7.833 -5.577 1.00 . A A . 3 DTR HD1 1 1
6 638 1 1 3 DTR HE1 H 0.795 -9.345 -4.731 1.00 . A A . 3 DTR HE1 1 1
6 639 1 1 3 DTR HE3 H 2.762 -5.941 -8.291 1.00 . A A . 3 DTR HE3 1 1
6 640 1 1 3 DTR HH2 H 5.471 -8.747 -6.485 1.00 . A A . 3 DTR HH2 1 1
6 641 1 1 3 DTR HZ2 H 3.609 -9.692 -5.151 1.00 . A A . 3 DTR HZ2 1 1
6 642 1 1 3 DTR HZ3 H 5.040 -6.878 -8.047 1.00 . A A . 3 DTR HZ3 1 1
6 643 1 1 3 DTR N N 0.464 -4.723 -5.520 1.00 . A A . 3 DTR N 1 1
6 644 1 1 3 DTR NE1 N 0.920 -8.636 -5.397 1.00 . A A . 3 DTR NE1 1 1
6 645 1 1 3 DTR O O 0.707 -3.399 -8.848 1.00 . A A . 3 DTR O 1 1
6 646 1 1 4 THR C C 4.525 -2.991 -7.049 1.00 . A A . 4 THR C 1 1
6 647 1 1 4 THR CA C 3.186 -2.737 -7.761 1.00 . A A . 4 THR CA 1 1
6 648 1 1 4 THR CB C 2.870 -1.241 -7.712 1.00 . A A . 4 THR CB 1 1
6 649 1 1 4 THR CG2 C 2.440 -0.757 -9.097 1.00 . A A . 4 THR CG2 1 1
6 650 1 1 4 THR H H 2.267 -3.796 -6.178 1.00 . A A . 4 THR H 1 1
6 651 1 1 4 THR HA H 3.240 -3.048 -8.790 1.00 . A A . 4 THR HA 1 1
6 652 1 1 4 THR HB H 3.749 -0.696 -7.402 1.00 . A A . 4 THR HB 1 1
6 653 1 1 4 THR HG1 H 1.935 -1.620 -6.048 1.00 . A A . 4 THR HG1 1 1
6 654 1 1 4 THR HG21 H 1.554 -1.290 -9.406 1.00 . A A . 4 THR HG21 1 1
6 655 1 1 4 THR HG22 H 3.235 -0.938 -9.805 1.00 . A A . 4 THR HG22 1 1
6 656 1 1 4 THR HG23 H 2.228 0.302 -9.058 1.00 . A A . 4 THR HG23 1 1
6 657 1 1 4 THR N N 2.124 -3.484 -7.095 1.00 . A A . 4 THR N 1 1
6 658 1 1 4 THR O O 4.683 -2.596 -5.894 1.00 . A A . 4 THR O 1 1
6 659 1 1 4 THR OG1 O 1.819 -1.012 -6.782 1.00 . A A . 4 THR OG1 1 1
6 660 1 1 5 PRO C C 7.716 -2.690 -7.035 1.00 . A A . 5 PRO C 1 1
6 661 1 1 5 PRO CA C 6.800 -3.912 -7.031 1.00 . A A . 5 PRO CA 1 1
6 662 1 1 5 PRO CB C 7.390 -5.039 -7.875 1.00 . A A . 5 PRO CB 1 1
6 663 1 1 5 PRO CD C 5.449 -4.165 -9.057 1.00 . A A . 5 PRO CD 1 1
6 664 1 1 5 PRO CG C 6.798 -4.869 -9.236 1.00 . A A . 5 PRO CG 1 1
6 665 1 1 5 PRO HA H 6.650 -4.262 -6.022 1.00 . A A . 5 PRO HA 1 1
6 666 1 1 5 PRO HB2 H 8.467 -4.947 -7.919 1.00 . A A . 5 PRO HB2 1 1
6 667 1 1 5 PRO HB3 H 7.110 -5.999 -7.466 1.00 . A A . 5 PRO HB3 1 1
6 668 1 1 5 PRO HD2 H 5.348 -3.359 -9.772 1.00 . A A . 5 PRO HD2 1 1
6 669 1 1 5 PRO HD3 H 4.640 -4.869 -9.164 1.00 . A A . 5 PRO HD3 1 1
6 670 1 1 5 PRO HG2 H 7.454 -4.266 -9.849 1.00 . A A . 5 PRO HG2 1 1
6 671 1 1 5 PRO HG3 H 6.645 -5.833 -9.695 1.00 . A A . 5 PRO HG3 1 1
6 672 1 1 5 PRO N N 5.487 -3.634 -7.680 1.00 . A A . 5 PRO N 1 1
6 673 1 1 5 PRO O O 8.919 -2.803 -6.800 1.00 . A A . 5 PRO O 1 1
6 674 1 1 6 VAL C C 7.902 0.381 -5.961 1.00 . A A . 6 VAL C 1 1
6 675 1 1 6 VAL CA C 7.909 -0.288 -7.331 1.00 . A A . 6 VAL CA 1 1
6 676 1 1 6 VAL CB C 7.326 0.669 -8.372 1.00 . A A . 6 VAL CB 1 1
6 677 1 1 6 VAL CG1 C 6.155 1.439 -7.758 1.00 . A A . 6 VAL CG1 1 1
6 678 1 1 6 VAL CG2 C 8.406 1.655 -8.819 1.00 . A A . 6 VAL CG2 1 1
6 679 1 1 6 VAL H H 6.173 -1.495 -7.479 1.00 . A A . 6 VAL H 1 1
6 680 1 1 6 VAL HA H 8.928 -0.518 -7.603 1.00 . A A . 6 VAL HA 1 1
6 681 1 1 6 VAL HB H 6.976 0.103 -9.225 1.00 . A A . 6 VAL HB 1 1
6 682 1 1 6 VAL HG11 H 5.525 1.824 -8.546 1.00 . A A . 6 VAL HG11 1 1
6 683 1 1 6 VAL HG12 H 6.535 2.259 -7.168 1.00 . A A . 6 VAL HG12 1 1
6 684 1 1 6 VAL HG13 H 5.581 0.778 -7.127 1.00 . A A . 6 VAL HG13 1 1
6 685 1 1 6 VAL HG21 H 7.985 2.355 -9.527 1.00 . A A . 6 VAL HG21 1 1
6 686 1 1 6 VAL HG22 H 9.217 1.115 -9.286 1.00 . A A . 6 VAL HG22 1 1
6 687 1 1 6 VAL HG23 H 8.780 2.194 -7.960 1.00 . A A . 6 VAL HG23 1 1
6 688 1 1 6 VAL N N 7.137 -1.524 -7.302 1.00 . A A . 6 VAL N 1 1
6 689 1 1 6 VAL O O 8.776 1.191 -5.650 1.00 . A A . 6 VAL O 1 1
6 690 1 1 7 CYS C C 7.739 -0.096 -2.842 1.00 . A A . 7 CYS C 1 1
6 691 1 1 7 CYS CA C 6.798 0.613 -3.811 1.00 . A A . 7 CYS CA 1 1
6 692 1 1 7 CYS CB C 5.359 0.489 -3.307 1.00 . A A . 7 CYS CB 1 1
6 693 1 1 7 CYS H H 6.242 -0.612 -5.448 1.00 . A A . 7 CYS H 1 1
6 694 1 1 7 CYS HA H 7.063 1.658 -3.854 1.00 . A A . 7 CYS HA 1 1
6 695 1 1 7 CYS HB2 H 4.930 1.475 -3.196 1.00 . A A . 7 CYS HB2 1 1
6 696 1 1 7 CYS HB3 H 4.776 -0.078 -4.019 1.00 . A A . 7 CYS HB3 1 1
6 697 1 1 7 CYS N N 6.909 0.038 -5.147 1.00 . A A . 7 CYS N 1 1
6 698 1 1 7 CYS O O 8.084 0.448 -1.793 1.00 . A A . 7 CYS O 1 1
6 699 1 1 7 CYS SG S 5.348 -0.357 -1.708 1.00 . A A . 7 CYS SG 1 1
6 700 1 1 8 NH2 HN1 H 7.905 -1.722 -3.969 1.00 . A A . 8 NH2 HN1 1 1
6 701 1 1 8 NH2 HN2 H 8.786 -1.753 -2.518 1.00 . A A . 8 NH2 HN2 1 1
6 702 1 1 8 NH2 N N 8.180 -1.289 -3.133 1.00 . A A . 8 NH2 N 1 1
7 703 1 1 1 CYS C C 1.931 -1.855 -2.456 1.00 . A A . 1 CYS C 1 1
7 704 1 1 1 CYS CA C 1.614 -0.753 -1.451 1.00 . A A . 1 CYS CA 1 1
7 705 1 1 1 CYS CB C 2.661 -0.745 -0.337 1.00 . A A . 1 CYS CB 1 1
7 706 1 1 1 CYS H1 H -0.223 -0.087 -0.732 1.00 . A A . 1 CYS H1 1 1
7 707 1 1 1 CYS H2 H 0.372 -1.467 0.060 1.00 . A A . 1 CYS H2 1 1
7 708 1 1 1 CYS H3 H -0.289 -1.598 -1.500 1.00 . A A . 1 CYS H3 1 1
7 709 1 1 1 CYS HA H 1.617 0.203 -1.954 1.00 . A A . 1 CYS HA 1 1
7 710 1 1 1 CYS HB2 H 2.179 -0.549 0.609 1.00 . A A . 1 CYS HB2 1 1
7 711 1 1 1 CYS HB3 H 3.153 -1.706 -0.298 1.00 . A A . 1 CYS HB3 1 1
7 712 1 1 1 CYS N N 0.266 -0.995 -0.861 1.00 . A A . 1 CYS N 1 1
7 713 1 1 1 CYS O O 2.897 -1.758 -3.213 1.00 . A A . 1 CYS O 1 1
7 714 1 1 1 CYS SG S 3.885 0.547 -0.669 1.00 . A A . 1 CYS SG 1 1
7 715 1 1 2 ARG C C 0.786 -3.685 -4.755 1.00 . A A . 2 ARG C 1 1
7 716 1 1 2 ARG CA C 1.317 -4.018 -3.367 1.00 . A A . 2 ARG CA 1 1
7 717 1 1 2 ARG CB C 0.610 -5.258 -2.833 1.00 . A A . 2 ARG CB 1 1
7 718 1 1 2 ARG CD C 2.412 -6.908 -2.279 1.00 . A A . 2 ARG CD 1 1
7 719 1 1 2 ARG CG C 1.350 -6.509 -3.305 1.00 . A A . 2 ARG CG 1 1
7 720 1 1 2 ARG CZ C 2.444 -8.015 -0.118 1.00 . A A . 2 ARG CZ 1 1
7 721 1 1 2 ARG H H 0.361 -2.928 -1.828 1.00 . A A . 2 ARG H 1 1
7 722 1 1 2 ARG HA H 2.369 -4.228 -3.441 1.00 . A A . 2 ARG HA 1 1
7 723 1 1 2 ARG HB2 H 0.597 -5.228 -1.753 1.00 . A A . 2 ARG HB2 1 1
7 724 1 1 2 ARG HB3 H -0.404 -5.281 -3.203 1.00 . A A . 2 ARG HB3 1 1
7 725 1 1 2 ARG HD2 H 3.226 -7.408 -2.788 1.00 . A A . 2 ARG HD2 1 1
7 726 1 1 2 ARG HD3 H 2.791 -6.022 -1.790 1.00 . A A . 2 ARG HD3 1 1
7 727 1 1 2 ARG HE H 0.998 -8.269 -1.479 1.00 . A A . 2 ARG HE 1 1
7 728 1 1 2 ARG HG2 H 0.642 -7.306 -3.420 1.00 . A A . 2 ARG HG2 1 1
7 729 1 1 2 ARG HG3 H 1.829 -6.319 -4.252 1.00 . A A . 2 ARG HG3 1 1
7 730 1 1 2 ARG HH11 H 1.053 -9.290 0.550 1.00 . A A . 2 ARG HH11 1 1
7 731 1 1 2 ARG HH12 H 2.368 -8.981 1.634 1.00 . A A . 2 ARG HH12 1 1
7 732 1 1 2 ARG HH21 H 3.975 -6.789 -0.519 1.00 . A A . 2 ARG HH21 1 1
7 733 1 1 2 ARG HH22 H 4.022 -7.564 1.029 1.00 . A A . 2 ARG HH22 1 1
7 734 1 1 2 ARG N N 1.113 -2.903 -2.455 1.00 . A A . 2 ARG N 1 1
7 735 1 1 2 ARG NE N 1.842 -7.809 -1.284 1.00 . A A . 2 ARG NE 1 1
7 736 1 1 2 ARG NH1 N 1.914 -8.826 0.757 1.00 . A A . 2 ARG NH1 1 1
7 737 1 1 2 ARG NH2 N 3.568 -7.409 0.152 1.00 . A A . 2 ARG NH2 1 1
7 738 1 1 2 ARG O O 0.674 -2.517 -5.127 1.00 . A A . 2 ARG O 1 1
7 739 1 1 3 DTR C C 0.972 -3.756 -7.700 1.00 . A A . 3 DTR C 1 1
7 740 1 1 3 DTR CA C -0.037 -4.541 -6.868 1.00 . A A . 3 DTR CA 1 1
7 741 1 1 3 DTR CB C -0.297 -5.902 -7.517 1.00 . A A . 3 DTR CB 1 1
7 742 1 1 3 DTR CD1 C -0.073 -7.809 -5.872 1.00 . A A . 3 DTR CD1 1 1
7 743 1 1 3 DTR CD2 C 1.877 -7.282 -6.856 1.00 . A A . 3 DTR CD2 1 1
7 744 1 1 3 DTR CE2 C 2.148 -8.350 -5.970 1.00 . A A . 3 DTR CE2 1 1
7 745 1 1 3 DTR CE3 C 2.943 -6.757 -7.605 1.00 . A A . 3 DTR CE3 1 1
7 746 1 1 3 DTR CG C 0.462 -6.957 -6.775 1.00 . A A . 3 DTR CG 1 1
7 747 1 1 3 DTR CH2 C 4.480 -8.344 -6.584 1.00 . A A . 3 DTR CH2 1 1
7 748 1 1 3 DTR CZ2 C 3.433 -8.878 -5.832 1.00 . A A . 3 DTR CZ2 1 1
7 749 1 1 3 DTR CZ3 C 4.235 -7.286 -7.468 1.00 . A A . 3 DTR CZ3 1 1
7 750 1 1 3 DTR H H 0.586 -5.626 -5.170 1.00 . A A . 3 DTR H 1 1
7 751 1 1 3 DTR HA H -0.963 -3.994 -6.820 1.00 . A A . 3 DTR HA 1 1
7 752 1 1 3 DTR HB2 H 0.032 -5.879 -8.545 1.00 . A A . 3 DTR HB2 1 1
7 753 1 1 3 DTR HB3 H -1.353 -6.124 -7.480 1.00 . A A . 3 DTR HB3 1 1
7 754 1 1 3 DTR HD1 H -1.109 -7.836 -5.572 1.00 . A A . 3 DTR HD1 1 1
7 755 1 1 3 DTR HE1 H 0.804 -9.346 -4.728 1.00 . A A . 3 DTR HE1 1 1
7 756 1 1 3 DTR HE3 H 2.765 -5.942 -8.289 1.00 . A A . 3 DTR HE3 1 1
7 757 1 1 3 DTR HH2 H 5.478 -8.745 -6.484 1.00 . A A . 3 DTR HH2 1 1
7 758 1 1 3 DTR HZ2 H 3.618 -9.692 -5.150 1.00 . A A . 3 DTR HZ2 1 1
7 759 1 1 3 DTR HZ3 H 5.045 -6.877 -8.046 1.00 . A A . 3 DTR HZ3 1 1
7 760 1 1 3 DTR N N 0.469 -4.724 -5.518 1.00 . A A . 3 DTR N 1 1
7 761 1 1 3 DTR NE1 N 0.927 -8.638 -5.394 1.00 . A A . 3 DTR NE1 1 1
7 762 1 1 3 DTR O O 0.712 -3.410 -8.851 1.00 . A A . 3 DTR O 1 1
7 763 1 1 4 THR C C 4.528 -2.990 -7.054 1.00 . A A . 4 THR C 1 1
7 764 1 1 4 THR CA C 3.188 -2.739 -7.765 1.00 . A A . 4 THR CA 1 1
7 765 1 1 4 THR CB C 2.870 -1.242 -7.720 1.00 . A A . 4 THR CB 1 1
7 766 1 1 4 THR CG2 C 2.438 -0.763 -9.106 1.00 . A A . 4 THR CG2 1 1
7 767 1 1 4 THR H H 2.269 -3.790 -6.177 1.00 . A A . 4 THR H 1 1
7 768 1 1 4 THR HA H 3.241 -3.052 -8.793 1.00 . A A . 4 THR HA 1 1
7 769 1 1 4 THR HB H 3.751 -0.696 -7.414 1.00 . A A . 4 THR HB 1 1
7 770 1 1 4 THR HG1 H 1.326 -0.244 -7.085 1.00 . A A . 4 THR HG1 1 1
7 771 1 1 4 THR HG21 H 3.233 -0.944 -9.814 1.00 . A A . 4 THR HG21 1 1
7 772 1 1 4 THR HG22 H 2.223 0.295 -9.070 1.00 . A A . 4 THR HG22 1 1
7 773 1 1 4 THR HG23 H 1.553 -1.300 -9.411 1.00 . A A . 4 THR HG23 1 1
7 774 1 1 4 THR N N 2.127 -3.483 -7.096 1.00 . A A . 4 THR N 1 1
7 775 1 1 4 THR O O 4.686 -2.593 -5.899 1.00 . A A . 4 THR O 1 1
7 776 1 1 4 THR OG1 O 1.823 -1.010 -6.789 1.00 . A A . 4 THR OG1 1 1
7 777 1 1 5 PRO C C 7.716 -2.686 -7.041 1.00 . A A . 5 PRO C 1 1
7 778 1 1 5 PRO CA C 6.803 -3.910 -7.036 1.00 . A A . 5 PRO CA 1 1
7 779 1 1 5 PRO CB C 7.393 -5.037 -7.880 1.00 . A A . 5 PRO CB 1 1
7 780 1 1 5 PRO CD C 5.451 -4.166 -9.061 1.00 . A A . 5 PRO CD 1 1
7 781 1 1 5 PRO CG C 6.801 -4.868 -9.241 1.00 . A A . 5 PRO CG 1 1
7 782 1 1 5 PRO HA H 6.654 -4.258 -6.027 1.00 . A A . 5 PRO HA 1 1
7 783 1 1 5 PRO HB2 H 8.470 -4.944 -7.924 1.00 . A A . 5 PRO HB2 1 1
7 784 1 1 5 PRO HB3 H 7.115 -5.997 -7.470 1.00 . A A . 5 PRO HB3 1 1
7 785 1 1 5 PRO HD2 H 5.348 -3.361 -9.777 1.00 . A A . 5 PRO HD2 1 1
7 786 1 1 5 PRO HD3 H 4.643 -4.870 -9.166 1.00 . A A . 5 PRO HD3 1 1
7 787 1 1 5 PRO HG2 H 7.456 -4.264 -9.854 1.00 . A A . 5 PRO HG2 1 1
7 788 1 1 5 PRO HG3 H 6.648 -5.832 -9.699 1.00 . A A . 5 PRO HG3 1 1
7 789 1 1 5 PRO N N 5.490 -3.634 -7.684 1.00 . A A . 5 PRO N 1 1
7 790 1 1 5 PRO O O 8.921 -2.797 -6.813 1.00 . A A . 5 PRO O 1 1
7 791 1 1 6 VAL C C 7.890 0.390 -5.966 1.00 . A A . 6 VAL C 1 1
7 792 1 1 6 VAL CA C 7.902 -0.283 -7.334 1.00 . A A . 6 VAL CA 1 1
7 793 1 1 6 VAL CB C 7.317 0.669 -8.378 1.00 . A A . 6 VAL CB 1 1
7 794 1 1 6 VAL CG1 C 6.144 1.439 -7.768 1.00 . A A . 6 VAL CG1 1 1
7 795 1 1 6 VAL CG2 C 8.396 1.658 -8.827 1.00 . A A . 6 VAL CG2 1 1
7 796 1 1 6 VAL H H 6.169 -1.493 -7.477 1.00 . A A . 6 VAL H 1 1
7 797 1 1 6 VAL HA H 8.922 -0.511 -7.603 1.00 . A A . 6 VAL HA 1 1
7 798 1 1 6 VAL HB H 6.970 0.100 -9.230 1.00 . A A . 6 VAL HB 1 1
7 799 1 1 6 VAL HG11 H 5.576 0.780 -7.129 1.00 . A A . 6 VAL HG11 1 1
7 800 1 1 6 VAL HG12 H 5.509 1.812 -8.558 1.00 . A A . 6 VAL HG12 1 1
7 801 1 1 6 VAL HG13 H 6.521 2.268 -7.187 1.00 . A A . 6 VAL HG13 1 1
7 802 1 1 6 VAL HG21 H 9.183 1.124 -9.339 1.00 . A A . 6 VAL HG21 1 1
7 803 1 1 6 VAL HG22 H 8.805 2.161 -7.963 1.00 . A A . 6 VAL HG22 1 1
7 804 1 1 6 VAL HG23 H 7.962 2.386 -9.495 1.00 . A A . 6 VAL HG23 1 1
7 805 1 1 6 VAL N N 7.133 -1.521 -7.303 1.00 . A A . 6 VAL N 1 1
7 806 1 1 6 VAL O O 8.745 1.223 -5.665 1.00 . A A . 6 VAL O 1 1
7 807 1 1 7 CYS C C 7.727 -0.124 -2.830 1.00 . A A . 7 CYS C 1 1
7 808 1 1 7 CYS CA C 6.802 0.598 -3.804 1.00 . A A . 7 CYS CA 1 1
7 809 1 1 7 CYS CB C 5.357 0.492 -3.312 1.00 . A A . 7 CYS CB 1 1
7 810 1 1 7 CYS H H 6.262 -0.646 -5.433 1.00 . A A . 7 CYS H 1 1
7 811 1 1 7 CYS HA H 7.081 1.639 -3.846 1.00 . A A . 7 CYS HA 1 1
7 812 1 1 7 CYS HB2 H 4.949 1.484 -3.177 1.00 . A A . 7 CYS HB2 1 1
7 813 1 1 7 CYS HB3 H 4.766 -0.044 -4.039 1.00 . A A . 7 CYS HB3 1 1
7 814 1 1 7 CYS N N 6.915 0.022 -5.140 1.00 . A A . 7 CYS N 1 1
7 815 1 1 7 CYS O O 8.164 -1.243 -3.095 1.00 . A A . 7 CYS O 1 1
7 816 1 1 7 CYS SG S 5.321 -0.394 -1.734 1.00 . A A . 7 CYS SG 1 1
7 817 1 1 8 NH2 HN1 H 7.707 1.348 -1.497 1.00 . A A . 8 NH2 HN1 1 1
7 818 1 1 8 NH2 HN2 H 8.649 0.000 -1.076 1.00 . A A . 8 NH2 HN2 1 1
7 819 1 1 8 NH2 N N 8.055 0.456 -1.707 1.00 . A A . 8 NH2 N 1 1
8 820 1 1 1 CYS C C 1.983 -1.936 -2.361 1.00 . A A . 1 CYS C 1 1
8 821 1 1 1 CYS CA C 1.678 -0.825 -1.364 1.00 . A A . 1 CYS CA 1 1
8 822 1 1 1 CYS CB C 1.444 0.491 -2.106 1.00 . A A . 1 CYS CB 1 1
8 823 1 1 1 CYS H1 H 2.911 0.327 -0.144 1.00 . A A . 1 CYS H1 1 1
8 824 1 1 1 CYS H2 H 3.703 -0.970 -0.905 1.00 . A A . 1 CYS H2 1 1
8 825 1 1 1 CYS H3 H 2.672 -1.256 0.415 1.00 . A A . 1 CYS H3 1 1
8 826 1 1 1 CYS HA H 0.792 -1.082 -0.801 1.00 . A A . 1 CYS HA 1 1
8 827 1 1 1 CYS HB2 H 1.279 0.290 -3.153 1.00 . A A . 1 CYS HB2 1 1
8 828 1 1 1 CYS HB3 H 0.578 0.987 -1.694 1.00 . A A . 1 CYS HB3 1 1
8 829 1 1 1 CYS N N 2.828 -0.669 -0.428 1.00 . A A . 1 CYS N 1 1
8 830 1 1 1 CYS O O 3.016 -1.918 -3.029 1.00 . A A . 1 CYS O 1 1
8 831 1 1 1 CYS SG S 2.896 1.557 -1.918 1.00 . A A . 1 CYS SG 1 1
8 832 1 1 2 ARG C C 0.734 -3.673 -4.759 1.00 . A A . 2 ARG C 1 1
8 833 1 1 2 ARG CA C 1.259 -4.019 -3.371 1.00 . A A . 2 ARG CA 1 1
8 834 1 1 2 ARG CB C 0.527 -5.247 -2.840 1.00 . A A . 2 ARG CB 1 1
8 835 1 1 2 ARG CD C 2.279 -6.942 -2.255 1.00 . A A . 2 ARG CD 1 1
8 836 1 1 2 ARG CG C 1.249 -6.514 -3.302 1.00 . A A . 2 ARG CG 1 1
8 837 1 1 2 ARG CZ C 2.212 -8.004 -0.072 1.00 . A A . 2 ARG CZ 1 1
8 838 1 1 2 ARG H H 0.273 -2.869 -1.898 1.00 . A A . 2 ARG H 1 1
8 839 1 1 2 ARG HA H 2.308 -4.249 -3.444 1.00 . A A . 2 ARG HA 1 1
8 840 1 1 2 ARG HB2 H 0.505 -5.214 -1.760 1.00 . A A . 2 ARG HB2 1 1
8 841 1 1 2 ARG HB3 H -0.484 -5.254 -3.219 1.00 . A A . 2 ARG HB3 1 1
8 842 1 1 2 ARG HD2 H 3.085 -7.467 -2.746 1.00 . A A . 2 ARG HD2 1 1
8 843 1 1 2 ARG HD3 H 2.675 -6.066 -1.762 1.00 . A A . 2 ARG HD3 1 1
8 844 1 1 2 ARG HE H 0.827 -8.284 -1.490 1.00 . A A . 2 ARG HE 1 1
8 845 1 1 2 ARG HG2 H 0.524 -7.293 -3.435 1.00 . A A . 2 ARG HG2 1 1
8 846 1 1 2 ARG HG3 H 1.753 -6.332 -4.238 1.00 . A A . 2 ARG HG3 1 1
8 847 1 1 2 ARG HH11 H 0.790 -9.264 0.559 1.00 . A A . 2 ARG HH11 1 1
8 848 1 1 2 ARG HH12 H 2.056 -8.933 1.695 1.00 . A A . 2 ARG HH12 1 1
8 849 1 1 2 ARG HH21 H 3.761 -6.786 -0.428 1.00 . A A . 2 ARG HH21 1 1
8 850 1 1 2 ARG HH22 H 3.737 -7.530 1.136 1.00 . A A . 2 ARG HH22 1 1
8 851 1 1 2 ARG N N 1.077 -2.904 -2.455 1.00 . A A . 2 ARG N 1 1
8 852 1 1 2 ARG NE N 1.662 -7.821 -1.268 1.00 . A A . 2 ARG NE 1 1
8 853 1 1 2 ARG NH1 N 1.641 -8.796 0.795 1.00 . A A . 2 ARG NH1 1 1
8 854 1 1 2 ARG NH2 N 3.324 -7.393 0.236 1.00 . A A . 2 ARG NH2 1 1
8 855 1 1 2 ARG O O 0.589 -2.501 -5.106 1.00 . A A . 2 ARG O 1 1
