NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
394324 |
1r7c   |
5978 | cing | 4-filtered-FRED | STAR | entry | full | 300 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1r7c
# This FRED archive file contains, for PDB entry <1r7c>:
#
# - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
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.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_1r7c
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1r7c
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 3766.39
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 $Genome_polyprotein A . 1 1
stop_
save_
save_Genome_polyprotein
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Genome polyprotein"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code SGSWLRDIWDWICEVLSDFKTWLKAKLMPQL
_Entity.Number_of_monomers 31
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 SER . 1 1
2 GLY . 1 1
3 SER . 1 1
4 TRP . 1 1
5 LEU . 1 1
6 ARG . 1 1
7 ASP . 1 1
8 ILE . 1 1
9 TRP . 1 1
10 ASP . 1 1
11 TRP . 1 1
12 ILE . 1 1
13 CYS . 1 1
14 GLU . 1 1
15 VAL . 1 1
16 LEU . 1 1
17 SER . 1 1
18 ASP . 1 1
19 PHE . 1 1
20 LYS . 1 1
21 THR . 1 1
22 TRP . 1 1
23 LEU . 1 1
24 LYS . 1 1
25 ALA . 1 1
26 LYS . 1 1
27 LEU . 1 1
28 MET . 1 1
29 PRO . 1 1
30 GLN . 1 1
31 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
SER 1 1 1 1
GLY 2 2 1 1
SER 3 3 1 1
TRP 4 4 1 1
LEU 5 5 1 1
ARG 6 6 1 1
ASP 7 7 1 1
ILE 8 8 1 1
TRP 9 9 1 1
ASP 10 10 1 1
TRP 11 11 1 1
ILE 12 12 1 1
CYS 13 13 1 1
GLU 14 14 1 1
VAL 15 15 1 1
LEU 16 16 1 1
SER 17 17 1 1
ASP 18 18 1 1
PHE 19 19 1 1
LYS 20 20 1 1
THR 21 21 1 1
TRP 22 22 1 1
LEU 23 23 1 1
LYS 24 24 1 1
ALA 25 25 1 1
LYS 26 26 1 1
LEU 27 27 1 1
MET 28 28 1 1
PRO 29 29 1 1
GLN 30 30 1 1
LEU 31 31 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
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298 1 . . . 1 1
299 1 . . . 1 1
300 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 1 SER HA . 1 . HA 1 1
1 1 2 1 1 2 GLY H . 2 . HN 1 1
2 1 1 1 1 2 GLY H . 2 . HN 1 1
2 1 2 1 1 3 SER H . 3 . HN 1 1
3 1 1 1 1 3 SER H . 3 . HN 1 1
3 1 2 1 1 3 SER HA . 3 . HA 1 1
4 1 1 1 1 3 SER H . 3 . HN 1 1
4 1 2 1 1 3 SER HB2 . 3 . HB2 1 1
5 1 1 1 1 3 SER H . 3 . HN 1 1
5 1 2 1 1 3 SER HB3 . 3 . HB1 1 1
6 1 1 1 1 3 SER HA . 3 . HA 1 1
6 1 2 1 1 4 TRP H . 4 . HN 1 1
7 1 1 1 1 3 SER HA . 3 . HA 1 1
7 1 2 1 1 6 ARG H . 6 . HN 1 1
8 1 1 1 1 4 TRP H . 4 . HN 1 1
8 1 2 1 1 4 TRP HA . 4 . HA 1 1
9 1 1 1 1 4 TRP H . 4 . HN 1 1
9 1 2 1 1 4 TRP HB2 . 4 . HB2 1 1
10 1 1 1 1 4 TRP H . 4 . HN 1 1
10 1 2 1 1 4 TRP HB3 . 4 . HB1 1 1
11 1 1 1 1 4 TRP H . 4 . HN 1 1
11 1 2 1 1 4 TRP HD1 . 4 . HD1 1 1
12 1 1 1 1 4 TRP H . 4 . HN 1 1
12 1 2 1 1 5 LEU H . 5 . HN 1 1
13 1 1 1 1 4 TRP HA . 4 . HA 1 1
13 1 2 1 1 4 TRP HB3 . 4 . HB1 1 1
14 1 1 1 1 4 TRP HA . 4 . HA 1 1
14 1 2 1 1 4 TRP HE3 . 4 . HE3 1 1
15 1 1 1 1 4 TRP HA . 4 . HA 1 1
15 1 2 1 1 5 LEU H . 5 . HN 1 1
16 1 1 1 1 4 TRP HA . 4 . HA 1 1
16 1 2 1 1 7 ASP H . 7 . HN 1 1
17 1 1 1 1 4 TRP HA . 4 . HA 1 1
17 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1
18 1 1 1 1 4 TRP HA . 4 . HA 1 1
18 1 2 1 1 7 ASP HB3 . 7 . HB1 1 1
19 1 1 1 1 4 TRP HB2 . 4 . HB2 1 1
19 1 2 1 1 4 TRP HD1 . 4 . HD1 1 1
20 1 1 1 1 4 TRP HB2 . 4 . HB2 1 1
20 1 2 1 1 4 TRP HE3 . 4 . HE3 1 1
21 1 1 1 1 4 TRP HB2 . 4 . HB2 1 1
21 1 2 1 1 5 LEU H . 5 . HN 1 1
22 1 1 1 1 4 TRP HB3 . 4 . HB1 1 1
22 1 2 1 1 4 TRP HD1 . 4 . HD1 1 1
23 1 1 1 1 4 TRP HB3 . 4 . HB1 1 1
23 1 2 1 1 4 TRP HE3 . 4 . HE3 1 1
24 1 1 1 1 4 TRP HB3 . 4 . HB1 1 1
24 1 2 1 1 5 LEU H . 5 . HN 1 1
25 1 1 1 1 4 TRP HE3 . 4 . HE3 1 1
25 1 2 1 1 8 ILE MD . 8 . HD1# 1 1
26 1 1 1 1 4 TRP HE3 . 4 . HE3 1 1
26 1 2 1 1 8 ILE HG12 . 8 . HG12 1 1
27 1 1 1 1 5 LEU H . 5 . HN 1 1
27 1 2 1 1 5 LEU HA . 5 . HA 1 1
28 1 1 1 1 5 LEU H . 5 . HN 1 1
28 1 2 1 1 5 LEU HB3 . 5 . HB1 1 1
29 1 1 1 1 5 LEU HA . 5 . HA 1 1
29 1 2 1 1 5 LEU HB3 . 5 . HB1 1 1
30 1 1 1 1 5 LEU HA . 5 . HA 1 1
30 1 2 1 1 6 ARG H . 6 . HN 1 1
31 1 1 1 1 5 LEU HA . 5 . HA 1 1
31 1 2 1 1 8 ILE H . 8 . HN 1 1
32 1 1 1 1 5 LEU HA . 5 . HA 1 1
32 1 2 1 1 8 ILE HB . 8 . HB 1 1
33 1 1 1 1 5 LEU HA . 5 . HA 1 1
33 1 2 1 1 9 TRP H . 9 . HN 1 1
34 1 1 1 1 5 LEU HB2 . 5 . HB2 1 1
34 1 2 1 1 6 ARG H . 6 . HN 1 1
35 1 1 1 1 5 LEU HB3 . 5 . HB1 1 1
35 1 2 1 1 6 ARG H . 6 . HN 1 1
36 1 1 1 1 6 ARG H . 6 . HN 1 1
36 1 2 1 1 6 ARG HA . 6 . HA 1 1
37 1 1 1 1 6 ARG H . 6 . HN 1 1
37 1 2 1 1 6 ARG HB2 . 6 . HB2 1 1
38 1 1 1 1 6 ARG H . 6 . HN 1 1
38 1 2 1 1 6 ARG HB3 . 6 . HB1 1 1
39 1 1 1 1 6 ARG H . 6 . HN 1 1
39 1 2 1 1 6 ARG QG . 6 . HG# 1 1
40 1 1 1 1 6 ARG H . 6 . HN 1 1
40 1 2 1 1 7 ASP H . 7 . HN 1 1
41 1 1 1 1 6 ARG HA . 6 . HA 1 1
41 1 2 1 1 6 ARG HB2 . 6 . HB2 1 1
42 1 1 1 1 6 ARG HA . 6 . HA 1 1
42 1 2 1 1 7 ASP H . 7 . HN 1 1
43 1 1 1 1 6 ARG HA . 6 . HA 1 1
43 1 2 1 1 9 TRP H . 9 . HN 1 1
44 1 1 1 1 6 ARG HA . 6 . HA 1 1
44 1 2 1 1 9 TRP QB . 9 . HB# 1 1
45 1 1 1 1 6 ARG HB2 . 6 . HB2 1 1
45 1 2 1 1 7 ASP H . 7 . HN 1 1
46 1 1 1 1 6 ARG HB3 . 6 . HB1 1 1
46 1 2 1 1 7 ASP H . 7 . HN 1 1
47 1 1 1 1 7 ASP H . 7 . HN 1 1
47 1 2 1 1 7 ASP HA . 7 . HA 1 1
48 1 1 1 1 7 ASP H . 7 . HN 1 1
48 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1
49 1 1 1 1 7 ASP H . 7 . HN 1 1
49 1 2 1 1 7 ASP HB3 . 7 . HB1 1 1
50 1 1 1 1 7 ASP HA . 7 . HA 1 1
50 1 2 1 1 10 ASP HB2 . 10 . HB2 1 1
51 1 1 1 1 7 ASP HA . 7 . HA 1 1
51 1 2 1 1 10 ASP HB3 . 10 . HB1 1 1
52 1 1 1 1 8 ILE H . 8 . HN 1 1
52 1 2 1 1 8 ILE HA . 8 . HA 1 1
53 1 1 1 1 8 ILE H . 8 . HN 1 1
53 1 2 1 1 8 ILE HB . 8 . HB 1 1
54 1 1 1 1 8 ILE H . 8 . HN 1 1
54 1 2 1 1 9 TRP H . 9 . HN 1 1
55 1 1 1 1 8 ILE HA . 8 . HA 1 1
55 1 2 1 1 9 TRP H . 9 . HN 1 1
56 1 1 1 1 8 ILE HA . 8 . HA 1 1
56 1 2 1 1 11 TRP H . 11 . HN 1 1
57 1 1 1 1 8 ILE HA . 8 . HA 1 1
57 1 2 1 1 11 TRP HB2 . 11 . HB2 1 1
58 1 1 1 1 8 ILE HA . 8 . HA 1 1
58 1 2 1 1 11 TRP HB3 . 11 . HB1 1 1
59 1 1 1 1 8 ILE HA . 8 . HA 1 1
59 1 2 1 1 11 TRP HE3 . 11 . HE3 1 1
60 1 1 1 1 8 ILE HA . 8 . HA 1 1
60 1 2 1 1 12 ILE H . 12 . HN 1 1
61 1 1 1 1 8 ILE HB . 8 . HB 1 1
61 1 2 1 1 9 TRP H . 9 . HN 1 1
62 1 1 1 1 8 ILE MG . 8 . HG2# 1 1
62 1 2 1 1 9 TRP H . 9 . HN 1 1
63 1 1 1 1 8 ILE MG . 8 . HG2# 1 1
63 1 2 1 1 11 TRP HE3 . 11 . HE3 1 1
64 1 1 1 1 8 ILE MG . 8 . HG2# 1 1
64 1 2 1 1 12 ILE HB . 12 . HB 1 1
65 1 1 1 1 9 TRP H . 9 . HN 1 1
65 1 2 1 1 9 TRP QB . 9 . HB# 1 1
66 1 1 1 1 9 TRP H . 9 . HN 1 1
66 1 2 1 1 10 ASP H . 10 . HN 1 1
67 1 1 1 1 9 TRP HA . 9 . HA 1 1
67 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
68 1 1 1 1 9 TRP HA . 9 . HA 1 1
68 1 2 1 1 10 ASP H . 10 . HN 1 1
69 1 1 1 1 9 TRP HA . 9 . HA 1 1
69 1 2 1 1 12 ILE H . 12 . HN 1 1
70 1 1 1 1 9 TRP HA . 9 . HA 1 1
70 1 2 1 1 12 ILE HB . 12 . HB 1 1
71 1 1 1 1 9 TRP QB . 9 . HB# 1 1
71 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1
72 1 1 1 1 9 TRP QB . 9 . HB# 1 1
72 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1
73 1 1 1 1 9 TRP QB . 9 . HB# 1 1
73 1 2 1 1 10 ASP H . 10 . HN 1 1
74 1 1 1 1 9 TRP HE3 . 9 . HE3 1 1
74 1 2 1 1 12 ILE MD . 12 . HD1# 1 1
75 1 1 1 1 9 TRP HE3 . 9 . HE3 1 1
75 1 2 1 1 12 ILE MG . 12 . HG2# 1 1
76 1 1 1 1 10 ASP H . 10 . HN 1 1
76 1 2 1 1 10 ASP HA . 10 . HA 1 1
77 1 1 1 1 10 ASP H . 10 . HN 1 1
77 1 2 1 1 10 ASP HB2 . 10 . HB2 1 1
78 1 1 1 1 10 ASP H . 10 . HN 1 1
78 1 2 1 1 10 ASP HB3 . 10 . HB1 1 1
79 1 1 1 1 10 ASP H . 10 . HN 1 1
79 1 2 1 1 11 TRP H . 11 . HN 1 1
80 1 1 1 1 10 ASP HA . 10 . HA 1 1
80 1 2 1 1 10 ASP HB2 . 10 . HB2 1 1
81 1 1 1 1 10 ASP HA . 10 . HA 1 1
81 1 2 1 1 11 TRP H . 11 . HN 1 1
82 1 1 1 1 10 ASP HA . 10 . HA 1 1
82 1 2 1 1 13 CYS H . 13 . HN 1 1
83 1 1 1 1 10 ASP HA . 10 . HA 1 1
83 1 2 1 1 13 CYS HB2 . 13 . HB2 1 1
84 1 1 1 1 10 ASP HA . 10 . HA 1 1
84 1 2 1 1 13 CYS HB3 . 13 . HB1 1 1
85 1 1 1 1 10 ASP HB2 . 10 . HB2 1 1
85 1 2 1 1 11 TRP H . 11 . HN 1 1
86 1 1 1 1 10 ASP HB3 . 10 . HB1 1 1
86 1 2 1 1 11 TRP H . 11 . HN 1 1
87 1 1 1 1 11 TRP H . 11 . HN 1 1
87 1 2 1 1 11 TRP HA . 11 . HA 1 1
88 1 1 1 1 11 TRP H . 11 . HN 1 1
88 1 2 1 1 11 TRP HB2 . 11 . HB2 1 1
89 1 1 1 1 11 TRP H . 11 . HN 1 1
89 1 2 1 1 11 TRP HB3 . 11 . HB1 1 1
90 1 1 1 1 11 TRP H . 11 . HN 1 1
90 1 2 1 1 12 ILE H . 12 . HN 1 1
91 1 1 1 1 11 TRP H . 11 . HN 1 1
91 1 2 1 1 13 CYS H . 13 . HN 1 1
92 1 1 1 1 11 TRP HA . 11 . HA 1 1
92 1 2 1 1 11 TRP HB2 . 11 . HB2 1 1
93 1 1 1 1 11 TRP HA . 11 . HA 1 1
93 1 2 1 1 11 TRP HD1 . 11 . HD1 1 1
94 1 1 1 1 11 TRP HA . 11 . HA 1 1
94 1 2 1 1 11 TRP HE3 . 11 . HE3 1 1
95 1 1 1 1 11 TRP HA . 11 . HA 1 1
95 1 2 1 1 12 ILE H . 12 . HN 1 1
96 1 1 1 1 11 TRP HA . 11 . HA 1 1
96 1 2 1 1 14 GLU H . 14 . HN 1 1
97 1 1 1 1 11 TRP HA . 11 . HA 1 1
97 1 2 1 1 14 GLU HB2 . 14 . HB2 1 1
98 1 1 1 1 11 TRP HA . 11 . HA 1 1
98 1 2 1 1 14 GLU HB3 . 14 . HB1 1 1
99 1 1 1 1 11 TRP HA . 11 . HA 1 1
99 1 2 1 1 15 VAL H . 15 . HN 1 1
