NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
623287 |
6b34   |
30346 | cing | 4-filtered-FRED | STAR | entry | full | 59 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6b34
# This FRED archive file contains, for PDB entry <6b34>:
#
# - 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_6b34
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6b34
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1292.48
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 $Tyrocidine_A_analogue_D_PHE_BE2_PHE_D_PHE_ASN_GLN_TYR_VAL_ORN_LEU A . 1 1
stop_
save_
save_Tyrocidine_A_analogue_D_PHE_BE2_PHE_D_PHE_ASN_GLN_TYR_VAL_ORN_LEU
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Tyrocidine A analogue D PHE BE2 PHE D PHE ASN GLN TYR VAL ORN LEU"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XXFXNQYVXL
_Entity.Number_of_monomers 10
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . $. 1 1
2 BE2 $BE2 1 1
3 PHE . 1 1
4 . $. 1 1
5 ASN . 1 1
6 GLN . 1 1
7 TYR . 1 1
8 VAL . 1 1
9 ORN $ORN 1 1
10 LEU . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. 1 1 1 1
BE2 2 2 1 1
PHE 3 3 1 1
. 4 4 1 1
ASN 5 5 1 1
GLN 6 6 1 1
TYR 7 7 1 1
VAL 8 8 1 1
ORN 9 9 1 1
LEU 10 10 1 1
stop_
save_
save_ORN
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ORN
_Chem_comp.Type non-polymer
save_
save_BE2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID BE2
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
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 5 ASN H . 5 . HN 1 1
1 1 2 1 1 8 VAL H . 8 . HN 1 1
2 1 1 1 1 7 TYR H . 7 . HN 1 1
2 1 2 1 1 7 TYR QD . 7 . HD# 1 1
3 1 1 1 1 7 TYR H . 7 . HN 1 1
3 1 2 1 1 8 VAL H . 8 . HN 1 1
4 1 1 1 1 7 TYR HA . 7 . HA 1 1
4 1 2 1 1 8 VAL H . 8 . HN 1 1
5 1 1 1 1 6 GLN HA . 6 . HA 1 1
5 1 2 1 1 7 TYR H . 7 . HN 1 1
6 1 1 1 1 8 VAL HA . 8 . HA 1 1
6 1 2 1 1 9 ORN H . 9 . HN 1 1
7 1 1 1 1 5 ASN H . 5 . HN 1 1
7 1 2 1 1 9 ORN HA . 9 . HA 1 1
8 1 1 1 1 6 GLN H . 6 . HN 1 1
8 1 2 1 1 6 GLN HA . 6 . HA 1 1
9 1 1 1 1 9 ORN HA . 9 . HA 1 1
9 1 2 1 1 10 LEU H . 10 . HN 1 1
10 1 1 1 1 9 ORN H . 9 . HN 1 1
10 1 2 1 1 9 ORN HA . 9 . HA 1 1
11 1 1 1 1 10 LEU H . 10 . HN 1 1
11 1 2 1 1 10 LEU HA . 10 . HA 1 1
12 1 1 1 1 5 ASN HA . 5 . HA 1 1
12 1 2 1 1 6 GLN H . 6 . HN 1 1
13 1 1 1 1 5 ASN H . 5 . HN 1 1
13 1 2 1 1 5 ASN HA . 5 . HA 1 1
14 1 1 1 1 3 PHE H . 3 . HN 1 1
14 1 2 1 1 3 PHE HA . 3 . HA 1 1
15 1 1 1 1 6 GLN HE22 . 6 . HE22 1 1
15 1 2 1 1 6 GLN HG3 . 6 . HG2 1 1
16 1 1 1 1 5 ASN HB3 . 5 . HB1 1 1
16 1 2 1 1 5 ASN HD21 . 5 . HD21 1 1
17 1 1 1 1 6 GLN HE22 . 6 . HE22 1 1
17 1 2 1 1 6 GLN HG2 . 6 . HG1 1 1
18 1 1 1 1 8 VAL H . 8 . HN 1 1
18 1 2 1 1 8 VAL HB . 8 . HB 1 1
19 1 1 1 1 5 ASN H . 5 . HN 1 1
19 1 2 1 1 5 ASN HB3 . 5 . HB1 1 1
20 1 1 1 1 8 VAL H . 8 . HN 1 1
20 1 2 1 1 9 ORN H . 9 . HN 1 1
21 1 1 1 1 3 PHE H . 3 . HN 1 1
21 1 2 1 1 3 PHE HB3 . 3 . HB2 1 1
22 1 1 1 1 2 BE2 H6 . 2 . H6 1 1
22 1 2 1 1 3 PHE H . 3 . HN 1 1
23 1 1 1 1 8 VAL H . 8 . HN 1 1
23 1 2 1 1 8 VAL HA . 8 . HA 1 1
24 1 1 1 1 7 TYR HB2 . 7 . HB2 1 1
24 1 2 1 1 8 VAL H . 8 . HN 1 1
25 1 1 1 1 7 TYR HB3 . 7 . HB1 1 1
25 1 2 1 1 8 VAL H . 8 . HN 1 1
26 1 1 1 1 8 VAL H . 8 . HN 1 1
26 1 2 1 1 8 VAL QG . 8 . HG1# 1 1
27 1 1 1 1 7 TYR HA . 7 . HA 1 1
27 1 2 1 1 7 TYR QD . 7 . HD# 1 1
28 1 1 1 1 7 TYR HB3 . 7 . HB1 1 1
28 1 2 1 1 7 TYR QD . 7 . HD# 1 1
29 1 1 1 1 7 TYR HB2 . 7 . HB2 1 1
29 1 2 1 1 7 TYR QD . 7 . HD# 1 1
30 1 1 1 1 6 GLN QB . 6 . HB1 1 1
30 1 2 1 1 7 TYR QD . 7 . HD# 1 1
31 1 1 1 1 6 GLN QB . 6 . HB1 1 1
31 1 2 1 1 7 TYR QE . 7 . HE# 1 1
32 1 1 1 1 6 GLN QB . 6 . HB1 1 1
32 1 2 1 1 6 GLN HE21 . 6 . HE21 1 1
33 1 1 1 1 5 ASN HD22 . 5 . HD22 1 1
33 1 2 1 1 8 VAL QG . 8 . HG1# 1 1
34 1 1 1 1 8 VAL QG . 8 . HG1# 1 1
34 1 2 1 1 9 ORN H . 9 . HN 1 1
35 1 1 1 1 5 ASN HA . 5 . HA 1 1
35 1 2 1 1 5 ASN HB3 . 5 . HB1 1 1
36 1 1 1 1 5 ASN HA . 5 . HA 1 1
36 1 2 1 1 5 ASN HB2 . 5 . HB2 1 1
37 1 1 1 1 6 GLN HA . 6 . HA 1 1
37 1 2 1 1 6 GLN HG3 . 6 . HG2 1 1
38 1 1 1 1 6 GLN HA . 6 . HA 1 1
38 1 2 1 1 6 GLN HG2 . 6 . HG1 1 1
39 1 1 1 1 6 GLN HA . 6 . HA 1 1
39 1 2 1 1 6 GLN QB . 6 . HB1 1 1
40 1 1 1 1 3 PHE HA . 3 . HA 1 1
40 1 2 1 1 3 PHE HB3 . 3 . HB2 1 1
41 1 1 1 1 3 PHE HA . 3 . HA 1 1
41 1 2 1 1 3 PHE HB2 . 3 . HB1 1 1
42 1 1 1 1 9 ORN HA . 9 . HA 1 1
42 1 2 1 1 9 ORN HB2 . 9 . HB1 1 1
43 1 1 1 1 9 ORN HA . 9 . HA 1 1
43 1 2 1 1 9 ORN HB3 . 9 . HB2 1 1
44 1 1 1 1 9 ORN HA . 9 . HA 1 1
44 1 2 1 1 9 ORN HG2 . 9 . HG1 1 1
44 1 2 1 1 9 ORN HG3 . 9 . HG2 1 1
45 1 1 1 1 8 VAL HA . 8 . HA 1 1
45 1 2 1 1 8 VAL QG . 8 . HG1# 1 1
46 1 1 1 1 7 TYR HA . 7 . HA 1 1
46 1 2 1 1 7 TYR HB2 . 7 . HB2 1 1
47 1 1 1 1 7 TYR HA . 7 . HA 1 1
47 1 2 1 1 7 TYR HB3 . 7 . HB1 1 1
48 1 1 1 1 8 VAL HA . 8 . HA 1 1
48 1 2 1 1 8 VAL HB . 8 . HB 1 1
49 1 1 1 1 10 LEU HA . 10 . HA 1 1
49 1 2 1 1 10 LEU QB . 10 . HB1 1 1
50 1 1 1 1 10 LEU HA . 10 . HA 1 1
50 1 2 1 1 10 LEU MD1 . 10 . HD1# 1 1
51 1 1 1 1 10 LEU HA . 10 . HA 1 1
51 1 2 1 1 10 LEU MD2 . 10 . HD2# 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 3.7 3.0 4.4 1 1
2 1 . . . . . 3.0 2.4 3.6 1 1
3 1 . . . . . 2.6 2.1 3.1 1 1
4 1 . . . . . 3.0 2.4 3.6 1 1
5 1 . . . . . 2.9 2.3 3.5 1 1
6 1 . . . . . 2.2 1.8 2.6 1 1
7 1 . . . . . 3.9 3.1 4.7 1 1
8 1 . . . . . 2.8 2.2 3.4 1 1
9 1 . . . . . 2.3 1.8 2.8 1 1
10 1 . . . . . 2.8 2.2 3.4 1 1
11 1 . . . . . 2.4 1.9 2.9 1 1
12 1 . . . . . 2.5 2.0 3.0 1 1
13 1 . . . . . 2.9 2.3 3.5 1 1
14 1 . . . . . 2.3 1.8 2.8 1 1
15 1 . . . . . 2.9 2.3 3.5 1 1
16 1 . . . . . 2.7 2.2 3.2 1 1
17 1 . . . . . 3.0 2.4 3.6 1 1
18 1 . . . . . 2.7 2.2 3.2 1 1
19 1 . . . . . 3.1 2.5 3.7 1 1
20 1 . . . . . 3.4 2.7 4.1 1 1
21 1 . . . . . 2.7 2.2 3.2 1 1
22 1 . . . . . 2.4 1.9 2.9 1 1
23 1 . . . . . 2.9 2.3 3.5 1 1
24 1 . . . . . 2.9 2.3 3.5 1 1
25 1 . . . . . 3.3 2.6 4.0 1 1
26 1 . . . . . 2.7 2.2 3.2 1 1
27 1 . . . . . 2.4 1.9 2.9 1 1
28 1 . . . . . 2.5 2.0 3.0 1 1
29 1 . . . . . 2.3 1.8 2.8 1 1
30 1 . . . . . 3.5 2.8 4.2 1 1
31 1 . . . . . 4.0 3.2 4.8 1 1
32 1 . . . . . 4.0 3.2 4.8 1 1
33 1 . . . . . 3.5 2.8 4.2 1 1
34 1 . . . . . 3.3 2.6 4.0 1 1
35 1 . . . . . 2.4 1.9 2.9 1 1
36 1 . . . . . 2.4 1.9 2.9 1 1
37 1 . . . . . 2.9 2.3 3.5 1 1
38 1 . . . . . 2.9 2.3 3.5 1 1
39 1 . . . . . 2.2 1.8 2.6 1 1
40 1 . . . . . 2.4 1.9 2.9 1 1
41 1 . . . . . 2.5 2.0 3.0 1 1
42 1 . . . . . 2.8 2.2 3.4 1 1
43 1 . . . . . 2.8 2.2 3.4 1 1
44 1 . . . . . 2.7 2.2 3.2 1 1
45 1 . . . . . 2.3 1.8 2.8 1 1
46 1 . . . . . 2.8 2.2 3.4 1 1
47 1 . . . . . 2.4 1.9 2.9 1 1
48 1 . . . . . 2.6 2.1 3.1 1 1
49 1 . . . . . 2.2 1.8 2.6 1 1
50 1 . . . . . 2.5 2.0 3.0 1 1
51 1 . . . . . 2.8 2.2 3.4 1 1
stop_
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 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 5 ASN N . 5 . N 1 2
1 1 2 1 1 8 VAL C . 8 . C 1 2
2 1 1 1 1 5 ASN H . 5 . HN 1 2
2 1 2 1 1 8 VAL O . 8 . O 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 . . . . . 2.85 1.7 4.0 1 2
2 1 . . . . . 1.9 1.8 2.0 1 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 2 BE2 C 1 1 3 PHE N 1 1 3 PHE CA 1 1 3 PHE C -145.0 -95.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
2 . 1 1 5 ASN C 1 1 6 GLN N 1 1 6 GLN CA 1 1 6 GLN C -80.0 -40.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
3 . 1 1 6 GLN C 1 1 7 TYR N 1 1 7 TYR CA 1 1 7 TYR C -145.0 -95.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
4 . 1 1 7 TYR C 1 1 8 VAL N 1 1 8 VAL CA 1 1 8 VAL C -140.0 -100.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
5 . 1 1 8 VAL C 1 1 9 ORN N 1 1 9 ORN CA 1 1 9 ORN C -150.0 -89.99999 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1
6 . 1 1 9 ORN C 1 1 10 LEU N 1 1 10 LEU CA 1 1 10 LEU C -140.0 -100.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 . C C 4.089 -5.073 -3.409 1.00 . A A . 1 DPN C 1 1
1 2 1 1 1 . CA C 3.203 -5.719 -2.334 1.00 . A A . 1 DPN CA 1 1
1 3 1 1 1 . CB C 3.866 -5.816 -0.933 1.00 . A A . 1 DPN CB 1 1
1 4 1 1 1 . CD1 C 5.579 -4.077 -0.281 1.00 . A A . 1 DPN CD1 1 1
1 5 1 1 1 . CD2 C 6.338 -6.070 -1.434 1.00 . A A . 1 DPN CD2 1 1
1 6 1 1 1 . CE1 C 6.909 -3.589 -0.236 1.00 . A A . 1 DPN CE1 1 1
1 7 1 1 1 . CE2 C 7.672 -5.594 -1.394 1.00 . A A . 1 DPN CE2 1 1
1 8 1 1 1 . CG C 5.285 -5.311 -0.885 1.00 . A A . 1 DPN CG 1 1
1 9 1 1 1 . CZ C 7.955 -4.347 -0.798 1.00 . A A . 1 DPN CZ 1 1
1 10 1 1 1 . H1 H 1.173 -5.587 -2.956 1.00 . A A . 1 DPN H1 1 1
1 11 1 1 1 . HA H 3.080 -6.752 -2.659 1.00 . A A . 1 DPN HA 1 1
1 12 1 1 1 . HB2 H 3.276 -5.279 -0.200 1.00 . A A . 1 DPN HB2 1 1
1 13 1 1 1 . HB3 H 3.873 -6.866 -0.637 1.00 . A A . 1 DPN HB3 1 1
1 14 1 1 1 . HD1 H 4.782 -3.489 0.152 1.00 . A A . 1 DPN HD1 1 1
1 15 1 1 1 . HD2 H 6.127 -7.024 -1.901 1.00 . A A . 1 DPN HD2 1 1
1 16 1 1 1 . HE1 H 7.120 -2.633 0.223 1.00 . A A . 1 DPN HE1 1 1
1 17 1 1 1 . HE2 H 8.470 -6.180 -1.827 1.00 . A A . 1 DPN HE2 1 1
1 18 1 1 1 . HZ H 8.969 -3.975 -0.773 1.00 . A A . 1 DPN HZ 1 1
1 19 1 1 1 . N N 1.842 -5.130 -2.355 1.00 . A A . 1 DPN N 1 1
1 20 1 1 1 . O O 4.550 -5.769 -4.305 1.00 . A A . 1 DPN O 1 1
1 21 1 1 2 BE2 C C 5.077 -1.048 -2.287 1.00 . A A . 2 BE2 C 1 1
1 22 1 1 2 BE2 C1 C 5.453 -1.517 -3.692 1.00 . A A . 2 BE2 C1 1 1
1 23 1 1 2 BE2 C2 C 5.054 -2.815 -4.158 1.00 . A A . 2 BE2 C2 1 1
1 24 1 1 2 BE2 C3 C 5.400 -3.203 -5.475 1.00 . A A . 2 BE2 C3 1 1
1 25 1 1 2 BE2 C4 C 6.129 -2.351 -6.311 1.00 . A A . 2 BE2 C4 1 1
1 26 1 1 2 BE2 C5 C 6.525 -1.094 -5.860 1.00 . A A . 2 BE2 C5 1 1
1 27 1 1 2 BE2 C6 C 6.194 -0.672 -4.571 1.00 . A A . 2 BE2 C6 1 1
1 28 1 1 2 BE2 H3 H 5.102 -4.165 -5.867 1.00 . A A . 2 BE2 H3 1 1
1 29 1 1 2 BE2 H4 H 6.383 -2.671 -7.317 1.00 . A A . 2 BE2 H4 1 1
1 30 1 1 2 BE2 H5 H 7.089 -0.438 -6.518 1.00 . A A . 2 BE2 H5 1 1
1 31 1 1 2 BE2 H6 H 6.513 0.319 -4.273 1.00 . A A . 2 BE2 H6 1 1
1 32 1 1 2 BE2 HN21 H 3.897 -3.253 -2.475 1.00 . A A . 2 BE2 HN21 1 1
1 33 1 1 2 BE2 N2 N 4.302 -3.699 -3.297 1.00 . A A . 2 BE2 N2 1 1
1 34 1 1 2 BE2 O1 O 4.335 -1.691 -1.569 1.00 . A A . 2 BE2 O1 1 1
1 35 1 1 3 PHE C C 4.088 1.617 -0.724 1.00 . A A . 3 PHE C 1 1
1 36 1 1 3 PHE CA C 5.293 0.713 -0.572 1.00 . A A . 3 PHE CA 1 1
1 37 1 1 3 PHE CB C 6.477 1.487 0.007 1.00 . A A . 3 PHE CB 1 1
1 38 1 1 3 PHE CD1 C 6.215 1.351 2.524 1.00 . A A . 3 PHE CD1 1 1
1 39 1 1 3 PHE CD2 C 5.868 3.490 1.433 1.00 . A A . 3 PHE CD2 1 1
1 40 1 1 3 PHE CE1 C 5.927 1.942 3.783 1.00 . A A . 3 PHE CE1 1 1
1 41 1 1 3 PHE CE2 C 5.579 4.092 2.683 1.00 . A A . 3 PHE CE2 1 1
1 42 1 1 3 PHE CG C 6.186 2.120 1.345 1.00 . A A . 3 PHE CG 1 1
1 43 1 1 3 PHE CZ C 5.608 3.315 3.859 1.00 . A A . 3 PHE CZ 1 1
1 44 1 1 3 PHE H H 6.176 0.681 -2.448 1.00 . A A . 3 PHE H 1 1
1 45 1 1 3 PHE HA H 5.064 -0.095 0.064 1.00 . A A . 3 PHE HA 1 1
1 46 1 1 3 PHE HB2 H 7.321 0.806 0.116 1.00 . A A . 3 PHE HB2 1 1
1 47 1 1 3 PHE HB3 H 6.756 2.270 -0.695 1.00 . A A . 3 PHE HB3 1 1
1 48 1 1 3 PHE HD1 H 6.459 0.300 2.473 1.00 . A A . 3 PHE HD1 1 1
1 49 1 1 3 PHE HD2 H 5.835 4.090 0.534 1.00 . A A . 3 PHE HD2 1 1
1 50 1 1 3 PHE HE1 H 5.960 1.343 4.682 1.00 . A A . 3 PHE HE1 1 1
1 51 1 1 3 PHE HE2 H 5.328 5.142 2.732 1.00 . A A . 3 PHE HE2 1 1
1 52 1 1 3 PHE HZ H 5.390 3.770 4.815 1.00 . A A . 3 PHE HZ 1 1
1 53 1 1 3 PHE N N 5.589 0.168 -1.867 1.00 . A A . 3 PHE N 1 1
1 54 1 1 3 PHE O O 4.206 2.745 -1.196 1.00 . A A . 3 PHE O 1 1
1 55 1 1 4 . C C 1.405 2.532 0.850 1.00 . A A . 4 DPN C 1 1
1 56 1 1 4 . CA C 1.604 1.663 -0.388 1.00 . A A . 4 DPN CA 1 1
1 57 1 1 4 . CB C 1.299 2.429 -1.698 1.00 . A A . 4 DPN CB 1 1
1 58 1 1 4 . CD1 C 2.504 1.284 -3.628 1.00 . A A . 4 DPN CD1 1 1
1 59 1 1 4 . CD2 C 0.103 1.002 -3.416 1.00 . A A . 4 DPN CD2 1 1
1 60 1 1 4 . CE1 C 2.506 0.462 -4.783 1.00 . A A . 4 DPN CE1 1 1
1 61 1 1 4 . CE2 C 0.092 0.191 -4.582 1.00 . A A . 4 DPN CE2 1 1
1 62 1 1 4 . CG C 1.306 1.553 -2.934 1.00 . A A . 4 DPN CG 1 1
1 63 1 1 4 . CZ C 1.298 -0.084 -5.258 1.00 . A A . 4 DPN CZ 1 1
1 64 1 1 4 . HA H 0.884 0.849 -0.324 1.00 . A A . 4 DPN HA 1 1
1 65 1 1 4 . HB2 H 0.313 2.879 -1.614 1.00 . A A . 4 DPN HB2 1 1
1 66 1 1 4 . HB3 H 2.013 3.235 -1.830 1.00 . A A . 4 DPN HB3 1 1
1 67 1 1 4 . HD1 H 3.432 1.710 -3.282 1.00 . A A . 4 DPN HD1 1 1
1 68 1 1 4 . HD2 H -0.823 1.205 -2.900 1.00 . A A . 4 DPN HD2 1 1
1 69 1 1 4 . HE1 H 3.431 0.261 -5.303 1.00 . A A . 4 DPN HE1 1 1
1 70 1 1 4 . HE2 H -0.838 -0.218 -4.949 1.00 . A A . 4 DPN HE2 1 1
1 71 1 1 4 . HZ H 1.295 -0.707 -6.141 1.00 . A A . 4 DPN HZ 1 1
1 72 1 1 4 . N N 2.948 1.057 -0.319 1.00 . A A . 4 DPN N 1 1
1 73 1 1 4 . O O 2.364 2.945 1.491 1.00 . A A . 4 DPN O 1 1
1 74 1 1 5 ASN C C -1.123 2.873 3.256 1.00 . A A . 5 ASN C 1 1
1 75 1 1 5 ASN CA C -0.172 3.638 2.333 1.00 . A A . 5 ASN CA 1 1
1 76 1 1 5 ASN CB C -0.757 4.977 1.850 1.00 . A A . 5 ASN CB 1 1
1 77 1 1 5 ASN CG C -2.032 4.806 1.055 1.00 . A A . 5 ASN CG 1 1
1 78 1 1 5 ASN H H -0.610 2.395 0.654 1.00 . A A . 5 ASN H 1 1
1 79 1 1 5 ASN HA H 0.739 3.848 2.892 1.00 . A A . 5 ASN HA 1 1
1 80 1 1 5 ASN HB2 H -0.962 5.614 2.709 1.00 . A A . 5 ASN HB2 1 1
1 81 1 1 5 ASN HB3 H -0.013 5.474 1.231 1.00 . A A . 5 ASN HB3 1 1
1 82 1 1 5 ASN HD21 H -2.818 4.980 -0.777 1.00 . A A . 5 ASN HD21 1 1
1 83 1 1 5 ASN HD22 H -1.123 5.375 -0.654 1.00 . A A . 5 ASN HD22 1 1
1 84 1 1 5 ASN N N 0.157 2.797 1.190 1.00 . A A . 5 ASN N 1 1
1 85 1 1 5 ASN ND2 N -1.982 5.076 -0.223 1.00 . A A . 5 ASN ND2 1 1
1 86 1 1 5 ASN O O -1.343 1.678 3.074 1.00 . A A . 5 ASN O 1 1
1 87 1 1 5 ASN OD1 O -3.059 4.442 1.602 1.00 . A A . 5 ASN OD1 1 1
1 88 1 1 6 GLN C C -3.827 2.362 4.753 1.00 . A A . 6 GLN C 1 1
1 89 1 1 6 GLN CA C -2.509 2.936 5.271 1.00 . A A . 6 GLN CA 1 1
1 90 1 1 6 GLN CB C -2.813 3.970 6.357 1.00 . A A . 6 GLN CB 1 1
1 91 1 1 6 GLN CD C -1.840 5.546 8.073 1.00 . A A . 6 GLN CD 1 1
1 92 1 1 6 GLN CG C -1.574 4.405 7.149 1.00 . A A . 6 GLN CG 1 1
1 93 1 1 6 GLN H H -1.483 4.547 4.331 1.00 . A A . 6 GLN H 1 1
1 94 1 1 6 GLN HA H -1.958 2.116 5.719 1.00 . A A . 6 GLN HA 1 1
1 95 1 1 6 GLN HB2 H -3.257 4.845 5.881 1.00 . A A . 6 GLN HB2 1 1
1 96 1 1 6 GLN HB3 H -3.539 3.550 7.054 1.00 . A A . 6 GLN HB3 1 1
1 97 1 1 6 GLN HE21 H -1.080 6.506 9.618 1.00 . A A . 6 GLN HE21 1 1
1 98 1 1 6 GLN HE22 H -0.158 5.137 9.077 1.00 . A A . 6 GLN HE22 1 1
1 99 1 1 6 GLN HG2 H -1.205 3.561 7.729 1.00 . A A . 6 GLN HG2 1 1
1 100 1 1 6 GLN HG3 H -0.795 4.726 6.474 1.00 . A A . 6 GLN HG3 1 1
1 101 1 1 6 GLN N N -1.664 3.560 4.252 1.00 . A A . 6 GLN N 1 1
1 102 1 1 6 GLN NE2 N -0.954 5.744 8.998 1.00 . A A . 6 GLN NE2 1 1
1 103 1 1 6 GLN O O -4.354 1.417 5.327 1.00 . A A . 6 GLN O 1 1
1 104 1 1 6 GLN OE1 O -2.820 6.254 7.952 1.00 . A A . 6 GLN OE1 1 1
1 105 1 1 7 TYR C C -5.485 1.662 1.875 1.00 . A A . 7 TYR C 1 1
1 106 1 1 7 TYR CA C -5.644 2.506 3.134 1.00 . A A . 7 TYR CA 1 1