8 856 1 1 3 DTR C C 0.986 -3.765 -7.741 1.00 . A A . 3 DTR C 1 1
8 857 1 1 3 DTR CA C -0.046 -4.510 -6.897 1.00 . A A . 3 DTR CA 1 1
8 858 1 1 3 DTR CB C -0.344 -5.869 -7.535 1.00 . A A . 3 DTR CB 1 1
8 859 1 1 3 DTR CD1 C -0.163 -7.787 -5.898 1.00 . A A . 3 DTR CD1 1 1
8 860 1 1 3 DTR CD2 C 1.810 -7.268 -6.841 1.00 . A A . 3 DTR CD2 1 1
8 861 1 1 3 DTR CE2 C 2.055 -8.344 -5.956 1.00 . A A . 3 DTR CE2 1 1
8 862 1 1 3 DTR CE3 C 2.895 -6.748 -7.566 1.00 . A A . 3 DTR CE3 1 1
8 863 1 1 3 DTR CG C 0.393 -6.934 -6.788 1.00 . A A . 3 DTR CG 1 1
8 864 1 1 3 DTR CH2 C 4.398 -8.353 -6.523 1.00 . A A . 3 DTR CH2 1 1
8 865 1 1 3 DTR CZ2 C 3.333 -8.882 -5.795 1.00 . A A . 3 DTR CZ2 1 1
8 866 1 1 3 DTR CZ3 C 4.180 -7.290 -7.405 1.00 . A A . 3 DTR CZ3 1 1
8 867 1 1 3 DTR H H 0.591 -5.608 -5.212 1.00 . A A . 3 DTR H 1 1
8 868 1 1 3 DTR HA H -0.956 -3.936 -6.854 1.00 . A A . 3 DTR HA 1 1
8 869 1 1 3 DTR HB2 H -0.022 -5.862 -8.565 1.00 . A A . 3 DTR HB2 1 1
8 870 1 1 3 DTR HB3 H -1.406 -6.064 -7.489 1.00 . A A . 3 DTR HB3 1 1
8 871 1 1 3 DTR HD1 H -1.205 -7.809 -5.618 1.00 . A A . 3 DTR HD1 1 1
8 872 1 1 3 DTR HE1 H 0.680 -9.336 -4.746 1.00 . A A . 3 DTR HE1 1 1
8 873 1 1 3 DTR HE3 H 2.739 -5.928 -8.251 1.00 . A A . 3 DTR HE3 1 1
8 874 1 1 3 DTR HH2 H 5.391 -8.761 -6.404 1.00 . A A . 3 DTR HH2 1 1
8 875 1 1 3 DTR HZ2 H 3.499 -9.700 -5.114 1.00 . A A . 3 DTR HZ2 1 1
8 876 1 1 3 DTR HZ3 H 5.005 -6.886 -7.963 1.00 . A A . 3 DTR HZ3 1 1
8 877 1 1 3 DTR N N 0.455 -4.702 -5.546 1.00 . A A . 3 DTR N 1 1
8 878 1 1 3 DTR NE1 N 0.821 -8.625 -5.405 1.00 . A A . 3 DTR NE1 1 1
8 879 1 1 3 DTR O O 0.762 -3.489 -8.919 1.00 . A A . 3 DTR O 1 1
8 880 1 1 4 THR C C 4.530 -2.999 -7.076 1.00 . A A . 4 THR C 1 1
8 881 1 1 4 THR CA C 3.201 -2.756 -7.811 1.00 . A A . 4 THR CA 1 1
8 882 1 1 4 THR CB C 2.909 -1.254 -7.852 1.00 . A A . 4 THR CB 1 1
8 883 1 1 4 THR CG2 C 2.306 -0.804 -6.521 1.00 . A A . 4 THR CG2 1 1
8 884 1 1 4 THR H H 2.242 -3.713 -6.186 1.00 . A A . 4 THR H 1 1
8 885 1 1 4 THR HA H 3.259 -3.120 -8.822 1.00 . A A . 4 THR HA 1 1
8 886 1 1 4 THR HB H 2.211 -1.046 -8.648 1.00 . A A . 4 THR HB 1 1
8 887 1 1 4 THR HG1 H 4.311 -0.594 -9.029 1.00 . A A . 4 THR HG1 1 1
8 888 1 1 4 THR HG21 H 2.608 -1.484 -5.740 1.00 . A A . 4 THR HG21 1 1
8 889 1 1 4 THR HG22 H 1.230 -0.798 -6.598 1.00 . A A . 4 THR HG22 1 1
8 890 1 1 4 THR HG23 H 2.655 0.190 -6.286 1.00 . A A . 4 THR HG23 1 1
8 891 1 1 4 THR N N 2.123 -3.457 -7.124 1.00 . A A . 4 THR N 1 1
8 892 1 1 4 THR O O 4.676 -2.580 -5.927 1.00 . A A . 4 THR O 1 1
8 893 1 1 4 THR OG1 O 4.119 -0.547 -8.089 1.00 . A A . 4 THR OG1 1 1
8 894 1 1 5 PRO C C 7.728 -2.731 -7.020 1.00 . A A . 5 PRO C 1 1
8 895 1 1 5 PRO CA C 6.796 -3.941 -7.008 1.00 . A A . 5 PRO CA 1 1
8 896 1 1 5 PRO CB C 7.386 -5.089 -7.823 1.00 . A A . 5 PRO CB 1 1
8 897 1 1 5 PRO CD C 5.469 -4.222 -9.047 1.00 . A A . 5 PRO CD 1 1
8 898 1 1 5 PRO CG C 6.817 -4.935 -9.195 1.00 . A A . 5 PRO CG 1 1
8 899 1 1 5 PRO HA H 6.629 -4.272 -5.996 1.00 . A A . 5 PRO HA 1 1
8 900 1 1 5 PRO HB2 H 8.464 -5.009 -7.851 1.00 . A A . 5 PRO HB2 1 1
8 901 1 1 5 PRO HB3 H 7.089 -6.039 -7.402 1.00 . A A . 5 PRO HB3 1 1
8 902 1 1 5 PRO HD2 H 5.379 -3.430 -9.778 1.00 . A A . 5 PRO HD2 1 1
8 903 1 1 5 PRO HD3 H 4.659 -4.924 -9.150 1.00 . A A . 5 PRO HD3 1 1
8 904 1 1 5 PRO HG2 H 7.486 -4.343 -9.806 1.00 . A A . 5 PRO HG2 1 1
8 905 1 1 5 PRO HG3 H 6.666 -5.904 -9.644 1.00 . A A . 5 PRO HG3 1 1
8 906 1 1 5 PRO N N 5.495 -3.665 -7.680 1.00 . A A . 5 PRO N 1 1
8 907 1 1 5 PRO O O 8.932 -2.862 -6.807 1.00 . A A . 5 PRO O 1 1
8 908 1 1 6 VAL C C 7.940 0.362 -5.949 1.00 . A A . 6 VAL C 1 1
8 909 1 1 6 VAL CA C 7.957 -0.332 -7.308 1.00 . A A . 6 VAL CA 1 1
8 910 1 1 6 VAL CB C 7.412 0.616 -8.382 1.00 . A A . 6 VAL CB 1 1
8 911 1 1 6 VAL CG1 C 6.317 1.504 -7.785 1.00 . A A . 6 VAL CG1 1 1
8 912 1 1 6 VAL CG2 C 8.549 1.496 -8.904 1.00 . A A . 6 VAL CG2 1 1
8 913 1 1 6 VAL H H 6.198 -1.509 -7.435 1.00 . A A . 6 VAL H 1 1
8 914 1 1 6 VAL HA H 8.976 -0.586 -7.556 1.00 . A A . 6 VAL HA 1 1
8 915 1 1 6 VAL HB H 7.001 0.037 -9.195 1.00 . A A . 6 VAL HB 1 1
8 916 1 1 6 VAL HG11 H 6.769 2.308 -7.225 1.00 . A A . 6 VAL HG11 1 1
8 917 1 1 6 VAL HG12 H 5.689 0.916 -7.132 1.00 . A A . 6 VAL HG12 1 1
8 918 1 1 6 VAL HG13 H 5.715 1.917 -8.583 1.00 . A A . 6 VAL HG13 1 1
8 919 1 1 6 VAL HG21 H 9.251 1.689 -8.107 1.00 . A A . 6 VAL HG21 1 1
8 920 1 1 6 VAL HG22 H 8.145 2.432 -9.262 1.00 . A A . 6 VAL HG22 1 1
8 921 1 1 6 VAL HG23 H 9.054 0.990 -9.714 1.00 . A A . 6 VAL HG23 1 1
8 922 1 1 6 VAL N N 7.162 -1.555 -7.271 1.00 . A A . 6 VAL N 1 1
8 923 1 1 6 VAL O O 8.870 1.088 -5.600 1.00 . A A . 6 VAL O 1 1
8 924 1 1 7 CYS C C 7.013 -0.292 -2.773 1.00 . A A . 7 CYS C 1 1
8 925 1 1 7 CYS CA C 6.743 0.738 -3.866 1.00 . A A . 7 CYS CA 1 1
8 926 1 1 7 CYS CB C 5.334 1.310 -3.693 1.00 . A A . 7 CYS CB 1 1
8 927 1 1 7 CYS H H 6.164 -0.457 -5.517 1.00 . A A . 7 CYS H 1 1
8 928 1 1 7 CYS HA H 7.459 1.541 -3.774 1.00 . A A . 7 CYS HA 1 1
8 929 1 1 7 CYS HB2 H 5.401 2.345 -3.392 1.00 . A A . 7 CYS HB2 1 1
8 930 1 1 7 CYS HB3 H 4.800 1.241 -4.629 1.00 . A A . 7 CYS HB3 1 1
8 931 1 1 7 CYS N N 6.874 0.131 -5.186 1.00 . A A . 7 CYS N 1 1
8 932 1 1 7 CYS O O 7.565 0.039 -1.724 1.00 . A A . 7 CYS O 1 1
8 933 1 1 7 CYS SG S 4.451 0.369 -2.424 1.00 . A A . 7 CYS SG 1 1
8 934 1 1 8 NH2 HN1 H 6.214 -1.796 -3.793 1.00 . A A . 8 NH2 HN1 1 1
8 935 1 1 8 NH2 HN2 H 6.822 -2.201 -2.262 1.00 . A A . 8 NH2 HN2 1 1
8 936 1 1 8 NH2 N N 6.654 -1.533 -2.959 1.00 . A A . 8 NH2 N 1 1
9 937 1 1 1 CYS C C 1.977 -1.858 -2.464 1.00 . A A . 1 CYS C 1 1
9 938 1 1 1 CYS CA C 1.693 -0.752 -1.455 1.00 . A A . 1 CYS CA 1 1
9 939 1 1 1 CYS CB C 2.805 -0.705 -0.405 1.00 . A A . 1 CYS CB 1 1
9 940 1 1 1 CYS H1 H 0.440 -0.707 0.208 1.00 . A A . 1 CYS H1 1 1
9 941 1 1 1 CYS H2 H 0.186 -2.038 -0.816 1.00 . A A . 1 CYS H2 1 1
9 942 1 1 1 CYS H3 H -0.366 -0.497 -1.270 1.00 . A A . 1 CYS H3 1 1
9 943 1 1 1 CYS HA H 1.643 0.197 -1.968 1.00 . A A . 1 CYS HA 1 1
9 944 1 1 1 CYS HB2 H 2.369 -0.594 0.577 1.00 . A A . 1 CYS HB2 1 1
9 945 1 1 1 CYS HB3 H 3.375 -1.621 -0.445 1.00 . A A . 1 CYS HB3 1 1
9 946 1 1 1 CYS N N 0.390 -1.019 -0.782 1.00 . A A . 1 CYS N 1 1
9 947 1 1 1 CYS O O 2.929 -1.774 -3.239 1.00 . A A . 1 CYS O 1 1
9 948 1 1 1 CYS SG S 3.897 0.699 -0.743 1.00 . A A . 1 CYS SG 1 1
9 949 1 1 2 ARG C C 0.766 -3.675 -4.738 1.00 . A A . 2 ARG C 1 1
9 950 1 1 2 ARG CA C 1.321 -4.014 -3.361 1.00 . A A . 2 ARG CA 1 1
9 951 1 1 2 ARG CB C 0.612 -5.247 -2.813 1.00 . A A . 2 ARG CB 1 1
9 952 1 1 2 ARG CD C 2.389 -6.928 -2.257 1.00 . A A . 2 ARG CD 1 1
9 953 1 1 2 ARG CG C 1.337 -6.509 -3.286 1.00 . A A . 2 ARG CG 1 1
9 954 1 1 2 ARG CZ C 2.377 -7.997 -0.077 1.00 . A A . 2 ARG CZ 1 1
9 955 1 1 2 ARG H H 0.408 -2.913 -1.804 1.00 . A A . 2 ARG H 1 1
9 956 1 1 2 ARG HA H 2.371 -4.233 -3.455 1.00 . A A . 2 ARG HA 1 1
9 957 1 1 2 ARG HB2 H 0.612 -5.213 -1.733 1.00 . A A . 2 ARG HB2 1 1
9 958 1 1 2 ARG HB3 H -0.406 -5.265 -3.171 1.00 . A A . 2 ARG HB3 1 1
9 959 1 1 2 ARG HD2 H 3.190 -7.448 -2.763 1.00 . A A . 2 ARG HD2 1 1
9 960 1 1 2 ARG HD3 H 2.787 -6.048 -1.772 1.00 . A A . 2 ARG HD3 1 1
9 961 1 1 2 ARG HE H 0.956 -8.272 -1.461 1.00 . A A . 2 ARG HE 1 1
9 962 1 1 2 ARG HG2 H 0.618 -7.293 -3.408 1.00 . A A . 2 ARG HG2 1 1
9 963 1 1 2 ARG HG3 H 1.823 -6.323 -4.231 1.00 . A A . 2 ARG HG3 1 1
9 964 1 1 2 ARG HH11 H 0.972 -9.260 0.586 1.00 . A A . 2 ARG HH11 1 1
9 965 1 1 2 ARG HH12 H 2.265 -8.932 1.689 1.00 . A A . 2 ARG HH12 1 1
9 966 1 1 2 ARG HH21 H 3.915 -6.777 -0.468 1.00 . A A . 2 ARG HH21 1 1
9 967 1 1 2 ARG HH22 H 3.932 -7.526 1.093 1.00 . A A . 2 ARG HH22 1 1
9 968 1 1 2 ARG N N 1.148 -2.896 -2.446 1.00 . A A . 2 ARG N 1 1
9 969 1 1 2 ARG NE N 1.797 -7.810 -1.258 1.00 . A A . 2 ARG NE 1 1
9 970 1 1 2 ARG NH1 N 1.829 -8.791 0.801 1.00 . A A . 2 ARG NH1 1 1
9 971 1 1 2 ARG NH2 N 3.495 -7.386 0.205 1.00 . A A . 2 ARG NH2 1 1
9 972 1 1 2 ARG O O 0.603 -2.506 -5.084 1.00 . A A . 2 ARG O 1 1
9 973 1 1 3 DTR C C 0.976 -3.772 -7.721 1.00 . A A . 3 DTR C 1 1
9 974 1 1 3 DTR CA C -0.041 -4.520 -6.862 1.00 . A A . 3 DTR CA 1 1
9 975 1 1 3 DTR CB C -0.343 -5.881 -7.493 1.00 . A A . 3 DTR CB 1 1
9 976 1 1 3 DTR CD1 C -0.127 -7.795 -5.855 1.00 . A A . 3 DTR CD1 1 1
9 977 1 1 3 DTR CD2 C 1.828 -7.275 -6.837 1.00 . A A . 3 DTR CD2 1 1
9 978 1 1 3 DTR CE2 C 2.090 -8.349 -5.954 1.00 . A A . 3 DTR CE2 1 1
9 979 1 1 3 DTR CE3 C 2.899 -6.755 -7.584 1.00 . A A . 3 DTR CE3 1 1
9 980 1 1 3 DTR CG C 0.411 -6.943 -6.757 1.00 . A A . 3 DTR CG 1 1
9 981 1 1 3 DTR CH2 C 4.423 -8.357 -6.564 1.00 . A A . 3 DTR CH2 1 1
9 982 1 1 3 DTR CZ2 C 3.371 -8.886 -5.817 1.00 . A A . 3 DTR CZ2 1 1
9 983 1 1 3 DTR CZ3 C 4.187 -7.295 -7.445 1.00 . A A . 3 DTR CZ3 1 1
9 984 1 1 3 DTR H H 0.638 -5.613 -5.190 1.00 . A A . 3 DTR H 1 1
9 985 1 1 3 DTR HA H -0.951 -3.950 -6.804 1.00 . A A . 3 DTR HA 1 1
9 986 1 1 3 DTR HB2 H -0.038 -5.875 -8.528 1.00 . A A . 3 DTR HB2 1 1
9 987 1 1 3 DTR HB3 H -1.402 -6.080 -7.429 1.00 . A A . 3 DTR HB3 1 1
9 988 1 1 3 DTR HD1 H -1.163 -7.817 -5.556 1.00 . A A . 3 DTR HD1 1 1
9 989 1 1 3 DTR HE1 H 0.740 -9.341 -4.716 1.00 . A A . 3 DTR HE1 1 1
9 990 1 1 3 DTR HE3 H 2.730 -5.936 -8.267 1.00 . A A . 3 DTR HE3 1 1
9 991 1 1 3 DTR HH2 H 5.417 -8.764 -6.465 1.00 . A A . 3 DTR HH2 1 1
9 992 1 1 3 DTR HZ2 H 3.551 -9.703 -5.137 1.00 . A A . 3 DTR HZ2 1 1
9 993 1 1 3 DTR HZ3 H 5.001 -6.891 -8.020 1.00 . A A . 3 DTR HZ3 1 1
9 994 1 1 3 DTR N N 0.485 -4.708 -5.520 1.00 . A A . 3 DTR N 1 1
9 995 1 1 3 DTR NE1 N 0.867 -8.631 -5.380 1.00 . A A . 3 DTR NE1 1 1
9 996 1 1 3 DTR O O 0.732 -3.496 -8.896 1.00 . A A . 3 DTR O 1 1
9 997 1 1 4 THR C C 4.524 -2.998 -7.102 1.00 . A A . 4 THR C 1 1
9 998 1 1 4 THR CA C 3.186 -2.755 -7.820 1.00 . A A . 4 THR CA 1 1
9 999 1 1 4 THR CB C 2.891 -1.252 -7.854 1.00 . A A . 4 THR CB 1 1
9 1000 1 1 4 THR CG2 C 2.308 -0.807 -6.512 1.00 . A A . 4 THR CG2 1 1
9 1001 1 1 4 THR H H 2.252 -3.716 -6.183 1.00 . A A . 4 THR H 1 1
9 1002 1 1 4 THR HA H 3.232 -3.117 -8.832 1.00 . A A . 4 THR HA 1 1
9 1003 1 1 4 THR HB H 2.180 -1.045 -8.638 1.00 . A A . 4 THR HB 1 1
9 1004 1 1 4 THR HG1 H 3.932 0.067 -8.832 1.00 . A A . 4 THR HG1 1 1
9 1005 1 1 4 THR HG21 H 2.664 0.186 -6.278 1.00 . A A . 4 THR HG21 1 1
9 1006 1 1 4 THR HG22 H 2.618 -1.492 -5.739 1.00 . A A . 4 THR HG22 1 1
9 1007 1 1 4 THR HG23 H 1.229 -0.797 -6.575 1.00 . A A . 4 THR HG23 1 1
9 1008 1 1 4 THR N N 2.120 -3.460 -7.120 1.00 . A A . 4 THR N 1 1
9 1009 1 1 4 THR O O 4.684 -2.585 -5.953 1.00 . A A . 4 THR O 1 1
9 1010 1 1 4 THR OG1 O 4.095 -0.543 -8.109 1.00 . A A . 4 THR OG1 1 1
9 1011 1 1 5 PRO C C 7.720 -2.724 -7.073 1.00 . A A . 5 PRO C 1 1
9 1012 1 1 5 PRO CA C 6.794 -3.937 -7.065 1.00 . A A . 5 PRO CA 1 1
9 1013 1 1 5 PRO CB C 7.378 -5.075 -7.897 1.00 . A A . 5 PRO CB 1 1
9 1014 1 1 5 PRO CD C 5.442 -4.210 -9.090 1.00 . A A . 5 PRO CD 1 1
9 1015 1 1 5 PRO CG C 6.793 -4.910 -9.261 1.00 . A A . 5 PRO CG 1 1
9 1016 1 1 5 PRO HA H 6.637 -4.279 -6.054 1.00 . A A . 5 PRO HA 1 1
9 1017 1 1 5 PRO HB2 H 8.455 -4.988 -7.935 1.00 . A A . 5 PRO HB2 1 1
9 1018 1 1 5 PRO HB3 H 7.090 -6.030 -7.482 1.00 . A A . 5 PRO HB3 1 1
9 1019 1 1 5 PRO HD2 H 5.337 -3.414 -9.815 1.00 . A A . 5 PRO HD2 1 1
9 1020 1 1 5 PRO HD3 H 4.636 -4.918 -9.184 1.00 . A A . 5 PRO HD3 1 1
9 1021 1 1 5 PRO HG2 H 7.452 -4.307 -9.872 1.00 . A A . 5 PRO HG2 1 1
9 1022 1 1 5 PRO HG3 H 6.644 -5.876 -9.718 1.00 . A A . 5 PRO HG3 1 1
9 1023 1 1 5 PRO N N 5.483 -3.659 -7.720 1.00 . A A . 5 PRO N 1 1
9 1024 1 1 5 PRO O O 8.936 -2.860 -6.929 1.00 . A A . 5 PRO O 1 1
9 1025 1 1 6 VAL C C 7.871 0.388 -5.912 1.00 . A A . 6 VAL C 1 1
9 1026 1 1 6 VAL CA C 7.931 -0.315 -7.265 1.00 . A A . 6 VAL CA 1 1
9 1027 1 1 6 VAL CB C 7.410 0.622 -8.360 1.00 . A A . 6 VAL CB 1 1
9 1028 1 1 6 VAL CG1 C 6.300 1.516 -7.799 1.00 . A A . 6 VAL CG1 1 1
9 1029 1 1 6 VAL CG2 C 8.559 1.499 -8.864 1.00 . A A . 6 VAL CG2 1 1
9 1030 1 1 6 VAL H H 6.170 -1.493 -7.351 1.00 . A A . 6 VAL H 1 1
9 1031 1 1 6 VAL HA H 8.958 -0.565 -7.483 1.00 . A A . 6 VAL HA 1 1
9 1032 1 1 6 VAL HB H 7.020 0.035 -9.178 1.00 . A A . 6 VAL HB 1 1
9 1033 1 1 6 VAL HG11 H 6.738 2.325 -7.234 1.00 . A A . 6 VAL HG11 1 1
9 1034 1 1 6 VAL HG12 H 5.657 0.933 -7.156 1.00 . A A . 6 VAL HG12 1 1
9 1035 1 1 6 VAL HG13 H 5.719 1.920 -8.614 1.00 . A A . 6 VAL HG13 1 1
9 1036 1 1 6 VAL HG21 H 8.159 2.404 -9.296 1.00 . A A . 6 VAL HG21 1 1
9 1037 1 1 6 VAL HG22 H 9.121 0.960 -9.613 1.00 . A A . 6 VAL HG22 1 1
9 1038 1 1 6 VAL HG23 H 9.209 1.750 -8.039 1.00 . A A . 6 VAL HG23 1 1
9 1039 1 1 6 VAL N N 7.142 -1.542 -7.242 1.00 . A A . 6 VAL N 1 1
9 1040 1 1 6 VAL O O 8.717 1.227 -5.600 1.00 . A A . 6 VAL O 1 1
9 1041 1 1 7 CYS C C 8.054 0.787 -3.101 1.00 . A A . 7 CYS C 1 1
9 1042 1 1 7 CYS CA C 6.704 0.647 -3.796 1.00 . A A . 7 CYS CA 1 1
9 1043 1 1 7 CYS CB C 5.772 -0.211 -2.938 1.00 . A A . 7 CYS CB 1 1
9 1044 1 1 7 CYS H H 6.221 -0.631 -5.417 1.00 . A A . 7 CYS H 1 1
9 1045 1 1 7 CYS HA H 6.267 1.627 -3.913 1.00 . A A . 7 CYS HA 1 1
9 1046 1 1 7 CYS HB2 H 5.613 -1.164 -3.421 1.00 . A A . 7 CYS HB2 1 1
9 1047 1 1 7 CYS HB3 H 6.219 -0.368 -1.968 1.00 . A A . 7 CYS HB3 1 1
9 1048 1 1 7 CYS N N 6.866 0.042 -5.115 1.00 . A A . 7 CYS N 1 1
9 1049 1 1 7 CYS O O 8.859 -0.145 -3.104 1.00 . A A . 7 CYS O 1 1
9 1050 1 1 7 CYS SG S 4.184 0.636 -2.742 1.00 . A A . 7 CYS SG 1 1
9 1051 1 1 8 NH2 HN1 H 7.711 2.647 -2.498 1.00 . A A . 8 NH2 HN1 1 1
9 1052 1 1 8 NH2 HN2 H 9.218 2.005 -2.051 1.00 . A A . 8 NH2 HN2 1 1
9 1053 1 1 8 NH2 N N 8.353 1.906 -2.500 1.00 . A A . 8 NH2 N 1 1
10 1054 1 1 1 CYS C C 2.084 -2.077 -2.250 1.00 . A A . 1 CYS C 1 1
10 1055 1 1 1 CYS CA C 1.837 -1.061 -1.140 1.00 . A A . 1 CYS CA 1 1
10 1056 1 1 1 CYS CB C 1.377 0.269 -1.742 1.00 . A A . 1 CYS CB 1 1
10 1057 1 1 1 CYS H1 H 3.888 -0.715 -1.038 1.00 . A A . 1 CYS H1 1 1
10 1058 1 1 1 CYS H2 H 3.283 -1.676 0.226 1.00 . A A . 1 CYS H2 1 1
10 1059 1 1 1 CYS H3 H 3.003 0.000 0.220 1.00 . A A . 1 CYS H3 1 1
10 1060 1 1 1 CYS HA H 1.074 -1.436 -0.475 1.00 . A A . 1 CYS HA 1 1
10 1061 1 1 1 CYS HB2 H 0.977 0.097 -2.731 1.00 . A A . 1 CYS HB2 1 1
10 1062 1 1 1 CYS HB3 H 0.612 0.702 -1.115 1.00 . A A . 1 CYS HB3 1 1
10 1063 1 1 1 CYS N N 3.098 -0.847 -0.376 1.00 . A A . 1 CYS N 1 1
10 1064 1 1 1 CYS O O 3.067 -1.981 -2.985 1.00 . A A . 1 CYS O 1 1
10 1065 1 1 1 CYS SG S 2.784 1.402 -1.850 1.00 . A A . 1 CYS SG 1 1
10 1066 1 1 2 ARG C C 0.834 -3.570 -4.735 1.00 . A A . 2 ARG C 1 1
10 1067 1 1 2 ARG CA C 1.317 -4.081 -3.385 1.00 . A A . 2 ARG CA 1 1
10 1068 1 1 2 ARG CB C 0.507 -5.307 -2.985 1.00 . A A . 2 ARG CB 1 1
10 1069 1 1 2 ARG CD C 2.173 -7.138 -2.597 1.00 . A A . 2 ARG CD 1 1
10 1070 1 1 2 ARG CG C 1.153 -6.559 -3.579 1.00 . A A . 2 ARG CG 1 1
10 1071 1 1 2 ARG CZ C 2.122 -8.491 -0.581 1.00 . A A . 2 ARG CZ 1 1
