NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
394654 |
1rg3   |
6040 | cing | 4-filtered-FRED | STAR | entry | full | 221 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1rg3
# This FRED archive file contains, for PDB entry <1rg3>:
#
# - 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_1rg3
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1rg3
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 1847.34
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 $Pulmonary_surfactant_associated_protein_B A . 1 1
stop_
save_
save_Pulmonary_surfactant_associated_protein_B
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Pulmonary surfactant associated protein B"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code GRMLPQLVCRLVLRCS
_Entity.Number_of_monomers 16
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 GLY . 1 1
2 ARG . 1 1
3 MET . 1 1
4 LEU . 1 1
5 PRO . 1 1
6 GLN . 1 1
7 LEU . 1 1
8 VAL . 1 1
9 CYS . 1 1
10 ARG . 1 1
11 LEU . 1 1
12 VAL . 1 1
13 LEU . 1 1
14 ARG . 1 1
15 CYS . 1 1
16 SER . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
GLY 1 1 1 1
ARG 2 2 1 1
MET 3 3 1 1
LEU 4 4 1 1
PRO 5 5 1 1
GLN 6 6 1 1
LEU 7 7 1 1
VAL 8 8 1 1
CYS 9 9 1 1
ARG 10 10 1 1
LEU 11 11 1 1
VAL 12 12 1 1
LEU 13 13 1 1
ARG 14 14 1 1
CYS 15 15 1 1
SER 16 16 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 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 GLY QA . 1 . HA# 1 1
1 1 2 1 1 2 ARG H . 2 . HN 1 1
2 1 1 1 1 1 GLY QA . 1 . HA# 1 1
2 1 2 1 1 2 ARG HA . 2 . HA 1 1
3 1 1 1 1 1 GLY QA . 1 . HA# 1 1
3 1 2 1 1 2 ARG QD . 2 . HD# 1 1
4 1 1 1 1 1 GLY QA . 1 . HA# 1 1
4 1 2 1 1 2 ARG QG . 2 . HG# 1 1
5 1 1 1 1 1 GLY QA . 1 . HA# 1 1
5 1 2 1 1 2 ARG QB . 2 . HB# 1 1
6 1 1 1 1 2 ARG HA . 2 . HA 1 1
6 1 2 1 1 3 MET H . 3 . HN 1 1
7 1 1 1 1 2 ARG QD . 2 . HD# 1 1
7 1 2 1 1 3 MET H . 3 . HN 1 1
8 1 1 1 1 2 ARG HE . 2 . HE 1 1
8 1 2 1 1 3 MET H . 3 . HN 1 1
9 1 1 1 1 2 ARG HA . 2 . HA 1 1
9 1 2 1 1 3 MET QG . 3 . HG# 1 1
10 1 1 1 1 2 ARG HA . 2 . HA 1 1
10 1 2 1 1 3 MET HA . 3 . HA 1 1
11 1 1 1 1 3 MET QG . 3 . HG# 1 1
11 1 2 1 1 4 LEU H . 4 . HN 1 1
12 1 1 1 1 3 MET HA . 3 . HA 1 1
12 1 2 1 1 4 LEU H . 4 . HN 1 1
13 1 1 1 1 3 MET QB . 3 . HB# 1 1
13 1 2 1 1 4 LEU HA . 4 . HA 1 1
14 1 1 1 1 3 MET QG . 3 . HG# 1 1
14 1 2 1 1 4 LEU HA . 4 . HA 1 1
15 1 1 1 1 3 MET H . 3 . HN 1 1
15 1 2 1 1 4 LEU HB2 . 4 . HB2 1 1
16 1 1 1 1 4 LEU HA . 4 . HA 1 1
16 1 2 1 1 5 PRO HD3 . 5 . HD1 1 1
17 1 1 1 1 4 LEU H . 4 . HN 1 1
17 1 2 1 1 5 PRO HD3 . 5 . HD1 1 1
18 1 1 1 1 4 LEU HA . 4 . HA 1 1
18 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
19 1 1 1 1 4 LEU H . 4 . HN 1 1
19 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
20 1 1 1 1 4 LEU HA . 4 . HA 1 1
20 1 2 1 1 5 PRO QG . 5 . HG# 1 1
21 1 1 1 1 4 LEU H . 4 . HN 1 1
21 1 2 1 1 5 PRO QG . 5 . HG# 1 1
22 1 1 1 1 4 LEU MD2 . 4 . HD2# 1 1
22 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
23 1 1 1 1 5 PRO HD3 . 5 . HD1 1 1
23 1 2 1 1 6 GLN H . 6 . HN 1 1
24 1 1 1 1 5 PRO QG . 5 . HG# 1 1
24 1 2 1 1 6 GLN H . 6 . HN 1 1
25 1 1 1 1 5 PRO HD2 . 5 . HD2 1 1
25 1 2 1 1 6 GLN H . 6 . HN 1 1
26 1 1 1 1 6 GLN H . 6 . HN 1 1
26 1 2 1 1 7 LEU H . 7 . HN 1 1
27 1 1 1 1 6 GLN QG . 6 . HG# 1 1
27 1 2 1 1 7 LEU H . 7 . HN 1 1
28 1 1 1 1 6 GLN QB . 6 . HB# 1 1
28 1 2 1 1 7 LEU H . 7 . HN 1 1
29 1 1 1 1 7 LEU QD . 7 . HD## 1 1
29 1 2 1 1 8 VAL HA . 8 . HA 1 1
30 1 1 1 1 7 LEU HA . 7 . HA 1 1
30 1 2 1 1 8 VAL H . 8 . HN 1 1
31 1 1 1 1 8 VAL H . 8 . HN 1 1
31 1 2 1 1 9 CYS H . 9 . HN 1 1
32 1 1 1 1 8 VAL HA . 8 . HA 1 1
32 1 2 1 1 9 CYS QB . 9 . HB# 1 1
33 1 1 1 1 8 VAL HA . 8 . HA 1 1
33 1 2 1 1 9 CYS H . 9 . HN 1 1
34 1 1 1 1 8 VAL QG . 8 . HG## 1 1
34 1 2 1 1 9 CYS QB . 9 . HB# 1 1
35 1 1 1 1 8 VAL QG . 8 . HG## 1 1
35 1 2 1 1 9 CYS H . 9 . HN 1 1
36 1 1 1 1 8 VAL HB . 8 . HB 1 1
36 1 2 1 1 9 CYS H . 9 . HN 1 1
37 1 1 1 1 8 VAL H . 8 . HN 1 1
37 1 2 1 1 9 CYS QB . 9 . HB# 1 1
38 1 1 1 1 9 CYS H . 9 . HN 1 1
38 1 2 1 1 10 ARG H . 10 . HN 1 1
39 1 1 1 1 9 CYS QB . 9 . HB# 1 1
39 1 2 1 1 10 ARG QG . 10 . HG# 1 1
40 1 1 1 1 9 CYS QB . 9 . HB# 1 1
40 1 2 1 1 10 ARG H . 10 . HN 1 1
41 1 1 1 1 9 CYS QB . 9 . HB# 1 1
41 1 2 1 1 10 ARG QB . 10 . HB# 1 1
42 1 1 1 1 10 ARG H . 10 . HN 1 1
42 1 2 1 1 11 LEU H . 11 . HN 1 1
43 1 1 1 1 10 ARG QD . 10 . HD# 1 1
43 1 2 1 1 11 LEU H . 11 . HN 1 1
44 1 1 1 1 10 ARG QB . 10 . HB# 1 1
44 1 2 1 1 11 LEU H . 11 . HN 1 1
45 1 1 1 1 10 ARG HE . 10 . HE 1 1
45 1 2 1 1 11 LEU H . 11 . HN 1 1
46 1 1 1 1 10 ARG HA . 10 . HA 1 1
46 1 2 1 1 11 LEU H . 11 . HN 1 1
47 1 1 1 1 11 LEU H . 11 . HN 1 1
47 1 2 1 1 12 VAL HA . 12 . HA 1 1
48 1 1 1 1 11 LEU H . 11 . HN 1 1
48 1 2 1 1 12 VAL H . 12 . HN 1 1
49 1 1 1 1 11 LEU HA . 11 . HA 1 1
49 1 2 1 1 12 VAL HA . 12 . HA 1 1
50 1 1 1 1 11 LEU HA . 11 . HA 1 1
50 1 2 1 1 12 VAL H . 12 . HN 1 1
51 1 1 1 1 11 LEU H . 11 . HN 1 1
51 1 2 1 1 12 VAL QG . 12 . HG## 1 1
52 1 1 1 1 11 LEU QB . 11 . HB# 1 1
52 1 2 1 1 12 VAL H . 12 . HN 1 1
53 1 1 1 1 12 VAL H . 12 . HN 1 1
53 1 2 1 1 13 LEU HA . 13 . HA 1 1
54 1 1 1 1 12 VAL HA . 12 . HA 1 1
54 1 2 1 1 13 LEU H . 13 . HN 1 1
55 1 1 1 1 12 VAL H . 12 . HN 1 1
55 1 2 1 1 13 LEU H . 13 . HN 1 1
56 1 1 1 1 12 VAL HA . 12 . HA 1 1
56 1 2 1 1 13 LEU HA . 13 . HA 1 1
57 1 1 1 1 12 VAL HB . 12 . HB 1 1
57 1 2 1 1 13 LEU H . 13 . HN 1 1
58 1 1 1 1 12 VAL QG . 12 . HG## 1 1
58 1 2 1 1 13 LEU HA . 13 . HA 1 1
59 1 1 1 1 14 ARG HA . 14 . HA 1 1
59 1 2 1 1 15 CYS H . 15 . HN 1 1
60 1 1 1 1 14 ARG H . 14 . HN 1 1
60 1 2 1 1 15 CYS H . 15 . HN 1 1
61 1 1 1 1 14 ARG QD . 14 . HD# 1 1
61 1 2 1 1 15 CYS HA . 15 . HA 1 1
62 1 1 1 1 15 CYS H . 15 . HN 1 1
62 1 2 1 1 16 SER H . 16 . HN 1 1
63 1 1 1 1 15 CYS HA . 15 . HA 1 1
63 1 2 1 1 16 SER H . 16 . HN 1 1
64 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1
64 1 2 1 1 16 SER H . 16 . HN 1 1
65 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1
65 1 2 1 1 16 SER H . 16 . HN 1 1
66 1 1 1 1 15 CYS H . 15 . HN 1 1
66 1 2 1 1 16 SER QB . 16 . HB# 1 1
67 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1
67 1 2 1 1 16 SER QB . 16 . HB# 1 1
68 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1
68 1 2 1 1 16 SER QB . 16 . HB# 1 1
69 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1
69 1 2 1 1 16 SER HA . 16 . HA 1 1
70 1 1 1 1 1 GLY QA . 1 . HA# 1 1
70 1 2 1 1 3 MET QG . 3 . HG# 1 1
71 1 1 1 1 1 GLY QA . 1 . HA# 1 1
71 1 2 1 1 3 MET QB . 3 . HB# 1 1
72 1 1 1 1 1 GLY QA . 1 . HA# 1 1
72 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
73 1 1 1 1 2 ARG QD . 2 . HD# 1 1
73 1 2 1 1 5 PRO QB . 5 . HB# 1 1
74 1 1 1 1 2 ARG HA . 2 . HA 1 1
74 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
75 1 1 1 1 2 ARG HA . 2 . HA 1 1
75 1 2 1 1 5 PRO HD3 . 5 . HD1 1 1
76 1 1 1 1 2 ARG HE . 2 . HE 1 1
76 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
77 1 1 1 1 3 MET QG . 3 . HG# 1 1
77 1 2 1 1 6 GLN QB . 6 . HB# 1 1
78 1 1 1 1 3 MET HA . 3 . HA 1 1
78 1 2 1 1 5 PRO HD3 . 5 . HD1 1 1
79 1 1 1 1 3 MET H . 3 . HN 1 1
79 1 2 1 1 5 PRO HD3 . 5 . HD1 1 1
80 1 1 1 1 3 MET H . 3 . HN 1 1
80 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
81 1 1 1 1 3 MET HA . 3 . HA 1 1
81 1 2 1 1 5 PRO HD2 . 5 . HD2 1 1
82 1 1 1 1 3 MET HA . 3 . HA 1 1
82 1 2 1 1 6 GLN H . 6 . HN 1 1
83 1 1 1 1 3 MET HA . 3 . HA 1 1
83 1 2 1 1 6 GLN QB . 6 . HB# 1 1
84 1 1 1 1 3 MET HA . 3 . HA 1 1
84 1 2 1 1 6 GLN QG . 6 . HG# 1 1
85 1 1 1 1 3 MET HA . 3 . HA 1 1
85 1 2 1 1 7 LEU H . 7 . HN 1 1
86 1 1 1 1 4 LEU HA . 4 . HA 1 1
86 1 2 1 1 7 LEU HA . 7 . HA 1 1
87 1 1 1 1 4 LEU HA . 4 . HA 1 1
87 1 2 1 1 7 LEU H . 7 . HN 1 1
88 1 1 1 1 4 LEU HA . 4 . HA 1 1
88 1 2 1 1 6 GLN QB . 6 . HB# 1 1
89 1 1 1 1 4 LEU H . 4 . HN 1 1
89 1 2 1 1 7 LEU HA . 7 . HA 1 1
90 1 1 1 1 4 LEU HA . 4 . HA 1 1
90 1 2 1 1 8 VAL QG . 8 . HG## 1 1
91 1 1 1 1 6 GLN QG . 6 . HG# 1 1
91 1 2 1 1 9 CYS QB . 9 . HB# 1 1
92 1 1 1 1 6 GLN H . 6 . HN 1 1
92 1 2 1 1 9 CYS QB . 9 . HB# 1 1
93 1 1 1 1 6 GLN QB . 6 . HB# 1 1
93 1 2 1 1 9 CYS H . 9 . HN 1 1
94 1 1 1 1 6 GLN QG . 6 . HG# 1 1
94 1 2 1 1 9 CYS H . 9 . HN 1 1
95 1 1 1 1 6 GLN H . 6 . HN 1 1
95 1 2 1 1 8 VAL QG . 8 . HG## 1 1
96 1 1 1 1 6 GLN QB . 6 . HB# 1 1
96 1 2 1 1 10 ARG QD . 10 . HD# 1 1
97 1 1 1 1 6 GLN QG . 6 . HG# 1 1
97 1 2 1 1 10 ARG H . 10 . HN 1 1
98 1 1 1 1 6 GLN QG . 6 . HG# 1 1
98 1 2 1 1 10 ARG QD . 10 . HD# 1 1
99 1 1 1 1 6 GLN QG . 6 . HG# 1 1
99 1 2 1 1 10 ARG HE . 10 . HE 1 1
100 1 1 1 1 7 LEU H . 7 . HN 1 1
100 1 2 1 1 10 ARG H . 10 . HN 1 1
101 1 1 1 1 7 LEU H . 7 . HN 1 1
101 1 2 1 1 9 CYS QB . 9 . HB# 1 1
102 1 1 1 1 7 LEU H . 7 . HN 1 1
102 1 2 1 1 9 CYS H . 9 . HN 1 1
103 1 1 1 1 7 LEU H . 7 . HN 1 1
103 1 2 1 1 10 ARG QB . 10 . HB# 1 1
104 1 1 1 1 7 LEU H . 7 . HN 1 1
104 1 2 1 1 10 ARG QD . 10 . HD# 1 1
105 1 1 1 1 8 VAL HA . 8 . HA 1 1
105 1 2 1 1 11 LEU H . 11 . HN 1 1
106 1 1 1 1 8 VAL H . 8 . HN 1 1
106 1 2 1 1 10 ARG H . 10 . HN 1 1
107 1 1 1 1 8 VAL HA . 8 . HA 1 1
107 1 2 1 1 12 VAL H . 12 . HN 1 1
108 1 1 1 1 9 CYS HA . 9 . HA 1 1
108 1 2 1 1 12 VAL H . 12 . HN 1 1
109 1 1 1 1 9 CYS QB . 9 . HB# 1 1
109 1 2 1 1 12 VAL H . 12 . HN 1 1
110 1 1 1 1 10 ARG QG . 10 . HG# 1 1
110 1 2 1 1 13 LEU HA . 13 . HA 1 1
111 1 1 1 1 10 ARG QG . 10 . HG# 1 1
111 1 2 1 1 12 VAL HA . 12 . HA 1 1
112 1 1 1 1 11 LEU H . 11 . HN 1 1
112 1 2 1 1 14 ARG HA . 14 . HA 1 1
113 1 1 1 1 11 LEU QD . 11 . HD## 1 1
113 1 2 1 1 16 SER H . 16 . HN 1 1
114 1 1 1 1 11 LEU H . 11 . HN 1 1
114 1 2 1 1 13 LEU H . 13 . HN 1 1
115 1 1 1 1 11 LEU HA . 11 . HA 1 1
115 1 2 1 1 14 ARG QB . 14 . HB# 1 1
116 1 1 1 1 11 LEU HA . 11 . HA 1 1
116 1 2 1 1 14 ARG QD . 14 . HD# 1 1
117 1 1 1 1 12 VAL HA . 12 . HA 1 1
117 1 2 1 1 16 SER H . 16 . HN 1 1
118 1 1 1 1 12 VAL QG . 12 . HG## 1 1
118 1 2 1 1 16 SER QB . 16 . HB# 1 1
119 1 1 1 1 12 VAL H . 12 . HN 1 1
119 1 2 1 1 14 ARG H . 14 . HN 1 1
120 1 1 1 1 12 VAL QG . 12 . HG## 1 1
120 1 2 1 1 16 SER H . 16 . HN 1 1
121 1 1 1 1 12 VAL HA . 12 . HA 1 1
121 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1
122 1 1 1 1 12 VAL HA . 12 . HA 1 1
122 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1
123 1 1 1 1 13 LEU QB . 13 . HB# 1 1
123 1 2 1 1 16 SER HA . 16 . HA 1 1
124 1 1 1 1 13 LEU HA . 13 . HA 1 1
124 1 2 1 1 16 SER H . 16 . HN 1 1
125 1 1 1 1 13 LEU HA . 13 . HA 1 1
125 1 2 1 1 16 SER QB . 16 . HB# 1 1
126 1 1 1 1 13 LEU QB . 13 . HB# 1 1
126 1 2 1 1 16 SER H . 16 . HN 1 1
127 1 1 1 1 14 ARG H . 14 . HN 1 1
127 1 2 1 1 16 SER H . 16 . HN 1 1
128 1 1 1 1 14 ARG QB . 14 . HB# 1 1
128 1 2 1 1 16 SER H . 16 . HN 1 1
129 1 1 1 1 14 ARG QG . 14 . HG# 1 1
129 1 2 1 1 16 SER H . 16 . HN 1 1
130 1 1 1 1 14 ARG HA . 14 . HA 1 1
130 1 2 1 1 16 SER H . 16 . 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 . . . . . 2.8 1.8 3.8 1 1
2 1 . . . . . 3.4 1.8 4.4 1 1
3 1 . . . . . 5.0 1.8 7.0 1 1
4 1 . . . . . 5.0 1.8 7.0 1 1
5 1 . . . . . 3.4 1.8 5.4 1 1
6 1 . . . . . 2.8 1.8 2.8 1 1
7 1 . . . . . 5.0 1.8 6.0 1 1