100 1 1 1 1 11 TRP HB2 . 11 . HB2 1 1
100 1 2 1 1 11 TRP HD1 . 11 . HD1 1 1
101 1 1 1 1 11 TRP HB2 . 11 . HB2 1 1
101 1 2 1 1 11 TRP HE3 . 11 . HE3 1 1
102 1 1 1 1 11 TRP HB2 . 11 . HB2 1 1
102 1 2 1 1 12 ILE H . 12 . HN 1 1
103 1 1 1 1 11 TRP HB3 . 11 . HB1 1 1
103 1 2 1 1 11 TRP HD1 . 11 . HD1 1 1
104 1 1 1 1 11 TRP HB3 . 11 . HB1 1 1
104 1 2 1 1 11 TRP HE3 . 11 . HE3 1 1
105 1 1 1 1 11 TRP HB3 . 11 . HB1 1 1
105 1 2 1 1 12 ILE H . 12 . HN 1 1
106 1 1 1 1 11 TRP HD1 . 11 . HD1 1 1
106 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
107 1 1 1 1 11 TRP HE1 . 11 . HE1 1 1
107 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
108 1 1 1 1 11 TRP HE3 . 11 . HE3 1 1
108 1 2 1 1 12 ILE MD . 12 . HD1# 1 1
109 1 1 1 1 11 TRP HE3 . 11 . HE3 1 1
109 1 2 1 1 12 ILE HG12 . 12 . HG12 1 1
110 1 1 1 1 11 TRP HE3 . 11 . HE3 1 1
110 1 2 1 1 12 ILE MG . 12 . HG2# 1 1
111 1 1 1 1 11 TRP HE3 . 11 . HE3 1 1
111 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
112 1 1 1 1 11 TRP HZ2 . 11 . HZ2 1 1
112 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
113 1 1 1 1 12 ILE H . 12 . HN 1 1
113 1 2 1 1 12 ILE HA . 12 . HA 1 1
114 1 1 1 1 12 ILE H . 12 . HN 1 1
114 1 2 1 1 12 ILE HB . 12 . HB 1 1
115 1 1 1 1 12 ILE H . 12 . HN 1 1
115 1 2 1 1 12 ILE MD . 12 . HD1# 1 1
116 1 1 1 1 12 ILE H . 12 . HN 1 1
116 1 2 1 1 12 ILE MG . 12 . HG2# 1 1
117 1 1 1 1 12 ILE H . 12 . HN 1 1
117 1 2 1 1 13 CYS H . 13 . HN 1 1
118 1 1 1 1 12 ILE HA . 12 . HA 1 1
118 1 2 1 1 12 ILE HB . 12 . HB 1 1
119 1 1 1 1 12 ILE HA . 12 . HA 1 1
119 1 2 1 1 13 CYS H . 13 . HN 1 1
120 1 1 1 1 12 ILE HA . 12 . HA 1 1
120 1 2 1 1 15 VAL H . 15 . HN 1 1
121 1 1 1 1 12 ILE HA . 12 . HA 1 1
121 1 2 1 1 15 VAL HB . 15 . HB 1 1
122 1 1 1 1 12 ILE HA . 12 . HA 1 1
122 1 2 1 1 15 VAL MG1 . 15 . HG1# 1 1
123 1 1 1 1 12 ILE HA . 12 . HA 1 1
123 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
124 1 1 1 1 12 ILE HA . 12 . HA 1 1
124 1 2 1 1 16 LEU H . 16 . HN 1 1
125 1 1 1 1 12 ILE HB . 12 . HB 1 1
125 1 2 1 1 13 CYS H . 13 . HN 1 1
126 1 1 1 1 12 ILE MG . 12 . HG2# 1 1
126 1 2 1 1 13 CYS H . 13 . HN 1 1
127 1 1 1 1 13 CYS H . 13 . HN 1 1
127 1 2 1 1 13 CYS HA . 13 . HA 1 1
128 1 1 1 1 13 CYS H . 13 . HN 1 1
128 1 2 1 1 13 CYS HB2 . 13 . HB2 1 1
129 1 1 1 1 13 CYS H . 13 . HN 1 1
129 1 2 1 1 13 CYS HB3 . 13 . HB1 1 1
130 1 1 1 1 13 CYS H . 13 . HN 1 1
130 1 2 1 1 13 CYS HG . 13 . HG 1 1
131 1 1 1 1 13 CYS H . 13 . HN 1 1
131 1 2 1 1 14 GLU H . 14 . HN 1 1
132 1 1 1 1 13 CYS H . 13 . HN 1 1
132 1 2 1 1 15 VAL H . 15 . HN 1 1
133 1 1 1 1 13 CYS HA . 13 . HA 1 1
133 1 2 1 1 13 CYS HB2 . 13 . HB2 1 1
134 1 1 1 1 13 CYS HA . 13 . HA 1 1
134 1 2 1 1 13 CYS HB3 . 13 . HB1 1 1
135 1 1 1 1 13 CYS HA . 13 . HA 1 1
135 1 2 1 1 14 GLU H . 14 . HN 1 1
136 1 1 1 1 13 CYS HA . 13 . HA 1 1
136 1 2 1 1 16 LEU H . 16 . HN 1 1
137 1 1 1 1 13 CYS HA . 13 . HA 1 1
137 1 2 1 1 16 LEU HB2 . 16 . HB2 1 1
138 1 1 1 1 13 CYS HA . 13 . HA 1 1
138 1 2 1 1 16 LEU HB3 . 16 . HB1 1 1
139 1 1 1 1 13 CYS HA . 13 . HA 1 1
139 1 2 1 1 17 SER H . 17 . HN 1 1
140 1 1 1 1 13 CYS HB2 . 13 . HB2 1 1
140 1 2 1 1 14 GLU H . 14 . HN 1 1
141 1 1 1 1 13 CYS HB3 . 13 . HB1 1 1
141 1 2 1 1 14 GLU H . 14 . HN 1 1
142 1 1 1 1 14 GLU H . 14 . HN 1 1
142 1 2 1 1 14 GLU HA . 14 . HA 1 1
143 1 1 1 1 14 GLU H . 14 . HN 1 1
143 1 2 1 1 14 GLU HB2 . 14 . HB2 1 1
144 1 1 1 1 14 GLU H . 14 . HN 1 1
144 1 2 1 1 14 GLU HB3 . 14 . HB1 1 1
145 1 1 1 1 14 GLU H . 14 . HN 1 1
145 1 2 1 1 15 VAL H . 15 . HN 1 1
146 1 1 1 1 14 GLU H . 14 . HN 1 1
146 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
147 1 1 1 1 14 GLU HA . 14 . HA 1 1
147 1 2 1 1 15 VAL H . 15 . HN 1 1
148 1 1 1 1 14 GLU HA . 14 . HA 1 1
148 1 2 1 1 16 LEU H . 16 . HN 1 1
149 1 1 1 1 14 GLU HB2 . 14 . HB2 1 1
149 1 2 1 1 15 VAL H . 15 . HN 1 1
150 1 1 1 1 14 GLU HB3 . 14 . HB1 1 1
150 1 2 1 1 15 VAL H . 15 . HN 1 1
151 1 1 1 1 15 VAL H . 15 . HN 1 1
151 1 2 1 1 15 VAL HA . 15 . HA 1 1
152 1 1 1 1 15 VAL H . 15 . HN 1 1
152 1 2 1 1 15 VAL HB . 15 . HB 1 1
153 1 1 1 1 15 VAL H . 15 . HN 1 1
153 1 2 1 1 15 VAL MG1 . 15 . HG1# 1 1
154 1 1 1 1 15 VAL H . 15 . HN 1 1
154 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1
155 1 1 1 1 15 VAL H . 15 . HN 1 1
155 1 2 1 1 16 LEU H . 16 . HN 1 1
156 1 1 1 1 15 VAL H . 15 . HN 1 1
156 1 2 1 1 17 SER H . 17 . HN 1 1
157 1 1 1 1 15 VAL HA . 15 . HA 1 1
157 1 2 1 1 15 VAL HB . 15 . HB 1 1
158 1 1 1 1 15 VAL HA . 15 . HA 1 1
158 1 2 1 1 16 LEU H . 16 . HN 1 1
159 1 1 1 1 15 VAL HA . 15 . HA 1 1
159 1 2 1 1 18 ASP H . 18 . HN 1 1
160 1 1 1 1 15 VAL HA . 15 . HA 1 1
160 1 2 1 1 18 ASP HB2 . 18 . HB2 1 1
161 1 1 1 1 15 VAL HA . 15 . HA 1 1
161 1 2 1 1 18 ASP HB3 . 18 . HB1 1 1
162 1 1 1 1 15 VAL HA . 15 . HA 1 1
162 1 2 1 1 19 PHE H . 19 . HN 1 1
163 1 1 1 1 15 VAL HB . 15 . HB 1 1
163 1 2 1 1 16 LEU H . 16 . HN 1 1
164 1 1 1 1 15 VAL MG1 . 15 . HG1# 1 1
164 1 2 1 1 16 LEU H . 16 . HN 1 1
165 1 1 1 1 15 VAL MG2 . 15 . HG2# 1 1
165 1 2 1 1 16 LEU H . 16 . HN 1 1
166 1 1 1 1 16 LEU H . 16 . HN 1 1
166 1 2 1 1 16 LEU HA . 16 . HA 1 1
167 1 1 1 1 16 LEU H . 16 . HN 1 1
167 1 2 1 1 16 LEU HB2 . 16 . HB2 1 1
168 1 1 1 1 16 LEU H . 16 . HN 1 1
168 1 2 1 1 16 LEU HB3 . 16 . HB1 1 1
169 1 1 1 1 16 LEU H . 16 . HN 1 1
169 1 2 1 1 17 SER H . 17 . HN 1 1
170 1 1 1 1 16 LEU H . 16 . HN 1 1
170 1 2 1 1 18 ASP H . 18 . HN 1 1
171 1 1 1 1 16 LEU HA . 16 . HA 1 1
171 1 2 1 1 16 LEU HB2 . 16 . HB2 1 1
172 1 1 1 1 16 LEU HA . 16 . HA 1 1
172 1 2 1 1 16 LEU HB3 . 16 . HB1 1 1
173 1 1 1 1 16 LEU HA . 16 . HA 1 1
173 1 2 1 1 17 SER H . 17 . HN 1 1
174 1 1 1 1 16 LEU HA . 16 . HA 1 1
174 1 2 1 1 19 PHE H . 19 . HN 1 1
175 1 1 1 1 16 LEU HA . 16 . HA 1 1
175 1 2 1 1 19 PHE HB2 . 19 . HB2 1 1
176 1 1 1 1 16 LEU HA . 16 . HA 1 1
176 1 2 1 1 19 PHE HB3 . 19 . HB1 1 1
177 1 1 1 1 16 LEU HA . 16 . HA 1 1
177 1 2 1 1 20 LYS H . 20 . HN 1 1
178 1 1 1 1 16 LEU HB2 . 16 . HB2 1 1
178 1 2 1 1 17 SER H . 17 . HN 1 1
179 1 1 1 1 16 LEU HB3 . 16 . HB1 1 1
179 1 2 1 1 17 SER H . 17 . HN 1 1
180 1 1 1 1 16 LEU QD . 16 . HD* 1 1
180 1 2 1 1 17 SER H . 17 . HN 1 1
181 1 1 1 1 17 SER H . 17 . HN 1 1
181 1 2 1 1 17 SER HA . 17 . HA 1 1
182 1 1 1 1 17 SER H . 17 . HN 1 1
182 1 2 1 1 17 SER HB2 . 17 . HB2 1 1
183 1 1 1 1 17 SER H . 17 . HN 1 1
183 1 2 1 1 17 SER HB3 . 17 . HB1 1 1
184 1 1 1 1 17 SER H . 17 . HN 1 1
184 1 2 1 1 18 ASP H . 18 . HN 1 1
185 1 1 1 1 17 SER H . 17 . HN 1 1
185 1 2 1 1 19 PHE H . 19 . HN 1 1
186 1 1 1 1 17 SER HA . 17 . HA 1 1
186 1 2 1 1 17 SER HB2 . 17 . HB2 1 1
187 1 1 1 1 17 SER HA . 17 . HA 1 1
187 1 2 1 1 17 SER HB3 . 17 . HB1 1 1
188 1 1 1 1 17 SER HA . 17 . HA 1 1
188 1 2 1 1 18 ASP H . 18 . HN 1 1
189 1 1 1 1 17 SER HA . 17 . HA 1 1
189 1 2 1 1 20 LYS H . 20 . HN 1 1
190 1 1 1 1 17 SER HA . 17 . HA 1 1
190 1 2 1 1 20 LYS HB2 . 20 . HB2 1 1
191 1 1 1 1 17 SER HA . 17 . HA 1 1
191 1 2 1 1 20 LYS HB3 . 20 . HB1 1 1
192 1 1 1 1 17 SER HA . 17 . HA 1 1
192 1 2 1 1 21 THR H . 21 . HN 1 1
193 1 1 1 1 17 SER HB2 . 17 . HB2 1 1
193 1 2 1 1 18 ASP H . 18 . HN 1 1
194 1 1 1 1 17 SER HB3 . 17 . HB1 1 1
194 1 2 1 1 18 ASP H . 18 . HN 1 1
195 1 1 1 1 18 ASP H . 18 . HN 1 1
195 1 2 1 1 18 ASP HA . 18 . HA 1 1
196 1 1 1 1 18 ASP H . 18 . HN 1 1
196 1 2 1 1 18 ASP HB2 . 18 . HB2 1 1
197 1 1 1 1 18 ASP H . 18 . HN 1 1
197 1 2 1 1 18 ASP HB3 . 18 . HB1 1 1
198 1 1 1 1 18 ASP H . 18 . HN 1 1
198 1 2 1 1 19 PHE H . 19 . HN 1 1
199 1 1 1 1 18 ASP H . 18 . HN 1 1
199 1 2 1 1 20 LYS H . 20 . HN 1 1
200 1 1 1 1 18 ASP HA . 18 . HA 1 1
200 1 2 1 1 19 PHE H . 19 . HN 1 1
201 1 1 1 1 18 ASP HA . 18 . HA 1 1
201 1 2 1 1 20 LYS H . 20 . HN 1 1
202 1 1 1 1 18 ASP HA . 18 . HA 1 1
202 1 2 1 1 21 THR H . 21 . HN 1 1
203 1 1 1 1 18 ASP HA . 18 . HA 1 1
203 1 2 1 1 21 THR HB . 21 . HB 1 1
204 1 1 1 1 18 ASP HB2 . 18 . HB2 1 1
204 1 2 1 1 19 PHE H . 19 . HN 1 1
205 1 1 1 1 18 ASP HB3 . 18 . HB1 1 1
205 1 2 1 1 19 PHE H . 19 . HN 1 1
206 1 1 1 1 19 PHE H . 19 . HN 1 1
206 1 2 1 1 19 PHE HA . 19 . HA 1 1
207 1 1 1 1 19 PHE H . 19 . HN 1 1
207 1 2 1 1 19 PHE HB2 . 19 . HB2 1 1
208 1 1 1 1 19 PHE H . 19 . HN 1 1
208 1 2 1 1 19 PHE HB3 . 19 . HB1 1 1
209 1 1 1 1 19 PHE H . 19 . HN 1 1
209 1 2 1 1 20 LYS H . 20 . HN 1 1
210 1 1 1 1 19 PHE H . 19 . HN 1 1
210 1 2 1 1 21 THR H . 21 . HN 1 1
211 1 1 1 1 19 PHE HA . 19 . HA 1 1
211 1 2 1 1 19 PHE QD . 19 . HD* 1 1
212 1 1 1 1 19 PHE HA . 19 . HA 1 1
212 1 2 1 1 20 LYS H . 20 . HN 1 1
213 1 1 1 1 19 PHE HA . 19 . HA 1 1
213 1 2 1 1 22 TRP QB . 22 . HB1 1 1
214 1 1 1 1 19 PHE HA . 19 . HA 1 1
214 1 2 1 1 22 TRP HE3 . 22 . HE3 1 1
215 1 1 1 1 19 PHE HA . 19 . HA 1 1
215 1 2 1 1 23 LEU H . 23 . HN 1 1
216 1 1 1 1 19 PHE HB2 . 19 . HB2 1 1
216 1 2 1 1 20 LYS H . 20 . HN 1 1
217 1 1 1 1 19 PHE HB3 . 19 . HB1 1 1
217 1 2 1 1 20 LYS H . 20 . HN 1 1
218 1 1 1 1 19 PHE QD . 19 . HD* 1 1
218 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1