1 107 1 1 7 TYR CB C -6.498 3.737 2.822 1.00 . A A . 7 TYR CB 1 1
1 108 1 1 7 TYR CD1 C -7.957 4.227 4.842 1.00 . A A . 7 TYR CD1 1 1
1 109 1 1 7 TYR CD2 C -6.018 5.631 4.459 1.00 . A A . 7 TYR CD2 1 1
1 110 1 1 7 TYR CE1 C -8.269 4.973 6.010 1.00 . A A . 7 TYR CE1 1 1
1 111 1 1 7 TYR CE2 C -6.323 6.373 5.633 1.00 . A A . 7 TYR CE2 1 1
1 112 1 1 7 TYR CG C -6.831 4.546 4.057 1.00 . A A . 7 TYR CG 1 1
1 113 1 1 7 TYR CZ C -7.445 6.036 6.393 1.00 . A A . 7 TYR CZ 1 1
1 114 1 1 7 TYR H H -3.859 3.685 3.225 1.00 . A A . 7 TYR H 1 1
1 115 1 1 7 TYR HA H -6.165 1.904 3.880 1.00 . A A . 7 TYR HA 1 1
1 116 1 1 7 TYR HB2 H -5.962 4.371 2.117 1.00 . A A . 7 TYR HB2 1 1
1 117 1 1 7 TYR HB3 H -7.427 3.411 2.356 1.00 . A A . 7 TYR HB3 1 1
1 118 1 1 7 TYR HD1 H -8.594 3.401 4.554 1.00 . A A . 7 TYR HD1 1 1
1 119 1 1 7 TYR HD2 H -5.150 5.895 3.873 1.00 . A A . 7 TYR HD2 1 1
1 120 1 1 7 TYR HE1 H -9.133 4.717 6.603 1.00 . A A . 7 TYR HE1 1 1
1 121 1 1 7 TYR HE2 H -5.691 7.193 5.939 1.00 . A A . 7 TYR HE2 1 1
1 122 1 1 7 TYR HH H -8.528 6.435 7.970 1.00 . A A . 7 TYR HH 1 1
1 123 1 1 7 TYR N N -4.352 2.931 3.680 1.00 . A A . 7 TYR N 1 1
1 124 1 1 7 TYR O O -6.228 0.712 1.662 1.00 . A A . 7 TYR O 1 1
1 125 1 1 7 TYR OH O -7.745 6.757 7.521 1.00 . A A . 7 TYR OH 1 1
1 126 1 1 8 VAL C C -2.857 0.640 -0.063 1.00 . A A . 8 VAL C 1 1
1 127 1 1 8 VAL CA C -4.235 1.247 -0.175 1.00 . A A . 8 VAL CA 1 1
1 128 1 1 8 VAL CB C -4.347 2.131 -1.440 1.00 . A A . 8 VAL CB 1 1
1 129 1 1 8 VAL CG1 C -4.063 1.308 -2.714 1.00 . A A . 8 VAL CG1 1 1
1 130 1 1 8 VAL CG2 C -5.750 2.719 -1.520 1.00 . A A . 8 VAL CG2 1 1
1 131 1 1 8 VAL H H -3.922 2.799 1.264 1.00 . A A . 8 VAL H 1 1
1 132 1 1 8 VAL HA H -4.959 0.438 -0.263 1.00 . A A . 8 VAL HA 1 1
1 133 1 1 8 VAL HB H -3.627 2.946 -1.376 1.00 . A A . 8 VAL HB 1 1
1 134 1 1 8 VAL HG11 H -4.763 0.473 -2.780 1.00 . A A . 8 VAL HG11 1 1
1 135 1 1 8 VAL HG12 H -3.045 0.926 -2.689 1.00 . A A . 8 VAL HG12 1 1
1 136 1 1 8 VAL HG13 H -4.182 1.943 -3.592 1.00 . A A . 8 VAL HG13 1 1
1 137 1 1 8 VAL HG21 H -5.877 3.250 -2.463 1.00 . A A . 8 VAL HG21 1 1
1 138 1 1 8 VAL HG22 H -5.907 3.413 -0.696 1.00 . A A . 8 VAL HG22 1 1
1 139 1 1 8 VAL HG23 H -6.482 1.909 -1.452 1.00 . A A . 8 VAL HG23 1 1
1 140 1 1 8 VAL N N -4.509 2.001 1.048 1.00 . A A . 8 VAL N 1 1
1 141 1 1 8 VAL O O -1.837 1.334 -0.168 1.00 . A A . 8 VAL O 1 1
1 142 1 1 9 ORN C C -1.457 -2.678 -0.079 1.00 . A A . 9 ORN C 1 1
1 143 1 1 9 ORN CA C -1.702 -1.384 0.723 1.00 . A A . 9 ORN CA 1 1
1 144 1 1 9 ORN CB C -1.964 -1.662 2.223 1.00 . A A . 9 ORN CB 1 1
1 145 1 1 9 ORN CD C -0.949 -2.281 4.443 1.00 . A A . 9 ORN CD 1 1
1 146 1 1 9 ORN CG C -0.667 -2.077 2.947 1.00 . A A . 9 ORN CG 1 1
1 147 1 1 9 ORN H H -3.746 -1.142 0.179 1.00 . A A . 9 ORN H 1 1
1 148 1 1 9 ORN HA H -0.821 -0.747 0.635 1.00 . A A . 9 ORN HA 1 1
1 149 1 1 9 ORN HB2 H -2.358 -0.755 2.689 1.00 . A A . 9 ORN HB2 1 1
1 150 1 1 9 ORN HB3 H -2.706 -2.459 2.317 1.00 . A A . 9 ORN HB3 1 1
1 151 1 1 9 ORN HD2 H -1.305 -1.341 4.872 1.00 . A A . 9 ORN HD2 1 1
1 152 1 1 9 ORN HD3 H -1.728 -3.040 4.560 1.00 . A A . 9 ORN HD3 1 1
1 153 1 1 9 ORN HE1 H 0.988 -2.012 5.071 1.00 . A A . 9 ORN HE1 1 1
1 154 1 1 9 ORN HE2 H 0.057 -2.855 6.140 1.00 . A A . 9 ORN HE2 1 1
1 155 1 1 9 ORN HE3 H 0.604 -3.588 4.767 1.00 . A A . 9 ORN HE3 1 1
1 156 1 1 9 ORN HG2 H -0.294 -3.008 2.516 1.00 . A A . 9 ORN HG2 1 1
1 157 1 1 9 ORN HG3 H 0.083 -1.294 2.824 1.00 . A A . 9 ORN HG3 1 1
1 158 1 1 9 ORN N N -2.854 -0.668 0.165 1.00 . A A . 9 ORN N 1 1
1 159 1 1 9 ORN NE N 0.270 -2.717 5.161 1.00 . A A . 9 ORN NE 1 1
1 160 1 1 9 ORN O O -2.304 -3.580 -0.090 1.00 . A A . 9 ORN O 1 1
1 161 1 1 10 LEU C C 1.422 -4.075 -1.657 1.00 . A A . 10 LEU C 1 1
1 162 1 1 10 LEU CA C -0.043 -3.704 -1.829 1.00 . A A . 10 LEU CA 1 1
1 163 1 1 10 LEU CB C -0.299 -3.165 -3.226 1.00 . A A . 10 LEU CB 1 1
1 164 1 1 10 LEU CD1 C -2.698 -2.338 -3.408 1.00 . A A . 10 LEU CD1 1 1
1 165 1 1 10 LEU CD2 C -1.643 -3.644 -5.245 1.00 . A A . 10 LEU CD2 1 1
1 166 1 1 10 LEU CG C -1.715 -3.449 -3.752 1.00 . A A . 10 LEU CG 1 1
1 167 1 1 10 LEU H H 0.343 -1.996 -0.691 1.00 . A A . 10 LEU H 1 1
1 168 1 1 10 LEU HA H -0.657 -4.562 -1.690 1.00 . A A . 10 LEU HA 1 1
1 169 1 1 10 LEU HB2 H -0.113 -2.094 -3.240 1.00 . A A . 10 LEU HB2 1 1
1 170 1 1 10 LEU HB3 H 0.403 -3.644 -3.895 1.00 . A A . 10 LEU HB3 1 1
1 171 1 1 10 LEU HD11 H -2.344 -1.388 -3.806 1.00 . A A . 10 LEU HD11 1 1
1 172 1 1 10 LEU HD12 H -2.794 -2.270 -2.328 1.00 . A A . 10 LEU HD12 1 1
1 173 1 1 10 LEU HD13 H -3.675 -2.570 -3.835 1.00 . A A . 10 LEU HD13 1 1
1 174 1 1 10 LEU HD21 H -1.241 -2.749 -5.720 1.00 . A A . 10 LEU HD21 1 1
1 175 1 1 10 LEU HD22 H -2.641 -3.848 -5.632 1.00 . A A . 10 LEU HD22 1 1
1 176 1 1 10 LEU HD23 H -0.998 -4.495 -5.461 1.00 . A A . 10 LEU HD23 1 1
1 177 1 1 10 LEU HG H -2.071 -4.377 -3.306 1.00 . A A . 10 LEU HG 1 1
1 178 1 1 10 LEU N N -0.349 -2.700 -0.819 1.00 . A A . 10 LEU N 1 1
1 179 1 1 10 LEU O O 2.125 -3.391 -0.922 1.00 . A A . 10 LEU O 1 1
2 180 1 1 1 . C C 4.099 -5.038 -3.174 1.00 . A A . 1 DPN C 1 1
2 181 1 1 1 . CA C 3.226 -5.640 -2.064 1.00 . A A . 1 DPN CA 1 1
2 182 1 1 1 . CB C 3.821 -5.601 -0.625 1.00 . A A . 1 DPN CB 1 1
2 183 1 1 1 . CD1 C 6.271 -5.060 -1.060 1.00 . A A . 1 DPN CD1 1 1
2 184 1 1 1 . CD2 C 4.965 -3.546 0.315 1.00 . A A . 1 DPN CD2 1 1
2 185 1 1 1 . CE1 C 7.411 -4.231 -0.896 1.00 . A A . 1 DPN CE1 1 1
2 186 1 1 1 . CE2 C 6.104 -2.715 0.493 1.00 . A A . 1 DPN CE2 1 1
2 187 1 1 1 . CG C 5.040 -4.717 -0.462 1.00 . A A . 1 DPN CG 1 1
2 188 1 1 1 . CZ C 7.324 -3.058 -0.120 1.00 . A A . 1 DPN CZ 1 1
2 189 1 1 1 . H1 H 1.221 -5.679 -2.770 1.00 . A A . 1 DPN H1 1 1
2 190 1 1 1 . HA H 3.169 -6.701 -2.308 1.00 . A A . 1 DPN HA 1 1
2 191 1 1 1 . HB2 H 3.054 -5.280 0.075 1.00 . A A . 1 DPN HB2 1 1
2 192 1 1 1 . HB3 H 4.109 -6.617 -0.356 1.00 . A A . 1 DPN HB3 1 1
2 193 1 1 1 . HD1 H 6.349 -5.960 -1.653 1.00 . A A . 1 DPN HD1 1 1
2 194 1 1 1 . HD2 H 4.031 -3.272 0.782 1.00 . A A . 1 DPN HD2 1 1
2 195 1 1 1 . HE1 H 8.346 -4.500 -1.368 1.00 . A A . 1 DPN HE1 1 1
2 196 1 1 1 . HE2 H 6.030 -1.819 1.090 1.00 . A A . 1 DPN HE2 1 1
2 197 1 1 1 . HZ H 8.190 -2.425 0.004 1.00 . A A . 1 DPN HZ 1 1
2 198 1 1 1 . N N 1.836 -5.140 -2.182 1.00 . A A . 1 DPN N 1 1
2 199 1 1 1 . O O 4.662 -5.783 -3.967 1.00 . A A . 1 DPN O 1 1
2 200 1 1 2 BE2 C C 4.969 -0.924 -2.469 1.00 . A A . 2 BE2 C 1 1
2 201 1 1 2 BE2 C1 C 5.242 -1.486 -3.864 1.00 . A A . 2 BE2 C1 1 1
2 202 1 1 2 BE2 C2 C 4.848 -2.822 -4.193 1.00 . A A . 2 BE2 C2 1 1
2 203 1 1 2 BE2 C3 C 5.111 -3.315 -5.493 1.00 . A A . 2 BE2 C3 1 1
2 204 1 1 2 BE2 C4 C 5.758 -2.522 -6.447 1.00 . A A . 2 BE2 C4 1 1
2 205 1 1 2 BE2 C5 C 6.156 -1.225 -6.128 1.00 . A A . 2 BE2 C5 1 1
2 206 1 1 2 BE2 C6 C 5.904 -0.704 -4.855 1.00 . A A . 2 BE2 C6 1 1
2 207 1 1 2 BE2 H3 H 4.808 -4.314 -5.778 1.00 . A A . 2 BE2 H3 1 1
2 208 1 1 2 BE2 H4 H 5.951 -2.919 -7.440 1.00 . A A . 2 BE2 H4 1 1
2 209 1 1 2 BE2 H5 H 6.659 -0.615 -6.873 1.00 . A A . 2 BE2 H5 1 1
2 210 1 1 2 BE2 H6 H 6.222 0.312 -4.656 1.00 . A A . 2 BE2 H6 1 1
2 211 1 1 2 BE2 HN21 H 3.727 -3.147 -2.459 1.00 . A A . 2 BE2 HN21 1 1
2 212 1 1 2 BE2 N2 N 4.177 -3.649 -3.222 1.00 . A A . 2 BE2 N2 1 1
2 213 1 1 2 BE2 O1 O 4.255 -1.501 -1.670 1.00 . A A . 2 BE2 O1 1 1
2 214 1 1 3 PHE C C 4.207 1.782 -0.853 1.00 . A A . 3 PHE C 1 1
2 215 1 1 3 PHE CA C 5.438 0.896 -0.855 1.00 . A A . 3 PHE CA 1 1
2 216 1 1 3 PHE CB C 6.701 1.692 -0.516 1.00 . A A . 3 PHE CB 1 1
2 217 1 1 3 PHE CD1 C 7.244 1.398 1.938 1.00 . A A . 3 PHE CD1 1 1
2 218 1 1 3 PHE CD2 C 6.262 3.496 1.210 1.00 . A A . 3 PHE CD2 1 1
2 219 1 1 3 PHE CE1 C 7.288 1.876 3.273 1.00 . A A . 3 PHE CE1 1 1
2 220 1 1 3 PHE CE2 C 6.297 3.983 2.541 1.00 . A A . 3 PHE CE2 1 1
2 221 1 1 3 PHE CG C 6.732 2.203 0.902 1.00 . A A . 3 PHE CG 1 1
2 222 1 1 3 PHE CZ C 6.816 3.172 3.572 1.00 . A A . 3 PHE CZ 1 1
2 223 1 1 3 PHE H H 6.074 0.765 -2.825 1.00 . A A . 3 PHE H 1 1
2 224 1 1 3 PHE HA H 5.327 0.114 -0.159 1.00 . A A . 3 PHE HA 1 1
2 225 1 1 3 PHE HB2 H 7.567 1.052 -0.673 1.00 . A A . 3 PHE HB2 1 1
2 226 1 1 3 PHE HB3 H 6.775 2.536 -1.194 1.00 . A A . 3 PHE HB3 1 1
2 227 1 1 3 PHE HD1 H 7.615 0.409 1.714 1.00 . A A . 3 PHE HD1 1 1
2 228 1 1 3 PHE HD2 H 5.867 4.124 0.424 1.00 . A A . 3 PHE HD2 1 1
2 229 1 1 3 PHE HE1 H 7.692 1.253 4.058 1.00 . A A . 3 PHE HE1 1 1
2 230 1 1 3 PHE HE2 H 5.927 4.972 2.765 1.00 . A A . 3 PHE HE2 1 1
2 231 1 1 3 PHE HZ H 6.851 3.541 4.587 1.00 . A A . 3 PHE HZ 1 1
2 232 1 1 3 PHE N N 5.547 0.294 -2.158 1.00 . A A . 3 PHE N 1 1
2 233 1 1 3 PHE O O 4.260 2.949 -1.239 1.00 . A A . 3 PHE O 1 1
2 234 1 1 4 . C C 1.511 2.534 0.844 1.00 . A A . 4 DPN C 1 1
2 235 1 1 4 . CA C 1.743 1.702 -0.418 1.00 . A A . 4 DPN CA 1 1
2 236 1 1 4 . CB C 1.375 2.463 -1.712 1.00 . A A . 4 DPN CB 1 1
2 237 1 1 4 . CD1 C 0.829 0.604 -3.355 1.00 . A A . 4 DPN CD1 1 1
2 238 1 1 4 . CD2 C 2.754 2.012 -3.799 1.00 . A A . 4 DPN CD2 1 1
2 239 1 1 4 . CE1 C 1.100 -0.136 -4.540 1.00 . A A . 4 DPN CE1 1 1
2 240 1 1 4 . CE2 C 3.035 1.274 -4.974 1.00 . A A . 4 DPN CE2 1 1
2 241 1 1 4 . CG C 1.657 1.679 -2.976 1.00 . A A . 4 DPN CG 1 1
2 242 1 1 4 . CZ C 2.208 0.200 -5.342 1.00 . A A . 4 DPN CZ 1 1
2 243 1 1 4 . HA H 1.070 0.848 -0.356 1.00 . A A . 4 DPN HA 1 1
2 244 1 1 4 . HB2 H 0.313 2.699 -1.690 1.00 . A A . 4 DPN HB2 1 1
2 245 1 1 4 . HB3 H 1.926 3.401 -1.746 1.00 . A A . 4 DPN HB3 1 1
2 246 1 1 4 . HD1 H -0.020 0.340 -2.743 1.00 . A A . 4 DPN HD1 1 1
2 247 1 1 4 . HD2 H 3.392 2.842 -3.529 1.00 . A A . 4 DPN HD2 1 1
2 248 1 1 4 . HE1 H 0.455 -0.952 -4.829 1.00 . A A . 4 DPN HE1 1 1
2 249 1 1 4 . HE2 H 3.881 1.541 -5.591 1.00 . A A . 4 DPN HE2 1 1
2 250 1 1 4 . HZ H 2.420 -0.363 -6.240 1.00 . A A . 4 DPN HZ 1 1
2 251 1 1 4 . N N 3.112 1.157 -0.421 1.00 . A A . 4 DPN N 1 1
2 252 1 1 4 . O O 2.454 2.962 1.500 1.00 . A A . 4 DPN O 1 1
2 253 1 1 5 ASN C C -1.092 2.766 3.221 1.00 . A A . 5 ASN C 1 1
2 254 1 1 5 ASN CA C -0.112 3.557 2.352 1.00 . A A . 5 ASN CA 1 1
2 255 1 1 5 ASN CB C -0.691 4.907 1.900 1.00 . A A . 5 ASN CB 1 1
2 256 1 1 5 ASN CG C -1.958 4.757 1.091 1.00 . A A . 5 ASN CG 1 1
2 257 1 1 5 ASN H H -0.501 2.342 0.640 1.00 . A A . 5 ASN H 1 1
2 258 1 1 5 ASN HA H 0.784 3.750 2.943 1.00 . A A . 5 ASN HA 1 1
2 259 1 1 5 ASN HB2 H -0.905 5.520 2.774 1.00 . A A . 5 ASN HB2 1 1
2 260 1 1 5 ASN HB3 H 0.057 5.422 1.301 1.00 . A A . 5 ASN HB3 1 1
2 261 1 1 5 ASN HD21 H -2.694 4.878 -0.766 1.00 . A A . 5 ASN HD21 1 1
2 262 1 1 5 ASN HD22 H -0.985 5.194 -0.617 1.00 . A A . 5 ASN HD22 1 1
2 263 1 1 5 ASN N N 0.251 2.752 1.189 1.00 . A A . 5 ASN N 1 1
2 264 1 1 5 ASN ND2 N -1.869 4.962 -0.197 1.00 . A A . 5 ASN ND2 1 1
2 265 1 1 5 ASN O O -1.310 1.583 2.989 1.00 . A A . 5 ASN O 1 1
2 266 1 1 5 ASN OD1 O -3.014 4.469 1.633 1.00 . A A . 5 ASN OD1 1 1
2 267 1 1 6 GLN C C -3.820 2.166 4.601 1.00 . A A . 6 GLN C 1 1
2 268 1 1 6 GLN CA C -2.541 2.747 5.191 1.00 . A A . 6 GLN CA 1 1
2 269 1 1 6 GLN CB C -2.930 3.744 6.286 1.00 . A A . 6 GLN CB 1 1
2 270 1 1 6 GLN CD C -2.141 5.311 8.091 1.00 . A A . 6 GLN CD 1 1
2 271 1 1 6 GLN CG C -1.747 4.253 7.116 1.00 . A A . 6 GLN CG 1 1
2 272 1 1 6 GLN H H -1.490 4.399 4.344 1.00 . A A . 6 GLN H 1 1
2 273 1 1 6 GLN HA H -1.995 1.932 5.637 1.00 . A A . 6 GLN HA 1 1
2 274 1 1 6 GLN HB2 H -3.418 4.596 5.813 1.00 . A A . 6 GLN HB2 1 1
2 275 1 1 6 GLN HB3 H -3.643 3.267 6.957 1.00 . A A . 6 GLN HB3 1 1
2 276 1 1 6 GLN HE21 H -1.481 6.289 9.671 1.00 . A A . 6 GLN HE21 1 1
2 277 1 1 6 GLN HE22 H -0.404 5.076 9.056 1.00 . A A . 6 GLN HE22 1 1
2 278 1 1 6 GLN HG2 H -1.309 3.423 7.662 1.00 . A A . 6 GLN HG2 1 1
2 279 1 1 6 GLN HG3 H -0.995 4.681 6.467 1.00 . A A . 6 GLN HG3 1 1
2 280 1 1 6 GLN N N -1.665 3.414 4.225 1.00 . A A . 6 GLN N 1 1
2 281 1 1 6 GLN NE2 N -1.272 5.577 9.013 1.00 . A A . 6 GLN NE2 1 1
2 282 1 1 6 GLN O O -4.276 1.107 5.020 1.00 . A A . 6 GLN O 1 1
2 283 1 1 6 GLN OE1 O -3.204 5.893 8.011 1.00 . A A . 6 GLN OE1 1 1
2 284 1 1 7 TYR C C -5.477 1.670 1.770 1.00 . A A . 7 TYR C 1 1
2 285 1 1 7 TYR CA C -5.671 2.467 3.052 1.00 . A A . 7 TYR CA 1 1
2 286 1 1 7 TYR CB C -6.517 3.711 2.775 1.00 . A A . 7 TYR CB 1 1
2 287 1 1 7 TYR CD1 C -6.077 5.567 4.467 1.00 . A A . 7 TYR CD1 1 1
2 288 1 1 7 TYR CD2 C -7.959 4.084 4.835 1.00 . A A . 7 TYR CD2 1 1
2 289 1 1 7 TYR CE1 C -6.387 6.260 5.670 1.00 . A A . 7 TYR CE1 1 1
2 290 1 1 7 TYR CE2 C -8.272 4.777 6.036 1.00 . A A . 7 TYR CE2 1 1
2 291 1 1 7 TYR CG C -6.857 4.468 4.043 1.00 . A A . 7 TYR CG 1 1
2 292 1 1 7 TYR CZ C -7.477 5.854 6.443 1.00 . A A . 7 TYR CZ 1 1
2 293 1 1 7 TYR H H -3.945 3.706 3.312 1.00 . A A . 7 TYR H 1 1
2 294 1 1 7 TYR HA H -6.207 1.837 3.764 1.00 . A A . 7 TYR HA 1 1
2 295 1 1 7 TYR HB2 H -5.968 4.373 2.104 1.00 . A A . 7 TYR HB2 1 1
2 296 1 1 7 TYR HB3 H -7.441 3.407 2.286 1.00 . A A . 7 TYR HB3 1 1
2 297 1 1 7 TYR HD1 H -5.228 5.882 3.879 1.00 . A A . 7 TYR HD1 1 1
2 298 1 1 7 TYR HD2 H -8.569 3.246 4.530 1.00 . A A . 7 TYR HD2 1 1
2 299 1 1 7 TYR HE1 H -5.780 7.091 5.994 1.00 . A A . 7 TYR HE1 1 1
2 300 1 1 7 TYR HE2 H -9.113 4.468 6.636 1.00 . A A . 7 TYR HE2 1 1
2 301 1 1 7 TYR HH H -8.529 6.151 8.063 1.00 . A A . 7 TYR HH 1 1
2 302 1 1 7 TYR N N -4.393 2.867 3.642 1.00 . A A . 7 TYR N 1 1
2 303 1 1 7 TYR O O -6.218 0.734 1.492 1.00 . A A . 7 TYR O 1 1
2 304 1 1 7 TYR OH O -7.771 6.518 7.606 1.00 . A A . 7 TYR OH 1 1
2 305 1 1 8 VAL C C -2.794 0.683 -0.083 1.00 . A A . 8 VAL C 1 1
2 306 1 1 8 VAL CA C -4.151 1.328 -0.243 1.00 . A A . 8 VAL CA 1 1
2 307 1 1 8 VAL CB C -4.194 2.258 -1.476 1.00 . A A . 8 VAL CB 1 1
2 308 1 1 8 VAL CG1 C -3.850 1.483 -2.764 1.00 . A A . 8 VAL CG1 1 1
2 309 1 1 8 VAL CG2 C -5.590 2.850 -1.598 1.00 . A A . 8 VAL CG2 1 1
2 310 1 1 8 VAL H H -3.890 2.826 1.264 1.00 . A A . 8 VAL H 1 1
2 311 1 1 8 VAL HA H -4.883 0.536 -0.393 1.00 . A A . 8 VAL HA 1 1
2 312 1 1 8 VAL HB H -3.477 3.064 -1.346 1.00 . A A . 8 VAL HB 1 1
2 313 1 1 8 VAL HG11 H -3.951 2.143 -3.626 1.00 . A A . 8 VAL HG11 1 1
2 314 1 1 8 VAL HG12 H -4.527 0.634 -2.881 1.00 . A A . 8 VAL HG12 1 1
2 315 1 1 8 VAL HG13 H -2.822 1.125 -2.716 1.00 . A A . 8 VAL HG13 1 1
2 316 1 1 8 VAL HG21 H -6.324 2.037 -1.589 1.00 . A A . 8 VAL HG21 1 1
2 317 1 1 8 VAL HG22 H -5.676 3.410 -2.527 1.00 . A A . 8 VAL HG22 1 1
2 318 1 1 8 VAL HG23 H -5.782 3.513 -0.757 1.00 . A A . 8 VAL HG23 1 1
2 319 1 1 8 VAL N N -4.469 2.037 0.995 1.00 . A A . 8 VAL N 1 1
2 320 1 1 8 VAL O O -1.746 1.331 -0.218 1.00 . A A . 8 VAL O 1 1
2 321 1 1 9 ORN C C -1.539 -2.659 -0.112 1.00 . A A . 9 ORN C 1 1
2 322 1 1 9 ORN CA C -1.701 -1.372 0.719 1.00 . A A . 9 ORN CA 1 1
