NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
647578 |
6u7w   |
30670 | cing | 4-filtered-FRED | STAR | entry | full | 114 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6u7w
# This FRED archive file contains, for PDB entry <6u7w>:
#
# - 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_6u7w
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6u7w
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1534.74
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_LYS_ALA_LEU_PHE_SER_ASN_PRO_PRO_ILE_ALA_PHE_PRO_ASN 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_LYS_ALA_LEU_PHE_SER_ASN_PRO_PRO_ILE_ALA_PHE_PRO_ASN
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "GLY LYS ALA LEU PHE SER ASN PRO PRO ILE ALA PHE PRO ASN"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GKALFSNPPIAFPN
_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 LYS . 1 1
3 ALA . 1 1
4 LEU . 1 1
5 PHE . 1 1
6 SER . 1 1
7 ASN . 1 1
8 PRO . 1 1
9 PRO . 1 1
10 ILE . 1 1
11 ALA . 1 1
12 PHE . 1 1
13 PRO . 1 1
14 ASN . 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
LYS 2 2 1 1
ALA 3 3 1 1
LEU 4 4 1 1
PHE 5 5 1 1
SER 6 6 1 1
ASN 7 7 1 1
PRO 8 8 1 1
PRO 9 9 1 1
ILE 10 10 1 1
ALA 11 11 1 1
PHE 12 12 1 1
PRO 13 13 1 1
ASN 14 14 1 1
stop_
save_
save_1_methyl_1H_1_2_3_triazole
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "1 methyl 1H 1 2 3 triazole"
_Entity.Type non-polymer
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . $. 1 2
stop_
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 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 LYS H . 2 . HN 1 1
1 1 2 1 1 2 LYS HB2 . 2 . HB2 1 1
2 1 1 1 1 2 LYS H . 2 . HN 1 1
2 1 2 1 1 2 LYS HB3 . 2 . HB1 1 1
3 1 1 1 1 3 ALA HA . 3 . HA 1 1
3 1 2 1 1 4 LEU H . 4 . HN 1 1
4 1 1 1 1 2 LYS HA . 2 . HA 1 1
4 1 2 1 1 3 ALA H . 3 . HN 1 1
5 1 1 1 1 5 PHE H . 5 . HN 1 1
5 1 2 1 1 5 PHE HB3 . 5 . HB1 1 1
6 1 1 1 1 4 LEU HA . 4 . HA 1 1
6 1 2 1 1 5 PHE H . 5 . HN 1 1
7 1 1 1 1 5 PHE HA . 5 . HA 1 1
7 1 2 1 1 5 PHE QD . 5 . HD# 1 1
8 1 1 1 1 6 SER HA . 6 . HA 1 1
8 1 2 1 1 7 ASN H . 7 . HN 1 1
9 1 1 1 1 7 ASN H . 7 . HN 1 1
9 1 2 1 1 7 ASN HB2 . 7 . HB2 1 1
10 1 1 1 1 7 ASN H . 7 . HN 1 1
10 1 2 1 1 7 ASN HB3 . 7 . HB1 1 1
11 1 1 1 1 10 ILE H . 10 . HN 1 1
11 1 2 1 1 10 ILE HG13 . 10 . HG11 1 1
12 1 1 1 1 10 ILE H . 10 . HN 1 1
12 1 2 1 1 10 ILE HB . 10 . HB 1 1
13 1 1 1 1 10 ILE HA . 10 . HA 1 1
13 1 2 1 1 11 ALA H . 11 . HN 1 1
14 1 1 1 1 12 PHE H . 12 . HN 1 1
14 1 2 1 1 12 PHE HB3 . 12 . HB1 1 1
15 1 1 1 1 12 PHE H . 12 . HN 1 1
15 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
16 1 1 1 1 11 ALA HA . 11 . HA 1 1
16 1 2 1 1 12 PHE H . 12 . HN 1 1
17 1 1 1 1 12 PHE HA . 12 . HA 1 1
17 1 2 1 1 13 PRO HD3 . 13 . HD1 1 1
18 1 1 1 1 12 PHE HA . 12 . HA 1 1
18 1 2 1 1 13 PRO HD2 . 13 . HD2 1 1
19 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
19 1 2 1 1 13 PRO HD3 . 13 . HD1 1 1
20 1 1 1 1 9 PRO HA . 9 . HA 1 1
20 1 2 1 1 10 ILE H . 10 . HN 1 1
21 1 1 1 1 8 PRO HA . 8 . HA 1 1
21 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1
22 1 1 1 1 8 PRO HA . 8 . HA 1 1
22 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1
23 1 1 1 1 10 ILE H . 10 . HN 1 1
23 1 2 1 1 10 ILE HG12 . 10 . HG12 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 LEU H . 4 . HN 1 1
25 1 2 1 1 11 ALA HA . 11 . HA 1 1
26 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
26 1 2 1 1 14 ASN H . 14 . HN 1 1
27 1 1 1 1 12 PHE HB2 . 12 . HB2 1 1
27 1 2 1 1 14 ASN H . 14 . HN 1 1
28 1 1 1 1 2 LYS H . 2 . HN 1 1
28 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
29 1 1 1 1 10 ILE MG . 10 . HG2# 1 1
29 1 2 1 1 11 ALA H . 11 . HN 1 1
30 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
30 1 2 1 1 14 ASN HD22 . 14 . HD22 1 1
31 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
31 1 2 1 1 14 ASN HD22 . 14 . HD22 1 1
32 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
32 1 2 1 1 12 PHE QD . 12 . HD# 1 1
33 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
33 1 2 1 1 12 PHE QD . 12 . HD# 1 1
34 1 1 1 1 10 ILE HA . 10 . HA 1 1
34 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
35 1 1 1 1 10 ILE HA . 10 . HA 1 1
35 1 2 1 1 10 ILE MD . 10 . HD1# 1 1
36 1 1 1 1 5 PHE H . 5 . HN 1 1
36 1 2 1 1 5 PHE HB2 . 5 . HB2 1 1
37 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
37 1 2 1 1 3 ALA H . 3 . HN 1 1
38 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
38 1 2 1 1 3 ALA H . 3 . HN 1 1
39 1 1 1 1 10 ILE HB . 10 . HB 1 1
39 1 2 1 1 11 ALA H . 11 . HN 1 1
40 1 1 1 1 2 LYS H . 2 . HN 1 1
40 1 2 1 1 2 LYS HD2 . 2 . HD2 1 1
41 1 1 1 1 2 LYS H . 2 . HN 1 1
41 1 2 1 1 2 LYS HD3 . 2 . HD1 1 1
42 1 1 1 1 6 SER H . 6 . HN 1 1
42 1 2 1 1 6 SER HA . 6 . HA 1 1
43 1 1 1 1 10 ILE H . 10 . HN 1 1
43 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
44 1 1 1 1 12 PHE HA . 12 . HA 1 1
44 1 2 1 1 12 PHE QD . 12 . HD# 1 1
45 1 1 1 1 2 LYS H . 2 . HN 1 1
45 1 2 1 1 3 ALA H . 3 . HN 1 1
46 1 1 1 1 2 LYS H . 2 . HN 1 1
46 1 2 1 1 12 PHE H . 12 . HN 1 1
47 1 1 1 1 12 PHE H . 12 . HN 1 1
47 1 2 1 1 14 ASN H . 14 . HN 1 1
48 1 1 1 1 11 ALA H . 11 . HN 1 1
48 1 2 1 1 12 PHE H . 12 . HN 1 1
49 1 1 1 1 4 LEU H . 4 . HN 1 1
49 1 2 1 1 10 ILE H . 10 . HN 1 1
50 1 1 1 1 12 PHE H . 12 . HN 1 1
50 1 2 1 1 12 PHE QD . 12 . HD# 1 1
51 1 1 1 1 6 SER H . 6 . HN 1 1
51 1 2 1 1 7 ASN H . 7 . HN 1 1
52 1 1 1 1 9 PRO HB3 . 9 . HB1 1 1
52 1 2 1 1 10 ILE H . 10 . HN 1 1
53 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
53 1 2 1 1 14 ASN HD21 . 14 . HD21 1 1
54 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
54 1 2 1 1 14 ASN HD21 . 14 . HD21 1 1
55 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1
55 1 2 1 1 10 ILE H . 10 . HN 1 1
56 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
56 1 2 1 1 12 PHE H . 12 . HN 1 1
57 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
57 1 2 1 1 12 PHE H . 12 . HN 1 1
58 1 1 1 1 4 LEU H . 4 . HN 1 1
58 1 2 1 1 10 ILE MG . 10 . HG2# 1 1
59 1 1 1 1 3 ALA HA . 3 . HA 1 1
59 1 2 1 1 11 ALA HA . 11 . HA 1 1
60 1 1 1 1 7 ASN HA . 7 . HA 1 1
60 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1
61 1 1 1 1 7 ASN HA . 7 . HA 1 1
61 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1
62 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
62 1 2 1 1 13 PRO HD2 . 13 . HD2 1 1
63 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
63 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
64 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
64 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
65 1 1 1 1 4 LEU HA . 4 . HA 1 1
65 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1
66 1 1 1 1 4 LEU HA . 4 . HA 1 1
66 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1
67 1 1 1 1 10 ILE HB . 10 . HB 1 1
67 1 2 1 1 10 ILE MD . 10 . HD1# 1 1
68 1 1 1 1 2 LYS H . 2 . HN 1 1
68 1 2 1 1 2 LYS QB . 2 . HB# 1 1
69 1 1 1 1 2 LYS H . 2 . HN 1 1
69 1 2 1 1 2 LYS QG . 2 . HG# 1 1
70 1 1 1 1 2 LYS H . 2 . HN 1 1
70 1 2 1 1 14 ASN QB . 14 . HB# 1 1
71 1 1 1 1 2 LYS QB . 2 . HB# 1 1
71 1 2 1 1 3 ALA H . 3 . HN 1 1
72 1 1 1 1 2 LYS QB . 2 . HB# 1 1
72 1 2 1 1 12 PHE HB2 . 12 . HB2 1 1
73 1 1 1 1 2 LYS QB . 2 . HB# 1 1
73 1 2 1 1 12 PHE QD . 12 . HD# 1 1
74 1 1 1 1 2 LYS QB . 2 . HB# 1 1
74 1 2 1 1 14 ASN QD . 14 . HD2# 1 1
75 1 1 1 1 4 LEU H . 4 . HN 1 1
75 1 2 1 1 4 LEU QB . 4 . HB# 1 1
76 1 1 1 1 4 LEU HA . 4 . HA 1 1
76 1 2 1 1 4 LEU QD . 4 . HD# 1 1
77 1 1 1 1 4 LEU QB . 4 . HB# 1 1
77 1 2 1 1 5 PHE H . 5 . HN 1 1
78 1 1 1 1 4 LEU QB . 4 . HB# 1 1
78 1 2 1 1 6 SER QB . 6 . HB# 1 1
79 1 1 1 1 4 LEU HG . 4 . HG 1 1
79 1 2 1 1 6 SER QB . 6 . HB# 1 1
80 1 1 1 1 5 PHE H . 5 . HN 1 1
80 1 2 1 1 5 PHE QB . 5 . HB# 1 1
81 1 1 1 1 6 SER QB . 6 . HB# 1 1
81 1 2 1 1 7 ASN H . 7 . HN 1 1
82 1 1 1 1 7 ASN H . 7 . HN 1 1
82 1 2 1 1 7 ASN QB . 7 . HB# 1 1
83 1 1 1 1 7 ASN HA . 7 . HA 1 1
83 1 2 1 1 9 PRO QD . 9 . HD# 1 1
84 1 1 1 1 8 PRO HA . 8 . HA 1 1
84 1 2 1 1 9 PRO QD . 9 . HD# 1 1
85 1 1 1 1 8 PRO QB . 8 . HB# 1 1
85 1 2 1 1 9 PRO QD . 9 . HD# 1 1
86 1 1 1 1 9 PRO QB . 9 . HB# 1 1
86 1 2 1 1 10 ILE H . 10 . HN 1 1
87 1 1 1 1 10 ILE H . 10 . HN 1 1
87 1 2 1 1 10 ILE QG . 10 . HG1# 1 1
88 1 1 1 1 12 PHE HA . 12 . HA 1 1
88 1 2 1 1 13 PRO QD . 13 . HD# 1 1
89 1 1 1 1 12 PHE HB2 . 12 . HB2 1 1
89 1 2 1 1 14 ASN QD . 14 . HD2# 1 1
90 1 1 1 1 12 PHE HB3 . 12 . HB1 1 1
90 1 2 1 1 13 PRO QD . 13 . HD# 1 1
91 1 1 1 1 12 PHE QD . 12 . HD# 1 1
91 1 2 1 1 13 PRO QD . 13 . HD# 1 1
92 1 1 1 1 13 PRO QB . 13 . HB# 1 1
92 1 2 1 1 14 ASN H . 14 . HN 1 1
93 1 1 1 1 13 PRO QD . 13 . HD# 1 1
93 1 2 1 1 14 ASN H . 14 . HN 1 1
94 1 1 1 1 14 ASN H . 14 . HN 1 1
94 1 2 1 1 14 ASN QB . 14 . HB# 1 1
95 1 1 1 1 14 ASN QB . 14 . HB# 1 1
95 1 2 1 1 14 ASN QD . 14 . HD2# 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.85 1.8 3.9 1 1
2 1 . . . . . 2.85 1.8 3.9 1 1
3 1 . . . . . 2.255 1.8 2.71 1 1
4 1 . . . . . 2.24 1.8 2.68 1 1
5 1 . . . . . 2.85 1.8 3.9 1 1
6 1 . . . . . 2.245 1.8 2.69 1 1
7 1 . . . . . 2.745 1.8 3.69 1 1
8 1 . . . . . 2.485 1.8 3.17 1 1
9 1 . . . . . 2.84 1.8 3.88 1 1
10 1 . . . . . 2.84 1.8 3.88 1 1
11 1 . . . . . 3.485 1.8 5.17 1 1
12 1 . . . . . 2.815 1.8 3.83 1 1
13 1 . . . . . 2.26 1.8 2.72 1 1
14 1 . . . . . 2.975 1.8 4.15 1 1
15 1 . . . . . 2.45 1.8 3.1 1 1
16 1 . . . . . 2.27 1.8 2.74 1 1
17 1 . . . . . 2.565 1.8 3.33 1 1
18 1 . . . . . 2.565 1.8 3.33 1 1
19 1 . . . . . 2.92 1.8 4.04 1 1
20 1 . . . . . 2.325 1.8 2.85 1 1
21 1 . . . . . 2.51 1.8 3.22 1 1
22 1 . . . . . 2.51 1.8 3.22 1 1
23 1 . . . . . 3.485 1.8 5.17 1 1
24 1 . . . . . 3.04 1.8 4.28 1 1
25 1 . . . . . 3.075 1.8 4.35 1 1
26 1 . . . . . 2.75 1.8 3.7 1 1
27 1 . . . . . 2.975 1.8 4.15 1 1
28 1 . . . . . 2.94 1.8 4.08 1 1
29 1 . . . . . 2.975 1.8 4.15 1 1
30 1 . . . . . 3.65 1.8 5.5 1 1
31 1 . . . . . 3.65 1.8 5.5 1 1
32 1 . . . . . 3.44 1.8 5.08 1 1
33 1 . . . . . 3.44 1.8 5.08 1 1
34 1 . . . . . 2.79 1.8 3.78 1 1
35 1 . . . . . 2.89 1.8 3.98 1 1
36 1 . . . . . 2.85 1.8 3.9 1 1
37 1 . . . . . 3.255 1.8 4.71 1 1
38 1 . . . . . 3.255 1.8 4.71 1 1
39 1 . . . . . 3.115 1.8 4.43 1 1
40 1 . . . . . 3.65 1.8 5.5 1 1
41 1 . . . . . 3.65 1.8 5.5 1 1
42 1 . . . . . 2.335 1.8 2.87 1 1
43 1 . . . . . 3.405 1.8 5.01 1 1
44 1 . . . . . 3.095 1.8 4.39 1 1
45 1 . . . . . 3.27 1.8 4.74 1 1
46 1 . . . . . 3.105 1.8 4.41 1 1
47 1 . . . . . 3.615 1.8 5.43 1 1
48 1 . . . . . 3.4 1.8 5.0 1 1
49 1 . . . . . 2.84 1.8 3.88 1 1
50 1 . . . . . 2.86 1.8 3.92 1 1
51 1 . . . . . 3.19 1.8 4.58 1 1
52 1 . . . . . 3.235 1.8 4.67 1 1
53 1 . . . . . 3.65 1.8 5.5 1 1
54 1 . . . . . 3.65 1.8 5.5 1 1
55 1 . . . . . 3.235 1.8 4.67 1 1
56 1 . . . . . 3.65 1.8 5.5 1 1
57 1 . . . . . 3.65 1.8 5.5 1 1
58 1 . . . . . 3.47 1.8 5.14 1 1
59 1 . . . . . 2.925 1.8 4.05 1 1
60 1 . . . . . 3.04 1.8 4.28 1 1
61 1 . . . . . 3.04 1.8 4.28 1 1
62 1 . . . . . 2.92 1.8 4.04 1 1
63 1 . . . . . 3.445 1.8 5.09 1 1
64 1 . . . . . 3.445 1.8 5.09 1 1
65 1 . . . . . 3.2 1.8 4.6 1 1
66 1 . . . . . 3.2 1.8 4.6 1 1
67 1 . . . . . 2.74 1.8 3.68 1 1
68 1 . . . . . 2.56 1.8 3.32 1 1
69 1 . . . . . 3.23 1.8 4.66 1 1
70 1 . . . . . 3.57 1.8 5.34 1 1
71 1 . . . . . 2.955 1.8 4.11 1 1
72 1 . . . . . 3.125 1.8 4.45 1 1
73 1 . . . . . 3.13 1.8 4.46 1 1
74 1 . . . . . 3.005 1.8 4.21 1 1
75 1 . . . . . 2.53 1.8 3.26 1 1
76 1 . . . . . 2.73 1.8 3.66 1 1
77 1 . . . . . 2.78 1.8 3.76 1 1
78 1 . . . . . 3.13 1.8 4.46 1 1
79 1 . . . . . 3.57 1.8 5.34 1 1
80 1 . . . . . 2.48 1.8 3.16 1 1
81 1 . . . . . 2.42 1.8 3.04 1 1
82 1 . . . . . 2.555 1.8 3.31 1 1
83 1 . . . . . 2.775 1.8 3.75 1 1
84 1 . . . . . 2.27 1.8 2.74 1 1
85 1 . . . . . 2.405 1.8 3.01 1 1
86 1 . . . . . 2.935 1.8 4.07 1 1
87 1 . . . . . 3.115 1.8 4.43 1 1
88 1 . . . . . 2.31 1.8 2.82 1 1
89 1 . . . . . 3.33 1.8 4.86 1 1
90 1 . . . . . 2.51 1.8 3.22 1 1
91 1 . . . . . 3.175 1.8 4.55 1 1
92 1 . . . . . 2.85 1.8 3.9 1 1
93 1 . . . . . 2.965 1.8 4.13 1 1
94 1 . . . . . 2.57 1.8 3.34 1 1
95 1 . . . . . 2.49 1.8 3.18 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
3 1 . . . 1 2
4 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 LEU O . 4 . O 1 2
1 1 2 1 1 10 ILE H . 10 . HN 1 2
2 1 1 1 1 4 LEU O . 4 . O 1 2
2 1 2 1 1 10 ILE N . 10 . N 1 2
3 1 1 1 1 2 LYS O . 2 . O 1 2
3 1 2 1 1 12 PHE H . 12 . HN 1 2
4 1 1 1 1 2 LYS O . 2 . O 1 2
4 1 2 1 1 12 PHE N . 12 . N 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 0.0 0.0 2.0 1 2
2 1 . . . . . 0.0 0.0 3.0 1 2
3 1 . . . . . 0.0 0.0 2.0 1 2
4 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 LYS C 1 1 3 ALA N 1 1 3 ALA CA 1 1 3 ALA C -150.3 -106.09999 . 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 LEU N 133.7 173.69998 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1
3 . 1 1 3 ALA C 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C -128.8 -76.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1
4 . 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C 1 1 5 PHE N 104.0 144.0 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1
5 . 1 1 6 SER C 1 1 7 ASN N 1 1 7 ASN CA 1 1 7 ASN C -165.3 -63.3 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
6 . 1 1 7 ASN N 1 1 7 ASN CA 1 1 7 ASN C 1 1 8 PRO N 50.6 138.4 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1
7 . 1 1 8 PRO N 1 1 8 PRO CA 1 1 8 PRO C 1 1 9 PRO N 118.299995 178.7 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1
8 . 1 1 9 PRO N 1 1 9 PRO CA 1 1 9 PRO C 1 1 10 ILE N 21.7 145.3 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1
9 . 1 1 9 PRO C 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C -154.4 -80.8 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
10 . 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C 1 1 11 ALA N 108.4 153.6 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1
11 . 1 1 10 ILE C 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C -148.7 -63.699997 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
12 . 1 1 11 ALA N 1 1 11 ALA CA 1 1 11 ALA C 1 1 12 PHE N 80.3 161.9 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1
13 . 1 1 11 ALA C 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C -127.5 -70.7 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
14 . 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C 1 1 13 PRO N 83.0 140.6 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1
15 . 1 1 14 ASN N 1 1 14 ASN CA 1 1 14 ASN CB 1 1 14 ASN 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 -5.954 -3.460 0.543 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C -7.199 -3.111 1.309 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H -7.513 -1.055 0.953 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY HA2 H -6.934 -2.926 2.339 1.00 . A A . 1 GLY HA2 1 1
1 5 1 1 1 GLY HA3 H -7.875 -3.953 1.269 1.00 . A A . 1 GLY HA3 1 1
1 6 1 1 1 GLY N N -7.875 -1.953 0.776 1.00 . A A . 1 GLY N 1 1
1 7 1 1 1 GLY O O -5.377 -4.536 0.729 1.00 . A A . 1 GLY O 1 1
1 8 1 1 2 LYS C C -3.155 -2.203 -0.385 1.00 . A A . 2 LYS C 1 1
1 9 1 1 2 LYS CA C -4.358 -2.791 -1.106 1.00 . A A . 2 LYS CA 1 1
1 10 1 1 2 LYS CB C -4.536 -2.152 -2.492 1.00 . A A . 2 LYS CB 1 1
1 11 1 1 2 LYS CD C -3.074 -3.738 -3.798 1.00 . A A . 2 LYS CD 1 1
1 12 1 1 2 LYS CE C -1.958 -3.831 -4.815 1.00 . A A . 2 LYS CE 1 1
1 13 1 1 2 LYS CG C -3.355 -2.294 -3.443 1.00 . A A . 2 LYS CG 1 1
1 14 1 1 2 LYS H H -6.035 -1.738 -0.421 1.00 . A A . 2 LYS H 1 1
1 15 1 1 2 LYS HA H -4.221 -3.855 -1.223 1.00 . A A . 2 LYS HA 1 1
1 16 1 1 2 LYS HB2 H -5.396 -2.602 -2.967 1.00 . A A . 2 LYS HB2 1 1
1 17 1 1 2 LYS HB3 H -4.735 -1.101 -2.357 1.00 . A A . 2 LYS HB3 1 1
1 18 1 1 2 LYS HD2 H -2.789 -4.275 -2.904 1.00 . A A . 2 LYS HD2 1 1
1 19 1 1 2 LYS HD3 H -3.968 -4.175 -4.215 1.00 . A A . 2 LYS HD3 1 1
1 20 1 1 2 LYS HE2 H -2.253 -3.276 -5.692 1.00 . A A . 2 LYS HE2 1 1
1 21 1 1 2 LYS HE3 H -1.073 -3.381 -4.390 1.00 . A A . 2 LYS HE3 1 1
1 22 1 1 2 LYS HG2 H -3.577 -1.756 -4.352 1.00 . A A . 2 LYS HG2 1 1
1 23 1 1 2 LYS HG3 H -2.479 -1.867 -2.977 1.00 . A A . 2 LYS HG3 1 1
1 24 1 1 2 LYS HZ1 H -2.515 -5.707 -5.544 1.00 . A A . 2 LYS HZ1 1 1
1 25 1 1 2 LYS HZ2 H -1.277 -5.768 -4.404 1.00 . A A . 2 LYS HZ2 1 1
1 26 1 1 2 LYS HZ3 H -0.959 -5.246 -5.972 1.00 . A A . 2 LYS HZ3 1 1
1 27 1 1 2 LYS N N -5.538 -2.576 -0.317 1.00 . A A . 2 LYS N 1 1
1 28 1 1 2 LYS NZ N -1.659 -5.225 -5.203 1.00 . A A . 2 LYS NZ 1 1
1 29 1 1 2 LYS O O -3.039 -0.997 -0.238 1.00 . A A . 2 LYS O 1 1
1 30 1 1 3 ALA C C 0.129 -3.062 0.062 1.00 . A A . 3 ALA C 1 1
1 31 1 1 3 ALA CA C -1.098 -2.624 0.777 1.00 . A A . 3 ALA CA 1 1
1 32 1 1 3 ALA CB C -1.085 -3.068 2.240 1.00 . A A . 3 ALA CB 1 1
1 33 1 1 3 ALA H H -2.480 -4.013 0.010 1.00 . A A . 3 ALA H 1 1
1 34 1 1 3 ALA HA H -1.105 -1.544 0.759 1.00 . A A . 3 ALA HA 1 1
1 35 1 1 3 ALA HB1 H -0.066 -3.265 2.540 1.00 . A A . 3 ALA HB1 1 1
1 36 1 1 3 ALA HB2 H -1.663 -3.975 2.336 1.00 . A A . 3 ALA HB2 1 1
1 37 1 1 3 ALA N N -2.306 -3.053 0.104 1.00 . A A . 3 ALA N 1 1
1 38 1 1 3 ALA O O 0.254 -4.228 -0.323 1.00 . A A . 3 ALA O 1 1
1 39 1 1 4 LEU C C 3.381 -2.225 0.232 1.00 . A A . 4 LEU C 1 1
1 40 1 1 4 LEU CA C 2.278 -2.386 -0.759 1.00 . A A . 4 LEU CA 1 1
1 41 1 1 4 LEU CB C 2.490 -1.436 -1.940 1.00 . A A . 4 LEU CB 1 1
1 42 1 1 4 LEU CD1 C 1.710 -0.491 -4.120 1.00 . A A . 4 LEU CD1 1 1
1 43 1 1 4 LEU CD2 C 1.574 -2.947 -3.720 1.00 . A A . 4 LEU CD2 1 1
1 44 1 1 4 LEU CG C 1.490 -1.567 -3.082 1.00 . A A . 4 LEU CG 1 1
1 45 1 1 4 LEU H H 0.860 -1.216 0.204 1.00 . A A . 4 LEU H 1 1
1 46 1 1 4 LEU HA H 2.266 -3.401 -1.124 1.00 . A A . 4 LEU HA 1 1
1 47 1 1 4 LEU HB2 H 2.445 -0.423 -1.567 1.00 . A A . 4 LEU HB2 1 1
1 48 1 1 4 LEU HB3 H 3.479 -1.608 -2.337 1.00 . A A . 4 LEU HB3 1 1
1 49 1 1 4 LEU HD11 H 1.600 0.481 -3.664 1.00 . A A . 4 LEU HD11 1 1
1 50 1 1 4 LEU HD12 H 0.984 -0.602 -4.912 1.00 . A A . 4 LEU HD12 1 1
1 51 1 1 4 LEU HD13 H 2.704 -0.587 -4.530 1.00 . A A . 4 LEU HD13 1 1
1 52 1 1 4 LEU HD21 H 0.919 -2.989 -4.578 1.00 . A A . 4 LEU HD21 1 1
1 53 1 1 4 LEU HD22 H 1.267 -3.696 -3.005 1.00 . A A . 4 LEU HD22 1 1
1 54 1 1 4 LEU HD23 H 2.589 -3.140 -4.033 1.00 . A A . 4 LEU HD23 1 1
1 55 1 1 4 LEU HG H 0.505 -1.447 -2.666 1.00 . A A . 4 LEU HG 1 1
1 56 1 1 4 LEU N N 1.029 -2.133 -0.114 1.00 . A A . 4 LEU N 1 1
1 57 1 1 4 LEU O O 3.657 -1.114 0.705 1.00 . A A . 4 LEU O 1 1
1 58 1 1 5 PHE C C 6.340 -3.079 0.706 1.00 . A A . 5 PHE C 1 1
1 59 1 1 5 PHE CA C 5.073 -3.296 1.486 1.00 . A A . 5 PHE CA 1 1
1 60 1 1 5 PHE CB C 5.099 -4.558 2.343 1.00 . A A . 5 PHE CB 1 1
1 61 1 1 5 PHE CD1 C 2.739 -5.354 2.718 1.00 . A A . 5 PHE CD1 1 1
1 62 1 1 5 PHE CD2 C 3.822 -4.171 4.473 1.00 . A A . 5 PHE CD2 1 1
1 63 1 1 5 PHE CE1 C 1.601 -5.473 3.494 1.00 . A A . 5 PHE CE1 1 1
1 64 1 1 5 PHE CE2 C 2.690 -4.288 5.255 1.00 . A A . 5 PHE CE2 1 1
1 65 1 1 5 PHE CG C 3.863 -4.701 3.198 1.00 . A A . 5 PHE CG 1 1
1 66 1 1 5 PHE CZ C 1.577 -4.941 4.765 1.00 . A A . 5 PHE CZ 1 1
1 67 1 1 5 PHE H H 3.717 -4.156 0.158 1.00 . A A . 5 PHE H 1 1
1 68 1 1 5 PHE HA H 4.928 -2.432 2.119 1.00 . A A . 5 PHE HA 1 1
1 69 1 1 5 PHE HB2 H 5.171 -5.422 1.701 1.00 . A A . 5 PHE HB2 1 1
1 70 1 1 5 PHE HB3 H 5.958 -4.526 2.998 1.00 . A A . 5 PHE HB3 1 1
1 71 1 1 5 PHE HD1 H 2.756 -5.774 1.723 1.00 . A A . 5 PHE HD1 1 1
1 72 1 1 5 PHE HD2 H 4.691 -3.659 4.863 1.00 . A A . 5 PHE HD2 1 1
1 73 1 1 5 PHE HE1 H 0.734 -5.985 3.103 1.00 . A A . 5 PHE HE1 1 1
1 74 1 1 5 PHE HE2 H 2.681 -3.865 6.250 1.00 . A A . 5 PHE HE2 1 1
1 75 1 1 5 PHE HZ H 0.691 -5.031 5.376 1.00 . A A . 5 PHE HZ 1 1
1 76 1 1 5 PHE N N 3.989 -3.309 0.571 1.00 . A A . 5 PHE N 1 1
1 77 1 1 5 PHE O O 7.026 -4.013 0.276 1.00 . A A . 5 PHE O 1 1
1 78 1 1 6 SER C C 8.170 -0.165 0.386 1.00 . A A . 6 SER C 1 1
1 79 1 1 6 SER CA C 7.640 -1.385 -0.342 1.00 . A A . 6 SER CA 1 1
1 80 1 1 6 SER CB C 7.094 -1.025 -1.752 1.00 . A A . 6 SER CB 1 1
1 81 1 1 6 SER H H 5.962 -1.170 0.812 1.00 . A A . 6 SER H 1 1
1 82 1 1 6 SER HA H 8.388 -2.158 -0.416 1.00 . A A . 6 SER HA 1 1
1 83 1 1 6 SER HB2 H 6.560 -1.874 -2.157 1.00 . A A . 6 SER HB2 1 1
1 84 1 1 6 SER HB3 H 6.392 -0.209 -1.665 1.00 . A A . 6 SER HB3 1 1
1 85 1 1 6 SER HG H 8.455 -1.464 -3.072 1.00 . A A . 6 SER HG 1 1
1 86 1 1 6 SER N N 6.564 -1.847 0.438 1.00 . A A . 6 SER N 1 1
1 87 1 1 6 SER O O 7.860 0.021 1.567 1.00 . A A . 6 SER O 1 1
1 88 1 1 6 SER OG O 8.137 -0.649 -2.656 1.00 . A A . 6 SER OG 1 1
1 89 1 1 7 ASN C C 9.041 3.004 -0.525 1.00 . A A . 7 ASN C 1 1
1 90 1 1 7 ASN CA C 9.412 1.842 0.372 1.00 . A A . 7 ASN CA 1 1
1 91 1 1 7 ASN CB C 10.926 1.820 0.636 1.00 . A A . 7 ASN CB 1 1
1 92 1 1 7 ASN CG C 11.396 3.020 1.455 1.00 . A A . 7 ASN CG 1 1
1 93 1 1 7 ASN H H 9.241 0.412 -1.164 1.00 . A A . 7 ASN H 1 1
1 94 1 1 7 ASN HA H 8.883 1.923 1.308 1.00 . A A . 7 ASN HA 1 1
1 95 1 1 7 ASN HB2 H 11.177 0.921 1.182 1.00 . A A . 7 ASN HB2 1 1
1 96 1 1 7 ASN HB3 H 11.450 1.823 -0.307 1.00 . A A . 7 ASN HB3 1 1
1 97 1 1 7 ASN HD21 H 11.841 4.044 -0.185 1.00 . A A . 7 ASN HD21 1 1
1 98 1 1 7 ASN HD22 H 12.118 4.857 1.300 1.00 . A A . 7 ASN HD22 1 1
1 99 1 1 7 ASN N N 8.960 0.631 -0.249 1.00 . A A . 7 ASN N 1 1
1 100 1 1 7 ASN ND2 N 11.825 4.066 0.799 1.00 . A A . 7 ASN ND2 1 1
1 101 1 1 7 ASN O O 9.484 3.049 -1.675 1.00 . A A . 7 ASN O 1 1
1 102 1 1 7 ASN OD1 O 11.395 2.980 2.691 1.00 . A A . 7 ASN OD1 1 1
1 103 1 1 8 PRO C C 6.303 2.827 1.181 1.00 . A A . 8 PRO C 1 1
1 104 1 1 8 PRO CA C 7.480 3.826 1.230 1.00 . A A . 8 PRO CA 1 1
1 105 1 1 8 PRO CB C 6.936 5.263 1.434 1.00 . A A . 8 PRO CB 1 1
1 106 1 1 8 PRO CD C 7.772 5.117 -0.790 1.00 . A A . 8 PRO CD 1 1
1 107 1 1 8 PRO CG C 7.527 6.075 0.328 1.00 . A A . 8 PRO CG 1 1
1 108 1 1 8 PRO HA H 8.168 3.577 2.023 1.00 . A A . 8 PRO HA 1 1
1 109 1 1 8 PRO HB2 H 5.858 5.247 1.378 1.00 . A A . 8 PRO HB2 1 1
1 110 1 1 8 PRO HB3 H 7.243 5.632 2.402 1.00 . A A . 8 PRO HB3 1 1
1 111 1 1 8 PRO HD2 H 6.871 4.956 -1.363 1.00 . A A . 8 PRO HD2 1 1
1 112 1 1 8 PRO HD3 H 8.572 5.464 -1.428 1.00 . A A . 8 PRO HD3 1 1
1 113 1 1 8 PRO HG2 H 6.830 6.843 0.027 1.00 . A A . 8 PRO HG2 1 1
1 114 1 1 8 PRO HG3 H 8.456 6.520 0.655 1.00 . A A . 8 PRO HG3 1 1
1 115 1 1 8 PRO N N 8.165 3.910 -0.074 1.00 . A A . 8 PRO N 1 1
1 116 1 1 8 PRO O O 5.790 2.525 0.093 1.00 . A A . 8 PRO O 1 1
1 117 1 1 9 PRO C C 3.454 2.131 2.243 1.00 . A A . 9 PRO C 1 1
1 118 1 1 9 PRO CA C 4.753 1.354 2.370 1.00 . A A . 9 PRO CA 1 1
1 119 1 1 9 PRO CB C 4.849 0.683 3.754 1.00 . A A . 9 PRO CB 1 1
1 120 1 1 9 PRO CD C 6.476 2.438 3.662 1.00 . A A . 9 PRO CD 1 1
1 121 1 1 9 PRO CG C 6.157 1.134 4.325 1.00 . A A . 9 PRO CG 1 1
1 122 1 1 9 PRO HA H 4.810 0.613 1.586 1.00 . A A . 9 PRO HA 1 1
1 123 1 1 9 PRO HB2 H 4.020 1.008 4.365 1.00 . A A . 9 PRO HB2 1 1
1 124 1 1 9 PRO HB3 H 4.817 -0.391 3.642 1.00 . A A . 9 PRO HB3 1 1
1 125 1 1 9 PRO HD2 H 6.013 3.258 4.191 1.00 . A A . 9 PRO HD2 1 1
1 126 1 1 9 PRO HD3 H 7.545 2.572 3.602 1.00 . A A . 9 PRO HD3 1 1
1 127 1 1 9 PRO HG2 H 6.067 1.265 5.392 1.00 . A A . 9 PRO HG2 1 1
1 128 1 1 9 PRO HG3 H 6.922 0.404 4.103 1.00 . A A . 9 PRO HG3 1 1
1 129 1 1 9 PRO N N 5.886 2.263 2.329 1.00 . A A . 9 PRO N 1 1
1 130 1 1 9 PRO O O 3.048 2.847 3.167 1.00 . A A . 9 PRO O 1 1
1 131 1 1 10 ILE C C 0.454 1.826 0.925 1.00 . A A . 10 ILE C 1 1
1 132 1 1 10 ILE CA C 1.639 2.774 0.853 1.00 . A A . 10 ILE CA 1 1
1 133 1 1 10 ILE CB C 1.683 3.551 -0.505 1.00 . A A . 10 ILE CB 1 1
1 134 1 1 10 ILE CD1 C 0.398 5.228 -1.964 1.00 . A A . 10 ILE CD1 1 1
1 135 1 1 10 ILE CG1 C 0.389 4.361 -0.723 1.00 . A A . 10 ILE CG1 1 1
1 136 1 1 10 ILE CG2 C 1.957 2.612 -1.682 1.00 . A A . 10 ILE CG2 1 1
1 137 1 1 10 ILE H H 3.222 1.479 0.401 1.00 . A A . 10 ILE H 1 1
1 138 1 1 10 ILE HA H 1.542 3.489 1.657 1.00 . A A . 10 ILE HA 1 1
1 139 1 1 10 ILE HB H 2.515 4.239 -0.450 1.00 . A A . 10 ILE HB 1 1
1 140 1 1 10 ILE HD11 H -0.542 5.755 -2.042 1.00 . A A . 10 ILE HD11 1 1
1 141 1 1 10 ILE HD12 H 0.538 4.608 -2.836 1.00 . A A . 10 ILE HD12 1 1
1 142 1 1 10 ILE HD13 H 1.206 5.943 -1.897 1.00 . A A . 10 ILE HD13 1 1
1 143 1 1 10 ILE HG12 H -0.443 3.677 -0.810 1.00 . A A . 10 ILE HG12 1 1
1 144 1 1 10 ILE HG13 H 0.228 5.002 0.131 1.00 . A A . 10 ILE HG13 1 1
1 145 1 1 10 ILE HG21 H 2.915 2.130 -1.545 1.00 . A A . 10 ILE HG21 1 1
1 146 1 1 10 ILE HG22 H 1.966 3.179 -2.600 1.00 . A A . 10 ILE HG22 1 1
1 147 1 1 10 ILE HG23 H 1.180 1.863 -1.729 1.00 . A A . 10 ILE HG23 1 1
1 148 1 1 10 ILE N N 2.851 2.056 1.100 1.00 . A A . 10 ILE N 1 1
1 149 1 1 10 ILE O O 0.508 0.688 0.410 1.00 . A A . 10 ILE O 1 1
1 150 1 1 11 ALA C C -2.950 2.195 1.285 1.00 . A A . 11 ALA C 1 1
1 151 1 1 11 ALA CA C -1.748 1.443 1.759 1.00 . A A . 11 ALA CA 1 1
1 152 1 1 11 ALA CB C -1.950 0.936 3.196 1.00 . A A . 11 ALA CB 1 1
1 153 1 1 11 ALA H H -0.562 3.133 2.031 1.00 . A A . 11 ALA H 1 1
1 154 1 1 11 ALA HA H -1.624 0.582 1.117 1.00 . A A . 11 ALA HA 1 1
1 155 1 1 11 ALA HB1 H -2.816 0.292 3.208 1.00 . A A . 11 ALA HB1 1 1
1 156 1 1 11 ALA HB2 H -2.135 1.724 3.904 1.00 . A A . 11 ALA HB2 1 1
1 157 1 1 11 ALA N N -0.577 2.245 1.615 1.00 . A A . 11 ALA N 1 1
1 158 1 1 11 ALA O O -3.050 3.416 1.457 1.00 . A A . 11 ALA O 1 1
1 159 1 1 12 PHE C C -6.236 1.522 0.882 1.00 . A A . 12 PHE C 1 1
1 160 1 1 12 PHE CA C -5.027 2.049 0.120 1.00 . A A . 12 PHE CA 1 1
1 161 1 1 12 PHE CB C -5.138 1.680 -1.364 1.00 . A A . 12 PHE CB 1 1
1 162 1 1 12 PHE CD1 C -2.851 1.306 -2.364 1.00 . A A . 12 PHE CD1 1 1
1 163 1 1 12 PHE CD2 C -3.985 3.337 -2.857 1.00 . A A . 12 PHE CD2 1 1
1 164 1 1 12 PHE CE1 C -1.786 1.701 -3.141 1.00 . A A . 12 PHE CE1 1 1
1 165 1 1 12 PHE CE2 C -2.923 3.738 -3.635 1.00 . A A . 12 PHE CE2 1 1
1 166 1 1 12 PHE CG C -3.966 2.121 -2.210 1.00 . A A . 12 PHE CG 1 1
1 167 1 1 12 PHE CZ C -1.820 2.918 -3.778 1.00 . A A . 12 PHE CZ 1 1
1 168 1 1 12 PHE H H -3.690 0.513 0.604 1.00 . A A . 12 PHE H 1 1
1 169 1 1 12 PHE HA H -4.963 3.123 0.213 1.00 . A A . 12 PHE HA 1 1
1 170 1 1 12 PHE HB2 H -5.226 0.608 -1.446 1.00 . A A . 12 PHE HB2 1 1
1 171 1 1 12 PHE HB3 H -6.030 2.134 -1.767 1.00 . A A . 12 PHE HB3 1 1
1 172 1 1 12 PHE HD1 H -2.826 0.352 -1.858 1.00 . A A . 12 PHE HD1 1 1
1 173 1 1 12 PHE HD2 H -4.844 3.984 -2.750 1.00 . A A . 12 PHE HD2 1 1
1 174 1 1 12 PHE HE1 H -0.925 1.056 -3.249 1.00 . A A . 12 PHE HE1 1 1
1 175 1 1 12 PHE HE2 H -2.953 4.696 -4.132 1.00 . A A . 12 PHE HE2 1 1
1 176 1 1 12 PHE HZ H -0.987 3.233 -4.390 1.00 . A A . 12 PHE HZ 1 1
1 177 1 1 12 PHE N N -3.838 1.484 0.681 1.00 . A A . 12 PHE N 1 1
1 178 1 1 12 PHE O O -6.261 0.340 1.253 1.00 . A A . 12 PHE O 1 1
1 179 1 1 13 PRO C C -9.202 0.763 1.396 1.00 . A A . 13 PRO C 1 1
1 180 1 1 13 PRO CA C -8.473 2.023 1.896 1.00 . A A . 13 PRO CA 1 1
1 181 1 1 13 PRO CB C -9.372 3.249 1.727 1.00 . A A . 13 PRO CB 1 1
1 182 1 1 13 PRO CD C -7.291 3.802 0.711 1.00 . A A . 13 PRO CD 1 1
1 183 1 1 13 PRO CG C -8.426 4.370 1.512 1.00 . A A . 13 PRO CG 1 1
1 184 1 1 13 PRO HA H -8.244 1.898 2.944 1.00 . A A . 13 PRO HA 1 1
1 185 1 1 13 PRO HB2 H -10.019 3.104 0.874 1.00 . A A . 13 PRO HB2 1 1
1 186 1 1 13 PRO HB3 H -9.964 3.396 2.617 1.00 . A A . 13 PRO HB3 1 1
1 187 1 1 13 PRO HD2 H -7.488 3.895 -0.347 1.00 . A A . 13 PRO HD2 1 1
1 188 1 1 13 PRO HD3 H -6.374 4.307 0.974 1.00 . A A . 13 PRO HD3 1 1
1 189 1 1 13 PRO HG2 H -8.914 5.163 0.965 1.00 . A A . 13 PRO HG2 1 1
1 190 1 1 13 PRO HG3 H -8.067 4.735 2.463 1.00 . A A . 13 PRO HG3 1 1
1 191 1 1 13 PRO N N -7.254 2.382 1.131 1.00 . A A . 13 PRO N 1 1
1 192 1 1 13 PRO O O -9.932 0.129 2.154 1.00 . A A . 13 PRO O 1 1
1 193 1 1 14 ASN C C -8.975 -2.091 0.060 1.00 . A A . 14 ASN C 1 1
1 194 1 1 14 ASN CA C -9.657 -0.805 -0.408 1.00 . A A . 14 ASN CA 1 1
1 195 1 1 14 ASN CB C -9.751 -0.800 -1.952 1.00 . A A . 14 ASN CB 1 1
1 196 1 1 14 ASN CG C -8.418 -0.988 -2.672 1.00 . A A . 14 ASN CG 1 1
1 197 1 1 14 ASN H H -8.389 0.914 -0.429 1.00 . A A . 14 ASN H 1 1
1 198 1 1 14 ASN HA H -10.657 -0.809 0.000 1.00 . A A . 14 ASN HA 1 1
1 199 1 1 14 ASN HB2 H -10.407 -1.600 -2.260 1.00 . A A . 14 ASN HB2 1 1
1 200 1 1 14 ASN HB3 H -10.183 0.137 -2.270 1.00 . A A . 14 ASN HB3 1 1
1 201 1 1 14 ASN HD21 H -9.330 -1.999 -4.100 1.00 . A A . 14 ASN HD21 1 1
1 202 1 1 14 ASN HD22 H -7.637 -1.814 -4.304 1.00 . A A . 14 ASN HD22 1 1
1 203 1 1 14 ASN N N -8.994 0.386 0.137 1.00 . A A . 14 ASN N 1 1
1 204 1 1 14 ASN ND2 N -8.460 -1.660 -3.796 1.00 . A A . 14 ASN ND2 1 1
1 205 1 1 14 ASN O O -9.439 -3.193 -0.242 1.00 . A A . 14 ASN O 1 1
1 206 1 1 14 ASN OD1 O -7.359 -0.558 -2.203 1.00 . A A . 14 ASN OD1 1 1
1 207 2 2 1 . C C -1.664 -2.034 3.168 1.00 . B A . 101 WMH C 1 1
1 208 2 2 1 . C1 C -0.795 0.140 3.722 1.00 . B A . 101 WMH C1 1 1
1 209 2 2 1 . C2 C 0.363 0.624 4.244 1.00 . B A . 101 WMH C2 1 1
1 210 2 2 1 . H1 H -2.303 -2.361 3.966 1.00 . B A . 101 WMH H1 1 1
1 211 2 2 1 . H2 H -2.289 -1.429 2.531 1.00 . B A . 101 WMH H2 1 1
1 212 2 2 1 . H5 H 0.594 1.664 4.416 1.00 . B A . 101 WMH H5 1 1
1 213 2 2 1 . N N -0.698 -1.162 3.666 1.00 . B A . 101 WMH N 1 1
1 214 2 2 1 . N1 N 1.159 -0.410 4.505 1.00 . B A . 101 WMH N1 1 1
1 215 2 2 1 . N2 N 0.567 -1.502 4.177 1.00 . B A . 101 WMH N2 1 1
2 216 1 1 1 GLY C C -6.581 -3.683 0.842 1.00 . A A . 1 GLY C 1 1
2 217 1 1 1 GLY CA C -7.664 -3.032 1.669 1.00 . A A . 1 GLY CA 1 1
2 218 1 1 1 GLY H1 H -7.785 -0.953 1.283 1.00 . A A . 1 GLY H1 1 1
2 219 1 1 1 GLY HA2 H -7.257 -2.794 2.641 1.00 . A A . 1 GLY HA2 1 1
2 220 1 1 1 GLY HA3 H -8.475 -3.734 1.798 1.00 . A A . 1 GLY HA3 1 1
2 221 1 1 1 GLY N N -8.200 -1.819 1.082 1.00 . A A . 1 GLY N 1 1
2 222 1 1 1 GLY O O -6.643 -4.882 0.560 1.00 . A A . 1 GLY O 1 1
2 223 1 1 2 LYS C C -3.227 -2.608 0.122 1.00 . A A . 2 LYS C 1 1
2 224 1 1 2 LYS CA C -4.438 -3.398 -0.307 1.00 . A A . 2 LYS CA 1 1
2 225 1 1 2 LYS CB C -4.655 -3.297 -1.836 1.00 . A A . 2 LYS CB 1 1
2 226 1 1 2 LYS CD C -5.227 -5.724 -2.235 1.00 . A A . 2 LYS CD 1 1
2 227 1 1 2 LYS CE C -6.319 -6.713 -2.617 1.00 . A A . 2 LYS CE 1 1
2 228 1 1 2 LYS CG C -5.684 -4.275 -2.398 1.00 . A A . 2 LYS CG 1 1
2 229 1 1 2 LYS H H -5.608 -1.952 0.682 1.00 . A A . 2 LYS H 1 1
2 230 1 1 2 LYS HA H -4.281 -4.428 -0.022 1.00 . A A . 2 LYS HA 1 1
2 231 1 1 2 LYS HB2 H -5.012 -2.303 -2.055 1.00 . A A . 2 LYS HB2 1 1
2 232 1 1 2 LYS HB3 H -3.714 -3.461 -2.340 1.00 . A A . 2 LYS HB3 1 1
2 233 1 1 2 LYS HD2 H -4.368 -5.895 -2.866 1.00 . A A . 2 LYS HD2 1 1
2 234 1 1 2 LYS HD3 H -4.950 -5.895 -1.206 1.00 . A A . 2 LYS HD3 1 1
2 235 1 1 2 LYS HE2 H -6.644 -6.506 -3.624 1.00 . A A . 2 LYS HE2 1 1
2 236 1 1 2 LYS HE3 H -5.911 -7.713 -2.575 1.00 . A A . 2 LYS HE3 1 1
2 237 1 1 2 LYS HG2 H -6.618 -4.142 -1.871 1.00 . A A . 2 LYS HG2 1 1
2 238 1 1 2 LYS HG3 H -5.824 -4.064 -3.447 1.00 . A A . 2 LYS HG3 1 1
2 239 1 1 2 LYS HZ1 H -8.176 -7.379 -1.935 1.00 . A A . 2 LYS HZ1 1 1
2 240 1 1 2 LYS HZ2 H -7.997 -5.725 -1.800 1.00 . A A . 2 LYS HZ2 1 1
2 241 1 1 2 LYS HZ3 H -7.207 -6.742 -0.717 1.00 . A A . 2 LYS HZ3 1 1
2 242 1 1 2 LYS N N -5.596 -2.905 0.445 1.00 . A A . 2 LYS N 1 1
2 243 1 1 2 LYS NZ N -7.491 -6.630 -1.710 1.00 . A A . 2 LYS NZ 1 1
2 244 1 1 2 LYS O O -3.356 -1.434 0.441 1.00 . A A . 2 LYS O 1 1
2 245 1 1 3 ALA C C 0.348 -2.926 -0.154 1.00 . A A . 3 ALA C 1 1
2 246 1 1 3 ALA CA C -0.872 -2.589 0.654 1.00 . A A . 3 ALA CA 1 1
2 247 1 1 3 ALA CB C -0.666 -2.919 2.140 1.00 . A A . 3 ALA CB 1 1
2 248 1 1 3 ALA H H -1.989 -4.148 -0.190 1.00 . A A . 3 ALA H 1 1
2 249 1 1 3 ALA HA H -1.027 -1.524 0.575 1.00 . A A . 3 ALA HA 1 1
2 250 1 1 3 ALA HB1 H 0.392 -2.916 2.356 1.00 . A A . 3 ALA HB1 1 1
2 251 1 1 3 ALA HB2 H -1.066 -3.899 2.345 1.00 . A A . 3 ALA HB2 1 1
2 252 1 1 3 ALA N N -2.075 -3.231 0.153 1.00 . A A . 3 ALA N 1 1
2 253 1 1 3 ALA O O 0.524 -4.055 -0.597 1.00 . A A . 3 ALA O 1 1
2 254 1 1 4 LEU C C 3.517 -2.203 -0.093 1.00 . A A . 4 LEU C 1 1
2 255 1 1 4 LEU CA C 2.401 -2.061 -1.078 1.00 . A A . 4 LEU CA 1 1
2 256 1 1 4 LEU CB C 2.698 -0.855 -1.998 1.00 . A A . 4 LEU CB 1 1
2 257 1 1 4 LEU CD1 C 1.863 -1.915 -4.131 1.00 . A A . 4 LEU CD1 1 1
2 258 1 1 4 LEU CD2 C 0.418 -0.260 -2.928 1.00 . A A . 4 LEU CD2 1 1
2 259 1 1 4 LEU CG C 1.838 -0.671 -3.262 1.00 . A A . 4 LEU CG 1 1
2 260 1 1 4 LEU H H 0.934 -1.029 -0.034 1.00 . A A . 4 LEU H 1 1
2 261 1 1 4 LEU HA H 2.339 -2.953 -1.680 1.00 . A A . 4 LEU HA 1 1
2 262 1 1 4 LEU HB2 H 2.597 0.037 -1.399 1.00 . A A . 4 LEU HB2 1 1
2 263 1 1 4 LEU HB3 H 3.732 -0.934 -2.299 1.00 . A A . 4 LEU HB3 1 1
2 264 1 1 4 LEU HD11 H 1.285 -1.739 -5.025 1.00 . A A . 4 LEU HD11 1 1
2 265 1 1 4 LEU HD12 H 1.433 -2.744 -3.589 1.00 . A A . 4 LEU HD12 1 1
2 266 1 1 4 LEU HD13 H 2.883 -2.147 -4.402 1.00 . A A . 4 LEU HD13 1 1
2 267 1 1 4 LEU HD21 H -0.042 -1.023 -2.317 1.00 . A A . 4 LEU HD21 1 1
2 268 1 1 4 LEU HD22 H -0.146 -0.139 -3.841 1.00 . A A . 4 LEU HD22 1 1
2 269 1 1 4 LEU HD23 H 0.429 0.674 -2.387 1.00 . A A . 4 LEU HD23 1 1
2 270 1 1 4 LEU HG H 2.289 0.117 -3.849 1.00 . A A . 4 LEU HG 1 1
2 271 1 1 4 LEU N N 1.162 -1.926 -0.370 1.00 . A A . 4 LEU N 1 1
2 272 1 1 4 LEU O O 3.842 -1.256 0.650 1.00 . A A . 4 LEU O 1 1
2 273 1 1 5 PHE C C 6.452 -3.189 0.127 1.00 . A A . 5 PHE C 1 1
2 274 1 1 5 PHE CA C 5.181 -3.646 0.809 1.00 . A A . 5 PHE CA 1 1
2 275 1 1 5 PHE CB C 5.228 -5.143 1.141 1.00 . A A . 5 PHE CB 1 1
2 276 1 1 5 PHE CD1 C 3.131 -6.453 0.721 1.00 . A A . 5 PHE CD1 1 1
2 277 1 1 5 PHE CD2 C 3.374 -5.361 2.822 1.00 . A A . 5 PHE CD2 1 1
2 278 1 1 5 PHE CE1 C 1.889 -6.908 1.095 1.00 . A A . 5 PHE CE1 1 1
2 279 1 1 5 PHE CE2 C 2.133 -5.820 3.204 1.00 . A A . 5 PHE CE2 1 1
2 280 1 1 5 PHE CG C 3.890 -5.674 1.578 1.00 . A A . 5 PHE CG 1 1
2 281 1 1 5 PHE CZ C 1.391 -6.593 2.337 1.00 . A A . 5 PHE CZ 1 1
2 282 1 1 5 PHE H H 3.742 -4.066 -0.652 1.00 . A A . 5 PHE H 1 1
2 283 1 1 5 PHE HA H 5.043 -3.078 1.717 1.00 . A A . 5 PHE HA 1 1
2 284 1 1 5 PHE HB2 H 5.541 -5.692 0.265 1.00 . A A . 5 PHE HB2 1 1
2 285 1 1 5 PHE HB3 H 5.934 -5.312 1.940 1.00 . A A . 5 PHE HB3 1 1
2 286 1 1 5 PHE HD1 H 3.520 -6.708 -0.254 1.00 . A A . 5 PHE HD1 1 1
2 287 1 1 5 PHE HD2 H 3.954 -4.756 3.503 1.00 . A A . 5 PHE HD2 1 1
2 288 1 1 5 PHE HE1 H 1.309 -7.514 0.415 1.00 . A A . 5 PHE HE1 1 1
2 289 1 1 5 PHE HE2 H 1.744 -5.571 4.180 1.00 . A A . 5 PHE HE2 1 1
2 290 1 1 5 PHE HZ H 0.414 -6.951 2.626 1.00 . A A . 5 PHE HZ 1 1
2 291 1 1 5 PHE N N 4.085 -3.362 -0.060 1.00 . A A . 5 PHE N 1 1
2 292 1 1 5 PHE O O 7.102 -3.940 -0.609 1.00 . A A . 5 PHE O 1 1
2 293 1 1 6 SER C C 8.214 -0.105 0.563 1.00 . A A . 6 SER C 1 1
2 294 1 1 6 SER CA C 7.845 -1.280 -0.329 1.00 . A A . 6 SER CA 1 1
2 295 1 1 6 SER CB C 7.480 -0.786 -1.740 1.00 . A A . 6 SER CB 1 1
2 296 1 1 6 SER H H 6.108 -1.376 0.799 1.00 . A A . 6 SER H 1 1
2 297 1 1 6 SER HA H 8.661 -1.983 -0.389 1.00 . A A . 6 SER HA 1 1
2 298 1 1 6 SER HB2 H 6.684 -0.062 -1.665 1.00 . A A . 6 SER HB2 1 1
2 299 1 1 6 SER HB3 H 8.343 -0.322 -2.194 1.00 . A A . 6 SER HB3 1 1
2 300 1 1 6 SER HG H 7.049 -2.657 -2.018 1.00 . A A . 6 SER HG 1 1
2 301 1 1 6 SER N N 6.714 -1.927 0.258 1.00 . A A . 6 SER N 1 1
2 302 1 1 6 SER O O 7.749 -0.025 1.710 1.00 . A A . 6 SER O 1 1
2 303 1 1 6 SER OG O 7.045 -1.863 -2.573 1.00 . A A . 6 SER OG 1 1
2 304 1 1 7 ASN C C 9.049 3.164 -0.055 1.00 . A A . 7 ASN C 1 1
2 305 1 1 7 ASN CA C 9.398 1.958 0.812 1.00 . A A . 7 ASN CA 1 1
2 306 1 1 7 ASN CB C 10.895 1.957 1.128 1.00 . A A . 7 ASN CB 1 1
2 307 1 1 7 ASN CG C 11.327 3.051 2.102 1.00 . A A . 7 ASN CG 1 1
2 308 1 1 7 ASN H H 9.463 0.634 -0.796 1.00 . A A . 7 ASN H 1 1
2 309 1 1 7 ASN HA H 8.830 1.966 1.729 1.00 . A A . 7 ASN HA 1 1
2 310 1 1 7 ASN HB2 H 11.152 1.003 1.563 1.00 . A A . 7 ASN HB2 1 1
2 311 1 1 7 ASN HB3 H 11.446 2.080 0.206 1.00 . A A . 7 ASN HB3 1 1
2 312 1 1 7 ASN HD21 H 12.845 1.943 2.658 1.00 . A A . 7 ASN HD21 1 1
2 313 1 1 7 ASN HD22 H 12.715 3.487 3.423 1.00 . A A . 7 ASN HD22 1 1
2 314 1 1 7 ASN N N 9.043 0.771 0.081 1.00 . A A . 7 ASN N 1 1
2 315 1 1 7 ASN ND2 N 12.392 2.804 2.799 1.00 . A A . 7 ASN ND2 1 1
2 316 1 1 7 ASN O O 9.641 3.347 -1.133 1.00 . A A . 7 ASN O 1 1
2 317 1 1 7 ASN OD1 O 10.709 4.116 2.212 1.00 . A A . 7 ASN OD1 1 1
2 318 1 1 8 PRO C C 6.200 2.835 1.495 1.00 . A A . 8 PRO C 1 1
2 319 1 1 8 PRO CA C 7.353 3.839 1.616 1.00 . A A . 8 PRO CA 1 1
2 320 1 1 8 PRO CB C 6.789 5.240 1.831 1.00 . A A . 8 PRO CB 1 1
2 321 1 1 8 PRO CD C 7.624 5.176 -0.395 1.00 . A A . 8 PRO CD 1 1
2 322 1 1 8 PRO CG C 6.522 5.731 0.459 1.00 . A A . 8 PRO CG 1 1
2 323 1 1 8 PRO HA H 7.995 3.576 2.444 1.00 . A A . 8 PRO HA 1 1
2 324 1 1 8 PRO HB2 H 5.886 5.181 2.421 1.00 . A A . 8 PRO HB2 1 1
2 325 1 1 8 PRO HB3 H 7.520 5.854 2.333 1.00 . A A . 8 PRO HB3 1 1
2 326 1 1 8 PRO HD2 H 7.246 4.890 -1.366 1.00 . A A . 8 PRO HD2 1 1
2 327 1 1 8 PRO HD3 H 8.420 5.898 -0.496 1.00 . A A . 8 PRO HD3 1 1
2 328 1 1 8 PRO HG2 H 5.563 5.367 0.120 1.00 . A A . 8 PRO HG2 1 1
2 329 1 1 8 PRO HG3 H 6.542 6.810 0.442 1.00 . A A . 8 PRO HG3 1 1
2 330 1 1 8 PRO N N 8.088 3.996 0.356 1.00 . A A . 8 PRO N 1 1
2 331 1 1 8 PRO O O 5.786 2.484 0.382 1.00 . A A . 8 PRO O 1 1
2 332 1 1 9 PRO C C 3.282 2.231 2.219 1.00 . A A . 9 PRO C 1 1
2 333 1 1 9 PRO CA C 4.546 1.448 2.614 1.00 . A A . 9 PRO CA 1 1
2 334 1 1 9 PRO CB C 4.455 0.921 4.053 1.00 . A A . 9 PRO CB 1 1
2 335 1 1 9 PRO CD C 6.245 2.517 3.985 1.00 . A A . 9 PRO CD 1 1
2 336 1 1 9 PRO CG C 5.206 1.908 4.881 1.00 . A A . 9 PRO CG 1 1
2 337 1 1 9 PRO HA H 4.684 0.633 1.918 1.00 . A A . 9 PRO HA 1 1
2 338 1 1 9 PRO HB2 H 3.417 0.863 4.349 1.00 . A A . 9 PRO HB2 1 1
2 339 1 1 9 PRO HB3 H 4.901 -0.061 4.108 1.00 . A A . 9 PRO HB3 1 1
2 340 1 1 9 PRO HD2 H 6.363 3.568 4.203 1.00 . A A . 9 PRO HD2 1 1
2 341 1 1 9 PRO HD3 H 7.189 2.002 4.097 1.00 . A A . 9 PRO HD3 1 1
2 342 1 1 9 PRO HG2 H 4.535 2.672 5.243 1.00 . A A . 9 PRO HG2 1 1
2 343 1 1 9 PRO HG3 H 5.677 1.405 5.714 1.00 . A A . 9 PRO HG3 1 1
2 344 1 1 9 PRO N N 5.700 2.320 2.624 1.00 . A A . 9 PRO N 1 1
2 345 1 1 9 PRO O O 2.750 3.049 2.994 1.00 . A A . 9 PRO O 1 1
2 346 1 1 10 ILE C C 0.526 1.783 0.633 1.00 . A A . 10 ILE C 1 1
2 347 1 1 10 ILE CA C 1.704 2.709 0.457 1.00 . A A . 10 ILE CA 1 1
2 348 1 1 10 ILE CB C 1.894 3.018 -1.053 1.00 . A A . 10 ILE CB 1 1
2 349 1 1 10 ILE CD1 C 3.433 4.222 -2.716 1.00 . A A . 10 ILE CD1 1 1
2 350 1 1 10 ILE CG1 C 3.110 3.938 -1.264 1.00 . A A . 10 ILE CG1 1 1
2 351 1 1 10 ILE CG2 C 0.627 3.631 -1.650 1.00 . A A . 10 ILE CG2 1 1
2 352 1 1 10 ILE H H 3.391 1.449 0.422 1.00 . A A . 10 ILE H 1 1
2 353 1 1 10 ILE HA H 1.534 3.631 0.992 1.00 . A A . 10 ILE HA 1 1
2 354 1 1 10 ILE HB H 2.075 2.083 -1.563 1.00 . A A . 10 ILE HB 1 1
2 355 1 1 10 ILE HD11 H 3.636 3.292 -3.227 1.00 . A A . 10 ILE HD11 1 1
2 356 1 1 10 ILE HD12 H 4.301 4.861 -2.773 1.00 . A A . 10 ILE HD12 1 1
2 357 1 1 10 ILE HD13 H 2.592 4.713 -3.183 1.00 . A A . 10 ILE HD13 1 1
2 358 1 1 10 ILE HG12 H 2.928 4.885 -0.780 1.00 . A A . 10 ILE HG12 1 1
2 359 1 1 10 ILE HG13 H 3.978 3.476 -0.814 1.00 . A A . 10 ILE HG13 1 1
2 360 1 1 10 ILE HG21 H 0.379 4.538 -1.120 1.00 . A A . 10 ILE HG21 1 1
2 361 1 1 10 ILE HG22 H -0.189 2.930 -1.565 1.00 . A A . 10 ILE HG22 1 1
2 362 1 1 10 ILE HG23 H 0.802 3.860 -2.690 1.00 . A A . 10 ILE HG23 1 1
2 363 1 1 10 ILE N N 2.876 2.056 0.995 1.00 . A A . 10 ILE N 1 1
2 364 1 1 10 ILE O O 0.607 0.618 0.269 1.00 . A A . 10 ILE O 1 1
2 365 1 1 11 ALA C C -2.917 2.033 0.842 1.00 . A A . 11 ALA C 1 1
2 366 1 1 11 ALA CA C -1.684 1.406 1.408 1.00 . A A . 11 ALA CA 1 1