8 1 . . . . . 5.0 1.8 5.0 1 1
9 1 . . . . . 5.0 1.8 6.0 1 1
10 1 . . . . . 5.0 1.8 5.0 1 1
11 1 . . . . . 5.0 1.8 6.0 1 1
12 1 . . . . . 5.0 1.8 5.0 1 1
13 1 . . . . . 5.0 1.8 6.0 1 1
14 1 . . . . . 5.0 1.8 6.0 1 1
15 1 . . . . . 5.0 1.8 5.0 1 1
16 1 . . . . . 3.4 1.8 3.4 1 1
17 1 . . . . . 2.8 1.8 2.8 1 1
18 1 . . . . . 5.0 1.8 5.0 1 1
19 1 . . . . . 2.8 1.8 2.8 1 1
20 1 . . . . . 3.4 1.8 4.4 1 1
21 1 . . . . . 3.4 1.8 4.4 1 1
22 1 . . . . . 5.0 1.8 6.0 1 1
23 1 . . . . . 5.0 1.8 5.0 1 1
24 1 . . . . . 2.8 1.8 3.8 1 1
25 1 . . . . . 5.0 1.8 5.0 1 1
26 1 . . . . . 2.8 1.8 2.8 1 1
27 1 . . . . . 5.0 1.8 6.0 1 1
28 1 . . . . . 3.4 1.8 4.4 1 1
29 1 . . . . . 5.0 1.8 8.0 1 1
30 1 . . . . . 3.4 1.8 3.4 1 1
31 1 . . . . . 2.8 1.8 2.8 1 1
32 1 . . . . . 5.0 1.8 6.0 1 1
33 1 . . . . . 3.4 1.8 3.4 1 1
34 1 . . . . . 5.0 1.8 9.0 1 1
35 1 . . . . . 2.8 1.8 5.8 1 1
36 1 . . . . . 3.4 1.8 3.4 1 1
37 1 . . . . . 5.0 1.8 6.0 1 1
38 1 . . . . . 2.8 1.8 2.8 1 1
39 1 . . . . . 5.0 1.8 7.0 1 1
40 1 . . . . . 2.8 1.8 3.8 1 1
41 1 . . . . . 5.0 1.8 7.0 1 1
42 1 . . . . . 2.8 1.8 2.8 1 1
43 1 . . . . . 5.0 1.8 6.0 1 1
44 1 . . . . . 2.8 1.8 3.8 1 1
45 1 . . . . . 5.0 1.8 5.0 1 1
46 1 . . . . . 3.4 1.8 3.4 1 1
47 1 . . . . . 5.0 1.8 5.0 1 1
48 1 . . . . . 2.8 1.8 2.8 1 1
49 1 . . . . . 5.0 1.8 5.0 1 1
50 1 . . . . . 3.4 1.8 3.4 1 1
51 1 . . . . . 5.0 1.8 8.0 1 1
52 1 . . . . . 3.4 1.8 4.4 1 1
53 1 . . . . . 5.0 1.8 5.0 1 1
54 1 . . . . . 3.4 1.8 3.4 1 1
55 1 . . . . . 2.8 1.8 2.8 1 1
56 1 . . . . . 5.0 1.8 5.0 1 1
57 1 . . . . . 2.8 1.8 2.8 1 1
58 1 . . . . . 5.0 1.8 8.0 1 1
59 1 . . . . . 3.4 1.8 3.4 1 1
60 1 . . . . . 3.4 1.8 3.4 1 1
61 1 . . . . . 5.0 1.8 6.0 1 1
62 1 . . . . . 2.8 1.8 2.8 1 1
63 1 . . . . . 3.4 1.8 3.4 1 1
64 1 . . . . . 5.0 1.8 5.0 1 1
65 1 . . . . . 3.4 1.8 3.4 1 1
66 1 . . . . . 5.0 1.8 6.0 1 1
67 1 . . . . . 5.0 1.8 6.0 1 1
68 1 . . . . . 5.0 1.8 6.0 1 1
69 1 . . . . . 5.0 1.8 5.0 1 1
70 1 . . . . . 5.0 1.8 7.0 1 1
71 1 . . . . . 5.0 1.8 7.0 1 1
72 1 . . . . . 3.4 1.8 4.4 1 1
73 1 . . . . . 5.0 1.8 7.0 1 1
74 1 . . . . . 5.0 1.8 5.0 1 1
75 1 . . . . . 5.0 1.8 5.0 1 1
76 1 . . . . . 5.0 1.8 5.0 1 1
77 1 . . . . . 5.0 1.8 7.0 1 1
78 1 . . . . . 5.0 1.8 5.0 1 1
79 1 . . . . . 5.0 1.8 5.0 1 1
80 1 . . . . . 5.0 1.8 5.0 1 1
81 1 . . . . . 5.0 1.8 5.0 1 1
82 1 . . . . . 5.0 1.8 5.0 1 1
83 1 . . . . . 5.0 1.8 6.0 1 1
84 1 . . . . . 5.0 1.8 6.0 1 1
85 1 . . . . . 5.0 1.8 5.0 1 1
86 1 . . . . . 5.0 1.8 5.0 1 1
87 1 . . . . . 3.4 1.8 3.4 1 1
88 1 . . . . . 5.0 1.8 6.0 1 1
89 1 . . . . . 5.0 1.8 5.0 1 1
90 1 . . . . . 5.0 1.8 8.0 1 1
91 1 . . . . . 5.0 1.8 7.0 1 1
92 1 . . . . . 5.0 1.8 6.0 1 1
93 1 . . . . . 5.0 1.8 6.0 1 1
94 1 . . . . . 5.0 1.8 6.0 1 1
95 1 . . . . . 5.0 1.8 8.0 1 1
96 1 . . . . . 5.0 1.8 7.0 1 1
97 1 . . . . . 5.0 1.8 6.0 1 1
98 1 . . . . . 5.0 1.8 7.0 1 1
99 1 . . . . . 5.0 1.8 6.0 1 1
100 1 . . . . . 5.0 1.8 5.0 1 1
101 1 . . . . . 5.0 1.8 6.0 1 1
102 1 . . . . . 5.0 1.8 5.0 1 1
103 1 . . . . . 5.0 1.8 6.0 1 1
104 1 . . . . . 5.0 1.8 6.0 1 1
105 1 . . . . . 3.4 1.8 3.4 1 1
106 1 . . . . . 3.4 1.8 3.4 1 1
107 1 . . . . . 5.0 1.8 5.0 1 1
108 1 . . . . . 3.4 1.8 3.4 1 1
109 1 . . . . . 5.0 1.8 6.0 1 1
110 1 . . . . . 2.8 1.8 3.8 1 1
111 1 . . . . . 5.0 1.8 6.0 1 1
112 1 . . . . . 5.0 1.8 5.0 1 1
113 1 . . . . . 5.0 1.8 8.0 1 1
114 1 . . . . . 5.0 1.8 5.0 1 1
115 1 . . . . . 2.8 1.8 3.8 1 1
116 1 . . . . . 5.0 1.8 6.0 1 1
117 1 . . . . . 5.0 1.8 5.0 1 1
118 1 . . . . . 5.0 1.8 9.0 1 1
119 1 . . . . . 5.0 1.8 5.0 1 1
120 1 . . . . . 5.0 1.8 8.0 1 1
121 1 . . . . . 5.0 1.8 5.0 1 1
122 1 . . . . . 5.0 1.8 5.0 1 1
123 1 . . . . . 2.8 1.8 3.8 1 1
124 1 . . . . . 5.0 1.8 5.0 1 1
125 1 . . . . . 3.4 1.8 4.4 1 1
126 1 . . . . . 5.0 1.8 6.0 1 1
127 1 . . . . . 3.4 1.8 3.4 1 1
128 1 . . . . . 5.0 1.8 6.0 1 1
129 1 . . . . . 5.0 1.8 6.0 1 1
130 1 . . . . . 5.0 1.8 5.0 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type 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 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 2 . OR 1 2
9 2 . 3 . 1 2
9 3 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 2 . OR 1 2
12 2 . 3 . 1 2
12 3 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 2
19 1 . . . 1 2
20 1 . . . 1 2
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 1 . . . 1 2
26 1 2 . OR 1 2
26 2 . 3 . 1 2
26 3 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 2 . OR 1 2
32 2 . 3 . 1 2
32 3 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 1 . . . 1 2
39 1 . . . 1 2
40 1 . . . 1 2
41 1 . . . 1 2
42 1 . . . 1 2
43 1 . . . 1 2
44 1 2 . OR 1 2
44 2 . 3 . 1 2
44 3 . . . 1 2
45 1 . . . 1 2
46 1 . . . 1 2
47 1 . . . 1 2
48 1 . . . 1 2
49 1 . . . 1 2
50 1 . . . 1 2
51 1 2 . OR 1 2
51 2 . 3 . 1 2
51 3 . . . 1 2
52 1 . . . 1 2
53 1 . . . 1 2
54 1 2 . OR 1 2
54 2 . 3 . 1 2
54 3 . . . 1 2
55 1 2 . OR 1 2
55 2 . 3 . 1 2
55 3 . 4 . 1 2
55 4 . . . 1 2
56 1 . . . 1 2
57 1 . . . 1 2
58 1 2 . OR 1 2
58 2 . 3 . 1 2
58 3 . . . 1 2
59 1 2 . OR 1 2
59 2 . 3 . 1 2
59 3 . . . 1 2
60 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 ARG QB . 2 . HB# 1 2
1 1 1 1 1 4 LEU HB2 . 4 . HB2 1 2
1 1 1 1 1 7 LEU QB . 7 . HB# 1 2
1 1 2 1 1 3 MET H . 3 . HN 1 2
2 1 1 1 1 2 ARG H . 2 . HN 1 2
2 1 1 1 1 4 LEU H . 4 . HN 1 2
2 1 2 1 1 3 MET H . 3 . HN 1 2
3 1 1 1 1 2 ARG QB . 2 . HB# 1 2
3 1 1 1 1 4 LEU HB3 . 4 . HB1 1 2
3 1 2 1 1 3 MET QG . 3 . HG# 1 2
4 1 1 1 1 2 ARG HA . 2 . HA 1 2
4 1 2 1 1 3 MET QB . 3 . HB# 1 2
4 1 2 1 1 5 PRO QB . 5 . HB# 1 2
4 1 2 1 1 6 GLN QB . 6 . HB# 1 2
5 1 1 1 1 3 MET HA . 3 . HA 1 2
5 1 2 1 1 4 LEU HB3 . 4 . HB1 1 2
5 1 2 1 1 7 LEU QB . 7 . HB# 1 2
6 1 1 1 1 3 MET QG . 3 . HG# 1 2
6 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 2
6 1 2 1 1 7 LEU QD . 7 . HD## 1 2
7 1 1 1 1 2 ARG QG . 2 . HG# 1 2
7 1 1 1 1 3 MET QB . 3 . HB# 1 2
7 1 2 1 1 5 PRO HD3 . 5 . HD1 1 2
8 1 1 1 1 2 ARG QG . 2 . HG# 1 2
8 1 1 1 1 3 MET QB . 3 . HB# 1 2
8 1 2 1 1 5 PRO HD2 . 5 . HD2 1 2
9 2 1 1 1 2 ARG H . 2 . HN 1 2
9 2 1 1 1 4 LEU H . 4 . HN 1 2
9 2 2 1 1 3 MET QB . 3 . HB# 1 2
9 3 1 1 1 4 LEU H . 4 . HN 1 2
9 3 2 1 1 5 PRO QB . 5 . HB# 1 2
9 3 2 1 1 6 GLN QB . 6 . HB# 1 2
10 1 1 1 1 2 ARG H . 2 . HN 1 2
10 1 1 1 1 4 LEU H . 4 . HN 1 2
10 1 2 1 1 3 MET QB . 3 . HB# 1 2
11 1 1 1 1 3 MET QG . 3 . HG# 1 2
11 1 2 1 1 4 LEU HB2 . 4 . HB2 1 2
11 1 2 1 1 7 LEU QB . 7 . HB# 1 2
12 2 1 1 1 4 LEU HA . 4 . HA 1 2
12 2 2 1 1 8 VAL QG . 8 . HG## 1 2
12 3 1 1 1 12 VAL QG . 12 . HG## 1 2
12 3 2 1 1 16 SER HA . 16 . HA 1 2
13 1 1 1 1 2 ARG QB . 2 . HB# 1 2
13 1 1 1 1 4 LEU HB3 . 4 . HB1 1 2
13 1 1 1 1 7 LEU QB . 7 . HB# 1 2
13 1 2 1 1 5 PRO HD3 . 5 . HD1 1 2
14 1 1 1 1 2 ARG QB . 2 . HB# 1 2
14 1 1 1 1 4 LEU HB3 . 4 . HB1 1 2
14 1 1 1 1 7 LEU QB . 7 . HB# 1 2
14 1 2 1 1 5 PRO HD2 . 5 . HD2 1 2
15 1 1 1 1 2 ARG QB . 2 . HB# 1 2
15 1 1 1 1 4 LEU HB3 . 4 . HB1 1 2
15 1 1 1 1 7 LEU QB . 7 . HB# 1 2
15 1 2 1 1 6 GLN H . 6 . HN 1 2
16 1 1 1 1 2 ARG H . 2 . HN 1 2
16 1 1 1 1 4 LEU H . 4 . HN 1 2
16 1 2 1 1 7 LEU H . 7 . HN 1 2
17 1 1 1 1 2 ARG QB . 2 . HB# 1 2
17 1 1 1 1 4 LEU HB2 . 4 . HB2 1 2
17 1 1 1 1 7 LEU QB . 7 . HB# 1 2
17 1 2 1 1 6 GLN QG . 6 . HG# 1 2
18 1 1 1 1 4 LEU HB3 . 4 . HB1 1 2
18 1 1 1 1 7 LEU QB . 7 . HB# 1 2
18 1 2 1 1 6 GLN QG . 6 . HG# 1 2
19 1 1 1 1 4 LEU MD2 . 4 . HD2# 1 2
19 1 2 1 1 7 LEU H . 7 . HN 1 2
19 1 2 1 1 8 VAL H . 8 . HN 1 2
20 1 1 1 1 2 ARG H . 2 . HN 1 2
20 1 1 1 1 4 LEU H . 4 . HN 1 2
20 1 2 1 1 7 LEU H . 7 . HN 1 2
20 1 2 1 1 8 VAL H . 8 . HN 1 2
21 1 1 1 1 5 PRO QB . 5 . HB# 1 2
21 1 1 1 1 6 GLN QB . 6 . HB# 1 2
21 1 1 1 1 8 VAL HB . 8 . HB 1 2
21 1 2 1 1 7 LEU H . 7 . HN 1 2
22 1 1 1 1 6 GLN HA . 6 . HA 1 2
22 1 1 1 1 11 LEU HA . 11 . HA 1 2
22 1 2 1 1 8 VAL HA . 8 . HA 1 2
23 1 1 1 1 5 PRO HA . 5 . HA 1 2
23 1 1 1 1 6 GLN HA . 6 . HA 1 2
23 1 1 1 1 7 LEU HA . 7 . HA 1 2
23 1 1 1 1 9 CYS HA . 9 . HA 1 2
23 1 2 1 1 8 VAL HA . 8 . HA 1 2
24 1 1 1 1 5 PRO QG . 5 . HG# 1 2
24 1 1 1 1 7 LEU QB . 7 . HB# 1 2
24 1 1 1 1 10 ARG QG . 10 . HG# 1 2
24 1 1 1 1 11 LEU QB . 11 . HB# 1 2
24 1 2 1 1 9 CYS QB . 9 . HB# 1 2
25 1 1 1 1 7 LEU QD . 7 . HD## 1 2
25 1 1 1 1 8 VAL QG . 8 . HG## 1 2
25 1 1 1 1 11 LEU QD . 11 . HD## 1 2
25 1 2 1 1 9 CYS QB . 9 . HB# 1 2
26 2 1 1 1 6 GLN QB . 6 . HB# 1 2
26 2 1 1 1 8 VAL HB . 8 . HB 1 2
26 2 1 1 1 12 VAL HB . 12 . HB 1 2
26 2 2 1 1 10 ARG HE . 10 . HE 1 2
26 3 1 1 1 12 VAL HB . 12 . HB 1 2
26 3 2 1 1 14 ARG HE . 14 . HE 1 2
27 1 1 1 1 8 VAL HA . 8 . HA 1 2
27 1 2 1 1 10 ARG H . 10 . HN 1 2
27 1 2 1 1 13 LEU H . 13 . HN 1 2
27 1 2 1 1 14 ARG H . 14 . HN 1 2
28 1 1 1 1 5 PRO QB . 5 . HB# 1 2
28 1 1 1 1 6 GLN QB . 6 . HB# 1 2
28 1 1 1 1 8 VAL HB . 8 . HB 1 2
28 1 2 1 1 9 CYS H . 9 . HN 1 2
29 1 1 1 1 5 PRO QB . 5 . HB# 1 2
29 1 1 1 1 6 GLN QB . 6 . HB# 1 2
29 1 1 1 1 8 VAL HB . 8 . HB 1 2
29 1 1 1 1 12 VAL HB . 12 . HB 1 2
29 1 2 1 1 9 CYS QB . 9 . HB# 1 2
30 1 1 1 1 5 PRO HA . 5 . HA 1 2
30 1 1 1 1 7 LEU HA . 7 . HA 1 2
30 1 1 1 1 9 CYS HA . 9 . HA 1 2
30 1 1 1 1 10 ARG HA . 10 . HA 1 2
30 1 2 1 1 8 VAL HA . 8 . HA 1 2
31 1 1 1 1 8 VAL HA . 8 . HA 1 2
31 1 2 1 1 10 ARG H . 10 . HN 1 2
31 1 2 1 1 14 ARG H . 14 . HN 1 2
32 2 1 1 1 8 VAL HB . 8 . HB 1 2
32 2 2 1 1 10 ARG QD . 10 . HD# 1 2
32 3 1 1 1 12 VAL HB . 12 . HB 1 2
32 3 2 1 1 14 ARG QD . 14 . HD# 1 2
33 1 1 1 1 6 GLN QB . 6 . HB# 1 2
33 1 1 1 1 8 VAL HB . 8 . HB 1 2
33 1 1 1 1 12 VAL HB . 12 . HB 1 2
33 1 2 1 1 9 CYS QB . 9 . HB# 1 2
34 1 1 1 1 7 LEU H . 7 . HN 1 2
34 1 1 1 1 8 VAL H . 8 . HN 1 2
34 1 2 1 1 10 ARG QD . 10 . HD# 1 2
34 1 2 1 1 14 ARG QD . 14 . HD# 1 2
35 1 1 1 1 9 CYS QB . 9 . HB# 1 2
35 1 1 1 1 15 CYS QB . 15 . HB# 1 2
35 1 2 1 1 12 VAL H . 12 . HN 1 2
36 1 1 1 1 10 ARG QG . 10 . HG# 1 2
36 1 1 1 1 13 LEU QB . 13 . HB# 1 2
36 1 1 1 1 14 ARG QG . 14 . HG# 1 2
36 1 2 1 1 12 VAL H . 12 . HN 1 2
37 1 1 1 1 9 CYS HA . 9 . HA 1 2
37 1 1 1 1 10 ARG HA . 10 . HA 1 2
37 1 2 1 1 13 LEU QB . 13 . HB# 1 2
38 1 1 1 1 10 ARG QB . 10 . HB# 1 2
38 1 1 1 1 14 ARG QB . 14 . HB# 1 2
38 1 2 1 1 12 VAL H . 12 . HN 1 2
39 1 1 1 1 10 ARG HA . 10 . HA 1 2
39 1 1 1 1 11 LEU HA . 11 . HA 1 2
39 1 2 1 1 12 VAL HA . 12 . HA 1 2
40 1 1 1 1 9 CYS HA . 9 . HA 1 2
40 1 1 1 1 10 ARG HA . 10 . HA 1 2
40 1 2 1 1 12 VAL QG . 12 . HG## 1 2
41 1 1 1 1 8 VAL QG . 8 . HG## 1 2
41 1 1 1 1 12 VAL QG . 12 . HG## 1 2
41 1 2 1 1 9 CYS HA . 9 . HA 1 2
41 1 2 1 1 10 ARG HA . 10 . HA 1 2
42 1 1 1 1 10 ARG QG . 10 . HG# 1 2
42 1 1 1 1 11 LEU QB . 11 . HB# 1 2
42 1 2 1 1 12 VAL H . 12 . HN 1 2
43 1 1 1 1 6 GLN QB . 6 . HB# 1 2
43 1 1 1 1 8 VAL HB . 8 . HB 1 2
43 1 1 1 1 12 VAL HB . 12 . HB 1 2
43 1 2 1 1 11 LEU H . 11 . HN 1 2
44 2 1 1 1 10 ARG QG . 10 . HG# 1 2
44 2 1 1 1 11 LEU QB . 11 . HB# 1 2
44 2 2 1 1 13 LEU H . 13 . HN 1 2
44 3 1 1 1 11 LEU QB . 11 . HB# 1 2
44 3 2 1 1 15 CYS H . 15 . HN 1 2
45 1 1 1 1 11 LEU HA . 11 . HA 1 2
45 1 2 1 1 13 LEU H . 13 . HN 1 2
45 1 2 1 1 14 ARG H . 14 . HN 1 2
46 1 1 1 1 12 VAL H . 12 . HN 1 2
46 1 2 1 1 13 LEU H . 13 . HN 1 2
46 1 2 1 1 14 ARG H . 14 . HN 1 2
