NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
631127 |
5vl6   |
30287 | cing | 4-filtered-FRED | STAR | entry | full | 192 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5vl6
# This FRED archive file contains, for PDB entry <5vl6>:
#
# - 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_5vl6
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 5vl6
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1871.94
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 $Peptide_38138 A . 1 1
stop_
save_
save_Peptide_38138
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Peptide 38138"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code NVHTFRGDNVHNSSSSL
_Entity.Number_of_monomers 17
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 ASN . 1 1
2 VAL . 1 1
3 HIS . 1 1
4 THR . 1 1
5 PHE . 1 1
6 ARG . 1 1
7 GLY . 1 1
8 ASP . 1 1
9 ASN . 1 1
10 VAL . 1 1
11 HIS . 1 1
12 ASN . 1 1
13 SER . 1 1
14 SER . 1 1
15 SER . 1 1
16 SER . 1 1
17 LEU . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
ASN 1 1 1 1
VAL 2 2 1 1
HIS 3 3 1 1
THR 4 4 1 1
PHE 5 5 1 1
ARG 6 6 1 1
GLY 7 7 1 1
ASP 8 8 1 1
ASN 9 9 1 1
VAL 10 10 1 1
HIS 11 11 1 1
ASN 12 12 1 1
SER 13 13 1 1
SER 14 14 1 1
SER 15 15 1 1
SER 16 16 1 1
LEU 17 17 1 1
stop_
save_
save_Discover_distance_constraints_4_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
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11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
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15 1 . . . 1 1
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172 1 . . . 1 1
173 1 . . . 1 1
174 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 VAL H 1 2 VAL HN 1 1
1 1 2 1 1 2 VAL HA 1 2 VAL HA 1 1
2 1 1 1 1 3 HIS H 1 3 HIS HN 1 1
2 1 2 1 1 3 HIS HA 1 3 HIS HA 1 1
3 1 1 1 1 4 THR H 1 4 THR HN 1 1
3 1 2 1 1 4 THR HA 1 4 THR HA 1 1
4 1 1 1 1 5 PHE H 1 5 PHE HN 1 1
4 1 2 1 1 5 PHE HA 1 5 PHE HA 1 1
5 1 1 1 1 6 ARG H 1 6 ARG HN 1 1
5 1 2 1 1 6 ARG HA 1 6 ARG HA 1 1
6 1 1 1 1 8 ASP H 1 8 ASP HN 1 1
6 1 2 1 1 8 ASP HA 1 8 ASP HA 1 1
7 1 1 1 1 9 ASN H 1 9 ASN HN 1 1
7 1 2 1 1 9 ASN HA 1 9 ASN HA 1 1
8 1 1 1 1 10 VAL H 1 10 VAL HN 1 1
8 1 2 1 1 10 VAL HA 1 10 VAL HA 1 1
9 1 1 1 1 11 HIS H 1 11 HIS HN 1 1
9 1 2 1 1 11 HIS HA 1 11 HIS HA 1 1
10 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
10 1 2 1 1 12 ASN HA 1 12 ASN HA 1 1
11 1 1 1 1 13 SER H 1 13 SER HN 1 1
11 1 2 1 1 13 SER HA 1 13 SER HA 1 1
12 1 1 1 1 14 SER H 1 14 SER HN 1 1
12 1 2 1 1 14 SER HA 1 14 SER HA 1 1
13 1 1 1 1 15 SER H 1 15 SER HN 1 1
13 1 2 1 1 15 SER HA 1 15 SER HA 1 1
14 1 1 1 1 16 SER H 1 16 SER HN 1 1
14 1 2 1 1 16 SER HA 1 16 SER HA 1 1
15 1 1 1 1 17 LEU H 1 17 LEU HN 1 1
15 1 2 1 1 17 LEU HA 1 17 LEU HA 1 1
16 1 1 1 1 2 VAL H 1 2 VAL HN 1 1
16 1 2 1 1 2 VAL HB 1 2 VAL HB 1 1
17 1 1 1 1 2 VAL H 1 2 VAL HN 1 1
17 1 2 1 1 2 VAL QG 1 2 VAL HG* 1 1
18 1 1 1 1 2 VAL HA 1 2 VAL HA 1 1
18 1 2 1 1 2 VAL HB 1 2 VAL HB 1 1
19 1 1 1 1 2 VAL HA 1 2 VAL HA 1 1
19 1 2 1 1 2 VAL QG 1 2 VAL HG* 1 1
20 1 1 1 1 3 HIS H 1 3 HIS HN 1 1
20 1 2 1 1 3 HIS HB2 1 3 HIS HBS 1 1
21 1 1 1 1 3 HIS H 1 3 HIS HN 1 1
21 1 2 1 1 3 HIS HB3 1 3 HIS HBR 1 1
22 1 1 1 1 3 HIS HA 1 3 HIS HA 1 1
22 1 2 1 1 3 HIS HB2 1 3 HIS HBS 1 1
23 1 1 1 1 3 HIS HA 1 3 HIS HA 1 1
23 1 2 1 1 3 HIS HB3 1 3 HIS HBR 1 1
24 1 1 1 1 4 THR H 1 4 THR HN 1 1
24 1 2 1 1 4 THR HB 1 4 THR HB 1 1
25 1 1 1 1 4 THR H 1 4 THR HN 1 1
25 1 2 1 1 4 THR MG 1 4 THR HG2* 1 1
26 1 1 1 1 4 THR HA 1 4 THR HA 1 1
26 1 2 1 1 4 THR HB 1 4 THR HB 1 1
27 1 1 1 1 4 THR HA 1 4 THR HA 1 1
27 1 2 1 1 4 THR MG 1 4 THR HG2* 1 1
28 1 1 1 1 5 PHE H 1 5 PHE HN 1 1
28 1 2 1 1 5 PHE QB 1 5 PHE HB* 1 1
29 1 1 1 1 6 ARG H 1 6 ARG HN 1 1
29 1 2 1 1 6 ARG QB 1 6 ARG HB* 1 1
30 1 1 1 1 6 ARG H 1 6 ARG HN 1 1
30 1 2 1 1 6 ARG QG 1 6 ARG HG* 1 1
31 1 1 1 1 6 ARG H 1 6 ARG HN 1 1
31 1 2 1 1 6 ARG QD 1 6 ARG HD* 1 1
32 1 1 1 1 6 ARG HA 1 6 ARG HA 1 1
32 1 2 1 1 6 ARG QD 1 6 ARG HD* 1 1
33 1 1 1 1 6 ARG HA 1 6 ARG HA 1 1
33 1 2 1 1 6 ARG QG 1 6 ARG HG* 1 1
34 1 1 1 1 6 ARG QB 1 6 ARG HB* 1 1
34 1 2 1 1 6 ARG QD 1 6 ARG HD* 1 1
35 1 1 1 1 6 ARG QD 1 6 ARG HD* 1 1
35 1 2 1 1 6 ARG QH 1 6 ARG HH* 1 1
36 1 1 1 1 8 ASP H 1 8 ASP HN 1 1
36 1 2 1 1 8 ASP QB 1 8 ASP HB* 1 1
37 1 1 1 1 9 ASN H 1 9 ASN HN 1 1
37 1 2 1 1 9 ASN HB2 1 9 ASN HBS 1 1
38 1 1 1 1 9 ASN H 1 9 ASN HN 1 1
38 1 2 1 1 9 ASN HB3 1 9 ASN HBR 1 1
39 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
39 1 2 1 1 9 ASN HB2 1 9 ASN HBS 1 1
40 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
40 1 2 1 1 9 ASN HB3 1 9 ASN HBR 1 1
41 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
41 1 2 1 1 9 ASN HD21 1 9 ASN HD22 1 1
42 1 1 1 1 9 ASN HB2 1 9 ASN HBS 1 1
42 1 2 1 1 9 ASN HD21 1 9 ASN HD22 1 1
43 1 1 1 1 9 ASN HB3 1 9 ASN HBR 1 1
43 1 2 1 1 9 ASN HD21 1 9 ASN HD22 1 1
44 1 1 1 1 10 VAL H 1 10 VAL HN 1 1
44 1 2 1 1 10 VAL HB 1 10 VAL HB 1 1
45 1 1 1 1 10 VAL H 1 10 VAL HN 1 1
45 1 2 1 1 10 VAL QG 1 10 VAL HG* 1 1
46 1 1 1 1 10 VAL HA 1 10 VAL HA 1 1
46 1 2 1 1 10 VAL HB 1 10 VAL HB 1 1
47 1 1 1 1 10 VAL HA 1 10 VAL HA 1 1
47 1 2 1 1 10 VAL QG 1 10 VAL HG* 1 1
48 1 1 1 1 11 HIS H 1 11 HIS HN 1 1
48 1 2 1 1 11 HIS HB2 1 11 HIS HBS 1 1
49 1 1 1 1 11 HIS H 1 11 HIS HN 1 1
49 1 2 1 1 11 HIS HB3 1 11 HIS HBR 1 1
50 1 1 1 1 11 HIS HA 1 11 HIS HA 1 1
50 1 2 1 1 11 HIS HB2 1 11 HIS HBS 1 1
51 1 1 1 1 11 HIS HA 1 11 HIS HA 1 1
51 1 2 1 1 11 HIS HB3 1 11 HIS HBR 1 1
52 1 1 1 1 11 HIS HB2 1 11 HIS HBS 1 1
52 1 2 1 1 11 HIS HD2 1 11 HIS HD2 1 1
53 1 1 1 1 11 HIS HB3 1 11 HIS HBR 1 1
53 1 2 1 1 11 HIS HD2 1 11 HIS HD2 1 1
54 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
54 1 2 1 1 12 ASN QB 1 12 ASN HB* 1 1
55 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
55 1 2 1 1 12 ASN HD22 1 12 ASN HD22 1 1
56 1 1 1 1 13 SER HA 1 13 SER HA 1 1
56 1 2 1 1 13 SER HB2 1 13 SER HBS 1 1
57 1 1 1 1 13 SER HA 1 13 SER HA 1 1
57 1 2 1 1 13 SER HB3 1 13 SER HBR 1 1
58 1 1 1 1 13 SER H 1 13 SER HN 1 1
58 1 2 1 1 13 SER HB2 1 13 SER HBS 1 1
59 1 1 1 1 13 SER H 1 13 SER HN 1 1
59 1 2 1 1 13 SER HB3 1 13 SER HBR 1 1
60 1 1 1 1 14 SER HA 1 14 SER HA 1 1
60 1 2 1 1 14 SER HB2 1 14 SER HBS 1 1
61 1 1 1 1 14 SER HA 1 14 SER HA 1 1
61 1 2 1 1 14 SER HB3 1 14 SER HBR 1 1
62 1 1 1 1 14 SER H 1 14 SER HN 1 1
62 1 2 1 1 14 SER HB2 1 14 SER HBS 1 1
63 1 1 1 1 14 SER H 1 14 SER HN 1 1
63 1 2 1 1 14 SER HB3 1 14 SER HBR 1 1
64 1 1 1 1 15 SER HA 1 15 SER HA 1 1
64 1 2 1 1 15 SER HB2 1 15 SER HBS 1 1
65 1 1 1 1 15 SER HA 1 15 SER HA 1 1
65 1 2 1 1 15 SER HB3 1 15 SER HBR 1 1
66 1 1 1 1 15 SER H 1 15 SER HN 1 1
66 1 2 1 1 15 SER HB2 1 15 SER HBS 1 1
67 1 1 1 1 15 SER H 1 15 SER HN 1 1
67 1 2 1 1 15 SER HB3 1 15 SER HBR 1 1
68 1 1 1 1 16 SER HA 1 16 SER HA 1 1
68 1 2 1 1 16 SER HB2 1 16 SER HBS 1 1
69 1 1 1 1 16 SER HA 1 16 SER HA 1 1
69 1 2 1 1 16 SER HB3 1 16 SER HBR 1 1
70 1 1 1 1 16 SER H 1 16 SER HN 1 1
70 1 2 1 1 16 SER HB2 1 16 SER HBS 1 1
71 1 1 1 1 16 SER H 1 16 SER HN 1 1
71 1 2 1 1 16 SER HB3 1 16 SER HBR 1 1
72 1 1 1 1 17 LEU H 1 17 LEU HN 1 1
72 1 2 1 1 17 LEU QB 1 17 LEU HB* 1 1
73 1 1 1 1 17 LEU H 1 17 LEU HN 1 1
73 1 2 1 1 17 LEU HG 1 17 LEU HG 1 1
74 1 1 1 1 17 LEU H 1 17 LEU HN 1 1
74 1 2 1 1 17 LEU QD 1 17 LEU HD* 1 1
75 1 1 1 1 17 LEU HA 1 17 LEU HA 1 1
75 1 2 1 1 17 LEU HG 1 17 LEU HG 1 1
76 1 1 1 1 17 LEU HA 1 17 LEU HA 1 1
76 1 2 1 1 17 LEU QD 1 17 LEU HD* 1 1
77 1 1 1 1 2 VAL H 1 2 VAL HN 1 1
77 1 2 1 1 3 HIS H 1 3 HIS HN 1 1
78 1 1 1 1 3 HIS H 1 3 HIS HN 1 1
78 1 2 1 1 4 THR H 1 4 THR HN 1 1
79 1 1 1 1 4 THR H 1 4 THR HN 1 1
79 1 2 1 1 5 PHE H 1 5 PHE HN 1 1
80 1 1 1 1 5 PHE H 1 5 PHE HN 1 1
80 1 2 1 1 6 ARG H 1 6 ARG HN 1 1
81 1 1 1 1 6 ARG H 1 6 ARG HN 1 1
81 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
82 1 1 1 1 7 GLY H 1 7 GLY HN 1 1
82 1 2 1 1 8 ASP H 1 8 ASP HN 1 1
83 1 1 1 1 8 ASP H 1 8 ASP HN 1 1
83 1 2 1 1 9 ASN H 1 9 ASN HN 1 1
84 1 1 1 1 9 ASN H 1 9 ASN HN 1 1
84 1 2 1 1 10 VAL H 1 10 VAL HN 1 1
85 1 1 1 1 10 VAL H 1 10 VAL HN 1 1
85 1 2 1 1 11 HIS H 1 11 HIS HN 1 1
86 1 1 1 1 11 HIS H 1 11 HIS HN 1 1
86 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
87 1 1 1 1 12 ASN H 1 12 ASN HN 1 1
87 1 2 1 1 13 SER H 1 13 SER HN 1 1
88 1 1 1 1 13 SER H 1 13 SER HN 1 1
88 1 2 1 1 14 SER H 1 14 SER HN 1 1
89 1 1 1 1 14 SER H 1 14 SER HN 1 1
89 1 2 1 1 15 SER H 1 15 SER HN 1 1
90 1 1 1 1 15 SER H 1 15 SER HN 1 1
90 1 2 1 1 16 SER H 1 16 SER HN 1 1
91 1 1 1 1 16 SER H 1 16 SER HN 1 1
91 1 2 1 1 17 LEU H 1 17 LEU HN 1 1
92 1 1 1 1 1 ASN HA 1 1 ASN HA 1 1
92 1 2 1 1 2 VAL H 1 2 VAL HN 1 1
93 1 1 1 1 2 VAL HA 1 2 VAL HA 1 1
93 1 2 1 1 3 HIS H 1 3 HIS HN 1 1
94 1 1 1 1 3 HIS HA 1 3 HIS HA 1 1
94 1 2 1 1 4 THR H 1 4 THR HN 1 1
95 1 1 1 1 4 THR HA 1 4 THR HA 1 1
95 1 2 1 1 5 PHE H 1 5 PHE HN 1 1
96 1 1 1 1 5 PHE HA 1 5 PHE HA 1 1
96 1 2 1 1 6 ARG H 1 6 ARG HN 1 1
97 1 1 1 1 6 ARG HA 1 6 ARG HA 1 1
97 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
98 1 1 1 1 7 GLY QA 1 7 GLY HA* 1 1
98 1 2 1 1 8 ASP H 1 8 ASP HN 1 1
99 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1
99 1 2 1 1 9 ASN H 1 9 ASN HN 1 1
100 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
100 1 2 1 1 10 VAL H 1 10 VAL HN 1 1
101 1 1 1 1 10 VAL HA 1 10 VAL HA 1 1
101 1 2 1 1 11 HIS H 1 11 HIS HN 1 1
102 1 1 1 1 11 HIS HA 1 11 HIS HA 1 1
102 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
103 1 1 1 1 13 SER HA 1 13 SER HA 1 1
103 1 2 1 1 14 SER H 1 14 SER HN 1 1
104 1 1 1 1 14 SER HA 1 14 SER HA 1 1
104 1 2 1 1 15 SER H 1 15 SER HN 1 1
105 1 1 1 1 15 SER HA 1 15 SER HA 1 1
105 1 2 1 1 16 SER H 1 16 SER HN 1 1
106 1 1 1 1 16 SER HA 1 16 SER HA 1 1
106 1 2 1 1 17 LEU H 1 17 LEU HN 1 1
107 1 1 1 1 1 ASN QB 1 1 ASN HB* 1 1
107 1 2 1 1 2 VAL H 1 2 VAL HN 1 1
108 1 1 1 1 2 VAL HB 1 2 VAL HB 1 1
108 1 2 1 1 3 HIS H 1 3 HIS HN 1 1
109 1 1 1 1 2 VAL QG 1 2 VAL HG* 1 1
109 1 2 1 1 3 HIS H 1 3 HIS HN 1 1
110 1 1 1 1 3 HIS HB2 1 3 HIS HBS 1 1
110 1 2 1 1 4 THR H 1 4 THR HN 1 1
111 1 1 1 1 3 HIS HB3 1 3 HIS HBR 1 1
111 1 2 1 1 4 THR H 1 4 THR HN 1 1
112 1 1 1 1 4 THR HB 1 4 THR HB 1 1
112 1 2 1 1 5 PHE H 1 5 PHE HN 1 1
113 1 1 1 1 4 THR HG1 1 4 THR HG* 1 1
113 1 1 1 1 4 THR MG 1 4 THR HG* 1 1
113 1 2 1 1 5 PHE H 1 5 PHE HN 1 1
114 1 1 1 1 5 PHE QB 1 5 PHE HB* 1 1
114 1 2 1 1 6 ARG H 1 6 ARG HN 1 1
115 1 1 1 1 6 ARG QB 1 6 ARG HB* 1 1
115 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
116 1 1 1 1 6 ARG QG 1 6 ARG HG* 1 1
116 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
117 1 1 1 1 8 ASP QB 1 8 ASP HB* 1 1
117 1 2 1 1 9 ASN H 1 9 ASN HN 1 1
118 1 1 1 1 9 ASN HB2 1 9 ASN HBS 1 1
118 1 2 1 1 10 VAL H 1 10 VAL HN 1 1
119 1 1 1 1 9 ASN HB3 1 9 ASN HBR 1 1
119 1 2 1 1 10 VAL H 1 10 VAL HN 1 1
120 1 1 1 1 10 VAL HB 1 10 VAL HB 1 1
120 1 2 1 1 11 HIS H 1 11 HIS HN 1 1
121 1 1 1 1 10 VAL QG 1 10 VAL HG* 1 1
121 1 2 1 1 11 HIS H 1 11 HIS HN 1 1
122 1 1 1 1 11 HIS HB2 1 11 HIS HBS 1 1
122 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
123 1 1 1 1 11 HIS HB3 1 11 HIS HBR 1 1
123 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
124 1 1 1 1 12 ASN QB 1 12 ASN HB* 1 1
124 1 2 1 1 13 SER H 1 13 SER HN 1 1
125 1 1 1 1 13 SER HB2 1 13 SER HBS 1 1
125 1 2 1 1 14 SER H 1 14 SER HN 1 1
126 1 1 1 1 13 SER HB3 1 13 SER HBR 1 1
126 1 2 1 1 14 SER H 1 14 SER HN 1 1
127 1 1 1 1 14 SER HB2 1 14 SER HBS 1 1
127 1 2 1 1 15 SER H 1 15 SER HN 1 1
128 1 1 1 1 14 SER HB3 1 14 SER HBR 1 1
128 1 2 1 1 15 SER H 1 15 SER HN 1 1
129 1 1 1 1 15 SER HB2 1 15 SER HBS 1 1
129 1 2 1 1 16 SER H 1 16 SER HN 1 1
130 1 1 1 1 15 SER HB3 1 15 SER HBR 1 1
130 1 2 1 1 16 SER H 1 16 SER HN 1 1
131 1 1 1 1 16 SER HB2 1 16 SER HBS 1 1
131 1 2 1 1 17 LEU H 1 17 LEU HN 1 1
132 1 1 1 1 16 SER HB3 1 16 SER HBR 1 1
132 1 2 1 1 17 LEU H 1 17 LEU HN 1 1
133 1 1 1 1 5 PHE HA 1 5 PHE HA 1 1
133 1 2 1 1 6 ARG QG 1 6 ARG HG* 1 1
134 1 1 1 1 2 VAL QG 1 2 VAL HG* 1 1
134 1 2 1 1 3 HIS HA 1 3 HIS HA 1 1
135 1 1 1 1 1 ASN HA 1 1 ASN HA 1 1
135 1 2 1 1 3 HIS H 1 3 HIS HN 1 1
136 1 1 1 1 2 VAL HA 1 2 VAL HA 1 1
136 1 2 1 1 4 THR H 1 4 THR HN 1 1
137 1 1 1 1 3 HIS HA 1 3 HIS HA 1 1
137 1 2 1 1 5 PHE H 1 5 PHE HN 1 1
138 1 1 1 1 4 THR HA 1 4 THR HA 1 1
138 1 2 1 1 6 ARG H 1 6 ARG HN 1 1
139 1 1 1 1 5 PHE HA 1 5 PHE HA 1 1
139 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
140 1 1 1 1 6 ARG HA 1 6 ARG HA 1 1
140 1 2 1 1 8 ASP H 1 8 ASP HN 1 1
141 1 1 1 1 7 GLY QA 1 7 GLY HA* 1 1
141 1 2 1 1 9 ASN H 1 9 ASN HN 1 1
142 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1
142 1 2 1 1 10 VAL H 1 10 VAL HN 1 1
143 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
143 1 2 1 1 11 HIS H 1 11 HIS HN 1 1
144 1 1 1 1 10 VAL HA 1 10 VAL HA 1 1
144 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
145 1 1 1 1 11 HIS HA 1 11 HIS HA 1 1
145 1 2 1 1 13 SER H 1 13 SER HN 1 1
146 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
146 1 2 1 1 14 SER H 1 14 SER HN 1 1
147 1 1 1 1 13 SER HA 1 13 SER HA 1 1
147 1 2 1 1 15 SER H 1 15 SER HN 1 1
148 1 1 1 1 14 SER HA 1 14 SER HA 1 1
148 1 2 1 1 16 SER H 1 16 SER HN 1 1
149 1 1 1 1 15 SER HA 1 15 SER HA 1 1
149 1 2 1 1 17 LEU H 1 17 LEU HN 1 1
150 1 1 1 1 1 ASN HA 1 1 ASN HA 1 1
150 1 2 1 1 4 THR H 1 4 THR HN 1 1
151 1 1 1 1 2 VAL HA 1 2 VAL HA 1 1
151 1 2 1 1 5 PHE H 1 5 PHE HN 1 1
152 1 1 1 1 3 HIS HA 1 3 HIS HA 1 1
152 1 2 1 1 6 ARG H 1 6 ARG HN 1 1
153 1 1 1 1 4 THR HA 1 4 THR HA 1 1
153 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
154 1 1 1 1 5 PHE HA 1 5 PHE HA 1 1
154 1 2 1 1 8 ASP H 1 8 ASP HN 1 1
155 1 1 1 1 6 ARG HA 1 6 ARG HA 1 1
155 1 2 1 1 9 ASN H 1 9 ASN HN 1 1
156 1 1 1 1 7 GLY QA 1 7 GLY HA* 1 1
156 1 2 1 1 10 VAL H 1 10 VAL HN 1 1
157 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1
157 1 2 1 1 11 HIS H 1 11 HIS HN 1 1
158 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
158 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
159 1 1 1 1 10 VAL HA 1 10 VAL HA 1 1
159 1 2 1 1 13 SER H 1 13 SER HN 1 1
160 1 1 1 1 11 HIS HA 1 11 HIS HA 1 1
160 1 2 1 1 14 SER H 1 14 SER HN 1 1
161 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1
161 1 2 1 1 15 SER H 1 15 SER HN 1 1
162 1 1 1 1 13 SER HA 1 13 SER HA 1 1
162 1 2 1 1 16 SER H 1 16 SER HN 1 1
163 1 1 1 1 14 SER HA 1 14 SER HA 1 1
163 1 2 1 1 17 LEU H 1 17 LEU HN 1 1
164 1 1 1 1 3 HIS HA 1 3 HIS HA 1 1
164 1 2 1 1 7 GLY H 1 7 GLY HN 1 1
165 1 1 1 1 4 THR HA 1 4 THR HA 1 1
165 1 2 1 1 8 ASP H 1 8 ASP HN 1 1
166 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1
166 1 2 1 1 12 ASN H 1 12 ASN HN 1 1
167 1 1 1 1 9 ASN HA 1 9 ASN HA 1 1
167 1 2 1 1 13 SER H 1 13 SER HN 1 1
168 1 1 1 1 10 VAL HA 1 10 VAL HA 1 1
168 1 2 1 1 14 SER H 1 14 SER HN 1 1
169 1 1 1 1 11 HIS HA 1 11 HIS HA 1 1
169 1 2 1 1 15 SER H 1 15 SER HN 1 1
170 1 1 1 1 2 VAL HB 1 2 VAL HB 1 1
170 1 2 1 1 5 PHE HA 1 5 PHE HA 1 1
171 1 1 1 1 5 PHE QB 1 5 PHE HB* 1 1
171 1 2 1 1 8 ASP HA 1 8 ASP HA 1 1
172 1 1 1 1 8 ASP QB 1 8 ASP HB* 1 1
172 1 2 1 1 11 HIS HA 1 11 HIS HA 1 1
173 1 1 1 1 10 VAL HB 1 10 VAL HB 1 1
173 1 2 1 1 13 SER HA 1 13 SER HA 1 1
174 1 1 1 1 12 ASN QB 1 12 ASN HB* 1 1
174 1 2 1 1 15 SER HA 1 15 SER HA 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 . . . . . 2.8 1.8 2.8 1 1
2 1 . . . . . 2.8 1.8 2.8 1 1
3 1 . . . . . 2.8 1.8 2.8 1 1
4 1 . . . . . 2.8 1.8 2.8 1 1
5 1 . . . . . 2.8 1.8 2.8 1 1
6 1 . . . . . 2.8 1.8 3.8 1 1
7 1 . . . . . 2.8 1.8 2.8 1 1
8 1 . . . . . 2.8 1.8 3.8 1 1
9 1 . . . . . 2.8 1.8 3.8 1 1
10 1 . . . . . 2.8 1.8 3.8 1 1
11 1 . . . . . 2.8 1.8 2.8 1 1
12 1 . . . . . 2.8 1.8 2.8 1 1
13 1 . . . . . 3.5 2.8 3.5 1 1
14 1 . . . . . 3.5 2.8 3.5 1 1
15 1 . . . . . 3.5 2.8 3.5 1 1
16 1 . . . . . 2.8 1.8 2.8 1 1
17 1 . . . . . 2.8 1.8 5.2 1 1
18 1 . . . . . 3.5 2.8 3.5 1 1
19 1 . . . . . 3.5 2.8 5.9 1 1
20 1 . . . . . 2.8 1.8 2.8 1 1
21 1 . . . . . 2.8 1.8 2.8 1 1
22 1 . . . . . 3.5 2.8 3.5 1 1
23 1 . . . . . 3.5 2.8 3.5 1 1
24 1 . . . . . 3.5 2.8 3.5 1 1
25 1 . . . . . 3.5 2.8 3.5 1 1
26 1 . . . . . 2.8 1.8 3.8 1 1
27 1 . . . . . 3.5 2.8 4.5 1 1
28 1 . . . . . 2.8 1.8 3.8 1 1
29 1 . . . . . 2.8 1.8 3.8 1 1
30 1 . . . . . 2.8 1.8 3.8 1 1
31 1 . . . . . 3.5 3.5 4.5 1 1
32 1 . . . . . 3.5 3.5 4.5 1 1
33 1 . . . . . 3.5 2.8 4.5 1 1
34 1 . . . . . 3.5 2.8 5.5 1 1
35 1 . . . . . 2.8 1.8 6.2 1 1
36 1 . . . . . 2.8 1.8 3.8 1 1
37 1 . . . . . 2.8 1.8 2.8 1 1
38 1 . . . . . 3.5 2.8 5.5 1 1
39 1 . . . . . 2.8 1.8 2.8 1 1
40 1 . . . . . 3.5 2.8 3.5 1 1
41 1 . . . . . 2.8 1.8 2.8 1 1
42 1 . . . . . 2.8 1.8 2.8 1 1
43 1 . . . . . 3.5 2.8 3.5 1 1
44 1 . . . . . 3.5 2.8 3.5 1 1
45 1 . . . . . 2.8 1.8 5.2 1 1
46 1 . . . . . 2.8 1.8 5.2 1 1
47 1 . . . . . 3.5 2.8 5.9 1 1
48 1 . . . . . 3.5 2.8 5.9 1 1
49 1 . . . . . 3.5 2.8 5.9 1 1
50 1 . . . . . 3.5 2.8 3.5 1 1
51 1 . . . . . 3.5 2.8 3.5 1 1
52 1 . . . . . 2.8 1.8 2.8 1 1
53 1 . . . . . 2.8 1.8 2.8 1 1
54 1 . . . . . 3.5 2.8 4.5 1 1
55 1 . . . . . 3.5 2.8 3.5 1 1
56 1 . . . . . 2.8 1.8 2.8 1 1
57 1 . . . . . 3.5 2.8 5.5 1 1
58 1 . . . . . 3.5 2.8 5.5 1 1
59 1 . . . . . 3.5 2.8 3.5 1 1
60 1 . . . . . 3.5 2.8 3.5 1 1
61 1 . . . . . 3.5 2.8 3.5 1 1
62 1 . . . . . 3.5 2.8 3.5 1 1
63 1 . . . . . 3.5 2.8 3.5 1 1
64 1 . . . . . 3.5 2.8 3.5 1 1
65 1 . . . . . 3.5 2.8 3.5 1 1
66 1 . . . . . 3.5 2.8 3.5 1 1
67 1 . . . . . 3.5 3.5 4.5 1 1
68 1 . . . . . 3.5 2.8 3.5 1 1
69 1 . . . . . 3.5 2.8 3.5 1 1
70 1 . . . . . 3.5 2.8 3.5 1 1
71 1 . . . . . 3.5 2.8 3.5 1 1
72 1 . . . . . 3.5 2.8 4.5 1 1
73 1 . . . . . 3.5 2.8 3.5 1 1
74 1 . . . . . 3.5 2.8 5.9 1 1
75 1 . . . . . 2.8 1.8 3.8 1 1
76 1 . . . . . 3.5 2.8 5.9 1 1
77 1 . . . . . 2.8 1.8 2.8 1 1
78 1 . . . . . 2.8 1.8 2.8 1 1
79 1 . . . . . 2.8 1.8 2.8 1 1
80 1 . . . . . 2.8 1.8 2.8 1 1
81 1 . . . . . 2.8 1.8 2.8 1 1
82 1 . . . . . 2.8 1.8 2.8 1 1
83 1 . . . . . 2.8 1.8 2.8 1 1
84 1 . . . . . 3.5 2.8 3.5 1 1
85 1 . . . . . 2.8 1.8 2.8 1 1
86 1 . . . . . 3.5 2.8 3.5 1 1
87 1 . . . . . 2.8 1.8 2.8 1 1
88 1 . . . . . 2.8 1.8 2.8 1 1
89 1 . . . . . 3.5 2.8 3.5 1 1
90 1 . . . . . 3.5 2.8 3.5 1 1
91 1 . . . . . 2.8 1.8 2.8 1 1
92 1 . . . . . 3.5 2.8 3.5 1 1
93 1 . . . . . 3.5 2.8 3.5 1 1
94 1 . . . . . 3.5 2.8 3.5 1 1
95 1 . . . . . 3.5 2.8 3.5 1 1
96 1 . . . . . 3.5 2.8 3.5 1 1
97 1 . . . . . 2.8 1.8 2.8 1 1
98 1 . . . . . 3.5 2.8 4.5 1 1
99 1 . . . . . 3.5 2.8 3.5 1 1
100 1 . . . . . 3.5 2.8 3.5 1 1
101 1 . . . . . 2.8 1.8 3.8 1 1
102 1 . . . . . 3.5 2.8 3.5 1 1
103 1 . . . . . 2.8 1.8 3.8 1 1
104 1 . . . . . 3.5 2.8 3.5 1 1
105 1 . . . . . 3.5 2.8 3.5 1 1
106 1 . . . . . 3.5 2.8 3.5 1 1
107 1 . . . . . 3.5 2.8 4.5 1 1
108 1 . . . . . 2.8 1.8 2.8 1 1
109 1 . . . . . 2.8 1.8 5.2 1 1
110 1 . . . . . 5.5 3.5 5.5 1 1
111 1 . . . . . 3.5 2.8 3.5 1 1
112 1 . . . . . 5.5 3.5 5.5 1 1
113 1 . . . . . 5.5 3.5 5.5 1 1
114 1 . . . . . 3.5 2.8 4.5 1 1
115 1 . . . . . 3.5 2.8 4.5 1 1
116 1 . . . . . 3.5 3.5 4.5 1 1
117 1 . . . . . 5.5 2.8 5.5 1 1
118 1 . . . . . 5.5 3.5 5.5 1 1
119 1 . . . . . 5.5 3.5 5.5 1 1
120 1 . . . . . 5.5 3.5 5.5 1 1
121 1 . . . . . 3.5 2.8 5.9 1 1
122 1 . . . . . 5.5 3.5 5.5 1 1
123 1 . . . . . 5.5 3.5 5.5 1 1
124 1 . . . . . 3.5 2.8 4.5 1 1
125 1 . . . . . 5.5 3.5 5.5 1 1
126 1 . . . . . 5.5 3.5 5.5 1 1
127 1 . . . . . 5.5 3.5 5.5 1 1
128 1 . . . . . 5.5 3.5 5.5 1 1
129 1 . . . . . 5.5 3.5 5.5 1 1
130 1 . . . . . 3.5 2.8 3.5 1 1
131 1 . . . . . 3.5 2.8 3.5 1 1
132 1 . . . . . 3.5 2.8 3.5 1 1
133 1 . . . . . 3.5 3.5 4.5 1 1
134 1 . . . . . 3.5 3.5 5.9 1 1
135 1 . . . . . 3.5 3.5 4.5 1 1
136 1 . . . . . 3.5 3.5 4.5 1 1
137 1 . . . . . 5.5 3.5 5.5 1 1
138 1 . . . . . 3.5 3.5 4.5 1 1
139 1 . . . . . 3.5 3.5 4.5 1 1
140 1 . . . . . 3.5 3.5 4.5 1 1
141 1 . . . . . 3.5 3.5 4.5 1 1
142 1 . . . . . 3.5 3.5 4.5 1 1
143 1 . . . . . 3.5 3.5 4.5 1 1
144 1 . . . . . 3.5 3.5 4.5 1 1
145 1 . . . . . 3.5 3.5 4.5 1 1
146 1 . . . . . 5.5 3.5 5.5 1 1
147 1 . . . . . 3.5 3.5 4.5 1 1
148 1 . . . . . 5.5 3.5 5.5 1 1
149 1 . . . . . 5.5 3.5 5.5 1 1
150 1 . . . . . 5.5 3.5 5.5 1 1
151 1 . . . . . 5.5 3.5 5.5 1 1
152 1 . . . . . 5.5 3.5 5.5 1 1
153 1 . . . . . 5.5 3.5 5.5 1 1
154 1 . . . . . 5.5 3.5 5.5 1 1
155 1 . . . . . 5.5 3.5 5.5 1 1
156 1 . . . . . 3.5 3.5 4.5 1 1
157 1 . . . . . 5.5 3.5 5.5 1 1
158 1 . . . . . 5.5 3.5 5.5 1 1
159 1 . . . . . 3.5 3.5 4.5 1 1
160 1 . . . . . 5.5 3.5 5.5 1 1
161 1 . . . . . 3.5 3.5 4.5 1 1
162 1 . . . . . 3.5 3.5 4.5 1 1
163 1 . . . . . 3.5 3.5 4.5 1 1
164 1 . . . . . 5.5 3.5 5.5 1 1
165 1 . . . . . 3.5 3.5 4.5 1 1
166 1 . . . . . 3.5 3.5 4.5 1 1
167 1 . . . . . 3.5 3.5 4.5 1 1
168 1 . . . . . 3.5 3.5 4.5 1 1
169 1 . . . . . 3.5 3.5 4.5 1 1
170 1 . . . . . 5.5 3.5 6.5 1 1
171 1 . . . . . 5.5 3.5 6.5 1 1
172 1 . . . . . 5.5 3.5 6.5 1 1
173 1 . . . . . 5.5 3.5 6.5 1 1
174 1 . . . . . 5.5 3.5 6.5 1 1
stop_
save_
save_Discover_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 10 VAL O 1 10 VAL O 1 2
1 1 2 1 1 14 SER H 1 14 SER HN 1 2
2 1 1 1 1 13 SER O 1 13 SER O 1 2
2 1 2 1 1 17 LEU H 1 17 LEU HN 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.8 2.5 1 2
2 1 . . . . . . 1.8 2.5 1 2
stop_
save_
save_Discover_dihedral_5
_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 1 ASN CA 1 1 1 ASN C 1 1 2 VAL N 1 1 2 VAL CA 178.0 179.99998 1 1 ASN CA 1 1 ASN C 1 2 VAL N 1 2 VAL CA 1 1
2 . 1 1 2 VAL CA 1 1 2 VAL C 1 1 3 HIS N 1 1 3 HIS CA 178.0 179.99998 1 2 VAL CA 1 2 VAL C 1 3 HIS N 1 3 HIS CA 1 1
3 . 1 1 3 HIS CA 1 1 3 HIS C 1 1 4 THR N 1 1 4 THR CA 178.0 179.99998 1 3 HIS CA 1 3 HIS C 1 4 THR N 1 4 THR CA 1 1
4 . 1 1 4 THR CA 1 1 4 THR C 1 1 5 PHE N 1 1 5 PHE CA 178.0 179.99998 1 4 THR CA 1 4 THR C 1 5 PHE N 1 5 PHE CA 1 1
5 . 1 1 5 PHE CA 1 1 5 PHE C 1 1 6 ARG N 1 1 6 ARG CA 178.0 179.99998 1 5 PHE CA 1 5 PHE C 1 6 ARG N 1 6 ARG CA 1 1
6 . 1 1 6 ARG CA 1 1 6 ARG C 1 1 7 GLY N 1 1 7 GLY CA 178.0 179.99998 1 6 ARG CA 1 6 ARG C 1 7 GLY N 1 7 GLY CA 1 1
7 . 1 1 7 GLY CA 1 1 7 GLY C 1 1 8 ASP N 1 1 8 ASP CA 178.0 179.99998 1 7 GLY CA 1 7 GLY C 1 8 ASP N 1 8 ASP CA 1 1
8 . 1 1 8 ASP CA 1 1 8 ASP C 1 1 9 ASN N 1 1 9 ASN CA 178.0 179.99998 1 8 ASP CA 1 8 ASP C 1 9 ASN N 1 9 ASN CA 1 1
9 . 1 1 9 ASN CA 1 1 9 ASN C 1 1 10 VAL N 1 1 10 VAL CA 178.0 179.99998 1 9 ASN CA 1 9 ASN C 1 10 VAL N 1 10 VAL CA 1 1
10 . 1 1 10 VAL CA 1 1 10 VAL C 1 1 11 HIS N 1 1 11 HIS CA 178.0 179.99998 1 10 VAL CA 1 10 VAL C 1 11 HIS N 1 11 HIS CA 1 1
11 . 1 1 11 HIS CA 1 1 11 HIS C 1 1 12 ASN N 1 1 12 ASN CA 178.0 179.99998 1 11 HIS CA 1 11 HIS C 1 12 ASN N 1 12 ASN CA 1 1
12 . 1 1 12 ASN CA 1 1 12 ASN C 1 1 13 SER N 1 1 13 SER CA 178.0 179.99998 1 12 ASN CA 1 12 ASN C 1 13 SER N 1 13 SER CA 1 1