10 1072 1 1 2 ARG H H 0.425 -3.080 -1.750 1.00 . A A . 2 ARG H 1 1
10 1073 1 1 2 ARG HA H 2.350 -4.367 -3.472 1.00 . A A . 2 ARG HA 1 1
10 1074 1 1 2 ARG HB2 H 0.481 -5.388 -1.908 1.00 . A A . 2 ARG HB2 1 1
10 1075 1 1 2 ARG HB3 H -0.500 -5.213 -3.362 1.00 . A A . 2 ARG HB3 1 1
10 1076 1 1 2 ARG HD2 H 2.953 -7.640 -3.153 1.00 . A A . 2 ARG HD2 1 1
10 1077 1 1 2 ARG HD3 H 2.609 -6.337 -2.018 1.00 . A A . 2 ARG HD3 1 1
10 1078 1 1 2 ARG HE H 0.644 -8.447 -1.931 1.00 . A A . 2 ARG HE 1 1
10 1079 1 1 2 ARG HG2 H 0.387 -7.284 -3.772 1.00 . A A . 2 ARG HG2 1 1
10 1080 1 1 2 ARG HG3 H 1.654 -6.312 -4.502 1.00 . A A . 2 ARG HG3 1 1
10 1081 1 1 2 ARG HH11 H 0.622 -9.700 -0.037 1.00 . A A . 2 ARG HH11 1 1
10 1082 1 1 2 ARG HH12 H 1.970 -9.645 1.048 1.00 . A A . 2 ARG HH12 1 1
10 1083 1 1 2 ARG HH21 H 3.757 -7.373 -0.867 1.00 . A A . 2 ARG HH21 1 1
10 1084 1 1 2 ARG HH22 H 3.746 -8.327 0.579 1.00 . A A . 2 ARG HH22 1 1
10 1085 1 1 2 ARG N N 1.187 -3.051 -2.364 1.00 . A A . 2 ARG N 1 1
10 1086 1 1 2 ARG NE N 1.529 -8.092 -1.702 1.00 . A A . 2 ARG NE 1 1
10 1087 1 1 2 ARG NH1 N 1.524 -9.345 0.205 1.00 . A A . 2 ARG NH1 1 1
10 1088 1 1 2 ARG NH2 N 3.300 -8.028 -0.266 1.00 . A A . 2 ARG NH2 1 1
10 1089 1 1 2 ARG O O 0.831 -2.366 -4.992 1.00 . A A . 2 ARG O 1 1
10 1090 1 1 3 DTR C C 1.052 -3.383 -7.680 1.00 . A A . 3 DTR C 1 1
10 1091 1 1 3 DTR CA C -0.035 -4.140 -6.923 1.00 . A A . 3 DTR CA 1 1
10 1092 1 1 3 DTR CB C -0.421 -5.403 -7.698 1.00 . A A . 3 DTR CB 1 1
10 1093 1 1 3 DTR CD1 C -0.380 -7.475 -6.251 1.00 . A A . 3 DTR CD1 1 1
10 1094 1 1 3 DTR CD2 C 1.612 -7.038 -7.193 1.00 . A A . 3 DTR CD2 1 1
10 1095 1 1 3 DTR CE2 C 1.779 -8.209 -6.418 1.00 . A A . 3 DTR CE2 1 1
10 1096 1 1 3 DTR CE3 C 2.723 -6.544 -7.893 1.00 . A A . 3 DTR CE3 1 1
10 1097 1 1 3 DTR CG C 0.233 -6.591 -7.070 1.00 . A A . 3 DTR CG 1 1
10 1098 1 1 3 DTR CH2 C 4.103 -8.360 -7.047 1.00 . A A . 3 DTR CH2 1 1
10 1099 1 1 3 DTR CZ2 C 3.009 -8.867 -6.344 1.00 . A A . 3 DTR CZ2 1 1
10 1100 1 1 3 DTR CZ3 C 3.960 -7.202 -7.820 1.00 . A A . 3 DTR CZ3 1 1
10 1101 1 1 3 DTR H H 0.469 -5.435 -5.337 1.00 . A A . 3 DTR H 1 1
10 1102 1 1 3 DTR HA H -0.905 -3.513 -6.824 1.00 . A A . 3 DTR HA 1 1
10 1103 1 1 3 DTR HB2 H -0.093 -5.311 -8.723 1.00 . A A . 3 DTR HB2 1 1
10 1104 1 1 3 DTR HB3 H -1.495 -5.526 -7.673 1.00 . A A . 3 DTR HB3 1 1
10 1105 1 1 3 DTR HD1 H -1.415 -7.435 -5.947 1.00 . A A . 3 DTR HD1 1 1
10 1106 1 1 3 DTR HE1 H 0.345 -9.194 -5.272 1.00 . A A . 3 DTR HE1 1 1
10 1107 1 1 3 DTR HE3 H 2.623 -5.652 -8.493 1.00 . A A . 3 DTR HE3 1 1
10 1108 1 1 3 DTR HH2 H 5.058 -8.861 -6.995 1.00 . A A . 3 DTR HH2 1 1
10 1109 1 1 3 DTR HZ2 H 3.115 -9.758 -5.746 1.00 . A A . 3 DTR HZ2 1 1
10 1110 1 1 3 DTR HZ3 H 4.804 -6.815 -8.361 1.00 . A A . 3 DTR HZ3 1 1
10 1111 1 1 3 DTR N N 0.437 -4.497 -5.597 1.00 . A A . 3 DTR N 1 1
10 1112 1 1 3 DTR NE1 N 0.536 -8.437 -5.865 1.00 . A A . 3 DTR NE1 1 1
10 1113 1 1 3 DTR O O 0.838 -2.920 -8.800 1.00 . A A . 3 DTR O 1 1
10 1114 1 1 4 THR C C 4.657 -3.014 -6.979 1.00 . A A . 4 THR C 1 1
10 1115 1 1 4 THR CA C 3.349 -2.567 -7.651 1.00 . A A . 4 THR CA 1 1
10 1116 1 1 4 THR CB C 3.179 -1.058 -7.458 1.00 . A A . 4 THR CB 1 1
10 1117 1 1 4 THR CG2 C 2.778 -0.409 -8.782 1.00 . A A . 4 THR CG2 1 1
10 1118 1 1 4 THR H H 2.322 -3.661 -6.160 1.00 . A A . 4 THR H 1 1
10 1119 1 1 4 THR HA H 3.373 -2.781 -8.705 1.00 . A A . 4 THR HA 1 1
10 1120 1 1 4 THR HB H 4.111 -0.631 -7.121 1.00 . A A . 4 THR HB 1 1
10 1121 1 1 4 THR HG1 H 2.586 -0.810 -5.622 1.00 . A A . 4 THR HG1 1 1
10 1122 1 1 4 THR HG21 H 3.544 -0.593 -9.522 1.00 . A A . 4 THR HG21 1 1
10 1123 1 1 4 THR HG22 H 2.663 0.656 -8.641 1.00 . A A . 4 THR HG22 1 1
10 1124 1 1 4 THR HG23 H 1.843 -0.828 -9.120 1.00 . A A . 4 THR HG23 1 1
10 1125 1 1 4 THR N N 2.219 -3.267 -7.050 1.00 . A A . 4 THR N 1 1
10 1126 1 1 4 THR O O 4.852 -2.751 -5.792 1.00 . A A . 4 THR O 1 1
10 1127 1 1 4 THR OG1 O 2.170 -0.818 -6.487 1.00 . A A . 4 THR OG1 1 1
10 1128 1 1 5 PRO C C 7.863 -3.017 -6.970 1.00 . A A . 5 PRO C 1 1
10 1129 1 1 5 PRO CA C 6.837 -4.141 -7.072 1.00 . A A . 5 PRO CA 1 1
10 1130 1 1 5 PRO CB C 7.315 -5.232 -8.027 1.00 . A A . 5 PRO CB 1 1
10 1131 1 1 5 PRO CD C 5.467 -4.066 -9.101 1.00 . A A . 5 PRO CD 1 1
10 1132 1 1 5 PRO CG C 6.743 -4.874 -9.360 1.00 . A A . 5 PRO CG 1 1
10 1133 1 1 5 PRO HA H 6.655 -4.570 -6.100 1.00 . A A . 5 PRO HA 1 1
10 1134 1 1 5 PRO HB2 H 8.396 -5.240 -8.071 1.00 . A A . 5 PRO HB2 1 1
10 1135 1 1 5 PRO HB3 H 6.946 -6.196 -7.712 1.00 . A A . 5 PRO HB3 1 1
10 1136 1 1 5 PRO HD2 H 5.443 -3.188 -9.732 1.00 . A A . 5 PRO HD2 1 1
10 1137 1 1 5 PRO HD3 H 4.595 -4.676 -9.269 1.00 . A A . 5 PRO HD3 1 1
10 1138 1 1 5 PRO HG2 H 7.453 -4.279 -9.917 1.00 . A A . 5 PRO HG2 1 1
10 1139 1 1 5 PRO HG3 H 6.498 -5.769 -9.910 1.00 . A A . 5 PRO HG3 1 1
10 1140 1 1 5 PRO N N 5.555 -3.681 -7.679 1.00 . A A . 5 PRO N 1 1
10 1141 1 1 5 PRO O O 9.052 -3.267 -6.767 1.00 . A A . 5 PRO O 1 1
10 1142 1 1 6 VAL C C 7.784 0.351 -5.962 1.00 . A A . 6 VAL C 1 1
10 1143 1 1 6 VAL CA C 8.272 -0.617 -7.034 1.00 . A A . 6 VAL CA 1 1
10 1144 1 1 6 VAL CB C 8.313 0.096 -8.386 1.00 . A A . 6 VAL CB 1 1
10 1145 1 1 6 VAL CG1 C 6.910 0.589 -8.747 1.00 . A A . 6 VAL CG1 1 1
10 1146 1 1 6 VAL CG2 C 9.266 1.291 -8.304 1.00 . A A . 6 VAL CG2 1 1
10 1147 1 1 6 VAL H H 6.435 -1.648 -7.271 1.00 . A A . 6 VAL H 1 1
10 1148 1 1 6 VAL HA H 9.269 -0.942 -6.783 1.00 . A A . 6 VAL HA 1 1
10 1149 1 1 6 VAL HB H 8.659 -0.592 -9.145 1.00 . A A . 6 VAL HB 1 1
10 1150 1 1 6 VAL HG11 H 6.196 0.186 -8.045 1.00 . A A . 6 VAL HG11 1 1
10 1151 1 1 6 VAL HG12 H 6.660 0.261 -9.746 1.00 . A A . 6 VAL HG12 1 1
10 1152 1 1 6 VAL HG13 H 6.887 1.668 -8.706 1.00 . A A . 6 VAL HG13 1 1
10 1153 1 1 6 VAL HG21 H 8.773 2.110 -7.804 1.00 . A A . 6 VAL HG21 1 1
10 1154 1 1 6 VAL HG22 H 9.550 1.595 -9.300 1.00 . A A . 6 VAL HG22 1 1
10 1155 1 1 6 VAL HG23 H 10.149 1.009 -7.748 1.00 . A A . 6 VAL HG23 1 1
10 1156 1 1 6 VAL N N 7.393 -1.780 -7.111 1.00 . A A . 6 VAL N 1 1
10 1157 1 1 6 VAL O O 8.480 1.303 -5.606 1.00 . A A . 6 VAL O 1 1
10 1158 1 1 7 CYS C C 7.070 1.342 -3.390 1.00 . A A . 7 CYS C 1 1
10 1159 1 1 7 CYS CA C 6.011 0.961 -4.419 1.00 . A A . 7 CYS CA 1 1
10 1160 1 1 7 CYS CB C 4.856 0.239 -3.722 1.00 . A A . 7 CYS CB 1 1
10 1161 1 1 7 CYS H H 6.072 -0.669 -5.773 1.00 . A A . 7 CYS H 1 1
10 1162 1 1 7 CYS HA H 5.631 1.860 -4.881 1.00 . A A . 7 CYS HA 1 1
10 1163 1 1 7 CYS HB2 H 4.659 -0.696 -4.226 1.00 . A A . 7 CYS HB2 1 1
10 1164 1 1 7 CYS HB3 H 5.121 0.046 -2.692 1.00 . A A . 7 CYS HB3 1 1
10 1165 1 1 7 CYS N N 6.582 0.104 -5.451 1.00 . A A . 7 CYS N 1 1
10 1166 1 1 7 CYS O O 7.501 0.504 -2.597 1.00 . A A . 7 CYS O 1 1
10 1167 1 1 7 CYS SG S 3.374 1.278 -3.777 1.00 . A A . 7 CYS SG 1 1
10 1168 1 1 8 NH2 HN1 H 7.175 3.233 -3.987 1.00 . A A . 8 NH2 HN1 1 1
10 1169 1 1 8 NH2 HN2 H 8.200 2.821 -2.698 1.00 . A A . 8 NH2 HN2 1 1
10 1170 1 1 8 NH2 N N 7.519 2.567 -3.356 1.00 . A A . 8 NH2 N 1 1
11 1171 1 1 1 CYS C C 1.983 -1.931 -2.353 1.00 . A A . 1 CYS C 1 1
11 1172 1 1 1 CYS CA C 1.671 -0.825 -1.352 1.00 . A A . 1 CYS CA 1 1
11 1173 1 1 1 CYS CB C 1.416 0.490 -2.090 1.00 . A A . 1 CYS CB 1 1
11 1174 1 1 1 CYS H1 H 2.913 0.344 -0.156 1.00 . A A . 1 CYS H1 1 1
11 1175 1 1 1 CYS H2 H 3.699 -0.967 -0.899 1.00 . A A . 1 CYS H2 1 1
11 1176 1 1 1 CYS H3 H 2.672 -1.230 0.429 1.00 . A A . 1 CYS H3 1 1
11 1177 1 1 1 CYS HA H 0.792 -1.094 -0.783 1.00 . A A . 1 CYS HA 1 1
11 1178 1 1 1 CYS HB2 H 1.231 0.285 -3.135 1.00 . A A . 1 CYS HB2 1 1
11 1179 1 1 1 CYS HB3 H 0.555 0.982 -1.663 1.00 . A A . 1 CYS HB3 1 1
11 1180 1 1 1 CYS N N 2.826 -0.656 -0.425 1.00 . A A . 1 CYS N 1 1
11 1181 1 1 1 CYS O O 3.015 -1.902 -3.024 1.00 . A A . 1 CYS O 1 1
11 1182 1 1 1 CYS SG S 2.865 1.563 -1.933 1.00 . A A . 1 CYS SG 1 1
11 1183 1 1 2 ARG C C 0.742 -3.668 -4.754 1.00 . A A . 2 ARG C 1 1
11 1184 1 1 2 ARG CA C 1.272 -4.016 -3.369 1.00 . A A . 2 ARG CA 1 1
11 1185 1 1 2 ARG CB C 0.550 -5.249 -2.839 1.00 . A A . 2 ARG CB 1 1
11 1186 1 1 2 ARG CD C 2.313 -6.938 -2.273 1.00 . A A . 2 ARG CD 1 1
11 1187 1 1 2 ARG CG C 1.275 -6.510 -3.311 1.00 . A A . 2 ARG CG 1 1
11 1188 1 1 2 ARG CZ C 2.248 -7.983 -0.083 1.00 . A A . 2 ARG CZ 1 1
11 1189 1 1 2 ARG H H 0.282 -2.878 -1.889 1.00 . A A . 2 ARG H 1 1
11 1190 1 1 2 ARG HA H 2.322 -4.238 -3.444 1.00 . A A . 2 ARG HA 1 1
11 1191 1 1 2 ARG HB2 H 0.534 -5.222 -1.760 1.00 . A A . 2 ARG HB2 1 1
11 1192 1 1 2 ARG HB3 H -0.463 -5.260 -3.213 1.00 . A A . 2 ARG HB3 1 1
11 1193 1 1 2 ARG HD2 H 3.119 -7.459 -2.771 1.00 . A A . 2 ARG HD2 1 1
11 1194 1 1 2 ARG HD3 H 2.709 -6.063 -1.779 1.00 . A A . 2 ARG HD3 1 1
11 1195 1 1 2 ARG HE H 0.886 -8.308 -1.513 1.00 . A A . 2 ARG HE 1 1
11 1196 1 1 2 ARG HG2 H 0.555 -7.292 -3.446 1.00 . A A . 2 ARG HG2 1 1
11 1197 1 1 2 ARG HG3 H 1.773 -6.321 -4.250 1.00 . A A . 2 ARG HG3 1 1
11 1198 1 1 2 ARG HH11 H 0.851 -9.273 0.543 1.00 . A A . 2 ARG HH11 1 1
11 1199 1 1 2 ARG HH12 H 2.096 -8.902 1.690 1.00 . A A . 2 ARG HH12 1 1
11 1200 1 1 2 ARG HH21 H 3.769 -6.729 -0.432 1.00 . A A . 2 ARG HH21 1 1
11 1201 1 1 2 ARG HH22 H 3.748 -7.462 1.137 1.00 . A A . 2 ARG HH22 1 1
11 1202 1 1 2 ARG N N 1.084 -2.905 -2.449 1.00 . A A . 2 ARG N 1 1
11 1203 1 1 2 ARG NE N 1.707 -7.823 -1.286 1.00 . A A . 2 ARG NE 1 1
11 1204 1 1 2 ARG NH1 N 1.688 -8.782 0.784 1.00 . A A . 2 ARG NH1 1 1
11 1205 1 1 2 ARG NH2 N 3.340 -7.342 0.232 1.00 . A A . 2 ARG NH2 1 1
11 1206 1 1 2 ARG O O 0.594 -2.496 -5.098 1.00 . A A . 2 ARG O 1 1
11 1207 1 1 3 DTR C C 0.990 -3.756 -7.737 1.00 . A A . 3 DTR C 1 1
11 1208 1 1 3 DTR CA C -0.041 -4.501 -6.894 1.00 . A A . 3 DTR CA 1 1
11 1209 1 1 3 DTR CB C -0.344 -5.856 -7.534 1.00 . A A . 3 DTR CB 1 1
11 1210 1 1 3 DTR CD1 C -0.159 -7.779 -5.903 1.00 . A A . 3 DTR CD1 1 1
11 1211 1 1 3 DTR CD2 C 1.809 -7.265 -6.860 1.00 . A A . 3 DTR CD2 1 1
11 1212 1 1 3 DTR CE2 C 2.056 -8.345 -5.980 1.00 . A A . 3 DTR CE2 1 1
11 1213 1 1 3 DTR CE3 C 2.891 -6.749 -7.592 1.00 . A A . 3 DTR CE3 1 1
11 1214 1 1 3 DTR CG C 0.395 -6.925 -6.794 1.00 . A A . 3 DTR CG 1 1
11 1215 1 1 3 DTR CH2 C 4.395 -8.362 -6.565 1.00 . A A . 3 DTR CH2 1 1
11 1216 1 1 3 DTR CZ2 C 3.334 -8.889 -5.830 1.00 . A A . 3 DTR CZ2 1 1
11 1217 1 1 3 DTR CZ3 C 4.176 -7.296 -7.443 1.00 . A A . 3 DTR CZ3 1 1
11 1218 1 1 3 DTR H H 0.602 -5.603 -5.213 1.00 . A A . 3 DTR H 1 1
11 1219 1 1 3 DTR HA H -0.950 -3.924 -6.846 1.00 . A A . 3 DTR HA 1 1
11 1220 1 1 3 DTR HB2 H -0.028 -5.847 -8.566 1.00 . A A . 3 DTR HB2 1 1
11 1221 1 1 3 DTR HB3 H -1.406 -6.051 -7.484 1.00 . A A . 3 DTR HB3 1 1
11 1222 1 1 3 DTR HD1 H -1.198 -7.797 -5.615 1.00 . A A . 3 DTR HD1 1 1
11 1223 1 1 3 DTR HE1 H 0.687 -9.335 -4.762 1.00 . A A . 3 DTR HE1 1 1
11 1224 1 1 3 DTR HE3 H 2.734 -5.926 -8.273 1.00 . A A . 3 DTR HE3 1 1
11 1225 1 1 3 DTR HH2 H 5.387 -8.775 -6.456 1.00 . A A . 3 DTR HH2 1 1
11 1226 1 1 3 DTR HZ2 H 3.500 -9.710 -5.152 1.00 . A A . 3 DTR HZ2 1 1
11 1227 1 1 3 DTR HZ3 H 4.997 -6.893 -8.006 1.00 . A A . 3 DTR HZ3 1 1
11 1228 1 1 3 DTR N N 0.463 -4.696 -5.544 1.00 . A A . 3 DTR N 1 1
11 1229 1 1 3 DTR NE1 N 0.826 -8.623 -5.421 1.00 . A A . 3 DTR NE1 1 1
11 1230 1 1 3 DTR O O 0.765 -3.479 -8.915 1.00 . A A . 3 DTR O 1 1
11 1231 1 1 4 THR C C 4.535 -2.999 -7.080 1.00 . A A . 4 THR C 1 1
11 1232 1 1 4 THR CA C 3.205 -2.747 -7.809 1.00 . A A . 4 THR CA 1 1
11 1233 1 1 4 THR CB C 2.918 -1.243 -7.839 1.00 . A A . 4 THR CB 1 1
11 1234 1 1 4 THR CG2 C 2.323 -0.801 -6.502 1.00 . A A . 4 THR CG2 1 1
11 1235 1 1 4 THR H H 2.247 -3.704 -6.184 1.00 . A A . 4 THR H 1 1
11 1236 1 1 4 THR HA H 3.258 -3.105 -8.822 1.00 . A A . 4 THR HA 1 1
11 1237 1 1 4 THR HB H 2.217 -1.029 -8.630 1.00 . A A . 4 THR HB 1 1
11 1238 1 1 4 THR HG1 H 4.720 -1.122 -8.559 1.00 . A A . 4 THR HG1 1 1
11 1239 1 1 4 THR HG21 H 1.245 -0.785 -6.576 1.00 . A A . 4 THR HG21 1 1
11 1240 1 1 4 THR HG22 H 2.681 0.188 -6.259 1.00 . A A . 4 THR HG22 1 1
11 1241 1 1 4 THR HG23 H 2.620 -1.492 -5.728 1.00 . A A . 4 THR HG23 1 1
11 1242 1 1 4 THR N N 2.127 -3.448 -7.121 1.00 . A A . 4 THR N 1 1
11 1243 1 1 4 THR O O 4.688 -2.590 -5.929 1.00 . A A . 4 THR O 1 1
11 1244 1 1 4 THR OG1 O 4.129 -0.539 -8.078 1.00 . A A . 4 THR OG1 1 1
11 1245 1 1 5 PRO C C 7.734 -2.744 -7.030 1.00 . A A . 5 PRO C 1 1
11 1246 1 1 5 PRO CA C 6.798 -3.951 -7.026 1.00 . A A . 5 PRO CA 1 1
11 1247 1 1 5 PRO CB C 7.381 -5.095 -7.851 1.00 . A A . 5 PRO CB 1 1
11 1248 1 1 5 PRO CD C 5.463 -4.213 -9.062 1.00 . A A . 5 PRO CD 1 1
11 1249 1 1 5 PRO CG C 6.808 -4.929 -9.220 1.00 . A A . 5 PRO CG 1 1
11 1250 1 1 5 PRO HA H 6.632 -4.289 -6.015 1.00 . A A . 5 PRO HA 1 1
11 1251 1 1 5 PRO HB2 H 8.459 -5.019 -7.881 1.00 . A A . 5 PRO HB2 1 1
11 1252 1 1 5 PRO HB3 H 7.082 -6.047 -7.437 1.00 . A A . 5 PRO HB3 1 1
11 1253 1 1 5 PRO HD2 H 5.373 -3.416 -9.789 1.00 . A A . 5 PRO HD2 1 1
11 1254 1 1 5 PRO HD3 H 4.651 -4.913 -9.165 1.00 . A A . 5 PRO HD3 1 1
11 1255 1 1 5 PRO HG2 H 7.477 -4.334 -9.828 1.00 . A A . 5 PRO HG2 1 1
11 1256 1 1 5 PRO HG3 H 6.653 -5.894 -9.676 1.00 . A A . 5 PRO HG3 1 1
11 1257 1 1 5 PRO N N 5.495 -3.666 -7.691 1.00 . A A . 5 PRO N 1 1
11 1258 1 1 5 PRO O O 8.939 -2.882 -6.818 1.00 . A A . 5 PRO O 1 1
11 1259 1 1 6 VAL C C 7.937 0.353 -5.939 1.00 . A A . 6 VAL C 1 1
11 1260 1 1 6 VAL CA C 7.974 -0.343 -7.297 1.00 . A A . 6 VAL CA 1 1
11 1261 1 1 6 VAL CB C 7.452 0.604 -8.381 1.00 . A A . 6 VAL CB 1 1
11 1262 1 1 6 VAL CG1 C 6.357 1.508 -7.804 1.00 . A A . 6 VAL CG1 1 1
11 1263 1 1 6 VAL CG2 C 8.604 1.470 -8.896 1.00 . A A . 6 VAL CG2 1 1
11 1264 1 1 6 VAL H H 6.210 -1.512 -7.432 1.00 . A A . 6 VAL H 1 1
11 1265 1 1 6 VAL HA H 8.997 -0.603 -7.527 1.00 . A A . 6 VAL HA 1 1
11 1266 1 1 6 VAL HB H 7.044 0.025 -9.197 1.00 . A A . 6 VAL HB 1 1
11 1267 1 1 6 VAL HG11 H 5.774 1.924 -8.612 1.00 . A A . 6 VAL HG11 1 1
11 1268 1 1 6 VAL HG12 H 6.812 2.309 -7.240 1.00 . A A . 6 VAL HG12 1 1
11 1269 1 1 6 VAL HG13 H 5.714 0.930 -7.157 1.00 . A A . 6 VAL HG13 1 1
11 1270 1 1 6 VAL HG21 H 9.202 1.805 -8.062 1.00 . A A . 6 VAL HG21 1 1
11 1271 1 1 6 VAL HG22 H 8.205 2.326 -9.420 1.00 . A A . 6 VAL HG22 1 1
11 1272 1 1 6 VAL HG23 H 9.217 0.889 -9.569 1.00 . A A . 6 VAL HG23 1 1
11 1273 1 1 6 VAL N N 7.174 -1.563 -7.270 1.00 . A A . 6 VAL N 1 1
11 1274 1 1 6 VAL O O 8.864 1.078 -5.578 1.00 . A A . 6 VAL O 1 1
11 1275 1 1 7 CYS C C 6.980 -0.285 -2.779 1.00 . A A . 7 CYS C 1 1
11 1276 1 1 7 CYS CA C 6.709 0.737 -3.878 1.00 . A A . 7 CYS CA 1 1
11 1277 1 1 7 CYS CB C 5.293 1.296 -3.720 1.00 . A A . 7 CYS CB 1 1
11 1278 1 1 7 CYS H H 6.152 -0.459 -5.536 1.00 . A A . 7 CYS H 1 1
11 1279 1 1 7 CYS HA H 7.415 1.549 -3.784 1.00 . A A . 7 CYS HA 1 1
11 1280 1 1 7 CYS HB2 H 5.345 2.339 -3.443 1.00 . A A . 7 CYS HB2 1 1
11 1281 1 1 7 CYS HB3 H 4.761 1.197 -4.655 1.00 . A A . 7 CYS HB3 1 1
11 1282 1 1 7 CYS N N 6.859 0.128 -5.194 1.00 . A A . 7 CYS N 1 1
11 1283 1 1 7 CYS O O 6.798 -1.485 -2.983 1.00 . A A . 7 CYS O 1 1
