NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
378151 |
1gw4   |
cing | 4-filtered-FRED | STAR | entry | full | 347 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1gw4
# This FRED archive file contains, for PDB entry <1gw4>:
#
# - 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_1gw4
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1gw4
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 5141.70
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 $APOA_I A . 1 1
stop_
save_
save_APOA_I
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "APOA I"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code SPLGEEMRDRARAHVDALRTHLAPYSDELRQRLAARLEALKENGGA
_Entity.Number_of_monomers 46
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 PRO . 1 1
3 LEU . 1 1
4 GLY . 1 1
5 GLU . 1 1
6 GLU . 1 1
7 MET . 1 1
8 ARG . 1 1
9 ASP . 1 1
10 ARG . 1 1
11 ALA . 1 1
12 ARG . 1 1
13 ALA . 1 1
14 HIS . 1 1
15 VAL . 1 1
16 ASP . 1 1
17 ALA . 1 1
18 LEU . 1 1
19 ARG . 1 1
20 THR . 1 1
21 HIS . 1 1
22 LEU . 1 1
23 ALA . 1 1
24 PRO . 1 1
25 TYR . 1 1
26 SER . 1 1
27 ASP . 1 1
28 GLU . 1 1
29 LEU . 1 1
30 ARG . 1 1
31 GLN . 1 1
32 ARG . 1 1
33 LEU . 1 1
34 ALA . 1 1
35 ALA . 1 1
36 ARG . 1 1
37 LEU . 1 1
38 GLU . 1 1
39 ALA . 1 1
40 LEU . 1 1
41 LYS . 1 1
42 GLU . 1 1
43 ASN . 1 1
44 GLY . 1 1
45 GLY . 1 1
46 ALA . 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
PRO 2 2 1 1
LEU 3 3 1 1
GLY 4 4 1 1
GLU 5 5 1 1
GLU 6 6 1 1
MET 7 7 1 1
ARG 8 8 1 1
ASP 9 9 1 1
ARG 10 10 1 1
ALA 11 11 1 1
ARG 12 12 1 1
ALA 13 13 1 1
HIS 14 14 1 1
VAL 15 15 1 1
ASP 16 16 1 1
ALA 17 17 1 1
LEU 18 18 1 1
ARG 19 19 1 1
THR 20 20 1 1
HIS 21 21 1 1
LEU 22 22 1 1
ALA 23 23 1 1
PRO 24 24 1 1
TYR 25 25 1 1
SER 26 26 1 1
ASP 27 27 1 1
GLU 28 28 1 1
LEU 29 29 1 1
ARG 30 30 1 1
GLN 31 31 1 1
ARG 32 32 1 1
LEU 33 33 1 1
ALA 34 34 1 1
ALA 35 35 1 1
ARG 36 36 1 1
LEU 37 37 1 1
GLU 38 38 1 1
ALA 39 39 1 1
LEU 40 40 1 1
LYS 41 41 1 1
GLU 42 42 1 1
ASN 43 43 1 1
GLY 44 44 1 1
GLY 45 45 1 1
ALA 46 46 1 1
stop_
save_
save_Discover_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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27 1 . . . 1 1
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48 1 . . . 1 1
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340 1 . . . 1 1
341 1 . . . 1 1
342 1 . . . 1 1
343 1 . . . 1 1
344 1 . . . 1 1
345 1 . . . 1 1
346 1 . . . 1 1
347 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 1 SERN HA 1 1
1 1 2 1 1 4 GLY H 1 4 GLY HN 1 1
2 1 1 1 1 2 PRO HA 1 2 PRO HA 1 1
2 1 2 1 1 3 LEU H 1 3 LEU HN 1 1
3 1 1 1 1 2 PRO QB 1 2 PRO HB* 1 1
3 1 2 1 1 3 LEU H 1 3 LEU HN 1 1
4 1 1 1 1 2 PRO QD 1 2 PRO HD* 1 1
4 1 2 1 1 3 LEU H 1 3 LEU HN 1 1
5 1 1 1 1 2 PRO HG2 1 2 PRO HG2 1 1
5 1 2 1 1 3 LEU H 1 3 LEU HN 1 1
6 1 1 1 1 3 LEU H 1 3 LEU HN 1 1
6 1 2 1 1 3 LEU HA 1 3 LEU HA 1 1
7 1 1 1 1 3 LEU H 1 3 LEU HN 1 1
7 1 2 1 1 3 LEU HB2 1 3 LEU HB1 1 1
8 1 1 1 1 3 LEU H 1 3 LEU HN 1 1
8 1 2 1 1 3 LEU HB3 1 3 LEU HB2 1 1
9 1 1 1 1 3 LEU HA 1 3 LEU HA 1 1
9 1 2 1 1 4 GLY H 1 4 GLY HN 1 1
10 1 1 1 1 3 LEU HB3 1 3 LEU HB2 1 1
10 1 2 1 1 4 GLY H 1 4 GLY HN 1 1
11 1 1 1 1 4 GLY QA 1 4 GLY HA* 1 1
11 1 2 1 1 7 MET H 1 7 MET HN 1 1
12 1 1 1 1 5 GLU H 1 5 GLU- HN 1 1
12 1 2 1 1 5 GLU QB 1 5 GLU- HB* 1 1
13 1 1 1 1 5 GLU H 1 5 GLU- HN 1 1
13 1 2 1 1 5 GLU HG2 1 5 GLU- HG2 1 1
14 1 1 1 1 5 GLU H 1 5 GLU- HN 1 1
14 1 2 1 1 5 GLU HG3 1 5 GLU- HG1 1 1
15 1 1 1 1 5 GLU H 1 5 GLU- HN 1 1
15 1 2 1 1 6 GLU H 1 6 GLU- HN 1 1
16 1 1 1 1 5 GLU HA 1 5 GLU- HA 1 1
16 1 2 1 1 7 MET H 1 7 MET HN 1 1
17 1 1 1 1 5 GLU HA 1 5 GLU- HA 1 1
17 1 2 1 1 8 ARG H 1 8 ARG+ HN 1 1
18 1 1 1 1 6 GLU H 1 6 GLU- HN 1 1
18 1 2 1 1 6 GLU HA 1 6 GLU- HA 1 1
19 1 1 1 1 6 GLU HA 1 6 GLU- HA 1 1
19 1 2 1 1 9 ASP HB2 1 9 ASP- HB1 1 1
20 1 1 1 1 6 GLU HB3 1 6 GLU- HB1 1 1
20 1 2 1 1 7 MET H 1 7 MET HN 1 1
21 1 1 1 1 7 MET H 1 7 MET HN 1 1
21 1 2 1 1 7 MET HA 1 7 MET HA 1 1
22 1 1 1 1 7 MET H 1 7 MET HN 1 1
22 1 2 1 1 7 MET HB3 1 7 MET HB1 1 1
23 1 1 1 1 7 MET H 1 7 MET HN 1 1
23 1 2 1 1 7 MET HG2 1 7 MET HG2 1 1
24 1 1 1 1 7 MET H 1 7 MET HN 1 1
24 1 2 1 1 7 MET HG3 1 7 MET HG1 1 1
25 1 1 1 1 7 MET HA 1 7 MET HA 1 1
25 1 2 1 1 10 ARG H 1 10 ARG+ HN 1 1
26 1 1 1 1 8 ARG H 1 8 ARG+ HN 1 1
26 1 2 1 1 8 ARG HA 1 8 ARG+ HA 1 1
27 1 1 1 1 8 ARG H 1 8 ARG+ HN 1 1
27 1 2 1 1 8 ARG HB2 1 8 ARG+ HB2 1 1
28 1 1 1 1 8 ARG H 1 8 ARG+ HN 1 1
28 1 2 1 1 8 ARG HB3 1 8 ARG+ HB1 1 1
29 1 1 1 1 8 ARG H 1 8 ARG+ HN 1 1
29 1 2 1 1 8 ARG HG3 1 8 ARG+ HG1 1 1
30 1 1 1 1 8 ARG H 1 8 ARG+ HN 1 1
30 1 2 1 1 9 ASP H 1 9 ASP- HN 1 1
31 1 1 1 1 8 ARG HA 1 8 ARG+ HA 1 1
31 1 2 1 1 8 ARG HB2 1 8 ARG+ HB2 1 1
32 1 1 1 1 8 ARG HA 1 8 ARG+ HA 1 1
32 1 2 1 1 8 ARG HE 1 8 ARG+ HE 1 1
33 1 1 1 1 8 ARG HA 1 8 ARG+ HA 1 1
33 1 2 1 1 8 ARG HG3 1 8 ARG+ HG1 1 1
34 1 1 1 1 8 ARG HA 1 8 ARG+ HA 1 1
34 1 2 1 1 11 ALA H 1 11 ALA HN 1 1
35 1 1 1 1 8 ARG HA 1 8 ARG+ HA 1 1
35 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1
36 1 1 1 1 8 ARG HA 1 8 ARG+ HA 1 1
36 1 2 1 1 12 ARG H 1 12 ARG+ HN 1 1
37 1 1 1 1 8 ARG HB2 1 8 ARG+ HB2 1 1
37 1 2 1 1 9 ASP H 1 9 ASP- HN 1 1
38 1 1 1 1 8 ARG HB3 1 8 ARG+ HB1 1 1
38 1 2 1 1 9 ASP H 1 9 ASP- HN 1 1
39 1 1 1 1 8 ARG HE 1 8 ARG+ HE 1 1
39 1 2 1 1 8 ARG HG2 1 8 ARG+ HG2 1 1
40 1 1 1 1 8 ARG HE 1 8 ARG+ HE 1 1
40 1 2 1 1 8 ARG HG3 1 8 ARG+ HG1 1 1
41 1 1 1 1 9 ASP H 1 9 ASP- HN 1 1
41 1 2 1 1 9 ASP HA 1 9 ASP- HA 1 1
42 1 1 1 1 9 ASP H 1 9 ASP- HN 1 1
42 1 2 1 1 9 ASP HB2 1 9 ASP- HB1 1 1
43 1 1 1 1 9 ASP H 1 9 ASP- HN 1 1
43 1 2 1 1 9 ASP HB3 1 9 ASP- HB2 1 1
44 1 1 1 1 9 ASP HA 1 9 ASP- HA 1 1
44 1 2 1 1 10 ARG H 1 10 ARG+ HN 1 1
45 1 1 1 1 9 ASP HA 1 9 ASP- HA 1 1
45 1 2 1 1 12 ARG H 1 12 ARG+ HN 1 1
46 1 1 1 1 9 ASP HA 1 9 ASP- HA 1 1
46 1 2 1 1 12 ARG QB 1 12 ARG+ HB* 1 1
47 1 1 1 1 9 ASP HB2 1 9 ASP- HB1 1 1
47 1 2 1 1 10 ARG H 1 10 ARG+ HN 1 1
48 1 1 1 1 9 ASP HB3 1 9 ASP- HB2 1 1
48 1 2 1 1 10 ARG H 1 10 ARG+ HN 1 1
49 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1
49 1 2 1 1 10 ARG HA 1 10 ARG+ HA 1 1
50 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1
50 1 2 1 1 10 ARG QB 1 10 ARG+ HB* 1 1
51 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1
51 1 2 1 1 10 ARG HG2 1 10 ARG+ HG2 1 1
52 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1
52 1 2 1 1 10 ARG HG3 1 10 ARG+ HG1 1 1
53 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1
53 1 2 1 1 11 ALA H 1 11 ALA HN 1 1
54 1 1 1 1 10 ARG HA 1 10 ARG+ HA 1 1
54 1 2 1 1 10 ARG HE 1 10 ARG+ HE 1 1
55 1 1 1 1 10 ARG QB 1 10 ARG+ HB* 1 1
55 1 2 1 1 11 ALA H 1 11 ALA HN 1 1
56 1 1 1 1 10 ARG HE 1 10 ARG+ HE 1 1
56 1 2 1 1 10 ARG HG3 1 10 ARG+ HG1 1 1
57 1 1 1 1 11 ALA H 1 11 ALA HN 1 1
57 1 2 1 1 11 ALA HA 1 11 ALA HA 1 1
58 1 1 1 1 11 ALA H 1 11 ALA HN 1 1
58 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1
59 1 1 1 1 11 ALA H 1 11 ALA HN 1 1
59 1 2 1 1 12 ARG H 1 12 ARG+ HN 1 1
60 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1
60 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
61 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1
61 1 2 1 1 14 HIS HB3 1 14 HIS HB1 1 1
62 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1
62 1 2 1 1 14 HIS HD2 1 14 HIS HD2 1 1
63 1 1 1 1 11 ALA MB 1 11 ALA HB* 1 1
63 1 2 1 1 12 ARG H 1 12 ARG+ HN 1 1
64 1 1 1 1 12 ARG H 1 12 ARG+ HN 1 1
64 1 2 1 1 12 ARG HA 1 12 ARG+ HA 1 1
65 1 1 1 1 12 ARG H 1 12 ARG+ HN 1 1
65 1 2 1 1 12 ARG QB 1 12 ARG+ HB* 1 1
66 1 1 1 1 12 ARG H 1 12 ARG+ HN 1 1
66 1 2 1 1 13 ALA H 1 13 ALA HN 1 1
67 1 1 1 1 12 ARG HA 1 12 ARG+ HA 1 1
67 1 2 1 1 12 ARG HE 1 12 ARG+ HE 1 1
68 1 1 1 1 12 ARG HA 1 12 ARG+ HA 1 1
68 1 2 1 1 13 ALA H 1 13 ALA HN 1 1
69 1 1 1 1 12 ARG HA 1 12 ARG+ HA 1 1
69 1 2 1 1 15 VAL H 1 15 VAL HN 1 1
70 1 1 1 1 12 ARG HA 1 12 ARG+ HA 1 1
70 1 2 1 1 15 VAL HB 1 15 VAL HB 1 1
71 1 1 1 1 12 ARG HA 1 12 ARG+ HA 1 1
71 1 2 1 1 15 VAL MG1 1 15 VAL HG1* 1 1
72 1 1 1 1 12 ARG HA 1 12 ARG+ HA 1 1
72 1 2 1 1 15 VAL MG2 1 15 VAL HG2* 1 1
73 1 1 1 1 12 ARG QB 1 12 ARG+ HB* 1 1
73 1 2 1 1 13 ALA H 1 13 ALA HN 1 1
74 1 1 1 1 12 ARG QD 1 12 ARG+ HD* 1 1
74 1 2 1 1 15 VAL MG1 1 15 VAL HG1* 1 1
75 1 1 1 1 12 ARG HE 1 12 ARG+ HE 1 1
75 1 2 1 1 12 ARG HG2 1 12 ARG+ HG2 1 1
76 1 1 1 1 12 ARG HE 1 12 ARG+ HE 1 1
76 1 2 1 1 12 ARG HG3 1 12 ARG+ HG1 1 1
77 1 1 1 1 12 ARG QH 1 12 ARG+ HH* 1 1
77 1 2 1 1 15 VAL MG2 1 15 VAL HG2* 1 1
78 1 1 1 1 13 ALA H 1 13 ALA HN 1 1
78 1 2 1 1 13 ALA HA 1 13 ALA HA 1 1
79 1 1 1 1 13 ALA H 1 13 ALA HN 1 1
79 1 2 1 1 13 ALA MB 1 13 ALA HB* 1 1
80 1 1 1 1 13 ALA H 1 13 ALA HN 1 1
80 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
81 1 1 1 1 13 ALA HA 1 13 ALA HA 1 1
81 1 2 1 1 16 ASP H 1 16 ASP- HN 1 1
82 1 1 1 1 13 ALA HA 1 13 ALA HA 1 1
82 1 2 1 1 16 ASP HB2 1 16 ASP- HB2 1 1
83 1 1 1 1 13 ALA MB 1 13 ALA HB* 1 1
83 1 2 1 1 14 HIS H 1 14 HIS HN 1 1
84 1 1 1 1 13 ALA MB 1 13 ALA HB* 1 1
84 1 2 1 1 14 HIS HA 1 14 HIS HA 1 1
85 1 1 1 1 13 ALA MB 1 13 ALA HB* 1 1
85 1 2 1 1 14 HIS HD2 1 14 HIS HD2 1 1
86 1 1 1 1 13 ALA MB 1 13 ALA HB* 1 1
86 1 2 1 1 15 VAL H 1 15 VAL HN 1 1
87 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
87 1 2 1 1 14 HIS HA 1 14 HIS HA 1 1
88 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
88 1 2 1 1 14 HIS HB2 1 14 HIS HB2 1 1
89 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
89 1 2 1 1 14 HIS HB3 1 14 HIS HB1 1 1
90 1 1 1 1 14 HIS H 1 14 HIS HN 1 1
90 1 2 1 1 14 HIS HD2 1 14 HIS HD2 1 1
91 1 1 1 1 14 HIS HA 1 14 HIS HA 1 1
91 1 2 1 1 17 ALA H 1 17 ALA HN 1 1
92 1 1 1 1 14 HIS HA 1 14 HIS HA 1 1
92 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1
93 1 1 1 1 14 HIS HA 1 14 HIS HA 1 1
93 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
94 1 1 1 1 14 HIS HB2 1 14 HIS HB2 1 1
94 1 2 1 1 15 VAL H 1 15 VAL HN 1 1
95 1 1 1 1 14 HIS HB3 1 14 HIS HB1 1 1
95 1 2 1 1 14 HIS HD2 1 14 HIS HD2 1 1
96 1 1 1 1 14 HIS HB3 1 14 HIS HB1 1 1
96 1 2 1 1 15 VAL H 1 15 VAL HN 1 1
97 1 1 1 1 14 HIS HD2 1 14 HIS HD2 1 1
97 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1
98 1 1 1 1 15 VAL H 1 15 VAL HN 1 1
98 1 2 1 1 15 VAL HA 1 15 VAL HA 1 1
99 1 1 1 1 15 VAL H 1 15 VAL HN 1 1
99 1 2 1 1 15 VAL HB 1 15 VAL HB 1 1
100 1 1 1 1 15 VAL H 1 15 VAL HN 1 1
100 1 2 1 1 15 VAL MG1 1 15 VAL HG1* 1 1
101 1 1 1 1 15 VAL H 1 15 VAL HN 1 1
101 1 2 1 1 16 ASP H 1 16 ASP- HN 1 1
102 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
102 1 2 1 1 15 VAL HB 1 15 VAL HB 1 1
103 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
103 1 2 1 1 15 VAL MG1 1 15 VAL HG1* 1 1
104 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
104 1 2 1 1 15 VAL MG2 1 15 VAL HG2* 1 1
105 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
105 1 2 1 1 16 ASP H 1 16 ASP- HN 1 1
106 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
106 1 2 1 1 17 ALA H 1 17 ALA HN 1 1
107 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
107 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
108 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
108 1 2 1 1 18 LEU HB2 1 18 LEU HB1 1 1
109 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
109 1 2 1 1 18 LEU HB3 1 18 LEU HB2 1 1
110 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
110 1 2 1 1 18 LEU MD1 1 18 LEU HD1* 1 1
111 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
111 1 2 1 1 18 LEU MD2 1 18 LEU HD2* 1 1
112 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
112 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
113 1 1 1 1 15 VAL HB 1 15 VAL HB 1 1
113 1 2 1 1 16 ASP H 1 16 ASP- HN 1 1
114 1 1 1 1 15 VAL MG1 1 15 VAL HG1* 1 1
114 1 2 1 1 16 ASP H 1 16 ASP- HN 1 1