13 . 1 1 13 SER CA 1 1 13 SER C 1 1 14 SER N 1 1 14 SER CA 178.0 179.99998 1 13 SER CA 1 13 SER C 1 14 SER N 1 14 SER CA 1 1
14 . 1 1 14 SER CA 1 1 14 SER C 1 1 15 SER N 1 1 15 SER CA 178.0 179.99998 1 14 SER CA 1 14 SER C 1 15 SER N 1 15 SER CA 1 1
15 . 1 1 15 SER CA 1 1 15 SER C 1 1 16 SER N 1 1 16 SER CA 178.0 179.99998 1 15 SER CA 1 15 SER C 1 16 SER N 1 16 SER CA 1 1
16 . 1 1 16 SER CA 1 1 16 SER C 1 1 17 LEU N 1 1 17 LEU CA 178.0 179.99998 1 16 SER CA 1 16 SER C 1 17 LEU N 1 17 LEU CA 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 ASN C C -9.286 -1.596 -0.259 1.00 . A A . 1 ASN C 1 1
1 2 1 1 1 ASN CA C -9.675 -3.081 0.025 1.00 . A A . 1 ASN CA 1 1
1 3 1 1 1 ASN CB C -11.195 -3.374 -0.338 1.00 . A A . 1 ASN CB 1 1
1 4 1 1 1 ASN CG C -12.271 -2.664 0.523 1.00 . A A . 1 ASN CG 1 1
1 5 1 1 1 ASN H1 H -8.370 -3.331 1.605 1.00 . A A . 1 ASN H1 1 1
1 6 1 1 1 ASN H2 H -9.499 -4.527 1.487 1.00 . A A . 1 ASN H2 1 1
1 7 1 1 1 ASN H3 H -9.925 -3.046 2.074 1.00 . A A . 1 ASN H3 1 1
1 8 1 1 1 ASN HA H -9.075 -3.690 -0.651 1.00 . A A . 1 ASN HA 1 1
1 9 1 1 1 ASN HB2 H -11.350 -3.072 -1.374 1.00 . A A . 1 ASN HB2 1 1
1 10 1 1 1 ASN HB3 H -11.360 -4.449 -0.269 1.00 . A A . 1 ASN HB3 1 1
1 11 1 1 1 ASN HD21 H -12.818 -1.432 -0.992 1.00 . A A . 1 ASN HD21 1 1
1 12 1 1 1 ASN HD22 H -13.694 -1.219 0.508 1.00 . A A . 1 ASN HD22 1 1
1 13 1 1 1 ASN N N -9.340 -3.533 1.410 1.00 . A A . 1 ASN N 1 1
1 14 1 1 1 ASN ND2 N -12.984 -1.695 -0.031 1.00 . A A . 1 ASN ND2 1 1
1 15 1 1 1 ASN O O -8.748 -1.311 -1.333 1.00 . A A . 1 ASN O 1 1
1 16 1 1 1 ASN OD1 O -12.472 -2.991 1.693 1.00 . A A . 1 ASN OD1 1 1
1 17 1 1 2 VAL C C -7.725 1.147 0.780 1.00 . A A . 2 VAL C 1 1
1 18 1 1 2 VAL CA C -9.241 0.782 0.531 1.00 . A A . 2 VAL CA 1 1
1 19 1 1 2 VAL CB C -10.091 1.670 1.496 1.00 . A A . 2 VAL CB 1 1
1 20 1 1 2 VAL CG1 C -10.355 3.089 0.939 1.00 . A A . 2 VAL CG1 1 1
1 21 1 1 2 VAL CG2 C -11.443 1.132 2.040 1.00 . A A . 2 VAL CG2 1 1
1 22 1 1 2 VAL H H -10.004 -0.963 1.525 1.00 . A A . 2 VAL H 1 1
1 23 1 1 2 VAL HA H -9.487 1.075 -0.490 1.00 . A A . 2 VAL HA 1 1
1 24 1 1 2 VAL HB H -9.465 1.818 2.376 1.00 . A A . 2 VAL HB 1 1
1 25 1 1 2 VAL HG11 H -9.427 3.504 0.546 1.00 . A A . 2 VAL HG11 1 1
1 26 1 1 2 VAL HG12 H -10.729 3.729 1.738 1.00 . A A . 2 VAL HG12 1 1
1 27 1 1 2 VAL HG13 H -11.095 3.034 0.141 1.00 . A A . 2 VAL HG13 1 1
1 28 1 1 2 VAL HG21 H -11.300 0.130 2.443 1.00 . A A . 2 VAL HG21 1 1
1 29 1 1 2 VAL HG22 H -11.806 1.792 2.828 1.00 . A A . 2 VAL HG22 1 1
1 30 1 1 2 VAL HG23 H -12.172 1.097 1.231 1.00 . A A . 2 VAL HG23 1 1
1 31 1 1 2 VAL N N -9.556 -0.661 0.672 1.00 . A A . 2 VAL N 1 1
1 32 1 1 2 VAL O O -7.321 2.255 0.435 1.00 . A A . 2 VAL O 1 1
1 33 1 1 3 HIS C C -4.693 0.939 0.466 1.00 . A A . 3 HIS C 1 1
1 34 1 1 3 HIS CA C -5.470 0.517 1.760 1.00 . A A . 3 HIS CA 1 1
1 35 1 1 3 HIS CB C -4.919 -0.733 2.507 1.00 . A A . 3 HIS CB 1 1
1 36 1 1 3 HIS CD2 C -2.764 -1.446 3.783 1.00 . A A . 3 HIS CD2 1 1
1 37 1 1 3 HIS CE1 C -1.950 0.454 4.154 1.00 . A A . 3 HIS CE1 1 1
1 38 1 1 3 HIS CG C -3.611 -0.459 3.248 1.00 . A A . 3 HIS CG 1 1
1 39 1 1 3 HIS H H -7.360 -0.520 1.878 1.00 . A A . 3 HIS H 1 1
1 40 1 1 3 HIS HA H -5.395 1.353 2.455 1.00 . A A . 3 HIS HA 1 1
1 41 1 1 3 HIS HB2 H -5.666 -1.072 3.224 1.00 . A A . 3 HIS HB2 1 1
1 42 1 1 3 HIS HB3 H -4.745 -1.524 1.778 1.00 . A A . 3 HIS HB3 1 1
1 43 1 1 3 HIS HD2 H -2.951 -2.509 3.739 1.00 . A A . 3 HIS HD2 1 1
1 44 1 1 3 HIS HE1 H -1.269 1.218 4.499 1.00 . A A . 3 HIS HE1 1 1
1 45 1 1 3 HIS HE2 H -0.867 -1.290 4.831 1.00 . A A . 3 HIS HE2 1 1
1 46 1 1 3 HIS N N -6.932 0.310 1.494 1.00 . A A . 3 HIS N 1 1
1 47 1 1 3 HIS ND1 N -3.104 0.811 3.498 1.00 . A A . 3 HIS ND1 1 1
1 48 1 1 3 HIS NE2 N -1.660 -0.865 4.372 1.00 . A A . 3 HIS NE2 1 1
1 49 1 1 3 HIS O O -3.919 1.897 0.503 1.00 . A A . 3 HIS O 1 1
1 50 1 1 4 THR C C -4.823 1.957 -2.572 1.00 . A A . 4 THR C 1 1
1 51 1 1 4 THR CA C -4.391 0.542 -2.001 1.00 . A A . 4 THR CA 1 1
1 52 1 1 4 THR CB C -4.809 -0.588 -2.990 1.00 . A A . 4 THR CB 1 1
1 53 1 1 4 THR CG2 C -4.173 -1.967 -2.734 1.00 . A A . 4 THR CG2 1 1
1 54 1 1 4 THR H H -5.602 -0.535 -0.587 1.00 . A A . 4 THR H 1 1
1 55 1 1 4 THR HA H -3.305 0.530 -1.914 1.00 . A A . 4 THR HA 1 1
1 56 1 1 4 THR HB H -4.490 -0.272 -3.983 1.00 . A A . 4 THR HB 1 1
1 57 1 1 4 THR HG1 H -6.638 0.109 -3.200 1.00 . A A . 4 THR HG1 1 1
1 58 1 1 4 THR HG21 H -4.532 -2.677 -3.479 1.00 . A A . 4 THR HG21 1 1
1 59 1 1 4 THR HG22 H -4.448 -2.315 -1.738 1.00 . A A . 4 THR HG22 1 1
1 60 1 1 4 THR HG23 H -3.088 -1.885 -2.803 1.00 . A A . 4 THR HG23 1 1
1 61 1 1 4 THR N N -4.964 0.244 -0.660 1.00 . A A . 4 THR N 1 1
1 62 1 1 4 THR O O -4.148 2.533 -3.427 1.00 . A A . 4 THR O 1 1
1 63 1 1 4 THR OG1 O -6.227 -0.744 -3.041 1.00 . A A . 4 THR OG1 1 1
1 64 1 1 5 PHE C C -6.157 4.967 -1.520 1.00 . A A . 5 PHE C 1 1
1 65 1 1 5 PHE CA C -6.585 3.764 -2.402 1.00 . A A . 5 PHE CA 1 1
1 66 1 1 5 PHE CB C -8.117 3.533 -2.481 1.00 . A A . 5 PHE CB 1 1
1 67 1 1 5 PHE CD1 C -8.964 5.031 -4.369 1.00 . A A . 5 PHE CD1 1 1
1 68 1 1 5 PHE CD2 C -9.772 5.447 -2.131 1.00 . A A . 5 PHE CD2 1 1
1 69 1 1 5 PHE CE1 C -9.728 6.096 -4.840 1.00 . A A . 5 PHE CE1 1 1
1 70 1 1 5 PHE CE2 C -10.533 6.513 -2.603 1.00 . A A . 5 PHE CE2 1 1
1 71 1 1 5 PHE CG C -8.976 4.700 -3.008 1.00 . A A . 5 PHE CG 1 1
1 72 1 1 5 PHE CZ C -10.511 6.837 -3.958 1.00 . A A . 5 PHE CZ 1 1
1 73 1 1 5 PHE H H -6.475 1.884 -1.438 1.00 . A A . 5 PHE H 1 1
1 74 1 1 5 PHE HA H -6.268 4.009 -3.416 1.00 . A A . 5 PHE HA 1 1
1 75 1 1 5 PHE HB2 H -8.297 2.665 -3.116 1.00 . A A . 5 PHE HB2 1 1
1 76 1 1 5 PHE HB3 H -8.466 3.296 -1.476 1.00 . A A . 5 PHE HB3 1 1
1 77 1 1 5 PHE HD1 H -8.360 4.458 -5.056 1.00 . A A . 5 PHE HD1 1 1
1 78 1 1 5 PHE HD2 H -9.796 5.194 -1.081 1.00 . A A . 5 PHE HD2 1 1
1 79 1 1 5 PHE HE1 H -9.713 6.348 -5.890 1.00 . A A . 5 PHE HE1 1 1
1 80 1 1 5 PHE HE2 H -11.140 7.088 -1.920 1.00 . A A . 5 PHE HE2 1 1
1 81 1 1 5 PHE HZ H -11.102 7.663 -4.325 1.00 . A A . 5 PHE HZ 1 1
1 82 1 1 5 PHE N N -5.972 2.466 -2.092 1.00 . A A . 5 PHE N 1 1
1 83 1 1 5 PHE O O -6.282 6.098 -2.000 1.00 . A A . 5 PHE O 1 1
1 84 1 1 6 ARG C C -3.823 5.660 1.225 1.00 . A A . 6 ARG C 1 1
1 85 1 1 6 ARG CA C -5.222 5.854 0.614 1.00 . A A . 6 ARG CA 1 1
1 86 1 1 6 ARG CB C -6.328 6.053 1.681 1.00 . A A . 6 ARG CB 1 1
1 87 1 1 6 ARG CD C -8.882 6.393 2.047 1.00 . A A . 6 ARG CD 1 1
1 88 1 1 6 ARG CG C -7.723 6.343 1.050 1.00 . A A . 6 ARG CG 1 1
1 89 1 1 6 ARG CZ C -11.347 6.841 1.971 1.00 . A A . 6 ARG CZ 1 1
1 90 1 1 6 ARG H H -5.524 3.811 0.030 1.00 . A A . 6 ARG H 1 1
1 91 1 1 6 ARG HA H -5.186 6.766 0.018 1.00 . A A . 6 ARG HA 1 1
1 92 1 1 6 ARG HB2 H -6.396 5.153 2.292 1.00 . A A . 6 ARG HB2 1 1
1 93 1 1 6 ARG HB3 H -6.051 6.893 2.318 1.00 . A A . 6 ARG HB3 1 1
1 94 1 1 6 ARG HD2 H -9.042 5.396 2.457 1.00 . A A . 6 ARG HD2 1 1
1 95 1 1 6 ARG HD3 H -8.628 7.077 2.857 1.00 . A A . 6 ARG HD3 1 1
1 96 1 1 6 ARG HE H -10.065 7.200 0.448 1.00 . A A . 6 ARG HE 1 1
1 97 1 1 6 ARG HG2 H -7.671 7.306 0.542 1.00 . A A . 6 ARG HG2 1 1
1 98 1 1 6 ARG HG3 H -7.936 5.572 0.310 1.00 . A A . 6 ARG HG3 1 1
1 99 1 1 6 ARG HH11 H -10.811 6.088 3.784 1.00 . A A . 6 ARG HH11 1 1
1 100 1 1 6 ARG HH12 H -12.514 6.439 3.589 1.00 . A A . 6 ARG HH12 1 1
1 101 1 1 6 ARG HH21 H -12.232 7.594 0.314 1.00 . A A . 6 ARG HH21 1 1
1 102 1 1 6 ARG HH22 H -13.299 7.274 1.662 1.00 . A A . 6 ARG HH22 1 1
1 103 1 1 6 ARG N N -5.636 4.763 -0.289 1.00 . A A . 6 ARG N 1 1
1 104 1 1 6 ARG NE N -10.131 6.853 1.394 1.00 . A A . 6 ARG NE 1 1
1 105 1 1 6 ARG NH1 N -11.576 6.422 3.215 1.00 . A A . 6 ARG NH1 1 1
1 106 1 1 6 ARG NH2 N -12.373 7.270 1.260 1.00 . A A . 6 ARG NH2 1 1
1 107 1 1 6 ARG O O -3.611 5.436 2.419 1.00 . A A . 6 ARG O 1 1
1 108 1 1 7 GLY C C -0.771 4.580 -0.308 1.00 . A A . 7 GLY C 1 1
1 109 1 1 7 GLY CA C -1.442 5.725 0.483 1.00 . A A . 7 GLY CA 1 1
1 110 1 1 7 GLY H H -3.230 6.050 -0.644 1.00 . A A . 7 GLY H 1 1
1 111 1 1 7 GLY HA2 H -0.988 6.666 0.172 1.00 . A A . 7 GLY HA2 1 1
1 112 1 1 7 GLY HA3 H -1.244 5.577 1.545 1.00 . A A . 7 GLY HA3 1 1
1 113 1 1 7 GLY N N -2.904 5.830 0.286 1.00 . A A . 7 GLY N 1 1
1 114 1 1 7 GLY O O 0.329 4.177 0.078 1.00 . A A . 7 GLY O 1 1
1 115 1 1 8 ASP C C -0.423 1.712 -1.509 1.00 . A A . 8 ASP C 1 1
1 116 1 1 8 ASP CA C -0.883 2.988 -2.275 1.00 . A A . 8 ASP CA 1 1
1 117 1 1 8 ASP CB C 0.051 3.506 -3.412 1.00 . A A . 8 ASP CB 1 1
1 118 1 1 8 ASP CG C 1.462 4.009 -3.060 1.00 . A A . 8 ASP CG 1 1
1 119 1 1 8 ASP H H -2.269 4.516 -1.675 1.00 . A A . 8 ASP H 1 1
1 120 1 1 8 ASP HA H -1.773 2.655 -2.810 1.00 . A A . 8 ASP HA 1 1
1 121 1 1 8 ASP HB2 H 0.174 2.686 -4.120 1.00 . A A . 8 ASP HB2 1 1
1 122 1 1 8 ASP HB3 H -0.470 4.313 -3.927 1.00 . A A . 8 ASP HB3 1 1
1 123 1 1 8 ASP N N -1.390 4.093 -1.414 1.00 . A A . 8 ASP N 1 1
1 124 1 1 8 ASP O O 0.540 1.061 -1.911 1.00 . A A . 8 ASP O 1 1
1 125 1 1 8 ASP OD1 O 1.680 5.008 -2.377 1.00 . A A . 8 ASP OD1 1 1
1 126 1 1 8 ASP OD2 O 2.443 3.240 -3.630 1.00 . A A . 8 ASP OD2 1 1
1 127 1 1 9 ASN C C 0.493 0.233 1.178 1.00 . A A . 9 ASN C 1 1
1 128 1 1 9 ASN CA C -0.848 0.131 0.403 1.00 . A A . 9 ASN CA 1 1
1 129 1 1 9 ASN CB C -1.088 -1.161 -0.422 1.00 . A A . 9 ASN CB 1 1
1 130 1 1 9 ASN CG C -1.247 -2.470 0.370 1.00 . A A . 9 ASN CG 1 1
1 131 1 1 9 ASN H H -1.975 1.875 -0.198 1.00 . A A . 9 ASN H 1 1
1 132 1 1 9 ASN HA H -1.618 0.120 1.174 1.00 . A A . 9 ASN HA 1 1
1 133 1 1 9 ASN HB2 H -1.998 -1.016 -1.005 1.00 . A A . 9 ASN HB2 1 1
1 134 1 1 9 ASN HB3 H -0.255 -1.282 -1.115 1.00 . A A . 9 ASN HB3 1 1
1 135 1 1 9 ASN HD21 H -3.253 -2.231 0.502 1.00 . A A . 9 ASN HD21 1 1
1 136 1 1 9 ASN HD22 H -2.614 -3.677 1.250 1.00 . A A . 9 ASN HD22 1 1
1 137 1 1 9 ASN N N -1.163 1.324 -0.439 1.00 . A A . 9 ASN N 1 1
1 138 1 1 9 ASN ND2 N -2.467 -2.820 0.736 1.00 . A A . 9 ASN ND2 1 1
1 139 1 1 9 ASN O O 1.232 -0.739 1.284 1.00 . A A . 9 ASN O 1 1
1 140 1 1 9 ASN OD1 O -0.281 -3.184 0.639 1.00 . A A . 9 ASN OD1 1 1
1 141 1 1 10 VAL C C 3.219 1.805 1.675 1.00 . A A . 10 VAL C 1 1
1 142 1 1 10 VAL CA C 1.960 1.719 2.586 1.00 . A A . 10 VAL CA 1 1
1 143 1 1 10 VAL CB C 2.072 1.044 4.004 1.00 . A A . 10 VAL CB 1 1
1 144 1 1 10 VAL CG1 C 2.368 -0.470 4.064 1.00 . A A . 10 VAL CG1 1 1
1 145 1 1 10 VAL CG2 C 3.069 1.794 4.918 1.00 . A A . 10 VAL CG2 1 1
1 146 1 1 10 VAL H H 0.028 2.119 1.727 1.00 . A A . 10 VAL H 1 1
1 147 1 1 10 VAL HA H 1.797 2.765 2.846 1.00 . A A . 10 VAL HA 1 1
1 148 1 1 10 VAL HB H 1.094 1.171 4.468 1.00 . A A . 10 VAL HB 1 1
1 149 1 1 10 VAL HG11 H 1.668 -1.003 3.421 1.00 . A A . 10 VAL HG11 1 1
1 150 1 1 10 VAL HG12 H 3.387 -0.655 3.723 1.00 . A A . 10 VAL HG12 1 1
1 151 1 1 10 VAL HG13 H 2.259 -0.821 5.090 1.00 . A A . 10 VAL HG13 1 1
1 152 1 1 10 VAL HG21 H 2.864 2.864 4.879 1.00 . A A . 10 VAL HG21 1 1
1 153 1 1 10 VAL HG22 H 2.959 1.440 5.943 1.00 . A A . 10 VAL HG22 1 1
1 154 1 1 10 VAL HG23 H 4.087 1.606 4.576 1.00 . A A . 10 VAL HG23 1 1
1 155 1 1 10 VAL N N 0.734 1.400 1.799 1.00 . A A . 10 VAL N 1 1
1 156 1 1 10 VAL O O 4.254 1.193 1.925 1.00 . A A . 10 VAL O 1 1
1 157 1 1 11 HIS C C 4.457 1.670 -1.232 1.00 . A A . 11 HIS C 1 1
1 158 1 1 11 HIS CA C 4.157 2.938 -0.380 1.00 . A A . 11 HIS CA 1 1
1 159 1 1 11 HIS CB C 5.428 3.640 0.228 1.00 . A A . 11 HIS CB 1 1
1 160 1 1 11 HIS CD2 C 6.338 5.814 1.262 1.00 . A A . 11 HIS CD2 1 1
1 161 1 1 11 HIS CE1 C 4.709 7.109 0.971 1.00 . A A . 11 HIS CE1 1 1
1 162 1 1 11 HIS CG C 5.288 5.109 0.649 1.00 . A A . 11 HIS CG 1 1
1 163 1 1 11 HIS H H 2.229 3.183 0.563 1.00 . A A . 11 HIS H 1 1
1 164 1 1 11 HIS HA H 3.724 3.661 -1.071 1.00 . A A . 11 HIS HA 1 1
1 165 1 1 11 HIS HB2 H 5.724 3.073 1.111 1.00 . A A . 11 HIS HB2 1 1
1 166 1 1 11 HIS HB3 H 6.234 3.573 -0.503 1.00 . A A . 11 HIS HB3 1 1
1 167 1 1 11 HIS HD2 H 7.296 5.388 1.520 1.00 . A A . 11 HIS HD2 1 1
1 168 1 1 11 HIS HE1 H 4.112 8.009 0.981 1.00 . A A . 11 HIS HE1 1 1
1 169 1 1 11 HIS HE2 H 6.496 7.881 1.912 1.00 . A A . 11 HIS HE2 1 1
1 170 1 1 11 HIS N N 3.098 2.674 0.646 1.00 . A A . 11 HIS N 1 1
1 171 1 1 11 HIS ND1 N 4.194 5.949 0.439 1.00 . A A . 11 HIS ND1 1 1
1 172 1 1 11 HIS NE2 N 5.976 7.126 1.488 1.00 . A A . 11 HIS NE2 1 1
1 173 1 1 11 HIS O O 5.619 1.373 -1.502 1.00 . A A . 11 HIS O 1 1
1 174 1 1 12 ASN C C 3.964 -1.445 -1.646 1.00 . A A . 12 ASN C 1 1
1 175 1 1 12 ASN CA C 3.532 -0.257 -2.562 1.00 . A A . 12 ASN CA 1 1
1 176 1 1 12 ASN CB C 4.338 -0.060 -3.888 1.00 . A A . 12 ASN CB 1 1
1 177 1 1 12 ASN CG C 4.056 -1.139 -4.948 1.00 . A A . 12 ASN CG 1 1
1 178 1 1 12 ASN H H 2.480 1.335 -1.571 1.00 . A A . 12 ASN H 1 1
1 179 1 1 12 ASN HA H 2.516 -0.494 -2.878 1.00 . A A . 12 ASN HA 1 1
1 180 1 1 12 ASN HB2 H 4.078 0.912 -4.308 1.00 . A A . 12 ASN HB2 1 1
1 181 1 1 12 ASN HB3 H 5.403 -0.067 -3.655 1.00 . A A . 12 ASN HB3 1 1
1 182 1 1 12 ASN HD21 H 2.263 -0.311 -5.409 1.00 . A A . 12 ASN HD21 1 1
1 183 1 1 12 ASN HD22 H 2.677 -1.760 -6.299 1.00 . A A . 12 ASN HD22 1 1
1 184 1 1 12 ASN N N 3.409 0.981 -1.750 1.00 . A A . 12 ASN N 1 1
1 185 1 1 12 ASN ND2 N 2.908 -1.064 -5.604 1.00 . A A . 12 ASN ND2 1 1
1 186 1 1 12 ASN O O 4.861 -2.214 -2.008 1.00 . A A . 12 ASN O 1 1
1 187 1 1 12 ASN OD1 O 4.847 -2.057 -5.160 1.00 . A A . 12 ASN OD1 1 1
1 188 1 1 13 SER C C 5.037 -2.541 1.001 1.00 . A A . 13 SER C 1 1
1 189 1 1 13 SER CA C 3.584 -2.683 0.530 1.00 . A A . 13 SER CA 1 1
1 190 1 1 13 SER CB C 3.100 -4.044 -0.007 1.00 . A A . 13 SER CB 1 1
1 191 1 1 13 SER H H 2.549 -0.955 -0.252 1.00 . A A . 13 SER H 1 1
1 192 1 1 13 SER HA H 2.964 -2.465 1.400 1.00 . A A . 13 SER HA 1 1
1 193 1 1 13 SER HB2 H 2.028 -3.991 -0.199 1.00 . A A . 13 SER HB2 1 1
1 194 1 1 13 SER HB3 H 3.619 -4.260 -0.941 1.00 . A A . 13 SER HB3 1 1
1 195 1 1 13 SER HG H 3.042 -5.925 0.549 1.00 . A A . 13 SER HG 1 1
1 196 1 1 13 SER N N 3.291 -1.606 -0.465 1.00 . A A . 13 SER N 1 1
1 197 1 1 13 SER O O 5.872 -3.385 0.687 1.00 . A A . 13 SER O 1 1
1 198 1 1 13 SER OG O 3.355 -5.094 0.915 1.00 . A A . 13 SER OG 1 1
1 199 1 1 14 SER C C 7.683 -1.068 1.084 1.00 . A A . 14 SER C 1 1
1 200 1 1 14 SER CA C 6.673 -1.110 2.276 1.00 . A A . 14 SER CA 1 1
1 201 1 1 14 SER CB C 7.016 -2.066 3.455 1.00 . A A . 14 SER CB 1 1
1 202 1 1 14 SER H H 4.559 -0.813 1.973 1.00 . A A . 14 SER H 1 1
1 203 1 1 14 SER HA H 6.619 -0.102 2.686 1.00 . A A . 14 SER HA 1 1
1 204 1 1 14 SER HB2 H 6.207 -2.034 4.185 1.00 . A A . 14 SER HB2 1 1
1 205 1 1 14 SER HB3 H 7.115 -3.083 3.074 1.00 . A A . 14 SER HB3 1 1
1 206 1 1 14 SER HG H 8.418 -2.289 4.813 1.00 . A A . 14 SER HG 1 1
1 207 1 1 14 SER N N 5.318 -1.443 1.754 1.00 . A A . 14 SER N 1 1
1 208 1 1 14 SER O O 8.821 -1.515 1.264 1.00 . A A . 14 SER O 1 1
1 209 1 1 14 SER OG O 8.230 -1.684 4.091 1.00 . A A . 14 SER OG 1 1
1 210 1 1 15 SER C C 8.440 -1.907 -1.949 1.00 . A A . 15 SER C 1 1
1 211 1 1 15 SER CA C 8.197 -0.469 -1.333 1.00 . A A . 15 SER CA 1 1
1 212 1 1 15 SER CB C 9.558 0.229 -1.039 1.00 . A A . 15 SER CB 1 1
1 213 1 1 15 SER H H 6.359 -0.118 -0.192 1.00 . A A . 15 SER H 1 1
1 214 1 1 15 SER HA H 7.690 0.124 -2.094 1.00 . A A . 15 SER HA 1 1
1 215 1 1 15 SER HB2 H 9.384 1.107 -0.417 1.00 . A A . 15 SER HB2 1 1
1 216 1 1 15 SER HB3 H 10.206 -0.466 -0.505 1.00 . A A . 15 SER HB3 1 1
1 217 1 1 15 SER HG H 11.034 1.057 -2.039 1.00 . A A . 15 SER HG 1 1
1 218 1 1 15 SER N N 7.287 -0.511 -0.119 1.00 . A A . 15 SER N 1 1
1 219 1 1 15 SER O O 8.891 -1.991 -3.095 1.00 . A A . 15 SER O 1 1
1 220 1 1 15 SER OG O 10.199 0.630 -2.246 1.00 . A A . 15 SER OG 1 1
1 221 1 1 16 SER C C 7.887 -5.468 -0.560 1.00 . A A . 16 SER C 1 1
1 222 1 1 16 SER CA C 8.318 -4.425 -1.645 1.00 . A A . 16 SER CA 1 1
1 223 1 1 16 SER CB C 9.833 -4.707 -1.864 1.00 . A A . 16 SER CB 1 1
1 224 1 1 16 SER H H 7.738 -2.862 -0.300 1.00 . A A . 16 SER H 1 1
1 225 1 1 16 SER HA H 7.771 -4.607 -2.570 1.00 . A A . 16 SER HA 1 1
1 226 1 1 16 SER HB2 H 10.312 -3.808 -2.252 1.00 . A A . 16 SER HB2 1 1
1 227 1 1 16 SER HB3 H 10.287 -4.970 -0.909 1.00 . A A . 16 SER HB3 1 1
1 228 1 1 16 SER HG H 10.974 -5.927 -2.898 1.00 . A A . 16 SER HG 1 1
1 229 1 1 16 SER N N 8.131 -3.014 -1.218 1.00 . A A . 16 SER N 1 1
1 230 1 1 16 SER O O 7.363 -6.526 -0.919 1.00 . A A . 16 SER O 1 1
1 231 1 1 16 SER OG O 10.033 -5.776 -2.782 1.00 . A A . 16 SER OG 1 1
1 232 1 1 17 LEU C C 6.295 -6.076 2.270 1.00 . A A . 17 LEU C 1 1
1 233 1 1 17 LEU CA C 7.794 -6.101 1.865 1.00 . A A . 17 LEU CA 1 1
1 234 1 1 17 LEU CB C 8.713 -5.830 3.096 1.00 . A A . 17 LEU CB 1 1
1 235 1 1 17 LEU CD1 C 11.037 -5.510 4.116 1.00 . A A . 17 LEU CD1 1 1
1 236 1 1 17 LEU CD2 C 10.621 -7.545 2.692 1.00 . A A . 17 LEU CD2 1 1
1 237 1 1 17 LEU CG C 10.249 -6.063 2.911 1.00 . A A . 17 LEU CG 1 1
1 238 1 1 17 LEU H H 8.583 -4.297 0.962 1.00 . A A . 17 LEU H 1 1
1 239 1 1 17 LEU HXT H 4.572 -6.986 2.181 1.00 . A A . 17 LEU HXT 1 1
1 240 1 1 17 LEU HA H 8.013 -7.112 1.523 1.00 . A A . 17 LEU HA 1 1
1 241 1 1 17 LEU HB2 H 8.573 -4.789 3.386 1.00 . A A . 17 LEU HB2 1 1
1 242 1 1 17 LEU HB3 H 8.372 -6.459 3.918 1.00 . A A . 17 LEU HB3 1 1
1 243 1 1 17 LEU HD11 H 10.776 -4.463 4.272 1.00 . A A . 17 LEU HD11 1 1
1 244 1 1 17 LEU HD12 H 10.786 -6.084 5.008 1.00 . A A . 17 LEU HD12 1 1
1 245 1 1 17 LEU HD13 H 12.106 -5.592 3.920 1.00 . A A . 17 LEU HD13 1 1
1 246 1 1 17 LEU HD21 H 10.065 -7.938 1.841 1.00 . A A . 17 LEU HD21 1 1
1 247 1 1 17 LEU HD22 H 11.690 -7.626 2.496 1.00 . A A . 17 LEU HD22 1 1
1 248 1 1 17 LEU HD23 H 10.371 -8.118 3.585 1.00 . A A . 17 LEU HD23 1 1
1 249 1 1 17 LEU HG H 10.564 -5.509 2.027 1.00 . A A . 17 LEU HG 1 1
1 250 1 1 17 LEU N N 8.140 -5.178 0.742 1.00 . A A . 17 LEU N 1 1
1 251 1 1 17 LEU O O 5.805 -5.163 2.936 1.00 . A A . 17 LEU O 1 1
1 252 1 1 17 LEU OXT O 5.464 -7.136 1.860 1.00 . A A . 17 LEU OXT 1 1
2 253 1 1 1 ASN C C -7.912 4.932 -6.316 1.00 . A A . 1 ASN C 1 1
2 254 1 1 1 ASN CA C -8.563 6.353 -6.241 1.00 . A A . 1 ASN CA 1 1
2 255 1 1 1 ASN CB C -9.899 6.361 -5.425 1.00 . A A . 1 ASN CB 1 1
2 256 1 1 1 ASN CG C -10.382 7.750 -4.964 1.00 . A A . 1 ASN CG 1 1
2 257 1 1 1 ASN H1 H -7.901 6.835 -8.131 1.00 . A A . 1 ASN H1 1 1
2 258 1 1 1 ASN H2 H -9.446 6.259 -8.099 1.00 . A A . 1 ASN H2 1 1
2 259 1 1 1 ASN H3 H -9.129 7.797 -7.596 1.00 . A A . 1 ASN H3 1 1
2 260 1 1 1 ASN HA H -7.860 7.022 -5.745 1.00 . A A . 1 ASN HA 1 1
2 261 1 1 1 ASN HB2 H -10.677 5.924 -6.050 1.00 . A A . 1 ASN HB2 1 1
2 262 1 1 1 ASN HB3 H -9.769 5.731 -4.545 1.00 . A A . 1 ASN HB3 1 1
2 263 1 1 1 ASN HD21 H -9.190 7.717 -3.322 1.00 . A A . 1 ASN HD21 1 1
2 264 1 1 1 ASN HD22 H -10.167 9.156 -3.516 1.00 . A A . 1 ASN HD22 1 1
2 265 1 1 1 ASN N N -8.777 6.851 -7.628 1.00 . A A . 1 ASN N 1 1
2 266 1 1 1 ASN ND2 N -9.873 8.247 -3.845 1.00 . A A . 1 ASN ND2 1 1
2 267 1 1 1 ASN O O -8.539 3.922 -5.978 1.00 . A A . 1 ASN O 1 1
2 268 1 1 1 ASN OD1 O -11.213 8.385 -5.612 1.00 . A A . 1 ASN OD1 1 1
2 269 1 1 2 VAL C C -4.526 3.939 -6.061 1.00 . A A . 2 VAL C 1 1
2 270 1 1 2 VAL CA C -5.827 3.623 -6.858 1.00 . A A . 2 VAL CA 1 1
2 271 1 1 2 VAL CB C -5.663 3.191 -8.351 1.00 . A A . 2 VAL CB 1 1
2 272 1 1 2 VAL CG1 C -4.642 2.052 -8.580 1.00 . A A . 2 VAL CG1 1 1
2 273 1 1 2 VAL CG2 C -6.988 2.789 -9.046 1.00 . A A . 2 VAL CG2 1 1
2 274 1 1 2 VAL H H -6.196 5.731 -7.041 1.00 . A A . 2 VAL H 1 1
2 275 1 1 2 VAL HA H -6.361 2.830 -6.333 1.00 . A A . 2 VAL HA 1 1
2 276 1 1 2 VAL HB H -5.284 4.061 -8.886 1.00 . A A . 2 VAL HB 1 1
2 277 1 1 2 VAL HG11 H -3.698 2.309 -8.100 1.00 . A A . 2 VAL HG11 1 1
2 278 1 1 2 VAL HG12 H -4.482 1.918 -9.650 1.00 . A A . 2 VAL HG12 1 1
2 279 1 1 2 VAL HG13 H -5.028 1.127 -8.151 1.00 . A A . 2 VAL HG13 1 1
2 280 1 1 2 VAL HG21 H -7.729 3.575 -8.901 1.00 . A A . 2 VAL HG21 1 1
2 281 1 1 2 VAL HG22 H -7.357 1.858 -8.614 1.00 . A A . 2 VAL HG22 1 1
2 282 1 1 2 VAL HG23 H -6.811 2.649 -10.112 1.00 . A A . 2 VAL HG23 1 1
2 283 1 1 2 VAL N N -6.636 4.867 -6.757 1.00 . A A . 2 VAL N 1 1
2 284 1 1 2 VAL O O -4.304 3.358 -4.995 1.00 . A A . 2 VAL O 1 1
2 285 1 1 3 HIS C C -2.788 6.199 -4.721 1.00 . A A . 3 HIS C 1 1
2 286 1 1 3 HIS CA C -2.410 5.278 -5.926 1.00 . A A . 3 HIS CA 1 1
2 287 1 1 3 HIS CB C -1.450 5.936 -6.953 1.00 . A A . 3 HIS CB 1 1
2 288 1 1 3 HIS CD2 C 0.482 6.893 -5.494 1.00 . A A . 3 HIS CD2 1 1
2 289 1 1 3 HIS CE1 C 2.042 5.648 -6.157 1.00 . A A . 3 HIS CE1 1 1
2 290 1 1 3 HIS CG C -0.011 5.987 -6.450 1.00 . A A . 3 HIS CG 1 1
2 291 1 1 3 HIS H H -3.868 5.201 -7.512 1.00 . A A . 3 HIS H 1 1
2 292 1 1 3 HIS HA H -1.912 4.396 -5.525 1.00 . A A . 3 HIS HA 1 1
2 293 1 1 3 HIS HB2 H -1.480 5.367 -7.882 1.00 . A A . 3 HIS HB2 1 1
2 294 1 1 3 HIS HB3 H -1.789 6.953 -7.148 1.00 . A A . 3 HIS HB3 1 1
2 295 1 1 3 HIS HD2 H -0.109 7.648 -4.996 1.00 . A A . 3 HIS HD2 1 1
2 296 1 1 3 HIS HE1 H 3.029 5.221 -6.255 1.00 . A A . 3 HIS HE1 1 1
2 297 1 1 3 HIS HE2 H 2.473 7.151 -4.664 1.00 . A A . 3 HIS HE2 1 1
2 298 1 1 3 HIS N N -3.657 4.824 -6.599 1.00 . A A . 3 HIS N 1 1
2 299 1 1 3 HIS ND1 N 1.004 5.154 -6.910 1.00 . A A . 3 HIS ND1 1 1
2 300 1 1 3 HIS NE2 N 1.829 6.681 -5.284 1.00 . A A . 3 HIS NE2 1 1
2 301 1 1 3 HIS O O -2.163 6.097 -3.662 1.00 . A A . 3 HIS O 1 1
2 302 1 1 4 THR C C -5.609 7.352 -3.226 1.00 . A A . 4 THR C 1 1
2 303 1 1 4 THR CA C -4.300 7.984 -3.838 1.00 . A A . 4 THR CA 1 1
2 304 1 1 4 THR CB C -4.398 9.454 -4.348 1.00 . A A . 4 THR CB 1 1
2 305 1 1 4 THR CG2 C -5.434 9.730 -5.459 1.00 . A A . 4 THR CG2 1 1
2 306 1 1 4 THR H H -4.196 7.173 -5.820 1.00 . A A . 4 THR H 1 1
2 307 1 1 4 THR HA H -3.554 7.981 -3.043 1.00 . A A . 4 THR HA 1 1
2 308 1 1 4 THR HB H -3.418 9.733 -4.735 1.00 . A A . 4 THR HB 1 1
2 309 1 1 4 THR HG1 H -4.628 11.227 -3.534 1.00 . A A . 4 THR HG1 1 1
2 310 1 1 4 THR HG21 H -5.406 10.786 -5.727 1.00 . A A . 4 THR HG21 1 1
2 311 1 1 4 THR HG22 H -5.196 9.126 -6.335 1.00 . A A . 4 THR HG22 1 1
2 312 1 1 4 THR HG23 H -6.430 9.472 -5.099 1.00 . A A . 4 THR HG23 1 1
2 313 1 1 4 THR N N -3.783 7.101 -4.901 1.00 . A A . 4 THR N 1 1
2 314 1 1 4 THR O O -6.560 8.069 -2.893 1.00 . A A . 4 THR O 1 1
2 315 1 1 4 THR OG1 O -4.686 10.312 -3.249 1.00 . A A . 4 THR OG1 1 1
2 316 1 1 5 PHE C C -6.621 5.430 -0.903 1.00 . A A . 5 PHE C 1 1
2 317 1 1 5 PHE CA C -6.750 5.253 -2.437 1.00 . A A . 5 PHE CA 1 1
2 318 1 1 5 PHE CB C -6.779 3.781 -2.956 1.00 . A A . 5 PHE CB 1 1
2 319 1 1 5 PHE CD1 C -9.245 3.259 -2.445 1.00 . A A . 5 PHE CD1 1 1
2 320 1 1 5 PHE CD2 C -7.581 1.572 -1.977 1.00 . A A . 5 PHE CD2 1 1
2 321 1 1 5 PHE CE1 C -10.242 2.397 -1.996 1.00 . A A . 5 PHE CE1 1 1
2 322 1 1 5 PHE CE2 C -8.582 0.710 -1.539 1.00 . A A . 5 PHE CE2 1 1