2 323 1 1 9 ORN CB C -1.902 -1.676 2.224 1.00 . A A . 9 ORN CB 1 1
2 324 1 1 9 ORN CD C -0.808 -2.643 4.311 1.00 . A A . 9 ORN CD 1 1
2 325 1 1 9 ORN CG C -0.583 -2.180 2.862 1.00 . A A . 9 ORN CG 1 1
2 326 1 1 9 ORN H H -3.760 -1.037 0.276 1.00 . A A . 9 ORN H 1 1
2 327 1 1 9 ORN HA H -0.800 -0.766 0.606 1.00 . A A . 9 ORN HA 1 1
2 328 1 1 9 ORN HB2 H -2.224 -0.766 2.736 1.00 . A A . 9 ORN HB2 1 1
2 329 1 1 9 ORN HB3 H -2.680 -2.433 2.332 1.00 . A A . 9 ORN HB3 1 1
2 330 1 1 9 ORN HD2 H 0.164 -2.764 4.798 1.00 . A A . 9 ORN HD2 1 1
2 331 1 1 9 ORN HD3 H -1.376 -1.879 4.850 1.00 . A A . 9 ORN HD3 1 1
2 332 1 1 9 ORN HE1 H -1.014 -4.644 3.872 1.00 . A A . 9 ORN HE1 1 1
2 333 1 1 9 ORN HE2 H -1.669 -4.215 5.326 1.00 . A A . 9 ORN HE2 1 1
2 334 1 1 9 ORN HE3 H -2.446 -3.826 3.924 1.00 . A A . 9 ORN HE3 1 1
2 335 1 1 9 ORN HG2 H -0.185 -3.011 2.276 1.00 . A A . 9 ORN HG2 1 1
2 336 1 1 9 ORN HG3 H 0.145 -1.367 2.859 1.00 . A A . 9 ORN HG3 1 1
2 337 1 1 9 ORN N N -2.847 -0.606 0.222 1.00 . A A . 9 ORN N 1 1
2 338 1 1 9 ORN NE N -1.541 -3.933 4.364 1.00 . A A . 9 ORN NE 1 1
2 339 1 1 9 ORN O O -2.346 -3.591 0.005 1.00 . A A . 9 ORN O 1 1
2 340 1 1 10 LEU C C 1.334 -4.069 -1.574 1.00 . A A . 10 LEU C 1 1
2 341 1 1 10 LEU CA C -0.146 -3.804 -1.796 1.00 . A A . 10 LEU CA 1 1
2 342 1 1 10 LEU CB C -0.411 -3.426 -3.268 1.00 . A A . 10 LEU CB 1 1
2 343 1 1 10 LEU CD1 C -2.629 -4.660 -3.501 1.00 . A A . 10 LEU CD1 1 1
2 344 1 1 10 LEU CD2 C -2.638 -2.157 -3.386 1.00 . A A . 10 LEU CD2 1 1
2 345 1 1 10 LEU CG C -1.846 -3.386 -3.840 1.00 . A A . 10 LEU CG 1 1
2 346 1 1 10 LEU H H 0.202 -1.969 -0.868 1.00 . A A . 10 LEU H 1 1
2 347 1 1 10 LEU HA H -0.712 -4.672 -1.520 1.00 . A A . 10 LEU HA 1 1
2 348 1 1 10 LEU HB2 H 0.034 -2.451 -3.434 1.00 . A A . 10 LEU HB2 1 1
2 349 1 1 10 LEU HB3 H 0.144 -4.131 -3.886 1.00 . A A . 10 LEU HB3 1 1
2 350 1 1 10 LEU HD11 H -2.060 -5.535 -3.815 1.00 . A A . 10 LEU HD11 1 1
2 351 1 1 10 LEU HD12 H -3.583 -4.651 -4.029 1.00 . A A . 10 LEU HD12 1 1
2 352 1 1 10 LEU HD13 H -2.816 -4.711 -2.428 1.00 . A A . 10 LEU HD13 1 1
2 353 1 1 10 LEU HD21 H -3.560 -2.087 -3.966 1.00 . A A . 10 LEU HD21 1 1
2 354 1 1 10 LEU HD22 H -2.047 -1.257 -3.550 1.00 . A A . 10 LEU HD22 1 1
2 355 1 1 10 LEU HD23 H -2.889 -2.243 -2.333 1.00 . A A . 10 LEU HD23 1 1
2 356 1 1 10 LEU HG H -1.760 -3.333 -4.925 1.00 . A A . 10 LEU HG 1 1
2 357 1 1 10 LEU N N -0.462 -2.711 -0.894 1.00 . A A . 10 LEU N 1 1
2 358 1 1 10 LEU O O 1.977 -3.290 -0.881 1.00 . A A . 10 LEU O 1 1
3 359 1 1 1 . C C 4.558 -5.300 -3.197 1.00 . A A . 1 DPN C 1 1
3 360 1 1 1 . CA C 3.525 -5.852 -2.207 1.00 . A A . 1 DPN CA 1 1
3 361 1 1 1 . CB C 4.088 -5.964 -0.753 1.00 . A A . 1 DPN CB 1 1
3 362 1 1 1 . CD1 C 6.557 -5.374 -0.967 1.00 . A A . 1 DPN CD1 1 1
3 363 1 1 1 . CD2 C 5.136 -3.900 0.338 1.00 . A A . 1 DPN CD2 1 1
3 364 1 1 1 . CE1 C 7.672 -4.528 -0.709 1.00 . A A . 1 DPN CE1 1 1
3 365 1 1 1 . CE2 C 6.245 -3.059 0.605 1.00 . A A . 1 DPN CE2 1 1
3 366 1 1 1 . CG C 5.280 -5.060 -0.458 1.00 . A A . 1 DPN CG 1 1
3 367 1 1 1 . CZ C 7.510 -3.373 0.076 1.00 . A A . 1 DPN CZ 1 1
3 368 1 1 1 . H1 H 1.629 -5.462 -3.100 1.00 . A A . 1 DPN H1 1 1
3 369 1 1 1 . HA H 3.334 -6.880 -2.529 1.00 . A A . 1 DPN HA 1 1
3 370 1 1 1 . HB2 H 3.298 -5.759 -0.037 1.00 . A A . 1 DPN HB2 1 1
3 371 1 1 1 . HB3 H 4.401 -6.997 -0.595 1.00 . A A . 1 DPN HB3 1 1
3 372 1 1 1 . HD1 H 6.691 -6.262 -1.570 1.00 . A A . 1 DPN HD1 1 1
3 373 1 1 1 . HD2 H 4.173 -3.654 0.749 1.00 . A A . 1 DPN HD2 1 1
3 374 1 1 1 . HE1 H 8.643 -4.780 -1.118 1.00 . A A . 1 DPN HE1 1 1
3 375 1 1 1 . HE2 H 6.120 -2.177 1.216 1.00 . A A . 1 DPN HE2 1 1
3 376 1 1 1 . HZ H 8.357 -2.727 0.271 1.00 . A A . 1 DPN HZ 1 1
3 377 1 1 1 . N N 2.227 -5.129 -2.354 1.00 . A A . 1 DPN N 1 1
3 378 1 1 1 . O O 5.222 -6.063 -3.877 1.00 . A A . 1 DPN O 1 1
3 379 1 1 2 BE2 C C 4.810 -1.203 -2.508 1.00 . A A . 2 BE2 C 1 1
3 380 1 1 2 BE2 C1 C 5.658 -1.733 -3.633 1.00 . A A . 2 BE2 C1 1 1
3 381 1 1 2 BE2 C2 C 5.550 -3.095 -4.000 1.00 . A A . 2 BE2 C2 1 1
3 382 1 1 2 BE2 C3 C 6.337 -3.592 -5.062 1.00 . A A . 2 BE2 C3 1 1
3 383 1 1 2 BE2 C4 C 7.226 -2.745 -5.742 1.00 . A A . 2 BE2 C4 1 1
3 384 1 1 2 BE2 C5 C 7.341 -1.397 -5.371 1.00 . A A . 2 BE2 C5 1 1
3 385 1 1 2 BE2 C6 C 6.558 -0.888 -4.322 1.00 . A A . 2 BE2 C6 1 1
3 386 1 1 2 BE2 H3 H 6.283 -4.625 -5.379 1.00 . A A . 2 BE2 H3 1 1
3 387 1 1 2 BE2 H4 H 7.838 -3.137 -6.553 1.00 . A A . 2 BE2 H4 1 1
3 388 1 1 2 BE2 H5 H 8.032 -0.746 -5.903 1.00 . A A . 2 BE2 H5 1 1
3 389 1 1 2 BE2 H6 H 6.644 0.166 -4.061 1.00 . A A . 2 BE2 H6 1 1
3 390 1 1 2 BE2 HN21 H 4.042 -3.430 -2.612 1.00 . A A . 2 BE2 HN21 1 1
3 391 1 1 2 BE2 N2 N 4.659 -3.937 -3.244 1.00 . A A . 2 BE2 N2 1 1
3 392 1 1 2 BE2 O1 O 3.735 -1.707 -2.217 1.00 . A A . 2 BE2 O1 1 1
3 393 1 1 3 PHE C C 3.709 1.589 -1.156 1.00 . A A . 3 PHE C 1 1
3 394 1 1 3 PHE CA C 4.586 0.450 -0.703 1.00 . A A . 3 PHE CA 1 1
3 395 1 1 3 PHE CB C 5.555 0.911 0.383 1.00 . A A . 3 PHE CB 1 1
3 396 1 1 3 PHE CD1 C 4.802 2.672 2.027 1.00 . A A . 3 PHE CD1 1 1
3 397 1 1 3 PHE CD2 C 4.281 0.343 2.493 1.00 . A A . 3 PHE CD2 1 1
3 398 1 1 3 PHE CE1 C 4.158 3.060 3.237 1.00 . A A . 3 PHE CE1 1 1
3 399 1 1 3 PHE CE2 C 3.632 0.722 3.698 1.00 . A A . 3 PHE CE2 1 1
3 400 1 1 3 PHE CG C 4.871 1.314 1.656 1.00 . A A . 3 PHE CG 1 1
3 401 1 1 3 PHE CZ C 3.573 2.083 4.071 1.00 . A A . 3 PHE CZ 1 1
3 402 1 1 3 PHE H H 6.140 0.290 -2.098 1.00 . A A . 3 PHE H 1 1
3 403 1 1 3 PHE HA H 3.980 -0.322 -0.301 1.00 . A A . 3 PHE HA 1 1
3 404 1 1 3 PHE HB2 H 6.241 0.093 0.601 1.00 . A A . 3 PHE HB2 1 1
3 405 1 1 3 PHE HB3 H 6.130 1.756 0.009 1.00 . A A . 3 PHE HB3 1 1
3 406 1 1 3 PHE HD1 H 5.241 3.428 1.389 1.00 . A A . 3 PHE HD1 1 1
3 407 1 1 3 PHE HD2 H 4.327 -0.699 2.219 1.00 . A A . 3 PHE HD2 1 1
3 408 1 1 3 PHE HE1 H 4.117 4.105 3.513 1.00 . A A . 3 PHE HE1 1 1
3 409 1 1 3 PHE HE2 H 3.178 -0.030 4.325 1.00 . A A . 3 PHE HE2 1 1
3 410 1 1 3 PHE HZ H 3.082 2.372 4.990 1.00 . A A . 3 PHE HZ 1 1
3 411 1 1 3 PHE N N 5.291 -0.114 -1.831 1.00 . A A . 3 PHE N 1 1
3 412 1 1 3 PHE O O 4.211 2.623 -1.584 1.00 . A A . 3 PHE O 1 1
3 413 1 1 4 . C C 1.103 3.286 -0.327 1.00 . A A . 4 DPN C 1 1
3 414 1 1 4 . CA C 1.309 2.263 -1.435 1.00 . A A . 4 DPN CA 1 1
3 415 1 1 4 . CB C 1.481 2.939 -2.807 1.00 . A A . 4 DPN CB 1 1
3 416 1 1 4 . CD1 C 0.226 1.909 -4.746 1.00 . A A . 4 DPN CD1 1 1
3 417 1 1 4 . CD2 C 2.499 1.176 -4.316 1.00 . A A . 4 DPN CD2 1 1
3 418 1 1 4 . CE1 C 0.147 1.026 -5.853 1.00 . A A . 4 DPN CE1 1 1
3 419 1 1 4 . CE2 C 2.432 0.290 -5.411 1.00 . A A . 4 DPN CE2 1 1
3 420 1 1 4 . CG C 1.402 1.988 -3.971 1.00 . A A . 4 DPN CG 1 1
3 421 1 1 4 . CZ C 1.252 0.215 -6.186 1.00 . A A . 4 DPN CZ 1 1
3 422 1 1 4 . HA H 0.396 1.661 -1.493 1.00 . A A . 4 DPN HA 1 1
3 423 1 1 4 . HB2 H 0.678 3.672 -2.902 1.00 . A A . 4 DPN HB2 1 1
3 424 1 1 4 . HB3 H 2.421 3.471 -2.840 1.00 . A A . 4 DPN HB3 1 1
3 425 1 1 4 . HD1 H -0.622 2.530 -4.503 1.00 . A A . 4 DPN HD1 1 1
3 426 1 1 4 . HD2 H 3.409 1.240 -3.740 1.00 . A A . 4 DPN HD2 1 1
3 427 1 1 4 . HE1 H -0.756 0.981 -6.440 1.00 . A A . 4 DPN HE1 1 1
3 428 1 1 4 . HE2 H 3.285 -0.326 -5.663 1.00 . A A . 4 DPN HE2 1 1
3 429 1 1 4 . HZ H 1.202 -0.456 -7.035 1.00 . A A . 4 DPN HZ 1 1
3 430 1 1 4 . N N 2.401 1.345 -1.043 1.00 . A A . 4 DPN N 1 1
3 431 1 1 4 . O O 1.861 4.236 -0.187 1.00 . A A . 4 DPN O 1 1
3 432 1 1 5 ASN C C -0.802 3.139 2.748 1.00 . A A . 5 ASN C 1 1
3 433 1 1 5 ASN CA C -0.196 3.955 1.611 1.00 . A A . 5 ASN CA 1 1
3 434 1 1 5 ASN CB C -1.075 5.148 1.193 1.00 . A A . 5 ASN CB 1 1
3 435 1 1 5 ASN CG C -2.439 4.731 0.709 1.00 . A A . 5 ASN CG 1 1
3 436 1 1 5 ASN H H -0.563 2.299 0.311 1.00 . A A . 5 ASN H 1 1
3 437 1 1 5 ASN HA H 0.760 4.350 1.963 1.00 . A A . 5 ASN HA 1 1
3 438 1 1 5 ASN HB2 H -1.193 5.817 2.041 1.00 . A A . 5 ASN HB2 1 1
3 439 1 1 5 ASN HB3 H -0.562 5.694 0.405 1.00 . A A . 5 ASN HB3 1 1
3 440 1 1 5 ASN HD21 H -3.592 4.623 -0.914 1.00 . A A . 5 ASN HD21 1 1
3 441 1 1 5 ASN HD22 H -1.987 5.240 -1.192 1.00 . A A . 5 ASN HD22 1 1
3 442 1 1 5 ASN N N 0.067 3.081 0.474 1.00 . A A . 5 ASN N 1 1
3 443 1 1 5 ASN ND2 N -2.691 4.879 -0.563 1.00 . A A . 5 ASN ND2 1 1
3 444 1 1 5 ASN O O -0.844 1.915 2.682 1.00 . A A . 5 ASN O 1 1
3 445 1 1 5 ASN OD1 O -3.270 4.292 1.491 1.00 . A A . 5 ASN OD1 1 1
3 446 1 1 6 GLN C C -3.005 2.295 4.776 1.00 . A A . 6 GLN C 1 1
3 447 1 1 6 GLN CA C -1.772 3.164 4.990 1.00 . A A . 6 GLN CA 1 1
3 448 1 1 6 GLN CB C -2.134 4.242 6.020 1.00 . A A . 6 GLN CB 1 1
3 449 1 1 6 GLN CD C -1.356 6.168 7.435 1.00 . A A . 6 GLN CD 1 1
3 450 1 1 6 GLN CG C -0.949 5.064 6.510 1.00 . A A . 6 GLN CG 1 1
3 451 1 1 6 GLN H H -1.240 4.821 3.767 1.00 . A A . 6 GLN H 1 1
3 452 1 1 6 GLN HA H -0.993 2.532 5.397 1.00 . A A . 6 GLN HA 1 1
3 453 1 1 6 GLN HB2 H -2.863 4.914 5.568 1.00 . A A . 6 GLN HB2 1 1
3 454 1 1 6 GLN HB3 H -2.593 3.755 6.878 1.00 . A A . 6 GLN HB3 1 1
3 455 1 1 6 GLN HE21 H -0.613 7.461 8.731 1.00 . A A . 6 GLN HE21 1 1
3 456 1 1 6 GLN HE22 H 0.552 6.385 8.021 1.00 . A A . 6 GLN HE22 1 1
3 457 1 1 6 GLN HG2 H -0.247 4.417 7.029 1.00 . A A . 6 GLN HG2 1 1
3 458 1 1 6 GLN HG3 H -0.437 5.524 5.668 1.00 . A A . 6 GLN HG3 1 1
3 459 1 1 6 GLN N N -1.255 3.818 3.789 1.00 . A A . 6 GLN N 1 1
3 460 1 1 6 GLN NE2 N -0.395 6.713 8.116 1.00 . A A . 6 GLN NE2 1 1
3 461 1 1 6 GLN O O -3.175 1.277 5.438 1.00 . A A . 6 GLN O 1 1
3 462 1 1 6 GLN OE1 O -2.514 6.538 7.526 1.00 . A A . 6 GLN OE1 1 1
3 463 1 1 7 TYR C C -5.143 1.186 2.373 1.00 . A A . 7 TYR C 1 1
3 464 1 1 7 TYR CA C -5.143 2.030 3.642 1.00 . A A . 7 TYR CA 1 1
3 465 1 1 7 TYR CB C -6.262 3.073 3.599 1.00 . A A . 7 TYR CB 1 1
3 466 1 1 7 TYR CD1 C -7.102 3.349 5.979 1.00 . A A . 7 TYR CD1 1 1
3 467 1 1 7 TYR CD2 C -5.697 5.089 5.049 1.00 . A A . 7 TYR CD2 1 1
3 468 1 1 7 TYR CE1 C -7.166 4.062 7.212 1.00 . A A . 7 TYR CE1 1 1
3 469 1 1 7 TYR CE2 C -5.757 5.803 6.272 1.00 . A A . 7 TYR CE2 1 1
3 470 1 1 7 TYR CG C -6.359 3.853 4.894 1.00 . A A . 7 TYR CG 1 1
3 471 1 1 7 TYR CZ C -6.487 5.278 7.347 1.00 . A A . 7 TYR CZ 1 1
3 472 1 1 7 TYR H H -3.645 3.529 3.316 1.00 . A A . 7 TYR H 1 1
3 473 1 1 7 TYR HA H -5.334 1.367 4.481 1.00 . A A . 7 TYR HA 1 1
3 474 1 1 7 TYR HB2 H -6.072 3.768 2.784 1.00 . A A . 7 TYR HB2 1 1
3 475 1 1 7 TYR HB3 H -7.210 2.565 3.420 1.00 . A A . 7 TYR HB3 1 1
3 476 1 1 7 TYR HD1 H -7.620 2.406 5.882 1.00 . A A . 7 TYR HD1 1 1
3 477 1 1 7 TYR HD2 H -5.125 5.496 4.225 1.00 . A A . 7 TYR HD2 1 1
3 478 1 1 7 TYR HE1 H -7.730 3.662 8.042 1.00 . A A . 7 TYR HE1 1 1
3 479 1 1 7 TYR HE2 H -5.235 6.746 6.380 1.00 . A A . 7 TYR HE2 1 1
3 480 1 1 7 TYR HH H -6.002 6.756 8.530 1.00 . A A . 7 TYR HH 1 1
3 481 1 1 7 TYR N N -3.867 2.709 3.865 1.00 . A A . 7 TYR N 1 1
3 482 1 1 7 TYR O O -5.764 0.133 2.316 1.00 . A A . 7 TYR O 1 1
3 483 1 1 7 TYR OH O -6.540 5.961 8.533 1.00 . A A . 7 TYR OH 1 1
3 484 1 1 8 VAL C C -2.872 0.381 0.033 1.00 . A A . 8 VAL C 1 1
3 485 1 1 8 VAL CA C -4.288 0.916 0.104 1.00 . A A . 8 VAL CA 1 1
3 486 1 1 8 VAL CB C -4.639 1.789 -1.121 1.00 . A A . 8 VAL CB 1 1
3 487 1 1 8 VAL CG1 C -4.474 0.989 -2.423 1.00 . A A . 8 VAL CG1 1 1
3 488 1 1 8 VAL CG2 C -6.076 2.311 -0.988 1.00 . A A . 8 VAL CG2 1 1
3 489 1 1 8 VAL H H -3.930 2.522 1.455 1.00 . A A . 8 VAL H 1 1
3 490 1 1 8 VAL HA H -4.968 0.071 0.113 1.00 . A A . 8 VAL HA 1 1
3 491 1 1 8 VAL HB H -3.967 2.639 -1.152 1.00 . A A . 8 VAL HB 1 1
3 492 1 1 8 VAL HG11 H -3.424 0.739 -2.569 1.00 . A A . 8 VAL HG11 1 1
3 493 1 1 8 VAL HG12 H -4.803 1.595 -3.258 1.00 . A A . 8 VAL HG12 1 1
3 494 1 1 8 VAL HG13 H -5.067 0.070 -2.380 1.00 . A A . 8 VAL HG13 1 1
3 495 1 1 8 VAL HG21 H -6.354 2.845 -1.896 1.00 . A A . 8 VAL HG21 1 1
3 496 1 1 8 VAL HG22 H -6.146 2.990 -0.141 1.00 . A A . 8 VAL HG22 1 1
3 497 1 1 8 VAL HG23 H -6.757 1.476 -0.832 1.00 . A A . 8 VAL HG23 1 1
3 498 1 1 8 VAL N N -4.419 1.646 1.362 1.00 . A A . 8 VAL N 1 1
3 499 1 1 8 VAL O O -1.899 1.123 -0.167 1.00 . A A . 8 VAL O 1 1
3 500 1 1 9 ORN C C -1.240 -2.717 -0.426 1.00 . A A . 9 ORN C 1 1
3 501 1 1 9 ORN CA C -1.560 -1.634 0.615 1.00 . A A . 9 ORN CA 1 1
3 502 1 1 9 ORN CB C -1.741 -2.261 2.029 1.00 . A A . 9 ORN CB 1 1
3 503 1 1 9 ORN CD C -2.322 -1.804 4.473 1.00 . A A . 9 ORN CD 1 1
3 504 1 1 9 ORN CG C -1.890 -1.182 3.131 1.00 . A A . 9 ORN CG 1 1
3 505 1 1 9 ORN H H -3.665 -1.426 0.356 1.00 . A A . 9 ORN H 1 1
3 506 1 1 9 ORN HA H -0.739 -0.921 0.653 1.00 . A A . 9 ORN HA 1 1
3 507 1 1 9 ORN HB2 H -2.628 -2.895 2.017 1.00 . A A . 9 ORN HB2 1 1
3 508 1 1 9 ORN HB3 H -0.870 -2.882 2.251 1.00 . A A . 9 ORN HB3 1 1
3 509 1 1 9 ORN HD2 H -2.705 -1.013 5.119 1.00 . A A . 9 ORN HD2 1 1
3 510 1 1 9 ORN HD3 H -3.129 -2.521 4.300 1.00 . A A . 9 ORN HD3 1 1
3 511 1 1 9 ORN HE1 H -0.871 -3.256 4.602 1.00 . A A . 9 ORN HE1 1 1
3 512 1 1 9 ORN HE2 H -0.450 -1.812 5.291 1.00 . A A . 9 ORN HE2 1 1
3 513 1 1 9 ORN HE3 H -1.502 -2.817 6.059 1.00 . A A . 9 ORN HE3 1 1
3 514 1 1 9 ORN HG2 H -0.939 -0.658 3.257 1.00 . A A . 9 ORN HG2 1 1
3 515 1 1 9 ORN HG3 H -2.651 -0.467 2.822 1.00 . A A . 9 ORN HG3 1 1
3 516 1 1 9 ORN N N -2.792 -0.932 0.225 1.00 . A A . 9 ORN N 1 1
3 517 1 1 9 ORN NE N -1.197 -2.474 5.162 1.00 . A A . 9 ORN NE 1 1
3 518 1 1 9 ORN O O -2.102 -3.550 -0.739 1.00 . A A . 9 ORN O 1 1
3 519 1 1 10 LEU C C 1.771 -4.107 -1.627 1.00 . A A . 10 LEU C 1 1
3 520 1 1 10 LEU CA C 0.430 -3.544 -2.047 1.00 . A A . 10 LEU CA 1 1
3 521 1 1 10 LEU CB C 0.589 -2.735 -3.354 1.00 . A A . 10 LEU CB 1 1
3 522 1 1 10 LEU CD1 C -1.598 -3.470 -4.422 1.00 . A A . 10 LEU CD1 1 1
3 523 1 1 10 LEU CD2 C -1.421 -1.148 -3.509 1.00 . A A . 10 LEU CD2 1 1
3 524 1 1 10 LEU CG C -0.654 -2.298 -4.167 1.00 . A A . 10 LEU CG 1 1
3 525 1 1 10 LEU H H 0.675 -2.087 -0.566 1.00 . A A . 10 LEU H 1 1
3 526 1 1 10 LEU HA H -0.272 -4.347 -2.178 1.00 . A A . 10 LEU HA 1 1
3 527 1 1 10 LEU HB2 H 1.164 -1.833 -3.123 1.00 . A A . 10 LEU HB2 1 1
3 528 1 1 10 LEU HB3 H 1.197 -3.336 -4.026 1.00 . A A . 10 LEU HB3 1 1
3 529 1 1 10 LEU HD11 H -2.039 -3.805 -3.477 1.00 . A A . 10 LEU HD11 1 1
3 530 1 1 10 LEU HD12 H -1.054 -4.291 -4.885 1.00 . A A . 10 LEU HD12 1 1
3 531 1 1 10 LEU HD13 H -2.396 -3.156 -5.093 1.00 . A A . 10 LEU HD13 1 1
3 532 1 1 10 LEU HD21 H -2.126 -0.722 -4.230 1.00 . A A . 10 LEU HD21 1 1
3 533 1 1 10 LEU HD22 H -0.726 -0.372 -3.203 1.00 . A A . 10 LEU HD22 1 1
3 534 1 1 10 LEU HD23 H -1.970 -1.511 -2.646 1.00 . A A . 10 LEU HD23 1 1
3 535 1 1 10 LEU HG H -0.304 -1.945 -5.135 1.00 . A A . 10 LEU HG 1 1
3 536 1 1 10 LEU N N -0.010 -2.698 -0.945 1.00 . A A . 10 LEU N 1 1
3 537 1 1 10 LEU O O 2.346 -3.597 -0.675 1.00 . A A . 10 LEU O 1 1
4 538 1 1 1 . C C 4.330 -6.033 -2.365 1.00 . A A . 1 DPN C 1 1