115 1 1 1 1 15 VAL MG1 1 15 VAL HG1* 1 1
115 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
116 1 1 1 1 15 VAL MG2 1 15 VAL HG2* 1 1
116 1 2 1 1 16 ASP H 1 16 ASP- HN 1 1
117 1 1 1 1 15 VAL MG2 1 15 VAL HG2* 1 1
117 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
118 1 1 1 1 15 VAL MG2 1 15 VAL HG2* 1 1
118 1 2 1 1 19 ARG HE 1 19 ARG+ HE 1 1
119 1 1 1 1 16 ASP H 1 16 ASP- HN 1 1
119 1 2 1 1 16 ASP HA 1 16 ASP- HA 1 1
120 1 1 1 1 16 ASP H 1 16 ASP- HN 1 1
120 1 2 1 1 16 ASP HB2 1 16 ASP- HB2 1 1
121 1 1 1 1 16 ASP H 1 16 ASP- HN 1 1
121 1 2 1 1 16 ASP HB3 1 16 ASP- HB1 1 1
122 1 1 1 1 16 ASP H 1 16 ASP- HN 1 1
122 1 2 1 1 17 ALA H 1 17 ALA HN 1 1
123 1 1 1 1 16 ASP HA 1 16 ASP- HA 1 1
123 1 2 1 1 17 ALA H 1 17 ALA HN 1 1
124 1 1 1 1 16 ASP HA 1 16 ASP- HA 1 1
124 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
125 1 1 1 1 16 ASP HA 1 16 ASP- HA 1 1
125 1 2 1 1 19 ARG HB3 1 19 ARG+ HB1 1 1
126 1 1 1 1 16 ASP HA 1 16 ASP- HA 1 1
126 1 2 1 1 19 ARG HE 1 19 ARG+ HE 1 1
127 1 1 1 1 16 ASP HB2 1 16 ASP- HB2 1 1
127 1 2 1 1 17 ALA H 1 17 ALA HN 1 1
128 1 1 1 1 16 ASP HB3 1 16 ASP- HB1 1 1
128 1 2 1 1 17 ALA H 1 17 ALA HN 1 1
129 1 1 1 1 17 ALA H 1 17 ALA HN 1 1
129 1 2 1 1 17 ALA HA 1 17 ALA HA 1 1
130 1 1 1 1 17 ALA H 1 17 ALA HN 1 1
130 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1
131 1 1 1 1 17 ALA H 1 17 ALA HN 1 1
131 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
132 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1
132 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
133 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1
133 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
134 1 1 1 1 17 ALA MB 1 17 ALA HB* 1 1
134 1 2 1 1 18 LEU H 1 18 LEU HN 1 1
135 1 1 1 1 18 LEU H 1 18 LEU HN 1 1
135 1 2 1 1 18 LEU HA 1 18 LEU HA 1 1
136 1 1 1 1 18 LEU H 1 18 LEU HN 1 1
136 1 2 1 1 18 LEU MD1 1 18 LEU HD1* 1 1
137 1 1 1 1 18 LEU H 1 18 LEU HN 1 1
137 1 2 1 1 18 LEU MD2 1 18 LEU HD2* 1 1
138 1 1 1 1 18 LEU H 1 18 LEU HN 1 1
138 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
139 1 1 1 1 18 LEU HA 1 18 LEU HA 1 1
139 1 2 1 1 18 LEU HB3 1 18 LEU HB2 1 1
140 1 1 1 1 18 LEU HA 1 18 LEU HA 1 1
140 1 2 1 1 18 LEU MD1 1 18 LEU HD1* 1 1
141 1 1 1 1 18 LEU HA 1 18 LEU HA 1 1
141 1 2 1 1 18 LEU MD2 1 18 LEU HD2* 1 1
142 1 1 1 1 18 LEU HA 1 18 LEU HA 1 1
142 1 2 1 1 21 HIS H 1 21 HIS HN 1 1
143 1 1 1 1 18 LEU HA 1 18 LEU HA 1 1
143 1 2 1 1 21 HIS HB2 1 21 HIS HB2 1 1
144 1 1 1 1 18 LEU HA 1 18 LEU HA 1 1
144 1 2 1 1 21 HIS HD2 1 21 HIS HD2 1 1
145 1 1 1 1 18 LEU HB2 1 18 LEU HB1 1 1
145 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
146 1 1 1 1 18 LEU HB3 1 18 LEU HB2 1 1
146 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
147 1 1 1 1 18 LEU MD2 1 18 LEU HD2* 1 1
147 1 2 1 1 19 ARG H 1 19 ARG+ HN 1 1
148 1 1 1 1 19 ARG H 1 19 ARG+ HN 1 1
148 1 2 1 1 19 ARG HA 1 19 ARG+ HA 1 1
149 1 1 1 1 19 ARG H 1 19 ARG+ HN 1 1
149 1 2 1 1 19 ARG HB2 1 19 ARG+ HB2 1 1
150 1 1 1 1 19 ARG H 1 19 ARG+ HN 1 1
150 1 2 1 1 19 ARG HB3 1 19 ARG+ HB1 1 1
151 1 1 1 1 19 ARG H 1 19 ARG+ HN 1 1
151 1 2 1 1 19 ARG QD 1 19 ARG+ HD* 1 1
152 1 1 1 1 19 ARG H 1 19 ARG+ HN 1 1
152 1 2 1 1 19 ARG HG2 1 19 ARG+ HG2 1 1
153 1 1 1 1 19 ARG H 1 19 ARG+ HN 1 1
153 1 2 1 1 20 THR H 1 20 THR HN 1 1
154 1 1 1 1 19 ARG HA 1 19 ARG+ HA 1 1
154 1 2 1 1 19 ARG HE 1 19 ARG+ HE 1 1
155 1 1 1 1 19 ARG HA 1 19 ARG+ HA 1 1
155 1 2 1 1 19 ARG HG2 1 19 ARG+ HG2 1 1
156 1 1 1 1 19 ARG HA 1 19 ARG+ HA 1 1
156 1 2 1 1 19 ARG HG3 1 19 ARG+ HG1 1 1
157 1 1 1 1 19 ARG HA 1 19 ARG+ HA 1 1
157 1 2 1 1 20 THR H 1 20 THR HN 1 1
158 1 1 1 1 19 ARG HA 1 19 ARG+ HA 1 1
158 1 2 1 1 21 HIS H 1 21 HIS HN 1 1
159 1 1 1 1 19 ARG HA 1 19 ARG+ HA 1 1
159 1 2 1 1 23 ALA H 1 23 ALA HN 1 1
160 1 1 1 1 19 ARG HB2 1 19 ARG+ HB2 1 1
160 1 2 1 1 19 ARG HE 1 19 ARG+ HE 1 1
161 1 1 1 1 19 ARG HB2 1 19 ARG+ HB2 1 1
161 1 2 1 1 20 THR H 1 20 THR HN 1 1
162 1 1 1 1 19 ARG HB3 1 19 ARG+ HB1 1 1
162 1 2 1 1 19 ARG HE 1 19 ARG+ HE 1 1
163 1 1 1 1 19 ARG HB3 1 19 ARG+ HB1 1 1
163 1 2 1 1 20 THR H 1 20 THR HN 1 1
164 1 1 1 1 19 ARG QD 1 19 ARG+ HD* 1 1
164 1 2 1 1 22 LEU QD 1 22 LEU HD* 1 1
165 1 1 1 1 19 ARG HE 1 19 ARG+ HE 1 1
165 1 2 1 1 19 ARG HG2 1 19 ARG+ HG2 1 1
166 1 1 1 1 19 ARG HE 1 19 ARG+ HE 1 1
166 1 2 1 1 19 ARG HG3 1 19 ARG+ HG1 1 1
167 1 1 1 1 20 THR H 1 20 THR HN 1 1
167 1 2 1 1 20 THR HA 1 20 THR HA 1 1
168 1 1 1 1 20 THR H 1 20 THR HN 1 1
168 1 2 1 1 20 THR HB 1 20 THR HB 1 1
169 1 1 1 1 20 THR H 1 20 THR HN 1 1
169 1 2 1 1 20 THR HG1 1 20 THR HG* 1 1
169 1 2 1 1 20 THR MG 1 20 THR HG* 1 1
170 1 1 1 1 20 THR H 1 20 THR HN 1 1
170 1 2 1 1 21 HIS H 1 21 HIS HN 1 1
171 1 1 1 1 20 THR HA 1 20 THR HA 1 1
171 1 2 1 1 20 THR HG1 1 20 THR HG* 1 1
171 1 2 1 1 20 THR MG 1 20 THR HG* 1 1
172 1 1 1 1 20 THR HA 1 20 THR HA 1 1
172 1 2 1 1 21 HIS H 1 21 HIS HN 1 1
173 1 1 1 1 20 THR HA 1 20 THR HA 1 1
173 1 2 1 1 23 ALA H 1 23 ALA HN 1 1
174 1 1 1 1 20 THR HA 1 20 THR HA 1 1
174 1 2 1 1 23 ALA MB 1 23 ALA HB* 1 1
175 1 1 1 1 20 THR HB 1 20 THR HB 1 1
175 1 2 1 1 21 HIS H 1 21 HIS HN 1 1
176 1 1 1 1 20 THR HG1 1 20 THR HG* 1 1
176 1 1 1 1 20 THR MG 1 20 THR HG* 1 1
176 1 2 1 1 21 HIS H 1 21 HIS HN 1 1
177 1 1 1 1 20 THR HG1 1 20 THR HG* 1 1
177 1 1 1 1 20 THR MG 1 20 THR HG* 1 1
177 1 2 1 1 21 HIS HD2 1 21 HIS HD2 1 1
178 1 1 1 1 21 HIS H 1 21 HIS HN 1 1
178 1 2 1 1 21 HIS HA 1 21 HIS HA 1 1
179 1 1 1 1 21 HIS H 1 21 HIS HN 1 1
179 1 2 1 1 22 LEU H 1 22 LEU HN 1 1
180 1 1 1 1 21 HIS HA 1 21 HIS HA 1 1
180 1 2 1 1 22 LEU H 1 22 LEU HN 1 1
181 1 1 1 1 21 HIS HA 1 21 HIS HA 1 1
181 1 2 1 1 23 ALA MB 1 23 ALA HB* 1 1
182 1 1 1 1 21 HIS HB2 1 21 HIS HB2 1 1
182 1 2 1 1 22 LEU H 1 22 LEU HN 1 1
183 1 1 1 1 21 HIS HB3 1 21 HIS HB1 1 1
183 1 2 1 1 21 HIS HD2 1 21 HIS HD2 1 1
184 1 1 1 1 21 HIS HB3 1 21 HIS HB1 1 1
184 1 2 1 1 22 LEU H 1 22 LEU HN 1 1
185 1 1 1 1 21 HIS HD2 1 21 HIS HD2 1 1
185 1 2 1 1 22 LEU QD 1 22 LEU HD* 1 1
186 1 1 1 1 22 LEU H 1 22 LEU HN 1 1
186 1 2 1 1 22 LEU HA 1 22 LEU HA 1 1
187 1 1 1 1 22 LEU H 1 22 LEU HN 1 1
187 1 2 1 1 22 LEU QB 1 22 LEU HB* 1 1
188 1 1 1 1 22 LEU H 1 22 LEU HN 1 1
188 1 2 1 1 22 LEU HG 1 22 LEU HG 1 1
189 1 1 1 1 22 LEU H 1 22 LEU HN 1 1
189 1 2 1 1 23 ALA H 1 23 ALA HN 1 1
190 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
190 1 2 1 1 22 LEU QD 1 22 LEU HD* 1 1
191 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
191 1 2 1 1 22 LEU HG 1 22 LEU HG 1 1
192 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
192 1 2 1 1 23 ALA H 1 23 ALA HN 1 1
193 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
193 1 2 1 1 23 ALA MB 1 23 ALA HB* 1 1
194 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
194 1 2 1 1 25 TYR H 1 25 TYR HN 1 1
195 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
195 1 2 1 1 25 TYR HB2 1 25 TYR HB2 1 1
196 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
196 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
197 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1
197 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
198 1 1 1 1 22 LEU QB 1 22 LEU HB* 1 1
198 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
199 1 1 1 1 22 LEU QD 1 22 LEU HD* 1 1
199 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
200 1 1 1 1 22 LEU QD 1 22 LEU HD* 1 1
200 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
201 1 1 1 1 22 LEU HG 1 22 LEU HG 1 1
201 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
202 1 1 1 1 23 ALA H 1 23 ALA HN 1 1
202 1 2 1 1 23 ALA HA 1 23 ALA HA 1 1
203 1 1 1 1 23 ALA H 1 23 ALA HN 1 1
203 1 2 1 1 23 ALA MB 1 23 ALA HB* 1 1
204 1 1 1 1 23 ALA H 1 23 ALA HN 1 1
204 1 2 1 1 24 PRO HD2 1 24 PRO HD2 1 1
205 1 1 1 1 23 ALA H 1 23 ALA HN 1 1
205 1 2 1 1 24 PRO HD3 1 24 PRO HD1 1 1
206 1 1 1 1 23 ALA HA 1 23 ALA HA 1 1
206 1 2 1 1 24 PRO HD2 1 24 PRO HD2 1 1
207 1 1 1 1 23 ALA HA 1 23 ALA HA 1 1
207 1 2 1 1 26 SER H 1 26 SER HN 1 1
208 1 1 1 1 23 ALA MB 1 23 ALA HB* 1 1
208 1 2 1 1 24 PRO HD2 1 24 PRO HD2 1 1
209 1 1 1 1 23 ALA MB 1 23 ALA HB* 1 1
209 1 2 1 1 24 PRO HD3 1 24 PRO HD1 1 1
210 1 1 1 1 24 PRO HA 1 24 PRO HA 1 1
210 1 2 1 1 24 PRO HB3 1 24 PRO HB1 1 1
211 1 1 1 1 24 PRO HA 1 24 PRO HA 1 1
211 1 2 1 1 25 TYR H 1 25 TYR HN 1 1
212 1 1 1 1 24 PRO HA 1 24 PRO HA 1 1
212 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
213 1 1 1 1 24 PRO HB2 1 24 PRO HB2 1 1
213 1 2 1 1 25 TYR H 1 25 TYR HN 1 1
214 1 1 1 1 24 PRO HB2 1 24 PRO HB2 1 1
214 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
215 1 1 1 1 24 PRO HB3 1 24 PRO HB1 1 1
215 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
216 1 1 1 1 24 PRO HB3 1 24 PRO HB1 1 1
216 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
217 1 1 1 1 24 PRO HD2 1 24 PRO HD2 1 1
217 1 2 1 1 25 TYR H 1 25 TYR HN 1 1
218 1 1 1 1 24 PRO HD2 1 24 PRO HD2 1 1
218 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
219 1 1 1 1 24 PRO HD2 1 24 PRO HD2 1 1
219 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
220 1 1 1 1 24 PRO HD3 1 24 PRO HD1 1 1
220 1 2 1 1 25 TYR H 1 25 TYR HN 1 1
221 1 1 1 1 24 PRO HD3 1 24 PRO HD1 1 1
221 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
222 1 1 1 1 24 PRO QG 1 24 PRO HG* 1 1
222 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
223 1 1 1 1 24 PRO QG 1 24 PRO HG* 1 1
223 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
224 1 1 1 1 25 TYR H 1 25 TYR HN 1 1
224 1 2 1 1 25 TYR HB2 1 25 TYR HB2 1 1
225 1 1 1 1 25 TYR H 1 25 TYR HN 1 1
225 1 2 1 1 25 TYR HB3 1 25 TYR HB1 1 1
226 1 1 1 1 25 TYR H 1 25 TYR HN 1 1
226 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
227 1 1 1 1 25 TYR H 1 25 TYR HN 1 1
227 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1
228 1 1 1 1 25 TYR HA 1 25 TYR HA 1 1
228 1 2 1 1 26 SER H 1 26 SER HN 1 1
229 1 1 1 1 25 TYR HA 1 25 TYR HA 1 1
229 1 2 1 1 27 ASP H 1 27 ASP- HN 1 1
230 1 1 1 1 25 TYR HB2 1 25 TYR HB2 1 1
230 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
231 1 1 1 1 25 TYR HB2 1 25 TYR HB2 1 1
231 1 2 1 1 26 SER H 1 26 SER HN 1 1
232 1 1 1 1 25 TYR HB2 1 25 TYR HB2 1 1
232 1 2 1 1 29 LEU QD 1 29 LEU HD* 1 1
233 1 1 1 1 25 TYR HB3 1 25 TYR HB1 1 1
233 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1
234 1 1 1 1 25 TYR HB3 1 25 TYR HB1 1 1
234 1 2 1 1 26 SER H 1 26 SER HN 1 1
235 1 1 1 1 25 TYR HB3 1 25 TYR HB1 1 1
235 1 2 1 1 29 LEU QD 1 29 LEU HD* 1 1
236 1 1 1 1 25 TYR QD 1 25 TYR HD* 1 1
236 1 2 1 1 26 SER H 1 26 SER HN 1 1
237 1 1 1 1 27 ASP HA 1 27 ASP- HA 1 1
237 1 2 1 1 30 ARG QB 1 30 ARG+ HB* 1 1
238 1 1 1 1 27 ASP HA 1 27 ASP- HA 1 1
238 1 2 1 1 30 ARG HE 1 30 ARG+ HE 1 1
239 1 1 1 1 28 GLU HA 1 28 GLU- HA 1 1
239 1 2 1 1 28 GLU HB3 1 28 GLU- HB1 1 1
240 1 1 1 1 28 GLU HA 1 28 GLU- HA 1 1
240 1 2 1 1 29 LEU H 1 29 LEU HN 1 1
241 1 1 1 1 28 GLU HB3 1 28 GLU- HB1 1 1
241 1 2 1 1 29 LEU H 1 29 LEU HN 1 1
242 1 1 1 1 29 LEU H 1 29 LEU HN 1 1
242 1 2 1 1 29 LEU HA 1 29 LEU HA 1 1
243 1 1 1 1 29 LEU H 1 29 LEU HN 1 1
243 1 2 1 1 29 LEU QB 1 29 LEU HB* 1 1
244 1 1 1 1 29 LEU H 1 29 LEU HN 1 1
244 1 2 1 1 29 LEU HG 1 29 LEU HG 1 1
245 1 1 1 1 29 LEU H 1 29 LEU HN 1 1
245 1 2 1 1 30 ARG H 1 30 ARG+ HN 1 1
246 1 1 1 1 29 LEU HA 1 29 LEU HA 1 1
246 1 2 1 1 29 LEU HG 1 29 LEU HG 1 1
247 1 1 1 1 29 LEU HA 1 29 LEU HA 1 1
247 1 2 1 1 32 ARG H 1 32 ARG+ HN 1 1
248 1 1 1 1 29 LEU HA 1 29 LEU HA 1 1
248 1 2 1 1 32 ARG HB2 1 32 ARG+ HB2 1 1
249 1 1 1 1 29 LEU QB 1 29 LEU HB* 1 1
249 1 2 1 1 30 ARG H 1 30 ARG+ HN 1 1
250 1 1 1 1 30 ARG H 1 30 ARG+ HN 1 1
250 1 2 1 1 30 ARG HA 1 30 ARG+ HA 1 1
251 1 1 1 1 30 ARG H 1 30 ARG+ HN 1 1
