NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
647612 |
6u7u   |
30669 | cing | 4-filtered-FRED | STAR | entry | full | 100 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6u7u
# This FRED archive file contains, for PDB entry <6u7u>:
#
# - 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_6u7u
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6u7u
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1575.77
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_THR_LYS_SER_ILE_PRO_PRO_ARG_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_THR_LYS_SER_ILE_PRO_PRO_ARG_ALA_PHE_PRO_ASP
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "GLY ARG ALA THR LYS SER ILE PRO PRO ARG ALA PHE PRO ASP"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GRATKSIPPRAFPD
_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 THR . 1 1
5 LYS . 1 1
6 SER . 1 1
7 ILE . 1 1
8 PRO . 1 1
9 PRO . 1 1
10 ARG . 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
THR 4 4 1 1
LYS 5 5 1 1
SER 6 6 1 1
ILE 7 7 1 1
PRO 8 8 1 1
PRO 9 9 1 1
ARG 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
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 HB3 . 2 . HB1 1 1
3 1 1 1 1 2 ARG H . 2 . HN 1 1
3 1 2 1 1 2 ARG HG2 . 2 . HG2 1 1
4 1 1 1 1 2 ARG H . 2 . HN 1 1
4 1 2 1 1 2 ARG HG3 . 2 . HG1 1 1
5 1 1 1 1 3 ALA HA . 3 . HA 1 1
5 1 2 1 1 4 THR H . 4 . HN 1 1
6 1 1 1 1 2 ARG HA . 2 . HA 1 1
6 1 2 1 1 3 ALA H . 3 . HN 1 1
7 1 1 1 1 4 THR H . 4 . HN 1 1
7 1 2 1 1 4 THR MG . 4 . HG2# 1 1
8 1 1 1 1 4 THR HA . 4 . HA 1 1
8 1 2 1 1 5 LYS H . 5 . HN 1 1
9 1 1 1 1 4 THR HB . 4 . HB 1 1
9 1 2 1 1 5 LYS H . 5 . HN 1 1
10 1 1 1 1 6 SER HA . 6 . HA 1 1
10 1 2 1 1 7 ILE H . 7 . HN 1 1
11 1 1 1 1 6 SER HB2 . 6 . HB2 1 1
11 1 2 1 1 7 ILE H . 7 . HN 1 1
12 1 1 1 1 7 ILE H . 7 . HN 1 1
12 1 2 1 1 7 ILE HB . 7 . HB 1 1
13 1 1 1 1 7 ILE H . 7 . HN 1 1
13 1 2 1 1 7 ILE HG12 . 7 . HG12 1 1
14 1 1 1 1 7 ILE H . 7 . HN 1 1
14 1 2 1 1 7 ILE MG . 7 . HG2# 1 1
15 1 1 1 1 7 ILE H . 7 . HN 1 1
15 1 2 1 1 7 ILE MD . 7 . HD1# 1 1
16 1 1 1 1 7 ILE HA . 7 . HA 1 1
16 1 2 1 1 8 PRO HA . 8 . HA 1 1
17 1 1 1 1 8 PRO HA . 8 . HA 1 1
17 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1
18 1 1 1 1 8 PRO HA . 8 . HA 1 1
18 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1
19 1 1 1 1 9 PRO HA . 9 . HA 1 1
19 1 2 1 1 10 ARG H . 10 . HN 1 1
20 1 1 1 1 10 ARG H . 10 . HN 1 1
20 1 2 1 1 10 ARG HB2 . 10 . HB2 1 1
21 1 1 1 1 10 ARG H . 10 . HN 1 1
21 1 2 1 1 10 ARG HB3 . 10 . HB1 1 1
22 1 1 1 1 10 ARG HA . 10 . HA 1 1
22 1 2 1 1 11 ALA H . 11 . HN 1 1
23 1 1 1 1 11 ALA HA . 11 . HA 1 1
23 1 2 1 1 12 PHE H . 12 . HN 1 1
24 1 1 1 1 3 ALA HA . 3 . HA 1 1
24 1 2 1 1 12 PHE H . 12 . HN 1 1
25 1 1 1 1 4 THR H . 4 . HN 1 1
25 1 2 1 1 11 ALA HA . 11 . HA 1 1
26 1 1 1 1 12 PHE HA . 12 . HA 1 1
26 1 2 1 1 13 PRO HD2 . 13 . HD2 1 1
27 1 1 1 1 12 PHE HA . 12 . HA 1 1
27 1 2 1 1 13 PRO HD3 . 13 . HD1 1 1
28 1 1 1 1 12 PHE HA . 12 . HA 1 1
28 1 2 1 1 12 PHE QD . 12 . HD# 1 1
29 1 1 1 1 12 PHE HB2 . 12 . HB2 1 1
29 1 2 1 1 14 ASP H . 14 . HN 1 1
30 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
30 1 2 1 1 14 ASP H . 14 . HN 1 1
31 1 1 1 1 10 ARG HB2 . 10 . HB2 1 1
31 1 2 1 1 11 ALA H . 11 . HN 1 1
32 1 1 1 1 10 ARG HB3 . 10 . HB1 1 1
32 1 2 1 1 11 ALA H . 11 . HN 1 1
33 1 1 1 1 4 THR H . 4 . HN 1 1
33 1 2 1 1 10 ARG HB2 . 10 . HB2 1 1
34 1 1 1 1 4 THR H . 4 . HN 1 1
34 1 2 1 1 10 ARG HB3 . 10 . HB1 1 1
35 1 1 1 1 2 ARG HG2 . 2 . HG2 1 1
35 1 2 1 1 3 ALA H . 3 . HN 1 1
36 1 1 1 1 2 ARG HG3 . 2 . HG1 1 1
36 1 2 1 1 3 ALA H . 3 . HN 1 1
37 1 1 1 1 7 ILE H . 7 . HN 1 1
37 1 2 1 1 7 ILE HG13 . 7 . HG11 1 1
38 1 1 1 1 2 ARG HB2 . 2 . HB2 1 1
38 1 2 1 1 12 PHE QD . 12 . HD# 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 4 THR MG . 4 . HG2# 1 1
40 1 2 1 1 6 SER H . 6 . HN 1 1
41 1 1 1 1 4 THR MG . 4 . HG2# 1 1
41 1 2 1 1 12 PHE QD . 12 . HD# 1 1
42 1 1 1 1 4 THR MG . 4 . HG2# 1 1
42 1 2 1 1 10 ARG H . 10 . HN 1 1
43 1 1 1 1 12 PHE H . 12 . HN 1 1
43 1 2 1 1 12 PHE QD . 12 . HD# 1 1
44 1 1 1 1 5 LYS H . 5 . HN 1 1
44 1 2 1 1 6 SER H . 6 . HN 1 1
45 1 1 1 1 3 ALA HA . 3 . HA 1 1
45 1 2 1 1 11 ALA HA . 11 . HA 1 1
46 1 1 1 1 4 THR H . 4 . HN 1 1
46 1 2 1 1 10 ARG H . 10 . HN 1 1
47 1 1 1 1 10 ARG H . 10 . HN 1 1
47 1 2 1 1 11 ALA H . 11 . HN 1 1
48 1 1 1 1 2 ARG H . 2 . HN 1 1
48 1 2 1 1 12 PHE H . 12 . HN 1 1
49 1 1 1 1 4 THR HA . 4 . HA 1 1
49 1 2 1 1 4 THR MG . 4 . HG2# 1 1
50 1 1 1 1 7 ILE HA . 7 . HA 1 1
50 1 2 1 1 7 ILE MG . 7 . HG2# 1 1
51 1 1 1 1 7 ILE MG . 7 . HG2# 1 1
51 1 2 1 1 8 PRO HA . 8 . HA 1 1
52 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1
52 1 2 1 1 10 ARG HA . 10 . HA 1 1
53 1 1 1 1 6 SER HB3 . 6 . HB1 1 1
53 1 2 1 1 7 ILE H . 7 . HN 1 1
54 1 1 1 1 4 THR MG . 4 . HG2# 1 1
54 1 2 1 1 12 PHE QE . 12 . HE# 1 1
55 1 1 1 1 4 THR MG . 4 . HG2# 1 1
55 1 2 1 1 5 LYS H . 5 . HN 1 1
56 1 1 1 1 2 ARG H . 2 . HN 1 1
56 1 2 1 1 2 ARG QB . 2 . HB# 1 1
57 1 1 1 1 2 ARG H . 2 . HN 1 1
57 1 2 1 1 2 ARG QG . 2 . HG# 1 1
58 1 1 1 1 2 ARG H . 2 . HN 1 1
58 1 2 1 1 12 PHE QB . 12 . HB# 1 1
59 1 1 1 1 2 ARG QB . 2 . HB# 1 1
59 1 2 1 1 2 ARG HE . 2 . HE 1 1
60 1 1 1 1 2 ARG QB . 2 . HB# 1 1
60 1 2 1 1 3 ALA H . 3 . HN 1 1
61 1 1 1 1 2 ARG QB . 2 . HB# 1 1
61 1 2 1 1 12 PHE QD . 12 . HD# 1 1
62 1 1 1 1 2 ARG QG . 2 . HG# 1 1
62 1 2 1 1 3 ALA H . 3 . HN 1 1
63 1 1 1 1 5 LYS H . 5 . HN 1 1
63 1 2 1 1 5 LYS QB . 5 . HB# 1 1
64 1 1 1 1 5 LYS H . 5 . HN 1 1
64 1 2 1 1 5 LYS QG . 5 . HG# 1 1
65 1 1 1 1 6 SER QB . 6 . HB# 1 1
65 1 2 1 1 7 ILE H . 7 . HN 1 1
66 1 1 1 1 7 ILE H . 7 . HN 1 1
66 1 2 1 1 7 ILE QG . 7 . HG1# 1 1
67 1 1 1 1 7 ILE HA . 7 . HA 1 1
67 1 2 1 1 9 PRO QD . 9 . HD# 1 1
68 1 1 1 1 7 ILE QG . 7 . HG1# 1 1
68 1 2 1 1 7 ILE MG . 7 . HG2# 1 1
69 1 1 1 1 8 PRO HA . 8 . HA 1 1
69 1 2 1 1 9 PRO QD . 9 . HD# 1 1
70 1 1 1 1 8 PRO QB . 8 . HB# 1 1
70 1 2 1 1 9 PRO QD . 9 . HD# 1 1
71 1 1 1 1 10 ARG H . 10 . HN 1 1
71 1 2 1 1 10 ARG QB . 10 . HB# 1 1
72 1 1 1 1 10 ARG QB . 10 . HB# 1 1
72 1 2 1 1 11 ALA H . 11 . HN 1 1
73 1 1 1 1 12 PHE H . 12 . HN 1 1
73 1 2 1 1 12 PHE QB . 12 . HB# 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 QB . 12 . HB# 1 1
75 1 2 1 1 13 PRO QD . 13 . HD# 1 1
76 1 1 1 1 12 PHE QB . 12 . HB# 1 1
76 1 2 1 1 14 ASP H . 14 . HN 1 1
77 1 1 1 1 13 PRO QB . 13 . HB# 1 1
77 1 2 1 1 14 ASP H . 14 . HN 1 1
78 1 1 1 1 13 PRO QD . 13 . HD# 1 1
78 1 2 1 1 14 ASP H . 14 . HN 1 1
79 1 1 1 1 14 ASP H . 14 . HN 1 1
79 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 . . . . . 2.97 1.8 4.14 1 1
2 1 . . . . . 2.97 1.8 4.14 1 1
3 1 . . . . . 3.585 1.8 5.37 1 1
4 1 . . . . . 3.585 1.8 5.37 1 1
5 1 . . . . . 2.375 1.8 2.95 1 1
6 1 . . . . . 2.41 1.8 3.02 1 1
7 1 . . . . . 2.8 1.8 3.8 1 1
8 1 . . . . . 2.415 1.8 3.03 1 1
9 1 . . . . . 2.565 1.8 3.33 1 1
10 1 . . . . . 2.575 1.8 3.35 1 1
11 1 . . . . . 2.92 1.8 4.04 1 1
12 1 . . . . . 2.735 1.8 3.67 1 1
13 1 . . . . . 3.505 1.8 5.21 1 1
14 1 . . . . . 3.525 1.8 5.25 1 1
15 1 . . . . . 3.65 1.8 5.5 1 1
16 1 . . . . . 2.735 1.8 3.67 1 1
17 1 . . . . . 2.605 1.8 3.41 1 1
18 1 . . . . . 2.605 1.8 3.41 1 1
19 1 . . . . . 2.425 1.8 3.05 1 1
20 1 . . . . . 2.995 1.8 4.19 1 1
21 1 . . . . . 2.995 1.8 4.19 1 1
22 1 . . . . . 2.455 1.8 3.11 1 1
23 1 . . . . . 2.41 1.8 3.02 1 1
24 1 . . . . . 3.15 1.8 4.5 1 1
25 1 . . . . . 3.235 1.8 4.67 1 1
26 1 . . . . . 2.7 1.8 3.6 1 1
27 1 . . . . . 2.7 1.8 3.6 1 1
28 1 . . . . . 3.125 1.8 4.45 1 1
29 1 . . . . . 3.02 1.8 4.24 1 1
30 1 . . . . . 3.02 1.8 4.24 1 1
31 1 . . . . . 3.485 1.8 5.17 1 1
32 1 . . . . . 3.485 1.8 5.17 1 1
33 1 . . . . . 3.65 1.8 5.5 1 1
34 1 . . . . . 3.65 1.8 5.5 1 1
35 1 . . . . . 3.65 1.8 5.5 1 1
36 1 . . . . . 3.65 1.8 5.5 1 1
37 1 . . . . . 3.505 1.8 5.21 1 1
38 1 . . . . . 3.31 1.8 4.82 1 1
39 1 . . . . . 3.31 1.8 4.82 1 1
40 1 . . . . . 3.465 1.8 5.13 1 1
41 1 . . . . . 3.545 1.8 5.29 1 1
42 1 . . . . . 3.34 1.8 4.88 1 1
43 1 . . . . . 3.075 1.8 4.35 1 1
44 1 . . . . . 2.97 1.8 4.14 1 1
45 1 . . . . . 2.585 1.8 3.37 1 1
46 1 . . . . . 2.83 1.8 3.86 1 1
47 1 . . . . . 3.48 1.8 5.16 1 1
48 1 . . . . . 3.64 1.8 5.48 1 1
49 1 . . . . . 2.605 1.8 3.41 1 1
50 1 . . . . . 2.62 1.8 3.44 1 1
51 1 . . . . . 2.735 1.8 3.67 1 1
52 1 . . . . . 3.185 1.8 4.57 1 1
53 1 . . . . . 2.92 1.8 4.04 1 1
54 1 . . . . . 2.87 1.8 3.94 1 1
55 1 . . . . . 3.165 1.8 4.53 1 1
56 1 . . . . . 2.59 1.8 3.38 1 1
57 1 . . . . . 3.215 1.8 4.63 1 1
58 1 . . . . . 3.08 1.8 4.36 1 1
59 1 . . . . . 3.16 1.8 4.52 1 1
60 1 . . . . . 3.015 1.8 4.23 1 1
61 1 . . . . . 2.96 1.8 4.12 1 1
62 1 . . . . . 3.325 1.8 4.85 1 1
63 1 . . . . . 2.625 1.8 3.45 1 1
64 1 . . . . . 3.475 1.8 5.15 1 1
65 1 . . . . . 2.565 1.8 3.33 1 1
66 1 . . . . . 3.07 1.8 4.34 1 1
67 1 . . . . . 3.09 1.8 4.38 1 1
68 1 . . . . . 2.45 1.8 3.1 1 1
69 1 . . . . . 2.395 1.8 2.99 1 1
70 1 . . . . . 2.73 1.8 3.66 1 1
71 1 . . . . . 2.66 1.8 3.52 1 1
72 1 . . . . . 3.14 1.8 4.48 1 1
73 1 . . . . . 2.53 1.8 3.26 1 1
74 1 . . . . . 2.455 1.8 3.11 1 1
75 1 . . . . . 2.58 1.8 3.36 1 1
76 1 . . . . . 2.75 1.8 3.7 1 1
77 1 . . . . . 2.915 1.8 4.03 1 1
78 1 . . . . . 3.03 1.8 4.26 1 1
79 1 . . . . . 2.66 1.8 3.52 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 4 THR OG1 . 4 . OG1 1 2
1 1 2 1 1 10 ARG H . 10 . HN 1 2
2 1 1 1 1 4 THR OG1 . 4 . OG1 1 2
2 1 2 1 1 10 ARG N . 10 . 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 -150.5 -110.49999 . 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 THR N 134.6 174.6 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1
3 . 1 1 3 ALA C 1 1 4 THR N 1 1 4 THR CA 1 1 4 THR C -152.4 -72.4 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1
4 . 1 1 4 THR N 1 1 4 THR CA 1 1 4 THR C 1 1 5 LYS N 117.69999 168.1 . 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 -160.0 -49.4 . 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 ILE N 114.5 175.5 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1
7 . 1 1 6 SER C 1 1 7 ILE N 1 1 7 ILE CA 1 1 7 ILE C -140.0 -58.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
8 . 1 1 7 ILE N 1 1 7 ILE CA 1 1 7 ILE C 1 1 8 PRO N 96.4 161.0 . 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 126.8 166.79999 . 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 ARG N 16.6 156.6 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1
11 . 1 1 9 PRO C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -184.1 -55.3 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
12 . 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C 1 1 11 ALA N 81.49999 206.7 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1
13 . 1 1 10 ARG C 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C -133.1 -53.7 . 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 93.6 159.4 . 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 -157.2 -58.6 . 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 46.4 151.4 . 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 -105.0 -65.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1
18 . 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER CB 1 1 6 SER OG 30.0 89.99999 . 6 . N . 6 . CA . 6 . CB . 6 . OG 1 1
19 . 1 1 14 ASP N 1 1 14 ASP CA 1 1 14 ASP CB 1 1 14 ASP CG 30.0 89.99999 . 14 . N . 14 . CA . 14 . CB . 14 . CG 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 -6.644 -0.798 3.671 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C -7.906 -0.120 4.140 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H -8.317 0.925 2.351 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY HA2 H -7.642 0.714 4.775 1.00 . A A . 1 GLY HA2 1 1
1 5 1 1 1 GLY HA3 H -8.485 -0.826 4.718 1.00 . A A . 1 GLY HA3 1 1
1 6 1 1 1 GLY N N -8.717 0.361 3.049 1.00 . A A . 1 GLY N 1 1
1 7 1 1 1 GLY O O -5.681 -0.918 4.431 1.00 . A A . 1 GLY O 1 1
1 8 1 1 2 ARG C C -4.265 -1.011 1.775 1.00 . A A . 2 ARG C 1 1
1 9 1 1 2 ARG CA C -5.482 -1.930 1.863 1.00 . A A . 2 ARG CA 1 1
1 10 1 1 2 ARG CB C -5.814 -2.537 0.489 1.00 . A A . 2 ARG CB 1 1
1 11 1 1 2 ARG CD C -4.054 -4.347 0.630 1.00 . A A . 2 ARG CD 1 1
1 12 1 1 2 ARG CG C -4.648 -3.235 -0.215 1.00 . A A . 2 ARG CG 1 1
1 13 1 1 2 ARG CZ C -1.844 -5.470 0.513 1.00 . A A . 2 ARG CZ 1 1
1 14 1 1 2 ARG H H -7.433 -1.111 1.855 1.00 . A A . 2 ARG H 1 1
1 15 1 1 2 ARG HA H -5.248 -2.734 2.544 1.00 . A A . 2 ARG HA 1 1
1 16 1 1 2 ARG HB2 H -6.603 -3.263 0.615 1.00 . A A . 2 ARG HB2 1 1
1 17 1 1 2 ARG HB3 H -6.173 -1.747 -0.154 1.00 . A A . 2 ARG HB3 1 1
1 18 1 1 2 ARG HD2 H -3.679 -3.921 1.549 1.00 . A A . 2 ARG HD2 1 1
1 19 1 1 2 ARG HD3 H -4.825 -5.071 0.850 1.00 . A A . 2 ARG HD3 1 1
1 20 1 1 2 ARG HE H -3.092 -5.144 -1.025 1.00 . A A . 2 ARG HE 1 1
1 21 1 1 2 ARG HG2 H -4.999 -3.657 -1.144 1.00 . A A . 2 ARG HG2 1 1
1 22 1 1 2 ARG HG3 H -3.880 -2.504 -0.422 1.00 . A A . 2 ARG HG3 1 1
1 23 1 1 2 ARG HH11 H -2.289 -4.846 2.422 1.00 . A A . 2 ARG HH11 1 1
1 24 1 1 2 ARG HH12 H -0.787 -5.626 2.250 1.00 . A A . 2 ARG HH12 1 1
1 25 1 1 2 ARG HH21 H -1.082 -6.230 -1.215 1.00 . A A . 2 ARG HH21 1 1
1 26 1 1 2 ARG HH22 H -0.080 -6.445 0.154 1.00 . A A . 2 ARG HH22 1 1
1 27 1 1 2 ARG N N -6.639 -1.240 2.421 1.00 . A A . 2 ARG N 1 1
1 28 1 1 2 ARG NE N -2.959 -5.017 -0.055 1.00 . A A . 2 ARG NE 1 1
1 29 1 1 2 ARG NH1 N -1.633 -5.305 1.816 1.00 . A A . 2 ARG NH1 1 1
1 30 1 1 2 ARG NH2 N -0.936 -6.093 -0.231 1.00 . A A . 2 ARG NH2 1 1
1 31 1 1 2 ARG O O -4.291 0.008 1.095 1.00 . A A . 2 ARG O 1 1
1 32 1 1 3 ALA C C -0.863 -1.646 2.262 1.00 . A A . 3 ALA C 1 1
1 33 1 1 3 ALA CA C -1.979 -0.671 2.508 1.00 . A A . 3 ALA CA 1 1
1 34 1 1 3 ALA CB C -1.808 0.020 3.866 1.00 . A A . 3 ALA CB 1 1
1 35 1 1 3 ALA H H -3.305 -2.183 3.042 1.00 . A A . 3 ALA H 1 1
1 36 1 1 3 ALA HA H -1.983 0.077 1.729 1.00 . A A . 3 ALA HA 1 1
1 37 1 1 3 ALA HB1 H -0.754 0.059 4.099 1.00 . A A . 3 ALA HB1 1 1
1 38 1 1 3 ALA HB2 H -2.314 -0.562 4.621 1.00 . A A . 3 ALA HB2 1 1
1 39 1 1 3 ALA N N -3.235 -1.376 2.485 1.00 . A A . 3 ALA N 1 1
1 40 1 1 3 ALA O O -0.835 -2.716 2.873 1.00 . A A . 3 ALA O 1 1
1 41 1 1 4 THR C C 2.236 -2.059 2.082 1.00 . A A . 4 THR C 1 1
1 42 1 1 4 THR CA C 1.126 -2.177 1.058 1.00 . A A . 4 THR CA 1 1
1 43 1 1 4 THR CB C 1.667 -1.901 -0.362 1.00 . A A . 4 THR CB 1 1
1 44 1 1 4 THR CG2 C 0.602 -2.212 -1.406 1.00 . A A . 4 THR CG2 1 1
1 45 1 1 4 THR H H -0.009 -0.431 0.924 1.00 . A A . 4 THR H 1 1
1 46 1 1 4 THR HA H 0.742 -3.186 1.088 1.00 . A A . 4 THR HA 1 1
1 47 1 1 4 THR HB H 2.524 -2.535 -0.534 1.00 . A A . 4 THR HB 1 1
1 48 1 1 4 THR HG1 H 3.000 -0.529 -0.734 1.00 . A A . 4 THR HG1 1 1
1 49 1 1 4 THR HG21 H 0.990 -2.021 -2.394 1.00 . A A . 4 THR HG21 1 1
1 50 1 1 4 THR HG22 H -0.262 -1.588 -1.232 1.00 . A A . 4 THR HG22 1 1
1 51 1 1 4 THR HG23 H 0.314 -3.252 -1.327 1.00 . A A . 4 THR HG23 1 1
1 52 1 1 4 THR N N 0.042 -1.298 1.387 1.00 . A A . 4 THR N 1 1
1 53 1 1 4 THR O O 2.501 -0.966 2.617 1.00 . A A . 4 THR O 1 1
1 54 1 1 4 THR OG1 O 2.068 -0.528 -0.478 1.00 . A A . 4 THR OG1 1 1
1 55 1 1 5 LYS C C 5.236 -2.852 2.653 1.00 . A A . 5 LYS C 1 1
1 56 1 1 5 LYS CA C 3.936 -3.183 3.358 1.00 . A A . 5 LYS CA 1 1
1 57 1 1 5 LYS CB C 4.040 -4.546 4.055 1.00 . A A . 5 LYS CB 1 1
1 58 1 1 5 LYS CD C 2.164 -4.060 5.678 1.00 . A A . 5 LYS CD 1 1
1 59 1 1 5 LYS CE C 0.813 -4.526 6.174 1.00 . A A . 5 LYS CE 1 1
1 60 1 1 5 LYS CG C 2.732 -5.036 4.667 1.00 . A A . 5 LYS CG 1 1
1 61 1 1 5 LYS H H 2.565 -4.014 1.976 1.00 . A A . 5 LYS H 1 1
1 62 1 1 5 LYS HA H 3.737 -2.419 4.095 1.00 . A A . 5 LYS HA 1 1
1 63 1 1 5 LYS HB2 H 4.368 -5.278 3.332 1.00 . A A . 5 LYS HB2 1 1
1 64 1 1 5 LYS HB3 H 4.778 -4.477 4.839 1.00 . A A . 5 LYS HB3 1 1
1 65 1 1 5 LYS HD2 H 2.837 -3.989 6.519 1.00 . A A . 5 LYS HD2 1 1
1 66 1 1 5 LYS HD3 H 2.052 -3.090 5.216 1.00 . A A . 5 LYS HD3 1 1
1 67 1 1 5 LYS HE2 H 0.139 -4.600 5.333 1.00 . A A . 5 LYS HE2 1 1
1 68 1 1 5 LYS HE3 H 0.926 -5.499 6.627 1.00 . A A . 5 LYS HE3 1 1
1 69 1 1 5 LYS HG2 H 2.004 -5.164 3.884 1.00 . A A . 5 LYS HG2 1 1
1 70 1 1 5 LYS HG3 H 2.908 -5.983 5.154 1.00 . A A . 5 LYS HG3 1 1
1 71 1 1 5 LYS HZ1 H -0.687 -3.945 7.481 1.00 . A A . 5 LYS HZ1 1 1
1 72 1 1 5 LYS HZ2 H 0.123 -2.641 6.772 1.00 . A A . 5 LYS HZ2 1 1
1 73 1 1 5 LYS HZ3 H 0.855 -3.533 7.994 1.00 . A A . 5 LYS HZ3 1 1
1 74 1 1 5 LYS N N 2.855 -3.175 2.396 1.00 . A A . 5 LYS N 1 1
1 75 1 1 5 LYS NZ N 0.240 -3.599 7.158 1.00 . A A . 5 LYS NZ 1 1
1 76 1 1 5 LYS O O 6.138 -2.255 3.230 1.00 . A A . 5 LYS O 1 1
1 77 1 1 6 SER C C 6.310 -1.683 -0.196 1.00 . A A . 6 SER C 1 1
1 78 1 1 6 SER CA C 6.477 -2.958 0.620 1.00 . A A . 6 SER CA 1 1
1 79 1 1 6 SER CB C 6.766 -4.156 -0.278 1.00 . A A . 6 SER CB 1 1
1 80 1 1 6 SER H H 4.562 -3.678 0.982 1.00 . A A . 6 SER H 1 1
1 81 1 1 6 SER HA H 7.305 -2.833 1.302 1.00 . A A . 6 SER HA 1 1
1 82 1 1 6 SER HB2 H 7.496 -3.866 -1.017 1.00 . A A . 6 SER HB2 1 1
1 83 1 1 6 SER HB3 H 7.156 -4.970 0.312 1.00 . A A . 6 SER HB3 1 1
1 84 1 1 6 SER HG H 5.361 -3.934 -1.628 1.00 . A A . 6 SER HG 1 1
1 85 1 1 6 SER N N 5.313 -3.220 1.408 1.00 . A A . 6 SER N 1 1
1 86 1 1 6 SER O O 5.182 -1.190 -0.376 1.00 . A A . 6 SER O 1 1
1 87 1 1 6 SER OG O 5.582 -4.593 -0.953 1.00 . A A . 6 SER OG 1 1
1 88 1 1 7 ILE C C 6.954 -0.304 -2.921 1.00 . A A . 7 ILE C 1 1
1 89 1 1 7 ILE CA C 7.424 0.031 -1.490 1.00 . A A . 7 ILE CA 1 1
1 90 1 1 7 ILE CB C 8.833 0.689 -1.533 1.00 . A A . 7 ILE CB 1 1
1 91 1 1 7 ILE CD1 C 11.266 0.289 -2.260 1.00 . A A . 7 ILE CD1 1 1
1 92 1 1 7 ILE CG1 C 9.880 -0.294 -2.094 1.00 . A A . 7 ILE CG1 1 1
1 93 1 1 7 ILE CG2 C 9.231 1.168 -0.136 1.00 . A A . 7 ILE CG2 1 1
1 94 1 1 7 ILE H H 8.273 -1.579 -0.441 1.00 . A A . 7 ILE H 1 1
1 95 1 1 7 ILE HA H 6.725 0.732 -1.054 1.00 . A A . 7 ILE HA 1 1
1 96 1 1 7 ILE HB H 8.778 1.554 -2.176 1.00 . A A . 7 ILE HB 1 1
1 97 1 1 7 ILE HD11 H 11.629 0.619 -1.298 1.00 . A A . 7 ILE HD11 1 1
1 98 1 1 7 ILE HD12 H 11.224 1.130 -2.935 1.00 . A A . 7 ILE HD12 1 1
1 99 1 1 7 ILE HD13 H 11.931 -0.462 -2.658 1.00 . A A . 7 ILE HD13 1 1
1 100 1 1 7 ILE HG12 H 9.962 -1.139 -1.428 1.00 . A A . 7 ILE HG12 1 1
1 101 1 1 7 ILE HG13 H 9.542 -0.642 -3.059 1.00 . A A . 7 ILE HG13 1 1
1 102 1 1 7 ILE HG21 H 9.243 0.325 0.540 1.00 . A A . 7 ILE HG21 1 1
1 103 1 1 7 ILE HG22 H 8.521 1.901 0.216 1.00 . A A . 7 ILE HG22 1 1
1 104 1 1 7 ILE HG23 H 10.217 1.609 -0.176 1.00 . A A . 7 ILE HG23 1 1
1 105 1 1 7 ILE N N 7.416 -1.155 -0.667 1.00 . A A . 7 ILE N 1 1
1 106 1 1 7 ILE O O 7.154 -1.436 -3.396 1.00 . A A . 7 ILE O 1 1
1 107 1 1 8 PRO C C 4.727 1.749 -2.023 1.00 . A A . 8 PRO C 1 1
1 108 1 1 8 PRO CA C 5.870 1.919 -3.038 1.00 . A A . 8 PRO CA 1 1
1 109 1 1 8 PRO CB C 5.375 2.705 -4.264 1.00 . A A . 8 PRO CB 1 1
1 110 1 1 8 PRO CD C 5.841 0.482 -5.013 1.00 . A A . 8 PRO CD 1 1
1 111 1 1 8 PRO CG C 4.943 1.667 -5.239 1.00 . A A . 8 PRO CG 1 1
1 112 1 1 8 PRO HA H 6.709 2.422 -2.585 1.00 . A A . 8 PRO HA 1 1
1 113 1 1 8 PRO HB2 H 4.552 3.342 -3.975 1.00 . A A . 8 PRO HB2 1 1
1 114 1 1 8 PRO HB3 H 6.178 3.308 -4.661 1.00 . A A . 8 PRO HB3 1 1
1 115 1 1 8 PRO HD2 H 5.300 -0.441 -5.163 1.00 . A A . 8 PRO HD2 1 1
1 116 1 1 8 PRO HD3 H 6.692 0.530 -5.675 1.00 . A A . 8 PRO HD3 1 1
1 117 1 1 8 PRO HG2 H 3.913 1.396 -5.055 1.00 . A A . 8 PRO HG2 1 1
1 118 1 1 8 PRO HG3 H 5.057 2.037 -6.247 1.00 . A A . 8 PRO HG3 1 1
1 119 1 1 8 PRO N N 6.266 0.623 -3.605 1.00 . A A . 8 PRO N 1 1
1 120 1 1 8 PRO O O 3.812 0.954 -2.257 1.00 . A A . 8 PRO O 1 1
1 121 1 1 9 PRO C C 2.443 2.994 -0.401 1.00 . A A . 9 PRO C 1 1
1 122 1 1 9 PRO CA C 3.717 2.349 0.129 1.00 . A A . 9 PRO CA 1 1
1 123 1 1 9 PRO CB C 4.265 3.127 1.339 1.00 . A A . 9 PRO CB 1 1
1 124 1 1 9 PRO CD C 5.844 3.349 -0.437 1.00 . A A . 9 PRO CD 1 1
1 125 1 1 9 PRO CG C 5.718 3.309 1.052 1.00 . A A . 9 PRO CG 1 1
1 126 1 1 9 PRO HA H 3.513 1.323 0.394 1.00 . A A . 9 PRO HA 1 1
1 127 1 1 9 PRO HB2 H 3.752 4.073 1.418 1.00 . A A . 9 PRO HB2 1 1
1 128 1 1 9 PRO HB3 H 4.110 2.552 2.240 1.00 . A A . 9 PRO HB3 1 1
1 129 1 1 9 PRO HD2 H 5.677 4.352 -0.802 1.00 . A A . 9 PRO HD2 1 1
1 130 1 1 9 PRO HD3 H 6.817 2.988 -0.733 1.00 . A A . 9 PRO HD3 1 1
1 131 1 1 9 PRO HG2 H 6.071 4.235 1.485 1.00 . A A . 9 PRO HG2 1 1
1 132 1 1 9 PRO HG3 H 6.277 2.475 1.450 1.00 . A A . 9 PRO HG3 1 1
1 133 1 1 9 PRO N N 4.777 2.438 -0.869 1.00 . A A . 9 PRO N 1 1
1 134 1 1 9 PRO O O 2.324 4.230 -0.463 1.00 . A A . 9 PRO O 1 1
1 135 1 1 10 ARG C C -0.835 2.183 -0.606 1.00 . A A . 10 ARG C 1 1
1 136 1 1 10 ARG CA C 0.329 2.609 -1.452 1.00 . A A . 10 ARG CA 1 1
1 137 1 1 10 ARG CB C 0.236 2.023 -2.860 1.00 . A A . 10 ARG CB 1 1
1 138 1 1 10 ARG CD C -0.931 1.875 -5.057 1.00 . A A . 10 ARG CD 1 1
1 139 1 1 10 ARG CG C -0.997 2.429 -3.646 1.00 . A A . 10 ARG CG 1 1
1 140 1 1 10 ARG CZ C 0.756 1.864 -6.901 1.00 . A A . 10 ARG CZ 1 1
1 141 1 1 10 ARG H H 1.686 1.200 -0.743 1.00 . A A . 10 ARG H 1 1
1 142 1 1 10 ARG HA H 0.346 3.685 -1.521 1.00 . A A . 10 ARG HA 1 1
1 143 1 1 10 ARG HB2 H 1.103 2.335 -3.422 1.00 . A A . 10 ARG HB2 1 1
1 144 1 1 10 ARG HB3 H 0.246 0.947 -2.781 1.00 . A A . 10 ARG HB3 1 1
1 145 1 1 10 ARG HD2 H -0.854 0.800 -5.005 1.00 . A A . 10 ARG HD2 1 1
1 146 1 1 10 ARG HD3 H -1.833 2.147 -5.583 1.00 . A A . 10 ARG HD3 1 1
1 147 1 1 10 ARG HE H 0.601 3.239 -5.424 1.00 . A A . 10 ARG HE 1 1
1 148 1 1 10 ARG HG2 H -1.876 2.043 -3.152 1.00 . A A . 10 ARG HG2 1 1
1 149 1 1 10 ARG HG3 H -1.048 3.508 -3.692 1.00 . A A . 10 ARG HG3 1 1
1 150 1 1 10 ARG HH11 H -0.453 0.213 -6.922 1.00 . A A . 10 ARG HH11 1 1
1 151 1 1 10 ARG HH12 H 0.651 0.289 -8.206 1.00 . A A . 10 ARG HH12 1 1
1 152 1 1 10 ARG HH21 H 2.150 3.335 -7.184 1.00 . A A . 10 ARG HH21 1 1
1 153 1 1 10 ARG HH22 H 2.188 2.118 -8.356 1.00 . A A . 10 ARG HH22 1 1
1 154 1 1 10 ARG N N 1.543 2.172 -0.842 1.00 . A A . 10 ARG N 1 1
1 155 1 1 10 ARG NE N 0.229 2.406 -5.793 1.00 . A A . 10 ARG NE 1 1
1 156 1 1 10 ARG NH1 N 0.291 0.716 -7.372 1.00 . A A . 10 ARG NH1 1 1
1 157 1 1 10 ARG NH2 N 1.762 2.473 -7.518 1.00 . A A . 10 ARG NH2 1 1
1 158 1 1 10 ARG O O -0.889 1.035 -0.137 1.00 . A A . 10 ARG O 1 1
1 159 1 1 11 ALA C C -4.123 3.143 -0.293 1.00 . A A . 11 ALA C 1 1
1 160 1 1 11 ALA CA C -2.871 2.812 0.442 1.00 . A A . 11 ALA CA 1 1
1 161 1 1 11 ALA CB C -2.837 3.536 1.798 1.00 . A A . 11 ALA CB 1 1
1 162 1 1 11 ALA H H -1.645 3.998 -0.749 1.00 . A A . 11 ALA H 1 1
1 163 1 1 11 ALA HA H -2.865 1.748 0.625 1.00 . A A . 11 ALA HA 1 1
1 164 1 1 11 ALA HB1 H -3.664 3.187 2.397 1.00 . A A . 11 ALA HB1 1 1
1 165 1 1 11 ALA HB2 H -2.944 4.601 1.688 1.00 . A A . 11 ALA HB2 1 1
1 166 1 1 11 ALA N N -1.734 3.099 -0.364 1.00 . A A . 11 ALA N 1 1
1 167 1 1 11 ALA O O -4.193 4.134 -1.021 1.00 . A A . 11 ALA O 1 1
1 168 1 1 12 PHE C C -7.367 2.770 0.363 1.00 . A A . 12 PHE C 1 1
1 169 1 1 12 PHE CA C -6.367 2.461 -0.741 1.00 . A A . 12 PHE CA 1 1
1 170 1 1 12 PHE CB C -6.741 1.161 -1.463 1.00 . A A . 12 PHE CB 1 1
1 171 1 1 12 PHE CD1 C -5.885 1.135 -3.826 1.00 . A A . 12 PHE CD1 1 1
1 172 1 1 12 PHE CD2 C -4.691 -0.108 -2.188 1.00 . A A . 12 PHE CD2 1 1
1 173 1 1 12 PHE CE1 C -4.984 0.729 -4.791 1.00 . A A . 12 PHE CE1 1 1
1 174 1 1 12 PHE CE2 C -3.789 -0.515 -3.146 1.00 . A A . 12 PHE CE2 1 1
1 175 1 1 12 PHE CG C -5.752 0.722 -2.516 1.00 . A A . 12 PHE CG 1 1
1 176 1 1 12 PHE CZ C -3.936 -0.097 -4.449 1.00 . A A . 12 PHE CZ 1 1
1 177 1 1 12 PHE H H -4.920 1.536 0.464 1.00 . A A . 12 PHE H 1 1
1 178 1 1 12 PHE HA H -6.311 3.273 -1.449 1.00 . A A . 12 PHE HA 1 1
1 179 1 1 12 PHE HB2 H -6.820 0.368 -0.735 1.00 . A A . 12 PHE HB2 1 1
1 180 1 1 12 PHE HB3 H -7.702 1.292 -1.938 1.00 . A A . 12 PHE HB3 1 1
1 181 1 1 12 PHE HD1 H -6.708 1.782 -4.092 1.00 . A A . 12 PHE HD1 1 1
1 182 1 1 12 PHE HD2 H -4.573 -0.434 -1.166 1.00 . A A . 12 PHE HD2 1 1
1 183 1 1 12 PHE HE1 H -5.102 1.061 -5.812 1.00 . A A . 12 PHE HE1 1 1
1 184 1 1 12 PHE HE2 H -2.968 -1.161 -2.873 1.00 . A A . 12 PHE HE2 1 1
1 185 1 1 12 PHE HZ H -3.228 -0.420 -5.201 1.00 . A A . 12 PHE HZ 1 1
1 186 1 1 12 PHE N N -5.085 2.311 -0.124 1.00 . A A . 12 PHE N 1 1
1 187 1 1 12 PHE O O -7.238 2.209 1.458 1.00 . A A . 12 PHE O 1 1
1 188 1 1 13 PRO C C -10.126 2.974 1.847 1.00 . A A . 13 PRO C 1 1
1 189 1 1 13 PRO CA C -9.347 4.106 1.148 1.00 . A A . 13 PRO CA 1 1
1 190 1 1 13 PRO CB C -10.306 5.009 0.363 1.00 . A A . 13 PRO CB 1 1
1 191 1 1 13 PRO CD C -8.653 4.279 -1.194 1.00 . A A . 13 PRO CD 1 1
1 192 1 1 13 PRO CG C -9.529 5.441 -0.830 1.00 . A A . 13 PRO CG 1 1
1 193 1 1 13 PRO HA H -8.849 4.691 1.906 1.00 . A A . 13 PRO HA 1 1
1 194 1 1 13 PRO HB2 H -11.185 4.448 0.082 1.00 . A A . 13 PRO HB2 1 1
1 195 1 1 13 PRO HB3 H -10.594 5.853 0.972 1.00 . A A . 13 PRO HB3 1 1
1 196 1 1 13 PRO HD2 H -9.175 3.600 -1.853 1.00 . A A . 13 PRO HD2 1 1
1 197 1 1 13 PRO HD3 H -7.745 4.634 -1.656 1.00 . A A . 13 PRO HD3 1 1
1 198 1 1 13 PRO HG2 H -10.200 5.676 -1.643 1.00 . A A . 13 PRO HG2 1 1
1 199 1 1 13 PRO HG3 H -8.925 6.301 -0.583 1.00 . A A . 13 PRO HG3 1 1
1 200 1 1 13 PRO N N -8.373 3.645 0.114 1.00 . A A . 13 PRO N 1 1
1 201 1 1 13 PRO O O -10.720 3.176 2.905 1.00 . A A . 13 PRO O 1 1
1 202 1 1 14 ASP C C -9.997 0.067 2.996 1.00 . A A . 14 ASP C 1 1
1 203 1 1 14 ASP CA C -10.782 0.628 1.828 1.00 . A A . 14 ASP CA 1 1
1 204 1 1 14 ASP CB C -10.997 -0.459 0.777 1.00 . A A . 14 ASP CB 1 1
1 205 1 1 14 ASP CG C -9.743 -0.781 0.015 1.00 . A A . 14 ASP CG 1 1
1 206 1 1 14 ASP H H -9.667 1.723 0.389 1.00 . A A . 14 ASP H 1 1
1 207 1 1 14 ASP HA H -11.746 0.943 2.196 1.00 . A A . 14 ASP HA 1 1
1 208 1 1 14 ASP HB2 H -11.337 -1.362 1.265 1.00 . A A . 14 ASP HB2 1 1
1 209 1 1 14 ASP HB3 H -11.750 -0.130 0.077 1.00 . A A . 14 ASP HB3 1 1
1 210 1 1 14 ASP N N -10.126 1.803 1.253 1.00 . A A . 14 ASP N 1 1
1 211 1 1 14 ASP O O -10.558 -0.629 3.845 1.00 . A A . 14 ASP O 1 1
1 212 1 1 14 ASP OD1 O -8.975 -1.682 0.421 1.00 . A A . 14 ASP OD1 1 1
1 213 1 1 14 ASP OD2 O -9.499 -0.106 -0.994 1.00 . A A . 14 ASP OD2 1 1
1 214 2 2 1 . C C -2.354 1.432 3.907 1.00 . B A . 101 WMH C 1 1
1 215 2 2 1 . C1 C -1.580 3.305 2.582 1.00 . B A . 101 WMH C1 1 1
1 216 2 2 1 . C2 C -0.397 3.961 2.432 1.00 . B A . 101 WMH C2 1 1
1 217 2 2 1 . H1 H -2.779 1.741 4.845 1.00 . B A . 101 WMH H1 1 1
1 218 2 2 1 . H2 H -3.150 1.458 3.179 1.00 . B A . 101 WMH H2 1 1
1 219 2 2 1 . H5 H -0.208 4.782 1.759 1.00 . B A . 101 WMH H5 1 1
1 220 2 2 1 . N N -1.410 2.368 3.486 1.00 . B A . 101 WMH N 1 1
1 221 2 2 1 . N1 N 0.486 3.411 3.262 1.00 . B A . 101 WMH N1 1 1
1 222 2 2 1 . N2 N -0.081 2.454 3.915 1.00 . B A . 101 WMH N2 1 1
2 223 1 1 1 GLY C C -7.356 -1.412 3.559 1.00 . A A . 1 GLY C 1 1
2 224 1 1 1 GLY CA C -8.378 -0.523 4.200 1.00 . A A . 1 GLY CA 1 1
2 225 1 1 1 GLY H1 H -8.899 1.159 3.029 1.00 . A A . 1 GLY H1 1 1
2 226 1 1 1 GLY HA2 H -7.884 0.173 4.861 1.00 . A A . 1 GLY HA2 1 1
2 227 1 1 1 GLY HA3 H -9.067 -1.131 4.764 1.00 . A A . 1 GLY HA3 1 1
2 228 1 1 1 GLY N N -9.104 0.214 3.192 1.00 . A A . 1 GLY N 1 1
2 229 1 1 1 GLY O O -7.440 -2.650 3.638 1.00 . A A . 1 GLY O 1 1
2 230 1 1 2 ARG C C -4.154 -0.668 2.018 1.00 . A A . 2 ARG C 1 1
2 231 1 1 2 ARG CA C -5.403 -1.513 2.168 1.00 . A A . 2 ARG CA 1 1
2 232 1 1 2 ARG CB C -5.977 -1.932 0.809 1.00 . A A . 2 ARG CB 1 1
2 233 1 1 2 ARG CD C -5.750 -3.117 -1.377 1.00 . A A . 2 ARG CD 1 1
2 234 1 1 2 ARG CG C -5.004 -2.558 -0.171 1.00 . A A . 2 ARG CG 1 1
2 235 1 1 2 ARG CZ C -7.036 -1.974 -3.192 1.00 . A A . 2 ARG CZ 1 1
2 236 1 1 2 ARG H H -6.359 0.181 2.917 1.00 . A A . 2 ARG H 1 1
2 237 1 1 2 ARG HA H -5.156 -2.404 2.726 1.00 . A A . 2 ARG HA 1 1
2 238 1 1 2 ARG HB2 H -6.763 -2.651 0.983 1.00 . A A . 2 ARG HB2 1 1
2 239 1 1 2 ARG HB3 H -6.412 -1.059 0.346 1.00 . A A . 2 ARG HB3 1 1
2 240 1 1 2 ARG HD2 H -5.035 -3.339 -2.154 1.00 . A A . 2 ARG HD2 1 1
2 241 1 1 2 ARG HD3 H -6.254 -4.026 -1.083 1.00 . A A . 2 ARG HD3 1 1
2 242 1 1 2 ARG HE H -7.264 -1.670 -1.230 1.00 . A A . 2 ARG HE 1 1
2 243 1 1 2 ARG HG2 H -4.302 -1.806 -0.501 1.00 . A A . 2 ARG HG2 1 1
2 244 1 1 2 ARG HG3 H -4.474 -3.361 0.320 1.00 . A A . 2 ARG HG3 1 1
2 245 1 1 2 ARG HH11 H -5.679 -3.325 -3.928 1.00 . A A . 2 ARG HH11 1 1
2 246 1 1 2 ARG HH12 H -6.599 -2.531 -5.118 1.00 . A A . 2 ARG HH12 1 1
2 247 1 1 2 ARG HH21 H -8.458 -0.589 -2.779 1.00 . A A . 2 ARG HH21 1 1
2 248 1 1 2 ARG HH22 H -8.261 -0.886 -4.450 1.00 . A A . 2 ARG HH22 1 1
2 249 1 1 2 ARG N N -6.406 -0.799 2.902 1.00 . A A . 2 ARG N 1 1
2 250 1 1 2 ARG NE N -6.748 -2.171 -1.907 1.00 . A A . 2 ARG NE 1 1
2 251 1 1 2 ARG NH1 N -6.392 -2.654 -4.143 1.00 . A A . 2 ARG NH1 1 1
2 252 1 1 2 ARG NH2 N -7.975 -1.096 -3.511 1.00 . A A . 2 ARG NH2 1 1
2 253 1 1 2 ARG O O -4.171 0.374 1.372 1.00 . A A . 2 ARG O 1 1
2 254 1 1 3 ALA C C -0.780 -1.541 2.379 1.00 . A A . 3 ALA C 1 1
2 255 1 1 3 ALA CA C -1.813 -0.489 2.628 1.00 . A A . 3 ALA CA 1 1
2 256 1 1 3 ALA CB C -1.542 0.274 3.933 1.00 . A A . 3 ALA CB 1 1
2 257 1 1 3 ALA H H -3.188 -1.907 3.225 1.00 . A A . 3 ALA H 1 1
2 258 1 1 3 ALA HA H -1.799 0.209 1.804 1.00 . A A . 3 ALA HA 1 1
2 259 1 1 3 ALA HB1 H -0.484 0.233 4.147 1.00 . A A . 3 ALA HB1 1 1
2 260 1 1 3 ALA HB2 H -2.082 -0.205 4.736 1.00 . A A . 3 ALA HB2 1 1
2 261 1 1 3 ALA N N -3.115 -1.103 2.664 1.00 . A A . 3 ALA N 1 1
2 262 1 1 3 ALA O O -0.878 -2.638 2.923 1.00 . A A . 3 ALA O 1 1
2 263 1 1 4 THR C C 2.316 -2.106 2.213 1.00 . A A . 4 THR C 1 1
2 264 1 1 4 THR CA C 1.181 -2.207 1.210 1.00 . A A . 4 THR CA 1 1
2 265 1 1 4 THR CB C 1.722 -2.017 -0.221 1.00 . A A . 4 THR CB 1 1
2 266 1 1 4 THR CG2 C 0.630 -2.314 -1.242 1.00 . A A . 4 THR CG2 1 1
2 267 1 1 4 THR H H 0.138 -0.410 1.024 1.00 . A A . 4 THR H 1 1
2 268 1 1 4 THR HA H 0.753 -3.196 1.281 1.00 . A A . 4 THR HA 1 1
2 269 1 1 4 THR HB H 2.541 -2.704 -0.371 1.00 . A A . 4 THR HB 1 1
2 270 1 1 4 THR HG1 H 3.163 -0.710 -0.228 1.00 . A A . 4 THR HG1 1 1
2 271 1 1 4 THR HG21 H 0.302 -3.337 -1.130 1.00 . A A . 4 THR HG21 1 1
2 272 1 1 4 THR HG22 H 1.019 -2.170 -2.239 1.00 . A A . 4 THR HG22 1 1
2 273 1 1 4 THR HG23 H -0.204 -1.649 -1.078 1.00 . A A . 4 THR HG23 1 1
2 274 1 1 4 THR N N 0.147 -1.262 1.510 1.00 . A A . 4 THR N 1 1
2 275 1 1 4 THR O O 2.629 -1.011 2.722 1.00 . A A . 4 THR O 1 1
2 276 1 1 4 THR OG1 O 2.211 -0.663 -0.398 1.00 . A A . 4 THR OG1 1 1
2 277 1 1 5 LYS C C 5.268 -2.948 2.575 1.00 . A A . 5 LYS C 1 1
2 278 1 1 5 LYS CA C 4.027 -3.284 3.395 1.00 . A A . 5 LYS CA 1 1
2 279 1 1 5 LYS CB C 4.138 -4.689 4.012 1.00 . A A . 5 LYS CB 1 1
2 280 1 1 5 LYS CD C 5.269 -6.261 5.649 1.00 . A A . 5 LYS CD 1 1
2 281 1 1 5 LYS CE C 5.673 -7.320 4.621 1.00 . A A . 5 LYS CE 1 1
2 282 1 1 5 LYS CG C 5.241 -4.847 5.055 1.00 . A A . 5 LYS CG 1 1
2 283 1 1 5 LYS H H 2.553 -4.063 2.137 1.00 . A A . 5 LYS H 1 1
2 284 1 1 5 LYS HA H 3.898 -2.551 4.178 1.00 . A A . 5 LYS HA 1 1
2 285 1 1 5 LYS HB2 H 3.197 -4.936 4.481 1.00 . A A . 5 LYS HB2 1 1
2 286 1 1 5 LYS HB3 H 4.322 -5.390 3.214 1.00 . A A . 5 LYS HB3 1 1
2 287 1 1 5 LYS HD2 H 5.981 -6.284 6.461 1.00 . A A . 5 LYS HD2 1 1
2 288 1 1 5 LYS HD3 H 4.287 -6.497 6.030 1.00 . A A . 5 LYS HD3 1 1
2 289 1 1 5 LYS HE2 H 5.553 -8.298 5.063 1.00 . A A . 5 LYS HE2 1 1
2 290 1 1 5 LYS HE3 H 5.026 -7.243 3.760 1.00 . A A . 5 LYS HE3 1 1
2 291 1 1 5 LYS HG2 H 6.191 -4.645 4.584 1.00 . A A . 5 LYS HG2 1 1
2 292 1 1 5 LYS HG3 H 5.075 -4.133 5.849 1.00 . A A . 5 LYS HG3 1 1
2 293 1 1 5 LYS HZ1 H 7.753 -7.334 4.958 1.00 . A A . 5 LYS HZ1 1 1
2 294 1 1 5 LYS HZ2 H 7.278 -6.223 3.803 1.00 . A A . 5 LYS HZ2 1 1
2 295 1 1 5 LYS HZ3 H 7.302 -7.847 3.425 1.00 . A A . 5 LYS HZ3 1 1
2 296 1 1 5 LYS N N 2.895 -3.228 2.523 1.00 . A A . 5 LYS N 1 1
2 297 1 1 5 LYS NZ N 7.081 -7.170 4.183 1.00 . A A . 5 LYS NZ 1 1
2 298 1 1 5 LYS O O 6.168 -2.249 3.035 1.00 . A A . 5 LYS O 1 1
2 299 1 1 6 SER C C 6.216 -1.832 -0.246 1.00 . A A . 6 SER C 1 1
2 300 1 1 6 SER CA C 6.374 -3.186 0.449 1.00 . A A . 6 SER CA 1 1
2 301 1 1 6 SER CB C 6.420 -4.318 -0.570 1.00 . A A . 6 SER CB 1 1
2 302 1 1 6 SER H H 4.525 -3.942 1.004 1.00 . A A . 6 SER H 1 1
2 303 1 1 6 SER HA H 7.293 -3.190 1.016 1.00 . A A . 6 SER HA 1 1
2 304 1 1 6 SER HB2 H 7.158 -4.098 -1.328 1.00 . A A . 6 SER HB2 1 1
2 305 1 1 6 SER HB3 H 6.671 -5.240 -0.069 1.00 . A A . 6 SER HB3 1 1
2 306 1 1 6 SER HG H 4.956 -5.414 -1.202 1.00 . A A . 6 SER HG 1 1
2 307 1 1 6 SER N N 5.282 -3.418 1.349 1.00 . A A . 6 SER N 1 1
2 308 1 1 6 SER O O 5.084 -1.283 -0.350 1.00 . A A . 6 SER O 1 1
2 309 1 1 6 SER OG O 5.162 -4.471 -1.197 1.00 . A A . 6 SER OG 1 1
2 310 1 1 7 ILE C C 6.954 -0.233 -2.882 1.00 . A A . 7 ILE C 1 1
2 311 1 1 7 ILE CA C 7.300 -0.025 -1.404 1.00 . A A . 7 ILE CA 1 1
2 312 1 1 7 ILE CB C 8.641 0.748 -1.267 1.00 . A A . 7 ILE CB 1 1
2 313 1 1 7 ILE CD1 C 11.113 0.723 -1.918 1.00 . A A . 7 ILE CD1 1 1
2 314 1 1 7 ILE CG1 C 9.811 -0.046 -1.866 1.00 . A A . 7 ILE CG1 1 1
2 315 1 1 7 ILE CG2 C 8.905 1.075 0.195 1.00 . A A . 7 ILE CG2 1 1
2 316 1 1 7 ILE H H 8.164 -1.779 -0.638 1.00 . A A . 7 ILE H 1 1
2 317 1 1 7 ILE HA H 6.510 0.561 -0.957 1.00 . A A . 7 ILE HA 1 1
2 318 1 1 7 ILE HB H 8.543 1.683 -1.796 1.00 . A A . 7 ILE HB 1 1
2 319 1 1 7 ILE HD11 H 11.400 1.019 -0.919 1.00 . A A . 7 ILE HD11 1 1
2 320 1 1 7 ILE HD12 H 10.989 1.602 -2.533 1.00 . A A . 7 ILE HD12 1 1
2 321 1 1 7 ILE HD13 H 11.880 0.092 -2.341 1.00 . A A . 7 ILE HD13 1 1
2 322 1 1 7 ILE HG12 H 9.981 -0.923 -1.260 1.00 . A A . 7 ILE HG12 1 1
2 323 1 1 7 ILE HG13 H 9.556 -0.347 -2.872 1.00 . A A . 7 ILE HG13 1 1
2 324 1 1 7 ILE HG21 H 8.964 0.159 0.764 1.00 . A A . 7 ILE HG21 1 1
2 325 1 1 7 ILE HG22 H 8.102 1.686 0.580 1.00 . A A . 7 ILE HG22 1 1
2 326 1 1 7 ILE HG23 H 9.839 1.611 0.278 1.00 . A A . 7 ILE HG23 1 1
2 327 1 1 7 ILE N N 7.316 -1.293 -0.721 1.00 . A A . 7 ILE N 1 1
2 328 1 1 7 ILE O O 7.150 -1.333 -3.415 1.00 . A A . 7 ILE O 1 1
2 329 1 1 8 PRO C C 4.805 1.889 -2.018 1.00 . A A . 8 PRO C 1 1
2 330 1 1 8 PRO CA C 6.016 2.060 -2.938 1.00 . A A . 8 PRO CA 1 1
2 331 1 1 8 PRO CB C 5.639 2.944 -4.147 1.00 . A A . 8 PRO CB 1 1
2 332 1 1 8 PRO CD C 6.028 0.743 -4.962 1.00 . A A . 8 PRO CD 1 1
2 333 1 1 8 PRO CG C 6.098 2.186 -5.345 1.00 . A A . 8 PRO CG 1 1
2 334 1 1 8 PRO HA H 6.840 2.495 -2.396 1.00 . A A . 8 PRO HA 1 1
2 335 1 1 8 PRO HB2 H 4.567 3.090 -4.162 1.00 . A A . 8 PRO HB2 1 1
2 336 1 1 8 PRO HB3 H 6.135 3.900 -4.069 1.00 . A A . 8 PRO HB3 1 1
2 337 1 1 8 PRO HD2 H 5.031 0.358 -5.103 1.00 . A A . 8 PRO HD2 1 1
2 338 1 1 8 PRO HD3 H 6.746 0.157 -5.518 1.00 . A A . 8 PRO HD3 1 1
2 339 1 1 8 PRO HG2 H 5.447 2.386 -6.182 1.00 . A A . 8 PRO HG2 1 1
2 340 1 1 8 PRO HG3 H 7.115 2.460 -5.587 1.00 . A A . 8 PRO HG3 1 1
2 341 1 1 8 PRO N N 6.378 0.775 -3.549 1.00 . A A . 8 PRO N 1 1
2 342 1 1 8 PRO O O 3.992 0.992 -2.238 1.00 . A A . 8 PRO O 1 1
2 343 1 1 9 PRO C C 2.264 2.985 -0.782 1.00 . A A . 9 PRO C 1 1
2 344 1 1 9 PRO CA C 3.556 2.629 -0.047 1.00 . A A . 9 PRO CA 1 1
2 345 1 1 9 PRO CB C 3.877 3.677 1.007 1.00 . A A . 9 PRO CB 1 1
2 346 1 1 9 PRO CD C 5.727 3.624 -0.474 1.00 . A A . 9 PRO CD 1 1
2 347 1 1 9 PRO CG C 5.360 3.804 0.960 1.00 . A A . 9 PRO CG 1 1
2 348 1 1 9 PRO HA H 3.450 1.655 0.412 1.00 . A A . 9 PRO HA 1 1
2 349 1 1 9 PRO HB2 H 3.373 4.593 0.736 1.00 . A A . 9 PRO HB2 1 1
2 350 1 1 9 PRO HB3 H 3.532 3.337 1.971 1.00 . A A . 9 PRO HB3 1 1
2 351 1 1 9 PRO HD2 H 5.674 4.560 -1.011 1.00 . A A . 9 PRO HD2 1 1
2 352 1 1 9 PRO HD3 H 6.715 3.195 -0.542 1.00 . A A . 9 PRO HD3 1 1
2 353 1 1 9 PRO HG2 H 5.672 4.776 1.309 1.00 . A A . 9 PRO HG2 1 1
2 354 1 1 9 PRO HG3 H 5.816 3.029 1.559 1.00 . A A . 9 PRO HG3 1 1
2 355 1 1 9 PRO N N 4.710 2.669 -0.943 1.00 . A A . 9 PRO N 1 1
2 356 1 1 9 PRO O O 1.998 4.152 -1.102 1.00 . A A . 9 PRO O 1 1
2 357 1 1 10 ARG C C -0.839 1.958 -0.830 1.00 . A A . 10 ARG C 1 1
2 358 1 1 10 ARG CA C 0.289 2.109 -1.816 1.00 . A A . 10 ARG CA 1 1
2 359 1 1 10 ARG CB C 0.231 1.015 -2.889 1.00 . A A . 10 ARG CB 1 1
2 360 1 1 10 ARG CD C 1.678 -0.126 -4.625 1.00 . A A . 10 ARG CD 1 1
2 361 1 1 10 ARG CG C 1.218 1.207 -4.038 1.00 . A A . 10 ARG CG 1 1
2 362 1 1 10 ARG CZ C 3.086 -2.054 -3.839 1.00 . A A . 10 ARG CZ 1 1
2 363 1 1 10 ARG H H 1.802 1.071 -0.848 1.00 . A A . 10 ARG H 1 1
2 364 1 1 10 ARG HA H 0.263 3.079 -2.289 1.00 . A A . 10 ARG HA 1 1
2 365 1 1 10 ARG HB2 H 0.442 0.064 -2.423 1.00 . A A . 10 ARG HB2 1 1
2 366 1 1 10 ARG HB3 H -0.767 0.989 -3.300 1.00 . A A . 10 ARG HB3 1 1
2 367 1 1 10 ARG HD2 H 0.819 -0.769 -4.741 1.00 . A A . 10 ARG HD2 1 1
2 368 1 1 10 ARG HD3 H 2.133 0.048 -5.589 1.00 . A A . 10 ARG HD3 1 1
2 369 1 1 10 ARG HE H 3.036 -0.187 -3.056 1.00 . A A . 10 ARG HE 1 1
2 370 1 1 10 ARG HG2 H 0.744 1.782 -4.819 1.00 . A A . 10 ARG HG2 1 1
2 371 1 1 10 ARG HG3 H 2.081 1.743 -3.669 1.00 . A A . 10 ARG HG3 1 1
2 372 1 1 10 ARG HH11 H 1.842 -2.589 -5.373 1.00 . A A . 10 ARG HH11 1 1
2 373 1 1 10 ARG HH12 H 2.848 -3.835 -4.820 1.00 . A A . 10 ARG HH12 1 1
2 374 1 1 10 ARG HH21 H 4.441 -1.906 -2.305 1.00 . A A . 10 ARG HH21 1 1
2 375 1 1 10 ARG HH22 H 4.387 -3.437 -3.024 1.00 . A A . 10 ARG HH22 1 1
2 376 1 1 10 ARG N N 1.521 1.979 -1.105 1.00 . A A . 10 ARG N 1 1
2 377 1 1 10 ARG NE N 2.660 -0.786 -3.747 1.00 . A A . 10 ARG NE 1 1
2 378 1 1 10 ARG NH1 N 2.564 -2.877 -4.736 1.00 . A A . 10 ARG NH1 1 1
2 379 1 1 10 ARG NH2 N 4.032 -2.495 -3.008 1.00 . A A . 10 ARG NH2 1 1
2 380 1 1 10 ARG O O -1.025 0.876 -0.260 1.00 . A A . 10 ARG O 1 1
2 381 1 1 11 ALA C C -3.919 3.387 -0.251 1.00 . A A . 11 ALA C 1 1
2 382 1 1 11 ALA CA C -2.627 2.970 0.390 1.00 . A A . 11 ALA CA 1 1
2 383 1 1 11 ALA CB C -2.368 3.773 1.680 1.00 . A A . 11 ALA CB 1 1
2 384 1 1 11 ALA H H -1.359 3.885 -1.008 1.00 . A A . 11 ALA H 1 1
2 385 1 1 11 ALA HA H -2.730 1.927 0.652 1.00 . A A . 11 ALA HA 1 1
2 386 1 1 11 ALA HB1 H -3.180 3.582 2.366 1.00 . A A . 11 ALA HB1 1 1
2 387 1 1 11 ALA HB2 H -2.344 4.833 1.494 1.00 . A A . 11 ALA HB2 1 1
2 388 1 1 11 ALA N N -1.543 3.035 -0.558 1.00 . A A . 11 ALA N 1 1
2 389 1 1 11 ALA O O -3.981 4.388 -0.979 1.00 . A A . 11 ALA O 1 1
2 390 1 1 12 PHE C C -7.281 2.924 0.516 1.00 . A A . 12 PHE C 1 1
2 391 1 1 12 PHE CA C -6.232 2.832 -0.587 1.00 . A A . 12 PHE CA 1 1
2 392 1 1 12 PHE CB C -6.542 1.690 -1.575 1.00 . A A . 12 PHE CB 1 1
2 393 1 1 12 PHE CD1 C -4.445 0.752 -2.612 1.00 . A A . 12 PHE CD1 1 1
2 394 1 1 12 PHE CD2 C -5.716 2.335 -3.858 1.00 . A A . 12 PHE CD2 1 1
2 395 1 1 12 PHE CE1 C -3.526 0.678 -3.634 1.00 . A A . 12 PHE CE1 1 1
2 396 1 1 12 PHE CE2 C -4.802 2.262 -4.887 1.00 . A A . 12 PHE CE2 1 1
2 397 1 1 12 PHE CG C -5.552 1.585 -2.709 1.00 . A A . 12 PHE CG 1 1
2 398 1 1 12 PHE CZ C -3.701 1.434 -4.775 1.00 . A A . 12 PHE CZ 1 1
2 399 1 1 12 PHE H H -4.800 1.883 0.638 1.00 . A A . 12 PHE H 1 1
2 400 1 1 12 PHE HA H -6.203 3.768 -1.124 1.00 . A A . 12 PHE HA 1 1
2 401 1 1 12 PHE HB2 H -6.536 0.750 -1.041 1.00 . A A . 12 PHE HB2 1 1
2 402 1 1 12 PHE HB3 H -7.522 1.844 -2.000 1.00 . A A . 12 PHE HB3 1 1
2 403 1 1 12 PHE HD1 H -4.305 0.162 -1.718 1.00 . A A . 12 PHE HD1 1 1
2 404 1 1 12 PHE HD2 H -6.576 2.983 -3.948 1.00 . A A . 12 PHE HD2 1 1
2 405 1 1 12 PHE HE1 H -2.670 0.024 -3.543 1.00 . A A . 12 PHE HE1 1 1
2 406 1 1 12 PHE HE2 H -4.942 2.859 -5.778 1.00 . A A . 12 PHE HE2 1 1
2 407 1 1 12 PHE HZ H -2.980 1.382 -5.577 1.00 . A A . 12 PHE HZ 1 1
2 408 1 1 12 PHE N N -4.932 2.626 0.004 1.00 . A A . 12 PHE N 1 1
2 409 1 1 12 PHE O O -7.162 2.238 1.542 1.00 . A A . 12 PHE O 1 1
2 410 1 1 13 PRO C C -10.328 2.848 1.642 1.00 . A A . 13 PRO C 1 1
2 411 1 1 13 PRO CA C -9.378 4.023 1.355 1.00 . A A . 13 PRO CA 1 1
2 412 1 1 13 PRO CB C -10.161 5.184 0.748 1.00 . A A . 13 PRO CB 1 1
2 413 1 1 13 PRO CD C -8.606 4.509 -0.917 1.00 . A A . 13 PRO CD 1 1
2 414 1 1 13 PRO CG C -9.997 5.017 -0.718 1.00 . A A . 13 PRO CG 1 1
2 415 1 1 13 PRO HA H -8.930 4.349 2.282 1.00 . A A . 13 PRO HA 1 1
2 416 1 1 13 PRO HB2 H -11.196 5.117 1.048 1.00 . A A . 13 PRO HB2 1 1
2 417 1 1 13 PRO HB3 H -9.737 6.114 1.091 1.00 . A A . 13 PRO HB3 1 1
2 418 1 1 13 PRO HD2 H -8.556 3.868 -1.786 1.00 . A A . 13 PRO HD2 1 1
2 419 1 1 13 PRO HD3 H -7.918 5.336 -1.013 1.00 . A A . 13 PRO HD3 1 1
2 420 1 1 13 PRO HG2 H -10.711 4.292 -1.080 1.00 . A A . 13 PRO HG2 1 1
2 421 1 1 13 PRO HG3 H -10.129 5.963 -1.220 1.00 . A A . 13 PRO HG3 1 1
2 422 1 1 13 PRO N N -8.338 3.748 0.324 1.00 . A A . 13 PRO N 1 1
2 423 1 1 13 PRO O O -11.390 3.021 2.256 1.00 . A A . 13 PRO O 1 1
