Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
596441 | 2n6h RC | 25764 | cing | 4-filtered-FRED | STAR | entry | full | 37 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2n6h
# This FRED archive file contains, for PDB entry <2n6h>:
#
# - 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_2n6h
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2n6h
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1896.24
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 $designed_2_stranded_parallel_beta_sheet A . 1 1
stop_
save_
save_designed_2_stranded_parallel_beta_sheet
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "designed 2 stranded parallel beta sheet"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XERFYEKXXVQKFIRX
_Entity.Number_of_monomers 16
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 ACE $ACE 1 1
2 GLU . 1 1
3 ARG . 1 1
4 PHE . 1 1
5 TYR . 1 1
6 GLU . 1 1
7 LYS . 1 1
8 . $. 1 1
9 DPR $DPR 1 1
10 VAL . 1 1
11 GLN . 1 1
12 LYS . 1 1
13 PHE . 1 1
14 ILE . 1 1
15 ARG . 1 1
16 ACE $ACE 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
ACE 1 1 1 1
GLU 2 2 1 1
ARG 3 3 1 1
PHE 4 4 1 1
TYR 5 5 1 1
GLU 6 6 1 1
LYS 7 7 1 1
. 8 8 1 1
DPR 9 9 1 1
VAL 10 10 1 1
GLN 11 11 1 1
LYS 12 12 1 1
PHE 13 13 1 1
ILE 14 14 1 1
ARG 15 15 1 1
ACE 16 16 1 1
stop_
save_
save_DPR
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID DPR
_Chem_comp.Type non-polymer
save_
save_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACE
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_3_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
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 GLU HA . 5 . HA 1 1
1 1 2 1 1 2 GLU QB . 5 . HB# 1 1
2 1 1 1 1 2 GLU H . 5 . HN 1 1
2 1 2 1 1 2 GLU HA . 5 . HA 1 1
3 1 1 1 1 2 GLU HA . 5 . HA 1 1
3 1 2 1 1 3 ARG H . 6 . HN 1 1
4 1 1 1 1 2 GLU QB . 5 . HB# 1 1
4 1 2 1 1 2 GLU QG . 5 . HG# 1 1
5 1 1 1 1 2 GLU H . 5 . HN 1 1
5 1 2 1 1 2 GLU QB . 5 . HB# 1 1
6 1 1 1 1 3 ARG H . 6 . HN 1 1
6 1 2 1 1 3 ARG HA . 6 . HA 1 1
7 1 1 1 1 3 ARG QB . 6 . HB2 1 1
7 1 2 1 1 3 ARG HE . 6 . HE# 1 1
8 1 1 1 1 3 ARG H . 6 . HN 1 1
8 1 2 1 1 3 ARG QB . 6 . HB2 1 1
9 1 1 1 1 3 ARG H . 6 . HN 1 1
9 1 2 1 1 3 ARG QD . 6 . HD# 1 1
10 1 1 1 1 3 ARG HE . 6 . HE# 1 1
10 1 2 1 1 3 ARG QG . 6 . HG2 1 1
11 1 1 1 1 3 ARG H . 6 . HN 1 1
11 1 2 1 1 3 ARG QG . 6 . HG2 1 1
12 1 1 1 1 5 TYR HA . 8 . HA 1 1
12 1 2 1 1 5 TYR QB . 8 . HB2 1 1
13 1 1 1 1 5 TYR HA . 8 . HA 1 1
13 1 2 1 1 5 TYR QD . 8 . HD# 1 1
14 1 1 1 1 5 TYR QB . 8 . HB2 1 1
14 1 2 1 1 5 TYR QD . 8 . HD# 1 1
15 1 1 1 1 6 GLU HA . 9 . HA 1 1
15 1 2 1 1 6 GLU QG . 9 . HG* 1 1
16 1 1 1 1 6 GLU H . 9 . HN 1 1
16 1 2 1 1 6 GLU HA . 9 . HA 1 1
17 1 1 1 1 6 GLU H . 9 . HN 1 1
17 1 2 1 1 6 GLU QG . 9 . HG* 1 1
18 1 1 1 1 7 LYS HA . 10 . HA 1 1
18 1 2 1 1 7 LYS QB . 10 . HB# 1 1
19 1 1 1 1 7 LYS H . 10 . HN 1 1
19 1 2 1 1 7 LYS HA . 10 . HA 1 1
20 1 1 1 1 7 LYS QB . 10 . HB# 1 1
20 1 2 1 1 7 LYS QG . 10 . HG# 1 1
21 1 1 1 1 7 LYS H . 10 . HN 1 1
21 1 2 1 1 7 LYS QB . 10 . HB# 1 1
22 1 1 1 1 7 LYS H . 10 . HN 1 1
22 1 2 1 1 7 LYS QG . 10 . HG# 1 1
23 1 1 1 1 10 VAL HA . 13 . HA 1 1
23 1 2 1 1 10 VAL HB . 13 . HB 1 1
24 1 1 1 1 10 VAL HA . 13 . HA 1 1
24 1 2 1 1 10 VAL MG1 . 13 . HG11 1 1
25 1 1 1 1 10 VAL H . 13 . HN 1 1
25 1 2 1 1 10 VAL HA . 13 . HA 1 1
26 1 1 1 1 10 VAL HB . 13 . HB 1 1
26 1 2 1 1 10 VAL QG . 13 . HG1# 1 1
27 1 1 1 1 10 VAL H . 13 . HN 1 1
27 1 2 1 1 10 VAL HB . 13 . HB 1 1
28 1 1 1 1 10 VAL H . 13 . HN 1 1
28 1 2 1 1 10 VAL MG1 . 13 . HG11 1 1
29 1 1 1 1 10 VAL H . 13 . HN 1 1
29 1 2 1 1 11 GLN HA . 14 . HA 1 1
30 1 1 1 1 11 GLN H . 14 . HN 1 1
30 1 2 1 1 11 GLN HA . 14 . HA 1 1
31 1 1 1 1 11 GLN H . 14 . HN 1 1
31 1 2 1 1 11 GLN QB . 14 . HB2 1 1
32 1 1 1 1 11 GLN H . 14 . HN 1 1
32 1 2 1 1 11 GLN QG . 14 . HG# 1 1
33 1 1 1 1 10 VAL H . 13 . HN 1 1
33 1 2 1 1 11 GLN QG . 14 . HG# 1 1
34 1 1 1 1 5 TYR QD . 8 . HD# 1 1
34 1 2 1 1 6 GLU HA . 9 . HA 1 1
35 1 1 1 1 3 ARG HA . 6 . HA 1 1
35 1 2 1 1 6 GLU H . 9 . HN 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 . . . . . 4.1 2.2 5.5 1 1
2 1 . . . . . 2.7 1.7 3.7 1 1
3 1 . . . . . 2.2 1.4 3.0 1 1
4 1 . . . . . 2.0 1.3 2.7 1 1
5 1 . . . . . 2.3 1.5 3.1 1 1
6 1 . . . . . 2.9 1.9 3.9 1 1
7 1 . . . . . 4.7 1.8 6.3 1 1
8 1 . . . . . 3.1 2.0 4.2 1 1
9 1 . . . . . 2.8 1.8 5.0 1 1
10 1 . . . . . 2.8 1.8 5.0 1 1
11 1 . . . . . 3.1 2.0 4.2 1 1
12 1 . . . . . 3.4 2.2 3.6 1 1
13 1 . . . . . 4.4 2.8 6.0 1 1
14 1 . . . . . 3.0 1.9 3.8 1 1
15 1 . . . . . 2.6 1.7 3.5 1 1
16 1 . . . . . 2.8 1.8 3.8 1 1
17 1 . . . . . 2.4 1.5 3.3 1 1
18 1 . . . . . 3.6 2.3 4.9 1 1
19 1 . . . . . 2.2 1.4 3.0 1 1
20 1 . . . . . 1.9 1.2 2.6 1 1
21 1 . . . . . 2.6 1.7 3.5 1 1
22 1 . . . . . 2.5 1.6 5.0 1 1
23 1 . . . . . 2.9 1.9 3.9 1 1
24 1 . . . . . 2.4 1.6 3.2 1 1
25 1 . . . . . 2.4 1.6 3.2 1 1
26 1 . . . . . 3.1 2.0 4.2 1 1
27 1 . . . . . 2.5 1.6 5.0 1 1
28 1 . . . . . 2.6 1.7 5.0 1 1
29 1 . . . . . 2.2 1.4 3.0 1 1
30 1 . . . . . 2.6 1.7 3.5 1 1
31 1 . . . . . 2.7 1.7 3.0 1 1
32 1 . . . . . 3.2 2.1 4.3 1 1
33 1 . . . . . 2.5 1.5 3.5 1 1
34 1 . . . . . 2.5 1.5 3.5 1 1
35 1 . . . . . 1.3 0.3 5.0 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 GLU O . 5 . O 1 2
1 1 2 1 1 6 GLU H . 9 . HN 1 2
2 1 1 1 1 2 GLU O . 5 . O 1 2
2 1 2 1 1 6 GLU N . 9 . N 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 1.9 1.5 2.5 1 2
2 1 . . . . . 2.9 2.4 3.6 1 2
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 ACE C C 4.927 0.965 -4.782 1.00 . A A . 0 ACE C 1 1
1 2 1 1 1 ACE CH3 C 3.513 1.396 -4.406 1.00 . A A . 0 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 2.809 0.647 -4.737 1.00 . A A . 0 ACE H1 1 1
1 4 1 1 1 ACE H2 H 3.286 2.340 -4.879 1.00 . A A . 0 ACE H2 1 1
1 5 1 1 1 ACE H3 H 3.444 1.505 -3.333 1.00 . A A . 0 ACE H3 1 1
1 6 1 1 1 ACE O O 5.209 -0.227 -4.905 1.00 . A A . 0 ACE O 1 1
1 7 1 1 2 GLU C C 7.999 1.280 -4.084 1.00 . A A . 1 GLU C 1 1
1 8 1 1 2 GLU CA C 7.194 1.648 -5.328 1.00 . A A . 1 GLU CA 1 1
1 9 1 1 2 GLU CB C 7.830 2.872 -5.995 1.00 . A A . 1 GLU CB 1 1
1 10 1 1 2 GLU CD C 7.010 2.229 -8.321 1.00 . A A . 1 GLU CD 1 1
1 11 1 1 2 GLU CG C 7.037 3.314 -7.241 1.00 . A A . 1 GLU CG 1 1
1 12 1 1 2 GLU H H 5.530 2.873 -4.853 1.00 . A A . 1 GLU H 1 1
1 13 1 1 2 GLU HA H 7.219 0.816 -6.008 1.00 . A A . 1 GLU HA 1 1
1 14 1 1 2 GLU HB2 H 7.854 3.687 -5.287 1.00 . A A . 1 GLU HB2 1 1
1 15 1 1 2 GLU HB3 H 8.841 2.631 -6.288 1.00 . A A . 1 GLU HB3 1 1
1 16 1 1 2 GLU HG2 H 6.023 3.540 -6.949 1.00 . A A . 1 GLU HG2 1 1
1 17 1 1 2 GLU HG3 H 7.493 4.205 -7.648 1.00 . A A . 1 GLU HG3 1 1
1 18 1 1 2 GLU N N 5.811 1.941 -4.964 1.00 . A A . 1 GLU N 1 1
1 19 1 1 2 GLU O O 7.922 1.959 -3.055 1.00 . A A . 1 GLU O 1 1
1 20 1 1 2 GLU OE1 O 6.476 1.164 -8.068 1.00 . A A . 1 GLU OE1 1 1
1 21 1 1 2 GLU OE2 O 7.530 2.485 -9.394 1.00 . A A . 1 GLU OE2 1 1
1 22 1 1 3 ARG C C 11.075 0.003 -3.279 1.00 . A A . 2 ARG C 1 1
1 23 1 1 3 ARG CA C 9.601 -0.265 -3.071 1.00 . A A . 2 ARG CA 1 1
1 24 1 1 3 ARG CB C 9.448 -1.766 -2.855 1.00 . A A . 2 ARG CB 1 1
1 25 1 1 3 ARG CD C 7.963 -3.615 -2.231 1.00 . A A . 2 ARG CD 1 1
1 26 1 1 3 ARG CG C 8.024 -2.111 -2.450 1.00 . A A . 2 ARG CG 1 1
1 27 1 1 3 ARG CZ C 9.075 -5.238 -0.801 1.00 . A A . 2 ARG CZ 1 1
1 28 1 1 3 ARG H H 8.795 -0.297 -5.034 1.00 . A A . 2 ARG H 1 1
1 29 1 1 3 ARG HA H 9.289 0.234 -2.167 1.00 . A A . 2 ARG HA 1 1
1 30 1 1 3 ARG HB2 H 9.690 -2.283 -3.772 1.00 . A A . 2 ARG HB2 1 1
1 31 1 1 3 ARG HB3 H 10.126 -2.088 -2.075 1.00 . A A . 2 ARG HB3 1 1
1 32 1 1 3 ARG HD2 H 6.970 -3.895 -1.912 1.00 . A A . 2 ARG HD2 1 1
1 33 1 1 3 ARG HD3 H 8.206 -4.126 -3.150 1.00 . A A . 2 ARG HD3 1 1
1 34 1 1 3 ARG HE H 9.516 -3.278 -0.819 1.00 . A A . 2 ARG HE 1 1
1 35 1 1 3 ARG HG2 H 7.768 -1.592 -1.536 1.00 . A A . 2 ARG HG2 1 1
1 36 1 1 3 ARG HG3 H 7.340 -1.831 -3.237 1.00 . A A . 2 ARG HG3 1 1
1 37 1 1 3 ARG HH11 H 7.615 -5.937 -1.978 1.00 . A A . 2 ARG HH11 1 1
1 38 1 1 3 ARG HH12 H 8.418 -7.119 -1.000 1.00 . A A . 2 ARG HH12 1 1
1 39 1 1 3 ARG HH21 H 10.570 -4.828 0.466 1.00 . A A . 2 ARG HH21 1 1
1 40 1 1 3 ARG HH22 H 10.092 -6.490 0.383 1.00 . A A . 2 ARG HH22 1 1
1 41 1 1 3 ARG N N 8.777 0.199 -4.188 1.00 . A A . 2 ARG N 1 1
1 42 1 1 3 ARG NE N 8.929 -3.978 -1.199 1.00 . A A . 2 ARG NE 1 1
1 43 1 1 3 ARG NH1 N 8.310 -6.171 -1.298 1.00 . A A . 2 ARG NH1 1 1
1 44 1 1 3 ARG NH2 N 9.983 -5.543 0.085 1.00 . A A . 2 ARG NH2 1 1
1 45 1 1 3 ARG O O 11.611 -0.156 -4.376 1.00 . A A . 2 ARG O 1 1
1 46 1 1 4 PHE C C 13.704 0.676 -0.784 1.00 . A A . 3 PHE C 1 1
1 47 1 1 4 PHE CA C 13.154 0.587 -2.200 1.00 . A A . 3 PHE CA 1 1
1 48 1 1 4 PHE CB C 13.519 1.879 -2.940 1.00 . A A . 3 PHE CB 1 1
1 49 1 1 4 PHE CD1 C 15.875 1.154 -3.516 1.00 . A A . 3 PHE CD1 1 1
1 50 1 1 4 PHE CD2 C 15.570 3.090 -2.090 1.00 . A A . 3 PHE CD2 1 1
1 51 1 1 4 PHE CE1 C 17.265 1.293 -3.399 1.00 . A A . 3 PHE CE1 1 1
1 52 1 1 4 PHE CE2 C 16.958 3.231 -1.974 1.00 . A A . 3 PHE CE2 1 1
1 53 1 1 4 PHE CG C 15.025 2.057 -2.866 1.00 . A A . 3 PHE CG 1 1
1 54 1 1 4 PHE CZ C 17.806 2.332 -2.630 1.00 . A A . 3 PHE CZ 1 1
1 55 1 1 4 PHE H H 11.242 0.423 -1.337 1.00 . A A . 3 PHE H 1 1
1 56 1 1 4 PHE HA H 13.616 -0.250 -2.698 1.00 . A A . 3 PHE HA 1 1
1 57 1 1 4 PHE HB2 H 13.210 1.802 -3.973 1.00 . A A . 3 PHE HB2 1 1
1 58 1 1 4 PHE HB3 H 13.025 2.722 -2.479 1.00 . A A . 3 PHE HB3 1 1
1 59 1 1 4 PHE HD1 H 15.460 0.356 -4.115 1.00 . A A . 3 PHE HD1 1 1
1 60 1 1 4 PHE HD2 H 14.917 3.776 -1.581 1.00 . A A . 3 PHE HD2 1 1
1 61 1 1 4 PHE HE1 H 17.920 0.596 -3.900 1.00 . A A . 3 PHE HE1 1 1
1 62 1 1 4 PHE HE2 H 17.374 4.032 -1.371 1.00 . A A . 3 PHE HE2 1 1
1 63 1 1 4 PHE HZ H 18.878 2.437 -2.540 1.00 . A A . 3 PHE HZ 1 1
1 64 1 1 4 PHE N N 11.728 0.356 -2.185 1.00 . A A . 3 PHE N 1 1
1 65 1 1 4 PHE O O 13.244 1.483 0.023 1.00 . A A . 3 PHE O 1 1
1 66 1 1 5 TYR C C 16.760 -0.660 0.627 1.00 . A A . 4 TYR C 1 1
1 67 1 1 5 TYR CA C 15.370 -0.081 0.791 1.00 . A A . 4 TYR CA 1 1
1 68 1 1 5 TYR CB C 14.559 -0.887 1.822 1.00 . A A . 4 TYR CB 1 1
1 69 1 1 5 TYR CD1 C 15.721 -3.108 1.622 1.00 . A A . 4 TYR CD1 1 1
1 70 1 1 5 TYR CD2 C 13.395 -2.947 0.968 1.00 . A A . 4 TYR CD2 1 1
1 71 1 1 5 TYR CE1 C 15.737 -4.451 1.272 1.00 . A A . 4 TYR CE1 1 1
1 72 1 1 5 TYR CE2 C 13.403 -4.299 0.619 1.00 . A A . 4 TYR CE2 1 1
1 73 1 1 5 TYR CG C 14.550 -2.353 1.476 1.00 . A A . 4 TYR CG 1 1
1 74 1 1 5 TYR CZ C 14.575 -5.056 0.771 1.00 . A A . 4 TYR CZ 1 1
1 75 1 1 5 TYR H H 15.074 -0.715 -1.204 1.00 . A A . 4 TYR H 1 1
1 76 1 1 5 TYR HA H 15.448 0.936 1.121 1.00 . A A . 4 TYR HA 1 1
1 77 1 1 5 TYR HB2 H 15.002 -0.762 2.798 1.00 . A A . 4 TYR HB2 1 1
1 78 1 1 5 TYR HB3 H 13.543 -0.519 1.844 1.00 . A A . 4 TYR HB3 1 1
1 79 1 1 5 TYR HD1 H 16.608 -2.656 2.031 1.00 . A A . 4 TYR HD1 1 1
1 80 1 1 5 TYR HD2 H 12.494 -2.362 0.851 1.00 . A A . 4 TYR HD2 1 1
1 81 1 1 5 TYR HE1 H 16.648 -5.017 1.392 1.00 . A A . 4 TYR HE1 1 1
1 82 1 1 5 TYR HE2 H 12.508 -4.755 0.233 1.00 . A A . 4 TYR HE2 1 1
1 83 1 1 5 TYR HH H 14.228 -6.893 1.159 1.00 . A A . 4 TYR HH 1 1
1 84 1 1 5 TYR N N 14.724 -0.120 -0.508 1.00 . A A . 4 TYR N 1 1
1 85 1 1 5 TYR O O 17.004 -1.417 -0.315 1.00 . A A . 4 TYR O 1 1
1 86 1 1 5 TYR OH O 14.587 -6.391 0.423 1.00 . A A . 4 TYR OH 1 1
1 87 1 1 6 GLU C C 19.279 -1.803 2.662 1.00 . A A . 5 GLU C 1 1
1 88 1 1 6 GLU CA C 19.029 -0.889 1.467 1.00 . A A . 5 GLU CA 1 1
1 89 1 1 6 GLU CB C 20.069 0.236 1.477 1.00 . A A . 5 GLU CB 1 1
1 90 1 1 6 GLU CD C 19.938 0.574 -1.043 1.00 . A A . 5 GLU CD 1 1
1 91 1 1 6 GLU CG C 19.824 1.237 0.332 1.00 . A A . 5 GLU CG 1 1
1 92 1 1 6 GLU H H 17.417 0.257 2.279 1.00 . A A . 5 GLU H 1 1
1 93 1 1 6 GLU HA H 19.150 -1.475 0.570 1.00 . A A . 5 GLU HA 1 1
1 94 1 1 6 GLU HB2 H 20.025 0.750 2.418 1.00 . A A . 5 GLU HB2 1 1
1 95 1 1 6 GLU HB3 H 21.052 -0.197 1.360 1.00 . A A . 5 GLU HB3 1 1
1 96 1 1 6 GLU HG2 H 18.835 1.656 0.438 1.00 . A A . 5 GLU HG2 1 1
1 97 1 1 6 GLU HG3 H 20.551 2.033 0.401 1.00 . A A . 5 GLU HG3 1 1
1 98 1 1 6 GLU N N 17.667 -0.340 1.541 1.00 . A A . 5 GLU N 1 1
1 99 1 1 6 GLU O O 19.109 -1.399 3.813 1.00 . A A . 5 GLU O 1 1
1 100 1 1 6 GLU OE1 O 19.155 -0.314 -1.332 1.00 . A A . 5 GLU OE1 1 1
1 101 1 1 6 GLU OE2 O 20.815 0.971 -1.792 1.00 . A A . 5 GLU OE2 1 1
1 102 1 1 7 LYS C C 21.505 -4.204 3.479 1.00 . A A . 6 LYS C 1 1
1 103 1 1 7 LYS CA C 20.003 -4.012 3.423 1.00 . A A . 6 LYS CA 1 1
1 104 1 1 7 LYS CB C 19.318 -5.348 3.115 1.00 . A A . 6 LYS CB 1 1
1 105 1 1 7 LYS CD C 18.934 -7.688 3.911 1.00 . A A . 6 LYS CD 1 1
1 106 1 1 7 LYS CE C 19.254 -8.701 5.012 1.00 . A A . 6 LYS CE 1 1
1 107 1 1 7 LYS CG C 19.633 -6.363 4.220 1.00 . A A . 6 LYS CG 1 1
1 108 1 1 7 LYS H H 19.829 -3.287 1.438 1.00 . A A . 6 LYS H 1 1
1 109 1 1 7 LYS HA H 19.656 -3.647 4.381 1.00 . A A . 6 LYS HA 1 1
1 110 1 1 7 LYS HB2 H 18.251 -5.197 3.062 1.00 . A A . 6 LYS HB2 1 1
1 111 1 1 7 LYS HB3 H 19.675 -5.726 2.170 1.00 . A A . 6 LYS HB3 1 1
1 112 1 1 7 LYS HD2 H 17.867 -7.530 3.865 1.00 . A A . 6 LYS HD2 1 1
1 113 1 1 7 LYS HD3 H 19.284 -8.068 2.963 1.00 . A A . 6 LYS HD3 1 1
1 114 1 1 7 LYS HE2 H 20.322 -8.861 5.056 1.00 . A A . 6 LYS HE2 1 1
1 115 1 1 7 LYS HE3 H 18.908 -8.322 5.962 1.00 . A A . 6 LYS HE3 1 1
1 116 1 1 7 LYS HG2 H 20.699 -6.525 4.271 1.00 . A A . 6 LYS HG2 1 1
1 117 1 1 7 LYS HG3 H 19.280 -5.985 5.168 1.00 . A A . 6 LYS HG3 1 1
1 118 1 1 7 LYS HZ1 H 17.588 -9.808 4.438 1.00 . A A . 6 LYS HZ1 1 1
1 119 1 1 7 LYS HZ2 H 18.589 -10.596 5.562 1.00 . A A . 6 LYS HZ2 1 1
1 120 1 1 7 LYS HZ3 H 19.063 -10.473 3.935 1.00 . A A . 6 LYS HZ3 1 1
1 121 1 1 7 LYS N N 19.702 -3.033 2.376 1.00 . A A . 6 LYS N 1 1
1 122 1 1 7 LYS NZ N 18.572 -9.993 4.714 1.00 . A A . 6 LYS NZ 1 1
1 123 1 1 7 LYS O O 22.088 -4.907 2.652 1.00 . A A . 6 LYS O 1 1
1 124 1 1 8 . CAA C 25.761 -2.509 4.064 1.00 . A A . 7 4G6 CAA 1 1
1 125 1 1 8 . CAB C 23.765 -2.003 2.673 1.00 . A A . 7 4G6 CAB 1 1
1 126 1 1 8 . CAE C 23.605 -3.660 4.499 1.00 . A A . 7 4G6 CAE 1 1
1 127 1 1 8 . CAF C 24.242 -2.331 4.089 1.00 . A A . 7 4G6 CAF 1 1
1 128 1 1 8 . HAA H 26.215 -1.679 3.522 1.00 . A A . 7 4G6 HAA 1 1
1 129 1 1 8 . HAB H 26.008 -3.446 3.567 1.00 . A A . 7 4G6 HAB 1 1
1 130 1 1 8 . HAC H 26.141 -2.528 5.085 1.00 . A A . 7 4G6 HAC 1 1
1 131 1 1 8 . HAD H 24.441 -2.453 1.945 1.00 . A A . 7 4G6 HAD 1 1
1 132 1 1 8 . HAE H 23.747 -0.922 2.535 1.00 . A A . 7 4G6 HAE 1 1
1 133 1 1 8 . HAF H 22.759 -2.399 2.530 1.00 . A A . 7 4G6 HAF 1 1
1 134 1 1 8 . HAG H 23.954 -4.438 3.819 1.00 . A A . 7 4G6 HAG 1 1
1 135 1 1 8 . HAH H 23.897 -3.916 5.516 1.00 . A A . 7 4G6 HAH 1 1
1 136 1 1 8 . HAI H 21.639 -2.973 5.047 1.00 . A A . 7 4G6 HAI 1 1
1 137 1 1 8 . HAL H 24.093 -0.300 4.699 1.00 . A A . 7 4G6 HAL 1 1
1 138 1 1 8 . NAC N 22.141 -3.560 4.411 1.00 . A A . 7 4G6 NAC 1 1
1 139 1 1 8 . NAD N 23.878 -1.229 4.996 1.00 . A A . 7 4G6 NAD 1 1
1 140 1 1 9 DPR C C 23.290 -1.385 6.177 1.00 . A A . 8 DPR C 1 1
1 141 1 1 9 DPR CA C 22.978 -0.134 7.007 1.00 . A A . 8 DPR CA 1 1
1 142 1 1 9 DPR CB C 23.668 1.123 6.487 1.00 . A A . 8 DPR CB 1 1
1 143 1 1 9 DPR CD C 21.424 1.705 7.277 1.00 . A A . 8 DPR CD 1 1
1 144 1 1 9 DPR CG C 22.859 2.249 7.076 1.00 . A A . 8 DPR CG 1 1
1 145 1 1 9 DPR HA H 23.271 -0.295 8.032 1.00 . A A . 8 DPR HA 1 1
1 146 1 1 9 DPR HB2 H 24.694 1.161 6.830 1.00 . A A . 8 DPR HB2 1 1
1 147 1 1 9 DPR HB3 H 23.624 1.163 5.410 1.00 . A A . 8 DPR HB3 1 1
1 148 1 1 9 DPR HD2 H 21.104 1.837 8.302 1.00 . A A . 8 DPR HD2 1 1
1 149 1 1 9 DPR HD3 H 20.732 2.182 6.598 1.00 . A A . 8 DPR HD3 1 1
1 150 1 1 9 DPR HG2 H 23.284 2.550 8.028 1.00 . A A . 8 DPR HG2 1 1
1 151 1 1 9 DPR HG3 H 22.840 3.092 6.399 1.00 . A A . 8 DPR HG3 1 1
1 152 1 1 9 DPR N N 21.549 0.277 6.951 1.00 . A A . 8 DPR N 1 1
1 153 1 1 9 DPR O O 22.985 -2.480 6.641 1.00 . A A . 8 DPR O 1 1
1 154 1 1 10 VAL C C 20.565 -0.535 6.635 1.00 . A A . 9 VAL C 1 1
1 155 1 1 10 VAL CA C 19.142 0.027 6.649 1.00 . A A . 9 VAL CA 1 1
1 156 1 1 10 VAL CB C 18.170 -1.130 6.897 1.00 . A A . 9 VAL CB 1 1
1 157 1 1 10 VAL CG1 C 18.467 -1.774 8.252 1.00 . A A . 9 VAL CG1 1 1
1 158 1 1 10 VAL CG2 C 16.729 -0.614 6.867 1.00 . A A . 9 VAL CG2 1 1
1 159 1 1 10 VAL H H 18.800 0.098 4.556 1.00 . A A . 9 VAL H 1 1
1 160 1 1 10 VAL HA H 19.040 0.744 7.451 1.00 . A A . 9 VAL HA 1 1
1 161 1 1 10 VAL HB H 18.300 -1.871 6.119 1.00 . A A . 9 VAL HB 1 1
1 162 1 1 10 VAL HG11 H 19.409 -2.301 8.201 1.00 . A A . 9 VAL HG11 1 1
1 163 1 1 10 VAL HG12 H 17.679 -2.470 8.499 1.00 . A A . 9 VAL HG12 1 1
1 164 1 1 10 VAL HG13 H 18.523 -1.008 9.010 1.00 . A A . 9 VAL HG13 1 1
1 165 1 1 10 VAL HG21 H 16.428 -0.454 5.841 1.00 . A A . 9 VAL HG21 1 1
1 166 1 1 10 VAL HG22 H 16.665 0.316 7.412 1.00 . A A . 9 VAL HG22 1 1
1 167 1 1 10 VAL HG23 H 16.074 -1.344 7.322 1.00 . A A . 9 VAL HG23 1 1
1 168 1 1 10 VAL N N 18.810 0.650 5.366 1.00 . A A . 9 VAL N 1 1
1 169 1 1 10 VAL O O 20.757 -1.719 6.360 1.00 . A A . 9 VAL O 1 1
1 170 1 1 11 GLN C C 18.496 1.947 5.273 1.00 . A A . 10 GLN C 1 1
1 171 1 1 11 GLN CA C 18.145 2.443 3.875 1.00 . A A . 10 GLN CA 1 1
1 172 1 1 11 GLN CB C 19.248 3.348 3.302 1.00 . A A . 10 GLN CB 1 1
1 173 1 1 11 GLN CD C 20.420 5.543 3.526 1.00 . A A . 10 GLN CD 1 1
1 174 1 1 11 GLN CG C 19.321 4.650 4.093 1.00 . A A . 10 GLN CG 1 1
1 175 1 1 11 GLN H H 16.527 3.515 4.721 1.00 . A A . 10 GLN H 1 1
1 176 1 1 11 GLN HA H 18.043 1.583 3.235 1.00 . A A . 10 GLN HA 1 1
1 177 1 1 11 GLN HB2 H 20.201 2.843 3.369 1.00 . A A . 10 GLN HB2 1 1
1 178 1 1 11 GLN HB3 H 19.032 3.571 2.267 1.00 . A A . 10 GLN HB3 1 1
1 179 1 1 11 GLN HE21 H 19.183 7.032 3.083 1.00 . A A . 10 GLN HE21 1 1
1 180 1 1 11 GLN HE22 H 20.813 7.304 2.697 1.00 . A A . 10 GLN HE22 1 1
1 181 1 1 11 GLN HG2 H 18.371 5.161 4.011 1.00 . A A . 10 GLN HG2 1 1
1 182 1 1 11 GLN HG3 H 19.531 4.436 5.127 1.00 . A A . 10 GLN HG3 1 1
1 183 1 1 11 GLN N N 16.872 3.152 3.879 1.00 . A A . 10 GLN N 1 1
1 184 1 1 11 GLN NE2 N 20.113 6.725 3.064 1.00 . A A . 10 GLN NE2 1 1
1 185 1 1 11 GLN O O 18.458 2.700 6.246 1.00 . A A . 10 GLN O 1 1
1 186 1 1 11 GLN OE1 O 21.587 5.154 3.504 1.00 . A A . 10 GLN OE1 1 1
1 187 1 1 12 LYS C C 16.170 3.310 2.769 1.00 . A A . 11 LYS C 1 1
1 188 1 1 12 LYS CA C 14.850 4.067 2.918 1.00 . A A . 11 LYS CA 1 1
1 189 1 1 12 LYS CB C 14.062 3.470 4.089 1.00 . A A . 11 LYS CB 1 1
1 190 1 1 12 LYS CD C 11.888 3.644 5.412 1.00 . A A . 11 LYS CD 1 1
1 191 1 1 12 LYS CE C 12.599 3.713 6.773 1.00 . A A . 11 LYS CE 1 1
1 192 1 1 12 LYS CG C 12.750 4.245 4.279 1.00 . A A . 11 LYS CG 1 1
1 193 1 1 12 LYS H H 14.046 3.127 1.197 1.00 . A A . 11 LYS H 1 1
1 194 1 1 12 LYS HA H 15.065 5.104 3.133 1.00 . A A . 11 LYS HA 1 1
1 195 1 1 12 LYS HB2 H 13.847 2.429 3.888 1.00 . A A . 11 LYS HB2 1 1
1 196 1 1 12 LYS HB3 H 14.664 3.550 4.975 1.00 . A A . 11 LYS HB3 1 1
1 197 1 1 12 LYS HD2 H 10.959 4.191 5.475 1.00 . A A . 11 LYS HD2 1 1
1 198 1 1 12 LYS HD3 H 11.673 2.612 5.179 1.00 . A A . 11 LYS HD3 1 1
1 199 1 1 12 LYS HE2 H 11.938 3.320 7.531 1.00 . A A . 11 LYS HE2 1 1
1 200 1 1 12 LYS HE3 H 13.500 3.128 6.759 1.00 . A A . 11 LYS HE3 1 1
1 201 1 1 12 LYS HG2 H 12.977 5.273 4.519 1.00 . A A . 11 LYS HG2 1 1
1 202 1 1 12 LYS HG3 H 12.185 4.214 3.359 1.00 . A A . 11 LYS HG3 1 1
1 203 1 1 12 LYS HZ1 H 12.085 5.727 6.905 1.00 . A A . 11 LYS HZ1 1 1
1 204 1 1 12 LYS HZ2 H 13.715 5.452 6.513 1.00 . A A . 11 LYS HZ2 1 1
1 205 1 1 12 LYS HZ3 H 13.169 5.209 8.104 1.00 . A A . 11 LYS HZ3 1 1
1 206 1 1 12 LYS N N 14.065 3.977 1.686 1.00 . A A . 11 LYS N 1 1
1 207 1 1 12 LYS NZ N 12.916 5.133 7.098 1.00 . A A . 11 LYS NZ 1 1
1 208 1 1 12 LYS O O 16.542 2.872 1.680 1.00 . A A . 11 LYS O 1 1
1 209 1 1 13 PHE C C 13.379 5.017 1.204 1.00 . A A . 12 PHE C 1 1
1 210 1 1 13 PHE CA C 12.623 4.757 -0.092 1.00 . A A . 12 PHE CA 1 1
1 211 1 1 13 PHE CB C 13.055 5.772 -1.164 1.00 . A A . 12 PHE CB 1 1
1 212 1 1 13 PHE CD1 C 11.233 5.138 -2.823 1.00 . A A . 12 PHE CD1 1 1
1 213 1 1 13 PHE CD2 C 13.543 5.106 -3.555 1.00 . A A . 12 PHE CD2 1 1
1 214 1 1 13 PHE CE1 C 10.833 4.731 -4.104 1.00 . A A . 12 PHE CE1 1 1
1 215 1 1 13 PHE CE2 C 13.132 4.701 -4.830 1.00 . A A . 12 PHE CE2 1 1
1 216 1 1 13 PHE CG C 12.592 5.326 -2.543 1.00 . A A . 12 PHE CG 1 1
1 217 1 1 13 PHE CZ C 11.774 4.515 -5.097 1.00 . A A . 12 PHE CZ 1 1
1 218 1 1 13 PHE H H 10.664 5.543 -0.290 1.00 . A A . 12 PHE H 1 1
1 219 1 1 13 PHE HA H 12.879 3.769 -0.435 1.00 . A A . 12 PHE HA 1 1
1 220 1 1 13 PHE HB2 H 12.607 6.730 -0.938 1.00 . A A . 12 PHE HB2 1 1
1 221 1 1 13 PHE HB3 H 14.129 5.878 -1.154 1.00 . A A . 12 PHE HB3 1 1
1 222 1 1 13 PHE HD1 H 10.495 5.304 -2.059 1.00 . A A . 12 PHE HD1 1 1
1 223 1 1 13 PHE HD2 H 14.593 5.251 -3.352 1.00 . A A . 12 PHE HD2 1 1
1 224 1 1 13 PHE HE1 H 9.797 4.580 -4.332 1.00 . A A . 12 PHE HE1 1 1
1 225 1 1 13 PHE HE2 H 13.864 4.532 -5.607 1.00 . A A . 12 PHE HE2 1 1
1 226 1 1 13 PHE HZ H 11.445 4.206 -6.072 1.00 . A A . 12 PHE HZ 1 1
1 227 1 1 13 PHE N N 11.175 4.808 0.109 1.00 . A A . 12 PHE N 1 1
1 228 1 1 13 PHE O O 13.352 6.121 1.748 1.00 . A A . 12 PHE O 1 1
1 229 1 1 14 ILE C C 10.539 3.908 0.853 1.00 . A A . 13 ILE C 1 1
1 230 1 1 14 ILE CA C 9.028 4.120 1.012 1.00 . A A . 13 ILE CA 1 1
1 231 1 1 14 ILE CB C 8.439 3.085 1.986 1.00 . A A . 13 ILE CB 1 1
1 232 1 1 14 ILE CD1 C 7.683 1.555 0.088 1.00 . A A . 13 ILE CD1 1 1
1 233 1 1 14 ILE CG1 C 8.488 1.662 1.392 1.00 . A A . 13 ILE CG1 1 1
1 234 1 1 14 ILE CG2 C 6.994 3.457 2.342 1.00 . A A . 13 ILE CG2 1 1
1 235 1 1 14 ILE H H 8.678 3.558 -1.016 1.00 . A A . 13 ILE H 1 1
1 236 1 1 14 ILE HA H 8.888 5.091 1.451 1.00 . A A . 13 ILE HA 1 1
1 237 1 1 14 ILE HB H 9.028 3.103 2.894 1.00 . A A . 13 ILE HB 1 1
1 238 1 1 14 ILE HD11 H 7.307 0.547 -0.016 1.00 . A A . 13 ILE HD11 1 1
1 239 1 1 14 ILE HD12 H 8.323 1.782 -0.748 1.00 . A A . 13 ILE HD12 1 1
1 240 1 1 14 ILE HD13 H 6.852 2.243 0.102 1.00 . A A . 13 ILE HD13 1 1
1 241 1 1 14 ILE HG12 H 9.510 1.400 1.190 1.00 . A A . 13 ILE HG12 1 1
1 242 1 1 14 ILE HG13 H 8.084 0.969 2.112 1.00 . A A . 13 ILE HG13 1 1
1 243 1 1 14 ILE HG21 H 6.948 4.501 2.617 1.00 . A A . 13 ILE HG21 1 1
1 244 1 1 14 ILE HG22 H 6.660 2.853 3.172 1.00 . A A . 13 ILE HG22 1 1
1 245 1 1 14 ILE HG23 H 6.353 3.281 1.492 1.00 . A A . 13 ILE HG23 1 1
1 246 1 1 14 ILE N N 8.321 4.097 -0.274 1.00 . A A . 13 ILE N 1 1
1 247 1 1 14 ILE O O 11.120 2.986 1.425 1.00 . A A . 13 ILE O 1 1
1 248 1 1 15 ARG C C 7.193 4.786 -0.454 1.00 . A A . 14 ARG C 1 1
1 249 1 1 15 ARG CA C 6.540 4.674 -1.830 1.00 . A A . 14 ARG CA 1 1
1 250 1 1 15 ARG CB C 7.332 5.489 -2.851 1.00 . A A . 14 ARG CB 1 1
1 251 1 1 15 ARG CD C 8.101 7.780 -3.501 1.00 . A A . 14 ARG CD 1 1
1 252 1 1 15 ARG CG C 7.324 6.967 -2.460 1.00 . A A . 14 ARG CG 1 1
1 253 1 1 15 ARG CZ C 10.342 7.911 -4.425 1.00 . A A . 14 ARG CZ 1 1
1 254 1 1 15 ARG H H 4.945 5.915 -1.203 1.00 . A A . 14 ARG H 1 1
1 255 1 1 15 ARG HA H 6.545 3.636 -2.133 1.00 . A A . 14 ARG HA 1 1
1 256 1 1 15 ARG HB2 H 8.343 5.134 -2.869 1.00 . A A . 14 ARG HB2 1 1
1 257 1 1 15 ARG HB3 H 6.891 5.373 -3.828 1.00 . A A . 14 ARG HB3 1 1
1 258 1 1 15 ARG HD2 H 7.640 7.652 -4.468 1.00 . A A . 14 ARG HD2 1 1
1 259 1 1 15 ARG HD3 H 8.069 8.825 -3.229 1.00 . A A . 14 ARG HD3 1 1
1 260 1 1 15 ARG HE H 9.804 6.615 -2.993 1.00 . A A . 14 ARG HE 1 1
1 261 1 1 15 ARG HG2 H 6.304 7.321 -2.415 1.00 . A A . 14 ARG HG2 1 1
1 262 1 1 15 ARG HG3 H 7.790 7.087 -1.494 1.00 . A A . 14 ARG HG3 1 1
1 263 1 1 15 ARG HH11 H 8.982 9.177 -5.168 1.00 . A A . 14 ARG HH11 1 1
1 264 1 1 15 ARG HH12 H 10.571 9.301 -5.846 1.00 . A A . 14 ARG HH12 1 1
1 265 1 1 15 ARG HH21 H 11.899 6.777 -3.879 1.00 . A A . 14 ARG HH21 1 1
1 266 1 1 15 ARG HH22 H 12.220 7.944 -5.117 1.00 . A A . 14 ARG HH22 1 1
1 267 1 1 15 ARG N N 5.163 5.160 -1.783 1.00 . A A . 14 ARG N 1 1
1 268 1 1 15 ARG NE N 9.492 7.341 -3.574 1.00 . A A . 14 ARG NE 1 1
1 269 1 1 15 ARG NH1 N 9.933 8.871 -5.207 1.00 . A A . 14 ARG NH1 1 1
1 270 1 1 15 ARG NH2 N 11.583 7.512 -4.478 1.00 . A A . 14 ARG NH2 1 1
1 271 1 1 15 ARG O O 6.681 5.472 0.430 1.00 . A A . 14 ARG O 1 1
1 272 1 1 16 ACE C C 4.202 4.604 -2.518 1.00 . A A . 15 ACE C 1 1
1 273 1 1 16 ACE CH3 C 2.810 5.212 -2.377 1.00 . A A . 15 ACE CH3 1 1
1 274 1 1 16 ACE H1 H 2.245 5.030 -3.279 1.00 . A A . 15 ACE H1 1 1
1 275 1 1 16 ACE H2 H 2.897 6.276 -2.216 1.00 . A A . 15 ACE H2 1 1
1 276 1 1 16 ACE H3 H 2.303 4.762 -1.537 1.00 . A A . 15 ACE H3 1 1
1 277 1 1 16 ACE O O 4.401 3.656 -3.276 1.00 . A A . 15 ACE O 1 1
2 278 1 1 1 ACE C C 9.313 2.512 -4.458 1.00 . A A . 0 ACE C 1 1
2 279 1 1 1 ACE CH3 C 9.919 3.250 -5.648 1.00 . A A . 0 ACE CH3 1 1
2 280 1 1 1 ACE H1 H 10.522 4.072 -5.293 1.00 . A A . 0 ACE H1 1 1
2 281 1 1 1 ACE H2 H 9.128 3.628 -6.279 1.00 . A A . 0 ACE H2 1 1
2 282 1 1 1 ACE H3 H 10.535 2.570 -6.216 1.00 . A A . 0 ACE H3 1 1