251 1 2 1 1 30 ARG QB 1 30 ARG+ HB* 1 1
252 1 1 1 1 30 ARG H 1 30 ARG+ HN 1 1
252 1 2 1 1 31 GLN H 1 31 GLN HN 1 1
253 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
253 1 2 1 1 30 ARG HE 1 30 ARG+ HE 1 1
254 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
254 1 2 1 1 30 ARG HG2 1 30 ARG+ HG2 1 1
255 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
255 1 2 1 1 30 ARG HG3 1 30 ARG+ HG1 1 1
256 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
256 1 2 1 1 33 LEU H 1 33 LEU HN 1 1
257 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
257 1 2 1 1 33 LEU QB 1 33 LEU HB* 1 1
258 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
258 1 2 1 1 33 LEU QD 1 33 LEU HD* 1 1
259 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
259 1 2 1 1 33 LEU HG 1 33 LEU HG 1 1
260 1 1 1 1 30 ARG HA 1 30 ARG+ HA 1 1
260 1 2 1 1 34 ALA H 1 34 ALA HN 1 1
261 1 1 1 1 30 ARG QB 1 30 ARG+ HB* 1 1
261 1 2 1 1 31 GLN H 1 31 GLN HN 1 1
262 1 1 1 1 30 ARG QD 1 30 ARG+ HD* 1 1
262 1 2 1 1 33 LEU QD 1 33 LEU HD* 1 1
263 1 1 1 1 30 ARG HE 1 30 ARG+ HE 1 1
263 1 2 1 1 30 ARG HG2 1 30 ARG+ HG2 1 1
264 1 1 1 1 30 ARG HE 1 30 ARG+ HE 1 1
264 1 2 1 1 30 ARG HG3 1 30 ARG+ HG1 1 1
265 1 1 1 1 31 GLN H 1 31 GLN HN 1 1
265 1 2 1 1 31 GLN HA 1 31 GLN HA 1 1
266 1 1 1 1 31 GLN H 1 31 GLN HN 1 1
266 1 2 1 1 31 GLN QB 1 31 GLN HB* 1 1
267 1 1 1 1 31 GLN H 1 31 GLN HN 1 1
267 1 2 1 1 31 GLN HG2 1 31 GLN HG2 1 1
268 1 1 1 1 31 GLN H 1 31 GLN HN 1 1
268 1 2 1 1 31 GLN HG3 1 31 GLN HG1 1 1
269 1 1 1 1 31 GLN H 1 31 GLN HN 1 1
269 1 2 1 1 32 ARG H 1 32 ARG+ HN 1 1
270 1 1 1 1 31 GLN HA 1 31 GLN HA 1 1
270 1 2 1 1 34 ALA H 1 34 ALA HN 1 1
271 1 1 1 1 31 GLN HA 1 31 GLN HA 1 1
271 1 2 1 1 34 ALA MB 1 34 ALA HB* 1 1
272 1 1 1 1 31 GLN QB 1 31 GLN HB* 1 1
272 1 2 1 1 32 ARG H 1 32 ARG+ HN 1 1
273 1 1 1 1 32 ARG H 1 32 ARG+ HN 1 1
273 1 2 1 1 32 ARG HA 1 32 ARG+ HA 1 1
274 1 1 1 1 32 ARG H 1 32 ARG+ HN 1 1
274 1 2 1 1 32 ARG QG 1 32 ARG+ HG* 1 1
275 1 1 1 1 32 ARG H 1 32 ARG+ HN 1 1
275 1 2 1 1 33 LEU H 1 33 LEU HN 1 1
276 1 1 1 1 32 ARG HA 1 32 ARG+ HA 1 1
276 1 2 1 1 32 ARG HB2 1 32 ARG+ HB2 1 1
277 1 1 1 1 32 ARG HA 1 32 ARG+ HA 1 1
277 1 2 1 1 32 ARG HB3 1 32 ARG+ HB1 1 1
278 1 1 1 1 32 ARG HA 1 32 ARG+ HA 1 1
278 1 2 1 1 32 ARG HE 1 32 ARG+ HE 1 1
279 1 1 1 1 32 ARG HA 1 32 ARG+ HA 1 1
279 1 2 1 1 32 ARG QG 1 32 ARG+ HG* 1 1
280 1 1 1 1 32 ARG HA 1 32 ARG+ HA 1 1
280 1 2 1 1 33 LEU H 1 33 LEU HN 1 1
281 1 1 1 1 33 LEU H 1 33 LEU HN 1 1
281 1 2 1 1 33 LEU HA 1 33 LEU HA 1 1
282 1 1 1 1 33 LEU H 1 33 LEU HN 1 1
282 1 2 1 1 33 LEU QB 1 33 LEU HB* 1 1
283 1 1 1 1 33 LEU H 1 33 LEU HN 1 1
283 1 2 1 1 33 LEU QD 1 33 LEU HD* 1 1
284 1 1 1 1 33 LEU H 1 33 LEU HN 1 1
284 1 2 1 1 33 LEU HG 1 33 LEU HG 1 1
285 1 1 1 1 33 LEU H 1 33 LEU HN 1 1
285 1 2 1 1 34 ALA H 1 34 ALA HN 1 1
286 1 1 1 1 33 LEU HA 1 33 LEU HA 1 1
286 1 2 1 1 33 LEU QD 1 33 LEU HD* 1 1
287 1 1 1 1 33 LEU HA 1 33 LEU HA 1 1
287 1 2 1 1 33 LEU HG 1 33 LEU HG 1 1
288 1 1 1 1 33 LEU HA 1 33 LEU HA 1 1
288 1 2 1 1 34 ALA H 1 34 ALA HN 1 1
289 1 1 1 1 33 LEU HA 1 33 LEU HA 1 1
289 1 2 1 1 36 ARG H 1 36 ARG+ HN 1 1
290 1 1 1 1 33 LEU HA 1 33 LEU HA 1 1
290 1 2 1 1 36 ARG HB3 1 36 ARG+ HB1 1 1
291 1 1 1 1 33 LEU QB 1 33 LEU HB* 1 1
291 1 2 1 1 34 ALA H 1 34 ALA HN 1 1
292 1 1 1 1 34 ALA H 1 34 ALA HN 1 1
292 1 2 1 1 34 ALA HA 1 34 ALA HA 1 1
293 1 1 1 1 34 ALA H 1 34 ALA HN 1 1
293 1 2 1 1 34 ALA MB 1 34 ALA HB* 1 1
294 1 1 1 1 34 ALA H 1 34 ALA HN 1 1
294 1 2 1 1 35 ALA H 1 35 ALA HN 1 1
295 1 1 1 1 34 ALA HA 1 34 ALA HA 1 1
295 1 2 1 1 37 LEU H 1 37 LEU HN 1 1
296 1 1 1 1 34 ALA HA 1 34 ALA HA 1 1
296 1 2 1 1 37 LEU QB 1 37 LEU HB* 1 1
297 1 1 1 1 34 ALA HA 1 34 ALA HA 1 1
297 1 2 1 1 37 LEU QD 1 37 LEU HD* 1 1
298 1 1 1 1 34 ALA HA 1 34 ALA HA 1 1
298 1 2 1 1 37 LEU HG 1 37 LEU HG 1 1
299 1 1 1 1 35 ALA H 1 35 ALA HN 1 1
299 1 2 1 1 35 ALA MB 1 35 ALA HB* 1 1
300 1 1 1 1 35 ALA HA 1 35 ALA HA 1 1
300 1 2 1 1 38 GLU H 1 38 GLU- HN 1 1
301 1 1 1 1 35 ALA MB 1 35 ALA HB* 1 1
301 1 2 1 1 36 ARG H 1 36 ARG+ HN 1 1
302 1 1 1 1 36 ARG H 1 36 ARG+ HN 1 1
302 1 2 1 1 36 ARG HB2 1 36 ARG+ HB2 1 1
303 1 1 1 1 36 ARG H 1 36 ARG+ HN 1 1
303 1 2 1 1 36 ARG HB3 1 36 ARG+ HB1 1 1
304 1 1 1 1 36 ARG H 1 36 ARG+ HN 1 1
304 1 2 1 1 37 LEU H 1 37 LEU HN 1 1
305 1 1 1 1 36 ARG HA 1 36 ARG+ HA 1 1
305 1 2 1 1 36 ARG HD2 1 36 ARG+ HD2 1 1
306 1 1 1 1 36 ARG HA 1 36 ARG+ HA 1 1
306 1 2 1 1 36 ARG HD3 1 36 ARG+ HD1 1 1
307 1 1 1 1 36 ARG HA 1 36 ARG+ HA 1 1
307 1 2 1 1 36 ARG HE 1 36 ARG+ HE 1 1
308 1 1 1 1 36 ARG HA 1 36 ARG+ HA 1 1
308 1 2 1 1 37 LEU H 1 37 LEU HN 1 1
309 1 1 1 1 36 ARG HA 1 36 ARG+ HA 1 1
309 1 2 1 1 39 ALA H 1 39 ALA HN 1 1
310 1 1 1 1 36 ARG HB2 1 36 ARG+ HB2 1 1
310 1 2 1 1 36 ARG HE 1 36 ARG+ HE 1 1
311 1 1 1 1 36 ARG HB2 1 36 ARG+ HB2 1 1
311 1 2 1 1 37 LEU H 1 37 LEU HN 1 1
312 1 1 1 1 36 ARG HB3 1 36 ARG+ HB1 1 1
312 1 2 1 1 36 ARG HE 1 36 ARG+ HE 1 1
313 1 1 1 1 36 ARG HB3 1 36 ARG+ HB1 1 1
313 1 2 1 1 37 LEU H 1 37 LEU HN 1 1
314 1 1 1 1 36 ARG HD2 1 36 ARG+ HD2 1 1
314 1 2 1 1 36 ARG HE 1 36 ARG+ HE 1 1
315 1 1 1 1 36 ARG HD2 1 36 ARG+ HD2 1 1
315 1 2 1 1 36 ARG HG2 1 36 ARG+ HG2 1 1
316 1 1 1 1 36 ARG HD3 1 36 ARG+ HD1 1 1
316 1 2 1 1 36 ARG HE 1 36 ARG+ HE 1 1
317 1 1 1 1 36 ARG HE 1 36 ARG+ HE 1 1
317 1 2 1 1 36 ARG HG2 1 36 ARG+ HG2 1 1
318 1 1 1 1 36 ARG HE 1 36 ARG+ HE 1 1
318 1 2 1 1 36 ARG HG3 1 36 ARG+ HG1 1 1
319 1 1 1 1 37 LEU H 1 37 LEU HN 1 1
319 1 2 1 1 38 GLU H 1 38 GLU- HN 1 1
320 1 1 1 1 37 LEU HA 1 37 LEU HA 1 1
320 1 2 1 1 37 LEU HG 1 37 LEU HG 1 1
321 1 1 1 1 37 LEU HA 1 37 LEU HA 1 1
321 1 2 1 1 38 GLU H 1 38 GLU- HN 1 1
322 1 1 1 1 37 LEU HA 1 37 LEU HA 1 1
322 1 2 1 1 40 LEU H 1 40 LEU HN 1 1
323 1 1 1 1 37 LEU QB 1 37 LEU HB* 1 1
323 1 2 1 1 38 GLU H 1 38 GLU- HN 1 1
324 1 1 1 1 38 GLU H 1 38 GLU- HN 1 1
324 1 2 1 1 38 GLU HB2 1 38 GLU- HB2 1 1
325 1 1 1 1 38 GLU H 1 38 GLU- HN 1 1
325 1 2 1 1 38 GLU HB3 1 38 GLU- HB1 1 1
326 1 1 1 1 38 GLU H 1 38 GLU- HN 1 1
326 1 2 1 1 38 GLU QG 1 38 GLU- HG* 1 1
327 1 1 1 1 38 GLU H 1 38 GLU- HN 1 1
327 1 2 1 1 39 ALA H 1 39 ALA HN 1 1
328 1 1 1 1 38 GLU HA 1 38 GLU- HA 1 1
328 1 2 1 1 38 GLU HB2 1 38 GLU- HB2 1 1
329 1 1 1 1 38 GLU HA 1 38 GLU- HA 1 1
329 1 2 1 1 38 GLU HB3 1 38 GLU- HB1 1 1
330 1 1 1 1 38 GLU HA 1 38 GLU- HA 1 1
330 1 2 1 1 39 ALA H 1 39 ALA HN 1 1
331 1 1 1 1 38 GLU HA 1 38 GLU- HA 1 1
331 1 2 1 1 41 LYS H 1 41 LYS+ HN 1 1
332 1 1 1 1 38 GLU HB2 1 38 GLU- HB2 1 1
332 1 2 1 1 39 ALA H 1 39 ALA HN 1 1
333 1 1 1 1 38 GLU HB3 1 38 GLU- HB1 1 1
333 1 2 1 1 39 ALA H 1 39 ALA HN 1 1
334 1 1 1 1 39 ALA H 1 39 ALA HN 1 1
334 1 2 1 1 39 ALA MB 1 39 ALA HB* 1 1
335 1 1 1 1 39 ALA H 1 39 ALA HN 1 1
335 1 2 1 1 40 LEU H 1 40 LEU HN 1 1
336 1 1 1 1 40 LEU H 1 40 LEU HN 1 1
336 1 2 1 1 40 LEU HB2 1 40 LEU HB2 1 1
337 1 1 1 1 40 LEU H 1 40 LEU HN 1 1
337 1 2 1 1 40 LEU HB3 1 40 LEU HB1 1 1
338 1 1 1 1 40 LEU H 1 40 LEU HN 1 1
338 1 2 1 1 40 LEU HG 1 40 LEU HG 1 1
339 1 1 1 1 40 LEU HA 1 40 LEU HA 1 1
339 1 2 1 1 40 LEU HB3 1 40 LEU HB1 1 1
340 1 1 1 1 40 LEU HA 1 40 LEU HA 1 1
340 1 2 1 1 40 LEU HG 1 40 LEU HG 1 1
341 1 1 1 1 41 LYS H 1 41 LYS+ HN 1 1
341 1 2 1 1 41 LYS HB2 1 41 LYS+ HB2 1 1
342 1 1 1 1 41 LYS H 1 41 LYS+ HN 1 1
342 1 2 1 1 41 LYS HB3 1 41 LYS+ HB1 1 1
343 1 1 1 1 41 LYS H 1 41 LYS+ HN 1 1
343 1 2 1 1 41 LYS QG 1 41 LYS+ HG* 1 1
344 1 1 1 1 41 LYS H 1 41 LYS+ HN 1 1
344 1 2 1 1 42 GLU H 1 42 GLU- HN 1 1
345 1 1 1 1 43 ASN H 1 43 ASN HN 1 1
345 1 2 1 1 43 ASN HA 1 43 ASN HA 1 1
346 1 1 1 1 43 ASN H 1 43 ASN HN 1 1
346 1 2 1 1 43 ASN HB2 1 43 ASN HB2 1 1
347 1 1 1 1 43 ASN HB2 1 43 ASN HB2 1 1
347 1 2 1 1 44 GLY H 1 44 GLY HN 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 . . . . . 3.8 1.8 3.8 1 1
2 1 . . . . . 3.8 1.8 3.8 1 1
3 1 . . . . . 5.0 1.8 6.0 1 1
4 1 . . . . . 5.0 1.8 6.0 1 1
5 1 . . . . . 3.8 1.8 3.8 1 1
6 1 . . . . . 2.8 1.8 2.8 1 1
7 1 . . . . . 3.8 1.8 3.8 1 1
8 1 . . . . . 3.8 1.8 3.8 1 1
9 1 . . . . . 3.8 1.8 3.8 1 1
10 1 . . . . . 3.8 1.8 3.8 1 1
11 1 . . . . . 5.0 1.8 6.0 1 1
12 1 . . . . . 2.8 1.8 3.8 1 1
13 1 . . . . . 5.0 1.8 5.0 1 1
14 1 . . . . . 5.0 1.8 5.0 1 1
15 1 . . . . . 2.8 1.8 2.8 1 1
16 1 . . . . . 5.0 1.8 5.0 1 1
17 1 . . . . . 3.8 1.8 3.8 1 1
18 1 . . . . . 2.8 1.8 3.0 1 1
19 1 . . . . . 3.8 1.8 3.8 1 1
20 1 . . . . . 3.8 1.8 3.8 1 1
21 1 . . . . . 2.8 1.8 3.0 1 1
22 1 . . . . . 2.8 1.8 3.0 1 1
23 1 . . . . . 5.0 1.8 5.0 1 1
24 1 . . . . . 5.0 1.8 5.0 1 1
25 1 . . . . . 3.8 1.8 3.8 1 1
26 1 . . . . . 2.8 1.8 3.0 1 1
27 1 . . . . . 2.8 1.8 3.8 1 1
28 1 . . . . . 2.8 1.8 3.8 1 1
29 1 . . . . . 3.8 1.8 5.0 1 1
30 1 . . . . . 3.8 1.8 3.8 1 1
31 1 . . . . . 2.8 1.8 3.0 1 1
32 1 . . . . . 3.8 1.8 4.8 1 1
33 1 . . . . . 3.8 1.8 3.8 1 1
34 1 . . . . . 3.8 1.8 3.8 1 1
35 1 . . . . . 2.8 1.8 4.8 1 1
36 1 . . . . . 6.0 1.8 6.0 1 1
37 1 . . . . . 3.8 1.8 3.8 1 1
38 1 . . . . . 3.8 1.8 3.8 1 1
39 1 . . . . . 3.8 1.8 3.8 1 1
40 1 . . . . . 3.8 1.8 3.8 1 1
41 1 . . . . . 2.8 1.8 3.0 1 1
42 1 . . . . . 2.8 1.8 2.8 1 1
43 1 . . . . . 3.8 1.8 3.8 1 1
44 1 . . . . . 3.8 1.8 3.8 1 1
45 1 . . . . . 3.8 1.8 3.8 1 1
46 1 . . . . . 3.8 1.8 4.8 1 1
47 1 . . . . . 5.0 1.8 5.0 1 1
48 1 . . . . . 5.0 1.8 5.0 1 1
49 1 . . . . . 2.8 1.8 2.8 1 1
50 1 . . . . . 2.8 1.8 3.8 1 1
51 1 . . . . . 3.8 1.8 3.8 1 1
52 1 . . . . . 3.8 1.8 3.8 1 1
53 1 . . . . . 2.8 1.8 2.8 1 1
54 1 . . . . . 5.0 1.8 5.0 1 1
55 1 . . . . . 3.8 1.8 4.8 1 1
56 1 . . . . . 3.8 1.8 3.8 1 1
57 1 . . . . . 2.8 1.8 3.0 1 1
58 1 . . . . . 2.8 1.8 4.8 1 1
59 1 . . . . . 5.0 1.8 5.0 1 1
60 1 . . . . . 3.8 1.8 3.8 1 1
61 1 . . . . . 5.0 1.8 5.0 1 1
62 1 . . . . . 3.8 1.8 3.8 1 1
63 1 . . . . . 3.8 1.8 5.8 1 1
64 1 . . . . . 2.8 1.8 3.0 1 1
65 1 . . . . . 2.8 1.8 3.8 1 1
66 1 . . . . . 3.8 1.8 3.8 1 1
67 1 . . . . . 5.0 1.8 5.0 1 1
68 1 . . . . . 3.8 1.8 3.8 1 1
69 1 . . . . . 3.8 1.8 3.8 1 1
70 1 . . . . . 3.8 1.8 3.8 1 1
71 1 . . . . . 3.8 1.8 5.8 1 1
72 1 . . . . . 5.0 1.8 7.0 1 1
73 1 . . . . . 3.8 1.8 4.8 1 1
74 1 . . . . . 3.8 1.8 6.8 1 1
75 1 . . . . . 3.8 1.8 3.8 1 1
76 1 . . . . . 3.8 1.8 3.8 1 1
77 1 . . . . . 5.0 1.8 9.0 1 1
78 1 . . . . . 2.8 1.8 3.0 1 1
79 1 . . . . . 2.8 1.8 4.8 1 1
80 1 . . . . . 2.8 1.8 2.8 1 1
81 1 . . . . . 5.0 1.8 5.0 1 1
82 1 . . . . . 3.8 1.8 3.8 1 1
83 1 . . . . . 3.8 1.8 5.8 1 1
84 1 . . . . . 5.0 1.8 7.0 1 1
85 1 . . . . . 6.0 3.8 8.0 1 1
86 1 . . . . . 6.0 3.8 8.0 1 1
87 1 . . . . . 2.8 1.8 3.0 1 1
88 1 . . . . . 3.8 1.8 3.8 1 1
89 1 . . . . . 3.8 1.8 3.8 1 1
90 1 . . . . . 5.0 1.8 5.0 1 1
91 1 . . . . . 5.0 1.8 5.0 1 1
92 1 . . . . . 3.8 1.8 5.3 1 1
93 1 . . . . . 5.0 1.8 5.0 1 1
94 1 . . . . . 3.8 1.8 3.8 1 1
95 1 . . . . . 3.8 1.8 3.8 1 1
96 1 . . . . . 5.0 1.8 5.0 1 1
97 1 . . . . . 6.0 3.8 8.0 1 1
98 1 . . . . . 2.8 1.8 3.0 1 1
99 1 . . . . . 2.8 1.8 2.8 1 1
100 1 . . . . . 2.8 1.8 4.8 1 1
101 1 . . . . . 2.8 1.8 2.8 1 1
102 1 . . . . . 2.8 1.8 3.0 1 1
103 1 . . . . . 2.8 1.8 4.8 1 1
104 1 . . . . . 2.8 1.8 4.8 1 1
105 1 . . . . . 3.8 1.8 3.8 1 1
106 1 . . . . . 6.0 1.8 6.0 1 1
107 1 . . . . . 3.8 1.8 3.8 1 1
108 1 . . . . . 3.8 1.8 3.8 1 1
109 1 . . . . . 3.8 1.8 3.8 1 1
110 1 . . . . . 3.8 1.8 5.8 1 1
111 1 . . . . . 3.8 1.8 5.8 1 1
112 1 . . . . . 5.0 1.8 5.0 1 1
113 1 . . . . . 3.8 1.8 3.8 1 1
114 1 . . . . . 5.0 1.8 7.0 1 1
115 1 . . . . . 3.8 1.8 6.0 1 1
116 1 . . . . . 3.8 1.8 5.8 1 1
117 1 . . . . . 5.0 1.8 7.0 1 1
118 1 . . . . . 5.0 1.8 7.0 1 1
119 1 . . . . . 2.8 1.8 3.0 1 1
120 1 . . . . . 2.8 1.8 2.8 1 1
121 1 . . . . . 2.8 1.8 2.8 1 1
122 1 . . . . . 3.8 1.8 3.8 1 1
123 1 . . . . . 3.8 1.8 3.8 1 1
