NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
647689 |
6u7x   |
30671 | cing | 4-filtered-FRED | STAR | entry | full | 99 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6u7x
# This FRED archive file contains, for PDB entry <6u7x>:
#
# - 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_6u7x
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6u7x
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1609.83
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 $GLY_ARG_ALA_TYR_LYS_SER_LYS_PRO_PRO_ILE_ALA_PHE_PRO_ASP A . 1 1
2 . 2 $1_methyl_1H_1_2_3_triazole B . 1 1
stop_
loop_
_PDBX_nonpoly_scheme.Entity_assembly_ID
_PDBX_nonpoly_scheme.Entity_ID
_PDBX_nonpoly_scheme.Mon_ID
_PDBX_nonpoly_scheme.Comp_index_ID
_PDBX_nonpoly_scheme.Comp_ID
_PDBX_nonpoly_scheme.Entry_ID
_PDBX_nonpoly_scheme.Assembly_ID
2 2 . 1 . 1 1
stop_
save_
save_GLY_ARG_ALA_TYR_LYS_SER_LYS_PRO_PRO_ILE_ALA_PHE_PRO_ASP
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "GLY ARG ALA TYR LYS SER LYS PRO PRO ILE ALA PHE PRO ASP"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GRAYKSKPPIAFPD
_Entity.Number_of_monomers 14
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 GLY . 1 1
2 ARG . 1 1
3 ALA . 1 1
4 TYR . 1 1
5 LYS . 1 1
6 SER . 1 1
7 LYS . 1 1
8 PRO . 1 1
9 PRO . 1 1
10 ILE . 1 1
11 ALA . 1 1
12 PHE . 1 1
13 PRO . 1 1
14 ASP . 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
GLY 1 1 1 1
ARG 2 2 1 1
ALA 3 3 1 1
TYR 4 4 1 1
LYS 5 5 1 1
SER 6 6 1 1
LYS 7 7 1 1
PRO 8 8 1 1
PRO 9 9 1 1
ILE 10 10 1 1
ALA 11 11 1 1
PHE 12 12 1 1
PRO 13 13 1 1
ASP 14 14 1 1
stop_
save_
save_1_methyl_1H_1_2_3_triazole
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "1 methyl 1H 1 2 3 triazole"
_Entity.Type non-polymer
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . $. 1 2
stop_
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 ARG H . 2 . HN 1 1
1 1 2 1 1 2 ARG HB2 . 2 . HB2 1 1
2 1 1 1 1 2 ARG H . 2 . HN 1 1
2 1 2 1 1 2 ARG HG2 . 2 . HG2 1 1
3 1 1 1 1 2 ARG H . 2 . HN 1 1
3 1 2 1 1 2 ARG HG3 . 2 . HG1 1 1
4 1 1 1 1 2 ARG H . 2 . HN 1 1
4 1 2 1 1 2 ARG HB3 . 2 . HB1 1 1
5 1 1 1 1 2 ARG HB3 . 2 . HB1 1 1
5 1 2 1 1 2 ARG HE . 2 . HE 1 1
6 1 1 1 1 2 ARG HB2 . 2 . HB2 1 1
6 1 2 1 1 2 ARG HE . 2 . HE 1 1
7 1 1 1 1 2 ARG HA . 2 . HA 1 1
7 1 2 1 1 3 ALA H . 3 . HN 1 1
8 1 1 1 1 4 TYR H . 4 . HN 1 1
8 1 2 1 1 4 TYR HB3 . 4 . HB1 1 1
9 1 1 1 1 3 ALA HA . 3 . HA 1 1
9 1 2 1 1 4 TYR H . 4 . HN 1 1
10 1 1 1 1 6 SER HA . 6 . HA 1 1
10 1 2 1 1 7 LYS H . 7 . HN 1 1
11 1 1 1 1 8 PRO HA . 8 . HA 1 1
11 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1
12 1 1 1 1 8 PRO HA . 8 . HA 1 1
12 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1
13 1 1 1 1 9 PRO HA . 9 . HA 1 1
13 1 2 1 1 10 ILE H . 10 . HN 1 1
14 1 1 1 1 10 ILE H . 10 . HN 1 1
14 1 2 1 1 10 ILE HB . 10 . HB 1 1
15 1 1 1 1 10 ILE HA . 10 . HA 1 1
15 1 2 1 1 11 ALA H . 11 . HN 1 1
16 1 1 1 1 12 PHE H . 12 . HN 1 1
16 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
17 1 1 1 1 11 ALA HA . 11 . HA 1 1
17 1 2 1 1 12 PHE H . 12 . HN 1 1
18 1 1 1 1 12 PHE HA . 12 . HA 1 1
18 1 2 1 1 13 PRO HD2 . 13 . HD2 1 1
19 1 1 1 1 12 PHE HA . 12 . HA 1 1
19 1 2 1 1 13 PRO HD3 . 13 . HD1 1 1
20 1 1 1 1 4 TYR H . 4 . HN 1 1
20 1 2 1 1 11 ALA HA . 11 . HA 1 1
21 1 1 1 1 3 ALA HA . 3 . HA 1 1
21 1 2 1 1 12 PHE H . 12 . HN 1 1
22 1 1 1 1 4 TYR HA . 4 . HA 1 1
22 1 2 1 1 5 LYS H . 5 . HN 1 1
23 1 1 1 1 4 TYR H . 4 . HN 1 1
23 1 2 1 1 4 TYR HB2 . 4 . HB2 1 1
24 1 1 1 1 12 PHE HA . 12 . HA 1 1
24 1 2 1 1 12 PHE QD . 12 . HD# 1 1
25 1 1 1 1 2 ARG HB2 . 2 . HB2 1 1
25 1 2 1 1 12 PHE QD . 12 . HD# 1 1
26 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
26 1 2 1 1 14 ASP H . 14 . HN 1 1
27 1 1 1 1 12 PHE HB2 . 12 . HB2 1 1
27 1 2 1 1 14 ASP H . 14 . HN 1 1
28 1 1 1 1 2 ARG H . 2 . HN 1 1
28 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
29 1 1 1 1 9 PRO HB3 . 9 . HB1 1 1
29 1 2 1 1 10 ILE H . 10 . HN 1 1
30 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1
30 1 2 1 1 10 ILE H . 10 . HN 1 1
31 1 1 1 1 2 ARG H . 2 . HN 1 1
31 1 2 1 1 12 PHE H . 12 . HN 1 1
32 1 1 1 1 4 TYR H . 4 . HN 1 1
32 1 2 1 1 10 ILE H . 10 . HN 1 1
33 1 1 1 1 5 LYS H . 5 . HN 1 1
33 1 2 1 1 6 SER H . 6 . HN 1 1
34 1 1 1 1 4 TYR H . 4 . HN 1 1
34 1 2 1 1 4 TYR QD . 4 . HD# 1 1
35 1 1 1 1 12 PHE H . 12 . HN 1 1
35 1 2 1 1 12 PHE QD . 12 . HD# 1 1
36 1 1 1 1 10 ILE HB . 10 . HB 1 1
36 1 2 1 1 11 ALA H . 11 . HN 1 1
37 1 1 1 1 10 ILE MG . 10 . HG2# 1 1
37 1 2 1 1 11 ALA H . 11 . HN 1 1
38 1 1 1 1 4 TYR QD . 4 . HD# 1 1
38 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
39 1 1 1 1 2 ARG HB3 . 2 . HB1 1 1
39 1 2 1 1 12 PHE QD . 12 . HD# 1 1
40 1 1 1 1 3 ALA HA . 3 . HA 1 1
40 1 2 1 1 11 ALA HA . 11 . HA 1 1
41 1 1 1 1 7 LYS H . 7 . HN 1 1
41 1 2 1 1 7 LYS HB2 . 7 . HB2 1 1
42 1 1 1 1 7 LYS H . 7 . HN 1 1
42 1 2 1 1 7 LYS HB3 . 7 . HB1 1 1
43 1 1 1 1 10 ILE H . 10 . HN 1 1
43 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
44 1 1 1 1 6 SER H . 6 . HN 1 1
44 1 2 1 1 7 LYS H . 7 . HN 1 1
45 1 1 1 1 10 ILE HA . 10 . HA 1 1
45 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
46 1 1 1 1 10 ILE HA . 10 . HA 1 1
46 1 2 1 1 10 ILE MD . 10 . HD1# 1 1
47 1 1 1 1 10 ILE HB . 10 . HB 1 1
47 1 2 1 1 10 ILE MD . 10 . HD1# 1 1
48 1 1 1 1 10 ILE MG . 10 . HG2# 1 1
48 1 2 1 1 12 PHE QE . 12 . HE# 1 1
49 1 1 1 1 7 LYS HA . 7 . HA 1 1
49 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1
50 1 1 1 1 7 LYS HA . 7 . HA 1 1
50 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1
51 1 1 1 1 2 ARG H . 2 . HN 1 1
51 1 2 1 1 2 ARG QB . 2 . HB# 1 1
52 1 1 1 1 2 ARG H . 2 . HN 1 1
52 1 2 1 1 2 ARG QG . 2 . HG# 1 1
53 1 1 1 1 2 ARG HA . 2 . HA 1 1
53 1 2 1 1 2 ARG QG . 2 . HG# 1 1
54 1 1 1 1 2 ARG QB . 2 . HB# 1 1
54 1 2 1 1 2 ARG HE . 2 . HE 1 1
55 1 1 1 1 2 ARG QB . 2 . HB# 1 1
55 1 2 1 1 3 ALA H . 3 . HN 1 1
56 1 1 1 1 2 ARG QB . 2 . HB# 1 1
56 1 2 1 1 12 PHE QD . 12 . HD# 1 1
57 1 1 1 1 4 TYR H . 4 . HN 1 1
57 1 2 1 1 4 TYR QB . 4 . HB# 1 1
58 1 1 1 1 4 TYR QB . 4 . HB# 1 1
58 1 2 1 1 6 SER H . 6 . HN 1 1
59 1 1 1 1 4 TYR QB . 4 . HB# 1 1
59 1 2 1 1 10 ILE H . 10 . HN 1 1
60 1 1 1 1 4 TYR QB . 4 . HB# 1 1
60 1 2 1 1 10 ILE HB . 10 . HB 1 1
61 1 1 1 1 4 TYR QB . 4 . HB# 1 1
61 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
62 1 1 1 1 5 LYS H . 5 . HN 1 1
62 1 2 1 1 5 LYS QB . 5 . HB# 1 1
63 1 1 1 1 5 LYS H . 5 . HN 1 1
63 1 2 1 1 5 LYS QD . 5 . HD# 1 1
64 1 1 1 1 5 LYS H . 5 . HN 1 1
64 1 2 1 1 5 LYS QE . 5 . HE# 1 1
65 1 1 1 1 5 LYS QG . 5 . HG# 1 1
65 1 2 1 1 5 LYS QZ . 5 . HZ# 1 1
66 1 1 1 1 6 SER QB . 6 . HB# 1 1
66 1 2 1 1 7 LYS H . 7 . HN 1 1
67 1 1 1 1 7 LYS H . 7 . HN 1 1
67 1 2 1 1 7 LYS QB . 7 . HB# 1 1
68 1 1 1 1 7 LYS HA . 7 . HA 1 1
68 1 2 1 1 7 LYS QE . 7 . HE# 1 1
69 1 1 1 1 7 LYS HA . 7 . HA 1 1
69 1 2 1 1 8 PRO QD . 8 . HD# 1 1
70 1 1 1 1 7 LYS HA . 7 . HA 1 1
70 1 2 1 1 9 PRO QD . 9 . HD# 1 1
71 1 1 1 1 8 PRO HA . 8 . HA 1 1
71 1 2 1 1 9 PRO QD . 9 . HD# 1 1
72 1 1 1 1 8 PRO QB . 8 . HB# 1 1
72 1 2 1 1 9 PRO QD . 9 . HD# 1 1
73 1 1 1 1 10 ILE H . 10 . HN 1 1
73 1 2 1 1 10 ILE QG . 10 . HG1# 1 1
74 1 1 1 1 12 PHE HA . 12 . HA 1 1
74 1 2 1 1 13 PRO QD . 13 . HD# 1 1
75 1 1 1 1 12 PHE HB2 . 12 . HB2 1 1
75 1 2 1 1 13 PRO QD . 13 . HD# 1 1
76 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
76 1 2 1 1 13 PRO QD . 13 . HD# 1 1
77 1 1 1 1 12 PHE QD . 12 . HD# 1 1
77 1 2 1 1 13 PRO QD . 13 . HD# 1 1
78 1 1 1 1 13 PRO QB . 13 . HB# 1 1
78 1 2 1 1 14 ASP H . 14 . HN 1 1
79 1 1 1 1 13 PRO QD . 13 . HD# 1 1
79 1 2 1 1 14 ASP H . 14 . HN 1 1
80 1 1 1 1 14 ASP H . 14 . HN 1 1
80 1 2 1 1 14 ASP QB . 14 . HB# 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.9 1.8 4.0 1 1
2 1 . . . . . 3.65 1.8 5.5 1 1
3 1 . . . . . 3.65 1.8 5.5 1 1
4 1 . . . . . 2.9 1.8 4.0 1 1
5 1 . . . . . 3.17 1.8 4.54 1 1
6 1 . . . . . 3.17 1.8 4.54 1 1
7 1 . . . . . 2.215 1.8 2.63 1 1
8 1 . . . . . 2.99 1.8 4.18 1 1
9 1 . . . . . 2.375 1.8 2.95 1 1
10 1 . . . . . 2.615 1.8 3.43 1 1
11 1 . . . . . 2.6 1.8 3.4 1 1
12 1 . . . . . 2.6 1.8 3.4 1 1
13 1 . . . . . 2.355 1.8 2.91 1 1
14 1 . . . . . 2.915 1.8 4.03 1 1
15 1 . . . . . 2.26 1.8 2.72 1 1
16 1 . . . . . 2.59 1.8 3.38 1 1
17 1 . . . . . 2.39 1.8 2.98 1 1
18 1 . . . . . 2.7 1.8 3.6 1 1
19 1 . . . . . 2.7 1.8 3.6 1 1
20 1 . . . . . 3.11 1.8 4.42 1 1
21 1 . . . . . 3.2 1.8 4.6 1 1
22 1 . . . . . 2.65 1.8 3.5 1 1
23 1 . . . . . 2.99 1.8 4.18 1 1
24 1 . . . . . 3.235 1.8 4.67 1 1
25 1 . . . . . 3.35 1.8 4.9 1 1
26 1 . . . . . 2.905 1.8 4.01 1 1
27 1 . . . . . 3.03 1.8 4.26 1 1
28 1 . . . . . 3.01 1.8 4.22 1 1
29 1 . . . . . 3.215 1.8 4.63 1 1
30 1 . . . . . 3.215 1.8 4.63 1 1
31 1 . . . . . 3.125 1.8 4.45 1 1
32 1 . . . . . 3.005 1.8 4.21 1 1
33 1 . . . . . 2.995 1.8 4.19 1 1
34 1 . . . . . 3.025 1.8 4.25 1 1
35 1 . . . . . 3.035 1.8 4.27 1 1
36 1 . . . . . 3.335 1.8 4.87 1 1
37 1 . . . . . 3.225 1.8 4.65 1 1
38 1 . . . . . 3.315 1.8 4.83 1 1
39 1 . . . . . 3.35 1.8 4.9 1 1
40 1 . . . . . 2.865 1.8 3.93 1 1
41 1 . . . . . 2.985 1.8 4.17 1 1
42 1 . . . . . 2.985 1.8 4.17 1 1
43 1 . . . . . 3.185 1.8 4.57 1 1
44 1 . . . . . 3.28 1.8 4.76 1 1
45 1 . . . . . 2.92 1.8 4.04 1 1
46 1 . . . . . 3.05 1.8 4.3 1 1
47 1 . . . . . 2.935 1.8 4.07 1 1
48 1 . . . . . 3.02 1.8 4.24 1 1
49 1 . . . . . 3.175 1.8 4.55 1 1
50 1 . . . . . 3.175 1.8 4.55 1 1
51 1 . . . . . 2.54 1.8 3.28 1 1
52 1 . . . . . 3.265 1.8 4.73 1 1
53 1 . . . . . 2.755 1.8 3.71 1 1
54 1 . . . . . 2.885 1.8 3.97 1 1
55 1 . . . . . 3.1 1.8 4.4 1 1
56 1 . . . . . 2.965 1.8 4.13 1 1
57 1 . . . . . 2.635 1.8 3.47 1 1
58 1 . . . . . 3.34 1.8 4.88 1 1
59 1 . . . . . 3.14 1.8 4.48 1 1
60 1 . . . . . 3.265 1.8 4.73 1 1
61 1 . . . . . 3.005 1.8 4.21 1 1
62 1 . . . . . 2.69 1.8 3.58 1 1
63 1 . . . . . 3.095 1.8 4.39 1 1
64 1 . . . . . 3.145 1.8 4.49 1 1
65 1 . . . . . 3.57 1.8 5.34 1 1
66 1 . . . . . 2.485 1.8 3.17 1 1
67 1 . . . . . 2.68 1.8 3.56 1 1
68 1 . . . . . 3.185 1.8 4.57 1 1
69 1 . . . . . 3.055 1.8 4.31 1 1
70 1 . . . . . 2.83 1.8 3.86 1 1
71 1 . . . . . 2.37 1.8 2.94 1 1
72 1 . . . . . 2.705 1.8 3.61 1 1
73 1 . . . . . 3.145 1.8 4.49 1 1
74 1 . . . . . 2.42 1.8 3.04 1 1
75 1 . . . . . 3.35 1.8 4.9 1 1
76 1 . . . . . 2.65 1.8 3.5 1 1
77 1 . . . . . 3.075 1.8 4.35 1 1
78 1 . . . . . 2.95 1.8 4.1 1 1
79 1 . . . . . 3.015 1.8 4.23 1 1
80 1 . . . . . 2.65 1.8 3.5 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 ARG O . 2 . O 1 2
1 1 2 1 1 12 PHE H . 12 . HN 1 2
2 1 1 1 1 2 ARG O . 2 . O 1 2
2 1 2 1 1 12 PHE N . 12 . N 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 0.0 0.0 2.0 1 2
2 1 . . . . . 0.0 0.0 3.0 1 2
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 2 ARG C 1 1 3 ALA N 1 1 3 ALA CA 1 1 3 ALA C -148.6 -108.59999 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
2 . 1 1 3 ALA N 1 1 3 ALA CA 1 1 3 ALA C 1 1 4 TYR N 135.6 175.6 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1
3 . 1 1 3 ALA C 1 1 4 TYR N 1 1 4 TYR CA 1 1 4 TYR C -139.4 -87.8 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1
4 . 1 1 4 TYR N 1 1 4 TYR CA 1 1 4 TYR C 1 1 5 LYS N 104.19999 155.2 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1
5 . 1 1 5 LYS C 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C -149.7 -37.5 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
6 . 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C 1 1 7 LYS N 118.4 169.8 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1
7 . 1 1 6 SER C 1 1 7 LYS N 1 1 7 LYS CA 1 1 7 LYS C -113.0 -40.8 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
8 . 1 1 7 LYS N 1 1 7 LYS CA 1 1 7 LYS C 1 1 8 PRO N 109.2 168.8 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1
9 . 1 1 8 PRO N 1 1 8 PRO CA 1 1 8 PRO C 1 1 9 PRO N 116.9 170.5 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1
10 . 1 1 9 PRO N 1 1 9 PRO CA 1 1 9 PRO C 1 1 10 ILE N 19.899998 142.1 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1
11 . 1 1 9 PRO C 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C -156.3 -86.3 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
12 . 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C 1 1 11 ALA N 107.3 162.5 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1
13 . 1 1 10 ILE C 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C -162.4 -35.4 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
14 . 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C 1 1 12 PHE N 93.799995 153.8 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1
15 . 1 1 11 ALA C 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C -147.8 -79.8 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
16 . 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C 1 1 13 PRO N 66.99999 131.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1
17 . 1 1 13 PRO C 1 1 14 ASP N 1 1 14 ASP CA 1 1 14 ASP C -105.4 -65.4 . 13 . C . 14 . N . 14 . CA . 14 . 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 GLY C C -6.698 -2.853 1.271 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C -7.748 -2.492 2.280 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H -8.041 -0.441 1.946 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY HA2 H -7.286 -2.314 3.238 1.00 . A A . 1 GLY HA2 1 1
1 5 1 1 1 GLY HA3 H -8.440 -3.316 2.367 1.00 . A A . 1 GLY HA3 1 1
1 6 1 1 1 GLY N N -8.469 -1.322 1.865 1.00 . A A . 1 GLY N 1 1
1 7 1 1 1 GLY O O -6.536 -4.019 0.918 1.00 . A A . 1 GLY O 1 1
1 8 1 1 2 ARG C C -3.658 -1.542 0.300 1.00 . A A . 2 ARG C 1 1
1 9 1 1 2 ARG CA C -4.970 -2.105 -0.214 1.00 . A A . 2 ARG CA 1 1
1 10 1 1 2 ARG CB C -5.287 -1.409 -1.554 1.00 . A A . 2 ARG CB 1 1
1 11 1 1 2 ARG CD C -6.920 -0.592 -3.256 1.00 . A A . 2 ARG CD 1 1
1 12 1 1 2 ARG CG C -6.760 -1.318 -1.929 1.00 . A A . 2 ARG CG 1 1
1 13 1 1 2 ARG CZ C -8.708 0.545 -4.568 1.00 . A A . 2 ARG CZ 1 1
1 14 1 1 2 ARG H H -6.133 -0.948 1.121 1.00 . A A . 2 ARG H 1 1
1 15 1 1 2 ARG HA H -4.880 -3.169 -0.371 1.00 . A A . 2 ARG HA 1 1
1 16 1 1 2 ARG HB2 H -4.882 -0.408 -1.518 1.00 . A A . 2 ARG HB2 1 1
1 17 1 1 2 ARG HB3 H -4.771 -1.946 -2.336 1.00 . A A . 2 ARG HB3 1 1
1 18 1 1 2 ARG HD2 H -6.178 0.189 -3.321 1.00 . A A . 2 ARG HD2 1 1
1 19 1 1 2 ARG HD3 H -6.758 -1.302 -4.053 1.00 . A A . 2 ARG HD3 1 1
1 20 1 1 2 ARG HE H -8.809 0.079 -2.619 1.00 . A A . 2 ARG HE 1 1
1 21 1 1 2 ARG HG2 H -7.159 -2.317 -2.022 1.00 . A A . 2 ARG HG2 1 1
1 22 1 1 2 ARG HG3 H -7.295 -0.779 -1.162 1.00 . A A . 2 ARG HG3 1 1
1 23 1 1 2 ARG HH11 H -7.206 -0.200 -5.757 1.00 . A A . 2 ARG HH11 1 1
1 24 1 1 2 ARG HH12 H -8.354 0.727 -6.586 1.00 . A A . 2 ARG HH12 1 1
1 25 1 1 2 ARG HH21 H -10.357 1.396 -3.707 1.00 . A A . 2 ARG HH21 1 1
1 26 1 1 2 ARG HH22 H -10.220 1.671 -5.390 1.00 . A A . 2 ARG HH22 1 1
1 27 1 1 2 ARG N N -5.991 -1.858 0.782 1.00 . A A . 2 ARG N 1 1
1 28 1 1 2 ARG NE N -8.255 0.010 -3.427 1.00 . A A . 2 ARG NE 1 1
1 29 1 1 2 ARG NH1 N -8.046 0.347 -5.709 1.00 . A A . 2 ARG NH1 1 1
1 30 1 1 2 ARG NH2 N -9.837 1.252 -4.561 1.00 . A A . 2 ARG NH2 1 1
1 31 1 1 2 ARG O O -3.409 -0.351 0.169 1.00 . A A . 2 ARG O 1 1
1 32 1 1 3 ALA C C -0.477 -2.549 0.625 1.00 . A A . 3 ALA C 1 1
1 33 1 1 3 ALA CA C -1.582 -1.943 1.434 1.00 . A A . 3 ALA CA 1 1
1 34 1 1 3 ALA CB C -1.422 -2.281 2.921 1.00 . A A . 3 ALA CB 1 1
1 35 1 1 3 ALA H H -3.163 -3.285 1.077 1.00 . A A . 3 ALA H 1 1
1 36 1 1 3 ALA HA H -1.528 -0.871 1.321 1.00 . A A . 3 ALA HA 1 1
1 37 1 1 3 ALA HB1 H -0.379 -2.491 3.110 1.00 . A A . 3 ALA HB1 1 1
1 38 1 1 3 ALA HB2 H -1.999 -3.166 3.144 1.00 . A A . 3 ALA HB2 1 1
1 39 1 1 3 ALA N N -2.878 -2.356 0.933 1.00 . A A . 3 ALA N 1 1
1 40 1 1 3 ALA O O -0.514 -3.737 0.286 1.00 . A A . 3 ALA O 1 1
1 41 1 1 4 TYR C C 2.833 -2.316 0.395 1.00 . A A . 4 TYR C 1 1
1 42 1 1 4 TYR CA C 1.611 -2.159 -0.492 1.00 . A A . 4 TYR CA 1 1
1 43 1 1 4 TYR CB C 1.863 -1.178 -1.650 1.00 . A A . 4 TYR CB 1 1
1 44 1 1 4 TYR CD1 C -0.341 -0.297 -2.530 1.00 . A A . 4 TYR CD1 1 1
1 45 1 1 4 TYR CD2 C 0.761 -1.982 -3.784 1.00 . A A . 4 TYR CD2 1 1
1 46 1 1 4 TYR CE1 C -1.364 -0.273 -3.447 1.00 . A A . 4 TYR CE1 1 1
1 47 1 1 4 TYR CE2 C -0.262 -1.961 -4.712 1.00 . A A . 4 TYR CE2 1 1
1 48 1 1 4 TYR CG C 0.739 -1.151 -2.677 1.00 . A A . 4 TYR CG 1 1
1 49 1 1 4 TYR CZ C -1.320 -1.101 -4.535 1.00 . A A . 4 TYR CZ 1 1
1 50 1 1 4 TYR H H 0.433 -0.794 0.562 1.00 . A A . 4 TYR H 1 1
1 51 1 1 4 TYR HA H 1.365 -3.126 -0.904 1.00 . A A . 4 TYR HA 1 1
1 52 1 1 4 TYR HB2 H 1.948 -0.176 -1.253 1.00 . A A . 4 TYR HB2 1 1
1 53 1 1 4 TYR HB3 H 2.777 -1.445 -2.159 1.00 . A A . 4 TYR HB3 1 1
1 54 1 1 4 TYR HD1 H -0.376 0.357 -1.670 1.00 . A A . 4 TYR HD1 1 1
1 55 1 1 4 TYR HD2 H 1.591 -2.657 -3.920 1.00 . A A . 4 TYR HD2 1 1
1 56 1 1 4 TYR HE1 H -2.194 0.401 -3.303 1.00 . A A . 4 TYR HE1 1 1
1 57 1 1 4 TYR HE2 H -0.223 -2.617 -5.569 1.00 . A A . 4 TYR HE2 1 1
1 58 1 1 4 TYR HH H -2.559 -0.162 -5.675 1.00 . A A . 4 TYR HH 1 1
1 59 1 1 4 TYR N N 0.483 -1.736 0.288 1.00 . A A . 4 TYR N 1 1
1 60 1 1 4 TYR O O 3.024 -1.551 1.347 1.00 . A A . 4 TYR O 1 1
1 61 1 1 4 TYR OH O -2.337 -1.075 -5.448 1.00 . A A . 4 TYR OH 1 1
1 62 1 1 5 LYS C C 6.011 -2.802 0.494 1.00 . A A . 5 LYS C 1 1
1 63 1 1 5 LYS CA C 4.819 -3.658 0.894 1.00 . A A . 5 LYS CA 1 1
1 64 1 1 5 LYS CB C 5.192 -5.160 0.767 1.00 . A A . 5 LYS CB 1 1
1 65 1 1 5 LYS CD C 2.841 -6.188 0.897 1.00 . A A . 5 LYS CD 1 1
1 66 1 1 5 LYS CE C 1.986 -7.262 1.552 1.00 . A A . 5 LYS CE 1 1
1 67 1 1 5 LYS CG C 4.253 -6.175 1.461 1.00 . A A . 5 LYS CG 1 1
1 68 1 1 5 LYS H H 3.406 -3.878 -0.677 1.00 . A A . 5 LYS H 1 1
1 69 1 1 5 LYS HA H 4.589 -3.451 1.928 1.00 . A A . 5 LYS HA 1 1
1 70 1 1 5 LYS HB2 H 5.221 -5.412 -0.282 1.00 . A A . 5 LYS HB2 1 1
1 71 1 1 5 LYS HB3 H 6.185 -5.289 1.172 1.00 . A A . 5 LYS HB3 1 1
1 72 1 1 5 LYS HD2 H 2.387 -5.224 1.068 1.00 . A A . 5 LYS HD2 1 1
1 73 1 1 5 LYS HD3 H 2.895 -6.378 -0.166 1.00 . A A . 5 LYS HD3 1 1
1 74 1 1 5 LYS HE2 H 2.426 -8.227 1.344 1.00 . A A . 5 LYS HE2 1 1
1 75 1 1 5 LYS HE3 H 1.974 -7.101 2.619 1.00 . A A . 5 LYS HE3 1 1
1 76 1 1 5 LYS HG2 H 4.670 -7.165 1.343 1.00 . A A . 5 LYS HG2 1 1
1 77 1 1 5 LYS HG3 H 4.209 -5.942 2.514 1.00 . A A . 5 LYS HG3 1 1
1 78 1 1 5 LYS HZ1 H 0.049 -8.034 1.440 1.00 . A A . 5 LYS HZ1 1 1
1 79 1 1 5 LYS HZ2 H 0.580 -7.337 0.002 1.00 . A A . 5 LYS HZ2 1 1
1 80 1 1 5 LYS HZ3 H 0.118 -6.365 1.302 1.00 . A A . 5 LYS HZ3 1 1
1 81 1 1 5 LYS N N 3.629 -3.327 0.104 1.00 . A A . 5 LYS N 1 1
1 82 1 1 5 LYS NZ N 0.599 -7.247 1.039 1.00 . A A . 5 LYS NZ 1 1
1 83 1 1 5 LYS O O 6.884 -2.489 1.326 1.00 . A A . 5 LYS O 1 1
1 84 1 1 6 SER C C 7.121 -0.233 -0.686 1.00 . A A . 6 SER C 1 1
1 85 1 1 6 SER CA C 7.103 -1.619 -1.323 1.00 . A A . 6 SER CA 1 1
1 86 1 1 6 SER CB C 6.862 -1.490 -2.810 1.00 . A A . 6 SER CB 1 1
1 87 1 1 6 SER H H 5.289 -2.644 -1.358 1.00 . A A . 6 SER H 1 1
1 88 1 1 6 SER HA H 8.047 -2.120 -1.164 1.00 . A A . 6 SER HA 1 1
1 89 1 1 6 SER HB2 H 6.024 -0.832 -2.978 1.00 . A A . 6 SER HB2 1 1
1 90 1 1 6 SER HB3 H 7.744 -1.083 -3.279 1.00 . A A . 6 SER HB3 1 1
1 91 1 1 6 SER HG H 7.099 -3.420 -2.891 1.00 . A A . 6 SER HG 1 1
1 92 1 1 6 SER N N 6.034 -2.410 -0.766 1.00 . A A . 6 SER N 1 1
1 93 1 1 6 SER O O 6.106 0.227 -0.185 1.00 . A A . 6 SER O 1 1
1 94 1 1 6 SER OG O 6.586 -2.765 -3.382 1.00 . A A . 6 SER OG 1 1
1 95 1 1 7 LYS C C 8.454 2.743 -1.254 1.00 . A A . 7 LYS C 1 1
1 96 1 1 7 LYS CA C 8.380 1.725 -0.129 1.00 . A A . 7 LYS CA 1 1
1 97 1 1 7 LYS CB C 9.598 1.867 0.809 1.00 . A A . 7 LYS CB 1 1
1 98 1 1 7 LYS CD C 9.788 -0.449 1.793 1.00 . A A . 7 LYS CD 1 1
1 99 1 1 7 LYS CE C 9.653 -1.289 3.036 1.00 . A A . 7 LYS CE 1 1
1 100 1 1 7 LYS CG C 9.532 1.017 2.073 1.00 . A A . 7 LYS CG 1 1
1 101 1 1 7 LYS H H 9.060 0.009 -1.106 1.00 . A A . 7 LYS H 1 1
1 102 1 1 7 LYS HA H 7.478 1.859 0.450 1.00 . A A . 7 LYS HA 1 1
1 103 1 1 7 LYS HB2 H 10.485 1.580 0.265 1.00 . A A . 7 LYS HB2 1 1
1 104 1 1 7 LYS HB3 H 9.689 2.904 1.101 1.00 . A A . 7 LYS HB3 1 1
1 105 1 1 7 LYS HD2 H 9.077 -0.796 1.058 1.00 . A A . 7 LYS HD2 1 1
1 106 1 1 7 LYS HD3 H 10.790 -0.552 1.404 1.00 . A A . 7 LYS HD3 1 1
1 107 1 1 7 LYS HE2 H 9.960 -2.297 2.803 1.00 . A A . 7 LYS HE2 1 1
1 108 1 1 7 LYS HE3 H 10.307 -0.858 3.777 1.00 . A A . 7 LYS HE3 1 1
1 109 1 1 7 LYS HG2 H 10.262 1.368 2.786 1.00 . A A . 7 LYS HG2 1 1
1 110 1 1 7 LYS HG3 H 8.546 1.120 2.501 1.00 . A A . 7 LYS HG3 1 1
1 111 1 1 7 LYS HZ1 H 7.952 -0.380 3.897 1.00 . A A . 7 LYS HZ1 1 1
1 112 1 1 7 LYS HZ2 H 8.236 -1.970 4.375 1.00 . A A . 7 LYS HZ2 1 1
1 113 1 1 7 LYS HZ3 H 7.605 -1.677 2.854 1.00 . A A . 7 LYS HZ3 1 1
1 114 1 1 7 LYS N N 8.264 0.408 -0.691 1.00 . A A . 7 LYS N 1 1
1 115 1 1 7 LYS NZ N 8.272 -1.314 3.568 1.00 . A A . 7 LYS NZ 1 1
1 116 1 1 7 LYS O O 9.185 2.517 -2.242 1.00 . A A . 7 LYS O 1 1
1 117 1 1 8 PRO C C 5.601 3.316 0.052 1.00 . A A . 8 PRO C 1 1
1 118 1 1 8 PRO CA C 6.850 4.208 -0.021 1.00 . A A . 8 PRO CA 1 1
1 119 1 1 8 PRO CB C 6.441 5.653 -0.326 1.00 . A A . 8 PRO CB 1 1
1 120 1 1 8 PRO CD C 7.672 4.903 -2.210 1.00 . A A . 8 PRO CD 1 1
1 121 1 1 8 PRO CG C 6.499 5.740 -1.809 1.00 . A A . 8 PRO CG 1 1
1 122 1 1 8 PRO HA H 7.385 4.166 0.914 1.00 . A A . 8 PRO HA 1 1
1 123 1 1 8 PRO HB2 H 5.445 5.837 0.048 1.00 . A A . 8 PRO HB2 1 1
1 124 1 1 8 PRO HB3 H 7.140 6.336 0.134 1.00 . A A . 8 PRO HB3 1 1
1 125 1 1 8 PRO HD2 H 7.518 4.468 -3.186 1.00 . A A . 8 PRO HD2 1 1
1 126 1 1 8 PRO HD3 H 8.574 5.494 -2.199 1.00 . A A . 8 PRO HD3 1 1
1 127 1 1 8 PRO HG2 H 5.591 5.340 -2.234 1.00 . A A . 8 PRO HG2 1 1
1 128 1 1 8 PRO HG3 H 6.643 6.762 -2.126 1.00 . A A . 8 PRO HG3 1 1
1 129 1 1 8 PRO N N 7.724 3.863 -1.169 1.00 . A A . 8 PRO N 1 1
1 130 1 1 8 PRO O O 4.979 3.020 -0.984 1.00 . A A . 8 PRO O 1 1
1 131 1 1 9 PRO C C 2.789 2.788 1.270 1.00 . A A . 9 PRO C 1 1
1 132 1 1 9 PRO CA C 4.080 1.997 1.430 1.00 . A A . 9 PRO CA 1 1
1 133 1 1 9 PRO CB C 4.224 1.442 2.848 1.00 . A A . 9 PRO CB 1 1
1 134 1 1 9 PRO CD C 5.952 3.083 2.526 1.00 . A A . 9 PRO CD 1 1
1 135 1 1 9 PRO CG C 5.078 2.426 3.566 1.00 . A A . 9 PRO CG 1 1
1 136 1 1 9 PRO HA H 4.081 1.189 0.715 1.00 . A A . 9 PRO HA 1 1
1 137 1 1 9 PRO HB2 H 3.247 1.359 3.301 1.00 . A A . 9 PRO HB2 1 1
1 138 1 1 9 PRO HB3 H 4.692 0.470 2.808 1.00 . A A . 9 PRO HB3 1 1
1 139 1 1 9 PRO HD2 H 6.032 4.142 2.720 1.00 . A A . 9 PRO HD2 1 1
1 140 1 1 9 PRO HD3 H 6.930 2.628 2.517 1.00 . A A . 9 PRO HD3 1 1
1 141 1 1 9 PRO HG2 H 4.451 3.163 4.045 1.00 . A A . 9 PRO HG2 1 1
1 142 1 1 9 PRO HG3 H 5.687 1.918 4.301 1.00 . A A . 9 PRO HG3 1 1
1 143 1 1 9 PRO N N 5.244 2.839 1.253 1.00 . A A . 9 PRO N 1 1
1 144 1 1 9 PRO O O 2.438 3.640 2.096 1.00 . A A . 9 PRO O 1 1
1 145 1 1 10 ILE C C -0.238 2.329 0.354 1.00 . A A . 10 ILE C 1 1
1 146 1 1 10 ILE CA C 0.899 3.215 -0.119 1.00 . A A . 10 ILE CA 1 1
1 147 1 1 10 ILE CB C 0.777 3.470 -1.651 1.00 . A A . 10 ILE CB 1 1
1 148 1 1 10 ILE CD1 C 2.083 5.695 -1.510 1.00 . A A . 10 ILE CD1 1 1
1 149 1 1 10 ILE CG1 C 1.954 4.329 -2.168 1.00 . A A . 10 ILE CG1 1 1
1 150 1 1 10 ILE CG2 C -0.556 4.107 -2.007 1.00 . A A . 10 ILE CG2 1 1
1 151 1 1 10 ILE H H 2.506 1.920 -0.464 1.00 . A A . 10 ILE H 1 1
1 152 1 1 10 ILE HA H 0.866 4.159 0.403 1.00 . A A . 10 ILE HA 1 1
1 153 1 1 10 ILE HB H 0.818 2.508 -2.141 1.00 . A A . 10 ILE HB 1 1
1 154 1 1 10 ILE HD11 H 1.183 6.264 -1.683 1.00 . A A . 10 ILE HD11 1 1
1 155 1 1 10 ILE HD12 H 2.927 6.218 -1.935 1.00 . A A . 10 ILE HD12 1 1
1 156 1 1 10 ILE HD13 H 2.237 5.575 -0.448 1.00 . A A . 10 ILE HD13 1 1
1 157 1 1 10 ILE HG12 H 2.879 3.798 -1.989 1.00 . A A . 10 ILE HG12 1 1
1 158 1 1 10 ILE HG13 H 1.837 4.480 -3.230 1.00 . A A . 10 ILE HG13 1 1
1 159 1 1 10 ILE HG21 H -1.346 3.439 -1.699 1.00 . A A . 10 ILE HG21 1 1
1 160 1 1 10 ILE HG22 H -0.603 4.259 -3.074 1.00 . A A . 10 ILE HG22 1 1
1 161 1 1 10 ILE HG23 H -0.656 5.052 -1.494 1.00 . A A . 10 ILE HG23 1 1
1 162 1 1 10 ILE N N 2.136 2.559 0.180 1.00 . A A . 10 ILE N 1 1
1 163 1 1 10 ILE O O -0.231 1.123 0.093 1.00 . A A . 10 ILE O 1 1
1 164 1 1 11 ALA C C -3.562 2.866 1.182 1.00 . A A . 11 ALA C 1 1
1 165 1 1 11 ALA CA C -2.295 2.136 1.552 1.00 . A A . 11 ALA CA 1 1
1 166 1 1 11 ALA CB C -2.284 1.859 3.079 1.00 . A A . 11 ALA CB 1 1
1 167 1 1 11 ALA H H -1.092 3.826 1.371 1.00 . A A . 11 ALA H 1 1
1 168 1 1 11 ALA HA H -2.284 1.194 1.026 1.00 . A A . 11 ALA HA 1 1
1 169 1 1 11 ALA HB1 H -3.145 1.257 3.327 1.00 . A A . 11 ALA HB1 1 1
1 170 1 1 11 ALA HB2 H -2.367 2.802 3.596 1.00 . A A . 11 ALA HB2 1 1
1 171 1 1 11 ALA N N -1.159 2.886 1.101 1.00 . A A . 11 ALA N 1 1
1 172 1 1 11 ALA O O -3.714 4.055 1.459 1.00 . A A . 11 ALA O 1 1
1 173 1 1 12 PHE C C -6.706 2.143 1.170 1.00 . A A . 12 PHE C 1 1
1 174 1 1 12 PHE CA C -5.726 2.676 0.159 1.00 . A A . 12 PHE CA 1 1
1 175 1 1 12 PHE CB C -6.138 2.232 -1.246 1.00 . A A . 12 PHE CB 1 1
1 176 1 1 12 PHE CD1 C -4.067 2.232 -2.675 1.00 . A A . 12 PHE CD1 1 1
1 177 1 1 12 PHE CD2 C -5.744 3.862 -3.091 1.00 . A A . 12 PHE CD2 1 1
1 178 1 1 12 PHE CE1 C -3.308 2.752 -3.703 1.00 . A A . 12 PHE CE1 1 1
1 179 1 1 12 PHE CE2 C -4.991 4.385 -4.116 1.00 . A A . 12 PHE CE2 1 1
1 180 1 1 12 PHE CG C -5.296 2.787 -2.358 1.00 . A A . 12 PHE CG 1 1
1 181 1 1 12 PHE CZ C -3.770 3.828 -4.422 1.00 . A A . 12 PHE CZ 1 1
1 182 1 1 12 PHE H H -4.174 1.254 0.279 1.00 . A A . 12 PHE H 1 1
1 183 1 1 12 PHE HA H -5.695 3.755 0.214 1.00 . A A . 12 PHE HA 1 1
1 184 1 1 12 PHE HB2 H -6.094 1.155 -1.300 1.00 . A A . 12 PHE HB2 1 1
1 185 1 1 12 PHE HB3 H -7.159 2.540 -1.416 1.00 . A A . 12 PHE HB3 1 1
1 186 1 1 12 PHE HD1 H -3.703 1.390 -2.105 1.00 . A A . 12 PHE HD1 1 1
1 187 1 1 12 PHE HD2 H -6.702 4.297 -2.850 1.00 . A A . 12 PHE HD2 1 1
1 188 1 1 12 PHE HE1 H -2.349 2.324 -3.955 1.00 . A A . 12 PHE HE1 1 1
1 189 1 1 12 PHE HE2 H -5.356 5.231 -4.681 1.00 . A A . 12 PHE HE2 1 1
1 190 1 1 12 PHE HZ H -3.174 4.232 -5.225 1.00 . A A . 12 PHE HZ 1 1
1 191 1 1 12 PHE N N -4.427 2.173 0.520 1.00 . A A . 12 PHE N 1 1
1 192 1 1 12 PHE O O -6.698 0.930 1.439 1.00 . A A . 12 PHE O 1 1
1 193 1 1 13 PRO C C -9.454 1.490 2.555 1.00 . A A . 13 PRO C 1 1
1 194 1 1 13 PRO CA C -8.499 2.663 2.838 1.00 . A A . 13 PRO CA 1 1
1 195 1 1 13 PRO CB C -9.299 3.946 3.058 1.00 . A A . 13 PRO CB 1 1
1 196 1 1 13 PRO CD C -7.762 4.412 1.312 1.00 . A A . 13 PRO CD 1 1
1 197 1 1 13 PRO CG C -9.149 4.702 1.792 1.00 . A A . 13 PRO CG 1 1
1 198 1 1 13 PRO HA H -7.942 2.441 3.736 1.00 . A A . 13 PRO HA 1 1
1 199 1 1 13 PRO HB2 H -10.331 3.692 3.252 1.00 . A A . 13 PRO HB2 1 1
1 200 1 1 13 PRO HB3 H -8.895 4.494 3.897 1.00 . A A . 13 PRO HB3 1 1
1 201 1 1 13 PRO HD2 H -7.706 4.515 0.237 1.00 . A A . 13 PRO HD2 1 1
1 202 1 1 13 PRO HD3 H -7.042 5.054 1.795 1.00 . A A . 13 PRO HD3 1 1
1 203 1 1 13 PRO HG2 H -9.880 4.363 1.072 1.00 . A A . 13 PRO HG2 1 1
1 204 1 1 13 PRO HG3 H -9.271 5.758 1.983 1.00 . A A . 13 PRO HG3 1 1
1 205 1 1 13 PRO N N -7.578 3.007 1.725 1.00 . A A . 13 PRO N 1 1
1 206 1 1 13 PRO O O -10.130 1.002 3.464 1.00 . A A . 13 PRO O 1 1
1 207 1 1 14 ASP C C -9.688 -1.413 1.377 1.00 . A A . 14 ASP C 1 1
1 208 1 1 14 ASP CA C -10.342 -0.112 0.949 1.00 . A A . 14 ASP CA 1 1
1 209 1 1 14 ASP CB C -10.598 -0.178 -0.564 1.00 . A A . 14 ASP CB 1 1
1 210 1 1 14 ASP CG C -11.281 1.035 -1.124 1.00 . A A . 14 ASP CG 1 1
1 211 1 1 14 ASP H H -8.942 1.482 0.651 1.00 . A A . 14 ASP H 1 1
1 212 1 1 14 ASP HA H -11.287 -0.008 1.463 1.00 . A A . 14 ASP HA 1 1
1 213 1 1 14 ASP HB2 H -9.649 -0.288 -1.069 1.00 . A A . 14 ASP HB2 1 1
1 214 1 1 14 ASP HB3 H -11.204 -1.045 -0.775 1.00 . A A . 14 ASP HB3 1 1
1 215 1 1 14 ASP N N -9.497 1.029 1.320 1.00 . A A . 14 ASP N 1 1
1 216 1 1 14 ASP O O -10.273 -2.486 1.238 1.00 . A A . 14 ASP O 1 1
1 217 1 1 14 ASP OD1 O -12.447 1.299 -0.779 1.00 . A A . 14 ASP OD1 1 1
1 218 1 1 14 ASP OD2 O -10.666 1.744 -1.938 1.00 . A A . 14 ASP OD2 1 1
1 219 2 2 1 . C C -1.861 -1.176 3.870 1.00 . B A . 101 WMH C 1 1
1 220 2 2 1 . C1 C -1.035 1.167 3.616 1.00 . B A . 101 WMH C1 1 1
1 221 2 2 1 . C2 C 0.165 1.756 3.823 1.00 . B A . 101 WMH C2 1 1
1 222 2 2 1 . H1 H -2.008 -1.599 4.853 1.00 . B A . 101 WMH H1 1 1
1 223 2 2 1 . H2 H -2.793 -0.757 3.520 1.00 . B A . 101 WMH H2 1 1
1 224 2 2 1 . H5 H 0.393 2.795 3.645 1.00 . B A . 101 WMH H5 1 1
1 225 2 2 1 . N N -0.902 -0.139 3.950 1.00 . B A . 101 WMH N 1 1
1 226 2 2 1 . N1 N 1.017 0.849 4.277 1.00 . B A . 101 WMH N1 1 1
1 227 2 2 1 . N2 N 0.429 -0.291 4.370 1.00 . B A . 101 WMH N2 1 1
2 228 1 1 1 GLY C C -6.674 -3.046 1.100 1.00 . A A . 1 GLY C 1 1
2 229 1 1 1 GLY CA C -7.636 -2.719 2.199 1.00 . A A . 1 GLY CA 1 1
2 230 1 1 1 GLY H1 H -7.941 -0.658 1.866 1.00 . A A . 1 GLY H1 1 1
2 231 1 1 1 GLY HA2 H -7.083 -2.584 3.116 1.00 . A A . 1 GLY HA2 1 1
2 232 1 1 1 GLY HA3 H -8.323 -3.544 2.320 1.00 . A A . 1 GLY HA3 1 1
2 233 1 1 1 GLY N N -8.390 -1.528 1.937 1.00 . A A . 1 GLY N 1 1
2 234 1 1 1 GLY O O -6.617 -4.182 0.629 1.00 . A A . 1 GLY O 1 1
2 235 1 1 2 ARG C C -3.676 -1.537 0.041 1.00 . A A . 2 ARG C 1 1
2 236 1 1 2 ARG CA C -4.935 -2.240 -0.351 1.00 . A A . 2 ARG CA 1 1
2 237 1 1 2 ARG CB C -5.403 -1.748 -1.718 1.00 . A A . 2 ARG CB 1 1
2 238 1 1 2 ARG CD C -6.904 -2.000 -3.677 1.00 . A A . 2 ARG CD 1 1
2 239 1 1 2 ARG CG C -6.401 -2.649 -2.414 1.00 . A A . 2 ARG CG 1 1
2 240 1 1 2 ARG CZ C -7.859 0.251 -4.152 1.00 . A A . 2 ARG CZ 1 1
2 241 1 1 2 ARG H H -6.050 -1.164 1.062 1.00 . A A . 2 ARG H 1 1
2 242 1 1 2 ARG HA H -4.732 -3.298 -0.411 1.00 . A A . 2 ARG HA 1 1
2 243 1 1 2 ARG HB2 H -5.865 -0.780 -1.596 1.00 . A A . 2 ARG HB2 1 1
2 244 1 1 2 ARG HB3 H -4.539 -1.642 -2.357 1.00 . A A . 2 ARG HB3 1 1
2 245 1 1 2 ARG HD2 H -6.052 -1.703 -4.270 1.00 . A A . 2 ARG HD2 1 1
2 246 1 1 2 ARG HD3 H -7.507 -2.704 -4.230 1.00 . A A . 2 ARG HD3 1 1
2 247 1 1 2 ARG HE H -8.169 -0.831 -2.493 1.00 . A A . 2 ARG HE 1 1
2 248 1 1 2 ARG HG2 H -5.920 -3.583 -2.662 1.00 . A A . 2 ARG HG2 1 1
2 249 1 1 2 ARG HG3 H -7.236 -2.832 -1.751 1.00 . A A . 2 ARG HG3 1 1
2 250 1 1 2 ARG HH11 H -6.782 -0.466 -5.744 1.00 . A A . 2 ARG HH11 1 1
2 251 1 1 2 ARG HH12 H -7.439 1.103 -5.947 1.00 . A A . 2 ARG HH12 1 1
2 252 1 1 2 ARG HH21 H -9.005 1.238 -2.794 1.00 . A A . 2 ARG HH21 1 1
2 253 1 1 2 ARG HH22 H -8.729 2.099 -4.252 1.00 . A A . 2 ARG HH22 1 1
2 254 1 1 2 ARG N N -5.939 -2.058 0.669 1.00 . A A . 2 ARG N 1 1
2 255 1 1 2 ARG NE N -7.704 -0.815 -3.371 1.00 . A A . 2 ARG NE 1 1
2 256 1 1 2 ARG NH1 N -7.318 0.293 -5.367 1.00 . A A . 2 ARG NH1 1 1
2 257 1 1 2 ARG NH2 N -8.578 1.267 -3.713 1.00 . A A . 2 ARG NH2 1 1
2 258 1 1 2 ARG O O -3.593 -0.321 -0.024 1.00 . A A . 2 ARG O 1 1
2 259 1 1 3 ALA C C -0.358 -2.328 0.055 1.00 . A A . 3 ALA C 1 1
2 260 1 1 3 ALA CA C -1.462 -1.759 0.882 1.00 . A A . 3 ALA CA 1 1
2 261 1 1 3 ALA CB C -1.195 -2.036 2.360 1.00 . A A . 3 ALA CB 1 1
2 262 1 1 3 ALA H H -2.872 -3.256 0.561 1.00 . A A . 3 ALA H 1 1
2 263 1 1 3 ALA HA H -1.486 -0.688 0.747 1.00 . A A . 3 ALA HA 1 1
2 264 1 1 3 ALA HB1 H -0.133 -2.178 2.496 1.00 . A A . 3 ALA HB1 1 1
2 265 1 1 3 ALA HB2 H -1.703 -2.950 2.632 1.00 . A A . 3 ALA HB2 1 1
2 266 1 1 3 ALA N N -2.733 -2.287 0.492 1.00 . A A . 3 ALA N 1 1
2 267 1 1 3 ALA O O -0.300 -3.541 -0.185 1.00 . A A . 3 ALA O 1 1
2 268 1 1 4 TYR C C 2.716 -2.074 0.034 1.00 . A A . 4 TYR C 1 1
2 269 1 1 4 TYR CA C 1.699 -1.874 -1.038 1.00 . A A . 4 TYR CA 1 1
2 270 1 1 4 TYR CB C 2.165 -0.824 -2.061 1.00 . A A . 4 TYR CB 1 1
2 271 1 1 4 TYR CD1 C 0.178 0.180 -3.265 1.00 . A A . 4 TYR CD1 1 1
2 272 1 1 4 TYR CD2 C 1.445 -1.487 -4.377 1.00 . A A . 4 TYR CD2 1 1
2 273 1 1 4 TYR CE1 C -0.662 0.272 -4.348 1.00 . A A . 4 TYR CE1 1 1
2 274 1 1 4 TYR CE2 C 0.610 -1.400 -5.466 1.00 . A A . 4 TYR CE2 1 1
2 275 1 1 4 TYR CG C 1.247 -0.703 -3.259 1.00 . A A . 4 TYR CG 1 1
2 276 1 1 4 TYR CZ C -0.441 -0.521 -5.446 1.00 . A A . 4 TYR CZ 1 1
2 277 1 1 4 TYR H H 0.336 -0.507 -0.259 1.00 . A A . 4 TYR H 1 1
2 278 1 1 4 TYR HA H 1.507 -2.813 -1.534 1.00 . A A . 4 TYR HA 1 1
2 279 1 1 4 TYR HB2 H 2.210 0.142 -1.579 1.00 . A A . 4 TYR HB2 1 1
2 280 1 1 4 TYR HB3 H 3.149 -1.089 -2.418 1.00 . A A . 4 TYR HB3 1 1
2 281 1 1 4 TYR HD1 H 0.008 0.801 -2.397 1.00 . A A . 4 TYR HD1 1 1
2 282 1 1 4 TYR HD2 H 2.274 -2.178 -4.394 1.00 . A A . 4 TYR HD2 1 1
2 283 1 1 4 TYR HE1 H -1.488 0.967 -4.331 1.00 . A A . 4 TYR HE1 1 1
2 284 1 1 4 TYR HE2 H 0.792 -2.027 -6.326 1.00 . A A . 4 TYR HE2 1 1
2 285 1 1 4 TYR HH H -1.545 -1.334 -6.769 1.00 . A A . 4 TYR HH 1 1
2 286 1 1 4 TYR N N 0.505 -1.467 -0.383 1.00 . A A . 4 TYR N 1 1
2 287 1 1 4 TYR O O 2.971 -1.163 0.821 1.00 . A A . 4 TYR O 1 1
2 288 1 1 4 TYR OH O -1.276 -0.440 -6.519 1.00 . A A . 4 TYR OH 1 1
2 289 1 1 5 LYS C C 5.596 -3.065 0.845 1.00 . A A . 5 LYS C 1 1
2 290 1 1 5 LYS CA C 4.208 -3.583 1.174 1.00 . A A . 5 LYS CA 1 1
2 291 1 1 5 LYS CB C 4.226 -5.084 1.468 1.00 . A A . 5 LYS CB 1 1
2 292 1 1 5 LYS CD C 2.888 -7.111 2.321 1.00 . A A . 5 LYS CD 1 1
2 293 1 1 5 LYS CE C 3.099 -8.107 1.163 1.00 . A A . 5 LYS CE 1 1
2 294 1 1 5 LYS CG C 2.868 -5.629 1.903 1.00 . A A . 5 LYS CG 1 1
2 295 1 1 5 LYS H H 3.028 -3.934 -0.562 1.00 . A A . 5 LYS H 1 1
2 296 1 1 5 LYS HA H 3.867 -3.062 2.056 1.00 . A A . 5 LYS HA 1 1
2 297 1 1 5 LYS HB2 H 4.540 -5.596 0.572 1.00 . A A . 5 LYS HB2 1 1
2 298 1 1 5 LYS HB3 H 4.942 -5.279 2.253 1.00 . A A . 5 LYS HB3 1 1
2 299 1 1 5 LYS HD2 H 3.687 -7.251 3.033 1.00 . A A . 5 LYS HD2 1 1
2 300 1 1 5 LYS HD3 H 1.951 -7.334 2.808 1.00 . A A . 5 LYS HD3 1 1
2 301 1 1 5 LYS HE2 H 2.916 -9.102 1.538 1.00 . A A . 5 LYS HE2 1 1
2 302 1 1 5 LYS HE3 H 2.375 -7.887 0.392 1.00 . A A . 5 LYS HE3 1 1
2 303 1 1 5 LYS HG2 H 2.519 -5.046 2.742 1.00 . A A . 5 LYS HG2 1 1
2 304 1 1 5 LYS HG3 H 2.172 -5.504 1.085 1.00 . A A . 5 LYS HG3 1 1
2 305 1 1 5 LYS HZ1 H 4.667 -7.197 0.073 1.00 . A A . 5 LYS HZ1 1 1
2 306 1 1 5 LYS HZ2 H 4.563 -8.852 -0.125 1.00 . A A . 5 LYS HZ2 1 1
2 307 1 1 5 LYS HZ3 H 5.187 -8.219 1.306 1.00 . A A . 5 LYS HZ3 1 1
2 308 1 1 5 LYS N N 3.264 -3.262 0.114 1.00 . A A . 5 LYS N 1 1
2 309 1 1 5 LYS NZ N 4.464 -8.086 0.572 1.00 . A A . 5 LYS NZ 1 1
2 310 1 1 5 LYS O O 6.517 -3.137 1.664 1.00 . A A . 5 LYS O 1 1
2 311 1 1 6 SER C C 6.981 -0.483 -0.304 1.00 . A A . 6 SER C 1 1
2 312 1 1 6 SER CA C 6.938 -1.935 -0.784 1.00 . A A . 6 SER CA 1 1
2 313 1 1 6 SER CB C 6.956 -2.008 -2.301 1.00 . A A . 6 SER CB 1 1
2 314 1 1 6 SER H H 4.978 -2.553 -0.966 1.00 . A A . 6 SER H 1 1
2 315 1 1 6 SER HA H 7.781 -2.483 -0.392 1.00 . A A . 6 SER HA 1 1
2 316 1 1 6 SER HB2 H 7.728 -1.359 -2.685 1.00 . A A . 6 SER HB2 1 1
2 317 1 1 6 SER HB3 H 7.139 -3.023 -2.618 1.00 . A A . 6 SER HB3 1 1
2 318 1 1 6 SER HG H 5.641 -0.631 -2.685 1.00 . A A . 6 SER HG 1 1
2 319 1 1 6 SER N N 5.731 -2.545 -0.336 1.00 . A A . 6 SER N 1 1
2 320 1 1 6 SER O O 5.935 0.148 -0.132 1.00 . A A . 6 SER O 1 1
2 321 1 1 6 SER OG O 5.691 -1.588 -2.819 1.00 . A A . 6 SER OG 1 1
2 322 1 1 7 LYS C C 8.670 2.223 -0.873 1.00 . A A . 7 LYS C 1 1
2 323 1 1 7 LYS CA C 8.293 1.408 0.359 1.00 . A A . 7 LYS CA 1 1
2 324 1 1 7 LYS CB C 9.364 1.550 1.450 1.00 . A A . 7 LYS CB 1 1
2 325 1 1 7 LYS CD C 10.168 0.904 3.768 1.00 . A A . 7 LYS CD 1 1
2 326 1 1 7 LYS CE C 10.204 2.328 4.318 1.00 . A A . 7 LYS CE 1 1
2 327 1 1 7 LYS CG C 9.085 0.726 2.704 1.00 . A A . 7 LYS CG 1 1
2 328 1 1 7 LYS H H 8.955 -0.531 -0.141 1.00 . A A . 7 LYS H 1 1
2 329 1 1 7 LYS HA H 7.339 1.749 0.733 1.00 . A A . 7 LYS HA 1 1
2 330 1 1 7 LYS HB2 H 10.315 1.239 1.045 1.00 . A A . 7 LYS HB2 1 1
2 331 1 1 7 LYS HB3 H 9.426 2.591 1.732 1.00 . A A . 7 LYS HB3 1 1
2 332 1 1 7 LYS HD2 H 9.965 0.224 4.583 1.00 . A A . 7 LYS HD2 1 1
2 333 1 1 7 LYS HD3 H 11.128 0.667 3.335 1.00 . A A . 7 LYS HD3 1 1
2 334 1 1 7 LYS HE2 H 10.431 3.008 3.512 1.00 . A A . 7 LYS HE2 1 1
2 335 1 1 7 LYS HE3 H 9.233 2.571 4.724 1.00 . A A . 7 LYS HE3 1 1
2 336 1 1 7 LYS HG2 H 8.137 1.033 3.118 1.00 . A A . 7 LYS HG2 1 1
2 337 1 1 7 LYS HG3 H 9.032 -0.317 2.426 1.00 . A A . 7 LYS HG3 1 1
2 338 1 1 7 LYS HZ1 H 11.187 3.462 5.755 1.00 . A A . 7 LYS HZ1 1 1
2 339 1 1 7 LYS HZ2 H 12.180 2.358 4.988 1.00 . A A . 7 LYS HZ2 1 1
2 340 1 1 7 LYS HZ3 H 11.091 1.830 6.162 1.00 . A A . 7 LYS HZ3 1 1
2 341 1 1 7 LYS N N 8.153 0.026 -0.043 1.00 . A A . 7 LYS N 1 1
2 342 1 1 7 LYS NZ N 11.226 2.496 5.371 1.00 . A A . 7 LYS NZ 1 1
2 343 1 1 7 LYS O O 9.468 1.740 -1.696 1.00 . A A . 7 LYS O 1 1
2 344 1 1 8 PRO C C 5.858 3.461 0.028 1.00 . A A . 8 PRO C 1 1
2 345 1 1 8 PRO CA C 7.233 4.141 -0.098 1.00 . A A . 8 PRO CA 1 1
2 346 1 1 8 PRO CB C 7.069 5.543 -0.708 1.00 . A A . 8 PRO CB 1 1
2 347 1 1 8 PRO CD C 8.409 4.305 -2.215 1.00 . A A . 8 PRO CD 1 1
2 348 1 1 8 PRO CG C 8.201 5.673 -1.663 1.00 . A A . 8 PRO CG 1 1
2 349 1 1 8 PRO HA H 7.685 4.224 0.879 1.00 . A A . 8 PRO HA 1 1
2 350 1 1 8 PRO HB2 H 6.114 5.602 -1.213 1.00 . A A . 8 PRO HB2 1 1
2 351 1 1 8 PRO HB3 H 7.117 6.291 0.068 1.00 . A A . 8 PRO HB3 1 1
2 352 1 1 8 PRO HD2 H 7.707 4.103 -3.010 1.00 . A A . 8 PRO HD2 1 1
2 353 1 1 8 PRO HD3 H 9.424 4.178 -2.562 1.00 . A A . 8 PRO HD3 1 1
2 354 1 1 8 PRO HG2 H 7.944 6.366 -2.452 1.00 . A A . 8 PRO HG2 1 1
2 355 1 1 8 PRO HG3 H 9.086 6.008 -1.143 1.00 . A A . 8 PRO HG3 1 1
2 356 1 1 8 PRO N N 8.146 3.456 -1.049 1.00 . A A . 8 PRO N 1 1
2 357 1 1 8 PRO O O 5.294 2.981 -0.965 1.00 . A A . 8 PRO O 1 1
2 358 1 1 9 PRO C C 2.827 3.508 0.990 1.00 . A A . 9 PRO C 1 1
2 359 1 1 9 PRO CA C 4.045 2.748 1.542 1.00 . A A . 9 PRO CA 1 1
2 360 1 1 9 PRO CB C 4.002 2.722 3.073 1.00 . A A . 9 PRO CB 1 1
2 361 1 1 9 PRO CD C 5.936 3.969 2.479 1.00 . A A . 9 PRO CD 1 1
2 362 1 1 9 PRO CG C 4.845 3.867 3.495 1.00 . A A . 9 PRO CG 1 1
2 363 1 1 9 PRO HA H 4.025 1.738 1.165 1.00 . A A . 9 PRO HA 1 1
2 364 1 1 9 PRO HB2 H 2.981 2.838 3.406 1.00 . A A . 9 PRO HB2 1 1
2 365 1 1 9 PRO HB3 H 4.396 1.789 3.445 1.00 . A A . 9 PRO HB3 1 1
2 366 1 1 9 PRO HD2 H 6.212 5.001 2.329 1.00 . A A . 9 PRO HD2 1 1
2 367 1 1 9 PRO HD3 H 6.792 3.387 2.784 1.00 . A A . 9 PRO HD3 1 1
2 368 1 1 9 PRO HG2 H 4.258 4.773 3.507 1.00 . A A . 9 PRO HG2 1 1
2 369 1 1 9 PRO HG3 H 5.257 3.673 4.474 1.00 . A A . 9 PRO HG3 1 1
2 370 1 1 9 PRO N N 5.324 3.403 1.253 1.00 . A A . 9 PRO N 1 1
2 371 1 1 9 PRO O O 2.481 4.604 1.465 1.00 . A A . 9 PRO O 1 1
2 372 1 1 10 ILE C C -0.150 2.602 -0.207 1.00 . A A . 10 ILE C 1 1
2 373 1 1 10 ILE CA C 1.001 3.522 -0.577 1.00 . A A . 10 ILE CA 1 1
2 374 1 1 10 ILE CB C 1.092 3.674 -2.125 1.00 . A A . 10 ILE CB 1 1
2 375 1 1 10 ILE CD1 C 2.492 4.761 -3.984 1.00 . A A . 10 ILE CD1 1 1
2 376 1 1 10 ILE CG1 C 2.289 4.568 -2.496 1.00 . A A . 10 ILE CG1 1 1
2 377 1 1 10 ILE CG2 C -0.213 4.253 -2.691 1.00 . A A . 10 ILE CG2 1 1
2 378 1 1 10 ILE H H 2.569 2.128 -0.404 1.00 . A A . 10 ILE H 1 1
2 379 1 1 10 ILE HA H 0.845 4.489 -0.122 1.00 . A A . 10 ILE HA 1 1
2 380 1 1 10 ILE HB H 1.241 2.694 -2.553 1.00 . A A . 10 ILE HB 1 1
2 381 1 1 10 ILE HD11 H 1.611 5.214 -4.409 1.00 . A A . 10 ILE HD11 1 1
2 382 1 1 10 ILE HD12 H 2.663 3.801 -4.447 1.00 . A A . 10 ILE HD12 1 1
2 383 1 1 10 ILE HD13 H 3.346 5.401 -4.152 1.00 . A A . 10 ILE HD13 1 1
2 384 1 1 10 ILE HG12 H 2.145 5.545 -2.061 1.00 . A A . 10 ILE HG12 1 1
2 385 1 1 10 ILE HG13 H 3.190 4.133 -2.089 1.00 . A A . 10 ILE HG13 1 1
2 386 1 1 10 ILE HG21 H -1.034 3.593 -2.450 1.00 . A A . 10 ILE HG21 1 1
2 387 1 1 10 ILE HG22 H -0.131 4.346 -3.765 1.00 . A A . 10 ILE HG22 1 1
2 388 1 1 10 ILE HG23 H -0.394 5.225 -2.259 1.00 . A A . 10 ILE HG23 1 1
2 389 1 1 10 ILE N N 2.211 2.957 -0.020 1.00 . A A . 10 ILE N 1 1
2 390 1 1 10 ILE O O -0.097 1.395 -0.495 1.00 . A A . 10 ILE O 1 1
2 391 1 1 11 ALA C C -3.571 2.987 0.611 1.00 . A A . 11 ALA C 1 1
2 392 1 1 11 ALA CA C -2.254 2.317 0.915 1.00 . A A . 11 ALA CA 1 1
2 393 1 1 11 ALA CB C -2.214 2.023 2.437 1.00 . A A . 11 ALA CB 1 1
2 394 1 1 11 ALA H H -1.161 4.093 0.668 1.00 . A A . 11 ALA H 1 1
2 395 1 1 11 ALA HA H -2.210 1.376 0.388 1.00 . A A . 11 ALA HA 1 1
2 396 1 1 11 ALA HB1 H -3.041 1.373 2.680 1.00 . A A . 11 ALA HB1 1 1
2 397 1 1 11 ALA HB2 H -2.351 2.955 2.963 1.00 . A A . 11 ALA HB2 1 1
2 398 1 1 11 ALA N N -1.147 3.131 0.472 1.00 . A A . 11 ALA N 1 1
2 399 1 1 11 ALA O O -3.654 4.220 0.501 1.00 . A A . 11 ALA O 1 1
2 400 1 1 12 PHE C C -6.736 2.000 1.443 1.00 . A A . 12 PHE C 1 1
2 401 1 1 12 PHE CA C -5.929 2.611 0.305 1.00 . A A . 12 PHE CA 1 1
2 402 1 1 12 PHE CB C -6.485 2.161 -1.046 1.00 . A A . 12 PHE CB 1 1
2 403 1 1 12 PHE CD1 C -4.782 2.016 -2.891 1.00 . A A . 12 PHE CD1 1 1
2 404 1 1 12 PHE CD2 C -6.093 3.996 -2.704 1.00 . A A . 12 PHE CD2 1 1
2 405 1 1 12 PHE CE1 C -4.133 2.547 -3.986 1.00 . A A . 12 PHE CE1 1 1
2 406 1 1 12 PHE CE2 C -5.448 4.530 -3.798 1.00 . A A . 12 PHE CE2 1 1
2 407 1 1 12 PHE CG C -5.771 2.736 -2.237 1.00 . A A . 12 PHE CG 1 1
2 408 1 1 12 PHE CZ C -4.467 3.805 -4.440 1.00 . A A . 12 PHE CZ 1 1
2 409 1 1 12 PHE H H -4.392 1.211 0.473 1.00 . A A . 12 PHE H 1 1
2 410 1 1 12 PHE HA H -5.933 3.687 0.367 1.00 . A A . 12 PHE HA 1 1
2 411 1 1 12 PHE HB2 H -6.424 1.086 -1.110 1.00 . A A . 12 PHE HB2 1 1
2 412 1 1 12 PHE HB3 H -7.524 2.451 -1.107 1.00 . A A . 12 PHE HB3 1 1
2 413 1 1 12 PHE HD1 H -4.521 1.030 -2.533 1.00 . A A . 12 PHE HD1 1 1
2 414 1 1 12 PHE HD2 H -6.863 4.567 -2.205 1.00 . A A . 12 PHE HD2 1 1
2 415 1 1 12 PHE HE1 H -3.365 1.982 -4.491 1.00 . A A . 12 PHE HE1 1 1