2 424 1 1 14 ASP C C -10.055 -0.371 2.494 1.00 . A A . 14 ASP C 1 1
2 425 1 1 14 ASP CA C -10.735 0.484 1.444 1.00 . A A . 14 ASP CA 1 1
2 426 1 1 14 ASP CB C -10.942 -0.316 0.148 1.00 . A A . 14 ASP CB 1 1
2 427 1 1 14 ASP CG C -9.652 -0.704 -0.544 1.00 . A A . 14 ASP CG 1 1
2 428 1 1 14 ASP H H -9.132 1.631 0.683 1.00 . A A . 14 ASP H 1 1
2 429 1 1 14 ASP HA H -11.699 0.790 1.824 1.00 . A A . 14 ASP HA 1 1
2 430 1 1 14 ASP HB2 H -11.477 -1.225 0.384 1.00 . A A . 14 ASP HB2 1 1
2 431 1 1 14 ASP HB3 H -11.536 0.273 -0.534 1.00 . A A . 14 ASP HB3 1 1
2 432 1 1 14 ASP N N -9.966 1.687 1.200 1.00 . A A . 14 ASP N 1 1
2 433 1 1 14 ASP O O -10.412 -1.525 2.696 1.00 . A A . 14 ASP O 1 1
2 434 1 1 14 ASP OD1 O -9.117 -1.795 -0.290 1.00 . A A . 14 ASP OD1 1 1
2 435 1 1 14 ASP OD2 O -9.171 0.073 -1.381 1.00 . A A . 14 ASP OD2 1 1
2 436 2 2 1 . C C -1.960 1.728 3.879 1.00 . B A . 101 WMH C 1 1
2 437 2 2 1 . C1 C -1.086 3.429 2.391 1.00 . B A . 101 WMH C1 1 1
2 438 2 2 1 . C2 C 0.151 3.935 2.136 1.00 . B A . 101 WMH C2 1 1
2 439 2 2 1 . H1 H -2.301 2.150 4.808 1.00 . B A . 101 WMH H1 1 1
2 440 2 2 1 . H2 H -2.788 1.780 3.187 1.00 . B A . 101 WMH H2 1 1
2 441 2 2 1 . H5 H 0.388 4.690 1.401 1.00 . B A . 101 WMH H5 1 1
2 442 2 2 1 . N N -0.956 2.529 3.346 1.00 . B A . 101 WMH N 1 1
2 443 2 2 1 . N1 N 1.023 3.336 2.952 1.00 . B A . 101 WMH N1 1 1
2 444 2 2 1 . N2 N 0.400 2.488 3.694 1.00 . B A . 101 WMH N2 1 1
3 445 1 1 1 GLY C C -7.139 -0.798 4.033 1.00 . A A . 1 GLY C 1 1
3 446 1 1 1 GLY CA C -8.266 0.134 4.377 1.00 . A A . 1 GLY CA 1 1
3 447 1 1 1 GLY H1 H -8.718 1.249 2.647 1.00 . A A . 1 GLY H1 1 1
3 448 1 1 1 GLY HA2 H -7.852 1.012 4.848 1.00 . A A . 1 GLY HA2 1 1
3 449 1 1 1 GLY HA3 H -8.920 -0.359 5.082 1.00 . A A . 1 GLY HA3 1 1
3 450 1 1 1 GLY N N -9.050 0.535 3.237 1.00 . A A . 1 GLY N 1 1
3 451 1 1 1 GLY O O -6.807 -1.676 4.818 1.00 . A A . 1 GLY O 1 1
3 452 1 1 2 ARG C C -4.188 -0.665 2.350 1.00 . A A . 2 ARG C 1 1
3 453 1 1 2 ARG CA C -5.435 -1.498 2.491 1.00 . A A . 2 ARG CA 1 1
3 454 1 1 2 ARG CB C -5.724 -2.192 1.152 1.00 . A A . 2 ARG CB 1 1
3 455 1 1 2 ARG CD C -7.311 -3.923 2.064 1.00 . A A . 2 ARG CD 1 1
3 456 1 1 2 ARG CG C -7.092 -2.829 1.046 1.00 . A A . 2 ARG CG 1 1
3 457 1 1 2 ARG CZ C -9.149 -5.540 2.499 1.00 . A A . 2 ARG CZ 1 1
3 458 1 1 2 ARG H H -6.791 0.125 2.305 1.00 . A A . 2 ARG H 1 1
3 459 1 1 2 ARG HA H -5.290 -2.240 3.262 1.00 . A A . 2 ARG HA 1 1
3 460 1 1 2 ARG HB2 H -5.633 -1.470 0.359 1.00 . A A . 2 ARG HB2 1 1
3 461 1 1 2 ARG HB3 H -4.981 -2.961 1.000 1.00 . A A . 2 ARG HB3 1 1
3 462 1 1 2 ARG HD2 H -6.671 -4.759 1.823 1.00 . A A . 2 ARG HD2 1 1
3 463 1 1 2 ARG HD3 H -7.069 -3.547 3.047 1.00 . A A . 2 ARG HD3 1 1
3 464 1 1 2 ARG HE H -9.329 -3.686 1.689 1.00 . A A . 2 ARG HE 1 1
3 465 1 1 2 ARG HG2 H -7.844 -2.068 1.194 1.00 . A A . 2 ARG HG2 1 1
3 466 1 1 2 ARG HG3 H -7.198 -3.244 0.055 1.00 . A A . 2 ARG HG3 1 1
3 467 1 1 2 ARG HH11 H -7.310 -6.327 2.972 1.00 . A A . 2 ARG HH11 1 1
3 468 1 1 2 ARG HH12 H -8.631 -7.364 3.258 1.00 . A A . 2 ARG HH12 1 1
3 469 1 1 2 ARG HH21 H -11.118 -5.108 2.173 1.00 . A A . 2 ARG HH21 1 1
3 470 1 1 2 ARG HH22 H -10.836 -6.650 2.825 1.00 . A A . 2 ARG HH22 1 1
3 471 1 1 2 ARG N N -6.533 -0.622 2.887 1.00 . A A . 2 ARG N 1 1
3 472 1 1 2 ARG NE N -8.700 -4.365 2.055 1.00 . A A . 2 ARG NE 1 1
3 473 1 1 2 ARG NH1 N -8.302 -6.469 2.945 1.00 . A A . 2 ARG NH1 1 1
3 474 1 1 2 ARG NH2 N -10.450 -5.784 2.496 1.00 . A A . 2 ARG NH2 1 1
3 475 1 1 2 ARG O O -4.255 0.447 1.858 1.00 . A A . 2 ARG O 1 1
3 476 1 1 3 ALA C C -0.722 -1.513 2.408 1.00 . A A . 3 ALA C 1 1
3 477 1 1 3 ALA CA C -1.803 -0.505 2.702 1.00 . A A . 3 ALA CA 1 1
3 478 1 1 3 ALA CB C -1.521 0.291 3.982 1.00 . A A . 3 ALA CB 1 1
3 479 1 1 3 ALA H H -3.077 -2.059 3.232 1.00 . A A . 3 ALA H 1 1
3 480 1 1 3 ALA HA H -1.860 0.177 1.866 1.00 . A A . 3 ALA HA 1 1
3 481 1 1 3 ALA HB1 H -0.452 0.327 4.130 1.00 . A A . 3 ALA HB1 1 1
3 482 1 1 3 ALA HB2 H -1.979 -0.213 4.820 1.00 . A A . 3 ALA HB2 1 1
3 483 1 1 3 ALA N N -3.083 -1.179 2.797 1.00 . A A . 3 ALA N 1 1
3 484 1 1 3 ALA O O -0.711 -2.605 2.986 1.00 . A A . 3 ALA O 1 1
3 485 1 1 4 THR C C 2.393 -2.027 1.983 1.00 . A A . 4 THR C 1 1
3 486 1 1 4 THR CA C 1.171 -2.099 1.078 1.00 . A A . 4 THR CA 1 1
3 487 1 1 4 THR CB C 1.597 -1.866 -0.390 1.00 . A A . 4 THR CB 1 1
3 488 1 1 4 THR CG2 C 0.420 -2.086 -1.333 1.00 . A A . 4 THR CG2 1 1
3 489 1 1 4 THR H H 0.093 -0.317 1.030 1.00 . A A . 4 THR H 1 1
3 490 1 1 4 THR HA H 0.755 -3.094 1.144 1.00 . A A . 4 THR HA 1 1
3 491 1 1 4 THR HB H 2.379 -2.568 -0.636 1.00 . A A . 4 THR HB 1 1
3 492 1 1 4 THR HG1 H 3.072 -0.601 -0.471 1.00 . A A . 4 THR HG1 1 1
3 493 1 1 4 THR HG21 H 0.739 -1.918 -2.352 1.00 . A A . 4 THR HG21 1 1
3 494 1 1 4 THR HG22 H -0.372 -1.396 -1.085 1.00 . A A . 4 THR HG22 1 1
3 495 1 1 4 THR HG23 H 0.064 -3.099 -1.228 1.00 . A A . 4 THR HG23 1 1
3 496 1 1 4 THR N N 0.143 -1.187 1.482 1.00 . A A . 4 THR N 1 1
3 497 1 1 4 THR O O 2.876 -0.929 2.336 1.00 . A A . 4 THR O 1 1
3 498 1 1 4 THR OG1 O 2.113 -0.526 -0.563 1.00 . A A . 4 THR OG1 1 1
3 499 1 1 5 LYS C C 5.275 -3.204 2.160 1.00 . A A . 5 LYS C 1 1
3 500 1 1 5 LYS CA C 4.102 -3.279 3.120 1.00 . A A . 5 LYS CA 1 1
3 501 1 1 5 LYS CB C 4.147 -4.549 3.994 1.00 . A A . 5 LYS CB 1 1
3 502 1 1 5 LYS CD C 3.898 -7.061 4.201 1.00 . A A . 5 LYS CD 1 1
3 503 1 1 5 LYS CE C 5.284 -7.363 4.760 1.00 . A A . 5 LYS CE 1 1
3 504 1 1 5 LYS CG C 3.896 -5.859 3.252 1.00 . A A . 5 LYS CG 1 1
3 505 1 1 5 LYS H H 2.381 -4.003 2.149 1.00 . A A . 5 LYS H 1 1
3 506 1 1 5 LYS HA H 4.143 -2.407 3.754 1.00 . A A . 5 LYS HA 1 1
3 507 1 1 5 LYS HB2 H 5.128 -4.609 4.440 1.00 . A A . 5 LYS HB2 1 1
3 508 1 1 5 LYS HB3 H 3.415 -4.456 4.782 1.00 . A A . 5 LYS HB3 1 1
3 509 1 1 5 LYS HD2 H 3.232 -6.853 5.023 1.00 . A A . 5 LYS HD2 1 1
3 510 1 1 5 LYS HD3 H 3.540 -7.929 3.669 1.00 . A A . 5 LYS HD3 1 1
3 511 1 1 5 LYS HE2 H 5.679 -6.474 5.228 1.00 . A A . 5 LYS HE2 1 1
3 512 1 1 5 LYS HE3 H 5.200 -8.142 5.503 1.00 . A A . 5 LYS HE3 1 1
3 513 1 1 5 LYS HG2 H 2.939 -5.805 2.759 1.00 . A A . 5 LYS HG2 1 1
3 514 1 1 5 LYS HG3 H 4.672 -5.992 2.513 1.00 . A A . 5 LYS HG3 1 1
3 515 1 1 5 LYS HZ1 H 5.901 -8.684 3.253 1.00 . A A . 5 LYS HZ1 1 1
3 516 1 1 5 LYS HZ2 H 7.167 -7.973 4.101 1.00 . A A . 5 LYS HZ2 1 1
3 517 1 1 5 LYS HZ3 H 6.310 -7.081 2.969 1.00 . A A . 5 LYS HZ3 1 1
3 518 1 1 5 LYS N N 2.877 -3.187 2.372 1.00 . A A . 5 LYS N 1 1
3 519 1 1 5 LYS NZ N 6.219 -7.807 3.707 1.00 . A A . 5 LYS NZ 1 1
3 520 1 1 5 LYS O O 6.375 -2.815 2.534 1.00 . A A . 5 LYS O 1 1
3 521 1 1 6 SER C C 6.038 -2.004 -0.615 1.00 . A A . 6 SER C 1 1
3 522 1 1 6 SER CA C 6.022 -3.442 -0.103 1.00 . A A . 6 SER CA 1 1
3 523 1 1 6 SER CB C 5.755 -4.449 -1.236 1.00 . A A . 6 SER CB 1 1
3 524 1 1 6 SER H H 4.139 -3.894 0.667 1.00 . A A . 6 SER H 1 1
3 525 1 1 6 SER HA H 6.975 -3.658 0.353 1.00 . A A . 6 SER HA 1 1
3 526 1 1 6 SER HB2 H 6.448 -4.266 -2.045 1.00 . A A . 6 SER HB2 1 1
3 527 1 1 6 SER HB3 H 5.901 -5.451 -0.861 1.00 . A A . 6 SER HB3 1 1
3 528 1 1 6 SER HG H 3.879 -4.965 -1.261 1.00 . A A . 6 SER HG 1 1
3 529 1 1 6 SER N N 5.025 -3.557 0.913 1.00 . A A . 6 SER N 1 1
3 530 1 1 6 SER O O 4.965 -1.388 -0.827 1.00 . A A . 6 SER O 1 1
3 531 1 1 6 SER OG O 4.425 -4.332 -1.742 1.00 . A A . 6 SER OG 1 1
3 532 1 1 7 ILE C C 7.221 -0.025 -2.748 1.00 . A A . 7 ILE C 1 1
3 533 1 1 7 ILE CA C 7.349 -0.096 -1.232 1.00 . A A . 7 ILE CA 1 1
3 534 1 1 7 ILE CB C 8.675 0.561 -0.761 1.00 . A A . 7 ILE CB 1 1
3 535 1 1 7 ILE CD1 C 11.228 0.424 -0.916 1.00 . A A . 7 ILE CD1 1 1
3 536 1 1 7 ILE CG1 C 9.902 -0.234 -1.241 1.00 . A A . 7 ILE CG1 1 1
3 537 1 1 7 ILE CG2 C 8.678 0.709 0.756 1.00 . A A . 7 ILE CG2 1 1
3 538 1 1 7 ILE H H 8.014 -2.004 -0.621 1.00 . A A . 7 ILE H 1 1
3 539 1 1 7 ILE HA H 6.520 0.454 -0.809 1.00 . A A . 7 ILE HA 1 1
3 540 1 1 7 ILE HB H 8.714 1.555 -1.179 1.00 . A A . 7 ILE HB 1 1
3 541 1 1 7 ILE HD11 H 11.282 1.386 -1.403 1.00 . A A . 7 ILE HD11 1 1
3 542 1 1 7 ILE HD12 H 12.035 -0.203 -1.260 1.00 . A A . 7 ILE HD12 1 1
3 543 1 1 7 ILE HD13 H 11.306 0.559 0.153 1.00 . A A . 7 ILE HD13 1 1
3 544 1 1 7 ILE HG12 H 9.898 -1.203 -0.768 1.00 . A A . 7 ILE HG12 1 1
3 545 1 1 7 ILE HG13 H 9.843 -0.358 -2.313 1.00 . A A . 7 ILE HG13 1 1
3 546 1 1 7 ILE HG21 H 9.607 1.165 1.067 1.00 . A A . 7 ILE HG21 1 1
3 547 1 1 7 ILE HG22 H 8.586 -0.266 1.210 1.00 . A A . 7 ILE HG22 1 1
3 548 1 1 7 ILE HG23 H 7.850 1.329 1.063 1.00 . A A . 7 ILE HG23 1 1
3 549 1 1 7 ILE N N 7.213 -1.459 -0.781 1.00 . A A . 7 ILE N 1 1
3 550 1 1 7 ILE O O 7.506 -1.013 -3.433 1.00 . A A . 7 ILE O 1 1
3 551 1 1 8 PRO C C 5.035 2.057 -1.747 1.00 . A A . 8 PRO C 1 1
3 552 1 1 8 PRO CA C 6.337 2.298 -2.534 1.00 . A A . 8 PRO CA 1 1
3 553 1 1 8 PRO CB C 6.115 3.357 -3.620 1.00 . A A . 8 PRO CB 1 1
3 554 1 1 8 PRO CD C 6.606 1.321 -4.755 1.00 . A A . 8 PRO CD 1 1
3 555 1 1 8 PRO CG C 5.790 2.578 -4.843 1.00 . A A . 8 PRO CG 1 1
3 556 1 1 8 PRO HA H 7.107 2.624 -1.851 1.00 . A A . 8 PRO HA 1 1
3 557 1 1 8 PRO HB2 H 5.296 4.000 -3.330 1.00 . A A . 8 PRO HB2 1 1
3 558 1 1 8 PRO HB3 H 7.009 3.946 -3.751 1.00 . A A . 8 PRO HB3 1 1
3 559 1 1 8 PRO HD2 H 6.080 0.495 -5.213 1.00 . A A . 8 PRO HD2 1 1
3 560 1 1 8 PRO HD3 H 7.570 1.462 -5.221 1.00 . A A . 8 PRO HD3 1 1
3 561 1 1 8 PRO HG2 H 4.737 2.343 -4.859 1.00 . A A . 8 PRO HG2 1 1
3 562 1 1 8 PRO HG3 H 6.064 3.144 -5.720 1.00 . A A . 8 PRO HG3 1 1
3 563 1 1 8 PRO N N 6.755 1.107 -3.304 1.00 . A A . 8 PRO N 1 1
3 564 1 1 8 PRO O O 4.222 1.207 -2.135 1.00 . A A . 8 PRO O 1 1
3 565 1 1 9 PRO C C 2.392 3.112 -0.540 1.00 . A A . 9 PRO C 1 1
3 566 1 1 9 PRO CA C 3.641 2.635 0.204 1.00 . A A . 9 PRO CA 1 1
3 567 1 1 9 PRO CB C 3.922 3.522 1.423 1.00 . A A . 9 PRO CB 1 1
3 568 1 1 9 PRO CD C 5.793 3.745 -0.046 1.00 . A A . 9 PRO CD 1 1
3 569 1 1 9 PRO CG C 4.969 4.480 0.970 1.00 . A A . 9 PRO CG 1 1
3 570 1 1 9 PRO HA H 3.494 1.611 0.515 1.00 . A A . 9 PRO HA 1 1
3 571 1 1 9 PRO HB2 H 3.015 4.029 1.713 1.00 . A A . 9 PRO HB2 1 1
3 572 1 1 9 PRO HB3 H 4.277 2.907 2.239 1.00 . A A . 9 PRO HB3 1 1
3 573 1 1 9 PRO HD2 H 6.148 4.423 -0.809 1.00 . A A . 9 PRO HD2 1 1
3 574 1 1 9 PRO HD3 H 6.622 3.242 0.430 1.00 . A A . 9 PRO HD3 1 1
3 575 1 1 9 PRO HG2 H 4.503 5.344 0.520 1.00 . A A . 9 PRO HG2 1 1
3 576 1 1 9 PRO HG3 H 5.583 4.779 1.807 1.00 . A A . 9 PRO HG3 1 1
3 577 1 1 9 PRO N N 4.845 2.765 -0.616 1.00 . A A . 9 PRO N 1 1
3 578 1 1 9 PRO O O 2.187 4.315 -0.760 1.00 . A A . 9 PRO O 1 1
3 579 1 1 10 ARG C C -0.748 2.064 -0.803 1.00 . A A . 10 ARG C 1 1
3 580 1 1 10 ARG CA C 0.399 2.424 -1.694 1.00 . A A . 10 ARG CA 1 1
3 581 1 1 10 ARG CB C 0.383 1.562 -2.951 1.00 . A A . 10 ARG CB 1 1
3 582 1 1 10 ARG CD C 1.860 0.777 -4.808 1.00 . A A . 10 ARG CD 1 1
3 583 1 1 10 ARG CG C 1.397 1.976 -4.004 1.00 . A A . 10 ARG CG 1 1
3 584 1 1 10 ARG CZ C 2.754 -1.436 -4.039 1.00 . A A . 10 ARG CZ 1 1
3 585 1 1 10 ARG H H 1.829 1.232 -0.780 1.00 . A A . 10 ARG H 1 1
3 586 1 1 10 ARG HA H 0.358 3.467 -1.968 1.00 . A A . 10 ARG HA 1 1
3 587 1 1 10 ARG HB2 H 0.588 0.540 -2.669 1.00 . A A . 10 ARG HB2 1 1
3 588 1 1 10 ARG HB3 H -0.604 1.609 -3.391 1.00 . A A . 10 ARG HB3 1 1
3 589 1 1 10 ARG HD2 H 0.992 0.232 -5.147 1.00 . A A . 10 ARG HD2 1 1
3 590 1 1 10 ARG HD3 H 2.437 1.110 -5.657 1.00 . A A . 10 ARG HD3 1 1
3 591 1 1 10 ARG HE H 3.256 0.386 -3.328 1.00 . A A . 10 ARG HE 1 1
3 592 1 1 10 ARG HG2 H 0.945 2.697 -4.669 1.00 . A A . 10 ARG HG2 1 1
3 593 1 1 10 ARG HG3 H 2.250 2.422 -3.511 1.00 . A A . 10 ARG HG3 1 1
3 594 1 1 10 ARG HH11 H 1.325 -1.649 -5.494 1.00 . A A . 10 ARG HH11 1 1
3 595 1 1 10 ARG HH12 H 1.978 -3.111 -4.943 1.00 . A A . 10 ARG HH12 1 1
3 596 1 1 10 ARG HH21 H 4.175 -1.602 -2.571 1.00 . A A . 10 ARG HH21 1 1
3 597 1 1 10 ARG HH22 H 3.680 -3.090 -3.185 1.00 . A A . 10 ARG HH22 1 1
3 598 1 1 10 ARG N N 1.610 2.174 -0.969 1.00 . A A . 10 ARG N 1 1
3 599 1 1 10 ARG NE N 2.696 -0.104 -3.979 1.00 . A A . 10 ARG NE 1 1
3 600 1 1 10 ARG NH1 N 1.975 -2.110 -4.883 1.00 . A A . 10 ARG NH1 1 1
3 601 1 1 10 ARG NH2 N 3.588 -2.089 -3.226 1.00 . A A . 10 ARG NH2 1 1
3 602 1 1 10 ARG O O -0.783 0.961 -0.247 1.00 . A A . 10 ARG O 1 1
3 603 1 1 11 ALA C C -4.054 2.891 -0.478 1.00 . A A . 11 ALA C 1 1
3 604 1 1 11 ALA CA C -2.759 2.714 0.257 1.00 . A A . 11 ALA CA 1 1
3 605 1 1 11 ALA CB C -2.716 3.541 1.564 1.00 . A A . 11 ALA CB 1 1
3 606 1 1 11 ALA H H -1.599 3.841 -1.075 1.00 . A A . 11 ALA H 1 1
3 607 1 1 11 ALA HA H -2.687 1.668 0.515 1.00 . A A . 11 ALA HA 1 1
3 608 1 1 11 ALA HB1 H -3.496 3.183 2.217 1.00 . A A . 11 ALA HB1 1 1
3 609 1 1 11 ALA HB2 H -2.891 4.589 1.400 1.00 . A A . 11 ALA HB2 1 1
3 610 1 1 11 ALA N N -1.655 2.979 -0.610 1.00 . A A . 11 ALA N 1 1
3 611 1 1 11 ALA O O -4.147 3.681 -1.424 1.00 . A A . 11 ALA O 1 1
3 612 1 1 12 PHE C C -7.382 2.496 0.307 1.00 . A A . 12 PHE C 1 1
3 613 1 1 12 PHE CA C -6.317 2.110 -0.700 1.00 . A A . 12 PHE CA 1 1
3 614 1 1 12 PHE CB C -6.583 0.702 -1.249 1.00 . A A . 12 PHE CB 1 1
3 615 1 1 12 PHE CD1 C -5.695 0.448 -3.578 1.00 . A A . 12 PHE CD1 1 1
3 616 1 1 12 PHE CD2 C -4.398 -0.447 -1.796 1.00 . A A . 12 PHE CD2 1 1
3 617 1 1 12 PHE CE1 C -4.746 0.024 -4.476 1.00 . A A . 12 PHE CE1 1 1
3 618 1 1 12 PHE CE2 C -3.448 -0.874 -2.692 1.00 . A A . 12 PHE CE2 1 1
3 619 1 1 12 PHE CG C -5.539 0.223 -2.230 1.00 . A A . 12 PHE CG 1 1
3 620 1 1 12 PHE CZ C -3.622 -0.638 -4.035 1.00 . A A . 12 PHE CZ 1 1
3 621 1 1 12 PHE H H -4.872 1.587 0.735 1.00 . A A . 12 PHE H 1 1
3 622 1 1 12 PHE HA H -6.312 2.814 -1.518 1.00 . A A . 12 PHE HA 1 1
3 623 1 1 12 PHE HB2 H -6.636 0.006 -0.428 1.00 . A A . 12 PHE HB2 1 1
3 624 1 1 12 PHE HB3 H -7.536 0.707 -1.756 1.00 . A A . 12 PHE HB3 1 1
3 625 1 1 12 PHE HD1 H -6.573 0.967 -3.930 1.00 . A A . 12 PHE HD1 1 1
3 626 1 1 12 PHE HD2 H -4.248 -0.634 -0.744 1.00 . A A . 12 PHE HD2 1 1
3 627 1 1 12 PHE HE1 H -4.883 0.208 -5.531 1.00 . A A . 12 PHE HE1 1 1
3 628 1 1 12 PHE HE2 H -2.567 -1.395 -2.343 1.00 . A A . 12 PHE HE2 1 1
3 629 1 1 12 PHE HZ H -2.878 -0.972 -4.744 1.00 . A A . 12 PHE HZ 1 1
3 630 1 1 12 PHE N N -5.031 2.146 -0.062 1.00 . A A . 12 PHE N 1 1
3 631 1 1 12 PHE O O -7.329 2.044 1.464 1.00 . A A . 12 PHE O 1 1
3 632 1 1 13 PRO C C -10.349 2.840 1.442 1.00 . A A . 13 PRO C 1 1
3 633 1 1 13 PRO CA C -9.426 3.866 0.769 1.00 . A A . 13 PRO CA 1 1
3 634 1 1 13 PRO CB C -10.239 4.763 -0.163 1.00 . A A . 13 PRO CB 1 1
3 635 1 1 13 PRO CD C -8.566 3.752 -1.509 1.00 . A A . 13 PRO CD 1 1
3 636 1 1 13 PRO CG C -9.987 4.220 -1.521 1.00 . A A . 13 PRO CG 1 1
3 637 1 1 13 PRO HA H -8.982 4.482 1.539 1.00 . A A . 13 PRO HA 1 1
3 638 1 1 13 PRO HB2 H -11.283 4.700 0.107 1.00 . A A . 13 PRO HB2 1 1
3 639 1 1 13 PRO HB3 H -9.900 5.785 -0.074 1.00 . A A . 13 PRO HB3 1 1
3 640 1 1 13 PRO HD2 H -8.428 2.935 -2.200 1.00 . A A . 13 PRO HD2 1 1
3 641 1 1 13 PRO HD3 H -7.896 4.566 -1.740 1.00 . A A . 13 PRO HD3 1 1
3 642 1 1 13 PRO HG2 H -10.654 3.392 -1.713 1.00 . A A . 13 PRO HG2 1 1
3 643 1 1 13 PRO HG3 H -10.124 4.993 -2.262 1.00 . A A . 13 PRO HG3 1 1
3 644 1 1 13 PRO N N -8.379 3.302 -0.116 1.00 . A A . 13 PRO N 1 1
3 645 1 1 13 PRO O O -11.224 3.212 2.227 1.00 . A A . 13 PRO O 1 1
3 646 1 1 14 ASP C C -10.216 -0.040 2.969 1.00 . A A . 14 ASP C 1 1
3 647 1 1 14 ASP CA C -10.993 0.558 1.797 1.00 . A A . 14 ASP CA 1 1
3 648 1 1 14 ASP CB C -11.469 -0.538 0.831 1.00 . A A . 14 ASP CB 1 1
3 649 1 1 14 ASP CG C -10.394 -1.499 0.414 1.00 . A A . 14 ASP CG 1 1
3 650 1 1 14 ASP H H -9.520 1.312 0.464 1.00 . A A . 14 ASP H 1 1
3 651 1 1 14 ASP HA H -11.850 1.071 2.207 1.00 . A A . 14 ASP HA 1 1
3 652 1 1 14 ASP HB2 H -12.255 -1.106 1.301 1.00 . A A . 14 ASP HB2 1 1
3 653 1 1 14 ASP HB3 H -11.867 -0.068 -0.056 1.00 . A A . 14 ASP HB3 1 1
3 654 1 1 14 ASP N N -10.186 1.571 1.139 1.00 . A A . 14 ASP N 1 1
3 655 1 1 14 ASP O O -10.662 -0.991 3.619 1.00 . A A . 14 ASP O 1 1
3 656 1 1 14 ASP OD1 O -9.555 -1.141 -0.434 1.00 . A A . 14 ASP OD1 1 1
3 657 1 1 14 ASP OD2 O -10.396 -2.652 0.908 1.00 . A A . 14 ASP OD2 1 1
3 658 2 2 1 . C C -2.043 1.722 3.929 1.00 . B A . 101 WMH C 1 1
3 659 2 2 1 . C1 C -1.411 3.436 2.317 1.00 . B A . 101 WMH C1 1 1
3 660 2 2 1 . C2 C -0.264 4.109 2.041 1.00 . B A . 101 WMH C2 1 1
3 661 2 2 1 . H1 H -2.369 2.134 4.868 1.00 . B A . 101 WMH H1 1 1
3 662 2 2 1 . H2 H -2.911 1.687 3.292 1.00 . B A . 101 WMH H2 1 1
3 663 2 2 1 . H5 H -0.140 4.859 1.274 1.00 . B A . 101 WMH H5 1 1
3 664 2 2 1 . N N -1.155 2.607 3.320 1.00 . B A . 101 WMH N 1 1
3 665 2 2 1 . N1 N 0.678 3.684 2.874 1.00 . B A . 101 WMH N1 1 1
3 666 2 2 1 . N2 N 0.190 2.785 3.657 1.00 . B A . 101 WMH N2 1 1
4 667 1 1 1 GLY C C -7.233 -1.445 3.445 1.00 . A A . 1 GLY C 1 1
4 668 1 1 1 GLY CA C -8.302 -0.665 4.117 1.00 . A A . 1 GLY CA 1 1
4 669 1 1 1 GLY H1 H -8.813 0.917 2.840 1.00 . A A . 1 GLY H1 1 1
4 670 1 1 1 GLY HA2 H -7.871 0.038 4.812 1.00 . A A . 1 GLY HA2 1 1
4 671 1 1 1 GLY HA3 H -8.942 -1.349 4.652 1.00 . A A . 1 GLY HA3 1 1
4 672 1 1 1 GLY N N -9.069 0.013 3.123 1.00 . A A . 1 GLY N 1 1
4 673 1 1 1 GLY O O -7.213 -2.677 3.501 1.00 . A A . 1 GLY O 1 1
4 674 1 1 2 ARG C C -4.116 -0.534 1.979 1.00 . A A . 2 ARG C 1 1
4 675 1 1 2 ARG CA C -5.347 -1.394 1.989 1.00 . A A . 2 ARG CA 1 1
4 676 1 1 2 ARG CB C -5.834 -1.579 0.561 1.00 . A A . 2 ARG CB 1 1
4 677 1 1 2 ARG CD C -5.528 -2.590 -1.710 1.00 . A A . 2 ARG CD 1 1
4 678 1 1 2 ARG CG C -4.989 -2.512 -0.288 1.00 . A A . 2 ARG CG 1 1
4 679 1 1 2 ARG CZ C -7.605 -3.624 -2.634 1.00 . A A . 2 ARG CZ 1 1
4 680 1 1 2 ARG H H -6.404 0.232 2.758 1.00 . A A . 2 ARG H 1 1
4 681 1 1 2 ARG HA H -5.136 -2.362 2.411 1.00 . A A . 2 ARG HA 1 1
4 682 1 1 2 ARG HB2 H -6.844 -1.954 0.592 1.00 . A A . 2 ARG HB2 1 1
4 683 1 1 2 ARG HB3 H -5.844 -0.609 0.089 1.00 . A A . 2 ARG HB3 1 1
4 684 1 1 2 ARG HD2 H -5.343 -1.653 -2.215 1.00 . A A . 2 ARG HD2 1 1
4 685 1 1 2 ARG HD3 H -5.011 -3.387 -2.223 1.00 . A A . 2 ARG HD3 1 1
4 686 1 1 2 ARG HE H -7.507 -2.435 -1.028 1.00 . A A . 2 ARG HE 1 1
4 687 1 1 2 ARG HG2 H -3.974 -2.145 -0.313 1.00 . A A . 2 ARG HG2 1 1
4 688 1 1 2 ARG HG3 H -5.007 -3.499 0.151 1.00 . A A . 2 ARG HG3 1 1
4 689 1 1 2 ARG HH11 H -5.950 -4.071 -3.746 1.00 . A A . 2 ARG HH11 1 1
4 690 1 1 2 ARG HH12 H -7.373 -4.782 -4.324 1.00 . A A . 2 ARG HH12 1 1
4 691 1 1 2 ARG HH21 H -9.391 -3.330 -1.756 1.00 . A A . 2 ARG HH21 1 1
4 692 1 1 2 ARG HH22 H -9.461 -4.326 -3.160 1.00 . A A . 2 ARG HH22 1 1
4 693 1 1 2 ARG N N -6.371 -0.750 2.753 1.00 . A A . 2 ARG N 1 1
4 694 1 1 2 ARG NE N -6.973 -2.870 -1.737 1.00 . A A . 2 ARG NE 1 1
4 695 1 1 2 ARG NH1 N -6.940 -4.197 -3.636 1.00 . A A . 2 ARG NH1 1 1
4 696 1 1 2 ARG NH2 N -8.911 -3.784 -2.521 1.00 . A A . 2 ARG NH2 1 1
4 697 1 1 2 ARG O O -4.154 0.590 1.510 1.00 . A A . 2 ARG O 1 1
4 698 1 1 3 ALA C C -0.735 -1.399 2.226 1.00 . A A . 3 ALA C 1 1
4 699 1 1 3 ALA CA C -1.788 -0.382 2.520 1.00 . A A . 3 ALA CA 1 1
4 700 1 1 3 ALA CB C -1.534 0.303 3.872 1.00 . A A . 3 ALA CB 1 1
4 701 1 1 3 ALA H H -3.129 -1.903 2.993 1.00 . A A . 3 ALA H 1 1
4 702 1 1 3 ALA HA H -1.792 0.364 1.739 1.00 . A A . 3 ALA HA 1 1
4 703 1 1 3 ALA HB1 H -0.470 0.308 4.060 1.00 . A A . 3 ALA HB1 1 1
4 704 1 1 3 ALA HB2 H -2.025 -0.263 4.651 1.00 . A A . 3 ALA HB2 1 1
4 705 1 1 3 ALA N N -3.066 -1.040 2.530 1.00 . A A . 3 ALA N 1 1
4 706 1 1 3 ALA O O -0.755 -2.504 2.797 1.00 . A A . 3 ALA O 1 1
4 707 1 1 4 THR C C 2.387 -1.719 1.917 1.00 . A A . 4 THR C 1 1
4 708 1 1 4 THR CA C 1.208 -1.969 1.004 1.00 . A A . 4 THR CA 1 1
4 709 1 1 4 THR CB C 1.618 -1.846 -0.483 1.00 . A A . 4 THR CB 1 1
4 710 1 1 4 THR CG2 C 0.527 -2.396 -1.393 1.00 . A A . 4 THR CG2 1 1
4 711 1 1 4 THR H H 0.100 -0.228 0.846 1.00 . A A . 4 THR H 1 1
4 712 1 1 4 THR HA H 0.850 -2.972 1.181 1.00 . A A . 4 THR HA 1 1
4 713 1 1 4 THR HB H 2.522 -2.416 -0.635 1.00 . A A . 4 THR HB 1 1
4 714 1 1 4 THR HG1 H 2.736 -0.445 -1.245 1.00 . A A . 4 THR HG1 1 1
4 715 1 1 4 THR HG21 H 0.834 -2.295 -2.424 1.00 . A A . 4 THR HG21 1 1
4 716 1 1 4 THR HG22 H -0.386 -1.841 -1.234 1.00 . A A . 4 THR HG22 1 1
4 717 1 1 4 THR HG23 H 0.360 -3.438 -1.168 1.00 . A A . 4 THR HG23 1 1
4 718 1 1 4 THR N N 0.147 -1.081 1.331 1.00 . A A . 4 THR N 1 1
4 719 1 1 4 THR O O 2.795 -0.565 2.137 1.00 . A A . 4 THR O 1 1
4 720 1 1 4 THR OG1 O 1.869 -0.472 -0.815 1.00 . A A . 4 THR OG1 1 1
4 721 1 1 5 LYS C C 5.263 -2.658 2.531 1.00 . A A . 5 LYS C 1 1
4 722 1 1 5 LYS CA C 4.022 -2.695 3.381 1.00 . A A . 5 LYS CA 1 1
4 723 1 1 5 LYS CB C 4.037 -3.900 4.328 1.00 . A A . 5 LYS CB 1 1
4 724 1 1 5 LYS CD C 2.699 -5.237 6.028 1.00 . A A . 5 LYS CD 1 1
4 725 1 1 5 LYS CE C 3.725 -5.180 7.140 1.00 . A A . 5 LYS CE 1 1
4 726 1 1 5 LYS CG C 2.751 -4.016 5.126 1.00 . A A . 5 LYS CG 1 1
4 727 1 1 5 LYS H H 2.468 -3.646 2.322 1.00 . A A . 5 LYS H 1 1
4 728 1 1 5 LYS HA H 3.954 -1.782 3.954 1.00 . A A . 5 LYS HA 1 1
4 729 1 1 5 LYS HB2 H 4.171 -4.802 3.749 1.00 . A A . 5 LYS HB2 1 1
4 730 1 1 5 LYS HB3 H 4.861 -3.795 5.020 1.00 . A A . 5 LYS HB3 1 1
4 731 1 1 5 LYS HD2 H 1.716 -5.310 6.469 1.00 . A A . 5 LYS HD2 1 1
4 732 1 1 5 LYS HD3 H 2.885 -6.116 5.430 1.00 . A A . 5 LYS HD3 1 1
4 733 1 1 5 LYS HE2 H 4.711 -5.260 6.706 1.00 . A A . 5 LYS HE2 1 1
4 734 1 1 5 LYS HE3 H 3.631 -4.237 7.658 1.00 . A A . 5 LYS HE3 1 1
4 735 1 1 5 LYS HG2 H 2.654 -3.138 5.747 1.00 . A A . 5 LYS HG2 1 1
4 736 1 1 5 LYS HG3 H 1.928 -4.054 4.428 1.00 . A A . 5 LYS HG3 1 1
4 737 1 1 5 LYS HZ1 H 4.250 -6.254 8.852 1.00 . A A . 5 LYS HZ1 1 1
4 738 1 1 5 LYS HZ2 H 3.595 -7.206 7.623 1.00 . A A . 5 LYS HZ2 1 1
4 739 1 1 5 LYS HZ3 H 2.593 -6.209 8.537 1.00 . A A . 5 LYS HZ3 1 1
4 740 1 1 5 LYS N N 2.882 -2.774 2.502 1.00 . A A . 5 LYS N 1 1
4 741 1 1 5 LYS NZ N 3.534 -6.282 8.099 1.00 . A A . 5 LYS NZ 1 1
4 742 1 1 5 LYS O O 6.253 -1.992 2.859 1.00 . A A . 5 LYS O 1 1
4 743 1 1 6 SER C C 6.209 -2.083 -0.339 1.00 . A A . 6 SER C 1 1
4 744 1 1 6 SER CA C 6.211 -3.388 0.458 1.00 . A A . 6 SER CA 1 1
4 745 1 1 6 SER CB C 5.959 -4.601 -0.430 1.00 . A A . 6 SER CB 1 1
4 746 1 1 6 SER H H 4.372 -3.855 1.202 1.00 . A A . 6 SER H 1 1
4 747 1 1 6 SER HA H 7.156 -3.516 0.964 1.00 . A A . 6 SER HA 1 1
4 748 1 1 6 SER HB2 H 6.544 -4.516 -1.333 1.00 . A A . 6 SER HB2 1 1
4 749 1 1 6 SER HB3 H 6.229 -5.502 0.099 1.00 . A A . 6 SER HB3 1 1
4 750 1 1 6 SER HG H 4.525 -5.119 -1.646 1.00 . A A . 6 SER HG 1 1
4 751 1 1 6 SER N N 5.182 -3.345 1.425 1.00 . A A . 6 SER N 1 1
4 752 1 1 6 SER O O 5.140 -1.522 -0.624 1.00 . A A . 6 SER O 1 1
4 753 1 1 6 SER OG O 4.581 -4.674 -0.791 1.00 . A A . 6 SER OG 1 1
4 754 1 1 7 ILE C C 7.167 -0.583 -2.880 1.00 . A A . 7 ILE C 1 1
4 755 1 1 7 ILE CA C 7.473 -0.346 -1.398 1.00 . A A . 7 ILE CA 1 1
4 756 1 1 7 ILE CB C 8.855 0.332 -1.227 1.00 . A A . 7 ILE CB 1 1
4 757 1 1 7 ILE CD1 C 11.347 0.120 -1.778 1.00 . A A . 7 ILE CD1 1 1
4 758 1 1 7 ILE CG1 C 9.984 -0.542 -1.798 1.00 . A A . 7 ILE CG1 1 1
4 759 1 1 7 ILE CG2 C 9.097 0.616 0.248 1.00 . A A . 7 ILE CG2 1 1
4 760 1 1 7 ILE H H 8.194 -2.063 -0.412 1.00 . A A . 7 ILE H 1 1
4 761 1 1 7 ILE HA H 6.710 0.310 -1.003 1.00 . A A . 7 ILE HA 1 1
4 762 1 1 7 ILE HB H 8.834 1.277 -1.750 1.00 . A A . 7 ILE HB 1 1
4 763 1 1 7 ILE HD11 H 11.317 1.020 -2.373 1.00 . A A . 7 ILE HD11 1 1
4 764 1 1 7 ILE HD12 H 12.082 -0.558 -2.186 1.00 . A A . 7 ILE HD12 1 1
4 765 1 1 7 ILE HD13 H 11.608 0.369 -0.762 1.00 . A A . 7 ILE HD13 1 1
4 766 1 1 7 ILE HG12 H 10.052 -1.449 -1.217 1.00 . A A . 7 ILE HG12 1 1
4 767 1 1 7 ILE HG13 H 9.748 -0.796 -2.821 1.00 . A A . 7 ILE HG13 1 1
4 768 1 1 7 ILE HG21 H 8.319 1.263 0.626 1.00 . A A . 7 ILE HG21 1 1
4 769 1 1 7 ILE HG22 H 10.054 1.099 0.366 1.00 . A A . 7 ILE HG22 1 1
4 770 1 1 7 ILE HG23 H 9.091 -0.313 0.798 1.00 . A A . 7 ILE HG23 1 1
4 771 1 1 7 ILE N N 7.376 -1.584 -0.663 1.00 . A A . 7 ILE N 1 1
4 772 1 1 7 ILE O O 7.477 -1.652 -3.410 1.00 . A A . 7 ILE O 1 1
4 773 1 1 8 PRO C C 4.857 1.501 -2.047 1.00 . A A . 8 PRO C 1 1
4 774 1 1 8 PRO CA C 6.089 1.657 -2.972 1.00 . A A . 8 PRO CA 1 1
4 775 1 1 8 PRO CB C 5.715 2.486 -4.200 1.00 . A A . 8 PRO CB 1 1
4 776 1 1 8 PRO CD C 6.183 0.288 -4.994 1.00 . A A . 8 PRO CD 1 1
4 777 1 1 8 PRO CG C 5.306 1.481 -5.218 1.00 . A A . 8 PRO CG 1 1
4 778 1 1 8 PRO HA H 6.904 2.132 -2.448 1.00 . A A . 8 PRO HA 1 1
4 779 1 1 8 PRO HB2 H 4.900 3.146 -3.945 1.00 . A A . 8 PRO HB2 1 1
4 780 1 1 8 PRO HB3 H 6.565 3.063 -4.531 1.00 . A A . 8 PRO HB3 1 1
4 781 1 1 8 PRO HD2 H 5.644 -0.623 -5.206 1.00 . A A . 8 PRO HD2 1 1
4 782 1 1 8 PRO HD3 H 7.071 0.350 -5.605 1.00 . A A . 8 PRO HD3 1 1
4 783 1 1 8 PRO HG2 H 4.269 1.215 -5.069 1.00 . A A . 8 PRO HG2 1 1
4 784 1 1 8 PRO HG3 H 5.449 1.875 -6.213 1.00 . A A . 8 PRO HG3 1 1
4 785 1 1 8 PRO N N 6.527 0.375 -3.562 1.00 . A A . 8 PRO N 1 1
4 786 1 1 8 PRO O O 3.940 0.718 -2.354 1.00 . A A . 8 PRO O 1 1
4 787 1 1 9 PRO C C 2.510 2.966 -0.529 1.00 . A A . 9 PRO C 1 1
4 788 1 1 9 PRO CA C 3.697 2.175 0.018 1.00 . A A . 9 PRO CA 1 1
4 789 1 1 9 PRO CB C 4.225 2.829 1.308 1.00 . A A . 9 PRO CB 1 1
4 790 1 1 9 PRO CD C 5.874 3.118 -0.412 1.00 . A A . 9 PRO CD 1 1
4 791 1 1 9 PRO CG C 5.682 3.069 1.073 1.00 . A A . 9 PRO CG 1 1
4 792 1 1 9 PRO HA H 3.387 1.158 0.215 1.00 . A A . 9 PRO HA 1 1
4 793 1 1 9 PRO HB2 H 3.695 3.753 1.482 1.00 . A A . 9 PRO HB2 1 1
4 794 1 1 9 PRO HB3 H 4.064 2.159 2.139 1.00 . A A . 9 PRO HB3 1 1
4 795 1 1 9 PRO HD2 H 5.736 4.124 -0.780 1.00 . A A . 9 PRO HD2 1 1
4 796 1 1 9 PRO HD3 H 6.859 2.748 -0.653 1.00 . A A . 9 PRO HD3 1 1
4 797 1 1 9 PRO HG2 H 5.975 4.010 1.517 1.00 . A A . 9 PRO HG2 1 1
4 798 1 1 9 PRO HG3 H 6.259 2.262 1.500 1.00 . A A . 9 PRO HG3 1 1
4 799 1 1 9 PRO N N 4.826 2.215 -0.903 1.00 . A A . 9 PRO N 1 1
4 800 1 1 9 PRO O O 2.514 4.212 -0.548 1.00 . A A . 9 PRO O 1 1
4 801 1 1 10 ARG C C -0.813 2.436 -0.710 1.00 . A A . 10 ARG C 1 1
4 802 1 1 10 ARG CA C 0.354 2.827 -1.577 1.00 . A A . 10 ARG CA 1 1
4 803 1 1 10 ARG CB C 0.148 2.323 -3.006 1.00 . A A . 10 ARG CB 1 1
4 804 1 1 10 ARG CD C 1.049 2.115 -5.337 1.00 . A A . 10 ARG CD 1 1
4 805 1 1 10 ARG CG C 1.268 2.708 -3.962 1.00 . A A . 10 ARG CG 1 1
4 806 1 1 10 ARG CZ C 2.340 1.896 -7.463 1.00 . A A . 10 ARG CZ 1 1
4 807 1 1 10 ARG H H 1.600 1.270 -0.974 1.00 . A A . 10 ARG H 1 1
4 808 1 1 10 ARG HA H 0.463 3.901 -1.585 1.00 . A A . 10 ARG HA 1 1
4 809 1 1 10 ARG HB2 H 0.080 1.245 -2.984 1.00 . A A . 10 ARG HB2 1 1
4 810 1 1 10 ARG HB3 H -0.778 2.724 -3.391 1.00 . A A . 10 ARG HB3 1 1
4 811 1 1 10 ARG HD2 H 1.023 1.039 -5.247 1.00 . A A . 10 ARG HD2 1 1
4 812 1 1 10 ARG HD3 H 0.103 2.469 -5.718 1.00 . A A . 10 ARG HD3 1 1
4 813 1 1 10 ARG HE H 2.674 3.239 -5.974 1.00 . A A . 10 ARG HE 1 1
4 814 1 1 10 ARG HG2 H 1.303 3.785 -4.046 1.00 . A A . 10 ARG HG2 1 1
4 815 1 1 10 ARG HG3 H 2.206 2.348 -3.566 1.00 . A A . 10 ARG HG3 1 1
4 816 1 1 10 ARG HH11 H 0.818 0.520 -7.314 1.00 . A A . 10 ARG HH11 1 1
4 817 1 1 10 ARG HH12 H 1.725 0.429 -8.752 1.00 . A A . 10 ARG HH12 1 1
4 818 1 1 10 ARG HH21 H 3.935 3.091 -7.983 1.00 . A A . 10 ARG HH21 1 1
4 819 1 1 10 ARG HH22 H 3.543 1.910 -9.127 1.00 . A A . 10 ARG HH22 1 1
4 820 1 1 10 ARG N N 1.540 2.252 -1.015 1.00 . A A . 10 ARG N 1 1
4 821 1 1 10 ARG NE N 2.114 2.487 -6.277 1.00 . A A . 10 ARG NE 1 1
4 822 1 1 10 ARG NH1 N 1.578 0.878 -7.866 1.00 . A A . 10 ARG NH1 1 1
4 823 1 1 10 ARG NH2 N 3.333 2.329 -8.239 1.00 . A A . 10 ARG NH2 1 1
4 824 1 1 10 ARG O O -0.923 1.269 -0.303 1.00 . A A . 10 ARG O 1 1
4 825 1 1 11 ALA C C -4.052 3.478 -0.222 1.00 . A A . 11 ALA C 1 1
4 826 1 1 11 ALA CA C -2.771 3.120 0.470 1.00 . A A . 11 ALA CA 1 1
4 827 1 1 11 ALA CB C -2.664 3.827 1.833 1.00 . A A . 11 ALA CB 1 1
4 828 1 1 11 ALA H H -1.518 4.298 -0.722 1.00 . A A . 11 ALA H 1 1
4 829 1 1 11 ALA HA H -2.780 2.053 0.639 1.00 . A A . 11 ALA HA 1 1
4 830 1 1 11 ALA HB1 H -3.452 3.464 2.475 1.00 . A A . 11 ALA HB1 1 1
4 831 1 1 11 ALA HB2 H -2.781 4.893 1.746 1.00 . A A . 11 ALA HB2 1 1
4 832 1 1 11 ALA N N -1.647 3.388 -0.381 1.00 . A A . 11 ALA N 1 1
4 833 1 1 11 ALA O O -4.087 4.386 -1.067 1.00 . A A . 11 ALA O 1 1
4 834 1 1 12 PHE C C -7.438 2.914 0.610 1.00 . A A . 12 PHE C 1 1
4 835 1 1 12 PHE CA C -6.381 2.927 -0.493 1.00 . A A . 12 PHE CA 1 1
4 836 1 1 12 PHE CB C -6.651 1.806 -1.517 1.00 . A A . 12 PHE CB 1 1
4 837 1 1 12 PHE CD1 C -4.562 0.837 -2.532 1.00 . A A . 12 PHE CD1 1 1
4 838 1 1 12 PHE CD2 C -5.741 2.506 -3.756 1.00 . A A . 12 PHE CD2 1 1
4 839 1 1 12 PHE CE1 C -3.626 0.750 -3.539 1.00 . A A . 12 PHE CE1 1 1
4 840 1 1 12 PHE CE2 C -4.805 2.424 -4.767 1.00 . A A . 12 PHE CE2 1 1
4 841 1 1 12 PHE CG C -5.632 1.714 -2.627 1.00 . A A . 12 PHE CG 1 1
4 842 1 1 12 PHE CZ C -3.748 1.545 -4.657 1.00 . A A . 12 PHE CZ 1 1
4 843 1 1 12 PHE H H -4.966 2.074 0.805 1.00 . A A . 12 PHE H 1 1
4 844 1 1 12 PHE HA H -6.397 3.882 -0.995 1.00 . A A . 12 PHE HA 1 1
4 845 1 1 12 PHE HB2 H -6.674 0.856 -1.008 1.00 . A A . 12 PHE HB2 1 1
4 846 1 1 12 PHE HB3 H -7.618 1.977 -1.965 1.00 . A A . 12 PHE HB3 1 1
4 847 1 1 12 PHE HD1 H -4.467 0.217 -1.654 1.00 . A A . 12 PHE HD1 1 1
4 848 1 1 12 PHE HD2 H -6.569 3.195 -3.846 1.00 . A A . 12 PHE HD2 1 1
4 849 1 1 12 PHE HE1 H -2.797 0.062 -3.452 1.00 . A A . 12 PHE HE1 1 1
4 850 1 1 12 PHE HE2 H -4.898 3.046 -5.645 1.00 . A A . 12 PHE HE2 1 1
4 851 1 1 12 PHE HZ H -3.014 1.479 -5.447 1.00 . A A . 12 PHE HZ 1 1
4 852 1 1 12 PHE N N -5.082 2.758 0.104 1.00 . A A . 12 PHE N 1 1
4 853 1 1 12 PHE O O -7.278 2.204 1.623 1.00 . A A . 12 PHE O 1 1
4 854 1 1 13 PRO C C -10.460 2.605 1.739 1.00 . A A . 13 PRO C 1 1
4 855 1 1 13 PRO CA C -9.598 3.846 1.452 1.00 . A A . 13 PRO CA 1 1
4 856 1 1 13 PRO CB C -10.463 4.970 0.877 1.00 . A A . 13 PRO CB 1 1
4 857 1 1 13 PRO CD C -8.885 4.406 -0.815 1.00 . A A . 13 PRO CD 1 1
4 858 1 1 13 PRO CG C -10.303 4.842 -0.593 1.00 . A A . 13 PRO CG 1 1
4 859 1 1 13 PRO HA H -9.165 4.184 2.381 1.00 . A A . 13 PRO HA 1 1
4 860 1 1 13 PRO HB2 H -11.489 4.826 1.181 1.00 . A A . 13 PRO HB2 1 1
4 861 1 1 13 PRO HB3 H -10.105 5.925 1.231 1.00 . A A . 13 PRO HB3 1 1
4 862 1 1 13 PRO HD2 H -8.821 3.767 -1.684 1.00 . A A . 13 PRO HD2 1 1
4 863 1 1 13 PRO HD3 H -8.239 5.263 -0.930 1.00 . A A . 13 PRO HD3 1 1
4 864 1 1 13 PRO HG2 H -10.989 4.100 -0.976 1.00 . A A . 13 PRO HG2 1 1
4 865 1 1 13 PRO HG3 H -10.479 5.797 -1.065 1.00 . A A . 13 PRO HG3 1 1
4 866 1 1 13 PRO N N -8.554 3.660 0.422 1.00 . A A . 13 PRO N 1 1
4 867 1 1 13 PRO O O -11.475 2.694 2.438 1.00 . A A . 13 PRO O 1 1
4 868 1 1 14 ASP C C -10.104 -0.573 2.565 1.00 . A A . 14 ASP C 1 1
4 869 1 1 14 ASP CA C -10.801 0.223 1.473 1.00 . A A . 14 ASP CA 1 1
4 870 1 1 14 ASP CB C -10.913 -0.628 0.196 1.00 . A A . 14 ASP CB 1 1
4 871 1 1 14 ASP CG C -9.604 -1.252 -0.242 1.00 . A A . 14 ASP CG 1 1
4 872 1 1 14 ASP H H -9.258 1.439 0.666 1.00 . A A . 14 ASP H 1 1
4 873 1 1 14 ASP HA H -11.790 0.490 1.814 1.00 . A A . 14 ASP HA 1 1
4 874 1 1 14 ASP HB2 H -11.618 -1.427 0.367 1.00 . A A . 14 ASP HB2 1 1
4 875 1 1 14 ASP HB3 H -11.280 -0.005 -0.606 1.00 . A A . 14 ASP HB3 1 1
4 876 1 1 14 ASP N N -10.066 1.461 1.227 1.00 . A A . 14 ASP N 1 1
4 877 1 1 14 ASP O O -10.513 -1.692 2.910 1.00 . A A . 14 ASP O 1 1
4 878 1 1 14 ASP OD1 O -9.458 -2.492 -0.157 1.00 . A A . 14 ASP OD1 1 1
4 879 1 1 14 ASP OD2 O -8.712 -0.535 -0.684 1.00 . A A . 14 ASP OD2 1 1
4 880 2 2 1 . C C -2.031 1.737 3.938 1.00 . B A . 101 WMH C 1 1
4 881 2 2 1 . C1 C -1.357 3.595 2.535 1.00 . B A . 101 WMH C1 1 1
4 882 2 2 1 . C2 C -0.193 4.254 2.309 1.00 . B A . 101 WMH C2 1 1
4 883 2 2 1 . H1 H -2.357 2.062 4.911 1.00 . B A . 101 WMH H1 1 1
4 884 2 2 1 . H2 H -2.891 1.781 3.290 1.00 . B A . 101 WMH H2 1 1
4 885 2 2 1 . H5 H -0.053 5.082 1.630 1.00 . B A . 101 WMH H5 1 1
4 886 2 2 1 . N N -1.118 2.654 3.428 1.00 . B A . 101 WMH N 1 1
4 887 2 2 1 . N1 N 0.747 3.706 3.069 1.00 . B A . 101 WMH N1 1 1
4 888 2 2 1 . N2 N 0.238 2.744 3.757 1.00 . B A . 101 WMH N2 1 1
5 889 1 1 1 GLY C C -7.334 -1.193 3.618 1.00 . A A . 1 GLY C 1 1
5 890 1 1 1 GLY CA C -8.406 -0.265 4.064 1.00 . A A . 1 GLY CA 1 1
5 891 1 1 1 GLY H1 H -8.778 0.960 2.405 1.00 . A A . 1 GLY H1 1 1
5 892 1 1 1 GLY HA2 H -7.959 0.552 4.610 1.00 . A A . 1 GLY HA2 1 1
5 893 1 1 1 GLY HA3 H -9.077 -0.803 4.716 1.00 . A A . 1 GLY HA3 1 1
5 894 1 1 1 GLY N N -9.164 0.255 2.972 1.00 . A A . 1 GLY N 1 1
5 895 1 1 1 GLY O O -7.259 -2.319 4.085 1.00 . A A . 1 GLY O 1 1
5 896 1 1 2 ARG C C -4.191 -0.702 2.238 1.00 . A A . 2 ARG C 1 1
5 897 1 1 2 ARG CA C -5.421 -1.554 2.202 1.00 . A A . 2 ARG CA 1 1
5 898 1 1 2 ARG CB C -5.656 -1.978 0.757 1.00 . A A . 2 ARG CB 1 1
5 899 1 1 2 ARG CD C -7.222 -3.873 1.247 1.00 . A A . 2 ARG CD 1 1
5 900 1 1 2 ARG CG C -6.999 -2.602 0.475 1.00 . A A . 2 ARG CG 1 1
5 901 1 1 2 ARG CZ C -8.993 -5.594 1.229 1.00 . A A . 2 ARG CZ 1 1
5 902 1 1 2 ARG H H -6.627 0.169 2.361 1.00 . A A . 2 ARG H 1 1
5 903 1 1 2 ARG HA H -5.301 -2.424 2.829 1.00 . A A . 2 ARG HA 1 1
5 904 1 1 2 ARG HB2 H -5.574 -1.090 0.155 1.00 . A A . 2 ARG HB2 1 1
5 905 1 1 2 ARG HB3 H -4.881 -2.672 0.468 1.00 . A A . 2 ARG HB3 1 1
5 906 1 1 2 ARG HD2 H -6.528 -4.625 0.899 1.00 . A A . 2 ARG HD2 1 1
5 907 1 1 2 ARG HD3 H -7.061 -3.681 2.298 1.00 . A A . 2 ARG HD3 1 1
5 908 1 1 2 ARG HE H -9.218 -3.641 0.770 1.00 . A A . 2 ARG HE 1 1
5 909 1 1 2 ARG HG2 H -7.775 -1.898 0.740 1.00 . A A . 2 ARG HG2 1 1
5 910 1 1 2 ARG HG3 H -7.061 -2.818 -0.582 1.00 . A A . 2 ARG HG3 1 1
5 911 1 1 2 ARG HH11 H -7.192 -6.338 1.883 1.00 . A A . 2 ARG HH11 1 1
5 912 1 1 2 ARG HH12 H -8.438 -7.490 1.771 1.00 . A A . 2 ARG HH12 1 1
5 913 1 1 2 ARG HH21 H -10.918 -5.206 0.687 1.00 . A A . 2 ARG HH21 1 1
5 914 1 1 2 ARG HH22 H -10.616 -6.823 1.116 1.00 . A A . 2 ARG HH22 1 1
5 915 1 1 2 ARG N N -6.520 -0.747 2.701 1.00 . A A . 2 ARG N 1 1
5 916 1 1 2 ARG NE N -8.581 -4.348 1.056 1.00 . A A . 2 ARG NE 1 1
5 917 1 1 2 ARG NH1 N -8.151 -6.534 1.663 1.00 . A A . 2 ARG NH1 1 1
5 918 1 1 2 ARG NH2 N -10.258 -5.895 0.994 1.00 . A A . 2 ARG NH2 1 1
5 919 1 1 2 ARG O O -4.284 0.492 2.009 1.00 . A A . 2 ARG O 1 1
5 920 1 1 3 ALA C C -0.690 -1.519 2.239 1.00 . A A . 3 ALA C 1 1
5 921 1 1 3 ALA CA C -1.804 -0.581 2.591 1.00 . A A . 3 ALA CA 1 1
5 922 1 1 3 ALA CB C -1.599 0.021 3.993 1.00 . A A . 3 ALA CB 1 1
5 923 1 1 3 ALA H H -3.065 -2.251 2.718 1.00 . A A . 3 ALA H 1 1
5 924 1 1 3 ALA HA H -1.827 0.219 1.867 1.00 . A A . 3 ALA HA 1 1
5 925 1 1 3 ALA HB1 H -0.542 0.047 4.211 1.00 . A A . 3 ALA HB1 1 1
5 926 1 1 3 ALA HB2 H -2.093 -0.613 4.713 1.00 . A A . 3 ALA HB2 1 1
5 927 1 1 3 ALA N N -3.072 -1.285 2.529 1.00 . A A . 3 ALA N 1 1
5 928 1 1 3 ALA O O -0.661 -2.659 2.721 1.00 . A A . 3 ALA O 1 1
5 929 1 1 4 THR C C 2.434 -1.765 2.014 1.00 . A A . 4 THR C 1 1
5 930 1 1 4 THR CA C 1.300 -1.910 1.024 1.00 . A A . 4 THR CA 1 1
5 931 1 1 4 THR CB C 1.781 -1.650 -0.425 1.00 . A A . 4 THR CB 1 1
5 932 1 1 4 THR CG2 C 0.732 -2.092 -1.436 1.00 . A A . 4 THR CG2 1 1
5 933 1 1 4 THR H H 0.134 -0.191 0.991 1.00 . A A . 4 THR H 1 1
5 934 1 1 4 THR HA H 0.948 -2.929 1.086 1.00 . A A . 4 THR HA 1 1
5 935 1 1 4 THR HB H 2.685 -2.216 -0.593 1.00 . A A . 4 THR HB 1 1
5 936 1 1 4 THR HG1 H 2.934 -0.194 -1.038 1.00 . A A . 4 THR HG1 1 1
5 937 1 1 4 THR HG21 H -0.184 -1.544 -1.266 1.00 . A A . 4 THR HG21 1 1
5 938 1 1 4 THR HG22 H 0.543 -3.150 -1.325 1.00 . A A . 4 THR HG22 1 1
5 939 1 1 4 THR HG23 H 1.088 -1.893 -2.436 1.00 . A A . 4 THR HG23 1 1
5 940 1 1 4 THR N N 0.202 -1.087 1.395 1.00 . A A . 4 THR N 1 1
5 941 1 1 4 THR O O 2.839 -0.654 2.374 1.00 . A A . 4 THR O 1 1
5 942 1 1 4 THR OG1 O 2.065 -0.264 -0.613 1.00 . A A . 4 THR OG1 1 1
5 943 1 1 5 LYS C C 5.301 -3.053 2.594 1.00 . A A . 5 LYS C 1 1
5 944 1 1 5 LYS CA C 4.005 -2.950 3.404 1.00 . A A . 5 LYS CA 1 1
5 945 1 1 5 LYS CB C 3.793 -4.169 4.306 1.00 . A A . 5 LYS CB 1 1
5 946 1 1 5 LYS CD C 4.395 -5.518 6.339 1.00 . A A . 5 LYS CD 1 1
5 947 1 1 5 LYS CE C 3.036 -5.337 7.010 1.00 . A A . 5 LYS CE 1 1
5 948 1 1 5 LYS CG C 4.761 -4.315 5.476 1.00 . A A . 5 LYS CG 1 1
5 949 1 1 5 LYS H H 2.522 -3.732 2.155 1.00 . A A . 5 LYS H 1 1
5 950 1 1 5 LYS HA H 4.012 -2.048 3.998 1.00 . A A . 5 LYS HA 1 1
5 951 1 1 5 LYS HB2 H 2.791 -4.101 4.700 1.00 . A A . 5 LYS HB2 1 1
5 952 1 1 5 LYS HB3 H 3.857 -5.055 3.692 1.00 . A A . 5 LYS HB3 1 1
5 953 1 1 5 LYS HD2 H 4.362 -6.399 5.717 1.00 . A A . 5 LYS HD2 1 1
5 954 1 1 5 LYS HD3 H 5.150 -5.645 7.101 1.00 . A A . 5 LYS HD3 1 1
5 955 1 1 5 LYS HE2 H 3.096 -4.518 7.709 1.00 . A A . 5 LYS HE2 1 1
5 956 1 1 5 LYS HE3 H 2.289 -5.109 6.265 1.00 . A A . 5 LYS HE3 1 1
5 957 1 1 5 LYS HG2 H 5.760 -4.450 5.089 1.00 . A A . 5 LYS HG2 1 1
5 958 1 1 5 LYS HG3 H 4.720 -3.421 6.079 1.00 . A A . 5 LYS HG3 1 1
5 959 1 1 5 LYS HZ1 H 1.692 -6.378 8.194 1.00 . A A . 5 LYS HZ1 1 1
5 960 1 1 5 LYS HZ2 H 3.295 -6.820 8.474 1.00 . A A . 5 LYS HZ2 1 1
5 961 1 1 5 LYS HZ3 H 2.495 -7.349 7.093 1.00 . A A . 5 LYS HZ3 1 1
5 962 1 1 5 LYS N N 2.913 -2.888 2.472 1.00 . A A . 5 LYS N 1 1
5 963 1 1 5 LYS NZ N 2.613 -6.544 7.741 1.00 . A A . 5 LYS NZ 1 1
5 964 1 1 5 LYS O O 6.420 -3.085 3.128 1.00 . A A . 5 LYS O 1 1
5 965 1 1 6 SER C C 6.197 -1.843 -0.412 1.00 . A A . 6 SER C 1 1
5 966 1 1 6 SER CA C 6.179 -3.142 0.368 1.00 . A A . 6 SER CA 1 1
5 967 1 1 6 SER CB C 6.000 -4.342 -0.562 1.00 . A A . 6 SER CB 1 1
5 968 1 1 6 SER H H 4.208 -3.131 0.953 1.00 . A A . 6 SER H 1 1
5 969 1 1 6 SER HA H 7.103 -3.249 0.909 1.00 . A A . 6 SER HA 1 1
5 970 1 1 6 SER HB2 H 6.720 -4.284 -1.363 1.00 . A A . 6 SER HB2 1 1
5 971 1 1 6 SER HB3 H 6.149 -5.255 -0.006 1.00 . A A . 6 SER HB3 1 1
5 972 1 1 6 SER HG H 4.696 -3.788 -1.902 1.00 . A A . 6 SER HG 1 1
5 973 1 1 6 SER N N 5.121 -3.112 1.305 1.00 . A A . 6 SER N 1 1
5 974 1 1 6 SER O O 5.155 -1.184 -0.561 1.00 . A A . 6 SER O 1 1
5 975 1 1 6 SER OG O 4.688 -4.354 -1.120 1.00 . A A . 6 SER OG 1 1
5 976 1 1 7 ILE C C 6.953 -0.515 -3.093 1.00 . A A . 7 ILE C 1 1
5 977 1 1 7 ILE CA C 7.503 -0.271 -1.683 1.00 . A A . 7 ILE CA 1 1
5 978 1 1 7 ILE CB C 8.982 0.213 -1.760 1.00 . A A . 7 ILE CB 1 1
5 979 1 1 7 ILE CD1 C 11.350 -0.462 -2.500 1.00 . A A . 7 ILE CD1 1 1
5 980 1 1 7 ILE CG1 C 9.901 -0.880 -2.344 1.00 . A A . 7 ILE CG1 1 1
5 981 1 1 7 ILE CG2 C 9.459 0.647 -0.382 1.00 . A A . 7 ILE CG2 1 1
5 982 1 1 7 ILE H H 8.147 -2.019 -0.697 1.00 . A A . 7 ILE H 1 1
5 983 1 1 7 ILE HA H 6.904 0.495 -1.212 1.00 . A A . 7 ILE HA 1 1
5 984 1 1 7 ILE HB H 9.011 1.082 -2.403 1.00 . A A . 7 ILE HB 1 1
5 985 1 1 7 ILE HD11 H 11.752 -0.203 -1.533 1.00 . A A . 7 ILE HD11 1 1
5 986 1 1 7 ILE HD12 H 11.408 0.395 -3.153 1.00 . A A . 7 ILE HD12 1 1
5 987 1 1 7 ILE HD13 H 11.919 -1.278 -2.921 1.00 . A A . 7 ILE HD13 1 1
5 988 1 1 7 ILE HG12 H 9.881 -1.740 -1.692 1.00 . A A . 7 ILE HG12 1 1
5 989 1 1 7 ILE HG13 H 9.527 -1.165 -3.315 1.00 . A A . 7 ILE HG13 1 1
5 990 1 1 7 ILE HG21 H 8.856 1.470 -0.029 1.00 . A A . 7 ILE HG21 1 1
5 991 1 1 7 ILE HG22 H 10.496 0.951 -0.434 1.00 . A A . 7 ILE HG22 1 1
5 992 1 1 7 ILE HG23 H 9.366 -0.185 0.301 1.00 . A A . 7 ILE HG23 1 1
5 993 1 1 7 ILE N N 7.359 -1.467 -0.887 1.00 . A A . 7 ILE N 1 1
5 994 1 1 7 ILE O O 7.052 -1.631 -3.608 1.00 . A A . 7 ILE O 1 1
5 995 1 1 8 PRO C C 4.886 1.692 -2.073 1.00 . A A . 8 PRO C 1 1
5 996 1 1 8 PRO CA C 6.049 1.776 -3.081 1.00 . A A . 8 PRO CA 1 1
5 997 1 1 8 PRO CB C 5.658 2.665 -4.268 1.00 . A A . 8 PRO CB 1 1
5 998 1 1 8 PRO CD C 5.769 0.409 -5.075 1.00 . A A . 8 PRO CD 1 1
5 999 1 1 8 PRO CG C 5.083 1.734 -5.274 1.00 . A A . 8 PRO CG 1 1
5 1000 1 1 8 PRO HA H 6.940 2.157 -2.608 1.00 . A A . 8 PRO HA 1 1
5 1001 1 1 8 PRO HB2 H 4.931 3.394 -3.943 1.00 . A A . 8 PRO HB2 1 1
5 1002 1 1 8 PRO HB3 H 6.533 3.170 -4.652 1.00 . A A . 8 PRO HB3 1 1
5 1003 1 1 8 PRO HD2 H 5.058 -0.398 -5.149 1.00 . A A . 8 PRO HD2 1 1
5 1004 1 1 8 PRO HD3 H 6.566 0.275 -5.792 1.00 . A A . 8 PRO HD3 1 1
5 1005 1 1 8 PRO HG2 H 4.021 1.633 -5.112 1.00 . A A . 8 PRO HG2 1 1
5 1006 1 1 8 PRO HG3 H 5.273 2.107 -6.271 1.00 . A A . 8 PRO HG3 1 1
5 1007 1 1 8 PRO N N 6.303 0.479 -3.705 1.00 . A A . 8 PRO N 1 1
5 1008 1 1 8 PRO O O 3.891 0.991 -2.327 1.00 . A A . 8 PRO O 1 1
5 1009 1 1 9 PRO C C 2.734 3.143 -0.398 1.00 . A A . 9 PRO C 1 1
5 1010 1 1 9 PRO CA C 3.946 2.356 0.097 1.00 . A A . 9 PRO CA 1 1