124 1 . . . . . 3.8 1.8 3.8 1 1
125 1 . . . . . 3.8 1.8 3.8 1 1
126 1 . . . . . 5.0 1.8 5.0 1 1
127 1 . . . . . 3.8 1.8 3.8 1 1
128 1 . . . . . 3.8 1.8 3.8 1 1
129 1 . . . . . 2.8 1.8 2.8 1 1
130 1 . . . . . 2.8 1.8 4.8 1 1
131 1 . . . . . 3.8 1.8 3.8 1 1
132 1 . . . . . 3.8 1.8 3.8 1 1
133 1 . . . . . 6.0 1.8 6.0 1 1
134 1 . . . . . 3.8 1.8 5.8 1 1
135 1 . . . . . 2.8 1.8 3.0 1 1
136 1 . . . . . 5.0 1.8 7.0 1 1
137 1 . . . . . 3.8 1.8 5.5 1 1
138 1 . . . . . 2.8 1.8 2.8 1 1
139 1 . . . . . 2.8 1.8 2.8 1 1
140 1 . . . . . 3.8 1.8 5.8 1 1
141 1 . . . . . 3.8 1.8 5.8 1 1
142 1 . . . . . 3.8 1.8 3.8 1 1
143 1 . . . . . 5.0 1.8 5.0 1 1
144 1 . . . . . 3.8 1.8 3.8 1 1
145 1 . . . . . 2.8 1.8 3.0 1 1
146 1 . . . . . 3.8 1.8 3.8 1 1
147 1 . . . . . 5.0 1.8 7.0 1 1
148 1 . . . . . 2.8 1.8 3.0 1 1
149 1 . . . . . 2.8 1.8 3.0 1 1
150 1 . . . . . 2.8 1.8 3.0 1 1
151 1 . . . . . 5.0 1.8 6.0 1 1
152 1 . . . . . 5.0 1.8 5.0 1 1
153 1 . . . . . 3.8 1.8 3.8 1 1
154 1 . . . . . 5.0 1.8 5.0 1 1
155 1 . . . . . 3.8 1.8 3.8 1 1
156 1 . . . . . 3.8 1.8 3.8 1 1
157 1 . . . . . 3.8 1.8 3.8 1 1
158 1 . . . . . 6.0 1.8 6.0 1 1
159 1 . . . . . 5.0 1.8 5.0 1 1
160 1 . . . . . 5.0 1.8 5.0 1 1
161 1 . . . . . 3.8 1.8 3.8 1 1
162 1 . . . . . 5.0 1.8 5.0 1 1
163 1 . . . . . 3.8 1.8 3.8 1 1
164 1 . . . . . 3.8 1.8 7.4 1 1
165 1 . . . . . 3.8 1.8 3.8 1 1
166 1 . . . . . 3.8 1.8 3.8 1 1
167 1 . . . . . 2.8 1.8 3.0 1 1
168 1 . . . . . 2.8 1.8 2.8 1 1
169 1 . . . . . 3.8 1.8 4.8 1 1
170 1 . . . . . 2.8 1.8 2.8 1 1
171 1 . . . . . 2.8 1.8 4.8 1 1
172 1 . . . . . 3.8 1.8 3.8 1 1
173 1 . . . . . 5.0 1.8 5.0 1 1
174 1 . . . . . 3.8 1.8 5.5 1 1
175 1 . . . . . 3.8 1.8 3.8 1 1
176 1 . . . . . 5.0 1.8 7.0 1 1
177 1 . . . . . 5.0 1.8 7.0 1 1
178 1 . . . . . 2.8 1.8 3.0 1 1
179 1 . . . . . 2.8 1.8 2.8 1 1
180 1 . . . . . 3.8 1.8 3.8 1 1
181 1 . . . . . 5.0 1.8 7.0 1 1
182 1 . . . . . 3.8 1.8 3.8 1 1
183 1 . . . . . 3.8 1.8 3.8 1 1
184 1 . . . . . 3.8 1.8 3.8 1 1
185 1 . . . . . 5.0 1.8 7.4 1 1
186 1 . . . . . 2.8 1.8 3.0 1 1
187 1 . . . . . 2.8 1.8 3.8 1 1
188 1 . . . . . 3.8 1.8 3.8 1 1
189 1 . . . . . 2.8 1.8 2.8 1 1
190 1 . . . . . 2.8 1.8 5.7 1 1
191 1 . . . . . 3.8 1.8 3.8 1 1
192 1 . . . . . 3.8 1.8 3.8 1 1
193 1 . . . . . 5.0 1.8 7.0 1 1
194 1 . . . . . 5.0 1.8 5.0 1 1
195 1 . . . . . 6.0 1.8 6.0 1 1
196 1 . . . . . 2.8 1.8 4.8 1 1
197 1 . . . . . 5.0 1.8 7.0 1 1
198 1 . . . . . 5.0 1.8 8.0 1 1
199 1 . . . . . 3.8 1.8 8.7 1 1
200 1 . . . . . 5.0 1.8 9.9 1 1
201 1 . . . . . 6.0 1.8 8.0 1 1
202 1 . . . . . 2.8 1.8 3.0 1 1
203 1 . . . . . 2.8 1.8 4.8 1 1
204 1 . . . . . 3.8 1.8 3.8 1 1
205 1 . . . . . 3.8 1.8 3.8 1 1
206 1 . . . . . 6.0 1.8 6.0 1 1
207 1 . . . . . 5.0 1.8 5.0 1 1
208 1 . . . . . 2.8 1.8 4.8 1 1
209 1 . . . . . 2.8 1.8 4.8 1 1
210 1 . . . . . 2.8 1.8 2.8 1 1
211 1 . . . . . 5.0 1.8 5.0 1 1
212 1 . . . . . 5.0 1.8 7.0 1 1
213 1 . . . . . 5.0 1.8 5.0 1 1
214 1 . . . . . 6.0 1.8 8.0 1 1
215 1 . . . . . 6.0 1.8 8.0 1 1
216 1 . . . . . 5.0 1.8 7.0 1 1
217 1 . . . . . 3.8 1.8 3.8 1 1
218 1 . . . . . 5.0 1.8 7.0 1 1
219 1 . . . . . 5.0 1.8 7.0 1 1
220 1 . . . . . 5.0 1.8 5.0 1 1
221 1 . . . . . 5.0 1.8 7.0 1 1
222 1 . . . . . 5.0 1.8 8.0 1 1
223 1 . . . . . 5.0 1.8 8.0 1 1
224 1 . . . . . 3.8 1.8 3.8 1 1
225 1 . . . . . 3.8 1.8 3.8 1 1
226 1 . . . . . 2.8 1.8 4.8 1 1
227 1 . . . . . 5.0 1.8 7.0 1 1
228 1 . . . . . 3.8 1.8 3.8 1 1
229 1 . . . . . 5.0 1.8 5.0 1 1
230 1 . . . . . 2.8 1.8 4.8 1 1
231 1 . . . . . 3.8 1.8 3.8 1 1
232 1 . . . . . 5.0 1.8 7.9 1 1
233 1 . . . . . 2.8 1.8 4.8 1 1
234 1 . . . . . 3.8 1.8 3.8 1 1
235 1 . . . . . 5.0 1.8 7.9 1 1
236 1 . . . . . 5.0 1.8 7.0 1 1
237 1 . . . . . 3.8 1.8 4.8 1 1
238 1 . . . . . 5.0 1.8 5.0 1 1
239 1 . . . . . 2.8 1.8 2.8 1 1
240 1 . . . . . 5.0 1.8 5.0 1 1
241 1 . . . . . 3.8 1.8 3.8 1 1
242 1 . . . . . 2.8 1.8 3.0 1 1
243 1 . . . . . 2.8 1.8 3.8 1 1
244 1 . . . . . 3.8 1.8 3.8 1 1
245 1 . . . . . 5.0 1.8 5.0 1 1
246 1 . . . . . 3.8 1.8 3.8 1 1
247 1 . . . . . 3.8 1.8 3.8 1 1
248 1 . . . . . 3.8 1.8 3.8 1 1
249 1 . . . . . 3.8 1.8 4.8 1 1
250 1 . . . . . 2.8 1.8 3.0 1 1
251 1 . . . . . 2.8 1.8 3.8 1 1
252 1 . . . . . 2.8 1.8 2.8 1 1
253 1 . . . . . 5.0 1.8 5.0 1 1
254 1 . . . . . 3.8 1.8 3.8 1 1
255 1 . . . . . 3.8 1.8 3.8 1 1
256 1 . . . . . 3.8 1.8 3.8 1 1
257 1 . . . . . 3.8 1.8 4.8 1 1
258 1 . . . . . 3.8 1.8 7.2 1 1
259 1 . . . . . 3.8 1.8 3.8 1 1
260 1 . . . . . 5.0 1.8 5.0 1 1
261 1 . . . . . 3.8 1.8 4.8 1 1
262 1 . . . . . 3.8 1.8 7.4 1 1
263 1 . . . . . 3.8 1.8 3.8 1 1
264 1 . . . . . 3.8 1.8 3.8 1 1
265 1 . . . . . 2.8 1.8 3.0 1 1
266 1 . . . . . 2.8 1.8 3.8 1 1
267 1 . . . . . 5.0 1.8 5.0 1 1
268 1 . . . . . 3.8 1.8 3.8 1 1
269 1 . . . . . 2.8 1.8 2.8 1 1
270 1 . . . . . 3.8 1.8 3.8 1 1
271 1 . . . . . 3.8 1.8 5.8 1 1
272 1 . . . . . 2.8 1.8 3.8 1 1
273 1 . . . . . 2.8 1.8 3.0 1 1
274 1 . . . . . 3.8 1.8 4.8 1 1
275 1 . . . . . 2.8 1.8 2.8 1 1
276 1 . . . . . 2.8 1.8 3.0 1 1
277 1 . . . . . 2.8 1.8 3.0 1 1
278 1 . . . . . 5.0 1.8 5.0 1 1
279 1 . . . . . 3.8 1.8 4.8 1 1
280 1 . . . . . 3.8 1.8 3.8 1 1
281 1 . . . . . 2.8 1.8 3.0 1 1
282 1 . . . . . 2.8 1.8 3.8 1 1
283 1 . . . . . 3.8 1.8 6.7 1 1
284 1 . . . . . 3.8 1.8 3.8 1 1
285 1 . . . . . 2.8 1.8 2.8 1 1
286 1 . . . . . 3.8 1.8 6.4 1 1
287 1 . . . . . 3.8 1.8 3.8 1 1
288 1 . . . . . 3.8 1.8 3.8 1 1
289 1 . . . . . 3.8 1.8 3.8 1 1
290 1 . . . . . 3.8 1.8 3.8 1 1
291 1 . . . . . 3.8 1.8 4.8 1 1
292 1 . . . . . 2.8 1.8 2.9 1 1
293 1 . . . . . 2.8 1.8 4.8 1 1
294 1 . . . . . 2.8 1.8 2.8 1 1
295 1 . . . . . 3.8 1.8 3.8 1 1
296 1 . . . . . 3.8 1.8 4.8 1 1
297 1 . . . . . 3.8 1.8 6.4 1 1
298 1 . . . . . 3.8 1.8 3.8 1 1
299 1 . . . . . 2.8 1.8 4.8 1 1
300 1 . . . . . 3.8 1.8 3.8 1 1
301 1 . . . . . 2.8 1.8 4.8 1 1
302 1 . . . . . 3.8 1.8 3.8 1 1
303 1 . . . . . 2.8 1.8 2.8 1 1
304 1 . . . . . 2.8 1.8 2.8 1 1
305 1 . . . . . 5.0 1.8 5.0 1 1
306 1 . . . . . 5.0 1.8 5.0 1 1
307 1 . . . . . 5.0 1.8 5.0 1 1
308 1 . . . . . 3.8 1.8 3.8 1 1
309 1 . . . . . 3.8 1.8 3.8 1 1
310 1 . . . . . 5.0 1.8 5.0 1 1
311 1 . . . . . 3.8 1.8 3.8 1 1
312 1 . . . . . 5.0 1.8 5.0 1 1
313 1 . . . . . 2.8 1.8 3.0 1 1
314 1 . . . . . 2.8 1.8 2.8 1 1
315 1 . . . . . 2.8 1.8 2.8 1 1
316 1 . . . . . 2.8 1.8 2.8 1 1
317 1 . . . . . 3.8 1.8 3.8 1 1
318 1 . . . . . 3.8 1.8 3.8 1 1
319 1 . . . . . 2.8 1.8 2.8 1 1
320 1 . . . . . 3.8 1.8 3.8 1 1
321 1 . . . . . 3.8 1.8 3.8 1 1
322 1 . . . . . 3.8 1.8 3.8 1 1
323 1 . . . . . 3.8 1.8 4.8 1 1
324 1 . . . . . 2.8 1.8 3.0 1 1
325 1 . . . . . 2.8 1.8 3.0 1 1
326 1 . . . . . 3.8 1.8 4.8 1 1
327 1 . . . . . 2.8 1.8 2.8 1 1
328 1 . . . . . 2.8 1.8 3.0 1 1
329 1 . . . . . 2.8 1.8 3.0 1 1
330 1 . . . . . 5.0 1.8 5.0 1 1
331 1 . . . . . 5.0 1.8 5.0 1 1
332 1 . . . . . 3.8 1.8 3.8 1 1
333 1 . . . . . 5.0 1.8 5.0 1 1
334 1 . . . . . 2.8 1.8 4.8 1 1
335 1 . . . . . 2.8 1.8 2.8 1 1
336 1 . . . . . 2.8 1.8 3.0 1 1
337 1 . . . . . 2.8 1.8 3.0 1 1
338 1 . . . . . 5.0 1.8 5.0 1 1
339 1 . . . . . 2.8 1.8 3.0 1 1
340 1 . . . . . 3.8 1.8 3.8 1 1
341 1 . . . . . 3.8 1.8 3.8 1 1
342 1 . . . . . 3.8 1.8 3.8 1 1
343 1 . . . . . 3.8 1.8 4.8 1 1
344 1 . . . . . 3.8 1.8 3.8 1 1
345 1 . . . . . 2.8 1.8 2.9 1 1
346 1 . . . . . 3.8 1.8 3.8 1 1
347 1 . . . . . 5.0 1.8 5.0 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 -6.262 -17.885 5.264 1.00 . A A . 1 SER C 1 1
1 2 1 1 1 SER CA C -6.594 -16.930 6.386 1.00 . A A . 1 SER CA 1 1
1 3 1 1 1 SER CB C -6.060 -15.503 6.098 1.00 . A A . 1 SER CB 1 1
1 4 1 1 1 SER H1 H -5.356 -18.106 7.517 1.00 . A A . 1 SER H1 1 1
1 5 1 1 1 SER H2 H -5.713 -16.616 8.208 1.00 . A A . 1 SER H2 1 1
1 6 1 1 1 SER H3 H -6.868 -17.838 8.202 1.00 . A A . 1 SER H3 1 1
1 7 1 1 1 SER HA H -7.702 -16.880 6.430 1.00 . A A . 1 SER HA 1 1
1 8 1 1 1 SER HB2 H -4.974 -15.461 6.313 1.00 . A A . 1 SER HB2 1 1
1 9 1 1 1 SER HB3 H -6.147 -15.253 5.023 1.00 . A A . 1 SER HB3 1 1
1 10 1 1 1 SER HG H -7.104 -14.932 7.640 1.00 . A A . 1 SER HG 1 1
1 11 1 1 1 SER N N -6.096 -17.408 7.673 1.00 . A A . 1 SER N 1 1
1 12 1 1 1 SER O O -5.775 -17.479 4.197 1.00 . A A . 1 SER O 1 1
1 13 1 1 1 SER OG O -6.713 -14.496 6.878 1.00 . A A . 1 SER OG 1 1
1 14 1 1 2 PRO C C -7.328 -20.036 3.226 1.00 . A A . 2 PRO C 1 1
1 15 1 1 2 PRO CA C -6.423 -20.272 4.420 1.00 . A A . 2 PRO CA 1 1
1 16 1 1 2 PRO CB C -6.819 -21.572 5.101 1.00 . A A . 2 PRO CB 1 1
1 17 1 1 2 PRO CD C -7.001 -19.783 6.728 1.00 . A A . 2 PRO CD 1 1
1 18 1 1 2 PRO CG C -7.644 -21.108 6.310 1.00 . A A . 2 PRO CG 1 1
1 19 1 1 2 PRO HA H -5.410 -20.322 4.049 1.00 . A A . 2 PRO HA 1 1
1 20 1 1 2 PRO HB2 H -7.487 -22.152 4.423 1.00 . A A . 2 PRO HB2 1 1
1 21 1 1 2 PRO HB3 H -5.908 -22.090 5.458 1.00 . A A . 2 PRO HB3 1 1
1 22 1 1 2 PRO HD2 H -7.759 -19.133 7.200 1.00 . A A . 2 PRO HD2 1 1
1 23 1 1 2 PRO HD3 H -6.133 -19.989 7.375 1.00 . A A . 2 PRO HD3 1 1
1 24 1 1 2 PRO HG2 H -8.660 -20.758 6.070 1.00 . A A . 2 PRO HG2 1 1
1 25 1 1 2 PRO HG3 H -7.545 -21.904 7.071 1.00 . A A . 2 PRO HG3 1 1
1 26 1 1 2 PRO N N -6.527 -19.162 5.472 1.00 . A A . 2 PRO N 1 1
1 27 1 1 2 PRO O O -6.965 -20.204 2.057 1.00 . A A . 2 PRO O 1 1
1 28 1 1 3 LEU C C -10.722 -18.517 3.195 1.00 . A A . 3 LEU C 1 1
1 29 1 1 3 LEU CA C -9.466 -19.060 2.530 1.00 . A A . 3 LEU CA 1 1
1 30 1 1 3 LEU CB C -9.841 -20.120 1.458 1.00 . A A . 3 LEU CB 1 1
1 31 1 1 3 LEU CD1 C -9.920 -20.634 -1.018 1.00 . A A . 3 LEU CD1 1 1
1 32 1 1 3 LEU CD2 C -8.385 -18.815 -0.214 1.00 . A A . 3 LEU CD2 1 1
1 33 1 1 3 LEU CG C -9.025 -20.168 0.139 1.00 . A A . 3 LEU CG 1 1
1 34 1 1 3 LEU H H -8.835 -19.702 4.518 1.00 . A A . 3 LEU H 1 1
1 35 1 1 3 LEU HA H -8.979 -18.188 2.058 1.00 . A A . 3 LEU HA 1 1
1 36 1 1 3 LEU HB2 H -9.822 -21.127 1.920 1.00 . A A . 3 LEU HB2 1 1
1 37 1 1 3 LEU HB3 H -10.910 -19.949 1.204 1.00 . A A . 3 LEU HB3 1 1
1 38 1 1 3 LEU HD11 H -10.655 -21.397 -0.700 1.00 . A A . 3 LEU HD11 1 1
1 39 1 1 3 LEU HD12 H -10.493 -19.793 -1.454 1.00 . A A . 3 LEU HD12 1 1
1 40 1 1 3 LEU HD13 H -9.330 -21.074 -1.844 1.00 . A A . 3 LEU HD13 1 1
1 41 1 1 3 LEU HD21 H -9.089 -17.975 -0.071 1.00 . A A . 3 LEU HD21 1 1
1 42 1 1 3 LEU HD22 H -7.484 -18.607 0.392 1.00 . A A . 3 LEU HD22 1 1
1 43 1 1 3 LEU HD23 H -8.081 -18.782 -1.277 1.00 . A A . 3 LEU HD23 1 1
1 44 1 1 3 LEU HG H -8.213 -20.915 0.262 1.00 . A A . 3 LEU HG 1 1
1 45 1 1 3 LEU N N -8.539 -19.597 3.518 1.00 . A A . 3 LEU N 1 1
1 46 1 1 3 LEU O O -11.685 -19.245 3.460 1.00 . A A . 3 LEU O 1 1
1 47 1 1 4 GLY C C -12.112 -15.217 3.208 1.00 . A A . 4 GLY C 1 1
1 48 1 1 4 GLY CA C -11.912 -16.528 3.931 1.00 . A A . 4 GLY CA 1 1
1 49 1 1 4 GLY H H -9.836 -16.715 3.211 1.00 . A A . 4 GLY H 1 1
1 50 1 1 4 GLY HA2 H -12.808 -17.159 3.793 1.00 . A A . 4 GLY HA2 1 1
1 51 1 1 4 GLY HA3 H -11.819 -16.334 5.015 1.00 . A A . 4 GLY HA3 1 1
1 52 1 1 4 GLY N N -10.725 -17.221 3.439 1.00 . A A . 4 GLY N 1 1
1 53 1 1 4 GLY O O -11.562 -14.175 3.584 1.00 . A A . 4 GLY O 1 1
1 54 1 1 5 GLU C C -14.606 -13.566 1.554 1.00 . A A . 5 GLU C 1 1
1 55 1 1 5 GLU CA C -13.188 -14.051 1.364 1.00 . A A . 5 GLU CA 1 1
1 56 1 1 5 GLU CB C -12.906 -14.393 -0.126 1.00 . A A . 5 GLU CB 1 1
1 57 1 1 5 GLU CD C -11.236 -13.833 -2.116 1.00 . A A . 5 GLU CD 1 1
1 58 1 1 5 GLU CG C -12.122 -13.336 -0.971 1.00 . A A . 5 GLU CG 1 1
1 59 1 1 5 GLU H H -13.391 -16.159 1.969 1.00 . A A . 5 GLU H 1 1
1 60 1 1 5 GLU HA H -12.509 -13.243 1.695 1.00 . A A . 5 GLU HA 1 1
1 61 1 1 5 GLU HB2 H -12.356 -15.354 -0.172 1.00 . A A . 5 GLU HB2 1 1
1 62 1 1 5 GLU HB3 H -13.870 -14.611 -0.628 1.00 . A A . 5 GLU HB3 1 1
1 63 1 1 5 GLU HG2 H -12.831 -12.610 -1.410 1.00 . A A . 5 GLU HG2 1 1