219 1 1 1 1 19 PHE QD . 19 . HD* 1 1
219 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1
220 1 1 1 1 19 PHE QE . 19 . HE* 1 1
220 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1
221 1 1 1 1 19 PHE QE . 19 . HE* 1 1
221 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1
222 1 1 1 1 20 LYS H . 20 . HN 1 1
222 1 2 1 1 20 LYS HA . 20 . HA 1 1
223 1 1 1 1 20 LYS H . 20 . HN 1 1
223 1 2 1 1 20 LYS HB2 . 20 . HB2 1 1
224 1 1 1 1 20 LYS H . 20 . HN 1 1
224 1 2 1 1 20 LYS HB3 . 20 . HB1 1 1
225 1 1 1 1 20 LYS H . 20 . HN 1 1
225 1 2 1 1 21 THR H . 21 . HN 1 1
226 1 1 1 1 20 LYS HA . 20 . HA 1 1
226 1 2 1 1 20 LYS HB3 . 20 . HB1 1 1
227 1 1 1 1 20 LYS HA . 20 . HA 1 1
227 1 2 1 1 23 LEU H . 23 . HN 1 1
228 1 1 1 1 20 LYS HA . 20 . HA 1 1
228 1 2 1 1 23 LEU QB . 23 . HB# 1 1
229 1 1 1 1 20 LYS HB3 . 20 . HB1 1 1
229 1 2 1 1 21 THR H . 21 . HN 1 1
230 1 1 1 1 21 THR H . 21 . HN 1 1
230 1 2 1 1 21 THR HA . 21 . HA 1 1
231 1 1 1 1 21 THR H . 21 . HN 1 1
231 1 2 1 1 22 TRP H . 22 . HN 1 1
232 1 1 1 1 21 THR HA . 21 . HA 1 1
232 1 2 1 1 21 THR HB . 21 . HB 1 1
233 1 1 1 1 21 THR HA . 21 . HA 1 1
233 1 2 1 1 22 TRP H . 22 . HN 1 1
234 1 1 1 1 21 THR HA . 21 . HA 1 1
234 1 2 1 1 24 LYS H . 24 . HN 1 1
235 1 1 1 1 21 THR HA . 21 . HA 1 1
235 1 2 1 1 24 LYS QB . 24 . HB# 1 1
236 1 1 1 1 21 THR MG . 21 . HG2# 1 1
236 1 2 1 1 22 TRP H . 22 . HN 1 1
237 1 1 1 1 22 TRP H . 22 . HN 1 1
237 1 2 1 1 22 TRP HA . 22 . HA 1 1
238 1 1 1 1 22 TRP H . 22 . HN 1 1
238 1 2 1 1 22 TRP QB . 22 . HB1 1 1
239 1 1 1 1 22 TRP H . 22 . HN 1 1
239 1 2 1 1 23 LEU H . 23 . HN 1 1
240 1 1 1 1 22 TRP HA . 22 . HA 1 1
240 1 2 1 1 22 TRP HD1 . 22 . HD1 1 1
241 1 1 1 1 22 TRP HA . 22 . HA 1 1
241 1 2 1 1 22 TRP HE3 . 22 . HE3 1 1
242 1 1 1 1 22 TRP HA . 22 . HA 1 1
242 1 2 1 1 23 LEU H . 23 . HN 1 1
243 1 1 1 1 22 TRP HA . 22 . HA 1 1
243 1 2 1 1 24 LYS H . 24 . HN 1 1
244 1 1 1 1 22 TRP HA . 22 . HA 1 1
244 1 2 1 1 25 ALA H . 25 . HN 1 1
245 1 1 1 1 22 TRP HA . 22 . HA 1 1
245 1 2 1 1 25 ALA MB . 25 . HB# 1 1
246 1 1 1 1 22 TRP HA . 22 . HA 1 1
246 1 2 1 1 26 LYS H . 26 . HN 1 1
247 1 1 1 1 22 TRP QB . 22 . HB1 1 1
247 1 2 1 1 22 TRP HD1 . 22 . HD1 1 1
248 1 1 1 1 22 TRP QB . 22 . HB1 1 1
248 1 2 1 1 23 LEU H . 23 . HN 1 1
249 1 1 1 1 22 TRP HE3 . 22 . HE3 1 1
249 1 2 1 1 23 LEU HA . 23 . HA 1 1
250 1 1 1 1 22 TRP HE3 . 22 . HE3 1 1
250 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1
251 1 1 1 1 22 TRP HZ3 . 22 . HZ3 1 1
251 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1
252 1 1 1 1 22 TRP HZ3 . 22 . HZ3 1 1
252 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1
253 1 1 1 1 23 LEU H . 23 . HN 1 1
253 1 2 1 1 23 LEU QB . 23 . HB# 1 1
254 1 1 1 1 23 LEU H . 23 . HN 1 1
254 1 2 1 1 24 LYS H . 24 . HN 1 1
255 1 1 1 1 23 LEU H . 23 . HN 1 1
255 1 2 1 1 25 ALA H . 25 . HN 1 1
256 1 1 1 1 23 LEU HA . 23 . HA 1 1
256 1 2 1 1 24 LYS H . 24 . HN 1 1
257 1 1 1 1 23 LEU HA . 23 . HA 1 1
257 1 2 1 1 25 ALA H . 25 . HN 1 1
258 1 1 1 1 23 LEU HA . 23 . HA 1 1
258 1 2 1 1 26 LYS H . 26 . HN 1 1
259 1 1 1 1 23 LEU HA . 23 . HA 1 1
259 1 2 1 1 26 LYS QB . 26 . HB# 1 1
260 1 1 1 1 23 LEU HA . 23 . HA 1 1
260 1 2 1 1 27 LEU H . 27 . HN 1 1
261 1 1 1 1 23 LEU QB . 23 . HB# 1 1
261 1 2 1 1 24 LYS H . 24 . HN 1 1
262 1 1 1 1 24 LYS H . 24 . HN 1 1
262 1 2 1 1 24 LYS HA . 24 . HA 1 1
263 1 1 1 1 24 LYS H . 24 . HN 1 1
263 1 2 1 1 24 LYS QB . 24 . HB# 1 1
264 1 1 1 1 24 LYS H . 24 . HN 1 1
264 1 2 1 1 25 ALA H . 25 . HN 1 1
265 1 1 1 1 24 LYS HA . 24 . HA 1 1
265 1 2 1 1 25 ALA H . 25 . HN 1 1
266 1 1 1 1 24 LYS HA . 24 . HA 1 1
266 1 2 1 1 26 LYS H . 26 . HN 1 1
267 1 1 1 1 24 LYS HA . 24 . HA 1 1
267 1 2 1 1 27 LEU H . 27 . HN 1 1
268 1 1 1 1 24 LYS QB . 24 . HB# 1 1
268 1 2 1 1 25 ALA H . 25 . HN 1 1
269 1 1 1 1 25 ALA H . 25 . HN 1 1
269 1 2 1 1 25 ALA HA . 25 . HA 1 1
270 1 1 1 1 25 ALA H . 25 . HN 1 1
270 1 2 1 1 25 ALA MB . 25 . HB# 1 1
271 1 1 1 1 25 ALA HA . 25 . HA 1 1
271 1 2 1 1 26 LYS H . 26 . HN 1 1
272 1 1 1 1 25 ALA HA . 25 . HA 1 1
272 1 2 1 1 27 LEU H . 27 . HN 1 1
273 1 1 1 1 25 ALA HA . 25 . HA 1 1
273 1 2 1 1 28 MET QB . 28 . HB# 1 1
274 1 1 1 1 25 ALA MB . 25 . HB# 1 1
274 1 2 1 1 26 LYS H . 26 . HN 1 1
275 1 1 1 1 26 LYS H . 26 . HN 1 1
275 1 2 1 1 26 LYS HA . 26 . HA 1 1
276 1 1 1 1 26 LYS H . 26 . HN 1 1
276 1 2 1 1 26 LYS QB . 26 . HB# 1 1
277 1 1 1 1 26 LYS H . 26 . HN 1 1
277 1 2 1 1 26 LYS HG2 . 26 . HG2 1 1
278 1 1 1 1 26 LYS H . 26 . HN 1 1
278 1 2 1 1 26 LYS HG3 . 26 . HG1 1 1
279 1 1 1 1 26 LYS HA . 26 . HA 1 1
279 1 2 1 1 27 LEU H . 27 . HN 1 1
280 1 1 1 1 26 LYS QB . 26 . HB# 1 1
280 1 2 1 1 27 LEU H . 27 . HN 1 1
281 1 1 1 1 27 LEU H . 27 . HN 1 1
281 1 2 1 1 27 LEU HA . 27 . HA 1 1
282 1 1 1 1 27 LEU H . 27 . HN 1 1
282 1 2 1 1 27 LEU HB2 . 27 . HB2 1 1
283 1 1 1 1 27 LEU H . 27 . HN 1 1
283 1 2 1 1 27 LEU HB3 . 27 . HB1 1 1
284 1 1 1 1 27 LEU HA . 27 . HA 1 1
284 1 2 1 1 27 LEU HB3 . 27 . HB1 1 1
285 1 1 1 1 27 LEU HA . 27 . HA 1 1
285 1 2 1 1 28 MET H . 28 . HN 1 1
286 1 1 1 1 27 LEU HB2 . 27 . HB2 1 1
286 1 2 1 1 28 MET H . 28 . HN 1 1
287 1 1 1 1 27 LEU HB3 . 27 . HB1 1 1
287 1 2 1 1 28 MET H . 28 . HN 1 1
288 1 1 1 1 28 MET H . 28 . HN 1 1
288 1 2 1 1 28 MET QB . 28 . HB# 1 1
289 1 1 1 1 28 MET HA . 28 . HA 1 1
289 1 2 1 1 29 PRO HD2 . 29 . HD2 1 1
290 1 1 1 1 28 MET HA . 28 . HA 1 1
290 1 2 1 1 29 PRO HD3 . 29 . HD1 1 1
291 1 1 1 1 28 MET HA . 28 . HA 1 1
291 1 2 1 1 29 PRO QG . 29 . HG# 1 1
292 1 1 1 1 28 MET QB . 28 . HB# 1 1
292 1 2 1 1 29 PRO HD2 . 29 . HD2 1 1
293 1 1 1 1 28 MET QB . 28 . HB# 1 1
293 1 2 1 1 29 PRO HD3 . 29 . HD1 1 1
294 1 1 1 1 29 PRO HA . 29 . HA 1 1
294 1 2 1 1 29 PRO HB3 . 29 . HB1 1 1
295 1 1 1 1 29 PRO HB2 . 29 . HB2 1 1
295 1 2 1 1 30 GLN H . 30 . HN 1 1
296 1 1 1 1 29 PRO HB3 . 29 . HB1 1 1
296 1 2 1 1 30 GLN H . 30 . HN 1 1
297 1 1 1 1 30 GLN H . 30 . HN 1 1
297 1 2 1 1 30 GLN HA . 30 . HA 1 1
298 1 1 1 1 30 GLN H . 30 . HN 1 1
298 1 2 1 1 30 GLN HB3 . 30 . HB1 1 1
299 1 1 1 1 31 LEU H . 31 . HN 1 1
299 1 2 1 1 31 LEU HA . 31 . HA 1 1
300 1 1 1 1 31 LEU H . 31 . HN 1 1
300 1 2 1 1 31 LEU QB . 31 . HB# 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.0 1.8 5.5 1 1
2 1 . . . . . 5.0 1.8 5.5 1 1
3 1 . . . . . 2.8 1.8 3.08 1 1
4 1 . . . . . 3.9 1.8 4.29 1 1
5 1 . . . . . 2.8 1.8 3.08 1 1
6 1 . . . . . 2.8 1.8 3.08 1 1
7 1 . . . . . 5.0 1.8 5.5 1 1
8 1 . . . . . 2.8 1.8 3.08 1 1
9 1 . . . . . 2.8 1.8 3.08 1 1
10 1 . . . . . 2.8 1.8 3.08 1 1
11 1 . . . . . 5.0 1.8 5.5 1 1
12 1 . . . . . 3.9 1.8 4.29 1 1
13 1 . . . . . 2.8 1.8 3.08 1 1
14 1 . . . . . 5.0 1.8 5.5 1 1
15 1 . . . . . 5.0 1.8 5.5 1 1
16 1 . . . . . 5.0 1.8 5.5 1 1
17 1 . . . . . 5.0 1.8 5.5 1 1
18 1 . . . . . 3.9 1.8 4.29 1 1
19 1 . . . . . 2.8 1.8 3.08 1 1
20 1 . . . . . 3.9 1.8 4.29 1 1
21 1 . . . . . 3.9 1.8 4.29 1 1
22 1 . . . . . 3.9 1.8 4.29 1 1
23 1 . . . . . 2.8 1.8 3.08 1 1
24 1 . . . . . 5.0 1.8 5.5 1 1
25 1 . . . . . 2.8 1.8 4.08 1 1
26 1 . . . . . 5.0 1.8 5.5 1 1
27 1 . . . . . 2.8 1.8 3.08 1 1
28 1 . . . . . 3.9 1.8 4.29 1 1
29 1 . . . . . 2.8 1.8 3.08 1 1
30 1 . . . . . 3.9 1.8 4.29 1 1
31 1 . . . . . 3.9 1.8 4.29 1 1
32 1 . . . . . 2.8 1.8 3.08 1 1
33 1 . . . . . 5.0 1.8 5.5 1 1
34 1 . . . . . 5.0 1.8 5.5 1 1
35 1 . . . . . 3.9 1.8 4.29 1 1
36 1 . . . . . 2.8 1.8 3.08 1 1
37 1 . . . . . 2.8 1.8 3.08 1 1
38 1 . . . . . 2.8 1.8 3.08 1 1
39 1 . . . . . 3.9 1.8 5.29 1 1
40 1 . . . . . 2.8 1.8 3.08 1 1
41 1 . . . . . 2.8 1.8 3.08 1 1
42 1 . . . . . 3.9 1.8 4.29 1 1
43 1 . . . . . 3.9 1.8 4.29 1 1
44 1 . . . . . 2.8 1.8 4.08 1 1
45 1 . . . . . 5.0 1.8 5.5 1 1
46 1 . . . . . 2.8 1.8 3.08 1 1
47 1 . . . . . 2.8 1.8 3.08 1 1
48 1 . . . . . 3.9 1.8 4.29 1 1
49 1 . . . . . 2.8 1.8 3.08 1 1
50 1 . . . . . 5.0 1.8 5.5 1 1
51 1 . . . . . 3.9 1.8 4.29 1 1
52 1 . . . . . 2.8 1.8 3.08 1 1
53 1 . . . . . 2.8 1.8 3.08 1 1
54 1 . . . . . 3.9 1.8 4.29 1 1
55 1 . . . . . 5.0 1.8 5.5 1 1
56 1 . . . . . 3.9 1.8 4.29 1 1
57 1 . . . . . 3.9 1.8 4.29 1 1
58 1 . . . . . 2.8 1.8 3.08 1 1
59 1 . . . . . 5.0 1.8 5.5 1 1
60 1 . . . . . 5.0 1.8 6.5 1 1
61 1 . . . . . 3.9 1.8 4.29 1 1
62 1 . . . . . 5.0 1.8 6.5 1 1
63 1 . . . . . 5.0 1.8 6.5 1 1
64 1 . . . . . 3.9 1.8 5.29 1 1
65 1 . . . . . 2.8 1.8 4.08 1 1
66 1 . . . . . 2.8 1.8 3.08 1 1
67 1 . . . . . 2.8 1.8 3.08 1 1
68 1 . . . . . 3.9 1.8 4.29 1 1
69 1 . . . . . 3.9 1.8 4.29 1 1
70 1 . . . . . 2.8 1.8 3.08 1 1
71 1 . . . . . 2.8 1.8 4.08 1 1
72 1 . . . . . 2.8 1.8 4.08 1 1
73 1 . . . . . 2.8 1.8 4.08 1 1
74 1 . . . . . 2.8 1.8 4.08 1 1
75 1 . . . . . 3.9 1.8 5.29 1 1
76 1 . . . . . 2.8 1.8 3.08 1 1
77 1 . . . . . 3.9 1.8 4.29 1 1
78 1 . . . . . 2.8 1.8 3.08 1 1
79 1 . . . . . 3.9 1.8 4.29 1 1
80 1 . . . . . 2.8 1.8 3.08 1 1
81 1 . . . . . 5.0 1.8 5.5 1 1
82 1 . . . . . 3.9 1.8 4.29 1 1
83 1 . . . . . 3.9 1.8 4.29 1 1
84 1 . . . . . 2.8 1.8 3.08 1 1
85 1 . . . . . 5.0 1.8 5.5 1 1