2 367 1 1 11 ALA CB C -1.898 0.993 2.879 1.00 . A A . 11 ALA CB 1 1
2 368 1 1 11 ALA H H -0.589 3.194 1.504 1.00 . A A . 11 ALA H 1 1
2 369 1 1 11 ALA HA H -1.492 0.509 0.837 1.00 . A A . 11 ALA HA 1 1
2 370 1 1 11 ALA HB1 H -2.711 0.287 2.919 1.00 . A A . 11 ALA HB1 1 1
2 371 1 1 11 ALA HB2 H -2.168 1.810 3.522 1.00 . A A . 11 ALA HB2 1 1
2 372 1 1 11 ALA N N -0.543 2.257 1.217 1.00 . A A . 11 ALA N 1 1
2 373 1 1 11 ALA O O -3.089 3.257 0.891 1.00 . A A . 11 ALA O 1 1
2 374 1 1 12 PHE C C -6.128 1.421 0.679 1.00 . A A . 12 PHE C 1 1
2 375 1 1 12 PHE CA C -4.985 1.643 -0.294 1.00 . A A . 12 PHE CA 1 1
2 376 1 1 12 PHE CB C -5.272 0.867 -1.585 1.00 . A A . 12 PHE CB 1 1
2 377 1 1 12 PHE CD1 C -4.073 2.310 -3.255 1.00 . A A . 12 PHE CD1 1 1
2 378 1 1 12 PHE CD2 C -3.576 -0.017 -3.211 1.00 . A A . 12 PHE CD2 1 1
2 379 1 1 12 PHE CE1 C -3.184 2.479 -4.295 1.00 . A A . 12 PHE CE1 1 1
2 380 1 1 12 PHE CE2 C -2.687 0.149 -4.250 1.00 . A A . 12 PHE CE2 1 1
2 381 1 1 12 PHE CG C -4.278 1.060 -2.698 1.00 . A A . 12 PHE CG 1 1
2 382 1 1 12 PHE CZ C -2.491 1.399 -4.793 1.00 . A A . 12 PHE CZ 1 1
2 383 1 1 12 PHE H H -3.562 0.246 0.341 1.00 . A A . 12 PHE H 1 1
2 384 1 1 12 PHE HA H -4.882 2.690 -0.532 1.00 . A A . 12 PHE HA 1 1
2 385 1 1 12 PHE HB2 H -5.296 -0.187 -1.354 1.00 . A A . 12 PHE HB2 1 1
2 386 1 1 12 PHE HB3 H -6.246 1.159 -1.953 1.00 . A A . 12 PHE HB3 1 1
2 387 1 1 12 PHE HD1 H -4.609 3.164 -2.868 1.00 . A A . 12 PHE HD1 1 1
2 388 1 1 12 PHE HD2 H -3.720 -1.001 -2.794 1.00 . A A . 12 PHE HD2 1 1
2 389 1 1 12 PHE HE1 H -3.034 3.461 -4.719 1.00 . A A . 12 PHE HE1 1 1
2 390 1 1 12 PHE HE2 H -2.144 -0.701 -4.639 1.00 . A A . 12 PHE HE2 1 1
2 391 1 1 12 PHE HZ H -1.793 1.532 -5.607 1.00 . A A . 12 PHE HZ 1 1
2 392 1 1 12 PHE N N -3.761 1.211 0.306 1.00 . A A . 12 PHE N 1 1
2 393 1 1 12 PHE O O -6.233 0.333 1.272 1.00 . A A . 12 PHE O 1 1
2 394 1 1 13 PRO C C -9.187 1.219 1.401 1.00 . A A . 13 PRO C 1 1
2 395 1 1 13 PRO CA C -8.192 2.347 1.761 1.00 . A A . 13 PRO CA 1 1
2 396 1 1 13 PRO CB C -8.868 3.713 1.585 1.00 . A A . 13 PRO CB 1 1
2 397 1 1 13 PRO CD C -6.958 3.748 0.179 1.00 . A A . 13 PRO CD 1 1
2 398 1 1 13 PRO CG C -7.796 4.604 1.070 1.00 . A A . 13 PRO CG 1 1
2 399 1 1 13 PRO HA H -7.876 2.228 2.786 1.00 . A A . 13 PRO HA 1 1
2 400 1 1 13 PRO HB2 H -9.677 3.621 0.876 1.00 . A A . 13 PRO HB2 1 1
2 401 1 1 13 PRO HB3 H -9.249 4.060 2.533 1.00 . A A . 13 PRO HB3 1 1
2 402 1 1 13 PRO HD2 H -7.370 3.712 -0.819 1.00 . A A . 13 PRO HD2 1 1
2 403 1 1 13 PRO HD3 H -5.948 4.128 0.169 1.00 . A A . 13 PRO HD3 1 1
2 404 1 1 13 PRO HG2 H -8.227 5.424 0.515 1.00 . A A . 13 PRO HG2 1 1
2 405 1 1 13 PRO HG3 H -7.205 4.978 1.893 1.00 . A A . 13 PRO HG3 1 1
2 406 1 1 13 PRO N N -7.024 2.424 0.842 1.00 . A A . 13 PRO N 1 1
2 407 1 1 13 PRO O O -10.129 0.939 2.149 1.00 . A A . 13 PRO O 1 1
2 408 1 1 14 ASN C C -9.240 -1.867 0.264 1.00 . A A . 14 ASN C 1 1
2 409 1 1 14 ASN CA C -9.812 -0.522 -0.191 1.00 . A A . 14 ASN CA 1 1
2 410 1 1 14 ASN CB C -10.010 -0.494 -1.719 1.00 . A A . 14 ASN CB 1 1
2 411 1 1 14 ASN CG C -8.722 -0.572 -2.512 1.00 . A A . 14 ASN CG 1 1
2 412 1 1 14 ASN H H -8.234 0.895 -0.303 1.00 . A A . 14 ASN H 1 1
2 413 1 1 14 ASN HA H -10.774 -0.401 0.286 1.00 . A A . 14 ASN HA 1 1
2 414 1 1 14 ASN HB2 H -10.624 -1.334 -2.008 1.00 . A A . 14 ASN HB2 1 1
2 415 1 1 14 ASN HB3 H -10.520 0.420 -1.984 1.00 . A A . 14 ASN HB3 1 1
2 416 1 1 14 ASN HD21 H -8.856 -2.539 -2.641 1.00 . A A . 14 ASN HD21 1 1
2 417 1 1 14 ASN HD22 H -7.508 -1.827 -3.440 1.00 . A A . 14 ASN HD22 1 1
2 418 1 1 14 ASN N N -8.978 0.591 0.259 1.00 . A A . 14 ASN N 1 1
2 419 1 1 14 ASN ND2 N -8.317 -1.755 -2.891 1.00 . A A . 14 ASN ND2 1 1
2 420 1 1 14 ASN O O -9.722 -2.924 -0.139 1.00 . A A . 14 ASN O 1 1
2 421 1 1 14 ASN OD1 O -8.105 0.448 -2.792 1.00 . A A . 14 ASN OD1 1 1
2 422 2 2 1 . C C -1.339 -1.926 3.060 1.00 . B A . 101 WMH C 1 1
2 423 2 2 1 . C1 C -0.707 0.338 3.504 1.00 . B A . 101 WMH C1 1 1
2 424 2 2 1 . C2 C 0.364 0.955 4.054 1.00 . B A . 101 WMH C2 1 1
2 425 2 2 1 . H1 H -1.957 -2.293 3.859 1.00 . B A . 101 WMH H1 1 1
2 426 2 2 1 . H2 H -2.021 -1.404 2.410 1.00 . B A . 101 WMH H2 1 1
2 427 2 2 1 . H5 H 0.489 2.021 4.170 1.00 . B A . 101 WMH H5 1 1
2 428 2 2 1 . N N -0.487 -0.950 3.539 1.00 . B A . 101 WMH N 1 1
2 429 2 2 1 . N1 N 1.236 0.018 4.425 1.00 . B A . 101 WMH N1 1 1
2 430 2 2 1 . N2 N 0.765 -1.147 4.134 1.00 . B A . 101 WMH N2 1 1
3 431 1 1 1 GLY C C -6.127 -3.400 0.748 1.00 . A A . 1 GLY C 1 1
3 432 1 1 1 GLY CA C -7.277 -2.872 1.573 1.00 . A A . 1 GLY CA 1 1
3 433 1 1 1 GLY H1 H -7.412 -0.836 1.081 1.00 . A A . 1 GLY H1 1 1
3 434 1 1 1 GLY HA2 H -6.917 -2.641 2.563 1.00 . A A . 1 GLY HA2 1 1
3 435 1 1 1 GLY HA3 H -8.032 -3.641 1.649 1.00 . A A . 1 GLY HA3 1 1
3 436 1 1 1 GLY N N -7.885 -1.697 1.026 1.00 . A A . 1 GLY N 1 1
3 437 1 1 1 GLY O O -5.645 -4.504 1.000 1.00 . A A . 1 GLY O 1 1
3 438 1 1 2 LYS C C -3.294 -2.513 -0.413 1.00 . A A . 2 LYS C 1 1
3 439 1 1 2 LYS CA C -4.560 -3.071 -1.037 1.00 . A A . 2 LYS CA 1 1
3 440 1 1 2 LYS CB C -4.685 -2.599 -2.489 1.00 . A A . 2 LYS CB 1 1
3 441 1 1 2 LYS CD C -3.691 -4.664 -3.578 1.00 . A A . 2 LYS CD 1 1
3 442 1 1 2 LYS CE C -2.670 -5.214 -4.578 1.00 . A A . 2 LYS CE 1 1
3 443 1 1 2 LYS CG C -3.604 -3.144 -3.434 1.00 . A A . 2 LYS CG 1 1
3 444 1 1 2 LYS H H -6.143 -1.804 -0.451 1.00 . A A . 2 LYS H 1 1
3 445 1 1 2 LYS HA H -4.521 -4.150 -1.008 1.00 . A A . 2 LYS HA 1 1
3 446 1 1 2 LYS HB2 H -5.649 -2.901 -2.865 1.00 . A A . 2 LYS HB2 1 1
3 447 1 1 2 LYS HB3 H -4.631 -1.520 -2.504 1.00 . A A . 2 LYS HB3 1 1
3 448 1 1 2 LYS HD2 H -3.510 -5.119 -2.616 1.00 . A A . 2 LYS HD2 1 1
3 449 1 1 2 LYS HD3 H -4.685 -4.924 -3.913 1.00 . A A . 2 LYS HD3 1 1
3 450 1 1 2 LYS HE2 H -2.822 -6.277 -4.678 1.00 . A A . 2 LYS HE2 1 1
3 451 1 1 2 LYS HE3 H -2.838 -4.741 -5.534 1.00 . A A . 2 LYS HE3 1 1
3 452 1 1 2 LYS HG2 H -3.724 -2.697 -4.409 1.00 . A A . 2 LYS HG2 1 1
3 453 1 1 2 LYS HG3 H -2.632 -2.886 -3.036 1.00 . A A . 2 LYS HG3 1 1
3 454 1 1 2 LYS HZ1 H -1.061 -5.420 -3.243 1.00 . A A . 2 LYS HZ1 1 1
3 455 1 1 2 LYS HZ2 H -1.046 -3.960 -4.128 1.00 . A A . 2 LYS HZ2 1 1
3 456 1 1 2 LYS HZ3 H -0.620 -5.394 -4.863 1.00 . A A . 2 LYS HZ3 1 1
3 457 1 1 2 LYS N N -5.695 -2.652 -0.243 1.00 . A A . 2 LYS N 1 1
3 458 1 1 2 LYS NZ N -1.266 -4.975 -4.161 1.00 . A A . 2 LYS NZ 1 1
3 459 1 1 2 LYS O O -3.164 -1.305 -0.232 1.00 . A A . 2 LYS O 1 1
3 460 1 1 3 ALA C C 0.044 -3.564 -0.141 1.00 . A A . 3 ALA C 1 1
3 461 1 1 3 ALA CA C -1.154 -3.004 0.557 1.00 . A A . 3 ALA CA 1 1
3 462 1 1 3 ALA CB C -1.157 -3.389 2.045 1.00 . A A . 3 ALA CB 1 1
3 463 1 1 3 ALA H H -2.565 -4.336 -0.230 1.00 . A A . 3 ALA H 1 1
3 464 1 1 3 ALA HA H -1.090 -1.928 0.504 1.00 . A A . 3 ALA HA 1 1
3 465 1 1 3 ALA HB1 H -0.151 -3.641 2.341 1.00 . A A . 3 ALA HB1 1 1
3 466 1 1 3 ALA HB2 H -1.790 -4.254 2.180 1.00 . A A . 3 ALA HB2 1 1
3 467 1 1 3 ALA N N -2.397 -3.381 -0.067 1.00 . A A . 3 ALA N 1 1
3 468 1 1 3 ALA O O 0.069 -4.734 -0.524 1.00 . A A . 3 ALA O 1 1
3 469 1 1 4 LEU C C 3.343 -2.527 0.047 1.00 . A A . 4 LEU C 1 1
3 470 1 1 4 LEU CA C 2.292 -3.105 -0.859 1.00 . A A . 4 LEU CA 1 1
3 471 1 1 4 LEU CB C 2.549 -2.722 -2.349 1.00 . A A . 4 LEU CB 1 1
3 472 1 1 4 LEU CD1 C 3.169 -1.053 -4.102 1.00 . A A . 4 LEU CD1 1 1
3 473 1 1 4 LEU CD2 C 1.034 -0.790 -2.893 1.00 . A A . 4 LEU CD2 1 1
3 474 1 1 4 LEU CG C 2.478 -1.240 -2.762 1.00 . A A . 4 LEU CG 1 1
3 475 1 1 4 LEU H H 0.871 -1.757 -0.156 1.00 . A A . 4 LEU H 1 1
3 476 1 1 4 LEU HA H 2.334 -4.179 -0.749 1.00 . A A . 4 LEU HA 1 1
3 477 1 1 4 LEU HB2 H 3.532 -3.080 -2.614 1.00 . A A . 4 LEU HB2 1 1
3 478 1 1 4 LEU HB3 H 1.831 -3.265 -2.946 1.00 . A A . 4 LEU HB3 1 1
3 479 1 1 4 LEU HD11 H 3.125 -0.013 -4.388 1.00 . A A . 4 LEU HD11 1 1
3 480 1 1 4 LEU HD12 H 2.673 -1.653 -4.851 1.00 . A A . 4 LEU HD12 1 1
3 481 1 1 4 LEU HD13 H 4.201 -1.359 -4.022 1.00 . A A . 4 LEU HD13 1 1
3 482 1 1 4 LEU HD21 H 0.537 -0.891 -1.939 1.00 . A A . 4 LEU HD21 1 1
3 483 1 1 4 LEU HD22 H 0.533 -1.405 -3.625 1.00 . A A . 4 LEU HD22 1 1
3 484 1 1 4 LEU HD23 H 1.004 0.242 -3.208 1.00 . A A . 4 LEU HD23 1 1
3 485 1 1 4 LEU HG H 2.971 -0.625 -2.023 1.00 . A A . 4 LEU HG 1 1
3 486 1 1 4 LEU N N 1.010 -2.712 -0.354 1.00 . A A . 4 LEU N 1 1
3 487 1 1 4 LEU O O 3.390 -1.306 0.273 1.00 . A A . 4 LEU O 1 1
3 488 1 1 5 PHE C C 6.428 -2.551 0.849 1.00 . A A . 5 PHE C 1 1
3 489 1 1 5 PHE CA C 5.147 -2.979 1.539 1.00 . A A . 5 PHE CA 1 1
3 490 1 1 5 PHE CB C 5.378 -4.060 2.602 1.00 . A A . 5 PHE CB 1 1
3 491 1 1 5 PHE CD1 C 3.236 -5.331 3.016 1.00 . A A . 5 PHE CD1 1 1
3 492 1 1 5 PHE CD2 C 3.892 -3.669 4.592 1.00 . A A . 5 PHE CD2 1 1
3 493 1 1 5 PHE CE1 C 2.106 -5.597 3.759 1.00 . A A . 5 PHE CE1 1 1
3 494 1 1 5 PHE CE2 C 2.762 -3.934 5.340 1.00 . A A . 5 PHE CE2 1 1
3 495 1 1 5 PHE CG C 4.145 -4.362 3.423 1.00 . A A . 5 PHE CG 1 1
3 496 1 1 5 PHE CZ C 1.868 -4.900 4.925 1.00 . A A . 5 PHE CZ 1 1
3 497 1 1 5 PHE H H 4.087 -4.324 0.341 1.00 . A A . 5 PHE H 1 1
3 498 1 1 5 PHE HA H 4.746 -2.104 2.029 1.00 . A A . 5 PHE HA 1 1
3 499 1 1 5 PHE HB2 H 5.683 -4.974 2.115 1.00 . A A . 5 PHE HB2 1 1
3 500 1 1 5 PHE HB3 H 6.158 -3.738 3.274 1.00 . A A . 5 PHE HB3 1 1
3 501 1 1 5 PHE HD1 H 3.420 -5.883 2.107 1.00 . A A . 5 PHE HD1 1 1
3 502 1 1 5 PHE HD2 H 4.589 -2.913 4.922 1.00 . A A . 5 PHE HD2 1 1
3 503 1 1 5 PHE HE1 H 1.411 -6.355 3.427 1.00 . A A . 5 PHE HE1 1 1
3 504 1 1 5 PHE HE2 H 2.582 -3.384 6.252 1.00 . A A . 5 PHE HE2 1 1
3 505 1 1 5 PHE HZ H 0.983 -5.107 5.509 1.00 . A A . 5 PHE HZ 1 1
3 506 1 1 5 PHE N N 4.150 -3.378 0.592 1.00 . A A . 5 PHE N 1 1
3 507 1 1 5 PHE O O 7.457 -3.221 0.905 1.00 . A A . 5 PHE O 1 1
3 508 1 1 6 SER C C 8.036 0.154 0.455 1.00 . A A . 6 SER C 1 1
3 509 1 1 6 SER CA C 7.391 -0.835 -0.521 1.00 . A A . 6 SER CA 1 1
3 510 1 1 6 SER CB C 6.782 -0.117 -1.721 1.00 . A A . 6 SER CB 1 1
3 511 1 1 6 SER H H 5.426 -1.065 0.033 1.00 . A A . 6 SER H 1 1
3 512 1 1 6 SER HA H 8.105 -1.568 -0.865 1.00 . A A . 6 SER HA 1 1
3 513 1 1 6 SER HB2 H 7.483 0.613 -2.099 1.00 . A A . 6 SER HB2 1 1
3 514 1 1 6 SER HB3 H 6.547 -0.833 -2.495 1.00 . A A . 6 SER HB3 1 1
3 515 1 1 6 SER HG H 5.792 1.413 -0.943 1.00 . A A . 6 SER HG 1 1
3 516 1 1 6 SER N N 6.311 -1.476 0.144 1.00 . A A . 6 SER N 1 1
3 517 1 1 6 SER O O 7.835 0.046 1.675 1.00 . A A . 6 SER O 1 1
3 518 1 1 6 SER OG O 5.576 0.553 -1.331 1.00 . A A . 6 SER OG 1 1
3 519 1 1 7 ASN C C 9.150 3.476 0.125 1.00 . A A . 7 ASN C 1 1
3 520 1 1 7 ASN CA C 9.348 2.122 0.800 1.00 . A A . 7 ASN CA 1 1
3 521 1 1 7 ASN CB C 10.823 1.886 1.093 1.00 . A A . 7 ASN CB 1 1
3 522 1 1 7 ASN CG C 11.409 2.954 1.995 1.00 . A A . 7 ASN CG 1 1
3 523 1 1 7 ASN H H 9.051 1.081 -0.991 1.00 . A A . 7 ASN H 1 1
3 524 1 1 7 ASN HA H 8.790 2.103 1.725 1.00 . A A . 7 ASN HA 1 1
3 525 1 1 7 ASN HB2 H 10.931 0.929 1.582 1.00 . A A . 7 ASN HB2 1 1
3 526 1 1 7 ASN HB3 H 11.375 1.876 0.164 1.00 . A A . 7 ASN HB3 1 1
3 527 1 1 7 ASN HD21 H 13.147 2.781 1.097 1.00 . A A . 7 ASN HD21 1 1
3 528 1 1 7 ASN HD22 H 13.066 3.955 2.358 1.00 . A A . 7 ASN HD22 1 1
3 529 1 1 7 ASN N N 8.804 1.081 -0.041 1.00 . A A . 7 ASN N 1 1
3 530 1 1 7 ASN ND2 N 12.658 3.257 1.801 1.00 . A A . 7 ASN ND2 1 1
3 531 1 1 7 ASN O O 9.811 3.773 -0.878 1.00 . A A . 7 ASN O 1 1
3 532 1 1 7 ASN OD1 O 10.725 3.508 2.855 1.00 . A A . 7 ASN OD1 1 1
3 533 1 1 8 PRO C C 6.262 2.937 1.372 1.00 . A A . 8 PRO C 1 1
3 534 1 1 8 PRO CA C 7.320 3.988 1.745 1.00 . A A . 8 PRO CA 1 1
3 535 1 1 8 PRO CB C 6.626 5.330 2.013 1.00 . A A . 8 PRO CB 1 1
3 536 1 1 8 PRO CD C 7.929 5.652 0.070 1.00 . A A . 8 PRO CD 1 1
3 537 1 1 8 PRO CG C 6.618 6.002 0.694 1.00 . A A . 8 PRO CG 1 1
3 538 1 1 8 PRO HA H 7.870 3.675 2.619 1.00 . A A . 8 PRO HA 1 1
3 539 1 1 8 PRO HB2 H 5.625 5.150 2.374 1.00 . A A . 8 PRO HB2 1 1
3 540 1 1 8 PRO HB3 H 7.183 5.897 2.744 1.00 . A A . 8 PRO HB3 1 1
3 541 1 1 8 PRO HD2 H 7.851 5.635 -1.006 1.00 . A A . 8 PRO HD2 1 1
3 542 1 1 8 PRO HD3 H 8.693 6.350 0.382 1.00 . A A . 8 PRO HD3 1 1
3 543 1 1 8 PRO HG2 H 5.801 5.626 0.095 1.00 . A A . 8 PRO HG2 1 1
3 544 1 1 8 PRO HG3 H 6.534 7.071 0.819 1.00 . A A . 8 PRO HG3 1 1
3 545 1 1 8 PRO N N 8.206 4.307 0.604 1.00 . A A . 8 PRO N 1 1
3 546 1 1 8 PRO O O 5.924 2.783 0.184 1.00 . A A . 8 PRO O 1 1
3 547 1 1 9 PRO C C 3.428 1.913 1.764 1.00 . A A . 9 PRO C 1 1
3 548 1 1 9 PRO CA C 4.718 1.190 2.107 1.00 . A A . 9 PRO CA 1 1
3 549 1 1 9 PRO CB C 4.593 0.430 3.432 1.00 . A A . 9 PRO CB 1 1
3 550 1 1 9 PRO CD C 6.202 2.175 3.759 1.00 . A A . 9 PRO CD 1 1
3 551 1 1 9 PRO CG C 5.165 1.342 4.459 1.00 . A A . 9 PRO CG 1 1
3 552 1 1 9 PRO HA H 4.981 0.520 1.300 1.00 . A A . 9 PRO HA 1 1
3 553 1 1 9 PRO HB2 H 3.551 0.216 3.627 1.00 . A A . 9 PRO HB2 1 1
3 554 1 1 9 PRO HB3 H 5.149 -0.493 3.375 1.00 . A A . 9 PRO HB3 1 1
3 555 1 1 9 PRO HD2 H 6.200 3.181 4.150 1.00 . A A . 9 PRO HD2 1 1
3 556 1 1 9 PRO HD3 H 7.180 1.729 3.863 1.00 . A A . 9 PRO HD3 1 1
3 557 1 1 9 PRO HG2 H 4.386 1.973 4.861 1.00 . A A . 9 PRO HG2 1 1
3 558 1 1 9 PRO HG3 H 5.620 0.761 5.248 1.00 . A A . 9 PRO HG3 1 1
3 559 1 1 9 PRO N N 5.768 2.164 2.352 1.00 . A A . 9 PRO N 1 1
3 560 1 1 9 PRO O O 2.992 2.816 2.493 1.00 . A A . 9 PRO O 1 1
3 561 1 1 10 ILE C C 0.469 1.396 0.492 1.00 . A A . 10 ILE C 1 1
3 562 1 1 10 ILE CA C 1.675 2.254 0.207 1.00 . A A . 10 ILE CA 1 1
3 563 1 1 10 ILE CB C 1.752 2.566 -1.316 1.00 . A A . 10 ILE CB 1 1
3 564 1 1 10 ILE CD1 C 3.261 3.611 -3.116 1.00 . A A . 10 ILE CD1 1 1
3 565 1 1 10 ILE CG1 C 3.044 3.342 -1.638 1.00 . A A . 10 ILE CG1 1 1
3 566 1 1 10 ILE CG2 C 0.525 3.371 -1.760 1.00 . A A . 10 ILE CG2 1 1
3 567 1 1 10 ILE H H 3.194 0.814 0.139 1.00 . A A . 10 ILE H 1 1
3 568 1 1 10 ILE HA H 1.586 3.183 0.749 1.00 . A A . 10 ILE HA 1 1
3 569 1 1 10 ILE HB H 1.762 1.630 -1.853 1.00 . A A . 10 ILE HB 1 1
3 570 1 1 10 ILE HD11 H 4.182 4.155 -3.252 1.00 . A A . 10 ILE HD11 1 1
3 571 1 1 10 ILE HD12 H 2.438 4.194 -3.499 1.00 . A A . 10 ILE HD12 1 1
3 572 1 1 10 ILE HD13 H 3.316 2.673 -3.649 1.00 . A A . 10 ILE HD13 1 1
3 573 1 1 10 ILE HG12 H 3.018 4.297 -1.134 1.00 . A A . 10 ILE HG12 1 1
3 574 1 1 10 ILE HG13 H 3.890 2.777 -1.274 1.00 . A A . 10 ILE HG13 1 1
3 575 1 1 10 ILE HG21 H 0.486 4.300 -1.209 1.00 . A A . 10 ILE HG21 1 1
3 576 1 1 10 ILE HG22 H -0.372 2.800 -1.565 1.00 . A A . 10 ILE HG22 1 1
3 577 1 1 10 ILE HG23 H 0.594 3.580 -2.817 1.00 . A A . 10 ILE HG23 1 1
3 578 1 1 10 ILE N N 2.851 1.573 0.661 1.00 . A A . 10 ILE N 1 1
3 579 1 1 10 ILE O O 0.391 0.242 0.032 1.00 . A A . 10 ILE O 1 1
3 580 1 1 11 ALA C C -2.813 1.972 1.124 1.00 . A A . 11 ALA C 1 1
3 581 1 1 11 ALA CA C -1.633 1.180 1.555 1.00 . A A . 11 ALA CA 1 1
3 582 1 1 11 ALA CB C -1.773 0.703 3.007 1.00 . A A . 11 ALA CB 1 1
3 583 1 1 11 ALA H H -0.283 2.761 1.744 1.00 . A A . 11 ALA H 1 1
3 584 1 1 11 ALA HA H -1.594 0.310 0.917 1.00 . A A . 11 ALA HA 1 1
3 585 1 1 11 ALA HB1 H -2.672 0.111 3.084 1.00 . A A . 11 ALA HB1 1 1
3 586 1 1 11 ALA HB2 H -1.862 1.508 3.712 1.00 . A A . 11 ALA HB2 1 1
3 587 1 1 11 ALA N N -0.429 1.898 1.298 1.00 . A A . 11 ALA N 1 1
3 588 1 1 11 ALA O O -2.906 3.184 1.379 1.00 . A A . 11 ALA O 1 1
3 589 1 1 12 PHE C C -6.038 1.604 0.831 1.00 . A A . 12 PHE C 1 1
3 590 1 1 12 PHE CA C -4.869 1.912 -0.076 1.00 . A A . 12 PHE CA 1 1
3 591 1 1 12 PHE CB C -5.140 1.390 -1.491 1.00 . A A . 12 PHE CB 1 1
3 592 1 1 12 PHE CD1 C -4.176 2.833 -3.295 1.00 . A A . 12 PHE CD1 1 1
3 593 1 1 12 PHE CD2 C -2.961 0.896 -2.641 1.00 . A A . 12 PHE CD2 1 1
3 594 1 1 12 PHE CE1 C -3.202 3.135 -4.221 1.00 . A A . 12 PHE CE1 1 1
3 595 1 1 12 PHE CE2 C -1.986 1.194 -3.564 1.00 . A A . 12 PHE CE2 1 1
3 596 1 1 12 PHE CG C -4.069 1.713 -2.495 1.00 . A A . 12 PHE CG 1 1
3 597 1 1 12 PHE CZ C -2.106 2.315 -4.356 1.00 . A A . 12 PHE CZ 1 1
3 598 1 1 12 PHE H H -3.557 0.338 0.356 1.00 . A A . 12 PHE H 1 1
3 599 1 1 12 PHE HA H -4.701 2.977 -0.117 1.00 . A A . 12 PHE HA 1 1
3 600 1 1 12 PHE HB2 H -5.239 0.315 -1.451 1.00 . A A . 12 PHE HB2 1 1
3 601 1 1 12 PHE HB3 H -6.070 1.811 -1.843 1.00 . A A . 12 PHE HB3 1 1
3 602 1 1 12 PHE HD1 H -5.037 3.478 -3.191 1.00 . A A . 12 PHE HD1 1 1
3 603 1 1 12 PHE HD2 H -2.867 0.017 -2.021 1.00 . A A . 12 PHE HD2 1 1
3 604 1 1 12 PHE HE1 H -3.300 4.013 -4.842 1.00 . A A . 12 PHE HE1 1 1
3 605 1 1 12 PHE HE2 H -1.126 0.549 -3.671 1.00 . A A . 12 PHE HE2 1 1
3 606 1 1 12 PHE HZ H -1.339 2.549 -5.080 1.00 . A A . 12 PHE HZ 1 1
3 607 1 1 12 PHE N N -3.694 1.309 0.465 1.00 . A A . 12 PHE N 1 1
3 608 1 1 12 PHE O O -6.124 0.492 1.360 1.00 . A A . 12 PHE O 1 1
3 609 1 1 13 PRO C C -8.994 1.197 1.616 1.00 . A A . 13 PRO C 1 1
3 610 1 1 13 PRO CA C -8.130 2.432 1.925 1.00 . A A . 13 PRO CA 1 1
3 611 1 1 13 PRO CB C -8.932 3.706 1.654 1.00 . A A . 13 PRO CB 1 1
3 612 1 1 13 PRO CD C -6.904 3.932 0.432 1.00 . A A . 13 PRO CD 1 1
3 613 1 1 13 PRO CG C -7.921 4.700 1.219 1.00 . A A . 13 PRO CG 1 1
3 614 1 1 13 PRO HA H -7.833 2.410 2.962 1.00 . A A . 13 PRO HA 1 1
3 615 1 1 13 PRO HB2 H -9.662 3.517 0.881 1.00 . A A . 13 PRO HB2 1 1
3 616 1 1 13 PRO HB3 H -9.430 4.023 2.558 1.00 . A A . 13 PRO HB3 1 1
3 617 1 1 13 PRO HD2 H -7.176 3.901 -0.611 1.00 . A A . 13 PRO HD2 1 1
3 618 1 1 13 PRO HD3 H -5.930 4.378 0.563 1.00 . A A . 13 PRO HD3 1 1
3 619 1 1 13 PRO HG2 H -8.385 5.454 0.601 1.00 . A A . 13 PRO HG2 1 1
3 620 1 1 13 PRO HG3 H -7.459 5.157 2.082 1.00 . A A . 13 PRO HG3 1 1
3 621 1 1 13 PRO N N -6.954 2.578 1.034 1.00 . A A . 13 PRO N 1 1
3 622 1 1 13 PRO O O -9.712 0.691 2.486 1.00 . A A . 13 PRO O 1 1
3 623 1 1 14 ASN C C -9.072 -1.766 0.467 1.00 . A A . 14 ASN C 1 1
3 624 1 1 14 ASN CA C -9.672 -0.459 -0.044 1.00 . A A . 14 ASN CA 1 1
3 625 1 1 14 ASN CB C -9.790 -0.508 -1.581 1.00 . A A . 14 ASN CB 1 1
3 626 1 1 14 ASN CG C -8.491 -0.884 -2.297 1.00 . A A . 14 ASN CG 1 1
3 627 1 1 14 ASN H H -8.242 1.097 -0.221 1.00 . A A . 14 ASN H 1 1
3 628 1 1 14 ASN HA H -10.662 -0.353 0.376 1.00 . A A . 14 ASN HA 1 1
3 629 1 1 14 ASN HB2 H -10.541 -1.237 -1.846 1.00 . A A . 14 ASN HB2 1 1
3 630 1 1 14 ASN HB3 H -10.108 0.460 -1.933 1.00 . A A . 14 ASN HB3 1 1
3 631 1 1 14 ASN HD21 H -9.507 -1.644 -3.813 1.00 . A A . 14 ASN HD21 1 1
3 632 1 1 14 ASN HD22 H -7.787 -1.701 -3.947 1.00 . A A . 14 ASN HD22 1 1
3 633 1 1 14 ASN N N -8.885 0.691 0.397 1.00 . A A . 14 ASN N 1 1
3 634 1 1 14 ASN ND2 N -8.607 -1.471 -3.460 1.00 . A A . 14 ASN ND2 1 1
3 635 1 1 14 ASN O O -9.673 -2.828 0.321 1.00 . A A . 14 ASN O 1 1
3 636 1 1 14 ASN OD1 O -7.399 -0.635 -1.805 1.00 . A A . 14 ASN OD1 1 1
3 637 2 2 1 . C C -1.658 -2.284 2.949 1.00 . B A . 101 WMH C 1 1
3 638 2 2 1 . C1 C -0.638 -0.159 3.457 1.00 . B A . 101 WMH C1 1 1
3 639 2 2 1 . C2 C 0.578 0.255 3.905 1.00 . B A . 101 WMH C2 1 1
3 640 2 2 1 . H1 H -2.290 -2.553 3.777 1.00 . B A . 101 WMH H1 1 1
3 641 2 2 1 . H2 H -2.262 -1.658 2.311 1.00 . B A . 101 WMH H2 1 1
3 642 2 2 1 . H5 H 0.884 1.278 4.062 1.00 . B A . 101 WMH H5 1 1
3 643 2 2 1 . N N -0.621 -1.465 3.395 1.00 . B A . 101 WMH N 1 1
3 644 2 2 1 . N1 N 1.325 -0.824 4.116 1.00 . B A . 101 WMH N1 1 1
3 645 2 2 1 . N2 N 0.647 -1.877 3.826 1.00 . B A . 101 WMH N2 1 1
4 646 1 1 1 GLY C C -6.510 -3.628 0.601 1.00 . A A . 1 GLY C 1 1
4 647 1 1 1 GLY CA C -7.711 -3.159 1.372 1.00 . A A . 1 GLY CA 1 1
4 648 1 1 1 GLY H1 H -7.854 -1.058 1.216 1.00 . A A . 1 GLY H1 1 1
4 649 1 1 1 GLY HA2 H -7.445 -3.046 2.411 1.00 . A A . 1 GLY HA2 1 1
4 650 1 1 1 GLY HA3 H -8.490 -3.904 1.295 1.00 . A A . 1 GLY HA3 1 1
4 651 1 1 1 GLY N N -8.228 -1.901 0.886 1.00 . A A . 1 GLY N 1 1
4 652 1 1 1 GLY O O -6.350 -4.819 0.346 1.00 . A A . 1 GLY O 1 1
4 653 1 1 2 LYS C C -3.251 -2.394 -0.008 1.00 . A A . 2 LYS C 1 1
4 654 1 1 2 LYS CA C -4.494 -3.077 -0.544 1.00 . A A . 2 LYS CA 1 1
4 655 1 1 2 LYS CB C -4.704 -2.729 -2.023 1.00 . A A . 2 LYS CB 1 1
4 656 1 1 2 LYS CD C -3.777 -2.674 -4.345 1.00 . A A . 2 LYS CD 1 1
4 657 1 1 2 LYS CE C -2.620 -3.085 -5.229 1.00 . A A . 2 LYS CE 1 1
4 658 1 1 2 LYS CG C -3.549 -3.127 -2.920 1.00 . A A . 2 LYS CG 1 1
4 659 1 1 2 LYS H H -5.788 -1.776 0.484 1.00 . A A . 2 LYS H 1 1
4 660 1 1 2 LYS HA H -4.366 -4.145 -0.460 1.00 . A A . 2 LYS HA 1 1
4 661 1 1 2 LYS HB2 H -5.592 -3.234 -2.374 1.00 . A A . 2 LYS HB2 1 1
4 662 1 1 2 LYS HB3 H -4.852 -1.663 -2.117 1.00 . A A . 2 LYS HB3 1 1
4 663 1 1 2 LYS HD2 H -4.689 -3.117 -4.719 1.00 . A A . 2 LYS HD2 1 1
4 664 1 1 2 LYS HD3 H -3.866 -1.598 -4.361 1.00 . A A . 2 LYS HD3 1 1
4 665 1 1 2 LYS HE2 H -1.712 -2.649 -4.841 1.00 . A A . 2 LYS HE2 1 1
4 666 1 1 2 LYS HE3 H -2.535 -4.161 -5.208 1.00 . A A . 2 LYS HE3 1 1
4 667 1 1 2 LYS HG2 H -2.644 -2.672 -2.547 1.00 . A A . 2 LYS HG2 1 1
4 668 1 1 2 LYS HG3 H -3.448 -4.202 -2.902 1.00 . A A . 2 LYS HG3 1 1
4 669 1 1 2 LYS HZ1 H -2.902 -1.613 -6.679 1.00 . A A . 2 LYS HZ1 1 1
4 670 1 1 2 LYS HZ2 H -3.638 -3.080 -7.045 1.00 . A A . 2 LYS HZ2 1 1
4 671 1 1 2 LYS HZ3 H -1.978 -2.915 -7.196 1.00 . A A . 2 LYS HZ3 1 1
4 672 1 1 2 LYS N N -5.653 -2.712 0.227 1.00 . A A . 2 LYS N 1 1
4 673 1 1 2 LYS NZ N -2.799 -2.644 -6.617 1.00 . A A . 2 LYS NZ 1 1
4 674 1 1 2 LYS O O -3.121 -1.181 -0.085 1.00 . A A . 2 LYS O 1 1
4 675 1 1 3 ALA C C 0.023 -3.258 0.276 1.00 . A A . 3 ALA C 1 1
4 676 1 1 3 ALA CA C -1.117 -2.673 1.048 1.00 . A A . 3 ALA CA 1 1
4 677 1 1 3 ALA CB C -0.982 -2.912 2.555 1.00 . A A . 3 ALA CB 1 1
4 678 1 1 3 ALA H H -2.570 -4.118 0.671 1.00 . A A . 3 ALA H 1 1
4 679 1 1 3 ALA HA H -1.106 -1.609 0.871 1.00 . A A . 3 ALA HA 1 1
4 680 1 1 3 ALA HB1 H 0.059 -3.075 2.794 1.00 . A A . 3 ALA HB1 1 1
4 681 1 1 3 ALA HB2 H -1.552 -3.787 2.827 1.00 . A A . 3 ALA HB2 1 1
4 682 1 1 3 ALA N N -2.381 -3.161 0.561 1.00 . A A . 3 ALA N 1 1
4 683 1 1 3 ALA O O 0.061 -4.463 0.012 1.00 . A A . 3 ALA O 1 1
4 684 1 1 4 LEU C C 3.290 -2.769 0.002 1.00 . A A . 4 LEU C 1 1
4 685 1 1 4 LEU CA C 2.078 -2.810 -0.876 1.00 . A A . 4 LEU CA 1 1
4 686 1 1 4 LEU CB C 2.314 -1.922 -2.125 1.00 . A A . 4 LEU CB 1 1
4 687 1 1 4 LEU CD1 C 0.989 -3.391 -3.714 1.00 . A A . 4 LEU CD1 1 1
4 688 1 1 4 LEU CD2 C -0.014 -1.244 -2.883 1.00 . A A . 4 LEU CD2 1 1
4 689 1 1 4 LEU CG C 1.268 -1.965 -3.262 1.00 . A A . 4 LEU CG 1 1
4 690 1 1 4 LEU H H 0.834 -1.448 0.100 1.00 . A A . 4 LEU H 1 1
4 691 1 1 4 LEU HA H 1.917 -3.828 -1.197 1.00 . A A . 4 LEU HA 1 1
4 692 1 1 4 LEU HB2 H 2.381 -0.899 -1.787 1.00 . A A . 4 LEU HB2 1 1
4 693 1 1 4 LEU HB3 H 3.274 -2.191 -2.542 1.00 . A A . 4 LEU HB3 1 1
4 694 1 1 4 LEU HD11 H 0.287 -3.380 -4.536 1.00 . A A . 4 LEU HD11 1 1
4 695 1 1 4 LEU HD12 H 0.563 -3.950 -2.894 1.00 . A A . 4 LEU HD12 1 1
4 696 1 1 4 LEU HD13 H 1.908 -3.860 -4.030 1.00 . A A . 4 LEU HD13 1 1
4 697 1 1 4 LEU HD21 H -0.463 -1.735 -2.032 1.00 . A A . 4 LEU HD21 1 1
4 698 1 1 4 LEU HD22 H -0.701 -1.251 -3.717 1.00 . A A . 4 LEU HD22 1 1
4 699 1 1 4 LEU HD23 H 0.220 -0.223 -2.621 1.00 . A A . 4 LEU HD23 1 1
4 700 1 1 4 LEU HG H 1.699 -1.461 -4.116 1.00 . A A . 4 LEU HG 1 1
4 701 1 1 4 LEU N N 0.929 -2.403 -0.121 1.00 . A A . 4 LEU N 1 1
4 702 1 1 4 LEU O O 3.476 -1.819 0.791 1.00 . A A . 4 LEU O 1 1
4 703 1 1 5 PHE C C 6.386 -3.148 -0.114 1.00 . A A . 5 PHE C 1 1
4 704 1 1 5 PHE CA C 5.301 -3.849 0.651 1.00 . A A . 5 PHE CA 1 1
4 705 1 1 5 PHE CB C 5.659 -5.290 1.006 1.00 . A A . 5 PHE CB 1 1
4 706 1 1 5 PHE CD1 C 4.317 -5.587 3.103 1.00 . A A . 5 PHE CD1 1 1
4 707 1 1 5 PHE CD2 C 3.797 -6.956 1.237 1.00 . A A . 5 PHE CD2 1 1
4 708 1 1 5 PHE CE1 C 3.311 -6.187 3.825 1.00 . A A . 5 PHE CE1 1 1
4 709 1 1 5 PHE CE2 C 2.792 -7.560 1.958 1.00 . A A . 5 PHE CE2 1 1
4 710 1 1 5 PHE CG C 4.573 -5.964 1.800 1.00 . A A . 5 PHE CG 1 1
4 711 1 1 5 PHE CZ C 2.548 -7.174 3.252 1.00 . A A . 5 PHE CZ 1 1
4 712 1 1 5 PHE H H 3.864 -4.511 -0.713 1.00 . A A . 5 PHE H 1 1
4 713 1 1 5 PHE HA H 5.128 -3.292 1.558 1.00 . A A . 5 PHE HA 1 1
4 714 1 1 5 PHE HB2 H 5.819 -5.853 0.097 1.00 . A A . 5 PHE HB2 1 1
4 715 1 1 5 PHE HB3 H 6.563 -5.297 1.598 1.00 . A A . 5 PHE HB3 1 1
4 716 1 1 5 PHE HD1 H 4.913 -4.810 3.562 1.00 . A A . 5 PHE HD1 1 1
4 717 1 1 5 PHE HD2 H 3.986 -7.265 0.220 1.00 . A A . 5 PHE HD2 1 1
4 718 1 1 5 PHE HE1 H 3.123 -5.882 4.843 1.00 . A A . 5 PHE HE1 1 1
4 719 1 1 5 PHE HE2 H 2.191 -8.333 1.505 1.00 . A A . 5 PHE HE2 1 1
4 720 1 1 5 PHE HZ H 1.757 -7.646 3.816 1.00 . A A . 5 PHE HZ 1 1
4 721 1 1 5 PHE N N 4.093 -3.781 -0.098 1.00 . A A . 5 PHE N 1 1
4 722 1 1 5 PHE O O 7.017 -3.709 -1.016 1.00 . A A . 5 PHE O 1 1
4 723 1 1 6 SER C C 7.892 0.020 0.548 1.00 . A A . 6 SER C 1 1
4 724 1 1 6 SER CA C 7.420 -1.010 -0.472 1.00 . A A . 6 SER CA 1 1
4 725 1 1 6 SER CB C 6.665 -0.315 -1.614 1.00 . A A . 6 SER CB 1 1
4 726 1 1 6 SER H H 6.000 -1.511 0.921 1.00 . A A . 6 SER H 1 1
4 727 1 1 6 SER HA H 8.248 -1.570 -0.877 1.00 . A A . 6 SER HA 1 1
4 728 1 1 6 SER HB2 H 5.876 0.294 -1.200 1.00 . A A . 6 SER HB2 1 1
4 729 1 1 6 SER HB3 H 7.346 0.310 -2.168 1.00 . A A . 6 SER HB3 1 1
4 730 1 1 6 SER HG H 6.422 -2.138 -2.252 1.00 . A A . 6 SER HG 1 1
4 731 1 1 6 SER N N 6.521 -1.893 0.184 1.00 . A A . 6 SER N 1 1
4 732 1 1 6 SER O O 7.398 0.028 1.681 1.00 . A A . 6 SER O 1 1
4 733 1 1 6 SER OG O 6.085 -1.267 -2.506 1.00 . A A . 6 SER OG 1 1
4 734 1 1 7 ASN C C 9.387 3.228 0.281 1.00 . A A . 7 ASN C 1 1
4 735 1 1 7 ASN CA C 9.302 1.912 1.053 1.00 . A A . 7 ASN CA 1 1
4 736 1 1 7 ASN CB C 10.675 1.547 1.643 1.00 . A A . 7 ASN CB 1 1
4 737 1 1 7 ASN CG C 11.185 2.592 2.631 1.00 . A A . 7 ASN CG 1 1
4 738 1 1 7 ASN H H 9.195 0.826 -0.737 1.00 . A A . 7 ASN H 1 1
4 739 1 1 7 ASN HA H 8.583 2.016 1.851 1.00 . A A . 7 ASN HA 1 1
4 740 1 1 7 ASN HB2 H 10.601 0.602 2.158 1.00 . A A . 7 ASN HB2 1 1
4 741 1 1 7 ASN HB3 H 11.392 1.458 0.840 1.00 . A A . 7 ASN HB3 1 1
4 742 1 1 7 ASN HD21 H 10.319 1.640 4.143 1.00 . A A . 7 ASN HD21 1 1
4 743 1 1 7 ASN HD22 H 11.177 3.076 4.547 1.00 . A A . 7 ASN HD22 1 1
4 744 1 1 7 ASN N N 8.817 0.869 0.167 1.00 . A A . 7 ASN N 1 1
4 745 1 1 7 ASN ND2 N 10.862 2.420 3.889 1.00 . A A . 7 ASN ND2 1 1
4 746 1 1 7 ASN O O 10.144 3.323 -0.691 1.00 . A A . 7 ASN O 1 1
4 747 1 1 7 ASN OD1 O 11.872 3.550 2.255 1.00 . A A . 7 ASN OD1 1 1
4 748 1 1 8 PRO C C 6.435 3.281 1.479 1.00 . A A . 8 PRO C 1 1
4 749 1 1 8 PRO CA C 7.635 4.204 1.778 1.00 . A A . 8 PRO CA 1 1
4 750 1 1 8 PRO CB C 7.166 5.664 1.906 1.00 . A A . 8 PRO CB 1 1
4 751 1 1 8 PRO CD C 8.574 5.574 -0.011 1.00 . A A . 8 PRO CD 1 1
4 752 1 1 8 PRO CG C 7.350 6.236 0.550 1.00 . A A . 8 PRO CG 1 1
4 753 1 1 8 PRO HA H 8.115 3.889 2.693 1.00 . A A . 8 PRO HA 1 1
4 754 1 1 8 PRO HB2 H 6.130 5.683 2.211 1.00 . A A . 8 PRO HB2 1 1
4 755 1 1 8 PRO HB3 H 7.772 6.179 2.637 1.00 . A A . 8 PRO HB3 1 1
4 756 1 1 8 PRO HD2 H 8.487 5.458 -1.082 1.00 . A A . 8 PRO HD2 1 1
4 757 1 1 8 PRO HD3 H 9.457 6.141 0.235 1.00 . A A . 8 PRO HD3 1 1
4 758 1 1 8 PRO HG2 H 6.487 6.012 -0.061 1.00 . A A . 8 PRO HG2 1 1
4 759 1 1 8 PRO HG3 H 7.498 7.303 0.614 1.00 . A A . 8 PRO HG3 1 1
4 760 1 1 8 PRO N N 8.594 4.257 0.652 1.00 . A A . 8 PRO N 1 1
4 761 1 1 8 PRO O O 6.117 3.020 0.306 1.00 . A A . 8 PRO O 1 1
4 762 1 1 9 PRO C C 3.430 2.557 1.764 1.00 . A A . 9 PRO C 1 1
4 763 1 1 9 PRO CA C 4.656 1.849 2.363 1.00 . A A . 9 PRO CA 1 1
4 764 1 1 9 PRO CB C 4.375 1.370 3.791 1.00 . A A . 9 PRO CB 1 1
4 765 1 1 9 PRO CD C 6.128 2.966 3.941 1.00 . A A . 9 PRO CD 1 1
4 766 1 1 9 PRO CG C 4.937 2.426 4.667 1.00 . A A . 9 PRO CG 1 1
4 767 1 1 9 PRO HA H 4.912 1.007 1.739 1.00 . A A . 9 PRO HA 1 1
4 768 1 1 9 PRO HB2 H 3.310 1.257 3.934 1.00 . A A . 9 PRO HB2 1 1
4 769 1 1 9 PRO HB3 H 4.866 0.423 3.956 1.00 . A A . 9 PRO HB3 1 1
4 770 1 1 9 PRO HD2 H 6.249 4.019 4.145 1.00 . A A . 9 PRO HD2 1 1
4 771 1 1 9 PRO HD3 H 7.020 2.422 4.213 1.00 . A A . 9 PRO HD3 1 1
4 772 1 1 9 PRO HG2 H 4.204 3.205 4.819 1.00 . A A . 9 PRO HG2 1 1
4 773 1 1 9 PRO HG3 H 5.234 1.999 5.612 1.00 . A A . 9 PRO HG3 1 1
4 774 1 1 9 PRO N N 5.794 2.746 2.520 1.00 . A A . 9 PRO N 1 1
4 775 1 1 9 PRO O O 2.981 3.609 2.253 1.00 . A A . 9 PRO O 1 1
4 776 1 1 10 ILE C C 0.571 1.675 0.361 1.00 . A A . 10 ILE C 1 1
4 777 1 1 10 ILE CA C 1.762 2.546 0.033 1.00 . A A . 10 ILE CA 1 1
4 778 1 1 10 ILE CB C 1.947 2.584 -1.511 1.00 . A A . 10 ILE CB 1 1
4 779 1 1 10 ILE CD1 C 3.526 3.357 -3.367 1.00 . A A . 10 ILE CD1 1 1
4 780 1 1 10 ILE CG1 C 3.232 3.340 -1.879 1.00 . A A . 10 ILE CG1 1 1
4 781 1 1 10 ILE CG2 C 0.733 3.244 -2.172 1.00 . A A . 10 ILE CG2 1 1
4 782 1 1 10 ILE H H 3.315 1.175 0.345 1.00 . A A . 10 ILE H 1 1
4 783 1 1 10 ILE HA H 1.595 3.548 0.397 1.00 . A A . 10 ILE HA 1 1
4 784 1 1 10 ILE HB H 2.018 1.568 -1.869 1.00 . A A . 10 ILE HB 1 1
4 785 1 1 10 ILE HD11 H 2.714 3.846 -3.885 1.00 . A A . 10 ILE HD11 1 1
4 786 1 1 10 ILE HD12 H 3.621 2.342 -3.724 1.00 . A A . 10 ILE HD12 1 1
4 787 1 1 10 ILE HD13 H 4.446 3.891 -3.549 1.00 . A A . 10 ILE HD13 1 1
4 788 1 1 10 ILE HG12 H 3.146 4.364 -1.550 1.00 . A A . 10 ILE HG12 1 1
4 789 1 1 10 ILE HG13 H 4.069 2.876 -1.379 1.00 . A A . 10 ILE HG13 1 1
4 790 1 1 10 ILE HG21 H 0.873 3.264 -3.244 1.00 . A A . 10 ILE HG21 1 1
4 791 1 1 10 ILE HG22 H 0.630 4.256 -1.807 1.00 . A A . 10 ILE HG22 1 1
4 792 1 1 10 ILE HG23 H -0.158 2.683 -1.933 1.00 . A A . 10 ILE HG23 1 1
4 793 1 1 10 ILE N N 2.917 1.999 0.696 1.00 . A A . 10 ILE N 1 1
4 794 1 1 10 ILE O O 0.547 0.481 0.014 1.00 . A A . 10 ILE O 1 1
4 795 1 1 11 ALA C C -2.779 2.164 0.912 1.00 . A A . 11 ALA C 1 1
4 796 1 1 11 ALA CA C -1.552 1.483 1.418 1.00 . A A . 11 ALA CA 1 1
4 797 1 1 11 ALA CB C -1.675 1.207 2.917 1.00 . A A . 11 ALA CB 1 1
4 798 1 1 11 ALA H H -0.300 3.150 1.390 1.00 . A A . 11 ALA H 1 1
4 799 1 1 11 ALA HA H -1.480 0.528 0.914 1.00 . A A . 11 ALA HA 1 1
4 800 1 1 11 ALA HB1 H -2.556 0.608 3.079 1.00 . A A . 11 ALA HB1 1 1
4 801 1 1 11 ALA HB2 H -1.795 2.099 3.505 1.00 . A A . 11 ALA HB2 1 1
4 802 1 1 11 ALA N N -0.378 2.224 1.075 1.00 . A A . 11 ALA N 1 1
4 803 1 1 11 ALA O O -2.880 3.397 0.916 1.00 . A A . 11 ALA O 1 1
4 804 1 1 12 PHE C C -6.031 1.372 0.863 1.00 . A A . 12 PHE C 1 1
4 805 1 1 12 PHE CA C -4.928 1.830 -0.064 1.00 . A A . 12 PHE CA 1 1
4 806 1 1 12 PHE CB C -5.166 1.256 -1.462 1.00 . A A . 12 PHE CB 1 1
4 807 1 1 12 PHE CD1 C -4.507 2.778 -3.335 1.00 . A A . 12 PHE CD1 1 1
4 808 1 1 12 PHE CD2 C -2.982 1.071 -2.694 1.00 . A A . 12 PHE CD2 1 1
4 809 1 1 12 PHE CE1 C -3.630 3.201 -4.310 1.00 . A A . 12 PHE CE1 1 1
4 810 1 1 12 PHE CE2 C -2.101 1.493 -3.668 1.00 . A A . 12 PHE CE2 1 1
4 811 1 1 12 PHE CG C -4.196 1.712 -2.516 1.00 . A A . 12 PHE CG 1 1
4 812 1 1 12 PHE CZ C -2.425 2.558 -4.476 1.00 . A A . 12 PHE CZ 1 1
4 813 1 1 12 PHE H H -3.505 0.408 0.481 1.00 . A A . 12 PHE H 1 1
4 814 1 1 12 PHE HA H -4.907 2.907 -0.119 1.00 . A A . 12 PHE HA 1 1
4 815 1 1 12 PHE HB2 H -5.102 0.180 -1.403 1.00 . A A . 12 PHE HB2 1 1
4 816 1 1 12 PHE HB3 H -6.162 1.526 -1.780 1.00 . A A . 12 PHE HB3 1 1
4 817 1 1 12 PHE HD1 H -5.453 3.284 -3.208 1.00 . A A . 12 PHE HD1 1 1
4 818 1 1 12 PHE HD2 H -2.726 0.236 -2.059 1.00 . A A . 12 PHE HD2 1 1
4 819 1 1 12 PHE HE1 H -3.887 4.036 -4.945 1.00 . A A . 12 PHE HE1 1 1
4 820 1 1 12 PHE HE2 H -1.154 0.990 -3.801 1.00 . A A . 12 PHE HE2 1 1
4 821 1 1 12 PHE HZ H -1.736 2.886 -5.240 1.00 . A A . 12 PHE HZ 1 1
4 822 1 1 12 PHE N N -3.684 1.376 0.460 1.00 . A A . 12 PHE N 1 1
4 823 1 1 12 PHE O O -6.049 0.194 1.281 1.00 . A A . 12 PHE O 1 1
4 824 1 1 13 PRO C C -9.069 0.936 1.540 1.00 . A A . 13 PRO C 1 1
4 825 1 1 13 PRO CA C -8.080 1.965 2.103 1.00 . A A . 13 PRO CA 1 1
4 826 1 1 13 PRO CB C -8.761 3.314 2.320 1.00 . A A . 13 PRO CB 1 1
4 827 1 1 13 PRO CD C -7.024 3.661 0.723 1.00 . A A . 13 PRO CD 1 1
4 828 1 1 13 PRO CG C -8.390 4.122 1.136 1.00 . A A . 13 PRO CG 1 1
4 829 1 1 13 PRO HA H -7.697 1.598 3.044 1.00 . A A . 13 PRO HA 1 1
4 830 1 1 13 PRO HB2 H -9.830 3.170 2.386 1.00 . A A . 13 PRO HB2 1 1
4 831 1 1 13 PRO HB3 H -8.398 3.762 3.233 1.00 . A A . 13 PRO HB3 1 1
4 832 1 1 13 PRO HD2 H -6.917 3.702 -0.349 1.00 . A A . 13 PRO HD2 1 1
4 833 1 1 13 PRO HD3 H -6.258 4.254 1.202 1.00 . A A . 13 PRO HD3 1 1
4 834 1 1 13 PRO HG2 H -9.104 3.947 0.345 1.00 . A A . 13 PRO HG2 1 1
4 835 1 1 13 PRO HG3 H -8.373 5.170 1.395 1.00 . A A . 13 PRO HG3 1 1
4 836 1 1 13 PRO N N -6.973 2.264 1.192 1.00 . A A . 13 PRO N 1 1
4 837 1 1 13 PRO O O -9.945 0.457 2.255 1.00 . A A . 13 PRO O 1 1
4 838 1 1 14 ASN C C -9.207 -1.857 -0.002 1.00 . A A . 14 ASN C 1 1
4 839 1 1 14 ASN CA C -9.728 -0.462 -0.359 1.00 . A A . 14 ASN CA 1 1
4 840 1 1 14 ASN CB C -9.831 -0.293 -1.898 1.00 . A A . 14 ASN CB 1 1
4 841 1 1 14 ASN CG C -8.503 -0.366 -2.640 1.00 . A A . 14 ASN CG 1 1
4 842 1 1 14 ASN H H -8.218 1.038 -0.262 1.00 . A A . 14 ASN H 1 1
4 843 1 1 14 ASN HA H -10.713 -0.364 0.072 1.00 . A A . 14 ASN HA 1 1
4 844 1 1 14 ASN HB2 H -10.462 -1.075 -2.293 1.00 . A A . 14 ASN HB2 1 1
4 845 1 1 14 ASN HB3 H -10.288 0.661 -2.112 1.00 . A A . 14 ASN HB3 1 1
4 846 1 1 14 ASN HD21 H -8.667 -2.329 -2.878 1.00 . A A . 14 ASN HD21 1 1
4 847 1 1 14 ASN HD22 H -7.272 -1.605 -3.567 1.00 . A A . 14 ASN HD22 1 1
4 848 1 1 14 ASN N N -8.902 0.576 0.268 1.00 . A A . 14 ASN N 1 1
4 849 1 1 14 ASN ND2 N -8.106 -1.540 -3.059 1.00 . A A . 14 ASN ND2 1 1
4 850 1 1 14 ASN O O -9.679 -2.861 -0.527 1.00 . A A . 14 ASN O 1 1
4 851 1 1 14 ASN OD1 O -7.845 0.645 -2.843 1.00 . A A . 14 ASN OD1 1 1
4 852 2 2 1 . C C -1.478 -1.740 3.366 1.00 . B A . 101 WMH C 1 1
4 853 2 2 1 . C1 C -0.519 0.461 3.494 1.00 . B A . 101 WMH C1 1 1
4 854 2 2 1 . C2 C 0.674 0.975 3.870 1.00 . B A . 101 WMH C2 1 1
4 855 2 2 1 . H1 H -2.083 -1.919 4.235 1.00 . B A . 101 WMH H1 1 1
4 856 2 2 1 . H2 H -2.126 -1.213 2.683 1.00 . B A . 101 WMH H2 1 1
4 857 2 2 1 . H5 H 0.952 2.019 3.840 1.00 . B A . 101 WMH H5 1 1
4 858 2 2 1 . N N -0.471 -0.834 3.670 1.00 . B A . 101 WMH N 1 1
4 859 2 2 1 . N1 N 1.443 -0.024 4.285 1.00 . B A . 101 WMH N1 1 1
4 860 2 2 1 . N2 N 0.800 -1.135 4.183 1.00 . B A . 101 WMH N2 1 1
5 861 1 1 1 GLY C C -6.614 -3.629 0.220 1.00 . A A . 1 GLY C 1 1
5 862 1 1 1 GLY CA C -7.755 -3.263 1.116 1.00 . A A . 1 GLY CA 1 1
5 863 1 1 1 GLY H1 H -7.888 -1.169 1.086 1.00 . A A . 1 GLY H1 1 1
5 864 1 1 1 GLY HA2 H -7.403 -3.218 2.135 1.00 . A A . 1 GLY HA2 1 1
5 865 1 1 1 GLY HA3 H -8.519 -4.023 1.041 1.00 . A A . 1 GLY HA3 1 1
5 866 1 1 1 GLY N N -8.317 -1.992 0.767 1.00 . A A . 1 GLY N 1 1
5 867 1 1 1 GLY O O -6.647 -4.662 -0.449 1.00 . A A . 1 GLY O 1 1
5 868 1 1 2 LYS C C -3.251 -2.351 0.010 1.00 . A A . 2 LYS C 1 1
5 869 1 1 2 LYS CA C -4.454 -3.012 -0.642 1.00 . A A . 2 LYS CA 1 1
5 870 1 1 2 LYS CB C -4.694 -2.450 -2.045 1.00 . A A . 2 LYS CB 1 1
5 871 1 1 2 LYS CD C -3.952 -2.116 -4.385 1.00 . A A . 2 LYS CD 1 1
5 872 1 1 2 LYS CE C -2.871 -2.342 -5.416 1.00 . A A . 2 LYS CE 1 1
5 873 1 1 2 LYS CG C -3.569 -2.674 -3.034 1.00 . A A . 2 LYS CG 1 1
5 874 1 1 2 LYS H H -5.651 -1.949 0.702 1.00 . A A . 2 LYS H 1 1
5 875 1 1 2 LYS HA H -4.293 -4.078 -0.707 1.00 . A A . 2 LYS HA 1 1
5 876 1 1 2 LYS HB2 H -5.585 -2.907 -2.449 1.00 . A A . 2 LYS HB2 1 1
5 877 1 1 2 LYS HB3 H -4.863 -1.388 -1.964 1.00 . A A . 2 LYS HB3 1 1
5 878 1 1 2 LYS HD2 H -4.854 -2.608 -4.712 1.00 . A A . 2 LYS HD2 1 1
5 879 1 1 2 LYS HD3 H -4.135 -1.056 -4.287 1.00 . A A . 2 LYS HD3 1 1
5 880 1 1 2 LYS HE2 H -1.978 -1.821 -5.104 1.00 . A A . 2 LYS HE2 1 1
5 881 1 1 2 LYS HE3 H -2.666 -3.401 -5.477 1.00 . A A . 2 LYS HE3 1 1
5 882 1 1 2 LYS HG2 H -2.680 -2.176 -2.679 1.00 . A A . 2 LYS HG2 1 1
5 883 1 1 2 LYS HG3 H -3.384 -3.735 -3.127 1.00 . A A . 2 LYS HG3 1 1
5 884 1 1 2 LYS HZ1 H -2.530 -2.028 -7.437 1.00 . A A . 2 LYS HZ1 1 1
5 885 1 1 2 LYS HZ2 H -3.475 -0.828 -6.737 1.00 . A A . 2 LYS HZ2 1 1
5 886 1 1 2 LYS HZ3 H -4.135 -2.342 -7.079 1.00 . A A . 2 LYS HZ3 1 1
5 887 1 1 2 LYS N N -5.619 -2.777 0.173 1.00 . A A . 2 LYS N 1 1
5 888 1 1 2 LYS NZ N -3.285 -1.850 -6.744 1.00 . A A . 2 LYS NZ 1 1
5 889 1 1 2 LYS O O -3.350 -1.227 0.479 1.00 . A A . 2 LYS O 1 1
5 890 1 1 3 ALA C C 0.295 -2.958 -0.118 1.00 . A A . 3 ALA C 1 1
5 891 1 1 3 ALA CA C -0.926 -2.560 0.659 1.00 . A A . 3 ALA CA 1 1
5 892 1 1 3 ALA CB C -0.815 -2.974 2.132 1.00 . A A . 3 ALA CB 1 1
5 893 1 1 3 ALA H H -2.132 -3.963 -0.300 1.00 . A A . 3 ALA H 1 1
5 894 1 1 3 ALA HA H -0.983 -1.483 0.625 1.00 . A A . 3 ALA HA 1 1
5 895 1 1 3 ALA HB1 H 0.226 -3.115 2.382 1.00 . A A . 3 ALA HB1 1 1
5 896 1 1 3 ALA HB2 H -1.343 -3.905 2.273 1.00 . A A . 3 ALA HB2 1 1
5 897 1 1 3 ALA N N -2.151 -3.052 0.066 1.00 . A A . 3 ALA N 1 1
5 898 1 1 3 ALA O O 0.445 -4.106 -0.539 1.00 . A A . 3 ALA O 1 1
5 899 1 1 4 LEU C C 3.470 -2.168 0.061 1.00 . A A . 4 LEU C 1 1
5 900 1 1 4 LEU CA C 2.391 -2.181 -0.989 1.00 . A A . 4 LEU CA 1 1
5 901 1 1 4 LEU CB C 2.622 -1.062 -2.002 1.00 . A A . 4 LEU CB 1 1
5 902 1 1 4 LEU CD1 C 4.055 -2.344 -3.628 1.00 . A A . 4 LEU CD1 1 1
5 903 1 1 4 LEU CD2 C 4.070 0.155 -3.635 1.00 . A A . 4 LEU CD2 1 1
5 904 1 1 4 LEU CG C 3.943 -1.089 -2.778 1.00 . A A . 4 LEU CG 1 1
5 905 1 1 4 LEU H H 0.922 -1.078 -0.043 1.00 . A A . 4 LEU H 1 1
5 906 1 1 4 LEU HA H 2.379 -3.132 -1.498 1.00 . A A . 4 LEU HA 1 1
5 907 1 1 4 LEU HB2 H 1.815 -1.101 -2.717 1.00 . A A . 4 LEU HB2 1 1
5 908 1 1 4 LEU HB3 H 2.566 -0.130 -1.463 1.00 . A A . 4 LEU HB3 1 1
5 909 1 1 4 LEU HD11 H 4.018 -3.215 -2.991 1.00 . A A . 4 LEU HD11 1 1
5 910 1 1 4 LEU HD12 H 4.992 -2.331 -4.166 1.00 . A A . 4 LEU HD12 1 1
5 911 1 1 4 LEU HD13 H 3.235 -2.378 -4.331 1.00 . A A . 4 LEU HD13 1 1
5 912 1 1 4 LEU HD21 H 4.998 0.120 -4.188 1.00 . A A . 4 LEU HD21 1 1
5 913 1 1 4 LEU HD22 H 4.064 1.031 -3.003 1.00 . A A . 4 LEU HD22 1 1
5 914 1 1 4 LEU HD23 H 3.243 0.204 -4.326 1.00 . A A . 4 LEU HD23 1 1
5 915 1 1 4 LEU HG H 4.761 -1.098 -2.073 1.00 . A A . 4 LEU HG 1 1
5 916 1 1 4 LEU N N 1.140 -1.993 -0.333 1.00 . A A . 4 LEU N 1 1
5 917 1 1 4 LEU O O 3.727 -1.136 0.701 1.00 . A A . 4 LEU O 1 1
5 918 1 1 5 PHE C C 6.412 -3.152 0.609 1.00 . A A . 5 PHE C 1 1
5 919 1 1 5 PHE CA C 5.088 -3.443 1.251 1.00 . A A . 5 PHE CA 1 1
5 920 1 1 5 PHE CB C 5.056 -4.844 1.873 1.00 . A A . 5 PHE CB 1 1
5 921 1 1 5 PHE CD1 C 3.337 -4.657 3.692 1.00 . A A . 5 PHE CD1 1 1
5 922 1 1 5 PHE CD2 C 2.846 -6.045 1.822 1.00 . A A . 5 PHE CD2 1 1
5 923 1 1 5 PHE CE1 C 2.114 -4.965 4.242 1.00 . A A . 5 PHE CE1 1 1
5 924 1 1 5 PHE CE2 C 1.622 -6.357 2.369 1.00 . A A . 5 PHE CE2 1 1
5 925 1 1 5 PHE CG C 3.720 -5.191 2.476 1.00 . A A . 5 PHE CG 1 1
5 926 1 1 5 PHE CZ C 1.254 -5.817 3.581 1.00 . A A . 5 PHE CZ 1 1
5 927 1 1 5 PHE H H 3.815 -4.053 -0.308 1.00 . A A . 5 PHE H 1 1
5 928 1 1 5 PHE HA H 4.909 -2.706 2.020 1.00 . A A . 5 PHE HA 1 1
5 929 1 1 5 PHE HB2 H 5.281 -5.575 1.110 1.00 . A A . 5 PHE HB2 1 1
5 930 1 1 5 PHE HB3 H 5.802 -4.904 2.652 1.00 . A A . 5 PHE HB3 1 1
5 931 1 1 5 PHE HD1 H 4.008 -3.989 4.213 1.00 . A A . 5 PHE HD1 1 1
5 932 1 1 5 PHE HD2 H 3.129 -6.472 0.871 1.00 . A A . 5 PHE HD2 1 1
5 933 1 1 5 PHE HE1 H 1.830 -4.540 5.193 1.00 . A A . 5 PHE HE1 1 1
5 934 1 1 5 PHE HE2 H 0.950 -7.024 1.847 1.00 . A A . 5 PHE HE2 1 1
5 935 1 1 5 PHE HZ H 0.292 -6.061 4.011 1.00 . A A . 5 PHE HZ 1 1
5 936 1 1 5 PHE N N 4.063 -3.295 0.262 1.00 . A A . 5 PHE N 1 1
5 937 1 1 5 PHE O O 7.048 -4.027 0.015 1.00 . A A . 5 PHE O 1 1
5 938 1 1 6 SER C C 8.323 -0.108 0.726 1.00 . A A . 6 SER C 1 1
5 939 1 1 6 SER CA C 7.955 -1.396 0.012 1.00 . A A . 6 SER CA 1 1