1 64 1 1 5 GLU HG3 H -11.479 -12.722 -0.313 1.00 . A A . 5 GLU HG3 1 1
1 65 1 1 5 GLU N N -12.924 -15.242 2.168 1.00 . A A . 5 GLU N 1 1
1 66 1 1 5 GLU O O -15.243 -13.045 0.629 1.00 . A A . 5 GLU O 1 1
1 67 1 1 5 GLU OE1 O -11.927 -14.146 -3.247 1.00 . A A . 5 GLU OE1 1 1
1 68 1 1 5 GLU OE2 O -10.020 -13.939 -2.020 1.00 . A A . 5 GLU OE2 1 1
1 69 1 1 6 GLU C C -16.254 -11.796 3.805 1.00 . A A . 6 GLU C 1 1
1 70 1 1 6 GLU CA C -16.416 -13.134 3.122 1.00 . A A . 6 GLU CA 1 1
1 71 1 1 6 GLU CB C -17.160 -14.146 4.037 1.00 . A A . 6 GLU CB 1 1
1 72 1 1 6 GLU CD C -19.197 -15.854 3.990 1.00 . A A . 6 GLU CD 1 1
1 73 1 1 6 GLU CG C -18.657 -14.452 3.697 1.00 . A A . 6 GLU CG 1 1
1 74 1 1 6 GLU H H -14.563 -14.277 3.440 1.00 . A A . 6 GLU H 1 1
1 75 1 1 6 GLU HA H -16.996 -12.974 2.195 1.00 . A A . 6 GLU HA 1 1
1 76 1 1 6 GLU HB2 H -16.601 -15.102 4.038 1.00 . A A . 6 GLU HB2 1 1
1 77 1 1 6 GLU HB3 H -17.094 -13.793 5.084 1.00 . A A . 6 GLU HB3 1 1
1 78 1 1 6 GLU HG2 H -19.313 -13.741 4.233 1.00 . A A . 6 GLU HG2 1 1
1 79 1 1 6 GLU HG3 H -18.854 -14.251 2.628 1.00 . A A . 6 GLU HG3 1 1
1 80 1 1 6 GLU N N -15.117 -13.699 2.763 1.00 . A A . 6 GLU N 1 1
1 81 1 1 6 GLU O O -17.017 -10.850 3.575 1.00 . A A . 6 GLU O 1 1
1 82 1 1 6 GLU OE1 O -18.534 -16.871 3.828 1.00 . A A . 6 GLU OE1 1 1
1 83 1 1 6 GLU OE2 O -20.480 -15.863 4.444 1.00 . A A . 6 GLU OE2 1 1
1 84 1 1 7 MET C C -14.574 -9.358 4.660 1.00 . A A . 7 MET C 1 1
1 85 1 1 7 MET CA C -15.072 -10.511 5.500 1.00 . A A . 7 MET CA 1 1
1 86 1 1 7 MET CB C -14.081 -10.823 6.655 1.00 . A A . 7 MET CB 1 1
1 87 1 1 7 MET CE C -15.405 -11.860 10.307 1.00 . A A . 7 MET CE 1 1
1 88 1 1 7 MET CG C -14.589 -10.515 8.080 1.00 . A A . 7 MET CG 1 1
1 89 1 1 7 MET H H -14.650 -12.544 4.766 1.00 . A A . 7 MET H 1 1
1 90 1 1 7 MET HA H -16.046 -10.206 5.925 1.00 . A A . 7 MET HA 1 1
1 91 1 1 7 MET HB2 H -13.773 -11.888 6.610 1.00 . A A . 7 MET HB2 1 1
1 92 1 1 7 MET HB3 H -13.146 -10.251 6.501 1.00 . A A . 7 MET HB3 1 1
1 93 1 1 7 MET HE1 H -14.704 -11.060 10.605 1.00 . A A . 7 MET HE1 1 1
1 94 1 1 7 MET HE2 H -16.314 -11.775 10.929 1.00 . A A . 7 MET HE2 1 1
1 95 1 1 7 MET HE3 H -14.932 -12.834 10.520 1.00 . A A . 7 MET HE3 1 1
1 96 1 1 7 MET HG2 H -13.764 -10.521 8.817 1.00 . A A . 7 MET HG2 1 1
1 97 1 1 7 MET HG3 H -15.037 -9.504 8.114 1.00 . A A . 7 MET HG3 1 1
1 98 1 1 7 MET N N -15.273 -11.705 4.683 1.00 . A A . 7 MET N 1 1
1 99 1 1 7 MET O O -14.869 -8.186 4.923 1.00 . A A . 7 MET O 1 1
1 100 1 1 7 MET SD S -15.825 -11.732 8.563 1.00 . A A . 7 MET SD 1 1
1 101 1 1 8 ARG C C -14.271 -7.765 2.193 1.00 . A A . 8 ARG C 1 1
1 102 1 1 8 ARG CA C -13.199 -8.651 2.782 1.00 . A A . 8 ARG CA 1 1
1 103 1 1 8 ARG CB C -12.370 -9.352 1.671 1.00 . A A . 8 ARG CB 1 1
1 104 1 1 8 ARG CD C -10.270 -8.938 3.087 1.00 . A A . 8 ARG CD 1 1
1 105 1 1 8 ARG CG C -10.991 -9.896 2.130 1.00 . A A . 8 ARG CG 1 1
1 106 1 1 8 ARG CZ C -9.736 -9.074 5.526 1.00 . A A . 8 ARG CZ 1 1
1 107 1 1 8 ARG H H -13.558 -10.688 3.538 1.00 . A A . 8 ARG H 1 1
1 108 1 1 8 ARG HA H -12.536 -8.012 3.395 1.00 . A A . 8 ARG HA 1 1
1 109 1 1 8 ARG HB2 H -12.950 -10.194 1.247 1.00 . A A . 8 ARG HB2 1 1
1 110 1 1 8 ARG HB3 H -12.231 -8.653 0.820 1.00 . A A . 8 ARG HB3 1 1
1 111 1 1 8 ARG HD2 H -9.190 -8.885 2.841 1.00 . A A . 8 ARG HD2 1 1
1 112 1 1 8 ARG HD3 H -10.676 -7.911 2.983 1.00 . A A . 8 ARG HD3 1 1
1 113 1 1 8 ARG HE H -11.222 -10.107 4.634 1.00 . A A . 8 ARG HE 1 1
1 114 1 1 8 ARG HG2 H -11.098 -10.877 2.635 1.00 . A A . 8 ARG HG2 1 1
1 115 1 1 8 ARG HG3 H -10.346 -10.092 1.250 1.00 . A A . 8 ARG HG3 1 1
1 116 1 1 8 ARG HH11 H -8.582 -7.855 4.549 1.00 . A A . 8 ARG HH11 1 1
1 117 1 1 8 ARG HH12 H -8.266 -8.035 6.359 1.00 . A A . 8 ARG HH12 1 1
1 118 1 1 8 ARG HH21 H -10.823 -10.248 6.585 1.00 . A A . 8 ARG HH21 1 1
1 119 1 1 8 ARG HH22 H -9.482 -9.333 7.471 1.00 . A A . 8 ARG HH22 1 1
1 120 1 1 8 ARG N N -13.782 -9.670 3.651 1.00 . A A . 8 ARG N 1 1
1 121 1 1 8 ARG NE N -10.462 -9.431 4.475 1.00 . A A . 8 ARG NE 1 1
1 122 1 1 8 ARG NH1 N -8.749 -8.229 5.484 1.00 . A A . 8 ARG NH1 1 1
1 123 1 1 8 ARG NH2 N -10.035 -9.602 6.660 1.00 . A A . 8 ARG NH2 1 1
1 124 1 1 8 ARG O O -14.104 -6.548 2.048 1.00 . A A . 8 ARG O 1 1
1 125 1 1 9 ASP C C -17.131 -6.699 2.202 1.00 . A A . 9 ASP C 1 1
1 126 1 1 9 ASP CA C -16.490 -7.636 1.205 1.00 . A A . 9 ASP CA 1 1
1 127 1 1 9 ASP CB C -17.519 -8.626 0.597 1.00 . A A . 9 ASP CB 1 1
1 128 1 1 9 ASP CG C -17.314 -9.014 -0.874 1.00 . A A . 9 ASP CG 1 1
1 129 1 1 9 ASP H H -15.442 -9.395 2.017 1.00 . A A . 9 ASP H 1 1
1 130 1 1 9 ASP HA H -16.054 -7.005 0.410 1.00 . A A . 9 ASP HA 1 1
1 131 1 1 9 ASP HB2 H -17.564 -9.561 1.182 1.00 . A A . 9 ASP HB2 1 1
1 132 1 1 9 ASP HB3 H -18.536 -8.194 0.684 1.00 . A A . 9 ASP HB3 1 1
1 133 1 1 9 ASP N N -15.383 -8.368 1.813 1.00 . A A . 9 ASP N 1 1
1 134 1 1 9 ASP O O -17.580 -5.597 1.864 1.00 . A A . 9 ASP O 1 1
1 135 1 1 9 ASP OD1 O -16.212 -9.078 -1.400 1.00 . A A . 9 ASP OD1 1 1
1 136 1 1 9 ASP OD2 O -18.490 -9.264 -1.525 1.00 . A A . 9 ASP OD2 1 1
1 137 1 1 10 ARG C C -17.003 -4.965 4.552 1.00 . A A . 10 ARG C 1 1
1 138 1 1 10 ARG CA C -17.717 -6.297 4.531 1.00 . A A . 10 ARG CA 1 1
1 139 1 1 10 ARG CB C -17.543 -7.052 5.878 1.00 . A A . 10 ARG CB 1 1
1 140 1 1 10 ARG CD C -19.905 -8.048 6.011 1.00 . A A . 10 ARG CD 1 1
1 141 1 1 10 ARG CG C -18.398 -8.338 6.021 1.00 . A A . 10 ARG CG 1 1
1 142 1 1 10 ARG CZ C -21.910 -9.270 6.868 1.00 . A A . 10 ARG CZ 1 1
1 143 1 1 10 ARG H H -16.951 -8.136 3.607 1.00 . A A . 10 ARG H 1 1
1 144 1 1 10 ARG HA H -18.791 -6.110 4.346 1.00 . A A . 10 ARG HA 1 1
1 145 1 1 10 ARG HB2 H -16.479 -7.326 6.017 1.00 . A A . 10 ARG HB2 1 1
1 146 1 1 10 ARG HB3 H -17.764 -6.361 6.718 1.00 . A A . 10 ARG HB3 1 1
1 147 1 1 10 ARG HD2 H -20.123 -7.115 6.570 1.00 . A A . 10 ARG HD2 1 1
1 148 1 1 10 ARG HD3 H -20.260 -7.892 4.971 1.00 . A A . 10 ARG HD3 1 1
1 149 1 1 10 ARG HE H -20.035 -10.013 6.897 1.00 . A A . 10 ARG HE 1 1
1 150 1 1 10 ARG HG2 H -18.177 -9.057 5.206 1.00 . A A . 10 ARG HG2 1 1
1 151 1 1 10 ARG HG3 H -18.132 -8.871 6.957 1.00 . A A . 10 ARG HG3 1 1
1 152 1 1 10 ARG HH11 H -22.322 -7.509 6.160 1.00 . A A . 10 ARG HH11 1 1
1 153 1 1 10 ARG HH12 H -23.736 -8.497 6.818 1.00 . A A . 10 ARG HH12 1 1
1 154 1 1 10 ARG HH21 H -21.611 -11.021 7.592 1.00 . A A . 10 ARG HH21 1 1
1 155 1 1 10 ARG HH22 H -23.356 -10.406 7.598 1.00 . A A . 10 ARG HH22 1 1
1 156 1 1 10 ARG N N -17.215 -7.136 3.444 1.00 . A A . 10 ARG N 1 1
1 157 1 1 10 ARG NE N -20.607 -9.200 6.630 1.00 . A A . 10 ARG NE 1 1
1 158 1 1 10 ARG NH1 N -22.759 -8.326 6.587 1.00 . A A . 10 ARG NH1 1 1
1 159 1 1 10 ARG NH2 N -22.357 -10.346 7.413 1.00 . A A . 10 ARG NH2 1 1
1 160 1 1 10 ARG O O -17.611 -3.895 4.667 1.00 . A A . 10 ARG O 1 1
1 161 1 1 11 ALA C C -14.322 -3.332 3.259 1.00 . A A . 11 ALA C 1 1
1 162 1 1 11 ALA CA C -14.848 -3.833 4.584 1.00 . A A . 11 ALA CA 1 1
1 163 1 1 11 ALA CB C -13.722 -4.205 5.566 1.00 . A A . 11 ALA CB 1 1
1 164 1 1 11 ALA H H -15.281 -5.956 4.211 1.00 . A A . 11 ALA H 1 1
1 165 1 1 11 ALA HA H -15.467 -3.027 5.020 1.00 . A A . 11 ALA HA 1 1
1 166 1 1 11 ALA HB1 H -14.122 -4.529 6.546 1.00 . A A . 11 ALA HB1 1 1
1 167 1 1 11 ALA HB2 H -13.093 -5.033 5.184 1.00 . A A . 11 ALA HB2 1 1
1 168 1 1 11 ALA HB3 H -13.050 -3.351 5.765 1.00 . A A . 11 ALA HB3 1 1
1 169 1 1 11 ALA N N -15.690 -5.012 4.409 1.00 . A A . 11 ALA N 1 1
1 170 1 1 11 ALA O O -13.222 -2.770 3.169 1.00 . A A . 11 ALA O 1 1
1 171 1 1 12 ARG C C -14.880 -1.716 0.573 1.00 . A A . 12 ARG C 1 1
1 172 1 1 12 ARG CA C -14.654 -3.183 0.853 1.00 . A A . 12 ARG CA 1 1
1 173 1 1 12 ARG CB C -15.411 -4.077 -0.167 1.00 . A A . 12 ARG CB 1 1
1 174 1 1 12 ARG CD C -13.307 -3.670 -1.582 1.00 . A A . 12 ARG CD 1 1
1 175 1 1 12 ARG CG C -14.586 -4.500 -1.411 1.00 . A A . 12 ARG CG 1 1
1 176 1 1 12 ARG CZ C -12.761 -3.692 -4.022 1.00 . A A . 12 ARG CZ 1 1
1 177 1 1 12 ARG H H -16.010 -3.999 2.381 1.00 . A A . 12 ARG H 1 1
1 178 1 1 12 ARG HA H -13.567 -3.376 0.783 1.00 . A A . 12 ARG HA 1 1
1 179 1 1 12 ARG HB2 H -15.771 -4.997 0.338 1.00 . A A . 12 ARG HB2 1 1
1 180 1 1 12 ARG HB3 H -16.339 -3.560 -0.492 1.00 . A A . 12 ARG HB3 1 1
1 181 1 1 12 ARG HD2 H -13.556 -2.594 -1.685 1.00 . A A . 12 ARG HD2 1 1
1 182 1 1 12 ARG HD3 H -12.661 -3.769 -0.686 1.00 . A A . 12 ARG HD3 1 1
1 183 1 1 12 ARG HE H -11.910 -4.915 -2.661 1.00 . A A . 12 ARG HE 1 1
1 184 1 1 12 ARG HG2 H -14.322 -5.575 -1.347 1.00 . A A . 12 ARG HG2 1 1
1 185 1 1 12 ARG HG3 H -15.188 -4.406 -2.338 1.00 . A A . 12 ARG HG3 1 1
1 186 1 1 12 ARG HH11 H -14.101 -2.371 -3.541 1.00 . A A . 12 ARG HH11 1 1
1 187 1 1 12 ARG HH12 H -13.627 -2.470 -5.322 1.00 . A A . 12 ARG HH12 1 1
1 188 1 1 12 ARG HH21 H -11.446 -4.962 -4.602 1.00 . A A . 12 ARG HH21 1 1
1 189 1 1 12 ARG HH22 H -12.184 -3.877 -5.905 1.00 . A A . 12 ARG HH22 1 1
1 190 1 1 12 ARG N N -15.089 -3.532 2.204 1.00 . A A . 12 ARG N 1 1
1 191 1 1 12 ARG NE N -12.593 -4.155 -2.790 1.00 . A A . 12 ARG NE 1 1
1 192 1 1 12 ARG NH1 N -13.586 -2.739 -4.341 1.00 . A A . 12 ARG NH1 1 1
1 193 1 1 12 ARG NH2 N -12.059 -4.226 -4.957 1.00 . A A . 12 ARG NH2 1 1
1 194 1 1 12 ARG O O -14.068 -1.041 -0.070 1.00 . A A . 12 ARG O 1 1
1 195 1 1 13 ALA C C -15.605 1.045 1.966 1.00 . A A . 13 ALA C 1 1
1 196 1 1 13 ALA CA C -16.318 0.221 0.919 1.00 . A A . 13 ALA CA 1 1
1 197 1 1 13 ALA CB C -17.849 0.359 0.997 1.00 . A A . 13 ALA CB 1 1
1 198 1 1 13 ALA H H -16.644 -1.867 1.535 1.00 . A A . 13 ALA H 1 1
1 199 1 1 13 ALA HA H -15.965 0.573 -0.069 1.00 . A A . 13 ALA HA 1 1
1 200 1 1 13 ALA HB1 H -18.356 -0.213 0.196 1.00 . A A . 13 ALA HB1 1 1
1 201 1 1 13 ALA HB2 H -18.253 -0.006 1.961 1.00 . A A . 13 ALA HB2 1 1
1 202 1 1 13 ALA HB3 H -18.173 1.411 0.886 1.00 . A A . 13 ALA HB3 1 1
1 203 1 1 13 ALA N N -15.997 -1.198 1.048 1.00 . A A . 13 ALA N 1 1
1 204 1 1 13 ALA O O -15.362 2.247 1.788 1.00 . A A . 13 ALA O 1 1
1 205 1 1 14 HIS C C -13.102 1.418 3.640 1.00 . A A . 14 HIS C 1 1
1 206 1 1 14 HIS CA C -14.493 1.086 4.129 1.00 . A A . 14 HIS CA 1 1
1 207 1 1 14 HIS CB C -14.421 0.102 5.310 1.00 . A A . 14 HIS CB 1 1
1 208 1 1 14 HIS CD2 C -15.915 -0.561 7.251 1.00 . A A . 14 HIS CD2 1 1
1 209 1 1 14 HIS CE1 C -17.817 -0.273 6.334 1.00 . A A . 14 HIS CE1 1 1
1 210 1 1 14 HIS CG C -15.763 -0.123 5.943 1.00 . A A . 14 HIS CG 1 1
1 211 1 1 14 HIS H H -15.665 -0.539 3.208 1.00 . A A . 14 HIS H 1 1
1 212 1 1 14 HIS HA H -14.981 2.048 4.359 1.00 . A A . 14 HIS HA 1 1
1 213 1 1 14 HIS HB2 H -14.027 -0.883 4.988 1.00 . A A . 14 HIS HB2 1 1
1 214 1 1 14 HIS HB3 H -13.728 0.449 6.105 1.00 . A A . 14 HIS HB3 1 1
1 215 1 1 14 HIS HD2 H -15.093 -0.781 7.926 1.00 . A A . 14 HIS HD2 1 1
1 216 1 1 14 HIS HE1 H -18.883 -0.222 6.151 1.00 . A A . 14 HIS HE1 1 1
1 217 1 1 14 HIS HE2 H -17.719 -0.951 8.386 1.00 . A A . 14 HIS HE2 1 1
1 218 1 1 14 HIS N N -15.284 0.430 3.089 1.00 . A A . 14 HIS N 1 1
1 219 1 1 14 HIS ND1 N -16.996 0.075 5.325 1.00 . A A . 14 HIS ND1 1 1
1 220 1 1 14 HIS NE2 N -17.257 -0.659 7.512 1.00 . A A . 14 HIS NE2 1 1
1 221 1 1 14 HIS O O -12.445 2.341 4.147 1.00 . A A . 14 HIS O 1 1
1 222 1 1 15 VAL C C -11.393 2.292 1.273 1.00 . A A . 15 VAL C 1 1
1 223 1 1 15 VAL CA C -11.335 0.984 2.026 1.00 . A A . 15 VAL CA 1 1
1 224 1 1 15 VAL CB C -10.912 -0.200 1.069 1.00 . A A . 15 VAL CB 1 1
1 225 1 1 15 VAL CG1 C -11.278 -0.040 -0.433 1.00 . A A . 15 VAL CG1 1 1
1 226 1 1 15 VAL CG2 C -9.394 -0.510 1.086 1.00 . A A . 15 VAL CG2 1 1
1 227 1 1 15 VAL H H -13.194 -0.148 2.376 1.00 . A A . 15 VAL H 1 1