2 416 1 1 12 PHE HE2 H -5.709 5.516 -4.153 1.00 . A A . 12 PHE HE2 1 1
2 417 1 1 12 PHE HZ H -3.964 4.226 -5.297 1.00 . A A . 12 PHE HZ 1 1
2 418 1 1 12 PHE N N -4.575 2.178 0.471 1.00 . A A . 12 PHE N 1 1
2 419 1 1 12 PHE O O -6.619 0.784 1.694 1.00 . A A . 12 PHE O 1 1
2 420 1 1 13 PRO C C -9.279 1.197 3.140 1.00 . A A . 13 PRO C 1 1
2 421 1 1 13 PRO CA C -8.316 2.374 3.360 1.00 . A A . 13 PRO CA 1 1
2 422 1 1 13 PRO CB C -9.099 3.623 3.769 1.00 . A A . 13 PRO CB 1 1
2 423 1 1 13 PRO CD C -7.822 4.235 1.857 1.00 . A A . 13 PRO CD 1 1
2 424 1 1 13 PRO CG C -8.357 4.754 3.157 1.00 . A A . 13 PRO CG 1 1
2 425 1 1 13 PRO HA H -7.636 2.112 4.158 1.00 . A A . 13 PRO HA 1 1
2 426 1 1 13 PRO HB2 H -10.104 3.550 3.383 1.00 . A A . 13 PRO HB2 1 1
2 427 1 1 13 PRO HB3 H -9.127 3.703 4.846 1.00 . A A . 13 PRO HB3 1 1
2 428 1 1 13 PRO HD2 H -8.557 4.346 1.074 1.00 . A A . 13 PRO HD2 1 1
2 429 1 1 13 PRO HD3 H -6.913 4.757 1.609 1.00 . A A . 13 PRO HD3 1 1
2 430 1 1 13 PRO HG2 H -9.027 5.584 2.984 1.00 . A A . 13 PRO HG2 1 1
2 431 1 1 13 PRO HG3 H -7.545 5.054 3.803 1.00 . A A . 13 PRO HG3 1 1
2 432 1 1 13 PRO N N -7.561 2.809 2.153 1.00 . A A . 13 PRO N 1 1
2 433 1 1 13 PRO O O -9.774 0.613 4.100 1.00 . A A . 13 PRO O 1 1
2 434 1 1 14 ASP C C -9.693 -1.594 1.790 1.00 . A A . 14 ASP C 1 1
2 435 1 1 14 ASP CA C -10.419 -0.279 1.583 1.00 . A A . 14 ASP CA 1 1
2 436 1 1 14 ASP CB C -10.990 -0.199 0.157 1.00 . A A . 14 ASP CB 1 1
2 437 1 1 14 ASP CG C -9.929 -0.139 -0.904 1.00 . A A . 14 ASP CG 1 1
2 438 1 1 14 ASP H H -9.139 1.367 1.163 1.00 . A A . 14 ASP H 1 1
2 439 1 1 14 ASP HA H -11.237 -0.243 2.289 1.00 . A A . 14 ASP HA 1 1
2 440 1 1 14 ASP HB2 H -11.591 -1.077 -0.028 1.00 . A A . 14 ASP HB2 1 1
2 441 1 1 14 ASP HB3 H -11.617 0.675 0.067 1.00 . A A . 14 ASP HB3 1 1
2 442 1 1 14 ASP N N -9.544 0.854 1.895 1.00 . A A . 14 ASP N 1 1
2 443 1 1 14 ASP O O -10.307 -2.651 1.834 1.00 . A A . 14 ASP O 1 1
2 444 1 1 14 ASP OD1 O -9.582 -1.186 -1.488 1.00 . A A . 14 ASP OD1 1 1
2 445 1 1 14 ASP OD2 O -9.415 0.966 -1.167 1.00 . A A . 14 ASP OD2 1 1
2 446 2 2 1 . C C -1.653 -0.946 3.305 1.00 . B A . 101 WMH C 1 1
2 447 2 2 1 . C1 C -0.936 1.408 2.978 1.00 . B A . 101 WMH C1 1 1
2 448 2 2 1 . C2 C 0.232 2.055 3.161 1.00 . B A . 101 WMH C2 1 1
2 449 2 2 1 . H1 H -1.762 -1.360 4.297 1.00 . B A . 101 WMH H1 1 1
2 450 2 2 1 . H2 H -2.609 -0.573 2.970 1.00 . B A . 101 WMH H2 1 1
2 451 2 2 1 . H5 H 0.407 3.100 2.953 1.00 . B A . 101 WMH H5 1 1
2 452 2 2 1 . N N -0.742 0.127 3.347 1.00 . B A . 101 WMH N 1 1
2 453 2 2 1 . N1 N 1.127 1.206 3.634 1.00 . B A . 101 WMH N1 1 1
2 454 2 2 1 . N2 N 0.600 0.045 3.765 1.00 . B A . 101 WMH N2 1 1
3 455 1 1 1 GLY C C -6.602 -2.941 1.504 1.00 . A A . 1 GLY C 1 1
3 456 1 1 1 GLY CA C -7.639 -2.448 2.456 1.00 . A A . 1 GLY CA 1 1
3 457 1 1 1 GLY H1 H -7.943 -0.463 1.811 1.00 . A A . 1 GLY H1 1 1
3 458 1 1 1 GLY HA2 H -7.160 -2.122 3.368 1.00 . A A . 1 GLY HA2 1 1
3 459 1 1 1 GLY HA3 H -8.324 -3.254 2.677 1.00 . A A . 1 GLY HA3 1 1
3 460 1 1 1 GLY N N -8.366 -1.349 1.881 1.00 . A A . 1 GLY N 1 1
3 461 1 1 1 GLY O O -6.449 -4.144 1.303 1.00 . A A . 1 GLY O 1 1
3 462 1 1 2 ARG C C -3.619 -1.597 0.296 1.00 . A A . 2 ARG C 1 1
3 463 1 1 2 ARG CA C -4.884 -2.332 -0.083 1.00 . A A . 2 ARG CA 1 1
3 464 1 1 2 ARG CB C -5.325 -1.915 -1.498 1.00 . A A . 2 ARG CB 1 1
3 465 1 1 2 ARG CD C -7.098 -1.996 -3.293 1.00 . A A . 2 ARG CD 1 1
3 466 1 1 2 ARG CG C -6.682 -2.458 -1.907 1.00 . A A . 2 ARG CG 1 1
3 467 1 1 2 ARG CZ C -9.031 -2.485 -4.795 1.00 . A A . 2 ARG CZ 1 1
3 468 1 1 2 ARG H H -6.070 -1.067 1.111 1.00 . A A . 2 ARG H 1 1
3 469 1 1 2 ARG HA H -4.709 -3.399 -0.059 1.00 . A A . 2 ARG HA 1 1
3 470 1 1 2 ARG HB2 H -5.367 -0.837 -1.537 1.00 . A A . 2 ARG HB2 1 1
3 471 1 1 2 ARG HB3 H -4.590 -2.261 -2.209 1.00 . A A . 2 ARG HB3 1 1
3 472 1 1 2 ARG HD2 H -7.021 -0.920 -3.338 1.00 . A A . 2 ARG HD2 1 1
3 473 1 1 2 ARG HD3 H -6.438 -2.439 -4.025 1.00 . A A . 2 ARG HD3 1 1
3 474 1 1 2 ARG HE H -9.028 -2.629 -2.794 1.00 . A A . 2 ARG HE 1 1
3 475 1 1 2 ARG HG2 H -6.635 -3.537 -1.902 1.00 . A A . 2 ARG HG2 1 1
3 476 1 1 2 ARG HG3 H -7.418 -2.129 -1.188 1.00 . A A . 2 ARG HG3 1 1
3 477 1 1 2 ARG HH11 H -7.438 -1.718 -5.835 1.00 . A A . 2 ARG HH11 1 1
3 478 1 1 2 ARG HH12 H -8.759 -2.163 -6.793 1.00 . A A . 2 ARG HH12 1 1
3 479 1 1 2 ARG HH21 H -10.819 -3.196 -4.111 1.00 . A A . 2 ARG HH21 1 1
3 480 1 1 2 ARG HH22 H -10.732 -3.015 -5.801 1.00 . A A . 2 ARG HH22 1 1
3 481 1 1 2 ARG N N -5.907 -2.010 0.888 1.00 . A A . 2 ARG N 1 1
3 482 1 1 2 ARG NE N -8.477 -2.399 -3.587 1.00 . A A . 2 ARG NE 1 1
3 483 1 1 2 ARG NH1 N -8.367 -2.095 -5.871 1.00 . A A . 2 ARG NH1 1 1
3 484 1 1 2 ARG NH2 N -10.278 -2.926 -4.910 1.00 . A A . 2 ARG NH2 1 1
3 485 1 1 2 ARG O O -3.513 -0.397 0.090 1.00 . A A . 2 ARG O 1 1
3 486 1 1 3 ALA C C -0.315 -2.251 0.532 1.00 . A A . 3 ALA C 1 1
3 487 1 1 3 ALA CA C -1.462 -1.715 1.339 1.00 . A A . 3 ALA CA 1 1
3 488 1 1 3 ALA CB C -1.235 -1.995 2.820 1.00 . A A . 3 ALA CB 1 1
3 489 1 1 3 ALA H H -2.876 -3.242 1.075 1.00 . A A . 3 ALA H 1 1
3 490 1 1 3 ALA HA H -1.516 -0.646 1.201 1.00 . A A . 3 ALA HA 1 1
3 491 1 1 3 ALA HB1 H -0.171 -2.071 2.986 1.00 . A A . 3 ALA HB1 1 1
3 492 1 1 3 ALA HB2 H -1.694 -2.940 3.068 1.00 . A A . 3 ALA HB2 1 1
3 493 1 1 3 ALA N N -2.716 -2.288 0.906 1.00 . A A . 3 ALA N 1 1
3 494 1 1 3 ALA O O -0.251 -3.448 0.247 1.00 . A A . 3 ALA O 1 1
3 495 1 1 4 TYR C C 2.855 -2.038 0.395 1.00 . A A . 4 TYR C 1 1
3 496 1 1 4 TYR CA C 1.746 -1.751 -0.586 1.00 . A A . 4 TYR CA 1 1
3 497 1 1 4 TYR CB C 2.169 -0.664 -1.584 1.00 . A A . 4 TYR CB 1 1
3 498 1 1 4 TYR CD1 C 0.128 0.367 -2.635 1.00 . A A . 4 TYR CD1 1 1
3 499 1 1 4 TYR CD2 C 1.388 -1.171 -3.927 1.00 . A A . 4 TYR CD2 1 1
3 500 1 1 4 TYR CE1 C -0.748 0.536 -3.668 1.00 . A A . 4 TYR CE1 1 1
3 501 1 1 4 TYR CE2 C 0.511 -1.008 -4.976 1.00 . A A . 4 TYR CE2 1 1
3 502 1 1 4 TYR CG C 1.210 -0.485 -2.738 1.00 . A A . 4 TYR CG 1 1
3 503 1 1 4 TYR CZ C -0.556 -0.151 -4.838 1.00 . A A . 4 TYR CZ 1 1
3 504 1 1 4 TYR H H 0.401 -0.420 0.312 1.00 . A A . 4 TYR H 1 1
3 505 1 1 4 TYR HA H 1.525 -2.659 -1.129 1.00 . A A . 4 TYR HA 1 1
3 506 1 1 4 TYR HB2 H 2.220 0.286 -1.070 1.00 . A A . 4 TYR HB2 1 1
3 507 1 1 4 TYR HB3 H 3.142 -0.903 -1.989 1.00 . A A . 4 TYR HB3 1 1
3 508 1 1 4 TYR HD1 H -0.023 0.903 -1.709 1.00 . A A . 4 TYR HD1 1 1
3 509 1 1 4 TYR HD2 H 2.228 -1.843 -4.031 1.00 . A A . 4 TYR HD2 1 1
3 510 1 1 4 TYR HE1 H -1.582 1.210 -3.551 1.00 . A A . 4 TYR HE1 1 1
3 511 1 1 4 TYR HE2 H 0.676 -1.554 -5.892 1.00 . A A . 4 TYR HE2 1 1
3 512 1 1 4 TYR HH H -1.747 -0.848 -6.167 1.00 . A A . 4 TYR HH 1 1
3 513 1 1 4 TYR N N 0.556 -1.373 0.129 1.00 . A A . 4 TYR N 1 1
3 514 1 1 4 TYR O O 2.982 -1.359 1.430 1.00 . A A . 4 TYR O 1 1
3 515 1 1 4 TYR OH O -1.437 0.016 -5.868 1.00 . A A . 4 TYR OH 1 1
3 516 1 1 5 LYS C C 5.972 -2.756 0.496 1.00 . A A . 5 LYS C 1 1
3 517 1 1 5 LYS CA C 4.716 -3.449 0.949 1.00 . A A . 5 LYS CA 1 1
3 518 1 1 5 LYS CB C 4.882 -4.962 0.891 1.00 . A A . 5 LYS CB 1 1
3 519 1 1 5 LYS CD C 3.774 -7.191 1.135 1.00 . A A . 5 LYS CD 1 1
3 520 1 1 5 LYS CE C 2.473 -7.906 1.456 1.00 . A A . 5 LYS CE 1 1
3 521 1 1 5 LYS CG C 3.617 -5.701 1.268 1.00 . A A . 5 LYS CG 1 1
3 522 1 1 5 LYS H H 3.472 -3.533 -0.737 1.00 . A A . 5 LYS H 1 1
3 523 1 1 5 LYS HA H 4.486 -3.153 1.961 1.00 . A A . 5 LYS HA 1 1
3 524 1 1 5 LYS HB2 H 5.162 -5.247 -0.112 1.00 . A A . 5 LYS HB2 1 1
3 525 1 1 5 LYS HB3 H 5.665 -5.257 1.573 1.00 . A A . 5 LYS HB3 1 1
3 526 1 1 5 LYS HD2 H 4.060 -7.414 0.119 1.00 . A A . 5 LYS HD2 1 1
3 527 1 1 5 LYS HD3 H 4.543 -7.527 1.814 1.00 . A A . 5 LYS HD3 1 1
3 528 1 1 5 LYS HE2 H 1.717 -7.577 0.758 1.00 . A A . 5 LYS HE2 1 1
3 529 1 1 5 LYS HE3 H 2.623 -8.968 1.341 1.00 . A A . 5 LYS HE3 1 1
3 530 1 1 5 LYS HG2 H 3.384 -5.473 2.298 1.00 . A A . 5 LYS HG2 1 1
3 531 1 1 5 LYS HG3 H 2.812 -5.367 0.631 1.00 . A A . 5 LYS HG3 1 1
3 532 1 1 5 LYS HZ1 H 1.849 -6.608 2.979 1.00 . A A . 5 LYS HZ1 1 1
3 533 1 1 5 LYS HZ2 H 2.712 -7.940 3.535 1.00 . A A . 5 LYS HZ2 1 1
3 534 1 1 5 LYS HZ3 H 1.120 -8.119 3.042 1.00 . A A . 5 LYS HZ3 1 1
3 535 1 1 5 LYS N N 3.626 -3.042 0.099 1.00 . A A . 5 LYS N 1 1
3 536 1 1 5 LYS NZ N 2.012 -7.626 2.834 1.00 . A A . 5 LYS NZ 1 1
3 537 1 1 5 LYS O O 6.758 -2.272 1.305 1.00 . A A . 5 LYS O 1 1
3 538 1 1 6 SER C C 7.122 -0.540 -1.111 1.00 . A A . 6 SER C 1 1
3 539 1 1 6 SER CA C 7.247 -2.025 -1.401 1.00 . A A . 6 SER CA 1 1
3 540 1 1 6 SER CB C 7.257 -2.318 -2.893 1.00 . A A . 6 SER CB 1 1
3 541 1 1 6 SER H H 5.498 -3.132 -1.394 1.00 . A A . 6 SER H 1 1
3 542 1 1 6 SER HA H 8.153 -2.403 -0.955 1.00 . A A . 6 SER HA 1 1
3 543 1 1 6 SER HB2 H 6.370 -1.900 -3.348 1.00 . A A . 6 SER HB2 1 1
3 544 1 1 6 SER HB3 H 8.138 -1.883 -3.338 1.00 . A A . 6 SER HB3 1 1
3 545 1 1 6 SER HG H 7.735 -3.873 -3.957 1.00 . A A . 6 SER HG 1 1
3 546 1 1 6 SER N N 6.146 -2.701 -0.801 1.00 . A A . 6 SER N 1 1
3 547 1 1 6 SER O O 6.068 0.061 -1.335 1.00 . A A . 6 SER O 1 1
3 548 1 1 6 SER OG O 7.277 -3.730 -3.119 1.00 . A A . 6 SER OG 1 1
3 549 1 1 7 LYS C C 8.238 2.359 -1.304 1.00 . A A . 7 LYS C 1 1
3 550 1 1 7 LYS CA C 8.175 1.395 -0.119 1.00 . A A . 7 LYS CA 1 1
3 551 1 1 7 LYS CB C 9.363 1.614 0.824 1.00 . A A . 7 LYS CB 1 1
3 552 1 1 7 LYS CD C 8.223 0.446 2.766 1.00 . A A . 7 LYS CD 1 1
3 553 1 1 7 LYS CE C 8.357 -0.635 3.827 1.00 . A A . 7 LYS CE 1 1
3 554 1 1 7 LYS CG C 9.481 0.554 1.922 1.00 . A A . 7 LYS CG 1 1
3 555 1 1 7 LYS H H 8.993 -0.508 -0.493 1.00 . A A . 7 LYS H 1 1
3 556 1 1 7 LYS HA H 7.261 1.572 0.427 1.00 . A A . 7 LYS HA 1 1
3 557 1 1 7 LYS HB2 H 10.271 1.603 0.242 1.00 . A A . 7 LYS HB2 1 1
3 558 1 1 7 LYS HB3 H 9.261 2.580 1.295 1.00 . A A . 7 LYS HB3 1 1
3 559 1 1 7 LYS HD2 H 8.049 1.392 3.257 1.00 . A A . 7 LYS HD2 1 1
3 560 1 1 7 LYS HD3 H 7.386 0.209 2.127 1.00 . A A . 7 LYS HD3 1 1
3 561 1 1 7 LYS HE2 H 9.184 -0.379 4.469 1.00 . A A . 7 LYS HE2 1 1
3 562 1 1 7 LYS HE3 H 7.448 -0.664 4.410 1.00 . A A . 7 LYS HE3 1 1
3 563 1 1 7 LYS HG2 H 9.661 -0.405 1.460 1.00 . A A . 7 LYS HG2 1 1
3 564 1 1 7 LYS HG3 H 10.313 0.801 2.562 1.00 . A A . 7 LYS HG3 1 1
3 565 1 1 7 LYS HZ1 H 8.595 -2.708 3.980 1.00 . A A . 7 LYS HZ1 1 1
3 566 1 1 7 LYS HZ2 H 9.530 -2.040 2.767 1.00 . A A . 7 LYS HZ2 1 1
3 567 1 1 7 LYS HZ3 H 7.864 -2.222 2.552 1.00 . A A . 7 LYS HZ3 1 1
3 568 1 1 7 LYS N N 8.172 0.024 -0.577 1.00 . A A . 7 LYS N 1 1
3 569 1 1 7 LYS NZ N 8.607 -1.978 3.242 1.00 . A A . 7 LYS NZ 1 1
3 570 1 1 7 LYS O O 8.889 2.049 -2.313 1.00 . A A . 7 LYS O 1 1
3 571 1 1 8 PRO C C 5.537 3.212 0.187 1.00 . A A . 8 PRO C 1 1
3 572 1 1 8 PRO CA C 6.844 3.992 -0.023 1.00 . A A . 8 PRO CA 1 1
3 573 1 1 8 PRO CB C 6.540 5.465 -0.326 1.00 . A A . 8 PRO CB 1 1
3 574 1 1 8 PRO CD C 7.543 4.550 -2.298 1.00 . A A . 8 PRO CD 1 1
3 575 1 1 8 PRO CG C 6.533 5.554 -1.813 1.00 . A A . 8 PRO CG 1 1
3 576 1 1 8 PRO HA H 7.451 3.920 0.868 1.00 . A A . 8 PRO HA 1 1
3 577 1 1 8 PRO HB2 H 5.578 5.725 0.092 1.00 . A A . 8 PRO HB2 1 1
3 578 1 1 8 PRO HB3 H 7.306 6.091 0.105 1.00 . A A . 8 PRO HB3 1 1
3 579 1 1 8 PRO HD2 H 7.216 4.101 -3.225 1.00 . A A . 8 PRO HD2 1 1
3 580 1 1 8 PRO HD3 H 8.508 5.017 -2.427 1.00 . A A . 8 PRO HD3 1 1
3 581 1 1 8 PRO HG2 H 5.550 5.306 -2.186 1.00 . A A . 8 PRO HG2 1 1
3 582 1 1 8 PRO HG3 H 6.812 6.548 -2.123 1.00 . A A . 8 PRO HG3 1 1
3 583 1 1 8 PRO N N 7.592 3.543 -1.218 1.00 . A A . 8 PRO N 1 1
3 584 1 1 8 PRO O O 4.871 2.828 -0.786 1.00 . A A . 8 PRO O 1 1
3 585 1 1 9 PRO C C 2.706 3.046 1.504 1.00 . A A . 9 PRO C 1 1
3 586 1 1 9 PRO CA C 3.960 2.214 1.759 1.00 . A A . 9 PRO CA 1 1
3 587 1 1 9 PRO CB C 4.111 1.852 3.238 1.00 . A A . 9 PRO CB 1 1
3 588 1 1 9 PRO CD C 5.865 3.401 2.667 1.00 . A A . 9 PRO CD 1 1
3 589 1 1 9 PRO CG C 5.011 2.898 3.802 1.00 . A A . 9 PRO CG 1 1
3 590 1 1 9 PRO HA H 3.904 1.315 1.162 1.00 . A A . 9 PRO HA 1 1
3 591 1 1 9 PRO HB2 H 3.140 1.865 3.712 1.00 . A A . 9 PRO HB2 1 1
3 592 1 1 9 PRO HB3 H 4.547 0.869 3.328 1.00 . A A . 9 PRO HB3 1 1
3 593 1 1 9 PRO HD2 H 5.921 4.479 2.693 1.00 . A A . 9 PRO HD2 1 1
3 594 1 1 9 PRO HD3 H 6.855 2.973 2.719 1.00 . A A . 9 PRO HD3 1 1
3 595 1 1 9 PRO HG2 H 4.421 3.706 4.209 1.00 . A A . 9 PRO HG2 1 1
3 596 1 1 9 PRO HG3 H 5.632 2.468 4.574 1.00 . A A . 9 PRO HG3 1 1
3 597 1 1 9 PRO N N 5.162 2.955 1.448 1.00 . A A . 9 PRO N 1 1
3 598 1 1 9 PRO O O 2.313 3.911 2.302 1.00 . A A . 9 PRO O 1 1
3 599 1 1 10 ILE C C -0.190 2.586 0.346 1.00 . A A . 10 ILE C 1 1
3 600 1 1 10 ILE CA C 0.943 3.504 -0.040 1.00 . A A . 10 ILE CA 1 1
3 601 1 1 10 ILE CB C 0.922 3.745 -1.584 1.00 . A A . 10 ILE CB 1 1
3 602 1 1 10 ILE CD1 C 2.311 5.906 -1.365 1.00 . A A . 10 ILE CD1 1 1
3 603 1 1 10 ILE CG1 C 2.156 4.555 -2.040 1.00 . A A . 10 ILE CG1 1 1
3 604 1 1 10 ILE CG2 C -0.371 4.419 -2.033 1.00 . A A . 10 ILE CG2 1 1
3 605 1 1 10 ILE H H 2.584 2.226 -0.267 1.00 . A A . 10 ILE H 1 1
3 606 1 1 10 ILE HA H 0.856 4.447 0.477 1.00 . A A . 10 ILE HA 1 1
3 607 1 1 10 ILE HB H 0.957 2.776 -2.059 1.00 . A A . 10 ILE HB 1 1
3 608 1 1 10 ILE HD11 H 3.179 6.411 -1.762 1.00 . A A . 10 ILE HD11 1 1
3 609 1 1 10 ILE HD12 H 2.437 5.766 -0.302 1.00 . A A . 10 ILE HD12 1 1
3 610 1 1 10 ILE HD13 H 1.430 6.501 -1.549 1.00 . A A . 10 ILE HD13 1 1
3 611 1 1 10 ILE HG12 H 3.048 3.985 -1.827 1.00 . A A . 10 ILE HG12 1 1
3 612 1 1 10 ILE HG13 H 2.091 4.720 -3.105 1.00 . A A . 10 ILE HG13 1 1
3 613 1 1 10 ILE HG21 H -0.344 4.567 -3.103 1.00 . A A . 10 ILE HG21 1 1
3 614 1 1 10 ILE HG22 H -0.473 5.372 -1.535 1.00 . A A . 10 ILE HG22 1 1
3 615 1 1 10 ILE HG23 H -1.205 3.781 -1.777 1.00 . A A . 10 ILE HG23 1 1
3 616 1 1 10 ILE N N 2.152 2.849 0.351 1.00 . A A . 10 ILE N 1 1
3 617 1 1 10 ILE O O -0.090 1.376 0.143 1.00 . A A . 10 ILE O 1 1
3 618 1 1 11 ALA C C -3.602 2.918 0.855 1.00 . A A . 11 ALA C 1 1
3 619 1 1 11 ALA CA C -2.330 2.278 1.316 1.00 . A A . 11 ALA CA 1 1
3 620 1 1 11 ALA CB C -2.425 2.010 2.844 1.00 . A A . 11 ALA CB 1 1
3 621 1 1 11 ALA H H -1.272 4.068 1.141 1.00 . A A . 11 ALA H 1 1
3 622 1 1 11 ALA HA H -2.215 1.333 0.804 1.00 . A A . 11 ALA HA 1 1
3 623 1 1 11 ALA HB1 H -3.246 1.333 3.024 1.00 . A A . 11 ALA HB1 1 1
3 624 1 1 11 ALA HB2 H -2.648 2.947 3.334 1.00 . A A . 11 ALA HB2 1 1
3 625 1 1 11 ALA N N -1.221 3.108 0.948 1.00 . A A . 11 ALA N 1 1
3 626 1 1 11 ALA O O -3.711 4.143 0.812 1.00 . A A . 11 ALA O 1 1
3 627 1 1 12 PHE C C -6.768 2.046 1.191 1.00 . A A . 12 PHE C 1 1
3 628 1 1 12 PHE CA C -5.832 2.553 0.115 1.00 . A A . 12 PHE CA 1 1
3 629 1 1 12 PHE CB C -6.290 2.026 -1.258 1.00 . A A . 12 PHE CB 1 1
3 630 1 1 12 PHE CD1 C -5.523 3.806 -2.849 1.00 . A A . 12 PHE CD1 1 1
3 631 1 1 12 PHE CD2 C -4.636 1.612 -3.113 1.00 . A A . 12 PHE CD2 1 1
3 632 1 1 12 PHE CE1 C -4.781 4.240 -3.925 1.00 . A A . 12 PHE CE1 1 1
3 633 1 1 12 PHE CE2 C -3.890 2.042 -4.193 1.00 . A A . 12 PHE CE2 1 1
3 634 1 1 12 PHE CG C -5.460 2.492 -2.426 1.00 . A A . 12 PHE CG 1 1
3 635 1 1 12 PHE CZ C -3.963 3.357 -4.599 1.00 . A A . 12 PHE CZ 1 1
3 636 1 1 12 PHE H H -4.289 1.155 0.379 1.00 . A A . 12 PHE H 1 1
3 637 1 1 12 PHE HA H -5.817 3.633 0.108 1.00 . A A . 12 PHE HA 1 1
3 638 1 1 12 PHE HB2 H -6.268 0.948 -1.244 1.00 . A A . 12 PHE HB2 1 1
3 639 1 1 12 PHE HB3 H -7.307 2.346 -1.425 1.00 . A A . 12 PHE HB3 1 1
3 640 1 1 12 PHE HD1 H -6.157 4.506 -2.325 1.00 . A A . 12 PHE HD1 1 1
3 641 1 1 12 PHE HD2 H -4.570 0.580 -2.802 1.00 . A A . 12 PHE HD2 1 1
3 642 1 1 12 PHE HE1 H -4.845 5.272 -4.239 1.00 . A A . 12 PHE HE1 1 1
3 643 1 1 12 PHE HE2 H -3.253 1.349 -4.722 1.00 . A A . 12 PHE HE2 1 1
3 644 1 1 12 PHE HZ H -3.380 3.700 -5.440 1.00 . A A . 12 PHE HZ 1 1
3 645 1 1 12 PHE N N -4.519 2.109 0.451 1.00 . A A . 12 PHE N 1 1
3 646 1 1 12 PHE O O -6.719 0.847 1.516 1.00 . A A . 12 PHE O 1 1
3 647 1 1 13 PRO C C -9.480 1.375 2.528 1.00 . A A . 13 PRO C 1 1
3 648 1 1 13 PRO CA C -8.598 2.604 2.833 1.00 . A A . 13 PRO CA 1 1
3 649 1 1 13 PRO CB C -9.473 3.856 2.960 1.00 . A A . 13 PRO CB 1 1
3 650 1 1 13 PRO CD C -7.614 4.382 1.492 1.00 . A A . 13 PRO CD 1 1
3 651 1 1 13 PRO CG C -8.949 4.858 1.977 1.00 . A A . 13 PRO CG 1 1
3 652 1 1 13 PRO HA H -8.093 2.430 3.773 1.00 . A A . 13 PRO HA 1 1
3 653 1 1 13 PRO HB2 H -10.497 3.591 2.736 1.00 . A A . 13 PRO HB2 1 1
3 654 1 1 13 PRO HB3 H -9.424 4.232 3.970 1.00 . A A . 13 PRO HB3 1 1
3 655 1 1 13 PRO HD2 H -7.529 4.566 0.432 1.00 . A A . 13 PRO HD2 1 1
3 656 1 1 13 PRO HD3 H -6.819 4.880 2.026 1.00 . A A . 13 PRO HD3 1 1
3 657 1 1 13 PRO HG2 H -9.624 4.939 1.140 1.00 . A A . 13 PRO HG2 1 1
3 658 1 1 13 PRO HG3 H -8.849 5.819 2.460 1.00 . A A . 13 PRO HG3 1 1
3 659 1 1 13 PRO N N -7.614 2.941 1.771 1.00 . A A . 13 PRO N 1 1
3 660 1 1 13 PRO O O -10.088 0.808 3.422 1.00 . A A . 13 PRO O 1 1
3 661 1 1 14 ASP C C -9.601 -1.492 1.454 1.00 . A A . 14 ASP C 1 1
3 662 1 1 14 ASP CA C -10.253 -0.233 0.852 1.00 . A A . 14 ASP CA 1 1
3 663 1 1 14 ASP CB C -10.266 -0.324 -0.685 1.00 . A A . 14 ASP CB 1 1
3 664 1 1 14 ASP CG C -10.938 -1.579 -1.213 1.00 . A A . 14 ASP CG 1 1
3 665 1 1 14 ASP H H -9.069 1.528 0.613 1.00 . A A . 14 ASP H 1 1
3 666 1 1 14 ASP HA H -11.269 -0.156 1.211 1.00 . A A . 14 ASP HA 1 1
3 667 1 1 14 ASP HB2 H -10.794 0.530 -1.085 1.00 . A A . 14 ASP HB2 1 1
3 668 1 1 14 ASP HB3 H -9.248 -0.303 -1.044 1.00 . A A . 14 ASP HB3 1 1
3 669 1 1 14 ASP N N -9.530 0.974 1.273 1.00 . A A . 14 ASP N 1 1
3 670 1 1 14 ASP O O -10.215 -2.558 1.547 1.00 . A A . 14 ASP O 1 1
3 671 1 1 14 ASP OD1 O -12.183 -1.629 -1.272 1.00 . A A . 14 ASP OD1 1 1
3 672 1 1 14 ASP OD2 O -10.235 -2.529 -1.601 1.00 . A A . 14 ASP OD2 1 1
3 673 2 2 1 . C C -1.786 -0.938 3.761 1.00 . B A . 101 WMH C 1 1
3 674 2 2 1 . C1 C -1.175 1.456 3.513 1.00 . B A . 101 WMH C1 1 1
3 675 2 2 1 . C2 C -0.071 2.164 3.828 1.00 . B A . 101 WMH C2 1 1
3 676 2 2 1 . H1 H -1.918 -1.385 4.735 1.00 . B A . 101 WMH H1 1 1
3 677 2 2 1 . H2 H -2.746 -0.602 3.397 1.00 . B A . 101 WMH H2 1 1
3 678 2 2 1 . H5 H 0.065 3.219 3.658 1.00 . B A . 101 WMH H5 1 1
3 679 2 2 1 . N N -0.943 0.180 3.883 1.00 . B A . 101 WMH N 1 1
3 680 2 2 1 . N1 N 0.819 1.361 4.378 1.00 . B A . 101 WMH N1 1 1
3 681 2 2 1 . N2 N 0.350 0.170 4.432 1.00 . B A . 101 WMH N2 1 1
4 682 1 1 1 GLY C C -6.640 -3.038 0.920 1.00 . A A . 1 GLY C 1 1
4 683 1 1 1 GLY CA C -7.719 -2.782 1.919 1.00 . A A . 1 GLY CA 1 1
4 684 1 1 1 GLY H1 H -8.152 -0.728 1.921 1.00 . A A . 1 GLY H1 1 1
4 685 1 1 1 GLY HA2 H -7.292 -2.666 2.903 1.00 . A A . 1 GLY HA2 1 1
4 686 1 1 1 GLY HA3 H -8.398 -3.621 1.922 1.00 . A A . 1 GLY HA3 1 1
4 687 1 1 1 GLY N N -8.437 -1.596 1.564 1.00 . A A . 1 GLY N 1 1
4 688 1 1 1 GLY O O -6.539 -4.137 0.358 1.00 . A A . 1 GLY O 1 1
4 689 1 1 2 ARG C C -3.562 -1.494 0.185 1.00 . A A . 2 ARG C 1 1
4 690 1 1 2 ARG CA C -4.828 -2.136 -0.339 1.00 . A A . 2 ARG CA 1 1
4 691 1 1 2 ARG CB C -5.278 -1.463 -1.623 1.00 . A A . 2 ARG CB 1 1
4 692 1 1 2 ARG CD C -5.052 -1.122 -4.097 1.00 . A A . 2 ARG CD 1 1
4 693 1 1 2 ARG CG C -4.476 -1.818 -2.865 1.00 . A A . 2 ARG CG 1 1
4 694 1 1 2 ARG CZ C -7.233 -1.515 -5.291 1.00 . A A . 2 ARG CZ 1 1
4 695 1 1 2 ARG H H -5.996 -1.163 1.107 1.00 . A A . 2 ARG H 1 1
4 696 1 1 2 ARG HA H -4.649 -3.183 -0.535 1.00 . A A . 2 ARG HA 1 1
4 697 1 1 2 ARG HB2 H -6.310 -1.730 -1.788 1.00 . A A . 2 ARG HB2 1 1
4 698 1 1 2 ARG HB3 H -5.216 -0.397 -1.475 1.00 . A A . 2 ARG HB3 1 1
4 699 1 1 2 ARG HD2 H -4.829 -0.067 -4.036 1.00 . A A . 2 ARG HD2 1 1
4 700 1 1 2 ARG HD3 H -4.592 -1.537 -4.981 1.00 . A A . 2 ARG HD3 1 1
4 701 1 1 2 ARG HE H -7.021 -1.200 -3.347 1.00 . A A . 2 ARG HE 1 1
4 702 1 1 2 ARG HG2 H -3.453 -1.500 -2.723 1.00 . A A . 2 ARG HG2 1 1
4 703 1 1 2 ARG HG3 H -4.507 -2.887 -3.014 1.00 . A A . 2 ARG HG3 1 1
4 704 1 1 2 ARG HH11 H -5.670 -1.692 -6.614 1.00 . A A . 2 ARG HH11 1 1
4 705 1 1 2 ARG HH12 H -7.229 -1.856 -7.286 1.00 . A A . 2 ARG HH12 1 1
4 706 1 1 2 ARG HH21 H -8.966 -1.440 -4.279 1.00 . A A . 2 ARG HH21 1 1
4 707 1 1 2 ARG HH22 H -9.153 -1.726 -5.965 1.00 . A A . 2 ARG HH22 1 1
4 708 1 1 2 ARG N N -5.865 -2.021 0.641 1.00 . A A . 2 ARG N 1 1
4 709 1 1 2 ARG NE N -6.515 -1.296 -4.188 1.00 . A A . 2 ARG NE 1 1
4 710 1 1 2 ARG NH1 N -6.660 -1.699 -6.473 1.00 . A A . 2 ARG NH1 1 1
4 711 1 1 2 ARG NH2 N -8.541 -1.564 -5.185 1.00 . A A . 2 ARG NH2 1 1
4 712 1 1 2 ARG O O -3.409 -0.277 0.150 1.00 . A A . 2 ARG O 1 1
4 713 1 1 3 ALA C C -0.295 -2.203 0.352 1.00 . A A . 3 ALA C 1 1
4 714 1 1 3 ALA CA C -1.441 -1.843 1.230 1.00 . A A . 3 ALA CA 1 1
4 715 1 1 3 ALA CB C -1.202 -2.406 2.639 1.00 . A A . 3 ALA CB 1 1
4 716 1 1 3 ALA H H -2.888 -3.261 0.722 1.00 . A A . 3 ALA H 1 1
4 717 1 1 3 ALA HA H -1.488 -0.768 1.313 1.00 . A A . 3 ALA HA 1 1
4 718 1 1 3 ALA HB1 H -0.140 -2.556 2.767 1.00 . A A . 3 ALA HB1 1 1
4 719 1 1 3 ALA HB2 H -1.693 -3.364 2.719 1.00 . A A . 3 ALA HB2 1 1
4 720 1 1 3 ALA N N -2.693 -2.298 0.694 1.00 . A A . 3 ALA N 1 1
4 721 1 1 3 ALA O O -0.204 -3.321 -0.171 1.00 . A A . 3 ALA O 1 1
4 722 1 1 4 TYR C C 2.842 -1.562 0.531 1.00 . A A . 4 TYR C 1 1
4 723 1 1 4 TYR CA C 1.783 -1.463 -0.512 1.00 . A A . 4 TYR CA 1 1
4 724 1 1 4 TYR CB C 2.084 -0.346 -1.516 1.00 . A A . 4 TYR CB 1 1
4 725 1 1 4 TYR CD1 C -0.072 0.110 -2.757 1.00 . A A . 4 TYR CD1 1 1
4 726 1 1 4 TYR CD2 C 1.691 -0.989 -3.910 1.00 . A A . 4 TYR CD2 1 1
4 727 1 1 4 TYR CE1 C -0.858 0.034 -3.889 1.00 . A A . 4 TYR CE1 1 1
4 728 1 1 4 TYR CE2 C 0.914 -1.061 -5.039 1.00 . A A . 4 TYR CE2 1 1
4 729 1 1 4 TYR CG C 1.217 -0.403 -2.751 1.00 . A A . 4 TYR CG 1 1
4 730 1 1 4 TYR CZ C -0.356 -0.549 -5.024 1.00 . A A . 4 TYR CZ 1 1
4 731 1 1 4 TYR H H 0.359 -0.345 0.486 1.00 . A A . 4 TYR H 1 1
4 732 1 1 4 TYR HA H 1.713 -2.408 -1.030 1.00 . A A . 4 TYR HA 1 1
4 733 1 1 4 TYR HB2 H 1.923 0.609 -1.039 1.00 . A A . 4 TYR HB2 1 1
4 734 1 1 4 TYR HB3 H 3.117 -0.418 -1.825 1.00 . A A . 4 TYR HB3 1 1
4 735 1 1 4 TYR HD1 H -0.455 0.572 -1.859 1.00 . A A . 4 TYR HD1 1 1
4 736 1 1 4 TYR HD2 H 2.691 -1.395 -3.924 1.00 . A A . 4 TYR HD2 1 1
4 737 1 1 4 TYR HE1 H -1.859 0.437 -3.875 1.00 . A A . 4 TYR HE1 1 1
4 738 1 1 4 TYR HE2 H 1.312 -1.519 -5.931 1.00 . A A . 4 TYR HE2 1 1
4 739 1 1 4 TYR HH H -1.478 0.238 -6.356 1.00 . A A . 4 TYR HH 1 1
4 740 1 1 4 TYR N N 0.553 -1.254 0.159 1.00 . A A . 4 TYR N 1 1
4 741 1 1 4 TYR O O 3.182 -0.571 1.180 1.00 . A A . 4 TYR O 1 1
4 742 1 1 4 TYR OH O -1.136 -0.641 -6.146 1.00 . A A . 4 TYR OH 1 1
4 743 1 1 5 LYS C C 5.679 -2.824 1.163 1.00 . A A . 5 LYS C 1 1
4 744 1 1 5 LYS CA C 4.301 -3.029 1.752 1.00 . A A . 5 LYS CA 1 1
4 745 1 1 5 LYS CB C 4.122 -4.422 2.356 1.00 . A A . 5 LYS CB 1 1
4 746 1 1 5 LYS CD C 2.615 -5.953 3.722 1.00 . A A . 5 LYS CD 1 1
4 747 1 1 5 LYS CE C 2.528 -7.042 2.670 1.00 . A A . 5 LYS CE 1 1
4 748 1 1 5 LYS CG C 2.792 -4.574 3.100 1.00 . A A . 5 LYS CG 1 1
4 749 1 1 5 LYS H H 2.957 -3.510 0.206 1.00 . A A . 5 LYS H 1 1
4 750 1 1 5 LYS HA H 4.163 -2.289 2.528 1.00 . A A . 5 LYS HA 1 1
4 751 1 1 5 LYS HB2 H 4.160 -5.149 1.558 1.00 . A A . 5 LYS HB2 1 1
4 752 1 1 5 LYS HB3 H 4.925 -4.613 3.051 1.00 . A A . 5 LYS HB3 1 1
4 753 1 1 5 LYS HD2 H 3.455 -6.157 4.367 1.00 . A A . 5 LYS HD2 1 1
4 754 1 1 5 LYS HD3 H 1.705 -5.951 4.303 1.00 . A A . 5 LYS HD3 1 1
4 755 1 1 5 LYS HE2 H 1.694 -6.828 2.023 1.00 . A A . 5 LYS HE2 1 1
4 756 1 1 5 LYS HE3 H 3.443 -7.051 2.095 1.00 . A A . 5 LYS HE3 1 1
4 757 1 1 5 LYS HG2 H 2.743 -3.834 3.884 1.00 . A A . 5 LYS HG2 1 1
4 758 1 1 5 LYS HG3 H 1.988 -4.397 2.400 1.00 . A A . 5 LYS HG3 1 1
4 759 1 1 5 LYS HZ1 H 2.367 -9.111 2.532 1.00 . A A . 5 LYS HZ1 1 1
4 760 1 1 5 LYS HZ2 H 1.375 -8.443 3.703 1.00 . A A . 5 LYS HZ2 1 1
4 761 1 1 5 LYS HZ3 H 3.024 -8.584 3.990 1.00 . A A . 5 LYS HZ3 1 1
4 762 1 1 5 LYS N N 3.298 -2.770 0.755 1.00 . A A . 5 LYS N 1 1
4 763 1 1 5 LYS NZ N 2.316 -8.372 3.263 1.00 . A A . 5 LYS NZ 1 1
4 764 1 1 5 LYS O O 6.691 -2.867 1.867 1.00 . A A . 5 LYS O 1 1
4 765 1 1 6 SER C C 6.963 -0.706 -0.739 1.00 . A A . 6 SER C 1 1
4 766 1 1 6 SER CA C 6.877 -2.230 -0.845 1.00 . A A . 6 SER CA 1 1
4 767 1 1 6 SER CB C 6.709 -2.656 -2.300 1.00 . A A . 6 SER CB 1 1
4 768 1 1 6 SER H H 4.864 -2.709 -0.632 1.00 . A A . 6 SER H 1 1
4 769 1 1 6 SER HA H 7.746 -2.698 -0.410 1.00 . A A . 6 SER HA 1 1
4 770 1 1 6 SER HB2 H 5.939 -2.055 -2.764 1.00 . A A . 6 SER HB2 1 1
4 771 1 1 6 SER HB3 H 7.640 -2.525 -2.830 1.00 . A A . 6 SER HB3 1 1
4 772 1 1 6 SER HG H 7.094 -4.514 -2.700 1.00 . A A . 6 SER HG 1 1
4 773 1 1 6 SER N N 5.699 -2.611 -0.126 1.00 . A A . 6 SER N 1 1
4 774 1 1 6 SER O O 6.004 -0.071 -0.283 1.00 . A A . 6 SER O 1 1
4 775 1 1 6 SER OG O 6.326 -4.031 -2.374 1.00 . A A . 6 SER OG 1 1
4 776 1 1 7 LYS C C 7.796 2.003 -2.317 1.00 . A A . 7 LYS C 1 1
4 777 1 1 7 LYS CA C 8.145 1.328 -0.996 1.00 . A A . 7 LYS CA 1 1
4 778 1 1 7 LYS CB C 9.498 1.796 -0.433 1.00 . A A . 7 LYS CB 1 1
4 779 1 1 7 LYS CD C 12.014 1.875 -0.578 1.00 . A A . 7 LYS CD 1 1
4 780 1 1 7 LYS CE C 12.185 1.464 0.882 1.00 . A A . 7 LYS CE 1 1
4 781 1 1 7 LYS CG C 10.726 1.314 -1.182 1.00 . A A . 7 LYS CG 1 1
4 782 1 1 7 LYS H H 8.814 -0.619 -1.476 1.00 . A A . 7 LYS H 1 1
4 783 1 1 7 LYS HA H 7.367 1.608 -0.300 1.00 . A A . 7 LYS HA 1 1
4 784 1 1 7 LYS HB2 H 9.513 2.875 -0.444 1.00 . A A . 7 LYS HB2 1 1
4 785 1 1 7 LYS HB3 H 9.565 1.458 0.590 1.00 . A A . 7 LYS HB3 1 1
4 786 1 1 7 LYS HD2 H 12.857 1.510 -1.145 1.00 . A A . 7 LYS HD2 1 1
4 787 1 1 7 LYS HD3 H 11.984 2.952 -0.640 1.00 . A A . 7 LYS HD3 1 1
4 788 1 1 7 LYS HE2 H 11.349 1.830 1.457 1.00 . A A . 7 LYS HE2 1 1
4 789 1 1 7 LYS HE3 H 12.218 0.387 0.938 1.00 . A A . 7 LYS HE3 1 1
4 790 1 1 7 LYS HG2 H 10.759 0.235 -1.134 1.00 . A A . 7 LYS HG2 1 1
4 791 1 1 7 LYS HG3 H 10.650 1.631 -2.213 1.00 . A A . 7 LYS HG3 1 1
4 792 1 1 7 LYS HZ1 H 13.456 1.811 2.488 1.00 . A A . 7 LYS HZ1 1 1
4 793 1 1 7 LYS HZ2 H 13.491 3.032 1.315 1.00 . A A . 7 LYS HZ2 1 1
4 794 1 1 7 LYS HZ3 H 14.248 1.558 1.033 1.00 . A A . 7 LYS HZ3 1 1
4 795 1 1 7 LYS N N 8.060 -0.110 -1.104 1.00 . A A . 7 LYS N 1 1
4 796 1 1 7 LYS NZ N 13.416 2.008 1.467 1.00 . A A . 7 LYS NZ 1 1
4 797 1 1 7 LYS O O 8.059 1.446 -3.387 1.00 . A A . 7 LYS O 1 1
4 798 1 1 8 PRO C C 5.572 3.280 -0.355 1.00 . A A . 8 PRO C 1 1
4 799 1 1 8 PRO CA C 6.805 3.895 -1.028 1.00 . A A . 8 PRO CA 1 1
4 800 1 1 8 PRO CB C 6.486 5.330 -1.494 1.00 . A A . 8 PRO CB 1 1
4 801 1 1 8 PRO CD C 6.747 3.966 -3.435 1.00 . A A . 8 PRO CD 1 1
4 802 1 1 8 PRO CG C 6.873 5.370 -2.935 1.00 . A A . 8 PRO CG 1 1
4 803 1 1 8 PRO HA H 7.629 3.911 -0.332 1.00 . A A . 8 PRO HA 1 1
4 804 1 1 8 PRO HB2 H 5.432 5.520 -1.362 1.00 . A A . 8 PRO HB2 1 1
4 805 1 1 8 PRO HB3 H 7.057 6.037 -0.912 1.00 . A A . 8 PRO HB3 1 1
4 806 1 1 8 PRO HD2 H 5.722 3.746 -3.695 1.00 . A A . 8 PRO HD2 1 1
4 807 1 1 8 PRO HD3 H 7.400 3.789 -4.276 1.00 . A A . 8 PRO HD3 1 1
4 808 1 1 8 PRO HG2 H 6.204 6.025 -3.470 1.00 . A A . 8 PRO HG2 1 1
4 809 1 1 8 PRO HG3 H 7.891 5.714 -3.033 1.00 . A A . 8 PRO HG3 1 1
4 810 1 1 8 PRO N N 7.167 3.196 -2.275 1.00 . A A . 8 PRO N 1 1
4 811 1 1 8 PRO O O 4.606 2.912 -1.035 1.00 . A A . 8 PRO O 1 1
4 812 1 1 9 PRO C C 3.244 3.461 1.655 1.00 . A A . 9 PRO C 1 1
4 813 1 1 9 PRO CA C 4.488 2.584 1.742 1.00 . A A . 9 PRO CA 1 1
4 814 1 1 9 PRO CB C 5.006 2.534 3.187 1.00 . A A . 9 PRO CB 1 1
4 815 1 1 9 PRO CD C 6.712 3.565 1.866 1.00 . A A . 9 PRO CD 1 1
4 816 1 1 9 PRO CG C 6.104 3.541 3.236 1.00 . A A . 9 PRO CG 1 1
4 817 1 1 9 PRO HA H 4.249 1.589 1.399 1.00 . A A . 9 PRO HA 1 1
4 818 1 1 9 PRO HB2 H 4.203 2.792 3.862 1.00 . A A . 9 PRO HB2 1 1
4 819 1 1 9 PRO HB3 H 5.368 1.543 3.417 1.00 . A A . 9 PRO HB3 1 1
4 820 1 1 9 PRO HD2 H 7.044 4.565 1.627 1.00 . A A . 9 PRO HD2 1 1
4 821 1 1 9 PRO HD3 H 7.534 2.869 1.798 1.00 . A A . 9 PRO HD3 1 1
4 822 1 1 9 PRO HG2 H 5.696 4.511 3.477 1.00 . A A . 9 PRO HG2 1 1
4 823 1 1 9 PRO HG3 H 6.840 3.252 3.971 1.00 . A A . 9 PRO HG3 1 1
4 824 1 1 9 PRO N N 5.599 3.156 0.984 1.00 . A A . 9 PRO N 1 1
4 825 1 1 9 PRO O O 3.242 4.618 2.098 1.00 . A A . 9 PRO O 1 1
4 826 1 1 10 ILE C C -0.156 2.641 1.062 1.00 . A A . 10 ILE C 1 1
4 827 1 1 10 ILE CA C 0.981 3.640 0.905 1.00 . A A . 10 ILE CA 1 1
4 828 1 1 10 ILE CB C 0.894 4.405 -0.469 1.00 . A A . 10 ILE CB 1 1
4 829 1 1 10 ILE CD1 C -0.623 6.290 0.368 1.00 . A A . 10 ILE CD1 1 1
4 830 1 1 10 ILE CG1 C -0.435 5.162 -0.624 1.00 . A A . 10 ILE CG1 1 1
4 831 1 1 10 ILE CG2 C 1.141 3.489 -1.663 1.00 . A A . 10 ILE CG2 1 1
4 832 1 1 10 ILE H H 2.302 2.034 0.680 1.00 . A A . 10 ILE H 1 1
4 833 1 1 10 ILE HA H 0.920 4.353 1.715 1.00 . A A . 10 ILE HA 1 1
4 834 1 1 10 ILE HB H 1.698 5.128 -0.467 1.00 . A A . 10 ILE HB 1 1
4 835 1 1 10 ILE HD11 H -1.566 6.780 0.176 1.00 . A A . 10 ILE HD11 1 1
4 836 1 1 10 ILE HD12 H 0.181 7.002 0.258 1.00 . A A . 10 ILE HD12 1 1
4 837 1 1 10 ILE HD13 H -0.622 5.894 1.373 1.00 . A A . 10 ILE HD13 1 1
4 838 1 1 10 ILE HG12 H -0.494 5.581 -1.617 1.00 . A A . 10 ILE HG12 1 1
4 839 1 1 10 ILE HG13 H -1.248 4.463 -0.491 1.00 . A A . 10 ILE HG13 1 1
4 840 1 1 10 ILE HG21 H 1.072 4.060 -2.577 1.00 . A A . 10 ILE HG21 1 1
4 841 1 1 10 ILE HG22 H 0.400 2.704 -1.671 1.00 . A A . 10 ILE HG22 1 1
4 842 1 1 10 ILE HG23 H 2.126 3.053 -1.584 1.00 . A A . 10 ILE HG23 1 1
4 843 1 1 10 ILE N N 2.227 2.940 1.050 1.00 . A A . 10 ILE N 1 1
4 844 1 1 10 ILE O O -0.100 1.523 0.512 1.00 . A A . 10 ILE O 1 1
4 845 1 1 11 ALA C C -3.529 2.790 1.757 1.00 . A A . 11 ALA C 1 1
4 846 1 1 11 ALA CA C -2.240 2.100 2.090 1.00 . A A . 11 ALA CA 1 1
4 847 1 1 11 ALA CB C -2.274 1.555 3.535 1.00 . A A . 11 ALA CB 1 1
4 848 1 1 11 ALA H H -1.141 3.856 2.313 1.00 . A A . 11 ALA H 1 1
4 849 1 1 11 ALA HA H -2.124 1.268 1.410 1.00 . A A . 11 ALA HA 1 1
4 850 1 1 11 ALA HB1 H -3.100 0.867 3.628 1.00 . A A . 11 ALA HB1 1 1
4 851 1 1 11 ALA HB2 H -2.437 2.381 4.211 1.00 . A A . 11 ALA HB2 1 1
4 852 1 1 11 ALA N N -1.136 2.985 1.859 1.00 . A A . 11 ALA N 1 1
4 853 1 1 11 ALA O O -3.831 3.862 2.273 1.00 . A A . 11 ALA O 1 1
4 854 1 1 12 PHE C C -6.615 2.043 1.259 1.00 . A A . 12 PHE C 1 1
4 855 1 1 12 PHE CA C -5.511 2.715 0.445 1.00 . A A . 12 PHE CA 1 1
4 856 1 1 12 PHE CB C -5.695 2.475 -1.056 1.00 . A A . 12 PHE CB 1 1
4 857 1 1 12 PHE CD1 C -3.466 2.377 -2.236 1.00 . A A . 12 PHE CD1 1 1
4 858 1 1 12 PHE CD2 C -4.744 4.376 -2.400 1.00 . A A . 12 PHE CD2 1 1
4 859 1 1 12 PHE CE1 C -2.479 2.942 -3.021 1.00 . A A . 12 PHE CE1 1 1
4 860 1 1 12 PHE CE2 C -3.756 4.944 -3.185 1.00 . A A . 12 PHE CE2 1 1
4 861 1 1 12 PHE CG C -4.612 3.089 -1.916 1.00 . A A . 12 PHE CG 1 1
4 862 1 1 12 PHE CZ C -2.626 4.227 -3.493 1.00 . A A . 12 PHE CZ 1 1
4 863 1 1 12 PHE H H -3.941 1.342 0.517 1.00 . A A . 12 PHE H 1 1
4 864 1 1 12 PHE HA H -5.493 3.775 0.640 1.00 . A A . 12 PHE HA 1 1
4 865 1 1 12 PHE HB2 H -5.726 1.417 -1.253 1.00 . A A . 12 PHE HB2 1 1
4 866 1 1 12 PHE HB3 H -6.635 2.910 -1.357 1.00 . A A . 12 PHE HB3 1 1
4 867 1 1 12 PHE HD1 H -3.349 1.368 -1.864 1.00 . A A . 12 PHE HD1 1 1
4 868 1 1 12 PHE HD2 H -5.631 4.942 -2.159 1.00 . A A . 12 PHE HD2 1 1
4 869 1 1 12 PHE HE1 H -1.586 2.386 -3.263 1.00 . A A . 12 PHE HE1 1 1
4 870 1 1 12 PHE HE2 H -3.868 5.951 -3.557 1.00 . A A . 12 PHE HE2 1 1
4 871 1 1 12 PHE HZ H -1.854 4.672 -4.105 1.00 . A A . 12 PHE HZ 1 1
4 872 1 1 12 PHE N N -4.256 2.199 0.882 1.00 . A A . 12 PHE N 1 1
4 873 1 1 12 PHE O O -6.597 0.811 1.416 1.00 . A A . 12 PHE O 1 1
4 874 1 1 13 PRO C C -9.606 1.284 2.154 1.00 . A A . 13 PRO C 1 1
4 875 1 1 13 PRO CA C -8.648 2.352 2.725 1.00 . A A . 13 PRO CA 1 1
4 876 1 1 13 PRO CB C -9.446 3.612 3.058 1.00 . A A . 13 PRO CB 1 1
4 877 1 1 13 PRO CD C -7.709 4.283 1.567 1.00 . A A . 13 PRO CD 1 1
4 878 1 1 13 PRO CG C -8.567 4.751 2.694 1.00 . A A . 13 PRO CG 1 1
4 879 1 1 13 PRO HA H -8.220 1.970 3.639 1.00 . A A . 13 PRO HA 1 1
4 880 1 1 13 PRO HB2 H -10.362 3.619 2.485 1.00 . A A . 13 PRO HB2 1 1
4 881 1 1 13 PRO HB3 H -9.678 3.614 4.112 1.00 . A A . 13 PRO HB3 1 1
4 882 1 1 13 PRO HD2 H -8.186 4.485 0.619 1.00 . A A . 13 PRO HD2 1 1
4 883 1 1 13 PRO HD3 H -6.753 4.779 1.633 1.00 . A A . 13 PRO HD3 1 1
4 884 1 1 13 PRO HG2 H -9.164 5.594 2.382 1.00 . A A . 13 PRO HG2 1 1
4 885 1 1 13 PRO HG3 H -7.955 5.022 3.540 1.00 . A A . 13 PRO HG3 1 1
4 886 1 1 13 PRO N N -7.580 2.835 1.804 1.00 . A A . 13 PRO N 1 1
4 887 1 1 13 PRO O O -10.615 0.955 2.778 1.00 . A A . 13 PRO O 1 1
4 888 1 1 14 ASP C C -9.463 -1.644 0.739 1.00 . A A . 14 ASP C 1 1
4 889 1 1 14 ASP CA C -10.126 -0.312 0.442 1.00 . A A . 14 ASP CA 1 1
4 890 1 1 14 ASP CB C -10.317 -0.140 -1.074 1.00 . A A . 14 ASP CB 1 1
4 891 1 1 14 ASP CG C -9.056 -0.353 -1.872 1.00 . A A . 14 ASP CG 1 1
4 892 1 1 14 ASP H H -8.517 1.058 0.519 1.00 . A A . 14 ASP H 1 1
4 893 1 1 14 ASP HA H -11.086 -0.288 0.934 1.00 . A A . 14 ASP HA 1 1
4 894 1 1 14 ASP HB2 H -11.051 -0.856 -1.417 1.00 . A A . 14 ASP HB2 1 1
4 895 1 1 14 ASP HB3 H -10.685 0.856 -1.267 1.00 . A A . 14 ASP HB3 1 1
4 896 1 1 14 ASP N N -9.314 0.751 1.005 1.00 . A A . 14 ASP N 1 1
4 897 1 1 14 ASP O O -9.871 -2.688 0.247 1.00 . A A . 14 ASP O 1 1
4 898 1 1 14 ASP OD1 O -8.915 -1.418 -2.514 1.00 . A A . 14 ASP OD1 1 1
4 899 1 1 14 ASP OD2 O -8.189 0.537 -1.880 1.00 . A A . 14 ASP OD2 1 1
4 900 2 2 1 . C C -1.697 -1.533 3.777 1.00 . B A . 101 WMH C 1 1
4 901 2 2 1 . C1 C -0.999 0.851 3.980 1.00 . B A . 101 WMH C1 1 1
4 902 2 2 1 . C2 C 0.169 1.458 4.318 1.00 . B A . 101 WMH C2 1 1
4 903 2 2 1 . H1 H -1.813 -2.146 4.659 1.00 . B A . 101 WMH H1 1 1
4 904 2 2 1 . H2 H -2.650 -1.108 3.506 1.00 . B A . 101 WMH H2 1 1
4 905 2 2 1 . H5 H 0.334 2.525 4.352 1.00 . B A . 101 WMH H5 1 1
4 906 2 2 1 . N N -0.793 -0.482 4.059 1.00 . B A . 101 WMH N 1 1
4 907 2 2 1 . N1 N 1.070 0.530 4.599 1.00 . B A . 101 WMH N1 1 1
4 908 2 2 1 . N2 N 0.551 -0.638 4.461 1.00 . B A . 101 WMH N2 1 1
5 909 1 1 1 GLY C C -6.526 -2.828 1.562 1.00 . A A . 1 GLY C 1 1
5 910 1 1 1 GLY CA C -7.576 -2.349 2.529 1.00 . A A . 1 GLY CA 1 1
5 911 1 1 1 GLY H1 H -7.865 -0.355 1.917 1.00 . A A . 1 GLY H1 1 1
5 912 1 1 1 GLY HA2 H -7.101 -2.045 3.449 1.00 . A A . 1 GLY HA2 1 1
5 913 1 1 1 GLY HA3 H -8.263 -3.158 2.730 1.00 . A A . 1 GLY HA3 1 1
5 914 1 1 1 GLY N N -8.302 -1.231 1.985 1.00 . A A . 1 GLY N 1 1
5 915 1 1 1 GLY O O -6.166 -4.009 1.542 1.00 . A A . 1 GLY O 1 1
5 916 1 1 2 ARG C C -3.727 -1.654 0.111 1.00 . A A . 2 ARG C 1 1
5 917 1 1 2 ARG CA C -5.061 -2.259 -0.262 1.00 . A A . 2 ARG CA 1 1
5 918 1 1 2 ARG CB C -5.515 -1.771 -1.644 1.00 . A A . 2 ARG CB 1 1
5 919 1 1 2 ARG CD C -7.352 -1.751 -3.367 1.00 . A A . 2 ARG CD 1 1
5 920 1 1 2 ARG CG C -6.908 -2.243 -2.008 1.00 . A A . 2 ARG CG 1 1
5 921 1 1 2 ARG CZ C -9.396 -1.988 -4.771 1.00 . A A . 2 ARG CZ 1 1
5 922 1 1 2 ARG H H -6.328 -0.986 0.846 1.00 . A A . 2 ARG H 1 1
5 923 1 1 2 ARG HA H -4.965 -3.334 -0.278 1.00 . A A . 2 ARG HA 1 1
5 924 1 1 2 ARG HB2 H -5.498 -0.692 -1.654 1.00 . A A . 2 ARG HB2 1 1
5 925 1 1 2 ARG HB3 H -4.824 -2.140 -2.388 1.00 . A A . 2 ARG HB3 1 1
5 926 1 1 2 ARG HD2 H -7.231 -0.679 -3.409 1.00 . A A . 2 ARG HD2 1 1
5 927 1 1 2 ARG HD3 H -6.742 -2.215 -4.127 1.00 . A A . 2 ARG HD3 1 1
5 928 1 1 2 ARG HE H -9.256 -2.393 -2.807 1.00 . A A . 2 ARG HE 1 1
5 929 1 1 2 ARG HG2 H -6.923 -3.322 -2.012 1.00 . A A . 2 ARG HG2 1 1
5 930 1 1 2 ARG HG3 H -7.598 -1.881 -1.261 1.00 . A A . 2 ARG HG3 1 1
5 931 1 1 2 ARG HH11 H -7.779 -1.350 -5.865 1.00 . A A . 2 ARG HH11 1 1
5 932 1 1 2 ARG HH12 H -9.227 -1.499 -6.746 1.00 . A A . 2 ARG HH12 1 1
5 933 1 1 2 ARG HH21 H -11.196 -2.622 -4.035 1.00 . A A . 2 ARG HH21 1 1
5 934 1 1 2 ARG HH22 H -11.199 -2.212 -5.699 1.00 . A A . 2 ARG HH22 1 1
5 935 1 1 2 ARG N N -6.039 -1.919 0.746 1.00 . A A . 2 ARG N 1 1
5 936 1 1 2 ARG NE N -8.756 -2.091 -3.607 1.00 . A A . 2 ARG NE 1 1
5 937 1 1 2 ARG NH1 N -8.752 -1.587 -5.865 1.00 . A A . 2 ARG NH1 1 1
5 938 1 1 2 ARG NH2 N -10.687 -2.302 -4.841 1.00 . A A . 2 ARG NH2 1 1
5 939 1 1 2 ARG O O -3.498 -0.461 -0.083 1.00 . A A . 2 ARG O 1 1
5 940 1 1 3 ALA C C -0.480 -2.651 0.334 1.00 . A A . 3 ALA C 1 1
5 941 1 1 3 ALA CA C -1.577 -2.055 1.157 1.00 . A A . 3 ALA CA 1 1
5 942 1 1 3 ALA CB C -1.355 -2.415 2.624 1.00 . A A . 3 ALA CB 1 1
5 943 1 1 3 ALA H H -3.174 -3.388 0.863 1.00 . A A . 3 ALA H 1 1
5 944 1 1 3 ALA HA H -1.521 -0.981 1.076 1.00 . A A . 3 ALA HA 1 1
5 945 1 1 3 ALA HB1 H -0.312 -2.661 2.763 1.00 . A A . 3 ALA HB1 1 1
5 946 1 1 3 ALA HB2 H -1.948 -3.289 2.853 1.00 . A A . 3 ALA HB2 1 1
5 947 1 1 3 ALA N N -2.898 -2.459 0.713 1.00 . A A . 3 ALA N 1 1
5 948 1 1 3 ALA O O -0.496 -3.847 0.012 1.00 . A A . 3 ALA O 1 1
5 949 1 1 4 TYR C C 2.727 -2.526 0.351 1.00 . A A . 4 TYR C 1 1
5 950 1 1 4 TYR CA C 1.657 -2.227 -0.677 1.00 . A A . 4 TYR CA 1 1
5 951 1 1 4 TYR CB C 2.152 -1.123 -1.630 1.00 . A A . 4 TYR CB 1 1
5 952 1 1 4 TYR CD1 C 1.819 -1.550 -4.082 1.00 . A A . 4 TYR CD1 1 1
5 953 1 1 4 TYR CD2 C 0.154 -0.299 -2.938 1.00 . A A . 4 TYR CD2 1 1
5 954 1 1 4 TYR CE1 C 1.112 -1.436 -5.250 1.00 . A A . 4 TYR CE1 1 1
5 955 1 1 4 TYR CE2 C -0.564 -0.181 -4.105 1.00 . A A . 4 TYR CE2 1 1
5 956 1 1 4 TYR CG C 1.356 -0.986 -2.905 1.00 . A A . 4 TYR CG 1 1
5 957 1 1 4 TYR CZ C -0.078 -0.751 -5.256 1.00 . A A . 4 TYR CZ 1 1
5 958 1 1 4 TYR H H 0.345 -0.865 0.207 1.00 . A A . 4 TYR H 1 1
5 959 1 1 4 TYR HA H 1.439 -3.115 -1.250 1.00 . A A . 4 TYR HA 1 1
5 960 1 1 4 TYR HB2 H 2.083 -0.170 -1.123 1.00 . A A . 4 TYR HB2 1 1
5 961 1 1 4 TYR HB3 H 3.181 -1.312 -1.893 1.00 . A A . 4 TYR HB3 1 1
5 962 1 1 4 TYR HD1 H 2.755 -2.090 -4.072 1.00 . A A . 4 TYR HD1 1 1
5 963 1 1 4 TYR HD2 H -0.222 0.149 -2.028 1.00 . A A . 4 TYR HD2 1 1
5 964 1 1 4 TYR HE1 H 1.496 -1.889 -6.153 1.00 . A A . 4 TYR HE1 1 1
5 965 1 1 4 TYR HE2 H -1.499 0.356 -4.107 1.00 . A A . 4 TYR HE2 1 1
5 966 1 1 4 TYR HH H -0.761 -1.506 -6.850 1.00 . A A . 4 TYR HH 1 1
5 967 1 1 4 TYR N N 0.460 -1.818 -0.003 1.00 . A A . 4 TYR N 1 1
5 968 1 1 4 TYR O O 2.697 -1.983 1.467 1.00 . A A . 4 TYR O 1 1
5 969 1 1 4 TYR OH O -0.785 -0.642 -6.418 1.00 . A A . 4 TYR OH 1 1
5 970 1 1 5 LYS C C 6.009 -2.994 0.367 1.00 . A A . 5 LYS C 1 1
5 971 1 1 5 LYS CA C 4.761 -3.690 0.875 1.00 . A A . 5 LYS CA 1 1
5 972 1 1 5 LYS CB C 4.959 -5.213 1.118 1.00 . A A . 5 LYS CB 1 1
5 973 1 1 5 LYS CD C 6.126 -5.913 -1.058 1.00 . A A . 5 LYS CD 1 1
5 974 1 1 5 LYS CE C 6.074 -6.877 -2.234 1.00 . A A . 5 LYS CE 1 1
5 975 1 1 5 LYS CG C 4.950 -6.131 -0.118 1.00 . A A . 5 LYS CG 1 1
5 976 1 1 5 LYS H H 3.531 -3.892 -0.838 1.00 . A A . 5 LYS H 1 1
5 977 1 1 5 LYS HA H 4.516 -3.217 1.814 1.00 . A A . 5 LYS HA 1 1
5 978 1 1 5 LYS HB2 H 5.909 -5.352 1.612 1.00 . A A . 5 LYS HB2 1 1
5 979 1 1 5 LYS HB3 H 4.182 -5.546 1.792 1.00 . A A . 5 LYS HB3 1 1
5 980 1 1 5 LYS HD2 H 6.096 -4.899 -1.429 1.00 . A A . 5 LYS HD2 1 1
5 981 1 1 5 LYS HD3 H 7.046 -6.069 -0.514 1.00 . A A . 5 LYS HD3 1 1
5 982 1 1 5 LYS HE2 H 5.138 -6.733 -2.752 1.00 . A A . 5 LYS HE2 1 1
5 983 1 1 5 LYS HE3 H 6.893 -6.655 -2.903 1.00 . A A . 5 LYS HE3 1 1
5 984 1 1 5 LYS HG2 H 4.983 -7.156 0.220 1.00 . A A . 5 LYS HG2 1 1
5 985 1 1 5 LYS HG3 H 4.028 -5.968 -0.657 1.00 . A A . 5 LYS HG3 1 1
5 986 1 1 5 LYS HZ1 H 7.034 -8.460 -1.257 1.00 . A A . 5 LYS HZ1 1 1
5 987 1 1 5 LYS HZ2 H 6.179 -8.942 -2.608 1.00 . A A . 5 LYS HZ2 1 1
5 988 1 1 5 LYS HZ3 H 5.363 -8.565 -1.194 1.00 . A A . 5 LYS HZ3 1 1
5 989 1 1 5 LYS N N 3.632 -3.407 0.011 1.00 . A A . 5 LYS N 1 1
5 990 1 1 5 LYS NZ N 6.163 -8.290 -1.800 1.00 . A A . 5 LYS NZ 1 1
5 991 1 1 5 LYS O O 7.082 -3.071 0.963 1.00 . A A . 5 LYS O 1 1
5 992 1 1 6 SER C C 6.879 -0.147 -0.731 1.00 . A A . 6 SER C 1 1
5 993 1 1 6 SER CA C 6.909 -1.557 -1.316 1.00 . A A . 6 SER CA 1 1
5 994 1 1 6 SER CB C 6.723 -1.519 -2.831 1.00 . A A . 6 SER CB 1 1
5 995 1 1 6 SER H H 4.980 -2.317 -1.174 1.00 . A A . 6 SER H 1 1
5 996 1 1 6 SER HA H 7.844 -2.043 -1.083 1.00 . A A . 6 SER HA 1 1
5 997 1 1 6 SER HB2 H 5.812 -0.988 -3.068 1.00 . A A . 6 SER HB2 1 1
5 998 1 1 6 SER HB3 H 7.563 -1.013 -3.286 1.00 . A A . 6 SER HB3 1 1
5 999 1 1 6 SER HG H 7.552 -3.161 -3.412 1.00 . A A . 6 SER HG 1 1
5 1000 1 1 6 SER N N 5.853 -2.316 -0.734 1.00 . A A . 6 SER N 1 1
5 1001 1 1 6 SER O O 5.822 0.464 -0.661 1.00 . A A . 6 SER O 1 1
5 1002 1 1 6 SER OG O 6.640 -2.842 -3.360 1.00 . A A . 6 SER OG 1 1
5 1003 1 1 7 LYS C C 8.542 2.651 -0.807 1.00 . A A . 7 LYS C 1 1
5 1004 1 1 7 LYS CA C 8.148 1.660 0.287 1.00 . A A . 7 LYS CA 1 1
5 1005 1 1 7 LYS CB C 9.177 1.695 1.445 1.00 . A A . 7 LYS CB 1 1
5 1006 1 1 7 LYS CD C 8.373 -0.387 2.750 1.00 . A A . 7 LYS CD 1 1
5 1007 1 1 7 LYS CE C 9.599 -1.230 2.449 1.00 . A A . 7 LYS CE 1 1
5 1008 1 1 7 LYS CG C 8.699 1.105 2.793 1.00 . A A . 7 LYS CG 1 1
5 1009 1 1 7 LYS H H 8.824 -0.222 -0.382 1.00 . A A . 7 LYS H 1 1
5 1010 1 1 7 LYS HA H 7.174 1.941 0.665 1.00 . A A . 7 LYS HA 1 1
5 1011 1 1 7 LYS HB2 H 10.057 1.150 1.138 1.00 . A A . 7 LYS HB2 1 1
5 1012 1 1 7 LYS HB3 H 9.456 2.725 1.608 1.00 . A A . 7 LYS HB3 1 1
5 1013 1 1 7 LYS HD2 H 7.971 -0.689 3.705 1.00 . A A . 7 LYS HD2 1 1
5 1014 1 1 7 LYS HD3 H 7.634 -0.557 1.981 1.00 . A A . 7 LYS HD3 1 1
5 1015 1 1 7 LYS HE2 H 9.953 -0.981 1.461 1.00 . A A . 7 LYS HE2 1 1
5 1016 1 1 7 LYS HE3 H 10.368 -1.005 3.172 1.00 . A A . 7 LYS HE3 1 1
5 1017 1 1 7 LYS HG2 H 9.480 1.251 3.525 1.00 . A A . 7 LYS HG2 1 1