5 1011 1 1 9 PRO CB C 4.575 3.043 1.322 1.00 . A A . 9 PRO CB 1 1
5 1012 1 1 9 PRO CD C 6.174 3.119 -0.444 1.00 . A A . 9 PRO CD 1 1
5 1013 1 1 9 PRO CG C 6.040 3.060 1.047 1.00 . A A . 9 PRO CG 1 1
5 1014 1 1 9 PRO HA H 3.640 1.351 0.347 1.00 . A A . 9 PRO HA 1 1
5 1015 1 1 9 PRO HB2 H 4.178 4.042 1.412 1.00 . A A . 9 PRO HB2 1 1
5 1016 1 1 9 PRO HB3 H 4.347 2.479 2.215 1.00 . A A . 9 PRO HB3 1 1
5 1017 1 1 9 PRO HD2 H 6.128 4.140 -0.791 1.00 . A A . 9 PRO HD2 1 1
5 1018 1 1 9 PRO HD3 H 7.098 2.649 -0.744 1.00 . A A . 9 PRO HD3 1 1
5 1019 1 1 9 PRO HG2 H 6.492 3.928 1.503 1.00 . A A . 9 PRO HG2 1 1
5 1020 1 1 9 PRO HG3 H 6.493 2.157 1.428 1.00 . A A . 9 PRO HG3 1 1
5 1021 1 1 9 PRO N N 5.008 2.348 -0.901 1.00 . A A . 9 PRO N 1 1
5 1022 1 1 9 PRO O O 2.772 4.374 -0.525 1.00 . A A . 9 PRO O 1 1
5 1023 1 1 10 ARG C C -0.641 2.440 -0.389 1.00 . A A . 10 ARG C 1 1
5 1024 1 1 10 ARG CA C 0.479 2.972 -1.223 1.00 . A A . 10 ARG CA 1 1
5 1025 1 1 10 ARG CB C 0.247 2.571 -2.669 1.00 . A A . 10 ARG CB 1 1
5 1026 1 1 10 ARG CD C 0.921 2.678 -5.054 1.00 . A A . 10 ARG CD 1 1
5 1027 1 1 10 ARG CG C 1.254 3.125 -3.652 1.00 . A A . 10 ARG CG 1 1
5 1028 1 1 10 ARG CZ C -0.964 2.939 -6.662 1.00 . A A . 10 ARG CZ 1 1
5 1029 1 1 10 ARG H H 1.763 1.441 -0.646 1.00 . A A . 10 ARG H 1 1
5 1030 1 1 10 ARG HA H 0.518 4.048 -1.153 1.00 . A A . 10 ARG HA 1 1
5 1031 1 1 10 ARG HB2 H 0.278 1.493 -2.733 1.00 . A A . 10 ARG HB2 1 1
5 1032 1 1 10 ARG HB3 H -0.736 2.905 -2.960 1.00 . A A . 10 ARG HB3 1 1
5 1033 1 1 10 ARG HD2 H 1.626 3.120 -5.741 1.00 . A A . 10 ARG HD2 1 1
5 1034 1 1 10 ARG HD3 H 1.003 1.602 -5.102 1.00 . A A . 10 ARG HD3 1 1
5 1035 1 1 10 ARG HE H -1.012 3.412 -4.714 1.00 . A A . 10 ARG HE 1 1
5 1036 1 1 10 ARG HG2 H 1.236 4.203 -3.609 1.00 . A A . 10 ARG HG2 1 1
5 1037 1 1 10 ARG HG3 H 2.239 2.766 -3.390 1.00 . A A . 10 ARG HG3 1 1
5 1038 1 1 10 ARG HH11 H 0.772 2.323 -7.542 1.00 . A A . 10 ARG HH11 1 1
5 1039 1 1 10 ARG HH12 H -0.569 2.410 -8.599 1.00 . A A . 10 ARG HH12 1 1
5 1040 1 1 10 ARG HH21 H -2.815 3.598 -6.124 1.00 . A A . 10 ARG HH21 1 1
5 1041 1 1 10 ARG HH22 H -2.676 3.179 -7.770 1.00 . A A . 10 ARG HH22 1 1
5 1042 1 1 10 ARG N N 1.708 2.422 -0.735 1.00 . A A . 10 ARG N 1 1
5 1043 1 1 10 ARG NE N -0.448 3.066 -5.442 1.00 . A A . 10 ARG NE 1 1
5 1044 1 1 10 ARG NH1 N -0.200 2.533 -7.672 1.00 . A A . 10 ARG NH1 1 1
5 1045 1 1 10 ARG NH2 N -2.236 3.257 -6.871 1.00 . A A . 10 ARG NH2 1 1
5 1046 1 1 10 ARG O O -0.557 1.315 0.126 1.00 . A A . 10 ARG O 1 1
5 1047 1 1 11 ALA C C -4.057 3.043 -0.185 1.00 . A A . 11 ALA C 1 1
5 1048 1 1 11 ALA CA C -2.786 2.801 0.567 1.00 . A A . 11 ALA CA 1 1
5 1049 1 1 11 ALA CB C -2.817 3.468 1.970 1.00 . A A . 11 ALA CB 1 1
5 1050 1 1 11 ALA H H -1.718 4.099 -0.664 1.00 . A A . 11 ALA H 1 1
5 1051 1 1 11 ALA HA H -2.687 1.733 0.698 1.00 . A A . 11 ALA HA 1 1
5 1052 1 1 11 ALA HB1 H -3.606 3.012 2.547 1.00 . A A . 11 ALA HB1 1 1
5 1053 1 1 11 ALA HB2 H -3.028 4.521 1.922 1.00 . A A . 11 ALA HB2 1 1
5 1054 1 1 11 ALA N N -1.674 3.222 -0.225 1.00 . A A . 11 ALA N 1 1
5 1055 1 1 11 ALA O O -4.126 3.932 -1.051 1.00 . A A . 11 ALA O 1 1
5 1056 1 1 12 PHE C C -7.404 2.593 0.460 1.00 . A A . 12 PHE C 1 1
5 1057 1 1 12 PHE CA C -6.300 2.346 -0.565 1.00 . A A . 12 PHE CA 1 1
5 1058 1 1 12 PHE CB C -6.558 1.067 -1.382 1.00 . A A . 12 PHE CB 1 1
5 1059 1 1 12 PHE CD1 C -4.483 -0.154 -2.206 1.00 . A A . 12 PHE CD1 1 1
5 1060 1 1 12 PHE CD2 C -5.515 1.431 -3.645 1.00 . A A . 12 PHE CD2 1 1
5 1061 1 1 12 PHE CE1 C -3.525 -0.410 -3.164 1.00 . A A . 12 PHE CE1 1 1
5 1062 1 1 12 PHE CE2 C -4.557 1.177 -4.610 1.00 . A A . 12 PHE CE2 1 1
5 1063 1 1 12 PHE CG C -5.495 0.775 -2.434 1.00 . A A . 12 PHE CG 1 1
5 1064 1 1 12 PHE CZ C -3.563 0.255 -4.368 1.00 . A A . 12 PHE CZ 1 1
5 1065 1 1 12 PHE H H -4.915 1.628 0.852 1.00 . A A . 12 PHE H 1 1
5 1066 1 1 12 PHE HA H -6.233 3.189 -1.238 1.00 . A A . 12 PHE HA 1 1
5 1067 1 1 12 PHE HB2 H -6.643 0.221 -0.719 1.00 . A A . 12 PHE HB2 1 1
5 1068 1 1 12 PHE HB3 H -7.498 1.189 -1.897 1.00 . A A . 12 PHE HB3 1 1
5 1069 1 1 12 PHE HD1 H -4.431 -0.689 -1.270 1.00 . A A . 12 PHE HD1 1 1
5 1070 1 1 12 PHE HD2 H -6.290 2.156 -3.840 1.00 . A A . 12 PHE HD2 1 1
5 1071 1 1 12 PHE HE1 H -2.746 -1.134 -2.969 1.00 . A A . 12 PHE HE1 1 1
5 1072 1 1 12 PHE HE2 H -4.592 1.701 -5.554 1.00 . A A . 12 PHE HE2 1 1
5 1073 1 1 12 PHE HZ H -2.812 0.056 -5.119 1.00 . A A . 12 PHE HZ 1 1
5 1074 1 1 12 PHE N N -5.042 2.268 0.112 1.00 . A A . 12 PHE N 1 1
5 1075 1 1 12 PHE O O -7.378 1.993 1.548 1.00 . A A . 12 PHE O 1 1
5 1076 1 1 13 PRO C C -10.283 2.780 1.685 1.00 . A A . 13 PRO C 1 1
5 1077 1 1 13 PRO CA C -9.454 3.908 1.066 1.00 . A A . 13 PRO CA 1 1
5 1078 1 1 13 PRO CB C -10.347 4.812 0.213 1.00 . A A . 13 PRO CB 1 1
5 1079 1 1 13 PRO CD C -8.553 4.118 -1.190 1.00 . A A . 13 PRO CD 1 1
5 1080 1 1 13 PRO CG C -9.473 5.265 -0.898 1.00 . A A . 13 PRO CG 1 1
5 1081 1 1 13 PRO HA H -9.030 4.495 1.866 1.00 . A A . 13 PRO HA 1 1
5 1082 1 1 13 PRO HB2 H -11.197 4.249 -0.146 1.00 . A A . 13 PRO HB2 1 1
5 1083 1 1 13 PRO HB3 H -10.693 5.645 0.808 1.00 . A A . 13 PRO HB3 1 1
5 1084 1 1 13 PRO HD2 H -9.002 3.446 -1.906 1.00 . A A . 13 PRO HD2 1 1
5 1085 1 1 13 PRO HD3 H -7.612 4.496 -1.557 1.00 . A A . 13 PRO HD3 1 1
5 1086 1 1 13 PRO HG2 H -10.071 5.501 -1.765 1.00 . A A . 13 PRO HG2 1 1
5 1087 1 1 13 PRO HG3 H -8.906 6.130 -0.587 1.00 . A A . 13 PRO HG3 1 1
5 1088 1 1 13 PRO N N -8.391 3.468 0.129 1.00 . A A . 13 PRO N 1 1
5 1089 1 1 13 PRO O O -10.856 2.954 2.760 1.00 . A A . 13 PRO O 1 1
5 1090 1 1 14 ASP C C -10.365 -0.207 2.702 1.00 . A A . 14 ASP C 1 1
5 1091 1 1 14 ASP CA C -11.118 0.507 1.582 1.00 . A A . 14 ASP CA 1 1
5 1092 1 1 14 ASP CB C -11.541 -0.487 0.490 1.00 . A A . 14 ASP CB 1 1
5 1093 1 1 14 ASP CG C -10.421 -1.339 -0.037 1.00 . A A . 14 ASP CG 1 1
5 1094 1 1 14 ASP H H -9.842 1.520 0.204 1.00 . A A . 14 ASP H 1 1
5 1095 1 1 14 ASP HA H -12.003 0.938 2.026 1.00 . A A . 14 ASP HA 1 1
5 1096 1 1 14 ASP HB2 H -12.296 -1.144 0.893 1.00 . A A . 14 ASP HB2 1 1
5 1097 1 1 14 ASP HB3 H -11.969 0.062 -0.334 1.00 . A A . 14 ASP HB3 1 1
5 1098 1 1 14 ASP N N -10.331 1.626 1.048 1.00 . A A . 14 ASP N 1 1
5 1099 1 1 14 ASP O O -10.873 -1.160 3.310 1.00 . A A . 14 ASP O 1 1
5 1100 1 1 14 ASP OD1 O -10.421 -2.567 0.221 1.00 . A A . 14 ASP OD1 1 1
5 1101 1 1 14 ASP OD2 O -9.538 -0.818 -0.737 1.00 . A A . 14 ASP OD2 1 1
5 1102 2 2 1 . C C -2.153 1.430 4.132 1.00 . B A . 101 WMH C 1 1
5 1103 2 2 1 . C1 C -1.533 3.318 2.752 1.00 . B A . 101 WMH C1 1 1
5 1104 2 2 1 . C2 C -0.401 4.037 2.580 1.00 . B A . 101 WMH C2 1 1
5 1105 2 2 1 . H1 H -2.530 1.705 5.101 1.00 . B A . 101 WMH H1 1 1
5 1106 2 2 1 . H2 H -3.003 1.456 3.469 1.00 . B A . 101 WMH H2 1 1
5 1107 2 2 1 . H5 H -0.281 4.860 1.892 1.00 . B A . 101 WMH H5 1 1
5 1108 2 2 1 . N N -1.280 2.403 3.669 1.00 . B A . 101 WMH N 1 1
5 1109 2 2 1 . N1 N 0.537 3.563 3.390 1.00 . B A . 101 WMH N1 1 1
5 1110 2 2 1 . N2 N 0.055 2.579 4.069 1.00 . B A . 101 WMH N2 1 1
6 1111 1 1 1 GLY C C -7.194 -0.637 4.329 1.00 . A A . 1 GLY C 1 1
6 1112 1 1 1 GLY CA C -8.310 0.367 4.448 1.00 . A A . 1 GLY CA 1 1
6 1113 1 1 1 GLY H1 H -8.551 1.125 2.486 1.00 . A A . 1 GLY H1 1 1
6 1114 1 1 1 GLY HA2 H -7.901 1.303 4.794 1.00 . A A . 1 GLY HA2 1 1
6 1115 1 1 1 GLY HA3 H -9.028 0.009 5.172 1.00 . A A . 1 GLY HA3 1 1
6 1116 1 1 1 GLY N N -8.989 0.594 3.190 1.00 . A A . 1 GLY N 1 1
6 1117 1 1 1 GLY O O -6.922 -1.402 5.263 1.00 . A A . 1 GLY O 1 1
6 1118 1 1 2 ARG C C -4.258 -0.836 2.377 1.00 . A A . 2 ARG C 1 1
6 1119 1 1 2 ARG CA C -5.450 -1.558 2.948 1.00 . A A . 2 ARG CA 1 1
6 1120 1 1 2 ARG CB C -5.896 -2.702 2.051 1.00 . A A . 2 ARG CB 1 1
6 1121 1 1 2 ARG CD C -7.385 -4.715 1.829 1.00 . A A . 2 ARG CD 1 1
6 1122 1 1 2 ARG CG C -6.655 -3.799 2.789 1.00 . A A . 2 ARG CG 1 1
6 1123 1 1 2 ARG CZ C -6.772 -4.963 -0.551 1.00 . A A . 2 ARG CZ 1 1
6 1124 1 1 2 ARG H H -6.773 0.002 2.498 1.00 . A A . 2 ARG H 1 1
6 1125 1 1 2 ARG HA H -5.162 -1.966 3.904 1.00 . A A . 2 ARG HA 1 1
6 1126 1 1 2 ARG HB2 H -6.540 -2.306 1.278 1.00 . A A . 2 ARG HB2 1 1
6 1127 1 1 2 ARG HB3 H -5.026 -3.144 1.590 1.00 . A A . 2 ARG HB3 1 1
6 1128 1 1 2 ARG HD2 H -7.747 -5.568 2.383 1.00 . A A . 2 ARG HD2 1 1
6 1129 1 1 2 ARG HD3 H -8.227 -4.181 1.413 1.00 . A A . 2 ARG HD3 1 1
6 1130 1 1 2 ARG HE H -5.767 -5.753 1.019 1.00 . A A . 2 ARG HE 1 1
6 1131 1 1 2 ARG HG2 H -5.953 -4.384 3.365 1.00 . A A . 2 ARG HG2 1 1
6 1132 1 1 2 ARG HG3 H -7.371 -3.341 3.455 1.00 . A A . 2 ARG HG3 1 1
6 1133 1 1 2 ARG HH11 H -8.355 -3.682 -0.236 1.00 . A A . 2 ARG HH11 1 1
6 1134 1 1 2 ARG HH12 H -7.970 -3.959 -1.873 1.00 . A A . 2 ARG HH12 1 1
6 1135 1 1 2 ARG HH21 H -5.236 -6.108 -1.209 1.00 . A A . 2 ARG HH21 1 1
6 1136 1 1 2 ARG HH22 H -6.127 -5.367 -2.462 1.00 . A A . 2 ARG HH22 1 1
6 1137 1 1 2 ARG N N -6.540 -0.645 3.200 1.00 . A A . 2 ARG N 1 1
6 1138 1 1 2 ARG NE N -6.535 -5.198 0.742 1.00 . A A . 2 ARG NE 1 1
6 1139 1 1 2 ARG NH1 N -7.765 -4.149 -0.909 1.00 . A A . 2 ARG NH1 1 1
6 1140 1 1 2 ARG NH2 N -5.999 -5.512 -1.477 1.00 . A A . 2 ARG NH2 1 1
6 1141 1 1 2 ARG O O -4.393 0.009 1.504 1.00 . A A . 2 ARG O 1 1
6 1142 1 1 3 ALA C C -0.855 -1.650 2.162 1.00 . A A . 3 ALA C 1 1
6 1143 1 1 3 ALA CA C -1.847 -0.570 2.524 1.00 . A A . 3 ALA CA 1 1
6 1144 1 1 3 ALA CB C -1.319 0.267 3.701 1.00 . A A . 3 ALA CB 1 1
6 1145 1 1 3 ALA H H -3.073 -1.892 3.556 1.00 . A A . 3 ALA H 1 1
6 1146 1 1 3 ALA HA H -2.000 0.078 1.675 1.00 . A A . 3 ALA HA 1 1
6 1147 1 1 3 ALA HB1 H -0.247 0.366 3.599 1.00 . A A . 3 ALA HB1 1 1
6 1148 1 1 3 ALA HB2 H -1.534 -0.255 4.622 1.00 . A A . 3 ALA HB2 1 1
6 1149 1 1 3 ALA N N -3.109 -1.171 2.890 1.00 . A A . 3 ALA N 1 1
6 1150 1 1 3 ALA O O -0.953 -2.782 2.660 1.00 . A A . 3 ALA O 1 1
6 1151 1 1 4 THR C C 2.228 -2.172 1.901 1.00 . A A . 4 THR C 1 1
6 1152 1 1 4 THR CA C 1.072 -2.285 0.921 1.00 . A A . 4 THR CA 1 1
6 1153 1 1 4 THR CB C 1.589 -2.051 -0.530 1.00 . A A . 4 THR CB 1 1
6 1154 1 1 4 THR CG2 C 0.465 -2.227 -1.543 1.00 . A A . 4 THR CG2 1 1
6 1155 1 1 4 THR H H 0.046 -0.467 0.835 1.00 . A A . 4 THR H 1 1
6 1156 1 1 4 THR HA H 0.653 -3.277 0.987 1.00 . A A . 4 THR HA 1 1
6 1157 1 1 4 THR HB H 2.365 -2.772 -0.738 1.00 . A A . 4 THR HB 1 1
6 1158 1 1 4 THR HG1 H 3.101 -0.811 -0.524 1.00 . A A . 4 THR HG1 1 1
6 1159 1 1 4 THR HG21 H -0.322 -1.518 -1.331 1.00 . A A . 4 THR HG21 1 1
6 1160 1 1 4 THR HG22 H 0.070 -3.231 -1.475 1.00 . A A . 4 THR HG22 1 1
6 1161 1 1 4 THR HG23 H 0.845 -2.056 -2.538 1.00 . A A . 4 THR HG23 1 1
6 1162 1 1 4 THR N N 0.053 -1.345 1.281 1.00 . A A . 4 THR N 1 1
6 1163 1 1 4 THR O O 2.524 -1.074 2.409 1.00 . A A . 4 THR O 1 1
6 1164 1 1 4 THR OG1 O 2.146 -0.729 -0.658 1.00 . A A . 4 THR OG1 1 1
6 1165 1 1 5 LYS C C 5.232 -3.111 2.158 1.00 . A A . 5 LYS C 1 1
6 1166 1 1 5 LYS CA C 4.023 -3.270 3.054 1.00 . A A . 5 LYS CA 1 1
6 1167 1 1 5 LYS CB C 4.134 -4.535 3.915 1.00 . A A . 5 LYS CB 1 1
6 1168 1 1 5 LYS CD C 3.197 -5.885 5.863 1.00 . A A . 5 LYS CD 1 1
6 1169 1 1 5 LYS CE C 4.420 -5.736 6.776 1.00 . A A . 5 LYS CE 1 1
6 1170 1 1 5 LYS CG C 3.004 -4.685 4.933 1.00 . A A . 5 LYS CG 1 1
6 1171 1 1 5 LYS H H 2.490 -4.141 1.887 1.00 . A A . 5 LYS H 1 1
6 1172 1 1 5 LYS HA H 3.957 -2.399 3.689 1.00 . A A . 5 LYS HA 1 1
6 1173 1 1 5 LYS HB2 H 4.121 -5.392 3.259 1.00 . A A . 5 LYS HB2 1 1
6 1174 1 1 5 LYS HB3 H 5.074 -4.520 4.442 1.00 . A A . 5 LYS HB3 1 1
6 1175 1 1 5 LYS HD2 H 2.317 -5.996 6.479 1.00 . A A . 5 LYS HD2 1 1
6 1176 1 1 5 LYS HD3 H 3.317 -6.773 5.260 1.00 . A A . 5 LYS HD3 1 1
6 1177 1 1 5 LYS HE2 H 4.470 -6.603 7.416 1.00 . A A . 5 LYS HE2 1 1
6 1178 1 1 5 LYS HE3 H 5.312 -5.696 6.169 1.00 . A A . 5 LYS HE3 1 1
6 1179 1 1 5 LYS HG2 H 2.960 -3.791 5.537 1.00 . A A . 5 LYS HG2 1 1
6 1180 1 1 5 LYS HG3 H 2.070 -4.797 4.403 1.00 . A A . 5 LYS HG3 1 1
6 1181 1 1 5 LYS HZ1 H 5.148 -4.520 8.313 1.00 . A A . 5 LYS HZ1 1 1
6 1182 1 1 5 LYS HZ2 H 3.475 -4.465 8.185 1.00 . A A . 5 LYS HZ2 1 1
6 1183 1 1 5 LYS HZ3 H 4.445 -3.656 7.075 1.00 . A A . 5 LYS HZ3 1 1
6 1184 1 1 5 LYS N N 2.840 -3.285 2.221 1.00 . A A . 5 LYS N 1 1
6 1185 1 1 5 LYS NZ N 4.356 -4.528 7.637 1.00 . A A . 5 LYS NZ 1 1
6 1186 1 1 5 LYS O O 6.337 -2.806 2.608 1.00 . A A . 5 LYS O 1 1
6 1187 1 1 6 SER C C 6.171 -1.658 -0.435 1.00 . A A . 6 SER C 1 1
6 1188 1 1 6 SER CA C 5.991 -3.137 -0.117 1.00 . A A . 6 SER CA 1 1
6 1189 1 1 6 SER CB C 5.546 -3.901 -1.357 1.00 . A A . 6 SER CB 1 1
6 1190 1 1 6 SER H H 4.101 -3.543 0.577 1.00 . A A . 6 SER H 1 1
6 1191 1 1 6 SER HA H 6.918 -3.563 0.238 1.00 . A A . 6 SER HA 1 1
6 1192 1 1 6 SER HB2 H 6.219 -3.692 -2.174 1.00 . A A . 6 SER HB2 1 1
6 1193 1 1 6 SER HB3 H 5.550 -4.957 -1.136 1.00 . A A . 6 SER HB3 1 1
6 1194 1 1 6 SER HG H 3.918 -4.180 -2.386 1.00 . A A . 6 SER HG 1 1
6 1195 1 1 6 SER N N 4.999 -3.295 0.884 1.00 . A A . 6 SER N 1 1
6 1196 1 1 6 SER O O 5.220 -0.866 -0.297 1.00 . A A . 6 SER O 1 1
6 1197 1 1 6 SER OG O 4.220 -3.523 -1.740 1.00 . A A . 6 SER OG 1 1
6 1198 1 1 7 ILE C C 7.534 0.181 -2.740 1.00 . A A . 7 ILE C 1 1
6 1199 1 1 7 ILE CA C 7.644 0.078 -1.215 1.00 . A A . 7 ILE CA 1 1
6 1200 1 1 7 ILE CB C 9.043 0.572 -0.737 1.00 . A A . 7 ILE CB 1 1
6 1201 1 1 7 ILE CD1 C 11.568 0.111 -0.892 1.00 . A A . 7 ILE CD1 1 1
6 1202 1 1 7 ILE CG1 C 10.171 -0.347 -1.254 1.00 . A A . 7 ILE CG1 1 1
6 1203 1 1 7 ILE CG2 C 9.076 0.672 0.785 1.00 . A A . 7 ILE CG2 1 1
6 1204 1 1 7 ILE H H 8.097 -1.939 -0.842 1.00 . A A . 7 ILE H 1 1
6 1205 1 1 7 ILE HA H 6.877 0.699 -0.777 1.00 . A A . 7 ILE HA 1 1
6 1206 1 1 7 ILE HB H 9.189 1.565 -1.134 1.00 . A A . 7 ILE HB 1 1
6 1207 1 1 7 ILE HD11 H 11.661 0.151 0.182 1.00 . A A . 7 ILE HD11 1 1
6 1208 1 1 7 ILE HD12 H 11.744 1.093 -1.306 1.00 . A A . 7 ILE HD12 1 1
6 1209 1 1 7 ILE HD13 H 12.291 -0.585 -1.292 1.00 . A A . 7 ILE HD13 1 1
6 1210 1 1 7 ILE HG12 H 10.039 -1.331 -0.832 1.00 . A A . 7 ILE HG12 1 1
6 1211 1 1 7 ILE HG13 H 10.106 -0.413 -2.331 1.00 . A A . 7 ILE HG13 1 1
6 1212 1 1 7 ILE HG21 H 8.865 -0.298 1.211 1.00 . A A . 7 ILE HG21 1 1
6 1213 1 1 7 ILE HG22 H 8.333 1.381 1.118 1.00 . A A . 7 ILE HG22 1 1
6 1214 1 1 7 ILE HG23 H 10.054 0.999 1.103 1.00 . A A . 7 ILE HG23 1 1
6 1215 1 1 7 ILE N N 7.370 -1.280 -0.814 1.00 . A A . 7 ILE N 1 1
6 1216 1 1 7 ILE O O 7.970 -0.739 -3.454 1.00 . A A . 7 ILE O 1 1
6 1217 1 1 8 PRO C C 5.015 1.919 -1.823 1.00 . A A . 8 PRO C 1 1
6 1218 1 1 8 PRO CA C 6.329 2.338 -2.489 1.00 . A A . 8 PRO CA 1 1
6 1219 1 1 8 PRO CB C 6.055 3.444 -3.531 1.00 . A A . 8 PRO CB 1 1
6 1220 1 1 8 PRO CD C 6.726 1.464 -4.706 1.00 . A A . 8 PRO CD 1 1
6 1221 1 1 8 PRO CG C 6.655 2.954 -4.808 1.00 . A A . 8 PRO CG 1 1
6 1222 1 1 8 PRO HA H 7.018 2.700 -1.741 1.00 . A A . 8 PRO HA 1 1
6 1223 1 1 8 PRO HB2 H 4.988 3.584 -3.626 1.00 . A A . 8 PRO HB2 1 1
6 1224 1 1 8 PRO HB3 H 6.513 4.367 -3.209 1.00 . A A . 8 PRO HB3 1 1
6 1225 1 1 8 PRO HD2 H 5.804 1.016 -5.042 1.00 . A A . 8 PRO HD2 1 1
6 1226 1 1 8 PRO HD3 H 7.564 1.082 -5.269 1.00 . A A . 8 PRO HD3 1 1
6 1227 1 1 8 PRO HG2 H 6.026 3.240 -5.639 1.00 . A A . 8 PRO HG2 1 1
6 1228 1 1 8 PRO HG3 H 7.642 3.369 -4.936 1.00 . A A . 8 PRO HG3 1 1
6 1229 1 1 8 PRO N N 6.917 1.246 -3.277 1.00 . A A . 8 PRO N 1 1
6 1230 1 1 8 PRO O O 4.257 1.105 -2.384 1.00 . A A . 8 PRO O 1 1
6 1231 1 1 9 PRO C C 2.301 2.748 -0.532 1.00 . A A . 9 PRO C 1 1
6 1232 1 1 9 PRO CA C 3.532 2.110 0.111 1.00 . A A . 9 PRO CA 1 1
6 1233 1 1 9 PRO CB C 3.773 2.669 1.517 1.00 . A A . 9 PRO CB 1 1
6 1234 1 1 9 PRO CD C 5.618 3.355 0.142 1.00 . A A . 9 PRO CD 1 1
6 1235 1 1 9 PRO CG C 4.791 3.743 1.338 1.00 . A A . 9 PRO CG 1 1
6 1236 1 1 9 PRO HA H 3.383 1.042 0.161 1.00 . A A . 9 PRO HA 1 1
6 1237 1 1 9 PRO HB2 H 2.843 3.064 1.903 1.00 . A A . 9 PRO HB2 1 1
6 1238 1 1 9 PRO HB3 H 4.135 1.885 2.164 1.00 . A A . 9 PRO HB3 1 1
6 1239 1 1 9 PRO HD2 H 5.854 4.227 -0.450 1.00 . A A . 9 PRO HD2 1 1
6 1240 1 1 9 PRO HD3 H 6.523 2.859 0.459 1.00 . A A . 9 PRO HD3 1 1
6 1241 1 1 9 PRO HG2 H 4.299 4.688 1.158 1.00 . A A . 9 PRO HG2 1 1
6 1242 1 1 9 PRO HG3 H 5.414 3.810 2.218 1.00 . A A . 9 PRO HG3 1 1
6 1243 1 1 9 PRO N N 4.747 2.429 -0.612 1.00 . A A . 9 PRO N 1 1
6 1244 1 1 9 PRO O O 2.147 3.980 -0.557 1.00 . A A . 9 PRO O 1 1
6 1245 1 1 10 ARG C C -0.855 2.080 -0.717 1.00 . A A . 10 ARG C 1 1
6 1246 1 1 10 ARG CA C 0.244 2.355 -1.692 1.00 . A A . 10 ARG CA 1 1
6 1247 1 1 10 ARG CB C -0.045 1.597 -2.986 1.00 . A A . 10 ARG CB 1 1
6 1248 1 1 10 ARG CD C 0.548 1.068 -5.356 1.00 . A A . 10 ARG CD 1 1
6 1249 1 1 10 ARG CG C 0.983 1.783 -4.085 1.00 . A A . 10 ARG CG 1 1
6 1250 1 1 10 ARG CZ C -1.395 1.131 -6.931 1.00 . A A . 10 ARG CZ 1 1
6 1251 1 1 10 ARG H H 1.678 0.956 -1.088 1.00 . A A . 10 ARG H 1 1
6 1252 1 1 10 ARG HA H 0.309 3.412 -1.894 1.00 . A A . 10 ARG HA 1 1
6 1253 1 1 10 ARG HB2 H -0.098 0.543 -2.759 1.00 . A A . 10 ARG HB2 1 1
6 1254 1 1 10 ARG HB3 H -1.007 1.913 -3.363 1.00 . A A . 10 ARG HB3 1 1
6 1255 1 1 10 ARG HD2 H 1.306 1.203 -6.113 1.00 . A A . 10 ARG HD2 1 1
6 1256 1 1 10 ARG HD3 H 0.435 0.015 -5.145 1.00 . A A . 10 ARG HD3 1 1
6 1257 1 1 10 ARG HE H -1.104 2.339 -5.345 1.00 . A A . 10 ARG HE 1 1
6 1258 1 1 10 ARG HG2 H 1.088 2.838 -4.290 1.00 . A A . 10 ARG HG2 1 1
6 1259 1 1 10 ARG HG3 H 1.930 1.379 -3.755 1.00 . A A . 10 ARG HG3 1 1
6 1260 1 1 10 ARG HH11 H -0.002 -0.266 -7.494 1.00 . A A . 10 ARG HH11 1 1
6 1261 1 1 10 ARG HH12 H -1.388 -0.213 -8.477 1.00 . A A . 10 ARG HH12 1 1
6 1262 1 1 10 ARG HH21 H -2.964 2.423 -6.723 1.00 . A A . 10 ARG HH21 1 1
6 1263 1 1 10 ARG HH22 H -3.102 1.354 -8.033 1.00 . A A . 10 ARG HH22 1 1
6 1264 1 1 10 ARG N N 1.471 1.919 -1.094 1.00 . A A . 10 ARG N 1 1
6 1265 1 1 10 ARG NE N -0.728 1.591 -5.866 1.00 . A A . 10 ARG NE 1 1
6 1266 1 1 10 ARG NH1 N -0.894 0.156 -7.685 1.00 . A A . 10 ARG NH1 1 1
6 1267 1 1 10 ARG NH2 N -2.559 1.669 -7.254 1.00 . A A . 10 ARG NH2 1 1
6 1268 1 1 10 ARG O O -0.918 0.980 -0.148 1.00 . A A . 10 ARG O 1 1
6 1269 1 1 11 ALA C C -4.060 3.057 -0.286 1.00 . A A . 11 ALA C 1 1
6 1270 1 1 11 ALA CA C -2.772 2.841 0.425 1.00 . A A . 11 ALA CA 1 1
6 1271 1 1 11 ALA CB C -2.681 3.687 1.706 1.00 . A A . 11 ALA CB 1 1
6 1272 1 1 11 ALA H H -1.591 3.925 -0.911 1.00 . A A . 11 ALA H 1 1
6 1273 1 1 11 ALA HA H -2.738 1.797 0.697 1.00 . A A . 11 ALA HA 1 1
6 1274 1 1 11 ALA HB1 H -3.447 3.356 2.390 1.00 . A A . 11 ALA HB1 1 1
6 1275 1 1 11 ALA HB2 H -2.840 4.734 1.529 1.00 . A A . 11 ALA HB2 1 1
6 1276 1 1 11 ALA N N -1.688 3.050 -0.473 1.00 . A A . 11 ALA N 1 1
6 1277 1 1 11 ALA O O -4.218 4.020 -1.053 1.00 . A A . 11 ALA O 1 1
6 1278 1 1 12 PHE C C -7.316 2.539 0.263 1.00 . A A . 12 PHE C 1 1
6 1279 1 1 12 PHE CA C -6.218 2.186 -0.730 1.00 . A A . 12 PHE CA 1 1
6 1280 1 1 12 PHE CB C -6.461 0.823 -1.388 1.00 . A A . 12 PHE CB 1 1
6 1281 1 1 12 PHE CD1 C -5.497 0.828 -3.711 1.00 . A A . 12 PHE CD1 1 1
6 1282 1 1 12 PHE CD2 C -4.306 -0.327 -2.003 1.00 . A A . 12 PHE CD2 1 1
6 1283 1 1 12 PHE CE1 C -4.527 0.471 -4.628 1.00 . A A . 12 PHE CE1 1 1
6 1284 1 1 12 PHE CE2 C -3.332 -0.684 -2.914 1.00 . A A . 12 PHE CE2 1 1
6 1285 1 1 12 PHE CG C -5.399 0.433 -2.389 1.00 . A A . 12 PHE CG 1 1
6 1286 1 1 12 PHE CZ C -3.445 -0.286 -4.229 1.00 . A A . 12 PHE CZ 1 1
6 1287 1 1 12 PHE H H -4.777 1.472 0.603 1.00 . A A . 12 PHE H 1 1
6 1288 1 1 12 PHE HA H -6.177 2.943 -1.499 1.00 . A A . 12 PHE HA 1 1
6 1289 1 1 12 PHE HB2 H -6.494 0.061 -0.624 1.00 . A A . 12 PHE HB2 1 1
6 1290 1 1 12 PHE HB3 H -7.410 0.847 -1.903 1.00 . A A . 12 PHE HB3 1 1
6 1291 1 1 12 PHE HD1 H -6.342 1.419 -4.027 1.00 . A A . 12 PHE HD1 1 1
6 1292 1 1 12 PHE HD2 H -4.216 -0.635 -0.971 1.00 . A A . 12 PHE HD2 1 1
6 1293 1 1 12 PHE HE1 H -4.618 0.786 -5.658 1.00 . A A . 12 PHE HE1 1 1
6 1294 1 1 12 PHE HE2 H -2.488 -1.276 -2.598 1.00 . A A . 12 PHE HE2 1 1
6 1295 1 1 12 PHE HZ H -2.683 -0.566 -4.943 1.00 . A A . 12 PHE HZ 1 1
6 1296 1 1 12 PHE N N -4.961 2.175 -0.064 1.00 . A A . 12 PHE N 1 1
6 1297 1 1 12 PHE O O -7.269 2.100 1.424 1.00 . A A . 12 PHE O 1 1
6 1298 1 1 13 PRO C C -10.305 2.796 1.331 1.00 . A A . 13 PRO C 1 1
6 1299 1 1 13 PRO CA C -9.399 3.857 0.691 1.00 . A A . 13 PRO CA 1 1
6 1300 1 1 13 PRO CB C -10.201 4.767 -0.245 1.00 . A A . 13 PRO CB 1 1
6 1301 1 1 13 PRO CD C -8.503 3.771 -1.577 1.00 . A A . 13 PRO CD 1 1
6 1302 1 1 13 PRO CG C -9.922 4.250 -1.608 1.00 . A A . 13 PRO CG 1 1
6 1303 1 1 13 PRO HA H -8.980 4.456 1.485 1.00 . A A . 13 PRO HA 1 1
6 1304 1 1 13 PRO HB2 H -11.251 4.704 0.000 1.00 . A A . 13 PRO HB2 1 1
6 1305 1 1 13 PRO HB3 H -9.862 5.787 -0.134 1.00 . A A . 13 PRO HB3 1 1
6 1306 1 1 13 PRO HD2 H -8.359 2.953 -2.265 1.00 . A A . 13 PRO HD2 1 1
6 1307 1 1 13 PRO HD3 H -7.827 4.581 -1.802 1.00 . A A . 13 PRO HD3 1 1
6 1308 1 1 13 PRO HG2 H -10.590 3.434 -1.836 1.00 . A A . 13 PRO HG2 1 1
6 1309 1 1 13 PRO HG3 H -10.032 5.043 -2.335 1.00 . A A . 13 PRO HG3 1 1
6 1310 1 1 13 PRO N N -8.326 3.324 -0.178 1.00 . A A . 13 PRO N 1 1
6 1311 1 1 13 PRO O O -11.205 3.128 2.115 1.00 . A A . 13 PRO O 1 1
6 1312 1 1 14 ASP C C -10.199 0.100 2.966 1.00 . A A . 14 ASP C 1 1
6 1313 1 1 14 ASP CA C -10.840 0.465 1.632 1.00 . A A . 14 ASP CA 1 1
6 1314 1 1 14 ASP CB C -10.969 -0.772 0.719 1.00 . A A . 14 ASP CB 1 1
6 1315 1 1 14 ASP CG C -9.666 -1.481 0.423 1.00 . A A . 14 ASP CG 1 1
6 1316 1 1 14 ASP H H -9.418 1.325 0.320 1.00 . A A . 14 ASP H 1 1
6 1317 1 1 14 ASP HA H -11.824 0.861 1.839 1.00 . A A . 14 ASP HA 1 1
6 1318 1 1 14 ASP HB2 H -11.627 -1.482 1.194 1.00 . A A . 14 ASP HB2 1 1
6 1319 1 1 14 ASP HB3 H -11.414 -0.464 -0.216 1.00 . A A . 14 ASP HB3 1 1
6 1320 1 1 14 ASP N N -10.089 1.540 1.004 1.00 . A A . 14 ASP N 1 1
6 1321 1 1 14 ASP O O -10.794 -0.592 3.780 1.00 . A A . 14 ASP O 1 1
6 1322 1 1 14 ASP OD1 O -8.830 -0.912 -0.291 1.00 . A A . 14 ASP OD1 1 1
6 1323 1 1 14 ASP OD2 O -9.495 -2.651 0.847 1.00 . A A . 14 ASP OD2 1 1
6 1324 2 2 1 . C C -1.916 1.662 3.797 1.00 . B A . 101 WMH C 1 1
6 1325 2 2 1 . C1 C -1.366 3.562 2.416 1.00 . B A . 101 WMH C1 1 1
6 1326 2 2 1 . C2 C -0.254 4.302 2.192 1.00 . B A . 101 WMH C2 1 1
6 1327 2 2 1 . H1 H -2.294 1.954 4.761 1.00 . B A . 101 WMH H1 1 1
6 1328 2 2 1 . H2 H -2.764 1.658 3.129 1.00 . B A . 101 WMH H2 1 1
6 1329 2 2 1 . H5 H -0.169 5.128 1.501 1.00 . B A . 101 WMH H5 1 1
6 1330 2 2 1 . N N -1.069 2.652 3.315 1.00 . B A . 101 WMH N 1 1
6 1331 2 2 1 . N1 N 0.716 3.834 2.975 1.00 . B A . 101 WMH N1 1 1
6 1332 2 2 1 . N2 N 0.271 2.845 3.667 1.00 . B A . 101 WMH N2 1 1
7 1333 1 1 1 GLY C C -6.790 -0.911 3.767 1.00 . A A . 1 GLY C 1 1
7 1334 1 1 1 GLY CA C -7.901 -0.008 4.195 1.00 . A A . 1 GLY CA 1 1
7 1335 1 1 1 GLY H1 H -8.560 0.995 2.464 1.00 . A A . 1 GLY H1 1 1
7 1336 1 1 1 GLY HA2 H -7.481 0.911 4.573 1.00 . A A . 1 GLY HA2 1 1
7 1337 1 1 1 GLY HA3 H -8.458 -0.488 4.987 1.00 . A A . 1 GLY HA3 1 1
7 1338 1 1 1 GLY N N -8.802 0.305 3.122 1.00 . A A . 1 GLY N 1 1
7 1339 1 1 1 GLY O O -6.394 -1.813 4.510 1.00 . A A . 1 GLY O 1 1
7 1340 1 1 2 ARG C C -3.965 -0.658 1.901 1.00 . A A . 2 ARG C 1 1
7 1341 1 1 2 ARG CA C -5.200 -1.499 2.066 1.00 . A A . 2 ARG CA 1 1
7 1342 1 1 2 ARG CB C -5.542 -2.142 0.724 1.00 . A A . 2 ARG CB 1 1
7 1343 1 1 2 ARG CD C -6.978 -3.663 -0.610 1.00 . A A . 2 ARG CD 1 1
7 1344 1 1 2 ARG CG C -6.760 -3.025 0.742 1.00 . A A . 2 ARG CG 1 1
7 1345 1 1 2 ARG CZ C -8.349 -5.642 -1.221 1.00 . A A . 2 ARG CZ 1 1
7 1346 1 1 2 ARG H H -6.636 0.050 2.034 1.00 . A A . 2 ARG H 1 1
7 1347 1 1 2 ARG HA H -5.002 -2.278 2.786 1.00 . A A . 2 ARG HA 1 1
7 1348 1 1 2 ARG HB2 H -5.709 -1.362 -0.003 1.00 . A A . 2 ARG HB2 1 1
7 1349 1 1 2 ARG HB3 H -4.699 -2.735 0.405 1.00 . A A . 2 ARG HB3 1 1
7 1350 1 1 2 ARG HD2 H -7.023 -2.886 -1.360 1.00 . A A . 2 ARG HD2 1 1
7 1351 1 1 2 ARG HD3 H -6.147 -4.318 -0.820 1.00 . A A . 2 ARG HD3 1 1
7 1352 1 1 2 ARG HE H -8.979 -3.946 -0.248 1.00 . A A . 2 ARG HE 1 1
7 1353 1 1 2 ARG HG2 H -6.623 -3.803 1.479 1.00 . A A . 2 ARG HG2 1 1
7 1354 1 1 2 ARG HG3 H -7.626 -2.432 0.996 1.00 . A A . 2 ARG HG3 1 1
7 1355 1 1 2 ARG HH11 H -6.349 -5.901 -1.635 1.00 . A A . 2 ARG HH11 1 1
7 1356 1 1 2 ARG HH12 H -7.325 -7.200 -2.104 1.00 . A A . 2 ARG HH12 1 1
7 1357 1 1 2 ARG HH21 H -10.383 -5.755 -0.972 1.00 . A A . 2 ARG HH21 1 1
7 1358 1 1 2 ARG HH22 H -9.682 -7.109 -1.734 1.00 . A A . 2 ARG HH22 1 1
7 1359 1 1 2 ARG N N -6.284 -0.691 2.574 1.00 . A A . 2 ARG N 1 1
7 1360 1 1 2 ARG NE N -8.216 -4.434 -0.654 1.00 . A A . 2 ARG NE 1 1
7 1361 1 1 2 ARG NH1 N -7.273 -6.288 -1.687 1.00 . A A . 2 ARG NH1 1 1
7 1362 1 1 2 ARG NH2 N -9.553 -6.207 -1.313 1.00 . A A . 2 ARG NH2 1 1
7 1363 1 1 2 ARG O O -3.919 0.212 1.055 1.00 . A A . 2 ARG O 1 1
7 1364 1 1 3 ALA C C -0.683 -1.254 2.355 1.00 . A A . 3 ALA C 1 1
7 1365 1 1 3 ALA CA C -1.737 -0.226 2.652 1.00 . A A . 3 ALA CA 1 1
7 1366 1 1 3 ALA CB C -1.464 0.515 3.961 1.00 . A A . 3 ALA CB 1 1
7 1367 1 1 3 ALA H H -3.155 -1.528 3.457 1.00 . A A . 3 ALA H 1 1
7 1368 1 1 3 ALA HA H -1.770 0.485 1.840 1.00 . A A . 3 ALA HA 1 1
7 1369 1 1 3 ALA HB1 H -0.397 0.639 4.073 1.00 . A A . 3 ALA HB1 1 1
7 1370 1 1 3 ALA HB2 H -1.837 -0.071 4.787 1.00 . A A . 3 ALA HB2 1 1
7 1371 1 1 3 ALA N N -3.013 -0.883 2.731 1.00 . A A . 3 ALA N 1 1
7 1372 1 1 3 ALA O O -0.676 -2.333 2.965 1.00 . A A . 3 ALA O 1 1
7 1373 1 1 4 THR C C 2.355 -1.927 1.993 1.00 . A A . 4 THR C 1 1
7 1374 1 1 4 THR CA C 1.190 -1.886 1.009 1.00 . A A . 4 THR CA 1 1
7 1375 1 1 4 THR CB C 1.683 -1.545 -0.413 1.00 . A A . 4 THR CB 1 1
7 1376 1 1 4 THR CG2 C 0.622 -1.885 -1.449 1.00 . A A . 4 THR CG2 1 1
7 1377 1 1 4 THR H H 0.136 -0.096 0.955 1.00 . A A . 4 THR H 1 1
7 1378 1 1 4 THR HA H 0.736 -2.866 0.977 1.00 . A A . 4 THR HA 1 1
7 1379 1 1 4 THR HB H 2.576 -2.117 -0.619 1.00 . A A . 4 THR HB 1 1
7 1380 1 1 4 THR HG1 H 2.798 -0.064 -1.027 1.00 . A A . 4 THR HG1 1 1
7 1381 1 1 4 THR HG21 H 0.988 -1.639 -2.435 1.00 . A A . 4 THR HG21 1 1
7 1382 1 1 4 THR HG22 H -0.273 -1.316 -1.245 1.00 . A A . 4 THR HG22 1 1
7 1383 1 1 4 THR HG23 H 0.396 -2.939 -1.400 1.00 . A A . 4 THR HG23 1 1
7 1384 1 1 4 THR N N 0.172 -0.960 1.420 1.00 . A A . 4 THR N 1 1
7 1385 1 1 4 THR O O 2.860 -0.877 2.431 1.00 . A A . 4 THR O 1 1
7 1386 1 1 4 THR OG1 O 1.992 -0.145 -0.494 1.00 . A A . 4 THR OG1 1 1
7 1387 1 1 5 LYS C C 5.186 -3.236 2.454 1.00 . A A . 5 LYS C 1 1
7 1388 1 1 5 LYS CA C 3.892 -3.314 3.251 1.00 . A A . 5 LYS CA 1 1
7 1389 1 1 5 LYS CB C 3.800 -4.650 4.027 1.00 . A A . 5 LYS CB 1 1
7 1390 1 1 5 LYS CD C 3.756 -7.162 4.029 1.00 . A A . 5 LYS CD 1 1
7 1391 1 1 5 LYS CE C 3.961 -8.440 3.217 1.00 . A A . 5 LYS CE 1 1
7 1392 1 1 5 LYS CG C 3.848 -5.913 3.167 1.00 . A A . 5 LYS CG 1 1
7 1393 1 1 5 LYS H H 2.296 -3.920 2.004 1.00 . A A . 5 LYS H 1 1
7 1394 1 1 5 LYS HA H 3.883 -2.492 3.951 1.00 . A A . 5 LYS HA 1 1
7 1395 1 1 5 LYS HB2 H 4.625 -4.696 4.722 1.00 . A A . 5 LYS HB2 1 1
7 1396 1 1 5 LYS HB3 H 2.880 -4.660 4.590 1.00 . A A . 5 LYS HB3 1 1
7 1397 1 1 5 LYS HD2 H 4.515 -7.110 4.795 1.00 . A A . 5 LYS HD2 1 1
7 1398 1 1 5 LYS HD3 H 2.781 -7.193 4.495 1.00 . A A . 5 LYS HD3 1 1
7 1399 1 1 5 LYS HE2 H 3.832 -9.292 3.869 1.00 . A A . 5 LYS HE2 1 1
7 1400 1 1 5 LYS HE3 H 3.218 -8.475 2.434 1.00 . A A . 5 LYS HE3 1 1
7 1401 1 1 5 LYS HG2 H 3.018 -5.900 2.478 1.00 . A A . 5 LYS HG2 1 1
7 1402 1 1 5 LYS HG3 H 4.775 -5.930 2.613 1.00 . A A . 5 LYS HG3 1 1
7 1403 1 1 5 LYS HZ1 H 6.060 -8.419 3.326 1.00 . A A . 5 LYS HZ1 1 1
7 1404 1 1 5 LYS HZ2 H 5.442 -7.756 1.899 1.00 . A A . 5 LYS HZ2 1 1
7 1405 1 1 5 LYS HZ3 H 5.446 -9.410 2.117 1.00 . A A . 5 LYS HZ3 1 1
7 1406 1 1 5 LYS N N 2.767 -3.133 2.356 1.00 . A A . 5 LYS N 1 1
7 1407 1 1 5 LYS NZ N 5.312 -8.503 2.608 1.00 . A A . 5 LYS NZ 1 1
7 1408 1 1 5 LYS O O 6.234 -2.855 2.973 1.00 . A A . 5 LYS O 1 1
7 1409 1 1 6 SER C C 6.267 -2.117 -0.324 1.00 . A A . 6 SER C 1 1
7 1410 1 1 6 SER CA C 6.212 -3.510 0.299 1.00 . A A . 6 SER CA 1 1
7 1411 1 1 6 SER CB C 6.072 -4.601 -0.765 1.00 . A A . 6 SER CB 1 1
7 1412 1 1 6 SER H H 4.236 -3.874 0.824 1.00 . A A . 6 SER H 1 1
7 1413 1 1 6 SER HA H 7.113 -3.681 0.869 1.00 . A A . 6 SER HA 1 1
7 1414 1 1 6 SER HB2 H 6.821 -4.454 -1.527 1.00 . A A . 6 SER HB2 1 1
7 1415 1 1 6 SER HB3 H 6.205 -5.570 -0.307 1.00 . A A . 6 SER HB3 1 1
7 1416 1 1 6 SER HG H 4.951 -4.578 -2.339 1.00 . A A . 6 SER HG 1 1
7 1417 1 1 6 SER N N 5.096 -3.577 1.191 1.00 . A A . 6 SER N 1 1
7 1418 1 1 6 SER O O 5.315 -1.327 -0.181 1.00 . A A . 6 SER O 1 1
7 1419 1 1 6 SER OG O 4.789 -4.558 -1.387 1.00 . A A . 6 SER OG 1 1
7 1420 1 1 7 ILE C C 6.857 -0.495 -2.980 1.00 . A A . 7 ILE C 1 1
7 1421 1 1 7 ILE CA C 7.458 -0.482 -1.574 1.00 . A A . 7 ILE CA 1 1
7 1422 1 1 7 ILE CB C 8.916 0.058 -1.615 1.00 . A A . 7 ILE CB 1 1
7 1423 1 1 7 ILE CD1 C 11.238 -0.357 -2.612 1.00 . A A . 7 ILE CD1 1 1
7 1424 1 1 7 ILE CG1 C 9.836 -0.882 -2.412 1.00 . A A . 7 ILE CG1 1 1
7 1425 1 1 7 ILE CG2 C 9.440 0.263 -0.195 1.00 . A A . 7 ILE CG2 1 1
7 1426 1 1 7 ILE H H 8.089 -2.424 -1.074 1.00 . A A . 7 ILE H 1 1
7 1427 1 1 7 ILE HA H 6.859 0.180 -0.965 1.00 . A A . 7 ILE HA 1 1
7 1428 1 1 7 ILE HB H 8.893 1.022 -2.097 1.00 . A A . 7 ILE HB 1 1
7 1429 1 1 7 ILE HD11 H 11.198 0.584 -3.142 1.00 . A A . 7 ILE HD11 1 1
7 1430 1 1 7 ILE HD12 H 11.813 -1.069 -3.183 1.00 . A A . 7 ILE HD12 1 1
7 1431 1 1 7 ILE HD13 H 11.704 -0.207 -1.649 1.00 . A A . 7 ILE HD13 1 1
7 1432 1 1 7 ILE HG12 H 9.923 -1.813 -1.874 1.00 . A A . 7 ILE HG12 1 1
7 1433 1 1 7 ILE HG13 H 9.403 -1.067 -3.383 1.00 . A A . 7 ILE HG13 1 1
7 1434 1 1 7 ILE HG21 H 8.810 0.972 0.319 1.00 . A A . 7 ILE HG21 1 1
7 1435 1 1 7 ILE HG22 H 10.450 0.641 -0.236 1.00 . A A . 7 ILE HG22 1 1
7 1436 1 1 7 ILE HG23 H 9.429 -0.680 0.333 1.00 . A A . 7 ILE HG23 1 1
7 1437 1 1 7 ILE N N 7.352 -1.784 -0.971 1.00 . A A . 7 ILE N 1 1
7 1438 1 1 7 ILE O O 6.890 -1.528 -3.671 1.00 . A A . 7 ILE O 1 1
7 1439 1 1 8 PRO C C 4.812 1.759 -1.755 1.00 . A A . 8 PRO C 1 1
7 1440 1 1 8 PRO CA C 6.097 1.817 -2.611 1.00 . A A . 8 PRO CA 1 1
7 1441 1 1 8 PRO CB C 5.989 2.929 -3.675 1.00 . A A . 8 PRO CB 1 1
7 1442 1 1 8 PRO CD C 5.709 0.799 -4.743 1.00 . A A . 8 PRO CD 1 1
7 1443 1 1 8 PRO CG C 6.035 2.236 -5.006 1.00 . A A . 8 PRO CG 1 1
7 1444 1 1 8 PRO HA H 6.952 1.996 -1.976 1.00 . A A . 8 PRO HA 1 1
7 1445 1 1 8 PRO HB2 H 5.059 3.461 -3.541 1.00 . A A . 8 PRO HB2 1 1
7 1446 1 1 8 PRO HB3 H 6.814 3.618 -3.563 1.00 . A A . 8 PRO HB3 1 1
7 1447 1 1 8 PRO HD2 H 4.641 0.643 -4.743 1.00 . A A . 8 PRO HD2 1 1
7 1448 1 1 8 PRO HD3 H 6.195 0.153 -5.459 1.00 . A A . 8 PRO HD3 1 1
7 1449 1 1 8 PRO HG2 H 5.311 2.669 -5.680 1.00 . A A . 8 PRO HG2 1 1
7 1450 1 1 8 PRO HG3 H 7.028 2.320 -5.422 1.00 . A A . 8 PRO HG3 1 1
7 1451 1 1 8 PRO N N 6.261 0.610 -3.414 1.00 . A A . 8 PRO N 1 1
7 1452 1 1 8 PRO O O 3.871 1.028 -2.086 1.00 . A A . 8 PRO O 1 1
7 1453 1 1 9 PRO C C 2.447 3.285 -0.399 1.00 . A A . 9 PRO C 1 1
7 1454 1 1 9 PRO CA C 3.606 2.528 0.244 1.00 . A A . 9 PRO CA 1 1
7 1455 1 1 9 PRO CB C 4.094 3.260 1.496 1.00 . A A . 9 PRO CB 1 1
7 1456 1 1 9 PRO CD C 5.872 3.313 -0.105 1.00 . A A . 9 PRO CD 1 1
7 1457 1 1 9 PRO CG C 5.259 4.064 1.042 1.00 . A A . 9 PRO CG 1 1
7 1458 1 1 9 PRO HA H 3.277 1.533 0.502 1.00 . A A . 9 PRO HA 1 1
7 1459 1 1 9 PRO HB2 H 3.295 3.888 1.860 1.00 . A A . 9 PRO HB2 1 1
7 1460 1 1 9 PRO HB3 H 4.372 2.549 2.258 1.00 . A A . 9 PRO HB3 1 1
7 1461 1 1 9 PRO HD2 H 6.214 3.998 -0.866 1.00 . A A . 9 PRO HD2 1 1
7 1462 1 1 9 PRO HD3 H 6.684 2.691 0.238 1.00 . A A . 9 PRO HD3 1 1
7 1463 1 1 9 PRO HG2 H 4.925 5.039 0.717 1.00 . A A . 9 PRO HG2 1 1
7 1464 1 1 9 PRO HG3 H 5.970 4.165 1.848 1.00 . A A . 9 PRO HG3 1 1
7 1465 1 1 9 PRO N N 4.775 2.490 -0.626 1.00 . A A . 9 PRO N 1 1
7 1466 1 1 9 PRO O O 2.485 4.527 -0.546 1.00 . A A . 9 PRO O 1 1
7 1467 1 1 10 ARG C C -0.867 2.606 -0.638 1.00 . A A . 10 ARG C 1 1
7 1468 1 1 10 ARG CA C 0.290 3.093 -1.437 1.00 . A A . 10 ARG CA 1 1
7 1469 1 1 10 ARG CB C 0.149 2.669 -2.912 1.00 . A A . 10 ARG CB 1 1
7 1470 1 1 10 ARG CD C 1.587 4.569 -3.687 1.00 . A A . 10 ARG CD 1 1
7 1471 1 1 10 ARG CG C 1.326 3.076 -3.786 1.00 . A A . 10 ARG CG 1 1
7 1472 1 1 10 ARG CZ C 3.826 5.616 -3.938 1.00 . A A . 10 ARG CZ 1 1
7 1473 1 1 10 ARG H H 1.532 1.567 -0.747 1.00 . A A . 10 ARG H 1 1
7 1474 1 1 10 ARG HA H 0.331 4.168 -1.367 1.00 . A A . 10 ARG HA 1 1
7 1475 1 1 10 ARG HB2 H 0.054 1.595 -2.954 1.00 . A A . 10 ARG HB2 1 1
7 1476 1 1 10 ARG HB3 H -0.746 3.114 -3.319 1.00 . A A . 10 ARG HB3 1 1
7 1477 1 1 10 ARG HD2 H 0.725 5.100 -4.061 1.00 . A A . 10 ARG HD2 1 1
7 1478 1 1 10 ARG HD3 H 1.738 4.827 -2.652 1.00 . A A . 10 ARG HD3 1 1
7 1479 1 1 10 ARG HE H 2.712 4.770 -5.412 1.00 . A A . 10 ARG HE 1 1
7 1480 1 1 10 ARG HG2 H 2.208 2.543 -3.459 1.00 . A A . 10 ARG HG2 1 1
7 1481 1 1 10 ARG HG3 H 1.108 2.821 -4.813 1.00 . A A . 10 ARG HG3 1 1
7 1482 1 1 10 ARG HH11 H 3.243 5.472 -1.963 1.00 . A A . 10 ARG HH11 1 1
7 1483 1 1 10 ARG HH12 H 4.725 6.266 -2.214 1.00 . A A . 10 ARG HH12 1 1
7 1484 1 1 10 ARG HH21 H 4.769 5.900 -5.735 1.00 . A A . 10 ARG HH21 1 1
7 1485 1 1 10 ARG HH22 H 5.599 6.541 -4.410 1.00 . A A . 10 ARG HH22 1 1
7 1486 1 1 10 ARG N N 1.474 2.548 -0.839 1.00 . A A . 10 ARG N 1 1
7 1487 1 1 10 ARG NE N 2.767 4.977 -4.450 1.00 . A A . 10 ARG NE 1 1
7 1488 1 1 10 ARG NH1 N 3.935 5.799 -2.618 1.00 . A A . 10 ARG NH1 1 1
7 1489 1 1 10 ARG NH2 N 4.793 6.040 -4.739 1.00 . A A . 10 ARG NH2 1 1
7 1490 1 1 10 ARG O O -0.915 1.426 -0.267 1.00 . A A . 10 ARG O 1 1
7 1491 1 1 11 ALA C C -4.142 3.326 -0.249 1.00 . A A . 11 ALA C 1 1
7 1492 1 1 11 ALA CA C -2.866 3.128 0.500 1.00 . A A . 11 ALA CA 1 1
7 1493 1 1 11 ALA CB C -2.873 3.871 1.845 1.00 . A A . 11 ALA CB 1 1
7 1494 1 1 11 ALA H H -1.666 4.418 -0.622 1.00 . A A . 11 ALA H 1 1
7 1495 1 1 11 ALA HA H -2.769 2.072 0.697 1.00 . A A . 11 ALA HA 1 1
7 1496 1 1 11 ALA HB1 H -3.643 3.448 2.472 1.00 . A A . 11 ALA HB1 1 1
7 1497 1 1 11 ALA HB2 H -3.088 4.919 1.724 1.00 . A A . 11 ALA HB2 1 1
7 1498 1 1 11 ALA N N -1.753 3.492 -0.310 1.00 . A A . 11 ALA N 1 1
7 1499 1 1 11 ALA O O -4.280 4.273 -1.038 1.00 . A A . 11 ALA O 1 1
7 1500 1 1 12 PHE C C -7.447 2.575 0.272 1.00 . A A . 12 PHE C 1 1
7 1501 1 1 12 PHE CA C -6.306 2.427 -0.723 1.00 . A A . 12 PHE CA 1 1
7 1502 1 1 12 PHE CB C -6.453 1.141 -1.551 1.00 . A A . 12 PHE CB 1 1
7 1503 1 1 12 PHE CD1 C -4.309 0.093 -2.356 1.00 . A A . 12 PHE CD1 1 1
7 1504 1 1 12 PHE CD2 C -5.412 1.656 -3.780 1.00 . A A . 12 PHE CD2 1 1
7 1505 1 1 12 PHE CE1 C -3.315 -0.070 -3.300 1.00 . A A . 12 PHE CE1 1 1
7 1506 1 1 12 PHE CE2 C -4.421 1.497 -4.728 1.00 . A A . 12 PHE CE2 1 1
7 1507 1 1 12 PHE CG C -5.370 0.958 -2.584 1.00 . A A . 12 PHE CG 1 1
7 1508 1 1 12 PHE CZ C -3.370 0.633 -4.487 1.00 . A A . 12 PHE CZ 1 1
7 1509 1 1 12 PHE H H -4.845 1.739 0.635 1.00 . A A . 12 PHE H 1 1
7 1510 1 1 12 PHE HA H -6.308 3.274 -1.393 1.00 . A A . 12 PHE HA 1 1
7 1511 1 1 12 PHE HB2 H -6.440 0.288 -0.890 1.00 . A A . 12 PHE HB2 1 1
7 1512 1 1 12 PHE HB3 H -7.400 1.168 -2.069 1.00 . A A . 12 PHE HB3 1 1
7 1513 1 1 12 PHE HD1 H -4.260 -0.458 -1.426 1.00 . A A . 12 PHE HD1 1 1
7 1514 1 1 12 PHE HD2 H -6.232 2.334 -3.966 1.00 . A A . 12 PHE HD2 1 1
7 1515 1 1 12 PHE HE1 H -2.493 -0.746 -3.108 1.00 . A A . 12 PHE HE1 1 1
7 1516 1 1 12 PHE HE2 H -4.466 2.049 -5.655 1.00 . A A . 12 PHE HE2 1 1
7 1517 1 1 12 PHE HZ H -2.594 0.505 -5.227 1.00 . A A . 12 PHE HZ 1 1
7 1518 1 1 12 PHE N N -5.047 2.434 -0.034 1.00 . A A . 12 PHE N 1 1
7 1519 1 1 12 PHE O O -7.356 2.053 1.399 1.00 . A A . 12 PHE O 1 1
7 1520 1 1 13 PRO C C -10.238 2.500 1.600 1.00 . A A . 13 PRO C 1 1
7 1521 1 1 13 PRO CA C -9.706 3.616 0.693 1.00 . A A . 13 PRO CA 1 1
7 1522 1 1 13 PRO CB C -10.767 3.993 -0.330 1.00 . A A . 13 PRO CB 1 1
7 1523 1 1 13 PRO CD C -8.695 3.846 -1.512 1.00 . A A . 13 PRO CD 1 1
7 1524 1 1 13 PRO CG C -10.006 4.575 -1.460 1.00 . A A . 13 PRO CG 1 1
7 1525 1 1 13 PRO HA H -9.507 4.483 1.305 1.00 . A A . 13 PRO HA 1 1
7 1526 1 1 13 PRO HB2 H -11.298 3.102 -0.631 1.00 . A A . 13 PRO HB2 1 1
7 1527 1 1 13 PRO HB3 H -11.456 4.706 0.097 1.00 . A A . 13 PRO HB3 1 1
7 1528 1 1 13 PRO HD2 H -8.728 3.062 -2.254 1.00 . A A . 13 PRO HD2 1 1
7 1529 1 1 13 PRO HD3 H -7.900 4.540 -1.739 1.00 . A A . 13 PRO HD3 1 1
7 1530 1 1 13 PRO HG2 H -10.553 4.430 -2.380 1.00 . A A . 13 PRO HG2 1 1
7 1531 1 1 13 PRO HG3 H -9.844 5.629 -1.286 1.00 . A A . 13 PRO HG3 1 1
7 1532 1 1 13 PRO N N -8.531 3.282 -0.143 1.00 . A A . 13 PRO N 1 1
7 1533 1 1 13 PRO O O -10.560 2.755 2.764 1.00 . A A . 13 PRO O 1 1
7 1534 1 1 14 ASP C C -9.957 -0.313 3.011 1.00 . A A . 14 ASP C 1 1
7 1535 1 1 14 ASP CA C -10.888 0.162 1.892 1.00 . A A . 14 ASP CA 1 1
7 1536 1 1 14 ASP CB C -11.364 -1.030 1.018 1.00 . A A . 14 ASP CB 1 1
7 1537 1 1 14 ASP CG C -10.255 -1.884 0.427 1.00 . A A . 14 ASP CG 1 1
7 1538 1 1 14 ASP H H -9.977 1.118 0.190 1.00 . A A . 14 ASP H 1 1
7 1539 1 1 14 ASP HA H -11.751 0.589 2.384 1.00 . A A . 14 ASP HA 1 1
7 1540 1 1 14 ASP HB2 H -11.981 -1.678 1.621 1.00 . A A . 14 ASP HB2 1 1
7 1541 1 1 14 ASP HB3 H -11.964 -0.641 0.208 1.00 . A A . 14 ASP HB3 1 1
7 1542 1 1 14 ASP N N -10.308 1.270 1.103 1.00 . A A . 14 ASP N 1 1
7 1543 1 1 14 ASP O O -10.301 -1.228 3.771 1.00 . A A . 14 ASP O 1 1
7 1544 1 1 14 ASP OD1 O -10.044 -3.023 0.901 1.00 . A A . 14 ASP OD1 1 1
7 1545 1 1 14 ASP OD2 O -9.610 -1.457 -0.539 1.00 . A A . 14 ASP OD2 1 1
7 1546 2 2 1 . C C -2.108 1.887 4.005 1.00 . B A . 101 WMH C 1 1
7 1547 2 2 1 . C1 C -1.567 3.773 2.592 1.00 . B A . 101 WMH C1 1 1
7 1548 2 2 1 . C2 C -0.450 4.521 2.379 1.00 . B A . 101 WMH C2 1 1
7 1549 2 2 1 . H1 H -2.534 2.189 4.945 1.00 . B A . 101 WMH H1 1 1
7 1550 2 2 1 . H2 H -2.930 1.827 3.311 1.00 . B A . 101 WMH H2 1 1
7 1551 2 2 1 . H5 H -0.359 5.337 1.678 1.00 . B A . 101 WMH H5 1 1
7 1552 2 2 1 . N N -1.275 2.880 3.516 1.00 . B A . 101 WMH N 1 1
7 1553 2 2 1 . N1 N 0.505 4.075 3.178 1.00 . B A . 101 WMH N1 1 1
7 1554 2 2 1 . N2 N 0.058 3.093 3.882 1.00 . B A . 101 WMH N2 1 1
8 1555 1 1 1 GLY C C -7.385 -0.940 3.844 1.00 . A A . 1 GLY C 1 1
8 1556 1 1 1 GLY CA C -8.211 0.215 4.327 1.00 . A A . 1 GLY CA 1 1
8 1557 1 1 1 GLY H1 H -8.675 1.540 2.747 1.00 . A A . 1 GLY H1 1 1
8 1558 1 1 1 GLY HA2 H -7.557 0.982 4.709 1.00 . A A . 1 GLY HA2 1 1
8 1559 1 1 1 GLY HA3 H -8.862 -0.124 5.119 1.00 . A A . 1 GLY HA3 1 1
8 1560 1 1 1 GLY N N -9.006 0.779 3.270 1.00 . A A . 1 GLY N 1 1
8 1561 1 1 1 GLY O O -7.638 -2.102 4.193 1.00 . A A . 1 GLY O 1 1
8 1562 1 1 2 ARG C C -4.227 -1.014 2.214 1.00 . A A . 2 ARG C 1 1
8 1563 1 1 2 ARG CA C -5.555 -1.659 2.484 1.00 . A A . 2 ARG CA 1 1
8 1564 1 1 2 ARG CB C -6.157 -2.176 1.190 1.00 . A A . 2 ARG CB 1 1
8 1565 1 1 2 ARG CD C -6.237 -3.873 -0.634 1.00 . A A . 2 ARG CD 1 1
8 1566 1 1 2 ARG CG C -5.605 -3.501 0.699 1.00 . A A . 2 ARG CG 1 1
8 1567 1 1 2 ARG CZ C -8.546 -4.199 -1.540 1.00 . A A . 2 ARG CZ 1 1
8 1568 1 1 2 ARG H H -6.231 0.294 2.812 1.00 . A A . 2 ARG H 1 1
8 1569 1 1 2 ARG HA H -5.447 -2.465 3.192 1.00 . A A . 2 ARG HA 1 1
8 1570 1 1 2 ARG HB2 H -7.223 -2.266 1.320 1.00 . A A . 2 ARG HB2 1 1
8 1571 1 1 2 ARG HB3 H -5.965 -1.442 0.424 1.00 . A A . 2 ARG HB3 1 1
8 1572 1 1 2 ARG HD2 H -5.883 -3.190 -1.393 1.00 . A A . 2 ARG HD2 1 1
8 1573 1 1 2 ARG HD3 H -5.944 -4.881 -0.893 1.00 . A A . 2 ARG HD3 1 1
8 1574 1 1 2 ARG HE H -8.088 -3.408 0.237 1.00 . A A . 2 ARG HE 1 1
8 1575 1 1 2 ARG HG2 H -4.535 -3.416 0.575 1.00 . A A . 2 ARG HG2 1 1
8 1576 1 1 2 ARG HG3 H -5.829 -4.271 1.422 1.00 . A A . 2 ARG HG3 1 1
8 1577 1 1 2 ARG HH11 H -7.101 -4.900 -2.817 1.00 . A A . 2 ARG HH11 1 1
8 1578 1 1 2 ARG HH12 H -8.683 -5.076 -3.401 1.00 . A A . 2 ARG HH12 1 1
8 1579 1 1 2 ARG HH21 H -10.185 -3.514 -0.565 1.00 . A A . 2 ARG HH21 1 1
8 1580 1 1 2 ARG HH22 H -10.522 -4.264 -2.076 1.00 . A A . 2 ARG HH22 1 1
8 1581 1 1 2 ARG N N -6.411 -0.645 3.036 1.00 . A A . 2 ARG N 1 1
8 1582 1 1 2 ARG NE N -7.710 -3.808 -0.577 1.00 . A A . 2 ARG NE 1 1
8 1583 1 1 2 ARG NH1 N -8.085 -4.760 -2.661 1.00 . A A . 2 ARG NH1 1 1
8 1584 1 1 2 ARG NH2 N -9.845 -3.985 -1.393 1.00 . A A . 2 ARG NH2 1 1
8 1585 1 1 2 ARG O O -4.160 -0.048 1.476 1.00 . A A . 2 ARG O 1 1
8 1586 1 1 3 ALA C C -0.891 -1.972 2.374 1.00 . A A . 3 ALA C 1 1
8 1587 1 1 3 ALA CA C -1.903 -0.922 2.672 1.00 . A A . 3 ALA CA 1 1