2 323 1 1 5 PHE CG C -7.903 2.857 -2.435 1.00 . A A . 5 PHE CG 1 1
2 324 1 1 5 PHE CZ C -9.911 1.122 -1.548 1.00 . A A . 5 PHE CZ 1 1
2 325 1 1 5 PHE H H -4.822 5.478 -3.333 1.00 . A A . 5 PHE H 1 1
2 326 1 1 5 PHE HA H -7.677 5.733 -2.749 1.00 . A A . 5 PHE HA 1 1
2 327 1 1 5 PHE HB2 H -6.868 3.821 -4.042 1.00 . A A . 5 PHE HB2 1 1
2 328 1 1 5 PHE HB3 H -5.822 3.318 -2.714 1.00 . A A . 5 PHE HB3 1 1
2 329 1 1 5 PHE HD1 H -9.508 4.243 -2.804 1.00 . A A . 5 PHE HD1 1 1
2 330 1 1 5 PHE HD2 H -6.551 1.249 -1.964 1.00 . A A . 5 PHE HD2 1 1
2 331 1 1 5 PHE HE1 H -11.273 2.719 -1.995 1.00 . A A . 5 PHE HE1 1 1
2 332 1 1 5 PHE HE2 H -8.327 -0.281 -1.191 1.00 . A A . 5 PHE HE2 1 1
2 333 1 1 5 PHE HZ H -10.686 0.452 -1.207 1.00 . A A . 5 PHE HZ 1 1
2 334 1 1 5 PHE N N -5.633 6.004 -3.038 1.00 . A A . 5 PHE N 1 1
2 335 1 1 5 PHE O O -7.373 6.192 -0.287 1.00 . A A . 5 PHE O 1 1
2 336 1 1 6 ARG C C -3.742 4.792 1.272 1.00 . A A . 6 ARG C 1 1
2 337 1 1 6 ARG CA C -5.288 4.741 1.105 1.00 . A A . 6 ARG CA 1 1
2 338 1 1 6 ARG CB C -5.873 3.484 1.786 1.00 . A A . 6 ARG CB 1 1
2 339 1 1 6 ARG CD C -7.995 2.017 1.972 1.00 . A A . 6 ARG CD 1 1
2 340 1 1 6 ARG CG C -7.414 3.390 1.638 1.00 . A A . 6 ARG CG 1 1
2 341 1 1 6 ARG CZ C -10.261 0.957 2.112 1.00 . A A . 6 ARG CZ 1 1
2 342 1 1 6 ARG H H -5.109 4.097 -0.928 1.00 . A A . 6 ARG H 1 1
2 343 1 1 6 ARG HA H -5.725 5.630 1.562 1.00 . A A . 6 ARG HA 1 1
2 344 1 1 6 ARG HB2 H -5.424 2.600 1.332 1.00 . A A . 6 ARG HB2 1 1
2 345 1 1 6 ARG HB3 H -5.620 3.505 2.846 1.00 . A A . 6 ARG HB3 1 1
2 346 1 1 6 ARG HD2 H -7.677 1.301 1.213 1.00 . A A . 6 ARG HD2 1 1
2 347 1 1 6 ARG HD3 H -7.616 1.699 2.943 1.00 . A A . 6 ARG HD3 1 1
2 348 1 1 6 ARG HE H -9.928 2.950 1.982 1.00 . A A . 6 ARG HE 1 1
2 349 1 1 6 ARG HG2 H -7.866 4.123 2.306 1.00 . A A . 6 ARG HG2 1 1
2 350 1 1 6 ARG HG3 H -7.682 3.642 0.612 1.00 . A A . 6 ARG HG3 1 1
2 351 1 1 6 ARG HH11 H -8.801 -0.460 2.159 1.00 . A A . 6 ARG HH11 1 1
2 352 1 1 6 ARG HH12 H -10.439 -1.066 2.242 1.00 . A A . 6 ARG HH12 1 1
2 353 1 1 6 ARG HH21 H -11.952 2.068 2.086 1.00 . A A . 6 ARG HH21 1 1
2 354 1 1 6 ARG HH22 H -12.186 0.339 2.201 1.00 . A A . 6 ARG HH22 1 1
2 355 1 1 6 ARG N N -5.644 4.710 -0.330 1.00 . A A . 6 ARG N 1 1
2 356 1 1 6 ARG NE N -9.476 2.048 2.020 1.00 . A A . 6 ARG NE 1 1
2 357 1 1 6 ARG NH1 N -9.796 -0.290 2.176 1.00 . A A . 6 ARG NH1 1 1
2 358 1 1 6 ARG NH2 N -11.569 1.135 2.135 1.00 . A A . 6 ARG NH2 1 1
2 359 1 1 6 ARG O O -3.161 4.133 2.140 1.00 . A A . 6 ARG O 1 1
2 360 1 1 7 GLY C C -0.860 4.727 -0.322 1.00 . A A . 7 GLY C 1 1
2 361 1 1 7 GLY CA C -1.652 5.836 0.416 1.00 . A A . 7 GLY CA 1 1
2 362 1 1 7 GLY H H -3.685 6.176 -0.202 1.00 . A A . 7 GLY H 1 1
2 363 1 1 7 GLY HA2 H -1.446 6.785 -0.077 1.00 . A A . 7 GLY HA2 1 1
2 364 1 1 7 GLY HA3 H -1.292 5.893 1.444 1.00 . A A . 7 GLY HA3 1 1
2 365 1 1 7 GLY N N -3.121 5.640 0.442 1.00 . A A . 7 GLY N 1 1
2 366 1 1 7 GLY O O 0.291 4.468 0.041 1.00 . A A . 7 GLY O 1 1
2 367 1 1 8 ASP C C -0.408 1.750 -1.352 1.00 . A A . 8 ASP C 1 1
2 368 1 1 8 ASP CA C -0.844 3.008 -2.170 1.00 . A A . 8 ASP CA 1 1
2 369 1 1 8 ASP CB C 0.250 3.591 -3.120 1.00 . A A . 8 ASP CB 1 1
2 370 1 1 8 ASP CG C 0.604 2.720 -4.336 1.00 . A A . 8 ASP CG 1 1
2 371 1 1 8 ASP H H -2.398 4.396 -1.607 1.00 . A A . 8 ASP H 1 1
2 372 1 1 8 ASP HA H -1.637 2.658 -2.831 1.00 . A A . 8 ASP HA 1 1
2 373 1 1 8 ASP HB2 H -0.105 4.554 -3.488 1.00 . A A . 8 ASP HB2 1 1
2 374 1 1 8 ASP HB3 H 1.157 3.757 -2.539 1.00 . A A . 8 ASP HB3 1 1
2 375 1 1 8 ASP N N -1.464 4.102 -1.361 1.00 . A A . 8 ASP N 1 1
2 376 1 1 8 ASP O O 0.572 1.092 -1.696 1.00 . A A . 8 ASP O 1 1
2 377 1 1 8 ASP OD1 O -0.234 2.256 -5.109 1.00 . A A . 8 ASP OD1 1 1
2 378 1 1 8 ASP OD2 O 1.956 2.542 -4.469 1.00 . A A . 8 ASP OD2 1 1
2 379 1 1 9 ASN C C 0.487 0.267 1.298 1.00 . A A . 9 ASN C 1 1
2 380 1 1 9 ASN CA C -0.881 0.187 0.559 1.00 . A A . 9 ASN CA 1 1
2 381 1 1 9 ASN CB C -1.220 -1.121 -0.210 1.00 . A A . 9 ASN CB 1 1
2 382 1 1 9 ASN CG C -1.362 -2.393 0.649 1.00 . A A . 9 ASN CG 1 1
2 383 1 1 9 ASN H H -2.013 1.895 -0.115 1.00 . A A . 9 ASN H 1 1
2 384 1 1 9 ASN HA H -1.625 0.239 1.353 1.00 . A A . 9 ASN HA 1 1
2 385 1 1 9 ASN HB2 H -2.153 -0.968 -0.752 1.00 . A A . 9 ASN HB2 1 1
2 386 1 1 9 ASN HB3 H -0.426 -1.296 -0.936 1.00 . A A . 9 ASN HB3 1 1
2 387 1 1 9 ASN HD21 H -3.304 -1.991 1.068 1.00 . A A . 9 ASN HD21 1 1
2 388 1 1 9 ASN HD22 H -2.666 -3.459 1.776 1.00 . A A . 9 ASN HD22 1 1
2 389 1 1 9 ASN N N -1.180 1.359 -0.313 1.00 . A A . 9 ASN N 1 1
2 390 1 1 9 ASN ND2 N -2.537 -2.633 1.209 1.00 . A A . 9 ASN ND2 1 1
2 391 1 1 9 ASN O O 1.216 -0.714 1.393 1.00 . A A . 9 ASN O 1 1
2 392 1 1 9 ASN OD1 O -0.418 -3.167 0.808 1.00 . A A . 9 ASN OD1 1 1
2 393 1 1 10 VAL C C 3.253 1.865 1.722 1.00 . A A . 10 VAL C 1 1
2 394 1 1 10 VAL CA C 2.000 1.775 2.639 1.00 . A A . 10 VAL CA 1 1
2 395 1 1 10 VAL CB C 2.130 1.120 4.066 1.00 . A A . 10 VAL CB 1 1
2 396 1 1 10 VAL CG1 C 2.491 -0.378 4.150 1.00 . A A . 10 VAL CG1 1 1
2 397 1 1 10 VAL CG2 C 3.095 1.921 4.972 1.00 . A A . 10 VAL CG2 1 1
2 398 1 1 10 VAL H H 0.065 2.174 1.800 1.00 . A A . 10 VAL H 1 1
2 399 1 1 10 VAL HA H 1.835 2.822 2.890 1.00 . A A . 10 VAL HA 1 1
2 400 1 1 10 VAL HB H 1.146 1.215 4.525 1.00 . A A . 10 VAL HB 1 1
2 401 1 1 10 VAL HG11 H 1.816 -0.951 3.515 1.00 . A A . 10 VAL HG11 1 1
2 402 1 1 10 VAL HG12 H 2.394 -0.717 5.182 1.00 . A A . 10 VAL HG12 1 1
2 403 1 1 10 VAL HG13 H 3.517 -0.524 3.815 1.00 . A A . 10 VAL HG13 1 1
2 404 1 1 10 VAL HG21 H 2.849 2.981 4.920 1.00 . A A . 10 VAL HG21 1 1
2 405 1 1 10 VAL HG22 H 2.997 1.576 6.002 1.00 . A A . 10 VAL HG22 1 1
2 406 1 1 10 VAL HG23 H 4.121 1.769 4.635 1.00 . A A . 10 VAL HG23 1 1
2 407 1 1 10 VAL N N 0.761 1.447 1.882 1.00 . A A . 10 VAL N 1 1
2 408 1 1 10 VAL O O 4.288 1.244 1.955 1.00 . A A . 10 VAL O 1 1
2 409 1 1 11 HIS C C 4.485 1.788 -1.218 1.00 . A A . 11 HIS C 1 1
2 410 1 1 11 HIS CA C 4.184 3.027 -0.321 1.00 . A A . 11 HIS CA 1 1
2 411 1 1 11 HIS CB C 5.463 3.710 0.294 1.00 . A A . 11 HIS CB 1 1
2 412 1 1 11 HIS CD2 C 6.388 5.850 1.381 1.00 . A A . 11 HIS CD2 1 1
2 413 1 1 11 HIS CE1 C 4.762 7.158 1.140 1.00 . A A . 11 HIS CE1 1 1
2 414 1 1 11 HIS CG C 5.331 5.166 0.757 1.00 . A A . 11 HIS CG 1 1
2 415 1 1 11 HIS H H 2.261 3.262 0.640 1.00 . A A . 11 HIS H 1 1
2 416 1 1 11 HIS HA H 3.750 3.771 -0.989 1.00 . A A . 11 HIS HA 1 1
2 417 1 1 11 HIS HB2 H 5.765 3.118 1.158 1.00 . A A . 11 HIS HB2 1 1
2 418 1 1 11 HIS HB3 H 6.261 3.661 -0.446 1.00 . A A . 11 HIS HB3 1 1
2 419 1 1 11 HIS HD2 H 7.347 5.413 1.619 1.00 . A A . 11 HIS HD2 1 1
2 420 1 1 11 HIS HE1 H 4.168 8.059 1.179 1.00 . A A . 11 HIS HE1 1 1
2 421 1 1 11 HIS HE2 H 6.558 7.898 2.088 1.00 . A A . 11 HIS HE2 1 1
2 422 1 1 11 HIS N N 3.128 2.749 0.709 1.00 . A A . 11 HIS N 1 1
2 423 1 1 11 HIS ND1 N 4.238 6.016 0.581 1.00 . A A . 11 HIS ND1 1 1
2 424 1 1 11 HIS NE2 N 6.033 7.157 1.647 1.00 . A A . 11 HIS NE2 1 1
2 425 1 1 11 HIS O O 5.644 1.488 -1.501 1.00 . A A . 11 HIS O 1 1
2 426 1 1 12 ASN C C 3.889 -1.295 -1.746 1.00 . A A . 12 ASN C 1 1
2 427 1 1 12 ASN CA C 3.514 -0.065 -2.624 1.00 . A A . 12 ASN CA 1 1
2 428 1 1 12 ASN CB C 4.339 0.154 -3.934 1.00 . A A . 12 ASN CB 1 1
2 429 1 1 12 ASN CG C 3.877 -0.697 -5.130 1.00 . A A . 12 ASN CG 1 1
2 430 1 1 12 ASN H H 2.509 1.506 -1.567 1.00 . A A . 12 ASN H 1 1
2 431 1 1 12 ASN HA H 2.493 -0.252 -2.956 1.00 . A A . 12 ASN HA 1 1
2 432 1 1 12 ASN HB2 H 4.261 1.204 -4.214 1.00 . A A . 12 ASN HB2 1 1
2 433 1 1 12 ASN HB3 H 5.385 -0.074 -3.728 1.00 . A A . 12 ASN HB3 1 1
2 434 1 1 12 ASN HD21 H 4.995 -2.286 -4.549 1.00 . A A . 12 ASN HD21 1 1
2 435 1 1 12 ASN HD22 H 4.065 -2.512 -6.014 1.00 . A A . 12 ASN HD22 1 1
2 436 1 1 12 ASN N N 3.429 1.140 -1.763 1.00 . A A . 12 ASN N 1 1
2 437 1 1 12 ASN ND2 N 4.350 -1.929 -5.240 1.00 . A A . 12 ASN ND2 1 1
2 438 1 1 12 ASN O O 4.803 -2.045 -2.106 1.00 . A A . 12 ASN O 1 1
2 439 1 1 12 ASN OD1 O 3.091 -0.251 -5.965 1.00 . A A . 12 ASN OD1 1 1
2 440 1 1 13 SER C C 4.869 -2.525 0.869 1.00 . A A . 13 SER C 1 1
2 441 1 1 13 SER CA C 3.433 -2.654 0.335 1.00 . A A . 13 SER CA 1 1
2 442 1 1 13 SER CB C 2.996 -4.042 -0.240 1.00 . A A . 13 SER CB 1 1
2 443 1 1 13 SER H H 2.417 -0.871 -0.378 1.00 . A A . 13 SER H 1 1
2 444 1 1 13 SER HA H 2.787 -2.481 1.196 1.00 . A A . 13 SER HA 1 1
2 445 1 1 13 SER HB2 H 2.922 -4.753 0.584 1.00 . A A . 13 SER HB2 1 1
2 446 1 1 13 SER HB3 H 2.017 -3.939 -0.706 1.00 . A A . 13 SER HB3 1 1
2 447 1 1 13 SER HG H 3.892 -5.513 -1.186 1.00 . A A . 13 SER HG 1 1
2 448 1 1 13 SER N N 3.166 -1.511 -0.601 1.00 . A A . 13 SER N 1 1
2 449 1 1 13 SER O O 5.716 -3.346 0.536 1.00 . A A . 13 SER O 1 1
2 450 1 1 13 SER OG O 3.914 -4.554 -1.201 1.00 . A A . 13 SER OG 1 1
2 451 1 1 14 SER C C 7.545 -1.115 1.109 1.00 . A A . 14 SER C 1 1
2 452 1 1 14 SER CA C 6.490 -1.192 2.260 1.00 . A A . 14 SER CA 1 1
2 453 1 1 14 SER CB C 6.777 -2.211 3.401 1.00 . A A . 14 SER CB 1 1
2 454 1 1 14 SER H H 4.388 -0.845 1.918 1.00 . A A . 14 SER H 1 1
2 455 1 1 14 SER HA H 6.443 -0.204 2.717 1.00 . A A . 14 SER HA 1 1
2 456 1 1 14 SER HB2 H 5.941 -2.207 4.099 1.00 . A A . 14 SER HB2 1 1
2 457 1 1 14 SER HB3 H 6.882 -3.208 2.973 1.00 . A A . 14 SER HB3 1 1
2 458 1 1 14 SER HG H 8.122 -2.518 4.799 1.00 . A A . 14 SER HG 1 1
2 459 1 1 14 SER N N 5.143 -1.474 1.686 1.00 . A A . 14 SER N 1 1
2 460 1 1 14 SER O O 8.669 -1.582 1.316 1.00 . A A . 14 SER O 1 1
2 461 1 1 14 SER OG O 7.969 -1.876 4.102 1.00 . A A . 14 SER OG 1 1
2 462 1 1 15 SER C C 8.445 -1.842 -1.906 1.00 . A A . 15 SER C 1 1
2 463 1 1 15 SER CA C 8.167 -0.425 -1.255 1.00 . A A . 15 SER CA 1 1
2 464 1 1 15 SER CB C 9.512 0.260 -0.872 1.00 . A A . 15 SER CB 1 1
2 465 1 1 15 SER H H 6.285 -0.095 -0.179 1.00 . A A . 15 SER H 1 1
2 466 1 1 15 SER HA H 7.697 0.194 -2.018 1.00 . A A . 15 SER HA 1 1
2 467 1 1 15 SER HB2 H 9.305 1.118 -0.233 1.00 . A A . 15 SER HB2 1 1
2 468 1 1 15 SER HB3 H 10.134 -0.451 -0.328 1.00 . A A . 15 SER HB3 1 1
2 469 1 1 15 SER HG H 11.035 1.120 -1.770 1.00 . A A . 15 SER HG 1 1
2 470 1 1 15 SER N N 7.204 -0.503 -0.084 1.00 . A A . 15 SER N 1 1
2 471 1 1 15 SER O O 8.986 -1.888 -3.015 1.00 . A A . 15 SER O 1 1
2 472 1 1 15 SER OG O 10.212 0.702 -2.032 1.00 . A A . 15 SER OG 1 1
2 473 1 1 16 SER C C 7.689 -5.446 -0.768 1.00 . A A . 16 SER C 1 1
2 474 1 1 16 SER CA C 8.280 -4.364 -1.727 1.00 . A A . 16 SER CA 1 1
2 475 1 1 16 SER CB C 9.804 -4.674 -1.806 1.00 . A A . 16 SER CB 1 1
2 476 1 1 16 SER H H 7.607 -2.858 -0.358 1.00 . A A . 16 SER H 1 1
2 477 1 1 16 SER HA H 7.836 -4.476 -2.717 1.00 . A A . 16 SER HA 1 1
2 478 1 1 16 SER HB2 H 10.338 -3.765 -2.084 1.00 . A A . 16 SER HB2 1 1
2 479 1 1 16 SER HB3 H 10.152 -5.010 -0.830 1.00 . A A . 16 SER HB3 1 1
2 480 1 1 16 SER HG H 11.015 -5.857 -2.802 1.00 . A A . 16 SER HG 1 1
2 481 1 1 16 SER N N 8.069 -2.974 -1.249 1.00 . A A . 16 SER N 1 1
2 482 1 1 16 SER O O 7.149 -6.443 -1.254 1.00 . A A . 16 SER O 1 1
2 483 1 1 16 SER OG O 10.072 -5.684 -2.772 1.00 . A A . 16 SER OG 1 1
2 484 1 1 17 LEU C C 5.770 -6.144 1.798 1.00 . A A . 17 LEU C 1 1
2 485 1 1 17 LEU CA C 7.313 -6.239 1.580 1.00 . A A . 17 LEU CA 1 1
2 486 1 1 17 LEU CB C 8.186 -6.172 2.876 1.00 . A A . 17 LEU CB 1 1
2 487 1 1 17 LEU CD1 C 10.465 -6.201 4.037 1.00 . A A . 17 LEU CD1 1 1
2 488 1 1 17 LEU CD2 C 9.928 -8.042 2.404 1.00 . A A . 17 LEU CD2 1 1
2 489 1 1 17 LEU CG C 9.700 -6.553 2.746 1.00 . A A . 17 LEU CG 1 1
2 490 1 1 17 LEU H H 8.293 -4.430 0.900 1.00 . A A . 17 LEU H 1 1
2 491 1 1 17 LEU HXT H 4.295 -5.480 2.888 1.00 . A A . 17 LEU HXT 1 1
2 492 1 1 17 LEU HA H 7.491 -7.226 1.154 1.00 . A A . 17 LEU HA 1 1
2 493 1 1 17 LEU HB2 H 8.125 -5.159 3.273 1.00 . A A . 17 LEU HB2 1 1
2 494 1 1 17 LEU HB3 H 7.740 -6.849 3.605 1.00 . A A . 17 LEU HB3 1 1
2 495 1 1 17 LEU HD11 H 10.305 -5.150 4.280 1.00 . A A . 17 LEU HD11 1 1
2 496 1 1 17 LEU HD12 H 10.101 -6.822 4.856 1.00 . A A . 17 LEU HD12 1 1
2 497 1 1 17 LEU HD13 H 11.530 -6.381 3.889 1.00 . A A . 17 LEU HD13 1 1
2 498 1 1 17 LEU HD21 H 9.387 -8.292 1.492 1.00 . A A . 17 LEU HD21 1 1
2 499 1 1 17 LEU HD22 H 10.992 -8.221 2.256 1.00 . A A . 17 LEU HD22 1 1
2 500 1 1 17 LEU HD23 H 9.565 -8.663 3.224 1.00 . A A . 17 LEU HD23 1 1
2 501 1 1 17 LEU HG H 10.123 -5.959 1.937 1.00 . A A . 17 LEU HG 1 1
2 502 1 1 17 LEU N N 7.825 -5.263 0.572 1.00 . A A . 17 LEU N 1 1
2 503 1 1 17 LEU O O 5.004 -6.684 0.997 1.00 . A A . 17 LEU O 1 1
2 504 1 1 17 LEU OXT O 5.255 -5.441 2.903 1.00 . A A . 17 LEU OXT 1 1
3 505 1 1 1 ASN C C -6.571 5.813 -7.702 1.00 . A A . 1 ASN C 1 1
3 506 1 1 1 ASN CA C -6.870 6.719 -8.932 1.00 . A A . 1 ASN CA 1 1
3 507 1 1 1 ASN CB C -8.173 6.277 -9.669 1.00 . A A . 1 ASN CB 1 1
3 508 1 1 1 ASN CG C -8.782 7.337 -10.609 1.00 . A A . 1 ASN CG 1 1
3 509 1 1 1 ASN H1 H -4.896 7.110 -9.395 1.00 . A A . 1 ASN H1 1 1
3 510 1 1 1 ASN H2 H -5.946 7.504 -10.603 1.00 . A A . 1 ASN H2 1 1
3 511 1 1 1 ASN H3 H -5.568 5.923 -10.322 1.00 . A A . 1 ASN H3 1 1
3 512 1 1 1 ASN HA H -7.051 7.723 -8.548 1.00 . A A . 1 ASN HA 1 1
3 513 1 1 1 ASN HB2 H -7.943 5.392 -10.262 1.00 . A A . 1 ASN HB2 1 1
3 514 1 1 1 ASN HB3 H -8.919 6.008 -8.921 1.00 . A A . 1 ASN HB3 1 1
3 515 1 1 1 ASN HD21 H -8.148 6.365 -12.270 1.00 . A A . 1 ASN HD21 1 1
3 516 1 1 1 ASN HD22 H -9.031 7.847 -12.555 1.00 . A A . 1 ASN HD22 1 1
3 517 1 1 1 ASN N N -5.727 6.822 -9.891 1.00 . A A . 1 ASN N 1 1
3 518 1 1 1 ASN ND2 N -8.643 7.170 -11.915 1.00 . A A . 1 ASN ND2 1 1
3 519 1 1 1 ASN O O -6.739 6.257 -6.562 1.00 . A A . 1 ASN O 1 1
3 520 1 1 1 ASN OD1 O -9.385 8.314 -10.163 1.00 . A A . 1 ASN OD1 1 1
3 521 1 1 2 VAL C C -4.487 4.047 -6.044 1.00 . A A . 2 VAL C 1 1
3 522 1 1 2 VAL CA C -5.747 3.595 -6.867 1.00 . A A . 2 VAL CA 1 1
3 523 1 1 2 VAL CB C -5.570 2.138 -7.396 1.00 . A A . 2 VAL CB 1 1
3 524 1 1 2 VAL CG1 C -5.522 1.061 -6.283 1.00 . A A . 2 VAL CG1 1 1
3 525 1 1 2 VAL CG2 C -6.581 1.648 -8.466 1.00 . A A . 2 VAL CG2 1 1
3 526 1 1 2 VAL H H -6.033 4.265 -8.899 1.00 . A A . 2 VAL H 1 1
3 527 1 1 2 VAL HA H -6.582 3.570 -6.166 1.00 . A A . 2 VAL HA 1 1
3 528 1 1 2 VAL HB H -4.592 2.113 -7.877 1.00 . A A . 2 VAL HB 1 1
3 529 1 1 2 VAL HG11 H -4.819 1.369 -5.508 1.00 . A A . 2 VAL HG11 1 1
3 530 1 1 2 VAL HG12 H -5.198 0.112 -6.709 1.00 . A A . 2 VAL HG12 1 1
3 531 1 1 2 VAL HG13 H -6.514 0.944 -5.847 1.00 . A A . 2 VAL HG13 1 1
3 532 1 1 2 VAL HG21 H -6.644 2.381 -9.270 1.00 . A A . 2 VAL HG21 1 1
3 533 1 1 2 VAL HG22 H -6.247 0.693 -8.871 1.00 . A A . 2 VAL HG22 1 1
3 534 1 1 2 VAL HG23 H -7.563 1.525 -8.009 1.00 . A A . 2 VAL HG23 1 1
3 535 1 1 2 VAL N N -6.122 4.563 -7.938 1.00 . A A . 2 VAL N 1 1
3 536 1 1 2 VAL O O -4.388 3.698 -4.867 1.00 . A A . 2 VAL O 1 1
3 537 1 1 3 HIS C C -2.719 6.205 -4.736 1.00 . A A . 3 HIS C 1 1
3 538 1 1 3 HIS CA C -2.303 5.288 -5.937 1.00 . A A . 3 HIS CA 1 1
3 539 1 1 3 HIS CB C -1.360 5.972 -6.962 1.00 . A A . 3 HIS CB 1 1
3 540 1 1 3 HIS CD2 C 0.491 7.092 -5.513 1.00 . A A . 3 HIS CD2 1 1
3 541 1 1 3 HIS CE1 C 2.112 5.862 -6.045 1.00 . A A . 3 HIS CE1 1 1
3 542 1 1 3 HIS CG C 0.062 6.119 -6.432 1.00 . A A . 3 HIS CG 1 1
3 543 1 1 3 HIS H H -3.591 4.942 -7.638 1.00 . A A . 3 HIS H 1 1
3 544 1 1 3 HIS HA H -1.767 4.434 -5.523 1.00 . A A . 3 HIS HA 1 1
3 545 1 1 3 HIS HB2 H -1.336 5.371 -7.871 1.00 . A A . 3 HIS HB2 1 1
3 546 1 1 3 HIS HB3 H -1.753 6.961 -7.201 1.00 . A A . 3 HIS HB3 1 1
3 547 1 1 3 HIS HD2 H -0.141 7.854 -5.081 1.00 . A A . 3 HIS HD2 1 1
3 548 1 1 3 HIS HE1 H 3.114 5.460 -6.080 1.00 . A A . 3 HIS HE1 1 1
3 549 1 1 3 HIS HE2 H 2.441 7.462 -4.629 1.00 . A A . 3 HIS HE2 1 1
3 550 1 1 3 HIS N N -3.505 4.759 -6.649 1.00 . A A . 3 HIS N 1 1
3 551 1 1 3 HIS ND1 N 1.119 5.294 -6.806 1.00 . A A . 3 HIS ND1 1 1
3 552 1 1 3 HIS NE2 N 1.836 6.936 -5.243 1.00 . A A . 3 HIS NE2 1 1
3 553 1 1 3 HIS O O -2.107 6.122 -3.668 1.00 . A A . 3 HIS O 1 1
3 554 1 1 4 THR C C -5.599 7.274 -3.272 1.00 . A A . 4 THR C 1 1
3 555 1 1 4 THR CA C -4.301 7.936 -3.882 1.00 . A A . 4 THR CA 1 1
3 556 1 1 4 THR CB C -4.436 9.401 -4.400 1.00 . A A . 4 THR CB 1 1
3 557 1 1 4 THR CG2 C -5.494 9.648 -5.496 1.00 . A A . 4 THR CG2 1 1
3 558 1 1 4 THR H H -4.148 7.115 -5.856 1.00 . A A . 4 THR H 1 1
3 559 1 1 4 THR HA H -3.564 7.961 -3.080 1.00 . A A . 4 THR HA 1 1
3 560 1 1 4 THR HB H -3.468 9.699 -4.803 1.00 . A A . 4 THR HB 1 1
3 561 1 1 4 THR HG1 H -4.696 11.174 -3.594 1.00 . A A . 4 THR HG1 1 1
3 562 1 1 4 THR HG21 H -5.492 10.702 -5.772 1.00 . A A . 4 THR HG21 1 1
3 563 1 1 4 THR HG22 H -5.257 9.043 -6.371 1.00 . A A . 4 THR HG22 1 1
3 564 1 1 4 THR HG23 H -6.479 9.373 -5.119 1.00 . A A . 4 THR HG23 1 1
3 565 1 1 4 THR N N -3.742 7.065 -4.933 1.00 . A A . 4 THR N 1 1
3 566 1 1 4 THR O O -6.538 7.982 -2.890 1.00 . A A . 4 THR O 1 1
3 567 1 1 4 THR OG1 O -4.728 10.260 -3.302 1.00 . A A . 4 THR OG1 1 1
3 568 1 1 5 PHE C C -6.629 5.326 -1.005 1.00 . A A . 5 PHE C 1 1
3 569 1 1 5 PHE CA C -6.753 5.155 -2.539 1.00 . A A . 5 PHE CA 1 1
3 570 1 1 5 PHE CB C -6.834 3.686 -3.059 1.00 . A A . 5 PHE CB 1 1
3 571 1 1 5 PHE CD1 C -9.307 3.177 -2.617 1.00 . A A . 5 PHE CD1 1 1
3 572 1 1 5 PHE CD2 C -7.652 1.583 -1.874 1.00 . A A . 5 PHE CD2 1 1
3 573 1 1 5 PHE CE1 C -10.316 2.362 -2.109 1.00 . A A . 5 PHE CE1 1 1
3 574 1 1 5 PHE CE2 C -8.663 0.766 -1.376 1.00 . A A . 5 PHE CE2 1 1
3 575 1 1 5 PHE CG C -7.963 2.798 -2.496 1.00 . A A . 5 PHE CG 1 1
3 576 1 1 5 PHE CZ C -9.993 1.158 -1.489 1.00 . A A . 5 PHE CZ 1 1
3 577 1 1 5 PHE H H -4.836 5.395 -3.466 1.00 . A A . 5 PHE H 1 1
3 578 1 1 5 PHE HA H -7.675 5.652 -2.842 1.00 . A A . 5 PHE HA 1 1
3 579 1 1 5 PHE HB2 H -6.959 3.728 -4.141 1.00 . A A . 5 PHE HB2 1 1
3 580 1 1 5 PHE HB3 H -5.882 3.199 -2.847 1.00 . A A . 5 PHE HB3 1 1
3 581 1 1 5 PHE HD1 H -9.562 4.105 -3.106 1.00 . A A . 5 PHE HD1 1 1
3 582 1 1 5 PHE HD2 H -6.620 1.277 -1.780 1.00 . A A . 5 PHE HD2 1 1
3 583 1 1 5 PHE HE1 H -11.349 2.665 -2.196 1.00 . A A . 5 PHE HE1 1 1
3 584 1 1 5 PHE HE2 H -8.415 -0.172 -0.902 1.00 . A A . 5 PHE HE2 1 1
3 585 1 1 5 PHE HZ H -10.777 0.527 -1.096 1.00 . A A . 5 PHE HZ 1 1
3 586 1 1 5 PHE N N -5.634 5.918 -3.135 1.00 . A A . 5 PHE N 1 1
3 587 1 1 5 PHE O O -7.383 6.083 -0.389 1.00 . A A . 5 PHE O 1 1
3 588 1 1 6 ARG C C -3.763 4.683 1.178 1.00 . A A . 6 ARG C 1 1
3 589 1 1 6 ARG CA C -5.306 4.631 1.008 1.00 . A A . 6 ARG CA 1 1
3 590 1 1 6 ARG CB C -5.917 3.404 1.721 1.00 . A A . 6 ARG CB 1 1
3 591 1 1 6 ARG CD C -8.069 2.026 1.934 1.00 . A A . 6 ARG CD 1 1
3 592 1 1 6 ARG CG C -7.452 3.372 1.592 1.00 . A A . 6 ARG CG 1 1
3 593 1 1 6 ARG CZ C -8.708 0.643 3.919 1.00 . A A . 6 ARG CZ 1 1
3 594 1 1 6 ARG H H -5.121 3.986 -1.030 1.00 . A A . 6 ARG H 1 1
3 595 1 1 6 ARG HA H -5.732 5.533 1.447 1.00 . A A . 6 ARG HA 1 1
3 596 1 1 6 ARG HB2 H -5.503 2.495 1.284 1.00 . A A . 6 ARG HB2 1 1
3 597 1 1 6 ARG HB3 H -5.653 3.443 2.778 1.00 . A A . 6 ARG HB3 1 1
3 598 1 1 6 ARG HD2 H -9.067 1.986 1.496 1.00 . A A . 6 ARG HD2 1 1
3 599 1 1 6 ARG HD3 H -7.461 1.240 1.488 1.00 . A A . 6 ARG HD3 1 1
3 600 1 1 6 ARG HE H -7.859 2.481 4.023 1.00 . A A . 6 ARG HE 1 1
3 601 1 1 6 ARG HG2 H -7.869 4.121 2.265 1.00 . A A . 6 ARG HG2 1 1
3 602 1 1 6 ARG HG3 H -7.723 3.631 0.568 1.00 . A A . 6 ARG HG3 1 1
3 603 1 1 6 ARG HH11 H -8.403 1.295 5.812 1.00 . A A . 6 ARG HH11 1 1
3 604 1 1 6 ARG HH12 H -9.133 -0.288 5.666 1.00 . A A . 6 ARG HH12 1 1
3 605 1 1 6 ARG HH21 H -9.157 -0.327 2.188 1.00 . A A . 6 ARG HH21 1 1
3 606 1 1 6 ARG HH22 H -9.552 -1.189 3.658 1.00 . A A . 6 ARG HH22 1 1
3 607 1 1 6 ARG N N -5.656 4.600 -0.433 1.00 . A A . 6 ARG N 1 1
3 608 1 1 6 ARG NE N -8.189 1.768 3.388 1.00 . A A . 6 ARG NE 1 1
3 609 1 1 6 ARG NH1 N -8.751 0.542 5.235 1.00 . A A . 6 ARG NH1 1 1
3 610 1 1 6 ARG NH2 N -9.177 -0.373 3.197 1.00 . A A . 6 ARG NH2 1 1
3 611 1 1 6 ARG O O -3.176 3.988 2.014 1.00 . A A . 6 ARG O 1 1
3 612 1 1 7 GLY C C -0.867 4.690 -0.368 1.00 . A A . 7 GLY C 1 1
3 613 1 1 7 GLY CA C -1.686 5.782 0.365 1.00 . A A . 7 GLY CA 1 1
3 614 1 1 7 GLY H H -3.722 6.126 -0.237 1.00 . A A . 7 GLY H 1 1
3 615 1 1 7 GLY HA2 H -1.490 6.736 -0.125 1.00 . A A . 7 GLY HA2 1 1
3 616 1 1 7 GLY HA3 H -1.333 5.845 1.395 1.00 . A A . 7 GLY HA3 1 1
3 617 1 1 7 GLY N N -3.152 5.570 0.384 1.00 . A A . 7 GLY N 1 1
3 618 1 1 7 GLY O O 0.278 4.442 0.019 1.00 . A A . 7 GLY O 1 1
3 619 1 1 8 ASP C C -0.350 1.732 -1.405 1.00 . A A . 8 ASP C 1 1
3 620 1 1 8 ASP CA C -0.782 2.991 -2.227 1.00 . A A . 8 ASP CA 1 1
3 621 1 1 8 ASP CB C 0.325 3.604 -3.144 1.00 . A A . 8 ASP CB 1 1
3 622 1 1 8 ASP CG C 0.784 2.733 -4.323 1.00 . A A . 8 ASP CG 1 1
3 623 1 1 8 ASP H H -2.373 4.351 -1.690 1.00 . A A . 8 ASP H 1 1
3 624 1 1 8 ASP HA H -1.552 2.634 -2.911 1.00 . A A . 8 ASP HA 1 1
3 625 1 1 8 ASP HB2 H -0.060 4.540 -3.551 1.00 . A A . 8 ASP HB2 1 1
3 626 1 1 8 ASP HB3 H 1.195 3.831 -2.527 1.00 . A A . 8 ASP HB3 1 1
3 627 1 1 8 ASP N N -1.440 4.069 -1.425 1.00 . A A . 8 ASP N 1 1
3 628 1 1 8 ASP O O 0.650 1.094 -1.726 1.00 . A A . 8 ASP O 1 1
3 629 1 1 8 ASP OD1 O 1.926 2.289 -4.431 1.00 . A A . 8 ASP OD1 1 1
3 630 1 1 8 ASP OD2 O -0.215 2.526 -5.240 1.00 . A A . 8 ASP OD2 1 1
3 631 1 1 9 ASN C C 0.502 0.236 1.248 1.00 . A A . 9 ASN C 1 1
3 632 1 1 9 ASN CA C -0.849 0.147 0.480 1.00 . A A . 9 ASN CA 1 1
3 633 1 1 9 ASN CB C -1.158 -1.159 -0.305 1.00 . A A . 9 ASN CB 1 1
3 634 1 1 9 ASN CG C -1.303 -2.439 0.541 1.00 . A A . 9 ASN CG 1 1
3 635 1 1 9 ASN H H -1.992 1.841 -0.214 1.00 . A A . 9 ASN H 1 1
3 636 1 1 9 ASN HA H -1.611 0.185 1.259 1.00 . A A . 9 ASN HA 1 1
3 637 1 1 9 ASN HB2 H -2.082 -1.012 -0.865 1.00 . A A . 9 ASN HB2 1 1
3 638 1 1 9 ASN HB3 H -0.348 -1.320 -1.016 1.00 . A A . 9 ASN HB3 1 1
3 639 1 1 9 ASN HD21 H -3.256 -2.062 0.924 1.00 . A A . 9 ASN HD21 1 1
3 640 1 1 9 ASN HD22 H -2.618 -3.528 1.633 1.00 . A A . 9 ASN HD22 1 1
3 641 1 1 9 ASN N N -1.145 1.321 -0.392 1.00 . A A . 9 ASN N 1 1
3 642 1 1 9 ASN ND2 N -2.486 -2.697 1.075 1.00 . A A . 9 ASN ND2 1 1
3 643 1 1 9 ASN O O 1.233 -0.741 1.361 1.00 . A A . 9 ASN O 1 1
3 644 1 1 9 ASN OD1 O -0.355 -3.205 0.713 1.00 . A A . 9 ASN OD1 1 1
3 645 1 1 10 VAL C C 3.251 1.840 1.716 1.00 . A A . 10 VAL C 1 1
3 646 1 1 10 VAL CA C 1.981 1.755 2.613 1.00 . A A . 10 VAL CA 1 1
3 647 1 1 10 VAL CB C 2.086 1.106 4.045 1.00 . A A . 10 VAL CB 1 1
3 648 1 1 10 VAL CG1 C 2.433 -0.394 4.142 1.00 . A A . 10 VAL CG1 1 1
3 649 1 1 10 VAL CG2 C 3.042 1.906 4.963 1.00 . A A . 10 VAL CG2 1 1
3 650 1 1 10 VAL H H 0.061 2.143 1.737 1.00 . A A . 10 VAL H 1 1