1 228 1 1 15 VAL HA H -10.574 1.102 2.819 1.00 . A A . 15 VAL HA 1 1
1 229 1 1 15 VAL HB H -11.435 -1.113 1.428 1.00 . A A . 15 VAL HB 1 1
1 230 1 1 15 VAL HG11 H -10.819 0.860 -0.886 1.00 . A A . 15 VAL HG11 1 1
1 231 1 1 15 VAL HG12 H -10.960 -0.910 -1.038 1.00 . A A . 15 VAL HG12 1 1
1 232 1 1 15 VAL HG13 H -12.370 0.036 -0.595 1.00 . A A . 15 VAL HG13 1 1
1 233 1 1 15 VAL HG21 H -9.028 -0.710 2.109 1.00 . A A . 15 VAL HG21 1 1
1 234 1 1 15 VAL HG22 H -9.152 -1.411 0.492 1.00 . A A . 15 VAL HG22 1 1
1 235 1 1 15 VAL HG23 H -8.792 0.324 0.681 1.00 . A A . 15 VAL HG23 1 1
1 236 1 1 15 VAL N N -12.622 0.686 2.652 1.00 . A A . 15 VAL N 1 1
1 237 1 1 15 VAL O O -10.397 3.011 1.133 1.00 . A A . 15 VAL O 1 1
1 238 1 1 16 ASP C C -12.634 5.041 1.203 1.00 . A A . 16 ASP C 1 1
1 239 1 1 16 ASP CA C -12.809 3.942 0.180 1.00 . A A . 16 ASP CA 1 1
1 240 1 1 16 ASP CB C -14.210 3.988 -0.485 1.00 . A A . 16 ASP CB 1 1
1 241 1 1 16 ASP CG C -14.486 5.164 -1.433 1.00 . A A . 16 ASP CG 1 1
1 242 1 1 16 ASP H H -13.312 1.890 0.812 1.00 . A A . 16 ASP H 1 1
1 243 1 1 16 ASP HA H -12.023 4.087 -0.584 1.00 . A A . 16 ASP HA 1 1
1 244 1 1 16 ASP HB2 H -14.414 3.058 -1.045 1.00 . A A . 16 ASP HB2 1 1
1 245 1 1 16 ASP HB3 H -14.989 4.011 0.304 1.00 . A A . 16 ASP HB3 1 1
1 246 1 1 16 ASP N N -12.571 2.631 0.778 1.00 . A A . 16 ASP N 1 1
1 247 1 1 16 ASP O O -11.893 6.012 1.007 1.00 . A A . 16 ASP O 1 1
1 248 1 1 16 ASP OD1 O -14.193 5.147 -2.620 1.00 . A A . 16 ASP OD1 1 1
1 249 1 1 16 ASP OD2 O -15.108 6.212 -0.813 1.00 . A A . 16 ASP OD2 1 1
1 250 1 1 17 ALA C C -11.699 5.987 3.784 1.00 . A A . 17 ALA C 1 1
1 251 1 1 17 ALA CA C -13.163 5.802 3.460 1.00 . A A . 17 ALA CA 1 1
1 252 1 1 17 ALA CB C -13.957 5.204 4.635 1.00 . A A . 17 ALA CB 1 1
1 253 1 1 17 ALA H H -14.094 4.185 2.293 1.00 . A A . 17 ALA H 1 1
1 254 1 1 17 ALA HA H -13.574 6.797 3.206 1.00 . A A . 17 ALA HA 1 1
1 255 1 1 17 ALA HB1 H -15.035 5.114 4.400 1.00 . A A . 17 ALA HB1 1 1
1 256 1 1 17 ALA HB2 H -13.600 4.191 4.907 1.00 . A A . 17 ALA HB2 1 1
1 257 1 1 17 ALA HB3 H -13.882 5.830 5.543 1.00 . A A . 17 ALA HB3 1 1
1 258 1 1 17 ALA N N -13.346 4.921 2.309 1.00 . A A . 17 ALA N 1 1
1 259 1 1 17 ALA O O -11.258 7.062 4.211 1.00 . A A . 17 ALA O 1 1
1 260 1 1 18 LEU C C -8.659 5.783 3.158 1.00 . A A . 18 LEU C 1 1
1 261 1 1 18 LEU CA C -9.527 4.922 4.046 1.00 . A A . 18 LEU CA 1 1
1 262 1 1 18 LEU CB C -8.991 3.463 4.101 1.00 . A A . 18 LEU CB 1 1
1 263 1 1 18 LEU CD1 C -9.108 1.097 5.107 1.00 . A A . 18 LEU CD1 1 1
1 264 1 1 18 LEU CD2 C -8.578 3.072 6.567 1.00 . A A . 18 LEU CD2 1 1
1 265 1 1 18 LEU CG C -9.361 2.596 5.336 1.00 . A A . 18 LEU CG 1 1
1 266 1 1 18 LEU H H -11.357 4.114 3.125 1.00 . A A . 18 LEU H 1 1
1 267 1 1 18 LEU HA H -9.478 5.371 5.054 1.00 . A A . 18 LEU HA 1 1
1 268 1 1 18 LEU HB2 H -9.329 2.926 3.191 1.00 . A A . 18 LEU HB2 1 1
1 269 1 1 18 LEU HB3 H -7.887 3.490 4.014 1.00 . A A . 18 LEU HB3 1 1
1 270 1 1 18 LEU HD11 H -9.644 0.712 4.220 1.00 . A A . 18 LEU HD11 1 1
1 271 1 1 18 LEU HD12 H -8.032 0.891 4.956 1.00 . A A . 18 LEU HD12 1 1
1 272 1 1 18 LEU HD13 H -9.417 0.488 5.977 1.00 . A A . 18 LEU HD13 1 1
1 273 1 1 18 LEU HD21 H -7.485 3.035 6.400 1.00 . A A . 18 LEU HD21 1 1
1 274 1 1 18 LEU HD22 H -8.830 4.112 6.849 1.00 . A A . 18 LEU HD22 1 1
1 275 1 1 18 LEU HD23 H -8.782 2.437 7.450 1.00 . A A . 18 LEU HD23 1 1
1 276 1 1 18 LEU HG H -10.442 2.738 5.544 1.00 . A A . 18 LEU HG 1 1
1 277 1 1 18 LEU N N -10.918 4.939 3.601 1.00 . A A . 18 LEU N 1 1
1 278 1 1 18 LEU O O -7.706 6.429 3.616 1.00 . A A . 18 LEU O 1 1
1 279 1 1 19 ARG C C -8.323 8.045 1.159 1.00 . A A . 19 ARG C 1 1
1 280 1 1 19 ARG CA C -8.173 6.563 0.906 1.00 . A A . 19 ARG CA 1 1
1 281 1 1 19 ARG CB C -8.628 6.185 -0.531 1.00 . A A . 19 ARG CB 1 1
1 282 1 1 19 ARG CD C -7.860 5.800 -2.951 1.00 . A A . 19 ARG CD 1 1
1 283 1 1 19 ARG CG C -7.641 6.594 -1.656 1.00 . A A . 19 ARG CG 1 1
1 284 1 1 19 ARG CZ C -9.971 6.128 -4.249 1.00 . A A . 19 ARG CZ 1 1
1 285 1 1 19 ARG H H -9.796 5.238 1.587 1.00 . A A . 19 ARG H 1 1
1 286 1 1 19 ARG HA H -7.105 6.307 1.037 1.00 . A A . 19 ARG HA 1 1
1 287 1 1 19 ARG HB2 H -8.793 5.091 -0.596 1.00 . A A . 19 ARG HB2 1 1
1 288 1 1 19 ARG HB3 H -9.626 6.629 -0.730 1.00 . A A . 19 ARG HB3 1 1
1 289 1 1 19 ARG HD2 H -7.373 6.311 -3.805 1.00 . A A . 19 ARG HD2 1 1
1 290 1 1 19 ARG HD3 H -7.399 4.794 -2.869 1.00 . A A . 19 ARG HD3 1 1
1 291 1 1 19 ARG HE H -9.879 5.211 -2.455 1.00 . A A . 19 ARG HE 1 1
1 292 1 1 19 ARG HG2 H -7.732 7.678 -1.869 1.00 . A A . 19 ARG HG2 1 1
1 293 1 1 19 ARG HG3 H -6.589 6.450 -1.334 1.00 . A A . 19 ARG HG3 1 1
1 294 1 1 19 ARG HH11 H -8.399 6.845 -5.136 1.00 . A A . 19 ARG HH11 1 1
1 295 1 1 19 ARG HH12 H -10.012 7.036 -6.013 1.00 . A A . 19 ARG HH12 1 1
1 296 1 1 19 ARG HH21 H -11.585 5.455 -3.461 1.00 . A A . 19 ARG HH21 1 1
1 297 1 1 19 ARG HH22 H -11.748 6.285 -5.106 1.00 . A A . 19 ARG HH22 1 1
1 298 1 1 19 ARG N N -8.948 5.787 1.871 1.00 . A A . 19 ARG N 1 1
1 299 1 1 19 ARG NE N -9.322 5.681 -3.183 1.00 . A A . 19 ARG NE 1 1
1 300 1 1 19 ARG NH1 N -9.407 6.739 -5.249 1.00 . A A . 19 ARG NH1 1 1
1 301 1 1 19 ARG NH2 N -11.243 5.943 -4.291 1.00 . A A . 19 ARG NH2 1 1
1 302 1 1 19 ARG O O -7.384 8.832 0.990 1.00 . A A . 19 ARG O 1 1
1 303 1 1 20 THR C C -8.864 10.488 2.779 1.00 . A A . 20 THR C 1 1
1 304 1 1 20 THR CA C -9.812 9.863 1.782 1.00 . A A . 20 THR CA 1 1
1 305 1 1 20 THR CB C -11.298 10.051 2.243 1.00 . A A . 20 THR CB 1 1
1 306 1 1 20 THR CG2 C -11.683 11.455 2.756 1.00 . A A . 20 THR CG2 1 1
1 307 1 1 20 THR H H -10.222 7.696 1.732 1.00 . A A . 20 THR H 1 1
1 308 1 1 20 THR HA H -9.671 10.387 0.819 1.00 . A A . 20 THR HA 1 1
1 309 1 1 20 THR HB H -11.510 9.314 3.047 1.00 . A A . 20 THR HB 1 1
1 310 1 1 20 THR HG1 H -13.076 9.871 1.527 1.00 . A A . 20 THR HG1 1 1
1 311 1 1 20 THR HG21 H -11.501 12.235 1.994 1.00 . A A . 20 THR HG21 1 1
1 312 1 1 20 THR HG22 H -12.750 11.516 3.040 1.00 . A A . 20 THR HG22 1 1
1 313 1 1 20 THR HG23 H -11.116 11.745 3.661 1.00 . A A . 20 THR HG23 1 1
1 314 1 1 20 THR N N -9.506 8.449 1.585 1.00 . A A . 20 THR N 1 1
1 315 1 1 20 THR O O -8.554 11.685 2.719 1.00 . A A . 20 THR O 1 1
1 316 1 1 20 THR OG1 O -12.188 9.810 1.161 1.00 . A A . 20 THR OG1 1 1
1 317 1 1 21 HIS C C -6.087 10.364 4.124 1.00 . A A . 21 HIS C 1 1
1 318 1 1 21 HIS CA C -7.454 10.163 4.734 1.00 . A A . 21 HIS CA 1 1
1 319 1 1 21 HIS CB C -7.399 9.078 5.823 1.00 . A A . 21 HIS CB 1 1
1 320 1 1 21 HIS CD2 C -9.272 8.062 7.198 1.00 . A A . 21 HIS CD2 1 1
1 321 1 1 21 HIS CE1 C -10.033 9.833 8.106 1.00 . A A . 21 HIS CE1 1 1
1 322 1 1 21 HIS CG C -8.550 9.172 6.781 1.00 . A A . 21 HIS CG 1 1
1 323 1 1 21 HIS H H -8.809 8.727 3.756 1.00 . A A . 21 HIS H 1 1
1 324 1 1 21 HIS HA H -7.792 11.152 5.084 1.00 . A A . 21 HIS HA 1 1
1 325 1 1 21 HIS HB2 H -7.407 8.063 5.379 1.00 . A A . 21 HIS HB2 1 1
1 326 1 1 21 HIS HB3 H -6.462 9.131 6.418 1.00 . A A . 21 HIS HB3 1 1
1 327 1 1 21 HIS HD2 H -9.076 7.044 6.875 1.00 . A A . 21 HIS HD2 1 1
1 328 1 1 21 HIS HE1 H -10.618 10.524 8.700 1.00 . A A . 21 HIS HE1 1 1
1 329 1 1 21 HIS HE2 H -10.953 7.928 8.558 1.00 . A A . 21 HIS HE2 1 1
1 330 1 1 21 HIS N N -8.410 9.697 3.733 1.00 . A A . 21 HIS N 1 1
1 331 1 1 21 HIS ND1 N -9.034 10.342 7.361 1.00 . A A . 21 HIS ND1 1 1
1 332 1 1 21 HIS NE2 N -10.244 8.490 8.065 1.00 . A A . 21 HIS NE2 1 1
1 333 1 1 21 HIS O O -5.428 11.391 4.326 1.00 . A A . 21 HIS O 1 1
1 334 1 1 22 LEU C C -4.282 9.905 1.394 1.00 . A A . 22 LEU C 1 1
1 335 1 1 22 LEU CA C -4.279 9.393 2.816 1.00 . A A . 22 LEU CA 1 1
1 336 1 1 22 LEU CB C -3.639 7.977 2.891 1.00 . A A . 22 LEU CB 1 1
1 337 1 1 22 LEU CD1 C -3.782 6.620 0.709 1.00 . A A . 22 LEU CD1 1 1
1 338 1 1 22 LEU CD2 C -4.203 5.510 2.923 1.00 . A A . 22 LEU CD2 1 1
1 339 1 1 22 LEU CG C -4.337 6.817 2.130 1.00 . A A . 22 LEU CG 1 1
1 340 1 1 22 LEU H H -6.285 8.579 3.205 1.00 . A A . 22 LEU H 1 1
1 341 1 1 22 LEU HA H -3.671 10.107 3.400 1.00 . A A . 22 LEU HA 1 1
1 342 1 1 22 LEU HB2 H -2.592 8.042 2.533 1.00 . A A . 22 LEU HB2 1 1
1 343 1 1 22 LEU HB3 H -3.550 7.689 3.957 1.00 . A A . 22 LEU HB3 1 1
1 344 1 1 22 LEU HD11 H -3.747 7.577 0.156 1.00 . A A . 22 LEU HD11 1 1
1 345 1 1 22 LEU HD12 H -2.745 6.236 0.720 1.00 . A A . 22 LEU HD12 1 1
1 346 1 1 22 LEU HD13 H -4.394 5.918 0.114 1.00 . A A . 22 LEU HD13 1 1
1 347 1 1 22 LEU HD21 H -4.554 5.624 3.966 1.00 . A A . 22 LEU HD21 1 1
1 348 1 1 22 LEU HD22 H -4.785 4.684 2.472 1.00 . A A . 22 LEU HD22 1 1
1 349 1 1 22 LEU HD23 H -3.151 5.174 2.980 1.00 . A A . 22 LEU HD23 1 1
1 350 1 1 22 LEU HG H -5.417 7.058 2.050 1.00 . A A . 22 LEU HG 1 1
1 351 1 1 22 LEU N N -5.627 9.375 3.381 1.00 . A A . 22 LEU N 1 1
1 352 1 1 22 LEU O O -3.458 9.500 0.560 1.00 . A A . 22 LEU O 1 1
1 353 1 1 23 ALA C C -3.839 12.147 -0.447 1.00 . A A . 23 ALA C 1 1
1 354 1 1 23 ALA CA C -5.184 11.508 -0.195 1.00 . A A . 23 ALA CA 1 1
1 355 1 1 23 ALA CB C -6.335 12.530 -0.184 1.00 . A A . 23 ALA CB 1 1
1 356 1 1 23 ALA H H -5.926 10.989 1.815 1.00 . A A . 23 ALA H 1 1
1 357 1 1 23 ALA HA H -5.355 10.772 -1.003 1.00 . A A . 23 ALA HA 1 1
1 358 1 1 23 ALA HB1 H -7.316 12.039 -0.035 1.00 . A A . 23 ALA HB1 1 1
1 359 1 1 23 ALA HB2 H -6.220 13.275 0.628 1.00 . A A . 23 ALA HB2 1 1
1 360 1 1 23 ALA HB3 H -6.400 13.089 -1.133 1.00 . A A . 23 ALA HB3 1 1
1 361 1 1 23 ALA N N -5.196 10.805 1.085 1.00 . A A . 23 ALA N 1 1
1 362 1 1 23 ALA O O -3.172 11.890 -1.453 1.00 . A A . 23 ALA O 1 1
1 363 1 1 24 PRO C C -0.883 13.148 0.886 1.00 . A A . 24 PRO C 1 1
1 364 1 1 24 PRO CA C -2.144 13.839 0.417 1.00 . A A . 24 PRO CA 1 1
1 365 1 1 24 PRO CB C -2.412 15.027 1.334 1.00 . A A . 24 PRO CB 1 1
1 366 1 1 24 PRO CD C -4.099 13.328 1.747 1.00 . A A . 24 PRO CD 1 1
1 367 1 1 24 PRO CG C -3.194 14.335 2.464 1.00 . A A . 24 PRO CG 1 1
1 368 1 1 24 PRO HA H -1.971 14.161 -0.600 1.00 . A A . 24 PRO HA 1 1
1 369 1 1 24 PRO HB2 H -1.458 15.397 1.746 1.00 . A A . 24 PRO HB2 1 1
1 370 1 1 24 PRO HB3 H -3.070 15.738 0.821 1.00 . A A . 24 PRO HB3 1 1
1 371 1 1 24 PRO HD2 H -4.170 12.411 2.357 1.00 . A A . 24 PRO HD2 1 1
1 372 1 1 24 PRO HD3 H -5.079 13.790 1.535 1.00 . A A . 24 PRO HD3 1 1
1 373 1 1 24 PRO HG2 H -2.589 13.638 3.072 1.00 . A A . 24 PRO HG2 1 1
1 374 1 1 24 PRO HG3 H -3.744 15.130 2.992 1.00 . A A . 24 PRO HG3 1 1
1 375 1 1 24 PRO N N -3.422 12.999 0.470 1.00 . A A . 24 PRO N 1 1
1 376 1 1 24 PRO O O 0.101 13.796 1.272 1.00 . A A . 24 PRO O 1 1
1 377 1 1 25 TYR C C 1.001 10.328 0.227 1.00 . A A . 25 TYR C 1 1
1 378 1 1 25 TYR CA C 0.254 11.035 1.339 1.00 . A A . 25 TYR CA 1 1
1 379 1 1 25 TYR CB C -0.247 9.947 2.336 1.00 . A A . 25 TYR CB 1 1
1 380 1 1 25 TYR CD1 C -0.026 11.647 4.216 1.00 . A A . 25 TYR CD1 1 1
1 381 1 1 25 TYR CD2 C -0.933 9.470 4.739 1.00 . A A . 25 TYR CD2 1 1
1 382 1 1 25 TYR CE1 C -0.118 12.007 5.558 1.00 . A A . 25 TYR CE1 1 1
1 383 1 1 25 TYR CE2 C -1.020 9.830 6.082 1.00 . A A . 25 TYR CE2 1 1
1 384 1 1 25 TYR CG C -0.409 10.368 3.801 1.00 . A A . 25 TYR CG 1 1
1 385 1 1 25 TYR CZ C -0.617 11.098 6.488 1.00 . A A . 25 TYR CZ 1 1
1 386 1 1 25 TYR H H -1.717 11.376 0.427 1.00 . A A . 25 TYR H 1 1
1 387 1 1 25 TYR HA H 0.969 11.713 1.841 1.00 . A A . 25 TYR HA 1 1
1 388 1 1 25 TYR HB2 H -1.195 9.510 1.960 1.00 . A A . 25 TYR HB2 1 1
1 389 1 1 25 TYR HB3 H 0.451 9.081 2.320 1.00 . A A . 25 TYR HB3 1 1
1 390 1 1 25 TYR HD1 H 0.389 12.348 3.503 1.00 . A A . 25 TYR HD1 1 1
1 391 1 1 25 TYR HD2 H -1.231 8.476 4.434 1.00 . A A . 25 TYR HD2 1 1
1 392 1 1 25 TYR HE1 H 0.204 12.990 5.867 1.00 . A A . 25 TYR HE1 1 1