2 283 1 1 1 ACE O O 9.909 2.449 -3.383 1.00 . A A . 0 ACE O 1 1
2 284 1 1 2 GLU C C 8.382 0.405 -2.778 1.00 . A A . 1 GLU C 1 1
2 285 1 1 2 GLU CA C 7.421 1.231 -3.617 1.00 . A A . 1 GLU CA 1 1
2 286 1 1 2 GLU CB C 6.382 0.314 -4.274 1.00 . A A . 1 GLU CB 1 1
2 287 1 1 2 GLU CD C 4.907 0.452 -2.247 1.00 . A A . 1 GLU CD 1 1
2 288 1 1 2 GLU CG C 5.623 -0.487 -3.213 1.00 . A A . 1 GLU CG 1 1
2 289 1 1 2 GLU H H 7.690 2.052 -5.534 1.00 . A A . 1 GLU H 1 1
2 290 1 1 2 GLU HA H 6.910 1.918 -2.975 1.00 . A A . 1 GLU HA 1 1
2 291 1 1 2 GLU HB2 H 5.682 0.916 -4.835 1.00 . A A . 1 GLU HB2 1 1
2 292 1 1 2 GLU HB3 H 6.883 -0.368 -4.944 1.00 . A A . 1 GLU HB3 1 1
2 293 1 1 2 GLU HG2 H 4.896 -1.114 -3.704 1.00 . A A . 1 GLU HG2 1 1
2 294 1 1 2 GLU HG3 H 6.314 -1.106 -2.666 1.00 . A A . 1 GLU HG3 1 1
2 295 1 1 2 GLU N N 8.120 1.959 -4.662 1.00 . A A . 1 GLU N 1 1
2 296 1 1 2 GLU O O 8.266 0.391 -1.558 1.00 . A A . 1 GLU O 1 1
2 297 1 1 2 GLU OE1 O 4.083 1.225 -2.706 1.00 . A A . 1 GLU OE1 1 1
2 298 1 1 2 GLU OE2 O 5.194 0.383 -1.063 1.00 . A A . 1 GLU OE2 1 1
2 299 1 1 3 ARG C C 11.015 -0.320 -1.684 1.00 . A A . 2 ARG C 1 1
2 300 1 1 3 ARG CA C 10.242 -1.146 -2.720 1.00 . A A . 2 ARG CA 1 1
2 301 1 1 3 ARG CB C 11.183 -1.795 -3.761 1.00 . A A . 2 ARG CB 1 1
2 302 1 1 3 ARG CD C 11.324 -4.129 -2.722 1.00 . A A . 2 ARG CD 1 1
2 303 1 1 3 ARG CG C 12.111 -2.881 -3.197 1.00 . A A . 2 ARG CG 1 1
2 304 1 1 3 ARG CZ C 9.696 -4.787 -1.047 1.00 . A A . 2 ARG CZ 1 1
2 305 1 1 3 ARG H H 9.343 -0.258 -4.407 1.00 . A A . 2 ARG H 1 1
2 306 1 1 3 ARG HA H 9.683 -1.882 -2.217 1.00 . A A . 2 ARG HA 1 1
2 307 1 1 3 ARG HB2 H 10.587 -2.241 -4.536 1.00 . A A . 2 ARG HB2 1 1
2 308 1 1 3 ARG HB3 H 11.795 -1.023 -4.199 1.00 . A A . 2 ARG HB3 1 1
2 309 1 1 3 ARG HD2 H 10.706 -4.483 -3.534 1.00 . A A . 2 ARG HD2 1 1
2 310 1 1 3 ARG HD3 H 12.022 -4.909 -2.464 1.00 . A A . 2 ARG HD3 1 1
2 311 1 1 3 ARG HE H 10.502 -2.960 -1.158 1.00 . A A . 2 ARG HE 1 1
2 312 1 1 3 ARG HG2 H 12.802 -3.177 -3.971 1.00 . A A . 2 ARG HG2 1 1
2 313 1 1 3 ARG HG3 H 12.664 -2.469 -2.375 1.00 . A A . 2 ARG HG3 1 1
2 314 1 1 3 ARG HH11 H 10.193 -6.172 -2.404 1.00 . A A . 2 ARG HH11 1 1
2 315 1 1 3 ARG HH12 H 9.061 -6.679 -1.195 1.00 . A A . 2 ARG HH12 1 1
2 316 1 1 3 ARG HH21 H 9.018 -3.616 0.428 1.00 . A A . 2 ARG HH21 1 1
2 317 1 1 3 ARG HH22 H 8.395 -5.232 0.407 1.00 . A A . 2 ARG HH22 1 1
2 318 1 1 3 ARG N N 9.305 -0.293 -3.430 1.00 . A A . 2 ARG N 1 1
2 319 1 1 3 ARG NE N 10.474 -3.846 -1.572 1.00 . A A . 2 ARG NE 1 1
2 320 1 1 3 ARG NH1 N 9.646 -5.972 -1.591 1.00 . A A . 2 ARG NH1 1 1
2 321 1 1 3 ARG NH2 N 8.981 -4.525 0.012 1.00 . A A . 2 ARG NH2 1 1
2 322 1 1 3 ARG O O 10.428 0.187 -0.729 1.00 . A A . 2 ARG O 1 1
2 323 1 1 4 PHE C C 12.899 0.142 0.532 1.00 . A A . 3 PHE C 1 1
2 324 1 1 4 PHE CA C 13.108 0.619 -0.917 1.00 . A A . 3 PHE CA 1 1
2 325 1 1 4 PHE CB C 12.745 2.111 -1.058 1.00 . A A . 3 PHE CB 1 1
2 326 1 1 4 PHE CD1 C 12.725 2.153 -3.601 1.00 . A A . 3 PHE CD1 1 1
2 327 1 1 4 PHE CD2 C 14.162 3.701 -2.408 1.00 . A A . 3 PHE CD2 1 1
2 328 1 1 4 PHE CE1 C 13.175 2.683 -4.818 1.00 . A A . 3 PHE CE1 1 1
2 329 1 1 4 PHE CE2 C 14.607 4.227 -3.621 1.00 . A A . 3 PHE CE2 1 1
2 330 1 1 4 PHE CG C 13.219 2.662 -2.390 1.00 . A A . 3 PHE CG 1 1
2 331 1 1 4 PHE CZ C 14.115 3.720 -4.827 1.00 . A A . 3 PHE CZ 1 1
2 332 1 1 4 PHE H H 12.744 -0.588 -2.640 1.00 . A A . 3 PHE H 1 1
2 333 1 1 4 PHE HA H 14.151 0.499 -1.165 1.00 . A A . 3 PHE HA 1 1
2 334 1 1 4 PHE HB2 H 11.671 2.219 -1.019 1.00 . A A . 3 PHE HB2 1 1
2 335 1 1 4 PHE HB3 H 13.190 2.671 -0.252 1.00 . A A . 3 PHE HB3 1 1
2 336 1 1 4 PHE HD1 H 11.996 1.360 -3.601 1.00 . A A . 3 PHE HD1 1 1
2 337 1 1 4 PHE HD2 H 14.546 4.098 -1.479 1.00 . A A . 3 PHE HD2 1 1
2 338 1 1 4 PHE HE1 H 12.797 2.291 -5.749 1.00 . A A . 3 PHE HE1 1 1
2 339 1 1 4 PHE HE2 H 15.328 5.029 -3.624 1.00 . A A . 3 PHE HE2 1 1
2 340 1 1 4 PHE HZ H 14.462 4.127 -5.766 1.00 . A A . 3 PHE HZ 1 1
2 341 1 1 4 PHE N N 12.318 -0.172 -1.866 1.00 . A A . 3 PHE N 1 1
2 342 1 1 4 PHE O O 12.217 0.792 1.329 1.00 . A A . 3 PHE O 1 1
2 343 1 1 5 TYR C C 14.713 -1.646 2.916 1.00 . A A . 4 TYR C 1 1
2 344 1 1 5 TYR CA C 13.368 -1.612 2.200 1.00 . A A . 4 TYR CA 1 1
2 345 1 1 5 TYR CB C 12.843 -3.043 2.035 1.00 . A A . 4 TYR CB 1 1
2 346 1 1 5 TYR CD1 C 15.066 -4.210 1.733 1.00 . A A . 4 TYR CD1 1 1
2 347 1 1 5 TYR CD2 C 13.548 -4.056 -0.133 1.00 . A A . 4 TYR CD2 1 1
2 348 1 1 5 TYR CE1 C 16.008 -4.844 0.924 1.00 . A A . 4 TYR CE1 1 1
2 349 1 1 5 TYR CE2 C 14.476 -4.697 -0.951 1.00 . A A . 4 TYR CE2 1 1
2 350 1 1 5 TYR CG C 13.831 -3.824 1.204 1.00 . A A . 4 TYR CG 1 1
2 351 1 1 5 TYR CZ C 15.715 -5.092 -0.425 1.00 . A A . 4 TYR CZ 1 1
2 352 1 1 5 TYR H H 14.014 -1.484 0.177 1.00 . A A . 4 TYR H 1 1
2 353 1 1 5 TYR HA H 12.666 -1.052 2.790 1.00 . A A . 4 TYR HA 1 1
2 354 1 1 5 TYR HB2 H 12.748 -3.506 3.006 1.00 . A A . 4 TYR HB2 1 1
2 355 1 1 5 TYR HB3 H 11.883 -3.027 1.544 1.00 . A A . 4 TYR HB3 1 1
2 356 1 1 5 TYR HD1 H 15.280 -4.049 2.773 1.00 . A A . 4 TYR HD1 1 1
2 357 1 1 5 TYR HD2 H 12.601 -3.755 -0.525 1.00 . A A . 4 TYR HD2 1 1
2 358 1 1 5 TYR HE1 H 16.965 -5.130 1.340 1.00 . A A . 4 TYR HE1 1 1
2 359 1 1 5 TYR HE2 H 14.242 -4.868 -1.991 1.00 . A A . 4 TYR HE2 1 1
2 360 1 1 5 TYR HH H 16.810 -6.592 -0.868 1.00 . A A . 4 TYR HH 1 1
2 361 1 1 5 TYR N N 13.491 -1.012 0.859 1.00 . A A . 4 TYR N 1 1
2 362 1 1 5 TYR O O 15.746 -1.390 2.309 1.00 . A A . 4 TYR O 1 1
2 363 1 1 5 TYR OH O 16.641 -5.720 -1.232 1.00 . A A . 4 TYR OH 1 1
2 364 1 1 6 GLU C C 17.161 -1.848 4.401 1.00 . A A . 5 GLU C 1 1
2 365 1 1 6 GLU CA C 15.828 -2.104 5.098 1.00 . A A . 5 GLU CA 1 1
2 366 1 1 6 GLU CB C 15.836 -3.491 5.759 1.00 . A A . 5 GLU CB 1 1
2 367 1 1 6 GLU CD C 17.004 -4.987 7.393 1.00 . A A . 5 GLU CD 1 1
2 368 1 1 6 GLU CG C 17.024 -3.617 6.723 1.00 . A A . 5 GLU CG 1 1
2 369 1 1 6 GLU H H 13.776 -2.173 4.590 1.00 . A A . 5 GLU H 1 1
2 370 1 1 6 GLU HA H 15.727 -1.376 5.866 1.00 . A A . 5 GLU HA 1 1
2 371 1 1 6 GLU HB2 H 14.916 -3.630 6.307 1.00 . A A . 5 GLU HB2 1 1
2 372 1 1 6 GLU HB3 H 15.915 -4.251 4.998 1.00 . A A . 5 GLU HB3 1 1
2 373 1 1 6 GLU HG2 H 17.950 -3.505 6.178 1.00 . A A . 5 GLU HG2 1 1
2 374 1 1 6 GLU HG3 H 16.956 -2.850 7.479 1.00 . A A . 5 GLU HG3 1 1
2 375 1 1 6 GLU N N 14.656 -1.987 4.209 1.00 . A A . 5 GLU N 1 1
2 376 1 1 6 GLU O O 17.952 -1.036 4.874 1.00 . A A . 5 GLU O 1 1
2 377 1 1 6 GLU OE1 O 16.026 -5.286 8.058 1.00 . A A . 5 GLU OE1 1 1
2 378 1 1 6 GLU OE2 O 17.968 -5.718 7.231 1.00 . A A . 5 GLU OE2 1 1
2 379 1 1 7 LYS C C 18.432 -2.238 1.052 1.00 . A A . 6 LYS C 1 1
2 380 1 1 7 LYS CA C 18.668 -2.325 2.559 1.00 . A A . 6 LYS CA 1 1
2 381 1 1 7 LYS CB C 19.614 -3.478 2.887 1.00 . A A . 6 LYS CB 1 1
2 382 1 1 7 LYS CD C 21.981 -4.332 2.592 1.00 . A A . 6 LYS CD 1 1
2 383 1 1 7 LYS CE C 21.543 -5.702 2.049 1.00 . A A . 6 LYS CE 1 1
2 384 1 1 7 LYS CG C 20.972 -3.223 2.238 1.00 . A A . 6 LYS CG 1 1
2 385 1 1 7 LYS H H 16.753 -3.148 2.962 1.00 . A A . 6 LYS H 1 1
2 386 1 1 7 LYS HA H 19.119 -1.404 2.859 1.00 . A A . 6 LYS HA 1 1
2 387 1 1 7 LYS HB2 H 19.730 -3.558 3.959 1.00 . A A . 6 LYS HB2 1 1
2 388 1 1 7 LYS HB3 H 19.188 -4.384 2.500 1.00 . A A . 6 LYS HB3 1 1
2 389 1 1 7 LYS HD2 H 22.942 -4.079 2.175 1.00 . A A . 6 LYS HD2 1 1
2 390 1 1 7 LYS HD3 H 22.066 -4.391 3.667 1.00 . A A . 6 LYS HD3 1 1
2 391 1 1 7 LYS HE2 H 20.619 -6.005 2.509 1.00 . A A . 6 LYS HE2 1 1
2 392 1 1 7 LYS HE3 H 21.416 -5.647 0.978 1.00 . A A . 6 LYS HE3 1 1
2 393 1 1 7 LYS HG2 H 20.857 -3.175 1.168 1.00 . A A . 6 LYS HG2 1 1
2 394 1 1 7 LYS HG3 H 21.350 -2.276 2.602 1.00 . A A . 6 LYS HG3 1 1
2 395 1 1 7 LYS HZ1 H 23.527 -6.318 2.171 1.00 . A A . 6 LYS HZ1 1 1
2 396 1 1 7 LYS HZ2 H 22.435 -7.567 1.803 1.00 . A A . 6 LYS HZ2 1 1
2 397 1 1 7 LYS HZ3 H 22.529 -6.955 3.385 1.00 . A A . 6 LYS HZ3 1 1
2 398 1 1 7 LYS N N 17.412 -2.521 3.289 1.00 . A A . 6 LYS N 1 1
2 399 1 1 7 LYS NZ N 22.587 -6.712 2.377 1.00 . A A . 6 LYS NZ 1 1
2 400 1 1 7 LYS O O 17.440 -2.743 0.535 1.00 . A A . 6 LYS O 1 1
2 401 1 1 8 . CAA C 21.507 -1.978 -1.705 1.00 . A A . 7 4G6 CAA 1 1
2 402 1 1 8 . CAB C 20.097 -0.659 -3.257 1.00 . A A . 7 4G6 CAB 1 1
2 403 1 1 8 . CAE C 19.151 -1.451 -1.108 1.00 . A A . 7 4G6 CAE 1 1
2 404 1 1 8 . CAF C 20.414 -0.910 -1.782 1.00 . A A . 7 4G6 CAF 1 1
2 405 1 1 8 . HAA H 21.367 -2.578 -0.805 1.00 . A A . 7 4G6 HAA 1 1
2 406 1 1 8 . HAB H 22.484 -1.496 -1.672 1.00 . A A . 7 4G6 HAB 1 1
2 407 1 1 8 . HAC H 21.449 -2.622 -2.583 1.00 . A A . 7 4G6 HAC 1 1
2 408 1 1 8 . HAD H 19.496 0.245 -3.353 1.00 . A A . 7 4G6 HAD 1 1
2 409 1 1 8 . HAE H 19.544 -1.508 -3.660 1.00 . A A . 7 4G6 HAE 1 1
2 410 1 1 8 . HAF H 21.028 -0.540 -3.811 1.00 . A A . 7 4G6 HAF 1 1
2 411 1 1 8 . HAG H 18.328 -0.764 -1.307 1.00 . A A . 7 4G6 HAG 1 1
2 412 1 1 8 . HAH H 18.909 -2.427 -1.529 1.00 . A A . 7 4G6 HAH 1 1
2 413 1 1 8 . HAI H 20.116 -1.173 0.796 1.00 . A A . 7 4G6 HAI 1 1
2 414 1 1 8 . HAL H 20.450 1.201 -1.499 1.00 . A A . 7 4G6 HAL 1 1
2 415 1 1 8 . NAC N 19.325 -1.585 0.346 1.00 . A A . 7 4G6 NAC 1 1
2 416 1 1 8 . NAD N 20.843 0.349 -1.153 1.00 . A A . 7 4G6 NAD 1 1
2 417 1 1 9 DPR C C 21.720 0.413 -0.163 1.00 . A A . 8 DPR C 1 1
2 418 1 1 9 DPR CA C 22.098 1.792 0.415 1.00 . A A . 8 DPR CA 1 1
2 419 1 1 9 DPR CB C 21.651 2.943 -0.488 1.00 . A A . 8 DPR CB 1 1
2 420 1 1 9 DPR CD C 21.073 3.535 1.797 1.00 . A A . 8 DPR CD 1 1
2 421 1 1 9 DPR CG C 21.513 4.111 0.439 1.00 . A A . 8 DPR CG 1 1
2 422 1 1 9 DPR HA H 23.165 1.849 0.561 1.00 . A A . 8 DPR HA 1 1
2 423 1 1 9 DPR HB2 H 22.398 3.140 -1.246 1.00 . A A . 8 DPR HB2 1 1
2 424 1 1 9 DPR HB3 H 20.700 2.723 -0.943 1.00 . A A . 8 DPR HB3 1 1
2 425 1 1 9 DPR HD2 H 21.635 3.993 2.601 1.00 . A A . 8 DPR HD2 1 1
2 426 1 1 9 DPR HD3 H 20.015 3.673 1.950 1.00 . A A . 8 DPR HD3 1 1
2 427 1 1 9 DPR HG2 H 22.465 4.620 0.536 1.00 . A A . 8 DPR HG2 1 1
2 428 1 1 9 DPR HG3 H 20.763 4.797 0.072 1.00 . A A . 8 DPR HG3 1 1
2 429 1 1 9 DPR N N 21.392 2.094 1.696 1.00 . A A . 8 DPR N 1 1
2 430 1 1 9 DPR O O 22.251 -0.593 0.308 1.00 . A A . 8 DPR O 1 1
2 431 1 1 10 VAL C C 21.123 1.159 2.586 1.00 . A A . 9 VAL C 1 1
2 432 1 1 10 VAL CA C 20.357 1.532 3.860 1.00 . A A . 9 VAL CA 1 1
2 433 1 1 10 VAL CB C 21.030 0.875 5.095 1.00 . A A . 9 VAL CB 1 1
2 434 1 1 10 VAL CG1 C 21.123 -0.657 4.997 1.00 . A A . 9 VAL CG1 1 1
2 435 1 1 10 VAL CG2 C 22.435 1.457 5.263 1.00 . A A . 9 VAL CG2 1 1
2 436 1 1 10 VAL H H 18.751 0.146 3.678 1.00 . A A . 9 VAL H 1 1
2 437 1 1 10 VAL HA H 20.383 2.603 3.996 1.00 . A A . 9 VAL HA 1 1
2 438 1 1 10 VAL HB H 20.450 1.114 5.961 1.00 . A A . 9 VAL HB 1 1
2 439 1 1 10 VAL HG11 H 21.251 -1.069 5.988 1.00 . A A . 9 VAL HG11 1 1
2 440 1 1 10 VAL HG12 H 21.969 -0.938 4.392 1.00 . A A . 9 VAL HG12 1 1
2 441 1 1 10 VAL HG13 H 20.230 -1.051 4.571 1.00 . A A . 9 VAL HG13 1 1
2 442 1 1 10 VAL HG21 H 22.380 2.535 5.265 1.00 . A A . 9 VAL HG21 1 1
2 443 1 1 10 VAL HG22 H 23.060 1.129 4.445 1.00 . A A . 9 VAL HG22 1 1
2 444 1 1 10 VAL HG23 H 22.857 1.116 6.197 1.00 . A A . 9 VAL HG23 1 1
2 445 1 1 10 VAL N N 18.958 1.102 3.699 1.00 . A A . 9 VAL N 1 1
2 446 1 1 10 VAL O O 21.447 -0.001 2.391 1.00 . A A . 9 VAL O 1 1
2 447 1 1 11 GLN C C 17.961 1.995 3.550 1.00 . A A . 10 GLN C 1 1
2 448 1 1 11 GLN CA C 16.551 1.421 3.353 1.00 . A A . 10 GLN CA 1 1
2 449 1 1 11 GLN CB C 16.243 1.189 1.854 1.00 . A A . 10 GLN CB 1 1
2 450 1 1 11 GLN CD C 17.599 3.158 1.016 1.00 . A A . 10 GLN CD 1 1
2 451 1 1 11 GLN CG C 16.224 2.507 1.056 1.00 . A A . 10 GLN CG 1 1
2 452 1 1 11 GLN H H 15.579 3.256 3.769 1.00 . A A . 10 GLN H 1 1
2 453 1 1 11 GLN HA H 16.504 0.478 3.855 1.00 . A A . 10 GLN HA 1 1
2 454 1 1 11 GLN HB2 H 16.987 0.532 1.431 1.00 . A A . 10 GLN HB2 1 1
2 455 1 1 11 GLN HB3 H 15.270 0.728 1.764 1.00 . A A . 10 GLN HB3 1 1
2 456 1 1 11 GLN HE21 H 16.987 4.856 1.845 1.00 . A A . 10 GLN HE21 1 1
2 457 1 1 11 GLN HE22 H 18.637 4.794 1.453 1.00 . A A . 10 GLN HE22 1 1
2 458 1 1 11 GLN HG2 H 15.901 2.303 0.046 1.00 . A A . 10 GLN HG2 1 1
2 459 1 1 11 GLN HG3 H 15.524 3.187 1.519 1.00 . A A . 10 GLN HG3 1 1
2 460 1 1 11 GLN N N 15.513 2.287 3.899 1.00 . A A . 10 GLN N 1 1
2 461 1 1 11 GLN NE2 N 17.754 4.370 1.476 1.00 . A A . 10 GLN NE2 1 1
2 462 1 1 11 GLN O O 18.150 3.211 3.549 1.00 . A A . 10 GLN O 1 1
2 463 1 1 11 GLN OE1 O 18.556 2.550 0.536 1.00 . A A . 10 GLN OE1 1 1
2 464 1 1 12 LYS C C 14.442 1.782 4.530 1.00 . A A . 11 LYS C 1 1
2 465 1 1 12 LYS CA C 13.419 2.808 4.982 1.00 . A A . 11 LYS CA 1 1
2 466 1 1 12 LYS CB C 12.379 2.134 5.904 1.00 . A A . 11 LYS CB 1 1
2 467 1 1 12 LYS CD C 10.566 3.909 5.554 1.00 . A A . 11 LYS CD 1 1
2 468 1 1 12 LYS CE C 9.597 4.829 6.296 1.00 . A A . 11 LYS CE 1 1
2 469 1 1 12 LYS CG C 11.412 3.141 6.570 1.00 . A A . 11 LYS CG 1 1
2 470 1 1 12 LYS H H 12.255 2.832 3.199 1.00 . A A . 11 LYS H 1 1
2 471 1 1 12 LYS HA H 13.933 3.583 5.541 1.00 . A A . 11 LYS HA 1 1
2 472 1 1 12 LYS HB2 H 11.800 1.435 5.320 1.00 . A A . 11 LYS HB2 1 1
2 473 1 1 12 LYS HB3 H 12.903 1.589 6.676 1.00 . A A . 11 LYS HB3 1 1
2 474 1 1 12 LYS HD2 H 11.197 4.510 4.934 1.00 . A A . 11 LYS HD2 1 1
2 475 1 1 12 LYS HD3 H 10.011 3.216 4.951 1.00 . A A . 11 LYS HD3 1 1
2 476 1 1 12 LYS HE2 H 8.950 4.237 6.927 1.00 . A A . 11 LYS HE2 1 1
2 477 1 1 12 LYS HE3 H 10.156 5.524 6.905 1.00 . A A . 11 LYS HE3 1 1
2 478 1 1 12 LYS HG2 H 10.752 2.604 7.235 1.00 . A A . 11 LYS HG2 1 1
2 479 1 1 12 LYS HG3 H 11.990 3.846 7.150 1.00 . A A . 11 LYS HG3 1 1
2 480 1 1 12 LYS HZ1 H 7.893 5.063 5.122 1.00 . A A . 11 LYS HZ1 1 1
2 481 1 1 12 LYS HZ2 H 9.309 5.690 4.422 1.00 . A A . 11 LYS HZ2 1 1
2 482 1 1 12 LYS HZ3 H 8.545 6.522 5.691 1.00 . A A . 11 LYS HZ3 1 1
2 483 1 1 12 LYS N N 12.839 3.389 3.766 1.00 . A A . 11 LYS N 1 1
2 484 1 1 12 LYS NZ N 8.774 5.583 5.308 1.00 . A A . 11 LYS NZ 1 1
2 485 1 1 12 LYS O O 14.252 0.568 4.691 1.00 . A A . 11 LYS O 1 1
2 486 1 1 13 PHE C C 13.164 4.616 3.356 1.00 . A A . 12 PHE C 1 1
2 487 1 1 13 PHE CA C 12.582 5.060 2.020 1.00 . A A . 12 PHE CA 1 1
2 488 1 1 13 PHE CB C 12.993 6.515 1.752 1.00 . A A . 12 PHE CB 1 1
2 489 1 1 13 PHE CD1 C 12.176 6.084 -0.664 1.00 . A A . 12 PHE CD1 1 1
2 490 1 1 13 PHE CD2 C 12.979 8.289 -0.028 1.00 . A A . 12 PHE CD2 1 1
2 491 1 1 13 PHE CE1 C 11.955 6.546 -1.961 1.00 . A A . 12 PHE CE1 1 1
2 492 1 1 13 PHE CE2 C 12.754 8.742 -1.331 1.00 . A A . 12 PHE CE2 1 1
2 493 1 1 13 PHE CG C 12.693 6.962 0.321 1.00 . A A . 12 PHE CG 1 1
2 494 1 1 13 PHE CZ C 12.244 7.873 -2.297 1.00 . A A . 12 PHE CZ 1 1
2 495 1 1 13 PHE H H 10.548 5.670 2.191 1.00 . A A . 12 PHE H 1 1
2 496 1 1 13 PHE HA H 13.040 4.440 1.267 1.00 . A A . 12 PHE HA 1 1
2 497 1 1 13 PHE HB2 H 12.456 7.159 2.433 1.00 . A A . 12 PHE HB2 1 1
2 498 1 1 13 PHE HB3 H 14.053 6.621 1.938 1.00 . A A . 12 PHE HB3 1 1
2 499 1 1 13 PHE HD1 H 11.940 5.064 -0.437 1.00 . A A . 12 PHE HD1 1 1
2 500 1 1 13 PHE HD2 H 13.373 8.966 0.715 1.00 . A A . 12 PHE HD2 1 1
2 501 1 1 13 PHE HE1 H 11.568 5.868 -2.707 1.00 . A A . 12 PHE HE1 1 1
2 502 1 1 13 PHE HE2 H 12.977 9.767 -1.592 1.00 . A A . 12 PHE HE2 1 1
2 503 1 1 13 PHE HZ H 12.072 8.226 -3.300 1.00 . A A . 12 PHE HZ 1 1
2 504 1 1 13 PHE N N 11.118 4.916 1.930 1.00 . A A . 12 PHE N 1 1
2 505 1 1 13 PHE O O 13.961 5.333 3.962 1.00 . A A . 12 PHE O 1 1
2 506 1 1 14 ILE C C 10.549 3.796 1.475 1.00 . A A . 13 ILE C 1 1
2 507 1 1 14 ILE CA C 9.013 3.795 1.401 1.00 . A A . 13 ILE CA 1 1
2 508 1 1 14 ILE CB C 8.394 2.603 2.154 1.00 . A A . 13 ILE CB 1 1
2 509 1 1 14 ILE CD1 C 8.137 0.133 2.289 1.00 . A A . 13 ILE CD1 1 1
2 510 1 1 14 ILE CG1 C 8.768 1.278 1.499 1.00 . A A . 13 ILE CG1 1 1
2 511 1 1 14 ILE CG2 C 6.870 2.741 2.146 1.00 . A A . 13 ILE CG2 1 1
2 512 1 1 14 ILE H H 8.739 3.040 -0.607 1.00 . A A . 13 ILE H 1 1
2 513 1 1 14 ILE HA H 8.673 4.696 1.889 1.00 . A A . 13 ILE HA 1 1
2 514 1 1 14 ILE HB H 8.739 2.609 3.173 1.00 . A A . 13 ILE HB 1 1
2 515 1 1 14 ILE HD11 H 7.072 0.120 2.112 1.00 . A A . 13 ILE HD11 1 1
2 516 1 1 14 ILE HD12 H 8.325 0.278 3.342 1.00 . A A . 13 ILE HD12 1 1
2 517 1 1 14 ILE HD13 H 8.567 -0.804 1.971 1.00 . A A . 13 ILE HD13 1 1
2 518 1 1 14 ILE HG12 H 8.400 1.270 0.494 1.00 . A A . 13 ILE HG12 1 1
2 519 1 1 14 ILE HG13 H 9.834 1.154 1.496 1.00 . A A . 13 ILE HG13 1 1
2 520 1 1 14 ILE HG21 H 6.443 2.052 2.861 1.00 . A A . 13 ILE HG21 1 1
2 521 1 1 14 ILE HG22 H 6.493 2.514 1.160 1.00 . A A . 13 ILE HG22 1 1
2 522 1 1 14 ILE HG23 H 6.596 3.751 2.413 1.00 . A A . 13 ILE HG23 1 1
2 523 1 1 14 ILE N N 8.552 3.815 -0.005 1.00 . A A . 13 ILE N 1 1
2 524 1 1 14 ILE O O 11.205 2.839 1.107 1.00 . A A . 13 ILE O 1 1
2 525 1 1 15 ARG C C 7.896 4.869 -0.495 1.00 . A A . 14 ARG C 1 1
2 526 1 1 15 ARG CA C 7.497 4.783 -1.953 1.00 . A A . 14 ARG CA 1 1
2 527 1 1 15 ARG CB C 8.210 5.898 -2.719 1.00 . A A . 14 ARG CB 1 1
2 528 1 1 15 ARG CD C 8.691 6.799 -4.998 1.00 . A A . 14 ARG CD 1 1
2 529 1 1 15 ARG CG C 7.889 5.773 -4.198 1.00 . A A . 14 ARG CG 1 1
2 530 1 1 15 ARG CZ C 11.019 7.288 -5.481 1.00 . A A . 14 ARG CZ 1 1
2 531 1 1 15 ARG H H 5.511 5.318 -1.434 1.00 . A A . 14 ARG H 1 1
2 532 1 1 15 ARG HA H 7.845 3.842 -2.338 1.00 . A A . 14 ARG HA 1 1
2 533 1 1 15 ARG HB2 H 7.874 6.858 -2.354 1.00 . A A . 14 ARG HB2 1 1
2 534 1 1 15 ARG HB3 H 9.272 5.809 -2.573 1.00 . A A . 14 ARG HB3 1 1
2 535 1 1 15 ARG HD2 H 8.409 6.741 -6.039 1.00 . A A . 14 ARG HD2 1 1
2 536 1 1 15 ARG HD3 H 8.477 7.790 -4.625 1.00 . A A . 14 ARG HD3 1 1
2 537 1 1 15 ARG HE H 10.418 5.766 -4.324 1.00 . A A . 14 ARG HE 1 1
2 538 1 1 15 ARG HG2 H 8.131 4.779 -4.520 1.00 . A A . 14 ARG HG2 1 1
2 539 1 1 15 ARG HG3 H 6.842 5.957 -4.352 1.00 . A A . 14 ARG HG3 1 1
2 540 1 1 15 ARG HH11 H 9.658 8.512 -6.293 1.00 . A A . 14 ARG HH11 1 1
2 541 1 1 15 ARG HH12 H 11.310 8.878 -6.663 1.00 . A A . 14 ARG HH12 1 1
2 542 1 1 15 ARG HH21 H 12.587 6.238 -4.814 1.00 . A A . 14 ARG HH21 1 1
2 543 1 1 15 ARG HH22 H 12.967 7.592 -5.825 1.00 . A A . 14 ARG HH22 1 1
2 544 1 1 15 ARG N N 6.043 4.853 -2.112 1.00 . A A . 14 ARG N 1 1
2 545 1 1 15 ARG NE N 10.118 6.527 -4.869 1.00 . A A . 14 ARG NE 1 1
2 546 1 1 15 ARG NH1 N 10.632 8.305 -6.202 1.00 . A A . 14 ARG NH1 1 1
2 547 1 1 15 ARG NH2 N 12.290 7.018 -5.364 1.00 . A A . 14 ARG NH2 1 1
2 548 1 1 15 ARG O O 7.636 5.872 0.169 1.00 . A A . 14 ARG O 1 1
2 549 1 1 16 ACE C C 5.424 4.296 -3.158 1.00 . A A . 15 ACE C 1 1
2 550 1 1 16 ACE CH3 C 3.907 4.445 -3.194 1.00 . A A . 15 ACE CH3 1 1
2 551 1 1 16 ACE H1 H 3.474 3.596 -3.703 1.00 . A A . 15 ACE H1 1 1
2 552 1 1 16 ACE H2 H 3.646 5.351 -3.719 1.00 . A A . 15 ACE H2 1 1
2 553 1 1 16 ACE H3 H 3.526 4.492 -2.185 1.00 . A A . 15 ACE H3 1 1
2 554 1 1 16 ACE O O 6.023 3.700 -4.061 1.00 . A A . 15 ACE O 1 1
3 555 1 1 1 ACE C C 4.918 0.838 -2.213 1.00 . A A . 0 ACE C 1 1
3 556 1 1 1 ACE CH3 C 4.093 0.223 -3.340 1.00 . A A . 0 ACE CH3 1 1
3 557 1 1 1 ACE H1 H 4.725 0.057 -4.199 1.00 . A A . 0 ACE H1 1 1
3 558 1 1 1 ACE H2 H 3.290 0.894 -3.606 1.00 . A A . 0 ACE H2 1 1
3 559 1 1 1 ACE H3 H 3.681 -0.718 -3.009 1.00 . A A . 0 ACE H3 1 1
3 560 1 1 1 ACE O O 4.390 1.553 -1.362 1.00 . A A . 0 ACE O 1 1
3 561 1 1 2 GLU C C 8.565 0.972 -1.623 1.00 . A A . 1 GLU C 1 1
3 562 1 1 2 GLU CA C 7.104 1.064 -1.178 1.00 . A A . 1 GLU CA 1 1
3 563 1 1 2 GLU CB C 6.900 0.262 0.106 1.00 . A A . 1 GLU CB 1 1
3 564 1 1 2 GLU CD C 6.983 -2.017 1.132 1.00 . A A . 1 GLU CD 1 1
3 565 1 1 2 GLU CG C 7.204 -1.217 -0.148 1.00 . A A . 1 GLU CG 1 1
3 566 1 1 2 GLU H H 6.579 -0.035 -2.906 1.00 . A A . 1 GLU H 1 1
3 567 1 1 2 GLU HA H 6.855 2.096 -0.986 1.00 . A A . 1 GLU HA 1 1
3 568 1 1 2 GLU HB2 H 7.556 0.638 0.872 1.00 . A A . 1 GLU HB2 1 1
3 569 1 1 2 GLU HB3 H 5.875 0.363 0.429 1.00 . A A . 1 GLU HB3 1 1
3 570 1 1 2 GLU HG2 H 6.549 -1.591 -0.921 1.00 . A A . 1 GLU HG2 1 1
3 571 1 1 2 GLU HG3 H 8.230 -1.326 -0.462 1.00 . A A . 1 GLU HG3 1 1
3 572 1 1 2 GLU N N 6.216 0.545 -2.209 1.00 . A A . 1 GLU N 1 1
3 573 1 1 2 GLU O O 9.474 0.947 -0.798 1.00 . A A . 1 GLU O 1 1
3 574 1 1 2 GLU OE1 O 5.870 -2.006 1.631 1.00 . A A . 1 GLU OE1 1 1
3 575 1 1 2 GLU OE2 O 7.931 -2.631 1.596 1.00 . A A . 1 GLU OE2 1 1
3 576 1 1 3 ARG C C 10.980 2.002 -3.142 1.00 . A A . 2 ARG C 1 1
3 577 1 1 3 ARG CA C 10.131 0.811 -3.489 1.00 . A A . 2 ARG CA 1 1
3 578 1 1 3 ARG CB C 10.103 0.621 -5.021 1.00 . A A . 2 ARG CB 1 1
3 579 1 1 3 ARG CD C 8.344 -1.137 -4.679 1.00 . A A . 2 ARG CD 1 1
3 580 1 1 3 ARG CG C 9.591 -0.777 -5.452 1.00 . A A . 2 ARG CG 1 1
3 581 1 1 3 ARG CZ C 9.464 -2.487 -3.012 1.00 . A A . 2 ARG CZ 1 1
3 582 1 1 3 ARG H H 8.012 0.943 -3.545 1.00 . A A . 2 ARG H 1 1
3 583 1 1 3 ARG HA H 10.608 -0.054 -3.055 1.00 . A A . 2 ARG HA 1 1
3 584 1 1 3 ARG HB2 H 9.468 1.374 -5.456 1.00 . A A . 2 ARG HB2 1 1
3 585 1 1 3 ARG HB3 H 11.109 0.746 -5.396 1.00 . A A . 2 ARG HB3 1 1
3 586 1 1 3 ARG HD2 H 7.641 -0.319 -4.709 1.00 . A A . 2 ARG HD2 1 1
3 587 1 1 3 ARG HD3 H 7.893 -2.021 -5.104 1.00 . A A . 2 ARG HD3 1 1
3 588 1 1 3 ARG HE H 8.657 -0.712 -2.639 1.00 . A A . 2 ARG HE 1 1
3 589 1 1 3 ARG HG2 H 9.367 -0.767 -6.508 1.00 . A A . 2 ARG HG2 1 1
3 590 1 1 3 ARG HG3 H 10.357 -1.512 -5.255 1.00 . A A . 2 ARG HG3 1 1
3 591 1 1 3 ARG HH11 H 9.231 -3.321 -4.818 1.00 . A A . 2 ARG HH11 1 1
3 592 1 1 3 ARG HH12 H 10.166 -4.237 -3.684 1.00 . A A . 2 ARG HH12 1 1
3 593 1 1 3 ARG HH21 H 9.858 -1.898 -1.140 1.00 . A A . 2 ARG HH21 1 1
3 594 1 1 3 ARG HH22 H 10.522 -3.430 -1.599 1.00 . A A . 2 ARG HH22 1 1
3 595 1 1 3 ARG N N 8.777 0.918 -2.936 1.00 . A A . 2 ARG N 1 1
3 596 1 1 3 ARG NE N 8.755 -1.404 -3.310 1.00 . A A . 2 ARG NE 1 1
3 597 1 1 3 ARG NH1 N 9.634 -3.421 -3.908 1.00 . A A . 2 ARG NH1 1 1
3 598 1 1 3 ARG NH2 N 9.989 -2.615 -1.824 1.00 . A A . 2 ARG NH2 1 1
3 599 1 1 3 ARG O O 10.513 3.026 -2.648 1.00 . A A . 2 ARG O 1 1
3 600 1 1 4 PHE C C 13.910 2.533 -1.793 1.00 . A A . 3 PHE C 1 1
3 601 1 1 4 PHE CA C 13.315 2.716 -3.177 1.00 . A A . 3 PHE CA 1 1
3 602 1 1 4 PHE CB C 12.958 4.205 -3.366 1.00 . A A . 3 PHE CB 1 1
3 603 1 1 4 PHE CD1 C 15.335 4.853 -3.944 1.00 . A A . 3 PHE CD1 1 1
3 604 1 1 4 PHE CD2 C 14.315 5.827 -1.974 1.00 . A A . 3 PHE CD2 1 1
3 605 1 1 4 PHE CE1 C 16.526 5.535 -3.662 1.00 . A A . 3 PHE CE1 1 1
3 606 1 1 4 PHE CE2 C 15.504 6.513 -1.694 1.00 . A A . 3 PHE CE2 1 1
3 607 1 1 4 PHE CG C 14.226 5.001 -3.101 1.00 . A A . 3 PHE CG 1 1
3 608 1 1 4 PHE CZ C 16.610 6.365 -2.538 1.00 . A A . 3 PHE CZ 1 1
3 609 1 1 4 PHE H H 12.476 0.913 -3.782 1.00 . A A . 3 PHE H 1 1
3 610 1 1 4 PHE HA H 14.049 2.448 -3.889 1.00 . A A . 3 PHE HA 1 1
3 611 1 1 4 PHE HB2 H 12.616 4.379 -4.377 1.00 . A A . 3 PHE HB2 1 1
3 612 1 1 4 PHE HB3 H 12.194 4.507 -2.664 1.00 . A A . 3 PHE HB3 1 1
3 613 1 1 4 PHE HD1 H 15.271 4.218 -4.815 1.00 . A A . 3 PHE HD1 1 1
3 614 1 1 4 PHE HD2 H 13.464 5.943 -1.328 1.00 . A A . 3 PHE HD2 1 1
3 615 1 1 4 PHE HE1 H 17.380 5.420 -4.311 1.00 . A A . 3 PHE HE1 1 1
3 616 1 1 4 PHE HE2 H 15.573 7.144 -0.817 1.00 . A A . 3 PHE HE2 1 1
3 617 1 1 4 PHE HZ H 17.527 6.891 -2.321 1.00 . A A . 3 PHE HZ 1 1
3 618 1 1 4 PHE N N 12.241 1.785 -3.405 1.00 . A A . 3 PHE N 1 1
3 619 1 1 4 PHE O O 13.458 3.149 -0.822 1.00 . A A . 3 PHE O 1 1
3 620 1 1 5 TYR C C 16.896 0.785 -0.597 1.00 . A A . 4 TYR C 1 1
3 621 1 1 5 TYR CA C 15.561 1.485 -0.416 1.00 . A A . 4 TYR CA 1 1
3 622 1 1 5 TYR CB C 14.605 0.644 0.427 1.00 . A A . 4 TYR CB 1 1
3 623 1 1 5 TYR CD1 C 15.444 -1.641 -0.135 1.00 . A A . 4 TYR CD1 1 1
3 624 1 1 5 TYR CD2 C 13.299 -0.940 -1.005 1.00 . A A . 4 TYR CD2 1 1
3 625 1 1 5 TYR CE1 C 15.326 -2.858 -0.796 1.00 . A A . 4 TYR CE1 1 1
3 626 1 1 5 TYR CE2 C 13.171 -2.158 -1.672 1.00 . A A . 4 TYR CE2 1 1
3 627 1 1 5 TYR CG C 14.429 -0.689 -0.231 1.00 . A A . 4 TYR CG 1 1
3 628 1 1 5 TYR CZ C 14.186 -3.124 -1.570 1.00 . A A . 4 TYR CZ 1 1
3 629 1 1 5 TYR H H 15.268 1.238 -2.495 1.00 . A A . 4 TYR H 1 1
3 630 1 1 5 TYR HA H 15.719 2.429 0.063 1.00 . A A . 4 TYR HA 1 1
3 631 1 1 5 TYR HB2 H 15.024 0.498 1.409 1.00 . A A . 4 TYR HB2 1 1
3 632 1 1 5 TYR HB3 H 13.649 1.139 0.503 1.00 . A A . 4 TYR HB3 1 1
3 633 1 1 5 TYR HD1 H 16.313 -1.443 0.473 1.00 . A A . 4 TYR HD1 1 1
3 634 1 1 5 TYR HD2 H 12.522 -0.194 -1.082 1.00 . A A . 4 TYR HD2 1 1
3 635 1 1 5 TYR HE1 H 16.114 -3.590 -0.706 1.00 . A A . 4 TYR HE1 1 1
3 636 1 1 5 TYR HE2 H 12.297 -2.346 -2.275 1.00 . A A . 4 TYR HE2 1 1
3 637 1 1 5 TYR HH H 14.752 -4.916 -1.905 1.00 . A A . 4 TYR HH 1 1
3 638 1 1 5 TYR N N 14.933 1.700 -1.698 1.00 . A A . 4 TYR N 1 1
3 639 1 1 5 TYR O O 17.121 0.108 -1.600 1.00 . A A . 4 TYR O 1 1
3 640 1 1 5 TYR OH O 14.064 -4.330 -2.229 1.00 . A A . 4 TYR OH 1 1
3 641 1 1 6 GLU C C 19.090 -0.707 1.547 1.00 . A A . 5 GLU C 1 1
3 642 1 1 6 GLU CA C 19.064 0.259 0.372 1.00 . A A . 5 GLU CA 1 1