8 1588 1 1 3 ALA CB C -1.540 -0.144 3.940 1.00 . A A . 3 ALA CB 1 1
8 1589 1 1 3 ALA H H -3.303 -2.290 3.394 1.00 . A A . 3 ALA H 1 1
8 1590 1 1 3 ALA HA H -1.936 -0.225 1.848 1.00 . A A . 3 ALA HA 1 1
8 1591 1 1 3 ALA HB1 H -0.468 -0.170 4.070 1.00 . A A . 3 ALA HB1 1 1
8 1592 1 1 3 ALA HB2 H -2.006 -0.617 4.789 1.00 . A A . 3 ALA HB2 1 1
8 1593 1 1 3 ALA N N -3.207 -1.499 2.820 1.00 . A A . 3 ALA N 1 1
8 1594 1 1 3 ALA O O -0.885 -3.038 2.997 1.00 . A A . 3 ALA O 1 1
8 1595 1 1 4 THR C C 2.205 -2.213 1.876 1.00 . A A . 4 THR C 1 1
8 1596 1 1 4 THR CA C 0.980 -2.594 1.072 1.00 . A A . 4 THR CA 1 1
8 1597 1 1 4 THR CB C 1.277 -2.571 -0.451 1.00 . A A . 4 THR CB 1 1
8 1598 1 1 4 THR CG2 C 0.110 -3.146 -1.238 1.00 . A A . 4 THR CG2 1 1
8 1599 1 1 4 THR H H -0.159 -0.886 0.876 1.00 . A A . 4 THR H 1 1
8 1600 1 1 4 THR HA H 0.676 -3.590 1.356 1.00 . A A . 4 THR HA 1 1
8 1601 1 1 4 THR HB H 2.155 -3.168 -0.644 1.00 . A A . 4 THR HB 1 1
8 1602 1 1 4 THR HG1 H 2.157 -1.326 -1.629 1.00 . A A . 4 THR HG1 1 1
8 1603 1 1 4 THR HG21 H -0.055 -4.172 -0.944 1.00 . A A . 4 THR HG21 1 1
8 1604 1 1 4 THR HG22 H 0.331 -3.100 -2.294 1.00 . A A . 4 THR HG22 1 1
8 1605 1 1 4 THR HG23 H -0.778 -2.566 -1.033 1.00 . A A . 4 THR HG23 1 1
8 1606 1 1 4 THR N N -0.072 -1.707 1.407 1.00 . A A . 4 THR N 1 1
8 1607 1 1 4 THR O O 2.448 -1.021 2.131 1.00 . A A . 4 THR O 1 1
8 1608 1 1 4 THR OG1 O 1.534 -1.231 -0.898 1.00 . A A . 4 THR OG1 1 1
8 1609 1 1 5 LYS C C 5.305 -2.717 2.177 1.00 . A A . 5 LYS C 1 1
8 1610 1 1 5 LYS CA C 4.116 -2.935 3.092 1.00 . A A . 5 LYS CA 1 1
8 1611 1 1 5 LYS CB C 4.377 -4.057 4.104 1.00 . A A . 5 LYS CB 1 1
8 1612 1 1 5 LYS CD C 4.798 -6.472 4.589 1.00 . A A . 5 LYS CD 1 1
8 1613 1 1 5 LYS CE C 4.898 -7.870 4.016 1.00 . A A . 5 LYS CE 1 1
8 1614 1 1 5 LYS CG C 4.558 -5.442 3.503 1.00 . A A . 5 LYS CG 1 1
8 1615 1 1 5 LYS H H 2.688 -4.120 2.102 1.00 . A A . 5 LYS H 1 1
8 1616 1 1 5 LYS HA H 3.939 -2.015 3.629 1.00 . A A . 5 LYS HA 1 1
8 1617 1 1 5 LYS HB2 H 5.273 -3.815 4.654 1.00 . A A . 5 LYS HB2 1 1
8 1618 1 1 5 LYS HB3 H 3.550 -4.092 4.797 1.00 . A A . 5 LYS HB3 1 1
8 1619 1 1 5 LYS HD2 H 5.720 -6.238 5.100 1.00 . A A . 5 LYS HD2 1 1
8 1620 1 1 5 LYS HD3 H 3.978 -6.437 5.291 1.00 . A A . 5 LYS HD3 1 1
8 1621 1 1 5 LYS HE2 H 3.965 -8.113 3.532 1.00 . A A . 5 LYS HE2 1 1
8 1622 1 1 5 LYS HE3 H 5.696 -7.898 3.289 1.00 . A A . 5 LYS HE3 1 1
8 1623 1 1 5 LYS HG2 H 3.672 -5.711 2.950 1.00 . A A . 5 LYS HG2 1 1
8 1624 1 1 5 LYS HG3 H 5.407 -5.428 2.837 1.00 . A A . 5 LYS HG3 1 1
8 1625 1 1 5 LYS HZ1 H 6.086 -8.696 5.515 1.00 . A A . 5 LYS HZ1 1 1
8 1626 1 1 5 LYS HZ2 H 5.169 -9.830 4.667 1.00 . A A . 5 LYS HZ2 1 1
8 1627 1 1 5 LYS HZ3 H 4.436 -8.843 5.805 1.00 . A A . 5 LYS HZ3 1 1
8 1628 1 1 5 LYS N N 2.939 -3.195 2.315 1.00 . A A . 5 LYS N 1 1
8 1629 1 1 5 LYS NZ N 5.166 -8.869 5.065 1.00 . A A . 5 LYS NZ 1 1
8 1630 1 1 5 LYS O O 6.337 -2.164 2.598 1.00 . A A . 5 LYS O 1 1
8 1631 1 1 6 SER C C 6.233 -1.508 -0.490 1.00 . A A . 6 SER C 1 1
8 1632 1 1 6 SER CA C 6.185 -2.973 -0.053 1.00 . A A . 6 SER CA 1 1
8 1633 1 1 6 SER CB C 5.895 -3.893 -1.231 1.00 . A A . 6 SER CB 1 1
8 1634 1 1 6 SER H H 4.344 -3.613 0.672 1.00 . A A . 6 SER H 1 1
8 1635 1 1 6 SER HA H 7.134 -3.248 0.383 1.00 . A A . 6 SER HA 1 1
8 1636 1 1 6 SER HB2 H 6.567 -3.657 -2.041 1.00 . A A . 6 SER HB2 1 1
8 1637 1 1 6 SER HB3 H 6.034 -4.921 -0.929 1.00 . A A . 6 SER HB3 1 1
8 1638 1 1 6 SER HG H 4.352 -2.780 -1.675 1.00 . A A . 6 SER HG 1 1
8 1639 1 1 6 SER N N 5.169 -3.152 0.941 1.00 . A A . 6 SER N 1 1
8 1640 1 1 6 SER O O 5.194 -0.891 -0.700 1.00 . A A . 6 SER O 1 1
8 1641 1 1 6 SER OG O 4.552 -3.726 -1.687 1.00 . A A . 6 SER OG 1 1
8 1642 1 1 7 ILE C C 7.844 0.543 -2.475 1.00 . A A . 7 ILE C 1 1
8 1643 1 1 7 ILE CA C 7.625 0.413 -0.947 1.00 . A A . 7 ILE CA 1 1
8 1644 1 1 7 ILE CB C 8.851 0.970 -0.149 1.00 . A A . 7 ILE CB 1 1
8 1645 1 1 7 ILE CD1 C 9.761 1.253 2.238 1.00 . A A . 7 ILE CD1 1 1
8 1646 1 1 7 ILE CG1 C 8.614 0.789 1.362 1.00 . A A . 7 ILE CG1 1 1
8 1647 1 1 7 ILE CG2 C 9.114 2.436 -0.468 1.00 . A A . 7 ILE CG2 1 1
8 1648 1 1 7 ILE H H 8.209 -1.543 -0.478 1.00 . A A . 7 ILE H 1 1
8 1649 1 1 7 ILE HA H 6.739 0.966 -0.667 1.00 . A A . 7 ILE HA 1 1
8 1650 1 1 7 ILE HB H 9.725 0.398 -0.424 1.00 . A A . 7 ILE HB 1 1
8 1651 1 1 7 ILE HD11 H 9.505 1.103 3.277 1.00 . A A . 7 ILE HD11 1 1
8 1652 1 1 7 ILE HD12 H 9.948 2.302 2.060 1.00 . A A . 7 ILE HD12 1 1
8 1653 1 1 7 ILE HD13 H 10.647 0.683 1.997 1.00 . A A . 7 ILE HD13 1 1
8 1654 1 1 7 ILE HG12 H 7.739 1.354 1.651 1.00 . A A . 7 ILE HG12 1 1
8 1655 1 1 7 ILE HG13 H 8.438 -0.256 1.568 1.00 . A A . 7 ILE HG13 1 1
8 1656 1 1 7 ILE HG21 H 9.992 2.767 0.068 1.00 . A A . 7 ILE HG21 1 1
8 1657 1 1 7 ILE HG22 H 8.268 3.028 -0.157 1.00 . A A . 7 ILE HG22 1 1
8 1658 1 1 7 ILE HG23 H 9.271 2.551 -1.532 1.00 . A A . 7 ILE HG23 1 1
8 1659 1 1 7 ILE N N 7.419 -0.976 -0.605 1.00 . A A . 7 ILE N 1 1
8 1660 1 1 7 ILE O O 8.509 -0.317 -3.073 1.00 . A A . 7 ILE O 1 1
8 1661 1 1 8 PRO C C 5.053 2.006 -2.086 1.00 . A A . 8 PRO C 1 1
8 1662 1 1 8 PRO CA C 6.388 2.595 -2.534 1.00 . A A . 8 PRO CA 1 1
8 1663 1 1 8 PRO CB C 6.161 3.617 -3.667 1.00 . A A . 8 PRO CB 1 1
8 1664 1 1 8 PRO CD C 7.408 1.814 -4.586 1.00 . A A . 8 PRO CD 1 1
8 1665 1 1 8 PRO CG C 7.186 3.289 -4.695 1.00 . A A . 8 PRO CG 1 1
8 1666 1 1 8 PRO HA H 6.871 3.073 -1.696 1.00 . A A . 8 PRO HA 1 1
8 1667 1 1 8 PRO HB2 H 5.160 3.501 -4.056 1.00 . A A . 8 PRO HB2 1 1
8 1668 1 1 8 PRO HB3 H 6.286 4.620 -3.288 1.00 . A A . 8 PRO HB3 1 1
8 1669 1 1 8 PRO HD2 H 6.666 1.273 -5.154 1.00 . A A . 8 PRO HD2 1 1
8 1670 1 1 8 PRO HD3 H 8.404 1.559 -4.915 1.00 . A A . 8 PRO HD3 1 1
8 1671 1 1 8 PRO HG2 H 6.821 3.546 -5.677 1.00 . A A . 8 PRO HG2 1 1
8 1672 1 1 8 PRO HG3 H 8.101 3.822 -4.483 1.00 . A A . 8 PRO HG3 1 1
8 1673 1 1 8 PRO N N 7.258 1.571 -3.152 1.00 . A A . 8 PRO N 1 1
8 1674 1 1 8 PRO O O 4.379 1.309 -2.865 1.00 . A A . 8 PRO O 1 1
8 1675 1 1 9 PRO C C 2.181 2.318 -0.905 1.00 . A A . 9 PRO C 1 1
8 1676 1 1 9 PRO CA C 3.431 1.706 -0.280 1.00 . A A . 9 PRO CA 1 1
8 1677 1 1 9 PRO CB C 3.536 2.048 1.204 1.00 . A A . 9 PRO CB 1 1
8 1678 1 1 9 PRO CD C 5.332 3.171 0.110 1.00 . A A . 9 PRO CD 1 1
8 1679 1 1 9 PRO CG C 4.371 3.278 1.251 1.00 . A A . 9 PRO CG 1 1
8 1680 1 1 9 PRO HA H 3.405 0.634 -0.411 1.00 . A A . 9 PRO HA 1 1
8 1681 1 1 9 PRO HB2 H 2.548 2.223 1.604 1.00 . A A . 9 PRO HB2 1 1
8 1682 1 1 9 PRO HB3 H 4.008 1.233 1.733 1.00 . A A . 9 PRO HB3 1 1
8 1683 1 1 9 PRO HD2 H 5.506 4.142 -0.330 1.00 . A A . 9 PRO HD2 1 1
8 1684 1 1 9 PRO HD3 H 6.261 2.737 0.452 1.00 . A A . 9 PRO HD3 1 1
8 1685 1 1 9 PRO HG2 H 3.745 4.150 1.129 1.00 . A A . 9 PRO HG2 1 1
8 1686 1 1 9 PRO HG3 H 4.908 3.330 2.184 1.00 . A A . 9 PRO HG3 1 1
8 1687 1 1 9 PRO N N 4.650 2.271 -0.844 1.00 . A A . 9 PRO N 1 1
8 1688 1 1 9 PRO O O 2.098 3.538 -1.116 1.00 . A A . 9 PRO O 1 1
8 1689 1 1 10 ARG C C -1.079 1.680 -0.831 1.00 . A A . 10 ARG C 1 1
8 1690 1 1 10 ARG CA C 0.015 1.906 -1.833 1.00 . A A . 10 ARG CA 1 1
8 1691 1 1 10 ARG CB C -0.261 1.099 -3.103 1.00 . A A . 10 ARG CB 1 1
8 1692 1 1 10 ARG CD C -1.738 0.627 -5.064 1.00 . A A . 10 ARG CD 1 1
8 1693 1 1 10 ARG CG C -1.505 1.528 -3.868 1.00 . A A . 10 ARG CG 1 1
8 1694 1 1 10 ARG CZ C -3.493 0.295 -6.796 1.00 . A A . 10 ARG CZ 1 1
8 1695 1 1 10 ARG H H 1.353 0.519 -1.043 1.00 . A A . 10 ARG H 1 1
8 1696 1 1 10 ARG HA H 0.089 2.953 -2.076 1.00 . A A . 10 ARG HA 1 1
8 1697 1 1 10 ARG HB2 H 0.588 1.195 -3.762 1.00 . A A . 10 ARG HB2 1 1
8 1698 1 1 10 ARG HB3 H -0.372 0.060 -2.830 1.00 . A A . 10 ARG HB3 1 1
8 1699 1 1 10 ARG HD2 H -0.856 0.618 -5.686 1.00 . A A . 10 ARG HD2 1 1
8 1700 1 1 10 ARG HD3 H -1.922 -0.374 -4.699 1.00 . A A . 10 ARG HD3 1 1
8 1701 1 1 10 ARG HE H -3.216 1.964 -5.699 1.00 . A A . 10 ARG HE 1 1
8 1702 1 1 10 ARG HG2 H -2.361 1.470 -3.211 1.00 . A A . 10 ARG HG2 1 1
8 1703 1 1 10 ARG HG3 H -1.379 2.544 -4.211 1.00 . A A . 10 ARG HG3 1 1
8 1704 1 1 10 ARG HH11 H -2.298 -1.365 -6.540 1.00 . A A . 10 ARG HH11 1 1
8 1705 1 1 10 ARG HH12 H -3.518 -1.544 -7.712 1.00 . A A . 10 ARG HH12 1 1
8 1706 1 1 10 ARG HH21 H -4.857 1.718 -7.307 1.00 . A A . 10 ARG HH21 1 1
8 1707 1 1 10 ARG HH22 H -5.000 0.264 -8.187 1.00 . A A . 10 ARG HH22 1 1
8 1708 1 1 10 ARG N N 1.244 1.480 -1.235 1.00 . A A . 10 ARG N 1 1
8 1709 1 1 10 ARG NE N -2.890 1.050 -5.869 1.00 . A A . 10 ARG NE 1 1
8 1710 1 1 10 ARG NH1 N -3.069 -0.956 -7.034 1.00 . A A . 10 ARG NH1 1 1
8 1711 1 1 10 ARG NH2 N -4.522 0.786 -7.475 1.00 . A A . 10 ARG NH2 1 1
8 1712 1 1 10 ARG O O -1.279 0.545 -0.368 1.00 . A A . 10 ARG O 1 1
8 1713 1 1 11 ALA C C -4.102 2.945 -0.109 1.00 . A A . 11 ALA C 1 1
8 1714 1 1 11 ALA CA C -2.794 2.602 0.505 1.00 . A A . 11 ALA CA 1 1
8 1715 1 1 11 ALA CB C -2.544 3.398 1.788 1.00 . A A . 11 ALA CB 1 1
8 1716 1 1 11 ALA H H -1.549 3.617 -0.816 1.00 . A A . 11 ALA H 1 1
8 1717 1 1 11 ALA HA H -2.833 1.553 0.761 1.00 . A A . 11 ALA HA 1 1
8 1718 1 1 11 ALA HB1 H -3.321 3.164 2.499 1.00 . A A . 11 ALA HB1 1 1
8 1719 1 1 11 ALA HB2 H -2.562 4.458 1.602 1.00 . A A . 11 ALA HB2 1 1
8 1720 1 1 11 ALA N N -1.749 2.728 -0.449 1.00 . A A . 11 ALA N 1 1
8 1721 1 1 11 ALA O O -4.279 4.013 -0.686 1.00 . A A . 11 ALA O 1 1
8 1722 1 1 12 PHE C C -7.251 2.812 0.387 1.00 . A A . 12 PHE C 1 1
8 1723 1 1 12 PHE CA C -6.295 2.140 -0.580 1.00 . A A . 12 PHE CA 1 1
8 1724 1 1 12 PHE CB C -6.818 0.744 -0.930 1.00 . A A . 12 PHE CB 1 1
8 1725 1 1 12 PHE CD1 C -6.486 -0.189 -3.234 1.00 . A A . 12 PHE CD1 1 1
8 1726 1 1 12 PHE CD2 C -4.771 -0.582 -1.635 1.00 . A A . 12 PHE CD2 1 1
8 1727 1 1 12 PHE CE1 C -5.771 -0.895 -4.173 1.00 . A A . 12 PHE CE1 1 1
8 1728 1 1 12 PHE CE2 C -4.050 -1.287 -2.569 1.00 . A A . 12 PHE CE2 1 1
8 1729 1 1 12 PHE CG C -6.004 -0.020 -1.956 1.00 . A A . 12 PHE CG 1 1
8 1730 1 1 12 PHE CZ C -4.552 -1.444 -3.840 1.00 . A A . 12 PHE CZ 1 1
8 1731 1 1 12 PHE H H -4.763 1.272 0.585 1.00 . A A . 12 PHE H 1 1
8 1732 1 1 12 PHE HA H -6.200 2.716 -1.487 1.00 . A A . 12 PHE HA 1 1
8 1733 1 1 12 PHE HB2 H -6.872 0.163 -0.024 1.00 . A A . 12 PHE HB2 1 1
8 1734 1 1 12 PHE HB3 H -7.822 0.852 -1.317 1.00 . A A . 12 PHE HB3 1 1
8 1735 1 1 12 PHE HD1 H -7.439 0.243 -3.499 1.00 . A A . 12 PHE HD1 1 1
8 1736 1 1 12 PHE HD2 H -4.371 -0.458 -0.637 1.00 . A A . 12 PHE HD2 1 1
8 1737 1 1 12 PHE HE1 H -6.166 -1.016 -5.171 1.00 . A A . 12 PHE HE1 1 1
8 1738 1 1 12 PHE HE2 H -3.095 -1.717 -2.307 1.00 . A A . 12 PHE HE2 1 1
8 1739 1 1 12 PHE HZ H -3.994 -1.998 -4.580 1.00 . A A . 12 PHE HZ 1 1
8 1740 1 1 12 PHE N N -4.998 2.045 0.020 1.00 . A A . 12 PHE N 1 1
8 1741 1 1 12 PHE O O -7.076 2.695 1.611 1.00 . A A . 12 PHE O 1 1
8 1742 1 1 13 PRO C C -10.167 3.258 1.518 1.00 . A A . 13 PRO C 1 1
8 1743 1 1 13 PRO CA C -9.258 4.217 0.719 1.00 . A A . 13 PRO CA 1 1
8 1744 1 1 13 PRO CB C -10.105 5.015 -0.283 1.00 . A A . 13 PRO CB 1 1
8 1745 1 1 13 PRO CD C -8.533 3.746 -1.561 1.00 . A A . 13 PRO CD 1 1
8 1746 1 1 13 PRO CG C -9.342 5.000 -1.567 1.00 . A A . 13 PRO CG 1 1
8 1747 1 1 13 PRO HA H -8.774 4.897 1.405 1.00 . A A . 13 PRO HA 1 1
8 1748 1 1 13 PRO HB2 H -11.068 4.541 -0.386 1.00 . A A . 13 PRO HB2 1 1
8 1749 1 1 13 PRO HB3 H -10.238 6.023 0.082 1.00 . A A . 13 PRO HB3 1 1
8 1750 1 1 13 PRO HD2 H -9.088 2.928 -1.994 1.00 . A A . 13 PRO HD2 1 1
8 1751 1 1 13 PRO HD3 H -7.613 3.909 -2.102 1.00 . A A . 13 PRO HD3 1 1
8 1752 1 1 13 PRO HG2 H -10.029 4.996 -2.401 1.00 . A A . 13 PRO HG2 1 1
8 1753 1 1 13 PRO HG3 H -8.697 5.864 -1.622 1.00 . A A . 13 PRO HG3 1 1
8 1754 1 1 13 PRO N N -8.271 3.522 -0.121 1.00 . A A . 13 PRO N 1 1
8 1755 1 1 13 PRO O O -10.885 3.680 2.414 1.00 . A A . 13 PRO O 1 1
8 1756 1 1 14 ASP C C -10.188 0.290 2.992 1.00 . A A . 14 ASP C 1 1
8 1757 1 1 14 ASP CA C -10.960 0.992 1.890 1.00 . A A . 14 ASP CA 1 1
8 1758 1 1 14 ASP CB C -11.538 -0.044 0.915 1.00 . A A . 14 ASP CB 1 1
8 1759 1 1 14 ASP CG C -10.491 -0.891 0.230 1.00 . A A . 14 ASP CG 1 1
8 1760 1 1 14 ASP H H -9.528 1.683 0.478 1.00 . A A . 14 ASP H 1 1
8 1761 1 1 14 ASP HA H -11.778 1.531 2.344 1.00 . A A . 14 ASP HA 1 1
8 1762 1 1 14 ASP HB2 H -12.184 -0.708 1.468 1.00 . A A . 14 ASP HB2 1 1
8 1763 1 1 14 ASP HB3 H -12.121 0.465 0.163 1.00 . A A . 14 ASP HB3 1 1
8 1764 1 1 14 ASP N N -10.125 1.979 1.198 1.00 . A A . 14 ASP N 1 1
8 1765 1 1 14 ASP O O -10.673 -0.680 3.585 1.00 . A A . 14 ASP O 1 1
8 1766 1 1 14 ASP OD1 O -10.349 -2.104 0.577 1.00 . A A . 14 ASP OD1 1 1
8 1767 1 1 14 ASP OD2 O -9.815 -0.370 -0.679 1.00 . A A . 14 ASP OD2 1 1
8 1768 2 2 1 . C C -1.974 1.308 3.896 1.00 . B A . 101 WMH C 1 1
8 1769 2 2 1 . C1 C -1.229 3.087 2.429 1.00 . B A . 101 WMH C1 1 1
8 1770 2 2 1 . C2 C -0.032 3.645 2.124 1.00 . B A . 101 WMH C2 1 1
8 1771 2 2 1 . H1 H -2.319 1.720 4.829 1.00 . B A . 101 WMH H1 1 1
8 1772 2 2 1 . H2 H -2.819 1.332 3.225 1.00 . B A . 101 WMH H2 1 1
8 1773 2 2 1 . H5 H 0.134 4.447 1.419 1.00 . B A . 101 WMH H5 1 1
8 1774 2 2 1 . N N -1.018 2.144 3.325 1.00 . B A . 101 WMH N 1 1
8 1775 2 2 1 . N1 N 0.899 3.032 2.845 1.00 . B A . 101 WMH N1 1 1
8 1776 2 2 1 . N2 N 0.355 2.126 3.577 1.00 . B A . 101 WMH N2 1 1
9 1777 1 1 1 GLY C C -6.585 -0.733 3.698 1.00 . A A . 1 GLY C 1 1
9 1778 1 1 1 GLY CA C -7.720 0.081 4.263 1.00 . A A . 1 GLY CA 1 1
9 1779 1 1 1 GLY H1 H -8.357 1.234 2.631 1.00 . A A . 1 GLY H1 1 1
9 1780 1 1 1 GLY HA2 H -7.309 0.941 4.768 1.00 . A A . 1 GLY HA2 1 1
9 1781 1 1 1 GLY HA3 H -8.265 -0.523 4.973 1.00 . A A . 1 GLY HA3 1 1
9 1782 1 1 1 GLY N N -8.635 0.533 3.263 1.00 . A A . 1 GLY N 1 1
9 1783 1 1 1 GLY O O -5.681 -1.141 4.439 1.00 . A A . 1 GLY O 1 1
9 1784 1 1 2 ARG C C -4.291 -0.924 1.694 1.00 . A A . 2 ARG C 1 1
9 1785 1 1 2 ARG CA C -5.576 -1.745 1.744 1.00 . A A . 2 ARG CA 1 1
9 1786 1 1 2 ARG CB C -6.015 -2.179 0.341 1.00 . A A . 2 ARG CB 1 1
9 1787 1 1 2 ARG CD C -5.560 -3.506 -1.736 1.00 . A A . 2 ARG CD 1 1
9 1788 1 1 2 ARG CG C -4.993 -3.011 -0.418 1.00 . A A . 2 ARG CG 1 1
9 1789 1 1 2 ARG CZ C -4.775 -5.444 -3.105 1.00 . A A . 2 ARG CZ 1 1
9 1790 1 1 2 ARG H H -7.387 -0.676 1.869 1.00 . A A . 2 ARG H 1 1
9 1791 1 1 2 ARG HA H -5.390 -2.625 2.339 1.00 . A A . 2 ARG HA 1 1
9 1792 1 1 2 ARG HB2 H -6.925 -2.754 0.416 1.00 . A A . 2 ARG HB2 1 1
9 1793 1 1 2 ARG HB3 H -6.223 -1.296 -0.243 1.00 . A A . 2 ARG HB3 1 1
9 1794 1 1 2 ARG HD2 H -6.400 -4.153 -1.526 1.00 . A A . 2 ARG HD2 1 1
9 1795 1 1 2 ARG HD3 H -5.894 -2.657 -2.314 1.00 . A A . 2 ARG HD3 1 1
9 1796 1 1 2 ARG HE H -3.702 -3.798 -2.617 1.00 . A A . 2 ARG HE 1 1
9 1797 1 1 2 ARG HG2 H -4.121 -2.404 -0.616 1.00 . A A . 2 ARG HG2 1 1
9 1798 1 1 2 ARG HG3 H -4.714 -3.861 0.186 1.00 . A A . 2 ARG HG3 1 1
9 1799 1 1 2 ARG HH11 H -6.675 -5.716 -2.390 1.00 . A A . 2 ARG HH11 1 1
9 1800 1 1 2 ARG HH12 H -6.095 -6.980 -3.359 1.00 . A A . 2 ARG HH12 1 1
9 1801 1 1 2 ARG HH21 H -2.921 -5.563 -3.982 1.00 . A A . 2 ARG HH21 1 1
9 1802 1 1 2 ARG HH22 H -3.947 -6.879 -4.304 1.00 . A A . 2 ARG HH22 1 1
9 1803 1 1 2 ARG N N -6.627 -0.990 2.402 1.00 . A A . 2 ARG N 1 1
9 1804 1 1 2 ARG NE N -4.570 -4.251 -2.522 1.00 . A A . 2 ARG NE 1 1
9 1805 1 1 2 ARG NH1 N -5.922 -6.084 -2.943 1.00 . A A . 2 ARG NH1 1 1
9 1806 1 1 2 ARG NH2 N -3.815 -5.997 -3.841 1.00 . A A . 2 ARG NH2 1 1
9 1807 1 1 2 ARG O O -4.280 0.184 1.186 1.00 . A A . 2 ARG O 1 1
9 1808 1 1 3 ALA C C -0.875 -1.850 2.074 1.00 . A A . 3 ALA C 1 1
9 1809 1 1 3 ALA CA C -1.946 -0.842 2.337 1.00 . A A . 3 ALA CA 1 1
9 1810 1 1 3 ALA CB C -1.737 -0.156 3.698 1.00 . A A . 3 ALA CB 1 1
9 1811 1 1 3 ALA H H -3.327 -2.357 2.670 1.00 . A A . 3 ALA H 1 1
9 1812 1 1 3 ALA HA H -1.900 -0.088 1.563 1.00 . A A . 3 ALA HA 1 1
9 1813 1 1 3 ALA HB1 H -0.691 -0.217 3.959 1.00 . A A . 3 ALA HB1 1 1
9 1814 1 1 3 ALA HB2 H -2.314 -0.681 4.444 1.00 . A A . 3 ALA HB2 1 1
9 1815 1 1 3 ALA N N -3.252 -1.465 2.266 1.00 . A A . 3 ALA N 1 1
9 1816 1 1 3 ALA O O -0.965 -2.991 2.540 1.00 . A A . 3 ALA O 1 1
9 1817 1 1 4 THR C C 2.183 -2.406 2.125 1.00 . A A . 4 THR C 1 1
9 1818 1 1 4 THR CA C 1.196 -2.328 0.968 1.00 . A A . 4 THR CA 1 1
9 1819 1 1 4 THR CB C 1.914 -1.819 -0.298 1.00 . A A . 4 THR CB 1 1
9 1820 1 1 4 THR CG2 C 1.028 -1.976 -1.511 1.00 . A A . 4 THR CG2 1 1
9 1821 1 1 4 THR H H 0.099 -0.567 0.904 1.00 . A A . 4 THR H 1 1
9 1822 1 1 4 THR HA H 0.807 -3.315 0.765 1.00 . A A . 4 THR HA 1 1
9 1823 1 1 4 THR HB H 2.815 -2.397 -0.441 1.00 . A A . 4 THR HB 1 1
9 1824 1 1 4 THR HG1 H 3.231 -0.427 0.002 1.00 . A A . 4 THR HG1 1 1
9 1825 1 1 4 THR HG21 H 0.111 -1.428 -1.356 1.00 . A A . 4 THR HG21 1 1
9 1826 1 1 4 THR HG22 H 0.804 -3.021 -1.659 1.00 . A A . 4 THR HG22 1 1
9 1827 1 1 4 THR HG23 H 1.536 -1.589 -2.380 1.00 . A A . 4 THR HG23 1 1
9 1828 1 1 4 THR N N 0.096 -1.467 1.295 1.00 . A A . 4 THR N 1 1
9 1829 1 1 4 THR O O 2.371 -1.427 2.869 1.00 . A A . 4 THR O 1 1
9 1830 1 1 4 THR OG1 O 2.272 -0.432 -0.141 1.00 . A A . 4 THR OG1 1 1
9 1831 1 1 5 LYS C C 5.121 -3.233 2.803 1.00 . A A . 5 LYS C 1 1
9 1832 1 1 5 LYS CA C 3.786 -3.724 3.332 1.00 . A A . 5 LYS CA 1 1
9 1833 1 1 5 LYS CB C 3.896 -5.197 3.787 1.00 . A A . 5 LYS CB 1 1
9 1834 1 1 5 LYS CD C 4.440 -7.587 3.194 1.00 . A A . 5 LYS CD 1 1
9 1835 1 1 5 LYS CE C 4.948 -8.499 2.095 1.00 . A A . 5 LYS CE 1 1
9 1836 1 1 5 LYS CG C 4.336 -6.161 2.693 1.00 . A A . 5 LYS CG 1 1
9 1837 1 1 5 LYS H H 2.547 -4.320 1.731 1.00 . A A . 5 LYS H 1 1
9 1838 1 1 5 LYS HA H 3.496 -3.109 4.170 1.00 . A A . 5 LYS HA 1 1
9 1839 1 1 5 LYS HB2 H 4.616 -5.257 4.591 1.00 . A A . 5 LYS HB2 1 1
9 1840 1 1 5 LYS HB3 H 2.936 -5.524 4.160 1.00 . A A . 5 LYS HB3 1 1
9 1841 1 1 5 LYS HD2 H 5.121 -7.625 4.030 1.00 . A A . 5 LYS HD2 1 1
9 1842 1 1 5 LYS HD3 H 3.465 -7.924 3.508 1.00 . A A . 5 LYS HD3 1 1
9 1843 1 1 5 LYS HE2 H 4.260 -8.463 1.263 1.00 . A A . 5 LYS HE2 1 1
9 1844 1 1 5 LYS HE3 H 5.915 -8.141 1.774 1.00 . A A . 5 LYS HE3 1 1
9 1845 1 1 5 LYS HG2 H 3.614 -6.130 1.891 1.00 . A A . 5 LYS HG2 1 1
9 1846 1 1 5 LYS HG3 H 5.299 -5.845 2.320 1.00 . A A . 5 LYS HG3 1 1
9 1847 1 1 5 LYS HZ1 H 5.426 -10.485 1.753 1.00 . A A . 5 LYS HZ1 1 1
9 1848 1 1 5 LYS HZ2 H 4.160 -10.278 2.837 1.00 . A A . 5 LYS HZ2 1 1
9 1849 1 1 5 LYS HZ3 H 5.740 -9.991 3.332 1.00 . A A . 5 LYS HZ3 1 1
9 1850 1 1 5 LYS N N 2.788 -3.559 2.302 1.00 . A A . 5 LYS N 1 1
9 1851 1 1 5 LYS NZ N 5.078 -9.898 2.537 1.00 . A A . 5 LYS NZ 1 1
9 1852 1 1 5 LYS O O 5.992 -2.804 3.559 1.00 . A A . 5 LYS O 1 1
9 1853 1 1 6 SER C C 6.281 -1.559 0.127 1.00 . A A . 6 SER C 1 1
9 1854 1 1 6 SER CA C 6.449 -2.900 0.839 1.00 . A A . 6 SER CA 1 1
9 1855 1 1 6 SER CB C 6.820 -4.014 -0.141 1.00 . A A . 6 SER CB 1 1
9 1856 1 1 6 SER H H 4.498 -3.558 0.949 1.00 . A A . 6 SER H 1 1
9 1857 1 1 6 SER HA H 7.228 -2.825 1.581 1.00 . A A . 6 SER HA 1 1
9 1858 1 1 6 SER HB2 H 7.617 -3.678 -0.789 1.00 . A A . 6 SER HB2 1 1
9 1859 1 1 6 SER HB3 H 7.148 -4.882 0.411 1.00 . A A . 6 SER HB3 1 1
9 1860 1 1 6 SER HG H 5.831 -4.019 -1.820 1.00 . A A . 6 SER HG 1 1
9 1861 1 1 6 SER N N 5.250 -3.273 1.505 1.00 . A A . 6 SER N 1 1
9 1862 1 1 6 SER O O 5.151 -1.062 -0.031 1.00 . A A . 6 SER O 1 1
9 1863 1 1 6 SER OG O 5.695 -4.381 -0.935 1.00 . A A . 6 SER OG 1 1
9 1864 1 1 7 ILE C C 7.358 -0.005 -2.514 1.00 . A A . 7 ILE C 1 1
9 1865 1 1 7 ILE CA C 7.385 0.274 -1.005 1.00 . A A . 7 ILE CA 1 1
9 1866 1 1 7 ILE CB C 8.610 1.160 -0.638 1.00 . A A . 7 ILE CB 1 1
9 1867 1 1 7 ILE CD1 C 11.182 1.261 -0.653 1.00 . A A . 7 ILE CD1 1 1
9 1868 1 1 7 ILE CG1 C 9.938 0.439 -0.948 1.00 . A A . 7 ILE CG1 1 1
9 1869 1 1 7 ILE CG2 C 8.539 1.557 0.825 1.00 . A A . 7 ILE CG2 1 1
9 1870 1 1 7 ILE H H 8.250 -1.409 -0.089 1.00 . A A . 7 ILE H 1 1
9 1871 1 1 7 ILE HA H 6.476 0.796 -0.739 1.00 . A A . 7 ILE HA 1 1
9 1872 1 1 7 ILE HB H 8.556 2.065 -1.224 1.00 . A A . 7 ILE HB 1 1
9 1873 1 1 7 ILE HD11 H 11.163 2.168 -1.239 1.00 . A A . 7 ILE HD11 1 1
9 1874 1 1 7 ILE HD12 H 12.061 0.686 -0.902 1.00 . A A . 7 ILE HD12 1 1
9 1875 1 1 7 ILE HD13 H 11.201 1.512 0.397 1.00 . A A . 7 ILE HD13 1 1
9 1876 1 1 7 ILE HG12 H 9.996 -0.464 -0.359 1.00 . A A . 7 ILE HG12 1 1
9 1877 1 1 7 ILE HG13 H 9.955 0.176 -1.995 1.00 . A A . 7 ILE HG13 1 1
9 1878 1 1 7 ILE HG21 H 9.394 2.169 1.068 1.00 . A A . 7 ILE HG21 1 1
9 1879 1 1 7 ILE HG22 H 8.549 0.666 1.436 1.00 . A A . 7 ILE HG22 1 1
9 1880 1 1 7 ILE HG23 H 7.632 2.113 1.011 1.00 . A A . 7 ILE HG23 1 1
9 1881 1 1 7 ILE N N 7.389 -0.978 -0.280 1.00 . A A . 7 ILE N 1 1
9 1882 1 1 7 ILE O O 7.812 -1.074 -2.947 1.00 . A A . 7 ILE O 1 1
9 1883 1 1 8 PRO C C 4.915 1.958 -2.106 1.00 . A A . 8 PRO C 1 1
9 1884 1 1 8 PRO CA C 6.221 2.179 -2.883 1.00 . A A . 8 PRO CA 1 1
9 1885 1 1 8 PRO CB C 5.935 2.923 -4.192 1.00 . A A . 8 PRO CB 1 1
9 1886 1 1 8 PRO CD C 6.704 0.753 -4.798 1.00 . A A . 8 PRO CD 1 1
9 1887 1 1 8 PRO CG C 5.765 1.851 -5.201 1.00 . A A . 8 PRO CG 1 1
9 1888 1 1 8 PRO HA H 6.927 2.737 -2.289 1.00 . A A . 8 PRO HA 1 1
9 1889 1 1 8 PRO HB2 H 5.041 3.517 -4.082 1.00 . A A . 8 PRO HB2 1 1
9 1890 1 1 8 PRO HB3 H 6.769 3.566 -4.437 1.00 . A A . 8 PRO HB3 1 1
9 1891 1 1 8 PRO HD2 H 6.294 -0.213 -5.058 1.00 . A A . 8 PRO HD2 1 1
9 1892 1 1 8 PRO HD3 H 7.669 0.893 -5.264 1.00 . A A . 8 PRO HD3 1 1
9 1893 1 1 8 PRO HG2 H 4.743 1.500 -5.183 1.00 . A A . 8 PRO HG2 1 1
9 1894 1 1 8 PRO HG3 H 6.017 2.222 -6.183 1.00 . A A . 8 PRO HG3 1 1
9 1895 1 1 8 PRO N N 6.807 0.905 -3.337 1.00 . A A . 8 PRO N 1 1
9 1896 1 1 8 PRO O O 4.153 1.032 -2.418 1.00 . A A . 8 PRO O 1 1
9 1897 1 1 9 PRO C C 2.213 2.973 -1.085 1.00 . A A . 9 PRO C 1 1
9 1898 1 1 9 PRO CA C 3.457 2.658 -0.264 1.00 . A A . 9 PRO CA 1 1
9 1899 1 1 9 PRO CB C 3.638 3.713 0.830 1.00 . A A . 9 PRO CB 1 1
9 1900 1 1 9 PRO CD C 5.549 3.835 -0.573 1.00 . A A . 9 PRO CD 1 1
9 1901 1 1 9 PRO CG C 5.086 4.032 0.832 1.00 . A A . 9 PRO CG 1 1
9 1902 1 1 9 PRO HA H 3.356 1.679 0.180 1.00 . A A . 9 PRO HA 1 1
9 1903 1 1 9 PRO HB2 H 3.039 4.582 0.595 1.00 . A A . 9 PRO HB2 1 1
9 1904 1 1 9 PRO HB3 H 3.324 3.297 1.776 1.00 . A A . 9 PRO HB3 1 1
9 1905 1 1 9 PRO HD2 H 5.428 4.741 -1.149 1.00 . A A . 9 PRO HD2 1 1
9 1906 1 1 9 PRO HD3 H 6.581 3.517 -0.565 1.00 . A A . 9 PRO HD3 1 1
9 1907 1 1 9 PRO HG2 H 5.239 5.056 1.142 1.00 . A A . 9 PRO HG2 1 1
9 1908 1 1 9 PRO HG3 H 5.610 3.358 1.498 1.00 . A A . 9 PRO HG3 1 1
9 1909 1 1 9 PRO N N 4.668 2.763 -1.064 1.00 . A A . 9 PRO N 1 1
9 1910 1 1 9 PRO O O 2.033 4.097 -1.590 1.00 . A A . 9 PRO O 1 1
9 1911 1 1 10 ARG C C -0.972 1.900 -1.051 1.00 . A A . 10 ARG C 1 1
9 1912 1 1 10 ARG CA C 0.175 2.179 -1.987 1.00 . A A . 10 ARG CA 1 1
9 1913 1 1 10 ARG CB C 0.109 1.276 -3.231 1.00 . A A . 10 ARG CB 1 1
9 1914 1 1 10 ARG CD C -1.130 2.961 -4.614 1.00 . A A . 10 ARG CD 1 1
9 1915 1 1 10 ARG CG C -1.116 1.528 -4.098 1.00 . A A . 10 ARG CG 1 1
9 1916 1 1 10 ARG CZ C -3.125 4.361 -5.053 1.00 . A A . 10 ARG CZ 1 1
9 1917 1 1 10 ARG H H 1.614 1.104 -0.906 1.00 . A A . 10 ARG H 1 1
9 1918 1 1 10 ARG HA H 0.154 3.211 -2.291 1.00 . A A . 10 ARG HA 1 1
9 1919 1 1 10 ARG HB2 H 0.992 1.436 -3.831 1.00 . A A . 10 ARG HB2 1 1
9 1920 1 1 10 ARG HB3 H 0.090 0.245 -2.910 1.00 . A A . 10 ARG HB3 1 1
9 1921 1 1 10 ARG HD2 H -1.028 3.637 -3.780 1.00 . A A . 10 ARG HD2 1 1
9 1922 1 1 10 ARG HD3 H -0.294 3.096 -5.284 1.00 . A A . 10 ARG HD3 1 1
9 1923 1 1 10 ARG HE H -2.602 2.684 -6.061 1.00 . A A . 10 ARG HE 1 1
9 1924 1 1 10 ARG HG2 H -1.106 0.848 -4.935 1.00 . A A . 10 ARG HG2 1 1
9 1925 1 1 10 ARG HG3 H -2.003 1.359 -3.505 1.00 . A A . 10 ARG HG3 1 1
9 1926 1 1 10 ARG HH11 H -2.040 5.015 -3.428 1.00 . A A . 10 ARG HH11 1 1
9 1927 1 1 10 ARG HH12 H -3.399 5.954 -3.809 1.00 . A A . 10 ARG HH12 1 1
9 1928 1 1 10 ARG HH21 H -4.431 4.029 -6.568 1.00 . A A . 10 ARG HH21 1 1
9 1929 1 1 10 ARG HH22 H -4.789 5.407 -5.636 1.00 . A A . 10 ARG HH22 1 1
9 1930 1 1 10 ARG N N 1.393 1.993 -1.272 1.00 . A A . 10 ARG N 1 1
9 1931 1 1 10 ARG NE N -2.363 3.294 -5.325 1.00 . A A . 10 ARG NE 1 1
9 1932 1 1 10 ARG NH1 N -2.828 5.161 -4.032 1.00 . A A . 10 ARG NH1 1 1
9 1933 1 1 10 ARG NH2 N -4.187 4.620 -5.794 1.00 . A A . 10 ARG NH2 1 1
9 1934 1 1 10 ARG O O -1.141 0.764 -0.588 1.00 . A A . 10 ARG O 1 1
9 1935 1 1 11 ALA C C -4.122 3.158 -0.433 1.00 . A A . 11 ALA C 1 1
9 1936 1 1 11 ALA CA C -2.813 2.741 0.188 1.00 . A A . 11 ALA CA 1 1
9 1937 1 1 11 ALA CB C -2.598 3.420 1.557 1.00 . A A . 11 ALA CB 1 1
9 1938 1 1 11 ALA H H -1.543 3.821 -1.074 1.00 . A A . 11 ALA H 1 1
9 1939 1 1 11 ALA HA H -2.876 1.674 0.351 1.00 . A A . 11 ALA HA 1 1
9 1940 1 1 11 ALA HB1 H -3.403 3.112 2.203 1.00 . A A . 11 ALA HB1 1 1
9 1941 1 1 11 ALA HB2 H -2.626 4.493 1.496 1.00 . A A . 11 ALA HB2 1 1
9 1942 1 1 11 ALA N N -1.721 2.924 -0.714 1.00 . A A . 11 ALA N 1 1
9 1943 1 1 11 ALA O O -4.191 4.107 -1.232 1.00 . A A . 11 ALA O 1 1
9 1944 1 1 12 PHE C C -7.404 2.930 0.565 1.00 . A A . 12 PHE C 1 1
9 1945 1 1 12 PHE CA C -6.467 2.619 -0.589 1.00 . A A . 12 PHE CA 1 1
9 1946 1 1 12 PHE CB C -6.935 1.364 -1.334 1.00 . A A . 12 PHE CB 1 1
9 1947 1 1 12 PHE CD1 C -5.037 0.197 -2.489 1.00 . A A . 12 PHE CD1 1 1
9 1948 1 1 12 PHE CD2 C -6.475 1.592 -3.780 1.00 . A A . 12 PHE CD2 1 1
9 1949 1 1 12 PHE CE1 C -4.302 -0.098 -3.613 1.00 . A A . 12 PHE CE1 1 1
9 1950 1 1 12 PHE CE2 C -5.743 1.303 -4.907 1.00 . A A . 12 PHE CE2 1 1
9 1951 1 1 12 PHE CG C -6.133 1.043 -2.557 1.00 . A A . 12 PHE CG 1 1
9 1952 1 1 12 PHE CZ C -4.656 0.457 -4.822 1.00 . A A . 12 PHE CZ 1 1
9 1953 1 1 12 PHE H H -4.972 1.710 0.566 1.00 . A A . 12 PHE H 1 1
9 1954 1 1 12 PHE HA H -6.456 3.453 -1.275 1.00 . A A . 12 PHE HA 1 1
9 1955 1 1 12 PHE HB2 H -6.875 0.522 -0.662 1.00 . A A . 12 PHE HB2 1 1
9 1956 1 1 12 PHE HB3 H -7.964 1.496 -1.628 1.00 . A A . 12 PHE HB3 1 1
9 1957 1 1 12 PHE HD1 H -4.761 -0.235 -1.538 1.00 . A A . 12 PHE HD1 1 1
9 1958 1 1 12 PHE HD2 H -7.326 2.254 -3.847 1.00 . A A . 12 PHE HD2 1 1
9 1959 1 1 12 PHE HE1 H -3.450 -0.757 -3.548 1.00 . A A . 12 PHE HE1 1 1
9 1960 1 1 12 PHE HE2 H -6.020 1.737 -5.857 1.00 . A A . 12 PHE HE2 1 1
9 1961 1 1 12 PHE HZ H -4.083 0.227 -5.707 1.00 . A A . 12 PHE HZ 1 1
9 1962 1 1 12 PHE N N -5.136 2.431 -0.087 1.00 . A A . 12 PHE N 1 1
9 1963 1 1 12 PHE O O -7.156 2.496 1.702 1.00 . A A . 12 PHE O 1 1
9 1964 1 1 13 PRO C C -10.207 2.968 2.026 1.00 . A A . 13 PRO C 1 1
9 1965 1 1 13 PRO CA C -9.452 4.111 1.346 1.00 . A A . 13 PRO CA 1 1
9 1966 1 1 13 PRO CB C -10.436 4.999 0.583 1.00 . A A . 13 PRO CB 1 1
9 1967 1 1 13 PRO CD C -8.916 4.148 -1.032 1.00 . A A . 13 PRO CD 1 1
9 1968 1 1 13 PRO CG C -10.348 4.532 -0.824 1.00 . A A . 13 PRO CG 1 1
9 1969 1 1 13 PRO HA H -8.956 4.703 2.100 1.00 . A A . 13 PRO HA 1 1
9 1970 1 1 13 PRO HB2 H -11.429 4.859 0.986 1.00 . A A . 13 PRO HB2 1 1
9 1971 1 1 13 PRO HB3 H -10.144 6.034 0.678 1.00 . A A . 13 PRO HB3 1 1
9 1972 1 1 13 PRO HD2 H -8.840 3.360 -1.767 1.00 . A A . 13 PRO HD2 1 1
9 1973 1 1 13 PRO HD3 H -8.326 5.001 -1.332 1.00 . A A . 13 PRO HD3 1 1
9 1974 1 1 13 PRO HG2 H -10.992 3.678 -0.968 1.00 . A A . 13 PRO HG2 1 1
9 1975 1 1 13 PRO HG3 H -10.623 5.330 -1.498 1.00 . A A . 13 PRO HG3 1 1
9 1976 1 1 13 PRO N N -8.501 3.671 0.306 1.00 . A A . 13 PRO N 1 1
9 1977 1 1 13 PRO O O -10.901 3.185 3.008 1.00 . A A . 13 PRO O 1 1
9 1978 1 1 14 ASP C C -9.856 0.042 3.205 1.00 . A A . 14 ASP C 1 1
9 1979 1 1 14 ASP CA C -10.751 0.617 2.119 1.00 . A A . 14 ASP CA 1 1
9 1980 1 1 14 ASP CB C -11.072 -0.481 1.103 1.00 . A A . 14 ASP CB 1 1
9 1981 1 1 14 ASP CG C -9.855 -1.245 0.657 1.00 . A A . 14 ASP CG 1 1
9 1982 1 1 14 ASP H H -9.548 1.644 0.693 1.00 . A A . 14 ASP H 1 1
9 1983 1 1 14 ASP HA H -11.666 0.971 2.568 1.00 . A A . 14 ASP HA 1 1
9 1984 1 1 14 ASP HB2 H -11.762 -1.181 1.550 1.00 . A A . 14 ASP HB2 1 1
9 1985 1 1 14 ASP HB3 H -11.533 -0.029 0.237 1.00 . A A . 14 ASP HB3 1 1
9 1986 1 1 14 ASP N N -10.087 1.763 1.503 1.00 . A A . 14 ASP N 1 1
9 1987 1 1 14 ASP O O -10.259 -0.842 3.967 1.00 . A A . 14 ASP O 1 1
9 1988 1 1 14 ASP OD1 O -9.631 -2.356 1.146 1.00 . A A . 14 ASP OD1 1 1
9 1989 1 1 14 ASP OD2 O -9.104 -0.736 -0.183 1.00 . A A . 14 ASP OD2 1 1
9 1990 2 2 1 . C C -2.152 1.306 3.718 1.00 . B A . 101 WMH C 1 1
9 1991 2 2 1 . C1 C -1.308 3.055 2.245 1.00 . B A . 101 WMH C1 1 1
9 1992 2 2 1 . C2 C -0.078 3.574 1.983 1.00 . B A . 101 WMH C2 1 1
9 1993 2 2 1 . H1 H -2.425 1.677 4.692 1.00 . B A . 101 WMH H1 1 1
9 1994 2 2 1 . H2 H -3.020 1.394 3.082 1.00 . B A . 101 WMH H2 1 1
9 1995 2 2 1 . H5 H 0.140 4.351 1.265 1.00 . B A . 101 WMH H5 1 1
9 1996 2 2 1 . N N -1.161 2.128 3.178 1.00 . B A . 101 WMH N 1 1
9 1997 2 2 1 . N1 N 0.807 2.958 2.764 1.00 . B A . 101 WMH N1 1 1
9 1998 2 2 1 . N2 N 0.205 2.086 3.499 1.00 . B A . 101 WMH N2 1 1
10 1999 1 1 1 GLY C C -6.669 -0.565 3.815 1.00 . A A . 1 GLY C 1 1
10 2000 1 1 1 GLY CA C -7.936 0.079 4.313 1.00 . A A . 1 GLY CA 1 1
10 2001 1 1 1 GLY H1 H -8.388 0.994 2.476 1.00 . A A . 1 GLY H1 1 1
10 2002 1 1 1 GLY HA2 H -7.682 0.926 4.928 1.00 . A A . 1 GLY HA2 1 1
10 2003 1 1 1 GLY HA3 H -8.477 -0.636 4.914 1.00 . A A . 1 GLY HA3 1 1
10 2004 1 1 1 GLY N N -8.782 0.522 3.244 1.00 . A A . 1 GLY N 1 1
10 2005 1 1 1 GLY O O -5.699 -0.677 4.559 1.00 . A A . 1 GLY O 1 1
10 2006 1 1 2 ARG C C -4.301 -0.733 1.921 1.00 . A A . 2 ARG C 1 1
10 2007 1 1 2 ARG CA C -5.507 -1.647 1.979 1.00 . A A . 2 ARG CA 1 1
10 2008 1 1 2 ARG CB C -5.799 -2.195 0.587 1.00 . A A . 2 ARG CB 1 1
10 2009 1 1 2 ARG CD C -6.208 -4.552 1.289 1.00 . A A . 2 ARG CD 1 1
10 2010 1 1 2 ARG CG C -6.760 -3.352 0.558 1.00 . A A . 2 ARG CG 1 1
10 2011 1 1 2 ARG CZ C -6.912 -6.869 1.782 1.00 . A A . 2 ARG CZ 1 1
10 2012 1 1 2 ARG H H -7.495 -0.910 2.034 1.00 . A A . 2 ARG H 1 1
10 2013 1 1 2 ARG HA H -5.257 -2.479 2.619 1.00 . A A . 2 ARG HA 1 1
10 2014 1 1 2 ARG HB2 H -6.215 -1.404 -0.017 1.00 . A A . 2 ARG HB2 1 1
10 2015 1 1 2 ARG HB3 H -4.867 -2.517 0.144 1.00 . A A . 2 ARG HB3 1 1
10 2016 1 1 2 ARG HD2 H -5.264 -4.834 0.846 1.00 . A A . 2 ARG HD2 1 1
10 2017 1 1 2 ARG HD3 H -6.055 -4.300 2.328 1.00 . A A . 2 ARG HD3 1 1
10 2018 1 1 2 ARG HE H -7.940 -5.503 0.702 1.00 . A A . 2 ARG HE 1 1
10 2019 1 1 2 ARG HG2 H -7.678 -3.045 1.038 1.00 . A A . 2 ARG HG2 1 1
10 2020 1 1 2 ARG HG3 H -6.965 -3.623 -0.466 1.00 . A A . 2 ARG HG3 1 1
10 2021 1 1 2 ARG HH11 H -5.083 -6.411 2.610 1.00 . A A . 2 ARG HH11 1 1
10 2022 1 1 2 ARG HH12 H -5.657 -7.985 2.938 1.00 . A A . 2 ARG HH12 1 1
10 2023 1 1 2 ARG HH21 H -8.656 -7.709 1.118 1.00 . A A . 2 ARG HH21 1 1
10 2024 1 1 2 ARG HH22 H -7.679 -8.729 2.068 1.00 . A A . 2 ARG HH22 1 1
10 2025 1 1 2 ARG N N -6.675 -1.003 2.567 1.00 . A A . 2 ARG N 1 1
10 2026 1 1 2 ARG NE N -7.119 -5.683 1.217 1.00 . A A . 2 ARG NE 1 1
10 2027 1 1 2 ARG NH1 N -5.801 -7.098 2.485 1.00 . A A . 2 ARG NH1 1 1
10 2028 1 1 2 ARG NH2 N -7.808 -7.829 1.642 1.00 . A A . 2 ARG NH2 1 1
10 2029 1 1 2 ARG O O -4.392 0.403 1.495 1.00 . A A . 2 ARG O 1 1
10 2030 1 1 3 ALA C C -0.891 -1.696 2.155 1.00 . A A . 3 ALA C 1 1
10 2031 1 1 3 ALA CA C -1.914 -0.608 2.354 1.00 . A A . 3 ALA CA 1 1
10 2032 1 1 3 ALA CB C -1.650 0.173 3.666 1.00 . A A . 3 ALA CB 1 1
10 2033 1 1 3 ALA H H -3.244 -2.125 2.823 1.00 . A A . 3 ALA H 1 1
10 2034 1 1 3 ALA HA H -1.885 0.068 1.511 1.00 . A A . 3 ALA HA 1 1
10 2035 1 1 3 ALA HB1 H -0.589 0.168 3.865 1.00 . A A . 3 ALA HB1 1 1
10 2036 1 1 3 ALA HB2 H -2.158 -0.329 4.476 1.00 . A A . 3 ALA HB2 1 1
10 2037 1 1 3 ALA N N -3.206 -1.243 2.392 1.00 . A A . 3 ALA N 1 1
10 2038 1 1 3 ALA O O -0.986 -2.754 2.794 1.00 . A A . 3 ALA O 1 1
10 2039 1 1 4 THR C C 2.257 -2.222 1.902 1.00 . A A . 4 THR C 1 1
10 2040 1 1 4 THR CA C 1.050 -2.478 1.013 1.00 . A A . 4 THR CA 1 1
10 2041 1 1 4 THR CB C 1.456 -2.511 -0.482 1.00 . A A . 4 THR CB 1 1
10 2042 1 1 4 THR CG2 C 0.327 -3.066 -1.340 1.00 . A A . 4 THR CG2 1 1
10 2043 1 1 4 THR H H 0.046 -0.670 0.727 1.00 . A A . 4 THR H 1 1
10 2044 1 1 4 THR HA H 0.633 -3.439 1.279 1.00 . A A . 4 THR HA 1 1
10 2045 1 1 4 THR HB H 2.323 -3.147 -0.590 1.00 . A A . 4 THR HB 1 1
10 2046 1 1 4 THR HG1 H 2.547 -1.311 -1.525 1.00 . A A . 4 THR HG1 1 1
10 2047 1 1 4 THR HG21 H 0.634 -3.073 -2.376 1.00 . A A . 4 THR HG21 1 1
10 2048 1 1 4 THR HG22 H -0.548 -2.442 -1.228 1.00 . A A . 4 THR HG22 1 1
10 2049 1 1 4 THR HG23 H 0.094 -4.072 -1.025 1.00 . A A . 4 THR HG23 1 1
10 2050 1 1 4 THR N N 0.031 -1.495 1.261 1.00 . A A . 4 THR N 1 1
10 2051 1 1 4 THR O O 2.538 -1.072 2.266 1.00 . A A . 4 THR O 1 1
10 2052 1 1 4 THR OG1 O 1.791 -1.192 -0.935 1.00 . A A . 4 THR OG1 1 1
10 2053 1 1 5 LYS C C 5.346 -2.852 2.368 1.00 . A A . 5 LYS C 1 1
10 2054 1 1 5 LYS CA C 4.079 -3.138 3.160 1.00 . A A . 5 LYS CA 1 1
10 2055 1 1 5 LYS CB C 4.241 -4.352 4.098 1.00 . A A . 5 LYS CB 1 1
10 2056 1 1 5 LYS CD C 4.625 -6.835 4.416 1.00 . A A . 5 LYS CD 1 1
10 2057 1 1 5 LYS CE C 5.753 -6.660 5.441 1.00 . A A . 5 LYS CE 1 1
10 2058 1 1 5 LYS CG C 4.543 -5.680 3.411 1.00 . A A . 5 LYS CG 1 1
10 2059 1 1 5 LYS H H 2.664 -4.165 1.976 1.00 . A A . 5 LYS H 1 1
10 2060 1 1 5 LYS HA H 3.886 -2.263 3.761 1.00 . A A . 5 LYS HA 1 1
10 2061 1 1 5 LYS HB2 H 5.046 -4.140 4.783 1.00 . A A . 5 LYS HB2 1 1
10 2062 1 1 5 LYS HB3 H 3.329 -4.463 4.667 1.00 . A A . 5 LYS HB3 1 1
10 2063 1 1 5 LYS HD2 H 3.687 -6.894 4.947 1.00 . A A . 5 LYS HD2 1 1
10 2064 1 1 5 LYS HD3 H 4.777 -7.756 3.874 1.00 . A A . 5 LYS HD3 1 1
10 2065 1 1 5 LYS HE2 H 5.586 -5.752 5.998 1.00 . A A . 5 LYS HE2 1 1
10 2066 1 1 5 LYS HE3 H 5.718 -7.495 6.124 1.00 . A A . 5 LYS HE3 1 1
10 2067 1 1 5 LYS HG2 H 3.759 -5.893 2.702 1.00 . A A . 5 LYS HG2 1 1
10 2068 1 1 5 LYS HG3 H 5.487 -5.594 2.895 1.00 . A A . 5 LYS HG3 1 1
10 2069 1 1 5 LYS HZ1 H 7.179 -5.826 4.137 1.00 . A A . 5 LYS HZ1 1 1
10 2070 1 1 5 LYS HZ2 H 7.341 -7.494 4.332 1.00 . A A . 5 LYS HZ2 1 1
10 2071 1 1 5 LYS HZ3 H 7.827 -6.454 5.545 1.00 . A A . 5 LYS HZ3 1 1
10 2072 1 1 5 LYS N N 2.941 -3.276 2.288 1.00 . A A . 5 LYS N 1 1
10 2073 1 1 5 LYS NZ N 7.099 -6.606 4.818 1.00 . A A . 5 LYS NZ 1 1
10 2074 1 1 5 LYS O O 6.273 -2.234 2.881 1.00 . A A . 5 LYS O 1 1
10 2075 1 1 6 SER C C 6.449 -1.599 -0.278 1.00 . A A . 6 SER C 1 1
10 2076 1 1 6 SER CA C 6.481 -3.034 0.255 1.00 . A A . 6 SER CA 1 1
10 2077 1 1 6 SER CB C 6.419 -4.059 -0.873 1.00 . A A . 6 SER CB 1 1
10 2078 1 1 6 SER H H 4.598 -3.734 0.732 1.00 . A A . 6 SER H 1 1
10 2079 1 1 6 SER HA H 7.388 -3.189 0.818 1.00 . A A . 6 SER HA 1 1
10 2080 1 1 6 SER HB2 H 6.973 -3.687 -1.722 1.00 . A A . 6 SER HB2 1 1
10 2081 1 1 6 SER HB3 H 6.844 -4.994 -0.545 1.00 . A A . 6 SER HB3 1 1
10 2082 1 1 6 SER HG H 4.989 -4.101 -2.218 1.00 . A A . 6 SER HG 1 1
10 2083 1 1 6 SER N N 5.362 -3.264 1.125 1.00 . A A . 6 SER N 1 1
10 2084 1 1 6 SER O O 5.373 -1.056 -0.530 1.00 . A A . 6 SER O 1 1
10 2085 1 1 6 SER OG O 5.057 -4.280 -1.271 1.00 . A A . 6 SER OG 1 1
10 2086 1 1 7 ILE C C 7.652 0.412 -2.462 1.00 . A A . 7 ILE C 1 1
10 2087 1 1 7 ILE CA C 7.684 0.377 -0.928 1.00 . A A . 7 ILE CA 1 1
10 2088 1 1 7 ILE CB C 8.944 1.127 -0.401 1.00 . A A . 7 ILE CB 1 1
10 2089 1 1 7 ILE CD1 C 11.514 1.051 -0.293 1.00 . A A . 7 ILE CD1 1 1
10 2090 1 1 7 ILE CG1 C 10.241 0.377 -0.772 1.00 . A A . 7 ILE CG1 1 1
10 2091 1 1 7 ILE CG2 C 8.846 1.335 1.103 1.00 . A A . 7 ILE CG2 1 1
10 2092 1 1 7 ILE H H 8.434 -1.482 -0.242 1.00 . A A . 7 ILE H 1 1
10 2093 1 1 7 ILE HA H 6.802 0.883 -0.566 1.00 . A A . 7 ILE HA 1 1
10 2094 1 1 7 ILE HB H 8.958 2.101 -0.865 1.00 . A A . 7 ILE HB 1 1
10 2095 1 1 7 ILE HD11 H 11.497 1.118 0.784 1.00 . A A . 7 ILE HD11 1 1
10 2096 1 1 7 ILE HD12 H 11.576 2.044 -0.713 1.00 . A A . 7 ILE HD12 1 1
10 2097 1 1 7 ILE HD13 H 12.370 0.472 -0.607 1.00 . A A . 7 ILE HD13 1 1
10 2098 1 1 7 ILE HG12 H 10.214 -0.612 -0.338 1.00 . A A . 7 ILE HG12 1 1
10 2099 1 1 7 ILE HG13 H 10.294 0.284 -1.847 1.00 . A A . 7 ILE HG13 1 1
10 2100 1 1 7 ILE HG21 H 7.974 1.927 1.337 1.00 . A A . 7 ILE HG21 1 1
10 2101 1 1 7 ILE HG22 H 9.732 1.843 1.452 1.00 . A A . 7 ILE HG22 1 1
10 2102 1 1 7 ILE HG23 H 8.769 0.374 1.588 1.00 . A A . 7 ILE HG23 1 1
10 2103 1 1 7 ILE N N 7.607 -0.992 -0.439 1.00 . A A . 7 ILE N 1 1
10 2104 1 1 7 ILE O O 8.200 -0.475 -3.108 1.00 . A A . 7 ILE O 1 1
10 2105 1 1 8 PRO C C 4.881 1.878 -1.854 1.00 . A A . 8 PRO C 1 1
10 2106 1 1 8 PRO CA C 6.212 2.434 -2.368 1.00 . A A . 8 PRO CA 1 1
10 2107 1 1 8 PRO CB C 5.940 3.489 -3.464 1.00 . A A . 8 PRO CB 1 1
10 2108 1 1 8 PRO CD C 6.900 1.581 -4.511 1.00 . A A . 8 PRO CD 1 1
10 2109 1 1 8 PRO CG C 6.760 3.064 -4.630 1.00 . A A . 8 PRO CG 1 1
10 2110 1 1 8 PRO HA H 6.790 2.870 -1.569 1.00 . A A . 8 PRO HA 1 1
10 2111 1 1 8 PRO HB2 H 4.888 3.491 -3.705 1.00 . A A . 8 PRO HB2 1 1
10 2112 1 1 8 PRO HB3 H 6.232 4.467 -3.115 1.00 . A A . 8 PRO HB3 1 1
10 2113 1 1 8 PRO HD2 H 6.036 1.081 -4.923 1.00 . A A . 8 PRO HD2 1 1
10 2114 1 1 8 PRO HD3 H 7.806 1.239 -4.989 1.00 . A A . 8 PRO HD3 1 1
10 2115 1 1 8 PRO HG2 H 6.256 3.324 -5.550 1.00 . A A . 8 PRO HG2 1 1
10 2116 1 1 8 PRO HG3 H 7.730 3.538 -4.587 1.00 . A A . 8 PRO HG3 1 1
10 2117 1 1 8 PRO N N 6.973 1.396 -3.073 1.00 . A A . 8 PRO N 1 1
10 2118 1 1 8 PRO O O 4.171 1.181 -2.599 1.00 . A A . 8 PRO O 1 1
10 2119 1 1 9 PRO C C 2.084 2.289 -0.689 1.00 . A A . 9 PRO C 1 1
10 2120 1 1 9 PRO CA C 3.289 1.656 -0.005 1.00 . A A . 9 PRO CA 1 1
10 2121 1 1 9 PRO CB C 3.367 2.090 1.467 1.00 . A A . 9 PRO CB 1 1
10 2122 1 1 9 PRO CD C 5.290 2.946 0.378 1.00 . A A . 9 PRO CD 1 1
10 2123 1 1 9 PRO CG C 4.794 2.436 1.691 1.00 . A A . 9 PRO CG 1 1
10 2124 1 1 9 PRO HA H 3.217 0.580 -0.076 1.00 . A A . 9 PRO HA 1 1
10 2125 1 1 9 PRO HB2 H 2.720 2.942 1.617 1.00 . A A . 9 PRO HB2 1 1
10 2126 1 1 9 PRO HB3 H 3.051 1.277 2.104 1.00 . A A . 9 PRO HB3 1 1
10 2127 1 1 9 PRO HD2 H 5.056 3.995 0.275 1.00 . A A . 9 PRO HD2 1 1
10 2128 1 1 9 PRO HD3 H 6.352 2.773 0.295 1.00 . A A . 9 PRO HD3 1 1
10 2129 1 1 9 PRO HG2 H 4.875 3.201 2.450 1.00 . A A . 9 PRO HG2 1 1
10 2130 1 1 9 PRO HG3 H 5.345 1.556 1.982 1.00 . A A . 9 PRO HG3 1 1
10 2131 1 1 9 PRO N N 4.531 2.143 -0.587 1.00 . A A . 9 PRO N 1 1
10 2132 1 1 9 PRO O O 1.940 3.520 -0.731 1.00 . A A . 9 PRO O 1 1
10 2133 1 1 10 ARG C C -1.057 1.723 -1.006 1.00 . A A . 10 ARG C 1 1
10 2134 1 1 10 ARG CA C 0.088 1.900 -1.941 1.00 . A A . 10 ARG CA 1 1
10 2135 1 1 10 ARG CB C -0.149 1.070 -3.205 1.00 . A A . 10 ARG CB 1 1
10 2136 1 1 10 ARG CD C 1.405 2.445 -4.631 1.00 . A A . 10 ARG CD 1 1
10 2137 1 1 10 ARG CG C 1.027 1.049 -4.165 1.00 . A A . 10 ARG CG 1 1
10 2138 1 1 10 ARG CZ C 3.116 3.435 -6.133 1.00 . A A . 10 ARG CZ 1 1
10 2139 1 1 10 ARG H H 1.441 0.496 -1.190 1.00 . A A . 10 ARG H 1 1
10 2140 1 1 10 ARG HA H 0.198 2.941 -2.203 1.00 . A A . 10 ARG HA 1 1
10 2141 1 1 10 ARG HB2 H -0.363 0.053 -2.913 1.00 . A A . 10 ARG HB2 1 1
10 2142 1 1 10 ARG HB3 H -1.006 1.471 -3.725 1.00 . A A . 10 ARG HB3 1 1
10 2143 1 1 10 ARG HD2 H 0.577 2.873 -5.175 1.00 . A A . 10 ARG HD2 1 1
10 2144 1 1 10 ARG HD3 H 1.629 3.054 -3.769 1.00 . A A . 10 ARG HD3 1 1
10 2145 1 1 10 ARG HE H 2.977 1.509 -5.588 1.00 . A A . 10 ARG HE 1 1
10 2146 1 1 10 ARG HG2 H 1.877 0.610 -3.665 1.00 . A A . 10 ARG HG2 1 1
10 2147 1 1 10 ARG HG3 H 0.767 0.448 -5.024 1.00 . A A . 10 ARG HG3 1 1
10 2148 1 1 10 ARG HH11 H 1.782 4.832 -5.462 1.00 . A A . 10 ARG HH11 1 1
10 2149 1 1 10 ARG HH12 H 2.983 5.439 -6.507 1.00 . A A . 10 ARG HH12 1 1
10 2150 1 1 10 ARG HH21 H 4.581 2.323 -6.974 1.00 . A A . 10 ARG HH21 1 1
10 2151 1 1 10 ARG HH22 H 4.619 3.981 -7.401 1.00 . A A . 10 ARG HH22 1 1
10 2152 1 1 10 ARG N N 1.265 1.463 -1.259 1.00 . A A . 10 ARG N 1 1
10 2153 1 1 10 ARG NE N 2.577 2.404 -5.494 1.00 . A A . 10 ARG NE 1 1
10 2154 1 1 10 ARG NH1 N 2.595 4.652 -6.024 1.00 . A A . 10 ARG NH1 1 1
10 2155 1 1 10 ARG NH2 N 4.181 3.241 -6.886 1.00 . A A . 10 ARG NH2 1 1
10 2156 1 1 10 ARG O O -1.207 0.650 -0.410 1.00 . A A . 10 ARG O 1 1
10 2157 1 1 11 ALA C C -4.212 2.981 -0.612 1.00 . A A . 11 ALA C 1 1
10 2158 1 1 11 ALA CA C -2.936 2.659 0.079 1.00 . A A . 11 ALA CA 1 1
10 2159 1 1 11 ALA CB C -2.769 3.520 1.345 1.00 . A A . 11 ALA CB 1 1
10 2160 1 1 11 ALA H H -1.712 3.568 -1.352 1.00 . A A . 11 ALA H 1 1
10 2161 1 1 11 ALA HA H -2.992 1.622 0.378 1.00 . A A . 11 ALA HA 1 1
10 2162 1 1 11 ALA HB1 H -3.547 3.250 2.043 1.00 . A A . 11 ALA HB1 1 1
10 2163 1 1 11 ALA HB2 H -2.868 4.570 1.146 1.00 . A A . 11 ALA HB2 1 1
10 2164 1 1 11 ALA N N -1.843 2.748 -0.832 1.00 . A A . 11 ALA N 1 1