11 1284 1 1 7 CYS SG S 4.420 0.373 -2.430 1.00 . A A . 7 CYS SG 1 1
11 1285 1 1 8 NH2 HN1 H 7.555 1.078 -1.453 1.00 . A A . 8 NH2 HN1 1 1
11 1286 1 1 8 NH2 HN2 H 7.587 -0.527 -0.904 1.00 . A A . 8 NH2 HN2 1 1
11 1287 1 1 8 NH2 N N 7.409 0.122 -1.616 1.00 . A A . 8 NH2 N 1 1
12 1288 1 1 1 CYS C C 2.083 -2.068 -2.312 1.00 . A A . 1 CYS C 1 1
12 1289 1 1 1 CYS CA C 1.843 -1.005 -1.246 1.00 . A A . 1 CYS CA 1 1
12 1290 1 1 1 CYS CB C 1.351 0.287 -1.899 1.00 . A A . 1 CYS CB 1 1
12 1291 1 1 1 CYS H1 H 3.479 -1.624 -0.115 1.00 . A A . 1 CYS H1 1 1
12 1292 1 1 1 CYS H2 H 2.940 -0.054 0.247 1.00 . A A . 1 CYS H2 1 1
12 1293 1 1 1 CYS H3 H 3.817 -0.346 -1.178 1.00 . A A . 1 CYS H3 1 1
12 1294 1 1 1 CYS HA H 1.100 -1.360 -0.547 1.00 . A A . 1 CYS HA 1 1
12 1295 1 1 1 CYS HB2 H 0.813 0.050 -2.805 1.00 . A A . 1 CYS HB2 1 1
12 1296 1 1 1 CYS HB3 H 0.695 0.808 -1.217 1.00 . A A . 1 CYS HB3 1 1
12 1297 1 1 1 CYS N N 3.115 -0.737 -0.518 1.00 . A A . 1 CYS N 1 1
12 1298 1 1 1 CYS O O 3.084 -2.028 -3.027 1.00 . A A . 1 CYS O 1 1
12 1299 1 1 1 CYS SG S 2.768 1.341 -2.297 1.00 . A A . 1 CYS SG 1 1
12 1300 1 1 2 ARG C C 0.804 -3.619 -4.762 1.00 . A A . 2 ARG C 1 1
12 1301 1 1 2 ARG CA C 1.279 -4.085 -3.393 1.00 . A A . 2 ARG CA 1 1
12 1302 1 1 2 ARG CB C 0.460 -5.290 -2.950 1.00 . A A . 2 ARG CB 1 1
12 1303 1 1 2 ARG CD C 2.115 -7.114 -2.485 1.00 . A A . 2 ARG CD 1 1
12 1304 1 1 2 ARG CG C 1.102 -6.567 -3.492 1.00 . A A . 2 ARG CG 1 1
12 1305 1 1 2 ARG CZ C 2.017 -8.341 -0.392 1.00 . A A . 2 ARG CZ 1 1
12 1306 1 1 2 ARG H H 0.382 -3.000 -1.816 1.00 . A A . 2 ARG H 1 1
12 1307 1 1 2 ARG HA H 2.311 -4.380 -3.469 1.00 . A A . 2 ARG HA 1 1
12 1308 1 1 2 ARG HB2 H 0.430 -5.328 -1.871 1.00 . A A . 2 ARG HB2 1 1
12 1309 1 1 2 ARG HB3 H -0.544 -5.204 -3.336 1.00 . A A . 2 ARG HB3 1 1
12 1310 1 1 2 ARG HD2 H 2.896 -7.639 -3.017 1.00 . A A . 2 ARG HD2 1 1
12 1311 1 1 2 ARG HD3 H 2.552 -6.294 -1.933 1.00 . A A . 2 ARG HD3 1 1
12 1312 1 1 2 ARG HE H 0.600 -8.430 -1.802 1.00 . A A . 2 ARG HE 1 1
12 1313 1 1 2 ARG HG2 H 0.333 -7.295 -3.661 1.00 . A A . 2 ARG HG2 1 1
12 1314 1 1 2 ARG HG3 H 1.607 -6.360 -4.422 1.00 . A A . 2 ARG HG3 1 1
12 1315 1 1 2 ARG HH11 H 0.535 -9.566 0.163 1.00 . A A . 2 ARG HH11 1 1
12 1316 1 1 2 ARG HH12 H 1.832 -9.398 1.299 1.00 . A A . 2 ARG HH12 1 1
12 1317 1 1 2 ARG HH21 H 3.627 -7.187 -0.677 1.00 . A A . 2 ARG HH21 1 1
12 1318 1 1 2 ARG HH22 H 3.583 -8.051 0.823 1.00 . A A . 2 ARG HH22 1 1
12 1319 1 1 2 ARG N N 1.158 -3.017 -2.413 1.00 . A A . 2 ARG N 1 1
12 1320 1 1 2 ARG NE N 1.462 -8.034 -1.559 1.00 . A A . 2 ARG NE 1 1
12 1321 1 1 2 ARG NH1 N 1.415 -9.166 0.420 1.00 . A A . 2 ARG NH1 1 1
12 1322 1 1 2 ARG NH2 N 3.166 -7.819 -0.056 1.00 . A A . 2 ARG NH2 1 1
12 1323 1 1 2 ARG O O 0.801 -2.425 -5.060 1.00 . A A . 2 ARG O 1 1
12 1324 1 1 3 DTR C C 1.015 -3.506 -7.710 1.00 . A A . 3 DTR C 1 1
12 1325 1 1 3 DTR CA C -0.060 -4.267 -6.935 1.00 . A A . 3 DTR CA 1 1
12 1326 1 1 3 DTR CB C -0.410 -5.561 -7.673 1.00 . A A . 3 DTR CB 1 1
12 1327 1 1 3 DTR CD1 C -0.345 -7.584 -6.157 1.00 . A A . 3 DTR CD1 1 1
12 1328 1 1 3 DTR CD2 C 1.655 -7.125 -7.075 1.00 . A A . 3 DTR CD2 1 1
12 1329 1 1 3 DTR CE2 C 1.837 -8.266 -6.259 1.00 . A A . 3 DTR CE2 1 1
12 1330 1 1 3 DTR CE3 C 2.765 -6.624 -7.771 1.00 . A A . 3 DTR CE3 1 1
12 1331 1 1 3 DTR CG C 0.262 -6.711 -6.993 1.00 . A A . 3 DTR CG 1 1
12 1332 1 1 3 DTR CH2 C 4.175 -8.375 -6.839 1.00 . A A . 3 DTR CH2 1 1
12 1333 1 1 3 DTR CZ2 C 3.082 -8.887 -6.139 1.00 . A A . 3 DTR CZ2 1 1
12 1334 1 1 3 DTR CZ3 C 4.017 -7.248 -7.653 1.00 . A A . 3 DTR CZ3 1 1
12 1335 1 1 3 DTR H H 0.439 -5.506 -5.300 1.00 . A A . 3 DTR H 1 1
12 1336 1 1 3 DTR HA H -0.945 -3.657 -6.861 1.00 . A A . 3 DTR HA 1 1
12 1337 1 1 3 DTR HB2 H -0.067 -5.498 -8.695 1.00 . A A . 3 DTR HB2 1 1
12 1338 1 1 3 DTR HB3 H -1.480 -5.707 -7.657 1.00 . A A . 3 DTR HB3 1 1
12 1339 1 1 3 DTR HD1 H -1.387 -7.562 -5.874 1.00 . A A . 3 DTR HD1 1 1
12 1340 1 1 3 DTR HE1 H 0.407 -9.247 -5.104 1.00 . A A . 3 DTR HE1 1 1
12 1341 1 1 3 DTR HE3 H 2.654 -5.756 -8.403 1.00 . A A . 3 DTR HE3 1 1
12 1342 1 1 3 DTR HH2 H 5.142 -8.847 -6.752 1.00 . A A . 3 DTR HH2 1 1
12 1343 1 1 3 DTR HZ2 H 3.199 -9.754 -5.509 1.00 . A A . 3 DTR HZ2 1 1
12 1344 1 1 3 DTR HZ3 H 4.861 -6.857 -8.191 1.00 . A A . 3 DTR HZ3 1 1
12 1345 1 1 3 DTR N N 0.409 -4.575 -5.593 1.00 . A A . 3 DTR N 1 1
12 1346 1 1 3 DTR NE1 N 0.589 -8.508 -5.720 1.00 . A A . 3 DTR NE1 1 1
12 1347 1 1 3 DTR O O 0.800 -3.092 -8.849 1.00 . A A . 3 DTR O 1 1
12 1348 1 1 4 THR C C 4.598 -3.009 -6.984 1.00 . A A . 4 THR C 1 1
12 1349 1 1 4 THR CA C 3.290 -2.623 -7.693 1.00 . A A . 4 THR CA 1 1
12 1350 1 1 4 THR CB C 3.086 -1.108 -7.563 1.00 . A A . 4 THR CB 1 1
12 1351 1 1 4 THR CG2 C 1.914 -0.652 -8.440 1.00 . A A . 4 THR CG2 1 1
12 1352 1 1 4 THR H H 2.279 -3.689 -6.171 1.00 . A A . 4 THR H 1 1
12 1353 1 1 4 THR HA H 3.337 -2.881 -8.735 1.00 . A A . 4 THR HA 1 1
12 1354 1 1 4 THR HB H 3.982 -0.597 -7.879 1.00 . A A . 4 THR HB 1 1
12 1355 1 1 4 THR HG1 H 2.410 -1.555 -5.796 1.00 . A A . 4 THR HG1 1 1
12 1356 1 1 4 THR HG21 H 1.959 0.420 -8.566 1.00 . A A . 4 THR HG21 1 1
12 1357 1 1 4 THR HG22 H 0.982 -0.916 -7.963 1.00 . A A . 4 THR HG22 1 1
12 1358 1 1 4 THR HG23 H 1.973 -1.130 -9.406 1.00 . A A . 4 THR HG23 1 1
12 1359 1 1 4 THR N N 2.172 -3.331 -7.076 1.00 . A A . 4 THR N 1 1
12 1360 1 1 4 THR O O 4.769 -2.691 -5.807 1.00 . A A . 4 THR O 1 1
12 1361 1 1 4 THR OG1 O 2.812 -0.786 -6.207 1.00 . A A . 4 THR OG1 1 1
12 1362 1 1 5 PRO C C 7.800 -2.932 -6.919 1.00 . A A . 5 PRO C 1 1
12 1363 1 1 5 PRO CA C 6.804 -4.087 -6.996 1.00 . A A . 5 PRO CA 1 1
12 1364 1 1 5 PRO CB C 7.328 -5.202 -7.898 1.00 . A A . 5 PRO CB 1 1
12 1365 1 1 5 PRO CD C 5.467 -4.131 -9.047 1.00 . A A . 5 PRO CD 1 1
12 1366 1 1 5 PRO CG C 6.767 -4.915 -9.252 1.00 . A A . 5 PRO CG 1 1
12 1367 1 1 5 PRO HA H 6.615 -4.482 -6.011 1.00 . A A . 5 PRO HA 1 1
12 1368 1 1 5 PRO HB2 H 8.409 -5.181 -7.926 1.00 . A A . 5 PRO HB2 1 1
12 1369 1 1 5 PRO HB3 H 6.980 -6.163 -7.548 1.00 . A A . 5 PRO HB3 1 1
12 1370 1 1 5 PRO HD2 H 5.431 -3.281 -9.716 1.00 . A A . 5 PRO HD2 1 1
12 1371 1 1 5 PRO HD3 H 4.613 -4.770 -9.201 1.00 . A A . 5 PRO HD3 1 1
12 1372 1 1 5 PRO HG2 H 7.471 -4.326 -9.824 1.00 . A A . 5 PRO HG2 1 1
12 1373 1 1 5 PRO HG3 H 6.553 -5.839 -9.767 1.00 . A A . 5 PRO HG3 1 1
12 1374 1 1 5 PRO N N 5.524 -3.683 -7.642 1.00 . A A . 5 PRO N 1 1
12 1375 1 1 5 PRO O O 8.977 -3.134 -6.623 1.00 . A A . 5 PRO O 1 1
12 1376 1 1 6 VAL C C 7.889 0.279 -5.887 1.00 . A A . 6 VAL C 1 1
12 1377 1 1 6 VAL CA C 8.170 -0.539 -7.144 1.00 . A A . 6 VAL CA 1 1
12 1378 1 1 6 VAL CB C 7.928 0.324 -8.383 1.00 . A A . 6 VAL CB 1 1
12 1379 1 1 6 VAL CG1 C 6.423 0.481 -8.611 1.00 . A A . 6 VAL CG1 1 1
12 1380 1 1 6 VAL CG2 C 8.557 1.704 -8.172 1.00 . A A . 6 VAL CG2 1 1
12 1381 1 1 6 VAL H H 6.369 -1.622 -7.416 1.00 . A A . 6 VAL H 1 1
12 1382 1 1 6 VAL HA H 9.203 -0.852 -7.135 1.00 . A A . 6 VAL HA 1 1
12 1383 1 1 6 VAL HB H 8.375 -0.149 -9.245 1.00 . A A . 6 VAL HB 1 1
12 1384 1 1 6 VAL HG11 H 6.026 -0.433 -9.025 1.00 . A A . 6 VAL HG11 1 1
12 1385 1 1 6 VAL HG12 H 6.247 1.295 -9.299 1.00 . A A . 6 VAL HG12 1 1
12 1386 1 1 6 VAL HG13 H 5.937 0.693 -7.671 1.00 . A A . 6 VAL HG13 1 1
12 1387 1 1 6 VAL HG21 H 7.842 2.355 -7.689 1.00 . A A . 6 VAL HG21 1 1
12 1388 1 1 6 VAL HG22 H 8.837 2.121 -9.126 1.00 . A A . 6 VAL HG22 1 1
12 1389 1 1 6 VAL HG23 H 9.434 1.608 -7.548 1.00 . A A . 6 VAL HG23 1 1
12 1390 1 1 6 VAL N N 7.317 -1.721 -7.186 1.00 . A A . 6 VAL N 1 1
12 1391 1 1 6 VAL O O 8.778 0.948 -5.360 1.00 . A A . 6 VAL O 1 1
12 1392 1 1 7 CYS C C 6.199 0.030 -3.011 1.00 . A A . 7 CYS C 1 1
12 1393 1 1 7 CYS CA C 6.262 0.960 -4.218 1.00 . A A . 7 CYS CA 1 1
12 1394 1 1 7 CYS CB C 4.897 1.618 -4.429 1.00 . A A . 7 CYS CB 1 1
12 1395 1 1 7 CYS H H 5.983 -0.331 -5.876 1.00 . A A . 7 CYS H 1 1
12 1396 1 1 7 CYS HA H 6.994 1.730 -4.029 1.00 . A A . 7 CYS HA 1 1
12 1397 1 1 7 CYS HB2 H 4.835 2.518 -3.836 1.00 . A A . 7 CYS HB2 1 1
12 1398 1 1 7 CYS HB3 H 4.775 1.865 -5.474 1.00 . A A . 7 CYS HB3 1 1
12 1399 1 1 7 CYS N N 6.649 0.220 -5.413 1.00 . A A . 7 CYS N 1 1
12 1400 1 1 7 CYS O O 5.847 -1.142 -3.141 1.00 . A A . 7 CYS O 1 1
12 1401 1 1 7 CYS SG S 3.590 0.472 -3.925 1.00 . A A . 7 CYS SG 1 1
12 1402 1 1 8 NH2 HN1 H 6.802 1.421 -1.727 1.00 . A A . 8 NH2 HN1 1 1
12 1403 1 1 8 NH2 HN2 H 6.485 -0.103 -1.050 1.00 . A A . 8 NH2 HN2 1 1
12 1404 1 1 8 NH2 N N 6.522 0.487 -1.832 1.00 . A A . 8 NH2 N 1 1
13 1405 1 1 1 CYS C C 2.027 -1.889 -2.448 1.00 . A A . 1 CYS C 1 1
13 1406 1 1 1 CYS CA C 1.752 -0.754 -1.467 1.00 . A A . 1 CYS CA 1 1
13 1407 1 1 1 CYS CB C 1.369 0.513 -2.234 1.00 . A A . 1 CYS CB 1 1
13 1408 1 1 1 CYS H1 H 2.856 0.391 -0.124 1.00 . A A . 1 CYS H1 1 1
13 1409 1 1 1 CYS H2 H 3.798 -0.406 -1.293 1.00 . A A . 1 CYS H2 1 1
13 1410 1 1 1 CYS H3 H 3.129 -1.278 0.004 1.00 . A A . 1 CYS H3 1 1
13 1411 1 1 1 CYS HA H 0.942 -1.035 -0.811 1.00 . A A . 1 CYS HA 1 1
13 1412 1 1 1 CYS HB2 H 1.004 0.243 -3.214 1.00 . A A . 1 CYS HB2 1 1
13 1413 1 1 1 CYS HB3 H 0.596 1.039 -1.694 1.00 . A A . 1 CYS HB3 1 1
13 1414 1 1 1 CYS N N 2.976 -0.492 -0.659 1.00 . A A . 1 CYS N 1 1
13 1415 1 1 1 CYS O O 3.033 -1.881 -3.156 1.00 . A A . 1 CYS O 1 1
13 1416 1 1 1 CYS SG S 2.822 1.579 -2.403 1.00 . A A . 1 CYS SG 1 1
13 1417 1 1 2 ARG C C 0.743 -3.676 -4.764 1.00 . A A . 2 ARG C 1 1
13 1418 1 1 2 ARG CA C 1.283 -4.002 -3.377 1.00 . A A . 2 ARG CA 1 1
13 1419 1 1 2 ARG CB C 0.547 -5.212 -2.812 1.00 . A A . 2 ARG CB 1 1
13 1420 1 1 2 ARG CD C 2.278 -6.922 -2.205 1.00 . A A . 2 ARG CD 1 1
13 1421 1 1 2 ARG CG C 1.251 -6.495 -3.257 1.00 . A A . 2 ARG CG 1 1
13 1422 1 1 2 ARG CZ C 2.200 -7.933 0.001 1.00 . A A . 2 ARG CZ 1 1
13 1423 1 1 2 ARG H H 0.344 -2.823 -1.895 1.00 . A A . 2 ARG H 1 1
13 1424 1 1 2 ARG HA H 2.329 -4.242 -3.460 1.00 . A A . 2 ARG HA 1 1
13 1425 1 1 2 ARG HB2 H 0.539 -5.157 -1.733 1.00 . A A . 2 ARG HB2 1 1
13 1426 1 1 2 ARG HB3 H -0.469 -5.218 -3.179 1.00 . A A . 2 ARG HB3 1 1
13 1427 1 1 2 ARG HD2 H 3.072 -7.472 -2.689 1.00 . A A . 2 ARG HD2 1 1
13 1428 1 1 2 ARG HD3 H 2.694 -6.043 -1.732 1.00 . A A . 2 ARG HD3 1 1
13 1429 1 1 2 ARG HE H 0.807 -8.222 -1.407 1.00 . A A . 2 ARG HE 1 1
13 1430 1 1 2 ARG HG2 H 0.516 -7.268 -3.377 1.00 . A A . 2 ARG HG2 1 1
13 1431 1 1 2 ARG HG3 H 1.755 -6.336 -4.196 1.00 . A A . 2 ARG HG3 1 1
13 1432 1 1 2 ARG HH11 H 0.758 -9.154 0.663 1.00 . A A . 2 ARG HH11 1 1
13 1433 1 1 2 ARG HH12 H 2.031 -8.821 1.788 1.00 . A A . 2 ARG HH12 1 1
13 1434 1 1 2 ARG HH21 H 3.768 -6.751 -0.386 1.00 . A A . 2 ARG HH21 1 1
13 1435 1 1 2 ARG HH22 H 3.735 -7.460 1.194 1.00 . A A . 2 ARG HH22 1 1
13 1436 1 1 2 ARG N N 1.126 -2.866 -2.482 1.00 . A A . 2 ARG N 1 1
13 1437 1 1 2 ARG NE N 1.649 -7.768 -1.198 1.00 . A A . 2 ARG NE 1 1
13 1438 1 1 2 ARG NH1 N 1.618 -8.696 0.886 1.00 . A A . 2 ARG NH1 1 1
13 1439 1 1 2 ARG NH2 N 3.321 -7.335 0.293 1.00 . A A . 2 ARG NH2 1 1
13 1440 1 1 2 ARG O O 0.585 -2.511 -5.124 1.00 . A A . 2 ARG O 1 1
13 1441 1 1 3 DTR C C 0.972 -3.802 -7.745 1.00 . A A . 3 DTR C 1 1
13 1442 1 1 3 DTR CA C -0.047 -4.546 -6.887 1.00 . A A . 3 DTR CA 1 1
13 1443 1 1 3 DTR CB C -0.331 -5.917 -7.506 1.00 . A A . 3 DTR CB 1 1
13 1444 1 1 3 DTR CD1 C -0.138 -7.809 -5.840 1.00 . A A . 3 DTR CD1 1 1
13 1445 1 1 3 DTR CD2 C 1.834 -7.284 -6.782 1.00 . A A . 3 DTR CD2 1 1
13 1446 1 1 3 DTR CE2 C 2.087 -8.343 -5.879 1.00 . A A . 3 DTR CE2 1 1
13 1447 1 1 3 DTR CE3 C 2.919 -6.764 -7.508 1.00 . A A . 3 DTR CE3 1 1
13 1448 1 1 3 DTR CG C 0.415 -6.964 -6.740 1.00 . A A . 3 DTR CG 1 1
13 1449 1 1 3 DTR CH2 C 4.433 -8.337 -6.434 1.00 . A A . 3 DTR CH2 1 1
13 1450 1 1 3 DTR CZ2 C 3.369 -8.866 -5.703 1.00 . A A . 3 DTR CZ2 1 1
13 1451 1 1 3 DTR CZ3 C 4.209 -7.289 -7.333 1.00 . A A . 3 DTR CZ3 1 1
13 1452 1 1 3 DTR H H 0.612 -5.618 -5.194 1.00 . A A . 3 DTR H 1 1
13 1453 1 1 3 DTR HA H -0.964 -3.982 -6.846 1.00 . A A . 3 DTR HA 1 1
13 1454 1 1 3 DTR HB2 H -0.006 -5.924 -8.535 1.00 . A A . 3 DTR HB2 1 1
13 1455 1 1 3 DTR HB3 H -1.391 -6.121 -7.460 1.00 . A A . 3 DTR HB3 1 1
13 1456 1 1 3 DTR HD1 H -1.181 -7.838 -5.564 1.00 . A A . 3 DTR HD1 1 1
13 1457 1 1 3 DTR HE1 H 0.716 -9.331 -4.660 1.00 . A A . 3 DTR HE1 1 1
13 1458 1 1 3 DTR HE3 H 2.759 -5.955 -8.207 1.00 . A A . 3 DTR HE3 1 1
13 1459 1 1 3 DTR HH2 H 5.429 -8.733 -6.305 1.00 . A A . 3 DTR HH2 1 1
13 1460 1 1 3 DTR HZ2 H 3.540 -9.672 -5.009 1.00 . A A . 3 DTR HZ2 1 1
13 1461 1 1 3 DTR HZ3 H 5.032 -6.886 -7.893 1.00 . A A . 3 DTR HZ3 1 1
13 1462 1 1 3 DTR N N 0.466 -4.718 -5.537 1.00 . A A . 3 DTR N 1 1
13 1463 1 1 3 DTR NE1 N 0.853 -8.629 -5.329 1.00 . A A . 3 DTR NE1 1 1
13 1464 1 1 3 DTR O O 0.736 -3.535 -8.924 1.00 . A A . 3 DTR O 1 1
13 1465 1 1 4 THR C C 4.509 -2.993 -7.090 1.00 . A A . 4 THR C 1 1
13 1466 1 1 4 THR CA C 3.182 -2.779 -7.837 1.00 . A A . 4 THR CA 1 1
13 1467 1 1 4 THR CB C 2.872 -1.282 -7.909 1.00 . A A . 4 THR CB 1 1
13 1468 1 1 4 THR CG2 C 2.252 -0.813 -6.593 1.00 . A A . 4 THR CG2 1 1
13 1469 1 1 4 THR H H 2.238 -3.732 -6.200 1.00 . A A . 4 THR H 1 1
13 1470 1 1 4 THR HA H 3.248 -3.164 -8.839 1.00 . A A . 4 THR HA 1 1
13 1471 1 1 4 THR HB H 2.178 -1.099 -8.715 1.00 . A A . 4 THR HB 1 1
13 1472 1 1 4 THR HG1 H 4.746 -0.904 -7.554 1.00 . A A . 4 THR HG1 1 1
13 1473 1 1 4 THR HG21 H 1.176 -0.841 -6.671 1.00 . A A . 4 THR HG21 1 1
13 1474 1 1 4 THR HG22 H 2.571 0.199 -6.385 1.00 . A A . 4 THR HG22 1 1
13 1475 1 1 4 THR HG23 H 2.573 -1.461 -5.792 1.00 . A A . 4 THR HG23 1 1
13 1476 1 1 4 THR N N 2.111 -3.481 -7.138 1.00 . A A . 4 THR N 1 1
13 1477 1 1 4 THR O O 4.645 -2.552 -5.950 1.00 . A A . 4 THR O 1 1
13 1478 1 1 4 THR OG1 O 4.075 -0.565 -8.149 1.00 . A A . 4 THR OG1 1 1
13 1479 1 1 5 PRO C C 7.696 -2.686 -7.010 1.00 . A A . 5 PRO C 1 1
13 1480 1 1 5 PRO CA C 6.784 -3.910 -6.992 1.00 . A A . 5 PRO CA 1 1
13 1481 1 1 5 PRO CB C 7.396 -5.060 -7.786 1.00 . A A . 5 PRO CB 1 1
13 1482 1 1 5 PRO CD C 5.472 -4.242 -9.034 1.00 . A A . 5 PRO CD 1 1
13 1483 1 1 5 PRO CG C 6.831 -4.937 -9.163 1.00 . A A . 5 PRO CG 1 1
13 1484 1 1 5 PRO HA H 6.612 -4.229 -5.977 1.00 . A A . 5 PRO HA 1 1
13 1485 1 1 5 PRO HB2 H 8.472 -4.963 -7.810 1.00 . A A . 5 PRO HB2 1 1
13 1486 1 1 5 PRO HB3 H 7.112 -6.008 -7.353 1.00 . A A . 5 PRO HB3 1 1
13 1487 1 1 5 PRO HD2 H 5.375 -3.463 -9.779 1.00 . A A . 5 PRO HD2 1 1
13 1488 1 1 5 PRO HD3 H 4.673 -4.958 -9.127 1.00 . A A . 5 PRO HD3 1 1
13 1489 1 1 5 PRO HG2 H 7.495 -4.345 -9.781 1.00 . A A . 5 PRO HG2 1 1
13 1490 1 1 5 PRO HG3 H 6.697 -5.915 -9.598 1.00 . A A . 5 PRO HG3 1 1
13 1491 1 1 5 PRO N N 5.484 -3.660 -7.677 1.00 . A A . 5 PRO N 1 1
13 1492 1 1 5 PRO O O 8.905 -2.798 -6.809 1.00 . A A . 5 PRO O 1 1
13 1493 1 1 6 VAL C C 7.862 0.406 -5.929 1.00 . A A . 6 VAL C 1 1
13 1494 1 1 6 VAL CA C 7.879 -0.281 -7.292 1.00 . A A . 6 VAL CA 1 1
13 1495 1 1 6 VAL CB C 7.304 0.660 -8.353 1.00 . A A . 6 VAL CB 1 1