5 940 1 1 6 SER CB C 7.700 -1.124 -1.484 1.00 . A A . 6 SER CB 1 1
5 941 1 1 6 SER H H 6.172 -1.247 1.056 1.00 . A A . 6 SER H 1 1
5 942 1 1 6 SER HA H 8.741 -2.129 0.117 1.00 . A A . 6 SER HA 1 1
5 943 1 1 6 SER HB2 H 6.915 -0.389 -1.584 1.00 . A A . 6 SER HB2 1 1
5 944 1 1 6 SER HB3 H 8.601 -0.746 -1.944 1.00 . A A . 6 SER HB3 1 1
5 945 1 1 6 SER HG H 7.157 -2.973 -1.472 1.00 . A A . 6 SER HG 1 1
5 946 1 1 6 SER N N 6.755 -1.901 0.612 1.00 . A A . 6 SER N 1 1
5 947 1 1 6 SER O O 7.812 0.163 1.819 1.00 . A A . 6 SER O 1 1
5 948 1 1 6 SER OG O 7.304 -2.309 -2.159 1.00 . A A . 6 SER OG 1 1
5 949 1 1 7 ASN C C 9.213 3.012 -0.320 1.00 . A A . 7 ASN C 1 1
5 950 1 1 7 ASN CA C 9.565 1.944 0.692 1.00 . A A . 7 ASN CA 1 1
5 951 1 1 7 ASN CB C 11.062 2.009 1.031 1.00 . A A . 7 ASN CB 1 1
5 952 1 1 7 ASN CG C 11.483 1.069 2.154 1.00 . A A . 7 ASN CG 1 1
5 953 1 1 7 ASN H H 9.635 0.376 -0.686 1.00 . A A . 7 ASN H 1 1
5 954 1 1 7 ASN HA H 8.986 2.076 1.593 1.00 . A A . 7 ASN HA 1 1
5 955 1 1 7 ASN HB2 H 11.628 1.747 0.151 1.00 . A A . 7 ASN HB2 1 1
5 956 1 1 7 ASN HB3 H 11.310 3.021 1.318 1.00 . A A . 7 ASN HB3 1 1
5 957 1 1 7 ASN HD21 H 9.759 1.314 3.112 1.00 . A A . 7 ASN HD21 1 1
5 958 1 1 7 ASN HD22 H 10.884 0.245 3.848 1.00 . A A . 7 ASN HD22 1 1
5 959 1 1 7 ASN N N 9.203 0.661 0.148 1.00 . A A . 7 ASN N 1 1
5 960 1 1 7 ASN ND2 N 10.629 0.863 3.131 1.00 . A A . 7 ASN ND2 1 1
5 961 1 1 7 ASN O O 9.846 3.089 -1.385 1.00 . A A . 7 ASN O 1 1
5 962 1 1 7 ASN OD1 O 12.592 0.546 2.147 1.00 . A A . 7 ASN OD1 1 1
5 963 1 1 8 PRO C C 6.281 2.828 1.193 1.00 . A A . 8 PRO C 1 1
5 964 1 1 8 PRO CA C 7.443 3.840 1.211 1.00 . A A . 8 PRO CA 1 1
5 965 1 1 8 PRO CB C 6.893 5.265 1.260 1.00 . A A . 8 PRO CB 1 1
5 966 1 1 8 PRO CD C 7.698 4.884 -0.971 1.00 . A A . 8 PRO CD 1 1
5 967 1 1 8 PRO CG C 6.663 5.630 -0.166 1.00 . A A . 8 PRO CG 1 1
5 968 1 1 8 PRO HA H 8.063 3.667 2.078 1.00 . A A . 8 PRO HA 1 1
5 969 1 1 8 PRO HB2 H 5.975 5.282 1.829 1.00 . A A . 8 PRO HB2 1 1
5 970 1 1 8 PRO HB3 H 7.621 5.918 1.719 1.00 . A A . 8 PRO HB3 1 1
5 971 1 1 8 PRO HD2 H 7.240 4.422 -1.832 1.00 . A A . 8 PRO HD2 1 1
5 972 1 1 8 PRO HD3 H 8.489 5.552 -1.280 1.00 . A A . 8 PRO HD3 1 1
5 973 1 1 8 PRO HG2 H 5.670 5.327 -0.462 1.00 . A A . 8 PRO HG2 1 1
5 974 1 1 8 PRO HG3 H 6.781 6.695 -0.298 1.00 . A A . 8 PRO HG3 1 1
5 975 1 1 8 PRO N N 8.207 3.853 -0.043 1.00 . A A . 8 PRO N 1 1
5 976 1 1 8 PRO O O 5.866 2.362 0.121 1.00 . A A . 8 PRO O 1 1
5 977 1 1 9 PRO C C 3.358 2.302 2.057 1.00 . A A . 9 PRO C 1 1
5 978 1 1 9 PRO CA C 4.629 1.546 2.455 1.00 . A A . 9 PRO CA 1 1
5 979 1 1 9 PRO CB C 4.590 1.116 3.928 1.00 . A A . 9 PRO CB 1 1
5 980 1 1 9 PRO CD C 6.324 2.763 3.707 1.00 . A A . 9 PRO CD 1 1
5 981 1 1 9 PRO CG C 5.317 2.190 4.667 1.00 . A A . 9 PRO CG 1 1
5 982 1 1 9 PRO HA H 4.748 0.688 1.810 1.00 . A A . 9 PRO HA 1 1
5 983 1 1 9 PRO HB2 H 3.563 1.038 4.252 1.00 . A A . 9 PRO HB2 1 1
5 984 1 1 9 PRO HB3 H 5.079 0.161 4.040 1.00 . A A . 9 PRO HB3 1 1
5 985 1 1 9 PRO HD2 H 6.396 3.834 3.830 1.00 . A A . 9 PRO HD2 1 1
5 986 1 1 9 PRO HD3 H 7.289 2.302 3.855 1.00 . A A . 9 PRO HD3 1 1
5 987 1 1 9 PRO HG2 H 4.620 2.955 4.978 1.00 . A A . 9 PRO HG2 1 1
5 988 1 1 9 PRO HG3 H 5.816 1.770 5.527 1.00 . A A . 9 PRO HG3 1 1
5 989 1 1 9 PRO N N 5.780 2.425 2.373 1.00 . A A . 9 PRO N 1 1
5 990 1 1 9 PRO O O 2.856 3.167 2.798 1.00 . A A . 9 PRO O 1 1
5 991 1 1 10 ILE C C 0.520 1.800 0.485 1.00 . A A . 10 ILE C 1 1
5 992 1 1 10 ILE CA C 1.723 2.708 0.352 1.00 . A A . 10 ILE CA 1 1
5 993 1 1 10 ILE CB C 1.931 3.117 -1.132 1.00 . A A . 10 ILE CB 1 1
5 994 1 1 10 ILE CD1 C 3.515 4.435 -2.670 1.00 . A A . 10 ILE CD1 1 1
5 995 1 1 10 ILE CG1 C 3.165 4.032 -1.252 1.00 . A A . 10 ILE CG1 1 1
5 996 1 1 10 ILE CG2 C 0.688 3.822 -1.675 1.00 . A A . 10 ILE CG2 1 1
5 997 1 1 10 ILE H H 3.343 1.362 0.329 1.00 . A A . 10 ILE H 1 1
5 998 1 1 10 ILE HA H 1.554 3.598 0.940 1.00 . A A . 10 ILE HA 1 1
5 999 1 1 10 ILE HB H 2.101 2.225 -1.715 1.00 . A A . 10 ILE HB 1 1
5 1000 1 1 10 ILE HD11 H 3.719 3.552 -3.256 1.00 . A A . 10 ILE HD11 1 1
5 1001 1 1 10 ILE HD12 H 4.389 5.069 -2.658 1.00 . A A . 10 ILE HD12 1 1
5 1002 1 1 10 ILE HD13 H 2.685 4.973 -3.104 1.00 . A A . 10 ILE HD13 1 1
5 1003 1 1 10 ILE HG12 H 2.985 4.939 -0.693 1.00 . A A . 10 ILE HG12 1 1
5 1004 1 1 10 ILE HG13 H 4.019 3.524 -0.829 1.00 . A A . 10 ILE HG13 1 1
5 1005 1 1 10 ILE HG21 H -0.163 3.161 -1.599 1.00 . A A . 10 ILE HG21 1 1
5 1006 1 1 10 ILE HG22 H 0.847 4.082 -2.710 1.00 . A A . 10 ILE HG22 1 1
5 1007 1 1 10 ILE HG23 H 0.502 4.719 -1.102 1.00 . A A . 10 ILE HG23 1 1
5 1008 1 1 10 ILE N N 2.889 2.040 0.875 1.00 . A A . 10 ILE N 1 1
5 1009 1 1 10 ILE O O 0.503 0.693 -0.063 1.00 . A A . 10 ILE O 1 1
5 1010 1 1 11 ALA C C -2.853 2.174 0.980 1.00 . A A . 11 ALA C 1 1
5 1011 1 1 11 ALA CA C -1.631 1.440 1.455 1.00 . A A . 11 ALA CA 1 1
5 1012 1 1 11 ALA CB C -1.788 1.007 2.920 1.00 . A A . 11 ALA CB 1 1
5 1013 1 1 11 ALA H H -0.413 3.113 1.671 1.00 . A A . 11 ALA H 1 1
5 1014 1 1 11 ALA HA H -1.529 0.544 0.857 1.00 . A A . 11 ALA HA 1 1
5 1015 1 1 11 ALA HB1 H -2.628 0.335 2.984 1.00 . A A . 11 ALA HB1 1 1
5 1016 1 1 11 ALA HB2 H -1.990 1.820 3.592 1.00 . A A . 11 ALA HB2 1 1
5 1017 1 1 11 ALA N N -0.457 2.232 1.244 1.00 . A A . 11 ALA N 1 1
5 1018 1 1 11 ALA O O -2.877 3.415 0.943 1.00 . A A . 11 ALA O 1 1
5 1019 1 1 12 PHE C C -6.199 1.387 0.923 1.00 . A A . 12 PHE C 1 1
5 1020 1 1 12 PHE CA C -5.066 1.946 0.081 1.00 . A A . 12 PHE CA 1 1
5 1021 1 1 12 PHE CB C -5.255 1.532 -1.388 1.00 . A A . 12 PHE CB 1 1
5 1022 1 1 12 PHE CD1 C -4.280 3.177 -3.017 1.00 . A A . 12 PHE CD1 1 1
5 1023 1 1 12 PHE CD2 C -3.021 1.221 -2.510 1.00 . A A . 12 PHE CD2 1 1
5 1024 1 1 12 PHE CE1 C -3.285 3.595 -3.874 1.00 . A A . 12 PHE CE1 1 1
5 1025 1 1 12 PHE CE2 C -2.022 1.635 -3.363 1.00 . A A . 12 PHE CE2 1 1
5 1026 1 1 12 PHE CG C -4.163 1.987 -2.324 1.00 . A A . 12 PHE CG 1 1
5 1027 1 1 12 PHE CZ C -2.154 2.824 -4.048 1.00 . A A . 12 PHE CZ 1 1
5 1028 1 1 12 PHE H H -3.742 0.447 0.662 1.00 . A A . 12 PHE H 1 1
5 1029 1 1 12 PHE HA H -5.042 3.023 0.151 1.00 . A A . 12 PHE HA 1 1
5 1030 1 1 12 PHE HB2 H -5.309 0.456 -1.440 1.00 . A A . 12 PHE HB2 1 1
5 1031 1 1 12 PHE HB3 H -6.192 1.939 -1.743 1.00 . A A . 12 PHE HB3 1 1
5 1032 1 1 12 PHE HD1 H -5.163 3.787 -2.884 1.00 . A A . 12 PHE HD1 1 1
5 1033 1 1 12 PHE HD2 H -2.914 0.288 -1.974 1.00 . A A . 12 PHE HD2 1 1
5 1034 1 1 12 PHE HE1 H -3.392 4.528 -4.409 1.00 . A A . 12 PHE HE1 1 1
5 1035 1 1 12 PHE HE2 H -1.137 1.029 -3.498 1.00 . A A . 12 PHE HE2 1 1
5 1036 1 1 12 PHE HZ H -1.373 3.151 -4.719 1.00 . A A . 12 PHE HZ 1 1
5 1037 1 1 12 PHE N N -3.833 1.426 0.590 1.00 . A A . 12 PHE N 1 1
5 1038 1 1 12 PHE O O -6.259 0.163 1.157 1.00 . A A . 12 PHE O 1 1
5 1039 1 1 13 PRO C C -9.277 0.893 1.643 1.00 . A A . 13 PRO C 1 1
5 1040 1 1 13 PRO CA C -8.237 1.853 2.269 1.00 . A A . 13 PRO CA 1 1
5 1041 1 1 13 PRO CB C -8.881 3.183 2.661 1.00 . A A . 13 PRO CB 1 1
5 1042 1 1 13 PRO CD C -7.183 3.692 1.045 1.00 . A A . 13 PRO CD 1 1
5 1043 1 1 13 PRO CG C -8.512 4.138 1.577 1.00 . A A . 13 PRO CG 1 1
5 1044 1 1 13 PRO HA H -7.838 1.380 3.154 1.00 . A A . 13 PRO HA 1 1
5 1045 1 1 13 PRO HB2 H -9.950 3.053 2.727 1.00 . A A . 13 PRO HB2 1 1
5 1046 1 1 13 PRO HB3 H -8.494 3.502 3.617 1.00 . A A . 13 PRO HB3 1 1
5 1047 1 1 13 PRO HD2 H -7.132 3.851 -0.022 1.00 . A A . 13 PRO HD2 1 1
5 1048 1 1 13 PRO HD3 H -6.383 4.220 1.542 1.00 . A A . 13 PRO HD3 1 1
5 1049 1 1 13 PRO HG2 H -9.255 4.116 0.796 1.00 . A A . 13 PRO HG2 1 1
5 1050 1 1 13 PRO HG3 H -8.435 5.136 1.985 1.00 . A A . 13 PRO HG3 1 1
5 1051 1 1 13 PRO N N -7.136 2.247 1.366 1.00 . A A . 13 PRO N 1 1
5 1052 1 1 13 PRO O O -10.272 0.532 2.279 1.00 . A A . 13 PRO O 1 1
5 1053 1 1 14 ASN C C -9.392 -1.910 0.009 1.00 . A A . 14 ASN C 1 1
5 1054 1 1 14 ASN CA C -9.914 -0.504 -0.240 1.00 . A A . 14 ASN CA 1 1
5 1055 1 1 14 ASN CB C -10.056 -0.238 -1.754 1.00 . A A . 14 ASN CB 1 1
5 1056 1 1 14 ASN CG C -8.751 -0.335 -2.532 1.00 . A A . 14 ASN CG 1 1
5 1057 1 1 14 ASN H H -8.260 0.832 -0.055 1.00 . A A . 14 ASN H 1 1
5 1058 1 1 14 ASN HA H -10.884 -0.422 0.230 1.00 . A A . 14 ASN HA 1 1
5 1059 1 1 14 ASN HB2 H -10.738 -0.966 -2.167 1.00 . A A . 14 ASN HB2 1 1
5 1060 1 1 14 ASN HB3 H -10.471 0.749 -1.901 1.00 . A A . 14 ASN HB3 1 1
5 1061 1 1 14 ASN HD21 H -9.105 -2.224 -2.993 1.00 . A A . 14 ASN HD21 1 1
5 1062 1 1 14 ASN HD22 H -7.646 -1.561 -3.633 1.00 . A A . 14 ASN HD22 1 1
5 1063 1 1 14 ASN N N -9.041 0.473 0.414 1.00 . A A . 14 ASN N 1 1
5 1064 1 1 14 ASN ND2 N -8.467 -1.483 -3.100 1.00 . A A . 14 ASN ND2 1 1
5 1065 1 1 14 ASN O O -9.953 -2.895 -0.476 1.00 . A A . 14 ASN O 1 1
5 1066 1 1 14 ASN OD1 O -8.023 0.644 -2.639 1.00 . A A . 14 ASN OD1 1 1
5 1067 2 2 1 . C C -1.397 -1.947 3.074 1.00 . B A . 101 WMH C 1 1
5 1068 2 2 1 . C1 C -0.601 0.283 3.465 1.00 . B A . 101 WMH C1 1 1
5 1069 2 2 1 . C2 C 0.537 0.837 3.939 1.00 . B A . 101 WMH C2 1 1
5 1070 2 2 1 . H1 H -1.978 -2.281 3.912 1.00 . B A . 101 WMH H1 1 1
5 1071 2 2 1 . H2 H -2.087 -1.396 2.457 1.00 . B A . 101 WMH H2 1 1
5 1072 2 2 1 . H5 H 0.734 1.894 4.030 1.00 . B A . 101 WMH H5 1 1
5 1073 2 2 1 . N N -0.460 -1.013 3.499 1.00 . B A . 101 WMH N 1 1
5 1074 2 2 1 . N1 N 1.373 -0.140 4.268 1.00 . B A . 101 WMH N1 1 1
5 1075 2 2 1 . N2 N 0.816 -1.277 4.021 1.00 . B A . 101 WMH N2 1 1
6 1076 1 1 1 GLY C C -6.062 -3.434 0.868 1.00 . A A . 1 GLY C 1 1
6 1077 1 1 1 GLY CA C -7.384 -3.072 1.506 1.00 . A A . 1 GLY CA 1 1
6 1078 1 1 1 GLY H1 H -7.593 -1.018 1.063 1.00 . A A . 1 GLY H1 1 1
6 1079 1 1 1 GLY HA2 H -7.219 -2.880 2.556 1.00 . A A . 1 GLY HA2 1 1
6 1080 1 1 1 GLY HA3 H -8.061 -3.906 1.405 1.00 . A A . 1 GLY HA3 1 1
6 1081 1 1 1 GLY N N -7.989 -1.906 0.912 1.00 . A A . 1 GLY N 1 1
6 1082 1 1 1 GLY O O -5.311 -4.258 1.407 1.00 . A A . 1 GLY O 1 1
6 1083 1 1 2 LYS C C -3.349 -2.433 -0.235 1.00 . A A . 2 LYS C 1 1
6 1084 1 1 2 LYS CA C -4.518 -3.081 -0.966 1.00 . A A . 2 LYS CA 1 1
6 1085 1 1 2 LYS CB C -4.591 -2.593 -2.424 1.00 . A A . 2 LYS CB 1 1
6 1086 1 1 2 LYS CD C -4.872 -4.833 -3.540 1.00 . A A . 2 LYS CD 1 1
6 1087 1 1 2 LYS CE C -5.681 -5.650 -4.537 1.00 . A A . 2 LYS CE 1 1
6 1088 1 1 2 LYS CG C -5.455 -3.441 -3.349 1.00 . A A . 2 LYS CG 1 1
6 1089 1 1 2 LYS H H -6.394 -2.171 -0.637 1.00 . A A . 2 LYS H 1 1
6 1090 1 1 2 LYS HA H -4.363 -4.150 -0.962 1.00 . A A . 2 LYS HA 1 1
6 1091 1 1 2 LYS HB2 H -5.009 -1.599 -2.423 1.00 . A A . 2 LYS HB2 1 1
6 1092 1 1 2 LYS HB3 H -3.603 -2.540 -2.850 1.00 . A A . 2 LYS HB3 1 1
6 1093 1 1 2 LYS HD2 H -3.858 -4.746 -3.903 1.00 . A A . 2 LYS HD2 1 1
6 1094 1 1 2 LYS HD3 H -4.869 -5.347 -2.590 1.00 . A A . 2 LYS HD3 1 1
6 1095 1 1 2 LYS HE2 H -5.704 -5.127 -5.482 1.00 . A A . 2 LYS HE2 1 1
6 1096 1 1 2 LYS HE3 H -5.194 -6.603 -4.670 1.00 . A A . 2 LYS HE3 1 1
6 1097 1 1 2 LYS HG2 H -6.443 -3.530 -2.920 1.00 . A A . 2 LYS HG2 1 1
6 1098 1 1 2 LYS HG3 H -5.524 -2.953 -4.309 1.00 . A A . 2 LYS HG3 1 1
6 1099 1 1 2 LYS HZ1 H -7.599 -6.446 -4.775 1.00 . A A . 2 LYS HZ1 1 1
6 1100 1 1 2 LYS HZ2 H -7.588 -4.986 -3.957 1.00 . A A . 2 LYS HZ2 1 1
6 1101 1 1 2 LYS HZ3 H -7.092 -6.375 -3.173 1.00 . A A . 2 LYS HZ3 1 1
6 1102 1 1 2 LYS N N -5.765 -2.825 -0.264 1.00 . A A . 2 LYS N 1 1
6 1103 1 1 2 LYS NZ N -7.070 -5.877 -4.085 1.00 . A A . 2 LYS NZ 1 1
6 1104 1 1 2 LYS O O -3.417 -1.274 0.154 1.00 . A A . 2 LYS O 1 1
6 1105 1 1 3 ALA C C 0.122 -3.121 -0.065 1.00 . A A . 3 ALA C 1 1
6 1106 1 1 3 ALA CA C -1.126 -2.724 0.661 1.00 . A A . 3 ALA CA 1 1
6 1107 1 1 3 ALA CB C -1.112 -3.211 2.121 1.00 . A A . 3 ALA CB 1 1
6 1108 1 1 3 ALA H H -2.306 -4.110 -0.364 1.00 . A A . 3 ALA H 1 1
6 1109 1 1 3 ALA HA H -1.167 -1.645 0.666 1.00 . A A . 3 ALA HA 1 1
6 1110 1 1 3 ALA HB1 H -0.089 -3.367 2.428 1.00 . A A . 3 ALA HB1 1 1
6 1111 1 1 3 ALA HB2 H -1.644 -4.149 2.178 1.00 . A A . 3 ALA HB2 1 1
6 1112 1 1 3 ALA N N -2.310 -3.188 -0.029 1.00 . A A . 3 ALA N 1 1
6 1113 1 1 3 ALA O O 0.271 -4.270 -0.488 1.00 . A A . 3 ALA O 1 1
6 1114 1 1 4 LEU C C 3.377 -2.117 0.060 1.00 . A A . 4 LEU C 1 1
6 1115 1 1 4 LEU CA C 2.245 -2.387 -0.898 1.00 . A A . 4 LEU CA 1 1
6 1116 1 1 4 LEU CB C 2.348 -1.472 -2.114 1.00 . A A . 4 LEU CB 1 1
6 1117 1 1 4 LEU CD1 C 3.655 -3.007 -3.616 1.00 . A A . 4 LEU CD1 1 1
6 1118 1 1 4 LEU CD2 C 3.628 -0.545 -4.062 1.00 . A A . 4 LEU CD2 1 1
6 1119 1 1 4 LEU CG C 3.597 -1.623 -2.990 1.00 . A A . 4 LEU CG 1 1
6 1120 1 1 4 LEU H H 0.824 -1.273 0.134 1.00 . A A . 4 LEU H 1 1
6 1121 1 1 4 LEU HA H 2.283 -3.415 -1.222 1.00 . A A . 4 LEU HA 1 1
6 1122 1 1 4 LEU HB2 H 1.479 -1.654 -2.730 1.00 . A A . 4 LEU HB2 1 1
6 1123 1 1 4 LEU HB3 H 2.313 -0.460 -1.746 1.00 . A A . 4 LEU HB3 1 1
6 1124 1 1 4 LEU HD11 H 4.525 -3.080 -4.251 1.00 . A A . 4 LEU HD11 1 1
6 1125 1 1 4 LEU HD12 H 2.766 -3.178 -4.203 1.00 . A A . 4 LEU HD12 1 1
6 1126 1 1 4 LEU HD13 H 3.722 -3.751 -2.836 1.00 . A A . 4 LEU HD13 1 1
6 1127 1 1 4 LEU HD21 H 4.512 -0.668 -4.671 1.00 . A A . 4 LEU HD21 1 1
6 1128 1 1 4 LEU HD22 H 3.646 0.429 -3.594 1.00 . A A . 4 LEU HD22 1 1
6 1129 1 1 4 LEU HD23 H 2.750 -0.630 -4.684 1.00 . A A . 4 LEU HD23 1 1
6 1130 1 1 4 LEU HG H 4.472 -1.507 -2.368 1.00 . A A . 4 LEU HG 1 1
6 1131 1 1 4 LEU N N 1.004 -2.174 -0.223 1.00 . A A . 4 LEU N 1 1
6 1132 1 1 4 LEU O O 3.653 -0.960 0.429 1.00 . A A . 4 LEU O 1 1
6 1133 1 1 5 PHE C C 6.401 -2.895 0.690 1.00 . A A . 5 PHE C 1 1
6 1134 1 1 5 PHE CA C 5.089 -3.076 1.421 1.00 . A A . 5 PHE CA 1 1
6 1135 1 1 5 PHE CB C 5.143 -4.286 2.356 1.00 . A A . 5 PHE CB 1 1
6 1136 1 1 5 PHE CD1 C 2.907 -5.316 2.856 1.00 . A A . 5 PHE CD1 1 1
6 1137 1 1 5 PHE CD2 C 3.801 -3.741 4.400 1.00 . A A . 5 PHE CD2 1 1
6 1138 1 1 5 PHE CE1 C 1.793 -5.473 3.655 1.00 . A A . 5 PHE CE1 1 1
6 1139 1 1 5 PHE CE2 C 2.691 -3.890 5.201 1.00 . A A . 5 PHE CE2 1 1
6 1140 1 1 5 PHE CG C 3.924 -4.450 3.220 1.00 . A A . 5 PHE CG 1 1
6 1141 1 1 5 PHE CZ C 1.685 -4.758 4.830 1.00 . A A . 5 PHE CZ 1 1
6 1142 1 1 5 PHE H H 3.713 -4.033 0.131 1.00 . A A . 5 PHE H 1 1
6 1143 1 1 5 PHE HA H 4.918 -2.188 2.012 1.00 . A A . 5 PHE HA 1 1
6 1144 1 1 5 PHE HB2 H 5.244 -5.179 1.761 1.00 . A A . 5 PHE HB2 1 1
6 1145 1 1 5 PHE HB3 H 6.003 -4.193 3.003 1.00 . A A . 5 PHE HB3 1 1
6 1146 1 1 5 PHE HD1 H 2.990 -5.877 1.937 1.00 . A A . 5 PHE HD1 1 1
6 1147 1 1 5 PHE HD2 H 4.585 -3.059 4.695 1.00 . A A . 5 PHE HD2 1 1
6 1148 1 1 5 PHE HE1 H 1.004 -6.151 3.365 1.00 . A A . 5 PHE HE1 1 1
6 1149 1 1 5 PHE HE2 H 2.609 -3.330 6.120 1.00 . A A . 5 PHE HE2 1 1
6 1150 1 1 5 PHE HZ H 0.816 -4.877 5.459 1.00 . A A . 5 PHE HZ 1 1
6 1151 1 1 5 PHE N N 4.000 -3.166 0.485 1.00 . A A . 5 PHE N 1 1
6 1152 1 1 5 PHE O O 7.133 -3.845 0.410 1.00 . A A . 5 PHE O 1 1
6 1153 1 1 6 SER C C 8.311 -0.035 0.300 1.00 . A A . 6 SER C 1 1
6 1154 1 1 6 SER CA C 7.826 -1.301 -0.366 1.00 . A A . 6 SER CA 1 1
6 1155 1 1 6 SER CB C 7.479 -1.069 -1.837 1.00 . A A . 6 SER CB 1 1
6 1156 1 1 6 SER H H 5.999 -0.990 0.542 1.00 . A A . 6 SER H 1 1
6 1157 1 1 6 SER HA H 8.559 -2.085 -0.274 1.00 . A A . 6 SER HA 1 1
6 1158 1 1 6 SER HB2 H 6.759 -0.267 -1.913 1.00 . A A . 6 SER HB2 1 1
6 1159 1 1 6 SER HB3 H 8.369 -0.807 -2.390 1.00 . A A . 6 SER HB3 1 1
6 1160 1 1 6 SER HG H 7.009 -2.936 -1.727 1.00 . A A . 6 SER HG 1 1
6 1161 1 1 6 SER N N 6.646 -1.692 0.324 1.00 . A A . 6 SER N 1 1
6 1162 1 1 6 SER O O 7.905 0.238 1.423 1.00 . A A . 6 SER O 1 1
6 1163 1 1 6 SER OG O 6.918 -2.248 -2.399 1.00 . A A . 6 SER OG 1 1
6 1164 1 1 7 ASN C C 9.040 3.128 -0.578 1.00 . A A . 7 ASN C 1 1
6 1165 1 1 7 ASN CA C 9.589 1.964 0.241 1.00 . A A . 7 ASN CA 1 1
6 1166 1 1 7 ASN CB C 11.133 2.077 0.425 1.00 . A A . 7 ASN CB 1 1
6 1167 1 1 7 ASN CG C 11.960 1.960 -0.853 1.00 . A A . 7 ASN CG 1 1
6 1168 1 1 7 ASN H H 9.546 0.442 -1.195 1.00 . A A . 7 ASN H 1 1
6 1169 1 1 7 ASN HA H 9.119 1.977 1.212 1.00 . A A . 7 ASN HA 1 1
6 1170 1 1 7 ASN HB2 H 11.356 3.037 0.868 1.00 . A A . 7 ASN HB2 1 1
6 1171 1 1 7 ASN HB3 H 11.449 1.306 1.110 1.00 . A A . 7 ASN HB3 1 1
6 1172 1 1 7 ASN HD21 H 13.252 3.270 -0.149 1.00 . A A . 7 ASN HD21 1 1
6 1173 1 1 7 ASN HD22 H 13.615 2.651 -1.708 1.00 . A A . 7 ASN HD22 1 1
6 1174 1 1 7 ASN N N 9.170 0.707 -0.330 1.00 . A A . 7 ASN N 1 1
6 1175 1 1 7 ASN ND2 N 13.041 2.691 -0.914 1.00 . A A . 7 ASN ND2 1 1
6 1176 1 1 7 ASN O O 9.380 3.275 -1.757 1.00 . A A . 7 ASN O 1 1
6 1177 1 1 7 ASN OD1 O 11.614 1.228 -1.786 1.00 . A A . 7 ASN OD1 1 1
6 1178 1 1 8 PRO C C 6.325 2.834 1.332 1.00 . A A . 8 PRO C 1 1
6 1179 1 1 8 PRO CA C 7.567 3.764 1.343 1.00 . A A . 8 PRO CA 1 1
6 1180 1 1 8 PRO CB C 7.146 5.192 1.699 1.00 . A A . 8 PRO CB 1 1
6 1181 1 1 8 PRO CD C 7.580 5.153 -0.666 1.00 . A A . 8 PRO CD 1 1
6 1182 1 1 8 PRO CG C 6.735 5.801 0.402 1.00 . A A . 8 PRO CG 1 1
6 1183 1 1 8 PRO HA H 8.292 3.407 2.057 1.00 . A A . 8 PRO HA 1 1
6 1184 1 1 8 PRO HB2 H 6.327 5.160 2.402 1.00 . A A . 8 PRO HB2 1 1
6 1185 1 1 8 PRO HB3 H 7.982 5.717 2.134 1.00 . A A . 8 PRO HB3 1 1
6 1186 1 1 8 PRO HD2 H 6.974 4.885 -1.518 1.00 . A A . 8 PRO HD2 1 1
6 1187 1 1 8 PRO HD3 H 8.377 5.815 -0.972 1.00 . A A . 8 PRO HD3 1 1
6 1188 1 1 8 PRO HG2 H 5.688 5.603 0.220 1.00 . A A . 8 PRO HG2 1 1
6 1189 1 1 8 PRO HG3 H 6.912 6.866 0.423 1.00 . A A . 8 PRO HG3 1 1
6 1190 1 1 8 PRO N N 8.128 3.944 -0.014 1.00 . A A . 8 PRO N 1 1
6 1191 1 1 8 PRO O O 5.700 2.639 0.274 1.00 . A A . 8 PRO O 1 1
6 1192 1 1 9 PRO C C 3.522 2.149 2.396 1.00 . A A . 9 PRO C 1 1
6 1193 1 1 9 PRO CA C 4.804 1.350 2.577 1.00 . A A . 9 PRO CA 1 1
6 1194 1 1 9 PRO CB C 4.884 0.767 3.993 1.00 . A A . 9 PRO CB 1 1
6 1195 1 1 9 PRO CD C 6.722 2.278 3.748 1.00 . A A . 9 PRO CD 1 1
6 1196 1 1 9 PRO CG C 5.766 1.705 4.746 1.00 . A A . 9 PRO CG 1 1
6 1197 1 1 9 PRO HA H 4.838 0.559 1.843 1.00 . A A . 9 PRO HA 1 1
6 1198 1 1 9 PRO HB2 H 3.894 0.724 4.421 1.00 . A A . 9 PRO HB2 1 1
6 1199 1 1 9 PRO HB3 H 5.306 -0.226 3.954 1.00 . A A . 9 PRO HB3 1 1
6 1200 1 1 9 PRO HD2 H 6.967 3.299 3.997 1.00 . A A . 9 PRO HD2 1 1
6 1201 1 1 9 PRO HD3 H 7.616 1.675 3.696 1.00 . A A . 9 PRO HD3 1 1
6 1202 1 1 9 PRO HG2 H 5.172 2.492 5.185 1.00 . A A . 9 PRO HG2 1 1
6 1203 1 1 9 PRO HG3 H 6.303 1.168 5.514 1.00 . A A . 9 PRO HG3 1 1
6 1204 1 1 9 PRO N N 5.979 2.216 2.478 1.00 . A A . 9 PRO N 1 1
6 1205 1 1 9 PRO O O 3.194 3.032 3.213 1.00 . A A . 9 PRO O 1 1
6 1206 1 1 10 ILE C C 0.437 1.642 1.047 1.00 . A A . 10 ILE C 1 1
6 1207 1 1 10 ILE CA C 1.624 2.588 1.017 1.00 . A A . 10 ILE CA 1 1
6 1208 1 1 10 ILE CB C 1.737 3.313 -0.366 1.00 . A A . 10 ILE CB 1 1
6 1209 1 1 10 ILE CD1 C 0.496 4.872 -1.978 1.00 . A A . 10 ILE CD1 1 1
6 1210 1 1 10 ILE CG1 C 0.445 4.082 -0.689 1.00 . A A . 10 ILE CG1 1 1
6 1211 1 1 10 ILE CG2 C 2.090 2.329 -1.485 1.00 . A A . 10 ILE CG2 1 1
6 1212 1 1 10 ILE H H 3.111 1.140 0.751 1.00 . A A . 10 ILE H 1 1
6 1213 1 1 10 ILE HA H 1.485 3.333 1.786 1.00 . A A . 10 ILE HA 1 1
6 1214 1 1 10 ILE HB H 2.550 4.020 -0.293 1.00 . A A . 10 ILE HB 1 1
6 1215 1 1 10 ILE HD11 H -0.455 5.360 -2.134 1.00 . A A . 10 ILE HD11 1 1
6 1216 1 1 10 ILE HD12 H 0.701 4.207 -2.802 1.00 . A A . 10 ILE HD12 1 1
6 1217 1 1 10 ILE HD13 H 1.275 5.618 -1.911 1.00 . A A . 10 ILE HD13 1 1
6 1218 1 1 10 ILE HG12 H -0.369 3.376 -0.772 1.00 . A A . 10 ILE HG12 1 1
6 1219 1 1 10 ILE HG13 H 0.234 4.767 0.117 1.00 . A A . 10 ILE HG13 1 1
6 1220 1 1 10 ILE HG21 H 2.159 2.859 -2.423 1.00 . A A . 10 ILE HG21 1 1
6 1221 1 1 10 ILE HG22 H 1.317 1.579 -1.555 1.00 . A A . 10 ILE HG22 1 1
6 1222 1 1 10 ILE HG23 H 3.035 1.853 -1.264 1.00 . A A . 10 ILE HG23 1 1
6 1223 1 1 10 ILE N N 2.826 1.874 1.336 1.00 . A A . 10 ILE N 1 1
6 1224 1 1 10 ILE O O 0.513 0.502 0.545 1.00 . A A . 10 ILE O 1 1
6 1225 1 1 11 ALA C C -2.967 2.041 1.239 1.00 . A A . 11 ALA C 1 1
6 1226 1 1 11 ALA CA C -1.808 1.271 1.760 1.00 . A A . 11 ALA CA 1 1
6 1227 1 1 11 ALA CB C -2.087 0.735 3.172 1.00 . A A . 11 ALA CB 1 1
6 1228 1 1 11 ALA H H -0.622 2.947 2.117 1.00 . A A . 11 ALA H 1 1
6 1229 1 1 11 ALA HA H -1.657 0.424 1.105 1.00 . A A . 11 ALA HA 1 1
6 1230 1 1 11 ALA HB1 H -2.945 0.084 3.127 1.00 . A A . 11 ALA HB1 1 1
6 1231 1 1 11 ALA HB2 H -2.316 1.503 3.889 1.00 . A A . 11 ALA HB2 1 1
6 1232 1 1 11 ALA N N -0.625 2.064 1.687 1.00 . A A . 11 ALA N 1 1
6 1233 1 1 11 ALA O O -3.052 3.256 1.411 1.00 . A A . 11 ALA O 1 1
6 1234 1 1 12 PHE C C -6.207 1.566 0.754 1.00 . A A . 12 PHE C 1 1
6 1235 1 1 12 PHE CA C -4.963 1.933 -0.039 1.00 . A A . 12 PHE CA 1 1
6 1236 1 1 12 PHE CB C -5.069 1.429 -1.483 1.00 . A A . 12 PHE CB 1 1
6 1237 1 1 12 PHE CD1 C -3.627 2.860 -2.955 1.00 . A A . 12 PHE CD1 1 1
6 1238 1 1 12 PHE CD2 C -2.885 0.654 -2.466 1.00 . A A . 12 PHE CD2 1 1
6 1239 1 1 12 PHE CE1 C -2.498 3.068 -3.726 1.00 . A A . 12 PHE CE1 1 1
6 1240 1 1 12 PHE CE2 C -1.758 0.855 -3.234 1.00 . A A . 12 PHE CE2 1 1
6 1241 1 1 12 PHE CG C -3.833 1.656 -2.318 1.00 . A A . 12 PHE CG 1 1
6 1242 1 1 12 PHE CZ C -1.563 2.063 -3.864 1.00 . A A . 12 PHE CZ 1 1
6 1243 1 1 12 PHE H H -3.716 0.377 0.555 1.00 . A A . 12 PHE H 1 1
6 1244 1 1 12 PHE HA H -4.835 3.005 -0.045 1.00 . A A . 12 PHE HA 1 1
6 1245 1 1 12 PHE HB2 H -5.262 0.366 -1.466 1.00 . A A . 12 PHE HB2 1 1
6 1246 1 1 12 PHE HB3 H -5.897 1.925 -1.967 1.00 . A A . 12 PHE HB3 1 1
6 1247 1 1 12 PHE HD1 H -4.359 3.646 -2.844 1.00 . A A . 12 PHE HD1 1 1
6 1248 1 1 12 PHE HD2 H -3.032 -0.294 -1.971 1.00 . A A . 12 PHE HD2 1 1
6 1249 1 1 12 PHE HE1 H -2.348 4.019 -4.219 1.00 . A A . 12 PHE HE1 1 1
6 1250 1 1 12 PHE HE2 H -1.027 0.066 -3.341 1.00 . A A . 12 PHE HE2 1 1
6 1251 1 1 12 PHE HZ H -0.681 2.221 -4.467 1.00 . A A . 12 PHE HZ 1 1
6 1252 1 1 12 PHE N N -3.829 1.355 0.597 1.00 . A A . 12 PHE N 1 1
6 1253 1 1 12 PHE O O -6.293 0.447 1.283 1.00 . A A . 12 PHE O 1 1
6 1254 1 1 13 PRO C C -9.320 1.130 1.179 1.00 . A A . 13 PRO C 1 1
6 1255 1 1 13 PRO CA C -8.421 2.295 1.662 1.00 . A A . 13 PRO CA 1 1
6 1256 1 1 13 PRO CB C -9.163 3.631 1.494 1.00 . A A . 13 PRO CB 1 1
6 1257 1 1 13 PRO CD C -7.127 3.846 0.289 1.00 . A A . 13 PRO CD 1 1
6 1258 1 1 13 PRO CG C -8.567 4.245 0.274 1.00 . A A . 13 PRO CG 1 1
6 1259 1 1 13 PRO HA H -8.198 2.149 2.708 1.00 . A A . 13 PRO HA 1 1
6 1260 1 1 13 PRO HB2 H -10.218 3.440 1.367 1.00 . A A . 13 PRO HB2 1 1
6 1261 1 1 13 PRO HB3 H -9.007 4.249 2.365 1.00 . A A . 13 PRO HB3 1 1
6 1262 1 1 13 PRO HD2 H -6.726 3.821 -0.712 1.00 . A A . 13 PRO HD2 1 1
6 1263 1 1 13 PRO HD3 H -6.552 4.514 0.913 1.00 . A A . 13 PRO HD3 1 1
6 1264 1 1 13 PRO HG2 H -9.056 3.859 -0.607 1.00 . A A . 13 PRO HG2 1 1
6 1265 1 1 13 PRO HG3 H -8.660 5.321 0.315 1.00 . A A . 13 PRO HG3 1 1
6 1266 1 1 13 PRO N N -7.171 2.493 0.878 1.00 . A A . 13 PRO N 1 1
6 1267 1 1 13 PRO O O -10.375 0.888 1.744 1.00 . A A . 13 PRO O 1 1
6 1268 1 1 14 ASN C C -9.073 -2.019 0.173 1.00 . A A . 14 ASN C 1 1
6 1269 1 1 14 ASN CA C -9.659 -0.715 -0.379 1.00 . A A . 14 ASN CA 1 1
6 1270 1 1 14 ASN CB C -9.630 -0.758 -1.919 1.00 . A A . 14 ASN CB 1 1
6 1271 1 1 14 ASN CG C -8.243 -1.026 -2.490 1.00 . A A . 14 ASN CG 1 1
6 1272 1 1 14 ASN H H -8.071 0.701 -0.302 1.00 . A A . 14 ASN H 1 1
6 1273 1 1 14 ASN HA H -10.682 -0.623 -0.045 1.00 . A A . 14 ASN HA 1 1
6 1274 1 1 14 ASN HB2 H -10.289 -1.545 -2.260 1.00 . A A . 14 ASN HB2 1 1
6 1275 1 1 14 ASN HB3 H -9.983 0.187 -2.304 1.00 . A A . 14 ASN HB3 1 1
6 1276 1 1 14 ASN HD21 H -9.008 -1.954 -4.057 1.00 . A A . 14 ASN HD21 1 1
6 1277 1 1 14 ASN HD22 H -7.302 -1.810 -4.024 1.00 . A A . 14 ASN HD22 1 1
6 1278 1 1 14 ASN N N -8.909 0.437 0.136 1.00 . A A . 14 ASN N 1 1
6 1279 1 1 14 ASN ND2 N -8.181 -1.659 -3.619 1.00 . A A . 14 ASN ND2 1 1
6 1280 1 1 14 ASN O O -9.575 -3.111 -0.105 1.00 . A A . 14 ASN O 1 1
6 1281 1 1 14 ASN OD1 O -7.232 -0.676 -1.893 1.00 . A A . 14 ASN OD1 1 1
6 1282 2 2 1 . C C -1.758 -2.230 3.083 1.00 . B A . 101 WMH C 1 1
6 1283 2 2 1 . C1 C -0.955 -0.057 3.728 1.00 . B A . 101 WMH C1 1 1
6 1284 2 2 1 . C2 C 0.164 0.429 4.315 1.00 . B A . 101 WMH C2 1 1
6 1285 2 2 1 . H1 H -2.417 -2.605 3.844 1.00 . B A . 101 WMH H1 1 1
6 1286 2 2 1 . H2 H -2.377 -1.614 2.452 1.00 . B A . 101 WMH H2 1 1
6 1287 2 2 1 . H5 H 0.371 1.469 4.512 1.00 . B A . 101 WMH H5 1 1
6 1288 2 2 1 . N N -0.838 -1.354 3.653 1.00 . B A . 101 WMH N 1 1
6 1289 2 2 1 . N1 N 0.961 -0.593 4.600 1.00 . B A . 101 WMH N1 1 1
6 1290 2 2 1 . N2 N 0.398 -1.688 4.221 1.00 . B A . 101 WMH N2 1 1
7 1291 1 1 1 GLY C C -6.394 -3.663 0.589 1.00 . A A . 1 GLY C 1 1
7 1292 1 1 1 GLY CA C -7.755 -3.171 1.007 1.00 . A A . 1 GLY CA 1 1
7 1293 1 1 1 GLY H1 H -7.696 -1.090 0.679 1.00 . A A . 1 GLY H1 1 1
7 1294 1 1 1 GLY HA2 H -7.763 -3.042 2.079 1.00 . A A . 1 GLY HA2 1 1
7 1295 1 1 1 GLY HA3 H -8.489 -3.917 0.743 1.00 . A A . 1 GLY HA3 1 1
7 1296 1 1 1 GLY N N -8.111 -1.927 0.371 1.00 . A A . 1 GLY N 1 1
7 1297 1 1 1 GLY O O -5.960 -4.732 1.010 1.00 . A A . 1 GLY O 1 1
7 1298 1 1 2 LYS C C -3.296 -2.559 0.018 1.00 . A A . 2 LYS C 1 1
7 1299 1 1 2 LYS CA C -4.406 -3.303 -0.709 1.00 . A A . 2 LYS CA 1 1
7 1300 1 1 2 LYS CB C -4.294 -3.102 -2.227 1.00 . A A . 2 LYS CB 1 1
7 1301 1 1 2 LYS CD C -4.941 -5.455 -2.893 1.00 . A A . 2 LYS CD 1 1
7 1302 1 1 2 LYS CE C -5.888 -6.324 -3.716 1.00 . A A . 2 LYS CE 1 1
7 1303 1 1 2 LYS CG C -5.249 -3.970 -3.052 1.00 . A A . 2 LYS CG 1 1
7 1304 1 1 2 LYS H H -6.065 -2.025 -0.498 1.00 . A A . 2 LYS H 1 1
7 1305 1 1 2 LYS HA H -4.302 -4.354 -0.492 1.00 . A A . 2 LYS HA 1 1
7 1306 1 1 2 LYS HB2 H -4.504 -2.067 -2.452 1.00 . A A . 2 LYS HB2 1 1
7 1307 1 1 2 LYS HB3 H -3.283 -3.325 -2.534 1.00 . A A . 2 LYS HB3 1 1
7 1308 1 1 2 LYS HD2 H -3.927 -5.643 -3.217 1.00 . A A . 2 LYS HD2 1 1
7 1309 1 1 2 LYS HD3 H -5.039 -5.726 -1.853 1.00 . A A . 2 LYS HD3 1 1
7 1310 1 1 2 LYS HE2 H -5.832 -6.013 -4.750 1.00 . A A . 2 LYS HE2 1 1
7 1311 1 1 2 LYS HE3 H -5.570 -7.354 -3.639 1.00 . A A . 2 LYS HE3 1 1
7 1312 1 1 2 LYS HG2 H -6.260 -3.788 -2.719 1.00 . A A . 2 LYS HG2 1 1
7 1313 1 1 2 LYS HG3 H -5.158 -3.698 -4.093 1.00 . A A . 2 LYS HG3 1 1
7 1314 1 1 2 LYS HZ1 H -7.387 -6.467 -2.259 1.00 . A A . 2 LYS HZ1 1 1
7 1315 1 1 2 LYS HZ2 H -7.882 -6.891 -3.788 1.00 . A A . 2 LYS HZ2 1 1
7 1316 1 1 2 LYS HZ3 H -7.699 -5.268 -3.407 1.00 . A A . 2 LYS HZ3 1 1
7 1317 1 1 2 LYS N N -5.710 -2.898 -0.225 1.00 . A A . 2 LYS N 1 1
7 1318 1 1 2 LYS NZ N -7.293 -6.215 -3.264 1.00 . A A . 2 LYS NZ 1 1
7 1319 1 1 2 LYS O O -3.443 -1.392 0.363 1.00 . A A . 2 LYS O 1 1
7 1320 1 1 3 ALA C C 0.192 -2.879 0.138 1.00 . A A . 3 ALA C 1 1
7 1321 1 1 3 ALA CA C -1.061 -2.686 0.933 1.00 . A A . 3 ALA CA 1 1
7 1322 1 1 3 ALA CB C -0.915 -3.254 2.355 1.00 . A A . 3 ALA CB 1 1
7 1323 1 1 3 ALA H H -2.165 -4.185 -0.018 1.00 . A A . 3 ALA H 1 1
7 1324 1 1 3 ALA HA H -1.231 -1.623 1.014 1.00 . A A . 3 ALA HA 1 1
7 1325 1 1 3 ALA HB1 H 0.134 -3.292 2.610 1.00 . A A . 3 ALA HB1 1 1
7 1326 1 1 3 ALA HB2 H -1.320 -4.255 2.375 1.00 . A A . 3 ALA HB2 1 1
7 1327 1 1 3 ALA N N -2.216 -3.244 0.263 1.00 . A A . 3 ALA N 1 1
7 1328 1 1 3 ALA O O 0.463 -3.970 -0.376 1.00 . A A . 3 ALA O 1 1
7 1329 1 1 4 LEU C C 3.310 -1.942 0.325 1.00 . A A . 4 LEU C 1 1
7 1330 1 1 4 LEU CA C 2.196 -1.865 -0.676 1.00 . A A . 4 LEU CA 1 1
7 1331 1 1 4 LEU CB C 2.381 -0.638 -1.554 1.00 . A A . 4 LEU CB 1 1
7 1332 1 1 4 LEU CD1 C 3.723 -1.673 -3.420 1.00 . A A . 4 LEU CD1 1 1
7 1333 1 1 4 LEU CD2 C 3.867 0.788 -2.986 1.00 . A A . 4 LEU CD2 1 1
7 1334 1 1 4 LEU CG C 3.682 -0.580 -2.362 1.00 . A A . 4 LEU CG 1 1
7 1335 1 1 4 LEU H H 0.692 -0.966 0.435 1.00 . A A . 4 LEU H 1 1
7 1336 1 1 4 LEU HA H 2.203 -2.749 -1.296 1.00 . A A . 4 LEU HA 1 1
7 1337 1 1 4 LEU HB2 H 1.553 -0.609 -2.243 1.00 . A A . 4 LEU HB2 1 1
7 1338 1 1 4 LEU HB3 H 2.342 0.226 -0.909 1.00 . A A . 4 LEU HB3 1 1
7 1339 1 1 4 LEU HD11 H 2.883 -1.561 -4.090 1.00 . A A . 4 LEU HD11 1 1
7 1340 1 1 4 LEU HD12 H 3.682 -2.642 -2.946 1.00 . A A . 4 LEU HD12 1 1
7 1341 1 1 4 LEU HD13 H 4.642 -1.590 -3.983 1.00 . A A . 4 LEU HD13 1 1
7 1342 1 1 4 LEU HD21 H 4.788 0.804 -3.548 1.00 . A A . 4 LEU HD21 1 1
7 1343 1 1 4 LEU HD22 H 3.906 1.537 -2.209 1.00 . A A . 4 LEU HD22 1 1
7 1344 1 1 4 LEU HD23 H 3.038 0.998 -3.646 1.00 . A A . 4 LEU HD23 1 1
7 1345 1 1 4 LEU HG H 4.504 -0.756 -1.686 1.00 . A A . 4 LEU HG 1 1
7 1346 1 1 4 LEU N N 0.953 -1.821 0.022 1.00 . A A . 4 LEU N 1 1
7 1347 1 1 4 LEU O O 3.631 -0.957 1.007 1.00 . A A . 4 LEU O 1 1
7 1348 1 1 5 PHE C C 6.232 -3.203 0.546 1.00 . A A . 5 PHE C 1 1
7 1349 1 1 5 PHE CA C 4.948 -3.289 1.353 1.00 . A A . 5 PHE CA 1 1
7 1350 1 1 5 PHE CB C 4.821 -4.619 2.105 1.00 . A A . 5 PHE CB 1 1
7 1351 1 1 5 PHE CD1 C 5.184 -4.276 4.561 1.00 . A A . 5 PHE CD1 1 1
7 1352 1 1 5 PHE CD2 C 6.960 -5.210 3.286 1.00 . A A . 5 PHE CD2 1 1
7 1353 1 1 5 PHE CE1 C 5.953 -4.351 5.701 1.00 . A A . 5 PHE CE1 1 1
7 1354 1 1 5 PHE CE2 C 7.736 -5.287 4.424 1.00 . A A . 5 PHE CE2 1 1
7 1355 1 1 5 PHE CG C 5.677 -4.706 3.339 1.00 . A A . 5 PHE CG 1 1
7 1356 1 1 5 PHE CZ C 7.233 -4.858 5.633 1.00 . A A . 5 PHE CZ 1 1
7 1357 1 1 5 PHE H H 3.519 -3.822 -0.105 1.00 . A A . 5 PHE H 1 1
7 1358 1 1 5 PHE HA H 4.934 -2.467 2.054 1.00 . A A . 5 PHE HA 1 1
7 1359 1 1 5 PHE HB2 H 3.794 -4.761 2.402 1.00 . A A . 5 PHE HB2 1 1
7 1360 1 1 5 PHE HB3 H 5.112 -5.421 1.440 1.00 . A A . 5 PHE HB3 1 1
7 1361 1 1 5 PHE HD1 H 4.181 -3.879 4.621 1.00 . A A . 5 PHE HD1 1 1
7 1362 1 1 5 PHE HD2 H 7.352 -5.546 2.340 1.00 . A A . 5 PHE HD2 1 1
7 1363 1 1 5 PHE HE1 H 5.556 -4.011 6.646 1.00 . A A . 5 PHE HE1 1 1
7 1364 1 1 5 PHE HE2 H 8.739 -5.683 4.372 1.00 . A A . 5 PHE HE2 1 1
7 1365 1 1 5 PHE HZ H 7.839 -4.917 6.526 1.00 . A A . 5 PHE HZ 1 1
7 1366 1 1 5 PHE N N 3.862 -3.094 0.453 1.00 . A A . 5 PHE N 1 1
7 1367 1 1 5 PHE O O 6.761 -4.203 0.039 1.00 . A A . 5 PHE O 1 1
7 1368 1 1 6 SER C C 8.121 -0.215 0.029 1.00 . A A . 6 SER C 1 1
7 1369 1 1 6 SER CA C 7.786 -1.616 -0.440 1.00 . A A . 6 SER CA 1 1
7 1370 1 1 6 SER CB C 7.446 -1.611 -1.949 1.00 . A A . 6 SER CB 1 1
7 1371 1 1 6 SER H H 6.122 -1.249 0.721 1.00 . A A . 6 SER H 1 1
7 1372 1 1 6 SER HA H 8.598 -2.296 -0.227 1.00 . A A . 6 SER HA 1 1
7 1373 1 1 6 SER HB2 H 6.646 -0.913 -2.135 1.00 . A A . 6 SER HB2 1 1
7 1374 1 1 6 SER HB3 H 8.319 -1.307 -2.506 1.00 . A A . 6 SER HB3 1 1
7 1375 1 1 6 SER HG H 6.939 -3.448 -1.614 1.00 . A A . 6 SER HG 1 1
7 1376 1 1 6 SER N N 6.626 -1.994 0.322 1.00 . A A . 6 SER N 1 1
7 1377 1 1 6 SER O O 7.596 0.201 1.058 1.00 . A A . 6 SER O 1 1
7 1378 1 1 6 SER OG O 7.041 -2.904 -2.409 1.00 . A A . 6 SER OG 1 1
7 1379 1 1 7 ASN C C 8.591 2.835 -1.265 1.00 . A A . 7 ASN C 1 1
7 1380 1 1 7 ASN CA C 9.243 1.874 -0.267 1.00 . A A . 7 ASN CA 1 1
7 1381 1 1 7 ASN CB C 10.765 2.161 -0.098 1.00 . A A . 7 ASN CB 1 1
7 1382 1 1 7 ASN CG C 11.580 2.134 -1.388 1.00 . A A . 7 ASN CG 1 1
7 1383 1 1 7 ASN H H 9.416 0.128 -1.455 1.00 . A A . 7 ASN H 1 1
7 1384 1 1 7 ASN HA H 8.748 1.992 0.686 1.00 . A A . 7 ASN HA 1 1
7 1385 1 1 7 ASN HB2 H 10.884 3.144 0.330 1.00 . A A . 7 ASN HB2 1 1
7 1386 1 1 7 ASN HB3 H 11.181 1.437 0.587 1.00 . A A . 7 ASN HB3 1 1
7 1387 1 1 7 ASN HD21 H 11.904 0.209 -1.180 1.00 . A A . 7 ASN HD21 1 1
7 1388 1 1 7 ASN HD22 H 12.604 0.940 -2.581 1.00 . A A . 7 ASN HD22 1 1
7 1389 1 1 7 ASN N N 8.970 0.502 -0.664 1.00 . A A . 7 ASN N 1 1
7 1390 1 1 7 ASN ND2 N 12.078 0.985 -1.754 1.00 . A A . 7 ASN ND2 1 1
7 1391 1 1 7 ASN O O 8.793 2.703 -2.476 1.00 . A A . 7 ASN O 1 1
7 1392 1 1 7 ASN OD1 O 11.764 3.151 -2.036 1.00 . A A . 7 ASN OD1 1 1
7 1393 1 1 8 PRO C C 6.267 3.004 1.040 1.00 . A A . 8 PRO C 1 1
7 1394 1 1 8 PRO CA C 7.415 3.935 0.611 1.00 . A A . 8 PRO CA 1 1
7 1395 1 1 8 PRO CB C 6.956 5.395 0.670 1.00 . A A . 8 PRO CB 1 1
7 1396 1 1 8 PRO CD C 7.024 4.732 -1.648 1.00 . A A . 8 PRO CD 1 1
7 1397 1 1 8 PRO CG C 6.347 5.660 -0.665 1.00 . A A . 8 PRO CG 1 1
7 1398 1 1 8 PRO HA H 8.272 3.796 1.257 1.00 . A A . 8 PRO HA 1 1
7 1399 1 1 8 PRO HB2 H 6.233 5.511 1.465 1.00 . A A . 8 PRO HB2 1 1
7 1400 1 1 8 PRO HB3 H 7.803 6.039 0.851 1.00 . A A . 8 PRO HB3 1 1
7 1401 1 1 8 PRO HD2 H 6.288 4.225 -2.255 1.00 . A A . 8 PRO HD2 1 1
7 1402 1 1 8 PRO HD3 H 7.707 5.281 -2.276 1.00 . A A . 8 PRO HD3 1 1
7 1403 1 1 8 PRO HG2 H 5.288 5.453 -0.631 1.00 . A A . 8 PRO HG2 1 1
7 1404 1 1 8 PRO HG3 H 6.515 6.688 -0.946 1.00 . A A . 8 PRO HG3 1 1
7 1405 1 1 8 PRO N N 7.750 3.767 -0.801 1.00 . A A . 8 PRO N 1 1
7 1406 1 1 8 PRO O O 5.417 2.633 0.215 1.00 . A A . 8 PRO O 1 1
7 1407 1 1 9 PRO C C 3.878 2.562 2.889 1.00 . A A . 9 PRO C 1 1
7 1408 1 1 9 PRO CA C 5.164 1.749 2.815 1.00 . A A . 9 PRO CA 1 1
7 1409 1 1 9 PRO CB C 5.631 1.314 4.209 1.00 . A A . 9 PRO CB 1 1
7 1410 1 1 9 PRO CD C 7.286 2.817 3.326 1.00 . A A . 9 PRO CD 1 1
7 1411 1 1 9 PRO CG C 6.678 2.299 4.599 1.00 . A A . 9 PRO CG 1 1
7 1412 1 1 9 PRO HA H 5.003 0.889 2.181 1.00 . A A . 9 PRO HA 1 1
7 1413 1 1 9 PRO HB2 H 4.795 1.336 4.891 1.00 . A A . 9 PRO HB2 1 1
7 1414 1 1 9 PRO HB3 H 6.031 0.312 4.160 1.00 . A A . 9 PRO HB3 1 1
7 1415 1 1 9 PRO HD2 H 7.494 3.874 3.410 1.00 . A A . 9 PRO HD2 1 1
7 1416 1 1 9 PRO HD3 H 8.189 2.273 3.089 1.00 . A A . 9 PRO HD3 1 1
7 1417 1 1 9 PRO HG2 H 6.223 3.108 5.150 1.00 . A A . 9 PRO HG2 1 1
7 1418 1 1 9 PRO HG3 H 7.429 1.813 5.205 1.00 . A A . 9 PRO HG3 1 1
7 1419 1 1 9 PRO N N 6.247 2.571 2.312 1.00 . A A . 9 PRO N 1 1
7 1420 1 1 9 PRO O O 3.797 3.579 3.610 1.00 . A A . 9 PRO O 1 1
7 1421 1 1 10 ILE C C 0.538 1.818 1.812 1.00 . A A . 10 ILE C 1 1
7 1422 1 1 10 ILE CA C 1.651 2.838 2.033 1.00 . A A . 10 ILE CA 1 1
7 1423 1 1 10 ILE CB C 1.667 3.921 0.892 1.00 . A A . 10 ILE CB 1 1
7 1424 1 1 10 ILE CD1 C 0.278 5.753 -0.262 1.00 . A A . 10 ILE CD1 1 1
7 1425 1 1 10 ILE CG1 C 0.313 4.648 0.781 1.00 . A A . 10 ILE CG1 1 1
7 1426 1 1 10 ILE CG2 C 2.085 3.314 -0.453 1.00 . A A . 10 ILE CG2 1 1
7 1427 1 1 10 ILE H H 3.035 1.351 1.567 1.00 . A A . 10 ILE H 1 1
7 1428 1 1 10 ILE HA H 1.483 3.331 2.979 1.00 . A A . 10 ILE HA 1 1
7 1429 1 1 10 ILE HB H 2.428 4.641 1.157 1.00 . A A . 10 ILE HB 1 1
7 1430 1 1 10 ILE HD11 H -0.705 6.200 -0.279 1.00 . A A . 10 ILE HD11 1 1
7 1431 1 1 10 ILE HD12 H 0.499 5.336 -1.234 1.00 . A A . 10 ILE HD12 1 1
7 1432 1 1 10 ILE HD13 H 1.012 6.505 -0.015 1.00 . A A . 10 ILE HD13 1 1
7 1433 1 1 10 ILE HG12 H -0.451 3.930 0.520 1.00 . A A . 10 ILE HG12 1 1
7 1434 1 1 10 ILE HG13 H 0.070 5.084 1.738 1.00 . A A . 10 ILE HG13 1 1
7 1435 1 1 10 ILE HG21 H 2.088 4.084 -1.210 1.00 . A A . 10 ILE HG21 1 1
7 1436 1 1 10 ILE HG22 H 1.386 2.540 -0.729 1.00 . A A . 10 ILE HG22 1 1
7 1437 1 1 10 ILE HG23 H 3.075 2.891 -0.363 1.00 . A A . 10 ILE HG23 1 1
7 1438 1 1 10 ILE N N 2.911 2.155 2.116 1.00 . A A . 10 ILE N 1 1
7 1439 1 1 10 ILE O O 0.727 0.811 1.102 1.00 . A A . 10 ILE O 1 1
7 1440 1 1 11 ALA C C -2.840 1.914 1.736 1.00 . A A . 11 ALA C 1 1
7 1441 1 1 11 ALA CA C -1.697 1.154 2.326 1.00 . A A . 11 ALA CA 1 1
7 1442 1 1 11 ALA CB C -2.079 0.500 3.653 1.00 . A A . 11 ALA CB 1 1
7 1443 1 1 11 ALA H H -0.678 2.814 3.038 1.00 . A A . 11 ALA H 1 1
7 1444 1 1 11 ALA HA H -1.419 0.373 1.630 1.00 . A A . 11 ALA HA 1 1
7 1445 1 1 11 ALA HB1 H -2.903 -0.177 3.488 1.00 . A A . 11 ALA HB1 1 1
7 1446 1 1 11 ALA HB2 H -2.395 1.199 4.403 1.00 . A A . 11 ALA HB2 1 1
7 1447 1 1 11 ALA N N -0.577 2.026 2.459 1.00 . A A . 11 ALA N 1 1
7 1448 1 1 11 ALA O O -2.930 3.132 1.895 1.00 . A A . 11 ALA O 1 1
7 1449 1 1 12 PHE C C -6.087 1.420 0.865 1.00 . A A . 12 PHE C 1 1
7 1450 1 1 12 PHE CA C -4.740 1.874 0.330 1.00 . A A . 12 PHE CA 1 1
7 1451 1 1 12 PHE CB C -4.603 1.577 -1.171 1.00 . A A . 12 PHE CB 1 1
7 1452 1 1 12 PHE CD1 C -2.958 3.236 -2.098 1.00 . A A . 12 PHE CD1 1 1
7 1453 1 1 12 PHE CD2 C -2.258 0.970 -1.849 1.00 . A A . 12 PHE CD2 1 1
7 1454 1 1 12 PHE CE1 C -1.710 3.567 -2.587 1.00 . A A . 12 PHE CE1 1 1
7 1455 1 1 12 PHE CE2 C -1.011 1.297 -2.340 1.00 . A A . 12 PHE CE2 1 1
7 1456 1 1 12 PHE CG C -3.248 1.937 -1.723 1.00 . A A . 12 PHE CG 1 1
7 1457 1 1 12 PHE CZ C -0.739 2.597 -2.710 1.00 . A A . 12 PHE CZ 1 1
7 1458 1 1 12 PHE H H -3.627 0.249 1.004 1.00 . A A . 12 PHE H 1 1
7 1459 1 1 12 PHE HA H -4.618 2.934 0.481 1.00 . A A . 12 PHE HA 1 1
7 1460 1 1 12 PHE HB2 H -4.765 0.523 -1.341 1.00 . A A . 12 PHE HB2 1 1
7 1461 1 1 12 PHE HB3 H -5.346 2.142 -1.713 1.00 . A A . 12 PHE HB3 1 1
7 1462 1 1 12 PHE HD1 H -3.718 3.998 -2.004 1.00 . A A . 12 PHE HD1 1 1
7 1463 1 1 12 PHE HD2 H -2.477 -0.047 -1.558 1.00 . A A . 12 PHE HD2 1 1
7 1464 1 1 12 PHE HE1 H -1.497 4.586 -2.876 1.00 . A A . 12 PHE HE1 1 1
7 1465 1 1 12 PHE HE2 H -0.253 0.535 -2.434 1.00 . A A . 12 PHE HE2 1 1
7 1466 1 1 12 PHE HZ H 0.236 2.865 -3.092 1.00 . A A . 12 PHE HZ 1 1
7 1467 1 1 12 PHE N N -3.685 1.232 1.046 1.00 . A A . 12 PHE N 1 1
7 1468 1 1 12 PHE O O -6.254 0.242 1.215 1.00 . A A . 12 PHE O 1 1
7 1469 1 1 13 PRO C C -9.222 1.001 0.703 1.00 . A A . 13 PRO C 1 1
7 1470 1 1 13 PRO CA C -8.426 2.067 1.491 1.00 . A A . 13 PRO CA 1 1
7 1471 1 1 13 PRO CB C -9.139 3.418 1.393 1.00 . A A . 13 PRO CB 1 1
7 1472 1 1 13 PRO CD C -6.927 3.778 0.598 1.00 . A A . 13 PRO CD 1 1
7 1473 1 1 13 PRO CG C -8.053 4.428 1.337 1.00 . A A . 13 PRO CG 1 1
7 1474 1 1 13 PRO HA H -8.376 1.771 2.528 1.00 . A A . 13 PRO HA 1 1
7 1475 1 1 13 PRO HB2 H -9.738 3.436 0.494 1.00 . A A . 13 PRO HB2 1 1
7 1476 1 1 13 PRO HB3 H -9.771 3.565 2.256 1.00 . A A . 13 PRO HB3 1 1
7 1477 1 1 13 PRO HD2 H -7.028 3.934 -0.465 1.00 . A A . 13 PRO HD2 1 1
7 1478 1 1 13 PRO HD3 H -5.993 4.182 0.958 1.00 . A A . 13 PRO HD3 1 1
7 1479 1 1 13 PRO HG2 H -8.394 5.305 0.809 1.00 . A A . 13 PRO HG2 1 1
7 1480 1 1 13 PRO HG3 H -7.744 4.688 2.338 1.00 . A A . 13 PRO HG3 1 1
7 1481 1 1 13 PRO N N -7.068 2.348 0.960 1.00 . A A . 13 PRO N 1 1
7 1482 1 1 13 PRO O O -10.337 0.636 1.091 1.00 . A A . 13 PRO O 1 1
7 1483 1 1 14 ASN C C -8.989 -1.896 -0.615 1.00 . A A . 14 ASN C 1 1
7 1484 1 1 14 ASN CA C -9.321 -0.523 -1.181 1.00 . A A . 14 ASN CA 1 1
7 1485 1 1 14 ASN CB C -8.920 -0.463 -2.673 1.00 . A A . 14 ASN CB 1 1
7 1486 1 1 14 ASN CG C -7.460 -0.815 -2.947 1.00 . A A . 14 ASN CG 1 1
7 1487 1 1 14 ASN H H -7.819 0.903 -0.699 1.00 . A A . 14 ASN H 1 1
7 1488 1 1 14 ASN HA H -10.387 -0.373 -1.100 1.00 . A A . 14 ASN HA 1 1
7 1489 1 1 14 ASN HB2 H -9.524 -1.174 -3.213 1.00 . A A . 14 ASN HB2 1 1
7 1490 1 1 14 ASN HB3 H -9.120 0.523 -3.062 1.00 . A A . 14 ASN HB3 1 1
7 1491 1 1 14 ASN HD21 H -7.919 -1.396 -4.782 1.00 . A A . 14 ASN HD21 1 1
7 1492 1 1 14 ASN HD22 H -6.256 -1.498 -4.352 1.00 . A A . 14 ASN HD22 1 1
7 1493 1 1 14 ASN N N -8.674 0.526 -0.395 1.00 . A A . 14 ASN N 1 1
7 1494 1 1 14 ASN ND2 N -7.187 -1.289 -4.137 1.00 . A A . 14 ASN ND2 1 1
7 1495 1 1 14 ASN O O -9.511 -2.911 -1.078 1.00 . A A . 14 ASN O 1 1
7 1496 1 1 14 ASN OD1 O -6.586 -0.643 -2.100 1.00 . A A . 14 ASN OD1 1 1
7 1497 2 2 1 . C C -1.629 -2.425 3.397 1.00 . B A . 101 WMH C 1 1
7 1498 2 2 1 . C1 C -0.967 -0.287 4.260 1.00 . B A . 101 WMH C1 1 1
7 1499 2 2 1 . C2 C 0.071 0.198 4.990 1.00 . B A . 101 WMH C2 1 1
7 1500 2 2 1 . H1 H -2.300 -2.908 4.080 1.00 . B A . 101 WMH H1 1 1
7 1501 2 2 1 . H2 H -2.259 -1.779 2.810 1.00 . B A . 101 WMH H2 1 1
7 1502 2 2 1 . H5 H 0.209 1.227 5.285 1.00 . B A . 101 WMH H5 1 1
7 1503 2 2 1 . N N -0.785 -1.567 4.102 1.00 . B A . 101 WMH N 1 1
7 1504 2 2 1 . N1 N 0.883 -0.811 5.277 1.00 . B A . 101 WMH N1 1 1
7 1505 2 2 1 . N2 N 0.411 -1.900 4.764 1.00 . B A . 101 WMH N2 1 1
8 1506 1 1 1 GLY C C -5.972 -3.408 0.789 1.00 . A A . 1 GLY C 1 1