86 1 . . . . . 3.9 1.8 4.29 1 1
87 1 . . . . . 2.8 1.8 3.08 1 1
88 1 . . . . . 2.8 1.8 3.08 1 1
89 1 . . . . . 2.8 1.8 3.08 1 1
90 1 . . . . . 3.9 1.8 4.29 1 1
91 1 . . . . . 5.0 1.8 5.5 1 1
92 1 . . . . . 2.8 1.8 3.08 1 1
93 1 . . . . . 3.9 1.8 4.29 1 1
94 1 . . . . . 5.0 1.8 5.5 1 1
95 1 . . . . . 3.9 1.8 4.29 1 1
96 1 . . . . . 2.8 1.8 3.08 1 1
97 1 . . . . . 3.9 1.8 4.29 1 1
98 1 . . . . . 5.0 1.8 5.5 1 1
99 1 . . . . . 5.0 1.8 5.5 1 1
100 1 . . . . . 2.8 1.8 3.08 1 1
101 1 . . . . . 3.9 1.8 4.29 1 1
102 1 . . . . . 3.9 1.8 4.29 1 1
103 1 . . . . . 3.9 1.8 4.29 1 1
104 1 . . . . . 3.9 1.8 4.29 1 1
105 1 . . . . . 5.0 1.8 5.5 1 1
106 1 . . . . . 3.9 1.8 5.29 1 1
107 1 . . . . . 3.9 1.8 5.29 1 1
108 1 . . . . . 3.9 1.8 5.29 1 1
109 1 . . . . . 5.0 1.8 5.5 1 1
110 1 . . . . . 5.0 1.8 6.5 1 1
111 1 . . . . . 5.0 1.8 6.5 1 1
112 1 . . . . . 3.9 1.8 5.29 1 1
113 1 . . . . . 2.8 1.8 3.08 1 1
114 1 . . . . . 2.8 1.8 3.08 1 1
115 1 . . . . . 5.0 1.8 6.5 1 1
116 1 . . . . . 3.9 1.8 5.29 1 1
117 1 . . . . . 2.8 1.8 3.08 1 1
118 1 . . . . . 2.8 1.8 3.08 1 1
119 1 . . . . . 3.9 1.8 4.29 1 1
120 1 . . . . . 3.9 1.8 4.29 1 1
121 1 . . . . . 2.8 1.8 3.08 1 1
122 1 . . . . . 3.9 1.8 5.29 1 1
123 1 . . . . . 2.8 1.8 4.08 1 1
124 1 . . . . . 5.0 1.8 5.5 1 1
125 1 . . . . . 2.8 1.8 3.08 1 1
126 1 . . . . . 5.0 1.8 5.5 1 1
127 1 . . . . . 2.8 1.8 3.08 1 1
128 1 . . . . . 3.9 1.8 4.29 1 1
129 1 . . . . . 2.8 1.8 3.08 1 1
130 1 . . . . . 5.0 1.8 5.5 1 1
131 1 . . . . . 3.9 1.8 4.29 1 1
132 1 . . . . . 5.0 1.8 5.5 1 1
133 1 . . . . . 2.8 1.8 3.08 1 1
134 1 . . . . . 2.8 1.8 3.08 1 1
135 1 . . . . . 3.9 1.8 4.29 1 1
136 1 . . . . . 3.9 1.8 4.29 1 1
137 1 . . . . . 3.9 1.8 4.29 1 1
138 1 . . . . . 2.8 1.8 3.08 1 1
139 1 . . . . . 5.0 1.8 5.5 1 1
140 1 . . . . . 3.9 1.8 4.29 1 1
141 1 . . . . . 3.9 1.8 4.29 1 1
142 1 . . . . . 2.8 1.8 3.08 1 1
143 1 . . . . . 3.9 1.8 4.29 1 1
144 1 . . . . . 2.8 1.8 3.08 1 1
145 1 . . . . . 2.8 1.8 3.08 1 1
146 1 . . . . . 5.0 1.8 6.5 1 1
147 1 . . . . . 2.8 1.8 3.08 1 1
148 1 . . . . . 5.0 1.8 5.5 1 1
149 1 . . . . . 2.8 1.8 3.08 1 1
150 1 . . . . . 2.8 1.8 3.08 1 1
151 1 . . . . . 2.8 1.8 3.08 1 1
152 1 . . . . . 2.8 1.8 3.08 1 1
153 1 . . . . . 3.9 1.8 5.29 1 1
154 1 . . . . . 2.8 1.8 4.08 1 1
155 1 . . . . . 3.9 1.8 4.29 1 1
156 1 . . . . . 5.0 1.8 5.5 1 1
157 1 . . . . . 2.8 1.8 3.08 1 1
158 1 . . . . . 3.9 1.8 4.29 1 1
159 1 . . . . . 3.9 1.8 4.29 1 1
160 1 . . . . . 3.9 1.8 4.29 1 1
161 1 . . . . . 2.8 1.8 3.08 1 1
162 1 . . . . . 5.0 1.8 5.5 1 1
163 1 . . . . . 2.8 1.8 3.08 1 1
164 1 . . . . . 3.9 1.8 5.29 1 1
165 1 . . . . . 5.0 1.8 6.5 1 1
166 1 . . . . . 2.8 1.8 3.08 1 1
167 1 . . . . . 3.9 1.8 4.29 1 1
168 1 . . . . . 2.8 1.8 3.08 1 1
169 1 . . . . . 2.8 1.8 3.08 1 1
170 1 . . . . . 5.0 1.8 5.5 1 1
171 1 . . . . . 2.8 1.8 3.08 1 1
172 1 . . . . . 2.8 1.8 3.08 1 1
173 1 . . . . . 3.9 1.8 4.29 1 1
174 1 . . . . . 3.9 1.8 4.29 1 1
175 1 . . . . . 2.8 1.8 3.08 1 1
176 1 . . . . . 3.9 1.8 4.29 1 1
177 1 . . . . . 5.0 1.8 5.5 1 1
178 1 . . . . . 3.9 1.8 4.29 1 1
179 1 . . . . . 2.8 1.8 3.08 1 1
180 1 . . . . . 3.9 1.8 6.29 1 1
181 1 . . . . . 2.8 1.8 3.08 1 1
182 1 . . . . . 3.9 1.8 4.29 1 1
183 1 . . . . . 3.9 1.8 4.29 1 1
184 1 . . . . . 2.8 1.8 3.08 1 1
185 1 . . . . . 5.0 1.8 5.5 1 1
186 1 . . . . . 2.8 1.8 3.08 1 1
187 1 . . . . . 2.8 1.8 3.08 1 1
188 1 . . . . . 3.9 1.8 4.29 1 1
189 1 . . . . . 3.9 1.8 4.29 1 1
190 1 . . . . . 5.0 1.8 5.5 1 1
191 1 . . . . . 3.9 1.8 4.29 1 1
192 1 . . . . . 5.0 1.8 5.5 1 1
193 1 . . . . . 5.0 1.8 5.5 1 1
194 1 . . . . . 3.9 1.8 4.29 1 1
195 1 . . . . . 2.8 1.8 3.08 1 1
196 1 . . . . . 3.9 1.8 4.29 1 1
197 1 . . . . . 2.8 1.8 3.08 1 1
198 1 . . . . . 2.8 1.8 3.08 1 1
199 1 . . . . . 5.0 1.8 5.5 1 1
200 1 . . . . . 3.9 1.8 4.29 1 1
201 1 . . . . . 5.0 1.8 5.5 1 1
202 1 . . . . . 2.8 1.8 3.08 1 1
203 1 . . . . . 3.9 1.8 4.29 1 1
204 1 . . . . . 5.0 1.8 5.5 1 1
205 1 . . . . . 2.8 1.8 3.08 1 1
206 1 . . . . . 2.8 1.8 3.08 1 1
207 1 . . . . . 3.9 1.8 4.29 1 1
208 1 . . . . . 2.8 1.8 3.08 1 1
209 1 . . . . . 2.8 1.8 3.08 1 1
210 1 . . . . . 5.0 1.8 5.5 1 1
211 1 . . . . . 2.8 1.8 5.08 1 1
212 1 . . . . . 5.0 1.8 5.5 1 1
213 1 . . . . . . 1.8 4.29 1 1
214 1 . . . . . 5.0 1.8 5.5 1 1
215 1 . . . . . 5.0 1.8 5.5 1 1
216 1 . . . . . 2.8 1.8 3.08 1 1
217 1 . . . . . 3.9 1.8 4.29 1 1
218 1 . . . . . 5.0 1.8 8.5 1 1
219 1 . . . . . 5.0 1.8 8.5 1 1
220 1 . . . . . 2.8 1.8 6.08 1 1
221 1 . . . . . 3.9 1.8 7.29 1 1
222 1 . . . . . 2.8 1.8 3.08 1 1
223 1 . . . . . 2.8 1.8 3.08 1 1
224 1 . . . . . 3.9 1.8 4.29 1 1
225 1 . . . . . 2.8 1.8 3.08 1 1
226 1 . . . . . 2.8 1.8 3.08 1 1
227 1 . . . . . 3.9 1.8 4.29 1 1
228 1 . . . . . 2.8 1.8 4.08 1 1
229 1 . . . . . 5.0 1.8 5.5 1 1
230 1 . . . . . 2.8 1.8 3.08 1 1
231 1 . . . . . 3.9 1.8 4.29 1 1
232 1 . . . . . 2.8 1.8 3.08 1 1
233 1 . . . . . 3.9 1.8 4.29 1 1
234 1 . . . . . 2.8 1.8 3.08 1 1
235 1 . . . . . 2.8 1.8 4.08 1 1
236 1 . . . . . 5.0 1.8 6.5 1 1
237 1 . . . . . 2.8 1.8 3.08 1 1
238 1 . . . . . . 1.8 3.08 1 1
239 1 . . . . . 3.9 1.8 4.29 1 1
240 1 . . . . . 3.9 1.8 4.29 1 1
241 1 . . . . . 5.0 1.8 5.5 1 1
242 1 . . . . . 3.9 1.8 4.29 1 1
243 1 . . . . . 5.0 1.8 5.5 1 1
244 1 . . . . . 3.9 1.8 4.29 1 1
245 1 . . . . . 2.8 1.8 4.08 1 1
246 1 . . . . . 5.0 1.8 5.5 1 1
247 1 . . . . . . 1.8 3.08 1 1
248 1 . . . . . . 1.8 3.08 1 1
249 1 . . . . . 2.8 1.8 3.08 1 1
250 1 . . . . . 5.0 1.8 6.5 1 1
251 1 . . . . . 5.0 1.8 6.5 1 1
252 1 . . . . . 5.0 1.8 6.5 1 1
253 1 . . . . . 2.8 1.8 4.08 1 1
254 1 . . . . . 3.9 1.8 4.29 1 1
255 1 . . . . . 5.0 1.8 5.5 1 1
256 1 . . . . . 3.9 1.8 4.29 1 1
257 1 . . . . . 5.0 1.8 5.5 1 1
258 1 . . . . . 3.9 1.8 4.29 1 1
259 1 . . . . . 2.8 1.8 4.08 1 1
260 1 . . . . . 5.0 1.8 5.5 1 1
261 1 . . . . . 2.8 1.8 4.08 1 1
262 1 . . . . . 2.8 1.8 3.08 1 1
263 1 . . . . . 2.8 1.8 4.08 1 1
264 1 . . . . . 2.8 1.8 3.08 1 1
265 1 . . . . . 3.9 1.8 4.29 1 1
266 1 . . . . . 5.0 1.8 5.5 1 1
267 1 . . . . . 3.9 1.8 4.29 1 1
268 1 . . . . . 2.8 1.8 4.08 1 1
269 1 . . . . . 2.8 1.8 3.08 1 1
270 1 . . . . . 2.8 1.8 4.08 1 1
271 1 . . . . . 3.9 1.8 4.29 1 1
272 1 . . . . . 5.0 1.8 5.5 1 1
273 1 . . . . . 3.9 1.8 5.29 1 1
274 1 . . . . . 2.8 1.8 4.08 1 1
275 1 . . . . . 2.8 1.8 3.08 1 1
276 1 . . . . . 2.8 1.8 4.08 1 1
277 1 . . . . . 5.0 1.8 5.5 1 1
278 1 . . . . . 3.9 1.8 4.29 1 1
279 1 . . . . . 3.9 1.8 4.29 1 1
280 1 . . . . . 2.8 1.8 4.08 1 1
281 1 . . . . . 2.8 1.8 3.08 1 1
282 1 . . . . . 3.9 1.8 4.29 1 1
283 1 . . . . . 2.8 1.8 3.08 1 1
284 1 . . . . . 2.8 1.8 3.08 1 1
285 1 . . . . . 3.9 1.8 4.29 1 1
286 1 . . . . . 3.9 1.8 4.29 1 1
287 1 . . . . . 3.9 1.8 4.29 1 1
288 1 . . . . . 2.8 1.8 4.08 1 1
289 1 . . . . . 5.0 1.8 5.5 1 1
290 1 . . . . . 5.0 1.8 5.5 1 1
291 1 . . . . . 5.0 1.8 6.5 1 1
292 1 . . . . . 3.9 1.8 5.29 1 1
293 1 . . . . . 3.9 1.8 5.29 1 1
294 1 . . . . . 2.8 1.8 3.08 1 1
295 1 . . . . . 2.8 1.8 3.08 1 1
296 1 . . . . . 2.8 1.8 3.08 1 1
297 1 . . . . . 2.8 1.8 3.08 1 1
298 1 . . . . . 3.9 1.8 4.29 1 1
299 1 . . . . . 2.8 1.8 3.08 1 1
300 1 . . . . . 2.8 1.8 4.08 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 SER C C -24.055 5.750 -5.699 1.00 . A A . 1 SER C 1 1
1 2 1 1 1 SER CA C -24.717 7.134 -5.764 1.00 . A A . 1 SER CA 1 1
1 3 1 1 1 SER CB C -25.806 7.262 -4.693 1.00 . A A . 1 SER CB 1 1
1 4 1 1 1 SER H1 H -25.801 8.281 -7.132 1.00 . A A . 1 SER H1 1 1
1 5 1 1 1 SER H2 H -26.211 6.631 -7.135 1.00 . A A . 1 SER H2 1 1
1 6 1 1 1 SER H3 H -24.761 7.151 -7.852 1.00 . A A . 1 SER H3 1 1
1 7 1 1 1 SER HA H -23.979 7.909 -5.631 1.00 . A A . 1 SER HA 1 1
1 8 1 1 1 SER HB2 H -25.412 6.954 -3.739 1.00 . A A . 1 SER HB2 1 1
1 9 1 1 1 SER HB3 H -26.125 8.295 -4.629 1.00 . A A . 1 SER HB3 1 1
1 10 1 1 1 SER HG H -27.540 6.463 -4.309 1.00 . A A . 1 SER HG 1 1
1 11 1 1 1 SER N N -25.426 7.313 -7.069 1.00 . A A . 1 SER N 1 1
1 12 1 1 1 SER O O -24.283 4.902 -6.542 1.00 . A A . 1 SER O 1 1
1 13 1 1 1 SER OG O -26.910 6.432 -5.033 1.00 . A A . 1 SER OG 1 1
1 14 1 1 2 GLY C C -21.708 4.160 -3.299 1.00 . A A . 2 GLY C 1 1
1 15 1 1 2 GLY CA C -22.554 4.192 -4.577 1.00 . A A . 2 GLY CA 1 1
1 16 1 1 2 GLY H H -23.066 6.217 -4.035 1.00 . A A . 2 GLY H 1 1
1 17 1 1 2 GLY HA2 H -23.299 3.409 -4.536 1.00 . A A . 2 GLY HA2 1 1
1 18 1 1 2 GLY HA3 H -21.914 4.034 -5.432 1.00 . A A . 2 GLY HA3 1 1
1 19 1 1 2 GLY N N -23.235 5.518 -4.702 1.00 . A A . 2 GLY N 1 1
1 20 1 1 2 GLY O O -21.946 4.907 -2.368 1.00 . A A . 2 GLY O 1 1
1 21 1 1 3 SER C C -18.430 3.700 -2.367 1.00 . A A . 3 SER C 1 1
1 22 1 1 3 SER CA C -19.850 3.216 -2.035 1.00 . A A . 3 SER CA 1 1
1 23 1 1 3 SER CB C -19.851 1.731 -1.651 1.00 . A A . 3 SER CB 1 1
1 24 1 1 3 SER H H -20.546 2.711 -4.014 1.00 . A A . 3 SER H 1 1
1 25 1 1 3 SER HA H -20.268 3.803 -1.232 1.00 . A A . 3 SER HA 1 1
1 26 1 1 3 SER HB2 H -20.716 1.248 -2.075 1.00 . A A . 3 SER HB2 1 1