4 539 1 1 1 . CA C 3.145 -6.262 -1.422 1.00 . A A . 1 DPN CA 1 1
4 540 1 1 1 . CB C 3.577 -6.310 0.070 1.00 . A A . 1 DPN CB 1 1
4 541 1 1 1 . CD1 C 5.204 -4.483 0.786 1.00 . A A . 1 DPN CD1 1 1
4 542 1 1 1 . CD2 C 6.102 -6.639 0.123 1.00 . A A . 1 DPN CD2 1 1
4 543 1 1 1 . CE1 C 6.517 -3.999 1.014 1.00 . A A . 1 DPN CE1 1 1
4 544 1 1 1 . CE2 C 7.420 -6.166 0.351 1.00 . A A . 1 DPN CE2 1 1
4 545 1 1 1 . CG C 4.985 -5.800 0.330 1.00 . A A . 1 DPN CG 1 1
4 546 1 1 1 . CZ C 7.626 -4.846 0.793 1.00 . A A . 1 DPN CZ 1 1
4 547 1 1 1 . H1 H 1.531 -5.531 -2.592 1.00 . A A . 1 DPN H1 1 1
4 548 1 1 1 . HA H 2.753 -7.252 -1.652 1.00 . A A . 1 DPN HA 1 1
4 549 1 1 1 . HB2 H 2.875 -5.758 0.686 1.00 . A A . 1 DPN HB2 1 1
4 550 1 1 1 . HB3 H 3.536 -7.348 0.392 1.00 . A A . 1 DPN HB3 1 1
4 551 1 1 1 . HD1 H 4.366 -3.824 0.959 1.00 . A A . 1 DPN HD1 1 1
4 552 1 1 1 . HD2 H 5.954 -7.652 -0.223 1.00 . A A . 1 DPN HD2 1 1
4 553 1 1 1 . HE1 H 6.665 -2.983 1.356 1.00 . A A . 1 DPN HE1 1 1
4 554 1 1 1 . HE2 H 8.260 -6.824 0.185 1.00 . A A . 1 DPN HE2 1 1
4 555 1 1 1 . HZ H 8.630 -4.483 0.964 1.00 . A A . 1 DPN HZ 1 1
4 556 1 1 1 . N N 2.077 -5.285 -1.781 1.00 . A A . 1 DPN N 1 1
4 557 1 1 1 . O O 4.875 -6.992 -2.898 1.00 . A A . 1 DPN O 1 1
4 558 1 1 2 BE2 C C 5.307 -1.862 -2.301 1.00 . A A . 2 BE2 C 1 1
4 559 1 1 2 BE2 C1 C 5.970 -2.740 -3.372 1.00 . A A . 2 BE2 C1 1 1
4 560 1 1 2 BE2 C2 C 5.662 -4.137 -3.468 1.00 . A A . 2 BE2 C2 1 1
4 561 1 1 2 BE2 C3 C 6.299 -4.919 -4.458 1.00 . A A . 2 BE2 C3 1 1
4 562 1 1 2 BE2 C4 C 7.233 -4.353 -5.330 1.00 . A A . 2 BE2 C4 1 1
4 563 1 1 2 BE2 C5 C 7.541 -2.997 -5.245 1.00 . A A . 2 BE2 C5 1 1
4 564 1 1 2 BE2 C6 C 6.923 -2.193 -4.283 1.00 . A A . 2 BE2 C6 1 1
4 565 1 1 2 BE2 H3 H 6.080 -5.968 -4.572 1.00 . A A . 2 BE2 H3 1 1
4 566 1 1 2 BE2 H4 H 7.714 -4.973 -6.082 1.00 . A A . 2 BE2 H4 1 1
4 567 1 1 2 BE2 H5 H 8.271 -2.566 -5.927 1.00 . A A . 2 BE2 H5 1 1
4 568 1 1 2 BE2 H6 H 7.208 -1.143 -4.249 1.00 . A A . 2 BE2 H6 1 1
4 569 1 1 2 BE2 HN21 H 4.190 -4.028 -2.009 1.00 . A A . 2 BE2 HN21 1 1
4 570 1 1 2 BE2 N2 N 4.683 -4.708 -2.577 1.00 . A A . 2 BE2 N2 1 1
4 571 1 1 2 BE2 O1 O 4.635 -2.329 -1.402 1.00 . A A . 2 BE2 O1 1 1
4 572 1 1 3 PHE C C 3.723 1.052 -1.843 1.00 . A A . 3 PHE C 1 1
4 573 1 1 3 PHE CA C 5.072 0.459 -1.429 1.00 . A A . 3 PHE CA 1 1
4 574 1 1 3 PHE CB C 6.126 1.559 -1.309 1.00 . A A . 3 PHE CB 1 1
4 575 1 1 3 PHE CD1 C 6.269 2.150 1.140 1.00 . A A . 3 PHE CD1 1 1
4 576 1 1 3 PHE CD2 C 5.284 3.760 -0.387 1.00 . A A . 3 PHE CD2 1 1
4 577 1 1 3 PHE CE1 C 6.062 3.035 2.222 1.00 . A A . 3 PHE CE1 1 1
4 578 1 1 3 PHE CE2 C 5.070 4.661 0.686 1.00 . A A . 3 PHE CE2 1 1
4 579 1 1 3 PHE CG C 5.890 2.509 -0.169 1.00 . A A . 3 PHE CG 1 1
4 580 1 1 3 PHE CZ C 5.462 4.300 1.991 1.00 . A A . 3 PHE CZ 1 1
4 581 1 1 3 PHE H H 6.010 -0.168 -3.169 1.00 . A A . 3 PHE H 1 1
4 582 1 1 3 PHE HA H 4.985 -0.044 -0.503 1.00 . A A . 3 PHE HA 1 1
4 583 1 1 3 PHE HB2 H 7.103 1.095 -1.169 1.00 . A A . 3 PHE HB2 1 1
4 584 1 1 3 PHE HB3 H 6.147 2.122 -2.239 1.00 . A A . 3 PHE HB3 1 1
4 585 1 1 3 PHE HD1 H 6.729 1.190 1.316 1.00 . A A . 3 PHE HD1 1 1
4 586 1 1 3 PHE HD2 H 4.982 4.048 -1.387 1.00 . A A . 3 PHE HD2 1 1
4 587 1 1 3 PHE HE1 H 6.365 2.748 3.218 1.00 . A A . 3 PHE HE1 1 1
4 588 1 1 3 PHE HE2 H 4.611 5.624 0.505 1.00 . A A . 3 PHE HE2 1 1
4 589 1 1 3 PHE HZ H 5.300 4.980 2.813 1.00 . A A . 3 PHE HZ 1 1
4 590 1 1 3 PHE N N 5.519 -0.506 -2.401 1.00 . A A . 3 PHE N 1 1
4 591 1 1 3 PHE O O 3.440 1.151 -3.036 1.00 . A A . 3 PHE O 1 1
4 592 1 1 4 . C C 1.356 2.729 0.387 1.00 . A A . 4 DPN C 1 1
4 593 1 1 4 . CA C 1.600 2.071 -0.965 1.00 . A A . 4 DPN CA 1 1
4 594 1 1 4 . CB C 1.587 3.223 -1.999 1.00 . A A . 4 DPN CB 1 1
4 595 1 1 4 . CD1 C 0.840 2.542 -4.322 1.00 . A A . 4 DPN CD1 1 1
4 596 1 1 4 . CD2 C -0.792 3.475 -2.801 1.00 . A A . 4 DPN CD2 1 1
4 597 1 1 4 . CE1 C -0.156 2.410 -5.317 1.00 . A A . 4 DPN CE1 1 1
4 598 1 1 4 . CE2 C -1.792 3.361 -3.793 1.00 . A A . 4 DPN CE2 1 1
4 599 1 1 4 . CG C 0.526 3.072 -3.059 1.00 . A A . 4 DPN CG 1 1
4 600 1 1 4 . CZ C -1.475 2.822 -5.051 1.00 . A A . 4 DPN CZ 1 1
4 601 1 1 4 . HA H 0.815 1.341 -1.187 1.00 . A A . 4 DPN HA 1 1
4 602 1 1 4 . HB2 H 1.402 4.160 -1.467 1.00 . A A . 4 DPN HB2 1 1
4 603 1 1 4 . HB3 H 2.565 3.306 -2.470 1.00 . A A . 4 DPN HB3 1 1
4 604 1 1 4 . HD1 H 1.847 2.227 -4.535 1.00 . A A . 4 DPN HD1 1 1
4 605 1 1 4 . HD2 H -1.042 3.877 -1.837 1.00 . A A . 4 DPN HD2 1 1
4 606 1 1 4 . HE1 H 0.096 1.989 -6.286 1.00 . A A . 4 DPN HE1 1 1
4 607 1 1 4 . HE2 H -2.801 3.682 -3.582 1.00 . A A . 4 DPN HE2 1 1
4 608 1 1 4 . HZ H -2.241 2.723 -5.812 1.00 . A A . 4 DPN HZ 1 1
4 609 1 1 4 . N N 2.918 1.409 -0.840 1.00 . A A . 4 DPN N 1 1
4 610 1 1 4 . O O 2.300 2.954 1.137 1.00 . A A . 4 DPN O 1 1
4 611 1 1 5 ASN C C -1.021 2.816 2.858 1.00 . A A . 5 ASN C 1 1
4 612 1 1 5 ASN CA C -0.222 3.743 1.940 1.00 . A A . 5 ASN CA 1 1
4 613 1 1 5 ASN CB C -0.954 5.068 1.642 1.00 . A A . 5 ASN CB 1 1
4 614 1 1 5 ASN CG C -2.321 4.863 1.019 1.00 . A A . 5 ASN CG 1 1
4 615 1 1 5 ASN H H -0.655 2.776 0.072 1.00 . A A . 5 ASN H 1 1
4 616 1 1 5 ASN HA H 0.706 3.989 2.456 1.00 . A A . 5 ASN HA 1 1
4 617 1 1 5 ASN HB2 H -1.077 5.625 2.565 1.00 . A A . 5 ASN HB2 1 1
4 618 1 1 5 ASN HB3 H -0.336 5.660 0.970 1.00 . A A . 5 ASN HB3 1 1
4 619 1 1 5 ASN HD21 H -3.401 5.197 -0.635 1.00 . A A . 5 ASN HD21 1 1
4 620 1 1 5 ASN HD22 H -1.765 5.783 -0.685 1.00 . A A . 5 ASN HD22 1 1
4 621 1 1 5 ASN N N 0.106 3.042 0.699 1.00 . A A . 5 ASN N 1 1
4 622 1 1 5 ASN ND2 N -2.504 5.318 -0.194 1.00 . A A . 5 ASN ND2 1 1
4 623 1 1 5 ASN O O -1.222 1.654 2.539 1.00 . A A . 5 ASN O 1 1
4 624 1 1 5 ASN OD1 O -3.207 4.306 1.637 1.00 . A A . 5 ASN OD1 1 1
4 625 1 1 6 GLN C C -3.495 1.926 4.581 1.00 . A A . 6 GLN C 1 1
4 626 1 1 6 GLN CA C -2.141 2.503 5.007 1.00 . A A . 6 GLN CA 1 1
4 627 1 1 6 GLN CB C -2.336 3.337 6.277 1.00 . A A . 6 GLN CB 1 1
4 628 1 1 6 GLN CD C -1.215 4.501 8.211 1.00 . A A . 6 GLN CD 1 1
4 629 1 1 6 GLN CG C -1.023 3.640 7.006 1.00 . A A . 6 GLN CG 1 1
4 630 1 1 6 GLN H H -1.301 4.297 4.207 1.00 . A A . 6 GLN H 1 1
4 631 1 1 6 GLN HA H -1.504 1.661 5.248 1.00 . A A . 6 GLN HA 1 1
4 632 1 1 6 GLN HB2 H -2.814 4.274 6.002 1.00 . A A . 6 GLN HB2 1 1
4 633 1 1 6 GLN HB3 H -3.001 2.802 6.956 1.00 . A A . 6 GLN HB3 1 1
4 634 1 1 6 GLN HE21 H -0.299 5.145 9.834 1.00 . A A . 6 GLN HE21 1 1
4 635 1 1 6 GLN HE22 H 0.628 4.056 8.851 1.00 . A A . 6 GLN HE22 1 1
4 636 1 1 6 GLN HG2 H -0.558 2.706 7.324 1.00 . A A . 6 GLN HG2 1 1
4 637 1 1 6 GLN HG3 H -0.346 4.164 6.346 1.00 . A A . 6 GLN HG3 1 1
4 638 1 1 6 GLN N N -1.455 3.322 4.000 1.00 . A A . 6 GLN N 1 1
4 639 1 1 6 GLN NE2 N -0.216 4.568 9.029 1.00 . A A . 6 GLN NE2 1 1
4 640 1 1 6 GLN O O -3.887 0.855 5.040 1.00 . A A . 6 GLN O 1 1
4 641 1 1 6 GLN OE1 O -2.249 5.112 8.397 1.00 . A A . 6 GLN OE1 1 1
4 642 1 1 7 TYR C C -5.425 1.416 1.964 1.00 . A A . 7 TYR C 1 1
4 643 1 1 7 TYR CA C -5.521 2.207 3.256 1.00 . A A . 7 TYR CA 1 1
4 644 1 1 7 TYR CB C -6.400 3.440 3.029 1.00 . A A . 7 TYR CB 1 1
4 645 1 1 7 TYR CD1 C -7.910 3.804 5.035 1.00 . A A . 7 TYR CD1 1 1
4 646 1 1 7 TYR CD2 C -5.933 5.188 4.825 1.00 . A A . 7 TYR CD2 1 1
4 647 1 1 7 TYR CE1 C -8.251 4.473 6.244 1.00 . A A . 7 TYR CE1 1 1
4 648 1 1 7 TYR CE2 C -6.269 5.855 6.037 1.00 . A A . 7 TYR CE2 1 1
4 649 1 1 7 TYR CG C -6.752 4.156 4.317 1.00 . A A . 7 TYR CG 1 1
4 650 1 1 7 TYR CZ C -7.429 5.494 6.728 1.00 . A A . 7 TYR CZ 1 1
4 651 1 1 7 TYR H H -3.810 3.477 3.330 1.00 . A A . 7 TYR H 1 1
4 652 1 1 7 TYR HA H -5.989 1.581 4.019 1.00 . A A . 7 TYR HA 1 1
4 653 1 1 7 TYR HB2 H -5.890 4.137 2.365 1.00 . A A . 7 TYR HB2 1 1
4 654 1 1 7 TYR HB3 H -7.329 3.124 2.550 1.00 . A A . 7 TYR HB3 1 1
4 655 1 1 7 TYR HD1 H -8.539 3.010 4.668 1.00 . A A . 7 TYR HD1 1 1
4 656 1 1 7 TYR HD2 H -5.041 5.483 4.295 1.00 . A A . 7 TYR HD2 1 1
4 657 1 1 7 TYR HE1 H -9.143 4.203 6.784 1.00 . A A . 7 TYR HE1 1 1
4 658 1 1 7 TYR HE2 H -5.633 6.640 6.423 1.00 . A A . 7 TYR HE2 1 1
4 659 1 1 7 TYR HH H -7.127 6.811 8.147 1.00 . A A . 7 TYR HH 1 1
4 660 1 1 7 TYR N N -4.193 2.624 3.703 1.00 . A A . 7 TYR N 1 1
4 661 1 1 7 TYR O O -6.160 0.461 1.756 1.00 . A A . 7 TYR O 1 1
4 662 1 1 7 TYR OH O -7.759 6.131 7.898 1.00 . A A . 7 TYR OH 1 1
4 663 1 1 8 VAL C C -2.875 0.555 -0.155 1.00 . A A . 8 VAL C 1 1
4 664 1 1 8 VAL CA C -4.279 1.122 -0.169 1.00 . A A . 8 VAL CA 1 1
4 665 1 1 8 VAL CB C -4.516 2.038 -1.389 1.00 . A A . 8 VAL CB 1 1
4 666 1 1 8 VAL CG1 C -4.344 1.238 -2.703 1.00 . A A . 8 VAL CG1 1 1
4 667 1 1 8 VAL CG2 C -5.928 2.610 -1.324 1.00 . A A . 8 VAL CG2 1 1
4 668 1 1 8 VAL H H -3.913 2.609 1.324 1.00 . A A . 8 VAL H 1 1
4 669 1 1 8 VAL HA H -4.978 0.288 -0.235 1.00 . A A . 8 VAL HA 1 1
4 670 1 1 8 VAL HB H -3.802 2.860 -1.371 1.00 . A A . 8 VAL HB 1 1
4 671 1 1 8 VAL HG11 H -5.015 0.379 -2.703 1.00 . A A . 8 VAL HG11 1 1
4 672 1 1 8 VAL HG12 H -3.310 0.894 -2.786 1.00 . A A . 8 VAL HG12 1 1
4 673 1 1 8 VAL HG13 H -4.575 1.875 -3.555 1.00 . A A . 8 VAL HG13 1 1
4 674 1 1 8 VAL HG21 H -6.012 3.282 -0.473 1.00 . A A . 8 VAL HG21 1 1
4 675 1 1 8 VAL HG22 H -6.644 1.795 -1.208 1.00 . A A . 8 VAL HG22 1 1
4 676 1 1 8 VAL HG23 H -6.147 3.160 -2.243 1.00 . A A . 8 VAL HG23 1 1
4 677 1 1 8 VAL N N -4.499 1.812 1.103 1.00 . A A . 8 VAL N 1 1
4 678 1 1 8 VAL O O -1.880 1.256 -0.403 1.00 . A A . 8 VAL O 1 1
4 679 1 1 9 ORN C C -1.210 -2.383 -0.603 1.00 . A A . 9 ORN C 1 1
4 680 1 1 9 ORN CA C -1.629 -1.461 0.548 1.00 . A A . 9 ORN CA 1 1
4 681 1 1 9 ORN CB C -1.907 -2.281 1.836 1.00 . A A . 9 ORN CB 1 1
4 682 1 1 9 ORN CD C -2.416 -2.167 4.340 1.00 . A A . 9 ORN CD 1 1
4 683 1 1 9 ORN CG C -2.063 -1.362 3.075 1.00 . A A . 9 ORN CG 1 1
4 684 1 1 9 ORN H H -3.727 -1.205 0.275 1.00 . A A . 9 ORN H 1 1
4 685 1 1 9 ORN HA H -0.824 -0.748 0.741 1.00 . A A . 9 ORN HA 1 1
4 686 1 1 9 ORN HB2 H -2.826 -2.861 1.700 1.00 . A A . 9 ORN HB2 1 1
4 687 1 1 9 ORN HB3 H -1.074 -2.966 1.997 1.00 . A A . 9 ORN HB3 1 1
4 688 1 1 9 ORN HD2 H -2.766 -1.473 5.111 1.00 . A A . 9 ORN HD2 1 1
4 689 1 1 9 ORN HD3 H -3.221 -2.870 4.105 1.00 . A A . 9 ORN HD3 1 1
4 690 1 1 9 ORN HE1 H -0.924 -3.570 4.151 1.00 . A A . 9 ORN HE1 1 1
4 691 1 1 9 ORN HE2 H -0.500 -2.261 5.069 1.00 . A A . 9 ORN HE2 1 1
4 692 1 1 9 ORN HE3 H -1.505 -3.414 5.689 1.00 . A A . 9 ORN HE3 1 1
4 693 1 1 9 ORN HG2 H -1.132 -0.818 3.243 1.00 . A A . 9 ORN HG2 1 1
4 694 1 1 9 ORN HG3 H -2.866 -0.641 2.888 1.00 . A A . 9 ORN HG3 1 1
4 695 1 1 9 ORN N N -2.842 -0.733 0.165 1.00 . A A . 9 ORN N 1 1
4 696 1 1 9 ORN NE N -1.246 -2.912 4.853 1.00 . A A . 9 ORN NE 1 1
4 697 1 1 9 ORN O O -2.056 -3.084 -1.176 1.00 . A A . 9 ORN O 1 1
4 698 1 1 10 LEU C C 1.777 -4.129 -1.184 1.00 . A A . 10 LEU C 1 1
4 699 1 1 10 LEU CA C 0.681 -3.324 -1.857 1.00 . A A . 10 LEU CA 1 1
4 700 1 1 10 LEU CB C 1.275 -2.478 -3.001 1.00 . A A . 10 LEU CB 1 1
4 701 1 1 10 LEU CD1 C -0.493 -2.936 -4.759 1.00 . A A . 10 LEU CD1 1 1
4 702 1 1 10 LEU CD2 C -0.544 -0.750 -3.556 1.00 . A A . 10 LEU CD2 1 1
4 703 1 1 10 LEU CG C 0.361 -1.860 -4.085 1.00 . A A . 10 LEU CG 1 1
4 704 1 1 10 LEU H H 0.740 -1.974 -0.260 1.00 . A A . 10 LEU H 1 1
4 705 1 1 10 LEU HA H -0.070 -3.988 -2.235 1.00 . A A . 10 LEU HA 1 1
4 706 1 1 10 LEU HB2 H 1.850 -1.669 -2.552 1.00 . A A . 10 LEU HB2 1 1
4 707 1 1 10 LEU HB3 H 1.989 -3.115 -3.522 1.00 . A A . 10 LEU HB3 1 1
4 708 1 1 10 LEU HD11 H -1.201 -3.352 -4.043 1.00 . A A . 10 LEU HD11 1 1
4 709 1 1 10 LEU HD12 H 0.148 -3.728 -5.144 1.00 . A A . 10 LEU HD12 1 1
4 710 1 1 10 LEU HD13 H -1.042 -2.491 -5.584 1.00 . A A . 10 LEU HD13 1 1
4 711 1 1 10 LEU HD21 H -1.006 -0.224 -4.395 1.00 . A A . 10 LEU HD21 1 1
4 712 1 1 10 LEU HD22 H 0.048 -0.038 -2.982 1.00 . A A . 10 LEU HD22 1 1
4 713 1 1 10 LEU HD23 H -1.323 -1.168 -2.923 1.00 . A A . 10 LEU HD23 1 1
4 714 1 1 10 LEU HG H 1.006 -1.419 -4.846 1.00 . A A . 10 LEU HG 1 1
4 715 1 1 10 LEU N N 0.098 -2.485 -0.825 1.00 . A A . 10 LEU N 1 1
4 716 1 1 10 LEU O O 2.301 -3.681 -0.177 1.00 . A A . 10 LEU O 1 1
5 717 1 1 1 . C C 4.250 -4.875 -3.382 1.00 . A A . 1 DPN C 1 1
5 718 1 1 1 . CA C 3.379 -5.602 -2.349 1.00 . A A . 1 DPN CA 1 1
5 719 1 1 1 . CB C 3.947 -5.614 -0.902 1.00 . A A . 1 DPN CB 1 1
5 720 1 1 1 . CD1 C 5.273 -3.622 -0.071 1.00 . A A . 1 DPN CD1 1 1
5 721 1 1 1 . CD2 C 6.454 -5.398 -1.227 1.00 . A A . 1 DPN CD2 1 1
5 722 1 1 1 . CE1 C 6.488 -2.910 0.093 1.00 . A A . 1 DPN CE1 1 1
5 723 1 1 1 . CE2 C 7.675 -4.697 -1.071 1.00 . A A . 1 DPN CE2 1 1
5 724 1 1 1 . CG C 5.247 -4.862 -0.735 1.00 . A A . 1 DPN CG 1 1
5 725 1 1 1 . CZ C 7.688 -3.447 -0.414 1.00 . A A . 1 DPN CZ 1 1
5 726 1 1 1 . H1 H 1.389 -5.687 -3.100 1.00 . A A . 1 DPN H1 1 1
5 727 1 1 1 . HA H 3.384 -6.646 -2.663 1.00 . A A . 1 DPN HA 1 1
5 728 1 1 1 . HB2 H 3.213 -5.210 -0.212 1.00 . A A . 1 DPN HB2 1 1
5 729 1 1 1 . HB3 H 4.121 -6.652 -0.619 1.00 . A A . 1 DPN HB3 1 1
5 730 1 1 1 . HD1 H 4.354 -3.202 0.313 1.00 . A A . 1 DPN HD1 1 1
5 731 1 1 1 . HD2 H 6.449 -6.351 -1.740 1.00 . A A . 1 DPN HD2 1 1
5 732 1 1 1 . HE1 H 6.492 -1.956 0.597 1.00 . A A . 1 DPN HE1 1 1
5 733 1 1 1 . HE2 H 8.593 -5.114 -1.461 1.00 . A A . 1 DPN HE2 1 1
5 734 1 1 1 . HZ H 8.616 -2.904 -0.300 1.00 . A A . 1 DPN HZ 1 1
5 735 1 1 1 . N N 1.971 -5.155 -2.474 1.00 . A A . 1 DPN N 1 1
5 736 1 1 1 . O O 4.867 -5.524 -4.216 1.00 . A A . 1 DPN O 1 1
5 737 1 1 2 BE2 C C 4.858 -0.799 -2.298 1.00 . A A . 2 BE2 C 1 1
5 738 1 1 2 BE2 C1 C 5.244 -1.227 -3.708 1.00 . A A . 2 BE2 C1 1 1
5 739 1 1 2 BE2 C2 C 4.936 -2.544 -4.174 1.00 . A A . 2 BE2 C2 1 1
5 740 1 1 2 BE2 C3 C 5.296 -2.907 -5.492 1.00 . A A . 2 BE2 C3 1 1
5 741 1 1 2 BE2 C4 C 5.954 -2.002 -6.332 1.00 . A A . 2 BE2 C4 1 1
5 742 1 1 2 BE2 C5 C 6.261 -0.718 -5.880 1.00 . A A . 2 BE2 C5 1 1
5 743 1 1 2 BE2 C6 C 5.917 -0.328 -4.582 1.00 . A A . 2 BE2 C6 1 1
5 744 1 1 2 BE2 H3 H 5.064 -3.891 -5.878 1.00 . A A . 2 BE2 H3 1 1
5 745 1 1 2 BE2 H4 H 6.225 -2.300 -7.342 1.00 . A A . 2 BE2 H4 1 1
5 746 1 1 2 BE2 H5 H 6.768 -0.020 -6.541 1.00 . A A . 2 BE2 H5 1 1
5 747 1 1 2 BE2 H6 H 6.162 0.682 -4.273 1.00 . A A . 2 BE2 H6 1 1
5 748 1 1 2 BE2 HN21 H 3.763 -3.069 -2.527 1.00 . A A . 2 BE2 HN21 1 1
5 749 1 1 2 BE2 N2 N 4.265 -3.484 -3.308 1.00 . A A . 2 BE2 N2 1 1
5 750 1 1 2 BE2 O1 O 4.077 -1.439 -1.620 1.00 . A A . 2 BE2 O1 1 1
5 751 1 1 3 PHE C C 3.995 1.805 -0.538 1.00 . A A . 3 PHE C 1 1
5 752 1 1 3 PHE CA C 5.173 0.851 -0.491 1.00 . A A . 3 PHE CA 1 1
5 753 1 1 3 PHE CB C 6.418 1.518 0.097 1.00 . A A . 3 PHE CB 1 1
5 754 1 1 3 PHE CD1 C 5.626 2.647 2.225 1.00 . A A . 3 PHE CD1 1 1
5 755 1 1 3 PHE CD2 C 7.095 0.721 2.398 1.00 . A A . 3 PHE CD2 1 1