10 2165 1 1 11 ALA O O -4.262 3.834 -1.507 1.00 . A A . 11 ALA O 1 1
10 2166 1 1 12 PHE C C -7.451 2.769 0.396 1.00 . A A . 12 PHE C 1 1
10 2167 1 1 12 PHE CA C -6.517 2.417 -0.767 1.00 . A A . 12 PHE CA 1 1
10 2168 1 1 12 PHE CB C -6.912 1.072 -1.420 1.00 . A A . 12 PHE CB 1 1
10 2169 1 1 12 PHE CD1 C -6.161 0.818 -3.820 1.00 . A A . 12 PHE CD1 1 1
10 2170 1 1 12 PHE CD2 C -4.797 -0.153 -2.130 1.00 . A A . 12 PHE CD2 1 1
10 2171 1 1 12 PHE CE1 C -5.281 0.370 -4.789 1.00 . A A . 12 PHE CE1 1 1
10 2172 1 1 12 PHE CE2 C -3.914 -0.604 -3.092 1.00 . A A . 12 PHE CE2 1 1
10 2173 1 1 12 PHE CG C -5.937 0.566 -2.482 1.00 . A A . 12 PHE CG 1 1
10 2174 1 1 12 PHE CZ C -4.155 -0.342 -4.424 1.00 . A A . 12 PHE CZ 1 1
10 2175 1 1 12 PHE H H -5.068 1.656 0.517 1.00 . A A . 12 PHE H 1 1
10 2176 1 1 12 PHE HA H -6.507 3.200 -1.508 1.00 . A A . 12 PHE HA 1 1
10 2177 1 1 12 PHE HB2 H -7.002 0.316 -0.655 1.00 . A A . 12 PHE HB2 1 1
10 2178 1 1 12 PHE HB3 H -7.872 1.196 -1.896 1.00 . A A . 12 PHE HB3 1 1
10 2179 1 1 12 PHE HD1 H -7.040 1.373 -4.108 1.00 . A A . 12 PHE HD1 1 1
10 2180 1 1 12 PHE HD2 H -4.605 -0.359 -1.087 1.00 . A A . 12 PHE HD2 1 1
10 2181 1 1 12 PHE HE1 H -5.480 0.580 -5.830 1.00 . A A . 12 PHE HE1 1 1
10 2182 1 1 12 PHE HE2 H -3.035 -1.160 -2.797 1.00 . A A . 12 PHE HE2 1 1
10 2183 1 1 12 PHE HZ H -3.467 -0.690 -5.180 1.00 . A A . 12 PHE HZ 1 1
10 2184 1 1 12 PHE N N -5.215 2.298 -0.218 1.00 . A A . 12 PHE N 1 1
10 2185 1 1 12 PHE O O -7.283 2.222 1.498 1.00 . A A . 12 PHE O 1 1
10 2186 1 1 13 PRO C C -10.099 3.116 2.027 1.00 . A A . 13 PRO C 1 1
10 2187 1 1 13 PRO CA C -9.317 4.205 1.274 1.00 . A A . 13 PRO CA 1 1
10 2188 1 1 13 PRO CB C -10.273 5.123 0.521 1.00 . A A . 13 PRO CB 1 1
10 2189 1 1 13 PRO CD C -8.653 4.429 -1.059 1.00 . A A . 13 PRO CD 1 1
10 2190 1 1 13 PRO CG C -9.462 5.610 -0.619 1.00 . A A . 13 PRO CG 1 1
10 2191 1 1 13 PRO HA H -8.771 4.792 1.998 1.00 . A A . 13 PRO HA 1 1
10 2192 1 1 13 PRO HB2 H -11.133 4.557 0.191 1.00 . A A . 13 PRO HB2 1 1
10 2193 1 1 13 PRO HB3 H -10.589 5.935 1.158 1.00 . A A . 13 PRO HB3 1 1
10 2194 1 1 13 PRO HD2 H -9.219 3.822 -1.748 1.00 . A A . 13 PRO HD2 1 1
10 2195 1 1 13 PRO HD3 H -7.728 4.760 -1.507 1.00 . A A . 13 PRO HD3 1 1
10 2196 1 1 13 PRO HG2 H -10.102 5.956 -1.415 1.00 . A A . 13 PRO HG2 1 1
10 2197 1 1 13 PRO HG3 H -8.809 6.405 -0.289 1.00 . A A . 13 PRO HG3 1 1
10 2198 1 1 13 PRO N N -8.401 3.714 0.206 1.00 . A A . 13 PRO N 1 1
10 2199 1 1 13 PRO O O -10.596 3.362 3.131 1.00 . A A . 13 PRO O 1 1
10 2200 1 1 14 ASP C C -10.082 0.313 3.294 1.00 . A A . 14 ASP C 1 1
10 2201 1 1 14 ASP CA C -10.901 0.813 2.110 1.00 . A A . 14 ASP CA 1 1
10 2202 1 1 14 ASP CB C -11.162 -0.364 1.156 1.00 . A A . 14 ASP CB 1 1
10 2203 1 1 14 ASP CG C -9.897 -1.061 0.723 1.00 . A A . 14 ASP CG 1 1
10 2204 1 1 14 ASP H H -9.846 1.818 0.540 1.00 . A A . 14 ASP H 1 1
10 2205 1 1 14 ASP HA H -11.845 1.181 2.483 1.00 . A A . 14 ASP HA 1 1
10 2206 1 1 14 ASP HB2 H -11.789 -1.088 1.656 1.00 . A A . 14 ASP HB2 1 1
10 2207 1 1 14 ASP HB3 H -11.675 -0.002 0.279 1.00 . A A . 14 ASP HB3 1 1
10 2208 1 1 14 ASP N N -10.216 1.932 1.443 1.00 . A A . 14 ASP N 1 1
10 2209 1 1 14 ASP O O -10.628 -0.252 4.241 1.00 . A A . 14 ASP O 1 1
10 2210 1 1 14 ASP OD1 O -9.322 -0.667 -0.305 1.00 . A A . 14 ASP OD1 1 1
10 2211 1 1 14 ASP OD2 O -9.451 -1.997 1.417 1.00 . A A . 14 ASP OD2 1 1
10 2212 2 2 1 . C C -2.125 1.626 3.633 1.00 . B A . 101 WMH C 1 1
10 2213 2 2 1 . C1 C -1.461 3.349 2.046 1.00 . B A . 101 WMH C1 1 1
10 2214 2 2 1 . C2 C -0.308 3.990 1.747 1.00 . B A . 101 WMH C2 1 1
10 2215 2 2 1 . H1 H -2.429 2.037 4.580 1.00 . B A . 101 WMH H1 1 1
10 2216 2 2 1 . H2 H -2.999 1.631 3.003 1.00 . B A . 101 WMH H2 1 1
10 2217 2 2 1 . H5 H -0.184 4.746 0.987 1.00 . B A . 101 WMH H5 1 1
10 2218 2 2 1 . N N -1.212 2.497 3.026 1.00 . B A . 101 WMH N 1 1
10 2219 2 2 1 . N1 N 0.640 3.530 2.547 1.00 . B A . 101 WMH N1 1 1
10 2220 2 2 1 . N2 N 0.149 2.632 3.333 1.00 . B A . 101 WMH N2 1 1
11 2221 1 1 1 GLY C C -6.659 -0.927 3.511 1.00 . A A . 1 GLY C 1 1
11 2222 1 1 1 GLY CA C -7.917 -0.349 4.087 1.00 . A A . 1 GLY CA 1 1
11 2223 1 1 1 GLY H1 H -8.435 0.889 2.475 1.00 . A A . 1 GLY H1 1 1
11 2224 1 1 1 GLY HA2 H -7.656 0.441 4.778 1.00 . A A . 1 GLY HA2 1 1
11 2225 1 1 1 GLY HA3 H -8.446 -1.123 4.624 1.00 . A A . 1 GLY HA3 1 1
11 2226 1 1 1 GLY N N -8.768 0.187 3.078 1.00 . A A . 1 GLY N 1 1
11 2227 1 1 1 GLY O O -5.714 -1.223 4.257 1.00 . A A . 1 GLY O 1 1
11 2228 1 1 2 ARG C C -4.266 -0.727 1.672 1.00 . A A . 2 ARG C 1 1
11 2229 1 1 2 ARG CA C -5.455 -1.629 1.525 1.00 . A A . 2 ARG CA 1 1
11 2230 1 1 2 ARG CB C -5.701 -1.954 0.044 1.00 . A A . 2 ARG CB 1 1
11 2231 1 1 2 ARG CD C -5.586 -4.502 0.083 1.00 . A A . 2 ARG CD 1 1
11 2232 1 1 2 ARG CG C -6.447 -3.260 -0.221 1.00 . A A . 2 ARG CG 1 1
11 2233 1 1 2 ARG CZ C -3.950 -4.885 1.957 1.00 . A A . 2 ARG CZ 1 1
11 2234 1 1 2 ARG H H -7.412 -0.862 1.640 1.00 . A A . 2 ARG H 1 1
11 2235 1 1 2 ARG HA H -5.217 -2.553 2.032 1.00 . A A . 2 ARG HA 1 1
11 2236 1 1 2 ARG HB2 H -6.280 -1.154 -0.392 1.00 . A A . 2 ARG HB2 1 1
11 2237 1 1 2 ARG HB3 H -4.746 -2.003 -0.458 1.00 . A A . 2 ARG HB3 1 1
11 2238 1 1 2 ARG HD2 H -6.146 -5.384 -0.187 1.00 . A A . 2 ARG HD2 1 1
11 2239 1 1 2 ARG HD3 H -4.696 -4.450 -0.525 1.00 . A A . 2 ARG HD3 1 1
11 2240 1 1 2 ARG HE H -5.936 -4.497 2.144 1.00 . A A . 2 ARG HE 1 1
11 2241 1 1 2 ARG HG2 H -7.332 -3.280 0.395 1.00 . A A . 2 ARG HG2 1 1
11 2242 1 1 2 ARG HG3 H -6.741 -3.282 -1.262 1.00 . A A . 2 ARG HG3 1 1
11 2243 1 1 2 ARG HH11 H -3.047 -4.938 0.110 1.00 . A A . 2 ARG HH11 1 1
11 2244 1 1 2 ARG HH12 H -1.987 -5.214 1.381 1.00 . A A . 2 ARG HH12 1 1
11 2245 1 1 2 ARG HH21 H -4.489 -4.869 3.919 1.00 . A A . 2 ARG HH21 1 1
11 2246 1 1 2 ARG HH22 H -2.831 -5.170 3.657 1.00 . A A . 2 ARG HH22 1 1
11 2247 1 1 2 ARG N N -6.631 -1.096 2.188 1.00 . A A . 2 ARG N 1 1
11 2248 1 1 2 ARG NE N -5.193 -4.618 1.504 1.00 . A A . 2 ARG NE 1 1
11 2249 1 1 2 ARG NH1 N -2.934 -5.023 1.104 1.00 . A A . 2 ARG NH1 1 1
11 2250 1 1 2 ARG NH2 N -3.736 -4.987 3.263 1.00 . A A . 2 ARG NH2 1 1
11 2251 1 1 2 ARG O O -4.339 0.464 1.410 1.00 . A A . 2 ARG O 1 1
11 2252 1 1 3 ALA C C -0.877 -1.675 2.057 1.00 . A A . 3 ALA C 1 1
11 2253 1 1 3 ALA CA C -1.943 -0.671 2.308 1.00 . A A . 3 ALA CA 1 1
11 2254 1 1 3 ALA CB C -1.801 -0.052 3.717 1.00 . A A . 3 ALA CB 1 1
11 2255 1 1 3 ALA H H -3.254 -2.245 2.411 1.00 . A A . 3 ALA H 1 1
11 2256 1 1 3 ALA HA H -1.861 0.114 1.571 1.00 . A A . 3 ALA HA 1 1
11 2257 1 1 3 ALA HB1 H -0.767 -0.114 4.021 1.00 . A A . 3 ALA HB1 1 1
11 2258 1 1 3 ALA HB2 H -2.404 -0.621 4.408 1.00 . A A . 3 ALA HB2 1 1
11 2259 1 1 3 ALA N N -3.211 -1.302 2.141 1.00 . A A . 3 ALA N 1 1
11 2260 1 1 3 ALA O O -0.983 -2.821 2.512 1.00 . A A . 3 ALA O 1 1
11 2261 1 1 4 THR C C 2.260 -1.891 2.092 1.00 . A A . 4 THR C 1 1
11 2262 1 1 4 THR CA C 1.211 -2.137 1.038 1.00 . A A . 4 THR CA 1 1
11 2263 1 1 4 THR CB C 1.801 -1.879 -0.361 1.00 . A A . 4 THR CB 1 1
11 2264 1 1 4 THR CG2 C 0.864 -2.364 -1.447 1.00 . A A . 4 THR CG2 1 1
11 2265 1 1 4 THR H H 0.079 -0.417 0.850 1.00 . A A . 4 THR H 1 1
11 2266 1 1 4 THR HA H 0.879 -3.162 1.092 1.00 . A A . 4 THR HA 1 1
11 2267 1 1 4 THR HB H 2.742 -2.405 -0.441 1.00 . A A . 4 THR HB 1 1
11 2268 1 1 4 THR HG1 H 2.850 -0.357 -1.047 1.00 . A A . 4 THR HG1 1 1
11 2269 1 1 4 THR HG21 H -0.071 -1.831 -1.366 1.00 . A A . 4 THR HG21 1 1
11 2270 1 1 4 THR HG22 H 0.685 -3.422 -1.324 1.00 . A A . 4 THR HG22 1 1
11 2271 1 1 4 THR HG23 H 1.300 -2.180 -2.417 1.00 . A A . 4 THR HG23 1 1
11 2272 1 1 4 THR N N 0.096 -1.294 1.292 1.00 . A A . 4 THR N 1 1
11 2273 1 1 4 THR O O 2.478 -0.746 2.514 1.00 . A A . 4 THR O 1 1
11 2274 1 1 4 THR OG1 O 2.036 -0.478 -0.532 1.00 . A A . 4 THR OG1 1 1
11 2275 1 1 5 LYS C C 5.277 -2.964 2.859 1.00 . A A . 5 LYS C 1 1
11 2276 1 1 5 LYS CA C 3.922 -2.824 3.538 1.00 . A A . 5 LYS CA 1 1
11 2277 1 1 5 LYS CB C 3.720 -3.865 4.631 1.00 . A A . 5 LYS CB 1 1
11 2278 1 1 5 LYS CD C 2.126 -4.791 6.409 1.00 . A A . 5 LYS CD 1 1
11 2279 1 1 5 LYS CE C 2.923 -4.614 7.707 1.00 . A A . 5 LYS CE 1 1
11 2280 1 1 5 LYS CG C 2.385 -3.703 5.363 1.00 . A A . 5 LYS CG 1 1
11 2281 1 1 5 LYS H H 2.596 -3.830 2.236 1.00 . A A . 5 LYS H 1 1
11 2282 1 1 5 LYS HA H 3.850 -1.836 3.965 1.00 . A A . 5 LYS HA 1 1
11 2283 1 1 5 LYS HB2 H 3.755 -4.848 4.190 1.00 . A A . 5 LYS HB2 1 1
11 2284 1 1 5 LYS HB3 H 4.517 -3.766 5.353 1.00 . A A . 5 LYS HB3 1 1
11 2285 1 1 5 LYS HD2 H 1.075 -4.781 6.658 1.00 . A A . 5 LYS HD2 1 1
11 2286 1 1 5 LYS HD3 H 2.371 -5.746 5.973 1.00 . A A . 5 LYS HD3 1 1
11 2287 1 1 5 LYS HE2 H 2.671 -3.652 8.124 1.00 . A A . 5 LYS HE2 1 1
11 2288 1 1 5 LYS HE3 H 2.607 -5.383 8.397 1.00 . A A . 5 LYS HE3 1 1
11 2289 1 1 5 LYS HG2 H 2.383 -2.746 5.863 1.00 . A A . 5 LYS HG2 1 1
11 2290 1 1 5 LYS HG3 H 1.590 -3.718 4.632 1.00 . A A . 5 LYS HG3 1 1
11 2291 1 1 5 LYS HZ1 H 4.849 -4.711 8.475 1.00 . A A . 5 LYS HZ1 1 1
11 2292 1 1 5 LYS HZ2 H 4.783 -3.842 7.067 1.00 . A A . 5 LYS HZ2 1 1
11 2293 1 1 5 LYS HZ3 H 4.700 -5.534 7.017 1.00 . A A . 5 LYS HZ3 1 1
11 2294 1 1 5 LYS N N 2.872 -2.940 2.551 1.00 . A A . 5 LYS N 1 1
11 2295 1 1 5 LYS NZ N 4.398 -4.686 7.538 1.00 . A A . 5 LYS NZ 1 1
11 2296 1 1 5 LYS O O 6.324 -3.078 3.499 1.00 . A A . 5 LYS O 1 1
11 2297 1 1 6 SER C C 6.490 -1.709 -0.077 1.00 . A A . 6 SER C 1 1
11 2298 1 1 6 SER CA C 6.387 -3.003 0.727 1.00 . A A . 6 SER CA 1 1
11 2299 1 1 6 SER CB C 6.251 -4.217 -0.178 1.00 . A A . 6 SER CB 1 1
11 2300 1 1 6 SER H H 4.365 -2.838 1.113 1.00 . A A . 6 SER H 1 1
11 2301 1 1 6 SER HA H 7.258 -3.114 1.352 1.00 . A A . 6 SER HA 1 1
11 2302 1 1 6 SER HB2 H 7.007 -4.173 -0.947 1.00 . A A . 6 SER HB2 1 1
11 2303 1 1 6 SER HB3 H 6.372 -5.120 0.404 1.00 . A A . 6 SER HB3 1 1
11 2304 1 1 6 SER HG H 5.072 -4.007 -1.727 1.00 . A A . 6 SER HG 1 1
11 2305 1 1 6 SER N N 5.232 -2.932 1.558 1.00 . A A . 6 SER N 1 1
11 2306 1 1 6 SER O O 5.610 -0.843 0.035 1.00 . A A . 6 SER O 1 1
11 2307 1 1 6 SER OG O 4.966 -4.235 -0.794 1.00 . A A . 6 SER OG 1 1
11 2308 1 1 7 ILE C C 6.975 -0.524 -2.999 1.00 . A A . 7 ILE C 1 1
11 2309 1 1 7 ILE CA C 7.704 -0.369 -1.655 1.00 . A A . 7 ILE CA 1 1
11 2310 1 1 7 ILE CB C 9.202 -0.014 -1.890 1.00 . A A . 7 ILE CB 1 1
11 2311 1 1 7 ILE CD1 C 11.419 -0.898 -2.856 1.00 . A A . 7 ILE CD1 1 1
11 2312 1 1 7 ILE CG1 C 9.958 -1.183 -2.564 1.00 . A A . 7 ILE CG1 1 1
11 2313 1 1 7 ILE CG2 C 9.856 0.369 -0.571 1.00 . A A . 7 ILE CG2 1 1
11 2314 1 1 7 ILE H H 8.232 -2.253 -0.866 1.00 . A A . 7 ILE H 1 1
11 2315 1 1 7 ILE HA H 7.241 0.431 -1.098 1.00 . A A . 7 ILE HA 1 1
11 2316 1 1 7 ILE HB H 9.237 0.850 -2.537 1.00 . A A . 7 ILE HB 1 1
11 2317 1 1 7 ILE HD11 H 11.491 -0.040 -3.505 1.00 . A A . 7 ILE HD11 1 1
11 2318 1 1 7 ILE HD12 H 11.863 -1.755 -3.338 1.00 . A A . 7 ILE HD12 1 1
11 2319 1 1 7 ILE HD13 H 11.936 -0.694 -1.930 1.00 . A A . 7 ILE HD13 1 1
11 2320 1 1 7 ILE HG12 H 9.918 -2.049 -1.922 1.00 . A A . 7 ILE HG12 1 1
11 2321 1 1 7 ILE HG13 H 9.471 -1.420 -3.500 1.00 . A A . 7 ILE HG13 1 1
11 2322 1 1 7 ILE HG21 H 9.774 -0.459 0.120 1.00 . A A . 7 ILE HG21 1 1
11 2323 1 1 7 ILE HG22 H 9.367 1.237 -0.158 1.00 . A A . 7 ILE HG22 1 1
11 2324 1 1 7 ILE HG23 H 10.900 0.586 -0.740 1.00 . A A . 7 ILE HG23 1 1
11 2325 1 1 7 ILE N N 7.541 -1.555 -0.843 1.00 . A A . 7 ILE N 1 1
11 2326 1 1 7 ILE O O 7.044 -1.589 -3.631 1.00 . A A . 7 ILE O 1 1
11 2327 1 1 8 PRO C C 4.807 1.651 -1.779 1.00 . A A . 8 PRO C 1 1
11 2328 1 1 8 PRO CA C 6.035 1.741 -2.708 1.00 . A A . 8 PRO CA 1 1
11 2329 1 1 8 PRO CB C 5.765 2.768 -3.834 1.00 . A A . 8 PRO CB 1 1
11 2330 1 1 8 PRO CD C 5.498 0.524 -4.698 1.00 . A A . 8 PRO CD 1 1
11 2331 1 1 8 PRO CG C 5.575 1.970 -5.097 1.00 . A A . 8 PRO CG 1 1
11 2332 1 1 8 PRO HA H 6.916 2.028 -2.155 1.00 . A A . 8 PRO HA 1 1
11 2333 1 1 8 PRO HB2 H 4.878 3.335 -3.591 1.00 . A A . 8 PRO HB2 1 1
11 2334 1 1 8 PRO HB3 H 6.608 3.439 -3.916 1.00 . A A . 8 PRO HB3 1 1
11 2335 1 1 8 PRO HD2 H 4.471 0.223 -4.553 1.00 . A A . 8 PRO HD2 1 1
11 2336 1 1 8 PRO HD3 H 5.977 -0.103 -5.435 1.00 . A A . 8 PRO HD3 1 1
11 2337 1 1 8 PRO HG2 H 4.659 2.267 -5.585 1.00 . A A . 8 PRO HG2 1 1
11 2338 1 1 8 PRO HG3 H 6.413 2.131 -5.759 1.00 . A A . 8 PRO HG3 1 1
11 2339 1 1 8 PRO N N 6.228 0.497 -3.439 1.00 . A A . 8 PRO N 1 1
11 2340 1 1 8 PRO O O 3.943 0.779 -1.976 1.00 . A A . 8 PRO O 1 1
11 2341 1 1 9 PRO C C 2.341 3.061 -0.605 1.00 . A A . 9 PRO C 1 1
11 2342 1 1 9 PRO CA C 3.563 2.548 0.151 1.00 . A A . 9 PRO CA 1 1
11 2343 1 1 9 PRO CB C 3.964 3.539 1.259 1.00 . A A . 9 PRO CB 1 1
11 2344 1 1 9 PRO CD C 5.764 3.457 -0.307 1.00 . A A . 9 PRO CD 1 1
11 2345 1 1 9 PRO CG C 5.442 3.676 1.141 1.00 . A A . 9 PRO CG 1 1
11 2346 1 1 9 PRO HA H 3.346 1.577 0.569 1.00 . A A . 9 PRO HA 1 1
11 2347 1 1 9 PRO HB2 H 3.465 4.482 1.092 1.00 . A A . 9 PRO HB2 1 1
11 2348 1 1 9 PRO HB3 H 3.678 3.144 2.223 1.00 . A A . 9 PRO HB3 1 1
11 2349 1 1 9 PRO HD2 H 5.690 4.382 -0.859 1.00 . A A . 9 PRO HD2 1 1
11 2350 1 1 9 PRO HD3 H 6.751 3.029 -0.406 1.00 . A A . 9 PRO HD3 1 1
11 2351 1 1 9 PRO HG2 H 5.747 4.665 1.448 1.00 . A A . 9 PRO HG2 1 1
11 2352 1 1 9 PRO HG3 H 5.928 2.929 1.751 1.00 . A A . 9 PRO HG3 1 1
11 2353 1 1 9 PRO N N 4.729 2.500 -0.732 1.00 . A A . 9 PRO N 1 1
11 2354 1 1 9 PRO O O 2.210 4.254 -0.877 1.00 . A A . 9 PRO O 1 1
11 2355 1 1 10 ARG C C -0.870 2.090 -0.914 1.00 . A A . 10 ARG C 1 1
11 2356 1 1 10 ARG CA C 0.328 2.441 -1.756 1.00 . A A . 10 ARG CA 1 1
11 2357 1 1 10 ARG CB C 0.356 1.600 -3.033 1.00 . A A . 10 ARG CB 1 1
11 2358 1 1 10 ARG CD C -0.735 0.866 -5.155 1.00 . A A . 10 ARG CD 1 1
11 2359 1 1 10 ARG CG C -0.849 1.762 -3.934 1.00 . A A . 10 ARG CG 1 1
11 2360 1 1 10 ARG CZ C -0.211 -1.529 -5.640 1.00 . A A . 10 ARG CZ 1 1
11 2361 1 1 10 ARG H H 1.670 1.215 -0.750 1.00 . A A . 10 ARG H 1 1
11 2362 1 1 10 ARG HA H 0.313 3.489 -2.015 1.00 . A A . 10 ARG HA 1 1
11 2363 1 1 10 ARG HB2 H 1.235 1.865 -3.602 1.00 . A A . 10 ARG HB2 1 1
11 2364 1 1 10 ARG HB3 H 0.431 0.559 -2.755 1.00 . A A . 10 ARG HB3 1 1
11 2365 1 1 10 ARG HD2 H -1.610 1.005 -5.774 1.00 . A A . 10 ARG HD2 1 1
11 2366 1 1 10 ARG HD3 H 0.144 1.152 -5.713 1.00 . A A . 10 ARG HD3 1 1
11 2367 1 1 10 ARG HE H -0.877 -0.797 -3.879 1.00 . A A . 10 ARG HE 1 1
11 2368 1 1 10 ARG HG2 H -1.740 1.500 -3.384 1.00 . A A . 10 ARG HG2 1 1
11 2369 1 1 10 ARG HG3 H -0.909 2.792 -4.257 1.00 . A A . 10 ARG HG3 1 1
11 2370 1 1 10 ARG HH11 H -0.064 -0.327 -7.293 1.00 . A A . 10 ARG HH11 1 1
11 2371 1 1 10 ARG HH12 H 0.347 -1.961 -7.550 1.00 . A A . 10 ARG HH12 1 1
11 2372 1 1 10 ARG HH21 H -0.312 -3.057 -4.266 1.00 . A A . 10 ARG HH21 1 1
11 2373 1 1 10 ARG HH22 H 0.237 -3.512 -5.812 1.00 . A A . 10 ARG HH22 1 1
11 2374 1 1 10 ARG N N 1.505 2.156 -0.993 1.00 . A A . 10 ARG N 1 1
11 2375 1 1 10 ARG NE N -0.629 -0.562 -4.805 1.00 . A A . 10 ARG NE 1 1
11 2376 1 1 10 ARG NH1 N 0.043 -1.248 -6.911 1.00 . A A . 10 ARG NH1 1 1
11 2377 1 1 10 ARG NH2 N -0.093 -2.781 -5.208 1.00 . A A . 10 ARG NH2 1 1
11 2378 1 1 10 ARG O O -1.036 0.927 -0.522 1.00 . A A . 10 ARG O 1 1
11 2379 1 1 11 ALA C C -4.084 3.274 -0.397 1.00 . A A . 11 ALA C 1 1
11 2380 1 1 11 ALA CA C -2.803 2.840 0.262 1.00 . A A . 11 ALA CA 1 1
11 2381 1 1 11 ALA CB C -2.659 3.500 1.645 1.00 . A A . 11 ALA CB 1 1
11 2382 1 1 11 ALA H H -1.499 3.986 -0.907 1.00 . A A . 11 ALA H 1 1
11 2383 1 1 11 ALA HA H -2.860 1.771 0.409 1.00 . A A . 11 ALA HA 1 1
11 2384 1 1 11 ALA HB1 H -3.482 3.170 2.261 1.00 . A A . 11 ALA HB1 1 1
11 2385 1 1 11 ALA HB2 H -2.708 4.571 1.592 1.00 . A A . 11 ALA HB2 1 1
11 2386 1 1 11 ALA N N -1.669 3.077 -0.582 1.00 . A A . 11 ALA N 1 1
11 2387 1 1 11 ALA O O -4.092 4.185 -1.242 1.00 . A A . 11 ALA O 1 1
11 2388 1 1 12 PHE C C -7.419 2.974 0.644 1.00 . A A . 12 PHE C 1 1
11 2389 1 1 12 PHE CA C -6.464 2.849 -0.541 1.00 . A A . 12 PHE CA 1 1
11 2390 1 1 12 PHE CB C -6.897 1.687 -1.447 1.00 . A A . 12 PHE CB 1 1
11 2391 1 1 12 PHE CD1 C -6.312 2.115 -3.851 1.00 . A A . 12 PHE CD1 1 1
11 2392 1 1 12 PHE CD2 C -4.939 0.619 -2.609 1.00 . A A . 12 PHE CD2 1 1
11 2393 1 1 12 PHE CE1 C -5.526 1.911 -4.967 1.00 . A A . 12 PHE CE1 1 1
11 2394 1 1 12 PHE CE2 C -4.152 0.417 -3.719 1.00 . A A . 12 PHE CE2 1 1
11 2395 1 1 12 PHE CG C -6.029 1.472 -2.661 1.00 . A A . 12 PHE CG 1 1
11 2396 1 1 12 PHE CZ C -4.446 1.063 -4.901 1.00 . A A . 12 PHE CZ 1 1
11 2397 1 1 12 PHE H H -5.028 1.904 0.645 1.00 . A A . 12 PHE H 1 1
11 2398 1 1 12 PHE HA H -6.458 3.769 -1.106 1.00 . A A . 12 PHE HA 1 1
11 2399 1 1 12 PHE HB2 H -6.882 0.774 -0.869 1.00 . A A . 12 PHE HB2 1 1
11 2400 1 1 12 PHE HB3 H -7.908 1.860 -1.784 1.00 . A A . 12 PHE HB3 1 1
11 2401 1 1 12 PHE HD1 H -7.158 2.785 -3.902 1.00 . A A . 12 PHE HD1 1 1
11 2402 1 1 12 PHE HD2 H -4.703 0.111 -1.686 1.00 . A A . 12 PHE HD2 1 1
11 2403 1 1 12 PHE HE1 H -5.757 2.418 -5.891 1.00 . A A . 12 PHE HE1 1 1
11 2404 1 1 12 PHE HE2 H -3.305 -0.250 -3.658 1.00 . A A . 12 PHE HE2 1 1
11 2405 1 1 12 PHE HZ H -3.831 0.902 -5.775 1.00 . A A . 12 PHE HZ 1 1
11 2406 1 1 12 PHE N N -5.141 2.613 -0.029 1.00 . A A . 12 PHE N 1 1
11 2407 1 1 12 PHE O O -7.170 2.367 1.706 1.00 . A A . 12 PHE O 1 1
11 2408 1 1 13 PRO C C -10.257 2.790 2.100 1.00 . A A . 13 PRO C 1 1
11 2409 1 1 13 PRO CA C -9.484 4.019 1.594 1.00 . A A . 13 PRO CA 1 1
11 2410 1 1 13 PRO CB C -10.453 5.032 0.972 1.00 . A A . 13 PRO CB 1 1
11 2411 1 1 13 PRO CD C -8.945 4.403 -0.757 1.00 . A A . 13 PRO CD 1 1
11 2412 1 1 13 PRO CG C -10.374 4.770 -0.489 1.00 . A A . 13 PRO CG 1 1
11 2413 1 1 13 PRO HA H -8.980 4.484 2.428 1.00 . A A . 13 PRO HA 1 1
11 2414 1 1 13 PRO HB2 H -11.448 4.863 1.355 1.00 . A A . 13 PRO HB2 1 1
11 2415 1 1 13 PRO HB3 H -10.133 6.036 1.209 1.00 . A A . 13 PRO HB3 1 1
11 2416 1 1 13 PRO HD2 H -8.877 3.733 -1.601 1.00 . A A . 13 PRO HD2 1 1
11 2417 1 1 13 PRO HD3 H -8.353 5.289 -0.929 1.00 . A A . 13 PRO HD3 1 1
11 2418 1 1 13 PRO HG2 H -11.028 3.950 -0.750 1.00 . A A . 13 PRO HG2 1 1
11 2419 1 1 13 PRO HG3 H -10.645 5.658 -1.041 1.00 . A A . 13 PRO HG3 1 1
11 2420 1 1 13 PRO N N -8.528 3.737 0.495 1.00 . A A . 13 PRO N 1 1
11 2421 1 1 13 PRO O O -10.972 2.871 3.096 1.00 . A A . 13 PRO O 1 1
11 2422 1 1 14 ASP C C -10.004 -0.238 2.939 1.00 . A A . 14 ASP C 1 1
11 2423 1 1 14 ASP CA C -10.806 0.439 1.839 1.00 . A A . 14 ASP CA 1 1
11 2424 1 1 14 ASP CB C -11.001 -0.533 0.657 1.00 . A A . 14 ASP CB 1 1
11 2425 1 1 14 ASP CG C -9.738 -1.282 0.269 1.00 . A A . 14 ASP CG 1 1
11 2426 1 1 14 ASP H H -9.526 1.640 0.639 1.00 . A A . 14 ASP H 1 1
11 2427 1 1 14 ASP HA H -11.770 0.723 2.237 1.00 . A A . 14 ASP HA 1 1
11 2428 1 1 14 ASP HB2 H -11.753 -1.261 0.920 1.00 . A A . 14 ASP HB2 1 1
11 2429 1 1 14 ASP HB3 H -11.344 0.028 -0.198 1.00 . A A . 14 ASP HB3 1 1
11 2430 1 1 14 ASP N N -10.115 1.661 1.424 1.00 . A A . 14 ASP N 1 1
11 2431 1 1 14 ASP O O -10.495 -1.125 3.647 1.00 . A A . 14 ASP O 1 1
11 2432 1 1 14 ASP OD1 O -8.708 -0.636 -0.004 1.00 . A A . 14 ASP OD1 1 1
11 2433 1 1 14 ASP OD2 O -9.776 -2.538 0.206 1.00 . A A . 14 ASP OD2 1 1
11 2434 2 2 1 . C C -2.237 1.397 3.798 1.00 . B A . 101 WMH C 1 1
11 2435 2 2 1 . C1 C -1.386 3.164 2.371 1.00 . B A . 101 WMH C1 1 1
11 2436 2 2 1 . C2 C -0.156 3.710 2.150 1.00 . B A . 101 WMH C2 1 1
11 2437 2 2 1 . H1 H -2.524 1.730 4.781 1.00 . B A . 101 WMH H1 1 1
11 2438 2 2 1 . H2 H -3.097 1.501 3.157 1.00 . B A . 101 WMH H2 1 1
11 2439 2 2 1 . H5 H 0.075 4.489 1.438 1.00 . B A . 101 WMH H5 1 1
11 2440 2 2 1 . N N -1.251 2.246 3.304 1.00 . B A . 101 WMH N 1 1
11 2441 2 2 1 . N1 N 0.712 3.115 2.962 1.00 . B A . 101 WMH N1 1 1
11 2442 2 2 1 . N2 N 0.094 2.236 3.673 1.00 . B A . 101 WMH N2 1 1
12 2443 1 1 1 GLY C C -7.218 -1.428 3.446 1.00 . A A . 1 GLY C 1 1
12 2444 1 1 1 GLY CA C -8.410 -0.694 4.006 1.00 . A A . 1 GLY CA 1 1
12 2445 1 1 1 GLY H1 H -8.648 0.918 2.643 1.00 . A A . 1 GLY H1 1 1
12 2446 1 1 1 GLY HA2 H -8.093 -0.090 4.841 1.00 . A A . 1 GLY HA2 1 1
12 2447 1 1 1 GLY HA3 H -9.116 -1.426 4.370 1.00 . A A . 1 GLY HA3 1 1
12 2448 1 1 1 GLY N N -9.095 0.138 3.036 1.00 . A A . 1 GLY N 1 1
12 2449 1 1 1 GLY O O -6.915 -2.543 3.876 1.00 . A A . 1 GLY O 1 1
12 2450 1 1 2 ARG C C -4.159 -0.601 1.999 1.00 . A A . 2 ARG C 1 1
12 2451 1 1 2 ARG CA C -5.385 -1.475 1.899 1.00 . A A . 2 ARG CA 1 1
12 2452 1 1 2 ARG CB C -5.657 -1.784 0.432 1.00 . A A . 2 ARG CB 1 1
12 2453 1 1 2 ARG CD C -7.113 -2.836 -1.302 1.00 . A A . 2 ARG CD 1 1
12 2454 1 1 2 ARG CG C -6.815 -2.729 0.181 1.00 . A A . 2 ARG CG 1 1
12 2455 1 1 2 ARG CZ C -5.801 -3.179 -3.393 1.00 . A A . 2 ARG CZ 1 1
12 2456 1 1 2 ARG H H -6.748 0.095 2.241 1.00 . A A . 2 ARG H 1 1
12 2457 1 1 2 ARG HA H -5.217 -2.402 2.423 1.00 . A A . 2 ARG HA 1 1
12 2458 1 1 2 ARG HB2 H -5.864 -0.855 -0.073 1.00 . A A . 2 ARG HB2 1 1
12 2459 1 1 2 ARG HB3 H -4.766 -2.220 0.003 1.00 . A A . 2 ARG HB3 1 1
12 2460 1 1 2 ARG HD2 H -7.966 -3.481 -1.448 1.00 . A A . 2 ARG HD2 1 1
12 2461 1 1 2 ARG HD3 H -7.347 -1.846 -1.664 1.00 . A A . 2 ARG HD3 1 1
12 2462 1 1 2 ARG HE H -5.334 -3.906 -1.570 1.00 . A A . 2 ARG HE 1 1
12 2463 1 1 2 ARG HG2 H -6.562 -3.707 0.563 1.00 . A A . 2 ARG HG2 1 1
12 2464 1 1 2 ARG HG3 H -7.689 -2.356 0.693 1.00 . A A . 2 ARG HG3 1 1
12 2465 1 1 2 ARG HH11 H -7.430 -1.981 -3.641 1.00 . A A . 2 ARG HH11 1 1
12 2466 1 1 2 ARG HH12 H -6.536 -2.273 -5.060 1.00 . A A . 2 ARG HH12 1 1
12 2467 1 1 2 ARG HH21 H -4.123 -4.316 -3.506 1.00 . A A . 2 ARG HH21 1 1
12 2468 1 1 2 ARG HH22 H -4.611 -3.651 -4.996 1.00 . A A . 2 ARG HH22 1 1
12 2469 1 1 2 ARG N N -6.526 -0.823 2.512 1.00 . A A . 2 ARG N 1 1
12 2470 1 1 2 ARG NE N -5.978 -3.363 -2.078 1.00 . A A . 2 ARG NE 1 1
12 2471 1 1 2 ARG NH1 N -6.645 -2.428 -4.077 1.00 . A A . 2 ARG NH1 1 1
12 2472 1 1 2 ARG NH2 N -4.776 -3.746 -4.011 1.00 . A A . 2 ARG NH2 1 1
12 2473 1 1 2 ARG O O -4.239 0.594 1.770 1.00 . A A . 2 ARG O 1 1
12 2474 1 1 3 ALA C C -0.696 -1.580 2.207 1.00 . A A . 3 ALA C 1 1
12 2475 1 1 3 ALA CA C -1.754 -0.551 2.437 1.00 . A A . 3 ALA CA 1 1
12 2476 1 1 3 ALA CB C -1.530 0.178 3.780 1.00 . A A . 3 ALA CB 1 1
12 2477 1 1 3 ALA H H -3.086 -2.143 2.636 1.00 . A A . 3 ALA H 1 1
12 2478 1 1 3 ALA HA H -1.711 0.166 1.630 1.00 . A A . 3 ALA HA 1 1
12 2479 1 1 3 ALA HB1 H -0.476 0.145 4.014 1.00 . A A . 3 ALA HB1 1 1
12 2480 1 1 3 ALA HB2 H -2.072 -0.339 4.556 1.00 . A A . 3 ALA HB2 1 1
12 2481 1 1 3 ALA N N -3.059 -1.194 2.377 1.00 . A A . 3 ALA N 1 1
12 2482 1 1 3 ALA O O -0.769 -2.671 2.760 1.00 . A A . 3 ALA O 1 1
12 2483 1 1 4 THR C C 2.461 -1.970 2.071 1.00 . A A . 4 THR C 1 1
12 2484 1 1 4 THR CA C 1.306 -2.193 1.114 1.00 . A A . 4 THR CA 1 1
12 2485 1 1 4 THR CB C 1.807 -2.075 -0.342 1.00 . A A . 4 THR CB 1 1
12 2486 1 1 4 THR CG2 C 0.732 -2.506 -1.322 1.00 . A A . 4 THR CG2 1 1
12 2487 1 1 4 THR H H 0.246 -0.417 0.897 1.00 . A A . 4 THR H 1 1
12 2488 1 1 4 THR HA H 0.918 -3.191 1.258 1.00 . A A . 4 THR HA 1 1
12 2489 1 1 4 THR HB H 2.669 -2.717 -0.459 1.00 . A A . 4 THR HB 1 1
12 2490 1 1 4 THR HG1 H 3.148 -0.671 -0.447 1.00 . A A . 4 THR HG1 1 1
12 2491 1 1 4 THR HG21 H 0.465 -3.535 -1.134 1.00 . A A . 4 THR HG21 1 1
12 2492 1 1 4 THR HG22 H 1.102 -2.410 -2.330 1.00 . A A . 4 THR HG22 1 1
12 2493 1 1 4 THR HG23 H -0.140 -1.881 -1.197 1.00 . A A . 4 THR HG23 1 1
12 2494 1 1 4 THR N N 0.251 -1.273 1.375 1.00 . A A . 4 THR N 1 1
12 2495 1 1 4 THR O O 2.927 -0.835 2.250 1.00 . A A . 4 THR O 1 1
12 2496 1 1 4 THR OG1 O 2.195 -0.719 -0.622 1.00 . A A . 4 THR OG1 1 1
12 2497 1 1 5 LYS C C 5.344 -2.927 2.678 1.00 . A A . 5 LYS C 1 1
12 2498 1 1 5 LYS CA C 4.095 -2.983 3.555 1.00 . A A . 5 LYS CA 1 1
12 2499 1 1 5 LYS CB C 4.173 -4.200 4.492 1.00 . A A . 5 LYS CB 1 1
12 2500 1 1 5 LYS CD C 4.553 -6.703 4.727 1.00 . A A . 5 LYS CD 1 1
12 2501 1 1 5 LYS CE C 5.845 -6.520 5.524 1.00 . A A . 5 LYS CE 1 1
12 2502 1 1 5 LYS CG C 4.314 -5.542 3.766 1.00 . A A . 5 LYS CG 1 1
12 2503 1 1 5 LYS H H 2.429 -3.891 2.612 1.00 . A A . 5 LYS H 1 1
12 2504 1 1 5 LYS HA H 4.034 -2.077 4.139 1.00 . A A . 5 LYS HA 1 1
12 2505 1 1 5 LYS HB2 H 5.029 -4.066 5.136 1.00 . A A . 5 LYS HB2 1 1
12 2506 1 1 5 LYS HB3 H 3.280 -4.232 5.098 1.00 . A A . 5 LYS HB3 1 1
12 2507 1 1 5 LYS HD2 H 3.720 -6.761 5.413 1.00 . A A . 5 LYS HD2 1 1
12 2508 1 1 5 LYS HD3 H 4.613 -7.619 4.159 1.00 . A A . 5 LYS HD3 1 1
12 2509 1 1 5 LYS HE2 H 6.669 -6.385 4.840 1.00 . A A . 5 LYS HE2 1 1
12 2510 1 1 5 LYS HE3 H 5.751 -5.641 6.141 1.00 . A A . 5 LYS HE3 1 1
12 2511 1 1 5 LYS HG2 H 3.410 -5.733 3.209 1.00 . A A . 5 LYS HG2 1 1
12 2512 1 1 5 LYS HG3 H 5.146 -5.474 3.081 1.00 . A A . 5 LYS HG3 1 1
12 2513 1 1 5 LYS HZ1 H 6.310 -8.544 5.851 1.00 . A A . 5 LYS HZ1 1 1
12 2514 1 1 5 LYS HZ2 H 5.333 -7.864 7.033 1.00 . A A . 5 LYS HZ2 1 1
12 2515 1 1 5 LYS HZ3 H 6.968 -7.501 6.993 1.00 . A A . 5 LYS HZ3 1 1
12 2516 1 1 5 LYS N N 2.920 -3.045 2.698 1.00 . A A . 5 LYS N 1 1
12 2517 1 1 5 LYS NZ N 6.134 -7.676 6.396 1.00 . A A . 5 LYS NZ 1 1
12 2518 1 1 5 LYS O O 6.454 -2.741 3.151 1.00 . A A . 5 LYS O 1 1
12 2519 1 1 6 SER C C 6.165 -1.685 -0.192 1.00 . A A . 6 SER C 1 1
12 2520 1 1 6 SER CA C 6.129 -3.082 0.415 1.00 . A A . 6 SER CA 1 1
12 2521 1 1 6 SER CB C 5.780 -4.123 -0.639 1.00 . A A . 6 SER CB 1 1
12 2522 1 1 6 SER H H 4.217 -3.303 1.093 1.00 . A A . 6 SER H 1 1
12 2523 1 1 6 SER HA H 7.080 -3.337 0.856 1.00 . A A . 6 SER HA 1 1
12 2524 1 1 6 SER HB2 H 6.385 -3.954 -1.519 1.00 . A A . 6 SER HB2 1 1
12 2525 1 1 6 SER HB3 H 5.963 -5.114 -0.253 1.00 . A A . 6 SER HB3 1 1
12 2526 1 1 6 SER HG H 3.968 -4.850 -0.779 1.00 . A A . 6 SER HG 1 1
12 2527 1 1 6 SER N N 5.126 -3.129 1.405 1.00 . A A . 6 SER N 1 1
12 2528 1 1 6 SER O O 5.118 -1.009 -0.275 1.00 . A A . 6 SER O 1 1
12 2529 1 1 6 SER OG O 4.398 -4.015 -1.004 1.00 . A A . 6 SER OG 1 1
12 2530 1 1 7 ILE C C 7.372 -0.107 -2.736 1.00 . A A . 7 ILE C 1 1
12 2531 1 1 7 ILE CA C 7.490 0.042 -1.216 1.00 . A A . 7 ILE CA 1 1
12 2532 1 1 7 ILE CB C 8.835 0.735 -0.842 1.00 . A A . 7 ILE CB 1 1
12 2533 1 1 7 ILE CD1 C 11.391 0.510 -0.979 1.00 . A A . 7 ILE CD1 1 1
12 2534 1 1 7 ILE CG1 C 10.045 -0.149 -1.204 1.00 . A A . 7 ILE CG1 1 1
12 2535 1 1 7 ILE CG2 C 8.848 1.094 0.641 1.00 . A A . 7 ILE CG2 1 1
12 2536 1 1 7 ILE H H 8.125 -1.815 -0.473 1.00 . A A . 7 ILE H 1 1
12 2537 1 1 7 ILE HA H 6.669 0.658 -0.876 1.00 . A A . 7 ILE HA 1 1
12 2538 1 1 7 ILE HB H 8.892 1.657 -1.401 1.00 . A A . 7 ILE HB 1 1
12 2539 1 1 7 ILE HD11 H 11.492 0.770 0.065 1.00 . A A . 7 ILE HD11 1 1
12 2540 1 1 7 ILE HD12 H 11.460 1.404 -1.582 1.00 . A A . 7 ILE HD12 1 1
12 2541 1 1 7 ILE HD13 H 12.179 -0.173 -1.257 1.00 . A A . 7 ILE HD13 1 1
12 2542 1 1 7 ILE HG12 H 10.017 -1.039 -0.595 1.00 . A A . 7 ILE HG12 1 1
12 2543 1 1 7 ILE HG13 H 9.978 -0.431 -2.245 1.00 . A A . 7 ILE HG13 1 1
12 2544 1 1 7 ILE HG21 H 8.036 1.771 0.858 1.00 . A A . 7 ILE HG21 1 1
12 2545 1 1 7 ILE HG22 H 9.786 1.567 0.889 1.00 . A A . 7 ILE HG22 1 1
12 2546 1 1 7 ILE HG23 H 8.734 0.195 1.229 1.00 . A A . 7 ILE HG23 1 1
12 2547 1 1 7 ILE N N 7.335 -1.246 -0.589 1.00 . A A . 7 ILE N 1 1
12 2548 1 1 7 ILE O O 7.852 -1.098 -3.304 1.00 . A A . 7 ILE O 1 1
12 2549 1 1 8 PRO C C 4.859 1.746 -2.032 1.00 . A A . 8 PRO C 1 1
12 2550 1 1 8 PRO CA C 6.152 2.047 -2.810 1.00 . A A . 8 PRO CA 1 1
12 2551 1 1 8 PRO CB C 5.850 2.942 -4.012 1.00 . A A . 8 PRO CB 1 1
12 2552 1 1 8 PRO CD C 6.516 0.825 -4.883 1.00 . A A . 8 PRO CD 1 1
12 2553 1 1 8 PRO CG C 5.605 1.992 -5.129 1.00 . A A . 8 PRO CG 1 1
12 2554 1 1 8 PRO HA H 6.872 2.531 -2.169 1.00 . A A . 8 PRO HA 1 1
12 2555 1 1 8 PRO HB2 H 4.979 3.544 -3.800 1.00 . A A . 8 PRO HB2 1 1
12 2556 1 1 8 PRO HB3 H 6.697 3.579 -4.213 1.00 . A A . 8 PRO HB3 1 1
12 2557 1 1 8 PRO HD2 H 6.038 -0.096 -5.184 1.00 . A A . 8 PRO HD2 1 1
12 2558 1 1 8 PRO HD3 H 7.449 0.953 -5.411 1.00 . A A . 8 PRO HD3 1 1
12 2559 1 1 8 PRO HG2 H 4.573 1.671 -5.115 1.00 . A A . 8 PRO HG2 1 1
12 2560 1 1 8 PRO HG3 H 5.838 2.459 -6.074 1.00 . A A . 8 PRO HG3 1 1
12 2561 1 1 8 PRO N N 6.733 0.846 -3.427 1.00 . A A . 8 PRO N 1 1
12 2562 1 1 8 PRO O O 4.072 0.874 -2.437 1.00 . A A . 8 PRO O 1 1
12 2563 1 1 9 PRO C C 2.199 2.744 -0.819 1.00 . A A . 9 PRO C 1 1
12 2564 1 1 9 PRO CA C 3.445 2.246 -0.081 1.00 . A A . 9 PRO CA 1 1
12 2565 1 1 9 PRO CB C 3.707 3.093 1.174 1.00 . A A . 9 PRO CB 1 1
12 2566 1 1 9 PRO CD C 5.571 3.384 -0.266 1.00 . A A . 9 PRO CD 1 1
12 2567 1 1 9 PRO CG C 5.169 3.350 1.172 1.00 . A A . 9 PRO CG 1 1
12 2568 1 1 9 PRO HA H 3.303 1.211 0.193 1.00 . A A . 9 PRO HA 1 1
12 2569 1 1 9 PRO HB2 H 3.146 4.015 1.107 1.00 . A A . 9 PRO HB2 1 1
12 2570 1 1 9 PRO HB3 H 3.401 2.548 2.054 1.00 . A A . 9 PRO HB3 1 1
12 2571 1 1 9 PRO HD2 H 5.438 4.375 -0.676 1.00 . A A . 9 PRO HD2 1 1
12 2572 1 1 9 PRO HD3 H 6.596 3.061 -0.355 1.00 . A A . 9 PRO HD3 1 1
12 2573 1 1 9 PRO HG2 H 5.378 4.301 1.642 1.00 . A A . 9 PRO HG2 1 1
12 2574 1 1 9 PRO HG3 H 5.685 2.552 1.686 1.00 . A A . 9 PRO HG3 1 1
12 2575 1 1 9 PRO N N 4.648 2.419 -0.885 1.00 . A A . 9 PRO N 1 1
12 2576 1 1 9 PRO O O 2.001 3.958 -1.022 1.00 . A A . 9 PRO O 1 1
12 2577 1 1 10 ARG C C -0.944 1.878 -1.035 1.00 . A A . 10 ARG C 1 1
12 2578 1 1 10 ARG CA C 0.197 2.123 -1.970 1.00 . A A . 10 ARG CA 1 1
12 2579 1 1 10 ARG CB C 0.061 1.233 -3.198 1.00 . A A . 10 ARG CB 1 1
12 2580 1 1 10 ARG CD C 1.079 0.403 -5.323 1.00 . A A . 10 ARG CD 1 1
12 2581 1 1 10 ARG CG C 1.237 1.331 -4.145 1.00 . A A . 10 ARG CG 1 1
12 2582 1 1 10 ARG CZ C 1.562 -2.040 -5.378 1.00 . A A . 10 ARG CZ 1 1
12 2583 1 1 10 ARG H H 1.644 0.876 -1.120 1.00 . A A . 10 ARG H 1 1
12 2584 1 1 10 ARG HA H 0.219 3.158 -2.275 1.00 . A A . 10 ARG HA 1 1
12 2585 1 1 10 ARG HB2 H -0.028 0.208 -2.872 1.00 . A A . 10 ARG HB2 1 1
12 2586 1 1 10 ARG HB3 H -0.833 1.512 -3.735 1.00 . A A . 10 ARG HB3 1 1
12 2587 1 1 10 ARG HD2 H 0.220 0.716 -5.898 1.00 . A A . 10 ARG HD2 1 1
12 2588 1 1 10 ARG HD3 H 1.968 0.471 -5.930 1.00 . A A . 10 ARG HD3 1 1
12 2589 1 1 10 ARG HE H 0.174 -1.133 -4.243 1.00 . A A . 10 ARG HE 1 1
12 2590 1 1 10 ARG HG2 H 1.312 2.347 -4.505 1.00 . A A . 10 ARG HG2 1 1
12 2591 1 1 10 ARG HG3 H 2.139 1.074 -3.609 1.00 . A A . 10 ARG HG3 1 1
12 2592 1 1 10 ARG HH11 H 2.794 -0.979 -6.628 1.00 . A A . 10 ARG HH11 1 1
12 2593 1 1 10 ARG HH12 H 3.045 -2.665 -6.628 1.00 . A A . 10 ARG HH12 1 1
12 2594 1 1 10 ARG HH21 H 0.513 -3.388 -4.283 1.00 . A A . 10 ARG HH21 1 1
12 2595 1 1 10 ARG HH22 H 1.728 -4.083 -5.255 1.00 . A A . 10 ARG HH22 1 1
12 2596 1 1 10 ARG N N 1.409 1.822 -1.270 1.00 . A A . 10 ARG N 1 1
12 2597 1 1 10 ARG NE N 0.886 -0.988 -4.908 1.00 . A A . 10 ARG NE 1 1
12 2598 1 1 10 ARG NH1 N 2.531 -1.880 -6.275 1.00 . A A . 10 ARG NH1 1 1
12 2599 1 1 10 ARG NH2 N 1.252 -3.255 -4.950 1.00 . A A . 10 ARG NH2 1 1
12 2600 1 1 10 ARG O O -1.139 0.751 -0.575 1.00 . A A . 10 ARG O 1 1
12 2601 1 1 11 ALA C C -4.035 3.133 -0.435 1.00 . A A . 11 ALA C 1 1
12 2602 1 1 11 ALA CA C -2.746 2.767 0.212 1.00 . A A . 11 ALA CA 1 1
12 2603 1 1 11 ALA CB C -2.553 3.569 1.509 1.00 . A A . 11 ALA CB 1 1
12 2604 1 1 11 ALA H H -1.483 3.791 -1.097 1.00 . A A . 11 ALA H 1 1
12 2605 1 1 11 ALA HA H -2.795 1.719 0.468 1.00 . A A . 11 ALA HA 1 1
12 2606 1 1 11 ALA HB1 H -3.334 3.282 2.195 1.00 . A A . 11 ALA HB1 1 1
12 2607 1 1 11 ALA HB2 H -2.635 4.630 1.353 1.00 . A A . 11 ALA HB2 1 1
12 2608 1 1 11 ALA N N -1.665 2.912 -0.706 1.00 . A A . 11 ALA N 1 1
12 2609 1 1 11 ALA O O -4.084 4.001 -1.319 1.00 . A A . 11 ALA O 1 1
12 2610 1 1 12 PHE C C -7.320 2.806 0.660 1.00 . A A . 12 PHE C 1 1
12 2611 1 1 12 PHE CA C -6.371 2.670 -0.526 1.00 . A A . 12 PHE CA 1 1
12 2612 1 1 12 PHE CB C -6.772 1.493 -1.434 1.00 . A A . 12 PHE CB 1 1
12 2613 1 1 12 PHE CD1 C -6.004 1.956 -3.785 1.00 . A A . 12 PHE CD1 1 1
12 2614 1 1 12 PHE CD2 C -4.788 0.356 -2.514 1.00 . A A . 12 PHE CD2 1 1
12 2615 1 1 12 PHE CE1 C -5.152 1.755 -4.854 1.00 . A A . 12 PHE CE1 1 1
12 2616 1 1 12 PHE CE2 C -3.935 0.152 -3.575 1.00 . A A . 12 PHE CE2 1 1
12 2617 1 1 12 PHE CG C -5.837 1.263 -2.605 1.00 . A A . 12 PHE CG 1 1
12 2618 1 1 12 PHE CZ C -4.115 0.851 -4.748 1.00 . A A . 12 PHE CZ 1 1
12 2619 1 1 12 PHE H H -4.923 1.827 0.714 1.00 . A A . 12 PHE H 1 1
12 2620 1 1 12 PHE HA H -6.372 3.586 -1.097 1.00 . A A . 12 PHE HA 1 1
12 2621 1 1 12 PHE HB2 H -6.827 0.588 -0.850 1.00 . A A . 12 PHE HB2 1 1
12 2622 1 1 12 PHE HB3 H -7.754 1.694 -1.833 1.00 . A A . 12 PHE HB3 1 1
12 2623 1 1 12 PHE HD1 H -6.815 2.665 -3.871 1.00 . A A . 12 PHE HD1 1 1
12 2624 1 1 12 PHE HD2 H -4.638 -0.197 -1.599 1.00 . A A . 12 PHE HD2 1 1
12 2625 1 1 12 PHE HE1 H -5.297 2.306 -5.772 1.00 . A A . 12 PHE HE1 1 1
12 2626 1 1 12 PHE HE2 H -3.125 -0.557 -3.484 1.00 . A A . 12 PHE HE2 1 1
12 2627 1 1 12 PHE HZ H -3.448 0.692 -5.583 1.00 . A A . 12 PHE HZ 1 1
12 2628 1 1 12 PHE N N -5.060 2.477 -0.014 1.00 . A A . 12 PHE N 1 1
12 2629 1 1 12 PHE O O -7.227 2.025 1.630 1.00 . A A . 12 PHE O 1 1
12 2630 1 1 13 PRO C C -10.141 3.038 2.135 1.00 . A A . 13 PRO C 1 1
12 2631 1 1 13 PRO CA C -9.161 4.138 1.715 1.00 . A A . 13 PRO CA 1 1
12 2632 1 1 13 PRO CB C -9.931 5.344 1.166 1.00 . A A . 13 PRO CB 1 1
12 2633 1 1 13 PRO CD C -8.541 4.590 -0.603 1.00 . A A . 13 PRO CD 1 1
12 2634 1 1 13 PRO CG C -9.889 5.164 -0.310 1.00 . A A . 13 PRO CG 1 1
12 2635 1 1 13 PRO HA H -8.594 4.449 2.579 1.00 . A A . 13 PRO HA 1 1
12 2636 1 1 13 PRO HB2 H -10.945 5.324 1.543 1.00 . A A . 13 PRO HB2 1 1
12 2637 1 1 13 PRO HB3 H -9.446 6.259 1.466 1.00 . A A . 13 PRO HB3 1 1
12 2638 1 1 13 PRO HD2 H -8.571 3.980 -1.494 1.00 . A A . 13 PRO HD2 1 1
12 2639 1 1 13 PRO HD3 H -7.809 5.376 -0.707 1.00 . A A . 13 PRO HD3 1 1
12 2640 1 1 13 PRO HG2 H -10.665 4.478 -0.619 1.00 . A A . 13 PRO HG2 1 1
12 2641 1 1 13 PRO HG3 H -10.007 6.114 -0.808 1.00 . A A . 13 PRO HG3 1 1
12 2642 1 1 13 PRO N N -8.263 3.770 0.591 1.00 . A A . 13 PRO N 1 1
12 2643 1 1 13 PRO O O -10.886 3.200 3.108 1.00 . A A . 13 PRO O 1 1
12 2644 1 1 14 ASP C C -10.330 -0.154 2.676 1.00 . A A . 14 ASP C 1 1
12 2645 1 1 14 ASP CA C -11.018 0.823 1.727 1.00 . A A . 14 ASP CA 1 1
12 2646 1 1 14 ASP CB C -11.490 0.106 0.452 1.00 . A A . 14 ASP CB 1 1
12 2647 1 1 14 ASP CG C -10.363 -0.483 -0.355 1.00 . A A . 14 ASP CG 1 1
12 2648 1 1 14 ASP H H -9.549 1.878 0.640 1.00 . A A . 14 ASP H 1 1
12 2649 1 1 14 ASP HA H -11.879 1.227 2.238 1.00 . A A . 14 ASP HA 1 1
12 2650 1 1 14 ASP HB2 H -12.159 -0.696 0.729 1.00 . A A . 14 ASP HB2 1 1
12 2651 1 1 14 ASP HB3 H -12.025 0.809 -0.167 1.00 . A A . 14 ASP HB3 1 1
12 2652 1 1 14 ASP N N -10.148 1.945 1.417 1.00 . A A . 14 ASP N 1 1
12 2653 1 1 14 ASP O O -10.919 -1.159 3.087 1.00 . A A . 14 ASP O 1 1
12 2654 1 1 14 ASP OD1 O -10.192 -1.709 -0.358 1.00 . A A . 14 ASP OD1 1 1
12 2655 1 1 14 ASP OD2 O -9.635 0.279 -1.009 1.00 . A A . 14 ASP OD2 1 1
12 2656 2 2 1 . C C -1.966 1.637 3.771 1.00 . B A . 101 WMH C 1 1
12 2657 2 2 1 . C1 C -1.247 3.339 2.192 1.00 . B A . 101 WMH C1 1 1
12 2658 2 2 1 . C2 C -0.069 3.930 1.886 1.00 . B A . 101 WMH C2 1 1
12 2659 2 2 1 . H1 H -2.225 2.042 4.736 1.00 . B A . 101 WMH H1 1 1
12 2660 2 2 1 . H2 H -2.855 1.681 3.164 1.00 . B A . 101 WMH H2 1 1
12 2661 2 2 1 . H5 H 0.087 4.682 1.128 1.00 . B A . 101 WMH H5 1 1
12 2662 2 2 1 . N N -1.027 2.476 3.165 1.00 . B A . 101 WMH N 1 1
12 2663 2 2 1 . N1 N 0.864 3.425 2.679 1.00 . B A . 101 WMH N1 1 1
12 2664 2 2 1 . N2 N 0.336 2.550 3.463 1.00 . B A . 101 WMH N2 1 1
13 2665 1 1 1 GLY C C -7.520 -1.335 3.837 1.00 . A A . 1 GLY C 1 1
13 2666 1 1 1 GLY CA C -8.614 -0.346 4.130 1.00 . A A . 1 GLY CA 1 1
13 2667 1 1 1 GLY H1 H -8.724 0.957 2.475 1.00 . A A . 1 GLY H1 1 1
13 2668 1 1 1 GLY HA2 H -8.201 0.453 4.728 1.00 . A A . 1 GLY HA2 1 1
13 2669 1 1 1 GLY HA3 H -9.391 -0.831 4.698 1.00 . A A . 1 GLY HA3 1 1
13 2670 1 1 1 GLY N N -9.189 0.227 2.939 1.00 . A A . 1 GLY N 1 1
13 2671 1 1 1 GLY O O -7.561 -2.485 4.305 1.00 . A A . 1 GLY O 1 1
13 2672 1 1 2 ARG C C -4.222 -0.829 2.394 1.00 . A A . 2 ARG C 1 1
13 2673 1 1 2 ARG CA C -5.410 -1.722 2.728 1.00 . A A . 2 ARG CA 1 1
13 2674 1 1 2 ARG CB C -5.726 -2.700 1.589 1.00 . A A . 2 ARG CB 1 1
13 2675 1 1 2 ARG CD C -6.674 -3.027 -0.701 1.00 . A A . 2 ARG CD 1 1
13 2676 1 1 2 ARG CG C -6.259 -2.032 0.352 1.00 . A A . 2 ARG CG 1 1
13 2677 1 1 2 ARG CZ C -5.593 -4.462 -2.381 1.00 . A A . 2 ARG CZ 1 1
13 2678 1 1 2 ARG H H -6.610 -0.006 2.681 1.00 . A A . 2 ARG H 1 1
13 2679 1 1 2 ARG HA H -5.167 -2.281 3.620 1.00 . A A . 2 ARG HA 1 1
13 2680 1 1 2 ARG HB2 H -4.824 -3.230 1.325 1.00 . A A . 2 ARG HB2 1 1
13 2681 1 1 2 ARG HB3 H -6.461 -3.412 1.934 1.00 . A A . 2 ARG HB3 1 1
13 2682 1 1 2 ARG HD2 H -7.389 -3.714 -0.275 1.00 . A A . 2 ARG HD2 1 1
13 2683 1 1 2 ARG HD3 H -7.144 -2.490 -1.512 1.00 . A A . 2 ARG HD3 1 1
13 2684 1 1 2 ARG HE H -4.748 -3.815 -0.674 1.00 . A A . 2 ARG HE 1 1
13 2685 1 1 2 ARG HG2 H -7.112 -1.425 0.618 1.00 . A A . 2 ARG HG2 1 1
13 2686 1 1 2 ARG HG3 H -5.473 -1.409 -0.044 1.00 . A A . 2 ARG HG3 1 1
13 2687 1 1 2 ARG HH11 H -7.495 -3.873 -2.908 1.00 . A A . 2 ARG HH11 1 1
13 2688 1 1 2 ARG HH12 H -6.732 -4.921 -4.018 1.00 . A A . 2 ARG HH12 1 1
13 2689 1 1 2 ARG HH21 H -3.716 -5.220 -2.182 1.00 . A A . 2 ARG HH21 1 1
13 2690 1 1 2 ARG HH22 H -4.508 -5.680 -3.623 1.00 . A A . 2 ARG HH22 1 1
13 2691 1 1 2 ARG N N -6.558 -0.911 3.056 1.00 . A A . 2 ARG N 1 1
13 2692 1 1 2 ARG NE N -5.559 -3.797 -1.232 1.00 . A A . 2 ARG NE 1 1
13 2693 1 1 2 ARG NH1 N -6.683 -4.411 -3.158 1.00 . A A . 2 ARG NH1 1 1
13 2694 1 1 2 ARG NH2 N -4.539 -5.173 -2.757 1.00 . A A . 2 ARG NH2 1 1
13 2695 1 1 2 ARG O O -4.392 0.275 1.849 1.00 . A A . 2 ARG O 1 1
13 2696 1 1 3 ALA C C -0.706 -1.507 2.232 1.00 . A A . 3 ALA C 1 1
13 2697 1 1 3 ALA CA C -1.812 -0.553 2.578 1.00 . A A . 3 ALA CA 1 1
13 2698 1 1 3 ALA CB C -1.460 0.198 3.872 1.00 . A A . 3 ALA CB 1 1
13 2699 1 1 3 ALA H H -2.998 -2.156 3.199 1.00 . A A . 3 ALA H 1 1
13 2700 1 1 3 ALA HA H -1.934 0.167 1.785 1.00 . A A . 3 ALA HA 1 1
13 2701 1 1 3 ALA HB1 H -0.386 0.250 3.959 1.00 . A A . 3 ALA HB1 1 1
13 2702 1 1 3 ALA HB2 H -1.851 -0.357 4.711 1.00 . A A . 3 ALA HB2 1 1
13 2703 1 1 3 ALA N N -3.055 -1.277 2.764 1.00 . A A . 3 ALA N 1 1
13 2704 1 1 3 ALA O O -0.576 -2.560 2.859 1.00 . A A . 3 ALA O 1 1
13 2705 1 1 4 THR C C 2.363 -1.639 1.797 1.00 . A A . 4 THR C 1 1
13 2706 1 1 4 THR CA C 1.182 -1.999 0.912 1.00 . A A . 4 THR CA 1 1
13 2707 1 1 4 THR CB C 1.571 -1.881 -0.590 1.00 . A A . 4 THR CB 1 1
13 2708 1 1 4 THR CG2 C 0.458 -2.405 -1.487 1.00 . A A . 4 THR CG2 1 1
13 2709 1 1 4 THR H H -0.077 -0.357 0.726 1.00 . A A . 4 THR H 1 1
13 2710 1 1 4 THR HA H 0.901 -3.022 1.122 1.00 . A A . 4 THR HA 1 1
13 2711 1 1 4 THR HB H 2.459 -2.474 -0.749 1.00 . A A . 4 THR HB 1 1
13 2712 1 1 4 THR HG1 H 2.742 -0.457 -1.293 1.00 . A A . 4 THR HG1 1 1
13 2713 1 1 4 THR HG21 H -0.444 -1.840 -1.306 1.00 . A A . 4 THR HG21 1 1
13 2714 1 1 4 THR HG22 H 0.281 -3.448 -1.274 1.00 . A A . 4 THR HG22 1 1
13 2715 1 1 4 THR HG23 H 0.749 -2.294 -2.520 1.00 . A A . 4 THR HG23 1 1
13 2716 1 1 4 THR N N 0.075 -1.175 1.252 1.00 . A A . 4 THR N 1 1
13 2717 1 1 4 THR O O 2.726 -0.465 1.927 1.00 . A A . 4 THR O 1 1
13 2718 1 1 4 THR OG1 O 1.847 -0.519 -0.930 1.00 . A A . 4 THR OG1 1 1
13 2719 1 1 5 LYS C C 5.298 -2.525 2.351 1.00 . A A . 5 LYS C 1 1
13 2720 1 1 5 LYS CA C 4.097 -2.405 3.260 1.00 . A A . 5 LYS CA 1 1
13 2721 1 1 5 LYS CB C 4.180 -3.396 4.424 1.00 . A A . 5 LYS CB 1 1
13 2722 1 1 5 LYS CD C 3.058 -1.893 6.118 1.00 . A A . 5 LYS CD 1 1
13 2723 1 1 5 LYS CE C 2.030 -1.805 7.245 1.00 . A A . 5 LYS CE 1 1
13 2724 1 1 5 LYS CG C 3.054 -3.264 5.449 1.00 . A A . 5 LYS CG 1 1
13 2725 1 1 5 LYS H H 2.496 -3.512 2.432 1.00 . A A . 5 LYS H 1 1
13 2726 1 1 5 LYS HA H 4.059 -1.395 3.641 1.00 . A A . 5 LYS HA 1 1
13 2727 1 1 5 LYS HB2 H 4.153 -4.398 4.024 1.00 . A A . 5 LYS HB2 1 1
13 2728 1 1 5 LYS HB3 H 5.119 -3.249 4.932 1.00 . A A . 5 LYS HB3 1 1
13 2729 1 1 5 LYS HD2 H 4.041 -1.711 6.524 1.00 . A A . 5 LYS HD2 1 1
13 2730 1 1 5 LYS HD3 H 2.832 -1.141 5.376 1.00 . A A . 5 LYS HD3 1 1
13 2731 1 1 5 LYS HE2 H 2.037 -0.800 7.640 1.00 . A A . 5 LYS HE2 1 1
13 2732 1 1 5 LYS HE3 H 1.053 -2.020 6.840 1.00 . A A . 5 LYS HE3 1 1
13 2733 1 1 5 LYS HG2 H 2.108 -3.403 4.946 1.00 . A A . 5 LYS HG2 1 1