3 643 1 1 6 GLU CB C 20.177 1.323 0.463 1.00 . A A . 5 GLU CB 1 1
3 644 1 1 6 GLU CD C 21.828 -0.236 1.570 1.00 . A A . 5 GLU CD 1 1
3 645 1 1 6 GLU CG C 21.576 0.689 0.387 1.00 . A A . 5 GLU CG 1 1
3 646 1 1 6 GLU H H 17.509 1.445 1.183 1.00 . A A . 5 GLU H 1 1
3 647 1 1 6 GLU HA H 19.180 -0.303 -0.547 1.00 . A A . 5 GLU HA 1 1
3 648 1 1 6 GLU HB2 H 20.063 2.020 -0.353 1.00 . A A . 5 GLU HB2 1 1
3 649 1 1 6 GLU HB3 H 20.082 1.855 1.393 1.00 . A A . 5 GLU HB3 1 1
3 650 1 1 6 GLU HG2 H 21.659 0.124 -0.529 1.00 . A A . 5 GLU HG2 1 1
3 651 1 1 6 GLU HG3 H 22.318 1.475 0.386 1.00 . A A . 5 GLU HG3 1 1
3 652 1 1 6 GLU N N 17.761 0.916 0.398 1.00 . A A . 5 GLU N 1 1
3 653 1 1 6 GLU O O 19.299 -0.305 2.692 1.00 . A A . 5 GLU O 1 1
3 654 1 1 6 GLU OE1 O 21.756 0.239 2.691 1.00 . A A . 5 GLU OE1 1 1
3 655 1 1 6 GLU OE2 O 22.089 -1.403 1.337 1.00 . A A . 5 GLU OE2 1 1
3 656 1 1 7 LYS C C 19.986 -3.937 2.200 1.00 . A A . 6 LYS C 1 1
3 657 1 1 7 LYS CA C 18.785 -3.012 2.299 1.00 . A A . 6 LYS CA 1 1
3 658 1 1 7 LYS CB C 17.486 -3.818 2.146 1.00 . A A . 6 LYS CB 1 1
3 659 1 1 7 LYS CD C 16.074 -5.688 3.216 1.00 . A A . 6 LYS CD 1 1
3 660 1 1 7 LYS CE C 15.861 -6.480 1.908 1.00 . A A . 6 LYS CE 1 1
3 661 1 1 7 LYS CG C 17.402 -4.888 3.245 1.00 . A A . 6 LYS CG 1 1
3 662 1 1 7 LYS H H 18.648 -2.233 0.330 1.00 . A A . 6 LYS H 1 1
3 663 1 1 7 LYS HA H 18.788 -2.543 3.270 1.00 . A A . 6 LYS HA 1 1
3 664 1 1 7 LYS HB2 H 16.637 -3.153 2.215 1.00 . A A . 6 LYS HB2 1 1
3 665 1 1 7 LYS HB3 H 17.504 -4.289 1.184 1.00 . A A . 6 LYS HB3 1 1
3 666 1 1 7 LYS HD2 H 16.070 -6.382 4.042 1.00 . A A . 6 LYS HD2 1 1
3 667 1 1 7 LYS HD3 H 15.253 -4.997 3.342 1.00 . A A . 6 LYS HD3 1 1
3 668 1 1 7 LYS HE2 H 16.716 -7.117 1.739 1.00 . A A . 6 LYS HE2 1 1
3 669 1 1 7 LYS HE3 H 14.979 -7.097 2.012 1.00 . A A . 6 LYS HE3 1 1
3 670 1 1 7 LYS HG2 H 18.222 -5.578 3.129 1.00 . A A . 6 LYS HG2 1 1
3 671 1 1 7 LYS HG3 H 17.490 -4.403 4.203 1.00 . A A . 6 LYS HG3 1 1
3 672 1 1 7 LYS HZ1 H 16.545 -5.607 0.146 1.00 . A A . 6 LYS HZ1 1 1
3 673 1 1 7 LYS HZ2 H 15.529 -4.603 1.070 1.00 . A A . 6 LYS HZ2 1 1
3 674 1 1 7 LYS HZ3 H 14.874 -5.887 0.177 1.00 . A A . 6 LYS HZ3 1 1
3 675 1 1 7 LYS N N 18.835 -1.983 1.258 1.00 . A A . 6 LYS N 1 1
3 676 1 1 7 LYS NZ N 15.692 -5.575 0.738 1.00 . A A . 6 LYS NZ 1 1
3 677 1 1 7 LYS O O 20.283 -4.484 1.138 1.00 . A A . 6 LYS O 1 1
3 678 1 1 8 . CAA C 24.335 -5.063 3.363 1.00 . A A . 7 4G6 CAA 1 1
3 679 1 1 8 . CAB C 23.185 -3.805 1.554 1.00 . A A . 7 4G6 CAB 1 1
3 680 1 1 8 . CAE C 21.854 -4.988 3.288 1.00 . A A . 7 4G6 CAE 1 1
3 681 1 1 8 . CAF C 23.129 -4.180 3.037 1.00 . A A . 7 4G6 CAF 1 1
3 682 1 1 8 . HAA H 24.149 -5.602 4.292 1.00 . A A . 7 4G6 HAA 1 1
3 683 1 1 8 . HAB H 25.221 -4.439 3.476 1.00 . A A . 7 4G6 HAB 1 1
3 684 1 1 8 . HAC H 24.493 -5.775 2.554 1.00 . A A . 7 4G6 HAC 1 1
3 685 1 1 8 . HAD H 22.187 -3.535 1.207 1.00 . A A . 7 4G6 HAD 1 1
3 686 1 1 8 . HAE H 23.553 -4.654 0.978 1.00 . A A . 7 4G6 HAE 1 1
3 687 1 1 8 . HAF H 23.859 -2.959 1.422 1.00 . A A . 7 4G6 HAF 1 1
3 688 1 1 8 . HAG H 21.748 -5.731 2.496 1.00 . A A . 7 4G6 HAG 1 1
3 689 1 1 8 . HAH H 21.930 -5.498 4.249 1.00 . A A . 7 4G6 HAH 1 1
3 690 1 1 8 . HAI H 20.401 -3.648 4.137 1.00 . A A . 7 4G6 HAI 1 1
3 691 1 1 8 . HAL H 23.463 -2.108 3.458 1.00 . A A . 7 4G6 HAL 1 1
3 692 1 1 8 . NAC N 20.674 -4.112 3.294 1.00 . A A . 7 4G6 NAC 1 1
3 693 1 1 8 . NAD N 23.155 -2.966 3.867 1.00 . A A . 7 4G6 NAD 1 1
3 694 1 1 9 DPR C C 22.811 -2.989 5.135 1.00 . A A . 8 DPR C 1 1
3 695 1 1 9 DPR CA C 22.897 -1.684 5.944 1.00 . A A . 8 DPR CA 1 1
3 696 1 1 9 DPR CB C 23.661 -0.584 5.213 1.00 . A A . 8 DPR CB 1 1
3 697 1 1 9 DPR CD C 21.795 0.425 6.435 1.00 . A A . 8 DPR CD 1 1
3 698 1 1 9 DPR CG C 23.222 0.683 5.894 1.00 . A A . 8 DPR CG 1 1
3 699 1 1 9 DPR HA H 23.393 -1.878 6.880 1.00 . A A . 8 DPR HA 1 1
3 700 1 1 9 DPR HB2 H 24.729 -0.731 5.320 1.00 . A A . 8 DPR HB2 1 1
3 701 1 1 9 DPR HB3 H 23.385 -0.558 4.172 1.00 . A A . 8 DPR HB3 1 1
3 702 1 1 9 DPR HD2 H 21.739 0.655 7.492 1.00 . A A . 8 DPR HD2 1 1
3 703 1 1 9 DPR HD3 H 21.065 0.997 5.884 1.00 . A A . 8 DPR HD3 1 1
3 704 1 1 9 DPR HG2 H 23.896 0.915 6.711 1.00 . A A . 8 DPR HG2 1 1
3 705 1 1 9 DPR HG3 H 23.203 1.502 5.189 1.00 . A A . 8 DPR HG3 1 1
3 706 1 1 9 DPR N N 21.588 -1.016 6.205 1.00 . A A . 8 DPR N 1 1
3 707 1 1 9 DPR O O 22.453 -4.025 5.694 1.00 . A A . 8 DPR O 1 1
3 708 1 1 10 VAL C C 20.430 -1.639 6.208 1.00 . A A . 9 VAL C 1 1
3 709 1 1 10 VAL CA C 19.172 -0.812 6.559 1.00 . A A . 9 VAL CA 1 1
3 710 1 1 10 VAL CB C 18.111 -1.719 7.206 1.00 . A A . 9 VAL CB 1 1
3 711 1 1 10 VAL CG1 C 17.605 -2.770 6.205 1.00 . A A . 9 VAL CG1 1 1
3 712 1 1 10 VAL CG2 C 18.715 -2.414 8.431 1.00 . A A . 9 VAL CG2 1 1
3 713 1 1 10 VAL H H 18.689 -0.564 4.505 1.00 . A A . 9 VAL H 1 1
3 714 1 1 10 VAL HA H 19.442 -0.054 7.278 1.00 . A A . 9 VAL HA 1 1
3 715 1 1 10 VAL HB H 17.276 -1.114 7.515 1.00 . A A . 9 VAL HB 1 1
3 716 1 1 10 VAL HG11 H 17.586 -2.345 5.211 1.00 . A A . 9 VAL HG11 1 1
3 717 1 1 10 VAL HG12 H 16.603 -3.073 6.476 1.00 . A A . 9 VAL HG12 1 1
3 718 1 1 10 VAL HG13 H 18.248 -3.635 6.218 1.00 . A A . 9 VAL HG13 1 1
3 719 1 1 10 VAL HG21 H 19.256 -1.692 9.024 1.00 . A A . 9 VAL HG21 1 1
3 720 1 1 10 VAL HG22 H 19.389 -3.193 8.108 1.00 . A A . 9 VAL HG22 1 1
3 721 1 1 10 VAL HG23 H 17.924 -2.847 9.026 1.00 . A A . 9 VAL HG23 1 1
3 722 1 1 10 VAL N N 18.572 -0.165 5.393 1.00 . A A . 9 VAL N 1 1
3 723 1 1 10 VAL O O 20.352 -2.844 5.990 1.00 . A A . 9 VAL O 1 1
3 724 1 1 11 GLN C C 17.832 0.946 5.523 1.00 . A A . 10 GLN C 1 1
3 725 1 1 11 GLN CA C 17.223 1.501 4.239 1.00 . A A . 10 GLN CA 1 1
3 726 1 1 11 GLN CB C 18.186 2.469 3.522 1.00 . A A . 10 GLN CB 1 1
3 727 1 1 11 GLN CD C 18.861 3.590 5.679 1.00 . A A . 10 GLN CD 1 1
3 728 1 1 11 GLN CG C 18.296 3.801 4.277 1.00 . A A . 10 GLN CG 1 1
3 729 1 1 11 GLN H H 15.623 2.262 5.409 1.00 . A A . 10 GLN H 1 1
3 730 1 1 11 GLN HA H 17.038 0.664 3.577 1.00 . A A . 10 GLN HA 1 1
3 731 1 1 11 GLN HB2 H 19.163 2.015 3.483 1.00 . A A . 10 GLN HB2 1 1
3 732 1 1 11 GLN HB3 H 17.842 2.656 2.517 1.00 . A A . 10 GLN HB3 1 1
3 733 1 1 11 GLN HE21 H 17.271 4.353 6.593 1.00 . A A . 10 GLN HE21 1 1
3 734 1 1 11 GLN HE22 H 18.512 3.817 7.620 1.00 . A A . 10 GLN HE22 1 1
3 735 1 1 11 GLN HG2 H 18.945 4.466 3.724 1.00 . A A . 10 GLN HG2 1 1
3 736 1 1 11 GLN HG3 H 17.314 4.247 4.348 1.00 . A A . 10 GLN HG3 1 1
3 737 1 1 11 GLN N N 15.939 2.158 4.488 1.00 . A A . 10 GLN N 1 1
3 738 1 1 11 GLN NE2 N 18.156 3.950 6.716 1.00 . A A . 10 GLN NE2 1 1
3 739 1 1 11 GLN O O 17.612 1.483 6.609 1.00 . A A . 10 GLN O 1 1
3 740 1 1 11 GLN OE1 O 19.972 3.084 5.831 1.00 . A A . 10 GLN OE1 1 1
3 741 1 1 12 LYS C C 15.206 2.635 3.493 1.00 . A A . 11 LYS C 1 1
3 742 1 1 12 LYS CA C 13.899 3.324 3.864 1.00 . A A . 11 LYS CA 1 1
3 743 1 1 12 LYS CB C 12.898 2.315 4.437 1.00 . A A . 11 LYS CB 1 1
3 744 1 1 12 LYS CD C 11.569 0.253 3.971 1.00 . A A . 11 LYS CD 1 1
3 745 1 1 12 LYS CE C 11.234 -0.803 2.917 1.00 . A A . 11 LYS CE 1 1
3 746 1 1 12 LYS CG C 12.580 1.245 3.392 1.00 . A A . 11 LYS CG 1 1
3 747 1 1 12 LYS H H 13.630 3.664 1.792 1.00 . A A . 11 LYS H 1 1
3 748 1 1 12 LYS HA H 14.102 4.078 4.611 1.00 . A A . 11 LYS HA 1 1
3 749 1 1 12 LYS HB2 H 13.323 1.847 5.314 1.00 . A A . 11 LYS HB2 1 1
3 750 1 1 12 LYS HB3 H 11.988 2.829 4.710 1.00 . A A . 11 LYS HB3 1 1
3 751 1 1 12 LYS HD2 H 11.992 -0.226 4.842 1.00 . A A . 11 LYS HD2 1 1
3 752 1 1 12 LYS HD3 H 10.668 0.778 4.250 1.00 . A A . 11 LYS HD3 1 1
3 753 1 1 12 LYS HE2 H 10.511 -1.497 3.320 1.00 . A A . 11 LYS HE2 1 1
3 754 1 1 12 LYS HE3 H 10.822 -0.322 2.043 1.00 . A A . 11 LYS HE3 1 1
3 755 1 1 12 LYS HG2 H 12.165 1.711 2.511 1.00 . A A . 11 LYS HG2 1 1
3 756 1 1 12 LYS HG3 H 13.482 0.718 3.131 1.00 . A A . 11 LYS HG3 1 1
3 757 1 1 12 LYS HZ1 H 12.899 -1.098 1.702 1.00 . A A . 11 LYS HZ1 1 1
3 758 1 1 12 LYS HZ2 H 12.236 -2.531 2.328 1.00 . A A . 11 LYS HZ2 1 1
3 759 1 1 12 LYS HZ3 H 13.151 -1.507 3.328 1.00 . A A . 11 LYS HZ3 1 1
3 760 1 1 12 LYS N N 13.345 3.970 2.683 1.00 . A A . 11 LYS N 1 1
3 761 1 1 12 LYS NZ N 12.473 -1.541 2.541 1.00 . A A . 11 LYS NZ 1 1
3 762 1 1 12 LYS O O 15.551 2.561 2.322 1.00 . A A . 11 LYS O 1 1
3 763 1 1 13 PHE C C 12.472 4.964 2.770 1.00 . A A . 12 PHE C 1 1
3 764 1 1 13 PHE CA C 12.010 5.520 1.434 1.00 . A A . 12 PHE CA 1 1
3 765 1 1 13 PHE CB C 12.065 7.057 1.465 1.00 . A A . 12 PHE CB 1 1
3 766 1 1 13 PHE CD1 C 10.713 7.413 -0.653 1.00 . A A . 12 PHE CD1 1 1
3 767 1 1 13 PHE CD2 C 12.948 8.347 -0.518 1.00 . A A . 12 PHE CD2 1 1
3 768 1 1 13 PHE CE1 C 10.585 7.932 -1.949 1.00 . A A . 12 PHE CE1 1 1
3 769 1 1 13 PHE CE2 C 12.813 8.863 -1.811 1.00 . A A . 12 PHE CE2 1 1
3 770 1 1 13 PHE CG C 11.897 7.620 0.066 1.00 . A A . 12 PHE CG 1 1
3 771 1 1 13 PHE CZ C 11.632 8.655 -2.525 1.00 . A A . 12 PHE CZ 1 1
3 772 1 1 13 PHE H H 10.543 4.527 0.262 1.00 . A A . 12 PHE H 1 1
3 773 1 1 13 PHE HA H 12.697 5.172 0.680 1.00 . A A . 12 PHE HA 1 1
3 774 1 1 13 PHE HB2 H 11.270 7.427 2.094 1.00 . A A . 12 PHE HB2 1 1
3 775 1 1 13 PHE HB3 H 13.015 7.374 1.873 1.00 . A A . 12 PHE HB3 1 1
3 776 1 1 13 PHE HD1 H 9.900 6.858 -0.212 1.00 . A A . 12 PHE HD1 1 1
3 777 1 1 13 PHE HD2 H 13.864 8.511 0.031 1.00 . A A . 12 PHE HD2 1 1
3 778 1 1 13 PHE HE1 H 9.681 7.775 -2.503 1.00 . A A . 12 PHE HE1 1 1
3 779 1 1 13 PHE HE2 H 13.622 9.420 -2.258 1.00 . A A . 12 PHE HE2 1 1
3 780 1 1 13 PHE HZ H 11.526 9.052 -3.524 1.00 . A A . 12 PHE HZ 1 1
3 781 1 1 13 PHE N N 10.681 5.028 1.089 1.00 . A A . 12 PHE N 1 1
3 782 1 1 13 PHE O O 12.059 5.421 3.835 1.00 . A A . 12 PHE O 1 1
3 783 1 1 14 ILE C C 9.652 5.236 1.887 1.00 . A A . 13 ILE C 1 1
3 784 1 1 14 ILE CA C 8.322 4.651 1.426 1.00 . A A . 13 ILE CA 1 1
3 785 1 1 14 ILE CB C 7.989 3.406 2.266 1.00 . A A . 13 ILE CB 1 1
3 786 1 1 14 ILE CD1 C 7.447 2.537 4.547 1.00 . A A . 13 ILE CD1 1 1
3 787 1 1 14 ILE CG1 C 7.838 3.781 3.746 1.00 . A A . 13 ILE CG1 1 1
3 788 1 1 14 ILE CG2 C 9.129 2.395 2.144 1.00 . A A . 13 ILE CG2 1 1
3 789 1 1 14 ILE H H 9.055 3.643 -0.324 1.00 . A A . 13 ILE H 1 1
3 790 1 1 14 ILE HA H 7.559 5.389 1.580 1.00 . A A . 13 ILE HA 1 1
3 791 1 1 14 ILE HB H 7.071 2.962 1.908 1.00 . A A . 13 ILE HB 1 1
3 792 1 1 14 ILE HD11 H 7.097 2.835 5.524 1.00 . A A . 13 ILE HD11 1 1
3 793 1 1 14 ILE HD12 H 8.306 1.892 4.653 1.00 . A A . 13 ILE HD12 1 1
3 794 1 1 14 ILE HD13 H 6.661 2.007 4.029 1.00 . A A . 13 ILE HD13 1 1
3 795 1 1 14 ILE HG12 H 8.774 4.161 4.121 1.00 . A A . 13 ILE HG12 1 1
3 796 1 1 14 ILE HG13 H 7.071 4.532 3.853 1.00 . A A . 13 ILE HG13 1 1
3 797 1 1 14 ILE HG21 H 8.838 1.464 2.608 1.00 . A A . 13 ILE HG21 1 1
3 798 1 1 14 ILE HG22 H 10.009 2.779 2.638 1.00 . A A . 13 ILE HG22 1 1
3 799 1 1 14 ILE HG23 H 9.348 2.227 1.104 1.00 . A A . 13 ILE HG23 1 1
3 800 1 1 14 ILE N N 8.380 4.290 -0.004 1.00 . A A . 13 ILE N 1 1
3 801 1 1 14 ILE O O 9.743 5.855 2.947 1.00 . A A . 13 ILE O 1 1
3 802 1 1 15 ARG C C 7.526 4.817 -0.884 1.00 . A A . 14 ARG C 1 1
3 803 1 1 15 ARG CA C 7.688 4.360 -2.325 1.00 . A A . 14 ARG CA 1 1
3 804 1 1 15 ARG CB C 8.534 5.369 -3.084 1.00 . A A . 14 ARG CB 1 1
3 805 1 1 15 ARG CD C 9.611 5.864 -5.277 1.00 . A A . 14 ARG CD 1 1
3 806 1 1 15 ARG CG C 8.782 4.845 -4.491 1.00 . A A . 14 ARG CG 1 1
3 807 1 1 15 ARG CZ C 11.789 6.933 -5.125 1.00 . A A . 14 ARG CZ 1 1
3 808 1 1 15 ARG H H 5.710 4.907 -2.856 1.00 . A A . 14 ARG H 1 1
3 809 1 1 15 ARG HA H 8.205 3.415 -2.331 1.00 . A A . 14 ARG HA 1 1
3 810 1 1 15 ARG HB2 H 8.011 6.312 -3.134 1.00 . A A . 14 ARG HB2 1 1
3 811 1 1 15 ARG HB3 H 9.479 5.497 -2.580 1.00 . A A . 14 ARG HB3 1 1
3 812 1 1 15 ARG HD2 H 9.770 5.496 -6.279 1.00 . A A . 14 ARG HD2 1 1
3 813 1 1 15 ARG HD3 H 9.075 6.801 -5.322 1.00 . A A . 14 ARG HD3 1 1
3 814 1 1 15 ARG HE H 11.115 5.579 -3.813 1.00 . A A . 14 ARG HE 1 1
3 815 1 1 15 ARG HG2 H 9.315 3.910 -4.426 1.00 . A A . 14 ARG HG2 1 1
3 816 1 1 15 ARG HG3 H 7.837 4.687 -4.987 1.00 . A A . 14 ARG HG3 1 1
3 817 1 1 15 ARG HH11 H 10.653 7.450 -6.690 1.00 . A A . 14 ARG HH11 1 1
3 818 1 1 15 ARG HH12 H 12.194 8.237 -6.589 1.00 . A A . 14 ARG HH12 1 1
3 819 1 1 15 ARG HH21 H 13.125 6.624 -3.668 1.00 . A A . 14 ARG HH21 1 1
3 820 1 1 15 ARG HH22 H 13.595 7.765 -4.882 1.00 . A A . 14 ARG HH22 1 1
3 821 1 1 15 ARG N N 6.389 4.211 -2.982 1.00 . A A . 14 ARG N 1 1
3 822 1 1 15 ARG NE N 10.902 6.072 -4.632 1.00 . A A . 14 ARG NE 1 1
3 823 1 1 15 ARG NH1 N 11.525 7.592 -6.220 1.00 . A A . 14 ARG NH1 1 1
3 824 1 1 15 ARG NH2 N 12.924 7.122 -4.510 1.00 . A A . 14 ARG NH2 1 1
3 825 1 1 15 ARG O O 6.650 5.624 -0.573 1.00 . A A . 14 ARG O 1 1
3 826 1 1 16 ACE C C 6.106 3.161 -3.750 1.00 . A A . 15 ACE C 1 1
3 827 1 1 16 ACE CH3 C 4.714 3.142 -4.374 1.00 . A A . 15 ACE CH3 1 1
3 828 1 1 16 ACE H1 H 4.584 4.021 -4.988 1.00 . A A . 15 ACE H1 1 1
3 829 1 1 16 ACE H2 H 3.969 3.136 -3.591 1.00 . A A . 15 ACE H2 1 1
3 830 1 1 16 ACE H3 H 4.604 2.258 -4.983 1.00 . A A . 15 ACE H3 1 1
3 831 1 1 16 ACE O O 6.904 2.247 -3.960 1.00 . A A . 15 ACE O 1 1
4 832 1 1 1 ACE C C 7.621 3.431 -6.213 1.00 . A A . 0 ACE C 1 1
4 833 1 1 1 ACE CH3 C 6.142 3.762 -6.059 1.00 . A A . 0 ACE CH3 1 1
4 834 1 1 1 ACE H1 H 5.550 2.892 -6.311 1.00 . A A . 0 ACE H1 1 1
4 835 1 1 1 ACE H2 H 5.884 4.576 -6.721 1.00 . A A . 0 ACE H2 1 1
4 836 1 1 1 ACE H3 H 5.940 4.051 -5.039 1.00 . A A . 0 ACE H3 1 1
4 837 1 1 1 ACE O O 8.133 3.333 -7.328 1.00 . A A . 0 ACE O 1 1
4 838 1 1 2 GLU C C 9.966 1.930 -3.949 1.00 . A A . 1 GLU C 1 1
4 839 1 1 2 GLU CA C 9.721 2.908 -5.095 1.00 . A A . 1 GLU CA 1 1
4 840 1 1 2 GLU CB C 10.556 4.179 -4.943 1.00 . A A . 1 GLU CB 1 1
4 841 1 1 2 GLU CD C 12.887 5.074 -4.900 1.00 . A A . 1 GLU CD 1 1
4 842 1 1 2 GLU CG C 12.029 3.820 -5.040 1.00 . A A . 1 GLU CG 1 1
4 843 1 1 2 GLU H H 7.845 3.317 -4.222 1.00 . A A . 1 GLU H 1 1
4 844 1 1 2 GLU HA H 9.973 2.424 -6.031 1.00 . A A . 1 GLU HA 1 1
4 845 1 1 2 GLU HB2 H 10.300 4.875 -5.729 1.00 . A A . 1 GLU HB2 1 1
4 846 1 1 2 GLU HB3 H 10.358 4.629 -3.982 1.00 . A A . 1 GLU HB3 1 1
4 847 1 1 2 GLU HG2 H 12.269 3.123 -4.262 1.00 . A A . 1 GLU HG2 1 1
4 848 1 1 2 GLU HG3 H 12.218 3.363 -5.998 1.00 . A A . 1 GLU HG3 1 1
4 849 1 1 2 GLU N N 8.305 3.244 -5.084 1.00 . A A . 1 GLU N 1 1
4 850 1 1 2 GLU O O 9.497 2.153 -2.827 1.00 . A A . 1 GLU O 1 1
4 851 1 1 2 GLU OE1 O 12.726 5.970 -5.713 1.00 . A A . 1 GLU OE1 1 1
4 852 1 1 2 GLU OE2 O 13.697 5.121 -3.990 1.00 . A A . 1 GLU OE2 1 1
4 853 1 1 3 ARG C C 11.636 0.200 -2.084 1.00 . A A . 2 ARG C 1 1
4 854 1 1 3 ARG CA C 10.812 -0.252 -3.271 1.00 . A A . 2 ARG CA 1 1
4 855 1 1 3 ARG CB C 11.506 -1.464 -3.915 1.00 . A A . 2 ARG CB 1 1
4 856 1 1 3 ARG CD C 13.208 0.051 -5.069 1.00 . A A . 2 ARG CD 1 1
4 857 1 1 3 ARG CG C 13.001 -1.198 -4.224 1.00 . A A . 2 ARG CG 1 1
4 858 1 1 3 ARG CZ C 12.662 -0.930 -7.214 1.00 . A A . 2 ARG CZ 1 1
4 859 1 1 3 ARG H H 10.905 0.664 -5.183 1.00 . A A . 2 ARG H 1 1
4 860 1 1 3 ARG HA H 9.854 -0.549 -2.917 1.00 . A A . 2 ARG HA 1 1
4 861 1 1 3 ARG HB2 H 11.433 -2.307 -3.248 1.00 . A A . 2 ARG HB2 1 1
4 862 1 1 3 ARG HB3 H 10.998 -1.705 -4.838 1.00 . A A . 2 ARG HB3 1 1
4 863 1 1 3 ARG HD2 H 12.932 0.920 -4.510 1.00 . A A . 2 ARG HD2 1 1
4 864 1 1 3 ARG HD3 H 14.255 0.126 -5.329 1.00 . A A . 2 ARG HD3 1 1
4 865 1 1 3 ARG HE H 11.693 0.604 -6.375 1.00 . A A . 2 ARG HE 1 1
4 866 1 1 3 ARG HG2 H 13.538 -1.086 -3.298 1.00 . A A . 2 ARG HG2 1 1
4 867 1 1 3 ARG HG3 H 13.398 -2.046 -4.756 1.00 . A A . 2 ARG HG3 1 1
4 868 1 1 3 ARG HH11 H 14.289 -1.670 -6.311 1.00 . A A . 2 ARG HH11 1 1
4 869 1 1 3 ARG HH12 H 13.857 -2.423 -7.810 1.00 . A A . 2 ARG HH12 1 1
4 870 1 1 3 ARG HH21 H 11.110 -0.382 -8.352 1.00 . A A . 2 ARG HH21 1 1
4 871 1 1 3 ARG HH22 H 12.060 -1.694 -8.963 1.00 . A A . 2 ARG HH22 1 1
4 872 1 1 3 ARG N N 10.616 0.812 -4.257 1.00 . A A . 2 ARG N 1 1
4 873 1 1 3 ARG NE N 12.429 -0.016 -6.275 1.00 . A A . 2 ARG NE 1 1
4 874 1 1 3 ARG NH1 N 13.682 -1.738 -7.103 1.00 . A A . 2 ARG NH1 1 1
4 875 1 1 3 ARG NH2 N 11.883 -1.008 -8.258 1.00 . A A . 2 ARG NH2 1 1
4 876 1 1 3 ARG O O 11.661 -0.475 -1.064 1.00 . A A . 2 ARG O 1 1
4 877 1 1 4 PHE C C 12.924 1.363 0.154 1.00 . A A . 3 PHE C 1 1
4 878 1 1 4 PHE CA C 13.211 1.916 -1.262 1.00 . A A . 3 PHE CA 1 1
4 879 1 1 4 PHE CB C 12.940 3.417 -1.222 1.00 . A A . 3 PHE CB 1 1
4 880 1 1 4 PHE CD1 C 15.300 4.214 -0.889 1.00 . A A . 3 PHE CD1 1 1
4 881 1 1 4 PHE CD2 C 13.653 4.761 0.794 1.00 . A A . 3 PHE CD2 1 1
4 882 1 1 4 PHE CE1 C 16.273 4.909 -0.164 1.00 . A A . 3 PHE CE1 1 1
4 883 1 1 4 PHE CE2 C 14.624 5.447 1.527 1.00 . A A . 3 PHE CE2 1 1
4 884 1 1 4 PHE CG C 13.986 4.147 -0.412 1.00 . A A . 3 PHE CG 1 1
4 885 1 1 4 PHE CZ C 15.936 5.525 1.046 1.00 . A A . 3 PHE CZ 1 1
4 886 1 1 4 PHE H H 12.228 1.757 -3.127 1.00 . A A . 3 PHE H 1 1
4 887 1 1 4 PHE HA H 14.230 1.736 -1.554 1.00 . A A . 3 PHE HA 1 1
4 888 1 1 4 PHE HB2 H 12.940 3.807 -2.220 1.00 . A A . 3 PHE HB2 1 1
4 889 1 1 4 PHE HB3 H 11.966 3.578 -0.778 1.00 . A A . 3 PHE HB3 1 1
4 890 1 1 4 PHE HD1 H 15.560 3.738 -1.823 1.00 . A A . 3 PHE HD1 1 1
4 891 1 1 4 PHE HD2 H 12.653 4.696 1.163 1.00 . A A . 3 PHE HD2 1 1
4 892 1 1 4 PHE HE1 H 17.287 4.961 -0.533 1.00 . A A . 3 PHE HE1 1 1
4 893 1 1 4 PHE HE2 H 14.359 5.921 2.461 1.00 . A A . 3 PHE HE2 1 1
4 894 1 1 4 PHE HZ H 16.687 6.062 1.606 1.00 . A A . 3 PHE HZ 1 1
4 895 1 1 4 PHE N N 12.314 1.317 -2.263 1.00 . A A . 3 PHE N 1 1
4 896 1 1 4 PHE O O 12.347 2.076 0.986 1.00 . A A . 3 PHE O 1 1
4 897 1 1 5 TYR C C 14.229 -0.779 2.541 1.00 . A A . 4 TYR C 1 1
4 898 1 1 5 TYR CA C 12.968 -0.519 1.729 1.00 . A A . 4 TYR CA 1 1
4 899 1 1 5 TYR CB C 12.180 -1.837 1.521 1.00 . A A . 4 TYR CB 1 1
4 900 1 1 5 TYR CD1 C 14.129 -3.414 1.372 1.00 . A A . 4 TYR CD1 1 1
4 901 1 1 5 TYR CD2 C 12.675 -3.205 -0.540 1.00 . A A . 4 TYR CD2 1 1
4 902 1 1 5 TYR CE1 C 14.925 -4.318 0.683 1.00 . A A . 4 TYR CE1 1 1
4 903 1 1 5 TYR CE2 C 13.466 -4.121 -1.239 1.00 . A A . 4 TYR CE2 1 1
4 904 1 1 5 TYR CG C 13.004 -2.857 0.771 1.00 . A A . 4 TYR CG 1 1
4 905 1 1 5 TYR CZ C 14.596 -4.680 -0.628 1.00 . A A . 4 TYR CZ 1 1
4 906 1 1 5 TYR H H 13.697 -0.450 -0.276 1.00 . A A . 4 TYR H 1 1
4 907 1 1 5 TYR HA H 12.341 0.149 2.296 1.00 . A A . 4 TYR HA 1 1
4 908 1 1 5 TYR HB2 H 11.915 -2.246 2.483 1.00 . A A . 4 TYR HB2 1 1
4 909 1 1 5 TYR HB3 H 11.280 -1.628 0.964 1.00 . A A . 4 TYR HB3 1 1
4 910 1 1 5 TYR HD1 H 14.364 -3.172 2.382 1.00 . A A . 4 TYR HD1 1 1
4 911 1 1 5 TYR HD2 H 11.803 -2.780 -1.006 1.00 . A A . 4 TYR HD2 1 1
4 912 1 1 5 TYR HE1 H 15.802 -4.724 1.165 1.00 . A A . 4 TYR HE1 1 1
4 913 1 1 5 TYR HE2 H 13.205 -4.394 -2.246 1.00 . A A . 4 TYR HE2 1 1
4 914 1 1 5 TYR HH H 15.588 -5.197 -2.176 1.00 . A A . 4 TYR HH 1 1
4 915 1 1 5 TYR N N 13.273 0.091 0.421 1.00 . A A . 4 TYR N 1 1
4 916 1 1 5 TYR O O 15.313 -0.940 1.986 1.00 . A A . 4 TYR O 1 1
4 917 1 1 5 TYR OH O 15.384 -5.578 -1.318 1.00 . A A . 4 TYR OH 1 1
4 918 1 1 6 GLU C C 16.451 -1.457 4.294 1.00 . A A . 5 GLU C 1 1
4 919 1 1 6 GLU CA C 15.095 -1.049 4.863 1.00 . A A . 5 GLU CA 1 1
4 920 1 1 6 GLU CB C 14.619 -2.081 5.895 1.00 . A A . 5 GLU CB 1 1
4 921 1 1 6 GLU CD C 13.759 -4.406 6.239 1.00 . A A . 5 GLU CD 1 1
4 922 1 1 6 GLU CG C 14.226 -3.388 5.203 1.00 . A A . 5 GLU CG 1 1
4 923 1 1 6 GLU H H 13.126 -0.666 4.189 1.00 . A A . 5 GLU H 1 1
4 924 1 1 6 GLU HA H 15.245 -0.129 5.378 1.00 . A A . 5 GLU HA 1 1
4 925 1 1 6 GLU HB2 H 15.416 -2.277 6.597 1.00 . A A . 5 GLU HB2 1 1
4 926 1 1 6 GLU HB3 H 13.765 -1.689 6.427 1.00 . A A . 5 GLU HB3 1 1
4 927 1 1 6 GLU HG2 H 13.423 -3.195 4.508 1.00 . A A . 5 GLU HG2 1 1
4 928 1 1 6 GLU HG3 H 15.073 -3.787 4.670 1.00 . A A . 5 GLU HG3 1 1
4 929 1 1 6 GLU N N 14.035 -0.815 3.863 1.00 . A A . 5 GLU N 1 1
4 930 1 1 6 GLU O O 17.462 -0.924 4.712 1.00 . A A . 5 GLU O 1 1
4 931 1 1 6 GLU OE1 O 14.545 -4.738 7.110 1.00 . A A . 5 GLU OE1 1 1
4 932 1 1 6 GLU OE2 O 12.621 -4.839 6.145 1.00 . A A . 5 GLU OE2 1 1
4 933 1 1 7 LYS C C 17.663 -2.754 1.235 1.00 . A A . 6 LYS C 1 1
4 934 1 1 7 LYS CA C 17.742 -2.843 2.757 1.00 . A A . 6 LYS CA 1 1
4 935 1 1 7 LYS CB C 18.052 -4.282 3.189 1.00 . A A . 6 LYS CB 1 1
4 936 1 1 7 LYS CD C 18.534 -5.785 5.128 1.00 . A A . 6 LYS CD 1 1
4 937 1 1 7 LYS CE C 18.724 -5.848 6.644 1.00 . A A . 6 LYS CE 1 1
4 938 1 1 7 LYS CG C 18.233 -4.344 4.708 1.00 . A A . 6 LYS CG 1 1
4 939 1 1 7 LYS H H 15.644 -2.774 3.086 1.00 . A A . 6 LYS H 1 1
4 940 1 1 7 LYS HA H 18.545 -2.207 3.079 1.00 . A A . 6 LYS HA 1 1
4 941 1 1 7 LYS HB2 H 17.242 -4.931 2.904 1.00 . A A . 6 LYS HB2 1 1
4 942 1 1 7 LYS HB3 H 18.962 -4.612 2.709 1.00 . A A . 6 LYS HB3 1 1
4 943 1 1 7 LYS HD2 H 17.709 -6.421 4.841 1.00 . A A . 6 LYS HD2 1 1
4 944 1 1 7 LYS HD3 H 19.435 -6.121 4.638 1.00 . A A . 6 LYS HD3 1 1
4 945 1 1 7 LYS HE2 H 18.948 -6.865 6.937 1.00 . A A . 6 LYS HE2 1 1
4 946 1 1 7 LYS HE3 H 19.541 -5.204 6.933 1.00 . A A . 6 LYS HE3 1 1
4 947 1 1 7 LYS HG2 H 19.054 -3.706 5.000 1.00 . A A . 6 LYS HG2 1 1
4 948 1 1 7 LYS HG3 H 17.330 -4.011 5.194 1.00 . A A . 6 LYS HG3 1 1
4 949 1 1 7 LYS HZ1 H 17.136 -6.153 7.957 1.00 . A A . 6 LYS HZ1 1 1
4 950 1 1 7 LYS HZ2 H 16.746 -5.198 6.606 1.00 . A A . 6 LYS HZ2 1 1
4 951 1 1 7 LYS HZ3 H 17.666 -4.544 7.875 1.00 . A A . 6 LYS HZ3 1 1
4 952 1 1 7 LYS N N 16.479 -2.388 3.367 1.00 . A A . 6 LYS N 1 1
4 953 1 1 7 LYS NZ N 17.474 -5.402 7.322 1.00 . A A . 6 LYS NZ 1 1
4 954 1 1 7 LYS O O 16.625 -2.408 0.678 1.00 . A A . 6 LYS O 1 1
4 955 1 1 8 . CAA C 20.891 -4.124 -1.190 1.00 . A A . 7 4G6 CAA 1 1
4 956 1 1 8 . CAB C 20.000 -2.703 -3.017 1.00 . A A . 7 4G6 CAB 1 1
4 957 1 1 8 . CAE C 18.713 -2.958 -0.910 1.00 . A A . 7 4G6 CAE 1 1
4 958 1 1 8 . CAF C 20.121 -2.838 -1.497 1.00 . A A . 7 4G6 CAF 1 1
4 959 1 1 8 . HAA H 20.566 -4.521 -0.228 1.00 . A A . 7 4G6 HAA 1 1
4 960 1 1 8 . HAB H 21.959 -3.907 -1.151 1.00 . A A . 7 4G6 HAB 1 1
4 961 1 1 8 . HAC H 20.699 -4.860 -1.969 1.00 . A A . 7 4G6 HAC 1 1
4 962 1 1 8 . HAD H 19.490 -3.576 -3.422 1.00 . A A . 7 4G6 HAD 1 1
4 963 1 1 8 . HAE H 20.995 -2.626 -3.455 1.00 . A A . 7 4G6 HAE 1 1
4 964 1 1 8 . HAF H 19.431 -1.804 -3.254 1.00 . A A . 7 4G6 HAF 1 1
4 965 1 1 8 . HAG H 18.135 -2.083 -1.208 1.00 . A A . 7 4G6 HAG 1 1
4 966 1 1 8 . HAH H 18.234 -3.853 -1.305 1.00 . A A . 7 4G6 HAH 1 1
4 967 1 1 8 . HAI H 19.585 -3.298 1.034 1.00 . A A . 7 4G6 HAI 1 1
4 968 1 1 8 . HAL H 20.737 -0.797 -1.455 1.00 . A A . 7 4G6 HAL 1 1
4 969 1 1 8 . NAC N 18.744 -3.038 0.558 1.00 . A A . 7 4G6 NAC 1 1
4 970 1 1 8 . NAD N 20.805 -1.657 -0.950 1.00 . A A . 7 4G6 NAD 1 1
4 971 1 1 9 DPR C C 21.501 -1.684 0.170 1.00 . A A . 8 DPR C 1 1
4 972 1 1 9 DPR CA C 22.172 -0.382 0.641 1.00 . A A . 8 DPR CA 1 1
4 973 1 1 9 DPR CB C 22.159 0.704 -0.435 1.00 . A A . 8 DPR CB 1 1
4 974 1 1 9 DPR CD C 21.522 1.748 1.662 1.00 . A A . 8 DPR CD 1 1
4 975 1 1 9 DPR CG C 22.265 1.983 0.334 1.00 . A A . 8 DPR CG 1 1
4 976 1 1 9 DPR HA H 23.190 -0.578 0.937 1.00 . A A . 8 DPR HA 1 1
4 977 1 1 9 DPR HB2 H 23.003 0.584 -1.103 1.00 . A A . 8 DPR HB2 1 1
4 978 1 1 9 DPR HB3 H 21.234 0.686 -0.985 1.00 . A A . 8 DPR HB3 1 1
4 979 1 1 9 DPR HD2 H 22.089 2.156 2.490 1.00 . A A . 8 DPR HD2 1 1
4 980 1 1 9 DPR HD3 H 20.532 2.179 1.631 1.00 . A A . 8 DPR HD3 1 1
4 981 1 1 9 DPR HG2 H 23.308 2.215 0.522 1.00 . A A . 8 DPR HG2 1 1
4 982 1 1 9 DPR HG3 H 21.797 2.790 -0.210 1.00 . A A . 8 DPR HG3 1 1
4 983 1 1 9 DPR N N 21.434 0.276 1.762 1.00 . A A . 8 DPR N 1 1
4 984 1 1 9 DPR O O 21.632 -2.709 0.840 1.00 . A A . 8 DPR O 1 1
4 985 1 1 10 VAL C C 20.807 -0.408 2.694 1.00 . A A . 9 VAL C 1 1
4 986 1 1 10 VAL CA C 20.065 0.352 3.796 1.00 . A A . 9 VAL CA 1 1
4 987 1 1 10 VAL CB C 20.107 -0.510 5.071 1.00 . A A . 9 VAL CB 1 1
4 988 1 1 10 VAL CG1 C 21.561 -0.728 5.483 1.00 . A A . 9 VAL CG1 1 1
4 989 1 1 10 VAL CG2 C 19.325 0.162 6.220 1.00 . A A . 9 VAL CG2 1 1
4 990 1 1 10 VAL H H 18.195 -0.153 2.946 1.00 . A A . 9 VAL H 1 1
4 991 1 1 10 VAL HA H 20.553 1.294 3.992 1.00 . A A . 9 VAL HA 1 1
4 992 1 1 10 VAL HB H 19.677 -1.472 4.862 1.00 . A A . 9 VAL HB 1 1
4 993 1 1 10 VAL HG11 H 22.022 -1.422 4.794 1.00 . A A . 9 VAL HG11 1 1
4 994 1 1 10 VAL HG12 H 21.593 -1.136 6.482 1.00 . A A . 9 VAL HG12 1 1
4 995 1 1 10 VAL HG13 H 22.088 0.212 5.457 1.00 . A A . 9 VAL HG13 1 1
4 996 1 1 10 VAL HG21 H 18.909 -0.604 6.862 1.00 . A A . 9 VAL HG21 1 1
4 997 1 1 10 VAL HG22 H 18.524 0.760 5.823 1.00 . A A . 9 VAL HG22 1 1
4 998 1 1 10 VAL HG23 H 19.985 0.793 6.797 1.00 . A A . 9 VAL HG23 1 1
4 999 1 1 10 VAL N N 18.683 0.583 3.372 1.00 . A A . 9 VAL N 1 1
4 1000 1 1 10 VAL O O 20.794 -1.637 2.689 1.00 . A A . 9 VAL O 1 1
4 1001 1 1 11 GLN C C 18.058 1.754 3.528 1.00 . A A . 10 GLN C 1 1
4 1002 1 1 11 GLN CA C 16.621 1.794 3.008 1.00 . A A . 10 GLN CA 1 1