5 1018 1 1 7 LYS HG3 H 7.822 1.644 3.117 1.00 . A A . 7 LYS HG3 1 1
5 1019 1 1 7 LYS HZ1 H 10.149 -3.227 2.275 1.00 . A A . 7 LYS HZ1 1 1
5 1020 1 1 7 LYS HZ2 H 8.549 -2.922 1.815 1.00 . A A . 7 LYS HZ2 1 1
5 1021 1 1 7 LYS HZ3 H 8.970 -2.941 3.442 1.00 . A A . 7 LYS HZ3 1 1
5 1022 1 1 7 LYS N N 8.021 0.330 -0.286 1.00 . A A . 7 LYS N 1 1
5 1023 1 1 7 LYS NZ N 9.300 -2.668 2.493 1.00 . A A . 7 LYS NZ 1 1
5 1024 1 1 7 LYS O O 9.296 2.281 -1.708 1.00 . A A . 7 LYS O 1 1
5 1025 1 1 8 PRO C C 5.721 3.576 0.086 1.00 . A A . 8 PRO C 1 1
5 1026 1 1 8 PRO CA C 7.014 4.378 0.170 1.00 . A A . 8 PRO CA 1 1
5 1027 1 1 8 PRO CB C 6.760 5.835 -0.250 1.00 . A A . 8 PRO CB 1 1
5 1028 1 1 8 PRO CD C 8.323 4.935 -1.796 1.00 . A A . 8 PRO CD 1 1
5 1029 1 1 8 PRO CG C 7.933 6.193 -1.088 1.00 . A A . 8 PRO CG 1 1
5 1030 1 1 8 PRO HA H 7.409 4.340 1.173 1.00 . A A . 8 PRO HA 1 1
5 1031 1 1 8 PRO HB2 H 5.840 5.894 -0.812 1.00 . A A . 8 PRO HB2 1 1
5 1032 1 1 8 PRO HB3 H 6.695 6.464 0.626 1.00 . A A . 8 PRO HB3 1 1
5 1033 1 1 8 PRO HD2 H 7.728 4.811 -2.689 1.00 . A A . 8 PRO HD2 1 1
5 1034 1 1 8 PRO HD3 H 9.376 4.933 -2.034 1.00 . A A . 8 PRO HD3 1 1
5 1035 1 1 8 PRO HG2 H 7.661 6.958 -1.799 1.00 . A A . 8 PRO HG2 1 1
5 1036 1 1 8 PRO HG3 H 8.744 6.535 -0.458 1.00 . A A . 8 PRO HG3 1 1
5 1037 1 1 8 PRO N N 8.005 3.893 -0.814 1.00 . A A . 8 PRO N 1 1
5 1038 1 1 8 PRO O O 5.208 3.329 -1.015 1.00 . A A . 8 PRO O 1 1
5 1039 1 1 9 PRO C C 2.741 2.998 1.009 1.00 . A A . 9 PRO C 1 1
5 1040 1 1 9 PRO CA C 4.050 2.268 1.279 1.00 . A A . 9 PRO CA 1 1
5 1041 1 1 9 PRO CB C 4.097 1.697 2.693 1.00 . A A . 9 PRO CB 1 1
5 1042 1 1 9 PRO CD C 5.666 3.516 2.586 1.00 . A A . 9 PRO CD 1 1
5 1043 1 1 9 PRO CG C 4.770 2.746 3.514 1.00 . A A . 9 PRO CG 1 1
5 1044 1 1 9 PRO HA H 4.154 1.466 0.563 1.00 . A A . 9 PRO HA 1 1
5 1045 1 1 9 PRO HB2 H 3.092 1.506 3.039 1.00 . A A . 9 PRO HB2 1 1
5 1046 1 1 9 PRO HB3 H 4.663 0.777 2.694 1.00 . A A . 9 PRO HB3 1 1
5 1047 1 1 9 PRO HD2 H 5.550 4.577 2.751 1.00 . A A . 9 PRO HD2 1 1
5 1048 1 1 9 PRO HD3 H 6.695 3.226 2.732 1.00 . A A . 9 PRO HD3 1 1
5 1049 1 1 9 PRO HG2 H 4.028 3.405 3.938 1.00 . A A . 9 PRO HG2 1 1
5 1050 1 1 9 PRO HG3 H 5.350 2.283 4.298 1.00 . A A . 9 PRO HG3 1 1
5 1051 1 1 9 PRO N N 5.198 3.145 1.233 1.00 . A A . 9 PRO N 1 1
5 1052 1 1 9 PRO O O 2.369 3.953 1.707 1.00 . A A . 9 PRO O 1 1
5 1053 1 1 10 ILE C C -0.296 2.244 0.114 1.00 . A A . 10 ILE C 1 1
5 1054 1 1 10 ILE CA C 0.812 3.148 -0.402 1.00 . A A . 10 ILE CA 1 1
5 1055 1 1 10 ILE CB C 0.704 3.293 -1.944 1.00 . A A . 10 ILE CB 1 1
5 1056 1 1 10 ILE CD1 C 1.850 4.366 -3.981 1.00 . A A . 10 ILE CD1 1 1
5 1057 1 1 10 ILE CG1 C 1.821 4.216 -2.472 1.00 . A A . 10 ILE CG1 1 1
5 1058 1 1 10 ILE CG2 C -0.671 3.821 -2.345 1.00 . A A . 10 ILE CG2 1 1
5 1059 1 1 10 ILE H H 2.465 1.867 -0.572 1.00 . A A . 10 ILE H 1 1
5 1060 1 1 10 ILE HA H 0.722 4.124 0.052 1.00 . A A . 10 ILE HA 1 1
5 1061 1 1 10 ILE HB H 0.828 2.314 -2.382 1.00 . A A . 10 ILE HB 1 1
5 1062 1 1 10 ILE HD11 H 2.002 3.398 -4.435 1.00 . A A . 10 ILE HD11 1 1
5 1063 1 1 10 ILE HD12 H 2.657 5.027 -4.262 1.00 . A A . 10 ILE HD12 1 1
5 1064 1 1 10 ILE HD13 H 0.911 4.777 -4.318 1.00 . A A . 10 ILE HD13 1 1
5 1065 1 1 10 ILE HG12 H 1.693 5.201 -2.048 1.00 . A A . 10 ILE HG12 1 1
5 1066 1 1 10 ILE HG13 H 2.777 3.821 -2.156 1.00 . A A . 10 ILE HG13 1 1
5 1067 1 1 10 ILE HG21 H -0.718 3.923 -3.419 1.00 . A A . 10 ILE HG21 1 1
5 1068 1 1 10 ILE HG22 H -0.843 4.778 -1.876 1.00 . A A . 10 ILE HG22 1 1
5 1069 1 1 10 ILE HG23 H -1.420 3.114 -2.016 1.00 . A A . 10 ILE HG23 1 1
5 1070 1 1 10 ILE N N 2.082 2.586 -0.029 1.00 . A A . 10 ILE N 1 1
5 1071 1 1 10 ILE O O -0.307 1.038 -0.182 1.00 . A A . 10 ILE O 1 1
5 1072 1 1 11 ALA C C -3.577 2.741 1.174 1.00 . A A . 11 ALA C 1 1
5 1073 1 1 11 ALA CA C -2.285 2.018 1.434 1.00 . A A . 11 ALA CA 1 1
5 1074 1 1 11 ALA CB C -2.173 1.703 2.942 1.00 . A A . 11 ALA CB 1 1
5 1075 1 1 11 ALA H H -1.102 3.725 1.207 1.00 . A A . 11 ALA H 1 1
5 1076 1 1 11 ALA HA H -2.303 1.088 0.886 1.00 . A A . 11 ALA HA 1 1
5 1077 1 1 11 ALA HB1 H -3.018 1.094 3.232 1.00 . A A . 11 ALA HB1 1 1
5 1078 1 1 11 ALA HB2 H -2.219 2.630 3.490 1.00 . A A . 11 ALA HB2 1 1
5 1079 1 1 11 ALA N N -1.180 2.789 0.928 1.00 . A A . 11 ALA N 1 1
5 1080 1 1 11 ALA O O -3.779 3.875 1.631 1.00 . A A . 11 ALA O 1 1
5 1081 1 1 12 PHE C C -6.659 2.139 1.243 1.00 . A A . 12 PHE C 1 1
5 1082 1 1 12 PHE CA C -5.727 2.645 0.167 1.00 . A A . 12 PHE CA 1 1
5 1083 1 1 12 PHE CB C -6.234 2.227 -1.220 1.00 . A A . 12 PHE CB 1 1
5 1084 1 1 12 PHE CD1 C -4.478 1.922 -2.994 1.00 . A A . 12 PHE CD1 1 1
5 1085 1 1 12 PHE CD2 C -5.523 4.055 -2.779 1.00 . A A . 12 PHE CD2 1 1
5 1086 1 1 12 PHE CE1 C -3.708 2.406 -4.033 1.00 . A A . 12 PHE CE1 1 1
5 1087 1 1 12 PHE CE2 C -4.756 4.540 -3.815 1.00 . A A . 12 PHE CE2 1 1
5 1088 1 1 12 PHE CG C -5.396 2.742 -2.354 1.00 . A A . 12 PHE CG 1 1
5 1089 1 1 12 PHE CZ C -3.847 3.714 -4.442 1.00 . A A . 12 PHE CZ 1 1
5 1090 1 1 12 PHE H H -4.152 1.246 0.064 1.00 . A A . 12 PHE H 1 1
5 1091 1 1 12 PHE HA H -5.657 3.722 0.217 1.00 . A A . 12 PHE HA 1 1
5 1092 1 1 12 PHE HB2 H -6.253 1.149 -1.281 1.00 . A A . 12 PHE HB2 1 1
5 1093 1 1 12 PHE HB3 H -7.239 2.601 -1.351 1.00 . A A . 12 PHE HB3 1 1
5 1094 1 1 12 PHE HD1 H -4.361 0.896 -2.680 1.00 . A A . 12 PHE HD1 1 1
5 1095 1 1 12 PHE HD2 H -6.234 4.707 -2.290 1.00 . A A . 12 PHE HD2 1 1
5 1096 1 1 12 PHE HE1 H -2.995 1.763 -4.528 1.00 . A A . 12 PHE HE1 1 1
5 1097 1 1 12 PHE HE2 H -4.867 5.566 -4.135 1.00 . A A . 12 PHE HE2 1 1
5 1098 1 1 12 PHE HZ H -3.244 4.094 -5.254 1.00 . A A . 12 PHE HZ 1 1
5 1099 1 1 12 PHE N N -4.423 2.117 0.430 1.00 . A A . 12 PHE N 1 1
5 1100 1 1 12 PHE O O -6.649 0.932 1.526 1.00 . A A . 12 PHE O 1 1
5 1101 1 1 13 PRO C C -9.415 1.557 2.667 1.00 . A A . 13 PRO C 1 1
5 1102 1 1 13 PRO CA C -8.430 2.713 2.975 1.00 . A A . 13 PRO CA 1 1
5 1103 1 1 13 PRO CB C -9.196 4.016 3.147 1.00 . A A . 13 PRO CB 1 1
5 1104 1 1 13 PRO CD C -7.474 4.497 1.586 1.00 . A A . 13 PRO CD 1 1
5 1105 1 1 13 PRO CG C -8.229 5.064 2.751 1.00 . A A . 13 PRO CG 1 1
5 1106 1 1 13 PRO HA H -7.900 2.490 3.890 1.00 . A A . 13 PRO HA 1 1
5 1107 1 1 13 PRO HB2 H -10.062 4.004 2.502 1.00 . A A . 13 PRO HB2 1 1
5 1108 1 1 13 PRO HB3 H -9.502 4.128 4.176 1.00 . A A . 13 PRO HB3 1 1
5 1109 1 1 13 PRO HD2 H -7.981 4.714 0.657 1.00 . A A . 13 PRO HD2 1 1
5 1110 1 1 13 PRO HD3 H -6.471 4.894 1.579 1.00 . A A . 13 PRO HD3 1 1
5 1111 1 1 13 PRO HG2 H -8.756 5.963 2.465 1.00 . A A . 13 PRO HG2 1 1
5 1112 1 1 13 PRO HG3 H -7.554 5.271 3.569 1.00 . A A . 13 PRO HG3 1 1
5 1113 1 1 13 PRO N N -7.465 3.041 1.867 1.00 . A A . 13 PRO N 1 1
5 1114 1 1 13 PRO O O -10.176 1.122 3.528 1.00 . A A . 13 PRO O 1 1
5 1115 1 1 14 ASP C C -9.559 -1.341 1.596 1.00 . A A . 14 ASP C 1 1
5 1116 1 1 14 ASP CA C -10.187 -0.061 1.014 1.00 . A A . 14 ASP CA 1 1
5 1117 1 1 14 ASP CB C -10.212 -0.137 -0.523 1.00 . A A . 14 ASP CB 1 1
5 1118 1 1 14 ASP CG C -10.982 -1.331 -1.050 1.00 . A A . 14 ASP CG 1 1
5 1119 1 1 14 ASP H H -8.854 1.581 0.789 1.00 . A A . 14 ASP H 1 1
5 1120 1 1 14 ASP HA H -11.195 0.046 1.385 1.00 . A A . 14 ASP HA 1 1
5 1121 1 1 14 ASP HB2 H -10.673 0.758 -0.914 1.00 . A A . 14 ASP HB2 1 1
5 1122 1 1 14 ASP HB3 H -9.197 -0.198 -0.886 1.00 . A A . 14 ASP HB3 1 1
5 1123 1 1 14 ASP N N -9.410 1.100 1.435 1.00 . A A . 14 ASP N 1 1
5 1124 1 1 14 ASP O O -10.209 -2.380 1.719 1.00 . A A . 14 ASP O 1 1
5 1125 1 1 14 ASP OD1 O -12.222 -1.269 -1.110 1.00 . A A . 14 ASP OD1 1 1
5 1126 1 1 14 ASP OD2 O -10.353 -2.348 -1.424 1.00 . A A . 14 ASP OD2 1 1
5 1127 2 2 1 . C C -1.723 -1.332 3.609 1.00 . B A . 101 WMH C 1 1
5 1128 2 2 1 . C1 C -0.903 1.001 3.367 1.00 . B A . 101 WMH C1 1 1
5 1129 2 2 1 . C2 C 0.311 1.580 3.501 1.00 . B A . 101 WMH C2 1 1
5 1130 2 2 1 . H1 H -1.793 -1.780 4.589 1.00 . B A . 101 WMH H1 1 1
5 1131 2 2 1 . H2 H -2.676 -0.904 3.337 1.00 . B A . 101 WMH H2 1 1
5 1132 2 2 1 . H5 H 0.531 2.624 3.341 1.00 . B A . 101 WMH H5 1 1
5 1133 2 2 1 . N N -0.754 -0.307 3.645 1.00 . B A . 101 WMH N 1 1
5 1134 2 2 1 . N1 N 1.186 0.658 3.856 1.00 . B A . 101 WMH N1 1 1
5 1135 2 2 1 . N2 N 0.602 -0.479 3.954 1.00 . B A . 101 WMH N2 1 1
6 1136 1 1 1 GLY C C -6.674 -2.925 1.002 1.00 . A A . 1 GLY C 1 1
6 1137 1 1 1 GLY CA C -7.806 -2.576 1.907 1.00 . A A . 1 GLY CA 1 1
6 1138 1 1 1 GLY H1 H -8.040 -0.538 1.496 1.00 . A A . 1 GLY H1 1 1
6 1139 1 1 1 GLY HA2 H -7.428 -2.383 2.899 1.00 . A A . 1 GLY HA2 1 1
6 1140 1 1 1 GLY HA3 H -8.499 -3.402 1.946 1.00 . A A . 1 GLY HA3 1 1
6 1141 1 1 1 GLY N N -8.483 -1.415 1.440 1.00 . A A . 1 GLY N 1 1
6 1142 1 1 1 GLY O O -6.518 -4.073 0.597 1.00 . A A . 1 GLY O 1 1
6 1143 1 1 2 ARG C C -3.566 -1.431 0.332 1.00 . A A . 2 ARG C 1 1
6 1144 1 1 2 ARG CA C -4.776 -2.120 -0.245 1.00 . A A . 2 ARG CA 1 1
6 1145 1 1 2 ARG CB C -5.094 -1.538 -1.642 1.00 . A A . 2 ARG CB 1 1
6 1146 1 1 2 ARG CD C -6.716 -1.465 -3.581 1.00 . A A . 2 ARG CD 1 1
6 1147 1 1 2 ARG CG C -6.407 -2.029 -2.213 1.00 . A A . 2 ARG CG 1 1
6 1148 1 1 2 ARG CZ C -8.475 -2.160 -5.215 1.00 . A A . 2 ARG CZ 1 1
6 1149 1 1 2 ARG H H -6.027 -1.045 1.056 1.00 . A A . 2 ARG H 1 1
6 1150 1 1 2 ARG HA H -4.581 -3.178 -0.334 1.00 . A A . 2 ARG HA 1 1
6 1151 1 1 2 ARG HB2 H -5.125 -0.461 -1.578 1.00 . A A . 2 ARG HB2 1 1
6 1152 1 1 2 ARG HB3 H -4.302 -1.819 -2.321 1.00 . A A . 2 ARG HB3 1 1
6 1153 1 1 2 ARG HD2 H -6.650 -0.388 -3.545 1.00 . A A . 2 ARG HD2 1 1
6 1154 1 1 2 ARG HD3 H -6.006 -1.855 -4.296 1.00 . A A . 2 ARG HD3 1 1
6 1155 1 1 2 ARG HE H -8.711 -1.915 -3.235 1.00 . A A . 2 ARG HE 1 1
6 1156 1 1 2 ARG HG2 H -6.367 -3.105 -2.294 1.00 . A A . 2 ARG HG2 1 1
6 1157 1 1 2 ARG HG3 H -7.201 -1.758 -1.533 1.00 . A A . 2 ARG HG3 1 1
6 1158 1 1 2 ARG HH11 H -6.672 -1.845 -6.132 1.00 . A A . 2 ARG HH11 1 1
6 1159 1 1 2 ARG HH12 H -7.925 -2.320 -7.178 1.00 . A A . 2 ARG HH12 1 1
6 1160 1 1 2 ARG HH21 H -10.392 -2.577 -4.650 1.00 . A A . 2 ARG HH21 1 1
6 1161 1 1 2 ARG HH22 H -10.092 -2.792 -6.304 1.00 . A A . 2 ARG HH22 1 1
6 1162 1 1 2 ARG N N -5.887 -1.932 0.660 1.00 . A A . 2 ARG N 1 1
6 1163 1 1 2 ARG NE N -8.067 -1.865 -3.985 1.00 . A A . 2 ARG NE 1 1
6 1164 1 1 2 ARG NH1 N -7.635 -2.105 -6.242 1.00 . A A . 2 ARG NH1 1 1
6 1165 1 1 2 ARG NH2 N -9.735 -2.522 -5.407 1.00 . A A . 2 ARG NH2 1 1
6 1166 1 1 2 ARG O O -3.507 -0.208 0.365 1.00 . A A . 2 ARG O 1 1
6 1167 1 1 3 ALA C C -0.253 -2.236 0.643 1.00 . A A . 3 ALA C 1 1
6 1168 1 1 3 ALA CA C -1.426 -1.687 1.387 1.00 . A A . 3 ALA CA 1 1
6 1169 1 1 3 ALA CB C -1.308 -1.991 2.885 1.00 . A A . 3 ALA CB 1 1
6 1170 1 1 3 ALA H H -2.785 -3.175 0.864 1.00 . A A . 3 ALA H 1 1
6 1171 1 1 3 ALA HA H -1.437 -0.615 1.257 1.00 . A A . 3 ALA HA 1 1
6 1172 1 1 3 ALA HB1 H -0.263 -2.126 3.117 1.00 . A A . 3 ALA HB1 1 1
6 1173 1 1 3 ALA HB2 H -1.834 -2.908 3.103 1.00 . A A . 3 ALA HB2 1 1
6 1174 1 1 3 ALA N N -2.657 -2.202 0.845 1.00 . A A . 3 ALA N 1 1
6 1175 1 1 3 ALA O O -0.196 -3.435 0.340 1.00 . A A . 3 ALA O 1 1
6 1176 1 1 4 TYR C C 2.987 -1.894 0.655 1.00 . A A . 4 TYR C 1 1
6 1177 1 1 4 TYR CA C 1.869 -1.726 -0.345 1.00 . A A . 4 TYR CA 1 1
6 1178 1 1 4 TYR CB C 2.238 -0.688 -1.410 1.00 . A A . 4 TYR CB 1 1
6 1179 1 1 4 TYR CD1 C 1.564 -1.621 -3.647 1.00 . A A . 4 TYR CD1 1 1
6 1180 1 1 4 TYR CD2 C 0.269 0.155 -2.739 1.00 . A A . 4 TYR CD2 1 1
6 1181 1 1 4 TYR CE1 C 0.751 -1.652 -4.759 1.00 . A A . 4 TYR CE1 1 1
6 1182 1 1 4 TYR CE2 C -0.548 0.127 -3.846 1.00 . A A . 4 TYR CE2 1 1
6 1183 1 1 4 TYR CG C 1.337 -0.717 -2.619 1.00 . A A . 4 TYR CG 1 1
6 1184 1 1 4 TYR CZ C -0.303 -0.776 -4.851 1.00 . A A . 4 TYR CZ 1 1
6 1185 1 1 4 TYR H H 0.499 -0.417 0.522 1.00 . A A . 4 TYR H 1 1
6 1186 1 1 4 TYR HA H 1.694 -2.670 -0.837 1.00 . A A . 4 TYR HA 1 1
6 1187 1 1 4 TYR HB2 H 2.142 0.300 -0.981 1.00 . A A . 4 TYR HB2 1 1
6 1188 1 1 4 TYR HB3 H 3.255 -0.844 -1.740 1.00 . A A . 4 TYR HB3 1 1
6 1189 1 1 4 TYR HD1 H 2.392 -2.309 -3.571 1.00 . A A . 4 TYR HD1 1 1
6 1190 1 1 4 TYR HD2 H 0.079 0.862 -1.945 1.00 . A A . 4 TYR HD2 1 1
6 1191 1 1 4 TYR HE1 H 0.950 -2.365 -5.546 1.00 . A A . 4 TYR HE1 1 1
6 1192 1 1 4 TYR HE2 H -1.375 0.814 -3.920 1.00 . A A . 4 TYR HE2 1 1
6 1193 1 1 4 TYR HH H -1.211 0.118 -6.254 1.00 . A A . 4 TYR HH 1 1
6 1194 1 1 4 TYR N N 0.656 -1.367 0.321 1.00 . A A . 4 TYR N 1 1
6 1195 1 1 4 TYR O O 3.187 -1.048 1.524 1.00 . A A . 4 TYR O 1 1
6 1196 1 1 4 TYR OH O -1.113 -0.795 -5.956 1.00 . A A . 4 TYR OH 1 1
6 1197 1 1 5 LYS C C 6.065 -2.789 0.777 1.00 . A A . 5 LYS C 1 1
6 1198 1 1 5 LYS CA C 4.795 -3.290 1.429 1.00 . A A . 5 LYS CA 1 1
6 1199 1 1 5 LYS CB C 4.872 -4.786 1.732 1.00 . A A . 5 LYS CB 1 1
6 1200 1 1 5 LYS CD C 3.769 -6.790 2.820 1.00 . A A . 5 LYS CD 1 1
6 1201 1 1 5 LYS CE C 3.282 -7.516 1.571 1.00 . A A . 5 LYS CE 1 1
6 1202 1 1 5 LYS CG C 3.753 -5.277 2.649 1.00 . A A . 5 LYS CG 1 1
6 1203 1 1 5 LYS H H 3.389 -3.675 -0.096 1.00 . A A . 5 LYS H 1 1
6 1204 1 1 5 LYS HA H 4.650 -2.749 2.352 1.00 . A A . 5 LYS HA 1 1
6 1205 1 1 5 LYS HB2 H 4.823 -5.328 0.801 1.00 . A A . 5 LYS HB2 1 1
6 1206 1 1 5 LYS HB3 H 5.818 -4.994 2.210 1.00 . A A . 5 LYS HB3 1 1
6 1207 1 1 5 LYS HD2 H 4.782 -7.102 3.029 1.00 . A A . 5 LYS HD2 1 1
6 1208 1 1 5 LYS HD3 H 3.131 -7.053 3.652 1.00 . A A . 5 LYS HD3 1 1
6 1209 1 1 5 LYS HE2 H 3.871 -7.200 0.722 1.00 . A A . 5 LYS HE2 1 1
6 1210 1 1 5 LYS HE3 H 3.408 -8.579 1.715 1.00 . A A . 5 LYS HE3 1 1
6 1211 1 1 5 LYS HG2 H 3.869 -4.817 3.618 1.00 . A A . 5 LYS HG2 1 1
6 1212 1 1 5 LYS HG3 H 2.805 -4.977 2.225 1.00 . A A . 5 LYS HG3 1 1
6 1213 1 1 5 LYS HZ1 H 1.700 -6.210 1.215 1.00 . A A . 5 LYS HZ1 1 1
6 1214 1 1 5 LYS HZ2 H 1.241 -7.549 2.077 1.00 . A A . 5 LYS HZ2 1 1
6 1215 1 1 5 LYS HZ3 H 1.531 -7.668 0.416 1.00 . A A . 5 LYS HZ3 1 1
6 1216 1 1 5 LYS N N 3.665 -3.007 0.573 1.00 . A A . 5 LYS N 1 1
6 1217 1 1 5 LYS NZ N 1.857 -7.233 1.302 1.00 . A A . 5 LYS NZ 1 1
6 1218 1 1 5 LYS O O 7.105 -2.637 1.418 1.00 . A A . 5 LYS O 1 1
6 1219 1 1 6 SER C C 7.052 -0.465 -0.974 1.00 . A A . 6 SER C 1 1
6 1220 1 1 6 SER CA C 7.049 -1.960 -1.224 1.00 . A A . 6 SER CA 1 1
6 1221 1 1 6 SER CB C 6.883 -2.280 -2.701 1.00 . A A . 6 SER CB 1 1
6 1222 1 1 6 SER H H 5.125 -2.704 -0.958 1.00 . A A . 6 SER H 1 1
6 1223 1 1 6 SER HA H 7.973 -2.383 -0.862 1.00 . A A . 6 SER HA 1 1
6 1224 1 1 6 SER HB2 H 5.997 -1.794 -3.082 1.00 . A A . 6 SER HB2 1 1
6 1225 1 1 6 SER HB3 H 7.753 -1.941 -3.243 1.00 . A A . 6 SER HB3 1 1
6 1226 1 1 6 SER HG H 7.160 -4.078 -2.088 1.00 . A A . 6 SER HG 1 1
6 1227 1 1 6 SER N N 5.971 -2.525 -0.495 1.00 . A A . 6 SER N 1 1
6 1228 1 1 6 SER O O 6.003 0.161 -0.967 1.00 . A A . 6 SER O 1 1
6 1229 1 1 6 SER OG O 6.758 -3.687 -2.876 1.00 . A A . 6 SER OG 1 1
6 1230 1 1 7 LYS C C 8.330 2.306 -1.683 1.00 . A A . 7 LYS C 1 1
6 1231 1 1 7 LYS CA C 8.366 1.477 -0.407 1.00 . A A . 7 LYS CA 1 1
6 1232 1 1 7 LYS CB C 9.675 1.722 0.392 1.00 . A A . 7 LYS CB 1 1
6 1233 1 1 7 LYS CD C 9.262 -0.118 2.197 1.00 . A A . 7 LYS CD 1 1
6 1234 1 1 7 LYS CE C 10.288 -1.107 1.657 1.00 . A A . 7 LYS CE 1 1
6 1235 1 1 7 LYS CG C 9.633 1.349 1.902 1.00 . A A . 7 LYS CG 1 1
6 1236 1 1 7 LYS H H 9.018 -0.482 -0.822 1.00 . A A . 7 LYS H 1 1
6 1237 1 1 7 LYS HA H 7.522 1.755 0.206 1.00 . A A . 7 LYS HA 1 1
6 1238 1 1 7 LYS HB2 H 10.466 1.149 -0.068 1.00 . A A . 7 LYS HB2 1 1
6 1239 1 1 7 LYS HB3 H 9.925 2.769 0.312 1.00 . A A . 7 LYS HB3 1 1
6 1240 1 1 7 LYS HD2 H 9.189 -0.253 3.266 1.00 . A A . 7 LYS HD2 1 1
6 1241 1 1 7 LYS HD3 H 8.303 -0.325 1.744 1.00 . A A . 7 LYS HD3 1 1
6 1242 1 1 7 LYS HE2 H 10.372 -0.974 0.588 1.00 . A A . 7 LYS HE2 1 1
6 1243 1 1 7 LYS HE3 H 11.242 -0.899 2.116 1.00 . A A . 7 LYS HE3 1 1
6 1244 1 1 7 LYS HG2 H 10.611 1.529 2.322 1.00 . A A . 7 LYS HG2 1 1
6 1245 1 1 7 LYS HG3 H 8.925 1.996 2.397 1.00 . A A . 7 LYS HG3 1 1
6 1246 1 1 7 LYS HZ1 H 10.583 -3.176 1.519 1.00 . A A . 7 LYS HZ1 1 1
6 1247 1 1 7 LYS HZ2 H 8.960 -2.748 1.574 1.00 . A A . 7 LYS HZ2 1 1
6 1248 1 1 7 LYS HZ3 H 9.892 -2.689 2.964 1.00 . A A . 7 LYS HZ3 1 1
6 1249 1 1 7 LYS N N 8.215 0.076 -0.732 1.00 . A A . 7 LYS N 1 1
6 1250 1 1 7 LYS NZ N 9.907 -2.508 1.940 1.00 . A A . 7 LYS NZ 1 1
6 1251 1 1 7 LYS O O 8.959 1.922 -2.678 1.00 . A A . 7 LYS O 1 1
6 1252 1 1 8 PRO C C 5.573 3.145 -0.241 1.00 . A A . 8 PRO C 1 1
6 1253 1 1 8 PRO CA C 6.847 3.960 -0.544 1.00 . A A . 8 PRO CA 1 1
6 1254 1 1 8 PRO CB C 6.464 5.373 -0.991 1.00 . A A . 8 PRO CB 1 1
6 1255 1 1 8 PRO CD C 7.437 4.294 -2.885 1.00 . A A . 8 PRO CD 1 1
6 1256 1 1 8 PRO CG C 6.402 5.299 -2.472 1.00 . A A . 8 PRO CG 1 1
6 1257 1 1 8 PRO HA H 7.483 4.017 0.324 1.00 . A A . 8 PRO HA 1 1
6 1258 1 1 8 PRO HB2 H 5.504 5.624 -0.567 1.00 . A A . 8 PRO HB2 1 1
6 1259 1 1 8 PRO HB3 H 7.207 6.083 -0.659 1.00 . A A . 8 PRO HB3 1 1
6 1260 1 1 8 PRO HD2 H 7.084 3.710 -3.722 1.00 . A A . 8 PRO HD2 1 1
6 1261 1 1 8 PRO HD3 H 8.365 4.787 -3.131 1.00 . A A . 8 PRO HD3 1 1
6 1262 1 1 8 PRO HG2 H 5.419 4.972 -2.778 1.00 . A A . 8 PRO HG2 1 1
6 1263 1 1 8 PRO HG3 H 6.624 6.264 -2.900 1.00 . A A . 8 PRO HG3 1 1
6 1264 1 1 8 PRO N N 7.601 3.437 -1.704 1.00 . A A . 8 PRO N 1 1
6 1265 1 1 8 PRO O O 4.793 2.841 -1.157 1.00 . A A . 8 PRO O 1 1
6 1266 1 1 9 PRO C C 2.913 2.822 1.368 1.00 . A A . 9 PRO C 1 1
6 1267 1 1 9 PRO CA C 4.182 1.987 1.424 1.00 . A A . 9 PRO CA 1 1
6 1268 1 1 9 PRO CB C 4.479 1.553 2.876 1.00 . A A . 9 PRO CB 1 1
6 1269 1 1 9 PRO CD C 6.177 3.082 2.203 1.00 . A A . 9 PRO CD 1 1
6 1270 1 1 9 PRO CG C 5.901 1.926 3.112 1.00 . A A . 9 PRO CG 1 1
6 1271 1 1 9 PRO HA H 4.065 1.116 0.794 1.00 . A A . 9 PRO HA 1 1
6 1272 1 1 9 PRO HB2 H 3.814 2.077 3.547 1.00 . A A . 9 PRO HB2 1 1
6 1273 1 1 9 PRO HB3 H 4.327 0.488 2.975 1.00 . A A . 9 PRO HB3 1 1
6 1274 1 1 9 PRO HD2 H 5.873 4.008 2.670 1.00 . A A . 9 PRO HD2 1 1
6 1275 1 1 9 PRO HD3 H 7.226 3.100 1.954 1.00 . A A . 9 PRO HD3 1 1
6 1276 1 1 9 PRO HG2 H 6.042 2.215 4.143 1.00 . A A . 9 PRO HG2 1 1
6 1277 1 1 9 PRO HG3 H 6.545 1.094 2.865 1.00 . A A . 9 PRO HG3 1 1
6 1278 1 1 9 PRO N N 5.346 2.769 1.036 1.00 . A A . 9 PRO N 1 1
6 1279 1 1 9 PRO O O 2.630 3.614 2.268 1.00 . A A . 9 PRO O 1 1
6 1280 1 1 10 ILE C C -0.192 2.550 0.521 1.00 . A A . 10 ILE C 1 1
6 1281 1 1 10 ILE CA C 0.978 3.424 0.105 1.00 . A A . 10 ILE CA 1 1
6 1282 1 1 10 ILE CB C 0.823 3.898 -1.366 1.00 . A A . 10 ILE CB 1 1
6 1283 1 1 10 ILE CD1 C 1.876 5.443 -3.111 1.00 . A A . 10 ILE CD1 1 1
6 1284 1 1 10 ILE CG1 C 1.935 4.899 -1.706 1.00 . A A . 10 ILE CG1 1 1
6 1285 1 1 10 ILE CG2 C -0.556 4.503 -1.615 1.00 . A A . 10 ILE CG2 1 1
6 1286 1 1 10 ILE H H 2.534 2.118 -0.424 1.00 . A A . 10 ILE H 1 1
6 1287 1 1 10 ILE HA H 1.014 4.288 0.748 1.00 . A A . 10 ILE HA 1 1
6 1288 1 1 10 ILE HB H 0.931 3.037 -2.008 1.00 . A A . 10 ILE HB 1 1
6 1289 1 1 10 ILE HD11 H 0.940 5.963 -3.253 1.00 . A A . 10 ILE HD11 1 1
6 1290 1 1 10 ILE HD12 H 1.936 4.621 -3.808 1.00 . A A . 10 ILE HD12 1 1
6 1291 1 1 10 ILE HD13 H 2.698 6.123 -3.272 1.00 . A A . 10 ILE HD13 1 1
6 1292 1 1 10 ILE HG12 H 1.865 5.739 -1.031 1.00 . A A . 10 ILE HG12 1 1
6 1293 1 1 10 ILE HG13 H 2.893 4.420 -1.570 1.00 . A A . 10 ILE HG13 1 1
6 1294 1 1 10 ILE HG21 H -1.296 3.743 -1.413 1.00 . A A . 10 ILE HG21 1 1
6 1295 1 1 10 ILE HG22 H -0.627 4.817 -2.645 1.00 . A A . 10 ILE HG22 1 1
6 1296 1 1 10 ILE HG23 H -0.707 5.345 -0.957 1.00 . A A . 10 ILE HG23 1 1
6 1297 1 1 10 ILE N N 2.207 2.706 0.289 1.00 . A A . 10 ILE N 1 1
6 1298 1 1 10 ILE O O -0.211 1.349 0.222 1.00 . A A . 10 ILE O 1 1
6 1299 1 1 11 ALA C C -3.566 3.059 1.229 1.00 . A A . 11 ALA C 1 1
6 1300 1 1 11 ALA CA C -2.286 2.378 1.675 1.00 . A A . 11 ALA CA 1 1
6 1301 1 1 11 ALA CB C -2.318 2.127 3.198 1.00 . A A . 11 ALA CB 1 1
6 1302 1 1 11 ALA H H -1.062 4.067 1.501 1.00 . A A . 11 ALA H 1 1
6 1303 1 1 11 ALA HA H -2.237 1.423 1.172 1.00 . A A . 11 ALA HA 1 1
6 1304 1 1 11 ALA HB1 H -3.183 1.527 3.435 1.00 . A A . 11 ALA HB1 1 1
6 1305 1 1 11 ALA HB2 H -2.412 3.076 3.703 1.00 . A A . 11 ALA HB2 1 1
6 1306 1 1 11 ALA N N -1.133 3.122 1.249 1.00 . A A . 11 ALA N 1 1
6 1307 1 1 11 ALA O O -3.615 4.284 1.042 1.00 . A A . 11 ALA O 1 1
6 1308 1 1 12 PHE C C -6.898 2.035 1.578 1.00 . A A . 12 PHE C 1 1
6 1309 1 1 12 PHE CA C -5.887 2.669 0.634 1.00 . A A . 12 PHE CA 1 1
6 1310 1 1 12 PHE CB C -6.181 2.204 -0.802 1.00 . A A . 12 PHE CB 1 1
6 1311 1 1 12 PHE CD1 C -5.760 4.029 -2.472 1.00 . A A . 12 PHE CD1 1 1
6 1312 1 1 12 PHE CD2 C -4.146 2.289 -2.280 1.00 . A A . 12 PHE CD2 1 1
6 1313 1 1 12 PHE CE1 C -5.005 4.627 -3.457 1.00 . A A . 12 PHE CE1 1 1
6 1314 1 1 12 PHE CE2 C -3.387 2.887 -3.266 1.00 . A A . 12 PHE CE2 1 1
6 1315 1 1 12 PHE CG C -5.342 2.854 -1.870 1.00 . A A . 12 PHE CG 1 1
6 1316 1 1 12 PHE CZ C -3.818 4.056 -3.855 1.00 . A A . 12 PHE CZ 1 1
6 1317 1 1 12 PHE H H -4.412 1.297 1.175 1.00 . A A . 12 PHE H 1 1
6 1318 1 1 12 PHE HA H -5.937 3.745 0.681 1.00 . A A . 12 PHE HA 1 1
6 1319 1 1 12 PHE HB2 H -6.017 1.140 -0.855 1.00 . A A . 12 PHE HB2 1 1
6 1320 1 1 12 PHE HB3 H -7.221 2.398 -1.021 1.00 . A A . 12 PHE HB3 1 1
6 1321 1 1 12 PHE HD1 H -6.689 4.484 -2.165 1.00 . A A . 12 PHE HD1 1 1
6 1322 1 1 12 PHE HD2 H -3.807 1.373 -1.818 1.00 . A A . 12 PHE HD2 1 1
6 1323 1 1 12 PHE HE1 H -5.348 5.543 -3.917 1.00 . A A . 12 PHE HE1 1 1
6 1324 1 1 12 PHE HE2 H -2.455 2.446 -3.583 1.00 . A A . 12 PHE HE2 1 1
6 1325 1 1 12 PHE HZ H -3.226 4.522 -4.628 1.00 . A A . 12 PHE HZ 1 1
6 1326 1 1 12 PHE N N -4.569 2.258 1.041 1.00 . A A . 12 PHE N 1 1
6 1327 1 1 12 PHE O O -6.793 0.828 1.846 1.00 . A A . 12 PHE O 1 1
6 1328 1 1 13 PRO C C -9.769 1.163 2.486 1.00 . A A . 13 PRO C 1 1
6 1329 1 1 13 PRO CA C -8.923 2.323 3.057 1.00 . A A . 13 PRO CA 1 1
6 1330 1 1 13 PRO CB C -9.809 3.556 3.295 1.00 . A A . 13 PRO CB 1 1
6 1331 1 1 13 PRO CD C -8.081 4.255 1.807 1.00 . A A . 13 PRO CD 1 1
6 1332 1 1 13 PRO CG C -8.953 4.717 2.932 1.00 . A A . 13 PRO CG 1 1
6 1333 1 1 13 PRO HA H -8.475 2.009 3.987 1.00 . A A . 13 PRO HA 1 1
6 1334 1 1 13 PRO HB2 H -10.686 3.499 2.666 1.00 . A A . 13 PRO HB2 1 1
6 1335 1 1 13 PRO HB3 H -10.107 3.596 4.332 1.00 . A A . 13 PRO HB3 1 1
6 1336 1 1 13 PRO HD2 H -8.577 4.396 0.858 1.00 . A A . 13 PRO HD2 1 1
6 1337 1 1 13 PRO HD3 H -7.142 4.787 1.832 1.00 . A A . 13 PRO HD3 1 1
6 1338 1 1 13 PRO HG2 H -9.571 5.543 2.612 1.00 . A A . 13 PRO HG2 1 1
6 1339 1 1 13 PRO HG3 H -8.350 5.008 3.780 1.00 . A A . 13 PRO HG3 1 1
6 1340 1 1 13 PRO N N -7.884 2.820 2.100 1.00 . A A . 13 PRO N 1 1
6 1341 1 1 13 PRO O O -10.518 0.499 3.208 1.00 . A A . 13 PRO O 1 1
6 1342 1 1 14 ASP C C -9.701 -1.479 0.968 1.00 . A A . 14 ASP C 1 1
6 1343 1 1 14 ASP CA C -10.272 -0.155 0.466 1.00 . A A . 14 ASP CA 1 1
6 1344 1 1 14 ASP CB C -9.963 -0.006 -1.036 1.00 . A A . 14 ASP CB 1 1
6 1345 1 1 14 ASP CG C -10.540 -1.103 -1.912 1.00 . A A . 14 ASP CG 1 1
6 1346 1 1 14 ASP H H -9.090 1.594 0.689 1.00 . A A . 14 ASP H 1 1
6 1347 1 1 14 ASP HA H -11.340 -0.120 0.616 1.00 . A A . 14 ASP HA 1 1
6 1348 1 1 14 ASP HB2 H -10.364 0.935 -1.382 1.00 . A A . 14 ASP HB2 1 1
6 1349 1 1 14 ASP HB3 H -8.890 0.008 -1.164 1.00 . A A . 14 ASP HB3 1 1
6 1350 1 1 14 ASP N N -9.638 0.949 1.186 1.00 . A A . 14 ASP N 1 1
6 1351 1 1 14 ASP O O -10.368 -2.525 0.959 1.00 . A A . 14 ASP O 1 1
6 1352 1 1 14 ASP OD1 O -9.921 -2.175 -2.048 1.00 . A A . 14 ASP OD1 1 1
6 1353 1 1 14 ASP OD2 O -11.599 -0.893 -2.530 1.00 . A A . 14 ASP OD2 1 1
6 1354 2 2 1 . C C -1.859 -0.915 3.805 1.00 . B A . 101 WMH C 1 1
6 1355 2 2 1 . C1 C -1.084 1.442 3.761 1.00 . B A . 101 WMH C1 1 1
6 1356 2 2 1 . C2 C 0.095 2.044 4.061 1.00 . B A . 101 WMH C2 1 1
6 1357 2 2 1 . H1 H -2.121 -1.352 4.757 1.00 . B A . 101 WMH H1 1 1
6 1358 2 2 1 . H2 H -2.742 -0.493 3.351 1.00 . B A . 101 WMH H2 1 1
6 1359 2 2 1 . H5 H 0.304 3.100 3.972 1.00 . B A . 101 WMH H5 1 1
6 1360 2 2 1 . N N -0.930 0.125 4.004 1.00 . B A . 101 WMH N 1 1
6 1361 2 2 1 . N1 N 0.952 1.118 4.482 1.00 . B A . 101 WMH N1 1 1
6 1362 2 2 1 . N2 N 0.384 -0.037 4.467 1.00 . B A . 101 WMH N2 1 1
7 1363 1 1 1 GLY C C -6.716 -2.934 1.715 1.00 . A A . 1 GLY C 1 1
7 1364 1 1 1 GLY CA C -7.803 -2.532 2.671 1.00 . A A . 1 GLY CA 1 1
7 1365 1 1 1 GLY H1 H -8.069 -0.493 2.225 1.00 . A A . 1 GLY H1 1 1
7 1366 1 1 1 GLY HA2 H -7.371 -2.315 3.637 1.00 . A A . 1 GLY HA2 1 1
7 1367 1 1 1 GLY HA3 H -8.497 -3.351 2.769 1.00 . A A . 1 GLY HA3 1 1
7 1368 1 1 1 GLY N N -8.503 -1.373 2.190 1.00 . A A . 1 GLY N 1 1
7 1369 1 1 1 GLY O O -6.169 -4.032 1.801 1.00 . A A . 1 GLY O 1 1
7 1370 1 1 2 ARG C C -4.074 -1.633 0.153 1.00 . A A . 2 ARG C 1 1
7 1371 1 1 2 ARG CA C -5.394 -2.293 -0.204 1.00 . A A . 2 ARG CA 1 1
7 1372 1 1 2 ARG CB C -5.906 -1.782 -1.557 1.00 . A A . 2 ARG CB 1 1
7 1373 1 1 2 ARG CD C -7.706 -1.856 -3.323 1.00 . A A . 2 ARG CD 1 1
7 1374 1 1 2 ARG CG C -7.162 -2.492 -2.051 1.00 . A A . 2 ARG CG 1 1
7 1375 1 1 2 ARG CZ C -8.228 0.500 -4.008 1.00 . A A . 2 ARG CZ 1 1
7 1376 1 1 2 ARG H H -6.753 -1.129 0.904 1.00 . A A . 2 ARG H 1 1
7 1377 1 1 2 ARG HA H -5.250 -3.362 -0.262 1.00 . A A . 2 ARG HA 1 1
7 1378 1 1 2 ARG HB2 H -6.127 -0.731 -1.470 1.00 . A A . 2 ARG HB2 1 1
7 1379 1 1 2 ARG HB3 H -5.129 -1.915 -2.295 1.00 . A A . 2 ARG HB3 1 1
7 1380 1 1 2 ARG HD2 H -6.907 -1.811 -4.045 1.00 . A A . 2 ARG HD2 1 1
7 1381 1 1 2 ARG HD3 H -8.505 -2.471 -3.710 1.00 . A A . 2 ARG HD3 1 1
7 1382 1 1 2 ARG HE H -8.602 -0.320 -2.207 1.00 . A A . 2 ARG HE 1 1
7 1383 1 1 2 ARG HG2 H -6.924 -3.525 -2.254 1.00 . A A . 2 ARG HG2 1 1
7 1384 1 1 2 ARG HG3 H -7.916 -2.441 -1.279 1.00 . A A . 2 ARG HG3 1 1
7 1385 1 1 2 ARG HH11 H -7.328 -0.571 -5.495 1.00 . A A . 2 ARG HH11 1 1
7 1386 1 1 2 ARG HH12 H -7.732 1.025 -5.907 1.00 . A A . 2 ARG HH12 1 1
7 1387 1 1 2 ARG HH21 H -9.187 1.856 -2.809 1.00 . A A . 2 ARG HH21 1 1
7 1388 1 1 2 ARG HH22 H -8.762 2.426 -4.373 1.00 . A A . 2 ARG HH22 1 1
7 1389 1 1 2 ARG N N -6.371 -2.029 0.828 1.00 . A A . 2 ARG N 1 1
7 1390 1 1 2 ARG NE N -8.220 -0.488 -3.095 1.00 . A A . 2 ARG NE 1 1
7 1391 1 1 2 ARG NH1 N -7.729 0.303 -5.209 1.00 . A A . 2 ARG NH1 1 1
7 1392 1 1 2 ARG NH2 N -8.765 1.673 -3.709 1.00 . A A . 2 ARG NH2 1 1
7 1393 1 1 2 ARG O O -3.958 -0.422 0.117 1.00 . A A . 2 ARG O 1 1
7 1394 1 1 3 ALA C C -0.716 -2.581 0.069 1.00 . A A . 3 ALA C 1 1
7 1395 1 1 3 ALA CA C -1.795 -1.958 0.918 1.00 . A A . 3 ALA CA 1 1
7 1396 1 1 3 ALA CB C -1.526 -2.249 2.401 1.00 . A A . 3 ALA CB 1 1
7 1397 1 1 3 ALA H H -3.274 -3.396 0.559 1.00 . A A . 3 ALA H 1 1
7 1398 1 1 3 ALA HA H -1.771 -0.889 0.775 1.00 . A A . 3 ALA HA 1 1
7 1399 1 1 3 ALA HB1 H -0.473 -2.451 2.529 1.00 . A A . 3 ALA HB1 1 1
7 1400 1 1 3 ALA HB2 H -2.086 -3.128 2.680 1.00 . A A . 3 ALA HB2 1 1
7 1401 1 1 3 ALA N N -3.117 -2.427 0.532 1.00 . A A . 3 ALA N 1 1
7 1402 1 1 3 ALA O O -0.851 -3.723 -0.404 1.00 . A A . 3 ALA O 1 1
7 1403 1 1 4 TYR C C 2.646 -2.258 0.068 1.00 . A A . 4 TYR C 1 1
7 1404 1 1 4 TYR CA C 1.478 -2.291 -0.872 1.00 . A A . 4 TYR CA 1 1
7 1405 1 1 4 TYR CB C 1.793 -1.411 -2.087 1.00 . A A . 4 TYR CB 1 1
7 1406 1 1 4 TYR CD1 C 0.807 -2.422 -4.156 1.00 . A A . 4 TYR CD1 1 1
7 1407 1 1 4 TYR CD2 C -0.265 -0.518 -3.223 1.00 . A A . 4 TYR CD2 1 1
7 1408 1 1 4 TYR CE1 C -0.129 -2.468 -5.156 1.00 . A A . 4 TYR CE1 1 1
7 1409 1 1 4 TYR CE2 C -1.208 -0.558 -4.220 1.00 . A A . 4 TYR CE2 1 1
7 1410 1 1 4 TYR CG C 0.757 -1.450 -3.174 1.00 . A A . 4 TYR CG 1 1
7 1411 1 1 4 TYR CZ C -1.134 -1.535 -5.183 1.00 . A A . 4 TYR CZ 1 1
7 1412 1 1 4 TYR H H 0.299 -0.881 0.113 1.00 . A A . 4 TYR H 1 1
7 1413 1 1 4 TYR HA H 1.302 -3.304 -1.202 1.00 . A A . 4 TYR HA 1 1
7 1414 1 1 4 TYR HB2 H 1.884 -0.386 -1.761 1.00 . A A . 4 TYR HB2 1 1
7 1415 1 1 4 TYR HB3 H 2.736 -1.727 -2.510 1.00 . A A . 4 TYR HB3 1 1
7 1416 1 1 4 TYR HD1 H 1.599 -3.154 -4.129 1.00 . A A . 4 TYR HD1 1 1
7 1417 1 1 4 TYR HD2 H -0.315 0.247 -2.462 1.00 . A A . 4 TYR HD2 1 1
7 1418 1 1 4 TYR HE1 H -0.063 -3.239 -5.910 1.00 . A A . 4 TYR HE1 1 1
7 1419 1 1 4 TYR HE2 H -1.998 0.178 -4.240 1.00 . A A . 4 TYR HE2 1 1
7 1420 1 1 4 TYR HH H -2.390 -2.485 -6.227 1.00 . A A . 4 TYR HH 1 1
7 1421 1 1 4 TYR N N 0.312 -1.822 -0.174 1.00 . A A . 4 TYR N 1 1
7 1422 1 1 4 TYR O O 2.867 -1.248 0.751 1.00 . A A . 4 TYR O 1 1
7 1423 1 1 4 TYR OH O -2.065 -1.577 -6.176 1.00 . A A . 4 TYR OH 1 1
7 1424 1 1 5 LYS C C 5.708 -2.989 0.071 1.00 . A A . 5 LYS C 1 1
7 1425 1 1 5 LYS CA C 4.548 -3.365 0.959 1.00 . A A . 5 LYS CA 1 1
7 1426 1 1 5 LYS CB C 4.801 -4.719 1.660 1.00 . A A . 5 LYS CB 1 1
7 1427 1 1 5 LYS CD C 2.573 -5.968 1.695 1.00 . A A . 5 LYS CD 1 1
7 1428 1 1 5 LYS CE C 3.110 -7.265 1.092 1.00 . A A . 5 LYS CE 1 1
7 1429 1 1 5 LYS CG C 3.645 -5.259 2.523 1.00 . A A . 5 LYS CG 1 1
7 1430 1 1 5 LYS H H 3.143 -4.128 -0.396 1.00 . A A . 5 LYS H 1 1
7 1431 1 1 5 LYS HA H 4.430 -2.582 1.694 1.00 . A A . 5 LYS HA 1 1
7 1432 1 1 5 LYS HB2 H 5.039 -5.452 0.906 1.00 . A A . 5 LYS HB2 1 1
7 1433 1 1 5 LYS HB3 H 5.665 -4.598 2.297 1.00 . A A . 5 LYS HB3 1 1
7 1434 1 1 5 LYS HD2 H 1.731 -6.198 2.331 1.00 . A A . 5 LYS HD2 1 1
7 1435 1 1 5 LYS HD3 H 2.253 -5.312 0.898 1.00 . A A . 5 LYS HD3 1 1
7 1436 1 1 5 LYS HE2 H 4.001 -7.062 0.519 1.00 . A A . 5 LYS HE2 1 1
7 1437 1 1 5 LYS HE3 H 3.351 -7.945 1.895 1.00 . A A . 5 LYS HE3 1 1
7 1438 1 1 5 LYS HG2 H 4.043 -5.964 3.237 1.00 . A A . 5 LYS HG2 1 1
7 1439 1 1 5 LYS HG3 H 3.193 -4.433 3.051 1.00 . A A . 5 LYS HG3 1 1
7 1440 1 1 5 LYS HZ1 H 1.876 -7.282 -0.585 1.00 . A A . 5 LYS HZ1 1 1
7 1441 1 1 5 LYS HZ2 H 1.267 -8.158 0.717 1.00 . A A . 5 LYS HZ2 1 1
7 1442 1 1 5 LYS HZ3 H 2.515 -8.794 -0.200 1.00 . A A . 5 LYS HZ3 1 1
7 1443 1 1 5 LYS N N 3.373 -3.341 0.142 1.00 . A A . 5 LYS N 1 1
7 1444 1 1 5 LYS NZ N 2.133 -7.913 0.200 1.00 . A A . 5 LYS NZ 1 1
7 1445 1 1 5 LYS O O 6.336 -3.841 -0.579 1.00 . A A . 5 LYS O 1 1
7 1446 1 1 6 SER C C 7.518 0.024 -0.131 1.00 . A A . 6 SER C 1 1
7 1447 1 1 6 SER CA C 6.886 -1.136 -0.872 1.00 . A A . 6 SER CA 1 1
7 1448 1 1 6 SER CB C 6.203 -0.677 -2.167 1.00 . A A . 6 SER CB 1 1
7 1449 1 1 6 SER H H 5.324 -1.103 0.462 1.00 . A A . 6 SER H 1 1
7 1450 1 1 6 SER HA H 7.634 -1.876 -1.111 1.00 . A A . 6 SER HA 1 1
7 1451 1 1 6 SER HB2 H 6.881 -0.047 -2.725 1.00 . A A . 6 SER HB2 1 1
7 1452 1 1 6 SER HB3 H 5.940 -1.538 -2.762 1.00 . A A . 6 SER HB3 1 1
7 1453 1 1 6 SER HG H 4.910 0.732 -2.574 1.00 . A A . 6 SER HG 1 1
7 1454 1 1 6 SER N N 5.899 -1.723 -0.036 1.00 . A A . 6 SER N 1 1
7 1455 1 1 6 SER O O 7.105 0.331 0.987 1.00 . A A . 6 SER O 1 1
7 1456 1 1 6 SER OG O 5.017 0.066 -1.886 1.00 . A A . 6 SER OG 1 1
7 1457 1 1 7 LYS C C 8.993 2.945 -1.080 1.00 . A A . 7 LYS C 1 1
7 1458 1 1 7 LYS CA C 9.173 1.775 -0.103 1.00 . A A . 7 LYS CA 1 1
7 1459 1 1 7 LYS CB C 10.679 1.578 0.189 1.00 . A A . 7 LYS CB 1 1
7 1460 1 1 7 LYS CD C 10.581 -0.675 1.408 1.00 . A A . 7 LYS CD 1 1
7 1461 1 1 7 LYS CE C 10.989 -1.421 2.673 1.00 . A A . 7 LYS CE 1 1
7 1462 1 1 7 LYS CG C 11.038 0.775 1.450 1.00 . A A . 7 LYS CG 1 1
7 1463 1 1 7 LYS H H 8.967 0.207 -1.487 1.00 . A A . 7 LYS H 1 1
7 1464 1 1 7 LYS HA H 8.652 1.967 0.822 1.00 . A A . 7 LYS HA 1 1
7 1465 1 1 7 LYS HB2 H 11.123 1.072 -0.656 1.00 . A A . 7 LYS HB2 1 1
7 1466 1 1 7 LYS HB3 H 11.126 2.557 0.273 1.00 . A A . 7 LYS HB3 1 1
7 1467 1 1 7 LYS HD2 H 9.506 -0.701 1.312 1.00 . A A . 7 LYS HD2 1 1
7 1468 1 1 7 LYS HD3 H 11.030 -1.159 0.553 1.00 . A A . 7 LYS HD3 1 1
7 1469 1 1 7 LYS HE2 H 10.655 -2.444 2.593 1.00 . A A . 7 LYS HE2 1 1
7 1470 1 1 7 LYS HE3 H 12.067 -1.398 2.744 1.00 . A A . 7 LYS HE3 1 1
7 1471 1 1 7 LYS HG2 H 12.110 0.784 1.571 1.00 . A A . 7 LYS HG2 1 1
7 1472 1 1 7 LYS HG3 H 10.587 1.263 2.302 1.00 . A A . 7 LYS HG3 1 1
7 1473 1 1 7 LYS HZ1 H 10.694 0.169 4.030 1.00 . A A . 7 LYS HZ1 1 1
7 1474 1 1 7 LYS HZ2 H 10.730 -1.353 4.738 1.00 . A A . 7 LYS HZ2 1 1
7 1475 1 1 7 LYS HZ3 H 9.370 -0.867 3.890 1.00 . A A . 7 LYS HZ3 1 1
7 1476 1 1 7 LYS N N 8.572 0.583 -0.670 1.00 . A A . 7 LYS N 1 1
7 1477 1 1 7 LYS NZ N 10.409 -0.825 3.901 1.00 . A A . 7 LYS NZ 1 1
7 1478 1 1 7 LYS O O 9.627 2.958 -2.140 1.00 . A A . 7 LYS O 1 1
7 1479 1 1 8 PRO C C 6.007 3.215 0.290 1.00 . A A . 8 PRO C 1 1
7 1480 1 1 8 PRO CA C 7.318 4.008 0.441 1.00 . A A . 8 PRO CA 1 1
7 1481 1 1 8 PRO CB C 7.001 5.517 0.573 1.00 . A A . 8 PRO CB 1 1
7 1482 1 1 8 PRO CD C 7.860 5.086 -1.636 1.00 . A A . 8 PRO CD 1 1
7 1483 1 1 8 PRO CG C 7.569 6.174 -0.653 1.00 . A A . 8 PRO CG 1 1
7 1484 1 1 8 PRO HA H 7.874 3.675 1.303 1.00 . A A . 8 PRO HA 1 1
7 1485 1 1 8 PRO HB2 H 5.930 5.649 0.629 1.00 . A A . 8 PRO HB2 1 1
7 1486 1 1 8 PRO HB3 H 7.457 5.901 1.472 1.00 . A A . 8 PRO HB3 1 1
7 1487 1 1 8 PRO HD2 H 7.004 4.902 -2.269 1.00 . A A . 8 PRO HD2 1 1
7 1488 1 1 8 PRO HD3 H 8.727 5.329 -2.231 1.00 . A A . 8 PRO HD3 1 1
7 1489 1 1 8 PRO HG2 H 6.848 6.861 -1.068 1.00 . A A . 8 PRO HG2 1 1
7 1490 1 1 8 PRO HG3 H 8.478 6.701 -0.402 1.00 . A A . 8 PRO HG3 1 1
7 1491 1 1 8 PRO N N 8.127 3.940 -0.780 1.00 . A A . 8 PRO N 1 1
7 1492 1 1 8 PRO O O 5.522 3.023 -0.840 1.00 . A A . 8 PRO O 1 1
7 1493 1 1 9 PRO C C 2.980 2.788 1.010 1.00 . A A . 9 PRO C 1 1
7 1494 1 1 9 PRO CA C 4.200 1.939 1.352 1.00 . A A . 9 PRO CA 1 1
7 1495 1 1 9 PRO CB C 4.069 1.359 2.773 1.00 . A A . 9 PRO CB 1 1
7 1496 1 1 9 PRO CD C 5.883 2.926 2.780 1.00 . A A . 9 PRO CD 1 1
7 1497 1 1 9 PRO CG C 5.322 1.737 3.491 1.00 . A A . 9 PRO CG 1 1
7 1498 1 1 9 PRO HA H 4.286 1.136 0.635 1.00 . A A . 9 PRO HA 1 1
7 1499 1 1 9 PRO HB2 H 3.200 1.787 3.250 1.00 . A A . 9 PRO HB2 1 1
7 1500 1 1 9 PRO HB3 H 3.956 0.288 2.715 1.00 . A A . 9 PRO HB3 1 1
7 1501 1 1 9 PRO HD2 H 5.483 3.837 3.202 1.00 . A A . 9 PRO HD2 1 1
7 1502 1 1 9 PRO HD3 H 6.959 2.915 2.841 1.00 . A A . 9 PRO HD3 1 1
7 1503 1 1 9 PRO HG2 H 5.094 1.991 4.516 1.00 . A A . 9 PRO HG2 1 1
7 1504 1 1 9 PRO HG3 H 6.024 0.917 3.459 1.00 . A A . 9 PRO HG3 1 1
7 1505 1 1 9 PRO N N 5.420 2.735 1.397 1.00 . A A . 9 PRO N 1 1
7 1506 1 1 9 PRO O O 2.696 3.794 1.672 1.00 . A A . 9 PRO O 1 1
7 1507 1 1 10 ILE C C -0.125 2.273 -0.091 1.00 . A A . 10 ILE C 1 1
7 1508 1 1 10 ILE CA C 1.087 3.105 -0.461 1.00 . A A . 10 ILE CA 1 1
7 1509 1 1 10 ILE CB C 1.116 3.359 -2.000 1.00 . A A . 10 ILE CB 1 1
7 1510 1 1 10 ILE CD1 C 2.421 5.569 -1.721 1.00 . A A . 10 ILE CD1 1 1
7 1511 1 1 10 ILE CG1 C 2.345 4.206 -2.394 1.00 . A A . 10 ILE CG1 1 1
7 1512 1 1 10 ILE CG2 C -0.176 4.017 -2.492 1.00 . A A . 10 ILE CG2 1 1
7 1513 1 1 10 ILE H H 2.556 1.591 -0.503 1.00 . A A . 10 ILE H 1 1
7 1514 1 1 10 ILE HA H 1.040 4.049 0.060 1.00 . A A . 10 ILE HA 1 1
7 1515 1 1 10 ILE HB H 1.196 2.397 -2.486 1.00 . A A . 10 ILE HB 1 1
7 1516 1 1 10 ILE HD11 H 2.497 5.442 -0.651 1.00 . A A . 10 ILE HD11 1 1
7 1517 1 1 10 ILE HD12 H 1.530 6.133 -1.952 1.00 . A A . 10 ILE HD12 1 1
7 1518 1 1 10 ILE HD13 H 3.288 6.100 -2.083 1.00 . A A . 10 ILE HD13 1 1
7 1519 1 1 10 ILE HG12 H 3.239 3.666 -2.126 1.00 . A A . 10 ILE HG12 1 1
7 1520 1 1 10 ILE HG13 H 2.333 4.361 -3.462 1.00 . A A . 10 ILE HG13 1 1
7 1521 1 1 10 ILE HG21 H -0.300 4.968 -1.996 1.00 . A A . 10 ILE HG21 1 1
7 1522 1 1 10 ILE HG22 H -1.016 3.379 -2.262 1.00 . A A . 10 ILE HG22 1 1
7 1523 1 1 10 ILE HG23 H -0.120 4.172 -3.559 1.00 . A A . 10 ILE HG23 1 1
7 1524 1 1 10 ILE N N 2.278 2.399 -0.023 1.00 . A A . 10 ILE N 1 1
7 1525 1 1 10 ILE O O -0.142 1.059 -0.342 1.00 . A A . 10 ILE O 1 1
7 1526 1 1 11 ALA C C -3.540 2.911 0.619 1.00 . A A . 11 ALA C 1 1
7 1527 1 1 11 ALA CA C -2.285 2.151 0.966 1.00 . A A . 11 ALA CA 1 1
7 1528 1 1 11 ALA CB C -2.302 1.862 2.489 1.00 . A A . 11 ALA CB 1 1
7 1529 1 1 11 ALA H H -1.063 3.852 0.713 1.00 . A A . 11 ALA H 1 1
7 1530 1 1 11 ALA HA H -2.292 1.209 0.440 1.00 . A A . 11 ALA HA 1 1
7 1531 1 1 11 ALA HB1 H -3.169 1.260 2.712 1.00 . A A . 11 ALA HB1 1 1
7 1532 1 1 11 ALA HB2 H -2.401 2.803 3.011 1.00 . A A . 11 ALA HB2 1 1
7 1533 1 1 11 ALA N N -1.109 2.886 0.545 1.00 . A A . 11 ALA N 1 1
7 1534 1 1 11 ALA O O -3.532 4.142 0.498 1.00 . A A . 11 ALA O 1 1
7 1535 1 1 12 PHE C C -6.810 2.116 1.285 1.00 . A A . 12 PHE C 1 1
7 1536 1 1 12 PHE CA C -5.902 2.707 0.222 1.00 . A A . 12 PHE CA 1 1
7 1537 1 1 12 PHE CB C -6.408 2.332 -1.181 1.00 . A A . 12 PHE CB 1 1
7 1538 1 1 12 PHE CD1 C -5.758 4.165 -2.768 1.00 . A A . 12 PHE CD1 1 1
7 1539 1 1 12 PHE CD2 C -4.583 2.096 -2.900 1.00 . A A . 12 PHE CD2 1 1
7 1540 1 1 12 PHE CE1 C -4.990 4.669 -3.800 1.00 . A A . 12 PHE CE1 1 1
7 1541 1 1 12 PHE CE2 C -3.813 2.598 -3.931 1.00 . A A . 12 PHE CE2 1 1
7 1542 1 1 12 PHE CG C -5.566 2.875 -2.306 1.00 . A A . 12 PHE CG 1 1
7 1543 1 1 12 PHE CZ C -4.017 3.884 -4.380 1.00 . A A . 12 PHE CZ 1 1
7 1544 1 1 12 PHE H H -4.491 1.203 0.498 1.00 . A A . 12 PHE H 1 1
7 1545 1 1 12 PHE HA H -5.843 3.780 0.319 1.00 . A A . 12 PHE HA 1 1
7 1546 1 1 12 PHE HB2 H -6.429 1.258 -1.272 1.00 . A A . 12 PHE HB2 1 1
7 1547 1 1 12 PHE HB3 H -7.412 2.713 -1.302 1.00 . A A . 12 PHE HB3 1 1
7 1548 1 1 12 PHE HD1 H -6.518 4.784 -2.315 1.00 . A A . 12 PHE HD1 1 1
7 1549 1 1 12 PHE HD2 H -4.421 1.088 -2.548 1.00 . A A . 12 PHE HD2 1 1
7 1550 1 1 12 PHE HE1 H -5.150 5.676 -4.151 1.00 . A A . 12 PHE HE1 1 1
7 1551 1 1 12 PHE HE2 H -3.050 1.985 -4.386 1.00 . A A . 12 PHE HE2 1 1
7 1552 1 1 12 PHE HZ H -3.412 4.274 -5.186 1.00 . A A . 12 PHE HZ 1 1
7 1553 1 1 12 PHE N N -4.593 2.183 0.455 1.00 . A A . 12 PHE N 1 1
7 1554 1 1 12 PHE O O -6.774 0.881 1.498 1.00 . A A . 12 PHE O 1 1
7 1555 1 1 13 PRO C C -9.542 1.449 2.794 1.00 . A A . 13 PRO C 1 1
7 1556 1 1 13 PRO CA C -8.507 2.543 3.117 1.00 . A A . 13 PRO CA 1 1
7 1557 1 1 13 PRO CB C -9.219 3.833 3.526 1.00 . A A . 13 PRO CB 1 1
7 1558 1 1 13 PRO CD C -7.780 4.401 1.709 1.00 . A A . 13 PRO CD 1 1
7 1559 1 1 13 PRO CG C -8.374 4.925 2.981 1.00 . A A . 13 PRO CG 1 1
7 1560 1 1 13 PRO HA H -7.897 2.206 3.940 1.00 . A A . 13 PRO HA 1 1
7 1561 1 1 13 PRO HB2 H -10.214 3.845 3.106 1.00 . A A . 13 PRO HB2 1 1
7 1562 1 1 13 PRO HB3 H -9.283 3.886 4.602 1.00 . A A . 13 PRO HB3 1 1
7 1563 1 1 13 PRO HD2 H -8.440 4.589 0.875 1.00 . A A . 13 PRO HD2 1 1
7 1564 1 1 13 PRO HD3 H -6.818 4.866 1.556 1.00 . A A . 13 PRO HD3 1 1
7 1565 1 1 13 PRO HG2 H -8.984 5.791 2.774 1.00 . A A . 13 PRO HG2 1 1
7 1566 1 1 13 PRO HG3 H -7.593 5.174 3.684 1.00 . A A . 13 PRO HG3 1 1
7 1567 1 1 13 PRO N N -7.637 2.958 1.971 1.00 . A A . 13 PRO N 1 1
7 1568 1 1 13 PRO O O -10.362 1.089 3.628 1.00 . A A . 13 PRO O 1 1
7 1569 1 1 14 ASP C C -9.735 -1.462 1.735 1.00 . A A . 14 ASP C 1 1
7 1570 1 1 14 ASP CA C -10.330 -0.178 1.179 1.00 . A A . 14 ASP CA 1 1
7 1571 1 1 14 ASP CB C -10.345 -0.308 -0.343 1.00 . A A . 14 ASP CB 1 1
7 1572 1 1 14 ASP CG C -10.849 0.902 -1.075 1.00 . A A . 14 ASP CG 1 1
7 1573 1 1 14 ASP H H -8.880 1.358 0.956 1.00 . A A . 14 ASP H 1 1
7 1574 1 1 14 ASP HA H -11.337 -0.036 1.539 1.00 . A A . 14 ASP HA 1 1
7 1575 1 1 14 ASP HB2 H -9.337 -0.506 -0.672 1.00 . A A . 14 ASP HB2 1 1
7 1576 1 1 14 ASP HB3 H -10.964 -1.155 -0.596 1.00 . A A . 14 ASP HB3 1 1
7 1577 1 1 14 ASP N N -9.500 0.941 1.591 1.00 . A A . 14 ASP N 1 1
7 1578 1 1 14 ASP O O -10.372 -2.510 1.742 1.00 . A A . 14 ASP O 1 1
7 1579 1 1 14 ASP OD1 O -10.035 1.794 -1.382 1.00 . A A . 14 ASP OD1 1 1
7 1580 1 1 14 ASP OD2 O -12.062 0.972 -1.392 1.00 . A A . 14 ASP OD2 1 1
7 1581 2 2 1 . C C -1.921 -1.142 3.361 1.00 . B A . 101 WMH C 1 1
7 1582 2 2 1 . C1 C -1.073 1.181 3.061 1.00 . B A . 101 WMH C1 1 1
7 1583 2 2 1 . C2 C 0.119 1.771 3.279 1.00 . B A . 101 WMH C2 1 1
7 1584 2 2 1 . H1 H -2.057 -1.565 4.345 1.00 . B A . 101 WMH H1 1 1
7 1585 2 2 1 . H2 H -2.852 -0.710 3.027 1.00 . B A . 101 WMH H2 1 1
7 1586 2 2 1 . H5 H 0.349 2.809 3.087 1.00 . B A . 101 WMH H5 1 1
7 1587 2 2 1 . N N -0.952 -0.114 3.423 1.00 . B A . 101 WMH N 1 1
7 1588 2 2 1 . N1 N 0.961 0.877 3.766 1.00 . B A . 101 WMH N1 1 1
7 1589 2 2 1 . N2 N 0.374 -0.263 3.872 1.00 . B A . 101 WMH N2 1 1
8 1590 1 1 1 GLY C C -6.911 -2.875 1.272 1.00 . A A . 1 GLY C 1 1
8 1591 1 1 1 GLY CA C -7.949 -2.352 2.197 1.00 . A A . 1 GLY CA 1 1
8 1592 1 1 1 GLY H1 H -8.049 -0.350 1.570 1.00 . A A . 1 GLY H1 1 1
8 1593 1 1 1 GLY HA2 H -7.504 -2.080 3.143 1.00 . A A . 1 GLY HA2 1 1
8 1594 1 1 1 GLY HA3 H -8.701 -3.110 2.351 1.00 . A A . 1 GLY HA3 1 1
8 1595 1 1 1 GLY N N -8.548 -1.194 1.609 1.00 . A A . 1 GLY N 1 1
8 1596 1 1 1 GLY O O -6.865 -4.062 0.978 1.00 . A A . 1 GLY O 1 1
8 1597 1 1 2 ARG C C -3.760 -1.804 0.261 1.00 . A A . 2 ARG C 1 1
8 1598 1 1 2 ARG CA C -5.105 -2.329 -0.194 1.00 . A A . 2 ARG CA 1 1
8 1599 1 1 2 ARG CB C -5.493 -1.682 -1.531 1.00 . A A . 2 ARG CB 1 1
8 1600 1 1 2 ARG CD C -5.474 -3.758 -2.922 1.00 . A A . 2 ARG CD 1 1
8 1601 1 1 2 ARG CG C -4.925 -2.349 -2.775 1.00 . A A . 2 ARG CG 1 1
8 1602 1 1 2 ARG CZ C -7.643 -4.744 -2.199 1.00 . A A . 2 ARG CZ 1 1
8 1603 1 1 2 ARG H H -6.116 -1.063 1.130 1.00 . A A . 2 ARG H 1 1
8 1604 1 1 2 ARG HA H -5.082 -3.401 -0.311 1.00 . A A . 2 ARG HA 1 1
8 1605 1 1 2 ARG HB2 H -6.570 -1.684 -1.618 1.00 . A A . 2 ARG HB2 1 1
8 1606 1 1 2 ARG HB3 H -5.151 -0.660 -1.515 1.00 . A A . 2 ARG HB3 1 1
8 1607 1 1 2 ARG HD2 H -5.206 -4.134 -3.899 1.00 . A A . 2 ARG HD2 1 1
8 1608 1 1 2 ARG HD3 H -5.048 -4.394 -2.163 1.00 . A A . 2 ARG HD3 1 1
8 1609 1 1 2 ARG HE H -7.397 -2.958 -3.108 1.00 . A A . 2 ARG HE 1 1
8 1610 1 1 2 ARG HG2 H -5.197 -1.769 -3.645 1.00 . A A . 2 ARG HG2 1 1