47 1 1 1 1 11 LEU QD . 11 . HD## 1 2
47 1 1 1 1 12 VAL QG . 12 . HG## 1 2
47 1 1 1 1 13 LEU QD . 13 . HD## 1 2
47 1 2 1 1 14 ARG HA . 14 . HA 1 2
48 1 1 1 1 11 LEU QD . 11 . HD## 1 2
48 1 1 1 1 12 VAL QG . 12 . HG## 1 2
48 1 1 1 1 13 LEU QD . 13 . HD## 1 2
48 1 2 1 1 16 SER H . 16 . HN 1 2
49 1 1 1 1 12 VAL QG . 12 . HG## 1 2
49 1 2 1 1 13 LEU H . 13 . HN 1 2
49 1 2 1 1 15 CYS H . 15 . HN 1 2
50 1 1 1 1 11 LEU QD . 11 . HD## 1 2
50 1 1 1 1 13 LEU QD . 13 . HD## 1 2
50 1 2 1 1 12 VAL HA . 12 . HA 1 2
51 2 1 1 1 7 LEU QD . 7 . HD## 1 2
51 2 1 1 1 11 LEU QD . 11 . HD## 1 2
51 2 2 1 1 10 ARG QD . 10 . HD# 1 2
51 3 1 1 1 12 VAL QG . 12 . HG## 1 2
51 3 1 1 1 13 LEU QD . 13 . HD## 1 2
51 3 2 1 1 14 ARG QD . 14 . HD# 1 2
52 1 1 1 1 12 VAL QG . 12 . HG## 1 2
52 1 2 1 1 13 LEU H . 13 . HN 1 2
52 1 2 1 1 14 ARG H . 14 . HN 1 2
52 1 2 1 1 15 CYS H . 15 . HN 1 2
53 1 1 1 1 13 LEU H . 13 . HN 1 2
53 1 1 1 1 15 CYS H . 15 . HN 1 2
53 1 2 1 1 14 ARG QD . 14 . HD# 1 2
54 2 1 1 1 10 ARG H . 10 . HN 1 2
54 2 1 1 1 14 ARG H . 14 . HN 1 2
54 2 2 1 1 13 LEU QB . 13 . HB# 1 2
54 3 1 1 1 11 LEU QB . 11 . HB# 1 2
54 3 2 1 1 14 ARG H . 14 . HN 1 2
55 2 1 1 1 2 ARG HE . 2 . HE 1 2
55 2 2 1 1 4 LEU MD1 . 4 . HD1# 1 2
55 3 1 1 1 10 ARG HE . 10 . HE 1 2
55 3 2 1 1 11 LEU QD . 11 . HD## 1 2
55 4 1 1 1 12 VAL QG . 12 . HG## 1 2
55 4 1 1 1 13 LEU QD . 13 . HD## 1 2
55 4 2 1 1 14 ARG HE . 14 . HE 1 2
56 1 1 1 1 11 LEU QD . 11 . HD## 1 2
56 1 1 1 1 12 VAL QG . 12 . HG## 1 2
56 1 1 1 1 13 LEU QD . 13 . HD## 1 2
56 1 2 1 1 14 ARG QD . 14 . HD# 1 2
57 1 1 1 1 13 LEU H . 13 . HN 1 2
57 1 1 1 1 15 CYS H . 15 . HN 1 2
57 1 2 1 1 14 ARG QB . 14 . HB# 1 2
58 2 1 1 1 10 ARG HE . 10 . HE 1 2
58 2 1 1 1 14 ARG HE . 14 . HE 1 2
58 2 2 1 1 13 LEU H . 13 . HN 1 2
58 3 1 1 1 14 ARG HE . 14 . HE 1 2
58 3 2 1 1 15 CYS H . 15 . HN 1 2
59 2 1 1 1 10 ARG H . 10 . HN 1 2
59 2 2 1 1 10 ARG HE . 10 . HE 1 2
59 3 1 1 1 14 ARG H . 14 . HN 1 2
59 3 2 1 1 14 ARG HE . 14 . HE 1 2
60 1 1 1 1 13 LEU H . 13 . HN 1 2
60 1 1 1 1 15 CYS H . 15 . HN 1 2
60 1 2 1 1 16 SER HA . 16 . HA 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.0 1.8 7.0 1 2
2 1 . . . . . . 1.8 3.4 1 2
3 1 . . . . . 3.4 1.8 6.4 1 2
4 1 . . . . . 3.4 1.8 6.4 1 2
5 1 . . . . . 5.0 1.8 6.0 1 2
6 1 . . . . . 5.0 1.8 11.0 1 2
7 1 . . . . . 3.4 1.8 5.4 1 2
8 1 . . . . . 5.0 1.8 7.0 1 2
9 2 . . . . . 2.8 1.8 6.8 1 2
9 3 . . . . . 2.8 1.8 6.8 1 2
10 1 . . . . . 5.0 1.8 7.0 1 2
11 1 . . . . . 5.0 1.8 8.0 1 2
12 2 . . . . . 5.0 1.8 11.0 1 2
12 3 . . . . . 5.0 1.8 11.0 1 2
13 1 . . . . . 3.4 1.8 5.4 1 2
14 1 . . . . . 5.0 1.8 7.0 1 2
15 1 . . . . . 5.0 1.8 7.0 1 2
16 1 . . . . . 5.0 1.8 5.0 1 2
17 1 . . . . . 5.0 1.8 10.0 1 2
18 1 . . . . . 5.0 1.8 8.0 1 2
19 1 . . . . . 5.0 1.8 7.0 1 2
20 1 . . . . . 5.0 1.8 5.0 1 2
21 1 . . . . . 5.0 1.8 7.0 1 2
22 1 . . . . . 5.0 1.8 5.0 1 2
23 1 . . . . . 5.0 1.8 5.0 1 2
24 1 . . . . . 5.0 1.8 13.0 1 2
25 1 . . . . . 5.0 1.8 17.0 1 2
26 2 . . . . . 5.0 1.8 6.0 1 2
26 3 . . . . . 5.0 1.8 6.0 1 2
27 1 . . . . . 5.0 1.8 5.0 1 2
28 1 . . . . . 2.8 1.8 4.8 1 2
29 1 . . . . . 5.0 1.8 11.0 1 2
30 1 . . . . . 5.0 1.8 5.0 1 2
31 1 . . . . . 5.0 1.8 5.0 1 2
32 2 . . . . . 5.0 1.8 7.0 1 2
32 3 . . . . . 5.0 1.8 7.0 1 2
33 1 . . . . . 5.0 1.8 9.0 1 2
34 1 . . . . . 5.0 1.8 9.0 1 2
35 1 . . . . . 5.0 1.8 7.0 1 2
36 1 . . . . . 5.0 1.8 8.0 1 2
37 1 . . . . . 3.4 1.8 5.4 1 2
38 1 . . . . . 5.0 1.8 7.0 1 2
39 1 . . . . . 5.0 1.8 5.0 1 2
40 1 . . . . . 5.0 1.8 11.0 1 2
41 1 . . . . . 3.4 1.8 15.4 1 2
42 1 . . . . . 5.0 1.8 7.0 1 2
43 1 . . . . . 5.0 1.8 6.0 1 2
44 2 . . . . . 3.4 1.8 6.4 1 2
44 3 . . . . . 3.4 1.8 6.4 1 2
45 1 . . . . . 2.8 1.8 2.8 1 2
46 1 . . . . . 2.8 1.8 2.8 1 2
47 1 . . . . . 2.8 1.8 11.8 1 2
48 1 . . . . . 5.0 1.8 14.0 1 2
49 1 . . . . . 3.4 1.8 9.4 1 2
50 1 . . . . . 3.4 1.8 9.4 1 2
51 2 . . . . . 2.8 1.8 18.8 1 2
51 3 . . . . . 2.8 1.8 18.8 1 2
52 1 . . . . . 5.0 1.8 14.0 1 2
53 1 . . . . . 5.0 1.8 7.0 1 2
54 2 . . . . . 3.4 1.8 6.4 1 2
54 3 . . . . . 3.4 1.8 6.4 1 2
55 2 . . . . . 5.0 1.8 15.0 1 2
55 3 . . . . . 5.0 1.8 15.0 1 2
55 4 . . . . . 5.0 1.8 15.0 1 2
56 1 . . . . . 5.0 1.8 17.0 1 2
57 1 . . . . . 3.4 1.8 5.4 1 2
58 2 . . . . . 5.0 1.8 5.0 1 2
58 3 . . . . . 5.0 1.8 5.0 1 2
59 2 . . . . . 5.0 1.8 5.0 1 2
59 3 . . . . . 5.0 1.8 5.0 1 2
60 1 . . . . . 5.0 1.8 5.0 1 2
stop_
save_
save_CNS/XPLOR_distance_constraints_6_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 3
2 1 . . . 1 3
3 1 . . . 1 3
4 1 . . . 1 3
5 1 . . . 1 3
6 1 . . . 1 3
7 1 . . . 1 3
8 1 . . . 1 3
9 1 . . . 1 3
10 1 . . . 1 3
11 1 . . . 1 3
12 1 . . . 1 3
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 7 LEU O . 7 . O 1 3
1 1 2 1 1 11 LEU H . 11 . HN 1 3
2 1 1 1 1 7 LEU O . 7 . O 1 3
2 1 2 1 1 11 LEU N . 11 . N 1 3
3 1 1 1 1 8 VAL O . 8 . O 1 3
3 1 2 1 1 12 VAL H . 12 . HN 1 3
4 1 1 1 1 8 VAL O . 8 . O 1 3
4 1 2 1 1 12 VAL N . 12 . N 1 3
5 1 1 1 1 9 CYS O . 9 . O 1 3
5 1 2 1 1 13 LEU H . 13 . HN 1 3
6 1 1 1 1 9 CYS O . 9 . O 1 3
6 1 2 1 1 13 LEU N . 13 . N 1 3
7 1 1 1 1 10 ARG O . 10 . O 1 3
7 1 2 1 1 14 ARG H . 14 . HN 1 3
8 1 1 1 1 10 ARG O . 10 . O 1 3
8 1 2 1 1 14 ARG N . 14 . N 1 3
9 1 1 1 1 11 LEU O . 11 . O 1 3
9 1 2 1 1 15 CYS H . 15 . HN 1 3
10 1 1 1 1 11 LEU O . 11 . O 1 3
10 1 2 1 1 15 CYS N . 15 . N 1 3
11 1 1 1 1 12 VAL O . 12 . O 1 3
11 1 2 1 1 16 SER H . 16 . HN 1 3
12 1 1 1 1 12 VAL O . 12 . O 1 3
12 1 2 1 1 16 SER N . 16 . N 1 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.2 1.7 2.4 1 3
2 1 . . . . . 3.3 2.5 5.5 1 3
3 1 . . . . . 2.2 1.7 2.4 1 3
4 1 . . . . . 3.3 2.5 3.5 1 3
5 1 . . . . . 2.2 1.7 2.4 1 3
6 1 . . . . . 3.3 2.5 5.5 1 3
7 1 . . . . . 2.2 1.7 2.4 1 3
8 1 . . . . . 3.3 2.5 3.5 1 3
9 1 . . . . . 2.2 1.7 2.4 1 3
10 1 . . . . . 3.3 2.5 5.5 1 3
11 1 . . . . . 2.2 1.7 2.4 1 3
12 1 . . . . . 3.3 2.5 5.5 1 3
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 6 GLN C 1 1 7 LEU N 1 1 7 LEU CA 1 1 7 LEU C -89.99999 -30.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1
2 . 1 1 7 LEU N 1 1 7 LEU CA 1 1 7 LEU C 1 1 8 VAL N -80.0 0.0 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1
3 . 1 1 7 LEU C 1 1 8 VAL N 1 1 8 VAL CA 1 1 8 VAL C -89.99999 -30.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
4 . 1 1 8 VAL N 1 1 8 VAL CA 1 1 8 VAL C 1 1 9 CYS N -80.0 0.0 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1
5 . 1 1 8 VAL C 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C -89.99999 -30.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1
6 . 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C 1 1 10 ARG N -80.0 0.0 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1
7 . 1 1 9 CYS C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -89.99999 -30.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
8 . 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C 1 1 11 LEU N -80.0 0.0 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1
9 . 1 1 10 ARG C 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C -89.99999 -30.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
10 . 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C 1 1 12 VAL N -80.0 0.0 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1
11 . 1 1 11 LEU C 1 1 12 VAL N 1 1 12 VAL CA 1 1 12 VAL C -89.99999 -30.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
12 . 1 1 12 VAL N 1 1 12 VAL CA 1 1 12 VAL C 1 1 13 LEU N -80.0 0.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1
13 . 1 1 12 VAL C 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C -89.99999 -30.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1
14 . 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C 1 1 14 ARG N -80.0 0.0 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1
15 . 1 1 13 LEU C 1 1 14 ARG N 1 1 14 ARG CA 1 1 14 ARG C -89.99999 -30.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1
16 . 1 1 14 ARG N 1 1 14 ARG CA 1 1 14 ARG C 1 1 15 CYS N -80.0 0.0 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1
17 . 1 1 14 ARG C 1 1 15 CYS N 1 1 15 CYS CA 1 1 15 CYS C -89.99999 -30.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1
18 . 1 1 15 CYS N 1 1 15 CYS CA 1 1 15 CYS C 1 1 16 SER N -80.0 0.0 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1
19 . 1 1 15 CYS C 1 1 16 SER N 1 1 16 SER CA 1 1 16 SER C -89.99999 -30.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 GLY C C -9.688 1.468 -0.619 1.00 . A A . 1 GLY C 1 1
1 2 1 1 1 GLY CA C -10.429 1.652 -1.929 1.00 . A A . 1 GLY CA 1 1
1 3 1 1 1 GLY H1 H -12.121 2.795 -2.371 1.00 . A A . 1 GLY H1 1 1
1 4 1 1 1 GLY H2 H -12.019 2.323 -0.750 1.00 . A A . 1 GLY H2 1 1
1 5 1 1 1 GLY H3 H -12.469 1.199 -1.931 1.00 . A A . 1 GLY H3 1 1
1 6 1 1 1 GLY HA2 H -10.379 0.731 -2.491 1.00 . A A . 1 GLY HA2 1 1
1 7 1 1 1 GLY HA3 H -9.945 2.433 -2.497 1.00 . A A . 1 GLY HA3 1 1
1 8 1 1 1 GLY N N -11.859 2.018 -1.732 1.00 . A A . 1 GLY N 1 1
1 9 1 1 1 GLY O O -10.165 0.773 0.278 1.00 . A A . 1 GLY O 1 1
1 10 1 1 2 ARG C C -7.254 0.561 0.941 1.00 . A A . 2 ARG C 1 1
1 11 1 1 2 ARG CA C -7.710 1.997 0.700 1.00 . A A . 2 ARG CA 1 1
1 12 1 1 2 ARG CB C -8.497 2.509 1.910 1.00 . A A . 2 ARG CB 1 1
1 13 1 1 2 ARG CD C -9.190 4.907 1.623 1.00 . A A . 2 ARG CD 1 1
1 14 1 1 2 ARG CG C -8.193 3.956 2.263 1.00 . A A . 2 ARG CG 1 1
1 15 1 1 2 ARG CZ C -9.470 6.083 -0.525 1.00 . A A . 2 ARG CZ 1 1
1 16 1 1 2 ARG H H -8.196 2.632 -1.260 1.00 . A A . 2 ARG H 1 1
1 17 1 1 2 ARG HA H -6.838 2.619 0.562 1.00 . A A . 2 ARG HA 1 1
1 18 1 1 2 ARG HB2 H -9.553 2.426 1.699 1.00 . A A . 2 ARG HB2 1 1
1 19 1 1 2 ARG HB3 H -8.260 1.894 2.766 1.00 . A A . 2 ARG HB3 1 1
1 20 1 1 2 ARG HD2 H -10.182 4.495 1.730 1.00 . A A . 2 ARG HD2 1 1
1 21 1 1 2 ARG HD3 H -9.139 5.858 2.132 1.00 . A A . 2 ARG HD3 1 1
1 22 1 1 2 ARG HE H -8.288 4.500 -0.233 1.00 . A A . 2 ARG HE 1 1
1 23 1 1 2 ARG HG2 H -8.240 4.072 3.336 1.00 . A A . 2 ARG HG2 1 1
1 24 1 1 2 ARG HG3 H -7.200 4.201 1.915 1.00 . A A . 2 ARG HG3 1 1
1 25 1 1 2 ARG HH11 H -10.560 6.845 0.998 1.00 . A A . 2 ARG HH11 1 1
1 26 1 1 2 ARG HH12 H -10.738 7.657 -0.521 1.00 . A A . 2 ARG HH12 1 1
1 27 1 1 2 ARG HH21 H -8.521 5.567 -2.234 1.00 . A A . 2 ARG HH21 1 1
1 28 1 1 2 ARG HH22 H -9.581 6.931 -2.356 1.00 . A A . 2 ARG HH22 1 1
1 29 1 1 2 ARG N N -8.521 2.093 -0.509 1.00 . A A . 2 ARG N 1 1
1 30 1 1 2 ARG NE N -8.917 5.114 0.202 1.00 . A A . 2 ARG NE 1 1
1 31 1 1 2 ARG NH1 N -10.326 6.932 0.030 1.00 . A A . 2 ARG NH1 1 1
1 32 1 1 2 ARG NH2 N -9.166 6.203 -1.810 1.00 . A A . 2 ARG NH2 1 1
1 33 1 1 2 ARG O O -8.067 -0.362 0.977 1.00 . A A . 2 ARG O 1 1
1 34 1 1 3 MET C C -5.862 -1.948 0.312 1.00 . A A . 3 MET C 1 1
1 35 1 1 3 MET CA C -5.370 -0.941 1.348 1.00 . A A . 3 MET CA 1 1
1 36 1 1 3 MET CB C -5.709 -1.437 2.760 1.00 . A A . 3 MET CB 1 1
1 37 1 1 3 MET CE C -5.462 1.835 5.319 1.00 . A A . 3 MET CE 1 1
1 38 1 1 3 MET CG C -6.121 -0.334 3.722 1.00 . A A . 3 MET CG 1 1
1 39 1 1 3 MET H H -5.351 1.160 1.068 1.00 . A A . 3 MET H 1 1