8 1507 1 1 1 GLY CA C -7.287 -3.048 1.439 1.00 . A A . 1 GLY CA 1 1
8 1508 1 1 1 GLY H1 H -7.436 -1.024 0.873 1.00 . A A . 1 GLY H1 1 1
8 1509 1 1 1 GLY HA2 H -7.119 -2.855 2.488 1.00 . A A . 1 GLY HA2 1 1
8 1510 1 1 1 GLY HA3 H -7.965 -3.883 1.346 1.00 . A A . 1 GLY HA3 1 1
8 1511 1 1 1 GLY N N -7.903 -1.889 0.842 1.00 . A A . 1 GLY N 1 1
8 1512 1 1 1 GLY O O -5.234 -4.268 1.290 1.00 . A A . 1 GLY O 1 1
8 1513 1 1 2 LYS C C -3.250 -2.378 -0.325 1.00 . A A . 2 LYS C 1 1
8 1514 1 1 2 LYS CA C -4.439 -3.012 -1.055 1.00 . A A . 2 LYS CA 1 1
8 1515 1 1 2 LYS CB C -4.566 -2.452 -2.480 1.00 . A A . 2 LYS CB 1 1
8 1516 1 1 2 LYS CD C -2.904 -3.993 -3.591 1.00 . A A . 2 LYS CD 1 1
8 1517 1 1 2 LYS CE C -1.695 -4.066 -4.508 1.00 . A A . 2 LYS CE 1 1
8 1518 1 1 2 LYS CG C -3.314 -2.556 -3.343 1.00 . A A . 2 LYS CG 1 1
8 1519 1 1 2 LYS H H -6.305 -2.100 -0.669 1.00 . A A . 2 LYS H 1 1
8 1520 1 1 2 LYS HA H -4.293 -4.080 -1.109 1.00 . A A . 2 LYS HA 1 1
8 1521 1 1 2 LYS HB2 H -5.355 -2.986 -2.987 1.00 . A A . 2 LYS HB2 1 1
8 1522 1 1 2 LYS HB3 H -4.849 -1.412 -2.419 1.00 . A A . 2 LYS HB3 1 1
8 1523 1 1 2 LYS HD2 H -2.654 -4.453 -2.646 1.00 . A A . 2 LYS HD2 1 1
8 1524 1 1 2 LYS HD3 H -3.727 -4.524 -4.046 1.00 . A A . 2 LYS HD3 1 1
8 1525 1 1 2 LYS HE2 H -0.876 -3.537 -4.043 1.00 . A A . 2 LYS HE2 1 1
8 1526 1 1 2 LYS HE3 H -1.420 -5.100 -4.641 1.00 . A A . 2 LYS HE3 1 1
8 1527 1 1 2 LYS HG2 H -3.506 -2.082 -4.293 1.00 . A A . 2 LYS HG2 1 1
8 1528 1 1 2 LYS HG3 H -2.508 -2.039 -2.843 1.00 . A A . 2 LYS HG3 1 1
8 1529 1 1 2 LYS HZ1 H -2.769 -3.924 -6.300 1.00 . A A . 2 LYS HZ1 1 1
8 1530 1 1 2 LYS HZ2 H -1.144 -3.542 -6.460 1.00 . A A . 2 LYS HZ2 1 1
8 1531 1 1 2 LYS HZ3 H -2.189 -2.445 -5.744 1.00 . A A . 2 LYS HZ3 1 1
8 1532 1 1 2 LYS N N -5.675 -2.767 -0.323 1.00 . A A . 2 LYS N 1 1
8 1533 1 1 2 LYS NZ N -1.966 -3.459 -5.829 1.00 . A A . 2 LYS NZ 1 1
8 1534 1 1 2 LYS O O -3.263 -1.194 -0.016 1.00 . A A . 2 LYS O 1 1
8 1535 1 1 3 ALA C C 0.209 -3.036 -0.083 1.00 . A A . 3 ALA C 1 1
8 1536 1 1 3 ALA CA C -1.063 -2.686 0.639 1.00 . A A . 3 ALA CA 1 1
8 1537 1 1 3 ALA CB C -1.048 -3.181 2.090 1.00 . A A . 3 ALA CB 1 1
8 1538 1 1 3 ALA H H -2.274 -4.110 -0.314 1.00 . A A . 3 ALA H 1 1
8 1539 1 1 3 ALA HA H -1.131 -1.610 0.659 1.00 . A A . 3 ALA HA 1 1
8 1540 1 1 3 ALA HB1 H -0.023 -3.319 2.403 1.00 . A A . 3 ALA HB1 1 1
8 1541 1 1 3 ALA HB2 H -1.563 -4.129 2.141 1.00 . A A . 3 ALA HB2 1 1
8 1542 1 1 3 ALA N N -2.245 -3.163 -0.050 1.00 . A A . 3 ALA N 1 1
8 1543 1 1 3 ALA O O 0.396 -4.168 -0.534 1.00 . A A . 3 ALA O 1 1
8 1544 1 1 4 LEU C C 3.408 -2.173 0.242 1.00 . A A . 4 LEU C 1 1
8 1545 1 1 4 LEU CA C 2.361 -2.242 -0.822 1.00 . A A . 4 LEU CA 1 1
8 1546 1 1 4 LEU CB C 2.659 -1.165 -1.875 1.00 . A A . 4 LEU CB 1 1
8 1547 1 1 4 LEU CD1 C 2.146 0.030 -4.006 1.00 . A A . 4 LEU CD1 1 1
8 1548 1 1 4 LEU CD2 C 1.695 -2.424 -3.823 1.00 . A A . 4 LEU CD2 1 1
8 1549 1 1 4 LEU CG C 1.727 -1.097 -3.078 1.00 . A A . 4 LEU CG 1 1
8 1550 1 1 4 LEU H H 0.849 -1.152 0.106 1.00 . A A . 4 LEU H 1 1
8 1551 1 1 4 LEU HA H 2.384 -3.212 -1.295 1.00 . A A . 4 LEU HA 1 1
8 1552 1 1 4 LEU HB2 H 2.632 -0.204 -1.381 1.00 . A A . 4 LEU HB2 1 1
8 1553 1 1 4 LEU HB3 H 3.664 -1.326 -2.237 1.00 . A A . 4 LEU HB3 1 1
8 1554 1 1 4 LEU HD11 H 3.163 -0.132 -4.327 1.00 . A A . 4 LEU HD11 1 1
8 1555 1 1 4 LEU HD12 H 2.079 0.973 -3.484 1.00 . A A . 4 LEU HD12 1 1
8 1556 1 1 4 LEU HD13 H 1.495 0.050 -4.867 1.00 . A A . 4 LEU HD13 1 1
8 1557 1 1 4 LEU HD21 H 1.321 -3.198 -3.170 1.00 . A A . 4 LEU HD21 1 1
8 1558 1 1 4 LEU HD22 H 2.693 -2.679 -4.146 1.00 . A A . 4 LEU HD22 1 1
8 1559 1 1 4 LEU HD23 H 1.051 -2.338 -4.686 1.00 . A A . 4 LEU HD23 1 1
8 1560 1 1 4 LEU HG H 0.735 -0.881 -2.713 1.00 . A A . 4 LEU HG 1 1
8 1561 1 1 4 LEU N N 1.071 -2.055 -0.216 1.00 . A A . 4 LEU N 1 1
8 1562 1 1 4 LEU O O 3.654 -1.107 0.810 1.00 . A A . 4 LEU O 1 1
8 1563 1 1 5 PHE C C 6.349 -3.045 0.762 1.00 . A A . 5 PHE C 1 1
8 1564 1 1 5 PHE CA C 5.064 -3.306 1.501 1.00 . A A . 5 PHE CA 1 1
8 1565 1 1 5 PHE CB C 5.095 -4.613 2.290 1.00 . A A . 5 PHE CB 1 1
8 1566 1 1 5 PHE CD1 C 3.713 -4.279 4.350 1.00 . A A . 5 PHE CD1 1 1
8 1567 1 1 5 PHE CD2 C 2.810 -5.612 2.598 1.00 . A A . 5 PHE CD2 1 1
8 1568 1 1 5 PHE CE1 C 2.570 -4.479 5.094 1.00 . A A . 5 PHE CE1 1 1
8 1569 1 1 5 PHE CE2 C 1.666 -5.817 3.337 1.00 . A A . 5 PHE CE2 1 1
8 1570 1 1 5 PHE CG C 3.847 -4.842 3.097 1.00 . A A . 5 PHE CG 1 1
8 1571 1 1 5 PHE CZ C 1.546 -5.248 4.588 1.00 . A A . 5 PHE CZ 1 1
8 1572 1 1 5 PHE H H 3.713 -4.115 0.112 1.00 . A A . 5 PHE H 1 1
8 1573 1 1 5 PHE HA H 4.898 -2.478 2.176 1.00 . A A . 5 PHE HA 1 1
8 1574 1 1 5 PHE HB2 H 5.202 -5.438 1.602 1.00 . A A . 5 PHE HB2 1 1
8 1575 1 1 5 PHE HB3 H 5.935 -4.598 2.967 1.00 . A A . 5 PHE HB3 1 1
8 1576 1 1 5 PHE HD1 H 4.513 -3.674 4.751 1.00 . A A . 5 PHE HD1 1 1
8 1577 1 1 5 PHE HD2 H 2.902 -6.059 1.620 1.00 . A A . 5 PHE HD2 1 1
8 1578 1 1 5 PHE HE1 H 2.480 -4.033 6.074 1.00 . A A . 5 PHE HE1 1 1
8 1579 1 1 5 PHE HE2 H 0.864 -6.419 2.937 1.00 . A A . 5 PHE HE2 1 1
8 1580 1 1 5 PHE HZ H 0.651 -5.404 5.171 1.00 . A A . 5 PHE HZ 1 1
8 1581 1 1 5 PHE N N 3.995 -3.284 0.552 1.00 . A A . 5 PHE N 1 1
8 1582 1 1 5 PHE O O 7.086 -3.957 0.376 1.00 . A A . 5 PHE O 1 1
8 1583 1 1 6 SER C C 8.199 -0.072 0.382 1.00 . A A . 6 SER C 1 1
8 1584 1 1 6 SER CA C 7.609 -1.308 -0.305 1.00 . A A . 6 SER CA 1 1
8 1585 1 1 6 SER CB C 7.012 -0.971 -1.680 1.00 . A A . 6 SER CB 1 1
8 1586 1 1 6 SER H H 5.912 -1.138 0.846 1.00 . A A . 6 SER H 1 1
8 1587 1 1 6 SER HA H 8.353 -2.079 -0.418 1.00 . A A . 6 SER HA 1 1
8 1588 1 1 6 SER HB2 H 6.196 -0.272 -1.553 1.00 . A A . 6 SER HB2 1 1
8 1589 1 1 6 SER HB3 H 7.764 -0.552 -2.326 1.00 . A A . 6 SER HB3 1 1
8 1590 1 1 6 SER HG H 6.624 -2.069 -3.241 1.00 . A A . 6 SER HG 1 1
8 1591 1 1 6 SER N N 6.544 -1.796 0.492 1.00 . A A . 6 SER N 1 1
8 1592 1 1 6 SER O O 8.047 0.076 1.598 1.00 . A A . 6 SER O 1 1
8 1593 1 1 6 SER OG O 6.469 -2.131 -2.294 1.00 . A A . 6 SER OG 1 1
8 1594 1 1 7 ASN C C 8.906 3.192 -0.583 1.00 . A A . 7 ASN C 1 1
8 1595 1 1 7 ASN CA C 9.417 2.009 0.219 1.00 . A A . 7 ASN CA 1 1
8 1596 1 1 7 ASN CB C 10.957 2.006 0.220 1.00 . A A . 7 ASN CB 1 1
8 1597 1 1 7 ASN CG C 11.567 3.303 0.759 1.00 . A A . 7 ASN CG 1 1
8 1598 1 1 7 ASN H H 9.033 0.615 -1.306 1.00 . A A . 7 ASN H 1 1
8 1599 1 1 7 ASN HA H 9.059 2.063 1.234 1.00 . A A . 7 ASN HA 1 1
8 1600 1 1 7 ASN HB2 H 11.315 1.189 0.829 1.00 . A A . 7 ASN HB2 1 1
8 1601 1 1 7 ASN HB3 H 11.300 1.868 -0.794 1.00 . A A . 7 ASN HB3 1 1
8 1602 1 1 7 ASN HD21 H 11.586 2.586 2.607 1.00 . A A . 7 ASN HD21 1 1
8 1603 1 1 7 ASN HD22 H 12.181 4.193 2.403 1.00 . A A . 7 ASN HD22 1 1
8 1604 1 1 7 ASN N N 8.882 0.780 -0.350 1.00 . A A . 7 ASN N 1 1
8 1605 1 1 7 ASN ND2 N 11.802 3.363 2.045 1.00 . A A . 7 ASN ND2 1 1
8 1606 1 1 7 ASN O O 9.333 3.389 -1.720 1.00 . A A . 7 ASN O 1 1
8 1607 1 1 7 ASN OD1 O 11.832 4.240 0.013 1.00 . A A . 7 ASN OD1 1 1
8 1608 1 1 8 PRO C C 6.192 2.739 1.195 1.00 . A A . 8 PRO C 1 1
8 1609 1 1 8 PRO CA C 7.340 3.761 1.259 1.00 . A A . 8 PRO CA 1 1
8 1610 1 1 8 PRO CB C 6.781 5.149 1.582 1.00 . A A . 8 PRO CB 1 1
8 1611 1 1 8 PRO CD C 7.376 5.151 -0.736 1.00 . A A . 8 PRO CD 1 1
8 1612 1 1 8 PRO CG C 6.389 5.703 0.259 1.00 . A A . 8 PRO CG 1 1
8 1613 1 1 8 PRO HA H 8.057 3.473 2.013 1.00 . A A . 8 PRO HA 1 1
8 1614 1 1 8 PRO HB2 H 5.933 5.054 2.244 1.00 . A A . 8 PRO HB2 1 1
8 1615 1 1 8 PRO HB3 H 7.548 5.750 2.051 1.00 . A A . 8 PRO HB3 1 1
8 1616 1 1 8 PRO HD2 H 6.872 4.854 -1.644 1.00 . A A . 8 PRO HD2 1 1
8 1617 1 1 8 PRO HD3 H 8.143 5.878 -0.953 1.00 . A A . 8 PRO HD3 1 1
8 1618 1 1 8 PRO HG2 H 5.389 5.382 0.012 1.00 . A A . 8 PRO HG2 1 1
8 1619 1 1 8 PRO HG3 H 6.441 6.782 0.277 1.00 . A A . 8 PRO HG3 1 1
8 1620 1 1 8 PRO N N 7.950 3.974 -0.057 1.00 . A A . 8 PRO N 1 1
8 1621 1 1 8 PRO O O 5.629 2.487 0.110 1.00 . A A . 8 PRO O 1 1
8 1622 1 1 9 PRO C C 3.419 1.905 2.394 1.00 . A A . 9 PRO C 1 1
8 1623 1 1 9 PRO CA C 4.755 1.167 2.395 1.00 . A A . 9 PRO CA 1 1
8 1624 1 1 9 PRO CB C 4.973 0.428 3.714 1.00 . A A . 9 PRO CB 1 1
8 1625 1 1 9 PRO CD C 6.604 2.178 3.603 1.00 . A A . 9 PRO CD 1 1
8 1626 1 1 9 PRO CG C 5.758 1.385 4.550 1.00 . A A . 9 PRO CG 1 1
8 1627 1 1 9 PRO HA H 4.774 0.470 1.570 1.00 . A A . 9 PRO HA 1 1
8 1628 1 1 9 PRO HB2 H 4.015 0.197 4.156 1.00 . A A . 9 PRO HB2 1 1
8 1629 1 1 9 PRO HB3 H 5.521 -0.483 3.533 1.00 . A A . 9 PRO HB3 1 1
8 1630 1 1 9 PRO HD2 H 6.691 3.203 3.928 1.00 . A A . 9 PRO HD2 1 1
8 1631 1 1 9 PRO HD3 H 7.581 1.730 3.509 1.00 . A A . 9 PRO HD3 1 1
8 1632 1 1 9 PRO HG2 H 5.087 2.040 5.086 1.00 . A A . 9 PRO HG2 1 1
8 1633 1 1 9 PRO HG3 H 6.383 0.844 5.244 1.00 . A A . 9 PRO HG3 1 1
8 1634 1 1 9 PRO N N 5.871 2.093 2.322 1.00 . A A . 9 PRO N 1 1
8 1635 1 1 9 PRO O O 2.942 2.377 3.438 1.00 . A A . 9 PRO O 1 1
8 1636 1 1 10 ILE C C 0.458 1.792 1.049 1.00 . A A . 10 ILE C 1 1
8 1637 1 1 10 ILE CA C 1.623 2.769 1.061 1.00 . A A . 10 ILE CA 1 1
8 1638 1 1 10 ILE CB C 1.638 3.658 -0.235 1.00 . A A . 10 ILE CB 1 1
8 1639 1 1 10 ILE CD1 C 0.256 5.324 -1.627 1.00 . A A . 10 ILE CD1 1 1
8 1640 1 1 10 ILE CG1 C 0.287 4.375 -0.442 1.00 . A A . 10 ILE CG1 1 1
8 1641 1 1 10 ILE CG2 C 2.028 2.842 -1.469 1.00 . A A . 10 ILE CG2 1 1
8 1642 1 1 10 ILE H H 3.297 1.668 0.444 1.00 . A A . 10 ILE H 1 1
8 1643 1 1 10 ILE HA H 1.512 3.416 1.919 1.00 . A A . 10 ILE HA 1 1
8 1644 1 1 10 ILE HB H 2.408 4.403 -0.096 1.00 . A A . 10 ILE HB 1 1
8 1645 1 1 10 ILE HD11 H 0.467 4.774 -2.531 1.00 . A A . 10 ILE HD11 1 1
8 1646 1 1 10 ILE HD12 H 1.000 6.095 -1.491 1.00 . A A . 10 ILE HD12 1 1
8 1647 1 1 10 ILE HD13 H -0.722 5.777 -1.700 1.00 . A A . 10 ILE HD13 1 1
8 1648 1 1 10 ILE HG12 H -0.481 3.632 -0.601 1.00 . A A . 10 ILE HG12 1 1
8 1649 1 1 10 ILE HG13 H 0.046 4.938 0.448 1.00 . A A . 10 ILE HG13 1 1
8 1650 1 1 10 ILE HG21 H 3.019 2.435 -1.336 1.00 . A A . 10 ILE HG21 1 1
8 1651 1 1 10 ILE HG22 H 2.014 3.479 -2.341 1.00 . A A . 10 ILE HG22 1 1
8 1652 1 1 10 ILE HG23 H 1.321 2.038 -1.599 1.00 . A A . 10 ILE HG23 1 1
8 1653 1 1 10 ILE N N 2.861 2.061 1.229 1.00 . A A . 10 ILE N 1 1
8 1654 1 1 10 ILE O O 0.532 0.709 0.432 1.00 . A A . 10 ILE O 1 1
8 1655 1 1 11 ALA C C -2.916 2.070 1.271 1.00 . A A . 11 ALA C 1 1
8 1656 1 1 11 ALA CA C -1.748 1.312 1.809 1.00 . A A . 11 ALA CA 1 1
8 1657 1 1 11 ALA CB C -2.054 0.743 3.203 1.00 . A A . 11 ALA CB 1 1
8 1658 1 1 11 ALA H H -0.560 2.955 2.303 1.00 . A A . 11 ALA H 1 1
8 1659 1 1 11 ALA HA H -1.566 0.483 1.140 1.00 . A A . 11 ALA HA 1 1
8 1660 1 1 11 ALA HB1 H -2.913 0.093 3.125 1.00 . A A . 11 ALA HB1 1 1
8 1661 1 1 11 ALA HB2 H -2.299 1.495 3.929 1.00 . A A . 11 ALA HB2 1 1
8 1662 1 1 11 ALA N N -0.578 2.125 1.776 1.00 . A A . 11 ALA N 1 1
8 1663 1 1 11 ALA O O -3.058 3.277 1.498 1.00 . A A . 11 ALA O 1 1
8 1664 1 1 12 PHE C C -6.098 1.531 0.726 1.00 . A A . 12 PHE C 1 1
8 1665 1 1 12 PHE CA C -4.879 1.940 -0.075 1.00 . A A . 12 PHE CA 1 1
8 1666 1 1 12 PHE CB C -4.969 1.439 -1.531 1.00 . A A . 12 PHE CB 1 1
8 1667 1 1 12 PHE CD1 C -2.587 1.106 -2.321 1.00 . A A . 12 PHE CD1 1 1
8 1668 1 1 12 PHE CD2 C -3.844 2.905 -3.247 1.00 . A A . 12 PHE CD2 1 1
8 1669 1 1 12 PHE CE1 C -1.499 1.461 -3.089 1.00 . A A . 12 PHE CE1 1 1
8 1670 1 1 12 PHE CE2 C -2.754 3.265 -4.022 1.00 . A A . 12 PHE CE2 1 1
8 1671 1 1 12 PHE CG C -3.775 1.825 -2.387 1.00 . A A . 12 PHE CG 1 1
8 1672 1 1 12 PHE CZ C -1.580 2.541 -3.941 1.00 . A A . 12 PHE CZ 1 1
8 1673 1 1 12 PHE H H -3.569 0.416 0.465 1.00 . A A . 12 PHE H 1 1
8 1674 1 1 12 PHE HA H -4.784 3.015 -0.068 1.00 . A A . 12 PHE HA 1 1
8 1675 1 1 12 PHE HB2 H -5.041 0.364 -1.520 1.00 . A A . 12 PHE HB2 1 1
8 1676 1 1 12 PHE HB3 H -5.857 1.847 -1.989 1.00 . A A . 12 PHE HB3 1 1
8 1677 1 1 12 PHE HD1 H -2.521 0.259 -1.653 1.00 . A A . 12 PHE HD1 1 1
8 1678 1 1 12 PHE HD2 H -4.760 3.473 -3.316 1.00 . A A . 12 PHE HD2 1 1
8 1679 1 1 12 PHE HE1 H -0.580 0.893 -3.024 1.00 . A A . 12 PHE HE1 1 1
8 1680 1 1 12 PHE HE2 H -2.820 4.110 -4.690 1.00 . A A . 12 PHE HE2 1 1
8 1681 1 1 12 PHE HZ H -0.727 2.823 -4.543 1.00 . A A . 12 PHE HZ 1 1
8 1682 1 1 12 PHE N N -3.728 1.385 0.560 1.00 . A A . 12 PHE N 1 1
8 1683 1 1 12 PHE O O -6.164 0.398 1.216 1.00 . A A . 12 PHE O 1 1
8 1684 1 1 13 PRO C C -9.120 1.012 1.311 1.00 . A A . 13 PRO C 1 1
8 1685 1 1 13 PRO CA C -8.258 2.211 1.723 1.00 . A A . 13 PRO CA 1 1
8 1686 1 1 13 PRO CB C -9.054 3.517 1.615 1.00 . A A . 13 PRO CB 1 1
8 1687 1 1 13 PRO CD C -7.094 3.783 0.288 1.00 . A A . 13 PRO CD 1 1
8 1688 1 1 13 PRO CG C -8.533 4.185 0.399 1.00 . A A . 13 PRO CG 1 1
8 1689 1 1 13 PRO HA H -7.963 2.070 2.753 1.00 . A A . 13 PRO HA 1 1
8 1690 1 1 13 PRO HB2 H -10.107 3.290 1.524 1.00 . A A . 13 PRO HB2 1 1
8 1691 1 1 13 PRO HB3 H -8.888 4.118 2.497 1.00 . A A . 13 PRO HB3 1 1
8 1692 1 1 13 PRO HD2 H -6.791 3.743 -0.748 1.00 . A A . 13 PRO HD2 1 1
8 1693 1 1 13 PRO HD3 H -6.465 4.462 0.844 1.00 . A A . 13 PRO HD3 1 1
8 1694 1 1 13 PRO HG2 H -9.084 3.839 -0.465 1.00 . A A . 13 PRO HG2 1 1
8 1695 1 1 13 PRO HG3 H -8.620 5.257 0.496 1.00 . A A . 13 PRO HG3 1 1
8 1696 1 1 13 PRO N N -7.074 2.439 0.888 1.00 . A A . 13 PRO N 1 1
8 1697 1 1 13 PRO O O -9.969 0.580 2.079 1.00 . A A . 13 PRO O 1 1
8 1698 1 1 14 ASN C C -9.094 -1.981 0.268 1.00 . A A . 14 ASN C 1 1
8 1699 1 1 14 ASN CA C -9.676 -0.695 -0.306 1.00 . A A . 14 ASN CA 1 1
8 1700 1 1 14 ASN CB C -9.776 -0.813 -1.840 1.00 . A A . 14 ASN CB 1 1
8 1701 1 1 14 ASN CG C -8.479 -1.218 -2.529 1.00 . A A . 14 ASN CG 1 1
8 1702 1 1 14 ASN H H -8.211 0.845 -0.460 1.00 . A A . 14 ASN H 1 1
8 1703 1 1 14 ASN HA H -10.669 -0.572 0.100 1.00 . A A . 14 ASN HA 1 1
8 1704 1 1 14 ASN HB2 H -10.522 -1.556 -2.081 1.00 . A A . 14 ASN HB2 1 1
8 1705 1 1 14 ASN HB3 H -10.093 0.139 -2.238 1.00 . A A . 14 ASN HB3 1 1
8 1706 1 1 14 ASN HD21 H -9.511 -2.182 -3.909 1.00 . A A . 14 ASN HD21 1 1
8 1707 1 1 14 ASN HD22 H -7.804 -2.240 -4.089 1.00 . A A . 14 ASN HD22 1 1
8 1708 1 1 14 ASN N N -8.900 0.465 0.126 1.00 . A A . 14 ASN N 1 1
8 1709 1 1 14 ASN ND2 N -8.605 -1.944 -3.607 1.00 . A A . 14 ASN ND2 1 1
8 1710 1 1 14 ASN O O -9.708 -3.042 0.179 1.00 . A A . 14 ASN O 1 1
8 1711 1 1 14 ASN OD1 O -7.373 -0.888 -2.082 1.00 . A A . 14 ASN OD1 1 1
8 1712 2 2 1 . C C -1.714 -2.217 3.049 1.00 . B A . 101 WMH C 1 1
8 1713 2 2 1 . C1 C -0.936 -0.066 3.777 1.00 . B A . 101 WMH C1 1 1
8 1714 2 2 1 . C2 C 0.158 0.401 4.424 1.00 . B A . 101 WMH C2 1 1
8 1715 2 2 1 . H1 H -2.400 -2.602 3.779 1.00 . B A . 101 WMH H1 1 1
8 1716 2 2 1 . H2 H -2.310 -1.582 2.413 1.00 . B A . 101 WMH H2 1 1
8 1717 2 2 1 . H5 H 0.358 1.436 4.665 1.00 . B A . 101 WMH H5 1 1
8 1718 2 2 1 . N N -0.814 -1.364 3.667 1.00 . B A . 101 WMH N 1 1
8 1719 2 2 1 . N1 N 0.944 -0.638 4.709 1.00 . B A . 101 WMH N1 1 1
8 1720 2 2 1 . N2 N 0.396 -1.722 4.272 1.00 . B A . 101 WMH N2 1 1
9 1721 1 1 1 GLY C C -5.980 -3.500 0.718 1.00 . A A . 1 GLY C 1 1
9 1722 1 1 1 GLY CA C -7.296 -3.193 1.388 1.00 . A A . 1 GLY CA 1 1
9 1723 1 1 1 GLY H1 H -7.462 -1.131 1.004 1.00 . A A . 1 GLY H1 1 1
9 1724 1 1 1 GLY HA2 H -7.123 -3.098 2.449 1.00 . A A . 1 GLY HA2 1 1
9 1725 1 1 1 GLY HA3 H -7.968 -4.022 1.223 1.00 . A A . 1 GLY HA3 1 1
9 1726 1 1 1 GLY N N -7.927 -1.993 0.902 1.00 . A A . 1 GLY N 1 1
9 1727 1 1 1 GLY O O -5.265 -4.411 1.138 1.00 . A A . 1 GLY O 1 1
9 1728 1 1 2 LYS C C -3.263 -2.270 -0.352 1.00 . A A . 2 LYS C 1 1
9 1729 1 1 2 LYS CA C -4.419 -3.021 -1.024 1.00 . A A . 2 LYS CA 1 1
9 1730 1 1 2 LYS CB C -4.581 -2.634 -2.523 1.00 . A A . 2 LYS CB 1 1
9 1731 1 1 2 LYS CD C -2.136 -2.388 -3.302 1.00 . A A . 2 LYS CD 1 1
9 1732 1 1 2 LYS CE C -1.093 -2.856 -4.302 1.00 . A A . 2 LYS CE 1 1
9 1733 1 1 2 LYS CG C -3.471 -3.108 -3.494 1.00 . A A . 2 LYS CG 1 1
9 1734 1 1 2 LYS H H -6.248 -2.055 -0.621 1.00 . A A . 2 LYS H 1 1
9 1735 1 1 2 LYS HA H -4.220 -4.081 -0.957 1.00 . A A . 2 LYS HA 1 1
9 1736 1 1 2 LYS HB2 H -5.513 -3.054 -2.872 1.00 . A A . 2 LYS HB2 1 1
9 1737 1 1 2 LYS HB3 H -4.654 -1.558 -2.588 1.00 . A A . 2 LYS HB3 1 1
9 1738 1 1 2 LYS HD2 H -2.289 -1.328 -3.432 1.00 . A A . 2 LYS HD2 1 1
9 1739 1 1 2 LYS HD3 H -1.779 -2.580 -2.300 1.00 . A A . 2 LYS HD3 1 1
9 1740 1 1 2 LYS HE2 H -0.144 -2.393 -4.071 1.00 . A A . 2 LYS HE2 1 1
9 1741 1 1 2 LYS HE3 H -1.000 -3.927 -4.206 1.00 . A A . 2 LYS HE3 1 1
9 1742 1 1 2 LYS HG2 H -3.309 -4.164 -3.336 1.00 . A A . 2 LYS HG2 1 1
9 1743 1 1 2 LYS HG3 H -3.814 -2.957 -4.508 1.00 . A A . 2 LYS HG3 1 1
9 1744 1 1 2 LYS HZ1 H -0.712 -2.768 -6.361 1.00 . A A . 2 LYS HZ1 1 1
9 1745 1 1 2 LYS HZ2 H -1.686 -1.513 -5.786 1.00 . A A . 2 LYS HZ2 1 1
9 1746 1 1 2 LYS HZ3 H -2.325 -3.047 -5.975 1.00 . A A . 2 LYS HZ3 1 1
9 1747 1 1 2 LYS N N -5.651 -2.773 -0.315 1.00 . A A . 2 LYS N 1 1
9 1748 1 1 2 LYS NZ N -1.469 -2.527 -5.692 1.00 . A A . 2 LYS NZ 1 1
9 1749 1 1 2 LYS O O -3.312 -1.051 -0.172 1.00 . A A . 2 LYS O 1 1
9 1750 1 1 3 ALA C C 0.177 -2.943 -0.148 1.00 . A A . 3 ALA C 1 1
9 1751 1 1 3 ALA CA C -1.038 -2.482 0.603 1.00 . A A . 3 ALA CA 1 1
9 1752 1 1 3 ALA CB C -0.927 -2.823 2.094 1.00 . A A . 3 ALA CB 1 1
9 1753 1 1 3 ALA H H -2.315 -3.987 -0.095 1.00 . A A . 3 ALA H 1 1
9 1754 1 1 3 ALA HA H -1.091 -1.407 0.505 1.00 . A A . 3 ALA HA 1 1
9 1755 1 1 3 ALA HB1 H 0.117 -2.943 2.347 1.00 . A A . 3 ALA HB1 1 1
9 1756 1 1 3 ALA HB2 H -1.440 -3.755 2.278 1.00 . A A . 3 ALA HB2 1 1
9 1757 1 1 3 ALA N N -2.252 -3.016 0.025 1.00 . A A . 3 ALA N 1 1
9 1758 1 1 3 ALA O O 0.321 -4.120 -0.462 1.00 . A A . 3 ALA O 1 1
9 1759 1 1 4 LEU C C 3.347 -2.118 -0.082 1.00 . A A . 4 LEU C 1 1
9 1760 1 1 4 LEU CA C 2.258 -2.249 -1.108 1.00 . A A . 4 LEU CA 1 1
9 1761 1 1 4 LEU CB C 2.454 -1.230 -2.227 1.00 . A A . 4 LEU CB 1 1
9 1762 1 1 4 LEU CD1 C 3.720 -2.702 -3.817 1.00 . A A . 4 LEU CD1 1 1
9 1763 1 1 4 LEU CD2 C 3.819 -0.218 -4.061 1.00 . A A . 4 LEU CD2 1 1
9 1764 1 1 4 LEU CG C 3.715 -1.373 -3.081 1.00 . A A . 4 LEU CG 1 1
9 1765 1 1 4 LEU H H 0.805 -1.081 -0.193 1.00 . A A . 4 LEU H 1 1
9 1766 1 1 4 LEU HA H 2.248 -3.247 -1.519 1.00 . A A . 4 LEU HA 1 1
9 1767 1 1 4 LEU HB2 H 1.595 -1.288 -2.877 1.00 . A A . 4 LEU HB2 1 1
9 1768 1 1 4 LEU HB3 H 2.472 -0.256 -1.761 1.00 . A A . 4 LEU HB3 1 1
9 1769 1 1 4 LEU HD11 H 4.602 -2.770 -4.436 1.00 . A A . 4 LEU HD11 1 1
9 1770 1 1 4 LEU HD12 H 2.837 -2.773 -4.434 1.00 . A A . 4 LEU HD12 1 1
9 1771 1 1 4 LEU HD13 H 3.721 -3.508 -3.099 1.00 . A A . 4 LEU HD13 1 1
9 1772 1 1 4 LEU HD21 H 4.710 -0.330 -4.661 1.00 . A A . 4 LEU HD21 1 1
9 1773 1 1 4 LEU HD22 H 3.867 0.713 -3.517 1.00 . A A . 4 LEU HD22 1 1
9 1774 1 1 4 LEU HD23 H 2.952 -0.212 -4.705 1.00 . A A . 4 LEU HD23 1 1
9 1775 1 1 4 LEU HG H 4.581 -1.349 -2.436 1.00 . A A . 4 LEU HG 1 1
9 1776 1 1 4 LEU N N 1.023 -2.010 -0.442 1.00 . A A . 4 LEU N 1 1
9 1777 1 1 4 LEU O O 3.620 -1.015 0.424 1.00 . A A . 4 LEU O 1 1
9 1778 1 1 5 PHE C C 6.284 -3.044 0.658 1.00 . A A . 5 PHE C 1 1
9 1779 1 1 5 PHE CA C 4.925 -3.277 1.273 1.00 . A A . 5 PHE CA 1 1
9 1780 1 1 5 PHE CB C 4.869 -4.621 1.997 1.00 . A A . 5 PHE CB 1 1
9 1781 1 1 5 PHE CD1 C 3.219 -4.506 3.883 1.00 . A A . 5 PHE CD1 1 1
9 1782 1 1 5 PHE CD2 C 2.569 -5.646 1.901 1.00 . A A . 5 PHE CD2 1 1
9 1783 1 1 5 PHE CE1 C 1.993 -4.792 4.448 1.00 . A A . 5 PHE CE1 1 1
9 1784 1 1 5 PHE CE2 C 1.342 -5.931 2.461 1.00 . A A . 5 PHE CE2 1 1
9 1785 1 1 5 PHE CG C 3.524 -4.929 2.608 1.00 . A A . 5 PHE CG 1 1
9 1786 1 1 5 PHE CZ C 1.054 -5.504 3.737 1.00 . A A . 5 PHE CZ 1 1
9 1787 1 1 5 PHE H H 3.666 -4.027 -0.237 1.00 . A A . 5 PHE H 1 1
9 1788 1 1 5 PHE HA H 4.724 -2.488 1.983 1.00 . A A . 5 PHE HA 1 1
9 1789 1 1 5 PHE HB2 H 5.107 -5.407 1.297 1.00 . A A . 5 PHE HB2 1 1
9 1790 1 1 5 PHE HB3 H 5.601 -4.620 2.791 1.00 . A A . 5 PHE HB3 1 1
9 1791 1 1 5 PHE HD1 H 3.955 -3.946 4.441 1.00 . A A . 5 PHE HD1 1 1
9 1792 1 1 5 PHE HD2 H 2.793 -5.982 0.900 1.00 . A A . 5 PHE HD2 1 1
9 1793 1 1 5 PHE HE1 H 1.766 -4.459 5.450 1.00 . A A . 5 PHE HE1 1 1
9 1794 1 1 5 PHE HE2 H 0.608 -6.490 1.897 1.00 . A A . 5 PHE HE2 1 1
9 1795 1 1 5 PHE HZ H 0.093 -5.728 4.177 1.00 . A A . 5 PHE HZ 1 1
9 1796 1 1 5 PHE N N 3.920 -3.215 0.252 1.00 . A A . 5 PHE N 1 1
9 1797 1 1 5 PHE O O 6.874 -3.937 0.031 1.00 . A A . 5 PHE O 1 1
9 1798 1 1 6 SER C C 8.423 -0.150 0.993 1.00 . A A . 6 SER C 1 1
9 1799 1 1 6 SER CA C 7.987 -1.387 0.209 1.00 . A A . 6 SER CA 1 1
9 1800 1 1 6 SER CB C 7.785 -1.021 -1.282 1.00 . A A . 6 SER CB 1 1
9 1801 1 1 6 SER H H 6.209 -1.162 1.254 1.00 . A A . 6 SER H 1 1
9 1802 1 1 6 SER HA H 8.719 -2.174 0.298 1.00 . A A . 6 SER HA 1 1
9 1803 1 1 6 SER HB2 H 7.097 -0.191 -1.355 1.00 . A A . 6 SER HB2 1 1
9 1804 1 1 6 SER HB3 H 8.734 -0.736 -1.710 1.00 . A A . 6 SER HB3 1 1
9 1805 1 1 6 SER HG H 7.201 -2.864 -1.405 1.00 . A A . 6 SER HG 1 1
9 1806 1 1 6 SER N N 6.733 -1.828 0.760 1.00 . A A . 6 SER N 1 1
9 1807 1 1 6 SER O O 7.887 0.117 2.081 1.00 . A A . 6 SER O 1 1
9 1808 1 1 6 SER OG O 7.255 -2.119 -2.024 1.00 . A A . 6 SER OG 1 1
9 1809 1 1 7 ASN C C 9.562 2.922 0.017 1.00 . A A . 7 ASN C 1 1
9 1810 1 1 7 ASN CA C 9.795 1.839 1.052 1.00 . A A . 7 ASN CA 1 1
9 1811 1 1 7 ASN CB C 11.286 1.834 1.450 1.00 . A A . 7 ASN CB 1 1
9 1812 1 1 7 ASN CG C 11.619 0.882 2.579 1.00 . A A . 7 ASN CG 1 1
9 1813 1 1 7 ASN H H 9.865 0.274 -0.326 1.00 . A A . 7 ASN H 1 1
9 1814 1 1 7 ASN HA H 9.185 2.005 1.926 1.00 . A A . 7 ASN HA 1 1
9 1815 1 1 7 ASN HB2 H 11.875 1.548 0.592 1.00 . A A . 7 ASN HB2 1 1
9 1816 1 1 7 ASN HB3 H 11.569 2.833 1.748 1.00 . A A . 7 ASN HB3 1 1
9 1817 1 1 7 ASN HD21 H 11.328 2.306 3.925 1.00 . A A . 7 ASN HD21 1 1
9 1818 1 1 7 ASN HD22 H 11.776 0.768 4.550 1.00 . A A . 7 ASN HD22 1 1
9 1819 1 1 7 ASN N N 9.385 0.575 0.476 1.00 . A A . 7 ASN N 1 1
9 1820 1 1 7 ASN ND2 N 11.573 1.367 3.797 1.00 . A A . 7 ASN ND2 1 1
9 1821 1 1 7 ASN O O 10.259 2.949 -1.000 1.00 . A A . 7 ASN O 1 1
9 1822 1 1 7 ASN OD1 O 11.933 -0.284 2.350 1.00 . A A . 7 ASN OD1 1 1
9 1823 1 1 8 PRO C C 6.442 2.816 1.092 1.00 . A A . 8 PRO C 1 1
9 1824 1 1 8 PRO CA C 7.630 3.783 1.331 1.00 . A A . 8 PRO CA 1 1
9 1825 1 1 8 PRO CB C 7.134 5.237 1.365 1.00 . A A . 8 PRO CB 1 1
9 1826 1 1 8 PRO CD C 8.251 4.908 -0.736 1.00 . A A . 8 PRO CD 1 1
9 1827 1 1 8 PRO CG C 7.144 5.676 -0.058 1.00 . A A . 8 PRO CG 1 1
9 1828 1 1 8 PRO HA H 8.122 3.545 2.262 1.00 . A A . 8 PRO HA 1 1
9 1829 1 1 8 PRO HB2 H 6.138 5.267 1.782 1.00 . A A . 8 PRO HB2 1 1
9 1830 1 1 8 PRO HB3 H 7.802 5.835 1.967 1.00 . A A . 8 PRO HB3 1 1
9 1831 1 1 8 PRO HD2 H 7.913 4.522 -1.687 1.00 . A A . 8 PRO HD2 1 1
9 1832 1 1 8 PRO HD3 H 9.115 5.541 -0.877 1.00 . A A . 8 PRO HD3 1 1
9 1833 1 1 8 PRO HG2 H 6.193 5.447 -0.515 1.00 . A A . 8 PRO HG2 1 1
9 1834 1 1 8 PRO HG3 H 7.337 6.738 -0.112 1.00 . A A . 8 PRO HG3 1 1
9 1835 1 1 8 PRO N N 8.557 3.802 0.194 1.00 . A A . 8 PRO N 1 1
9 1836 1 1 8 PRO O O 6.164 2.427 -0.060 1.00 . A A . 8 PRO O 1 1
9 1837 1 1 9 PRO C C 3.364 2.290 1.638 1.00 . A A . 9 PRO C 1 1
9 1838 1 1 9 PRO CA C 4.616 1.507 2.029 1.00 . A A . 9 PRO CA 1 1
9 1839 1 1 9 PRO CB C 4.480 0.871 3.413 1.00 . A A . 9 PRO CB 1 1
9 1840 1 1 9 PRO CD C 6.024 2.734 3.565 1.00 . A A . 9 PRO CD 1 1
9 1841 1 1 9 PRO CG C 5.104 1.839 4.363 1.00 . A A . 9 PRO CG 1 1
9 1842 1 1 9 PRO HA H 4.801 0.748 1.283 1.00 . A A . 9 PRO HA 1 1
9 1843 1 1 9 PRO HB2 H 3.434 0.718 3.636 1.00 . A A . 9 PRO HB2 1 1
9 1844 1 1 9 PRO HB3 H 4.994 -0.078 3.426 1.00 . A A . 9 PRO HB3 1 1
9 1845 1 1 9 PRO HD2 H 5.795 3.772 3.751 1.00 . A A . 9 PRO HD2 1 1
9 1846 1 1 9 PRO HD3 H 7.056 2.538 3.814 1.00 . A A . 9 PRO HD3 1 1
9 1847 1 1 9 PRO HG2 H 4.331 2.430 4.829 1.00 . A A . 9 PRO HG2 1 1
9 1848 1 1 9 PRO HG3 H 5.662 1.302 5.117 1.00 . A A . 9 PRO HG3 1 1
9 1849 1 1 9 PRO N N 5.750 2.387 2.158 1.00 . A A . 9 PRO N 1 1
9 1850 1 1 9 PRO O O 3.010 3.302 2.269 1.00 . A A . 9 PRO O 1 1
9 1851 1 1 10 ILE C C 0.338 1.714 0.354 1.00 . A A . 10 ILE C 1 1
9 1852 1 1 10 ILE CA C 1.570 2.541 0.072 1.00 . A A . 10 ILE CA 1 1
9 1853 1 1 10 ILE CB C 1.715 2.761 -1.461 1.00 . A A . 10 ILE CB 1 1
9 1854 1 1 10 ILE CD1 C 3.100 4.917 -1.125 1.00 . A A . 10 ILE CD1 1 1
9 1855 1 1 10 ILE CG1 C 3.003 3.552 -1.793 1.00 . A A . 10 ILE CG1 1 1
9 1856 1 1 10 ILE CG2 C 0.491 3.458 -2.035 1.00 . A A . 10 ILE CG2 1 1
9 1857 1 1 10 ILE H H 3.017 1.012 0.189 1.00 . A A . 10 ILE H 1 1
9 1858 1 1 10 ILE HA H 1.486 3.500 0.561 1.00 . A A . 10 ILE HA 1 1
9 1859 1 1 10 ILE HB H 1.780 1.790 -1.927 1.00 . A A . 10 ILE HB 1 1
9 1860 1 1 10 ILE HD11 H 4.011 5.406 -1.438 1.00 . A A . 10 ILE HD11 1 1
9 1861 1 1 10 ILE HD12 H 3.113 4.794 -0.052 1.00 . A A . 10 ILE HD12 1 1
9 1862 1 1 10 ILE HD13 H 2.250 5.517 -1.410 1.00 . A A . 10 ILE HD13 1 1
9 1863 1 1 10 ILE HG12 H 3.859 2.976 -1.474 1.00 . A A . 10 ILE HG12 1 1
9 1864 1 1 10 ILE HG13 H 3.057 3.697 -2.862 1.00 . A A . 10 ILE HG13 1 1
9 1865 1 1 10 ILE HG21 H 0.388 4.430 -1.576 1.00 . A A . 10 ILE HG21 1 1
9 1866 1 1 10 ILE HG22 H -0.389 2.867 -1.827 1.00 . A A . 10 ILE HG22 1 1
9 1867 1 1 10 ILE HG23 H 0.604 3.572 -3.102 1.00 . A A . 10 ILE HG23 1 1
9 1868 1 1 10 ILE N N 2.724 1.854 0.601 1.00 . A A . 10 ILE N 1 1
9 1869 1 1 10 ILE O O 0.298 0.539 0.001 1.00 . A A . 10 ILE O 1 1
9 1870 1 1 11 ALA C C -3.071 2.296 0.921 1.00 . A A . 11 ALA C 1 1
9 1871 1 1 11 ALA CA C -1.838 1.552 1.338 1.00 . A A . 11 ALA CA 1 1
9 1872 1 1 11 ALA CB C -1.931 1.177 2.833 1.00 . A A . 11 ALA CB 1 1
9 1873 1 1 11 ALA H H -0.594 3.240 1.257 1.00 . A A . 11 ALA H 1 1
9 1874 1 1 11 ALA HA H -1.801 0.637 0.766 1.00 . A A . 11 ALA HA 1 1
9 1875 1 1 11 ALA HB1 H -2.774 0.514 2.960 1.00 . A A . 11 ALA HB1 1 1
9 1876 1 1 11 ALA HB2 H -2.104 2.017 3.478 1.00 . A A . 11 ALA HB2 1 1
9 1877 1 1 11 ALA N N -0.646 2.292 1.010 1.00 . A A . 11 ALA N 1 1
9 1878 1 1 11 ALA O O -3.112 3.535 0.934 1.00 . A A . 11 ALA O 1 1
9 1879 1 1 12 PHE C C -6.379 1.509 1.039 1.00 . A A . 12 PHE C 1 1
9 1880 1 1 12 PHE CA C -5.312 2.082 0.125 1.00 . A A . 12 PHE CA 1 1
9 1881 1 1 12 PHE CB C -5.602 1.691 -1.334 1.00 . A A . 12 PHE CB 1 1
9 1882 1 1 12 PHE CD1 C -3.541 1.238 -2.694 1.00 . A A . 12 PHE CD1 1 1
9 1883 1 1 12 PHE CD2 C -4.540 3.388 -2.852 1.00 . A A . 12 PHE CD2 1 1
9 1884 1 1 12 PHE CE1 C -2.566 1.619 -3.589 1.00 . A A . 12 PHE CE1 1 1
9 1885 1 1 12 PHE CE2 C -3.565 3.776 -3.748 1.00 . A A . 12 PHE CE2 1 1
9 1886 1 1 12 PHE CG C -4.540 2.117 -2.314 1.00 . A A . 12 PHE CG 1 1
9 1887 1 1 12 PHE CZ C -2.578 2.890 -4.118 1.00 . A A . 12 PHE CZ 1 1
9 1888 1 1 12 PHE H H -3.935 0.575 0.551 1.00 . A A . 12 PHE H 1 1
9 1889 1 1 12 PHE HA H -5.285 3.158 0.215 1.00 . A A . 12 PHE HA 1 1
9 1890 1 1 12 PHE HB2 H -5.694 0.617 -1.397 1.00 . A A . 12 PHE HB2 1 1
9 1891 1 1 12 PHE HB3 H -6.536 2.139 -1.638 1.00 . A A . 12 PHE HB3 1 1
9 1892 1 1 12 PHE HD1 H -3.530 0.242 -2.277 1.00 . A A . 12 PHE HD1 1 1
9 1893 1 1 12 PHE HD2 H -5.314 4.085 -2.563 1.00 . A A . 12 PHE HD2 1 1
9 1894 1 1 12 PHE HE1 H -1.794 0.921 -3.876 1.00 . A A . 12 PHE HE1 1 1
9 1895 1 1 12 PHE HE2 H -3.576 4.774 -4.158 1.00 . A A . 12 PHE HE2 1 1
9 1896 1 1 12 PHE HZ H -1.813 3.190 -4.820 1.00 . A A . 12 PHE HZ 1 1
9 1897 1 1 12 PHE N N -4.052 1.554 0.545 1.00 . A A . 12 PHE N 1 1
9 1898 1 1 12 PHE O O -6.303 0.328 1.399 1.00 . A A . 12 PHE O 1 1
9 1899 1 1 13 PRO C C -9.297 0.714 1.805 1.00 . A A . 13 PRO C 1 1
9 1900 1 1 13 PRO CA C -8.459 1.874 2.360 1.00 . A A . 13 PRO CA 1 1
9 1901 1 1 13 PRO CB C -9.327 3.127 2.538 1.00 . A A . 13 PRO CB 1 1
9 1902 1 1 13 PRO CD C -7.588 3.715 1.008 1.00 . A A . 13 PRO CD 1 1
9 1903 1 1 13 PRO CG C -9.025 3.975 1.353 1.00 . A A . 13 PRO CG 1 1
9 1904 1 1 13 PRO HA H -8.041 1.580 3.311 1.00 . A A . 13 PRO HA 1 1
9 1905 1 1 13 PRO HB2 H -10.369 2.842 2.565 1.00 . A A . 13 PRO HB2 1 1
9 1906 1 1 13 PRO HB3 H -9.062 3.627 3.457 1.00 . A A . 13 PRO HB3 1 1
9 1907 1 1 13 PRO HD2 H -7.430 3.826 -0.055 1.00 . A A . 13 PRO HD2 1 1
9 1908 1 1 13 PRO HD3 H -6.938 4.375 1.560 1.00 . A A . 13 PRO HD3 1 1
9 1909 1 1 13 PRO HG2 H -9.666 3.695 0.529 1.00 . A A . 13 PRO HG2 1 1
9 1910 1 1 13 PRO HG3 H -9.167 5.016 1.603 1.00 . A A . 13 PRO HG3 1 1
9 1911 1 1 13 PRO N N -7.395 2.314 1.428 1.00 . A A . 13 PRO N 1 1
9 1912 1 1 13 PRO O O -10.121 0.122 2.513 1.00 . A A . 13 PRO O 1 1
9 1913 1 1 14 ASN C C -9.128 -2.047 0.333 1.00 . A A . 14 ASN C 1 1
9 1914 1 1 14 ASN CA C -9.750 -0.714 -0.099 1.00 . A A . 14 ASN CA 1 1
9 1915 1 1 14 ASN CB C -9.774 -0.570 -1.644 1.00 . A A . 14 ASN CB 1 1
9 1916 1 1 14 ASN CG C -8.397 -0.461 -2.306 1.00 . A A . 14 ASN CG 1 1
9 1917 1 1 14 ASN H H -8.447 0.948 0.038 1.00 . A A . 14 ASN H 1 1
9 1918 1 1 14 ASN HA H -10.767 -0.695 0.267 1.00 . A A . 14 ASN HA 1 1
9 1919 1 1 14 ASN HB2 H -10.269 -1.436 -2.061 1.00 . A A . 14 ASN HB2 1 1
9 1920 1 1 14 ASN HB3 H -10.347 0.310 -1.898 1.00 . A A . 14 ASN HB3 1 1
9 1921 1 1 14 ASN HD21 H -9.160 0.655 -3.742 1.00 . A A . 14 ASN HD21 1 1
9 1922 1 1 14 ASN HD22 H -7.464 0.357 -3.847 1.00 . A A . 14 ASN HD22 1 1
9 1923 1 1 14 ASN N N -9.082 0.399 0.542 1.00 . A A . 14 ASN N 1 1
9 1924 1 1 14 ASN ND2 N -8.332 0.244 -3.403 1.00 . A A . 14 ASN ND2 1 1
9 1925 1 1 14 ASN O O -9.729 -3.106 0.157 1.00 . A A . 14 ASN O 1 1
9 1926 1 1 14 ASN OD1 O -7.402 -1.000 -1.831 1.00 . A A . 14 ASN OD1 1 1
9 1927 2 2 1 . C C -1.514 -1.764 2.998 1.00 . B A . 101 WMH C 1 1
9 1928 2 2 1 . C1 C -0.731 0.471 3.370 1.00 . B A . 101 WMH C1 1 1
9 1929 2 2 1 . C2 C 0.412 1.042 3.833 1.00 . B A . 101 WMH C2 1 1
9 1930 2 2 1 . H1 H -2.089 -2.079 3.850 1.00 . B A . 101 WMH H1 1 1
9 1931 2 2 1 . H2 H -2.202 -1.222 2.369 1.00 . B A . 101 WMH H2 1 1
9 1932 2 2 1 . H5 H 0.604 2.101 3.924 1.00 . B A . 101 WMH H5 1 1
9 1933 2 2 1 . N N -0.580 -0.822 3.406 1.00 . B A . 101 WMH N 1 1
9 1934 2 2 1 . N1 N 1.252 0.063 4.153 1.00 . B A . 101 WMH N1 1 1
9 1935 2 2 1 . N2 N 0.700 -1.076 3.914 1.00 . B A . 101 WMH N2 1 1
10 1936 1 1 1 GLY C C -5.761 -3.395 0.472 1.00 . A A . 1 GLY C 1 1
10 1937 1 1 1 GLY CA C -6.939 -3.246 1.402 1.00 . A A . 1 GLY CA 1 1
10 1938 1 1 1 GLY H1 H -7.404 -1.206 1.171 1.00 . A A . 1 GLY H1 1 1
10 1939 1 1 1 GLY HA2 H -6.569 -3.118 2.409 1.00 . A A . 1 GLY HA2 1 1
10 1940 1 1 1 GLY HA3 H -7.537 -4.144 1.357 1.00 . A A . 1 GLY HA3 1 1
10 1941 1 1 1 GLY N N -7.764 -2.115 1.066 1.00 . A A . 1 GLY N 1 1
10 1942 1 1 1 GLY O O -4.979 -4.349 0.591 1.00 . A A . 1 GLY O 1 1
10 1943 1 1 2 LYS C C -3.267 -1.990 -0.710 1.00 . A A . 2 LYS C 1 1
10 1944 1 1 2 LYS CA C -4.516 -2.511 -1.393 1.00 . A A . 2 LYS CA 1 1
10 1945 1 1 2 LYS CB C -4.819 -1.704 -2.655 1.00 . A A . 2 LYS CB 1 1
10 1946 1 1 2 LYS CD C -4.121 -1.062 -4.974 1.00 . A A . 2 LYS CD 1 1
10 1947 1 1 2 LYS CE C -3.046 -1.191 -6.038 1.00 . A A . 2 LYS CE 1 1
10 1948 1 1 2 LYS CG C -3.725 -1.781 -3.706 1.00 . A A . 2 LYS CG 1 1
10 1949 1 1 2 LYS H H -6.279 -1.744 -0.506 1.00 . A A . 2 LYS H 1 1
10 1950 1 1 2 LYS HA H -4.361 -3.547 -1.656 1.00 . A A . 2 LYS HA 1 1
10 1951 1 1 2 LYS HB2 H -5.740 -2.061 -3.091 1.00 . A A . 2 LYS HB2 1 1
10 1952 1 1 2 LYS HB3 H -4.945 -0.668 -2.378 1.00 . A A . 2 LYS HB3 1 1
10 1953 1 1 2 LYS HD2 H -5.040 -1.490 -5.349 1.00 . A A . 2 LYS HD2 1 1
10 1954 1 1 2 LYS HD3 H -4.272 -0.017 -4.749 1.00 . A A . 2 LYS HD3 1 1
10 1955 1 1 2 LYS HE2 H -2.821 -2.238 -6.174 1.00 . A A . 2 LYS HE2 1 1
10 1956 1 1 2 LYS HE3 H -3.433 -0.791 -6.964 1.00 . A A . 2 LYS HE3 1 1
10 1957 1 1 2 LYS HG2 H -2.827 -1.329 -3.313 1.00 . A A . 2 LYS HG2 1 1
10 1958 1 1 2 LYS HG3 H -3.535 -2.819 -3.935 1.00 . A A . 2 LYS HG3 1 1
10 1959 1 1 2 LYS HZ1 H -1.056 -0.689 -6.383 1.00 . A A . 2 LYS HZ1 1 1
10 1960 1 1 2 LYS HZ2 H -1.438 -0.701 -4.732 1.00 . A A . 2 LYS HZ2 1 1
10 1961 1 1 2 LYS HZ3 H -1.960 0.550 -5.734 1.00 . A A . 2 LYS HZ3 1 1
10 1962 1 1 2 LYS N N -5.623 -2.470 -0.461 1.00 . A A . 2 LYS N 1 1
10 1963 1 1 2 LYS NZ N -1.795 -0.476 -5.680 1.00 . A A . 2 LYS NZ 1 1
10 1964 1 1 2 LYS O O -3.228 -0.841 -0.277 1.00 . A A . 2 LYS O 1 1
10 1965 1 1 3 ALA C C 0.172 -3.077 -0.553 1.00 . A A . 3 ALA C 1 1
10 1966 1 1 3 ALA CA C -1.051 -2.516 0.093 1.00 . A A . 3 ALA CA 1 1
10 1967 1 1 3 ALA CB C -1.135 -2.950 1.550 1.00 . A A . 3 ALA CB 1 1
10 1968 1 1 3 ALA H H -2.332 -3.723 -1.015 1.00 . A A . 3 ALA H 1 1
10 1969 1 1 3 ALA HA H -0.959 -1.440 0.089 1.00 . A A . 3 ALA HA 1 1
10 1970 1 1 3 ALA HB1 H -0.148 -3.228 1.890 1.00 . A A . 3 ALA HB1 1 1
10 1971 1 1 3 ALA HB2 H -1.791 -3.805 1.626 1.00 . A A . 3 ALA HB2 1 1
10 1972 1 1 3 ALA N N -2.271 -2.835 -0.603 1.00 . A A . 3 ALA N 1 1
10 1973 1 1 3 ALA O O 0.129 -4.102 -1.238 1.00 . A A . 3 ALA O 1 1
10 1974 1 1 4 LEU C C 3.425 -2.807 0.445 1.00 . A A . 4 LEU C 1 1
10 1975 1 1 4 LEU CA C 2.555 -2.749 -0.783 1.00 . A A . 4 LEU CA 1 1
10 1976 1 1 4 LEU CB C 3.143 -1.714 -1.757 1.00 . A A . 4 LEU CB 1 1
10 1977 1 1 4 LEU CD1 C 3.087 -0.400 -3.879 1.00 . A A . 4 LEU CD1 1 1
10 1978 1 1 4 LEU CD2 C 2.162 -2.716 -3.842 1.00 . A A . 4 LEU CD2 1 1
10 1979 1 1 4 LEU CG C 2.362 -1.440 -3.042 1.00 . A A . 4 LEU CG 1 1
10 1980 1 1 4 LEU H H 1.179 -1.526 0.151 1.00 . A A . 4 LEU H 1 1
10 1981 1 1 4 LEU HA H 2.510 -3.718 -1.257 1.00 . A A . 4 LEU HA 1 1
10 1982 1 1 4 LEU HB2 H 3.239 -0.780 -1.224 1.00 . A A . 4 LEU HB2 1 1
10 1983 1 1 4 LEU HB3 H 4.135 -2.043 -2.030 1.00 . A A . 4 LEU HB3 1 1
10 1984 1 1 4 LEU HD11 H 4.069 -0.767 -4.137 1.00 . A A . 4 LEU HD11 1 1
10 1985 1 1 4 LEU HD12 H 3.182 0.515 -3.314 1.00 . A A . 4 LEU HD12 1 1
10 1986 1 1 4 LEU HD13 H 2.525 -0.209 -4.781 1.00 . A A . 4 LEU HD13 1 1
10 1987 1 1 4 LEU HD21 H 1.592 -2.496 -4.732 1.00 . A A . 4 LEU HD21 1 1
10 1988 1 1 4 LEU HD22 H 1.627 -3.436 -3.242 1.00 . A A . 4 LEU HD22 1 1
10 1989 1 1 4 LEU HD23 H 3.125 -3.118 -4.121 1.00 . A A . 4 LEU HD23 1 1
10 1990 1 1 4 LEU HG H 1.393 -1.043 -2.779 1.00 . A A . 4 LEU HG 1 1
10 1991 1 1 4 LEU N N 1.249 -2.368 -0.347 1.00 . A A . 4 LEU N 1 1
10 1992 1 1 4 LEU O O 3.239 -2.016 1.373 1.00 . A A . 4 LEU O 1 1
10 1993 1 1 5 PHE C C 6.584 -3.176 1.229 1.00 . A A . 5 PHE C 1 1
10 1994 1 1 5 PHE CA C 5.269 -3.862 1.586 1.00 . A A . 5 PHE CA 1 1
10 1995 1 1 5 PHE CB C 5.462 -5.346 1.968 1.00 . A A . 5 PHE CB 1 1
10 1996 1 1 5 PHE CD1 C 4.852 -6.879 0.082 1.00 . A A . 5 PHE CD1 1 1
10 1997 1 1 5 PHE CD2 C 7.155 -6.469 0.506 1.00 . A A . 5 PHE CD2 1 1
10 1998 1 1 5 PHE CE1 C 5.187 -7.708 -0.968 1.00 . A A . 5 PHE CE1 1 1
10 1999 1 1 5 PHE CE2 C 7.498 -7.295 -0.537 1.00 . A A . 5 PHE CE2 1 1
10 2000 1 1 5 PHE CG C 5.834 -6.251 0.828 1.00 . A A . 5 PHE CG 1 1
10 2001 1 1 5 PHE CZ C 6.513 -7.916 -1.278 1.00 . A A . 5 PHE CZ 1 1
10 2002 1 1 5 PHE H H 4.436 -4.335 -0.290 1.00 . A A . 5 PHE H 1 1
10 2003 1 1 5 PHE HA H 4.839 -3.329 2.419 1.00 . A A . 5 PHE HA 1 1
10 2004 1 1 5 PHE HB2 H 6.250 -5.416 2.703 1.00 . A A . 5 PHE HB2 1 1
10 2005 1 1 5 PHE HB3 H 4.545 -5.715 2.403 1.00 . A A . 5 PHE HB3 1 1
10 2006 1 1 5 PHE HD1 H 3.817 -6.708 0.334 1.00 . A A . 5 PHE HD1 1 1
10 2007 1 1 5 PHE HD2 H 7.923 -5.982 1.089 1.00 . A A . 5 PHE HD2 1 1
10 2008 1 1 5 PHE HE1 H 4.412 -8.193 -1.544 1.00 . A A . 5 PHE HE1 1 1
10 2009 1 1 5 PHE HE2 H 8.540 -7.457 -0.774 1.00 . A A . 5 PHE HE2 1 1
10 2010 1 1 5 PHE HZ H 6.786 -8.564 -2.099 1.00 . A A . 5 PHE HZ 1 1
10 2011 1 1 5 PHE N N 4.340 -3.726 0.474 1.00 . A A . 5 PHE N 1 1
10 2012 1 1 5 PHE O O 7.639 -3.416 1.831 1.00 . A A . 5 PHE O 1 1
10 2013 1 1 6 SER C C 7.877 -0.368 0.764 1.00 . A A . 6 SER C 1 1
10 2014 1 1 6 SER CA C 7.591 -1.516 -0.211 1.00 . A A . 6 SER CA 1 1
10 2015 1 1 6 SER CB C 7.224 -0.933 -1.572 1.00 . A A . 6 SER CB 1 1
10 2016 1 1 6 SER H H 5.623 -2.196 -0.185 1.00 . A A . 6 SER H 1 1
10 2017 1 1 6 SER HA H 8.465 -2.137 -0.326 1.00 . A A . 6 SER HA 1 1
10 2018 1 1 6 SER HB2 H 6.410 -0.237 -1.443 1.00 . A A . 6 SER HB2 1 1
10 2019 1 1 6 SER HB3 H 8.077 -0.421 -1.990 1.00 . A A . 6 SER HB3 1 1
10 2020 1 1 6 SER HG H 6.984 -2.810 -2.067 1.00 . A A . 6 SER HG 1 1
10 2021 1 1 6 SER N N 6.491 -2.306 0.254 1.00 . A A . 6 SER N 1 1
10 2022 1 1 6 SER O O 7.170 -0.184 1.767 1.00 . A A . 6 SER O 1 1
10 2023 1 1 6 SER OG O 6.807 -1.946 -2.465 1.00 . A A . 6 SER OG 1 1
10 2024 1 1 7 ASN C C 9.483 2.665 0.225 1.00 . A A . 7 ASN C 1 1
10 2025 1 1 7 ASN CA C 9.276 1.547 1.220 1.00 . A A . 7 ASN CA 1 1
10 2026 1 1 7 ASN CB C 10.575 1.299 2.000 1.00 . A A . 7 ASN CB 1 1
10 2027 1 1 7 ASN CG C 11.022 2.500 2.819 1.00 . A A . 7 ASN CG 1 1
10 2028 1 1 7 ASN H H 9.453 0.151 -0.310 1.00 . A A . 7 ASN H 1 1
10 2029 1 1 7 ASN HA H 8.474 1.794 1.901 1.00 . A A . 7 ASN HA 1 1
10 2030 1 1 7 ASN HB2 H 10.442 0.459 2.663 1.00 . A A . 7 ASN HB2 1 1
10 2031 1 1 7 ASN HB3 H 11.353 1.067 1.290 1.00 . A A . 7 ASN HB3 1 1
10 2032 1 1 7 ASN HD21 H 12.909 1.924 2.686 1.00 . A A . 7 ASN HD21 1 1
10 2033 1 1 7 ASN HD22 H 12.612 3.383 3.572 1.00 . A A . 7 ASN HD22 1 1
10 2034 1 1 7 ASN N N 8.900 0.377 0.469 1.00 . A A . 7 ASN N 1 1
10 2035 1 1 7 ASN ND2 N 12.305 2.611 3.047 1.00 . A A . 7 ASN ND2 1 1
10 2036 1 1 7 ASN O O 10.309 2.521 -0.686 1.00 . A A . 7 ASN O 1 1
10 2037 1 1 7 ASN OD1 O 10.208 3.314 3.266 1.00 . A A . 7 ASN OD1 1 1
10 2038 1 1 8 PRO C C 6.435 3.125 1.153 1.00 . A A . 8 PRO C 1 1
10 2039 1 1 8 PRO CA C 7.693 3.989 1.363 1.00 . A A . 8 PRO CA 1 1
10 2040 1 1 8 PRO CB C 7.331 5.466 1.178 1.00 . A A . 8 PRO CB 1 1
10 2041 1 1 8 PRO CD C 8.822 4.926 -0.592 1.00 . A A . 8 PRO CD 1 1
10 2042 1 1 8 PRO CG C 7.604 5.732 -0.255 1.00 . A A . 8 PRO CG 1 1
10 2043 1 1 8 PRO HA H 8.087 3.835 2.358 1.00 . A A . 8 PRO HA 1 1
10 2044 1 1 8 PRO HB2 H 6.289 5.618 1.422 1.00 . A A . 8 PRO HB2 1 1
10 2045 1 1 8 PRO HB3 H 7.949 6.081 1.814 1.00 . A A . 8 PRO HB3 1 1
10 2046 1 1 8 PRO HD2 H 8.792 4.606 -1.623 1.00 . A A . 8 PRO HD2 1 1
10 2047 1 1 8 PRO HD3 H 9.719 5.496 -0.399 1.00 . A A . 8 PRO HD3 1 1
10 2048 1 1 8 PRO HG2 H 6.761 5.414 -0.853 1.00 . A A . 8 PRO HG2 1 1
10 2049 1 1 8 PRO HG3 H 7.795 6.785 -0.401 1.00 . A A . 8 PRO HG3 1 1
10 2050 1 1 8 PRO N N 8.728 3.773 0.321 1.00 . A A . 8 PRO N 1 1
10 2051 1 1 8 PRO O O 6.087 2.783 0.016 1.00 . A A . 8 PRO O 1 1
10 2052 1 1 9 PRO C C 3.351 2.859 1.717 1.00 . A A . 9 PRO C 1 1
10 2053 1 1 9 PRO CA C 4.532 1.966 2.140 1.00 . A A . 9 PRO CA 1 1
10 2054 1 1 9 PRO CB C 4.333 1.427 3.560 1.00 . A A . 9 PRO CB 1 1
10 2055 1 1 9 PRO CD C 6.165 2.974 3.640 1.00 . A A . 9 PRO CD 1 1
10 2056 1 1 9 PRO CG C 5.025 2.408 4.442 1.00 . A A . 9 PRO CG 1 1
10 2057 1 1 9 PRO HA H 4.629 1.150 1.440 1.00 . A A . 9 PRO HA 1 1
10 2058 1 1 9 PRO HB2 H 3.277 1.370 3.781 1.00 . A A . 9 PRO HB2 1 1
10 2059 1 1 9 PRO HB3 H 4.776 0.446 3.642 1.00 . A A . 9 PRO HB3 1 1
10 2060 1 1 9 PRO HD2 H 6.272 4.033 3.830 1.00 . A A . 9 PRO HD2 1 1
10 2061 1 1 9 PRO HD3 H 7.083 2.454 3.874 1.00 . A A . 9 PRO HD3 1 1
10 2062 1 1 9 PRO HG2 H 4.340 3.195 4.720 1.00 . A A . 9 PRO HG2 1 1
10 2063 1 1 9 PRO HG3 H 5.397 1.909 5.325 1.00 . A A . 9 PRO HG3 1 1
10 2064 1 1 9 PRO N N 5.767 2.729 2.233 1.00 . A A . 9 PRO N 1 1
10 2065 1 1 9 PRO O O 3.110 3.926 2.299 1.00 . A A . 9 PRO O 1 1
10 2066 1 1 10 ILE C C 0.311 2.210 0.133 1.00 . A A . 10 ILE C 1 1
10 2067 1 1 10 ILE CA C 1.503 3.163 0.201 1.00 . A A . 10 ILE CA 1 1
10 2068 1 1 10 ILE CB C 1.781 3.865 -1.176 1.00 . A A . 10 ILE CB 1 1
10 2069 1 1 10 ILE CD1 C -0.036 5.661 -0.886 1.00 . A A . 10 ILE CD1 1 1
10 2070 1 1 10 ILE CG1 C 0.518 4.544 -1.748 1.00 . A A . 10 ILE CG1 1 1
10 2071 1 1 10 ILE CG2 C 2.399 2.912 -2.184 1.00 . A A . 10 ILE CG2 1 1