13 1496 1 1 6 VAL CG1 C 6.182 1.507 -7.742 1.00 . A A . 6 VAL CG1 1 1
13 1497 1 1 6 VAL CG2 C 8.411 1.581 -8.869 1.00 . A A . 6 VAL CG2 1 1
13 1498 1 1 6 VAL H H 6.141 -1.490 -7.405 1.00 . A A . 6 VAL H 1 1
13 1499 1 1 6 VAL HA H 8.901 -0.514 -7.551 1.00 . A A . 6 VAL HA 1 1
13 1500 1 1 6 VAL HB H 6.908 0.078 -9.173 1.00 . A A . 6 VAL HB 1 1
13 1501 1 1 6 VAL HG11 H 5.583 0.893 -7.086 1.00 . A A . 6 VAL HG11 1 1
13 1502 1 1 6 VAL HG12 H 5.561 1.901 -8.531 1.00 . A A . 6 VAL HG12 1 1
13 1503 1 1 6 VAL HG13 H 6.613 2.323 -7.180 1.00 . A A . 6 VAL HG13 1 1
13 1504 1 1 6 VAL HG21 H 7.973 2.388 -9.439 1.00 . A A . 6 VAL HG21 1 1
13 1505 1 1 6 VAL HG22 H 9.083 1.019 -9.499 1.00 . A A . 6 VAL HG22 1 1
13 1506 1 1 6 VAL HG23 H 8.959 1.990 -8.031 1.00 . A A . 6 VAL HG23 1 1
13 1507 1 1 6 VAL N N 7.108 -1.519 -7.251 1.00 . A A . 6 VAL N 1 1
13 1508 1 1 6 VAL O O 8.715 1.242 -5.635 1.00 . A A . 6 VAL O 1 1
13 1509 1 1 7 CYS C C 6.595 -0.466 -2.721 1.00 . A A . 7 CYS C 1 1
13 1510 1 1 7 CYS CA C 6.755 0.628 -3.773 1.00 . A A . 7 CYS CA 1 1
13 1511 1 1 7 CYS CB C 5.544 1.562 -3.726 1.00 . A A . 7 CYS CB 1 1
13 1512 1 1 7 CYS H H 6.231 -0.629 -5.397 1.00 . A A . 7 CYS H 1 1
13 1513 1 1 7 CYS HA H 7.644 1.198 -3.551 1.00 . A A . 7 CYS HA 1 1
13 1514 1 1 7 CYS HB2 H 5.600 2.179 -2.840 1.00 . A A . 7 CYS HB2 1 1
13 1515 1 1 7 CYS HB3 H 5.542 2.192 -4.603 1.00 . A A . 7 CYS HB3 1 1
13 1516 1 1 7 CYS N N 6.882 0.044 -5.105 1.00 . A A . 7 CYS N 1 1
13 1517 1 1 7 CYS O O 6.887 -0.250 -1.545 1.00 . A A . 7 CYS O 1 1
13 1518 1 1 7 CYS SG S 4.024 0.580 -3.683 1.00 . A A . 7 CYS SG 1 1
13 1519 1 1 8 NH2 HN1 H 5.913 -1.809 -4.015 1.00 . A A . 8 NH2 HN1 1 1
13 1520 1 1 8 NH2 HN2 H 6.039 -2.347 -2.410 1.00 . A A . 8 NH2 HN2 1 1
13 1521 1 1 8 NH2 N N 6.145 -1.638 -3.078 1.00 . A A . 8 NH2 N 1 1
14 1522 1 1 1 CYS C C 2.048 -1.985 -2.377 1.00 . A A . 1 CYS C 1 1
14 1523 1 1 1 CYS CA C 1.809 -0.910 -1.322 1.00 . A A . 1 CYS CA 1 1
14 1524 1 1 1 CYS CB C 1.542 0.435 -2.000 1.00 . A A . 1 CYS CB 1 1
14 1525 1 1 1 CYS H1 H 2.864 -0.041 0.249 1.00 . A A . 1 CYS H1 1 1
14 1526 1 1 1 CYS H2 H 3.842 -0.565 -1.037 1.00 . A A . 1 CYS H2 1 1
14 1527 1 1 1 CYS H3 H 3.173 -1.696 0.040 1.00 . A A . 1 CYS H3 1 1
14 1528 1 1 1 CYS HA H 0.955 -1.184 -0.718 1.00 . A A . 1 CYS HA 1 1
14 1529 1 1 1 CYS HB2 H 1.419 0.284 -3.062 1.00 . A A . 1 CYS HB2 1 1
14 1530 1 1 1 CYS HB3 H 0.642 0.870 -1.591 1.00 . A A . 1 CYS HB3 1 1
14 1531 1 1 1 CYS N N 3.012 -0.795 -0.451 1.00 . A A . 1 CYS N 1 1
14 1532 1 1 1 CYS O O 3.010 -1.914 -3.140 1.00 . A A . 1 CYS O 1 1
14 1533 1 1 1 CYS SG S 2.940 1.546 -1.705 1.00 . A A . 1 CYS SG 1 1
14 1534 1 1 2 ARG C C 0.767 -3.639 -4.739 1.00 . A A . 2 ARG C 1 1
14 1535 1 1 2 ARG CA C 1.294 -4.063 -3.375 1.00 . A A . 2 ARG CA 1 1
14 1536 1 1 2 ARG CB C 0.524 -5.284 -2.886 1.00 . A A . 2 ARG CB 1 1
14 1537 1 1 2 ARG CD C 2.211 -7.071 -2.393 1.00 . A A . 2 ARG CD 1 1
14 1538 1 1 2 ARG CG C 1.190 -6.557 -3.410 1.00 . A A . 2 ARG CG 1 1
14 1539 1 1 2 ARG CZ C 2.116 -8.220 -0.256 1.00 . A A . 2 ARG CZ 1 1
14 1540 1 1 2 ARG H H 0.421 -2.987 -1.779 1.00 . A A . 2 ARG H 1 1
14 1541 1 1 2 ARG HA H 2.333 -4.329 -3.471 1.00 . A A . 2 ARG HA 1 1
14 1542 1 1 2 ARG HB2 H 0.515 -5.296 -1.805 1.00 . A A . 2 ARG HB2 1 1
14 1543 1 1 2 ARG HB3 H -0.492 -5.237 -3.250 1.00 . A A . 2 ARG HB3 1 1
14 1544 1 1 2 ARG HD2 H 2.991 -7.608 -2.915 1.00 . A A . 2 ARG HD2 1 1
14 1545 1 1 2 ARG HD3 H 2.647 -6.235 -1.867 1.00 . A A . 2 ARG HD3 1 1
14 1546 1 1 2 ARG HE H 0.713 -8.387 -1.674 1.00 . A A . 2 ARG HE 1 1
14 1547 1 1 2 ARG HG2 H 0.435 -7.301 -3.571 1.00 . A A . 2 ARG HG2 1 1
14 1548 1 1 2 ARG HG3 H 1.694 -6.354 -4.342 1.00 . A A . 2 ARG HG3 1 1
14 1549 1 1 2 ARG HH11 H 0.649 -9.448 0.333 1.00 . A A . 2 ARG HH11 1 1
14 1550 1 1 2 ARG HH12 H 1.933 -9.215 1.472 1.00 . A A . 2 ARG HH12 1 1
14 1551 1 1 2 ARG HH21 H 3.710 -7.051 -0.574 1.00 . A A . 2 ARG HH21 1 1
14 1552 1 1 2 ARG HH22 H 3.666 -7.857 0.959 1.00 . A A . 2 ARG HH22 1 1
14 1553 1 1 2 ARG N N 1.167 -2.980 -2.412 1.00 . A A . 2 ARG N 1 1
14 1554 1 1 2 ARG NE N 1.566 -7.966 -1.439 1.00 . A A . 2 ARG NE 1 1
14 1555 1 1 2 ARG NH1 N 1.519 -9.023 0.582 1.00 . A A . 2 ARG NH1 1 1
14 1556 1 1 2 ARG NH2 N 3.253 -7.666 0.068 1.00 . A A . 2 ARG NH2 1 1
14 1557 1 1 2 ARG O O 0.657 -2.450 -5.033 1.00 . A A . 2 ARG O 1 1
14 1558 1 1 3 DTR C C 0.994 -3.611 -7.725 1.00 . A A . 3 DTR C 1 1
14 1559 1 1 3 DTR CA C -0.059 -4.354 -6.906 1.00 . A A . 3 DTR CA 1 1
14 1560 1 1 3 DTR CB C -0.409 -5.672 -7.599 1.00 . A A . 3 DTR CB 1 1
14 1561 1 1 3 DTR CD1 C -0.290 -7.663 -6.047 1.00 . A A . 3 DTR CD1 1 1
14 1562 1 1 3 DTR CD2 C 1.695 -7.182 -6.986 1.00 . A A . 3 DTR CD2 1 1
14 1563 1 1 3 DTR CE2 C 1.904 -8.303 -6.149 1.00 . A A . 3 DTR CE2 1 1
14 1564 1 1 3 DTR CE3 C 2.794 -6.673 -7.698 1.00 . A A . 3 DTR CE3 1 1
14 1565 1 1 3 DTR CG C 0.292 -6.795 -6.905 1.00 . A A . 3 DTR CG 1 1
14 1566 1 1 3 DTR CH2 C 4.241 -8.378 -6.738 1.00 . A A . 3 DTR CH2 1 1
14 1567 1 1 3 DTR CZ2 C 3.162 -8.896 -6.024 1.00 . A A . 3 DTR CZ2 1 1
14 1568 1 1 3 DTR CZ3 C 4.058 -7.270 -7.572 1.00 . A A . 3 DTR CZ3 1 1
14 1569 1 1 3 DTR H H 0.558 -5.547 -5.279 1.00 . A A . 3 DTR H 1 1
14 1570 1 1 3 DTR HA H -0.947 -3.751 -6.828 1.00 . A A . 3 DTR HA 1 1
14 1571 1 1 3 DTR HB2 H -0.094 -5.633 -8.631 1.00 . A A . 3 DTR HB2 1 1
14 1572 1 1 3 DTR HB3 H -1.477 -5.830 -7.554 1.00 . A A . 3 DTR HB3 1 1
14 1573 1 1 3 DTR HD1 H -1.330 -7.658 -5.759 1.00 . A A . 3 DTR HD1 1 1
14 1574 1 1 3 DTR HE1 H 0.501 -9.293 -4.970 1.00 . A A . 3 DTR HE1 1 1
14 1575 1 1 3 DTR HE3 H 2.666 -5.818 -8.346 1.00 . A A . 3 DTR HE3 1 1
14 1576 1 1 3 DTR HH2 H 5.218 -8.829 -6.646 1.00 . A A . 3 DTR HH2 1 1
14 1577 1 1 3 DTR HZ2 H 3.300 -9.749 -5.379 1.00 . A A . 3 DTR HZ2 1 1
14 1578 1 1 3 DTR HZ3 H 4.894 -6.874 -8.120 1.00 . A A . 3 DTR HZ3 1 1
14 1579 1 1 3 DTR N N 0.448 -4.623 -5.570 1.00 . A A . 3 DTR N 1 1
14 1580 1 1 3 DTR NE1 N 0.665 -8.560 -5.600 1.00 . A A . 3 DTR NE1 1 1
14 1581 1 1 3 DTR O O 0.771 -3.274 -8.887 1.00 . A A . 3 DTR O 1 1
14 1582 1 1 4 THR C C 4.565 -3.005 -7.046 1.00 . A A . 4 THR C 1 1
14 1583 1 1 4 THR CA C 3.244 -2.682 -7.766 1.00 . A A . 4 THR CA 1 1
14 1584 1 1 4 THR CB C 3.007 -1.169 -7.740 1.00 . A A . 4 THR CB 1 1
14 1585 1 1 4 THR CG2 C 2.423 -0.756 -6.390 1.00 . A A . 4 THR CG2 1 1
14 1586 1 1 4 THR H H 2.259 -3.674 -6.179 1.00 . A A . 4 THR H 1 1
14 1587 1 1 4 THR HA H 3.286 -3.004 -8.791 1.00 . A A . 4 THR HA 1 1
14 1588 1 1 4 THR HB H 2.315 -0.903 -8.524 1.00 . A A . 4 THR HB 1 1
14 1589 1 1 4 THR HG1 H 4.220 -0.109 -8.828 1.00 . A A . 4 THR HG1 1 1
14 1590 1 1 4 THR HG21 H 2.804 0.216 -6.115 1.00 . A A . 4 THR HG21 1 1
14 1591 1 1 4 THR HG22 H 2.705 -1.477 -5.638 1.00 . A A . 4 THR HG22 1 1
14 1592 1 1 4 THR HG23 H 1.346 -0.712 -6.461 1.00 . A A . 4 THR HG23 1 1
14 1593 1 1 4 THR N N 2.145 -3.372 -7.103 1.00 . A A . 4 THR N 1 1
14 1594 1 1 4 THR O O 4.728 -2.646 -5.880 1.00 . A A . 4 THR O 1 1
14 1595 1 1 4 THR OG1 O 4.240 -0.497 -7.951 1.00 . A A . 4 THR OG1 1 1
14 1596 1 1 5 PRO C C 7.773 -2.864 -6.975 1.00 . A A . 5 PRO C 1 1
14 1597 1 1 5 PRO CA C 6.794 -4.036 -7.026 1.00 . A A . 5 PRO CA 1 1
14 1598 1 1 5 PRO CB C 7.340 -5.164 -7.898 1.00 . A A . 5 PRO CB 1 1
14 1599 1 1 5 PRO CD C 5.455 -4.171 -9.073 1.00 . A A . 5 PRO CD 1 1
14 1600 1 1 5 PRO CG C 6.777 -4.921 -9.260 1.00 . A A . 5 PRO CG 1 1
14 1601 1 1 5 PRO HA H 6.612 -4.411 -6.032 1.00 . A A . 5 PRO HA 1 1
14 1602 1 1 5 PRO HB2 H 8.420 -5.125 -7.924 1.00 . A A . 5 PRO HB2 1 1
14 1603 1 1 5 PRO HB3 H 7.007 -6.121 -7.524 1.00 . A A . 5 PRO HB3 1 1
14 1604 1 1 5 PRO HD2 H 5.389 -3.344 -9.768 1.00 . A A . 5 PRO HD2 1 1
14 1605 1 1 5 PRO HD3 H 4.621 -4.842 -9.204 1.00 . A A . 5 PRO HD3 1 1
14 1606 1 1 5 PRO HG2 H 7.466 -4.323 -9.841 1.00 . A A . 5 PRO HG2 1 1
14 1607 1 1 5 PRO HG3 H 6.594 -5.861 -9.757 1.00 . A A . 5 PRO HG3 1 1
14 1608 1 1 5 PRO N N 5.503 -3.679 -7.682 1.00 . A A . 5 PRO N 1 1
14 1609 1 1 5 PRO O O 8.965 -3.054 -6.730 1.00 . A A . 5 PRO O 1 1
14 1610 1 1 6 VAL C C 7.901 0.311 -5.879 1.00 . A A . 6 VAL C 1 1
14 1611 1 1 6 VAL CA C 8.109 -0.465 -7.176 1.00 . A A . 6 VAL CA 1 1
14 1612 1 1 6 VAL CB C 7.797 0.430 -8.382 1.00 . A A . 6 VAL CB 1 1
14 1613 1 1 6 VAL CG1 C 6.741 1.476 -8.011 1.00 . A A . 6 VAL CG1 1 1
14 1614 1 1 6 VAL CG2 C 9.076 1.140 -8.830 1.00 . A A . 6 VAL CG2 1 1
14 1615 1 1 6 VAL H H 6.308 -1.564 -7.391 1.00 . A A . 6 VAL H 1 1
14 1616 1 1 6 VAL HA H 9.144 -0.771 -7.233 1.00 . A A . 6 VAL HA 1 1
14 1617 1 1 6 VAL HB H 7.424 -0.181 -9.192 1.00 . A A . 6 VAL HB 1 1
14 1618 1 1 6 VAL HG11 H 5.958 1.013 -7.431 1.00 . A A . 6 VAL HG11 1 1
14 1619 1 1 6 VAL HG12 H 6.318 1.893 -8.913 1.00 . A A . 6 VAL HG12 1 1
14 1620 1 1 6 VAL HG13 H 7.200 2.265 -7.433 1.00 . A A . 6 VAL HG13 1 1
14 1621 1 1 6 VAL HG21 H 9.485 1.700 -8.002 1.00 . A A . 6 VAL HG21 1 1
14 1622 1 1 6 VAL HG22 H 8.850 1.812 -9.643 1.00 . A A . 6 VAL HG22 1 1
14 1623 1 1 6 VAL HG23 H 9.799 0.406 -9.160 1.00 . A A . 6 VAL HG23 1 1
14 1624 1 1 6 VAL N N 7.265 -1.656 -7.203 1.00 . A A . 6 VAL N 1 1
14 1625 1 1 6 VAL O O 8.797 1.017 -5.415 1.00 . A A . 6 VAL O 1 1
14 1626 1 1 7 CYS C C 7.501 0.652 -3.025 1.00 . A A . 7 CYS C 1 1
14 1627 1 1 7 CYS CA C 6.396 0.865 -4.054 1.00 . A A . 7 CYS CA 1 1
14 1628 1 1 7 CYS CB C 5.068 0.350 -3.492 1.00 . A A . 7 CYS CB 1 1
14 1629 1 1 7 CYS H H 6.037 -0.404 -5.713 1.00 . A A . 7 CYS H 1 1
14 1630 1 1 7 CYS HA H 6.303 1.922 -4.254 1.00 . A A . 7 CYS HA 1 1
14 1631 1 1 7 CYS HB2 H 4.712 -0.466 -4.103 1.00 . A A . 7 CYS HB2 1 1
14 1632 1 1 7 CYS HB3 H 5.215 0.005 -2.480 1.00 . A A . 7 CYS HB3 1 1
14 1633 1 1 7 CYS N N 6.712 0.172 -5.297 1.00 . A A . 7 CYS N 1 1
14 1634 1 1 7 CYS O O 7.863 -0.485 -2.722 1.00 . A A . 7 CYS O 1 1
14 1635 1 1 7 CYS SG S 3.849 1.688 -3.503 1.00 . A A . 7 CYS SG 1 1
14 1636 1 1 8 NH2 HN1 H 7.776 2.592 -2.705 1.00 . A A . 8 NH2 HN1 1 1
14 1637 1 1 8 NH2 HN2 H 8.775 1.559 -1.801 1.00 . A A . 8 NH2 HN2 1 1
14 1638 1 1 8 NH2 N N 8.065 1.687 -2.464 1.00 . A A . 8 NH2 N 1 1
15 1639 1 1 1 CYS C C 2.151 -2.370 -2.062 1.00 . A A . 1 CYS C 1 1
15 1640 1 1 1 CYS CA C 1.946 -1.352 -0.947 1.00 . A A . 1 CYS CA 1 1
15 1641 1 1 1 CYS CB C 1.756 0.044 -1.542 1.00 . A A . 1 CYS CB 1 1
15 1642 1 1 1 CYS H1 H 2.985 -0.686 0.731 1.00 . A A . 1 CYS H1 1 1
15 1643 1 1 1 CYS H2 H 3.977 -1.059 -0.597 1.00 . A A . 1 CYS H2 1 1
15 1644 1 1 1 CYS H3 H 3.288 -2.306 0.329 1.00 . A A . 1 CYS H3 1 1
15 1645 1 1 1 CYS HA H 1.071 -1.621 -0.373 1.00 . A A . 1 CYS HA 1 1
15 1646 1 1 1 CYS HB2 H 1.291 -0.040 -2.513 1.00 . A A . 1 CYS HB2 1 1
15 1647 1 1 1 CYS HB3 H 1.124 0.630 -0.891 1.00 . A A . 1 CYS HB3 1 1
15 1648 1 1 1 CYS N N 3.139 -1.350 -0.053 1.00 . A A . 1 CYS N 1 1
15 1649 1 1 1 CYS O O 3.237 -2.469 -2.634 1.00 . A A . 1 CYS O 1 1
15 1650 1 1 1 CYS SG S 3.365 0.853 -1.712 1.00 . A A . 1 CYS SG 1 1
15 1651 1 1 2 ARG C C 0.739 -3.555 -4.754 1.00 . A A . 2 ARG C 1 1
15 1652 1 1 2 ARG CA C 1.178 -4.132 -3.414 1.00 . A A . 2 ARG CA 1 1
15 1653 1 1 2 ARG CB C 0.292 -5.318 -3.052 1.00 . A A . 2 ARG CB 1 1
15 1654 1 1 2 ARG CD C 1.811 -7.270 -2.654 1.00 . A A . 2 ARG CD 1 1
15 1655 1 1 2 ARG CG C 0.872 -6.596 -3.657 1.00 . A A . 2 ARG CG 1 1
15 1656 1 1 2 ARG CZ C 1.593 -8.637 -0.659 1.00 . A A . 2 ARG CZ 1 1
15 1657 1 1 2 ARG H H 0.263 -3.008 -1.878 1.00 . A A . 2 ARG H 1 1
15 1658 1 1 2 ARG HA H 2.195 -4.476 -3.500 1.00 . A A . 2 ARG HA 1 1
15 1659 1 1 2 ARG HB2 H 0.242 -5.415 -1.977 1.00 . A A . 2 ARG HB2 1 1
15 1660 1 1 2 ARG HB3 H -0.701 -5.156 -3.444 1.00 . A A . 2 ARG HB3 1 1
15 1661 1 1 2 ARG HD2 H 2.560 -7.833 -3.194 1.00 . A A . 2 ARG HD2 1 1
15 1662 1 1 2 ARG HD3 H 2.299 -6.515 -2.055 1.00 . A A . 2 ARG HD3 1 1
15 1663 1 1 2 ARG HE H 0.156 -8.442 -2.039 1.00 . A A . 2 ARG HE 1 1
15 1664 1 1 2 ARG HG2 H 0.064 -7.259 -3.896 1.00 . A A . 2 ARG HG2 1 1
15 1665 1 1 2 ARG HG3 H 1.422 -6.366 -4.554 1.00 . A A . 2 ARG HG3 1 1
15 1666 1 1 2 ARG HH11 H -0.023 -9.710 -0.164 1.00 . A A . 2 ARG HH11 1 1
15 1667 1 1 2 ARG HH12 H 1.301 -9.791 0.950 1.00 . A A . 2 ARG HH12 1 1
15 1668 1 1 2 ARG HH21 H 3.329 -7.669 -0.896 1.00 . A A . 2 ARG HH21 1 1
15 1669 1 1 2 ARG HH22 H 3.198 -8.636 0.535 1.00 . A A . 2 ARG HH22 1 1
15 1670 1 1 2 ARG N N 1.103 -3.126 -2.367 1.00 . A A . 2 ARG N 1 1
15 1671 1 1 2 ARG NE N 1.063 -8.173 -1.787 1.00 . A A . 2 ARG NE 1 1
15 1672 1 1 2 ARG NH1 N 0.903 -9.442 0.102 1.00 . A A . 2 ARG NH1 1 1
15 1673 1 1 2 ARG NH2 N 2.800 -8.287 -0.313 1.00 . A A . 2 ARG NH2 1 1
15 1674 1 1 2 ARG O O 0.738 -2.342 -4.950 1.00 . A A . 2 ARG O 1 1
15 1675 1 1 3 DTR C C 1.070 -3.314 -7.729 1.00 . A A . 3 DTR C 1 1
15 1676 1 1 3 DTR CA C -0.066 -4.025 -6.995 1.00 . A A . 3 DTR CA 1 1
15 1677 1 1 3 DTR CB C -0.507 -5.252 -7.796 1.00 . A A . 3 DTR CB 1 1
15 1678 1 1 3 DTR CD1 C -0.594 -7.367 -6.414 1.00 . A A . 3 DTR CD1 1 1
15 1679 1 1 3 DTR CD2 C 1.453 -6.962 -7.249 1.00 . A A . 3 DTR CD2 1 1
15 1680 1 1 3 DTR CE2 C 1.550 -8.160 -6.502 1.00 . A A . 3 DTR CE2 1 1
15 1681 1 1 3 DTR CE3 C 2.611 -6.482 -7.882 1.00 . A A . 3 DTR CE3 1 1
15 1682 1 1 3 DTR CG C 0.081 -6.479 -7.178 1.00 . A A . 3 DTR CG 1 1
15 1683 1 1 3 DTR CH2 C 3.895 -8.361 -7.025 1.00 . A A . 3 DTR CH2 1 1
15 1684 1 1 3 DTR CZ2 C 2.757 -8.855 -6.389 1.00 . A A . 3 DTR CZ2 1 1
15 1685 1 1 3 DTR CZ3 C 3.822 -7.179 -7.769 1.00 . A A . 3 DTR CZ3 1 1
15 1686 1 1 3 DTR H H 0.393 -5.390 -5.453 1.00 . A A . 3 DTR H 1 1
15 1687 1 1 3 DTR HA H -0.902 -3.355 -6.892 1.00 . A A . 3 DTR HA 1 1
15 1688 1 1 3 DTR HB2 H -0.163 -5.160 -8.816 1.00 . A A . 3 DTR HB2 1 1
15 1689 1 1 3 DTR HB3 H -1.585 -5.322 -7.785 1.00 . A A . 3 DTR HB3 1 1
15 1690 1 1 3 DTR HD1 H -1.640 -7.306 -6.158 1.00 . A A . 3 DTR HD1 1 1
15 1691 1 1 3 DTR HE1 H 0.037 -9.133 -5.452 1.00 . A A . 3 DTR HE1 1 1
15 1692 1 1 3 DTR HE3 H 2.567 -5.571 -8.459 1.00 . A A . 3 DTR HE3 1 1
15 1693 1 1 3 DTR HH2 H 4.834 -8.891 -6.943 1.00 . A A . 3 DTR HH2 1 1
15 1694 1 1 3 DTR HZ2 H 2.810 -9.764 -5.814 1.00 . A A . 3 DTR HZ2 1 1
15 1695 1 1 3 DTR HZ3 H 4.703 -6.804 -8.257 1.00 . A A . 3 DTR HZ3 1 1
15 1696 1 1 3 DTR N N 0.370 -4.440 -5.671 1.00 . A A . 3 DTR N 1 1
15 1697 1 1 3 DTR NE1 N 0.276 -8.366 -6.014 1.00 . A A . 3 DTR NE1 1 1
15 1698 1 1 3 DTR O O 0.916 -2.891 -8.875 1.00 . A A . 3 DTR O 1 1
15 1699 1 1 4 THR C C 4.656 -3.031 -6.933 1.00 . A A . 4 THR C 1 1
15 1700 1 1 4 THR CA C 3.380 -2.548 -7.643 1.00 . A A . 4 THR CA 1 1
15 1701 1 1 4 THR CB C 3.267 -1.029 -7.494 1.00 . A A . 4 THR CB 1 1
15 1702 1 1 4 THR CG2 C 2.662 -0.687 -6.132 1.00 . A A . 4 THR CG2 1 1
15 1703 1 1 4 THR H H 2.272 -3.561 -6.150 1.00 . A A . 4 THR H 1 1
15 1704 1 1 4 THR HA H 3.420 -2.787 -8.691 1.00 . A A . 4 THR HA 1 1
15 1705 1 1 4 THR HB H 2.633 -0.637 -8.274 1.00 . A A . 4 THR HB 1 1
15 1706 1 1 4 THR HG1 H 4.637 -0.050 -8.468 1.00 . A A . 4 THR HG1 1 1