4 1003 1 1 11 GLN CB C 16.633 2.225 1.543 1.00 . A A . 10 GLN CB 1 1
4 1004 1 1 11 GLN CD C 17.461 1.671 -0.761 1.00 . A A . 10 GLN CD 1 1
4 1005 1 1 11 GLN CG C 17.461 1.240 0.703 1.00 . A A . 10 GLN CG 1 1
4 1006 1 1 11 GLN H H 16.202 3.376 4.364 1.00 . A A . 10 GLN H 1 1
4 1007 1 1 11 GLN HA H 16.213 0.810 3.073 1.00 . A A . 10 GLN HA 1 1
4 1008 1 1 11 GLN HB2 H 15.622 2.262 1.168 1.00 . A A . 10 GLN HB2 1 1
4 1009 1 1 11 GLN HB3 H 17.079 3.200 1.481 1.00 . A A . 10 GLN HB3 1 1
4 1010 1 1 11 GLN HE21 H 16.640 -0.016 -1.412 1.00 . A A . 10 GLN HE21 1 1
4 1011 1 1 11 GLN HE22 H 16.988 1.133 -2.612 1.00 . A A . 10 GLN HE22 1 1
4 1012 1 1 11 GLN HG2 H 18.478 1.220 1.061 1.00 . A A . 10 GLN HG2 1 1
4 1013 1 1 11 GLN HG3 H 17.034 0.252 0.783 1.00 . A A . 10 GLN HG3 1 1
4 1014 1 1 11 GLN N N 15.782 2.698 3.794 1.00 . A A . 10 GLN N 1 1
4 1015 1 1 11 GLN NE2 N 16.991 0.863 -1.670 1.00 . A A . 10 GLN NE2 1 1
4 1016 1 1 11 GLN O O 18.582 2.743 4.043 1.00 . A A . 10 GLN O 1 1
4 1017 1 1 11 GLN OE1 O 17.905 2.771 -1.085 1.00 . A A . 10 GLN OE1 1 1
4 1018 1 1 12 LYS C C 14.444 2.600 3.753 1.00 . A A . 11 LYS C 1 1
4 1019 1 1 12 LYS CA C 13.668 3.587 4.629 1.00 . A A . 11 LYS CA 1 1
4 1020 1 1 12 LYS CB C 13.188 2.859 5.899 1.00 . A A . 11 LYS CB 1 1
4 1021 1 1 12 LYS CD C 11.670 1.086 6.799 1.00 . A A . 11 LYS CD 1 1
4 1022 1 1 12 LYS CE C 10.622 0.035 6.429 1.00 . A A . 11 LYS CE 1 1
4 1023 1 1 12 LYS CG C 12.158 1.788 5.530 1.00 . A A . 11 LYS CG 1 1
4 1024 1 1 12 LYS H H 12.361 3.989 2.976 1.00 . A A . 11 LYS H 1 1
4 1025 1 1 12 LYS HA H 14.343 4.375 4.929 1.00 . A A . 11 LYS HA 1 1
4 1026 1 1 12 LYS HB2 H 14.035 2.382 6.371 1.00 . A A . 11 LYS HB2 1 1
4 1027 1 1 12 LYS HB3 H 12.750 3.556 6.589 1.00 . A A . 11 LYS HB3 1 1
4 1028 1 1 12 LYS HD2 H 12.505 0.607 7.289 1.00 . A A . 11 LYS HD2 1 1
4 1029 1 1 12 LYS HD3 H 11.229 1.812 7.466 1.00 . A A . 11 LYS HD3 1 1
4 1030 1 1 12 LYS HE2 H 10.270 -0.453 7.324 1.00 . A A . 11 LYS HE2 1 1
4 1031 1 1 12 LYS HE3 H 9.791 0.514 5.931 1.00 . A A . 11 LYS HE3 1 1
4 1032 1 1 12 LYS HG2 H 11.320 2.251 5.030 1.00 . A A . 11 LYS HG2 1 1
4 1033 1 1 12 LYS HG3 H 12.609 1.060 4.876 1.00 . A A . 11 LYS HG3 1 1
4 1034 1 1 12 LYS HZ1 H 10.789 -1.900 5.682 1.00 . A A . 11 LYS HZ1 1 1
4 1035 1 1 12 LYS HZ2 H 12.251 -1.038 5.707 1.00 . A A . 11 LYS HZ2 1 1
4 1036 1 1 12 LYS HZ3 H 11.077 -0.689 4.530 1.00 . A A . 11 LYS HZ3 1 1
4 1037 1 1 12 LYS N N 12.524 4.203 3.918 1.00 . A A . 11 LYS N 1 1
4 1038 1 1 12 LYS NZ N 11.231 -0.974 5.519 1.00 . A A . 11 LYS NZ 1 1
4 1039 1 1 12 LYS O O 13.857 1.759 3.071 1.00 . A A . 11 LYS O 1 1
4 1040 1 1 13 PHE C C 11.709 5.057 4.542 1.00 . A A . 12 PHE C 1 1
4 1041 1 1 13 PHE CA C 10.537 5.669 3.757 1.00 . A A . 12 PHE CA 1 1
4 1042 1 1 13 PHE CB C 9.196 5.079 4.246 1.00 . A A . 12 PHE CB 1 1
4 1043 1 1 13 PHE CD1 C 9.837 3.029 2.820 1.00 . A A . 12 PHE CD1 1 1
4 1044 1 1 13 PHE CD2 C 7.746 3.042 4.048 1.00 . A A . 12 PHE CD2 1 1
4 1045 1 1 13 PHE CE1 C 9.533 1.774 2.317 1.00 . A A . 12 PHE CE1 1 1
4 1046 1 1 13 PHE CE2 C 7.442 1.781 3.532 1.00 . A A . 12 PHE CE2 1 1
4 1047 1 1 13 PHE CG C 8.940 3.680 3.697 1.00 . A A . 12 PHE CG 1 1
4 1048 1 1 13 PHE CZ C 8.333 1.146 2.664 1.00 . A A . 12 PHE CZ 1 1
4 1049 1 1 13 PHE H H 11.424 5.137 1.922 1.00 . A A . 12 PHE H 1 1
4 1050 1 1 13 PHE HA H 10.534 6.703 3.983 1.00 . A A . 12 PHE HA 1 1
4 1051 1 1 13 PHE HB2 H 9.216 5.018 5.326 1.00 . A A . 12 PHE HB2 1 1
4 1052 1 1 13 PHE HB3 H 8.381 5.725 3.957 1.00 . A A . 12 PHE HB3 1 1
4 1053 1 1 13 PHE HD1 H 10.766 3.471 2.544 1.00 . A A . 12 PHE HD1 1 1
4 1054 1 1 13 PHE HD2 H 7.052 3.530 4.718 1.00 . A A . 12 PHE HD2 1 1
4 1055 1 1 13 PHE HE1 H 10.225 1.298 1.644 1.00 . A A . 12 PHE HE1 1 1
4 1056 1 1 13 PHE HE2 H 6.522 1.297 3.807 1.00 . A A . 12 PHE HE2 1 1
4 1057 1 1 13 PHE HZ H 8.093 0.174 2.262 1.00 . A A . 12 PHE HZ 1 1
4 1058 1 1 13 PHE N N 10.647 5.569 2.303 1.00 . A A . 12 PHE N 1 1
4 1059 1 1 13 PHE O O 11.869 5.382 5.715 1.00 . A A . 12 PHE O 1 1
4 1060 1 1 14 ILE C C 9.694 6.030 1.487 1.00 . A A . 13 ILE C 1 1
4 1061 1 1 14 ILE CA C 9.931 5.832 -0.015 1.00 . A A . 13 ILE CA 1 1
4 1062 1 1 14 ILE CB C 9.710 7.152 -0.795 1.00 . A A . 13 ILE CB 1 1
4 1063 1 1 14 ILE CD1 C 10.625 8.675 1.092 1.00 . A A . 13 ILE CD1 1 1
4 1064 1 1 14 ILE CG1 C 10.722 8.263 -0.386 1.00 . A A . 13 ILE CG1 1 1
4 1065 1 1 14 ILE CG2 C 8.270 7.658 -0.579 1.00 . A A . 13 ILE CG2 1 1
4 1066 1 1 14 ILE H H 9.152 4.507 -1.508 1.00 . A A . 13 ILE H 1 1
4 1067 1 1 14 ILE HA H 10.947 5.519 -0.164 1.00 . A A . 13 ILE HA 1 1
4 1068 1 1 14 ILE HB H 9.839 6.939 -1.850 1.00 . A A . 13 ILE HB 1 1
4 1069 1 1 14 ILE HD11 H 10.972 9.693 1.195 1.00 . A A . 13 ILE HD11 1 1
4 1070 1 1 14 ILE HD12 H 11.249 8.030 1.693 1.00 . A A . 13 ILE HD12 1 1
4 1071 1 1 14 ILE HD13 H 9.603 8.616 1.425 1.00 . A A . 13 ILE HD13 1 1
4 1072 1 1 14 ILE HG12 H 11.722 7.905 -0.575 1.00 . A A . 13 ILE HG12 1 1
4 1073 1 1 14 ILE HG13 H 10.546 9.133 -1.003 1.00 . A A . 13 ILE HG13 1 1
4 1074 1 1 14 ILE HG21 H 7.977 8.274 -1.418 1.00 . A A . 13 ILE HG21 1 1
4 1075 1 1 14 ILE HG22 H 8.216 8.242 0.325 1.00 . A A . 13 ILE HG22 1 1
4 1076 1 1 14 ILE HG23 H 7.596 6.817 -0.502 1.00 . A A . 13 ILE HG23 1 1
4 1077 1 1 14 ILE N N 9.021 4.797 -0.575 1.00 . A A . 13 ILE N 1 1
4 1078 1 1 14 ILE O O 8.665 6.569 1.890 1.00 . A A . 13 ILE O 1 1
4 1079 1 1 15 ARG C C 8.012 4.240 0.105 1.00 . A A . 14 ARG C 1 1
4 1080 1 1 15 ARG CA C 7.186 3.226 -0.677 1.00 . A A . 14 ARG CA 1 1
4 1081 1 1 15 ARG CB C 5.710 3.366 -0.300 1.00 . A A . 14 ARG CB 1 1
4 1082 1 1 15 ARG CD C 5.308 5.371 -1.859 1.00 . A A . 14 ARG CD 1 1
4 1083 1 1 15 ARG CG C 5.203 4.821 -0.427 1.00 . A A . 14 ARG CG 1 1
4 1084 1 1 15 ARG CZ C 6.996 5.962 -3.500 1.00 . A A . 14 ARG CZ 1 1
4 1085 1 1 15 ARG H H 7.859 1.598 0.502 1.00 . A A . 14 ARG H 1 1
4 1086 1 1 15 ARG HA H 7.296 3.418 -1.728 1.00 . A A . 14 ARG HA 1 1
4 1087 1 1 15 ARG HB2 H 5.123 2.732 -0.948 1.00 . A A . 14 ARG HB2 1 1
4 1088 1 1 15 ARG HB3 H 5.582 3.034 0.722 1.00 . A A . 14 ARG HB3 1 1
4 1089 1 1 15 ARG HD2 H 4.787 4.707 -2.530 1.00 . A A . 14 ARG HD2 1 1
4 1090 1 1 15 ARG HD3 H 4.840 6.345 -1.896 1.00 . A A . 14 ARG HD3 1 1
4 1091 1 1 15 ARG HE H 7.417 5.213 -1.690 1.00 . A A . 14 ARG HE 1 1
4 1092 1 1 15 ARG HG2 H 4.171 4.859 -0.118 1.00 . A A . 14 ARG HG2 1 1
4 1093 1 1 15 ARG HG3 H 5.784 5.453 0.230 1.00 . A A . 14 ARG HG3 1 1
4 1094 1 1 15 ARG HH11 H 5.089 6.281 -4.017 1.00 . A A . 14 ARG HH11 1 1
4 1095 1 1 15 ARG HH12 H 6.270 6.703 -5.212 1.00 . A A . 14 ARG HH12 1 1
4 1096 1 1 15 ARG HH21 H 8.973 5.768 -3.256 1.00 . A A . 14 ARG HH21 1 1
4 1097 1 1 15 ARG HH22 H 8.466 6.414 -4.782 1.00 . A A . 14 ARG HH22 1 1
4 1098 1 1 15 ARG N N 7.613 1.854 -0.411 1.00 . A A . 14 ARG N 1 1
4 1099 1 1 15 ARG NE N 6.695 5.488 -2.295 1.00 . A A . 14 ARG NE 1 1
4 1100 1 1 15 ARG NH1 N 6.044 6.344 -4.307 1.00 . A A . 14 ARG NH1 1 1
4 1101 1 1 15 ARG NH2 N 8.243 6.054 -3.875 1.00 . A A . 14 ARG NH2 1 1
4 1102 1 1 15 ARG O O 7.718 4.516 1.266 1.00 . A A . 14 ARG O 1 1
4 1103 1 1 16 ACE C C 7.661 0.943 -1.380 1.00 . A A . 15 ACE C 1 1
4 1104 1 1 16 ACE CH3 C 8.108 -0.453 -0.963 1.00 . A A . 15 ACE CH3 1 1
4 1105 1 1 16 ACE H1 H 9.159 -0.439 -0.715 1.00 . A A . 15 ACE H1 1 1
4 1106 1 1 16 ACE H2 H 7.934 -1.145 -1.773 1.00 . A A . 15 ACE H2 1 1
4 1107 1 1 16 ACE H3 H 7.541 -0.766 -0.098 1.00 . A A . 15 ACE H3 1 1
4 1108 1 1 16 ACE O O 7.358 1.195 -2.552 1.00 . A A . 15 ACE O 1 1
5 1109 1 1 1 ACE C C 6.160 0.599 -5.189 1.00 . A A . 0 ACE C 1 1
5 1110 1 1 1 ACE CH3 C 4.794 1.273 -5.229 1.00 . A A . 0 ACE CH3 1 1
5 1111 1 1 1 ACE H1 H 4.480 1.513 -4.224 1.00 . A A . 0 ACE H1 1 1
5 1112 1 1 1 ACE H2 H 4.076 0.602 -5.678 1.00 . A A . 0 ACE H2 1 1
5 1113 1 1 1 ACE H3 H 4.856 2.176 -5.815 1.00 . A A . 0 ACE H3 1 1
5 1114 1 1 1 ACE O O 6.333 -0.500 -5.719 1.00 . A A . 0 ACE O 1 1
5 1115 1 1 2 GLU C C 8.994 0.731 -3.016 1.00 . A A . 1 GLU C 1 1
5 1116 1 1 2 GLU CA C 8.493 0.706 -4.456 1.00 . A A . 1 GLU CA 1 1
5 1117 1 1 2 GLU CB C 9.462 1.502 -5.331 1.00 . A A . 1 GLU CB 1 1
5 1118 1 1 2 GLU CD C 9.982 2.227 -7.663 1.00 . A A . 1 GLU CD 1 1
5 1119 1 1 2 GLU CG C 9.010 1.443 -6.789 1.00 . A A . 1 GLU CG 1 1
5 1120 1 1 2 GLU H H 6.938 2.135 -4.155 1.00 . A A . 1 GLU H 1 1
5 1121 1 1 2 GLU HA H 8.488 -0.321 -4.798 1.00 . A A . 1 GLU HA 1 1
5 1122 1 1 2 GLU HB2 H 9.482 2.526 -5.002 1.00 . A A . 1 GLU HB2 1 1
5 1123 1 1 2 GLU HB3 H 10.450 1.077 -5.248 1.00 . A A . 1 GLU HB3 1 1
5 1124 1 1 2 GLU HG2 H 8.981 0.414 -7.114 1.00 . A A . 1 GLU HG2 1 1
5 1125 1 1 2 GLU HG3 H 8.024 1.875 -6.876 1.00 . A A . 1 GLU HG3 1 1
5 1126 1 1 2 GLU N N 7.134 1.260 -4.558 1.00 . A A . 1 GLU N 1 1
5 1127 1 1 2 GLU O O 8.743 1.677 -2.266 1.00 . A A . 1 GLU O 1 1
5 1128 1 1 2 GLU OE1 O 11.150 1.872 -7.680 1.00 . A A . 1 GLU OE1 1 1
5 1129 1 1 2 GLU OE2 O 9.546 3.170 -8.301 1.00 . A A . 1 GLU OE2 1 1
5 1130 1 1 3 ARG C C 11.388 0.568 -1.121 1.00 . A A . 2 ARG C 1 1
5 1131 1 1 3 ARG CA C 10.270 -0.436 -1.304 1.00 . A A . 2 ARG CA 1 1
5 1132 1 1 3 ARG CB C 10.880 -1.826 -1.131 1.00 . A A . 2 ARG CB 1 1
5 1133 1 1 3 ARG CD C 10.502 -4.263 -1.256 1.00 . A A . 2 ARG CD 1 1
5 1134 1 1 3 ARG CG C 9.820 -2.902 -1.331 1.00 . A A . 2 ARG CG 1 1
5 1135 1 1 3 ARG CZ C 12.254 -5.449 -2.450 1.00 . A A . 2 ARG CZ 1 1
5 1136 1 1 3 ARG H H 9.879 -1.038 -3.293 1.00 . A A . 2 ARG H 1 1
5 1137 1 1 3 ARG HA H 9.512 -0.277 -0.573 1.00 . A A . 2 ARG HA 1 1
5 1138 1 1 3 ARG HB2 H 11.670 -1.963 -1.856 1.00 . A A . 2 ARG HB2 1 1
5 1139 1 1 3 ARG HB3 H 11.293 -1.914 -0.136 1.00 . A A . 2 ARG HB3 1 1
5 1140 1 1 3 ARG HD2 H 10.969 -4.380 -0.290 1.00 . A A . 2 ARG HD2 1 1
5 1141 1 1 3 ARG HD3 H 9.769 -5.042 -1.398 1.00 . A A . 2 ARG HD3 1 1
5 1142 1 1 3 ARG HE H 11.680 -3.577 -2.888 1.00 . A A . 2 ARG HE 1 1
5 1143 1 1 3 ARG HG2 H 9.071 -2.824 -0.554 1.00 . A A . 2 ARG HG2 1 1
5 1144 1 1 3 ARG HG3 H 9.356 -2.783 -2.298 1.00 . A A . 2 ARG HG3 1 1
5 1145 1 1 3 ARG HH11 H 11.319 -6.454 -0.992 1.00 . A A . 2 ARG HH11 1 1
5 1146 1 1 3 ARG HH12 H 12.589 -7.312 -1.799 1.00 . A A . 2 ARG HH12 1 1
5 1147 1 1 3 ARG HH21 H 13.348 -4.700 -3.950 1.00 . A A . 2 ARG HH21 1 1
5 1148 1 1 3 ARG HH22 H 13.739 -6.319 -3.475 1.00 . A A . 2 ARG HH22 1 1
5 1149 1 1 3 ARG N N 9.712 -0.322 -2.645 1.00 . A A . 2 ARG N 1 1
5 1150 1 1 3 ARG NE N 11.519 -4.353 -2.301 1.00 . A A . 2 ARG NE 1 1
5 1151 1 1 3 ARG NH1 N 12.038 -6.486 -1.688 1.00 . A A . 2 ARG NH1 1 1
5 1152 1 1 3 ARG NH2 N 13.186 -5.492 -3.363 1.00 . A A . 2 ARG NH2 1 1
5 1153 1 1 3 ARG O O 11.578 1.147 -0.051 1.00 . A A . 2 ARG O 1 1
5 1154 1 1 4 PHE C C 14.017 1.602 -0.860 1.00 . A A . 3 PHE C 1 1
5 1155 1 1 4 PHE CA C 13.337 1.552 -2.229 1.00 . A A . 3 PHE CA 1 1
5 1156 1 1 4 PHE CB C 13.036 3.008 -2.641 1.00 . A A . 3 PHE CB 1 1
5 1157 1 1 4 PHE CD1 C 15.310 3.400 -3.666 1.00 . A A . 3 PHE CD1 1 1
5 1158 1 1 4 PHE CD2 C 14.669 4.698 -1.727 1.00 . A A . 3 PHE CD2 1 1
5 1159 1 1 4 PHE CE1 C 16.557 4.034 -3.678 1.00 . A A . 3 PHE CE1 1 1
5 1160 1 1 4 PHE CE2 C 15.916 5.337 -1.739 1.00 . A A . 3 PHE CE2 1 1
5 1161 1 1 4 PHE CG C 14.361 3.738 -2.693 1.00 . A A . 3 PHE CG 1 1
5 1162 1 1 4 PHE CZ C 16.860 5.006 -2.717 1.00 . A A . 3 PHE CZ 1 1
5 1163 1 1 4 PHE H H 11.936 0.153 -2.969 1.00 . A A . 3 PHE H 1 1
5 1164 1 1 4 PHE HA H 14.029 1.124 -2.940 1.00 . A A . 3 PHE HA 1 1
5 1165 1 1 4 PHE HB2 H 12.568 3.035 -3.615 1.00 . A A . 3 PHE HB2 1 1
5 1166 1 1 4 PHE HB3 H 12.390 3.487 -1.916 1.00 . A A . 3 PHE HB3 1 1
5 1167 1 1 4 PHE HD1 H 15.073 2.659 -4.416 1.00 . A A . 3 PHE HD1 1 1
5 1168 1 1 4 PHE HD2 H 13.943 4.937 -0.968 1.00 . A A . 3 PHE HD2 1 1
5 1169 1 1 4 PHE HE1 H 17.288 3.773 -4.429 1.00 . A A . 3 PHE HE1 1 1
5 1170 1 1 4 PHE HE2 H 16.151 6.082 -0.993 1.00 . A A . 3 PHE HE2 1 1
5 1171 1 1 4 PHE HZ H 17.823 5.493 -2.725 1.00 . A A . 3 PHE HZ 1 1
5 1172 1 1 4 PHE N N 12.154 0.696 -2.188 1.00 . A A . 3 PHE N 1 1
5 1173 1 1 4 PHE O O 14.081 2.669 -0.250 1.00 . A A . 3 PHE O 1 1
5 1174 1 1 5 TYR C C 16.723 0.281 0.741 1.00 . A A . 4 TYR C 1 1
5 1175 1 1 5 TYR CA C 15.217 0.472 0.930 1.00 . A A . 4 TYR CA 1 1
5 1176 1 1 5 TYR CB C 14.683 -0.630 1.867 1.00 . A A . 4 TYR CB 1 1
5 1177 1 1 5 TYR CD1 C 15.415 -2.350 0.080 1.00 . A A . 4 TYR CD1 1 1
5 1178 1 1 5 TYR CD2 C 14.549 -3.093 2.215 1.00 . A A . 4 TYR CD2 1 1
5 1179 1 1 5 TYR CE1 C 15.603 -3.680 -0.297 1.00 . A A . 4 TYR CE1 1 1
5 1180 1 1 5 TYR CE2 C 14.742 -4.417 1.832 1.00 . A A . 4 TYR CE2 1 1
5 1181 1 1 5 TYR CG C 14.889 -2.050 1.354 1.00 . A A . 4 TYR CG 1 1
5 1182 1 1 5 TYR CZ C 15.274 -4.715 0.578 1.00 . A A . 4 TYR CZ 1 1
5 1183 1 1 5 TYR H H 14.468 -0.356 -0.892 1.00 . A A . 4 TYR H 1 1
5 1184 1 1 5 TYR HA H 15.062 1.422 1.413 1.00 . A A . 4 TYR HA 1 1
5 1185 1 1 5 TYR HB2 H 15.182 -0.546 2.819 1.00 . A A . 4 TYR HB2 1 1
5 1186 1 1 5 TYR HB3 H 13.626 -0.471 2.021 1.00 . A A . 4 TYR HB3 1 1
5 1187 1 1 5 TYR HD1 H 15.662 -1.572 -0.615 1.00 . A A . 4 TYR HD1 1 1
5 1188 1 1 5 TYR HD2 H 14.145 -2.871 3.190 1.00 . A A . 4 TYR HD2 1 1
5 1189 1 1 5 TYR HE1 H 16.030 -3.904 -1.256 1.00 . A A . 4 TYR HE1 1 1
5 1190 1 1 5 TYR HE2 H 14.485 -5.206 2.509 1.00 . A A . 4 TYR HE2 1 1
5 1191 1 1 5 TYR HH H 16.120 -6.048 -0.495 1.00 . A A . 4 TYR HH 1 1
5 1192 1 1 5 TYR N N 14.533 0.471 -0.373 1.00 . A A . 4 TYR N 1 1
5 1193 1 1 5 TYR O O 17.218 -0.837 0.818 1.00 . A A . 4 TYR O 1 1
5 1194 1 1 5 TYR OH O 15.461 -6.030 0.203 1.00 . A A . 4 TYR OH 1 1
5 1195 1 1 6 GLU C C 19.474 0.048 0.961 1.00 . A A . 5 GLU C 1 1
5 1196 1 1 6 GLU CA C 18.920 1.329 0.308 1.00 . A A . 5 GLU CA 1 1
5 1197 1 1 6 GLU CB C 19.537 2.624 0.876 1.00 . A A . 5 GLU CB 1 1
5 1198 1 1 6 GLU CD C 21.775 1.600 1.320 1.00 . A A . 5 GLU CD 1 1
5 1199 1 1 6 GLU CG C 21.041 2.707 0.601 1.00 . A A . 5 GLU CG 1 1
5 1200 1 1 6 GLU H H 17.004 2.257 0.491 1.00 . A A . 5 GLU H 1 1
5 1201 1 1 6 GLU HA H 19.116 1.284 -0.754 1.00 . A A . 5 GLU HA 1 1
5 1202 1 1 6 GLU HB2 H 19.050 3.473 0.419 1.00 . A A . 5 GLU HB2 1 1
5 1203 1 1 6 GLU HB3 H 19.368 2.654 1.942 1.00 . A A . 5 GLU HB3 1 1
5 1204 1 1 6 GLU HG2 H 21.214 2.616 -0.462 1.00 . A A . 5 GLU HG2 1 1
5 1205 1 1 6 GLU HG3 H 21.414 3.663 0.941 1.00 . A A . 5 GLU HG3 1 1
5 1206 1 1 6 GLU N N 17.455 1.386 0.518 1.00 . A A . 5 GLU N 1 1
5 1207 1 1 6 GLU O O 19.143 -0.255 2.108 1.00 . A A . 5 GLU O 1 1
5 1208 1 1 6 GLU OE1 O 21.669 1.553 2.534 1.00 . A A . 5 GLU OE1 1 1
5 1209 1 1 6 GLU OE2 O 22.423 0.816 0.649 1.00 . A A . 5 GLU OE2 1 1
5 1210 1 1 7 LYS C C 22.148 -2.046 1.060 1.00 . A A . 6 LYS C 1 1
5 1211 1 1 7 LYS CA C 20.680 -2.069 0.688 1.00 . A A . 6 LYS CA 1 1
5 1212 1 1 7 LYS CB C 20.506 -3.184 -0.364 1.00 . A A . 6 LYS CB 1 1
5 1213 1 1 7 LYS CD C 18.509 -2.100 -1.683 1.00 . A A . 6 LYS CD 1 1
5 1214 1 1 7 LYS CE C 19.336 -1.784 -2.947 1.00 . A A . 6 LYS CE 1 1
5 1215 1 1 7 LYS CG C 19.053 -3.324 -0.883 1.00 . A A . 6 LYS CG 1 1
5 1216 1 1 7 LYS H H 20.386 -0.518 -0.745 1.00 . A A . 6 LYS H 1 1
5 1217 1 1 7 LYS HA H 20.106 -2.337 1.565 1.00 . A A . 6 LYS HA 1 1
5 1218 1 1 7 LYS HB2 H 21.173 -3.020 -1.182 1.00 . A A . 6 LYS HB2 1 1
5 1219 1 1 7 LYS HB3 H 20.784 -4.119 0.103 1.00 . A A . 6 LYS HB3 1 1
5 1220 1 1 7 LYS HD2 H 17.503 -2.321 -1.997 1.00 . A A . 6 LYS HD2 1 1
5 1221 1 1 7 LYS HD3 H 18.477 -1.237 -1.059 1.00 . A A . 6 LYS HD3 1 1
5 1222 1 1 7 LYS HE2 H 19.395 -2.669 -3.559 1.00 . A A . 6 LYS HE2 1 1
5 1223 1 1 7 LYS HE3 H 18.839 -1.003 -3.505 1.00 . A A . 6 LYS HE3 1 1
5 1224 1 1 7 LYS HG2 H 19.003 -4.191 -1.523 1.00 . A A . 6 LYS HG2 1 1
5 1225 1 1 7 LYS HG3 H 18.406 -3.492 -0.030 1.00 . A A . 6 LYS HG3 1 1
5 1226 1 1 7 LYS HZ1 H 20.916 -0.438 -3.079 1.00 . A A . 6 LYS HZ1 1 1
5 1227 1 1 7 LYS HZ2 H 21.400 -2.058 -2.922 1.00 . A A . 6 LYS HZ2 1 1
5 1228 1 1 7 LYS HZ3 H 20.797 -1.209 -1.579 1.00 . A A . 6 LYS HZ3 1 1
5 1229 1 1 7 LYS N N 20.222 -0.763 0.188 1.00 . A A . 6 LYS N 1 1
5 1230 1 1 7 LYS NZ N 20.716 -1.340 -2.604 1.00 . A A . 6 LYS NZ 1 1
5 1231 1 1 7 LYS O O 22.980 -1.459 0.368 1.00 . A A . 6 LYS O 1 1
5 1232 1 1 8 . CAA C 25.654 -1.284 3.626 1.00 . A A . 7 4G6 CAA 1 1
5 1233 1 1 8 . CAB C 23.577 -0.237 2.742 1.00 . A A . 7 4G6 CAB 1 1
5 1234 1 1 8 . CAE C 23.861 -2.688 2.634 1.00 . A A . 7 4G6 CAE 1 1
5 1235 1 1 8 . CAF C 24.139 -1.449 3.487 1.00 . A A . 7 4G6 CAF 1 1
5 1236 1 1 8 . HAA H 26.080 -2.197 4.043 1.00 . A A . 7 4G6 HAA 1 1
5 1237 1 1 8 . HAB H 25.869 -0.446 4.290 1.00 . A A . 7 4G6 HAB 1 1
5 1238 1 1 8 . HAC H 26.091 -1.094 2.646 1.00 . A A . 7 4G6 HAC 1 1
5 1239 1 1 8 . HAD H 23.808 0.676 3.292 1.00 . A A . 7 4G6 HAD 1 1
5 1240 1 1 8 . HAE H 22.496 -0.347 2.651 1.00 . A A . 7 4G6 HAE 1 1
5 1241 1 1 8 . HAF H 24.016 -0.189 1.745 1.00 . A A . 7 4G6 HAF 1 1
5 1242 1 1 8 . HAG H 24.535 -2.686 1.778 1.00 . A A . 7 4G6 HAG 1 1
5 1243 1 1 8 . HAH H 24.030 -3.587 3.227 1.00 . A A . 7 4G6 HAH 1 1
5 1244 1 1 8 . HAI H 21.756 -3.117 2.708 1.00 . A A . 7 4G6 HAI 1 1
5 1245 1 1 8 . HAL H 23.760 -0.829 5.486 1.00 . A A . 7 4G6 HAL 1 1
5 1246 1 1 8 . NAC N 22.468 -2.668 2.166 1.00 . A A . 7 4G6 NAC 1 1
5 1247 1 1 8 . NAD N 23.512 -1.527 4.814 1.00 . A A . 7 4G6 NAD 1 1
5 1248 1 1 9 DPR C C 22.636 -2.452 5.168 1.00 . A A . 8 DPR C 1 1
5 1249 1 1 9 DPR CA C 22.079 -2.353 6.592 1.00 . A A . 8 DPR CA 1 1
5 1250 1 1 9 DPR CB C 22.797 -1.300 7.435 1.00 . A A . 8 DPR CB 1 1
5 1251 1 1 9 DPR CD C 20.418 -1.136 7.900 1.00 . A A . 8 DPR CD 1 1
5 1252 1 1 9 DPR CG C 21.819 -0.982 8.522 1.00 . A A . 8 DPR CG 1 1
5 1253 1 1 9 DPR HA H 22.153 -3.309 7.083 1.00 . A A . 8 DPR HA 1 1
5 1254 1 1 9 DPR HB2 H 23.714 -1.701 7.842 1.00 . A A . 8 DPR HB2 1 1
5 1255 1 1 9 DPR HB3 H 22.992 -0.415 6.853 1.00 . A A . 8 DPR HB3 1 1
5 1256 1 1 9 DPR HD2 H 19.773 -1.713 8.551 1.00 . A A . 8 DPR HD2 1 1
5 1257 1 1 9 DPR HD3 H 19.979 -0.171 7.693 1.00 . A A . 8 DPR HD3 1 1
5 1258 1 1 9 DPR HG2 H 21.945 -1.677 9.345 1.00 . A A . 8 DPR HG2 1 1
5 1259 1 1 9 DPR HG3 H 21.958 0.032 8.869 1.00 . A A . 8 DPR HG3 1 1
5 1260 1 1 9 DPR N N 20.667 -1.862 6.638 1.00 . A A . 8 DPR N 1 1
5 1261 1 1 9 DPR O O 22.257 -3.357 4.426 1.00 . A A . 8 DPR O 1 1
5 1262 1 1 10 VAL C C 19.793 -2.062 5.663 1.00 . A A . 9 VAL C 1 1
5 1263 1 1 10 VAL CA C 18.364 -1.529 5.839 1.00 . A A . 9 VAL CA 1 1
5 1264 1 1 10 VAL CB C 17.380 -2.549 5.262 1.00 . A A . 9 VAL CB 1 1
5 1265 1 1 10 VAL CG1 C 17.600 -3.909 5.926 1.00 . A A . 9 VAL CG1 1 1
5 1266 1 1 10 VAL CG2 C 15.955 -2.079 5.551 1.00 . A A . 9 VAL CG2 1 1
5 1267 1 1 10 VAL H H 18.192 -0.210 4.180 1.00 . A A . 9 VAL H 1 1
5 1268 1 1 10 VAL HA H 18.147 -1.419 6.890 1.00 . A A . 9 VAL HA 1 1
5 1269 1 1 10 VAL HB H 17.526 -2.635 4.194 1.00 . A A . 9 VAL HB 1 1
5 1270 1 1 10 VAL HG11 H 17.667 -3.782 6.997 1.00 . A A . 9 VAL HG11 1 1
5 1271 1 1 10 VAL HG12 H 18.516 -4.346 5.558 1.00 . A A . 9 VAL HG12 1 1
5 1272 1 1 10 VAL HG13 H 16.771 -4.561 5.693 1.00 . A A . 9 VAL HG13 1 1
5 1273 1 1 10 VAL HG21 H 15.255 -2.837 5.239 1.00 . A A . 9 VAL HG21 1 1
5 1274 1 1 10 VAL HG22 H 15.760 -1.164 5.013 1.00 . A A . 9 VAL HG22 1 1
5 1275 1 1 10 VAL HG23 H 15.845 -1.902 6.612 1.00 . A A . 9 VAL HG23 1 1
5 1276 1 1 10 VAL N N 18.165 -0.241 5.160 1.00 . A A . 9 VAL N 1 1
5 1277 1 1 10 VAL O O 20.091 -2.676 4.639 1.00 . A A . 9 VAL O 1 1
5 1278 1 1 11 GLN C C 17.926 0.885 5.837 1.00 . A A . 10 GLN C 1 1
5 1279 1 1 11 GLN CA C 17.708 2.148 5.004 1.00 . A A . 10 GLN CA 1 1
5 1280 1 1 11 GLN CB C 18.578 3.278 5.556 1.00 . A A . 10 GLN CB 1 1
5 1281 1 1 11 GLN CD C 19.223 5.676 5.284 1.00 . A A . 10 GLN CD 1 1
5 1282 1 1 11 GLN CG C 18.359 4.549 4.731 1.00 . A A . 10 GLN CG 1 1
5 1283 1 1 11 GLN H H 15.845 2.520 5.932 1.00 . A A . 10 GLN H 1 1
5 1284 1 1 11 GLN HA H 17.988 1.950 3.978 1.00 . A A . 10 GLN HA 1 1
5 1285 1 1 11 GLN HB2 H 18.311 3.467 6.586 1.00 . A A . 10 GLN HB2 1 1
5 1286 1 1 11 GLN HB3 H 19.616 2.991 5.500 1.00 . A A . 10 GLN HB3 1 1
5 1287 1 1 11 GLN HE21 H 17.677 6.846 5.714 1.00 . A A . 10 GLN HE21 1 1
5 1288 1 1 11 GLN HE22 H 19.202 7.489 6.093 1.00 . A A . 10 GLN HE22 1 1
5 1289 1 1 11 GLN HG2 H 18.631 4.358 3.702 1.00 . A A . 10 GLN HG2 1 1
5 1290 1 1 11 GLN HG3 H 17.320 4.837 4.779 1.00 . A A . 10 GLN HG3 1 1
5 1291 1 1 11 GLN N N 16.295 2.530 5.067 1.00 . A A . 10 GLN N 1 1
5 1292 1 1 11 GLN NE2 N 18.654 6.761 5.734 1.00 . A A . 10 GLN NE2 1 1
5 1293 1 1 11 GLN O O 17.852 0.922 7.065 1.00 . A A . 10 GLN O 1 1
5 1294 1 1 11 GLN OE1 O 20.448 5.562 5.317 1.00 . A A . 10 GLN OE1 1 1
5 1295 1 1 12 LYS C C 15.598 2.879 3.988 1.00 . A A . 11 LYS C 1 1
5 1296 1 1 12 LYS CA C 14.120 3.240 4.218 1.00 . A A . 11 LYS CA 1 1
5 1297 1 1 12 LYS CB C 13.293 1.968 4.491 1.00 . A A . 11 LYS CB 1 1
5 1298 1 1 12 LYS CD C 13.168 1.826 7.128 1.00 . A A . 11 LYS CD 1 1
5 1299 1 1 12 LYS CE C 13.724 3.217 7.469 1.00 . A A . 11 LYS CE 1 1
5 1300 1 1 12 LYS CG C 13.655 1.193 5.785 1.00 . A A . 11 LYS CG 1 1
5 1301 1 1 12 LYS H H 13.849 3.489 2.146 1.00 . A A . 11 LYS H 1 1
5 1302 1 1 12 LYS HA H 14.047 3.924 5.020 1.00 . A A . 11 LYS HA 1 1
5 1303 1 1 12 LYS HB2 H 12.253 2.249 4.551 1.00 . A A . 11 LYS HB2 1 1
5 1304 1 1 12 LYS HB3 H 13.414 1.303 3.646 1.00 . A A . 11 LYS HB3 1 1
5 1305 1 1 12 LYS HD2 H 12.095 1.905 7.086 1.00 . A A . 11 LYS HD2 1 1
5 1306 1 1 12 LYS HD3 H 13.425 1.147 7.929 1.00 . A A . 11 LYS HD3 1 1
5 1307 1 1 12 LYS HE2 H 13.345 3.953 6.796 1.00 . A A . 11 LYS HE2 1 1
5 1308 1 1 12 LYS HE3 H 13.387 3.474 8.464 1.00 . A A . 11 LYS HE3 1 1
5 1309 1 1 12 LYS HG2 H 13.217 0.213 5.709 1.00 . A A . 11 LYS HG2 1 1
5 1310 1 1 12 LYS HG3 H 14.719 1.075 5.824 1.00 . A A . 11 LYS HG3 1 1
5 1311 1 1 12 LYS HZ1 H 15.550 2.223 7.578 1.00 . A A . 11 LYS HZ1 1 1
5 1312 1 1 12 LYS HZ2 H 15.564 3.776 8.264 1.00 . A A . 11 LYS HZ2 1 1
5 1313 1 1 12 LYS HZ3 H 15.568 3.590 6.576 1.00 . A A . 11 LYS HZ3 1 1
5 1314 1 1 12 LYS N N 13.577 3.847 3.010 1.00 . A A . 11 LYS N 1 1
5 1315 1 1 12 LYS NZ N 15.214 3.200 7.471 1.00 . A A . 11 LYS NZ 1 1
5 1316 1 1 12 LYS O O 16.089 2.913 2.857 1.00 . A A . 11 LYS O 1 1
5 1317 1 1 13 PHE C C 12.694 4.851 3.060 1.00 . A A . 12 PHE C 1 1
5 1318 1 1 13 PHE CA C 12.185 5.368 1.716 1.00 . A A . 12 PHE CA 1 1
5 1319 1 1 13 PHE CB C 12.703 6.798 1.480 1.00 . A A . 12 PHE CB 1 1
5 1320 1 1 13 PHE CD1 C 10.824 7.564 -0.016 1.00 . A A . 12 PHE CD1 1 1
5 1321 1 1 13 PHE CD2 C 13.046 7.357 -0.952 1.00 . A A . 12 PHE CD2 1 1
5 1322 1 1 13 PHE CE1 C 10.332 7.935 -1.270 1.00 . A A . 12 PHE CE1 1 1
5 1323 1 1 13 PHE CE2 C 12.552 7.726 -2.205 1.00 . A A . 12 PHE CE2 1 1
5 1324 1 1 13 PHE CG C 12.185 7.279 0.145 1.00 . A A . 12 PHE CG 1 1
5 1325 1 1 13 PHE CZ C 11.192 8.010 -2.365 1.00 . A A . 12 PHE CZ 1 1
5 1326 1 1 13 PHE H H 10.213 6.084 2.064 1.00 . A A . 12 PHE H 1 1
5 1327 1 1 13 PHE HA H 12.573 4.728 0.932 1.00 . A A . 12 PHE HA 1 1
5 1328 1 1 13 PHE HB2 H 12.342 7.448 2.265 1.00 . A A . 12 PHE HB2 1 1
5 1329 1 1 13 PHE HB3 H 13.785 6.802 1.476 1.00 . A A . 12 PHE HB3 1 1
5 1330 1 1 13 PHE HD1 H 10.156 7.508 0.831 1.00 . A A . 12 PHE HD1 1 1
5 1331 1 1 13 PHE HD2 H 14.097 7.156 -0.829 1.00 . A A . 12 PHE HD2 1 1
5 1332 1 1 13 PHE HE1 H 9.283 8.155 -1.393 1.00 . A A . 12 PHE HE1 1 1
5 1333 1 1 13 PHE HE2 H 13.214 7.752 -3.053 1.00 . A A . 12 PHE HE2 1 1
5 1334 1 1 13 PHE HZ H 10.805 8.296 -3.335 1.00 . A A . 12 PHE HZ 1 1
5 1335 1 1 13 PHE N N 10.719 5.343 1.668 1.00 . A A . 12 PHE N 1 1
5 1336 1 1 13 PHE O O 12.282 5.329 4.116 1.00 . A A . 12 PHE O 1 1
5 1337 1 1 14 ILE C C 10.054 4.337 1.081 1.00 . A A . 13 ILE C 1 1
5 1338 1 1 14 ILE CA C 8.529 4.441 1.081 1.00 . A A . 13 ILE CA 1 1
5 1339 1 1 14 ILE CB C 7.866 3.294 1.877 1.00 . A A . 13 ILE CB 1 1
5 1340 1 1 14 ILE CD1 C 9.779 3.071 3.596 1.00 . A A . 13 ILE CD1 1 1
5 1341 1 1 14 ILE CG1 C 8.273 3.291 3.375 1.00 . A A . 13 ILE CG1 1 1
5 1342 1 1 14 ILE CG2 C 8.226 1.949 1.238 1.00 . A A . 13 ILE CG2 1 1
5 1343 1 1 14 ILE H H 8.576 3.940 -0.988 1.00 . A A . 13 ILE H 1 1
5 1344 1 1 14 ILE HA H 8.245 5.384 1.525 1.00 . A A . 13 ILE HA 1 1
5 1345 1 1 14 ILE HB H 6.792 3.421 1.811 1.00 . A A . 13 ILE HB 1 1
5 1346 1 1 14 ILE HD11 H 10.285 4.024 3.619 1.00 . A A . 13 ILE HD11 1 1
5 1347 1 1 14 ILE HD12 H 10.188 2.458 2.810 1.00 . A A . 13 ILE HD12 1 1
5 1348 1 1 14 ILE HD13 H 9.926 2.572 4.543 1.00 . A A . 13 ILE HD13 1 1
5 1349 1 1 14 ILE HG12 H 7.996 4.237 3.813 1.00 . A A . 13 ILE HG12 1 1
5 1350 1 1 14 ILE HG13 H 7.729 2.505 3.879 1.00 . A A . 13 ILE HG13 1 1
5 1351 1 1 14 ILE HG21 H 7.579 1.178 1.632 1.00 . A A . 13 ILE HG21 1 1
5 1352 1 1 14 ILE HG22 H 9.253 1.703 1.458 1.00 . A A . 13 ILE HG22 1 1
5 1353 1 1 14 ILE HG23 H 8.094 2.013 0.168 1.00 . A A . 13 ILE HG23 1 1
5 1354 1 1 14 ILE N N 8.041 4.395 -0.301 1.00 . A A . 13 ILE N 1 1
5 1355 1 1 14 ILE O O 10.620 3.383 0.549 1.00 . A A . 13 ILE O 1 1