10 2072 1 1 10 ILE H H 2.908 1.614 0.241 1.00 . A A . 10 ILE H 1 1
10 2073 1 1 10 ILE HA H 1.276 3.914 0.944 1.00 . A A . 10 ILE HA 1 1
10 2074 1 1 10 ILE HB H 2.522 4.630 -0.986 1.00 . A A . 10 ILE HB 1 1
10 2075 1 1 10 ILE HD11 H 0.718 6.423 -0.757 1.00 . A A . 10 ILE HD11 1 1
10 2076 1 1 10 ILE HD12 H -0.322 5.268 0.079 1.00 . A A . 10 ILE HD12 1 1
10 2077 1 1 10 ILE HD13 H -0.902 6.091 -1.367 1.00 . A A . 10 ILE HD13 1 1
10 2078 1 1 10 ILE HG12 H 0.749 4.963 -2.716 1.00 . A A . 10 ILE HG12 1 1
10 2079 1 1 10 ILE HG13 H -0.255 3.797 -1.864 1.00 . A A . 10 ILE HG13 1 1
10 2080 1 1 10 ILE HG21 H 1.718 2.087 -2.336 1.00 . A A . 10 ILE HG21 1 1
10 2081 1 1 10 ILE HG22 H 3.335 2.541 -1.798 1.00 . A A . 10 ILE HG22 1 1
10 2082 1 1 10 ILE HG23 H 2.563 3.425 -3.120 1.00 . A A . 10 ILE HG23 1 1
10 2083 1 1 10 ILE N N 2.656 2.445 0.693 1.00 . A A . 10 ILE N 1 1
10 2084 1 1 10 ILE O O 0.337 1.180 -0.578 1.00 . A A . 10 ILE O 1 1
10 2085 1 1 11 ALA C C -3.113 2.449 0.746 1.00 . A A . 11 ALA C 1 1
10 2086 1 1 11 ALA CA C -1.855 1.683 1.043 1.00 . A A . 11 ALA CA 1 1
10 2087 1 1 11 ALA CB C -1.955 1.105 2.458 1.00 . A A . 11 ALA CB 1 1
10 2088 1 1 11 ALA H H -0.671 3.359 1.416 1.00 . A A . 11 ALA H 1 1
10 2089 1 1 11 ALA HA H -1.772 0.845 0.365 1.00 . A A . 11 ALA HA 1 1
10 2090 1 1 11 ALA HB1 H -2.811 0.450 2.499 1.00 . A A . 11 ALA HB1 1 1
10 2091 1 1 11 ALA HB2 H -2.110 1.872 3.196 1.00 . A A . 11 ALA HB2 1 1
10 2092 1 1 11 ALA N N -0.694 2.521 0.909 1.00 . A A . 11 ALA N 1 1
10 2093 1 1 11 ALA O O -3.158 3.688 0.871 1.00 . A A . 11 ALA O 1 1
10 2094 1 1 12 PHE C C -6.405 1.550 0.985 1.00 . A A . 12 PHE C 1 1
10 2095 1 1 12 PHE CA C -5.412 2.268 0.078 1.00 . A A . 12 PHE CA 1 1
10 2096 1 1 12 PHE CB C -5.785 2.087 -1.407 1.00 . A A . 12 PHE CB 1 1
10 2097 1 1 12 PHE CD1 C -3.680 2.295 -2.791 1.00 . A A . 12 PHE CD1 1 1
10 2098 1 1 12 PHE CD2 C -5.248 4.087 -2.833 1.00 . A A . 12 PHE CD2 1 1
10 2099 1 1 12 PHE CE1 C -2.861 2.987 -3.662 1.00 . A A . 12 PHE CE1 1 1
10 2100 1 1 12 PHE CE2 C -4.429 4.780 -3.705 1.00 . A A . 12 PHE CE2 1 1
10 2101 1 1 12 PHE CG C -4.886 2.837 -2.366 1.00 . A A . 12 PHE CG 1 1
10 2102 1 1 12 PHE CZ C -3.236 4.232 -4.118 1.00 . A A . 12 PHE CZ 1 1
10 2103 1 1 12 PHE H H -3.976 0.759 0.232 1.00 . A A . 12 PHE H 1 1
10 2104 1 1 12 PHE HA H -5.378 3.318 0.323 1.00 . A A . 12 PHE HA 1 1
10 2105 1 1 12 PHE HB2 H -5.741 1.039 -1.656 1.00 . A A . 12 PHE HB2 1 1
10 2106 1 1 12 PHE HB3 H -6.796 2.437 -1.555 1.00 . A A . 12 PHE HB3 1 1
10 2107 1 1 12 PHE HD1 H -3.383 1.319 -2.434 1.00 . A A . 12 PHE HD1 1 1
10 2108 1 1 12 PHE HD2 H -6.183 4.522 -2.513 1.00 . A A . 12 PHE HD2 1 1
10 2109 1 1 12 PHE HE1 H -1.924 2.559 -3.988 1.00 . A A . 12 PHE HE1 1 1
10 2110 1 1 12 PHE HE2 H -4.721 5.757 -4.065 1.00 . A A . 12 PHE HE2 1 1
10 2111 1 1 12 PHE HZ H -2.597 4.778 -4.796 1.00 . A A . 12 PHE HZ 1 1
10 2112 1 1 12 PHE N N -4.113 1.727 0.345 1.00 . A A . 12 PHE N 1 1
10 2113 1 1 12 PHE O O -6.283 0.329 1.180 1.00 . A A . 12 PHE O 1 1
10 2114 1 1 13 PRO C C -9.144 0.484 2.100 1.00 . A A . 13 PRO C 1 1
10 2115 1 1 13 PRO CA C -8.379 1.747 2.543 1.00 . A A . 13 PRO CA 1 1
10 2116 1 1 13 PRO CB C -9.358 2.908 2.730 1.00 . A A . 13 PRO CB 1 1
10 2117 1 1 13 PRO CD C -7.638 3.724 1.310 1.00 . A A . 13 PRO CD 1 1
10 2118 1 1 13 PRO CG C -8.557 4.117 2.427 1.00 . A A . 13 PRO CG 1 1
10 2119 1 1 13 PRO HA H -7.897 1.549 3.488 1.00 . A A . 13 PRO HA 1 1
10 2120 1 1 13 PRO HB2 H -10.184 2.794 2.043 1.00 . A A . 13 PRO HB2 1 1
10 2121 1 1 13 PRO HB3 H -9.724 2.922 3.746 1.00 . A A . 13 PRO HB3 1 1
10 2122 1 1 13 PRO HD2 H -8.109 3.885 0.352 1.00 . A A . 13 PRO HD2 1 1
10 2123 1 1 13 PRO HD3 H -6.719 4.287 1.388 1.00 . A A . 13 PRO HD3 1 1
10 2124 1 1 13 PRO HG2 H -9.205 4.922 2.115 1.00 . A A . 13 PRO HG2 1 1
10 2125 1 1 13 PRO HG3 H -7.987 4.407 3.296 1.00 . A A . 13 PRO HG3 1 1
10 2126 1 1 13 PRO N N -7.398 2.283 1.555 1.00 . A A . 13 PRO N 1 1
10 2127 1 1 13 PRO O O -9.767 -0.191 2.925 1.00 . A A . 13 PRO O 1 1
10 2128 1 1 14 ASN C C -9.002 -2.289 0.642 1.00 . A A . 14 ASN C 1 1
10 2129 1 1 14 ASN CA C -9.793 -1.021 0.308 1.00 . A A . 14 ASN CA 1 1
10 2130 1 1 14 ASN CB C -9.990 -0.929 -1.215 1.00 . A A . 14 ASN CB 1 1
10 2131 1 1 14 ASN CG C -8.698 -1.109 -2.001 1.00 . A A . 14 ASN CG 1 1
10 2132 1 1 14 ASN H H -8.607 0.754 0.217 1.00 . A A . 14 ASN H 1 1
10 2133 1 1 14 ASN HA H -10.761 -1.076 0.785 1.00 . A A . 14 ASN HA 1 1
10 2134 1 1 14 ASN HB2 H -10.680 -1.698 -1.524 1.00 . A A . 14 ASN HB2 1 1
10 2135 1 1 14 ASN HB3 H -10.407 0.038 -1.457 1.00 . A A . 14 ASN HB3 1 1
10 2136 1 1 14 ASN HD21 H -9.065 -3.032 -2.217 1.00 . A A . 14 ASN HD21 1 1
10 2137 1 1 14 ASN HD22 H -7.629 -2.473 -2.973 1.00 . A A . 14 ASN HD22 1 1
10 2138 1 1 14 ASN N N -9.108 0.166 0.824 1.00 . A A . 14 ASN N 1 1
10 2139 1 1 14 ASN ND2 N -8.430 -2.312 -2.431 1.00 . A A . 14 ASN ND2 1 1
10 2140 1 1 14 ASN O O -9.503 -3.399 0.496 1.00 . A A . 14 ASN O 1 1
10 2141 1 1 14 ASN OD1 O -7.961 -0.163 -2.226 1.00 . A A . 14 ASN OD1 1 1
10 2142 2 2 1 . C C -1.655 -1.864 2.443 1.00 . B A . 101 WMH C 1 1
10 2143 2 2 1 . C1 C -0.755 0.317 2.878 1.00 . B A . 101 WMH C1 1 1
10 2144 2 2 1 . C2 C 0.442 0.807 3.291 1.00 . B A . 101 WMH C2 1 1
10 2145 2 2 1 . H1 H -2.242 -2.170 3.285 1.00 . B A . 101 WMH H1 1 1
10 2146 2 2 1 . H2 H -2.314 -1.289 1.812 1.00 . B A . 101 WMH H2 1 1
10 2147 2 2 1 . H5 H 0.689 1.851 3.415 1.00 . B A . 101 WMH H5 1 1
10 2148 2 2 1 . N N -0.663 -0.982 2.846 1.00 . B A . 101 WMH N 1 1
10 2149 2 2 1 . N1 N 1.250 -0.214 3.511 1.00 . B A . 101 WMH N1 1 1
10 2150 2 2 1 . N2 N 0.633 -1.310 3.261 1.00 . B A . 101 WMH N2 1 1
11 2151 1 1 1 GLY C C -6.173 -3.481 0.468 1.00 . A A . 1 GLY C 1 1
11 2152 1 1 1 GLY CA C -7.478 -3.089 1.121 1.00 . A A . 1 GLY CA 1 1
11 2153 1 1 1 GLY H1 H -7.595 -1.009 0.741 1.00 . A A . 1 GLY H1 1 1
11 2154 1 1 1 GLY HA2 H -7.316 -2.951 2.180 1.00 . A A . 1 GLY HA2 1 1
11 2155 1 1 1 GLY HA3 H -8.190 -3.887 0.974 1.00 . A A . 1 GLY HA3 1 1
11 2156 1 1 1 GLY N N -8.027 -1.873 0.562 1.00 . A A . 1 GLY N 1 1
11 2157 1 1 1 GLY O O -5.640 -4.576 0.707 1.00 . A A . 1 GLY O 1 1
11 2158 1 1 2 LYS C C -3.256 -2.308 -0.242 1.00 . A A . 2 LYS C 1 1
11 2159 1 1 2 LYS CA C -4.404 -2.870 -1.028 1.00 . A A . 2 LYS CA 1 1
11 2160 1 1 2 LYS CB C -4.402 -2.351 -2.467 1.00 . A A . 2 LYS CB 1 1
11 2161 1 1 2 LYS CD C -4.865 -4.602 -3.535 1.00 . A A . 2 LYS CD 1 1
11 2162 1 1 2 LYS CE C -3.476 -4.744 -4.159 1.00 . A A . 2 LYS CE 1 1
11 2163 1 1 2 LYS CG C -5.300 -3.141 -3.410 1.00 . A A . 2 LYS CG 1 1
11 2164 1 1 2 LYS H H -6.129 -1.772 -0.551 1.00 . A A . 2 LYS H 1 1
11 2165 1 1 2 LYS HA H -4.281 -3.941 -1.050 1.00 . A A . 2 LYS HA 1 1
11 2166 1 1 2 LYS HB2 H -4.752 -1.330 -2.457 1.00 . A A . 2 LYS HB2 1 1
11 2167 1 1 2 LYS HB3 H -3.399 -2.363 -2.863 1.00 . A A . 2 LYS HB3 1 1
11 2168 1 1 2 LYS HD2 H -4.863 -5.068 -2.561 1.00 . A A . 2 LYS HD2 1 1
11 2169 1 1 2 LYS HD3 H -5.580 -5.114 -4.159 1.00 . A A . 2 LYS HD3 1 1
11 2170 1 1 2 LYS HE2 H -2.762 -4.196 -3.563 1.00 . A A . 2 LYS HE2 1 1
11 2171 1 1 2 LYS HE3 H -3.209 -5.790 -4.150 1.00 . A A . 2 LYS HE3 1 1
11 2172 1 1 2 LYS HG2 H -6.311 -3.110 -3.031 1.00 . A A . 2 LYS HG2 1 1
11 2173 1 1 2 LYS HG3 H -5.269 -2.677 -4.384 1.00 . A A . 2 LYS HG3 1 1
11 2174 1 1 2 LYS HZ1 H -3.712 -3.246 -5.625 1.00 . A A . 2 LYS HZ1 1 1
11 2175 1 1 2 LYS HZ2 H -4.041 -4.793 -6.185 1.00 . A A . 2 LYS HZ2 1 1
11 2176 1 1 2 LYS HZ3 H -2.458 -4.322 -5.921 1.00 . A A . 2 LYS HZ3 1 1
11 2177 1 1 2 LYS N N -5.659 -2.613 -0.368 1.00 . A A . 2 LYS N 1 1
11 2178 1 1 2 LYS NZ N -3.425 -4.243 -5.554 1.00 . A A . 2 LYS NZ 1 1
11 2179 1 1 2 LYS O O -3.273 -1.160 0.164 1.00 . A A . 2 LYS O 1 1
11 2180 1 1 3 ALA C C 0.112 -3.247 0.022 1.00 . A A . 3 ALA C 1 1
11 2181 1 1 3 ALA CA C -1.110 -2.774 0.738 1.00 . A A . 3 ALA CA 1 1
11 2182 1 1 3 ALA CB C -1.186 -3.349 2.154 1.00 . A A . 3 ALA CB 1 1
11 2183 1 1 3 ALA H H -2.337 -4.057 -0.332 1.00 . A A . 3 ALA H 1 1
11 2184 1 1 3 ALA HA H -1.075 -1.697 0.805 1.00 . A A . 3 ALA HA 1 1
11 2185 1 1 3 ALA HB1 H -0.187 -3.569 2.500 1.00 . A A . 3 ALA HB1 1 1
11 2186 1 1 3 ALA HB2 H -1.763 -4.262 2.127 1.00 . A A . 3 ALA HB2 1 1
11 2187 1 1 3 ALA N N -2.289 -3.133 -0.003 1.00 . A A . 3 ALA N 1 1
11 2188 1 1 3 ALA O O 0.149 -4.374 -0.468 1.00 . A A . 3 ALA O 1 1
11 2189 1 1 4 LEU C C 3.434 -2.650 0.288 1.00 . A A . 4 LEU C 1 1
11 2190 1 1 4 LEU CA C 2.314 -2.734 -0.718 1.00 . A A . 4 LEU CA 1 1
11 2191 1 1 4 LEU CB C 2.560 -1.891 -2.012 1.00 . A A . 4 LEU CB 1 1
11 2192 1 1 4 LEU CD1 C 3.860 0.207 -1.332 1.00 . A A . 4 LEU CD1 1 1
11 2193 1 1 4 LEU CD2 C 2.284 0.277 -3.275 1.00 . A A . 4 LEU CD2 1 1
11 2194 1 1 4 LEU CG C 2.560 -0.341 -1.913 1.00 . A A . 4 LEU CG 1 1
11 2195 1 1 4 LEU H H 0.986 -1.481 0.277 1.00 . A A . 4 LEU H 1 1
11 2196 1 1 4 LEU HA H 2.220 -3.775 -0.995 1.00 . A A . 4 LEU HA 1 1
11 2197 1 1 4 LEU HB2 H 3.521 -2.183 -2.407 1.00 . A A . 4 LEU HB2 1 1
11 2198 1 1 4 LEU HB3 H 1.809 -2.179 -2.733 1.00 . A A . 4 LEU HB3 1 1
11 2199 1 1 4 LEU HD11 H 4.687 -0.083 -1.964 1.00 . A A . 4 LEU HD11 1 1
11 2200 1 1 4 LEU HD12 H 4.007 -0.197 -0.341 1.00 . A A . 4 LEU HD12 1 1
11 2201 1 1 4 LEU HD13 H 3.808 1.284 -1.279 1.00 . A A . 4 LEU HD13 1 1
11 2202 1 1 4 LEU HD21 H 1.322 -0.056 -3.637 1.00 . A A . 4 LEU HD21 1 1
11 2203 1 1 4 LEU HD22 H 3.052 -0.025 -3.970 1.00 . A A . 4 LEU HD22 1 1
11 2204 1 1 4 LEU HD23 H 2.283 1.354 -3.187 1.00 . A A . 4 LEU HD23 1 1
11 2205 1 1 4 LEU HG H 1.763 -0.043 -1.248 1.00 . A A . 4 LEU HG 1 1
11 2206 1 1 4 LEU N N 1.080 -2.387 -0.090 1.00 . A A . 4 LEU N 1 1
11 2207 1 1 4 LEU O O 3.495 -1.706 1.096 1.00 . A A . 4 LEU O 1 1
11 2208 1 1 5 PHE C C 6.655 -3.429 0.494 1.00 . A A . 5 PHE C 1 1
11 2209 1 1 5 PHE CA C 5.365 -3.679 1.207 1.00 . A A . 5 PHE CA 1 1
11 2210 1 1 5 PHE CB C 5.363 -4.961 2.040 1.00 . A A . 5 PHE CB 1 1
11 2211 1 1 5 PHE CD1 C 3.097 -5.921 2.555 1.00 . A A . 5 PHE CD1 1 1
11 2212 1 1 5 PHE CD2 C 3.986 -4.269 4.019 1.00 . A A . 5 PHE CD2 1 1
11 2213 1 1 5 PHE CE1 C 1.953 -5.981 3.321 1.00 . A A . 5 PHE CE1 1 1
11 2214 1 1 5 PHE CE2 C 2.851 -4.329 4.791 1.00 . A A . 5 PHE CE2 1 1
11 2215 1 1 5 PHE CG C 4.127 -5.065 2.895 1.00 . A A . 5 PHE CG 1 1
11 2216 1 1 5 PHE CZ C 1.830 -5.185 4.441 1.00 . A A . 5 PHE CZ 1 1
11 2217 1 1 5 PHE H H 4.187 -4.360 -0.370 1.00 . A A . 5 PHE H 1 1
11 2218 1 1 5 PHE HA H 5.213 -2.839 1.869 1.00 . A A . 5 PHE HA 1 1
11 2219 1 1 5 PHE HB2 H 5.399 -5.818 1.383 1.00 . A A . 5 PHE HB2 1 1
11 2220 1 1 5 PHE HB3 H 6.223 -4.968 2.692 1.00 . A A . 5 PHE HB3 1 1
11 2221 1 1 5 PHE HD1 H 3.191 -6.550 1.682 1.00 . A A . 5 PHE HD1 1 1
11 2222 1 1 5 PHE HD2 H 4.784 -3.594 4.293 1.00 . A A . 5 PHE HD2 1 1
11 2223 1 1 5 PHE HE1 H 1.155 -6.654 3.042 1.00 . A A . 5 PHE HE1 1 1
11 2224 1 1 5 PHE HE2 H 2.759 -3.705 5.668 1.00 . A A . 5 PHE HE2 1 1
11 2225 1 1 5 PHE HZ H 0.933 -5.229 5.039 1.00 . A A . 5 PHE HZ 1 1
11 2226 1 1 5 PHE N N 4.276 -3.635 0.286 1.00 . A A . 5 PHE N 1 1
11 2227 1 1 5 PHE O O 7.295 -4.329 -0.053 1.00 . A A . 5 PHE O 1 1
11 2228 1 1 6 SER C C 8.235 -0.231 0.388 1.00 . A A . 6 SER C 1 1
11 2229 1 1 6 SER CA C 8.104 -1.621 -0.213 1.00 . A A . 6 SER CA 1 1
11 2230 1 1 6 SER CB C 7.896 -1.548 -1.746 1.00 . A A . 6 SER CB 1 1
11 2231 1 1 6 SER H H 6.328 -1.529 0.812 1.00 . A A . 6 SER H 1 1
11 2232 1 1 6 SER HA H 8.966 -2.224 0.031 1.00 . A A . 6 SER HA 1 1
11 2233 1 1 6 SER HB2 H 7.056 -0.906 -1.962 1.00 . A A . 6 SER HB2 1 1
11 2234 1 1 6 SER HB3 H 8.784 -1.147 -2.212 1.00 . A A . 6 SER HB3 1 1
11 2235 1 1 6 SER HG H 7.638 -3.459 -1.546 1.00 . A A . 6 SER HG 1 1
11 2236 1 1 6 SER N N 6.945 -2.174 0.404 1.00 . A A . 6 SER N 1 1
11 2237 1 1 6 SER O O 7.588 0.048 1.413 1.00 . A A . 6 SER O 1 1
11 2238 1 1 6 SER OG O 7.635 -2.844 -2.296 1.00 . A A . 6 SER OG 1 1
11 2239 1 1 7 ASN C C 8.904 2.969 -0.799 1.00 . A A . 7 ASN C 1 1
11 2240 1 1 7 ASN CA C 9.146 1.969 0.318 1.00 . A A . 7 ASN CA 1 1
11 2241 1 1 7 ASN CB C 10.511 2.187 0.993 1.00 . A A . 7 ASN CB 1 1
11 2242 1 1 7 ASN CG C 10.701 3.606 1.498 1.00 . A A . 7 ASN CG 1 1
11 2243 1 1 7 ASN H H 9.539 0.384 -0.990 1.00 . A A . 7 ASN H 1 1
11 2244 1 1 7 ASN HA H 8.366 2.094 1.054 1.00 . A A . 7 ASN HA 1 1
11 2245 1 1 7 ASN HB2 H 10.598 1.514 1.833 1.00 . A A . 7 ASN HB2 1 1
11 2246 1 1 7 ASN HB3 H 11.292 1.968 0.279 1.00 . A A . 7 ASN HB3 1 1
11 2247 1 1 7 ASN HD21 H 11.688 4.095 -0.147 1.00 . A A . 7 ASN HD21 1 1
11 2248 1 1 7 ASN HD22 H 11.474 5.353 1.023 1.00 . A A . 7 ASN HD22 1 1
11 2249 1 1 7 ASN N N 9.022 0.624 -0.189 1.00 . A A . 7 ASN N 1 1
11 2250 1 1 7 ASN ND2 N 11.354 4.429 0.715 1.00 . A A . 7 ASN ND2 1 1
11 2251 1 1 7 ASN O O 9.421 2.792 -1.901 1.00 . A A . 7 ASN O 1 1
11 2252 1 1 7 ASN OD1 O 10.285 3.943 2.609 1.00 . A A . 7 ASN OD1 1 1
11 2253 1 1 8 PRO C C 6.188 3.326 0.912 1.00 . A A . 8 PRO C 1 1
11 2254 1 1 8 PRO CA C 7.396 4.257 0.716 1.00 . A A . 8 PRO CA 1 1
11 2255 1 1 8 PRO CB C 6.916 5.718 0.591 1.00 . A A . 8 PRO CB 1 1
11 2256 1 1 8 PRO CD C 7.777 5.057 -1.533 1.00 . A A . 8 PRO CD 1 1
11 2257 1 1 8 PRO CG C 7.567 6.243 -0.650 1.00 . A A . 8 PRO CG 1 1
11 2258 1 1 8 PRO HA H 8.072 4.165 1.554 1.00 . A A . 8 PRO HA 1 1
11 2259 1 1 8 PRO HB2 H 5.840 5.732 0.507 1.00 . A A . 8 PRO HB2 1 1
11 2260 1 1 8 PRO HB3 H 7.218 6.277 1.464 1.00 . A A . 8 PRO HB3 1 1
11 2261 1 1 8 PRO HD2 H 6.875 4.824 -2.079 1.00 . A A . 8 PRO HD2 1 1
11 2262 1 1 8 PRO HD3 H 8.604 5.218 -2.207 1.00 . A A . 8 PRO HD3 1 1
11 2263 1 1 8 PRO HG2 H 6.918 6.958 -1.133 1.00 . A A . 8 PRO HG2 1 1
11 2264 1 1 8 PRO HG3 H 8.513 6.700 -0.404 1.00 . A A . 8 PRO HG3 1 1
11 2265 1 1 8 PRO N N 8.088 4.011 -0.565 1.00 . A A . 8 PRO N 1 1
11 2266 1 1 8 PRO O O 5.392 3.137 -0.011 1.00 . A A . 8 PRO O 1 1
11 2267 1 1 9 PRO C C 3.627 2.577 2.545 1.00 . A A . 9 PRO C 1 1
11 2268 1 1 9 PRO CA C 4.939 1.821 2.392 1.00 . A A . 9 PRO CA 1 1
11 2269 1 1 9 PRO CB C 5.331 1.153 3.715 1.00 . A A . 9 PRO CB 1 1
11 2270 1 1 9 PRO CD C 6.952 2.880 3.268 1.00 . A A . 9 PRO CD 1 1
11 2271 1 1 9 PRO CG C 6.279 2.101 4.370 1.00 . A A . 9 PRO CG 1 1
11 2272 1 1 9 PRO HA H 4.834 1.075 1.618 1.00 . A A . 9 PRO HA 1 1
11 2273 1 1 9 PRO HB2 H 4.444 1.000 4.312 1.00 . A A . 9 PRO HB2 1 1
11 2274 1 1 9 PRO HB3 H 5.799 0.201 3.510 1.00 . A A . 9 PRO HB3 1 1
11 2275 1 1 9 PRO HD2 H 7.043 3.920 3.548 1.00 . A A . 9 PRO HD2 1 1
11 2276 1 1 9 PRO HD3 H 7.926 2.462 3.059 1.00 . A A . 9 PRO HD3 1 1
11 2277 1 1 9 PRO HG2 H 5.729 2.767 5.019 1.00 . A A . 9 PRO HG2 1 1
11 2278 1 1 9 PRO HG3 H 7.010 1.550 4.944 1.00 . A A . 9 PRO HG3 1 1
11 2279 1 1 9 PRO N N 6.046 2.724 2.107 1.00 . A A . 9 PRO N 1 1
11 2280 1 1 9 PRO O O 3.467 3.417 3.451 1.00 . A A . 9 PRO O 1 1
11 2281 1 1 10 ILE C C 0.335 1.926 1.500 1.00 . A A . 10 ILE C 1 1
11 2282 1 1 10 ILE CA C 1.435 2.960 1.682 1.00 . A A . 10 ILE CA 1 1
11 2283 1 1 10 ILE CB C 1.348 4.080 0.583 1.00 . A A . 10 ILE CB 1 1
11 2284 1 1 10 ILE CD1 C -0.172 5.914 -0.401 1.00 . A A . 10 ILE CD1 1 1
11 2285 1 1 10 ILE CG1 C -0.032 4.776 0.594 1.00 . A A . 10 ILE CG1 1 1
11 2286 1 1 10 ILE CG2 C 1.683 3.531 -0.808 1.00 . A A . 10 ILE CG2 1 1
11 2287 1 1 10 ILE H H 2.869 1.632 0.977 1.00 . A A . 10 ILE H 1 1
11 2288 1 1 10 ILE HA H 1.315 3.418 2.652 1.00 . A A . 10 ILE HA 1 1
11 2289 1 1 10 ILE HB H 2.106 4.811 0.820 1.00 . A A . 10 ILE HB 1 1
11 2290 1 1 10 ILE HD11 H -0.013 5.540 -1.402 1.00 . A A . 10 ILE HD11 1 1
11 2291 1 1 10 ILE HD12 H 0.562 6.677 -0.181 1.00 . A A . 10 ILE HD12 1 1
11 2292 1 1 10 ILE HD13 H -1.162 6.337 -0.326 1.00 . A A . 10 ILE HD13 1 1
11 2293 1 1 10 ILE HG12 H -0.792 4.045 0.360 1.00 . A A . 10 ILE HG12 1 1
11 2294 1 1 10 ILE HG13 H -0.217 5.167 1.583 1.00 . A A . 10 ILE HG13 1 1
11 2295 1 1 10 ILE HG21 H 2.690 3.141 -0.806 1.00 . A A . 10 ILE HG21 1 1
11 2296 1 1 10 ILE HG22 H 1.603 4.323 -1.536 1.00 . A A . 10 ILE HG22 1 1
11 2297 1 1 10 ILE HG23 H 0.990 2.740 -1.057 1.00 . A A . 10 ILE HG23 1 1
11 2298 1 1 10 ILE N N 2.710 2.308 1.669 1.00 . A A . 10 ILE N 1 1
11 2299 1 1 10 ILE O O 0.499 0.944 0.745 1.00 . A A . 10 ILE O 1 1
11 2300 1 1 11 ALA C C -3.016 2.012 1.617 1.00 . A A . 11 ALA C 1 1
11 2301 1 1 11 ALA CA C -1.854 1.228 2.132 1.00 . A A . 11 ALA CA 1 1
11 2302 1 1 11 ALA CB C -2.180 0.537 3.457 1.00 . A A . 11 ALA CB 1 1
11 2303 1 1 11 ALA H H -0.784 2.826 2.886 1.00 . A A . 11 ALA H 1 1
11 2304 1 1 11 ALA HA H -1.614 0.466 1.402 1.00 . A A . 11 ALA HA 1 1
11 2305 1 1 11 ALA HB1 H -3.029 -0.113 3.311 1.00 . A A . 11 ALA HB1 1 1
11 2306 1 1 11 ALA HB2 H -2.438 1.232 4.235 1.00 . A A . 11 ALA HB2 1 1
11 2307 1 1 11 ALA N N -0.730 2.089 2.240 1.00 . A A . 11 ALA N 1 1
11 2308 1 1 11 ALA O O -3.124 3.214 1.865 1.00 . A A . 11 ALA O 1 1
11 2309 1 1 12 PHE C C -6.236 1.526 0.897 1.00 . A A . 12 PHE C 1 1
11 2310 1 1 12 PHE CA C -4.943 2.007 0.248 1.00 . A A . 12 PHE CA 1 1
11 2311 1 1 12 PHE CB C -4.919 1.703 -1.257 1.00 . A A . 12 PHE CB 1 1
11 2312 1 1 12 PHE CD1 C -2.570 1.207 -2.042 1.00 . A A . 12 PHE CD1 1 1
11 2313 1 1 12 PHE CD2 C -3.471 3.374 -2.471 1.00 . A A . 12 PHE CD2 1 1
11 2314 1 1 12 PHE CE1 C -1.388 1.568 -2.652 1.00 . A A . 12 PHE CE1 1 1
11 2315 1 1 12 PHE CE2 C -2.288 3.740 -3.086 1.00 . A A . 12 PHE CE2 1 1
11 2316 1 1 12 PHE CG C -3.628 2.104 -1.940 1.00 . A A . 12 PHE CG 1 1
11 2317 1 1 12 PHE CZ C -1.246 2.837 -3.177 1.00 . A A . 12 PHE CZ 1 1
11 2318 1 1 12 PHE H H -3.707 0.404 0.750 1.00 . A A . 12 PHE H 1 1
11 2319 1 1 12 PHE HA H -4.822 3.067 0.395 1.00 . A A . 12 PHE HA 1 1
11 2320 1 1 12 PHE HB2 H -5.062 0.644 -1.405 1.00 . A A . 12 PHE HB2 1 1
11 2321 1 1 12 PHE HB3 H -5.729 2.240 -1.728 1.00 . A A . 12 PHE HB3 1 1
11 2322 1 1 12 PHE HD1 H -2.679 0.214 -1.630 1.00 . A A . 12 PHE HD1 1 1
11 2323 1 1 12 PHE HD2 H -4.283 4.082 -2.404 1.00 . A A . 12 PHE HD2 1 1
11 2324 1 1 12 PHE HE1 H -0.576 0.860 -2.722 1.00 . A A . 12 PHE HE1 1 1
11 2325 1 1 12 PHE HE2 H -2.178 4.733 -3.497 1.00 . A A . 12 PHE HE2 1 1
11 2326 1 1 12 PHE HZ H -0.322 3.126 -3.656 1.00 . A A . 12 PHE HZ 1 1
11 2327 1 1 12 PHE N N -3.840 1.371 0.880 1.00 . A A . 12 PHE N 1 1
11 2328 1 1 12 PHE O O -6.342 0.336 1.253 1.00 . A A . 12 PHE O 1 1
11 2329 1 1 13 PRO C C -9.343 0.994 1.122 1.00 . A A . 13 PRO C 1 1
11 2330 1 1 13 PRO CA C -8.513 2.119 1.773 1.00 . A A . 13 PRO CA 1 1
11 2331 1 1 13 PRO CB C -9.286 3.439 1.717 1.00 . A A . 13 PRO CB 1 1
11 2332 1 1 13 PRO CD C -7.189 3.845 0.664 1.00 . A A . 13 PRO CD 1 1
11 2333 1 1 13 PRO CG C -8.244 4.482 1.513 1.00 . A A . 13 PRO CG 1 1
11 2334 1 1 13 PRO HA H -8.335 1.858 2.806 1.00 . A A . 13 PRO HA 1 1
11 2335 1 1 13 PRO HB2 H -9.988 3.412 0.898 1.00 . A A . 13 PRO HB2 1 1
11 2336 1 1 13 PRO HB3 H -9.816 3.592 2.646 1.00 . A A . 13 PRO HB3 1 1
11 2337 1 1 13 PRO HD2 H -7.432 3.953 -0.384 1.00 . A A . 13 PRO HD2 1 1
11 2338 1 1 13 PRO HD3 H -6.233 4.294 0.884 1.00 . A A . 13 PRO HD3 1 1
11 2339 1 1 13 PRO HG2 H -8.670 5.338 1.011 1.00 . A A . 13 PRO HG2 1 1
11 2340 1 1 13 PRO HG3 H -7.828 4.775 2.466 1.00 . A A . 13 PRO HG3 1 1
11 2341 1 1 13 PRO N N -7.231 2.428 1.085 1.00 . A A . 13 PRO N 1 1
11 2342 1 1 13 PRO O O -10.346 0.558 1.676 1.00 . A A . 13 PRO O 1 1
11 2343 1 1 14 ASN C C -9.119 -1.903 -0.178 1.00 . A A . 14 ASN C 1 1
11 2344 1 1 14 ASN CA C -9.620 -0.566 -0.708 1.00 . A A . 14 ASN CA 1 1
11 2345 1 1 14 ASN CB C -9.447 -0.514 -2.241 1.00 . A A . 14 ASN CB 1 1
11 2346 1 1 14 ASN CG C -8.011 -0.704 -2.717 1.00 . A A . 14 ASN CG 1 1
11 2347 1 1 14 ASN H H -8.157 0.954 -0.469 1.00 . A A . 14 ASN H 1 1
11 2348 1 1 14 ASN HA H -10.670 -0.481 -0.471 1.00 . A A . 14 ASN HA 1 1
11 2349 1 1 14 ASN HB2 H -10.042 -1.298 -2.683 1.00 . A A . 14 ASN HB2 1 1
11 2350 1 1 14 ASN HB3 H -9.806 0.438 -2.598 1.00 . A A . 14 ASN HB3 1 1
11 2351 1 1 14 ASN HD21 H -8.638 -1.490 -4.421 1.00 . A A . 14 ASN HD21 1 1
11 2352 1 1 14 ASN HD22 H -6.946 -1.349 -4.257 1.00 . A A . 14 ASN HD22 1 1
11 2353 1 1 14 ASN N N -8.935 0.537 -0.041 1.00 . A A . 14 ASN N 1 1
11 2354 1 1 14 ASN ND2 N -7.851 -1.231 -3.897 1.00 . A A . 14 ASN ND2 1 1
11 2355 1 1 14 ASN O O -9.713 -2.944 -0.442 1.00 . A A . 14 ASN O 1 1
11 2356 1 1 14 ASN OD1 O -7.055 -0.375 -2.021 1.00 . A A . 14 ASN OD1 1 1
11 2357 2 2 1 . C C -1.836 -2.406 3.138 1.00 . B A . 101 WMH C 1 1
11 2358 2 2 1 . C1 C -1.046 -0.301 3.969 1.00 . B A . 101 WMH C1 1 1
11 2359 2 2 1 . C2 C 0.070 0.133 4.616 1.00 . B A . 101 WMH C2 1 1
11 2360 2 2 1 . H1 H -2.537 -2.812 3.843 1.00 . B A . 101 WMH H1 1 1
11 2361 2 2 1 . H2 H -2.413 -1.742 2.513 1.00 . B A . 101 WMH H2 1 1
11 2362 2 2 1 . H5 H 0.279 1.152 4.907 1.00 . B A . 101 WMH H5 1 1
11 2363 2 2 1 . N N -0.927 -1.589 3.789 1.00 . B A . 101 WMH N 1 1
11 2364 2 2 1 . N1 N 0.858 -0.921 4.825 1.00 . B A . 101 WMH N1 1 1
11 2365 2 2 1 . N2 N 0.296 -1.976 4.346 1.00 . B A . 101 WMH N2 1 1
12 2366 1 1 1 GLY C C -6.023 -3.617 0.571 1.00 . A A . 1 GLY C 1 1
12 2367 1 1 1 GLY CA C -7.311 -3.255 1.276 1.00 . A A . 1 GLY CA 1 1
12 2368 1 1 1 GLY H1 H -7.572 -1.183 1.018 1.00 . A A . 1 GLY H1 1 1
12 2369 1 1 1 GLY HA2 H -7.114 -3.113 2.328 1.00 . A A . 1 GLY HA2 1 1
12 2370 1 1 1 GLY HA3 H -8.007 -4.073 1.163 1.00 . A A . 1 GLY HA3 1 1
12 2371 1 1 1 GLY N N -7.914 -2.062 0.740 1.00 . A A . 1 GLY N 1 1
12 2372 1 1 1 GLY O O -5.479 -4.694 0.779 1.00 . A A . 1 GLY O 1 1
12 2373 1 1 2 LYS C C -3.180 -2.301 -0.250 1.00 . A A . 2 LYS C 1 1
12 2374 1 1 2 LYS CA C -4.315 -2.987 -0.983 1.00 . A A . 2 LYS CA 1 1
12 2375 1 1 2 LYS CB C -4.407 -2.484 -2.426 1.00 . A A . 2 LYS CB 1 1
12 2376 1 1 2 LYS CD C -3.302 -2.157 -4.645 1.00 . A A . 2 LYS CD 1 1
12 2377 1 1 2 LYS CE C -2.043 -2.376 -5.465 1.00 . A A . 2 LYS CE 1 1
12 2378 1 1 2 LYS CG C -3.157 -2.720 -3.247 1.00 . A A . 2 LYS CG 1 1
12 2379 1 1 2 LYS H H -6.030 -1.904 -0.432 1.00 . A A . 2 LYS H 1 1
12 2380 1 1 2 LYS HA H -4.141 -4.052 -0.988 1.00 . A A . 2 LYS HA 1 1
12 2381 1 1 2 LYS HB2 H -5.230 -2.981 -2.916 1.00 . A A . 2 LYS HB2 1 1
12 2382 1 1 2 LYS HB3 H -4.607 -1.422 -2.410 1.00 . A A . 2 LYS HB3 1 1
12 2383 1 1 2 LYS HD2 H -4.135 -2.635 -5.137 1.00 . A A . 2 LYS HD2 1 1
12 2384 1 1 2 LYS HD3 H -3.489 -1.097 -4.566 1.00 . A A . 2 LYS HD3 1 1
12 2385 1 1 2 LYS HE2 H -2.193 -1.957 -6.449 1.00 . A A . 2 LYS HE2 1 1
12 2386 1 1 2 LYS HE3 H -1.221 -1.866 -4.983 1.00 . A A . 2 LYS HE3 1 1
12 2387 1 1 2 LYS HG2 H -2.320 -2.242 -2.759 1.00 . A A . 2 LYS HG2 1 1
12 2388 1 1 2 LYS HG3 H -2.982 -3.782 -3.311 1.00 . A A . 2 LYS HG3 1 1
12 2389 1 1 2 LYS HZ1 H -0.866 -3.914 -6.219 1.00 . A A . 2 LYS HZ1 1 1
12 2390 1 1 2 LYS HZ2 H -2.485 -4.358 -6.015 1.00 . A A . 2 LYS HZ2 1 1
12 2391 1 1 2 LYS HZ3 H -1.470 -4.246 -4.699 1.00 . A A . 2 LYS HZ3 1 1
12 2392 1 1 2 LYS N N -5.548 -2.744 -0.278 1.00 . A A . 2 LYS N 1 1
12 2393 1 1 2 LYS NZ N -1.705 -3.803 -5.613 1.00 . A A . 2 LYS NZ 1 1
12 2394 1 1 2 LYS O O -3.246 -1.113 0.031 1.00 . A A . 2 LYS O 1 1
12 2395 1 1 3 ALA C C 0.253 -2.820 0.041 1.00 . A A . 3 ALA C 1 1
12 2396 1 1 3 ALA CA C -1.022 -2.514 0.768 1.00 . A A . 3 ALA CA 1 1
12 2397 1 1 3 ALA CB C -0.999 -3.039 2.211 1.00 . A A . 3 ALA CB 1 1
12 2398 1 1 3 ALA H H -2.151 -3.987 -0.199 1.00 . A A . 3 ALA H 1 1
12 2399 1 1 3 ALA HA H -1.132 -1.441 0.800 1.00 . A A . 3 ALA HA 1 1
12 2400 1 1 3 ALA HB1 H 0.026 -3.110 2.542 1.00 . A A . 3 ALA HB1 1 1
12 2401 1 1 3 ALA HB2 H -1.448 -4.020 2.235 1.00 . A A . 3 ALA HB2 1 1
12 2402 1 1 3 ALA N N -2.163 -3.040 0.060 1.00 . A A . 3 ALA N 1 1
12 2403 1 1 3 ALA O O 0.461 -3.938 -0.424 1.00 . A A . 3 ALA O 1 1
12 2404 1 1 4 LEU C C 3.427 -2.124 0.274 1.00 . A A . 4 LEU C 1 1
12 2405 1 1 4 LEU CA C 2.351 -1.991 -0.752 1.00 . A A . 4 LEU CA 1 1
12 2406 1 1 4 LEU CB C 2.676 -0.815 -1.685 1.00 . A A . 4 LEU CB 1 1
12 2407 1 1 4 LEU CD1 C 2.147 0.632 -3.655 1.00 . A A . 4 LEU CD1 1 1
12 2408 1 1 4 LEU CD2 C 1.764 -1.831 -3.792 1.00 . A A . 4 LEU CD2 1 1
12 2409 1 1 4 LEU CG C 1.749 -0.612 -2.879 1.00 . A A . 4 LEU CG 1 1
12 2410 1 1 4 LEU H H 0.865 -0.933 0.261 1.00 . A A . 4 LEU H 1 1
12 2411 1 1 4 LEU HA H 2.311 -2.897 -1.335 1.00 . A A . 4 LEU HA 1 1
12 2412 1 1 4 LEU HB2 H 2.660 0.091 -1.095 1.00 . A A . 4 LEU HB2 1 1
12 2413 1 1 4 LEU HB3 H 3.680 -0.954 -2.057 1.00 . A A . 4 LEU HB3 1 1
12 2414 1 1 4 LEU HD11 H 1.486 0.754 -4.500 1.00 . A A . 4 LEU HD11 1 1
12 2415 1 1 4 LEU HD12 H 3.164 0.527 -4.003 1.00 . A A . 4 LEU HD12 1 1
12 2416 1 1 4 LEU HD13 H 2.075 1.497 -3.012 1.00 . A A . 4 LEU HD13 1 1
12 2417 1 1 4 LEU HD21 H 1.424 -2.697 -3.247 1.00 . A A . 4 LEU HD21 1 1
12 2418 1 1 4 LEU HD22 H 2.769 -2.000 -4.148 1.00 . A A . 4 LEU HD22 1 1
12 2419 1 1 4 LEU HD23 H 1.109 -1.656 -4.634 1.00 . A A . 4 LEU HD23 1 1
12 2420 1 1 4 LEU HG H 0.749 -0.479 -2.503 1.00 . A A . 4 LEU HG 1 1
12 2421 1 1 4 LEU N N 1.084 -1.824 -0.096 1.00 . A A . 4 LEU N 1 1
12 2422 1 1 4 LEU O O 3.815 -1.138 0.921 1.00 . A A . 4 LEU O 1 1
12 2423 1 1 5 PHE C C 6.258 -3.360 0.594 1.00 . A A . 5 PHE C 1 1
12 2424 1 1 5 PHE CA C 4.975 -3.571 1.357 1.00 . A A . 5 PHE CA 1 1
12 2425 1 1 5 PHE CB C 4.883 -4.954 2.009 1.00 . A A . 5 PHE CB 1 1
12 2426 1 1 5 PHE CD1 C 2.560 -5.818 2.456 1.00 . A A . 5 PHE CD1 1 1
12 2427 1 1 5 PHE CD2 C 3.609 -4.467 4.106 1.00 . A A . 5 PHE CD2 1 1
12 2428 1 1 5 PHE CE1 C 1.435 -5.912 3.248 1.00 . A A . 5 PHE CE1 1 1
12 2429 1 1 5 PHE CE2 C 2.491 -4.560 4.904 1.00 . A A . 5 PHE CE2 1 1
12 2430 1 1 5 PHE CG C 3.662 -5.094 2.877 1.00 . A A . 5 PHE CG 1 1
12 2431 1 1 5 PHE CZ C 1.403 -5.282 4.475 1.00 . A A . 5 PHE CZ 1 1
12 2432 1 1 5 PHE H H 3.477 -4.084 -0.006 1.00 . A A . 5 PHE H 1 1
12 2433 1 1 5 PHE HA H 4.924 -2.805 2.118 1.00 . A A . 5 PHE HA 1 1
12 2434 1 1 5 PHE HB2 H 4.838 -5.710 1.238 1.00 . A A . 5 PHE HB2 1 1
12 2435 1 1 5 PHE HB3 H 5.754 -5.125 2.625 1.00 . A A . 5 PHE HB3 1 1
12 2436 1 1 5 PHE HD1 H 2.584 -6.316 1.498 1.00 . A A . 5 PHE HD1 1 1
12 2437 1 1 5 PHE HD2 H 4.466 -3.900 4.440 1.00 . A A . 5 PHE HD2 1 1
12 2438 1 1 5 PHE HE1 H 0.581 -6.480 2.909 1.00 . A A . 5 PHE HE1 1 1
12 2439 1 1 5 PHE HE2 H 2.469 -4.066 5.865 1.00 . A A . 5 PHE HE2 1 1
12 2440 1 1 5 PHE HZ H 0.526 -5.350 5.102 1.00 . A A . 5 PHE HZ 1 1
12 2441 1 1 5 PHE N N 3.883 -3.327 0.468 1.00 . A A . 5 PHE N 1 1
12 2442 1 1 5 PHE O O 6.919 -4.294 0.140 1.00 . A A . 5 PHE O 1 1
12 2443 1 1 6 SER C C 7.968 -0.280 0.170 1.00 . A A . 6 SER C 1 1
12 2444 1 1 6 SER CA C 7.610 -1.632 -0.396 1.00 . A A . 6 SER CA 1 1
12 2445 1 1 6 SER CB C 7.172 -1.507 -1.874 1.00 . A A . 6 SER CB 1 1
12 2446 1 1 6 SER H H 5.919 -1.439 0.756 1.00 . A A . 6 SER H 1 1
12 2447 1 1 6 SER HA H 8.433 -2.323 -0.317 1.00 . A A . 6 SER HA 1 1
12 2448 1 1 6 SER HB2 H 6.279 -0.897 -1.927 1.00 . A A . 6 SER HB2 1 1
12 2449 1 1 6 SER HB3 H 7.959 -1.058 -2.462 1.00 . A A . 6 SER HB3 1 1
12 2450 1 1 6 SER HG H 7.404 -3.406 -1.922 1.00 . A A . 6 SER HG 1 1
12 2451 1 1 6 SER N N 6.516 -2.116 0.364 1.00 . A A . 6 SER N 1 1
12 2452 1 1 6 SER O O 7.416 0.107 1.194 1.00 . A A . 6 SER O 1 1
12 2453 1 1 6 SER OG O 6.852 -2.784 -2.418 1.00 . A A . 6 SER OG 1 1
12 2454 1 1 7 ASN C C 8.626 2.767 -0.983 1.00 . A A . 7 ASN C 1 1
12 2455 1 1 7 ASN CA C 9.192 1.755 0.007 1.00 . A A . 7 ASN CA 1 1
12 2456 1 1 7 ASN CB C 10.710 1.977 0.230 1.00 . A A . 7 ASN CB 1 1
12 2457 1 1 7 ASN CG C 11.569 1.826 -1.018 1.00 . A A . 7 ASN CG 1 1
12 2458 1 1 7 ASN H H 9.366 0.045 -1.209 1.00 . A A . 7 ASN H 1 1
12 2459 1 1 7 ASN HA H 8.673 1.867 0.947 1.00 . A A . 7 ASN HA 1 1
12 2460 1 1 7 ASN HB2 H 10.860 2.979 0.604 1.00 . A A . 7 ASN HB2 1 1
12 2461 1 1 7 ASN HB3 H 11.054 1.275 0.976 1.00 . A A . 7 ASN HB3 1 1
12 2462 1 1 7 ASN HD21 H 11.935 -0.072 -0.595 1.00 . A A . 7 ASN HD21 1 1
12 2463 1 1 7 ASN HD22 H 12.666 0.535 -2.029 1.00 . A A . 7 ASN HD22 1 1
12 2464 1 1 7 ASN N N 8.882 0.418 -0.441 1.00 . A A . 7 ASN N 1 1
12 2465 1 1 7 ASN ND2 N 12.103 0.653 -1.234 1.00 . A A . 7 ASN ND2 1 1
12 2466 1 1 7 ASN O O 8.853 2.647 -2.196 1.00 . A A . 7 ASN O 1 1
12 2467 1 1 7 ASN OD1 O 11.779 2.776 -1.760 1.00 . A A . 7 ASN OD1 1 1
12 2468 1 1 8 PRO C C 6.221 3.022 1.208 1.00 . A A . 8 PRO C 1 1
12 2469 1 1 8 PRO CA C 7.448 3.888 0.886 1.00 . A A . 8 PRO CA 1 1
12 2470 1 1 8 PRO CB C 7.071 5.387 0.997 1.00 . A A . 8 PRO CB 1 1
12 2471 1 1 8 PRO CD C 7.235 4.791 -1.322 1.00 . A A . 8 PRO CD 1 1
12 2472 1 1 8 PRO CG C 7.234 5.956 -0.381 1.00 . A A . 8 PRO CG 1 1
12 2473 1 1 8 PRO HA H 8.257 3.662 1.562 1.00 . A A . 8 PRO HA 1 1
12 2474 1 1 8 PRO HB2 H 6.051 5.474 1.342 1.00 . A A . 8 PRO HB2 1 1
12 2475 1 1 8 PRO HB3 H 7.732 5.871 1.701 1.00 . A A . 8 PRO HB3 1 1
12 2476 1 1 8 PRO HD2 H 6.225 4.528 -1.601 1.00 . A A . 8 PRO HD2 1 1
12 2477 1 1 8 PRO HD3 H 7.831 4.996 -2.198 1.00 . A A . 8 PRO HD3 1 1
12 2478 1 1 8 PRO HG2 H 6.411 6.618 -0.606 1.00 . A A . 8 PRO HG2 1 1
12 2479 1 1 8 PRO HG3 H 8.170 6.490 -0.446 1.00 . A A . 8 PRO HG3 1 1
12 2480 1 1 8 PRO N N 7.835 3.743 -0.515 1.00 . A A . 8 PRO N 1 1
12 2481 1 1 8 PRO O O 5.375 2.796 0.332 1.00 . A A . 8 PRO O 1 1
12 2482 1 1 9 PRO C C 3.692 2.478 2.838 1.00 . A A . 9 PRO C 1 1
12 2483 1 1 9 PRO CA C 4.989 1.670 2.845 1.00 . A A . 9 PRO CA 1 1
12 2484 1 1 9 PRO CB C 5.343 1.209 4.265 1.00 . A A . 9 PRO CB 1 1
12 2485 1 1 9 PRO CD C 7.141 2.599 3.496 1.00 . A A . 9 PRO CD 1 1
12 2486 1 1 9 PRO CG C 6.425 2.129 4.726 1.00 . A A . 9 PRO CG 1 1
12 2487 1 1 9 PRO HA H 4.874 0.817 2.192 1.00 . A A . 9 PRO HA 1 1
12 2488 1 1 9 PRO HB2 H 4.469 1.287 4.893 1.00 . A A . 9 PRO HB2 1 1
12 2489 1 1 9 PRO HB3 H 5.682 0.184 4.238 1.00 . A A . 9 PRO HB3 1 1
12 2490 1 1 9 PRO HD2 H 7.462 3.623 3.615 1.00 . A A . 9 PRO HD2 1 1
12 2491 1 1 9 PRO HD3 H 7.987 1.961 3.287 1.00 . A A . 9 PRO HD3 1 1
12 2492 1 1 9 PRO HG2 H 5.996 2.964 5.257 1.00 . A A . 9 PRO HG2 1 1
12 2493 1 1 9 PRO HG3 H 7.107 1.596 5.373 1.00 . A A . 9 PRO HG3 1 1
12 2494 1 1 9 PRO N N 6.129 2.487 2.435 1.00 . A A . 9 PRO N 1 1
12 2495 1 1 9 PRO O O 3.459 3.336 3.716 1.00 . A A . 9 PRO O 1 1
12 2496 1 1 10 ILE C C 0.502 1.976 1.438 1.00 . A A . 10 ILE C 1 1
12 2497 1 1 10 ILE CA C 1.650 2.960 1.663 1.00 . A A . 10 ILE CA 1 1
12 2498 1 1 10 ILE CB C 1.766 3.985 0.472 1.00 . A A . 10 ILE CB 1 1
12 2499 1 1 10 ILE CD1 C 0.215 5.747 1.492 1.00 . A A . 10 ILE CD1 1 1
12 2500 1 1 10 ILE CG1 C 0.495 4.837 0.314 1.00 . A A . 10 ILE CG1 1 1
12 2501 1 1 10 ILE CG2 C 2.114 3.296 -0.845 1.00 . A A . 10 ILE CG2 1 1
12 2502 1 1 10 ILE H H 3.112 1.535 1.197 1.00 . A A . 10 ILE H 1 1
12 2503 1 1 10 ILE HA H 1.461 3.508 2.575 1.00 . A A . 10 ILE HA 1 1
12 2504 1 1 10 ILE HB H 2.590 4.640 0.706 1.00 . A A . 10 ILE HB 1 1
12 2505 1 1 10 ILE HD11 H 1.044 6.425 1.628 1.00 . A A . 10 ILE HD11 1 1
12 2506 1 1 10 ILE HD12 H 0.078 5.156 2.383 1.00 . A A . 10 ILE HD12 1 1
12 2507 1 1 10 ILE HD13 H -0.683 6.315 1.297 1.00 . A A . 10 ILE HD13 1 1
12 2508 1 1 10 ILE HG12 H 0.588 5.456 -0.565 1.00 . A A . 10 ILE HG12 1 1
12 2509 1 1 10 ILE HG13 H -0.353 4.177 0.194 1.00 . A A . 10 ILE HG13 1 1
12 2510 1 1 10 ILE HG21 H 2.183 4.032 -1.632 1.00 . A A . 10 ILE HG21 1 1
12 2511 1 1 10 ILE HG22 H 1.344 2.579 -1.088 1.00 . A A . 10 ILE HG22 1 1
12 2512 1 1 10 ILE HG23 H 3.060 2.785 -0.744 1.00 . A A . 10 ILE HG23 1 1
12 2513 1 1 10 ILE N N 2.877 2.236 1.842 1.00 . A A . 10 ILE N 1 1
12 2514 1 1 10 ILE O O 0.668 0.939 0.763 1.00 . A A . 10 ILE O 1 1
12 2515 1 1 11 ALA C C -2.904 2.170 1.281 1.00 . A A . 11 ALA C 1 1
12 2516 1 1 11 ALA CA C -1.771 1.411 1.910 1.00 . A A . 11 ALA CA 1 1
12 2517 1 1 11 ALA CB C -2.193 0.807 3.259 1.00 . A A . 11 ALA CB 1 1
12 2518 1 1 11 ALA H H -0.704 3.059 2.599 1.00 . A A . 11 ALA H 1 1
12 2519 1 1 11 ALA HA H -1.504 0.592 1.254 1.00 . A A . 11 ALA HA 1 1
12 2520 1 1 11 ALA HB1 H -3.014 0.128 3.094 1.00 . A A . 11 ALA HB1 1 1
12 2521 1 1 11 ALA HB2 H -2.535 1.537 3.970 1.00 . A A . 11 ALA HB2 1 1
12 2522 1 1 11 ALA N N -0.624 2.254 2.041 1.00 . A A . 11 ALA N 1 1
12 2523 1 1 11 ALA O O -2.943 3.410 1.327 1.00 . A A . 11 ALA O 1 1
12 2524 1 1 12 PHE C C -6.167 1.524 0.745 1.00 . A A . 12 PHE C 1 1
12 2525 1 1 12 PHE CA C -4.929 2.001 0.003 1.00 . A A . 12 PHE CA 1 1
12 2526 1 1 12 PHE CB C -4.993 1.529 -1.463 1.00 . A A . 12 PHE CB 1 1
12 2527 1 1 12 PHE CD1 C -2.692 1.105 -2.390 1.00 . A A . 12 PHE CD1 1 1
12 2528 1 1 12 PHE CD2 C -3.856 3.058 -3.095 1.00 . A A . 12 PHE CD2 1 1
12 2529 1 1 12 PHE CE1 C -1.624 1.445 -3.199 1.00 . A A . 12 PHE CE1 1 1
12 2530 1 1 12 PHE CE2 C -2.791 3.404 -3.902 1.00 . A A . 12 PHE CE2 1 1
12 2531 1 1 12 PHE CG C -3.819 1.910 -2.328 1.00 . A A . 12 PHE CG 1 1
12 2532 1 1 12 PHE CZ C -1.675 2.597 -3.954 1.00 . A A . 12 PHE CZ 1 1
12 2533 1 1 12 PHE H H -3.674 0.475 0.644 1.00 . A A . 12 PHE H 1 1
12 2534 1 1 12 PHE HA H -4.868 3.078 0.035 1.00 . A A . 12 PHE HA 1 1
12 2535 1 1 12 PHE HB2 H -5.064 0.452 -1.474 1.00 . A A . 12 PHE HB2 1 1
12 2536 1 1 12 PHE HB3 H -5.887 1.934 -1.915 1.00 . A A . 12 PHE HB3 1 1
12 2537 1 1 12 PHE HD1 H -2.654 0.206 -1.793 1.00 . A A . 12 PHE HD1 1 1
12 2538 1 1 12 PHE HD2 H -4.729 3.695 -3.056 1.00 . A A . 12 PHE HD2 1 1
12 2539 1 1 12 PHE HE1 H -0.750 0.813 -3.239 1.00 . A A . 12 PHE HE1 1 1
12 2540 1 1 12 PHE HE2 H -2.837 4.307 -4.493 1.00 . A A . 12 PHE HE2 1 1
12 2541 1 1 12 PHE HZ H -0.841 2.866 -4.588 1.00 . A A . 12 PHE HZ 1 1
12 2542 1 1 12 PHE N N -3.780 1.454 0.664 1.00 . A A . 12 PHE N 1 1
12 2543 1 1 12 PHE O O -6.214 0.369 1.180 1.00 . A A . 12 PHE O 1 1
12 2544 1 1 13 PRO C C -9.314 0.959 1.017 1.00 . A A . 13 PRO C 1 1
12 2545 1 1 13 PRO CA C -8.438 2.072 1.650 1.00 . A A . 13 PRO CA 1 1
12 2546 1 1 13 PRO CB C -9.193 3.404 1.641 1.00 . A A . 13 PRO CB 1 1
12 2547 1 1 13 PRO CD C -7.236 3.757 0.345 1.00 . A A . 13 PRO CD 1 1
12 2548 1 1 13 PRO CG C -8.687 4.106 0.434 1.00 . A A . 13 PRO CG 1 1
12 2549 1 1 13 PRO HA H -8.210 1.800 2.671 1.00 . A A . 13 PRO HA 1 1
12 2550 1 1 13 PRO HB2 H -10.254 3.217 1.577 1.00 . A A . 13 PRO HB2 1 1
12 2551 1 1 13 PRO HB3 H -8.970 3.958 2.540 1.00 . A A . 13 PRO HB3 1 1
12 2552 1 1 13 PRO HD2 H -6.904 3.776 -0.682 1.00 . A A . 13 PRO HD2 1 1
12 2553 1 1 13 PRO HD3 H -6.644 4.428 0.948 1.00 . A A . 13 PRO HD3 1 1
12 2554 1 1 13 PRO HG2 H -9.211 3.751 -0.441 1.00 . A A . 13 PRO HG2 1 1
12 2555 1 1 13 PRO HG3 H -8.811 5.172 0.537 1.00 . A A . 13 PRO HG3 1 1
12 2556 1 1 13 PRO N N -7.194 2.385 0.893 1.00 . A A . 13 PRO N 1 1
12 2557 1 1 13 PRO O O -10.459 0.735 1.432 1.00 . A A . 13 PRO O 1 1
12 2558 1 1 14 ASN C C -8.922 -2.142 -0.105 1.00 . A A . 14 ASN C 1 1
12 2559 1 1 14 ASN CA C -9.485 -0.822 -0.608 1.00 . A A . 14 ASN CA 1 1
12 2560 1 1 14 ASN CB C -9.363 -0.775 -2.138 1.00 . A A . 14 ASN CB 1 1
12 2561 1 1 14 ASN CG C -7.957 -1.048 -2.639 1.00 . A A . 14 ASN CG 1 1
12 2562 1 1 14 ASN H H -7.887 0.522 -0.279 1.00 . A A . 14 ASN H 1 1
12 2563 1 1 14 ASN HA H -10.527 -0.758 -0.332 1.00 . A A . 14 ASN HA 1 1
12 2564 1 1 14 ASN HB2 H -10.018 -1.524 -2.557 1.00 . A A . 14 ASN HB2 1 1
12 2565 1 1 14 ASN HB3 H -9.670 0.196 -2.494 1.00 . A A . 14 ASN HB3 1 1
12 2566 1 1 14 ASN HD21 H -8.686 -1.929 -4.227 1.00 . A A . 14 ASN HD21 1 1
12 2567 1 1 14 ASN HD22 H -6.967 -1.856 -4.138 1.00 . A A . 14 ASN HD22 1 1
12 2568 1 1 14 ASN N N -8.788 0.281 0.031 1.00 . A A . 14 ASN N 1 1
12 2569 1 1 14 ASN ND2 N -7.854 -1.671 -3.770 1.00 . A A . 14 ASN ND2 1 1
12 2570 1 1 14 ASN O O -9.381 -3.219 -0.496 1.00 . A A . 14 ASN O 1 1
12 2571 1 1 14 ASN OD1 O -6.976 -0.720 -1.985 1.00 . A A . 14 ASN OD1 1 1
12 2572 2 2 1 . C C -1.749 -2.138 3.172 1.00 . B A . 101 WMH C 1 1
12 2573 2 2 1 . C1 C -1.097 0.035 3.927 1.00 . B A . 101 WMH C1 1 1
12 2574 2 2 1 . C2 C -0.067 0.543 4.651 1.00 . B A . 101 WMH C2 1 1
12 2575 2 2 1 . H1 H -2.449 -2.574 3.858 1.00 . B A . 101 WMH H1 1 1
12 2576 2 2 1 . H2 H -2.348 -1.521 2.524 1.00 . B A . 101 WMH H2 1 1
12 2577 2 2 1 . H5 H 0.090 1.584 4.888 1.00 . B A . 101 WMH H5 1 1
12 2578 2 2 1 . N N -0.930 -1.256 3.851 1.00 . B A . 101 WMH N 1 1
12 2579 2 2 1 . N1 N 0.720 -0.468 5.014 1.00 . B A . 101 WMH N1 1 1
12 2580 2 2 1 . N2 N 0.234 -1.573 4.556 1.00 . B A . 101 WMH N2 1 1
13 2581 1 1 1 GLY C C -6.007 -3.520 -0.136 1.00 . A A . 1 GLY C 1 1
13 2582 1 1 1 GLY CA C -7.214 -3.334 0.738 1.00 . A A . 1 GLY CA 1 1
13 2583 1 1 1 GLY H1 H -7.544 -1.258 0.739 1.00 . A A . 1 GLY H1 1 1
13 2584 1 1 1 GLY HA2 H -6.898 -3.321 1.771 1.00 . A A . 1 GLY HA2 1 1
13 2585 1 1 1 GLY HA3 H -7.884 -4.166 0.583 1.00 . A A . 1 GLY HA3 1 1
13 2586 1 1 1 GLY N N -7.914 -2.116 0.438 1.00 . A A . 1 GLY N 1 1
13 2587 1 1 1 GLY O O -5.791 -4.599 -0.687 1.00 . A A . 1 GLY O 1 1
13 2588 1 1 2 LYS C C -2.891 -1.912 -0.282 1.00 . A A . 2 LYS C 1 1
13 2589 1 1 2 LYS CA C -4.021 -2.512 -1.074 1.00 . A A . 2 LYS CA 1 1
13 2590 1 1 2 LYS CB C -4.175 -1.787 -2.422 1.00 . A A . 2 LYS CB 1 1
13 2591 1 1 2 LYS CD C -4.634 -3.855 -3.776 1.00 . A A . 2 LYS CD 1 1
13 2592 1 1 2 LYS CE C -5.584 -4.540 -4.742 1.00 . A A . 2 LYS CE 1 1
13 2593 1 1 2 LYS CG C -5.112 -2.459 -3.413 1.00 . A A . 2 LYS CG 1 1
13 2594 1 1 2 LYS H H -5.466 -1.635 0.172 1.00 . A A . 2 LYS H 1 1
13 2595 1 1 2 LYS HA H -3.789 -3.551 -1.255 1.00 . A A . 2 LYS HA 1 1
13 2596 1 1 2 LYS HB2 H -4.554 -0.795 -2.240 1.00 . A A . 2 LYS HB2 1 1
13 2597 1 1 2 LYS HB3 H -3.205 -1.697 -2.882 1.00 . A A . 2 LYS HB3 1 1
13 2598 1 1 2 LYS HD2 H -3.658 -3.788 -4.233 1.00 . A A . 2 LYS HD2 1 1
13 2599 1 1 2 LYS HD3 H -4.571 -4.445 -2.874 1.00 . A A . 2 LYS HD3 1 1
13 2600 1 1 2 LYS HE2 H -5.249 -5.555 -4.894 1.00 . A A . 2 LYS HE2 1 1
13 2601 1 1 2 LYS HE3 H -6.571 -4.553 -4.302 1.00 . A A . 2 LYS HE3 1 1
13 2602 1 1 2 LYS HG2 H -6.095 -2.531 -2.973 1.00 . A A . 2 LYS HG2 1 1
13 2603 1 1 2 LYS HG3 H -5.162 -1.860 -4.309 1.00 . A A . 2 LYS HG3 1 1
13 2604 1 1 2 LYS HZ1 H -5.978 -2.877 -5.958 1.00 . A A . 2 LYS HZ1 1 1
13 2605 1 1 2 LYS HZ2 H -6.296 -4.350 -6.700 1.00 . A A . 2 LYS HZ2 1 1
13 2606 1 1 2 LYS HZ3 H -4.707 -3.834 -6.496 1.00 . A A . 2 LYS HZ3 1 1
13 2607 1 1 2 LYS N N -5.236 -2.471 -0.289 1.00 . A A . 2 LYS N 1 1
13 2608 1 1 2 LYS NZ N -5.648 -3.858 -6.053 1.00 . A A . 2 LYS NZ 1 1
13 2609 1 1 2 LYS O O -2.974 -0.778 0.157 1.00 . A A . 2 LYS O 1 1
13 2610 1 1 3 ALA C C 0.566 -2.543 -0.024 1.00 . A A . 3 ALA C 1 1
13 2611 1 1 3 ALA CA C -0.721 -2.252 0.678 1.00 . A A . 3 ALA CA 1 1
13 2612 1 1 3 ALA CB C -0.743 -2.833 2.091 1.00 . A A . 3 ALA CB 1 1
13 2613 1 1 3 ALA H H -1.881 -3.601 -0.411 1.00 . A A . 3 ALA H 1 1
13 2614 1 1 3 ALA HA H -0.797 -1.178 0.770 1.00 . A A . 3 ALA HA 1 1
13 2615 1 1 3 ALA HB1 H 0.272 -2.999 2.422 1.00 . A A . 3 ALA HB1 1 1
13 2616 1 1 3 ALA HB2 H -1.270 -3.777 2.075 1.00 . A A . 3 ALA HB2 1 1
13 2617 1 1 3 ALA N N -1.873 -2.681 -0.068 1.00 . A A . 3 ALA N 1 1
13 2618 1 1 3 ALA O O 0.748 -3.619 -0.593 1.00 . A A . 3 ALA O 1 1
13 2619 1 1 4 LEU C C 3.657 -2.150 0.519 1.00 . A A . 4 LEU C 1 1
13 2620 1 1 4 LEU CA C 2.738 -1.726 -0.598 1.00 . A A . 4 LEU CA 1 1
13 2621 1 1 4 LEU CB C 3.239 -0.432 -1.266 1.00 . A A . 4 LEU CB 1 1
13 2622 1 1 4 LEU CD1 C 4.662 -1.575 -2.996 1.00 . A A . 4 LEU CD1 1 1
13 2623 1 1 4 LEU CD2 C 4.978 0.840 -2.565 1.00 . A A . 4 LEU CD2 1 1
13 2624 1 1 4 LEU CG C 4.625 -0.495 -1.939 1.00 . A A . 4 LEU CG 1 1
13 2625 1 1 4 LEU H H 1.156 -0.677 0.294 1.00 . A A . 4 LEU H 1 1
13 2626 1 1 4 LEU HA H 2.687 -2.516 -1.332 1.00 . A A . 4 LEU HA 1 1
13 2627 1 1 4 LEU HB2 H 2.518 -0.142 -2.013 1.00 . A A . 4 LEU HB2 1 1