8 1611 1 1 2 ARG HG3 H -3.849 -2.397 -2.690 1.00 . A A . 2 ARG HG3 1 1
8 1612 1 1 2 ARG HH11 H -6.082 -6.067 -2.037 1.00 . A A . 2 ARG HH11 1 1
8 1613 1 1 2 ARG HH12 H -7.570 -6.630 -1.422 1.00 . A A . 2 ARG HH12 1 1
8 1614 1 1 2 ARG HH21 H -9.414 -3.701 -2.152 1.00 . A A . 2 ARG HH21 1 1
8 1615 1 1 2 ARG HH22 H -9.483 -5.280 -1.509 1.00 . A A . 2 ARG HH22 1 1
8 1616 1 1 2 ARG N N -6.085 -1.983 0.790 1.00 . A A . 2 ARG N 1 1
8 1617 1 1 2 ARG NE N -6.940 -3.771 -2.788 1.00 . A A . 2 ARG NE 1 1
8 1618 1 1 2 ARG NH1 N -7.052 -5.892 -1.865 1.00 . A A . 2 ARG NH1 1 1
8 1619 1 1 2 ARG NH2 N -8.927 -4.561 -1.937 1.00 . A A . 2 ARG NH2 1 1
8 1620 1 1 2 ARG O O -3.513 -0.601 0.203 1.00 . A A . 2 ARG O 1 1
8 1621 1 1 3 ALA C C -0.535 -2.791 0.332 1.00 . A A . 3 ALA C 1 1
8 1622 1 1 3 ALA CA C -1.622 -2.294 1.236 1.00 . A A . 3 ALA CA 1 1
8 1623 1 1 3 ALA CB C -1.397 -2.795 2.670 1.00 . A A . 3 ALA CB 1 1
8 1624 1 1 3 ALA H H -3.188 -3.622 0.772 1.00 . A A . 3 ALA H 1 1
8 1625 1 1 3 ALA HA H -1.583 -1.215 1.252 1.00 . A A . 3 ALA HA 1 1
8 1626 1 1 3 ALA HB1 H -0.349 -3.030 2.788 1.00 . A A . 3 ALA HB1 1 1
8 1627 1 1 3 ALA HB2 H -1.970 -3.699 2.814 1.00 . A A . 3 ALA HB2 1 1
8 1628 1 1 3 ALA N N -2.935 -2.672 0.757 1.00 . A A . 3 ALA N 1 1
8 1629 1 1 3 ALA O O -0.533 -3.946 -0.072 1.00 . A A . 3 ALA O 1 1
8 1630 1 1 4 TYR C C 2.767 -2.029 0.064 1.00 . A A . 4 TYR C 1 1
8 1631 1 1 4 TYR CA C 1.533 -2.263 -0.759 1.00 . A A . 4 TYR CA 1 1
8 1632 1 1 4 TYR CB C 1.594 -1.439 -2.054 1.00 . A A . 4 TYR CB 1 1
8 1633 1 1 4 TYR CD1 C -0.726 -0.981 -2.956 1.00 . A A . 4 TYR CD1 1 1
8 1634 1 1 4 TYR CD2 C 0.578 -2.674 -4.005 1.00 . A A . 4 TYR CD2 1 1
8 1635 1 1 4 TYR CE1 C -1.756 -1.225 -3.840 1.00 . A A . 4 TYR CE1 1 1
8 1636 1 1 4 TYR CE2 C -0.447 -2.923 -4.891 1.00 . A A . 4 TYR CE2 1 1
8 1637 1 1 4 TYR CG C 0.459 -1.702 -3.023 1.00 . A A . 4 TYR CG 1 1
8 1638 1 1 4 TYR CZ C -1.613 -2.197 -4.804 1.00 . A A . 4 TYR CZ 1 1
8 1639 1 1 4 TYR H H 0.300 -0.990 0.340 1.00 . A A . 4 TYR H 1 1
8 1640 1 1 4 TYR HA H 1.459 -3.312 -1.007 1.00 . A A . 4 TYR HA 1 1
8 1641 1 1 4 TYR HB2 H 1.572 -0.389 -1.799 1.00 . A A . 4 TYR HB2 1 1
8 1642 1 1 4 TYR HB3 H 2.523 -1.657 -2.558 1.00 . A A . 4 TYR HB3 1 1
8 1643 1 1 4 TYR HD1 H -0.834 -0.220 -2.196 1.00 . A A . 4 TYR HD1 1 1
8 1644 1 1 4 TYR HD2 H 1.493 -3.245 -4.071 1.00 . A A . 4 TYR HD2 1 1
8 1645 1 1 4 TYR HE1 H -2.668 -0.650 -3.769 1.00 . A A . 4 TYR HE1 1 1
8 1646 1 1 4 TYR HE2 H -0.324 -3.688 -5.644 1.00 . A A . 4 TYR HE2 1 1
8 1647 1 1 4 TYR HH H -2.662 -3.389 -5.869 1.00 . A A . 4 TYR HH 1 1
8 1648 1 1 4 TYR N N 0.388 -1.921 0.032 1.00 . A A . 4 TYR N 1 1
8 1649 1 1 4 TYR O O 3.173 -0.876 0.291 1.00 . A A . 4 TYR O 1 1
8 1650 1 1 4 TYR OH O -2.639 -2.440 -5.686 1.00 . A A . 4 TYR OH 1 1
8 1651 1 1 5 LYS C C 5.761 -3.002 0.525 1.00 . A A . 5 LYS C 1 1
8 1652 1 1 5 LYS CA C 4.505 -3.022 1.371 1.00 . A A . 5 LYS CA 1 1
8 1653 1 1 5 LYS CB C 4.505 -4.137 2.399 1.00 . A A . 5 LYS CB 1 1
8 1654 1 1 5 LYS CD C 3.240 -5.208 4.312 1.00 . A A . 5 LYS CD 1 1
8 1655 1 1 5 LYS CE C 4.519 -5.372 5.094 1.00 . A A . 5 LYS CE 1 1
8 1656 1 1 5 LYS CG C 3.316 -4.040 3.352 1.00 . A A . 5 LYS CG 1 1
8 1657 1 1 5 LYS H H 2.979 -3.992 0.355 1.00 . A A . 5 LYS H 1 1
8 1658 1 1 5 LYS HA H 4.450 -2.077 1.890 1.00 . A A . 5 LYS HA 1 1
8 1659 1 1 5 LYS HB2 H 4.468 -5.086 1.887 1.00 . A A . 5 LYS HB2 1 1
8 1660 1 1 5 LYS HB3 H 5.413 -4.076 2.980 1.00 . A A . 5 LYS HB3 1 1
8 1661 1 1 5 LYS HD2 H 2.431 -5.036 5.007 1.00 . A A . 5 LYS HD2 1 1
8 1662 1 1 5 LYS HD3 H 3.047 -6.114 3.753 1.00 . A A . 5 LYS HD3 1 1
8 1663 1 1 5 LYS HE2 H 5.268 -5.686 4.382 1.00 . A A . 5 LYS HE2 1 1
8 1664 1 1 5 LYS HE3 H 4.795 -4.415 5.509 1.00 . A A . 5 LYS HE3 1 1
8 1665 1 1 5 LYS HG2 H 3.403 -3.129 3.925 1.00 . A A . 5 LYS HG2 1 1
8 1666 1 1 5 LYS HG3 H 2.410 -4.004 2.765 1.00 . A A . 5 LYS HG3 1 1
8 1667 1 1 5 LYS HZ1 H 3.667 -6.068 6.860 1.00 . A A . 5 LYS HZ1 1 1
8 1668 1 1 5 LYS HZ2 H 5.266 -6.567 6.668 1.00 . A A . 5 LYS HZ2 1 1
8 1669 1 1 5 LYS HZ3 H 4.045 -7.288 5.779 1.00 . A A . 5 LYS HZ3 1 1
8 1670 1 1 5 LYS N N 3.342 -3.102 0.550 1.00 . A A . 5 LYS N 1 1
8 1671 1 1 5 LYS NZ N 4.375 -6.380 6.163 1.00 . A A . 5 LYS NZ 1 1
8 1672 1 1 5 LYS O O 6.430 -4.015 0.308 1.00 . A A . 5 LYS O 1 1
8 1673 1 1 6 SER C C 7.310 -0.076 -0.644 1.00 . A A . 6 SER C 1 1
8 1674 1 1 6 SER CA C 7.097 -1.552 -0.856 1.00 . A A . 6 SER CA 1 1
8 1675 1 1 6 SER CB C 6.788 -1.881 -2.325 1.00 . A A . 6 SER CB 1 1
8 1676 1 1 6 SER H H 5.341 -1.140 0.113 1.00 . A A . 6 SER H 1 1
8 1677 1 1 6 SER HA H 7.958 -2.103 -0.508 1.00 . A A . 6 SER HA 1 1
8 1678 1 1 6 SER HB2 H 5.928 -1.314 -2.649 1.00 . A A . 6 SER HB2 1 1
8 1679 1 1 6 SER HB3 H 7.640 -1.631 -2.939 1.00 . A A . 6 SER HB3 1 1
8 1680 1 1 6 SER HG H 6.638 -3.662 -1.600 1.00 . A A . 6 SER HG 1 1
8 1681 1 1 6 SER N N 5.980 -1.874 -0.036 1.00 . A A . 6 SER N 1 1
8 1682 1 1 6 SER O O 6.487 0.542 0.003 1.00 . A A . 6 SER O 1 1
8 1683 1 1 6 SER OG O 6.509 -3.274 -2.477 1.00 . A A . 6 SER OG 1 1
8 1684 1 1 7 LYS C C 8.085 2.737 -2.049 1.00 . A A . 7 LYS C 1 1
8 1685 1 1 7 LYS CA C 8.652 1.887 -0.906 1.00 . A A . 7 LYS CA 1 1
8 1686 1 1 7 LYS CB C 10.165 2.167 -0.752 1.00 . A A . 7 LYS CB 1 1
8 1687 1 1 7 LYS CD C 10.948 0.086 0.518 1.00 . A A . 7 LYS CD 1 1
8 1688 1 1 7 LYS CE C 11.630 -0.401 1.780 1.00 . A A . 7 LYS CE 1 1
8 1689 1 1 7 LYS CG C 10.834 1.600 0.510 1.00 . A A . 7 LYS CG 1 1
8 1690 1 1 7 LYS H H 9.004 -0.047 -1.676 1.00 . A A . 7 LYS H 1 1
8 1691 1 1 7 LYS HA H 8.153 2.151 0.014 1.00 . A A . 7 LYS HA 1 1
8 1692 1 1 7 LYS HB2 H 10.675 1.750 -1.607 1.00 . A A . 7 LYS HB2 1 1
8 1693 1 1 7 LYS HB3 H 10.311 3.238 -0.758 1.00 . A A . 7 LYS HB3 1 1
8 1694 1 1 7 LYS HD2 H 9.960 -0.348 0.457 1.00 . A A . 7 LYS HD2 1 1
8 1695 1 1 7 LYS HD3 H 11.534 -0.219 -0.335 1.00 . A A . 7 LYS HD3 1 1
8 1696 1 1 7 LYS HE2 H 12.622 0.025 1.819 1.00 . A A . 7 LYS HE2 1 1
8 1697 1 1 7 LYS HE3 H 11.064 -0.066 2.635 1.00 . A A . 7 LYS HE3 1 1
8 1698 1 1 7 LYS HG2 H 11.831 2.006 0.593 1.00 . A A . 7 LYS HG2 1 1
8 1699 1 1 7 LYS HG3 H 10.253 1.910 1.366 1.00 . A A . 7 LYS HG3 1 1
8 1700 1 1 7 LYS HZ1 H 12.170 -2.172 2.715 1.00 . A A . 7 LYS HZ1 1 1
8 1701 1 1 7 LYS HZ2 H 12.343 -2.237 1.053 1.00 . A A . 7 LYS HZ2 1 1
8 1702 1 1 7 LYS HZ3 H 10.808 -2.319 1.749 1.00 . A A . 7 LYS HZ3 1 1
8 1703 1 1 7 LYS N N 8.381 0.477 -1.127 1.00 . A A . 7 LYS N 1 1
8 1704 1 1 7 LYS NZ N 11.742 -1.870 1.817 1.00 . A A . 7 LYS NZ 1 1
8 1705 1 1 7 LYS O O 8.291 2.403 -3.227 1.00 . A A . 7 LYS O 1 1
8 1706 1 1 8 PRO C C 5.669 3.361 0.057 1.00 . A A . 8 PRO C 1 1
8 1707 1 1 8 PRO CA C 6.907 4.165 -0.371 1.00 . A A . 8 PRO CA 1 1
8 1708 1 1 8 PRO CB C 6.548 5.649 -0.498 1.00 . A A . 8 PRO CB 1 1
8 1709 1 1 8 PRO CD C 6.841 4.805 -2.719 1.00 . A A . 8 PRO CD 1 1
8 1710 1 1 8 PRO CG C 6.061 5.792 -1.892 1.00 . A A . 8 PRO CG 1 1
8 1711 1 1 8 PRO HA H 7.709 4.031 0.338 1.00 . A A . 8 PRO HA 1 1
8 1712 1 1 8 PRO HB2 H 5.780 5.895 0.219 1.00 . A A . 8 PRO HB2 1 1
8 1713 1 1 8 PRO HB3 H 7.422 6.257 -0.320 1.00 . A A . 8 PRO HB3 1 1
8 1714 1 1 8 PRO HD2 H 6.197 4.337 -3.447 1.00 . A A . 8 PRO HD2 1 1
8 1715 1 1 8 PRO HD3 H 7.671 5.294 -3.208 1.00 . A A . 8 PRO HD3 1 1
8 1716 1 1 8 PRO HG2 H 5.007 5.557 -1.932 1.00 . A A . 8 PRO HG2 1 1
8 1717 1 1 8 PRO HG3 H 6.232 6.798 -2.244 1.00 . A A . 8 PRO HG3 1 1
8 1718 1 1 8 PRO N N 7.321 3.812 -1.742 1.00 . A A . 8 PRO N 1 1
8 1719 1 1 8 PRO O O 4.867 2.957 -0.806 1.00 . A A . 8 PRO O 1 1
8 1720 1 1 9 PRO C C 3.057 3.006 1.588 1.00 . A A . 9 PRO C 1 1
8 1721 1 1 9 PRO CA C 4.369 2.302 1.871 1.00 . A A . 9 PRO CA 1 1
8 1722 1 1 9 PRO CB C 4.603 2.220 3.386 1.00 . A A . 9 PRO CB 1 1
8 1723 1 1 9 PRO CD C 6.411 3.478 2.460 1.00 . A A . 9 PRO CD 1 1
8 1724 1 1 9 PRO CG C 6.041 2.541 3.571 1.00 . A A . 9 PRO CG 1 1
8 1725 1 1 9 PRO HA H 4.347 1.310 1.444 1.00 . A A . 9 PRO HA 1 1
8 1726 1 1 9 PRO HB2 H 3.969 2.939 3.883 1.00 . A A . 9 PRO HB2 1 1
8 1727 1 1 9 PRO HB3 H 4.370 1.227 3.738 1.00 . A A . 9 PRO HB3 1 1
8 1728 1 1 9 PRO HD2 H 6.245 4.503 2.753 1.00 . A A . 9 PRO HD2 1 1
8 1729 1 1 9 PRO HD3 H 7.442 3.322 2.181 1.00 . A A . 9 PRO HD3 1 1
8 1730 1 1 9 PRO HG2 H 6.195 3.013 4.531 1.00 . A A . 9 PRO HG2 1 1
8 1731 1 1 9 PRO HG3 H 6.621 1.633 3.502 1.00 . A A . 9 PRO HG3 1 1
8 1732 1 1 9 PRO N N 5.506 3.079 1.371 1.00 . A A . 9 PRO N 1 1
8 1733 1 1 9 PRO O O 2.768 4.071 2.158 1.00 . A A . 9 PRO O 1 1
8 1734 1 1 10 ILE C C -0.093 2.101 0.653 1.00 . A A . 10 ILE C 1 1
8 1735 1 1 10 ILE CA C 1.046 3.056 0.340 1.00 . A A . 10 ILE CA 1 1
8 1736 1 1 10 ILE CB C 1.008 3.553 -1.149 1.00 . A A . 10 ILE CB 1 1
8 1737 1 1 10 ILE CD1 C -0.615 5.486 -0.680 1.00 . A A . 10 ILE CD1 1 1
8 1738 1 1 10 ILE CG1 C -0.333 4.226 -1.479 1.00 . A A . 10 ILE CG1 1 1
8 1739 1 1 10 ILE CG2 C 1.315 2.436 -2.141 1.00 . A A . 10 ILE CG2 1 1
8 1740 1 1 10 ILE H H 2.581 1.634 0.254 1.00 . A A . 10 ILE H 1 1
8 1741 1 1 10 ILE HA H 0.936 3.913 0.987 1.00 . A A . 10 ILE HA 1 1
8 1742 1 1 10 ILE HB H 1.791 4.289 -1.253 1.00 . A A . 10 ILE HB 1 1
8 1743 1 1 10 ILE HD11 H 0.168 6.208 -0.857 1.00 . A A . 10 ILE HD11 1 1
8 1744 1 1 10 ILE HD12 H -0.660 5.245 0.371 1.00 . A A . 10 ILE HD12 1 1
8 1745 1 1 10 ILE HD13 H -1.562 5.901 -0.991 1.00 . A A . 10 ILE HD13 1 1
8 1746 1 1 10 ILE HG12 H -0.351 4.489 -2.526 1.00 . A A . 10 ILE HG12 1 1
8 1747 1 1 10 ILE HG13 H -1.131 3.524 -1.284 1.00 . A A . 10 ILE HG13 1 1
8 1748 1 1 10 ILE HG21 H 1.293 2.827 -3.147 1.00 . A A . 10 ILE HG21 1 1
8 1749 1 1 10 ILE HG22 H 0.571 1.658 -2.043 1.00 . A A . 10 ILE HG22 1 1
8 1750 1 1 10 ILE HG23 H 2.293 2.026 -1.932 1.00 . A A . 10 ILE HG23 1 1
8 1751 1 1 10 ILE N N 2.295 2.466 0.690 1.00 . A A . 10 ILE N 1 1
8 1752 1 1 10 ILE O O -0.095 0.932 0.223 1.00 . A A . 10 ILE O 1 1
8 1753 1 1 11 ALA C C -3.402 2.559 1.546 1.00 . A A . 11 ALA C 1 1
8 1754 1 1 11 ALA CA C -2.152 1.773 1.828 1.00 . A A . 11 ALA CA 1 1
8 1755 1 1 11 ALA CB C -2.135 1.306 3.301 1.00 . A A . 11 ALA CB 1 1
8 1756 1 1 11 ALA H H -0.921 3.465 1.841 1.00 . A A . 11 ALA H 1 1
8 1757 1 1 11 ALA HA H -2.152 0.906 1.183 1.00 . A A . 11 ALA HA 1 1
8 1758 1 1 11 ALA HB1 H -3.005 0.695 3.481 1.00 . A A . 11 ALA HB1 1 1
8 1759 1 1 11 ALA HB2 H -2.190 2.176 3.938 1.00 . A A . 11 ALA HB2 1 1
8 1760 1 1 11 ALA N N -1.010 2.561 1.471 1.00 . A A . 11 ALA N 1 1
8 1761 1 1 11 ALA O O -3.548 3.713 1.975 1.00 . A A . 11 ALA O 1 1
8 1762 1 1 12 PHE C C -6.611 2.085 1.336 1.00 . A A . 12 PHE C 1 1
8 1763 1 1 12 PHE CA C -5.504 2.553 0.413 1.00 . A A . 12 PHE CA 1 1
8 1764 1 1 12 PHE CB C -5.828 2.184 -1.034 1.00 . A A . 12 PHE CB 1 1
8 1765 1 1 12 PHE CD1 C -4.842 3.898 -2.579 1.00 . A A . 12 PHE CD1 1 1
8 1766 1 1 12 PHE CD2 C -3.751 1.788 -2.405 1.00 . A A . 12 PHE CD2 1 1
8 1767 1 1 12 PHE CE1 C -3.893 4.317 -3.486 1.00 . A A . 12 PHE CE1 1 1
8 1768 1 1 12 PHE CE2 C -2.800 2.203 -3.314 1.00 . A A . 12 PHE CE2 1 1
8 1769 1 1 12 PHE CG C -4.786 2.633 -2.027 1.00 . A A . 12 PHE CG 1 1
8 1770 1 1 12 PHE CZ C -2.871 3.467 -3.855 1.00 . A A . 12 PHE CZ 1 1
8 1771 1 1 12 PHE H H -4.055 1.045 0.516 1.00 . A A . 12 PHE H 1 1
8 1772 1 1 12 PHE HA H -5.393 3.625 0.484 1.00 . A A . 12 PHE HA 1 1
8 1773 1 1 12 PHE HB2 H -5.938 1.114 -1.109 1.00 . A A . 12 PHE HB2 1 1
8 1774 1 1 12 PHE HB3 H -6.766 2.648 -1.297 1.00 . A A . 12 PHE HB3 1 1
8 1775 1 1 12 PHE HD1 H -5.642 4.565 -2.295 1.00 . A A . 12 PHE HD1 1 1
8 1776 1 1 12 PHE HD2 H -3.688 0.796 -1.983 1.00 . A A . 12 PHE HD2 1 1
8 1777 1 1 12 PHE HE1 H -3.949 5.307 -3.913 1.00 . A A . 12 PHE HE1 1 1
8 1778 1 1 12 PHE HE2 H -1.997 1.542 -3.606 1.00 . A A . 12 PHE HE2 1 1
8 1779 1 1 12 PHE HZ H -2.126 3.794 -4.565 1.00 . A A . 12 PHE HZ 1 1
8 1780 1 1 12 PHE N N -4.265 1.958 0.813 1.00 . A A . 12 PHE N 1 1
8 1781 1 1 12 PHE O O -6.680 0.882 1.639 1.00 . A A . 12 PHE O 1 1
8 1782 1 1 13 PRO C C -9.547 1.595 2.288 1.00 . A A . 13 PRO C 1 1
8 1783 1 1 13 PRO CA C -8.607 2.729 2.758 1.00 . A A . 13 PRO CA 1 1
8 1784 1 1 13 PRO CB C -9.354 4.056 2.782 1.00 . A A . 13 PRO CB 1 1
8 1785 1 1 13 PRO CD C -7.342 4.481 1.598 1.00 . A A . 13 PRO CD 1 1
8 1786 1 1 13 PRO CG C -8.279 5.065 2.613 1.00 . A A . 13 PRO CG 1 1
8 1787 1 1 13 PRO HA H -8.263 2.496 3.754 1.00 . A A . 13 PRO HA 1 1
8 1788 1 1 13 PRO HB2 H -10.064 4.082 1.970 1.00 . A A . 13 PRO HB2 1 1
8 1789 1 1 13 PRO HB3 H -9.867 4.176 3.724 1.00 . A A . 13 PRO HB3 1 1
8 1790 1 1 13 PRO HD2 H -7.659 4.736 0.596 1.00 . A A . 13 PRO HD2 1 1
8 1791 1 1 13 PRO HD3 H -6.337 4.826 1.782 1.00 . A A . 13 PRO HD3 1 1
8 1792 1 1 13 PRO HG2 H -8.690 5.998 2.258 1.00 . A A . 13 PRO HG2 1 1
8 1793 1 1 13 PRO HG3 H -7.763 5.215 3.550 1.00 . A A . 13 PRO HG3 1 1
8 1794 1 1 13 PRO N N -7.455 3.021 1.840 1.00 . A A . 13 PRO N 1 1
8 1795 1 1 13 PRO O O -10.333 1.063 3.070 1.00 . A A . 13 PRO O 1 1
8 1796 1 1 14 ASP C C -9.760 -1.219 1.121 1.00 . A A . 14 ASP C 1 1
8 1797 1 1 14 ASP CA C -10.230 0.091 0.471 1.00 . A A . 14 ASP CA 1 1
8 1798 1 1 14 ASP CB C -10.041 0.014 -1.057 1.00 . A A . 14 ASP CB 1 1
8 1799 1 1 14 ASP CG C -10.816 -1.120 -1.711 1.00 . A A . 14 ASP CG 1 1
8 1800 1 1 14 ASP H H -8.884 1.758 0.432 1.00 . A A . 14 ASP H 1 1
8 1801 1 1 14 ASP HA H -11.276 0.240 0.697 1.00 . A A . 14 ASP HA 1 1
8 1802 1 1 14 ASP HB2 H -10.370 0.941 -1.500 1.00 . A A . 14 ASP HB2 1 1
8 1803 1 1 14 ASP HB3 H -8.991 -0.123 -1.268 1.00 . A A . 14 ASP HB3 1 1
8 1804 1 1 14 ASP N N -9.462 1.229 1.020 1.00 . A A . 14 ASP N 1 1
8 1805 1 1 14 ASP O O -10.505 -2.197 1.226 1.00 . A A . 14 ASP O 1 1
8 1806 1 1 14 ASP OD1 O -12.037 -0.975 -1.929 1.00 . A A . 14 ASP OD1 1 1
8 1807 1 1 14 ASP OD2 O -10.204 -2.160 -2.063 1.00 . A A . 14 ASP OD2 1 1
8 1808 2 2 1 . C C -1.789 -1.808 3.762 1.00 . B A . 101 WMH C 1 1
8 1809 2 2 1 . C1 C -0.897 0.524 3.716 1.00 . B A . 101 WMH C1 1 1
8 1810 2 2 1 . C2 C 0.331 1.049 3.930 1.00 . B A . 101 WMH C2 1 1
8 1811 2 2 1 . H1 H -1.917 -2.341 4.692 1.00 . B A . 101 WMH H1 1 1
8 1812 2 2 1 . H2 H -2.720 -1.333 3.490 1.00 . B A . 101 WMH H2 1 1
8 1813 2 2 1 . H5 H 0.591 2.094 3.832 1.00 . B A . 101 WMH H5 1 1
8 1814 2 2 1 . N N -0.801 -0.809 3.928 1.00 . B A . 101 WMH N 1 1
8 1815 2 2 1 . N1 N 1.162 0.086 4.277 1.00 . B A . 101 WMH N1 1 1
8 1816 2 2 1 . N2 N 0.540 -1.041 4.292 1.00 . B A . 101 WMH N2 1 1
9 1817 1 1 1 GLY C C -6.921 -2.862 1.590 1.00 . A A . 1 GLY C 1 1
9 1818 1 1 1 GLY CA C -7.983 -2.313 2.489 1.00 . A A . 1 GLY CA 1 1
9 1819 1 1 1 GLY H1 H -8.147 -0.310 1.871 1.00 . A A . 1 GLY H1 1 1
9 1820 1 1 1 GLY HA2 H -7.542 -2.013 3.429 1.00 . A A . 1 GLY HA2 1 1
9 1821 1 1 1 GLY HA3 H -8.722 -3.079 2.667 1.00 . A A . 1 GLY HA3 1 1
9 1822 1 1 1 GLY N N -8.614 -1.175 1.874 1.00 . A A . 1 GLY N 1 1
9 1823 1 1 1 GLY O O -6.852 -4.068 1.346 1.00 . A A . 1 GLY O 1 1
9 1824 1 1 2 ARG C C -3.775 -1.739 0.590 1.00 . A A . 2 ARG C 1 1
9 1825 1 1 2 ARG CA C -5.071 -2.346 0.134 1.00 . A A . 2 ARG CA 1 1
9 1826 1 1 2 ARG CB C -5.480 -1.768 -1.202 1.00 . A A . 2 ARG CB 1 1
9 1827 1 1 2 ARG CD C -5.456 -1.812 -3.680 1.00 . A A . 2 ARG CD 1 1
9 1828 1 1 2 ARG CG C -4.818 -2.372 -2.421 1.00 . A A . 2 ARG CG 1 1
9 1829 1 1 2 ARG CZ C -7.766 -1.629 -4.641 1.00 . A A . 2 ARG CZ 1 1
9 1830 1 1 2 ARG H H -6.122 -1.051 1.410 1.00 . A A . 2 ARG H 1 1
9 1831 1 1 2 ARG HA H -4.992 -3.420 0.064 1.00 . A A . 2 ARG HA 1 1
9 1832 1 1 2 ARG HB2 H -6.552 -1.828 -1.303 1.00 . A A . 2 ARG HB2 1 1
9 1833 1 1 2 ARG HB3 H -5.199 -0.728 -1.170 1.00 . A A . 2 ARG HB3 1 1
9 1834 1 1 2 ARG HD2 H -5.232 -0.759 -3.744 1.00 . A A . 2 ARG HD2 1 1
9 1835 1 1 2 ARG HD3 H -5.048 -2.323 -4.538 1.00 . A A . 2 ARG HD3 1 1
9 1836 1 1 2 ARG HE H -7.296 -2.375 -2.836 1.00 . A A . 2 ARG HE 1 1
9 1837 1 1 2 ARG HG2 H -3.766 -2.127 -2.414 1.00 . A A . 2 ARG HG2 1 1
9 1838 1 1 2 ARG HG3 H -4.943 -3.444 -2.410 1.00 . A A . 2 ARG HG3 1 1
9 1839 1 1 2 ARG HH11 H -6.324 -1.161 -6.017 1.00 . A A . 2 ARG HH11 1 1
9 1840 1 1 2 ARG HH12 H -7.926 -0.919 -6.540 1.00 . A A . 2 ARG HH12 1 1
9 1841 1 1 2 ARG HH21 H -9.481 -1.975 -3.560 1.00 . A A . 2 ARG HH21 1 1
9 1842 1 1 2 ARG HH22 H -9.731 -1.451 -5.156 1.00 . A A . 2 ARG HH22 1 1
9 1843 1 1 2 ARG N N -6.084 -1.983 1.097 1.00 . A A . 2 ARG N 1 1
9 1844 1 1 2 ARG NE N -6.928 -1.994 -3.665 1.00 . A A . 2 ARG NE 1 1
9 1845 1 1 2 ARG NH1 N -7.304 -1.217 -5.811 1.00 . A A . 2 ARG NH1 1 1
9 1846 1 1 2 ARG NH2 N -9.069 -1.684 -4.436 1.00 . A A . 2 ARG NH2 1 1
9 1847 1 1 2 ARG O O -3.758 -0.579 0.986 1.00 . A A . 2 ARG O 1 1
9 1848 1 1 3 ALA C C -0.285 -2.657 0.284 1.00 . A A . 3 ALA C 1 1
9 1849 1 1 3 ALA CA C -1.426 -2.045 1.045 1.00 . A A . 3 ALA CA 1 1
9 1850 1 1 3 ALA CB C -1.292 -2.378 2.538 1.00 . A A . 3 ALA CB 1 1
9 1851 1 1 3 ALA H H -2.755 -3.391 0.149 1.00 . A A . 3 ALA H 1 1
9 1852 1 1 3 ALA HA H -1.383 -0.972 0.942 1.00 . A A . 3 ALA HA 1 1
9 1853 1 1 3 ALA HB1 H -0.255 -2.596 2.749 1.00 . A A . 3 ALA HB1 1 1
9 1854 1 1 3 ALA HB2 H -1.882 -3.260 2.740 1.00 . A A . 3 ALA HB2 1 1
9 1855 1 1 3 ALA N N -2.713 -2.494 0.549 1.00 . A A . 3 ALA N 1 1
9 1856 1 1 3 ALA O O -0.257 -3.859 0.042 1.00 . A A . 3 ALA O 1 1
9 1857 1 1 4 TYR C C 2.916 -2.630 0.310 1.00 . A A . 4 TYR C 1 1
9 1858 1 1 4 TYR CA C 1.863 -2.290 -0.725 1.00 . A A . 4 TYR CA 1 1
9 1859 1 1 4 TYR CB C 2.401 -1.225 -1.686 1.00 . A A . 4 TYR CB 1 1
9 1860 1 1 4 TYR CD1 C 0.606 -0.039 -3.008 1.00 . A A . 4 TYR CD1 1 1
9 1861 1 1 4 TYR CD2 C 1.790 -1.813 -4.053 1.00 . A A . 4 TYR CD2 1 1
9 1862 1 1 4 TYR CE1 C -0.120 0.156 -4.164 1.00 . A A . 4 TYR CE1 1 1
9 1863 1 1 4 TYR CE2 C 1.067 -1.628 -5.206 1.00 . A A . 4 TYR CE2 1 1
9 1864 1 1 4 TYR CG C 1.576 -1.025 -2.934 1.00 . A A . 4 TYR CG 1 1
9 1865 1 1 4 TYR CZ C 0.117 -0.642 -5.256 1.00 . A A . 4 TYR CZ 1 1
9 1866 1 1 4 TYR H H 0.556 -0.877 0.122 1.00 . A A . 4 TYR H 1 1
9 1867 1 1 4 TYR HA H 1.620 -3.180 -1.286 1.00 . A A . 4 TYR HA 1 1
9 1868 1 1 4 TYR HB2 H 2.426 -0.275 -1.173 1.00 . A A . 4 TYR HB2 1 1
9 1869 1 1 4 TYR HB3 H 3.403 -1.492 -1.987 1.00 . A A . 4 TYR HB3 1 1
9 1870 1 1 4 TYR HD1 H 0.418 0.585 -2.146 1.00 . A A . 4 TYR HD1 1 1
9 1871 1 1 4 TYR HD2 H 2.538 -2.591 -4.015 1.00 . A A . 4 TYR HD2 1 1
9 1872 1 1 4 TYR HE1 H -0.872 0.927 -4.212 1.00 . A A . 4 TYR HE1 1 1
9 1873 1 1 4 TYR HE2 H 1.256 -2.256 -6.062 1.00 . A A . 4 TYR HE2 1 1
9 1874 1 1 4 TYR HH H -0.983 -1.279 -6.681 1.00 . A A . 4 TYR HH 1 1
9 1875 1 1 4 TYR N N 0.663 -1.835 -0.065 1.00 . A A . 4 TYR N 1 1
9 1876 1 1 4 TYR O O 2.881 -2.112 1.427 1.00 . A A . 4 TYR O 1 1
9 1877 1 1 4 TYR OH O -0.591 -0.444 -6.400 1.00 . A A . 4 TYR OH 1 1
9 1878 1 1 5 LYS C C 6.205 -3.206 0.423 1.00 . A A . 5 LYS C 1 1
9 1879 1 1 5 LYS CA C 4.913 -3.903 0.843 1.00 . A A . 5 LYS CA 1 1
9 1880 1 1 5 LYS CB C 5.109 -5.427 0.816 1.00 . A A . 5 LYS CB 1 1
9 1881 1 1 5 LYS CD C 3.336 -5.946 2.556 1.00 . A A . 5 LYS CD 1 1
9 1882 1 1 5 LYS CE C 2.129 -6.815 2.871 1.00 . A A . 5 LYS CE 1 1
9 1883 1 1 5 LYS CG C 3.868 -6.250 1.161 1.00 . A A . 5 LYS CG 1 1
9 1884 1 1 5 LYS H H 3.779 -3.920 -0.938 1.00 . A A . 5 LYS H 1 1
9 1885 1 1 5 LYS HA H 4.651 -3.594 1.844 1.00 . A A . 5 LYS HA 1 1
9 1886 1 1 5 LYS HB2 H 5.431 -5.715 -0.173 1.00 . A A . 5 LYS HB2 1 1
9 1887 1 1 5 LYS HB3 H 5.887 -5.682 1.520 1.00 . A A . 5 LYS HB3 1 1
9 1888 1 1 5 LYS HD2 H 4.111 -6.140 3.283 1.00 . A A . 5 LYS HD2 1 1
9 1889 1 1 5 LYS HD3 H 3.044 -4.907 2.606 1.00 . A A . 5 LYS HD3 1 1
9 1890 1 1 5 LYS HE2 H 1.382 -6.645 2.110 1.00 . A A . 5 LYS HE2 1 1
9 1891 1 1 5 LYS HE3 H 2.433 -7.850 2.844 1.00 . A A . 5 LYS HE3 1 1
9 1892 1 1 5 LYS HG2 H 3.093 -6.025 0.442 1.00 . A A . 5 LYS HG2 1 1
9 1893 1 1 5 LYS HG3 H 4.119 -7.298 1.097 1.00 . A A . 5 LYS HG3 1 1
9 1894 1 1 5 LYS HZ1 H 2.233 -6.603 4.965 1.00 . A A . 5 LYS HZ1 1 1
9 1895 1 1 5 LYS HZ2 H 0.760 -7.176 4.386 1.00 . A A . 5 LYS HZ2 1 1
9 1896 1 1 5 LYS HZ3 H 1.132 -5.558 4.217 1.00 . A A . 5 LYS HZ3 1 1
9 1897 1 1 5 LYS N N 3.829 -3.508 -0.047 1.00 . A A . 5 LYS N 1 1
9 1898 1 1 5 LYS NZ N 1.539 -6.513 4.196 1.00 . A A . 5 LYS NZ 1 1
9 1899 1 1 5 LYS O O 7.262 -3.391 1.027 1.00 . A A . 5 LYS O 1 1
9 1900 1 1 6 SER C C 7.222 -0.255 -0.573 1.00 . A A . 6 SER C 1 1
9 1901 1 1 6 SER CA C 7.230 -1.677 -1.134 1.00 . A A . 6 SER CA 1 1
9 1902 1 1 6 SER CB C 7.154 -1.643 -2.654 1.00 . A A . 6 SER CB 1 1
9 1903 1 1 6 SER H H 5.239 -2.327 -1.056 1.00 . A A . 6 SER H 1 1
9 1904 1 1 6 SER HA H 8.140 -2.182 -0.840 1.00 . A A . 6 SER HA 1 1
9 1905 1 1 6 SER HB2 H 6.259 -1.115 -2.951 1.00 . A A . 6 SER HB2 1 1
9 1906 1 1 6 SER HB3 H 8.021 -1.137 -3.051 1.00 . A A . 6 SER HB3 1 1
9 1907 1 1 6 SER HG H 7.160 -3.584 -2.445 1.00 . A A . 6 SER HG 1 1
9 1908 1 1 6 SER N N 6.109 -2.421 -0.619 1.00 . A A . 6 SER N 1 1
9 1909 1 1 6 SER O O 6.254 0.155 0.082 1.00 . A A . 6 SER O 1 1
9 1910 1 1 6 SER OG O 7.104 -2.960 -3.182 1.00 . A A . 6 SER OG 1 1
9 1911 1 1 7 LYS C C 8.074 2.739 -1.573 1.00 . A A . 7 LYS C 1 1
9 1912 1 1 7 LYS CA C 8.403 1.840 -0.381 1.00 . A A . 7 LYS CA 1 1
9 1913 1 1 7 LYS CB C 9.828 2.136 0.119 1.00 . A A . 7 LYS CB 1 1
9 1914 1 1 7 LYS CD C 9.413 1.579 2.548 1.00 . A A . 7 LYS CD 1 1
9 1915 1 1 7 LYS CE C 9.884 0.785 3.763 1.00 . A A . 7 LYS CE 1 1
9 1916 1 1 7 LYS CG C 10.271 1.304 1.321 1.00 . A A . 7 LYS CG 1 1
9 1917 1 1 7 LYS H H 9.040 0.066 -1.291 1.00 . A A . 7 LYS H 1 1
9 1918 1 1 7 LYS HA H 7.694 2.016 0.415 1.00 . A A . 7 LYS HA 1 1
9 1919 1 1 7 LYS HB2 H 10.519 1.947 -0.689 1.00 . A A . 7 LYS HB2 1 1
9 1920 1 1 7 LYS HB3 H 9.887 3.179 0.388 1.00 . A A . 7 LYS HB3 1 1
9 1921 1 1 7 LYS HD2 H 9.458 2.632 2.780 1.00 . A A . 7 LYS HD2 1 1
9 1922 1 1 7 LYS HD3 H 8.391 1.305 2.327 1.00 . A A . 7 LYS HD3 1 1
9 1923 1 1 7 LYS HE2 H 9.213 0.979 4.587 1.00 . A A . 7 LYS HE2 1 1
9 1924 1 1 7 LYS HE3 H 9.851 -0.267 3.518 1.00 . A A . 7 LYS HE3 1 1
9 1925 1 1 7 LYS HG2 H 10.191 0.257 1.070 1.00 . A A . 7 LYS HG2 1 1
9 1926 1 1 7 LYS HG3 H 11.300 1.540 1.549 1.00 . A A . 7 LYS HG3 1 1
9 1927 1 1 7 LYS HZ1 H 11.523 0.644 5.056 1.00 . A A . 7 LYS HZ1 1 1
9 1928 1 1 7 LYS HZ2 H 11.353 2.157 4.361 1.00 . A A . 7 LYS HZ2 1 1
9 1929 1 1 7 LYS HZ3 H 11.963 0.891 3.452 1.00 . A A . 7 LYS HZ3 1 1
9 1930 1 1 7 LYS N N 8.290 0.465 -0.799 1.00 . A A . 7 LYS N 1 1
9 1931 1 1 7 LYS NZ N 11.261 1.138 4.179 1.00 . A A . 7 LYS NZ 1 1
9 1932 1 1 7 LYS O O 8.514 2.456 -2.693 1.00 . A A . 7 LYS O 1 1
9 1933 1 1 8 PRO C C 5.527 3.334 0.287 1.00 . A A . 8 PRO C 1 1
9 1934 1 1 8 PRO CA C 6.739 4.193 -0.076 1.00 . A A . 8 PRO CA 1 1
9 1935 1 1 8 PRO CB C 6.287 5.659 -0.286 1.00 . A A . 8 PRO CB 1 1
9 1936 1 1 8 PRO CD C 6.898 4.759 -2.410 1.00 . A A . 8 PRO CD 1 1
9 1937 1 1 8 PRO CG C 6.772 6.038 -1.645 1.00 . A A . 8 PRO CG 1 1
9 1938 1 1 8 PRO HA H 7.484 4.148 0.704 1.00 . A A . 8 PRO HA 1 1
9 1939 1 1 8 PRO HB2 H 5.210 5.708 -0.226 1.00 . A A . 8 PRO HB2 1 1
9 1940 1 1 8 PRO HB3 H 6.718 6.288 0.478 1.00 . A A . 8 PRO HB3 1 1
9 1941 1 1 8 PRO HD2 H 5.945 4.482 -2.837 1.00 . A A . 8 PRO HD2 1 1
9 1942 1 1 8 PRO HD3 H 7.651 4.836 -3.179 1.00 . A A . 8 PRO HD3 1 1
9 1943 1 1 8 PRO HG2 H 6.058 6.695 -2.120 1.00 . A A . 8 PRO HG2 1 1
9 1944 1 1 8 PRO HG3 H 7.733 6.524 -1.565 1.00 . A A . 8 PRO HG3 1 1
9 1945 1 1 8 PRO N N 7.298 3.814 -1.375 1.00 . A A . 8 PRO N 1 1
9 1946 1 1 8 PRO O O 4.881 2.753 -0.613 1.00 . A A . 8 PRO O 1 1
9 1947 1 1 9 PRO C C 2.767 3.158 1.607 1.00 . A A . 9 PRO C 1 1
9 1948 1 1 9 PRO CA C 4.047 2.467 2.047 1.00 . A A . 9 PRO CA 1 1
9 1949 1 1 9 PRO CB C 4.151 2.470 3.582 1.00 . A A . 9 PRO CB 1 1
9 1950 1 1 9 PRO CD C 5.960 3.781 2.724 1.00 . A A . 9 PRO CD 1 1
9 1951 1 1 9 PRO CG C 5.531 2.944 3.888 1.00 . A A . 9 PRO CG 1 1
9 1952 1 1 9 PRO HA H 4.054 1.454 1.671 1.00 . A A . 9 PRO HA 1 1
9 1953 1 1 9 PRO HB2 H 3.407 3.139 3.986 1.00 . A A . 9 PRO HB2 1 1
9 1954 1 1 9 PRO HB3 H 3.983 1.472 3.960 1.00 . A A . 9 PRO HB3 1 1
9 1955 1 1 9 PRO HD2 H 5.702 4.817 2.879 1.00 . A A . 9 PRO HD2 1 1
9 1956 1 1 9 PRO HD3 H 7.022 3.671 2.574 1.00 . A A . 9 PRO HD3 1 1
9 1957 1 1 9 PRO HG2 H 5.521 3.540 4.788 1.00 . A A . 9 PRO HG2 1 1
9 1958 1 1 9 PRO HG3 H 6.196 2.102 4.010 1.00 . A A . 9 PRO HG3 1 1
9 1959 1 1 9 PRO N N 5.210 3.210 1.595 1.00 . A A . 9 PRO N 1 1
9 1960 1 1 9 PRO O O 2.289 4.099 2.257 1.00 . A A . 9 PRO O 1 1
9 1961 1 1 10 ILE C C -0.070 2.381 0.221 1.00 . A A . 10 ILE C 1 1
9 1962 1 1 10 ILE CA C 1.082 3.308 -0.090 1.00 . A A . 10 ILE CA 1 1
9 1963 1 1 10 ILE CB C 1.221 3.510 -1.627 1.00 . A A . 10 ILE CB 1 1
9 1964 1 1 10 ILE CD1 C 2.581 4.782 -3.407 1.00 . A A . 10 ILE CD1 1 1
9 1965 1 1 10 ILE CG1 C 2.341 4.528 -1.931 1.00 . A A . 10 ILE CG1 1 1
9 1966 1 1 10 ILE CG2 C -0.101 3.955 -2.236 1.00 . A A . 10 ILE CG2 1 1
9 1967 1 1 10 ILE H H 2.772 2.071 -0.019 1.00 . A A . 10 ILE H 1 1
9 1968 1 1 10 ILE HA H 0.901 4.267 0.374 1.00 . A A . 10 ILE HA 1 1
9 1969 1 1 10 ILE HB H 1.490 2.560 -2.065 1.00 . A A . 10 ILE HB 1 1
9 1970 1 1 10 ILE HD11 H 2.869 3.861 -3.892 1.00 . A A . 10 ILE HD11 1 1
9 1971 1 1 10 ILE HD12 H 3.370 5.510 -3.524 1.00 . A A . 10 ILE HD12 1 1
9 1972 1 1 10 ILE HD13 H 1.675 5.158 -3.859 1.00 . A A . 10 ILE HD13 1 1
9 1973 1 1 10 ILE HG12 H 2.092 5.474 -1.476 1.00 . A A . 10 ILE HG12 1 1
9 1974 1 1 10 ILE HG13 H 3.265 4.166 -1.500 1.00 . A A . 10 ILE HG13 1 1
9 1975 1 1 10 ILE HG21 H -0.407 4.892 -1.796 1.00 . A A . 10 ILE HG21 1 1
9 1976 1 1 10 ILE HG22 H -0.848 3.200 -2.044 1.00 . A A . 10 ILE HG22 1 1
9 1977 1 1 10 ILE HG23 H 0.027 4.076 -3.302 1.00 . A A . 10 ILE HG23 1 1
9 1978 1 1 10 ILE N N 2.282 2.763 0.470 1.00 . A A . 10 ILE N 1 1
9 1979 1 1 10 ILE O O -0.046 1.195 -0.157 1.00 . A A . 10 ILE O 1 1
9 1980 1 1 11 ALA C C -3.442 2.828 0.949 1.00 . A A . 11 ALA C 1 1
9 1981 1 1 11 ALA CA C -2.173 2.099 1.327 1.00 . A A . 11 ALA CA 1 1
9 1982 1 1 11 ALA CB C -2.185 1.755 2.839 1.00 . A A . 11 ALA CB 1 1
9 1983 1 1 11 ALA H H -0.995 3.817 1.252 1.00 . A A . 11 ALA H 1 1
9 1984 1 1 11 ALA HA H -2.130 1.179 0.763 1.00 . A A . 11 ALA HA 1 1
9 1985 1 1 11 ALA HB1 H -3.051 1.147 3.058 1.00 . A A . 11 ALA HB1 1 1
9 1986 1 1 11 ALA HB2 H -2.263 2.679 3.391 1.00 . A A . 11 ALA HB2 1 1
9 1987 1 1 11 ALA N N -1.035 2.883 0.952 1.00 . A A . 11 ALA N 1 1
9 1988 1 1 11 ALA O O -3.475 4.064 0.898 1.00 . A A . 11 ALA O 1 1
9 1989 1 1 12 PHE C C -6.763 2.113 1.325 1.00 . A A . 12 PHE C 1 1
9 1990 1 1 12 PHE CA C -5.755 2.544 0.281 1.00 . A A . 12 PHE CA 1 1
9 1991 1 1 12 PHE CB C -6.167 1.969 -1.087 1.00 . A A . 12 PHE CB 1 1
9 1992 1 1 12 PHE CD1 C -4.074 2.026 -2.492 1.00 . A A . 12 PHE CD1 1 1
9 1993 1 1 12 PHE CD2 C -5.924 3.363 -3.151 1.00 . A A . 12 PHE CD2 1 1
9 1994 1 1 12 PHE CE1 C -3.360 2.485 -3.577 1.00 . A A . 12 PHE CE1 1 1
9 1995 1 1 12 PHE CE2 C -5.216 3.822 -4.235 1.00 . A A . 12 PHE CE2 1 1
9 1996 1 1 12 PHE CG C -5.365 2.462 -2.264 1.00 . A A . 12 PHE CG 1 1
9 1997 1 1 12 PHE CZ C -3.933 3.386 -4.448 1.00 . A A . 12 PHE CZ 1 1
9 1998 1 1 12 PHE H H -4.325 1.092 0.775 1.00 . A A . 12 PHE H 1 1
9 1999 1 1 12 PHE HA H -5.705 3.620 0.217 1.00 . A A . 12 PHE HA 1 1
9 2000 1 1 12 PHE HB2 H -6.098 0.895 -1.056 1.00 . A A . 12 PHE HB2 1 1
9 2001 1 1 12 PHE HB3 H -7.200 2.225 -1.260 1.00 . A A . 12 PHE HB3 1 1
9 2002 1 1 12 PHE HD1 H -3.619 1.323 -1.810 1.00 . A A . 12 PHE HD1 1 1
9 2003 1 1 12 PHE HD2 H -6.934 3.706 -2.989 1.00 . A A . 12 PHE HD2 1 1
9 2004 1 1 12 PHE HE1 H -2.352 2.144 -3.748 1.00 . A A . 12 PHE HE1 1 1
9 2005 1 1 12 PHE HE2 H -5.667 4.528 -4.918 1.00 . A A . 12 PHE HE2 1 1
9 2006 1 1 12 PHE HZ H -3.375 3.748 -5.299 1.00 . A A . 12 PHE HZ 1 1
9 2007 1 1 12 PHE N N -4.453 2.064 0.679 1.00 . A A . 12 PHE N 1 1
9 2008 1 1 12 PHE O O -6.756 0.939 1.720 1.00 . A A . 12 PHE O 1 1
9 2009 1 1 13 PRO C C -9.685 1.649 2.434 1.00 . A A . 13 PRO C 1 1
9 2010 1 1 13 PRO CA C -8.673 2.741 2.846 1.00 . A A . 13 PRO CA 1 1
9 2011 1 1 13 PRO CB C -9.396 4.078 3.024 1.00 . A A . 13 PRO CB 1 1
9 2012 1 1 13 PRO CD C -7.743 4.435 1.351 1.00 . A A . 13 PRO CD 1 1
9 2013 1 1 13 PRO CG C -8.468 5.099 2.476 1.00 . A A . 13 PRO CG 1 1
9 2014 1 1 13 PRO HA H -8.200 2.454 3.773 1.00 . A A . 13 PRO HA 1 1
9 2015 1 1 13 PRO HB2 H -10.322 4.047 2.470 1.00 . A A . 13 PRO HB2 1 1
9 2016 1 1 13 PRO HB3 H -9.602 4.245 4.070 1.00 . A A . 13 PRO HB3 1 1
9 2017 1 1 13 PRO HD2 H -8.306 4.522 0.433 1.00 . A A . 13 PRO HD2 1 1
9 2018 1 1 13 PRO HD3 H -6.764 4.872 1.245 1.00 . A A . 13 PRO HD3 1 1
9 2019 1 1 13 PRO HG2 H -9.026 5.948 2.114 1.00 . A A . 13 PRO HG2 1 1
9 2020 1 1 13 PRO HG3 H -7.771 5.407 3.240 1.00 . A A . 13 PRO HG3 1 1
9 2021 1 1 13 PRO N N -7.652 3.032 1.795 1.00 . A A . 13 PRO N 1 1
9 2022 1 1 13 PRO O O -10.583 1.281 3.204 1.00 . A A . 13 PRO O 1 1
9 2023 1 1 14 ASP C C -9.807 -1.257 1.307 1.00 . A A . 14 ASP C 1 1
9 2024 1 1 14 ASP CA C -10.324 0.049 0.682 1.00 . A A . 14 ASP CA 1 1
9 2025 1 1 14 ASP CB C -10.157 0.008 -0.848 1.00 . A A . 14 ASP CB 1 1
9 2026 1 1 14 ASP CG C -10.920 -1.112 -1.529 1.00 . A A . 14 ASP CG 1 1
9 2027 1 1 14 ASP H H -8.892 1.618 0.635 1.00 . A A . 14 ASP H 1 1
9 2028 1 1 14 ASP HA H -11.364 0.191 0.931 1.00 . A A . 14 ASP HA 1 1
9 2029 1 1 14 ASP HB2 H -10.500 0.945 -1.260 1.00 . A A . 14 ASP HB2 1 1
9 2030 1 1 14 ASP HB3 H -9.108 -0.105 -1.076 1.00 . A A . 14 ASP HB3 1 1
9 2031 1 1 14 ASP N N -9.547 1.172 1.211 1.00 . A A . 14 ASP N 1 1
9 2032 1 1 14 ASP O O -10.476 -2.294 1.295 1.00 . A A . 14 ASP O 1 1
9 2033 1 1 14 ASP OD1 O -12.161 -1.043 -1.612 1.00 . A A . 14 ASP OD1 1 1
9 2034 1 1 14 ASP OD2 O -10.283 -2.061 -2.041 1.00 . A A . 14 ASP OD2 1 1
9 2035 2 2 1 . C C -1.757 -1.290 3.484 1.00 . B A . 101 WMH C 1 1
9 2036 2 2 1 . C1 C -0.939 1.040 3.350 1.00 . B A . 101 WMH C1 1 1
9 2037 2 2 1 . C2 C 0.264 1.610 3.575 1.00 . B A . 101 WMH C2 1 1
9 2038 2 2 1 . H1 H -1.949 -1.718 4.458 1.00 . B A . 101 WMH H1 1 1
9 2039 2 2 1 . H2 H -2.668 -0.859 3.101 1.00 . B A . 101 WMH H2 1 1
9 2040 2 2 1 . H5 H 0.492 2.660 3.462 1.00 . B A . 101 WMH H5 1 1
9 2041 2 2 1 . N N -0.802 -0.275 3.605 1.00 . B A . 101 WMH N 1 1
9 2042 2 2 1 . N1 N 1.122 0.678 3.956 1.00 . B A . 101 WMH N1 1 1
9 2043 2 2 1 . N2 N 0.534 -0.461 3.992 1.00 . B A . 101 WMH N2 1 1
10 2044 1 1 1 GLY C C -6.179 -2.571 1.557 1.00 . A A . 1 GLY C 1 1
10 2045 1 1 1 GLY CA C -7.215 -2.139 2.565 1.00 . A A . 1 GLY CA 1 1
10 2046 1 1 1 GLY H1 H -7.774 -0.328 1.633 1.00 . A A . 1 GLY H1 1 1
10 2047 1 1 1 GLY HA2 H -6.708 -1.741 3.431 1.00 . A A . 1 GLY HA2 1 1
10 2048 1 1 1 GLY HA3 H -7.787 -3.004 2.866 1.00 . A A . 1 GLY HA3 1 1
10 2049 1 1 1 GLY N N -8.116 -1.145 2.065 1.00 . A A . 1 GLY N 1 1
10 2050 1 1 1 GLY O O -5.427 -3.523 1.816 1.00 . A A . 1 GLY O 1 1
10 2051 1 1 2 ARG C C -3.768 -1.710 -0.112 1.00 . A A . 2 ARG C 1 1
10 2052 1 1 2 ARG CA C -5.114 -2.224 -0.601 1.00 . A A . 2 ARG CA 1 1
10 2053 1 1 2 ARG CB C -5.420 -1.589 -1.969 1.00 . A A . 2 ARG CB 1 1
10 2054 1 1 2 ARG CD C -7.043 -1.157 -3.841 1.00 . A A . 2 ARG CD 1 1
10 2055 1 1 2 ARG CG C -6.752 -1.971 -2.581 1.00 . A A . 2 ARG CG 1 1
10 2056 1 1 2 ARG CZ C -5.700 -0.567 -5.875 1.00 . A A . 2 ARG CZ 1 1
10 2057 1 1 2 ARG H H -6.796 -1.205 0.224 1.00 . A A . 2 ARG H 1 1
10 2058 1 1 2 ARG HA H -5.065 -3.299 -0.701 1.00 . A A . 2 ARG HA 1 1
10 2059 1 1 2 ARG HB2 H -5.393 -0.519 -1.859 1.00 . A A . 2 ARG HB2 1 1
10 2060 1 1 2 ARG HB3 H -4.637 -1.876 -2.656 1.00 . A A . 2 ARG HB3 1 1
10 2061 1 1 2 ARG HD2 H -8.050 -1.361 -4.171 1.00 . A A . 2 ARG HD2 1 1
10 2062 1 1 2 ARG HD3 H -6.953 -0.110 -3.591 1.00 . A A . 2 ARG HD3 1 1
10 2063 1 1 2 ARG HE H -5.871 -2.408 -5.003 1.00 . A A . 2 ARG HE 1 1
10 2064 1 1 2 ARG HG2 H -6.729 -3.018 -2.841 1.00 . A A . 2 ARG HG2 1 1
10 2065 1 1 2 ARG HG3 H -7.535 -1.793 -1.859 1.00 . A A . 2 ARG HG3 1 1
10 2066 1 1 2 ARG HH11 H -6.617 1.082 -5.037 1.00 . A A . 2 ARG HH11 1 1
10 2067 1 1 2 ARG HH12 H -5.738 1.422 -6.447 1.00 . A A . 2 ARG HH12 1 1
10 2068 1 1 2 ARG HH21 H -4.704 -1.959 -6.995 1.00 . A A . 2 ARG HH21 1 1
10 2069 1 1 2 ARG HH22 H -4.595 -0.382 -7.609 1.00 . A A . 2 ARG HH22 1 1
10 2070 1 1 2 ARG N N -6.134 -1.909 0.401 1.00 . A A . 2 ARG N 1 1
10 2071 1 1 2 ARG NE N -6.124 -1.457 -4.951 1.00 . A A . 2 ARG NE 1 1
10 2072 1 1 2 ARG NH1 N -6.041 0.733 -5.783 1.00 . A A . 2 ARG NH1 1 1
10 2073 1 1 2 ARG NH2 N -4.950 -0.989 -6.894 1.00 . A A . 2 ARG NH2 1 1
10 2074 1 1 2 ARG O O -3.446 -0.535 -0.284 1.00 . A A . 2 ARG O 1 1
10 2075 1 1 3 ALA C C -0.633 -2.820 0.231 1.00 . A A . 3 ALA C 1 1
10 2076 1 1 3 ALA CA C -1.722 -2.224 1.052 1.00 . A A . 3 ALA CA 1 1
10 2077 1 1 3 ALA CB C -1.592 -2.700 2.502 1.00 . A A . 3 ALA CB 1 1
10 2078 1 1 3 ALA H H -3.342 -3.486 0.619 1.00 . A A . 3 ALA H 1 1
10 2079 1 1 3 ALA HA H -1.624 -1.149 1.038 1.00 . A A . 3 ALA HA 1 1
10 2080 1 1 3 ALA HB1 H -0.558 -2.952 2.681 1.00 . A A . 3 ALA HB1 1 1
10 2081 1 1 3 ALA HB2 H -2.192 -3.590 2.627 1.00 . A A . 3 ALA HB2 1 1
10 2082 1 1 3 ALA N N -3.016 -2.568 0.510 1.00 . A A . 3 ALA N 1 1
10 2083 1 1 3 ALA O O -0.704 -3.985 -0.176 1.00 . A A . 3 ALA O 1 1
10 2084 1 1 4 TYR C C 2.721 -2.271 0.022 1.00 . A A . 4 TYR C 1 1
10 2085 1 1 4 TYR CA C 1.483 -2.442 -0.795 1.00 . A A . 4 TYR CA 1 1
10 2086 1 1 4 TYR CB C 1.598 -1.638 -2.091 1.00 . A A . 4 TYR CB 1 1
10 2087 1 1 4 TYR CD1 C 0.506 -2.858 -3.985 1.00 . A A . 4 TYR CD1 1 1
10 2088 1 1 4 TYR CD2 C -0.693 -1.069 -2.981 1.00 . A A . 4 TYR CD2 1 1
10 2089 1 1 4 TYR CE1 C -0.538 -3.073 -4.848 1.00 . A A . 4 TYR CE1 1 1
10 2090 1 1 4 TYR CE2 C -1.742 -1.281 -3.841 1.00 . A A . 4 TYR CE2 1 1
10 2091 1 1 4 TYR CG C 0.449 -1.857 -3.039 1.00 . A A . 4 TYR CG 1 1
10 2092 1 1 4 TYR CZ C -1.658 -2.285 -4.771 1.00 . A A . 4 TYR CZ 1 1
10 2093 1 1 4 TYR H H 0.318 -1.093 0.277 1.00 . A A . 4 TYR H 1 1
10 2094 1 1 4 TYR HA H 1.356 -3.483 -1.046 1.00 . A A . 4 TYR HA 1 1
10 2095 1 1 4 TYR HB2 H 1.637 -0.587 -1.854 1.00 . A A . 4 TYR HB2 1 1
10 2096 1 1 4 TYR HB3 H 2.510 -1.919 -2.600 1.00 . A A . 4 TYR HB3 1 1
10 2097 1 1 4 TYR HD1 H 1.387 -3.480 -4.045 1.00 . A A . 4 TYR HD1 1 1
10 2098 1 1 4 TYR HD2 H -0.754 -0.281 -2.243 1.00 . A A . 4 TYR HD2 1 1
10 2099 1 1 4 TYR HE1 H -0.468 -3.864 -5.579 1.00 . A A . 4 TYR HE1 1 1
10 2100 1 1 4 TYR HE2 H -2.623 -0.659 -3.776 1.00 . A A . 4 TYR HE2 1 1
10 2101 1 1 4 TYR HH H -2.846 -1.663 -6.107 1.00 . A A . 4 TYR HH 1 1
10 2102 1 1 4 TYR N N 0.351 -2.025 -0.038 1.00 . A A . 4 TYR N 1 1
10 2103 1 1 4 TYR O O 3.076 -1.141 0.407 1.00 . A A . 4 TYR O 1 1
10 2104 1 1 4 TYR OH O -2.689 -2.493 -5.636 1.00 . A A . 4 TYR OH 1 1
10 2105 1 1 5 LYS C C 5.728 -3.077 0.097 1.00 . A A . 5 LYS C 1 1
10 2106 1 1 5 LYS CA C 4.586 -3.351 1.051 1.00 . A A . 5 LYS CA 1 1
10 2107 1 1 5 LYS CB C 4.790 -4.638 1.830 1.00 . A A . 5 LYS CB 1 1
10 2108 1 1 5 LYS CD C 3.979 -6.182 3.608 1.00 . A A . 5 LYS CD 1 1
10 2109 1 1 5 LYS CE C 2.885 -6.467 4.606 1.00 . A A . 5 LYS CE 1 1
10 2110 1 1 5 LYS CG C 3.728 -4.888 2.876 1.00 . A A . 5 LYS CG 1 1
10 2111 1 1 5 LYS H H 3.001 -4.231 0.012 1.00 . A A . 5 LYS H 1 1
10 2112 1 1 5 LYS HA H 4.525 -2.521 1.739 1.00 . A A . 5 LYS HA 1 1
10 2113 1 1 5 LYS HB2 H 4.791 -5.468 1.137 1.00 . A A . 5 LYS HB2 1 1
10 2114 1 1 5 LYS HB3 H 5.747 -4.599 2.325 1.00 . A A . 5 LYS HB3 1 1
10 2115 1 1 5 LYS HD2 H 4.012 -6.988 2.892 1.00 . A A . 5 LYS HD2 1 1
10 2116 1 1 5 LYS HD3 H 4.925 -6.115 4.125 1.00 . A A . 5 LYS HD3 1 1
10 2117 1 1 5 LYS HE2 H 2.855 -5.670 5.333 1.00 . A A . 5 LYS HE2 1 1
10 2118 1 1 5 LYS HE3 H 1.948 -6.506 4.072 1.00 . A A . 5 LYS HE3 1 1
10 2119 1 1 5 LYS HG2 H 3.742 -4.075 3.586 1.00 . A A . 5 LYS HG2 1 1
10 2120 1 1 5 LYS HG3 H 2.762 -4.930 2.395 1.00 . A A . 5 LYS HG3 1 1
10 2121 1 1 5 LYS HZ1 H 2.308 -7.909 5.965 1.00 . A A . 5 LYS HZ1 1 1
10 2122 1 1 5 LYS HZ2 H 3.980 -7.749 5.844 1.00 . A A . 5 LYS HZ2 1 1
10 2123 1 1 5 LYS HZ3 H 3.114 -8.542 4.632 1.00 . A A . 5 LYS HZ3 1 1
10 2124 1 1 5 LYS N N 3.359 -3.370 0.317 1.00 . A A . 5 LYS N 1 1
10 2125 1 1 5 LYS NZ N 3.093 -7.747 5.302 1.00 . A A . 5 LYS NZ 1 1
10 2126 1 1 5 LYS O O 6.338 -3.983 -0.481 1.00 . A A . 5 LYS O 1 1
10 2127 1 1 6 SER C C 7.295 0.025 -0.416 1.00 . A A . 6 SER C 1 1
10 2128 1 1 6 SER CA C 6.894 -1.294 -1.020 1.00 . A A . 6 SER CA 1 1
10 2129 1 1 6 SER CB C 6.290 -1.090 -2.416 1.00 . A A . 6 SER CB 1 1
10 2130 1 1 6 SER H H 5.326 -1.185 0.312 1.00 . A A . 6 SER H 1 1
10 2131 1 1 6 SER HA H 7.737 -1.967 -1.067 1.00 . A A . 6 SER HA 1 1
10 2132 1 1 6 SER HB2 H 5.505 -0.350 -2.361 1.00 . A A . 6 SER HB2 1 1
10 2133 1 1 6 SER HB3 H 7.056 -0.752 -3.097 1.00 . A A . 6 SER HB3 1 1
10 2134 1 1 6 SER HG H 6.114 -2.992 -2.335 1.00 . A A . 6 SER HG 1 1
10 2135 1 1 6 SER N N 5.908 -1.831 -0.145 1.00 . A A . 6 SER N 1 1
10 2136 1 1 6 SER O O 6.703 0.419 0.584 1.00 . A A . 6 SER O 1 1
10 2137 1 1 6 SER OG O 5.740 -2.307 -2.908 1.00 . A A . 6 SER OG 1 1
10 2138 1 1 7 LYS C C 8.384 3.047 -1.444 1.00 . A A . 7 LYS C 1 1
10 2139 1 1 7 LYS CA C 8.711 1.954 -0.427 1.00 . A A . 7 LYS CA 1 1
10 2140 1 1 7 LYS CB C 10.199 1.953 -0.100 1.00 . A A . 7 LYS CB 1 1
10 2141 1 1 7 LYS CD C 12.008 1.025 1.361 1.00 . A A . 7 LYS CD 1 1
10 2142 1 1 7 LYS CE C 12.281 0.208 2.603 1.00 . A A . 7 LYS CE 1 1
10 2143 1 1 7 LYS CG C 10.534 1.042 1.056 1.00 . A A . 7 LYS CG 1 1
10 2144 1 1 7 LYS H H 8.809 0.245 -1.667 1.00 . A A . 7 LYS H 1 1
10 2145 1 1 7 LYS HA H 8.160 2.121 0.487 1.00 . A A . 7 LYS HA 1 1
10 2146 1 1 7 LYS HB2 H 10.748 1.624 -0.970 1.00 . A A . 7 LYS HB2 1 1
10 2147 1 1 7 LYS HB3 H 10.505 2.957 0.156 1.00 . A A . 7 LYS HB3 1 1
10 2148 1 1 7 LYS HD2 H 12.540 0.593 0.528 1.00 . A A . 7 LYS HD2 1 1
10 2149 1 1 7 LYS HD3 H 12.348 2.035 1.529 1.00 . A A . 7 LYS HD3 1 1
10 2150 1 1 7 LYS HE2 H 13.333 0.251 2.843 1.00 . A A . 7 LYS HE2 1 1
10 2151 1 1 7 LYS HE3 H 11.704 0.657 3.396 1.00 . A A . 7 LYS HE3 1 1
10 2152 1 1 7 LYS HG2 H 10.005 1.392 1.930 1.00 . A A . 7 LYS HG2 1 1
10 2153 1 1 7 LYS HG3 H 10.206 0.043 0.814 1.00 . A A . 7 LYS HG3 1 1
10 2154 1 1 7 LYS HZ1 H 12.364 -1.660 1.666 1.00 . A A . 7 LYS HZ1 1 1
10 2155 1 1 7 LYS HZ2 H 10.847 -1.284 2.263 1.00 . A A . 7 LYS HZ2 1 1
10 2156 1 1 7 LYS HZ3 H 12.078 -1.745 3.318 1.00 . A A . 7 LYS HZ3 1 1
10 2157 1 1 7 LYS N N 8.308 0.655 -0.926 1.00 . A A . 7 LYS N 1 1
10 2158 1 1 7 LYS NZ N 11.866 -1.204 2.455 1.00 . A A . 7 LYS NZ 1 1
10 2159 1 1 7 LYS O O 8.859 2.985 -2.590 1.00 . A A . 7 LYS O 1 1
10 2160 1 1 8 PRO C C 5.627 3.215 0.326 1.00 . A A . 8 PRO C 1 1
10 2161 1 1 8 PRO CA C 6.856 4.146 0.221 1.00 . A A . 8 PRO CA 1 1
10 2162 1 1 8 PRO CB C 6.382 5.600 0.226 1.00 . A A . 8 PRO CB 1 1
10 2163 1 1 8 PRO CD C 7.216 5.204 -1.950 1.00 . A A . 8 PRO CD 1 1
10 2164 1 1 8 PRO CG C 6.116 5.890 -1.202 1.00 . A A . 8 PRO CG 1 1
10 2165 1 1 8 PRO HA H 7.528 3.979 1.050 1.00 . A A . 8 PRO HA 1 1
10 2166 1 1 8 PRO HB2 H 5.490 5.688 0.828 1.00 . A A . 8 PRO HB2 1 1
10 2167 1 1 8 PRO HB3 H 7.159 6.238 0.617 1.00 . A A . 8 PRO HB3 1 1
10 2168 1 1 8 PRO HD2 H 6.869 4.890 -2.921 1.00 . A A . 8 PRO HD2 1 1
10 2169 1 1 8 PRO HD3 H 8.067 5.859 -2.046 1.00 . A A . 8 PRO HD3 1 1
10 2170 1 1 8 PRO HG2 H 5.157 5.479 -1.486 1.00 . A A . 8 PRO HG2 1 1
10 2171 1 1 8 PRO HG3 H 6.139 6.951 -1.391 1.00 . A A . 8 PRO HG3 1 1
10 2172 1 1 8 PRO N N 7.542 4.044 -1.092 1.00 . A A . 8 PRO N 1 1
10 2173 1 1 8 PRO O O 5.016 2.852 -0.700 1.00 . A A . 8 PRO O 1 1
10 2174 1 1 9 PRO C C 2.790 2.661 1.554 1.00 . A A . 9 PRO C 1 1
10 2175 1 1 9 PRO CA C 4.113 1.922 1.769 1.00 . A A . 9 PRO CA 1 1
10 2176 1 1 9 PRO CB C 4.258 1.456 3.222 1.00 . A A . 9 PRO CB 1 1
10 2177 1 1 9 PRO CD C 5.985 3.077 2.805 1.00 . A A . 9 PRO CD 1 1
10 2178 1 1 9 PRO CG C 5.107 2.492 3.879 1.00 . A A . 9 PRO CG 1 1
10 2179 1 1 9 PRO HA H 4.144 1.071 1.105 1.00 . A A . 9 PRO HA 1 1
10 2180 1 1 9 PRO HB2 H 3.282 1.396 3.680 1.00 . A A . 9 PRO HB2 1 1
10 2181 1 1 9 PRO HB3 H 4.732 0.487 3.247 1.00 . A A . 9 PRO HB3 1 1
10 2182 1 1 9 PRO HD2 H 6.099 4.141 2.943 1.00 . A A . 9 PRO HD2 1 1
10 2183 1 1 9 PRO HD3 H 6.949 2.590 2.809 1.00 . A A . 9 PRO HD3 1 1
10 2184 1 1 9 PRO HG2 H 4.481 3.260 4.306 1.00 . A A . 9 PRO HG2 1 1
10 2185 1 1 9 PRO HG3 H 5.712 2.035 4.649 1.00 . A A . 9 PRO HG3 1 1
10 2186 1 1 9 PRO N N 5.266 2.787 1.550 1.00 . A A . 9 PRO N 1 1
10 2187 1 1 9 PRO O O 2.391 3.536 2.356 1.00 . A A . 9 PRO O 1 1
10 2188 1 1 10 ILE C C -0.257 2.003 0.454 1.00 . A A . 10 ILE C 1 1
10 2189 1 1 10 ILE CA C 0.882 2.948 0.115 1.00 . A A . 10 ILE CA 1 1
10 2190 1 1 10 ILE CB C 0.817 3.383 -1.396 1.00 . A A . 10 ILE CB 1 1
10 2191 1 1 10 ILE CD1 C -0.974 5.187 -1.001 1.00 . A A . 10 ILE CD1 1 1
10 2192 1 1 10 ILE CG1 C -0.570 3.946 -1.765 1.00 . A A . 10 ILE CG1 1 1
10 2193 1 1 10 ILE CG2 C 1.186 2.238 -2.326 1.00 . A A . 10 ILE CG2 1 1
10 2194 1 1 10 ILE H H 2.528 1.664 -0.126 1.00 . A A . 10 ILE H 1 1
10 2195 1 1 10 ILE HA H 0.780 3.829 0.730 1.00 . A A . 10 ILE HA 1 1
10 2196 1 1 10 ILE HB H 1.552 4.162 -1.537 1.00 . A A . 10 ILE HB 1 1
10 2197 1 1 10 ILE HD11 H -0.266 5.979 -1.198 1.00 . A A . 10 ILE HD11 1 1
10 2198 1 1 10 ILE HD12 H -0.991 4.970 0.057 1.00 . A A . 10 ILE HD12 1 1
10 2199 1 1 10 ILE HD13 H -1.959 5.497 -1.315 1.00 . A A . 10 ILE HD13 1 1
10 2200 1 1 10 ILE HG12 H -0.586 4.190 -2.816 1.00 . A A . 10 ILE HG12 1 1
10 2201 1 1 10 ILE HG13 H -1.313 3.183 -1.576 1.00 . A A . 10 ILE HG13 1 1
10 2202 1 1 10 ILE HG21 H 2.174 1.881 -2.084 1.00 . A A . 10 ILE HG21 1 1