5 1356 1 1 15 ARG C C 6.879 4.954 -0.638 1.00 . A A . 14 ARG C 1 1
5 1357 1 1 15 ARG CA C 6.454 4.848 -2.106 1.00 . A A . 14 ARG CA 1 1
5 1358 1 1 15 ARG CB C 7.084 5.997 -2.918 1.00 . A A . 14 ARG CB 1 1
5 1359 1 1 15 ARG CD C 9.170 4.718 -3.636 1.00 . A A . 14 ARG CD 1 1
5 1360 1 1 15 ARG CG C 8.622 5.955 -2.905 1.00 . A A . 14 ARG CG 1 1
5 1361 1 1 15 ARG CZ C 11.303 5.686 -4.313 1.00 . A A . 14 ARG CZ 1 1
5 1362 1 1 15 ARG H H 4.501 5.398 -1.489 1.00 . A A . 14 ARG H 1 1
5 1363 1 1 15 ARG HA H 6.766 3.900 -2.502 1.00 . A A . 14 ARG HA 1 1
5 1364 1 1 15 ARG HB2 H 6.745 5.931 -3.940 1.00 . A A . 14 ARG HB2 1 1
5 1365 1 1 15 ARG HB3 H 6.760 6.940 -2.502 1.00 . A A . 14 ARG HB3 1 1
5 1366 1 1 15 ARG HD2 H 8.857 3.826 -3.134 1.00 . A A . 14 ARG HD2 1 1
5 1367 1 1 15 ARG HD3 H 8.794 4.711 -4.648 1.00 . A A . 14 ARG HD3 1 1
5 1368 1 1 15 ARG HE H 11.127 4.054 -3.166 1.00 . A A . 14 ARG HE 1 1
5 1369 1 1 15 ARG HG2 H 9.002 6.846 -3.368 1.00 . A A . 14 ARG HG2 1 1
5 1370 1 1 15 ARG HG3 H 8.953 5.918 -1.882 1.00 . A A . 14 ARG HG3 1 1
5 1371 1 1 15 ARG HH11 H 9.664 6.547 -5.075 1.00 . A A . 14 ARG HH11 1 1
5 1372 1 1 15 ARG HH12 H 11.170 7.285 -5.511 1.00 . A A . 14 ARG HH12 1 1
5 1373 1 1 15 ARG HH21 H 13.099 5.015 -3.737 1.00 . A A . 14 ARG HH21 1 1
5 1374 1 1 15 ARG HH22 H 13.114 6.416 -4.756 1.00 . A A . 14 ARG HH22 1 1
5 1375 1 1 15 ARG N N 5.000 4.937 -2.196 1.00 . A A . 14 ARG N 1 1
5 1376 1 1 15 ARG NE N 10.630 4.739 -3.661 1.00 . A A . 14 ARG NE 1 1
5 1377 1 1 15 ARG NH1 N 10.663 6.575 -5.022 1.00 . A A . 14 ARG NH1 1 1
5 1378 1 1 15 ARG NH2 N 12.607 5.708 -4.265 1.00 . A A . 14 ARG NH2 1 1
5 1379 1 1 15 ARG O O 6.159 5.531 0.177 1.00 . A A . 14 ARG O 1 1
5 1380 1 1 16 ACE C C 4.345 4.406 -3.223 1.00 . A A . 15 ACE C 1 1
5 1381 1 1 16 ACE CH3 C 2.827 4.562 -3.213 1.00 . A A . 15 ACE CH3 1 1
5 1382 1 1 16 ACE H1 H 2.364 3.594 -3.339 1.00 . A A . 15 ACE H1 1 1
5 1383 1 1 16 ACE H2 H 2.528 5.212 -4.020 1.00 . A A . 15 ACE H2 1 1
5 1384 1 1 16 ACE H3 H 2.514 4.989 -2.272 1.00 . A A . 15 ACE H3 1 1
5 1385 1 1 16 ACE O O 4.914 3.817 -4.142 1.00 . A A . 15 ACE O 1 1
6 1386 1 1 1 ACE C C 4.980 0.976 -4.447 1.00 . A A . 0 ACE C 1 1
6 1387 1 1 1 ACE CH3 C 3.838 1.979 -4.339 1.00 . A A . 0 ACE CH3 1 1
6 1388 1 1 1 ACE H1 H 2.896 1.469 -4.483 1.00 . A A . 0 ACE H1 1 1
6 1389 1 1 1 ACE H2 H 3.953 2.740 -5.096 1.00 . A A . 0 ACE H2 1 1
6 1390 1 1 1 ACE H3 H 3.851 2.438 -3.361 1.00 . A A . 0 ACE H3 1 1
6 1391 1 1 1 ACE O O 4.819 -0.102 -5.020 1.00 . A A . 0 ACE O 1 1
6 1392 1 1 2 GLU C C 8.154 0.601 -2.673 1.00 . A A . 1 GLU C 1 1
6 1393 1 1 2 GLU CA C 7.307 0.454 -3.935 1.00 . A A . 1 GLU CA 1 1
6 1394 1 1 2 GLU CB C 8.155 0.789 -5.164 1.00 . A A . 1 GLU CB 1 1
6 1395 1 1 2 GLU CD C 9.446 2.586 -6.331 1.00 . A A . 1 GLU CD 1 1
6 1396 1 1 2 GLU CG C 8.611 2.249 -5.101 1.00 . A A . 1 GLU CG 1 1
6 1397 1 1 2 GLU H H 6.207 2.210 -3.452 1.00 . A A . 1 GLU H 1 1
6 1398 1 1 2 GLU HA H 6.977 -0.572 -4.011 1.00 . A A . 1 GLU HA 1 1
6 1399 1 1 2 GLU HB2 H 9.020 0.143 -5.189 1.00 . A A . 1 GLU HB2 1 1
6 1400 1 1 2 GLU HB3 H 7.567 0.637 -6.056 1.00 . A A . 1 GLU HB3 1 1
6 1401 1 1 2 GLU HG2 H 7.745 2.894 -5.069 1.00 . A A . 1 GLU HG2 1 1
6 1402 1 1 2 GLU HG3 H 9.206 2.405 -4.213 1.00 . A A . 1 GLU HG3 1 1
6 1403 1 1 2 GLU N N 6.137 1.336 -3.893 1.00 . A A . 1 GLU N 1 1
6 1404 1 1 2 GLU O O 8.303 1.703 -2.131 1.00 . A A . 1 GLU O 1 1
6 1405 1 1 2 GLU OE1 O 8.926 2.466 -7.427 1.00 . A A . 1 GLU OE1 1 1
6 1406 1 1 2 GLU OE2 O 10.595 2.959 -6.158 1.00 . A A . 1 GLU OE2 1 1
6 1407 1 1 3 ARG C C 11.021 -0.652 -1.332 1.00 . A A . 2 ARG C 1 1
6 1408 1 1 3 ARG CA C 9.545 -0.526 -1.002 1.00 . A A . 2 ARG CA 1 1
6 1409 1 1 3 ARG CB C 9.177 -1.653 0.001 1.00 . A A . 2 ARG CB 1 1
6 1410 1 1 3 ARG CD C 8.739 -3.459 -1.817 1.00 . A A . 2 ARG CD 1 1
6 1411 1 1 3 ARG CG C 9.446 -3.102 -0.502 1.00 . A A . 2 ARG CG 1 1
6 1412 1 1 3 ARG CZ C 8.826 -2.886 -4.170 1.00 . A A . 2 ARG CZ 1 1
6 1413 1 1 3 ARG H H 8.547 -1.359 -2.678 1.00 . A A . 2 ARG H 1 1
6 1414 1 1 3 ARG HA H 9.406 0.420 -0.490 1.00 . A A . 2 ARG HA 1 1
6 1415 1 1 3 ARG HB2 H 9.767 -1.509 0.914 1.00 . A A . 2 ARG HB2 1 1
6 1416 1 1 3 ARG HB3 H 8.132 -1.561 0.254 1.00 . A A . 2 ARG HB3 1 1
6 1417 1 1 3 ARG HD2 H 8.852 -4.516 -2.004 1.00 . A A . 2 ARG HD2 1 1
6 1418 1 1 3 ARG HD3 H 7.688 -3.229 -1.726 1.00 . A A . 2 ARG HD3 1 1
6 1419 1 1 3 ARG HE H 10.042 -2.100 -2.786 1.00 . A A . 2 ARG HE 1 1
6 1420 1 1 3 ARG HG2 H 10.505 -3.233 -0.643 1.00 . A A . 2 ARG HG2 1 1
6 1421 1 1 3 ARG HG3 H 9.119 -3.793 0.263 1.00 . A A . 2 ARG HG3 1 1
6 1422 1 1 3 ARG HH11 H 7.414 -4.193 -3.613 1.00 . A A . 2 ARG HH11 1 1
6 1423 1 1 3 ARG HH12 H 7.470 -3.825 -5.305 1.00 . A A . 2 ARG HH12 1 1
6 1424 1 1 3 ARG HH21 H 10.129 -1.618 -5.007 1.00 . A A . 2 ARG HH21 1 1
6 1425 1 1 3 ARG HH22 H 9.008 -2.366 -6.094 1.00 . A A . 2 ARG HH22 1 1
6 1426 1 1 3 ARG N N 8.710 -0.527 -2.207 1.00 . A A . 2 ARG N 1 1
6 1427 1 1 3 ARG NE N 9.298 -2.720 -2.939 1.00 . A A . 2 ARG NE 1 1
6 1428 1 1 3 ARG NH1 N 7.826 -3.698 -4.379 1.00 . A A . 2 ARG NH1 1 1
6 1429 1 1 3 ARG NH2 N 9.363 -2.239 -5.168 1.00 . A A . 2 ARG NH2 1 1
6 1430 1 1 3 ARG O O 11.735 -1.292 -0.565 1.00 . A A . 2 ARG O 1 1
6 1431 1 1 4 PHE C C 13.719 -0.333 -1.486 1.00 . A A . 3 PHE C 1 1
6 1432 1 1 4 PHE CA C 12.953 -0.043 -2.767 1.00 . A A . 3 PHE CA 1 1
6 1433 1 1 4 PHE CB C 13.351 1.306 -3.380 1.00 . A A . 3 PHE CB 1 1
6 1434 1 1 4 PHE CD1 C 15.527 0.509 -4.402 1.00 . A A . 3 PHE CD1 1 1
6 1435 1 1 4 PHE CD2 C 15.558 2.389 -2.869 1.00 . A A . 3 PHE CD2 1 1
6 1436 1 1 4 PHE CE1 C 16.918 0.616 -4.549 1.00 . A A . 3 PHE CE1 1 1
6 1437 1 1 4 PHE CE2 C 16.936 2.497 -3.013 1.00 . A A . 3 PHE CE2 1 1
6 1438 1 1 4 PHE CG C 14.848 1.396 -3.560 1.00 . A A . 3 PHE CG 1 1
6 1439 1 1 4 PHE CZ C 17.623 1.612 -3.855 1.00 . A A . 3 PHE CZ 1 1
6 1440 1 1 4 PHE H H 10.894 0.522 -2.989 1.00 . A A . 3 PHE H 1 1
6 1441 1 1 4 PHE HA H 13.136 -0.834 -3.481 1.00 . A A . 3 PHE HA 1 1
6 1442 1 1 4 PHE HB2 H 12.876 1.406 -4.345 1.00 . A A . 3 PHE HB2 1 1
6 1443 1 1 4 PHE HB3 H 13.013 2.101 -2.749 1.00 . A A . 3 PHE HB3 1 1
6 1444 1 1 4 PHE HD1 H 14.983 -0.257 -4.935 1.00 . A A . 3 PHE HD1 1 1
6 1445 1 1 4 PHE HD2 H 15.035 3.074 -2.219 1.00 . A A . 3 PHE HD2 1 1
6 1446 1 1 4 PHE HE1 H 17.446 -0.066 -5.198 1.00 . A A . 3 PHE HE1 1 1
6 1447 1 1 4 PHE HE2 H 17.468 3.267 -2.472 1.00 . A A . 3 PHE HE2 1 1
6 1448 1 1 4 PHE HZ H 18.693 1.696 -3.968 1.00 . A A . 3 PHE HZ 1 1
6 1449 1 1 4 PHE N N 11.503 -0.007 -2.434 1.00 . A A . 3 PHE N 1 1
6 1450 1 1 4 PHE O O 13.877 0.523 -0.621 1.00 . A A . 3 PHE O 1 1
6 1451 1 1 5 TYR C C 16.063 -2.292 -0.087 1.00 . A A . 4 TYR C 1 1
6 1452 1 1 5 TYR CA C 14.569 -2.019 -0.004 1.00 . A A . 4 TYR CA 1 1
6 1453 1 1 5 TYR CB C 13.863 -3.327 0.377 1.00 . A A . 4 TYR CB 1 1
6 1454 1 1 5 TYR CD1 C 13.380 -2.722 2.704 1.00 . A A . 4 TYR CD1 1 1
6 1455 1 1 5 TYR CD2 C 14.818 -4.630 2.324 1.00 . A A . 4 TYR CD2 1 1
6 1456 1 1 5 TYR CE1 C 13.484 -2.889 4.065 1.00 . A A . 4 TYR CE1 1 1
6 1457 1 1 5 TYR CE2 C 14.935 -4.806 3.708 1.00 . A A . 4 TYR CE2 1 1
6 1458 1 1 5 TYR CG C 14.035 -3.585 1.835 1.00 . A A . 4 TYR CG 1 1
6 1459 1 1 5 TYR CZ C 14.264 -3.933 4.585 1.00 . A A . 4 TYR CZ 1 1
6 1460 1 1 5 TYR H H 13.762 -2.284 -1.943 1.00 . A A . 4 TYR H 1 1
6 1461 1 1 5 TYR HA H 14.375 -1.275 0.755 1.00 . A A . 4 TYR HA 1 1
6 1462 1 1 5 TYR HB2 H 12.812 -3.245 0.158 1.00 . A A . 4 TYR HB2 1 1
6 1463 1 1 5 TYR HB3 H 14.284 -4.149 -0.183 1.00 . A A . 4 TYR HB3 1 1
6 1464 1 1 5 TYR HD1 H 12.776 -1.919 2.309 1.00 . A A . 4 TYR HD1 1 1
6 1465 1 1 5 TYR HD2 H 15.328 -5.295 1.643 1.00 . A A . 4 TYR HD2 1 1
6 1466 1 1 5 TYR HE1 H 12.953 -2.213 4.713 1.00 . A A . 4 TYR HE1 1 1
6 1467 1 1 5 TYR HE2 H 15.540 -5.607 4.097 1.00 . A A . 4 TYR HE2 1 1
6 1468 1 1 5 TYR HH H 15.227 -4.496 6.133 1.00 . A A . 4 TYR HH 1 1
6 1469 1 1 5 TYR N N 14.028 -1.607 -1.285 1.00 . A A . 4 TYR N 1 1
6 1470 1 1 5 TYR O O 16.501 -3.206 -0.785 1.00 . A A . 4 TYR O 1 1
6 1471 1 1 5 TYR OH O 14.370 -4.106 5.949 1.00 . A A . 4 TYR OH 1 1
6 1472 1 1 6 GLU C C 18.754 -1.531 2.140 1.00 . A A . 5 GLU C 1 1
6 1473 1 1 6 GLU CA C 18.288 -1.698 0.700 1.00 . A A . 5 GLU CA 1 1
6 1474 1 1 6 GLU CB C 18.977 -0.671 -0.211 1.00 . A A . 5 GLU CB 1 1
6 1475 1 1 6 GLU CD C 20.948 -2.202 -0.745 1.00 . A A . 5 GLU CD 1 1
6 1476 1 1 6 GLU CG C 20.512 -0.836 -0.205 1.00 . A A . 5 GLU CG 1 1
6 1477 1 1 6 GLU H H 16.430 -0.813 1.217 1.00 . A A . 5 GLU H 1 1
6 1478 1 1 6 GLU HA H 18.525 -2.694 0.367 1.00 . A A . 5 GLU HA 1 1
6 1479 1 1 6 GLU HB2 H 18.615 -0.799 -1.220 1.00 . A A . 5 GLU HB2 1 1
6 1480 1 1 6 GLU HB3 H 18.726 0.322 0.129 1.00 . A A . 5 GLU HB3 1 1
6 1481 1 1 6 GLU HG2 H 20.951 -0.063 -0.817 1.00 . A A . 5 GLU HG2 1 1
6 1482 1 1 6 GLU HG3 H 20.877 -0.731 0.805 1.00 . A A . 5 GLU HG3 1 1
6 1483 1 1 6 GLU N N 16.840 -1.513 0.660 1.00 . A A . 5 GLU N 1 1
6 1484 1 1 6 GLU O O 19.318 -0.505 2.511 1.00 . A A . 5 GLU O 1 1
6 1485 1 1 6 GLU OE1 O 20.612 -3.206 -0.144 1.00 . A A . 5 GLU OE1 1 1
6 1486 1 1 6 GLU OE2 O 21.617 -2.219 -1.764 1.00 . A A . 5 GLU OE2 1 1
6 1487 1 1 7 LYS C C 20.027 -3.470 4.606 1.00 . A A . 6 LYS C 1 1
6 1488 1 1 7 LYS CA C 18.867 -2.518 4.368 1.00 . A A . 6 LYS CA 1 1
6 1489 1 1 7 LYS CB C 17.670 -2.940 5.228 1.00 . A A . 6 LYS CB 1 1
6 1490 1 1 7 LYS CD C 16.843 -3.292 7.565 1.00 . A A . 6 LYS CD 1 1
6 1491 1 1 7 LYS CE C 17.219 -3.208 9.046 1.00 . A A . 6 LYS CE 1 1
6 1492 1 1 7 LYS CG C 18.043 -2.872 6.713 1.00 . A A . 6 LYS CG 1 1
6 1493 1 1 7 LYS H H 18.028 -3.338 2.603 1.00 . A A . 6 LYS H 1 1
6 1494 1 1 7 LYS HA H 19.166 -1.517 4.649 1.00 . A A . 6 LYS HA 1 1
6 1495 1 1 7 LYS HB2 H 16.839 -2.277 5.037 1.00 . A A . 6 LYS HB2 1 1
6 1496 1 1 7 LYS HB3 H 17.387 -3.952 4.978 1.00 . A A . 6 LYS HB3 1 1
6 1497 1 1 7 LYS HD2 H 16.010 -2.632 7.365 1.00 . A A . 6 LYS HD2 1 1
6 1498 1 1 7 LYS HD3 H 16.567 -4.306 7.324 1.00 . A A . 6 LYS HD3 1 1
6 1499 1 1 7 LYS HE2 H 17.509 -2.195 9.287 1.00 . A A . 6 LYS HE2 1 1
6 1500 1 1 7 LYS HE3 H 16.370 -3.493 9.650 1.00 . A A . 6 LYS HE3 1 1
6 1501 1 1 7 LYS HG2 H 18.873 -3.531 6.914 1.00 . A A . 6 LYS HG2 1 1
6 1502 1 1 7 LYS HG3 H 18.317 -1.861 6.966 1.00 . A A . 6 LYS HG3 1 1
6 1503 1 1 7 LYS HZ1 H 19.211 -3.779 8.843 1.00 . A A . 6 LYS HZ1 1 1
6 1504 1 1 7 LYS HZ2 H 18.127 -5.080 8.966 1.00 . A A . 6 LYS HZ2 1 1
6 1505 1 1 7 LYS HZ3 H 18.530 -4.173 10.345 1.00 . A A . 6 LYS HZ3 1 1
6 1506 1 1 7 LYS N N 18.493 -2.551 2.955 1.00 . A A . 6 LYS N 1 1
6 1507 1 1 7 LYS NZ N 18.357 -4.129 9.322 1.00 . A A . 6 LYS NZ 1 1
6 1508 1 1 7 LYS O O 20.073 -4.564 4.042 1.00 . A A . 6 LYS O 1 1
6 1509 1 1 8 . CAA C 24.501 -4.419 5.169 1.00 . A A . 7 4G6 CAA 1 1
6 1510 1 1 8 . CAB C 22.992 -3.593 3.377 1.00 . A A . 7 4G6 CAB 1 1
6 1511 1 1 8 . CAE C 22.119 -3.943 5.670 1.00 . A A . 7 4G6 CAE 1 1
6 1512 1 1 8 . CAF C 23.335 -3.478 4.864 1.00 . A A . 7 4G6 CAF 1 1
6 1513 1 1 8 . HAA H 25.246 -4.344 4.377 1.00 . A A . 7 4G6 HAA 1 1
6 1514 1 1 8 . HAB H 24.134 -5.444 5.226 1.00 . A A . 7 4G6 HAB 1 1
6 1515 1 1 8 . HAC H 24.954 -4.141 6.121 1.00 . A A . 7 4G6 HAC 1 1
6 1516 1 1 8 . HAD H 23.711 -4.248 2.885 1.00 . A A . 7 4G6 HAD 1 1
6 1517 1 1 8 . HAE H 23.026 -2.604 2.919 1.00 . A A . 7 4G6 HAE 1 1
6 1518 1 1 8 . HAF H 21.989 -4.005 3.267 1.00 . A A . 7 4G6 HAF 1 1
6 1519 1 1 8 . HAG H 21.873 -4.962 5.371 1.00 . A A . 7 4G6 HAG 1 1
6 1520 1 1 8 . HAH H 22.357 -3.932 6.734 1.00 . A A . 7 4G6 HAH 1 1
6 1521 1 1 8 . HAI H 20.906 -2.172 5.850 1.00 . A A . 7 4G6 HAI 1 1
6 1522 1 1 8 . HAL H 24.280 -1.604 4.511 1.00 . A A . 7 4G6 HAL 1 1
6 1523 1 1 8 . NAC N 20.965 -3.070 5.415 1.00 . A A . 7 4G6 NAC 1 1
6 1524 1 1 8 . NAD N 23.715 -2.091 5.177 1.00 . A A . 7 4G6 NAD 1 1
6 1525 1 1 9 DPR C C 23.377 -1.457 6.290 1.00 . A A . 8 DPR C 1 1
6 1526 1 1 9 DPR CA C 23.876 -0.017 6.477 1.00 . A A . 8 DPR CA 1 1
6 1527 1 1 9 DPR CB C 24.947 0.373 5.467 1.00 . A A . 8 DPR CB 1 1
6 1528 1 1 9 DPR CD C 23.510 2.300 5.850 1.00 . A A . 8 DPR CD 1 1
6 1529 1 1 9 DPR CG C 24.962 1.870 5.540 1.00 . A A . 8 DPR CG 1 1
6 1530 1 1 9 DPR HA H 24.280 0.096 7.469 1.00 . A A . 8 DPR HA 1 1
6 1531 1 1 9 DPR HB2 H 25.906 -0.041 5.750 1.00 . A A . 8 DPR HB2 1 1
6 1532 1 1 9 DPR HB3 H 24.670 0.056 4.474 1.00 . A A . 8 DPR HB3 1 1
6 1533 1 1 9 DPR HD2 H 23.489 3.008 6.669 1.00 . A A . 8 DPR HD2 1 1
6 1534 1 1 9 DPR HD3 H 23.045 2.720 4.974 1.00 . A A . 8 DPR HD3 1 1
6 1535 1 1 9 DPR HG2 H 25.628 2.194 6.332 1.00 . A A . 8 DPR HG2 1 1
6 1536 1 1 9 DPR HG3 H 25.276 2.289 4.596 1.00 . A A . 8 DPR HG3 1 1
6 1537 1 1 9 DPR N N 22.843 1.035 6.234 1.00 . A A . 8 DPR N 1 1
6 1538 1 1 9 DPR O O 22.708 -1.970 7.184 1.00 . A A . 8 DPR O 1 1
6 1539 1 1 10 VAL C C 21.539 0.818 6.353 1.00 . A A . 9 VAL C 1 1
6 1540 1 1 10 VAL CA C 20.559 1.985 6.108 1.00 . A A . 9 VAL CA 1 1
6 1541 1 1 10 VAL CB C 19.521 2.012 7.241 1.00 . A A . 9 VAL CB 1 1
6 1542 1 1 10 VAL CG1 C 18.722 0.698 7.277 1.00 . A A . 9 VAL CG1 1 1
6 1543 1 1 10 VAL CG2 C 20.234 2.237 8.580 1.00 . A A . 9 VAL CG2 1 1
6 1544 1 1 10 VAL H H 19.729 0.957 4.432 1.00 . A A . 9 VAL H 1 1
6 1545 1 1 10 VAL HA H 21.089 2.921 6.120 1.00 . A A . 9 VAL HA 1 1
6 1546 1 1 10 VAL HB H 18.836 2.821 7.063 1.00 . A A . 9 VAL HB 1 1
6 1547 1 1 10 VAL HG11 H 17.721 0.892 7.635 1.00 . A A . 9 VAL HG11 1 1
6 1548 1 1 10 VAL HG12 H 19.204 -0.005 7.941 1.00 . A A . 9 VAL HG12 1 1
6 1549 1 1 10 VAL HG13 H 18.667 0.282 6.281 1.00 . A A . 9 VAL HG13 1 1
6 1550 1 1 10 VAL HG21 H 19.508 2.518 9.330 1.00 . A A . 9 VAL HG21 1 1
6 1551 1 1 10 VAL HG22 H 20.963 3.026 8.472 1.00 . A A . 9 VAL HG22 1 1
6 1552 1 1 10 VAL HG23 H 20.730 1.327 8.882 1.00 . A A . 9 VAL HG23 1 1
6 1553 1 1 10 VAL N N 19.853 1.846 4.826 1.00 . A A . 9 VAL N 1 1
6 1554 1 1 10 VAL O O 21.107 -0.287 6.673 1.00 . A A . 9 VAL O 1 1
6 1555 1 1 11 GLN C C 19.354 2.923 4.208 1.00 . A A . 10 GLN C 1 1
6 1556 1 1 11 GLN CA C 18.600 2.701 2.891 1.00 . A A . 10 GLN CA 1 1
6 1557 1 1 11 GLN CB C 19.381 3.303 1.708 1.00 . A A . 10 GLN CB 1 1
6 1558 1 1 11 GLN CD C 21.626 2.552 2.621 1.00 . A A . 10 GLN CD 1 1
6 1559 1 1 11 GLN CG C 20.677 2.523 1.431 1.00 . A A . 10 GLN CG 1 1
6 1560 1 1 11 GLN H H 17.286 4.316 3.291 1.00 . A A . 10 GLN H 1 1
6 1561 1 1 11 GLN HA H 18.452 1.644 2.730 1.00 . A A . 10 GLN HA 1 1
6 1562 1 1 11 GLN HB2 H 18.759 3.276 0.825 1.00 . A A . 10 GLN HB2 1 1
6 1563 1 1 11 GLN HB3 H 19.628 4.329 1.934 1.00 . A A . 10 GLN HB3 1 1
6 1564 1 1 11 GLN HE21 H 21.667 0.575 2.797 1.00 . A A . 10 GLN HE21 1 1
6 1565 1 1 11 GLN HE22 H 22.612 1.419 3.921 1.00 . A A . 10 GLN HE22 1 1
6 1566 1 1 11 GLN HG2 H 20.427 1.501 1.211 1.00 . A A . 10 GLN HG2 1 1
6 1567 1 1 11 GLN HG3 H 21.171 2.957 0.575 1.00 . A A . 10 GLN HG3 1 1
6 1568 1 1 11 GLN N N 17.307 3.381 2.997 1.00 . A A . 10 GLN N 1 1
6 1569 1 1 11 GLN NE2 N 22.000 1.423 3.160 1.00 . A A . 10 GLN NE2 1 1
6 1570 1 1 11 GLN O O 19.459 4.056 4.674 1.00 . A A . 10 GLN O 1 1
6 1571 1 1 11 GLN OE1 O 22.039 3.623 3.065 1.00 . A A . 10 GLN OE1 1 1
6 1572 1 1 12 LYS C C 16.156 2.768 2.714 1.00 . A A . 11 LYS C 1 1
6 1573 1 1 12 LYS CA C 14.890 3.615 2.883 1.00 . A A . 11 LYS CA 1 1
6 1574 1 1 12 LYS CB C 14.393 3.557 4.330 1.00 . A A . 11 LYS CB 1 1
6 1575 1 1 12 LYS CD C 15.044 3.985 6.759 1.00 . A A . 11 LYS CD 1 1
6 1576 1 1 12 LYS CE C 13.792 4.823 7.081 1.00 . A A . 11 LYS CE 1 1
6 1577 1 1 12 LYS CG C 15.472 4.079 5.280 1.00 . A A . 11 LYS CG 1 1
6 1578 1 1 12 LYS H H 13.942 2.249 1.594 1.00 . A A . 11 LYS H 1 1
6 1579 1 1 12 LYS HA H 15.110 4.639 2.626 1.00 . A A . 11 LYS HA 1 1
6 1580 1 1 12 LYS HB2 H 13.520 4.176 4.398 1.00 . A A . 11 LYS HB2 1 1
6 1581 1 1 12 LYS HB3 H 14.139 2.540 4.588 1.00 . A A . 11 LYS HB3 1 1
6 1582 1 1 12 LYS HD2 H 14.833 2.952 6.986 1.00 . A A . 11 LYS HD2 1 1
6 1583 1 1 12 LYS HD3 H 15.861 4.319 7.379 1.00 . A A . 11 LYS HD3 1 1
6 1584 1 1 12 LYS HE2 H 13.609 4.792 8.144 1.00 . A A . 11 LYS HE2 1 1
6 1585 1 1 12 LYS HE3 H 13.966 5.847 6.782 1.00 . A A . 11 LYS HE3 1 1
6 1586 1 1 12 LYS HG2 H 16.365 3.494 5.151 1.00 . A A . 11 LYS HG2 1 1
6 1587 1 1 12 LYS HG3 H 15.683 5.108 5.037 1.00 . A A . 11 LYS HG3 1 1
6 1588 1 1 12 LYS HZ1 H 12.330 4.954 5.607 1.00 . A A . 11 LYS HZ1 1 1
6 1589 1 1 12 LYS HZ2 H 11.807 4.204 7.037 1.00 . A A . 11 LYS HZ2 1 1
6 1590 1 1 12 LYS HZ3 H 12.818 3.369 5.957 1.00 . A A . 11 LYS HZ3 1 1
6 1591 1 1 12 LYS N N 13.832 3.120 2.028 1.00 . A A . 11 LYS N 1 1
6 1592 1 1 12 LYS NZ N 12.597 4.298 6.367 1.00 . A A . 11 LYS NZ 1 1
6 1593 1 1 12 LYS O O 16.091 1.590 2.342 1.00 . A A . 11 LYS O 1 1
6 1594 1 1 13 PHE C C 12.700 3.807 1.857 1.00 . A A . 12 PHE C 1 1
6 1595 1 1 13 PHE CA C 11.672 3.132 0.967 1.00 . A A . 12 PHE CA 1 1
6 1596 1 1 13 PHE CB C 12.247 2.822 -0.409 1.00 . A A . 12 PHE CB 1 1
6 1597 1 1 13 PHE CD1 C 13.162 5.114 -0.916 1.00 . A A . 12 PHE CD1 1 1
6 1598 1 1 13 PHE CD2 C 11.492 4.155 -2.378 1.00 . A A . 12 PHE CD2 1 1
6 1599 1 1 13 PHE CE1 C 13.188 6.262 -1.705 1.00 . A A . 12 PHE CE1 1 1
6 1600 1 1 13 PHE CE2 C 11.523 5.291 -3.169 1.00 . A A . 12 PHE CE2 1 1
6 1601 1 1 13 PHE CG C 12.315 4.060 -1.255 1.00 . A A . 12 PHE CG 1 1
6 1602 1 1 13 PHE CZ C 12.368 6.352 -2.839 1.00 . A A . 12 PHE CZ 1 1
6 1603 1 1 13 PHE H H 10.257 4.385 0.009 1.00 . A A . 12 PHE H 1 1
6 1604 1 1 13 PHE HA H 11.437 2.195 1.424 1.00 . A A . 12 PHE HA 1 1
6 1605 1 1 13 PHE HB2 H 13.249 2.464 -0.283 1.00 . A A . 12 PHE HB2 1 1
6 1606 1 1 13 PHE HB3 H 11.647 2.066 -0.899 1.00 . A A . 12 PHE HB3 1 1
6 1607 1 1 13 PHE HD1 H 13.814 5.034 -0.060 1.00 . A A . 12 PHE HD1 1 1
6 1608 1 1 13 PHE HD2 H 10.836 3.338 -2.636 1.00 . A A . 12 PHE HD2 1 1
6 1609 1 1 13 PHE HE1 H 13.838 7.074 -1.441 1.00 . A A . 12 PHE HE1 1 1
6 1610 1 1 13 PHE HE2 H 10.897 5.343 -4.039 1.00 . A A . 12 PHE HE2 1 1
6 1611 1 1 13 PHE HZ H 12.380 7.239 -3.450 1.00 . A A . 12 PHE HZ 1 1
6 1612 1 1 13 PHE N N 10.418 3.867 0.825 1.00 . A A . 12 PHE N 1 1
6 1613 1 1 13 PHE O O 12.471 4.885 2.402 1.00 . A A . 12 PHE O 1 1
6 1614 1 1 14 ILE C C 9.483 3.835 1.767 1.00 . A A . 13 ILE C 1 1
6 1615 1 1 14 ILE CA C 8.214 4.630 1.478 1.00 . A A . 13 ILE CA 1 1
6 1616 1 1 14 ILE CB C 7.071 4.043 2.335 1.00 . A A . 13 ILE CB 1 1
6 1617 1 1 14 ILE CD1 C 6.404 2.423 0.488 1.00 . A A . 13 ILE CD1 1 1
6 1618 1 1 14 ILE CG1 C 6.807 2.574 1.961 1.00 . A A . 13 ILE CG1 1 1
6 1619 1 1 14 ILE CG2 C 5.784 4.864 2.188 1.00 . A A . 13 ILE CG2 1 1
6 1620 1 1 14 ILE H H 8.365 3.924 -0.531 1.00 . A A . 13 ILE H 1 1
6 1621 1 1 14 ILE HA H 8.373 5.649 1.774 1.00 . A A . 13 ILE HA 1 1
6 1622 1 1 14 ILE HB H 7.378 4.082 3.372 1.00 . A A . 13 ILE HB 1 1
6 1623 1 1 14 ILE HD11 H 5.788 1.542 0.379 1.00 . A A . 13 ILE HD11 1 1
6 1624 1 1 14 ILE HD12 H 7.288 2.313 -0.116 1.00 . A A . 13 ILE HD12 1 1
6 1625 1 1 14 ILE HD13 H 5.848 3.287 0.164 1.00 . A A . 13 ILE HD13 1 1
6 1626 1 1 14 ILE HG12 H 7.701 2.002 2.139 1.00 . A A . 13 ILE HG12 1 1
6 1627 1 1 14 ILE HG13 H 6.014 2.191 2.584 1.00 . A A . 13 ILE HG13 1 1
6 1628 1 1 14 ILE HG21 H 5.336 4.673 1.225 1.00 . A A . 13 ILE HG21 1 1
6 1629 1 1 14 ILE HG22 H 6.013 5.915 2.284 1.00 . A A . 13 ILE HG22 1 1
6 1630 1 1 14 ILE HG23 H 5.090 4.579 2.966 1.00 . A A . 13 ILE HG23 1 1
6 1631 1 1 14 ILE N N 7.919 4.593 0.037 1.00 . A A . 13 ILE N 1 1
6 1632 1 1 14 ILE O O 9.604 3.195 2.811 1.00 . A A . 13 ILE O 1 1
6 1633 1 1 15 ARG C C 7.079 5.443 -0.538 1.00 . A A . 14 ARG C 1 1
6 1634 1 1 15 ARG CA C 6.902 5.255 -2.037 1.00 . A A . 14 ARG CA 1 1
6 1635 1 1 15 ARG CB C 8.213 5.494 -2.806 1.00 . A A . 14 ARG CB 1 1
6 1636 1 1 15 ARG CD C 8.949 7.584 -1.489 1.00 . A A . 14 ARG CD 1 1
6 1637 1 1 15 ARG CG C 8.631 6.980 -2.861 1.00 . A A . 14 ARG CG 1 1
6 1638 1 1 15 ARG CZ C 10.416 7.147 0.390 1.00 . A A . 14 ARG CZ 1 1
6 1639 1 1 15 ARG H H 5.796 7.040 -2.311 1.00 . A A . 14 ARG H 1 1
6 1640 1 1 15 ARG HA H 6.620 4.221 -2.193 1.00 . A A . 14 ARG HA 1 1
6 1641 1 1 15 ARG HB2 H 9.003 4.934 -2.333 1.00 . A A . 14 ARG HB2 1 1
6 1642 1 1 15 ARG HB3 H 8.089 5.133 -3.816 1.00 . A A . 14 ARG HB3 1 1
6 1643 1 1 15 ARG HD2 H 9.318 8.588 -1.638 1.00 . A A . 14 ARG HD2 1 1
6 1644 1 1 15 ARG HD3 H 8.070 7.639 -0.884 1.00 . A A . 14 ARG HD3 1 1
6 1645 1 1 15 ARG HE H 10.377 6.027 -1.272 1.00 . A A . 14 ARG HE 1 1
6 1646 1 1 15 ARG HG2 H 9.501 7.069 -3.480 1.00 . A A . 14 ARG HG2 1 1
6 1647 1 1 15 ARG HG3 H 7.828 7.540 -3.308 1.00 . A A . 14 ARG HG3 1 1
6 1648 1 1 15 ARG HH11 H 9.194 8.725 0.547 1.00 . A A . 14 ARG HH11 1 1
6 1649 1 1 15 ARG HH12 H 10.229 8.440 1.907 1.00 . A A . 14 ARG HH12 1 1
6 1650 1 1 15 ARG HH21 H 11.739 5.651 0.504 1.00 . A A . 14 ARG HH21 1 1
6 1651 1 1 15 ARG HH22 H 11.672 6.699 1.881 1.00 . A A . 14 ARG HH22 1 1
6 1652 1 1 15 ARG N N 5.843 6.103 -2.584 1.00 . A A . 14 ARG N 1 1
6 1653 1 1 15 ARG NE N 9.987 6.810 -0.820 1.00 . A A . 14 ARG NE 1 1
6 1654 1 1 15 ARG NH1 N 9.907 8.185 0.995 1.00 . A A . 14 ARG NH1 1 1
6 1655 1 1 15 ARG NH2 N 11.348 6.445 0.970 1.00 . A A . 14 ARG NH2 1 1
6 1656 1 1 15 ARG O O 6.473 6.326 0.068 1.00 . A A . 14 ARG O 1 1
6 1657 1 1 16 ACE C C 4.948 5.630 -3.452 1.00 . A A . 15 ACE C 1 1
6 1658 1 1 16 ACE CH3 C 3.899 6.620 -3.950 1.00 . A A . 15 ACE CH3 1 1
6 1659 1 1 16 ACE H1 H 3.594 7.261 -3.136 1.00 . A A . 15 ACE H1 1 1
6 1660 1 1 16 ACE H2 H 3.042 6.078 -4.323 1.00 . A A . 15 ACE H2 1 1
6 1661 1 1 16 ACE H3 H 4.318 7.220 -4.744 1.00 . A A . 15 ACE H3 1 1
6 1662 1 1 16 ACE O O 4.952 4.461 -3.844 1.00 . A A . 15 ACE O 1 1
7 1663 1 1 1 ACE C C 5.024 0.802 -2.766 1.00 . A A . 0 ACE C 1 1
7 1664 1 1 1 ACE CH3 C 3.987 1.748 -2.172 1.00 . A A . 0 ACE CH3 1 1
7 1665 1 1 1 ACE H1 H 3.913 2.633 -2.785 1.00 . A A . 0 ACE H1 1 1
7 1666 1 1 1 ACE H2 H 4.283 2.025 -1.171 1.00 . A A . 0 ACE H2 1 1
7 1667 1 1 1 ACE H3 H 3.027 1.254 -2.137 1.00 . A A . 0 ACE H3 1 1
7 1668 1 1 1 ACE O O 4.837 -0.414 -2.771 1.00 . A A . 0 ACE O 1 1
7 1669 1 1 2 GLU C C 8.162 0.092 -2.796 1.00 . A A . 1 GLU C 1 1
7 1670 1 1 2 GLU CA C 7.182 0.557 -3.870 1.00 . A A . 1 GLU CA 1 1
7 1671 1 1 2 GLU CB C 7.940 1.370 -4.927 1.00 . A A . 1 GLU CB 1 1
7 1672 1 1 2 GLU CD C 6.309 0.745 -6.785 1.00 . A A . 1 GLU CD 1 1
7 1673 1 1 2 GLU CG C 6.992 1.887 -6.027 1.00 . A A . 1 GLU CG 1 1
7 1674 1 1 2 GLU H H 6.216 2.343 -3.240 1.00 . A A . 1 GLU H 1 1
7 1675 1 1 2 GLU HA H 6.753 -0.314 -4.332 1.00 . A A . 1 GLU HA 1 1
7 1676 1 1 2 GLU HB2 H 8.417 2.212 -4.449 1.00 . A A . 1 GLU HB2 1 1
7 1677 1 1 2 GLU HB3 H 8.696 0.745 -5.379 1.00 . A A . 1 GLU HB3 1 1
7 1678 1 1 2 GLU HG2 H 6.234 2.510 -5.576 1.00 . A A . 1 GLU HG2 1 1
7 1679 1 1 2 GLU HG3 H 7.560 2.482 -6.728 1.00 . A A . 1 GLU HG3 1 1
7 1680 1 1 2 GLU N N 6.120 1.368 -3.271 1.00 . A A . 1 GLU N 1 1
7 1681 1 1 2 GLU O O 8.597 0.879 -1.951 1.00 . A A . 1 GLU O 1 1
7 1682 1 1 2 GLU OE1 O 5.567 -0.003 -6.175 1.00 . A A . 1 GLU OE1 1 1
7 1683 1 1 2 GLU OE2 O 6.543 0.639 -7.979 1.00 . A A . 1 GLU OE2 1 1
7 1684 1 1 3 ARG C C 10.828 -1.281 -2.076 1.00 . A A . 2 ARG C 1 1
7 1685 1 1 3 ARG CA C 9.406 -1.789 -1.868 1.00 . A A . 2 ARG CA 1 1
7 1686 1 1 3 ARG CB C 9.400 -3.320 -1.946 1.00 . A A . 2 ARG CB 1 1
7 1687 1 1 3 ARG CD C 9.287 -3.321 -4.474 1.00 . A A . 2 ARG CD 1 1
7 1688 1 1 3 ARG CG C 10.008 -3.840 -3.240 1.00 . A A . 2 ARG CG 1 1
7 1689 1 1 3 ARG CZ C 9.532 -3.737 -6.840 1.00 . A A . 2 ARG CZ 1 1
7 1690 1 1 3 ARG H H 8.095 -1.765 -3.529 1.00 . A A . 2 ARG H 1 1
7 1691 1 1 3 ARG HA H 9.092 -1.505 -0.897 1.00 . A A . 2 ARG HA 1 1
7 1692 1 1 3 ARG HB2 H 9.964 -3.719 -1.122 1.00 . A A . 2 ARG HB2 1 1
7 1693 1 1 3 ARG HB3 H 8.385 -3.671 -1.880 1.00 . A A . 2 ARG HB3 1 1
7 1694 1 1 3 ARG HD2 H 8.239 -3.569 -4.438 1.00 . A A . 2 ARG HD2 1 1
7 1695 1 1 3 ARG HD3 H 9.424 -2.259 -4.569 1.00 . A A . 2 ARG HD3 1 1
7 1696 1 1 3 ARG HE H 10.641 -4.568 -5.392 1.00 . A A . 2 ARG HE 1 1
7 1697 1 1 3 ARG HG2 H 11.045 -3.544 -3.291 1.00 . A A . 2 ARG HG2 1 1
7 1698 1 1 3 ARG HG3 H 9.958 -4.919 -3.236 1.00 . A A . 2 ARG HG3 1 1
7 1699 1 1 3 ARG HH11 H 8.081 -2.453 -6.338 1.00 . A A . 2 ARG HH11 1 1
7 1700 1 1 3 ARG HH12 H 8.265 -2.749 -8.034 1.00 . A A . 2 ARG HH12 1 1
7 1701 1 1 3 ARG HH21 H 10.896 -4.971 -7.634 1.00 . A A . 2 ARG HH21 1 1
7 1702 1 1 3 ARG HH22 H 9.857 -4.173 -8.767 1.00 . A A . 2 ARG HH22 1 1
7 1703 1 1 3 ARG N N 8.492 -1.197 -2.839 1.00 . A A . 2 ARG N 1 1
7 1704 1 1 3 ARG NE N 9.911 -3.960 -5.586 1.00 . A A . 2 ARG NE 1 1
7 1705 1 1 3 ARG NH1 N 8.549 -2.916 -7.089 1.00 . A A . 2 ARG NH1 1 1
7 1706 1 1 3 ARG NH2 N 10.142 -4.341 -7.824 1.00 . A A . 2 ARG NH2 1 1
7 1707 1 1 3 ARG O O 11.779 -1.833 -1.529 1.00 . A A . 2 ARG O 1 1
7 1708 1 1 4 PHE C C 12.995 0.633 -1.825 1.00 . A A . 3 PHE C 1 1
7 1709 1 1 4 PHE CA C 12.284 0.327 -3.145 1.00 . A A . 3 PHE CA 1 1
7 1710 1 1 4 PHE CB C 12.094 1.624 -3.953 1.00 . A A . 3 PHE CB 1 1