5 756 1 1 3 PHE CE1 C 5.580 2.747 3.639 1.00 . A A . 3 PHE CE1 1 1
5 757 1 1 3 PHE CE2 C 7.059 0.812 3.813 1.00 . A A . 3 PHE CE2 1 1
5 758 1 1 3 PHE CG C 6.381 1.634 1.598 1.00 . A A . 3 PHE CG 1 1
5 759 1 1 3 PHE CZ C 6.300 1.827 4.433 1.00 . A A . 3 PHE CZ 1 1
5 760 1 1 3 PHE H H 6.010 0.896 -2.393 1.00 . A A . 3 PHE H 1 1
5 761 1 1 3 PHE HA H 4.934 0.004 0.089 1.00 . A A . 3 PHE HA 1 1
5 762 1 1 3 PHE HB2 H 7.292 0.928 -0.177 1.00 . A A . 3 PHE HB2 1 1
5 763 1 1 3 PHE HB3 H 6.529 2.512 -0.334 1.00 . A A . 3 PHE HB3 1 1
5 764 1 1 3 PHE HD1 H 5.069 3.353 1.623 1.00 . A A . 3 PHE HD1 1 1
5 765 1 1 3 PHE HD2 H 7.678 -0.060 1.931 1.00 . A A . 3 PHE HD2 1 1
5 766 1 1 3 PHE HE1 H 4.999 3.528 4.107 1.00 . A A . 3 PHE HE1 1 1
5 767 1 1 3 PHE HE2 H 7.618 0.110 4.415 1.00 . A A . 3 PHE HE2 1 1
5 768 1 1 3 PHE HZ H 6.275 1.904 5.511 1.00 . A A . 3 PHE HZ 1 1
5 769 1 1 3 PHE N N 5.416 0.375 -1.826 1.00 . A A . 3 PHE N 1 1
5 770 1 1 3 PHE O O 4.134 2.966 -0.913 1.00 . A A . 3 PHE O 1 1
5 771 1 1 4 . C C 1.237 2.706 1.030 1.00 . A A . 4 DPN C 1 1
5 772 1 1 4 . CA C 1.515 1.871 -0.208 1.00 . A A . 4 DPN CA 1 1
5 773 1 1 4 . CB C 1.226 2.647 -1.510 1.00 . A A . 4 DPN CB 1 1
5 774 1 1 4 . CD1 C 2.468 1.738 -3.527 1.00 . A A . 4 DPN CD1 1 1
5 775 1 1 4 . CD2 C 0.180 1.025 -3.143 1.00 . A A . 4 DPN CD2 1 1
5 776 1 1 4 . CE1 C 2.535 0.921 -4.682 1.00 . A A . 4 DPN CE1 1 1
5 777 1 1 4 . CE2 C 0.233 0.213 -4.305 1.00 . A A . 4 DPN CE2 1 1
5 778 1 1 4 . CG C 1.294 1.790 -2.748 1.00 . A A . 4 DPN CG 1 1
5 779 1 1 4 . CZ C 1.416 0.159 -5.070 1.00 . A A . 4 DPN CZ 1 1
5 780 1 1 4 . HA H 0.803 1.060 -0.185 1.00 . A A . 4 DPN HA 1 1
5 781 1 1 4 . HB2 H 0.223 3.067 -1.447 1.00 . A A . 4 DPN HB2 1 1
5 782 1 1 4 . HB3 H 1.924 3.473 -1.606 1.00 . A A . 4 DPN HB3 1 1
5 783 1 1 4 . HD1 H 3.327 2.327 -3.241 1.00 . A A . 4 DPN HD1 1 1
5 784 1 1 4 . HD2 H -0.731 1.060 -2.561 1.00 . A A . 4 DPN HD2 1 1
5 785 1 1 4 . HE1 H 3.440 0.890 -5.271 1.00 . A A . 4 DPN HE1 1 1
5 786 1 1 4 . HE2 H -0.628 -0.361 -4.607 1.00 . A A . 4 DPN HE2 1 1
5 787 1 1 4 . HZ H 1.463 -0.463 -5.955 1.00 . A A . 4 DPN HZ 1 1
5 788 1 1 4 . N N 2.848 1.243 -0.164 1.00 . A A . 4 DPN N 1 1
5 789 1 1 4 . O O 2.149 3.171 1.704 1.00 . A A . 4 DPN O 1 1
5 790 1 1 5 ASN C C -1.383 2.832 3.347 1.00 . A A . 5 ASN C 1 1
5 791 1 1 5 ASN CA C -0.470 3.685 2.466 1.00 . A A . 5 ASN CA 1 1
5 792 1 1 5 ASN CB C -1.162 4.967 1.967 1.00 . A A . 5 ASN CB 1 1
5 793 1 1 5 ASN CG C -2.382 4.680 1.122 1.00 . A A . 5 ASN CG 1 1
5 794 1 1 5 ASN H H -0.757 2.436 0.763 1.00 . A A . 5 ASN H 1 1
5 795 1 1 5 ASN HA H 0.401 3.970 3.056 1.00 . A A . 5 ASN HA 1 1
5 796 1 1 5 ASN HB2 H -1.459 5.574 2.820 1.00 . A A . 5 ASN HB2 1 1
5 797 1 1 5 ASN HB3 H -0.447 5.539 1.379 1.00 . A A . 5 ASN HB3 1 1
5 798 1 1 5 ASN HD21 H -3.084 4.729 -0.751 1.00 . A A . 5 ASN HD21 1 1
5 799 1 1 5 ASN HD22 H -1.432 5.254 -0.560 1.00 . A A . 5 ASN HD22 1 1
5 800 1 1 5 ASN N N -0.038 2.883 1.332 1.00 . A A . 5 ASN N 1 1
5 801 1 1 5 ASN ND2 N -2.288 4.908 -0.162 1.00 . A A . 5 ASN ND2 1 1
5 802 1 1 5 ASN O O -1.508 1.630 3.130 1.00 . A A . 5 ASN O 1 1
5 803 1 1 5 ASN OD1 O -3.403 4.264 1.634 1.00 . A A . 5 ASN OD1 1 1
5 804 1 1 6 GLN C C -4.088 2.101 4.744 1.00 . A A . 6 GLN C 1 1
5 805 1 1 6 GLN CA C -2.821 2.728 5.319 1.00 . A A . 6 GLN CA 1 1
5 806 1 1 6 GLN CB C -3.226 3.693 6.438 1.00 . A A . 6 GLN CB 1 1
5 807 1 1 6 GLN CD C -2.447 5.229 8.278 1.00 . A A . 6 GLN CD 1 1
5 808 1 1 6 GLN CG C -2.041 4.234 7.243 1.00 . A A . 6 GLN CG 1 1
5 809 1 1 6 GLN H H -1.891 4.443 4.460 1.00 . A A . 6 GLN H 1 1
5 810 1 1 6 GLN HA H -2.229 1.930 5.746 1.00 . A A . 6 GLN HA 1 1
5 811 1 1 6 GLN HB2 H -3.761 4.533 5.991 1.00 . A A . 6 GLN HB2 1 1
5 812 1 1 6 GLN HB3 H -3.903 3.176 7.117 1.00 . A A . 6 GLN HB3 1 1
5 813 1 1 6 GLN HE21 H -1.771 6.183 9.867 1.00 . A A . 6 GLN HE21 1 1
5 814 1 1 6 GLN HE22 H -0.654 5.064 9.151 1.00 . A A . 6 GLN HE22 1 1
5 815 1 1 6 GLN HG2 H -1.538 3.407 7.738 1.00 . A A . 6 GLN HG2 1 1
5 816 1 1 6 GLN HG3 H -1.336 4.724 6.584 1.00 . A A . 6 GLN HG3 1 1
5 817 1 1 6 GLN N N -1.997 3.448 4.347 1.00 . A A . 6 GLN N 1 1
5 818 1 1 6 GLN NE2 N -1.552 5.511 9.171 1.00 . A A . 6 GLN NE2 1 1
5 819 1 1 6 GLN O O -4.534 1.061 5.211 1.00 . A A . 6 GLN O 1 1
5 820 1 1 6 GLN OE1 O -3.544 5.750 8.271 1.00 . A A . 6 GLN OE1 1 1
5 821 1 1 7 TYR C C -5.746 1.424 1.942 1.00 . A A . 7 TYR C 1 1
5 822 1 1 7 TYR CA C -5.935 2.307 3.170 1.00 . A A . 7 TYR CA 1 1
5 823 1 1 7 TYR CB C -6.755 3.540 2.790 1.00 . A A . 7 TYR CB 1 1
5 824 1 1 7 TYR CD1 C -5.786 5.843 3.285 1.00 . A A . 7 TYR CD1 1 1
5 825 1 1 7 TYR CD2 C -6.992 4.694 5.048 1.00 . A A . 7 TYR CD2 1 1
5 826 1 1 7 TYR CE1 C -5.539 6.934 4.163 1.00 . A A . 7 TYR CE1 1 1
5 827 1 1 7 TYR CE2 C -6.741 5.782 5.928 1.00 . A A . 7 TYR CE2 1 1
5 828 1 1 7 TYR CG C -6.512 4.711 3.722 1.00 . A A . 7 TYR CG 1 1
5 829 1 1 7 TYR CZ C -6.021 6.889 5.476 1.00 . A A . 7 TYR CZ 1 1
5 830 1 1 7 TYR H H -4.225 3.571 3.370 1.00 . A A . 7 TYR H 1 1
5 831 1 1 7 TYR HA H -6.485 1.740 3.923 1.00 . A A . 7 TYR HA 1 1
5 832 1 1 7 TYR HB2 H -6.486 3.845 1.779 1.00 . A A . 7 TYR HB2 1 1
5 833 1 1 7 TYR HB3 H -7.814 3.281 2.803 1.00 . A A . 7 TYR HB3 1 1
5 834 1 1 7 TYR HD1 H -5.411 5.881 2.272 1.00 . A A . 7 TYR HD1 1 1
5 835 1 1 7 TYR HD2 H -7.548 3.839 5.407 1.00 . A A . 7 TYR HD2 1 1
5 836 1 1 7 TYR HE1 H -4.988 7.794 3.816 1.00 . A A . 7 TYR HE1 1 1
5 837 1 1 7 TYR HE2 H -7.105 5.758 6.944 1.00 . A A . 7 TYR HE2 1 1
5 838 1 1 7 TYR HH H -5.282 8.645 5.920 1.00 . A A . 7 TYR HH 1 1
5 839 1 1 7 TYR N N -4.663 2.744 3.744 1.00 . A A . 7 TYR N 1 1
5 840 1 1 7 TYR O O -6.485 0.469 1.726 1.00 . A A . 7 TYR O 1 1
5 841 1 1 7 TYR OH O -5.794 7.943 6.323 1.00 . A A . 7 TYR OH 1 1
5 842 1 1 8 VAL C C -2.996 0.544 0.004 1.00 . A A . 8 VAL C 1 1
5 843 1 1 8 VAL CA C -4.435 0.993 -0.072 1.00 . A A . 8 VAL CA 1 1
5 844 1 1 8 VAL CB C -4.670 1.829 -1.357 1.00 . A A . 8 VAL CB 1 1
5 845 1 1 8 VAL CG1 C -4.303 1.014 -2.616 1.00 . A A . 8 VAL CG1 1 1
5 846 1 1 8 VAL CG2 C -6.133 2.247 -1.432 1.00 . A A . 8 VAL CG2 1 1
5 847 1 1 8 VAL H H -4.170 2.555 1.358 1.00 . A A . 8 VAL H 1 1
5 848 1 1 8 VAL HA H -5.072 0.110 -0.113 1.00 . A A . 8 VAL HA 1 1
5 849 1 1 8 VAL HB H -4.048 2.723 -1.322 1.00 . A A . 8 VAL HB 1 1
5 850 1 1 8 VAL HG11 H -3.238 0.789 -2.614 1.00 . A A . 8 VAL HG11 1 1
5 851 1 1 8 VAL HG12 H -4.539 1.598 -3.508 1.00 . A A . 8 VAL HG12 1 1
5 852 1 1 8 VAL HG13 H -4.873 0.083 -2.635 1.00 . A A . 8 VAL HG13 1 1
5 853 1 1 8 VAL HG21 H -6.327 2.748 -2.379 1.00 . A A . 8 VAL HG21 1 1
5 854 1 1 8 VAL HG22 H -6.363 2.928 -0.614 1.00 . A A . 8 VAL HG22 1 1
5 855 1 1 8 VAL HG23 H -6.769 1.359 -1.350 1.00 . A A . 8 VAL HG23 1 1
5 856 1 1 8 VAL N N -4.745 1.751 1.137 1.00 . A A . 8 VAL N 1 1
5 857 1 1 8 VAL O O -2.061 1.363 -0.060 1.00 . A A . 8 VAL O 1 1
5 858 1 1 9 ORN C C -1.414 -2.704 -0.377 1.00 . A A . 9 ORN C 1 1
5 859 1 1 9 ORN CA C -1.544 -1.393 0.410 1.00 . A A . 9 ORN CA 1 1
5 860 1 1 9 ORN CB C -1.369 -1.604 1.934 1.00 . A A . 9 ORN CB 1 1
5 861 1 1 9 ORN CD C 0.304 -1.519 3.857 1.00 . A A . 9 ORN CD 1 1
5 862 1 1 9 ORN CG C 0.129 -1.525 2.326 1.00 . A A . 9 ORN CG 1 1
5 863 1 1 9 ORN H H -3.664 -1.346 0.189 1.00 . A A . 9 ORN H 1 1
5 864 1 1 9 ORN HA H -0.772 -0.718 0.065 1.00 . A A . 9 ORN HA 1 1
5 865 1 1 9 ORN HB2 H -1.918 -0.824 2.468 1.00 . A A . 9 ORN HB2 1 1
5 866 1 1 9 ORN HB3 H -1.775 -2.577 2.215 1.00 . A A . 9 ORN HB3 1 1
5 867 1 1 9 ORN HD2 H 1.339 -1.254 4.091 1.00 . A A . 9 ORN HD2 1 1
5 868 1 1 9 ORN HD3 H -0.356 -0.760 4.290 1.00 . A A . 9 ORN HD3 1 1
5 869 1 1 9 ORN HE1 H 0.607 -3.543 4.056 1.00 . A A . 9 ORN HE1 1 1
5 870 1 1 9 ORN HE2 H 0.125 -2.806 5.452 1.00 . A A . 9 ORN HE2 1 1
5 871 1 1 9 ORN HE3 H -0.967 -3.086 4.248 1.00 . A A . 9 ORN HE3 1 1
5 872 1 1 9 ORN HG2 H 0.664 -2.376 1.899 1.00 . A A . 9 ORN HG2 1 1
5 873 1 1 9 ORN HG3 H 0.554 -0.602 1.925 1.00 . A A . 9 ORN HG3 1 1
5 874 1 1 9 ORN N N -2.838 -0.765 0.149 1.00 . A A . 9 ORN N 1 1
5 875 1 1 9 ORN NE N -0.006 -2.842 4.449 1.00 . A A . 9 ORN NE 1 1
5 876 1 1 9 ORN O O -2.215 -3.631 -0.197 1.00 . A A . 9 ORN O 1 1
5 877 1 1 10 LEU C C 1.414 -4.131 -1.827 1.00 . A A . 10 LEU C 1 1
5 878 1 1 10 LEU CA C -0.068 -3.892 -2.074 1.00 . A A . 10 LEU CA 1 1
5 879 1 1 10 LEU CB C -0.336 -3.552 -3.557 1.00 . A A . 10 LEU CB 1 1
5 880 1 1 10 LEU CD1 C -2.423 -4.952 -3.899 1.00 . A A . 10 LEU CD1 1 1
5 881 1 1 10 LEU CD2 C -2.687 -2.488 -3.564 1.00 . A A . 10 LEU CD2 1 1
5 882 1 1 10 LEU CG C -1.775 -3.584 -4.126 1.00 . A A . 10 LEU CG 1 1
5 883 1 1 10 LEU H H 0.269 -2.012 -1.245 1.00 . A A . 10 LEU H 1 1
5 884 1 1 10 LEU HA H -0.632 -4.749 -1.766 1.00 . A A . 10 LEU HA 1 1
5 885 1 1 10 LEU HB2 H 0.072 -2.560 -3.745 1.00 . A A . 10 LEU HB2 1 1
5 886 1 1 10 LEU HB3 H 0.244 -4.247 -4.159 1.00 . A A . 10 LEU HB3 1 1
5 887 1 1 10 LEU HD11 H -1.779 -5.737 -4.298 1.00 . A A . 10 LEU HD11 1 1
5 888 1 1 10 LEU HD12 H -3.382 -4.987 -4.419 1.00 . A A . 10 LEU HD12 1 1
5 889 1 1 10 LEU HD13 H -2.588 -5.119 -2.834 1.00 . A A . 10 LEU HD13 1 1
5 890 1 1 10 LEU HD21 H -3.594 -2.428 -4.171 1.00 . A A . 10 LEU HD21 1 1
5 891 1 1 10 LEU HD22 H -2.176 -1.529 -3.596 1.00 . A A . 10 LEU HD22 1 1
5 892 1 1 10 LEU HD23 H -2.964 -2.721 -2.539 1.00 . A A . 10 LEU HD23 1 1
5 893 1 1 10 LEU HG H -1.702 -3.426 -5.200 1.00 . A A . 10 LEU HG 1 1
5 894 1 1 10 LEU N N -0.375 -2.769 -1.206 1.00 . A A . 10 LEU N 1 1
5 895 1 1 10 LEU O O 2.013 -3.373 -1.074 1.00 . A A . 10 LEU O 1 1
6 896 1 1 1 . C C 4.203 -5.331 -2.878 1.00 . A A . 1 DPN C 1 1
6 897 1 1 1 . CA C 3.223 -5.814 -1.804 1.00 . A A . 1 DPN CA 1 1
6 898 1 1 1 . CB C 3.843 -5.792 -0.369 1.00 . A A . 1 DPN CB 1 1
6 899 1 1 1 . CD1 C 5.076 -3.679 0.367 1.00 . A A . 1 DPN CD1 1 1
6 900 1 1 1 . CD2 C 6.343 -5.447 -0.721 1.00 . A A . 1 DPN CD2 1 1
6 901 1 1 1 . CE1 C 6.256 -2.904 0.480 1.00 . A A . 1 DPN CE1 1 1
6 902 1 1 1 . CE2 C 7.520 -4.673 -0.609 1.00 . A A . 1 DPN CE2 1 1
6 903 1 1 1 . CG C 5.107 -4.952 -0.243 1.00 . A A . 1 DPN CG 1 1
6 904 1 1 1 . CZ C 7.473 -3.401 -0.013 1.00 . A A . 1 DPN CZ 1 1
6 905 1 1 1 . H1 H 1.314 -5.470 -2.664 1.00 . A A . 1 DPN H1 1 1
6 906 1 1 1 . HA H 3.020 -6.859 -2.029 1.00 . A A . 1 DPN HA 1 1
6 907 1 1 1 . HB2 H 3.105 -5.441 0.348 1.00 . A A . 1 DPN HB2 1 1
6 908 1 1 1 . HB3 H 4.098 -6.816 -0.103 1.00 . A A . 1 DPN HB3 1 1
6 909 1 1 1 . HD1 H 4.151 -3.290 0.751 1.00 . A A . 1 DPN HD1 1 1
6 910 1 1 1 . HD2 H 6.389 -6.424 -1.178 1.00 . A A . 1 DPN HD2 1 1
6 911 1 1 1 . HE1 H 6.222 -1.930 0.945 1.00 . A A . 1 DPN HE1 1 1
6 912 1 1 1 . HE2 H 8.457 -5.055 -0.984 1.00 . A A . 1 DPN HE2 1 1
6 913 1 1 1 . HZ H 8.370 -2.810 0.064 1.00 . A A . 1 DPN HZ 1 1
6 914 1 1 1 . N N 1.937 -5.082 -1.973 1.00 . A A . 1 DPN N 1 1
6 915 1 1 1 . O O 4.829 -6.143 -3.548 1.00 . A A . 1 DPN O 1 1
6 916 1 1 2 BE2 C C 4.781 -1.198 -2.403 1.00 . A A . 2 BE2 C 1 1
6 917 1 1 2 BE2 C1 C 5.352 -1.821 -3.657 1.00 . A A . 2 BE2 C1 1 1
6 918 1 1 2 BE2 C2 C 5.090 -3.190 -3.943 1.00 . A A . 2 BE2 C2 1 1
6 919 1 1 2 BE2 C3 C 5.628 -3.764 -5.122 1.00 . A A . 2 BE2 C3 1 1
6 920 1 1 2 BE2 C4 C 6.413 -2.995 -5.995 1.00 . A A . 2 BE2 C4 1 1
6 921 1 1 2 BE2 C5 C 6.677 -1.652 -5.704 1.00 . A A . 2 BE2 C5 1 1
6 922 1 1 2 BE2 C6 C 6.154 -1.064 -4.546 1.00 . A A . 2 BE2 C6 1 1
6 923 1 1 2 BE2 H3 H 5.440 -4.800 -5.370 1.00 . A A . 2 BE2 H3 1 1
6 924 1 1 2 BE2 H4 H 6.822 -3.445 -6.895 1.00 . A A . 2 BE2 H4 1 1
6 925 1 1 2 BE2 H5 H 7.287 -1.062 -6.383 1.00 . A A . 2 BE2 H5 1 1
6 926 1 1 2 BE2 H6 H 6.368 -0.018 -4.354 1.00 . A A . 2 BE2 H6 1 1
6 927 1 1 2 BE2 HN21 H 3.758 -3.413 -2.362 1.00 . A A . 2 BE2 HN21 1 1
6 928 1 1 2 BE2 N2 N 4.295 -3.963 -3.029 1.00 . A A . 2 BE2 N2 1 1
6 929 1 1 2 BE2 O1 O 3.815 -1.675 -1.831 1.00 . A A . 2 BE2 O1 1 1
6 930 1 1 3 PHE C C 3.917 1.622 -0.994 1.00 . A A . 3 PHE C 1 1
6 931 1 1 3 PHE CA C 4.976 0.579 -0.711 1.00 . A A . 3 PHE CA 1 1
6 932 1 1 3 PHE CB C 6.153 1.192 0.041 1.00 . A A . 3 PHE CB 1 1
6 933 1 1 3 PHE CD1 C 5.571 3.123 1.572 1.00 . A A . 3 PHE CD1 1 1
6 934 1 1 3 PHE CD2 C 5.603 0.877 2.493 1.00 . A A . 3 PHE CD2 1 1
6 935 1 1 3 PHE CE1 C 5.200 3.646 2.837 1.00 . A A . 3 PHE CE1 1 1
6 936 1 1 3 PHE CE2 C 5.230 1.388 3.765 1.00 . A A . 3 PHE CE2 1 1
6 937 1 1 3 PHE CG C 5.774 1.742 1.394 1.00 . A A . 3 PHE CG 1 1
6 938 1 1 3 PHE CZ C 5.024 2.774 3.935 1.00 . A A . 3 PHE CZ 1 1
6 939 1 1 3 PHE H H 6.139 0.339 -2.430 1.00 . A A . 3 PHE H 1 1
6 940 1 1 3 PHE HA H 4.560 -0.185 -0.110 1.00 . A A . 3 PHE HA 1 1
6 941 1 1 3 PHE HB2 H 6.914 0.428 0.177 1.00 . A A . 3 PHE HB2 1 1
6 942 1 1 3 PHE HB3 H 6.578 1.997 -0.557 1.00 . A A . 3 PHE HB3 1 1
6 943 1 1 3 PHE HD1 H 5.692 3.796 0.731 1.00 . A A . 3 PHE HD1 1 1
6 944 1 1 3 PHE HD2 H 5.757 -0.184 2.373 1.00 . A A . 3 PHE HD2 1 1
6 945 1 1 3 PHE HE1 H 5.045 4.709 2.959 1.00 . A A . 3 PHE HE1 1 1
6 946 1 1 3 PHE HE2 H 5.106 0.719 4.597 1.00 . A A . 3 PHE HE2 1 1
6 947 1 1 3 PHE HZ H 4.738 3.167 4.898 1.00 . A A . 3 PHE HZ 1 1
6 948 1 1 3 PHE N N 5.392 -0.051 -1.939 1.00 . A A . 3 PHE N 1 1
6 949 1 1 3 PHE O O 4.225 2.739 -1.396 1.00 . A A . 3 PHE O 1 1
6 950 1 1 4 . C C 1.166 2.766 0.271 1.00 . A A . 4 DPN C 1 1
6 951 1 1 4 . CA C 1.423 1.932 -0.983 1.00 . A A . 4 DPN CA 1 1
6 952 1 1 4 . CB C 1.390 2.781 -2.276 1.00 . A A . 4 DPN CB 1 1
6 953 1 1 4 . CD1 C 0.516 1.296 -4.131 1.00 . A A . 4 DPN CD1 1 1
6 954 1 1 4 . CD2 C 2.861 1.900 -4.150 1.00 . A A . 4 DPN CD2 1 1
6 955 1 1 4 . CE1 C 0.699 0.539 -5.326 1.00 . A A . 4 DPN CE1 1 1
6 956 1 1 4 . CE2 C 3.056 1.137 -5.333 1.00 . A A . 4 DPN CE2 1 1
6 957 1 1 4 . CG C 1.597 1.976 -3.538 1.00 . A A . 4 DPN CG 1 1
6 958 1 1 4 . CZ C 1.972 0.458 -5.917 1.00 . A A . 4 DPN CZ 1 1
6 959 1 1 4 . HA H 0.615 1.204 -1.051 1.00 . A A . 4 DPN HA 1 1
6 960 1 1 4 . HB2 H 0.418 3.269 -2.342 1.00 . A A . 4 DPN HB2 1 1
6 961 1 1 4 . HB3 H 2.152 3.555 -2.225 1.00 . A A . 4 DPN HB3 1 1
6 962 1 1 4 . HD1 H -0.468 1.354 -3.680 1.00 . A A . 4 DPN HD1 1 1
6 963 1 1 4 . HD2 H 3.697 2.426 -3.722 1.00 . A A . 4 DPN HD2 1 1
6 964 1 1 4 . HE1 H -0.142 0.032 -5.774 1.00 . A A . 4 DPN HE1 1 1
6 965 1 1 4 . HE2 H 4.038 1.084 -5.781 1.00 . A A . 4 DPN HE2 1 1
6 966 1 1 4 . HZ H 2.115 -0.122 -6.816 1.00 . A A . 4 DPN HZ 1 1
6 967 1 1 4 . N N 2.678 1.181 -0.771 1.00 . A A . 4 DPN N 1 1
6 968 1 1 4 . O O 2.092 3.075 1.012 1.00 . A A . 4 DPN O 1 1
6 969 1 1 5 ASN C C -1.091 3.010 2.741 1.00 . A A . 5 ASN C 1 1
6 970 1 1 5 ASN CA C -0.418 3.912 1.701 1.00 . A A . 5 ASN CA 1 1
6 971 1 1 5 ASN CB C -1.282 5.130 1.330 1.00 . A A . 5 ASN CB 1 1
6 972 1 1 5 ASN CG C -2.627 4.749 0.776 1.00 . A A . 5 ASN CG 1 1