13 2628 1 1 4 LEU HB3 H 3.271 0.330 -0.502 1.00 . A A . 4 LEU HB3 1 1
13 2629 1 1 4 LEU HD11 H 5.642 -1.596 -3.449 1.00 . A A . 4 LEU HD11 1 1
13 2630 1 1 4 LEU HD12 H 3.920 -1.364 -3.752 1.00 . A A . 4 LEU HD12 1 1
13 2631 1 1 4 LEU HD13 H 4.457 -2.529 -2.541 1.00 . A A . 4 LEU HD13 1 1
13 2632 1 1 4 LEU HD21 H 5.951 0.774 -3.029 1.00 . A A . 4 LEU HD21 1 1
13 2633 1 1 4 LEU HD22 H 4.996 1.604 -1.801 1.00 . A A . 4 LEU HD22 1 1
13 2634 1 1 4 LEU HD23 H 4.241 1.095 -3.313 1.00 . A A . 4 LEU HD23 1 1
13 2635 1 1 4 LEU HG H 5.372 -0.726 -1.194 1.00 . A A . 4 LEU HG 1 1
13 2636 1 1 4 LEU N N 1.425 -1.557 -0.052 1.00 . A A . 4 LEU N 1 1
13 2637 1 1 4 LEU O O 3.895 -1.400 1.469 1.00 . A A . 4 LEU O 1 1
13 2638 1 1 5 PHE C C 6.486 -3.640 1.095 1.00 . A A . 5 PHE C 1 1
13 2639 1 1 5 PHE CA C 5.023 -3.936 1.416 1.00 . A A . 5 PHE CA 1 1
13 2640 1 1 5 PHE CB C 4.777 -5.452 1.477 1.00 . A A . 5 PHE CB 1 1
13 2641 1 1 5 PHE CD1 C 2.528 -6.319 0.754 1.00 . A A . 5 PHE CD1 1 1
13 2642 1 1 5 PHE CD2 C 2.810 -5.674 3.027 1.00 . A A . 5 PHE CD2 1 1
13 2643 1 1 5 PHE CE1 C 1.213 -6.653 1.008 1.00 . A A . 5 PHE CE1 1 1
13 2644 1 1 5 PHE CE2 C 1.496 -6.008 3.288 1.00 . A A . 5 PHE CE2 1 1
13 2645 1 1 5 PHE CG C 3.343 -5.825 1.760 1.00 . A A . 5 PHE CG 1 1
13 2646 1 1 5 PHE CZ C 0.695 -6.497 2.277 1.00 . A A . 5 PHE CZ 1 1
13 2647 1 1 5 PHE H H 3.967 -3.853 -0.407 1.00 . A A . 5 PHE H 1 1
13 2648 1 1 5 PHE HA H 4.768 -3.498 2.368 1.00 . A A . 5 PHE HA 1 1
13 2649 1 1 5 PHE HB2 H 5.056 -5.896 0.533 1.00 . A A . 5 PHE HB2 1 1
13 2650 1 1 5 PHE HB3 H 5.390 -5.873 2.259 1.00 . A A . 5 PHE HB3 1 1
13 2651 1 1 5 PHE HD1 H 2.931 -6.443 -0.241 1.00 . A A . 5 PHE HD1 1 1
13 2652 1 1 5 PHE HD2 H 3.431 -5.290 3.823 1.00 . A A . 5 PHE HD2 1 1
13 2653 1 1 5 PHE HE1 H 0.592 -7.033 0.211 1.00 . A A . 5 PHE HE1 1 1
13 2654 1 1 5 PHE HE2 H 1.095 -5.883 4.283 1.00 . A A . 5 PHE HE2 1 1
13 2655 1 1 5 PHE HZ H -0.334 -6.758 2.478 1.00 . A A . 5 PHE HZ 1 1
13 2656 1 1 5 PHE N N 4.167 -3.340 0.406 1.00 . A A . 5 PHE N 1 1
13 2657 1 1 5 PHE O O 7.386 -4.422 1.385 1.00 . A A . 5 PHE O 1 1
13 2658 1 1 6 SER C C 8.023 -0.539 0.456 1.00 . A A . 6 SER C 1 1
13 2659 1 1 6 SER CA C 7.991 -2.030 0.145 1.00 . A A . 6 SER CA 1 1
13 2660 1 1 6 SER CB C 8.181 -2.281 -1.354 1.00 . A A . 6 SER CB 1 1
13 2661 1 1 6 SER H H 5.940 -1.897 0.388 1.00 . A A . 6 SER H 1 1
13 2662 1 1 6 SER HA H 8.741 -2.558 0.710 1.00 . A A . 6 SER HA 1 1
13 2663 1 1 6 SER HB2 H 7.499 -1.656 -1.913 1.00 . A A . 6 SER HB2 1 1
13 2664 1 1 6 SER HB3 H 9.196 -2.048 -1.631 1.00 . A A . 6 SER HB3 1 1
13 2665 1 1 6 SER HG H 7.931 -4.126 -0.828 1.00 . A A . 6 SER HG 1 1
13 2666 1 1 6 SER N N 6.701 -2.498 0.529 1.00 . A A . 6 SER N 1 1
13 2667 1 1 6 SER O O 7.053 -0.022 1.007 1.00 . A A . 6 SER O 1 1
13 2668 1 1 6 SER OG O 7.920 -3.648 -1.668 1.00 . A A . 6 SER OG 1 1
13 2669 1 1 7 ASN C C 8.767 2.297 -0.893 1.00 . A A . 7 ASN C 1 1
13 2670 1 1 7 ASN CA C 9.180 1.570 0.365 1.00 . A A . 7 ASN CA 1 1
13 2671 1 1 7 ASN CB C 10.588 2.017 0.784 1.00 . A A . 7 ASN CB 1 1
13 2672 1 1 7 ASN CG C 10.948 1.594 2.183 1.00 . A A . 7 ASN CG 1 1
13 2673 1 1 7 ASN H H 9.896 -0.335 -0.192 1.00 . A A . 7 ASN H 1 1
13 2674 1 1 7 ASN HA H 8.488 1.792 1.162 1.00 . A A . 7 ASN HA 1 1
13 2675 1 1 7 ASN HB2 H 11.308 1.583 0.107 1.00 . A A . 7 ASN HB2 1 1
13 2676 1 1 7 ASN HB3 H 10.646 3.094 0.720 1.00 . A A . 7 ASN HB3 1 1
13 2677 1 1 7 ASN HD21 H 10.292 3.311 2.920 1.00 . A A . 7 ASN HD21 1 1
13 2678 1 1 7 ASN HD22 H 10.926 2.181 4.058 1.00 . A A . 7 ASN HD22 1 1
13 2679 1 1 7 ASN N N 9.107 0.131 0.161 1.00 . A A . 7 ASN N 1 1
13 2680 1 1 7 ASN ND2 N 10.697 2.444 3.141 1.00 . A A . 7 ASN ND2 1 1
13 2681 1 1 7 ASN O O 9.228 1.944 -1.987 1.00 . A A . 7 ASN O 1 1
13 2682 1 1 7 ASN OD1 O 11.466 0.503 2.403 1.00 . A A . 7 ASN OD1 1 1
13 2683 1 1 8 PRO C C 5.958 2.975 0.755 1.00 . A A . 8 PRO C 1 1
13 2684 1 1 8 PRO CA C 7.275 3.728 0.468 1.00 . A A . 8 PRO CA 1 1
13 2685 1 1 8 PRO CB C 7.002 5.210 0.224 1.00 . A A . 8 PRO CB 1 1
13 2686 1 1 8 PRO CD C 7.419 4.127 -1.916 1.00 . A A . 8 PRO CD 1 1
13 2687 1 1 8 PRO CG C 6.817 5.351 -1.256 1.00 . A A . 8 PRO CG 1 1
13 2688 1 1 8 PRO HA H 7.952 3.614 1.301 1.00 . A A . 8 PRO HA 1 1
13 2689 1 1 8 PRO HB2 H 6.114 5.500 0.766 1.00 . A A . 8 PRO HB2 1 1
13 2690 1 1 8 PRO HB3 H 7.843 5.791 0.572 1.00 . A A . 8 PRO HB3 1 1
13 2691 1 1 8 PRO HD2 H 6.671 3.597 -2.487 1.00 . A A . 8 PRO HD2 1 1
13 2692 1 1 8 PRO HD3 H 8.243 4.411 -2.554 1.00 . A A . 8 PRO HD3 1 1
13 2693 1 1 8 PRO HG2 H 5.762 5.410 -1.484 1.00 . A A . 8 PRO HG2 1 1
13 2694 1 1 8 PRO HG3 H 7.316 6.244 -1.600 1.00 . A A . 8 PRO HG3 1 1
13 2695 1 1 8 PRO N N 7.887 3.303 -0.791 1.00 . A A . 8 PRO N 1 1
13 2696 1 1 8 PRO O O 5.144 2.769 -0.147 1.00 . A A . 8 PRO O 1 1
13 2697 1 1 9 PRO C C 3.279 2.655 2.308 1.00 . A A . 9 PRO C 1 1
13 2698 1 1 9 PRO CA C 4.540 1.796 2.374 1.00 . A A . 9 PRO CA 1 1
13 2699 1 1 9 PRO CB C 4.805 1.347 3.814 1.00 . A A . 9 PRO CB 1 1
13 2700 1 1 9 PRO CD C 6.652 2.704 3.150 1.00 . A A . 9 PRO CD 1 1
13 2701 1 1 9 PRO CG C 5.809 2.320 4.328 1.00 . A A . 9 PRO CG 1 1
13 2702 1 1 9 PRO HA H 4.408 0.929 1.743 1.00 . A A . 9 PRO HA 1 1
13 2703 1 1 9 PRO HB2 H 3.885 1.389 4.378 1.00 . A A . 9 PRO HB2 1 1
13 2704 1 1 9 PRO HB3 H 5.191 0.340 3.820 1.00 . A A . 9 PRO HB3 1 1
13 2705 1 1 9 PRO HD2 H 6.966 3.731 3.241 1.00 . A A . 9 PRO HD2 1 1
13 2706 1 1 9 PRO HD3 H 7.507 2.047 3.067 1.00 . A A . 9 PRO HD3 1 1
13 2707 1 1 9 PRO HG2 H 5.304 3.191 4.722 1.00 . A A . 9 PRO HG2 1 1
13 2708 1 1 9 PRO HG3 H 6.418 1.865 5.094 1.00 . A A . 9 PRO HG3 1 1
13 2709 1 1 9 PRO N N 5.743 2.535 2.004 1.00 . A A . 9 PRO N 1 1
13 2710 1 1 9 PRO O O 2.979 3.431 3.229 1.00 . A A . 9 PRO O 1 1
13 2711 1 1 10 ILE C C 0.246 2.243 1.119 1.00 . A A . 10 ILE C 1 1
13 2712 1 1 10 ILE CA C 1.360 3.265 1.043 1.00 . A A . 10 ILE CA 1 1
13 2713 1 1 10 ILE CB C 1.297 4.083 -0.296 1.00 . A A . 10 ILE CB 1 1
13 2714 1 1 10 ILE CD1 C -0.207 5.663 -1.664 1.00 . A A . 10 ILE CD1 1 1
13 2715 1 1 10 ILE CG1 C -0.069 4.789 -0.438 1.00 . A A . 10 ILE CG1 1 1
13 2716 1 1 10 ILE CG2 C 1.602 3.201 -1.511 1.00 . A A . 10 ILE CG2 1 1
13 2717 1 1 10 ILE H H 2.958 2.049 0.464 1.00 . A A . 10 ILE H 1 1
13 2718 1 1 10 ILE HA H 1.256 3.941 1.879 1.00 . A A . 10 ILE HA 1 1
13 2719 1 1 10 ILE HB H 2.070 4.835 -0.248 1.00 . A A . 10 ILE HB 1 1
13 2720 1 1 10 ILE HD11 H 0.525 6.454 -1.628 1.00 . A A . 10 ILE HD11 1 1
13 2721 1 1 10 ILE HD12 H -1.198 6.091 -1.693 1.00 . A A . 10 ILE HD12 1 1
13 2722 1 1 10 ILE HD13 H -0.046 5.065 -2.548 1.00 . A A . 10 ILE HD13 1 1
13 2723 1 1 10 ILE HG12 H -0.852 4.046 -0.481 1.00 . A A . 10 ILE HG12 1 1
13 2724 1 1 10 ILE HG13 H -0.224 5.412 0.429 1.00 . A A . 10 ILE HG13 1 1
13 2725 1 1 10 ILE HG21 H 1.541 3.798 -2.410 1.00 . A A . 10 ILE HG21 1 1
13 2726 1 1 10 ILE HG22 H 0.883 2.397 -1.563 1.00 . A A . 10 ILE HG22 1 1
13 2727 1 1 10 ILE HG23 H 2.595 2.789 -1.419 1.00 . A A . 10 ILE HG23 1 1
13 2728 1 1 10 ILE N N 2.602 2.582 1.206 1.00 . A A . 10 ILE N 1 1
13 2729 1 1 10 ILE O O 0.361 1.140 0.554 1.00 . A A . 10 ILE O 1 1
13 2730 1 1 11 ALA C C -3.150 2.322 1.597 1.00 . A A . 11 ALA C 1 1
13 2731 1 1 11 ALA CA C -1.878 1.643 1.997 1.00 . A A . 11 ALA CA 1 1
13 2732 1 1 11 ALA CB C -1.992 1.000 3.392 1.00 . A A . 11 ALA CB 1 1
13 2733 1 1 11 ALA H H -0.784 3.393 2.370 1.00 . A A . 11 ALA H 1 1
13 2734 1 1 11 ALA HA H -1.701 0.856 1.277 1.00 . A A . 11 ALA HA 1 1
13 2735 1 1 11 ALA HB1 H -2.795 0.279 3.367 1.00 . A A . 11 ALA HB1 1 1
13 2736 1 1 11 ALA HB2 H -2.225 1.706 4.168 1.00 . A A . 11 ALA HB2 1 1
13 2737 1 1 11 ALA N N -0.773 2.543 1.880 1.00 . A A . 11 ALA N 1 1
13 2738 1 1 11 ALA O O -3.377 3.497 1.917 1.00 . A A . 11 ALA O 1 1
13 2739 1 1 12 PHE C C -6.323 1.379 1.080 1.00 . A A . 12 PHE C 1 1
13 2740 1 1 12 PHE CA C -5.197 2.087 0.371 1.00 . A A . 12 PHE CA 1 1
13 2741 1 1 12 PHE CB C -5.294 1.790 -1.129 1.00 . A A . 12 PHE CB 1 1
13 2742 1 1 12 PHE CD1 C -4.345 3.577 -2.605 1.00 . A A . 12 PHE CD1 1 1
13 2743 1 1 12 PHE CD2 C -2.992 1.680 -2.132 1.00 . A A . 12 PHE CD2 1 1
13 2744 1 1 12 PHE CE1 C -3.334 4.098 -3.385 1.00 . A A . 12 PHE CE1 1 1
13 2745 1 1 12 PHE CE2 C -1.983 2.199 -2.907 1.00 . A A . 12 PHE CE2 1 1
13 2746 1 1 12 PHE CG C -4.187 2.364 -1.971 1.00 . A A . 12 PHE CG 1 1
13 2747 1 1 12 PHE CZ C -2.156 3.407 -3.534 1.00 . A A . 12 PHE CZ 1 1
13 2748 1 1 12 PHE H H -3.698 0.660 0.744 1.00 . A A . 12 PHE H 1 1
13 2749 1 1 12 PHE HA H -5.254 3.154 0.530 1.00 . A A . 12 PHE HA 1 1
13 2750 1 1 12 PHE HB2 H -5.297 0.720 -1.265 1.00 . A A . 12 PHE HB2 1 1
13 2751 1 1 12 PHE HB3 H -6.232 2.182 -1.496 1.00 . A A . 12 PHE HB3 1 1
13 2752 1 1 12 PHE HD1 H -5.269 4.121 -2.487 1.00 . A A . 12 PHE HD1 1 1
13 2753 1 1 12 PHE HD2 H -2.852 0.729 -1.639 1.00 . A A . 12 PHE HD2 1 1
13 2754 1 1 12 PHE HE1 H -3.461 5.048 -3.882 1.00 . A A . 12 PHE HE1 1 1
13 2755 1 1 12 PHE HE2 H -1.057 1.658 -3.023 1.00 . A A . 12 PHE HE2 1 1
13 2756 1 1 12 PHE HZ H -1.363 3.816 -4.144 1.00 . A A . 12 PHE HZ 1 1
13 2757 1 1 12 PHE N N -3.953 1.601 0.898 1.00 . A A . 12 PHE N 1 1
13 2758 1 1 12 PHE O O -6.275 0.148 1.227 1.00 . A A . 12 PHE O 1 1
13 2759 1 1 13 PRO C C -9.280 0.456 1.547 1.00 . A A . 13 PRO C 1 1
13 2760 1 1 13 PRO CA C -8.501 1.576 2.258 1.00 . A A . 13 PRO CA 1 1
13 2761 1 1 13 PRO CB C -9.404 2.790 2.496 1.00 . A A . 13 PRO CB 1 1
13 2762 1 1 13 PRO CD C -7.538 3.568 1.234 1.00 . A A . 13 PRO CD 1 1
13 2763 1 1 13 PRO CG C -9.002 3.783 1.463 1.00 . A A . 13 PRO CG 1 1
13 2764 1 1 13 PRO HA H -8.162 1.196 3.211 1.00 . A A . 13 PRO HA 1 1
13 2765 1 1 13 PRO HB2 H -10.438 2.497 2.388 1.00 . A A . 13 PRO HB2 1 1
13 2766 1 1 13 PRO HB3 H -9.234 3.172 3.491 1.00 . A A . 13 PRO HB3 1 1
13 2767 1 1 13 PRO HD2 H -7.277 3.821 0.218 1.00 . A A . 13 PRO HD2 1 1
13 2768 1 1 13 PRO HD3 H -6.957 4.147 1.935 1.00 . A A . 13 PRO HD3 1 1
13 2769 1 1 13 PRO HG2 H -9.558 3.612 0.555 1.00 . A A . 13 PRO HG2 1 1
13 2770 1 1 13 PRO HG3 H -9.181 4.784 1.826 1.00 . A A . 13 PRO HG3 1 1
13 2771 1 1 13 PRO N N -7.370 2.119 1.484 1.00 . A A . 13 PRO N 1 1
13 2772 1 1 13 PRO O O -10.072 -0.242 2.175 1.00 . A A . 13 PRO O 1 1
13 2773 1 1 14 ASN C C -9.060 -2.146 -0.221 1.00 . A A . 14 ASN C 1 1
13 2774 1 1 14 ASN CA C -9.730 -0.794 -0.488 1.00 . A A . 14 ASN CA 1 1
13 2775 1 1 14 ASN CB C -9.779 -0.523 -2.013 1.00 . A A . 14 ASN CB 1 1
13 2776 1 1 14 ASN CG C -8.454 -0.736 -2.753 1.00 . A A . 14 ASN CG 1 1
13 2777 1 1 14 ASN H H -8.436 0.894 -0.194 1.00 . A A . 14 ASN H 1 1
13 2778 1 1 14 ASN HA H -10.738 -0.843 -0.106 1.00 . A A . 14 ASN HA 1 1
13 2779 1 1 14 ASN HB2 H -10.505 -1.187 -2.455 1.00 . A A . 14 ASN HB2 1 1
13 2780 1 1 14 ASN HB3 H -10.103 0.496 -2.170 1.00 . A A . 14 ASN HB3 1 1
13 2781 1 1 14 ASN HD21 H -7.932 1.158 -2.522 1.00 . A A . 14 ASN HD21 1 1
13 2782 1 1 14 ASN HD22 H -6.817 0.171 -3.381 1.00 . A A . 14 ASN HD22 1 1
13 2783 1 1 14 ASN N N -9.053 0.278 0.253 1.00 . A A . 14 ASN N 1 1
13 2784 1 1 14 ASN ND2 N -7.659 0.292 -2.890 1.00 . A A . 14 ASN ND2 1 1
13 2785 1 1 14 ASN O O -9.578 -3.194 -0.609 1.00 . A A . 14 ASN O 1 1
13 2786 1 1 14 ASN OD1 O -8.171 -1.826 -3.228 1.00 . A A . 14 ASN OD1 1 1
13 2787 2 2 1 . C C -1.421 -1.919 3.079 1.00 . B A . 101 WMH C 1 1
13 2788 2 2 1 . C1 C -0.751 0.269 3.812 1.00 . B A . 101 WMH C1 1 1
13 2789 2 2 1 . C2 C 0.379 0.806 4.342 1.00 . B A . 101 WMH C2 1 1
13 2790 2 2 1 . H1 H -2.018 -2.360 3.856 1.00 . B A . 101 WMH H1 1 1
13 2791 2 2 1 . H2 H -2.104 -1.332 2.484 1.00 . B A . 101 WMH H2 1 1
13 2792 2 2 1 . H5 H 0.522 1.843 4.611 1.00 . B A . 101 WMH H5 1 1
13 2793 2 2 1 . N N -0.536 -1.006 3.630 1.00 . B A . 101 WMH N 1 1
13 2794 2 2 1 . N1 N 1.277 -0.164 4.474 1.00 . B A . 101 WMH N1 1 1
13 2795 2 2 1 . N2 N 0.770 -1.272 4.060 1.00 . B A . 101 WMH N2 1 1
14 2796 1 1 1 GLY C C -6.374 -3.535 0.007 1.00 . A A . 1 GLY C 1 1
14 2797 1 1 1 GLY CA C -7.403 -3.186 1.042 1.00 . A A . 1 GLY CA 1 1
14 2798 1 1 1 GLY H1 H -7.641 -1.104 0.850 1.00 . A A . 1 GLY H1 1 1
14 2799 1 1 1 GLY HA2 H -6.924 -3.068 2.001 1.00 . A A . 1 GLY HA2 1 1
14 2800 1 1 1 GLY HA3 H -8.126 -3.987 1.099 1.00 . A A . 1 GLY HA3 1 1
14 2801 1 1 1 GLY N N -8.077 -1.971 0.703 1.00 . A A . 1 GLY N 1 1
14 2802 1 1 1 GLY O O -6.494 -4.539 -0.689 1.00 . A A . 1 GLY O 1 1
14 2803 1 1 2 LYS C C -3.077 -2.250 -0.432 1.00 . A A . 2 LYS C 1 1
14 2804 1 1 2 LYS CA C -4.302 -2.897 -1.032 1.00 . A A . 2 LYS CA 1 1
14 2805 1 1 2 LYS CB C -4.591 -2.319 -2.434 1.00 . A A . 2 LYS CB 1 1
14 2806 1 1 2 LYS CD C -3.355 -4.117 -3.726 1.00 . A A . 2 LYS CD 1 1
14 2807 1 1 2 LYS CE C -2.256 -4.433 -4.745 1.00 . A A . 2 LYS CE 1 1
14 2808 1 1 2 LYS CG C -3.504 -2.614 -3.478 1.00 . A A . 2 LYS CG 1 1
14 2809 1 1 2 LYS H H -5.379 -1.869 0.420 1.00 . A A . 2 LYS H 1 1
14 2810 1 1 2 LYS HA H -4.145 -3.963 -1.102 1.00 . A A . 2 LYS HA 1 1
14 2811 1 1 2 LYS HB2 H -5.522 -2.735 -2.790 1.00 . A A . 2 LYS HB2 1 1
14 2812 1 1 2 LYS HB3 H -4.701 -1.249 -2.350 1.00 . A A . 2 LYS HB3 1 1
14 2813 1 1 2 LYS HD2 H -3.108 -4.604 -2.794 1.00 . A A . 2 LYS HD2 1 1
14 2814 1 1 2 LYS HD3 H -4.295 -4.503 -4.092 1.00 . A A . 2 LYS HD3 1 1
14 2815 1 1 2 LYS HE2 H -2.226 -5.502 -4.904 1.00 . A A . 2 LYS HE2 1 1
14 2816 1 1 2 LYS HE3 H -2.497 -3.943 -5.676 1.00 . A A . 2 LYS HE3 1 1
14 2817 1 1 2 LYS HG2 H -3.768 -2.131 -4.407 1.00 . A A . 2 LYS HG2 1 1
14 2818 1 1 2 LYS HG3 H -2.562 -2.222 -3.121 1.00 . A A . 2 LYS HG3 1 1
14 2819 1 1 2 LYS HZ1 H -0.882 -2.957 -4.171 1.00 . A A . 2 LYS HZ1 1 1
14 2820 1 1 2 LYS HZ2 H -0.205 -4.220 -5.025 1.00 . A A . 2 LYS HZ2 1 1
14 2821 1 1 2 LYS HZ3 H -0.605 -4.456 -3.418 1.00 . A A . 2 LYS HZ3 1 1
14 2822 1 1 2 LYS N N -5.396 -2.681 -0.130 1.00 . A A . 2 LYS N 1 1
14 2823 1 1 2 LYS NZ N -0.911 -3.990 -4.295 1.00 . A A . 2 LYS NZ 1 1
14 2824 1 1 2 LYS O O -2.978 -1.029 -0.372 1.00 . A A . 2 LYS O 1 1
14 2825 1 1 3 ALA C C 0.244 -2.981 -0.050 1.00 . A A . 3 ALA C 1 1
14 2826 1 1 3 ALA CA C -0.987 -2.597 0.697 1.00 . A A . 3 ALA CA 1 1
14 2827 1 1 3 ALA CB C -0.935 -3.036 2.157 1.00 . A A . 3 ALA CB 1 1
14 2828 1 1 3 ALA H H -2.345 -4.030 0.009 1.00 . A A . 3 ALA H 1 1
14 2829 1 1 3 ALA HA H -1.033 -1.518 0.685 1.00 . A A . 3 ALA HA 1 1
14 2830 1 1 3 ALA HB1 H 0.094 -3.193 2.444 1.00 . A A . 3 ALA HB1 1 1
14 2831 1 1 3 ALA HB2 H -1.481 -3.962 2.266 1.00 . A A . 3 ALA HB2 1 1
14 2832 1 1 3 ALA N N -2.194 -3.061 0.065 1.00 . A A . 3 ALA N 1 1
14 2833 1 1 3 ALA O O 0.400 -4.118 -0.493 1.00 . A A . 3 ALA O 1 1
14 2834 1 1 4 LEU C C 3.421 -2.163 0.153 1.00 . A A . 4 LEU C 1 1
14 2835 1 1 4 LEU CA C 2.341 -2.230 -0.884 1.00 . A A . 4 LEU CA 1 1
14 2836 1 1 4 LEU CB C 2.609 -1.153 -1.974 1.00 . A A . 4 LEU CB 1 1
14 2837 1 1 4 LEU CD1 C 0.262 -0.485 -2.744 1.00 . A A . 4 LEU CD1 1 1
14 2838 1 1 4 LEU CD2 C 2.220 -0.175 -4.259 1.00 . A A . 4 LEU CD2 1 1
14 2839 1 1 4 LEU CG C 1.620 -1.038 -3.166 1.00 . A A . 4 LEU CG 1 1
14 2840 1 1 4 LEU H H 0.904 -1.117 0.108 1.00 . A A . 4 LEU H 1 1
14 2841 1 1 4 LEU HA H 2.333 -3.209 -1.341 1.00 . A A . 4 LEU HA 1 1
14 2842 1 1 4 LEU HB2 H 2.631 -0.193 -1.482 1.00 . A A . 4 LEU HB2 1 1
14 2843 1 1 4 LEU HB3 H 3.594 -1.340 -2.376 1.00 . A A . 4 LEU HB3 1 1
14 2844 1 1 4 LEU HD11 H -0.186 -1.149 -2.019 1.00 . A A . 4 LEU HD11 1 1
14 2845 1 1 4 LEU HD12 H -0.384 -0.397 -3.604 1.00 . A A . 4 LEU HD12 1 1
14 2846 1 1 4 LEU HD13 H 0.396 0.489 -2.296 1.00 . A A . 4 LEU HD13 1 1
14 2847 1 1 4 LEU HD21 H 1.525 -0.101 -5.083 1.00 . A A . 4 LEU HD21 1 1
14 2848 1 1 4 LEU HD22 H 3.141 -0.621 -4.605 1.00 . A A . 4 LEU HD22 1 1
14 2849 1 1 4 LEU HD23 H 2.421 0.812 -3.871 1.00 . A A . 4 LEU HD23 1 1
14 2850 1 1 4 LEU HG H 1.454 -2.023 -3.576 1.00 . A A . 4 LEU HG 1 1
14 2851 1 1 4 LEU N N 1.101 -2.026 -0.223 1.00 . A A . 4 LEU N 1 1
14 2852 1 1 4 LEU O O 3.763 -1.074 0.642 1.00 . A A . 4 LEU O 1 1
14 2853 1 1 5 PHE C C 6.288 -3.102 0.750 1.00 . A A . 5 PHE C 1 1
14 2854 1 1 5 PHE CA C 4.993 -3.329 1.493 1.00 . A A . 5 PHE CA 1 1
14 2855 1 1 5 PHE CB C 5.024 -4.644 2.291 1.00 . A A . 5 PHE CB 1 1
14 2856 1 1 5 PHE CD1 C 7.289 -5.059 3.325 1.00 . A A . 5 PHE CD1 1 1
14 2857 1 1 5 PHE CD2 C 5.569 -4.139 4.692 1.00 . A A . 5 PHE CD2 1 1
14 2858 1 1 5 PHE CE1 C 8.162 -5.024 4.394 1.00 . A A . 5 PHE CE1 1 1
14 2859 1 1 5 PHE CE2 C 6.437 -4.104 5.764 1.00 . A A . 5 PHE CE2 1 1
14 2860 1 1 5 PHE CG C 5.983 -4.617 3.459 1.00 . A A . 5 PHE CG 1 1
14 2861 1 1 5 PHE CZ C 7.735 -4.546 5.614 1.00 . A A . 5 PHE CZ 1 1
14 2862 1 1 5 PHE H H 3.576 -4.140 0.175 1.00 . A A . 5 PHE H 1 1
14 2863 1 1 5 PHE HA H 4.840 -2.498 2.166 1.00 . A A . 5 PHE HA 1 1
14 2864 1 1 5 PHE HB2 H 4.036 -4.850 2.675 1.00 . A A . 5 PHE HB2 1 1
14 2865 1 1 5 PHE HB3 H 5.322 -5.447 1.633 1.00 . A A . 5 PHE HB3 1 1
14 2866 1 1 5 PHE HD1 H 7.626 -5.435 2.370 1.00 . A A . 5 PHE HD1 1 1
14 2867 1 1 5 PHE HD2 H 4.554 -3.790 4.818 1.00 . A A . 5 PHE HD2 1 1
14 2868 1 1 5 PHE HE1 H 9.179 -5.371 4.275 1.00 . A A . 5 PHE HE1 1 1
14 2869 1 1 5 PHE HE2 H 6.099 -3.727 6.718 1.00 . A A . 5 PHE HE2 1 1
14 2870 1 1 5 PHE HZ H 8.415 -4.519 6.454 1.00 . A A . 5 PHE HZ 1 1
14 2871 1 1 5 PHE N N 3.930 -3.302 0.540 1.00 . A A . 5 PHE N 1 1
14 2872 1 1 5 PHE O O 6.869 -4.026 0.164 1.00 . A A . 5 PHE O 1 1
14 2873 1 1 6 SER C C 8.268 -0.167 0.686 1.00 . A A . 6 SER C 1 1
14 2874 1 1 6 SER CA C 7.842 -1.454 0.014 1.00 . A A . 6 SER CA 1 1
14 2875 1 1 6 SER CB C 7.514 -1.226 -1.482 1.00 . A A . 6 SER CB 1 1
14 2876 1 1 6 SER H H 6.131 -1.177 1.124 1.00 . A A . 6 SER H 1 1
14 2877 1 1 6 SER HA H 8.596 -2.217 0.117 1.00 . A A . 6 SER HA 1 1
14 2878 1 1 6 SER HB2 H 7.071 -2.124 -1.890 1.00 . A A . 6 SER HB2 1 1
14 2879 1 1 6 SER HB3 H 6.812 -0.411 -1.570 1.00 . A A . 6 SER HB3 1 1
14 2880 1 1 6 SER HG H 9.152 -1.745 -2.387 1.00 . A A . 6 SER HG 1 1
14 2881 1 1 6 SER N N 6.667 -1.874 0.687 1.00 . A A . 6 SER N 1 1
14 2882 1 1 6 SER O O 7.819 0.113 1.797 1.00 . A A . 6 SER O 1 1
14 2883 1 1 6 SER OG O 8.679 -0.914 -2.238 1.00 . A A . 6 SER OG 1 1
14 2884 1 1 7 ASN C C 9.177 2.905 -0.495 1.00 . A A . 7 ASN C 1 1
14 2885 1 1 7 ASN CA C 9.522 1.871 0.568 1.00 . A A . 7 ASN CA 1 1
14 2886 1 1 7 ASN CB C 11.019 1.920 0.899 1.00 . A A . 7 ASN CB 1 1
14 2887 1 1 7 ASN CG C 11.498 3.310 1.314 1.00 . A A . 7 ASN CG 1 1
14 2888 1 1 7 ASN H H 9.544 0.230 -0.752 1.00 . A A . 7 ASN H 1 1
14 2889 1 1 7 ASN HA H 8.947 2.052 1.463 1.00 . A A . 7 ASN HA 1 1
14 2890 1 1 7 ASN HB2 H 11.228 1.232 1.706 1.00 . A A . 7 ASN HB2 1 1
14 2891 1 1 7 ASN HB3 H 11.573 1.615 0.024 1.00 . A A . 7 ASN HB3 1 1
14 2892 1 1 7 ASN HD21 H 13.293 2.923 0.603 1.00 . A A . 7 ASN HD21 1 1
14 2893 1 1 7 ASN HD22 H 13.083 4.485 1.303 1.00 . A A . 7 ASN HD22 1 1
14 2894 1 1 7 ASN N N 9.139 0.570 0.078 1.00 . A A . 7 ASN N 1 1
14 2895 1 1 7 ASN ND2 N 12.741 3.602 1.049 1.00 . A A . 7 ASN ND2 1 1
14 2896 1 1 7 ASN O O 9.744 2.862 -1.603 1.00 . A A . 7 ASN O 1 1
14 2897 1 1 7 ASN OD1 O 10.744 4.110 1.867 1.00 . A A . 7 ASN OD1 1 1
14 2898 1 1 8 PRO C C 6.305 2.857 1.062 1.00 . A A . 8 PRO C 1 1
14 2899 1 1 8 PRO CA C 7.466 3.872 1.035 1.00 . A A . 8 PRO CA 1 1
14 2900 1 1 8 PRO CB C 6.889 5.306 1.039 1.00 . A A . 8 PRO CB 1 1
14 2901 1 1 8 PRO CD C 7.784 4.857 -1.148 1.00 . A A . 8 PRO CD 1 1
14 2902 1 1 8 PRO CG C 7.376 5.959 -0.220 1.00 . A A . 8 PRO CG 1 1
14 2903 1 1 8 PRO HA H 8.100 3.734 1.898 1.00 . A A . 8 PRO HA 1 1
14 2904 1 1 8 PRO HB2 H 5.810 5.255 1.062 1.00 . A A . 8 PRO HB2 1 1
14 2905 1 1 8 PRO HB3 H 7.241 5.828 1.916 1.00 . A A . 8 PRO HB3 1 1
14 2906 1 1 8 PRO HD2 H 6.943 4.525 -1.739 1.00 . A A . 8 PRO HD2 1 1
14 2907 1 1 8 PRO HD3 H 8.597 5.172 -1.784 1.00 . A A . 8 PRO HD3 1 1
14 2908 1 1 8 PRO HG2 H 6.579 6.540 -0.663 1.00 . A A . 8 PRO HG2 1 1
14 2909 1 1 8 PRO HG3 H 8.218 6.596 0.000 1.00 . A A . 8 PRO HG3 1 1
14 2910 1 1 8 PRO N N 8.220 3.811 -0.229 1.00 . A A . 8 PRO N 1 1
14 2911 1 1 8 PRO O O 5.812 2.447 0.007 1.00 . A A . 8 PRO O 1 1
14 2912 1 1 9 PRO C C 3.445 2.249 2.156 1.00 . A A . 9 PRO C 1 1
14 2913 1 1 9 PRO CA C 4.757 1.496 2.377 1.00 . A A . 9 PRO CA 1 1
14 2914 1 1 9 PRO CB C 4.859 0.953 3.807 1.00 . A A . 9 PRO CB 1 1
14 2915 1 1 9 PRO CD C 6.522 2.683 3.562 1.00 . A A . 9 PRO CD 1 1
14 2916 1 1 9 PRO CG C 5.635 1.984 4.563 1.00 . A A . 9 PRO CG 1 1
14 2917 1 1 9 PRO HA H 4.824 0.690 1.661 1.00 . A A . 9 PRO HA 1 1
14 2918 1 1 9 PRO HB2 H 3.867 0.826 4.216 1.00 . A A . 9 PRO HB2 1 1
14 2919 1 1 9 PRO HB3 H 5.373 0.004 3.799 1.00 . A A . 9 PRO HB3 1 1
14 2920 1 1 9 PRO HD2 H 6.545 3.747 3.751 1.00 . A A . 9 PRO HD2 1 1
14 2921 1 1 9 PRO HD3 H 7.520 2.274 3.603 1.00 . A A . 9 PRO HD3 1 1
14 2922 1 1 9 PRO HG2 H 4.954 2.691 5.011 1.00 . A A . 9 PRO HG2 1 1
14 2923 1 1 9 PRO HG3 H 6.231 1.508 5.326 1.00 . A A . 9 PRO HG3 1 1
14 2924 1 1 9 PRO N N 5.893 2.396 2.254 1.00 . A A . 9 PRO N 1 1
14 2925 1 1 9 PRO O O 2.985 3.013 3.017 1.00 . A A . 9 PRO O 1 1
14 2926 1 1 10 ILE C C 0.506 1.812 0.746 1.00 . A A . 10 ILE C 1 1
14 2927 1 1 10 ILE CA C 1.670 2.777 0.622 1.00 . A A . 10 ILE CA 1 1
14 2928 1 1 10 ILE CB C 1.763 3.325 -0.832 1.00 . A A . 10 ILE CB 1 1
14 2929 1 1 10 ILE CD1 C 3.228 4.785 -2.356 1.00 . A A . 10 ILE CD1 1 1
14 2930 1 1 10 ILE CG1 C 2.978 4.265 -0.957 1.00 . A A . 10 ILE CG1 1 1
14 2931 1 1 10 ILE CG2 C 0.475 4.056 -1.224 1.00 . A A . 10 ILE CG2 1 1
14 2932 1 1 10 ILE H H 3.310 1.487 0.344 1.00 . A A . 10 ILE H 1 1
14 2933 1 1 10 ILE HA H 1.523 3.602 1.303 1.00 . A A . 10 ILE HA 1 1
14 2934 1 1 10 ILE HB H 1.899 2.490 -1.503 1.00 . A A . 10 ILE HB 1 1
14 2935 1 1 10 ILE HD11 H 3.402 3.957 -3.027 1.00 . A A . 10 ILE HD11 1 1
14 2936 1 1 10 ILE HD12 H 4.092 5.433 -2.349 1.00 . A A . 10 ILE HD12 1 1
14 2937 1 1 10 ILE HD13 H 2.364 5.342 -2.689 1.00 . A A . 10 ILE HD13 1 1
14 2938 1 1 10 ILE HG12 H 2.828 5.119 -0.315 1.00 . A A . 10 ILE HG12 1 1
14 2939 1 1 10 ILE HG13 H 3.862 3.734 -0.635 1.00 . A A . 10 ILE HG13 1 1
14 2940 1 1 10 ILE HG21 H -0.363 3.378 -1.151 1.00 . A A . 10 ILE HG21 1 1
14 2941 1 1 10 ILE HG22 H 0.561 4.416 -2.239 1.00 . A A . 10 ILE HG22 1 1
14 2942 1 1 10 ILE HG23 H 0.320 4.894 -0.560 1.00 . A A . 10 ILE HG23 1 1
14 2943 1 1 10 ILE N N 2.892 2.094 0.989 1.00 . A A . 10 ILE N 1 1
14 2944 1 1 10 ILE O O 0.603 0.658 0.309 1.00 . A A . 10 ILE O 1 1
14 2945 1 1 11 ALA C C -2.934 2.161 1.109 1.00 . A A . 11 ALA C 1 1
14 2946 1 1 11 ALA CA C -1.715 1.417 1.549 1.00 . A A . 11 ALA CA 1 1
14 2947 1 1 11 ALA CB C -1.892 0.942 2.998 1.00 . A A . 11 ALA CB 1 1
14 2948 1 1 11 ALA H H -0.591 3.148 1.760 1.00 . A A . 11 ALA H 1 1
14 2949 1 1 11 ALA HA H -1.598 0.543 0.923 1.00 . A A . 11 ALA HA 1 1
14 2950 1 1 11 ALA HB1 H -2.745 0.284 3.037 1.00 . A A . 11 ALA HB1 1 1
14 2951 1 1 11 ALA HB2 H -2.086 1.750 3.680 1.00 . A A . 11 ALA HB2 1 1
14 2952 1 1 11 ALA N N -0.556 2.242 1.385 1.00 . A A . 11 ALA N 1 1
14 2953 1 1 11 ALA O O -3.000 3.384 1.225 1.00 . A A . 11 ALA O 1 1
14 2954 1 1 12 PHE C C -6.274 1.459 0.940 1.00 . A A . 12 PHE C 1 1
14 2955 1 1 12 PHE CA C -5.114 2.029 0.130 1.00 . A A . 12 PHE CA 1 1
14 2956 1 1 12 PHE CB C -5.315 1.783 -1.374 1.00 . A A . 12 PHE CB 1 1
14 2957 1 1 12 PHE CD1 C -4.106 3.743 -2.385 1.00 . A A . 12 PHE CD1 1 1
14 2958 1 1 12 PHE CD2 C -3.338 1.550 -2.916 1.00 . A A . 12 PHE CD2 1 1
14 2959 1 1 12 PHE CE1 C -3.116 4.286 -3.181 1.00 . A A . 12 PHE CE1 1 1
14 2960 1 1 12 PHE CE2 C -2.346 2.088 -3.715 1.00 . A A . 12 PHE CE2 1 1
14 2961 1 1 12 PHE CG C -4.229 2.369 -2.242 1.00 . A A . 12 PHE CG 1 1
14 2962 1 1 12 PHE CZ C -2.235 3.457 -3.847 1.00 . A A . 12 PHE CZ 1 1
14 2963 1 1 12 PHE H H -3.728 0.474 0.507 1.00 . A A . 12 PHE H 1 1
14 2964 1 1 12 PHE HA H -5.040 3.091 0.310 1.00 . A A . 12 PHE HA 1 1
14 2965 1 1 12 PHE HB2 H -5.345 0.719 -1.553 1.00 . A A . 12 PHE HB2 1 1
14 2966 1 1 12 PHE HB3 H -6.255 2.217 -1.676 1.00 . A A . 12 PHE HB3 1 1
14 2967 1 1 12 PHE HD1 H -4.792 4.394 -1.865 1.00 . A A . 12 PHE HD1 1 1
14 2968 1 1 12 PHE HD2 H -3.420 0.478 -2.815 1.00 . A A . 12 PHE HD2 1 1
14 2969 1 1 12 PHE HE1 H -3.033 5.358 -3.284 1.00 . A A . 12 PHE HE1 1 1
14 2970 1 1 12 PHE HE2 H -1.658 1.438 -4.234 1.00 . A A . 12 PHE HE2 1 1
14 2971 1 1 12 PHE HZ H -1.458 3.880 -4.469 1.00 . A A . 12 PHE HZ 1 1
14 2972 1 1 12 PHE N N -3.878 1.445 0.588 1.00 . A A . 12 PHE N 1 1
14 2973 1 1 12 PHE O O -6.288 0.250 1.221 1.00 . A A . 12 PHE O 1 1
14 2974 1 1 13 PRO C C -9.196 0.705 1.728 1.00 . A A . 13 PRO C 1 1
14 2975 1 1 13 PRO CA C -8.408 1.918 2.205 1.00 . A A . 13 PRO CA 1 1
14 2976 1 1 13 PRO CB C -9.310 3.147 2.179 1.00 . A A . 13 PRO CB 1 1
14 2977 1 1 13 PRO CD C -7.351 3.738 0.957 1.00 . A A . 13 PRO CD 1 1
14 2978 1 1 13 PRO CG C -8.396 4.272 1.890 1.00 . A A . 13 PRO CG 1 1
14 2979 1 1 13 PRO HA H -8.080 1.747 3.220 1.00 . A A . 13 PRO HA 1 1
14 2980 1 1 13 PRO HB2 H -10.054 3.029 1.404 1.00 . A A . 13 PRO HB2 1 1
14 2981 1 1 13 PRO HB3 H -9.796 3.267 3.135 1.00 . A A . 13 PRO HB3 1 1
14 2982 1 1 13 PRO HD2 H -7.661 3.858 -0.070 1.00 . A A . 13 PRO HD2 1 1
14 2983 1 1 13 PRO HD3 H -6.413 4.240 1.137 1.00 . A A . 13 PRO HD3 1 1
14 2984 1 1 13 PRO HG2 H -8.939 5.080 1.425 1.00 . A A . 13 PRO HG2 1 1
14 2985 1 1 13 PRO HG3 H -7.944 4.607 2.811 1.00 . A A . 13 PRO HG3 1 1
14 2986 1 1 13 PRO N N -7.265 2.307 1.325 1.00 . A A . 13 PRO N 1 1
14 2987 1 1 13 PRO O O -9.806 -0.004 2.529 1.00 . A A . 13 PRO O 1 1
14 2988 1 1 14 ASN C C -9.282 -2.004 0.189 1.00 . A A . 14 ASN C 1 1
14 2989 1 1 14 ASN CA C -9.909 -0.656 -0.163 1.00 . A A . 14 ASN CA 1 1
14 2990 1 1 14 ASN CB C -9.971 -0.499 -1.684 1.00 . A A . 14 ASN CB 1 1
14 2991 1 1 14 ASN CG C -8.621 -0.635 -2.354 1.00 . A A . 14 ASN CG 1 1
14 2992 1 1 14 ASN H H -8.630 1.046 -0.134 1.00 . A A . 14 ASN H 1 1
14 2993 1 1 14 ASN HA H -10.916 -0.630 0.225 1.00 . A A . 14 ASN HA 1 1
14 2994 1 1 14 ASN HB2 H -10.621 -1.257 -2.092 1.00 . A A . 14 ASN HB2 1 1
14 2995 1 1 14 ASN HB3 H -10.370 0.476 -1.919 1.00 . A A . 14 ASN HB3 1 1
14 2996 1 1 14 ASN HD21 H -8.924 -2.564 -2.724 1.00 . A A . 14 ASN HD21 1 1
14 2997 1 1 14 ASN HD22 H -7.431 -1.931 -3.277 1.00 . A A . 14 ASN HD22 1 1
14 2998 1 1 14 ASN N N -9.168 0.455 0.437 1.00 . A A . 14 ASN N 1 1
14 2999 1 1 14 ASN ND2 N -8.294 -1.818 -2.824 1.00 . A A . 14 ASN ND2 1 1
14 3000 1 1 14 ASN O O -9.892 -3.061 -0.019 1.00 . A A . 14 ASN O 1 1
14 3001 1 1 14 ASN OD1 O -7.888 0.331 -2.470 1.00 . A A . 14 ASN OD1 1 1
14 3002 2 2 1 . C C -1.534 -2.011 3.085 1.00 . B A . 101 WMH C 1 1
14 3003 2 2 1 . C1 C -0.721 0.195 3.547 1.00 . B A . 101 WMH C1 1 1
14 3004 2 2 1 . C2 C 0.422 0.726 4.046 1.00 . B A . 101 WMH C2 1 1
14 3005 2 2 1 . H1 H -2.182 -2.329 3.880 1.00 . B A . 101 WMH H1 1 1
14 3006 2 2 1 . H2 H -2.169 -1.434 2.431 1.00 . B A . 101 WMH H2 1 1
14 3007 2 2 1 . H5 H 0.632 1.778 4.165 1.00 . B A . 101 WMH H5 1 1
14 3008 2 2 1 . N N -0.599 -1.103 3.556 1.00 . B A . 101 WMH N 1 1
14 3009 2 2 1 . N1 N 1.238 -0.276 4.363 1.00 . B A . 101 WMH N1 1 1
14 3010 2 2 1 . N2 N 0.664 -1.398 4.088 1.00 . B A . 101 WMH N2 1 1
15 3011 1 1 1 GLY C C -6.008 -3.420 0.666 1.00 . A A . 1 GLY C 1 1
15 3012 1 1 1 GLY CA C -7.257 -3.099 1.456 1.00 . A A . 1 GLY CA 1 1
15 3013 1 1 1 GLY H1 H -7.528 -1.037 1.071 1.00 . A A . 1 GLY H1 1 1
15 3014 1 1 1 GLY HA2 H -6.996 -2.950 2.492 1.00 . A A . 1 GLY HA2 1 1
15 3015 1 1 1 GLY HA3 H -7.934 -3.938 1.387 1.00 . A A . 1 GLY HA3 1 1
15 3016 1 1 1 GLY N N -7.943 -1.923 0.968 1.00 . A A . 1 GLY N 1 1
15 3017 1 1 1 GLY O O -5.390 -4.476 0.863 1.00 . A A . 1 GLY O 1 1
15 3018 1 1 2 LYS C C -3.245 -2.166 -0.338 1.00 . A A . 2 LYS C 1 1
15 3019 1 1 2 LYS CA C -4.451 -2.736 -1.043 1.00 . A A . 2 LYS CA 1 1
15 3020 1 1 2 LYS CB C -4.614 -2.096 -2.434 1.00 . A A . 2 LYS CB 1 1
15 3021 1 1 2 LYS CD C -3.077 -3.683 -3.671 1.00 . A A . 2 LYS CD 1 1
15 3022 1 1 2 LYS CE C -1.873 -3.775 -4.588 1.00 . A A . 2 LYS CE 1 1
15 3023 1 1 2 LYS CG C -3.403 -2.230 -3.356 1.00 . A A . 2 LYS CG 1 1
15 3024 1 1 2 LYS H H -6.180 -1.735 -0.366 1.00 . A A . 2 LYS H 1 1
15 3025 1 1 2 LYS HA H -4.308 -3.799 -1.162 1.00 . A A . 2 LYS HA 1 1
15 3026 1 1 2 LYS HB2 H -5.458 -2.551 -2.927 1.00 . A A . 2 LYS HB2 1 1
15 3027 1 1 2 LYS HB3 H -4.822 -1.045 -2.302 1.00 . A A . 2 LYS HB3 1 1
15 3028 1 1 2 LYS HD2 H -2.856 -4.199 -2.749 1.00 . A A . 2 LYS HD2 1 1
15 3029 1 1 2 LYS HD3 H -3.927 -4.141 -4.152 1.00 . A A . 2 LYS HD3 1 1
15 3030 1 1 2 LYS HE2 H -2.099 -3.241 -5.499 1.00 . A A . 2 LYS HE2 1 1
15 3031 1 1 2 LYS HE3 H -1.028 -3.309 -4.102 1.00 . A A . 2 LYS HE3 1 1
15 3032 1 1 2 LYS HG2 H -3.608 -1.712 -4.281 1.00 . A A . 2 LYS HG2 1 1
15 3033 1 1 2 LYS HG3 H -2.549 -1.774 -2.873 1.00 . A A . 2 LYS HG3 1 1
15 3034 1 1 2 LYS HZ1 H -0.688 -5.183 -5.552 1.00 . A A . 2 LYS HZ1 1 1
15 3035 1 1 2 LYS HZ2 H -2.291 -5.647 -5.453 1.00 . A A . 2 LYS HZ2 1 1
15 3036 1 1 2 LYS HZ3 H -1.300 -5.737 -4.098 1.00 . A A . 2 LYS HZ3 1 1
15 3037 1 1 2 LYS N N -5.637 -2.542 -0.234 1.00 . A A . 2 LYS N 1 1
15 3038 1 1 2 LYS NZ N -1.527 -5.167 -4.936 1.00 . A A . 2 LYS NZ 1 1
15 3039 1 1 2 LYS O O -3.128 -0.963 -0.167 1.00 . A A . 2 LYS O 1 1
15 3040 1 1 3 ALA C C 0.000 -3.305 0.035 1.00 . A A . 3 ALA C 1 1
15 3041 1 1 3 ALA CA C -1.157 -2.666 0.723 1.00 . A A . 3 ALA CA 1 1
15 3042 1 1 3 ALA CB C -1.175 -2.988 2.225 1.00 . A A . 3 ALA CB 1 1
15 3043 1 1 3 ALA H H -2.580 -3.990 -0.011 1.00 . A A . 3 ALA H 1 1
15 3044 1 1 3 ALA HA H -1.052 -1.596 0.610 1.00 . A A . 3 ALA HA 1 1
15 3045 1 1 3 ALA HB1 H -0.176 -3.249 2.541 1.00 . A A . 3 ALA HB1 1 1
15 3046 1 1 3 ALA HB2 H -1.832 -3.828 2.392 1.00 . A A . 3 ALA HB2 1 1
15 3047 1 1 3 ALA N N -2.392 -3.032 0.094 1.00 . A A . 3 ALA N 1 1
15 3048 1 1 3 ALA O O -0.021 -4.499 -0.268 1.00 . A A . 3 ALA O 1 1
15 3049 1 1 4 LEU C C 3.342 -2.637 0.054 1.00 . A A . 4 LEU C 1 1
15 3050 1 1 4 LEU CA C 2.194 -2.969 -0.853 1.00 . A A . 4 LEU CA 1 1
15 3051 1 1 4 LEU CB C 2.384 -2.306 -2.221 1.00 . A A . 4 LEU CB 1 1
15 3052 1 1 4 LEU CD1 C 3.641 -4.184 -3.340 1.00 . A A . 4 LEU CD1 1 1
15 3053 1 1 4 LEU CD2 C 3.775 -1.859 -4.263 1.00 . A A . 4 LEU CD2 1 1
15 3054 1 1 4 LEU CG C 3.647 -2.699 -3.004 1.00 . A A . 4 LEU CG 1 1
15 3055 1 1 4 LEU H H 0.919 -1.557 -0.005 1.00 . A A . 4 LEU H 1 1
15 3056 1 1 4 LEU HA H 2.127 -4.040 -0.981 1.00 . A A . 4 LEU HA 1 1
15 3057 1 1 4 LEU HB2 H 1.524 -2.544 -2.829 1.00 . A A . 4 LEU HB2 1 1
15 3058 1 1 4 LEU HB3 H 2.407 -1.238 -2.065 1.00 . A A . 4 LEU HB3 1 1
15 3059 1 1 4 LEU HD11 H 2.768 -4.414 -3.932 1.00 . A A . 4 LEU HD11 1 1
15 3060 1 1 4 LEU HD12 H 3.627 -4.763 -2.430 1.00 . A A . 4 LEU HD12 1 1
15 3061 1 1 4 LEU HD13 H 4.530 -4.425 -3.906 1.00 . A A . 4 LEU HD13 1 1
15 3062 1 1 4 LEU HD21 H 2.907 -2.013 -4.889 1.00 . A A . 4 LEU HD21 1 1
15 3063 1 1 4 LEU HD22 H 4.663 -2.154 -4.803 1.00 . A A . 4 LEU HD22 1 1
15 3064 1 1 4 LEU HD23 H 3.846 -0.815 -3.997 1.00 . A A . 4 LEU HD23 1 1
15 3065 1 1 4 LEU HG H 4.510 -2.510 -2.382 1.00 . A A . 4 LEU HG 1 1
15 3066 1 1 4 LEU N N 0.991 -2.515 -0.232 1.00 . A A . 4 LEU N 1 1
15 3067 1 1 4 LEU O O 3.502 -1.472 0.464 1.00 . A A . 4 LEU O 1 1
15 3068 1 1 5 PHE C C 6.403 -2.908 0.445 1.00 . A A . 5 PHE C 1 1
15 3069 1 1 5 PHE CA C 5.231 -3.436 1.264 1.00 . A A . 5 PHE CA 1 1
15 3070 1 1 5 PHE CB C 5.598 -4.716 2.013 1.00 . A A . 5 PHE CB 1 1
15 3071 1 1 5 PHE CD1 C 7.945 -4.720 2.910 1.00 . A A . 5 PHE CD1 1 1
15 3072 1 1 5 PHE CD2 C 6.175 -4.092 4.361 1.00 . A A . 5 PHE CD2 1 1
15 3073 1 1 5 PHE CE1 C 8.851 -4.529 3.927 1.00 . A A . 5 PHE CE1 1 1
15 3074 1 1 5 PHE CE2 C 7.077 -3.898 5.382 1.00 . A A . 5 PHE CE2 1 1
15 3075 1 1 5 PHE CG C 6.597 -4.505 3.115 1.00 . A A . 5 PHE CG 1 1
15 3076 1 1 5 PHE CZ C 8.417 -4.118 5.164 1.00 . A A . 5 PHE CZ 1 1
15 3077 1 1 5 PHE H H 3.872 -4.540 0.108 1.00 . A A . 5 PHE H 1 1
15 3078 1 1 5 PHE HA H 4.955 -2.675 1.980 1.00 . A A . 5 PHE HA 1 1
15 3079 1 1 5 PHE HB2 H 4.706 -5.138 2.453 1.00 . A A . 5 PHE HB2 1 1
15 3080 1 1 5 PHE HB3 H 6.014 -5.425 1.314 1.00 . A A . 5 PHE HB3 1 1
15 3081 1 1 5 PHE HD1 H 8.288 -5.040 1.936 1.00 . A A . 5 PHE HD1 1 1
15 3082 1 1 5 PHE HD2 H 5.123 -3.920 4.536 1.00 . A A . 5 PHE HD2 1 1
15 3083 1 1 5 PHE HE1 H 9.905 -4.699 3.758 1.00 . A A . 5 PHE HE1 1 1
15 3084 1 1 5 PHE HE2 H 6.734 -3.575 6.355 1.00 . A A . 5 PHE HE2 1 1
15 3085 1 1 5 PHE HZ H 9.125 -3.969 5.964 1.00 . A A . 5 PHE HZ 1 1
15 3086 1 1 5 PHE N N 4.100 -3.637 0.413 1.00 . A A . 5 PHE N 1 1
15 3087 1 1 5 PHE O O 7.156 -3.671 -0.199 1.00 . A A . 5 PHE O 1 1
15 3088 1 1 6 SER C C 8.183 0.017 0.723 1.00 . A A . 6 SER C 1 1
15 3089 1 1 6 SER CA C 7.502 -0.917 -0.276 1.00 . A A . 6 SER CA 1 1
15 3090 1 1 6 SER CB C 6.849 -0.147 -1.435 1.00 . A A . 6 SER CB 1 1
15 3091 1 1 6 SER H H 5.797 -1.088 0.845 1.00 . A A . 6 SER H 1 1
15 3092 1 1 6 SER HA H 8.210 -1.624 -0.672 1.00 . A A . 6 SER HA 1 1
15 3093 1 1 6 SER HB2 H 7.549 0.571 -1.836 1.00 . A A . 6 SER HB2 1 1
15 3094 1 1 6 SER HB3 H 6.555 -0.841 -2.209 1.00 . A A . 6 SER HB3 1 1
15 3095 1 1 6 SER HG H 5.928 1.477 -0.819 1.00 . A A . 6 SER HG 1 1
15 3096 1 1 6 SER N N 6.483 -1.628 0.401 1.00 . A A . 6 SER N 1 1
15 3097 1 1 6 SER O O 7.983 -0.125 1.926 1.00 . A A . 6 SER O 1 1
15 3098 1 1 6 SER OG O 5.693 0.555 -0.986 1.00 . A A . 6 SER OG 1 1
15 3099 1 1 7 ASN C C 9.640 3.269 0.370 1.00 . A A . 7 ASN C 1 1
15 3100 1 1 7 ASN CA C 9.613 1.917 1.092 1.00 . A A . 7 ASN CA 1 1
15 3101 1 1 7 ASN CB C 11.029 1.459 1.578 1.00 . A A . 7 ASN CB 1 1
15 3102 1 1 7 ASN CG C 11.999 1.034 0.467 1.00 . A A . 7 ASN CG 1 1
15 3103 1 1 7 ASN H H 9.173 0.968 -0.713 1.00 . A A . 7 ASN H 1 1
15 3104 1 1 7 ASN HA H 8.963 2.019 1.947 1.00 . A A . 7 ASN HA 1 1
15 3105 1 1 7 ASN HB2 H 11.489 2.277 2.112 1.00 . A A . 7 ASN HB2 1 1
15 3106 1 1 7 ASN HB3 H 10.904 0.632 2.259 1.00 . A A . 7 ASN HB3 1 1
15 3107 1 1 7 ASN HD21 H 11.396 -0.855 0.608 1.00 . A A . 7 ASN HD21 1 1
15 3108 1 1 7 ASN HD22 H 12.617 -0.534 -0.561 1.00 . A A . 7 ASN HD22 1 1
15 3109 1 1 7 ASN N N 8.979 0.929 0.248 1.00 . A A . 7 ASN N 1 1
15 3110 1 1 7 ASN ND2 N 12.001 -0.237 0.141 1.00 . A A . 7 ASN ND2 1 1
15 3111 1 1 7 ASN O O 10.464 3.494 -0.511 1.00 . A A . 7 ASN O 1 1
15 3112 1 1 7 ASN OD1 O 12.758 1.845 -0.073 1.00 . A A . 7 ASN OD1 1 1
15 3113 1 1 8 PRO C C 6.542 3.087 1.280 1.00 . A A . 8 PRO C 1 1
15 3114 1 1 8 PRO CA C 7.675 4.023 1.733 1.00 . A A . 8 PRO CA 1 1
15 3115 1 1 8 PRO CB C 7.107 5.450 1.912 1.00 . A A . 8 PRO CB 1 1
15 3116 1 1 8 PRO CD C 8.557 5.480 0.021 1.00 . A A . 8 PRO CD 1 1
15 3117 1 1 8 PRO CG C 7.972 6.342 1.086 1.00 . A A . 8 PRO CG 1 1
15 3118 1 1 8 PRO HA H 8.102 3.685 2.665 1.00 . A A . 8 PRO HA 1 1
15 3119 1 1 8 PRO HB2 H 6.084 5.473 1.568 1.00 . A A . 8 PRO HB2 1 1
15 3120 1 1 8 PRO HB3 H 7.140 5.726 2.953 1.00 . A A . 8 PRO HB3 1 1
15 3121 1 1 8 PRO HD2 H 7.878 5.400 -0.816 1.00 . A A . 8 PRO HD2 1 1
15 3122 1 1 8 PRO HD3 H 9.515 5.859 -0.303 1.00 . A A . 8 PRO HD3 1 1
15 3123 1 1 8 PRO HG2 H 7.376 7.130 0.648 1.00 . A A . 8 PRO HG2 1 1
15 3124 1 1 8 PRO HG3 H 8.753 6.767 1.698 1.00 . A A . 8 PRO HG3 1 1
15 3125 1 1 8 PRO N N 8.707 4.193 0.689 1.00 . A A . 8 PRO N 1 1
15 3126 1 1 8 PRO O O 6.237 3.018 0.076 1.00 . A A . 8 PRO O 1 1
15 3127 1 1 9 PRO C C 3.594 2.227 1.424 1.00 . A A . 9 PRO C 1 1
15 3128 1 1 9 PRO CA C 4.810 1.437 1.905 1.00 . A A . 9 PRO CA 1 1
15 3129 1 1 9 PRO CB C 4.498 0.756 3.241 1.00 . A A . 9 PRO CB 1 1
15 3130 1 1 9 PRO CD C 6.355 2.201 3.625 1.00 . A A . 9 PRO CD 1 1
15 3131 1 1 9 PRO CG C 5.733 0.908 4.049 1.00 . A A . 9 PRO CG 1 1
15 3132 1 1 9 PRO HA H 5.073 0.698 1.163 1.00 . A A . 9 PRO HA 1 1
15 3133 1 1 9 PRO HB2 H 3.657 1.249 3.706 1.00 . A A . 9 PRO HB2 1 1
15 3134 1 1 9 PRO HB3 H 4.261 -0.284 3.074 1.00 . A A . 9 PRO HB3 1 1
15 3135 1 1 9 PRO HD2 H 5.977 3.019 4.222 1.00 . A A . 9 PRO HD2 1 1
15 3136 1 1 9 PRO HD3 H 7.428 2.131 3.713 1.00 . A A . 9 PRO HD3 1 1
15 3137 1 1 9 PRO HG2 H 5.481 0.944 5.097 1.00 . A A . 9 PRO HG2 1 1
15 3138 1 1 9 PRO HG3 H 6.405 0.086 3.852 1.00 . A A . 9 PRO HG3 1 1
15 3139 1 1 9 PRO N N 5.946 2.317 2.211 1.00 . A A . 9 PRO N 1 1
15 3140 1 1 9 PRO O O 3.346 3.357 1.876 1.00 . A A . 9 PRO O 1 1
15 3141 1 1 10 ILE C C 0.440 1.484 0.270 1.00 . A A . 10 ILE C 1 1
15 3142 1 1 10 ILE CA C 1.691 2.314 -0.018 1.00 . A A . 10 ILE CA 1 1
15 3143 1 1 10 ILE CB C 1.862 2.618 -1.545 1.00 . A A . 10 ILE CB 1 1
15 3144 1 1 10 ILE CD1 C 0.789 3.770 -3.558 1.00 . A A . 10 ILE CD1 1 1
15 3145 1 1 10 ILE CG1 C 0.641 3.357 -2.106 1.00 . A A . 10 ILE CG1 1 1
15 3146 1 1 10 ILE CG2 C 2.161 1.350 -2.344 1.00 . A A . 10 ILE CG2 1 1
15 3147 1 1 10 ILE H H 3.071 0.749 0.218 1.00 . A A . 10 ILE H 1 1
15 3148 1 1 10 ILE HA H 1.593 3.250 0.514 1.00 . A A . 10 ILE HA 1 1
15 3149 1 1 10 ILE HB H 2.728 3.257 -1.643 1.00 . A A . 10 ILE HB 1 1
15 3150 1 1 10 ILE HD11 H 0.949 2.894 -4.167 1.00 . A A . 10 ILE HD11 1 1
15 3151 1 1 10 ILE HD12 H 1.631 4.440 -3.658 1.00 . A A . 10 ILE HD12 1 1
15 3152 1 1 10 ILE HD13 H -0.112 4.272 -3.878 1.00 . A A . 10 ILE HD13 1 1
15 3153 1 1 10 ILE HG12 H -0.224 2.717 -2.034 1.00 . A A . 10 ILE HG12 1 1
15 3154 1 1 10 ILE HG13 H 0.471 4.250 -1.522 1.00 . A A . 10 ILE HG13 1 1
15 3155 1 1 10 ILE HG21 H 1.346 0.652 -2.216 1.00 . A A . 10 ILE HG21 1 1
15 3156 1 1 10 ILE HG22 H 3.079 0.906 -1.990 1.00 . A A . 10 ILE HG22 1 1
15 3157 1 1 10 ILE HG23 H 2.259 1.598 -3.391 1.00 . A A . 10 ILE HG23 1 1
15 3158 1 1 10 ILE N N 2.852 1.657 0.524 1.00 . A A . 10 ILE N 1 1
15 3159 1 1 10 ILE O O 0.404 0.267 0.001 1.00 . A A . 10 ILE O 1 1
15 3160 1 1 11 ALA C C -2.980 2.241 0.851 1.00 . A A . 11 ALA C 1 1
15 3161 1 1 11 ALA CA C -1.777 1.438 1.257 1.00 . A A . 11 ALA CA 1 1
15 3162 1 1 11 ALA CB C -1.857 1.125 2.767 1.00 . A A . 11 ALA CB 1 1
15 3163 1 1 11 ALA H H -0.463 3.069 1.089 1.00 . A A . 11 ALA H 1 1
15 3164 1 1 11 ALA HA H -1.801 0.500 0.721 1.00 . A A . 11 ALA HA 1 1
15 3165 1 1 11 ALA HB1 H -2.740 0.530 2.941 1.00 . A A . 11 ALA HB1 1 1
15 3166 1 1 11 ALA HB2 H -1.952 2.003 3.380 1.00 . A A . 11 ALA HB2 1 1
15 3167 1 1 11 ALA N N -0.550 2.115 0.888 1.00 . A A . 11 ALA N 1 1
15 3168 1 1 11 ALA O O -2.954 3.480 0.859 1.00 . A A . 11 ALA O 1 1
15 3169 1 1 12 PHE C C -6.384 1.580 0.975 1.00 . A A . 12 PHE C 1 1
15 3170 1 1 12 PHE CA C -5.273 2.127 0.100 1.00 . A A . 12 PHE CA 1 1
15 3171 1 1 12 PHE CB C -5.576 1.818 -1.373 1.00 . A A . 12 PHE CB 1 1
15 3172 1 1 12 PHE CD1 C -4.789 3.727 -2.781 1.00 . A A . 12 PHE CD1 1 1
15 3173 1 1 12 PHE CD2 C -3.539 1.703 -2.835 1.00 . A A . 12 PHE CD2 1 1
15 3174 1 1 12 PHE CE1 C -3.917 4.297 -3.680 1.00 . A A . 12 PHE CE1 1 1
15 3175 1 1 12 PHE CE2 C -2.661 2.267 -3.734 1.00 . A A . 12 PHE CE2 1 1
15 3176 1 1 12 PHE CG C -4.612 2.428 -2.347 1.00 . A A . 12 PHE CG 1 1
15 3177 1 1 12 PHE CZ C -2.852 3.568 -4.159 1.00 . A A . 12 PHE CZ 1 1
15 3178 1 1 12 PHE H H -3.940 0.562 0.537 1.00 . A A . 12 PHE H 1 1
15 3179 1 1 12 PHE HA H -5.193 3.197 0.229 1.00 . A A . 12 PHE HA 1 1
15 3180 1 1 12 PHE HB2 H -5.559 0.747 -1.516 1.00 . A A . 12 PHE HB2 1 1
15 3181 1 1 12 PHE HB3 H -6.565 2.181 -1.606 1.00 . A A . 12 PHE HB3 1 1
15 3182 1 1 12 PHE HD1 H -5.622 4.302 -2.406 1.00 . A A . 12 PHE HD1 1 1
15 3183 1 1 12 PHE HD2 H -3.391 0.687 -2.501 1.00 . A A . 12 PHE HD2 1 1
15 3184 1 1 12 PHE HE1 H -4.070 5.313 -4.010 1.00 . A A . 12 PHE HE1 1 1
15 3185 1 1 12 PHE HE2 H -1.826 1.694 -4.109 1.00 . A A . 12 PHE HE2 1 1
15 3186 1 1 12 PHE HZ H -2.166 4.015 -4.866 1.00 . A A . 12 PHE HZ 1 1