1 27 1 1 3 SER HB3 H -18.956 1.260 -2.037 1.00 . A A . 3 SER HB3 1 1
1 28 1 1 3 SER HG H -20.818 1.585 0.034 1.00 . A A . 3 SER HG 1 1
1 29 1 1 3 SER N N -20.719 3.301 -3.250 1.00 . A A . 3 SER N 1 1
1 30 1 1 3 SER O O -17.484 2.933 -2.362 1.00 . A A . 3 SER O 1 1
1 31 1 1 3 SER OG O -19.895 1.608 -0.234 1.00 . A A . 3 SER OG 1 1
1 32 1 1 4 TRP C C -15.989 5.422 -1.767 1.00 . A A . 4 TRP C 1 1
1 33 1 1 4 TRP CA C -16.918 5.515 -2.985 1.00 . A A . 4 TRP CA 1 1
1 34 1 1 4 TRP CB C -17.147 6.978 -3.380 1.00 . A A . 4 TRP CB 1 1
1 35 1 1 4 TRP CD1 C -17.438 7.090 -5.889 1.00 . A A . 4 TRP CD1 1 1
1 36 1 1 4 TRP CD2 C -15.331 7.539 -5.241 1.00 . A A . 4 TRP CD2 1 1
1 37 1 1 4 TRP CE2 C -15.351 7.636 -6.652 1.00 . A A . 4 TRP CE2 1 1
1 38 1 1 4 TRP CE3 C -14.115 7.778 -4.576 1.00 . A A . 4 TRP CE3 1 1
1 39 1 1 4 TRP CG C -16.669 7.193 -4.780 1.00 . A A . 4 TRP CG 1 1
1 40 1 1 4 TRP CH2 C -13.003 8.192 -6.703 1.00 . A A . 4 TRP CH2 1 1
1 41 1 1 4 TRP CZ2 C -14.204 7.958 -7.379 1.00 . A A . 4 TRP CZ2 1 1
1 42 1 1 4 TRP CZ3 C -12.959 8.102 -5.304 1.00 . A A . 4 TRP CZ3 1 1
1 43 1 1 4 TRP H H -19.054 5.569 -2.647 1.00 . A A . 4 TRP H 1 1
1 44 1 1 4 TRP HA H -16.495 4.973 -3.816 1.00 . A A . 4 TRP HA 1 1
1 45 1 1 4 TRP HB2 H -18.200 7.210 -3.319 1.00 . A A . 4 TRP HB2 1 1
1 46 1 1 4 TRP HB3 H -16.598 7.623 -2.710 1.00 . A A . 4 TRP HB3 1 1
1 47 1 1 4 TRP HD1 H -18.489 6.843 -5.904 1.00 . A A . 4 TRP HD1 1 1
1 48 1 1 4 TRP HE1 H -16.971 7.344 -7.927 1.00 . A A . 4 TRP HE1 1 1
1 49 1 1 4 TRP HE3 H -14.070 7.711 -3.500 1.00 . A A . 4 TRP HE3 1 1
1 50 1 1 4 TRP HH2 H -12.110 8.441 -7.257 1.00 . A A . 4 TRP HH2 1 1
1 51 1 1 4 TRP HZ2 H -14.244 8.026 -8.456 1.00 . A A . 4 TRP HZ2 1 1
1 52 1 1 4 TRP HZ3 H -12.030 8.283 -4.784 1.00 . A A . 4 TRP HZ3 1 1
1 53 1 1 4 TRP N N -18.276 4.972 -2.652 1.00 . A A . 4 TRP N 1 1
1 54 1 1 4 TRP NE1 N -16.656 7.353 -7.000 1.00 . A A . 4 TRP NE1 1 1
1 55 1 1 4 TRP O O -14.815 5.129 -1.898 1.00 . A A . 4 TRP O 1 1
1 56 1 1 5 LEU C C -15.085 4.148 0.772 1.00 . A A . 5 LEU C 1 1
1 57 1 1 5 LEU CA C -15.660 5.566 0.648 1.00 . A A . 5 LEU CA 1 1
1 58 1 1 5 LEU CB C -16.609 5.870 1.813 1.00 . A A . 5 LEU CB 1 1
1 59 1 1 5 LEU CD1 C -16.259 7.267 3.861 1.00 . A A . 5 LEU CD1 1 1
1 60 1 1 5 LEU CD2 C -16.040 4.782 3.993 1.00 . A A . 5 LEU CD2 1 1
1 61 1 1 5 LEU CG C -15.806 6.012 3.111 1.00 . A A . 5 LEU CG 1 1
1 62 1 1 5 LEU H H -17.460 5.883 -0.504 1.00 . A A . 5 LEU H 1 1
1 63 1 1 5 LEU HA H -14.866 6.295 0.615 1.00 . A A . 5 LEU HA 1 1
1 64 1 1 5 LEU HB2 H -17.138 6.791 1.614 1.00 . A A . 5 LEU HB2 1 1
1 65 1 1 5 LEU HB3 H -17.319 5.063 1.918 1.00 . A A . 5 LEU HB3 1 1
1 66 1 1 5 LEU HD11 H -15.614 7.430 4.712 1.00 . A A . 5 LEU HD11 1 1
1 67 1 1 5 LEU HD12 H -17.276 7.137 4.201 1.00 . A A . 5 LEU HD12 1 1
1 68 1 1 5 LEU HD13 H -16.205 8.120 3.201 1.00 . A A . 5 LEU HD13 1 1
1 69 1 1 5 LEU HD21 H -15.444 4.864 4.890 1.00 . A A . 5 LEU HD21 1 1
1 70 1 1 5 LEU HD22 H -15.756 3.891 3.452 1.00 . A A . 5 LEU HD22 1 1
1 71 1 1 5 LEU HD23 H -17.086 4.723 4.260 1.00 . A A . 5 LEU HD23 1 1
1 72 1 1 5 LEU HG H -14.754 6.094 2.877 1.00 . A A . 5 LEU HG 1 1
1 73 1 1 5 LEU N N -16.509 5.657 -0.583 1.00 . A A . 5 LEU N 1 1
1 74 1 1 5 LEU O O -13.912 3.964 1.038 1.00 . A A . 5 LEU O 1 1
1 75 1 1 6 ARG C C -14.470 1.451 -0.528 1.00 . A A . 6 ARG C 1 1
1 76 1 1 6 ARG CA C -15.425 1.738 0.638 1.00 . A A . 6 ARG CA 1 1
1 77 1 1 6 ARG CB C -16.687 0.877 0.526 1.00 . A A . 6 ARG CB 1 1
1 78 1 1 6 ARG CD C -17.446 -1.346 1.387 1.00 . A A . 6 ARG CD 1 1
1 79 1 1 6 ARG CG C -16.317 -0.602 0.668 1.00 . A A . 6 ARG CG 1 1
1 80 1 1 6 ARG CZ C -17.599 -3.753 1.636 1.00 . A A . 6 ARG CZ 1 1
1 81 1 1 6 ARG H H -16.844 3.331 0.331 1.00 . A A . 6 ARG H 1 1
1 82 1 1 6 ARG HA H -14.934 1.558 1.582 1.00 . A A . 6 ARG HA 1 1
1 83 1 1 6 ARG HB2 H -17.380 1.153 1.309 1.00 . A A . 6 ARG HB2 1 1
1 84 1 1 6 ARG HB3 H -17.149 1.039 -0.436 1.00 . A A . 6 ARG HB3 1 1
1 85 1 1 6 ARG HD2 H -17.735 -0.812 2.282 1.00 . A A . 6 ARG HD2 1 1
1 86 1 1 6 ARG HD3 H -18.293 -1.471 0.730 1.00 . A A . 6 ARG HD3 1 1
1 87 1 1 6 ARG HE H -15.937 -2.740 2.037 1.00 . A A . 6 ARG HE 1 1
1 88 1 1 6 ARG HG2 H -16.170 -1.031 -0.313 1.00 . A A . 6 ARG HG2 1 1
1 89 1 1 6 ARG HG3 H -15.407 -0.692 1.241 1.00 . A A . 6 ARG HG3 1 1
1 90 1 1 6 ARG HH11 H -18.629 -3.393 3.317 1.00 . A A . 6 ARG HH11 1 1
1 91 1 1 6 ARG HH12 H -19.060 -4.843 2.474 1.00 . A A . 6 ARG HH12 1 1
1 92 1 1 6 ARG HH21 H -16.736 -4.365 -0.067 1.00 . A A . 6 ARG HH21 1 1
1 93 1 1 6 ARG HH22 H -17.986 -5.393 0.548 1.00 . A A . 6 ARG HH22 1 1
1 94 1 1 6 ARG N N -15.908 3.149 0.558 1.00 . A A . 6 ARG N 1 1
1 95 1 1 6 ARG NE N -16.868 -2.675 1.734 1.00 . A A . 6 ARG NE 1 1
1 96 1 1 6 ARG NH1 N -18.500 -4.017 2.546 1.00 . A A . 6 ARG NH1 1 1
1 97 1 1 6 ARG NH2 N -17.427 -4.567 0.627 1.00 . A A . 6 ARG NH2 1 1
1 98 1 1 6 ARG O O -13.509 0.720 -0.384 1.00 . A A . 6 ARG O 1 1
1 99 1 1 7 ASP C C -12.403 2.213 -2.528 1.00 . A A . 7 ASP C 1 1
1 100 1 1 7 ASP CA C -13.844 1.808 -2.863 1.00 . A A . 7 ASP CA 1 1
1 101 1 1 7 ASP CB C -14.416 2.710 -3.961 1.00 . A A . 7 ASP CB 1 1
1 102 1 1 7 ASP CG C -13.681 2.450 -5.277 1.00 . A A . 7 ASP CG 1 1
1 103 1 1 7 ASP H H -15.514 2.616 -1.761 1.00 . A A . 7 ASP H 1 1
1 104 1 1 7 ASP HA H -13.883 0.777 -3.176 1.00 . A A . 7 ASP HA 1 1
1 105 1 1 7 ASP HB2 H -15.468 2.499 -4.088 1.00 . A A . 7 ASP HB2 1 1
1 106 1 1 7 ASP HB3 H -14.288 3.745 -3.679 1.00 . A A . 7 ASP HB3 1 1
1 107 1 1 7 ASP N N -14.732 2.029 -1.679 1.00 . A A . 7 ASP N 1 1
1 108 1 1 7 ASP O O -11.459 1.545 -2.906 1.00 . A A . 7 ASP O 1 1
1 109 1 1 7 ASP OD1 O -14.019 1.484 -5.940 1.00 . A A . 7 ASP OD1 1 1
1 110 1 1 7 ASP OD2 O -12.792 3.222 -5.599 1.00 . A A . 7 ASP OD2 1 1
1 111 1 1 8 ILE C C -10.298 2.828 -0.326 1.00 . A A . 8 ILE C 1 1
1 112 1 1 8 ILE CA C -10.849 3.734 -1.435 1.00 . A A . 8 ILE CA 1 1
1 113 1 1 8 ILE CB C -10.994 5.175 -0.927 1.00 . A A . 8 ILE CB 1 1
1 114 1 1 8 ILE CD1 C -12.449 7.159 -1.373 1.00 . A A . 8 ILE CD1 1 1
1 115 1 1 8 ILE CG1 C -11.610 6.056 -2.021 1.00 . A A . 8 ILE CG1 1 1
1 116 1 1 8 ILE CG2 C -9.614 5.729 -0.554 1.00 . A A . 8 ILE CG2 1 1
1 117 1 1 8 ILE H H -13.006 3.811 -1.506 1.00 . A A . 8 ILE H 1 1
1 118 1 1 8 ILE HA H -10.201 3.710 -2.297 1.00 . A A . 8 ILE HA 1 1
1 119 1 1 8 ILE HB H -11.631 5.184 -0.054 1.00 . A A . 8 ILE HB 1 1
1 120 1 1 8 ILE HD11 H -12.834 7.815 -2.139 1.00 . A A . 8 ILE HD11 1 1
1 121 1 1 8 ILE HD12 H -11.833 7.725 -0.690 1.00 . A A . 8 ILE HD12 1 1
1 122 1 1 8 ILE HD13 H -13.272 6.715 -0.833 1.00 . A A . 8 ILE HD13 1 1
1 123 1 1 8 ILE HG12 H -10.823 6.501 -2.612 1.00 . A A . 8 ILE HG12 1 1
1 124 1 1 8 ILE HG13 H -12.242 5.455 -2.658 1.00 . A A . 8 ILE HG13 1 1
1 125 1 1 8 ILE HG21 H -8.854 5.223 -1.131 1.00 . A A . 8 ILE HG21 1 1
1 126 1 1 8 ILE HG22 H -9.434 5.565 0.499 1.00 . A A . 8 ILE HG22 1 1
1 127 1 1 8 ILE HG23 H -9.581 6.788 -0.764 1.00 . A A . 8 ILE HG23 1 1
1 128 1 1 8 ILE N N -12.229 3.295 -1.808 1.00 . A A . 8 ILE N 1 1
1 129 1 1 8 ILE O O -9.118 2.537 -0.288 1.00 . A A . 8 ILE O 1 1
1 130 1 1 9 TRP C C -9.972 0.253 1.121 1.00 . A A . 9 TRP C 1 1
1 131 1 1 9 TRP CA C -10.678 1.494 1.686 1.00 . A A . 9 TRP CA 1 1
1 132 1 1 9 TRP CB C -11.948 1.097 2.448 1.00 . A A . 9 TRP CB 1 1
1 133 1 1 9 TRP CD1 C -11.943 -0.478 4.424 1.00 . A A . 9 TRP CD1 1 1
1 134 1 1 9 TRP CD2 C -10.813 1.423 4.835 1.00 . A A . 9 TRP CD2 1 1
1 135 1 1 9 TRP CE2 C -10.731 0.640 6.010 1.00 . A A . 9 TRP CE2 1 1
1 136 1 1 9 TRP CE3 C -10.179 2.679 4.830 1.00 . A A . 9 TRP CE3 1 1
1 137 1 1 9 TRP CG C -11.588 0.689 3.842 1.00 . A A . 9 TRP CG 1 1
1 138 1 1 9 TRP CH2 C -9.420 2.336 7.118 1.00 . A A . 9 TRP CH2 1 1
1 139 1 1 9 TRP CZ2 C -10.045 1.086 7.140 1.00 . A A . 9 TRP CZ2 1 1
1 140 1 1 9 TRP CZ3 C -9.487 3.131 5.966 1.00 . A A . 9 TRP CZ3 1 1
1 141 1 1 9 TRP H H -12.093 2.635 0.518 1.00 . A A . 9 TRP H 1 1
1 142 1 1 9 TRP HA H -10.014 2.035 2.340 1.00 . A A . 9 TRP HA 1 1
1 143 1 1 9 TRP HB2 H -12.625 1.938 2.482 1.00 . A A . 9 TRP HB2 1 1
1 144 1 1 9 TRP HB3 H -12.427 0.271 1.943 1.00 . A A . 9 TRP HB3 1 1
1 145 1 1 9 TRP HD1 H -12.528 -1.259 3.961 1.00 . A A . 9 TRP HD1 1 1
1 146 1 1 9 TRP HE1 H -11.549 -1.246 6.345 1.00 . A A . 9 TRP HE1 1 1
1 147 1 1 9 TRP HE3 H -10.224 3.300 3.948 1.00 . A A . 9 TRP HE3 1 1
1 148 1 1 9 TRP HH2 H -8.887 2.689 7.988 1.00 . A A . 9 TRP HH2 1 1
1 149 1 1 9 TRP HZ2 H -9.996 0.469 8.025 1.00 . A A . 9 TRP HZ2 1 1
1 150 1 1 9 TRP HZ3 H -9.004 4.097 5.951 1.00 . A A . 9 TRP HZ3 1 1
1 151 1 1 9 TRP N N -11.146 2.383 0.574 1.00 . A A . 9 TRP N 1 1
1 152 1 1 9 TRP NE1 N -11.435 -0.509 5.710 1.00 . A A . 9 TRP NE1 1 1
1 153 1 1 9 TRP O O -8.854 -0.051 1.492 1.00 . A A . 9 TRP O 1 1
1 154 1 1 10 ASP C C -8.681 -1.257 -1.122 1.00 . A A . 10 ASP C 1 1
1 155 1 1 10 ASP CA C -9.962 -1.666 -0.382 1.00 . A A . 10 ASP CA 1 1