1 40 1 1 3 MET HA H -4.297 -0.851 1.257 1.00 . A A . 3 MET HA 1 1
1 41 1 1 3 MET HB2 H -6.520 -2.145 2.695 1.00 . A A . 3 MET HB2 1 1
1 42 1 1 3 MET HB3 H -4.842 -1.935 3.169 1.00 . A A . 3 MET HB3 1 1
1 43 1 1 3 MET HE1 H -4.619 2.226 5.868 1.00 . A A . 3 MET HE1 1 1
1 44 1 1 3 MET HE2 H -6.018 1.156 5.948 1.00 . A A . 3 MET HE2 1 1
1 45 1 1 3 MET HE3 H -6.102 2.650 5.013 1.00 . A A . 3 MET HE3 1 1
1 46 1 1 3 MET HG2 H -7.040 0.107 3.368 1.00 . A A . 3 MET HG2 1 1
1 47 1 1 3 MET HG3 H -6.285 -0.769 4.697 1.00 . A A . 3 MET HG3 1 1
1 48 1 1 3 MET N N -5.946 0.382 1.106 1.00 . A A . 3 MET N 1 1
1 49 1 1 3 MET O O -6.426 -2.986 0.658 1.00 . A A . 3 MET O 1 1
1 50 1 1 3 MET SD S -4.877 0.962 3.868 1.00 . A A . 3 MET SD 1 1
1 51 1 1 4 LEU C C -5.601 -2.006 -3.390 1.00 . A A . 4 LEU C 1 1
1 52 1 1 4 LEU CA C -6.063 -2.519 -2.040 1.00 . A A . 4 LEU CA 1 1
1 53 1 1 4 LEU CB C -7.584 -2.698 -2.030 1.00 . A A . 4 LEU CB 1 1
1 54 1 1 4 LEU CD1 C -7.479 -4.766 -3.441 1.00 . A A . 4 LEU CD1 1 1
1 55 1 1 4 LEU CD2 C -7.694 -4.961 -0.957 1.00 . A A . 4 LEU CD2 1 1
1 56 1 1 4 LEU CG C -8.065 -4.142 -2.184 1.00 . A A . 4 LEU CG 1 1
1 57 1 1 4 LEU H H -5.184 -0.798 -1.175 1.00 . A A . 4 LEU H 1 1
1 58 1 1 4 LEU HA H -5.610 -3.454 -1.879 1.00 . A A . 4 LEU HA 1 1
1 59 1 1 4 LEU HB2 H -7.963 -2.312 -1.095 1.00 . A A . 4 LEU HB2 1 1
1 60 1 1 4 LEU HB3 H -8.001 -2.115 -2.836 1.00 . A A . 4 LEU HB3 1 1
1 61 1 1 4 LEU HD11 H -8.208 -5.425 -3.890 1.00 . A A . 4 LEU HD11 1 1
1 62 1 1 4 LEU HD12 H -6.595 -5.330 -3.184 1.00 . A A . 4 LEU HD12 1 1
1 63 1 1 4 LEU HD13 H -7.218 -3.987 -4.143 1.00 . A A . 4 LEU HD13 1 1
1 64 1 1 4 LEU HD21 H -8.008 -4.436 -0.067 1.00 . A A . 4 LEU HD21 1 1
1 65 1 1 4 LEU HD22 H -6.624 -5.105 -0.931 1.00 . A A . 4 LEU HD22 1 1
1 66 1 1 4 LEU HD23 H -8.186 -5.920 -1.002 1.00 . A A . 4 LEU HD23 1 1
1 67 1 1 4 LEU HG H -9.141 -4.148 -2.279 1.00 . A A . 4 LEU HG 1 1
1 68 1 1 4 LEU N N -5.642 -1.637 -0.960 1.00 . A A . 4 LEU N 1 1
1 69 1 1 4 LEU O O -4.970 -2.727 -4.164 1.00 . A A . 4 LEU O 1 1
1 70 1 1 5 PRO C C -4.170 0.458 -4.904 1.00 . A A . 5 PRO C 1 1
1 71 1 1 5 PRO CA C -5.583 -0.107 -4.946 1.00 . A A . 5 PRO CA 1 1
1 72 1 1 5 PRO CB C -6.645 1.010 -5.034 1.00 . A A . 5 PRO CB 1 1
1 73 1 1 5 PRO CD C -6.683 0.146 -2.844 1.00 . A A . 5 PRO CD 1 1
1 74 1 1 5 PRO CG C -7.560 0.743 -3.875 1.00 . A A . 5 PRO CG 1 1
1 75 1 1 5 PRO HA H -5.683 -0.777 -5.787 1.00 . A A . 5 PRO HA 1 1
1 76 1 1 5 PRO HB2 H -6.166 1.975 -4.950 1.00 . A A . 5 PRO HB2 1 1
1 77 1 1 5 PRO HB3 H -7.169 0.941 -5.975 1.00 . A A . 5 PRO HB3 1 1
1 78 1 1 5 PRO HD2 H -6.050 0.895 -2.390 1.00 . A A . 5 PRO HD2 1 1
1 79 1 1 5 PRO HD3 H -7.252 -0.392 -2.104 1.00 . A A . 5 PRO HD3 1 1
1 80 1 1 5 PRO HG2 H -8.002 1.654 -3.516 1.00 . A A . 5 PRO HG2 1 1
1 81 1 1 5 PRO HG3 H -8.317 0.025 -4.156 1.00 . A A . 5 PRO HG3 1 1
1 82 1 1 5 PRO N N -5.926 -0.758 -3.690 1.00 . A A . 5 PRO N 1 1
1 83 1 1 5 PRO O O -3.603 0.837 -5.929 1.00 . A A . 5 PRO O 1 1
1 84 1 1 6 GLN C C -1.437 0.010 -2.643 1.00 . A A . 6 GLN C 1 1
1 85 1 1 6 GLN CA C -2.253 0.986 -3.495 1.00 . A A . 6 GLN CA 1 1
1 86 1 1 6 GLN CB C -2.283 2.362 -2.829 1.00 . A A . 6 GLN CB 1 1
1 87 1 1 6 GLN CD C -1.042 4.515 -2.379 1.00 . A A . 6 GLN CD 1 1
1 88 1 1 6 GLN CG C -0.946 3.083 -2.865 1.00 . A A . 6 GLN CG 1 1
1 89 1 1 6 GLN H H -4.111 0.166 -2.928 1.00 . A A . 6 GLN H 1 1
1 90 1 1 6 GLN HA H -1.784 1.076 -4.464 1.00 . A A . 6 GLN HA 1 1
1 91 1 1 6 GLN HB2 H -3.014 2.977 -3.334 1.00 . A A . 6 GLN HB2 1 1
1 92 1 1 6 GLN HB3 H -2.577 2.243 -1.797 1.00 . A A . 6 GLN HB3 1 1
1 93 1 1 6 GLN HE21 H 0.821 4.429 -1.686 1.00 . A A . 6 GLN HE21 1 1
1 94 1 1 6 GLN HE22 H 0.003 5.934 -1.456 1.00 . A A . 6 GLN HE22 1 1
1 95 1 1 6 GLN HG2 H -0.249 2.551 -2.235 1.00 . A A . 6 GLN HG2 1 1
1 96 1 1 6 GLN HG3 H -0.582 3.086 -3.881 1.00 . A A . 6 GLN HG3 1 1
1 97 1 1 6 GLN N N -3.605 0.493 -3.699 1.00 . A A . 6 GLN N 1 1
1 98 1 1 6 GLN NE2 N 0.036 5.009 -1.780 1.00 . A A . 6 GLN NE2 1 1
1 99 1 1 6 GLN O O -0.291 0.292 -2.299 1.00 . A A . 6 GLN O 1 1
1 100 1 1 6 GLN OE1 O -2.071 5.171 -2.539 1.00 . A A . 6 GLN OE1 1 1
1 101 1 1 7 LEU C C -0.022 -2.565 -2.141 1.00 . A A . 7 LEU C 1 1
1 102 1 1 7 LEU CA C -1.337 -2.141 -1.492 1.00 . A A . 7 LEU CA 1 1
1 103 1 1 7 LEU CB C -2.233 -3.365 -1.285 1.00 . A A . 7 LEU CB 1 1
1 104 1 1 7 LEU CD1 C -2.610 -5.276 0.296 1.00 . A A . 7 LEU CD1 1 1
1 105 1 1 7 LEU CD2 C -0.898 -5.475 -1.516 1.00 . A A . 7 LEU CD2 1 1
1 106 1 1 7 LEU CG C -1.579 -4.530 -0.537 1.00 . A A . 7 LEU CG 1 1
1 107 1 1 7 LEU H H -2.947 -1.324 -2.599 1.00 . A A . 7 LEU H 1 1
1 108 1 1 7 LEU HA H -1.123 -1.698 -0.534 1.00 . A A . 7 LEU HA 1 1
1 109 1 1 7 LEU HB2 H -3.107 -3.055 -0.732 1.00 . A A . 7 LEU HB2 1 1
1 110 1 1 7 LEU HB3 H -2.549 -3.722 -2.254 1.00 . A A . 7 LEU HB3 1 1
1 111 1 1 7 LEU HD11 H -3.583 -5.180 -0.165 1.00 . A A . 7 LEU HD11 1 1
1 112 1 1 7 LEU HD12 H -2.641 -4.857 1.291 1.00 . A A . 7 LEU HD12 1 1
1 113 1 1 7 LEU HD13 H -2.340 -6.320 0.352 1.00 . A A . 7 LEU HD13 1 1
1 114 1 1 7 LEU HD21 H 0.027 -5.832 -1.086 1.00 . A A . 7 LEU HD21 1 1
1 115 1 1 7 LEU HD22 H -0.688 -4.952 -2.436 1.00 . A A . 7 LEU HD22 1 1
1 116 1 1 7 LEU HD23 H -1.547 -6.314 -1.719 1.00 . A A . 7 LEU HD23 1 1
1 117 1 1 7 LEU HG H -0.827 -4.142 0.134 1.00 . A A . 7 LEU HG 1 1
1 118 1 1 7 LEU N N -2.028 -1.142 -2.302 1.00 . A A . 7 LEU N 1 1
1 119 1 1 7 LEU O O 0.887 -3.049 -1.467 1.00 . A A . 7 LEU O 1 1
1 120 1 1 8 VAL C C 2.281 -1.581 -4.163 1.00 . A A . 8 VAL C 1 1
1 121 1 1 8 VAL CA C 1.289 -2.728 -4.186 1.00 . A A . 8 VAL CA 1 1
1 122 1 1 8 VAL CB C 1.003 -3.130 -5.655 1.00 . A A . 8 VAL CB 1 1
1 123 1 1 8 VAL CG1 C 1.043 -4.642 -5.809 1.00 . A A . 8 VAL CG1 1 1
1 124 1 1 8 VAL CG2 C -0.334 -2.581 -6.141 1.00 . A A . 8 VAL CG2 1 1
1 125 1 1 8 VAL H H -0.674 -1.969 -3.928 1.00 . A A . 8 VAL H 1 1
1 126 1 1 8 VAL HA H 1.734 -3.567 -3.689 1.00 . A A . 8 VAL HA 1 1
1 127 1 1 8 VAL HB H 1.782 -2.713 -6.277 1.00 . A A . 8 VAL HB 1 1
1 128 1 1 8 VAL HG11 H 1.183 -4.894 -6.849 1.00 . A A . 8 VAL HG11 1 1
1 129 1 1 8 VAL HG12 H 0.112 -5.064 -5.458 1.00 . A A . 8 VAL HG12 1 1
1 130 1 1 8 VAL HG13 H 1.861 -5.042 -5.229 1.00 . A A . 8 VAL HG13 1 1
1 131 1 1 8 VAL HG21 H -0.381 -2.649 -7.217 1.00 . A A . 8 VAL HG21 1 1
1 132 1 1 8 VAL HG22 H -0.433 -1.549 -5.840 1.00 . A A . 8 VAL HG22 1 1
1 133 1 1 8 VAL HG23 H -1.138 -3.159 -5.708 1.00 . A A . 8 VAL HG23 1 1
1 134 1 1 8 VAL N N 0.078 -2.371 -3.451 1.00 . A A . 8 VAL N 1 1
1 135 1 1 8 VAL O O 3.342 -1.662 -3.538 1.00 . A A . 8 VAL O 1 1
1 136 1 1 9 CYS C C 3.131 1.076 -3.449 1.00 . A A . 9 CYS C 1 1
1 137 1 1 9 CYS CA C 2.775 0.672 -4.862 1.00 . A A . 9 CYS CA 1 1
1 138 1 1 9 CYS CB C 2.095 1.827 -5.600 1.00 . A A . 9 CYS CB 1 1
1 139 1 1 9 CYS H H 1.062 -0.493 -5.289 1.00 . A A . 9 CYS H 1 1
1 140 1 1 9 CYS HA H 3.688 0.401 -5.370 1.00 . A A . 9 CYS HA 1 1
1 141 1 1 9 CYS HB2 H 1.039 1.811 -5.381 1.00 . A A . 9 CYS HB2 1 1
1 142 1 1 9 CYS HB3 H 2.516 2.761 -5.256 1.00 . A A . 9 CYS HB3 1 1
1 143 1 1 9 CYS HG H 3.094 2.229 -7.626 1.00 . A A . 9 CYS HG 1 1
1 144 1 1 9 CYS N N 1.922 -0.502 -4.828 1.00 . A A . 9 CYS N 1 1
1 145 1 1 9 CYS O O 4.277 1.448 -3.167 1.00 . A A . 9 CYS O 1 1
1 146 1 1 9 CYS SG S 2.285 1.767 -7.397 1.00 . A A . 9 CYS SG 1 1
1 147 1 1 10 ARG C C 3.498 0.267 -0.675 1.00 . A A . 10 ARG C 1 1
1 148 1 1 10 ARG CA C 2.503 1.274 -1.165 1.00 . A A . 10 ARG CA 1 1
1 149 1 1 10 ARG CB C 1.321 1.325 -0.215 1.00 . A A . 10 ARG CB 1 1
1 150 1 1 10 ARG CD C 1.423 0.569 2.183 1.00 . A A . 10 ARG CD 1 1
1 151 1 1 10 ARG CG C 1.771 1.677 1.201 1.00 . A A . 10 ARG CG 1 1
1 152 1 1 10 ARG CZ C -0.274 1.476 3.722 1.00 . A A . 10 ARG CZ 1 1
1 153 1 1 10 ARG H H 1.288 0.613 -2.770 1.00 . A A . 10 ARG H 1 1
1 154 1 1 10 ARG HA H 2.983 2.235 -1.173 1.00 . A A . 10 ARG HA 1 1
1 155 1 1 10 ARG HB2 H 0.621 2.074 -0.555 1.00 . A A . 10 ARG HB2 1 1
1 156 1 1 10 ARG HB3 H 0.837 0.361 -0.193 1.00 . A A . 10 ARG HB3 1 1
1 157 1 1 10 ARG HD2 H 1.517 -0.382 1.678 1.00 . A A . 10 ARG HD2 1 1
1 158 1 1 10 ARG HD3 H 2.116 0.607 3.010 1.00 . A A . 10 ARG HD3 1 1
1 159 1 1 10 ARG HE H -0.638 0.174 2.253 1.00 . A A . 10 ARG HE 1 1
1 160 1 1 10 ARG HG2 H 2.860 1.824 1.203 1.00 . A A . 10 ARG HG2 1 1
1 161 1 1 10 ARG HG3 H 1.285 2.590 1.509 1.00 . A A . 10 ARG HG3 1 1
1 162 1 1 10 ARG HH11 H 1.597 2.177 4.041 1.00 . A A . 10 ARG HH11 1 1
1 163 1 1 10 ARG HH12 H 0.383 2.789 5.112 1.00 . A A . 10 ARG HH12 1 1
1 164 1 1 10 ARG HH21 H -2.230 0.979 3.664 1.00 . A A . 10 ARG HH21 1 1
1 165 1 1 10 ARG HH22 H -1.790 2.108 4.901 1.00 . A A . 10 ARG HH22 1 1
1 166 1 1 10 ARG N N 2.178 0.954 -2.530 1.00 . A A . 10 ARG N 1 1
1 167 1 1 10 ARG NE N 0.063 0.698 2.695 1.00 . A A . 10 ARG NE 1 1
1 168 1 1 10 ARG NH1 N 0.645 2.207 4.343 1.00 . A A . 10 ARG NH1 1 1
1 169 1 1 10 ARG NH2 N -1.535 1.525 4.128 1.00 . A A . 10 ARG NH2 1 1
1 170 1 1 10 ARG O O 4.487 0.642 -0.127 1.00 . A A . 10 ARG O 1 1
1 171 1 1 11 LEU C C 5.548 -1.542 -0.565 1.00 . A A . 11 LEU C 1 1
1 172 1 1 11 LEU CA C 4.156 -2.090 -0.563 1.00 . A A . 11 LEU CA 1 1
1 173 1 1 11 LEU CB C 4.039 -3.275 -1.526 1.00 . A A . 11 LEU CB 1 1
1 174 1 1 11 LEU CD1 C 3.753 -5.745 -1.847 1.00 . A A . 11 LEU CD1 1 1
1 175 1 1 11 LEU CD2 C 5.603 -4.883 -0.403 1.00 . A A . 11 LEU CD2 1 1
1 176 1 1 11 LEU CG C 4.175 -4.654 -0.876 1.00 . A A . 11 LEU CG 1 1
1 177 1 1 11 LEU H H 2.472 -1.223 -1.414 1.00 . A A . 11 LEU H 1 1
1 178 1 1 11 LEU HA H 3.907 -2.407 0.426 1.00 . A A . 11 LEU HA 1 1
1 179 1 1 11 LEU HB2 H 3.075 -3.224 -2.011 1.00 . A A . 11 LEU HB2 1 1
1 180 1 1 11 LEU HB3 H 4.808 -3.180 -2.278 1.00 . A A . 11 LEU HB3 1 1
1 181 1 1 11 LEU HD11 H 2.736 -5.571 -2.166 1.00 . A A . 11 LEU HD11 1 1
1 182 1 1 11 LEU HD12 H 3.816 -6.706 -1.358 1.00 . A A . 11 LEU HD12 1 1
1 183 1 1 11 LEU HD13 H 4.406 -5.736 -2.706 1.00 . A A . 11 LEU HD13 1 1
1 184 1 1 11 LEU HD21 H 6.172 -5.349 -1.194 1.00 . A A . 11 LEU HD21 1 1
1 185 1 1 11 LEU HD22 H 5.596 -5.528 0.464 1.00 . A A . 11 LEU HD22 1 1
1 186 1 1 11 LEU HD23 H 6.053 -3.936 -0.145 1.00 . A A . 11 LEU HD23 1 1
1 187 1 1 11 LEU HG H 3.525 -4.704 -0.015 1.00 . A A . 11 LEU HG 1 1
1 188 1 1 11 LEU N N 3.248 -1.013 -0.938 1.00 . A A . 11 LEU N 1 1
1 189 1 1 11 LEU O O 6.335 -1.763 0.363 1.00 . A A . 11 LEU O 1 1
1 190 1 1 12 VAL C C 7.133 0.844 -0.383 1.00 . A A . 12 VAL C 1 1
1 191 1 1 12 VAL CA C 7.077 -0.054 -1.605 1.00 . A A . 12 VAL CA 1 1
1 192 1 1 12 VAL CB C 7.284 0.769 -2.891 1.00 . A A . 12 VAL CB 1 1
1 193 1 1 12 VAL CG1 C 8.666 1.402 -2.903 1.00 . A A . 12 VAL CG1 1 1
1 194 1 1 12 VAL CG2 C 7.077 -0.103 -4.120 1.00 . A A . 12 VAL CG2 1 1
1 195 1 1 12 VAL H H 5.114 -0.514 -2.239 1.00 . A A . 12 VAL H 1 1
1 196 1 1 12 VAL HA H 7.818 -0.804 -1.527 1.00 . A A . 12 VAL HA 1 1
1 197 1 1 12 VAL HB H 6.550 1.561 -2.910 1.00 . A A . 12 VAL HB 1 1
1 198 1 1 12 VAL HG11 H 8.712 2.182 -2.158 1.00 . A A . 12 VAL HG11 1 1