15 3187 1 1 12 PHE N N -4.020 1.545 0.507 1.00 . A A . 12 PHE N 1 1
15 3188 1 1 12 PHE O O -6.359 0.390 1.316 1.00 . A A . 12 PHE O 1 1
15 3189 1 1 13 PRO C C -9.307 0.818 1.736 1.00 . A A . 13 PRO C 1 1
15 3190 1 1 13 PRO CA C -8.524 2.052 2.219 1.00 . A A . 13 PRO CA 1 1
15 3191 1 1 13 PRO CB C -9.416 3.290 2.173 1.00 . A A . 13 PRO CB 1 1
15 3192 1 1 13 PRO CD C -7.421 3.875 1.024 1.00 . A A . 13 PRO CD 1 1
15 3193 1 1 13 PRO CG C -8.465 4.405 1.960 1.00 . A A . 13 PRO CG 1 1
15 3194 1 1 13 PRO HA H -8.211 1.881 3.238 1.00 . A A . 13 PRO HA 1 1
15 3195 1 1 13 PRO HB2 H -10.116 3.199 1.355 1.00 . A A . 13 PRO HB2 1 1
15 3196 1 1 13 PRO HB3 H -9.952 3.398 3.104 1.00 . A A . 13 PRO HB3 1 1
15 3197 1 1 13 PRO HD2 H -7.714 4.027 -0.005 1.00 . A A . 13 PRO HD2 1 1
15 3198 1 1 13 PRO HD3 H -6.476 4.354 1.226 1.00 . A A . 13 PRO HD3 1 1
15 3199 1 1 13 PRO HG2 H -8.977 5.252 1.527 1.00 . A A . 13 PRO HG2 1 1
15 3200 1 1 13 PRO HG3 H -8.012 4.685 2.900 1.00 . A A . 13 PRO HG3 1 1
15 3201 1 1 13 PRO N N -7.366 2.433 1.361 1.00 . A A . 13 PRO N 1 1
15 3202 1 1 13 PRO O O -10.059 0.216 2.507 1.00 . A A . 13 PRO O 1 1
15 3203 1 1 14 ASN C C -9.134 -2.029 0.395 1.00 . A A . 14 ASN C 1 1
15 3204 1 1 14 ASN CA C -9.792 -0.728 -0.087 1.00 . A A . 14 ASN CA 1 1
15 3205 1 1 14 ASN CB C -9.852 -0.684 -1.642 1.00 . A A . 14 ASN CB 1 1
15 3206 1 1 14 ASN CG C -8.491 -0.666 -2.349 1.00 . A A . 14 ASN CG 1 1
15 3207 1 1 14 ASN H H -8.585 1.028 -0.095 1.00 . A A . 14 ASN H 1 1
15 3208 1 1 14 ASN HA H -10.803 -0.718 0.293 1.00 . A A . 14 ASN HA 1 1
15 3209 1 1 14 ASN HB2 H -10.382 -1.560 -1.990 1.00 . A A . 14 ASN HB2 1 1
15 3210 1 1 14 ASN HB3 H -10.404 0.191 -1.945 1.00 . A A . 14 ASN HB3 1 1
15 3211 1 1 14 ASN HD21 H -9.256 0.368 -3.836 1.00 . A A . 14 ASN HD21 1 1
15 3212 1 1 14 ASN HD22 H -7.585 -0.011 -3.977 1.00 . A A . 14 ASN HD22 1 1
15 3213 1 1 14 ASN N N -9.142 0.456 0.476 1.00 . A A . 14 ASN N 1 1
15 3214 1 1 14 ASN ND2 N -8.435 -0.049 -3.492 1.00 . A A . 14 ASN ND2 1 1
15 3215 1 1 14 ASN O O -9.697 -3.110 0.243 1.00 . A A . 14 ASN O 1 1
15 3216 1 1 14 ASN OD1 O -7.510 -1.208 -1.871 1.00 . A A . 14 ASN OD1 1 1
15 3217 2 2 1 . C C -1.658 -1.832 3.071 1.00 . B A . 101 WMH C 1 1
15 3218 2 2 1 . C1 C -0.694 0.360 3.294 1.00 . B A . 101 WMH C1 1 1
15 3219 2 2 1 . C2 C 0.511 0.864 3.671 1.00 . B A . 101 WMH C2 1 1
15 3220 2 2 1 . H1 H -2.228 -2.049 3.954 1.00 . B A . 101 WMH H1 1 1
15 3221 2 2 1 . H2 H -2.322 -1.284 2.420 1.00 . B A . 101 WMH H2 1 1
15 3222 2 2 1 . H5 H 0.782 1.910 3.702 1.00 . B A . 101 WMH H5 1 1
15 3223 2 2 1 . N N -0.636 -0.939 3.386 1.00 . B A . 101 WMH N 1 1
15 3224 2 2 1 . N1 N 1.293 -0.157 3.991 1.00 . B A . 101 WMH N1 1 1
15 3225 2 2 1 . N2 N 0.646 -1.263 3.837 1.00 . B A . 101 WMH N2 1 1
16 3226 1 1 1 GLY C C -5.702 -3.278 -0.109 1.00 . A A . 1 GLY C 1 1
16 3227 1 1 1 GLY CA C -6.966 -3.193 0.700 1.00 . A A . 1 GLY CA 1 1
16 3228 1 1 1 GLY H1 H -7.442 -1.144 0.752 1.00 . A A . 1 GLY H1 1 1
16 3229 1 1 1 GLY HA2 H -6.705 -3.187 1.747 1.00 . A A . 1 GLY HA2 1 1
16 3230 1 1 1 GLY HA3 H -7.571 -4.064 0.492 1.00 . A A . 1 GLY HA3 1 1
16 3231 1 1 1 GLY N N -7.739 -2.015 0.406 1.00 . A A . 1 GLY N 1 1
16 3232 1 1 1 GLY O O -5.105 -4.352 -0.230 1.00 . A A . 1 GLY O 1 1
16 3233 1 1 2 LYS C C -2.939 -1.743 -0.523 1.00 . A A . 2 LYS C 1 1
16 3234 1 1 2 LYS CA C -4.077 -2.153 -1.454 1.00 . A A . 2 LYS CA 1 1
16 3235 1 1 2 LYS CB C -4.221 -1.202 -2.672 1.00 . A A . 2 LYS CB 1 1
16 3236 1 1 2 LYS CD C -1.783 -0.762 -3.375 1.00 . A A . 2 LYS CD 1 1
16 3237 1 1 2 LYS CE C -0.764 -0.957 -4.490 1.00 . A A . 2 LYS CE 1 1
16 3238 1 1 2 LYS CG C -3.147 -1.319 -3.773 1.00 . A A . 2 LYS CG 1 1
16 3239 1 1 2 LYS H H -5.823 -1.350 -0.599 1.00 . A A . 2 LYS H 1 1
16 3240 1 1 2 LYS HA H -3.896 -3.160 -1.797 1.00 . A A . 2 LYS HA 1 1
16 3241 1 1 2 LYS HB2 H -5.180 -1.385 -3.134 1.00 . A A . 2 LYS HB2 1 1
16 3242 1 1 2 LYS HB3 H -4.215 -0.187 -2.307 1.00 . A A . 2 LYS HB3 1 1
16 3243 1 1 2 LYS HD2 H -1.882 0.294 -3.179 1.00 . A A . 2 LYS HD2 1 1
16 3244 1 1 2 LYS HD3 H -1.436 -1.267 -2.484 1.00 . A A . 2 LYS HD3 1 1
16 3245 1 1 2 LYS HE2 H 0.183 -0.536 -4.190 1.00 . A A . 2 LYS HE2 1 1
16 3246 1 1 2 LYS HE3 H -0.641 -2.014 -4.667 1.00 . A A . 2 LYS HE3 1 1
16 3247 1 1 2 LYS HG2 H -3.018 -2.359 -4.031 1.00 . A A . 2 LYS HG2 1 1
16 3248 1 1 2 LYS HG3 H -3.496 -0.783 -4.644 1.00 . A A . 2 LYS HG3 1 1
16 3249 1 1 2 LYS HZ1 H -0.457 -0.457 -6.481 1.00 . A A . 2 LYS HZ1 1 1
16 3250 1 1 2 LYS HZ2 H -1.340 0.708 -5.644 1.00 . A A . 2 LYS HZ2 1 1
16 3251 1 1 2 LYS HZ3 H -2.066 -0.739 -6.104 1.00 . A A . 2 LYS HZ3 1 1
16 3252 1 1 2 LYS N N -5.295 -2.174 -0.687 1.00 . A A . 2 LYS N 1 1
16 3253 1 1 2 LYS NZ N -1.185 -0.315 -5.749 1.00 . A A . 2 LYS NZ 1 1
16 3254 1 1 2 LYS O O -2.859 -0.593 -0.089 1.00 . A A . 2 LYS O 1 1
16 3255 1 1 3 ALA C C 0.244 -3.162 0.157 1.00 . A A . 3 ALA C 1 1
16 3256 1 1 3 ALA CA C -0.984 -2.506 0.701 1.00 . A A . 3 ALA CA 1 1
16 3257 1 1 3 ALA CB C -1.286 -3.000 2.115 1.00 . A A . 3 ALA CB 1 1
16 3258 1 1 3 ALA H H -2.276 -3.611 -0.511 1.00 . A A . 3 ALA H 1 1
16 3259 1 1 3 ALA HA H -0.803 -1.443 0.749 1.00 . A A . 3 ALA HA 1 1
16 3260 1 1 3 ALA HB1 H -0.372 -3.371 2.553 1.00 . A A . 3 ALA HB1 1 1
16 3261 1 1 3 ALA HB2 H -2.000 -3.808 2.056 1.00 . A A . 3 ALA HB2 1 1
16 3262 1 1 3 ALA N N -2.122 -2.703 -0.171 1.00 . A A . 3 ALA N 1 1
16 3263 1 1 3 ALA O O 0.205 -4.307 -0.284 1.00 . A A . 3 ALA O 1 1
16 3264 1 1 4 LEU C C 3.633 -2.665 0.735 1.00 . A A . 4 LEU C 1 1
16 3265 1 1 4 LEU CA C 2.589 -2.935 -0.318 1.00 . A A . 4 LEU CA 1 1
16 3266 1 1 4 LEU CB C 2.995 -2.340 -1.711 1.00 . A A . 4 LEU CB 1 1
16 3267 1 1 4 LEU CD1 C 3.788 -0.498 -3.224 1.00 . A A . 4 LEU CD1 1 1
16 3268 1 1 4 LEU CD2 C 1.971 -0.016 -1.643 1.00 . A A . 4 LEU CD2 1 1
16 3269 1 1 4 LEU CG C 3.242 -0.811 -1.845 1.00 . A A . 4 LEU CG 1 1
16 3270 1 1 4 LEU H H 1.295 -1.521 0.506 1.00 . A A . 4 LEU H 1 1
16 3271 1 1 4 LEU HA H 2.482 -4.008 -0.403 1.00 . A A . 4 LEU HA 1 1
16 3272 1 1 4 LEU HB2 H 3.905 -2.832 -2.022 1.00 . A A . 4 LEU HB2 1 1
16 3273 1 1 4 LEU HB3 H 2.223 -2.611 -2.415 1.00 . A A . 4 LEU HB3 1 1
16 3274 1 1 4 LEU HD11 H 4.723 -1.020 -3.370 1.00 . A A . 4 LEU HD11 1 1
16 3275 1 1 4 LEU HD12 H 3.955 0.566 -3.305 1.00 . A A . 4 LEU HD12 1 1
16 3276 1 1 4 LEU HD13 H 3.078 -0.813 -3.974 1.00 . A A . 4 LEU HD13 1 1
16 3277 1 1 4 LEU HD21 H 2.182 1.034 -1.784 1.00 . A A . 4 LEU HD21 1 1
16 3278 1 1 4 LEU HD22 H 1.601 -0.171 -0.641 1.00 . A A . 4 LEU HD22 1 1
16 3279 1 1 4 LEU HD23 H 1.225 -0.332 -2.355 1.00 . A A . 4 LEU HD23 1 1
16 3280 1 1 4 LEU HG H 3.972 -0.499 -1.111 1.00 . A A . 4 LEU HG 1 1
16 3281 1 1 4 LEU N N 1.319 -2.440 0.158 1.00 . A A . 4 LEU N 1 1
16 3282 1 1 4 LEU O O 3.539 -1.664 1.457 1.00 . A A . 4 LEU O 1 1
16 3283 1 1 5 PHE C C 6.852 -2.753 1.361 1.00 . A A . 5 PHE C 1 1
16 3284 1 1 5 PHE CA C 5.603 -3.422 1.899 1.00 . A A . 5 PHE CA 1 1
16 3285 1 1 5 PHE CB C 5.922 -4.766 2.595 1.00 . A A . 5 PHE CB 1 1
16 3286 1 1 5 PHE CD1 C 7.734 -5.995 1.363 1.00 . A A . 5 PHE CD1 1 1
16 3287 1 1 5 PHE CD2 C 5.497 -6.786 1.164 1.00 . A A . 5 PHE CD2 1 1
16 3288 1 1 5 PHE CE1 C 8.173 -7.009 0.537 1.00 . A A . 5 PHE CE1 1 1
16 3289 1 1 5 PHE CE2 C 5.926 -7.804 0.334 1.00 . A A . 5 PHE CE2 1 1
16 3290 1 1 5 PHE CG C 6.394 -5.868 1.683 1.00 . A A . 5 PHE CG 1 1
16 3291 1 1 5 PHE CZ C 7.267 -7.916 0.022 1.00 . A A . 5 PHE CZ 1 1
16 3292 1 1 5 PHE H H 4.619 -4.335 0.272 1.00 . A A . 5 PHE H 1 1
16 3293 1 1 5 PHE HA H 5.201 -2.749 2.638 1.00 . A A . 5 PHE HA 1 1
16 3294 1 1 5 PHE HB2 H 6.699 -4.604 3.326 1.00 . A A . 5 PHE HB2 1 1
16 3295 1 1 5 PHE HB3 H 5.035 -5.110 3.104 1.00 . A A . 5 PHE HB3 1 1
16 3296 1 1 5 PHE HD1 H 8.437 -5.279 1.767 1.00 . A A . 5 PHE HD1 1 1
16 3297 1 1 5 PHE HD2 H 4.451 -6.690 1.416 1.00 . A A . 5 PHE HD2 1 1
16 3298 1 1 5 PHE HE1 H 9.223 -7.095 0.298 1.00 . A A . 5 PHE HE1 1 1
16 3299 1 1 5 PHE HE2 H 5.218 -8.512 -0.068 1.00 . A A . 5 PHE HE2 1 1
16 3300 1 1 5 PHE HZ H 7.605 -8.714 -0.624 1.00 . A A . 5 PHE HZ 1 1
16 3301 1 1 5 PHE N N 4.580 -3.562 0.878 1.00 . A A . 5 PHE N 1 1
16 3302 1 1 5 PHE O O 7.760 -2.415 2.121 1.00 . A A . 5 PHE O 1 1
16 3303 1 1 6 SER C C 7.954 -0.411 -0.233 1.00 . A A . 6 SER C 1 1
16 3304 1 1 6 SER CA C 7.999 -1.893 -0.560 1.00 . A A . 6 SER CA 1 1
16 3305 1 1 6 SER CB C 7.936 -2.118 -2.056 1.00 . A A . 6 SER CB 1 1
16 3306 1 1 6 SER H H 6.172 -2.904 -0.502 1.00 . A A . 6 SER H 1 1
16 3307 1 1 6 SER HA H 8.917 -2.317 -0.181 1.00 . A A . 6 SER HA 1 1
16 3308 1 1 6 SER HB2 H 8.620 -1.428 -2.530 1.00 . A A . 6 SER HB2 1 1
16 3309 1 1 6 SER HB3 H 8.217 -3.132 -2.289 1.00 . A A . 6 SER HB3 1 1
16 3310 1 1 6 SER HG H 6.355 -1.013 -2.191 1.00 . A A . 6 SER HG 1 1
16 3311 1 1 6 SER N N 6.899 -2.570 0.064 1.00 . A A . 6 SER N 1 1
16 3312 1 1 6 SER O O 6.901 0.219 -0.358 1.00 . A A . 6 SER O 1 1
16 3313 1 1 6 SER OG O 6.622 -1.872 -2.542 1.00 . A A . 6 SER OG 1 1
16 3314 1 1 7 ASN C C 9.028 2.432 -0.643 1.00 . A A . 7 ASN C 1 1
16 3315 1 1 7 ASN CA C 9.214 1.526 0.581 1.00 . A A . 7 ASN CA 1 1
16 3316 1 1 7 ASN CB C 10.604 1.751 1.226 1.00 . A A . 7 ASN CB 1 1
16 3317 1 1 7 ASN CG C 10.866 3.183 1.698 1.00 . A A . 7 ASN CG 1 1
16 3318 1 1 7 ASN H H 9.878 -0.452 0.222 1.00 . A A . 7 ASN H 1 1
16 3319 1 1 7 ASN HA H 8.444 1.725 1.309 1.00 . A A . 7 ASN HA 1 1
16 3320 1 1 7 ASN HB2 H 10.702 1.100 2.083 1.00 . A A . 7 ASN HB2 1 1
16 3321 1 1 7 ASN HB3 H 11.364 1.484 0.506 1.00 . A A . 7 ASN HB3 1 1
16 3322 1 1 7 ASN HD21 H 12.800 2.953 1.388 1.00 . A A . 7 ASN HD21 1 1
16 3323 1 1 7 ASN HD22 H 12.315 4.485 2.008 1.00 . A A . 7 ASN HD22 1 1
16 3324 1 1 7 ASN N N 9.081 0.119 0.188 1.00 . A A . 7 ASN N 1 1
16 3325 1 1 7 ASN ND2 N 12.109 3.580 1.694 1.00 . A A . 7 ASN ND2 1 1
16 3326 1 1 7 ASN O O 9.677 2.209 -1.674 1.00 . A A . 7 ASN O 1 1
16 3327 1 1 7 ASN OD1 O 9.956 3.919 2.067 1.00 . A A . 7 ASN OD1 1 1
16 3328 1 1 8 PRO C C 6.012 3.010 0.672 1.00 . A A . 8 PRO C 1 1
16 3329 1 1 8 PRO CA C 7.346 3.779 0.605 1.00 . A A . 8 PRO CA 1 1
16 3330 1 1 8 PRO CB C 7.078 5.272 0.445 1.00 . A A . 8 PRO CB 1 1
16 3331 1 1 8 PRO CD C 7.859 4.366 -1.680 1.00 . A A . 8 PRO CD 1 1
16 3332 1 1 8 PRO CG C 7.264 5.583 -1.010 1.00 . A A . 8 PRO CG 1 1
16 3333 1 1 8 PRO HA H 7.932 3.623 1.497 1.00 . A A . 8 PRO HA 1 1
16 3334 1 1 8 PRO HB2 H 6.072 5.483 0.775 1.00 . A A . 8 PRO HB2 1 1
16 3335 1 1 8 PRO HB3 H 7.775 5.822 1.060 1.00 . A A . 8 PRO HB3 1 1
16 3336 1 1 8 PRO HD2 H 7.150 3.923 -2.362 1.00 . A A . 8 PRO HD2 1 1
16 3337 1 1 8 PRO HD3 H 8.764 4.628 -2.205 1.00 . A A . 8 PRO HD3 1 1
16 3338 1 1 8 PRO HG2 H 6.307 5.816 -1.453 1.00 . A A . 8 PRO HG2 1 1
16 3339 1 1 8 PRO HG3 H 7.928 6.429 -1.114 1.00 . A A . 8 PRO HG3 1 1
16 3340 1 1 8 PRO N N 8.144 3.452 -0.579 1.00 . A A . 8 PRO N 1 1
16 3341 1 1 8 PRO O O 5.247 2.977 -0.316 1.00 . A A . 8 PRO O 1 1
16 3342 1 1 9 PRO C C 3.261 2.514 2.162 1.00 . A A . 9 PRO C 1 1
16 3343 1 1 9 PRO CA C 4.484 1.624 1.993 1.00 . A A . 9 PRO CA 1 1
16 3344 1 1 9 PRO CB C 4.721 0.814 3.280 1.00 . A A . 9 PRO CB 1 1
16 3345 1 1 9 PRO CD C 6.468 2.450 3.075 1.00 . A A . 9 PRO CD 1 1
16 3346 1 1 9 PRO CG C 6.106 1.155 3.730 1.00 . A A . 9 PRO CG 1 1
16 3347 1 1 9 PRO HA H 4.328 0.953 1.162 1.00 . A A . 9 PRO HA 1 1
16 3348 1 1 9 PRO HB2 H 3.988 1.106 4.018 1.00 . A A . 9 PRO HB2 1 1
16 3349 1 1 9 PRO HB3 H 4.620 -0.240 3.069 1.00 . A A . 9 PRO HB3 1 1
16 3350 1 1 9 PRO HD2 H 6.166 3.286 3.687 1.00 . A A . 9 PRO HD2 1 1
16 3351 1 1 9 PRO HD3 H 7.530 2.473 2.891 1.00 . A A . 9 PRO HD3 1 1
16 3352 1 1 9 PRO HG2 H 6.118 1.271 4.804 1.00 . A A . 9 PRO HG2 1 1
16 3353 1 1 9 PRO HG3 H 6.789 0.375 3.428 1.00 . A A . 9 PRO HG3 1 1
16 3354 1 1 9 PRO N N 5.696 2.405 1.829 1.00 . A A . 9 PRO N 1 1
16 3355 1 1 9 PRO O O 3.082 3.166 3.202 1.00 . A A . 9 PRO O 1 1
16 3356 1 1 10 ILE C C 0.090 2.375 1.186 1.00 . A A . 10 ILE C 1 1
16 3357 1 1 10 ILE CA C 1.251 3.350 1.196 1.00 . A A . 10 ILE CA 1 1
16 3358 1 1 10 ILE CB C 1.158 4.366 0.012 1.00 . A A . 10 ILE CB 1 1
16 3359 1 1 10 ILE CD1 C -0.243 6.260 -0.992 1.00 . A A . 10 ILE CD1 1 1
16 3360 1 1 10 ILE CG1 C -0.135 5.196 0.084 1.00 . A A . 10 ILE CG1 1 1
16 3361 1 1 10 ILE CG2 C 1.290 3.665 -1.342 1.00 . A A . 10 ILE CG2 1 1
16 3362 1 1 10 ILE H H 2.692 2.108 0.322 1.00 . A A . 10 ILE H 1 1
16 3363 1 1 10 ILE HA H 1.241 3.885 2.133 1.00 . A A . 10 ILE HA 1 1
16 3364 1 1 10 ILE HB H 2.003 5.032 0.111 1.00 . A A . 10 ILE HB 1 1
16 3365 1 1 10 ILE HD11 H 0.583 6.950 -0.902 1.00 . A A . 10 ILE HD11 1 1
16 3366 1 1 10 ILE HD12 H -1.172 6.796 -0.875 1.00 . A A . 10 ILE HD12 1 1
16 3367 1 1 10 ILE HD13 H -0.216 5.791 -1.964 1.00 . A A . 10 ILE HD13 1 1
16 3368 1 1 10 ILE HG12 H -0.983 4.537 -0.021 1.00 . A A . 10 ILE HG12 1 1
16 3369 1 1 10 ILE HG13 H -0.186 5.685 1.046 1.00 . A A . 10 ILE HG13 1 1
16 3370 1 1 10 ILE HG21 H 2.253 3.181 -1.400 1.00 . A A . 10 ILE HG21 1 1
16 3371 1 1 10 ILE HG22 H 1.202 4.394 -2.134 1.00 . A A . 10 ILE HG22 1 1
16 3372 1 1 10 ILE HG23 H 0.510 2.924 -1.439 1.00 . A A . 10 ILE HG23 1 1
16 3373 1 1 10 ILE N N 2.467 2.589 1.145 1.00 . A A . 10 ILE N 1 1
16 3374 1 1 10 ILE O O 0.151 1.340 0.514 1.00 . A A . 10 ILE O 1 1
16 3375 1 1 11 ALA C C -3.285 2.434 1.674 1.00 . A A . 11 ALA C 1 1
16 3376 1 1 11 ALA CA C -2.028 1.744 2.033 1.00 . A A . 11 ALA CA 1 1
16 3377 1 1 11 ALA CB C -2.147 1.042 3.385 1.00 . A A . 11 ALA CB 1 1
16 3378 1 1 11 ALA H H -0.946 3.456 2.511 1.00 . A A . 11 ALA H 1 1
16 3379 1 1 11 ALA HA H -1.857 0.978 1.287 1.00 . A A . 11 ALA HA 1 1
16 3380 1 1 11 ALA HB1 H -3.005 0.387 3.365 1.00 . A A . 11 ALA HB1 1 1
16 3381 1 1 11 ALA HB2 H -2.282 1.741 4.193 1.00 . A A . 11 ALA HB2 1 1
16 3382 1 1 11 ALA N N -0.918 2.638 1.970 1.00 . A A . 11 ALA N 1 1
16 3383 1 1 11 ALA O O -3.476 3.619 1.979 1.00 . A A . 11 ALA O 1 1
16 3384 1 1 12 PHE C C -6.471 1.483 1.216 1.00 . A A . 12 PHE C 1 1
16 3385 1 1 12 PHE CA C -5.351 2.255 0.552 1.00 . A A . 12 PHE CA 1 1
16 3386 1 1 12 PHE CB C -5.455 2.169 -0.967 1.00 . A A . 12 PHE CB 1 1
16 3387 1 1 12 PHE CD1 C -3.165 2.353 -1.974 1.00 . A A . 12 PHE CD1 1 1
16 3388 1 1 12 PHE CD2 C -4.638 4.208 -2.150 1.00 . A A . 12 PHE CD2 1 1
16 3389 1 1 12 PHE CE1 C -2.199 3.043 -2.665 1.00 . A A . 12 PHE CE1 1 1
16 3390 1 1 12 PHE CE2 C -3.679 4.903 -2.837 1.00 . A A . 12 PHE CE2 1 1
16 3391 1 1 12 PHE CG C -4.397 2.928 -1.708 1.00 . A A . 12 PHE CG 1 1
16 3392 1 1 12 PHE CZ C -2.455 4.321 -3.097 1.00 . A A . 12 PHE CZ 1 1
16 3393 1 1 12 PHE H H -3.871 0.811 0.765 1.00 . A A . 12 PHE H 1 1
16 3394 1 1 12 PHE HA H -5.396 3.291 0.851 1.00 . A A . 12 PHE HA 1 1
16 3395 1 1 12 PHE HB2 H -5.392 1.133 -1.263 1.00 . A A . 12 PHE HB2 1 1
16 3396 1 1 12 PHE HB3 H -6.417 2.553 -1.271 1.00 . A A . 12 PHE HB3 1 1
16 3397 1 1 12 PHE HD1 H -2.964 1.349 -1.628 1.00 . A A . 12 PHE HD1 1 1
16 3398 1 1 12 PHE HD2 H -5.595 4.667 -1.949 1.00 . A A . 12 PHE HD2 1 1
16 3399 1 1 12 PHE HE1 H -1.242 2.582 -2.865 1.00 . A A . 12 PHE HE1 1 1
16 3400 1 1 12 PHE HE2 H -3.891 5.907 -3.169 1.00 . A A . 12 PHE HE2 1 1
16 3401 1 1 12 PHE HZ H -1.696 4.865 -3.640 1.00 . A A . 12 PHE HZ 1 1
16 3402 1 1 12 PHE N N -4.110 1.738 0.992 1.00 . A A . 12 PHE N 1 1
16 3403 1 1 12 PHE O O -6.356 0.264 1.398 1.00 . A A . 12 PHE O 1 1
16 3404 1 1 13 PRO C C -9.356 0.381 1.572 1.00 . A A . 13 PRO C 1 1
16 3405 1 1 13 PRO CA C -8.725 1.581 2.306 1.00 . A A . 13 PRO CA 1 1
16 3406 1 1 13 PRO CB C -9.732 2.748 2.365 1.00 . A A . 13 PRO CB 1 1
16 3407 1 1 13 PRO CD C -7.754 3.615 1.402 1.00 . A A . 13 PRO CD 1 1
16 3408 1 1 13 PRO CG C -9.235 3.730 1.365 1.00 . A A . 13 PRO CG 1 1
16 3409 1 1 13 PRO HA H -8.460 1.286 3.310 1.00 . A A . 13 PRO HA 1 1
16 3410 1 1 13 PRO HB2 H -10.719 2.388 2.112 1.00 . A A . 13 PRO HB2 1 1
16 3411 1 1 13 PRO HB3 H -9.740 3.172 3.359 1.00 . A A . 13 PRO HB3 1 1
16 3412 1 1 13 PRO HD2 H -7.323 3.950 0.472 1.00 . A A . 13 PRO HD2 1 1
16 3413 1 1 13 PRO HD3 H -7.350 4.172 2.236 1.00 . A A . 13 PRO HD3 1 1
16 3414 1 1 13 PRO HG2 H -9.603 3.477 0.381 1.00 . A A . 13 PRO HG2 1 1
16 3415 1 1 13 PRO HG3 H -9.536 4.730 1.634 1.00 . A A . 13 PRO HG3 1 1
16 3416 1 1 13 PRO N N -7.560 2.175 1.601 1.00 . A A . 13 PRO N 1 1
16 3417 1 1 13 PRO O O -10.051 -0.444 2.185 1.00 . A A . 13 PRO O 1 1
16 3418 1 1 14 ASN C C -8.835 -2.099 -0.327 1.00 . A A . 14 ASN C 1 1
16 3419 1 1 14 ASN CA C -9.623 -0.810 -0.539 1.00 . A A . 14 ASN CA 1 1
16 3420 1 1 14 ASN CB C -9.621 -0.427 -2.043 1.00 . A A . 14 ASN CB 1 1
16 3421 1 1 14 ASN CG C -8.227 -0.306 -2.647 1.00 . A A . 14 ASN CG 1 1
16 3422 1 1 14 ASN H H -8.472 0.916 -0.123 1.00 . A A . 14 ASN H 1 1
16 3423 1 1 14 ASN HA H -10.642 -0.972 -0.222 1.00 . A A . 14 ASN HA 1 1
16 3424 1 1 14 ASN HB2 H -10.165 -1.175 -2.598 1.00 . A A . 14 ASN HB2 1 1
16 3425 1 1 14 ASN HB3 H -10.125 0.522 -2.154 1.00 . A A . 14 ASN HB3 1 1
16 3426 1 1 14 ASN HD21 H -8.905 -0.754 -4.460 1.00 . A A . 14 ASN HD21 1 1
16 3427 1 1 14 ASN HD22 H -7.221 -0.425 -4.334 1.00 . A A . 14 ASN HD22 1 1
16 3428 1 1 14 ASN N N -9.081 0.266 0.284 1.00 . A A . 14 ASN N 1 1
16 3429 1 1 14 ASN ND2 N -8.111 -0.521 -3.933 1.00 . A A . 14 ASN ND2 1 1
16 3430 1 1 14 ASN O O -9.202 -3.139 -0.847 1.00 . A A . 14 ASN O 1 1
16 3431 1 1 14 ASN OD1 O -7.270 -0.006 -1.956 1.00 . A A . 14 ASN OD1 1 1
16 3432 2 2 1 . C C -1.847 -1.929 3.017 1.00 . B A . 101 WMH C 1 1
16 3433 2 2 1 . C1 C -0.949 0.207 3.715 1.00 . B A . 101 WMH C1 1 1
16 3434 2 2 1 . C2 C 0.249 0.649 4.167 1.00 . B A . 101 WMH C2 1 1
16 3435 2 2 1 . H1 H -2.453 -2.279 3.834 1.00 . B A . 101 WMH H1 1 1
16 3436 2 2 1 . H2 H -2.475 -1.312 2.395 1.00 . B A . 101 WMH H2 1 1
16 3437 2 2 1 . H5 H 0.488 1.668 4.430 1.00 . B A . 101 WMH H5 1 1
16 3438 2 2 1 . N N -0.849 -1.084 3.510 1.00 . B A . 101 WMH N 1 1
16 3439 2 2 1 . N1 N 1.072 -0.382 4.236 1.00 . B A . 101 WMH N1 1 1
16 3440 2 2 1 . N2 N 0.459 -1.449 3.853 1.00 . B A . 101 WMH N2 1 1
17 3441 1 1 1 GLY C C -5.781 -3.288 0.731 1.00 . A A . 1 GLY C 1 1
17 3442 1 1 1 GLY CA C -7.059 -3.130 1.516 1.00 . A A . 1 GLY CA 1 1
17 3443 1 1 1 GLY H1 H -7.394 -1.070 1.269 1.00 . A A . 1 GLY H1 1 1
17 3444 1 1 1 GLY HA2 H -6.819 -3.081 2.568 1.00 . A A . 1 GLY HA2 1 1
17 3445 1 1 1 GLY HA3 H -7.682 -3.994 1.338 1.00 . A A . 1 GLY HA3 1 1
17 3446 1 1 1 GLY N N -7.804 -1.955 1.148 1.00 . A A . 1 GLY N 1 1
17 3447 1 1 1 GLY O O -4.847 -3.971 1.193 1.00 . A A . 1 GLY O 1 1
17 3448 1 1 2 LYS C C -3.335 -2.161 -0.651 1.00 . A A . 2 LYS C 1 1
17 3449 1 1 2 LYS CA C -4.565 -2.764 -1.311 1.00 . A A . 2 LYS CA 1 1
17 3450 1 1 2 LYS CB C -4.836 -2.115 -2.679 1.00 . A A . 2 LYS CB 1 1
17 3451 1 1 2 LYS CD C -4.105 -1.761 -5.065 1.00 . A A . 2 LYS CD 1 1
17 3452 1 1 2 LYS CE C -3.113 -2.167 -6.152 1.00 . A A . 2 LYS CE 1 1
17 3453 1 1 2 LYS CG C -3.758 -2.381 -3.723 1.00 . A A . 2 LYS CG 1 1
17 3454 1 1 2 LYS H H -6.480 -2.098 -0.720 1.00 . A A . 2 LYS H 1 1
17 3455 1 1 2 LYS HA H -4.386 -3.820 -1.452 1.00 . A A . 2 LYS HA 1 1
17 3456 1 1 2 LYS HB2 H -5.771 -2.491 -3.061 1.00 . A A . 2 LYS HB2 1 1
17 3457 1 1 2 LYS HB3 H -4.923 -1.047 -2.547 1.00 . A A . 2 LYS HB3 1 1
17 3458 1 1 2 LYS HD2 H -5.092 -2.087 -5.360 1.00 . A A . 2 LYS HD2 1 1
17 3459 1 1 2 LYS HD3 H -4.095 -0.686 -4.966 1.00 . A A . 2 LYS HD3 1 1
17 3460 1 1 2 LYS HE2 H -3.098 -3.245 -6.214 1.00 . A A . 2 LYS HE2 1 1
17 3461 1 1 2 LYS HE3 H -3.446 -1.759 -7.095 1.00 . A A . 2 LYS HE3 1 1
17 3462 1 1 2 LYS HG2 H -2.831 -1.953 -3.375 1.00 . A A . 2 LYS HG2 1 1
17 3463 1 1 2 LYS HG3 H -3.642 -3.449 -3.846 1.00 . A A . 2 LYS HG3 1 1
17 3464 1 1 2 LYS HZ1 H -1.370 -2.064 -4.978 1.00 . A A . 2 LYS HZ1 1 1
17 3465 1 1 2 LYS HZ2 H -1.681 -0.663 -5.885 1.00 . A A . 2 LYS HZ2 1 1
17 3466 1 1 2 LYS HZ3 H -1.102 -2.033 -6.642 1.00 . A A . 2 LYS HZ3 1 1
17 3467 1 1 2 LYS N N -5.720 -2.652 -0.435 1.00 . A A . 2 LYS N 1 1
17 3468 1 1 2 LYS NZ N -1.731 -1.702 -5.881 1.00 . A A . 2 LYS NZ 1 1
17 3469 1 1 2 LYS O O -3.304 -0.977 -0.335 1.00 . A A . 2 LYS O 1 1
17 3470 1 1 3 ALA C C 0.055 -3.225 -0.412 1.00 . A A . 3 ALA C 1 1
17 3471 1 1 3 ALA CA C -1.130 -2.609 0.231 1.00 . A A . 3 ALA CA 1 1
17 3472 1 1 3 ALA CB C -1.176 -2.983 1.720 1.00 . A A . 3 ALA CB 1 1
17 3473 1 1 3 ALA H H -2.442 -3.913 -0.735 1.00 . A A . 3 ALA H 1 1
17 3474 1 1 3 ALA HA H -1.035 -1.536 0.166 1.00 . A A . 3 ALA HA 1 1
17 3475 1 1 3 ALA HB1 H -0.180 -3.240 2.045 1.00 . A A . 3 ALA HB1 1 1
17 3476 1 1 3 ALA HB2 H -1.819 -3.841 1.843 1.00 . A A . 3 ALA HB2 1 1
17 3477 1 1 3 ALA N N -2.355 -2.983 -0.430 1.00 . A A . 3 ALA N 1 1
17 3478 1 1 3 ALA O O 0.001 -4.363 -0.860 1.00 . A A . 3 ALA O 1 1
17 3479 1 1 4 LEU C C 3.357 -2.527 0.030 1.00 . A A . 4 LEU C 1 1
17 3480 1 1 4 LEU CA C 2.347 -2.956 -0.979 1.00 . A A . 4 LEU CA 1 1
17 3481 1 1 4 LEU CB C 2.733 -2.440 -2.365 1.00 . A A . 4 LEU CB 1 1
17 3482 1 1 4 LEU CD1 C 4.060 -4.455 -3.120 1.00 . A A . 4 LEU CD1 1 1
17 3483 1 1 4 LEU CD2 C 4.451 -2.228 -4.188 1.00 . A A . 4 LEU CD2 1 1
17 3484 1 1 4 LEU CG C 4.080 -2.947 -2.908 1.00 . A A . 4 LEU CG 1 1
17 3485 1 1 4 LEU H H 1.037 -1.486 -0.344 1.00 . A A . 4 LEU H 1 1
17 3486 1 1 4 LEU HA H 2.286 -4.033 -0.989 1.00 . A A . 4 LEU HA 1 1
17 3487 1 1 4 LEU HB2 H 1.958 -2.731 -3.058 1.00 . A A . 4 LEU HB2 1 1
17 3488 1 1 4 LEU HB3 H 2.773 -1.364 -2.320 1.00 . A A . 4 LEU HB3 1 1
17 3489 1 1 4 LEU HD11 H 3.274 -4.711 -3.816 1.00 . A A . 4 LEU HD11 1 1
17 3490 1 1 4 LEU HD12 H 3.889 -4.953 -2.178 1.00 . A A . 4 LEU HD12 1 1
17 3491 1 1 4 LEU HD13 H 5.011 -4.771 -3.523 1.00 . A A . 4 LEU HD13 1 1
17 3492 1 1 4 LEU HD21 H 5.387 -2.618 -4.562 1.00 . A A . 4 LEU HD21 1 1
17 3493 1 1 4 LEU HD22 H 4.558 -1.172 -3.990 1.00 . A A . 4 LEU HD22 1 1
17 3494 1 1 4 LEU HD23 H 3.678 -2.384 -4.925 1.00 . A A . 4 LEU HD23 1 1
17 3495 1 1 4 LEU HG H 4.842 -2.740 -2.171 1.00 . A A . 4 LEU HG 1 1
17 3496 1 1 4 LEU N N 1.092 -2.451 -0.542 1.00 . A A . 4 LEU N 1 1
17 3497 1 1 4 LEU O O 3.525 -1.320 0.273 1.00 . A A . 4 LEU O 1 1
17 3498 1 1 5 PHE C C 6.312 -2.899 1.065 1.00 . A A . 5 PHE C 1 1
17 3499 1 1 5 PHE CA C 4.959 -3.174 1.660 1.00 . A A . 5 PHE CA 1 1
17 3500 1 1 5 PHE CB C 4.997 -4.205 2.780 1.00 . A A . 5 PHE CB 1 1
17 3501 1 1 5 PHE CD1 C 2.673 -4.993 3.313 1.00 . A A . 5 PHE CD1 1 1
17 3502 1 1 5 PHE CD2 C 3.662 -3.357 4.725 1.00 . A A . 5 PHE CD2 1 1
17 3503 1 1 5 PHE CE1 C 1.530 -4.971 4.081 1.00 . A A . 5 PHE CE1 1 1
17 3504 1 1 5 PHE CE2 C 2.522 -3.332 5.498 1.00 . A A . 5 PHE CE2 1 1
17 3505 1 1 5 PHE CG C 3.752 -4.189 3.623 1.00 . A A . 5 PHE CG 1 1
17 3506 1 1 5 PHE CZ C 1.456 -4.140 5.175 1.00 . A A . 5 PHE CZ 1 1
17 3507 1 1 5 PHE H H 3.776 -4.407 0.420 1.00 . A A . 5 PHE H 1 1
17 3508 1 1 5 PHE HA H 4.629 -2.234 2.083 1.00 . A A . 5 PHE HA 1 1
17 3509 1 1 5 PHE HB2 H 5.102 -5.191 2.352 1.00 . A A . 5 PHE HB2 1 1
17 3510 1 1 5 PHE HB3 H 5.840 -4.000 3.421 1.00 . A A . 5 PHE HB3 1 1
17 3511 1 1 5 PHE HD1 H 2.733 -5.646 2.455 1.00 . A A . 5 PHE HD1 1 1
17 3512 1 1 5 PHE HD2 H 4.498 -2.721 4.981 1.00 . A A . 5 PHE HD2 1 1
17 3513 1 1 5 PHE HE1 H 0.694 -5.606 3.828 1.00 . A A . 5 PHE HE1 1 1
17 3514 1 1 5 PHE HE2 H 2.466 -2.677 6.356 1.00 . A A . 5 PHE HE2 1 1
17 3515 1 1 5 PHE HZ H 0.561 -4.120 5.780 1.00 . A A . 5 PHE HZ 1 1
17 3516 1 1 5 PHE N N 3.984 -3.477 0.656 1.00 . A A . 5 PHE N 1 1
17 3517 1 1 5 PHE O O 7.195 -3.764 0.994 1.00 . A A . 5 PHE O 1 1
17 3518 1 1 6 SER C C 8.101 -0.128 0.940 1.00 . A A . 6 SER C 1 1
17 3519 1 1 6 SER CA C 7.579 -1.200 -0.019 1.00 . A A . 6 SER CA 1 1
17 3520 1 1 6 SER CB C 7.189 -0.620 -1.374 1.00 . A A . 6 SER CB 1 1
17 3521 1 1 6 SER H H 5.612 -1.161 0.485 1.00 . A A . 6 SER H 1 1
17 3522 1 1 6 SER HA H 8.306 -1.983 -0.160 1.00 . A A . 6 SER HA 1 1
17 3523 1 1 6 SER HB2 H 7.972 0.029 -1.736 1.00 . A A . 6 SER HB2 1 1
17 3524 1 1 6 SER HB3 H 7.025 -1.422 -2.077 1.00 . A A . 6 SER HB3 1 1
17 3525 1 1 6 SER HG H 6.031 0.873 -1.865 1.00 . A A . 6 SER HG 1 1
17 3526 1 1 6 SER N N 6.406 -1.735 0.536 1.00 . A A . 6 SER N 1 1
17 3527 1 1 6 SER O O 7.753 -0.134 2.132 1.00 . A A . 6 SER O 1 1
17 3528 1 1 6 SER OG O 5.986 0.130 -1.251 1.00 . A A . 6 SER OG 1 1
17 3529 1 1 7 ASN C C 9.507 3.113 0.443 1.00 . A A . 7 ASN C 1 1
17 3530 1 1 7 ASN CA C 9.427 1.836 1.266 1.00 . A A . 7 ASN CA 1 1
17 3531 1 1 7 ASN CB C 10.786 1.475 1.941 1.00 . A A . 7 ASN CB 1 1
17 3532 1 1 7 ASN CG C 11.857 0.959 0.984 1.00 . A A . 7 ASN CG 1 1
17 3533 1 1 7 ASN H H 9.206 0.713 -0.480 1.00 . A A . 7 ASN H 1 1
17 3534 1 1 7 ASN HA H 8.685 1.981 2.037 1.00 . A A . 7 ASN HA 1 1
17 3535 1 1 7 ASN HB2 H 11.178 2.357 2.424 1.00 . A A . 7 ASN HB2 1 1
17 3536 1 1 7 ASN HB3 H 10.607 0.721 2.694 1.00 . A A . 7 ASN HB3 1 1
17 3537 1 1 7 ASN HD21 H 12.595 2.773 0.744 1.00 . A A . 7 ASN HD21 1 1
17 3538 1 1 7 ASN HD22 H 13.382 1.520 -0.145 1.00 . A A . 7 ASN HD22 1 1
17 3539 1 1 7 ASN N N 8.920 0.758 0.458 1.00 . A A . 7 ASN N 1 1
17 3540 1 1 7 ASN ND2 N 12.694 1.831 0.483 1.00 . A A . 7 ASN ND2 1 1
17 3541 1 1 7 ASN O O 10.311 3.207 -0.485 1.00 . A A . 7 ASN O 1 1
17 3542 1 1 7 ASN OD1 O 11.931 -0.252 0.710 1.00 . A A . 7 ASN OD1 1 1
17 3543 1 1 8 PRO C C 6.384 3.096 1.235 1.00 . A A . 8 PRO C 1 1
17 3544 1 1 8 PRO CA C 7.544 3.998 1.712 1.00 . A A . 8 PRO CA 1 1
17 3545 1 1 8 PRO CB C 7.059 5.449 1.835 1.00 . A A . 8 PRO CB 1 1
17 3546 1 1 8 PRO CD C 8.612 5.405 0.025 1.00 . A A . 8 PRO CD 1 1
17 3547 1 1 8 PRO CG C 7.342 6.049 0.504 1.00 . A A . 8 PRO CG 1 1
17 3548 1 1 8 PRO HA H 7.915 3.652 2.665 1.00 . A A . 8 PRO HA 1 1
17 3549 1 1 8 PRO HB2 H 6.003 5.461 2.062 1.00 . A A . 8 PRO HB2 1 1
17 3550 1 1 8 PRO HB3 H 7.608 5.951 2.618 1.00 . A A . 8 PRO HB3 1 1
17 3551 1 1 8 PRO HD2 H 8.595 5.283 -1.048 1.00 . A A . 8 PRO HD2 1 1
17 3552 1 1 8 PRO HD3 H 9.467 5.992 0.325 1.00 . A A . 8 PRO HD3 1 1
17 3553 1 1 8 PRO HG2 H 6.532 5.832 -0.174 1.00 . A A . 8 PRO HG2 1 1
17 3554 1 1 8 PRO HG3 H 7.477 7.115 0.601 1.00 . A A . 8 PRO HG3 1 1
17 3555 1 1 8 PRO N N 8.618 4.096 0.699 1.00 . A A . 8 PRO N 1 1
17 3556 1 1 8 PRO O O 6.064 3.070 0.040 1.00 . A A . 8 PRO O 1 1
17 3557 1 1 9 PRO C C 3.412 2.204 1.425 1.00 . A A . 9 PRO C 1 1
17 3558 1 1 9 PRO CA C 4.673 1.430 1.802 1.00 . A A . 9 PRO CA 1 1
17 3559 1 1 9 PRO CB C 4.459 0.614 3.079 1.00 . A A . 9 PRO CB 1 1
17 3560 1 1 9 PRO CD C 6.080 2.295 3.585 1.00 . A A . 9 PRO CD 1 1
17 3561 1 1 9 PRO CG C 4.966 1.481 4.174 1.00 . A A . 9 PRO CG 1 1
17 3562 1 1 9 PRO HA H 4.946 0.780 0.984 1.00 . A A . 9 PRO HA 1 1
17 3563 1 1 9 PRO HB2 H 3.408 0.394 3.199 1.00 . A A . 9 PRO HB2 1 1
17 3564 1 1 9 PRO HB3 H 5.019 -0.307 3.018 1.00 . A A . 9 PRO HB3 1 1
17 3565 1 1 9 PRO HD2 H 6.077 3.292 4.001 1.00 . A A . 9 PRO HD2 1 1
17 3566 1 1 9 PRO HD3 H 7.032 1.817 3.757 1.00 . A A . 9 PRO HD3 1 1
17 3567 1 1 9 PRO HG2 H 4.174 2.131 4.519 1.00 . A A . 9 PRO HG2 1 1
17 3568 1 1 9 PRO HG3 H 5.334 0.872 4.987 1.00 . A A . 9 PRO HG3 1 1
17 3569 1 1 9 PRO N N 5.767 2.334 2.147 1.00 . A A . 9 PRO N 1 1
17 3570 1 1 9 PRO O O 2.988 3.136 2.140 1.00 . A A . 9 PRO O 1 1
17 3571 1 1 10 ILE C C 0.428 1.678 -0.031 1.00 . A A . 10 ILE C 1 1
17 3572 1 1 10 ILE CA C 1.660 2.538 -0.171 1.00 . A A . 10 ILE CA 1 1
17 3573 1 1 10 ILE CB C 1.797 3.108 -1.626 1.00 . A A . 10 ILE CB 1 1
17 3574 1 1 10 ILE CD1 C 3.191 1.204 -2.750 1.00 . A A . 10 ILE CD1 1 1
17 3575 1 1 10 ILE CG1 C 1.912 2.021 -2.738 1.00 . A A . 10 ILE CG1 1 1
17 3576 1 1 10 ILE CG2 C 2.976 4.047 -1.691 1.00 . A A . 10 ILE CG2 1 1
17 3577 1 1 10 ILE H H 3.184 1.078 -0.179 1.00 . A A . 10 ILE H 1 1
17 3578 1 1 10 ILE HA H 1.532 3.370 0.505 1.00 . A A . 10 ILE HA 1 1
17 3579 1 1 10 ILE HB H 0.915 3.705 -1.803 1.00 . A A . 10 ILE HB 1 1
17 3580 1 1 10 ILE HD11 H 3.287 0.656 -1.825 1.00 . A A . 10 ILE HD11 1 1
17 3581 1 1 10 ILE HD12 H 4.036 1.868 -2.859 1.00 . A A . 10 ILE HD12 1 1
17 3582 1 1 10 ILE HD13 H 3.166 0.515 -3.579 1.00 . A A . 10 ILE HD13 1 1
17 3583 1 1 10 ILE HG12 H 1.097 1.325 -2.619 1.00 . A A . 10 ILE HG12 1 1
17 3584 1 1 10 ILE HG13 H 1.813 2.503 -3.700 1.00 . A A . 10 ILE HG13 1 1
17 3585 1 1 10 ILE HG21 H 3.062 4.439 -2.693 1.00 . A A . 10 ILE HG21 1 1
17 3586 1 1 10 ILE HG22 H 3.858 3.475 -1.439 1.00 . A A . 10 ILE HG22 1 1
17 3587 1 1 10 ILE HG23 H 2.842 4.849 -0.981 1.00 . A A . 10 ILE HG23 1 1
17 3588 1 1 10 ILE N N 2.828 1.847 0.311 1.00 . A A . 10 ILE N 1 1
17 3589 1 1 10 ILE O O 0.380 0.524 -0.519 1.00 . A A . 10 ILE O 1 1
17 3590 1 1 11 ALA C C -2.943 2.262 0.510 1.00 . A A . 11 ALA C 1 1
17 3591 1 1 11 ALA CA C -1.746 1.480 0.926 1.00 . A A . 11 ALA CA 1 1
17 3592 1 1 11 ALA CB C -1.882 1.085 2.409 1.00 . A A . 11 ALA CB 1 1
17 3593 1 1 11 ALA H H -0.467 3.113 1.022 1.00 . A A . 11 ALA H 1 1
17 3594 1 1 11 ALA HA H -1.714 0.564 0.352 1.00 . A A . 11 ALA HA 1 1
17 3595 1 1 11 ALA HB1 H -2.767 0.477 2.516 1.00 . A A . 11 ALA HB1 1 1
17 3596 1 1 11 ALA HB2 H -2.006 1.928 3.062 1.00 . A A . 11 ALA HB2 1 1
17 3597 1 1 11 ALA N N -0.546 2.201 0.667 1.00 . A A . 11 ALA N 1 1
17 3598 1 1 11 ALA O O -2.870 3.479 0.293 1.00 . A A . 11 ALA O 1 1
17 3599 1 1 12 PHE C C -6.249 1.542 1.062 1.00 . A A . 12 PHE C 1 1
17 3600 1 1 12 PHE CA C -5.284 2.091 0.028 1.00 . A A . 12 PHE CA 1 1
17 3601 1 1 12 PHE CB C -5.706 1.660 -1.388 1.00 . A A . 12 PHE CB 1 1
17 3602 1 1 12 PHE CD1 C -3.663 1.415 -2.851 1.00 . A A . 12 PHE CD1 1 1
17 3603 1 1 12 PHE CD2 C -5.057 3.317 -3.161 1.00 . A A . 12 PHE CD2 1 1
17 3604 1 1 12 PHE CE1 C -2.829 1.856 -3.854 1.00 . A A . 12 PHE CE1 1 1
17 3605 1 1 12 PHE CE2 C -4.226 3.761 -4.166 1.00 . A A . 12 PHE CE2 1 1
17 3606 1 1 12 PHE CG C -4.789 2.141 -2.489 1.00 . A A . 12 PHE CG 1 1
17 3607 1 1 12 PHE CZ C -3.110 3.031 -4.513 1.00 . A A . 12 PHE CZ 1 1
17 3608 1 1 12 PHE H H -3.935 0.585 0.442 1.00 . A A . 12 PHE H 1 1
17 3609 1 1 12 PHE HA H -5.242 3.169 0.093 1.00 . A A . 12 PHE HA 1 1
17 3610 1 1 12 PHE HB2 H -5.733 0.581 -1.430 1.00 . A A . 12 PHE HB2 1 1
17 3611 1 1 12 PHE HB3 H -6.697 2.040 -1.589 1.00 . A A . 12 PHE HB3 1 1
17 3612 1 1 12 PHE HD1 H -3.440 0.493 -2.331 1.00 . A A . 12 PHE HD1 1 1
17 3613 1 1 12 PHE HD2 H -5.931 3.892 -2.892 1.00 . A A . 12 PHE HD2 1 1
17 3614 1 1 12 PHE HE1 H -1.955 1.282 -4.127 1.00 . A A . 12 PHE HE1 1 1
17 3615 1 1 12 PHE HE2 H -4.451 4.685 -4.682 1.00 . A A . 12 PHE HE2 1 1
17 3616 1 1 12 PHE HZ H -2.459 3.378 -5.302 1.00 . A A . 12 PHE HZ 1 1
17 3617 1 1 12 PHE N N -4.006 1.563 0.351 1.00 . A A . 12 PHE N 1 1
17 3618 1 1 12 PHE O O -6.103 0.377 1.483 1.00 . A A . 12 PHE O 1 1
17 3619 1 1 13 PRO C C -9.087 0.767 2.143 1.00 . A A . 13 PRO C 1 1
17 3620 1 1 13 PRO CA C -8.179 1.934 2.570 1.00 . A A . 13 PRO CA 1 1
17 3621 1 1 13 PRO CB C -9.006 3.197 2.821 1.00 . A A . 13 PRO CB 1 1
17 3622 1 1 13 PRO CD C -7.467 3.725 1.077 1.00 . A A . 13 PRO CD 1 1
17 3623 1 1 13 PRO CG C -8.846 4.007 1.587 1.00 . A A . 13 PRO CG 1 1
17 3624 1 1 13 PRO HA H -7.660 1.653 3.474 1.00 . A A . 13 PRO HA 1 1
17 3625 1 1 13 PRO HB2 H -10.038 2.921 2.985 1.00 . A A . 13 PRO HB2 1 1
17 3626 1 1 13 PRO HB3 H -8.625 3.717 3.687 1.00 . A A . 13 PRO HB3 1 1
17 3627 1 1 13 PRO HD2 H -7.437 3.794 -0.001 1.00 . A A . 13 PRO HD2 1 1
17 3628 1 1 13 PRO HD3 H -6.752 4.401 1.522 1.00 . A A . 13 PRO HD3 1 1
17 3629 1 1 13 PRO HG2 H -9.580 3.697 0.858 1.00 . A A . 13 PRO HG2 1 1
17 3630 1 1 13 PRO HG3 H -8.959 5.058 1.810 1.00 . A A . 13 PRO HG3 1 1
17 3631 1 1 13 PRO N N -7.220 2.344 1.523 1.00 . A A . 13 PRO N 1 1
17 3632 1 1 13 PRO O O -9.838 0.220 2.953 1.00 . A A . 13 PRO O 1 1
17 3633 1 1 14 ASN C C -9.019 -2.059 0.635 1.00 . A A . 14 ASN C 1 1
17 3634 1 1 14 ASN CA C -9.748 -0.748 0.350 1.00 . A A . 14 ASN CA 1 1
17 3635 1 1 14 ASN CB C -10.021 -0.602 -1.161 1.00 . A A . 14 ASN CB 1 1
17 3636 1 1 14 ASN CG C -8.765 -0.411 -2.012 1.00 . A A . 14 ASN CG 1 1
17 3637 1 1 14 ASN H H -8.425 0.915 0.285 1.00 . A A . 14 ASN H 1 1
17 3638 1 1 14 ASN HA H -10.693 -0.775 0.872 1.00 . A A . 14 ASN HA 1 1
17 3639 1 1 14 ASN HB2 H -10.523 -1.490 -1.512 1.00 . A A . 14 ASN HB2 1 1
17 3640 1 1 14 ASN HB3 H -10.669 0.247 -1.312 1.00 . A A . 14 ASN HB3 1 1
17 3641 1 1 14 ASN HD21 H -9.796 0.641 -3.328 1.00 . A A . 14 ASN HD21 1 1
17 3642 1 1 14 ASN HD22 H -8.113 0.445 -3.663 1.00 . A A . 14 ASN HD22 1 1
17 3643 1 1 14 ASN N N -9.005 0.394 0.880 1.00 . A A . 14 ASN N 1 1
17 3644 1 1 14 ASN ND2 N -8.907 0.288 -3.106 1.00 . A A . 14 ASN ND2 1 1
17 3645 1 1 14 ASN O O -9.543 -3.142 0.365 1.00 . A A . 14 ASN O 1 1
17 3646 1 1 14 ASN OD1 O -7.683 -0.881 -1.684 1.00 . A A . 14 ASN OD1 1 1
17 3647 2 2 1 . C C -1.691 -1.874 2.596 1.00 . B A . 101 WMH C 1 1
17 3648 2 2 1 . C1 C -0.736 0.300 2.940 1.00 . B A . 101 WMH C1 1 1
17 3649 2 2 1 . C2 C 0.455 0.784 3.377 1.00 . B A . 101 WMH C2 1 1
17 3650 2 2 1 . H1 H -2.277 -2.147 3.454 1.00 . B A . 101 WMH H1 1 1
17 3651 2 2 1 . H2 H -2.345 -1.304 1.957 1.00 . B A . 101 WMH H2 1 1
17 3652 2 2 1 . H5 H 0.728 1.826 3.459 1.00 . B A . 101 WMH H5 1 1
17 3653 2 2 1 . N N -0.682 -1.000 2.983 1.00 . B A . 101 WMH N 1 1
17 3654 2 2 1 . N1 N 1.224 -0.251 3.684 1.00 . B A . 101 WMH N1 1 1
17 3655 2 2 1 . N2 N 0.587 -1.340 3.466 1.00 . B A . 101 WMH N2 1 1
18 3656 1 1 1 GLY C C -5.319 -3.123 0.037 1.00 . A A . 1 GLY C 1 1
18 3657 1 1 1 GLY CA C -6.631 -3.150 0.773 1.00 . A A . 1 GLY CA 1 1
18 3658 1 1 1 GLY H1 H -7.299 -1.167 0.692 1.00 . A A . 1 GLY H1 1 1
18 3659 1 1 1 GLY HA2 H -6.434 -3.075 1.832 1.00 . A A . 1 GLY HA2 1 1
18 3660 1 1 1 GLY HA3 H -7.124 -4.090 0.574 1.00 . A A . 1 GLY HA3 1 1
18 3661 1 1 1 GLY N N -7.500 -2.081 0.388 1.00 . A A . 1 GLY N 1 1
18 3662 1 1 1 GLY O O -4.494 -4.032 0.203 1.00 . A A . 1 GLY O 1 1
18 3663 1 1 2 LYS C C -2.795 -1.511 -0.584 1.00 . A A . 2 LYS C 1 1
18 3664 1 1 2 LYS CA C -3.882 -1.995 -1.534 1.00 . A A . 2 LYS CA 1 1
18 3665 1 1 2 LYS CB C -4.043 -1.034 -2.726 1.00 . A A . 2 LYS CB 1 1
18 3666 1 1 2 LYS CD C -2.560 -2.281 -4.338 1.00 . A A . 2 LYS CD 1 1
18 3667 1 1 2 LYS CE C -1.319 -2.231 -5.220 1.00 . A A . 2 LYS CE 1 1
18 3668 1 1 2 LYS CG C -2.829 -0.948 -3.655 1.00 . A A . 2 LYS CG 1 1
18 3669 1 1 2 LYS H H -5.815 -1.433 -0.908 1.00 . A A . 2 LYS H 1 1
18 3670 1 1 2 LYS HA H -3.618 -2.980 -1.892 1.00 . A A . 2 LYS HA 1 1
18 3671 1 1 2 LYS HB2 H -4.889 -1.357 -3.316 1.00 . A A . 2 LYS HB2 1 1
18 3672 1 1 2 LYS HB3 H -4.249 -0.047 -2.344 1.00 . A A . 2 LYS HB3 1 1
18 3673 1 1 2 LYS HD2 H -2.419 -3.037 -3.581 1.00 . A A . 2 LYS HD2 1 1
18 3674 1 1 2 LYS HD3 H -3.415 -2.540 -4.945 1.00 . A A . 2 LYS HD3 1 1
18 3675 1 1 2 LYS HE2 H -1.484 -1.522 -6.016 1.00 . A A . 2 LYS HE2 1 1
18 3676 1 1 2 LYS HE3 H -0.477 -1.914 -4.621 1.00 . A A . 2 LYS HE3 1 1
18 3677 1 1 2 LYS HG2 H -3.012 -0.196 -4.408 1.00 . A A . 2 LYS HG2 1 1
18 3678 1 1 2 LYS HG3 H -1.964 -0.667 -3.071 1.00 . A A . 2 LYS HG3 1 1
18 3679 1 1 2 LYS HZ1 H -1.765 -3.875 -6.460 1.00 . A A . 2 LYS HZ1 1 1
18 3680 1 1 2 LYS HZ2 H -0.959 -4.270 -5.060 1.00 . A A . 2 LYS HZ2 1 1
18 3681 1 1 2 LYS HZ3 H -0.111 -3.574 -6.317 1.00 . A A . 2 LYS HZ3 1 1
18 3682 1 1 2 LYS N N -5.118 -2.118 -0.795 1.00 . A A . 2 LYS N 1 1
18 3683 1 1 2 LYS NZ N -1.020 -3.554 -5.811 1.00 . A A . 2 LYS NZ 1 1
18 3684 1 1 2 LYS O O -2.864 -0.404 -0.071 1.00 . A A . 2 LYS O 1 1
18 3685 1 1 3 ALA C C 0.550 -2.524 0.061 1.00 . A A . 3 ALA C 1 1
18 3686 1 1 3 ALA CA C -0.763 -2.096 0.598 1.00 . A A . 3 ALA CA 1 1
18 3687 1 1 3 ALA CB C -1.031 -2.771 1.944 1.00 . A A . 3 ALA CB 1 1
18 3688 1 1 3 ALA H H -1.818 -3.227 -0.787 1.00 . A A . 3 ALA H 1 1
18 3689 1 1 3 ALA HA H -0.732 -1.030 0.768 1.00 . A A . 3 ALA HA 1 1
18 3690 1 1 3 ALA HB1 H -0.087 -3.065 2.378 1.00 . A A . 3 ALA HB1 1 1
18 3691 1 1 3 ALA HB2 H -1.632 -3.652 1.777 1.00 . A A . 3 ALA HB2 1 1
18 3692 1 1 3 ALA N N -1.838 -2.360 -0.329 1.00 . A A . 3 ALA N 1 1
18 3693 1 1 3 ALA O O 0.688 -3.623 -0.473 1.00 . A A . 3 ALA O 1 1
18 3694 1 1 4 LEU C C 3.669 -2.265 0.983 1.00 . A A . 4 LEU C 1 1
18 3695 1 1 4 LEU CA C 2.835 -1.976 -0.232 1.00 . A A . 4 LEU CA 1 1
18 3696 1 1 4 LEU CB C 3.460 -0.808 -1.011 1.00 . A A . 4 LEU CB 1 1
18 3697 1 1 4 LEU CD1 C 3.502 0.763 -2.962 1.00 . A A . 4 LEU CD1 1 1
18 3698 1 1 4 LEU CD2 C 2.545 -1.527 -3.239 1.00 . A A . 4 LEU CD2 1 1
18 3699 1 1 4 LEU CG C 2.737 -0.361 -2.283 1.00 . A A . 4 LEU CG 1 1
18 3700 1 1 4 LEU H H 1.319 -0.791 0.584 1.00 . A A . 4 LEU H 1 1
18 3701 1 1 4 LEU HA H 2.809 -2.850 -0.867 1.00 . A A . 4 LEU HA 1 1
18 3702 1 1 4 LEU HB2 H 3.514 0.041 -0.346 1.00 . A A . 4 LEU HB2 1 1
18 3703 1 1 4 LEU HB3 H 4.467 -1.088 -1.280 1.00 . A A . 4 LEU HB3 1 1
18 3704 1 1 4 LEU HD11 H 4.485 0.414 -3.239 1.00 . A A . 4 LEU HD11 1 1
18 3705 1 1 4 LEU HD12 H 3.598 1.595 -2.281 1.00 . A A . 4 LEU HD12 1 1
18 3706 1 1 4 LEU HD13 H 2.969 1.081 -3.846 1.00 . A A . 4 LEU HD13 1 1
18 3707 1 1 4 LEU HD21 H 2.061 -1.179 -4.139 1.00 . A A . 4 LEU HD21 1 1
18 3708 1 1 4 LEU HD22 H 1.926 -2.277 -2.769 1.00 . A A . 4 LEU HD22 1 1
18 3709 1 1 4 LEU HD23 H 3.506 -1.954 -3.484 1.00 . A A . 4 LEU HD23 1 1
18 3710 1 1 4 LEU HG H 1.765 0.020 -2.010 1.00 . A A . 4 LEU HG 1 1
18 3711 1 1 4 LEU N N 1.506 -1.671 0.186 1.00 . A A . 4 LEU N 1 1
18 3712 1 1 4 LEU O O 3.602 -1.534 1.967 1.00 . A A . 4 LEU O 1 1
18 3713 1 1 5 PHE C C 6.656 -3.022 1.576 1.00 . A A . 5 PHE C 1 1
18 3714 1 1 5 PHE CA C 5.339 -3.652 2.004 1.00 . A A . 5 PHE CA 1 1
18 3715 1 1 5 PHE CB C 5.487 -5.175 2.177 1.00 . A A . 5 PHE CB 1 1
18 3716 1 1 5 PHE CD1 C 7.666 -5.828 3.277 1.00 . A A . 5 PHE CD1 1 1
18 3717 1 1 5 PHE CD2 C 5.693 -5.759 4.613 1.00 . A A . 5 PHE CD2 1 1
18 3718 1 1 5 PHE CE1 C 8.400 -6.212 4.378 1.00 . A A . 5 PHE CE1 1 1
18 3719 1 1 5 PHE CE2 C 6.425 -6.145 5.717 1.00 . A A . 5 PHE CE2 1 1
18 3720 1 1 5 PHE CG C 6.301 -5.595 3.379 1.00 . A A . 5 PHE CG 1 1
18 3721 1 1 5 PHE CZ C 7.779 -6.370 5.600 1.00 . A A . 5 PHE CZ 1 1
18 3722 1 1 5 PHE H H 4.292 -3.978 0.199 1.00 . A A . 5 PHE H 1 1
18 3723 1 1 5 PHE HA H 4.994 -3.193 2.919 1.00 . A A . 5 PHE HA 1 1
18 3724 1 1 5 PHE HB2 H 4.506 -5.617 2.275 1.00 . A A . 5 PHE HB2 1 1
18 3725 1 1 5 PHE HB3 H 5.963 -5.575 1.293 1.00 . A A . 5 PHE HB3 1 1
18 3726 1 1 5 PHE HD1 H 8.154 -5.704 2.322 1.00 . A A . 5 PHE HD1 1 1
18 3727 1 1 5 PHE HD2 H 4.631 -5.584 4.706 1.00 . A A . 5 PHE HD2 1 1
18 3728 1 1 5 PHE HE1 H 9.462 -6.392 4.282 1.00 . A A . 5 PHE HE1 1 1
18 3729 1 1 5 PHE HE2 H 5.935 -6.270 6.672 1.00 . A A . 5 PHE HE2 1 1
18 3730 1 1 5 PHE HZ H 8.352 -6.674 6.464 1.00 . A A . 5 PHE HZ 1 1
18 3731 1 1 5 PHE N N 4.394 -3.353 0.950 1.00 . A A . 5 PHE N 1 1
18 3732 1 1 5 PHE O O 7.545 -2.715 2.386 1.00 . A A . 5 PHE O 1 1
18 3733 1 1 6 SER C C 7.769 -0.696 -0.109 1.00 . A A . 6 SER C 1 1
18 3734 1 1 6 SER CA C 7.853 -2.192 -0.350 1.00 . A A . 6 SER CA 1 1
18 3735 1 1 6 SER CB C 7.776 -2.481 -1.837 1.00 . A A . 6 SER CB 1 1
18 3736 1 1 6 SER H H 5.998 -3.117 -0.280 1.00 . A A . 6 SER H 1 1
18 3737 1 1 6 SER HA H 8.769 -2.600 0.045 1.00 . A A . 6 SER HA 1 1
18 3738 1 1 6 SER HB2 H 6.902 -1.993 -2.245 1.00 . A A . 6 SER HB2 1 1
18 3739 1 1 6 SER HB3 H 8.662 -2.116 -2.331 1.00 . A A . 6 SER HB3 1 1
18 3740 1 1 6 SER HG H 8.351 -4.289 -1.509 1.00 . A A . 6 SER HG 1 1
18 3741 1 1 6 SER N N 6.747 -2.824 0.280 1.00 . A A . 6 SER N 1 1
18 3742 1 1 6 SER O O 6.681 -0.168 0.095 1.00 . A A . 6 SER O 1 1
18 3743 1 1 6 SER OG O 7.665 -3.882 -2.058 1.00 . A A . 6 SER OG 1 1