3 651 1 1 10 VAL HA H 1.810 2.803 2.856 1.00 . A A . 10 VAL HA 1 1
3 652 1 1 10 VAL HB H 1.096 1.210 4.489 1.00 . A A . 10 VAL HB 1 1
3 653 1 1 10 VAL HG11 H 1.764 -0.965 3.499 1.00 . A A . 10 VAL HG11 1 1
3 654 1 1 10 VAL HG12 H 2.317 -0.728 5.173 1.00 . A A . 10 VAL HG12 1 1
3 655 1 1 10 VAL HG13 H 3.464 -0.550 3.824 1.00 . A A . 10 VAL HG13 1 1
3 656 1 1 10 VAL HG21 H 2.803 2.968 4.900 1.00 . A A . 10 VAL HG21 1 1
3 657 1 1 10 VAL HG22 H 2.925 1.568 5.992 1.00 . A A . 10 VAL HG22 1 1
3 658 1 1 10 VAL HG23 H 4.072 1.746 4.643 1.00 . A A . 10 VAL HG23 1 1
3 659 1 1 10 VAL N N 0.759 1.419 1.834 1.00 . A A . 10 VAL N 1 1
3 660 1 1 10 VAL O O 4.283 1.229 1.978 1.00 . A A . 10 VAL O 1 1
3 661 1 1 11 HIS C C 4.540 1.719 -1.189 1.00 . A A . 11 HIS C 1 1
3 662 1 1 11 HIS CA C 4.213 2.975 -0.328 1.00 . A A . 11 HIS CA 1 1
3 663 1 1 11 HIS CB C 5.473 3.680 0.302 1.00 . A A . 11 HIS CB 1 1
3 664 1 1 11 HIS CD2 C 6.360 5.852 1.360 1.00 . A A . 11 HIS CD2 1 1
3 665 1 1 11 HIS CE1 C 4.730 7.142 1.054 1.00 . A A . 11 HIS CE1 1 1
3 666 1 1 11 HIS CG C 5.321 5.147 0.729 1.00 . A A . 11 HIS CG 1 1
3 667 1 1 11 HIS H H 2.272 3.217 0.596 1.00 . A A . 11 HIS H 1 1
3 668 1 1 11 HIS HA H 3.787 3.701 -1.020 1.00 . A A . 11 HIS HA 1 1
3 669 1 1 11 HIS HB2 H 5.759 3.110 1.186 1.00 . A A . 11 HIS HB2 1 1
3 670 1 1 11 HIS HB3 H 6.289 3.620 -0.418 1.00 . A A . 11 HIS HB3 1 1
3 671 1 1 11 HIS HD2 H 7.316 5.427 1.629 1.00 . A A . 11 HIS HD2 1 1
3 672 1 1 11 HIS HE1 H 4.128 8.039 1.061 1.00 . A A . 11 HIS HE1 1 1
3 673 1 1 11 HIS HE2 H 6.501 7.916 2.021 1.00 . A A . 11 HIS HE2 1 1
3 674 1 1 11 HIS N N 3.140 2.709 0.688 1.00 . A A . 11 HIS N 1 1
3 675 1 1 11 HIS ND1 N 4.227 5.983 0.509 1.00 . A A . 11 HIS ND1 1 1
3 676 1 1 11 HIS NE2 N 5.990 7.161 1.587 1.00 . A A . 11 HIS NE2 1 1
3 677 1 1 11 HIS O O 5.707 1.423 -1.441 1.00 . A A . 11 HIS O 1 1
3 678 1 1 12 ASN C C 3.986 -1.386 -1.658 1.00 . A A . 12 ASN C 1 1
3 679 1 1 12 ASN CA C 3.614 -0.177 -2.568 1.00 . A A . 12 ASN CA 1 1
3 680 1 1 12 ASN CB C 4.463 0.018 -3.866 1.00 . A A . 12 ASN CB 1 1
3 681 1 1 12 ASN CG C 4.142 -1.007 -4.967 1.00 . A A . 12 ASN CG 1 1
3 682 1 1 12 ASN H H 2.573 1.409 -1.567 1.00 . A A . 12 ASN H 1 1
3 683 1 1 12 ASN HA H 2.602 -0.382 -2.916 1.00 . A A . 12 ASN HA 1 1
3 684 1 1 12 ASN HB2 H 4.284 1.020 -4.256 1.00 . A A . 12 ASN HB2 1 1
3 685 1 1 12 ASN HB3 H 5.518 -0.075 -3.606 1.00 . A A . 12 ASN HB3 1 1
3 686 1 1 12 ASN HD21 H 2.433 -0.034 -5.466 1.00 . A A . 12 ASN HD21 1 1
3 687 1 1 12 ASN HD22 H 2.772 -1.485 -6.384 1.00 . A A . 12 ASN HD22 1 1
3 688 1 1 12 ASN N N 3.500 1.047 -1.737 1.00 . A A . 12 ASN N 1 1
3 689 1 1 12 ASN ND2 N 3.027 -0.828 -5.661 1.00 . A A . 12 ASN ND2 1 1
3 690 1 1 12 ASN O O 4.899 -2.145 -1.998 1.00 . A A . 12 ASN O 1 1
3 691 1 1 12 ASN OD1 O 4.870 -1.975 -5.178 1.00 . A A . 12 ASN OD1 1 1
3 692 1 1 13 SER C C 4.950 -2.540 0.995 1.00 . A A . 13 SER C 1 1
3 693 1 1 13 SER CA C 3.518 -2.689 0.457 1.00 . A A . 13 SER CA 1 1
3 694 1 1 13 SER CB C 3.087 -4.094 -0.082 1.00 . A A . 13 SER CB 1 1
3 695 1 1 13 SER H H 2.505 -0.929 -0.312 1.00 . A A . 13 SER H 1 1
3 696 1 1 13 SER HA H 2.866 -2.492 1.308 1.00 . A A . 13 SER HA 1 1
3 697 1 1 13 SER HB2 H 3.006 -4.781 0.760 1.00 . A A . 13 SER HB2 1 1
3 698 1 1 13 SER HB3 H 2.111 -4.005 -0.561 1.00 . A A . 13 SER HB3 1 1
3 699 1 1 13 SER HG H 3.996 -5.590 -0.976 1.00 . A A . 13 SER HG 1 1
3 700 1 1 13 SER N N 3.257 -1.574 -0.513 1.00 . A A . 13 SER N 1 1
3 701 1 1 13 SER O O 5.804 -3.363 0.689 1.00 . A A . 13 SER O 1 1
3 702 1 1 13 SER OG O 4.014 -4.631 -1.020 1.00 . A A . 13 SER OG 1 1
3 703 1 1 14 SER C C 7.613 -1.104 1.216 1.00 . A A . 14 SER C 1 1
3 704 1 1 14 SER CA C 6.552 -1.161 2.363 1.00 . A A . 14 SER CA 1 1
3 705 1 1 14 SER CB C 6.839 -2.147 3.531 1.00 . A A . 14 SER CB 1 1
3 706 1 1 14 SER H H 4.451 -0.836 1.998 1.00 . A A . 14 SER H 1 1
3 707 1 1 14 SER HA H 6.495 -0.162 2.794 1.00 . A A . 14 SER HA 1 1
3 708 1 1 14 SER HB2 H 5.998 -2.130 4.225 1.00 . A A . 14 SER HB2 1 1
3 709 1 1 14 SER HB3 H 6.953 -3.154 3.131 1.00 . A A . 14 SER HB3 1 1
3 710 1 1 14 SER HG H 8.178 -2.408 4.945 1.00 . A A . 14 SER HG 1 1
3 711 1 1 14 SER N N 5.211 -1.466 1.787 1.00 . A A . 14 SER N 1 1
3 712 1 1 14 SER O O 8.739 -1.562 1.439 1.00 . A A . 14 SER O 1 1
3 713 1 1 14 SER OG O 8.024 -1.785 4.231 1.00 . A A . 14 SER OG 1 1
3 714 1 1 15 SER C C 8.526 -1.904 -1.779 1.00 . A A . 15 SER C 1 1
3 715 1 1 15 SER CA C 8.243 -0.474 -1.163 1.00 . A A . 15 SER CA 1 1
3 716 1 1 15 SER CB C 9.582 0.228 -0.794 1.00 . A A . 15 SER CB 1 1
3 717 1 1 15 SER H H 6.353 -0.129 -0.105 1.00 . A A . 15 SER H 1 1
3 718 1 1 15 SER HA H 7.771 0.124 -1.944 1.00 . A A . 15 SER HA 1 1
3 719 1 1 15 SER HB2 H 9.372 1.099 -0.175 1.00 . A A . 15 SER HB2 1 1
3 720 1 1 15 SER HB3 H 10.206 -0.468 -0.233 1.00 . A A . 15 SER HB3 1 1
3 721 1 1 15 SER HG H 11.105 1.072 -1.709 1.00 . A A . 15 SER HG 1 1
3 722 1 1 15 SER N N 7.275 -0.528 0.005 1.00 . A A . 15 SER N 1 1
3 723 1 1 15 SER O O 9.065 -1.976 -2.888 1.00 . A A . 15 SER O 1 1
3 724 1 1 15 SER OG O 10.284 0.643 -1.963 1.00 . A A . 15 SER OG 1 1
3 725 1 1 16 SER C C 7.801 -5.477 -0.531 1.00 . A A . 16 SER C 1 1
3 726 1 1 16 SER CA C 8.374 -4.423 -1.530 1.00 . A A . 16 SER CA 1 1
3 727 1 1 16 SER CB C 9.899 -4.727 -1.612 1.00 . A A . 16 SER CB 1 1
3 728 1 1 16 SER H H 7.695 -2.882 -0.204 1.00 . A A . 16 SER H 1 1
3 729 1 1 16 SER HA H 7.922 -4.569 -2.511 1.00 . A A . 16 SER HA 1 1
3 730 1 1 16 SER HB2 H 10.428 -3.825 -1.920 1.00 . A A . 16 SER HB2 1 1
3 731 1 1 16 SER HB3 H 10.255 -5.033 -0.629 1.00 . A A . 16 SER HB3 1 1
3 732 1 1 16 SER HG H 11.109 -5.934 -2.579 1.00 . A A . 16 SER HG 1 1
3 733 1 1 16 SER N N 8.157 -3.020 -1.091 1.00 . A A . 16 SER N 1 1
3 734 1 1 16 SER O O 7.260 -6.495 -0.977 1.00 . A A . 16 SER O 1 1
3 735 1 1 16 SER OG O 10.165 -5.766 -2.547 1.00 . A A . 16 SER OG 1 1
3 736 1 1 17 LEU C C 5.941 -6.028 2.167 1.00 . A A . 17 LEU C 1 1
3 737 1 1 17 LEU CA C 7.454 -6.195 1.846 1.00 . A A . 17 LEU CA 1 1
3 738 1 1 17 LEU CB C 8.325 -6.075 3.135 1.00 . A A . 17 LEU CB 1 1
3 739 1 1 17 LEU CD1 C 10.609 -6.049 4.288 1.00 . A A . 17 LEU CD1 1 1
3 740 1 1 17 LEU CD2 C 10.069 -7.959 2.738 1.00 . A A . 17 LEU CD2 1 1
3 741 1 1 17 LEU CG C 9.839 -6.458 3.016 1.00 . A A . 17 LEU CG 1 1
3 742 1 1 17 LEU H H 8.414 -4.402 1.096 1.00 . A A . 17 LEU H 1 1
3 743 1 1 17 LEU HXT H 4.129 -6.663 1.826 1.00 . A A . 17 LEU HXT 1 1
3 744 1 1 17 LEU HA H 7.591 -7.204 1.458 1.00 . A A . 17 LEU HA 1 1
3 745 1 1 17 LEU HB2 H 8.275 -5.039 3.469 1.00 . A A . 17 LEU HB2 1 1
3 746 1 1 17 LEU HB3 H 7.877 -6.701 3.906 1.00 . A A . 17 LEU HB3 1 1
3 747 1 1 17 LEU HD11 H 10.447 -4.989 4.486 1.00 . A A . 17 LEU HD11 1 1
3 748 1 1 17 LEU HD12 H 11.673 -6.233 4.143 1.00 . A A . 17 LEU HD12 1 1
3 749 1 1 17 LEU HD13 H 10.251 -6.635 5.134 1.00 . A A . 17 LEU HD13 1 1
3 750 1 1 17 LEU HD21 H 9.525 -8.250 1.839 1.00 . A A . 17 LEU HD21 1 1
3 751 1 1 17 LEU HD22 H 9.710 -8.545 3.584 1.00 . A A . 17 LEU HD22 1 1
3 752 1 1 17 LEU HD23 H 11.133 -8.143 2.593 1.00 . A A . 17 LEU HD23 1 1
3 753 1 1 17 LEU HG H 10.258 -5.898 2.180 1.00 . A A . 17 LEU HG 1 1
3 754 1 1 17 LEU N N 7.949 -5.248 0.801 1.00 . A A . 17 LEU N 1 1
3 755 1 1 17 LEU O O 5.522 -5.177 2.953 1.00 . A A . 17 LEU O 1 1
3 756 1 1 17 LEU OXT O 5.017 -6.880 1.534 1.00 . A A . 17 LEU OXT 1 1
4 757 1 1 1 ASN C C -9.397 -1.070 0.897 1.00 . A A . 1 ASN C 1 1
4 758 1 1 1 ASN CA C -9.594 -2.471 1.539 1.00 . A A . 1 ASN CA 1 1
4 759 1 1 1 ASN CB C -10.905 -3.231 1.149 1.00 . A A . 1 ASN CB 1 1
4 760 1 1 1 ASN CG C -10.983 -3.633 -0.338 1.00 . A A . 1 ASN CG 1 1
4 761 1 1 1 ASN H1 H -8.635 -1.853 3.258 1.00 . A A . 1 ASN H1 1 1
4 762 1 1 1 ASN H2 H -10.280 -1.832 3.376 1.00 . A A . 1 ASN H2 1 1
4 763 1 1 1 ASN H3 H -9.467 -3.266 3.438 1.00 . A A . 1 ASN H3 1 1
4 764 1 1 1 ASN HA H -8.759 -3.090 1.212 1.00 . A A . 1 ASN HA 1 1
4 765 1 1 1 ASN HB2 H -10.967 -4.137 1.752 1.00 . A A . 1 ASN HB2 1 1
4 766 1 1 1 ASN HB3 H -11.759 -2.597 1.384 1.00 . A A . 1 ASN HB3 1 1
4 767 1 1 1 ASN HD21 H -12.280 -2.137 -0.772 1.00 . A A . 1 ASN HD21 1 1
4 768 1 1 1 ASN HD22 H -11.832 -3.160 -2.118 1.00 . A A . 1 ASN HD22 1 1
4 769 1 1 1 ASN N N -9.485 -2.345 3.023 1.00 . A A . 1 ASN N 1 1
4 770 1 1 1 ASN ND2 N -11.760 -2.920 -1.139 1.00 . A A . 1 ASN ND2 1 1
4 771 1 1 1 ASN O O -8.343 -0.816 0.303 1.00 . A A . 1 ASN O 1 1
4 772 1 1 1 ASN OD1 O -10.345 -4.591 -0.773 1.00 . A A . 1 ASN OD1 1 1
4 773 1 1 2 VAL C C -9.289 2.102 1.313 1.00 . A A . 2 VAL C 1 1
4 774 1 1 2 VAL CA C -10.319 1.220 0.509 1.00 . A A . 2 VAL CA 1 1
4 775 1 1 2 VAL CB C -11.702 1.929 0.463 1.00 . A A . 2 VAL CB 1 1
4 776 1 1 2 VAL CG1 C -11.736 3.183 -0.445 1.00 . A A . 2 VAL CG1 1 1
4 777 1 1 2 VAL CG2 C -12.945 1.068 0.109 1.00 . A A . 2 VAL CG2 1 1
4 778 1 1 2 VAL H H -11.234 -0.465 1.505 1.00 . A A . 2 VAL H 1 1
4 779 1 1 2 VAL HA H -9.956 1.161 -0.517 1.00 . A A . 2 VAL HA 1 1
4 780 1 1 2 VAL HB H -11.878 2.295 1.475 1.00 . A A . 2 VAL HB 1 1
4 781 1 1 2 VAL HG11 H -10.876 3.815 -0.224 1.00 . A A . 2 VAL HG11 1 1
4 782 1 1 2 VAL HG12 H -12.654 3.742 -0.258 1.00 . A A . 2 VAL HG12 1 1
4 783 1 1 2 VAL HG13 H -11.704 2.876 -1.490 1.00 . A A . 2 VAL HG13 1 1
4 784 1 1 2 VAL HG21 H -12.956 0.172 0.730 1.00 . A A . 2 VAL HG21 1 1
4 785 1 1 2 VAL HG22 H -12.900 0.781 -0.942 1.00 . A A . 2 VAL HG22 1 1
4 786 1 1 2 VAL HG23 H -13.851 1.646 0.289 1.00 . A A . 2 VAL HG23 1 1
4 787 1 1 2 VAL N N -10.392 -0.176 1.028 1.00 . A A . 2 VAL N 1 1
4 788 1 1 2 VAL O O -8.789 3.085 0.770 1.00 . A A . 2 VAL O 1 1
4 789 1 1 3 HIS C C -6.609 2.524 2.764 1.00 . A A . 3 HIS C 1 1
4 790 1 1 3 HIS CA C -8.022 2.560 3.441 1.00 . A A . 3 HIS CA 1 1
4 791 1 1 3 HIS CB C -8.050 2.032 4.903 1.00 . A A . 3 HIS CB 1 1
4 792 1 1 3 HIS CD2 C -7.486 4.401 5.779 1.00 . A A . 3 HIS CD2 1 1
4 793 1 1 3 HIS CE1 C -6.265 3.879 7.411 1.00 . A A . 3 HIS CE1 1 1
4 794 1 1 3 HIS CG C -7.378 3.004 5.861 1.00 . A A . 3 HIS CG 1 1
4 795 1 1 3 HIS H H -9.545 1.072 3.054 1.00 . A A . 3 HIS H 1 1
4 796 1 1 3 HIS HA H -8.336 3.604 3.471 1.00 . A A . 3 HIS HA 1 1
4 797 1 1 3 HIS HB2 H -9.087 1.894 5.209 1.00 . A A . 3 HIS HB2 1 1
4 798 1 1 3 HIS HB3 H -7.535 1.073 4.946 1.00 . A A . 3 HIS HB3 1 1
4 799 1 1 3 HIS HD2 H -8.056 4.934 5.033 1.00 . A A . 3 HIS HD2 1 1
4 800 1 1 3 HIS HE1 H -5.629 3.981 8.278 1.00 . A A . 3 HIS HE1 1 1
4 801 1 1 3 HIS HE2 H -6.628 5.973 7.010 1.00 . A A . 3 HIS HE2 1 1
4 802 1 1 3 HIS N N -9.029 1.822 2.616 1.00 . A A . 3 HIS N 1 1
4 803 1 1 3 HIS ND1 N -6.577 2.628 6.935 1.00 . A A . 3 HIS ND1 1 1
4 804 1 1 3 HIS NE2 N -6.759 4.996 6.790 1.00 . A A . 3 HIS NE2 1 1
4 805 1 1 3 HIS O O -5.915 3.544 2.724 1.00 . A A . 3 HIS O 1 1
4 806 1 1 4 THR C C -5.119 1.459 -0.063 1.00 . A A . 4 THR C 1 1
4 807 1 1 4 THR CA C -4.971 1.128 1.480 1.00 . A A . 4 THR CA 1 1
4 808 1 1 4 THR CB C -4.511 -0.340 1.734 1.00 . A A . 4 THR CB 1 1
4 809 1 1 4 THR CG2 C -4.000 -0.622 3.159 1.00 . A A . 4 THR CG2 1 1
4 810 1 1 4 THR H H -6.842 0.559 2.340 1.00 . A A . 4 THR H 1 1
4 811 1 1 4 THR HA H -4.213 1.793 1.894 1.00 . A A . 4 THR HA 1 1
4 812 1 1 4 THR HB H -3.679 -0.531 1.057 1.00 . A A . 4 THR HB 1 1
4 813 1 1 4 THR HG1 H -5.856 -1.115 0.524 1.00 . A A . 4 THR HG1 1 1
4 814 1 1 4 THR HG21 H -3.703 -1.668 3.238 1.00 . A A . 4 THR HG21 1 1
4 815 1 1 4 THR HG22 H -3.142 0.016 3.370 1.00 . A A . 4 THR HG22 1 1
4 816 1 1 4 THR HG23 H -4.793 -0.414 3.877 1.00 . A A . 4 THR HG23 1 1
4 817 1 1 4 THR N N -6.223 1.349 2.225 1.00 . A A . 4 THR N 1 1
4 818 1 1 4 THR O O -4.250 1.098 -0.860 1.00 . A A . 4 THR O 1 1
4 819 1 1 4 THR OG1 O -5.532 -1.284 1.412 1.00 . A A . 4 THR OG1 1 1
4 820 1 1 5 PHE C C -5.601 3.792 -2.292 1.00 . A A . 5 PHE C 1 1
4 821 1 1 5 PHE CA C -6.464 2.594 -1.867 1.00 . A A . 5 PHE CA 1 1
4 822 1 1 5 PHE CB C -7.967 2.843 -2.128 1.00 . A A . 5 PHE CB 1 1
4 823 1 1 5 PHE CD1 C -8.301 1.974 -4.512 1.00 . A A . 5 PHE CD1 1 1
4 824 1 1 5 PHE CD2 C -9.009 4.225 -4.004 1.00 . A A . 5 PHE CD2 1 1
4 825 1 1 5 PHE CE1 C -8.728 2.138 -5.829 1.00 . A A . 5 PHE CE1 1 1
4 826 1 1 5 PHE CE2 C -9.434 4.388 -5.321 1.00 . A A . 5 PHE CE2 1 1
4 827 1 1 5 PHE CG C -8.430 3.020 -3.590 1.00 . A A . 5 PHE CG 1 1
4 828 1 1 5 PHE CZ C -9.292 3.345 -6.232 1.00 . A A . 5 PHE CZ 1 1
4 829 1 1 5 PHE H H -6.884 2.412 0.219 1.00 . A A . 5 PHE H 1 1
4 830 1 1 5 PHE HA H -6.174 1.762 -2.509 1.00 . A A . 5 PHE HA 1 1
4 831 1 1 5 PHE HB2 H -8.525 2.012 -1.697 1.00 . A A . 5 PHE HB2 1 1
4 832 1 1 5 PHE HB3 H -8.243 3.749 -1.588 1.00 . A A . 5 PHE HB3 1 1
4 833 1 1 5 PHE HD1 H -7.869 1.034 -4.201 1.00 . A A . 5 PHE HD1 1 1
4 834 1 1 5 PHE HD2 H -9.128 5.034 -3.299 1.00 . A A . 5 PHE HD2 1 1
4 835 1 1 5 PHE HE1 H -8.620 1.329 -6.536 1.00 . A A . 5 PHE HE1 1 1
4 836 1 1 5 PHE HE2 H -9.873 5.323 -5.635 1.00 . A A . 5 PHE HE2 1 1
4 837 1 1 5 PHE HZ H -9.620 3.472 -7.253 1.00 . A A . 5 PHE HZ 1 1
4 838 1 1 5 PHE N N -6.199 2.162 -0.480 1.00 . A A . 5 PHE N 1 1
4 839 1 1 5 PHE O O -4.852 3.710 -3.271 1.00 . A A . 5 PHE O 1 1
4 840 1 1 6 ARG C C -3.583 6.294 -1.125 1.00 . A A . 6 ARG C 1 1
4 841 1 1 6 ARG CA C -4.984 6.143 -1.722 1.00 . A A . 6 ARG CA 1 1
4 842 1 1 6 ARG CB C -5.989 7.307 -1.484 1.00 . A A . 6 ARG CB 1 1
4 843 1 1 6 ARG CD C -8.331 8.243 -2.244 1.00 . A A . 6 ARG CD 1 1
4 844 1 1 6 ARG CG C -7.376 7.050 -2.155 1.00 . A A . 6 ARG CG 1 1
4 845 1 1 6 ARG CZ C -9.644 9.746 -0.726 1.00 . A A . 6 ARG CZ 1 1
4 846 1 1 6 ARG H H -6.315 4.808 -0.696 1.00 . A A . 6 ARG H 1 1
4 847 1 1 6 ARG HA H -4.813 6.162 -2.799 1.00 . A A . 6 ARG HA 1 1
4 848 1 1 6 ARG HB2 H -6.134 7.436 -0.411 1.00 . A A . 6 ARG HB2 1 1
4 849 1 1 6 ARG HB3 H -5.566 8.224 -1.895 1.00 . A A . 6 ARG HB3 1 1
4 850 1 1 6 ARG HD2 H -7.812 9.067 -2.733 1.00 . A A . 6 ARG HD2 1 1
4 851 1 1 6 ARG HD3 H -9.192 7.960 -2.849 1.00 . A A . 6 ARG HD3 1 1
4 852 1 1 6 ARG HE H -8.484 8.207 -0.100 1.00 . A A . 6 ARG HE 1 1
4 853 1 1 6 ARG HG2 H -7.191 6.700 -3.171 1.00 . A A . 6 ARG HG2 1 1
4 854 1 1 6 ARG HG3 H -7.877 6.253 -1.607 1.00 . A A . 6 ARG HG3 1 1
4 855 1 1 6 ARG HH11 H -9.905 10.281 -2.672 1.00 . A A . 6 ARG HH11 1 1
4 856 1 1 6 ARG HH12 H -10.768 11.254 -1.501 1.00 . A A . 6 ARG HH12 1 1
4 857 1 1 6 ARG HH21 H -9.621 9.505 1.283 1.00 . A A . 6 ARG HH21 1 1
4 858 1 1 6 ARG HH22 H -10.609 10.821 0.690 1.00 . A A . 6 ARG HH22 1 1
4 859 1 1 6 ARG N N -5.705 4.870 -1.499 1.00 . A A . 6 ARG N 1 1
4 860 1 1 6 ARG NE N -8.808 8.706 -0.916 1.00 . A A . 6 ARG NE 1 1
4 861 1 1 6 ARG NH1 N -10.146 10.487 -1.713 1.00 . A A . 6 ARG NH1 1 1
4 862 1 1 6 ARG NH2 N -9.985 10.048 0.512 1.00 . A A . 6 ARG NH2 1 1
4 863 1 1 6 ARG O O -2.766 7.077 -1.623 1.00 . A A . 6 ARG O 1 1
4 864 1 1 7 GLY C C -1.038 4.508 -0.164 1.00 . A A . 7 GLY C 1 1
4 865 1 1 7 GLY CA C -2.009 5.503 0.599 1.00 . A A . 7 GLY CA 1 1
4 866 1 1 7 GLY H H -4.097 5.004 0.341 1.00 . A A . 7 GLY H 1 1
4 867 1 1 7 GLY HA2 H -1.572 6.502 0.590 1.00 . A A . 7 GLY HA2 1 1
4 868 1 1 7 GLY HA3 H -2.124 5.171 1.631 1.00 . A A . 7 GLY HA3 1 1
4 869 1 1 7 GLY N N -3.344 5.552 -0.050 1.00 . A A . 7 GLY N 1 1
4 870 1 1 7 GLY O O 0.148 4.430 0.162 1.00 . A A . 7 GLY O 1 1
4 871 1 1 8 ASP C C -0.448 1.520 -1.284 1.00 . A A . 8 ASP C 1 1
4 872 1 1 8 ASP CA C -0.919 2.780 -2.058 1.00 . A A . 8 ASP CA 1 1
4 873 1 1 8 ASP CB C 0.157 3.421 -2.981 1.00 . A A . 8 ASP CB 1 1
4 874 1 1 8 ASP CG C -0.364 4.476 -3.971 1.00 . A A . 8 ASP CG 1 1
4 875 1 1 8 ASP H H -2.550 3.934 -1.365 1.00 . A A . 8 ASP H 1 1
4 876 1 1 8 ASP HA H -1.703 2.430 -2.729 1.00 . A A . 8 ASP HA 1 1
4 877 1 1 8 ASP HB2 H 0.918 3.884 -2.353 1.00 . A A . 8 ASP HB2 1 1
4 878 1 1 8 ASP HB3 H 0.624 2.622 -3.557 1.00 . A A . 8 ASP HB3 1 1
4 879 1 1 8 ASP N N -1.570 3.774 -1.183 1.00 . A A . 8 ASP N 1 1
4 880 1 1 8 ASP O O 0.589 0.941 -1.603 1.00 . A A . 8 ASP O 1 1
4 881 1 1 8 ASP OD1 O -0.830 4.199 -5.076 1.00 . A A . 8 ASP OD1 1 1
4 882 1 1 8 ASP OD2 O -0.251 5.752 -3.478 1.00 . A A . 8 ASP OD2 1 1
4 883 1 1 9 ASN C C 0.386 -0.008 1.353 1.00 . A A . 9 ASN C 1 1
4 884 1 1 9 ASN CA C -0.924 -0.154 0.521 1.00 . A A . 9 ASN CA 1 1
4 885 1 1 9 ASN CB C -1.116 -1.439 -0.333 1.00 . A A . 9 ASN CB 1 1
4 886 1 1 9 ASN CG C -1.161 -2.772 0.437 1.00 . A A . 9 ASN CG 1 1
4 887 1 1 9 ASN H H -2.129 1.515 -0.140 1.00 . A A . 9 ASN H 1 1
4 888 1 1 9 ASN HA H -1.719 -0.198 1.265 1.00 . A A . 9 ASN HA 1 1
4 889 1 1 9 ASN HB2 H -2.055 -1.338 -0.877 1.00 . A A . 9 ASN HB2 1 1
4 890 1 1 9 ASN HB3 H -0.305 -1.490 -1.059 1.00 . A A . 9 ASN HB3 1 1
4 891 1 1 9 ASN HD21 H -3.151 -2.602 0.782 1.00 . A A . 9 ASN HD21 1 1
4 892 1 1 9 ASN HD22 H -2.394 -4.043 1.423 1.00 . A A . 9 ASN HD22 1 1
4 893 1 1 9 ASN N N -1.255 1.040 -0.312 1.00 . A A . 9 ASN N 1 1
4 894 1 1 9 ASN ND2 N -2.327 -3.170 0.919 1.00 . A A . 9 ASN ND2 1 1
4 895 1 1 9 ASN O O 1.189 -0.929 1.444 1.00 . A A . 9 ASN O 1 1
4 896 1 1 9 ASN OD1 O -0.153 -3.458 0.591 1.00 . A A . 9 ASN OD1 1 1
4 897 1 1 10 VAL C C 2.982 1.784 2.053 1.00 . A A . 10 VAL C 1 1
4 898 1 1 10 VAL CA C 1.678 1.540 2.866 1.00 . A A . 10 VAL CA 1 1
4 899 1 1 10 VAL CB C 1.765 0.826 4.268 1.00 . A A . 10 VAL CB 1 1
4 900 1 1 10 VAL CG1 C 2.276 -0.631 4.312 1.00 . A A . 10 VAL CG1 1 1
4 901 1 1 10 VAL CG2 C 2.569 1.669 5.286 1.00 . A A . 10 VAL CG2 1 1
4 902 1 1 10 VAL H H -0.226 1.826 1.923 1.00 . A A . 10 VAL H 1 1
4 903 1 1 10 VAL HA H 1.407 2.556 3.154 1.00 . A A . 10 VAL HA 1 1
4 904 1 1 10 VAL HB H 0.744 0.795 4.649 1.00 . A A . 10 VAL HB 1 1
4 905 1 1 10 VAL HG11 H 1.716 -1.234 3.597 1.00 . A A . 10 VAL HG11 1 1
4 906 1 1 10 VAL HG12 H 3.335 -0.652 4.053 1.00 . A A . 10 VAL HG12 1 1
4 907 1 1 10 VAL HG13 H 2.138 -1.034 5.315 1.00 . A A . 10 VAL HG13 1 1
4 908 1 1 10 VAL HG21 H 2.217 2.700 5.264 1.00 . A A . 10 VAL HG21 1 1
4 909 1 1 10 VAL HG22 H 2.430 1.259 6.286 1.00 . A A . 10 VAL HG22 1 1
4 910 1 1 10 VAL HG23 H 3.627 1.640 5.025 1.00 . A A . 10 VAL HG23 1 1
4 911 1 1 10 VAL N N 0.523 1.155 2.014 1.00 . A A . 10 VAL N 1 1
4 912 1 1 10 VAL O O 4.052 1.250 2.338 1.00 . A A . 10 VAL O 1 1
4 913 1 1 11 HIS C C 4.389 1.980 -0.810 1.00 . A A . 11 HIS C 1 1
4 914 1 1 11 HIS CA C 3.948 3.127 0.149 1.00 . A A . 11 HIS CA 1 1
4 915 1 1 11 HIS CB C 5.108 3.841 0.917 1.00 . A A . 11 HIS CB 1 1
4 916 1 1 11 HIS CD2 C 7.019 5.509 0.538 1.00 . A A . 11 HIS CD2 1 1
4 917 1 1 11 HIS CE1 C 6.647 6.060 -1.455 1.00 . A A . 11 HIS CE1 1 1
4 918 1 1 11 HIS CG C 5.900 4.818 0.061 1.00 . A A . 11 HIS CG 1 1
4 919 1 1 11 HIS H H 1.948 3.147 0.967 1.00 . A A . 11 HIS H 1 1
4 920 1 1 11 HIS HA H 3.511 3.892 -0.493 1.00 . A A . 11 HIS HA 1 1
4 921 1 1 11 HIS HB2 H 4.679 4.388 1.757 1.00 . A A . 11 HIS HB2 1 1
4 922 1 1 11 HIS HB3 H 5.790 3.083 1.305 1.00 . A A . 11 HIS HB3 1 1
4 923 1 1 11 HIS HD2 H 7.426 5.412 1.534 1.00 . A A . 11 HIS HD2 1 1
4 924 1 1 11 HIS HE1 H 6.756 6.550 -2.411 1.00 . A A . 11 HIS HE1 1 1
4 925 1 1 11 HIS HE2 H 8.327 6.954 -0.425 1.00 . A A . 11 HIS HE2 1 1
4 926 1 1 11 HIS N N 2.851 2.707 1.078 1.00 . A A . 11 HIS N 1 1
4 927 1 1 11 HIS ND1 N 5.620 5.165 -1.256 1.00 . A A . 11 HIS ND1 1 1
4 928 1 1 11 HIS NE2 N 7.531 6.332 -0.445 1.00 . A A . 11 HIS NE2 1 1
4 929 1 1 11 HIS O O 5.584 1.765 -1.007 1.00 . A A . 11 HIS O 1 1
4 930 1 1 12 ASN C C 4.052 -1.071 -1.613 1.00 . A A . 12 ASN C 1 1
4 931 1 1 12 ASN CA C 3.653 0.196 -2.430 1.00 . A A . 12 ASN CA 1 1
4 932 1 1 12 ASN CB C 4.565 0.572 -3.643 1.00 . A A . 12 ASN CB 1 1
4 933 1 1 12 ASN CG C 4.473 -0.388 -4.844 1.00 . A A . 12 ASN CG 1 1
4 934 1 1 12 ASN H H 2.468 1.624 -1.352 1.00 . A A . 12 ASN H 1 1
4 935 1 1 12 ASN HA H 2.677 -0.030 -2.859 1.00 . A A . 12 ASN HA 1 1
4 936 1 1 12 ASN HB2 H 4.300 1.574 -3.979 1.00 . A A . 12 ASN HB2 1 1
4 937 1 1 12 ASN HB3 H 5.599 0.585 -3.298 1.00 . A A . 12 ASN HB3 1 1
4 938 1 1 12 ASN HD21 H 2.875 0.592 -5.620 1.00 . A A . 12 ASN HD21 1 1
4 939 1 1 12 ASN HD22 H 3.431 -0.789 -6.539 1.00 . A A . 12 ASN HD22 1 1
4 940 1 1 12 ASN N N 3.422 1.323 -1.492 1.00 . A A . 12 ASN N 1 1
4 941 1 1 12 ASN ND2 N 3.517 -0.179 -5.739 1.00 . A A . 12 ASN ND2 1 1
4 942 1 1 12 ASN O O 5.035 -1.732 -1.965 1.00 . A A . 12 ASN O 1 1
4 943 1 1 12 ASN OD1 O 5.263 -1.323 -4.980 1.00 . A A . 12 ASN OD1 1 1
4 944 1 1 13 SER C C 4.934 -2.398 0.981 1.00 . A A . 13 SER C 1 1
4 945 1 1 13 SER CA C 3.567 -2.610 0.330 1.00 . A A . 13 SER CA 1 1
4 946 1 1 13 SER CB C 3.293 -3.985 -0.368 1.00 . A A . 13 SER CB 1 1
4 947 1 1 13 SER H H 2.471 -0.849 -0.319 1.00 . A A . 13 SER H 1 1
4 948 1 1 13 SER HA H 2.847 -2.553 1.147 1.00 . A A . 13 SER HA 1 1
4 949 1 1 13 SER HB2 H 3.214 -4.759 0.395 1.00 . A A . 13 SER HB2 1 1
4 950 1 1 13 SER HB3 H 2.346 -3.920 -0.904 1.00 . A A . 13 SER HB3 1 1
4 951 1 1 13 SER HG H 4.374 -5.307 -1.340 1.00 . A A . 13 SER HG 1 1
4 952 1 1 13 SER N N 3.276 -1.419 -0.538 1.00 . A A . 13 SER N 1 1
4 953 1 1 13 SER O O 5.871 -3.099 0.633 1.00 . A A . 13 SER O 1 1
4 954 1 1 13 SER OG O 4.313 -4.350 -1.291 1.00 . A A . 13 SER OG 1 1
4 955 1 1 14 SER C C 7.474 -0.825 1.553 1.00 . A A . 14 SER C 1 1
4 956 1 1 14 SER CA C 6.341 -1.087 2.594 1.00 . A A . 14 SER CA 1 1
4 957 1 1 14 SER CB C 6.629 -2.171 3.669 1.00 . A A . 14 SER CB 1 1
4 958 1 1 14 SER H H 4.241 -0.876 2.148 1.00 . A A . 14 SER H 1 1
4 959 1 1 14 SER HA H 6.181 -0.150 3.127 1.00 . A A . 14 SER HA 1 1
4 960 1 1 14 SER HB2 H 5.735 -2.321 4.275 1.00 . A A . 14 SER HB2 1 1
4 961 1 1 14 SER HB3 H 6.885 -3.106 3.172 1.00 . A A . 14 SER HB3 1 1
4 962 1 1 14 SER HG H 7.863 -2.470 5.168 1.00 . A A . 14 SER HG 1 1
4 963 1 1 14 SER N N 5.061 -1.415 1.909 1.00 . A A . 14 SER N 1 1
4 964 1 1 14 SER O O 8.629 -1.134 1.864 1.00 . A A . 14 SER O 1 1
4 965 1 1 14 SER OG O 7.707 -1.785 4.515 1.00 . A A . 14 SER OG 1 1
4 966 1 1 15 SER C C 8.894 -1.321 -1.239 1.00 . A A . 15 SER C 1 1
4 967 1 1 15 SER CA C 8.220 0.019 -0.726 1.00 . A A . 15 SER CA 1 1
4 968 1 1 15 SER CB C 9.310 0.991 -0.198 1.00 . A A . 15 SER CB 1 1
4 969 1 1 15 SER H H 6.217 0.060 0.166 1.00 . A A . 15 SER H 1 1
4 970 1 1 15 SER HA H 7.730 0.494 -1.575 1.00 . A A . 15 SER HA 1 1
4 971 1 1 15 SER HB2 H 8.827 1.804 0.344 1.00 . A A . 15 SER HB2 1 1
4 972 1 1 15 SER HB3 H 9.971 0.452 0.480 1.00 . A A . 15 SER HB3 1 1
4 973 1 1 15 SER HG H 10.743 2.132 -0.910 1.00 . A A . 15 SER HG 1 1
4 974 1 1 15 SER N N 7.170 -0.225 0.343 1.00 . A A . 15 SER N 1 1
4 975 1 1 15 SER O O 9.777 -1.267 -2.100 1.00 . A A . 15 SER O 1 1
4 976 1 1 15 SER OG O 10.080 1.537 -1.265 1.00 . A A . 15 SER OG 1 1
4 977 1 1 16 SER C C 7.994 -4.955 -0.691 1.00 . A A . 16 SER C 1 1
4 978 1 1 16 SER CA C 8.986 -3.829 -1.104 1.00 . A A . 16 SER CA 1 1