13 2734 1 1 5 LYS HG3 H 3.175 -4.027 6.201 1.00 . A A . 5 LYS HG3 1 1
13 2735 1 1 5 LYS HZ1 H 1.573 -2.705 9.072 1.00 . A A . 5 LYS HZ1 1 1
13 2736 1 1 5 LYS HZ2 H 3.219 -2.527 8.827 1.00 . A A . 5 LYS HZ2 1 1
13 2737 1 1 5 LYS HZ3 H 2.370 -3.738 8.022 1.00 . A A . 5 LYS HZ3 1 1
13 2738 1 1 5 LYS N N 2.907 -2.622 2.468 1.00 . A A . 5 LYS N 1 1
13 2739 1 1 5 LYS NZ N 2.322 -2.753 8.351 1.00 . A A . 5 LYS NZ 1 1
13 2740 1 1 5 LYS O O 6.401 -2.065 2.670 1.00 . A A . 5 LYS O 1 1
13 2741 1 1 6 SER C C 6.125 -1.936 -0.522 1.00 . A A . 6 SER C 1 1
13 2742 1 1 6 SER CA C 6.005 -3.273 0.168 1.00 . A A . 6 SER CA 1 1
13 2743 1 1 6 SER CB C 5.488 -4.316 -0.817 1.00 . A A . 6 SER CB 1 1
13 2744 1 1 6 SER H H 4.161 -3.510 1.055 1.00 . A A . 6 SER H 1 1
13 2745 1 1 6 SER HA H 6.953 -3.596 0.568 1.00 . A A . 6 SER HA 1 1
13 2746 1 1 6 SER HB2 H 6.137 -4.361 -1.679 1.00 . A A . 6 SER HB2 1 1
13 2747 1 1 6 SER HB3 H 5.458 -5.281 -0.334 1.00 . A A . 6 SER HB3 1 1
13 2748 1 1 6 SER HG H 4.223 -3.087 -1.602 1.00 . A A . 6 SER HG 1 1
13 2749 1 1 6 SER N N 5.052 -3.139 1.212 1.00 . A A . 6 SER N 1 1
13 2750 1 1 6 SER O O 5.115 -1.234 -0.675 1.00 . A A . 6 SER O 1 1
13 2751 1 1 6 SER OG O 4.165 -3.983 -1.247 1.00 . A A . 6 SER OG 1 1
13 2752 1 1 7 ILE C C 7.005 -0.395 -3.040 1.00 . A A . 7 ILE C 1 1
13 2753 1 1 7 ILE CA C 7.513 -0.326 -1.595 1.00 . A A . 7 ILE CA 1 1
13 2754 1 1 7 ILE CB C 8.997 0.127 -1.549 1.00 . A A . 7 ILE CB 1 1
13 2755 1 1 7 ILE CD1 C 11.368 -0.508 -2.288 1.00 . A A . 7 ILE CD1 1 1
13 2756 1 1 7 ILE CG1 C 9.924 -0.938 -2.163 1.00 . A A . 7 ILE CG1 1 1
13 2757 1 1 7 ILE CG2 C 9.400 0.433 -0.108 1.00 . A A . 7 ILE CG2 1 1
13 2758 1 1 7 ILE H H 8.047 -2.219 -0.823 1.00 . A A . 7 ILE H 1 1
13 2759 1 1 7 ILE HA H 6.910 0.397 -1.064 1.00 . A A . 7 ILE HA 1 1
13 2760 1 1 7 ILE HB H 9.083 1.044 -2.116 1.00 . A A . 7 ILE HB 1 1
13 2761 1 1 7 ILE HD11 H 11.954 -1.317 -2.697 1.00 . A A . 7 ILE HD11 1 1
13 2762 1 1 7 ILE HD12 H 11.745 -0.236 -1.313 1.00 . A A . 7 ILE HD12 1 1
13 2763 1 1 7 ILE HD13 H 11.433 0.348 -2.944 1.00 . A A . 7 ILE HD13 1 1
13 2764 1 1 7 ILE HG12 H 9.904 -1.817 -1.536 1.00 . A A . 7 ILE HG12 1 1
13 2765 1 1 7 ILE HG13 H 9.561 -1.197 -3.146 1.00 . A A . 7 ILE HG13 1 1
13 2766 1 1 7 ILE HG21 H 10.437 0.734 -0.081 1.00 . A A . 7 ILE HG21 1 1
13 2767 1 1 7 ILE HG22 H 9.266 -0.452 0.497 1.00 . A A . 7 ILE HG22 1 1
13 2768 1 1 7 ILE HG23 H 8.783 1.229 0.281 1.00 . A A . 7 ILE HG23 1 1
13 2769 1 1 7 ILE N N 7.305 -1.586 -0.936 1.00 . A A . 7 ILE N 1 1
13 2770 1 1 7 ILE O O 7.161 -1.424 -3.703 1.00 . A A . 7 ILE O 1 1
13 2771 1 1 8 PRO C C 4.817 1.684 -1.889 1.00 . A A . 8 PRO C 1 1
13 2772 1 1 8 PRO CA C 6.060 1.869 -2.770 1.00 . A A . 8 PRO CA 1 1
13 2773 1 1 8 PRO CB C 5.775 2.926 -3.860 1.00 . A A . 8 PRO CB 1 1
13 2774 1 1 8 PRO CD C 5.779 0.746 -4.871 1.00 . A A . 8 PRO CD 1 1
13 2775 1 1 8 PRO CG C 5.898 2.209 -5.174 1.00 . A A . 8 PRO CG 1 1
13 2776 1 1 8 PRO HA H 6.912 2.169 -2.181 1.00 . A A . 8 PRO HA 1 1
13 2777 1 1 8 PRO HB2 H 4.782 3.326 -3.719 1.00 . A A . 8 PRO HB2 1 1
13 2778 1 1 8 PRO HB3 H 6.500 3.722 -3.777 1.00 . A A . 8 PRO HB3 1 1
13 2779 1 1 8 PRO HD2 H 4.743 0.441 -4.873 1.00 . A A . 8 PRO HD2 1 1
13 2780 1 1 8 PRO HD3 H 6.349 0.152 -5.569 1.00 . A A . 8 PRO HD3 1 1
13 2781 1 1 8 PRO HG2 H 5.102 2.518 -5.838 1.00 . A A . 8 PRO HG2 1 1
13 2782 1 1 8 PRO HG3 H 6.858 2.426 -5.619 1.00 . A A . 8 PRO HG3 1 1
13 2783 1 1 8 PRO N N 6.341 0.658 -3.533 1.00 . A A . 8 PRO N 1 1
13 2784 1 1 8 PRO O O 3.863 0.996 -2.297 1.00 . A A . 8 PRO O 1 1
13 2785 1 1 9 PRO C C 2.471 2.911 -0.355 1.00 . A A . 9 PRO C 1 1
13 2786 1 1 9 PRO CA C 3.665 2.163 0.227 1.00 . A A . 9 PRO CA 1 1
13 2787 1 1 9 PRO CB C 4.145 2.833 1.527 1.00 . A A . 9 PRO CB 1 1
13 2788 1 1 9 PRO CD C 5.927 2.984 -0.043 1.00 . A A . 9 PRO CD 1 1
13 2789 1 1 9 PRO CG C 5.629 2.855 1.420 1.00 . A A . 9 PRO CG 1 1
13 2790 1 1 9 PRO HA H 3.387 1.136 0.414 1.00 . A A . 9 PRO HA 1 1
13 2791 1 1 9 PRO HB2 H 3.735 3.830 1.589 1.00 . A A . 9 PRO HB2 1 1
13 2792 1 1 9 PRO HB3 H 3.819 2.252 2.379 1.00 . A A . 9 PRO HB3 1 1
13 2793 1 1 9 PRO HD2 H 5.927 4.023 -0.341 1.00 . A A . 9 PRO HD2 1 1
13 2794 1 1 9 PRO HD3 H 6.877 2.522 -0.261 1.00 . A A . 9 PRO HD3 1 1
13 2795 1 1 9 PRO HG2 H 6.028 3.698 1.963 1.00 . A A . 9 PRO HG2 1 1
13 2796 1 1 9 PRO HG3 H 6.038 1.932 1.804 1.00 . A A . 9 PRO HG3 1 1
13 2797 1 1 9 PRO N N 4.816 2.245 -0.665 1.00 . A A . 9 PRO N 1 1
13 2798 1 1 9 PRO O O 2.439 4.148 -0.383 1.00 . A A . 9 PRO O 1 1
13 2799 1 1 10 ARG C C -0.788 2.315 -0.600 1.00 . A A . 10 ARG C 1 1
13 2800 1 1 10 ARG CA C 0.359 2.693 -1.466 1.00 . A A . 10 ARG CA 1 1
13 2801 1 1 10 ARG CB C 0.141 2.135 -2.867 1.00 . A A . 10 ARG CB 1 1
13 2802 1 1 10 ARG CD C 0.924 1.900 -5.221 1.00 . A A . 10 ARG CD 1 1
13 2803 1 1 10 ARG CG C 1.216 2.509 -3.866 1.00 . A A . 10 ARG CG 1 1
13 2804 1 1 10 ARG CZ C -1.042 1.720 -6.748 1.00 . A A . 10 ARG CZ 1 1
13 2805 1 1 10 ARG H H 1.653 1.188 -0.870 1.00 . A A . 10 ARG H 1 1
13 2806 1 1 10 ARG HA H 0.456 3.767 -1.520 1.00 . A A . 10 ARG HA 1 1
13 2807 1 1 10 ARG HB2 H 0.104 1.058 -2.804 1.00 . A A . 10 ARG HB2 1 1
13 2808 1 1 10 ARG HB3 H -0.808 2.493 -3.238 1.00 . A A . 10 ARG HB3 1 1
13 2809 1 1 10 ARG HD2 H 1.700 2.213 -5.904 1.00 . A A . 10 ARG HD2 1 1
13 2810 1 1 10 ARG HD3 H 0.934 0.824 -5.131 1.00 . A A . 10 ARG HD3 1 1
13 2811 1 1 10 ARG HE H -0.754 3.130 -5.325 1.00 . A A . 10 ARG HE 1 1
13 2812 1 1 10 ARG HG2 H 1.251 3.584 -3.960 1.00 . A A . 10 ARG HG2 1 1
13 2813 1 1 10 ARG HG3 H 2.169 2.145 -3.511 1.00 . A A . 10 ARG HG3 1 1
13 2814 1 1 10 ARG HH11 H 0.363 0.268 -7.060 1.00 . A A . 10 ARG HH11 1 1
13 2815 1 1 10 ARG HH12 H -1.010 0.164 -8.062 1.00 . A A . 10 ARG HH12 1 1
13 2816 1 1 10 ARG HH21 H -2.662 2.993 -6.733 1.00 . A A . 10 ARG HH21 1 1
13 2817 1 1 10 ARG HH22 H -2.733 1.739 -7.894 1.00 . A A . 10 ARG HH22 1 1
13 2818 1 1 10 ARG N N 1.547 2.167 -0.881 1.00 . A A . 10 ARG N 1 1
13 2819 1 1 10 ARG NE N -0.379 2.329 -5.758 1.00 . A A . 10 ARG NE 1 1
13 2820 1 1 10 ARG NH1 N -0.524 0.650 -7.330 1.00 . A A . 10 ARG NH1 1 1
13 2821 1 1 10 ARG NH2 N -2.228 2.188 -7.149 1.00 . A A . 10 ARG NH2 1 1
13 2822 1 1 10 ARG O O -0.907 1.149 -0.186 1.00 . A A . 10 ARG O 1 1
13 2823 1 1 11 ALA C C -3.987 3.217 -0.148 1.00 . A A . 11 ALA C 1 1
13 2824 1 1 11 ALA CA C -2.710 2.979 0.560 1.00 . A A . 11 ALA CA 1 1
13 2825 1 1 11 ALA CB C -2.644 3.724 1.896 1.00 . A A . 11 ALA CB 1 1
13 2826 1 1 11 ALA H H -1.472 4.167 -0.631 1.00 . A A . 11 ALA H 1 1
13 2827 1 1 11 ALA HA H -2.657 1.921 0.765 1.00 . A A . 11 ALA HA 1 1
13 2828 1 1 11 ALA HB1 H -3.438 3.371 2.535 1.00 . A A . 11 ALA HB1 1 1
13 2829 1 1 11 ALA HB2 H -2.769 4.786 1.774 1.00 . A A . 11 ALA HB2 1 1
13 2830 1 1 11 ALA N N -1.609 3.261 -0.282 1.00 . A A . 11 ALA N 1 1
13 2831 1 1 11 ALA O O -4.154 4.209 -0.866 1.00 . A A . 11 ALA O 1 1
13 2832 1 1 12 PHE C C -7.171 2.561 0.440 1.00 . A A . 12 PHE C 1 1
13 2833 1 1 12 PHE CA C -6.121 2.341 -0.627 1.00 . A A . 12 PHE CA 1 1
13 2834 1 1 12 PHE CB C -6.370 1.037 -1.380 1.00 . A A . 12 PHE CB 1 1
13 2835 1 1 12 PHE CD1 C -4.207 -0.058 -2.094 1.00 . A A . 12 PHE CD1 1 1
13 2836 1 1 12 PHE CD2 C -5.471 1.137 -3.725 1.00 . A A . 12 PHE CD2 1 1
13 2837 1 1 12 PHE CE1 C -3.259 -0.368 -3.046 1.00 . A A . 12 PHE CE1 1 1
13 2838 1 1 12 PHE CE2 C -4.523 0.830 -4.680 1.00 . A A . 12 PHE CE2 1 1
13 2839 1 1 12 PHE CG C -5.328 0.701 -2.421 1.00 . A A . 12 PHE CG 1 1
13 2840 1 1 12 PHE CZ C -3.419 0.079 -4.340 1.00 . A A . 12 PHE CZ 1 1
13 2841 1 1 12 PHE H H -4.657 1.546 0.611 1.00 . A A . 12 PHE H 1 1
13 2842 1 1 12 PHE HA H -6.120 3.166 -1.325 1.00 . A A . 12 PHE HA 1 1
13 2843 1 1 12 PHE HB2 H -6.410 0.227 -0.670 1.00 . A A . 12 PHE HB2 1 1
13 2844 1 1 12 PHE HB3 H -7.325 1.101 -1.878 1.00 . A A . 12 PHE HB3 1 1
13 2845 1 1 12 PHE HD1 H -4.073 -0.408 -1.082 1.00 . A A . 12 PHE HD1 1 1
13 2846 1 1 12 PHE HD2 H -6.336 1.725 -3.997 1.00 . A A . 12 PHE HD2 1 1
13 2847 1 1 12 PHE HE1 H -2.394 -0.956 -2.780 1.00 . A A . 12 PHE HE1 1 1
13 2848 1 1 12 PHE HE2 H -4.645 1.179 -5.695 1.00 . A A . 12 PHE HE2 1 1
13 2849 1 1 12 PHE HZ H -2.676 -0.161 -5.089 1.00 . A A . 12 PHE HZ 1 1
13 2850 1 1 12 PHE N N -4.860 2.298 0.009 1.00 . A A . 12 PHE N 1 1
13 2851 1 1 12 PHE O O -7.172 1.856 1.468 1.00 . A A . 12 PHE O 1 1
13 2852 1 1 13 PRO C C -10.129 2.831 1.552 1.00 . A A . 13 PRO C 1 1
13 2853 1 1 13 PRO CA C -9.107 3.927 1.212 1.00 . A A . 13 PRO CA 1 1
13 2854 1 1 13 PRO CB C -9.801 5.116 0.542 1.00 . A A . 13 PRO CB 1 1
13 2855 1 1 13 PRO CD C -8.167 4.349 -0.999 1.00 . A A . 13 PRO CD 1 1
13 2856 1 1 13 PRO CG C -9.536 4.938 -0.907 1.00 . A A . 13 PRO CG 1 1
13 2857 1 1 13 PRO HA H -8.646 4.261 2.130 1.00 . A A . 13 PRO HA 1 1
13 2858 1 1 13 PRO HB2 H -10.857 5.088 0.759 1.00 . A A . 13 PRO HB2 1 1
13 2859 1 1 13 PRO HB3 H -9.376 6.039 0.908 1.00 . A A . 13 PRO HB3 1 1
13 2860 1 1 13 PRO HD2 H -8.082 3.737 -1.886 1.00 . A A . 13 PRO HD2 1 1
13 2861 1 1 13 PRO HD3 H -7.417 5.126 -0.998 1.00 . A A . 13 PRO HD3 1 1
13 2862 1 1 13 PRO HG2 H -10.264 4.266 -1.335 1.00 . A A . 13 PRO HG2 1 1
13 2863 1 1 13 PRO HG3 H -9.567 5.895 -1.408 1.00 . A A . 13 PRO HG3 1 1
13 2864 1 1 13 PRO N N -8.078 3.529 0.226 1.00 . A A . 13 PRO N 1 1
13 2865 1 1 13 PRO O O -11.023 3.035 2.374 1.00 . A A . 13 PRO O 1 1
13 2866 1 1 14 ASP C C -10.333 -0.220 2.445 1.00 . A A . 14 ASP C 1 1
13 2867 1 1 14 ASP CA C -10.885 0.558 1.247 1.00 . A A . 14 ASP CA 1 1
13 2868 1 1 14 ASP CB C -11.098 -0.364 0.039 1.00 . A A . 14 ASP CB 1 1
13 2869 1 1 14 ASP CG C -9.875 -1.144 -0.378 1.00 . A A . 14 ASP CG 1 1
13 2870 1 1 14 ASP H H -9.313 1.573 0.247 1.00 . A A . 14 ASP H 1 1
13 2871 1 1 14 ASP HA H -11.831 0.985 1.544 1.00 . A A . 14 ASP HA 1 1
13 2872 1 1 14 ASP HB2 H -11.879 -1.071 0.269 1.00 . A A . 14 ASP HB2 1 1
13 2873 1 1 14 ASP HB3 H -11.419 0.240 -0.796 1.00 . A A . 14 ASP HB3 1 1
13 2874 1 1 14 ASP N N -10.007 1.676 0.935 1.00 . A A . 14 ASP N 1 1
13 2875 1 1 14 ASP O O -10.934 -1.191 2.913 1.00 . A A . 14 ASP O 1 1
13 2876 1 1 14 ASP OD1 O -9.033 -0.596 -1.129 1.00 . A A . 14 ASP OD1 1 1
13 2877 1 1 14 ASP OD2 O -9.756 -2.338 0.003 1.00 . A A . 14 ASP OD2 1 1
13 2878 2 2 1 . C C -2.013 1.604 3.940 1.00 . B A . 101 WMH C 1 1
13 2879 2 2 1 . C1 C -1.348 3.512 2.617 1.00 . B A . 101 WMH C1 1 1
13 2880 2 2 1 . C2 C -0.190 4.194 2.419 1.00 . B A . 101 WMH C2 1 1
13 2881 2 2 1 . H1 H -2.396 1.904 4.899 1.00 . B A . 101 WMH H1 1 1
13 2882 2 2 1 . H2 H -2.842 1.627 3.253 1.00 . B A . 101 WMH H2 1 1
13 2883 2 2 1 . H5 H -0.055 5.041 1.763 1.00 . B A . 101 WMH H5 1 1
13 2884 2 2 1 . N N -1.108 2.552 3.480 1.00 . B A . 101 WMH N 1 1
13 2885 2 2 1 . N1 N 0.747 3.635 3.176 1.00 . B A . 101 WMH N1 1 1
13 2886 2 2 1 . N2 N 0.241 2.646 3.830 1.00 . B A . 101 WMH N2 1 1
14 2887 1 1 1 GLY C C -6.907 -1.223 3.574 1.00 . A A . 1 GLY C 1 1
14 2888 1 1 1 GLY CA C -8.068 -0.467 4.139 1.00 . A A . 1 GLY CA 1 1
14 2889 1 1 1 GLY H1 H -8.543 1.015 2.712 1.00 . A A . 1 GLY H1 1 1
14 2890 1 1 1 GLY HA2 H -7.696 0.295 4.807 1.00 . A A . 1 GLY HA2 1 1
14 2891 1 1 1 GLY HA3 H -8.697 -1.150 4.691 1.00 . A A . 1 GLY HA3 1 1
14 2892 1 1 1 GLY N N -8.836 0.160 3.100 1.00 . A A . 1 GLY N 1 1
14 2893 1 1 1 GLY O O -6.356 -2.114 4.214 1.00 . A A . 1 GLY O 1 1
14 2894 1 1 2 ARG C C -4.191 -0.668 1.851 1.00 . A A . 2 ARG C 1 1
14 2895 1 1 2 ARG CA C -5.439 -1.510 1.707 1.00 . A A . 2 ARG CA 1 1
14 2896 1 1 2 ARG CB C -5.785 -1.705 0.230 1.00 . A A . 2 ARG CB 1 1
14 2897 1 1 2 ARG CD C -4.688 -3.988 -0.128 1.00 . A A . 2 ARG CD 1 1
14 2898 1 1 2 ARG CG C -4.800 -2.537 -0.608 1.00 . A A . 2 ARG CG 1 1
14 2899 1 1 2 ARG CZ C -4.075 -4.770 2.181 1.00 . A A . 2 ARG CZ 1 1
14 2900 1 1 2 ARG H H -6.972 -0.101 1.950 1.00 . A A . 2 ARG H 1 1
14 2901 1 1 2 ARG HA H -5.278 -2.476 2.165 1.00 . A A . 2 ARG HA 1 1
14 2902 1 1 2 ARG HB2 H -6.755 -2.176 0.163 1.00 . A A . 2 ARG HB2 1 1
14 2903 1 1 2 ARG HB3 H -5.855 -0.726 -0.216 1.00 . A A . 2 ARG HB3 1 1
14 2904 1 1 2 ARG HD2 H -5.670 -4.337 0.151 1.00 . A A . 2 ARG HD2 1 1
14 2905 1 1 2 ARG HD3 H -4.320 -4.591 -0.944 1.00 . A A . 2 ARG HD3 1 1
14 2906 1 1 2 ARG HE H -2.868 -3.828 0.862 1.00 . A A . 2 ARG HE 1 1
14 2907 1 1 2 ARG HG2 H -5.127 -2.541 -1.636 1.00 . A A . 2 ARG HG2 1 1
14 2908 1 1 2 ARG HG3 H -3.825 -2.072 -0.548 1.00 . A A . 2 ARG HG3 1 1
14 2909 1 1 2 ARG HH11 H -6.101 -4.954 1.865 1.00 . A A . 2 ARG HH11 1 1
14 2910 1 1 2 ARG HH12 H -5.557 -5.573 3.346 1.00 . A A . 2 ARG HH12 1 1
14 2911 1 1 2 ARG HH21 H -2.157 -4.715 2.899 1.00 . A A . 2 ARG HH21 1 1
14 2912 1 1 2 ARG HH22 H -3.292 -5.457 3.924 1.00 . A A . 2 ARG HH22 1 1
14 2913 1 1 2 ARG N N -6.520 -0.856 2.381 1.00 . A A . 2 ARG N 1 1
14 2914 1 1 2 ARG NE N -3.785 -4.147 1.025 1.00 . A A . 2 ARG NE 1 1
14 2915 1 1 2 ARG NH1 N -5.325 -5.126 2.476 1.00 . A A . 2 ARG NH1 1 1
14 2916 1 1 2 ARG NH2 N -3.111 -4.993 3.051 1.00 . A A . 2 ARG NH2 1 1
14 2917 1 1 2 ARG O O -4.220 0.535 1.623 1.00 . A A . 2 ARG O 1 1
14 2918 1 1 3 ALA C C -0.810 -1.707 2.132 1.00 . A A . 3 ALA C 1 1
14 2919 1 1 3 ALA CA C -1.849 -0.689 2.447 1.00 . A A . 3 ALA CA 1 1
14 2920 1 1 3 ALA CB C -1.641 -0.095 3.850 1.00 . A A . 3 ALA CB 1 1
14 2921 1 1 3 ALA H H -3.248 -2.206 2.627 1.00 . A A . 3 ALA H 1 1
14 2922 1 1 3 ALA HA H -1.777 0.104 1.717 1.00 . A A . 3 ALA HA 1 1
14 2923 1 1 3 ALA HB1 H -0.596 -0.182 4.106 1.00 . A A . 3 ALA HB1 1 1
14 2924 1 1 3 ALA HB2 H -2.227 -0.652 4.563 1.00 . A A . 3 ALA HB2 1 1
14 2925 1 1 3 ALA N N -3.156 -1.281 2.312 1.00 . A A . 3 ALA N 1 1
14 2926 1 1 3 ALA O O -0.937 -2.871 2.537 1.00 . A A . 3 ALA O 1 1
14 2927 1 1 4 THR C C 2.346 -2.020 2.034 1.00 . A A . 4 THR C 1 1
14 2928 1 1 4 THR CA C 1.226 -2.181 1.019 1.00 . A A . 4 THR CA 1 1
14 2929 1 1 4 THR CB C 1.740 -1.925 -0.422 1.00 . A A . 4 THR CB 1 1
14 2930 1 1 4 THR CG2 C 0.661 -2.264 -1.443 1.00 . A A . 4 THR CG2 1 1
14 2931 1 1 4 THR H H 0.167 -0.414 0.962 1.00 . A A . 4 THR H 1 1
14 2932 1 1 4 THR HA H 0.850 -3.191 1.076 1.00 . A A . 4 THR HA 1 1
14 2933 1 1 4 THR HB H 2.599 -2.554 -0.601 1.00 . A A . 4 THR HB 1 1
14 2934 1 1 4 THR HG1 H 3.076 -0.560 -0.739 1.00 . A A . 4 THR HG1 1 1
14 2935 1 1 4 THR HG21 H -0.203 -1.639 -1.271 1.00 . A A . 4 THR HG21 1 1
14 2936 1 1 4 THR HG22 H 0.380 -3.301 -1.338 1.00 . A A . 4 THR HG22 1 1
14 2937 1 1 4 THR HG23 H 1.039 -2.093 -2.439 1.00 . A A . 4 THR HG23 1 1
14 2938 1 1 4 THR N N 0.156 -1.315 1.350 1.00 . A A . 4 THR N 1 1
14 2939 1 1 4 THR O O 2.765 -0.889 2.352 1.00 . A A . 4 THR O 1 1
14 2940 1 1 4 THR OG1 O 2.119 -0.551 -0.581 1.00 . A A . 4 THR OG1 1 1
14 2941 1 1 5 LYS C C 5.189 -2.852 2.848 1.00 . A A . 5 LYS C 1 1
14 2942 1 1 5 LYS CA C 3.871 -3.122 3.553 1.00 . A A . 5 LYS CA 1 1
14 2943 1 1 5 LYS CB C 3.956 -4.452 4.316 1.00 . A A . 5 LYS CB 1 1
14 2944 1 1 5 LYS CD C 4.509 -6.920 4.297 1.00 . A A . 5 LYS CD 1 1
14 2945 1 1 5 LYS CE C 5.697 -6.760 5.256 1.00 . A A . 5 LYS CE 1 1
14 2946 1 1 5 LYS CG C 4.285 -5.669 3.452 1.00 . A A . 5 LYS CG 1 1
14 2947 1 1 5 LYS H H 2.339 -3.977 2.380 1.00 . A A . 5 LYS H 1 1
14 2948 1 1 5 LYS HA H 3.682 -2.326 4.258 1.00 . A A . 5 LYS HA 1 1
14 2949 1 1 5 LYS HB2 H 4.727 -4.356 5.064 1.00 . A A . 5 LYS HB2 1 1
14 2950 1 1 5 LYS HB3 H 3.010 -4.628 4.806 1.00 . A A . 5 LYS HB3 1 1
14 2951 1 1 5 LYS HD2 H 3.618 -7.117 4.875 1.00 . A A . 5 LYS HD2 1 1
14 2952 1 1 5 LYS HD3 H 4.699 -7.753 3.639 1.00 . A A . 5 LYS HD3 1 1
14 2953 1 1 5 LYS HE2 H 5.505 -5.951 5.943 1.00 . A A . 5 LYS HE2 1 1
14 2954 1 1 5 LYS HE3 H 5.803 -7.674 5.820 1.00 . A A . 5 LYS HE3 1 1
14 2955 1 1 5 LYS HG2 H 3.465 -5.850 2.774 1.00 . A A . 5 LYS HG2 1 1
14 2956 1 1 5 LYS HG3 H 5.180 -5.460 2.887 1.00 . A A . 5 LYS HG3 1 1
14 2957 1 1 5 LYS HZ1 H 6.919 -5.653 3.931 1.00 . A A . 5 LYS HZ1 1 1
14 2958 1 1 5 LYS HZ2 H 7.236 -7.305 3.942 1.00 . A A . 5 LYS HZ2 1 1
14 2959 1 1 5 LYS HZ3 H 7.721 -6.338 5.237 1.00 . A A . 5 LYS HZ3 1 1
14 2960 1 1 5 LYS N N 2.786 -3.131 2.594 1.00 . A A . 5 LYS N 1 1
14 2961 1 1 5 LYS NZ N 6.968 -6.495 4.537 1.00 . A A . 5 LYS NZ 1 1
14 2962 1 1 5 LYS O O 6.156 -2.411 3.460 1.00 . A A . 5 LYS O 1 1
14 2963 1 1 6 SER C C 6.202 -1.715 -0.103 1.00 . A A . 6 SER C 1 1
14 2964 1 1 6 SER CA C 6.377 -2.932 0.784 1.00 . A A . 6 SER CA 1 1
14 2965 1 1 6 SER CB C 6.638 -4.182 -0.039 1.00 . A A . 6 SER CB 1 1
14 2966 1 1 6 SER H H 4.424 -3.475 1.116 1.00 . A A . 6 SER H 1 1
14 2967 1 1 6 SER HA H 7.210 -2.777 1.449 1.00 . A A . 6 SER HA 1 1
14 2968 1 1 6 SER HB2 H 7.390 -3.971 -0.786 1.00 . A A . 6 SER HB2 1 1
14 2969 1 1 6 SER HB3 H 6.982 -4.973 0.611 1.00 . A A . 6 SER HB3 1 1
14 2970 1 1 6 SER HG H 5.377 -5.559 -0.540 1.00 . A A . 6 SER HG 1 1
14 2971 1 1 6 SER N N 5.218 -3.132 1.575 1.00 . A A . 6 SER N 1 1
14 2972 1 1 6 SER O O 5.061 -1.299 -0.402 1.00 . A A . 6 SER O 1 1
14 2973 1 1 6 SER OG O 5.447 -4.609 -0.689 1.00 . A A . 6 SER OG 1 1
14 2974 1 1 7 ILE C C 6.971 -0.437 -2.805 1.00 . A A . 7 ILE C 1 1
14 2975 1 1 7 ILE CA C 7.296 0.006 -1.364 1.00 . A A . 7 ILE CA 1 1
14 2976 1 1 7 ILE CB C 8.649 0.777 -1.309 1.00 . A A . 7 ILE CB 1 1
14 2977 1 1 7 ILE CD1 C 11.157 0.601 -1.784 1.00 . A A . 7 ILE CD1 1 1
14 2978 1 1 7 ILE CG1 C 9.817 -0.104 -1.783 1.00 . A A . 7 ILE CG1 1 1
14 2979 1 1 7 ILE CG2 C 8.905 1.283 0.110 1.00 . A A . 7 ILE CG2 1 1
14 2980 1 1 7 ILE H H 8.170 -1.502 -0.209 1.00 . A A . 7 ILE H 1 1
14 2981 1 1 7 ILE HA H 6.504 0.656 -1.024 1.00 . A A . 7 ILE HA 1 1
14 2982 1 1 7 ILE HB H 8.570 1.639 -1.955 1.00 . A A . 7 ILE HB 1 1
14 2983 1 1 7 ILE HD11 H 11.911 -0.067 -2.173 1.00 . A A . 7 ILE HD11 1 1
14 2984 1 1 7 ILE HD12 H 11.412 0.883 -0.774 1.00 . A A . 7 ILE HD12 1 1
14 2985 1 1 7 ILE HD13 H 11.100 1.486 -2.401 1.00 . A A . 7 ILE HD13 1 1
14 2986 1 1 7 ILE HG12 H 9.897 -0.960 -1.132 1.00 . A A . 7 ILE HG12 1 1
14 2987 1 1 7 ILE HG13 H 9.615 -0.444 -2.788 1.00 . A A . 7 ILE HG13 1 1
14 2988 1 1 7 ILE HG21 H 8.928 0.444 0.790 1.00 . A A . 7 ILE HG21 1 1
14 2989 1 1 7 ILE HG22 H 8.123 1.965 0.406 1.00 . A A . 7 ILE HG22 1 1
14 2990 1 1 7 ILE HG23 H 9.857 1.793 0.140 1.00 . A A . 7 ILE HG23 1 1
14 2991 1 1 7 ILE N N 7.306 -1.138 -0.501 1.00 . A A . 7 ILE N 1 1
14 2992 1 1 7 ILE O O 7.291 -1.577 -3.190 1.00 . A A . 7 ILE O 1 1
14 2993 1 1 8 PRO C C 4.628 1.599 -2.238 1.00 . A A . 8 PRO C 1 1
14 2994 1 1 8 PRO CA C 5.818 1.726 -3.183 1.00 . A A . 8 PRO CA 1 1
14 2995 1 1 8 PRO CB C 5.360 2.390 -4.498 1.00 . A A . 8 PRO CB 1 1
14 2996 1 1 8 PRO CD C 5.921 0.121 -4.991 1.00 . A A . 8 PRO CD 1 1
14 2997 1 1 8 PRO CG C 5.832 1.488 -5.590 1.00 . A A . 8 PRO CG 1 1
14 2998 1 1 8 PRO HA H 6.607 2.304 -2.731 1.00 . A A . 8 PRO HA 1 1
14 2999 1 1 8 PRO HB2 H 4.282 2.477 -4.498 1.00 . A A . 8 PRO HB2 1 1
14 3000 1 1 8 PRO HB3 H 5.800 3.372 -4.579 1.00 . A A . 8 PRO HB3 1 1
14 3001 1 1 8 PRO HD2 H 4.965 -0.378 -5.040 1.00 . A A . 8 PRO HD2 1 1
14 3002 1 1 8 PRO HD3 H 6.683 -0.465 -5.483 1.00 . A A . 8 PRO HD3 1 1
14 3003 1 1 8 PRO HG2 H 5.123 1.493 -6.405 1.00 . A A . 8 PRO HG2 1 1
14 3004 1 1 8 PRO HG3 H 6.802 1.811 -5.938 1.00 . A A . 8 PRO HG3 1 1
14 3005 1 1 8 PRO N N 6.292 0.401 -3.604 1.00 . A A . 8 PRO N 1 1
14 3006 1 1 8 PRO O O 3.681 0.849 -2.538 1.00 . A A . 8 PRO O 1 1
14 3007 1 1 9 PRO C C 2.345 2.941 -0.643 1.00 . A A . 9 PRO C 1 1
14 3008 1 1 9 PRO CA C 3.570 2.222 -0.117 1.00 . A A . 9 PRO CA 1 1
14 3009 1 1 9 PRO CB C 4.118 2.923 1.135 1.00 . A A . 9 PRO CB 1 1
14 3010 1 1 9 PRO CD C 5.700 3.217 -0.630 1.00 . A A . 9 PRO CD 1 1
14 3011 1 1 9 PRO CG C 5.568 3.150 0.861 1.00 . A A . 9 PRO CG 1 1
14 3012 1 1 9 PRO HA H 3.312 1.198 0.107 1.00 . A A . 9 PRO HA 1 1
14 3013 1 1 9 PRO HB2 H 3.591 3.853 1.283 1.00 . A A . 9 PRO HB2 1 1
14 3014 1 1 9 PRO HB3 H 3.975 2.284 1.996 1.00 . A A . 9 PRO HB3 1 1
14 3015 1 1 9 PRO HD2 H 5.520 4.224 -0.979 1.00 . A A . 9 PRO HD2 1 1
14 3016 1 1 9 PRO HD3 H 6.681 2.877 -0.921 1.00 . A A . 9 PRO HD3 1 1
14 3017 1 1 9 PRO HG2 H 5.888 4.076 1.310 1.00 . A A . 9 PRO HG2 1 1
14 3018 1 1 9 PRO HG3 H 6.145 2.325 1.252 1.00 . A A . 9 PRO HG3 1 1
14 3019 1 1 9 PRO N N 4.650 2.293 -1.081 1.00 . A A . 9 PRO N 1 1
14 3020 1 1 9 PRO O O 2.276 4.178 -0.647 1.00 . A A . 9 PRO O 1 1
14 3021 1 1 10 ARG C C -0.904 2.313 -0.802 1.00 . A A . 10 ARG C 1 1
14 3022 1 1 10 ARG CA C 0.215 2.690 -1.707 1.00 . A A . 10 ARG CA 1 1
14 3023 1 1 10 ARG CB C -0.016 2.124 -3.111 1.00 . A A . 10 ARG CB 1 1
14 3024 1 1 10 ARG CD C 0.874 4.063 -4.435 1.00 . A A . 10 ARG CD 1 1
14 3025 1 1 10 ARG CG C 1.007 2.580 -4.141 1.00 . A A . 10 ARG CG 1 1
14 3026 1 1 10 ARG CZ C -1.155 5.472 -4.833 1.00 . A A . 10 ARG CZ 1 1
14 3027 1 1 10 ARG H H 1.575 1.203 -1.134 1.00 . A A . 10 ARG H 1 1
14 3028 1 1 10 ARG HA H 0.282 3.765 -1.763 1.00 . A A . 10 ARG HA 1 1
14 3029 1 1 10 ARG HB2 H 0.015 1.045 -3.057 1.00 . A A . 10 ARG HB2 1 1
14 3030 1 1 10 ARG HB3 H -0.996 2.426 -3.449 1.00 . A A . 10 ARG HB3 1 1
14 3031 1 1 10 ARG HD2 H 0.959 4.614 -3.511 1.00 . A A . 10 ARG HD2 1 1
14 3032 1 1 10 ARG HD3 H 1.673 4.354 -5.098 1.00 . A A . 10 ARG HD3 1 1
14 3033 1 1 10 ARG HE H -0.701 3.728 -5.757 1.00 . A A . 10 ARG HE 1 1
14 3034 1 1 10 ARG HG2 H 1.998 2.387 -3.760 1.00 . A A . 10 ARG HG2 1 1
14 3035 1 1 10 ARG HG3 H 0.855 2.026 -5.054 1.00 . A A . 10 ARG HG3 1 1
14 3036 1 1 10 ARG HH11 H 0.031 6.228 -3.338 1.00 . A A . 10 ARG HH11 1 1
14 3037 1 1 10 ARG HH12 H -1.315 7.183 -3.706 1.00 . A A . 10 ARG HH12 1 1
14 3038 1 1 10 ARG HH21 H -2.581 5.042 -6.240 1.00 . A A . 10 ARG HH21 1 1
14 3039 1 1 10 ARG HH22 H -2.851 6.479 -5.373 1.00 . A A . 10 ARG HH22 1 1
14 3040 1 1 10 ARG N N 1.432 2.179 -1.153 1.00 . A A . 10 ARG N 1 1
14 3041 1 1 10 ARG NE N -0.412 4.378 -5.076 1.00 . A A . 10 ARG NE 1 1
14 3042 1 1 10 ARG NH1 N -0.793 6.345 -3.895 1.00 . A A . 10 ARG NH1 1 1
14 3043 1 1 10 ARG NH2 N -2.265 5.677 -5.527 1.00 . A A . 10 ARG NH2 1 1
14 3044 1 1 10 ARG O O -1.102 1.123 -0.506 1.00 . A A . 10 ARG O 1 1
14 3045 1 1 11 ALA C C -3.957 3.479 -0.042 1.00 . A A . 11 ALA C 1 1
14 3046 1 1 11 ALA CA C -2.680 3.030 0.571 1.00 . A A . 11 ALA CA 1 1
14 3047 1 1 11 ALA CB C -2.469 3.632 1.968 1.00 . A A . 11 ALA CB 1 1
14 3048 1 1 11 ALA H H -1.416 4.230 -0.547 1.00 . A A . 11 ALA H 1 1
14 3049 1 1 11 ALA HA H -2.734 1.956 0.667 1.00 . A A . 11 ALA HA 1 1
14 3050 1 1 11 ALA HB1 H -3.278 3.317 2.610 1.00 . A A . 11 ALA HB1 1 1
14 3051 1 1 11 ALA HB2 H -2.472 4.709 1.935 1.00 . A A . 11 ALA HB2 1 1
14 3052 1 1 11 ALA N N -1.603 3.294 -0.313 1.00 . A A . 11 ALA N 1 1
14 3053 1 1 11 ALA O O -4.031 4.552 -0.641 1.00 . A A . 11 ALA O 1 1
14 3054 1 1 12 PHE C C -7.278 2.883 0.562 1.00 . A A . 12 PHE C 1 1
14 3055 1 1 12 PHE CA C -6.220 2.891 -0.518 1.00 . A A . 12 PHE CA 1 1
14 3056 1 1 12 PHE CB C -6.518 1.816 -1.579 1.00 . A A . 12 PHE CB 1 1
14 3057 1 1 12 PHE CD1 C -4.415 0.857 -2.584 1.00 . A A . 12 PHE CD1 1 1
14 3058 1 1 12 PHE CD2 C -5.603 2.518 -3.813 1.00 . A A . 12 PHE CD2 1 1
14 3059 1 1 12 PHE CE1 C -3.475 0.777 -3.588 1.00 . A A . 12 PHE CE1 1 1
14 3060 1 1 12 PHE CE2 C -4.665 2.440 -4.820 1.00 . A A . 12 PHE CE2 1 1
14 3061 1 1 12 PHE CG C -5.493 1.728 -2.683 1.00 . A A . 12 PHE CG 1 1
14 3062 1 1 12 PHE CZ C -3.600 1.570 -4.709 1.00 . A A . 12 PHE CZ 1 1
14 3063 1 1 12 PHE H H -4.801 1.874 0.665 1.00 . A A . 12 PHE H 1 1
14 3064 1 1 12 PHE HA H -6.195 3.862 -0.990 1.00 . A A . 12 PHE HA 1 1
14 3065 1 1 12 PHE HB2 H -6.588 0.850 -1.106 1.00 . A A . 12 PHE HB2 1 1
14 3066 1 1 12 PHE HB3 H -7.472 2.043 -2.036 1.00 . A A . 12 PHE HB3 1 1
14 3067 1 1 12 PHE HD1 H -4.315 0.235 -1.707 1.00 . A A . 12 PHE HD1 1 1
14 3068 1 1 12 PHE HD2 H -6.435 3.201 -3.906 1.00 . A A . 12 PHE HD2 1 1
14 3069 1 1 12 PHE HE1 H -2.642 0.095 -3.498 1.00 . A A . 12 PHE HE1 1 1
14 3070 1 1 12 PHE HE2 H -4.765 3.064 -5.697 1.00 . A A . 12 PHE HE2 1 1
14 3071 1 1 12 PHE HZ H -2.866 1.511 -5.499 1.00 . A A . 12 PHE HZ 1 1
14 3072 1 1 12 PHE N N -4.941 2.664 0.091 1.00 . A A . 12 PHE N 1 1
14 3073 1 1 12 PHE O O -7.190 2.075 1.503 1.00 . A A . 12 PHE O 1 1
14 3074 1 1 13 PRO C C -10.196 2.718 1.832 1.00 . A A . 13 PRO C 1 1
14 3075 1 1 13 PRO CA C -9.363 3.965 1.452 1.00 . A A . 13 PRO CA 1 1
14 3076 1 1 13 PRO CB C -10.274 5.031 0.827 1.00 . A A . 13 PRO CB 1 1
14 3077 1 1 13 PRO CD C -8.466 4.692 -0.693 1.00 . A A . 13 PRO CD 1 1
14 3078 1 1 13 PRO CG C -9.906 5.072 -0.615 1.00 . A A . 13 PRO CG 1 1
14 3079 1 1 13 PRO HA H -8.942 4.374 2.357 1.00 . A A . 13 PRO HA 1 1
14 3080 1 1 13 PRO HB2 H -11.305 4.739 0.962 1.00 . A A . 13 PRO HB2 1 1
14 3081 1 1 13 PRO HB3 H -10.110 5.986 1.304 1.00 . A A . 13 PRO HB3 1 1
14 3082 1 1 13 PRO HD2 H -8.258 4.201 -1.632 1.00 . A A . 13 PRO HD2 1 1
14 3083 1 1 13 PRO HD3 H -7.838 5.563 -0.574 1.00 . A A . 13 PRO HD3 1 1
14 3084 1 1 13 PRO HG2 H -10.506 4.365 -1.168 1.00 . A A . 13 PRO HG2 1 1
14 3085 1 1 13 PRO HG3 H -10.051 6.069 -1.002 1.00 . A A . 13 PRO HG3 1 1
14 3086 1 1 13 PRO N N -8.295 3.766 0.441 1.00 . A A . 13 PRO N 1 1
14 3087 1 1 13 PRO O O -11.070 2.806 2.689 1.00 . A A . 13 PRO O 1 1
14 3088 1 1 14 ASP C C -9.948 -0.386 2.667 1.00 . A A . 14 ASP C 1 1
14 3089 1 1 14 ASP CA C -10.667 0.354 1.560 1.00 . A A . 14 ASP CA 1 1
14 3090 1 1 14 ASP CB C -10.841 -0.585 0.350 1.00 . A A . 14 ASP CB 1 1
14 3091 1 1 14 ASP CG C -9.548 -1.191 -0.147 1.00 . A A . 14 ASP CG 1 1
14 3092 1 1 14 ASP H H -9.223 1.559 0.543 1.00 . A A . 14 ASP H 1 1
14 3093 1 1 14 ASP HA H -11.640 0.651 1.923 1.00 . A A . 14 ASP HA 1 1
14 3094 1 1 14 ASP HB2 H -11.491 -1.397 0.635 1.00 . A A . 14 ASP HB2 1 1
14 3095 1 1 14 ASP HB3 H -11.303 -0.042 -0.460 1.00 . A A . 14 ASP HB3 1 1
14 3096 1 1 14 ASP N N -9.932 1.579 1.220 1.00 . A A . 14 ASP N 1 1
14 3097 1 1 14 ASP O O -10.402 -1.429 3.122 1.00 . A A . 14 ASP O 1 1
14 3098 1 1 14 ASP OD1 O -9.269 -2.383 0.148 1.00 . A A . 14 ASP OD1 1 1
14 3099 1 1 14 ASP OD2 O -8.798 -0.495 -0.852 1.00 . A A . 14 ASP OD2 1 1
14 3100 2 2 1 . C C -2.030 1.363 3.948 1.00 . B A . 101 WMH C 1 1
14 3101 2 2 1 . C1 C -1.175 3.207 2.611 1.00 . B A . 101 WMH C1 1 1
14 3102 2 2 1 . C2 C 0.061 3.712 2.355 1.00 . B A . 101 WMH C2 1 1
14 3103 2 2 1 . H1 H -2.354 1.699 4.918 1.00 . B A . 101 WMH H1 1 1
14 3104 2 2 1 . H2 H -2.868 1.481 3.278 1.00 . B A . 101 WMH H2 1 1
14 3105 2 2 1 . H5 H 0.281 4.541 1.700 1.00 . B A . 101 WMH H5 1 1
14 3106 2 2 1 . N N -1.028 2.201 3.457 1.00 . B A . 101 WMH N 1 1
14 3107 2 2 1 . N1 N 0.949 3.010 3.048 1.00 . B A . 101 WMH N1 1 1
14 3108 2 2 1 . N2 N 0.347 2.096 3.728 1.00 . B A . 101 WMH N2 1 1
15 3109 1 1 1 GLY C C -6.821 -1.199 3.553 1.00 . A A . 1 GLY C 1 1
15 3110 1 1 1 GLY CA C -7.863 -0.376 4.264 1.00 . A A . 1 GLY CA 1 1
15 3111 1 1 1 GLY H1 H -8.600 1.193 3.052 1.00 . A A . 1 GLY H1 1 1
15 3112 1 1 1 GLY HA2 H -7.377 0.375 4.869 1.00 . A A . 1 GLY HA2 1 1
15 3113 1 1 1 GLY HA3 H -8.437 -1.025 4.908 1.00 . A A . 1 GLY HA3 1 1
15 3114 1 1 1 GLY N N -8.762 0.266 3.332 1.00 . A A . 1 GLY N 1 1
15 3115 1 1 1 GLY O O -6.237 -2.119 4.126 1.00 . A A . 1 GLY O 1 1
15 3116 1 1 2 ARG C C -4.347 -0.843 1.468 1.00 . A A . 2 ARG C 1 1
15 3117 1 1 2 ARG CA C -5.662 -1.599 1.489 1.00 . A A . 2 ARG CA 1 1
15 3118 1 1 2 ARG CB C -6.242 -1.711 0.095 1.00 . A A . 2 ARG CB 1 1
15 3119 1 1 2 ARG CD C -6.189 -2.536 -2.220 1.00 . A A . 2 ARG CD 1 1
15 3120 1 1 2 ARG CG C -5.453 -2.529 -0.899 1.00 . A A . 2 ARG CG 1 1
15 3121 1 1 2 ARG CZ C -6.028 -3.553 -4.466 1.00 . A A . 2 ARG CZ 1 1
15 3122 1 1 2 ARG H H -7.070 -0.110 1.934 1.00 . A A . 2 ARG H 1 1
15 3123 1 1 2 ARG HA H -5.513 -2.586 1.899 1.00 . A A . 2 ARG HA 1 1
15 3124 1 1 2 ARG HB2 H -7.232 -2.139 0.161 1.00 . A A . 2 ARG HB2 1 1
15 3125 1 1 2 ARG HB3 H -6.337 -0.710 -0.297 1.00 . A A . 2 ARG HB3 1 1
15 3126 1 1 2 ARG HD2 H -7.167 -2.964 -2.070 1.00 . A A . 2 ARG HD2 1 1
15 3127 1 1 2 ARG HD3 H -6.296 -1.513 -2.550 1.00 . A A . 2 ARG HD3 1 1
15 3128 1 1 2 ARG HE H -4.615 -3.624 -3.003 1.00 . A A . 2 ARG HE 1 1
15 3129 1 1 2 ARG HG2 H -4.476 -2.088 -1.027 1.00 . A A . 2 ARG HG2 1 1
15 3130 1 1 2 ARG HG3 H -5.361 -3.542 -0.539 1.00 . A A . 2 ARG HG3 1 1
15 3131 1 1 2 ARG HH11 H -7.751 -2.486 -4.163 1.00 . A A . 2 ARG HH11 1 1
15 3132 1 1 2 ARG HH12 H -7.684 -3.223 -5.679 1.00 . A A . 2 ARG HH12 1 1
15 3133 1 1 2 ARG HH21 H -4.437 -4.648 -5.090 1.00 . A A . 2 ARG HH21 1 1
15 3134 1 1 2 ARG HH22 H -5.685 -4.533 -6.238 1.00 . A A . 2 ARG HH22 1 1
15 3135 1 1 2 ARG N N -6.596 -0.879 2.315 1.00 . A A . 2 ARG N 1 1
15 3136 1 1 2 ARG NE N -5.508 -3.293 -3.258 1.00 . A A . 2 ARG NE 1 1
15 3137 1 1 2 ARG NH1 N -7.227 -3.060 -4.800 1.00 . A A . 2 ARG NH1 1 1
15 3138 1 1 2 ARG NH2 N -5.342 -4.287 -5.329 1.00 . A A . 2 ARG NH2 1 1
15 3139 1 1 2 ARG O O -4.282 0.275 0.978 1.00 . A A . 2 ARG O 1 1
15 3140 1 1 3 ALA C C -0.947 -1.834 1.842 1.00 . A A . 3 ALA C 1 1
15 3141 1 1 3 ALA CA C -2.020 -0.833 2.144 1.00 . A A . 3 ALA CA 1 1
15 3142 1 1 3 ALA CB C -1.804 -0.257 3.550 1.00 . A A . 3 ALA CB 1 1
15 3143 1 1 3 ALA H H -3.470 -2.320 2.433 1.00 . A A . 3 ALA H 1 1
15 3144 1 1 3 ALA HA H -1.957 -0.021 1.436 1.00 . A A . 3 ALA HA 1 1
15 3145 1 1 3 ALA HB1 H -0.759 -0.345 3.802 1.00 . A A . 3 ALA HB1 1 1
15 3146 1 1 3 ALA HB2 H -2.381 -0.840 4.253 1.00 . A A . 3 ALA HB2 1 1
15 3147 1 1 3 ALA N N -3.340 -1.429 2.043 1.00 . A A . 3 ALA N 1 1
15 3148 1 1 3 ALA O O -1.032 -2.994 2.270 1.00 . A A . 3 ALA O 1 1
15 3149 1 1 4 THR C C 2.191 -1.981 1.946 1.00 . A A . 4 THR C 1 1
15 3150 1 1 4 THR CA C 1.175 -2.236 0.834 1.00 . A A . 4 THR CA 1 1
15 3151 1 1 4 THR CB C 1.783 -1.938 -0.559 1.00 . A A . 4 THR CB 1 1
15 3152 1 1 4 THR CG2 C 0.885 -2.470 -1.667 1.00 . A A . 4 THR CG2 1 1
15 3153 1 1 4 THR H H 0.001 -0.548 0.634 1.00 . A A . 4 THR H 1 1
15 3154 1 1 4 THR HA H 0.866 -3.271 0.877 1.00 . A A . 4 THR HA 1 1
15 3155 1 1 4 THR HB H 2.747 -2.423 -0.624 1.00 . A A . 4 THR HB 1 1
15 3156 1 1 4 THR HG1 H 2.791 -0.400 -1.209 1.00 . A A . 4 THR HG1 1 1
15 3157 1 1 4 THR HG21 H -0.087 -2.004 -1.596 1.00 . A A . 4 THR HG21 1 1
15 3158 1 1 4 THR HG22 H 0.779 -3.540 -1.567 1.00 . A A . 4 THR HG22 1 1
15 3159 1 1 4 THR HG23 H 1.323 -2.241 -2.627 1.00 . A A . 4 THR HG23 1 1
15 3160 1 1 4 THR N N 0.027 -1.425 1.078 1.00 . A A . 4 THR N 1 1
15 3161 1 1 4 THR O O 2.308 -0.848 2.449 1.00 . A A . 4 THR O 1 1
15 3162 1 1 4 THR OG1 O 1.960 -0.522 -0.726 1.00 . A A . 4 THR OG1 1 1
15 3163 1 1 5 LYS C C 5.185 -2.526 2.863 1.00 . A A . 5 LYS C 1 1
15 3164 1 1 5 LYS CA C 3.835 -2.884 3.448 1.00 . A A . 5 LYS CA 1 1
15 3165 1 1 5 LYS CB C 3.922 -4.186 4.253 1.00 . A A . 5 LYS CB 1 1
15 3166 1 1 5 LYS CD C 2.135 -3.628 5.981 1.00 . A A . 5 LYS CD 1 1
15 3167 1 1 5 LYS CE C 3.090 -3.575 7.170 1.00 . A A . 5 LYS CE 1 1
15 3168 1 1 5 LYS CG C 2.607 -4.613 4.913 1.00 . A A . 5 LYS CG 1 1
15 3169 1 1 5 LYS H H 2.723 -3.890 1.957 1.00 . A A . 5 LYS H 1 1
15 3170 1 1 5 LYS HA H 3.514 -2.084 4.098 1.00 . A A . 5 LYS HA 1 1
15 3171 1 1 5 LYS HB2 H 4.229 -4.975 3.583 1.00 . A A . 5 LYS HB2 1 1
15 3172 1 1 5 LYS HB3 H 4.671 -4.075 5.021 1.00 . A A . 5 LYS HB3 1 1
15 3173 1 1 5 LYS HD2 H 2.068 -2.644 5.542 1.00 . A A . 5 LYS HD2 1 1
15 3174 1 1 5 LYS HD3 H 1.158 -3.931 6.326 1.00 . A A . 5 LYS HD3 1 1
15 3175 1 1 5 LYS HE2 H 3.154 -4.560 7.610 1.00 . A A . 5 LYS HE2 1 1
15 3176 1 1 5 LYS HE3 H 4.069 -3.283 6.820 1.00 . A A . 5 LYS HE3 1 1
15 3177 1 1 5 LYS HG2 H 1.845 -4.687 4.153 1.00 . A A . 5 LYS HG2 1 1
15 3178 1 1 5 LYS HG3 H 2.751 -5.582 5.369 1.00 . A A . 5 LYS HG3 1 1
15 3179 1 1 5 LYS HZ1 H 2.594 -1.653 7.826 1.00 . A A . 5 LYS HZ1 1 1
15 3180 1 1 5 LYS HZ2 H 3.321 -2.606 8.995 1.00 . A A . 5 LYS HZ2 1 1
15 3181 1 1 5 LYS HZ3 H 1.708 -2.879 8.579 1.00 . A A . 5 LYS HZ3 1 1
15 3182 1 1 5 LYS N N 2.866 -3.015 2.378 1.00 . A A . 5 LYS N 1 1
15 3183 1 1 5 LYS NZ N 2.643 -2.620 8.207 1.00 . A A . 5 LYS NZ 1 1
15 3184 1 1 5 LYS O O 5.929 -1.699 3.411 1.00 . A A . 5 LYS O 1 1
15 3185 1 1 6 SER C C 6.510 -1.710 0.069 1.00 . A A . 6 SER C 1 1
15 3186 1 1 6 SER CA C 6.691 -2.873 1.043 1.00 . A A . 6 SER CA 1 1
15 3187 1 1 6 SER CB C 7.085 -4.150 0.314 1.00 . A A . 6 SER CB 1 1
15 3188 1 1 6 SER H H 4.840 -3.742 1.335 1.00 . A A . 6 SER H 1 1
15 3189 1 1 6 SER HA H 7.457 -2.633 1.763 1.00 . A A . 6 SER HA 1 1
15 3190 1 1 6 SER HB2 H 7.879 -3.930 -0.386 1.00 . A A . 6 SER HB2 1 1
15 3191 1 1 6 SER HB3 H 7.425 -4.888 1.025 1.00 . A A . 6 SER HB3 1 1
15 3192 1 1 6 SER HG H 5.563 -5.365 0.138 1.00 . A A . 6 SER HG 1 1
15 3193 1 1 6 SER N N 5.474 -3.114 1.742 1.00 . A A . 6 SER N 1 1
15 3194 1 1 6 SER O O 5.373 -1.340 -0.268 1.00 . A A . 6 SER O 1 1
15 3195 1 1 6 SER OG O 5.970 -4.673 -0.401 1.00 . A A . 6 SER OG 1 1
15 3196 1 1 7 ILE C C 7.146 -0.553 -2.698 1.00 . A A . 7 ILE C 1 1
15 3197 1 1 7 ILE CA C 7.572 -0.042 -1.314 1.00 . A A . 7 ILE CA 1 1
15 3198 1 1 7 ILE CB C 8.945 0.674 -1.420 1.00 . A A . 7 ILE CB 1 1
15 3199 1 1 7 ILE CD1 C 11.397 0.321 -2.088 1.00 . A A . 7 ILE CD1 1 1
15 3200 1 1 7 ILE CG1 C 10.044 -0.312 -1.870 1.00 . A A . 7 ILE CG1 1 1
15 3201 1 1 7 ILE CG2 C 9.304 1.331 -0.089 1.00 . A A . 7 ILE CG2 1 1
15 3202 1 1 7 ILE H H 8.480 -1.449 -0.042 1.00 . A A . 7 ILE H 1 1
15 3203 1 1 7 ILE HA H 6.834 0.664 -0.963 1.00 . A A . 7 ILE HA 1 1
15 3204 1 1 7 ILE HB H 8.851 1.457 -2.156 1.00 . A A . 7 ILE HB 1 1
15 3205 1 1 7 ILE HD11 H 11.729 0.781 -1.169 1.00 . A A . 7 ILE HD11 1 1
15 3206 1 1 7 ILE HD12 H 11.322 1.073 -2.861 1.00 . A A . 7 ILE HD12 1 1
15 3207 1 1 7 ILE HD13 H 12.104 -0.435 -2.390 1.00 . A A . 7 ILE HD13 1 1
15 3208 1 1 7 ILE HG12 H 10.163 -1.078 -1.120 1.00 . A A . 7 ILE HG12 1 1
15 3209 1 1 7 ILE HG13 H 9.739 -0.775 -2.796 1.00 . A A . 7 ILE HG13 1 1
15 3210 1 1 7 ILE HG21 H 8.564 2.077 0.158 1.00 . A A . 7 ILE HG21 1 1
15 3211 1 1 7 ILE HG22 H 10.274 1.798 -0.164 1.00 . A A . 7 ILE HG22 1 1
15 3212 1 1 7 ILE HG23 H 9.325 0.580 0.687 1.00 . A A . 7 ILE HG23 1 1
15 3213 1 1 7 ILE N N 7.609 -1.134 -0.366 1.00 . A A . 7 ILE N 1 1
15 3214 1 1 7 ILE O O 7.430 -1.709 -3.048 1.00 . A A . 7 ILE O 1 1
15 3215 1 1 8 PRO C C 4.717 1.456 -2.129 1.00 . A A . 8 PRO C 1 1
15 3216 1 1 8 PRO CA C 5.926 1.573 -3.073 1.00 . A A . 8 PRO CA 1 1
15 3217 1 1 8 PRO CB C 5.475 2.215 -4.408 1.00 . A A . 8 PRO CB 1 1
15 3218 1 1 8 PRO CD C 5.996 -0.072 -4.841 1.00 . A A . 8 PRO CD 1 1
15 3219 1 1 8 PRO CG C 5.939 1.280 -5.477 1.00 . A A . 8 PRO CG 1 1
15 3220 1 1 8 PRO HA H 6.716 2.161 -2.629 1.00 . A A . 8 PRO HA 1 1
15 3221 1 1 8 PRO HB2 H 4.399 2.312 -4.411 1.00 . A A . 8 PRO HB2 1 1
15 3222 1 1 8 PRO HB3 H 5.924 3.189 -4.517 1.00 . A A . 8 PRO HB3 1 1
15 3223 1 1 8 PRO HD2 H 5.026 -0.545 -4.855 1.00 . A A . 8 PRO HD2 1 1
15 3224 1 1 8 PRO HD3 H 6.732 -0.694 -5.330 1.00 . A A . 8 PRO HD3 1 1
15 3225 1 1 8 PRO HG2 H 5.239 1.282 -6.299 1.00 . A A . 8 PRO HG2 1 1
15 3226 1 1 8 PRO HG3 H 6.919 1.575 -5.820 1.00 . A A . 8 PRO HG3 1 1
15 3227 1 1 8 PRO N N 6.409 0.245 -3.479 1.00 . A A . 8 PRO N 1 1
15 3228 1 1 8 PRO O O 3.788 0.667 -2.403 1.00 . A A . 8 PRO O 1 1
15 3229 1 1 9 PRO C C 2.405 2.941 -0.631 1.00 . A A . 9 PRO C 1 1
15 3230 1 1 9 PRO CA C 3.593 2.166 -0.069 1.00 . A A . 9 PRO CA 1 1
15 3231 1 1 9 PRO CB C 4.136 2.842 1.204 1.00 . A A . 9 PRO CB 1 1
15 3232 1 1 9 PRO CD C 5.746 3.124 -0.548 1.00 . A A . 9 PRO CD 1 1
15 3233 1 1 9 PRO CG C 5.592 3.077 0.943 1.00 . A A . 9 PRO CG 1 1
15 3234 1 1 9 PRO HA H 3.286 1.151 0.144 1.00 . A A . 9 PRO HA 1 1
15 3235 1 1 9 PRO HB2 H 3.609 3.771 1.365 1.00 . A A . 9 PRO HB2 1 1
15 3236 1 1 9 PRO HB3 H 3.988 2.192 2.054 1.00 . A A . 9 PRO HB3 1 1
15 3237 1 1 9 PRO HD2 H 5.569 4.126 -0.913 1.00 . A A . 9 PRO HD2 1 1
15 3238 1 1 9 PRO HD3 H 6.733 2.783 -0.821 1.00 . A A . 9 PRO HD3 1 1
15 3239 1 1 9 PRO HG2 H 5.901 4.014 1.383 1.00 . A A . 9 PRO HG2 1 1
15 3240 1 1 9 PRO HG3 H 6.172 2.265 1.354 1.00 . A A . 9 PRO HG3 1 1
15 3241 1 1 9 PRO N N 4.705 2.196 -1.001 1.00 . A A . 9 PRO N 1 1
15 3242 1 1 9 PRO O O 2.403 4.175 -0.664 1.00 . A A . 9 PRO O 1 1
15 3243 1 1 10 ARG C C -0.925 2.343 -0.940 1.00 . A A . 10 ARG C 1 1
15 3244 1 1 10 ARG CA C 0.281 2.799 -1.716 1.00 . A A . 10 ARG CA 1 1
15 3245 1 1 10 ARG CB C 0.203 2.396 -3.192 1.00 . A A . 10 ARG CB 1 1
15 3246 1 1 10 ARG CD C -0.823 2.791 -5.450 1.00 . A A . 10 ARG CD 1 1
15 3247 1 1 10 ARG CG C -0.976 2.979 -3.947 1.00 . A A . 10 ARG CG 1 1
15 3248 1 1 10 ARG CZ C -0.190 0.991 -7.058 1.00 . A A . 10 ARG CZ 1 1
15 3249 1 1 10 ARG H H 1.504 1.242 -1.059 1.00 . A A . 10 ARG H 1 1
15 3250 1 1 10 ARG HA H 0.363 3.874 -1.643 1.00 . A A . 10 ARG HA 1 1
15 3251 1 1 10 ARG HB2 H 1.114 2.700 -3.683 1.00 . A A . 10 ARG HB2 1 1
15 3252 1 1 10 ARG HB3 H 0.137 1.318 -3.243 1.00 . A A . 10 ARG HB3 1 1
15 3253 1 1 10 ARG HD2 H -1.699 3.189 -5.939 1.00 . A A . 10 ARG HD2 1 1
15 3254 1 1 10 ARG HD3 H 0.044 3.348 -5.775 1.00 . A A . 10 ARG HD3 1 1
15 3255 1 1 10 ARG HE H -0.906 0.699 -5.192 1.00 . A A . 10 ARG HE 1 1
15 3256 1 1 10 ARG HG2 H -1.880 2.488 -3.621 1.00 . A A . 10 ARG HG2 1 1
15 3257 1 1 10 ARG HG3 H -1.040 4.034 -3.728 1.00 . A A . 10 ARG HG3 1 1
15 3258 1 1 10 ARG HH11 H 0.022 2.882 -7.821 1.00 . A A . 10 ARG HH11 1 1
15 3259 1 1 10 ARG HH12 H 0.471 1.654 -8.893 1.00 . A A . 10 ARG HH12 1 1
15 3260 1 1 10 ARG HH21 H -0.280 -1.007 -6.653 1.00 . A A . 10 ARG HH21 1 1
15 3261 1 1 10 ARG HH22 H 0.328 -0.626 -8.200 1.00 . A A . 10 ARG HH22 1 1
15 3262 1 1 10 ARG N N 1.445 2.222 -1.118 1.00 . A A . 10 ARG N 1 1
15 3263 1 1 10 ARG NE N -0.662 1.381 -5.859 1.00 . A A . 10 ARG NE 1 1
15 3264 1 1 10 ARG NH1 N 0.122 1.898 -7.982 1.00 . A A . 10 ARG NH1 1 1
15 3265 1 1 10 ARG NH2 N -0.042 -0.299 -7.326 1.00 . A A . 10 ARG NH2 1 1
15 3266 1 1 10 ARG O O -1.119 1.139 -0.729 1.00 . A A . 10 ARG O 1 1
15 3267 1 1 11 ALA C C -4.101 3.451 -0.218 1.00 . A A . 11 ALA C 1 1
15 3268 1 1 11 ALA CA C -2.822 2.962 0.372 1.00 . A A . 11 ALA CA 1 1
15 3269 1 1 11 ALA CB C -2.661 3.502 1.800 1.00 . A A . 11 ALA CB 1 1
15 3270 1 1 11 ALA H H -1.527 4.230 -0.664 1.00 . A A . 11 ALA H 1 1
15 3271 1 1 11 ALA HA H -2.871 1.885 0.428 1.00 . A A . 11 ALA HA 1 1
15 3272 1 1 11 ALA HB1 H -3.474 3.133 2.406 1.00 . A A . 11 ALA HB1 1 1
15 3273 1 1 11 ALA HB2 H -2.697 4.577 1.820 1.00 . A A . 11 ALA HB2 1 1
15 3274 1 1 11 ALA N N -1.702 3.286 -0.461 1.00 . A A . 11 ALA N 1 1
15 3275 1 1 11 ALA O O -4.157 4.521 -0.835 1.00 . A A . 11 ALA O 1 1
15 3276 1 1 12 PHE C C -7.402 3.015 0.642 1.00 . A A . 12 PHE C 1 1
15 3277 1 1 12 PHE CA C -6.426 2.967 -0.535 1.00 . A A . 12 PHE CA 1 1
15 3278 1 1 12 PHE CB C -6.842 1.892 -1.553 1.00 . A A . 12 PHE CB 1 1
15 3279 1 1 12 PHE CD1 C -4.855 0.759 -2.598 1.00 . A A . 12 PHE CD1 1 1
15 3280 1 1 12 PHE CD2 C -5.964 2.458 -3.836 1.00 . A A . 12 PHE CD2 1 1
15 3281 1 1 12 PHE CE1 C -3.963 0.579 -3.627 1.00 . A A . 12 PHE CE1 1 1
15 3282 1 1 12 PHE CE2 C -5.071 2.284 -4.873 1.00 . A A . 12 PHE CE2 1 1
15 3283 1 1 12 PHE CG C -5.866 1.700 -2.688 1.00 . A A . 12 PHE CG 1 1
15 3284 1 1 12 PHE CZ C -4.070 1.342 -4.768 1.00 . A A . 12 PHE CZ 1 1
15 3285 1 1 12 PHE H H -4.974 1.867 0.512 1.00 . A A . 12 PHE H 1 1
15 3286 1 1 12 PHE HA H -6.379 3.928 -1.022 1.00 . A A . 12 PHE HA 1 1
15 3287 1 1 12 PHE HB2 H -6.982 0.948 -1.052 1.00 . A A . 12 PHE HB2 1 1
15 3288 1 1 12 PHE HB3 H -7.783 2.197 -1.983 1.00 . A A . 12 PHE HB3 1 1
15 3289 1 1 12 PHE HD1 H -4.767 0.162 -1.703 1.00 . A A . 12 PHE HD1 1 1
15 3290 1 1 12 PHE HD2 H -6.750 3.195 -3.917 1.00 . A A . 12 PHE HD2 1 1
15 3291 1 1 12 PHE HE1 H -3.180 -0.159 -3.539 1.00 . A A . 12 PHE HE1 1 1
15 3292 1 1 12 PHE HE2 H -5.155 2.883 -5.767 1.00 . A A . 12 PHE HE2 1 1
15 3293 1 1 12 PHE HZ H -3.368 1.201 -5.578 1.00 . A A . 12 PHE HZ 1 1
15 3294 1 1 12 PHE N N -5.117 2.681 -0.023 1.00 . A A . 12 PHE N 1 1
15 3295 1 1 12 PHE O O -7.171 2.329 1.655 1.00 . A A . 12 PHE O 1 1
15 3296 1 1 13 PRO C C -10.259 2.784 2.101 1.00 . A A . 13 PRO C 1 1
15 3297 1 1 13 PRO CA C -9.474 4.025 1.641 1.00 . A A . 13 PRO CA 1 1
15 3298 1 1 13 PRO CB C -10.446 5.064 1.066 1.00 . A A . 13 PRO CB 1 1
15 3299 1 1 13 PRO CD C -8.914 4.535 -0.673 1.00 . A A . 13 PRO CD 1 1
15 3300 1 1 13 PRO CG C -9.753 5.632 -0.119 1.00 . A A . 13 PRO CG 1 1
15 3301 1 1 13 PRO HA H -8.975 4.455 2.495 1.00 . A A . 13 PRO HA 1 1
15 3302 1 1 13 PRO HB2 H -11.369 4.575 0.788 1.00 . A A . 13 PRO HB2 1 1