6 973 1 1 5 ASN H H -0.834 2.824 -0.098 1.00 . A A . 5 ASN H 1 1
6 974 1 1 5 ASN HA H 0.508 4.285 2.142 1.00 . A A . 5 ASN HA 1 1
6 975 1 1 5 ASN HB2 H -1.433 5.745 2.216 1.00 . A A . 5 ASN HB2 1 1
6 976 1 1 5 ASN HB3 H -0.746 5.724 0.589 1.00 . A A . 5 ASN HB3 1 1
6 977 1 1 5 ASN HD21 H -3.687 4.640 -0.920 1.00 . A A . 5 ASN HD21 1 1
6 978 1 1 5 ASN HD22 H -2.048 5.216 -1.094 1.00 . A A . 5 ASN HD22 1 1
6 979 1 1 5 ASN N N -0.082 3.120 0.520 1.00 . A A . 5 ASN N 1 1
6 980 1 1 5 ASN ND2 N -2.796 4.877 -0.513 1.00 . A A . 5 ASN ND2 1 1
6 981 1 1 5 ASN O O -1.181 1.804 2.556 1.00 . A A . 5 ASN O 1 1
6 982 1 1 5 ASN OD1 O -3.516 4.351 1.513 1.00 . A A . 5 ASN OD1 1 1
6 983 1 1 6 GLN C C -3.391 2.092 4.625 1.00 . A A . 6 GLN C 1 1
6 984 1 1 6 GLN CA C -2.109 2.845 4.953 1.00 . A A . 6 GLN CA 1 1
6 985 1 1 6 GLN CB C -2.386 3.819 6.099 1.00 . A A . 6 GLN CB 1 1
6 986 1 1 6 GLN CD C -1.392 5.405 7.790 1.00 . A A . 6 GLN CD 1 1
6 987 1 1 6 GLN CG C -1.112 4.369 6.754 1.00 . A A . 6 GLN CG 1 1
6 988 1 1 6 GLN H H -1.483 4.600 3.923 1.00 . A A . 6 GLN H 1 1
6 989 1 1 6 GLN HA H -1.381 2.116 5.279 1.00 . A A . 6 GLN HA 1 1
6 990 1 1 6 GLN HB2 H -2.965 4.658 5.702 1.00 . A A . 6 GLN HB2 1 1
6 991 1 1 6 GLN HB3 H -2.978 3.309 6.855 1.00 . A A . 6 GLN HB3 1 1
6 992 1 1 6 GLN HE21 H -0.542 6.392 9.278 1.00 . A A . 6 GLN HE21 1 1
6 993 1 1 6 GLN HE22 H 0.472 5.224 8.488 1.00 . A A . 6 GLN HE22 1 1
6 994 1 1 6 GLN HG2 H -0.566 3.553 7.217 1.00 . A A . 6 GLN HG2 1 1
6 995 1 1 6 GLN HG3 H -0.484 4.826 6.004 1.00 . A A . 6 GLN HG3 1 1
6 996 1 1 6 GLN N N -1.538 3.600 3.838 1.00 . A A . 6 GLN N 1 1
6 997 1 1 6 GLN NE2 N -0.410 5.693 8.581 1.00 . A A . 6 GLN NE2 1 1
6 998 1 1 6 GLN O O -3.625 1.009 5.159 1.00 . A A . 6 GLN O 1 1
6 999 1 1 6 GLN OE1 O -2.472 5.950 7.874 1.00 . A A . 6 GLN OE1 1 1
6 1000 1 1 7 TYR C C -5.477 1.289 2.148 1.00 . A A . 7 TYR C 1 1
6 1001 1 1 7 TYR CA C -5.521 2.093 3.440 1.00 . A A . 7 TYR CA 1 1
6 1002 1 1 7 TYR CB C -6.539 3.220 3.318 1.00 . A A . 7 TYR CB 1 1
6 1003 1 1 7 TYR CD1 C -7.240 3.819 5.698 1.00 . A A . 7 TYR CD1 1 1
6 1004 1 1 7 TYR CD2 C -5.785 5.353 4.504 1.00 . A A . 7 TYR CD2 1 1
6 1005 1 1 7 TYR CE1 C -7.216 4.677 6.828 1.00 . A A . 7 TYR CE1 1 1
6 1006 1 1 7 TYR CE2 C -5.766 6.211 5.639 1.00 . A A . 7 TYR CE2 1 1
6 1007 1 1 7 TYR CG C -6.527 4.145 4.524 1.00 . A A . 7 TYR CG 1 1
6 1008 1 1 7 TYR CZ C -6.480 5.863 6.782 1.00 . A A . 7 TYR CZ 1 1
6 1009 1 1 7 TYR H H -3.940 3.532 3.334 1.00 . A A . 7 TYR H 1 1
6 1010 1 1 7 TYR HA H -5.829 1.434 4.253 1.00 . A A . 7 TYR HA 1 1
6 1011 1 1 7 TYR HB2 H -6.309 3.804 2.428 1.00 . A A . 7 TYR HB2 1 1
6 1012 1 1 7 TYR HB3 H -7.533 2.790 3.198 1.00 . A A . 7 TYR HB3 1 1
6 1013 1 1 7 TYR HD1 H -7.807 2.901 5.742 1.00 . A A . 7 TYR HD1 1 1
6 1014 1 1 7 TYR HD2 H -5.222 5.624 3.624 1.00 . A A . 7 TYR HD2 1 1
6 1015 1 1 7 TYR HE1 H -7.762 4.415 7.721 1.00 . A A . 7 TYR HE1 1 1
6 1016 1 1 7 TYR HE2 H -5.194 7.127 5.619 1.00 . A A . 7 TYR HE2 1 1
6 1017 1 1 7 TYR HH H -6.971 6.364 8.604 1.00 . A A . 7 TYR HH 1 1
6 1018 1 1 7 TYR N N -4.212 2.666 3.766 1.00 . A A . 7 TYR N 1 1
6 1019 1 1 7 TYR O O -6.087 0.233 2.040 1.00 . A A . 7 TYR O 1 1
6 1020 1 1 7 TYR OH O -6.464 6.702 7.866 1.00 . A A . 7 TYR OH 1 1
6 1021 1 1 8 VAL C C -3.128 0.648 -0.193 1.00 . A A . 8 VAL C 1 1
6 1022 1 1 8 VAL CA C -4.569 1.108 -0.115 1.00 . A A . 8 VAL CA 1 1
6 1023 1 1 8 VAL CB C -4.960 2.010 -1.309 1.00 . A A . 8 VAL CB 1 1
6 1024 1 1 8 VAL CG1 C -4.766 1.263 -2.649 1.00 . A A . 8 VAL CG1 1 1
6 1025 1 1 8 VAL CG2 C -6.418 2.439 -1.161 1.00 . A A . 8 VAL CG2 1 1
6 1026 1 1 8 VAL H H -4.263 2.675 1.306 1.00 . A A . 8 VAL H 1 1
6 1027 1 1 8 VAL HA H -5.209 0.225 -0.129 1.00 . A A . 8 VAL HA 1 1
6 1028 1 1 8 VAL HB H -4.331 2.896 -1.306 1.00 . A A . 8 VAL HB 1 1
6 1029 1 1 8 VAL HG11 H -5.360 0.347 -2.655 1.00 . A A . 8 VAL HG11 1 1
6 1030 1 1 8 VAL HG12 H -3.713 1.019 -2.784 1.00 . A A . 8 VAL HG12 1 1
6 1031 1 1 8 VAL HG13 H -5.090 1.900 -3.472 1.00 . A A . 8 VAL HG13 1 1
6 1032 1 1 8 VAL HG21 H -6.735 2.995 -2.045 1.00 . A A . 8 VAL HG21 1 1
6 1033 1 1 8 VAL HG22 H -6.527 3.074 -0.285 1.00 . A A . 8 VAL HG22 1 1
6 1034 1 1 8 VAL HG23 H -7.047 1.550 -1.047 1.00 . A A . 8 VAL HG23 1 1
6 1035 1 1 8 VAL N N -4.739 1.790 1.169 1.00 . A A . 8 VAL N 1 1
6 1036 1 1 8 VAL O O -2.207 1.423 -0.505 1.00 . A A . 8 VAL O 1 1
6 1037 1 1 9 ORN C C -1.353 -2.445 -0.162 1.00 . A A . 9 ORN C 1 1
6 1038 1 1 9 ORN CA C -1.713 -1.181 0.633 1.00 . A A . 9 ORN CA 1 1
6 1039 1 1 9 ORN CB C -1.874 -1.474 2.145 1.00 . A A . 9 ORN CB 1 1
6 1040 1 1 9 ORN CD C -0.681 -1.984 4.335 1.00 . A A . 9 ORN CD 1 1
6 1041 1 1 9 ORN CG C -0.513 -1.771 2.814 1.00 . A A . 9 ORN CG 1 1
6 1042 1 1 9 ORN H H -3.802 -1.176 0.271 1.00 . A A . 9 ORN H 1 1
6 1043 1 1 9 ORN HA H -0.923 -0.439 0.502 1.00 . A A . 9 ORN HA 1 1
6 1044 1 1 9 ORN HB2 H -2.325 -0.605 2.630 1.00 . A A . 9 ORN HB2 1 1
6 1045 1 1 9 ORN HB3 H -2.539 -2.331 2.272 1.00 . A A . 9 ORN HB3 1 1
6 1046 1 1 9 ORN HD2 H 0.305 -1.990 4.798 1.00 . A A . 9 ORN HD2 1 1
6 1047 1 1 9 ORN HD3 H -1.265 -1.152 4.749 1.00 . A A . 9 ORN HD3 1 1
6 1048 1 1 9 ORN HE1 H -1.435 -3.379 5.644 1.00 . A A . 9 ORN HE1 1 1
6 1049 1 1 9 ORN HE2 H -2.293 -3.255 4.245 1.00 . A A . 9 ORN HE2 1 1
6 1050 1 1 9 ORN HE3 H -0.839 -4.035 4.250 1.00 . A A . 9 ORN HE3 1 1
6 1051 1 1 9 ORN HG2 H -0.067 -2.662 2.369 1.00 . A A . 9 ORN HG2 1 1
6 1052 1 1 9 ORN HG3 H 0.159 -0.925 2.651 1.00 . A A . 9 ORN HG3 1 1
6 1053 1 1 9 ORN N N -2.965 -0.629 0.123 1.00 . A A . 9 ORN N 1 1
6 1054 1 1 9 ORN NE N -1.368 -3.262 4.638 1.00 . A A . 9 ORN NE 1 1
6 1055 1 1 9 ORN O O -2.148 -3.387 -0.222 1.00 . A A . 9 ORN O 1 1
6 1056 1 1 10 LEU C C 1.534 -3.976 -1.343 1.00 . A A . 10 LEU C 1 1
6 1057 1 1 10 LEU CA C 0.210 -3.400 -1.812 1.00 . A A . 10 LEU CA 1 1
6 1058 1 1 10 LEU CB C 0.386 -2.757 -3.200 1.00 . A A . 10 LEU CB 1 1
6 1059 1 1 10 LEU CD1 C -1.440 -3.934 -4.495 1.00 . A A . 10 LEU CD1 1 1
6 1060 1 1 10 LEU CD2 C -1.920 -1.673 -3.526 1.00 . A A . 10 LEU CD2 1 1
6 1061 1 1 10 LEU CG C -0.838 -2.577 -4.128 1.00 . A A . 10 LEU CG 1 1
6 1062 1 1 10 LEU H H 0.444 -1.679 -0.648 1.00 . A A . 10 LEU H 1 1
6 1063 1 1 10 LEU HA H -0.518 -4.175 -1.858 1.00 . A A . 10 LEU HA 1 1
6 1064 1 1 10 LEU HB2 H 0.841 -1.776 -3.060 1.00 . A A . 10 LEU HB2 1 1
6 1065 1 1 10 LEU HB3 H 1.099 -3.367 -3.742 1.00 . A A . 10 LEU HB3 1 1
6 1066 1 1 10 LEU HD11 H -0.665 -4.581 -4.907 1.00 . A A . 10 LEU HD11 1 1
6 1067 1 1 10 LEU HD12 H -2.219 -3.791 -5.247 1.00 . A A . 10 LEU HD12 1 1
6 1068 1 1 10 LEU HD13 H -1.875 -4.404 -3.612 1.00 . A A . 10 LEU HD13 1 1
6 1069 1 1 10 LEU HD21 H -2.661 -1.431 -4.290 1.00 . A A . 10 LEU HD21 1 1
6 1070 1 1 10 LEU HD22 H -1.470 -0.748 -3.163 1.00 . A A . 10 LEU HD22 1 1
6 1071 1 1 10 LEU HD23 H -2.414 -2.185 -2.700 1.00 . A A . 10 LEU HD23 1 1
6 1072 1 1 10 LEU HG H -0.484 -2.111 -5.044 1.00 . A A . 10 LEU HG 1 1
6 1073 1 1 10 LEU N N -0.198 -2.408 -0.825 1.00 . A A . 10 LEU N 1 1
6 1074 1 1 10 LEU O O 2.137 -3.409 -0.452 1.00 . A A . 10 LEU O 1 1
7 1075 1 1 1 . C C 4.237 -5.079 -3.006 1.00 . A A . 1 DPN C 1 1
7 1076 1 1 1 . CA C 3.272 -5.630 -1.949 1.00 . A A . 1 DPN CA 1 1
7 1077 1 1 1 . CB C 3.761 -5.565 -0.468 1.00 . A A . 1 DPN CB 1 1
7 1078 1 1 1 . CD1 C 6.184 -4.808 -0.719 1.00 . A A . 1 DPN CD1 1 1
7 1079 1 1 1 . CD2 C 4.665 -3.448 0.601 1.00 . A A . 1 DPN CD2 1 1
7 1080 1 1 1 . CE1 C 7.238 -3.895 -0.454 1.00 . A A . 1 DPN CE1 1 1
7 1081 1 1 1 . CE2 C 5.716 -2.534 0.880 1.00 . A A . 1 DPN CE2 1 1
7 1082 1 1 1 . CG C 4.890 -4.586 -0.200 1.00 . A A . 1 DPN CG 1 1
7 1083 1 1 1 . CZ C 6.999 -2.756 0.345 1.00 . A A . 1 DPN CZ 1 1
7 1084 1 1 1 . H1 H 1.328 -5.655 -2.810 1.00 . A A . 1 DPN H1 1 1
7 1085 1 1 1 . HA H 3.212 -6.695 -2.168 1.00 . A A . 1 DPN HA 1 1
7 1086 1 1 1 . HB2 H 2.919 -5.321 0.176 1.00 . A A . 1 DPN HB2 1 1
7 1087 1 1 1 . HB3 H 4.111 -6.559 -0.189 1.00 . A A . 1 DPN HB3 1 1
7 1088 1 1 1 . HD1 H 6.377 -5.683 -1.325 1.00 . A A . 1 DPN HD1 1 1
7 1089 1 1 1 . HD2 H 3.683 -3.269 1.012 1.00 . A A . 1 DPN HD2 1 1
7 1090 1 1 1 . HE1 H 8.221 -4.073 -0.866 1.00 . A A . 1 DPN HE1 1 1
7 1091 1 1 1 . HE2 H 5.528 -1.665 1.495 1.00 . A A . 1 DPN HE2 1 1
7 1092 1 1 1 . HZ H 7.800 -2.059 0.547 1.00 . A A . 1 DPN HZ 1 1
7 1093 1 1 1 . N N 1.903 -5.114 -2.185 1.00 . A A . 1 DPN N 1 1
7 1094 1 1 1 . O O 4.868 -5.857 -3.712 1.00 . A A . 1 DPN O 1 1
7 1095 1 1 2 BE2 C C 5.068 -0.951 -2.411 1.00 . A A . 2 BE2 C 1 1
7 1096 1 1 2 BE2 C1 C 5.437 -1.566 -3.761 1.00 . A A . 2 BE2 C1 1 1
7 1097 1 1 2 BE2 C2 C 5.060 -2.911 -4.066 1.00 . A A . 2 BE2 C2 1 1
7 1098 1 1 2 BE2 C3 C 5.414 -3.457 -5.321 1.00 . A A . 2 BE2 C3 1 1
7 1099 1 1 2 BE2 C4 C 6.131 -2.704 -6.256 1.00 . A A . 2 BE2 C4 1 1
7 1100 1 1 2 BE2 C5 C 6.509 -1.396 -5.962 1.00 . A A . 2 BE2 C5 1 1
7 1101 1 1 2 BE2 C6 C 6.170 -0.823 -4.732 1.00 . A A . 2 BE2 C6 1 1
7 1102 1 1 2 BE2 H3 H 5.127 -4.467 -5.585 1.00 . A A . 2 BE2 H3 1 1
7 1103 1 1 2 BE2 H4 H 6.393 -3.142 -7.217 1.00 . A A . 2 BE2 H4 1 1
7 1104 1 1 2 BE2 H5 H 7.066 -0.817 -6.695 1.00 . A A . 2 BE2 H5 1 1
7 1105 1 1 2 BE2 H6 H 6.474 0.200 -4.553 1.00 . A A . 2 BE2 H6 1 1
7 1106 1 1 2 BE2 HN21 H 3.806 -3.160 -2.415 1.00 . A A . 2 BE2 HN21 1 1
7 1107 1 1 2 BE2 N2 N 4.317 -3.695 -3.114 1.00 . A A . 2 BE2 N2 1 1
7 1108 1 1 2 BE2 O1 O 4.313 -1.506 -1.639 1.00 . A A . 2 BE2 O1 1 1
7 1109 1 1 3 PHE C C 4.181 1.793 -0.910 1.00 . A A . 3 PHE C 1 1
7 1110 1 1 3 PHE CA C 5.421 0.924 -0.835 1.00 . A A . 3 PHE CA 1 1
7 1111 1 1 3 PHE CB C 6.650 1.751 -0.448 1.00 . A A . 3 PHE CB 1 1
7 1112 1 1 3 PHE CD1 C 6.138 3.751 1.021 1.00 . A A . 3 PHE CD1 1 1
7 1113 1 1 3 PHE CD2 C 6.828 1.679 2.079 1.00 . A A . 3 PHE CD2 1 1
7 1114 1 1 3 PHE CE1 C 6.024 4.371 2.289 1.00 . A A . 3 PHE CE1 1 1
7 1115 1 1 3 PHE CE2 C 6.715 2.287 3.356 1.00 . A A . 3 PHE CE2 1 1
7 1116 1 1 3 PHE CG C 6.537 2.404 0.908 1.00 . A A . 3 PHE CG 1 1
7 1117 1 1 3 PHE CZ C 6.314 3.638 3.459 1.00 . A A . 3 PHE CZ 1 1
7 1118 1 1 3 PHE H H 6.175 0.741 -2.763 1.00 . A A . 3 PHE H 1 1
7 1119 1 1 3 PHE HA H 5.284 0.161 -0.125 1.00 . A A . 3 PHE HA 1 1
7 1120 1 1 3 PHE HB2 H 7.521 1.097 -0.447 1.00 . A A . 3 PHE HB2 1 1
7 1121 1 1 3 PHE HB3 H 6.801 2.522 -1.195 1.00 . A A . 3 PHE HB3 1 1
7 1122 1 1 3 PHE HD1 H 5.906 4.319 0.130 1.00 . A A . 3 PHE HD1 1 1
7 1123 1 1 3 PHE HD2 H 7.145 0.648 2.006 1.00 . A A . 3 PHE HD2 1 1
7 1124 1 1 3 PHE HE1 H 5.710 5.401 2.362 1.00 . A A . 3 PHE HE1 1 1
7 1125 1 1 3 PHE HE2 H 6.943 1.722 4.247 1.00 . A A . 3 PHE HE2 1 1
7 1126 1 1 3 PHE HZ H 6.229 4.106 4.427 1.00 . A A . 3 PHE HZ 1 1
7 1127 1 1 3 PHE N N 5.614 0.285 -2.112 1.00 . A A . 3 PHE N 1 1
7 1128 1 1 3 PHE O O 4.233 2.937 -1.358 1.00 . A A . 3 PHE O 1 1
7 1129 1 1 4 . C C 1.512 2.565 0.804 1.00 . A A . 4 DPN C 1 1
7 1130 1 1 4 . CA C 1.717 1.722 -0.453 1.00 . A A . 4 DPN CA 1 1
7 1131 1 1 4 . CB C 1.321 2.482 -1.739 1.00 . A A . 4 DPN CB 1 1
7 1132 1 1 4 . CD1 C 0.223 0.907 -3.389 1.00 . A A . 4 DPN CD1 1 1
7 1133 1 1 4 . CD2 C 2.532 1.545 -3.771 1.00 . A A . 4 DPN CD2 1 1
7 1134 1 1 4 . CE1 C 0.246 0.111 -4.565 1.00 . A A . 4 DPN CE1 1 1
7 1135 1 1 4 . CE2 C 2.570 0.741 -4.937 1.00 . A A . 4 DPN CE2 1 1
7 1136 1 1 4 . CG C 1.363 1.628 -2.986 1.00 . A A . 4 DPN CG 1 1
7 1137 1 1 4 . CZ C 1.426 0.025 -5.332 1.00 . A A . 4 DPN CZ 1 1
7 1138 1 1 4 . HA H 1.043 0.872 -0.372 1.00 . A A . 4 DPN HA 1 1
7 1139 1 1 4 . HB2 H 0.305 2.853 -1.622 1.00 . A A . 4 DPN HB2 1 1
7 1140 1 1 4 . HB3 H 1.971 3.340 -1.873 1.00 . A A . 4 DPN HB3 1 1
7 1141 1 1 4 . HD1 H -0.680 0.962 -2.800 1.00 . A A . 4 DPN HD1 1 1
7 1142 1 1 4 . HD2 H 3.411 2.100 -3.484 1.00 . A A . 4 DPN HD2 1 1
7 1143 1 1 4 . HE1 H -0.635 -0.429 -4.869 1.00 . A A . 4 DPN HE1 1 1
7 1144 1 1 4 . HE2 H 3.475 0.681 -5.525 1.00 . A A . 4 DPN HE2 1 1
7 1145 1 1 4 . HZ H 1.450 -0.587 -6.223 1.00 . A A . 4 DPN HZ 1 1
7 1146 1 1 4 . N N 3.088 1.178 -0.463 1.00 . A A . 4 DPN N 1 1
7 1147 1 1 4 . O O 2.466 3.036 1.411 1.00 . A A . 4 DPN O 1 1
7 1148 1 1 5 ASN C C -1.039 2.732 3.250 1.00 . A A . 5 ASN C 1 1
7 1149 1 1 5 ASN CA C -0.079 3.534 2.369 1.00 . A A . 5 ASN CA 1 1
7 1150 1 1 5 ASN CB C -0.674 4.885 1.938 1.00 . A A . 5 ASN CB 1 1
7 1151 1 1 5 ASN CG C -1.951 4.735 1.143 1.00 . A A . 5 ASN CG 1 1
7 1152 1 1 5 ASN H H -0.496 2.301 0.677 1.00 . A A . 5 ASN H 1 1
7 1153 1 1 5 ASN HA H 0.827 3.727 2.944 1.00 . A A . 5 ASN HA 1 1
7 1154 1 1 5 ASN HB2 H -0.879 5.491 2.818 1.00 . A A . 5 ASN HB2 1 1
7 1155 1 1 5 ASN HB3 H 0.063 5.409 1.332 1.00 . A A . 5 ASN HB3 1 1
7 1156 1 1 5 ASN HD21 H -2.712 4.862 -0.702 1.00 . A A . 5 ASN HD21 1 1
7 1157 1 1 5 ASN HD22 H -1.003 5.187 -0.575 1.00 . A A . 5 ASN HD22 1 1
7 1158 1 1 5 ASN N N 0.263 2.740 1.195 1.00 . A A . 5 ASN N 1 1
7 1159 1 1 5 ASN ND2 N -1.880 4.947 -0.144 1.00 . A A . 5 ASN ND2 1 1
7 1160 1 1 5 ASN O O -1.262 1.551 3.010 1.00 . A A . 5 ASN O 1 1
7 1161 1 1 5 ASN OD1 O -2.995 4.434 1.698 1.00 . A A . 5 ASN OD1 1 1
7 1162 1 1 6 GLN C C -3.743 2.132 4.693 1.00 . A A . 6 GLN C 1 1
7 1163 1 1 6 GLN CA C -2.445 2.703 5.255 1.00 . A A . 6 GLN CA 1 1
7 1164 1 1 6 GLN CB C -2.803 3.701 6.360 1.00 . A A . 6 GLN CB 1 1
7 1165 1 1 6 GLN CD C -1.954 5.277 8.136 1.00 . A A . 6 GLN CD 1 1
7 1166 1 1 6 GLN CG C -1.600 4.190 7.174 1.00 . A A . 6 GLN CG 1 1
7 1167 1 1 6 GLN H H -1.408 4.356 4.396 1.00 . A A . 6 GLN H 1 1
7 1168 1 1 6 GLN HA H -1.892 1.880 5.688 1.00 . A A . 6 GLN HA 1 1
7 1169 1 1 6 GLN HB2 H -3.288 4.560 5.899 1.00 . A A . 6 GLN HB2 1 1
7 1170 1 1 6 GLN HB3 H -3.513 3.231 7.041 1.00 . A A . 6 GLN HB3 1 1
7 1171 1 1 6 GLN HE21 H -1.260 6.245 9.706 1.00 . A A . 6 GLN HE21 1 1
7 1172 1 1 6 GLN HE22 H -0.232 4.983 9.110 1.00 . A A . 6 GLN HE22 1 1
7 1173 1 1 6 GLN HG2 H -1.177 3.355 7.728 1.00 . A A . 6 GLN HG2 1 1
7 1174 1 1 6 GLN HG3 H -0.842 4.591 6.514 1.00 . A A . 6 GLN HG3 1 1
7 1175 1 1 6 GLN N N -1.588 3.372 4.272 1.00 . A A . 6 GLN N 1 1
7 1176 1 1 6 GLN NE2 N -1.079 5.518 9.059 1.00 . A A . 6 GLN NE2 1 1
7 1177 1 1 6 GLN O O -4.238 1.121 5.176 1.00 . A A . 6 GLN O 1 1
7 1178 1 1 6 GLN OE1 O -2.994 5.904 8.045 1.00 . A A . 6 GLN OE1 1 1
7 1179 1 1 7 TYR C C -5.424 1.622 1.818 1.00 . A A . 7 TYR C 1 1
7 1180 1 1 7 TYR CA C -5.582 2.396 3.119 1.00 . A A . 7 TYR CA 1 1
7 1181 1 1 7 TYR CB C -6.429 3.649 2.882 1.00 . A A . 7 TYR CB 1 1
7 1182 1 1 7 TYR CD1 C -5.771 5.529 4.472 1.00 . A A . 7 TYR CD1 1 1
7 1183 1 1 7 TYR CD2 C -7.681 4.147 5.039 1.00 . A A . 7 TYR CD2 1 1
7 1184 1 1 7 TYR CE1 C -5.947 6.269 5.673 1.00 . A A . 7 TYR CE1 1 1
7 1185 1 1 7 TYR CE2 C -7.861 4.890 6.238 1.00 . A A . 7 TYR CE2 1 1
7 1186 1 1 7 TYR CG C -6.633 4.458 4.148 1.00 . A A . 7 TYR CG 1 1