4 979 1 1 16 SER CB C 10.323 -3.950 -0.283 1.00 . A A . 16 SER CB 1 1
4 980 1 1 16 SER H H 7.692 -2.484 -0.089 1.00 . A A . 16 SER H 1 1
4 981 1 1 16 SER HA H 9.193 -3.880 -2.173 1.00 . A A . 16 SER HA 1 1
4 982 1 1 16 SER HB2 H 10.723 -4.955 -0.417 1.00 . A A . 16 SER HB2 1 1
4 983 1 1 16 SER HB3 H 11.037 -3.234 -0.690 1.00 . A A . 16 SER HB3 1 1
4 984 1 1 16 SER HG H 10.985 -3.275 1.447 1.00 . A A . 16 SER HG 1 1
4 985 1 1 16 SER N N 8.454 -2.511 -0.752 1.00 . A A . 16 SER N 1 1
4 986 1 1 16 SER O O 7.499 -5.675 -1.565 1.00 . A A . 16 SER O 1 1
4 987 1 1 16 SER OG O 10.187 -3.696 1.119 1.00 . A A . 16 SER OG 1 1
4 988 1 1 17 LEU C C 6.279 -5.753 2.568 1.00 . A A . 17 LEU C 1 1
4 989 1 1 17 LEU CA C 6.780 -6.140 1.147 1.00 . A A . 17 LEU CA 1 1
4 990 1 1 17 LEU CB C 7.244 -7.631 1.020 1.00 . A A . 17 LEU CB 1 1
4 991 1 1 17 LEU CD1 C 8.591 -9.458 2.249 1.00 . A A . 17 LEU CD1 1 1
4 992 1 1 17 LEU CD2 C 9.767 -8.027 0.554 1.00 . A A . 17 LEU CD2 1 1
4 993 1 1 17 LEU CG C 8.634 -8.058 1.600 1.00 . A A . 17 LEU CG 1 1
4 994 1 1 17 LEU H H 8.211 -4.519 1.290 1.00 . A A . 17 LEU H 1 1
4 995 1 1 17 LEU HXT H 6.688 -5.579 4.468 1.00 . A A . 17 LEU HXT 1 1
4 996 1 1 17 LEU HA H 5.903 -6.060 0.506 1.00 . A A . 17 LEU HA 1 1
4 997 1 1 17 LEU HB2 H 6.491 -8.241 1.519 1.00 . A A . 17 LEU HB2 1 1
4 998 1 1 17 LEU HB3 H 7.233 -7.892 -0.038 1.00 . A A . 17 LEU HB3 1 1
4 999 1 1 17 LEU HD11 H 7.793 -9.491 2.990 1.00 . A A . 17 LEU HD11 1 1
4 1000 1 1 17 LEU HD12 H 9.545 -9.663 2.733 1.00 . A A . 17 LEU HD12 1 1
4 1001 1 1 17 LEU HD13 H 8.404 -10.209 1.480 1.00 . A A . 17 LEU HD13 1 1
4 1002 1 1 17 LEU HD21 H 9.806 -7.041 0.090 1.00 . A A . 17 LEU HD21 1 1
4 1003 1 1 17 LEU HD22 H 10.719 -8.236 1.043 1.00 . A A . 17 LEU HD22 1 1
4 1004 1 1 17 LEU HD23 H 9.577 -8.781 -0.210 1.00 . A A . 17 LEU HD23 1 1
4 1005 1 1 17 LEU HG H 8.893 -7.345 2.383 1.00 . A A . 17 LEU HG 1 1
4 1006 1 1 17 LEU N N 7.736 -5.116 0.628 1.00 . A A . 17 LEU N 1 1
4 1007 1 1 17 LEU O O 5.123 -5.361 2.730 1.00 . A A . 17 LEU O 1 1
4 1008 1 1 17 LEU OXT O 7.148 -5.853 3.671 1.00 . A A . 17 LEU OXT 1 1
5 1009 1 1 1 ASN C C -10.115 3.970 -3.720 1.00 . A A . 1 ASN C 1 1
5 1010 1 1 1 ASN CA C -9.970 2.416 -3.567 1.00 . A A . 1 ASN CA 1 1
5 1011 1 1 1 ASN CB C -9.721 1.684 -4.928 1.00 . A A . 1 ASN CB 1 1
5 1012 1 1 1 ASN CG C -9.124 0.266 -4.814 1.00 . A A . 1 ASN CG 1 1
5 1013 1 1 1 ASN H1 H -11.323 2.303 -2.013 1.00 . A A . 1 ASN H1 1 1
5 1014 1 1 1 ASN H2 H -11.976 1.940 -3.483 1.00 . A A . 1 ASN H2 1 1
5 1015 1 1 1 ASN H3 H -11.006 0.847 -2.718 1.00 . A A . 1 ASN H3 1 1
5 1016 1 1 1 ASN HA H -9.107 2.227 -2.929 1.00 . A A . 1 ASN HA 1 1
5 1017 1 1 1 ASN HB2 H -10.676 1.606 -5.448 1.00 . A A . 1 ASN HB2 1 1
5 1018 1 1 1 ASN HB3 H -9.049 2.294 -5.530 1.00 . A A . 1 ASN HB3 1 1
5 1019 1 1 1 ASN HD21 H -10.923 -0.623 -5.107 1.00 . A A . 1 ASN HD21 1 1
5 1020 1 1 1 ASN HD22 H -9.572 -1.710 -4.876 1.00 . A A . 1 ASN HD22 1 1
5 1021 1 1 1 ASN N N -11.166 1.829 -2.890 1.00 . A A . 1 ASN N 1 1
5 1022 1 1 1 ASN ND2 N -9.937 -0.771 -4.942 1.00 . A A . 1 ASN ND2 1 1
5 1023 1 1 1 ASN O O -9.970 4.516 -4.819 1.00 . A A . 1 ASN O 1 1
5 1024 1 1 1 ASN OD1 O -7.922 0.095 -4.618 1.00 . A A . 1 ASN OD1 1 1
5 1025 1 1 2 VAL C C -9.021 6.778 -2.564 1.00 . A A . 2 VAL C 1 1
5 1026 1 1 2 VAL CA C -10.470 6.186 -2.577 1.00 . A A . 2 VAL CA 1 1
5 1027 1 1 2 VAL CB C -11.412 6.649 -1.402 1.00 . A A . 2 VAL CB 1 1
5 1028 1 1 2 VAL CG1 C -11.505 8.185 -1.240 1.00 . A A . 2 VAL CG1 1 1
5 1029 1 1 2 VAL CG2 C -12.861 6.105 -1.500 1.00 . A A . 2 VAL CG2 1 1
5 1030 1 1 2 VAL H H -10.464 4.201 -1.730 1.00 . A A . 2 VAL H 1 1
5 1031 1 1 2 VAL HA H -10.939 6.493 -3.512 1.00 . A A . 2 VAL HA 1 1
5 1032 1 1 2 VAL HB H -10.986 6.257 -0.479 1.00 . A A . 2 VAL HB 1 1
5 1033 1 1 2 VAL HG11 H -10.502 8.605 -1.168 1.00 . A A . 2 VAL HG11 1 1
5 1034 1 1 2 VAL HG12 H -12.063 8.421 -0.333 1.00 . A A . 2 VAL HG12 1 1
5 1035 1 1 2 VAL HG13 H -12.016 8.612 -2.102 1.00 . A A . 2 VAL HG13 1 1
5 1036 1 1 2 VAL HG21 H -12.836 5.022 -1.616 1.00 . A A . 2 VAL HG21 1 1
5 1037 1 1 2 VAL HG22 H -13.359 6.551 -2.361 1.00 . A A . 2 VAL HG22 1 1
5 1038 1 1 2 VAL HG23 H -13.407 6.361 -0.591 1.00 . A A . 2 VAL HG23 1 1
5 1039 1 1 2 VAL N N -10.355 4.697 -2.602 1.00 . A A . 2 VAL N 1 1
5 1040 1 1 2 VAL O O -8.595 7.414 -3.531 1.00 . A A . 2 VAL O 1 1
5 1041 1 1 3 HIS C C -5.802 5.980 -1.889 1.00 . A A . 3 HIS C 1 1
5 1042 1 1 3 HIS CA C -6.879 6.961 -1.260 1.00 . A A . 3 HIS CA 1 1
5 1043 1 1 3 HIS CB C -6.725 6.961 0.282 1.00 . A A . 3 HIS CB 1 1
5 1044 1 1 3 HIS CD2 C -4.826 8.724 0.033 1.00 . A A . 3 HIS CD2 1 1
5 1045 1 1 3 HIS CE1 C -4.076 8.672 1.998 1.00 . A A . 3 HIS CE1 1 1
5 1046 1 1 3 HIS CG C -5.548 7.786 0.788 1.00 . A A . 3 HIS CG 1 1
5 1047 1 1 3 HIS H H -8.740 6.045 -0.704 1.00 . A A . 3 HIS H 1 1
5 1048 1 1 3 HIS HA H -6.732 7.970 -1.647 1.00 . A A . 3 HIS HA 1 1
5 1049 1 1 3 HIS HB2 H -7.639 7.366 0.717 1.00 . A A . 3 HIS HB2 1 1
5 1050 1 1 3 HIS HB3 H -6.603 5.933 0.621 1.00 . A A . 3 HIS HB3 1 1
5 1051 1 1 3 HIS HD2 H -5.012 8.954 -1.006 1.00 . A A . 3 HIS HD2 1 1
5 1052 1 1 3 HIS HE1 H -3.465 8.900 2.859 1.00 . A A . 3 HIS HE1 1 1
5 1053 1 1 3 HIS HE2 H -3.157 10.009 0.568 1.00 . A A . 3 HIS HE2 1 1
5 1054 1 1 3 HIS N N -8.292 6.544 -1.459 1.00 . A A . 3 HIS N 1 1
5 1055 1 1 3 HIS ND1 N -5.081 7.742 2.099 1.00 . A A . 3 HIS ND1 1 1
5 1056 1 1 3 HIS NE2 N -3.846 9.311 0.809 1.00 . A A . 3 HIS NE2 1 1
5 1057 1 1 3 HIS O O -4.610 6.054 -1.580 1.00 . A A . 3 HIS O 1 1
5 1058 1 1 4 THR C C -5.231 2.795 -2.601 1.00 . A A . 4 THR C 1 1
5 1059 1 1 4 THR CA C -5.525 4.037 -3.502 1.00 . A A . 4 THR CA 1 1
5 1060 1 1 4 THR CB C -4.410 4.584 -4.421 1.00 . A A . 4 THR CB 1 1
5 1061 1 1 4 THR CG2 C -4.752 5.818 -5.278 1.00 . A A . 4 THR CG2 1 1
5 1062 1 1 4 THR H H -7.251 5.108 -2.945 1.00 . A A . 4 THR H 1 1
5 1063 1 1 4 THR HA H -6.267 3.662 -4.208 1.00 . A A . 4 THR HA 1 1
5 1064 1 1 4 THR HB H -4.191 3.784 -5.129 1.00 . A A . 4 THR HB 1 1
5 1065 1 1 4 THR HG1 H -2.489 4.988 -4.359 1.00 . A A . 4 THR HG1 1 1
5 1066 1 1 4 THR HG21 H -3.885 6.099 -5.875 1.00 . A A . 4 THR HG21 1 1
5 1067 1 1 4 THR HG22 H -5.587 5.581 -5.938 1.00 . A A . 4 THR HG22 1 1
5 1068 1 1 4 THR HG23 H -5.029 6.647 -4.626 1.00 . A A . 4 THR HG23 1 1
5 1069 1 1 4 THR N N -6.258 5.073 -2.766 1.00 . A A . 4 THR N 1 1
5 1070 1 1 4 THR O O -4.099 2.320 -2.524 1.00 . A A . 4 THR O 1 1
5 1071 1 1 4 THR OG1 O -3.193 4.827 -3.726 1.00 . A A . 4 THR OG1 1 1
5 1072 1 1 5 PHE C C -5.464 1.369 0.253 1.00 . A A . 5 PHE C 1 1
5 1073 1 1 5 PHE CA C -6.215 1.043 -1.075 1.00 . A A . 5 PHE CA 1 1
5 1074 1 1 5 PHE CB C -5.774 -0.270 -1.796 1.00 . A A . 5 PHE CB 1 1
5 1075 1 1 5 PHE CD1 C -7.628 -1.995 -1.513 1.00 . A A . 5 PHE CD1 1 1
5 1076 1 1 5 PHE CD2 C -5.618 -2.256 -0.198 1.00 . A A . 5 PHE CD2 1 1
5 1077 1 1 5 PHE CE1 C -8.165 -3.133 -0.916 1.00 . A A . 5 PHE CE1 1 1
5 1078 1 1 5 PHE CE2 C -6.157 -3.393 0.398 1.00 . A A . 5 PHE CE2 1 1
5 1079 1 1 5 PHE CG C -6.349 -1.547 -1.158 1.00 . A A . 5 PHE CG 1 1
5 1080 1 1 5 PHE CZ C -7.429 -3.832 0.038 1.00 . A A . 5 PHE CZ 1 1
5 1081 1 1 5 PHE H H -7.207 2.625 -2.143 1.00 . A A . 5 PHE H 1 1
5 1082 1 1 5 PHE HA H -7.245 0.858 -0.771 1.00 . A A . 5 PHE HA 1 1
5 1083 1 1 5 PHE HB2 H -6.108 -0.222 -2.832 1.00 . A A . 5 PHE HB2 1 1
5 1084 1 1 5 PHE HB3 H -4.686 -0.329 -1.781 1.00 . A A . 5 PHE HB3 1 1
5 1085 1 1 5 PHE HD1 H -8.199 -1.456 -2.254 1.00 . A A . 5 PHE HD1 1 1
5 1086 1 1 5 PHE HD2 H -4.631 -1.920 0.082 1.00 . A A . 5 PHE HD2 1 1
5 1087 1 1 5 PHE HE1 H -9.152 -3.473 -1.192 1.00 . A A . 5 PHE HE1 1 1
5 1088 1 1 5 PHE HE2 H -5.589 -3.934 1.140 1.00 . A A . 5 PHE HE2 1 1
5 1089 1 1 5 PHE HZ H -7.845 -4.716 0.498 1.00 . A A . 5 PHE HZ 1 1
5 1090 1 1 5 PHE N N -6.296 2.222 -1.979 1.00 . A A . 5 PHE N 1 1
5 1091 1 1 5 PHE O O -4.526 0.679 0.663 1.00 . A A . 5 PHE O 1 1
5 1092 1 1 6 ARG C C -3.975 3.443 2.197 1.00 . A A . 6 ARG C 1 1
5 1093 1 1 6 ARG CA C -5.426 2.927 2.235 1.00 . A A . 6 ARG CA 1 1
5 1094 1 1 6 ARG CB C -5.719 1.908 3.367 1.00 . A A . 6 ARG CB 1 1
5 1095 1 1 6 ARG CD C -7.543 0.073 3.303 1.00 . A A . 6 ARG CD 1 1
5 1096 1 1 6 ARG CG C -7.225 1.567 3.508 1.00 . A A . 6 ARG CG 1 1
5 1097 1 1 6 ARG CZ C -9.565 -1.406 3.344 1.00 . A A . 6 ARG CZ 1 1
5 1098 1 1 6 ARG H H -6.697 2.953 0.506 1.00 . A A . 6 ARG H 1 1
5 1099 1 1 6 ARG HA H -6.034 3.800 2.471 1.00 . A A . 6 ARG HA 1 1
5 1100 1 1 6 ARG HB2 H -5.174 0.988 3.154 1.00 . A A . 6 ARG HB2 1 1
5 1101 1 1 6 ARG HB3 H -5.360 2.319 4.311 1.00 . A A . 6 ARG HB3 1 1
5 1102 1 1 6 ARG HD2 H -7.236 -0.221 2.300 1.00 . A A . 6 ARG HD2 1 1
5 1103 1 1 6 ARG HD3 H -6.988 -0.515 4.034 1.00 . A A . 6 ARG HD3 1 1
5 1104 1 1 6 ARG HE H -9.594 0.591 3.676 1.00 . A A . 6 ARG HE 1 1
5 1105 1 1 6 ARG HG2 H -7.559 1.863 4.503 1.00 . A A . 6 ARG HG2 1 1
5 1106 1 1 6 ARG HG3 H -7.779 2.142 2.767 1.00 . A A . 6 ARG HG3 1 1
5 1107 1 1 6 ARG HH11 H -7.890 -2.490 2.945 1.00 . A A . 6 ARG HH11 1 1
5 1108 1 1 6 ARG HH12 H -9.381 -3.403 2.998 1.00 . A A . 6 ARG HH12 1 1
5 1109 1 1 6 ARG HH21 H -11.413 -0.666 3.712 1.00 . A A . 6 ARG HH21 1 1
5 1110 1 1 6 ARG HH22 H -11.333 -2.390 3.423 1.00 . A A . 6 ARG HH22 1 1
5 1111 1 1 6 ARG N N -5.935 2.440 0.927 1.00 . A A . 6 ARG N 1 1
5 1112 1 1 6 ARG NE N -8.993 -0.193 3.463 1.00 . A A . 6 ARG NE 1 1
5 1113 1 1 6 ARG NH1 N -8.891 -2.523 3.074 1.00 . A A . 6 ARG NH1 1 1
5 1114 1 1 6 ARG NH2 N -10.873 -1.494 3.506 1.00 . A A . 6 ARG NH2 1 1
5 1115 1 1 6 ARG O O -3.052 2.956 2.856 1.00 . A A . 6 ARG O 1 1
5 1116 1 1 7 GLY C C -1.587 4.437 0.283 1.00 . A A . 7 GLY C 1 1
5 1117 1 1 7 GLY CA C -2.622 5.213 1.104 1.00 . A A . 7 GLY CA 1 1
5 1118 1 1 7 GLY H H -4.716 4.792 0.899 1.00 . A A . 7 GLY H 1 1
5 1119 1 1 7 GLY HA2 H -2.863 6.135 0.575 1.00 . A A . 7 GLY HA2 1 1
5 1120 1 1 7 GLY HA3 H -2.170 5.470 2.062 1.00 . A A . 7 GLY HA3 1 1
5 1121 1 1 7 GLY N N -3.879 4.483 1.372 1.00 . A A . 7 GLY N 1 1
5 1122 1 1 7 GLY O O -0.446 4.299 0.731 1.00 . A A . 7 GLY O 1 1
5 1123 1 1 8 ASP C C -0.550 1.861 -1.167 1.00 . A A . 8 ASP C 1 1
5 1124 1 1 8 ASP CA C -1.080 3.175 -1.823 1.00 . A A . 8 ASP CA 1 1
5 1125 1 1 8 ASP CB C -0.001 4.122 -2.442 1.00 . A A . 8 ASP CB 1 1
5 1126 1 1 8 ASP CG C 0.780 3.570 -3.639 1.00 . A A . 8 ASP CG 1 1
5 1127 1 1 8 ASP H H -2.929 4.143 -1.222 1.00 . A A . 8 ASP H 1 1
5 1128 1 1 8 ASP HA H -1.704 2.857 -2.658 1.00 . A A . 8 ASP HA 1 1
5 1129 1 1 8 ASP HB2 H -0.493 5.045 -2.750 1.00 . A A . 8 ASP HB2 1 1
5 1130 1 1 8 ASP HB3 H 0.718 4.363 -1.658 1.00 . A A . 8 ASP HB3 1 1
5 1131 1 1 8 ASP N N -1.982 3.961 -0.919 1.00 . A A . 8 ASP N 1 1
5 1132 1 1 8 ASP O O 0.576 1.451 -1.444 1.00 . A A . 8 ASP O 1 1
5 1133 1 1 8 ASP OD1 O 1.977 3.297 -3.592 1.00 . A A . 8 ASP OD1 1 1
5 1134 1 1 8 ASP OD2 O -0.006 3.426 -4.754 1.00 . A A . 8 ASP OD2 1 1
5 1135 1 1 9 ASN C C 0.311 0.032 1.200 1.00 . A A . 9 ASN C 1 1
5 1136 1 1 9 ASN CA C -0.991 -0.100 0.351 1.00 . A A . 9 ASN CA 1 1
5 1137 1 1 9 ASN CB C -1.098 -1.284 -0.653 1.00 . A A . 9 ASN CB 1 1
5 1138 1 1 9 ASN CG C -1.016 -2.703 -0.058 1.00 . A A . 9 ASN CG 1 1
5 1139 1 1 9 ASN H H -2.313 1.514 -0.210 1.00 . A A . 9 ASN H 1 1
5 1140 1 1 9 ASN HA H -1.785 -0.274 1.077 1.00 . A A . 9 ASN HA 1 1
5 1141 1 1 9 ASN HB2 H -2.056 -1.195 -1.166 1.00 . A A . 9 ASN HB2 1 1
5 1142 1 1 9 ASN HB3 H -0.304 -1.177 -1.392 1.00 . A A . 9 ASN HB3 1 1
5 1143 1 1 9 ASN HD21 H -2.975 -2.689 0.460 1.00 . A A . 9 ASN HD21 1 1
5 1144 1 1 9 ASN HD22 H -2.099 -4.151 0.857 1.00 . A A . 9 ASN HD22 1 1
5 1145 1 1 9 ASN N N -1.377 1.161 -0.351 1.00 . A A . 9 ASN N 1 1
5 1146 1 1 9 ASN ND2 N -2.117 -3.222 0.461 1.00 . A A . 9 ASN ND2 1 1
5 1147 1 1 9 ASN O O 1.111 -0.892 1.263 1.00 . A A . 9 ASN O 1 1
5 1148 1 1 9 ASN OD1 O 0.035 -3.342 -0.065 1.00 . A A . 9 ASN OD1 1 1
5 1149 1 1 10 VAL C C 2.909 1.719 1.930 1.00 . A A . 10 VAL C 1 1
5 1150 1 1 10 VAL CA C 1.617 1.500 2.777 1.00 . A A . 10 VAL CA 1 1
5 1151 1 1 10 VAL CB C 1.699 0.743 4.155 1.00 . A A . 10 VAL CB 1 1
5 1152 1 1 10 VAL CG1 C 2.107 -0.746 4.134 1.00 . A A . 10 VAL CG1 1 1
5 1153 1 1 10 VAL CG2 C 2.588 1.499 5.171 1.00 . A A . 10 VAL CG2 1 1
5 1154 1 1 10 VAL H H -0.304 1.838 1.874 1.00 . A A . 10 VAL H 1 1
5 1155 1 1 10 VAL HA H 1.380 2.516 3.092 1.00 . A A . 10 VAL HA 1 1
5 1156 1 1 10 VAL HB H 0.690 0.769 4.567 1.00 . A A . 10 VAL HB 1 1
5 1157 1 1 10 VAL HG11 H 1.484 -1.284 3.420 1.00 . A A . 10 VAL HG11 1 1
5 1158 1 1 10 VAL HG12 H 1.972 -1.173 5.128 1.00 . A A . 10 VAL HG12 1 1
5 1159 1 1 10 VAL HG13 H 3.153 -0.832 3.841 1.00 . A A . 10 VAL HG13 1 1
5 1160 1 1 10 VAL HG21 H 2.305 2.551 5.190 1.00 . A A . 10 VAL HG21 1 1
5 1161 1 1 10 VAL HG22 H 2.453 1.068 6.163 1.00 . A A . 10 VAL HG22 1 1
5 1162 1 1 10 VAL HG23 H 3.634 1.409 4.876 1.00 . A A . 10 VAL HG23 1 1
5 1163 1 1 10 VAL N N 0.447 1.165 1.920 1.00 . A A . 10 VAL N 1 1
5 1164 1 1 10 VAL O O 3.982 1.192 2.221 1.00 . A A . 10 VAL O 1 1
5 1165 1 1 11 HIS C C 4.331 1.769 -0.910 1.00 . A A . 11 HIS C 1 1
5 1166 1 1 11 HIS CA C 3.859 2.979 -0.046 1.00 . A A . 11 HIS CA 1 1
5 1167 1 1 11 HIS CB C 4.998 3.771 0.675 1.00 . A A . 11 HIS CB 1 1
5 1168 1 1 11 HIS CD2 C 6.865 5.462 0.183 1.00 . A A . 11 HIS CD2 1 1
5 1169 1 1 11 HIS CE1 C 6.476 5.872 -1.841 1.00 . A A . 11 HIS CE1 1 1
5 1170 1 1 11 HIS CG C 5.766 4.708 -0.245 1.00 . A A . 11 HIS CG 1 1
5 1171 1 1 11 HIS H H 1.869 3.043 0.795 1.00 . A A . 11 HIS H 1 1
5 1172 1 1 11 HIS HA H 3.406 3.683 -0.744 1.00 . A A . 11 HIS HA 1 1
5 1173 1 1 11 HIS HB2 H 4.552 4.364 1.475 1.00 . A A . 11 HIS HB2 1 1
5 1174 1 1 11 HIS HB3 H 5.696 3.059 1.114 1.00 . A A . 11 HIS HB3 1 1
5 1175 1 1 11 HIS HD2 H 7.273 5.444 1.183 1.00 . A A . 11 HIS HD2 1 1
5 1176 1 1 11 HIS HE1 H 6.570 6.303 -2.827 1.00 . A A . 11 HIS HE1 1 1
5 1177 1 1 11 HIS HE2 H 8.130 6.876 -0.874 1.00 . A A . 11 HIS HE2 1 1
5 1178 1 1 11 HIS N N 2.771 2.604 0.915 1.00 . A A . 11 HIS N 1 1
5 1179 1 1 11 HIS ND1 N 5.476 4.962 -1.582 1.00 . A A . 11 HIS ND1 1 1
5 1180 1 1 11 HIS NE2 N 7.352 6.233 -0.852 1.00 . A A . 11 HIS NE2 1 1
5 1181 1 1 11 HIS O O 5.530 1.597 -1.123 1.00 . A A . 11 HIS O 1 1
5 1182 1 1 12 ASN C C 4.086 -1.380 -1.411 1.00 . A A . 12 ASN C 1 1
5 1183 1 1 12 ASN CA C 3.652 -0.199 -2.337 1.00 . A A . 12 ASN CA 1 1
5 1184 1 1 12 ASN CB C 4.578 0.012 -3.587 1.00 . A A . 12 ASN CB 1 1
5 1185 1 1 12 ASN CG C 4.096 1.050 -4.618 1.00 . A A . 12 ASN CG 1 1
5 1186 1 1 12 ASN H H 2.419 1.265 -1.358 1.00 . A A . 12 ASN H 1 1
5 1187 1 1 12 ASN HA H 2.683 -0.491 -2.742 1.00 . A A . 12 ASN HA 1 1
5 1188 1 1 12 ASN HB2 H 5.565 0.311 -3.235 1.00 . A A . 12 ASN HB2 1 1
5 1189 1 1 12 ASN HB3 H 4.672 -0.946 -4.097 1.00 . A A . 12 ASN HB3 1 1
5 1190 1 1 12 ASN HD21 H 2.846 -0.274 -5.511 1.00 . A A . 12 ASN HD21 1 1
5 1191 1 1 12 ASN HD22 H 2.867 1.331 -6.206 1.00 . A A . 12 ASN HD22 1 1
5 1192 1 1 12 ASN N N 3.384 1.002 -1.498 1.00 . A A . 12 ASN N 1 1
5 1193 1 1 12 ASN ND2 N 3.199 0.673 -5.516 1.00 . A A . 12 ASN ND2 1 1
5 1194 1 1 12 ASN O O 5.061 -2.075 -1.717 1.00 . A A . 12 ASN O 1 1
5 1195 1 1 12 ASN OD1 O 4.536 2.199 -4.616 1.00 . A A . 12 ASN OD1 1 1
5 1196 1 1 13 SER C C 5.042 -2.497 1.284 1.00 . A A . 13 SER C 1 1
5 1197 1 1 13 SER CA C 3.639 -2.717 0.692 1.00 . A A . 13 SER CA 1 1
5 1198 1 1 13 SER CB C 3.308 -4.146 0.150 1.00 . A A . 13 SER CB 1 1
5 1199 1 1 13 SER H H 2.535 -1.039 -0.118 1.00 . A A . 13 SER H 1 1
5 1200 1 1 13 SER HA H 2.949 -2.556 1.520 1.00 . A A . 13 SER HA 1 1
5 1201 1 1 13 SER HB2 H 3.259 -4.837 0.992 1.00 . A A . 13 SER HB2 1 1
5 1202 1 1 13 SER HB3 H 2.337 -4.122 -0.346 1.00 . A A . 13 SER HB3 1 1
5 1203 1 1 13 SER HG H 4.322 -5.578 -0.737 1.00 . A A . 13 SER HG 1 1
5 1204 1 1 13 SER N N 3.338 -1.627 -0.292 1.00 . A A . 13 SER N 1 1
5 1205 1 1 13 SER O O 5.925 -3.321 1.093 1.00 . A A . 13 SER O 1 1
5 1206 1 1 13 SER OG O 4.286 -4.619 -0.772 1.00 . A A . 13 SER OG 1 1
5 1207 1 1 14 SER C C 7.603 -0.842 1.510 1.00 . A A . 14 SER C 1 1
5 1208 1 1 14 SER CA C 6.537 -1.005 2.638 1.00 . A A . 14 SER CA 1 1
5 1209 1 1 14 SER CB C 6.873 -1.953 3.821 1.00 . A A . 14 SER CB 1 1
5 1210 1 1 14 SER H H 4.449 -0.765 2.171 1.00 . A A . 14 SER H 1 1
5 1211 1 1 14 SER HA H 6.396 -0.015 3.071 1.00 . A A . 14 SER HA 1 1
5 1212 1 1 14 SER HB2 H 6.018 -1.999 4.497 1.00 . A A . 14 SER HB2 1 1
5 1213 1 1 14 SER HB3 H 7.075 -2.951 3.432 1.00 . A A . 14 SER HB3 1 1
5 1214 1 1 14 SER HG H 8.198 -2.098 5.264 1.00 . A A . 14 SER HG 1 1
5 1215 1 1 14 SER N N 5.237 -1.380 2.025 1.00 . A A . 14 SER N 1 1
5 1216 1 1 14 SER O O 8.736 -1.293 1.706 1.00 . A A . 14 SER O 1 1
5 1217 1 1 14 SER OG O 8.012 -1.496 4.539 1.00 . A A . 14 SER OG 1 1
5 1218 1 1 15 SER C C 8.551 -1.354 -1.556 1.00 . A A . 15 SER C 1 1
5 1219 1 1 15 SER CA C 8.233 -0.005 -0.806 1.00 . A A . 15 SER CA 1 1
5 1220 1 1 15 SER CB C 9.558 0.684 -0.362 1.00 . A A . 15 SER CB 1 1
5 1221 1 1 15 SER H H 6.327 0.202 0.258 1.00 . A A . 15 SER H 1 1
5 1222 1 1 15 SER HA H 7.757 0.657 -1.530 1.00 . A A . 15 SER HA 1 1
5 1223 1 1 15 SER HB2 H 9.328 1.485 0.341 1.00 . A A . 15 SER HB2 1 1
5 1224 1 1 15 SER HB3 H 10.195 -0.052 0.129 1.00 . A A . 15 SER HB3 1 1
5 1225 1 1 15 SER HG H 11.065 1.646 -1.179 1.00 . A A . 15 SER HG 1 1
5 1226 1 1 15 SER N N 7.258 -0.179 0.345 1.00 . A A . 15 SER N 1 1
5 1227 1 1 15 SER O O 9.085 -1.302 -2.668 1.00 . A A . 15 SER O 1 1
5 1228 1 1 15 SER OG O 10.255 1.229 -1.479 1.00 . A A . 15 SER OG 1 1
5 1229 1 1 16 SER C C 7.854 -5.002 -0.701 1.00 . A A . 16 SER C 1 1
5 1230 1 1 16 SER CA C 8.483 -3.873 -1.565 1.00 . A A . 16 SER CA 1 1
5 1231 1 1 16 SER CB C 10.013 -4.142 -1.664 1.00 . A A . 16 SER CB 1 1
5 1232 1 1 16 SER H H 7.768 -2.507 -0.075 1.00 . A A . 16 SER H 1 1
5 1233 1 1 16 SER HA H 8.051 -3.910 -2.565 1.00 . A A . 16 SER HA 1 1
5 1234 1 1 16 SER HB2 H 10.530 -3.204 -1.863 1.00 . A A . 16 SER HB2 1 1
5 1235 1 1 16 SER HB3 H 10.364 -4.552 -0.717 1.00 . A A . 16 SER HB3 1 1
5 1236 1 1 16 SER HG H 11.249 -5.215 -2.748 1.00 . A A . 16 SER HG 1 1
5 1237 1 1 16 SER N N 8.223 -2.539 -0.976 1.00 . A A . 16 SER N 1 1
5 1238 1 1 16 SER O O 7.190 -5.882 -1.257 1.00 . A A . 16 SER O 1 1
5 1239 1 1 16 SER OG O 10.302 -5.066 -2.707 1.00 . A A . 16 SER OG 1 1
5 1240 1 1 17 LEU C C 7.579 -5.577 3.041 1.00 . A A . 17 LEU C 1 1
5 1241 1 1 17 LEU CA C 7.551 -6.036 1.556 1.00 . A A . 17 LEU CA 1 1
5 1242 1 1 17 LEU CB C 8.129 -7.479 1.369 1.00 . A A . 17 LEU CB 1 1
5 1243 1 1 17 LEU CD1 C 10.083 -8.923 2.258 1.00 . A A . 17 LEU CD1 1 1
5 1244 1 1 17 LEU CD2 C 10.329 -7.787 0.029 1.00 . A A . 17 LEU CD2 1 1
5 1245 1 1 17 LEU CG C 9.681 -7.688 1.426 1.00 . A A . 17 LEU CG 1 1
5 1246 1 1 17 LEU H H 8.682 -4.261 1.020 1.00 . A A . 17 LEU H 1 1
5 1247 1 1 17 LEU HXT H 8.641 -4.972 4.560 1.00 . A A . 17 LEU HXT 1 1
5 1248 1 1 17 LEU HA H 6.494 -6.115 1.299 1.00 . A A . 17 LEU HA 1 1
5 1249 1 1 17 LEU HB2 H 7.694 -8.101 2.151 1.00 . A A . 17 LEU HB2 1 1
5 1250 1 1 17 LEU HB3 H 7.778 -7.856 0.409 1.00 . A A . 17 LEU HB3 1 1
5 1251 1 1 17 LEU HD11 H 9.628 -8.859 3.247 1.00 . A A . 17 LEU HD11 1 1
5 1252 1 1 17 LEU HD12 H 11.168 -8.955 2.359 1.00 . A A . 17 LEU HD12 1 1
5 1253 1 1 17 LEU HD13 H 9.737 -9.827 1.757 1.00 . A A . 17 LEU HD13 1 1
5 1254 1 1 17 LEU HD21 H 10.050 -6.917 -0.565 1.00 . A A . 17 LEU HD21 1 1
5 1255 1 1 17 LEU HD22 H 11.414 -7.822 0.133 1.00 . A A . 17 LEU HD22 1 1
5 1256 1 1 17 LEU HD23 H 9.983 -8.693 -0.469 1.00 . A A . 17 LEU HD23 1 1
5 1257 1 1 17 LEU HG H 10.107 -6.813 1.918 1.00 . A A . 17 LEU HG 1 1
5 1258 1 1 17 LEU N N 8.103 -4.995 0.636 1.00 . A A . 17 LEU N 1 1
5 1259 1 1 17 LEU O O 6.530 -5.515 3.686 1.00 . A A . 17 LEU O 1 1
5 1260 1 1 17 LEU OXT O 8.799 -5.230 3.650 1.00 . A A . 17 LEU OXT 1 1
6 1261 1 1 1 ASN C C -11.017 6.679 -3.496 1.00 . A A . 1 ASN C 1 1
6 1262 1 1 1 ASN CA C -11.873 7.911 -3.840 1.00 . A A . 1 ASN CA 1 1
6 1263 1 1 1 ASN CB C -12.209 8.890 -2.668 1.00 . A A . 1 ASN CB 1 1
6 1264 1 1 1 ASN CG C -10.983 9.602 -2.063 1.00 . A A . 1 ASN CG 1 1
6 1265 1 1 1 ASN H1 H -12.880 6.827 -5.268 1.00 . A A . 1 ASN H1 1 1
6 1266 1 1 1 ASN H2 H -13.706 6.980 -3.849 1.00 . A A . 1 ASN H2 1 1
6 1267 1 1 1 ASN H3 H -13.608 8.257 -4.887 1.00 . A A . 1 ASN H3 1 1
6 1268 1 1 1 ASN HA H -11.311 8.486 -4.576 1.00 . A A . 1 ASN HA 1 1
6 1269 1 1 1 ASN HB2 H -12.905 9.645 -3.033 1.00 . A A . 1 ASN HB2 1 1
6 1270 1 1 1 ASN HB3 H -12.696 8.321 -1.877 1.00 . A A . 1 ASN HB3 1 1
6 1271 1 1 1 ASN HD21 H -11.088 8.526 -0.347 1.00 . A A . 1 ASN HD21 1 1
6 1272 1 1 1 ASN HD22 H -9.789 9.695 -0.426 1.00 . A A . 1 ASN HD22 1 1
6 1273 1 1 1 ASN N N -13.116 7.457 -4.515 1.00 . A A . 1 ASN N 1 1
6 1274 1 1 1 ASN ND2 N -10.589 9.246 -0.849 1.00 . A A . 1 ASN ND2 1 1
6 1275 1 1 1 ASN O O -10.111 6.393 -4.288 1.00 . A A . 1 ASN O 1 1
6 1276 1 1 1 ASN OD1 O -10.381 10.479 -2.683 1.00 . A A . 1 ASN OD1 1 1
6 1277 1 1 2 VAL C C -9.062 4.987 -1.395 1.00 . A A . 2 VAL C 1 1
6 1278 1 1 2 VAL CA C -10.530 4.752 -1.875 1.00 . A A . 2 VAL CA 1 1
6 1279 1 1 2 VAL CB C -10.661 3.610 -2.934 1.00 . A A . 2 VAL CB 1 1
6 1280 1 1 2 VAL CG1 C -9.601 2.481 -2.941 1.00 . A A . 2 VAL CG1 1 1
6 1281 1 1 2 VAL CG2 C -12.075 2.998 -2.971 1.00 . A A . 2 VAL CG2 1 1
6 1282 1 1 2 VAL H H -12.035 6.305 -1.780 1.00 . A A . 2 VAL H 1 1
6 1283 1 1 2 VAL HA H -11.074 4.403 -0.998 1.00 . A A . 2 VAL HA 1 1
6 1284 1 1 2 VAL HB H -10.547 4.107 -3.897 1.00 . A A . 2 VAL HB 1 1
6 1285 1 1 2 VAL HG11 H -8.603 2.919 -2.915 1.00 . A A . 2 VAL HG11 1 1
6 1286 1 1 2 VAL HG12 H -9.741 1.845 -2.067 1.00 . A A . 2 VAL HG12 1 1
6 1287 1 1 2 VAL HG13 H -9.712 1.884 -3.846 1.00 . A A . 2 VAL HG13 1 1
6 1288 1 1 2 VAL HG21 H -12.817 3.797 -2.966 1.00 . A A . 2 VAL HG21 1 1
6 1289 1 1 2 VAL HG22 H -12.189 2.402 -3.876 1.00 . A A . 2 VAL HG22 1 1
6 1290 1 1 2 VAL HG23 H -12.219 2.363 -2.097 1.00 . A A . 2 VAL HG23 1 1
6 1291 1 1 2 VAL N N -11.274 5.976 -2.357 1.00 . A A . 2 VAL N 1 1
6 1292 1 1 2 VAL O O -8.535 4.281 -0.532 1.00 . A A . 2 VAL O 1 1
6 1293 1 1 3 HIS C C -5.941 5.418 -2.117 1.00 . A A . 3 HIS C 1 1
6 1294 1 1 3 HIS CA C -7.068 6.485 -1.893 1.00 . A A . 3 HIS CA 1 1
6 1295 1 1 3 HIS CB C -7.076 7.202 -0.529 1.00 . A A . 3 HIS CB 1 1
6 1296 1 1 3 HIS CD2 C -4.948 8.640 -0.935 1.00 . A A . 3 HIS CD2 1 1
6 1297 1 1 3 HIS CE1 C -4.221 8.713 1.039 1.00 . A A . 3 HIS CE1 1 1
6 1298 1 1 3 HIS CG C -5.797 7.904 -0.091 1.00 . A A . 3 HIS CG 1 1
6 1299 1 1 3 HIS H H -9.007 6.435 -2.758 1.00 . A A . 3 HIS H 1 1
6 1300 1 1 3 HIS HA H -6.928 7.255 -2.652 1.00 . A A . 3 HIS HA 1 1