15 3303 1 1 13 PRO HB3 H -10.648 5.823 1.807 1.00 . A A . 13 PRO HB3 1 1
15 3304 1 1 13 PRO HD2 H -9.503 3.917 -1.334 1.00 . A A . 13 PRO HD2 1 1
15 3305 1 1 13 PRO HD3 H -8.060 4.946 -1.190 1.00 . A A . 13 PRO HD3 1 1
15 3306 1 1 13 PRO HG2 H -10.475 5.958 -0.853 1.00 . A A . 13 PRO HG2 1 1
15 3307 1 1 13 PRO HG3 H -9.129 6.458 0.187 1.00 . A A . 13 PRO HG3 1 1
15 3308 1 1 13 PRO N N -8.507 3.793 0.533 1.00 . A A . 13 PRO N 1 1
15 3309 1 1 13 PRO O O -11.085 2.871 3.004 1.00 . A A . 13 PRO O 1 1
15 3310 1 1 14 ASP C C -9.820 -0.369 2.862 1.00 . A A . 14 ASP C 1 1
15 3311 1 1 14 ASP CA C -10.699 0.424 1.896 1.00 . A A . 14 ASP CA 1 1
15 3312 1 1 14 ASP CB C -11.064 -0.438 0.679 1.00 . A A . 14 ASP CB 1 1
15 3313 1 1 14 ASP CG C -9.869 -1.077 0.020 1.00 . A A . 14 ASP CG 1 1
15 3314 1 1 14 ASP H H -9.363 1.632 0.761 1.00 . A A . 14 ASP H 1 1
15 3315 1 1 14 ASP HA H -11.602 0.715 2.413 1.00 . A A . 14 ASP HA 1 1
15 3316 1 1 14 ASP HB2 H -11.739 -1.220 0.993 1.00 . A A . 14 ASP HB2 1 1
15 3317 1 1 14 ASP HB3 H -11.567 0.181 -0.049 1.00 . A A . 14 ASP HB3 1 1
15 3318 1 1 14 ASP N N -10.014 1.650 1.495 1.00 . A A . 14 ASP N 1 1
15 3319 1 1 14 ASP O O -10.106 -1.523 3.193 1.00 . A A . 14 ASP O 1 1
15 3320 1 1 14 ASP OD1 O -9.129 -0.373 -0.690 1.00 . A A . 14 ASP OD1 1 1
15 3321 1 1 14 ASP OD2 O -9.668 -2.300 0.198 1.00 . A A . 14 ASP OD2 1 1
15 3322 2 2 1 . C C -2.210 1.192 3.698 1.00 . B A . 101 WMH C 1 1
15 3323 2 2 1 . C1 C -1.377 3.100 2.455 1.00 . B A . 101 WMH C1 1 1
15 3324 2 2 1 . C2 C -0.160 3.673 2.264 1.00 . B A . 101 WMH C2 1 1
15 3325 2 2 1 . H1 H -2.511 1.464 4.695 1.00 . B A . 101 WMH H1 1 1
15 3326 2 2 1 . H2 H -3.063 1.335 3.054 1.00 . B A . 101 WMH H2 1 1
15 3327 2 2 1 . H5 H 0.044 4.539 1.653 1.00 . B A . 101 WMH H5 1 1
15 3328 2 2 1 . N N -1.218 2.071 3.256 1.00 . B A . 101 WMH N 1 1
15 3329 2 2 1 . N1 N 0.733 2.983 2.957 1.00 . B A . 101 WMH N1 1 1
15 3330 2 2 1 . N2 N 0.145 2.012 3.570 1.00 . B A . 101 WMH N2 1 1
16 3331 1 1 1 GLY C C -6.647 -0.253 4.100 1.00 . A A . 1 GLY C 1 1
16 3332 1 1 1 GLY CA C -7.901 0.517 4.393 1.00 . A A . 1 GLY CA 1 1
16 3333 1 1 1 GLY H1 H -8.445 1.233 2.499 1.00 . A A . 1 GLY H1 1 1
16 3334 1 1 1 GLY HA2 H -7.625 1.497 4.754 1.00 . A A . 1 GLY HA2 1 1
16 3335 1 1 1 GLY HA3 H -8.451 0.005 5.167 1.00 . A A . 1 GLY HA3 1 1
16 3336 1 1 1 GLY N N -8.753 0.671 3.246 1.00 . A A . 1 GLY N 1 1
16 3337 1 1 1 GLY O O -5.722 -0.279 4.925 1.00 . A A . 1 GLY O 1 1
16 3338 1 1 2 ARG C C -4.251 -0.779 2.283 1.00 . A A . 2 ARG C 1 1
16 3339 1 1 2 ARG CA C -5.441 -1.663 2.562 1.00 . A A . 2 ARG CA 1 1
16 3340 1 1 2 ARG CB C -5.717 -2.542 1.345 1.00 . A A . 2 ARG CB 1 1
16 3341 1 1 2 ARG CD C -6.353 -4.603 2.646 1.00 . A A . 2 ARG CD 1 1
16 3342 1 1 2 ARG CG C -6.758 -3.622 1.558 1.00 . A A . 2 ARG CG 1 1
16 3343 1 1 2 ARG CZ C -4.680 -6.423 2.910 1.00 . A A . 2 ARG CZ 1 1
16 3344 1 1 2 ARG H H -7.356 -0.794 2.321 1.00 . A A . 2 ARG H 1 1
16 3345 1 1 2 ARG HA H -5.195 -2.302 3.397 1.00 . A A . 2 ARG HA 1 1
16 3346 1 1 2 ARG HB2 H -6.054 -1.913 0.535 1.00 . A A . 2 ARG HB2 1 1
16 3347 1 1 2 ARG HB3 H -4.792 -3.014 1.046 1.00 . A A . 2 ARG HB3 1 1
16 3348 1 1 2 ARG HD2 H -6.249 -4.075 3.582 1.00 . A A . 2 ARG HD2 1 1
16 3349 1 1 2 ARG HD3 H -7.134 -5.343 2.744 1.00 . A A . 2 ARG HD3 1 1
16 3350 1 1 2 ARG HE H -4.519 -4.860 1.664 1.00 . A A . 2 ARG HE 1 1
16 3351 1 1 2 ARG HG2 H -7.691 -3.156 1.835 1.00 . A A . 2 ARG HG2 1 1
16 3352 1 1 2 ARG HG3 H -6.887 -4.161 0.632 1.00 . A A . 2 ARG HG3 1 1
16 3353 1 1 2 ARG HH11 H -6.322 -6.649 4.118 1.00 . A A . 2 ARG HH11 1 1
16 3354 1 1 2 ARG HH12 H -5.174 -7.887 4.273 1.00 . A A . 2 ARG HH12 1 1
16 3355 1 1 2 ARG HH21 H -2.932 -6.514 1.856 1.00 . A A . 2 ARG HH21 1 1
16 3356 1 1 2 ARG HH22 H -3.167 -7.808 2.940 1.00 . A A . 2 ARG HH22 1 1
16 3357 1 1 2 ARG N N -6.598 -0.879 2.939 1.00 . A A . 2 ARG N 1 1
16 3358 1 1 2 ARG NE N -5.091 -5.288 2.342 1.00 . A A . 2 ARG NE 1 1
16 3359 1 1 2 ARG NH1 N -5.437 -7.026 3.830 1.00 . A A . 2 ARG NH1 1 1
16 3360 1 1 2 ARG NH2 N -3.517 -6.952 2.548 1.00 . A A . 2 ARG NH2 1 1
16 3361 1 1 2 ARG O O -4.371 0.262 1.664 1.00 . A A . 2 ARG O 1 1
16 3362 1 1 3 ALA C C -0.869 -1.504 2.159 1.00 . A A . 3 ALA C 1 1
16 3363 1 1 3 ALA CA C -1.902 -0.501 2.549 1.00 . A A . 3 ALA CA 1 1
16 3364 1 1 3 ALA CB C -1.497 0.272 3.811 1.00 . A A . 3 ALA CB 1 1
16 3365 1 1 3 ALA H H -3.102 -2.012 3.289 1.00 . A A . 3 ALA H 1 1
16 3366 1 1 3 ALA HA H -2.036 0.195 1.733 1.00 . A A . 3 ALA HA 1 1
16 3367 1 1 3 ALA HB1 H -0.419 0.308 3.857 1.00 . A A . 3 ALA HB1 1 1
16 3368 1 1 3 ALA HB2 H -1.868 -0.260 4.674 1.00 . A A . 3 ALA HB2 1 1
16 3369 1 1 3 ALA N N -3.136 -1.186 2.756 1.00 . A A . 3 ALA N 1 1
16 3370 1 1 3 ALA O O -0.834 -2.611 2.715 1.00 . A A . 3 ALA O 1 1
16 3371 1 1 4 THR C C 2.070 -2.016 1.736 1.00 . A A . 4 THR C 1 1
16 3372 1 1 4 THR CA C 0.933 -2.068 0.725 1.00 . A A . 4 THR CA 1 1
16 3373 1 1 4 THR CB C 1.467 -1.638 -0.635 1.00 . A A . 4 THR CB 1 1
16 3374 1 1 4 THR CG2 C 1.886 -2.852 -1.427 1.00 . A A . 4 THR CG2 1 1
16 3375 1 1 4 THR H H -0.244 -0.346 0.675 1.00 . A A . 4 THR H 1 1
16 3376 1 1 4 THR HA H 0.539 -3.070 0.657 1.00 . A A . 4 THR HA 1 1
16 3377 1 1 4 THR HB H 2.332 -1.017 -0.465 1.00 . A A . 4 THR HB 1 1
16 3378 1 1 4 THR HG1 H 0.017 -1.614 -1.953 1.00 . A A . 4 THR HG1 1 1
16 3379 1 1 4 THR HG21 H 1.016 -3.481 -1.560 1.00 . A A . 4 THR HG21 1 1
16 3380 1 1 4 THR HG22 H 2.656 -3.390 -0.894 1.00 . A A . 4 THR HG22 1 1
16 3381 1 1 4 THR HG23 H 2.252 -2.540 -2.394 1.00 . A A . 4 THR HG23 1 1
16 3382 1 1 4 THR N N -0.102 -1.189 1.164 1.00 . A A . 4 THR N 1 1
16 3383 1 1 4 THR O O 2.328 -0.972 2.350 1.00 . A A . 4 THR O 1 1
16 3384 1 1 4 THR OG1 O 0.429 -0.966 -1.367 1.00 . A A . 4 THR OG1 1 1
16 3385 1 1 5 LYS C C 5.101 -2.986 2.128 1.00 . A A . 5 LYS C 1 1
16 3386 1 1 5 LYS CA C 3.792 -3.230 2.856 1.00 . A A . 5 LYS CA 1 1
16 3387 1 1 5 LYS CB C 3.755 -4.625 3.471 1.00 . A A . 5 LYS CB 1 1
16 3388 1 1 5 LYS CD C 4.589 -6.289 5.148 1.00 . A A . 5 LYS CD 1 1
16 3389 1 1 5 LYS CE C 4.771 -7.373 4.087 1.00 . A A . 5 LYS CE 1 1
16 3390 1 1 5 LYS CG C 4.779 -4.893 4.560 1.00 . A A . 5 LYS CG 1 1
16 3391 1 1 5 LYS H H 2.466 -3.886 1.362 1.00 . A A . 5 LYS H 1 1
16 3392 1 1 5 LYS HA H 3.656 -2.492 3.631 1.00 . A A . 5 LYS HA 1 1
16 3393 1 1 5 LYS HB2 H 2.774 -4.806 3.881 1.00 . A A . 5 LYS HB2 1 1
16 3394 1 1 5 LYS HB3 H 3.930 -5.326 2.671 1.00 . A A . 5 LYS HB3 1 1
16 3395 1 1 5 LYS HD2 H 5.304 -6.446 5.940 1.00 . A A . 5 LYS HD2 1 1
16 3396 1 1 5 LYS HD3 H 3.591 -6.359 5.551 1.00 . A A . 5 LYS HD3 1 1
16 3397 1 1 5 LYS HE2 H 4.085 -7.190 3.275 1.00 . A A . 5 LYS HE2 1 1
16 3398 1 1 5 LYS HE3 H 5.785 -7.337 3.719 1.00 . A A . 5 LYS HE3 1 1
16 3399 1 1 5 LYS HG2 H 5.771 -4.815 4.139 1.00 . A A . 5 LYS HG2 1 1
16 3400 1 1 5 LYS HG3 H 4.658 -4.161 5.344 1.00 . A A . 5 LYS HG3 1 1
16 3401 1 1 5 LYS HZ1 H 3.546 -8.766 5.031 1.00 . A A . 5 LYS HZ1 1 1
16 3402 1 1 5 LYS HZ2 H 5.188 -8.987 5.346 1.00 . A A . 5 LYS HZ2 1 1
16 3403 1 1 5 LYS HZ3 H 4.544 -9.414 3.844 1.00 . A A . 5 LYS HZ3 1 1
16 3404 1 1 5 LYS N N 2.714 -3.115 1.914 1.00 . A A . 5 LYS N 1 1
16 3405 1 1 5 LYS NZ N 4.498 -8.718 4.616 1.00 . A A . 5 LYS NZ 1 1
16 3406 1 1 5 LYS O O 6.020 -2.373 2.659 1.00 . A A . 5 LYS O 1 1
16 3407 1 1 6 SER C C 6.384 -1.824 -0.440 1.00 . A A . 6 SER C 1 1
16 3408 1 1 6 SER CA C 6.306 -3.267 0.070 1.00 . A A . 6 SER CA 1 1
16 3409 1 1 6 SER CB C 6.252 -4.287 -1.070 1.00 . A A . 6 SER CB 1 1
16 3410 1 1 6 SER H H 4.387 -3.906 0.509 1.00 . A A . 6 SER H 1 1
16 3411 1 1 6 SER HA H 7.181 -3.467 0.671 1.00 . A A . 6 SER HA 1 1
16 3412 1 1 6 SER HB2 H 6.934 -3.991 -1.852 1.00 . A A . 6 SER HB2 1 1
16 3413 1 1 6 SER HB3 H 6.532 -5.259 -0.693 1.00 . A A . 6 SER HB3 1 1
16 3414 1 1 6 SER HG H 4.610 -5.271 -1.460 1.00 . A A . 6 SER HG 1 1
16 3415 1 1 6 SER N N 5.157 -3.443 0.902 1.00 . A A . 6 SER N 1 1
16 3416 1 1 6 SER O O 5.353 -1.185 -0.684 1.00 . A A . 6 SER O 1 1
16 3417 1 1 6 SER OG O 4.934 -4.374 -1.614 1.00 . A A . 6 SER OG 1 1
16 3418 1 1 7 ILE C C 7.754 0.125 -2.534 1.00 . A A . 7 ILE C 1 1
16 3419 1 1 7 ILE CA C 7.785 0.057 -1.002 1.00 . A A . 7 ILE CA 1 1
16 3420 1 1 7 ILE CB C 9.108 0.680 -0.449 1.00 . A A . 7 ILE CB 1 1
16 3421 1 1 7 ILE CD1 C 11.665 0.380 -0.362 1.00 . A A . 7 ILE CD1 1 1
16 3422 1 1 7 ILE CG1 C 10.334 -0.189 -0.816 1.00 . A A . 7 ILE CG1 1 1
16 3423 1 1 7 ILE CG2 C 9.012 0.867 1.065 1.00 . A A . 7 ILE CG2 1 1
16 3424 1 1 7 ILE H H 8.370 -1.858 -0.336 1.00 . A A . 7 ILE H 1 1
16 3425 1 1 7 ILE HA H 6.949 0.628 -0.627 1.00 . A A . 7 ILE HA 1 1
16 3426 1 1 7 ILE HB H 9.220 1.657 -0.894 1.00 . A A . 7 ILE HB 1 1
16 3427 1 1 7 ILE HD11 H 12.462 -0.287 -0.656 1.00 . A A . 7 ILE HD11 1 1
16 3428 1 1 7 ILE HD12 H 11.662 0.487 0.713 1.00 . A A . 7 ILE HD12 1 1
16 3429 1 1 7 ILE HD13 H 11.818 1.346 -0.819 1.00 . A A . 7 ILE HD13 1 1
16 3430 1 1 7 ILE HG12 H 10.224 -1.157 -0.353 1.00 . A A . 7 ILE HG12 1 1
16 3431 1 1 7 ILE HG13 H 10.369 -0.313 -1.888 1.00 . A A . 7 ILE HG13 1 1
16 3432 1 1 7 ILE HG21 H 9.939 1.283 1.432 1.00 . A A . 7 ILE HG21 1 1
16 3433 1 1 7 ILE HG22 H 8.838 -0.088 1.534 1.00 . A A . 7 ILE HG22 1 1
16 3434 1 1 7 ILE HG23 H 8.199 1.538 1.302 1.00 . A A . 7 ILE HG23 1 1
16 3435 1 1 7 ILE N N 7.589 -1.304 -0.548 1.00 . A A . 7 ILE N 1 1
16 3436 1 1 7 ILE O O 8.322 -0.749 -3.207 1.00 . A A . 7 ILE O 1 1
16 3437 1 1 8 PRO C C 5.049 1.808 -1.881 1.00 . A A . 8 PRO C 1 1
16 3438 1 1 8 PRO CA C 6.446 2.218 -2.378 1.00 . A A . 8 PRO CA 1 1
16 3439 1 1 8 PRO CB C 6.343 3.333 -3.416 1.00 . A A . 8 PRO CB 1 1
16 3440 1 1 8 PRO CD C 6.983 1.331 -4.580 1.00 . A A . 8 PRO CD 1 1
16 3441 1 1 8 PRO CG C 6.235 2.632 -4.724 1.00 . A A . 8 PRO CG 1 1
16 3442 1 1 8 PRO HA H 7.043 2.550 -1.541 1.00 . A A . 8 PRO HA 1 1
16 3443 1 1 8 PRO HB2 H 5.474 3.941 -3.214 1.00 . A A . 8 PRO HB2 1 1
16 3444 1 1 8 PRO HB3 H 7.236 3.937 -3.374 1.00 . A A . 8 PRO HB3 1 1
16 3445 1 1 8 PRO HD2 H 6.417 0.525 -5.018 1.00 . A A . 8 PRO HD2 1 1
16 3446 1 1 8 PRO HD3 H 7.954 1.402 -5.046 1.00 . A A . 8 PRO HD3 1 1
16 3447 1 1 8 PRO HG2 H 5.196 2.444 -4.952 1.00 . A A . 8 PRO HG2 1 1
16 3448 1 1 8 PRO HG3 H 6.683 3.236 -5.500 1.00 . A A . 8 PRO HG3 1 1
16 3449 1 1 8 PRO N N 7.113 1.144 -3.120 1.00 . A A . 8 PRO N 1 1
16 3450 1 1 8 PRO O O 4.273 1.184 -2.622 1.00 . A A . 8 PRO O 1 1
16 3451 1 1 9 PRO C C 2.267 2.561 -0.664 1.00 . A A . 9 PRO C 1 1
16 3452 1 1 9 PRO CA C 3.427 1.769 -0.053 1.00 . A A . 9 PRO CA 1 1
16 3453 1 1 9 PRO CB C 3.588 2.103 1.435 1.00 . A A . 9 PRO CB 1 1
16 3454 1 1 9 PRO CD C 5.542 2.921 0.314 1.00 . A A . 9 PRO CD 1 1
16 3455 1 1 9 PRO CG C 4.626 3.172 1.480 1.00 . A A . 9 PRO CG 1 1
16 3456 1 1 9 PRO HA H 3.245 0.713 -0.174 1.00 . A A . 9 PRO HA 1 1
16 3457 1 1 9 PRO HB2 H 2.644 2.448 1.832 1.00 . A A . 9 PRO HB2 1 1
16 3458 1 1 9 PRO HB3 H 3.909 1.221 1.972 1.00 . A A . 9 PRO HB3 1 1
16 3459 1 1 9 PRO HD2 H 5.853 3.857 -0.126 1.00 . A A . 9 PRO HD2 1 1
16 3460 1 1 9 PRO HD3 H 6.402 2.349 0.629 1.00 . A A . 9 PRO HD3 1 1
16 3461 1 1 9 PRO HG2 H 4.156 4.139 1.384 1.00 . A A . 9 PRO HG2 1 1
16 3462 1 1 9 PRO HG3 H 5.176 3.114 2.408 1.00 . A A . 9 PRO HG3 1 1
16 3463 1 1 9 PRO N N 4.709 2.143 -0.631 1.00 . A A . 9 PRO N 1 1
16 3464 1 1 9 PRO O O 2.323 3.787 -0.782 1.00 . A A . 9 PRO O 1 1
16 3465 1 1 10 ARG C C -1.012 2.267 -0.626 1.00 . A A . 10 ARG C 1 1
16 3466 1 1 10 ARG CA C 0.072 2.497 -1.627 1.00 . A A . 10 ARG CA 1 1
16 3467 1 1 10 ARG CB C -0.349 1.855 -2.946 1.00 . A A . 10 ARG CB 1 1
16 3468 1 1 10 ARG CD C 0.230 1.100 -5.238 1.00 . A A . 10 ARG CD 1 1
16 3469 1 1 10 ARG CG C 0.743 1.758 -3.978 1.00 . A A . 10 ARG CG 1 1
16 3470 1 1 10 ARG CZ C 1.169 0.571 -7.469 1.00 . A A . 10 ARG CZ 1 1
16 3471 1 1 10 ARG H H 1.257 0.882 -1.066 1.00 . A A . 10 ARG H 1 1
16 3472 1 1 10 ARG HA H 0.252 3.552 -1.764 1.00 . A A . 10 ARG HA 1 1
16 3473 1 1 10 ARG HB2 H -0.704 0.855 -2.745 1.00 . A A . 10 ARG HB2 1 1
16 3474 1 1 10 ARG HB3 H -1.159 2.432 -3.365 1.00 . A A . 10 ARG HB3 1 1
16 3475 1 1 10 ARG HD2 H -0.253 0.170 -4.977 1.00 . A A . 10 ARG HD2 1 1
16 3476 1 1 10 ARG HD3 H -0.485 1.757 -5.711 1.00 . A A . 10 ARG HD3 1 1
16 3477 1 1 10 ARG HE H 2.205 0.809 -5.763 1.00 . A A . 10 ARG HE 1 1
16 3478 1 1 10 ARG HG2 H 1.097 2.751 -4.214 1.00 . A A . 10 ARG HG2 1 1
16 3479 1 1 10 ARG HG3 H 1.555 1.168 -3.577 1.00 . A A . 10 ARG HG3 1 1
16 3480 1 1 10 ARG HH11 H -0.873 0.797 -7.529 1.00 . A A . 10 ARG HH11 1 1
16 3481 1 1 10 ARG HH12 H -0.139 0.394 -9.012 1.00 . A A . 10 ARG HH12 1 1
16 3482 1 1 10 ARG HH21 H 3.161 0.229 -7.803 1.00 . A A . 10 ARG HH21 1 1
16 3483 1 1 10 ARG HH22 H 2.180 0.091 -9.178 1.00 . A A . 10 ARG HH22 1 1
16 3484 1 1 10 ARG N N 1.253 1.863 -1.098 1.00 . A A . 10 ARG N 1 1
16 3485 1 1 10 ARG NE N 1.309 0.825 -6.173 1.00 . A A . 10 ARG NE 1 1
16 3486 1 1 10 ARG NH1 N -0.031 0.592 -8.035 1.00 . A A . 10 ARG NH1 1 1
16 3487 1 1 10 ARG NH2 N 2.235 0.275 -8.193 1.00 . A A . 10 ARG NH2 1 1
16 3488 1 1 10 ARG O O -1.049 1.200 -0.002 1.00 . A A . 10 ARG O 1 1
16 3489 1 1 11 ALA C C -4.246 3.218 -0.144 1.00 . A A . 11 ALA C 1 1
16 3490 1 1 11 ALA CA C -2.923 3.027 0.513 1.00 . A A . 11 ALA CA 1 1
16 3491 1 1 11 ALA CB C -2.764 3.821 1.819 1.00 . A A . 11 ALA CB 1 1
16 3492 1 1 11 ALA H H -1.804 4.068 -0.916 1.00 . A A . 11 ALA H 1 1
16 3493 1 1 11 ALA HA H -2.874 1.972 0.748 1.00 . A A . 11 ALA HA 1 1
16 3494 1 1 11 ALA HB1 H -3.519 3.496 2.518 1.00 . A A . 11 ALA HB1 1 1
16 3495 1 1 11 ALA HB2 H -2.877 4.881 1.679 1.00 . A A . 11 ALA HB2 1 1
16 3496 1 1 11 ALA N N -1.862 3.223 -0.421 1.00 . A A . 11 ALA N 1 1
16 3497 1 1 11 ALA O O -4.497 4.209 -0.825 1.00 . A A . 11 ALA O 1 1
16 3498 1 1 12 PHE C C -7.419 2.589 0.316 1.00 . A A . 12 PHE C 1 1
16 3499 1 1 12 PHE CA C -6.308 2.126 -0.616 1.00 . A A . 12 PHE CA 1 1
16 3500 1 1 12 PHE CB C -6.497 0.656 -1.023 1.00 . A A . 12 PHE CB 1 1
16 3501 1 1 12 PHE CD1 C -4.185 -0.281 -1.540 1.00 . A A . 12 PHE CD1 1 1
16 3502 1 1 12 PHE CD2 C -5.710 0.078 -3.340 1.00 . A A . 12 PHE CD2 1 1
16 3503 1 1 12 PHE CE1 C -3.239 -0.737 -2.424 1.00 . A A . 12 PHE CE1 1 1
16 3504 1 1 12 PHE CE2 C -4.759 -0.384 -4.226 1.00 . A A . 12 PHE CE2 1 1
16 3505 1 1 12 PHE CG C -5.444 0.139 -1.987 1.00 . A A . 12 PHE CG 1 1
16 3506 1 1 12 PHE CZ C -3.524 -0.789 -3.767 1.00 . A A . 12 PHE CZ 1 1
16 3507 1 1 12 PHE H H -4.807 1.554 0.690 1.00 . A A . 12 PHE H 1 1
16 3508 1 1 12 PHE HA H -6.296 2.731 -1.510 1.00 . A A . 12 PHE HA 1 1
16 3509 1 1 12 PHE HB2 H -6.466 0.043 -0.134 1.00 . A A . 12 PHE HB2 1 1
16 3510 1 1 12 PHE HB3 H -7.462 0.545 -1.493 1.00 . A A . 12 PHE HB3 1 1
16 3511 1 1 12 PHE HD1 H -3.930 -0.254 -0.489 1.00 . A A . 12 PHE HD1 1 1
16 3512 1 1 12 PHE HD2 H -6.675 0.394 -3.706 1.00 . A A . 12 PHE HD2 1 1
16 3513 1 1 12 PHE HE1 H -2.272 -1.054 -2.062 1.00 . A A . 12 PHE HE1 1 1
16 3514 1 1 12 PHE HE2 H -4.984 -0.428 -5.283 1.00 . A A . 12 PHE HE2 1 1
16 3515 1 1 12 PHE HZ H -2.780 -1.152 -4.463 1.00 . A A . 12 PHE HZ 1 1
16 3516 1 1 12 PHE N N -5.056 2.249 0.034 1.00 . A A . 12 PHE N 1 1
16 3517 1 1 12 PHE O O -7.315 2.418 1.535 1.00 . A A . 12 PHE O 1 1
16 3518 1 1 13 PRO C C -10.342 2.714 1.438 1.00 . A A . 13 PRO C 1 1
16 3519 1 1 13 PRO CA C -9.629 3.725 0.535 1.00 . A A . 13 PRO CA 1 1
16 3520 1 1 13 PRO CB C -10.590 4.239 -0.541 1.00 . A A . 13 PRO CB 1 1
16 3521 1 1 13 PRO CD C -8.737 3.310 -1.694 1.00 . A A . 13 PRO CD 1 1
16 3522 1 1 13 PRO CG C -10.217 3.490 -1.767 1.00 . A A . 13 PRO CG 1 1
16 3523 1 1 13 PRO HA H -9.292 4.556 1.135 1.00 . A A . 13 PRO HA 1 1
16 3524 1 1 13 PRO HB2 H -11.609 4.038 -0.242 1.00 . A A . 13 PRO HB2 1 1
16 3525 1 1 13 PRO HB3 H -10.450 5.302 -0.672 1.00 . A A . 13 PRO HB3 1 1
16 3526 1 1 13 PRO HD2 H -8.436 2.425 -2.236 1.00 . A A . 13 PRO HD2 1 1
16 3527 1 1 13 PRO HD3 H -8.227 4.183 -2.072 1.00 . A A . 13 PRO HD3 1 1
16 3528 1 1 13 PRO HG2 H -10.717 2.532 -1.779 1.00 . A A . 13 PRO HG2 1 1
16 3529 1 1 13 PRO HG3 H -10.483 4.065 -2.642 1.00 . A A . 13 PRO HG3 1 1
16 3530 1 1 13 PRO N N -8.507 3.155 -0.246 1.00 . A A . 13 PRO N 1 1
16 3531 1 1 13 PRO O O -11.051 3.092 2.380 1.00 . A A . 13 PRO O 1 1
16 3532 1 1 14 ASP C C -9.938 0.087 3.194 1.00 . A A . 14 ASP C 1 1
16 3533 1 1 14 ASP CA C -10.789 0.407 1.968 1.00 . A A . 14 ASP CA 1 1
16 3534 1 1 14 ASP CB C -11.076 -0.858 1.141 1.00 . A A . 14 ASP CB 1 1
16 3535 1 1 14 ASP CG C -9.852 -1.678 0.802 1.00 . A A . 14 ASP CG 1 1
16 3536 1 1 14 ASP H H -9.571 1.190 0.422 1.00 . A A . 14 ASP H 1 1
16 3537 1 1 14 ASP HA H -11.724 0.821 2.318 1.00 . A A . 14 ASP HA 1 1
16 3538 1 1 14 ASP HB2 H -11.750 -1.489 1.700 1.00 . A A . 14 ASP HB2 1 1
16 3539 1 1 14 ASP HB3 H -11.560 -0.563 0.221 1.00 . A A . 14 ASP HB3 1 1
16 3540 1 1 14 ASP N N -10.153 1.440 1.171 1.00 . A A . 14 ASP N 1 1
16 3541 1 1 14 ASP O O -10.350 -0.658 4.084 1.00 . A A . 14 ASP O 1 1
16 3542 1 1 14 ASP OD1 O -8.885 -1.135 0.212 1.00 . A A . 14 ASP OD1 1 1
16 3543 1 1 14 ASP OD2 O -9.867 -2.894 1.072 1.00 . A A . 14 ASP OD2 1 1
16 3544 2 2 1 . C C -2.023 1.700 3.864 1.00 . B A . 101 WMH C 1 1
16 3545 2 2 1 . C1 C -1.427 3.600 2.470 1.00 . B A . 101 WMH C1 1 1
16 3546 2 2 1 . C2 C -0.280 4.272 2.199 1.00 . B A . 101 WMH C2 1 1
16 3547 2 2 1 . H1 H -2.340 2.031 4.837 1.00 . B A . 101 WMH H1 1 1
16 3548 2 2 1 . H2 H -2.896 1.725 3.229 1.00 . B A . 101 WMH H2 1 1
16 3549 2 2 1 . H5 H -0.183 5.112 1.528 1.00 . B A . 101 WMH H5 1 1
16 3550 2 2 1 . N N -1.136 2.640 3.330 1.00 . B A . 101 WMH N 1 1
16 3551 2 2 1 . N1 N 0.706 3.719 2.899 1.00 . B A . 101 WMH N1 1 1
16 3552 2 2 1 . N2 N 0.241 2.734 3.593 1.00 . B A . 101 WMH N2 1 1
17 3553 1 1 1 GLY C C -7.358 -0.999 3.842 1.00 . A A . 1 GLY C 1 1
17 3554 1 1 1 GLY CA C -8.145 0.124 4.436 1.00 . A A . 1 GLY CA 1 1
17 3555 1 1 1 GLY H1 H -8.593 1.391 2.816 1.00 . A A . 1 GLY H1 1 1
17 3556 1 1 1 GLY HA2 H -7.466 0.855 4.849 1.00 . A A . 1 GLY HA2 1 1
17 3557 1 1 1 GLY HA3 H -8.767 -0.267 5.227 1.00 . A A . 1 GLY HA3 1 1
17 3558 1 1 1 GLY N N -8.981 0.759 3.458 1.00 . A A . 1 GLY N 1 1
17 3559 1 1 1 GLY O O -7.634 -2.176 4.108 1.00 . A A . 1 GLY O 1 1
17 3560 1 1 2 ARG C C -4.262 -0.900 1.996 1.00 . A A . 2 ARG C 1 1
17 3561 1 1 2 ARG CA C -5.553 -1.603 2.367 1.00 . A A . 2 ARG CA 1 1
17 3562 1 1 2 ARG CB C -6.258 -2.163 1.125 1.00 . A A . 2 ARG CB 1 1
17 3563 1 1 2 ARG CD C -6.244 -3.725 -0.818 1.00 . A A . 2 ARG CD 1 1
17 3564 1 1 2 ARG CG C -5.439 -3.151 0.326 1.00 . A A . 2 ARG CG 1 1
17 3565 1 1 2 ARG CZ C -5.923 -5.340 -2.684 1.00 . A A . 2 ARG CZ 1 1
17 3566 1 1 2 ARG H H -6.245 0.303 2.856 1.00 . A A . 2 ARG H 1 1
17 3567 1 1 2 ARG HA H -5.345 -2.404 3.059 1.00 . A A . 2 ARG HA 1 1
17 3568 1 1 2 ARG HB2 H -7.166 -2.660 1.437 1.00 . A A . 2 ARG HB2 1 1
17 3569 1 1 2 ARG HB3 H -6.521 -1.338 0.480 1.00 . A A . 2 ARG HB3 1 1
17 3570 1 1 2 ARG HD2 H -7.072 -4.282 -0.407 1.00 . A A . 2 ARG HD2 1 1
17 3571 1 1 2 ARG HD3 H -6.621 -2.913 -1.423 1.00 . A A . 2 ARG HD3 1 1
17 3572 1 1 2 ARG HE H -4.500 -4.649 -1.425 1.00 . A A . 2 ARG HE 1 1
17 3573 1 1 2 ARG HG2 H -4.565 -2.654 -0.066 1.00 . A A . 2 ARG HG2 1 1
17 3574 1 1 2 ARG HG3 H -5.138 -3.952 0.982 1.00 . A A . 2 ARG HG3 1 1
17 3575 1 1 2 ARG HH11 H -7.865 -4.749 -2.467 1.00 . A A . 2 ARG HH11 1 1
17 3576 1 1 2 ARG HH12 H -7.599 -5.856 -3.738 1.00 . A A . 2 ARG HH12 1 1
17 3577 1 1 2 ARG HH21 H -4.104 -6.140 -3.215 1.00 . A A . 2 ARG HH21 1 1
17 3578 1 1 2 ARG HH22 H -5.400 -6.669 -4.163 1.00 . A A . 2 ARG HH22 1 1
17 3579 1 1 2 ARG N N -6.406 -0.650 3.025 1.00 . A A . 2 ARG N 1 1
17 3580 1 1 2 ARG NE N -5.455 -4.618 -1.660 1.00 . A A . 2 ARG NE 1 1
17 3581 1 1 2 ARG NH1 N -7.216 -5.307 -2.990 1.00 . A A . 2 ARG NH1 1 1
17 3582 1 1 2 ARG NH2 N -5.090 -6.091 -3.402 1.00 . A A . 2 ARG NH2 1 1
17 3583 1 1 2 ARG O O -4.297 0.112 1.322 1.00 . A A . 2 ARG O 1 1
17 3584 1 1 3 ALA C C -0.830 -1.916 2.012 1.00 . A A . 3 ALA C 1 1
17 3585 1 1 3 ALA CA C -1.841 -0.821 2.240 1.00 . A A . 3 ALA CA 1 1
17 3586 1 1 3 ALA CB C -1.437 0.035 3.462 1.00 . A A . 3 ALA CB 1 1
17 3587 1 1 3 ALA H H -3.185 -2.229 3.012 1.00 . A A . 3 ALA H 1 1
17 3588 1 1 3 ALA HA H -1.892 -0.185 1.369 1.00 . A A . 3 ALA HA 1 1
17 3589 1 1 3 ALA HB1 H -0.358 0.101 3.492 1.00 . A A . 3 ALA HB1 1 1
17 3590 1 1 3 ALA HB2 H -1.780 -0.457 4.358 1.00 . A A . 3 ALA HB2 1 1
17 3591 1 1 3 ALA N N -3.152 -1.408 2.474 1.00 . A A . 3 ALA N 1 1
17 3592 1 1 3 ALA O O -0.794 -2.884 2.769 1.00 . A A . 3 ALA O 1 1
17 3593 1 1 4 THR C C 2.198 -2.594 1.609 1.00 . A A . 4 THR C 1 1
17 3594 1 1 4 THR CA C 1.002 -2.755 0.685 1.00 . A A . 4 THR CA 1 1
17 3595 1 1 4 THR CB C 1.477 -2.657 -0.795 1.00 . A A . 4 THR CB 1 1
17 3596 1 1 4 THR CG2 C 0.384 -3.050 -1.758 1.00 . A A . 4 THR CG2 1 1
17 3597 1 1 4 THR H H -0.092 -0.979 0.410 1.00 . A A . 4 THR H 1 1
17 3598 1 1 4 THR HA H 0.570 -3.733 0.840 1.00 . A A . 4 THR HA 1 1
17 3599 1 1 4 THR HB H 2.313 -3.331 -0.918 1.00 . A A . 4 THR HB 1 1
17 3600 1 1 4 THR HG1 H 2.736 -1.433 -1.612 1.00 . A A . 4 THR HG1 1 1
17 3601 1 1 4 THR HG21 H 0.748 -2.969 -2.771 1.00 . A A . 4 THR HG21 1 1
17 3602 1 1 4 THR HG22 H -0.460 -2.390 -1.627 1.00 . A A . 4 THR HG22 1 1
17 3603 1 1 4 THR HG23 H 0.084 -4.069 -1.562 1.00 . A A . 4 THR HG23 1 1
17 3604 1 1 4 THR N N -0.012 -1.770 0.990 1.00 . A A . 4 THR N 1 1
17 3605 1 1 4 THR O O 2.709 -1.474 1.783 1.00 . A A . 4 THR O 1 1
17 3606 1 1 4 THR OG1 O 1.923 -1.321 -1.104 1.00 . A A . 4 THR OG1 1 1
17 3607 1 1 5 LYS C C 5.098 -3.669 2.189 1.00 . A A . 5 LYS C 1 1
17 3608 1 1 5 LYS CA C 3.828 -3.617 3.056 1.00 . A A . 5 LYS CA 1 1
17 3609 1 1 5 LYS CB C 3.809 -4.674 4.192 1.00 . A A . 5 LYS CB 1 1
17 3610 1 1 5 LYS CD C 3.609 -7.059 4.946 1.00 . A A . 5 LYS CD 1 1
17 3611 1 1 5 LYS CE C 3.514 -8.517 4.532 1.00 . A A . 5 LYS CE 1 1
17 3612 1 1 5 LYS CG C 3.643 -6.122 3.745 1.00 . A A . 5 LYS CG 1 1
17 3613 1 1 5 LYS H H 2.161 -4.524 2.109 1.00 . A A . 5 LYS H 1 1
17 3614 1 1 5 LYS HA H 3.804 -2.629 3.492 1.00 . A A . 5 LYS HA 1 1
17 3615 1 1 5 LYS HB2 H 4.738 -4.606 4.739 1.00 . A A . 5 LYS HB2 1 1
17 3616 1 1 5 LYS HB3 H 3.001 -4.432 4.865 1.00 . A A . 5 LYS HB3 1 1
17 3617 1 1 5 LYS HD2 H 4.514 -6.924 5.518 1.00 . A A . 5 LYS HD2 1 1
17 3618 1 1 5 LYS HD3 H 2.755 -6.809 5.558 1.00 . A A . 5 LYS HD3 1 1
17 3619 1 1 5 LYS HE2 H 3.461 -9.124 5.422 1.00 . A A . 5 LYS HE2 1 1
17 3620 1 1 5 LYS HE3 H 2.614 -8.661 3.954 1.00 . A A . 5 LYS HE3 1 1
17 3621 1 1 5 LYS HG2 H 2.719 -6.219 3.195 1.00 . A A . 5 LYS HG2 1 1
17 3622 1 1 5 LYS HG3 H 4.474 -6.391 3.111 1.00 . A A . 5 LYS HG3 1 1
17 3623 1 1 5 LYS HZ1 H 4.734 -8.391 2.846 1.00 . A A . 5 LYS HZ1 1 1
17 3624 1 1 5 LYS HZ2 H 4.615 -9.942 3.469 1.00 . A A . 5 LYS HZ2 1 1
17 3625 1 1 5 LYS HZ3 H 5.566 -8.796 4.247 1.00 . A A . 5 LYS HZ3 1 1
17 3626 1 1 5 LYS N N 2.645 -3.675 2.220 1.00 . A A . 5 LYS N 1 1
17 3627 1 1 5 LYS NZ N 4.678 -8.937 3.728 1.00 . A A . 5 LYS NZ 1 1
17 3628 1 1 5 LYS O O 5.799 -4.690 2.090 1.00 . A A . 5 LYS O 1 1
17 3629 1 1 6 SER C C 6.596 -0.948 0.301 1.00 . A A . 6 SER C 1 1
17 3630 1 1 6 SER CA C 6.391 -2.427 0.552 1.00 . A A . 6 SER CA 1 1
17 3631 1 1 6 SER CB C 5.992 -3.126 -0.739 1.00 . A A . 6 SER CB 1 1
17 3632 1 1 6 SER H H 4.744 -1.797 1.657 1.00 . A A . 6 SER H 1 1
17 3633 1 1 6 SER HA H 7.292 -2.877 0.941 1.00 . A A . 6 SER HA 1 1
17 3634 1 1 6 SER HB2 H 6.673 -2.849 -1.530 1.00 . A A . 6 SER HB2 1 1
17 3635 1 1 6 SER HB3 H 6.012 -4.194 -0.592 1.00 . A A . 6 SER HB3 1 1
17 3636 1 1 6 SER HG H 4.308 -2.351 -0.296 1.00 . A A . 6 SER HG 1 1
17 3637 1 1 6 SER N N 5.317 -2.583 1.494 1.00 . A A . 6 SER N 1 1
17 3638 1 1 6 SER O O 5.752 -0.152 0.687 1.00 . A A . 6 SER O 1 1
17 3639 1 1 6 SER OG O 4.670 -2.740 -1.102 1.00 . A A . 6 SER OG 1 1
17 3640 1 1 7 ILE C C 8.128 0.799 -2.229 1.00 . A A . 7 ILE C 1 1
17 3641 1 1 7 ILE CA C 7.932 0.783 -0.709 1.00 . A A . 7 ILE CA 1 1
17 3642 1 1 7 ILE CB C 9.194 1.422 0.004 1.00 . A A . 7 ILE CB 1 1
17 3643 1 1 7 ILE CD1 C 9.127 0.230 2.316 1.00 . A A . 7 ILE CD1 1 1
17 3644 1 1 7 ILE CG1 C 9.025 1.536 1.546 1.00 . A A . 7 ILE CG1 1 1
17 3645 1 1 7 ILE CG2 C 9.523 2.796 -0.578 1.00 . A A . 7 ILE CG2 1 1
17 3646 1 1 7 ILE H H 8.367 -1.252 -0.558 1.00 . A A . 7 ILE H 1 1
17 3647 1 1 7 ILE HA H 7.045 1.351 -0.468 1.00 . A A . 7 ILE HA 1 1
17 3648 1 1 7 ILE HB H 10.034 0.776 -0.206 1.00 . A A . 7 ILE HB 1 1
17 3649 1 1 7 ILE HD11 H 8.365 -0.451 1.969 1.00 . A A . 7 ILE HD11 1 1
17 3650 1 1 7 ILE HD12 H 8.984 0.422 3.370 1.00 . A A . 7 ILE HD12 1 1
17 3651 1 1 7 ILE HD13 H 10.102 -0.208 2.158 1.00 . A A . 7 ILE HD13 1 1
17 3652 1 1 7 ILE HG12 H 9.787 2.195 1.933 1.00 . A A . 7 ILE HG12 1 1
17 3653 1 1 7 ILE HG13 H 8.057 1.971 1.753 1.00 . A A . 7 ILE HG13 1 1
17 3654 1 1 7 ILE HG21 H 9.713 2.700 -1.638 1.00 . A A . 7 ILE HG21 1 1
17 3655 1 1 7 ILE HG22 H 10.404 3.189 -0.093 1.00 . A A . 7 ILE HG22 1 1
17 3656 1 1 7 ILE HG23 H 8.693 3.466 -0.416 1.00 . A A . 7 ILE HG23 1 1
17 3657 1 1 7 ILE N N 7.684 -0.587 -0.325 1.00 . A A . 7 ILE N 1 1
17 3658 1 1 7 ILE O O 8.935 0.018 -2.749 1.00 . A A . 7 ILE O 1 1
17 3659 1 1 8 PRO C C 5.126 1.861 -1.958 1.00 . A A . 8 PRO C 1 1
17 3660 1 1 8 PRO CA C 6.382 2.571 -2.456 1.00 . A A . 8 PRO CA 1 1
17 3661 1 1 8 PRO CB C 6.021 3.427 -3.681 1.00 . A A . 8 PRO CB 1 1
17 3662 1 1 8 PRO CD C 7.498 1.754 -4.429 1.00 . A A . 8 PRO CD 1 1
17 3663 1 1 8 PRO CG C 7.100 3.167 -4.655 1.00 . A A . 8 PRO CG 1 1
17 3664 1 1 8 PRO HA H 6.788 3.203 -1.682 1.00 . A A . 8 PRO HA 1 1
17 3665 1 1 8 PRO HB2 H 5.064 3.109 -4.064 1.00 . A A . 8 PRO HB2 1 1
17 3666 1 1 8 PRO HB3 H 5.974 4.470 -3.408 1.00 . A A . 8 PRO HB3 1 1
17 3667 1 1 8 PRO HD2 H 6.817 1.078 -4.926 1.00 . A A . 8 PRO HD2 1 1
17 3668 1 1 8 PRO HD3 H 8.513 1.581 -4.753 1.00 . A A . 8 PRO HD3 1 1
17 3669 1 1 8 PRO HG2 H 6.726 3.306 -5.657 1.00 . A A . 8 PRO HG2 1 1
17 3670 1 1 8 PRO HG3 H 7.934 3.828 -4.463 1.00 . A A . 8 PRO HG3 1 1
17 3671 1 1 8 PRO N N 7.392 1.634 -2.983 1.00 . A A . 8 PRO N 1 1
17 3672 1 1 8 PRO O O 4.664 0.875 -2.575 1.00 . A A . 8 PRO O 1 1
17 3673 1 1 9 PRO C C 2.120 2.270 -1.018 1.00 . A A . 9 PRO C 1 1
17 3674 1 1 9 PRO CA C 3.366 1.753 -0.294 1.00 . A A . 9 PRO CA 1 1
17 3675 1 1 9 PRO CB C 3.386 2.197 1.170 1.00 . A A . 9 PRO CB 1 1
17 3676 1 1 9 PRO CD C 5.085 3.438 -0.009 1.00 . A A . 9 PRO CD 1 1
17 3677 1 1 9 PRO CG C 4.165 3.472 1.185 1.00 . A A . 9 PRO CG 1 1
17 3678 1 1 9 PRO HA H 3.386 0.673 -0.352 1.00 . A A . 9 PRO HA 1 1
17 3679 1 1 9 PRO HB2 H 2.373 2.346 1.510 1.00 . A A . 9 PRO HB2 1 1
17 3680 1 1 9 PRO HB3 H 3.864 1.437 1.773 1.00 . A A . 9 PRO HB3 1 1
17 3681 1 1 9 PRO HD2 H 5.030 4.373 -0.548 1.00 . A A . 9 PRO HD2 1 1
17 3682 1 1 9 PRO HD3 H 6.098 3.243 0.311 1.00 . A A . 9 PRO HD3 1 1
17 3683 1 1 9 PRO HG2 H 3.489 4.311 1.109 1.00 . A A . 9 PRO HG2 1 1
17 3684 1 1 9 PRO HG3 H 4.737 3.539 2.099 1.00 . A A . 9 PRO HG3 1 1
17 3685 1 1 9 PRO N N 4.568 2.321 -0.840 1.00 . A A . 9 PRO N 1 1
17 3686 1 1 9 PRO O O 1.901 3.489 -1.145 1.00 . A A . 9 PRO O 1 1
17 3687 1 1 10 ARG C C -1.006 1.452 -1.257 1.00 . A A . 10 ARG C 1 1
17 3688 1 1 10 ARG CA C 0.123 1.690 -2.202 1.00 . A A . 10 ARG CA 1 1
17 3689 1 1 10 ARG CB C -0.066 0.840 -3.459 1.00 . A A . 10 ARG CB 1 1
17 3690 1 1 10 ARG CD C 1.125 2.481 -4.960 1.00 . A A . 10 ARG CD 1 1
17 3691 1 1 10 ARG CG C 1.007 1.028 -4.519 1.00 . A A . 10 ARG CG 1 1
17 3692 1 1 10 ARG CZ C -0.297 3.943 -6.396 1.00 . A A . 10 ARG CZ 1 1
17 3693 1 1 10 ARG H H 1.570 0.406 -1.412 1.00 . A A . 10 ARG H 1 1
17 3694 1 1 10 ARG HA H 0.151 2.735 -2.471 1.00 . A A . 10 ARG HA 1 1
17 3695 1 1 10 ARG HB2 H -0.071 -0.200 -3.171 1.00 . A A . 10 ARG HB2 1 1
17 3696 1 1 10 ARG HB3 H -1.024 1.079 -3.899 1.00 . A A . 10 ARG HB3 1 1
17 3697 1 1 10 ARG HD2 H 1.479 3.071 -4.129 1.00 . A A . 10 ARG HD2 1 1
17 3698 1 1 10 ARG HD3 H 1.843 2.531 -5.764 1.00 . A A . 10 ARG HD3 1 1
17 3699 1 1 10 ARG HE H -0.962 2.707 -4.962 1.00 . A A . 10 ARG HE 1 1
17 3700 1 1 10 ARG HG2 H 1.958 0.707 -4.119 1.00 . A A . 10 ARG HG2 1 1
17 3701 1 1 10 ARG HG3 H 0.754 0.421 -5.377 1.00 . A A . 10 ARG HG3 1 1
17 3702 1 1 10 ARG HH11 H 1.697 4.082 -6.869 1.00 . A A . 10 ARG HH11 1 1
17 3703 1 1 10 ARG HH12 H 0.678 5.071 -7.801 1.00 . A A . 10 ARG HH12 1 1
17 3704 1 1 10 ARG HH21 H -2.317 4.095 -6.184 1.00 . A A . 10 ARG HH21 1 1
17 3705 1 1 10 ARG HH22 H -1.669 5.093 -7.396 1.00 . A A . 10 ARG HH22 1 1
17 3706 1 1 10 ARG N N 1.342 1.358 -1.525 1.00 . A A . 10 ARG N 1 1
17 3707 1 1 10 ARG NE N -0.155 3.030 -5.429 1.00 . A A . 10 ARG NE 1 1
17 3708 1 1 10 ARG NH1 N 0.764 4.395 -7.064 1.00 . A A . 10 ARG NH1 1 1
17 3709 1 1 10 ARG NH2 N -1.504 4.409 -6.681 1.00 . A A . 10 ARG NH2 1 1
17 3710 1 1 10 ARG O O -1.077 0.382 -0.632 1.00 . A A . 10 ARG O 1 1
17 3711 1 1 11 ALA C C -4.252 2.583 -0.876 1.00 . A A . 11 ALA C 1 1
17 3712 1 1 11 ALA CA C -2.950 2.283 -0.193 1.00 . A A . 11 ALA CA 1 1
17 3713 1 1 11 ALA CB C -2.817 3.163 1.076 1.00 . A A . 11 ALA CB 1 1
17 3714 1 1 11 ALA H H -1.782 3.256 -1.622 1.00 . A A . 11 ALA H 1 1
17 3715 1 1 11 ALA HA H -2.968 1.248 0.116 1.00 . A A . 11 ALA HA 1 1
17 3716 1 1 11 ALA HB1 H -3.562 2.839 1.785 1.00 . A A . 11 ALA HB1 1 1
17 3717 1 1 11 ALA HB2 H -3.008 4.202 0.880 1.00 . A A . 11 ALA HB2 1 1
17 3718 1 1 11 ALA N N -1.859 2.428 -1.104 1.00 . A A . 11 ALA N 1 1
17 3719 1 1 11 ALA O O -4.286 3.243 -1.932 1.00 . A A . 11 ALA O 1 1
17 3720 1 1 12 PHE C C -7.440 2.797 0.456 1.00 . A A . 12 PHE C 1 1
17 3721 1 1 12 PHE CA C -6.642 2.309 -0.738 1.00 . A A . 12 PHE CA 1 1
17 3722 1 1 12 PHE CB C -7.259 1.027 -1.303 1.00 . A A . 12 PHE CB 1 1
17 3723 1 1 12 PHE CD1 C -6.805 1.020 -3.764 1.00 . A A . 12 PHE CD1 1 1
17 3724 1 1 12 PHE CD2 C -5.659 -0.556 -2.406 1.00 . A A . 12 PHE CD2 1 1
17 3725 1 1 12 PHE CE1 C -6.175 0.522 -4.881 1.00 . A A . 12 PHE CE1 1 1
17 3726 1 1 12 PHE CE2 C -5.023 -1.058 -3.516 1.00 . A A . 12 PHE CE2 1 1
17 3727 1 1 12 PHE CG C -6.557 0.488 -2.515 1.00 . A A . 12 PHE CG 1 1
17 3728 1 1 12 PHE CZ C -5.281 -0.521 -4.759 1.00 . A A . 12 PHE CZ 1 1
17 3729 1 1 12 PHE H H -5.156 1.533 0.510 1.00 . A A . 12 PHE H 1 1
17 3730 1 1 12 PHE HA H -6.602 3.068 -1.503 1.00 . A A . 12 PHE HA 1 1
17 3731 1 1 12 PHE HB2 H -7.246 0.262 -0.541 1.00 . A A . 12 PHE HB2 1 1
17 3732 1 1 12 PHE HB3 H -8.283 1.229 -1.575 1.00 . A A . 12 PHE HB3 1 1
17 3733 1 1 12 PHE HD1 H -7.503 1.839 -3.863 1.00 . A A . 12 PHE HD1 1 1
17 3734 1 1 12 PHE HD2 H -5.453 -0.976 -1.433 1.00 . A A . 12 PHE HD2 1 1
17 3735 1 1 12 PHE HE1 H -6.379 0.950 -5.852 1.00 . A A . 12 PHE HE1 1 1
17 3736 1 1 12 PHE HE2 H -4.325 -1.876 -3.409 1.00 . A A . 12 PHE HE2 1 1
17 3737 1 1 12 PHE HZ H -4.787 -0.913 -5.636 1.00 . A A . 12 PHE HZ 1 1
17 3738 1 1 12 PHE N N -5.300 2.086 -0.293 1.00 . A A . 12 PHE N 1 1
17 3739 1 1 12 PHE O O -7.216 2.315 1.576 1.00 . A A . 12 PHE O 1 1
17 3740 1 1 13 PRO C C -10.016 3.413 2.163 1.00 . A A . 13 PRO C 1 1
17 3741 1 1 13 PRO CA C -9.128 4.368 1.364 1.00 . A A . 13 PRO CA 1 1
17 3742 1 1 13 PRO CB C -9.978 5.445 0.672 1.00 . A A . 13 PRO CB 1 1
17 3743 1 1 13 PRO CD C -8.830 4.266 -1.040 1.00 . A A . 13 PRO CD 1 1
17 3744 1 1 13 PRO CG C -9.362 5.614 -0.668 1.00 . A A . 13 PRO CG 1 1
17 3745 1 1 13 PRO HA H -8.443 4.846 2.045 1.00 . A A . 13 PRO HA 1 1
17 3746 1 1 13 PRO HB2 H -11.002 5.110 0.601 1.00 . A A . 13 PRO HB2 1 1
17 3747 1 1 13 PRO HB3 H -9.936 6.364 1.241 1.00 . A A . 13 PRO HB3 1 1
17 3748 1 1 13 PRO HD2 H -9.616 3.663 -1.467 1.00 . A A . 13 PRO HD2 1 1
17 3749 1 1 13 PRO HD3 H -8.008 4.367 -1.729 1.00 . A A . 13 PRO HD3 1 1
17 3750 1 1 13 PRO HG2 H -10.107 5.938 -1.379 1.00 . A A . 13 PRO HG2 1 1
17 3751 1 1 13 PRO HG3 H -8.558 6.332 -0.613 1.00 . A A . 13 PRO HG3 1 1
17 3752 1 1 13 PRO N N -8.391 3.733 0.260 1.00 . A A . 13 PRO N 1 1
17 3753 1 1 13 PRO O O -10.481 3.761 3.242 1.00 . A A . 13 PRO O 1 1
17 3754 1 1 14 ASP C C -10.266 0.486 3.406 1.00 . A A . 14 ASP C 1 1
17 3755 1 1 14 ASP CA C -11.079 1.243 2.367 1.00 . A A . 14 ASP CA 1 1
17 3756 1 1 14 ASP CB C -11.772 0.246 1.418 1.00 . A A . 14 ASP CB 1 1
17 3757 1 1 14 ASP CG C -10.832 -0.755 0.791 1.00 . A A . 14 ASP CG 1 1
17 3758 1 1 14 ASP H H -9.821 1.963 0.804 1.00 . A A . 14 ASP H 1 1
17 3759 1 1 14 ASP HA H -11.833 1.813 2.891 1.00 . A A . 14 ASP HA 1 1
17 3760 1 1 14 ASP HB2 H -12.516 -0.305 1.974 1.00 . A A . 14 ASP HB2 1 1
17 3761 1 1 14 ASP HB3 H -12.267 0.796 0.631 1.00 . A A . 14 ASP HB3 1 1
17 3762 1 1 14 ASP N N -10.235 2.209 1.657 1.00 . A A . 14 ASP N 1 1
17 3763 1 1 14 ASP O O -10.803 -0.320 4.163 1.00 . A A . 14 ASP O 1 1
17 3764 1 1 14 ASP OD1 O -10.089 -0.387 -0.126 1.00 . A A . 14 ASP OD1 1 1
17 3765 1 1 14 ASP OD2 O -10.859 -1.941 1.167 1.00 . A A . 14 ASP OD2 1 1
17 3766 2 2 1 . C C -1.999 1.449 3.448 1.00 . B A . 101 WMH C 1 1
17 3767 2 2 1 . C1 C -1.483 3.115 1.770 1.00 . B A . 101 WMH C1 1 1
17 3768 2 2 1 . C2 C -0.376 3.826 1.438 1.00 . B A . 101 WMH C2 1 1
17 3769 2 2 1 . H1 H -2.285 1.850 4.406 1.00 . B A . 101 WMH H1 1 1
17 3770 2 2 1 . H2 H -2.901 1.396 2.860 1.00 . B A . 101 WMH H2 1 1
17 3771 2 2 1 . H5 H -0.300 4.537 0.628 1.00 . B A . 101 WMH H5 1 1
17 3772 2 2 1 . N N -1.173 2.356 2.803 1.00 . B A . 101 WMH N 1 1
17 3773 2 2 1 . N1 N 0.597 3.496 2.282 1.00 . B A . 101 WMH N1 1 1
17 3774 2 2 1 . N2 N 0.162 2.619 3.119 1.00 . B A . 101 WMH N2 1 1
18 3775 1 1 1 GLY C C -7.407 -0.904 4.060 1.00 . A A . 1 GLY C 1 1
18 3776 1 1 1 GLY CA C -8.428 0.169 4.261 1.00 . A A . 1 GLY CA 1 1
18 3777 1 1 1 GLY H1 H -8.724 1.092 2.397 1.00 . A A . 1 GLY H1 1 1
18 3778 1 1 1 GLY HA2 H -7.937 1.063 4.616 1.00 . A A . 1 GLY HA2 1 1
18 3779 1 1 1 GLY HA3 H -9.144 -0.161 4.997 1.00 . A A . 1 GLY HA3 1 1
18 3780 1 1 1 GLY N N -9.120 0.472 3.046 1.00 . A A . 1 GLY N 1 1
18 3781 1 1 1 GLY O O -7.554 -2.014 4.561 1.00 . A A . 1 GLY O 1 1
18 3782 1 1 2 ARG C C -4.097 -0.667 2.716 1.00 . A A . 2 ARG C 1 1
18 3783 1 1 2 ARG CA C -5.315 -1.501 3.038 1.00 . A A . 2 ARG CA 1 1
18 3784 1 1 2 ARG CB C -5.640 -2.437 1.859 1.00 . A A . 2 ARG CB 1 1
18 3785 1 1 2 ARG CD C -4.927 -4.350 0.397 1.00 . A A . 2 ARG CD 1 1
18 3786 1 1 2 ARG CG C -4.585 -3.502 1.605 1.00 . A A . 2 ARG CG 1 1
18 3787 1 1 2 ARG CZ C -3.854 -6.200 -0.895 1.00 . A A . 2 ARG CZ 1 1
18 3788 1 1 2 ARG H H -6.362 0.291 2.869 1.00 . A A . 2 ARG H 1 1
18 3789 1 1 2 ARG HA H -5.137 -2.081 3.929 1.00 . A A . 2 ARG HA 1 1
18 3790 1 1 2 ARG HB2 H -6.579 -2.933 2.059 1.00 . A A . 2 ARG HB2 1 1
18 3791 1 1 2 ARG HB3 H -5.748 -1.845 0.963 1.00 . A A . 2 ARG HB3 1 1
18 3792 1 1 2 ARG HD2 H -5.912 -4.768 0.542 1.00 . A A . 2 ARG HD2 1 1
18 3793 1 1 2 ARG HD3 H -4.926 -3.723 -0.483 1.00 . A A . 2 ARG HD3 1 1
18 3794 1 1 2 ARG HE H -3.394 -5.620 0.990 1.00 . A A . 2 ARG HE 1 1
18 3795 1 1 2 ARG HG2 H -3.635 -3.018 1.433 1.00 . A A . 2 ARG HG2 1 1
18 3796 1 1 2 ARG HG3 H -4.512 -4.138 2.475 1.00 . A A . 2 ARG HG3 1 1
18 3797 1 1 2 ARG HH11 H -5.214 -5.145 -2.022 1.00 . A A . 2 ARG HH11 1 1
18 3798 1 1 2 ARG HH12 H -4.505 -6.466 -2.820 1.00 . A A . 2 ARG HH12 1 1
18 3799 1 1 2 ARG HH21 H -2.427 -7.477 -0.136 1.00 . A A . 2 ARG HH21 1 1
18 3800 1 1 2 ARG HH22 H -2.927 -7.822 -1.720 1.00 . A A . 2 ARG HH22 1 1
18 3801 1 1 2 ARG N N -6.404 -0.595 3.292 1.00 . A A . 2 ARG N 1 1
18 3802 1 1 2 ARG NE N -3.961 -5.442 0.206 1.00 . A A . 2 ARG NE 1 1
18 3803 1 1 2 ARG NH1 N -4.574 -5.917 -1.982 1.00 . A A . 2 ARG NH1 1 1
18 3804 1 1 2 ARG NH2 N -3.008 -7.226 -0.916 1.00 . A A . 2 ARG NH2 1 1
18 3805 1 1 2 ARG O O -4.226 0.374 2.090 1.00 . A A . 2 ARG O 1 1
18 3806 1 1 3 ALA C C -0.664 -1.362 2.479 1.00 . A A . 3 ALA C 1 1
18 3807 1 1 3 ALA CA C -1.717 -0.386 2.905 1.00 . A A . 3 ALA CA 1 1
18 3808 1 1 3 ALA CB C -1.301 0.432 4.135 1.00 . A A . 3 ALA CB 1 1
18 3809 1 1 3 ALA H H -2.915 -1.918 3.685 1.00 . A A . 3 ALA H 1 1
18 3810 1 1 3 ALA HA H -1.895 0.289 2.081 1.00 . A A . 3 ALA HA 1 1
18 3811 1 1 3 ALA HB1 H -0.233 0.585 4.108 1.00 . A A . 3 ALA HB1 1 1
18 3812 1 1 3 ALA HB2 H -1.561 -0.120 5.026 1.00 . A A . 3 ALA HB2 1 1
18 3813 1 1 3 ALA N N -2.956 -1.086 3.159 1.00 . A A . 3 ALA N 1 1
18 3814 1 1 3 ALA O O -0.595 -2.472 3.018 1.00 . A A . 3 ALA O 1 1
18 3815 1 1 4 THR C C 2.278 -2.033 1.913 1.00 . A A . 4 THR C 1 1
18 3816 1 1 4 THR CA C 1.121 -1.857 0.950 1.00 . A A . 4 THR CA 1 1
18 3817 1 1 4 THR CB C 1.624 -1.365 -0.424 1.00 . A A . 4 THR CB 1 1
18 3818 1 1 4 THR CG2 C 0.494 -1.408 -1.442 1.00 . A A . 4 THR CG2 1 1
18 3819 1 1 4 THR H H 0.045 -0.088 1.091 1.00 . A A . 4 THR H 1 1
18 3820 1 1 4 THR HA H 0.642 -2.813 0.813 1.00 . A A . 4 THR HA 1 1
18 3821 1 1 4 THR HB H 2.421 -2.016 -0.756 1.00 . A A . 4 THR HB 1 1
18 3822 1 1 4 THR HG1 H 2.955 0.015 -0.808 1.00 . A A . 4 THR HG1 1 1
18 3823 1 1 4 THR HG21 H -0.295 -0.742 -1.124 1.00 . A A . 4 THR HG21 1 1
18 3824 1 1 4 THR HG22 H 0.102 -2.413 -1.496 1.00 . A A . 4 THR HG22 1 1
18 3825 1 1 4 THR HG23 H 0.849 -1.107 -2.414 1.00 . A A . 4 THR HG23 1 1
18 3826 1 1 4 THR N N 0.122 -0.983 1.493 1.00 . A A . 4 THR N 1 1
18 3827 1 1 4 THR O O 2.777 -1.058 2.509 1.00 . A A . 4 THR O 1 1
18 3828 1 1 4 THR OG1 O 2.123 -0.015 -0.316 1.00 . A A . 4 THR OG1 1 1
18 3829 1 1 5 LYS C C 5.078 -3.480 2.234 1.00 . A A . 5 LYS C 1 1
18 3830 1 1 5 LYS CA C 3.771 -3.557 2.991 1.00 . A A . 5 LYS CA 1 1
18 3831 1 1 5 LYS CB C 3.583 -4.922 3.651 1.00 . A A . 5 LYS CB 1 1
18 3832 1 1 5 LYS CD C 2.174 -6.385 5.134 1.00 . A A . 5 LYS CD 1 1
18 3833 1 1 5 LYS CE C 0.908 -6.472 5.970 1.00 . A A . 5 LYS CE 1 1
18 3834 1 1 5 LYS CG C 2.329 -5.012 4.513 1.00 . A A . 5 LYS CG 1 1
18 3835 1 1 5 LYS H H 2.214 -3.986 1.633 1.00 . A A . 5 LYS H 1 1
18 3836 1 1 5 LYS HA H 3.784 -2.795 3.756 1.00 . A A . 5 LYS HA 1 1
18 3837 1 1 5 LYS HB2 H 3.528 -5.681 2.883 1.00 . A A . 5 LYS HB2 1 1
18 3838 1 1 5 LYS HB3 H 4.438 -5.119 4.279 1.00 . A A . 5 LYS HB3 1 1
18 3839 1 1 5 LYS HD2 H 2.126 -7.125 4.348 1.00 . A A . 5 LYS HD2 1 1
18 3840 1 1 5 LYS HD3 H 3.027 -6.584 5.765 1.00 . A A . 5 LYS HD3 1 1
18 3841 1 1 5 LYS HE2 H 0.971 -5.749 6.771 1.00 . A A . 5 LYS HE2 1 1
18 3842 1 1 5 LYS HE3 H 0.060 -6.237 5.345 1.00 . A A . 5 LYS HE3 1 1
18 3843 1 1 5 LYS HG2 H 2.394 -4.278 5.303 1.00 . A A . 5 LYS HG2 1 1
18 3844 1 1 5 LYS HG3 H 1.467 -4.800 3.898 1.00 . A A . 5 LYS HG3 1 1
18 3845 1 1 5 LYS HZ1 H 1.513 -8.042 7.191 1.00 . A A . 5 LYS HZ1 1 1
18 3846 1 1 5 LYS HZ2 H 0.694 -8.552 5.820 1.00 . A A . 5 LYS HZ2 1 1
18 3847 1 1 5 LYS HZ3 H -0.154 -7.856 7.110 1.00 . A A . 5 LYS HZ3 1 1
18 3848 1 1 5 LYS N N 2.675 -3.259 2.107 1.00 . A A . 5 LYS N 1 1
18 3849 1 1 5 LYS NZ N 0.726 -7.816 6.555 1.00 . A A . 5 LYS NZ 1 1
18 3850 1 1 5 LYS O O 6.138 -3.300 2.817 1.00 . A A . 5 LYS O 1 1
18 3851 1 1 6 SER C C 6.108 -2.101 -0.568 1.00 . A A . 6 SER C 1 1
18 3852 1 1 6 SER CA C 6.118 -3.486 0.076 1.00 . A A . 6 SER CA 1 1
18 3853 1 1 6 SER CB C 6.065 -4.596 -0.972 1.00 . A A . 6 SER CB 1 1
18 3854 1 1 6 SER H H 4.127 -3.796 0.507 1.00 . A A . 6 SER H 1 1
18 3855 1 1 6 SER HA H 7.016 -3.599 0.666 1.00 . A A . 6 SER HA 1 1
18 3856 1 1 6 SER HB2 H 6.764 -4.378 -1.766 1.00 . A A . 6 SER HB2 1 1
18 3857 1 1 6 SER HB3 H 6.326 -5.537 -0.509 1.00 . A A . 6 SER HB3 1 1
18 3858 1 1 6 SER HG H 4.785 -4.397 -2.438 1.00 . A A . 6 SER HG 1 1
18 3859 1 1 6 SER N N 4.988 -3.612 0.939 1.00 . A A . 6 SER N 1 1
18 3860 1 1 6 SER O O 5.039 -1.462 -0.663 1.00 . A A . 6 SER O 1 1
18 3861 1 1 6 SER OG O 4.758 -4.706 -1.522 1.00 . A A . 6 SER OG 1 1
18 3862 1 1 7 ILE C C 6.811 -0.342 -3.018 1.00 . A A . 7 ILE C 1 1
18 3863 1 1 7 ILE CA C 7.370 -0.320 -1.598 1.00 . A A . 7 ILE CA 1 1
18 3864 1 1 7 ILE CB C 8.821 0.281 -1.547 1.00 . A A . 7 ILE CB 1 1
18 3865 1 1 7 ILE CD1 C 9.968 -1.155 -3.406 1.00 . A A . 7 ILE CD1 1 1
18 3866 1 1 7 ILE CG1 C 9.935 -0.735 -1.947 1.00 . A A . 7 ILE CG1 1 1
18 3867 1 1 7 ILE CG2 C 9.103 0.874 -0.183 1.00 . A A . 7 ILE CG2 1 1
18 3868 1 1 7 ILE H H 8.081 -2.142 -0.812 1.00 . A A . 7 ILE H 1 1
18 3869 1 1 7 ILE HA H 6.719 0.330 -1.029 1.00 . A A . 7 ILE HA 1 1
18 3870 1 1 7 ILE HB H 8.837 1.105 -2.245 1.00 . A A . 7 ILE HB 1 1
18 3871 1 1 7 ILE HD11 H 10.124 -0.289 -4.031 1.00 . A A . 7 ILE HD11 1 1
18 3872 1 1 7 ILE HD12 H 9.026 -1.618 -3.668 1.00 . A A . 7 ILE HD12 1 1
18 3873 1 1 7 ILE HD13 H 10.769 -1.863 -3.562 1.00 . A A . 7 ILE HD13 1 1