7 1711 1 1 4 PHE CD1 C 14.681 1.817 -4.008 1.00 . A A . 3 PHE CD1 1 1
7 1712 1 1 4 PHE CD2 C 13.312 3.537 -5.032 1.00 . A A . 3 PHE CD2 1 1
7 1713 1 1 4 PHE CE1 C 15.832 2.525 -4.376 1.00 . A A . 3 PHE CE1 1 1
7 1714 1 1 4 PHE CE2 C 14.466 4.239 -5.396 1.00 . A A . 3 PHE CE2 1 1
7 1715 1 1 4 PHE CG C 13.403 2.327 -4.332 1.00 . A A . 3 PHE CG 1 1
7 1716 1 1 4 PHE CZ C 15.725 3.736 -5.065 1.00 . A A . 3 PHE CZ 1 1
7 1717 1 1 4 PHE H H 10.175 0.161 -3.286 1.00 . A A . 3 PHE H 1 1
7 1718 1 1 4 PHE HA H 12.864 -0.377 -3.721 1.00 . A A . 3 PHE HA 1 1
7 1719 1 1 4 PHE HB2 H 11.560 1.390 -4.860 1.00 . A A . 3 PHE HB2 1 1
7 1720 1 1 4 PHE HB3 H 11.493 2.307 -3.368 1.00 . A A . 3 PHE HB3 1 1
7 1721 1 1 4 PHE HD1 H 14.792 0.885 -3.503 1.00 . A A . 3 PHE HD1 1 1
7 1722 1 1 4 PHE HD2 H 12.341 3.933 -5.288 1.00 . A A . 3 PHE HD2 1 1
7 1723 1 1 4 PHE HE1 H 16.807 2.141 -4.110 1.00 . A A . 3 PHE HE1 1 1
7 1724 1 1 4 PHE HE2 H 14.383 5.170 -5.935 1.00 . A A . 3 PHE HE2 1 1
7 1725 1 1 4 PHE HZ H 16.615 4.278 -5.346 1.00 . A A . 3 PHE HZ 1 1
7 1726 1 1 4 PHE N N 10.967 -0.238 -2.873 1.00 . A A . 3 PHE N 1 1
7 1727 1 1 4 PHE O O 12.608 1.545 -1.093 1.00 . A A . 3 PHE O 1 1
7 1728 1 1 5 TYR C C 16.301 -0.207 -0.669 1.00 . A A . 4 TYR C 1 1
7 1729 1 1 5 TYR CA C 14.859 0.135 -0.347 1.00 . A A . 4 TYR CA 1 1
7 1730 1 1 5 TYR CB C 14.368 -0.735 0.840 1.00 . A A . 4 TYR CB 1 1
7 1731 1 1 5 TYR CD1 C 15.991 -2.670 0.685 1.00 . A A . 4 TYR CD1 1 1
7 1732 1 1 5 TYR CD2 C 13.623 -3.122 0.444 1.00 . A A . 4 TYR CD2 1 1
7 1733 1 1 5 TYR CE1 C 16.277 -4.021 0.518 1.00 . A A . 4 TYR CE1 1 1
7 1734 1 1 5 TYR CE2 C 13.909 -4.482 0.276 1.00 . A A . 4 TYR CE2 1 1
7 1735 1 1 5 TYR CG C 14.663 -2.212 0.650 1.00 . A A . 4 TYR CG 1 1
7 1736 1 1 5 TYR CZ C 15.235 -4.933 0.313 1.00 . A A . 4 TYR CZ 1 1
7 1737 1 1 5 TYR H H 14.360 -0.796 -2.183 1.00 . A A . 4 TYR H 1 1
7 1738 1 1 5 TYR HA H 14.799 1.175 -0.073 1.00 . A A . 4 TYR HA 1 1
7 1739 1 1 5 TYR HB2 H 14.853 -0.408 1.743 1.00 . A A . 4 TYR HB2 1 1
7 1740 1 1 5 TYR HB3 H 13.301 -0.604 0.949 1.00 . A A . 4 TYR HB3 1 1
7 1741 1 1 5 TYR HD1 H 16.796 -1.979 0.859 1.00 . A A . 4 TYR HD1 1 1
7 1742 1 1 5 TYR HD2 H 12.602 -2.778 0.422 1.00 . A A . 4 TYR HD2 1 1
7 1743 1 1 5 TYR HE1 H 17.306 -4.359 0.553 1.00 . A A . 4 TYR HE1 1 1
7 1744 1 1 5 TYR HE2 H 13.105 -5.180 0.121 1.00 . A A . 4 TYR HE2 1 1
7 1745 1 1 5 TYR HH H 15.727 -6.422 -0.778 1.00 . A A . 4 TYR HH 1 1
7 1746 1 1 5 TYR N N 14.073 -0.106 -1.549 1.00 . A A . 4 TYR N 1 1
7 1747 1 1 5 TYR O O 16.567 -0.985 -1.585 1.00 . A A . 4 TYR O 1 1
7 1748 1 1 5 TYR OH O 15.515 -6.274 0.147 1.00 . A A . 4 TYR OH 1 1
7 1749 1 1 6 GLU C C 19.251 -0.212 1.308 1.00 . A A . 5 GLU C 1 1
7 1750 1 1 6 GLU CA C 18.645 0.005 -0.064 1.00 . A A . 5 GLU CA 1 1
7 1751 1 1 6 GLU CB C 19.381 1.142 -0.785 1.00 . A A . 5 GLU CB 1 1
7 1752 1 1 6 GLU CD C 18.875 0.110 -3.016 1.00 . A A . 5 GLU CD 1 1
7 1753 1 1 6 GLU CG C 18.766 1.374 -2.166 1.00 . A A . 5 GLU CG 1 1
7 1754 1 1 6 GLU H H 16.955 0.896 0.858 1.00 . A A . 5 GLU H 1 1
7 1755 1 1 6 GLU HA H 18.748 -0.908 -0.636 1.00 . A A . 5 GLU HA 1 1
7 1756 1 1 6 GLU HB2 H 19.308 2.047 -0.206 1.00 . A A . 5 GLU HB2 1 1
7 1757 1 1 6 GLU HB3 H 20.421 0.876 -0.900 1.00 . A A . 5 GLU HB3 1 1
7 1758 1 1 6 GLU HG2 H 17.727 1.637 -2.048 1.00 . A A . 5 GLU HG2 1 1
7 1759 1 1 6 GLU HG3 H 19.287 2.181 -2.658 1.00 . A A . 5 GLU HG3 1 1
7 1760 1 1 6 GLU N N 17.228 0.319 0.115 1.00 . A A . 5 GLU N 1 1
7 1761 1 1 6 GLU O O 19.418 0.734 2.083 1.00 . A A . 5 GLU O 1 1
7 1762 1 1 6 GLU OE1 O 19.988 -0.344 -3.224 1.00 . A A . 5 GLU OE1 1 1
7 1763 1 1 6 GLU OE2 O 17.848 -0.375 -3.457 1.00 . A A . 5 GLU OE2 1 1
7 1764 1 1 7 LYS C C 21.108 -2.855 2.979 1.00 . A A . 6 LYS C 1 1
7 1765 1 1 7 LYS CA C 20.117 -1.724 2.959 1.00 . A A . 6 LYS CA 1 1
7 1766 1 1 7 LYS CB C 19.013 -1.943 3.994 1.00 . A A . 6 LYS CB 1 1
7 1767 1 1 7 LYS CD C 18.781 -4.485 3.644 1.00 . A A . 6 LYS CD 1 1
7 1768 1 1 7 LYS CE C 17.745 -5.600 3.503 1.00 . A A . 6 LYS CE 1 1
7 1769 1 1 7 LYS CG C 18.059 -3.129 3.719 1.00 . A A . 6 LYS CG 1 1
7 1770 1 1 7 LYS H H 19.398 -2.197 1.018 1.00 . A A . 6 LYS H 1 1
7 1771 1 1 7 LYS HA H 20.664 -0.842 3.270 1.00 . A A . 6 LYS HA 1 1
7 1772 1 1 7 LYS HB2 H 19.468 -2.087 4.947 1.00 . A A . 6 LYS HB2 1 1
7 1773 1 1 7 LYS HB3 H 18.424 -1.044 4.020 1.00 . A A . 6 LYS HB3 1 1
7 1774 1 1 7 LYS HD2 H 19.414 -4.515 2.775 1.00 . A A . 6 LYS HD2 1 1
7 1775 1 1 7 LYS HD3 H 19.367 -4.645 4.536 1.00 . A A . 6 LYS HD3 1 1
7 1776 1 1 7 LYS HE2 H 17.090 -5.592 4.361 1.00 . A A . 6 LYS HE2 1 1
7 1777 1 1 7 LYS HE3 H 17.165 -5.444 2.606 1.00 . A A . 6 LYS HE3 1 1
7 1778 1 1 7 LYS HG2 H 17.341 -3.171 4.528 1.00 . A A . 6 LYS HG2 1 1
7 1779 1 1 7 LYS HG3 H 17.536 -2.953 2.797 1.00 . A A . 6 LYS HG3 1 1
7 1780 1 1 7 LYS HZ1 H 19.463 -6.775 3.543 1.00 . A A . 6 LYS HZ1 1 1
7 1781 1 1 7 LYS HZ2 H 18.256 -7.348 2.494 1.00 . A A . 6 LYS HZ2 1 1
7 1782 1 1 7 LYS HZ3 H 18.088 -7.541 4.173 1.00 . A A . 6 LYS HZ3 1 1
7 1783 1 1 7 LYS N N 19.561 -1.459 1.644 1.00 . A A . 6 LYS N 1 1
7 1784 1 1 7 LYS NZ N 18.441 -6.915 3.422 1.00 . A A . 6 LYS NZ 1 1
7 1785 1 1 7 LYS O O 21.469 -3.423 1.948 1.00 . A A . 6 LYS O 1 1
7 1786 1 1 8 . CAA C 24.856 -4.508 5.268 1.00 . A A . 7 4G6 CAA 1 1
7 1787 1 1 8 . CAB C 24.567 -3.367 3.072 1.00 . A A . 7 4G6 CAB 1 1
7 1788 1 1 8 . CAE C 22.584 -4.208 4.303 1.00 . A A . 7 4G6 CAE 1 1
7 1789 1 1 8 . CAF C 23.961 -3.564 4.463 1.00 . A A . 7 4G6 CAF 1 1
7 1790 1 1 8 . HAA H 24.560 -4.482 6.318 1.00 . A A . 7 4G6 HAA 1 1
7 1791 1 1 8 . HAB H 25.895 -4.193 5.175 1.00 . A A . 7 4G6 HAB 1 1
7 1792 1 1 8 . HAC H 24.748 -5.523 4.887 1.00 . A A . 7 4G6 HAC 1 1
7 1793 1 1 8 . HAD H 25.311 -4.140 2.884 1.00 . A A . 7 4G6 HAD 1 1
7 1794 1 1 8 . HAE H 25.037 -2.385 3.015 1.00 . A A . 7 4G6 HAE 1 1
7 1795 1 1 8 . HAF H 23.776 -3.431 2.325 1.00 . A A . 7 4G6 HAF 1 1
7 1796 1 1 8 . HAG H 22.590 -4.844 3.417 1.00 . A A . 7 4G6 HAG 1 1
7 1797 1 1 8 . HAH H 22.352 -4.810 5.182 1.00 . A A . 7 4G6 HAH 1 1
7 1798 1 1 8 . HAI H 21.270 -2.638 4.951 1.00 . A A . 7 4G6 HAI 1 1
7 1799 1 1 8 . HAL H 24.288 -1.468 4.764 1.00 . A A . 7 4G6 HAL 1 1
7 1800 1 1 8 . NAC N 21.576 -3.151 4.150 1.00 . A A . 7 4G6 NAC 1 1
7 1801 1 1 8 . NAD N 23.830 -2.269 5.148 1.00 . A A . 7 4G6 NAD 1 1
7 1802 1 1 9 DPR C C 23.137 -2.150 6.263 1.00 . A A . 8 DPR C 1 1
7 1803 1 1 9 DPR CA C 23.116 -0.726 6.856 1.00 . A A . 8 DPR CA 1 1
7 1804 1 1 9 DPR CB C 23.934 0.252 6.018 1.00 . A A . 8 DPR CB 1 1
7 1805 1 1 9 DPR CD C 21.962 1.424 6.827 1.00 . A A . 8 DPR CD 1 1
7 1806 1 1 9 DPR CG C 23.451 1.599 6.462 1.00 . A A . 8 DPR CG 1 1
7 1807 1 1 9 DPR HA H 23.523 -0.746 7.853 1.00 . A A . 8 DPR HA 1 1
7 1808 1 1 9 DPR HB2 H 24.991 0.133 6.219 1.00 . A A . 8 DPR HB2 1 1
7 1809 1 1 9 DPR HB3 H 23.726 0.117 4.968 1.00 . A A . 8 DPR HB3 1 1
7 1810 1 1 9 DPR HD2 H 21.754 1.864 7.795 1.00 . A A . 8 DPR HD2 1 1
7 1811 1 1 9 DPR HD3 H 21.326 1.857 6.069 1.00 . A A . 8 DPR HD3 1 1
7 1812 1 1 9 DPR HG2 H 24.016 1.926 7.327 1.00 . A A . 8 DPR HG2 1 1
7 1813 1 1 9 DPR HG3 H 23.551 2.317 5.661 1.00 . A A . 8 DPR HG3 1 1
7 1814 1 1 9 DPR N N 21.777 -0.042 6.870 1.00 . A A . 8 DPR N 1 1
7 1815 1 1 9 DPR O O 22.562 -3.089 6.812 1.00 . A A . 8 DPR O 1 1
7 1816 1 1 10 VAL C C 20.613 -0.672 6.903 1.00 . A A . 9 VAL C 1 1
7 1817 1 1 10 VAL CA C 19.328 0.195 6.993 1.00 . A A . 9 VAL CA 1 1
7 1818 1 1 10 VAL CB C 18.224 -0.578 7.773 1.00 . A A . 9 VAL CB 1 1
7 1819 1 1 10 VAL CG1 C 17.067 0.362 8.139 1.00 . A A . 9 VAL CG1 1 1
7 1820 1 1 10 VAL CG2 C 17.637 -1.721 6.934 1.00 . A A . 9 VAL CG2 1 1
7 1821 1 1 10 VAL H H 19.076 0.164 4.868 1.00 . A A . 9 VAL H 1 1
7 1822 1 1 10 VAL HA H 19.566 1.075 7.573 1.00 . A A . 9 VAL HA 1 1
7 1823 1 1 10 VAL HB H 18.648 -0.992 8.668 1.00 . A A . 9 VAL HB 1 1
7 1824 1 1 10 VAL HG11 H 16.446 -0.114 8.884 1.00 . A A . 9 VAL HG11 1 1
7 1825 1 1 10 VAL HG12 H 16.473 0.572 7.264 1.00 . A A . 9 VAL HG12 1 1
7 1826 1 1 10 VAL HG13 H 17.460 1.283 8.543 1.00 . A A . 9 VAL HG13 1 1
7 1827 1 1 10 VAL HG21 H 18.346 -2.527 6.862 1.00 . A A . 9 VAL HG21 1 1
7 1828 1 1 10 VAL HG22 H 17.392 -1.357 5.956 1.00 . A A . 9 VAL HG22 1 1
7 1829 1 1 10 VAL HG23 H 16.737 -2.088 7.408 1.00 . A A . 9 VAL HG23 1 1
7 1830 1 1 10 VAL N N 18.825 0.651 5.682 1.00 . A A . 9 VAL N 1 1
7 1831 1 1 10 VAL O O 20.552 -1.897 6.941 1.00 . A A . 9 VAL O 1 1
7 1832 1 1 11 GLN C C 18.041 1.736 5.574 1.00 . A A . 10 GLN C 1 1
7 1833 1 1 11 GLN CA C 17.580 2.112 4.164 1.00 . A A . 10 GLN CA 1 1
7 1834 1 1 11 GLN CB C 18.437 3.277 3.643 1.00 . A A . 10 GLN CB 1 1
7 1835 1 1 11 GLN CD C 18.905 4.787 1.702 1.00 . A A . 10 GLN CD 1 1
7 1836 1 1 11 GLN CG C 18.015 3.660 2.217 1.00 . A A . 10 GLN CG 1 1
7 1837 1 1 11 GLN H H 15.785 2.939 4.951 1.00 . A A . 10 GLN H 1 1
7 1838 1 1 11 GLN HA H 17.718 1.260 3.519 1.00 . A A . 10 GLN HA 1 1
7 1839 1 1 11 GLN HB2 H 18.312 4.130 4.293 1.00 . A A . 10 GLN HB2 1 1
7 1840 1 1 11 GLN HB3 H 19.476 2.981 3.639 1.00 . A A . 10 GLN HB3 1 1
7 1841 1 1 11 GLN HE21 H 17.400 6.055 1.436 1.00 . A A . 10 GLN HE21 1 1
7 1842 1 1 11 GLN HE22 H 18.935 6.655 1.029 1.00 . A A . 10 GLN HE22 1 1
7 1843 1 1 11 GLN HG2 H 18.099 2.804 1.565 1.00 . A A . 10 GLN HG2 1 1
7 1844 1 1 11 GLN HG3 H 16.992 4.001 2.220 1.00 . A A . 10 GLN HG3 1 1
7 1845 1 1 11 GLN N N 16.162 2.486 4.168 1.00 . A A . 10 GLN N 1 1
7 1846 1 1 11 GLN NE2 N 18.369 5.927 1.361 1.00 . A A . 10 GLN NE2 1 1
7 1847 1 1 11 GLN O O 17.701 2.418 6.539 1.00 . A A . 10 GLN O 1 1
7 1848 1 1 11 GLN OE1 O 20.122 4.626 1.611 1.00 . A A . 10 GLN OE1 1 1
7 1849 1 1 12 LYS C C 15.379 2.229 3.118 1.00 . A A . 11 LYS C 1 1
7 1850 1 1 12 LYS CA C 13.922 2.673 3.222 1.00 . A A . 11 LYS CA 1 1
7 1851 1 1 12 LYS CB C 13.031 1.488 3.616 1.00 . A A . 11 LYS CB 1 1
7 1852 1 1 12 LYS CD C 13.526 1.793 6.135 1.00 . A A . 11 LYS CD 1 1
7 1853 1 1 12 LYS CE C 12.141 2.399 6.405 1.00 . A A . 11 LYS CE 1 1
7 1854 1 1 12 LYS CG C 13.499 0.826 4.928 1.00 . A A . 11 LYS CG 1 1
7 1855 1 1 12 LYS H H 13.101 2.582 1.271 1.00 . A A . 11 LYS H 1 1
7 1856 1 1 12 LYS HA H 13.834 3.446 3.967 1.00 . A A . 11 LYS HA 1 1
7 1857 1 1 12 LYS HB2 H 12.012 1.820 3.718 1.00 . A A . 11 LYS HB2 1 1
7 1858 1 1 12 LYS HB3 H 13.071 0.754 2.827 1.00 . A A . 11 LYS HB3 1 1
7 1859 1 1 12 LYS HD2 H 13.833 1.239 7.010 1.00 . A A . 11 LYS HD2 1 1
7 1860 1 1 12 LYS HD3 H 14.238 2.581 5.960 1.00 . A A . 11 LYS HD3 1 1
7 1861 1 1 12 LYS HE2 H 12.198 3.020 7.287 1.00 . A A . 11 LYS HE2 1 1
7 1862 1 1 12 LYS HE3 H 11.828 3.003 5.571 1.00 . A A . 11 LYS HE3 1 1
7 1863 1 1 12 LYS HG2 H 12.834 0.010 5.155 1.00 . A A . 11 LYS HG2 1 1
7 1864 1 1 12 LYS HG3 H 14.491 0.431 4.775 1.00 . A A . 11 LYS HG3 1 1
7 1865 1 1 12 LYS HZ1 H 11.575 0.590 7.267 1.00 . A A . 11 LYS HZ1 1 1
7 1866 1 1 12 LYS HZ2 H 10.894 0.872 5.735 1.00 . A A . 11 LYS HZ2 1 1
7 1867 1 1 12 LYS HZ3 H 10.306 1.701 7.095 1.00 . A A . 11 LYS HZ3 1 1
7 1868 1 1 12 LYS N N 13.468 3.202 1.939 1.00 . A A . 11 LYS N 1 1
7 1869 1 1 12 LYS NZ N 11.155 1.308 6.643 1.00 . A A . 11 LYS NZ 1 1
7 1870 1 1 12 LYS O O 15.795 1.679 2.101 1.00 . A A . 11 LYS O 1 1
7 1871 1 1 13 PHE C C 13.550 4.499 1.650 1.00 . A A . 12 PHE C 1 1
7 1872 1 1 13 PHE CA C 13.051 4.917 0.270 1.00 . A A . 12 PHE CA 1 1
7 1873 1 1 13 PHE CB C 13.738 6.235 -0.122 1.00 . A A . 12 PHE CB 1 1
7 1874 1 1 13 PHE CD1 C 12.509 5.975 -2.379 1.00 . A A . 12 PHE CD1 1 1
7 1875 1 1 13 PHE CD2 C 13.909 7.921 -1.977 1.00 . A A . 12 PHE CD2 1 1
7 1876 1 1 13 PHE CE1 C 12.216 6.463 -3.657 1.00 . A A . 12 PHE CE1 1 1
7 1877 1 1 13 PHE CE2 C 13.608 8.400 -3.256 1.00 . A A . 12 PHE CE2 1 1
7 1878 1 1 13 PHE CG C 13.365 6.710 -1.525 1.00 . A A . 12 PHE CG 1 1
7 1879 1 1 13 PHE CZ C 12.763 7.670 -4.095 1.00 . A A . 12 PHE CZ 1 1
7 1880 1 1 13 PHE H H 11.218 5.982 0.328 1.00 . A A . 12 PHE H 1 1
7 1881 1 1 13 PHE HA H 13.321 4.147 -0.439 1.00 . A A . 12 PHE HA 1 1
7 1882 1 1 13 PHE HB2 H 13.452 6.998 0.585 1.00 . A A . 12 PHE HB2 1 1
7 1883 1 1 13 PHE HB3 H 14.810 6.100 -0.070 1.00 . A A . 12 PHE HB3 1 1
7 1884 1 1 13 PHE HD1 H 12.073 5.045 -2.063 1.00 . A A . 12 PHE HD1 1 1
7 1885 1 1 13 PHE HD2 H 14.563 8.489 -1.332 1.00 . A A . 12 PHE HD2 1 1
7 1886 1 1 13 PHE HE1 H 11.570 5.903 -4.310 1.00 . A A . 12 PHE HE1 1 1
7 1887 1 1 13 PHE HE2 H 14.031 9.334 -3.595 1.00 . A A . 12 PHE HE2 1 1
7 1888 1 1 13 PHE HZ H 12.530 8.040 -5.081 1.00 . A A . 12 PHE HZ 1 1
7 1889 1 1 13 PHE N N 11.598 5.081 0.284 1.00 . A A . 12 PHE N 1 1
7 1890 1 1 13 PHE O O 14.006 5.332 2.433 1.00 . A A . 12 PHE O 1 1
7 1891 1 1 14 ILE C C 10.781 4.030 0.259 1.00 . A A . 13 ILE C 1 1
7 1892 1 1 14 ILE CA C 9.286 4.338 0.302 1.00 . A A . 13 ILE CA 1 1
7 1893 1 1 14 ILE CB C 8.590 3.310 1.200 1.00 . A A . 13 ILE CB 1 1
7 1894 1 1 14 ILE CD1 C 6.829 5.025 1.854 1.00 . A A . 13 ILE CD1 1 1
7 1895 1 1 14 ILE CG1 C 7.082 3.618 1.283 1.00 . A A . 13 ILE CG1 1 1
7 1896 1 1 14 ILE CG2 C 9.214 3.335 2.599 1.00 . A A . 13 ILE CG2 1 1
7 1897 1 1 14 ILE H H 8.771 3.482 -1.589 1.00 . A A . 13 ILE H 1 1
7 1898 1 1 14 ILE HA H 9.150 5.321 0.732 1.00 . A A . 13 ILE HA 1 1
7 1899 1 1 14 ILE HB H 8.726 2.326 0.774 1.00 . A A . 13 ILE HB 1 1
7 1900 1 1 14 ILE HD11 H 7.577 5.271 2.591 1.00 . A A . 13 ILE HD11 1 1
7 1901 1 1 14 ILE HD12 H 5.853 5.053 2.315 1.00 . A A . 13 ILE HD12 1 1
7 1902 1 1 14 ILE HD13 H 6.863 5.748 1.053 1.00 . A A . 13 ILE HD13 1 1
7 1903 1 1 14 ILE HG12 H 6.653 3.556 0.294 1.00 . A A . 13 ILE HG12 1 1
7 1904 1 1 14 ILE HG13 H 6.607 2.887 1.922 1.00 . A A . 13 ILE HG13 1 1
7 1905 1 1 14 ILE HG21 H 10.180 2.854 2.572 1.00 . A A . 13 ILE HG21 1 1
7 1906 1 1 14 ILE HG22 H 8.570 2.809 3.290 1.00 . A A . 13 ILE HG22 1 1
7 1907 1 1 14 ILE HG23 H 9.329 4.359 2.924 1.00 . A A . 13 ILE HG23 1 1
7 1908 1 1 14 ILE N N 8.693 4.302 -1.043 1.00 . A A . 13 ILE N 1 1
7 1909 1 1 14 ILE O O 11.183 2.868 0.224 1.00 . A A . 13 ILE O 1 1
7 1910 1 1 15 ARG C C 8.041 5.345 -1.549 1.00 . A A . 14 ARG C 1 1
7 1911 1 1 15 ARG CA C 7.477 5.143 -2.942 1.00 . A A . 14 ARG CA 1 1
7 1912 1 1 15 ARG CB C 8.346 5.853 -3.971 1.00 . A A . 14 ARG CB 1 1
7 1913 1 1 15 ARG CD C 8.638 6.220 -6.430 1.00 . A A . 14 ARG CD 1 1
7 1914 1 1 15 ARG CG C 7.821 5.500 -5.355 1.00 . A A . 14 ARG CG 1 1
7 1915 1 1 15 ARG CZ C 10.927 6.311 -7.229 1.00 . A A . 14 ARG CZ 1 1
7 1916 1 1 15 ARG H H 5.898 6.385 -3.613 1.00 . A A . 14 ARG H 1 1
7 1917 1 1 15 ARG HA H 7.484 4.085 -3.164 1.00 . A A . 14 ARG HA 1 1
7 1918 1 1 15 ARG HB2 H 8.294 6.922 -3.820 1.00 . A A . 14 ARG HB2 1 1
7 1919 1 1 15 ARG HB3 H 9.363 5.519 -3.877 1.00 . A A . 14 ARG HB3 1 1
7 1920 1 1 15 ARG HD2 H 8.229 5.988 -7.401 1.00 . A A . 14 ARG HD2 1 1
7 1921 1 1 15 ARG HD3 H 8.577 7.287 -6.266 1.00 . A A . 14 ARG HD3 1 1
7 1922 1 1 15 ARG HE H 10.318 5.139 -5.721 1.00 . A A . 14 ARG HE 1 1
7 1923 1 1 15 ARG HG2 H 7.904 4.432 -5.489 1.00 . A A . 14 ARG HG2 1 1
7 1924 1 1 15 ARG HG3 H 6.786 5.792 -5.430 1.00 . A A . 14 ARG HG3 1 1
7 1925 1 1 15 ARG HH11 H 9.593 7.463 -8.178 1.00 . A A . 14 ARG HH11 1 1
7 1926 1 1 15 ARG HH12 H 11.222 7.565 -8.760 1.00 . A A . 14 ARG HH12 1 1
7 1927 1 1 15 ARG HH21 H 12.464 5.267 -6.483 1.00 . A A . 14 ARG HH21 1 1
7 1928 1 1 15 ARG HH22 H 12.845 6.322 -7.802 1.00 . A A . 14 ARG HH22 1 1
7 1929 1 1 15 ARG N N 6.106 5.622 -3.033 1.00 . A A . 14 ARG N 1 1
7 1930 1 1 15 ARG NE N 10.033 5.801 -6.385 1.00 . A A . 14 ARG NE 1 1
7 1931 1 1 15 ARG NH1 N 10.551 7.181 -8.125 1.00 . A A . 14 ARG NH1 1 1
7 1932 1 1 15 ARG NH2 N 12.175 5.937 -7.166 1.00 . A A . 14 ARG NH2 1 1
7 1933 1 1 15 ARG O O 7.885 6.405 -0.947 1.00 . A A . 14 ARG O 1 1
7 1934 1 1 16 ACE C C 5.132 5.046 -2.342 1.00 . A A . 15 ACE C 1 1
7 1935 1 1 16 ACE CH3 C 3.738 5.638 -2.520 1.00 . A A . 15 ACE CH3 1 1
7 1936 1 1 16 ACE H1 H 3.105 5.321 -1.704 1.00 . A A . 15 ACE H1 1 1
7 1937 1 1 16 ACE H2 H 3.318 5.297 -3.455 1.00 . A A . 15 ACE H2 1 1
7 1938 1 1 16 ACE H3 H 3.804 6.716 -2.527 1.00 . A A . 15 ACE H3 1 1
7 1939 1 1 16 ACE O O 5.321 4.086 -1.595 1.00 . A A . 15 ACE O 1 1
8 1940 1 1 1 ACE C C 4.178 2.439 -4.450 1.00 . A A . 0 ACE C 1 1
8 1941 1 1 1 ACE CH3 C 4.269 3.787 -5.156 1.00 . A A . 0 ACE CH3 1 1
8 1942 1 1 1 ACE H1 H 3.300 4.050 -5.559 1.00 . A A . 0 ACE H1 1 1
8 1943 1 1 1 ACE H2 H 4.987 3.725 -5.960 1.00 . A A . 0 ACE H2 1 1
8 1944 1 1 1 ACE H3 H 4.582 4.542 -4.451 1.00 . A A . 0 ACE H3 1 1
8 1945 1 1 1 ACE O O 3.085 1.929 -4.205 1.00 . A A . 0 ACE O 1 1
8 1946 1 1 2 GLU C C 6.651 0.420 -2.619 1.00 . A A . 1 GLU C 1 1
8 1947 1 1 2 GLU CA C 5.374 0.570 -3.454 1.00 . A A . 1 GLU CA 1 1
8 1948 1 1 2 GLU CB C 5.265 -0.596 -4.456 1.00 . A A . 1 GLU CB 1 1
8 1949 1 1 2 GLU CD C 6.427 0.562 -6.427 1.00 . A A . 1 GLU CD 1 1
8 1950 1 1 2 GLU CG C 6.432 -0.635 -5.469 1.00 . A A . 1 GLU CG 1 1
8 1951 1 1 2 GLU H H 6.174 2.312 -4.351 1.00 . A A . 1 GLU H 1 1
8 1952 1 1 2 GLU HA H 4.530 0.511 -2.779 1.00 . A A . 1 GLU HA 1 1
8 1953 1 1 2 GLU HB2 H 5.240 -1.527 -3.916 1.00 . A A . 1 GLU HB2 1 1
8 1954 1 1 2 GLU HB3 H 4.340 -0.487 -5.001 1.00 . A A . 1 GLU HB3 1 1
8 1955 1 1 2 GLU HG2 H 7.363 -0.639 -4.925 1.00 . A A . 1 GLU HG2 1 1
8 1956 1 1 2 GLU HG3 H 6.361 -1.546 -6.045 1.00 . A A . 1 GLU HG3 1 1
8 1957 1 1 2 GLU N N 5.334 1.861 -4.128 1.00 . A A . 1 GLU N 1 1
8 1958 1 1 2 GLU O O 7.208 1.412 -2.118 1.00 . A A . 1 GLU O 1 1
8 1959 1 1 2 GLU OE1 O 6.541 1.681 -5.975 1.00 . A A . 1 GLU OE1 1 1
8 1960 1 1 2 GLU OE2 O 6.309 0.328 -7.618 1.00 . A A . 1 GLU OE2 1 1
8 1961 1 1 3 ARG C C 9.409 -0.198 -2.113 1.00 . A A . 2 ARG C 1 1
8 1962 1 1 3 ARG CA C 8.291 -1.098 -1.657 1.00 . A A . 2 ARG CA 1 1
8 1963 1 1 3 ARG CB C 8.791 -2.517 -1.872 1.00 . A A . 2 ARG CB 1 1
8 1964 1 1 3 ARG CD C 8.306 -4.915 -1.801 1.00 . A A . 2 ARG CD 1 1
8 1965 1 1 3 ARG CG C 7.708 -3.536 -1.569 1.00 . A A . 2 ARG CG 1 1
8 1966 1 1 3 ARG CZ C 9.376 -6.099 -3.632 1.00 . A A . 2 ARG CZ 1 1
8 1967 1 1 3 ARG H H 6.616 -1.574 -2.855 1.00 . A A . 2 ARG H 1 1
8 1968 1 1 3 ARG HA H 8.086 -0.938 -0.613 1.00 . A A . 2 ARG HA 1 1
8 1969 1 1 3 ARG HB2 H 9.104 -2.628 -2.899 1.00 . A A . 2 ARG HB2 1 1
8 1970 1 1 3 ARG HB3 H 9.637 -2.695 -1.223 1.00 . A A . 2 ARG HB3 1 1
8 1971 1 1 3 ARG HD2 H 9.105 -5.089 -1.094 1.00 . A A . 2 ARG HD2 1 1
8 1972 1 1 3 ARG HD3 H 7.541 -5.668 -1.672 1.00 . A A . 2 ARG HD3 1 1
8 1973 1 1 3 ARG HE H 8.856 -4.157 -3.707 1.00 . A A . 2 ARG HE 1 1
8 1974 1 1 3 ARG HG2 H 7.391 -3.438 -0.539 1.00 . A A . 2 ARG HG2 1 1
8 1975 1 1 3 ARG HG3 H 6.868 -3.388 -2.228 1.00 . A A . 2 ARG HG3 1 1
8 1976 1 1 3 ARG HH11 H 8.915 -7.186 -2.016 1.00 . A A . 2 ARG HH11 1 1
8 1977 1 1 3 ARG HH12 H 9.753 -8.033 -3.273 1.00 . A A . 2 ARG HH12 1 1
8 1978 1 1 3 ARG HH21 H 9.958 -5.269 -5.359 1.00 . A A . 2 ARG HH21 1 1
8 1979 1 1 3 ARG HH22 H 10.344 -6.947 -5.167 1.00 . A A . 2 ARG HH22 1 1
8 1980 1 1 3 ARG N N 7.101 -0.827 -2.452 1.00 . A A . 2 ARG N 1 1
8 1981 1 1 3 ARG NE N 8.834 -4.981 -3.160 1.00 . A A . 2 ARG NE 1 1
8 1982 1 1 3 ARG NH1 N 9.347 -7.191 -2.918 1.00 . A A . 2 ARG NH1 1 1
8 1983 1 1 3 ARG NH2 N 9.937 -6.105 -4.811 1.00 . A A . 2 ARG NH2 1 1
8 1984 1 1 3 ARG O O 9.457 0.193 -3.278 1.00 . A A . 2 ARG O 1 1
8 1985 1 1 4 PHE C C 12.463 1.066 -0.418 1.00 . A A . 3 PHE C 1 1
8 1986 1 1 4 PHE CA C 11.441 0.931 -1.563 1.00 . A A . 3 PHE CA 1 1
8 1987 1 1 4 PHE CB C 10.938 2.315 -1.986 1.00 . A A . 3 PHE CB 1 1
8 1988 1 1 4 PHE CD1 C 13.051 3.016 -3.187 1.00 . A A . 3 PHE CD1 1 1
8 1989 1 1 4 PHE CD2 C 12.302 4.273 -1.263 1.00 . A A . 3 PHE CD2 1 1
8 1990 1 1 4 PHE CE1 C 14.166 3.857 -3.294 1.00 . A A . 3 PHE CE1 1 1
8 1991 1 1 4 PHE CE2 C 13.397 5.107 -1.365 1.00 . A A . 3 PHE CE2 1 1
8 1992 1 1 4 PHE CG C 12.117 3.233 -2.171 1.00 . A A . 3 PHE CG 1 1
8 1993 1 1 4 PHE CZ C 14.340 4.908 -2.382 1.00 . A A . 3 PHE CZ 1 1
8 1994 1 1 4 PHE H H 10.243 -0.262 -0.303 1.00 . A A . 3 PHE H 1 1
8 1995 1 1 4 PHE HA H 11.921 0.462 -2.415 1.00 . A A . 3 PHE HA 1 1
8 1996 1 1 4 PHE HB2 H 10.414 2.230 -2.925 1.00 . A A . 3 PHE HB2 1 1
8 1997 1 1 4 PHE HB3 H 10.266 2.710 -1.247 1.00 . A A . 3 PHE HB3 1 1
8 1998 1 1 4 PHE HD1 H 12.908 2.211 -3.893 1.00 . A A . 3 PHE HD1 1 1
8 1999 1 1 4 PHE HD2 H 11.589 4.431 -0.476 1.00 . A A . 3 PHE HD2 1 1
8 2000 1 1 4 PHE HE1 H 14.891 3.695 -4.076 1.00 . A A . 3 PHE HE1 1 1
8 2001 1 1 4 PHE HE2 H 13.515 5.900 -0.650 1.00 . A A . 3 PHE HE2 1 1
8 2002 1 1 4 PHE HZ H 15.198 5.558 -2.461 1.00 . A A . 3 PHE HZ 1 1
8 2003 1 1 4 PHE N N 10.318 0.099 -1.211 1.00 . A A . 3 PHE N 1 1
8 2004 1 1 4 PHE O O 12.367 1.972 0.426 1.00 . A A . 3 PHE O 1 1
8 2005 1 1 5 TYR C C 15.771 -0.370 0.090 1.00 . A A . 4 TYR C 1 1
8 2006 1 1 5 TYR CA C 14.504 0.277 0.614 1.00 . A A . 4 TYR CA 1 1
8 2007 1 1 5 TYR CB C 14.042 -0.437 1.900 1.00 . A A . 4 TYR CB 1 1
8 2008 1 1 5 TYR CD1 C 15.052 -2.717 1.510 1.00 . A A . 4 TYR CD1 1 1
8 2009 1 1 5 TYR CD2 C 12.640 -2.515 1.614 1.00 . A A . 4 TYR CD2 1 1
8 2010 1 1 5 TYR CE1 C 14.936 -4.085 1.278 1.00 . A A . 4 TYR CE1 1 1
8 2011 1 1 5 TYR CE2 C 12.521 -3.890 1.385 1.00 . A A . 4 TYR CE2 1 1
8 2012 1 1 5 TYR CG C 13.905 -1.928 1.683 1.00 . A A . 4 TYR CG 1 1
8 2013 1 1 5 TYR CZ C 13.669 -4.677 1.218 1.00 . A A . 4 TYR CZ 1 1
8 2014 1 1 5 TYR H H 13.531 -0.485 -1.113 1.00 . A A . 4 TYR H 1 1
8 2015 1 1 5 TYR HA H 14.709 1.308 0.839 1.00 . A A . 4 TYR HA 1 1
8 2016 1 1 5 TYR HB2 H 14.766 -0.265 2.680 1.00 . A A . 4 TYR HB2 1 1
8 2017 1 1 5 TYR HB3 H 13.089 -0.036 2.206 1.00 . A A . 4 TYR HB3 1 1
8 2018 1 1 5 TYR HD1 H 16.030 -2.274 1.583 1.00 . A A . 4 TYR HD1 1 1
8 2019 1 1 5 TYR HD2 H 11.755 -1.908 1.742 1.00 . A A . 4 TYR HD2 1 1
8 2020 1 1 5 TYR HE1 H 15.828 -4.680 1.147 1.00 . A A . 4 TYR HE1 1 1
8 2021 1 1 5 TYR HE2 H 11.545 -4.343 1.339 1.00 . A A . 4 TYR HE2 1 1
8 2022 1 1 5 TYR HH H 14.338 -6.324 0.518 1.00 . A A . 4 TYR HH 1 1
8 2023 1 1 5 TYR N N 13.470 0.197 -0.411 1.00 . A A . 4 TYR N 1 1
8 2024 1 1 5 TYR O O 15.727 -1.158 -0.856 1.00 . A A . 4 TYR O 1 1
8 2025 1 1 5 TYR OH O 13.552 -6.033 0.987 1.00 . A A . 4 TYR OH 1 1
8 2026 1 1 6 GLU C C 18.760 -1.341 1.614 1.00 . A A . 5 GLU C 1 1
8 2027 1 1 6 GLU CA C 18.169 -0.700 0.373 1.00 . A A . 5 GLU CA 1 1
8 2028 1 1 6 GLU CB C 19.139 0.351 -0.179 1.00 . A A . 5 GLU CB 1 1
8 2029 1 1 6 GLU CD C 20.376 -1.345 -1.635 1.00 . A A . 5 GLU CD 1 1
8 2030 1 1 6 GLU CG C 20.502 -0.271 -0.549 1.00 . A A . 5 GLU CG 1 1
8 2031 1 1 6 GLU H H 16.855 0.519 1.515 1.00 . A A . 5 GLU H 1 1
8 2032 1 1 6 GLU HA H 17.997 -1.460 -0.370 1.00 . A A . 5 GLU HA 1 1
8 2033 1 1 6 GLU HB2 H 18.708 0.809 -1.056 1.00 . A A . 5 GLU HB2 1 1
8 2034 1 1 6 GLU HB3 H 19.297 1.107 0.573 1.00 . A A . 5 GLU HB3 1 1
8 2035 1 1 6 GLU HG2 H 21.156 0.509 -0.907 1.00 . A A . 5 GLU HG2 1 1
8 2036 1 1 6 GLU HG3 H 20.938 -0.714 0.335 1.00 . A A . 5 GLU HG3 1 1
8 2037 1 1 6 GLU N N 16.892 -0.086 0.742 1.00 . A A . 5 GLU N 1 1
8 2038 1 1 6 GLU O O 19.167 -0.640 2.540 1.00 . A A . 5 GLU O 1 1
8 2039 1 1 6 GLU OE1 O 19.730 -2.350 -1.395 1.00 . A A . 5 GLU OE1 1 1
8 2040 1 1 6 GLU OE2 O 20.932 -1.139 -2.700 1.00 . A A . 5 GLU OE2 1 1
8 2041 1 1 7 LYS C C 20.673 -3.998 2.439 1.00 . A A . 6 LYS C 1 1
8 2042 1 1 7 LYS CA C 19.339 -3.380 2.804 1.00 . A A . 6 LYS CA 1 1
8 2043 1 1 7 LYS CB C 18.362 -4.458 3.282 1.00 . A A . 6 LYS CB 1 1
8 2044 1 1 7 LYS CD C 17.940 -6.190 5.040 1.00 . A A . 6 LYS CD 1 1
8 2045 1 1 7 LYS CE C 18.505 -6.854 6.299 1.00 . A A . 6 LYS CE 1 1
8 2046 1 1 7 LYS CG C 18.911 -5.113 4.553 1.00 . A A . 6 LYS CG 1 1
8 2047 1 1 7 LYS H H 18.455 -3.185 0.882 1.00 . A A . 6 LYS H 1 1
8 2048 1 1 7 LYS HA H 19.505 -2.687 3.603 1.00 . A A . 6 LYS HA 1 1
8 2049 1 1 7 LYS HB2 H 17.402 -4.006 3.492 1.00 . A A . 6 LYS HB2 1 1
8 2050 1 1 7 LYS HB3 H 18.247 -5.207 2.512 1.00 . A A . 6 LYS HB3 1 1
8 2051 1 1 7 LYS HD2 H 16.986 -5.738 5.269 1.00 . A A . 6 LYS HD2 1 1
8 2052 1 1 7 LYS HD3 H 17.811 -6.936 4.270 1.00 . A A . 6 LYS HD3 1 1
8 2053 1 1 7 LYS HE2 H 17.825 -7.623 6.636 1.00 . A A . 6 LYS HE2 1 1
8 2054 1 1 7 LYS HE3 H 19.464 -7.298 6.072 1.00 . A A . 6 LYS HE3 1 1
8 2055 1 1 7 LYS HG2 H 19.873 -5.557 4.350 1.00 . A A . 6 LYS HG2 1 1
8 2056 1 1 7 LYS HG3 H 19.016 -4.356 5.324 1.00 . A A . 6 LYS HG3 1 1
8 2057 1 1 7 LYS HZ1 H 18.081 -5.004 7.152 1.00 . A A . 6 LYS HZ1 1 1
8 2058 1 1 7 LYS HZ2 H 19.670 -5.542 7.420 1.00 . A A . 6 LYS HZ2 1 1
8 2059 1 1 7 LYS HZ3 H 18.378 -6.233 8.282 1.00 . A A . 6 LYS HZ3 1 1
8 2060 1 1 7 LYS N N 18.801 -2.673 1.643 1.00 . A A . 6 LYS N 1 1
8 2061 1 1 7 LYS NZ N 18.671 -5.832 7.369 1.00 . A A . 6 LYS NZ 1 1
8 2062 1 1 7 LYS O O 20.745 -4.978 1.699 1.00 . A A . 6 LYS O 1 1
8 2063 1 1 8 . CAA C 25.260 -3.395 1.560 1.00 . A A . 7 4G6 CAA 1 1
8 2064 1 1 8 . CAB C 23.163 -2.486 0.586 1.00 . A A . 7 4G6 CAB 1 1
8 2065 1 1 8 . CAE C 23.067 -3.911 2.605 1.00 . A A . 7 4G6 CAE 1 1