6 1301 1 1 3 HIS HB2 H -7.878 7.940 -0.541 1.00 . A A . 3 HIS HB2 1 1
6 1302 1 1 3 HIS HB3 H -7.315 6.457 0.230 1.00 . A A . 3 HIS HB3 1 1
6 1303 1 1 3 HIS HD2 H -5.094 8.770 -1.997 1.00 . A A . 3 HIS HD2 1 1
6 1304 1 1 3 HIS HE1 H -3.590 8.958 1.880 1.00 . A A . 3 HIS HE1 1 1
6 1305 1 1 3 HIS HE2 H -3.122 9.739 -0.515 1.00 . A A . 3 HIS HE2 1 1
6 1306 1 1 3 HIS N N -8.451 5.973 -2.053 1.00 . A A . 3 HIS N 1 1
6 1307 1 1 3 HIS ND1 N -5.344 7.941 1.224 1.00 . A A . 3 HIS ND1 1 1
6 1308 1 1 3 HIS NE2 N -3.901 9.172 -0.210 1.00 . A A . 3 HIS NE2 1 1
6 1309 1 1 3 HIS O O -4.840 5.478 -1.567 1.00 . A A . 3 HIS O 1 1
6 1310 1 1 4 THR C C -4.987 2.408 -2.275 1.00 . A A . 4 THR C 1 1
6 1311 1 1 4 THR CA C -5.458 3.332 -3.444 1.00 . A A . 4 THR CA 1 1
6 1312 1 1 4 THR CB C -4.418 3.776 -4.497 1.00 . A A . 4 THR CB 1 1
6 1313 1 1 4 THR CG2 C -4.916 4.616 -5.692 1.00 . A A . 4 THR CG2 1 1
6 1314 1 1 4 THR H H -7.184 4.552 -3.422 1.00 . A A . 4 THR H 1 1
6 1315 1 1 4 THR HA H -6.156 2.712 -4.007 1.00 . A A . 4 THR HA 1 1
6 1316 1 1 4 THR HB H -4.022 2.856 -4.928 1.00 . A A . 4 THR HB 1 1
6 1317 1 1 4 THR HG1 H -3.570 5.309 -3.610 1.00 . A A . 4 THR HG1 1 1
6 1318 1 1 4 THR HG21 H -4.077 4.853 -6.346 1.00 . A A . 4 THR HG21 1 1
6 1319 1 1 4 THR HG22 H -5.363 5.540 -5.326 1.00 . A A . 4 THR HG22 1 1
6 1320 1 1 4 THR HG23 H -5.661 4.048 -6.250 1.00 . A A . 4 THR HG23 1 1
6 1321 1 1 4 THR N N -6.268 4.472 -3.005 1.00 . A A . 4 THR N 1 1
6 1322 1 1 4 THR O O -3.800 2.107 -2.152 1.00 . A A . 4 THR O 1 1
6 1323 1 1 4 THR OG1 O -3.302 4.438 -3.911 1.00 . A A . 4 THR OG1 1 1
6 1324 1 1 5 PHE C C -4.977 1.785 0.873 1.00 . A A . 5 PHE C 1 1
6 1325 1 1 5 PHE CA C -5.685 1.019 -0.288 1.00 . A A . 5 PHE CA 1 1
6 1326 1 1 5 PHE CB C -5.041 -0.348 -0.657 1.00 . A A . 5 PHE CB 1 1
6 1327 1 1 5 PHE CD1 C -5.569 -1.338 -2.949 1.00 . A A . 5 PHE CD1 1 1
6 1328 1 1 5 PHE CD2 C -6.909 -2.038 -1.064 1.00 . A A . 5 PHE CD2 1 1
6 1329 1 1 5 PHE CE1 C -6.315 -2.165 -3.785 1.00 . A A . 5 PHE CE1 1 1
6 1330 1 1 5 PHE CE2 C -7.653 -2.867 -1.902 1.00 . A A . 5 PHE CE2 1 1
6 1331 1 1 5 PHE CG C -5.863 -1.265 -1.581 1.00 . A A . 5 PHE CG 1 1
6 1332 1 1 5 PHE CZ C -7.356 -2.929 -3.260 1.00 . A A . 5 PHE CZ 1 1
6 1333 1 1 5 PHE H H -6.905 2.146 -1.659 1.00 . A A . 5 PHE H 1 1
6 1334 1 1 5 PHE HA H -6.672 0.769 0.100 1.00 . A A . 5 PHE HA 1 1
6 1335 1 1 5 PHE HB2 H -4.092 -0.144 -1.151 1.00 . A A . 5 PHE HB2 1 1
6 1336 1 1 5 PHE HB3 H -4.836 -0.889 0.267 1.00 . A A . 5 PHE HB3 1 1
6 1337 1 1 5 PHE HD1 H -4.761 -0.750 -3.357 1.00 . A A . 5 PHE HD1 1 1
6 1338 1 1 5 PHE HD2 H -7.141 -1.992 -0.010 1.00 . A A . 5 PHE HD2 1 1
6 1339 1 1 5 PHE HE1 H -6.087 -2.215 -4.840 1.00 . A A . 5 PHE HE1 1 1
6 1340 1 1 5 PHE HE2 H -8.460 -3.460 -1.498 1.00 . A A . 5 PHE HE2 1 1
6 1341 1 1 5 PHE HZ H -7.934 -3.571 -3.909 1.00 . A A . 5 PHE HZ 1 1
6 1342 1 1 5 PHE N N -5.945 1.904 -1.459 1.00 . A A . 5 PHE N 1 1
6 1343 1 1 5 PHE O O -4.002 1.314 1.465 1.00 . A A . 5 PHE O 1 1
6 1344 1 1 6 ARG C C -3.598 4.317 2.218 1.00 . A A . 6 ARG C 1 1
6 1345 1 1 6 ARG CA C -5.071 3.864 2.309 1.00 . A A . 6 ARG CA 1 1
6 1346 1 1 6 ARG CB C -5.477 3.281 3.688 1.00 . A A . 6 ARG CB 1 1
6 1347 1 1 6 ARG CD C -7.426 1.742 4.436 1.00 . A A . 6 ARG CD 1 1
6 1348 1 1 6 ARG CG C -7.012 3.104 3.855 1.00 . A A . 6 ARG CG 1 1
6 1349 1 1 6 ARG CZ C -9.531 0.621 5.207 1.00 . A A . 6 ARG CZ 1 1
6 1350 1 1 6 ARG H H -6.330 3.278 0.671 1.00 . A A . 6 ARG H 1 1
6 1351 1 1 6 ARG HA H -5.658 4.776 2.201 1.00 . A A . 6 ARG HA 1 1
6 1352 1 1 6 ARG HB2 H -5.002 2.306 3.805 1.00 . A A . 6 ARG HB2 1 1
6 1353 1 1 6 ARG HB3 H -5.112 3.945 4.472 1.00 . A A . 6 ARG HB3 1 1
6 1354 1 1 6 ARG HD2 H -7.170 0.957 3.725 1.00 . A A . 6 ARG HD2 1 1
6 1355 1 1 6 ARG HD3 H -6.883 1.574 5.366 1.00 . A A . 6 ARG HD3 1 1
6 1356 1 1 6 ARG HE H -9.425 2.522 4.513 1.00 . A A . 6 ARG HE 1 1
6 1357 1 1 6 ARG HG2 H -7.376 3.886 4.521 1.00 . A A . 6 ARG HG2 1 1
6 1358 1 1 6 ARG HG3 H -7.485 3.226 2.881 1.00 . A A . 6 ARG HG3 1 1
6 1359 1 1 6 ARG HH11 H -11.313 1.581 5.181 1.00 . A A . 6 ARG HH11 1 1
6 1360 1 1 6 ARG HH12 H -11.349 -0.065 5.773 1.00 . A A . 6 ARG HH12 1 1
6 1361 1 1 6 ARG HH21 H -7.943 -0.639 5.376 1.00 . A A . 6 ARG HH21 1 1
6 1362 1 1 6 ARG HH22 H -9.483 -1.297 5.882 1.00 . A A . 6 ARG HH22 1 1
6 1363 1 1 6 ARG N N -5.533 2.971 1.211 1.00 . A A . 6 ARG N 1 1
6 1364 1 1 6 ARG NE N -8.882 1.694 4.711 1.00 . A A . 6 ARG NE 1 1
6 1365 1 1 6 ARG NH1 N -10.833 0.720 5.402 1.00 . A A . 6 ARG NH1 1 1
6 1366 1 1 6 ARG NH2 N -8.938 -0.531 5.513 1.00 . A A . 6 ARG NH2 1 1
6 1367 1 1 6 ARG O O -2.761 4.122 3.102 1.00 . A A . 6 ARG O 1 1
6 1368 1 1 7 GLY C C -1.181 4.630 -0.109 1.00 . A A . 7 GLY C 1 1
6 1369 1 1 7 GLY CA C -2.103 5.560 0.677 1.00 . A A . 7 GLY CA 1 1
6 1370 1 1 7 GLY H H -4.167 5.045 0.434 1.00 . A A . 7 GLY H 1 1
6 1371 1 1 7 GLY HA2 H -2.303 6.444 0.072 1.00 . A A . 7 GLY HA2 1 1
6 1372 1 1 7 GLY HA3 H -1.580 5.871 1.582 1.00 . A A . 7 GLY HA3 1 1
6 1373 1 1 7 GLY N N -3.391 4.961 1.075 1.00 . A A . 7 GLY N 1 1
6 1374 1 1 7 GLY O O -0.037 4.433 0.311 1.00 . A A . 7 GLY O 1 1
6 1375 1 1 8 ASP C C -0.358 1.881 -1.364 1.00 . A A . 8 ASP C 1 1
6 1376 1 1 8 ASP CA C -0.844 3.161 -2.113 1.00 . A A . 8 ASP CA 1 1
6 1377 1 1 8 ASP CB C 0.255 3.977 -2.866 1.00 . A A . 8 ASP CB 1 1
6 1378 1 1 8 ASP CG C 0.975 3.252 -4.013 1.00 . A A . 8 ASP CG 1 1
6 1379 1 1 8 ASP H H -2.593 4.327 -1.551 1.00 . A A . 8 ASP H 1 1
6 1380 1 1 8 ASP HA H -1.526 2.806 -2.886 1.00 . A A . 8 ASP HA 1 1
6 1381 1 1 8 ASP HB2 H -0.219 4.867 -3.281 1.00 . A A . 8 ASP HB2 1 1
6 1382 1 1 8 ASP HB3 H 1.002 4.295 -2.139 1.00 . A A . 8 ASP HB3 1 1
6 1383 1 1 8 ASP N N -1.656 4.092 -1.257 1.00 . A A . 8 ASP N 1 1
6 1384 1 1 8 ASP O O 0.722 1.373 -1.654 1.00 . A A . 8 ASP O 1 1
6 1385 1 1 8 ASP OD1 O 0.392 2.756 -4.976 1.00 . A A . 8 ASP OD1 1 1
6 1386 1 1 8 ASP OD2 O 2.334 3.227 -3.835 1.00 . A A . 8 ASP OD2 1 1
6 1387 1 1 9 ASN C C 0.506 0.222 1.146 1.00 . A A . 9 ASN C 1 1
6 1388 1 1 9 ASN CA C -0.831 0.101 0.353 1.00 . A A . 9 ASN CA 1 1
6 1389 1 1 9 ASN CB C -1.021 -1.162 -0.535 1.00 . A A . 9 ASN CB 1 1
6 1390 1 1 9 ASN CG C -1.169 -2.495 0.218 1.00 . A A . 9 ASN CG 1 1
6 1391 1 1 9 ASN H H -2.080 1.739 -0.290 1.00 . A A . 9 ASN H 1 1
6 1392 1 1 9 ASN HA H -1.607 0.032 1.115 1.00 . A A . 9 ASN HA 1 1
6 1393 1 1 9 ASN HB2 H -1.919 -1.016 -1.136 1.00 . A A . 9 ASN HB2 1 1
6 1394 1 1 9 ASN HB3 H -0.167 -1.240 -1.208 1.00 . A A . 9 ASN HB3 1 1
6 1395 1 1 9 ASN HD21 H -3.159 -2.215 0.480 1.00 . A A . 9 ASN HD21 1 1
6 1396 1 1 9 ASN HD22 H -2.511 -3.699 1.143 1.00 . A A . 9 ASN HD22 1 1
6 1397 1 1 9 ASN N N -1.177 1.314 -0.445 1.00 . A A . 9 ASN N 1 1
6 1398 1 1 9 ASN ND2 N -2.375 -2.829 0.648 1.00 . A A . 9 ASN ND2 1 1
6 1399 1 1 9 ASN O O 1.244 -0.747 1.280 1.00 . A A . 9 ASN O 1 1
6 1400 1 1 9 ASN OD1 O -0.204 -3.234 0.411 1.00 . A A . 9 ASN OD1 1 1
6 1401 1 1 10 VAL C C 3.238 1.765 1.636 1.00 . A A . 10 VAL C 1 1
6 1402 1 1 10 VAL CA C 1.959 1.742 2.531 1.00 . A A . 10 VAL CA 1 1
6 1403 1 1 10 VAL CB C 2.028 1.133 3.981 1.00 . A A . 10 VAL CB 1 1
6 1404 1 1 10 VAL CG1 C 2.311 -0.380 4.111 1.00 . A A . 10 VAL CG1 1 1
6 1405 1 1 10 VAL CG2 C 3.009 1.914 4.885 1.00 . A A . 10 VAL CG2 1 1
6 1406 1 1 10 VAL H H 0.034 2.123 1.652 1.00 . A A . 10 VAL H 1 1
6 1407 1 1 10 VAL HA H 1.809 2.802 2.738 1.00 . A A . 10 VAL HA 1 1
6 1408 1 1 10 VAL HB H 1.040 1.287 4.414 1.00 . A A . 10 VAL HB 1 1
6 1409 1 1 10 VAL HG11 H 1.622 -0.935 3.475 1.00 . A A . 10 VAL HG11 1 1
6 1410 1 1 10 VAL HG12 H 3.336 -0.585 3.802 1.00 . A A . 10 VAL HG12 1 1
6 1411 1 1 10 VAL HG13 H 2.176 -0.687 5.148 1.00 . A A . 10 VAL HG13 1 1
6 1412 1 1 10 VAL HG21 H 2.813 2.982 4.797 1.00 . A A . 10 VAL HG21 1 1
6 1413 1 1 10 VAL HG22 H 4.033 1.705 4.575 1.00 . A A . 10 VAL HG22 1 1
6 1414 1 1 10 VAL HG23 H 2.873 1.604 5.921 1.00 . A A . 10 VAL HG23 1 1
6 1415 1 1 10 VAL N N 0.741 1.407 1.744 1.00 . A A . 10 VAL N 1 1
6 1416 1 1 10 VAL O O 4.268 1.176 1.953 1.00 . A A . 10 VAL O 1 1
6 1417 1 1 11 HIS C C 4.522 1.428 -1.261 1.00 . A A . 11 HIS C 1 1
6 1418 1 1 11 HIS CA C 4.220 2.745 -0.481 1.00 . A A . 11 HIS CA 1 1
6 1419 1 1 11 HIS CB C 5.492 3.466 0.102 1.00 . A A . 11 HIS CB 1 1
6 1420 1 1 11 HIS CD2 C 6.415 5.682 1.029 1.00 . A A . 11 HIS CD2 1 1
6 1421 1 1 11 HIS CE1 C 4.802 6.975 0.655 1.00 . A A . 11 HIS CE1 1 1
6 1422 1 1 11 HIS CG C 5.363 4.957 0.444 1.00 . A A . 11 HIS CG 1 1
6 1423 1 1 11 HIS H H 2.272 3.055 0.405 1.00 . A A . 11 HIS H 1 1
6 1424 1 1 11 HIS HA H 3.806 3.433 -1.219 1.00 . A A . 11 HIS HA 1 1
6 1425 1 1 11 HIS HB2 H 5.773 2.945 1.017 1.00 . A A . 11 HIS HB2 1 1
6 1426 1 1 11 HIS HB3 H 6.304 3.353 -0.616 1.00 . A A . 11 HIS HB3 1 1
6 1427 1 1 11 HIS HD2 H 7.366 5.260 1.319 1.00 . A A . 11 HIS HD2 1 1
6 1428 1 1 11 HIS HE1 H 4.214 7.880 0.612 1.00 . A A . 11 HIS HE1 1 1
6 1429 1 1 11 HIS HE2 H 6.586 7.779 1.573 1.00 . A A . 11 HIS HE2 1 1
6 1430 1 1 11 HIS N N 3.138 2.555 0.543 1.00 . A A . 11 HIS N 1 1
6 1431 1 1 11 HIS ND1 N 4.280 5.796 0.179 1.00 . A A . 11 HIS ND1 1 1
6 1432 1 1 11 HIS NE2 N 6.063 7.007 1.183 1.00 . A A . 11 HIS NE2 1 1
6 1433 1 1 11 HIS O O 5.683 1.099 -1.497 1.00 . A A . 11 HIS O 1 1
6 1434 1 1 12 ASN C C 3.995 -1.688 -1.525 1.00 . A A . 12 ASN C 1 1
6 1435 1 1 12 ASN CA C 3.573 -0.552 -2.504 1.00 . A A . 12 ASN CA 1 1
6 1436 1 1 12 ASN CB C 4.368 -0.495 -3.854 1.00 . A A . 12 ASN CB 1 1
6 1437 1 1 12 ASN CG C 3.704 0.363 -4.944 1.00 . A A . 12 ASN CG 1 1
6 1438 1 1 12 ASN H H 2.549 1.110 -1.608 1.00 . A A . 12 ASN H 1 1
6 1439 1 1 12 ASN HA H 2.549 -0.793 -2.790 1.00 . A A . 12 ASN HA 1 1
6 1440 1 1 12 ASN HB2 H 5.363 -0.098 -3.655 1.00 . A A . 12 ASN HB2 1 1
6 1441 1 1 12 ASN HB3 H 4.468 -1.512 -4.233 1.00 . A A . 12 ASN HB3 1 1
6 1442 1 1 12 ASN HD21 H 2.192 -0.970 -5.166 1.00 . A A . 12 ASN HD21 1 1
6 1443 1 1 12 ASN HD22 H 2.104 0.447 -6.188 1.00 . A A . 12 ASN HD22 1 1
6 1444 1 1 12 ASN N N 3.472 0.730 -1.757 1.00 . A A . 12 ASN N 1 1
6 1445 1 1 12 ASN ND2 N 2.578 -0.089 -5.475 1.00 . A A . 12 ASN ND2 1 1
6 1446 1 1 12 ASN O O 4.913 -2.456 -1.831 1.00 . A A . 12 ASN O 1 1
6 1447 1 1 12 ASN OD1 O 4.184 1.438 -5.299 1.00 . A A . 12 ASN OD1 1 1
6 1448 1 1 13 SER C C 5.016 -2.600 1.207 1.00 . A A . 13 SER C 1 1
6 1449 1 1 13 SER CA C 3.593 -2.831 0.695 1.00 . A A . 13 SER CA 1 1
6 1450 1 1 13 SER CB C 3.193 -4.286 0.279 1.00 . A A . 13 SER CB 1 1
6 1451 1 1 13 SER H H 2.544 -1.150 -0.181 1.00 . A A . 13 SER H 1 1
6 1452 1 1 13 SER HA H 2.943 -2.583 1.534 1.00 . A A . 13 SER HA 1 1
6 1453 1 1 13 SER HB2 H 3.143 -4.903 1.175 1.00 . A A . 13 SER HB2 1 1
6 1454 1 1 13 SER HB3 H 2.209 -4.261 -0.189 1.00 . A A . 13 SER HB3 1 1
6 1455 1 1 13 SER HG H 4.130 -5.827 -0.501 1.00 . A A . 13 SER HG 1 1
6 1456 1 1 13 SER N N 3.299 -1.800 -0.351 1.00 . A A . 13 SER N 1 1
6 1457 1 1 13 SER O O 5.888 -3.403 0.919 1.00 . A A . 13 SER O 1 1
6 1458 1 1 13 SER OG O 4.119 -4.875 -0.628 1.00 . A A . 13 SER OG 1 1
6 1459 1 1 14 SER C C 7.661 -1.106 1.345 1.00 . A A . 14 SER C 1 1
6 1460 1 1 14 SER CA C 6.596 -1.126 2.484 1.00 . A A . 14 SER CA 1 1
6 1461 1 1 14 SER CB C 6.913 -2.027 3.709 1.00 . A A . 14 SER CB 1 1
6 1462 1 1 14 SER H H 4.482 -0.871 2.146 1.00 . A A . 14 SER H 1 1
6 1463 1 1 14 SER HA H 6.518 -0.105 2.857 1.00 . A A . 14 SER HA 1 1
6 1464 1 1 14 SER HB2 H 6.059 -2.024 4.386 1.00 . A A . 14 SER HB2 1 1
6 1465 1 1 14 SER HB3 H 7.093 -3.045 3.365 1.00 . A A . 14 SER HB3 1 1
6 1466 1 1 14 SER HG H 8.235 -2.137 5.157 1.00 . A A . 14 SER HG 1 1
6 1467 1 1 14 SER N N 5.257 -1.488 1.948 1.00 . A A . 14 SER N 1 1
6 1468 1 1 14 SER O O 8.818 -1.436 1.627 1.00 . A A . 14 SER O 1 1
6 1469 1 1 14 SER OG O 8.063 -1.564 4.407 1.00 . A A . 14 SER OG 1 1
6 1470 1 1 15 SER C C 8.831 -2.137 -1.422 1.00 . A A . 15 SER C 1 1
6 1471 1 1 15 SER CA C 8.285 -0.687 -1.082 1.00 . A A . 15 SER CA 1 1
6 1472 1 1 15 SER CB C 9.474 0.268 -0.786 1.00 . A A . 15 SER CB 1 1
6 1473 1 1 15 SER H H 6.354 -0.374 -0.087 1.00 . A A . 15 SER H 1 1
6 1474 1 1 15 SER HA H 7.765 -0.310 -1.963 1.00 . A A . 15 SER HA 1 1
6 1475 1 1 15 SER HB2 H 9.089 1.189 -0.348 1.00 . A A . 15 SER HB2 1 1
6 1476 1 1 15 SER HB3 H 10.148 -0.211 -0.075 1.00 . A A . 15 SER HB3 1 1
6 1477 1 1 15 SER HG H 10.922 1.175 -1.758 1.00 . A A . 15 SER HG 1 1
6 1478 1 1 15 SER N N 7.300 -0.688 0.075 1.00 . A A . 15 SER N 1 1
6 1479 1 1 15 SER O O 9.627 -2.280 -2.355 1.00 . A A . 15 SER O 1 1
6 1480 1 1 15 SER OG O 10.195 0.585 -1.973 1.00 . A A . 15 SER OG 1 1
6 1481 1 1 16 SER C C 7.814 -5.575 -0.193 1.00 . A A . 16 SER C 1 1
6 1482 1 1 16 SER CA C 8.804 -4.591 -0.883 1.00 . A A . 16 SER CA 1 1
6 1483 1 1 16 SER CB C 10.212 -4.662 -0.192 1.00 . A A . 16 SER CB 1 1
6 1484 1 1 16 SER H H 7.689 -3.017 0.006 1.00 . A A . 16 SER H 1 1
6 1485 1 1 16 SER HA H 8.892 -4.827 -1.943 1.00 . A A . 16 SER HA 1 1
6 1486 1 1 16 SER HB2 H 10.543 -5.701 -0.202 1.00 . A A . 16 SER HB2 1 1
6 1487 1 1 16 SER HB3 H 10.916 -4.068 -0.775 1.00 . A A . 16 SER HB3 1 1
6 1488 1 1 16 SER HG H 11.093 -3.811 1.351 1.00 . A A . 16 SER HG 1 1
6 1489 1 1 16 SER N N 8.379 -3.201 -0.708 1.00 . A A . 16 SER N 1 1
6 1490 1 1 16 SER O O 7.223 -6.415 -0.876 1.00 . A A . 16 SER O 1 1
6 1491 1 1 16 SER OG O 10.236 -4.200 1.161 1.00 . A A . 16 SER OG 1 1
6 1492 1 1 17 LEU C C 6.394 -5.703 3.286 1.00 . A A . 17 LEU C 1 1
6 1493 1 1 17 LEU CA C 6.734 -6.361 1.920 1.00 . A A . 17 LEU CA 1 1
6 1494 1 1 17 LEU CB C 7.199 -7.842 2.089 1.00 . A A . 17 LEU CB 1 1
6 1495 1 1 17 LEU CD1 C 8.510 -9.447 3.621 1.00 . A A . 17 LEU CD1 1 1
6 1496 1 1 17 LEU CD2 C 9.762 -8.192 1.844 1.00 . A A . 17 LEU CD2 1 1
6 1497 1 1 17 LEU CG C 8.558 -8.138 2.806 1.00 . A A . 17 LEU CG 1 1
6 1498 1 1 17 LEU H H 8.213 -4.802 1.654 1.00 . A A . 17 LEU H 1 1
6 1499 1 1 17 LEU HXT H 4.993 -5.010 4.453 1.00 . A A . 17 LEU HXT 1 1
6 1500 1 1 17 LEU HA H 5.804 -6.393 1.353 1.00 . A A . 17 LEU HA 1 1
6 1501 1 1 17 LEU HB2 H 6.416 -8.376 2.628 1.00 . A A . 17 LEU HB2 1 1
6 1502 1 1 17 LEU HB3 H 7.266 -8.271 1.090 1.00 . A A . 17 LEU HB3 1 1
6 1503 1 1 17 LEU HD11 H 7.662 -9.419 4.305 1.00 . A A . 17 LEU HD11 1 1
6 1504 1 1 17 LEU HD12 H 8.401 -10.293 2.943 1.00 . A A . 17 LEU HD12 1 1
6 1505 1 1 17 LEU HD13 H 9.433 -9.555 4.191 1.00 . A A . 17 LEU HD13 1 1
6 1506 1 1 17 LEU HD21 H 9.805 -7.271 1.263 1.00 . A A . 17 LEU HD21 1 1
6 1507 1 1 17 LEU HD22 H 10.681 -8.302 2.419 1.00 . A A . 17 LEU HD22 1 1
6 1508 1 1 17 LEU HD23 H 9.651 -9.042 1.171 1.00 . A A . 17 LEU HD23 1 1
6 1509 1 1 17 LEU HG H 8.740 -7.325 3.509 1.00 . A A . 17 LEU HG 1 1
6 1510 1 1 17 LEU N N 7.668 -5.487 1.152 1.00 . A A . 17 LEU N 1 1
6 1511 1 1 17 LEU O O 7.259 -5.431 4.119 1.00 . A A . 17 LEU O 1 1
6 1512 1 1 17 LEU OXT O 5.049 -5.410 3.582 1.00 . A A . 17 LEU OXT 1 1
7 1513 1 1 1 ASN C C -4.566 5.367 6.435 1.00 . A A . 1 ASN C 1 1
7 1514 1 1 1 ASN CA C -4.793 5.246 7.979 1.00 . A A . 1 ASN CA 1 1
7 1515 1 1 1 ASN CB C -5.612 6.425 8.593 1.00 . A A . 1 ASN CB 1 1
7 1516 1 1 1 ASN CG C -7.114 6.412 8.242 1.00 . A A . 1 ASN CG 1 1
7 1517 1 1 1 ASN H1 H -2.934 4.410 8.278 1.00 . A A . 1 ASN H1 1 1
7 1518 1 1 1 ASN H2 H -3.617 5.009 9.654 1.00 . A A . 1 ASN H2 1 1
7 1519 1 1 1 ASN H3 H -2.975 6.038 8.537 1.00 . A A . 1 ASN H3 1 1
7 1520 1 1 1 ASN HA H -5.333 4.319 8.172 1.00 . A A . 1 ASN HA 1 1
7 1521 1 1 1 ASN HB2 H -5.516 6.377 9.678 1.00 . A A . 1 ASN HB2 1 1
7 1522 1 1 1 ASN HB3 H -5.182 7.365 8.247 1.00 . A A . 1 ASN HB3 1 1
7 1523 1 1 1 ASN HD21 H -6.953 8.062 7.073 1.00 . A A . 1 ASN HD21 1 1
7 1524 1 1 1 ASN HD22 H -8.558 7.376 7.193 1.00 . A A . 1 ASN HD22 1 1
7 1525 1 1 1 ASN N N -3.473 5.169 8.668 1.00 . A A . 1 ASN N 1 1
7 1526 1 1 1 ASN ND2 N -7.578 7.358 7.439 1.00 . A A . 1 ASN ND2 1 1
7 1527 1 1 1 ASN O O -4.907 6.373 5.803 1.00 . A A . 1 ASN O 1 1
7 1528 1 1 1 ASN OD1 O -7.868 5.551 8.695 1.00 . A A . 1 ASN OD1 1 1
7 1529 1 1 2 VAL C C -5.027 3.989 3.490 1.00 . A A . 2 VAL C 1 1
7 1530 1 1 2 VAL CA C -3.749 4.203 4.366 1.00 . A A . 2 VAL CA 1 1
7 1531 1 1 2 VAL CB C -2.892 2.895 4.078 1.00 . A A . 2 VAL CB 1 1
7 1532 1 1 2 VAL CG1 C -2.228 2.872 2.690 1.00 . A A . 2 VAL CG1 1 1
7 1533 1 1 2 VAL CG2 C -1.807 2.493 5.111 1.00 . A A . 2 VAL CG2 1 1
7 1534 1 1 2 VAL H H -3.735 3.524 6.405 1.00 . A A . 2 VAL H 1 1
7 1535 1 1 2 VAL HA H -3.208 5.084 4.021 1.00 . A A . 2 VAL HA 1 1
7 1536 1 1 2 VAL HB H -3.607 2.073 4.072 1.00 . A A . 2 VAL HB 1 1
7 1537 1 1 2 VAL HG11 H -2.960 3.150 1.932 1.00 . A A . 2 VAL HG11 1 1
7 1538 1 1 2 VAL HG12 H -1.400 3.580 2.672 1.00 . A A . 2 VAL HG12 1 1
7 1539 1 1 2 VAL HG13 H -1.853 1.869 2.483 1.00 . A A . 2 VAL HG13 1 1
7 1540 1 1 2 VAL HG21 H -2.238 2.497 6.112 1.00 . A A . 2 VAL HG21 1 1
7 1541 1 1 2 VAL HG22 H -1.436 1.495 4.880 1.00 . A A . 2 VAL HG22 1 1
7 1542 1 1 2 VAL HG23 H -0.982 3.205 5.068 1.00 . A A . 2 VAL HG23 1 1
7 1543 1 1 2 VAL N N -4.004 4.307 5.827 1.00 . A A . 2 VAL N 1 1
7 1544 1 1 2 VAL O O -5.080 4.426 2.343 1.00 . A A . 2 VAL O 1 1
7 1545 1 1 3 HIS C C -7.107 1.801 2.274 1.00 . A A . 3 HIS C 1 1
7 1546 1 1 3 HIS CA C -7.298 2.859 3.435 1.00 . A A . 3 HIS CA 1 1
7 1547 1 1 3 HIS CB C -8.102 4.144 3.159 1.00 . A A . 3 HIS CB 1 1
7 1548 1 1 3 HIS CD2 C -9.946 4.417 1.347 1.00 . A A . 3 HIS CD2 1 1
7 1549 1 1 3 HIS CE1 C -11.501 3.376 2.304 1.00 . A A . 3 HIS CE1 1 1
7 1550 1 1 3 HIS CG C -9.500 3.941 2.589 1.00 . A A . 3 HIS CG 1 1
7 1551 1 1 3 HIS H H -5.846 2.931 4.996 1.00 . A A . 3 HIS H 1 1
7 1552 1 1 3 HIS HA H -7.846 2.336 4.218 1.00 . A A . 3 HIS HA 1 1
7 1553 1 1 3 HIS HB2 H -8.200 4.685 4.100 1.00 . A A . 3 HIS HB2 1 1
7 1554 1 1 3 HIS HB3 H -7.534 4.762 2.464 1.00 . A A . 3 HIS HB3 1 1
7 1555 1 1 3 HIS HD2 H -9.346 4.985 0.652 1.00 . A A . 3 HIS HD2 1 1
7 1556 1 1 3 HIS HE1 H -12.473 2.940 2.483 1.00 . A A . 3 HIS HE1 1 1
7 1557 1 1 3 HIS HE2 H -11.872 4.238 0.355 1.00 . A A . 3 HIS HE2 1 1
7 1558 1 1 3 HIS N N -6.008 3.251 4.052 1.00 . A A . 3 HIS N 1 1
7 1559 1 1 3 HIS ND1 N -10.509 3.246 3.247 1.00 . A A . 3 HIS ND1 1 1
7 1560 1 1 3 HIS NE2 N -11.262 4.055 1.139 1.00 . A A . 3 HIS NE2 1 1
7 1561 1 1 3 HIS O O -8.001 1.538 1.467 1.00 . A A . 3 HIS O 1 1
7 1562 1 1 4 THR C C -5.652 0.229 -0.102 1.00 . A A . 4 THR C 1 1
7 1563 1 1 4 THR CA C -5.360 0.127 1.422 1.00 . A A . 4 THR CA 1 1
7 1564 1 1 4 THR CB C -5.578 -1.263 2.067 1.00 . A A . 4 THR CB 1 1
7 1565 1 1 4 THR CG2 C -5.150 -1.460 3.538 1.00 . A A . 4 THR CG2 1 1
7 1566 1 1 4 THR H H -5.313 1.436 3.072 1.00 . A A . 4 THR H 1 1
7 1567 1 1 4 THR HA H -4.282 0.279 1.490 1.00 . A A . 4 THR HA 1 1
7 1568 1 1 4 THR HB H -4.974 -1.959 1.485 1.00 . A A . 4 THR HB 1 1
7 1569 1 1 4 THR HG1 H -7.495 -1.182 2.489 1.00 . A A . 4 THR HG1 1 1
7 1570 1 1 4 THR HG21 H -5.367 -2.483 3.845 1.00 . A A . 4 THR HG21 1 1
7 1571 1 1 4 THR HG22 H -4.081 -1.271 3.633 1.00 . A A . 4 THR HG22 1 1
7 1572 1 1 4 THR HG23 H -5.700 -0.766 4.173 1.00 . A A . 4 THR HG23 1 1
7 1573 1 1 4 THR N N -5.918 1.161 2.311 1.00 . A A . 4 THR N 1 1
7 1574 1 1 4 THR O O -5.764 -0.765 -0.825 1.00 . A A . 4 THR O 1 1
7 1575 1 1 4 THR OG1 O -6.925 -1.698 1.914 1.00 . A A . 4 THR OG1 1 1
7 1576 1 1 5 PHE C C -5.645 3.384 -2.155 1.00 . A A . 5 PHE C 1 1
7 1577 1 1 5 PHE CA C -5.965 1.899 -1.934 1.00 . A A . 5 PHE CA 1 1
7 1578 1 1 5 PHE CB C -7.387 1.506 -2.435 1.00 . A A . 5 PHE CB 1 1
7 1579 1 1 5 PHE CD1 C -8.571 2.864 -4.239 1.00 . A A . 5 PHE CD1 1 1
7 1580 1 1 5 PHE CD2 C -7.156 1.031 -4.933 1.00 . A A . 5 PHE CD2 1 1
7 1581 1 1 5 PHE CE1 C -8.855 3.147 -5.573 1.00 . A A . 5 PHE CE1 1 1
7 1582 1 1 5 PHE CE2 C -7.444 1.316 -6.265 1.00 . A A . 5 PHE CE2 1 1
7 1583 1 1 5 PHE CG C -7.716 1.805 -3.909 1.00 . A A . 5 PHE CG 1 1
7 1584 1 1 5 PHE CZ C -8.293 2.374 -6.584 1.00 . A A . 5 PHE CZ 1 1
7 1585 1 1 5 PHE H H -5.552 2.224 0.127 1.00 . A A . 5 PHE H 1 1
7 1586 1 1 5 PHE HA H -5.261 1.342 -2.552 1.00 . A A . 5 PHE HA 1 1
7 1587 1 1 5 PHE HB2 H -7.504 0.433 -2.282 1.00 . A A . 5 PHE HB2 1 1
7 1588 1 1 5 PHE HB3 H -8.120 2.019 -1.813 1.00 . A A . 5 PHE HB3 1 1
7 1589 1 1 5 PHE HD1 H -9.011 3.463 -3.456 1.00 . A A . 5 PHE HD1 1 1
7 1590 1 1 5 PHE HD2 H -6.499 0.210 -4.688 1.00 . A A . 5 PHE HD2 1 1
7 1591 1 1 5 PHE HE1 H -9.512 3.967 -5.823 1.00 . A A . 5 PHE HE1 1 1
7 1592 1 1 5 PHE HE2 H -7.009 0.716 -7.052 1.00 . A A . 5 PHE HE2 1 1
7 1593 1 1 5 PHE HZ H -8.515 2.594 -7.618 1.00 . A A . 5 PHE HZ 1 1
7 1594 1 1 5 PHE N N -5.705 1.490 -0.549 1.00 . A A . 5 PHE N 1 1
7 1595 1 1 5 PHE O O -5.059 3.714 -3.194 1.00 . A A . 5 PHE O 1 1
7 1596 1 1 6 ARG C C -4.399 6.274 -0.785 1.00 . A A . 6 ARG C 1 1
7 1597 1 1 6 ARG CA C -5.745 5.718 -1.297 1.00 . A A . 6 ARG CA 1 1
7 1598 1 1 6 ARG CB C -7.078 6.428 -0.917 1.00 . A A . 6 ARG CB 1 1
7 1599 1 1 6 ARG CD C -9.612 6.601 -1.624 1.00 . A A . 6 ARG CD 1 1
7 1600 1 1 6 ARG CG C -8.289 5.827 -1.713 1.00 . A A . 6 ARG CG 1 1
7 1601 1 1 6 ARG CZ C -11.912 6.412 -2.600 1.00 . A A . 6 ARG CZ 1 1
7 1602 1 1 6 ARG H H -6.435 3.903 -0.359 1.00 . A A . 6 ARG H 1 1
7 1603 1 1 6 ARG HA H -5.682 5.879 -2.374 1.00 . A A . 6 ARG HA 1 1
7 1604 1 1 6 ARG HB2 H -7.256 6.306 0.152 1.00 . A A . 6 ARG HB2 1 1
7 1605 1 1 6 ARG HB3 H -6.993 7.490 -1.147 1.00 . A A . 6 ARG HB3 1 1
7 1606 1 1 6 ARG HD2 H -9.953 6.609 -0.588 1.00 . A A . 6 ARG HD2 1 1
7 1607 1 1 6 ARG HD3 H -9.452 7.627 -1.957 1.00 . A A . 6 ARG HD3 1 1
7 1608 1 1 6 ARG HE H -10.388 5.140 -2.993 1.00 . A A . 6 ARG HE 1 1
7 1609 1 1 6 ARG HG2 H -8.006 5.755 -2.763 1.00 . A A . 6 ARG HG2 1 1
7 1610 1 1 6 ARG HG3 H -8.468 4.820 -1.336 1.00 . A A . 6 ARG HG3 1 1
7 1611 1 1 6 ARG HH11 H -11.791 8.021 -1.361 1.00 . A A . 6 ARG HH11 1 1
7 1612 1 1 6 ARG HH12 H -13.349 7.769 -2.115 1.00 . A A . 6 ARG HH12 1 1
7 1613 1 1 6 ARG HH21 H -12.398 4.924 -3.884 1.00 . A A . 6 ARG HH21 1 1
7 1614 1 1 6 ARG HH22 H -13.683 6.051 -3.513 1.00 . A A . 6 ARG HH22 1 1
7 1615 1 1 6 ARG N N -5.989 4.257 -1.193 1.00 . A A . 6 ARG N 1 1
7 1616 1 1 6 ARG NE N -10.649 5.966 -2.473 1.00 . A A . 6 ARG NE 1 1
7 1617 1 1 6 ARG NH1 N -12.389 7.488 -1.975 1.00 . A A . 6 ARG NH1 1 1
7 1618 1 1 6 ARG NH2 N -12.728 5.743 -3.395 1.00 . A A . 6 ARG NH2 1 1
7 1619 1 1 6 ARG O O -3.972 7.374 -1.147 1.00 . A A . 6 ARG O 1 1
7 1620 1 1 7 GLY C C -1.319 4.862 -0.182 1.00 . A A . 7 GLY C 1 1
7 1621 1 1 7 GLY CA C -2.410 5.696 0.591 1.00 . A A . 7 GLY CA 1 1
7 1622 1 1 7 GLY H H -4.221 4.594 0.284 1.00 . A A . 7 GLY H 1 1
7 1623 1 1 7 GLY HA2 H -2.174 6.757 0.507 1.00 . A A . 7 GLY HA2 1 1
7 1624 1 1 7 GLY HA3 H -2.404 5.409 1.642 1.00 . A A . 7 GLY HA3 1 1