1 393 1 1 25 TYR HE2 H -1.400 9.129 6.810 1.00 . A A . 25 TYR HE2 1 1
1 394 1 1 25 TYR HH H -1.426 12.116 7.872 1.00 . A A . 25 TYR HH 1 1
1 395 1 1 25 TYR N N -0.863 11.829 0.835 1.00 . A A . 25 TYR N 1 1
1 396 1 1 25 TYR O O 2.166 9.934 0.395 1.00 . A A . 25 TYR O 1 1
1 397 1 1 25 TYR OH O -0.715 11.462 7.805 1.00 . A A . 25 TYR OH 1 1
1 398 1 1 26 SER C C 2.306 9.748 -2.350 1.00 . A A . 26 SER C 1 1
1 399 1 1 26 SER CA C 0.905 9.309 -1.989 1.00 . A A . 26 SER CA 1 1
1 400 1 1 26 SER CB C -0.026 9.330 -3.230 1.00 . A A . 26 SER CB 1 1
1 401 1 1 26 SER H H -0.614 10.524 -0.959 1.00 . A A . 26 SER H 1 1
1 402 1 1 26 SER HA H 0.981 8.268 -1.628 1.00 . A A . 26 SER HA 1 1
1 403 1 1 26 SER HB2 H -0.337 10.371 -3.445 1.00 . A A . 26 SER HB2 1 1
1 404 1 1 26 SER HB3 H 0.511 8.999 -4.139 1.00 . A A . 26 SER HB3 1 1
1 405 1 1 26 SER HG H -1.072 7.715 -3.539 1.00 . A A . 26 SER HG 1 1
1 406 1 1 26 SER N N 0.353 10.119 -0.904 1.00 . A A . 26 SER N 1 1
1 407 1 1 26 SER O O 3.267 8.970 -2.292 1.00 . A A . 26 SER O 1 1
1 408 1 1 26 SER OG O -1.203 8.534 -3.054 1.00 . A A . 26 SER OG 1 1
1 409 1 1 27 ASP C C 4.487 12.238 -2.208 1.00 . A A . 27 ASP C 1 1
1 410 1 1 27 ASP CA C 3.710 11.504 -3.276 1.00 . A A . 27 ASP CA 1 1
1 411 1 1 27 ASP CB C 3.456 12.393 -4.523 1.00 . A A . 27 ASP CB 1 1
1 412 1 1 27 ASP CG C 2.202 13.279 -4.495 1.00 . A A . 27 ASP CG 1 1
1 413 1 1 27 ASP H H 1.596 11.607 -2.666 1.00 . A A . 27 ASP H 1 1
1 414 1 1 27 ASP HA H 4.313 10.621 -3.557 1.00 . A A . 27 ASP HA 1 1
1 415 1 1 27 ASP HB2 H 4.320 13.050 -4.725 1.00 . A A . 27 ASP HB2 1 1
1 416 1 1 27 ASP HB3 H 3.382 11.748 -5.422 1.00 . A A . 27 ASP HB3 1 1
1 417 1 1 27 ASP N N 2.446 10.999 -2.748 1.00 . A A . 27 ASP N 1 1
1 418 1 1 27 ASP O O 4.670 13.460 -2.256 1.00 . A A . 27 ASP O 1 1
1 419 1 1 27 ASP OD1 O 1.103 12.891 -4.864 1.00 . A A . 27 ASP OD1 1 1
1 420 1 1 27 ASP OD2 O 2.457 14.543 -4.040 1.00 . A A . 27 ASP OD2 1 1
1 421 1 1 28 GLU C C 6.944 11.060 0.162 1.00 . A A . 28 GLU C 1 1
1 422 1 1 28 GLU CA C 5.867 12.052 -0.214 1.00 . A A . 28 GLU CA 1 1
1 423 1 1 28 GLU CB C 5.012 12.461 1.018 1.00 . A A . 28 GLU CB 1 1
1 424 1 1 28 GLU CD C 4.738 12.098 3.636 1.00 . A A . 28 GLU CD 1 1
1 425 1 1 28 GLU CG C 4.975 11.495 2.248 1.00 . A A . 28 GLU CG 1 1
1 426 1 1 28 GLU H H 4.652 10.501 -1.200 1.00 . A A . 28 GLU H 1 1
1 427 1 1 28 GLU HA H 6.367 12.946 -0.631 1.00 . A A . 28 GLU HA 1 1
1 428 1 1 28 GLU HB2 H 5.344 13.463 1.360 1.00 . A A . 28 GLU HB2 1 1
1 429 1 1 28 GLU HB3 H 3.967 12.631 0.680 1.00 . A A . 28 GLU HB3 1 1
1 430 1 1 28 GLU HG2 H 4.193 10.728 2.096 1.00 . A A . 28 GLU HG2 1 1
1 431 1 1 28 GLU HG3 H 5.915 10.915 2.310 1.00 . A A . 28 GLU HG3 1 1
1 432 1 1 28 GLU N N 4.977 11.497 -1.230 1.00 . A A . 28 GLU N 1 1
1 433 1 1 28 GLU O O 8.122 11.407 0.313 1.00 . A A . 28 GLU O 1 1
1 434 1 1 28 GLU OE1 O 5.522 13.178 3.904 1.00 . A A . 28 GLU OE1 1 1
1 435 1 1 28 GLU OE2 O 3.919 11.649 4.426 1.00 . A A . 28 GLU OE2 1 1
1 436 1 1 29 LEU C C 7.514 7.779 -0.615 1.00 . A A . 29 LEU C 1 1
1 437 1 1 29 LEU CA C 7.504 8.724 0.564 1.00 . A A . 29 LEU CA 1 1
1 438 1 1 29 LEU CB C 7.184 7.966 1.884 1.00 . A A . 29 LEU CB 1 1
1 439 1 1 29 LEU CD1 C 6.006 6.172 3.226 1.00 . A A . 29 LEU CD1 1 1
1 440 1 1 29 LEU CD2 C 4.743 7.321 1.385 1.00 . A A . 29 LEU CD2 1 1
1 441 1 1 29 LEU CG C 6.126 6.830 1.844 1.00 . A A . 29 LEU CG 1 1
1 442 1 1 29 LEU H H 5.523 9.637 0.295 1.00 . A A . 29 LEU H 1 1
1 443 1 1 29 LEU HA H 8.517 9.158 0.624 1.00 . A A . 29 LEU HA 1 1
1 444 1 1 29 LEU HB2 H 8.127 7.542 2.287 1.00 . A A . 29 LEU HB2 1 1
1 445 1 1 29 LEU HB3 H 6.868 8.707 2.646 1.00 . A A . 29 LEU HB3 1 1
1 446 1 1 29 LEU HD11 H 6.976 5.766 3.573 1.00 . A A . 29 LEU HD11 1 1
1 447 1 1 29 LEU HD12 H 5.653 6.879 4.000 1.00 . A A . 29 LEU HD12 1 1
1 448 1 1 29 LEU HD13 H 5.297 5.323 3.213 1.00 . A A . 29 LEU HD13 1 1
1 449 1 1 29 LEU HD21 H 4.363 8.150 2.010 1.00 . A A . 29 LEU HD21 1 1
1 450 1 1 29 LEU HD22 H 4.774 7.685 0.341 1.00 . A A . 29 LEU HD22 1 1
1 451 1 1 29 LEU HD23 H 3.989 6.513 1.404 1.00 . A A . 29 LEU HD23 1 1
1 452 1 1 29 LEU HG H 6.475 6.057 1.129 1.00 . A A . 29 LEU HG 1 1
1 453 1 1 29 LEU N N 6.554 9.814 0.352 1.00 . A A . 29 LEU N 1 1
1 454 1 1 29 LEU O O 6.524 7.101 -0.916 1.00 . A A . 29 LEU O 1 1
1 455 1 1 30 ARG C C 10.228 6.860 -2.951 1.00 . A A . 30 ARG C 1 1
1 456 1 1 30 ARG CA C 8.809 6.814 -2.435 1.00 . A A . 30 ARG CA 1 1
1 457 1 1 30 ARG CB C 7.788 7.158 -3.554 1.00 . A A . 30 ARG CB 1 1
1 458 1 1 30 ARG CD C 5.551 6.201 -4.370 1.00 . A A . 30 ARG CD 1 1
1 459 1 1 30 ARG CG C 7.047 5.937 -4.160 1.00 . A A . 30 ARG CG 1 1
1 460 1 1 30 ARG CZ C 3.933 4.607 -3.324 1.00 . A A . 30 ARG CZ 1 1
1 461 1 1 30 ARG H H 9.386 8.400 -1.022 1.00 . A A . 30 ARG H 1 1
1 462 1 1 30 ARG HA H 8.621 5.789 -2.063 1.00 . A A . 30 ARG HA 1 1
1 463 1 1 30 ARG HB2 H 7.029 7.864 -3.164 1.00 . A A . 30 ARG HB2 1 1
1 464 1 1 30 ARG HB3 H 8.302 7.721 -4.361 1.00 . A A . 30 ARG HB3 1 1
1 465 1 1 30 ARG HD2 H 5.355 7.290 -4.427 1.00 . A A . 30 ARG HD2 1 1
1 466 1 1 30 ARG HD3 H 5.212 5.759 -5.329 1.00 . A A . 30 ARG HD3 1 1
1 467 1 1 30 ARG HE H 4.988 5.985 -2.296 1.00 . A A . 30 ARG HE 1 1
1 468 1 1 30 ARG HG2 H 7.510 5.648 -5.125 1.00 . A A . 30 ARG HG2 1 1
1 469 1 1 30 ARG HG3 H 7.155 5.044 -3.510 1.00 . A A . 30 ARG HG3 1 1
1 470 1 1 30 ARG HH11 H 4.097 4.391 -5.247 1.00 . A A . 30 ARG HH11 1 1
1 471 1 1 30 ARG HH12 H 2.921 3.265 -4.378 1.00 . A A . 30 ARG HH12 1 1
1 472 1 1 30 ARG HH21 H 3.698 4.735 -1.424 1.00 . A A . 30 ARG HH21 1 1
1 473 1 1 30 ARG HH22 H 2.703 3.444 -2.299 1.00 . A A . 30 ARG HH22 1 1
1 474 1 1 30 ARG N N 8.627 7.743 -1.324 1.00 . A A . 30 ARG N 1 1
1 475 1 1 30 ARG NE N 4.808 5.599 -3.233 1.00 . A A . 30 ARG NE 1 1
1 476 1 1 30 ARG NH1 N 3.606 4.016 -4.435 1.00 . A A . 30 ARG NH1 1 1
1 477 1 1 30 ARG NH2 N 3.374 4.207 -2.237 1.00 . A A . 30 ARG NH2 1 1
1 478 1 1 30 ARG O O 10.815 5.841 -3.332 1.00 . A A . 30 ARG O 1 1
1 479 1 1 31 GLN C C 13.065 7.738 -2.154 1.00 . A A . 31 GLN C 1 1
1 480 1 1 31 GLN CA C 12.210 8.226 -3.302 1.00 . A A . 31 GLN CA 1 1
1 481 1 1 31 GLN CB C 12.477 9.718 -3.594 1.00 . A A . 31 GLN CB 1 1
1 482 1 1 31 GLN CD C 11.692 11.799 -5.076 1.00 . A A . 31 GLN CD 1 1
1 483 1 1 31 GLN CG C 11.872 10.284 -4.922 1.00 . A A . 31 GLN CG 1 1
1 484 1 1 31 GLN H H 10.152 8.871 -2.861 1.00 . A A . 31 GLN H 1 1
1 485 1 1 31 GLN HA H 12.464 7.618 -4.191 1.00 . A A . 31 GLN HA 1 1
1 486 1 1 31 GLN HB2 H 12.094 10.323 -2.748 1.00 . A A . 31 GLN HB2 1 1
1 487 1 1 31 GLN HB3 H 13.575 9.887 -3.599 1.00 . A A . 31 GLN HB3 1 1
1 488 1 1 31 GLN HE21 H 13.370 12.167 -4.108 1.00 . A A . 31 GLN HE21 1 1
1 489 1 1 31 GLN HE22 H 12.401 13.609 -4.745 1.00 . A A . 31 GLN HE22 1 1
1 490 1 1 31 GLN HG2 H 12.461 9.931 -5.789 1.00 . A A . 31 GLN HG2 1 1
1 491 1 1 31 GLN HG3 H 10.862 9.868 -5.090 1.00 . A A . 31 GLN HG3 1 1
1 492 1 1 31 GLN N N 10.792 8.052 -3.002 1.00 . A A . 31 GLN N 1 1
1 493 1 1 31 GLN NE2 N 12.592 12.617 -4.594 1.00 . A A . 31 GLN NE2 1 1
1 494 1 1 31 GLN O O 14.214 7.315 -2.325 1.00 . A A . 31 GLN O 1 1
1 495 1 1 31 GLN OE1 O 10.721 12.264 -5.653 1.00 . A A . 31 GLN OE1 1 1
1 496 1 1 32 ARG C C 13.166 5.717 0.130 1.00 . A A . 32 ARG C 1 1
1 497 1 1 32 ARG CA C 13.146 7.225 0.226 1.00 . A A . 32 ARG CA 1 1
1 498 1 1 32 ARG CB C 12.382 7.708 1.493 1.00 . A A . 32 ARG CB 1 1
1 499 1 1 32 ARG CD C 12.394 7.698 4.059 1.00 . A A . 32 ARG CD 1 1
1 500 1 1 32 ARG CG C 13.241 7.784 2.782 1.00 . A A . 32 ARG CG 1 1
1 501 1 1 32 ARG CZ C 13.058 6.446 6.119 1.00 . A A . 32 ARG CZ 1 1
1 502 1 1 32 ARG H H 11.634 8.373 -0.888 1.00 . A A . 32 ARG H 1 1
1 503 1 1 32 ARG HA H 14.194 7.569 0.283 1.00 . A A . 32 ARG HA 1 1
1 504 1 1 32 ARG HB2 H 11.942 8.707 1.306 1.00 . A A . 32 ARG HB2 1 1
1 505 1 1 32 ARG HB3 H 11.512 7.041 1.659 1.00 . A A . 32 ARG HB3 1 1
1 506 1 1 32 ARG HD2 H 12.532 8.609 4.676 1.00 . A A . 32 ARG HD2 1 1
1 507 1 1 32 ARG HD3 H 11.316 7.640 3.803 1.00 . A A . 32 ARG HD3 1 1
1 508 1 1 32 ARG HE H 12.918 5.614 4.286 1.00 . A A . 32 ARG HE 1 1
1 509 1 1 32 ARG HG2 H 13.993 6.970 2.809 1.00 . A A . 32 ARG HG2 1 1
1 510 1 1 32 ARG HG3 H 13.830 8.723 2.794 1.00 . A A . 32 ARG HG3 1 1
1 511 1 1 32 ARG HH11 H 12.689 8.326 6.441 1.00 . A A . 32 ARG HH11 1 1
1 512 1 1 32 ARG HH12 H 13.185 7.310 7.900 1.00 . A A . 32 ARG HH12 1 1
1 513 1 1 32 ARG HH21 H 13.444 4.579 5.910 1.00 . A A . 32 ARG HH21 1 1
1 514 1 1 32 ARG HH22 H 13.596 5.272 7.618 1.00 . A A . 32 ARG HH22 1 1
1 515 1 1 32 ARG N N 12.522 7.817 -0.953 1.00 . A A . 32 ARG N 1 1
1 516 1 1 32 ARG NE N 12.811 6.491 4.817 1.00 . A A . 32 ARG NE 1 1
1 517 1 1 32 ARG NH1 N 12.971 7.469 6.918 1.00 . A A . 32 ARG NH1 1 1
1 518 1 1 32 ARG NH2 N 13.406 5.314 6.619 1.00 . A A . 32 ARG NH2 1 1
1 519 1 1 32 ARG O O 14.112 5.049 0.563 1.00 . A A . 32 ARG O 1 1
1 520 1 1 33 LEU C C 12.919 3.381 -1.980 1.00 . A A . 33 LEU C 1 1
1 521 1 1 33 LEU CA C 12.081 3.729 -0.772 1.00 . A A . 33 LEU CA 1 1
1 522 1 1 33 LEU CB C 10.606 3.272 -0.979 1.00 . A A . 33 LEU CB 1 1
1 523 1 1 33 LEU CD1 C 8.176 3.886 -0.619 1.00 . A A . 33 LEU CD1 1 1
1 524 1 1 33 LEU CD2 C 9.434 2.796 1.262 1.00 . A A . 33 LEU CD2 1 1
1 525 1 1 33 LEU CG C 9.547 3.742 0.055 1.00 . A A . 33 LEU CG 1 1
1 526 1 1 33 LEU H H 11.325 5.795 -0.684 1.00 . A A . 33 LEU H 1 1
1 527 1 1 33 LEU HA H 12.525 3.174 0.077 1.00 . A A . 33 LEU HA 1 1
1 528 1 1 33 LEU HB2 H 10.273 3.596 -1.984 1.00 . A A . 33 LEU HB2 1 1
1 529 1 1 33 LEU HB3 H 10.584 2.166 -1.020 1.00 . A A . 33 LEU HB3 1 1
1 530 1 1 33 LEU HD11 H 8.208 4.594 -1.469 1.00 . A A . 33 LEU HD11 1 1
1 531 1 1 33 LEU HD12 H 7.798 2.923 -1.012 1.00 . A A . 33 LEU HD12 1 1
1 532 1 1 33 LEU HD13 H 7.414 4.272 0.084 1.00 . A A . 33 LEU HD13 1 1
1 533 1 1 33 LEU HD21 H 9.208 1.756 0.960 1.00 . A A . 33 LEU HD21 1 1
1 534 1 1 33 LEU HD22 H 10.375 2.772 1.843 1.00 . A A . 33 LEU HD22 1 1
1 535 1 1 33 LEU HD23 H 8.647 3.119 1.968 1.00 . A A . 33 LEU HD23 1 1
1 536 1 1 33 LEU HG H 9.850 4.743 0.427 1.00 . A A . 33 LEU HG 1 1
1 537 1 1 33 LEU N N 12.125 5.155 -0.456 1.00 . A A . 33 LEU N 1 1
1 538 1 1 33 LEU O O 13.221 2.203 -2.234 1.00 . A A . 33 LEU O 1 1
1 539 1 1 34 ALA C C 15.594 4.142 -3.656 1.00 . A A . 34 ALA C 1 1
1 540 1 1 34 ALA CA C 14.114 4.155 -3.959 1.00 . A A . 34 ALA CA 1 1
1 541 1 1 34 ALA CB C 13.739 5.255 -4.974 1.00 . A A . 34 ALA CB 1 1
1 542 1 1 34 ALA H H 12.905 5.317 -2.546 1.00 . A A . 34 ALA H 1 1
1 543 1 1 34 ALA HA H 13.851 3.165 -4.373 1.00 . A A . 34 ALA HA 1 1
1 544 1 1 34 ALA HB1 H 12.670 5.216 -5.249 1.00 . A A . 34 ALA HB1 1 1
1 545 1 1 34 ALA HB2 H 13.941 6.270 -4.585 1.00 . A A . 34 ALA HB2 1 1
1 546 1 1 34 ALA HB3 H 14.312 5.150 -5.917 1.00 . A A . 34 ALA HB3 1 1
1 547 1 1 34 ALA N N 13.288 4.370 -2.770 1.00 . A A . 34 ALA N 1 1
1 548 1 1 34 ALA O O 16.431 4.329 -4.559 1.00 . A A . 34 ALA O 1 1
1 549 1 1 35 ALA C C 17.722 2.433 -1.625 1.00 . A A . 35 ALA C 1 1
1 550 1 1 35 ALA CA C 17.373 3.849 -2.019 1.00 . A A . 35 ALA CA 1 1
1 551 1 1 35 ALA CB C 17.624 4.860 -0.887 1.00 . A A . 35 ALA CB 1 1
1 552 1 1 35 ALA H H 15.200 3.945 -1.691 1.00 . A A . 35 ALA H 1 1
1 553 1 1 35 ALA HA H 18.000 4.109 -2.892 1.00 . A A . 35 ALA HA 1 1
1 554 1 1 35 ALA HB1 H 17.403 5.897 -1.204 1.00 . A A . 35 ALA HB1 1 1
1 555 1 1 35 ALA HB2 H 16.999 4.654 0.003 1.00 . A A . 35 ALA HB2 1 1
1 556 1 1 35 ALA HB3 H 18.678 4.850 -0.552 1.00 . A A . 35 ALA HB3 1 1
1 557 1 1 35 ALA N N 15.968 3.958 -2.404 1.00 . A A . 35 ALA N 1 1
1 558 1 1 35 ALA O O 18.752 1.879 -2.031 1.00 . A A . 35 ALA O 1 1
1 559 1 1 36 ARG C C 16.695 -0.457 -1.651 1.00 . A A . 36 ARG C 1 1