10 2203 1 1 10 ILE HG22 H 1.165 2.584 -3.349 1.00 . A A . 10 ILE HG22 1 1
10 2204 1 1 10 ILE HG23 H 0.472 1.437 -2.204 1.00 . A A . 10 ILE HG23 1 1
10 2205 1 1 10 ILE N N 2.145 2.347 0.463 1.00 . A A . 10 ILE N 1 1
10 2206 1 1 10 ILE O O -0.214 0.806 0.118 1.00 . A A . 10 ILE O 1 1
10 2207 1 1 11 ALA C C -3.608 2.551 1.160 1.00 . A A . 11 ALA C 1 1
10 2208 1 1 11 ALA CA C -2.384 1.753 1.514 1.00 . A A . 11 ALA CA 1 1
10 2209 1 1 11 ALA CB C -2.427 1.363 3.008 1.00 . A A . 11 ALA CB 1 1
10 2210 1 1 11 ALA H H -1.176 3.448 1.470 1.00 . A A . 11 ALA H 1 1
10 2211 1 1 11 ALA HA H -2.374 0.857 0.913 1.00 . A A . 11 ALA HA 1 1
10 2212 1 1 11 ALA HB1 H -3.294 0.745 3.182 1.00 . A A . 11 ALA HB1 1 1
10 2213 1 1 11 ALA HB2 H -2.535 2.267 3.587 1.00 . A A . 11 ALA HB2 1 1
10 2214 1 1 11 ALA N N -1.227 2.515 1.169 1.00 . A A . 11 ALA N 1 1
10 2215 1 1 11 ALA O O -3.810 3.664 1.663 1.00 . A A . 11 ALA O 1 1
10 2216 1 1 12 PHE C C -6.691 2.246 0.842 1.00 . A A . 12 PHE C 1 1
10 2217 1 1 12 PHE CA C -5.608 2.634 -0.141 1.00 . A A . 12 PHE CA 1 1
10 2218 1 1 12 PHE CB C -5.987 2.229 -1.568 1.00 . A A . 12 PHE CB 1 1
10 2219 1 1 12 PHE CD1 C -3.952 1.730 -2.975 1.00 . A A . 12 PHE CD1 1 1
10 2220 1 1 12 PHE CD2 C -5.012 3.846 -3.219 1.00 . A A . 12 PHE CD2 1 1
10 2221 1 1 12 PHE CE1 C -3.020 2.087 -3.930 1.00 . A A . 12 PHE CE1 1 1
10 2222 1 1 12 PHE CE2 C -4.083 4.205 -4.171 1.00 . A A . 12 PHE CE2 1 1
10 2223 1 1 12 PHE CG C -4.960 2.609 -2.609 1.00 . A A . 12 PHE CG 1 1
10 2224 1 1 12 PHE CZ C -3.086 3.325 -4.528 1.00 . A A . 12 PHE CZ 1 1
10 2225 1 1 12 PHE H H -4.129 1.143 -0.097 1.00 . A A . 12 PHE H 1 1
10 2226 1 1 12 PHE HA H -5.459 3.703 -0.094 1.00 . A A . 12 PHE HA 1 1
10 2227 1 1 12 PHE HB2 H -6.163 1.167 -1.612 1.00 . A A . 12 PHE HB2 1 1
10 2228 1 1 12 PHE HB3 H -6.908 2.735 -1.819 1.00 . A A . 12 PHE HB3 1 1
10 2229 1 1 12 PHE HD1 H -3.895 0.759 -2.507 1.00 . A A . 12 PHE HD1 1 1
10 2230 1 1 12 PHE HD2 H -5.793 4.538 -2.942 1.00 . A A . 12 PHE HD2 1 1
10 2231 1 1 12 PHE HE1 H -2.234 1.400 -4.210 1.00 . A A . 12 PHE HE1 1 1
10 2232 1 1 12 PHE HE2 H -4.138 5.178 -4.639 1.00 . A A . 12 PHE HE2 1 1
10 2233 1 1 12 PHE HZ H -2.359 3.609 -5.274 1.00 . A A . 12 PHE HZ 1 1
10 2234 1 1 12 PHE N N -4.385 2.017 0.274 1.00 . A A . 12 PHE N 1 1
10 2235 1 1 12 PHE O O -6.792 1.073 1.185 1.00 . A A . 12 PHE O 1 1
10 2236 1 1 13 PRO C C -9.183 1.765 2.597 1.00 . A A . 13 PRO C 1 1
10 2237 1 1 13 PRO CA C -8.516 3.137 2.366 1.00 . A A . 13 PRO CA 1 1
10 2238 1 1 13 PRO CB C -9.529 4.140 1.881 1.00 . A A . 13 PRO CB 1 1
10 2239 1 1 13 PRO CD C -7.427 4.643 0.823 1.00 . A A . 13 PRO CD 1 1
10 2240 1 1 13 PRO CG C -8.687 5.265 1.392 1.00 . A A . 13 PRO CG 1 1
10 2241 1 1 13 PRO HA H -8.136 3.495 3.310 1.00 . A A . 13 PRO HA 1 1
10 2242 1 1 13 PRO HB2 H -10.120 3.700 1.092 1.00 . A A . 13 PRO HB2 1 1
10 2243 1 1 13 PRO HB3 H -10.164 4.445 2.696 1.00 . A A . 13 PRO HB3 1 1
10 2244 1 1 13 PRO HD2 H -7.450 4.672 -0.256 1.00 . A A . 13 PRO HD2 1 1
10 2245 1 1 13 PRO HD3 H -6.554 5.155 1.201 1.00 . A A . 13 PRO HD3 1 1
10 2246 1 1 13 PRO HG2 H -9.220 5.815 0.633 1.00 . A A . 13 PRO HG2 1 1
10 2247 1 1 13 PRO HG3 H -8.438 5.919 2.215 1.00 . A A . 13 PRO HG3 1 1
10 2248 1 1 13 PRO N N -7.476 3.246 1.315 1.00 . A A . 13 PRO N 1 1
10 2249 1 1 13 PRO O O -9.311 1.333 3.744 1.00 . A A . 13 PRO O 1 1
10 2250 1 1 14 ASP C C -9.408 -1.294 2.211 1.00 . A A . 14 ASP C 1 1
10 2251 1 1 14 ASP CA C -10.306 -0.191 1.648 1.00 . A A . 14 ASP CA 1 1
10 2252 1 1 14 ASP CB C -10.854 -0.648 0.295 1.00 . A A . 14 ASP CB 1 1
10 2253 1 1 14 ASP CG C -9.781 -1.182 -0.620 1.00 . A A . 14 ASP CG 1 1
10 2254 1 1 14 ASP H H -9.378 1.452 0.645 1.00 . A A . 14 ASP H 1 1
10 2255 1 1 14 ASP HA H -11.135 -0.043 2.324 1.00 . A A . 14 ASP HA 1 1
10 2256 1 1 14 ASP HB2 H -11.583 -1.428 0.451 1.00 . A A . 14 ASP HB2 1 1
10 2257 1 1 14 ASP HB3 H -11.330 0.191 -0.191 1.00 . A A . 14 ASP HB3 1 1
10 2258 1 1 14 ASP N N -9.587 1.091 1.532 1.00 . A A . 14 ASP N 1 1
10 2259 1 1 14 ASP O O -9.897 -2.270 2.781 1.00 . A A . 14 ASP O 1 1
10 2260 1 1 14 ASP OD1 O -8.842 -0.437 -0.948 1.00 . A A . 14 ASP OD1 1 1
10 2261 1 1 14 ASP OD2 O -9.887 -2.348 -1.059 1.00 . A A . 14 ASP OD2 1 1
10 2262 2 2 1 . C C -2.025 -1.696 3.556 1.00 . B A . 101 WMH C 1 1
10 2263 2 2 1 . C1 C -1.196 0.643 3.534 1.00 . B A . 101 WMH C1 1 1
10 2264 2 2 1 . C2 C -0.004 1.219 3.831 1.00 . B A . 101 WMH C2 1 1
10 2265 2 2 1 . H1 H -2.185 -2.221 4.487 1.00 . B A . 101 WMH H1 1 1
10 2266 2 2 1 . H2 H -2.949 -1.240 3.242 1.00 . B A . 101 WMH H2 1 1
10 2267 2 2 1 . H5 H 0.219 2.273 3.750 1.00 . B A . 101 WMH H5 1 1
10 2268 2 2 1 . N N -1.066 -0.678 3.757 1.00 . B A . 101 WMH N 1 1
10 2269 2 2 1 . N1 N 0.841 0.284 4.232 1.00 . B A . 101 WMH N1 1 1
10 2270 2 2 1 . N2 N 0.255 -0.865 4.207 1.00 . B A . 101 WMH N2 1 1
11 2271 1 1 1 GLY C C -6.843 -2.840 1.076 1.00 . A A . 1 GLY C 1 1
11 2272 1 1 1 GLY CA C -7.892 -2.386 2.025 1.00 . A A . 1 GLY CA 1 1
11 2273 1 1 1 GLY H1 H -7.906 -0.342 1.561 1.00 . A A . 1 GLY H1 1 1
11 2274 1 1 1 GLY HA2 H -7.459 -2.230 3.002 1.00 . A A . 1 GLY HA2 1 1
11 2275 1 1 1 GLY HA3 H -8.664 -3.138 2.082 1.00 . A A . 1 GLY HA3 1 1
11 2276 1 1 1 GLY N N -8.452 -1.160 1.548 1.00 . A A . 1 GLY N 1 1
11 2277 1 1 1 GLY O O -6.843 -3.983 0.618 1.00 . A A . 1 GLY O 1 1
11 2278 1 1 2 ARG C C -3.624 -1.662 0.251 1.00 . A A . 2 ARG C 1 1
11 2279 1 1 2 ARG CA C -4.948 -2.207 -0.227 1.00 . A A . 2 ARG CA 1 1
11 2280 1 1 2 ARG CB C -5.342 -1.537 -1.532 1.00 . A A . 2 ARG CB 1 1
11 2281 1 1 2 ARG CD C -5.114 -1.247 -3.983 1.00 . A A . 2 ARG CD 1 1
11 2282 1 1 2 ARG CG C -4.622 -2.023 -2.774 1.00 . A A . 2 ARG CG 1 1
11 2283 1 1 2 ARG CZ C -7.327 -0.374 -4.753 1.00 . A A . 2 ARG CZ 1 1
11 2284 1 1 2 ARG H H -5.967 -1.064 1.205 1.00 . A A . 2 ARG H 1 1
11 2285 1 1 2 ARG HA H -4.880 -3.272 -0.384 1.00 . A A . 2 ARG HA 1 1
11 2286 1 1 2 ARG HB2 H -6.403 -1.644 -1.690 1.00 . A A . 2 ARG HB2 1 1
11 2287 1 1 2 ARG HB3 H -5.116 -0.488 -1.423 1.00 . A A . 2 ARG HB3 1 1
11 2288 1 1 2 ARG HD2 H -4.756 -0.230 -3.915 1.00 . A A . 2 ARG HD2 1 1
11 2289 1 1 2 ARG HD3 H -4.730 -1.710 -4.880 1.00 . A A . 2 ARG HD3 1 1
11 2290 1 1 2 ARG HE H -7.025 -1.898 -3.466 1.00 . A A . 2 ARG HE 1 1
11 2291 1 1 2 ARG HG2 H -3.560 -1.872 -2.657 1.00 . A A . 2 ARG HG2 1 1
11 2292 1 1 2 ARG HG3 H -4.832 -3.071 -2.925 1.00 . A A . 2 ARG HG3 1 1
11 2293 1 1 2 ARG HH11 H -5.753 0.499 -5.752 1.00 . A A . 2 ARG HH11 1 1
11 2294 1 1 2 ARG HH12 H -7.279 1.127 -6.165 1.00 . A A . 2 ARG HH12 1 1
11 2295 1 1 2 ARG HH21 H -9.093 -1.003 -3.944 1.00 . A A . 2 ARG HH21 1 1
11 2296 1 1 2 ARG HH22 H -9.252 0.256 -5.090 1.00 . A A . 2 ARG HH22 1 1
11 2297 1 1 2 ARG N N -5.953 -1.936 0.755 1.00 . A A . 2 ARG N 1 1
11 2298 1 1 2 ARG NE N -6.584 -1.236 -4.046 1.00 . A A . 2 ARG NE 1 1
11 2299 1 1 2 ARG NH1 N -6.748 0.477 -5.613 1.00 . A A . 2 ARG NH1 1 1
11 2300 1 1 2 ARG NH2 N -8.645 -0.371 -4.594 1.00 . A A . 2 ARG NH2 1 1
11 2301 1 1 2 ARG O O -3.341 -0.480 0.094 1.00 . A A . 2 ARG O 1 1
11 2302 1 1 3 ALA C C -0.506 -2.872 0.598 1.00 . A A . 3 ALA C 1 1
11 2303 1 1 3 ALA CA C -1.561 -2.148 1.370 1.00 . A A . 3 ALA CA 1 1
11 2304 1 1 3 ALA CB C -1.405 -2.430 2.865 1.00 . A A . 3 ALA CB 1 1
11 2305 1 1 3 ALA H H -3.215 -3.392 1.081 1.00 . A A . 3 ALA H 1 1
11 2306 1 1 3 ALA HA H -1.427 -1.087 1.215 1.00 . A A . 3 ALA HA 1 1
11 2307 1 1 3 ALA HB1 H -0.378 -2.714 3.031 1.00 . A A . 3 ALA HB1 1 1
11 2308 1 1 3 ALA HB2 H -2.043 -3.258 3.133 1.00 . A A . 3 ALA HB2 1 1
11 2309 1 1 3 ALA N N -2.878 -2.487 0.904 1.00 . A A . 3 ALA N 1 1
11 2310 1 1 3 ALA O O -0.608 -4.082 0.356 1.00 . A A . 3 ALA O 1 1
11 2311 1 1 4 TYR C C 2.796 -2.721 0.467 1.00 . A A . 4 TYR C 1 1
11 2312 1 1 4 TYR CA C 1.622 -2.675 -0.482 1.00 . A A . 4 TYR CA 1 1
11 2313 1 1 4 TYR CB C 1.967 -1.809 -1.705 1.00 . A A . 4 TYR CB 1 1
11 2314 1 1 4 TYR CD1 C 0.872 -2.606 -3.842 1.00 . A A . 4 TYR CD1 1 1
11 2315 1 1 4 TYR CD2 C -0.145 -0.802 -2.678 1.00 . A A . 4 TYR CD2 1 1
11 2316 1 1 4 TYR CE1 C -0.110 -2.538 -4.808 1.00 . A A . 4 TYR CE1 1 1
11 2317 1 1 4 TYR CE2 C -1.131 -0.729 -3.636 1.00 . A A . 4 TYR CE2 1 1
11 2318 1 1 4 TYR CG C 0.875 -1.739 -2.761 1.00 . A A . 4 TYR CG 1 1
11 2319 1 1 4 TYR CZ C -1.108 -1.597 -4.698 1.00 . A A . 4 TYR CZ 1 1
11 2320 1 1 4 TYR H H 0.489 -1.175 0.413 1.00 . A A . 4 TYR H 1 1
11 2321 1 1 4 TYR HA H 1.372 -3.673 -0.808 1.00 . A A . 4 TYR HA 1 1
11 2322 1 1 4 TYR HB2 H 2.165 -0.801 -1.374 1.00 . A A . 4 TYR HB2 1 1
11 2323 1 1 4 TYR HB3 H 2.857 -2.205 -2.171 1.00 . A A . 4 TYR HB3 1 1
11 2324 1 1 4 TYR HD1 H 1.657 -3.342 -3.925 1.00 . A A . 4 TYR HD1 1 1
11 2325 1 1 4 TYR HD2 H -0.160 -0.121 -1.839 1.00 . A A . 4 TYR HD2 1 1
11 2326 1 1 4 TYR HE1 H -0.087 -3.227 -5.641 1.00 . A A . 4 TYR HE1 1 1
11 2327 1 1 4 TYR HE2 H -1.912 0.010 -3.544 1.00 . A A . 4 TYR HE2 1 1
11 2328 1 1 4 TYR HH H -2.375 -2.420 -5.861 1.00 . A A . 4 TYR HH 1 1
11 2329 1 1 4 TYR N N 0.496 -2.139 0.218 1.00 . A A . 4 TYR N 1 1
11 2330 1 1 4 TYR O O 2.881 -1.905 1.395 1.00 . A A . 4 TYR O 1 1
11 2331 1 1 4 TYR OH O -2.085 -1.521 -5.658 1.00 . A A . 4 TYR OH 1 1
11 2332 1 1 5 LYS C C 6.034 -3.027 0.541 1.00 . A A . 5 LYS C 1 1
11 2333 1 1 5 LYS CA C 4.859 -3.809 1.107 1.00 . A A . 5 LYS CA 1 1
11 2334 1 1 5 LYS CB C 5.219 -5.293 1.263 1.00 . A A . 5 LYS CB 1 1
11 2335 1 1 5 LYS CD C 5.909 -7.477 0.211 1.00 . A A . 5 LYS CD 1 1
11 2336 1 1 5 LYS CE C 4.626 -8.207 0.592 1.00 . A A . 5 LYS CE 1 1
11 2337 1 1 5 LYS CG C 5.656 -5.993 -0.022 1.00 . A A . 5 LYS CG 1 1
11 2338 1 1 5 LYS H H 3.564 -4.266 -0.508 1.00 . A A . 5 LYS H 1 1
11 2339 1 1 5 LYS HA H 4.610 -3.404 2.077 1.00 . A A . 5 LYS HA 1 1
11 2340 1 1 5 LYS HB2 H 6.022 -5.384 1.977 1.00 . A A . 5 LYS HB2 1 1
11 2341 1 1 5 LYS HB3 H 4.349 -5.801 1.648 1.00 . A A . 5 LYS HB3 1 1
11 2342 1 1 5 LYS HD2 H 6.304 -7.910 -0.696 1.00 . A A . 5 LYS HD2 1 1
11 2343 1 1 5 LYS HD3 H 6.631 -7.590 1.006 1.00 . A A . 5 LYS HD3 1 1
11 2344 1 1 5 LYS HE2 H 4.230 -7.774 1.498 1.00 . A A . 5 LYS HE2 1 1
11 2345 1 1 5 LYS HE3 H 3.908 -8.088 -0.205 1.00 . A A . 5 LYS HE3 1 1
11 2346 1 1 5 LYS HG2 H 4.883 -5.882 -0.766 1.00 . A A . 5 LYS HG2 1 1
11 2347 1 1 5 LYS HG3 H 6.567 -5.532 -0.378 1.00 . A A . 5 LYS HG3 1 1
11 2348 1 1 5 LYS HZ1 H 5.506 -9.812 1.617 1.00 . A A . 5 LYS HZ1 1 1
11 2349 1 1 5 LYS HZ2 H 5.157 -10.138 -0.025 1.00 . A A . 5 LYS HZ2 1 1
11 2350 1 1 5 LYS HZ3 H 3.931 -10.069 1.102 1.00 . A A . 5 LYS HZ3 1 1
11 2351 1 1 5 LYS N N 3.692 -3.654 0.250 1.00 . A A . 5 LYS N 1 1
11 2352 1 1 5 LYS NZ N 4.840 -9.643 0.834 1.00 . A A . 5 LYS NZ 1 1
11 2353 1 1 5 LYS O O 7.121 -2.987 1.116 1.00 . A A . 5 LYS O 1 1
11 2354 1 1 6 SER C C 6.852 -0.228 -0.648 1.00 . A A . 6 SER C 1 1
11 2355 1 1 6 SER CA C 6.780 -1.626 -1.262 1.00 . A A . 6 SER CA 1 1
11 2356 1 1 6 SER CB C 6.408 -1.566 -2.734 1.00 . A A . 6 SER CB 1 1
11 2357 1 1 6 SER H H 4.909 -2.491 -0.986 1.00 . A A . 6 SER H 1 1
11 2358 1 1 6 SER HA H 7.742 -2.104 -1.164 1.00 . A A . 6 SER HA 1 1
11 2359 1 1 6 SER HB2 H 5.466 -1.050 -2.843 1.00 . A A . 6 SER HB2 1 1
11 2360 1 1 6 SER HB3 H 7.173 -1.050 -3.296 1.00 . A A . 6 SER HB3 1 1
11 2361 1 1 6 SER HG H 7.037 -3.384 -2.927 1.00 . A A . 6 SER HG 1 1
11 2362 1 1 6 SER N N 5.798 -2.414 -0.586 1.00 . A A . 6 SER N 1 1
11 2363 1 1 6 SER O O 5.985 0.152 0.165 1.00 . A A . 6 SER O 1 1
11 2364 1 1 6 SER OG O 6.272 -2.887 -3.244 1.00 . A A . 6 SER OG 1 1
11 2365 1 1 7 LYS C C 7.951 2.836 -1.648 1.00 . A A . 7 LYS C 1 1
11 2366 1 1 7 LYS CA C 8.080 1.835 -0.505 1.00 . A A . 7 LYS CA 1 1
11 2367 1 1 7 LYS CB C 9.425 1.949 0.211 1.00 . A A . 7 LYS CB 1 1
11 2368 1 1 7 LYS CD C 11.910 1.533 0.207 1.00 . A A . 7 LYS CD 1 1
11 2369 1 1 7 LYS CE C 12.240 2.892 0.805 1.00 . A A . 7 LYS CE 1 1
11 2370 1 1 7 LYS CG C 10.640 1.566 -0.630 1.00 . A A . 7 LYS CG 1 1
11 2371 1 1 7 LYS H H 8.532 0.142 -1.642 1.00 . A A . 7 LYS H 1 1
11 2372 1 1 7 LYS HA H 7.286 2.039 0.200 1.00 . A A . 7 LYS HA 1 1
11 2373 1 1 7 LYS HB2 H 9.547 2.973 0.533 1.00 . A A . 7 LYS HB2 1 1
11 2374 1 1 7 LYS HB3 H 9.397 1.311 1.081 1.00 . A A . 7 LYS HB3 1 1
11 2375 1 1 7 LYS HD2 H 11.783 0.821 1.009 1.00 . A A . 7 LYS HD2 1 1
11 2376 1 1 7 LYS HD3 H 12.727 1.218 -0.424 1.00 . A A . 7 LYS HD3 1 1
11 2377 1 1 7 LYS HE2 H 12.443 3.590 0.005 1.00 . A A . 7 LYS HE2 1 1
11 2378 1 1 7 LYS HE3 H 11.387 3.236 1.372 1.00 . A A . 7 LYS HE3 1 1
11 2379 1 1 7 LYS HG2 H 10.474 0.584 -1.049 1.00 . A A . 7 LYS HG2 1 1
11 2380 1 1 7 LYS HG3 H 10.759 2.284 -1.427 1.00 . A A . 7 LYS HG3 1 1
11 2381 1 1 7 LYS HZ1 H 13.622 3.783 2.060 1.00 . A A . 7 LYS HZ1 1 1
11 2382 1 1 7 LYS HZ2 H 14.250 2.462 1.202 1.00 . A A . 7 LYS HZ2 1 1
11 2383 1 1 7 LYS HZ3 H 13.205 2.220 2.510 1.00 . A A . 7 LYS HZ3 1 1
11 2384 1 1 7 LYS N N 7.881 0.499 -0.999 1.00 . A A . 7 LYS N 1 1
11 2385 1 1 7 LYS NZ N 13.412 2.831 1.694 1.00 . A A . 7 LYS NZ 1 1
11 2386 1 1 7 LYS O O 8.387 2.552 -2.769 1.00 . A A . 7 LYS O 1 1
11 2387 1 1 8 PRO C C 5.581 3.593 0.316 1.00 . A A . 8 PRO C 1 1
11 2388 1 1 8 PRO CA C 6.807 4.429 -0.097 1.00 . A A . 8 PRO CA 1 1
11 2389 1 1 8 PRO CB C 6.401 5.891 -0.344 1.00 . A A . 8 PRO CB 1 1
11 2390 1 1 8 PRO CD C 7.100 5.036 -2.443 1.00 . A A . 8 PRO CD 1 1
11 2391 1 1 8 PRO CG C 6.111 5.954 -1.796 1.00 . A A . 8 PRO CG 1 1
11 2392 1 1 8 PRO HA H 7.563 4.378 0.672 1.00 . A A . 8 PRO HA 1 1
11 2393 1 1 8 PRO HB2 H 5.527 6.125 0.247 1.00 . A A . 8 PRO HB2 1 1
11 2394 1 1 8 PRO HB3 H 7.213 6.548 -0.074 1.00 . A A . 8 PRO HB3 1 1
11 2395 1 1 8 PRO HD2 H 6.685 4.594 -3.336 1.00 . A A . 8 PRO HD2 1 1
11 2396 1 1 8 PRO HD3 H 8.011 5.566 -2.674 1.00 . A A . 8 PRO HD3 1 1
11 2397 1 1 8 PRO HG2 H 5.104 5.612 -1.983 1.00 . A A . 8 PRO HG2 1 1
11 2398 1 1 8 PRO HG3 H 6.242 6.962 -2.158 1.00 . A A . 8 PRO HG3 1 1
11 2399 1 1 8 PRO N N 7.344 4.014 -1.416 1.00 . A A . 8 PRO N 1 1
11 2400 1 1 8 PRO O O 5.025 2.872 -0.514 1.00 . A A . 8 PRO O 1 1
11 2401 1 1 9 PRO C C 2.720 3.332 1.404 1.00 . A A . 9 PRO C 1 1
11 2402 1 1 9 PRO CA C 4.017 2.891 2.082 1.00 . A A . 9 PRO CA 1 1
11 2403 1 1 9 PRO CB C 3.960 3.168 3.592 1.00 . A A . 9 PRO CB 1 1
11 2404 1 1 9 PRO CD C 5.790 4.432 2.681 1.00 . A A . 9 PRO CD 1 1
11 2405 1 1 9 PRO CG C 5.268 3.795 3.938 1.00 . A A . 9 PRO CG 1 1
11 2406 1 1 9 PRO HA H 4.152 1.837 1.903 1.00 . A A . 9 PRO HA 1 1
11 2407 1 1 9 PRO HB2 H 3.136 3.833 3.802 1.00 . A A . 9 PRO HB2 1 1
11 2408 1 1 9 PRO HB3 H 3.816 2.241 4.125 1.00 . A A . 9 PRO HB3 1 1
11 2409 1 1 9 PRO HD2 H 5.487 5.466 2.622 1.00 . A A . 9 PRO HD2 1 1
11 2410 1 1 9 PRO HD3 H 6.866 4.351 2.644 1.00 . A A . 9 PRO HD3 1 1
11 2411 1 1 9 PRO HG2 H 5.119 4.544 4.699 1.00 . A A . 9 PRO HG2 1 1
11 2412 1 1 9 PRO HG3 H 5.955 3.042 4.292 1.00 . A A . 9 PRO HG3 1 1
11 2413 1 1 9 PRO N N 5.168 3.646 1.604 1.00 . A A . 9 PRO N 1 1
11 2414 1 1 9 PRO O O 2.119 4.356 1.763 1.00 . A A . 9 PRO O 1 1
11 2415 1 1 10 ILE C C 0.009 2.022 0.214 1.00 . A A . 10 ILE C 1 1
11 2416 1 1 10 ILE CA C 1.142 2.866 -0.356 1.00 . A A . 10 ILE CA 1 1
11 2417 1 1 10 ILE CB C 1.336 2.540 -1.868 1.00 . A A . 10 ILE CB 1 1
11 2418 1 1 10 ILE CD1 C 2.842 3.032 -3.887 1.00 . A A . 10 ILE CD1 1 1
11 2419 1 1 10 ILE CG1 C 2.500 3.364 -2.447 1.00 . A A . 10 ILE CG1 1 1
11 2420 1 1 10 ILE CG2 C 0.054 2.819 -2.648 1.00 . A A . 10 ILE CG2 1 1
11 2421 1 1 10 ILE H H 2.920 1.861 0.113 1.00 . A A . 10 ILE H 1 1
11 2422 1 1 10 ILE HA H 0.900 3.914 -0.251 1.00 . A A . 10 ILE HA 1 1
11 2423 1 1 10 ILE HB H 1.570 1.490 -1.961 1.00 . A A . 10 ILE HB 1 1
11 2424 1 1 10 ILE HD11 H 3.125 1.993 -3.961 1.00 . A A . 10 ILE HD11 1 1
11 2425 1 1 10 ILE HD12 H 3.665 3.654 -4.212 1.00 . A A . 10 ILE HD12 1 1
11 2426 1 1 10 ILE HD13 H 1.981 3.216 -4.511 1.00 . A A . 10 ILE HD13 1 1
11 2427 1 1 10 ILE HG12 H 2.242 4.412 -2.406 1.00 . A A . 10 ILE HG12 1 1
11 2428 1 1 10 ILE HG13 H 3.381 3.194 -1.845 1.00 . A A . 10 ILE HG13 1 1
11 2429 1 1 10 ILE HG21 H -0.202 3.861 -2.546 1.00 . A A . 10 ILE HG21 1 1
11 2430 1 1 10 ILE HG22 H -0.747 2.214 -2.251 1.00 . A A . 10 ILE HG22 1 1
11 2431 1 1 10 ILE HG23 H 0.204 2.583 -3.690 1.00 . A A . 10 ILE HG23 1 1
11 2432 1 1 10 ILE N N 2.345 2.603 0.388 1.00 . A A . 10 ILE N 1 1
11 2433 1 1 10 ILE O O 0.012 0.782 0.079 1.00 . A A . 10 ILE O 1 1
11 2434 1 1 11 ALA C C -3.311 2.747 1.169 1.00 . A A . 11 ALA C 1 1
11 2435 1 1 11 ALA CA C -2.048 1.988 1.475 1.00 . A A . 11 ALA CA 1 1
11 2436 1 1 11 ALA CB C -1.951 1.771 3.002 1.00 . A A . 11 ALA CB 1 1
11 2437 1 1 11 ALA H H -0.825 3.634 1.049 1.00 . A A . 11 ALA H 1 1
11 2438 1 1 11 ALA HA H -2.111 1.023 0.992 1.00 . A A . 11 ALA HA 1 1
11 2439 1 1 11 ALA HB1 H -2.839 1.259 3.338 1.00 . A A . 11 ALA HB1 1 1
11 2440 1 1 11 ALA HB2 H -1.913 2.740 3.479 1.00 . A A . 11 ALA HB2 1 1
11 2441 1 1 11 ALA N N -0.907 2.666 0.913 1.00 . A A . 11 ALA N 1 1
11 2442 1 1 11 ALA O O -3.376 3.978 1.315 1.00 . A A . 11 ALA O 1 1
11 2443 1 1 12 PHE C C -6.529 2.066 1.484 1.00 . A A . 12 PHE C 1 1
11 2444 1 1 12 PHE CA C -5.570 2.586 0.447 1.00 . A A . 12 PHE CA 1 1
11 2445 1 1 12 PHE CB C -6.064 2.183 -0.949 1.00 . A A . 12 PHE CB 1 1
11 2446 1 1 12 PHE CD1 C -5.725 3.908 -2.718 1.00 . A A . 12 PHE CD1 1 1
11 2447 1 1 12 PHE CD2 C -4.109 2.172 -2.532 1.00 . A A . 12 PHE CD2 1 1
11 2448 1 1 12 PHE CE1 C -5.022 4.458 -3.766 1.00 . A A . 12 PHE CE1 1 1
11 2449 1 1 12 PHE CE2 C -3.401 2.718 -3.583 1.00 . A A . 12 PHE CE2 1 1
11 2450 1 1 12 PHE CG C -5.280 2.765 -2.089 1.00 . A A . 12 PHE CG 1 1
11 2451 1 1 12 PHE CZ C -3.861 3.863 -4.201 1.00 . A A . 12 PHE CZ 1 1
11 2452 1 1 12 PHE H H -4.108 1.087 0.563 1.00 . A A . 12 PHE H 1 1
11 2453 1 1 12 PHE HA H -5.501 3.662 0.506 1.00 . A A . 12 PHE HA 1 1
11 2454 1 1 12 PHE HB2 H -6.044 1.109 -1.038 1.00 . A A . 12 PHE HB2 1 1
11 2455 1 1 12 PHE HB3 H -7.088 2.504 -1.056 1.00 . A A . 12 PHE HB3 1 1
11 2456 1 1 12 PHE HD1 H -6.636 4.377 -2.378 1.00 . A A . 12 PHE HD1 1 1
11 2457 1 1 12 PHE HD2 H -3.748 1.277 -2.048 1.00 . A A . 12 PHE HD2 1 1
11 2458 1 1 12 PHE HE1 H -5.385 5.353 -4.250 1.00 . A A . 12 PHE HE1 1 1
11 2459 1 1 12 PHE HE2 H -2.489 2.256 -3.926 1.00 . A A . 12 PHE HE2 1 1
11 2460 1 1 12 PHE HZ H -3.312 4.298 -5.022 1.00 . A A . 12 PHE HZ 1 1
11 2461 1 1 12 PHE N N -4.277 2.043 0.719 1.00 . A A . 12 PHE N 1 1
11 2462 1 1 12 PHE O O -6.531 0.852 1.749 1.00 . A A . 12 PHE O 1 1
11 2463 1 1 13 PRO C C -9.405 1.556 2.548 1.00 . A A . 13 PRO C 1 1
11 2464 1 1 13 PRO CA C -8.372 2.563 3.105 1.00 . A A . 13 PRO CA 1 1
11 2465 1 1 13 PRO CB C -9.044 3.882 3.503 1.00 . A A . 13 PRO CB 1 1
11 2466 1 1 13 PRO CD C -7.314 4.417 1.926 1.00 . A A . 13 PRO CD 1 1
11 2467 1 1 13 PRO CG C -8.637 4.869 2.464 1.00 . A A . 13 PRO CG 1 1
11 2468 1 1 13 PRO HA H -7.899 2.113 3.963 1.00 . A A . 13 PRO HA 1 1
11 2469 1 1 13 PRO HB2 H -10.115 3.746 3.522 1.00 . A A . 13 PRO HB2 1 1
11 2470 1 1 13 PRO HB3 H -8.699 4.178 4.483 1.00 . A A . 13 PRO HB3 1 1
11 2471 1 1 13 PRO HD2 H -7.233 4.679 0.881 1.00 . A A . 13 PRO HD2 1 1
11 2472 1 1 13 PRO HD3 H -6.505 4.856 2.491 1.00 . A A . 13 PRO HD3 1 1
11 2473 1 1 13 PRO HG2 H -9.373 4.876 1.675 1.00 . A A . 13 PRO HG2 1 1
11 2474 1 1 13 PRO HG3 H -8.553 5.853 2.906 1.00 . A A . 13 PRO HG3 1 1
11 2475 1 1 13 PRO N N -7.349 2.954 2.106 1.00 . A A . 13 PRO N 1 1
11 2476 1 1 13 PRO O O -10.220 1.000 3.287 1.00 . A A . 13 PRO O 1 1
11 2477 1 1 14 ASP C C -9.680 -1.091 1.103 1.00 . A A . 14 ASP C 1 1
11 2478 1 1 14 ASP CA C -10.110 0.278 0.577 1.00 . A A . 14 ASP CA 1 1
11 2479 1 1 14 ASP CB C -9.852 0.358 -0.944 1.00 . A A . 14 ASP CB 1 1
11 2480 1 1 14 ASP CG C -10.353 -0.846 -1.731 1.00 . A A . 14 ASP CG 1 1
11 2481 1 1 14 ASP H H -8.756 1.907 0.719 1.00 . A A . 14 ASP H 1 1
11 2482 1 1 14 ASP HA H -11.160 0.438 0.769 1.00 . A A . 14 ASP HA 1 1
11 2483 1 1 14 ASP HB2 H -10.342 1.235 -1.337 1.00 . A A . 14 ASP HB2 1 1
11 2484 1 1 14 ASP HB3 H -8.787 0.453 -1.106 1.00 . A A . 14 ASP HB3 1 1
11 2485 1 1 14 ASP N N -9.337 1.318 1.249 1.00 . A A . 14 ASP N 1 1
11 2486 1 1 14 ASP O O -10.477 -2.028 1.181 1.00 . A A . 14 ASP O 1 1
11 2487 1 1 14 ASP OD1 O -9.523 -1.593 -2.294 1.00 . A A . 14 ASP OD1 1 1
11 2488 1 1 14 ASP OD2 O -11.574 -1.063 -1.817 1.00 . A A . 14 ASP OD2 1 1
11 2489 2 2 1 . C C -1.732 -1.261 3.780 1.00 . B A . 101 WMH C 1 1
11 2490 2 2 1 . C1 C -0.738 1.001 3.471 1.00 . B A . 101 WMH C1 1 1
11 2491 2 2 1 . C2 C 0.513 1.499 3.598 1.00 . B A . 101 WMH C2 1 1
11 2492 2 2 1 . H1 H -1.897 -1.632 4.781 1.00 . B A . 101 WMH H1 1 1
11 2493 2 2 1 . H2 H -2.631 -0.780 3.425 1.00 . B A . 101 WMH H2 1 1
11 2494 2 2 1 . H5 H 0.803 2.520 3.400 1.00 . B A . 101 WMH H5 1 1
11 2495 2 2 1 . N N -0.686 -0.305 3.803 1.00 . B A . 101 WMH N 1 1
11 2496 2 2 1 . N1 N 1.323 0.535 4.003 1.00 . B A . 101 WMH N1 1 1
11 2497 2 2 1 . N2 N 0.657 -0.563 4.141 1.00 . B A . 101 WMH N2 1 1
12 2498 1 1 1 GLY C C -6.641 -2.854 0.937 1.00 . A A . 1 GLY C 1 1
12 2499 1 1 1 GLY CA C -7.797 -2.516 1.844 1.00 . A A . 1 GLY CA 1 1
12 2500 1 1 1 GLY H1 H -8.038 -0.412 1.690 1.00 . A A . 1 GLY H1 1 1
12 2501 1 1 1 GLY HA2 H -7.421 -2.450 2.853 1.00 . A A . 1 GLY HA2 1 1
12 2502 1 1 1 GLY HA3 H -8.520 -3.318 1.798 1.00 . A A . 1 GLY HA3 1 1
12 2503 1 1 1 GLY N N -8.471 -1.279 1.520 1.00 . A A . 1 GLY N 1 1
12 2504 1 1 1 GLY O O -6.413 -4.027 0.630 1.00 . A A . 1 GLY O 1 1
12 2505 1 1 2 ARG C C -3.488 -1.513 0.262 1.00 . A A . 2 ARG C 1 1
12 2506 1 1 2 ARG CA C -4.740 -2.114 -0.341 1.00 . A A . 2 ARG CA 1 1
12 2507 1 1 2 ARG CB C -4.943 -1.559 -1.770 1.00 . A A . 2 ARG CB 1 1
12 2508 1 1 2 ARG CD C -5.800 -3.639 -2.926 1.00 . A A . 2 ARG CD 1 1
12 2509 1 1 2 ARG CG C -6.079 -2.186 -2.562 1.00 . A A . 2 ARG CG 1 1
12 2510 1 1 2 ARG CZ C -4.190 -4.948 -4.319 1.00 . A A . 2 ARG CZ 1 1
12 2511 1 1 2 ARG H H -6.107 -0.948 0.796 1.00 . A A . 2 ARG H 1 1
12 2512 1 1 2 ARG HA H -4.608 -3.184 -0.400 1.00 . A A . 2 ARG HA 1 1
12 2513 1 1 2 ARG HB2 H -5.128 -0.498 -1.712 1.00 . A A . 2 ARG HB2 1 1
12 2514 1 1 2 ARG HB3 H -4.027 -1.712 -2.322 1.00 . A A . 2 ARG HB3 1 1
12 2515 1 1 2 ARG HD2 H -5.602 -4.195 -2.022 1.00 . A A . 2 ARG HD2 1 1
12 2516 1 1 2 ARG HD3 H -6.672 -4.049 -3.411 1.00 . A A . 2 ARG HD3 1 1
12 2517 1 1 2 ARG HE H -4.188 -2.948 -4.077 1.00 . A A . 2 ARG HE 1 1
12 2518 1 1 2 ARG HG2 H -6.974 -2.147 -1.957 1.00 . A A . 2 ARG HG2 1 1
12 2519 1 1 2 ARG HG3 H -6.234 -1.615 -3.467 1.00 . A A . 2 ARG HG3 1 1
12 2520 1 1 2 ARG HH11 H -5.671 -6.104 -3.516 1.00 . A A . 2 ARG HH11 1 1
12 2521 1 1 2 ARG HH12 H -4.492 -6.958 -4.398 1.00 . A A . 2 ARG HH12 1 1
12 2522 1 1 2 ARG HH21 H -2.637 -4.107 -5.339 1.00 . A A . 2 ARG HH21 1 1
12 2523 1 1 2 ARG HH22 H -2.727 -5.815 -5.466 1.00 . A A . 2 ARG HH22 1 1
12 2524 1 1 2 ARG N N -5.894 -1.864 0.514 1.00 . A A . 2 ARG N 1 1
12 2525 1 1 2 ARG NE N -4.647 -3.782 -3.833 1.00 . A A . 2 ARG NE 1 1
12 2526 1 1 2 ARG NH1 N -4.832 -6.075 -4.063 1.00 . A A . 2 ARG NH1 1 1
12 2527 1 1 2 ARG NH2 N -3.113 -4.962 -5.100 1.00 . A A . 2 ARG NH2 1 1
12 2528 1 1 2 ARG O O -3.272 -0.317 0.171 1.00 . A A . 2 ARG O 1 1
12 2529 1 1 3 ALA C C -0.327 -2.552 0.656 1.00 . A A . 3 ALA C 1 1
12 2530 1 1 3 ALA CA C -1.422 -1.933 1.457 1.00 . A A . 3 ALA CA 1 1
12 2531 1 1 3 ALA CB C -1.267 -2.334 2.934 1.00 . A A . 3 ALA CB 1 1
12 2532 1 1 3 ALA H H -2.992 -3.264 1.037 1.00 . A A . 3 ALA H 1 1
12 2533 1 1 3 ALA HA H -1.344 -0.859 1.377 1.00 . A A . 3 ALA HA 1 1
12 2534 1 1 3 ALA HB1 H -0.226 -2.563 3.115 1.00 . A A . 3 ALA HB1 1 1
12 2535 1 1 3 ALA HB2 H -1.849 -3.225 3.113 1.00 . A A . 3 ALA HB2 1 1
12 2536 1 1 3 ALA N N -2.710 -2.332 0.917 1.00 . A A . 3 ALA N 1 1
12 2537 1 1 3 ALA O O -0.384 -3.740 0.322 1.00 . A A . 3 ALA O 1 1
12 2538 1 1 4 TYR C C 3.002 -2.172 0.455 1.00 . A A . 4 TYR C 1 1
12 2539 1 1 4 TYR CA C 1.778 -2.244 -0.406 1.00 . A A . 4 TYR CA 1 1
12 2540 1 1 4 TYR CB C 1.962 -1.446 -1.694 1.00 . A A . 4 TYR CB 1 1
12 2541 1 1 4 TYR CD1 C -0.308 -0.872 -2.653 1.00 . A A . 4 TYR CD1 1 1
12 2542 1 1 4 TYR CD2 C 0.931 -2.636 -3.653 1.00 . A A . 4 TYR CD2 1 1
12 2543 1 1 4 TYR CE1 C -1.327 -1.072 -3.554 1.00 . A A . 4 TYR CE1 1 1
12 2544 1 1 4 TYR CE2 C -0.079 -2.839 -4.557 1.00 . A A . 4 TYR CE2 1 1
12 2545 1 1 4 TYR CG C 0.840 -1.652 -2.687 1.00 . A A . 4 TYR CG 1 1
12 2546 1 1 4 TYR CZ C -1.206 -2.056 -4.505 1.00 . A A . 4 TYR CZ 1 1
12 2547 1 1 4 TYR H H 0.619 -0.825 0.586 1.00 . A A . 4 TYR H 1 1
12 2548 1 1 4 TYR HA H 1.596 -3.279 -0.660 1.00 . A A . 4 TYR HA 1 1
12 2549 1 1 4 TYR HB2 H 2.006 -0.393 -1.456 1.00 . A A . 4 TYR HB2 1 1
12 2550 1 1 4 TYR HB3 H 2.886 -1.741 -2.167 1.00 . A A . 4 TYR HB3 1 1
12 2551 1 1 4 TYR HD1 H -0.398 -0.102 -1.902 1.00 . A A . 4 TYR HD1 1 1
12 2552 1 1 4 TYR HD2 H 1.817 -3.254 -3.694 1.00 . A A . 4 TYR HD2 1 1
12 2553 1 1 4 TYR HE1 H -2.212 -0.455 -3.511 1.00 . A A . 4 TYR HE1 1 1
12 2554 1 1 4 TYR HE2 H 0.022 -3.613 -5.302 1.00 . A A . 4 TYR HE2 1 1
12 2555 1 1 4 TYR HH H -2.420 -1.410 -5.807 1.00 . A A . 4 TYR HH 1 1
12 2556 1 1 4 TYR N N 0.647 -1.774 0.333 1.00 . A A . 4 TYR N 1 1
12 2557 1 1 4 TYR O O 3.289 -1.136 1.038 1.00 . A A . 4 TYR O 1 1
12 2558 1 1 4 TYR OH O -2.213 -2.262 -5.401 1.00 . A A . 4 TYR OH 1 1
12 2559 1 1 5 LYS C C 6.062 -2.667 0.712 1.00 . A A . 5 LYS C 1 1
12 2560 1 1 5 LYS CA C 4.890 -3.386 1.382 1.00 . A A . 5 LYS CA 1 1
12 2561 1 1 5 LYS CB C 5.273 -4.864 1.705 1.00 . A A . 5 LYS CB 1 1
12 2562 1 1 5 LYS CD C 4.766 -6.012 -0.539 1.00 . A A . 5 LYS CD 1 1
12 2563 1 1 5 LYS CE C 5.355 -6.816 -1.690 1.00 . A A . 5 LYS CE 1 1
12 2564 1 1 5 LYS CG C 5.810 -5.716 0.531 1.00 . A A . 5 LYS CG 1 1
12 2565 1 1 5 LYS H H 3.323 -4.090 0.132 1.00 . A A . 5 LYS H 1 1
12 2566 1 1 5 LYS HA H 4.679 -2.876 2.310 1.00 . A A . 5 LYS HA 1 1
12 2567 1 1 5 LYS HB2 H 6.037 -4.854 2.470 1.00 . A A . 5 LYS HB2 1 1
12 2568 1 1 5 LYS HB3 H 4.400 -5.357 2.108 1.00 . A A . 5 LYS HB3 1 1
12 2569 1 1 5 LYS HD2 H 3.950 -6.571 -0.104 1.00 . A A . 5 LYS HD2 1 1
12 2570 1 1 5 LYS HD3 H 4.399 -5.075 -0.931 1.00 . A A . 5 LYS HD3 1 1
12 2571 1 1 5 LYS HE2 H 5.776 -7.731 -1.298 1.00 . A A . 5 LYS HE2 1 1
12 2572 1 1 5 LYS HE3 H 4.564 -7.056 -2.384 1.00 . A A . 5 LYS HE3 1 1
12 2573 1 1 5 LYS HG2 H 6.617 -5.175 0.065 1.00 . A A . 5 LYS HG2 1 1
12 2574 1 1 5 LYS HG3 H 6.189 -6.648 0.925 1.00 . A A . 5 LYS HG3 1 1
12 2575 1 1 5 LYS HZ1 H 6.057 -5.173 -2.796 1.00 . A A . 5 LYS HZ1 1 1
12 2576 1 1 5 LYS HZ2 H 6.758 -6.627 -3.219 1.00 . A A . 5 LYS HZ2 1 1
12 2577 1 1 5 LYS HZ3 H 7.235 -5.862 -1.805 1.00 . A A . 5 LYS HZ3 1 1
12 2578 1 1 5 LYS N N 3.681 -3.293 0.574 1.00 . A A . 5 LYS N 1 1
12 2579 1 1 5 LYS NZ N 6.415 -6.073 -2.408 1.00 . A A . 5 LYS NZ 1 1
12 2580 1 1 5 LYS O O 7.040 -2.321 1.368 1.00 . A A . 5 LYS O 1 1
12 2581 1 1 6 SER C C 6.944 -0.287 -1.014 1.00 . A A . 6 SER C 1 1
12 2582 1 1 6 SER CA C 6.991 -1.781 -1.315 1.00 . A A . 6 SER CA 1 1
12 2583 1 1 6 SER CB C 6.851 -2.059 -2.803 1.00 . A A . 6 SER CB 1 1
12 2584 1 1 6 SER H H 5.173 -2.768 -1.075 1.00 . A A . 6 SER H 1 1
12 2585 1 1 6 SER HA H 7.936 -2.170 -0.972 1.00 . A A . 6 SER HA 1 1
12 2586 1 1 6 SER HB2 H 5.879 -1.731 -3.140 1.00 . A A . 6 SER HB2 1 1
12 2587 1 1 6 SER HB3 H 7.622 -1.531 -3.343 1.00 . A A . 6 SER HB3 1 1
12 2588 1 1 6 SER HG H 7.925 -3.643 -2.939 1.00 . A A . 6 SER HG 1 1
12 2589 1 1 6 SER N N 5.964 -2.466 -0.587 1.00 . A A . 6 SER N 1 1
12 2590 1 1 6 SER O O 5.874 0.313 -0.980 1.00 . A A . 6 SER O 1 1
12 2591 1 1 6 SER OG O 6.985 -3.451 -3.056 1.00 . A A . 6 SER OG 1 1
12 2592 1 1 7 LYS C C 8.162 2.583 -1.616 1.00 . A A . 7 LYS C 1 1
12 2593 1 1 7 LYS CA C 8.225 1.670 -0.400 1.00 . A A . 7 LYS CA 1 1
12 2594 1 1 7 LYS CB C 9.525 1.889 0.355 1.00 . A A . 7 LYS CB 1 1
12 2595 1 1 7 LYS CD C 10.968 1.236 2.346 1.00 . A A . 7 LYS CD 1 1
12 2596 1 1 7 LYS CE C 12.173 0.853 1.483 1.00 . A A . 7 LYS CE 1 1
12 2597 1 1 7 LYS CG C 9.635 1.056 1.616 1.00 . A A . 7 LYS CG 1 1
12 2598 1 1 7 LYS H H 8.916 -0.250 -0.910 1.00 . A A . 7 LYS H 1 1
12 2599 1 1 7 LYS HA H 7.405 1.884 0.265 1.00 . A A . 7 LYS HA 1 1
12 2600 1 1 7 LYS HB2 H 10.344 1.625 -0.296 1.00 . A A . 7 LYS HB2 1 1
12 2601 1 1 7 LYS HB3 H 9.600 2.930 0.627 1.00 . A A . 7 LYS HB3 1 1
12 2602 1 1 7 LYS HD2 H 11.066 2.272 2.632 1.00 . A A . 7 LYS HD2 1 1
12 2603 1 1 7 LYS HD3 H 10.960 0.621 3.234 1.00 . A A . 7 LYS HD3 1 1
12 2604 1 1 7 LYS HE2 H 12.973 0.494 2.110 1.00 . A A . 7 LYS HE2 1 1
12 2605 1 1 7 LYS HE3 H 11.830 0.060 0.835 1.00 . A A . 7 LYS HE3 1 1
12 2606 1 1 7 LYS HG2 H 8.837 1.338 2.287 1.00 . A A . 7 LYS HG2 1 1
12 2607 1 1 7 LYS HG3 H 9.519 0.017 1.346 1.00 . A A . 7 LYS HG3 1 1
12 2608 1 1 7 LYS HZ1 H 11.961 2.353 -0.021 1.00 . A A . 7 LYS HZ1 1 1
12 2609 1 1 7 LYS HZ2 H 13.495 1.680 0.075 1.00 . A A . 7 LYS HZ2 1 1
12 2610 1 1 7 LYS HZ3 H 12.987 2.758 1.237 1.00 . A A . 7 LYS HZ3 1 1
12 2611 1 1 7 LYS N N 8.103 0.286 -0.788 1.00 . A A . 7 LYS N 1 1
12 2612 1 1 7 LYS NZ N 12.671 1.969 0.636 1.00 . A A . 7 LYS NZ 1 1
12 2613 1 1 7 LYS O O 8.685 2.229 -2.683 1.00 . A A . 7 LYS O 1 1
12 2614 1 1 8 PRO C C 5.517 3.370 -0.080 1.00 . A A . 8 PRO C 1 1
12 2615 1 1 8 PRO CA C 6.796 4.180 -0.288 1.00 . A A . 8 PRO CA 1 1
12 2616 1 1 8 PRO CB C 6.432 5.649 -0.578 1.00 . A A . 8 PRO CB 1 1
12 2617 1 1 8 PRO CD C 7.378 4.749 -2.564 1.00 . A A . 8 PRO CD 1 1
12 2618 1 1 8 PRO CG C 7.215 6.012 -1.790 1.00 . A A . 8 PRO CG 1 1
12 2619 1 1 8 PRO HA H 7.440 4.121 0.576 1.00 . A A . 8 PRO HA 1 1
12 2620 1 1 8 PRO HB2 H 5.369 5.723 -0.759 1.00 . A A . 8 PRO HB2 1 1
12 2621 1 1 8 PRO HB3 H 6.699 6.267 0.267 1.00 . A A . 8 PRO HB3 1 1
12 2622 1 1 8 PRO HD2 H 6.512 4.564 -3.183 1.00 . A A . 8 PRO HD2 1 1
12 2623 1 1 8 PRO HD3 H 8.276 4.788 -3.161 1.00 . A A . 8 PRO HD3 1 1
12 2624 1 1 8 PRO HG2 H 6.684 6.747 -2.375 1.00 . A A . 8 PRO HG2 1 1
12 2625 1 1 8 PRO HG3 H 8.181 6.392 -1.492 1.00 . A A . 8 PRO HG3 1 1
12 2626 1 1 8 PRO N N 7.499 3.748 -1.508 1.00 . A A . 8 PRO N 1 1
12 2627 1 1 8 PRO O O 4.741 3.187 -1.032 1.00 . A A . 8 PRO O 1 1
12 2628 1 1 9 PRO C C 2.835 2.865 1.317 1.00 . A A . 9 PRO C 1 1
12 2629 1 1 9 PRO CA C 4.110 2.045 1.430 1.00 . A A . 9 PRO CA 1 1
12 2630 1 1 9 PRO CB C 4.322 1.576 2.878 1.00 . A A . 9 PRO CB 1 1
12 2631 1 1 9 PRO CD C 6.131 3.012 2.334 1.00 . A A . 9 PRO CD 1 1
12 2632 1 1 9 PRO CG C 5.764 1.817 3.151 1.00 . A A . 9 PRO CG 1 1
12 2633 1 1 9 PRO HA H 4.047 1.192 0.770 1.00 . A A . 9 PRO HA 1 1
12 2634 1 1 9 PRO HB2 H 3.691 2.155 3.536 1.00 . A A . 9 PRO HB2 1 1
12 2635 1 1 9 PRO HB3 H 4.073 0.528 2.962 1.00 . A A . 9 PRO HB3 1 1
12 2636 1 1 9 PRO HD2 H 5.898 3.923 2.867 1.00 . A A . 9 PRO HD2 1 1
12 2637 1 1 9 PRO HD3 H 7.181 2.969 2.086 1.00 . A A . 9 PRO HD3 1 1
12 2638 1 1 9 PRO HG2 H 5.913 2.016 4.201 1.00 . A A . 9 PRO HG2 1 1
12 2639 1 1 9 PRO HG3 H 6.346 0.961 2.843 1.00 . A A . 9 PRO HG3 1 1
12 2640 1 1 9 PRO N N 5.286 2.853 1.139 1.00 . A A . 9 PRO N 1 1
12 2641 1 1 9 PRO O O 2.590 3.793 2.099 1.00 . A A . 9 PRO O 1 1
12 2642 1 1 10 ILE C C -0.312 2.319 0.509 1.00 . A A . 10 ILE C 1 1
12 2643 1 1 10 ILE CA C 0.824 3.244 0.100 1.00 . A A . 10 ILE CA 1 1
12 2644 1 1 10 ILE CB C 0.674 3.734 -1.386 1.00 . A A . 10 ILE CB 1 1
12 2645 1 1 10 ILE CD1 C -0.890 5.693 -0.834 1.00 . A A . 10 ILE CD1 1 1
12 2646 1 1 10 ILE CG1 C -0.679 4.425 -1.632 1.00 . A A . 10 ILE CG1 1 1
12 2647 1 1 10 ILE CG2 C 0.892 2.607 -2.381 1.00 . A A . 10 ILE CG2 1 1
12 2648 1 1 10 ILE H H 2.344 1.864 -0.302 1.00 . A A . 10 ILE H 1 1
12 2649 1 1 10 ILE HA H 0.813 4.102 0.757 1.00 . A A . 10 ILE HA 1 1
12 2650 1 1 10 ILE HB H 1.461 4.454 -1.555 1.00 . A A . 10 ILE HB 1 1
12 2651 1 1 10 ILE HD11 H -0.842 5.468 0.221 1.00 . A A . 10 ILE HD11 1 1
12 2652 1 1 10 ILE HD12 H -1.854 6.116 -1.073 1.00 . A A . 10 ILE HD12 1 1
12 2653 1 1 10 ILE HD13 H -0.113 6.398 -1.085 1.00 . A A . 10 ILE HD13 1 1
12 2654 1 1 10 ILE HG12 H -0.759 4.682 -2.677 1.00 . A A . 10 ILE HG12 1 1
12 2655 1 1 10 ILE HG13 H -1.474 3.737 -1.380 1.00 . A A . 10 ILE HG13 1 1
12 2656 1 1 10 ILE HG21 H 1.877 2.184 -2.244 1.00 . A A . 10 ILE HG21 1 1
12 2657 1 1 10 ILE HG22 H 0.803 2.994 -3.385 1.00 . A A . 10 ILE HG22 1 1
12 2658 1 1 10 ILE HG23 H 0.146 1.843 -2.225 1.00 . A A . 10 ILE HG23 1 1
12 2659 1 1 10 ILE N N 2.066 2.571 0.316 1.00 . A A . 10 ILE N 1 1
12 2660 1 1 10 ILE O O -0.343 1.139 0.116 1.00 . A A . 10 ILE O 1 1
12 2661 1 1 11 ALA C C -3.570 2.763 1.505 1.00 . A A . 11 ALA C 1 1
12 2662 1 1 11 ALA CA C -2.291 2.050 1.823 1.00 . A A . 11 ALA CA 1 1
12 2663 1 1 11 ALA CB C -2.225 1.752 3.330 1.00 . A A . 11 ALA CB 1 1
12 2664 1 1 11 ALA H H -1.081 3.739 1.668 1.00 . A A . 11 ALA H 1 1
12 2665 1 1 11 ALA HA H -2.285 1.114 1.285 1.00 . A A . 11 ALA HA 1 1
12 2666 1 1 11 ALA HB1 H -3.061 1.127 3.602 1.00 . A A . 11 ALA HB1 1 1
12 2667 1 1 11 ALA HB2 H -2.308 2.686 3.867 1.00 . A A . 11 ALA HB2 1 1
12 2668 1 1 11 ALA N N -1.179 2.815 1.353 1.00 . A A . 11 ALA N 1 1
12 2669 1 1 11 ALA O O -3.775 3.916 1.899 1.00 . A A . 11 ALA O 1 1
12 2670 1 1 12 PHE C C -6.701 2.101 1.393 1.00 . A A . 12 PHE C 1 1
12 2671 1 1 12 PHE CA C -5.670 2.602 0.394 1.00 . A A . 12 PHE CA 1 1
12 2672 1 1 12 PHE CB C -6.022 2.131 -1.020 1.00 . A A . 12 PHE CB 1 1
12 2673 1 1 12 PHE CD1 C -3.893 1.876 -2.369 1.00 . A A . 12 PHE CD1 1 1
12 2674 1 1 12 PHE CD2 C -5.309 3.741 -2.807 1.00 . A A . 12 PHE CD2 1 1
12 2675 1 1 12 PHE CE1 C -3.019 2.303 -3.350 1.00 . A A . 12 PHE CE1 1 1
12 2676 1 1 12 PHE CE2 C -4.438 4.173 -3.785 1.00 . A A . 12 PHE CE2 1 1
12 2677 1 1 12 PHE CG C -5.053 2.593 -2.087 1.00 . A A . 12 PHE CG 1 1
12 2678 1 1 12 PHE CZ C -3.292 3.454 -4.057 1.00 . A A . 12 PHE CZ 1 1
12 2679 1 1 12 PHE H H -4.111 1.205 0.483 1.00 . A A . 12 PHE H 1 1
12 2680 1 1 12 PHE HA H -5.623 3.681 0.409 1.00 . A A . 12 PHE HA 1 1
12 2681 1 1 12 PHE HB2 H -6.061 1.054 -1.031 1.00 . A A . 12 PHE HB2 1 1
12 2682 1 1 12 PHE HB3 H -7.002 2.511 -1.274 1.00 . A A . 12 PHE HB3 1 1
12 2683 1 1 12 PHE HD1 H -3.673 0.976 -1.814 1.00 . A A . 12 PHE HD1 1 1
12 2684 1 1 12 PHE HD2 H -6.203 4.306 -2.598 1.00 . A A . 12 PHE HD2 1 1
12 2685 1 1 12 PHE HE1 H -2.120 1.743 -3.564 1.00 . A A . 12 PHE HE1 1 1
12 2686 1 1 12 PHE HE2 H -4.653 5.074 -4.338 1.00 . A A . 12 PHE HE2 1 1
12 2687 1 1 12 PHE HZ H -2.612 3.794 -4.826 1.00 . A A . 12 PHE HZ 1 1
12 2688 1 1 12 PHE N N -4.392 2.102 0.776 1.00 . A A . 12 PHE N 1 1
12 2689 1 1 12 PHE O O -6.707 0.897 1.708 1.00 . A A . 12 PHE O 1 1
12 2690 1 1 13 PRO C C -9.560 1.533 2.547 1.00 . A A . 13 PRO C 1 1
12 2691 1 1 13 PRO CA C -8.608 2.677 2.938 1.00 . A A . 13 PRO CA 1 1
12 2692 1 1 13 PRO CB C -9.400 3.980 3.062 1.00 . A A . 13 PRO CB 1 1
12 2693 1 1 13 PRO CD C -7.596 4.444 1.577 1.00 . A A . 13 PRO CD 1 1
12 2694 1 1 13 PRO CG C -8.443 5.039 2.661 1.00 . A A . 13 PRO CG 1 1
12 2695 1 1 13 PRO HA H -8.155 2.448 3.890 1.00 . A A . 13 PRO HA 1 1
12 2696 1 1 13 PRO HB2 H -10.253 3.945 2.401 1.00 . A A . 13 PRO HB2 1 1
12 2697 1 1 13 PRO HB3 H -9.730 4.110 4.081 1.00 . A A . 13 PRO HB3 1 1
12 2698 1 1 13 PRO HD2 H -8.041 4.610 0.607 1.00 . A A . 13 PRO HD2 1 1
12 2699 1 1 13 PRO HD3 H -6.605 4.869 1.625 1.00 . A A . 13 PRO HD3 1 1
12 2700 1 1 13 PRO HG2 H -8.981 5.900 2.289 1.00 . A A . 13 PRO HG2 1 1
12 2701 1 1 13 PRO HG3 H -7.830 5.316 3.505 1.00 . A A . 13 PRO HG3 1 1
12 2702 1 1 13 PRO N N -7.570 3.002 1.914 1.00 . A A . 13 PRO N 1 1
12 2703 1 1 13 PRO O O -10.306 1.021 3.382 1.00 . A A . 13 PRO O 1 1
12 2704 1 1 14 ASP C C -9.685 -1.300 0.999 1.00 . A A . 14 ASP C 1 1
12 2705 1 1 14 ASP CA C -10.382 0.049 0.826 1.00 . A A . 14 ASP CA 1 1
12 2706 1 1 14 ASP CB C -10.869 0.247 -0.616 1.00 . A A . 14 ASP CB 1 1
12 2707 1 1 14 ASP CG C -9.766 0.336 -1.633 1.00 . A A . 14 ASP CG 1 1
12 2708 1 1 14 ASP H H -8.972 1.632 0.661 1.00 . A A . 14 ASP H 1 1
12 2709 1 1 14 ASP HA H -11.242 0.037 1.479 1.00 . A A . 14 ASP HA 1 1
12 2710 1 1 14 ASP HB2 H -11.500 -0.584 -0.891 1.00 . A A . 14 ASP HB2 1 1
12 2711 1 1 14 ASP HB3 H -11.452 1.155 -0.665 1.00 . A A . 14 ASP HB3 1 1
12 2712 1 1 14 ASP N N -9.551 1.149 1.289 1.00 . A A . 14 ASP N 1 1
12 2713 1 1 14 ASP O O -10.243 -2.342 0.671 1.00 . A A . 14 ASP O 1 1
12 2714 1 1 14 ASP OD1 O -9.401 -0.683 -2.215 1.00 . A A . 14 ASP OD1 1 1
12 2715 1 1 14 ASP OD2 O -9.281 1.457 -1.905 1.00 . A A . 14 ASP OD2 1 1
12 2716 2 2 1 . C C -1.703 -1.281 3.939 1.00 . B A . 101 WMH C 1 1
12 2717 2 2 1 . C1 C -0.948 1.085 3.793 1.00 . B A . 101 WMH C1 1 1
12 2718 2 2 1 . C2 C 0.239 1.706 3.989 1.00 . B A . 101 WMH C2 1 1
12 2719 2 2 1 . H1 H -1.824 -1.751 4.905 1.00 . B A . 101 WMH H1 1 1
12 2720 2 2 1 . H2 H -2.648 -0.868 3.623 1.00 . B A . 101 WMH H2 1 1
12 2721 2 2 1 . H5 H 0.426 2.760 3.856 1.00 . B A . 101 WMH H5 1 1
12 2722 2 2 1 . N N -0.765 -0.226 4.051 1.00 . B A . 101 WMH N 1 1
12 2723 2 2 1 . N1 N 1.133 0.806 4.369 1.00 . B A . 101 WMH N1 1 1
12 2724 2 2 1 . N2 N 0.586 -0.359 4.422 1.00 . B A . 101 WMH N2 1 1
13 2725 1 1 1 GLY C C -6.826 -2.820 1.466 1.00 . A A . 1 GLY C 1 1
13 2726 1 1 1 GLY CA C -7.871 -2.322 2.415 1.00 . A A . 1 GLY CA 1 1
13 2727 1 1 1 GLY H1 H -8.031 -0.375 1.641 1.00 . A A . 1 GLY H1 1 1
13 2728 1 1 1 GLY HA2 H -7.416 -2.058 3.358 1.00 . A A . 1 GLY HA2 1 1
13 2729 1 1 1 GLY HA3 H -8.592 -3.110 2.579 1.00 . A A . 1 GLY HA3 1 1
13 2730 1 1 1 GLY N N -8.546 -1.180 1.874 1.00 . A A . 1 GLY N 1 1
13 2731 1 1 1 GLY O O -6.685 -4.026 1.252 1.00 . A A . 1 GLY O 1 1
13 2732 1 1 2 ARG C C -3.750 -1.728 0.325 1.00 . A A . 2 ARG C 1 1
13 2733 1 1 2 ARG CA C -5.090 -2.264 -0.092 1.00 . A A . 2 ARG CA 1 1
13 2734 1 1 2 ARG CB C -5.438 -1.720 -1.483 1.00 . A A . 2 ARG CB 1 1
13 2735 1 1 2 ARG CD C -6.751 -3.710 -2.301 1.00 . A A . 2 ARG CD 1 1
13 2736 1 1 2 ARG CG C -6.755 -2.210 -2.062 1.00 . A A . 2 ARG CG 1 1
13 2737 1 1 2 ARG CZ C -5.591 -5.314 -3.804 1.00 . A A . 2 ARG CZ 1 1
13 2738 1 1 2 ARG H H -6.199 -0.964 1.136 1.00 . A A . 2 ARG H 1 1
13 2739 1 1 2 ARG HA H -5.045 -3.341 -0.145 1.00 . A A . 2 ARG HA 1 1
13 2740 1 1 2 ARG HB2 H -5.469 -0.644 -1.430 1.00 . A A . 2 ARG HB2 1 1
13 2741 1 1 2 ARG HB3 H -4.646 -2.001 -2.162 1.00 . A A . 2 ARG HB3 1 1
13 2742 1 1 2 ARG HD2 H -6.616 -4.217 -1.357 1.00 . A A . 2 ARG HD2 1 1
13 2743 1 1 2 ARG HD3 H -7.704 -3.994 -2.724 1.00 . A A . 2 ARG HD3 1 1
13 2744 1 1 2 ARG HE H -4.977 -3.452 -3.390 1.00 . A A . 2 ARG HE 1 1
13 2745 1 1 2 ARG HG2 H -7.552 -1.969 -1.373 1.00 . A A . 2 ARG HG2 1 1
13 2746 1 1 2 ARG HG3 H -6.924 -1.703 -3.001 1.00 . A A . 2 ARG HG3 1 1
13 2747 1 1 2 ARG HH11 H -7.396 -6.034 -3.120 1.00 . A A . 2 ARG HH11 1 1
13 2748 1 1 2 ARG HH12 H -6.541 -7.106 -4.125 1.00 . A A . 2 ARG HH12 1 1
13 2749 1 1 2 ARG HH21 H -3.805 -4.917 -4.699 1.00 . A A . 2 ARG HH21 1 1
13 2750 1 1 2 ARG HH22 H -4.416 -6.486 -4.988 1.00 . A A . 2 ARG HH22 1 1
13 2751 1 1 2 ARG N N -6.093 -1.905 0.879 1.00 . A A . 2 ARG N 1 1
13 2752 1 1 2 ARG NE N -5.682 -4.119 -3.221 1.00 . A A . 2 ARG NE 1 1
13 2753 1 1 2 ARG NH1 N -6.570 -6.215 -3.665 1.00 . A A . 2 ARG NH1 1 1
13 2754 1 1 2 ARG NH2 N -4.533 -5.591 -4.553 1.00 . A A . 2 ARG NH2 1 1
13 2755 1 1 2 ARG O O -3.458 -0.565 0.103 1.00 . A A . 2 ARG O 1 1
13 2756 1 1 3 ALA C C -0.618 -2.848 0.472 1.00 . A A . 3 ALA C 1 1
13 2757 1 1 3 ALA CA C -1.631 -2.174 1.348 1.00 . A A . 3 ALA CA 1 1
13 2758 1 1 3 ALA CB C -1.388 -2.521 2.823 1.00 . A A . 3 ALA CB 1 1
13 2759 1 1 3 ALA H H -3.273 -3.462 1.138 1.00 . A A . 3 ALA H 1 1
13 2760 1 1 3 ALA HA H -1.538 -1.105 1.224 1.00 . A A . 3 ALA HA 1 1
13 2761 1 1 3 ALA HB1 H -0.344 -2.769 2.949 1.00 . A A . 3 ALA HB1 1 1
13 2762 1 1 3 ALA HB2 H -1.983 -3.385 3.078 1.00 . A A . 3 ALA HB2 1 1
13 2763 1 1 3 ALA N N -2.965 -2.550 0.942 1.00 . A A . 3 ALA N 1 1
13 2764 1 1 3 ALA O O -0.733 -4.041 0.162 1.00 . A A . 3 ALA O 1 1
13 2765 1 1 4 TYR C C 2.713 -2.416 -0.122 1.00 . A A . 4 TYR C 1 1
13 2766 1 1 4 TYR CA C 1.387 -2.574 -0.813 1.00 . A A . 4 TYR CA 1 1
13 2767 1 1 4 TYR CB C 1.360 -1.843 -2.165 1.00 . A A . 4 TYR CB 1 1
13 2768 1 1 4 TYR CD1 C -0.920 -0.975 -2.841 1.00 . A A . 4 TYR CD1 1 1
13 2769 1 1 4 TYR CD2 C -0.297 -3.161 -3.538 1.00 . A A . 4 TYR CD2 1 1
13 2770 1 1 4 TYR CE1 C -2.146 -1.129 -3.447 1.00 . A A . 4 TYR CE1 1 1
13 2771 1 1 4 TYR CE2 C -1.518 -3.316 -4.153 1.00 . A A . 4 TYR CE2 1 1
13 2772 1 1 4 TYR CG C 0.027 -1.991 -2.874 1.00 . A A . 4 TYR CG 1 1
13 2773 1 1 4 TYR CZ C -2.439 -2.300 -4.102 1.00 . A A . 4 TYR CZ 1 1
13 2774 1 1 4 TYR H H 0.355 -1.134 0.290 1.00 . A A . 4 TYR H 1 1
13 2775 1 1 4 TYR HA H 1.205 -3.626 -0.979 1.00 . A A . 4 TYR HA 1 1
13 2776 1 1 4 TYR HB2 H 1.542 -0.791 -2.005 1.00 . A A . 4 TYR HB2 1 1
13 2777 1 1 4 TYR HB3 H 2.129 -2.246 -2.806 1.00 . A A . 4 TYR HB3 1 1
13 2778 1 1 4 TYR HD1 H -0.683 -0.055 -2.325 1.00 . A A . 4 TYR HD1 1 1
13 2779 1 1 4 TYR HD2 H 0.426 -3.964 -3.580 1.00 . A A . 4 TYR HD2 1 1
13 2780 1 1 4 TYR HE1 H -2.865 -0.326 -3.410 1.00 . A A . 4 TYR HE1 1 1
13 2781 1 1 4 TYR HE2 H -1.743 -4.238 -4.667 1.00 . A A . 4 TYR HE2 1 1
13 2782 1 1 4 TYR HH H -3.859 -1.707 -5.261 1.00 . A A . 4 TYR HH 1 1
13 2783 1 1 4 TYR N N 0.346 -2.085 0.042 1.00 . A A . 4 TYR N 1 1
13 2784 1 1 4 TYR O O 3.063 -1.317 0.359 1.00 . A A . 4 TYR O 1 1
13 2785 1 1 4 TYR OH O -3.666 -2.466 -4.692 1.00 . A A . 4 TYR OH 1 1
13 2786 1 1 5 LYS C C 5.855 -3.154 -0.203 1.00 . A A . 5 LYS C 1 1