15 1707 1 1 4 THR HG21 H 3.094 0.234 -5.768 1.00 . A A . 4 THR HG21 1 1
15 1708 1 1 4 THR HG22 H 2.872 -1.484 -5.434 1.00 . A A . 4 THR HG22 1 1
15 1709 1 1 4 THR HG23 H 1.593 -0.567 -6.233 1.00 . A A . 4 THR HG23 1 1
15 1710 1 1 4 THR N N 2.212 -3.197 -7.058 1.00 . A A . 4 THR N 1 1
15 1711 1 1 4 THR O O 4.826 -2.769 -5.743 1.00 . A A . 4 THR O 1 1
15 1712 1 1 4 THR OG1 O 4.559 -0.448 -7.598 1.00 . A A . 4 THR OG1 1 1
15 1713 1 1 5 PRO C C 7.861 -3.140 -6.838 1.00 . A A . 5 PRO C 1 1
15 1714 1 1 5 PRO CA C 6.798 -4.229 -6.964 1.00 . A A . 5 PRO CA 1 1
15 1715 1 1 5 PRO CB C 7.267 -5.339 -7.903 1.00 . A A . 5 PRO CB 1 1
15 1716 1 1 5 PRO CD C 5.488 -4.116 -9.029 1.00 . A A . 5 PRO CD 1 1
15 1717 1 1 5 PRO CG C 6.743 -4.967 -9.251 1.00 . A A . 5 PRO CG 1 1
15 1718 1 1 5 PRO HA H 6.577 -4.649 -5.996 1.00 . A A . 5 PRO HA 1 1
15 1719 1 1 5 PRO HB2 H 8.347 -5.381 -7.916 1.00 . A A . 5 PRO HB2 1 1
15 1720 1 1 5 PRO HB3 H 6.856 -6.289 -7.593 1.00 . A A . 5 PRO HB3 1 1
15 1721 1 1 5 PRO HD2 H 5.509 -3.240 -9.663 1.00 . A A . 5 PRO HD2 1 1
15 1722 1 1 5 PRO HD3 H 4.601 -4.698 -9.220 1.00 . A A . 5 PRO HD3 1 1
15 1723 1 1 5 PRO HG2 H 7.488 -4.397 -9.789 1.00 . A A . 5 PRO HG2 1 1
15 1724 1 1 5 PRO HG3 H 6.485 -5.855 -9.805 1.00 . A A . 5 PRO HG3 1 1
15 1725 1 1 5 PRO N N 5.550 -3.728 -7.606 1.00 . A A . 5 PRO N 1 1
15 1726 1 1 5 PRO O O 9.039 -3.432 -6.630 1.00 . A A . 5 PRO O 1 1
15 1727 1 1 6 VAL C C 7.877 0.234 -5.807 1.00 . A A . 6 VAL C 1 1
15 1728 1 1 6 VAL CA C 8.353 -0.754 -6.868 1.00 . A A . 6 VAL CA 1 1
15 1729 1 1 6 VAL CB C 8.461 -0.043 -8.221 1.00 . A A . 6 VAL CB 1 1
15 1730 1 1 6 VAL CG1 C 7.062 0.173 -8.807 1.00 . A A . 6 VAL CG1 1 1
15 1731 1 1 6 VAL CG2 C 9.145 1.312 -8.029 1.00 . A A . 6 VAL CG2 1 1
15 1732 1 1 6 VAL H H 6.483 -1.718 -7.134 1.00 . A A . 6 VAL H 1 1
15 1733 1 1 6 VAL HA H 9.330 -1.119 -6.590 1.00 . A A . 6 VAL HA 1 1
15 1734 1 1 6 VAL HB H 9.043 -0.650 -8.899 1.00 . A A . 6 VAL HB 1 1
15 1735 1 1 6 VAL HG11 H 7.148 0.649 -9.771 1.00 . A A . 6 VAL HG11 1 1
15 1736 1 1 6 VAL HG12 H 6.488 0.804 -8.144 1.00 . A A . 6 VAL HG12 1 1
15 1737 1 1 6 VAL HG13 H 6.565 -0.779 -8.918 1.00 . A A . 6 VAL HG13 1 1
15 1738 1 1 6 VAL HG21 H 8.425 2.032 -7.671 1.00 . A A . 6 VAL HG21 1 1
15 1739 1 1 6 VAL HG22 H 9.551 1.647 -8.972 1.00 . A A . 6 VAL HG22 1 1
15 1740 1 1 6 VAL HG23 H 9.944 1.212 -7.308 1.00 . A A . 6 VAL HG23 1 1
15 1741 1 1 6 VAL N N 7.434 -1.886 -6.968 1.00 . A A . 6 VAL N 1 1
15 1742 1 1 6 VAL O O 8.680 0.769 -5.042 1.00 . A A . 6 VAL O 1 1
15 1743 1 1 7 CYS C C 6.881 2.630 -4.644 1.00 . A A . 7 CYS C 1 1
15 1744 1 1 7 CYS CA C 5.997 1.396 -4.794 1.00 . A A . 7 CYS CA 1 1
15 1745 1 1 7 CYS CB C 5.848 0.705 -3.437 1.00 . A A . 7 CYS CB 1 1
15 1746 1 1 7 CYS H H 5.978 0.013 -6.400 1.00 . A A . 7 CYS H 1 1
15 1747 1 1 7 CYS HA H 5.021 1.703 -5.136 1.00 . A A . 7 CYS HA 1 1
15 1748 1 1 7 CYS HB2 H 6.600 -0.064 -3.340 1.00 . A A . 7 CYS HB2 1 1
15 1749 1 1 7 CYS HB3 H 5.971 1.431 -2.648 1.00 . A A . 7 CYS HB3 1 1
15 1750 1 1 7 CYS N N 6.570 0.469 -5.766 1.00 . A A . 7 CYS N 1 1
15 1751 1 1 7 CYS O O 7.819 2.634 -3.847 1.00 . A A . 7 CYS O 1 1
15 1752 1 1 7 CYS SG S 4.203 -0.041 -3.320 1.00 . A A . 7 CYS SG 1 1
15 1753 1 1 8 NH2 HN1 H 5.889 3.683 -6.004 1.00 . A A . 8 NH2 HN1 1 1
15 1754 1 1 8 NH2 HN2 H 7.199 4.484 -5.280 1.00 . A A . 8 NH2 HN2 1 1
15 1755 1 1 8 NH2 N N 6.636 3.687 -5.370 1.00 . A A . 8 NH2 N 1 1
16 1756 1 1 1 CYS C C 2.287 -2.116 -2.290 1.00 . A A . 1 CYS C 1 1
16 1757 1 1 1 CYS CA C 2.111 -1.057 -1.208 1.00 . A A . 1 CYS CA 1 1
16 1758 1 1 1 CYS CB C 1.115 0.006 -1.678 1.00 . A A . 1 CYS CB 1 1
16 1759 1 1 1 CYS H1 H 4.134 -0.761 -1.601 1.00 . A A . 1 CYS H1 1 1
16 1760 1 1 1 CYS H2 H 3.723 -0.649 0.044 1.00 . A A . 1 CYS H2 1 1
16 1761 1 1 1 CYS H3 H 3.336 0.617 -1.021 1.00 . A A . 1 CYS H3 1 1
16 1762 1 1 1 CYS HA H 1.739 -1.522 -0.308 1.00 . A A . 1 CYS HA 1 1
16 1763 1 1 1 CYS HB2 H 0.126 -0.424 -1.723 1.00 . A A . 1 CYS HB2 1 1
16 1764 1 1 1 CYS HB3 H 1.118 0.832 -0.984 1.00 . A A . 1 CYS HB3 1 1
16 1765 1 1 1 CYS N N 3.425 -0.414 -0.926 1.00 . A A . 1 CYS N 1 1
16 1766 1 1 1 CYS O O 3.309 -2.153 -2.976 1.00 . A A . 1 CYS O 1 1
16 1767 1 1 1 CYS SG S 1.591 0.597 -3.322 1.00 . A A . 1 CYS SG 1 1
16 1768 1 1 2 ARG C C 0.857 -3.531 -4.785 1.00 . A A . 2 ARG C 1 1
16 1769 1 1 2 ARG CA C 1.339 -4.035 -3.432 1.00 . A A . 2 ARG CA 1 1
16 1770 1 1 2 ARG CB C 0.477 -5.209 -2.987 1.00 . A A . 2 ARG CB 1 1
16 1771 1 1 2 ARG CD C 2.048 -7.115 -2.559 1.00 . A A . 2 ARG CD 1 1
16 1772 1 1 2 ARG CG C 1.052 -6.510 -3.550 1.00 . A A . 2 ARG CG 1 1
16 1773 1 1 2 ARG CZ C 1.926 -8.372 -0.485 1.00 . A A . 2 ARG CZ 1 1
16 1774 1 1 2 ARG H H 0.498 -2.902 -1.858 1.00 . A A . 2 ARG H 1 1
16 1775 1 1 2 ARG HA H 2.356 -4.375 -3.532 1.00 . A A . 2 ARG HA 1 1
16 1776 1 1 2 ARG HB2 H 0.462 -5.257 -1.907 1.00 . A A . 2 ARG HB2 1 1
16 1777 1 1 2 ARG HB3 H -0.530 -5.076 -3.354 1.00 . A A . 2 ARG HB3 1 1
16 1778 1 1 2 ARG HD2 H 2.793 -7.677 -3.104 1.00 . A A . 2 ARG HD2 1 1
16 1779 1 1 2 ARG HD3 H 2.534 -6.322 -2.010 1.00 . A A . 2 ARG HD3 1 1
16 1780 1 1 2 ARG HE H 0.464 -8.333 -1.852 1.00 . A A . 2 ARG HE 1 1
16 1781 1 1 2 ARG HG2 H 0.248 -7.198 -3.720 1.00 . A A . 2 ARG HG2 1 1
16 1782 1 1 2 ARG HG3 H 1.558 -6.314 -4.483 1.00 . A A . 2 ARG HG3 1 1
16 1783 1 1 2 ARG HH11 H 0.376 -9.498 0.096 1.00 . A A . 2 ARG HH11 1 1
16 1784 1 1 2 ARG HH12 H 1.716 -9.445 1.193 1.00 . A A . 2 ARG HH12 1 1
16 1785 1 1 2 ARG HH21 H 3.606 -7.331 -0.804 1.00 . A A . 2 ARG HH21 1 1
16 1786 1 1 2 ARG HH22 H 3.545 -8.217 0.683 1.00 . A A . 2 ARG HH22 1 1
16 1787 1 1 2 ARG N N 1.286 -2.977 -2.435 1.00 . A A . 2 ARG N 1 1
16 1788 1 1 2 ARG NE N 1.360 -8.003 -1.630 1.00 . A A . 2 ARG NE 1 1
16 1789 1 1 2 ARG NH1 N 1.290 -9.167 0.331 1.00 . A A . 2 ARG NH1 1 1
16 1790 1 1 2 ARG NH2 N 3.118 -7.940 -0.178 1.00 . A A . 2 ARG NH2 1 1
16 1791 1 1 2 ARG O O 0.888 -2.333 -5.064 1.00 . A A . 2 ARG O 1 1
16 1792 1 1 3 DTR C C 1.029 -3.368 -7.717 1.00 . A A . 3 DTR C 1 1
16 1793 1 1 3 DTR CA C -0.056 -4.117 -6.955 1.00 . A A . 3 DTR CA 1 1
16 1794 1 1 3 DTR CB C -0.437 -5.390 -7.714 1.00 . A A . 3 DTR CB 1 1
16 1795 1 1 3 DTR CD1 C -0.435 -7.431 -6.222 1.00 . A A . 3 DTR CD1 1 1
16 1796 1 1 3 DTR CD2 C 1.578 -7.027 -7.137 1.00 . A A . 3 DTR CD2 1 1
16 1797 1 1 3 DTR CE2 C 1.723 -8.182 -6.334 1.00 . A A . 3 DTR CE2 1 1
16 1798 1 1 3 DTR CE3 C 2.705 -6.556 -7.829 1.00 . A A . 3 DTR CE3 1 1
16 1799 1 1 3 DTR CG C 0.199 -6.569 -7.050 1.00 . A A . 3 DTR CG 1 1
16 1800 1 1 3 DTR CH2 C 4.056 -8.363 -6.917 1.00 . A A . 3 DTR CH2 1 1
16 1801 1 1 3 DTR CZ2 C 2.946 -8.845 -6.222 1.00 . A A . 3 DTR CZ2 1 1
16 1802 1 1 3 DTR CZ3 C 3.936 -7.222 -7.718 1.00 . A A . 3 DTR CZ3 1 1
16 1803 1 1 3 DTR H H 0.428 -5.394 -5.349 1.00 . A A . 3 DTR H 1 1
16 1804 1 1 3 DTR HA H -0.928 -3.491 -6.861 1.00 . A A . 3 DTR HA 1 1
16 1805 1 1 3 DTR HB2 H -0.088 -5.320 -8.733 1.00 . A A . 3 DTR HB2 1 1
16 1806 1 1 3 DTR HB3 H -1.511 -5.507 -7.707 1.00 . A A . 3 DTR HB3 1 1
16 1807 1 1 3 DTR HD1 H -1.475 -7.379 -5.938 1.00 . A A . 3 DTR HD1 1 1
16 1808 1 1 3 DTR HE1 H 0.262 -9.130 -5.190 1.00 . A A . 3 DTR HE1 1 1
16 1809 1 1 3 DTR HE3 H 2.623 -5.677 -8.451 1.00 . A A . 3 DTR HE3 1 1
16 1810 1 1 3 DTR HH2 H 5.007 -8.869 -6.836 1.00 . A A . 3 DTR HH2 1 1
16 1811 1 1 3 DTR HZ2 H 3.036 -9.723 -5.603 1.00 . A A . 3 DTR HZ2 1 1
16 1812 1 1 3 DTR HZ3 H 4.794 -6.853 -8.252 1.00 . A A . 3 DTR HZ3 1 1
16 1813 1 1 3 DTR N N 0.421 -4.461 -5.626 1.00 . A A . 3 DTR N 1 1
16 1814 1 1 3 DTR NE1 N 0.468 -8.389 -5.797 1.00 . A A . 3 DTR NE1 1 1
16 1815 1 1 3 DTR O O 0.807 -2.886 -8.827 1.00 . A A . 3 DTR O 1 1
16 1816 1 1 4 THR C C 4.636 -3.028 -6.998 1.00 . A A . 4 THR C 1 1
16 1817 1 1 4 THR CA C 3.343 -2.597 -7.706 1.00 . A A . 4 THR CA 1 1
16 1818 1 1 4 THR CB C 3.170 -1.083 -7.554 1.00 . A A . 4 THR CB 1 1
16 1819 1 1 4 THR CG2 C 2.833 -0.462 -8.911 1.00 . A A . 4 THR CG2 1 1
16 1820 1 1 4 THR H H 2.313 -3.693 -6.221 1.00 . A A . 4 THR H 1 1
16 1821 1 1 4 THR HA H 3.384 -2.840 -8.753 1.00 . A A . 4 THR HA 1 1
16 1822 1 1 4 THR HB H 4.088 -0.652 -7.184 1.00 . A A . 4 THR HB 1 1
16 1823 1 1 4 THR HG1 H 2.430 -1.041 -5.756 1.00 . A A . 4 THR HG1 1 1
16 1824 1 1 4 THR HG21 H 1.907 -0.877 -9.276 1.00 . A A . 4 THR HG21 1 1
16 1825 1 1 4 THR HG22 H 3.626 -0.677 -9.613 1.00 . A A . 4 THR HG22 1 1
16 1826 1 1 4 THR HG23 H 2.731 0.606 -8.801 1.00 . A A . 4 THR HG23 1 1
16 1827 1 1 4 THR N N 2.206 -3.283 -7.103 1.00 . A A . 4 THR N 1 1
16 1828 1 1 4 THR O O 4.809 -2.734 -5.814 1.00 . A A . 4 THR O 1 1
16 1829 1 1 4 THR OG1 O 2.118 -0.818 -6.636 1.00 . A A . 4 THR OG1 1 1
16 1830 1 1 5 PRO C C 7.831 -3.037 -6.903 1.00 . A A . 5 PRO C 1 1
16 1831 1 1 5 PRO CA C 6.810 -4.165 -7.017 1.00 . A A . 5 PRO CA 1 1
16 1832 1 1 5 PRO CB C 7.313 -5.272 -7.939 1.00 . A A . 5 PRO CB 1 1
16 1833 1 1 5 PRO CD C 5.483 -4.136 -9.075 1.00 . A A . 5 PRO CD 1 1
16 1834 1 1 5 PRO CG C 6.765 -4.947 -9.289 1.00 . A A . 5 PRO CG 1 1
16 1835 1 1 5 PRO HA H 6.603 -4.578 -6.043 1.00 . A A . 5 PRO HA 1 1
16 1836 1 1 5 PRO HB2 H 8.394 -5.272 -7.961 1.00 . A A . 5 PRO HB2 1 1
16 1837 1 1 5 PRO HB3 H 6.943 -6.232 -7.610 1.00 . A A . 5 PRO HB3 1 1
16 1838 1 1 5 PRO HD2 H 5.470 -3.275 -9.729 1.00 . A A . 5 PRO HD2 1 1
16 1839 1 1 5 PRO HD3 H 4.616 -4.752 -9.245 1.00 . A A . 5 PRO HD3 1 1
16 1840 1 1 5 PRO HG2 H 7.485 -4.363 -9.848 1.00 . A A . 5 PRO HG2 1 1
16 1841 1 1 5 PRO HG3 H 6.534 -5.855 -9.823 1.00 . A A . 5 PRO HG3 1 1
16 1842 1 1 5 PRO N N 5.545 -3.715 -7.662 1.00 . A A . 5 PRO N 1 1
16 1843 1 1 5 PRO O O 9.027 -3.280 -6.740 1.00 . A A . 5 PRO O 1 1
16 1844 1 1 6 VAL C C 7.605 0.411 -5.971 1.00 . A A . 6 VAL C 1 1
16 1845 1 1 6 VAL CA C 8.218 -0.637 -6.894 1.00 . A A . 6 VAL CA 1 1
16 1846 1 1 6 VAL CB C 8.437 -0.033 -8.282 1.00 . A A . 6 VAL CB 1 1
16 1847 1 1 6 VAL CG1 C 7.285 0.916 -8.616 1.00 . A A . 6 VAL CG1 1 1
16 1848 1 1 6 VAL CG2 C 9.757 0.742 -8.297 1.00 . A A . 6 VAL CG2 1 1
16 1849 1 1 6 VAL H H 6.384 -1.674 -7.119 1.00 . A A . 6 VAL H 1 1
16 1850 1 1 6 VAL HA H 9.172 -0.944 -6.492 1.00 . A A . 6 VAL HA 1 1
16 1851 1 1 6 VAL HB H 8.475 -0.826 -9.016 1.00 . A A . 6 VAL HB 1 1
16 1852 1 1 6 VAL HG11 H 7.452 1.868 -8.135 1.00 . A A . 6 VAL HG11 1 1
16 1853 1 1 6 VAL HG12 H 6.357 0.493 -8.264 1.00 . A A . 6 VAL HG12 1 1
16 1854 1 1 6 VAL HG13 H 7.235 1.057 -9.685 1.00 . A A . 6 VAL HG13 1 1
16 1855 1 1 6 VAL HG21 H 10.557 0.086 -8.607 1.00 . A A . 6 VAL HG21 1 1
16 1856 1 1 6 VAL HG22 H 9.964 1.119 -7.306 1.00 . A A . 6 VAL HG22 1 1
16 1857 1 1 6 VAL HG23 H 9.681 1.568 -8.988 1.00 . A A . 6 VAL HG23 1 1
16 1858 1 1 6 VAL N N 7.347 -1.803 -6.989 1.00 . A A . 6 VAL N 1 1
16 1859 1 1 6 VAL O O 8.120 1.523 -5.848 1.00 . A A . 6 VAL O 1 1
16 1860 1 1 7 CYS C C 6.166 0.631 -2.964 1.00 . A A . 7 CYS C 1 1
16 1861 1 1 7 CYS CA C 5.824 0.964 -4.414 1.00 . A A . 7 CYS CA 1 1
16 1862 1 1 7 CYS CB C 4.310 0.874 -4.616 1.00 . A A . 7 CYS CB 1 1
16 1863 1 1 7 CYS H H 6.137 -0.850 -5.462 1.00 . A A . 7 CYS H 1 1
16 1864 1 1 7 CYS HA H 6.144 1.973 -4.627 1.00 . A A . 7 CYS HA 1 1
16 1865 1 1 7 CYS HB2 H 4.010 1.558 -5.396 1.00 . A A . 7 CYS HB2 1 1
16 1866 1 1 7 CYS HB3 H 4.044 -0.134 -4.899 1.00 . A A . 7 CYS HB3 1 1
16 1867 1 1 7 CYS N N 6.502 0.048 -5.323 1.00 . A A . 7 CYS N 1 1
16 1868 1 1 7 CYS O O 6.558 1.511 -2.197 1.00 . A A . 7 CYS O 1 1
16 1869 1 1 7 CYS SG S 3.465 1.311 -3.075 1.00 . A A . 7 CYS SG 1 1
16 1870 1 1 8 NH2 HN1 H 5.729 -1.297 -3.153 1.00 . A A . 8 NH2 HN1 1 1
16 1871 1 1 8 NH2 HN2 H 6.259 -0.820 -1.613 1.00 . A A . 8 NH2 HN2 1 1
16 1872 1 1 8 NH2 N N 6.041 -0.598 -2.542 1.00 . A A . 8 NH2 N 1 1
17 1873 1 1 1 CYS C C 2.267 -2.134 -2.260 1.00 . A A . 1 CYS C 1 1
17 1874 1 1 1 CYS CA C 2.076 -1.065 -1.190 1.00 . A A . 1 CYS CA 1 1
17 1875 1 1 1 CYS CB C 1.136 0.026 -1.706 1.00 . A A . 1 CYS CB 1 1
17 1876 1 1 1 CYS H1 H 3.725 -0.837 0.060 1.00 . A A . 1 CYS H1 1 1
17 1877 1 1 1 CYS H2 H 3.297 0.572 -0.786 1.00 . A A . 1 CYS H2 1 1
17 1878 1 1 1 CYS H3 H 4.086 -0.699 -1.591 1.00 . A A . 1 CYS H3 1 1
17 1879 1 1 1 CYS HA H 1.651 -1.517 -0.307 1.00 . A A . 1 CYS HA 1 1
17 1880 1 1 1 CYS HB2 H 0.137 -0.376 -1.801 1.00 . A A . 1 CYS HB2 1 1
17 1881 1 1 1 CYS HB3 H 1.126 0.850 -1.010 1.00 . A A . 1 CYS HB3 1 1
17 1882 1 1 1 CYS N N 3.395 -0.462 -0.852 1.00 . A A . 1 CYS N 1 1
17 1883 1 1 1 CYS O O 3.312 -2.197 -2.909 1.00 . A A . 1 CYS O 1 1
17 1884 1 1 1 CYS SG S 1.708 0.606 -3.323 1.00 . A A . 1 CYS SG 1 1
17 1885 1 1 2 ARG C C 0.837 -3.541 -4.789 1.00 . A A . 2 ARG C 1 1
17 1886 1 1 2 ARG CA C 1.317 -4.034 -3.431 1.00 . A A . 2 ARG CA 1 1
17 1887 1 1 2 ARG CB C 0.459 -5.211 -2.981 1.00 . A A . 2 ARG CB 1 1
17 1888 1 1 2 ARG CD C 2.038 -7.106 -2.534 1.00 . A A . 2 ARG CD 1 1
17 1889 1 1 2 ARG CG C 1.046 -6.511 -3.535 1.00 . A A . 2 ARG CG 1 1
17 1890 1 1 2 ARG CZ C 1.917 -8.370 -0.464 1.00 . A A . 2 ARG CZ 1 1
17 1891 1 1 2 ARG H H 0.445 -2.875 -1.893 1.00 . A A . 2 ARG H 1 1
17 1892 1 1 2 ARG HA H 2.336 -4.368 -3.523 1.00 . A A . 2 ARG HA 1 1
17 1893 1 1 2 ARG HB2 H 0.439 -5.252 -1.902 1.00 . A A . 2 ARG HB2 1 1
17 1894 1 1 2 ARG HB3 H -0.546 -5.086 -3.355 1.00 . A A . 2 ARG HB3 1 1
17 1895 1 1 2 ARG HD2 H 2.789 -7.666 -3.071 1.00 . A A . 2 ARG HD2 1 1
17 1896 1 1 2 ARG HD3 H 2.516 -6.308 -1.984 1.00 . A A . 2 ARG HD3 1 1
17 1897 1 1 2 ARG HE H 0.449 -8.317 -1.824 1.00 . A A . 2 ARG HE 1 1
17 1898 1 1 2 ARG HG2 H 0.246 -7.204 -3.706 1.00 . A A . 2 ARG HG2 1 1
17 1899 1 1 2 ARG HG3 H 1.557 -6.319 -4.465 1.00 . A A . 2 ARG HG3 1 1
17 1900 1 1 2 ARG HH11 H 0.364 -9.491 0.118 1.00 . A A . 2 ARG HH11 1 1
17 1901 1 1 2 ARG HH12 H 1.708 -9.449 1.210 1.00 . A A . 2 ARG HH12 1 1
17 1902 1 1 2 ARG HH21 H 3.601 -7.336 -0.784 1.00 . A A . 2 ARG HH21 1 1
17 1903 1 1 2 ARG HH22 H 3.540 -8.228 0.699 1.00 . A A . 2 ARG HH22 1 1
17 1904 1 1 2 ARG N N 1.252 -2.972 -2.439 1.00 . A A . 2 ARG N 1 1
17 1905 1 1 2 ARG NE N 1.348 -7.994 -1.604 1.00 . A A . 2 ARG NE 1 1
17 1906 1 1 2 ARG NH1 N 1.280 -9.165 0.352 1.00 . A A . 2 ARG NH1 1 1
17 1907 1 1 2 ARG NH2 N 3.112 -7.945 -0.159 1.00 . A A . 2 ARG NH2 1 1
17 1908 1 1 2 ARG O O 0.854 -2.344 -5.071 1.00 . A A . 2 ARG O 1 1
17 1909 1 1 3 DTR C C 1.031 -3.410 -7.733 1.00 . A A . 3 DTR C 1 1
17 1910 1 1 3 DTR CA C -0.057 -4.148 -6.961 1.00 . A A . 3 DTR CA 1 1
17 1911 1 1 3 DTR CB C -0.443 -5.427 -7.707 1.00 . A A . 3 DTR CB 1 1
17 1912 1 1 3 DTR CD1 C -0.435 -7.460 -6.204 1.00 . A A . 3 DTR CD1 1 1
17 1913 1 1 3 DTR CD2 C 1.578 -7.052 -7.116 1.00 . A A . 3 DTR CD2 1 1
17 1914 1 1 3 DTR CE2 C 1.726 -8.202 -6.306 1.00 . A A . 3 DTR CE2 1 1
17 1915 1 1 3 DTR CE3 C 2.705 -6.580 -7.807 1.00 . A A . 3 DTR CE3 1 1
17 1916 1 1 3 DTR CG C 0.197 -6.600 -7.034 1.00 . A A . 3 DTR CG 1 1
17 1917 1 1 3 DTR CH2 C 4.061 -8.376 -6.881 1.00 . A A . 3 DTR CH2 1 1
17 1918 1 1 3 DTR CZ2 C 2.952 -8.859 -6.188 1.00 . A A . 3 DTR CZ2 1 1