8 2066 1 1 8 . CAF C 23.879 -2.826 1.894 1.00 . A A . 7 4G6 CAF 1 1
8 2067 1 1 8 . HAA H 25.144 -4.348 1.047 1.00 . A A . 7 4G6 HAA 1 1
8 2068 1 1 8 . HAB H 25.824 -3.544 2.481 1.00 . A A . 7 4G6 HAB 1 1
8 2069 1 1 8 . HAC H 25.794 -2.697 0.915 1.00 . A A . 7 4G6 HAC 1 1
8 2070 1 1 8 . HAD H 23.191 -1.409 0.422 1.00 . A A . 7 4G6 HAD 1 1
8 2071 1 1 8 . HAE H 22.125 -2.817 0.643 1.00 . A A . 7 4G6 HAE 1 1
8 2072 1 1 8 . HAF H 23.658 -2.996 -0.241 1.00 . A A . 7 4G6 HAF 1 1
8 2073 1 1 8 . HAG H 22.978 -4.770 1.940 1.00 . A A . 7 4G6 HAG 1 1
8 2074 1 1 8 . HAH H 23.575 -4.219 3.517 1.00 . A A . 7 4G6 HAH 1 1
8 2075 1 1 8 . HAI H 21.620 -2.600 3.507 1.00 . A A . 7 4G6 HAI 1 1
8 2076 1 1 8 . HAL H 24.176 -0.745 2.232 1.00 . A A . 7 4G6 HAL 1 1
8 2077 1 1 8 . NAC N 21.725 -3.410 2.928 1.00 . A A . 7 4G6 NAC 1 1
8 2078 1 1 8 . NAD N 24.017 -1.609 2.710 1.00 . A A . 7 4G6 NAD 1 1
8 2079 1 1 9 DPR C C 23.963 -1.588 4.033 1.00 . A A . 8 DPR C 1 1
8 2080 1 1 9 DPR CA C 24.147 -0.247 4.766 1.00 . A A . 8 DPR CA 1 1
8 2081 1 1 9 DPR CB C 24.728 0.844 3.871 1.00 . A A . 8 DPR CB 1 1
8 2082 1 1 9 DPR CD C 23.078 1.843 5.377 1.00 . A A . 8 DPR CD 1 1
8 2083 1 1 9 DPR CG C 24.376 2.122 4.584 1.00 . A A . 8 DPR CG 1 1
8 2084 1 1 9 DPR HA H 24.802 -0.386 5.610 1.00 . A A . 8 DPR HA 1 1
8 2085 1 1 9 DPR HB2 H 25.801 0.730 3.785 1.00 . A A . 8 DPR HB2 1 1
8 2086 1 1 9 DPR HB3 H 24.263 0.825 2.899 1.00 . A A . 8 DPR HB3 1 1
8 2087 1 1 9 DPR HD2 H 23.206 2.097 6.423 1.00 . A A . 8 DPR HD2 1 1
8 2088 1 1 9 DPR HD3 H 22.245 2.382 4.954 1.00 . A A . 8 DPR HD3 1 1
8 2089 1 1 9 DPR HG2 H 25.177 2.401 5.259 1.00 . A A . 8 DPR HG2 1 1
8 2090 1 1 9 DPR HG3 H 24.205 2.915 3.868 1.00 . A A . 8 DPR HG3 1 1
8 2091 1 1 9 DPR N N 22.878 0.391 5.217 1.00 . A A . 8 DPR N 1 1
8 2092 1 1 9 DPR O O 23.794 -2.600 4.709 1.00 . A A . 8 DPR O 1 1
8 2093 1 1 10 VAL C C 21.753 -0.264 5.417 1.00 . A A . 9 VAL C 1 1
8 2094 1 1 10 VAL CA C 20.538 0.541 5.919 1.00 . A A . 9 VAL CA 1 1
8 2095 1 1 10 VAL CB C 19.613 -0.357 6.768 1.00 . A A . 9 VAL CB 1 1
8 2096 1 1 10 VAL CG1 C 18.988 -1.462 5.922 1.00 . A A . 9 VAL CG1 1 1
8 2097 1 1 10 VAL CG2 C 20.428 -0.978 7.910 1.00 . A A . 9 VAL CG2 1 1
8 2098 1 1 10 VAL H H 20.053 0.925 3.887 1.00 . A A . 9 VAL H 1 1
8 2099 1 1 10 VAL HA H 20.891 1.339 6.554 1.00 . A A . 9 VAL HA 1 1
8 2100 1 1 10 VAL HB H 18.822 0.233 7.182 1.00 . A A . 9 VAL HB 1 1
8 2101 1 1 10 VAL HG11 H 19.679 -2.278 5.828 1.00 . A A . 9 VAL HG11 1 1
8 2102 1 1 10 VAL HG12 H 18.746 -1.069 4.948 1.00 . A A . 9 VAL HG12 1 1
8 2103 1 1 10 VAL HG13 H 18.083 -1.814 6.398 1.00 . A A . 9 VAL HG13 1 1
8 2104 1 1 10 VAL HG21 H 21.094 -1.727 7.509 1.00 . A A . 9 VAL HG21 1 1
8 2105 1 1 10 VAL HG22 H 19.757 -1.435 8.622 1.00 . A A . 9 VAL HG22 1 1
8 2106 1 1 10 VAL HG23 H 21.003 -0.207 8.401 1.00 . A A . 9 VAL HG23 1 1
8 2107 1 1 10 VAL N N 19.793 1.136 4.806 1.00 . A A . 9 VAL N 1 1
8 2108 1 1 10 VAL O O 21.678 -1.475 5.239 1.00 . A A . 9 VAL O 1 1
8 2109 1 1 11 GLN C C 18.787 1.985 5.025 1.00 . A A . 10 GLN C 1 1
8 2110 1 1 11 GLN CA C 18.102 2.579 3.787 1.00 . A A . 10 GLN CA 1 1
8 2111 1 1 11 GLN CB C 19.103 3.493 3.069 1.00 . A A . 10 GLN CB 1 1
8 2112 1 1 11 GLN CD C 17.942 3.266 0.813 1.00 . A A . 10 GLN CD 1 1
8 2113 1 1 11 GLN CG C 18.443 4.232 1.887 1.00 . A A . 10 GLN CG 1 1
8 2114 1 1 11 GLN H H 17.054 4.051 4.903 1.00 . A A . 10 GLN H 1 1
8 2115 1 1 11 GLN HA H 17.800 1.781 3.130 1.00 . A A . 10 GLN HA 1 1
8 2116 1 1 11 GLN HB2 H 19.485 4.221 3.771 1.00 . A A . 10 GLN HB2 1 1
8 2117 1 1 11 GLN HB3 H 19.924 2.896 2.698 1.00 . A A . 10 GLN HB3 1 1
8 2118 1 1 11 GLN HE21 H 19.128 4.007 -0.598 1.00 . A A . 10 GLN HE21 1 1
8 2119 1 1 11 GLN HE22 H 18.126 2.728 -1.089 1.00 . A A . 10 GLN HE22 1 1
8 2120 1 1 11 GLN HG2 H 17.607 4.806 2.258 1.00 . A A . 10 GLN HG2 1 1
8 2121 1 1 11 GLN HG3 H 19.164 4.906 1.449 1.00 . A A . 10 GLN HG3 1 1
8 2122 1 1 11 GLN N N 16.941 3.374 4.204 1.00 . A A . 10 GLN N 1 1
8 2123 1 1 11 GLN NE2 N 18.440 3.339 -0.391 1.00 . A A . 10 GLN NE2 1 1
8 2124 1 1 11 GLN O O 18.429 2.315 6.155 1.00 . A A . 10 GLN O 1 1
8 2125 1 1 11 GLN OE1 O 17.081 2.428 1.065 1.00 . A A . 10 GLN OE1 1 1
8 2126 1 1 12 LYS C C 15.735 3.199 3.658 1.00 . A A . 11 LYS C 1 1
8 2127 1 1 12 LYS CA C 14.622 4.099 4.196 1.00 . A A . 11 LYS CA 1 1
8 2128 1 1 12 LYS CB C 14.701 4.117 5.732 1.00 . A A . 11 LYS CB 1 1
8 2129 1 1 12 LYS CD C 14.532 2.654 7.815 1.00 . A A . 11 LYS CD 1 1
8 2130 1 1 12 LYS CE C 13.514 3.575 8.508 1.00 . A A . 11 LYS CE 1 1
8 2131 1 1 12 LYS CG C 14.407 2.709 6.278 1.00 . A A . 11 LYS CG 1 1
8 2132 1 1 12 LYS H H 13.254 2.877 3.117 1.00 . A A . 11 LYS H 1 1
8 2133 1 1 12 LYS HA H 14.777 5.103 3.830 1.00 . A A . 11 LYS HA 1 1
8 2134 1 1 12 LYS HB2 H 15.693 4.422 6.035 1.00 . A A . 11 LYS HB2 1 1
8 2135 1 1 12 LYS HB3 H 13.985 4.814 6.111 1.00 . A A . 11 LYS HB3 1 1
8 2136 1 1 12 LYS HD2 H 14.367 1.640 8.145 1.00 . A A . 11 LYS HD2 1 1
8 2137 1 1 12 LYS HD3 H 15.529 2.957 8.097 1.00 . A A . 11 LYS HD3 1 1
8 2138 1 1 12 LYS HE2 H 13.707 4.600 8.248 1.00 . A A . 11 LYS HE2 1 1
8 2139 1 1 12 LYS HE3 H 12.514 3.303 8.208 1.00 . A A . 11 LYS HE3 1 1
8 2140 1 1 12 LYS HG2 H 13.403 2.428 5.999 1.00 . A A . 11 LYS HG2 1 1
8 2141 1 1 12 LYS HG3 H 15.102 2.006 5.847 1.00 . A A . 11 LYS HG3 1 1
8 2142 1 1 12 LYS HZ1 H 12.722 3.547 10.431 1.00 . A A . 11 LYS HZ1 1 1
8 2143 1 1 12 LYS HZ2 H 14.308 4.150 10.343 1.00 . A A . 11 LYS HZ2 1 1
8 2144 1 1 12 LYS HZ3 H 14.021 2.481 10.203 1.00 . A A . 11 LYS HZ3 1 1
8 2145 1 1 12 LYS N N 13.306 3.629 3.746 1.00 . A A . 11 LYS N 1 1
8 2146 1 1 12 LYS NZ N 13.652 3.427 9.983 1.00 . A A . 11 LYS NZ 1 1
8 2147 1 1 12 LYS O O 15.507 2.365 2.781 1.00 . A A . 11 LYS O 1 1
8 2148 1 1 13 PHE C C 12.167 4.186 4.157 1.00 . A A . 12 PHE C 1 1
8 2149 1 1 13 PHE CA C 10.908 3.559 3.593 1.00 . A A . 12 PHE CA 1 1
8 2150 1 1 13 PHE CB C 11.194 2.065 3.339 1.00 . A A . 12 PHE CB 1 1
8 2151 1 1 13 PHE CD1 C 9.563 1.734 1.498 1.00 . A A . 12 PHE CD1 1 1
8 2152 1 1 13 PHE CD2 C 9.281 0.438 3.522 1.00 . A A . 12 PHE CD2 1 1
8 2153 1 1 13 PHE CE1 C 8.429 1.128 0.956 1.00 . A A . 12 PHE CE1 1 1
8 2154 1 1 13 PHE CE2 C 8.147 -0.172 2.982 1.00 . A A . 12 PHE CE2 1 1
8 2155 1 1 13 PHE CG C 9.987 1.387 2.772 1.00 . A A . 12 PHE CG 1 1
8 2156 1 1 13 PHE CZ C 7.719 0.174 1.697 1.00 . A A . 12 PHE CZ 1 1
8 2157 1 1 13 PHE H H 11.166 4.675 1.797 1.00 . A A . 12 PHE H 1 1
8 2158 1 1 13 PHE HA H 10.139 3.637 4.337 1.00 . A A . 12 PHE HA 1 1
8 2159 1 1 13 PHE HB2 H 12.000 1.968 2.643 1.00 . A A . 12 PHE HB2 1 1
8 2160 1 1 13 PHE HB3 H 11.472 1.588 4.270 1.00 . A A . 12 PHE HB3 1 1
8 2161 1 1 13 PHE HD1 H 10.129 2.465 0.923 1.00 . A A . 12 PHE HD1 1 1
8 2162 1 1 13 PHE HD2 H 9.618 0.173 4.513 1.00 . A A . 12 PHE HD2 1 1
8 2163 1 1 13 PHE HE1 H 8.102 1.394 -0.029 1.00 . A A . 12 PHE HE1 1 1
8 2164 1 1 13 PHE HE2 H 7.601 -0.907 3.556 1.00 . A A . 12 PHE HE2 1 1
8 2165 1 1 13 PHE HZ H 6.840 -0.294 1.276 1.00 . A A . 12 PHE HZ 1 1
8 2166 1 1 13 PHE N N 10.484 4.293 2.388 1.00 . A A . 12 PHE N 1 1
8 2167 1 1 13 PHE O O 12.104 5.140 4.932 1.00 . A A . 12 PHE O 1 1
8 2168 1 1 14 ILE C C 9.183 4.500 2.109 1.00 . A A . 13 ILE C 1 1
8 2169 1 1 14 ILE CA C 8.884 5.339 0.852 1.00 . A A . 13 ILE CA 1 1
8 2170 1 1 14 ILE CB C 8.274 6.705 1.285 1.00 . A A . 13 ILE CB 1 1
8 2171 1 1 14 ILE CD1 C 10.594 7.623 1.705 1.00 . A A . 13 ILE CD1 1 1
8 2172 1 1 14 ILE CG1 C 9.206 7.391 2.314 1.00 . A A . 13 ILE CG1 1 1
8 2173 1 1 14 ILE CG2 C 6.855 6.530 1.897 1.00 . A A . 13 ILE CG2 1 1
8 2174 1 1 14 ILE H H 7.765 3.691 0.016 1.00 . A A . 13 ILE H 1 1
8 2175 1 1 14 ILE HA H 9.818 5.543 0.363 1.00 . A A . 13 ILE HA 1 1
8 2176 1 1 14 ILE HB H 8.205 7.347 0.420 1.00 . A A . 13 ILE HB 1 1
8 2177 1 1 14 ILE HD11 H 10.499 7.856 0.653 1.00 . A A . 13 ILE HD11 1 1
8 2178 1 1 14 ILE HD12 H 11.194 6.733 1.824 1.00 . A A . 13 ILE HD12 1 1
8 2179 1 1 14 ILE HD13 H 11.073 8.448 2.212 1.00 . A A . 13 ILE HD13 1 1
8 2180 1 1 14 ILE HG12 H 8.780 8.344 2.591 1.00 . A A . 13 ILE HG12 1 1
8 2181 1 1 14 ILE HG13 H 9.298 6.778 3.198 1.00 . A A . 13 ILE HG13 1 1
8 2182 1 1 14 ILE HG21 H 6.785 7.063 2.837 1.00 . A A . 13 ILE HG21 1 1
8 2183 1 1 14 ILE HG22 H 6.649 5.488 2.070 1.00 . A A . 13 ILE HG22 1 1
8 2184 1 1 14 ILE HG23 H 6.115 6.929 1.214 1.00 . A A . 13 ILE HG23 1 1
8 2185 1 1 14 ILE N N 8.014 4.633 -0.126 1.00 . A A . 13 ILE N 1 1
8 2186 1 1 14 ILE O O 8.276 4.089 2.833 1.00 . A A . 13 ILE O 1 1
8 2187 1 1 15 ARG C C 7.581 5.231 -1.232 1.00 . A A . 14 ARG C 1 1
8 2188 1 1 15 ARG CA C 6.725 4.374 -2.144 1.00 . A A . 14 ARG CA 1 1
8 2189 1 1 15 ARG CB C 5.819 3.471 -1.297 1.00 . A A . 14 ARG CB 1 1
8 2190 1 1 15 ARG CD C 4.017 3.389 0.402 1.00 . A A . 14 ARG CD 1 1
8 2191 1 1 15 ARG CG C 4.877 4.318 -0.448 1.00 . A A . 14 ARG CG 1 1
8 2192 1 1 15 ARG CZ C 4.367 1.701 2.114 1.00 . A A . 14 ARG CZ 1 1
8 2193 1 1 15 ARG H H 8.143 2.862 -2.603 1.00 . A A . 14 ARG H 1 1
8 2194 1 1 15 ARG HA H 6.114 5.018 -2.739 1.00 . A A . 14 ARG HA 1 1
8 2195 1 1 15 ARG HB2 H 5.240 2.832 -1.944 1.00 . A A . 14 ARG HB2 1 1
8 2196 1 1 15 ARG HB3 H 6.419 2.867 -0.641 1.00 . A A . 14 ARG HB3 1 1
8 2197 1 1 15 ARG HD2 H 3.339 3.975 1.003 1.00 . A A . 14 ARG HD2 1 1
8 2198 1 1 15 ARG HD3 H 3.451 2.731 -0.243 1.00 . A A . 14 ARG HD3 1 1
8 2199 1 1 15 ARG HE H 5.855 2.714 1.225 1.00 . A A . 14 ARG HE 1 1
8 2200 1 1 15 ARG HG2 H 5.445 4.966 0.191 1.00 . A A . 14 ARG HG2 1 1
8 2201 1 1 15 ARG HG3 H 4.240 4.907 -1.089 1.00 . A A . 14 ARG HG3 1 1
8 2202 1 1 15 ARG HH11 H 2.468 2.091 1.614 1.00 . A A . 14 ARG HH11 1 1
8 2203 1 1 15 ARG HH12 H 2.689 0.868 2.821 1.00 . A A . 14 ARG HH12 1 1
8 2204 1 1 15 ARG HH21 H 6.149 1.111 2.813 1.00 . A A . 14 ARG HH21 1 1
8 2205 1 1 15 ARG HH22 H 4.773 0.315 3.500 1.00 . A A . 14 ARG HH22 1 1
8 2206 1 1 15 ARG N N 7.604 3.577 -3.003 1.00 . A A . 14 ARG N 1 1
8 2207 1 1 15 ARG NE N 4.878 2.595 1.273 1.00 . A A . 14 ARG NE 1 1
8 2208 1 1 15 ARG NH1 N 3.074 1.542 2.189 1.00 . A A . 14 ARG NH1 1 1
8 2209 1 1 15 ARG NH2 N 5.158 0.987 2.868 1.00 . A A . 14 ARG NH2 1 1
8 2210 1 1 15 ARG O O 7.859 6.386 -1.545 1.00 . A A . 14 ARG O 1 1
8 2211 1 1 16 ACE C C 7.701 3.809 -4.313 1.00 . A A . 15 ACE C 1 1
8 2212 1 1 16 ACE CH3 C 8.665 2.919 -5.091 1.00 . A A . 15 ACE CH3 1 1
8 2213 1 1 16 ACE H1 H 8.544 1.892 -4.779 1.00 . A A . 15 ACE H1 1 1
8 2214 1 1 16 ACE H2 H 9.679 3.236 -4.899 1.00 . A A . 15 ACE H2 1 1
8 2215 1 1 16 ACE H3 H 8.459 3.002 -6.148 1.00 . A A . 15 ACE H3 1 1
8 2216 1 1 16 ACE O O 7.064 4.694 -4.882 1.00 . A A . 15 ACE O 1 1
9 2217 1 1 1 ACE C C 6.928 0.615 -5.318 1.00 . A A . 0 ACE C 1 1
9 2218 1 1 1 ACE CH3 C 7.148 1.012 -6.774 1.00 . A A . 0 ACE CH3 1 1
9 2219 1 1 1 ACE H1 H 6.446 0.483 -7.401 1.00 . A A . 0 ACE H1 1 1
9 2220 1 1 1 ACE H2 H 8.156 0.759 -7.069 1.00 . A A . 0 ACE H2 1 1
9 2221 1 1 1 ACE H3 H 6.997 2.076 -6.884 1.00 . A A . 0 ACE H3 1 1
9 2222 1 1 1 ACE O O 7.250 -0.504 -4.914 1.00 . A A . 0 ACE O 1 1
9 2223 1 1 2 GLU C C 7.360 0.836 -2.391 1.00 . A A . 1 GLU C 1 1
9 2224 1 1 2 GLU CA C 6.097 1.273 -3.131 1.00 . A A . 1 GLU CA 1 1
9 2225 1 1 2 GLU CB C 5.032 0.186 -3.015 1.00 . A A . 1 GLU CB 1 1
9 2226 1 1 2 GLU CD C 2.676 -0.429 -3.595 1.00 . A A . 1 GLU CD 1 1
9 2227 1 1 2 GLU CG C 3.750 0.649 -3.709 1.00 . A A . 1 GLU CG 1 1
9 2228 1 1 2 GLU H H 6.126 2.403 -4.914 1.00 . A A . 1 GLU H 1 1
9 2229 1 1 2 GLU HA H 5.720 2.176 -2.675 1.00 . A A . 1 GLU HA 1 1
9 2230 1 1 2 GLU HB2 H 5.391 -0.713 -3.488 1.00 . A A . 1 GLU HB2 1 1
9 2231 1 1 2 GLU HB3 H 4.827 -0.009 -1.975 1.00 . A A . 1 GLU HB3 1 1
9 2232 1 1 2 GLU HG2 H 3.397 1.557 -3.242 1.00 . A A . 1 GLU HG2 1 1
9 2233 1 1 2 GLU HG3 H 3.955 0.838 -4.751 1.00 . A A . 1 GLU HG3 1 1
9 2234 1 1 2 GLU N N 6.368 1.534 -4.536 1.00 . A A . 1 GLU N 1 1
9 2235 1 1 2 GLU O O 7.985 1.636 -1.688 1.00 . A A . 1 GLU O 1 1
9 2236 1 1 2 GLU OE1 O 2.321 -0.768 -2.478 1.00 . A A . 1 GLU OE1 1 1
9 2237 1 1 2 GLU OE2 O 2.226 -0.900 -4.626 1.00 . A A . 1 GLU OE2 1 1
9 2238 1 1 3 ARG C C 10.188 -0.526 -2.550 1.00 . A A . 2 ARG C 1 1
9 2239 1 1 3 ARG CA C 8.899 -0.979 -1.867 1.00 . A A . 2 ARG CA 1 1
9 2240 1 1 3 ARG CB C 8.837 -2.510 -1.842 1.00 . A A . 2 ARG CB 1 1
9 2241 1 1 3 ARG CD C 8.736 -4.582 -3.234 1.00 . A A . 2 ARG CD 1 1
9 2242 1 1 3 ARG CG C 8.791 -3.053 -3.273 1.00 . A A . 2 ARG CG 1 1
9 2243 1 1 3 ARG CZ C 10.092 -6.421 -2.414 1.00 . A A . 2 ARG CZ 1 1
9 2244 1 1 3 ARG H H 7.174 -1.030 -3.100 1.00 . A A . 2 ARG H 1 1
9 2245 1 1 3 ARG HA H 8.907 -0.622 -0.849 1.00 . A A . 2 ARG HA 1 1
9 2246 1 1 3 ARG HB2 H 9.713 -2.897 -1.338 1.00 . A A . 2 ARG HB2 1 1
9 2247 1 1 3 ARG HB3 H 7.951 -2.824 -1.312 1.00 . A A . 2 ARG HB3 1 1
9 2248 1 1 3 ARG HD2 H 7.860 -4.894 -2.686 1.00 . A A . 2 ARG HD2 1 1
9 2249 1 1 3 ARG HD3 H 8.679 -4.962 -4.244 1.00 . A A . 2 ARG HD3 1 1
9 2250 1 1 3 ARG HE H 10.615 -4.496 -2.257 1.00 . A A . 2 ARG HE 1 1
9 2251 1 1 3 ARG HG2 H 7.912 -2.673 -3.774 1.00 . A A . 2 ARG HG2 1 1
9 2252 1 1 3 ARG HG3 H 9.675 -2.741 -3.807 1.00 . A A . 2 ARG HG3 1 1
9 2253 1 1 3 ARG HH11 H 8.362 -6.908 -3.296 1.00 . A A . 2 ARG HH11 1 1
9 2254 1 1 3 ARG HH12 H 9.308 -8.239 -2.717 1.00 . A A . 2 ARG HH12 1 1
9 2255 1 1 3 ARG HH21 H 11.861 -6.235 -1.495 1.00 . A A . 2 ARG HH21 1 1
9 2256 1 1 3 ARG HH22 H 11.289 -7.858 -1.697 1.00 . A A . 2 ARG HH22 1 1
9 2257 1 1 3 ARG N N 7.718 -0.440 -2.539 1.00 . A A . 2 ARG N 1 1
9 2258 1 1 3 ARG NE N 9.927 -5.113 -2.580 1.00 . A A . 2 ARG NE 1 1
9 2259 1 1 3 ARG NH1 N 9.183 -7.254 -2.843 1.00 . A A . 2 ARG NH1 1 1
9 2260 1 1 3 ARG NH2 N 11.165 -6.873 -1.822 1.00 . A A . 2 ARG NH2 1 1
9 2261 1 1 3 ARG O O 10.268 -0.459 -3.775 1.00 . A A . 2 ARG O 1 1
9 2262 1 1 4 PHE C C 13.404 0.552 -1.008 1.00 . A A . 3 PHE C 1 1
9 2263 1 1 4 PHE CA C 12.499 0.225 -2.196 1.00 . A A . 3 PHE CA 1 1
9 2264 1 1 4 PHE CB C 12.360 1.475 -3.076 1.00 . A A . 3 PHE CB 1 1
9 2265 1 1 4 PHE CD1 C 14.606 1.212 -4.208 1.00 . A A . 3 PHE CD1 1 1
9 2266 1 1 4 PHE CD2 C 14.171 3.217 -2.917 1.00 . A A . 3 PHE CD2 1 1
9 2267 1 1 4 PHE CE1 C 15.899 1.677 -4.486 1.00 . A A . 3 PHE CE1 1 1
9 2268 1 1 4 PHE CE2 C 15.454 3.683 -3.195 1.00 . A A . 3 PHE CE2 1 1
9 2269 1 1 4 PHE CG C 13.741 1.984 -3.426 1.00 . A A . 3 PHE CG 1 1
9 2270 1 1 4 PHE CZ C 16.323 2.914 -3.980 1.00 . A A . 3 PHE CZ 1 1
9 2271 1 1 4 PHE H H 11.041 -0.311 -0.760 1.00 . A A . 3 PHE H 1 1
9 2272 1 1 4 PHE HA H 12.953 -0.563 -2.777 1.00 . A A . 3 PHE HA 1 1
9 2273 1 1 4 PHE HB2 H 11.834 1.223 -3.985 1.00 . A A . 3 PHE HB2 1 1
9 2274 1 1 4 PHE HB3 H 11.813 2.231 -2.549 1.00 . A A . 3 PHE HB3 1 1
9 2275 1 1 4 PHE HD1 H 14.277 0.262 -4.601 1.00 . A A . 3 PHE HD1 1 1
9 2276 1 1 4 PHE HD2 H 13.505 3.813 -2.312 1.00 . A A . 3 PHE HD2 1 1
9 2277 1 1 4 PHE HE1 H 16.568 1.083 -5.089 1.00 . A A . 3 PHE HE1 1 1
9 2278 1 1 4 PHE HE2 H 15.777 4.634 -2.795 1.00 . A A . 3 PHE HE2 1 1
9 2279 1 1 4 PHE HZ H 17.319 3.273 -4.194 1.00 . A A . 3 PHE HZ 1 1
9 2280 1 1 4 PHE N N 11.189 -0.225 -1.726 1.00 . A A . 3 PHE N 1 1
9 2281 1 1 4 PHE O O 13.609 1.726 -0.675 1.00 . A A . 3 PHE O 1 1
9 2282 1 1 5 TYR C C 16.183 -0.839 0.503 1.00 . A A . 4 TYR C 1 1
9 2283 1 1 5 TYR CA C 14.827 -0.241 0.790 1.00 . A A . 4 TYR CA 1 1
9 2284 1 1 5 TYR CB C 14.219 -0.881 2.053 1.00 . A A . 4 TYR CB 1 1
9 2285 1 1 5 TYR CD1 C 15.383 -3.113 1.987 1.00 . A A . 4 TYR CD1 1 1
9 2286 1 1 5 TYR CD2 C 12.973 -3.056 1.780 1.00 . A A . 4 TYR CD2 1 1
9 2287 1 1 5 TYR CE1 C 15.372 -4.495 1.875 1.00 . A A . 4 TYR CE1 1 1
9 2288 1 1 5 TYR CE2 C 12.955 -4.448 1.666 1.00 . A A . 4 TYR CE2 1 1
9 2289 1 1 5 TYR CG C 14.187 -2.387 1.944 1.00 . A A . 4 TYR CG 1 1
9 2290 1 1 5 TYR CZ C 14.156 -5.173 1.715 1.00 . A A . 4 TYR CZ 1 1
9 2291 1 1 5 TYR H H 13.769 -1.389 -0.655 1.00 . A A . 4 TYR H 1 1
9 2292 1 1 5 TYR HA H 14.947 0.810 0.962 1.00 . A A . 4 TYR HA 1 1
9 2293 1 1 5 TYR HB2 H 14.816 -0.609 2.909 1.00 . A A . 4 TYR HB2 1 1
9 2294 1 1 5 TYR HB3 H 13.213 -0.513 2.189 1.00 . A A . 4 TYR HB3 1 1
9 2295 1 1 5 TYR HD1 H 16.319 -2.604 2.124 1.00 . A A . 4 TYR HD1 1 1
9 2296 1 1 5 TYR HD2 H 12.050 -2.497 1.742 1.00 . A A . 4 TYR HD2 1 1
9 2297 1 1 5 TYR HE1 H 16.307 -5.037 1.916 1.00 . A A . 4 TYR HE1 1 1
9 2298 1 1 5 TYR HE2 H 12.017 -4.962 1.542 1.00 . A A . 4 TYR HE2 1 1
9 2299 1 1 5 TYR HH H 13.235 -6.845 1.718 1.00 . A A . 4 TYR HH 1 1
9 2300 1 1 5 TYR N N 13.953 -0.473 -0.361 1.00 . A A . 4 TYR N 1 1
9 2301 1 1 5 TYR O O 16.313 -1.708 -0.358 1.00 . A A . 4 TYR O 1 1
9 2302 1 1 5 TYR OH O 14.140 -6.549 1.604 1.00 . A A . 4 TYR OH 1 1
9 2303 1 1 6 GLU C C 19.149 -1.357 2.390 1.00 . A A . 5 GLU C 1 1
9 2304 1 1 6 GLU CA C 18.549 -0.925 1.053 1.00 . A A . 5 GLU CA 1 1
9 2305 1 1 6 GLU CB C 19.437 0.144 0.405 1.00 . A A . 5 GLU CB 1 1
9 2306 1 1 6 GLU CD C 21.720 0.654 -0.483 1.00 . A A . 5 GLU CD 1 1
9 2307 1 1 6 GLU CG C 20.850 -0.407 0.180 1.00 . A A . 5 GLU CG 1 1
9 2308 1 1 6 GLU H H 17.032 0.299 1.920 1.00 . A A . 5 GLU H 1 1
9 2309 1 1 6 GLU HA H 18.518 -1.786 0.399 1.00 . A A . 5 GLU HA 1 1
9 2310 1 1 6 GLU HB2 H 19.010 0.437 -0.543 1.00 . A A . 5 GLU HB2 1 1
9 2311 1 1 6 GLU HB3 H 19.489 1.002 1.054 1.00 . A A . 5 GLU HB3 1 1
9 2312 1 1 6 GLU HG2 H 21.288 -0.682 1.128 1.00 . A A . 5 GLU HG2 1 1
9 2313 1 1 6 GLU HG3 H 20.799 -1.277 -0.458 1.00 . A A . 5 GLU HG3 1 1
9 2314 1 1 6 GLU N N 17.197 -0.392 1.238 1.00 . A A . 5 GLU N 1 1
9 2315 1 1 6 GLU O O 19.615 -0.525 3.166 1.00 . A A . 5 GLU O 1 1
9 2316 1 1 6 GLU OE1 O 21.373 1.083 -1.572 1.00 . A A . 5 GLU OE1 1 1
9 2317 1 1 6 GLU OE2 O 22.723 1.024 0.106 1.00 . A A . 5 GLU OE2 1 1
9 2318 1 1 7 LYS C C 21.073 -3.911 3.501 1.00 . A A . 6 LYS C 1 1
9 2319 1 1 7 LYS CA C 19.774 -3.223 3.853 1.00 . A A . 6 LYS CA 1 1
9 2320 1 1 7 LYS CB C 18.836 -4.211 4.557 1.00 . A A . 6 LYS CB 1 1
9 2321 1 1 7 LYS CD C 16.655 -4.499 5.736 1.00 . A A . 6 LYS CD 1 1
9 2322 1 1 7 LYS CE C 15.393 -3.788 6.229 1.00 . A A . 6 LYS CE 1 1
9 2323 1 1 7 LYS CG C 17.572 -3.494 5.035 1.00 . A A . 6 LYS CG 1 1
9 2324 1 1 7 LYS H H 18.822 -3.288 1.954 1.00 . A A . 6 LYS H 1 1
9 2325 1 1 7 LYS HA H 19.997 -2.416 4.531 1.00 . A A . 6 LYS HA 1 1
9 2326 1 1 7 LYS HB2 H 18.563 -4.997 3.867 1.00 . A A . 6 LYS HB2 1 1
9 2327 1 1 7 LYS HB3 H 19.344 -4.642 5.406 1.00 . A A . 6 LYS HB3 1 1
9 2328 1 1 7 LYS HD2 H 16.381 -5.280 5.041 1.00 . A A . 6 LYS HD2 1 1
9 2329 1 1 7 LYS HD3 H 17.173 -4.932 6.579 1.00 . A A . 6 LYS HD3 1 1
9 2330 1 1 7 LYS HE2 H 14.756 -4.496 6.738 1.00 . A A . 6 LYS HE2 1 1
9 2331 1 1 7 LYS HE3 H 15.670 -2.996 6.909 1.00 . A A . 6 LYS HE3 1 1
9 2332 1 1 7 LYS HG2 H 17.843 -2.710 5.729 1.00 . A A . 6 LYS HG2 1 1
9 2333 1 1 7 LYS HG3 H 17.059 -3.066 4.198 1.00 . A A . 6 LYS HG3 1 1
9 2334 1 1 7 LYS HZ1 H 14.934 -3.720 4.199 1.00 . A A . 6 LYS HZ1 1 1
9 2335 1 1 7 LYS HZ2 H 14.908 -2.204 4.967 1.00 . A A . 6 LYS HZ2 1 1
9 2336 1 1 7 LYS HZ3 H 13.640 -3.306 5.215 1.00 . A A . 6 LYS HZ3 1 1
9 2337 1 1 7 LYS N N 19.177 -2.672 2.629 1.00 . A A . 6 LYS N 1 1
9 2338 1 1 7 LYS NZ N 14.663 -3.210 5.064 1.00 . A A . 6 LYS NZ 1 1
9 2339 1 1 7 LYS O O 21.109 -5.100 3.179 1.00 . A A . 6 LYS O 1 1
9 2340 1 1 8 . CAA C 25.608 -3.252 2.048 1.00 . A A . 7 4G6 CAA 1 1
9 2341 1 1 8 . CAB C 23.471 -2.546 0.995 1.00 . A A . 7 4G6 CAB 1 1
9 2342 1 1 8 . CAE C 23.448 -3.701 3.185 1.00 . A A . 7 4G6 CAE 1 1
9 2343 1 1 8 . CAF C 24.212 -2.691 2.326 1.00 . A A . 7 4G6 CAF 1 1
9 2344 1 1 8 . HAA H 25.993 -2.824 1.122 1.00 . A A . 7 4G6 HAA 1 1
9 2345 1 1 8 . HAB H 25.550 -4.336 1.952 1.00 . A A . 7 4G6 HAB 1 1
9 2346 1 1 8 . HAC H 26.274 -2.995 2.872 1.00 . A A . 7 4G6 HAC 1 1
9 2347 1 1 8 . HAD H 22.448 -2.906 1.106 1.00 . A A . 7 4G6 HAD 1 1
9 2348 1 1 8 . HAE H 23.981 -3.129 0.229 1.00 . A A . 7 4G6 HAE 1 1
9 2349 1 1 8 . HAF H 23.457 -1.496 0.703 1.00 . A A . 7 4G6 HAF 1 1
9 2350 1 1 8 . HAG H 23.324 -4.623 2.618 1.00 . A A . 7 4G6 HAG 1 1
9 2351 1 1 8 . HAH H 24.010 -3.908 4.095 1.00 . A A . 7 4G6 HAH 1 1
9 2352 1 1 8 . HAI H 22.039 -2.194 3.784 1.00 . A A . 7 4G6 HAI 1 1
9 2353 1 1 8 . HAL H 24.604 -0.601 2.418 1.00 . A A . 7 4G6 HAL 1 1
9 2354 1 1 8 . NAC N 22.128 -3.159 3.536 1.00 . A A . 7 4G6 NAC 1 1
9 2355 1 1 8 . NAD N 24.317 -1.377 2.981 1.00 . A A . 7 4G6 NAD 1 1
9 2356 1 1 9 DPR C C 24.081 -1.164 4.271 1.00 . A A . 8 DPR C 1 1
9 2357 1 1 9 DPR CA C 24.279 0.281 4.752 1.00 . A A . 8 DPR CA 1 1
9 2358 1 1 9 DPR CB C 24.861 1.186 3.673 1.00 . A A . 8 DPR CB 1 1
9 2359 1 1 9 DPR CD C 23.249 2.467 4.968 1.00 . A A . 8 DPR CD 1 1
9 2360 1 1 9 DPR CG C 24.573 2.566 4.182 1.00 . A A . 8 DPR CG 1 1
9 2361 1 1 9 DPR HA H 24.941 0.289 5.601 1.00 . A A . 8 DPR HA 1 1
9 2362 1 1 9 DPR HB2 H 25.927 1.022 3.573 1.00 . A A . 8 DPR HB2 1 1
9 2363 1 1 9 DPR HB3 H 24.359 1.031 2.731 1.00 . A A . 8 DPR HB3 1 1
9 2364 1 1 9 DPR HD2 H 23.347 2.922 5.946 1.00 . A A . 8 DPR HD2 1 1
9 2365 1 1 9 DPR HD3 H 22.444 2.922 4.419 1.00 . A A . 8 DPR HD3 1 1
9 2366 1 1 9 DPR HG2 H 25.377 2.893 4.834 1.00 . A A . 8 DPR HG2 1 1
9 2367 1 1 9 DPR HG3 H 24.462 3.257 3.359 1.00 . A A . 8 DPR HG3 1 1
9 2368 1 1 9 DPR N N 23.019 1.014 5.091 1.00 . A A . 8 DPR N 1 1
9 2369 1 1 9 DPR O O 23.753 -2.039 5.069 1.00 . A A . 8 DPR O 1 1
9 2370 1 1 10 VAL C C 21.885 0.426 5.435 1.00 . A A . 9 VAL C 1 1
9 2371 1 1 10 VAL CA C 20.681 1.329 5.797 1.00 . A A . 9 VAL CA 1 1
9 2372 1 1 10 VAL CB C 19.860 0.685 6.932 1.00 . A A . 9 VAL CB 1 1
9 2373 1 1 10 VAL CG1 C 19.209 -0.630 6.461 1.00 . A A . 9 VAL CG1 1 1
9 2374 1 1 10 VAL CG2 C 20.781 0.409 8.125 1.00 . A A . 9 VAL CG2 1 1
9 2375 1 1 10 VAL H H 19.756 0.941 3.918 1.00 . A A . 9 VAL H 1 1
9 2376 1 1 10 VAL HA H 21.049 2.275 6.162 1.00 . A A . 9 VAL HA 1 1
9 2377 1 1 10 VAL HB H 19.083 1.370 7.234 1.00 . A A . 9 VAL HB 1 1
9 2378 1 1 10 VAL HG11 H 18.305 -0.807 7.030 1.00 . A A . 9 VAL HG11 1 1
9 2379 1 1 10 VAL HG12 H 19.886 -1.456 6.615 1.00 . A A . 9 VAL HG12 1 1
9 2380 1 1 10 VAL HG13 H 18.956 -0.557 5.414 1.00 . A A . 9 VAL HG13 1 1
9 2381 1 1 10 VAL HG21 H 20.185 0.147 8.987 1.00 . A A . 9 VAL HG21 1 1
9 2382 1 1 10 VAL HG22 H 21.362 1.293 8.344 1.00 . A A . 9 VAL HG22 1 1
9 2383 1 1 10 VAL HG23 H 21.445 -0.408 7.886 1.00 . A A . 9 VAL HG23 1 1
9 2384 1 1 10 VAL N N 19.791 1.583 4.658 1.00 . A A . 9 VAL N 1 1
9 2385 1 1 10 VAL O O 21.791 -0.797 5.497 1.00 . A A . 9 VAL O 1 1
9 2386 1 1 11 GLN C C 18.995 2.658 4.642 1.00 . A A . 10 GLN C 1 1
9 2387 1 1 11 GLN CA C 18.057 2.819 3.445 1.00 . A A . 10 GLN CA 1 1
9 2388 1 1 11 GLN CB C 18.302 4.119 2.635 1.00 . A A . 10 GLN CB 1 1
9 2389 1 1 11 GLN CD C 20.837 4.319 2.971 1.00 . A A . 10 GLN CD 1 1
9 2390 1 1 11 GLN CG C 19.692 4.171 1.970 1.00 . A A . 10 GLN CG 1 1
9 2391 1 1 11 GLN H H 16.557 2.935 4.927 1.00 . A A . 10 GLN H 1 1
9 2392 1 1 11 GLN HA H 18.164 1.965 2.792 1.00 . A A . 10 GLN HA 1 1
9 2393 1 1 11 GLN HB2 H 17.549 4.195 1.865 1.00 . A A . 10 GLN HB2 1 1
9 2394 1 1 11 GLN HB3 H 18.202 4.965 3.300 1.00 . A A . 10 GLN HB3 1 1
9 2395 1 1 11 GLN HE21 H 19.670 4.687 4.530 1.00 . A A . 10 GLN HE21 1 1
9 2396 1 1 11 GLN HE22 H 21.336 4.676 4.856 1.00 . A A . 10 GLN HE22 1 1
9 2397 1 1 11 GLN HG2 H 19.841 3.265 1.406 1.00 . A A . 10 GLN HG2 1 1
9 2398 1 1 11 GLN HG3 H 19.715 5.008 1.286 1.00 . A A . 10 GLN HG3 1 1
9 2399 1 1 11 GLN N N 16.694 2.863 3.961 1.00 . A A . 10 GLN N 1 1
9 2400 1 1 11 GLN NE2 N 20.595 4.581 4.221 1.00 . A A . 10 GLN NE2 1 1
9 2401 1 1 11 GLN O O 18.964 3.469 5.568 1.00 . A A . 10 GLN O 1 1
9 2402 1 1 11 GLN OE1 O 22.001 4.286 2.572 1.00 . A A . 10 GLN OE1 1 1
9 2403 1 1 12 LYS C C 15.630 2.815 3.161 1.00 . A A . 11 LYS C 1 1
9 2404 1 1 12 LYS CA C 14.279 2.879 3.877 1.00 . A A . 11 LYS CA 1 1
9 2405 1 1 12 LYS CB C 14.318 1.914 5.070 1.00 . A A . 11 LYS CB 1 1
9 2406 1 1 12 LYS CD C 13.099 1.067 7.075 1.00 . A A . 11 LYS CD 1 1
9 2407 1 1 12 LYS CE C 11.817 1.180 7.901 1.00 . A A . 11 LYS CE 1 1
9 2408 1 1 12 LYS CG C 13.028 2.026 5.884 1.00 . A A . 11 LYS CG 1 1
9 2409 1 1 12 LYS H H 13.257 1.827 2.316 1.00 . A A . 11 LYS H 1 1
9 2410 1 1 12 LYS HA H 14.142 3.882 4.257 1.00 . A A . 11 LYS HA 1 1
9 2411 1 1 12 LYS HB2 H 14.425 0.902 4.708 1.00 . A A . 11 LYS HB2 1 1
9 2412 1 1 12 LYS HB3 H 15.158 2.158 5.701 1.00 . A A . 11 LYS HB3 1 1
9 2413 1 1 12 LYS HD2 H 13.208 0.054 6.714 1.00 . A A . 11 LYS HD2 1 1
9 2414 1 1 12 LYS HD3 H 13.946 1.323 7.692 1.00 . A A . 11 LYS HD3 1 1
9 2415 1 1 12 LYS HE2 H 11.875 0.513 8.748 1.00 . A A . 11 LYS HE2 1 1
9 2416 1 1 12 LYS HE3 H 11.704 2.196 8.250 1.00 . A A . 11 LYS HE3 1 1
9 2417 1 1 12 LYS HG2 H 12.910 3.039 6.242 1.00 . A A . 11 LYS HG2 1 1
9 2418 1 1 12 LYS HG3 H 12.184 1.760 5.266 1.00 . A A . 11 LYS HG3 1 1
9 2419 1 1 12 LYS HZ1 H 9.817 0.650 7.663 1.00 . A A . 11 LYS HZ1 1 1
9 2420 1 1 12 LYS HZ2 H 10.862 -0.058 6.525 1.00 . A A . 11 LYS HZ2 1 1