13 2787 1 1 5 LYS CA C 4.681 -3.538 0.670 1.00 . A A . 5 LYS CA 1 1
13 2788 1 1 5 LYS CB C 4.877 -4.896 1.313 1.00 . A A . 5 LYS CB 1 1
13 2789 1 1 5 LYS CD C 3.978 -6.629 2.903 1.00 . A A . 5 LYS CD 1 1
13 2790 1 1 5 LYS CE C 3.719 -7.673 1.824 1.00 . A A . 5 LYS CE 1 1
13 2791 1 1 5 LYS CG C 3.830 -5.219 2.365 1.00 . A A . 5 LYS CG 1 1
13 2792 1 1 5 LYS H H 3.128 -4.305 -0.505 1.00 . A A . 5 LYS H 1 1
13 2793 1 1 5 LYS HA H 4.616 -2.801 1.456 1.00 . A A . 5 LYS HA 1 1
13 2794 1 1 5 LYS HB2 H 4.827 -5.641 0.534 1.00 . A A . 5 LYS HB2 1 1
13 2795 1 1 5 LYS HB3 H 5.853 -4.927 1.773 1.00 . A A . 5 LYS HB3 1 1
13 2796 1 1 5 LYS HD2 H 4.985 -6.751 3.272 1.00 . A A . 5 LYS HD2 1 1
13 2797 1 1 5 LYS HD3 H 3.280 -6.773 3.713 1.00 . A A . 5 LYS HD3 1 1
13 2798 1 1 5 LYS HE2 H 2.743 -7.502 1.392 1.00 . A A . 5 LYS HE2 1 1
13 2799 1 1 5 LYS HE3 H 4.470 -7.574 1.055 1.00 . A A . 5 LYS HE3 1 1
13 2800 1 1 5 LYS HG2 H 3.934 -4.526 3.186 1.00 . A A . 5 LYS HG2 1 1
13 2801 1 1 5 LYS HG3 H 2.850 -5.110 1.924 1.00 . A A . 5 LYS HG3 1 1
13 2802 1 1 5 LYS HZ1 H 4.715 -9.280 2.714 1.00 . A A . 5 LYS HZ1 1 1
13 2803 1 1 5 LYS HZ2 H 3.502 -9.730 1.627 1.00 . A A . 5 LYS HZ2 1 1
13 2804 1 1 5 LYS HZ3 H 3.092 -9.130 3.145 1.00 . A A . 5 LYS HZ3 1 1
13 2805 1 1 5 LYS N N 3.436 -3.494 -0.046 1.00 . A A . 5 LYS N 1 1
13 2806 1 1 5 LYS NZ N 3.768 -9.042 2.360 1.00 . A A . 5 LYS NZ 1 1
13 2807 1 1 5 LYS O O 6.501 -3.995 -0.838 1.00 . A A . 5 LYS O 1 1
13 2808 1 1 6 SER C C 7.375 0.055 -0.310 1.00 . A A . 6 SER C 1 1
13 2809 1 1 6 SER CA C 7.124 -1.265 -1.011 1.00 . A A . 6 SER CA 1 1
13 2810 1 1 6 SER CB C 6.745 -1.053 -2.485 1.00 . A A . 6 SER CB 1 1
13 2811 1 1 6 SER H H 5.398 -1.275 0.120 1.00 . A A . 6 SER H 1 1
13 2812 1 1 6 SER HA H 7.996 -1.897 -0.932 1.00 . A A . 6 SER HA 1 1
13 2813 1 1 6 SER HB2 H 5.886 -0.402 -2.542 1.00 . A A . 6 SER HB2 1 1
13 2814 1 1 6 SER HB3 H 7.577 -0.606 -3.007 1.00 . A A . 6 SER HB3 1 1
13 2815 1 1 6 SER HG H 6.620 -2.982 -2.443 1.00 . A A . 6 SER HG 1 1
13 2816 1 1 6 SER N N 6.038 -1.880 -0.313 1.00 . A A . 6 SER N 1 1
13 2817 1 1 6 SER O O 6.599 0.414 0.574 1.00 . A A . 6 SER O 1 1
13 2818 1 1 6 SER OG O 6.424 -2.302 -3.107 1.00 . A A . 6 SER OG 1 1
13 2819 1 1 7 LYS C C 8.597 3.099 -1.111 1.00 . A A . 7 LYS C 1 1
13 2820 1 1 7 LYS CA C 8.691 2.037 -0.029 1.00 . A A . 7 LYS CA 1 1
13 2821 1 1 7 LYS CB C 10.064 2.077 0.660 1.00 . A A . 7 LYS CB 1 1
13 2822 1 1 7 LYS CD C 11.572 1.135 2.486 1.00 . A A . 7 LYS CD 1 1
13 2823 1 1 7 LYS CE C 11.857 2.486 3.144 1.00 . A A . 7 LYS CE 1 1
13 2824 1 1 7 LYS CG C 10.198 1.085 1.815 1.00 . A A . 7 LYS CG 1 1
13 2825 1 1 7 LYS H H 9.088 0.395 -1.277 1.00 . A A . 7 LYS H 1 1
13 2826 1 1 7 LYS HA H 7.914 2.211 0.700 1.00 . A A . 7 LYS HA 1 1
13 2827 1 1 7 LYS HB2 H 10.829 1.856 -0.071 1.00 . A A . 7 LYS HB2 1 1
13 2828 1 1 7 LYS HB3 H 10.226 3.074 1.045 1.00 . A A . 7 LYS HB3 1 1
13 2829 1 1 7 LYS HD2 H 11.618 0.368 3.245 1.00 . A A . 7 LYS HD2 1 1
13 2830 1 1 7 LYS HD3 H 12.326 0.940 1.739 1.00 . A A . 7 LYS HD3 1 1
13 2831 1 1 7 LYS HE2 H 12.833 2.446 3.603 1.00 . A A . 7 LYS HE2 1 1
13 2832 1 1 7 LYS HE3 H 11.857 3.254 2.384 1.00 . A A . 7 LYS HE3 1 1
13 2833 1 1 7 LYS HG2 H 9.450 1.326 2.556 1.00 . A A . 7 LYS HG2 1 1
13 2834 1 1 7 LYS HG3 H 10.023 0.089 1.437 1.00 . A A . 7 LYS HG3 1 1
13 2835 1 1 7 LYS HZ1 H 11.115 3.728 4.649 1.00 . A A . 7 LYS HZ1 1 1
13 2836 1 1 7 LYS HZ2 H 10.804 2.107 4.926 1.00 . A A . 7 LYS HZ2 1 1
13 2837 1 1 7 LYS HZ3 H 9.911 2.950 3.790 1.00 . A A . 7 LYS HZ3 1 1
13 2838 1 1 7 LYS N N 8.440 0.738 -0.623 1.00 . A A . 7 LYS N 1 1
13 2839 1 1 7 LYS NZ N 10.864 2.833 4.185 1.00 . A A . 7 LYS NZ 1 1
13 2840 1 1 7 LYS O O 9.257 2.968 -2.137 1.00 . A A . 7 LYS O 1 1
13 2841 1 1 8 PRO C C 5.705 3.402 0.251 1.00 . A A . 8 PRO C 1 1
13 2842 1 1 8 PRO CA C 6.914 4.345 0.244 1.00 . A A . 8 PRO CA 1 1
13 2843 1 1 8 PRO CB C 6.431 5.809 0.111 1.00 . A A . 8 PRO CB 1 1
13 2844 1 1 8 PRO CD C 7.567 5.221 -1.915 1.00 . A A . 8 PRO CD 1 1
13 2845 1 1 8 PRO CG C 7.188 6.380 -1.045 1.00 . A A . 8 PRO CG 1 1
13 2846 1 1 8 PRO HA H 7.475 4.225 1.159 1.00 . A A . 8 PRO HA 1 1
13 2847 1 1 8 PRO HB2 H 5.367 5.817 -0.072 1.00 . A A . 8 PRO HB2 1 1
13 2848 1 1 8 PRO HB3 H 6.642 6.343 1.024 1.00 . A A . 8 PRO HB3 1 1
13 2849 1 1 8 PRO HD2 H 6.769 4.984 -2.602 1.00 . A A . 8 PRO HD2 1 1
13 2850 1 1 8 PRO HD3 H 8.482 5.427 -2.449 1.00 . A A . 8 PRO HD3 1 1
13 2851 1 1 8 PRO HG2 H 6.558 7.067 -1.591 1.00 . A A . 8 PRO HG2 1 1
13 2852 1 1 8 PRO HG3 H 8.072 6.889 -0.690 1.00 . A A . 8 PRO HG3 1 1
13 2853 1 1 8 PRO N N 7.761 4.143 -0.943 1.00 . A A . 8 PRO N 1 1
13 2854 1 1 8 PRO O O 5.206 3.016 -0.824 1.00 . A A . 8 PRO O 1 1
13 2855 1 1 9 PRO C C 2.811 2.789 1.166 1.00 . A A . 9 PRO C 1 1
13 2856 1 1 9 PRO CA C 4.108 2.092 1.577 1.00 . A A . 9 PRO CA 1 1
13 2857 1 1 9 PRO CB C 4.094 1.718 3.065 1.00 . A A . 9 PRO CB 1 1
13 2858 1 1 9 PRO CD C 5.855 3.298 2.754 1.00 . A A . 9 PRO CD 1 1
13 2859 1 1 9 PRO CG C 4.848 2.803 3.746 1.00 . A A . 9 PRO CG 1 1
13 2860 1 1 9 PRO HA H 4.233 1.205 0.973 1.00 . A A . 9 PRO HA 1 1
13 2861 1 1 9 PRO HB2 H 3.072 1.669 3.411 1.00 . A A . 9 PRO HB2 1 1
13 2862 1 1 9 PRO HB3 H 4.569 0.759 3.201 1.00 . A A . 9 PRO HB3 1 1
13 2863 1 1 9 PRO HD2 H 5.990 4.366 2.852 1.00 . A A . 9 PRO HD2 1 1
13 2864 1 1 9 PRO HD3 H 6.796 2.785 2.883 1.00 . A A . 9 PRO HD3 1 1
13 2865 1 1 9 PRO HG2 H 4.173 3.598 4.027 1.00 . A A . 9 PRO HG2 1 1
13 2866 1 1 9 PRO HG3 H 5.346 2.410 4.622 1.00 . A A . 9 PRO HG3 1 1
13 2867 1 1 9 PRO N N 5.258 2.973 1.443 1.00 . A A . 9 PRO N 1 1
13 2868 1 1 9 PRO O O 2.382 3.779 1.781 1.00 . A A . 9 PRO O 1 1
13 2869 1 1 10 ILE C C -0.159 1.999 0.076 1.00 . A A . 10 ILE C 1 1
13 2870 1 1 10 ILE CA C 0.994 2.862 -0.396 1.00 . A A . 10 ILE CA 1 1
13 2871 1 1 10 ILE CB C 0.998 2.924 -1.954 1.00 . A A . 10 ILE CB 1 1
13 2872 1 1 10 ILE CD1 C 2.228 5.195 -2.001 1.00 . A A . 10 ILE CD1 1 1
13 2873 1 1 10 ILE CG1 C 2.195 3.747 -2.473 1.00 . A A . 10 ILE CG1 1 1
13 2874 1 1 10 ILE CG2 C -0.313 3.491 -2.487 1.00 . A A . 10 ILE CG2 1 1
13 2875 1 1 10 ILE H H 2.619 1.540 -0.351 1.00 . A A . 10 ILE H 1 1
13 2876 1 1 10 ILE HA H 0.880 3.862 -0.003 1.00 . A A . 10 ILE HA 1 1
13 2877 1 1 10 ILE HB H 1.091 1.913 -2.321 1.00 . A A . 10 ILE HB 1 1
13 2878 1 1 10 ILE HD11 H 3.085 5.693 -2.428 1.00 . A A . 10 ILE HD11 1 1
13 2879 1 1 10 ILE HD12 H 2.302 5.221 -0.924 1.00 . A A . 10 ILE HD12 1 1
13 2880 1 1 10 ILE HD13 H 1.324 5.697 -2.313 1.00 . A A . 10 ILE HD13 1 1
13 2881 1 1 10 ILE HG12 H 3.110 3.281 -2.142 1.00 . A A . 10 ILE HG12 1 1
13 2882 1 1 10 ILE HG13 H 2.171 3.750 -3.553 1.00 . A A . 10 ILE HG13 1 1
13 2883 1 1 10 ILE HG21 H -0.445 4.496 -2.117 1.00 . A A . 10 ILE HG21 1 1
13 2884 1 1 10 ILE HG22 H -1.134 2.875 -2.156 1.00 . A A . 10 ILE HG22 1 1
13 2885 1 1 10 ILE HG23 H -0.286 3.508 -3.567 1.00 . A A . 10 ILE HG23 1 1
13 2886 1 1 10 ILE N N 2.223 2.307 0.110 1.00 . A A . 10 ILE N 1 1
13 2887 1 1 10 ILE O O -0.198 0.798 -0.222 1.00 . A A . 10 ILE O 1 1
13 2888 1 1 11 ALA C C -3.447 2.636 1.045 1.00 . A A . 11 ALA C 1 1
13 2889 1 1 11 ALA CA C -2.198 1.851 1.342 1.00 . A A . 11 ALA CA 1 1
13 2890 1 1 11 ALA CB C -2.153 1.565 2.857 1.00 . A A . 11 ALA CB 1 1
13 2891 1 1 11 ALA H H -0.940 3.513 1.114 1.00 . A A . 11 ALA H 1 1
13 2892 1 1 11 ALA HA H -2.245 0.914 0.809 1.00 . A A . 11 ALA HA 1 1
13 2893 1 1 11 ALA HB1 H -3.007 0.955 3.110 1.00 . A A . 11 ALA HB1 1 1
13 2894 1 1 11 ALA HB2 H -2.243 2.504 3.382 1.00 . A A . 11 ALA HB2 1 1
13 2895 1 1 11 ALA N N -1.049 2.574 0.858 1.00 . A A . 11 ALA N 1 1
13 2896 1 1 11 ALA O O -3.530 3.826 1.348 1.00 . A A . 11 ALA O 1 1
13 2897 1 1 12 PHE C C -6.658 2.137 1.194 1.00 . A A . 12 PHE C 1 1
13 2898 1 1 12 PHE CA C -5.654 2.583 0.143 1.00 . A A . 12 PHE CA 1 1
13 2899 1 1 12 PHE CB C -6.136 2.208 -1.261 1.00 . A A . 12 PHE CB 1 1
13 2900 1 1 12 PHE CD1 C -4.233 1.930 -2.868 1.00 . A A . 12 PHE CD1 1 1
13 2901 1 1 12 PHE CD2 C -5.474 3.957 -2.925 1.00 . A A . 12 PHE CD2 1 1
13 2902 1 1 12 PHE CE1 C -3.433 2.388 -3.894 1.00 . A A . 12 PHE CE1 1 1
13 2903 1 1 12 PHE CE2 C -4.679 4.422 -3.950 1.00 . A A . 12 PHE CE2 1 1
13 2904 1 1 12 PHE CG C -5.259 2.707 -2.372 1.00 . A A . 12 PHE CG 1 1
13 2905 1 1 12 PHE CZ C -3.657 3.636 -4.435 1.00 . A A . 12 PHE CZ 1 1
13 2906 1 1 12 PHE H H -4.202 1.055 0.194 1.00 . A A . 12 PHE H 1 1
13 2907 1 1 12 PHE HA H -5.520 3.653 0.201 1.00 . A A . 12 PHE HA 1 1
13 2908 1 1 12 PHE HB2 H -6.216 1.136 -1.348 1.00 . A A . 12 PHE HB2 1 1
13 2909 1 1 12 PHE HB3 H -7.115 2.636 -1.405 1.00 . A A . 12 PHE HB3 1 1
13 2910 1 1 12 PHE HD1 H -4.065 0.954 -2.436 1.00 . A A . 12 PHE HD1 1 1
13 2911 1 1 12 PHE HD2 H -6.276 4.575 -2.546 1.00 . A A . 12 PHE HD2 1 1
13 2912 1 1 12 PHE HE1 H -2.630 1.773 -4.276 1.00 . A A . 12 PHE HE1 1 1
13 2913 1 1 12 PHE HE2 H -4.859 5.399 -4.373 1.00 . A A . 12 PHE HE2 1 1
13 2914 1 1 12 PHE HZ H -3.032 3.998 -5.238 1.00 . A A . 12 PHE HZ 1 1
13 2915 1 1 12 PHE N N -4.383 1.990 0.439 1.00 . A A . 12 PHE N 1 1
13 2916 1 1 12 PHE O O -6.737 0.930 1.491 1.00 . A A . 12 PHE O 1 1
13 2917 1 1 13 PRO C C -9.427 1.707 2.640 1.00 . A A . 13 PRO C 1 1
13 2918 1 1 13 PRO CA C -8.417 2.857 2.871 1.00 . A A . 13 PRO CA 1 1
13 2919 1 1 13 PRO CB C -9.158 4.186 2.964 1.00 . A A . 13 PRO CB 1 1
13 2920 1 1 13 PRO CD C -7.378 4.538 1.419 1.00 . A A . 13 PRO CD 1 1
13 2921 1 1 13 PRO CG C -8.172 5.197 2.504 1.00 . A A . 13 PRO CG 1 1
13 2922 1 1 13 PRO HA H -7.908 2.680 3.806 1.00 . A A . 13 PRO HA 1 1
13 2923 1 1 13 PRO HB2 H -10.024 4.157 2.321 1.00 . A A . 13 PRO HB2 1 1
13 2924 1 1 13 PRO HB3 H -9.463 4.367 3.984 1.00 . A A . 13 PRO HB3 1 1
13 2925 1 1 13 PRO HD2 H -7.825 4.718 0.453 1.00 . A A . 13 PRO HD2 1 1
13 2926 1 1 13 PRO HD3 H -6.363 4.906 1.448 1.00 . A A . 13 PRO HD3 1 1
13 2927 1 1 13 PRO HG2 H -8.684 6.065 2.117 1.00 . A A . 13 PRO HG2 1 1
13 2928 1 1 13 PRO HG3 H -7.523 5.478 3.321 1.00 . A A . 13 PRO HG3 1 1
13 2929 1 1 13 PRO N N -7.429 3.097 1.772 1.00 . A A . 13 PRO N 1 1
13 2930 1 1 13 PRO O O -10.105 1.269 3.583 1.00 . A A . 13 PRO O 1 1
13 2931 1 1 14 ASP C C -9.845 -1.173 1.704 1.00 . A A . 14 ASP C 1 1
13 2932 1 1 14 ASP CA C -10.419 0.096 1.087 1.00 . A A . 14 ASP CA 1 1
13 2933 1 1 14 ASP CB C -10.543 -0.075 -0.433 1.00 . A A . 14 ASP CB 1 1
13 2934 1 1 14 ASP CG C -11.303 -1.319 -0.856 1.00 . A A . 14 ASP CG 1 1
13 2935 1 1 14 ASP H H -9.078 1.718 0.691 1.00 . A A . 14 ASP H 1 1
13 2936 1 1 14 ASP HA H -11.397 0.278 1.505 1.00 . A A . 14 ASP HA 1 1
13 2937 1 1 14 ASP HB2 H -11.057 0.781 -0.843 1.00 . A A . 14 ASP HB2 1 1
13 2938 1 1 14 ASP HB3 H -9.550 -0.121 -0.856 1.00 . A A . 14 ASP HB3 1 1
13 2939 1 1 14 ASP N N -9.561 1.251 1.407 1.00 . A A . 14 ASP N 1 1
13 2940 1 1 14 ASP O O -10.574 -2.093 2.069 1.00 . A A . 14 ASP O 1 1
13 2941 1 1 14 ASP OD1 O -10.662 -2.289 -1.295 1.00 . A A . 14 ASP OD1 1 1
13 2942 1 1 14 ASP OD2 O -12.555 -1.330 -0.803 1.00 . A A . 14 ASP OD2 1 1
13 2943 2 2 1 . C C -1.737 -1.416 3.806 1.00 . B A . 101 WMH C 1 1
13 2944 2 2 1 . C1 C -0.902 0.891 3.378 1.00 . B A . 101 WMH C1 1 1
13 2945 2 2 1 . C2 C 0.296 1.479 3.518 1.00 . B A . 101 WMH C2 1 1
13 2946 2 2 1 . H1 H -1.812 -1.840 4.797 1.00 . B A . 101 WMH H1 1 1
13 2947 2 2 1 . H2 H -2.687 -0.990 3.525 1.00 . B A . 101 WMH H2 1 1
13 2948 2 2 1 . H5 H 0.525 2.499 3.248 1.00 . B A . 101 WMH H5 1 1
13 2949 2 2 1 . N N -0.775 -0.384 3.812 1.00 . B A . 101 WMH N 1 1
13 2950 2 2 1 . N1 N 1.148 0.615 4.036 1.00 . B A . 101 WMH N1 1 1
13 2951 2 2 1 . N2 N 0.557 -0.512 4.233 1.00 . B A . 101 WMH N2 1 1
14 2952 1 1 1 GLY C C -6.884 -2.992 1.665 1.00 . A A . 1 GLY C 1 1
14 2953 1 1 1 GLY CA C -7.860 -2.456 2.664 1.00 . A A . 1 GLY CA 1 1
14 2954 1 1 1 GLY H1 H -8.099 -0.541 1.827 1.00 . A A . 1 GLY H1 1 1
14 2955 1 1 1 GLY HA2 H -7.344 -2.125 3.552 1.00 . A A . 1 GLY HA2 1 1
14 2956 1 1 1 GLY HA3 H -8.555 -3.241 2.926 1.00 . A A . 1 GLY HA3 1 1
14 2957 1 1 1 GLY N N -8.582 -1.357 2.089 1.00 . A A . 1 GLY N 1 1
14 2958 1 1 1 GLY O O -6.983 -4.144 1.226 1.00 . A A . 1 GLY O 1 1
14 2959 1 1 2 ARG C C -3.725 -1.733 0.522 1.00 . A A . 2 ARG C 1 1
14 2960 1 1 2 ARG CA C -5.002 -2.498 0.262 1.00 . A A . 2 ARG CA 1 1
14 2961 1 1 2 ARG CB C -5.583 -2.126 -1.105 1.00 . A A . 2 ARG CB 1 1
14 2962 1 1 2 ARG CD C -5.459 -2.202 -3.596 1.00 . A A . 2 ARG CD 1 1
14 2963 1 1 2 ARG CG C -4.747 -2.544 -2.297 1.00 . A A . 2 ARG CG 1 1
14 2964 1 1 2 ARG CZ C -7.698 -2.593 -4.657 1.00 . A A . 2 ARG CZ 1 1
14 2965 1 1 2 ARG H H -5.896 -1.276 1.711 1.00 . A A . 2 ARG H 1 1
14 2966 1 1 2 ARG HA H -4.813 -3.561 0.292 1.00 . A A . 2 ARG HA 1 1
14 2967 1 1 2 ARG HB2 H -6.554 -2.588 -1.201 1.00 . A A . 2 ARG HB2 1 1
14 2968 1 1 2 ARG HB3 H -5.709 -1.054 -1.138 1.00 . A A . 2 ARG HB3 1 1
14 2969 1 1 2 ARG HD2 H -5.547 -1.130 -3.679 1.00 . A A . 2 ARG HD2 1 1
14 2970 1 1 2 ARG HD3 H -4.868 -2.580 -4.417 1.00 . A A . 2 ARG HD3 1 1
14 2971 1 1 2 ARG HE H -7.061 -3.378 -2.912 1.00 . A A . 2 ARG HE 1 1
14 2972 1 1 2 ARG HG2 H -3.806 -2.014 -2.261 1.00 . A A . 2 ARG HG2 1 1
14 2973 1 1 2 ARG HG3 H -4.563 -3.606 -2.256 1.00 . A A . 2 ARG HG3 1 1
14 2974 1 1 2 ARG HH11 H -6.448 -1.488 -5.844 1.00 . A A . 2 ARG HH11 1 1
14 2975 1 1 2 ARG HH12 H -8.004 -1.724 -6.482 1.00 . A A . 2 ARG HH12 1 1
14 2976 1 1 2 ARG HH21 H -9.196 -3.682 -3.789 1.00 . A A . 2 ARG HH21 1 1
14 2977 1 1 2 ARG HH22 H -9.615 -2.990 -5.280 1.00 . A A . 2 ARG HH22 1 1
14 2978 1 1 2 ARG N N -5.960 -2.158 1.280 1.00 . A A . 2 ARG N 1 1
14 2979 1 1 2 ARG NE N -6.807 -2.800 -3.671 1.00 . A A . 2 ARG NE 1 1
14 2980 1 1 2 ARG NH1 N -7.361 -1.886 -5.729 1.00 . A A . 2 ARG NH1 1 1
14 2981 1 1 2 ARG NH2 N -8.915 -3.121 -4.574 1.00 . A A . 2 ARG NH2 1 1
14 2982 1 1 2 ARG O O -3.741 -0.513 0.568 1.00 . A A . 2 ARG O 1 1
14 2983 1 1 3 ALA C C -0.293 -2.399 0.110 1.00 . A A . 3 ALA C 1 1
14 2984 1 1 3 ALA CA C -1.363 -1.838 1.011 1.00 . A A . 3 ALA CA 1 1
14 2985 1 1 3 ALA CB C -0.982 -2.059 2.480 1.00 . A A . 3 ALA CB 1 1
14 2986 1 1 3 ALA H H -2.682 -3.421 0.680 1.00 . A A . 3 ALA H 1 1
14 2987 1 1 3 ALA HA H -1.444 -0.775 0.836 1.00 . A A . 3 ALA HA 1 1
14 2988 1 1 3 ALA HB1 H 0.097 -2.046 2.554 1.00 . A A . 3 ALA HB1 1 1
14 2989 1 1 3 ALA HB2 H -1.333 -3.033 2.784 1.00 . A A . 3 ALA HB2 1 1
14 2990 1 1 3 ALA N N -2.648 -2.441 0.724 1.00 . A A . 3 ALA N 1 1
14 2991 1 1 3 ALA O O -0.233 -3.614 -0.133 1.00 . A A . 3 ALA O 1 1
14 2992 1 1 4 TYR C C 2.836 -2.109 -0.332 1.00 . A A . 4 TYR C 1 1
14 2993 1 1 4 TYR CA C 1.639 -1.891 -1.222 1.00 . A A . 4 TYR CA 1 1
14 2994 1 1 4 TYR CB C 1.938 -0.791 -2.251 1.00 . A A . 4 TYR CB 1 1
14 2995 1 1 4 TYR CD1 C 1.162 -1.165 -4.612 1.00 . A A . 4 TYR CD1 1 1
14 2996 1 1 4 TYR CD2 C -0.310 -0.032 -3.143 1.00 . A A . 4 TYR CD2 1 1
14 2997 1 1 4 TYR CE1 C 0.247 -1.059 -5.627 1.00 . A A . 4 TYR CE1 1 1
14 2998 1 1 4 TYR CE2 C -1.236 0.079 -4.154 1.00 . A A . 4 TYR CE2 1 1
14 2999 1 1 4 TYR CG C 0.907 -0.658 -3.355 1.00 . A A . 4 TYR CG 1 1
14 3000 1 1 4 TYR CZ C -0.950 -0.438 -5.393 1.00 . A A . 4 TYR CZ 1 1
14 3001 1 1 4 TYR H H 0.356 -0.568 -0.232 1.00 . A A . 4 TYR H 1 1
14 3002 1 1 4 TYR HA H 1.401 -2.808 -1.739 1.00 . A A . 4 TYR HA 1 1
14 3003 1 1 4 TYR HB2 H 1.987 0.160 -1.742 1.00 . A A . 4 TYR HB2 1 1
14 3004 1 1 4 TYR HB3 H 2.896 -0.993 -2.707 1.00 . A A . 4 TYR HB3 1 1
14 3005 1 1 4 TYR HD1 H 2.107 -1.654 -4.793 1.00 . A A . 4 TYR HD1 1 1
14 3006 1 1 4 TYR HD2 H -0.528 0.375 -2.165 1.00 . A A . 4 TYR HD2 1 1
14 3007 1 1 4 TYR HE1 H 0.480 -1.467 -6.601 1.00 . A A . 4 TYR HE1 1 1
14 3008 1 1 4 TYR HE2 H -2.180 0.566 -3.963 1.00 . A A . 4 TYR HE2 1 1
14 3009 1 1 4 TYR HH H -1.952 -1.208 -6.799 1.00 . A A . 4 TYR HH 1 1
14 3010 1 1 4 TYR N N 0.514 -1.524 -0.404 1.00 . A A . 4 TYR N 1 1
14 3011 1 1 4 TYR O O 3.299 -1.171 0.336 1.00 . A A . 4 TYR O 1 1
14 3012 1 1 4 TYR OH O -1.864 -0.332 -6.404 1.00 . A A . 4 TYR OH 1 1
14 3013 1 1 5 LYS C C 5.755 -3.271 -0.163 1.00 . A A . 5 LYS C 1 1
14 3014 1 1 5 LYS CA C 4.469 -3.661 0.536 1.00 . A A . 5 LYS CA 1 1
14 3015 1 1 5 LYS CB C 4.483 -5.144 0.913 1.00 . A A . 5 LYS CB 1 1
14 3016 1 1 5 LYS CD C 3.323 -7.082 1.976 1.00 . A A . 5 LYS CD 1 1
14 3017 1 1 5 LYS CE C 2.041 -7.577 2.615 1.00 . A A . 5 LYS CE 1 1
14 3018 1 1 5 LYS CG C 3.244 -5.607 1.656 1.00 . A A . 5 LYS CG 1 1
14 3019 1 1 5 LYS H H 2.937 -4.024 -0.866 1.00 . A A . 5 LYS H 1 1
14 3020 1 1 5 LYS HA H 4.385 -3.070 1.437 1.00 . A A . 5 LYS HA 1 1
14 3021 1 1 5 LYS HB2 H 4.570 -5.726 0.008 1.00 . A A . 5 LYS HB2 1 1
14 3022 1 1 5 LYS HB3 H 5.345 -5.335 1.534 1.00 . A A . 5 LYS HB3 1 1
14 3023 1 1 5 LYS HD2 H 3.491 -7.632 1.061 1.00 . A A . 5 LYS HD2 1 1
14 3024 1 1 5 LYS HD3 H 4.144 -7.252 2.655 1.00 . A A . 5 LYS HD3 1 1
14 3025 1 1 5 LYS HE2 H 1.839 -6.984 3.495 1.00 . A A . 5 LYS HE2 1 1
14 3026 1 1 5 LYS HE3 H 1.234 -7.456 1.907 1.00 . A A . 5 LYS HE3 1 1
14 3027 1 1 5 LYS HG2 H 3.167 -5.052 2.580 1.00 . A A . 5 LYS HG2 1 1
14 3028 1 1 5 LYS HG3 H 2.369 -5.417 1.053 1.00 . A A . 5 LYS HG3 1 1
14 3029 1 1 5 LYS HZ1 H 1.238 -9.344 3.407 1.00 . A A . 5 LYS HZ1 1 1
14 3030 1 1 5 LYS HZ2 H 2.862 -9.108 3.737 1.00 . A A . 5 LYS HZ2 1 1
14 3031 1 1 5 LYS HZ3 H 2.402 -9.603 2.204 1.00 . A A . 5 LYS HZ3 1 1
14 3032 1 1 5 LYS N N 3.332 -3.329 -0.296 1.00 . A A . 5 LYS N 1 1
14 3033 1 1 5 LYS NZ N 2.132 -8.998 3.005 1.00 . A A . 5 LYS NZ 1 1
14 3034 1 1 5 LYS O O 6.474 -4.108 -0.714 1.00 . A A . 5 LYS O 1 1
14 3035 1 1 6 SER C C 7.443 -0.171 -0.037 1.00 . A A . 6 SER C 1 1
14 3036 1 1 6 SER CA C 7.120 -1.415 -0.831 1.00 . A A . 6 SER CA 1 1
14 3037 1 1 6 SER CB C 6.787 -1.030 -2.278 1.00 . A A . 6 SER CB 1 1
14 3038 1 1 6 SER H H 5.308 -1.389 0.171 1.00 . A A . 6 SER H 1 1
14 3039 1 1 6 SER HA H 7.943 -2.111 -0.814 1.00 . A A . 6 SER HA 1 1
14 3040 1 1 6 SER HB2 H 6.025 -0.265 -2.268 1.00 . A A . 6 SER HB2 1 1
14 3041 1 1 6 SER HB3 H 7.675 -0.644 -2.757 1.00 . A A . 6 SER HB3 1 1
14 3042 1 1 6 SER HG H 7.039 -2.765 -3.134 1.00 . A A . 6 SER HG 1 1
14 3043 1 1 6 SER N N 5.972 -2.001 -0.222 1.00 . A A . 6 SER N 1 1
14 3044 1 1 6 SER O O 6.646 0.231 0.801 1.00 . A A . 6 SER O 1 1
14 3045 1 1 6 SER OG O 6.298 -2.154 -3.029 1.00 . A A . 6 SER OG 1 1
14 3046 1 1 7 LYS C C 9.115 2.702 -0.663 1.00 . A A . 7 LYS C 1 1
14 3047 1 1 7 LYS CA C 8.964 1.619 0.403 1.00 . A A . 7 LYS CA 1 1
14 3048 1 1 7 LYS CB C 10.260 1.437 1.194 1.00 . A A . 7 LYS CB 1 1
14 3049 1 1 7 LYS CD C 11.461 0.307 3.123 1.00 . A A . 7 LYS CD 1 1
14 3050 1 1 7 LYS CE C 12.109 1.612 3.602 1.00 . A A . 7 LYS CE 1 1
14 3051 1 1 7 LYS CG C 10.124 0.527 2.412 1.00 . A A . 7 LYS CG 1 1
14 3052 1 1 7 LYS H H 9.239 -0.027 -0.849 1.00 . A A . 7 LYS H 1 1
14 3053 1 1 7 LYS HA H 8.163 1.883 1.077 1.00 . A A . 7 LYS HA 1 1
14 3054 1 1 7 LYS HB2 H 11.005 1.008 0.541 1.00 . A A . 7 LYS HB2 1 1
14 3055 1 1 7 LYS HB3 H 10.601 2.404 1.529 1.00 . A A . 7 LYS HB3 1 1
14 3056 1 1 7 LYS HD2 H 11.294 -0.325 3.982 1.00 . A A . 7 LYS HD2 1 1
14 3057 1 1 7 LYS HD3 H 12.135 -0.191 2.443 1.00 . A A . 7 LYS HD3 1 1
14 3058 1 1 7 LYS HE2 H 13.043 1.370 4.087 1.00 . A A . 7 LYS HE2 1 1
14 3059 1 1 7 LYS HE3 H 12.311 2.239 2.747 1.00 . A A . 7 LYS HE3 1 1
14 3060 1 1 7 LYS HG2 H 9.431 0.977 3.107 1.00 . A A . 7 LYS HG2 1 1
14 3061 1 1 7 LYS HG3 H 9.735 -0.428 2.090 1.00 . A A . 7 LYS HG3 1 1
14 3062 1 1 7 LYS HZ1 H 11.747 3.223 4.854 1.00 . A A . 7 LYS HZ1 1 1
14 3063 1 1 7 LYS HZ2 H 11.066 1.784 5.410 1.00 . A A . 7 LYS HZ2 1 1
14 3064 1 1 7 LYS HZ3 H 10.352 2.619 4.135 1.00 . A A . 7 LYS HZ3 1 1
14 3065 1 1 7 LYS N N 8.592 0.384 -0.235 1.00 . A A . 7 LYS N 1 1
14 3066 1 1 7 LYS NZ N 11.263 2.350 4.561 1.00 . A A . 7 LYS NZ 1 1
14 3067 1 1 7 LYS O O 9.992 2.591 -1.530 1.00 . A A . 7 LYS O 1 1
14 3068 1 1 8 PRO C C 5.954 3.232 0.116 1.00 . A A . 8 PRO C 1 1
14 3069 1 1 8 PRO CA C 7.257 4.013 0.376 1.00 . A A . 8 PRO CA 1 1
14 3070 1 1 8 PRO CB C 6.990 5.530 0.258 1.00 . A A . 8 PRO CB 1 1
14 3071 1 1 8 PRO CD C 8.277 4.830 -1.640 1.00 . A A . 8 PRO CD 1 1
14 3072 1 1 8 PRO CG C 7.903 6.025 -0.824 1.00 . A A . 8 PRO CG 1 1
14 3073 1 1 8 PRO HA H 7.619 3.792 1.367 1.00 . A A . 8 PRO HA 1 1
14 3074 1 1 8 PRO HB2 H 5.953 5.685 -0.002 1.00 . A A . 8 PRO HB2 1 1
14 3075 1 1 8 PRO HB3 H 7.200 6.011 1.202 1.00 . A A . 8 PRO HB3 1 1
14 3076 1 1 8 PRO HD2 H 7.535 4.639 -2.401 1.00 . A A . 8 PRO HD2 1 1
14 3077 1 1 8 PRO HD3 H 9.254 4.957 -2.079 1.00 . A A . 8 PRO HD3 1 1
14 3078 1 1 8 PRO HG2 H 7.392 6.752 -1.439 1.00 . A A . 8 PRO HG2 1 1
14 3079 1 1 8 PRO HG3 H 8.785 6.466 -0.384 1.00 . A A . 8 PRO HG3 1 1
14 3080 1 1 8 PRO N N 8.288 3.767 -0.645 1.00 . A A . 8 PRO N 1 1
14 3081 1 1 8 PRO O O 5.586 2.968 -1.043 1.00 . A A . 8 PRO O 1 1
14 3082 1 1 9 PRO C C 2.809 2.961 0.821 1.00 . A A . 9 PRO C 1 1
14 3083 1 1 9 PRO CA C 4.029 2.076 1.077 1.00 . A A . 9 PRO CA 1 1
14 3084 1 1 9 PRO CB C 3.918 1.386 2.436 1.00 . A A . 9 PRO CB 1 1
14 3085 1 1 9 PRO CD C 5.638 3.066 2.595 1.00 . A A . 9 PRO CD 1 1
14 3086 1 1 9 PRO CG C 4.618 2.291 3.394 1.00 . A A . 9 PRO CG 1 1
14 3087 1 1 9 PRO HA H 4.095 1.329 0.302 1.00 . A A . 9 PRO HA 1 1
14 3088 1 1 9 PRO HB2 H 2.874 1.266 2.691 1.00 . A A . 9 PRO HB2 1 1
14 3089 1 1 9 PRO HB3 H 4.392 0.417 2.388 1.00 . A A . 9 PRO HB3 1 1
14 3090 1 1 9 PRO HD2 H 5.585 4.118 2.834 1.00 . A A . 9 PRO HD2 1 1
14 3091 1 1 9 PRO HD3 H 6.626 2.681 2.797 1.00 . A A . 9 PRO HD3 1 1
14 3092 1 1 9 PRO HG2 H 3.905 2.968 3.842 1.00 . A A . 9 PRO HG2 1 1
14 3093 1 1 9 PRO HG3 H 5.106 1.707 4.160 1.00 . A A . 9 PRO HG3 1 1
14 3094 1 1 9 PRO N N 5.259 2.831 1.187 1.00 . A A . 9 PRO N 1 1
14 3095 1 1 9 PRO O O 2.554 3.945 1.533 1.00 . A A . 9 PRO O 1 1
14 3096 1 1 10 ILE C C -0.282 2.426 -0.069 1.00 . A A . 10 ILE C 1 1
14 3097 1 1 10 ILE CA C 0.861 3.318 -0.515 1.00 . A A . 10 ILE CA 1 1
14 3098 1 1 10 ILE CB C 0.745 3.604 -2.042 1.00 . A A . 10 ILE CB 1 1
14 3099 1 1 10 ILE CD1 C 1.964 4.718 -4.011 1.00 . A A . 10 ILE CD1 1 1
14 3100 1 1 10 ILE CG1 C 1.946 4.443 -2.518 1.00 . A A . 10 ILE CG1 1 1
14 3101 1 1 10 ILE CG2 C -0.573 4.322 -2.361 1.00 . A A . 10 ILE CG2 1 1
14 3102 1 1 10 ILE H H 2.366 1.891 -0.776 1.00 . A A . 10 ILE H 1 1
14 3103 1 1 10 ILE HA H 0.834 4.247 0.035 1.00 . A A . 10 ILE HA 1 1
14 3104 1 1 10 ILE HB H 0.749 2.660 -2.564 1.00 . A A . 10 ILE HB 1 1
14 3105 1 1 10 ILE HD11 H 1.070 5.256 -4.287 1.00 . A A . 10 ILE HD11 1 1
14 3106 1 1 10 ILE HD12 H 2.004 3.782 -4.550 1.00 . A A . 10 ILE HD12 1 1
14 3107 1 1 10 ILE HD13 H 2.832 5.312 -4.258 1.00 . A A . 10 ILE HD13 1 1
14 3108 1 1 10 ILE HG12 H 1.931 5.398 -2.013 1.00 . A A . 10 ILE HG12 1 1
14 3109 1 1 10 ILE HG13 H 2.859 3.926 -2.262 1.00 . A A . 10 ILE HG13 1 1
14 3110 1 1 10 ILE HG21 H -0.631 4.509 -3.423 1.00 . A A . 10 ILE HG21 1 1
14 3111 1 1 10 ILE HG22 H -0.610 5.261 -1.828 1.00 . A A . 10 ILE HG22 1 1
14 3112 1 1 10 ILE HG23 H -1.401 3.700 -2.057 1.00 . A A . 10 ILE HG23 1 1
14 3113 1 1 10 ILE N N 2.085 2.633 -0.201 1.00 . A A . 10 ILE N 1 1
14 3114 1 1 10 ILE O O -0.269 1.220 -0.346 1.00 . A A . 10 ILE O 1 1
14 3115 1 1 11 ALA C C -3.627 2.872 0.734 1.00 . A A . 11 ALA C 1 1
14 3116 1 1 11 ALA CA C -2.345 2.183 1.113 1.00 . A A . 11 ALA CA 1 1
14 3117 1 1 11 ALA CB C -2.342 1.921 2.640 1.00 . A A . 11 ALA CB 1 1
14 3118 1 1 11 ALA H H -1.188 3.920 0.905 1.00 . A A . 11 ALA H 1 1
14 3119 1 1 11 ALA HA H -2.303 1.236 0.595 1.00 . A A . 11 ALA HA 1 1
14 3120 1 1 11 ALA HB1 H -3.128 1.219 2.873 1.00 . A A . 11 ALA HB1 1 1
14 3121 1 1 11 ALA HB2 H -2.558 2.852 3.142 1.00 . A A . 11 ALA HB2 1 1
14 3122 1 1 11 ALA N N -1.223 2.970 0.664 1.00 . A A . 11 ALA N 1 1
14 3123 1 1 11 ALA O O -3.658 4.094 0.560 1.00 . A A . 11 ALA O 1 1
14 3124 1 1 12 PHE C C -6.960 2.107 1.301 1.00 . A A . 12 PHE C 1 1
14 3125 1 1 12 PHE CA C -5.970 2.586 0.256 1.00 . A A . 12 PHE CA 1 1
14 3126 1 1 12 PHE CB C -6.396 2.140 -1.154 1.00 . A A . 12 PHE CB 1 1
14 3127 1 1 12 PHE CD1 C -4.514 2.179 -2.831 1.00 . A A . 12 PHE CD1 1 1
14 3128 1 1 12 PHE CD2 C -5.984 4.051 -2.722 1.00 . A A . 12 PHE CD2 1 1
14 3129 1 1 12 PHE CE1 C -3.801 2.803 -3.839 1.00 . A A . 12 PHE CE1 1 1
14 3130 1 1 12 PHE CE2 C -5.275 4.671 -3.728 1.00 . A A . 12 PHE CE2 1 1
14 3131 1 1 12 PHE CG C -5.615 2.799 -2.260 1.00 . A A . 12 PHE CG 1 1
14 3132 1 1 12 PHE CZ C -4.184 4.048 -4.285 1.00 . A A . 12 PHE CZ 1 1
14 3133 1 1 12 PHE H H -4.534 1.131 0.713 1.00 . A A . 12 PHE H 1 1
14 3134 1 1 12 PHE HA H -5.918 3.664 0.285 1.00 . A A . 12 PHE HA 1 1
14 3135 1 1 12 PHE HB2 H -6.262 1.072 -1.242 1.00 . A A . 12 PHE HB2 1 1
14 3136 1 1 12 PHE HB3 H -7.441 2.378 -1.291 1.00 . A A . 12 PHE HB3 1 1
14 3137 1 1 12 PHE HD1 H -4.216 1.204 -2.480 1.00 . A A . 12 PHE HD1 1 1
14 3138 1 1 12 PHE HD2 H -6.840 4.547 -2.289 1.00 . A A . 12 PHE HD2 1 1
14 3139 1 1 12 PHE HE1 H -2.941 2.332 -4.290 1.00 . A A . 12 PHE HE1 1 1
14 3140 1 1 12 PHE HE2 H -5.577 5.648 -4.077 1.00 . A A . 12 PHE HE2 1 1
14 3141 1 1 12 PHE HZ H -3.624 4.532 -5.071 1.00 . A A . 12 PHE HZ 1 1
14 3142 1 1 12 PHE N N -4.656 2.099 0.586 1.00 . A A . 12 PHE N 1 1
14 3143 1 1 12 PHE O O -6.951 0.914 1.646 1.00 . A A . 12 PHE O 1 1
14 3144 1 1 13 PRO C C -9.694 1.516 2.724 1.00 . A A . 13 PRO C 1 1
14 3145 1 1 13 PRO CA C -8.825 2.780 2.907 1.00 . A A . 13 PRO CA 1 1
14 3146 1 1 13 PRO CB C -9.713 4.018 2.836 1.00 . A A . 13 PRO CB 1 1
14 3147 1 1 13 PRO CD C -7.839 4.473 1.430 1.00 . A A . 13 PRO CD 1 1
14 3148 1 1 13 PRO CG C -8.796 5.103 2.406 1.00 . A A . 13 PRO CG 1 1
14 3149 1 1 13 PRO HA H -8.359 2.748 3.881 1.00 . A A . 13 PRO HA 1 1
14 3150 1 1 13 PRO HB2 H -10.502 3.851 2.119 1.00 . A A . 13 PRO HB2 1 1
14 3151 1 1 13 PRO HB3 H -10.141 4.222 3.806 1.00 . A A . 13 PRO HB3 1 1
14 3152 1 1 13 PRO HD2 H -8.198 4.588 0.418 1.00 . A A . 13 PRO HD2 1 1
14 3153 1 1 13 PRO HD3 H -6.862 4.921 1.541 1.00 . A A . 13 PRO HD3 1 1
14 3154 1 1 13 PRO HG2 H -9.356 5.893 1.930 1.00 . A A . 13 PRO HG2 1 1
14 3155 1 1 13 PRO HG3 H -8.260 5.489 3.259 1.00 . A A . 13 PRO HG3 1 1
14 3156 1 1 13 PRO N N -7.813 3.040 1.830 1.00 . A A . 13 PRO N 1 1
14 3157 1 1 13 PRO O O -10.311 1.028 3.687 1.00 . A A . 13 PRO O 1 1
14 3158 1 1 14 ASP C C -9.876 -1.412 1.927 1.00 . A A . 14 ASP C 1 1
14 3159 1 1 14 ASP CA C -10.515 -0.218 1.227 1.00 . A A . 14 ASP CA 1 1
14 3160 1 1 14 ASP CB C -10.585 -0.488 -0.285 1.00 . A A . 14 ASP CB 1 1
14 3161 1 1 14 ASP CG C -11.327 -1.771 -0.610 1.00 . A A . 14 ASP CG 1 1
14 3162 1 1 14 ASP H H -9.316 1.496 0.787 1.00 . A A . 14 ASP H 1 1
14 3163 1 1 14 ASP HA H -11.518 -0.089 1.605 1.00 . A A . 14 ASP HA 1 1
14 3164 1 1 14 ASP HB2 H -11.095 0.331 -0.771 1.00 . A A . 14 ASP HB2 1 1
14 3165 1 1 14 ASP HB3 H -9.581 -0.564 -0.676 1.00 . A A . 14 ASP HB3 1 1
14 3166 1 1 14 ASP N N -9.769 1.009 1.509 1.00 . A A . 14 ASP N 1 1
14 3167 1 1 14 ASP O O -10.564 -2.340 2.364 1.00 . A A . 14 ASP O 1 1
14 3168 1 1 14 ASP OD1 O -12.567 -1.796 -0.482 1.00 . A A . 14 ASP OD1 1 1
14 3169 1 1 14 ASP OD2 O -10.689 -2.776 -0.989 1.00 . A A . 14 ASP OD2 1 1
14 3170 2 2 1 . C C -1.537 -1.029 3.461 1.00 . B A . 101 WMH C 1 1
14 3171 2 2 1 . C1 C -1.039 1.404 3.225 1.00 . B A . 101 WMH C1 1 1
14 3172 2 2 1 . C2 C 0.046 2.155 3.490 1.00 . B A . 101 WMH C2 1 1
14 3173 2 2 1 . H1 H -1.628 -1.488 4.434 1.00 . B A . 101 WMH H1 1 1
14 3174 2 2 1 . H2 H -2.516 -0.725 3.126 1.00 . B A . 101 WMH H2 1 1
14 3175 2 2 1 . H5 H 0.119 3.217 3.319 1.00 . B A . 101 WMH H5 1 1
14 3176 2 2 1 . N N -0.733 0.129 3.565 1.00 . B A . 101 WMH N 1 1
14 3177 2 2 1 . N1 N 1.001 1.387 3.983 1.00 . B A . 101 WMH N1 1 1
14 3178 2 2 1 . N2 N 0.587 0.170 4.046 1.00 . B A . 101 WMH N2 1 1
15 3179 1 1 1 GLY C C -7.071 -2.908 1.459 1.00 . A A . 1 GLY C 1 1
15 3180 1 1 1 GLY CA C -8.104 -2.241 2.330 1.00 . A A . 1 GLY CA 1 1
15 3181 1 1 1 GLY H1 H -8.042 -0.301 1.526 1.00 . A A . 1 GLY H1 1 1
15 3182 1 1 1 GLY HA2 H -7.654 -1.978 3.275 1.00 . A A . 1 GLY HA2 1 1
15 3183 1 1 1 GLY HA3 H -8.912 -2.937 2.508 1.00 . A A . 1 GLY HA3 1 1
15 3184 1 1 1 GLY N N -8.639 -1.056 1.722 1.00 . A A . 1 GLY N 1 1
15 3185 1 1 1 GLY O O -7.189 -4.086 1.146 1.00 . A A . 1 GLY O 1 1
15 3186 1 1 2 ARG C C -3.692 -2.065 0.630 1.00 . A A . 2 ARG C 1 1
15 3187 1 1 2 ARG CA C -5.000 -2.704 0.229 1.00 . A A . 2 ARG CA 1 1
15 3188 1 1 2 ARG CB C -5.231 -2.417 -1.258 1.00 . A A . 2 ARG CB 1 1
15 3189 1 1 2 ARG CD C -4.230 -2.547 -3.577 1.00 . A A . 2 ARG CD 1 1
15 3190 1 1 2 ARG CG C -4.144 -3.016 -2.143 1.00 . A A . 2 ARG CG 1 1
15 3191 1 1 2 ARG CZ C -5.783 -2.584 -5.494 1.00 . A A . 2 ARG CZ 1 1
15 3192 1 1 2 ARG H H -5.998 -1.231 1.358 1.00 . A A . 2 ARG H 1 1
15 3193 1 1 2 ARG HA H -4.947 -3.770 0.384 1.00 . A A . 2 ARG HA 1 1
15 3194 1 1 2 ARG HB2 H -6.186 -2.826 -1.554 1.00 . A A . 2 ARG HB2 1 1
15 3195 1 1 2 ARG HB3 H -5.240 -1.349 -1.414 1.00 . A A . 2 ARG HB3 1 1
15 3196 1 1 2 ARG HD2 H -4.107 -1.474 -3.595 1.00 . A A . 2 ARG HD2 1 1
15 3197 1 1 2 ARG HD3 H -3.423 -3.000 -4.134 1.00 . A A . 2 ARG HD3 1 1
15 3198 1 1 2 ARG HE H -6.165 -3.338 -3.672 1.00 . A A . 2 ARG HE 1 1
15 3199 1 1 2 ARG HG2 H -3.180 -2.734 -1.746 1.00 . A A . 2 ARG HG2 1 1
15 3200 1 1 2 ARG HG3 H -4.236 -4.091 -2.113 1.00 . A A . 2 ARG HG3 1 1
15 3201 1 1 2 ARG HH11 H -3.945 -1.764 -5.960 1.00 . A A . 2 ARG HH11 1 1
15 3202 1 1 2 ARG HH12 H -5.079 -1.791 -7.233 1.00 . A A . 2 ARG HH12 1 1
15 3203 1 1 2 ARG HH21 H -7.678 -3.332 -5.423 1.00 . A A . 2 ARG HH21 1 1
15 3204 1 1 2 ARG HH22 H -7.242 -2.663 -6.928 1.00 . A A . 2 ARG HH22 1 1
15 3205 1 1 2 ARG N N -6.067 -2.165 1.058 1.00 . A A . 2 ARG N 1 1
15 3206 1 1 2 ARG NE N -5.495 -2.877 -4.226 1.00 . A A . 2 ARG NE 1 1
15 3207 1 1 2 ARG NH1 N -4.872 -2.005 -6.274 1.00 . A A . 2 ARG NH1 1 1
15 3208 1 1 2 ARG NH2 N -6.979 -2.883 -5.985 1.00 . A A . 2 ARG NH2 1 1
15 3209 1 1 2 ARG O O -3.599 -0.859 0.673 1.00 . A A . 2 ARG O 1 1
15 3210 1 1 3 ALA C C -0.343 -2.822 0.314 1.00 . A A . 3 ALA C 1 1
15 3211 1 1 3 ALA CA C -1.400 -2.350 1.268 1.00 . A A . 3 ALA CA 1 1
15 3212 1 1 3 ALA CB C -1.052 -2.736 2.704 1.00 . A A . 3 ALA CB 1 1
15 3213 1 1 3 ALA H H -2.825 -3.829 0.837 1.00 . A A . 3 ALA H 1 1
15 3214 1 1 3 ALA HA H -1.449 -1.272 1.209 1.00 . A A . 3 ALA HA 1 1
15 3215 1 1 3 ALA HB1 H 0.018 -2.866 2.774 1.00 . A A . 3 ALA HB1 1 1
15 3216 1 1 3 ALA HB2 H -1.534 -3.673 2.936 1.00 . A A . 3 ALA HB2 1 1
15 3217 1 1 3 ALA N N -2.704 -2.855 0.899 1.00 . A A . 3 ALA N 1 1
15 3218 1 1 3 ALA O O -0.347 -3.980 -0.098 1.00 . A A . 3 ALA O 1 1
15 3219 1 1 4 TYR C C 2.871 -2.343 -0.075 1.00 . A A . 4 TYR C 1 1
15 3220 1 1 4 TYR CA C 1.634 -2.256 -0.923 1.00 . A A . 4 TYR CA 1 1
15 3221 1 1 4 TYR CB C 1.847 -1.216 -2.027 1.00 . A A . 4 TYR CB 1 1
15 3222 1 1 4 TYR CD1 C -0.238 -0.125 -2.926 1.00 . A A . 4 TYR CD1 1 1
15 3223 1 1 4 TYR CD2 C 0.626 -2.013 -4.076 1.00 . A A . 4 TYR CD2 1 1
15 3224 1 1 4 TYR CE1 C -1.254 -0.027 -3.842 1.00 . A A . 4 TYR CE1 1 1
15 3225 1 1 4 TYR CE2 C -0.391 -1.921 -4.997 1.00 . A A . 4 TYR CE2 1 1
15 3226 1 1 4 TYR CG C 0.721 -1.118 -3.027 1.00 . A A . 4 TYR CG 1 1
15 3227 1 1 4 TYR CZ C -1.326 -0.928 -4.879 1.00 . A A . 4 TYR CZ 1 1
15 3228 1 1 4 TYR H H 0.408 -0.981 0.188 1.00 . A A . 4 TYR H 1 1
15 3229 1 1 4 TYR HA H 1.441 -3.218 -1.373 1.00 . A A . 4 TYR HA 1 1
15 3230 1 1 4 TYR HB2 H 1.965 -0.244 -1.573 1.00 . A A . 4 TYR HB2 1 1
15 3231 1 1 4 TYR HB3 H 2.751 -1.462 -2.567 1.00 . A A . 4 TYR HB3 1 1
15 3232 1 1 4 TYR HD1 H -0.178 0.581 -2.110 1.00 . A A . 4 TYR HD1 1 1
15 3233 1 1 4 TYR HD2 H 1.363 -2.797 -4.170 1.00 . A A . 4 TYR HD2 1 1
15 3234 1 1 4 TYR HE1 H -1.991 0.759 -3.743 1.00 . A A . 4 TYR HE1 1 1
15 3235 1 1 4 TYR HE2 H -0.443 -2.630 -5.810 1.00 . A A . 4 TYR HE2 1 1
15 3236 1 1 4 TYR HH H -2.345 0.061 -6.150 1.00 . A A . 4 TYR HH 1 1
15 3237 1 1 4 TYR N N 0.516 -1.921 -0.081 1.00 . A A . 4 TYR N 1 1
15 3238 1 1 4 TYR O O 3.267 -1.356 0.576 1.00 . A A . 4 TYR O 1 1
15 3239 1 1 4 TYR OH O -2.341 -0.838 -5.797 1.00 . A A . 4 TYR OH 1 1
15 3240 1 1 5 LYS C C 5.887 -3.335 -0.102 1.00 . A A . 5 LYS C 1 1
15 3241 1 1 5 LYS CA C 4.666 -3.681 0.717 1.00 . A A . 5 LYS CA 1 1
15 3242 1 1 5 LYS CB C 4.731 -5.072 1.345 1.00 . A A . 5 LYS CB 1 1
15 3243 1 1 5 LYS CD C 3.487 -4.299 3.434 1.00 . A A . 5 LYS CD 1 1
15 3244 1 1 5 LYS CE C 4.783 -4.215 4.220 1.00 . A A . 5 LYS CE 1 1
15 3245 1 1 5 LYS CG C 3.575 -5.351 2.317 1.00 . A A . 5 LYS CG 1 1
15 3246 1 1 5 LYS H H 3.108 -4.256 -0.547 1.00 . A A . 5 LYS H 1 1
15 3247 1 1 5 LYS HA H 4.620 -2.949 1.508 1.00 . A A . 5 LYS HA 1 1
15 3248 1 1 5 LYS HB2 H 4.693 -5.805 0.553 1.00 . A A . 5 LYS HB2 1 1
15 3249 1 1 5 LYS HB3 H 5.664 -5.184 1.878 1.00 . A A . 5 LYS HB3 1 1
15 3250 1 1 5 LYS HD2 H 3.264 -3.334 3.005 1.00 . A A . 5 LYS HD2 1 1
15 3251 1 1 5 LYS HD3 H 2.689 -4.578 4.105 1.00 . A A . 5 LYS HD3 1 1
15 3252 1 1 5 LYS HE2 H 4.965 -5.165 4.697 1.00 . A A . 5 LYS HE2 1 1
15 3253 1 1 5 LYS HE3 H 5.577 -4.010 3.517 1.00 . A A . 5 LYS HE3 1 1
15 3254 1 1 5 LYS HG2 H 2.648 -5.342 1.764 1.00 . A A . 5 LYS HG2 1 1
15 3255 1 1 5 LYS HG3 H 3.716 -6.325 2.760 1.00 . A A . 5 LYS HG3 1 1
15 3256 1 1 5 LYS HZ1 H 5.648 -3.173 5.781 1.00 . A A . 5 LYS HZ1 1 1
15 3257 1 1 5 LYS HZ2 H 3.961 -3.260 5.895 1.00 . A A . 5 LYS HZ2 1 1
15 3258 1 1 5 LYS HZ3 H 4.685 -2.213 4.793 1.00 . A A . 5 LYS HZ3 1 1
15 3259 1 1 5 LYS N N 3.473 -3.496 -0.044 1.00 . A A . 5 LYS N 1 1
15 3260 1 1 5 LYS NZ N 4.761 -3.149 5.241 1.00 . A A . 5 LYS NZ 1 1
15 3261 1 1 5 LYS O O 6.585 -4.190 -0.644 1.00 . A A . 5 LYS O 1 1
15 3262 1 1 6 SER C C 7.275 -0.074 -0.432 1.00 . A A . 6 SER C 1 1
15 3263 1 1 6 SER CA C 7.096 -1.460 -1.022 1.00 . A A . 6 SER CA 1 1
15 3264 1 1 6 SER CB C 6.724 -1.342 -2.508 1.00 . A A . 6 SER CB 1 1
15 3265 1 1 6 SER H H 5.357 -1.448 0.066 1.00 . A A . 6 SER H 1 1
15 3266 1 1 6 SER HA H 7.994 -2.048 -0.907 1.00 . A A . 6 SER HA 1 1
15 3267 1 1 6 SER HB2 H 5.874 -0.685 -2.610 1.00 . A A . 6 SER HB2 1 1
15 3268 1 1 6 SER HB3 H 7.558 -0.934 -3.060 1.00 . A A . 6 SER HB3 1 1
15 3269 1 1 6 SER HG H 6.519 -3.286 -2.384 1.00 . A A . 6 SER HG 1 1
15 3270 1 1 6 SER N N 6.024 -2.065 -0.305 1.00 . A A . 6 SER N 1 1
15 3271 1 1 6 SER O O 6.472 0.337 0.426 1.00 . A A . 6 SER O 1 1
15 3272 1 1 6 SER OG O 6.383 -2.610 -3.062 1.00 . A A . 6 SER OG 1 1
15 3273 1 1 7 LYS C C 7.995 2.816 -1.641 1.00 . A A . 7 LYS C 1 1
15 3274 1 1 7 LYS CA C 8.446 1.982 -0.440 1.00 . A A . 7 LYS CA 1 1
15 3275 1 1 7 LYS CB C 9.886 2.339 -0.020 1.00 . A A . 7 LYS CB 1 1
15 3276 1 1 7 LYS CD C 12.313 2.583 -0.674 1.00 . A A . 7 LYS CD 1 1
15 3277 1 1 7 LYS CE C 12.834 1.814 0.528 1.00 . A A . 7 LYS CE 1 1
15 3278 1 1 7 LYS CG C 10.936 2.108 -1.097 1.00 . A A . 7 LYS CG 1 1
15 3279 1 1 7 LYS H H 9.005 0.179 -1.355 1.00 . A A . 7 LYS H 1 1
15 3280 1 1 7 LYS HA H 7.765 2.159 0.379 1.00 . A A . 7 LYS HA 1 1
15 3281 1 1 7 LYS HB2 H 9.917 3.382 0.260 1.00 . A A . 7 LYS HB2 1 1
15 3282 1 1 7 LYS HB3 H 10.145 1.740 0.840 1.00 . A A . 7 LYS HB3 1 1
15 3283 1 1 7 LYS HD2 H 12.997 2.457 -1.498 1.00 . A A . 7 LYS HD2 1 1
15 3284 1 1 7 LYS HD3 H 12.252 3.632 -0.422 1.00 . A A . 7 LYS HD3 1 1
15 3285 1 1 7 LYS HE2 H 12.191 2.002 1.374 1.00 . A A . 7 LYS HE2 1 1
15 3286 1 1 7 LYS HE3 H 12.832 0.760 0.298 1.00 . A A . 7 LYS HE3 1 1
15 3287 1 1 7 LYS HG2 H 10.990 1.050 -1.304 1.00 . A A . 7 LYS HG2 1 1
15 3288 1 1 7 LYS HG3 H 10.636 2.630 -1.994 1.00 . A A . 7 LYS HG3 1 1
15 3289 1 1 7 LYS HZ1 H 14.526 1.697 1.712 1.00 . A A . 7 LYS HZ1 1 1
15 3290 1 1 7 LYS HZ2 H 14.241 3.237 1.102 1.00 . A A . 7 LYS HZ2 1 1
15 3291 1 1 7 LYS HZ3 H 14.847 2.011 0.090 1.00 . A A . 7 LYS HZ3 1 1
15 3292 1 1 7 LYS N N 8.314 0.604 -0.802 1.00 . A A . 7 LYS N 1 1
15 3293 1 1 7 LYS NZ N 14.200 2.222 0.877 1.00 . A A . 7 LYS NZ 1 1
15 3294 1 1 7 LYS O O 8.324 2.472 -2.795 1.00 . A A . 7 LYS O 1 1
15 3295 1 1 8 PRO C C 5.531 3.428 0.353 1.00 . A A . 8 PRO C 1 1
15 3296 1 1 8 PRO CA C 6.735 4.273 -0.103 1.00 . A A . 8 PRO CA 1 1
15 3297 1 1 8 PRO CB C 6.320 5.734 -0.326 1.00 . A A . 8 PRO CB 1 1
15 3298 1 1 8 PRO CD C 6.654 4.723 -2.493 1.00 . A A . 8 PRO CD 1 1
15 3299 1 1 8 PRO CG C 5.910 5.812 -1.758 1.00 . A A . 8 PRO CG 1 1
15 3300 1 1 8 PRO HA H 7.523 4.217 0.632 1.00 . A A . 8 PRO HA 1 1
15 3301 1 1 8 PRO HB2 H 5.499 5.978 0.332 1.00 . A A . 8 PRO HB2 1 1
15 3302 1 1 8 PRO HB3 H 7.157 6.384 -0.122 1.00 . A A . 8 PRO HB3 1 1
15 3303 1 1 8 PRO HD2 H 5.978 4.160 -3.118 1.00 . A A . 8 PRO HD2 1 1
15 3304 1 1 8 PRO HD3 H 7.450 5.141 -3.091 1.00 . A A . 8 PRO HD3 1 1
15 3305 1 1 8 PRO HG2 H 4.847 5.649 -1.842 1.00 . A A . 8 PRO HG2 1 1
15 3306 1 1 8 PRO HG3 H 6.170 6.779 -2.162 1.00 . A A . 8 PRO HG3 1 1
15 3307 1 1 8 PRO N N 7.199 3.864 -1.430 1.00 . A A . 8 PRO N 1 1
15 3308 1 1 8 PRO O O 4.885 2.767 -0.477 1.00 . A A . 8 PRO O 1 1
15 3309 1 1 9 PRO C C 2.777 3.277 1.706 1.00 . A A . 9 PRO C 1 1
15 3310 1 1 9 PRO CA C 4.091 2.654 2.180 1.00 . A A . 9 PRO CA 1 1
15 3311 1 1 9 PRO CB C 4.229 2.740 3.705 1.00 . A A . 9 PRO CB 1 1
15 3312 1 1 9 PRO CD C 5.994 4.047 2.751 1.00 . A A . 9 PRO CD 1 1
15 3313 1 1 9 PRO CG C 5.088 3.933 3.945 1.00 . A A . 9 PRO CG 1 1
15 3314 1 1 9 PRO HA H 4.124 1.622 1.858 1.00 . A A . 9 PRO HA 1 1
15 3315 1 1 9 PRO HB2 H 3.250 2.858 4.148 1.00 . A A . 9 PRO HB2 1 1
15 3316 1 1 9 PRO HB3 H 4.692 1.840 4.082 1.00 . A A . 9 PRO HB3 1 1
15 3317 1 1 9 PRO HD2 H 6.169 5.085 2.510 1.00 . A A . 9 PRO HD2 1 1
15 3318 1 1 9 PRO HD3 H 6.930 3.539 2.929 1.00 . A A . 9 PRO HD3 1 1
15 3319 1 1 9 PRO HG2 H 4.469 4.815 4.032 1.00 . A A . 9 PRO HG2 1 1
15 3320 1 1 9 PRO HG3 H 5.667 3.796 4.847 1.00 . A A . 9 PRO HG3 1 1
15 3321 1 1 9 PRO N N 5.235 3.390 1.671 1.00 . A A . 9 PRO N 1 1
15 3322 1 1 9 PRO O O 2.297 4.285 2.257 1.00 . A A . 9 PRO O 1 1
15 3323 1 1 10 ILE C C -0.036 2.176 0.355 1.00 . A A . 10 ILE C 1 1
15 3324 1 1 10 ILE CA C 1.031 3.193 0.062 1.00 . A A . 10 ILE CA 1 1
15 3325 1 1 10 ILE CB C 1.155 3.395 -1.480 1.00 . A A . 10 ILE CB 1 1
15 3326 1 1 10 ILE CD1 C 2.034 5.799 -1.204 1.00 . A A . 10 ILE CD1 1 1
15 3327 1 1 10 ILE CG1 C 2.252 4.424 -1.814 1.00 . A A . 10 ILE CG1 1 1
15 3328 1 1 10 ILE CG2 C -0.180 3.819 -2.096 1.00 . A A . 10 ILE CG2 1 1
15 3329 1 1 10 ILE H H 2.744 2.004 0.207 1.00 . A A . 10 ILE H 1 1
15 3330 1 1 10 ILE HA H 0.762 4.132 0.521 1.00 . A A . 10 ILE HA 1 1
15 3331 1 1 10 ILE HB H 1.430 2.446 -1.915 1.00 . A A . 10 ILE HB 1 1
15 3332 1 1 10 ILE HD11 H 2.825 6.465 -1.514 1.00 . A A . 10 ILE HD11 1 1
15 3333 1 1 10 ILE HD12 H 2.038 5.719 -0.127 1.00 . A A . 10 ILE HD12 1 1
15 3334 1 1 10 ILE HD13 H 1.082 6.191 -1.533 1.00 . A A . 10 ILE HD13 1 1
15 3335 1 1 10 ILE HG12 H 3.200 4.057 -1.451 1.00 . A A . 10 ILE HG12 1 1
15 3336 1 1 10 ILE HG13 H 2.305 4.541 -2.887 1.00 . A A . 10 ILE HG13 1 1
15 3337 1 1 10 ILE HG21 H -0.485 4.763 -1.670 1.00 . A A . 10 ILE HG21 1 1
15 3338 1 1 10 ILE HG22 H -0.929 3.070 -1.880 1.00 . A A . 10 ILE HG22 1 1
15 3339 1 1 10 ILE HG23 H -0.073 3.923 -3.164 1.00 . A A . 10 ILE HG23 1 1
15 3340 1 1 10 ILE N N 2.260 2.740 0.638 1.00 . A A . 10 ILE N 1 1
15 3341 1 1 10 ILE O O 0.064 1.010 -0.061 1.00 . A A . 10 ILE O 1 1
15 3342 1 1 11 ALA C C -3.360 2.431 1.070 1.00 . A A . 11 ALA C 1 1
15 3343 1 1 11 ALA CA C -2.094 1.711 1.436 1.00 . A A . 11 ALA CA 1 1
15 3344 1 1 11 ALA CB C -2.120 1.302 2.936 1.00 . A A . 11 ALA CB 1 1
15 3345 1 1 11 ALA H H -0.997 3.488 1.479 1.00 . A A . 11 ALA H 1 1
15 3346 1 1 11 ALA HA H -2.006 0.827 0.822 1.00 . A A . 11 ALA HA 1 1
15 3347 1 1 11 ALA HB1 H -2.923 0.597 3.085 1.00 . A A . 11 ALA HB1 1 1
15 3348 1 1 11 ALA HB2 H -2.324 2.182 3.528 1.00 . A A . 11 ALA HB2 1 1
15 3349 1 1 11 ALA N N -1.003 2.575 1.118 1.00 . A A . 11 ALA N 1 1
15 3350 1 1 11 ALA O O -3.469 3.643 1.274 1.00 . A A . 11 ALA O 1 1
15 3351 1 1 12 PHE C C -6.547 2.043 1.197 1.00 . A A . 12 PHE C 1 1
15 3352 1 1 12 PHE CA C -5.535 2.300 0.110 1.00 . A A . 12 PHE CA 1 1
15 3353 1 1 12 PHE CB C -6.041 1.723 -1.225 1.00 . A A . 12 PHE CB 1 1
15 3354 1 1 12 PHE CD1 C -4.272 3.040 -2.475 1.00 . A A . 12 PHE CD1 1 1
15 3355 1 1 12 PHE CD2 C -5.209 1.117 -3.511 1.00 . A A . 12 PHE CD2 1 1
15 3356 1 1 12 PHE CE1 C -3.482 3.254 -3.583 1.00 . A A . 12 PHE CE1 1 1
15 3357 1 1 12 PHE CE2 C -4.420 1.328 -4.619 1.00 . A A . 12 PHE CE2 1 1
15 3358 1 1 12 PHE CG C -5.148 1.963 -2.423 1.00 . A A . 12 PHE CG 1 1
15 3359 1 1 12 PHE CZ C -3.555 2.400 -4.655 1.00 . A A . 12 PHE CZ 1 1
15 3360 1 1 12 PHE H H -4.113 0.766 0.380 1.00 . A A . 12 PHE H 1 1
15 3361 1 1 12 PHE HA H -5.391 3.365 0.006 1.00 . A A . 12 PHE HA 1 1
15 3362 1 1 12 PHE HB2 H -6.155 0.654 -1.116 1.00 . A A . 12 PHE HB2 1 1
15 3363 1 1 12 PHE HB3 H -7.009 2.152 -1.438 1.00 . A A . 12 PHE HB3 1 1
15 3364 1 1 12 PHE HD1 H -4.204 3.718 -1.637 1.00 . A A . 12 PHE HD1 1 1
15 3365 1 1 12 PHE HD2 H -5.885 0.274 -3.488 1.00 . A A . 12 PHE HD2 1 1
15 3366 1 1 12 PHE HE1 H -2.805 4.095 -3.612 1.00 . A A . 12 PHE HE1 1 1
15 3367 1 1 12 PHE HE2 H -4.484 0.652 -5.461 1.00 . A A . 12 PHE HE2 1 1
15 3368 1 1 12 PHE HZ H -2.933 2.571 -5.521 1.00 . A A . 12 PHE HZ 1 1
15 3369 1 1 12 PHE N N -4.280 1.729 0.504 1.00 . A A . 12 PHE N 1 1
15 3370 1 1 12 PHE O O -6.653 0.907 1.669 1.00 . A A . 12 PHE O 1 1
15 3371 1 1 13 PRO C C -9.418 1.941 2.408 1.00 . A A . 13 PRO C 1 1