1 199 1 1 12 VAL HG12 H 8.861 1.823 -3.878 1.00 . A A . 12 VAL HG12 1 1
1 200 1 1 12 VAL HG13 H 9.410 0.649 -2.681 1.00 . A A . 12 VAL HG13 1 1
1 201 1 1 12 VAL HG21 H 6.482 -0.964 -3.856 1.00 . A A . 12 VAL HG21 1 1
1 202 1 1 12 VAL HG22 H 8.036 -0.428 -4.496 1.00 . A A . 12 VAL HG22 1 1
1 203 1 1 12 VAL HG23 H 6.566 0.467 -4.883 1.00 . A A . 12 VAL HG23 1 1
1 204 1 1 12 VAL N N 5.814 -0.721 -1.567 1.00 . A A . 12 VAL N 1 1
1 205 1 1 12 VAL O O 8.053 0.786 0.441 1.00 . A A . 12 VAL O 1 1
1 206 1 1 13 LEU C C 5.421 1.717 2.140 1.00 . A A . 13 LEU C 1 1
1 207 1 1 13 LEU CA C 5.949 2.487 0.924 1.00 . A A . 13 LEU CA 1 1
1 208 1 1 13 LEU CB C 5.109 3.729 0.650 1.00 . A A . 13 LEU CB 1 1
1 209 1 1 13 LEU CD1 C 3.922 5.225 -0.976 1.00 . A A . 13 LEU CD1 1 1
1 210 1 1 13 LEU CD2 C 6.284 4.535 -1.413 1.00 . A A . 13 LEU CD2 1 1
1 211 1 1 13 LEU CG C 4.948 4.112 -0.824 1.00 . A A . 13 LEU CG 1 1
1 212 1 1 13 LEU H H 5.359 1.588 -0.901 1.00 . A A . 13 LEU H 1 1
1 213 1 1 13 LEU HA H 6.929 2.799 1.159 1.00 . A A . 13 LEU HA 1 1
1 214 1 1 13 LEU HB2 H 4.130 3.581 1.078 1.00 . A A . 13 LEU HB2 1 1
1 215 1 1 13 LEU HB3 H 5.591 4.554 1.162 1.00 . A A . 13 LEU HB3 1 1
1 216 1 1 13 LEU HD11 H 4.426 6.179 -0.986 1.00 . A A . 13 LEU HD11 1 1
1 217 1 1 13 LEU HD12 H 3.229 5.191 -0.149 1.00 . A A . 13 LEU HD12 1 1
1 218 1 1 13 LEU HD13 H 3.383 5.093 -1.903 1.00 . A A . 13 LEU HD13 1 1
1 219 1 1 13 LEU HD21 H 7.086 4.104 -0.833 1.00 . A A . 13 LEU HD21 1 1
1 220 1 1 13 LEU HD22 H 6.363 5.612 -1.391 1.00 . A A . 13 LEU HD22 1 1
1 221 1 1 13 LEU HD23 H 6.353 4.191 -2.435 1.00 . A A . 13 LEU HD23 1 1
1 222 1 1 13 LEU HG H 4.594 3.256 -1.377 1.00 . A A . 13 LEU HG 1 1
1 223 1 1 13 LEU N N 6.079 1.628 -0.233 1.00 . A A . 13 LEU N 1 1
1 224 1 1 13 LEU O O 5.290 2.282 3.224 1.00 . A A . 13 LEU O 1 1
1 225 1 1 14 ARG C C 5.947 -0.411 4.040 1.00 . A A . 14 ARG C 1 1
1 226 1 1 14 ARG CA C 4.754 -0.395 3.103 1.00 . A A . 14 ARG CA 1 1
1 227 1 1 14 ARG CB C 4.383 -1.818 2.681 1.00 . A A . 14 ARG CB 1 1
1 228 1 1 14 ARG CD C 5.513 -3.524 4.142 1.00 . A A . 14 ARG CD 1 1
1 229 1 1 14 ARG CG C 4.221 -2.780 3.848 1.00 . A A . 14 ARG CG 1 1
1 230 1 1 14 ARG CZ C 6.757 -5.460 3.264 1.00 . A A . 14 ARG CZ 1 1
1 231 1 1 14 ARG H H 5.340 -0.015 1.125 1.00 . A A . 14 ARG H 1 1
1 232 1 1 14 ARG HA H 3.906 0.085 3.550 1.00 . A A . 14 ARG HA 1 1
1 233 1 1 14 ARG HB2 H 3.448 -1.784 2.144 1.00 . A A . 14 ARG HB2 1 1
1 234 1 1 14 ARG HB3 H 5.152 -2.202 2.031 1.00 . A A . 14 ARG HB3 1 1
1 235 1 1 14 ARG HD2 H 6.346 -2.871 3.926 1.00 . A A . 14 ARG HD2 1 1
1 236 1 1 14 ARG HD3 H 5.529 -3.792 5.188 1.00 . A A . 14 ARG HD3 1 1
1 237 1 1 14 ARG HE H 4.857 -5.030 2.831 1.00 . A A . 14 ARG HE 1 1
1 238 1 1 14 ARG HG2 H 3.932 -2.221 4.726 1.00 . A A . 14 ARG HG2 1 1
1 239 1 1 14 ARG HG3 H 3.449 -3.497 3.606 1.00 . A A . 14 ARG HG3 1 1
1 240 1 1 14 ARG HH11 H 7.823 -4.270 4.505 1.00 . A A . 14 ARG HH11 1 1
1 241 1 1 14 ARG HH12 H 8.676 -5.640 3.878 1.00 . A A . 14 ARG HH12 1 1
1 242 1 1 14 ARG HH21 H 5.977 -6.835 2.006 1.00 . A A . 14 ARG HH21 1 1
1 243 1 1 14 ARG HH22 H 7.628 -7.096 2.459 1.00 . A A . 14 ARG HH22 1 1
1 244 1 1 14 ARG N N 5.178 0.411 1.986 1.00 . A A . 14 ARG N 1 1
1 245 1 1 14 ARG NE N 5.642 -4.738 3.339 1.00 . A A . 14 ARG NE 1 1
1 246 1 1 14 ARG NH1 N 7.840 -5.093 3.937 1.00 . A A . 14 ARG NH1 1 1
1 247 1 1 14 ARG NH2 N 6.790 -6.554 2.515 1.00 . A A . 14 ARG NH2 1 1
1 248 1 1 14 ARG O O 5.833 -0.333 5.263 1.00 . A A . 14 ARG O 1 1
1 249 1 1 15 CYS C C 8.891 1.009 4.171 1.00 . A A . 15 CYS C 1 1
1 250 1 1 15 CYS CA C 8.408 -0.436 4.033 1.00 . A A . 15 CYS CA 1 1
1 251 1 1 15 CYS CB C 9.413 -1.223 3.196 1.00 . A A . 15 CYS CB 1 1
1 252 1 1 15 CYS H H 7.086 -0.495 2.398 1.00 . A A . 15 CYS H 1 1
1 253 1 1 15 CYS HA H 8.317 -0.885 5.010 1.00 . A A . 15 CYS HA 1 1
1 254 1 1 15 CYS HB2 H 8.919 -1.576 2.306 1.00 . A A . 15 CYS HB2 1 1
1 255 1 1 15 CYS HB3 H 10.220 -0.567 2.908 1.00 . A A . 15 CYS HB3 1 1
1 256 1 1 15 CYS HG H 9.648 -2.784 4.860 1.00 . A A . 15 CYS HG 1 1
1 257 1 1 15 CYS N N 7.111 -0.465 3.383 1.00 . A A . 15 CYS N 1 1
1 258 1 1 15 CYS O O 9.825 1.289 4.923 1.00 . A A . 15 CYS O 1 1
1 259 1 1 15 CYS SG S 10.129 -2.653 4.040 1.00 . A A . 15 CYS SG 1 1
1 260 1 1 16 SER C C 9.242 3.779 4.723 1.00 . A A . 16 SER C 1 1
1 261 1 1 16 SER CA C 8.624 3.338 3.395 1.00 . A A . 16 SER CA 1 1
1 262 1 1 16 SER CB C 7.394 4.212 3.118 1.00 . A A . 16 SER CB 1 1
1 263 1 1 16 SER H H 7.555 1.604 2.802 1.00 . A A . 16 SER H 1 1
1 264 1 1 16 SER HA H 9.328 3.484 2.597 1.00 . A A . 16 SER HA 1 1
1 265 1 1 16 SER HB2 H 7.273 4.330 2.054 1.00 . A A . 16 SER HB2 1 1
1 266 1 1 16 SER HB3 H 6.519 3.743 3.534 1.00 . A A . 16 SER HB3 1 1
1 267 1 1 16 SER HG H 6.738 6.009 3.546 1.00 . A A . 16 SER HG 1 1
1 268 1 1 16 SER N N 8.260 1.914 3.407 1.00 . A A . 16 SER N 1 1
1 269 1 1 16 SER O O 8.533 3.729 5.751 1.00 . A A . 16 SER O 1 1
1 270 1 1 16 SER OXT O 10.429 4.166 4.723 1.00 . A A . 16 SER OXT 1 1
1 271 1 1 16 SER OG O 7.536 5.499 3.697 1.00 . A A . 16 SER OG 1 1
2 272 1 1 1 GLY C C -9.701 0.773 -1.387 1.00 . A A . 1 GLY C 1 1
2 273 1 1 1 GLY CA C -10.932 0.584 -2.252 1.00 . A A . 1 GLY CA 1 1
2 274 1 1 1 GLY H1 H -12.927 0.309 -1.694 1.00 . A A . 1 GLY H1 1 1
2 275 1 1 1 GLY H2 H -12.513 1.924 -1.983 1.00 . A A . 1 GLY H2 1 1
2 276 1 1 1 GLY H3 H -12.009 1.165 -0.559 1.00 . A A . 1 GLY H3 1 1
2 277 1 1 1 GLY HA2 H -11.024 -0.461 -2.505 1.00 . A A . 1 GLY HA2 1 1
2 278 1 1 1 GLY HA3 H -10.809 1.153 -3.162 1.00 . A A . 1 GLY HA3 1 1
2 279 1 1 1 GLY N N -12.182 1.027 -1.575 1.00 . A A . 1 GLY N 1 1
2 280 1 1 1 GLY O O -8.687 1.298 -1.846 1.00 . A A . 1 GLY O 1 1
2 281 1 1 2 ARG C C -7.802 -0.785 0.770 1.00 . A A . 2 ARG C 1 1
2 282 1 1 2 ARG CA C -8.673 0.467 0.798 1.00 . A A . 2 ARG CA 1 1
2 283 1 1 2 ARG CB C -9.188 0.716 2.217 1.00 . A A . 2 ARG CB 1 1
2 284 1 1 2 ARG CD C -10.541 2.686 1.435 1.00 . A A . 2 ARG CD 1 1
2 285 1 1 2 ARG CG C -9.570 2.164 2.483 1.00 . A A . 2 ARG CG 1 1
2 286 1 1 2 ARG CZ C -10.471 3.865 -0.726 1.00 . A A . 2 ARG CZ 1 1
2 287 1 1 2 ARG H H -10.624 -0.067 0.175 1.00 . A A . 2 ARG H 1 1
2 288 1 1 2 ARG HA H -8.076 1.312 0.488 1.00 . A A . 2 ARG HA 1 1
2 289 1 1 2 ARG HB2 H -10.059 0.100 2.384 1.00 . A A . 2 ARG HB2 1 1
2 290 1 1 2 ARG HB3 H -8.419 0.434 2.920 1.00 . A A . 2 ARG HB3 1 1
2 291 1 1 2 ARG HD2 H -11.137 1.862 1.074 1.00 . A A . 2 ARG HD2 1 1
2 292 1 1 2 ARG HD3 H -11.186 3.420 1.895 1.00 . A A . 2 ARG HD3 1 1
2 293 1 1 2 ARG HE H -8.868 3.294 0.317 1.00 . A A . 2 ARG HE 1 1
2 294 1 1 2 ARG HG2 H -10.036 2.231 3.454 1.00 . A A . 2 ARG HG2 1 1
2 295 1 1 2 ARG HG3 H -8.677 2.770 2.466 1.00 . A A . 2 ARG HG3 1 1
2 296 1 1 2 ARG HH11 H -12.335 3.486 -0.037 1.00 . A A . 2 ARG HH11 1 1
2 297 1 1 2 ARG HH12 H -12.260 4.316 -1.554 1.00 . A A . 2 ARG HH12 1 1
2 298 1 1 2 ARG HH21 H -8.767 4.388 -1.678 1.00 . A A . 2 ARG HH21 1 1
2 299 1 1 2 ARG HH22 H -10.234 4.828 -2.488 1.00 . A A . 2 ARG HH22 1 1
2 300 1 1 2 ARG N N -9.789 0.343 -0.132 1.00 . A A . 2 ARG N 1 1
2 301 1 1 2 ARG NE N -9.848 3.301 0.306 1.00 . A A . 2 ARG NE 1 1
2 302 1 1 2 ARG NH1 N -11.798 3.891 -0.777 1.00 . A A . 2 ARG NH1 1 1
2 303 1 1 2 ARG NH2 N -9.766 4.404 -1.711 1.00 . A A . 2 ARG NH2 1 1
2 304 1 1 2 ARG O O -8.311 -1.907 0.778 1.00 . A A . 2 ARG O 1 1
2 305 1 1 3 MET C C -5.817 -2.599 -0.501 1.00 . A A . 3 MET C 1 1
2 306 1 1 3 MET CA C -5.546 -1.699 0.699 1.00 . A A . 3 MET CA 1 1
2 307 1 1 3 MET CB C -5.632 -2.512 1.992 1.00 . A A . 3 MET CB 1 1
2 308 1 1 3 MET CE C -3.975 -0.092 4.819 1.00 . A A . 3 MET CE 1 1
2 309 1 1 3 MET CG C -5.636 -1.658 3.247 1.00 . A A . 3 MET CG 1 1
2 310 1 1 3 MET H H -6.145 0.331 0.725 1.00 . A A . 3 MET H 1 1
2 311 1 1 3 MET HA H -4.552 -1.288 0.608 1.00 . A A . 3 MET HA 1 1
2 312 1 1 3 MET HB2 H -6.541 -3.096 1.976 1.00 . A A . 3 MET HB2 1 1
2 313 1 1 3 MET HB3 H -4.786 -3.182 2.039 1.00 . A A . 3 MET HB3 1 1
2 314 1 1 3 MET HE1 H -4.882 0.446 4.590 1.00 . A A . 3 MET HE1 1 1
2 315 1 1 3 MET HE2 H -3.132 0.417 4.374 1.00 . A A . 3 MET HE2 1 1
2 316 1 1 3 MET HE3 H -3.843 -0.137 5.891 1.00 . A A . 3 MET HE3 1 1
2 317 1 1 3 MET HG2 H -5.807 -0.630 2.964 1.00 . A A . 3 MET HG2 1 1
2 318 1 1 3 MET HG3 H -6.438 -1.990 3.889 1.00 . A A . 3 MET HG3 1 1
2 319 1 1 3 MET N N -6.488 -0.586 0.733 1.00 . A A . 3 MET N 1 1
2 320 1 1 3 MET O O -6.182 -3.765 -0.349 1.00 . A A . 3 MET O 1 1
2 321 1 1 3 MET SD S -4.084 -1.754 4.161 1.00 . A A . 3 MET SD 1 1
2 322 1 1 4 LEU C C -5.268 -2.094 -4.128 1.00 . A A . 4 LEU C 1 1
2 323 1 1 4 LEU CA C -5.854 -2.802 -2.922 1.00 . A A . 4 LEU CA 1 1
2 324 1 1 4 LEU CB C -7.348 -3.070 -3.131 1.00 . A A . 4 LEU CB 1 1
2 325 1 1 4 LEU CD1 C -8.673 -5.116 -2.525 1.00 . A A . 4 LEU CD1 1 1
2 326 1 1 4 LEU CD2 C -8.282 -4.551 -4.929 1.00 . A A . 4 LEU CD2 1 1
2 327 1 1 4 LEU CG C -7.700 -4.508 -3.524 1.00 . A A . 4 LEU CG 1 1
2 328 1 1 4 LEU H H -5.336 -1.116 -1.751 1.00 . A A . 4 LEU H 1 1
2 329 1 1 4 LEU HA H -5.357 -3.724 -2.818 1.00 . A A . 4 LEU HA 1 1
2 330 1 1 4 LEU HB2 H -7.866 -2.830 -2.213 1.00 . A A . 4 LEU HB2 1 1
2 331 1 1 4 LEU HB3 H -7.706 -2.409 -3.907 1.00 . A A . 4 LEU HB3 1 1
2 332 1 1 4 LEU HD11 H -9.275 -5.864 -3.018 1.00 . A A . 4 LEU HD11 1 1
2 333 1 1 4 LEU HD12 H -9.313 -4.342 -2.128 1.00 . A A . 4 LEU HD12 1 1
2 334 1 1 4 LEU HD13 H -8.119 -5.574 -1.718 1.00 . A A . 4 LEU HD13 1 1
2 335 1 1 4 LEU HD21 H -7.979 -5.464 -5.418 1.00 . A A . 4 LEU HD21 1 1
2 336 1 1 4 LEU HD22 H -7.921 -3.704 -5.495 1.00 . A A . 4 LEU HD22 1 1
2 337 1 1 4 LEU HD23 H -9.360 -4.513 -4.873 1.00 . A A . 4 LEU HD23 1 1
2 338 1 1 4 LEU HG H -6.799 -5.105 -3.517 1.00 . A A . 4 LEU HG 1 1
2 339 1 1 4 LEU N N -5.632 -2.048 -1.695 1.00 . A A . 4 LEU N 1 1
2 340 1 1 4 LEU O O -4.478 -2.665 -4.881 1.00 . A A . 4 LEU O 1 1
2 341 1 1 5 PRO C C -3.855 0.609 -5.155 1.00 . A A . 5 PRO C 1 1
2 342 1 1 5 PRO CA C -5.212 -0.018 -5.446 1.00 . A A . 5 PRO CA 1 1
2 343 1 1 5 PRO CB C -6.330 1.040 -5.535 1.00 . A A . 5 PRO CB 1 1
2 344 1 1 5 PRO CD C -6.600 -0.107 -3.504 1.00 . A A . 5 PRO CD 1 1
2 345 1 1 5 PRO CG C -7.375 0.555 -4.575 1.00 . A A . 5 PRO CG 1 1
2 346 1 1 5 PRO HA H -5.164 -0.581 -6.366 1.00 . A A . 5 PRO HA 1 1
2 347 1 1 5 PRO HB2 H -5.941 2.007 -5.246 1.00 . A A . 5 PRO HB2 1 1
2 348 1 1 5 PRO HB3 H -6.711 1.085 -6.544 1.00 . A A . 5 PRO HB3 1 1
2 349 1 1 5 PRO HD2 H -6.101 0.620 -2.879 1.00 . A A . 5 PRO HD2 1 1
2 350 1 1 5 PRO HD3 H -7.215 -0.773 -2.921 1.00 . A A . 5 PRO HD3 1 1
2 351 1 1 5 PRO HG2 H -7.946 1.375 -4.181 1.00 . A A . 5 PRO HG2 1 1
2 352 1 1 5 PRO HG3 H -8.012 -0.173 -5.055 1.00 . A A . 5 PRO HG3 1 1
2 353 1 1 5 PRO N N -5.661 -0.844 -4.330 1.00 . A A . 5 PRO N 1 1
2 354 1 1 5 PRO O O -3.171 1.096 -6.055 1.00 . A A . 5 PRO O 1 1
2 355 1 1 6 GLN C C -1.449 0.075 -2.584 1.00 . A A . 6 GLN C 1 1
2 356 1 1 6 GLN CA C -2.193 1.101 -3.441 1.00 . A A . 6 GLN CA 1 1
2 357 1 1 6 GLN CB C -2.407 2.390 -2.645 1.00 . A A . 6 GLN CB 1 1
2 358 1 1 6 GLN CD C -1.312 4.349 -1.487 1.00 . A A . 6 GLN CD 1 1