17 1919 1 1 3 DTR CZ3 C 3.939 -7.240 -7.689 1.00 . A A . 3 DTR CZ3 1 1
17 1920 1 1 3 DTR H H 0.434 -5.412 -5.347 1.00 . A A . 3 DTR H 1 1
17 1921 1 1 3 DTR HA H -0.926 -3.517 -6.875 1.00 . A A . 3 DTR HA 1 1
17 1922 1 1 3 DTR HB2 H -0.099 -5.367 -8.729 1.00 . A A . 3 DTR HB2 1 1
17 1923 1 1 3 DTR HB3 H -1.516 -5.543 -7.694 1.00 . A A . 3 DTR HB3 1 1
17 1924 1 1 3 DTR HD1 H -1.476 -7.410 -5.924 1.00 . A A . 3 DTR HD1 1 1
17 1925 1 1 3 DTR HE1 H 0.266 -9.150 -5.161 1.00 . A A . 3 DTR HE1 1 1
17 1926 1 1 3 DTR HE3 H 2.621 -5.705 -8.433 1.00 . A A . 3 DTR HE3 1 1
17 1927 1 1 3 DTR HH2 H 5.014 -8.877 -6.795 1.00 . A A . 3 DTR HH2 1 1
17 1928 1 1 3 DTR HZ2 H 3.045 -9.733 -5.563 1.00 . A A . 3 DTR HZ2 1 1
17 1929 1 1 3 DTR HZ3 H 4.796 -6.870 -8.223 1.00 . A A . 3 DTR HZ3 1 1
17 1930 1 1 3 DTR N N 0.418 -4.480 -5.628 1.00 . A A . 3 DTR N 1 1
17 1931 1 1 3 DTR NE1 N 0.471 -8.412 -5.772 1.00 . A A . 3 DTR NE1 1 1
17 1932 1 1 3 DTR O O 0.819 -2.969 -8.862 1.00 . A A . 3 DTR O 1 1
17 1933 1 1 4 THR C C 4.630 -3.033 -7.006 1.00 . A A . 4 THR C 1 1
17 1934 1 1 4 THR CA C 3.336 -2.611 -7.719 1.00 . A A . 4 THR CA 1 1
17 1935 1 1 4 THR CB C 3.165 -1.095 -7.587 1.00 . A A . 4 THR CB 1 1
17 1936 1 1 4 THR CG2 C 2.784 -0.495 -8.941 1.00 . A A . 4 THR CG2 1 1
17 1937 1 1 4 THR H H 2.301 -3.669 -6.212 1.00 . A A . 4 THR H 1 1
17 1938 1 1 4 THR HA H 3.378 -2.868 -8.763 1.00 . A A . 4 THR HA 1 1
17 1939 1 1 4 THR HB H 4.093 -0.657 -7.253 1.00 . A A . 4 THR HB 1 1
17 1940 1 1 4 THR HG1 H 1.664 -0.040 -6.940 1.00 . A A . 4 THR HG1 1 1
17 1941 1 1 4 THR HG21 H 2.684 0.576 -8.843 1.00 . A A . 4 THR HG21 1 1
17 1942 1 1 4 THR HG22 H 1.847 -0.914 -9.271 1.00 . A A . 4 THR HG22 1 1
17 1943 1 1 4 THR HG23 H 3.555 -0.719 -9.665 1.00 . A A . 4 THR HG23 1 1
17 1944 1 1 4 THR N N 2.199 -3.290 -7.108 1.00 . A A . 4 THR N 1 1
17 1945 1 1 4 THR O O 4.801 -2.728 -5.825 1.00 . A A . 4 THR O 1 1
17 1946 1 1 4 THR OG1 O 2.142 -0.817 -6.641 1.00 . A A . 4 THR OG1 1 1
17 1947 1 1 5 PRO C C 7.825 -3.036 -6.910 1.00 . A A . 5 PRO C 1 1
17 1948 1 1 5 PRO CA C 6.805 -4.167 -7.012 1.00 . A A . 5 PRO CA 1 1
17 1949 1 1 5 PRO CB C 7.311 -5.283 -7.922 1.00 . A A . 5 PRO CB 1 1
17 1950 1 1 5 PRO CD C 5.479 -4.161 -9.071 1.00 . A A . 5 PRO CD 1 1
17 1951 1 1 5 PRO CG C 6.764 -4.972 -9.276 1.00 . A A . 5 PRO CG 1 1
17 1952 1 1 5 PRO HA H 6.599 -4.569 -6.033 1.00 . A A . 5 PRO HA 1 1
17 1953 1 1 5 PRO HB2 H 8.392 -5.281 -7.943 1.00 . A A . 5 PRO HB2 1 1
17 1954 1 1 5 PRO HB3 H 6.942 -6.240 -7.582 1.00 . A A . 5 PRO HB3 1 1
17 1955 1 1 5 PRO HD2 H 5.466 -3.306 -9.733 1.00 . A A . 5 PRO HD2 1 1
17 1956 1 1 5 PRO HD3 H 4.613 -4.780 -9.234 1.00 . A A . 5 PRO HD3 1 1
17 1957 1 1 5 PRO HG2 H 7.484 -4.394 -9.839 1.00 . A A . 5 PRO HG2 1 1
17 1958 1 1 5 PRO HG3 H 6.533 -5.887 -9.799 1.00 . A A . 5 PRO HG3 1 1
17 1959 1 1 5 PRO N N 5.540 -3.726 -7.662 1.00 . A A . 5 PRO N 1 1
17 1960 1 1 5 PRO O O 9.021 -3.278 -6.745 1.00 . A A . 5 PRO O 1 1
17 1961 1 1 6 VAL C C 7.735 0.305 -5.820 1.00 . A A . 6 VAL C 1 1
17 1962 1 1 6 VAL CA C 8.204 -0.630 -6.930 1.00 . A A . 6 VAL CA 1 1
17 1963 1 1 6 VAL CB C 8.197 0.116 -8.264 1.00 . A A . 6 VAL CB 1 1
17 1964 1 1 6 VAL CG1 C 6.764 0.518 -8.616 1.00 . A A . 6 VAL CG1 1 1
17 1965 1 1 6 VAL CG2 C 9.065 1.371 -8.149 1.00 . A A . 6 VAL CG2 1 1
17 1966 1 1 6 VAL H H 6.374 -1.679 -7.141 1.00 . A A . 6 VAL H 1 1
17 1967 1 1 6 VAL HA H 9.213 -0.950 -6.714 1.00 . A A . 6 VAL HA 1 1
17 1968 1 1 6 VAL HB H 8.591 -0.526 -9.038 1.00 . A A . 6 VAL HB 1 1
17 1969 1 1 6 VAL HG11 H 6.128 -0.353 -8.587 1.00 . A A . 6 VAL HG11 1 1
17 1970 1 1 6 VAL HG12 H 6.745 0.946 -9.609 1.00 . A A . 6 VAL HG12 1 1
17 1971 1 1 6 VAL HG13 H 6.409 1.248 -7.903 1.00 . A A . 6 VAL HG13 1 1
17 1972 1 1 6 VAL HG21 H 8.511 2.147 -7.640 1.00 . A A . 6 VAL HG21 1 1
17 1973 1 1 6 VAL HG22 H 9.338 1.713 -9.137 1.00 . A A . 6 VAL HG22 1 1
17 1974 1 1 6 VAL HG23 H 9.959 1.141 -7.589 1.00 . A A . 6 VAL HG23 1 1
17 1975 1 1 6 VAL N N 7.338 -1.802 -7.011 1.00 . A A . 6 VAL N 1 1
17 1976 1 1 6 VAL O O 8.502 1.129 -5.323 1.00 . A A . 6 VAL O 1 1
17 1977 1 1 7 CYS C C 6.177 0.401 -3.010 1.00 . A A . 7 CYS C 1 1
17 1978 1 1 7 CYS CA C 5.907 1.010 -4.382 1.00 . A A . 7 CYS CA 1 1
17 1979 1 1 7 CYS CB C 4.398 1.164 -4.586 1.00 . A A . 7 CYS CB 1 1
17 1980 1 1 7 CYS H H 5.903 -0.503 -5.866 1.00 . A A . 7 CYS H 1 1
17 1981 1 1 7 CYS HA H 6.366 1.986 -4.429 1.00 . A A . 7 CYS HA 1 1
17 1982 1 1 7 CYS HB2 H 4.201 2.059 -5.158 1.00 . A A . 7 CYS HB2 1 1
17 1983 1 1 7 CYS HB3 H 4.018 0.305 -5.119 1.00 . A A . 7 CYS HB3 1 1
17 1984 1 1 7 CYS N N 6.468 0.171 -5.435 1.00 . A A . 7 CYS N 1 1
17 1985 1 1 7 CYS O O 6.205 -0.821 -2.863 1.00 . A A . 7 CYS O 1 1
17 1986 1 1 7 CYS SG S 3.579 1.285 -2.977 1.00 . A A . 7 CYS SG 1 1
17 1987 1 1 8 NH2 HN1 H 6.356 2.160 -2.106 1.00 . A A . 8 NH2 HN1 1 1
17 1988 1 1 8 NH2 HN2 H 6.554 0.804 -1.103 1.00 . A A . 8 NH2 HN2 1 1
17 1989 1 1 8 NH2 N N 6.379 1.187 -1.988 1.00 . A A . 8 NH2 N 1 1
18 1990 1 1 1 CYS C C 2.270 -2.111 -2.276 1.00 . A A . 1 CYS C 1 1
18 1991 1 1 1 CYS CA C 2.077 -1.038 -1.211 1.00 . A A . 1 CYS CA 1 1
18 1992 1 1 1 CYS CB C 1.127 0.043 -1.728 1.00 . A A . 1 CYS CB 1 1
18 1993 1 1 1 CYS H1 H 4.109 -0.749 -1.563 1.00 . A A . 1 CYS H1 1 1
18 1994 1 1 1 CYS H2 H 3.677 -0.706 0.080 1.00 . A A . 1 CYS H2 1 1
18 1995 1 1 1 CYS H3 H 3.317 0.611 -0.931 1.00 . A A . 1 CYS H3 1 1
18 1996 1 1 1 CYS HA H 1.659 -1.487 -0.322 1.00 . A A . 1 CYS HA 1 1
18 1997 1 1 1 CYS HB2 H 0.132 -0.366 -1.820 1.00 . A A . 1 CYS HB2 1 1
18 1998 1 1 1 CYS HB3 H 1.112 0.871 -1.034 1.00 . A A . 1 CYS HB3 1 1
18 1999 1 1 1 CYS N N 3.394 -0.425 -0.882 1.00 . A A . 1 CYS N 1 1
18 2000 1 1 1 CYS O O 3.312 -2.173 -2.928 1.00 . A A . 1 CYS O 1 1
18 2001 1 1 1 CYS SG S 1.693 0.623 -3.347 1.00 . A A . 1 CYS SG 1 1
18 2002 1 1 2 ARG C C 0.841 -3.541 -4.790 1.00 . A A . 2 ARG C 1 1
18 2003 1 1 2 ARG CA C 1.325 -4.025 -3.429 1.00 . A A . 2 ARG CA 1 1
18 2004 1 1 2 ARG CB C 0.471 -5.202 -2.973 1.00 . A A . 2 ARG CB 1 1
18 2005 1 1 2 ARG CD C 2.056 -7.089 -2.516 1.00 . A A . 2 ARG CD 1 1
18 2006 1 1 2 ARG CG C 1.061 -6.503 -3.519 1.00 . A A . 2 ARG CG 1 1
18 2007 1 1 2 ARG CZ C 1.942 -8.342 -0.439 1.00 . A A . 2 ARG CZ 1 1
18 2008 1 1 2 ARG H H 0.453 -2.861 -1.895 1.00 . A A . 2 ARG H 1 1
18 2009 1 1 2 ARG HA H 2.345 -4.356 -3.522 1.00 . A A . 2 ARG HA 1 1
18 2010 1 1 2 ARG HB2 H 0.452 -5.236 -1.893 1.00 . A A . 2 ARG HB2 1 1
18 2011 1 1 2 ARG HB3 H -0.534 -5.081 -3.346 1.00 . A A . 2 ARG HB3 1 1
18 2012 1 1 2 ARG HD2 H 2.808 -7.651 -3.051 1.00 . A A . 2 ARG HD2 1 1
18 2013 1 1 2 ARG HD3 H 2.533 -6.285 -1.973 1.00 . A A . 2 ARG HD3 1 1
18 2014 1 1 2 ARG HE H 0.471 -8.299 -1.796 1.00 . A A . 2 ARG HE 1 1
18 2015 1 1 2 ARG HG2 H 0.263 -7.199 -3.685 1.00 . A A . 2 ARG HG2 1 1
18 2016 1 1 2 ARG HG3 H 1.570 -6.314 -4.452 1.00 . A A . 2 ARG HG3 1 1
18 2017 1 1 2 ARG HH11 H 0.392 -9.460 0.154 1.00 . A A . 2 ARG HH11 1 1
18 2018 1 1 2 ARG HH12 H 1.739 -9.410 1.241 1.00 . A A . 2 ARG HH12 1 1
18 2019 1 1 2 ARG HH21 H 3.625 -7.308 -0.770 1.00 . A A . 2 ARG HH21 1 1
18 2020 1 1 2 ARG HH22 H 3.570 -8.192 0.718 1.00 . A A . 2 ARG HH22 1 1
18 2021 1 1 2 ARG N N 1.258 -2.956 -2.444 1.00 . A A . 2 ARG N 1 1
18 2022 1 1 2 ARG NE N 1.370 -7.972 -1.581 1.00 . A A . 2 ARG NE 1 1
18 2023 1 1 2 ARG NH1 N 1.309 -9.132 0.383 1.00 . A A . 2 ARG NH1 1 1
18 2024 1 1 2 ARG NH2 N 3.139 -7.914 -0.140 1.00 . A A . 2 ARG NH2 1 1
18 2025 1 1 2 ARG O O 0.857 -2.345 -5.080 1.00 . A A . 2 ARG O 1 1
18 2026 1 1 3 DTR C C 1.027 -3.419 -7.732 1.00 . A A . 3 DTR C 1 1
18 2027 1 1 3 DTR CA C -0.056 -4.162 -6.957 1.00 . A A . 3 DTR CA 1 1
18 2028 1 1 3 DTR CB C -0.432 -5.446 -7.698 1.00 . A A . 3 DTR CB 1 1
18 2029 1 1 3 DTR CD1 C -0.418 -7.470 -6.184 1.00 . A A . 3 DTR CD1 1 1
18 2030 1 1 3 DTR CD2 C 1.594 -7.060 -7.098 1.00 . A A . 3 DTR CD2 1 1
18 2031 1 1 3 DTR CE2 C 1.747 -8.205 -6.282 1.00 . A A . 3 DTR CE2 1 1
18 2032 1 1 3 DTR CE3 C 2.719 -6.586 -7.794 1.00 . A A . 3 DTR CE3 1 1
18 2033 1 1 3 DTR CG C 0.211 -6.612 -7.019 1.00 . A A . 3 DTR CG 1 1
18 2034 1 1 3 DTR CH2 C 4.083 -8.371 -6.858 1.00 . A A . 3 DTR CH2 1 1
18 2035 1 1 3 DTR CZ2 C 2.976 -8.856 -6.161 1.00 . A A . 3 DTR CZ2 1 1
18 2036 1 1 3 DTR CZ3 C 3.954 -7.241 -7.672 1.00 . A A . 3 DTR CZ3 1 1
18 2037 1 1 3 DTR H H 0.440 -5.415 -5.337 1.00 . A A . 3 DTR H 1 1
18 2038 1 1 3 DTR HA H -0.929 -3.536 -6.873 1.00 . A A . 3 DTR HA 1 1
18 2039 1 1 3 DTR HB2 H -0.087 -5.388 -8.719 1.00 . A A . 3 DTR HB2 1 1
18 2040 1 1 3 DTR HB3 H -1.506 -5.568 -7.686 1.00 . A A . 3 DTR HB3 1 1
18 2041 1 1 3 DTR HD1 H -1.459 -7.424 -5.903 1.00 . A A . 3 DTR HD1 1 1
18 2042 1 1 3 DTR HE1 H 0.292 -9.153 -5.132 1.00 . A A . 3 DTR HE1 1 1
18 2043 1 1 3 DTR HE3 H 2.632 -5.715 -8.425 1.00 . A A . 3 DTR HE3 1 1
18 2044 1 1 3 DTR HH2 H 5.038 -8.869 -6.770 1.00 . A A . 3 DTR HH2 1 1
18 2045 1 1 3 DTR HZ2 H 3.072 -9.726 -5.532 1.00 . A A . 3 DTR HZ2 1 1
18 2046 1 1 3 DTR HZ3 H 4.811 -6.871 -8.208 1.00 . A A . 3 DTR HZ3 1 1
18 2047 1 1 3 DTR N N 0.421 -4.484 -5.624 1.00 . A A . 3 DTR N 1 1
18 2048 1 1 3 DTR NE1 N 0.493 -8.416 -5.746 1.00 . A A . 3 DTR NE1 1 1
18 2049 1 1 3 DTR O O 0.808 -2.973 -8.857 1.00 . A A . 3 DTR O 1 1
18 2050 1 1 4 THR C C 4.627 -3.029 -7.010 1.00 . A A . 4 THR C 1 1
18 2051 1 1 4 THR CA C 3.330 -2.617 -7.725 1.00 . A A . 4 THR CA 1 1
18 2052 1 1 4 THR CB C 3.150 -1.101 -7.597 1.00 . A A . 4 THR CB 1 1
18 2053 1 1 4 THR CG2 C 2.787 -0.507 -8.958 1.00 . A A . 4 THR CG2 1 1
18 2054 1 1 4 THR H H 2.304 -3.684 -6.217 1.00 . A A . 4 THR H 1 1
18 2055 1 1 4 THR HA H 3.374 -2.876 -8.767 1.00 . A A . 4 THR HA 1 1
18 2056 1 1 4 THR HB H 4.070 -0.659 -7.251 1.00 . A A . 4 THR HB 1 1
18 2057 1 1 4 THR HG1 H 1.482 -0.239 -7.091 1.00 . A A . 4 THR HG1 1 1
18 2058 1 1 4 THR HG21 H 2.678 0.563 -8.865 1.00 . A A . 4 THR HG21 1 1
18 2059 1 1 4 THR HG22 H 1.857 -0.934 -9.302 1.00 . A A . 4 THR HG22 1 1
18 2060 1 1 4 THR HG23 H 3.570 -0.729 -9.669 1.00 . A A . 4 THR HG23 1 1
18 2061 1 1 4 THR N N 2.198 -3.300 -7.111 1.00 . A A . 4 THR N 1 1
18 2062 1 1 4 THR O O 4.798 -2.717 -5.831 1.00 . A A . 4 THR O 1 1
18 2063 1 1 4 THR OG1 O 2.112 -0.828 -6.667 1.00 . A A . 4 THR OG1 1 1
18 2064 1 1 5 PRO C C 7.824 -3.016 -6.919 1.00 . A A . 5 PRO C 1 1
18 2065 1 1 5 PRO CA C 6.808 -4.152 -7.012 1.00 . A A . 5 PRO CA 1 1
18 2066 1 1 5 PRO CB C 7.318 -5.270 -7.916 1.00 . A A . 5 PRO CB 1 1
18 2067 1 1 5 PRO CD C 5.481 -4.163 -9.070 1.00 . A A . 5 PRO CD 1 1
18 2068 1 1 5 PRO CG C 6.769 -4.970 -9.272 1.00 . A A . 5 PRO CG 1 1
18 2069 1 1 5 PRO HA H 6.605 -4.549 -6.031 1.00 . A A . 5 PRO HA 1 1
18 2070 1 1 5 PRO HB2 H 8.398 -5.264 -7.938 1.00 . A A . 5 PRO HB2 1 1
18 2071 1 1 5 PRO HB3 H 6.952 -6.227 -7.571 1.00 . A A . 5 PRO HB3 1 1
18 2072 1 1 5 PRO HD2 H 5.464 -3.311 -9.736 1.00 . A A . 5 PRO HD2 1 1
18 2073 1 1 5 PRO HD3 H 4.618 -4.787 -9.230 1.00 . A A . 5 PRO HD3 1 1
18 2074 1 1 5 PRO HG2 H 7.485 -4.390 -9.838 1.00 . A A . 5 PRO HG2 1 1
18 2075 1 1 5 PRO HG3 H 6.542 -5.887 -9.791 1.00 . A A . 5 PRO HG3 1 1
18 2076 1 1 5 PRO N N 5.540 -3.720 -7.663 1.00 . A A . 5 PRO N 1 1
18 2077 1 1 5 PRO O O 9.021 -3.253 -6.759 1.00 . A A . 5 PRO O 1 1
18 2078 1 1 6 VAL C C 7.696 0.355 -5.875 1.00 . A A . 6 VAL C 1 1
18 2079 1 1 6 VAL CA C 8.196 -0.610 -6.946 1.00 . A A . 6 VAL CA 1 1
18 2080 1 1 6 VAL CB C 8.226 0.099 -8.300 1.00 . A A . 6 VAL CB 1 1
18 2081 1 1 6 VAL CG1 C 6.811 0.542 -8.676 1.00 . A A . 6 VAL CG1 1 1
18 2082 1 1 6 VAL CG2 C 9.135 1.327 -8.210 1.00 . A A . 6 VAL CG2 1 1
18 2083 1 1 6 VAL H H 6.368 -1.665 -7.145 1.00 . A A . 6 VAL H 1 1
18 2084 1 1 6 VAL HA H 9.197 -0.923 -6.694 1.00 . A A . 6 VAL HA 1 1
18 2085 1 1 6 VAL HB H 8.603 -0.578 -9.052 1.00 . A A . 6 VAL HB 1 1
18 2086 1 1 6 VAL HG11 H 6.474 1.300 -7.984 1.00 . A A . 6 VAL HG11 1 1
18 2087 1 1 6 VAL HG12 H 6.144 -0.306 -8.634 1.00 . A A . 6 VAL HG12 1 1
18 2088 1 1 6 VAL HG13 H 6.814 0.946 -9.678 1.00 . A A . 6 VAL HG13 1 1
18 2089 1 1 6 VAL HG21 H 10.001 1.090 -7.610 1.00 . A A . 6 VAL HG21 1 1
18 2090 1 1 6 VAL HG22 H 8.595 2.144 -7.756 1.00 . A A . 6 VAL HG22 1 1
18 2091 1 1 6 VAL HG23 H 9.454 1.613 -9.203 1.00 . A A . 6 VAL HG23 1 1
18 2092 1 1 6 VAL N N 7.331 -1.785 -7.019 1.00 . A A . 6 VAL N 1 1
18 2093 1 1 6 VAL O O 8.388 1.306 -5.510 1.00 . A A . 6 VAL O 1 1
18 2094 1 1 7 CYS C C 6.141 0.364 -2.961 1.00 . A A . 7 CYS C 1 1
18 2095 1 1 7 CYS CA C 5.908 0.959 -4.346 1.00 . A A . 7 CYS CA 1 1
18 2096 1 1 7 CYS CB C 4.406 1.120 -4.588 1.00 . A A . 7 CYS CB 1 1
18 2097 1 1 7 CYS H H 5.983 -0.667 -5.704 1.00 . A A . 7 CYS H 1 1
18 2098 1 1 7 CYS HA H 6.374 1.931 -4.393 1.00 . A A . 7 CYS HA 1 1
18 2099 1 1 7 CYS HB2 H 4.231 1.988 -5.207 1.00 . A A . 7 CYS HB2 1 1
18 2100 1 1 7 CYS HB3 H 4.026 0.241 -5.088 1.00 . A A . 7 CYS HB3 1 1
18 2101 1 1 7 CYS N N 6.489 0.105 -5.375 1.00 . A A . 7 CYS N 1 1
18 2102 1 1 7 CYS O O 6.220 -0.854 -2.809 1.00 . A A . 7 CYS O 1 1
18 2103 1 1 7 CYS SG S 3.555 1.327 -3.004 1.00 . A A . 7 CYS SG 1 1
18 2104 1 1 8 NH2 HN1 H 6.192 2.131 -2.053 1.00 . A A . 8 NH2 HN1 1 1
18 2105 1 1 8 NH2 HN2 H 6.406 0.787 -1.038 1.00 . A A . 8 NH2 HN2 1 1
18 2106 1 1 8 NH2 N N 6.255 1.160 -1.932 1.00 . A A . 8 NH2 N 1 1
19 2107 1 1 1 CYS C C 2.271 -2.132 -2.276 1.00 . A A . 1 CYS C 1 1
19 2108 1 1 1 CYS CA C 2.089 -1.060 -1.208 1.00 . A A . 1 CYS CA 1 1
19 2109 1 1 1 CYS CB C 1.145 0.030 -1.719 1.00 . A A . 1 CYS CB 1 1
19 2110 1 1 1 CYS H1 H 3.678 -0.709 0.091 1.00 . A A . 1 CYS H1 1 1
19 2111 1 1 1 CYS H2 H 3.352 0.579 -0.968 1.00 . A A . 1 CYS H2 1 1
19 2112 1 1 1 CYS H3 H 4.131 -0.818 -1.539 1.00 . A A . 1 CYS H3 1 1
19 2113 1 1 1 CYS HA H 1.671 -1.508 -0.319 1.00 . A A . 1 CYS HA 1 1
19 2114 1 1 1 CYS HB2 H 0.148 -0.374 -1.814 1.00 . A A . 1 CYS HB2 1 1
19 2115 1 1 1 CYS HB3 H 1.136 0.853 -1.021 1.00 . A A . 1 CYS HB3 1 1
19 2116 1 1 1 CYS N N 3.412 -0.457 -0.881 1.00 . A A . 1 CYS N 1 1
19 2117 1 1 1 CYS O O 3.311 -2.199 -2.932 1.00 . A A . 1 CYS O 1 1
19 2118 1 1 1 CYS SG S 1.715 0.614 -3.335 1.00 . A A . 1 CYS SG 1 1
19 2119 1 1 2 ARG C C 0.833 -3.544 -4.791 1.00 . A A . 2 ARG C 1 1
19 2120 1 1 2 ARG CA C 1.311 -4.037 -3.431 1.00 . A A . 2 ARG CA 1 1
19 2121 1 1 2 ARG CB C 0.444 -5.205 -2.977 1.00 . A A . 2 ARG CB 1 1
19 2122 1 1 2 ARG CD C 2.001 -7.117 -2.519 1.00 . A A . 2 ARG CD 1 1
19 2123 1 1 2 ARG CG C 1.019 -6.512 -3.525 1.00 . A A . 2 ARG CG 1 1
19 2124 1 1 2 ARG CZ C 1.856 -8.379 -0.449 1.00 . A A . 2 ARG CZ 1 1
19 2125 1 1 2 ARG H H 0.452 -2.871 -1.890 1.00 . A A . 2 ARG H 1 1
19 2126 1 1 2 ARG HA H 2.327 -4.379 -3.523 1.00 . A A . 2 ARG HA 1 1
19 2127 1 1 2 ARG HB2 H 0.423 -5.242 -1.897 1.00 . A A . 2 ARG HB2 1 1
19 2128 1 1 2 ARG HB3 H -0.561 -5.074 -3.351 1.00 . A A . 2 ARG HB3 1 1
19 2129 1 1 2 ARG HD2 H 2.749 -7.685 -3.053 1.00 . A A . 2 ARG HD2 1 1
19 2130 1 1 2 ARG HD3 H 2.485 -6.323 -1.967 1.00 . A A . 2 ARG HD3 1 1