7 1625 1 1 7 GLY N N -3.756 5.454 0.027 1.00 . A A . 7 GLY N 1 1
7 1626 1 1 7 GLY O O -0.143 4.963 0.171 1.00 . A A . 7 GLY O 1 1
7 1627 1 1 8 ASP C C -0.362 1.944 -1.300 1.00 . A A . 8 ASP C 1 1
7 1628 1 1 8 ASP CA C -0.830 3.209 -2.066 1.00 . A A . 8 ASP CA 1 1
7 1629 1 1 8 ASP CB C 0.277 4.040 -2.792 1.00 . A A . 8 ASP CB 1 1
7 1630 1 1 8 ASP CG C 1.018 3.320 -3.931 1.00 . A A . 8 ASP CG 1 1
7 1631 1 1 8 ASP H H -2.690 4.063 -1.449 1.00 . A A . 8 ASP H 1 1
7 1632 1 1 8 ASP HA H -1.475 2.837 -2.862 1.00 . A A . 8 ASP HA 1 1
7 1633 1 1 8 ASP HB2 H -0.181 4.943 -3.196 1.00 . A A . 8 ASP HB2 1 1
7 1634 1 1 8 ASP HB3 H 1.016 4.335 -2.047 1.00 . A A . 8 ASP HB3 1 1
7 1635 1 1 8 ASP N N -1.705 4.067 -1.225 1.00 . A A . 8 ASP N 1 1
7 1636 1 1 8 ASP O O 0.753 1.483 -1.523 1.00 . A A . 8 ASP O 1 1
7 1637 1 1 8 ASP OD1 O 0.453 2.839 -4.913 1.00 . A A . 8 ASP OD1 1 1
7 1638 1 1 8 ASP OD2 O 2.372 3.285 -3.726 1.00 . A A . 8 ASP OD2 1 1
7 1639 1 1 9 ASN C C 0.466 0.206 1.131 1.00 . A A . 9 ASN C 1 1
7 1640 1 1 9 ASN CA C -0.881 0.114 0.347 1.00 . A A . 9 ASN CA 1 1
7 1641 1 1 9 ASN CB C -1.099 -1.136 -0.553 1.00 . A A . 9 ASN CB 1 1
7 1642 1 1 9 ASN CG C -1.196 -2.488 0.180 1.00 . A A . 9 ASN CG 1 1
7 1643 1 1 9 ASN H H -2.156 1.717 -0.355 1.00 . A A . 9 ASN H 1 1
7 1644 1 1 9 ASN HA H -1.652 0.049 1.115 1.00 . A A . 9 ASN HA 1 1
7 1645 1 1 9 ASN HB2 H -2.014 -0.990 -1.126 1.00 . A A . 9 ASN HB2 1 1
7 1646 1 1 9 ASN HB3 H -0.263 -1.195 -1.250 1.00 . A A . 9 ASN HB3 1 1
7 1647 1 1 9 ASN HD21 H -3.173 -2.235 0.549 1.00 . A A . 9 ASN HD21 1 1
7 1648 1 1 9 ASN HD22 H -2.478 -3.725 1.147 1.00 . A A . 9 ASN HD22 1 1
7 1649 1 1 9 ASN N N -1.228 1.331 -0.452 1.00 . A A . 9 ASN N 1 1
7 1650 1 1 9 ASN ND2 N -2.375 -2.844 0.664 1.00 . A A . 9 ASN ND2 1 1
7 1651 1 1 9 ASN O O 1.195 -0.773 1.240 1.00 . A A . 9 ASN O 1 1
7 1652 1 1 9 ASN OD1 O -0.218 -3.222 0.308 1.00 . A A . 9 ASN OD1 1 1
7 1653 1 1 10 VAL C C 3.224 1.730 1.604 1.00 . A A . 10 VAL C 1 1
7 1654 1 1 10 VAL CA C 1.960 1.692 2.519 1.00 . A A . 10 VAL CA 1 1
7 1655 1 1 10 VAL CB C 2.049 1.043 3.951 1.00 . A A . 10 VAL CB 1 1
7 1656 1 1 10 VAL CG1 C 2.334 -0.472 4.040 1.00 . A A . 10 VAL CG1 1 1
7 1657 1 1 10 VAL CG2 C 3.043 1.801 4.862 1.00 . A A . 10 VAL CG2 1 1
7 1658 1 1 10 VAL H H 0.037 2.112 1.656 1.00 . A A . 10 VAL H 1 1
7 1659 1 1 10 VAL HA H 1.819 2.746 2.756 1.00 . A A . 10 VAL HA 1 1
7 1660 1 1 10 VAL HB H 1.067 1.186 4.401 1.00 . A A . 10 VAL HB 1 1
7 1661 1 1 10 VAL HG11 H 1.636 -1.012 3.400 1.00 . A A . 10 VAL HG11 1 1
7 1662 1 1 10 VAL HG12 H 2.212 -0.804 5.071 1.00 . A A . 10 VAL HG12 1 1
7 1663 1 1 10 VAL HG13 H 3.355 -0.670 3.713 1.00 . A A . 10 VAL HG13 1 1
7 1664 1 1 10 VAL HG21 H 2.847 2.872 4.803 1.00 . A A . 10 VAL HG21 1 1
7 1665 1 1 10 VAL HG22 H 2.920 1.465 5.892 1.00 . A A . 10 VAL HG22 1 1
7 1666 1 1 10 VAL HG23 H 4.063 1.600 4.534 1.00 . A A . 10 VAL HG23 1 1
7 1667 1 1 10 VAL N N 0.730 1.382 1.738 1.00 . A A . 10 VAL N 1 1
7 1668 1 1 10 VAL O O 4.258 1.131 1.891 1.00 . A A . 10 VAL O 1 1
7 1669 1 1 11 HIS C C 4.504 1.440 -1.286 1.00 . A A . 11 HIS C 1 1
7 1670 1 1 11 HIS CA C 4.180 2.751 -0.506 1.00 . A A . 11 HIS CA 1 1
7 1671 1 1 11 HIS CB C 5.440 3.498 0.073 1.00 . A A . 11 HIS CB 1 1
7 1672 1 1 11 HIS CD2 C 6.324 5.733 0.987 1.00 . A A . 11 HIS CD2 1 1
7 1673 1 1 11 HIS CE1 C 4.685 6.995 0.618 1.00 . A A . 11 HIS CE1 1 1
7 1674 1 1 11 HIS CG C 5.283 4.987 0.411 1.00 . A A . 11 HIS CG 1 1
7 1675 1 1 11 HIS H H 2.246 3.051 0.415 1.00 . A A . 11 HIS H 1 1
7 1676 1 1 11 HIS HA H 3.748 3.431 -1.241 1.00 . A A . 11 HIS HA 1 1
7 1677 1 1 11 HIS HB2 H 5.733 2.984 0.988 1.00 . A A . 11 HIS HB2 1 1
7 1678 1 1 11 HIS HB3 H 6.252 3.399 -0.647 1.00 . A A . 11 HIS HB3 1 1
7 1679 1 1 11 HIS HD2 H 7.285 5.330 1.271 1.00 . A A . 11 HIS HD2 1 1
7 1680 1 1 11 HIS HE1 H 4.079 7.888 0.575 1.00 . A A . 11 HIS HE1 1 1
7 1681 1 1 11 HIS HE2 H 6.460 7.836 1.522 1.00 . A A . 11 HIS HE2 1 1
7 1682 1 1 11 HIS N N 3.112 2.544 0.529 1.00 . A A . 11 HIS N 1 1
7 1683 1 1 11 HIS ND1 N 4.184 5.804 0.149 1.00 . A A . 11 HIS ND1 1 1
7 1684 1 1 11 HIS NE2 N 5.949 7.054 1.138 1.00 . A A . 11 HIS NE2 1 1
7 1685 1 1 11 HIS O O 5.670 1.145 -1.544 1.00 . A A . 11 HIS O 1 1
7 1686 1 1 12 ASN C C 4.000 -1.697 -1.514 1.00 . A A . 12 ASN C 1 1
7 1687 1 1 12 ASN CA C 3.582 -0.567 -2.507 1.00 . A A . 12 ASN CA 1 1
7 1688 1 1 12 ASN CB C 4.407 -0.521 -3.839 1.00 . A A . 12 ASN CB 1 1
7 1689 1 1 12 ASN CG C 3.903 0.470 -4.907 1.00 . A A . 12 ASN CG 1 1
7 1690 1 1 12 ASN H H 2.535 1.073 -1.598 1.00 . A A . 12 ASN H 1 1
7 1691 1 1 12 ASN HA H 2.565 -0.815 -2.809 1.00 . A A . 12 ASN HA 1 1
7 1692 1 1 12 ASN HB2 H 5.432 -0.250 -3.589 1.00 . A A . 12 ASN HB2 1 1
7 1693 1 1 12 ASN HB3 H 4.412 -1.521 -4.274 1.00 . A A . 12 ASN HB3 1 1
7 1694 1 1 12 ASN HD21 H 2.492 -0.819 -5.585 1.00 . A A . 12 ASN HD21 1 1
7 1695 1 1 12 ASN HD22 H 2.559 0.726 -6.403 1.00 . A A . 12 ASN HD22 1 1
7 1696 1 1 12 ASN N N 3.465 0.715 -1.762 1.00 . A A . 12 ASN N 1 1
7 1697 1 1 12 ASN ND2 N 2.906 0.096 -5.694 1.00 . A A . 12 ASN ND2 1 1
7 1698 1 1 12 ASN O O 4.894 -2.493 -1.824 1.00 . A A . 12 ASN O 1 1
7 1699 1 1 12 ASN OD1 O 4.417 1.582 -5.034 1.00 . A A . 12 ASN OD1 1 1
7 1700 1 1 13 SER C C 5.063 -2.636 1.200 1.00 . A A . 13 SER C 1 1
7 1701 1 1 13 SER CA C 3.612 -2.801 0.733 1.00 . A A . 13 SER CA 1 1
7 1702 1 1 13 SER CB C 3.127 -4.192 0.279 1.00 . A A . 13 SER CB 1 1
7 1703 1 1 13 SER H H 2.582 -1.121 -0.153 1.00 . A A . 13 SER H 1 1
7 1704 1 1 13 SER HA H 2.990 -2.531 1.586 1.00 . A A . 13 SER HA 1 1
7 1705 1 1 13 SER HB2 H 2.054 -4.149 0.092 1.00 . A A . 13 SER HB2 1 1
7 1706 1 1 13 SER HB3 H 3.639 -4.465 -0.643 1.00 . A A . 13 SER HB3 1 1
7 1707 1 1 13 SER HG H 3.070 -6.036 0.950 1.00 . A A . 13 SER HG 1 1
7 1708 1 1 13 SER N N 3.323 -1.785 -0.325 1.00 . A A . 13 SER N 1 1
7 1709 1 1 13 SER O O 5.900 -3.494 0.934 1.00 . A A . 13 SER O 1 1
7 1710 1 1 13 SER OG O 3.383 -5.184 1.264 1.00 . A A . 13 SER OG 1 1
7 1711 1 1 14 SER C C 7.708 -1.151 1.223 1.00 . A A . 14 SER C 1 1
7 1712 1 1 14 SER CA C 6.690 -1.137 2.408 1.00 . A A . 14 SER CA 1 1
7 1713 1 1 14 SER CB C 7.027 -2.030 3.637 1.00 . A A . 14 SER CB 1 1
7 1714 1 1 14 SER H H 4.579 -0.861 2.074 1.00 . A A . 14 SER H 1 1
7 1715 1 1 14 SER HA H 6.630 -0.109 2.766 1.00 . A A . 14 SER HA 1 1
7 1716 1 1 14 SER HB2 H 6.214 -1.962 4.359 1.00 . A A . 14 SER HB2 1 1
7 1717 1 1 14 SER HB3 H 7.131 -3.065 3.310 1.00 . A A . 14 SER HB3 1 1
7 1718 1 1 14 SER HG H 8.421 -2.179 5.012 1.00 . A A . 14 SER HG 1 1
7 1719 1 1 14 SER N N 5.339 -1.501 1.894 1.00 . A A . 14 SER N 1 1
7 1720 1 1 14 SER O O 8.842 -1.591 1.433 1.00 . A A . 14 SER O 1 1
7 1721 1 1 14 SER OG O 8.237 -1.613 4.259 1.00 . A A . 14 SER OG 1 1
7 1722 1 1 15 SER C C 8.484 -2.133 -1.761 1.00 . A A . 15 SER C 1 1
7 1723 1 1 15 SER CA C 8.244 -0.667 -1.213 1.00 . A A . 15 SER CA 1 1
7 1724 1 1 15 SER CB C 9.608 0.034 -0.939 1.00 . A A . 15 SER CB 1 1
7 1725 1 1 15 SER H H 6.396 -0.260 -0.107 1.00 . A A . 15 SER H 1 1
7 1726 1 1 15 SER HA H 7.748 -0.105 -2.004 1.00 . A A . 15 SER HA 1 1
7 1727 1 1 15 SER HB2 H 9.436 0.938 -0.354 1.00 . A A . 15 SER HB2 1 1
7 1728 1 1 15 SER HB3 H 10.248 -0.642 -0.372 1.00 . A A . 15 SER HB3 1 1
7 1729 1 1 15 SER HG H 11.096 0.810 -1.961 1.00 . A A . 15 SER HG 1 1
7 1730 1 1 15 SER N N 7.322 -0.650 -0.008 1.00 . A A . 15 SER N 1 1
7 1731 1 1 15 SER O O 8.937 -2.270 -2.901 1.00 . A A . 15 SER O 1 1
7 1732 1 1 15 SER OG O 10.260 0.381 -2.156 1.00 . A A . 15 SER OG 1 1
7 1733 1 1 16 SER C C 7.918 -5.624 -0.208 1.00 . A A . 16 SER C 1 1
7 1734 1 1 16 SER CA C 8.352 -4.634 -1.341 1.00 . A A . 16 SER CA 1 1
7 1735 1 1 16 SER CB C 9.866 -4.931 -1.547 1.00 . A A . 16 SER CB 1 1
7 1736 1 1 16 SER H H 7.774 -3.008 -0.072 1.00 . A A . 16 SER H 1 1
7 1737 1 1 16 SER HA H 7.803 -4.858 -2.257 1.00 . A A . 16 SER HA 1 1
7 1738 1 1 16 SER HB2 H 10.343 -4.053 -1.983 1.00 . A A . 16 SER HB2 1 1
7 1739 1 1 16 SER HB3 H 10.323 -5.144 -0.581 1.00 . A A . 16 SER HB3 1 1
7 1740 1 1 16 SER HG H 11.003 -6.201 -2.521 1.00 . A A . 16 SER HG 1 1
7 1741 1 1 16 SER N N 8.169 -3.204 -0.980 1.00 . A A . 16 SER N 1 1
7 1742 1 1 16 SER O O 7.396 -6.699 -0.515 1.00 . A A . 16 SER O 1 1
7 1743 1 1 16 SER OG O 10.062 -6.042 -2.413 1.00 . A A . 16 SER OG 1 1
7 1744 1 1 17 LEU C C 6.327 -6.099 2.646 1.00 . A A . 17 LEU C 1 1
7 1745 1 1 17 LEU CA C 7.827 -6.139 2.246 1.00 . A A . 17 LEU CA 1 1
7 1746 1 1 17 LEU CB C 8.742 -5.803 3.463 1.00 . A A . 17 LEU CB 1 1
7 1747 1 1 17 LEU CD1 C 11.063 -5.424 4.472 1.00 . A A . 17 LEU CD1 1 1
7 1748 1 1 17 LEU CD2 C 10.657 -7.530 3.151 1.00 . A A . 17 LEU CD2 1 1
7 1749 1 1 17 LEU CG C 10.279 -6.040 3.296 1.00 . A A . 17 LEU CG 1 1
7 1750 1 1 17 LEU H H 8.616 -4.382 1.256 1.00 . A A . 17 LEU H 1 1
7 1751 1 1 17 LEU HXT H 4.607 -7.018 2.597 1.00 . A A . 17 LEU HXT 1 1
7 1752 1 1 17 LEU HA H 8.051 -7.166 1.955 1.00 . A A . 17 LEU HA 1 1
7 1753 1 1 17 LEU HB2 H 8.597 -4.749 3.700 1.00 . A A . 17 LEU HB2 1 1
7 1754 1 1 17 LEU HB3 H 8.400 -6.391 4.315 1.00 . A A . 17 LEU HB3 1 1
7 1755 1 1 17 LEU HD11 H 10.797 -4.372 4.575 1.00 . A A . 17 LEU HD11 1 1
7 1756 1 1 17 LEU HD12 H 10.812 -5.954 5.391 1.00 . A A . 17 LEU HD12 1 1
7 1757 1 1 17 LEU HD13 H 12.132 -5.513 4.281 1.00 . A A . 17 LEU HD13 1 1
7 1758 1 1 17 LEU HD21 H 10.103 -7.967 2.320 1.00 . A A . 17 LEU HD21 1 1
7 1759 1 1 17 LEU HD22 H 10.406 -8.059 4.071 1.00 . A A . 17 LEU HD22 1 1
7 1760 1 1 17 LEU HD23 H 11.726 -7.618 2.962 1.00 . A A . 17 LEU HD23 1 1
7 1761 1 1 17 LEU HG H 10.595 -5.530 2.386 1.00 . A A . 17 LEU HG 1 1
7 1762 1 1 17 LEU N N 8.173 -5.272 1.079 1.00 . A A . 17 LEU N 1 1
7 1763 1 1 17 LEU O O 5.834 -5.157 3.268 1.00 . A A . 17 LEU O 1 1
7 1764 1 1 17 LEU OXT O 5.501 -7.179 2.286 1.00 . A A . 17 LEU OXT 1 1
8 1765 1 1 1 ASN C C -6.783 5.982 -7.309 1.00 . A A . 1 ASN C 1 1
8 1766 1 1 1 ASN CA C -7.112 7.065 -8.375 1.00 . A A . 1 ASN CA 1 1
8 1767 1 1 1 ASN CB C -8.319 6.652 -9.276 1.00 . A A . 1 ASN CB 1 1
8 1768 1 1 1 ASN CG C -8.976 7.811 -10.053 1.00 . A A . 1 ASN CG 1 1
8 1769 1 1 1 ASN H1 H -5.163 7.711 -8.600 1.00 . A A . 1 ASN H1 1 1
8 1770 1 1 1 ASN H2 H -5.650 6.666 -9.778 1.00 . A A . 1 ASN H2 1 1
8 1771 1 1 1 ASN H3 H -6.171 8.230 -9.797 1.00 . A A . 1 ASN H3 1 1
8 1772 1 1 1 ASN HA H -7.417 7.959 -7.831 1.00 . A A . 1 ASN HA 1 1
8 1773 1 1 1 ASN HB2 H -7.977 5.905 -9.992 1.00 . A A . 1 ASN HB2 1 1
8 1774 1 1 1 ASN HB3 H -9.077 6.199 -8.638 1.00 . A A . 1 ASN HB3 1 1
8 1775 1 1 1 ASN HD21 H -8.144 7.230 -11.809 1.00 . A A . 1 ASN HD21 1 1
8 1776 1 1 1 ASN HD22 H -9.158 8.653 -11.889 1.00 . A A . 1 ASN HD22 1 1
8 1777 1 1 1 ASN N N -5.928 7.449 -9.205 1.00 . A A . 1 ASN N 1 1
8 1778 1 1 1 ASN ND2 N -8.741 7.906 -11.353 1.00 . A A . 1 ASN ND2 1 1
8 1779 1 1 1 ASN O O -7.028 6.204 -6.120 1.00 . A A . 1 ASN O 1 1
8 1780 1 1 1 ASN OD1 O -9.702 8.628 -9.487 1.00 . A A . 1 ASN OD1 1 1
8 1781 1 1 2 VAL C C -4.612 4.132 -5.893 1.00 . A A . 2 VAL C 1 1
8 1782 1 1 2 VAL CA C -5.807 3.722 -6.827 1.00 . A A . 2 VAL CA 1 1
8 1783 1 1 2 VAL CB C -5.498 2.393 -7.581 1.00 . A A . 2 VAL CB 1 1
8 1784 1 1 2 VAL CG1 C -5.375 1.156 -6.658 1.00 . A A . 2 VAL CG1 1 1
8 1785 1 1 2 VAL CG2 C -6.452 2.008 -8.744 1.00 . A A . 2 VAL CG2 1 1
8 1786 1 1 2 VAL H H -6.078 4.713 -8.729 1.00 . A A . 2 VAL H 1 1
8 1787 1 1 2 VAL HA H -6.656 3.519 -6.175 1.00 . A A . 2 VAL HA 1 1
8 1788 1 1 2 VAL HB H -4.516 2.528 -8.033 1.00 . A A . 2 VAL HB 1 1
8 1789 1 1 2 VAL HG11 H -4.711 1.388 -5.826 1.00 . A A . 2 VAL HG11 1 1
8 1790 1 1 2 VAL HG12 H -4.968 0.319 -7.225 1.00 . A A . 2 VAL HG12 1 1
8 1791 1 1 2 VAL HG13 H -6.360 0.889 -6.274 1.00 . A A . 2 VAL HG13 1 1
8 1792 1 1 2 VAL HG21 H -6.565 2.856 -9.418 1.00 . A A . 2 VAL HG21 1 1
8 1793 1 1 2 VAL HG22 H -6.034 1.162 -9.291 1.00 . A A . 2 VAL HG22 1 1
8 1794 1 1 2 VAL HG23 H -7.426 1.733 -8.339 1.00 . A A . 2 VAL HG23 1 1
8 1795 1 1 2 VAL N N -6.224 4.831 -7.737 1.00 . A A . 2 VAL N 1 1
8 1796 1 1 2 VAL O O -4.529 3.629 -4.771 1.00 . A A . 2 VAL O 1 1
8 1797 1 1 3 HIS C C -3.044 6.232 -4.253 1.00 . A A . 3 HIS C 1 1
8 1798 1 1 3 HIS CA C -2.522 5.487 -5.529 1.00 . A A . 3 HIS CA 1 1
8 1799 1 1 3 HIS CB C -1.576 6.332 -6.426 1.00 . A A . 3 HIS CB 1 1
8 1800 1 1 3 HIS CD2 C 0.956 5.746 -6.281 1.00 . A A . 3 HIS CD2 1 1
8 1801 1 1 3 HIS CE1 C 1.501 7.020 -4.700 1.00 . A A . 3 HIS CE1 1 1
8 1802 1 1 3 HIS CG C -0.171 6.464 -5.843 1.00 . A A . 3 HIS CG 1 1
8 1803 1 1 3 HIS H H -3.726 5.295 -7.314 1.00 . A A . 3 HIS H 1 1
8 1804 1 1 3 HIS HA H -1.958 4.619 -5.190 1.00 . A A . 3 HIS HA 1 1
8 1805 1 1 3 HIS HB2 H -1.504 5.854 -7.403 1.00 . A A . 3 HIS HB2 1 1
8 1806 1 1 3 HIS HB3 H -2.002 7.327 -6.550 1.00 . A A . 3 HIS HB3 1 1
8 1807 1 1 3 HIS HD2 H 0.953 5.022 -7.083 1.00 . A A . 3 HIS HD2 1 1
8 1808 1 1 3 HIS HE1 H 2.110 7.513 -3.956 1.00 . A A . 3 HIS HE1 1 1
8 1809 1 1 3 HIS HE2 H 3.019 5.772 -5.601 1.00 . A A . 3 HIS HE2 1 1
8 1810 1 1 3 HIS N N -3.660 4.984 -6.355 1.00 . A A . 3 HIS N 1 1
8 1811 1 1 3 HIS ND1 N 0.164 7.321 -4.800 1.00 . A A . 3 HIS ND1 1 1
8 1812 1 1 3 HIS NE2 N 2.065 6.099 -5.541 1.00 . A A . 3 HIS NE2 1 1
8 1813 1 1 3 HIS O O -2.488 6.062 -3.166 1.00 . A A . 3 HIS O 1 1
8 1814 1 1 4 THR C C -6.046 6.960 -2.842 1.00 . A A . 4 THR C 1 1
8 1815 1 1 4 THR CA C -4.779 7.769 -3.324 1.00 . A A . 4 THR CA 1 1
8 1816 1 1 4 THR CB C -5.104 9.212 -3.808 1.00 . A A . 4 THR CB 1 1
8 1817 1 1 4 THR CG2 C -3.882 10.098 -4.107 1.00 . A A . 4 THR CG2 1 1
8 1818 1 1 4 THR H H -4.468 7.165 -5.341 1.00 . A A . 4 THR H 1 1
8 1819 1 1 4 THR HA H -4.086 7.842 -2.485 1.00 . A A . 4 THR HA 1 1
8 1820 1 1 4 THR HB H -5.658 9.698 -3.004 1.00 . A A . 4 THR HB 1 1
8 1821 1 1 4 THR HG1 H -5.481 8.849 -5.704 1.00 . A A . 4 THR HG1 1 1
8 1822 1 1 4 THR HG21 H -4.218 11.081 -4.437 1.00 . A A . 4 THR HG21 1 1
8 1823 1 1 4 THR HG22 H -3.283 9.637 -4.893 1.00 . A A . 4 THR HG22 1 1
8 1824 1 1 4 THR HG23 H -3.280 10.204 -3.205 1.00 . A A . 4 THR HG23 1 1
8 1825 1 1 4 THR N N -4.106 7.045 -4.406 1.00 . A A . 4 THR N 1 1
8 1826 1 1 4 THR O O -7.027 7.562 -2.394 1.00 . A A . 4 THR O 1 1
8 1827 1 1 4 THR OG1 O -5.959 9.200 -4.950 1.00 . A A . 4 THR OG1 1 1
8 1828 1 1 5 PHE C C -7.086 4.727 -0.884 1.00 . A A . 5 PHE C 1 1
8 1829 1 1 5 PHE CA C -7.109 4.711 -2.432 1.00 . A A . 5 PHE CA 1 1
8 1830 1 1 5 PHE CB C -7.061 3.299 -3.092 1.00 . A A . 5 PHE CB 1 1
8 1831 1 1 5 PHE CD1 C -7.799 0.956 -2.432 1.00 . A A . 5 PHE CD1 1 1
8 1832 1 1 5 PHE CD2 C -9.516 2.631 -2.709 1.00 . A A . 5 PHE CD2 1 1
8 1833 1 1 5 PHE CE1 C -8.777 0.006 -2.140 1.00 . A A . 5 PHE CE1 1 1
8 1834 1 1 5 PHE CE2 C -10.491 1.681 -2.407 1.00 . A A . 5 PHE CE2 1 1
8 1835 1 1 5 PHE CG C -8.161 2.279 -2.718 1.00 . A A . 5 PHE CG 1 1
8 1836 1 1 5 PHE CZ C -10.120 0.369 -2.128 1.00 . A A . 5 PHE CZ 1 1
8 1837 1 1 5 PHE H H -5.190 5.162 -3.273 1.00 . A A . 5 PHE H 1 1
8 1838 1 1 5 PHE HA H -8.046 5.174 -2.740 1.00 . A A . 5 PHE HA 1 1
8 1839 1 1 5 PHE HB2 H -7.111 3.445 -4.171 1.00 . A A . 5 PHE HB2 1 1
8 1840 1 1 5 PHE HB3 H -6.095 2.852 -2.859 1.00 . A A . 5 PHE HB3 1 1
8 1841 1 1 5 PHE HD1 H -6.758 0.670 -2.437 1.00 . A A . 5 PHE HD1 1 1
8 1842 1 1 5 PHE HD2 H -9.808 3.645 -2.938 1.00 . A A . 5 PHE HD2 1 1
8 1843 1 1 5 PHE HE1 H -8.491 -1.013 -1.924 1.00 . A A . 5 PHE HE1 1 1
8 1844 1 1 5 PHE HE2 H -11.533 1.964 -2.389 1.00 . A A . 5 PHE HE2 1 1
8 1845 1 1 5 PHE HZ H -10.876 -0.368 -1.901 1.00 . A A . 5 PHE HZ 1 1
8 1846 1 1 5 PHE N N -6.018 5.598 -2.892 1.00 . A A . 5 PHE N 1 1
8 1847 1 1 5 PHE O O -7.946 5.335 -0.240 1.00 . A A . 5 PHE O 1 1
8 1848 1 1 6 ARG C C -4.277 4.105 1.389 1.00 . A A . 6 ARG C 1 1
8 1849 1 1 6 ARG CA C -5.799 3.945 1.118 1.00 . A A . 6 ARG CA 1 1
8 1850 1 1 6 ARG CB C -6.305 2.576 1.624 1.00 . A A . 6 ARG CB 1 1
8 1851 1 1 6 ARG CD C -8.284 0.921 1.501 1.00 . A A . 6 ARG CD 1 1
8 1852 1 1 6 ARG CG C -7.822 2.370 1.374 1.00 . A A . 6 ARG CG 1 1
8 1853 1 1 6 ARG CZ C -10.447 -0.342 1.455 1.00 . A A . 6 ARG CZ 1 1
8 1854 1 1 6 ARG H H -5.447 3.556 -0.957 1.00 . A A . 6 ARG H 1 1
8 1855 1 1 6 ARG HA H -6.338 4.737 1.637 1.00 . A A . 6 ARG HA 1 1
8 1856 1 1 6 ARG HB2 H -5.756 1.789 1.107 1.00 . A A . 6 ARG HB2 1 1
8 1857 1 1 6 ARG HB3 H -6.110 2.500 2.693 1.00 . A A . 6 ARG HB3 1 1
8 1858 1 1 6 ARG HD2 H -7.896 0.351 0.657 1.00 . A A . 6 ARG HD2 1 1
8 1859 1 1 6 ARG HD3 H -7.889 0.501 2.426 1.00 . A A . 6 ARG HD3 1 1
8 1860 1 1 6 ARG HE H -10.293 1.675 1.568 1.00 . A A . 6 ARG HE 1 1
8 1861 1 1 6 ARG HG2 H -8.373 2.970 2.098 1.00 . A A . 6 ARG HG2 1 1
8 1862 1 1 6 ARG HG3 H -8.062 2.726 0.372 1.00 . A A . 6 ARG HG3 1 1
8 1863 1 1 6 ARG HH11 H -12.232 0.611 1.513 1.00 . A A . 6 ARG HH11 1 1
8 1864 1 1 6 ARG HH12 H -12.309 -1.134 1.419 1.00 . A A . 6 ARG HH12 1 1
8 1865 1 1 6 ARG HH21 H -8.867 -1.622 1.375 1.00 . A A . 6 ARG HH21 1 1
8 1866 1 1 6 ARG HH22 H -10.447 -2.373 1.343 1.00 . A A . 6 ARG HH22 1 1
8 1867 1 1 6 ARG N N -6.073 4.043 -0.332 1.00 . A A . 6 ARG N 1 1
8 1868 1 1 6 ARG NE N -9.762 0.817 1.513 1.00 . A A . 6 ARG NE 1 1
8 1869 1 1 6 ARG NH1 N -11.766 -0.283 1.463 1.00 . A A . 6 ARG NH1 1 1
8 1870 1 1 6 ARG NH2 N -9.874 -1.542 1.385 1.00 . A A . 6 ARG NH2 1 1
8 1871 1 1 6 ARG O O -3.683 3.393 2.204 1.00 . A A . 6 ARG O 1 1
8 1872 1 1 7 GLY C C -1.314 4.469 0.018 1.00 . A A . 7 GLY C 1 1
8 1873 1 1 7 GLY CA C -2.253 5.424 0.800 1.00 . A A . 7 GLY CA 1 1
8 1874 1 1 7 GLY H H -4.274 5.661 0.098 1.00 . A A . 7 GLY H 1 1
8 1875 1 1 7 GLY HA2 H -2.108 6.432 0.412 1.00 . A A . 7 GLY HA2 1 1
8 1876 1 1 7 GLY HA3 H -1.962 5.412 1.850 1.00 . A A . 7 GLY HA3 1 1
8 1877 1 1 7 GLY N N -3.696 5.100 0.708 1.00 . A A . 7 GLY N 1 1
8 1878 1 1 7 GLY O O -0.168 4.287 0.432 1.00 . A A . 7 GLY O 1 1
8 1879 1 1 8 ASP C C -0.512 1.656 -1.236 1.00 . A A . 8 ASP C 1 1
8 1880 1 1 8 ASP CA C -1.017 2.942 -1.967 1.00 . A A . 8 ASP CA 1 1
8 1881 1 1 8 ASP CB C 0.072 3.712 -2.779 1.00 . A A . 8 ASP CB 1 1
8 1882 1 1 8 ASP CG C 0.584 2.999 -4.041 1.00 . A A . 8 ASP CG 1 1
8 1883 1 1 8 ASP H H -2.736 4.112 -1.389 1.00 . A A . 8 ASP H 1 1
8 1884 1 1 8 ASP HA H -1.728 2.585 -2.711 1.00 . A A . 8 ASP HA 1 1
8 1885 1 1 8 ASP HB2 H -0.337 4.680 -3.071 1.00 . A A . 8 ASP HB2 1 1
8 1886 1 1 8 ASP HB3 H 0.924 3.883 -2.121 1.00 . A A . 8 ASP HB3 1 1
8 1887 1 1 8 ASP N N -1.792 3.889 -1.109 1.00 . A A . 8 ASP N 1 1
8 1888 1 1 8 ASP O O 0.547 1.127 -1.569 1.00 . A A . 8 ASP O 1 1
8 1889 1 1 8 ASP OD1 O -0.155 2.586 -4.935 1.00 . A A . 8 ASP OD1 1 1
8 1890 1 1 8 ASP OD2 O 1.950 2.899 -4.063 1.00 . A A . 8 ASP OD2 1 1
8 1891 1 1 9 ASN C C 0.365 0.012 1.324 1.00 . A A . 9 ASN C 1 1
8 1892 1 1 9 ASN CA C -0.944 -0.119 0.490 1.00 . A A . 9 ASN CA 1 1
8 1893 1 1 9 ASN CB C -1.112 -1.373 -0.412 1.00 . A A . 9 ASN CB 1 1
8 1894 1 1 9 ASN CG C -1.181 -2.727 0.317 1.00 . A A . 9 ASN CG 1 1
8 1895 1 1 9 ASN H H -2.194 1.534 -0.106 1.00 . A A . 9 ASN H 1 1
8 1896 1 1 9 ASN HA H -1.736 -0.209 1.234 1.00 . A A . 9 ASN HA 1 1
8 1897 1 1 9 ASN HB2 H -2.034 -1.254 -0.981 1.00 . A A . 9 ASN HB2 1 1
8 1898 1 1 9 ASN HB3 H -0.279 -1.404 -1.114 1.00 . A A . 9 ASN HB3 1 1
8 1899 1 1 9 ASN HD21 H -3.174 -2.541 0.643 1.00 . A A . 9 ASN HD21 1 1
8 1900 1 1 9 ASN HD22 H -2.443 -4.007 1.256 1.00 . A A . 9 ASN HD22 1 1
8 1901 1 1 9 ASN N N -1.303 1.098 -0.293 1.00 . A A . 9 ASN N 1 1
8 1902 1 1 9 ASN ND2 N -2.360 -3.123 0.775 1.00 . A A . 9 ASN ND2 1 1
8 1903 1 1 9 ASN O O 1.170 -0.910 1.389 1.00 . A A . 9 ASN O 1 1
8 1904 1 1 9 ASN OD1 O -0.181 -3.428 0.469 1.00 . A A . 9 ASN OD1 1 1
8 1905 1 1 10 VAL C C 2.953 1.789 2.053 1.00 . A A . 10 VAL C 1 1
8 1906 1 1 10 VAL CA C 1.659 1.521 2.876 1.00 . A A . 10 VAL CA 1 1
8 1907 1 1 10 VAL CB C 1.759 0.763 4.253 1.00 . A A . 10 VAL CB 1 1
8 1908 1 1 10 VAL CG1 C 2.252 -0.700 4.245 1.00 . A A . 10 VAL CG1 1 1
8 1909 1 1 10 VAL CG2 C 2.588 1.565 5.284 1.00 . A A . 10 VAL CG2 1 1
8 1910 1 1 10 VAL H H -0.251 1.829 1.947 1.00 . A A . 10 VAL H 1 1
8 1911 1 1 10 VAL HA H 1.389 2.527 3.196 1.00 . A A . 10 VAL HA 1 1
8 1912 1 1 10 VAL HB H 0.743 0.732 4.649 1.00 . A A . 10 VAL HB 1 1
8 1913 1 1 10 VAL HG11 H 1.674 -1.275 3.521 1.00 . A A . 10 VAL HG11 1 1
8 1914 1 1 10 VAL HG12 H 3.307 -0.726 3.970 1.00 . A A . 10 VAL HG12 1 1
8 1915 1 1 10 VAL HG13 H 2.125 -1.132 5.237 1.00 . A A . 10 VAL HG13 1 1
8 1916 1 1 10 VAL HG21 H 2.248 2.601 5.298 1.00 . A A . 10 VAL HG21 1 1
8 1917 1 1 10 VAL HG22 H 2.459 1.127 6.274 1.00 . A A . 10 VAL HG22 1 1
8 1918 1 1 10 VAL HG23 H 3.642 1.533 5.007 1.00 . A A . 10 VAL HG23 1 1
8 1919 1 1 10 VAL N N 0.500 1.157 2.016 1.00 . A A . 10 VAL N 1 1
8 1920 1 1 10 VAL O O 4.027 1.256 2.318 1.00 . A A . 10 VAL O 1 1
8 1921 1 1 11 HIS C C 4.353 2.035 -0.803 1.00 . A A . 11 HIS C 1 1
8 1922 1 1 11 HIS CA C 3.896 3.170 0.164 1.00 . A A . 11 HIS CA 1 1
8 1923 1 1 11 HIS CB C 5.048 3.896 0.935 1.00 . A A . 11 HIS CB 1 1
8 1924 1 1 11 HIS CD2 C 6.921 5.609 0.562 1.00 . A A . 11 HIS CD2 1 1
8 1925 1 1 11 HIS CE1 C 6.515 6.183 -1.418 1.00 . A A . 11 HIS CE1 1 1
8 1926 1 1 11 HIS CG C 5.812 4.899 0.085 1.00 . A A . 11 HIS CG 1 1
8 1927 1 1 11 HIS H H 1.902 3.168 1.001 1.00 . A A . 11 HIS H 1 1
8 1928 1 1 11 HIS HA H 3.445 3.931 -0.473 1.00 . A A . 11 HIS HA 1 1
8 1929 1 1 11 HIS HB2 H 4.614 4.424 1.784 1.00 . A A . 11 HIS HB2 1 1
8 1930 1 1 11 HIS HB3 H 5.747 3.147 1.307 1.00 . A A . 11 HIS HB3 1 1
8 1931 1 1 11 HIS HD2 H 7.339 5.506 1.553 1.00 . A A . 11 HIS HD2 1 1
8 1932 1 1 11 HIS HE1 H 6.601 6.692 -2.367 1.00 . A A . 11 HIS HE1 1 1
8 1933 1 1 11 HIS HE2 H 8.186 7.098 -0.390 1.00 . A A . 11 HIS HE2 1 1
8 1934 1 1 11 HIS N N 2.807 2.730 1.095 1.00 . A A . 11 HIS N 1 1
8 1935 1 1 11 HIS ND1 N 5.512 5.261 -1.223 1.00 . A A . 11 HIS ND1 1 1
8 1936 1 1 11 HIS NE2 N 7.404 6.458 -0.412 1.00 . A A . 11 HIS NE2 1 1
8 1937 1 1 11 HIS O O 5.549 1.854 -1.025 1.00 . A A . 11 HIS O 1 1
8 1938 1 1 12 ASN C C 4.053 -1.035 -1.601 1.00 . A A . 12 ASN C 1 1
8 1939 1 1 12 ASN CA C 3.630 0.231 -2.405 1.00 . A A . 12 ASN CA 1 1
8 1940 1 1 12 ASN CB C 4.517 0.616 -3.633 1.00 . A A . 12 ASN CB 1 1
8 1941 1 1 12 ASN CG C 4.311 -0.304 -4.848 1.00 . A A . 12 ASN CG 1 1
8 1942 1 1 12 ASN H H 2.433 1.627 -1.304 1.00 . A A . 12 ASN H 1 1
8 1943 1 1 12 ASN HA H 2.651 -0.007 -2.822 1.00 . A A . 12 ASN HA 1 1
8 1944 1 1 12 ASN HB2 H 4.275 1.637 -3.928 1.00 . A A . 12 ASN HB2 1 1
8 1945 1 1 12 ASN HB3 H 5.565 0.575 -3.336 1.00 . A A . 12 ASN HB3 1 1
8 1946 1 1 12 ASN HD21 H 2.566 0.613 -5.328 1.00 . A A . 12 ASN HD21 1 1
8 1947 1 1 12 ASN HD22 H 3.036 -0.709 -6.373 1.00 . A A . 12 ASN HD22 1 1