2 359 1 1 6 GLN CG C -1.150 3.230 -2.498 1.00 . A A . 6 GLN CG 1 1
2 360 1 1 6 GLN H H -4.062 0.154 -3.222 1.00 . A A . 6 GLN H 1 1
2 361 1 1 6 GLN HA H -1.602 1.322 -4.317 1.00 . A A . 6 GLN HA 1 1
2 362 1 1 6 GLN HB2 H -3.157 2.987 -3.144 1.00 . A A . 6 GLN HB2 1 1
2 363 1 1 6 GLN HB3 H -2.762 2.134 -1.658 1.00 . A A . 6 GLN HB3 1 1
2 364 1 1 6 GLN HE21 H -2.867 5.068 -2.495 1.00 . A A . 6 GLN HE21 1 1
2 365 1 1 6 GLN HE22 H -2.431 5.937 -1.066 1.00 . A A . 6 GLN HE22 1 1
2 366 1 1 6 GLN HG2 H -0.341 2.591 -2.177 1.00 . A A . 6 GLN HG2 1 1
2 367 1 1 6 GLN HG3 H -0.907 3.663 -3.457 1.00 . A A . 6 GLN HG3 1 1
2 368 1 1 6 GLN N N -3.471 0.568 -3.883 1.00 . A A . 6 GLN N 1 1
2 369 1 1 6 GLN NE2 N -2.303 5.205 -1.705 1.00 . A A . 6 GLN NE2 1 1
2 370 1 1 6 GLN O O -0.362 0.352 -2.080 1.00 . A A . 6 GLN O 1 1
2 371 1 1 6 GLN OE1 O -0.555 4.442 -0.521 1.00 . A A . 6 GLN OE1 1 1
2 372 1 1 7 LEU C C -0.081 -2.584 -2.195 1.00 . A A . 7 LEU C 1 1
2 373 1 1 7 LEU CA C -1.430 -2.169 -1.620 1.00 . A A . 7 LEU CA 1 1
2 374 1 1 7 LEU CB C -2.365 -3.379 -1.553 1.00 . A A . 7 LEU CB 1 1
2 375 1 1 7 LEU CD1 C -2.961 -5.405 -0.207 1.00 . A A . 7 LEU CD1 1 1
2 376 1 1 7 LEU CD2 C -0.950 -5.441 -1.698 1.00 . A A . 7 LEU CD2 1 1
2 377 1 1 7 LEU CG C -1.819 -4.585 -0.788 1.00 . A A . 7 LEU CG 1 1
2 378 1 1 7 LEU H H -2.910 -1.282 -2.842 1.00 . A A . 7 LEU H 1 1
2 379 1 1 7 LEU HA H -1.280 -1.787 -0.627 1.00 . A A . 7 LEU HA 1 1
2 380 1 1 7 LEU HB2 H -3.287 -3.067 -1.083 1.00 . A A . 7 LEU HB2 1 1
2 381 1 1 7 LEU HB3 H -2.586 -3.692 -2.563 1.00 . A A . 7 LEU HB3 1 1
2 382 1 1 7 LEU HD11 H -3.154 -5.087 0.807 1.00 . A A . 7 LEU HD11 1 1
2 383 1 1 7 LEU HD12 H -2.691 -6.451 -0.211 1.00 . A A . 7 LEU HD12 1 1
2 384 1 1 7 LEU HD13 H -3.848 -5.260 -0.804 1.00 . A A . 7 LEU HD13 1 1
2 385 1 1 7 LEU HD21 H -1.108 -6.485 -1.469 1.00 . A A . 7 LEU HD21 1 1
2 386 1 1 7 LEU HD22 H 0.090 -5.192 -1.541 1.00 . A A . 7 LEU HD22 1 1
2 387 1 1 7 LEU HD23 H -1.213 -5.255 -2.729 1.00 . A A . 7 LEU HD23 1 1
2 388 1 1 7 LEU HG H -1.207 -4.236 0.031 1.00 . A A . 7 LEU HG 1 1
2 389 1 1 7 LEU N N -2.041 -1.112 -2.419 1.00 . A A . 7 LEU N 1 1
2 390 1 1 7 LEU O O 0.804 -3.042 -1.470 1.00 . A A . 7 LEU O 1 1
2 391 1 1 8 VAL C C 2.281 -1.596 -4.137 1.00 . A A . 8 VAL C 1 1
2 392 1 1 8 VAL CA C 1.313 -2.759 -4.179 1.00 . A A . 8 VAL CA 1 1
2 393 1 1 8 VAL CB C 1.062 -3.157 -5.645 1.00 . A A . 8 VAL CB 1 1
2 394 1 1 8 VAL CG1 C 2.335 -3.700 -6.278 1.00 . A A . 8 VAL CG1 1 1
2 395 1 1 8 VAL CG2 C -0.062 -4.177 -5.736 1.00 . A A . 8 VAL CG2 1 1
2 396 1 1 8 VAL H H -0.664 -2.030 -4.016 1.00 . A A . 8 VAL H 1 1
2 397 1 1 8 VAL HA H 1.751 -3.593 -3.669 1.00 . A A . 8 VAL HA 1 1
2 398 1 1 8 VAL HB H 0.764 -2.274 -6.190 1.00 . A A . 8 VAL HB 1 1
2 399 1 1 8 VAL HG11 H 2.123 -4.035 -7.282 1.00 . A A . 8 VAL HG11 1 1
2 400 1 1 8 VAL HG12 H 2.704 -4.529 -5.693 1.00 . A A . 8 VAL HG12 1 1
2 401 1 1 8 VAL HG13 H 3.083 -2.920 -6.308 1.00 . A A . 8 VAL HG13 1 1
2 402 1 1 8 VAL HG21 H 0.139 -4.866 -6.542 1.00 . A A . 8 VAL HG21 1 1
2 403 1 1 8 VAL HG22 H -0.996 -3.666 -5.925 1.00 . A A . 8 VAL HG22 1 1
2 404 1 1 8 VAL HG23 H -0.132 -4.720 -4.806 1.00 . A A . 8 VAL HG23 1 1
2 405 1 1 8 VAL N N 0.072 -2.411 -3.500 1.00 . A A . 8 VAL N 1 1
2 406 1 1 8 VAL O O 3.344 -1.663 -3.514 1.00 . A A . 8 VAL O 1 1
2 407 1 1 9 CYS C C 3.076 1.068 -3.393 1.00 . A A . 9 CYS C 1 1
2 408 1 1 9 CYS CA C 2.722 0.676 -4.809 1.00 . A A . 9 CYS CA 1 1
2 409 1 1 9 CYS CB C 2.013 1.824 -5.528 1.00 . A A . 9 CYS CB 1 1
2 410 1 1 9 CYS H H 1.037 -0.523 -5.249 1.00 . A A . 9 CYS H 1 1
2 411 1 1 9 CYS HA H 3.639 0.434 -5.324 1.00 . A A . 9 CYS HA 1 1
2 412 1 1 9 CYS HB2 H 0.958 1.786 -5.299 1.00 . A A . 9 CYS HB2 1 1
2 413 1 1 9 CYS HB3 H 2.417 2.763 -5.179 1.00 . A A . 9 CYS HB3 1 1
2 414 1 1 9 CYS HG H 2.296 0.872 -7.595 1.00 . A A . 9 CYS HG 1 1
2 415 1 1 9 CYS N N 1.897 -0.517 -4.788 1.00 . A A . 9 CYS N 1 1
2 416 1 1 9 CYS O O 4.211 1.475 -3.115 1.00 . A A . 9 CYS O 1 1
2 417 1 1 9 CYS SG S 2.185 1.787 -7.327 1.00 . A A . 9 CYS SG 1 1
2 418 1 1 10 ARG C C 3.481 0.216 -0.626 1.00 . A A . 10 ARG C 1 1
2 419 1 1 10 ARG CA C 2.471 1.212 -1.101 1.00 . A A . 10 ARG CA 1 1
2 420 1 1 10 ARG CB C 1.302 1.258 -0.137 1.00 . A A . 10 ARG CB 1 1
2 421 1 1 10 ARG CD C 0.946 1.278 2.358 1.00 . A A . 10 ARG CD 1 1
2 422 1 1 10 ARG CG C 1.722 1.872 1.193 1.00 . A A . 10 ARG CG 1 1
2 423 1 1 10 ARG CZ C 0.760 -0.867 3.557 1.00 . A A . 10 ARG CZ 1 1
2 424 1 1 10 ARG H H 1.255 0.532 -2.701 1.00 . A A . 10 ARG H 1 1
2 425 1 1 10 ARG HA H 2.944 2.177 -1.111 1.00 . A A . 10 ARG HA 1 1
2 426 1 1 10 ARG HB2 H 0.507 1.853 -0.565 1.00 . A A . 10 ARG HB2 1 1
2 427 1 1 10 ARG HB3 H 0.946 0.255 0.044 1.00 . A A . 10 ARG HB3 1 1
2 428 1 1 10 ARG HD2 H 1.077 1.914 3.220 1.00 . A A . 10 ARG HD2 1 1
2 429 1 1 10 ARG HD3 H -0.100 1.246 2.093 1.00 . A A . 10 ARG HD3 1 1
2 430 1 1 10 ARG HE H 2.203 -0.406 2.256 1.00 . A A . 10 ARG HE 1 1
2 431 1 1 10 ARG HG2 H 2.792 1.697 1.343 1.00 . A A . 10 ARG HG2 1 1
2 432 1 1 10 ARG HG3 H 1.543 2.937 1.155 1.00 . A A . 10 ARG HG3 1 1
2 433 1 1 10 ARG HH11 H -0.693 0.472 3.993 1.00 . A A . 10 ARG HH11 1 1
2 434 1 1 10 ARG HH12 H -0.810 -1.045 4.820 1.00 . A A . 10 ARG HH12 1 1
2 435 1 1 10 ARG HH21 H 2.050 -2.409 3.346 1.00 . A A . 10 ARG HH21 1 1
2 436 1 1 10 ARG HH22 H 0.748 -2.680 4.453 1.00 . A A . 10 ARG HH22 1 1
2 437 1 1 10 ARG N N 2.137 0.900 -2.465 1.00 . A A . 10 ARG N 1 1
2 438 1 1 10 ARG NE N 1.393 -0.072 2.694 1.00 . A A . 10 ARG NE 1 1
2 439 1 1 10 ARG NH1 N -0.338 -0.445 4.174 1.00 . A A . 10 ARG NH1 1 1
2 440 1 1 10 ARG NH2 N 1.224 -2.085 3.805 1.00 . A A . 10 ARG NH2 1 1
2 441 1 1 10 ARG O O 4.466 0.602 -0.081 1.00 . A A . 10 ARG O 1 1
2 442 1 1 11 LEU C C 5.570 -1.548 -0.558 1.00 . A A . 11 LEU C 1 1
2 443 1 1 11 LEU CA C 4.187 -2.126 -0.547 1.00 . A A . 11 LEU CA 1 1
2 444 1 1 11 LEU CB C 4.084 -3.303 -1.522 1.00 . A A . 11 LEU CB 1 1
2 445 1 1 11 LEU CD1 C 3.890 -5.773 -1.903 1.00 . A A . 11 LEU CD1 1 1
2 446 1 1 11 LEU CD2 C 5.608 -4.889 -0.316 1.00 . A A . 11 LEU CD2 1 1
2 447 1 1 11 LEU CG C 4.212 -4.689 -0.886 1.00 . A A . 11 LEU CG 1 1
2 448 1 1 11 LEU H H 2.481 -1.284 -1.381 1.00 . A A . 11 LEU H 1 1
2 449 1 1 11 LEU HA H 3.955 -2.457 0.442 1.00 . A A . 11 LEU HA 1 1
2 450 1 1 11 LEU HB2 H 3.127 -3.247 -2.020 1.00 . A A . 11 LEU HB2 1 1
2 451 1 1 11 LEU HB3 H 4.862 -3.200 -2.264 1.00 . A A . 11 LEU HB3 1 1
2 452 1 1 11 LEU HD11 H 2.820 -5.845 -2.026 1.00 . A A . 11 LEU HD11 1 1
2 453 1 1 11 LEU HD12 H 4.277 -6.720 -1.556 1.00 . A A . 11 LEU HD12 1 1
2 454 1 1 11 LEU HD13 H 4.345 -5.524 -2.851 1.00 . A A . 11 LEU HD13 1 1
2 455 1 1 11 LEU HD21 H 6.248 -5.320 -1.073 1.00 . A A . 11 LEU HD21 1 1
2 456 1 1 11 LEU HD22 H 5.559 -5.555 0.533 1.00 . A A . 11 LEU HD22 1 1
2 457 1 1 11 LEU HD23 H 6.011 -3.937 -0.003 1.00 . A A . 11 LEU HD23 1 1
2 458 1 1 11 LEU HG H 3.504 -4.772 -0.075 1.00 . A A . 11 LEU HG 1 1
2 459 1 1 11 LEU N N 3.255 -1.064 -0.904 1.00 . A A . 11 LEU N 1 1
2 460 1 1 11 LEU O O 6.373 -1.764 0.357 1.00 . A A . 11 LEU O 1 1
2 461 1 1 12 VAL C C 7.106 0.872 -0.369 1.00 . A A . 12 VAL C 1 1
2 462 1 1 12 VAL CA C 7.055 -0.015 -1.599 1.00 . A A . 12 VAL CA 1 1
2 463 1 1 12 VAL CB C 7.225 0.826 -2.877 1.00 . A A . 12 VAL CB 1 1
2 464 1 1 12 VAL CG1 C 8.651 1.340 -2.992 1.00 . A A . 12 VAL CG1 1 1
2 465 1 1 12 VAL CG2 C 6.841 0.015 -4.105 1.00 . A A . 12 VAL CG2 1 1
2 466 1 1 12 VAL H H 5.096 -0.509 -2.213 1.00 . A A . 12 VAL H 1 1
2 467 1 1 12 VAL HA H 7.813 -0.748 -1.539 1.00 . A A . 12 VAL HA 1 1
2 468 1 1 12 VAL HB H 6.564 1.677 -2.813 1.00 . A A . 12 VAL HB 1 1
2 469 1 1 12 VAL HG11 H 8.759 2.239 -2.402 1.00 . A A . 12 VAL HG11 1 1
2 470 1 1 12 VAL HG12 H 8.873 1.559 -4.026 1.00 . A A . 12 VAL HG12 1 1
2 471 1 1 12 VAL HG13 H 9.335 0.588 -2.629 1.00 . A A . 12 VAL HG13 1 1
2 472 1 1 12 VAL HG21 H 5.788 -0.225 -4.064 1.00 . A A . 12 VAL HG21 1 1
2 473 1 1 12 VAL HG22 H 7.418 -0.898 -4.128 1.00 . A A . 12 VAL HG22 1 1
2 474 1 1 12 VAL HG23 H 7.045 0.591 -4.996 1.00 . A A . 12 VAL HG23 1 1
2 475 1 1 12 VAL N N 5.807 -0.709 -1.553 1.00 . A A . 12 VAL N 1 1
2 476 1 1 12 VAL O O 8.038 0.825 0.439 1.00 . A A . 12 VAL O 1 1
2 477 1 1 13 LEU C C 5.402 1.681 2.180 1.00 . A A . 13 LEU C 1 1
2 478 1 1 13 LEU CA C 5.896 2.477 0.966 1.00 . A A . 13 LEU CA 1 1
2 479 1 1 13 LEU CB C 5.017 3.695 0.717 1.00 . A A . 13 LEU CB 1 1
2 480 1 1 13 LEU CD1 C 3.698 5.106 -0.882 1.00 . A A . 13 LEU CD1 1 1
2 481 1 1 13 LEU CD2 C 6.115 4.648 -1.327 1.00 . A A . 13 LEU CD2 1 1
2 482 1 1 13 LEU CG C 4.822 4.091 -0.750 1.00 . A A . 13 LEU CG 1 1
2 483 1 1 13 LEU H H 5.309 1.580 -0.860 1.00 . A A . 13 LEU H 1 1
2 484 1 1 13 LEU HA H 6.870 2.818 1.195 1.00 . A A . 13 LEU HA 1 1
2 485 1 1 13 LEU HB2 H 4.049 3.514 1.157 1.00 . A A . 13 LEU HB2 1 1
2 486 1 1 13 LEU HB3 H 5.481 4.527 1.232 1.00 . A A . 13 LEU HB3 1 1
2 487 1 1 13 LEU HD11 H 3.918 5.781 -1.697 1.00 . A A . 13 LEU HD11 1 1
2 488 1 1 13 LEU HD12 H 3.610 5.667 0.037 1.00 . A A . 13 LEU HD12 1 1
2 489 1 1 13 LEU HD13 H 2.770 4.592 -1.081 1.00 . A A . 13 LEU HD13 1 1
2 490 1 1 13 LEU HD21 H 6.049 4.671 -2.404 1.00 . A A . 13 LEU HD21 1 1
2 491 1 1 13 LEU HD22 H 6.942 4.019 -1.030 1.00 . A A . 13 LEU HD22 1 1
2 492 1 1 13 LEU HD23 H 6.272 5.650 -0.955 1.00 . A A . 13 LEU HD23 1 1
2 493 1 1 13 LEU HG H 4.549 3.217 -1.321 1.00 . A A . 13 LEU HG 1 1
2 494 1 1 13 LEU N N 6.036 1.630 -0.200 1.00 . A A . 13 LEU N 1 1
2 495 1 1 13 LEU O O 5.269 2.230 3.274 1.00 . A A . 13 LEU O 1 1
2 496 1 1 14 ARG C C 6.001 -0.426 4.059 1.00 . A A . 14 ARG C 1 1
2 497 1 1 14 ARG CA C 4.804 -0.456 3.128 1.00 . A A . 14 ARG CA 1 1
2 498 1 1 14 ARG CB C 4.496 -1.891 2.694 1.00 . A A . 14 ARG CB 1 1
2 499 1 1 14 ARG CD C 5.847 -3.519 4.045 1.00 . A A . 14 ARG CD 1 1
2 500 1 1 14 ARG CG C 4.479 -2.888 3.841 1.00 . A A . 14 ARG CG 1 1
2 501 1 1 14 ARG CZ C 7.007 -5.628 3.523 1.00 . A A . 14 ARG CZ 1 1
2 502 1 1 14 ARG H H 5.357 -0.042 1.148 1.00 . A A . 14 ARG H 1 1
2 503 1 1 14 ARG HA H 3.937 -0.015 3.579 1.00 . A A . 14 ARG HA 1 1
2 504 1 1 14 ARG HB2 H 3.526 -1.907 2.220 1.00 . A A . 14 ARG HB2 1 1
2 505 1 1 14 ARG HB3 H 5.240 -2.208 1.984 1.00 . A A . 14 ARG HB3 1 1
2 506 1 1 14 ARG HD2 H 6.587 -2.915 3.539 1.00 . A A . 14 ARG HD2 1 1
2 507 1 1 14 ARG HD3 H 6.065 -3.541 5.103 1.00 . A A . 14 ARG HD3 1 1
2 508 1 1 14 ARG HE H 5.084 -5.255 3.142 1.00 . A A . 14 ARG HE 1 1
2 509 1 1 14 ARG HG2 H 4.190 -2.377 4.747 1.00 . A A . 14 ARG HG2 1 1
2 510 1 1 14 ARG HG3 H 3.764 -3.666 3.619 1.00 . A A . 14 ARG HG3 1 1
2 511 1 1 14 ARG HH11 H 8.171 -4.229 4.405 1.00 . A A . 14 ARG HH11 1 1
2 512 1 1 14 ARG HH12 H 8.963 -5.722 4.027 1.00 . A A . 14 ARG HH12 1 1
2 513 1 1 14 ARG HH21 H 6.125 -7.219 2.644 1.00 . A A . 14 ARG HH21 1 1
2 514 1 1 14 ARG HH22 H 7.802 -7.419 3.027 1.00 . A A . 14 ARG HH22 1 1
2 515 1 1 14 ARG N N 5.192 0.371 2.016 1.00 . A A . 14 ARG N 1 1