7 1187 1 1 7 TYR CZ C -6.990 5.936 6.544 1.00 . A A . 7 TYR CZ 1 1
7 1188 1 1 7 TYR H H -3.812 3.586 3.296 1.00 . A A . 7 TYR H 1 1
7 1189 1 1 7 TYR HA H -6.101 1.758 3.834 1.00 . A A . 7 TYR HA 1 1
7 1190 1 1 7 TYR HB2 H -5.935 4.277 2.140 1.00 . A A . 7 TYR HB2 1 1
7 1191 1 1 7 TYR HB3 H -7.401 3.349 2.492 1.00 . A A . 7 TYR HB3 1 1
7 1192 1 1 7 TYR HD1 H -4.962 5.787 3.804 1.00 . A A . 7 TYR HD1 1 1
7 1193 1 1 7 TYR HD2 H -8.353 3.332 4.813 1.00 . A A . 7 TYR HD2 1 1
7 1194 1 1 7 TYR HE1 H -5.278 7.079 5.917 1.00 . A A . 7 TYR HE1 1 1
7 1195 1 1 7 TYR HE2 H -8.667 4.644 6.914 1.00 . A A . 7 TYR HE2 1 1
7 1196 1 1 7 TYR HH H -6.468 7.289 7.854 1.00 . A A . 7 TYR HH 1 1
7 1197 1 1 7 TYR N N -4.290 2.786 3.684 1.00 . A A . 7 TYR N 1 1
7 1198 1 1 7 TYR O O -6.160 0.678 1.552 1.00 . A A . 7 TYR O 1 1
7 1199 1 1 7 TYR OH O -7.159 6.640 7.709 1.00 . A A . 7 TYR OH 1 1
7 1200 1 1 8 VAL C C -2.809 0.689 -0.146 1.00 . A A . 8 VAL C 1 1
7 1201 1 1 8 VAL CA C -4.171 1.329 -0.251 1.00 . A A . 8 VAL CA 1 1
7 1202 1 1 8 VAL CB C -4.253 2.283 -1.465 1.00 . A A . 8 VAL CB 1 1
7 1203 1 1 8 VAL CG1 C -3.960 1.525 -2.777 1.00 . A A . 8 VAL CG1 1 1
7 1204 1 1 8 VAL CG2 C -5.647 2.890 -1.532 1.00 . A A . 8 VAL CG2 1 1
7 1205 1 1 8 VAL H H -3.869 2.807 1.269 1.00 . A A . 8 VAL H 1 1
7 1206 1 1 8 VAL HA H -4.908 0.539 -0.392 1.00 . A A . 8 VAL HA 1 1
7 1207 1 1 8 VAL HB H -3.523 3.081 -1.348 1.00 . A A . 8 VAL HB 1 1
7 1208 1 1 8 VAL HG11 H -2.941 1.144 -2.766 1.00 . A A . 8 VAL HG11 1 1
7 1209 1 1 8 VAL HG12 H -4.070 2.205 -3.623 1.00 . A A . 8 VAL HG12 1 1
7 1210 1 1 8 VAL HG13 H -4.658 0.694 -2.891 1.00 . A A . 8 VAL HG13 1 1
7 1211 1 1 8 VAL HG21 H -6.389 2.087 -1.520 1.00 . A A . 8 VAL HG21 1 1
7 1212 1 1 8 VAL HG22 H -5.754 3.474 -2.445 1.00 . A A . 8 VAL HG22 1 1
7 1213 1 1 8 VAL HG23 H -5.806 3.537 -0.671 1.00 . A A . 8 VAL HG23 1 1
7 1214 1 1 8 VAL N N -4.450 2.015 1.009 1.00 . A A . 8 VAL N 1 1
7 1215 1 1 8 VAL O O -1.770 1.359 -0.229 1.00 . A A . 8 VAL O 1 1
7 1216 1 1 9 ORN C C -1.512 -2.665 -0.275 1.00 . A A . 9 ORN C 1 1
7 1217 1 1 9 ORN CA C -1.710 -1.390 0.570 1.00 . A A . 9 ORN CA 1 1
7 1218 1 1 9 ORN CB C -1.960 -1.715 2.064 1.00 . A A . 9 ORN CB 1 1
7 1219 1 1 9 ORN CD C -1.024 -3.020 4.043 1.00 . A A . 9 ORN CD 1 1
7 1220 1 1 9 ORN CG C -0.684 -2.298 2.726 1.00 . A A . 9 ORN CG 1 1
7 1221 1 1 9 ORN H H -3.751 -1.070 0.058 1.00 . A A . 9 ORN H 1 1
7 1222 1 1 9 ORN HA H -0.809 -0.777 0.496 1.00 . A A . 9 ORN HA 1 1
7 1223 1 1 9 ORN HB2 H -2.248 -0.801 2.589 1.00 . A A . 9 ORN HB2 1 1
7 1224 1 1 9 ORN HB3 H -2.780 -2.432 2.136 1.00 . A A . 9 ORN HB3 1 1
7 1225 1 1 9 ORN HD2 H -0.099 -3.195 4.598 1.00 . A A . 9 ORN HD2 1 1
7 1226 1 1 9 ORN HD3 H -1.677 -2.383 4.644 1.00 . A A . 9 ORN HD3 1 1
7 1227 1 1 9 ORN HE1 H -1.080 -4.920 3.252 1.00 . A A . 9 ORN HE1 1 1
7 1228 1 1 9 ORN HE2 H -1.914 -4.769 4.667 1.00 . A A . 9 ORN HE2 1 1
7 1229 1 1 9 ORN HE3 H -2.546 -4.167 3.268 1.00 . A A . 9 ORN HE3 1 1
7 1230 1 1 9 ORN HG2 H -0.200 -3.006 2.048 1.00 . A A . 9 ORN HG2 1 1
7 1231 1 1 9 ORN HG3 H 0.012 -1.483 2.936 1.00 . A A . 9 ORN HG3 1 1
7 1232 1 1 9 ORN N N -2.843 -0.624 0.049 1.00 . A A . 9 ORN N 1 1
7 1233 1 1 9 ORN NE N -1.692 -4.321 3.789 1.00 . A A . 9 ORN NE 1 1
7 1234 1 1 9 ORN O O -2.245 -3.654 -0.112 1.00 . A A . 9 ORN O 1 1
7 1235 1 1 10 LEU C C 1.369 -4.026 -1.635 1.00 . A A . 10 LEU C 1 1
7 1236 1 1 10 LEU CA C -0.089 -3.750 -1.971 1.00 . A A . 10 LEU CA 1 1
7 1237 1 1 10 LEU CB C -0.250 -3.374 -3.458 1.00 . A A . 10 LEU CB 1 1
7 1238 1 1 10 LEU CD1 C -2.271 -4.799 -4.018 1.00 . A A . 10 LEU CD1 1 1
7 1239 1 1 10 LEU CD2 C -2.626 -2.367 -3.548 1.00 . A A . 10 LEU CD2 1 1
7 1240 1 1 10 LEU CG C -1.648 -3.403 -4.119 1.00 . A A . 10 LEU CG 1 1
7 1241 1 1 10 LEU H H 0.121 -1.854 -1.134 1.00 . A A . 10 LEU H 1 1
7 1242 1 1 10 LEU HA H -0.680 -4.606 -1.734 1.00 . A A . 10 LEU HA 1 1
7 1243 1 1 10 LEU HB2 H 0.158 -2.377 -3.588 1.00 . A A . 10 LEU HB2 1 1
7 1244 1 1 10 LEU HB3 H 0.381 -4.048 -4.034 1.00 . A A . 10 LEU HB3 1 1
7 1245 1 1 10 LEU HD11 H -2.497 -5.037 -2.978 1.00 . A A . 10 LEU HD11 1 1
7 1246 1 1 10 LEU HD12 H -1.582 -5.540 -4.421 1.00 . A A . 10 LEU HD12 1 1
7 1247 1 1 10 LEU HD13 H -3.196 -4.827 -4.598 1.00 . A A . 10 LEU HD13 1 1
7 1248 1 1 10 LEU HD21 H -3.498 -2.299 -4.200 1.00 . A A . 10 LEU HD21 1 1
7 1249 1 1 10 LEU HD22 H -2.143 -1.395 -3.497 1.00 . A A . 10 LEU HD22 1 1
7 1250 1 1 10 LEU HD23 H -2.950 -2.669 -2.553 1.00 . A A . 10 LEU HD23 1 1
7 1251 1 1 10 LEU HG H -1.511 -3.177 -5.175 1.00 . A A . 10 LEU HG 1 1
7 1252 1 1 10 LEU N N -0.468 -2.652 -1.101 1.00 . A A . 10 LEU N 1 1
7 1253 1 1 10 LEU O O 1.965 -3.246 -0.907 1.00 . A A . 10 LEU O 1 1
8 1254 1 1 1 . C C 4.461 -5.221 -3.449 1.00 . A A . 1 DPN C 1 1
8 1255 1 1 1 . CA C 3.451 -5.843 -2.473 1.00 . A A . 1 DPN CA 1 1
8 1256 1 1 1 . CB C 4.042 -6.016 -1.050 1.00 . A A . 1 DPN CB 1 1
8 1257 1 1 1 . CD1 C 5.489 -4.042 -0.364 1.00 . A A . 1 DPN CD1 1 1
8 1258 1 1 1 . CD2 C 6.574 -6.061 -1.163 1.00 . A A . 1 DPN CD2 1 1
8 1259 1 1 1 . CE1 C 6.748 -3.432 -0.178 1.00 . A A . 1 DPN CE1 1 1
8 1260 1 1 1 . CE2 C 7.840 -5.455 -0.986 1.00 . A A . 1 DPN CE2 1 1
8 1261 1 1 1 . CG C 5.387 -5.358 -0.857 1.00 . A A . 1 DPN CG 1 1
8 1262 1 1 1 . CZ C 7.924 -4.140 -0.488 1.00 . A A . 1 DPN CZ 1 1
8 1263 1 1 1 . H1 H 1.528 -5.434 -3.284 1.00 . A A . 1 DPN H1 1 1
8 1264 1 1 1 . HA H 3.263 -6.853 -2.845 1.00 . A A . 1 DPN HA 1 1
8 1265 1 1 1 . HB2 H 3.357 -5.640 -0.308 1.00 . A A . 1 DPN HB2 1 1
8 1266 1 1 1 . HB3 H 4.164 -7.088 -0.858 1.00 . A A . 1 DPN HB3 1 1
8 1267 1 1 1 . HD1 H 4.595 -3.495 -0.116 1.00 . A A . 1 DPN HD1 1 1
8 1268 1 1 1 . HD2 H 6.519 -7.074 -1.541 1.00 . A A . 1 DPN HD2 1 1
8 1269 1 1 1 . HE1 H 6.808 -2.425 0.212 1.00 . A A . 1 DPN HE1 1 1
8 1270 1 1 1 . HE2 H 8.738 -6.003 -1.228 1.00 . A A . 1 DPN HE2 1 1
8 1271 1 1 1 . HZ H 8.889 -3.682 -0.340 1.00 . A A . 1 DPN HZ 1 1
8 1272 1 1 1 . N N 2.148 -5.123 -2.547 1.00 . A A . 1 DPN N 1 1
8 1273 1 1 1 . O O 5.123 -5.939 -4.178 1.00 . A A . 1 DPN O 1 1
8 1274 1 1 2 BE2 C C 4.709 -1.133 -2.530 1.00 . A A . 2 BE2 C 1 1
8 1275 1 1 2 BE2 C1 C 5.508 -1.606 -3.728 1.00 . A A . 2 BE2 C1 1 1
8 1276 1 1 2 BE2 C2 C 5.386 -2.958 -4.167 1.00 . A A . 2 BE2 C2 1 1
8 1277 1 1 2 BE2 C3 C 6.128 -3.388 -5.289 1.00 . A A . 2 BE2 C3 1 1
8 1278 1 1 2 BE2 C4 C 6.971 -2.502 -5.959 1.00 . A A . 2 BE2 C4 1 1
8 1279 1 1 2 BE2 C5 C 7.101 -1.177 -5.528 1.00 . A A . 2 BE2 C5 1 1
8 1280 1 1 2 BE2 C6 C 6.383 -0.725 -4.411 1.00 . A A . 2 BE2 C6 1 1
8 1281 1 1 2 BE2 H3 H 6.055 -4.404 -5.653 1.00 . A A . 2 BE2 H3 1 1
8 1282 1 1 2 BE2 H4 H 7.540 -2.842 -6.823 1.00 . A A . 2 BE2 H4 1 1
8 1283 1 1 2 BE2 H5 H 7.763 -0.503 -6.061 1.00 . A A . 2 BE2 H5 1 1
8 1284 1 1 2 BE2 H6 H 6.499 0.310 -4.099 1.00 . A A . 2 BE2 H6 1 1
8 1285 1 1 2 BE2 HN21 H 3.933 -3.380 -2.749 1.00 . A A . 2 BE2 HN21 1 1
8 1286 1 1 2 BE2 N2 N 4.533 -3.846 -3.429 1.00 . A A . 2 BE2 N2 1 1
8 1287 1 1 2 BE2 O1 O 3.660 -1.654 -2.222 1.00 . A A . 2 BE2 O1 1 1
8 1288 1 1 3 PHE C C 3.689 1.616 -1.010 1.00 . A A . 3 PHE C 1 1
8 1289 1 1 3 PHE CA C 4.586 0.447 -0.637 1.00 . A A . 3 PHE CA 1 1
8 1290 1 1 3 PHE CB C 5.617 0.874 0.394 1.00 . A A . 3 PHE CB 1 1
8 1291 1 1 3 PHE CD1 C 4.807 0.223 2.689 1.00 . A A . 3 PHE CD1 1 1
8 1292 1 1 3 PHE CD2 C 4.628 2.545 2.017 1.00 . A A . 3 PHE CD2 1 1
8 1293 1 1 3 PHE CE1 C 4.229 0.528 3.948 1.00 . A A . 3 PHE CE1 1 1
8 1294 1 1 3 PHE CE2 C 4.043 2.869 3.272 1.00 . A A . 3 PHE CE2 1 1
8 1295 1 1 3 PHE CG C 5.010 1.222 1.726 1.00 . A A . 3 PHE CG 1 1
8 1296 1 1 3 PHE CZ C 3.850 1.855 4.239 1.00 . A A . 3 PHE CZ 1 1
8 1297 1 1 3 PHE H H 6.052 0.355 -2.113 1.00 . A A . 3 PHE H 1 1
8 1298 1 1 3 PHE HA H 4.010 -0.354 -0.238 1.00 . A A . 3 PHE HA 1 1
8 1299 1 1 3 PHE HB2 H 6.324 0.055 0.535 1.00 . A A . 3 PHE HB2 1 1
8 1300 1 1 3 PHE HB3 H 6.168 1.744 0.017 1.00 . A A . 3 PHE HB3 1 1
8 1301 1 1 3 PHE HD1 H 5.092 -0.793 2.472 1.00 . A A . 3 PHE HD1 1 1
8 1302 1 1 3 PHE HD2 H 4.786 3.325 1.279 1.00 . A A . 3 PHE HD2 1 1
8 1303 1 1 3 PHE HE1 H 4.089 -0.257 4.684 1.00 . A A . 3 PHE HE1 1 1
8 1304 1 1 3 PHE HE2 H 3.752 3.888 3.482 1.00 . A A . 3 PHE HE2 1 1
8 1305 1 1 3 PHE HZ H 3.416 2.093 5.201 1.00 . A A . 3 PHE HZ 1 1
8 1306 1 1 3 PHE N N 5.222 -0.069 -1.823 1.00 . A A . 3 PHE N 1 1
8 1307 1 1 3 PHE O O 4.181 2.664 -1.418 1.00 . A A . 3 PHE O 1 1
8 1308 1 1 4 . C C 1.105 3.350 -0.104 1.00 . A A . 4 DPN C 1 1
8 1309 1 1 4 . CA C 1.290 2.316 -1.205 1.00 . A A . 4 DPN CA 1 1
8 1310 1 1 4 . CB C 1.448 2.979 -2.588 1.00 . A A . 4 DPN CB 1 1
8 1311 1 1 4 . CD1 C 0.380 1.491 -4.334 1.00 . A A . 4 DPN CD1 1 1
8 1312 1 1 4 . CD2 C 2.802 1.576 -4.207 1.00 . A A . 4 DPN CD2 1 1
8 1313 1 1 4 . CE1 C 0.456 0.573 -5.401 1.00 . A A . 4 DPN CE1 1 1
8 1314 1 1 4 . CE2 C 2.888 0.646 -5.281 1.00 . A A . 4 DPN CE2 1 1
8 1315 1 1 4 . CG C 1.545 2.003 -3.723 1.00 . A A . 4 DPN CG 1 1
8 1316 1 1 4 . CZ C 1.719 0.147 -5.869 1.00 . A A . 4 DPN CZ 1 1
8 1317 1 1 4 . HA H 0.374 1.727 -1.247 1.00 . A A . 4 DPN HA 1 1
8 1318 1 1 4 . HB2 H 0.569 3.605 -2.758 1.00 . A A . 4 DPN HB2 1 1
8 1319 1 1 4 . HB3 H 2.316 3.633 -2.583 1.00 . A A . 4 DPN HB3 1 1
8 1320 1 1 4 . HD1 H -0.594 1.814 -3.983 1.00 . A A . 4 DPN HD1 1 1
8 1321 1 1 4 . HD2 H 3.713 1.962 -3.756 1.00 . A A . 4 DPN HD2 1 1
8 1322 1 1 4 . HE1 H -0.449 0.197 -5.861 1.00 . A A . 4 DPN HE1 1 1
8 1323 1 1 4 . HE2 H 3.856 0.313 -5.641 1.00 . A A . 4 DPN HE2 1 1
8 1324 1 1 4 . HZ H 1.783 -0.559 -6.686 1.00 . A A . 4 DPN HZ 1 1
8 1325 1 1 4 . N N 2.387 1.386 -0.855 1.00 . A A . 4 DPN N 1 1
8 1326 1 1 4 . O O 1.881 4.288 0.037 1.00 . A A . 4 DPN O 1 1
8 1327 1 1 5 ASN C C -0.853 3.272 2.938 1.00 . A A . 5 ASN C 1 1
8 1328 1 1 5 ASN CA C -0.222 4.071 1.802 1.00 . A A . 5 ASN CA 1 1
8 1329 1 1 5 ASN CB C -1.121 5.231 1.337 1.00 . A A . 5 ASN CB 1 1
8 1330 1 1 5 ASN CG C -2.454 4.759 0.788 1.00 . A A . 5 ASN CG 1 1
8 1331 1 1 5 ASN H H -0.558 2.372 0.552 1.00 . A A . 5 ASN H 1 1
8 1332 1 1 5 ASN HA H 0.716 4.490 2.164 1.00 . A A . 5 ASN HA 1 1
8 1333 1 1 5 ASN HB2 H -1.311 5.899 2.170 1.00 . A A . 5 ASN HB2 1 1
8 1334 1 1 5 ASN HB3 H -0.591 5.799 0.553 1.00 . A A . 5 ASN HB3 1 1
8 1335 1 1 5 ASN HD21 H -3.514 4.548 -0.891 1.00 . A A . 5 ASN HD21 1 1
8 1336 1 1 5 ASN HD22 H -1.914 5.220 -1.081 1.00 . A A . 5 ASN HD22 1 1
8 1337 1 1 5 ASN N N 0.065 3.169 0.697 1.00 . A A . 5 ASN N 1 1
8 1338 1 1 5 ASN ND2 N -2.640 4.851 -0.496 1.00 . A A . 5 ASN ND2 1 1
8 1339 1 1 5 ASN O O -0.862 2.052 2.898 1.00 . A A . 5 ASN O 1 1
8 1340 1 1 5 ASN OD1 O -3.319 4.313 1.539 1.00 . A A . 5 ASN OD1 1 1
8 1341 1 1 6 GLN C C -3.140 2.403 4.847 1.00 . A A . 6 GLN C 1 1
8 1342 1 1 6 GLN CA C -1.923 3.280 5.125 1.00 . A A . 6 GLN CA 1 1
8 1343 1 1 6 GLN CB C -2.309 4.326 6.178 1.00 . A A . 6 GLN CB 1 1
8 1344 1 1 6 GLN CD C -1.495 6.047 7.841 1.00 . A A . 6 GLN CD 1 1
8 1345 1 1 6 GLN CG C -1.099 4.999 6.850 1.00 . A A . 6 GLN CG 1 1
8 1346 1 1 6 GLN H H -1.349 4.966 3.935 1.00 . A A . 6 GLN H 1 1
8 1347 1 1 6 GLN HA H -1.160 2.639 5.533 1.00 . A A . 6 GLN HA 1 1
8 1348 1 1 6 GLN HB2 H -2.920 5.091 5.696 1.00 . A A . 6 GLN HB2 1 1
8 1349 1 1 6 GLN HB3 H -2.891 3.840 6.943 1.00 . A A . 6 GLN HB3 1 1
8 1350 1 1 6 GLN HE21 H -0.790 7.129 9.328 1.00 . A A . 6 GLN HE21 1 1
8 1351 1 1 6 GLN HE22 H 0.355 6.033 8.631 1.00 . A A . 6 GLN HE22 1 1
8 1352 1 1 6 GLN HG2 H -0.507 4.242 7.358 1.00 . A A . 6 GLN HG2 1 1
8 1353 1 1 6 GLN HG3 H -0.478 5.486 6.105 1.00 . A A . 6 GLN HG3 1 1
8 1354 1 1 6 GLN N N -1.361 3.952 3.952 1.00 . A A . 6 GLN N 1 1
8 1355 1 1 6 GLN NE2 N -0.567 6.429 8.667 1.00 . A A . 6 GLN NE2 1 1
8 1356 1 1 6 GLN O O -3.287 1.339 5.460 1.00 . A A . 6 GLN O 1 1
8 1357 1 1 6 GLN OE1 O -2.617 6.513 7.861 1.00 . A A . 6 GLN OE1 1 1
8 1358 1 1 7 TYR C C -5.136 1.207 2.463 1.00 . A A . 7 TYR C 1 1
8 1359 1 1 7 TYR CA C -5.240 2.130 3.668 1.00 . A A . 7 TYR CA 1 1
8 1360 1 1 7 TYR CB C -6.352 3.149 3.423 1.00 . A A . 7 TYR CB 1 1
8 1361 1 1 7 TYR CD1 C -7.284 3.684 5.722 1.00 . A A . 7 TYR CD1 1 1
8 1362 1 1 7 TYR CD2 C -5.974 5.379 4.591 1.00 . A A . 7 TYR CD2 1 1
8 1363 1 1 7 TYR CE1 C -7.464 4.562 6.837 1.00 . A A . 7 TYR CE1 1 1
8 1364 1 1 7 TYR CE2 C -6.147 6.261 5.703 1.00 . A A . 7 TYR CE2 1 1
8 1365 1 1 7 TYR CG C -6.545 4.089 4.595 1.00 . A A . 7 TYR CG 1 1
8 1366 1 1 7 TYR CZ C -6.892 5.836 6.816 1.00 . A A . 7 TYR CZ 1 1
8 1367 1 1 7 TYR H H -3.795 3.694 3.443 1.00 . A A . 7 TYR H 1 1
8 1368 1 1 7 TYR HA H -5.511 1.531 4.535 1.00 . A A . 7 TYR HA 1 1
8 1369 1 1 7 TYR HB2 H -6.099 3.734 2.551 1.00 . A A . 7 TYR HB2 1 1
8 1370 1 1 7 TYR HB3 H -7.291 2.619 3.243 1.00 . A A . 7 TYR HB3 1 1
8 1371 1 1 7 TYR HD1 H -7.723 2.701 5.743 1.00 . A A . 7 TYR HD1 1 1
8 1372 1 1 7 TYR HD2 H -5.398 5.706 3.738 1.00 . A A . 7 TYR HD2 1 1
8 1373 1 1 7 TYR HE1 H -8.037 4.242 7.687 1.00 . A A . 7 TYR HE1 1 1
8 1374 1 1 7 TYR HE2 H -5.708 7.250 5.690 1.00 . A A . 7 TYR HE2 1 1
8 1375 1 1 7 TYR HH H -7.563 6.287 8.593 1.00 . A A . 7 TYR HH 1 1
8 1376 1 1 7 TYR N N -3.994 2.839 3.947 1.00 . A A . 7 TYR N 1 1
8 1377 1 1 7 TYR O O -5.701 0.118 2.441 1.00 . A A . 7 TYR O 1 1
8 1378 1 1 7 TYR OH O -7.053 6.679 7.883 1.00 . A A . 7 TYR OH 1 1
8 1379 1 1 8 VAL C C -2.782 0.394 0.180 1.00 . A A . 8 VAL C 1 1
8 1380 1 1 8 VAL CA C -4.214 0.892 0.227 1.00 . A A . 8 VAL CA 1 1
8 1381 1 1 8 VAL CB C -4.556 1.726 -1.032 1.00 . A A . 8 VAL CB 1 1
8 1382 1 1 8 VAL CG1 C -4.393 0.873 -2.298 1.00 . A A . 8 VAL CG1 1 1
8 1383 1 1 8 VAL CG2 C -5.991 2.246 -0.929 1.00 . A A . 8 VAL CG2 1 1
8 1384 1 1 8 VAL H H -3.934 2.552 1.532 1.00 . A A . 8 VAL H 1 1
8 1385 1 1 8 VAL HA H -4.873 0.031 0.256 1.00 . A A . 8 VAL HA 1 1
8 1386 1 1 8 VAL HB H -3.876 2.571 -1.090 1.00 . A A . 8 VAL HB 1 1
8 1387 1 1 8 VAL HG11 H -4.694 1.445 -3.181 1.00 . A A . 8 VAL HG11 1 1
8 1388 1 1 8 VAL HG12 H -5.016 -0.023 -2.230 1.00 . A A . 8 VAL HG12 1 1
8 1389 1 1 8 VAL HG13 H -3.354 0.582 -2.406 1.00 . A A . 8 VAL HG13 1 1
8 1390 1 1 8 VAL HG21 H -6.667 1.408 -0.752 1.00 . A A . 8 VAL HG21 1 1
8 1391 1 1 8 VAL HG22 H -6.274 2.745 -1.854 1.00 . A A . 8 VAL HG22 1 1
8 1392 1 1 8 VAL HG23 H -6.067 2.957 -0.098 1.00 . A A . 8 VAL HG23 1 1
8 1393 1 1 8 VAL N N -4.396 1.651 1.456 1.00 . A A . 8 VAL N 1 1
8 1394 1 1 8 VAL O O -1.826 1.155 -0.021 1.00 . A A . 8 VAL O 1 1
8 1395 1 1 9 ORN C C -1.201 -2.696 -0.419 1.00 . A A . 9 ORN C 1 1
8 1396 1 1 9 ORN CA C -1.416 -1.614 0.656 1.00 . A A . 9 ORN CA 1 1
8 1397 1 1 9 ORN CB C -1.465 -2.251 2.065 1.00 . A A . 9 ORN CB 1 1
8 1398 1 1 9 ORN CD C -1.551 -1.847 4.558 1.00 . A A . 9 ORN CD 1 1
8 1399 1 1 9 ORN CG C -1.403 -1.186 3.185 1.00 . A A . 9 ORN CG 1 1
8 1400 1 1 9 ORN H H -3.534 -1.422 0.529 1.00 . A A . 9 ORN H 1 1