8 1948 1 1 12 ASN N N 3.392 1.352 -1.464 1.00 . A A . 12 ASN N 1 1
8 1949 1 1 12 ASN ND2 N 3.218 -0.119 -5.574 1.00 . A A . 12 ASN ND2 1 1
8 1950 1 1 12 ASN O O 5.034 -1.690 -1.970 1.00 . A A . 12 ASN O 1 1
8 1951 1 1 12 ASN OD1 O 5.109 -1.200 -5.122 1.00 . A A . 12 ASN OD1 1 1
8 1952 1 1 13 SER C C 4.990 -2.375 0.977 1.00 . A A . 13 SER C 1 1
8 1953 1 1 13 SER CA C 3.600 -2.577 0.350 1.00 . A A . 13 SER CA 1 1
8 1954 1 1 13 SER CB C 3.311 -3.947 -0.348 1.00 . A A . 13 SER CB 1 1
8 1955 1 1 13 SER H H 2.492 -0.822 -0.286 1.00 . A A . 13 SER H 1 1
8 1956 1 1 13 SER HA H 2.896 -2.519 1.180 1.00 . A A . 13 SER HA 1 1
8 1957 1 1 13 SER HB2 H 3.244 -4.720 0.418 1.00 . A A . 13 SER HB2 1 1
8 1958 1 1 13 SER HB3 H 2.356 -3.883 -0.869 1.00 . A A . 13 SER HB3 1 1
8 1959 1 1 13 SER HG H 4.383 -5.273 -1.325 1.00 . A A . 13 SER HG 1 1
8 1960 1 1 13 SER N N 3.296 -1.389 -0.516 1.00 . A A . 13 SER N 1 1
8 1961 1 1 13 SER O O 5.920 -3.098 0.639 1.00 . A A . 13 SER O 1 1
8 1962 1 1 13 SER OG O 4.322 -4.316 -1.280 1.00 . A A . 13 SER OG 1 1
8 1963 1 1 14 SER C C 7.522 -0.779 1.474 1.00 . A A . 14 SER C 1 1
8 1964 1 1 14 SER CA C 6.416 -1.022 2.552 1.00 . A A . 14 SER CA 1 1
8 1965 1 1 14 SER CB C 6.723 -2.092 3.638 1.00 . A A . 14 SER CB 1 1
8 1966 1 1 14 SER H H 4.313 -0.818 2.110 1.00 . A A . 14 SER H 1 1
8 1967 1 1 14 SER HA H 6.262 -0.076 3.070 1.00 . A A . 14 SER HA 1 1
8 1968 1 1 14 SER HB2 H 5.851 -2.205 4.283 1.00 . A A . 14 SER HB2 1 1
8 1969 1 1 14 SER HB3 H 6.935 -3.045 3.153 1.00 . A A . 14 SER HB3 1 1
8 1970 1 1 14 SER HG H 8.007 -2.391 5.092 1.00 . A A . 14 SER HG 1 1
8 1971 1 1 14 SER N N 5.130 -1.366 1.880 1.00 . A A . 14 SER N 1 1
8 1972 1 1 14 SER O O 8.669 -1.171 1.715 1.00 . A A . 14 SER O 1 1
8 1973 1 1 14 SER OG O 7.840 -1.715 4.432 1.00 . A A . 14 SER OG 1 1
8 1974 1 1 15 SER C C 8.633 -1.220 -1.529 1.00 . A A . 15 SER C 1 1
8 1975 1 1 15 SER CA C 8.210 0.121 -0.800 1.00 . A A . 15 SER CA 1 1
8 1976 1 1 15 SER CB C 9.471 0.882 -0.298 1.00 . A A . 15 SER CB 1 1
8 1977 1 1 15 SER H H 6.253 0.222 0.183 1.00 . A A . 15 SER H 1 1
8 1978 1 1 15 SER HA H 7.729 0.754 -1.547 1.00 . A A . 15 SER HA 1 1
8 1979 1 1 15 SER HB2 H 9.164 1.672 0.387 1.00 . A A . 15 SER HB2 1 1
8 1980 1 1 15 SER HB3 H 10.121 0.184 0.229 1.00 . A A . 15 SER HB3 1 1
8 1981 1 1 15 SER HG H 10.962 1.919 -1.048 1.00 . A A . 15 SER HG 1 1
8 1982 1 1 15 SER N N 7.196 -0.116 0.306 1.00 . A A . 15 SER N 1 1
8 1983 1 1 15 SER O O 9.230 -1.145 -2.607 1.00 . A A . 15 SER O 1 1
8 1984 1 1 15 SER OG O 10.191 1.457 -1.384 1.00 . A A . 15 SER OG 1 1
8 1985 1 1 16 SER C C 8.130 -4.939 -0.656 1.00 . A A . 16 SER C 1 1
8 1986 1 1 16 SER CA C 8.668 -3.754 -1.521 1.00 . A A . 16 SER CA 1 1
8 1987 1 1 16 SER CB C 10.214 -3.937 -1.544 1.00 . A A . 16 SER CB 1 1
8 1988 1 1 16 SER H H 7.811 -2.401 -0.096 1.00 . A A . 16 SER H 1 1
8 1989 1 1 16 SER HA H 8.277 -3.838 -2.535 1.00 . A A . 16 SER HA 1 1
8 1990 1 1 16 SER HB2 H 10.684 -2.973 -1.741 1.00 . A A . 16 SER HB2 1 1
8 1991 1 1 16 SER HB3 H 10.546 -4.306 -0.574 1.00 . A A . 16 SER HB3 1 1
8 1992 1 1 16 SER HG H 11.562 -4.955 -2.547 1.00 . A A . 16 SER HG 1 1
8 1993 1 1 16 SER N N 8.322 -2.419 -0.967 1.00 . A A . 16 SER N 1 1
8 1994 1 1 16 SER O O 7.692 -5.944 -1.223 1.00 . A A . 16 SER O 1 1
8 1995 1 1 16 SER OG O 10.606 -4.859 -2.554 1.00 . A A . 16 SER OG 1 1
8 1996 1 1 17 LEU C C 6.189 -5.876 1.873 1.00 . A A . 17 LEU C 1 1
8 1997 1 1 17 LEU CA C 7.723 -5.903 1.622 1.00 . A A . 17 LEU CA 1 1
8 1998 1 1 17 LEU CB C 8.520 -5.848 2.962 1.00 . A A . 17 LEU CB 1 1
8 1999 1 1 17 LEU CD1 C 10.738 -5.774 4.236 1.00 . A A . 17 LEU CD1 1 1
8 2000 1 1 17 LEU CD2 C 10.418 -7.557 2.486 1.00 . A A . 17 LEU CD2 1 1
8 2001 1 1 17 LEU CG C 10.062 -6.111 2.891 1.00 . A A . 17 LEU CG 1 1
8 2002 1 1 17 LEU H H 8.577 -3.984 1.095 1.00 . A A . 17 LEU H 1 1
8 2003 1 1 17 LEU HXT H 4.448 -6.602 1.376 1.00 . A A . 17 LEU HXT 1 1
8 2004 1 1 17 LEU HA H 7.955 -6.858 1.149 1.00 . A A . 17 LEU HA 1 1
8 2005 1 1 17 LEU HB2 H 8.376 -4.855 3.388 1.00 . A A . 17 LEU HB2 1 1
8 2006 1 1 17 LEU HB3 H 8.083 -6.577 3.646 1.00 . A A . 17 LEU HB3 1 1
8 2007 1 1 17 LEU HD11 H 10.487 -4.753 4.523 1.00 . A A . 17 LEU HD11 1 1
8 2008 1 1 17 LEU HD12 H 10.385 -6.464 5.002 1.00 . A A . 17 LEU HD12 1 1
8 2009 1 1 17 LEU HD13 H 11.819 -5.867 4.132 1.00 . A A . 17 LEU HD13 1 1
8 2010 1 1 17 LEU HD21 H 9.941 -7.796 1.536 1.00 . A A . 17 LEU HD21 1 1
8 2011 1 1 17 LEU HD22 H 10.066 -8.246 3.254 1.00 . A A . 17 LEU HD22 1 1
8 2012 1 1 17 LEU HD23 H 11.500 -7.650 2.384 1.00 . A A . 17 LEU HD23 1 1
8 2013 1 1 17 LEU HG H 10.477 -5.444 2.136 1.00 . A A . 17 LEU HG 1 1
8 2014 1 1 17 LEU N N 8.194 -4.829 0.697 1.00 . A A . 17 LEU N 1 1
8 2015 1 1 17 LEU O O 5.669 -5.137 2.710 1.00 . A A . 17 LEU O 1 1
8 2016 1 1 17 LEU OXT O 5.363 -6.727 1.114 1.00 . A A . 17 LEU OXT 1 1
9 2017 1 1 1 ASN C C -10.065 4.354 -4.243 1.00 . A A . 1 ASN C 1 1
9 2018 1 1 1 ASN CA C -9.981 2.787 -4.247 1.00 . A A . 1 ASN CA 1 1
9 2019 1 1 1 ASN CB C -9.614 2.165 -5.634 1.00 . A A . 1 ASN CB 1 1
9 2020 1 1 1 ASN CG C -8.147 2.362 -6.065 1.00 . A A . 1 ASN CG 1 1
9 2021 1 1 1 ASN H1 H -11.532 2.583 -2.905 1.00 . A A . 1 ASN H1 1 1
9 2022 1 1 1 ASN H2 H -11.176 1.193 -3.719 1.00 . A A . 1 ASN H2 1 1
9 2023 1 1 1 ASN H3 H -11.993 2.407 -4.479 1.00 . A A . 1 ASN H3 1 1
9 2024 1 1 1 ASN HA H -9.213 2.490 -3.533 1.00 . A A . 1 ASN HA 1 1
9 2025 1 1 1 ASN HB2 H -9.813 1.094 -5.588 1.00 . A A . 1 ASN HB2 1 1
9 2026 1 1 1 ASN HB3 H -10.261 2.605 -6.393 1.00 . A A . 1 ASN HB3 1 1
9 2027 1 1 1 ASN HD21 H -7.566 0.619 -5.207 1.00 . A A . 1 ASN HD21 1 1
9 2028 1 1 1 ASN HD22 H -6.300 1.528 -6.001 1.00 . A A . 1 ASN HD22 1 1
9 2029 1 1 1 ASN N N -11.275 2.195 -3.802 1.00 . A A . 1 ASN N 1 1
9 2030 1 1 1 ASN ND2 N -7.268 1.429 -5.731 1.00 . A A . 1 ASN ND2 1 1
9 2031 1 1 1 ASN O O -9.823 5.002 -5.267 1.00 . A A . 1 ASN O 1 1
9 2032 1 1 1 ASN OD1 O -7.794 3.351 -6.707 1.00 . A A . 1 ASN OD1 1 1
9 2033 1 1 2 VAL C C -8.991 6.990 -2.727 1.00 . A A . 2 VAL C 1 1
9 2034 1 1 2 VAL CA C -10.447 6.455 -2.911 1.00 . A A . 2 VAL CA 1 1
9 2035 1 1 2 VAL CB C -11.476 6.836 -1.781 1.00 . A A . 2 VAL CB 1 1
9 2036 1 1 2 VAL CG1 C -11.541 8.353 -1.478 1.00 . A A . 2 VAL CG1 1 1
9 2037 1 1 2 VAL CG2 C -12.924 6.355 -2.049 1.00 . A A . 2 VAL CG2 1 1
9 2038 1 1 2 VAL H H -10.568 4.395 -2.273 1.00 . A A . 2 VAL H 1 1
9 2039 1 1 2 VAL HA H -10.826 6.867 -3.846 1.00 . A A . 2 VAL HA 1 1
9 2040 1 1 2 VAL HB H -11.142 6.344 -0.868 1.00 . A A . 2 VAL HB 1 1
9 2041 1 1 2 VAL HG11 H -10.536 8.729 -1.283 1.00 . A A . 2 VAL HG11 1 1
9 2042 1 1 2 VAL HG12 H -12.168 8.522 -0.603 1.00 . A A . 2 VAL HG12 1 1
9 2043 1 1 2 VAL HG13 H -11.965 8.877 -2.335 1.00 . A A . 2 VAL HG13 1 1
9 2044 1 1 2 VAL HG21 H -12.917 5.287 -2.267 1.00 . A A . 2 VAL HG21 1 1
9 2045 1 1 2 VAL HG22 H -13.334 6.896 -2.901 1.00 . A A . 2 VAL HG22 1 1
9 2046 1 1 2 VAL HG23 H -13.538 6.542 -1.169 1.00 . A A . 2 VAL HG23 1 1
9 2047 1 1 2 VAL N N -10.374 4.973 -3.079 1.00 . A A . 2 VAL N 1 1
9 2048 1 1 2 VAL O O -8.466 7.687 -3.597 1.00 . A A . 2 VAL O 1 1
9 2049 1 1 3 HIS C C -5.872 6.046 -1.890 1.00 . A A . 3 HIS C 1 1
9 2050 1 1 3 HIS CA C -6.966 6.995 -1.241 1.00 . A A . 3 HIS CA 1 1
9 2051 1 1 3 HIS CB C -6.930 6.848 0.305 1.00 . A A . 3 HIS CB 1 1
9 2052 1 1 3 HIS CD2 C -5.433 7.404 2.350 1.00 . A A . 3 HIS CD2 1 1
9 2053 1 1 3 HIS CE1 C -4.176 8.842 1.477 1.00 . A A . 3 HIS CE1 1 1
9 2054 1 1 3 HIS CG C -5.789 7.585 1.002 1.00 . A A . 3 HIS CG 1 1
9 2055 1 1 3 HIS H H -8.894 6.102 -0.915 1.00 . A A . 3 HIS H 1 1
9 2056 1 1 3 HIS HA H -6.768 8.031 -1.517 1.00 . A A . 3 HIS HA 1 1
9 2057 1 1 3 HIS HB2 H -7.870 7.230 0.702 1.00 . A A . 3 HIS HB2 1 1
9 2058 1 1 3 HIS HB3 H -6.856 5.788 0.549 1.00 . A A . 3 HIS HB3 1 1
9 2059 1 1 3 HIS HD2 H -5.924 6.724 3.031 1.00 . A A . 3 HIS HD2 1 1
9 2060 1 1 3 HIS HE1 H -3.387 9.572 1.371 1.00 . A A . 3 HIS HE1 1 1
9 2061 1 1 3 HIS HE2 H -3.873 8.321 3.553 1.00 . A A . 3 HIS HE2 1 1
9 2062 1 1 3 HIS N N -8.369 6.643 -1.587 1.00 . A A . 3 HIS N 1 1
9 2063 1 1 3 HIS ND1 N -4.983 8.546 0.403 1.00 . A A . 3 HIS ND1 1 1
9 2064 1 1 3 HIS NE2 N -4.368 8.217 2.678 1.00 . A A . 3 HIS NE2 1 1
9 2065 1 1 3 HIS O O -4.697 6.082 -1.522 1.00 . A A . 3 HIS O 1 1
9 2066 1 1 4 THR C C -5.303 2.919 -2.798 1.00 . A A . 4 THR C 1 1
9 2067 1 1 4 THR CA C -5.530 4.224 -3.625 1.00 . A A . 4 THR CA 1 1
9 2068 1 1 4 THR CB C -4.361 4.814 -4.446 1.00 . A A . 4 THR CB 1 1
9 2069 1 1 4 THR CG2 C -4.651 6.106 -5.234 1.00 . A A . 4 THR CG2 1 1
9 2070 1 1 4 THR H H -7.274 5.270 -3.083 1.00 . A A . 4 THR H 1 1
9 2071 1 1 4 THR HA H -6.237 3.910 -4.393 1.00 . A A . 4 THR HA 1 1
9 2072 1 1 4 THR HB H -4.113 4.059 -5.192 1.00 . A A . 4 THR HB 1 1
9 2073 1 1 4 THR HG1 H -2.445 5.192 -4.253 1.00 . A A . 4 THR HG1 1 1
9 2074 1 1 4 THR HG21 H -3.752 6.416 -5.767 1.00 . A A . 4 THR HG21 1 1
9 2075 1 1 4 THR HG22 H -5.452 5.923 -5.950 1.00 . A A . 4 THR HG22 1 1
9 2076 1 1 4 THR HG23 H -4.954 6.893 -4.543 1.00 . A A . 4 THR HG23 1 1
9 2077 1 1 4 THR N N -6.291 5.210 -2.856 1.00 . A A . 4 THR N 1 1
9 2078 1 1 4 THR O O -4.181 2.417 -2.701 1.00 . A A . 4 THR O 1 1
9 2079 1 1 4 THR OG1 O -3.183 4.996 -3.671 1.00 . A A . 4 THR OG1 1 1
9 2080 1 1 5 PHE C C -5.621 1.282 -0.092 1.00 . A A . 5 PHE C 1 1
9 2081 1 1 5 PHE CA C -6.387 1.089 -1.440 1.00 . A A . 5 PHE CA 1 1
9 2082 1 1 5 PHE CB C -6.028 -0.187 -2.264 1.00 . A A . 5 PHE CB 1 1
9 2083 1 1 5 PHE CD1 C -5.304 -2.395 -1.208 1.00 . A A . 5 PHE CD1 1 1
9 2084 1 1 5 PHE CD2 C -7.664 -1.889 -1.280 1.00 . A A . 5 PHE CD2 1 1
9 2085 1 1 5 PHE CE1 C -5.584 -3.599 -0.564 1.00 . A A . 5 PHE CE1 1 1
9 2086 1 1 5 PHE CE2 C -7.942 -3.089 -0.628 1.00 . A A . 5 PHE CE2 1 1
9 2087 1 1 5 PHE CG C -6.342 -1.528 -1.567 1.00 . A A . 5 PHE CG 1 1
9 2088 1 1 5 PHE CZ C -6.902 -3.941 -0.270 1.00 . A A . 5 PHE CZ 1 1
9 2089 1 1 5 PHE H H -7.301 2.762 -2.438 1.00 . A A . 5 PHE H 1 1
9 2090 1 1 5 PHE HA H -7.426 0.941 -1.146 1.00 . A A . 5 PHE HA 1 1
9 2091 1 1 5 PHE HB2 H -6.571 -0.153 -3.209 1.00 . A A . 5 PHE HB2 1 1
9 2092 1 1 5 PHE HB3 H -4.959 -0.160 -2.478 1.00 . A A . 5 PHE HB3 1 1
9 2093 1 1 5 PHE HD1 H -4.281 -2.130 -1.430 1.00 . A A . 5 PHE HD1 1 1
9 2094 1 1 5 PHE HD2 H -8.474 -1.234 -1.566 1.00 . A A . 5 PHE HD2 1 1
9 2095 1 1 5 PHE HE1 H -4.780 -4.266 -0.293 1.00 . A A . 5 PHE HE1 1 1
9 2096 1 1 5 PHE HE2 H -8.963 -3.357 -0.400 1.00 . A A . 5 PHE HE2 1 1
9 2097 1 1 5 PHE HZ H -7.117 -4.870 0.236 1.00 . A A . 5 PHE HZ 1 1
9 2098 1 1 5 PHE N N -6.406 2.328 -2.263 1.00 . A A . 5 PHE N 1 1
9 2099 1 1 5 PHE O O -4.699 0.534 0.249 1.00 . A A . 5 PHE O 1 1
9 2100 1 1 6 ARG C C -4.103 3.215 1.996 1.00 . A A . 6 ARG C 1 1
9 2101 1 1 6 ARG CA C -5.543 2.676 2.010 1.00 . A A . 6 ARG CA 1 1
9 2102 1 1 6 ARG CB C -5.786 1.550 3.047 1.00 . A A . 6 ARG CB 1 1
9 2103 1 1 6 ARG CD C -7.619 -0.328 2.957 1.00 . A A . 6 ARG CD 1 1
9 2104 1 1 6 ARG CG C -7.280 1.158 3.208 1.00 . A A . 6 ARG CG 1 1
9 2105 1 1 6 ARG CZ C -6.067 -2.094 3.870 1.00 . A A . 6 ARG CZ 1 1
9 2106 1 1 6 ARG H H -6.812 2.871 0.291 1.00 . A A . 6 ARG H 1 1
9 2107 1 1 6 ARG HA H -6.161 3.511 2.340 1.00 . A A . 6 ARG HA 1 1
9 2108 1 1 6 ARG HB2 H -5.224 0.667 2.744 1.00 . A A . 6 ARG HB2 1 1
9 2109 1 1 6 ARG HB3 H -5.413 1.887 4.014 1.00 . A A . 6 ARG HB3 1 1
9 2110 1 1 6 ARG HD2 H -8.702 -0.436 2.898 1.00 . A A . 6 ARG HD2 1 1
9 2111 1 1 6 ARG HD3 H -7.184 -0.623 2.002 1.00 . A A . 6 ARG HD3 1 1
9 2112 1 1 6 ARG HE H -7.568 -1.222 4.907 1.00 . A A . 6 ARG HE 1 1
9 2113 1 1 6 ARG HG2 H -7.581 1.402 4.227 1.00 . A A . 6 ARG HG2 1 1
9 2114 1 1 6 ARG HG3 H -7.870 1.766 2.522 1.00 . A A . 6 ARG HG3 1 1
9 2115 1 1 6 ARG HH11 H -6.256 -2.767 5.768 1.00 . A A . 6 ARG HH11 1 1
9 2116 1 1 6 ARG HH12 H -4.965 -3.490 4.834 1.00 . A A . 6 ARG HH12 1 1
9 2117 1 1 6 ARG HH21 H -5.577 -1.667 1.942 1.00 . A A . 6 ARG HH21 1 1
9 2118 1 1 6 ARG HH22 H -4.588 -2.883 2.718 1.00 . A A . 6 ARG HH22 1 1
9 2119 1 1 6 ARG N N -6.064 2.307 0.667 1.00 . A A . 6 ARG N 1 1
9 2120 1 1 6 ARG NE N -7.104 -1.241 4.011 1.00 . A A . 6 ARG NE 1 1
9 2121 1 1 6 ARG NH1 N -5.737 -2.842 4.905 1.00 . A A . 6 ARG NH1 1 1
9 2122 1 1 6 ARG NH2 N -5.353 -2.225 2.754 1.00 . A A . 6 ARG NH2 1 1
9 2123 1 1 6 ARG O O -3.164 2.674 2.586 1.00 . A A . 6 ARG O 1 1
9 2124 1 1 7 GLY C C -1.706 4.377 0.259 1.00 . A A . 7 GLY C 1 1
9 2125 1 1 7 GLY CA C -2.782 5.105 1.072 1.00 . A A . 7 GLY CA 1 1
9 2126 1 1 7 GLY H H -4.879 4.686 0.859 1.00 . A A . 7 GLY H 1 1
9 2127 1 1 7 GLY HA2 H -3.035 6.027 0.549 1.00 . A A . 7 GLY HA2 1 1
9 2128 1 1 7 GLY HA3 H -2.365 5.362 2.046 1.00 . A A . 7 GLY HA3 1 1
9 2129 1 1 7 GLY N N -4.031 4.338 1.282 1.00 . A A . 7 GLY N 1 1
9 2130 1 1 7 GLY O O -0.565 4.282 0.723 1.00 . A A . 7 GLY O 1 1
9 2131 1 1 8 ASP C C -0.559 1.847 -1.185 1.00 . A A . 8 ASP C 1 1
9 2132 1 1 8 ASP CA C -1.121 3.146 -1.847 1.00 . A A . 8 ASP CA 1 1
9 2133 1 1 8 ASP CB C -0.062 4.129 -2.440 1.00 . A A . 8 ASP CB 1 1
9 2134 1 1 8 ASP CG C 0.759 3.606 -3.624 1.00 . A A . 8 ASP CG 1 1
9 2135 1 1 8 ASP H H -3.014 4.035 -1.265 1.00 . A A . 8 ASP H 1 1
9 2136 1 1 8 ASP HA H -1.720 2.811 -2.693 1.00 . A A . 8 ASP HA 1 1
9 2137 1 1 8 ASP HB2 H -0.588 5.025 -2.770 1.00 . A A . 8 ASP HB2 1 1
9 2138 1 1 8 ASP HB3 H 0.627 4.411 -1.644 1.00 . A A . 8 ASP HB3 1 1
9 2139 1 1 8 ASP N N -2.065 3.891 -0.950 1.00 . A A . 8 ASP N 1 1
9 2140 1 1 8 ASP O O 0.584 1.475 -1.442 1.00 . A A . 8 ASP O 1 1
9 2141 1 1 8 ASP OD1 O 1.962 3.364 -3.553 1.00 . A A . 8 ASP OD1 1 1
9 2142 1 1 8 ASP OD2 O 0.003 3.451 -4.759 1.00 . A A . 8 ASP OD2 1 1
9 2143 1 1 9 ASN C C 0.329 0.026 1.185 1.00 . A A . 9 ASN C 1 1
9 2144 1 1 9 ASN CA C -0.962 -0.131 0.327 1.00 . A A . 9 ASN CA 1 1
9 2145 1 1 9 ASN CB C -1.034 -1.322 -0.670 1.00 . A A . 9 ASN CB 1 1
9 2146 1 1 9 ASN CG C -0.962 -2.733 -0.056 1.00 . A A . 9 ASN CG 1 1
9 2147 1 1 9 ASN H H -2.323 1.440 -0.254 1.00 . A A . 9 ASN H 1 1
9 2148 1 1 9 ASN HA H -1.757 -0.321 1.048 1.00 . A A . 9 ASN HA 1 1
9 2149 1 1 9 ASN HB2 H -1.963 -1.241 -1.233 1.00 . A A . 9 ASN HB2 1 1
9 2150 1 1 9 ASN HB3 H -0.202 -1.222 -1.367 1.00 . A A . 9 ASN HB3 1 1
9 2151 1 1 9 ASN HD21 H -2.909 -2.675 0.497 1.00 . A A . 9 ASN HD21 1 1
9 2152 1 1 9 ASN HD22 H -2.052 -4.145 0.904 1.00 . A A . 9 ASN HD22 1 1
9 2153 1 1 9 ASN N N -1.375 1.117 -0.381 1.00 . A A . 9 ASN N 1 1
9 2154 1 1 9 ASN ND2 N -2.061 -3.223 0.491 1.00 . A A . 9 ASN ND2 1 1
9 2155 1 1 9 ASN O O 1.143 -0.887 1.263 1.00 . A A . 9 ASN O 1 1
9 2156 1 1 9 ASN OD1 O 0.080 -3.389 -0.070 1.00 . A A . 9 ASN OD1 1 1
9 2157 1 1 10 VAL C C 2.907 1.728 1.932 1.00 . A A . 10 VAL C 1 1
9 2158 1 1 10 VAL CA C 1.601 1.521 2.764 1.00 . A A . 10 VAL CA 1 1
9 2159 1 1 10 VAL CB C 1.667 0.786 4.154 1.00 . A A . 10 VAL CB 1 1
9 2160 1 1 10 VAL CG1 C 2.076 -0.703 4.161 1.00 . A A . 10 VAL CG1 1 1
9 2161 1 1 10 VAL CG2 C 2.540 1.559 5.169 1.00 . A A . 10 VAL CG2 1 1
9 2162 1 1 10 VAL H H -0.317 1.827 1.840 1.00 . A A . 10 VAL H 1 1
9 2163 1 1 10 VAL HA H 1.357 2.542 3.058 1.00 . A A . 10 VAL HA 1 1
9 2164 1 1 10 VAL HB H 0.653 0.816 4.553 1.00 . A A . 10 VAL HB 1 1
9 2165 1 1 10 VAL HG11 H 1.462 -1.252 3.446 1.00 . A A . 10 VAL HG11 1 1
9 2166 1 1 10 VAL HG12 H 3.126 -0.792 3.882 1.00 . A A . 10 VAL HG12 1 1
9 2167 1 1 10 VAL HG13 H 1.929 -1.115 5.159 1.00 . A A . 10 VAL HG13 1 1
9 2168 1 1 10 VAL HG21 H 2.255 2.611 5.168 1.00 . A A . 10 VAL HG21 1 1
9 2169 1 1 10 VAL HG22 H 2.392 1.143 6.165 1.00 . A A . 10 VAL HG22 1 1
9 2170 1 1 10 VAL HG23 H 3.590 1.466 4.889 1.00 . A A . 10 VAL HG23 1 1
9 2171 1 1 10 VAL N N 0.443 1.164 1.898 1.00 . A A . 10 VAL N 1 1
9 2172 1 1 10 VAL O O 3.976 1.213 2.250 1.00 . A A . 10 VAL O 1 1
9 2173 1 1 11 HIS C C 4.338 1.744 -0.914 1.00 . A A . 11 HIS C 1 1
9 2174 1 1 11 HIS CA C 3.882 2.960 -0.048 1.00 . A A . 11 HIS CA 1 1
9 2175 1 1 11 HIS CB C 5.029 3.733 0.677 1.00 . A A . 11 HIS CB 1 1
9 2176 1 1 11 HIS CD2 C 6.924 5.394 0.197 1.00 . A A . 11 HIS CD2 1 1
9 2177 1 1 11 HIS CE1 C 6.549 5.816 -1.827 1.00 . A A . 11 HIS CE1 1 1
9 2178 1 1 11 HIS CG C 5.815 4.661 -0.237 1.00 . A A . 11 HIS CG 1 1
9 2179 1 1 11 HIS H H 1.879 3.030 0.761 1.00 . A A . 11 HIS H 1 1
9 2180 1 1 11 HIS HA H 3.444 3.671 -0.748 1.00 . A A . 11 HIS HA 1 1
9 2181 1 1 11 HIS HB2 H 4.590 4.329 1.477 1.00 . A A . 11 HIS HB2 1 1
9 2182 1 1 11 HIS HB3 H 5.717 3.010 1.116 1.00 . A A . 11 HIS HB3 1 1
9 2183 1 1 11 HIS HD2 H 7.329 5.365 1.198 1.00 . A A . 11 HIS HD2 1 1
9 2184 1 1 11 HIS HE1 H 6.652 6.247 -2.811 1.00 . A A . 11 HIS HE1 1 1
9 2185 1 1 11 HIS HE2 H 8.217 6.792 -0.854 1.00 . A A . 11 HIS HE2 1 1
9 2186 1 1 11 HIS N N 2.780 2.596 0.901 1.00 . A A . 11 HIS N 1 1
9 2187 1 1 11 HIS ND1 N 5.534 4.922 -1.574 1.00 . A A . 11 HIS ND1 1 1
9 2188 1 1 11 HIS NE2 N 7.428 6.161 -0.835 1.00 . A A . 11 HIS NE2 1 1
9 2189 1 1 11 HIS O O 5.535 1.550 -1.120 1.00 . A A . 11 HIS O 1 1
9 2190 1 1 12 ASN C C 4.092 -1.381 -1.438 1.00 . A A . 12 ASN C 1 1
9 2191 1 1 12 ASN CA C 3.634 -0.204 -2.354 1.00 . A A . 12 ASN CA 1 1
9 2192 1 1 12 ASN CB C 4.529 0.015 -3.625 1.00 . A A . 12 ASN CB 1 1
9 2193 1 1 12 ASN CG C 4.017 1.050 -4.643 1.00 . A A . 12 ASN CG 1 1
9 2194 1 1 12 ASN H H 2.420 1.278 -1.383 1.00 . A A . 12 ASN H 1 1
9 2195 1 1 12 ASN HA H 2.658 -0.499 -2.737 1.00 . A A . 12 ASN HA 1 1
9 2196 1 1 12 ASN HB2 H 5.513 0.340 -3.287 1.00 . A A . 12 ASN HB2 1 1
9 2197 1 1 12 ASN HB3 H 4.641 -0.941 -4.135 1.00 . A A . 12 ASN HB3 1 1
9 2198 1 1 12 ASN HD21 H 2.749 -0.278 -5.503 1.00 . A A . 12 ASN HD21 1 1
9 2199 1 1 12 ASN HD22 H 2.746 1.327 -6.199 1.00 . A A . 12 ASN HD22 1 1
9 2200 1 1 12 ASN N N 3.381 0.997 -1.515 1.00 . A A . 12 ASN N 1 1
9 2201 1 1 12 ASN ND2 N 3.098 0.669 -5.518 1.00 . A A . 12 ASN ND2 1 1
9 2202 1 1 12 ASN O O 5.073 -2.063 -1.751 1.00 . A A . 12 ASN O 1 1
9 2203 1 1 12 ASN OD1 O 4.452 2.201 -4.653 1.00 . A A . 12 ASN OD1 1 1
9 2204 1 1 13 SER C C 5.069 -2.445 1.260 1.00 . A A . 13 SER C 1 1
9 2205 1 1 13 SER CA C 3.676 -2.719 0.671 1.00 . A A . 13 SER CA 1 1
9 2206 1 1 13 SER CB C 3.389 -4.159 0.128 1.00 . A A . 13 SER CB 1 1
9 2207 1 1 13 SER H H 2.550 -1.052 -0.130 1.00 . A A . 13 SER H 1 1
9 2208 1 1 13 SER HA H 2.979 -2.577 1.498 1.00 . A A . 13 SER HA 1 1
9 2209 1 1 13 SER HB2 H 3.339 -4.847 0.972 1.00 . A A . 13 SER HB2 1 1
9 2210 1 1 13 SER HB3 H 2.426 -4.158 -0.384 1.00 . A A . 13 SER HB3 1 1
9 2211 1 1 13 SER HG H 4.460 -5.572 -0.718 1.00 . A A . 13 SER HG 1 1
9 2212 1 1 13 SER N N 3.356 -1.633 -0.310 1.00 . A A . 13 SER N 1 1
9 2213 1 1 13 SER O O 6.003 -3.186 0.976 1.00 . A A . 13 SER O 1 1
9 2214 1 1 13 SER OG O 4.391 -4.616 -0.774 1.00 . A A . 13 SER OG 1 1
9 2215 1 1 14 SER C C 7.589 -0.784 1.584 1.00 . A A . 14 SER C 1 1
9 2216 1 1 14 SER CA C 6.496 -0.944 2.689 1.00 . A A . 14 SER CA 1 1
9 2217 1 1 14 SER CB C 6.830 -1.911 3.862 1.00 . A A . 14 SER CB 1 1
9 2218 1 1 14 SER H H 4.386 -0.805 2.259 1.00 . A A . 14 SER H 1 1
9 2219 1 1 14 SER HA H 6.336 0.042 3.124 1.00 . A A . 14 SER HA 1 1
9 2220 1 1 14 SER HB2 H 5.966 -1.983 4.523 1.00 . A A . 14 SER HB2 1 1
9 2221 1 1 14 SER HB3 H 7.053 -2.897 3.457 1.00 . A A . 14 SER HB3 1 1
9 2222 1 1 14 SER HG H 8.135 -2.063 5.323 1.00 . A A . 14 SER HG 1 1
9 2223 1 1 14 SER N N 5.207 -1.362 2.068 1.00 . A A . 14 SER N 1 1
9 2224 1 1 14 SER O O 8.743 -1.138 1.847 1.00 . A A . 14 SER O 1 1
9 2225 1 1 14 SER OG O 7.951 -1.450 4.608 1.00 . A A . 14 SER OG 1 1
9 2226 1 1 15 SER C C 8.678 -1.475 -1.381 1.00 . A A . 15 SER C 1 1
9 2227 1 1 15 SER CA C 8.242 -0.081 -0.768 1.00 . A A . 15 SER CA 1 1
9 2228 1 1 15 SER CB C 9.499 0.733 -0.346 1.00 . A A . 15 SER CB 1 1
9 2229 1 1 15 SER H H 6.293 0.080 0.223 1.00 . A A . 15 SER H 1 1
9 2230 1 1 15 SER HA H 7.747 0.478 -1.561 1.00 . A A . 15 SER HA 1 1
9 2231 1 1 15 SER HB2 H 9.190 1.575 0.274 1.00 . A A . 15 SER HB2 1 1
9 2232 1 1 15 SER HB3 H 10.163 0.089 0.231 1.00 . A A . 15 SER HB3 1 1
9 2233 1 1 15 SER HG H 10.970 1.721 -1.198 1.00 . A A . 15 SER HG 1 1
9 2234 1 1 15 SER N N 7.243 -0.233 0.365 1.00 . A A . 15 SER N 1 1
9 2235 1 1 15 SER O O 9.266 -1.489 -2.465 1.00 . A A . 15 SER O 1 1
9 2236 1 1 15 SER OG O 10.201 1.224 -1.485 1.00 . A A . 15 SER OG 1 1
9 2237 1 1 16 SER C C 8.217 -5.114 -0.198 1.00 . A A . 16 SER C 1 1
9 2238 1 1 16 SER CA C 8.743 -3.998 -1.154 1.00 . A A . 16 SER CA 1 1
9 2239 1 1 16 SER CB C 10.290 -4.165 -1.167 1.00 . A A . 16 SER CB 1 1
9 2240 1 1 16 SER H H 7.877 -2.538 0.156 1.00 . A A . 16 SER H 1 1
9 2241 1 1 16 SER HA H 8.353 -4.169 -2.158 1.00 . A A . 16 SER HA 1 1
9 2242 1 1 16 SER HB2 H 10.748 -3.215 -1.442 1.00 . A A . 16 SER HB2 1 1
9 2243 1 1 16 SER HB3 H 10.628 -4.449 -0.170 1.00 . A A . 16 SER HB3 1 1
9 2244 1 1 16 SER HG H 11.648 -5.244 -2.087 1.00 . A A . 16 SER HG 1 1
9 2245 1 1 16 SER N N 8.383 -2.626 -0.713 1.00 . A A . 16 SER N 1 1
9 2246 1 1 16 SER O O 7.791 -6.166 -0.684 1.00 . A A . 16 SER O 1 1
9 2247 1 1 16 SER OG O 10.692 -5.161 -2.099 1.00 . A A . 16 SER OG 1 1
9 2248 1 1 17 LEU C C 6.264 -5.946 2.302 1.00 . A A . 17 LEU C 1 1
9 2249 1 1 17 LEU CA C 7.817 -5.900 2.149 1.00 . A A . 17 LEU CA 1 1
9 2250 1 1 17 LEU CB C 8.626 -5.729 3.477 1.00 . A A . 17 LEU CB 1 1
9 2251 1 1 17 LEU CD1 C 10.847 -5.525 4.728 1.00 . A A . 17 LEU CD1 1 1
9 2252 1 1 17 LEU CD2 C 10.551 -7.435 3.114 1.00 . A A . 17 LEU CD2 1 1
9 2253 1 1 17 LEU CG C 10.171 -5.969 3.416 1.00 . A A . 17 LEU CG 1 1
9 2254 1 1 17 LEU H H 8.650 -4.018 1.471 1.00 . A A . 17 LEU H 1 1
9 2255 1 1 17 LEU HXT H 4.690 -5.401 3.317 1.00 . A A . 17 LEU HXT 1 1
9 2256 1 1 17 LEU HA H 8.104 -6.873 1.751 1.00 . A A . 17 LEU HA 1 1
9 2257 1 1 17 LEU HB2 H 8.467 -4.709 3.827 1.00 . A A . 17 LEU HB2 1 1
9 2258 1 1 17 LEU HB3 H 8.207 -6.410 4.218 1.00 . A A . 17 LEU HB3 1 1
9 2259 1 1 17 LEU HD11 H 10.579 -4.491 4.943 1.00 . A A . 17 LEU HD11 1 1
9 2260 1 1 17 LEU HD12 H 11.929 -5.607 4.625 1.00 . A A . 17 LEU HD12 1 1
9 2261 1 1 17 LEU HD13 H 10.511 -6.164 5.545 1.00 . A A . 17 LEU HD13 1 1
9 2262 1 1 17 LEU HD21 H 10.074 -7.751 2.186 1.00 . A A . 17 LEU HD21 1 1
9 2263 1 1 17 LEU HD22 H 11.633 -7.515 3.012 1.00 . A A . 17 LEU HD22 1 1
9 2264 1 1 17 LEU HD23 H 10.215 -8.073 3.931 1.00 . A A . 17 LEU HD23 1 1
9 2265 1 1 17 LEU HG H 10.570 -5.351 2.612 1.00 . A A . 17 LEU HG 1 1
9 2266 1 1 17 LEU N N 8.277 -4.896 1.141 1.00 . A A . 17 LEU N 1 1
9 2267 1 1 17 LEU O O 5.587 -6.572 1.487 1.00 . A A . 17 LEU O 1 1
9 2268 1 1 17 LEU OXT O 5.640 -5.273 3.369 1.00 . A A . 17 LEU OXT 1 1
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