1 156 1 1 10 ASP CB C -10.993 -2.239 -1.361 1.00 . A A . 10 ASP CB 1 1
1 157 1 1 10 ASP CG C -10.654 -3.702 -1.662 1.00 . A A . 10 ASP CG 1 1
1 158 1 1 10 ASP H H -11.506 -0.184 -0.073 1.00 . A A . 10 ASP H 1 1
1 159 1 1 10 ASP HA H -9.738 -2.391 0.385 1.00 . A A . 10 ASP HA 1 1
1 160 1 1 10 ASP HB2 H -11.979 -2.180 -0.922 1.00 . A A . 10 ASP HB2 1 1
1 161 1 1 10 ASP HB3 H -10.973 -1.671 -2.279 1.00 . A A . 10 ASP HB3 1 1
1 162 1 1 10 ASP N N -10.609 -0.455 0.218 1.00 . A A . 10 ASP N 1 1
1 163 1 1 10 ASP O O -7.672 -1.934 -1.053 1.00 . A A . 10 ASP O 1 1
1 164 1 1 10 ASP OD1 O -10.919 -4.537 -0.812 1.00 . A A . 10 ASP OD1 1 1
1 165 1 1 10 ASP OD2 O -10.138 -3.962 -2.737 1.00 . A A . 10 ASP OD2 1 1
1 166 1 1 11 TRP C C -6.350 0.559 -1.561 1.00 . A A . 11 TRP C 1 1
1 167 1 1 11 TRP CA C -7.503 0.335 -2.550 1.00 . A A . 11 TRP CA 1 1
1 168 1 1 11 TRP CB C -7.928 1.655 -3.204 1.00 . A A . 11 TRP CB 1 1
1 169 1 1 11 TRP CD1 C -6.538 1.885 -5.303 1.00 . A A . 11 TRP CD1 1 1
1 170 1 1 11 TRP CD2 C -5.774 3.160 -3.614 1.00 . A A . 11 TRP CD2 1 1
1 171 1 1 11 TRP CE2 C -4.913 3.384 -4.713 1.00 . A A . 11 TRP CE2 1 1
1 172 1 1 11 TRP CE3 C -5.513 3.847 -2.415 1.00 . A A . 11 TRP CE3 1 1
1 173 1 1 11 TRP CG C -6.798 2.204 -4.015 1.00 . A A . 11 TRP CG 1 1
1 174 1 1 11 TRP CH2 C -3.585 4.935 -3.428 1.00 . A A . 11 TRP CH2 1 1
1 175 1 1 11 TRP CZ2 C -3.830 4.260 -4.627 1.00 . A A . 11 TRP CZ2 1 1
1 176 1 1 11 TRP CZ3 C -4.424 4.729 -2.324 1.00 . A A . 11 TRP CZ3 1 1
1 177 1 1 11 TRP H H -9.542 0.387 -1.844 1.00 . A A . 11 TRP H 1 1
1 178 1 1 11 TRP HA H -7.217 -0.378 -3.308 1.00 . A A . 11 TRP HA 1 1
1 179 1 1 11 TRP HB2 H -8.779 1.481 -3.846 1.00 . A A . 11 TRP HB2 1 1
1 180 1 1 11 TRP HB3 H -8.197 2.365 -2.436 1.00 . A A . 11 TRP HB3 1 1
1 181 1 1 11 TRP HD1 H -7.110 1.196 -5.908 1.00 . A A . 11 TRP HD1 1 1
1 182 1 1 11 TRP HE1 H -5.021 2.533 -6.613 1.00 . A A . 11 TRP HE1 1 1
1 183 1 1 11 TRP HE3 H -6.154 3.695 -1.560 1.00 . A A . 11 TRP HE3 1 1
1 184 1 1 11 TRP HH2 H -2.749 5.614 -3.351 1.00 . A A . 11 TRP HH2 1 1
1 185 1 1 11 TRP HZ2 H -3.186 4.415 -5.480 1.00 . A A . 11 TRP HZ2 1 1
1 186 1 1 11 TRP HZ3 H -4.233 5.251 -1.399 1.00 . A A . 11 TRP HZ3 1 1
1 187 1 1 11 TRP N N -8.716 -0.142 -1.816 1.00 . A A . 11 TRP N 1 1
1 188 1 1 11 TRP NE1 N -5.420 2.584 -5.719 1.00 . A A . 11 TRP NE1 1 1
1 189 1 1 11 TRP O O -5.218 0.195 -1.822 1.00 . A A . 11 TRP O 1 1
1 190 1 1 12 ILE C C -5.016 0.037 1.097 1.00 . A A . 12 ILE C 1 1
1 191 1 1 12 ILE CA C -5.564 1.382 0.600 1.00 . A A . 12 ILE CA 1 1
1 192 1 1 12 ILE CB C -6.242 2.149 1.744 1.00 . A A . 12 ILE CB 1 1
1 193 1 1 12 ILE CD1 C -7.797 4.075 2.111 1.00 . A A . 12 ILE CD1 1 1
1 194 1 1 12 ILE CG1 C -6.639 3.549 1.260 1.00 . A A . 12 ILE CG1 1 1
1 195 1 1 12 ILE CG2 C -5.275 2.283 2.926 1.00 . A A . 12 ILE CG2 1 1
1 196 1 1 12 ILE H H -7.559 1.420 -0.230 1.00 . A A . 12 ILE H 1 1
1 197 1 1 12 ILE HA H -4.769 1.976 0.176 1.00 . A A . 12 ILE HA 1 1
1 198 1 1 12 ILE HB H -7.124 1.613 2.062 1.00 . A A . 12 ILE HB 1 1
1 199 1 1 12 ILE HD11 H -8.699 3.535 1.864 1.00 . A A . 12 ILE HD11 1 1
1 200 1 1 12 ILE HD12 H -7.940 5.127 1.913 1.00 . A A . 12 ILE HD12 1 1
1 201 1 1 12 ILE HD13 H -7.568 3.934 3.157 1.00 . A A . 12 ILE HD13 1 1
1 202 1 1 12 ILE HG12 H -5.793 4.214 1.351 1.00 . A A . 12 ILE HG12 1 1
1 203 1 1 12 ILE HG13 H -6.948 3.499 0.227 1.00 . A A . 12 ILE HG13 1 1
1 204 1 1 12 ILE HG21 H -5.590 3.099 3.558 1.00 . A A . 12 ILE HG21 1 1
1 205 1 1 12 ILE HG22 H -4.279 2.479 2.556 1.00 . A A . 12 ILE HG22 1 1
1 206 1 1 12 ILE HG23 H -5.273 1.366 3.495 1.00 . A A . 12 ILE HG23 1 1
1 207 1 1 12 ILE N N -6.636 1.145 -0.419 1.00 . A A . 12 ILE N 1 1
1 208 1 1 12 ILE O O -3.842 -0.090 1.385 1.00 . A A . 12 ILE O 1 1
1 209 1 1 13 CYS C C -4.261 -2.809 0.729 1.00 . A A . 13 CYS C 1 1
1 210 1 1 13 CYS CA C -5.383 -2.312 1.650 1.00 . A A . 13 CYS CA 1 1
1 211 1 1 13 CYS CB C -6.606 -3.230 1.556 1.00 . A A . 13 CYS CB 1 1
1 212 1 1 13 CYS H H -6.800 -0.843 0.941 1.00 . A A . 13 CYS H 1 1
1 213 1 1 13 CYS HA H -5.038 -2.258 2.671 1.00 . A A . 13 CYS HA 1 1
1 214 1 1 13 CYS HB2 H -7.497 -2.672 1.805 1.00 . A A . 13 CYS HB2 1 1
1 215 1 1 13 CYS HB3 H -6.692 -3.614 0.550 1.00 . A A . 13 CYS HB3 1 1
1 216 1 1 13 CYS HG H -5.808 -5.241 2.324 1.00 . A A . 13 CYS HG 1 1
1 217 1 1 13 CYS N N -5.858 -0.970 1.187 1.00 . A A . 13 CYS N 1 1
1 218 1 1 13 CYS O O -3.267 -3.347 1.181 1.00 . A A . 13 CYS O 1 1
1 219 1 1 13 CYS SG S -6.417 -4.609 2.713 1.00 . A A . 13 CYS SG 1 1
1 220 1 1 14 GLU C C -2.118 -2.144 -1.369 1.00 . A A . 14 GLU C 1 1
1 221 1 1 14 GLU CA C -3.348 -3.047 -1.519 1.00 . A A . 14 GLU CA 1 1
1 222 1 1 14 GLU CB C -3.967 -2.888 -2.911 1.00 . A A . 14 GLU CB 1 1
1 223 1 1 14 GLU CD C -5.986 -3.501 -4.261 1.00 . A A . 14 GLU CD 1 1
1 224 1 1 14 GLU CG C -5.079 -3.924 -3.101 1.00 . A A . 14 GLU CG 1 1
1 225 1 1 14 GLU H H -5.215 -2.161 -0.895 1.00 . A A . 14 GLU H 1 1
1 226 1 1 14 GLU HA H -3.083 -4.078 -1.346 1.00 . A A . 14 GLU HA 1 1
1 227 1 1 14 GLU HB2 H -4.379 -1.894 -3.010 1.00 . A A . 14 GLU HB2 1 1
1 228 1 1 14 GLU HB3 H -3.206 -3.038 -3.663 1.00 . A A . 14 GLU HB3 1 1
1 229 1 1 14 GLU HG2 H -4.640 -4.887 -3.319 1.00 . A A . 14 GLU HG2 1 1
1 230 1 1 14 GLU HG3 H -5.666 -3.993 -2.197 1.00 . A A . 14 GLU HG3 1 1
1 231 1 1 14 GLU N N -4.409 -2.611 -0.560 1.00 . A A . 14 GLU N 1 1
1 232 1 1 14 GLU O O -0.995 -2.612 -1.345 1.00 . A A . 14 GLU O 1 1
1 233 1 1 14 GLU OE1 O -6.759 -2.575 -4.079 1.00 . A A . 14 GLU OE1 1 1
1 234 1 1 14 GLU OE2 O -5.892 -4.113 -5.311 1.00 . A A . 14 GLU OE2 1 1
1 235 1 1 15 VAL C C -0.461 -0.197 0.245 1.00 . A A . 15 VAL C 1 1
1 236 1 1 15 VAL CA C -1.172 0.088 -1.086 1.00 . A A . 15 VAL CA 1 1
1 237 1 1 15 VAL CB C -1.783 1.496 -1.091 1.00 . A A . 15 VAL CB 1 1
1 238 1 1 15 VAL CG1 C -0.697 2.532 -0.781 1.00 . A A . 15 VAL CG1 1 1
1 239 1 1 15 VAL CG2 C -2.379 1.791 -2.471 1.00 . A A . 15 VAL CG2 1 1
1 240 1 1 15 VAL H H -3.244 -0.502 -1.263 1.00 . A A . 15 VAL H 1 1
1 241 1 1 15 VAL HA H -0.483 -0.019 -1.909 1.00 . A A . 15 VAL HA 1 1
1 242 1 1 15 VAL HB H -2.559 1.554 -0.341 1.00 . A A . 15 VAL HB 1 1
1 243 1 1 15 VAL HG11 H -0.613 2.656 0.289 1.00 . A A . 15 VAL HG11 1 1
1 244 1 1 15 VAL HG12 H -0.960 3.476 -1.233 1.00 . A A . 15 VAL HG12 1 1
1 245 1 1 15 VAL HG13 H 0.248 2.193 -1.179 1.00 . A A . 15 VAL HG13 1 1
1 246 1 1 15 VAL HG21 H -1.985 2.725 -2.843 1.00 . A A . 15 VAL HG21 1 1
1 247 1 1 15 VAL HG22 H -3.454 1.861 -2.392 1.00 . A A . 15 VAL HG22 1 1
1 248 1 1 15 VAL HG23 H -2.120 0.995 -3.154 1.00 . A A . 15 VAL HG23 1 1
1 249 1 1 15 VAL N N -2.326 -0.852 -1.252 1.00 . A A . 15 VAL N 1 1
1 250 1 1 15 VAL O O 0.746 -0.094 0.341 1.00 . A A . 15 VAL O 1 1
1 251 1 1 16 LEU C C 0.392 -2.058 2.429 1.00 . A A . 16 LEU C 1 1
1 252 1 1 16 LEU CA C -0.577 -0.880 2.588 1.00 . A A . 16 LEU CA 1 1
1 253 1 1 16 LEU CB C -1.745 -1.254 3.510 1.00 . A A . 16 LEU CB 1 1
1 254 1 1 16 LEU CD1 C -2.020 -0.673 5.930 1.00 . A A . 16 LEU CD1 1 1
1 255 1 1 16 LEU CD2 C -1.392 -2.998 5.269 1.00 . A A . 16 LEU CD2 1 1
1 256 1 1 16 LEU CG C -1.226 -1.514 4.929 1.00 . A A . 16 LEU CG 1 1
1 257 1 1 16 LEU H H -2.177 -0.652 1.155 1.00 . A A . 16 LEU H 1 1
1 258 1 1 16 LEU HA H -0.061 -0.015 2.974 1.00 . A A . 16 LEU HA 1 1
1 259 1 1 16 LEU HB2 H -2.459 -0.442 3.531 1.00 . A A . 16 LEU HB2 1 1
1 260 1 1 16 LEU HB3 H -2.226 -2.145 3.135 1.00 . A A . 16 LEU HB3 1 1
1 261 1 1 16 LEU HD11 H -1.997 0.364 5.629 1.00 . A A . 16 LEU HD11 1 1
1 262 1 1 16 LEU HD12 H -1.581 -0.772 6.912 1.00 . A A . 16 LEU HD12 1 1
1 263 1 1 16 LEU HD13 H -3.044 -1.017 5.958 1.00 . A A . 16 LEU HD13 1 1
1 264 1 1 16 LEU HD21 H -0.901 -3.597 4.517 1.00 . A A . 16 LEU HD21 1 1
1 265 1 1 16 LEU HD22 H -2.443 -3.245 5.298 1.00 . A A . 16 LEU HD22 1 1
1 266 1 1 16 LEU HD23 H -0.949 -3.197 6.234 1.00 . A A . 16 LEU HD23 1 1
1 267 1 1 16 LEU HG H -0.180 -1.245 4.985 1.00 . A A . 16 LEU HG 1 1
1 268 1 1 16 LEU N N -1.204 -0.568 1.265 1.00 . A A . 16 LEU N 1 1
1 269 1 1 16 LEU O O 1.538 -1.986 2.831 1.00 . A A . 16 LEU O 1 1
1 270 1 1 17 SER C C 1.961 -3.918 0.640 1.00 . A A . 17 SER C 1 1
1 271 1 1 17 SER CA C 0.839 -4.309 1.608 1.00 . A A . 17 SER CA 1 1
1 272 1 1 17 SER CB C -0.048 -5.394 0.994 1.00 . A A . 17 SER CB 1 1
1 273 1 1 17 SER H H -0.983 -3.155 1.492 1.00 . A A . 17 SER H 1 1
1 274 1 1 17 SER HA H 1.249 -4.649 2.547 1.00 . A A . 17 SER HA 1 1
1 275 1 1 17 SER HB2 H -0.605 -4.983 0.168 1.00 . A A . 17 SER HB2 1 1
1 276 1 1 17 SER HB3 H 0.574 -6.204 0.636 1.00 . A A . 17 SER HB3 1 1
1 277 1 1 17 SER HG H -1.793 -5.421 1.857 1.00 . A A . 17 SER HG 1 1
1 278 1 1 17 SER N N -0.059 -3.132 1.822 1.00 . A A . 17 SER N 1 1
1 279 1 1 17 SER O O 3.105 -4.291 0.818 1.00 . A A . 17 SER O 1 1
1 280 1 1 17 SER OG O -0.955 -5.875 1.978 1.00 . A A . 17 SER OG 1 1
1 281 1 1 18 ASP C C 3.721 -1.853 -0.629 1.00 . A A . 18 ASP C 1 1