18 3744 1 1 7 ASN C C 8.404 2.141 -1.155 1.00 . A A . 7 ASN C 1 1
18 3745 1 1 7 ASN CA C 8.907 1.406 0.094 1.00 . A A . 7 ASN CA 1 1
18 3746 1 1 7 ASN CB C 10.311 1.932 0.489 1.00 . A A . 7 ASN CB 1 1
18 3747 1 1 7 ASN CG C 11.375 1.792 -0.604 1.00 . A A . 7 ASN CG 1 1
18 3748 1 1 7 ASN H H 9.737 -0.501 -0.284 1.00 . A A . 7 ASN H 1 1
18 3749 1 1 7 ASN HA H 8.222 1.590 0.907 1.00 . A A . 7 ASN HA 1 1
18 3750 1 1 7 ASN HB2 H 10.232 2.979 0.737 1.00 . A A . 7 ASN HB2 1 1
18 3751 1 1 7 ASN HB3 H 10.647 1.394 1.364 1.00 . A A . 7 ASN HB3 1 1
18 3752 1 1 7 ASN HD21 H 12.227 3.469 -0.008 1.00 . A A . 7 ASN HD21 1 1
18 3753 1 1 7 ASN HD22 H 12.980 2.690 -1.344 1.00 . A A . 7 ASN HD22 1 1
18 3754 1 1 7 ASN N N 8.894 -0.026 -0.119 1.00 . A A . 7 ASN N 1 1
18 3755 1 1 7 ASN ND2 N 12.276 2.734 -0.660 1.00 . A A . 7 ASN ND2 1 1
18 3756 1 1 7 ASN O O 8.760 1.774 -2.282 1.00 . A A . 7 ASN O 1 1
18 3757 1 1 7 ASN OD1 O 11.372 0.847 -1.403 1.00 . A A . 7 ASN OD1 1 1
18 3758 1 1 8 PRO C C 5.755 2.727 0.675 1.00 . A A . 8 PRO C 1 1
18 3759 1 1 8 PRO CA C 7.003 3.550 0.298 1.00 . A A . 8 PRO CA 1 1
18 3760 1 1 8 PRO CB C 6.621 5.011 0.065 1.00 . A A . 8 PRO CB 1 1
18 3761 1 1 8 PRO CD C 7.005 3.980 -2.086 1.00 . A A . 8 PRO CD 1 1
18 3762 1 1 8 PRO CG C 6.262 5.093 -1.383 1.00 . A A . 8 PRO CG 1 1
18 3763 1 1 8 PRO HA H 7.759 3.490 1.067 1.00 . A A . 8 PRO HA 1 1
18 3764 1 1 8 PRO HB2 H 5.786 5.264 0.703 1.00 . A A . 8 PRO HB2 1 1
18 3765 1 1 8 PRO HB3 H 7.463 5.646 0.302 1.00 . A A . 8 PRO HB3 1 1
18 3766 1 1 8 PRO HD2 H 6.329 3.407 -2.702 1.00 . A A . 8 PRO HD2 1 1
18 3767 1 1 8 PRO HD3 H 7.809 4.384 -2.687 1.00 . A A . 8 PRO HD3 1 1
18 3768 1 1 8 PRO HG2 H 5.198 4.966 -1.504 1.00 . A A . 8 PRO HG2 1 1
18 3769 1 1 8 PRO HG3 H 6.568 6.051 -1.776 1.00 . A A . 8 PRO HG3 1 1
18 3770 1 1 8 PRO N N 7.536 3.145 -0.996 1.00 . A A . 8 PRO N 1 1
18 3771 1 1 8 PRO O O 4.880 2.488 -0.177 1.00 . A A . 8 PRO O 1 1
18 3772 1 1 9 PRO C C 3.271 2.347 2.517 1.00 . A A . 9 PRO C 1 1
18 3773 1 1 9 PRO CA C 4.515 1.482 2.381 1.00 . A A . 9 PRO CA 1 1
18 3774 1 1 9 PRO CB C 4.940 0.918 3.749 1.00 . A A . 9 PRO CB 1 1
18 3775 1 1 9 PRO CD C 6.611 2.461 3.023 1.00 . A A . 9 PRO CD 1 1
18 3776 1 1 9 PRO CG C 6.386 1.251 3.878 1.00 . A A . 9 PRO CG 1 1
18 3777 1 1 9 PRO HA H 4.311 0.673 1.694 1.00 . A A . 9 PRO HA 1 1
18 3778 1 1 9 PRO HB2 H 4.357 1.394 4.522 1.00 . A A . 9 PRO HB2 1 1
18 3779 1 1 9 PRO HB3 H 4.776 -0.149 3.770 1.00 . A A . 9 PRO HB3 1 1
18 3780 1 1 9 PRO HD2 H 6.394 3.362 3.579 1.00 . A A . 9 PRO HD2 1 1
18 3781 1 1 9 PRO HD3 H 7.629 2.465 2.665 1.00 . A A . 9 PRO HD3 1 1
18 3782 1 1 9 PRO HG2 H 6.613 1.477 4.910 1.00 . A A . 9 PRO HG2 1 1
18 3783 1 1 9 PRO HG3 H 6.989 0.426 3.533 1.00 . A A . 9 PRO HG3 1 1
18 3784 1 1 9 PRO N N 5.651 2.265 1.936 1.00 . A A . 9 PRO N 1 1
18 3785 1 1 9 PRO O O 3.025 2.974 3.560 1.00 . A A . 9 PRO O 1 1
18 3786 1 1 10 ILE C C 0.174 2.271 1.332 1.00 . A A . 10 ILE C 1 1
18 3787 1 1 10 ILE CA C 1.353 3.226 1.414 1.00 . A A . 10 ILE CA 1 1
18 3788 1 1 10 ILE CB C 1.357 4.264 0.240 1.00 . A A . 10 ILE CB 1 1
18 3789 1 1 10 ILE CD1 C 0.088 6.251 -0.749 1.00 . A A . 10 ILE CD1 1 1
18 3790 1 1 10 ILE CG1 C 0.085 5.122 0.255 1.00 . A A . 10 ILE CG1 1 1
18 3791 1 1 10 ILE CG2 C 1.544 3.577 -1.117 1.00 . A A . 10 ILE CG2 1 1
18 3792 1 1 10 ILE H H 2.874 2.028 0.623 1.00 . A A . 10 ILE H 1 1
18 3793 1 1 10 ILE HA H 1.292 3.757 2.354 1.00 . A A . 10 ILE HA 1 1
18 3794 1 1 10 ILE HB H 2.211 4.908 0.388 1.00 . A A . 10 ILE HB 1 1
18 3795 1 1 10 ILE HD11 H -0.842 6.799 -0.676 1.00 . A A . 10 ILE HD11 1 1
18 3796 1 1 10 ILE HD12 H 0.190 5.844 -1.744 1.00 . A A . 10 ILE HD12 1 1
18 3797 1 1 10 ILE HD13 H 0.914 6.913 -0.542 1.00 . A A . 10 ILE HD13 1 1
18 3798 1 1 10 ILE HG12 H -0.768 4.495 0.043 1.00 . A A . 10 ILE HG12 1 1
18 3799 1 1 10 ILE HG13 H -0.029 5.551 1.239 1.00 . A A . 10 ILE HG13 1 1
18 3800 1 1 10 ILE HG21 H 0.741 2.873 -1.276 1.00 . A A . 10 ILE HG21 1 1
18 3801 1 1 10 ILE HG22 H 2.488 3.055 -1.126 1.00 . A A . 10 ILE HG22 1 1
18 3802 1 1 10 ILE HG23 H 1.534 4.320 -1.901 1.00 . A A . 10 ILE HG23 1 1
18 3803 1 1 10 ILE N N 2.558 2.465 1.442 1.00 . A A . 10 ILE N 1 1
18 3804 1 1 10 ILE O O 0.259 1.215 0.674 1.00 . A A . 10 ILE O 1 1
18 3805 1 1 11 ALA C C -3.278 2.512 1.715 1.00 . A A . 11 ALA C 1 1
18 3806 1 1 11 ALA CA C -2.044 1.745 2.067 1.00 . A A . 11 ALA CA 1 1
18 3807 1 1 11 ALA CB C -2.243 1.018 3.408 1.00 . A A . 11 ALA CB 1 1
18 3808 1 1 11 ALA H H -0.887 3.410 2.576 1.00 . A A . 11 ALA H 1 1
18 3809 1 1 11 ALA HA H -1.894 0.995 1.303 1.00 . A A . 11 ALA HA 1 1
18 3810 1 1 11 ALA HB1 H -3.065 0.329 3.293 1.00 . A A . 11 ALA HB1 1 1
18 3811 1 1 11 ALA HB2 H -2.497 1.679 4.216 1.00 . A A . 11 ALA HB2 1 1
18 3812 1 1 11 ALA N N -0.884 2.585 2.049 1.00 . A A . 11 ALA N 1 1
18 3813 1 1 11 ALA O O -3.432 3.700 2.068 1.00 . A A . 11 ALA O 1 1
18 3814 1 1 12 PHE C C -6.493 1.514 1.141 1.00 . A A . 12 PHE C 1 1
18 3815 1 1 12 PHE CA C -5.382 2.391 0.573 1.00 . A A . 12 PHE CA 1 1
18 3816 1 1 12 PHE CB C -5.442 2.423 -0.960 1.00 . A A . 12 PHE CB 1 1
18 3817 1 1 12 PHE CD1 C -4.556 4.607 -1.832 1.00 . A A . 12 PHE CD1 1 1
18 3818 1 1 12 PHE CD2 C -3.160 2.684 -1.997 1.00 . A A . 12 PHE CD2 1 1
18 3819 1 1 12 PHE CE1 C -3.576 5.373 -2.425 1.00 . A A . 12 PHE CE1 1 1
18 3820 1 1 12 PHE CE2 C -2.177 3.444 -2.591 1.00 . A A . 12 PHE CE2 1 1
18 3821 1 1 12 PHE CG C -4.364 3.256 -1.608 1.00 . A A . 12 PHE CG 1 1
18 3822 1 1 12 PHE CZ C -2.386 4.791 -2.805 1.00 . A A . 12 PHE CZ 1 1
18 3823 1 1 12 PHE H H -3.911 0.922 0.777 1.00 . A A . 12 PHE H 1 1
18 3824 1 1 12 PHE HA H -5.463 3.394 0.963 1.00 . A A . 12 PHE HA 1 1
18 3825 1 1 12 PHE HB2 H -5.357 1.416 -1.338 1.00 . A A . 12 PHE HB2 1 1
18 3826 1 1 12 PHE HB3 H -6.397 2.826 -1.259 1.00 . A A . 12 PHE HB3 1 1
18 3827 1 1 12 PHE HD1 H -5.485 5.068 -1.532 1.00 . A A . 12 PHE HD1 1 1
18 3828 1 1 12 PHE HD2 H -2.995 1.630 -1.828 1.00 . A A . 12 PHE HD2 1 1
18 3829 1 1 12 PHE HE1 H -3.739 6.427 -2.592 1.00 . A A . 12 PHE HE1 1 1
18 3830 1 1 12 PHE HE2 H -1.245 2.988 -2.889 1.00 . A A . 12 PHE HE2 1 1
18 3831 1 1 12 PHE HZ H -1.616 5.389 -3.269 1.00 . A A . 12 PHE HZ 1 1
18 3832 1 1 12 PHE N N -4.133 1.853 1.012 1.00 . A A . 12 PHE N 1 1
18 3833 1 1 12 PHE O O -6.320 0.292 1.214 1.00 . A A . 12 PHE O 1 1
18 3834 1 1 13 PRO C C -9.333 0.188 1.438 1.00 . A A . 13 PRO C 1 1
18 3835 1 1 13 PRO CA C -8.766 1.391 2.226 1.00 . A A . 13 PRO CA 1 1
18 3836 1 1 13 PRO CB C -9.837 2.466 2.365 1.00 . A A . 13 PRO CB 1 1
18 3837 1 1 13 PRO CD C -7.913 3.562 1.484 1.00 . A A . 13 PRO CD 1 1
18 3838 1 1 13 PRO CG C -9.089 3.746 2.392 1.00 . A A . 13 PRO CG 1 1
18 3839 1 1 13 PRO HA H -8.481 1.054 3.212 1.00 . A A . 13 PRO HA 1 1
18 3840 1 1 13 PRO HB2 H -10.507 2.410 1.521 1.00 . A A . 13 PRO HB2 1 1
18 3841 1 1 13 PRO HB3 H -10.387 2.312 3.281 1.00 . A A . 13 PRO HB3 1 1
18 3842 1 1 13 PRO HD2 H -8.170 3.847 0.476 1.00 . A A . 13 PRO HD2 1 1
18 3843 1 1 13 PRO HD3 H -7.079 4.142 1.847 1.00 . A A . 13 PRO HD3 1 1
18 3844 1 1 13 PRO HG2 H -9.718 4.546 2.034 1.00 . A A . 13 PRO HG2 1 1
18 3845 1 1 13 PRO HG3 H -8.755 3.955 3.399 1.00 . A A . 13 PRO HG3 1 1
18 3846 1 1 13 PRO N N -7.633 2.113 1.572 1.00 . A A . 13 PRO N 1 1
18 3847 1 1 13 PRO O O -10.085 -0.617 1.987 1.00 . A A . 13 PRO O 1 1
18 3848 1 1 14 ASN C C -8.559 -2.293 -0.363 1.00 . A A . 14 ASN C 1 1
18 3849 1 1 14 ASN CA C -9.429 -1.071 -0.647 1.00 . A A . 14 ASN CA 1 1
18 3850 1 1 14 ASN CB C -9.397 -0.754 -2.157 1.00 . A A . 14 ASN CB 1 1
18 3851 1 1 14 ASN CG C -7.997 -0.519 -2.707 1.00 . A A . 14 ASN CG 1 1
18 3852 1 1 14 ASN H H -8.403 0.751 -0.232 1.00 . A A . 14 ASN H 1 1
18 3853 1 1 14 ASN HA H -10.442 -1.301 -0.353 1.00 . A A . 14 ASN HA 1 1
18 3854 1 1 14 ASN HB2 H -9.825 -1.584 -2.696 1.00 . A A . 14 ASN HB2 1 1
18 3855 1 1 14 ASN HB3 H -9.991 0.128 -2.345 1.00 . A A . 14 ASN HB3 1 1
18 3856 1 1 14 ASN HD21 H -8.531 -1.279 -4.438 1.00 . A A . 14 ASN HD21 1 1
18 3857 1 1 14 ASN HD22 H -6.902 -0.714 -4.327 1.00 . A A . 14 ASN HD22 1 1
18 3858 1 1 14 ASN N N -8.982 0.067 0.169 1.00 . A A . 14 ASN N 1 1
18 3859 1 1 14 ASN ND2 N -7.787 -0.874 -3.937 1.00 . A A . 14 ASN ND2 1 1
18 3860 1 1 14 ASN O O -8.835 -3.402 -0.844 1.00 . A A . 14 ASN O 1 1
18 3861 1 1 14 ASN OD1 O -7.106 -0.034 -2.007 1.00 . A A . 14 ASN OD1 1 1
18 3862 2 2 1 . C C -1.750 -1.887 2.926 1.00 . B A . 101 WMH C 1 1
18 3863 2 2 1 . C1 C -1.061 0.226 3.851 1.00 . B A . 101 WMH C1 1 1
18 3864 2 2 1 . C2 C 0.035 0.694 4.497 1.00 . B A . 101 WMH C2 1 1
18 3865 2 2 1 . H1 H -2.400 -2.369 3.634 1.00 . B A . 101 WMH H1 1 1
18 3866 2 2 1 . H2 H -2.375 -1.243 2.326 1.00 . B A . 101 WMH H2 1 1
18 3867 2 2 1 . H5 H 0.187 1.708 4.836 1.00 . B A . 101 WMH H5 1 1
18 3868 2 2 1 . N N -0.873 -1.043 3.603 1.00 . B A . 101 WMH N 1 1
18 3869 2 2 1 . N1 N 0.890 -0.314 4.640 1.00 . B A . 101 WMH N1 1 1
18 3870 2 2 1 . N2 N 0.388 -1.380 4.120 1.00 . B A . 101 WMH N2 1 1
19 3871 1 1 1 GLY C C -6.078 -3.580 1.010 1.00 . A A . 1 GLY C 1 1
19 3872 1 1 1 GLY CA C -7.378 -3.172 1.661 1.00 . A A . 1 GLY CA 1 1
19 3873 1 1 1 GLY H1 H -7.450 -1.149 1.058 1.00 . A A . 1 GLY H1 1 1
19 3874 1 1 1 GLY HA2 H -7.197 -2.975 2.706 1.00 . A A . 1 GLY HA2 1 1
19 3875 1 1 1 GLY HA3 H -8.082 -3.986 1.572 1.00 . A A . 1 GLY HA3 1 1
19 3876 1 1 1 GLY N N -7.954 -1.992 1.056 1.00 . A A . 1 GLY N 1 1
19 3877 1 1 1 GLY O O -5.378 -4.476 1.498 1.00 . A A . 1 GLY O 1 1
19 3878 1 1 2 LYS C C -3.362 -2.483 -0.189 1.00 . A A . 2 LYS C 1 1
19 3879 1 1 2 LYS CA C -4.530 -3.250 -0.789 1.00 . A A . 2 LYS CA 1 1
19 3880 1 1 2 LYS CB C -4.671 -2.933 -2.290 1.00 . A A . 2 LYS CB 1 1
19 3881 1 1 2 LYS CD C -3.037 -4.679 -3.092 1.00 . A A . 2 LYS CD 1 1
19 3882 1 1 2 LYS CE C -1.758 -4.941 -3.868 1.00 . A A . 2 LYS CE 1 1
19 3883 1 1 2 LYS CG C -3.419 -3.210 -3.124 1.00 . A A . 2 LYS CG 1 1
19 3884 1 1 2 LYS H H -6.333 -2.238 -0.445 1.00 . A A . 2 LYS H 1 1
19 3885 1 1 2 LYS HA H -4.349 -4.308 -0.674 1.00 . A A . 2 LYS HA 1 1
19 3886 1 1 2 LYS HB2 H -5.476 -3.531 -2.688 1.00 . A A . 2 LYS HB2 1 1
19 3887 1 1 2 LYS HB3 H -4.929 -1.890 -2.400 1.00 . A A . 2 LYS HB3 1 1
19 3888 1 1 2 LYS HD2 H -2.888 -4.978 -2.065 1.00 . A A . 2 LYS HD2 1 1
19 3889 1 1 2 LYS HD3 H -3.837 -5.260 -3.526 1.00 . A A . 2 LYS HD3 1 1
19 3890 1 1 2 LYS HE2 H -1.908 -4.654 -4.898 1.00 . A A . 2 LYS HE2 1 1
19 3891 1 1 2 LYS HE3 H -0.963 -4.345 -3.443 1.00 . A A . 2 LYS HE3 1 1
19 3892 1 1 2 LYS HG2 H -3.612 -2.921 -4.145 1.00 . A A . 2 LYS HG2 1 1
19 3893 1 1 2 LYS HG3 H -2.602 -2.625 -2.729 1.00 . A A . 2 LYS HG3 1 1
19 3894 1 1 2 LYS HZ1 H -2.116 -6.961 -4.230 1.00 . A A . 2 LYS HZ1 1 1
19 3895 1 1 2 LYS HZ2 H -1.211 -6.684 -2.845 1.00 . A A . 2 LYS HZ2 1 1
19 3896 1 1 2 LYS HZ3 H -0.498 -6.530 -4.366 1.00 . A A . 2 LYS HZ3 1 1
19 3897 1 1 2 LYS N N -5.748 -2.942 -0.087 1.00 . A A . 2 LYS N 1 1
19 3898 1 1 2 LYS NZ N -1.370 -6.363 -3.821 1.00 . A A . 2 LYS NZ 1 1
19 3899 1 1 2 LYS O O -3.376 -1.265 -0.127 1.00 . A A . 2 LYS O 1 1
19 3900 1 1 3 ALA C C 0.004 -2.964 -0.039 1.00 . A A . 3 ALA C 1 1
19 3901 1 1 3 ALA CA C -1.186 -2.599 0.789 1.00 . A A . 3 ALA CA 1 1
19 3902 1 1 3 ALA CB C -0.984 -2.911 2.277 1.00 . A A . 3 ALA CB 1 1
19 3903 1 1 3 ALA H H -2.468 -4.173 0.302 1.00 . A A . 3 ALA H 1 1
19 3904 1 1 3 ALA HA H -1.315 -1.532 0.685 1.00 . A A . 3 ALA HA 1 1
19 3905 1 1 3 ALA HB1 H 0.075 -2.970 2.483 1.00 . A A . 3 ALA HB1 1 1
19 3906 1 1 3 ALA HB2 H -1.445 -3.858 2.511 1.00 . A A . 3 ALA HB2 1 1
19 3907 1 1 3 ALA N N -2.391 -3.193 0.282 1.00 . A A . 3 ALA N 1 1
19 3908 1 1 3 ALA O O 0.184 -4.121 -0.419 1.00 . A A . 3 ALA O 1 1
19 3909 1 1 4 LEU C C 3.163 -2.072 -0.191 1.00 . A A . 4 LEU C 1 1
19 3910 1 1 4 LEU CA C 1.980 -2.157 -1.120 1.00 . A A . 4 LEU CA 1 1
19 3911 1 1 4 LEU CB C 2.080 -1.098 -2.210 1.00 . A A . 4 LEU CB 1 1
19 3912 1 1 4 LEU CD1 C 3.223 -2.508 -3.941 1.00 . A A . 4 LEU CD1 1 1
19 3913 1 1 4 LEU CD2 C 3.300 -0.010 -4.102 1.00 . A A . 4 LEU CD2 1 1
19 3914 1 1 4 LEU CG C 3.273 -1.202 -3.159 1.00 . A A . 4 LEU CG 1 1
19 3915 1 1 4 LEU H H 0.562 -1.052 -0.093 1.00 . A A . 4 LEU H 1 1
19 3916 1 1 4 LEU HA H 1.939 -3.133 -1.577 1.00 . A A . 4 LEU HA 1 1
19 3917 1 1 4 LEU HB2 H 1.176 -1.149 -2.796 1.00 . A A . 4 LEU HB2 1 1
19 3918 1 1 4 LEU HB3 H 2.124 -0.140 -1.713 1.00 . A A . 4 LEU HB3 1 1
19 3919 1 1 4 LEU HD11 H 3.263 -3.342 -3.257 1.00 . A A . 4 LEU HD11 1 1
19 3920 1 1 4 LEU HD12 H 4.066 -2.558 -4.614 1.00 . A A . 4 LEU HD12 1 1
19 3921 1 1 4 LEU HD13 H 2.307 -2.553 -4.511 1.00 . A A . 4 LEU HD13 1 1
19 3922 1 1 4 LEU HD21 H 4.145 -0.097 -4.768 1.00 . A A . 4 LEU HD21 1 1
19 3923 1 1 4 LEU HD22 H 3.389 0.900 -3.528 1.00 . A A . 4 LEU HD22 1 1
19 3924 1 1 4 LEU HD23 H 2.387 0.015 -4.678 1.00 . A A . 4 LEU HD23 1 1
19 3925 1 1 4 LEU HG H 4.185 -1.198 -2.581 1.00 . A A . 4 LEU HG 1 1
19 3926 1 1 4 LEU N N 0.785 -1.974 -0.360 1.00 . A A . 4 LEU N 1 1
19 3927 1 1 4 LEU O O 3.483 -1.001 0.342 1.00 . A A . 4 LEU O 1 1
19 3928 1 1 5 PHE C C 6.171 -2.910 0.148 1.00 . A A . 5 PHE C 1 1
19 3929 1 1 5 PHE CA C 4.912 -3.250 0.914 1.00 . A A . 5 PHE CA 1 1
19 3930 1 1 5 PHE CB C 5.030 -4.621 1.607 1.00 . A A . 5 PHE CB 1 1
19 3931 1 1 5 PHE CD1 C 7.384 -5.323 2.174 1.00 . A A . 5 PHE CD1 1 1
19 3932 1 1 5 PHE CD2 C 6.126 -4.148 3.822 1.00 . A A . 5 PHE CD2 1 1
19 3933 1 1 5 PHE CE1 C 8.462 -5.379 3.030 1.00 . A A . 5 PHE CE1 1 1
19 3934 1 1 5 PHE CE2 C 7.203 -4.205 4.684 1.00 . A A . 5 PHE CE2 1 1
19 3935 1 1 5 PHE CG C 6.202 -4.706 2.557 1.00 . A A . 5 PHE CG 1 1
19 3936 1 1 5 PHE CZ C 8.372 -4.821 4.287 1.00 . A A . 5 PHE CZ 1 1
19 3937 1 1 5 PHE H H 3.463 -3.987 -0.437 1.00 . A A . 5 PHE H 1 1
19 3938 1 1 5 PHE HA H 4.767 -2.490 1.667 1.00 . A A . 5 PHE HA 1 1
19 3939 1 1 5 PHE HB2 H 4.129 -4.810 2.171 1.00 . A A . 5 PHE HB2 1 1
19 3940 1 1 5 PHE HB3 H 5.148 -5.390 0.859 1.00 . A A . 5 PHE HB3 1 1
19 3941 1 1 5 PHE HD1 H 7.462 -5.763 1.191 1.00 . A A . 5 PHE HD1 1 1
19 3942 1 1 5 PHE HD2 H 5.213 -3.666 4.139 1.00 . A A . 5 PHE HD2 1 1
19 3943 1 1 5 PHE HE1 H 9.377 -5.861 2.717 1.00 . A A . 5 PHE HE1 1 1
19 3944 1 1 5 PHE HE2 H 7.132 -3.765 5.669 1.00 . A A . 5 PHE HE2 1 1
19 3945 1 1 5 PHE HZ H 9.220 -4.866 4.955 1.00 . A A . 5 PHE HZ 1 1
19 3946 1 1 5 PHE N N 3.779 -3.189 0.035 1.00 . A A . 5 PHE N 1 1
19 3947 1 1 5 PHE O O 6.578 -3.637 -0.767 1.00 . A A . 5 PHE O 1 1
19 3948 1 1 6 SER C C 8.315 -0.113 0.831 1.00 . A A . 6 SER C 1 1
19 3949 1 1 6 SER CA C 7.936 -1.276 -0.070 1.00 . A A . 6 SER CA 1 1
19 3950 1 1 6 SER CB C 7.620 -0.784 -1.513 1.00 . A A . 6 SER CB 1 1
19 3951 1 1 6 SER H H 6.396 -1.287 1.269 1.00 . A A . 6 SER H 1 1
19 3952 1 1 6 SER HA H 8.710 -2.028 -0.079 1.00 . A A . 6 SER HA 1 1
19 3953 1 1 6 SER HB2 H 7.162 -1.589 -2.069 1.00 . A A . 6 SER HB2 1 1
19 3954 1 1 6 SER HB3 H 6.926 0.042 -1.455 1.00 . A A . 6 SER HB3 1 1
19 3955 1 1 6 SER HG H 8.523 0.293 -2.880 1.00 . A A . 6 SER HG 1 1
19 3956 1 1 6 SER N N 6.754 -1.812 0.520 1.00 . A A . 6 SER N 1 1
19 3957 1 1 6 SER O O 7.738 0.021 1.918 1.00 . A A . 6 SER O 1 1
19 3958 1 1 6 SER OG O 8.790 -0.357 -2.216 1.00 . A A . 6 SER OG 1 1
19 3959 1 1 7 ASN C C 9.428 3.079 0.225 1.00 . A A . 7 ASN C 1 1
19 3960 1 1 7 ASN CA C 9.565 1.890 1.166 1.00 . A A . 7 ASN CA 1 1
19 3961 1 1 7 ASN CB C 10.959 1.841 1.876 1.00 . A A . 7 ASN CB 1 1
19 3962 1 1 7 ASN CG C 12.171 1.677 0.955 1.00 . A A . 7 ASN CG 1 1
19 3963 1 1 7 ASN H H 9.730 0.478 -0.403 1.00 . A A . 7 ASN H 1 1
19 3964 1 1 7 ASN HA H 8.782 1.965 1.907 1.00 . A A . 7 ASN HA 1 1
19 3965 1 1 7 ASN HB2 H 11.098 2.758 2.427 1.00 . A A . 7 ASN HB2 1 1
19 3966 1 1 7 ASN HB3 H 10.951 1.021 2.580 1.00 . A A . 7 ASN HB3 1 1
19 3967 1 1 7 ASN HD21 H 12.084 -0.290 1.129 1.00 . A A . 7 ASN HD21 1 1
19 3968 1 1 7 ASN HD22 H 13.349 0.307 0.138 1.00 . A A . 7 ASN HD22 1 1
19 3969 1 1 7 ASN N N 9.253 0.690 0.430 1.00 . A A . 7 ASN N 1 1
19 3970 1 1 7 ASN ND2 N 12.571 0.457 0.715 1.00 . A A . 7 ASN ND2 1 1
19 3971 1 1 7 ASN O O 10.205 3.221 -0.718 1.00 . A A . 7 ASN O 1 1
19 3972 1 1 7 ASN OD1 O 12.757 2.656 0.478 1.00 . A A . 7 ASN OD1 1 1
19 3973 1 1 8 PRO C C 6.315 2.812 1.245 1.00 . A A . 8 PRO C 1 1
19 3974 1 1 8 PRO CA C 7.440 3.835 1.526 1.00 . A A . 8 PRO CA 1 1
19 3975 1 1 8 PRO CB C 6.853 5.246 1.559 1.00 . A A . 8 PRO CB 1 1
19 3976 1 1 8 PRO CD C 8.083 5.066 -0.480 1.00 . A A . 8 PRO CD 1 1
19 3977 1 1 8 PRO CG C 6.855 5.675 0.139 1.00 . A A . 8 PRO CG 1 1
19 3978 1 1 8 PRO HA H 7.930 3.627 2.464 1.00 . A A . 8 PRO HA 1 1
19 3979 1 1 8 PRO HB2 H 5.853 5.214 1.965 1.00 . A A . 8 PRO HB2 1 1
19 3980 1 1 8 PRO HB3 H 7.475 5.890 2.163 1.00 . A A . 8 PRO HB3 1 1
19 3981 1 1 8 PRO HD2 H 7.858 4.712 -1.476 1.00 . A A . 8 PRO HD2 1 1
19 3982 1 1 8 PRO HD3 H 8.894 5.778 -0.516 1.00 . A A . 8 PRO HD3 1 1
19 3983 1 1 8 PRO HG2 H 5.969 5.297 -0.351 1.00 . A A . 8 PRO HG2 1 1
19 3984 1 1 8 PRO HG3 H 6.890 6.751 0.074 1.00 . A A . 8 PRO HG3 1 1
19 3985 1 1 8 PRO N N 8.408 3.933 0.415 1.00 . A A . 8 PRO N 1 1
19 3986 1 1 8 PRO O O 6.054 2.468 0.081 1.00 . A A . 8 PRO O 1 1
19 3987 1 1 9 PRO C C 3.286 2.164 1.811 1.00 . A A . 9 PRO C 1 1
19 3988 1 1 9 PRO CA C 4.549 1.381 2.113 1.00 . A A . 9 PRO CA 1 1
19 3989 1 1 9 PRO CB C 4.429 0.657 3.467 1.00 . A A . 9 PRO CB 1 1
19 3990 1 1 9 PRO CD C 5.934 2.524 3.704 1.00 . A A . 9 PRO CD 1 1
19 3991 1 1 9 PRO CG C 5.483 1.251 4.352 1.00 . A A . 9 PRO CG 1 1
19 3992 1 1 9 PRO HA H 4.735 0.671 1.321 1.00 . A A . 9 PRO HA 1 1
19 3993 1 1 9 PRO HB2 H 3.439 0.819 3.869 1.00 . A A . 9 PRO HB2 1 1
19 3994 1 1 9 PRO HB3 H 4.587 -0.402 3.324 1.00 . A A . 9 PRO HB3 1 1
19 3995 1 1 9 PRO HD2 H 5.369 3.365 4.080 1.00 . A A . 9 PRO HD2 1 1
19 3996 1 1 9 PRO HD3 H 6.989 2.662 3.878 1.00 . A A . 9 PRO HD3 1 1
19 3997 1 1 9 PRO HG2 H 5.067 1.459 5.327 1.00 . A A . 9 PRO HG2 1 1
19 3998 1 1 9 PRO HG3 H 6.309 0.563 4.439 1.00 . A A . 9 PRO HG3 1 1
19 3999 1 1 9 PRO N N 5.656 2.288 2.286 1.00 . A A . 9 PRO N 1 1
19 4000 1 1 9 PRO O O 2.795 2.927 2.648 1.00 . A A . 9 PRO O 1 1
19 4001 1 1 10 ILE C C 0.420 1.842 0.404 1.00 . A A . 10 ILE C 1 1
19 4002 1 1 10 ILE CA C 1.620 2.740 0.215 1.00 . A A . 10 ILE CA 1 1
19 4003 1 1 10 ILE CB C 1.716 3.200 -1.269 1.00 . A A . 10 ILE CB 1 1
19 4004 1 1 10 ILE CD1 C 3.084 5.295 -0.639 1.00 . A A . 10 ILE CD1 1 1
19 4005 1 1 10 ILE CG1 C 2.986 4.047 -1.503 1.00 . A A . 10 ILE CG1 1 1
19 4006 1 1 10 ILE CG2 C 0.469 3.983 -1.684 1.00 . A A . 10 ILE CG2 1 1
19 4007 1 1 10 ILE H H 3.218 1.396 0.000 1.00 . A A . 10 ILE H 1 1
19 4008 1 1 10 ILE HA H 1.516 3.608 0.849 1.00 . A A . 10 ILE HA 1 1
19 4009 1 1 10 ILE HB H 1.772 2.316 -1.887 1.00 . A A . 10 ILE HB 1 1
19 4010 1 1 10 ILE HD11 H 3.142 5.013 0.402 1.00 . A A . 10 ILE HD11 1 1
19 4011 1 1 10 ILE HD12 H 2.204 5.898 -0.793 1.00 . A A . 10 ILE HD12 1 1
19 4012 1 1 10 ILE HD13 H 3.961 5.862 -0.912 1.00 . A A . 10 ILE HD13 1 1
19 4013 1 1 10 ILE HG12 H 3.856 3.442 -1.295 1.00 . A A . 10 ILE HG12 1 1
19 4014 1 1 10 ILE HG13 H 3.011 4.357 -2.537 1.00 . A A . 10 ILE HG13 1 1
19 4015 1 1 10 ILE HG21 H 0.558 4.282 -2.717 1.00 . A A . 10 ILE HG21 1 1
19 4016 1 1 10 ILE HG22 H 0.380 4.863 -1.064 1.00 . A A . 10 ILE HG22 1 1
19 4017 1 1 10 ILE HG23 H -0.406 3.363 -1.559 1.00 . A A . 10 ILE HG23 1 1
19 4018 1 1 10 ILE N N 2.796 2.023 0.623 1.00 . A A . 10 ILE N 1 1
19 4019 1 1 10 ILE O O 0.343 0.762 -0.187 1.00 . A A . 10 ILE O 1 1
19 4020 1 1 11 ALA C C -2.836 2.138 0.931 1.00 . A A . 11 ALA C 1 1
19 4021 1 1 11 ALA CA C -1.642 1.456 1.489 1.00 . A A . 11 ALA CA 1 1
19 4022 1 1 11 ALA CB C -1.852 1.089 2.964 1.00 . A A . 11 ALA CB 1 1
19 4023 1 1 11 ALA H H -0.352 3.068 1.764 1.00 . A A . 11 ALA H 1 1
19 4024 1 1 11 ALA HA H -1.509 0.536 0.937 1.00 . A A . 11 ALA HA 1 1
19 4025 1 1 11 ALA HB1 H -2.724 0.458 3.041 1.00 . A A . 11 ALA HB1 1 1
19 4026 1 1 11 ALA HB2 H -2.029 1.935 3.603 1.00 . A A . 11 ALA HB2 1 1
19 4027 1 1 11 ALA N N -0.471 2.234 1.265 1.00 . A A . 11 ALA N 1 1
19 4028 1 1 11 ALA O O -2.951 3.368 0.972 1.00 . A A . 11 ALA O 1 1
19 4029 1 1 12 PHE C C -6.035 1.446 0.694 1.00 . A A . 12 PHE C 1 1
19 4030 1 1 12 PHE CA C -4.889 1.854 -0.208 1.00 . A A . 12 PHE CA 1 1
19 4031 1 1 12 PHE CB C -5.046 1.280 -1.624 1.00 . A A . 12 PHE CB 1 1
19 4032 1 1 12 PHE CD1 C -2.922 0.469 -2.708 1.00 . A A . 12 PHE CD1 1 1
19 4033 1 1 12 PHE CD2 C -3.567 2.728 -3.056 1.00 . A A . 12 PHE CD2 1 1
19 4034 1 1 12 PHE CE1 C -1.794 0.663 -3.474 1.00 . A A . 12 PHE CE1 1 1
19 4035 1 1 12 PHE CE2 C -2.440 2.930 -3.828 1.00 . A A . 12 PHE CE2 1 1
19 4036 1 1 12 PHE CG C -3.823 1.498 -2.489 1.00 . A A . 12 PHE CG 1 1
19 4037 1 1 12 PHE CZ C -1.553 1.896 -4.037 1.00 . A A . 12 PHE CZ 1 1
19 4038 1 1 12 PHE H H -3.541 0.390 0.369 1.00 . A A . 12 PHE H 1 1
19 4039 1 1 12 PHE HA H -4.824 2.931 -0.254 1.00 . A A . 12 PHE HA 1 1
19 4040 1 1 12 PHE HB2 H -5.228 0.218 -1.557 1.00 . A A . 12 PHE HB2 1 1
19 4041 1 1 12 PHE HB3 H -5.886 1.758 -2.106 1.00 . A A . 12 PHE HB3 1 1
19 4042 1 1 12 PHE HD1 H -3.112 -0.499 -2.267 1.00 . A A . 12 PHE HD1 1 1
19 4043 1 1 12 PHE HD2 H -4.262 3.538 -2.893 1.00 . A A . 12 PHE HD2 1 1
19 4044 1 1 12 PHE HE1 H -1.102 -0.150 -3.634 1.00 . A A . 12 PHE HE1 1 1
19 4045 1 1 12 PHE HE2 H -2.252 3.898 -4.268 1.00 . A A . 12 PHE HE2 1 1
19 4046 1 1 12 PHE HZ H -0.667 2.055 -4.636 1.00 . A A . 12 PHE HZ 1 1
19 4047 1 1 12 PHE N N -3.697 1.364 0.382 1.00 . A A . 12 PHE N 1 1
19 4048 1 1 12 PHE O O -6.076 0.297 1.162 1.00 . A A . 12 PHE O 1 1
19 4049 1 1 13 PRO C C -9.035 0.982 1.547 1.00 . A A . 13 PRO C 1 1
19 4050 1 1 13 PRO CA C -8.077 2.135 1.929 1.00 . A A . 13 PRO CA 1 1
19 4051 1 1 13 PRO CB C -8.822 3.477 1.953 1.00 . A A . 13 PRO CB 1 1
19 4052 1 1 13 PRO CD C -6.988 3.738 0.446 1.00 . A A . 13 PRO CD 1 1
19 4053 1 1 13 PRO CG C -8.388 4.193 0.723 1.00 . A A . 13 PRO CG 1 1
19 4054 1 1 13 PRO HA H -7.692 1.932 2.918 1.00 . A A . 13 PRO HA 1 1
19 4055 1 1 13 PRO HB2 H -9.886 3.292 1.943 1.00 . A A . 13 PRO HB2 1 1
19 4056 1 1 13 PRO HB3 H -8.557 4.026 2.845 1.00 . A A . 13 PRO HB3 1 1
19 4057 1 1 13 PRO HD2 H -6.796 3.740 -0.616 1.00 . A A . 13 PRO HD2 1 1
19 4058 1 1 13 PRO HD3 H -6.275 4.365 0.961 1.00 . A A . 13 PRO HD3 1 1
19 4059 1 1 13 PRO HG2 H -9.037 3.940 -0.101 1.00 . A A . 13 PRO HG2 1 1
19 4060 1 1 13 PRO HG3 H -8.407 5.260 0.895 1.00 . A A . 13 PRO HG3 1 1
19 4061 1 1 13 PRO N N -6.963 2.366 0.985 1.00 . A A . 13 PRO N 1 1
19 4062 1 1 13 PRO O O -9.922 0.624 2.330 1.00 . A A . 13 PRO O 1 1
19 4063 1 1 14 ASN C C -9.153 -2.032 0.498 1.00 . A A . 14 ASN C 1 1
19 4064 1 1 14 ASN CA C -9.683 -0.712 -0.070 1.00 . A A . 14 ASN CA 1 1
19 4065 1 1 14 ASN CB C -9.767 -0.789 -1.611 1.00 . A A . 14 ASN CB 1 1
19 4066 1 1 14 ASN CG C -8.472 -1.201 -2.295 1.00 . A A . 14 ASN CG 1 1
19 4067 1 1 14 ASN H H -8.145 0.745 -0.216 1.00 . A A . 14 ASN H 1 1
19 4068 1 1 14 ASN HA H -10.671 -0.548 0.330 1.00 . A A . 14 ASN HA 1 1
19 4069 1 1 14 ASN HB2 H -10.517 -1.516 -1.882 1.00 . A A . 14 ASN HB2 1 1
19 4070 1 1 14 ASN HB3 H -10.064 0.175 -1.995 1.00 . A A . 14 ASN HB3 1 1
19 4071 1 1 14 ASN HD21 H -9.488 -1.903 -3.847 1.00 . A A . 14 ASN HD21 1 1
19 4072 1 1 14 ASN HD22 H -7.776 -2.050 -3.930 1.00 . A A . 14 ASN HD22 1 1
19 4073 1 1 14 ASN N N -8.853 0.405 0.373 1.00 . A A . 14 ASN N 1 1
19 4074 1 1 14 ASN ND2 N -8.592 -1.770 -3.464 1.00 . A A . 14 ASN ND2 1 1
19 4075 1 1 14 ASN O O -9.825 -3.069 0.425 1.00 . A A . 14 ASN O 1 1
19 4076 1 1 14 ASN OD1 O -7.373 -0.982 -1.782 1.00 . A A . 14 ASN OD1 1 1
19 4077 2 2 1 . C C -1.579 -1.857 3.180 1.00 . B A . 101 WMH C 1 1
19 4078 2 2 1 . C1 C -0.712 0.342 3.556 1.00 . B A . 101 WMH C1 1 1
19 4079 2 2 1 . C2 C 0.443 0.863 4.043 1.00 . B A . 101 WMH C2 1 1
19 4080 2 2 1 . H1 H -2.202 -2.159 4.002 1.00 . B A . 101 WMH H1 1 1
19 4081 2 2 1 . H2 H -2.230 -1.294 2.530 1.00 . B A . 101 WMH H2 1 1
19 4082 2 2 1 . H5 H 0.690 1.911 4.118 1.00 . B A . 101 WMH H5 1 1
19 4083 2 2 1 . N N -0.627 -0.953 3.622 1.00 . B A . 101 WMH N 1 1
19 4084 2 2 1 . N1 N 1.223 -0.149 4.407 1.00 . B A . 101 WMH N1 1 1
19 4085 2 2 1 . N2 N 0.617 -1.258 4.173 1.00 . B A . 101 WMH N2 1 1
20 4086 1 1 1 GLY C C -6.233 -3.486 0.014 1.00 . A A . 1 GLY C 1 1
20 4087 1 1 1 GLY CA C -7.490 -3.190 0.801 1.00 . A A . 1 GLY CA 1 1
20 4088 1 1 1 GLY H1 H -7.562 -1.082 0.776 1.00 . A A . 1 GLY H1 1 1
20 4089 1 1 1 GLY HA2 H -7.256 -3.235 1.853 1.00 . A A . 1 GLY HA2 1 1
20 4090 1 1 1 GLY HA3 H -8.228 -3.946 0.575 1.00 . A A . 1 GLY HA3 1 1
20 4091 1 1 1 GLY N N -8.045 -1.893 0.504 1.00 . A A . 1 GLY N 1 1
20 4092 1 1 1 GLY O O -5.851 -4.647 -0.138 1.00 . A A . 1 GLY O 1 1
20 4093 1 1 2 LYS C C -3.178 -2.189 -0.421 1.00 . A A . 2 LYS C 1 1
20 4094 1 1 2 LYS CA C -4.378 -2.609 -1.269 1.00 . A A . 2 LYS CA 1 1
20 4095 1 1 2 LYS CB C -4.443 -1.768 -2.561 1.00 . A A . 2 LYS CB 1 1
20 4096 1 1 2 LYS CD C -3.360 -1.050 -4.722 1.00 . A A . 2 LYS CD 1 1
20 4097 1 1 2 LYS CE C -2.195 -1.278 -5.691 1.00 . A A . 2 LYS CE 1 1
20 4098 1 1 2 LYS CG C -3.254 -1.942 -3.492 1.00 . A A . 2 LYS CG 1 1
20 4099 1 1 2 LYS H H -5.961 -1.552 -0.364 1.00 . A A . 2 LYS H 1 1
20 4100 1 1 2 LYS HA H -4.283 -3.652 -1.529 1.00 . A A . 2 LYS HA 1 1
20 4101 1 1 2 LYS HB2 H -5.334 -2.040 -3.107 1.00 . A A . 2 LYS HB2 1 1
20 4102 1 1 2 LYS HB3 H -4.512 -0.725 -2.290 1.00 . A A . 2 LYS HB3 1 1
20 4103 1 1 2 LYS HD2 H -4.286 -1.266 -5.235 1.00 . A A . 2 LYS HD2 1 1
20 4104 1 1 2 LYS HD3 H -3.357 -0.018 -4.406 1.00 . A A . 2 LYS HD3 1 1
20 4105 1 1 2 LYS HE2 H -2.189 -2.319 -5.977 1.00 . A A . 2 LYS HE2 1 1
20 4106 1 1 2 LYS HE3 H -2.354 -0.670 -6.567 1.00 . A A . 2 LYS HE3 1 1
20 4107 1 1 2 LYS HG2 H -2.356 -1.685 -2.951 1.00 . A A . 2 LYS HG2 1 1
20 4108 1 1 2 LYS HG3 H -3.206 -2.974 -3.807 1.00 . A A . 2 LYS HG3 1 1
20 4109 1 1 2 LYS HZ1 H -0.796 0.055 -4.851 1.00 . A A . 2 LYS HZ1 1 1
20 4110 1 1 2 LYS HZ2 H -0.103 -1.184 -5.759 1.00 . A A . 2 LYS HZ2 1 1
20 4111 1 1 2 LYS HZ3 H -0.713 -1.507 -4.239 1.00 . A A . 2 LYS HZ3 1 1
20 4112 1 1 2 LYS N N -5.600 -2.453 -0.499 1.00 . A A . 2 LYS N 1 1
20 4113 1 1 2 LYS NZ N -0.874 -0.951 -5.101 1.00 . A A . 2 LYS NZ 1 1
20 4114 1 1 2 LYS O O -3.087 -1.034 0.006 1.00 . A A . 2 LYS O 1 1
20 4115 1 1 3 ALA C C 0.093 -3.583 0.003 1.00 . A A . 3 ALA C 1 1
20 4116 1 1 3 ALA CA C -1.093 -2.903 0.611 1.00 . A A . 3 ALA CA 1 1
20 4117 1 1 3 ALA CB C -1.265 -3.324 2.075 1.00 . A A . 3 ALA CB 1 1
20 4118 1 1 3 ALA H H -2.451 -4.045 -0.473 1.00 . A A . 3 ALA H 1 1
20 4119 1 1 3 ALA HA H -0.908 -1.839 0.594 1.00 . A A . 3 ALA HA 1 1
20 4120 1 1 3 ALA HB1 H -0.320 -3.694 2.445 1.00 . A A . 3 ALA HB1 1 1
20 4121 1 1 3 ALA HB2 H -1.997 -4.113 2.119 1.00 . A A . 3 ALA HB2 1 1
20 4122 1 1 3 ALA N N -2.303 -3.131 -0.149 1.00 . A A . 3 ALA N 1 1
20 4123 1 1 3 ALA O O 0.038 -4.758 -0.370 1.00 . A A . 3 ALA O 1 1
20 4124 1 1 4 LEU C C 3.445 -2.809 0.415 1.00 . A A . 4 LEU C 1 1
20 4125 1 1 4 LEU CA C 2.416 -3.282 -0.578 1.00 . A A . 4 LEU CA 1 1
20 4126 1 1 4 LEU CB C 2.718 -2.694 -1.964 1.00 . A A . 4 LEU CB 1 1
20 4127 1 1 4 LEU CD1 C 4.058 -4.607 -2.901 1.00 . A A . 4 LEU CD1 1 1
20 4128 1 1 4 LEU CD2 C 4.267 -2.329 -3.901 1.00 . A A . 4 LEU CD2 1 1
20 4129 1 1 4 LEU CG C 4.039 -3.115 -2.622 1.00 . A A . 4 LEU CG 1 1
20 4130 1 1 4 LEU H H 1.097 -1.881 0.160 1.00 . A A . 4 LEU H 1 1
20 4131 1 1 4 LEU HA H 2.408 -4.362 -0.629 1.00 . A A . 4 LEU HA 1 1
20 4132 1 1 4 LEU HB2 H 1.917 -2.975 -2.629 1.00 . A A . 4 LEU HB2 1 1
20 4133 1 1 4 LEU HB3 H 2.722 -1.618 -1.870 1.00 . A A . 4 LEU HB3 1 1
20 4134 1 1 4 LEU HD11 H 3.247 -4.859 -3.568 1.00 . A A . 4 LEU HD11 1 1
20 4135 1 1 4 LEU HD12 H 3.945 -5.150 -1.976 1.00 . A A . 4 LEU HD12 1 1
20 4136 1 1 4 LEU HD13 H 4.997 -4.876 -3.363 1.00 . A A . 4 LEU HD13 1 1
20 4137 1 1 4 LEU HD21 H 3.449 -2.509 -4.583 1.00 . A A . 4 LEU HD21 1 1
20 4138 1 1 4 LEU HD22 H 5.193 -2.644 -4.358 1.00 . A A . 4 LEU HD22 1 1
20 4139 1 1 4 LEU HD23 H 4.318 -1.275 -3.672 1.00 . A A . 4 LEU HD23 1 1
20 4140 1 1 4 LEU HG H 4.851 -2.898 -1.944 1.00 . A A . 4 LEU HG 1 1
20 4141 1 1 4 LEU N N 1.146 -2.823 -0.109 1.00 . A A . 4 LEU N 1 1
20 4142 1 1 4 LEU O O 3.451 -1.615 0.775 1.00 . A A . 4 LEU O 1 1
20 4143 1 1 5 PHE C C 6.556 -2.928 1.021 1.00 . A A . 5 PHE C 1 1
20 4144 1 1 5 PHE CA C 5.300 -3.274 1.803 1.00 . A A . 5 PHE CA 1 1
20 4145 1 1 5 PHE CB C 5.559 -4.307 2.914 1.00 . A A . 5 PHE CB 1 1
20 4146 1 1 5 PHE CD1 C 6.064 -2.833 4.891 1.00 . A A . 5 PHE CD1 1 1
20 4147 1 1 5 PHE CD2 C 7.766 -4.319 4.131 1.00 . A A . 5 PHE CD2 1 1
20 4148 1 1 5 PHE CE1 C 6.904 -2.372 5.885 1.00 . A A . 5 PHE CE1 1 1
20 4149 1 1 5 PHE CE2 C 8.612 -3.863 5.125 1.00 . A A . 5 PHE CE2 1 1
20 4150 1 1 5 PHE CG C 6.485 -3.812 4.001 1.00 . A A . 5 PHE CG 1 1
20 4151 1 1 5 PHE CZ C 8.180 -2.887 6.002 1.00 . A A . 5 PHE CZ 1 1
20 4152 1 1 5 PHE H H 4.207 -4.626 0.616 1.00 . A A . 5 PHE H 1 1
20 4153 1 1 5 PHE HA H 4.946 -2.354 2.246 1.00 . A A . 5 PHE HA 1 1
20 4154 1 1 5 PHE HB2 H 4.619 -4.573 3.375 1.00 . A A . 5 PHE HB2 1 1
20 4155 1 1 5 PHE HB3 H 5.998 -5.191 2.476 1.00 . A A . 5 PHE HB3 1 1
20 4156 1 1 5 PHE HD1 H 5.065 -2.429 4.802 1.00 . A A . 5 PHE HD1 1 1
20 4157 1 1 5 PHE HD2 H 8.103 -5.082 3.445 1.00 . A A . 5 PHE HD2 1 1
20 4158 1 1 5 PHE HE1 H 6.567 -1.608 6.573 1.00 . A A . 5 PHE HE1 1 1
20 4159 1 1 5 PHE HE2 H 9.609 -4.269 5.214 1.00 . A A . 5 PHE HE2 1 1
20 4160 1 1 5 PHE HZ H 8.841 -2.528 6.778 1.00 . A A . 5 PHE HZ 1 1
20 4161 1 1 5 PHE N N 4.277 -3.687 0.890 1.00 . A A . 5 PHE N 1 1
20 4162 1 1 5 PHE O O 7.474 -3.746 0.848 1.00 . A A . 5 PHE O 1 1
20 4163 1 1 6 SER C C 8.090 0.028 0.397 1.00 . A A . 6 SER C 1 1
20 4164 1 1 6 SER CA C 7.582 -1.219 -0.312 1.00 . A A . 6 SER CA 1 1
20 4165 1 1 6 SER CB C 7.019 -0.885 -1.682 1.00 . A A . 6 SER CB 1 1
20 4166 1 1 6 SER H H 5.714 -1.211 0.516 1.00 . A A . 6 SER H 1 1
20 4167 1 1 6 SER HA H 8.363 -1.954 -0.413 1.00 . A A . 6 SER HA 1 1
20 4168 1 1 6 SER HB2 H 7.736 -0.286 -2.225 1.00 . A A . 6 SER HB2 1 1
20 4169 1 1 6 SER HB3 H 6.824 -1.796 -2.228 1.00 . A A . 6 SER HB3 1 1
20 4170 1 1 6 SER HG H 5.720 0.452 -2.289 1.00 . A A . 6 SER HG 1 1
20 4171 1 1 6 SER N N 6.521 -1.766 0.454 1.00 . A A . 6 SER N 1 1
20 4172 1 1 6 SER O O 7.715 0.265 1.550 1.00 . A A . 6 SER O 1 1
20 4173 1 1 6 SER OG O 5.793 -0.158 -1.546 1.00 . A A . 6 SER OG 1 1
20 4174 1 1 7 ASN C C 9.016 3.182 -0.595 1.00 . A A . 7 ASN C 1 1
20 4175 1 1 7 ASN CA C 9.391 2.044 0.340 1.00 . A A . 7 ASN CA 1 1
20 4176 1 1 7 ASN CB C 10.912 2.051 0.576 1.00 . A A . 7 ASN CB 1 1
20 4177 1 1 7 ASN CG C 11.402 3.366 1.191 1.00 . A A . 7 ASN CG 1 1
20 4178 1 1 7 ASN H H 9.297 0.529 -1.110 1.00 . A A . 7 ASN H 1 1
20 4179 1 1 7 ASN HA H 8.881 2.160 1.284 1.00 . A A . 7 ASN HA 1 1
20 4180 1 1 7 ASN HB2 H 11.173 1.243 1.242 1.00 . A A . 7 ASN HB2 1 1
20 4181 1 1 7 ASN HB3 H 11.415 1.909 -0.369 1.00 . A A . 7 ASN HB3 1 1
20 4182 1 1 7 ASN HD21 H 11.136 2.645 2.999 1.00 . A A . 7 ASN HD21 1 1
20 4183 1 1 7 ASN HD22 H 11.751 4.250 2.932 1.00 . A A . 7 ASN HD22 1 1
20 4184 1 1 7 ASN N N 8.939 0.792 -0.232 1.00 . A A . 7 ASN N 1 1
20 4185 1 1 7 ASN ND2 N 11.431 3.434 2.494 1.00 . A A . 7 ASN ND2 1 1
20 4186 1 1 7 ASN O O 9.463 3.200 -1.745 1.00 . A A . 7 ASN O 1 1
20 4187 1 1 7 ASN OD1 O 11.744 4.317 0.485 1.00 . A A . 7 ASN OD1 1 1
20 4188 1 1 8 PRO C C 6.292 3.087 1.136 1.00 . A A . 8 PRO C 1 1
20 4189 1 1 8 PRO CA C 7.481 4.075 1.145 1.00 . A A . 8 PRO CA 1 1
20 4190 1 1 8 PRO CB C 6.963 5.510 1.303 1.00 . A A . 8 PRO CB 1 1
20 4191 1 1 8 PRO CD C 7.764 5.313 -0.944 1.00 . A A . 8 PRO CD 1 1
20 4192 1 1 8 PRO CG C 6.720 5.977 -0.091 1.00 . A A . 8 PRO CG 1 1
20 4193 1 1 8 PRO HA H 8.173 3.840 1.940 1.00 . A A . 8 PRO HA 1 1
20 4194 1 1 8 PRO HB2 H 6.054 5.503 1.885 1.00 . A A . 8 PRO HB2 1 1
20 4195 1 1 8 PRO HB3 H 7.711 6.114 1.797 1.00 . A A . 8 PRO HB3 1 1
20 4196 1 1 8 PRO HD2 H 7.349 5.029 -1.900 1.00 . A A . 8 PRO HD2 1 1
20 4197 1 1 8 PRO HD3 H 8.611 5.967 -1.082 1.00 . A A . 8 PRO HD3 1 1
20 4198 1 1 8 PRO HG2 H 5.734 5.675 -0.409 1.00 . A A . 8 PRO HG2 1 1
20 4199 1 1 8 PRO HG3 H 6.818 7.051 -0.145 1.00 . A A . 8 PRO HG3 1 1
20 4200 1 1 8 PRO N N 8.149 4.117 -0.168 1.00 . A A . 8 PRO N 1 1
20 4201 1 1 8 PRO O O 5.730 2.808 0.065 1.00 . A A . 8 PRO O 1 1
20 4202 1 1 9 PRO C C 3.481 2.332 2.105 1.00 . A A . 9 PRO C 1 1
20 4203 1 1 9 PRO CA C 4.785 1.593 2.383 1.00 . A A . 9 PRO CA 1 1
20 4204 1 1 9 PRO CB C 4.817 1.083 3.835 1.00 . A A . 9 PRO CB 1 1
20 4205 1 1 9 PRO CD C 6.582 2.684 3.604 1.00 . A A . 9 PRO CD 1 1
20 4206 1 1 9 PRO CG C 6.169 1.451 4.352 1.00 . A A . 9 PRO CG 1 1
20 4207 1 1 9 PRO HA H 4.890 0.773 1.689 1.00 . A A . 9 PRO HA 1 1
20 4208 1 1 9 PRO HB2 H 4.032 1.562 4.401 1.00 . A A . 9 PRO HB2 1 1
20 4209 1 1 9 PRO HB3 H 4.668 0.013 3.847 1.00 . A A . 9 PRO HB3 1 1
20 4210 1 1 9 PRO HD2 H 6.225 3.570 4.109 1.00 . A A . 9 PRO HD2 1 1
20 4211 1 1 9 PRO HD3 H 7.656 2.708 3.499 1.00 . A A . 9 PRO HD3 1 1
20 4212 1 1 9 PRO HG2 H 6.116 1.655 5.411 1.00 . A A . 9 PRO HG2 1 1
20 4213 1 1 9 PRO HG3 H 6.866 0.647 4.163 1.00 . A A . 9 PRO HG3 1 1
20 4214 1 1 9 PRO N N 5.922 2.512 2.297 1.00 . A A . 9 PRO N 1 1
20 4215 1 1 9 PRO O O 3.062 3.200 2.885 1.00 . A A . 9 PRO O 1 1
20 4216 1 1 10 ILE C C 0.486 1.753 0.651 1.00 . A A . 10 ILE C 1 1
20 4217 1 1 10 ILE CA C 1.662 2.706 0.581 1.00 . A A . 10 ILE CA 1 1
20 4218 1 1 10 ILE CB C 1.788 3.327 -0.850 1.00 . A A . 10 ILE CB 1 1
20 4219 1 1 10 ILE CD1 C 2.758 5.541 0.059 1.00 . A A . 10 ILE CD1 1 1
20 4220 1 1 10 ILE CG1 C 2.927 4.368 -0.901 1.00 . A A . 10 ILE CG1 1 1
20 4221 1 1 10 ILE CG2 C 0.473 3.960 -1.301 1.00 . A A . 10 ILE CG2 1 1
20 4222 1 1 10 ILE H H 3.241 1.325 0.417 1.00 . A A . 10 ILE H 1 1
20 4223 1 1 10 ILE HA H 1.490 3.505 1.286 1.00 . A A . 10 ILE HA 1 1
20 4224 1 1 10 ILE HB H 2.023 2.527 -1.537 1.00 . A A . 10 ILE HB 1 1
20 4225 1 1 10 ILE HD11 H 1.829 6.047 -0.151 1.00 . A A . 10 ILE HD11 1 1
20 4226 1 1 10 ILE HD12 H 3.579 6.230 -0.073 1.00 . A A . 10 ILE HD12 1 1
20 4227 1 1 10 ILE HD13 H 2.756 5.183 1.077 1.00 . A A . 10 ILE HD13 1 1
20 4228 1 1 10 ILE HG12 H 3.857 3.880 -0.649 1.00 . A A . 10 ILE HG12 1 1
20 4229 1 1 10 ILE HG13 H 2.997 4.764 -1.903 1.00 . A A . 10 ILE HG13 1 1
20 4230 1 1 10 ILE HG21 H 0.204 4.750 -0.615 1.00 . A A . 10 ILE HG21 1 1
20 4231 1 1 10 ILE HG22 H -0.305 3.212 -1.308 1.00 . A A . 10 ILE HG22 1 1
20 4232 1 1 10 ILE HG23 H 0.589 4.369 -2.294 1.00 . A A . 10 ILE HG23 1 1
20 4233 1 1 10 ILE N N 2.874 2.034 0.986 1.00 . A A . 10 ILE N 1 1
20 4234 1 1 10 ILE O O 0.483 0.686 0.000 1.00 . A A . 10 ILE O 1 1
20 4235 1 1 11 ALA C C -2.870 2.163 1.302 1.00 . A A . 11 ALA C 1 1
20 4236 1 1 11 ALA CA C -1.668 1.332 1.638 1.00 . A A . 11 ALA CA 1 1
20 4237 1 1 11 ALA CB C -1.797 0.776 3.059 1.00 . A A . 11 ALA CB 1 1
20 4238 1 1 11 ALA H H -0.391 2.935 1.991 1.00 . A A . 11 ALA H 1 1
20 4239 1 1 11 ALA HA H -1.623 0.493 0.956 1.00 . A A . 11 ALA HA 1 1
20 4240 1 1 11 ALA HB1 H -2.698 0.184 3.111 1.00 . A A . 11 ALA HB1 1 1
20 4241 1 1 11 ALA HB2 H -1.878 1.550 3.801 1.00 . A A . 11 ALA HB2 1 1
20 4242 1 1 11 ALA N N -0.477 2.108 1.471 1.00 . A A . 11 ALA N 1 1
20 4243 1 1 11 ALA O O -2.858 3.398 1.466 1.00 . A A . 11 ALA O 1 1
20 4244 1 1 12 PHE C C -6.234 1.517 1.189 1.00 . A A . 12 PHE C 1 1
20 4245 1 1 12 PHE CA C -5.099 2.147 0.419 1.00 . A A . 12 PHE CA 1 1
20 4246 1 1 12 PHE CB C -5.354 1.970 -1.085 1.00 . A A . 12 PHE CB 1 1
20 4247 1 1 12 PHE CD1 C -4.430 3.844 -2.459 1.00 . A A . 12 PHE CD1 1 1
20 4248 1 1 12 PHE CD2 C -3.185 1.825 -2.334 1.00 . A A . 12 PHE CD2 1 1
20 4249 1 1 12 PHE CE1 C -3.469 4.388 -3.284 1.00 . A A . 12 PHE CE1 1 1
20 4250 1 1 12 PHE CE2 C -2.225 2.361 -3.155 1.00 . A A . 12 PHE CE2 1 1
20 4251 1 1 12 PHE CG C -4.300 2.560 -1.976 1.00 . A A . 12 PHE CG 1 1
20 4252 1 1 12 PHE CZ C -2.366 3.645 -3.632 1.00 . A A . 12 PHE CZ 1 1
20 4253 1 1 12 PHE H H -3.788 0.540 0.685 1.00 . A A . 12 PHE H 1 1
20 4254 1 1 12 PHE HA H -5.034 3.200 0.647 1.00 . A A . 12 PHE HA 1 1
20 4255 1 1 12 PHE HB2 H -5.418 0.916 -1.305 1.00 . A A . 12 PHE HB2 1 1
20 4256 1 1 12 PHE HB3 H -6.299 2.433 -1.333 1.00 . A A . 12 PHE HB3 1 1
20 4257 1 1 12 PHE HD1 H -5.298 4.428 -2.183 1.00 . A A . 12 PHE HD1 1 1
20 4258 1 1 12 PHE HD2 H -3.066 0.818 -1.960 1.00 . A A . 12 PHE HD2 1 1
20 4259 1 1 12 PHE HE1 H -3.581 5.397 -3.657 1.00 . A A . 12 PHE HE1 1 1
20 4260 1 1 12 PHE HE2 H -1.356 1.777 -3.423 1.00 . A A . 12 PHE HE2 1 1
20 4261 1 1 12 PHE HZ H -1.610 4.066 -4.278 1.00 . A A . 12 PHE HZ 1 1
20 4262 1 1 12 PHE N N -3.873 1.513 0.801 1.00 . A A . 12 PHE N 1 1
20 4263 1 1 12 PHE O O -6.270 0.283 1.339 1.00 . A A . 12 PHE O 1 1
20 4264 1 1 13 PRO C C -9.349 0.960 1.626 1.00 . A A . 13 PRO C 1 1
20 4265 1 1 13 PRO CA C -8.376 1.850 2.431 1.00 . A A . 13 PRO CA 1 1
20 4266 1 1 13 PRO CB C -9.072 3.140 2.868 1.00 . A A . 13 PRO CB 1 1
20 4267 1 1 13 PRO CD C -7.261 3.796 1.451 1.00 . A A . 13 PRO CD 1 1
20 4268 1 1 13 PRO CG C -8.654 4.162 1.868 1.00 . A A . 13 PRO CG 1 1
20 4269 1 1 13 PRO HA H -8.049 1.301 3.301 1.00 . A A . 13 PRO HA 1 1
20 4270 1 1 13 PRO HB2 H -10.141 2.990 2.857 1.00 . A A . 13 PRO HB2 1 1
20 4271 1 1 13 PRO HB3 H -8.752 3.408 3.863 1.00 . A A . 13 PRO HB3 1 1
20 4272 1 1 13 PRO HD2 H -7.099 4.057 0.416 1.00 . A A . 13 PRO HD2 1 1
20 4273 1 1 13 PRO HD3 H -6.537 4.288 2.084 1.00 . A A . 13 PRO HD3 1 1
20 4274 1 1 13 PRO HG2 H -9.319 4.136 1.017 1.00 . A A . 13 PRO HG2 1 1
20 4275 1 1 13 PRO HG3 H -8.664 5.142 2.319 1.00 . A A . 13 PRO HG3 1 1
20 4276 1 1 13 PRO N N -7.216 2.328 1.641 1.00 . A A . 13 PRO N 1 1
20 4277 1 1 13 PRO O O -10.459 0.659 2.071 1.00 . A A . 13 PRO O 1 1
20 4278 1 1 14 ASN C C -9.214 -1.780 -0.121 1.00 . A A . 14 ASN C 1 1
20 4279 1 1 14 ASN CA C -9.695 -0.349 -0.374 1.00 . A A . 14 ASN CA 1 1
20 4280 1 1 14 ASN CB C -9.624 0.027 -1.882 1.00 . A A . 14 ASN CB 1 1
20 4281 1 1 14 ASN CG C -8.210 0.087 -2.472 1.00 . A A . 14 ASN CG 1 1
20 4282 1 1 14 ASN H H -8.079 0.916 0.128 1.00 . A A . 14 ASN H 1 1
20 4283 1 1 14 ASN HA H -10.718 -0.275 -0.037 1.00 . A A . 14 ASN HA 1 1
20 4284 1 1 14 ASN HB2 H -10.181 -0.705 -2.448 1.00 . A A . 14 ASN HB2 1 1
20 4285 1 1 14 ASN HB3 H -10.090 0.992 -2.018 1.00 . A A . 14 ASN HB3 1 1
20 4286 1 1 14 ASN HD21 H -8.768 1.516 -3.700 1.00 . A A . 14 ASN HD21 1 1
20 4287 1 1 14 ASN HD22 H -7.126 1.014 -3.844 1.00 . A A . 14 ASN HD22 1 1
20 4288 1 1 14 ASN N N -8.937 0.568 0.446 1.00 . A A . 14 ASN N 1 1
20 4289 1 1 14 ASN ND2 N -8.009 0.955 -3.425 1.00 . A A . 14 ASN ND2 1 1
20 4290 1 1 14 ASN O O -9.898 -2.759 -0.443 1.00 . A A . 14 ASN O 1 1
20 4291 1 1 14 ASN OD1 O -7.309 -0.626 -2.058 1.00 . A A . 14 ASN OD1 1 1
20 4292 2 2 1 . C C -1.725 -2.209 2.970 1.00 . B A . 101 WMH C 1 1
20 4293 2 2 1 . C1 C -0.663 -0.104 3.469 1.00 . B A . 101 WMH C1 1 1
20 4294 2 2 1 . C2 C 0.560 0.291 3.903 1.00 . B A . 101 WMH C2 1 1
20 4295 2 2 1 . H1 H -2.339 -2.488 3.808 1.00 . B A . 101 WMH H1 1 1
20 4296 2 2 1 . H2 H -2.332 -1.577 2.344 1.00 . B A . 101 WMH H2 1 1
20 4297 2 2 1 . H5 H 0.879 1.313 4.052 1.00 . B A . 101 WMH H5 1 1
20 4298 2 2 1 . N N -0.666 -1.409 3.408 1.00 . B A . 101 WMH N 1 1
20 4299 2 2 1 . N1 N 1.296 -0.793 4.112 1.00 . B A . 101 WMH N1 1 1
20 4300 2 2 1 . N2 N 0.604 -1.843 3.830 1.00 . B A . 101 WMH N2 1 1
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