15 3372 1 1 13 PRO CA C -8.322 2.985 2.690 1.00 . A A . 13 PRO CA 1 1
15 3373 1 1 13 PRO CB C -8.924 4.399 2.771 1.00 . A A . 13 PRO CB 1 1
15 3374 1 1 13 PRO CD C -7.218 4.458 1.093 1.00 . A A . 13 PRO CD 1 1
15 3375 1 1 13 PRO CG C -8.511 5.080 1.511 1.00 . A A . 13 PRO CG 1 1
15 3376 1 1 13 PRO HA H -7.850 2.742 3.631 1.00 . A A . 13 PRO HA 1 1
15 3377 1 1 13 PRO HB2 H -9.999 4.327 2.850 1.00 . A A . 13 PRO HB2 1 1
15 3378 1 1 13 PRO HB3 H -8.532 4.909 3.639 1.00 . A A . 13 PRO HB3 1 1
15 3379 1 1 13 PRO HD2 H -7.142 4.451 0.016 1.00 . A A . 13 PRO HD2 1 1
15 3380 1 1 13 PRO HD3 H -6.383 4.982 1.532 1.00 . A A . 13 PRO HD3 1 1
15 3381 1 1 13 PRO HG2 H -9.258 4.927 0.747 1.00 . A A . 13 PRO HG2 1 1
15 3382 1 1 13 PRO HG3 H -8.378 6.137 1.690 1.00 . A A . 13 PRO HG3 1 1
15 3383 1 1 13 PRO N N -7.305 3.085 1.618 1.00 . A A . 13 PRO N 1 1
15 3384 1 1 13 PRO O O -10.223 1.618 3.279 1.00 . A A . 13 PRO O 1 1
15 3385 1 1 14 ASP C C -9.920 -0.951 1.455 1.00 . A A . 14 ASP C 1 1
15 3386 1 1 14 ASP CA C -10.353 0.362 0.801 1.00 . A A . 14 ASP CA 1 1
15 3387 1 1 14 ASP CB C -10.371 0.212 -0.726 1.00 . A A . 14 ASP CB 1 1
15 3388 1 1 14 ASP CG C -11.187 -0.975 -1.196 1.00 . A A . 14 ASP CG 1 1
15 3389 1 1 14 ASP H H -8.839 1.832 0.531 1.00 . A A . 14 ASP H 1 1
15 3390 1 1 14 ASP HA H -11.344 0.616 1.144 1.00 . A A . 14 ASP HA 1 1
15 3391 1 1 14 ASP HB2 H -10.791 1.105 -1.164 1.00 . A A . 14 ASP HB2 1 1
15 3392 1 1 14 ASP HB3 H -9.356 0.092 -1.077 1.00 . A A . 14 ASP HB3 1 1
15 3393 1 1 14 ASP N N -9.447 1.440 1.190 1.00 . A A . 14 ASP N 1 1
15 3394 1 1 14 ASP O O -10.740 -1.831 1.739 1.00 . A A . 14 ASP O 1 1
15 3395 1 1 14 ASP OD1 O -10.615 -1.903 -1.830 1.00 . A A . 14 ASP OD1 1 1
15 3396 1 1 14 ASP OD2 O -12.399 -1.015 -0.943 1.00 . A A . 14 ASP OD2 1 1
15 3397 2 2 1 . C C -1.476 -1.713 3.744 1.00 . B A . 101 WMH C 1 1
15 3398 2 2 1 . C1 C -0.824 0.689 3.476 1.00 . B A . 101 WMH C1 1 1
15 3399 2 2 1 . C2 C 0.336 1.358 3.691 1.00 . B A . 101 WMH C2 1 1
15 3400 2 2 1 . H1 H -1.506 -2.194 4.712 1.00 . B A . 101 WMH H1 1 1
15 3401 2 2 1 . H2 H -2.461 -1.351 3.497 1.00 . B A . 101 WMH H2 1 1
15 3402 2 2 1 . H5 H 0.486 2.415 3.529 1.00 . B A . 101 WMH H5 1 1
15 3403 2 2 1 . N N -0.592 -0.610 3.800 1.00 . B A . 101 WMH N 1 1
15 3404 2 2 1 . N1 N 1.252 0.517 4.125 1.00 . B A . 101 WMH N1 1 1
15 3405 2 2 1 . N2 N 0.755 -0.664 4.208 1.00 . B A . 101 WMH N2 1 1
16 3406 1 1 1 GLY C C -6.544 -2.875 1.621 1.00 . A A . 1 GLY C 1 1
16 3407 1 1 1 GLY CA C -7.697 -2.316 2.417 1.00 . A A . 1 GLY CA 1 1
16 3408 1 1 1 GLY H1 H -7.887 -0.396 1.561 1.00 . A A . 1 GLY H1 1 1
16 3409 1 1 1 GLY HA2 H -7.325 -1.943 3.360 1.00 . A A . 1 GLY HA2 1 1
16 3410 1 1 1 GLY HA3 H -8.409 -3.105 2.605 1.00 . A A . 1 GLY HA3 1 1
16 3411 1 1 1 GLY N N -8.360 -1.242 1.724 1.00 . A A . 1 GLY N 1 1
16 3412 1 1 1 GLY O O -6.185 -4.049 1.769 1.00 . A A . 1 GLY O 1 1
16 3413 1 1 2 ARG C C -3.577 -1.750 0.337 1.00 . A A . 2 ARG C 1 1
16 3414 1 1 2 ARG CA C -4.851 -2.497 -0.039 1.00 . A A . 2 ARG CA 1 1
16 3415 1 1 2 ARG CB C -5.159 -2.310 -1.530 1.00 . A A . 2 ARG CB 1 1
16 3416 1 1 2 ARG CD C -4.405 -2.716 -3.907 1.00 . A A . 2 ARG CD 1 1
16 3417 1 1 2 ARG CG C -4.119 -2.947 -2.436 1.00 . A A . 2 ARG CG 1 1
16 3418 1 1 2 ARG CZ C -6.036 -3.566 -5.592 1.00 . A A . 2 ARG CZ 1 1
16 3419 1 1 2 ARG H H -6.238 -1.114 0.738 1.00 . A A . 2 ARG H 1 1
16 3420 1 1 2 ARG HA H -4.704 -3.548 0.161 1.00 . A A . 2 ARG HA 1 1
16 3421 1 1 2 ARG HB2 H -6.122 -2.746 -1.749 1.00 . A A . 2 ARG HB2 1 1
16 3422 1 1 2 ARG HB3 H -5.195 -1.253 -1.747 1.00 . A A . 2 ARG HB3 1 1
16 3423 1 1 2 ARG HD2 H -4.369 -1.655 -4.103 1.00 . A A . 2 ARG HD2 1 1
16 3424 1 1 2 ARG HD3 H -3.633 -3.205 -4.481 1.00 . A A . 2 ARG HD3 1 1
16 3425 1 1 2 ARG HE H -6.406 -3.277 -3.626 1.00 . A A . 2 ARG HE 1 1
16 3426 1 1 2 ARG HG2 H -3.151 -2.531 -2.201 1.00 . A A . 2 ARG HG2 1 1
16 3427 1 1 2 ARG HG3 H -4.106 -4.011 -2.244 1.00 . A A . 2 ARG HG3 1 1
16 3428 1 1 2 ARG HH11 H -4.129 -3.481 -6.310 1.00 . A A . 2 ARG HH11 1 1
16 3429 1 1 2 ARG HH12 H -5.299 -3.836 -7.477 1.00 . A A . 2 ARG HH12 1 1
16 3430 1 1 2 ARG HH21 H -8.023 -3.872 -5.218 1.00 . A A . 2 ARG HH21 1 1
16 3431 1 1 2 ARG HH22 H -7.562 -4.134 -6.832 1.00 . A A . 2 ARG HH22 1 1
16 3432 1 1 2 ARG N N -5.950 -2.049 0.786 1.00 . A A . 2 ARG N 1 1
16 3433 1 1 2 ARG NE N -5.717 -3.236 -4.328 1.00 . A A . 2 ARG NE 1 1
16 3434 1 1 2 ARG NH1 N -5.099 -3.642 -6.512 1.00 . A A . 2 ARG NH1 1 1
16 3435 1 1 2 ARG NH2 N -7.285 -3.877 -5.902 1.00 . A A . 2 ARG NH2 1 1
16 3436 1 1 2 ARG O O -3.480 -0.537 0.150 1.00 . A A . 2 ARG O 1 1
16 3437 1 1 3 ALA C C -0.226 -2.311 0.390 1.00 . A A . 3 ALA C 1 1
16 3438 1 1 3 ALA CA C -1.363 -1.916 1.308 1.00 . A A . 3 ALA CA 1 1
16 3439 1 1 3 ALA CB C -1.061 -2.373 2.746 1.00 . A A . 3 ALA CB 1 1
16 3440 1 1 3 ALA H H -2.764 -3.439 0.959 1.00 . A A . 3 ALA H 1 1
16 3441 1 1 3 ALA HA H -1.451 -0.840 1.310 1.00 . A A . 3 ALA HA 1 1
16 3442 1 1 3 ALA HB1 H 0.010 -2.457 2.857 1.00 . A A . 3 ALA HB1 1 1
16 3443 1 1 3 ALA HB2 H -1.498 -3.349 2.894 1.00 . A A . 3 ALA HB2 1 1
16 3444 1 1 3 ALA N N -2.627 -2.471 0.865 1.00 . A A . 3 ALA N 1 1
16 3445 1 1 3 ALA O O -0.139 -3.456 -0.052 1.00 . A A . 3 ALA O 1 1
16 3446 1 1 4 TYR C C 2.923 -1.892 0.280 1.00 . A A . 4 TYR C 1 1
16 3447 1 1 4 TYR CA C 1.809 -1.600 -0.684 1.00 . A A . 4 TYR CA 1 1
16 3448 1 1 4 TYR CB C 2.175 -0.398 -1.562 1.00 . A A . 4 TYR CB 1 1
16 3449 1 1 4 TYR CD1 C 2.031 -0.380 -4.070 1.00 . A A . 4 TYR CD1 1 1
16 3450 1 1 4 TYR CD2 C 0.011 -0.120 -2.844 1.00 . A A . 4 TYR CD2 1 1
16 3451 1 1 4 TYR CE1 C 1.333 -0.296 -5.249 1.00 . A A . 4 TYR CE1 1 1
16 3452 1 1 4 TYR CE2 C -0.694 -0.036 -4.022 1.00 . A A . 4 TYR CE2 1 1
16 3453 1 1 4 TYR CG C 1.387 -0.293 -2.846 1.00 . A A . 4 TYR CG 1 1
16 3454 1 1 4 TYR CZ C -0.026 -0.124 -5.220 1.00 . A A . 4 TYR CZ 1 1
16 3455 1 1 4 TYR H H 0.389 -0.436 0.337 1.00 . A A . 4 TYR H 1 1
16 3456 1 1 4 TYR HA H 1.647 -2.466 -1.309 1.00 . A A . 4 TYR HA 1 1
16 3457 1 1 4 TYR HB2 H 1.997 0.507 -1.001 1.00 . A A . 4 TYR HB2 1 1
16 3458 1 1 4 TYR HB3 H 3.224 -0.456 -1.814 1.00 . A A . 4 TYR HB3 1 1
16 3459 1 1 4 TYR HD1 H 3.103 -0.515 -4.092 1.00 . A A . 4 TYR HD1 1 1
16 3460 1 1 4 TYR HD2 H -0.505 -0.049 -1.897 1.00 . A A . 4 TYR HD2 1 1
16 3461 1 1 4 TYR HE1 H 1.860 -0.367 -6.191 1.00 . A A . 4 TYR HE1 1 1
16 3462 1 1 4 TYR HE2 H -1.765 0.095 -4.000 1.00 . A A . 4 TYR HE2 1 1
16 3463 1 1 4 TYR HH H -1.344 0.693 -6.387 1.00 . A A . 4 TYR HH 1 1
16 3464 1 1 4 TYR N N 0.599 -1.358 0.068 1.00 . A A . 4 TYR N 1 1
16 3465 1 1 4 TYR O O 3.212 -1.082 1.166 1.00 . A A . 4 TYR O 1 1
16 3466 1 1 4 TYR OH O -0.718 -0.044 -6.393 1.00 . A A . 4 TYR OH 1 1
16 3467 1 1 5 LYS C C 5.903 -2.896 0.586 1.00 . A A . 5 LYS C 1 1
16 3468 1 1 5 LYS CA C 4.573 -3.479 1.021 1.00 . A A . 5 LYS CA 1 1
16 3469 1 1 5 LYS CB C 4.639 -5.030 1.133 1.00 . A A . 5 LYS CB 1 1
16 3470 1 1 5 LYS CD C 2.158 -5.616 0.916 1.00 . A A . 5 LYS CD 1 1
16 3471 1 1 5 LYS CE C 0.908 -6.124 1.627 1.00 . A A . 5 LYS CE 1 1
16 3472 1 1 5 LYS CG C 3.409 -5.706 1.784 1.00 . A A . 5 LYS CG 1 1
16 3473 1 1 5 LYS H H 3.266 -3.599 -0.636 1.00 . A A . 5 LYS H 1 1
16 3474 1 1 5 LYS HA H 4.343 -3.069 1.993 1.00 . A A . 5 LYS HA 1 1
16 3475 1 1 5 LYS HB2 H 4.753 -5.439 0.142 1.00 . A A . 5 LYS HB2 1 1
16 3476 1 1 5 LYS HB3 H 5.512 -5.289 1.714 1.00 . A A . 5 LYS HB3 1 1
16 3477 1 1 5 LYS HD2 H 2.002 -4.584 0.641 1.00 . A A . 5 LYS HD2 1 1
16 3478 1 1 5 LYS HD3 H 2.319 -6.201 0.021 1.00 . A A . 5 LYS HD3 1 1
16 3479 1 1 5 LYS HE2 H 0.796 -5.576 2.550 1.00 . A A . 5 LYS HE2 1 1
16 3480 1 1 5 LYS HE3 H 0.055 -5.923 0.997 1.00 . A A . 5 LYS HE3 1 1
16 3481 1 1 5 LYS HG2 H 3.630 -6.750 1.954 1.00 . A A . 5 LYS HG2 1 1
16 3482 1 1 5 LYS HG3 H 3.215 -5.228 2.732 1.00 . A A . 5 LYS HG3 1 1
16 3483 1 1 5 LYS HZ1 H 0.054 -7.864 2.370 1.00 . A A . 5 LYS HZ1 1 1
16 3484 1 1 5 LYS HZ2 H 1.710 -7.803 2.615 1.00 . A A . 5 LYS HZ2 1 1
16 3485 1 1 5 LYS HZ3 H 1.090 -8.139 1.081 1.00 . A A . 5 LYS HZ3 1 1
16 3486 1 1 5 LYS N N 3.523 -3.039 0.129 1.00 . A A . 5 LYS N 1 1
16 3487 1 1 5 LYS NZ N 0.955 -7.570 1.940 1.00 . A A . 5 LYS NZ 1 1
16 3488 1 1 5 LYS O O 6.836 -2.780 1.387 1.00 . A A . 5 LYS O 1 1
16 3489 1 1 6 SER C C 7.071 -0.399 -0.925 1.00 . A A . 6 SER C 1 1
16 3490 1 1 6 SER CA C 7.153 -1.894 -1.200 1.00 . A A . 6 SER CA 1 1
16 3491 1 1 6 SER CB C 7.247 -2.138 -2.705 1.00 . A A . 6 SER CB 1 1
16 3492 1 1 6 SER H H 5.224 -2.678 -1.272 1.00 . A A . 6 SER H 1 1
16 3493 1 1 6 SER HA H 8.022 -2.314 -0.717 1.00 . A A . 6 SER HA 1 1
16 3494 1 1 6 SER HB2 H 6.396 -1.685 -3.195 1.00 . A A . 6 SER HB2 1 1
16 3495 1 1 6 SER HB3 H 8.156 -1.694 -3.079 1.00 . A A . 6 SER HB3 1 1
16 3496 1 1 6 SER HG H 7.230 -4.012 -2.168 1.00 . A A . 6 SER HG 1 1
16 3497 1 1 6 SER N N 5.987 -2.531 -0.672 1.00 . A A . 6 SER N 1 1
16 3498 1 1 6 SER O O 5.986 0.188 -0.993 1.00 . A A . 6 SER O 1 1
16 3499 1 1 6 SER OG O 7.260 -3.530 -3.006 1.00 . A A . 6 SER OG 1 1
16 3500 1 1 7 LYS C C 8.062 2.396 -1.645 1.00 . A A . 7 LYS C 1 1
16 3501 1 1 7 LYS CA C 8.305 1.610 -0.339 1.00 . A A . 7 LYS CA 1 1
16 3502 1 1 7 LYS CB C 9.712 1.887 0.209 1.00 . A A . 7 LYS CB 1 1
16 3503 1 1 7 LYS CD C 11.448 3.497 1.071 1.00 . A A . 7 LYS CD 1 1
16 3504 1 1 7 LYS CE C 12.461 3.154 -0.024 1.00 . A A . 7 LYS CE 1 1
16 3505 1 1 7 LYS CG C 10.009 3.337 0.587 1.00 . A A . 7 LYS CG 1 1
16 3506 1 1 7 LYS H H 9.004 -0.361 -0.543 1.00 . A A . 7 LYS H 1 1
16 3507 1 1 7 LYS HA H 7.570 1.882 0.403 1.00 . A A . 7 LYS HA 1 1
16 3508 1 1 7 LYS HB2 H 9.863 1.279 1.087 1.00 . A A . 7 LYS HB2 1 1
16 3509 1 1 7 LYS HB3 H 10.415 1.578 -0.550 1.00 . A A . 7 LYS HB3 1 1
16 3510 1 1 7 LYS HD2 H 11.600 4.521 1.378 1.00 . A A . 7 LYS HD2 1 1
16 3511 1 1 7 LYS HD3 H 11.606 2.844 1.917 1.00 . A A . 7 LYS HD3 1 1
16 3512 1 1 7 LYS HE2 H 12.283 2.151 -0.382 1.00 . A A . 7 LYS HE2 1 1
16 3513 1 1 7 LYS HE3 H 12.348 3.854 -0.838 1.00 . A A . 7 LYS HE3 1 1
16 3514 1 1 7 LYS HG2 H 9.852 3.968 -0.274 1.00 . A A . 7 LYS HG2 1 1
16 3515 1 1 7 LYS HG3 H 9.338 3.635 1.381 1.00 . A A . 7 LYS HG3 1 1
16 3516 1 1 7 LYS HZ1 H 14.011 2.504 1.203 1.00 . A A . 7 LYS HZ1 1 1
16 3517 1 1 7 LYS HZ2 H 14.055 4.149 0.863 1.00 . A A . 7 LYS HZ2 1 1
16 3518 1 1 7 LYS HZ3 H 14.517 3.047 -0.310 1.00 . A A . 7 LYS HZ3 1 1
16 3519 1 1 7 LYS N N 8.194 0.190 -0.604 1.00 . A A . 7 LYS N 1 1
16 3520 1 1 7 LYS NZ N 13.844 3.216 0.465 1.00 . A A . 7 LYS NZ 1 1
16 3521 1 1 7 LYS O O 8.511 1.960 -2.708 1.00 . A A . 7 LYS O 1 1
16 3522 1 1 8 PRO C C 5.440 3.278 -0.008 1.00 . A A . 8 PRO C 1 1
16 3523 1 1 8 PRO CA C 6.706 4.058 -0.386 1.00 . A A . 8 PRO CA 1 1
16 3524 1 1 8 PRO CB C 6.344 5.494 -0.782 1.00 . A A . 8 PRO CB 1 1
16 3525 1 1 8 PRO CD C 7.044 4.380 -2.778 1.00 . A A . 8 PRO CD 1 1
16 3526 1 1 8 PRO CG C 6.117 5.437 -2.251 1.00 . A A . 8 PRO CG 1 1
16 3527 1 1 8 PRO HA H 7.406 4.067 0.434 1.00 . A A . 8 PRO HA 1 1
16 3528 1 1 8 PRO HB2 H 5.454 5.804 -0.255 1.00 . A A . 8 PRO HB2 1 1
16 3529 1 1 8 PRO HB3 H 7.161 6.155 -0.538 1.00 . A A . 8 PRO HB3 1 1
16 3530 1 1 8 PRO HD2 H 6.561 3.810 -3.558 1.00 . A A . 8 PRO HD2 1 1
16 3531 1 1 8 PRO HD3 H 7.953 4.829 -3.149 1.00 . A A . 8 PRO HD3 1 1
16 3532 1 1 8 PRO HG2 H 5.090 5.168 -2.451 1.00 . A A . 8 PRO HG2 1 1
16 3533 1 1 8 PRO HG3 H 6.343 6.394 -2.698 1.00 . A A . 8 PRO HG3 1 1
16 3534 1 1 8 PRO N N 7.323 3.526 -1.606 1.00 . A A . 8 PRO N 1 1
16 3535 1 1 8 PRO O O 4.610 2.982 -0.875 1.00 . A A . 8 PRO O 1 1
16 3536 1 1 9 PRO C C 2.839 3.008 1.582 1.00 . A A . 9 PRO C 1 1
16 3537 1 1 9 PRO CA C 4.104 2.169 1.721 1.00 . A A . 9 PRO CA 1 1
16 3538 1 1 9 PRO CB C 4.385 1.873 3.200 1.00 . A A . 9 PRO CB 1 1
16 3539 1 1 9 PRO CD C 6.200 3.180 2.388 1.00 . A A . 9 PRO CD 1 1
16 3540 1 1 9 PRO CG C 5.841 2.118 3.374 1.00 . A A . 9 PRO CG 1 1
16 3541 1 1 9 PRO HA H 3.986 1.247 1.172 1.00 . A A . 9 PRO HA 1 1
16 3542 1 1 9 PRO HB2 H 3.795 2.535 3.818 1.00 . A A . 9 PRO HB2 1 1
16 3543 1 1 9 PRO HB3 H 4.127 0.849 3.423 1.00 . A A . 9 PRO HB3 1 1
16 3544 1 1 9 PRO HD2 H 6.035 4.161 2.813 1.00 . A A . 9 PRO HD2 1 1
16 3545 1 1 9 PRO HD3 H 7.229 3.061 2.087 1.00 . A A . 9 PRO HD3 1 1
16 3546 1 1 9 PRO HG2 H 6.039 2.455 4.382 1.00 . A A . 9 PRO HG2 1 1
16 3547 1 1 9 PRO HG3 H 6.391 1.211 3.167 1.00 . A A . 9 PRO HG3 1 1
16 3548 1 1 9 PRO N N 5.276 2.910 1.274 1.00 . A A . 9 PRO N 1 1
16 3549 1 1 9 PRO O O 2.637 3.981 2.321 1.00 . A A . 9 PRO O 1 1
16 3550 1 1 10 ILE C C -0.314 2.405 0.706 1.00 . A A . 10 ILE C 1 1
16 3551 1 1 10 ILE CA C 0.802 3.365 0.350 1.00 . A A . 10 ILE CA 1 1
16 3552 1 1 10 ILE CB C 0.669 3.782 -1.147 1.00 . A A . 10 ILE CB 1 1
16 3553 1 1 10 ILE CD1 C 1.878 5.041 -3.036 1.00 . A A . 10 ILE CD1 1 1
16 3554 1 1 10 ILE CG1 C 1.858 4.671 -1.563 1.00 . A A . 10 ILE CG1 1 1
16 3555 1 1 10 ILE CG2 C -0.653 4.517 -1.384 1.00 . A A . 10 ILE CG2 1 1
16 3556 1 1 10 ILE H H 2.330 1.973 -0.011 1.00 . A A . 10 ILE H 1 1
16 3557 1 1 10 ILE HA H 0.749 4.243 0.977 1.00 . A A . 10 ILE HA 1 1
16 3558 1 1 10 ILE HB H 0.673 2.887 -1.750 1.00 . A A . 10 ILE HB 1 1
16 3559 1 1 10 ILE HD11 H 1.933 4.141 -3.632 1.00 . A A . 10 ILE HD11 1 1
16 3560 1 1 10 ILE HD12 H 2.738 5.661 -3.239 1.00 . A A . 10 ILE HD12 1 1
16 3561 1 1 10 ILE HD13 H 0.976 5.580 -3.283 1.00 . A A . 10 ILE HD13 1 1
16 3562 1 1 10 ILE HG12 H 1.822 5.590 -0.998 1.00 . A A . 10 ILE HG12 1 1
16 3563 1 1 10 ILE HG13 H 2.777 4.154 -1.335 1.00 . A A . 10 ILE HG13 1 1
16 3564 1 1 10 ILE HG21 H -1.477 3.871 -1.119 1.00 . A A . 10 ILE HG21 1 1
16 3565 1 1 10 ILE HG22 H -0.733 4.789 -2.427 1.00 . A A . 10 ILE HG22 1 1
16 3566 1 1 10 ILE HG23 H -0.684 5.409 -0.778 1.00 . A A . 10 ILE HG23 1 1
16 3567 1 1 10 ILE N N 2.055 2.692 0.594 1.00 . A A . 10 ILE N 1 1
16 3568 1 1 10 ILE O O -0.301 1.247 0.266 1.00 . A A . 10 ILE O 1 1
16 3569 1 1 11 ALA C C -3.632 2.633 1.557 1.00 . A A . 11 ALA C 1 1
16 3570 1 1 11 ALA CA C -2.326 1.983 1.907 1.00 . A A . 11 ALA CA 1 1
16 3571 1 1 11 ALA CB C -2.300 1.596 3.402 1.00 . A A . 11 ALA CB 1 1
16 3572 1 1 11 ALA H H -1.225 3.759 1.860 1.00 . A A . 11 ALA H 1 1
16 3573 1 1 11 ALA HA H -2.239 1.085 1.313 1.00 . A A . 11 ALA HA 1 1
16 3574 1 1 11 ALA HB1 H -3.104 0.903 3.598 1.00 . A A . 11 ALA HB1 1 1
16 3575 1 1 11 ALA HB2 H -2.466 2.486 3.990 1.00 . A A . 11 ALA HB2 1 1
16 3576 1 1 11 ALA N N -1.241 2.837 1.522 1.00 . A A . 11 ALA N 1 1
16 3577 1 1 11 ALA O O -4.006 3.656 2.123 1.00 . A A . 11 ALA O 1 1
16 3578 1 1 12 PHE C C -6.657 2.096 1.123 1.00 . A A . 12 PHE C 1 1
16 3579 1 1 12 PHE CA C -5.568 2.520 0.155 1.00 . A A . 12 PHE CA 1 1
16 3580 1 1 12 PHE CB C -5.848 1.992 -1.259 1.00 . A A . 12 PHE CB 1 1
16 3581 1 1 12 PHE CD1 C -5.312 3.715 -2.990 1.00 . A A . 12 PHE CD1 1 1
16 3582 1 1 12 PHE CD2 C -3.719 1.994 -2.609 1.00 . A A . 12 PHE CD2 1 1
16 3583 1 1 12 PHE CE1 C -4.493 4.272 -3.949 1.00 . A A . 12 PHE CE1 1 1
16 3584 1 1 12 PHE CE2 C -2.894 2.548 -3.571 1.00 . A A . 12 PHE CE2 1 1
16 3585 1 1 12 PHE CG C -4.940 2.574 -2.309 1.00 . A A . 12 PHE CG 1 1
16 3586 1 1 12 PHE CZ C -3.281 3.689 -4.240 1.00 . A A . 12 PHE CZ 1 1
16 3587 1 1 12 PHE H H -3.924 1.221 0.246 1.00 . A A . 12 PHE H 1 1
16 3588 1 1 12 PHE HA H -5.516 3.598 0.121 1.00 . A A . 12 PHE HA 1 1
16 3589 1 1 12 PHE HB2 H -5.719 0.919 -1.267 1.00 . A A . 12 PHE HB2 1 1
16 3590 1 1 12 PHE HB3 H -6.868 2.226 -1.528 1.00 . A A . 12 PHE HB3 1 1
16 3591 1 1 12 PHE HD1 H -6.263 4.173 -2.759 1.00 . A A . 12 PHE HD1 1 1
16 3592 1 1 12 PHE HD2 H -3.413 1.099 -2.087 1.00 . A A . 12 PHE HD2 1 1
16 3593 1 1 12 PHE HE1 H -4.800 5.167 -4.471 1.00 . A A . 12 PHE HE1 1 1
16 3594 1 1 12 PHE HE2 H -1.940 2.097 -3.802 1.00 . A A . 12 PHE HE2 1 1
16 3595 1 1 12 PHE HZ H -2.636 4.123 -4.991 1.00 . A A . 12 PHE HZ 1 1
16 3596 1 1 12 PHE N N -4.301 2.046 0.624 1.00 . A A . 12 PHE N 1 1
16 3597 1 1 12 PHE O O -6.685 0.919 1.531 1.00 . A A . 12 PHE O 1 1
16 3598 1 1 13 PRO C C -9.501 1.566 2.254 1.00 . A A . 13 PRO C 1 1
16 3599 1 1 13 PRO CA C -8.649 2.822 2.514 1.00 . A A . 13 PRO CA 1 1
16 3600 1 1 13 PRO CB C -9.505 4.078 2.372 1.00 . A A . 13 PRO CB 1 1
16 3601 1 1 13 PRO CD C -7.562 4.456 1.043 1.00 . A A . 13 PRO CD 1 1
16 3602 1 1 13 PRO CG C -8.552 5.134 1.947 1.00 . A A . 13 PRO CG 1 1
16 3603 1 1 13 PRO HA H -8.254 2.773 3.519 1.00 . A A . 13 PRO HA 1 1
16 3604 1 1 13 PRO HB2 H -10.263 3.909 1.620 1.00 . A A . 13 PRO HB2 1 1
16 3605 1 1 13 PRO HB3 H -9.967 4.318 3.318 1.00 . A A . 13 PRO HB3 1 1
16 3606 1 1 13 PRO HD2 H -7.883 4.518 0.014 1.00 . A A . 13 PRO HD2 1 1
16 3607 1 1 13 PRO HD3 H -6.590 4.909 1.162 1.00 . A A . 13 PRO HD3 1 1
16 3608 1 1 13 PRO HG2 H -9.079 5.911 1.414 1.00 . A A . 13 PRO HG2 1 1
16 3609 1 1 13 PRO HG3 H -8.051 5.546 2.810 1.00 . A A . 13 PRO HG3 1 1
16 3610 1 1 13 PRO N N -7.553 3.048 1.523 1.00 . A A . 13 PRO N 1 1
16 3611 1 1 13 PRO O O -10.130 1.027 3.171 1.00 . A A . 13 PRO O 1 1
16 3612 1 1 14 ASP C C -9.612 -1.348 1.334 1.00 . A A . 14 ASP C 1 1
16 3613 1 1 14 ASP CA C -10.194 -0.132 0.613 1.00 . A A . 14 ASP CA 1 1
16 3614 1 1 14 ASP CB C -10.076 -0.328 -0.910 1.00 . A A . 14 ASP CB 1 1
16 3615 1 1 14 ASP CG C -10.679 -1.628 -1.412 1.00 . A A . 14 ASP CG 1 1
16 3616 1 1 14 ASP H H -8.978 1.605 0.349 1.00 . A A . 14 ASP H 1 1
16 3617 1 1 14 ASP HA H -11.235 -0.023 0.874 1.00 . A A . 14 ASP HA 1 1
16 3618 1 1 14 ASP HB2 H -10.584 0.484 -1.408 1.00 . A A . 14 ASP HB2 1 1
16 3619 1 1 14 ASP HB3 H -9.030 -0.306 -1.183 1.00 . A A . 14 ASP HB3 1 1
16 3620 1 1 14 ASP N N -9.483 1.089 1.014 1.00 . A A . 14 ASP N 1 1
16 3621 1 1 14 ASP O O -10.309 -2.333 1.580 1.00 . A A . 14 ASP O 1 1
16 3622 1 1 14 ASP OD1 O -9.936 -2.605 -1.599 1.00 . A A . 14 ASP OD1 1 1
16 3623 1 1 14 ASP OD2 O -11.901 -1.685 -1.650 1.00 . A A . 14 ASP OD2 1 1
16 3624 2 2 1 . C C -1.583 -1.450 3.848 1.00 . B A . 101 WMH C 1 1
16 3625 2 2 1 . C1 C -0.998 0.978 3.884 1.00 . B A . 101 WMH C1 1 1
16 3626 2 2 1 . C2 C 0.141 1.658 4.179 1.00 . B A . 101 WMH C2 1 1
16 3627 2 2 1 . H1 H -1.668 -2.016 4.764 1.00 . B A . 101 WMH H1 1 1
16 3628 2 2 1 . H2 H -2.558 -1.084 3.567 1.00 . B A . 101 WMH H2 1 1
16 3629 2 2 1 . H5 H 0.266 2.730 4.129 1.00 . B A . 101 WMH H5 1 1
16 3630 2 2 1 . N N -0.734 -0.338 4.065 1.00 . B A . 101 WMH N 1 1
16 3631 2 2 1 . N1 N 1.077 0.792 4.537 1.00 . B A . 101 WMH N1 1 1
16 3632 2 2 1 . N2 N 0.601 -0.406 4.488 1.00 . B A . 101 WMH N2 1 1
17 3633 1 1 1 GLY C C -6.534 -2.676 1.730 1.00 . A A . 1 GLY C 1 1
17 3634 1 1 1 GLY CA C -7.635 -2.110 2.577 1.00 . A A . 1 GLY CA 1 1
17 3635 1 1 1 GLY H1 H -7.979 -0.237 1.681 1.00 . A A . 1 GLY H1 1 1
17 3636 1 1 1 GLY HA2 H -7.205 -1.658 3.459 1.00 . A A . 1 GLY HA2 1 1
17 3637 1 1 1 GLY HA3 H -8.296 -2.909 2.880 1.00 . A A . 1 GLY HA3 1 1
17 3638 1 1 1 GLY N N -8.386 -1.113 1.868 1.00 . A A . 1 GLY N 1 1
17 3639 1 1 1 GLY O O -6.269 -3.876 1.755 1.00 . A A . 1 GLY O 1 1
17 3640 1 1 2 ARG C C -3.511 -1.629 0.495 1.00 . A A . 2 ARG C 1 1
17 3641 1 1 2 ARG CA C -4.818 -2.270 0.102 1.00 . A A . 2 ARG CA 1 1
17 3642 1 1 2 ARG CB C -5.128 -1.980 -1.367 1.00 . A A . 2 ARG CB 1 1
17 3643 1 1 2 ARG CD C -6.654 -2.317 -3.325 1.00 . A A . 2 ARG CD 1 1
17 3644 1 1 2 ARG CG C -6.400 -2.632 -1.865 1.00 . A A . 2 ARG CG 1 1
17 3645 1 1 2 ARG CZ C -5.649 -2.750 -5.561 1.00 . A A . 2 ARG CZ 1 1
17 3646 1 1 2 ARG H H -6.106 -0.869 1.022 1.00 . A A . 2 ARG H 1 1
17 3647 1 1 2 ARG HA H -4.734 -3.338 0.233 1.00 . A A . 2 ARG HA 1 1
17 3648 1 1 2 ARG HB2 H -5.218 -0.914 -1.500 1.00 . A A . 2 ARG HB2 1 1
17 3649 1 1 2 ARG HB3 H -4.306 -2.334 -1.972 1.00 . A A . 2 ARG HB3 1 1
17 3650 1 1 2 ARG HD2 H -7.615 -2.720 -3.600 1.00 . A A . 2 ARG HD2 1 1
17 3651 1 1 2 ARG HD3 H -6.667 -1.246 -3.447 1.00 . A A . 2 ARG HD3 1 1
17 3652 1 1 2 ARG HE H -4.934 -3.424 -3.778 1.00 . A A . 2 ARG HE 1 1
17 3653 1 1 2 ARG HG2 H -6.309 -3.702 -1.747 1.00 . A A . 2 ARG HG2 1 1
17 3654 1 1 2 ARG HG3 H -7.230 -2.273 -1.275 1.00 . A A . 2 ARG HG3 1 1
17 3655 1 1 2 ARG HH11 H -7.260 -1.480 -5.621 1.00 . A A . 2 ARG HH11 1 1
17 3656 1 1 2 ARG HH12 H -6.614 -1.877 -7.145 1.00 . A A . 2 ARG HH12 1 1
17 3657 1 1 2 ARG HH21 H -4.034 -3.952 -5.900 1.00 . A A . 2 ARG HH21 1 1
17 3658 1 1 2 ARG HH22 H -4.741 -3.284 -7.302 1.00 . A A . 2 ARG HH22 1 1
17 3659 1 1 2 ARG N N -5.883 -1.824 0.972 1.00 . A A . 2 ARG N 1 1
17 3660 1 1 2 ARG NE N -5.632 -2.886 -4.221 1.00 . A A . 2 ARG NE 1 1
17 3661 1 1 2 ARG NH1 N -6.565 -1.979 -6.146 1.00 . A A . 2 ARG NH1 1 1
17 3662 1 1 2 ARG NH2 N -4.749 -3.370 -6.303 1.00 . A A . 2 ARG NH2 1 1
17 3663 1 1 2 ARG O O -3.274 -0.459 0.206 1.00 . A A . 2 ARG O 1 1
17 3664 1 1 3 ALA C C -0.335 -2.631 0.783 1.00 . A A . 3 ALA C 1 1
17 3665 1 1 3 ALA CA C -1.391 -1.948 1.607 1.00 . A A . 3 ALA CA 1 1
17 3666 1 1 3 ALA CB C -1.182 -2.290 3.093 1.00 . A A . 3 ALA CB 1 1
17 3667 1 1 3 ALA H H -2.960 -3.309 1.358 1.00 . A A . 3 ALA H 1 1
17 3668 1 1 3 ALA HA H -1.319 -0.878 1.479 1.00 . A A . 3 ALA HA 1 1
17 3669 1 1 3 ALA HB1 H -0.121 -2.382 3.271 1.00 . A A . 3 ALA HB1 1 1
17 3670 1 1 3 ALA HB2 H -1.645 -3.242 3.300 1.00 . A A . 3 ALA HB2 1 1
17 3671 1 1 3 ALA N N -2.693 -2.385 1.166 1.00 . A A . 3 ALA N 1 1
17 3672 1 1 3 ALA O O -0.400 -3.843 0.549 1.00 . A A . 3 ALA O 1 1
17 3673 1 1 4 TYR C C 2.948 -2.528 0.371 1.00 . A A . 4 TYR C 1 1
17 3674 1 1 4 TYR CA C 1.696 -2.390 -0.447 1.00 . A A . 4 TYR CA 1 1
17 3675 1 1 4 TYR CB C 1.916 -1.536 -1.699 1.00 . A A . 4 TYR CB 1 1
17 3676 1 1 4 TYR CD1 C 1.068 -2.626 -3.798 1.00 . A A . 4 TYR CD1 1 1
17 3677 1 1 4 TYR CD2 C -0.394 -1.144 -2.649 1.00 . A A . 4 TYR CD2 1 1
17 3678 1 1 4 TYR CE1 C 0.096 -2.869 -4.734 1.00 . A A . 4 TYR CE1 1 1
17 3679 1 1 4 TYR CE2 C -1.371 -1.382 -3.588 1.00 . A A . 4 TYR CE2 1 1
17 3680 1 1 4 TYR CG C 0.846 -1.762 -2.739 1.00 . A A . 4 TYR CG 1 1
17 3681 1 1 4 TYR CZ C -1.120 -2.246 -4.626 1.00 . A A . 4 TYR CZ 1 1
17 3682 1 1 4 TYR H H 0.596 -0.913 0.559 1.00 . A A . 4 TYR H 1 1
17 3683 1 1 4 TYR HA H 1.401 -3.382 -0.761 1.00 . A A . 4 TYR HA 1 1
17 3684 1 1 4 TYR HB2 H 1.902 -0.490 -1.427 1.00 . A A . 4 TYR HB2 1 1
17 3685 1 1 4 TYR HB3 H 2.872 -1.781 -2.140 1.00 . A A . 4 TYR HB3 1 1
17 3686 1 1 4 TYR HD1 H 2.028 -3.114 -3.883 1.00 . A A . 4 TYR HD1 1 1
17 3687 1 1 4 TYR HD2 H -0.585 -0.466 -1.831 1.00 . A A . 4 TYR HD2 1 1
17 3688 1 1 4 TYR HE1 H 0.299 -3.550 -5.550 1.00 . A A . 4 TYR HE1 1 1
17 3689 1 1 4 TYR HE2 H -2.330 -0.893 -3.498 1.00 . A A . 4 TYR HE2 1 1
17 3690 1 1 4 TYR HH H -2.493 -1.649 -5.796 1.00 . A A . 4 TYR HH 1 1
17 3691 1 1 4 TYR N N 0.618 -1.870 0.348 1.00 . A A . 4 TYR N 1 1
17 3692 1 1 4 TYR O O 3.116 -1.835 1.383 1.00 . A A . 4 TYR O 1 1
17 3693 1 1 4 TYR OH O -2.088 -2.490 -5.554 1.00 . A A . 4 TYR OH 1 1
17 3694 1 1 5 LYS C C 6.112 -2.744 0.147 1.00 . A A . 5 LYS C 1 1
17 3695 1 1 5 LYS CA C 5.041 -3.690 0.668 1.00 . A A . 5 LYS CA 1 1
17 3696 1 1 5 LYS CB C 5.539 -5.148 0.471 1.00 . A A . 5 LYS CB 1 1
17 3697 1 1 5 LYS CD C 3.445 -6.474 -0.189 1.00 . A A . 5 LYS CD 1 1
17 3698 1 1 5 LYS CE C 2.748 -7.828 -0.063 1.00 . A A . 5 LYS CE 1 1
17 3699 1 1 5 LYS CG C 4.577 -6.306 0.828 1.00 . A A . 5 LYS CG 1 1
17 3700 1 1 5 LYS H H 3.622 -3.930 -0.866 1.00 . A A . 5 LYS H 1 1
17 3701 1 1 5 LYS HA H 4.877 -3.505 1.719 1.00 . A A . 5 LYS HA 1 1
17 3702 1 1 5 LYS HB2 H 5.805 -5.269 -0.568 1.00 . A A . 5 LYS HB2 1 1
17 3703 1 1 5 LYS HB3 H 6.440 -5.266 1.057 1.00 . A A . 5 LYS HB3 1 1
17 3704 1 1 5 LYS HD2 H 2.715 -5.695 -0.023 1.00 . A A . 5 LYS HD2 1 1
17 3705 1 1 5 LYS HD3 H 3.847 -6.374 -1.186 1.00 . A A . 5 LYS HD3 1 1
17 3706 1 1 5 LYS HE2 H 2.011 -7.911 -0.847 1.00 . A A . 5 LYS HE2 1 1
17 3707 1 1 5 LYS HE3 H 3.486 -8.605 -0.199 1.00 . A A . 5 LYS HE3 1 1
17 3708 1 1 5 LYS HG2 H 5.142 -7.226 0.866 1.00 . A A . 5 LYS HG2 1 1
17 3709 1 1 5 LYS HG3 H 4.152 -6.113 1.802 1.00 . A A . 5 LYS HG3 1 1
17 3710 1 1 5 LYS HZ1 H 2.717 -7.921 2.044 1.00 . A A . 5 LYS HZ1 1 1
17 3711 1 1 5 LYS HZ2 H 1.655 -8.971 1.275 1.00 . A A . 5 LYS HZ2 1 1
17 3712 1 1 5 LYS HZ3 H 1.302 -7.328 1.329 1.00 . A A . 5 LYS HZ3 1 1
17 3713 1 1 5 LYS N N 3.809 -3.429 -0.043 1.00 . A A . 5 LYS N 1 1
17 3714 1 1 5 LYS NZ N 2.073 -8.022 1.236 1.00 . A A . 5 LYS NZ 1 1
17 3715 1 1 5 LYS O O 7.064 -2.403 0.857 1.00 . A A . 5 LYS O 1 1
17 3716 1 1 6 SER C C 6.902 -0.106 -1.086 1.00 . A A . 6 SER C 1 1
17 3717 1 1 6 SER CA C 6.858 -1.461 -1.771 1.00 . A A . 6 SER CA 1 1
17 3718 1 1 6 SER CB C 6.429 -1.330 -3.225 1.00 . A A . 6 SER CB 1 1
17 3719 1 1 6 SER H H 5.163 -2.641 -1.612 1.00 . A A . 6 SER H 1 1
17 3720 1 1 6 SER HA H 7.837 -1.914 -1.744 1.00 . A A . 6 SER HA 1 1
17 3721 1 1 6 SER HB2 H 6.953 -0.502 -3.679 1.00 . A A . 6 SER HB2 1 1
17 3722 1 1 6 SER HB3 H 6.660 -2.242 -3.755 1.00 . A A . 6 SER HB3 1 1
17 3723 1 1 6 SER HG H 4.824 -0.284 -2.818 1.00 . A A . 6 SER HG 1 1
17 3724 1 1 6 SER N N 5.948 -2.345 -1.104 1.00 . A A . 6 SER N 1 1
17 3725 1 1 6 SER O O 5.868 0.436 -0.726 1.00 . A A . 6 SER O 1 1
17 3726 1 1 6 SER OG O 5.024 -1.087 -3.318 1.00 . A A . 6 SER OG 1 1
17 3727 1 1 7 LYS C C 8.248 2.821 -1.257 1.00 . A A . 7 LYS C 1 1
17 3728 1 1 7 LYS CA C 8.262 1.687 -0.237 1.00 . A A . 7 LYS CA 1 1
17 3729 1 1 7 LYS CB C 9.570 1.704 0.553 1.00 . A A . 7 LYS CB 1 1
17 3730 1 1 7 LYS CD C 10.943 0.743 2.404 1.00 . A A . 7 LYS CD 1 1
17 3731 1 1 7 LYS CE C 11.044 -0.337 3.460 1.00 . A A . 7 LYS CE 1 1
17 3732 1 1 7 LYS CG C 9.648 0.639 1.631 1.00 . A A . 7 LYS CG 1 1
17 3733 1 1 7 LYS H H 8.877 -0.050 -1.244 1.00 . A A . 7 LYS H 1 1
17 3734 1 1 7 LYS HA H 7.438 1.801 0.451 1.00 . A A . 7 LYS HA 1 1
17 3735 1 1 7 LYS HB2 H 10.390 1.551 -0.132 1.00 . A A . 7 LYS HB2 1 1
17 3736 1 1 7 LYS HB3 H 9.680 2.671 1.022 1.00 . A A . 7 LYS HB3 1 1
17 3737 1 1 7 LYS HD2 H 11.769 0.643 1.714 1.00 . A A . 7 LYS HD2 1 1
17 3738 1 1 7 LYS HD3 H 10.985 1.710 2.881 1.00 . A A . 7 LYS HD3 1 1
17 3739 1 1 7 LYS HE2 H 10.201 -0.234 4.123 1.00 . A A . 7 LYS HE2 1 1
17 3740 1 1 7 LYS HE3 H 10.999 -1.299 2.971 1.00 . A A . 7 LYS HE3 1 1
17 3741 1 1 7 LYS HG2 H 8.821 0.766 2.314 1.00 . A A . 7 LYS HG2 1 1
17 3742 1 1 7 LYS HG3 H 9.589 -0.335 1.168 1.00 . A A . 7 LYS HG3 1 1
17 3743 1 1 7 LYS HZ1 H 13.134 -0.254 3.612 1.00 . A A . 7 LYS HZ1 1 1
17 3744 1 1 7 LYS HZ2 H 12.379 -1.022 4.910 1.00 . A A . 7 LYS HZ2 1 1
17 3745 1 1 7 LYS HZ3 H 12.323 0.650 4.784 1.00 . A A . 7 LYS HZ3 1 1
17 3746 1 1 7 LYS N N 8.087 0.419 -0.901 1.00 . A A . 7 LYS N 1 1
17 3747 1 1 7 LYS NZ N 12.302 -0.235 4.237 1.00 . A A . 7 LYS NZ 1 1
17 3748 1 1 7 LYS O O 8.770 2.657 -2.368 1.00 . A A . 7 LYS O 1 1
17 3749 1 1 8 PRO C C 5.532 3.375 0.279 1.00 . A A . 8 PRO C 1 1
17 3750 1 1 8 PRO CA C 6.853 4.162 0.300 1.00 . A A . 8 PRO CA 1 1
17 3751 1 1 8 PRO CB C 6.570 5.668 0.302 1.00 . A A . 8 PRO CB 1 1
17 3752 1 1 8 PRO CD C 7.581 5.160 -1.797 1.00 . A A . 8 PRO CD 1 1
17 3753 1 1 8 PRO CG C 6.579 6.054 -1.127 1.00 . A A . 8 PRO CG 1 1
17 3754 1 1 8 PRO HA H 7.448 3.893 1.158 1.00 . A A . 8 PRO HA 1 1
17 3755 1 1 8 PRO HB2 H 5.610 5.857 0.756 1.00 . A A . 8 PRO HB2 1 1
17 3756 1 1 8 PRO HB3 H 7.340 6.190 0.850 1.00 . A A . 8 PRO HB3 1 1
17 3757 1 1 8 PRO HD2 H 7.257 4.912 -2.796 1.00 . A A . 8 PRO HD2 1 1
17 3758 1 1 8 PRO HD3 H 8.551 5.632 -1.820 1.00 . A A . 8 PRO HD3 1 1
17 3759 1 1 8 PRO HG2 H 5.598 5.898 -1.552 1.00 . A A . 8 PRO HG2 1 1
17 3760 1 1 8 PRO HG3 H 6.872 7.089 -1.225 1.00 . A A . 8 PRO HG3 1 1
17 3761 1 1 8 PRO N N 7.606 3.960 -0.949 1.00 . A A . 8 PRO N 1 1
17 3762 1 1 8 PRO O O 4.811 3.389 -0.736 1.00 . A A . 8 PRO O 1 1
17 3763 1 1 9 PRO C C 2.759 2.700 1.385 1.00 . A A . 9 PRO C 1 1
17 3764 1 1 9 PRO CA C 4.004 1.842 1.419 1.00 . A A . 9 PRO CA 1 1
17 3765 1 1 9 PRO CB C 4.104 1.105 2.757 1.00 . A A . 9 PRO CB 1 1
17 3766 1 1 9 PRO CD C 5.985 2.544 2.603 1.00 . A A . 9 PRO CD 1 1
17 3767 1 1 9 PRO CG C 5.525 1.242 3.167 1.00 . A A . 9 PRO CG 1 1
17 3768 1 1 9 PRO HA H 3.969 1.127 0.608 1.00 . A A . 9 PRO HA 1 1
17 3769 1 1 9 PRO HB2 H 3.435 1.565 3.469 1.00 . A A . 9 PRO HB2 1 1
17 3770 1 1 9 PRO HB3 H 3.832 0.070 2.615 1.00 . A A . 9 PRO HB3 1 1
17 3771 1 1 9 PRO HD2 H 5.758 3.354 3.283 1.00 . A A . 9 PRO HD2 1 1
17 3772 1 1 9 PRO HD3 H 7.045 2.492 2.406 1.00 . A A . 9 PRO HD3 1 1
17 3773 1 1 9 PRO HG2 H 5.597 1.253 4.245 1.00 . A A . 9 PRO HG2 1 1
17 3774 1 1 9 PRO HG3 H 6.107 0.429 2.759 1.00 . A A . 9 PRO HG3 1 1
17 3775 1 1 9 PRO N N 5.212 2.648 1.361 1.00 . A A . 9 PRO N 1 1
17 3776 1 1 9 PRO O O 2.530 3.533 2.278 1.00 . A A . 9 PRO O 1 1
17 3777 1 1 10 ILE C C -0.352 2.311 0.627 1.00 . A A . 10 ILE C 1 1
17 3778 1 1 10 ILE CA C 0.765 3.250 0.199 1.00 . A A . 10 ILE CA 1 1
17 3779 1 1 10 ILE CB C 0.553 3.743 -1.283 1.00 . A A . 10 ILE CB 1 1
17 3780 1 1 10 ILE CD1 C -0.821 5.820 -0.648 1.00 . A A . 10 ILE CD1 1 1
17 3781 1 1 10 ILE CG1 C -0.760 4.534 -1.449 1.00 . A A . 10 ILE CG1 1 1
17 3782 1 1 10 ILE CG2 C 0.622 2.593 -2.287 1.00 . A A . 10 ILE CG2 1 1
17 3783 1 1 10 ILE H H 2.283 1.937 -0.367 1.00 . A A . 10 ILE H 1 1
17 3784 1 1 10 ILE HA H 0.787 4.103 0.861 1.00 . A A . 10 ILE HA 1 1
17 3785 1 1 10 ILE HB H 1.381 4.395 -1.517 1.00 . A A . 10 ILE HB 1 1
17 3786 1 1 10 ILE HD11 H -1.766 6.311 -0.830 1.00 . A A . 10 ILE HD11 1 1
17 3787 1 1 10 ILE HD12 H -0.012 6.471 -0.947 1.00 . A A . 10 ILE HD12 1 1
17 3788 1 1 10 ILE HD13 H -0.731 5.595 0.405 1.00 . A A . 10 ILE HD13 1 1
17 3789 1 1 10 ILE HG12 H -0.890 4.791 -2.490 1.00 . A A . 10 ILE HG12 1 1
17 3790 1 1 10 ILE HG13 H -1.583 3.908 -1.138 1.00 . A A . 10 ILE HG13 1 1
17 3791 1 1 10 ILE HG21 H 0.475 2.976 -3.287 1.00 . A A . 10 ILE HG21 1 1
17 3792 1 1 10 ILE HG22 H -0.153 1.874 -2.062 1.00 . A A . 10 ILE HG22 1 1
17 3793 1 1 10 ILE HG23 H 1.586 2.112 -2.223 1.00 . A A . 10 ILE HG23 1 1
17 3794 1 1 10 ILE N N 2.003 2.551 0.343 1.00 . A A . 10 ILE N 1 1
17 3795 1 1 10 ILE O O -0.299 1.100 0.332 1.00 . A A . 10 ILE O 1 1
17 3796 1 1 11 ALA C C -3.690 2.681 1.366 1.00 . A A . 11 ALA C 1 1
17 3797 1 1 11 ALA CA C -2.410 2.008 1.789 1.00 . A A . 11 ALA CA 1 1
17 3798 1 1 11 ALA CB C -2.445 1.699 3.310 1.00 . A A . 11 ALA CB 1 1
17 3799 1 1 11 ALA H H -1.240 3.750 1.679 1.00 . A A . 11 ALA H 1 1
17 3800 1 1 11 ALA HA H -2.335 1.078 1.243 1.00 . A A . 11 ALA HA 1 1
17 3801 1 1 11 ALA HB1 H -3.246 1.000 3.501 1.00 . A A . 11 ALA HB1 1 1
17 3802 1 1 11 ALA HB2 H -2.662 2.609 3.848 1.00 . A A . 11 ALA HB2 1 1
17 3803 1 1 11 ALA N N -1.293 2.815 1.386 1.00 . A A . 11 ALA N 1 1
17 3804 1 1 11 ALA O O -4.036 3.761 1.860 1.00 . A A . 11 ALA O 1 1
17 3805 1 1 12 PHE C C -6.700 2.165 0.925 1.00 . A A . 12 PHE C 1 1
17 3806 1 1 12 PHE CA C -5.612 2.550 -0.061 1.00 . A A . 12 PHE CA 1 1
17 3807 1 1 12 PHE CB C -5.913 1.965 -1.446 1.00 . A A . 12 PHE CB 1 1
17 3808 1 1 12 PHE CD1 C -5.017 3.491 -3.224 1.00 . A A . 12 PHE CD1 1 1
17 3809 1 1 12 PHE CD2 C -3.825 1.480 -2.769 1.00 . A A . 12 PHE CD2 1 1
17 3810 1 1 12 PHE CE1 C -4.096 3.819 -4.195 1.00 . A A . 12 PHE CE1 1 1
17 3811 1 1 12 PHE CE2 C -2.899 1.809 -3.741 1.00 . A A . 12 PHE CE2 1 1
17 3812 1 1 12 PHE CG C -4.895 2.320 -2.498 1.00 . A A . 12 PHE CG 1 1
17 3813 1 1 12 PHE CZ C -3.036 2.979 -4.453 1.00 . A A . 12 PHE CZ 1 1
17 3814 1 1 12 PHE H H -3.979 1.230 0.095 1.00 . A A . 12 PHE H 1 1
17 3815 1 1 12 PHE HA H -5.543 3.625 -0.127 1.00 . A A . 12 PHE HA 1 1
17 3816 1 1 12 PHE HB2 H -5.967 0.891 -1.373 1.00 . A A . 12 PHE HB2 1 1
17 3817 1 1 12 PHE HB3 H -6.874 2.337 -1.773 1.00 . A A . 12 PHE HB3 1 1
17 3818 1 1 12 PHE HD1 H -5.843 4.161 -3.027 1.00 . A A . 12 PHE HD1 1 1
17 3819 1 1 12 PHE HD2 H -3.711 0.561 -2.211 1.00 . A A . 12 PHE HD2 1 1
17 3820 1 1 12 PHE HE1 H -4.206 4.739 -4.750 1.00 . A A . 12 PHE HE1 1 1
17 3821 1 1 12 PHE HE2 H -2.066 1.153 -3.947 1.00 . A A . 12 PHE HE2 1 1
17 3822 1 1 12 PHE HZ H -2.315 3.239 -5.215 1.00 . A A . 12 PHE HZ 1 1
17 3823 1 1 12 PHE N N -4.357 2.069 0.441 1.00 . A A . 12 PHE N 1 1
17 3824 1 1 12 PHE O O -6.723 1.010 1.376 1.00 . A A . 12 PHE O 1 1
17 3825 1 1 13 PRO C C -9.520 1.682 2.177 1.00 . A A . 13 PRO C 1 1
17 3826 1 1 13 PRO CA C -8.664 2.953 2.319 1.00 . A A . 13 PRO CA 1 1
17 3827 1 1 13 PRO CB C -9.543 4.206 2.145 1.00 . A A . 13 PRO CB 1 1
17 3828 1 1 13 PRO CD C -7.631 4.488 0.738 1.00 . A A . 13 PRO CD 1 1
17 3829 1 1 13 PRO CG C -9.072 4.857 0.885 1.00 . A A . 13 PRO CG 1 1
17 3830 1 1 13 PRO HA H -8.239 2.964 3.312 1.00 . A A . 13 PRO HA 1 1
17 3831 1 1 13 PRO HB2 H -10.579 3.909 2.074 1.00 . A A . 13 PRO HB2 1 1
17 3832 1 1 13 PRO HB3 H -9.410 4.856 2.997 1.00 . A A . 13 PRO HB3 1 1
17 3833 1 1 13 PRO HD2 H -7.355 4.496 -0.306 1.00 . A A . 13 PRO HD2 1 1
17 3834 1 1 13 PRO HD3 H -7.001 5.156 1.307 1.00 . A A . 13 PRO HD3 1 1
17 3835 1 1 13 PRO HG2 H -9.641 4.483 0.046 1.00 . A A . 13 PRO HG2 1 1
17 3836 1 1 13 PRO HG3 H -9.180 5.928 0.962 1.00 . A A . 13 PRO HG3 1 1
17 3837 1 1 13 PRO N N -7.590 3.126 1.292 1.00 . A A . 13 PRO N 1 1
17 3838 1 1 13 PRO O O -10.129 1.236 3.139 1.00 . A A . 13 PRO O 1 1
17 3839 1 1 14 ASP C C -9.625 -1.324 1.472 1.00 . A A . 14 ASP C 1 1
17 3840 1 1 14 ASP CA C -10.296 -0.147 0.745 1.00 . A A . 14 ASP CA 1 1
17 3841 1 1 14 ASP CB C -10.382 -0.429 -0.761 1.00 . A A . 14 ASP CB 1 1
17 3842 1 1 14 ASP CG C -11.195 -1.664 -1.100 1.00 . A A . 14 ASP CG 1 1
17 3843 1 1 14 ASP H H -9.054 1.519 0.253 1.00 . A A . 14 ASP H 1 1
17 3844 1 1 14 ASP HA H -11.293 -0.016 1.142 1.00 . A A . 14 ASP HA 1 1
17 3845 1 1 14 ASP HB2 H -10.836 0.419 -1.253 1.00 . A A . 14 ASP HB2 1 1
17 3846 1 1 14 ASP HB3 H -9.380 -0.563 -1.143 1.00 . A A . 14 ASP HB3 1 1
17 3847 1 1 14 ASP N N -9.548 1.099 0.987 1.00 . A A . 14 ASP N 1 1
17 3848 1 1 14 ASP O O -10.227 -2.380 1.689 1.00 . A A . 14 ASP O 1 1
17 3849 1 1 14 ASP OD1 O -10.612 -2.701 -1.481 1.00 . A A . 14 ASP OD1 1 1
17 3850 1 1 14 ASP OD2 O -12.444 -1.619 -0.997 1.00 . A A . 14 ASP OD2 1 1
17 3851 2 2 1 . C C -1.739 -1.275 4.082 1.00 . B A . 101 WMH C 1 1
17 3852 2 2 1 . C1 C -1.162 1.134 3.899 1.00 . B A . 101 WMH C1 1 1
17 3853 2 2 1 . C2 C -0.047 1.842 4.176 1.00 . B A . 101 WMH C2 1 1
17 3854 2 2 1 . H1 H -1.854 -1.756 5.043 1.00 . B A . 101 WMH H1 1 1
17 3855 2 2 1 . H2 H -2.706 -0.944 3.736 1.00 . B A . 101 WMH H2 1 1
17 3856 2 2 1 . H5 H 0.071 2.904 4.023 1.00 . B A . 101 WMH H5 1 1
17 3857 2 2 1 . N N -0.905 -0.151 4.223 1.00 . B A . 101 WMH N 1 1
17 3858 2 2 1 . N1 N 0.876 1.029 4.660 1.00 . B A . 101 WMH N1 1 1
17 3859 2 2 1 . N2 N 0.413 -0.170 4.711 1.00 . B A . 101 WMH N2 1 1
18 3860 1 1 1 GLY C C -7.071 -2.905 0.735 1.00 . A A . 1 GLY C 1 1
18 3861 1 1 1 GLY CA C -8.250 -2.525 1.582 1.00 . A A . 1 GLY CA 1 1
18 3862 1 1 1 GLY H1 H -8.335 -0.424 1.610 1.00 . A A . 1 GLY H1 1 1
18 3863 1 1 1 GLY HA2 H -7.945 -2.531 2.618 1.00 . A A . 1 GLY HA2 1 1
18 3864 1 1 1 GLY HA3 H -9.030 -3.259 1.443 1.00 . A A . 1 GLY HA3 1 1
18 3865 1 1 1 GLY N N -8.773 -1.228 1.254 1.00 . A A . 1 GLY N 1 1
18 3866 1 1 1 GLY O O -7.101 -3.934 0.053 1.00 . A A . 1 GLY O 1 1
18 3867 1 1 2 ARG C C -3.630 -1.720 0.661 1.00 . A A . 2 ARG C 1 1
18 3868 1 1 2 ARG CA C -4.832 -2.378 0.002 1.00 . A A . 2 ARG CA 1 1
18 3869 1 1 2 ARG CB C -4.948 -1.890 -1.436 1.00 . A A . 2 ARG CB 1 1
18 3870 1 1 2 ARG CD C -3.926 -1.829 -3.701 1.00 . A A . 2 ARG CD 1 1
18 3871 1 1 2 ARG CG C -3.799 -2.342 -2.302 1.00 . A A . 2 ARG CG 1 1
18 3872 1 1 2 ARG CZ C -2.819 -2.163 -5.890 1.00 . A A . 2 ARG CZ 1 1
18 3873 1 1 2 ARG H H -6.071 -1.256 1.279 1.00 . A A . 2 ARG H 1 1
18 3874 1 1 2 ARG HA H -4.695 -3.449 -0.001 1.00 . A A . 2 ARG HA 1 1
18 3875 1 1 2 ARG HB2 H -5.869 -2.264 -1.862 1.00 . A A . 2 ARG HB2 1 1
18 3876 1 1 2 ARG HB3 H -4.971 -0.811 -1.440 1.00 . A A . 2 ARG HB3 1 1
18 3877 1 1 2 ARG HD2 H -4.915 -2.060 -4.063 1.00 . A A . 2 ARG HD2 1 1
18 3878 1 1 2 ARG HD3 H -3.784 -0.759 -3.695 1.00 . A A . 2 ARG HD3 1 1
18 3879 1 1 2 ARG HE H -2.360 -3.111 -4.152 1.00 . A A . 2 ARG HE 1 1
18 3880 1 1 2 ARG HG2 H -2.873 -1.980 -1.879 1.00 . A A . 2 ARG HG2 1 1
18 3881 1 1 2 ARG HG3 H -3.788 -3.421 -2.323 1.00 . A A . 2 ARG HG3 1 1
18 3882 1 1 2 ARG HH11 H -4.194 -0.640 -5.905 1.00 . A A . 2 ARG HH11 1 1
18 3883 1 1 2 ARG HH12 H -3.476 -0.981 -7.417 1.00 . A A . 2 ARG HH12 1 1
18 3884 1 1 2 ARG HH21 H -1.387 -3.579 -6.272 1.00 . A A . 2 ARG HH21 1 1
18 3885 1 1 2 ARG HH22 H -1.856 -2.659 -7.621 1.00 . A A . 2 ARG HH22 1 1
18 3886 1 1 2 ARG N N -6.038 -2.081 0.748 1.00 . A A . 2 ARG N 1 1
18 3887 1 1 2 ARG NE N -2.933 -2.433 -4.584 1.00 . A A . 2 ARG NE 1 1
18 3888 1 1 2 ARG NH1 N -3.547 -1.194 -6.439 1.00 . A A . 2 ARG NH1 1 1
18 3889 1 1 2 ARG NH2 N -1.968 -2.847 -6.638 1.00 . A A . 2 ARG NH2 1 1
18 3890 1 1 2 ARG O O -3.662 -0.538 0.956 1.00 . A A . 2 ARG O 1 1
18 3891 1 1 3 ALA C C -0.163 -2.413 0.676 1.00 . A A . 3 ALA C 1 1
18 3892 1 1 3 ALA CA C -1.364 -1.993 1.479 1.00 . A A . 3 ALA CA 1 1
18 3893 1 1 3 ALA CB C -1.230 -2.487 2.925 1.00 . A A . 3 ALA CB 1 1
18 3894 1 1 3 ALA H H -2.633 -3.432 0.639 1.00 . A A . 3 ALA H 1 1
18 3895 1 1 3 ALA HA H -1.411 -0.914 1.493 1.00 . A A . 3 ALA HA 1 1
18 3896 1 1 3 ALA HB1 H -0.182 -2.627 3.142 1.00 . A A . 3 ALA HB1 1 1
18 3897 1 1 3 ALA HB2 H -1.729 -3.440 3.013 1.00 . A A . 3 ALA HB2 1 1
18 3898 1 1 3 ALA N N -2.594 -2.482 0.883 1.00 . A A . 3 ALA N 1 1
18 3899 1 1 3 ALA O O -0.054 -3.568 0.267 1.00 . A A . 3 ALA O 1 1
18 3900 1 1 4 TYR C C 3.063 -2.100 0.740 1.00 . A A . 4 TYR C 1 1
18 3901 1 1 4 TYR CA C 1.965 -1.754 -0.248 1.00 . A A . 4 TYR CA 1 1
18 3902 1 1 4 TYR CB C 2.391 -0.567 -1.125 1.00 . A A . 4 TYR CB 1 1
18 3903 1 1 4 TYR CD1 C 2.084 -0.857 -3.615 1.00 . A A . 4 TYR CD1 1 1
18 3904 1 1 4 TYR CD2 C 0.372 0.269 -2.416 1.00 . A A . 4 TYR CD2 1 1
18 3905 1 1 4 TYR CE1 C 1.392 -0.671 -4.794 1.00 . A A . 4 TYR CE1 1 1
18 3906 1 1 4 TYR CE2 C -0.332 0.448 -3.590 1.00 . A A . 4 TYR CE2 1 1
18 3907 1 1 4 TYR CG C 1.591 -0.388 -2.407 1.00 . A A . 4 TYR CG 1 1
18 3908 1 1 4 TYR CZ C 0.184 -0.021 -4.776 1.00 . A A . 4 TYR CZ 1 1
18 3909 1 1 4 TYR H H 0.570 -0.566 0.767 1.00 . A A . 4 TYR H 1 1
18 3910 1 1 4 TYR HA H 1.793 -2.611 -0.881 1.00 . A A . 4 TYR HA 1 1
18 3911 1 1 4 TYR HB2 H 2.283 0.347 -0.558 1.00 . A A . 4 TYR HB2 1 1
18 3912 1 1 4 TYR HB3 H 3.429 -0.687 -1.396 1.00 . A A . 4 TYR HB3 1 1
18 3913 1 1 4 TYR HD1 H 3.033 -1.370 -3.626 1.00 . A A . 4 TYR HD1 1 1
18 3914 1 1 4 TYR HD2 H -0.031 0.637 -1.483 1.00 . A A . 4 TYR HD2 1 1
18 3915 1 1 4 TYR HE1 H 1.800 -1.048 -5.721 1.00 . A A . 4 TYR HE1 1 1
18 3916 1 1 4 TYR HE2 H -1.283 0.957 -3.576 1.00 . A A . 4 TYR HE2 1 1
18 3917 1 1 4 TYR HH H -0.742 1.128 -5.959 1.00 . A A . 4 TYR HH 1 1
18 3918 1 1 4 TYR N N 0.731 -1.482 0.454 1.00 . A A . 4 TYR N 1 1
18 3919 1 1 4 TYR O O 3.182 -1.480 1.814 1.00 . A A . 4 TYR O 1 1
18 3920 1 1 4 TYR OH O -0.499 0.192 -5.948 1.00 . A A . 4 TYR OH 1 1
18 3921 1 1 5 LYS C C 6.177 -2.746 0.857 1.00 . A A . 5 LYS C 1 1
18 3922 1 1 5 LYS CA C 4.933 -3.533 1.224 1.00 . A A . 5 LYS CA 1 1
18 3923 1 1 5 LYS CB C 5.176 -5.036 1.027 1.00 . A A . 5 LYS CB 1 1
18 3924 1 1 5 LYS CD C 3.607 -5.867 2.839 1.00 . A A . 5 LYS CD 1 1
18 3925 1 1 5 LYS CE C 2.386 -6.730 3.123 1.00 . A A . 5 LYS CE 1 1
18 3926 1 1 5 LYS CG C 3.977 -5.923 1.358 1.00 . A A . 5 LYS CG 1 1
18 3927 1 1 5 LYS H H 3.668 -3.540 -0.457 1.00 . A A . 5 LYS H 1 1
18 3928 1 1 5 LYS HA H 4.680 -3.345 2.256 1.00 . A A . 5 LYS HA 1 1
18 3929 1 1 5 LYS HB2 H 5.450 -5.211 -0.003 1.00 . A A . 5 LYS HB2 1 1
18 3930 1 1 5 LYS HB3 H 6.001 -5.334 1.658 1.00 . A A . 5 LYS HB3 1 1
18 3931 1 1 5 LYS HD2 H 4.436 -6.224 3.429 1.00 . A A . 5 LYS HD2 1 1
18 3932 1 1 5 LYS HD3 H 3.383 -4.846 3.110 1.00 . A A . 5 LYS HD3 1 1
18 3933 1 1 5 LYS HE2 H 1.540 -6.306 2.606 1.00 . A A . 5 LYS HE2 1 1
18 3934 1 1 5 LYS HE3 H 2.568 -7.731 2.759 1.00 . A A . 5 LYS HE3 1 1
18 3935 1 1 5 LYS HG2 H 3.132 -5.586 0.778 1.00 . A A . 5 LYS HG2 1 1
18 3936 1 1 5 LYS HG3 H 4.214 -6.942 1.091 1.00 . A A . 5 LYS HG3 1 1
18 3937 1 1 5 LYS HZ1 H 1.175 -7.323 4.691 1.00 . A A . 5 LYS HZ1 1 1
18 3938 1 1 5 LYS HZ2 H 1.918 -5.844 4.971 1.00 . A A . 5 LYS HZ2 1 1
18 3939 1 1 5 LYS HZ3 H 2.797 -7.284 5.079 1.00 . A A . 5 LYS HZ3 1 1
18 3940 1 1 5 LYS N N 3.836 -3.092 0.400 1.00 . A A . 5 LYS N 1 1
18 3941 1 1 5 LYS NZ N 2.053 -6.785 4.552 1.00 . A A . 5 LYS NZ 1 1
18 3942 1 1 5 LYS O O 6.914 -2.275 1.729 1.00 . A A . 5 LYS O 1 1
18 3943 1 1 6 SER C C 7.263 -0.363 -0.881 1.00 . A A . 6 SER C 1 1
18 3944 1 1 6 SER CA C 7.519 -1.867 -0.944 1.00 . A A . 6 SER CA 1 1
18 3945 1 1 6 SER CB C 7.798 -2.305 -2.377 1.00 . A A . 6 SER CB 1 1
18 3946 1 1 6 SER H H 5.757 -2.976 -1.080 1.00 . A A . 6 SER H 1 1
18 3947 1 1 6 SER HA H 8.375 -2.108 -0.334 1.00 . A A . 6 SER HA 1 1
18 3948 1 1 6 SER HB2 H 6.954 -2.049 -3.000 1.00 . A A . 6 SER HB2 1 1
18 3949 1 1 6 SER HB3 H 8.683 -1.806 -2.744 1.00 . A A . 6 SER HB3 1 1
18 3950 1 1 6 SER HG H 7.792 -3.950 -3.354 1.00 . A A . 6 SER HG 1 1
18 3951 1 1 6 SER N N 6.388 -2.592 -0.433 1.00 . A A . 6 SER N 1 1
18 3952 1 1 6 SER O O 6.106 0.081 -0.875 1.00 . A A . 6 SER O 1 1
18 3953 1 1 6 SER OG O 8.006 -3.715 -2.441 1.00 . A A . 6 SER OG 1 1
18 3954 1 1 7 LYS C C 7.948 2.442 -2.106 1.00 . A A . 7 LYS C 1 1
18 3955 1 1 7 LYS CA C 8.245 1.838 -0.739 1.00 . A A . 7 LYS CA 1 1
18 3956 1 1 7 LYS CB C 9.541 2.408 -0.157 1.00 . A A . 7 LYS CB 1 1