1 282 1 1 18 ASP CA C 2.673 -2.704 -1.350 1.00 . A A . 18 ASP CA 1 1
1 283 1 1 18 ASP CB C 1.921 -1.863 -2.387 1.00 . A A . 18 ASP CB 1 1
1 284 1 1 18 ASP CG C 2.910 -1.309 -3.418 1.00 . A A . 18 ASP CG 1 1
1 285 1 1 18 ASP H H 0.706 -2.853 -0.483 1.00 . A A . 18 ASP H 1 1
1 286 1 1 18 ASP HA H 3.136 -3.554 -1.826 1.00 . A A . 18 ASP HA 1 1
1 287 1 1 18 ASP HB2 H 1.188 -2.480 -2.887 1.00 . A A . 18 ASP HB2 1 1
1 288 1 1 18 ASP HB3 H 1.423 -1.043 -1.893 1.00 . A A . 18 ASP HB3 1 1
1 289 1 1 18 ASP N N 1.635 -3.149 -0.374 1.00 . A A . 18 ASP N 1 1
1 290 1 1 18 ASP O O 4.906 -2.056 -0.792 1.00 . A A . 18 ASP O 1 1
1 291 1 1 18 ASP OD1 O 3.563 -0.321 -3.118 1.00 . A A . 18 ASP OD1 1 1
1 292 1 1 18 ASP OD2 O 2.997 -1.882 -4.491 1.00 . A A . 18 ASP OD2 1 1
1 293 1 1 19 PHE C C 5.238 -0.905 1.709 1.00 . A A . 19 PHE C 1 1
1 294 1 1 19 PHE CA C 4.250 -0.038 0.921 1.00 . A A . 19 PHE CA 1 1
1 295 1 1 19 PHE CB C 3.392 0.800 1.877 1.00 . A A . 19 PHE CB 1 1
1 296 1 1 19 PHE CD1 C 2.675 2.681 0.356 1.00 . A A . 19 PHE CD1 1 1
1 297 1 1 19 PHE CD2 C 4.219 3.165 2.163 1.00 . A A . 19 PHE CD2 1 1
1 298 1 1 19 PHE CE1 C 2.711 4.026 -0.034 1.00 . A A . 19 PHE CE1 1 1
1 299 1 1 19 PHE CE2 C 4.254 4.509 1.773 1.00 . A A . 19 PHE CE2 1 1
1 300 1 1 19 PHE CG C 3.430 2.250 1.455 1.00 . A A . 19 PHE CG 1 1
1 301 1 1 19 PHE CZ C 3.500 4.939 0.675 1.00 . A A . 19 PHE CZ 1 1
1 302 1 1 19 PHE H H 2.319 -0.774 0.287 1.00 . A A . 19 PHE H 1 1
1 303 1 1 19 PHE HA H 4.780 0.608 0.238 1.00 . A A . 19 PHE HA 1 1
1 304 1 1 19 PHE HB2 H 2.372 0.444 1.854 1.00 . A A . 19 PHE HB2 1 1
1 305 1 1 19 PHE HB3 H 3.780 0.709 2.881 1.00 . A A . 19 PHE HB3 1 1
1 306 1 1 19 PHE HD1 H 2.066 1.976 -0.191 1.00 . A A . 19 PHE HD1 1 1
1 307 1 1 19 PHE HD2 H 4.801 2.833 3.010 1.00 . A A . 19 PHE HD2 1 1
1 308 1 1 19 PHE HE1 H 2.129 4.358 -0.881 1.00 . A A . 19 PHE HE1 1 1
1 309 1 1 19 PHE HE2 H 4.863 5.214 2.320 1.00 . A A . 19 PHE HE2 1 1
1 310 1 1 19 PHE HZ H 3.527 5.976 0.375 1.00 . A A . 19 PHE HZ 1 1
1 311 1 1 19 PHE N N 3.286 -0.907 0.174 1.00 . A A . 19 PHE N 1 1
1 312 1 1 19 PHE O O 6.424 -0.638 1.732 1.00 . A A . 19 PHE O 1 1
1 313 1 1 20 LYS C C 6.716 -3.461 2.177 1.00 . A A . 20 LYS C 1 1
1 314 1 1 20 LYS CA C 5.668 -2.849 3.117 1.00 . A A . 20 LYS CA 1 1
1 315 1 1 20 LYS CB C 4.758 -3.936 3.696 1.00 . A A . 20 LYS CB 1 1
1 316 1 1 20 LYS CD C 4.576 -5.706 5.450 1.00 . A A . 20 LYS CD 1 1
1 317 1 1 20 LYS CE C 5.268 -6.272 6.694 1.00 . A A . 20 LYS CE 1 1
1 318 1 1 20 LYS CG C 5.539 -4.778 4.707 1.00 . A A . 20 LYS CG 1 1
1 319 1 1 20 LYS H H 3.797 -2.147 2.298 1.00 . A A . 20 LYS H 1 1
1 320 1 1 20 LYS HA H 6.148 -2.304 3.915 1.00 . A A . 20 LYS HA 1 1
1 321 1 1 20 LYS HB2 H 3.914 -3.474 4.187 1.00 . A A . 20 LYS HB2 1 1
1 322 1 1 20 LYS HB3 H 4.405 -4.572 2.897 1.00 . A A . 20 LYS HB3 1 1
1 323 1 1 20 LYS HD2 H 3.698 -5.149 5.748 1.00 . A A . 20 LYS HD2 1 1
1 324 1 1 20 LYS HD3 H 4.285 -6.517 4.801 1.00 . A A . 20 LYS HD3 1 1
1 325 1 1 20 LYS HE2 H 6.198 -6.753 6.418 1.00 . A A . 20 LYS HE2 1 1
1 326 1 1 20 LYS HE3 H 5.449 -5.489 7.414 1.00 . A A . 20 LYS HE3 1 1
1 327 1 1 20 LYS HG2 H 6.280 -5.369 4.186 1.00 . A A . 20 LYS HG2 1 1
1 328 1 1 20 LYS HG3 H 6.030 -4.128 5.415 1.00 . A A . 20 LYS HG3 1 1
1 329 1 1 20 LYS HZ1 H 3.432 -6.791 7.534 1.00 . A A . 20 LYS HZ1 1 1
1 330 1 1 20 LYS HZ2 H 4.737 -7.728 8.085 1.00 . A A . 20 LYS HZ2 1 1
1 331 1 1 20 LYS HZ3 H 4.097 -7.990 6.533 1.00 . A A . 20 LYS HZ3 1 1
1 332 1 1 20 LYS N N 4.757 -1.950 2.342 1.00 . A A . 20 LYS N 1 1
1 333 1 1 20 LYS NZ N 4.311 -7.270 7.253 1.00 . A A . 20 LYS NZ 1 1
1 334 1 1 20 LYS O O 7.894 -3.483 2.478 1.00 . A A . 20 LYS O 1 1
1 335 1 1 21 THR C C 8.100 -3.430 -0.584 1.00 . A A . 21 THR C 1 1
1 336 1 1 21 THR CA C 7.256 -4.541 0.058 1.00 . A A . 21 THR CA 1 1
1 337 1 1 21 THR CB C 6.389 -5.239 -0.997 1.00 . A A . 21 THR CB 1 1
1 338 1 1 21 THR CG2 C 7.262 -6.148 -1.864 1.00 . A A . 21 THR CG2 1 1
1 339 1 1 21 THR H H 5.336 -3.902 0.811 1.00 . A A . 21 THR H 1 1
1 340 1 1 21 THR HA H 7.892 -5.260 0.550 1.00 . A A . 21 THR HA 1 1
1 341 1 1 21 THR HB H 5.917 -4.497 -1.624 1.00 . A A . 21 THR HB 1 1
1 342 1 1 21 THR HG1 H 4.530 -5.685 -0.618 1.00 . A A . 21 THR HG1 1 1
1 343 1 1 21 THR HG21 H 8.070 -5.572 -2.291 1.00 . A A . 21 THR HG21 1 1
1 344 1 1 21 THR HG22 H 6.664 -6.571 -2.658 1.00 . A A . 21 THR HG22 1 1
1 345 1 1 21 THR HG23 H 7.669 -6.943 -1.257 1.00 . A A . 21 THR HG23 1 1
1 346 1 1 21 THR N N 6.291 -3.943 1.033 1.00 . A A . 21 THR N 1 1
1 347 1 1 21 THR O O 9.282 -3.595 -0.813 1.00 . A A . 21 THR O 1 1
1 348 1 1 21 THR OG1 O 5.390 -6.021 -0.352 1.00 . A A . 21 THR OG1 1 1
1 349 1 1 22 TRP C C 9.395 -0.733 -0.565 1.00 . A A . 22 TRP C 1 1
1 350 1 1 22 TRP CA C 8.244 -1.162 -1.483 1.00 . A A . 22 TRP CA 1 1
1 351 1 1 22 TRP CB C 7.215 -0.035 -1.622 1.00 . A A . 22 TRP CB 1 1
1 352 1 1 22 TRP CD1 C 7.425 0.981 -3.925 1.00 . A A . 22 TRP CD1 1 1
1 353 1 1 22 TRP CD2 C 8.568 2.131 -2.365 1.00 . A A . 22 TRP CD2 1 1
1 354 1 1 22 TRP CE2 C 8.770 2.802 -3.593 1.00 . A A . 22 TRP CE2 1 1
1 355 1 1 22 TRP CE3 C 9.183 2.654 -1.213 1.00 . A A . 22 TRP CE3 1 1
1 356 1 1 22 TRP CG C 7.710 0.977 -2.603 1.00 . A A . 22 TRP CG 1 1
1 357 1 1 22 TRP CH2 C 10.159 4.459 -2.524 1.00 . A A . 22 TRP CH2 1 1
1 358 1 1 22 TRP CZ2 C 9.555 3.952 -3.677 1.00 . A A . 22 TRP CZ2 1 1
1 359 1 1 22 TRP CZ3 C 9.974 3.812 -1.294 1.00 . A A . 22 TRP CZ3 1 1
1 360 1 1 22 TRP H H 6.537 -2.197 -0.662 1.00 . A A . 22 TRP H 1 1
1 361 1 1 22 TRP HA H 8.620 -1.442 -2.454 1.00 . A A . 22 TRP HA 1 1
1 362 1 1 22 TRP HB2 H 6.278 -0.445 -1.971 1.00 . A A . 22 TRP HB2 1 1
1 363 1 1 22 TRP HB3 H 7.066 0.436 -0.662 1.00 . A A . 22 TRP HB3 1 1
1 364 1 1 22 TRP HD1 H 6.808 0.257 -4.437 1.00 . A A . 22 TRP HD1 1 1
1 365 1 1 22 TRP HE1 H 8.008 2.294 -5.466 1.00 . A A . 22 TRP HE1 1 1
1 366 1 1 22 TRP HE3 H 9.046 2.163 -0.261 1.00 . A A . 22 TRP HE3 1 1
1 367 1 1 22 TRP HH2 H 10.768 5.349 -2.580 1.00 . A A . 22 TRP HH2 1 1
1 368 1 1 22 TRP HZ2 H 9.695 4.447 -4.627 1.00 . A A . 22 TRP HZ2 1 1
1 369 1 1 22 TRP HZ3 H 10.442 4.206 -0.404 1.00 . A A . 22 TRP HZ3 1 1
1 370 1 1 22 TRP N N 7.494 -2.299 -0.865 1.00 . A A . 22 TRP N 1 1
1 371 1 1 22 TRP NE1 N 8.054 2.063 -4.514 1.00 . A A . 22 TRP NE1 1 1
1 372 1 1 22 TRP O O 10.498 -0.489 -1.017 1.00 . A A . 22 TRP O 1 1
1 373 1 1 23 LEU C C 11.337 -1.316 1.677 1.00 . A A . 23 LEU C 1 1
1 374 1 1 23 LEU CA C 10.229 -0.257 1.679 1.00 . A A . 23 LEU CA 1 1
1 375 1 1 23 LEU CB C 9.555 -0.186 3.055 1.00 . A A . 23 LEU CB 1 1
1 376 1 1 23 LEU CD1 C 8.243 1.942 2.950 1.00 . A A . 23 LEU CD1 1 1
1 377 1 1 23 LEU CD2 C 9.439 1.313 5.052 1.00 . A A . 23 LEU CD2 1 1
1 378 1 1 23 LEU CG C 9.494 1.271 3.522 1.00 . A A . 23 LEU CG 1 1
1 379 1 1 23 LEU H H 8.249 -0.866 1.059 1.00 . A A . 23 LEU H 1 1
1 380 1 1 23 LEU HA H 10.631 0.708 1.412 1.00 . A A . 23 LEU HA 1 1
1 381 1 1 23 LEU HB2 H 8.554 -0.586 2.988 1.00 . A A . 23 LEU HB2 1 1
1 382 1 1 23 LEU HB3 H 10.127 -0.765 3.764 1.00 . A A . 23 LEU HB3 1 1
1 383 1 1 23 LEU HD11 H 8.201 1.775 1.883 1.00 . A A . 23 LEU HD11 1 1
1 384 1 1 23 LEU HD12 H 8.282 3.003 3.147 1.00 . A A . 23 LEU HD12 1 1
1 385 1 1 23 LEU HD13 H 7.364 1.522 3.415 1.00 . A A . 23 LEU HD13 1 1
1 386 1 1 23 LEU HD21 H 8.562 0.785 5.396 1.00 . A A . 23 LEU HD21 1 1
1 387 1 1 23 LEU HD22 H 9.394 2.340 5.382 1.00 . A A . 23 LEU HD22 1 1
1 388 1 1 23 LEU HD23 H 10.324 0.843 5.457 1.00 . A A . 23 LEU HD23 1 1
1 389 1 1 23 LEU HG H 10.373 1.796 3.177 1.00 . A A . 23 LEU HG 1 1
1 390 1 1 23 LEU N N 9.147 -0.654 0.722 1.00 . A A . 23 LEU N 1 1
1 391 1 1 23 LEU O O 12.510 -0.998 1.649 1.00 . A A . 23 LEU O 1 1
1 392 1 1 24 LYS C C 12.732 -3.656 0.331 1.00 . A A . 24 LYS C 1 1
1 393 1 1 24 LYS CA C 11.990 -3.666 1.673 1.00 . A A . 24 LYS CA 1 1
1 394 1 1 24 LYS CB C 11.193 -4.962 1.841 1.00 . A A . 24 LYS CB 1 1
1 395 1 1 24 LYS CD C 11.449 -7.449 1.822 1.00 . A A . 24 LYS CD 1 1
1 396 1 1 24 LYS CE C 11.485 -8.357 3.055 1.00 . A A . 24 LYS CE 1 1
1 397 1 1 24 LYS CG C 12.146 -6.123 2.139 1.00 . A A . 24 LYS CG 1 1
1 398 1 1 24 LYS H H 10.013 -2.802 1.702 1.00 . A A . 24 LYS H 1 1
1 399 1 1 24 LYS HA H 12.684 -3.547 2.491 1.00 . A A . 24 LYS HA 1 1
1 400 1 1 24 LYS HB2 H 10.495 -4.851 2.659 1.00 . A A . 24 LYS HB2 1 1
1 401 1 1 24 LYS HB3 H 10.650 -5.170 0.931 1.00 . A A . 24 LYS HB3 1 1
1 402 1 1 24 LYS HD2 H 10.422 -7.257 1.544 1.00 . A A . 24 LYS HD2 1 1
1 403 1 1 24 LYS HD3 H 11.958 -7.936 1.004 1.00 . A A . 24 LYS HD3 1 1
1 404 1 1 24 LYS HE2 H 12.473 -8.779 3.180 1.00 . A A . 24 LYS HE2 1 1
1 405 1 1 24 LYS HE3 H 11.197 -7.806 3.937 1.00 . A A . 24 LYS HE3 1 1
1 406 1 1 24 LYS HG2 H 13.033 -6.026 1.528 1.00 . A A . 24 LYS HG2 1 1
1 407 1 1 24 LYS HG3 H 12.424 -6.104 3.182 1.00 . A A . 24 LYS HG3 1 1
1 408 1 1 24 LYS HZ1 H 10.594 -10.192 3.482 1.00 . A A . 24 LYS HZ1 1 1