18 3874 1 1 7 ILE HG12 H 10.897 -0.301 -1.723 1.00 . A A . 7 ILE HG12 1 1
18 3875 1 1 7 ILE HG13 H 9.818 -1.624 -1.345 1.00 . A A . 7 ILE HG13 1 1
18 3876 1 1 7 ILE HG21 H 10.106 1.273 -0.164 1.00 . A A . 7 ILE HG21 1 1
18 3877 1 1 7 ILE HG22 H 9.001 0.108 0.571 1.00 . A A . 7 ILE HG22 1 1
18 3878 1 1 7 ILE HG23 H 8.398 1.667 0.021 1.00 . A A . 7 ILE HG23 1 1
18 3879 1 1 7 ILE N N 7.266 -1.615 -0.956 1.00 . A A . 7 ILE N 1 1
18 3880 1 1 7 ILE O O 6.784 -1.401 -3.661 1.00 . A A . 7 ILE O 1 1
18 3881 1 1 8 PRO C C 5.004 2.063 -1.802 1.00 . A A . 8 PRO C 1 1
18 3882 1 1 8 PRO CA C 6.213 2.048 -2.767 1.00 . A A . 8 PRO CA 1 1
18 3883 1 1 8 PRO CB C 6.012 3.080 -3.883 1.00 . A A . 8 PRO CB 1 1
18 3884 1 1 8 PRO CD C 5.792 0.930 -4.898 1.00 . A A . 8 PRO CD 1 1
18 3885 1 1 8 PRO CG C 5.270 2.337 -4.934 1.00 . A A . 8 PRO CG 1 1
18 3886 1 1 8 PRO HA H 7.124 2.257 -2.228 1.00 . A A . 8 PRO HA 1 1
18 3887 1 1 8 PRO HB2 H 5.444 3.917 -3.507 1.00 . A A . 8 PRO HB2 1 1
18 3888 1 1 8 PRO HB3 H 6.972 3.420 -4.246 1.00 . A A . 8 PRO HB3 1 1
18 3889 1 1 8 PRO HD2 H 4.994 0.228 -5.086 1.00 . A A . 8 PRO HD2 1 1
18 3890 1 1 8 PRO HD3 H 6.587 0.798 -5.617 1.00 . A A . 8 PRO HD3 1 1
18 3891 1 1 8 PRO HG2 H 4.212 2.349 -4.711 1.00 . A A . 8 PRO HG2 1 1
18 3892 1 1 8 PRO HG3 H 5.455 2.780 -5.901 1.00 . A A . 8 PRO HG3 1 1
18 3893 1 1 8 PRO N N 6.303 0.783 -3.522 1.00 . A A . 8 PRO N 1 1
18 3894 1 1 8 PRO O O 4.076 1.252 -1.957 1.00 . A A . 8 PRO O 1 1
18 3895 1 1 9 PRO C C 2.658 3.597 -0.579 1.00 . A A . 9 PRO C 1 1
18 3896 1 1 9 PRO CA C 3.891 3.091 0.147 1.00 . A A . 9 PRO CA 1 1
18 3897 1 1 9 PRO CB C 4.376 4.139 1.151 1.00 . A A . 9 PRO CB 1 1
18 3898 1 1 9 PRO CD C 6.129 3.819 -0.407 1.00 . A A . 9 PRO CD 1 1
18 3899 1 1 9 PRO CG C 5.852 4.109 1.034 1.00 . A A . 9 PRO CG 1 1
18 3900 1 1 9 PRO HA H 3.653 2.167 0.652 1.00 . A A . 9 PRO HA 1 1
18 3901 1 1 9 PRO HB2 H 3.972 5.105 0.883 1.00 . A A . 9 PRO HB2 1 1
18 3902 1 1 9 PRO HB3 H 4.051 3.874 2.146 1.00 . A A . 9 PRO HB3 1 1
18 3903 1 1 9 PRO HD2 H 6.112 4.731 -0.987 1.00 . A A . 9 PRO HD2 1 1
18 3904 1 1 9 PRO HD3 H 7.077 3.315 -0.511 1.00 . A A . 9 PRO HD3 1 1
18 3905 1 1 9 PRO HG2 H 6.261 5.067 1.314 1.00 . A A . 9 PRO HG2 1 1
18 3906 1 1 9 PRO HG3 H 6.259 3.328 1.658 1.00 . A A . 9 PRO HG3 1 1
18 3907 1 1 9 PRO N N 5.017 2.937 -0.777 1.00 . A A . 9 PRO N 1 1
18 3908 1 1 9 PRO O O 2.634 4.720 -1.104 1.00 . A A . 9 PRO O 1 1
18 3909 1 1 10 ARG C C -0.660 2.489 -0.484 1.00 . A A . 10 ARG C 1 1
18 3910 1 1 10 ARG CA C 0.454 3.060 -1.309 1.00 . A A . 10 ARG CA 1 1
18 3911 1 1 10 ARG CB C 0.480 2.448 -2.701 1.00 . A A . 10 ARG CB 1 1
18 3912 1 1 10 ARG CD C -0.643 1.941 -4.856 1.00 . A A . 10 ARG CD 1 1
18 3913 1 1 10 ARG CG C -0.821 2.520 -3.470 1.00 . A A . 10 ARG CG 1 1
18 3914 1 1 10 ARG CZ C -0.300 -0.410 -5.607 1.00 . A A . 10 ARG CZ 1 1
18 3915 1 1 10 ARG H H 1.763 1.861 -0.264 1.00 . A A . 10 ARG H 1 1
18 3916 1 1 10 ARG HA H 0.344 4.131 -1.389 1.00 . A A . 10 ARG HA 1 1
18 3917 1 1 10 ARG HB2 H 1.241 2.943 -3.285 1.00 . A A . 10 ARG HB2 1 1
18 3918 1 1 10 ARG HB3 H 0.750 1.409 -2.594 1.00 . A A . 10 ARG HB3 1 1
18 3919 1 1 10 ARG HD2 H -1.613 1.858 -5.320 1.00 . A A . 10 ARG HD2 1 1
18 3920 1 1 10 ARG HD3 H -0.019 2.603 -5.438 1.00 . A A . 10 ARG HD3 1 1
18 3921 1 1 10 ARG HE H 0.691 0.501 -4.133 1.00 . A A . 10 ARG HE 1 1
18 3922 1 1 10 ARG HG2 H -1.574 1.954 -2.941 1.00 . A A . 10 ARG HG2 1 1
18 3923 1 1 10 ARG HG3 H -1.133 3.550 -3.551 1.00 . A A . 10 ARG HG3 1 1
18 3924 1 1 10 ARG HH11 H -1.770 0.540 -6.663 1.00 . A A . 10 ARG HH11 1 1
18 3925 1 1 10 ARG HH12 H -1.492 -1.063 -7.138 1.00 . A A . 10 ARG HH12 1 1
18 3926 1 1 10 ARG HH21 H 1.075 -1.659 -4.777 1.00 . A A . 10 ARG HH21 1 1
18 3927 1 1 10 ARG HH22 H 0.201 -2.330 -6.063 1.00 . A A . 10 ARG HH22 1 1
18 3928 1 1 10 ARG N N 1.679 2.761 -0.656 1.00 . A A . 10 ARG N 1 1
18 3929 1 1 10 ARG NE N -0.016 0.612 -4.811 1.00 . A A . 10 ARG NE 1 1
18 3930 1 1 10 ARG NH1 N -1.243 -0.303 -6.531 1.00 . A A . 10 ARG NH1 1 1
18 3931 1 1 10 ARG NH2 N 0.360 -1.536 -5.471 1.00 . A A . 10 ARG NH2 1 1
18 3932 1 1 10 ARG O O -0.566 1.353 -0.003 1.00 . A A . 10 ARG O 1 1
18 3933 1 1 11 ALA C C -4.029 2.865 -0.246 1.00 . A A . 11 ALA C 1 1
18 3934 1 1 11 ALA CA C -2.757 2.805 0.537 1.00 . A A . 11 ALA CA 1 1
18 3935 1 1 11 ALA CB C -2.867 3.567 1.874 1.00 . A A . 11 ALA CB 1 1
18 3936 1 1 11 ALA H H -1.734 4.164 -0.645 1.00 . A A . 11 ALA H 1 1
18 3937 1 1 11 ALA HA H -2.560 1.765 0.752 1.00 . A A . 11 ALA HA 1 1
18 3938 1 1 11 ALA HB1 H -3.598 3.074 2.495 1.00 . A A . 11 ALA HB1 1 1
18 3939 1 1 11 ALA HB2 H -3.191 4.585 1.740 1.00 . A A . 11 ALA HB2 1 1
18 3940 1 1 11 ALA N N -1.678 3.261 -0.263 1.00 . A A . 11 ALA N 1 1
18 3941 1 1 11 ALA O O -4.196 3.714 -1.134 1.00 . A A . 11 ALA O 1 1
18 3942 1 1 12 PHE C C -7.277 2.313 0.215 1.00 . A A . 12 PHE C 1 1
18 3943 1 1 12 PHE CA C -6.134 1.825 -0.654 1.00 . A A . 12 PHE CA 1 1
18 3944 1 1 12 PHE CB C -6.336 0.355 -1.043 1.00 . A A . 12 PHE CB 1 1
18 3945 1 1 12 PHE CD1 C -5.259 -0.061 -3.274 1.00 . A A . 12 PHE CD1 1 1
18 3946 1 1 12 PHE CD2 C -4.177 -0.915 -1.331 1.00 . A A . 12 PHE CD2 1 1
18 3947 1 1 12 PHE CE1 C -4.252 -0.583 -4.062 1.00 . A A . 12 PHE CE1 1 1
18 3948 1 1 12 PHE CE2 C -3.169 -1.438 -2.114 1.00 . A A . 12 PHE CE2 1 1
18 3949 1 1 12 PHE CG C -5.235 -0.217 -1.901 1.00 . A A . 12 PHE CG 1 1
18 3950 1 1 12 PHE CZ C -3.207 -1.273 -3.481 1.00 . A A . 12 PHE CZ 1 1
18 3951 1 1 12 PHE H H -4.706 1.412 0.848 1.00 . A A . 12 PHE H 1 1
18 3952 1 1 12 PHE HA H -6.078 2.424 -1.551 1.00 . A A . 12 PHE HA 1 1
18 3953 1 1 12 PHE HB2 H -6.398 -0.236 -0.142 1.00 . A A . 12 PHE HB2 1 1
18 3954 1 1 12 PHE HB3 H -7.266 0.263 -1.585 1.00 . A A . 12 PHE HB3 1 1
18 3955 1 1 12 PHE HD1 H -6.075 0.481 -3.731 1.00 . A A . 12 PHE HD1 1 1
18 3956 1 1 12 PHE HD2 H -4.143 -1.044 -0.260 1.00 . A A . 12 PHE HD2 1 1
18 3957 1 1 12 PHE HE1 H -4.285 -0.453 -5.132 1.00 . A A . 12 PHE HE1 1 1
18 3958 1 1 12 PHE HE2 H -2.351 -1.978 -1.658 1.00 . A A . 12 PHE HE2 1 1
18 3959 1 1 12 PHE HZ H -2.420 -1.682 -4.099 1.00 . A A . 12 PHE HZ 1 1
18 3960 1 1 12 PHE N N -4.900 1.980 0.063 1.00 . A A . 12 PHE N 1 1
18 3961 1 1 12 PHE O O -7.293 2.038 1.420 1.00 . A A . 12 PHE O 1 1
18 3962 1 1 13 PRO C C -10.245 2.668 1.154 1.00 . A A . 13 PRO C 1 1
18 3963 1 1 13 PRO CA C -9.380 3.657 0.359 1.00 . A A . 13 PRO CA 1 1
18 3964 1 1 13 PRO CB C -10.216 4.317 -0.753 1.00 . A A . 13 PRO CB 1 1
18 3965 1 1 13 PRO CD C -8.354 3.297 -1.823 1.00 . A A . 13 PRO CD 1 1
18 3966 1 1 13 PRO CG C -9.797 3.630 -2.006 1.00 . A A . 13 PRO CG 1 1
18 3967 1 1 13 PRO HA H -9.020 4.422 1.030 1.00 . A A . 13 PRO HA 1 1
18 3968 1 1 13 PRO HB2 H -11.267 4.163 -0.551 1.00 . A A . 13 PRO HB2 1 1
18 3969 1 1 13 PRO HB3 H -10.004 5.375 -0.793 1.00 . A A . 13 PRO HB3 1 1
18 3970 1 1 13 PRO HD2 H -8.095 2.420 -2.399 1.00 . A A . 13 PRO HD2 1 1
18 3971 1 1 13 PRO HD3 H -7.729 4.133 -2.100 1.00 . A A . 13 PRO HD3 1 1
18 3972 1 1 13 PRO HG2 H -10.376 2.729 -2.142 1.00 . A A . 13 PRO HG2 1 1
18 3973 1 1 13 PRO HG3 H -9.925 4.290 -2.852 1.00 . A A . 13 PRO HG3 1 1
18 3974 1 1 13 PRO N N -8.257 3.029 -0.376 1.00 . A A . 13 PRO N 1 1
18 3975 1 1 13 PRO O O -10.967 3.060 2.078 1.00 . A A . 13 PRO O 1 1
18 3976 1 1 14 ASP C C -10.271 -0.094 2.766 1.00 . A A . 14 ASP C 1 1
18 3977 1 1 14 ASP CA C -10.943 0.359 1.478 1.00 . A A . 14 ASP CA 1 1
18 3978 1 1 14 ASP CB C -11.142 -0.843 0.556 1.00 . A A . 14 ASP CB 1 1
18 3979 1 1 14 ASP CG C -9.868 -1.620 0.310 1.00 . A A . 14 ASP CG 1 1
18 3980 1 1 14 ASP H H -9.524 1.128 0.112 1.00 . A A . 14 ASP H 1 1
18 3981 1 1 14 ASP HA H -11.907 0.779 1.720 1.00 . A A . 14 ASP HA 1 1
18 3982 1 1 14 ASP HB2 H -11.868 -1.507 0.999 1.00 . A A . 14 ASP HB2 1 1
18 3983 1 1 14 ASP HB3 H -11.518 -0.491 -0.393 1.00 . A A . 14 ASP HB3 1 1
18 3984 1 1 14 ASP N N -10.151 1.399 0.820 1.00 . A A . 14 ASP N 1 1
18 3985 1 1 14 ASP O O -10.786 -0.960 3.482 1.00 . A A . 14 ASP O 1 1
18 3986 1 1 14 ASP OD1 O -9.733 -2.749 0.829 1.00 . A A . 14 ASP OD1 1 1
18 3987 1 1 14 ASP OD2 O -8.994 -1.121 -0.398 1.00 . A A . 14 ASP OD2 1 1
18 3988 2 2 1 . C C -1.977 1.797 4.189 1.00 . B A . 101 WMH C 1 1
18 3989 2 2 1 . C1 C -1.573 3.626 2.647 1.00 . B A . 101 WMH C1 1 1
18 3990 2 2 1 . C2 C -0.530 4.459 2.404 1.00 . B A . 101 WMH C2 1 1
18 3991 2 2 1 . H1 H -2.385 2.103 5.133 1.00 . B A . 101 WMH H1 1 1
18 3992 2 2 1 . H2 H -2.829 1.688 3.539 1.00 . B A . 101 WMH H2 1 1
18 3993 2 2 1 . H5 H -0.509 5.228 1.647 1.00 . B A . 101 WMH H5 1 1
18 3994 2 2 1 . N N -1.216 2.824 3.634 1.00 . B A . 101 WMH N 1 1
18 3995 2 2 1 . N1 N 0.452 4.172 3.241 1.00 . B A . 101 WMH N1 1 1
18 3996 2 2 1 . N2 N 0.088 3.194 4.003 1.00 . B A . 101 WMH N2 1 1
19 3997 1 1 1 GLY C C -7.552 -1.683 2.798 1.00 . A A . 1 GLY C 1 1
19 3998 1 1 1 GLY CA C -8.613 -0.890 3.513 1.00 . A A . 1 GLY CA 1 1
19 3999 1 1 1 GLY H1 H -8.817 0.678 2.118 1.00 . A A . 1 GLY H1 1 1
19 4000 1 1 1 GLY HA2 H -8.154 -0.316 4.303 1.00 . A A . 1 GLY HA2 1 1
19 4001 1 1 1 GLY HA3 H -9.327 -1.574 3.948 1.00 . A A . 1 GLY HA3 1 1
19 4002 1 1 1 GLY N N -9.313 0.010 2.637 1.00 . A A . 1 GLY N 1 1
19 4003 1 1 1 GLY O O -7.759 -2.853 2.477 1.00 . A A . 1 GLY O 1 1
19 4004 1 1 2 ARG C C -4.092 -0.778 1.970 1.00 . A A . 2 ARG C 1 1
19 4005 1 1 2 ARG CA C -5.297 -1.681 1.886 1.00 . A A . 2 ARG CA 1 1
19 4006 1 1 2 ARG CB C -5.590 -2.007 0.409 1.00 . A A . 2 ARG CB 1 1
19 4007 1 1 2 ARG CD C -3.948 -3.920 0.226 1.00 . A A . 2 ARG CD 1 1
19 4008 1 1 2 ARG CG C -4.406 -2.601 -0.366 1.00 . A A . 2 ARG CG 1 1
19 4009 1 1 2 ARG CZ C -2.120 -5.574 -0.099 1.00 . A A . 2 ARG CZ 1 1
19 4010 1 1 2 ARG H H -6.335 -0.111 2.808 1.00 . A A . 2 ARG H 1 1
19 4011 1 1 2 ARG HA H -5.088 -2.601 2.413 1.00 . A A . 2 ARG HA 1 1
19 4012 1 1 2 ARG HB2 H -6.405 -2.714 0.374 1.00 . A A . 2 ARG HB2 1 1
19 4013 1 1 2 ARG HB3 H -5.899 -1.100 -0.088 1.00 . A A . 2 ARG HB3 1 1
19 4014 1 1 2 ARG HD2 H -3.639 -3.751 1.247 1.00 . A A . 2 ARG HD2 1 1
19 4015 1 1 2 ARG HD3 H -4.774 -4.613 0.210 1.00 . A A . 2 ARG HD3 1 1
19 4016 1 1 2 ARG HE H -2.616 -4.062 -1.362 1.00 . A A . 2 ARG HE 1 1
19 4017 1 1 2 ARG HG2 H -4.698 -2.760 -1.393 1.00 . A A . 2 ARG HG2 1 1
19 4018 1 1 2 ARG HG3 H -3.587 -1.897 -0.335 1.00 . A A . 2 ARG HG3 1 1
19 4019 1 1 2 ARG HH11 H -3.183 -5.865 1.643 1.00 . A A . 2 ARG HH11 1 1
19 4020 1 1 2 ARG HH12 H -1.915 -6.968 1.377 1.00 . A A . 2 ARG HH12 1 1
19 4021 1 1 2 ARG HH21 H -0.827 -5.659 -1.727 1.00 . A A . 2 ARG HH21 1 1
19 4022 1 1 2 ARG HH22 H -0.590 -6.856 -0.541 1.00 . A A . 2 ARG HH22 1 1
19 4023 1 1 2 ARG N N -6.432 -1.049 2.535 1.00 . A A . 2 ARG N 1 1
19 4024 1 1 2 ARG NE N -2.823 -4.507 -0.508 1.00 . A A . 2 ARG NE 1 1
19 4025 1 1 2 ARG NH1 N -2.433 -6.172 1.052 1.00 . A A . 2 ARG NH1 1 1
19 4026 1 1 2 ARG NH2 N -1.113 -6.053 -0.845 1.00 . A A . 2 ARG NH2 1 1
19 4027 1 1 2 ARG O O -4.176 0.392 1.631 1.00 . A A . 2 ARG O 1 1
19 4028 1 1 3 ALA C C -0.634 -1.632 2.222 1.00 . A A . 3 ALA C 1 1
19 4029 1 1 3 ALA CA C -1.732 -0.659 2.511 1.00 . A A . 3 ALA CA 1 1
19 4030 1 1 3 ALA CB C -1.524 0.025 3.875 1.00 . A A . 3 ALA CB 1 1
19 4031 1 1 3 ALA H H -3.028 -2.246 2.786 1.00 . A A . 3 ALA H 1 1
19 4032 1 1 3 ALA HA H -1.723 0.098 1.739 1.00 . A A . 3 ALA HA 1 1
19 4033 1 1 3 ALA HB1 H -0.472 -0.002 4.119 1.00 . A A . 3 ALA HB1 1 1
19 4034 1 1 3 ALA HB2 H -2.070 -0.527 4.624 1.00 . A A . 3 ALA HB2 1 1
19 4035 1 1 3 ALA N N -3.008 -1.325 2.443 1.00 . A A . 3 ALA N 1 1
19 4036 1 1 3 ALA O O -0.638 -2.765 2.722 1.00 . A A . 3 ALA O 1 1
19 4037 1 1 4 THR C C 2.532 -1.717 1.998 1.00 . A A . 4 THR C 1 1
19 4038 1 1 4 THR CA C 1.373 -2.069 1.097 1.00 . A A . 4 THR CA 1 1
19 4039 1 1 4 THR CB C 1.761 -1.997 -0.398 1.00 . A A . 4 THR CB 1 1
19 4040 1 1 4 THR CG2 C 0.668 -2.613 -1.256 1.00 . A A . 4 THR CG2 1 1
19 4041 1 1 4 THR H H 0.222 -0.366 0.951 1.00 . A A . 4 THR H 1 1
19 4042 1 1 4 THR HA H 1.067 -3.079 1.324 1.00 . A A . 4 THR HA 1 1
19 4043 1 1 4 THR HB H 2.673 -2.556 -0.546 1.00 . A A . 4 THR HB 1 1
19 4044 1 1 4 THR HG1 H 2.859 -0.594 -1.163 1.00 . A A . 4 THR HG1 1 1
19 4045 1 1 4 THR HG21 H -0.258 -2.076 -1.100 1.00 . A A . 4 THR HG21 1 1
19 4046 1 1 4 THR HG22 H 0.533 -3.649 -0.988 1.00 . A A . 4 THR HG22 1 1
19 4047 1 1 4 THR HG23 H 0.954 -2.538 -2.294 1.00 . A A . 4 THR HG23 1 1
19 4048 1 1 4 THR N N 0.273 -1.239 1.395 1.00 . A A . 4 THR N 1 1
19 4049 1 1 4 THR O O 2.952 -0.562 2.077 1.00 . A A . 4 THR O 1 1
19 4050 1 1 4 THR OG1 O 1.965 -0.640 -0.799 1.00 . A A . 4 THR OG1 1 1
19 4051 1 1 5 LYS C C 5.430 -2.609 2.834 1.00 . A A . 5 LYS C 1 1
19 4052 1 1 5 LYS CA C 4.132 -2.513 3.615 1.00 . A A . 5 LYS CA 1 1
19 4053 1 1 5 LYS CB C 4.095 -3.543 4.743 1.00 . A A . 5 LYS CB 1 1
19 4054 1 1 5 LYS CD C 2.830 -4.495 6.727 1.00 . A A . 5 LYS CD 1 1
19 4055 1 1 5 LYS CE C 3.908 -4.130 7.743 1.00 . A A . 5 LYS CE 1 1
19 4056 1 1 5 LYS CG C 2.797 -3.522 5.551 1.00 . A A . 5 LYS CG 1 1
19 4057 1 1 5 LYS H H 2.628 -3.602 2.619 1.00 . A A . 5 LYS H 1 1
19 4058 1 1 5 LYS HA H 4.049 -1.520 4.032 1.00 . A A . 5 LYS HA 1 1
19 4059 1 1 5 LYS HB2 H 4.216 -4.527 4.314 1.00 . A A . 5 LYS HB2 1 1
19 4060 1 1 5 LYS HB3 H 4.919 -3.342 5.410 1.00 . A A . 5 LYS HB3 1 1
19 4061 1 1 5 LYS HD2 H 1.869 -4.482 7.218 1.00 . A A . 5 LYS HD2 1 1
19 4062 1 1 5 LYS HD3 H 3.025 -5.489 6.350 1.00 . A A . 5 LYS HD3 1 1
19 4063 1 1 5 LYS HE2 H 3.875 -4.848 8.548 1.00 . A A . 5 LYS HE2 1 1
19 4064 1 1 5 LYS HE3 H 4.876 -4.182 7.269 1.00 . A A . 5 LYS HE3 1 1
19 4065 1 1 5 LYS HG2 H 2.633 -2.525 5.933 1.00 . A A . 5 LYS HG2 1 1
19 4066 1 1 5 LYS HG3 H 1.981 -3.787 4.897 1.00 . A A . 5 LYS HG3 1 1
19 4067 1 1 5 LYS HZ1 H 2.816 -2.699 8.821 1.00 . A A . 5 LYS HZ1 1 1
19 4068 1 1 5 LYS HZ2 H 3.735 -2.052 7.564 1.00 . A A . 5 LYS HZ2 1 1
19 4069 1 1 5 LYS HZ3 H 4.489 -2.551 8.970 1.00 . A A . 5 LYS HZ3 1 1
19 4070 1 1 5 LYS N N 3.021 -2.708 2.711 1.00 . A A . 5 LYS N 1 1
19 4071 1 1 5 LYS NZ N 3.717 -2.776 8.309 1.00 . A A . 5 LYS NZ 1 1
19 4072 1 1 5 LYS O O 6.519 -2.391 3.359 1.00 . A A . 5 LYS O 1 1
19 4073 1 1 6 SER C C 6.525 -1.667 -0.017 1.00 . A A . 6 SER C 1 1
19 4074 1 1 6 SER CA C 6.344 -3.026 0.659 1.00 . A A . 6 SER CA 1 1
19 4075 1 1 6 SER CB C 5.969 -4.096 -0.353 1.00 . A A . 6 SER CB 1 1
19 4076 1 1 6 SER H H 4.389 -3.138 1.240 1.00 . A A . 6 SER H 1 1
19 4077 1 1 6 SER HA H 7.251 -3.322 1.165 1.00 . A A . 6 SER HA 1 1
19 4078 1 1 6 SER HB2 H 6.622 -4.020 -1.210 1.00 . A A . 6 SER HB2 1 1
19 4079 1 1 6 SER HB3 H 6.070 -5.071 0.097 1.00 . A A . 6 SER HB3 1 1
19 4080 1 1 6 SER HG H 4.649 -3.962 -1.756 1.00 . A A . 6 SER HG 1 1
19 4081 1 1 6 SER N N 5.283 -2.943 1.588 1.00 . A A . 6 SER N 1 1
19 4082 1 1 6 SER O O 5.671 -0.777 0.122 1.00 . A A . 6 SER O 1 1
19 4083 1 1 6 SER OG O 4.614 -3.931 -0.790 1.00 . A A . 6 SER OG 1 1
19 4084 1 1 7 ILE C C 7.585 -0.434 -2.902 1.00 . A A . 7 ILE C 1 1
19 4085 1 1 7 ILE CA C 7.852 -0.251 -1.408 1.00 . A A . 7 ILE CA 1 1
19 4086 1 1 7 ILE CB C 9.285 0.309 -1.162 1.00 . A A . 7 ILE CB 1 1
19 4087 1 1 7 ILE CD1 C 11.789 -0.275 -1.258 1.00 . A A . 7 ILE CD1 1 1
19 4088 1 1 7 ILE CG1 C 10.364 -0.757 -1.450 1.00 . A A . 7 ILE CG1 1 1
19 4089 1 1 7 ILE CG2 C 9.407 0.845 0.259 1.00 . A A . 7 ILE CG2 1 1
19 4090 1 1 7 ILE H H 8.288 -2.196 -0.770 1.00 . A A . 7 ILE H 1 1
19 4091 1 1 7 ILE HA H 7.131 0.457 -1.022 1.00 . A A . 7 ILE HA 1 1
19 4092 1 1 7 ILE HB H 9.422 1.139 -1.836 1.00 . A A . 7 ILE HB 1 1
19 4093 1 1 7 ILE HD11 H 11.977 0.555 -1.923 1.00 . A A . 7 ILE HD11 1 1
19 4094 1 1 7 ILE HD12 H 12.476 -1.079 -1.475 1.00 . A A . 7 ILE HD12 1 1
19 4095 1 1 7 ILE HD13 H 11.923 0.047 -0.236 1.00 . A A . 7 ILE HD13 1 1
19 4096 1 1 7 ILE HG12 H 10.214 -1.590 -0.781 1.00 . A A . 7 ILE HG12 1 1
19 4097 1 1 7 ILE HG13 H 10.258 -1.099 -2.470 1.00 . A A . 7 ILE HG13 1 1
19 4098 1 1 7 ILE HG21 H 9.207 0.049 0.958 1.00 . A A . 7 ILE HG21 1 1
19 4099 1 1 7 ILE HG22 H 8.695 1.643 0.407 1.00 . A A . 7 ILE HG22 1 1
19 4100 1 1 7 ILE HG23 H 10.407 1.219 0.417 1.00 . A A . 7 ILE HG23 1 1
19 4101 1 1 7 ILE N N 7.614 -1.484 -0.704 1.00 . A A . 7 ILE N 1 1
19 4102 1 1 7 ILE O O 7.981 -1.456 -3.484 1.00 . A A . 7 ILE O 1 1
19 4103 1 1 8 PRO C C 4.985 1.455 -2.192 1.00 . A A . 8 PRO C 1 1
19 4104 1 1 8 PRO CA C 6.339 1.717 -2.895 1.00 . A A . 8 PRO CA 1 1
19 4105 1 1 8 PRO CB C 6.132 2.699 -4.071 1.00 . A A . 8 PRO CB 1 1
19 4106 1 1 8 PRO CD C 6.554 0.501 -4.962 1.00 . A A . 8 PRO CD 1 1
19 4107 1 1 8 PRO CG C 6.553 1.960 -5.308 1.00 . A A . 8 PRO CG 1 1
19 4108 1 1 8 PRO HA H 7.043 2.138 -2.192 1.00 . A A . 8 PRO HA 1 1
19 4109 1 1 8 PRO HB2 H 5.091 2.981 -4.120 1.00 . A A . 8 PRO HB2 1 1
19 4110 1 1 8 PRO HB3 H 6.736 3.581 -3.915 1.00 . A A . 8 PRO HB3 1 1
19 4111 1 1 8 PRO HD2 H 5.580 0.068 -5.132 1.00 . A A . 8 PRO HD2 1 1
19 4112 1 1 8 PRO HD3 H 7.311 -0.027 -5.524 1.00 . A A . 8 PRO HD3 1 1
19 4113 1 1 8 PRO HG2 H 5.854 2.152 -6.110 1.00 . A A . 8 PRO HG2 1 1
19 4114 1 1 8 PRO HG3 H 7.543 2.279 -5.598 1.00 . A A . 8 PRO HG3 1 1
19 4115 1 1 8 PRO N N 6.878 0.515 -3.543 1.00 . A A . 8 PRO N 1 1
19 4116 1 1 8 PRO O O 4.194 0.591 -2.629 1.00 . A A . 8 PRO O 1 1
19 4117 1 1 9 PRO C C 2.292 2.714 -1.084 1.00 . A A . 9 PRO C 1 1
19 4118 1 1 9 PRO CA C 3.462 2.034 -0.361 1.00 . A A . 9 PRO CA 1 1
19 4119 1 1 9 PRO CB C 3.744 2.722 0.971 1.00 . A A . 9 PRO CB 1 1
19 4120 1 1 9 PRO CD C 5.609 3.160 -0.468 1.00 . A A . 9 PRO CD 1 1
19 4121 1 1 9 PRO CG C 4.797 3.725 0.665 1.00 . A A . 9 PRO CG 1 1
19 4122 1 1 9 PRO HA H 3.220 0.995 -0.194 1.00 . A A . 9 PRO HA 1 1
19 4123 1 1 9 PRO HB2 H 2.840 3.192 1.332 1.00 . A A . 9 PRO HB2 1 1
19 4124 1 1 9 PRO HB3 H 4.090 1.994 1.691 1.00 . A A . 9 PRO HB3 1 1
19 4125 1 1 9 PRO HD2 H 5.860 3.940 -1.170 1.00 . A A . 9 PRO HD2 1 1
19 4126 1 1 9 PRO HD3 H 6.502 2.684 -0.092 1.00 . A A . 9 PRO HD3 1 1
19 4127 1 1 9 PRO HG2 H 4.337 4.654 0.364 1.00 . A A . 9 PRO HG2 1 1
19 4128 1 1 9 PRO HG3 H 5.418 3.876 1.533 1.00 . A A . 9 PRO HG3 1 1
19 4129 1 1 9 PRO N N 4.710 2.172 -1.094 1.00 . A A . 9 PRO N 1 1
19 4130 1 1 9 PRO O O 2.369 3.895 -1.467 1.00 . A A . 9 PRO O 1 1
19 4131 1 1 10 ARG C C -1.079 2.136 -0.965 1.00 . A A . 10 ARG C 1 1
19 4132 1 1 10 ARG CA C 0.042 2.439 -1.923 1.00 . A A . 10 ARG CA 1 1
19 4133 1 1 10 ARG CB C -0.211 1.723 -3.266 1.00 . A A . 10 ARG CB 1 1
19 4134 1 1 10 ARG CD C 1.192 3.309 -4.645 1.00 . A A . 10 ARG CD 1 1
19 4135 1 1 10 ARG CG C 0.922 1.855 -4.281 1.00 . A A . 10 ARG CG 1 1
19 4136 1 1 10 ARG CZ C -0.115 5.269 -5.468 1.00 . A A . 10 ARG CZ 1 1
19 4137 1 1 10 ARG H H 1.302 1.011 -1.043 1.00 . A A . 10 ARG H 1 1
19 4138 1 1 10 ARG HA H 0.120 3.505 -2.080 1.00 . A A . 10 ARG HA 1 1
19 4139 1 1 10 ARG HB2 H -0.365 0.671 -3.070 1.00 . A A . 10 ARG HB2 1 1
19 4140 1 1 10 ARG HB3 H -1.111 2.127 -3.709 1.00 . A A . 10 ARG HB3 1 1
19 4141 1 1 10 ARG HD2 H 1.399 3.854 -3.735 1.00 . A A . 10 ARG HD2 1 1
19 4142 1 1 10 ARG HD3 H 2.055 3.355 -5.288 1.00 . A A . 10 ARG HD3 1 1
19 4143 1 1 10 ARG HE H -0.615 3.327 -5.688 1.00 . A A . 10 ARG HE 1 1
19 4144 1 1 10 ARG HG2 H 1.819 1.436 -3.852 1.00 . A A . 10 ARG HG2 1 1
19 4145 1 1 10 ARG HG3 H 0.658 1.309 -5.173 1.00 . A A . 10 ARG HG3 1 1
19 4146 1 1 10 ARG HH11 H 1.640 5.800 -4.556 1.00 . A A . 10 ARG HH11 1 1
19 4147 1 1 10 ARG HH12 H 0.705 7.116 -5.088 1.00 . A A . 10 ARG HH12 1 1
19 4148 1 1 10 ARG HH21 H -1.890 5.085 -6.447 1.00 . A A . 10 ARG HH21 1 1
19 4149 1 1 10 ARG HH22 H -1.392 6.699 -6.242 1.00 . A A . 10 ARG HH22 1 1
19 4150 1 1 10 ARG N N 1.258 1.958 -1.311 1.00 . A A . 10 ARG N 1 1
19 4151 1 1 10 ARG NE N 0.056 3.946 -5.319 1.00 . A A . 10 ARG NE 1 1
19 4152 1 1 10 ARG NH1 N 0.806 6.121 -5.010 1.00 . A A . 10 ARG NH1 1 1
19 4153 1 1 10 ARG NH2 N -1.201 5.725 -6.092 1.00 . A A . 10 ARG NH2 1 1
19 4154 1 1 10 ARG O O -1.247 0.974 -0.559 1.00 . A A . 10 ARG O 1 1
19 4155 1 1 11 ALA C C -4.191 3.285 -0.155 1.00 . A A . 11 ALA C 1 1
19 4156 1 1 11 ALA CA C -2.848 2.905 0.404 1.00 . A A . 11 ALA CA 1 1
19 4157 1 1 11 ALA CB C -2.600 3.578 1.771 1.00 . A A . 11 ALA CB 1 1
19 4158 1 1 11 ALA H H -1.631 4.052 -0.871 1.00 . A A . 11 ALA H 1 1
19 4159 1 1 11 ALA HA H -2.867 1.837 0.557 1.00 . A A . 11 ALA HA 1 1
19 4160 1 1 11 ALA HB1 H -3.371 3.254 2.454 1.00 . A A . 11 ALA HB1 1 1
19 4161 1 1 11 ALA HB2 H -2.654 4.651 1.711 1.00 . A A . 11 ALA HB2 1 1
19 4162 1 1 11 ALA N N -1.800 3.141 -0.544 1.00 . A A . 11 ALA N 1 1
19 4163 1 1 11 ALA O O -4.325 4.246 -0.928 1.00 . A A . 11 ALA O 1 1
19 4164 1 1 12 PHE C C -7.428 2.881 0.971 1.00 . A A . 12 PHE C 1 1
19 4165 1 1 12 PHE CA C -6.524 2.704 -0.234 1.00 . A A . 12 PHE CA 1 1
19 4166 1 1 12 PHE CB C -6.980 1.483 -1.038 1.00 . A A . 12 PHE CB 1 1
19 4167 1 1 12 PHE CD1 C -5.022 0.492 -2.281 1.00 . A A . 12 PHE CD1 1 1
19 4168 1 1 12 PHE CD2 C -6.685 1.657 -3.524 1.00 . A A . 12 PHE CD2 1 1
19 4169 1 1 12 PHE CE1 C -4.328 0.229 -3.440 1.00 . A A . 12 PHE CE1 1 1
19 4170 1 1 12 PHE CE2 C -5.994 1.399 -4.688 1.00 . A A . 12 PHE CE2 1 1
19 4171 1 1 12 PHE CG C -6.208 1.211 -2.306 1.00 . A A . 12 PHE CG 1 1
19 4172 1 1 12 PHE CZ C -4.816 0.684 -4.648 1.00 . A A . 12 PHE CZ 1 1
19 4173 1 1 12 PHE H H -4.962 1.803 0.857 1.00 . A A . 12 PHE H 1 1
19 4174 1 1 12 PHE HA H -6.565 3.581 -0.860 1.00 . A A . 12 PHE HA 1 1
19 4175 1 1 12 PHE HB2 H -6.903 0.609 -0.411 1.00 . A A . 12 PHE HB2 1 1
19 4176 1 1 12 PHE HB3 H -8.019 1.618 -1.302 1.00 . A A . 12 PHE HB3 1 1
19 4177 1 1 12 PHE HD1 H -4.633 0.138 -1.336 1.00 . A A . 12 PHE HD1 1 1
19 4178 1 1 12 PHE HD2 H -7.607 2.219 -3.564 1.00 . A A . 12 PHE HD2 1 1
19 4179 1 1 12 PHE HE1 H -3.405 -0.332 -3.403 1.00 . A A . 12 PHE HE1 1 1
19 4180 1 1 12 PHE HE2 H -6.378 1.760 -5.633 1.00 . A A . 12 PHE HE2 1 1
19 4181 1 1 12 PHE HZ H -4.280 0.482 -5.563 1.00 . A A . 12 PHE HZ 1 1
19 4182 1 1 12 PHE N N -5.172 2.528 0.222 1.00 . A A . 12 PHE N 1 1
19 4183 1 1 12 PHE O O -7.325 2.100 1.938 1.00 . A A . 12 PHE O 1 1
19 4184 1 1 13 PRO C C -10.213 3.035 2.370 1.00 . A A . 13 PRO C 1 1
19 4185 1 1 13 PRO CA C -9.237 4.179 2.069 1.00 . A A . 13 PRO CA 1 1
19 4186 1 1 13 PRO CB C -9.999 5.431 1.617 1.00 . A A . 13 PRO CB 1 1
19 4187 1 1 13 PRO CD C -8.502 4.852 -0.156 1.00 . A A . 13 PRO CD 1 1
19 4188 1 1 13 PRO CG C -9.838 5.471 0.137 1.00 . A A . 13 PRO CG 1 1
19 4189 1 1 13 PRO HA H -8.681 4.401 2.968 1.00 . A A . 13 PRO HA 1 1
19 4190 1 1 13 PRO HB2 H -11.038 5.341 1.900 1.00 . A A . 13 PRO HB2 1 1
19 4191 1 1 13 PRO HB3 H -9.570 6.306 2.083 1.00 . A A . 13 PRO HB3 1 1
19 4192 1 1 13 PRO HD2 H -8.521 4.352 -1.113 1.00 . A A . 13 PRO HD2 1 1
19 4193 1 1 13 PRO HD3 H -7.726 5.603 -0.139 1.00 . A A . 13 PRO HD3 1 1
19 4194 1 1 13 PRO HG2 H -10.627 4.897 -0.327 1.00 . A A . 13 PRO HG2 1 1
19 4195 1 1 13 PRO HG3 H -9.864 6.493 -0.210 1.00 . A A . 13 PRO HG3 1 1
19 4196 1 1 13 PRO N N -8.324 3.888 0.950 1.00 . A A . 13 PRO N 1 1
19 4197 1 1 13 PRO O O -10.777 2.967 3.463 1.00 . A A . 13 PRO O 1 1
19 4198 1 1 14 ASP C C -10.624 -0.054 2.529 1.00 . A A . 14 ASP C 1 1
19 4199 1 1 14 ASP CA C -11.283 0.976 1.615 1.00 . A A . 14 ASP CA 1 1
19 4200 1 1 14 ASP CB C -11.708 0.318 0.283 1.00 . A A . 14 ASP CB 1 1
19 4201 1 1 14 ASP CG C -10.572 -0.338 -0.471 1.00 . A A . 14 ASP CG 1 1
19 4202 1 1 14 ASP H H -9.947 2.255 0.550 1.00 . A A . 14 ASP H 1 1
19 4203 1 1 14 ASP HA H -12.161 1.348 2.122 1.00 . A A . 14 ASP HA 1 1
19 4204 1 1 14 ASP HB2 H -12.448 -0.440 0.489 1.00 . A A . 14 ASP HB2 1 1
19 4205 1 1 14 ASP HB3 H -12.152 1.073 -0.349 1.00 . A A . 14 ASP HB3 1 1
19 4206 1 1 14 ASP N N -10.400 2.131 1.412 1.00 . A A . 14 ASP N 1 1
19 4207 1 1 14 ASP O O -11.303 -0.881 3.143 1.00 . A A . 14 ASP O 1 1
19 4208 1 1 14 ASP OD1 O -9.838 0.363 -1.191 1.00 . A A . 14 ASP OD1 1 1
19 4209 1 1 14 ASP OD2 O -10.402 -1.568 -0.382 1.00 . A A . 14 ASP OD2 1 1
19 4210 2 2 1 . C C -1.987 1.472 3.912 1.00 . B A . 101 WMH C 1 1
19 4211 2 2 1 . C1 C -1.269 3.246 2.399 1.00 . B A . 101 WMH C1 1 1
19 4212 2 2 1 . C2 C -0.070 3.796 2.080 1.00 . B A . 101 WMH C2 1 1
19 4213 2 2 1 . H1 H -2.250 1.843 4.889 1.00 . B A . 101 WMH H1 1 1
19 4214 2 2 1 . H2 H -2.874 1.524 3.299 1.00 . B A . 101 WMH H2 1 1
19 4215 2 2 1 . H5 H 0.089 4.569 1.343 1.00 . B A . 101 WMH H5 1 1
19 4216 2 2 1 . N N -1.048 2.328 3.328 1.00 . B A . 101 WMH N 1 1
19 4217 2 2 1 . N1 N 0.869 3.222 2.819 1.00 . B A . 101 WMH N1 1 1
19 4218 2 2 1 . N2 N 0.337 2.337 3.584 1.00 . B A . 101 WMH N2 1 1
20 4219 1 1 1 GLY C C -7.458 -1.534 3.075 1.00 . A A . 1 GLY C 1 1
20 4220 1 1 1 GLY CA C -8.423 -0.629 3.791 1.00 . A A . 1 GLY CA 1 1
20 4221 1 1 1 GLY H1 H -8.918 0.527 2.086 1.00 . A A . 1 GLY H1 1 1
20 4222 1 1 1 GLY HA2 H -7.861 0.062 4.402 1.00 . A A . 1 GLY HA2 1 1
20 4223 1 1 1 GLY HA3 H -9.049 -1.229 4.437 1.00 . A A . 1 GLY HA3 1 1
20 4224 1 1 1 GLY N N -9.275 0.122 2.906 1.00 . A A . 1 GLY N 1 1
20 4225 1 1 1 GLY O O -7.669 -2.748 3.001 1.00 . A A . 1 GLY O 1 1
20 4226 1 1 2 ARG C C -4.124 -0.857 1.815 1.00 . A A . 2 ARG C 1 1
20 4227 1 1 2 ARG CA C -5.370 -1.706 1.890 1.00 . A A . 2 ARG CA 1 1
20 4228 1 1 2 ARG CB C -5.780 -2.193 0.483 1.00 . A A . 2 ARG CB 1 1
20 4229 1 1 2 ARG CD C -5.127 -3.446 -1.609 1.00 . A A . 2 ARG CD 1 1
20 4230 1 1 2 ARG CG C -4.677 -2.958 -0.243 1.00 . A A . 2 ARG CG 1 1
20 4231 1 1 2 ARG CZ C -4.030 -5.397 -2.733 1.00 . A A . 2 ARG CZ 1 1
20 4232 1 1 2 ARG H H -6.319 0.016 2.597 1.00 . A A . 2 ARG H 1 1
20 4233 1 1 2 ARG HA H -5.158 -2.563 2.513 1.00 . A A . 2 ARG HA 1 1
20 4234 1 1 2 ARG HB2 H -6.638 -2.843 0.576 1.00 . A A . 2 ARG HB2 1 1
20 4235 1 1 2 ARG HB3 H -6.052 -1.341 -0.120 1.00 . A A . 2 ARG HB3 1 1
20 4236 1 1 2 ARG HD2 H -5.952 -4.130 -1.493 1.00 . A A . 2 ARG HD2 1 1
20 4237 1 1 2 ARG HD3 H -5.451 -2.593 -2.186 1.00 . A A . 2 ARG HD3 1 1
20 4238 1 1 2 ARG HE H -3.265 -3.541 -2.544 1.00 . A A . 2 ARG HE 1 1
20 4239 1 1 2 ARG HG2 H -3.825 -2.306 -0.374 1.00 . A A . 2 ARG HG2 1 1
20 4240 1 1 2 ARG HG3 H -4.387 -3.808 0.356 1.00 . A A . 2 ARG HG3 1 1
20 4241 1 1 2 ARG HH11 H -5.818 -5.923 -1.873 1.00 . A A . 2 ARG HH11 1 1
20 4242 1 1 2 ARG HH12 H -5.006 -7.177 -2.712 1.00 . A A . 2 ARG HH12 1 1
20 4243 1 1 2 ARG HH21 H -2.221 -5.276 -3.678 1.00 . A A . 2 ARG HH21 1 1
20 4244 1 1 2 ARG HH22 H -2.959 -6.815 -3.739 1.00 . A A . 2 ARG HH22 1 1
20 4245 1 1 2 ARG N N -6.417 -0.960 2.541 1.00 . A A . 2 ARG N 1 1
20 4246 1 1 2 ARG NE N -4.038 -4.114 -2.329 1.00 . A A . 2 ARG NE 1 1
20 4247 1 1 2 ARG NH1 N -5.029 -6.218 -2.418 1.00 . A A . 2 ARG NH1 1 1
20 4248 1 1 2 ARG NH2 N -3.001 -5.859 -3.434 1.00 . A A . 2 ARG NH2 1 1
20 4249 1 1 2 ARG O O -4.065 0.089 1.060 1.00 . A A . 2 ARG O 1 1
20 4250 1 1 3 ALA C C -0.850 -1.550 2.486 1.00 . A A . 3 ALA C 1 1
20 4251 1 1 3 ALA CA C -1.907 -0.519 2.656 1.00 . A A . 3 ALA CA 1 1
20 4252 1 1 3 ALA CB C -1.708 0.267 3.966 1.00 . A A . 3 ALA CB 1 1
20 4253 1 1 3 ALA H H -3.332 -1.902 3.273 1.00 . A A . 3 ALA H 1 1
20 4254 1 1 3 ALA HA H -1.862 0.168 1.824 1.00 . A A . 3 ALA HA 1 1
20 4255 1 1 3 ALA HB1 H -0.656 0.264 4.208 1.00 . A A . 3 ALA HB1 1 1
20 4256 1 1 3 ALA HB2 H -2.248 -0.227 4.760 1.00 . A A . 3 ALA HB2 1 1
20 4257 1 1 3 ALA N N -3.187 -1.167 2.637 1.00 . A A . 3 ALA N 1 1
20 4258 1 1 3 ALA O O -0.899 -2.607 3.128 1.00 . A A . 3 ALA O 1 1
20 4259 1 1 4 THR C C 2.347 -1.869 2.203 1.00 . A A . 4 THR C 1 1
20 4260 1 1 4 THR CA C 1.125 -2.220 1.391 1.00 . A A . 4 THR CA 1 1
20 4261 1 1 4 THR CB C 1.471 -2.333 -0.113 1.00 . A A . 4 THR CB 1 1
20 4262 1 1 4 THR CG2 C 0.307 -2.932 -0.882 1.00 . A A . 4 THR CG2 1 1
20 4263 1 1 4 THR H H 0.064 -0.462 1.100 1.00 . A A . 4 THR H 1 1
20 4264 1 1 4 THR HA H 0.757 -3.178 1.725 1.00 . A A . 4 THR HA 1 1
20 4265 1 1 4 THR HB H 2.329 -2.982 -0.221 1.00 . A A . 4 THR HB 1 1
20 4266 1 1 4 THR HG1 H 2.413 -1.210 -1.385 1.00 . A A . 4 THR HG1 1 1
20 4267 1 1 4 THR HG21 H -0.561 -2.300 -0.765 1.00 . A A . 4 THR HG21 1 1
20 4268 1 1 4 THR HG22 H 0.088 -3.916 -0.496 1.00 . A A . 4 THR HG22 1 1
20 4269 1 1 4 THR HG23 H 0.565 -3.002 -1.927 1.00 . A A . 4 THR HG23 1 1
20 4270 1 1 4 THR N N 0.078 -1.292 1.626 1.00 . A A . 4 THR N 1 1
20 4271 1 1 4 THR O O 2.618 -0.687 2.472 1.00 . A A . 4 THR O 1 1
20 4272 1 1 4 THR OG1 O 1.791 -1.042 -0.666 1.00 . A A . 4 THR OG1 1 1
20 4273 1 1 5 LYS C C 5.445 -2.736 2.433 1.00 . A A . 5 LYS C 1 1
20 4274 1 1 5 LYS CA C 4.271 -2.680 3.387 1.00 . A A . 5 LYS CA 1 1
20 4275 1 1 5 LYS CB C 4.433 -3.696 4.526 1.00 . A A . 5 LYS CB 1 1
20 4276 1 1 5 LYS CD C 3.673 -4.500 6.791 1.00 . A A . 5 LYS CD 1 1
20 4277 1 1 5 LYS CE C 2.660 -4.322 7.926 1.00 . A A . 5 LYS CE 1 1
20 4278 1 1 5 LYS CG C 3.374 -3.578 5.617 1.00 . A A . 5 LYS CG 1 1
20 4279 1 1 5 LYS H H 2.716 -3.795 2.498 1.00 . A A . 5 LYS H 1 1
20 4280 1 1 5 LYS HA H 4.230 -1.685 3.805 1.00 . A A . 5 LYS HA 1 1
20 4281 1 1 5 LYS HB2 H 4.377 -4.690 4.108 1.00 . A A . 5 LYS HB2 1 1
20 4282 1 1 5 LYS HB3 H 5.405 -3.561 4.979 1.00 . A A . 5 LYS HB3 1 1
20 4283 1 1 5 LYS HD2 H 3.638 -5.524 6.452 1.00 . A A . 5 LYS HD2 1 1
20 4284 1 1 5 LYS HD3 H 4.662 -4.279 7.165 1.00 . A A . 5 LYS HD3 1 1
20 4285 1 1 5 LYS HE2 H 2.992 -4.897 8.778 1.00 . A A . 5 LYS HE2 1 1
20 4286 1 1 5 LYS HE3 H 2.630 -3.277 8.198 1.00 . A A . 5 LYS HE3 1 1
20 4287 1 1 5 LYS HG2 H 3.346 -2.560 5.972 1.00 . A A . 5 LYS HG2 1 1
20 4288 1 1 5 LYS HG3 H 2.415 -3.842 5.196 1.00 . A A . 5 LYS HG3 1 1
20 4289 1 1 5 LYS HZ1 H 1.291 -5.787 7.361 1.00 . A A . 5 LYS HZ1 1 1
20 4290 1 1 5 LYS HZ2 H 0.924 -4.264 6.728 1.00 . A A . 5 LYS HZ2 1 1
20 4291 1 1 5 LYS HZ3 H 0.643 -4.601 8.359 1.00 . A A . 5 LYS HZ3 1 1
20 4292 1 1 5 LYS N N 3.044 -2.883 2.658 1.00 . A A . 5 LYS N 1 1
20 4293 1 1 5 LYS NZ N 1.291 -4.765 7.560 1.00 . A A . 5 LYS NZ 1 1
20 4294 1 1 5 LYS O O 6.599 -2.538 2.823 1.00 . A A . 5 LYS O 1 1
20 4295 1 1 6 SER C C 6.387 -1.604 -0.333 1.00 . A A . 6 SER C 1 1
20 4296 1 1 6 SER CA C 6.120 -3.031 0.154 1.00 . A A . 6 SER CA 1 1
20 4297 1 1 6 SER CB C 5.607 -3.945 -0.949 1.00 . A A . 6 SER CB 1 1
20 4298 1 1 6 SER H H 4.229 -3.201 0.922 1.00 . A A . 6 SER H 1 1
20 4299 1 1 6 SER HA H 7.034 -3.441 0.553 1.00 . A A . 6 SER HA 1 1
20 4300 1 1 6 SER HB2 H 6.125 -3.723 -1.870 1.00 . A A . 6 SER HB2 1 1
20 4301 1 1 6 SER HB3 H 5.775 -4.974 -0.674 1.00 . A A . 6 SER HB3 1 1
20 4302 1 1 6 SER HG H 4.101 -3.052 -1.811 1.00 . A A . 6 SER HG 1 1
20 4303 1 1 6 SER N N 5.150 -3.009 1.192 1.00 . A A . 6 SER N 1 1
20 4304 1 1 6 SER O O 5.612 -0.694 -0.043 1.00 . A A . 6 SER O 1 1
20 4305 1 1 6 SER OG O 4.209 -3.748 -1.152 1.00 . A A . 6 SER OG 1 1
20 4306 1 1 7 ILE C C 7.568 0.006 -3.005 1.00 . A A . 7 ILE C 1 1
20 4307 1 1 7 ILE CA C 7.852 -0.090 -1.503 1.00 . A A . 7 ILE CA 1 1
20 4308 1 1 7 ILE CB C 9.369 0.186 -1.233 1.00 . A A . 7 ILE CB 1 1
20 4309 1 1 7 ILE CD1 C 8.938 0.980 1.182 1.00 . A A . 7 ILE CD1 1 1
20 4310 1 1 7 ILE CG1 C 9.703 0.037 0.267 1.00 . A A . 7 ILE CG1 1 1
20 4311 1 1 7 ILE CG2 C 9.788 1.568 -1.733 1.00 . A A . 7 ILE CG2 1 1
20 4312 1 1 7 ILE H H 8.040 -2.173 -1.282 1.00 . A A . 7 ILE H 1 1
20 4313 1 1 7 ILE HA H 7.256 0.637 -0.973 1.00 . A A . 7 ILE HA 1 1
20 4314 1 1 7 ILE HB H 9.937 -0.549 -1.786 1.00 . A A . 7 ILE HB 1 1
20 4315 1 1 7 ILE HD11 H 9.117 2.001 0.880 1.00 . A A . 7 ILE HD11 1 1
20 4316 1 1 7 ILE HD12 H 9.282 0.845 2.198 1.00 . A A . 7 ILE HD12 1 1
20 4317 1 1 7 ILE HD13 H 7.882 0.763 1.127 1.00 . A A . 7 ILE HD13 1 1
20 4318 1 1 7 ILE HG12 H 9.476 -0.971 0.578 1.00 . A A . 7 ILE HG12 1 1
20 4319 1 1 7 ILE HG13 H 10.758 0.219 0.407 1.00 . A A . 7 ILE HG13 1 1
20 4320 1 1 7 ILE HG21 H 9.215 2.325 -1.218 1.00 . A A . 7 ILE HG21 1 1
20 4321 1 1 7 ILE HG22 H 9.602 1.638 -2.796 1.00 . A A . 7 ILE HG22 1 1
20 4322 1 1 7 ILE HG23 H 10.838 1.716 -1.539 1.00 . A A . 7 ILE HG23 1 1
20 4323 1 1 7 ILE N N 7.474 -1.410 -1.035 1.00 . A A . 7 ILE N 1 1
20 4324 1 1 7 ILE O O 7.934 -0.903 -3.753 1.00 . A A . 7 ILE O 1 1
20 4325 1 1 8 PRO C C 5.084 1.796 -1.950 1.00 . A A . 8 PRO C 1 1
20 4326 1 1 8 PRO CA C 6.393 2.177 -2.647 1.00 . A A . 8 PRO CA 1 1
20 4327 1 1 8 PRO CB C 6.129 3.308 -3.670 1.00 . A A . 8 PRO CB 1 1
20 4328 1 1 8 PRO CD C 6.583 1.300 -4.888 1.00 . A A . 8 PRO CD 1 1
20 4329 1 1 8 PRO CG C 6.626 2.793 -4.986 1.00 . A A . 8 PRO CG 1 1
20 4330 1 1 8 PRO HA H 7.123 2.499 -1.919 1.00 . A A . 8 PRO HA 1 1
20 4331 1 1 8 PRO HB2 H 5.070 3.516 -3.703 1.00 . A A . 8 PRO HB2 1 1
20 4332 1 1 8 PRO HB3 H 6.659 4.199 -3.369 1.00 . A A . 8 PRO HB3 1 1
20 4333 1 1 8 PRO HD2 H 5.597 0.931 -5.130 1.00 . A A . 8 PRO HD2 1 1
20 4334 1 1 8 PRO HD3 H 7.327 0.852 -5.529 1.00 . A A . 8 PRO HD3 1 1
20 4335 1 1 8 PRO HG2 H 5.982 3.137 -5.781 1.00 . A A . 8 PRO HG2 1 1
20 4336 1 1 8 PRO HG3 H 7.638 3.130 -5.152 1.00 . A A . 8 PRO HG3 1 1
20 4337 1 1 8 PRO N N 6.899 1.074 -3.482 1.00 . A A . 8 PRO N 1 1
20 4338 1 1 8 PRO O O 4.271 1.061 -2.525 1.00 . A A . 8 PRO O 1 1
20 4339 1 1 9 PRO C C 2.421 2.541 -0.634 1.00 . A A . 9 PRO C 1 1
20 4340 1 1 9 PRO CA C 3.651 1.943 0.039 1.00 . A A . 9 PRO CA 1 1
20 4341 1 1 9 PRO CB C 3.880 2.584 1.412 1.00 . A A . 9 PRO CB 1 1
20 4342 1 1 9 PRO CD C 5.801 3.090 0.070 1.00 . A A . 9 PRO CD 1 1
20 4343 1 1 9 PRO CG C 4.950 3.599 1.199 1.00 . A A . 9 PRO CG 1 1
20 4344 1 1 9 PRO HA H 3.515 0.878 0.142 1.00 . A A . 9 PRO HA 1 1
20 4345 1 1 9 PRO HB2 H 2.962 3.039 1.753 1.00 . A A . 9 PRO HB2 1 1
20 4346 1 1 9 PRO HB3 H 4.188 1.823 2.113 1.00 . A A . 9 PRO HB3 1 1
20 4347 1 1 9 PRO HD2 H 6.165 3.914 -0.524 1.00 . A A . 9 PRO HD2 1 1
20 4348 1 1 9 PRO HD3 H 6.623 2.504 0.452 1.00 . A A . 9 PRO HD3 1 1
20 4349 1 1 9 PRO HG2 H 4.504 4.544 0.929 1.00 . A A . 9 PRO HG2 1 1
20 4350 1 1 9 PRO HG3 H 5.542 3.708 2.094 1.00 . A A . 9 PRO HG3 1 1
20 4351 1 1 9 PRO N N 4.873 2.250 -0.707 1.00 . A A . 9 PRO N 1 1
20 4352 1 1 9 PRO O O 2.320 3.760 -0.817 1.00 . A A . 9 PRO O 1 1
20 4353 1 1 10 ARG C C -0.847 1.845 -0.800 1.00 . A A . 10 ARG C 1 1
20 4354 1 1 10 ARG CA C 0.318 2.108 -1.694 1.00 . A A . 10 ARG CA 1 1
20 4355 1 1 10 ARG CB C 0.154 1.365 -3.025 1.00 . A A . 10 ARG CB 1 1
20 4356 1 1 10 ARG CD C 1.434 3.102 -4.284 1.00 . A A . 10 ARG CD 1 1
20 4357 1 1 10 ARG CG C 1.281 1.618 -4.012 1.00 . A A . 10 ARG CG 1 1
20 4358 1 1 10 ARG CZ C 2.996 4.626 -5.454 1.00 . A A . 10 ARG CZ 1 1
20 4359 1 1 10 ARG H H 1.640 0.734 -0.833 1.00 . A A . 10 ARG H 1 1
20 4360 1 1 10 ARG HA H 0.376 3.167 -1.885 1.00 . A A . 10 ARG HA 1 1
20 4361 1 1 10 ARG HB2 H 0.111 0.305 -2.825 1.00 . A A . 10 ARG HB2 1 1
20 4362 1 1 10 ARG HB3 H -0.775 1.669 -3.484 1.00 . A A . 10 ARG HB3 1 1
20 4363 1 1 10 ARG HD2 H 0.500 3.478 -4.670 1.00 . A A . 10 ARG HD2 1 1
20 4364 1 1 10 ARG HD3 H 1.665 3.599 -3.354 1.00 . A A . 10 ARG HD3 1 1
20 4365 1 1 10 ARG HE H 2.792 2.625 -5.773 1.00 . A A . 10 ARG HE 1 1
20 4366 1 1 10 ARG HG2 H 2.204 1.239 -3.598 1.00 . A A . 10 ARG HG2 1 1
20 4367 1 1 10 ARG HG3 H 1.059 1.108 -4.936 1.00 . A A . 10 ARG HG3 1 1
20 4368 1 1 10 ARG HH11 H 1.905 5.550 -3.980 1.00 . A A . 10 ARG HH11 1 1
20 4369 1 1 10 ARG HH12 H 2.917 6.596 -4.840 1.00 . A A . 10 ARG HH12 1 1
20 4370 1 1 10 ARG HH21 H 4.263 4.073 -6.969 1.00 . A A . 10 ARG HH21 1 1
20 4371 1 1 10 ARG HH22 H 4.285 5.727 -6.585 1.00 . A A . 10 ARG HH22 1 1
20 4372 1 1 10 ARG N N 1.519 1.694 -1.024 1.00 . A A . 10 ARG N 1 1
20 4373 1 1 10 ARG NE N 2.490 3.402 -5.248 1.00 . A A . 10 ARG NE 1 1
20 4374 1 1 10 ARG NH1 N 2.588 5.656 -4.709 1.00 . A A . 10 ARG NH1 1 1
20 4375 1 1 10 ARG NH2 N 3.913 4.816 -6.391 1.00 . A A . 10 ARG NH2 1 1
20 4376 1 1 10 ARG O O -0.958 0.756 -0.226 1.00 . A A . 10 ARG O 1 1
20 4377 1 1 11 ALA C C -4.096 2.987 -0.486 1.00 . A A . 11 ALA C 1 1
20 4378 1 1 11 ALA CA C -2.820 2.684 0.236 1.00 . A A . 11 ALA CA 1 1
20 4379 1 1 11 ALA CB C -2.702 3.528 1.522 1.00 . A A . 11 ALA CB 1 1
20 4380 1 1 11 ALA H H -1.566 3.687 -1.103 1.00 . A A . 11 ALA H 1 1
20 4381 1 1 11 ALA HA H -2.851 1.642 0.518 1.00 . A A . 11 ALA HA 1 1
20 4382 1 1 11 ALA HB1 H -3.506 3.256 2.188 1.00 . A A . 11 ALA HB1 1 1
20 4383 1 1 11 ALA HB2 H -2.792 4.581 1.325 1.00 . A A . 11 ALA HB2 1 1
20 4384 1 1 11 ALA N N -1.692 2.834 -0.633 1.00 . A A . 11 ALA N 1 1
20 4385 1 1 11 ALA O O -4.117 3.774 -1.444 1.00 . A A . 11 ALA O 1 1
20 4386 1 1 12 PHE C C -7.445 2.763 0.493 1.00 . A A . 12 PHE C 1 1
20 4387 1 1 12 PHE CA C -6.446 2.477 -0.629 1.00 . A A . 12 PHE CA 1 1
20 4388 1 1 12 PHE CB C -6.846 1.203 -1.392 1.00 . A A . 12 PHE CB 1 1
20 4389 1 1 12 PHE CD1 C -6.229 1.275 -3.833 1.00 . A A . 12 PHE CD1 1 1
20 4390 1 1 12 PHE CD2 C -4.790 0.085 -2.357 1.00 . A A . 12 PHE CD2 1 1
20 4391 1 1 12 PHE CE1 C -5.409 0.948 -4.894 1.00 . A A . 12 PHE CE1 1 1
20 4392 1 1 12 PHE CE2 C -3.964 -0.242 -3.415 1.00 . A A . 12 PHE CE2 1 1
20 4393 1 1 12 PHE CG C -5.934 0.849 -2.552 1.00 . A A . 12 PHE CG 1 1
20 4394 1 1 12 PHE CZ C -4.275 0.190 -4.686 1.00 . A A . 12 PHE CZ 1 1
20 4395 1 1 12 PHE H H -4.997 1.706 0.684 1.00 . A A . 12 PHE H 1 1
20 4396 1 1 12 PHE HA H -6.419 3.311 -1.312 1.00 . A A . 12 PHE HA 1 1
20 4397 1 1 12 PHE HB2 H -6.854 0.372 -0.704 1.00 . A A . 12 PHE HB2 1 1
20 4398 1 1 12 PHE HB3 H -7.845 1.336 -1.780 1.00 . A A . 12 PHE HB3 1 1
20 4399 1 1 12 PHE HD1 H -7.112 1.870 -4.004 1.00 . A A . 12 PHE HD1 1 1
20 4400 1 1 12 PHE HD2 H -4.544 -0.250 -1.358 1.00 . A A . 12 PHE HD2 1 1
20 4401 1 1 12 PHE HE1 H -5.658 1.289 -5.889 1.00 . A A . 12 PHE HE1 1 1
20 4402 1 1 12 PHE HE2 H -3.076 -0.834 -3.249 1.00 . A A . 12 PHE HE2 1 1
20 4403 1 1 12 PHE HZ H -3.631 -0.067 -5.515 1.00 . A A . 12 PHE HZ 1 1
20 4404 1 1 12 PHE N N -5.134 2.334 -0.060 1.00 . A A . 12 PHE N 1 1
20 4405 1 1 12 PHE O O -7.358 2.140 1.569 1.00 . A A . 12 PHE O 1 1
20 4406 1 1 13 PRO C C -10.029 3.130 2.133 1.00 . A A . 13 PRO C 1 1
20 4407 1 1 13 PRO CA C -9.385 4.193 1.231 1.00 . A A . 13 PRO CA 1 1
20 4408 1 1 13 PRO CB C -10.447 4.819 0.347 1.00 . A A . 13 PRO CB 1 1
20 4409 1 1 13 PRO CD C -8.562 4.404 -1.053 1.00 . A A . 13 PRO CD 1 1
20 4410 1 1 13 PRO CG C -9.689 5.369 -0.798 1.00 . A A . 13 PRO CG 1 1
20 4411 1 1 13 PRO HA H -8.966 4.969 1.854 1.00 . A A . 13 PRO HA 1 1
20 4412 1 1 13 PRO HB2 H -11.146 4.056 0.040 1.00 . A A . 13 PRO HB2 1 1
20 4413 1 1 13 PRO HB3 H -10.974 5.592 0.887 1.00 . A A . 13 PRO HB3 1 1
20 4414 1 1 13 PRO HD2 H -8.827 3.709 -1.835 1.00 . A A . 13 PRO HD2 1 1
20 4415 1 1 13 PRO HD3 H -7.667 4.947 -1.319 1.00 . A A . 13 PRO HD3 1 1
20 4416 1 1 13 PRO HG2 H -10.328 5.441 -1.666 1.00 . A A . 13 PRO HG2 1 1
20 4417 1 1 13 PRO HG3 H -9.295 6.340 -0.541 1.00 . A A . 13 PRO HG3 1 1
20 4418 1 1 13 PRO N N -8.392 3.704 0.248 1.00 . A A . 13 PRO N 1 1
20 4419 1 1 13 PRO O O -9.951 3.234 3.368 1.00 . A A . 13 PRO O 1 1
20 4420 1 1 14 ASP C C -10.545 0.260 3.211 1.00 . A A . 14 ASP C 1 1
20 4421 1 1 14 ASP CA C -11.410 1.107 2.287 1.00 . A A . 14 ASP CA 1 1
20 4422 1 1 14 ASP CB C -12.293 0.204 1.391 1.00 . A A . 14 ASP CB 1 1
20 4423 1 1 14 ASP CG C -11.532 -0.839 0.602 1.00 . A A . 14 ASP CG 1 1
20 4424 1 1 14 ASP H H -10.554 2.028 0.551 1.00 . A A . 14 ASP H 1 1
20 4425 1 1 14 ASP HA H -12.062 1.683 2.927 1.00 . A A . 14 ASP HA 1 1
20 4426 1 1 14 ASP HB2 H -13.007 -0.315 2.013 1.00 . A A . 14 ASP HB2 1 1
20 4427 1 1 14 ASP HB3 H -12.833 0.832 0.696 1.00 . A A . 14 ASP HB3 1 1
20 4428 1 1 14 ASP N N -10.631 2.106 1.526 1.00 . A A . 14 ASP N 1 1
20 4429 1 1 14 ASP O O -11.031 -0.248 4.212 1.00 . A A . 14 ASP O 1 1
20 4430 1 1 14 ASP OD1 O -11.365 -1.976 1.095 1.00 . A A . 14 ASP OD1 1 1
20 4431 1 1 14 ASP OD2 O -11.111 -0.553 -0.535 1.00 . A A . 14 ASP OD2 1 1
20 4432 2 2 1 . C C -2.166 1.708 3.891 1.00 . B A . 101 WMH C 1 1
20 4433 2 2 1 . C1 C -1.410 3.340 2.261 1.00 . B A . 101 WMH C1 1 1
20 4434 2 2 1 . C2 C -0.219 3.909 1.954 1.00 . B A . 101 WMH C2 1 1
20 4435 2 2 1 . H1 H -2.473 2.145 4.826 1.00 . B A . 101 WMH H1 1 1
20 4436 2 2 1 . H2 H -3.028 1.709 3.244 1.00 . B A . 101 WMH H2 1 1
20 4437 2 2 1 . H5 H -0.049 4.619 1.160 1.00 . B A . 101 WMH H5 1 1
20 4438 2 2 1 . N N -1.216 2.531 3.282 1.00 . B A . 101 WMH N 1 1
20 4439 2 2 1 . N1 N 0.697 3.448 2.790 1.00 . B A . 101 WMH N1 1 1
20 4440 2 2 1 . N2 N 0.152 2.618 3.612 1.00 . B A . 101 WMH N2 1 1
stop_
save_
Contact the webmaster for help, if required. Saturday, June 1, 2024 2:10:16 PM GMT (wattos1)