2 516 1 1 14 ARG NE N 5.907 -4.880 3.519 1.00 . A A . 14 ARG NE 1 1
2 517 1 1 14 ARG NH1 N 8.140 -5.154 4.026 1.00 . A A . 14 ARG NH1 1 1
2 518 1 1 14 ARG NH2 N 6.975 -6.857 3.024 1.00 . A A . 14 ARG NH2 1 1
2 519 1 1 14 ARG O O 5.891 -0.324 5.281 1.00 . A A . 14 ARG O 1 1
2 520 1 1 15 CYS C C 8.928 1.058 4.138 1.00 . A A . 15 CYS C 1 1
2 521 1 1 15 CYS CA C 8.463 -0.397 4.035 1.00 . A A . 15 CYS CA 1 1
2 522 1 1 15 CYS CB C 9.474 -1.183 3.204 1.00 . A A . 15 CYS CB 1 1
2 523 1 1 15 CYS H H 7.130 -0.520 2.412 1.00 . A A . 15 CYS H 1 1
2 524 1 1 15 CYS HA H 8.391 -0.827 5.020 1.00 . A A . 15 CYS HA 1 1
2 525 1 1 15 CYS HB2 H 8.975 -1.575 2.334 1.00 . A A . 15 CYS HB2 1 1
2 526 1 1 15 CYS HB3 H 10.258 -0.515 2.880 1.00 . A A . 15 CYS HB3 1 1
2 527 1 1 15 CYS HG H 9.895 -2.587 4.968 1.00 . A A . 15 CYS HG 1 1
2 528 1 1 15 CYS N N 7.161 -0.467 3.396 1.00 . A A . 15 CYS N 1 1
2 529 1 1 15 CYS O O 9.875 1.362 4.862 1.00 . A A . 15 CYS O 1 1
2 530 1 1 15 CYS SG S 10.244 -2.568 4.075 1.00 . A A . 15 CYS SG 1 1
2 531 1 1 16 SER C C 9.265 3.844 4.629 1.00 . A A . 16 SER C 1 1
2 532 1 1 16 SER CA C 8.626 3.369 3.325 1.00 . A A . 16 SER CA 1 1
2 533 1 1 16 SER CB C 7.396 4.235 3.045 1.00 . A A . 16 SER CB 1 1
2 534 1 1 16 SER H H 7.561 1.615 2.784 1.00 . A A . 16 SER H 1 1
2 535 1 1 16 SER HA H 9.316 3.499 2.512 1.00 . A A . 16 SER HA 1 1
2 536 1 1 16 SER HB2 H 6.517 3.620 3.032 1.00 . A A . 16 SER HB2 1 1
2 537 1 1 16 SER HB3 H 7.298 4.981 3.820 1.00 . A A . 16 SER HB3 1 1
2 538 1 1 16 SER HG H 7.120 5.768 1.855 1.00 . A A . 16 SER HG 1 1
2 539 1 1 16 SER N N 8.273 1.942 3.370 1.00 . A A . 16 SER N 1 1
2 540 1 1 16 SER O O 8.559 3.867 5.660 1.00 . A A . 16 SER O 1 1
2 541 1 1 16 SER OXT O 10.465 4.189 4.607 1.00 . A A . 16 SER OXT 1 1
2 542 1 1 16 SER OG O 7.513 4.893 1.795 1.00 . A A . 16 SER OG 1 1
3 543 1 1 1 GLY C C -9.666 0.132 -3.595 1.00 . A A . 1 GLY C 1 1
3 544 1 1 1 GLY CA C -10.287 -0.330 -4.899 1.00 . A A . 1 GLY CA 1 1
3 545 1 1 1 GLY H1 H -10.602 0.360 -6.845 1.00 . A A . 1 GLY H1 1 1
3 546 1 1 1 GLY H2 H -9.420 1.221 -5.996 1.00 . A A . 1 GLY H2 1 1
3 547 1 1 1 GLY H3 H -11.056 1.463 -5.645 1.00 . A A . 1 GLY H3 1 1
3 548 1 1 1 GLY HA2 H -11.291 -0.679 -4.703 1.00 . A A . 1 GLY HA2 1 1
3 549 1 1 1 GLY HA3 H -9.704 -1.148 -5.293 1.00 . A A . 1 GLY HA3 1 1
3 550 1 1 1 GLY N N -10.346 0.755 -5.918 1.00 . A A . 1 GLY N 1 1
3 551 1 1 1 GLY O O -8.810 1.016 -3.588 1.00 . A A . 1 GLY O 1 1
3 552 1 1 2 ARG C C -8.672 -1.214 -0.635 1.00 . A A . 2 ARG C 1 1
3 553 1 1 2 ARG CA C -9.578 -0.113 -1.175 1.00 . A A . 2 ARG CA 1 1
3 554 1 1 2 ARG CB C -10.731 0.141 -0.200 1.00 . A A . 2 ARG CB 1 1
3 555 1 1 2 ARG CD C -11.596 2.164 -1.416 1.00 . A A . 2 ARG CD 1 1
3 556 1 1 2 ARG CG C -11.118 1.606 -0.085 1.00 . A A . 2 ARG CG 1 1
3 557 1 1 2 ARG CZ C -9.983 4.006 -1.695 1.00 . A A . 2 ARG CZ 1 1
3 558 1 1 2 ARG H H -10.783 -1.166 -2.562 1.00 . A A . 2 ARG H 1 1
3 559 1 1 2 ARG HA H -9.002 0.793 -1.281 1.00 . A A . 2 ARG HA 1 1
3 560 1 1 2 ARG HB2 H -11.597 -0.412 -0.533 1.00 . A A . 2 ARG HB2 1 1
3 561 1 1 2 ARG HB3 H -10.444 -0.212 0.779 1.00 . A A . 2 ARG HB3 1 1
3 562 1 1 2 ARG HD2 H -11.942 1.346 -2.030 1.00 . A A . 2 ARG HD2 1 1
3 563 1 1 2 ARG HD3 H -12.412 2.846 -1.233 1.00 . A A . 2 ARG HD3 1 1
3 564 1 1 2 ARG HE H -10.215 2.486 -2.967 1.00 . A A . 2 ARG HE 1 1
3 565 1 1 2 ARG HG2 H -11.912 1.703 0.640 1.00 . A A . 2 ARG HG2 1 1
3 566 1 1 2 ARG HG3 H -10.256 2.171 0.244 1.00 . A A . 2 ARG HG3 1 1
3 567 1 1 2 ARG HH11 H -11.113 4.127 -0.021 1.00 . A A . 2 ARG HH11 1 1
3 568 1 1 2 ARG HH12 H -9.972 5.411 -0.241 1.00 . A A . 2 ARG HH12 1 1
3 569 1 1 2 ARG HH21 H -8.713 4.173 -3.257 1.00 . A A . 2 ARG HH21 1 1
3 570 1 1 2 ARG HH22 H -8.609 5.437 -2.078 1.00 . A A . 2 ARG HH22 1 1
3 571 1 1 2 ARG N N -10.098 -0.468 -2.491 1.00 . A A . 2 ARG N 1 1
3 572 1 1 2 ARG NE N -10.534 2.873 -2.126 1.00 . A A . 2 ARG NE 1 1
3 573 1 1 2 ARG NH1 N -10.390 4.560 -0.560 1.00 . A A . 2 ARG NH1 1 1
3 574 1 1 2 ARG NH2 N -9.023 4.586 -2.401 1.00 . A A . 2 ARG NH2 1 1
3 575 1 1 2 ARG O O -9.071 -2.375 -0.550 1.00 . A A . 2 ARG O 1 1
3 576 1 1 3 MET C C -6.204 -2.906 -0.750 1.00 . A A . 3 MET C 1 1
3 577 1 1 3 MET CA C -6.484 -1.797 0.260 1.00 . A A . 3 MET CA 1 1
3 578 1 1 3 MET CB C -7.000 -2.399 1.569 1.00 . A A . 3 MET CB 1 1
3 579 1 1 3 MET CE C -8.639 -1.971 5.004 1.00 . A A . 3 MET CE 1 1
3 580 1 1 3 MET CG C -7.399 -1.358 2.602 1.00 . A A . 3 MET CG 1 1
3 581 1 1 3 MET H H -7.188 0.099 -0.363 1.00 . A A . 3 MET H 1 1
3 582 1 1 3 MET HA H -5.565 -1.266 0.457 1.00 . A A . 3 MET HA 1 1
3 583 1 1 3 MET HB2 H -7.863 -3.013 1.353 1.00 . A A . 3 MET HB2 1 1
3 584 1 1 3 MET HB3 H -6.227 -3.020 1.996 1.00 . A A . 3 MET HB3 1 1
3 585 1 1 3 MET HE1 H -8.730 -3.028 5.203 1.00 . A A . 3 MET HE1 1 1
3 586 1 1 3 MET HE2 H -9.317 -1.425 5.642 1.00 . A A . 3 MET HE2 1 1
3 587 1 1 3 MET HE3 H -7.625 -1.654 5.201 1.00 . A A . 3 MET HE3 1 1
3 588 1 1 3 MET HG2 H -6.680 -1.376 3.407 1.00 . A A . 3 MET HG2 1 1
3 589 1 1 3 MET HG3 H -7.388 -0.385 2.132 1.00 . A A . 3 MET HG3 1 1
3 590 1 1 3 MET N N -7.449 -0.842 -0.271 1.00 . A A . 3 MET N 1 1
3 591 1 1 3 MET O O -6.554 -4.066 -0.529 1.00 . A A . 3 MET O 1 1
3 592 1 1 3 MET SD S -9.042 -1.649 3.289 1.00 . A A . 3 MET SD 1 1
3 593 1 1 4 LEU C C -4.548 -2.838 -4.081 1.00 . A A . 4 LEU C 1 1
3 594 1 1 4 LEU CA C -5.241 -3.504 -2.906 1.00 . A A . 4 LEU CA 1 1
3 595 1 1 4 LEU CB C -6.498 -4.239 -3.385 1.00 . A A . 4 LEU CB 1 1
3 596 1 1 4 LEU CD1 C -5.231 -5.997 -4.645 1.00 . A A . 4 LEU CD1 1 1
3 597 1 1 4 LEU CD2 C -6.000 -6.448 -2.309 1.00 . A A . 4 LEU CD2 1 1
3 598 1 1 4 LEU CG C -6.322 -5.741 -3.617 1.00 . A A . 4 LEU CG 1 1
3 599 1 1 4 LEU H H -5.314 -1.601 -1.977 1.00 . A A . 4 LEU H 1 1
3 600 1 1 4 LEU HA H -4.572 -4.204 -2.493 1.00 . A A . 4 LEU HA 1 1
3 601 1 1 4 LEU HB2 H -7.274 -4.099 -2.646 1.00 . A A . 4 LEU HB2 1 1
3 602 1 1 4 LEU HB3 H -6.822 -3.791 -4.311 1.00 . A A . 4 LEU HB3 1 1
3 603 1 1 4 LEU HD11 H -4.390 -5.349 -4.448 1.00 . A A . 4 LEU HD11 1 1
3 604 1 1 4 LEU HD12 H -5.615 -5.795 -5.635 1.00 . A A . 4 LEU HD12 1 1
3 605 1 1 4 LEU HD13 H -4.914 -7.028 -4.586 1.00 . A A . 4 LEU HD13 1 1
3 606 1 1 4 LEU HD21 H -6.780 -6.246 -1.590 1.00 . A A . 4 LEU HD21 1 1
3 607 1 1 4 LEU HD22 H -5.057 -6.086 -1.927 1.00 . A A . 4 LEU HD22 1 1
3 608 1 1 4 LEU HD23 H -5.934 -7.511 -2.481 1.00 . A A . 4 LEU HD23 1 1
3 609 1 1 4 LEU HG H -7.245 -6.151 -4.001 1.00 . A A . 4 LEU HG 1 1
3 610 1 1 4 LEU N N -5.570 -2.541 -1.860 1.00 . A A . 4 LEU N 1 1
3 611 1 1 4 LEU O O -3.494 -3.283 -4.535 1.00 . A A . 4 LEU O 1 1
3 612 1 1 5 PRO C C -3.531 -0.064 -5.317 1.00 . A A . 5 PRO C 1 1
3 613 1 1 5 PRO CA C -4.638 -1.021 -5.737 1.00 . A A . 5 PRO CA 1 1
3 614 1 1 5 PRO CB C -5.896 -0.276 -6.226 1.00 . A A . 5 PRO CB 1 1
3 615 1 1 5 PRO CD C -6.403 -1.207 -4.132 1.00 . A A . 5 PRO CD 1 1
3 616 1 1 5 PRO CG C -7.013 -0.896 -5.441 1.00 . A A . 5 PRO CG 1 1
3 617 1 1 5 PRO HA H -4.275 -1.676 -6.516 1.00 . A A . 5 PRO HA 1 1
3 618 1 1 5 PRO HB2 H -5.799 0.780 -6.015 1.00 . A A . 5 PRO HB2 1 1
3 619 1 1 5 PRO HB3 H -6.025 -0.431 -7.286 1.00 . A A . 5 PRO HB3 1 1
3 620 1 1 5 PRO HD2 H -6.248 -0.309 -3.551 1.00 . A A . 5 PRO HD2 1 1
3 621 1 1 5 PRO HD3 H -6.984 -1.935 -3.587 1.00 . A A . 5 PRO HD3 1 1
3 622 1 1 5 PRO HG2 H -7.832 -0.211 -5.326 1.00 . A A . 5 PRO HG2 1 1
3 623 1 1 5 PRO HG3 H -7.332 -1.815 -5.910 1.00 . A A . 5 PRO HG3 1 1
3 624 1 1 5 PRO N N -5.149 -1.774 -4.595 1.00 . A A . 5 PRO N 1 1
3 625 1 1 5 PRO O O -2.730 0.384 -6.137 1.00 . A A . 5 PRO O 1 1
3 626 1 1 6 GLN C C -1.530 0.275 -2.550 1.00 . A A . 6 GLN C 1 1
3 627 1 1 6 GLN CA C -2.464 1.084 -3.452 1.00 . A A . 6 GLN CA 1 1
3 628 1 1 6 GLN CB C -3.112 2.218 -2.654 1.00 . A A . 6 GLN CB 1 1
3 629 1 1 6 GLN CD C -2.793 4.396 -1.416 1.00 . A A . 6 GLN CD 1 1
3 630 1 1 6 GLN CG C -2.124 3.273 -2.183 1.00 . A A . 6 GLN CG 1 1
3 631 1 1 6 GLN H H -4.140 -0.193 -3.419 1.00 . A A . 6 GLN H 1 1
3 632 1 1 6 GLN HA H -1.891 1.504 -4.265 1.00 . A A . 6 GLN HA 1 1
3 633 1 1 6 GLN HB2 H -3.853 2.701 -3.274 1.00 . A A . 6 GLN HB2 1 1
3 634 1 1 6 GLN HB3 H -3.600 1.800 -1.786 1.00 . A A . 6 GLN HB3 1 1
3 635 1 1 6 GLN HE21 H -3.721 3.081 -0.248 1.00 . A A . 6 GLN HE21 1 1
3 636 1 1 6 GLN HE22 H -4.049 4.745 0.086 1.00 . A A . 6 GLN HE22 1 1
3 637 1 1 6 GLN HG2 H -1.395 2.802 -1.538 1.00 . A A . 6 GLN HG2 1 1
3 638 1 1 6 GLN HG3 H -1.625 3.691 -3.044 1.00 . A A . 6 GLN HG3 1 1
3 639 1 1 6 GLN N N -3.482 0.216 -4.019 1.00 . A A . 6 GLN N 1 1
3 640 1 1 6 GLN NE2 N -3.602 4.038 -0.427 1.00 . A A . 6 GLN NE2 1 1
3 641 1 1 6 GLN O O -0.489 0.768 -2.118 1.00 . A A . 6 GLN O 1 1
3 642 1 1 6 GLN OE1 O -2.585 5.574 -1.710 1.00 . A A . 6 GLN OE1 1 1
3 643 1 1 7 LEU C C 0.195 -2.219 -2.116 1.00 . A A . 7 LEU C 1 1
3 644 1 1 7 LEU CA C -1.116 -1.856 -1.431 1.00 . A A . 7 LEU CA 1 1
3 645 1 1 7 LEU CB C -1.903 -3.126 -1.097 1.00 . A A . 7 LEU CB 1 1
3 646 1 1 7 LEU CD1 C -2.678 -2.246 1.118 1.00 . A A . 7 LEU CD1 1 1
3 647 1 1 7 LEU CD2 C -2.862 -4.688 0.612 1.00 . A A . 7 LEU CD2 1 1
3 648 1 1 7 LEU CG C -2.044 -3.424 0.397 1.00 . A A . 7 LEU CG 1 1
3 649 1 1 7 LEU H H -2.752 -1.314 -2.649 1.00 . A A . 7 LEU H 1 1
3 650 1 1 7 LEU HA H -0.899 -1.332 -0.523 1.00 . A A . 7 LEU HA 1 1
3 651 1 1 7 LEU HB2 H -2.894 -3.031 -1.518 1.00 . A A . 7 LEU HB2 1 1
3 652 1 1 7 LEU HB3 H -1.412 -3.966 -1.564 1.00 . A A . 7 LEU HB3 1 1
3 653 1 1 7 LEU HD11 H -3.487 -1.852 0.521 1.00 . A A . 7 LEU HD11 1 1
3 654 1 1 7 LEU HD12 H -1.936 -1.477 1.274 1.00 . A A . 7 LEU HD12 1 1
3 655 1 1 7 LEU HD13 H -3.063 -2.575 2.074 1.00 . A A . 7 LEU HD13 1 1
3 656 1 1 7 LEU HD21 H -2.646 -5.095 1.590 1.00 . A A . 7 LEU HD21 1 1
3 657 1 1 7 LEU HD22 H -2.607 -5.416 -0.144 1.00 . A A . 7 LEU HD22 1 1
3 658 1 1 7 LEU HD23 H -3.914 -4.452 0.545 1.00 . A A . 7 LEU HD23 1 1
3 659 1 1 7 LEU HG H -1.062 -3.584 0.819 1.00 . A A . 7 LEU HG 1 1
3 660 1 1 7 LEU N N -1.914 -0.976 -2.275 1.00 . A A . 7 LEU N 1 1
3 661 1 1 7 LEU O O 1.227 -2.391 -1.467 1.00 . A A . 7 LEU O 1 1
3 662 1 1 8 VAL C C 2.313 -1.508 -4.173 1.00 . A A . 8 VAL C 1 1
3 663 1 1 8 VAL CA C 1.321 -2.646 -4.229 1.00 . A A . 8 VAL CA 1 1
3 664 1 1 8 VAL CB C 0.956 -2.932 -5.697 1.00 . A A . 8 VAL CB 1 1
3 665 1 1 8 VAL CG1 C 2.162 -3.470 -6.452 1.00 . A A . 8 VAL CG1 1 1
3 666 1 1 8 VAL CG2 C -0.211 -3.905 -5.777 1.00 . A A . 8 VAL CG2 1 1
3 667 1 1 8 VAL H H -0.703 -2.147 -3.886 1.00 . A A . 8 VAL H 1 1
3 668 1 1 8 VAL HA H 1.774 -3.523 -3.809 1.00 . A A . 8 VAL HA 1 1
3 669 1 1 8 VAL HB H 0.655 -2.004 -6.160 1.00 . A A . 8 VAL HB 1 1
3 670 1 1 8 VAL HG11 H 2.091 -3.188 -7.492 1.00 . A A . 8 VAL HG11 1 1
3 671 1 1 8 VAL HG12 H 2.184 -4.547 -6.374 1.00 . A A . 8 VAL HG12 1 1
3 672 1 1 8 VAL HG13 H 3.065 -3.059 -6.028 1.00 . A A . 8 VAL HG13 1 1
3 673 1 1 8 VAL HG21 H -0.199 -4.404 -6.735 1.00 . A A . 8 VAL HG21 1 1
3 674 1 1 8 VAL HG22 H -1.139 -3.364 -5.665 1.00 . A A . 8 VAL HG22 1 1