1 560 1 1 36 ARG CA C 17.020 0.416 -0.461 1.00 . A A . 36 ARG CA 1 1
1 561 1 1 36 ARG CB C 16.094 0.098 0.745 1.00 . A A . 36 ARG CB 1 1
1 562 1 1 36 ARG CD C 17.392 -1.696 2.043 1.00 . A A . 36 ARG CD 1 1
1 563 1 1 36 ARG CG C 16.131 -1.376 1.227 1.00 . A A . 36 ARG CG 1 1
1 564 1 1 36 ARG CZ C 18.036 -3.538 3.618 1.00 . A A . 36 ARG CZ 1 1
1 565 1 1 36 ARG H H 16.093 2.414 -0.440 1.00 . A A . 36 ARG H 1 1
1 566 1 1 36 ARG HA H 18.073 0.224 -0.182 1.00 . A A . 36 ARG HA 1 1
1 567 1 1 36 ARG HB2 H 16.345 0.773 1.590 1.00 . A A . 36 ARG HB2 1 1
1 568 1 1 36 ARG HB3 H 15.046 0.354 0.490 1.00 . A A . 36 ARG HB3 1 1
1 569 1 1 36 ARG HD2 H 18.263 -1.823 1.371 1.00 . A A . 36 ARG HD2 1 1
1 570 1 1 36 ARG HD3 H 17.607 -0.875 2.754 1.00 . A A . 36 ARG HD3 1 1
1 571 1 1 36 ARG HE H 16.252 -3.405 2.673 1.00 . A A . 36 ARG HE 1 1
1 572 1 1 36 ARG HG2 H 15.232 -1.603 1.835 1.00 . A A . 36 ARG HG2 1 1
1 573 1 1 36 ARG HG3 H 16.086 -2.077 0.370 1.00 . A A . 36 ARG HG3 1 1
1 574 1 1 36 ARG HH11 H 19.435 -2.213 3.370 1.00 . A A . 36 ARG HH11 1 1
1 575 1 1 36 ARG HH12 H 19.798 -3.604 4.528 1.00 . A A . 36 ARG HH12 1 1
1 576 1 1 36 ARG HH21 H 16.742 -4.929 3.892 1.00 . A A . 36 ARG HH21 1 1
1 577 1 1 36 ARG HH22 H 18.319 -5.060 4.851 1.00 . A A . 36 ARG HH22 1 1
1 578 1 1 36 ARG N N 16.886 1.830 -0.800 1.00 . A A . 36 ARG N 1 1
1 579 1 1 36 ARG NE N 17.167 -2.959 2.804 1.00 . A A . 36 ARG NE 1 1
1 580 1 1 36 ARG NH1 N 19.224 -3.075 3.873 1.00 . A A . 36 ARG NH1 1 1
1 581 1 1 36 ARG NH2 N 17.672 -4.630 4.192 1.00 . A A . 36 ARG NH2 1 1
1 582 1 1 36 ARG O O 17.355 -1.467 -1.921 1.00 . A A . 36 ARG O 1 1
1 583 1 1 37 LEU C C 16.537 -0.724 -4.592 1.00 . A A . 37 LEU C 1 1
1 584 1 1 37 LEU CA C 15.345 -0.709 -3.663 1.00 . A A . 37 LEU CA 1 1
1 585 1 1 37 LEU CB C 14.128 -0.001 -4.327 1.00 . A A . 37 LEU CB 1 1
1 586 1 1 37 LEU CD1 C 13.069 1.497 -6.132 1.00 . A A . 37 LEU CD1 1 1
1 587 1 1 37 LEU CD2 C 15.474 1.814 -5.483 1.00 . A A . 37 LEU CD2 1 1
1 588 1 1 37 LEU CG C 14.346 0.785 -5.647 1.00 . A A . 37 LEU CG 1 1
1 589 1 1 37 LEU H H 15.071 0.687 -1.981 1.00 . A A . 37 LEU H 1 1
1 590 1 1 37 LEU HA H 15.094 -1.768 -3.470 1.00 . A A . 37 LEU HA 1 1
1 591 1 1 37 LEU HB2 H 13.333 -0.759 -4.507 1.00 . A A . 37 LEU HB2 1 1
1 592 1 1 37 LEU HB3 H 13.677 0.690 -3.583 1.00 . A A . 37 LEU HB3 1 1
1 593 1 1 37 LEU HD11 H 12.205 0.805 -6.137 1.00 . A A . 37 LEU HD11 1 1
1 594 1 1 37 LEU HD12 H 12.785 2.334 -5.469 1.00 . A A . 37 LEU HD12 1 1
1 595 1 1 37 LEU HD13 H 13.175 1.898 -7.156 1.00 . A A . 37 LEU HD13 1 1
1 596 1 1 37 LEU HD21 H 16.400 1.348 -5.094 1.00 . A A . 37 LEU HD21 1 1
1 597 1 1 37 LEU HD22 H 15.735 2.309 -6.437 1.00 . A A . 37 LEU HD22 1 1
1 598 1 1 37 LEU HD23 H 15.200 2.611 -4.767 1.00 . A A . 37 LEU HD23 1 1
1 599 1 1 37 LEU HG H 14.656 0.064 -6.432 1.00 . A A . 37 LEU HG 1 1
1 600 1 1 37 LEU N N 15.669 -0.074 -2.388 1.00 . A A . 37 LEU N 1 1
1 601 1 1 37 LEU O O 16.638 -1.563 -5.499 1.00 . A A . 37 LEU O 1 1
1 602 1 1 38 GLU C C 19.576 -0.955 -4.819 1.00 . A A . 38 GLU C 1 1
1 603 1 1 38 GLU CA C 18.702 0.228 -5.164 1.00 . A A . 38 GLU CA 1 1
1 604 1 1 38 GLU CB C 19.434 1.571 -4.878 1.00 . A A . 38 GLU CB 1 1
1 605 1 1 38 GLU CD C 21.236 3.303 -5.780 1.00 . A A . 38 GLU CD 1 1
1 606 1 1 38 GLU CG C 20.142 2.276 -6.081 1.00 . A A . 38 GLU CG 1 1
1 607 1 1 38 GLU H H 17.226 0.942 -3.694 1.00 . A A . 38 GLU H 1 1
1 608 1 1 38 GLU HA H 18.460 0.165 -6.240 1.00 . A A . 38 GLU HA 1 1
1 609 1 1 38 GLU HB2 H 18.710 2.282 -4.433 1.00 . A A . 38 GLU HB2 1 1
1 610 1 1 38 GLU HB3 H 20.174 1.399 -4.073 1.00 . A A . 38 GLU HB3 1 1
1 611 1 1 38 GLU HG2 H 20.594 1.515 -6.744 1.00 . A A . 38 GLU HG2 1 1
1 612 1 1 38 GLU HG3 H 19.395 2.783 -6.720 1.00 . A A . 38 GLU HG3 1 1
1 613 1 1 38 GLU N N 17.460 0.200 -4.397 1.00 . A A . 38 GLU N 1 1
1 614 1 1 38 GLU O O 20.145 -1.620 -5.693 1.00 . A A . 38 GLU O 1 1
1 615 1 1 38 GLU OE1 O 22.237 3.038 -5.127 1.00 . A A . 38 GLU OE1 1 1
1 616 1 1 38 GLU OE2 O 20.991 4.536 -6.305 1.00 . A A . 38 GLU OE2 1 1
1 617 1 1 39 ALA C C 20.095 -3.633 -3.697 1.00 . A A . 39 ALA C 1 1
1 618 1 1 39 ALA CA C 20.538 -2.335 -3.062 1.00 . A A . 39 ALA CA 1 1
1 619 1 1 39 ALA CB C 20.453 -2.366 -1.526 1.00 . A A . 39 ALA CB 1 1
1 620 1 1 39 ALA H H 19.246 -0.558 -2.872 1.00 . A A . 39 ALA H 1 1
1 621 1 1 39 ALA HA H 21.586 -2.160 -3.370 1.00 . A A . 39 ALA HA 1 1
1 622 1 1 39 ALA HB1 H 20.816 -1.421 -1.077 1.00 . A A . 39 ALA HB1 1 1
1 623 1 1 39 ALA HB2 H 19.415 -2.514 -1.171 1.00 . A A . 39 ALA HB2 1 1
1 624 1 1 39 ALA HB3 H 21.065 -3.178 -1.096 1.00 . A A . 39 ALA HB3 1 1
1 625 1 1 39 ALA N N 19.722 -1.219 -3.533 1.00 . A A . 39 ALA N 1 1
1 626 1 1 39 ALA O O 20.906 -4.515 -4.008 1.00 . A A . 39 ALA O 1 1
1 627 1 1 40 LEU C C 18.580 -5.348 -5.747 1.00 . A A . 40 LEU C 1 1
1 628 1 1 40 LEU CA C 18.216 -5.053 -4.311 1.00 . A A . 40 LEU CA 1 1
1 629 1 1 40 LEU CB C 16.671 -5.037 -4.121 1.00 . A A . 40 LEU CB 1 1
1 630 1 1 40 LEU CD1 C 15.887 -6.393 -2.131 1.00 . A A . 40 LEU CD1 1 1
1 631 1 1 40 LEU CD2 C 14.575 -6.523 -4.269 1.00 . A A . 40 LEU CD2 1 1
1 632 1 1 40 LEU CG C 15.978 -6.349 -3.663 1.00 . A A . 40 LEU CG 1 1
1 633 1 1 40 LEU H H 18.205 -2.934 -3.714 1.00 . A A . 40 LEU H 1 1
1 634 1 1 40 LEU HA H 18.650 -5.870 -3.708 1.00 . A A . 40 LEU HA 1 1
1 635 1 1 40 LEU HB2 H 16.413 -4.236 -3.401 1.00 . A A . 40 LEU HB2 1 1
1 636 1 1 40 LEU HB3 H 16.206 -4.718 -5.075 1.00 . A A . 40 LEU HB3 1 1
1 637 1 1 40 LEU HD11 H 16.885 -6.313 -1.657 1.00 . A A . 40 LEU HD11 1 1
1 638 1 1 40 LEU HD12 H 15.267 -5.572 -1.723 1.00 . A A . 40 LEU HD12 1 1
1 639 1 1 40 LEU HD13 H 15.445 -7.342 -1.776 1.00 . A A . 40 LEU HD13 1 1
1 640 1 1 40 LEU HD21 H 13.913 -5.666 -4.047 1.00 . A A . 40 LEU HD21 1 1
1 641 1 1 40 LEU HD22 H 14.625 -6.623 -5.370 1.00 . A A . 40 LEU HD22 1 1
1 642 1 1 40 LEU HD23 H 14.076 -7.438 -3.901 1.00 . A A . 40 LEU HD23 1 1
1 643 1 1 40 LEU HG H 16.606 -7.204 -3.991 1.00 . A A . 40 LEU HG 1 1
1 644 1 1 40 LEU N N 18.796 -3.787 -3.872 1.00 . A A . 40 LEU N 1 1
1 645 1 1 40 LEU O O 18.907 -6.483 -6.115 1.00 . A A . 40 LEU O 1 1
1 646 1 1 41 LYS C C 20.028 -4.115 -8.494 1.00 . A A . 41 LYS C 1 1
1 647 1 1 41 LYS CA C 18.648 -4.522 -8.034 1.00 . A A . 41 LYS CA 1 1
1 648 1 1 41 LYS CB C 17.552 -3.706 -8.774 1.00 . A A . 41 LYS CB 1 1
1 649 1 1 41 LYS CD C 15.820 -4.888 -10.304 1.00 . A A . 41 LYS CD 1 1
1 650 1 1 41 LYS CE C 15.950 -3.690 -11.254 1.00 . A A . 41 LYS CE 1 1
1 651 1 1 41 LYS CG C 16.199 -4.452 -8.886 1.00 . A A . 41 LYS CG 1 1
1 652 1 1 41 LYS H H 18.371 -3.388 -6.165 1.00 . A A . 41 LYS H 1 1
1 653 1 1 41 LYS HA H 18.526 -5.597 -8.262 1.00 . A A . 41 LYS HA 1 1
1 654 1 1 41 LYS HB2 H 17.404 -2.732 -8.263 1.00 . A A . 41 LYS HB2 1 1
1 655 1 1 41 LYS HB3 H 17.906 -3.443 -9.790 1.00 . A A . 41 LYS HB3 1 1
1 656 1 1 41 LYS HD2 H 16.466 -5.729 -10.623 1.00 . A A . 41 LYS HD2 1 1
1 657 1 1 41 LYS HD3 H 14.779 -5.272 -10.313 1.00 . A A . 41 LYS HD3 1 1
1 658 1 1 41 LYS HE2 H 16.046 -2.746 -10.677 1.00 . A A . 41 LYS HE2 1 1
1 659 1 1 41 LYS HE3 H 16.872 -3.763 -11.867 1.00 . A A . 41 LYS HE3 1 1
1 660 1 1 41 LYS HG2 H 16.218 -5.373 -8.272 1.00 . A A . 41 LYS HG2 1 1
1 661 1 1 41 LYS HG3 H 15.393 -3.826 -8.455 1.00 . A A . 41 LYS HG3 1 1
1 662 1 1 41 LYS HZ1 H 14.003 -4.176 -11.719 1.00 . A A . 41 LYS HZ1 1 1
1 663 1 1 41 LYS HZ2 H 14.477 -2.655 -12.257 1.00 . A A . 41 LYS HZ2 1 1
1 664 1 1 41 LYS HZ3 H 15.013 -4.034 -13.056 1.00 . A A . 41 LYS HZ3 1 1
1 665 1 1 41 LYS N N 18.500 -4.337 -6.593 1.00 . A A . 41 LYS N 1 1
1 666 1 1 41 LYS NZ N 14.772 -3.635 -12.138 1.00 . A A . 41 LYS NZ 1 1
1 667 1 1 41 LYS O O 20.949 -4.935 -8.595 1.00 . A A . 41 LYS O 1 1
1 668 1 1 42 GLU C C 21.432 -0.844 -9.497 1.00 . A A . 42 GLU C 1 1
1 669 1 1 42 GLU CA C 21.414 -2.354 -9.438 1.00 . A A . 42 GLU CA 1 1
1 670 1 1 42 GLU CB C 21.520 -2.974 -10.859 1.00 . A A . 42 GLU CB 1 1
1 671 1 1 42 GLU CD C 21.315 -2.026 -13.334 1.00 . A A . 42 GLU CD 1 1
1 672 1 1 42 GLU CG C 20.651 -2.330 -11.989 1.00 . A A . 42 GLU CG 1 1
1 673 1 1 42 GLU H H 19.404 -2.200 -8.544 1.00 . A A . 42 GLU H 1 1
1 674 1 1 42 GLU HA H 22.277 -2.676 -8.826 1.00 . A A . 42 GLU HA 1 1
1 675 1 1 42 GLU HB2 H 22.580 -2.951 -11.179 1.00 . A A . 42 GLU HB2 1 1
1 676 1 1 42 GLU HB3 H 21.282 -4.054 -10.794 1.00 . A A . 42 GLU HB3 1 1
1 677 1 1 42 GLU HG2 H 19.780 -2.978 -12.204 1.00 . A A . 42 GLU HG2 1 1
1 678 1 1 42 GLU HG3 H 20.203 -1.384 -11.633 1.00 . A A . 42 GLU HG3 1 1
1 679 1 1 42 GLU N N 20.189 -2.843 -8.811 1.00 . A A . 42 GLU N 1 1
1 680 1 1 42 GLU O O 20.799 -0.152 -8.692 1.00 . A A . 42 GLU O 1 1
1 681 1 1 42 GLU OE1 O 22.095 -0.910 -13.320 1.00 . A A . 42 GLU OE1 1 1
1 682 1 1 42 GLU OE2 O 21.159 -2.724 -14.327 1.00 . A A . 42 GLU OE2 1 1
1 683 1 1 43 ASN C C 22.664 1.908 -9.509 1.00 . A A . 43 ASN C 1 1
1 684 1 1 43 ASN CA C 22.173 1.130 -10.707 1.00 . A A . 43 ASN CA 1 1
1 685 1 1 43 ASN CB C 20.731 1.569 -11.096 1.00 . A A . 43 ASN CB 1 1
1 686 1 1 43 ASN CG C 20.414 3.066 -11.007 1.00 . A A . 43 ASN CG 1 1
1 687 1 1 43 ASN H H 22.830 -0.966 -10.941 1.00 . A A . 43 ASN H 1 1
1 688 1 1 43 ASN HA H 22.868 1.342 -11.540 1.00 . A A . 43 ASN HA 1 1
1 689 1 1 43 ASN HB2 H 20.521 1.262 -12.139 1.00 . A A . 43 ASN HB2 1 1
1 690 1 1 43 ASN HB3 H 19.984 1.020 -10.494 1.00 . A A . 43 ASN HB3 1 1
1 691 1 1 43 ASN HD21 H 19.337 2.801 -9.355 1.00 . A A . 43 ASN HD21 1 1
1 692 1 1 43 ASN HD22 H 19.485 4.495 -10.074 1.00 . A A . 43 ASN HD22 1 1
1 693 1 1 43 ASN N N 22.188 -0.306 -10.438 1.00 . A A . 43 ASN N 1 1
1 694 1 1 43 ASN ND2 N 19.710 3.500 -9.997 1.00 . A A . 43 ASN ND2 1 1
1 695 1 1 43 ASN O O 21.890 2.321 -8.637 1.00 . A A . 43 ASN O 1 1
1 696 1 1 43 ASN OD1 O 20.797 3.866 -11.847 1.00 . A A . 43 ASN OD1 1 1
1 697 1 1 44 GLY C C 25.920 2.170 -7.988 1.00 . A A . 44 GLY C 1 1
1 698 1 1 44 GLY CA C 24.586 2.800 -8.313 1.00 . A A . 44 GLY CA 1 1
1 699 1 1 44 GLY H H 24.522 1.814 -10.281 1.00 . A A . 44 GLY H 1 1
1 700 1 1 44 GLY HA2 H 24.733 3.874 -8.524 1.00 . A A . 44 GLY HA2 1 1
1 701 1 1 44 GLY HA3 H 23.927 2.733 -7.428 1.00 . A A . 44 GLY HA3 1 1
1 702 1 1 44 GLY N N 23.962 2.141 -9.457 1.00 . A A . 44 GLY N 1 1
1 703 1 1 44 GLY O O 26.125 1.596 -6.912 1.00 . A A . 44 GLY O 1 1
1 704 1 1 45 GLY C C 28.408 0.383 -9.009 1.00 . A A . 45 GLY C 1 1
1 705 1 1 45 GLY CA C 28.231 1.846 -8.675 1.00 . A A . 45 GLY CA 1 1
1 706 1 1 45 GLY H H 26.551 2.674 -9.833 1.00 . A A . 45 GLY H 1 1
1 707 1 1 45 GLY HA2 H 28.929 2.445 -9.288 1.00 . A A . 45 GLY HA2 1 1
1 708 1 1 45 GLY HA3 H 28.505 2.013 -7.618 1.00 . A A . 45 GLY HA3 1 1
1 709 1 1 45 GLY N N 26.855 2.273 -8.913 1.00 . A A . 45 GLY N 1 1
1 710 1 1 45 GLY O O 29.169 -0.346 -8.362 1.00 . A A . 45 GLY O 1 1
1 711 1 1 46 ALA C C 27.315 -2.335 -9.234 1.00 . A A . 46 ALA C 1 1
1 712 1 1 46 ALA CA C 27.717 -1.479 -10.411 1.00 . A A . 46 ALA CA 1 1
1 713 1 1 46 ALA CB C 29.113 -1.831 -10.956 1.00 . A A . 46 ALA CB 1 1
1 714 1 1 46 ALA H H 27.238 0.663 -10.623 1.00 . A A . 46 ALA H 1 1
1 715 1 1 46 ALA HA H 26.962 -1.637 -11.204 1.00 . A A . 46 ALA HA 1 1
1 716 1 1 46 ALA HB1 H 29.375 -1.220 -11.841 1.00 . A A . 46 ALA HB1 1 1
1 717 1 1 46 ALA HB2 H 29.908 -1.667 -10.203 1.00 . A A . 46 ALA HB2 1 1
1 718 1 1 46 ALA HB3 H 29.177 -2.889 -11.271 1.00 . A A . 46 ALA HB3 1 1
1 719 1 1 46 ALA N N 27.728 -0.064 -10.049 1.00 . A A . 46 ALA N 1 1
1 720 1 1 46 ALA O O 28.154 -3.050 -8.604 1.00 . A A . 46 ALA O 1 1
1 721 1 1 46 ALA OXT O 26.086 -2.301 -8.915 1.00 . A A . 46 ALA OXT 1 1
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