9 2421 1 1 12 LYS HZ3 H 10.441 1.583 6.391 1.00 . A A . 11 LYS HZ3 1 1
9 2422 1 1 12 LYS N N 13.149 2.536 2.998 1.00 . A A . 11 LYS N 1 1
9 2423 1 1 12 LYS NZ N 10.645 0.811 7.056 1.00 . A A . 11 LYS NZ 1 1
9 2424 1 1 12 LYS O O 15.712 2.727 1.938 1.00 . A A . 11 LYS O 1 1
9 2425 1 1 13 PHE C C 11.964 3.170 3.121 1.00 . A A . 12 PHE C 1 1
9 2426 1 1 13 PHE CA C 10.850 2.712 2.186 1.00 . A A . 12 PHE CA 1 1
9 2427 1 1 13 PHE CB C 11.392 2.387 0.801 1.00 . A A . 12 PHE CB 1 1
9 2428 1 1 13 PHE CD1 C 12.939 4.399 0.529 1.00 . A A . 12 PHE CD1 1 1
9 2429 1 1 13 PHE CD2 C 11.099 4.113 -1.012 1.00 . A A . 12 PHE CD2 1 1
9 2430 1 1 13 PHE CE1 C 13.297 5.577 -0.120 1.00 . A A . 12 PHE CE1 1 1
9 2431 1 1 13 PHE CE2 C 11.467 5.290 -1.666 1.00 . A A . 12 PHE CE2 1 1
9 2432 1 1 13 PHE CG C 11.836 3.654 0.085 1.00 . A A . 12 PHE CG 1 1
9 2433 1 1 13 PHE CZ C 12.566 6.022 -1.222 1.00 . A A . 12 PHE CZ 1 1
9 2434 1 1 13 PHE H H 9.947 4.632 1.989 1.00 . A A . 12 PHE H 1 1
9 2435 1 1 13 PHE HA H 10.457 1.808 2.595 1.00 . A A . 12 PHE HA 1 1
9 2436 1 1 13 PHE HB2 H 12.222 1.725 0.923 1.00 . A A . 12 PHE HB2 1 1
9 2437 1 1 13 PHE HB3 H 10.624 1.891 0.220 1.00 . A A . 12 PHE HB3 1 1
9 2438 1 1 13 PHE HD1 H 13.527 4.060 1.350 1.00 . A A . 12 PHE HD1 1 1
9 2439 1 1 13 PHE HD2 H 10.248 3.550 -1.359 1.00 . A A . 12 PHE HD2 1 1
9 2440 1 1 13 PHE HE1 H 14.140 6.139 0.233 1.00 . A A . 12 PHE HE1 1 1
9 2441 1 1 13 PHE HE2 H 10.911 5.626 -2.519 1.00 . A A . 12 PHE HE2 1 1
9 2442 1 1 13 PHE HZ H 12.842 6.936 -1.723 1.00 . A A . 12 PHE HZ 1 1
9 2443 1 1 13 PHE N N 9.751 3.675 2.055 1.00 . A A . 12 PHE N 1 1
9 2444 1 1 13 PHE O O 11.760 4.051 3.956 1.00 . A A . 12 PHE O 1 1
9 2445 1 1 14 ILE C C 8.486 3.245 1.978 1.00 . A A . 13 ILE C 1 1
9 2446 1 1 14 ILE CA C 7.398 4.293 1.788 1.00 . A A . 13 ILE CA 1 1
9 2447 1 1 14 ILE CB C 6.094 3.743 2.423 1.00 . A A . 13 ILE CB 1 1
9 2448 1 1 14 ILE CD1 C 5.144 6.041 3.076 1.00 . A A . 13 ILE CD1 1 1
9 2449 1 1 14 ILE CG1 C 4.894 4.720 2.311 1.00 . A A . 13 ILE CG1 1 1
9 2450 1 1 14 ILE CG2 C 6.346 3.447 3.905 1.00 . A A . 13 ILE CG2 1 1
9 2451 1 1 14 ILE H H 7.668 3.867 -0.276 1.00 . A A . 13 ILE H 1 1
9 2452 1 1 14 ILE HA H 7.695 5.207 2.273 1.00 . A A . 13 ILE HA 1 1
9 2453 1 1 14 ILE HB H 5.839 2.815 1.927 1.00 . A A . 13 ILE HB 1 1
9 2454 1 1 14 ILE HD11 H 6.077 6.002 3.616 1.00 . A A . 13 ILE HD11 1 1
9 2455 1 1 14 ILE HD12 H 4.342 6.192 3.783 1.00 . A A . 13 ILE HD12 1 1
9 2456 1 1 14 ILE HD13 H 5.160 6.867 2.386 1.00 . A A . 13 ILE HD13 1 1
9 2457 1 1 14 ILE HG12 H 4.701 4.938 1.275 1.00 . A A . 13 ILE HG12 1 1
9 2458 1 1 14 ILE HG13 H 4.021 4.240 2.729 1.00 . A A . 13 ILE HG13 1 1
9 2459 1 1 14 ILE HG21 H 6.830 4.296 4.365 1.00 . A A . 13 ILE HG21 1 1
9 2460 1 1 14 ILE HG22 H 6.982 2.578 3.997 1.00 . A A . 13 ILE HG22 1 1
9 2461 1 1 14 ILE HG23 H 5.405 3.257 4.402 1.00 . A A . 13 ILE HG23 1 1
9 2462 1 1 14 ILE N N 7.266 4.524 0.343 1.00 . A A . 13 ILE N 1 1
9 2463 1 1 14 ILE O O 8.194 2.050 2.011 1.00 . A A . 13 ILE O 1 1
9 2464 1 1 15 ARG C C 6.684 5.571 -0.204 1.00 . A A . 14 ARG C 1 1
9 2465 1 1 15 ARG CA C 6.750 5.533 -1.713 1.00 . A A . 14 ARG CA 1 1
9 2466 1 1 15 ARG CB C 8.087 6.144 -2.129 1.00 . A A . 14 ARG CB 1 1
9 2467 1 1 15 ARG CD C 8.564 4.527 -4.040 1.00 . A A . 14 ARG CD 1 1
9 2468 1 1 15 ARG CG C 8.368 5.998 -3.629 1.00 . A A . 14 ARG CG 1 1
9 2469 1 1 15 ARG CZ C 9.154 3.275 -6.030 1.00 . A A . 14 ARG CZ 1 1
9 2470 1 1 15 ARG H H 5.282 7.049 -1.953 1.00 . A A . 14 ARG H 1 1
9 2471 1 1 15 ARG HA H 6.734 4.501 -2.001 1.00 . A A . 14 ARG HA 1 1
9 2472 1 1 15 ARG HB2 H 8.084 7.194 -1.878 1.00 . A A . 14 ARG HB2 1 1
9 2473 1 1 15 ARG HB3 H 8.875 5.658 -1.574 1.00 . A A . 14 ARG HB3 1 1
9 2474 1 1 15 ARG HD2 H 9.349 4.087 -3.448 1.00 . A A . 14 ARG HD2 1 1
9 2475 1 1 15 ARG HD3 H 7.654 3.974 -3.893 1.00 . A A . 14 ARG HD3 1 1
9 2476 1 1 15 ARG HE H 8.999 5.266 -5.975 1.00 . A A . 14 ARG HE 1 1
9 2477 1 1 15 ARG HG2 H 7.532 6.400 -4.170 1.00 . A A . 14 ARG HG2 1 1
9 2478 1 1 15 ARG HG3 H 9.253 6.554 -3.873 1.00 . A A . 14 ARG HG3 1 1
9 2479 1 1 15 ARG HH11 H 8.871 2.223 -4.351 1.00 . A A . 14 ARG HH11 1 1
9 2480 1 1 15 ARG HH12 H 9.266 1.294 -5.758 1.00 . A A . 14 ARG HH12 1 1
9 2481 1 1 15 ARG HH21 H 9.511 4.061 -7.836 1.00 . A A . 14 ARG HH21 1 1
9 2482 1 1 15 ARG HH22 H 9.624 2.336 -7.736 1.00 . A A . 14 ARG HH22 1 1
9 2483 1 1 15 ARG N N 5.624 6.222 -2.351 1.00 . A A . 14 ARG N 1 1
9 2484 1 1 15 ARG NE N 8.926 4.446 -5.449 1.00 . A A . 14 ARG NE 1 1
9 2485 1 1 15 ARG NH1 N 9.091 2.179 -5.326 1.00 . A A . 14 ARG NH1 1 1
9 2486 1 1 15 ARG NH2 N 9.453 3.220 -7.299 1.00 . A A . 14 ARG NH2 1 1
9 2487 1 1 15 ARG O O 6.180 6.506 0.407 1.00 . A A . 14 ARG O 1 1
9 2488 1 1 16 ACE C C 5.054 5.747 -3.461 1.00 . A A . 15 ACE C 1 1
9 2489 1 1 16 ACE CH3 C 3.890 6.560 -4.021 1.00 . A A . 15 ACE CH3 1 1
9 2490 1 1 16 ACE H1 H 2.974 6.256 -3.537 1.00 . A A . 15 ACE H1 1 1
9 2491 1 1 16 ACE H2 H 3.810 6.388 -5.084 1.00 . A A . 15 ACE H2 1 1
9 2492 1 1 16 ACE H3 H 4.063 7.611 -3.838 1.00 . A A . 15 ACE H3 1 1
9 2493 1 1 16 ACE O O 5.426 4.713 -4.019 1.00 . A A . 15 ACE O 1 1
10 2494 1 1 1 ACE C C 7.678 1.387 -3.936 1.00 . A A . 0 ACE C 1 1
10 2495 1 1 1 ACE CH3 C 8.036 1.206 -5.408 1.00 . A A . 0 ACE CH3 1 1
10 2496 1 1 1 ACE H1 H 8.882 1.829 -5.652 1.00 . A A . 0 ACE H1 1 1
10 2497 1 1 1 ACE H2 H 7.192 1.488 -6.021 1.00 . A A . 0 ACE H2 1 1
10 2498 1 1 1 ACE H3 H 8.284 0.171 -5.593 1.00 . A A . 0 ACE H3 1 1
10 2499 1 1 1 ACE O O 8.524 1.761 -3.125 1.00 . A A . 0 ACE O 1 1
10 2500 1 1 2 GLU C C 6.914 0.607 -1.247 1.00 . A A . 1 GLU C 1 1
10 2501 1 1 2 GLU CA C 5.948 1.268 -2.227 1.00 . A A . 1 GLU CA 1 1
10 2502 1 1 2 GLU CB C 4.560 0.635 -2.089 1.00 . A A . 1 GLU CB 1 1
10 2503 1 1 2 GLU CD C 3.238 -1.475 -2.332 1.00 . A A . 1 GLU CD 1 1
10 2504 1 1 2 GLU CG C 4.625 -0.853 -2.448 1.00 . A A . 1 GLU CG 1 1
10 2505 1 1 2 GLU H H 5.789 0.835 -4.294 1.00 . A A . 1 GLU H 1 1
10 2506 1 1 2 GLU HA H 5.867 2.313 -1.989 1.00 . A A . 1 GLU HA 1 1
10 2507 1 1 2 GLU HB2 H 4.217 0.742 -1.070 1.00 . A A . 1 GLU HB2 1 1
10 2508 1 1 2 GLU HB3 H 3.870 1.133 -2.754 1.00 . A A . 1 GLU HB3 1 1
10 2509 1 1 2 GLU HG2 H 4.985 -0.963 -3.462 1.00 . A A . 1 GLU HG2 1 1
10 2510 1 1 2 GLU HG3 H 5.297 -1.357 -1.773 1.00 . A A . 1 GLU HG3 1 1
10 2511 1 1 2 GLU N N 6.418 1.122 -3.602 1.00 . A A . 1 GLU N 1 1
10 2512 1 1 2 GLU O O 7.095 1.085 -0.126 1.00 . A A . 1 GLU O 1 1
10 2513 1 1 2 GLU OE1 O 2.345 -1.023 -3.031 1.00 . A A . 1 GLU OE1 1 1
10 2514 1 1 2 GLU OE2 O 3.087 -2.398 -1.547 1.00 . A A . 1 GLU OE2 1 1
10 2515 1 1 3 ARG C C 9.927 -0.878 -1.141 1.00 . A A . 2 ARG C 1 1
10 2516 1 1 3 ARG CA C 8.477 -1.232 -0.838 1.00 . A A . 2 ARG CA 1 1
10 2517 1 1 3 ARG CB C 8.296 -2.735 -1.056 1.00 . A A . 2 ARG CB 1 1
10 2518 1 1 3 ARG CD C 8.399 -4.578 -2.735 1.00 . A A . 2 ARG CD 1 1
10 2519 1 1 3 ARG CG C 8.507 -3.069 -2.539 1.00 . A A . 2 ARG CG 1 1
10 2520 1 1 3 ARG CZ C 9.561 -6.567 -1.964 1.00 . A A . 2 ARG CZ 1 1
10 2521 1 1 3 ARG H H 7.345 -0.818 -2.585 1.00 . A A . 2 ARG H 1 1
10 2522 1 1 3 ARG HA H 8.276 -1.011 0.199 1.00 . A A . 2 ARG HA 1 1
10 2523 1 1 3 ARG HB2 H 9.018 -3.273 -0.459 1.00 . A A . 2 ARG HB2 1 1
10 2524 1 1 3 ARG HB3 H 7.298 -3.024 -0.762 1.00 . A A . 2 ARG HB3 1 1
10 2525 1 1 3 ARG HD2 H 7.436 -4.919 -2.388 1.00 . A A . 2 ARG HD2 1 1
10 2526 1 1 3 ARG HD3 H 8.507 -4.812 -3.784 1.00 . A A . 2 ARG HD3 1 1
10 2527 1 1 3 ARG HE H 10.095 -4.698 -1.471 1.00 . A A . 2 ARG HE 1 1
10 2528 1 1 3 ARG HG2 H 7.754 -2.573 -3.131 1.00 . A A . 2 ARG HG2 1 1
10 2529 1 1 3 ARG HG3 H 9.486 -2.740 -2.852 1.00 . A A . 2 ARG HG3 1 1
10 2530 1 1 3 ARG HH11 H 7.981 -6.862 -3.158 1.00 . A A . 2 ARG HH11 1 1
10 2531 1 1 3 ARG HH12 H 8.796 -8.295 -2.625 1.00 . A A . 2 ARG HH12 1 1
10 2532 1 1 3 ARG HH21 H 11.169 -6.574 -0.772 1.00 . A A . 2 ARG HH21 1 1
10 2533 1 1 3 ARG HH22 H 10.602 -8.132 -1.274 1.00 . A A . 2 ARG HH22 1 1
10 2534 1 1 3 ARG N N 7.532 -0.491 -1.680 1.00 . A A . 2 ARG N 1 1
10 2535 1 1 3 ARG NE N 9.451 -5.242 -1.976 1.00 . A A . 2 ARG NE 1 1
10 2536 1 1 3 ARG NH1 N 8.713 -7.298 -2.634 1.00 . A A . 2 ARG NH1 1 1
10 2537 1 1 3 ARG NH2 N 10.519 -7.135 -1.283 1.00 . A A . 2 ARG NH2 1 1
10 2538 1 1 3 ARG O O 10.819 -1.696 -0.914 1.00 . A A . 2 ARG O 1 1
10 2539 1 1 4 PHE C C 12.419 0.657 -0.712 1.00 . A A . 3 PHE C 1 1
10 2540 1 1 4 PHE CA C 11.558 0.680 -1.968 1.00 . A A . 3 PHE CA 1 1
10 2541 1 1 4 PHE CB C 11.648 2.083 -2.580 1.00 . A A . 3 PHE CB 1 1
10 2542 1 1 4 PHE CD1 C 13.816 1.633 -3.800 1.00 . A A . 3 PHE CD1 1 1
10 2543 1 1 4 PHE CD2 C 13.764 3.401 -2.141 1.00 . A A . 3 PHE CD2 1 1
10 2544 1 1 4 PHE CE1 C 15.175 1.890 -4.026 1.00 . A A . 3 PHE CE1 1 1
10 2545 1 1 4 PHE CE2 C 15.120 3.660 -2.369 1.00 . A A . 3 PHE CE2 1 1
10 2546 1 1 4 PHE CG C 13.107 2.391 -2.859 1.00 . A A . 3 PHE CG 1 1
10 2547 1 1 4 PHE CZ C 15.827 2.903 -3.312 1.00 . A A . 3 PHE CZ 1 1
10 2548 1 1 4 PHE H H 9.451 0.943 -1.833 1.00 . A A . 3 PHE H 1 1
10 2549 1 1 4 PHE HA H 11.953 -0.038 -2.673 1.00 . A A . 3 PHE HA 1 1
10 2550 1 1 4 PHE HB2 H 11.086 2.114 -3.503 1.00 . A A . 3 PHE HB2 1 1
10 2551 1 1 4 PHE HB3 H 11.249 2.811 -1.888 1.00 . A A . 3 PHE HB3 1 1
10 2552 1 1 4 PHE HD1 H 13.314 0.854 -4.355 1.00 . A A . 3 PHE HD1 1 1
10 2553 1 1 4 PHE HD2 H 13.223 3.984 -1.415 1.00 . A A . 3 PHE HD2 1 1
10 2554 1 1 4 PHE HE1 H 15.720 1.304 -4.750 1.00 . A A . 3 PHE HE1 1 1
10 2555 1 1 4 PHE HE2 H 15.624 4.439 -1.812 1.00 . A A . 3 PHE HE2 1 1
10 2556 1 1 4 PHE HZ H 16.874 3.099 -3.488 1.00 . A A . 3 PHE HZ 1 1
10 2557 1 1 4 PHE N N 10.182 0.316 -1.656 1.00 . A A . 3 PHE N 1 1
10 2558 1 1 4 PHE O O 12.110 1.320 0.283 1.00 . A A . 3 PHE O 1 1
10 2559 1 1 5 TYR C C 15.818 -0.417 -0.194 1.00 . A A . 4 TYR C 1 1
10 2560 1 1 5 TYR CA C 14.440 -0.120 0.357 1.00 . A A . 4 TYR CA 1 1
10 2561 1 1 5 TYR CB C 14.018 -1.226 1.352 1.00 . A A . 4 TYR CB 1 1
10 2562 1 1 5 TYR CD1 C 15.575 -3.087 0.682 1.00 . A A . 4 TYR CD1 1 1
10 2563 1 1 5 TYR CD2 C 13.192 -3.408 0.382 1.00 . A A . 4 TYR CD2 1 1
10 2564 1 1 5 TYR CE1 C 15.824 -4.350 0.163 1.00 . A A . 4 TYR CE1 1 1
10 2565 1 1 5 TYR CE2 C 13.438 -4.681 -0.140 1.00 . A A . 4 TYR CE2 1 1
10 2566 1 1 5 TYR CG C 14.259 -2.612 0.798 1.00 . A A . 4 TYR CG 1 1
10 2567 1 1 5 TYR CZ C 14.755 -5.156 -0.250 1.00 . A A . 4 TYR CZ 1 1
10 2568 1 1 5 TYR H H 13.749 -0.552 -1.597 1.00 . A A . 4 TYR H 1 1
10 2569 1 1 5 TYR HA H 14.456 0.830 0.863 1.00 . A A . 4 TYR HA 1 1
10 2570 1 1 5 TYR HB2 H 14.582 -1.118 2.263 1.00 . A A . 4 TYR HB2 1 1
10 2571 1 1 5 TYR HB3 H 12.966 -1.119 1.570 1.00 . A A . 4 TYR HB3 1 1
10 2572 1 1 5 TYR HD1 H 16.400 -2.480 1.019 1.00 . A A . 4 TYR HD1 1 1
10 2573 1 1 5 TYR HD2 H 12.180 -3.039 0.466 1.00 . A A . 4 TYR HD2 1 1
10 2574 1 1 5 TYR HE1 H 16.846 -4.700 0.085 1.00 . A A . 4 TYR HE1 1 1
10 2575 1 1 5 TYR HE2 H 12.613 -5.296 -0.456 1.00 . A A . 4 TYR HE2 1 1
10 2576 1 1 5 TYR HH H 15.735 -6.794 -0.285 1.00 . A A . 4 TYR HH 1 1
10 2577 1 1 5 TYR N N 13.529 -0.070 -0.774 1.00 . A A . 4 TYR N 1 1
10 2578 1 1 5 TYR O O 15.947 -0.927 -1.307 1.00 . A A . 4 TYR O 1 1
10 2579 1 1 5 TYR OH O 14.998 -6.413 -0.767 1.00 . A A . 4 TYR OH 1 1
10 2580 1 1 6 GLU C C 18.897 -1.047 1.395 1.00 . A A . 5 GLU C 1 1
10 2581 1 1 6 GLU CA C 18.203 -0.468 0.167 1.00 . A A . 5 GLU CA 1 1
10 2582 1 1 6 GLU CB C 18.900 0.808 -0.328 1.00 . A A . 5 GLU CB 1 1
10 2583 1 1 6 GLU CD C 21.175 -0.211 0.035 1.00 . A A . 5 GLU CD 1 1
10 2584 1 1 6 GLU CG C 20.256 0.471 -0.962 1.00 . A A . 5 GLU CG 1 1
10 2585 1 1 6 GLU H H 16.689 0.211 1.485 1.00 . A A . 5 GLU H 1 1
10 2586 1 1 6 GLU HA H 18.191 -1.211 -0.623 1.00 . A A . 5 GLU HA 1 1
10 2587 1 1 6 GLU HB2 H 18.275 1.295 -1.061 1.00 . A A . 5 GLU HB2 1 1
10 2588 1 1 6 GLU HB3 H 19.054 1.472 0.505 1.00 . A A . 5 GLU HB3 1 1
10 2589 1 1 6 GLU HG2 H 20.098 -0.187 -1.804 1.00 . A A . 5 GLU HG2 1 1
10 2590 1 1 6 GLU HG3 H 20.722 1.382 -1.309 1.00 . A A . 5 GLU HG3 1 1
10 2591 1 1 6 GLU N N 16.845 -0.158 0.590 1.00 . A A . 5 GLU N 1 1
10 2592 1 1 6 GLU O O 19.087 -0.347 2.390 1.00 . A A . 5 GLU O 1 1
10 2593 1 1 6 GLU OE1 O 21.478 0.392 1.051 1.00 . A A . 5 GLU OE1 1 1
10 2594 1 1 6 GLU OE2 O 21.534 -1.344 -0.224 1.00 . A A . 5 GLU OE2 1 1
10 2595 1 1 7 LYS C C 21.279 -3.353 2.204 1.00 . A A . 6 LYS C 1 1
10 2596 1 1 7 LYS CA C 19.829 -3.008 2.506 1.00 . A A . 6 LYS CA 1 1
10 2597 1 1 7 LYS CB C 19.001 -4.275 2.812 1.00 . A A . 6 LYS CB 1 1
10 2598 1 1 7 LYS CD C 20.822 -5.441 4.223 1.00 . A A . 6 LYS CD 1 1
10 2599 1 1 7 LYS CE C 21.025 -6.236 5.517 1.00 . A A . 6 LYS CE 1 1
10 2600 1 1 7 LYS CG C 19.362 -4.968 4.153 1.00 . A A . 6 LYS CG 1 1
10 2601 1 1 7 LYS H H 19.005 -2.864 0.550 1.00 . A A . 6 LYS H 1 1
10 2602 1 1 7 LYS HA H 19.804 -2.360 3.358 1.00 . A A . 6 LYS HA 1 1
10 2603 1 1 7 LYS HB2 H 17.957 -4.003 2.842 1.00 . A A . 6 LYS HB2 1 1
10 2604 1 1 7 LYS HB3 H 19.147 -4.982 2.007 1.00 . A A . 6 LYS HB3 1 1
10 2605 1 1 7 LYS HD2 H 21.054 -6.061 3.371 1.00 . A A . 6 LYS HD2 1 1
10 2606 1 1 7 LYS HD3 H 21.480 -4.595 4.251 1.00 . A A . 6 LYS HD3 1 1
10 2607 1 1 7 LYS HE2 H 20.355 -7.082 5.528 1.00 . A A . 6 LYS HE2 1 1
10 2608 1 1 7 LYS HE3 H 22.046 -6.584 5.569 1.00 . A A . 6 LYS HE3 1 1
10 2609 1 1 7 LYS HG2 H 19.180 -4.275 4.963 1.00 . A A . 6 LYS HG2 1 1
10 2610 1 1 7 LYS HG3 H 18.713 -5.821 4.283 1.00 . A A . 6 LYS HG3 1 1
10 2611 1 1 7 LYS HZ1 H 19.712 -5.233 6.784 1.00 . A A . 6 LYS HZ1 1 1
10 2612 1 1 7 LYS HZ2 H 21.193 -4.435 6.548 1.00 . A A . 6 LYS HZ2 1 1
10 2613 1 1 7 LYS HZ3 H 21.113 -5.804 7.552 1.00 . A A . 6 LYS HZ3 1 1
10 2614 1 1 7 LYS N N 19.220 -2.341 1.350 1.00 . A A . 6 LYS N 1 1
10 2615 1 1 7 LYS NZ N 20.739 -5.361 6.689 1.00 . A A . 6 LYS NZ 1 1
10 2616 1 1 7 LYS O O 21.575 -4.150 1.313 1.00 . A A . 6 LYS O 1 1
10 2617 1 1 8 . CAA C 25.844 -2.172 2.201 1.00 . A A . 7 4G6 CAA 1 1
10 2618 1 1 8 . CAB C 23.913 -1.714 0.708 1.00 . A A . 7 4G6 CAB 1 1
10 2619 1 1 8 . CAE C 23.605 -3.066 2.766 1.00 . A A . 7 4G6 CAE 1 1
10 2620 1 1 8 . CAF C 24.345 -1.868 2.168 1.00 . A A . 7 4G6 CAF 1 1
10 2621 1 1 8 . HAA H 26.028 -3.143 1.742 1.00 . A A . 7 4G6 HAA 1 1
10 2622 1 1 8 . HAB H 26.188 -2.190 3.236 1.00 . A A . 7 4G6 HAB 1 1
10 2623 1 1 8 . HAC H 26.385 -1.402 1.651 1.00 . A A . 7 4G6 HAC 1 1
10 2624 1 1 8 . HAD H 23.456 -0.735 0.565 1.00 . A A . 7 4G6 HAD 1 1
10 2625 1 1 8 . HAE H 23.191 -2.490 0.458 1.00 . A A . 7 4G6 HAE 1 1
10 2626 1 1 8 . HAF H 24.784 -1.809 0.059 1.00 . A A . 7 4G6 HAF 1 1
10 2627 1 1 8 . HAG H 23.707 -3.912 2.086 1.00 . A A . 7 4G6 HAG 1 1
10 2628 1 1 8 . HAH H 24.052 -3.327 3.724 1.00 . A A . 7 4G6 HAH 1 1
10 2629 1 1 8 . HAI H 21.890 -2.149 3.684 1.00 . A A . 7 4G6 HAI 1 1
10 2630 1 1 8 . HAL H 24.021 0.231 2.396 1.00 . A A . 7 4G6 HAL 1 1
10 2631 1 1 8 . NAC N 22.177 -2.775 2.960 1.00 . A A . 7 4G6 NAC 1 1
10 2632 1 1 8 . NAD N 24.075 -0.626 2.908 1.00 . A A . 7 4G6 NAD 1 1
10 2633 1 1 9 DPR C C 23.942 -0.592 4.219 1.00 . A A . 8 DPR C 1 1
10 2634 1 1 9 DPR CA C 23.713 0.775 4.894 1.00 . A A . 8 DPR CA 1 1
10 2635 1 1 9 DPR CB C 23.971 1.948 3.957 1.00 . A A . 8 DPR CB 1 1
10 2636 1 1 9 DPR CD C 22.173 2.514 5.526 1.00 . A A . 8 DPR CD 1 1
10 2637 1 1 9 DPR CG C 23.292 3.111 4.637 1.00 . A A . 8 DPR CG 1 1
10 2638 1 1 9 DPR HA H 24.371 0.867 5.742 1.00 . A A . 8 DPR HA 1 1
10 2639 1 1 9 DPR HB2 H 25.035 2.123 3.854 1.00 . A A . 8 DPR HB2 1 1
10 2640 1 1 9 DPR HB3 H 23.519 1.769 2.994 1.00 . A A . 8 DPR HB3 1 1
10 2641 1 1 9 DPR HD2 H 22.331 2.769 6.567 1.00 . A A . 8 DPR HD2 1 1
10 2642 1 1 9 DPR HD3 H 21.204 2.847 5.197 1.00 . A A . 8 DPR HD3 1 1
10 2643 1 1 9 DPR HG2 H 24.008 3.651 5.248 1.00 . A A . 8 DPR HG2 1 1
10 2644 1 1 9 DPR HG3 H 22.861 3.776 3.902 1.00 . A A . 8 DPR HG3 1 1
10 2645 1 1 9 DPR N N 22.313 1.064 5.320 1.00 . A A . 8 DPR N 1 1
10 2646 1 1 9 DPR O O 24.040 -1.600 4.918 1.00 . A A . 8 DPR O 1 1
10 2647 1 1 10 VAL C C 21.371 0.157 5.463 1.00 . A A . 9 VAL C 1 1
10 2648 1 1 10 VAL CA C 19.981 0.634 5.957 1.00 . A A . 9 VAL CA 1 1
10 2649 1 1 10 VAL CB C 19.273 -0.493 6.738 1.00 . A A . 9 VAL CB 1 1
10 2650 1 1 10 VAL CG1 C 18.934 -1.665 5.821 1.00 . A A . 9 VAL CG1 1 1
10 2651 1 1 10 VAL CG2 C 20.184 -0.976 7.869 1.00 . A A . 9 VAL CG2 1 1
10 2652 1 1 10 VAL H H 18.935 0.454 4.109 1.00 . A A . 9 VAL H 1 1
10 2653 1 1 10 VAL HA H 20.125 1.458 6.642 1.00 . A A . 9 VAL HA 1 1
10 2654 1 1 10 VAL HB H 18.359 -0.117 7.156 1.00 . A A . 9 VAL HB 1 1
10 2655 1 1 10 VAL HG11 H 18.556 -1.286 4.885 1.00 . A A . 9 VAL HG11 1 1
10 2656 1 1 10 VAL HG12 H 18.178 -2.279 6.289 1.00 . A A . 9 VAL HG12 1 1
10 2657 1 1 10 VAL HG13 H 19.811 -2.256 5.651 1.00 . A A . 9 VAL HG13 1 1
10 2658 1 1 10 VAL HG21 H 20.973 -1.588 7.458 1.00 . A A . 9 VAL HG21 1 1
10 2659 1 1 10 VAL HG22 H 19.608 -1.558 8.572 1.00 . A A . 9 VAL HG22 1 1
10 2660 1 1 10 VAL HG23 H 20.615 -0.124 8.375 1.00 . A A . 9 VAL HG23 1 1
10 2661 1 1 10 VAL N N 19.123 1.077 4.842 1.00 . A A . 9 VAL N 1 1
10 2662 1 1 10 VAL O O 21.595 -1.030 5.248 1.00 . A A . 9 VAL O 1 1
10 2663 1 1 11 GLN C C 18.589 2.312 4.806 1.00 . A A . 10 GLN C 1 1
10 2664 1 1 11 GLN CA C 17.712 2.650 3.592 1.00 . A A . 10 GLN CA 1 1
10 2665 1 1 11 GLN CB C 18.114 4.015 3.012 1.00 . A A . 10 GLN CB 1 1
10 2666 1 1 11 GLN CD C 19.935 5.378 1.982 1.00 . A A . 10 GLN CD 1 1
10 2667 1 1 11 GLN CG C 19.568 4.010 2.547 1.00 . A A . 10 GLN CG 1 1
10 2668 1 1 11 GLN H H 16.003 3.517 4.495 1.00 . A A . 10 GLN H 1 1
10 2669 1 1 11 GLN HA H 17.841 1.892 2.833 1.00 . A A . 10 GLN HA 1 1
10 2670 1 1 11 GLN HB2 H 17.475 4.245 2.172 1.00 . A A . 10 GLN HB2 1 1
10 2671 1 1 11 GLN HB3 H 17.986 4.773 3.771 1.00 . A A . 10 GLN HB3 1 1
10 2672 1 1 11 GLN HE21 H 21.381 5.698 3.305 1.00 . A A . 10 GLN HE21 1 1
10 2673 1 1 11 GLN HE22 H 21.141 6.943 2.176 1.00 . A A . 10 GLN HE22 1 1
10 2674 1 1 11 GLN HG2 H 20.210 3.781 3.376 1.00 . A A . 10 GLN HG2 1 1
10 2675 1 1 11 GLN HG3 H 19.691 3.268 1.778 1.00 . A A . 10 GLN HG3 1 1
10 2676 1 1 11 GLN N N 16.300 2.742 3.974 1.00 . A A . 10 GLN N 1 1
10 2677 1 1 11 GLN NE2 N 20.899 6.063 2.533 1.00 . A A . 10 GLN NE2 1 1
10 2678 1 1 11 GLN O O 18.779 3.146 5.691 1.00 . A A . 10 GLN O 1 1
10 2679 1 1 11 GLN OE1 O 19.323 5.837 1.017 1.00 . A A . 10 GLN OE1 1 1
10 2680 1 1 12 LYS C C 15.398 1.837 3.601 1.00 . A A . 11 LYS C 1 1
10 2681 1 1 12 LYS CA C 13.963 2.122 4.042 1.00 . A A . 11 LYS CA 1 1
10 2682 1 1 12 LYS CB C 13.223 0.795 4.326 1.00 . A A . 11 LYS CB 1 1
10 2683 1 1 12 LYS CD C 11.895 1.134 6.544 1.00 . A A . 11 LYS CD 1 1
10 2684 1 1 12 LYS CE C 12.800 2.248 7.082 1.00 . A A . 11 LYS CE 1 1
10 2685 1 1 12 LYS CG C 11.841 1.001 4.989 1.00 . A A . 11 LYS CG 1 1
10 2686 1 1 12 LYS H H 13.563 2.698 2.044 1.00 . A A . 11 LYS H 1 1
10 2687 1 1 12 LYS HA H 13.990 2.734 4.910 1.00 . A A . 11 LYS HA 1 1
10 2688 1 1 12 LYS HB2 H 13.086 0.273 3.395 1.00 . A A . 11 LYS HB2 1 1
10 2689 1 1 12 LYS HB3 H 13.837 0.188 4.977 1.00 . A A . 11 LYS HB3 1 1
10 2690 1 1 12 LYS HD2 H 10.896 1.315 6.902 1.00 . A A . 11 LYS HD2 1 1
10 2691 1 1 12 LYS HD3 H 12.233 0.190 6.950 1.00 . A A . 11 LYS HD3 1 1
10 2692 1 1 12 LYS HE2 H 12.685 2.289 8.157 1.00 . A A . 11 LYS HE2 1 1
10 2693 1 1 12 LYS HE3 H 13.829 2.031 6.859 1.00 . A A . 11 LYS HE3 1 1
10 2694 1 1 12 LYS HG2 H 11.402 1.894 4.590 1.00 . A A . 11 LYS HG2 1 1
10 2695 1 1 12 LYS HG3 H 11.206 0.162 4.738 1.00 . A A . 11 LYS HG3 1 1
10 2696 1 1 12 LYS HZ1 H 13.220 4.003 6.053 1.00 . A A . 11 LYS HZ1 1 1
10 2697 1 1 12 LYS HZ2 H 12.064 4.181 7.285 1.00 . A A . 11 LYS HZ2 1 1
10 2698 1 1 12 LYS HZ3 H 11.643 3.428 5.821 1.00 . A A . 11 LYS HZ3 1 1
10 2699 1 1 12 LYS N N 13.295 2.882 2.971 1.00 . A A . 11 LYS N 1 1
10 2700 1 1 12 LYS NZ N 12.402 3.564 6.518 1.00 . A A . 11 LYS NZ 1 1
10 2701 1 1 12 LYS O O 15.670 0.857 2.911 1.00 . A A . 11 LYS O 1 1
10 2702 1 1 13 PHE C C 12.383 3.837 3.176 1.00 . A A . 12 PHE C 1 1
10 2703 1 1 13 PHE CA C 11.893 4.523 1.899 1.00 . A A . 12 PHE CA 1 1
10 2704 1 1 13 PHE CB C 12.177 6.040 2.041 1.00 . A A . 12 PHE CB 1 1
10 2705 1 1 13 PHE CD1 C 11.614 6.223 -0.472 1.00 . A A . 12 PHE CD1 1 1
10 2706 1 1 13 PHE CD2 C 12.151 8.221 0.801 1.00 . A A . 12 PHE CD2 1 1
10 2707 1 1 13 PHE CE1 C 11.470 7.011 -1.623 1.00 . A A . 12 PHE CE1 1 1
10 2708 1 1 13 PHE CE2 C 12.007 8.996 -0.353 1.00 . A A . 12 PHE CE2 1 1
10 2709 1 1 13 PHE CG C 11.958 6.832 0.755 1.00 . A A . 12 PHE CG 1 1
10 2710 1 1 13 PHE CZ C 11.669 8.392 -1.563 1.00 . A A . 12 PHE CZ 1 1
10 2711 1 1 13 PHE H H 10.294 3.439 0.993 1.00 . A A . 12 PHE H 1 1
10 2712 1 1 13 PHE HA H 12.507 4.147 1.093 1.00 . A A . 12 PHE HA 1 1
10 2713 1 1 13 PHE HB2 H 11.566 6.455 2.817 1.00 . A A . 12 PHE HB2 1 1
10 2714 1 1 13 PHE HB3 H 13.211 6.160 2.337 1.00 . A A . 12 PHE HB3 1 1
10 2715 1 1 13 PHE HD1 H 11.448 5.165 -0.538 1.00 . A A . 12 PHE HD1 1 1
10 2716 1 1 13 PHE HD2 H 12.415 8.695 1.736 1.00 . A A . 12 PHE HD2 1 1
10 2717 1 1 13 PHE HE1 H 11.221 6.547 -2.563 1.00 . A A . 12 PHE HE1 1 1
10 2718 1 1 13 PHE HE2 H 12.159 10.064 -0.308 1.00 . A A . 12 PHE HE2 1 1
10 2719 1 1 13 PHE HZ H 11.559 8.992 -2.453 1.00 . A A . 12 PHE HZ 1 1
10 2720 1 1 13 PHE N N 10.478 4.203 1.570 1.00 . A A . 12 PHE N 1 1
10 2721 1 1 13 PHE O O 11.997 4.194 4.284 1.00 . A A . 12 PHE O 1 1
10 2722 1 1 14 ILE C C 9.429 4.895 2.012 1.00 . A A . 13 ILE C 1 1
10 2723 1 1 14 ILE CA C 8.066 4.383 1.545 1.00 . A A . 13 ILE CA 1 1
10 2724 1 1 14 ILE CB C 7.698 3.029 2.196 1.00 . A A . 13 ILE CB 1 1
10 2725 1 1 14 ILE CD1 C 8.841 3.558 4.446 1.00 . A A . 13 ILE CD1 1 1
10 2726 1 1 14 ILE CG1 C 7.549 3.129 3.739 1.00 . A A . 13 ILE CG1 1 1
10 2727 1 1 14 ILE CG2 C 8.761 1.980 1.844 1.00 . A A . 13 ILE CG2 1 1
10 2728 1 1 14 ILE H H 8.460 3.399 -0.306 1.00 . A A . 13 ILE H 1 1
10 2729 1 1 14 ILE HA H 7.327 5.106 1.816 1.00 . A A . 13 ILE HA 1 1
10 2730 1 1 14 ILE HB H 6.754 2.704 1.777 1.00 . A A . 13 ILE HB 1 1
10 2731 1 1 14 ILE HD11 H 8.870 3.111 5.430 1.00 . A A . 13 ILE HD11 1 1
10 2732 1 1 14 ILE HD12 H 8.860 4.629 4.546 1.00 . A A . 13 ILE HD12 1 1
10 2733 1 1 14 ILE HD13 H 9.696 3.229 3.885 1.00 . A A . 13 ILE HD13 1 1
10 2734 1 1 14 ILE HG12 H 6.778 3.848 3.967 1.00 . A A . 13 ILE HG12 1 1
10 2735 1 1 14 ILE HG13 H 7.247 2.164 4.119 1.00 . A A . 13 ILE HG13 1 1
10 2736 1 1 14 ILE HG21 H 8.367 0.992 2.028 1.00 . A A . 13 ILE HG21 1 1
10 2737 1 1 14 ILE HG22 H 9.641 2.133 2.450 1.00 . A A . 13 ILE HG22 1 1
10 2738 1 1 14 ILE HG23 H 9.025 2.072 0.800 1.00 . A A . 13 ILE HG23 1 1
10 2739 1 1 14 ILE N N 8.066 4.212 0.089 1.00 . A A . 13 ILE N 1 1
10 2740 1 1 14 ILE O O 9.504 5.881 2.737 1.00 . A A . 13 ILE O 1 1
10 2741 1 1 15 ARG C C 7.525 5.120 -0.720 1.00 . A A . 14 ARG C 1 1
10 2742 1 1 15 ARG CA C 7.585 4.790 -2.200 1.00 . A A . 14 ARG CA 1 1
10 2743 1 1 15 ARG CB C 8.882 5.305 -2.783 1.00 . A A . 14 ARG CB 1 1
10 2744 1 1 15 ARG CD C 10.266 5.378 -4.846 1.00 . A A . 14 ARG CD 1 1
10 2745 1 1 15 ARG CG C 8.968 4.858 -4.236 1.00 . A A . 14 ARG CG 1 1
10 2746 1 1 15 ARG CZ C 9.452 7.588 -5.468 1.00 . A A . 14 ARG CZ 1 1
10 2747 1 1 15 ARG H H 6.192 6.287 -2.769 1.00 . A A . 14 ARG H 1 1
10 2748 1 1 15 ARG HA H 7.584 3.724 -2.307 1.00 . A A . 14 ARG HA 1 1
10 2749 1 1 15 ARG HB2 H 8.905 6.383 -2.726 1.00 . A A . 14 ARG HB2 1 1
10 2750 1 1 15 ARG HB3 H 9.708 4.885 -2.230 1.00 . A A . 14 ARG HB3 1 1
10 2751 1 1 15 ARG HD2 H 11.106 4.974 -4.301 1.00 . A A . 14 ARG HD2 1 1
10 2752 1 1 15 ARG HD3 H 10.326 5.066 -5.880 1.00 . A A . 14 ARG HD3 1 1
10 2753 1 1 15 ARG HE H 10.948 7.262 -4.183 1.00 . A A . 14 ARG HE 1 1
10 2754 1 1 15 ARG HG2 H 8.957 3.777 -4.268 1.00 . A A . 14 ARG HG2 1 1
10 2755 1 1 15 ARG HG3 H 8.125 5.244 -4.784 1.00 . A A . 14 ARG HG3 1 1
10 2756 1 1 15 ARG HH11 H 8.574 6.044 -6.390 1.00 . A A . 14 ARG HH11 1 1
10 2757 1 1 15 ARG HH12 H 7.957 7.610 -6.799 1.00 . A A . 14 ARG HH12 1 1
10 2758 1 1 15 ARG HH21 H 10.145 9.311 -4.719 1.00 . A A . 14 ARG HH21 1 1
10 2759 1 1 15 ARG HH22 H 8.846 9.457 -5.855 1.00 . A A . 14 ARG HH22 1 1
10 2760 1 1 15 ARG N N 6.443 5.352 -2.926 1.00 . A A . 14 ARG N 1 1
10 2761 1 1 15 ARG NE N 10.302 6.833 -4.776 1.00 . A A . 14 ARG NE 1 1
10 2762 1 1 15 ARG NH1 N 8.594 7.038 -6.282 1.00 . A A . 14 ARG NH1 1 1
10 2763 1 1 15 ARG NH2 N 9.484 8.887 -5.337 1.00 . A A . 14 ARG NH2 1 1
10 2764 1 1 15 ARG O O 6.992 6.154 -0.319 1.00 . A A . 14 ARG O 1 1
10 2765 1 1 16 ACE C C 5.735 4.627 -3.797 1.00 . A A . 15 ACE C 1 1
10 2766 1 1 16 ACE CH3 C 4.575 5.345 -4.478 1.00 . A A . 15 ACE CH3 1 1
10 2767 1 1 16 ACE H1 H 4.380 6.277 -3.971 1.00 . A A . 15 ACE H1 1 1
10 2768 1 1 16 ACE H2 H 3.692 4.723 -4.438 1.00 . A A . 15 ACE H2 1 1
10 2769 1 1 16 ACE H3 H 4.829 5.542 -5.510 1.00 . A A . 15 ACE H3 1 1
10 2770 1 1 16 ACE O O 5.984 3.446 -4.051 1.00 . A A . 15 ACE O 1 1
stop_
save_