18 3957 1 1 7 LYS CD C 11.171 2.447 1.788 1.00 . A A . 7 LYS CD 1 1
18 3958 1 1 7 LYS CE C 12.374 1.953 0.988 1.00 . A A . 7 LYS CE 1 1
18 3959 1 1 7 LYS CG C 9.851 1.905 1.250 1.00 . A A . 7 LYS CG 1 1
18 3960 1 1 7 LYS H H 9.213 -0.020 -0.903 1.00 . A A . 7 LYS H 1 1
18 3961 1 1 7 LYS HA H 7.428 2.068 -0.072 1.00 . A A . 7 LYS HA 1 1
18 3962 1 1 7 LYS HB2 H 10.355 2.128 -0.808 1.00 . A A . 7 LYS HB2 1 1
18 3963 1 1 7 LYS HB3 H 9.468 3.485 -0.128 1.00 . A A . 7 LYS HB3 1 1
18 3964 1 1 7 LYS HD2 H 11.147 3.527 1.745 1.00 . A A . 7 LYS HD2 1 1
18 3965 1 1 7 LYS HD3 H 11.278 2.134 2.815 1.00 . A A . 7 LYS HD3 1 1
18 3966 1 1 7 LYS HE2 H 12.401 0.875 1.019 1.00 . A A . 7 LYS HE2 1 1
18 3967 1 1 7 LYS HE3 H 12.268 2.276 -0.036 1.00 . A A . 7 LYS HE3 1 1
18 3968 1 1 7 LYS HG2 H 9.056 2.215 1.912 1.00 . A A . 7 LYS HG2 1 1
18 3969 1 1 7 LYS HG3 H 9.892 0.827 1.228 1.00 . A A . 7 LYS HG3 1 1
18 3970 1 1 7 LYS HZ1 H 14.459 2.093 1.001 1.00 . A A . 7 LYS HZ1 1 1
18 3971 1 1 7 LYS HZ2 H 13.763 2.237 2.530 1.00 . A A . 7 LYS HZ2 1 1
18 3972 1 1 7 LYS HZ3 H 13.667 3.519 1.441 1.00 . A A . 7 LYS HZ3 1 1
18 3973 1 1 7 LYS N N 8.328 0.403 -0.838 1.00 . A A . 7 LYS N 1 1
18 3974 1 1 7 LYS NZ N 13.650 2.483 1.525 1.00 . A A . 7 LYS NZ 1 1
18 3975 1 1 7 LYS O O 8.558 2.038 -3.105 1.00 . A A . 7 LYS O 1 1
18 3976 1 1 8 PRO C C 5.243 3.098 -0.463 1.00 . A A . 8 PRO C 1 1
18 3977 1 1 8 PRO CA C 6.345 4.016 -1.025 1.00 . A A . 8 PRO CA 1 1
18 3978 1 1 8 PRO CB C 5.712 5.285 -1.610 1.00 . A A . 8 PRO CB 1 1
18 3979 1 1 8 PRO CD C 6.587 4.058 -3.452 1.00 . A A . 8 PRO CD 1 1
18 3980 1 1 8 PRO CG C 5.456 4.950 -3.032 1.00 . A A . 8 PRO CG 1 1
18 3981 1 1 8 PRO HA H 7.047 4.290 -0.253 1.00 . A A . 8 PRO HA 1 1
18 3982 1 1 8 PRO HB2 H 4.794 5.507 -1.086 1.00 . A A . 8 PRO HB2 1 1
18 3983 1 1 8 PRO HB3 H 6.398 6.114 -1.519 1.00 . A A . 8 PRO HB3 1 1
18 3984 1 1 8 PRO HD2 H 6.228 3.308 -4.138 1.00 . A A . 8 PRO HD2 1 1
18 3985 1 1 8 PRO HD3 H 7.380 4.635 -3.902 1.00 . A A . 8 PRO HD3 1 1
18 3986 1 1 8 PRO HG2 H 4.515 4.426 -3.114 1.00 . A A . 8 PRO HG2 1 1
18 3987 1 1 8 PRO HG3 H 5.437 5.847 -3.632 1.00 . A A . 8 PRO HG3 1 1
18 3988 1 1 8 PRO N N 7.037 3.433 -2.189 1.00 . A A . 8 PRO N 1 1
18 3989 1 1 8 PRO O O 4.370 2.629 -1.210 1.00 . A A . 8 PRO O 1 1
18 3990 1 1 9 PRO C C 2.997 2.806 1.697 1.00 . A A . 9 PRO C 1 1
18 3991 1 1 9 PRO CA C 4.249 1.988 1.455 1.00 . A A . 9 PRO CA 1 1
18 3992 1 1 9 PRO CB C 4.868 1.527 2.787 1.00 . A A . 9 PRO CB 1 1
18 3993 1 1 9 PRO CD C 6.228 3.269 1.847 1.00 . A A . 9 PRO CD 1 1
18 3994 1 1 9 PRO CG C 6.236 2.140 2.830 1.00 . A A . 9 PRO CG 1 1
18 3995 1 1 9 PRO HA H 4.010 1.135 0.834 1.00 . A A . 9 PRO HA 1 1
18 3996 1 1 9 PRO HB2 H 4.255 1.874 3.606 1.00 . A A . 9 PRO HB2 1 1
18 3997 1 1 9 PRO HB3 H 4.921 0.449 2.804 1.00 . A A . 9 PRO HB3 1 1
18 3998 1 1 9 PRO HD2 H 5.902 4.179 2.331 1.00 . A A . 9 PRO HD2 1 1
18 3999 1 1 9 PRO HD3 H 7.212 3.390 1.426 1.00 . A A . 9 PRO HD3 1 1
18 4000 1 1 9 PRO HG2 H 6.448 2.509 3.821 1.00 . A A . 9 PRO HG2 1 1
18 4001 1 1 9 PRO HG3 H 6.973 1.405 2.542 1.00 . A A . 9 PRO HG3 1 1
18 4002 1 1 9 PRO N N 5.258 2.811 0.850 1.00 . A A . 9 PRO N 1 1
18 4003 1 1 9 PRO O O 2.859 3.493 2.715 1.00 . A A . 9 PRO O 1 1
18 4004 1 1 10 ILE C C -0.188 2.573 0.954 1.00 . A A . 10 ILE C 1 1
18 4005 1 1 10 ILE CA C 0.937 3.567 0.808 1.00 . A A . 10 ILE CA 1 1
18 4006 1 1 10 ILE CB C 0.718 4.523 -0.417 1.00 . A A . 10 ILE CB 1 1
18 4007 1 1 10 ILE CD1 C -0.852 6.316 -1.388 1.00 . A A . 10 ILE CD1 1 1
18 4008 1 1 10 ILE CG1 C -0.599 5.316 -0.279 1.00 . A A . 10 ILE CG1 1 1
18 4009 1 1 10 ILE CG2 C 0.777 3.764 -1.744 1.00 . A A . 10 ILE CG2 1 1
18 4010 1 1 10 ILE H H 2.389 2.385 -0.123 1.00 . A A . 10 ILE H 1 1
18 4011 1 1 10 ILE HA H 0.984 4.160 1.711 1.00 . A A . 10 ILE HA 1 1
18 4012 1 1 10 ILE HB H 1.544 5.218 -0.421 1.00 . A A . 10 ILE HB 1 1
18 4013 1 1 10 ILE HD11 H -0.892 5.798 -2.336 1.00 . A A . 10 ILE HD11 1 1
18 4014 1 1 10 ILE HD12 H -0.053 7.042 -1.407 1.00 . A A . 10 ILE HD12 1 1
18 4015 1 1 10 ILE HD13 H -1.792 6.819 -1.212 1.00 . A A . 10 ILE HD13 1 1
18 4016 1 1 10 ILE HG12 H -1.426 4.621 -0.273 1.00 . A A . 10 ILE HG12 1 1
18 4017 1 1 10 ILE HG13 H -0.586 5.852 0.658 1.00 . A A . 10 ILE HG13 1 1
18 4018 1 1 10 ILE HG21 H 0.620 4.451 -2.562 1.00 . A A . 10 ILE HG21 1 1
18 4019 1 1 10 ILE HG22 H 0.009 3.004 -1.758 1.00 . A A . 10 ILE HG22 1 1
18 4020 1 1 10 ILE HG23 H 1.745 3.296 -1.849 1.00 . A A . 10 ILE HG23 1 1
18 4021 1 1 10 ILE N N 2.164 2.852 0.712 1.00 . A A . 10 ILE N 1 1
18 4022 1 1 10 ILE O O -0.146 1.480 0.374 1.00 . A A . 10 ILE O 1 1
18 4023 1 1 11 ALA C C -3.487 2.756 1.560 1.00 . A A . 11 ALA C 1 1
18 4024 1 1 11 ALA CA C -2.246 2.024 1.972 1.00 . A A . 11 ALA CA 1 1
18 4025 1 1 11 ALA CB C -2.380 1.518 3.433 1.00 . A A . 11 ALA CB 1 1
18 4026 1 1 11 ALA H H -1.110 3.729 2.285 1.00 . A A . 11 ALA H 1 1
18 4027 1 1 11 ALA HA H -2.115 1.177 1.314 1.00 . A A . 11 ALA HA 1 1
18 4028 1 1 11 ALA HB1 H -3.203 0.822 3.484 1.00 . A A . 11 ALA HB1 1 1
18 4029 1 1 11 ALA HB2 H -2.605 2.360 4.069 1.00 . A A . 11 ALA HB2 1 1
18 4030 1 1 11 ALA N N -1.132 2.887 1.783 1.00 . A A . 11 ALA N 1 1
18 4031 1 1 11 ALA O O -3.581 3.978 1.711 1.00 . A A . 11 ALA O 1 1
18 4032 1 1 12 PHE C C -6.711 2.010 1.518 1.00 . A A . 12 PHE C 1 1
18 4033 1 1 12 PHE CA C -5.648 2.551 0.595 1.00 . A A . 12 PHE CA 1 1
18 4034 1 1 12 PHE CB C -5.948 2.143 -0.863 1.00 . A A . 12 PHE CB 1 1
18 4035 1 1 12 PHE CD1 C -3.766 2.464 -2.112 1.00 . A A . 12 PHE CD1 1 1
18 4036 1 1 12 PHE CD2 C -5.625 3.840 -2.689 1.00 . A A . 12 PHE CD2 1 1
18 4037 1 1 12 PHE CE1 C -3.000 3.099 -3.073 1.00 . A A . 12 PHE CE1 1 1
18 4038 1 1 12 PHE CE2 C -4.865 4.472 -3.649 1.00 . A A . 12 PHE CE2 1 1
18 4039 1 1 12 PHE CG C -5.091 2.830 -1.906 1.00 . A A . 12 PHE CG 1 1
18 4040 1 1 12 PHE CZ C -3.551 4.103 -3.841 1.00 . A A . 12 PHE CZ 1 1
18 4041 1 1 12 PHE H H -4.220 1.073 0.922 1.00 . A A . 12 PHE H 1 1
18 4042 1 1 12 PHE HA H -5.610 3.627 0.665 1.00 . A A . 12 PHE HA 1 1
18 4043 1 1 12 PHE HB2 H -5.798 1.079 -0.966 1.00 . A A . 12 PHE HB2 1 1
18 4044 1 1 12 PHE HB3 H -6.982 2.369 -1.076 1.00 . A A . 12 PHE HB3 1 1
18 4045 1 1 12 PHE HD1 H -3.333 1.679 -1.508 1.00 . A A . 12 PHE HD1 1 1
18 4046 1 1 12 PHE HD2 H -6.654 4.134 -2.546 1.00 . A A . 12 PHE HD2 1 1
18 4047 1 1 12 PHE HE1 H -1.968 2.818 -3.229 1.00 . A A . 12 PHE HE1 1 1
18 4048 1 1 12 PHE HE2 H -5.300 5.260 -4.248 1.00 . A A . 12 PHE HE2 1 1
18 4049 1 1 12 PHE HZ H -2.957 4.602 -4.592 1.00 . A A . 12 PHE HZ 1 1
18 4050 1 1 12 PHE N N -4.393 2.037 1.020 1.00 . A A . 12 PHE N 1 1
18 4051 1 1 12 PHE O O -6.743 0.794 1.780 1.00 . A A . 12 PHE O 1 1
18 4052 1 1 13 PRO C C -9.744 1.577 2.280 1.00 . A A . 13 PRO C 1 1
18 4053 1 1 13 PRO CA C -8.701 2.488 2.953 1.00 . A A . 13 PRO CA 1 1
18 4054 1 1 13 PRO CB C -9.334 3.830 3.350 1.00 . A A . 13 PRO CB 1 1
18 4055 1 1 13 PRO CD C -7.610 4.338 1.779 1.00 . A A . 13 PRO CD 1 1
18 4056 1 1 13 PRO CG C -8.966 4.763 2.248 1.00 . A A . 13 PRO CG 1 1
18 4057 1 1 13 PRO HA H -8.313 1.991 3.829 1.00 . A A . 13 PRO HA 1 1
18 4058 1 1 13 PRO HB2 H -10.404 3.712 3.434 1.00 . A A . 13 PRO HB2 1 1
18 4059 1 1 13 PRO HB3 H -8.927 4.159 4.295 1.00 . A A . 13 PRO HB3 1 1
18 4060 1 1 13 PRO HD2 H -7.502 4.543 0.725 1.00 . A A . 13 PRO HD2 1 1
18 4061 1 1 13 PRO HD3 H -6.836 4.831 2.347 1.00 . A A . 13 PRO HD3 1 1
18 4062 1 1 13 PRO HG2 H -9.681 4.673 1.443 1.00 . A A . 13 PRO HG2 1 1
18 4063 1 1 13 PRO HG3 H -8.936 5.777 2.615 1.00 . A A . 13 PRO HG3 1 1
18 4064 1 1 13 PRO N N -7.604 2.882 2.032 1.00 . A A . 13 PRO N 1 1
18 4065 1 1 13 PRO O O -10.755 1.202 2.877 1.00 . A A . 13 PRO O 1 1
18 4066 1 1 14 ASP C C -9.831 -1.094 0.474 1.00 . A A . 14 ASP C 1 1
18 4067 1 1 14 ASP CA C -10.322 0.326 0.267 1.00 . A A . 14 ASP CA 1 1
18 4068 1 1 14 ASP CB C -10.278 0.648 -1.231 1.00 . A A . 14 ASP CB 1 1
18 4069 1 1 14 ASP CG C -10.689 2.056 -1.559 1.00 . A A . 14 ASP CG 1 1
18 4070 1 1 14 ASP H H -8.684 1.621 0.620 1.00 . A A . 14 ASP H 1 1
18 4071 1 1 14 ASP HA H -11.337 0.414 0.626 1.00 . A A . 14 ASP HA 1 1
18 4072 1 1 14 ASP HB2 H -9.270 0.500 -1.586 1.00 . A A . 14 ASP HB2 1 1
18 4073 1 1 14 ASP HB3 H -10.934 -0.034 -1.751 1.00 . A A . 14 ASP HB3 1 1
18 4074 1 1 14 ASP N N -9.484 1.232 1.032 1.00 . A A . 14 ASP N 1 1
18 4075 1 1 14 ASP O O -10.370 -2.044 -0.102 1.00 . A A . 14 ASP O 1 1
18 4076 1 1 14 ASP OD1 O -9.865 2.807 -2.132 1.00 . A A . 14 ASP OD1 1 1
18 4077 1 1 14 ASP OD2 O -11.827 2.452 -1.240 1.00 . A A . 14 ASP OD2 1 1
18 4078 2 2 1 . C C -1.812 -1.552 3.970 1.00 . B A . 101 WMH C 1 1
18 4079 2 2 1 . C1 C -1.138 0.847 4.009 1.00 . B A . 101 WMH C1 1 1
18 4080 2 2 1 . C2 C -0.001 1.479 4.375 1.00 . B A . 101 WMH C2 1 1
18 4081 2 2 1 . H1 H -1.979 -2.106 4.883 1.00 . B A . 101 WMH H1 1 1
18 4082 2 2 1 . H2 H -2.752 -1.161 3.613 1.00 . B A . 101 WMH H2 1 1
18 4083 2 2 1 . H5 H 0.168 2.543 4.312 1.00 . B A . 101 WMH H5 1 1
18 4084 2 2 1 . N N -0.943 -0.474 4.235 1.00 . B A . 101 WMH N 1 1
18 4085 2 2 1 . N1 N 0.874 0.589 4.819 1.00 . B A . 101 WMH N1 1 1
18 4086 2 2 1 . N2 N 0.358 -0.589 4.759 1.00 . B A . 101 WMH N2 1 1
19 4087 1 1 1 GLY C C -6.891 -2.958 1.507 1.00 . A A . 1 GLY C 1 1
19 4088 1 1 1 GLY CA C -7.951 -2.388 2.399 1.00 . A A . 1 GLY CA 1 1
19 4089 1 1 1 GLY H1 H -8.057 -0.452 1.580 1.00 . A A . 1 GLY H1 1 1
19 4090 1 1 1 GLY HA2 H -7.506 -2.089 3.336 1.00 . A A . 1 GLY HA2 1 1
19 4091 1 1 1 GLY HA3 H -8.697 -3.148 2.587 1.00 . A A . 1 GLY HA3 1 1
19 4092 1 1 1 GLY N N -8.584 -1.254 1.793 1.00 . A A . 1 GLY N 1 1
19 4093 1 1 1 GLY O O -6.891 -4.146 1.206 1.00 . A A . 1 GLY O 1 1
19 4094 1 1 2 ARG C C -3.653 -1.775 0.550 1.00 . A A . 2 ARG C 1 1
19 4095 1 1 2 ARG CA C -4.913 -2.544 0.209 1.00 . A A . 2 ARG CA 1 1
19 4096 1 1 2 ARG CB C -5.287 -2.370 -1.277 1.00 . A A . 2 ARG CB 1 1
19 4097 1 1 2 ARG CD C -3.791 -4.240 -2.144 1.00 . A A . 2 ARG CD 1 1
19 4098 1 1 2 ARG CG C -4.200 -2.774 -2.276 1.00 . A A . 2 ARG CG 1 1
19 4099 1 1 2 ARG CZ C -4.897 -6.242 -3.160 1.00 . A A . 2 ARG CZ 1 1
19 4100 1 1 2 ARG H H -6.044 -1.168 1.323 1.00 . A A . 2 ARG H 1 1
19 4101 1 1 2 ARG HA H -4.742 -3.592 0.407 1.00 . A A . 2 ARG HA 1 1
19 4102 1 1 2 ARG HB2 H -6.165 -2.965 -1.485 1.00 . A A . 2 ARG HB2 1 1
19 4103 1 1 2 ARG HB3 H -5.529 -1.331 -1.446 1.00 . A A . 2 ARG HB3 1 1
19 4104 1 1 2 ARG HD2 H -3.021 -4.452 -2.869 1.00 . A A . 2 ARG HD2 1 1
19 4105 1 1 2 ARG HD3 H -3.391 -4.398 -1.154 1.00 . A A . 2 ARG HD3 1 1
19 4106 1 1 2 ARG HE H -5.723 -4.976 -1.830 1.00 . A A . 2 ARG HE 1 1
19 4107 1 1 2 ARG HG2 H -4.566 -2.609 -3.278 1.00 . A A . 2 ARG HG2 1 1
19 4108 1 1 2 ARG HG3 H -3.334 -2.152 -2.107 1.00 . A A . 2 ARG HG3 1 1
19 4109 1 1 2 ARG HH11 H -3.062 -5.884 -4.016 1.00 . A A . 2 ARG HH11 1 1
19 4110 1 1 2 ARG HH12 H -3.833 -7.280 -4.578 1.00 . A A . 2 ARG HH12 1 1
19 4111 1 1 2 ARG HH21 H -6.750 -6.863 -2.606 1.00 . A A . 2 ARG HH21 1 1
19 4112 1 1 2 ARG HH22 H -5.985 -7.862 -3.765 1.00 . A A . 2 ARG HH22 1 1
19 4113 1 1 2 ARG N N -5.993 -2.114 1.062 1.00 . A A . 2 ARG N 1 1
19 4114 1 1 2 ARG NE N -4.911 -5.163 -2.357 1.00 . A A . 2 ARG NE 1 1
19 4115 1 1 2 ARG NH1 N -3.863 -6.485 -3.966 1.00 . A A . 2 ARG NH1 1 1
19 4116 1 1 2 ARG NH2 N -5.945 -7.046 -3.180 1.00 . A A . 2 ARG NH2 1 1
19 4117 1 1 2 ARG O O -3.538 -0.602 0.244 1.00 . A A . 2 ARG O 1 1
19 4118 1 1 3 ALA C C -0.371 -2.449 0.776 1.00 . A A . 3 ALA C 1 1
19 4119 1 1 3 ALA CA C -1.484 -1.858 1.599 1.00 . A A . 3 ALA CA 1 1
19 4120 1 1 3 ALA CB C -1.228 -2.117 3.083 1.00 . A A . 3 ALA CB 1 1
19 4121 1 1 3 ALA H H -2.921 -3.364 1.464 1.00 . A A . 3 ALA H 1 1
19 4122 1 1 3 ALA HA H -1.523 -0.791 1.436 1.00 . A A . 3 ALA HA 1 1
19 4123 1 1 3 ALA HB1 H -0.163 -2.195 3.239 1.00 . A A . 3 ALA HB1 1 1
19 4124 1 1 3 ALA HB2 H -1.687 -3.056 3.349 1.00 . A A . 3 ALA HB2 1 1
19 4125 1 1 3 ALA N N -2.753 -2.430 1.210 1.00 . A A . 3 ALA N 1 1
19 4126 1 1 3 ALA O O -0.334 -3.663 0.545 1.00 . A A . 3 ALA O 1 1
19 4127 1 1 4 TYR C C 2.853 -2.142 0.396 1.00 . A A . 4 TYR C 1 1
19 4128 1 1 4 TYR CA C 1.632 -2.039 -0.463 1.00 . A A . 4 TYR CA 1 1
19 4129 1 1 4 TYR CB C 1.881 -1.112 -1.659 1.00 . A A . 4 TYR CB 1 1
19 4130 1 1 4 TYR CD1 C -0.418 -0.762 -2.633 1.00 . A A . 4 TYR CD1 1 1
19 4131 1 1 4 TYR CD2 C 1.174 -1.985 -3.903 1.00 . A A . 4 TYR CD2 1 1
19 4132 1 1 4 TYR CE1 C -1.351 -0.948 -3.619 1.00 . A A . 4 TYR CE1 1 1
19 4133 1 1 4 TYR CE2 C 0.249 -2.165 -4.897 1.00 . A A . 4 TYR CE2 1 1
19 4134 1 1 4 TYR CG C 0.861 -1.280 -2.754 1.00 . A A . 4 TYR CG 1 1
19 4135 1 1 4 TYR CZ C -1.013 -1.647 -4.748 1.00 . A A . 4 TYR CZ 1 1
19 4136 1 1 4 TYR H H 0.393 -0.644 0.482 1.00 . A A . 4 TYR H 1 1
19 4137 1 1 4 TYR HA H 1.402 -3.025 -0.839 1.00 . A A . 4 TYR HA 1 1
19 4138 1 1 4 TYR HB2 H 1.845 -0.086 -1.323 1.00 . A A . 4 TYR HB2 1 1
19 4139 1 1 4 TYR HB3 H 2.857 -1.320 -2.071 1.00 . A A . 4 TYR HB3 1 1
19 4140 1 1 4 TYR HD1 H -0.676 -0.209 -1.741 1.00 . A A . 4 TYR HD1 1 1
19 4141 1 1 4 TYR HD2 H 2.168 -2.392 -4.019 1.00 . A A . 4 TYR HD2 1 1
19 4142 1 1 4 TYR HE1 H -2.345 -0.538 -3.504 1.00 . A A . 4 TYR HE1 1 1
19 4143 1 1 4 TYR HE2 H 0.516 -2.716 -5.788 1.00 . A A . 4 TYR HE2 1 1
19 4144 1 1 4 TYR HH H -2.394 -1.015 -5.901 1.00 . A A . 4 TYR HH 1 1
19 4145 1 1 4 TYR N N 0.502 -1.608 0.312 1.00 . A A . 4 TYR N 1 1
19 4146 1 1 4 TYR O O 3.098 -1.291 1.256 1.00 . A A . 4 TYR O 1 1
19 4147 1 1 4 TYR OH O -1.945 -1.852 -5.721 1.00 . A A . 4 TYR OH 1 1
19 4148 1 1 5 LYS C C 6.024 -2.842 0.139 1.00 . A A . 5 LYS C 1 1
19 4149 1 1 5 LYS CA C 4.834 -3.428 0.894 1.00 . A A . 5 LYS CA 1 1
19 4150 1 1 5 LYS CB C 4.975 -4.935 1.159 1.00 . A A . 5 LYS CB 1 1
19 4151 1 1 5 LYS CD C 4.797 -7.305 0.292 1.00 . A A . 5 LYS CD 1 1
19 4152 1 1 5 LYS CE C 6.028 -7.752 1.042 1.00 . A A . 5 LYS CE 1 1
19 4153 1 1 5 LYS CG C 4.870 -5.825 -0.078 1.00 . A A . 5 LYS CG 1 1
19 4154 1 1 5 LYS H H 3.380 -3.809 -0.548 1.00 . A A . 5 LYS H 1 1
19 4155 1 1 5 LYS HA H 4.748 -2.910 1.839 1.00 . A A . 5 LYS HA 1 1
19 4156 1 1 5 LYS HB2 H 5.944 -5.101 1.605 1.00 . A A . 5 LYS HB2 1 1
19 4157 1 1 5 LYS HB3 H 4.211 -5.236 1.861 1.00 . A A . 5 LYS HB3 1 1
19 4158 1 1 5 LYS HD2 H 3.932 -7.466 0.917 1.00 . A A . 5 LYS HD2 1 1
19 4159 1 1 5 LYS HD3 H 4.698 -7.890 -0.611 1.00 . A A . 5 LYS HD3 1 1
19 4160 1 1 5 LYS HE2 H 6.886 -7.608 0.403 1.00 . A A . 5 LYS HE2 1 1
19 4161 1 1 5 LYS HE3 H 6.119 -7.129 1.918 1.00 . A A . 5 LYS HE3 1 1
19 4162 1 1 5 LYS HG2 H 3.970 -5.564 -0.611 1.00 . A A . 5 LYS HG2 1 1
19 4163 1 1 5 LYS HG3 H 5.731 -5.658 -0.708 1.00 . A A . 5 LYS HG3 1 1
19 4164 1 1 5 LYS HZ1 H 6.822 -9.417 1.972 1.00 . A A . 5 LYS HZ1 1 1
19 4165 1 1 5 LYS HZ2 H 5.869 -9.802 0.637 1.00 . A A . 5 LYS HZ2 1 1
19 4166 1 1 5 LYS HZ3 H 5.151 -9.315 2.094 1.00 . A A . 5 LYS HZ3 1 1
19 4167 1 1 5 LYS N N 3.621 -3.175 0.160 1.00 . A A . 5 LYS N 1 1
19 4168 1 1 5 LYS NZ N 5.958 -9.165 1.454 1.00 . A A . 5 LYS NZ 1 1
19 4169 1 1 5 LYS O O 7.191 -3.096 0.457 1.00 . A A . 5 LYS O 1 1
19 4170 1 1 6 SER C C 7.172 -0.106 -0.844 1.00 . A A . 6 SER C 1 1
19 4171 1 1 6 SER CA C 6.630 -1.301 -1.642 1.00 . A A . 6 SER CA 1 1
19 4172 1 1 6 SER CB C 5.909 -0.807 -2.884 1.00 . A A . 6 SER CB 1 1
19 4173 1 1 6 SER H H 4.744 -1.925 -1.038 1.00 . A A . 6 SER H 1 1
19 4174 1 1 6 SER HA H 7.436 -1.955 -1.937 1.00 . A A . 6 SER HA 1 1
19 4175 1 1 6 SER HB2 H 5.121 -0.130 -2.591 1.00 . A A . 6 SER HB2 1 1
19 4176 1 1 6 SER HB3 H 6.606 -0.290 -3.525 1.00 . A A . 6 SER HB3 1 1
19 4177 1 1 6 SER HG H 5.509 -1.682 -4.531 1.00 . A A . 6 SER HG 1 1
19 4178 1 1 6 SER N N 5.695 -2.037 -0.838 1.00 . A A . 6 SER N 1 1
19 4179 1 1 6 SER O O 6.715 0.161 0.267 1.00 . A A . 6 SER O 1 1
19 4180 1 1 6 SER OG O 5.339 -1.891 -3.603 1.00 . A A . 6 SER OG 1 1
19 4181 1 1 7 LYS C C 8.339 2.974 -1.550 1.00 . A A . 7 LYS C 1 1
19 4182 1 1 7 LYS CA C 8.732 1.725 -0.752 1.00 . A A . 7 LYS CA 1 1
19 4183 1 1 7 LYS CB C 10.261 1.587 -0.685 1.00 . A A . 7 LYS CB 1 1
19 4184 1 1 7 LYS CD C 12.487 2.610 -0.062 1.00 . A A . 7 LYS CD 1 1
19 4185 1 1 7 LYS CE C 12.844 1.670 1.086 1.00 . A A . 7 LYS CE 1 1
19 4186 1 1 7 LYS CG C 10.983 2.828 -0.186 1.00 . A A . 7 LYS CG 1 1
19 4187 1 1 7 LYS H H 8.544 0.252 -2.226 1.00 . A A . 7 LYS H 1 1
19 4188 1 1 7 LYS HA H 8.339 1.779 0.252 1.00 . A A . 7 LYS HA 1 1
19 4189 1 1 7 LYS HB2 H 10.498 0.765 -0.028 1.00 . A A . 7 LYS HB2 1 1
19 4190 1 1 7 LYS HB3 H 10.627 1.356 -1.676 1.00 . A A . 7 LYS HB3 1 1
19 4191 1 1 7 LYS HD2 H 12.857 2.185 -0.982 1.00 . A A . 7 LYS HD2 1 1
19 4192 1 1 7 LYS HD3 H 12.960 3.567 0.107 1.00 . A A . 7 LYS HD3 1 1
19 4193 1 1 7 LYS HE2 H 12.329 0.732 0.947 1.00 . A A . 7 LYS HE2 1 1
19 4194 1 1 7 LYS HE3 H 13.909 1.495 1.070 1.00 . A A . 7 LYS HE3 1 1
19 4195 1 1 7 LYS HG2 H 10.798 3.642 -0.871 1.00 . A A . 7 LYS HG2 1 1
19 4196 1 1 7 LYS HG3 H 10.580 3.073 0.783 1.00 . A A . 7 LYS HG3 1 1
19 4197 1 1 7 LYS HZ1 H 12.934 3.147 2.580 1.00 . A A . 7 LYS HZ1 1 1
19 4198 1 1 7 LYS HZ2 H 12.744 1.593 3.173 1.00 . A A . 7 LYS HZ2 1 1
19 4199 1 1 7 LYS HZ3 H 11.436 2.375 2.474 1.00 . A A . 7 LYS HZ3 1 1
19 4200 1 1 7 LYS N N 8.165 0.554 -1.373 1.00 . A A . 7 LYS N 1 1
19 4201 1 1 7 LYS NZ N 12.467 2.237 2.404 1.00 . A A . 7 LYS NZ 1 1
19 4202 1 1 7 LYS O O 8.659 3.067 -2.735 1.00 . A A . 7 LYS O 1 1
19 4203 1 1 8 PRO C C 5.775 3.054 0.476 1.00 . A A . 8 PRO C 1 1
19 4204 1 1 8 PRO CA C 7.092 3.848 0.419 1.00 . A A . 8 PRO CA 1 1
19 4205 1 1 8 PRO CB C 6.827 5.319 0.756 1.00 . A A . 8 PRO CB 1 1
19 4206 1 1 8 PRO CD C 7.221 5.205 -1.599 1.00 . A A . 8 PRO CD 1 1
19 4207 1 1 8 PRO CG C 6.438 5.931 -0.540 1.00 . A A . 8 PRO CG 1 1
19 4208 1 1 8 PRO HA H 7.812 3.434 1.110 1.00 . A A . 8 PRO HA 1 1
19 4209 1 1 8 PRO HB2 H 6.033 5.386 1.485 1.00 . A A . 8 PRO HB2 1 1
19 4210 1 1 8 PRO HB3 H 7.725 5.768 1.150 1.00 . A A . 8 PRO HB3 1 1
19 4211 1 1 8 PRO HD2 H 6.611 5.023 -2.472 1.00 . A A . 8 PRO HD2 1 1
19 4212 1 1 8 PRO HD3 H 8.100 5.772 -1.866 1.00 . A A . 8 PRO HD3 1 1
19 4213 1 1 8 PRO HG2 H 5.379 5.797 -0.704 1.00 . A A . 8 PRO HG2 1 1
19 4214 1 1 8 PRO HG3 H 6.686 6.982 -0.545 1.00 . A A . 8 PRO HG3 1 1
19 4215 1 1 8 PRO N N 7.605 3.930 -0.957 1.00 . A A . 8 PRO N 1 1
19 4216 1 1 8 PRO O O 5.108 2.875 -0.558 1.00 . A A . 8 PRO O 1 1
19 4217 1 1 9 PRO C C 2.939 2.695 1.615 1.00 . A A . 9 PRO C 1 1
19 4218 1 1 9 PRO CA C 4.161 1.792 1.798 1.00 . A A . 9 PRO CA 1 1
19 4219 1 1 9 PRO CB C 4.221 1.225 3.225 1.00 . A A . 9 PRO CB 1 1
19 4220 1 1 9 PRO CD C 6.166 2.592 2.913 1.00 . A A . 9 PRO CD 1 1
19 4221 1 1 9 PRO CG C 5.202 2.083 3.948 1.00 . A A . 9 PRO CG 1 1
19 4222 1 1 9 PRO HA H 4.107 0.986 1.082 1.00 . A A . 9 PRO HA 1 1
19 4223 1 1 9 PRO HB2 H 3.241 1.282 3.675 1.00 . A A . 9 PRO HB2 1 1
19 4224 1 1 9 PRO HB3 H 4.548 0.196 3.192 1.00 . A A . 9 PRO HB3 1 1
19 4225 1 1 9 PRO HD2 H 6.449 3.611 3.134 1.00 . A A . 9 PRO HD2 1 1
19 4226 1 1 9 PRO HD3 H 7.038 1.957 2.861 1.00 . A A . 9 PRO HD3 1 1
19 4227 1 1 9 PRO HG2 H 4.689 2.909 4.415 1.00 . A A . 9 PRO HG2 1 1
19 4228 1 1 9 PRO HG3 H 5.722 1.499 4.692 1.00 . A A . 9 PRO HG3 1 1
19 4229 1 1 9 PRO N N 5.399 2.534 1.651 1.00 . A A . 9 PRO N 1 1
19 4230 1 1 9 PRO O O 2.638 3.545 2.462 1.00 . A A . 9 PRO O 1 1
19 4231 1 1 10 ILE C C -0.083 2.379 0.387 1.00 . A A . 10 ILE C 1 1
19 4232 1 1 10 ILE CA C 1.105 3.313 0.186 1.00 . A A . 10 ILE CA 1 1
19 4233 1 1 10 ILE CB C 1.119 3.916 -1.267 1.00 . A A . 10 ILE CB 1 1
19 4234 1 1 10 ILE CD1 C -0.357 5.937 -0.682 1.00 . A A . 10 ILE CD1 1 1
19 4235 1 1 10 ILE CG1 C -0.164 4.716 -1.566 1.00 . A A . 10 ILE CG1 1 1
19 4236 1 1 10 ILE CG2 C 1.350 2.843 -2.331 1.00 . A A . 10 ILE CG2 1 1
19 4237 1 1 10 ILE H H 2.674 1.965 -0.199 1.00 . A A . 10 ILE H 1 1
19 4238 1 1 10 ILE HA H 1.037 4.113 0.908 1.00 . A A . 10 ILE HA 1 1
19 4239 1 1 10 ILE HB H 1.962 4.589 -1.315 1.00 . A A . 10 ILE HB 1 1
19 4240 1 1 10 ILE HD11 H 0.474 6.613 -0.811 1.00 . A A . 10 ILE HD11 1 1
19 4241 1 1 10 ILE HD12 H -0.417 5.631 0.352 1.00 . A A . 10 ILE HD12 1 1
19 4242 1 1 10 ILE HD13 H -1.274 6.437 -0.960 1.00 . A A . 10 ILE HD13 1 1
19 4243 1 1 10 ILE HG12 H -0.137 5.054 -2.590 1.00 . A A . 10 ILE HG12 1 1
19 4244 1 1 10 ILE HG13 H -1.017 4.069 -1.431 1.00 . A A . 10 ILE HG13 1 1
19 4245 1 1 10 ILE HG21 H 2.303 2.365 -2.160 1.00 . A A . 10 ILE HG21 1 1
19 4246 1 1 10 ILE HG22 H 1.343 3.299 -3.310 1.00 . A A . 10 ILE HG22 1 1
19 4247 1 1 10 ILE HG23 H 0.562 2.106 -2.270 1.00 . A A . 10 ILE HG23 1 1
19 4248 1 1 10 ILE N N 2.310 2.577 0.476 1.00 . A A . 10 ILE N 1 1
19 4249 1 1 10 ILE O O -0.007 1.184 0.056 1.00 . A A . 10 ILE O 1 1
19 4250 1 1 11 ALA C C -3.519 2.728 0.723 1.00 . A A . 11 ALA C 1 1
19 4251 1 1 11 ALA CA C -2.278 2.051 1.249 1.00 . A A . 11 ALA CA 1 1
19 4252 1 1 11 ALA CB C -2.463 1.776 2.767 1.00 . A A . 11 ALA CB 1 1
19 4253 1 1 11 ALA H H -1.180 3.816 1.259 1.00 . A A . 11 ALA H 1 1
19 4254 1 1 11 ALA HA H -2.143 1.109 0.738 1.00 . A A . 11 ALA HA 1 1
19 4255 1 1 11 ALA HB1 H -3.232 1.028 2.881 1.00 . A A . 11 ALA HB1 1 1
19 4256 1 1 11 ALA HB2 H -2.805 2.686 3.234 1.00 . A A . 11 ALA HB2 1 1
19 4257 1 1 11 ALA N N -1.140 2.875 0.981 1.00 . A A . 11 ALA N 1 1
19 4258 1 1 11 ALA O O -3.576 3.956 0.623 1.00 . A A . 11 ALA O 1 1
19 4259 1 1 12 PHE C C -6.743 2.036 1.022 1.00 . A A . 12 PHE C 1 1
19 4260 1 1 12 PHE CA C -5.760 2.392 -0.073 1.00 . A A . 12 PHE CA 1 1
19 4261 1 1 12 PHE CB C -6.178 1.736 -1.396 1.00 . A A . 12 PHE CB 1 1
19 4262 1 1 12 PHE CD1 C -5.758 3.171 -3.406 1.00 . A A . 12 PHE CD1 1 1
19 4263 1 1 12 PHE CD2 C -4.144 1.508 -2.865 1.00 . A A . 12 PHE CD2 1 1
19 4264 1 1 12 PHE CE1 C -5.003 3.552 -4.494 1.00 . A A . 12 PHE CE1 1 1
19 4265 1 1 12 PHE CE2 C -3.384 1.890 -3.955 1.00 . A A . 12 PHE CE2 1 1
19 4266 1 1 12 PHE CG C -5.341 2.143 -2.580 1.00 . A A . 12 PHE CG 1 1
19 4267 1 1 12 PHE CZ C -3.815 2.913 -4.767 1.00 . A A . 12 PHE CZ 1 1
19 4268 1 1 12 PHE H H -4.279 0.971 0.361 1.00 . A A . 12 PHE H 1 1
19 4269 1 1 12 PHE HA H -5.719 3.465 -0.190 1.00 . A A . 12 PHE HA 1 1
19 4270 1 1 12 PHE HB2 H -6.099 0.664 -1.292 1.00 . A A . 12 PHE HB2 1 1
19 4271 1 1 12 PHE HB3 H -7.204 1.994 -1.606 1.00 . A A . 12 PHE HB3 1 1
19 4272 1 1 12 PHE HD1 H -6.688 3.678 -3.199 1.00 . A A . 12 PHE HD1 1 1
19 4273 1 1 12 PHE HD2 H -3.808 0.705 -2.225 1.00 . A A . 12 PHE HD2 1 1
19 4274 1 1 12 PHE HE1 H -5.343 4.357 -5.130 1.00 . A A . 12 PHE HE1 1 1
19 4275 1 1 12 PHE HE2 H -2.449 1.396 -4.177 1.00 . A A . 12 PHE HE2 1 1
19 4276 1 1 12 PHE HZ H -3.223 3.209 -5.620 1.00 . A A . 12 PHE HZ 1 1
19 4277 1 1 12 PHE N N -4.465 1.938 0.348 1.00 . A A . 12 PHE N 1 1
19 4278 1 1 12 PHE O O -6.730 0.890 1.502 1.00 . A A . 12 PHE O 1 1
19 4279 1 1 13 PRO C C -9.582 1.682 2.354 1.00 . A A . 13 PRO C 1 1
19 4280 1 1 13 PRO CA C -8.551 2.803 2.569 1.00 . A A . 13 PRO CA 1 1
19 4281 1 1 13 PRO CB C -9.236 4.161 2.704 1.00 . A A . 13 PRO CB 1 1
19 4282 1 1 13 PRO CD C -7.701 4.346 0.877 1.00 . A A . 13 PRO CD 1 1
19 4283 1 1 13 PRO CG C -9.008 4.848 1.400 1.00 . A A . 13 PRO CG 1 1
19 4284 1 1 13 PRO HA H -7.998 2.587 3.469 1.00 . A A . 13 PRO HA 1 1
19 4285 1 1 13 PRO HB2 H -10.287 4.009 2.900 1.00 . A A . 13 PRO HB2 1 1
19 4286 1 1 13 PRO HB3 H -8.791 4.709 3.521 1.00 . A A . 13 PRO HB3 1 1
19 4287 1 1 13 PRO HD2 H -7.720 4.312 -0.204 1.00 . A A . 13 PRO HD2 1 1
19 4288 1 1 13 PRO HD3 H -6.892 4.970 1.222 1.00 . A A . 13 PRO HD3 1 1
19 4289 1 1 13 PRO HG2 H -9.799 4.604 0.706 1.00 . A A . 13 PRO HG2 1 1
19 4290 1 1 13 PRO HG3 H -8.966 5.917 1.548 1.00 . A A . 13 PRO HG3 1 1
19 4291 1 1 13 PRO N N -7.600 2.989 1.444 1.00 . A A . 13 PRO N 1 1
19 4292 1 1 13 PRO O O -10.375 1.352 3.247 1.00 . A A . 13 PRO O 1 1
19 4293 1 1 14 ASP C C -9.864 -1.261 1.534 1.00 . A A . 14 ASP C 1 1
19 4294 1 1 14 ASP CA C -10.413 -0.022 0.866 1.00 . A A . 14 ASP CA 1 1
19 4295 1 1 14 ASP CB C -10.496 -0.247 -0.643 1.00 . A A . 14 ASP CB 1 1
19 4296 1 1 14 ASP CG C -11.235 0.848 -1.354 1.00 . A A . 14 ASP CG 1 1
19 4297 1 1 14 ASP H H -8.989 1.495 0.490 1.00 . A A . 14 ASP H 1 1
19 4298 1 1 14 ASP HA H -11.404 0.178 1.246 1.00 . A A . 14 ASP HA 1 1
19 4299 1 1 14 ASP HB2 H -9.494 -0.292 -1.044 1.00 . A A . 14 ASP HB2 1 1
19 4300 1 1 14 ASP HB3 H -10.995 -1.184 -0.837 1.00 . A A . 14 ASP HB3 1 1
19 4301 1 1 14 ASP N N -9.575 1.111 1.176 1.00 . A A . 14 ASP N 1 1
19 4302 1 1 14 ASP O O -10.600 -2.190 1.844 1.00 . A A . 14 ASP O 1 1
19 4303 1 1 14 ASP OD1 O -10.600 1.842 -1.761 1.00 . A A . 14 ASP OD1 1 1
19 4304 1 1 14 ASP OD2 O -12.466 0.738 -1.523 1.00 . A A . 14 ASP OD2 1 1
19 4305 2 2 1 . C C -1.772 -1.053 4.016 1.00 . B A . 101 WMH C 1 1
19 4306 2 2 1 . C1 C -1.218 1.321 3.533 1.00 . B A . 101 WMH C1 1 1
19 4307 2 2 1 . C2 C -0.145 2.090 3.813 1.00 . B A . 101 WMH C2 1 1
19 4308 2 2 1 . H1 H -1.844 -1.468 5.011 1.00 . B A . 101 WMH H1 1 1
19 4309 2 2 1 . H2 H -2.757 -0.767 3.682 1.00 . B A . 101 WMH H2 1 1
19 4310 2 2 1 . H5 H -0.031 3.125 3.528 1.00 . B A . 101 WMH H5 1 1
19 4311 2 2 1 . N N -0.966 0.100 4.053 1.00 . B A . 101 WMH N 1 1
19 4312 2 2 1 . N1 N 0.745 1.390 4.483 1.00 . B A . 101 WMH N1 1 1
19 4313 2 2 1 . N2 N 0.305 0.192 4.653 1.00 . B A . 101 WMH N2 1 1
20 4314 1 1 1 GLY C C -6.912 -2.959 1.086 1.00 . A A . 1 GLY C 1 1
20 4315 1 1 1 GLY CA C -7.940 -2.558 2.105 1.00 . A A . 1 GLY CA 1 1
20 4316 1 1 1 GLY H1 H -7.966 -0.504 1.641 1.00 . A A . 1 GLY H1 1 1
20 4317 1 1 1 GLY HA2 H -7.477 -2.499 3.077 1.00 . A A . 1 GLY HA2 1 1
20 4318 1 1 1 GLY HA3 H -8.716 -3.308 2.132 1.00 . A A . 1 GLY HA3 1 1
20 4319 1 1 1 GLY N N -8.537 -1.289 1.787 1.00 . A A . 1 GLY N 1 1
20 4320 1 1 1 GLY O O -6.853 -4.119 0.679 1.00 . A A . 1 GLY O 1 1
20 4321 1 1 2 ARG C C -3.758 -1.706 0.089 1.00 . A A . 2 ARG C 1 1
20 4322 1 1 2 ARG CA C -5.087 -2.279 -0.334 1.00 . A A . 2 ARG CA 1 1
20 4323 1 1 2 ARG CB C -5.475 -1.745 -1.720 1.00 . A A . 2 ARG CB 1 1
20 4324 1 1 2 ARG CD C -7.016 -1.790 -3.685 1.00 . A A . 2 ARG CD 1 1
20 4325 1 1 2 ARG CG C -6.665 -2.431 -2.358 1.00 . A A . 2 ARG CG 1 1
20 4326 1 1 2 ARG CZ C -8.928 -1.967 -5.271 1.00 . A A . 2 ARG CZ 1 1
20 4327 1 1 2 ARG H H -6.148 -1.111 1.059 1.00 . A A . 2 ARG H 1 1
20 4328 1 1 2 ARG HA H -4.983 -3.352 -0.396 1.00 . A A . 2 ARG HA 1 1
20 4329 1 1 2 ARG HB2 H -5.701 -0.696 -1.634 1.00 . A A . 2 ARG HB2 1 1
20 4330 1 1 2 ARG HB3 H -4.626 -1.860 -2.378 1.00 . A A . 2 ARG HB3 1 1
20 4331 1 1 2 ARG HD2 H -7.340 -0.776 -3.498 1.00 . A A . 2 ARG HD2 1 1
20 4332 1 1 2 ARG HD3 H -6.138 -1.773 -4.313 1.00 . A A . 2 ARG HD3 1 1
20 4333 1 1 2 ARG HE H -8.140 -3.468 -4.164 1.00 . A A . 2 ARG HE 1 1
20 4334 1 1 2 ARG HG2 H -6.425 -3.472 -2.521 1.00 . A A . 2 ARG HG2 1 1
20 4335 1 1 2 ARG HG3 H -7.513 -2.355 -1.693 1.00 . A A . 2 ARG HG3 1 1
20 4336 1 1 2 ARG HH11 H -8.243 -0.049 -5.069 1.00 . A A . 2 ARG HH11 1 1
20 4337 1 1 2 ARG HH12 H -9.506 -0.221 -6.180 1.00 . A A . 2 ARG HH12 1 1
20 4338 1 1 2 ARG HH21 H -9.865 -3.720 -5.739 1.00 . A A . 2 ARG HH21 1 1
20 4339 1 1 2 ARG HH22 H -10.460 -2.364 -6.567 1.00 . A A . 2 ARG HH22 1 1
20 4340 1 1 2 ARG N N -6.103 -2.011 0.661 1.00 . A A . 2 ARG N 1 1
20 4341 1 1 2 ARG NE N -8.088 -2.508 -4.379 1.00 . A A . 2 ARG NE 1 1
20 4342 1 1 2 ARG NH1 N -8.891 -0.664 -5.522 1.00 . A A . 2 ARG NH1 1 1
20 4343 1 1 2 ARG NH2 N -9.805 -2.732 -5.901 1.00 . A A . 2 ARG NH2 1 1
20 4344 1 1 2 ARG O O -3.479 -0.528 -0.130 1.00 . A A . 2 ARG O 1 1
20 4345 1 1 3 ALA C C -0.629 -2.868 0.306 1.00 . A A . 3 ALA C 1 1
20 4346 1 1 3 ALA CA C -1.646 -2.170 1.146 1.00 . A A . 3 ALA CA 1 1
20 4347 1 1 3 ALA CB C -1.426 -2.492 2.623 1.00 . A A . 3 ALA CB 1 1
20 4348 1 1 3 ALA H H -3.293 -3.433 0.909 1.00 . A A . 3 ALA H 1 1
20 4349 1 1 3 ALA HA H -1.531 -1.106 1.006 1.00 . A A . 3 ALA HA 1 1
20 4350 1 1 3 ALA HB1 H -0.394 -2.777 2.764 1.00 . A A . 3 ALA HB1 1 1
20 4351 1 1 3 ALA HB2 H -2.060 -3.325 2.886 1.00 . A A . 3 ALA HB2 1 1
20 4352 1 1 3 ALA N N -2.977 -2.522 0.720 1.00 . A A . 3 ALA N 1 1
20 4353 1 1 3 ALA O O -0.790 -4.046 -0.039 1.00 . A A . 3 ALA O 1 1
20 4354 1 1 4 TYR C C 2.697 -2.613 -0.019 1.00 . A A . 4 TYR C 1 1
20 4355 1 1 4 TYR CA C 1.449 -2.667 -0.852 1.00 . A A . 4 TYR CA 1 1
20 4356 1 1 4 TYR CB C 1.609 -1.838 -2.138 1.00 . A A . 4 TYR CB 1 1
20 4357 1 1 4 TYR CD1 C -0.489 -0.573 -2.715 1.00 . A A . 4 TYR CD1 1 1
20 4358 1 1 4 TYR CD2 C -0.143 -2.674 -3.756 1.00 . A A . 4 TYR CD2 1 1
20 4359 1 1 4 TYR CE1 C -1.687 -0.439 -3.354 1.00 . A A . 4 TYR CE1 1 1
20 4360 1 1 4 TYR CE2 C -1.348 -2.543 -4.414 1.00 . A A . 4 TYR CE2 1 1
20 4361 1 1 4 TYR CG C 0.307 -1.688 -2.898 1.00 . A A . 4 TYR CG 1 1
20 4362 1 1 4 TYR CZ C -2.117 -1.423 -4.205 1.00 . A A . 4 TYR CZ 1 1
20 4363 1 1 4 TYR H H 0.421 -1.195 0.196 1.00 . A A . 4 TYR H 1 1
20 4364 1 1 4 TYR HA H 1.221 -3.690 -1.108 1.00 . A A . 4 TYR HA 1 1
20 4365 1 1 4 TYR HB2 H 1.963 -0.851 -1.879 1.00 . A A . 4 TYR HB2 1 1
20 4366 1 1 4 TYR HB3 H 2.324 -2.318 -2.787 1.00 . A A . 4 TYR HB3 1 1
20 4367 1 1 4 TYR HD1 H -0.151 0.206 -2.046 1.00 . A A . 4 TYR HD1 1 1
20 4368 1 1 4 TYR HD2 H 0.463 -3.553 -3.916 1.00 . A A . 4 TYR HD2 1 1
20 4369 1 1 4 TYR HE1 H -2.273 0.450 -3.178 1.00 . A A . 4 TYR HE1 1 1
20 4370 1 1 4 TYR HE2 H -1.680 -3.320 -5.085 1.00 . A A . 4 TYR HE2 1 1
20 4371 1 1 4 TYR HH H -3.360 -0.453 -5.297 1.00 . A A . 4 TYR HH 1 1
20 4372 1 1 4 TYR N N 0.378 -2.142 -0.063 1.00 . A A . 4 TYR N 1 1
20 4373 1 1 4 TYR O O 3.045 -1.550 0.531 1.00 . A A . 4 TYR O 1 1
20 4374 1 1 4 TYR OH O -3.328 -1.300 -4.838 1.00 . A A . 4 TYR OH 1 1
20 4375 1 1 5 LYS C C 5.784 -3.333 0.163 1.00 . A A . 5 LYS C 1 1
20 4376 1 1 5 LYS CA C 4.537 -3.805 0.933 1.00 . A A . 5 LYS CA 1 1
20 4377 1 1 5 LYS CB C 4.696 -5.202 1.591 1.00 . A A . 5 LYS CB 1 1
20 4378 1 1 5 LYS CD C 4.893 -7.723 1.324 1.00 . A A . 5 LYS CD 1 1
20 4379 1 1 5 LYS CE C 3.481 -8.318 1.497 1.00 . A A . 5 LYS CE 1 1
20 4380 1 1 5 LYS CG C 4.899 -6.368 0.623 1.00 . A A . 5 LYS CG 1 1
20 4381 1 1 5 LYS H H 3.052 -4.526 -0.377 1.00 . A A . 5 LYS H 1 1
20 4382 1 1 5 LYS HA H 4.377 -3.073 1.711 1.00 . A A . 5 LYS HA 1 1
20 4383 1 1 5 LYS HB2 H 5.550 -5.172 2.251 1.00 . A A . 5 LYS HB2 1 1
20 4384 1 1 5 LYS HB3 H 3.815 -5.401 2.182 1.00 . A A . 5 LYS HB3 1 1
20 4385 1 1 5 LYS HD2 H 5.484 -8.412 0.741 1.00 . A A . 5 LYS HD2 1 1
20 4386 1 1 5 LYS HD3 H 5.346 -7.602 2.296 1.00 . A A . 5 LYS HD3 1 1
20 4387 1 1 5 LYS HE2 H 3.058 -8.473 0.517 1.00 . A A . 5 LYS HE2 1 1
20 4388 1 1 5 LYS HE3 H 3.578 -9.278 1.985 1.00 . A A . 5 LYS HE3 1 1
20 4389 1 1 5 LYS HG2 H 4.118 -6.355 -0.121 1.00 . A A . 5 LYS HG2 1 1
20 4390 1 1 5 LYS HG3 H 5.853 -6.232 0.135 1.00 . A A . 5 LYS HG3 1 1
20 4391 1 1 5 LYS HZ1 H 1.647 -7.988 2.390 1.00 . A A . 5 LYS HZ1 1 1
20 4392 1 1 5 LYS HZ2 H 2.287 -6.601 1.764 1.00 . A A . 5 LYS HZ2 1 1
20 4393 1 1 5 LYS HZ3 H 2.895 -7.234 3.220 1.00 . A A . 5 LYS HZ3 1 1
20 4394 1 1 5 LYS N N 3.361 -3.733 0.112 1.00 . A A . 5 LYS N 1 1
20 4395 1 1 5 LYS NZ N 2.543 -7.473 2.270 1.00 . A A . 5 LYS NZ 1 1
20 4396 1 1 5 LYS O O 6.638 -4.114 -0.269 1.00 . A A . 5 LYS O 1 1
20 4397 1 1 6 SER C C 7.024 0.003 -0.220 1.00 . A A . 6 SER C 1 1
20 4398 1 1 6 SER CA C 6.890 -1.403 -0.770 1.00 . A A . 6 SER CA 1 1
20 4399 1 1 6 SER CB C 6.602 -1.382 -2.274 1.00 . A A . 6 SER CB 1 1
20 4400 1 1 6 SER H H 5.078 -1.492 0.236 1.00 . A A . 6 SER H 1 1
20 4401 1 1 6 SER HA H 7.795 -1.961 -0.587 1.00 . A A . 6 SER HA 1 1
20 4402 1 1 6 SER HB2 H 5.681 -0.848 -2.458 1.00 . A A . 6 SER HB2 1 1
20 4403 1 1 6 SER HB3 H 7.416 -0.893 -2.789 1.00 . A A . 6 SER HB3 1 1
20 4404 1 1 6 SER HG H 6.538 -3.287 -1.993 1.00 . A A . 6 SER HG 1 1
20 4405 1 1 6 SER N N 5.820 -2.055 -0.080 1.00 . A A . 6 SER N 1 1
20 4406 1 1 6 SER O O 6.084 0.508 0.376 1.00 . A A . 6 SER O 1 1
20 4407 1 1 6 SER OG O 6.477 -2.715 -2.774 1.00 . A A . 6 SER OG 1 1
20 4408 1 1 7 LYS C C 8.606 2.903 -1.090 1.00 . A A . 7 LYS C 1 1
20 4409 1 1 7 LYS CA C 8.410 1.953 0.096 1.00 . A A . 7 LYS CA 1 1
20 4410 1 1 7 LYS CB C 9.602 1.988 1.077 1.00 . A A . 7 LYS CB 1 1
20 4411 1 1 7 LYS CD C 12.009 1.354 1.583 1.00 . A A . 7 LYS CD 1 1
20 4412 1 1 7 LYS CE C 11.672 0.503 2.815 1.00 . A A . 7 LYS CE 1 1
20 4413 1 1 7 LYS CG C 10.889 1.356 0.545 1.00 . A A . 7 LYS CG 1 1
20 4414 1 1 7 LYS H H 8.899 0.137 -0.854 1.00 . A A . 7 LYS H 1 1
20 4415 1 1 7 LYS HA H 7.512 2.254 0.617 1.00 . A A . 7 LYS HA 1 1
20 4416 1 1 7 LYS HB2 H 9.814 3.017 1.323 1.00 . A A . 7 LYS HB2 1 1
20 4417 1 1 7 LYS HB3 H 9.315 1.466 1.978 1.00 . A A . 7 LYS HB3 1 1
20 4418 1 1 7 LYS HD2 H 12.900 0.954 1.127 1.00 . A A . 7 LYS HD2 1 1
20 4419 1 1 7 LYS HD3 H 12.193 2.370 1.897 1.00 . A A . 7 LYS HD3 1 1
20 4420 1 1 7 LYS HE2 H 12.503 0.552 3.503 1.00 . A A . 7 LYS HE2 1 1
20 4421 1 1 7 LYS HE3 H 10.795 0.908 3.296 1.00 . A A . 7 LYS HE3 1 1
20 4422 1 1 7 LYS HG2 H 10.679 0.334 0.270 1.00 . A A . 7 LYS HG2 1 1
20 4423 1 1 7 LYS HG3 H 11.213 1.905 -0.328 1.00 . A A . 7 LYS HG3 1 1
20 4424 1 1 7 LYS HZ1 H 10.604 -1.037 1.855 1.00 . A A . 7 LYS HZ1 1 1
20 4425 1 1 7 LYS HZ2 H 11.252 -1.483 3.327 1.00 . A A . 7 LYS HZ2 1 1
20 4426 1 1 7 LYS HZ3 H 12.248 -1.340 1.990 1.00 . A A . 7 LYS HZ3 1 1
20 4427 1 1 7 LYS N N 8.177 0.604 -0.381 1.00 . A A . 7 LYS N 1 1
20 4428 1 1 7 LYS NZ N 11.429 -0.917 2.472 1.00 . A A . 7 LYS NZ 1 1
20 4429 1 1 7 LYS O O 9.334 2.567 -2.035 1.00 . A A . 7 LYS O 1 1
20 4430 1 1 8 PRO C C 5.774 3.727 0.067 1.00 . A A . 8 PRO C 1 1
20 4431 1 1 8 PRO CA C 7.057 4.554 -0.011 1.00 . A A . 8 PRO CA 1 1
20 4432 1 1 8 PRO CB C 6.713 6.005 -0.401 1.00 . A A . 8 PRO CB 1 1
20 4433 1 1 8 PRO CD C 7.993 5.063 -2.191 1.00 . A A . 8 PRO CD 1 1
20 4434 1 1 8 PRO CG C 7.645 6.354 -1.511 1.00 . A A . 8 PRO CG 1 1
20 4435 1 1 8 PRO HA H 7.561 4.536 0.942 1.00 . A A . 8 PRO HA 1 1
20 4436 1 1 8 PRO HB2 H 5.684 6.056 -0.722 1.00 . A A . 8 PRO HB2 1 1
20 4437 1 1 8 PRO HB3 H 6.856 6.653 0.453 1.00 . A A . 8 PRO HB3 1 1
20 4438 1 1 8 PRO HD2 H 7.261 4.825 -2.947 1.00 . A A . 8 PRO HD2 1 1
20 4439 1 1 8 PRO HD3 H 8.981 5.113 -2.622 1.00 . A A . 8 PRO HD3 1 1
20 4440 1 1 8 PRO HG2 H 7.156 7.024 -2.203 1.00 . A A . 8 PRO HG2 1 1
20 4441 1 1 8 PRO HG3 H 8.531 6.820 -1.107 1.00 . A A . 8 PRO HG3 1 1
20 4442 1 1 8 PRO N N 7.946 4.088 -1.097 1.00 . A A . 8 PRO N 1 1
20 4443 1 1 8 PRO O O 5.191 3.381 -0.970 1.00 . A A . 8 PRO O 1 1
20 4444 1 1 9 PRO C C 2.873 3.225 1.038 1.00 . A A . 9 PRO C 1 1
20 4445 1 1 9 PRO CA C 4.159 2.548 1.494 1.00 . A A . 9 PRO CA 1 1
20 4446 1 1 9 PRO CB C 4.143 2.295 3.005 1.00 . A A . 9 PRO CB 1 1
20 4447 1 1 9 PRO CD C 5.961 3.777 2.567 1.00 . A A . 9 PRO CD 1 1
20 4448 1 1 9 PRO CG C 4.934 3.408 3.592 1.00 . A A . 9 PRO CG 1 1
20 4449 1 1 9 PRO HA H 4.261 1.609 0.970 1.00 . A A . 9 PRO HA 1 1
20 4450 1 1 9 PRO HB2 H 3.122 2.301 3.359 1.00 . A A . 9 PRO HB2 1 1
20 4451 1 1 9 PRO HB3 H 4.595 1.338 3.214 1.00 . A A . 9 PRO HB3 1 1
20 4452 1 1 9 PRO HD2 H 6.150 4.840 2.594 1.00 . A A . 9 PRO HD2 1 1
20 4453 1 1 9 PRO HD3 H 6.873 3.223 2.733 1.00 . A A . 9 PRO HD3 1 1
20 4454 1 1 9 PRO HG2 H 4.285 4.247 3.792 1.00 . A A . 9 PRO HG2 1 1
20 4455 1 1 9 PRO HG3 H 5.412 3.079 4.503 1.00 . A A . 9 PRO HG3 1 1
20 4456 1 1 9 PRO N N 5.335 3.385 1.287 1.00 . A A . 9 PRO N 1 1
20 4457 1 1 9 PRO O O 2.528 4.326 1.493 1.00 . A A . 9 PRO O 1 1
20 4458 1 1 10 ILE C C -0.141 2.167 0.111 1.00 . A A . 10 ILE C 1 1
20 4459 1 1 10 ILE CA C 0.951 3.079 -0.385 1.00 . A A . 10 ILE CA 1 1
20 4460 1 1 10 ILE CB C 0.955 3.121 -1.943 1.00 . A A . 10 ILE CB 1 1
20 4461 1 1 10 ILE CD1 C 1.988 5.479 -1.973 1.00 . A A . 10 ILE CD1 1 1
20 4462 1 1 10 ILE CG1 C 2.075 4.043 -2.460 1.00 . A A . 10 ILE CG1 1 1
20 4463 1 1 10 ILE CG2 C -0.398 3.556 -2.503 1.00 . A A . 10 ILE CG2 1 1
20 4464 1 1 10 ILE H H 2.539 1.737 -0.217 1.00 . A A . 10 ILE H 1 1
20 4465 1 1 10 ILE HA H 0.788 4.074 0.002 1.00 . A A . 10 ILE HA 1 1
20 4466 1 1 10 ILE HB H 1.148 2.120 -2.296 1.00 . A A . 10 ILE HB 1 1
20 4467 1 1 10 ILE HD11 H 1.050 5.913 -2.285 1.00 . A A . 10 ILE HD11 1 1
20 4468 1 1 10 ILE HD12 H 2.806 6.045 -2.396 1.00 . A A . 10 ILE HD12 1 1
20 4469 1 1 10 ILE HD13 H 2.061 5.505 -0.896 1.00 . A A . 10 ILE HD13 1 1
20 4470 1 1 10 ILE HG12 H 3.027 3.651 -2.132 1.00 . A A . 10 ILE HG12 1 1
20 4471 1 1 10 ILE HG13 H 2.050 4.053 -3.540 1.00 . A A . 10 ILE HG13 1 1
20 4472 1 1 10 ILE HG21 H -0.622 4.553 -2.157 1.00 . A A . 10 ILE HG21 1 1
20 4473 1 1 10 ILE HG22 H -1.163 2.875 -2.161 1.00 . A A . 10 ILE HG22 1 1
20 4474 1 1 10 ILE HG23 H -0.363 3.547 -3.582 1.00 . A A . 10 ILE HG23 1 1
20 4475 1 1 10 ILE N N 2.199 2.589 0.128 1.00 . A A . 10 ILE N 1 1
20 4476 1 1 10 ILE O O -0.072 0.943 -0.087 1.00 . A A . 10 ILE O 1 1
20 4477 1 1 11 ALA C C -3.468 2.673 1.079 1.00 . A A . 11 ALA C 1 1
20 4478 1 1 11 ALA CA C -2.187 1.956 1.337 1.00 . A A . 11 ALA CA 1 1
20 4479 1 1 11 ALA CB C -2.072 1.674 2.855 1.00 . A A . 11 ALA CB 1 1
20 4480 1 1 11 ALA H H -1.076 3.693 0.976 1.00 . A A . 11 ALA H 1 1
20 4481 1 1 11 ALA HA H -2.205 1.013 0.809 1.00 . A A . 11 ALA HA 1 1
20 4482 1 1 11 ALA HB1 H -2.936 1.109 3.171 1.00 . A A . 11 ALA HB1 1 1
20 4483 1 1 11 ALA HB2 H -2.074 2.620 3.376 1.00 . A A . 11 ALA HB2 1 1
20 4484 1 1 11 ALA N N -1.090 2.725 0.815 1.00 . A A . 11 ALA N 1 1
20 4485 1 1 11 ALA O O -3.641 3.822 1.496 1.00 . A A . 11 ALA O 1 1
20 4486 1 1 12 PHE C C -6.534 2.065 1.240 1.00 . A A . 12 PHE C 1 1
20 4487 1 1 12 PHE CA C -5.638 2.571 0.138 1.00 . A A . 12 PHE CA 1 1
20 4488 1 1 12 PHE CB C -6.172 2.176 -1.241 1.00 . A A . 12 PHE CB 1 1
20 4489 1 1 12 PHE CD1 C -4.384 1.933 -2.989 1.00 . A A . 12 PHE CD1 1 1
20 4490 1 1 12 PHE CD2 C -5.525 4.008 -2.811 1.00 . A A . 12 PHE CD2 1 1
20 4491 1 1 12 PHE CE1 C -3.617 2.443 -4.023 1.00 . A A . 12 PHE CE1 1 1
20 4492 1 1 12 PHE CE2 C -4.767 4.519 -3.840 1.00 . A A . 12 PHE CE2 1 1
20 4493 1 1 12 PHE CG C -5.345 2.713 -2.373 1.00 . A A . 12 PHE CG 1 1
20 4494 1 1 12 PHE CZ C -3.812 3.736 -4.446 1.00 . A A . 12 PHE CZ 1 1
20 4495 1 1 12 PHE H H -4.082 1.159 0.013 1.00 . A A . 12 PHE H 1 1
20 4496 1 1 12 PHE HA H -5.557 3.646 0.207 1.00 . A A . 12 PHE HA 1 1
20 4497 1 1 12 PHE HB2 H -6.207 1.102 -1.318 1.00 . A A . 12 PHE HB2 1 1
20 4498 1 1 12 PHE HB3 H -7.174 2.564 -1.347 1.00 . A A . 12 PHE HB3 1 1
20 4499 1 1 12 PHE HD1 H -4.237 0.917 -2.653 1.00 . A A . 12 PHE HD1 1 1
20 4500 1 1 12 PHE HD2 H -6.274 4.625 -2.337 1.00 . A A . 12 PHE HD2 1 1
20 4501 1 1 12 PHE HE1 H -2.865 1.838 -4.506 1.00 . A A . 12 PHE HE1 1 1
20 4502 1 1 12 PHE HE2 H -4.924 5.536 -4.170 1.00 . A A . 12 PHE HE2 1 1
20 4503 1 1 12 PHE HZ H -3.215 4.139 -5.251 1.00 . A A . 12 PHE HZ 1 1
20 4504 1 1 12 PHE N N -4.337 2.040 0.369 1.00 . A A . 12 PHE N 1 1
20 4505 1 1 12 PHE O O -6.591 0.844 1.477 1.00 . A A . 12 PHE O 1 1
20 4506 1 1 13 PRO C C -9.074 1.545 2.953 1.00 . A A . 13 PRO C 1 1
20 4507 1 1 13 PRO CA C -8.068 2.684 3.126 1.00 . A A . 13 PRO CA 1 1
20 4508 1 1 13 PRO CB C -8.801 4.007 3.411 1.00 . A A . 13 PRO CB 1 1
20 4509 1 1 13 PRO CD C -7.359 4.414 1.558 1.00 . A A . 13 PRO CD 1 1
20 4510 1 1 13 PRO CG C -8.666 4.811 2.162 1.00 . A A . 13 PRO CG 1 1
20 4511 1 1 13 PRO HA H -7.428 2.452 3.964 1.00 . A A . 13 PRO HA 1 1
20 4512 1 1 13 PRO HB2 H -9.835 3.802 3.640 1.00 . A A . 13 PRO HB2 1 1
20 4513 1 1 13 PRO HB3 H -8.333 4.504 4.247 1.00 . A A . 13 PRO HB3 1 1
20 4514 1 1 13 PRO HD2 H -7.392 4.548 0.487 1.00 . A A . 13 PRO HD2 1 1
20 4515 1 1 13 PRO HD3 H -6.549 4.979 1.994 1.00 . A A . 13 PRO HD3 1 1
20 4516 1 1 13 PRO HG2 H -9.476 4.575 1.488 1.00 . A A . 13 PRO HG2 1 1
20 4517 1 1 13 PRO HG3 H -8.668 5.865 2.397 1.00 . A A . 13 PRO HG3 1 1
20 4518 1 1 13 PRO N N -7.260 2.983 1.918 1.00 . A A . 13 PRO N 1 1
20 4519 1 1 13 PRO O O -9.506 0.933 3.934 1.00 . A A . 13 PRO O 1 1
20 4520 1 1 14 ASP C C -9.840 -1.167 1.698 1.00 . A A . 14 ASP C 1 1
20 4521 1 1 14 ASP CA C -10.370 0.209 1.372 1.00 . A A . 14 ASP CA 1 1
20 4522 1 1 14 ASP CB C -10.733 0.271 -0.107 1.00 . A A . 14 ASP CB 1 1
20 4523 1 1 14 ASP CG C -11.376 1.567 -0.479 1.00 . A A . 14 ASP CG 1 1
20 4524 1 1 14 ASP H H -8.989 1.776 1.001 1.00 . A A . 14 ASP H 1 1
20 4525 1 1 14 ASP HA H -11.267 0.381 1.948 1.00 . A A . 14 ASP HA 1 1
20 4526 1 1 14 ASP HB2 H -9.836 0.155 -0.696 1.00 . A A . 14 ASP HB2 1 1
20 4527 1 1 14 ASP HB3 H -11.417 -0.533 -0.338 1.00 . A A . 14 ASP HB3 1 1
20 4528 1 1 14 ASP N N -9.411 1.252 1.715 1.00 . A A . 14 ASP N 1 1
20 4529 1 1 14 ASP O O -10.616 -2.111 1.870 1.00 . A A . 14 ASP O 1 1
20 4530 1 1 14 ASP OD1 O -12.591 1.724 -0.283 1.00 . A A . 14 ASP OD1 1 1
20 4531 1 1 14 ASP OD2 O -10.675 2.474 -0.964 1.00 . A A . 14 ASP OD2 1 1
20 4532 2 2 1 . C C -1.741 -1.359 3.573 1.00 . B A . 101 WMH C 1 1
20 4533 2 2 1 . C1 C -0.824 0.936 3.288 1.00 . B A . 101 WMH C1 1 1
20 4534 2 2 1 . C2 C 0.415 1.472 3.404 1.00 . B A . 101 WMH C2 1 1
20 4535 2 2 1 . H1 H -1.854 -1.765 4.567 1.00 . B A . 101 WMH H1 1 1
20 4536 2 2 1 . H2 H -2.667 -0.896 3.268 1.00 . B A . 101 WMH H2 1 1
20 4537 2 2 1 . H5 H 0.668 2.508 3.230 1.00 . B A . 101 WMH H5 1 1
20 4538 2 2 1 . N N -0.723 -0.375 3.581 1.00 . B A . 101 WMH N 1 1
20 4539 2 2 1 . N1 N 1.261 0.522 3.758 1.00 . B A . 101 WMH N1 1 1
20 4540 2 2 1 . N2 N 0.631 -0.596 3.878 1.00 . B A . 101 WMH N2 1 1
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