19 2131 1 1 2 ARG HE H 0.398 -8.313 -1.819 1.00 . A A . 2 ARG HE 1 1
19 2132 1 1 2 ARG HG2 H 0.213 -7.198 -3.698 1.00 . A A . 2 ARG HG2 1 1
19 2133 1 1 2 ARG HG3 H 1.535 -6.328 -4.454 1.00 . A A . 2 ARG HG3 1 1
19 2134 1 1 2 ARG HH11 H 0.288 -9.483 0.125 1.00 . A A . 2 ARG HH11 1 1
19 2135 1 1 2 ARG HH12 H 1.625 -9.452 1.225 1.00 . A A . 2 ARG HH12 1 1
19 2136 1 1 2 ARG HH21 H 3.552 -7.362 -0.760 1.00 . A A . 2 ARG HH21 1 1
19 2137 1 1 2 ARG HH22 H 3.473 -8.252 0.724 1.00 . A A . 2 ARG HH22 1 1
19 2138 1 1 2 ARG N N 1.254 -2.970 -2.443 1.00 . A A . 2 ARG N 1 1
19 2139 1 1 2 ARG NE N 1.298 -7.998 -1.593 1.00 . A A . 2 ARG NE 1 1
19 2140 1 1 2 ARG NH1 N 1.205 -9.166 0.363 1.00 . A A . 2 ARG NH1 1 1
19 2141 1 1 2 ARG NH2 N 3.054 -7.966 -0.137 1.00 . A A . 2 ARG NH2 1 1
19 2142 1 1 2 ARG O O 0.857 -2.347 -5.076 1.00 . A A . 2 ARG O 1 1
19 2143 1 1 3 DTR C C 1.027 -3.413 -7.734 1.00 . A A . 3 DTR C 1 1
19 2144 1 1 3 DTR CA C -0.062 -4.152 -6.962 1.00 . A A . 3 DTR CA 1 1
19 2145 1 1 3 DTR CB C -0.444 -5.433 -7.708 1.00 . A A . 3 DTR CB 1 1
19 2146 1 1 3 DTR CD1 C -0.443 -7.462 -6.201 1.00 . A A . 3 DTR CD1 1 1
19 2147 1 1 3 DTR CD2 C 1.575 -7.053 -7.101 1.00 . A A . 3 DTR CD2 1 1
19 2148 1 1 3 DTR CE2 C 1.720 -8.201 -6.288 1.00 . A A . 3 DTR CE2 1 1
19 2149 1 1 3 DTR CE3 C 2.706 -6.580 -7.786 1.00 . A A . 3 DTR CE3 1 1
19 2150 1 1 3 DTR CG C 0.193 -6.604 -7.029 1.00 . A A . 3 DTR CG 1 1
19 2151 1 1 3 DTR CH2 C 4.060 -8.371 -6.848 1.00 . A A . 3 DTR CH2 1 1
19 2152 1 1 3 DTR CZ2 C 2.947 -8.856 -6.160 1.00 . A A . 3 DTR CZ2 1 1
19 2153 1 1 3 DTR CZ3 C 3.939 -7.236 -7.659 1.00 . A A . 3 DTR CZ3 1 1
19 2154 1 1 3 DTR H H 0.423 -5.414 -5.345 1.00 . A A . 3 DTR H 1 1
19 2155 1 1 3 DTR HA H -0.932 -3.523 -6.879 1.00 . A A . 3 DTR HA 1 1
19 2156 1 1 3 DTR HB2 H -0.095 -5.374 -8.728 1.00 . A A . 3 DTR HB2 1 1
19 2157 1 1 3 DTR HB3 H -1.518 -5.550 -7.699 1.00 . A A . 3 DTR HB3 1 1
19 2158 1 1 3 DTR HD1 H -1.486 -7.415 -5.928 1.00 . A A . 3 DTR HD1 1 1
19 2159 1 1 3 DTR HE1 H 0.255 -9.150 -5.150 1.00 . A A . 3 DTR HE1 1 1
19 2160 1 1 3 DTR HE3 H 2.624 -5.706 -8.415 1.00 . A A . 3 DTR HE3 1 1
19 2161 1 1 3 DTR HH2 H 5.013 -8.869 -6.755 1.00 . A A . 3 DTR HH2 1 1
19 2162 1 1 3 DTR HZ2 H 3.038 -9.728 -5.534 1.00 . A A . 3 DTR HZ2 1 1
19 2163 1 1 3 DTR HZ3 H 4.800 -6.867 -8.188 1.00 . A A . 3 DTR HZ3 1 1
19 2164 1 1 3 DTR N N 0.410 -4.482 -5.628 1.00 . A A . 3 DTR N 1 1
19 2165 1 1 3 DTR NE1 N 0.462 -8.412 -5.761 1.00 . A A . 3 DTR NE1 1 1
19 2166 1 1 3 DTR O O 0.814 -2.968 -8.860 1.00 . A A . 3 DTR O 1 1
19 2167 1 1 4 THR C C 4.626 -3.031 -7.002 1.00 . A A . 4 THR C 1 1
19 2168 1 1 4 THR CA C 3.332 -2.617 -7.720 1.00 . A A . 4 THR CA 1 1
19 2169 1 1 4 THR CB C 3.155 -1.100 -7.592 1.00 . A A . 4 THR CB 1 1
19 2170 1 1 4 THR CG2 C 2.793 -0.504 -8.953 1.00 . A A . 4 THR CG2 1 1
19 2171 1 1 4 THR H H 2.298 -3.679 -6.214 1.00 . A A . 4 THR H 1 1
19 2172 1 1 4 THR HA H 3.376 -2.875 -8.762 1.00 . A A . 4 THR HA 1 1
19 2173 1 1 4 THR HB H 4.077 -0.659 -7.246 1.00 . A A . 4 THR HB 1 1
19 2174 1 1 4 THR HG1 H 2.410 -0.102 -6.099 1.00 . A A . 4 THR HG1 1 1
19 2175 1 1 4 THR HG21 H 2.687 0.566 -8.860 1.00 . A A . 4 THR HG21 1 1
19 2176 1 1 4 THR HG22 H 1.861 -0.928 -9.295 1.00 . A A . 4 THR HG22 1 1
19 2177 1 1 4 THR HG23 H 3.573 -0.729 -9.665 1.00 . A A . 4 THR HG23 1 1
19 2178 1 1 4 THR N N 2.196 -3.296 -7.109 1.00 . A A . 4 THR N 1 1
19 2179 1 1 4 THR O O 4.795 -2.719 -5.823 1.00 . A A . 4 THR O 1 1
19 2180 1 1 4 THR OG1 O 2.119 -0.823 -6.661 1.00 . A A . 4 THR OG1 1 1
19 2181 1 1 5 PRO C C 7.822 -3.026 -6.905 1.00 . A A . 5 PRO C 1 1
19 2182 1 1 5 PRO CA C 6.804 -4.159 -6.998 1.00 . A A . 5 PRO CA 1 1
19 2183 1 1 5 PRO CB C 7.312 -5.281 -7.900 1.00 . A A . 5 PRO CB 1 1
19 2184 1 1 5 PRO CD C 5.481 -4.169 -9.060 1.00 . A A . 5 PRO CD 1 1
19 2185 1 1 5 PRO CG C 6.765 -4.982 -9.258 1.00 . A A . 5 PRO CG 1 1
19 2186 1 1 5 PRO HA H 6.597 -4.556 -6.017 1.00 . A A . 5 PRO HA 1 1
19 2187 1 1 5 PRO HB2 H 8.393 -5.277 -7.921 1.00 . A A . 5 PRO HB2 1 1
19 2188 1 1 5 PRO HB3 H 6.945 -6.236 -7.555 1.00 . A A . 5 PRO HB3 1 1
19 2189 1 1 5 PRO HD2 H 5.470 -3.318 -9.727 1.00 . A A . 5 PRO HD2 1 1
19 2190 1 1 5 PRO HD3 H 4.616 -4.789 -9.222 1.00 . A A . 5 PRO HD3 1 1
19 2191 1 1 5 PRO HG2 H 7.485 -4.408 -9.825 1.00 . A A . 5 PRO HG2 1 1
19 2192 1 1 5 PRO HG3 H 6.536 -5.901 -9.774 1.00 . A A . 5 PRO HG3 1 1
19 2193 1 1 5 PRO N N 5.538 -3.725 -7.653 1.00 . A A . 5 PRO N 1 1
19 2194 1 1 5 PRO O O 9.018 -3.266 -6.739 1.00 . A A . 5 PRO O 1 1
19 2195 1 1 6 VAL C C 7.726 0.324 -5.838 1.00 . A A . 6 VAL C 1 1
19 2196 1 1 6 VAL CA C 8.199 -0.620 -6.940 1.00 . A A . 6 VAL CA 1 1
19 2197 1 1 6 VAL CB C 8.195 0.115 -8.280 1.00 . A A . 6 VAL CB 1 1
19 2198 1 1 6 VAL CG1 C 6.963 1.018 -8.365 1.00 . A A . 6 VAL CG1 1 1
19 2199 1 1 6 VAL CG2 C 9.460 0.968 -8.396 1.00 . A A . 6 VAL CG2 1 1
19 2200 1 1 6 VAL H H 6.371 -1.673 -7.144 1.00 . A A . 6 VAL H 1 1
19 2201 1 1 6 VAL HA H 9.206 -0.937 -6.720 1.00 . A A . 6 VAL HA 1 1
19 2202 1 1 6 VAL HB H 8.168 -0.605 -9.085 1.00 . A A . 6 VAL HB 1 1
19 2203 1 1 6 VAL HG11 H 7.156 1.940 -7.835 1.00 . A A . 6 VAL HG11 1 1
19 2204 1 1 6 VAL HG12 H 6.117 0.517 -7.918 1.00 . A A . 6 VAL HG12 1 1
19 2205 1 1 6 VAL HG13 H 6.747 1.236 -9.400 1.00 . A A . 6 VAL HG13 1 1
19 2206 1 1 6 VAL HG21 H 9.808 1.230 -7.409 1.00 . A A . 6 VAL HG21 1 1
19 2207 1 1 6 VAL HG22 H 9.237 1.867 -8.951 1.00 . A A . 6 VAL HG22 1 1
19 2208 1 1 6 VAL HG23 H 10.226 0.408 -8.911 1.00 . A A . 6 VAL HG23 1 1
19 2209 1 1 6 VAL N N 7.333 -1.795 -7.013 1.00 . A A . 6 VAL N 1 1
19 2210 1 1 6 VAL O O 8.478 1.186 -5.383 1.00 . A A . 6 VAL O 1 1
19 2211 1 1 7 CYS C C 6.163 0.384 -2.993 1.00 . A A . 7 CYS C 1 1
19 2212 1 1 7 CYS CA C 5.915 1.001 -4.367 1.00 . A A . 7 CYS CA 1 1
19 2213 1 1 7 CYS CB C 4.412 1.176 -4.587 1.00 . A A . 7 CYS CB 1 1
19 2214 1 1 7 CYS H H 5.923 -0.546 -5.816 1.00 . A A . 7 CYS H 1 1
19 2215 1 1 7 CYS HA H 6.389 1.970 -4.407 1.00 . A A . 7 CYS HA 1 1
19 2216 1 1 7 CYS HB2 H 4.233 2.071 -5.164 1.00 . A A . 7 CYS HB2 1 1
19 2217 1 1 7 CYS HB3 H 4.023 0.321 -5.120 1.00 . A A . 7 CYS HB3 1 1
19 2218 1 1 7 CYS N N 6.477 0.156 -5.416 1.00 . A A . 7 CYS N 1 1
19 2219 1 1 7 CYS O O 6.039 -0.828 -2.821 1.00 . A A . 7 CYS O 1 1
19 2220 1 1 7 CYS SG S 3.578 1.316 -2.985 1.00 . A A . 7 CYS SG 1 1
19 2221 1 1 8 NH2 HN1 H 6.604 2.120 -2.135 1.00 . A A . 8 NH2 HN1 1 1
19 2222 1 1 8 NH2 HN2 H 6.668 0.767 -1.112 1.00 . A A . 8 NH2 HN2 1 1
19 2223 1 1 8 NH2 N N 6.507 1.155 -1.998 1.00 . A A . 8 NH2 N 1 1
20 2224 1 1 1 CYS C C 2.278 -2.120 -2.293 1.00 . A A . 1 CYS C 1 1
20 2225 1 1 1 CYS CA C 2.100 -1.046 -1.226 1.00 . A A . 1 CYS CA 1 1
20 2226 1 1 1 CYS CB C 1.148 0.039 -1.733 1.00 . A A . 1 CYS CB 1 1
20 2227 1 1 1 CYS H1 H 4.129 -0.768 -1.596 1.00 . A A . 1 CYS H1 1 1
20 2228 1 1 1 CYS H2 H 3.711 -0.717 0.050 1.00 . A A . 1 CYS H2 1 1
20 2229 1 1 1 CYS H3 H 3.349 0.598 -0.963 1.00 . A A . 1 CYS H3 1 1
20 2230 1 1 1 CYS HA H 1.689 -1.494 -0.334 1.00 . A A . 1 CYS HA 1 1
20 2231 1 1 1 CYS HB2 H 0.153 -0.370 -1.826 1.00 . A A . 1 CYS HB2 1 1
20 2232 1 1 1 CYS HB3 H 1.134 0.861 -1.034 1.00 . A A . 1 CYS HB3 1 1
20 2233 1 1 1 CYS N N 3.422 -0.437 -0.910 1.00 . A A . 1 CYS N 1 1
20 2234 1 1 1 CYS O O 3.311 -2.181 -2.960 1.00 . A A . 1 CYS O 1 1
20 2235 1 1 1 CYS SG S 1.710 0.630 -3.350 1.00 . A A . 1 CYS SG 1 1
20 2236 1 1 2 ARG C C 0.838 -3.546 -4.793 1.00 . A A . 2 ARG C 1 1
20 2237 1 1 2 ARG CA C 1.320 -4.034 -3.434 1.00 . A A . 2 ARG CA 1 1
20 2238 1 1 2 ARG CB C 0.456 -5.203 -2.976 1.00 . A A . 2 ARG CB 1 1
20 2239 1 1 2 ARG CD C 2.023 -7.106 -2.519 1.00 . A A . 2 ARG CD 1 1
20 2240 1 1 2 ARG CG C 1.033 -6.510 -3.522 1.00 . A A . 2 ARG CG 1 1
20 2241 1 1 2 ARG CZ C 1.893 -8.352 -0.438 1.00 . A A . 2 ARG CZ 1 1
20 2242 1 1 2 ARG H H 0.467 -2.871 -1.889 1.00 . A A . 2 ARG H 1 1
20 2243 1 1 2 ARG HA H 2.337 -4.375 -3.529 1.00 . A A . 2 ARG HA 1 1
20 2244 1 1 2 ARG HB2 H 0.438 -5.238 -1.895 1.00 . A A . 2 ARG HB2 1 1
20 2245 1 1 2 ARG HB3 H -0.549 -5.074 -3.347 1.00 . A A . 2 ARG HB3 1 1
20 2246 1 1 2 ARG HD2 H 2.769 -7.675 -3.053 1.00 . A A . 2 ARG HD2 1 1
20 2247 1 1 2 ARG HD3 H 2.506 -6.309 -1.974 1.00 . A A . 2 ARG HD3 1 1
20 2248 1 1 2 ARG HE H 0.429 -8.308 -1.804 1.00 . A A . 2 ARG HE 1 1
20 2249 1 1 2 ARG HG2 H 0.229 -7.200 -3.688 1.00 . A A . 2 ARG HG2 1 1
20 2250 1 1 2 ARG HG3 H 1.544 -6.327 -4.454 1.00 . A A . 2 ARG HG3 1 1
20 2251 1 1 2 ARG HH11 H 0.335 -9.464 0.150 1.00 . A A . 2 ARG HH11 1 1
20 2252 1 1 2 ARG HH12 H 1.676 -9.415 1.245 1.00 . A A . 2 ARG HH12 1 1
20 2253 1 1 2 ARG HH21 H 3.580 -7.324 -0.763 1.00 . A A . 2 ARG HH21 1 1
20 2254 1 1 2 ARG HH22 H 3.514 -8.203 0.728 1.00 . A A . 2 ARG HH22 1 1
20 2255 1 1 2 ARG N N 1.265 -2.965 -2.449 1.00 . A A . 2 ARG N 1 1
20 2256 1 1 2 ARG NE N 1.328 -7.983 -1.583 1.00 . A A . 2 ARG NE 1 1
20 2257 1 1 2 ARG NH1 N 1.251 -9.138 0.383 1.00 . A A . 2 ARG NH1 1 1
20 2258 1 1 2 ARG NH2 N 3.088 -7.927 -0.134 1.00 . A A . 2 ARG NH2 1 1
20 2259 1 1 2 ARG O O 0.862 -2.350 -5.082 1.00 . A A . 2 ARG O 1 1
20 2260 1 1 3 DTR C C 1.020 -3.415 -7.732 1.00 . A A . 3 DTR C 1 1
20 2261 1 1 3 DTR CA C -0.065 -4.160 -6.961 1.00 . A A . 3 DTR CA 1 1
20 2262 1 1 3 DTR CB C -0.439 -5.444 -7.704 1.00 . A A . 3 DTR CB 1 1
20 2263 1 1 3 DTR CD1 C -0.433 -7.468 -6.191 1.00 . A A . 3 DTR CD1 1 1
20 2264 1 1 3 DTR CD2 C 1.582 -7.059 -7.097 1.00 . A A . 3 DTR CD2 1 1
20 2265 1 1 3 DTR CE2 C 1.731 -8.204 -6.280 1.00 . A A . 3 DTR CE2 1 1
20 2266 1 1 3 DTR CE3 C 2.711 -6.587 -7.786 1.00 . A A . 3 DTR CE3 1 1
20 2267 1 1 3 DTR CG C 0.199 -6.611 -7.023 1.00 . A A . 3 DTR CG 1 1
20 2268 1 1 3 DTR CH2 C 4.069 -8.373 -6.844 1.00 . A A . 3 DTR CH2 1 1
20 2269 1 1 3 DTR CZ2 C 2.959 -8.856 -6.153 1.00 . A A . 3 DTR CZ2 1 1
20 2270 1 1 3 DTR CZ3 C 3.945 -7.242 -7.659 1.00 . A A . 3 DTR CZ3 1 1
20 2271 1 1 3 DTR H H 0.424 -5.417 -5.341 1.00 . A A . 3 DTR H 1 1
20 2272 1 1 3 DTR HA H -0.938 -3.535 -6.877 1.00 . A A . 3 DTR HA 1 1
20 2273 1 1 3 DTR HB2 H -0.088 -5.385 -8.724 1.00 . A A . 3 DTR HB2 1 1
20 2274 1 1 3 DTR HB3 H -1.513 -5.564 -7.699 1.00 . A A . 3 DTR HB3 1 1
20 2275 1 1 3 DTR HD1 H -1.476 -7.420 -5.915 1.00 . A A . 3 DTR HD1 1 1
20 2276 1 1 3 DTR HE1 H 0.269 -9.151 -5.135 1.00 . A A . 3 DTR HE1 1 1
20 2277 1 1 3 DTR HE3 H 2.627 -5.716 -8.417 1.00 . A A . 3 DTR HE3 1 1
20 2278 1 1 3 DTR HH2 H 5.023 -8.870 -6.752 1.00 . A A . 3 DTR HH2 1 1
20 2279 1 1 3 DTR HZ2 H 3.051 -9.726 -5.523 1.00 . A A . 3 DTR HZ2 1 1
20 2280 1 1 3 DTR HZ3 H 4.805 -6.873 -8.192 1.00 . A A . 3 DTR HZ3 1 1
20 2281 1 1 3 DTR N N 0.411 -4.486 -5.627 1.00 . A A . 3 DTR N 1 1
20 2282 1 1 3 DTR NE1 N 0.474 -8.415 -5.749 1.00 . A A . 3 DTR NE1 1 1
20 2283 1 1 3 DTR O O 0.800 -2.960 -8.853 1.00 . A A . 3 DTR O 1 1
20 2284 1 1 4 THR C C 4.620 -3.030 -7.003 1.00 . A A . 4 THR C 1 1
20 2285 1 1 4 THR CA C 3.325 -2.619 -7.722 1.00 . A A . 4 THR CA 1 1
20 2286 1 1 4 THR CB C 3.142 -1.105 -7.596 1.00 . A A . 4 THR CB 1 1
20 2287 1 1 4 THR CG2 C 2.790 -0.508 -8.958 1.00 . A A . 4 THR CG2 1 1
20 2288 1 1 4 THR H H 2.298 -3.694 -6.221 1.00 . A A . 4 THR H 1 1
20 2289 1 1 4 THR HA H 3.372 -2.879 -8.764 1.00 . A A . 4 THR HA 1 1
20 2290 1 1 4 THR HB H 4.059 -0.660 -7.241 1.00 . A A . 4 THR HB 1 1
20 2291 1 1 4 THR HG1 H 1.400 -0.368 -7.142 1.00 . A A . 4 THR HG1 1 1
20 2292 1 1 4 THR HG21 H 2.684 0.563 -8.866 1.00 . A A . 4 THR HG21 1 1
20 2293 1 1 4 THR HG22 H 1.860 -0.931 -9.306 1.00 . A A . 4 THR HG22 1 1
20 2294 1 1 4 THR HG23 H 3.575 -0.732 -9.665 1.00 . A A . 4 THR HG23 1 1
20 2295 1 1 4 THR N N 2.192 -3.303 -7.112 1.00 . A A . 4 THR N 1 1
20 2296 1 1 4 THR O O 4.786 -2.714 -5.824 1.00 . A A . 4 THR O 1 1
20 2297 1 1 4 THR OG1 O 2.097 -0.831 -6.672 1.00 . A A . 4 THR OG1 1 1
20 2298 1 1 5 PRO C C 7.817 -3.019 -6.904 1.00 . A A . 5 PRO C 1 1
20 2299 1 1 5 PRO CA C 6.801 -4.153 -6.994 1.00 . A A . 5 PRO CA 1 1
20 2300 1 1 5 PRO CB C 7.311 -5.276 -7.892 1.00 . A A . 5 PRO CB 1 1
20 2301 1 1 5 PRO CD C 5.480 -4.170 -9.057 1.00 . A A . 5 PRO CD 1 1
20 2302 1 1 5 PRO CG C 6.765 -4.980 -9.251 1.00 . A A . 5 PRO CG 1 1
20 2303 1 1 5 PRO HA H 6.594 -4.546 -6.012 1.00 . A A . 5 PRO HA 1 1
20 2304 1 1 5 PRO HB2 H 8.392 -5.272 -7.912 1.00 . A A . 5 PRO HB2 1 1
20 2305 1 1 5 PRO HB3 H 6.944 -6.231 -7.544 1.00 . A A . 5 PRO HB3 1 1
20 2306 1 1 5 PRO HD2 H 5.468 -3.320 -9.726 1.00 . A A . 5 PRO HD2 1 1
20 2307 1 1 5 PRO HD3 H 4.615 -4.791 -9.218 1.00 . A A . 5 PRO HD3 1 1
20 2308 1 1 5 PRO HG2 H 7.485 -4.407 -9.820 1.00 . A A . 5 PRO HG2 1 1
20 2309 1 1 5 PRO HG3 H 6.536 -5.901 -9.765 1.00 . A A . 5 PRO HG3 1 1
20 2310 1 1 5 PRO N N 5.534 -3.723 -7.652 1.00 . A A . 5 PRO N 1 1
20 2311 1 1 5 PRO O O 9.013 -3.257 -6.737 1.00 . A A . 5 PRO O 1 1
20 2312 1 1 6 VAL C C 7.710 0.342 -5.854 1.00 . A A . 6 VAL C 1 1
20 2313 1 1 6 VAL CA C 8.193 -0.613 -6.941 1.00 . A A . 6 VAL CA 1 1
20 2314 1 1 6 VAL CB C 8.202 0.110 -8.289 1.00 . A A . 6 VAL CB 1 1
20 2315 1 1 6 VAL CG1 C 6.968 1.008 -8.395 1.00 . A A . 6 VAL CG1 1 1
20 2316 1 1 6 VAL CG2 C 9.466 0.966 -8.397 1.00 . A A . 6 VAL CG2 1 1
20 2317 1 1 6 VAL H H 6.365 -1.665 -7.143 1.00 . A A . 6 VAL H 1 1
20 2318 1 1 6 VAL HA H 9.198 -0.928 -6.709 1.00 . A A . 6 VAL HA 1 1
20 2319 1 1 6 VAL HB H 8.188 -0.618 -9.087 1.00 . A A . 6 VAL HB 1 1
20 2320 1 1 6 VAL HG11 H 6.125 0.518 -7.931 1.00 . A A . 6 VAL HG11 1 1
20 2321 1 1 6 VAL HG12 H 6.748 1.195 -9.435 1.00 . A A . 6 VAL HG12 1 1
20 2322 1 1 6 VAL HG13 H 7.161 1.944 -7.893 1.00 . A A . 6 VAL HG13 1 1
20 2323 1 1 6 VAL HG21 H 9.792 1.255 -7.409 1.00 . A A . 6 VAL HG21 1 1
20 2324 1 1 6 VAL HG22 H 9.252 1.852 -8.979 1.00 . A A . 6 VAL HG22 1 1
20 2325 1 1 6 VAL HG23 H 10.246 0.398 -8.882 1.00 . A A . 6 VAL HG23 1 1
20 2326 1 1 6 VAL N N 7.327 -1.787 -7.012 1.00 . A A . 6 VAL N 1 1
20 2327 1 1 6 VAL O O 8.434 1.252 -5.448 1.00 . A A . 6 VAL O 1 1
20 2328 1 1 7 CYS C C 6.137 0.365 -2.970 1.00 . A A . 7 CYS C 1 1
20 2329 1 1 7 CYS CA C 5.915 0.982 -4.347 1.00 . A A . 7 CYS CA 1 1
20 2330 1 1 7 CYS CB C 4.416 1.170 -4.589 1.00 . A A . 7 CYS CB 1 1
20 2331 1 1 7 CYS H H 5.951 -0.608 -5.749 1.00 . A A . 7 CYS H 1 1
20 2332 1 1 7 CYS HA H 6.396 1.947 -4.381 1.00 . A A . 7 CYS HA 1 1
20 2333 1 1 7 CYS HB2 H 4.256 2.056 -5.185 1.00 . A A . 7 CYS HB2 1 1
20 2334 1 1 7 CYS HB3 H 4.024 0.309 -5.109 1.00 . A A . 7 CYS HB3 1 1
20 2335 1 1 7 CYS N N 6.483 0.131 -5.387 1.00 . A A . 7 CYS N 1 1
20 2336 1 1 7 CYS O O 6.194 -0.857 -2.834 1.00 . A A . 7 CYS O 1 1
20 2337 1 1 7 CYS SG S 3.565 1.352 -3.001 1.00 . A A . 7 CYS SG 1 1
20 2338 1 1 8 NH2 HN1 H 6.221 2.118 -2.041 1.00 . A A . 8 NH2 HN1 1 1
20 2339 1 1 8 NH2 HN2 H 6.410 0.758 -1.043 1.00 . A A . 8 NH2 HN2 1 1
20 2340 1 1 8 NH2 N N 6.266 1.145 -1.931 1.00 . A A . 8 NH2 N 1 1
stop_
save_
Contact the webmaster for help, if required. Tuesday, April 30, 2024 7:43:35 PM GMT (wattos1)