8 1401 1 1 9 ORN HA H -0.587 -0.909 0.608 1.00 . A A . 9 ORN HA 1 1
8 1402 1 1 9 ORN HB2 H -2.384 -2.826 2.154 1.00 . A A . 9 ORN HB2 1 1
8 1403 1 1 9 ORN HB3 H -0.611 -2.932 2.176 1.00 . A A . 9 ORN HB3 1 1
8 1404 1 1 9 ORN HD2 H -2.509 -2.367 4.602 1.00 . A A . 9 ORN HD2 1 1
8 1405 1 1 9 ORN HD3 H -0.745 -2.572 4.702 1.00 . A A . 9 ORN HD3 1 1
8 1406 1 1 9 ORN HE1 H -0.633 -0.357 5.623 1.00 . A A . 9 ORN HE1 1 1
8 1407 1 1 9 ORN HE2 H -2.273 -0.167 5.496 1.00 . A A . 9 ORN HE2 1 1
8 1408 1 1 9 ORN HE3 H -1.645 -1.295 6.529 1.00 . A A . 9 ORN HE3 1 1
8 1409 1 1 9 ORN HG2 H -0.449 -0.658 3.135 1.00 . A A . 9 ORN HG2 1 1
8 1410 1 1 9 ORN HG3 H -2.209 -0.461 3.046 1.00 . A A . 9 ORN HG3 1 1
8 1411 1 1 9 ORN N N -2.679 -0.912 0.384 1.00 . A A . 9 ORN N 1 1
8 1412 1 1 9 ORN NE N -1.515 -0.845 5.637 1.00 . A A . 9 ORN NE 1 1
8 1413 1 1 9 ORN O O -2.089 -3.522 -0.668 1.00 . A A . 9 ORN O 1 1
8 1414 1 1 10 LEU C C 1.715 -4.125 -1.772 1.00 . A A . 10 LEU C 1 1
8 1415 1 1 10 LEU CA C 0.348 -3.564 -2.130 1.00 . A A . 10 LEU CA 1 1
8 1416 1 1 10 LEU CB C 0.420 -2.786 -3.461 1.00 . A A . 10 LEU CB 1 1
8 1417 1 1 10 LEU CD1 C -1.440 -3.987 -4.697 1.00 . A A . 10 LEU CD1 1 1
8 1418 1 1 10 LEU CD2 C -1.903 -1.743 -3.691 1.00 . A A . 10 LEU CD2 1 1
8 1419 1 1 10 LEU CG C -0.837 -2.629 -4.333 1.00 . A A . 10 LEU CG 1 1
8 1420 1 1 10 LEU H H 0.682 -2.053 -0.740 1.00 . A A . 10 LEU H 1 1
8 1421 1 1 10 LEU HA H -0.357 -4.364 -2.213 1.00 . A A . 10 LEU HA 1 1
8 1422 1 1 10 LEU HB2 H 0.815 -1.788 -3.246 1.00 . A A . 10 LEU HB2 1 1
8 1423 1 1 10 LEU HB3 H 1.150 -3.298 -4.081 1.00 . A A . 10 LEU HB3 1 1
8 1424 1 1 10 LEU HD11 H -0.674 -4.618 -5.135 1.00 . A A . 10 LEU HD11 1 1
8 1425 1 1 10 LEU HD12 H -2.233 -3.844 -5.441 1.00 . A A . 10 LEU HD12 1 1
8 1426 1 1 10 LEU HD13 H -1.862 -4.466 -3.820 1.00 . A A . 10 LEU HD13 1 1
8 1427 1 1 10 LEU HD21 H -2.370 -2.261 -2.852 1.00 . A A . 10 LEU HD21 1 1
8 1428 1 1 10 LEU HD22 H -2.670 -1.508 -4.435 1.00 . A A . 10 LEU HD22 1 1
8 1429 1 1 10 LEU HD23 H -1.445 -0.820 -3.348 1.00 . A A . 10 LEU HD23 1 1
8 1430 1 1 10 LEU HG H -0.527 -2.156 -5.263 1.00 . A A . 10 LEU HG 1 1
8 1431 1 1 10 LEU N N -0.022 -2.685 -1.031 1.00 . A A . 10 LEU N 1 1
8 1432 1 1 10 LEU O O 2.325 -3.631 -0.832 1.00 . A A . 10 LEU O 1 1
9 1433 1 1 1 . C C 4.378 -5.145 -3.519 1.00 . A A . 1 DPN C 1 1
9 1434 1 1 1 . CA C 3.451 -5.743 -2.456 1.00 . A A . 1 DPN CA 1 1
9 1435 1 1 1 . CB C 4.179 -5.911 -1.091 1.00 . A A . 1 DPN CB 1 1
9 1436 1 1 1 . CD1 C 5.671 -3.950 -0.449 1.00 . A A . 1 DPN CD1 1 1
9 1437 1 1 1 . CD2 C 6.679 -5.873 -1.537 1.00 . A A . 1 DPN CD2 1 1
9 1438 1 1 1 . CE1 C 6.935 -3.314 -0.392 1.00 . A A . 1 DPN CE1 1 1
9 1439 1 1 1 . CE2 C 7.944 -5.243 -1.490 1.00 . A A . 1 DPN CE2 1 1
9 1440 1 1 1 . CG C 5.529 -5.228 -1.026 1.00 . A A . 1 DPN CG 1 1
9 1441 1 1 1 . CZ C 8.075 -3.963 -0.916 1.00 . A A . 1 DPN CZ 1 1
9 1442 1 1 1 . H1 H 1.471 -5.342 -3.096 1.00 . A A . 1 DPN H1 1 1
9 1443 1 1 1 . HA H 3.232 -6.757 -2.783 1.00 . A A . 1 DPN HA 1 1
9 1444 1 1 1 . HB2 H 3.556 -5.535 -0.295 1.00 . A A . 1 DPN HB2 1 1
9 1445 1 1 1 . HB3 H 4.334 -6.978 -0.918 1.00 . A A . 1 DPN HB3 1 1
9 1446 1 1 1 . HD1 H 4.809 -3.451 -0.044 1.00 . A A . 1 DPN HD1 1 1
9 1447 1 1 1 . HD2 H 6.588 -6.852 -1.970 1.00 . A A . 1 DPN HD2 1 1
9 1448 1 1 1 . HE1 H 7.028 -2.332 0.055 1.00 . A A . 1 DPN HE1 1 1
9 1449 1 1 1 . HE2 H 8.809 -5.755 -1.884 1.00 . A A . 1 DPN HE2 1 1
9 1450 1 1 1 . HZ H 9.049 -3.483 -0.877 1.00 . A A . 1 DPN HZ 1 1
9 1451 1 1 1 . N N 2.145 -5.029 -2.422 1.00 . A A . 1 DPN N 1 1
9 1452 1 1 1 . O O 4.914 -5.878 -4.338 1.00 . A A . 1 DPN O 1 1
9 1453 1 1 2 BE2 C C 4.984 -1.079 -2.566 1.00 . A A . 2 BE2 C 1 1
9 1454 1 1 2 BE2 C1 C 5.602 -1.574 -3.855 1.00 . A A . 2 BE2 C1 1 1
9 1455 1 1 2 BE2 C2 C 5.358 -2.911 -4.294 1.00 . A A . 2 BE2 C2 1 1
9 1456 1 1 2 BE2 C3 C 5.943 -3.352 -5.503 1.00 . A A . 2 BE2 C3 1 1
9 1457 1 1 2 BE2 C4 C 6.760 -2.487 -6.260 1.00 . A A . 2 BE2 C4 1 1
9 1458 1 1 2 BE2 C5 C 6.998 -1.177 -5.816 1.00 . A A . 2 BE2 C5 1 1
9 1459 1 1 2 BE2 C6 C 6.430 -0.728 -4.622 1.00 . A A . 2 BE2 C6 1 1
9 1460 1 1 2 BE2 H3 H 5.773 -4.353 -5.869 1.00 . A A . 2 BE2 H3 1 1
9 1461 1 1 2 BE2 H4 H 7.212 -2.842 -7.184 1.00 . A A . 2 BE2 H4 1 1
9 1462 1 1 2 BE2 H5 H 7.632 -0.511 -6.396 1.00 . A A . 2 BE2 H5 1 1
9 1463 1 1 2 BE2 H6 H 6.631 0.291 -4.309 1.00 . A A . 2 BE2 H6 1 1
9 1464 1 1 2 BE2 HN21 H 4.038 -3.299 -2.737 1.00 . A A . 2 BE2 HN21 1 1
9 1465 1 1 2 BE2 N2 N 4.536 -3.774 -3.485 1.00 . A A . 2 BE2 N2 1 1
9 1466 1 1 2 BE2 O1 O 4.019 -1.624 -2.062 1.00 . A A . 2 BE2 O1 1 1
9 1467 1 1 3 PHE C C 4.008 1.615 -0.967 1.00 . A A . 3 PHE C 1 1
9 1468 1 1 3 PHE CA C 5.086 0.568 -0.735 1.00 . A A . 3 PHE CA 1 1
9 1469 1 1 3 PHE CB C 6.235 1.155 0.088 1.00 . A A . 3 PHE CB 1 1
9 1470 1 1 3 PHE CD1 C 5.400 2.736 1.886 1.00 . A A . 3 PHE CD1 1 1
9 1471 1 1 3 PHE CD2 C 5.959 0.462 2.507 1.00 . A A . 3 PHE CD2 1 1
9 1472 1 1 3 PHE CE1 C 5.043 3.025 3.227 1.00 . A A . 3 PHE CE1 1 1
9 1473 1 1 3 PHE CE2 C 5.602 0.737 3.858 1.00 . A A . 3 PHE CE2 1 1
9 1474 1 1 3 PHE CG C 5.859 1.458 1.516 1.00 . A A . 3 PHE CG 1 1
9 1475 1 1 3 PHE CZ C 5.148 2.025 4.215 1.00 . A A . 3 PHE CZ 1 1
9 1476 1 1 3 PHE H H 6.309 0.485 -2.440 1.00 . A A . 3 PHE H 1 1
9 1477 1 1 3 PHE HA H 4.681 -0.245 -0.202 1.00 . A A . 3 PHE HA 1 1
9 1478 1 1 3 PHE HB2 H 7.056 0.429 0.105 1.00 . A A . 3 PHE HB2 1 1
9 1479 1 1 3 PHE HB3 H 6.578 2.075 -0.392 1.00 . A A . 3 PHE HB3 1 1
9 1480 1 1 3 PHE HD1 H 5.321 3.515 1.134 1.00 . A A . 3 PHE HD1 1 1
9 1481 1 1 3 PHE HD2 H 6.304 -0.522 2.231 1.00 . A A . 3 PHE HD2 1 1
9 1482 1 1 3 PHE HE1 H 4.688 4.012 3.495 1.00 . A A . 3 PHE HE1 1 1
9 1483 1 1 3 PHE HE2 H 5.684 -0.037 4.616 1.00 . A A . 3 PHE HE2 1 1
9 1484 1 1 3 PHE HZ H 4.884 2.247 5.238 1.00 . A A . 3 PHE HZ 1 1
9 1485 1 1 3 PHE N N 5.554 0.041 -1.993 1.00 . A A . 3 PHE N 1 1
9 1486 1 1 3 PHE O O 4.315 2.731 -1.369 1.00 . A A . 3 PHE O 1 1
9 1487 1 1 4 . C C 1.287 2.892 0.261 1.00 . A A . 4 DPN C 1 1
9 1488 1 1 4 . CA C 1.520 1.962 -0.924 1.00 . A A . 4 DPN CA 1 1
9 1489 1 1 4 . CB C 1.469 2.735 -2.268 1.00 . A A . 4 DPN CB 1 1
9 1490 1 1 4 . CD1 C 0.400 1.372 -4.115 1.00 . A A . 4 DPN CD1 1 1
9 1491 1 1 4 . CD2 C 2.820 1.495 -4.031 1.00 . A A . 4 DPN CD2 1 1
9 1492 1 1 4 . CE1 C 0.481 0.557 -5.275 1.00 . A A . 4 DPN CE1 1 1
9 1493 1 1 4 . CE2 C 2.911 0.661 -5.178 1.00 . A A . 4 DPN CE2 1 1
9 1494 1 1 4 . CG C 1.566 1.849 -3.491 1.00 . A A . 4 DPN CG 1 1
9 1495 1 1 4 . CZ C 1.739 0.193 -5.798 1.00 . A A . 4 DPN CZ 1 1
9 1496 1 1 4 . HA H 0.699 1.251 -0.933 1.00 . A A . 4 DPN HA 1 1
9 1497 1 1 4 . HB2 H 0.516 3.276 -2.317 1.00 . A A . 4 DPN HB2 1 1
9 1498 1 1 4 . HB3 H 2.267 3.470 -2.298 1.00 . A A . 4 DPN HB3 1 1
9 1499 1 1 4 . HD1 H -0.573 1.632 -3.716 1.00 . A A . 4 DPN HD1 1 1
9 1500 1 1 4 . HD2 H 3.729 1.862 -3.568 1.00 . A A . 4 DPN HD2 1 1
9 1501 1 1 4 . HE1 H -0.417 0.210 -5.747 1.00 . A A . 4 DPN HE1 1 1
9 1502 1 1 4 . HE2 H 3.876 0.395 -5.572 1.00 . A A . 4 DPN HE2 1 1
9 1503 1 1 4 . HZ H 1.801 -0.434 -6.674 1.00 . A A . 4 DPN HZ 1 1
9 1504 1 1 4 . N N 2.767 1.190 -0.717 1.00 . A A . 4 DPN N 1 1
9 1505 1 1 4 . O O 2.192 3.577 0.707 1.00 . A A . 4 DPN O 1 1
9 1506 1 1 5 ASN C C -1.016 3.072 2.993 1.00 . A A . 5 ASN C 1 1
9 1507 1 1 5 ASN CA C -0.274 3.819 1.883 1.00 . A A . 5 ASN CA 1 1
9 1508 1 1 5 ASN CB C -1.065 5.035 1.362 1.00 . A A . 5 ASN CB 1 1
9 1509 1 1 5 ASN CG C -2.415 4.662 0.793 1.00 . A A . 5 ASN CG 1 1
9 1510 1 1 5 ASN H H -0.665 2.322 0.399 1.00 . A A . 5 ASN H 1 1
9 1511 1 1 5 ASN HA H 0.662 4.192 2.317 1.00 . A A . 5 ASN HA 1 1
9 1512 1 1 5 ASN HB2 H -1.208 5.744 2.175 1.00 . A A . 5 ASN HB2 1 1
9 1513 1 1 5 ASN HB3 H -0.475 5.520 0.589 1.00 . A A . 5 ASN HB3 1 1
9 1514 1 1 5 ASN HD21 H -3.460 4.541 -0.909 1.00 . A A . 5 ASN HD21 1 1
9 1515 1 1 5 ASN HD22 H -1.816 5.116 -1.078 1.00 . A A . 5 ASN HD22 1 1
9 1516 1 1 5 ASN N N 0.064 2.923 0.775 1.00 . A A . 5 ASN N 1 1
9 1517 1 1 5 ASN ND2 N -2.573 4.782 -0.495 1.00 . A A . 5 ASN ND2 1 1
9 1518 1 1 5 ASN O O -1.158 1.855 2.952 1.00 . A A . 5 ASN O 1 1
9 1519 1 1 5 ASN OD1 O -3.304 4.275 1.526 1.00 . A A . 5 ASN OD1 1 1
9 1520 1 1 6 GLN C C -3.359 2.407 4.905 1.00 . A A . 6 GLN C 1 1
9 1521 1 1 6 GLN CA C -2.111 3.239 5.186 1.00 . A A . 6 GLN CA 1 1
9 1522 1 1 6 GLN CB C -2.497 4.353 6.157 1.00 . A A . 6 GLN CB 1 1
9 1523 1 1 6 GLN CD C -1.731 6.265 7.591 1.00 . A A . 6 GLN CD 1 1
9 1524 1 1 6 GLN CG C -1.313 5.128 6.719 1.00 . A A . 6 GLN CG 1 1
9 1525 1 1 6 GLN H H -1.373 4.820 3.951 1.00 . A A . 6 GLN H 1 1
9 1526 1 1 6 GLN HA H -1.403 2.587 5.675 1.00 . A A . 6 GLN HA 1 1
9 1527 1 1 6 GLN HB2 H -3.166 5.044 5.643 1.00 . A A . 6 GLN HB2 1 1
9 1528 1 1 6 GLN HB3 H -3.052 3.915 6.978 1.00 . A A . 6 GLN HB3 1 1
9 1529 1 1 6 GLN HE21 H -1.047 7.554 8.918 1.00 . A A . 6 GLN HE21 1 1
9 1530 1 1 6 GLN HE22 H 0.118 6.407 8.323 1.00 . A A . 6 GLN HE22 1 1
9 1531 1 1 6 GLN HG2 H -0.695 4.457 7.306 1.00 . A A . 6 GLN HG2 1 1
9 1532 1 1 6 GLN HG3 H -0.714 5.539 5.909 1.00 . A A . 6 GLN HG3 1 1
9 1533 1 1 6 GLN N N -1.479 3.815 3.993 1.00 . A A . 6 GLN N 1 1
9 1534 1 1 6 GLN NE2 N -0.813 6.776 8.339 1.00 . A A . 6 GLN NE2 1 1
9 1535 1 1 6 GLN O O -3.611 1.411 5.588 1.00 . A A . 6 GLN O 1 1
9 1536 1 1 6 GLN OE1 O -2.867 6.692 7.581 1.00 . A A . 6 GLN OE1 1 1
9 1537 1 1 7 TYR C C -5.259 1.218 2.378 1.00 . A A . 7 TYR C 1 1
9 1538 1 1 7 TYR CA C -5.380 2.126 3.595 1.00 . A A . 7 TYR CA 1 1
9 1539 1 1 7 TYR CB C -6.467 3.171 3.361 1.00 . A A . 7 TYR CB 1 1
9 1540 1 1 7 TYR CD1 C -6.126 5.342 4.649 1.00 . A A . 7 TYR CD1 1 1
9 1541 1 1 7 TYR CD2 C -7.486 3.610 5.653 1.00 . A A . 7 TYR CD2 1 1
9 1542 1 1 7 TYR CE1 C -6.342 6.167 5.778 1.00 . A A . 7 TYR CE1 1 1
9 1543 1 1 7 TYR CE2 C -7.711 4.437 6.780 1.00 . A A . 7 TYR CE2 1 1
9 1544 1 1 7 TYR CG C -6.697 4.055 4.571 1.00 . A A . 7 TYR CG 1 1
9 1545 1 1 7 TYR CZ C -7.133 5.708 6.830 1.00 . A A . 7 TYR CZ 1 1
9 1546 1 1 7 TYR H H -3.846 3.586 3.349 1.00 . A A . 7 TYR H 1 1
9 1547 1 1 7 TYR HA H -5.677 1.512 4.441 1.00 . A A . 7 TYR HA 1 1
9 1548 1 1 7 TYR HB2 H -6.180 3.799 2.511 1.00 . A A . 7 TYR HB2 1 1
9 1549 1 1 7 TYR HB3 H -7.393 2.659 3.114 1.00 . A A . 7 TYR HB3 1 1
9 1550 1 1 7 TYR HD1 H -5.508 5.705 3.842 1.00 . A A . 7 TYR HD1 1 1
9 1551 1 1 7 TYR HD2 H -7.934 2.621 5.618 1.00 . A A . 7 TYR HD2 1 1
9 1552 1 1 7 TYR HE1 H -5.893 7.146 5.830 1.00 . A A . 7 TYR HE1 1 1
9 1553 1 1 7 TYR HE2 H -8.316 4.087 7.598 1.00 . A A . 7 TYR HE2 1 1
9 1554 1 1 7 TYR HH H -7.895 6.087 8.580 1.00 . A A . 7 TYR HH 1 1
9 1555 1 1 7 TYR N N -4.126 2.799 3.907 1.00 . A A . 7 TYR N 1 1
9 1556 1 1 7 TYR O O -5.825 0.131 2.349 1.00 . A A . 7 TYR O 1 1
9 1557 1 1 7 TYR OH O -7.346 6.507 7.918 1.00 . A A . 7 TYR OH 1 1
9 1558 1 1 8 VAL C C -2.925 0.324 0.144 1.00 . A A . 8 VAL C 1 1
9 1559 1 1 8 VAL CA C -4.331 0.892 0.150 1.00 . A A . 8 VAL CA 1 1
9 1560 1 1 8 VAL CB C -4.612 1.748 -1.099 1.00 . A A . 8 VAL CB 1 1
9 1561 1 1 8 VAL CG1 C -4.428 0.931 -2.380 1.00 . A A . 8 VAL CG1 1 1
9 1562 1 1 8 VAL CG2 C -6.044 2.279 -1.025 1.00 . A A . 8 VAL CG2 1 1
9 1563 1 1 8 VAL H H -4.052 2.562 1.450 1.00 . A A . 8 VAL H 1 1
9 1564 1 1 8 VAL HA H -5.029 0.055 0.150 1.00 . A A . 8 VAL HA 1 1
9 1565 1 1 8 VAL HB H -3.920 2.591 -1.111 1.00 . A A . 8 VAL HB 1 1
9 1566 1 1 8 VAL HG11 H -4.674 1.555 -3.248 1.00 . A A . 8 VAL HG11 1 1
9 1567 1 1 8 VAL HG12 H -5.081 0.064 -2.361 1.00 . A A . 8 VAL HG12 1 1
9 1568 1 1 8 VAL HG13 H -3.391 0.607 -2.463 1.00 . A A . 8 VAL HG13 1 1
9 1569 1 1 8 VAL HG21 H -6.144 2.971 -0.192 1.00 . A A . 8 VAL HG21 1 1
9 1570 1 1 8 VAL HG22 H -6.735 1.436 -0.881 1.00 . A A . 8 VAL HG22 1 1
9 1571 1 1 8 VAL HG23 H -6.296 2.799 -1.947 1.00 . A A . 8 VAL HG23 1 1
9 1572 1 1 8 VAL N N -4.513 1.662 1.379 1.00 . A A . 8 VAL N 1 1
9 1573 1 1 8 VAL O O -1.929 1.032 -0.088 1.00 . A A . 8 VAL O 1 1
9 1574 1 1 9 ORN C C -1.293 -2.738 -0.247 1.00 . A A . 9 ORN C 1 1
9 1575 1 1 9 ORN CA C -1.652 -1.695 0.832 1.00 . A A . 9 ORN CA 1 1
9 1576 1 1 9 ORN CB C -1.902 -2.379 2.196 1.00 . A A . 9 ORN CB 1 1
9 1577 1 1 9 ORN CD C -2.537 -2.090 4.624 1.00 . A A . 9 ORN CD 1 1
9 1578 1 1 9 ORN CG C -2.073 -1.364 3.357 1.00 . A A . 9 ORN CG 1 1
9 1579 1 1 9 ORN H H -3.748 -1.455 0.549 1.00 . A A . 9 ORN H 1 1
9 1580 1 1 9 ORN HA H -0.826 -0.990 0.932 1.00 . A A . 9 ORN HA 1 1
9 1581 1 1 9 ORN HB2 H -2.809 -2.992 2.120 1.00 . A A . 9 ORN HB2 1 1
9 1582 1 1 9 ORN HB3 H -1.062 -3.044 2.419 1.00 . A A . 9 ORN HB3 1 1
9 1583 1 1 9 ORN HD2 H -3.555 -2.466 4.456 1.00 . A A . 9 ORN HD2 1 1
9 1584 1 1 9 ORN HD3 H -1.873 -2.927 4.819 1.00 . A A . 9 ORN HD3 1 1
9 1585 1 1 9 ORN HE1 H -1.609 -0.890 6.003 1.00 . A A . 9 ORN HE1 1 1
9 1586 1 1 9 ORN HE2 H -3.122 -0.370 5.599 1.00 . A A . 9 ORN HE2 1 1
9 1587 1 1 9 ORN HE3 H -2.929 -1.674 6.592 1.00 . A A . 9 ORN HE3 1 1
9 1588 1 1 9 ORN HG2 H -1.122 -0.869 3.551 1.00 . A A . 9 ORN HG2 1 1
9 1589 1 1 9 ORN HG3 H -2.826 -0.613 3.092 1.00 . A A . 9 ORN HG3 1 1
9 1590 1 1 9 ORN N N -2.870 -0.972 0.430 1.00 . A A . 9 ORN N 1 1
9 1591 1 1 9 ORN NE N -2.547 -1.192 5.796 1.00 . A A . 9 ORN NE 1 1
9 1592 1 1 9 ORN O O -2.128 -3.588 -0.583 1.00 . A A . 9 ORN O 1 1
9 1593 1 1 10 LEU C C 1.774 -4.021 -1.624 1.00 . A A . 10 LEU C 1 1
9 1594 1 1 10 LEU CA C 0.381 -3.475 -1.903 1.00 . A A . 10 LEU CA 1 1
9 1595 1 1 10 LEU CB C 0.424 -2.638 -3.189 1.00 . A A . 10 LEU CB 1 1
9 1596 1 1 10 LEU CD1 C -1.395 -3.897 -4.454 1.00 . A A . 10 LEU CD1 1 1
9 1597 1 1 10 LEU CD2 C -1.908 -1.662 -3.463 1.00 . A A . 10 LEU CD2 1 1
9 1598 1 1 10 LEU CG C -0.826 -2.527 -4.086 1.00 . A A . 10 LEU CG 1 1
9 1599 1 1 10 LEU H H 0.603 -2.049 -0.377 1.00 . A A . 10 LEU H 1 1
9 1600 1 1 10 LEU HA H -0.292 -4.297 -2.030 1.00 . A A . 10 LEU HA 1 1
9 1601 1 1 10 LEU HB2 H 0.755 -1.635 -2.932 1.00 . A A . 10 LEU HB2 1 1
9 1602 1 1 10 LEU HB3 H 1.199 -3.071 -3.813 1.00 . A A . 10 LEU HB3 1 1
9 1603 1 1 10 LEU HD11 H -1.812 -4.379 -3.567 1.00 . A A . 10 LEU HD11 1 1
9 1604 1 1 10 LEU HD12 H -0.603 -4.518 -4.871 1.00 . A A . 10 LEU HD12 1 1
9 1605 1 1 10 LEU HD13 H -2.183 -3.788 -5.198 1.00 . A A . 10 LEU HD13 1 1
9 1606 1 1 10 LEU HD21 H -1.473 -0.737 -3.088 1.00 . A A . 10 LEU HD21 1 1
9 1607 1 1 10 LEU HD22 H -2.397 -2.198 -2.660 1.00 . A A . 10 LEU HD22 1 1
9 1608 1 1 10 LEU HD23 H -2.651 -1.410 -4.225 1.00 . A A . 10 LEU HD23 1 1
9 1609 1 1 10 LEU HG H -0.518 -2.046 -5.009 1.00 . A A . 10 LEU HG 1 1
9 1610 1 1 10 LEU N N -0.067 -2.669 -0.768 1.00 . A A . 10 LEU N 1 1
9 1611 1 1 10 LEU O O 2.448 -3.519 -0.728 1.00 . A A . 10 LEU O 1 1
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