1 409 1 1 24 LYS HZ2 H 10.650 -9.822 1.825 1.00 . A A . 24 LYS HZ2 1 1
1 410 1 1 24 LYS HZ3 H 9.528 -9.043 2.835 1.00 . A A . 24 LYS HZ3 1 1
1 411 1 1 24 LYS N N 10.967 -2.575 1.691 1.00 . A A . 24 LYS N 1 1
1 412 1 1 24 LYS NZ N 10.489 -9.434 2.778 1.00 . A A . 24 LYS NZ 1 1
1 413 1 1 24 LYS O O 13.937 -3.816 0.279 1.00 . A A . 24 LYS O 1 1
1 414 1 1 25 ALA C C 13.640 -2.235 -2.183 1.00 . A A . 25 ALA C 1 1
1 415 1 1 25 ALA CA C 12.671 -3.422 -2.098 1.00 . A A . 25 ALA CA 1 1
1 416 1 1 25 ALA CB C 11.524 -3.253 -3.098 1.00 . A A . 25 ALA CB 1 1
1 417 1 1 25 ALA H H 11.046 -3.323 -0.678 1.00 . A A . 25 ALA H 1 1
1 418 1 1 25 ALA HA H 13.192 -4.347 -2.286 1.00 . A A . 25 ALA HA 1 1
1 419 1 1 25 ALA HB1 H 11.066 -4.213 -3.285 1.00 . A A . 25 ALA HB1 1 1
1 420 1 1 25 ALA HB2 H 11.910 -2.852 -4.023 1.00 . A A . 25 ALA HB2 1 1
1 421 1 1 25 ALA HB3 H 10.788 -2.575 -2.691 1.00 . A A . 25 ALA HB3 1 1
1 422 1 1 25 ALA N N 12.017 -3.457 -0.752 1.00 . A A . 25 ALA N 1 1
1 423 1 1 25 ALA O O 14.724 -2.351 -2.720 1.00 . A A . 25 ALA O 1 1
1 424 1 1 26 LYS C C 15.329 -0.093 -0.710 1.00 . A A . 26 LYS C 1 1
1 425 1 1 26 LYS CA C 14.162 0.094 -1.689 1.00 . A A . 26 LYS CA 1 1
1 426 1 1 26 LYS CB C 13.288 1.278 -1.263 1.00 . A A . 26 LYS CB 1 1
1 427 1 1 26 LYS CD C 13.606 3.669 -0.600 1.00 . A A . 26 LYS CD 1 1
1 428 1 1 26 LYS CE C 14.265 4.998 -0.985 1.00 . A A . 26 LYS CE 1 1
1 429 1 1 26 LYS CG C 13.996 2.590 -1.613 1.00 . A A . 26 LYS CG 1 1
1 430 1 1 26 LYS H H 12.380 -1.032 -1.215 1.00 . A A . 26 LYS H 1 1
1 431 1 1 26 LYS HA H 14.532 0.250 -2.690 1.00 . A A . 26 LYS HA 1 1
1 432 1 1 26 LYS HB2 H 12.340 1.230 -1.780 1.00 . A A . 26 LYS HB2 1 1
1 433 1 1 26 LYS HB3 H 13.119 1.235 -0.197 1.00 . A A . 26 LYS HB3 1 1
1 434 1 1 26 LYS HD2 H 12.532 3.786 -0.595 1.00 . A A . 26 LYS HD2 1 1
1 435 1 1 26 LYS HD3 H 13.940 3.377 0.385 1.00 . A A . 26 LYS HD3 1 1
1 436 1 1 26 LYS HE2 H 14.419 5.608 -0.105 1.00 . A A . 26 LYS HE2 1 1
1 437 1 1 26 LYS HE3 H 15.203 4.821 -1.489 1.00 . A A . 26 LYS HE3 1 1
1 438 1 1 26 LYS HG2 H 15.066 2.440 -1.586 1.00 . A A . 26 LYS HG2 1 1
1 439 1 1 26 LYS HG3 H 13.701 2.904 -2.603 1.00 . A A . 26 LYS HG3 1 1
1 440 1 1 26 LYS HZ1 H 13.005 4.982 -2.647 1.00 . A A . 26 LYS HZ1 1 1
1 441 1 1 26 LYS HZ2 H 13.763 6.477 -2.364 1.00 . A A . 26 LYS HZ2 1 1
1 442 1 1 26 LYS HZ3 H 12.469 5.979 -1.382 1.00 . A A . 26 LYS HZ3 1 1
1 443 1 1 26 LYS N N 13.259 -1.098 -1.649 1.00 . A A . 26 LYS N 1 1
1 444 1 1 26 LYS NZ N 13.303 5.658 -1.914 1.00 . A A . 26 LYS NZ 1 1
1 445 1 1 26 LYS O O 16.453 0.274 -0.999 1.00 . A A . 26 LYS O 1 1
1 446 1 1 27 LEU C C 17.145 -1.952 0.953 1.00 . A A . 27 LEU C 1 1
1 447 1 1 27 LEU CA C 16.163 -0.879 1.446 1.00 . A A . 27 LEU CA 1 1
1 448 1 1 27 LEU CB C 15.454 -1.346 2.722 1.00 . A A . 27 LEU CB 1 1
1 449 1 1 27 LEU CD1 C 15.828 -0.319 4.974 1.00 . A A . 27 LEU CD1 1 1
1 450 1 1 27 LEU CD2 C 16.624 -2.643 4.512 1.00 . A A . 27 LEU CD2 1 1
1 451 1 1 27 LEU CG C 16.416 -1.250 3.911 1.00 . A A . 27 LEU CG 1 1
1 452 1 1 27 LEU H H 14.156 -0.953 0.651 1.00 . A A . 27 LEU H 1 1
1 453 1 1 27 LEU HA H 16.684 0.046 1.635 1.00 . A A . 27 LEU HA 1 1
1 454 1 1 27 LEU HB2 H 14.592 -0.718 2.904 1.00 . A A . 27 LEU HB2 1 1
1 455 1 1 27 LEU HB3 H 15.133 -2.370 2.601 1.00 . A A . 27 LEU HB3 1 1
1 456 1 1 27 LEU HD11 H 15.373 0.534 4.494 1.00 . A A . 27 LEU HD11 1 1
1 457 1 1 27 LEU HD12 H 16.616 0.017 5.633 1.00 . A A . 27 LEU HD12 1 1
1 458 1 1 27 LEU HD13 H 15.083 -0.851 5.547 1.00 . A A . 27 LEU HD13 1 1
1 459 1 1 27 LEU HD21 H 17.300 -2.575 5.351 1.00 . A A . 27 LEU HD21 1 1
1 460 1 1 27 LEU HD22 H 17.043 -3.299 3.764 1.00 . A A . 27 LEU HD22 1 1
1 461 1 1 27 LEU HD23 H 15.675 -3.036 4.846 1.00 . A A . 27 LEU HD23 1 1
1 462 1 1 27 LEU HG H 17.365 -0.856 3.575 1.00 . A A . 27 LEU HG 1 1
1 463 1 1 27 LEU N N 15.070 -0.664 0.444 1.00 . A A . 27 LEU N 1 1
1 464 1 1 27 LEU O O 18.327 -1.889 1.235 1.00 . A A . 27 LEU O 1 1
1 465 1 1 28 MET C C 18.628 -3.412 -1.232 1.00 . A A . 28 MET C 1 1
1 466 1 1 28 MET CA C 17.576 -4.009 -0.285 1.00 . A A . 28 MET CA 1 1
1 467 1 1 28 MET CB C 16.667 -4.984 -1.041 1.00 . A A . 28 MET CB 1 1
1 468 1 1 28 MET CE C 15.713 -8.652 -0.880 1.00 . A A . 28 MET CE 1 1
1 469 1 1 28 MET CG C 16.211 -6.098 -0.095 1.00 . A A . 28 MET CG 1 1
1 470 1 1 28 MET H H 15.709 -2.963 0.013 1.00 . A A . 28 MET H 1 1
1 471 1 1 28 MET HA H 18.052 -4.515 0.539 1.00 . A A . 28 MET HA 1 1
1 472 1 1 28 MET HB2 H 15.804 -4.455 -1.417 1.00 . A A . 28 MET HB2 1 1
1 473 1 1 28 MET HB3 H 17.211 -5.418 -1.866 1.00 . A A . 28 MET HB3 1 1
1 474 1 1 28 MET HE1 H 15.078 -9.384 -1.360 1.00 . A A . 28 MET HE1 1 1
1 475 1 1 28 MET HE2 H 15.909 -8.959 0.134 1.00 . A A . 28 MET HE2 1 1
1 476 1 1 28 MET HE3 H 16.648 -8.570 -1.417 1.00 . A A . 28 MET HE3 1 1
1 477 1 1 28 MET HG2 H 17.043 -6.752 0.118 1.00 . A A . 28 MET HG2 1 1
1 478 1 1 28 MET HG3 H 15.850 -5.662 0.825 1.00 . A A . 28 MET HG3 1 1
1 479 1 1 28 MET N N 16.667 -2.934 0.224 1.00 . A A . 28 MET N 1 1
1 480 1 1 28 MET O O 18.285 -2.821 -2.238 1.00 . A A . 28 MET O 1 1
1 481 1 1 28 MET SD S 14.880 -7.045 -0.877 1.00 . A A . 28 MET SD 1 1
1 482 1 1 29 PRO C C 21.206 -3.927 -2.951 1.00 . A A . 29 PRO C 1 1
1 483 1 1 29 PRO CA C 20.995 -3.056 -1.703 1.00 . A A . 29 PRO CA 1 1
1 484 1 1 29 PRO CB C 22.204 -3.139 -0.773 1.00 . A A . 29 PRO CB 1 1
1 485 1 1 29 PRO CD C 20.371 -4.281 0.326 1.00 . A A . 29 PRO CD 1 1
1 486 1 1 29 PRO CG C 21.873 -4.220 0.208 1.00 . A A . 29 PRO CG 1 1
1 487 1 1 29 PRO HA H 20.811 -2.030 -1.979 1.00 . A A . 29 PRO HA 1 1
1 488 1 1 29 PRO HB2 H 23.092 -3.397 -1.335 1.00 . A A . 29 PRO HB2 1 1
1 489 1 1 29 PRO HB3 H 22.344 -2.203 -0.256 1.00 . A A . 29 PRO HB3 1 1
1 490 1 1 29 PRO HD2 H 20.036 -5.309 0.334 1.00 . A A . 29 PRO HD2 1 1
1 491 1 1 29 PRO HD3 H 20.041 -3.766 1.214 1.00 . A A . 29 PRO HD3 1 1
1 492 1 1 29 PRO HG2 H 22.255 -5.167 -0.149 1.00 . A A . 29 PRO HG2 1 1
1 493 1 1 29 PRO HG3 H 22.303 -3.988 1.170 1.00 . A A . 29 PRO HG3 1 1
1 494 1 1 29 PRO N N 19.881 -3.586 -0.873 1.00 . A A . 29 PRO N 1 1
1 495 1 1 29 PRO O O 20.495 -4.890 -3.174 1.00 . A A . 29 PRO O 1 1
1 496 1 1 30 GLN C C 22.987 -5.786 -4.612 1.00 . A A . 30 GLN C 1 1
1 497 1 1 30 GLN CA C 22.442 -4.403 -4.995 1.00 . A A . 30 GLN CA 1 1
1 498 1 1 30 GLN CB C 23.487 -3.609 -5.786 1.00 . A A . 30 GLN CB 1 1
1 499 1 1 30 GLN CD C 24.663 -4.892 -7.585 1.00 . A A . 30 GLN CD 1 1
1 500 1 1 30 GLN CG C 23.443 -4.026 -7.260 1.00 . A A . 30 GLN CG 1 1
1 501 1 1 30 GLN H H 22.741 -2.817 -3.560 1.00 . A A . 30 GLN H 1 1
1 502 1 1 30 GLN HA H 21.538 -4.504 -5.576 1.00 . A A . 30 GLN HA 1 1
1 503 1 1 30 GLN HB2 H 23.274 -2.553 -5.704 1.00 . A A . 30 GLN HB2 1 1
1 504 1 1 30 GLN HB3 H 24.470 -3.810 -5.386 1.00 . A A . 30 GLN HB3 1 1
1 505 1 1 30 GLN HE21 H 23.715 -6.609 -7.267 1.00 . A A . 30 GLN HE21 1 1
1 506 1 1 30 GLN HE22 H 25.341 -6.752 -7.730 1.00 . A A . 30 GLN HE22 1 1
1 507 1 1 30 GLN HG2 H 22.540 -4.588 -7.449 1.00 . A A . 30 GLN HG2 1 1
1 508 1 1 30 GLN HG3 H 23.455 -3.144 -7.883 1.00 . A A . 30 GLN HG3 1 1
1 509 1 1 30 GLN N N 22.180 -3.595 -3.763 1.00 . A A . 30 GLN N 1 1
1 510 1 1 30 GLN NE2 N 24.565 -6.192 -7.522 1.00 . A A . 30 GLN NE2 1 1
1 511 1 1 30 GLN O O 24.074 -5.908 -4.079 1.00 . A A . 30 GLN O 1 1
1 512 1 1 30 GLN OE1 O 25.718 -4.379 -7.901 1.00 . A A . 30 GLN OE1 1 1
1 513 1 1 31 LEU C C 22.479 -9.152 -5.718 1.00 . A A . 31 LEU C 1 1
1 514 1 1 31 LEU CA C 22.693 -8.203 -4.530 1.00 . A A . 31 LEU CA 1 1
1 515 1 1 31 LEU CB C 21.824 -8.623 -3.341 1.00 . A A . 31 LEU CB 1 1
1 516 1 1 31 LEU CD1 C 22.364 -9.550 -1.081 1.00 . A A . 31 LEU CD1 1 1
1 517 1 1 31 LEU CD2 C 21.825 -11.097 -2.968 1.00 . A A . 31 LEU CD2 1 1
1 518 1 1 31 LEU CG C 22.499 -9.775 -2.589 1.00 . A A . 31 LEU CG 1 1
1 519 1 1 31 LEU H H 21.360 -6.695 -5.304 1.00 . A A . 31 LEU H 1 1
1 520 1 1 31 LEU HA H 23.732 -8.192 -4.241 1.00 . A A . 31 LEU HA 1 1
1 521 1 1 31 LEU HB2 H 21.698 -7.781 -2.674 1.00 . A A . 31 LEU HB2 1 1
1 522 1 1 31 LEU HB3 H 20.857 -8.945 -3.698 1.00 . A A . 31 LEU HB3 1 1
1 523 1 1 31 LEU HD11 H 23.012 -8.741 -0.778 1.00 . A A . 31 LEU HD11 1 1
1 524 1 1 31 LEU HD12 H 22.645 -10.452 -0.556 1.00 . A A . 31 LEU HD12 1 1
1 525 1 1 31 LEU HD13 H 21.341 -9.300 -0.844 1.00 . A A . 31 LEU HD13 1 1
1 526 1 1 31 LEU HD21 H 22.059 -11.338 -3.995 1.00 . A A . 31 LEU HD21 1 1
1 527 1 1 31 LEU HD22 H 20.755 -11.001 -2.856 1.00 . A A . 31 LEU HD22 1 1
1 528 1 1 31 LEU HD23 H 22.186 -11.883 -2.322 1.00 . A A . 31 LEU HD23 1 1
1 529 1 1 31 LEU HG H 23.546 -9.813 -2.854 1.00 . A A . 31 LEU HG 1 1
1 530 1 1 31 LEU N N 22.233 -6.823 -4.877 1.00 . A A . 31 LEU N 1 1
1 531 1 1 31 LEU O O 21.463 -9.024 -6.383 1.00 . A A . 31 LEU O 1 1
1 532 1 1 31 LEU OXT O 23.336 -9.993 -5.939 1.00 . A A . 31 LEU OXT 1 1
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