3 675 1 1 8 VAL HG23 H -0.123 -4.638 -4.989 1.00 . A A . 8 VAL HG23 1 1
3 676 1 1 8 VAL N N 0.144 -2.317 -3.436 1.00 . A A . 8 VAL N 1 1
3 677 1 1 8 VAL O O 3.414 -1.635 -3.625 1.00 . A A . 8 VAL O 1 1
3 678 1 1 9 CYS C C 3.050 1.170 -3.264 1.00 . A A . 9 CYS C 1 1
3 679 1 1 9 CYS CA C 2.739 0.802 -4.697 1.00 . A A . 9 CYS CA 1 1
3 680 1 1 9 CYS CB C 2.064 1.967 -5.424 1.00 . A A . 9 CYS CB 1 1
3 681 1 1 9 CYS H H 1.009 -0.339 -5.107 1.00 . A A . 9 CYS H 1 1
3 682 1 1 9 CYS HA H 3.669 0.555 -5.188 1.00 . A A . 9 CYS HA 1 1
3 683 1 1 9 CYS HB2 H 0.997 1.904 -5.276 1.00 . A A . 9 CYS HB2 1 1
3 684 1 1 9 CYS HB3 H 2.424 2.898 -5.009 1.00 . A A . 9 CYS HB3 1 1
3 685 1 1 9 CYS HG H 2.897 2.781 -7.401 1.00 . A A . 9 CYS HG 1 1
3 686 1 1 9 CYS N N 1.902 -0.379 -4.714 1.00 . A A . 9 CYS N 1 1
3 687 1 1 9 CYS O O 4.135 1.671 -2.971 1.00 . A A . 9 CYS O 1 1
3 688 1 1 9 CYS SG S 2.370 2.003 -7.206 1.00 . A A . 9 CYS SG 1 1
3 689 1 1 10 ARG C C 3.076 -0.043 -0.304 1.00 . A A . 10 ARG C 1 1
3 690 1 1 10 ARG CA C 2.390 1.133 -0.954 1.00 . A A . 10 ARG CA 1 1
3 691 1 1 10 ARG CB C 1.213 1.561 -0.114 1.00 . A A . 10 ARG CB 1 1
3 692 1 1 10 ARG CD C 0.996 1.647 2.396 1.00 . A A . 10 ARG CD 1 1
3 693 1 1 10 ARG CG C 1.725 2.188 1.176 1.00 . A A . 10 ARG CG 1 1
3 694 1 1 10 ARG CZ C 1.256 -0.207 3.997 1.00 . A A . 10 ARG CZ 1 1
3 695 1 1 10 ARG H H 1.288 0.422 -2.625 1.00 . A A . 10 ARG H 1 1
3 696 1 1 10 ARG HA H 3.104 1.947 -0.944 1.00 . A A . 10 ARG HA 1 1
3 697 1 1 10 ARG HB2 H 0.623 2.286 -0.658 1.00 . A A . 10 ARG HB2 1 1
3 698 1 1 10 ARG HB3 H 0.608 0.703 0.132 1.00 . A A . 10 ARG HB3 1 1
3 699 1 1 10 ARG HD2 H 1.109 2.349 3.208 1.00 . A A . 10 ARG HD2 1 1
3 700 1 1 10 ARG HD3 H -0.052 1.543 2.155 1.00 . A A . 10 ARG HD3 1 1
3 701 1 1 10 ARG HE H 2.092 -0.134 2.186 1.00 . A A . 10 ARG HE 1 1
3 702 1 1 10 ARG HG2 H 2.800 1.968 1.271 1.00 . A A . 10 ARG HG2 1 1
3 703 1 1 10 ARG HG3 H 1.588 3.257 1.123 1.00 . A A . 10 ARG HG3 1 1
3 704 1 1 10 ARG HH11 H 0.087 1.308 4.652 1.00 . A A . 10 ARG HH11 1 1
3 705 1 1 10 ARG HH12 H 0.287 -0.007 5.760 1.00 . A A . 10 ARG HH12 1 1
3 706 1 1 10 ARG HH21 H 2.356 -1.866 3.644 1.00 . A A . 10 ARG HH21 1 1
3 707 1 1 10 ARG HH22 H 1.575 -1.807 5.189 1.00 . A A . 10 ARG HH22 1 1
3 708 1 1 10 ARG N N 2.125 0.867 -2.352 1.00 . A A . 10 ARG N 1 1
3 709 1 1 10 ARG NE N 1.517 0.349 2.816 1.00 . A A . 10 ARG NE 1 1
3 710 1 1 10 ARG NH1 N 0.480 0.417 4.874 1.00 . A A . 10 ARG NH1 1 1
3 711 1 1 10 ARG NH2 N 1.771 -1.390 4.301 1.00 . A A . 10 ARG NH2 1 1
3 712 1 1 10 ARG O O 3.337 -0.024 0.874 1.00 . A A . 10 ARG O 1 1
3 713 1 1 11 LEU C C 5.547 -1.711 -0.544 1.00 . A A . 11 LEU C 1 1
3 714 1 1 11 LEU CA C 4.118 -2.194 -0.632 1.00 . A A . 11 LEU CA 1 1
3 715 1 1 11 LEU CB C 3.993 -3.380 -1.594 1.00 . A A . 11 LEU CB 1 1
3 716 1 1 11 LEU CD1 C 3.766 -5.849 -1.964 1.00 . A A . 11 LEU CD1 1 1
3 717 1 1 11 LEU CD2 C 5.191 -4.994 -0.096 1.00 . A A . 11 LEU CD2 1 1
3 718 1 1 11 LEU CG C 3.937 -4.754 -0.923 1.00 . A A . 11 LEU CG 1 1
3 719 1 1 11 LEU H H 3.160 -0.984 -2.010 1.00 . A A . 11 LEU H 1 1
3 720 1 1 11 LEU HA H 3.766 -2.455 0.343 1.00 . A A . 11 LEU HA 1 1
3 721 1 1 11 LEU HB2 H 3.094 -3.251 -2.177 1.00 . A A . 11 LEU HB2 1 1
3 722 1 1 11 LEU HB3 H 4.841 -3.366 -2.262 1.00 . A A . 11 LEU HB3 1 1
3 723 1 1 11 LEU HD11 H 2.719 -5.954 -2.208 1.00 . A A . 11 LEU HD11 1 1
3 724 1 1 11 LEU HD12 H 4.139 -6.782 -1.569 1.00 . A A . 11 LEU HD12 1 1
3 725 1 1 11 LEU HD13 H 4.318 -5.589 -2.855 1.00 . A A . 11 LEU HD13 1 1
3 726 1 1 11 LEU HD21 H 5.966 -5.402 -0.727 1.00 . A A . 11 LEU HD21 1 1
3 727 1 1 11 LEU HD22 H 4.970 -5.692 0.699 1.00 . A A . 11 LEU HD22 1 1
3 728 1 1 11 LEU HD23 H 5.527 -4.060 0.329 1.00 . A A . 11 LEU HD23 1 1
3 729 1 1 11 LEU HG H 3.085 -4.789 -0.259 1.00 . A A . 11 LEU HG 1 1
3 730 1 1 11 LEU N N 3.383 -1.046 -1.097 1.00 . A A . 11 LEU N 1 1
3 731 1 1 11 LEU O O 6.264 -1.938 0.439 1.00 . A A . 11 LEU O 1 1
3 732 1 1 12 VAL C C 7.216 0.713 -0.416 1.00 . A A . 12 VAL C 1 1
3 733 1 1 12 VAL CA C 7.224 -0.297 -1.537 1.00 . A A . 12 VAL CA 1 1
3 734 1 1 12 VAL CB C 7.570 0.389 -2.874 1.00 . A A . 12 VAL CB 1 1
3 735 1 1 12 VAL CG1 C 8.984 0.946 -2.840 1.00 . A A . 12 VAL CG1 1 1
3 736 1 1 12 VAL CG2 C 7.398 -0.581 -4.032 1.00 . A A . 12 VAL CG2 1 1
3 737 1 1 12 VAL H H 5.274 -0.707 -2.271 1.00 . A A . 12 VAL H 1 1
3 738 1 1 12 VAL HA H 7.949 -1.044 -1.314 1.00 . A A . 12 VAL HA 1 1
3 739 1 1 12 VAL HB H 6.886 1.213 -3.018 1.00 . A A . 12 VAL HB 1 1
3 740 1 1 12 VAL HG11 H 8.959 1.973 -2.509 1.00 . A A . 12 VAL HG11 1 1
3 741 1 1 12 VAL HG12 H 9.415 0.896 -3.829 1.00 . A A . 12 VAL HG12 1 1
3 742 1 1 12 VAL HG13 H 9.585 0.363 -2.157 1.00 . A A . 12 VAL HG13 1 1
3 743 1 1 12 VAL HG21 H 6.741 -1.386 -3.734 1.00 . A A . 12 VAL HG21 1 1
3 744 1 1 12 VAL HG22 H 8.360 -0.985 -4.309 1.00 . A A . 12 VAL HG22 1 1
3 745 1 1 12 VAL HG23 H 6.969 -0.062 -4.877 1.00 . A A . 12 VAL HG23 1 1
3 746 1 1 12 VAL N N 5.921 -0.923 -1.550 1.00 . A A . 12 VAL N 1 1
3 747 1 1 12 VAL O O 8.137 0.790 0.407 1.00 . A A . 12 VAL O 1 1
3 748 1 1 13 LEU C C 5.440 1.602 1.970 1.00 . A A . 13 LEU C 1 1
3 749 1 1 13 LEU CA C 5.938 2.355 0.753 1.00 . A A . 13 LEU CA 1 1
3 750 1 1 13 LEU CB C 5.032 3.530 0.409 1.00 . A A . 13 LEU CB 1 1
3 751 1 1 13 LEU CD1 C 3.553 4.332 -1.454 1.00 . A A . 13 LEU CD1 1 1
3 752 1 1 13 LEU CD2 C 5.955 5.020 -1.384 1.00 . A A . 13 LEU CD2 1 1
3 753 1 1 13 LEU CG C 4.963 3.908 -1.074 1.00 . A A . 13 LEU CG 1 1
3 754 1 1 13 LEU H H 5.384 1.270 -0.961 1.00 . A A . 13 LEU H 1 1
3 755 1 1 13 LEU HA H 6.905 2.732 0.988 1.00 . A A . 13 LEU HA 1 1
3 756 1 1 13 LEU HB2 H 4.037 3.310 0.757 1.00 . A A . 13 LEU HB2 1 1
3 757 1 1 13 LEU HB3 H 5.408 4.388 0.957 1.00 . A A . 13 LEU HB3 1 1
3 758 1 1 13 LEU HD11 H 3.489 5.411 -1.453 1.00 . A A . 13 LEU HD11 1 1
3 759 1 1 13 LEU HD12 H 2.851 3.929 -0.739 1.00 . A A . 13 LEU HD12 1 1
3 760 1 1 13 LEU HD13 H 3.319 3.959 -2.440 1.00 . A A . 13 LEU HD13 1 1
3 761 1 1 13 LEU HD21 H 6.257 4.954 -2.419 1.00 . A A . 13 LEU HD21 1 1
3 762 1 1 13 LEU HD22 H 6.822 4.916 -0.749 1.00 . A A . 13 LEU HD22 1 1
3 763 1 1 13 LEU HD23 H 5.489 5.978 -1.205 1.00 . A A . 13 LEU HD23 1 1
3 764 1 1 13 LEU HG H 5.226 3.050 -1.672 1.00 . A A . 13 LEU HG 1 1
3 765 1 1 13 LEU N N 6.111 1.426 -0.327 1.00 . A A . 13 LEU N 1 1
3 766 1 1 13 LEU O O 5.234 2.185 3.032 1.00 . A A . 13 LEU O 1 1
3 767 1 1 14 ARG C C 5.993 -0.408 3.951 1.00 . A A . 14 ARG C 1 1
3 768 1 1 14 ARG CA C 4.861 -0.518 2.952 1.00 . A A . 14 ARG CA 1 1
3 769 1 1 14 ARG CB C 4.610 -1.985 2.584 1.00 . A A . 14 ARG CB 1 1
3 770 1 1 14 ARG CD C 6.007 -3.466 4.061 1.00 . A A . 14 ARG CD 1 1
3 771 1 1 14 ARG CG C 4.613 -2.929 3.778 1.00 . A A . 14 ARG CG 1 1
3 772 1 1 14 ARG CZ C 7.220 -5.596 3.807 1.00 . A A . 14 ARG CZ 1 1
3 773 1 1 14 ARG H H 5.480 -0.154 0.982 1.00 . A A . 14 ARG H 1 1
3 774 1 1 14 ARG HA H 3.955 -0.080 3.318 1.00 . A A . 14 ARG HA 1 1
3 775 1 1 14 ARG HB2 H 3.647 -2.058 2.108 1.00 . A A . 14 ARG HB2 1 1
3 776 1 1 14 ARG HB3 H 5.371 -2.311 1.898 1.00 . A A . 14 ARG HB3 1 1
3 777 1 1 14 ARG HD2 H 6.732 -2.783 3.644 1.00 . A A . 14 ARG HD2 1 1
3 778 1 1 14 ARG HD3 H 6.145 -3.527 5.130 1.00 . A A . 14 ARG HD3 1 1
3 779 1 1 14 ARG HE H 5.567 -5.095 2.807 1.00 . A A . 14 ARG HE 1 1
3 780 1 1 14 ARG HG2 H 4.261 -2.395 4.647 1.00 . A A . 14 ARG HG2 1 1
3 781 1 1 14 ARG HG3 H 3.953 -3.758 3.570 1.00 . A A . 14 ARG HG3 1 1
3 782 1 1 14 ARG HH11 H 8.036 -4.323 5.150 1.00 . A A . 14 ARG HH11 1 1
3 783 1 1 14 ARG HH12 H 8.869 -5.828 4.954 1.00 . A A . 14 ARG HH12 1 1
3 784 1 1 14 ARG HH21 H 6.662 -7.075 2.548 1.00 . A A . 14 ARG HH21 1 1
3 785 1 1 14 ARG HH22 H 8.090 -7.390 3.476 1.00 . A A . 14 ARG HH22 1 1
3 786 1 1 14 ARG N N 5.282 0.279 1.831 1.00 . A A . 14 ARG N 1 1
3 787 1 1 14 ARG NE N 6.213 -4.790 3.478 1.00 . A A . 14 ARG NE 1 1
3 788 1 1 14 ARG NH1 N 8.115 -5.217 4.712 1.00 . A A . 14 ARG NH1 1 1
3 789 1 1 14 ARG NH2 N 7.333 -6.784 3.229 1.00 . A A . 14 ARG NH2 1 1
3 790 1 1 14 ARG O O 5.806 -0.241 5.157 1.00 . A A . 14 ARG O 1 1
3 791 1 1 15 CYS C C 8.822 1.166 4.189 1.00 . A A . 15 CYS C 1 1
3 792 1 1 15 CYS CA C 8.445 -0.312 4.078 1.00 . A A . 15 CYS CA 1 1
3 793 1 1 15 CYS CB C 9.545 -1.055 3.325 1.00 . A A . 15 CYS CB 1 1
3 794 1 1 15 CYS H H 7.221 -0.562 2.380 1.00 . A A . 15 CYS H 1 1
3 795 1 1 15 CYS HA H 8.331 -0.734 5.063 1.00 . A A . 15 CYS HA 1 1
3 796 1 1 15 CYS HB2 H 9.132 -1.455 2.414 1.00 . A A . 15 CYS HB2 1 1
3 797 1 1 15 CYS HB3 H 10.329 -0.357 3.074 1.00 . A A . 15 CYS HB3 1 1
3 798 1 1 15 CYS HG H 11.210 -2.489 3.984 1.00 . A A . 15 CYS HG 1 1
3 799 1 1 15 CYS N N 7.190 -0.453 3.362 1.00 . A A . 15 CYS N 1 1
3 800 1 1 15 CYS O O 9.696 1.532 4.975 1.00 . A A . 15 CYS O 1 1
3 801 1 1 15 CYS SG S 10.289 -2.422 4.246 1.00 . A A . 15 CYS SG 1 1
3 802 1 1 16 SER C C 8.961 3.970 4.663 1.00 . A A . 16 SER C 1 1
3 803 1 1 16 SER CA C 8.438 3.448 3.324 1.00 . A A . 16 SER CA 1 1
3 804 1 1 16 SER CB C 7.168 4.228 2.968 1.00 . A A . 16 SER CB 1 1
3 805 1 1 16 SER H H 7.522 1.625 2.738 1.00 . A A . 16 SER H 1 1
3 806 1 1 16 SER HA H 9.165 3.621 2.552 1.00 . A A . 16 SER HA 1 1
3 807 1 1 16 SER HB2 H 7.057 4.264 1.898 1.00 . A A . 16 SER HB2 1 1
3 808 1 1 16 SER HB3 H 6.313 3.742 3.406 1.00 . A A . 16 SER HB3 1 1
3 809 1 1 16 SER HG H 6.861 5.594 4.341 1.00 . A A . 16 SER HG 1 1
3 810 1 1 16 SER N N 8.171 2.002 3.365 1.00 . A A . 16 SER N 1 1
3 811 1 1 16 SER O O 8.344 3.652 5.702 1.00 . A A . 16 SER O 1 1
3 812 1 1 16 SER OXT O 9.982 4.690 4.659 1.00 . A A . 16 SER OXT 1 1
3 813 1 1 16 SER OG O 7.230 5.559 3.454 1.00 . A A . 16 SER OG 1 1
4 814 1 1 1 GLY C C -9.877 0.421 -3.308 1.00 . A A . 1 GLY C 1 1
4 815 1 1 1 GLY CA C -10.683 -0.127 -4.468 1.00 . A A . 1 GLY CA 1 1
4 816 1 1 1 GLY H1 H -11.029 1.618 -5.563 1.00 . A A . 1 GLY H1 1 1
4 817 1 1 1 GLY H2 H -12.148 1.356 -4.322 1.00 . A A . 1 GLY H2 1 1
4 818 1 1 1 GLY H3 H -12.234 0.444 -5.745 1.00 . A A . 1 GLY H3 1 1
4 819 1 1 1 GLY HA2 H -11.279 -0.957 -4.117 1.00 . A A . 1 GLY HA2 1 1
4 820 1 1 1 GLY HA3 H -10.003 -0.481 -5.228 1.00 . A A . 1 GLY HA3 1 1
4 821 1 1 1 GLY N N -11.586 0.895 -5.067 1.00 . A A . 1 GLY N 1 1
4 822 1 1 1 GLY O O -8.834 1.045 -3.506 1.00 . A A . 1 GLY O 1 1
4 823 1 1 2 ARG C C -8.807 -0.451 -0.304 1.00 . A A . 2 ARG C 1 1
4 824 1 1 2 ARG CA C -9.673 0.655 -0.896 1.00 . A A . 2 ARG CA 1 1
4 825 1 1 2 ARG CB C -10.687 1.139 0.143 1.00 . A A . 2 ARG CB 1 1
4 826 1 1 2 ARG CD C -10.391 3.535 -0.559 1.00 . A A . 2 ARG CD 1 1
4 827 1 1 2 ARG CG C -11.388 2.431 -0.246 1.00 . A A . 2 ARG CG 1 1
4 828 1 1 2 ARG CZ C -9.364 4.553 -2.556 1.00 . A A . 2 ARG CZ 1 1
4 829 1 1 2 ARG H H -11.193 -0.321 -1.999 1.00 . A A . 2 ARG H 1 1
4 830 1 1 2 ARG HA H -9.038 1.481 -1.180 1.00 . A A . 2 ARG HA 1 1
4 831 1 1 2 ARG HB2 H -11.437 0.375 0.280 1.00 . A A . 2 ARG HB2 1 1
4 832 1 1 2 ARG HB3 H -10.174 1.302 1.079 1.00 . A A . 2 ARG HB3 1 1
4 833 1 1 2 ARG HD2 H -10.836 4.486 -0.307 1.00 . A A . 2 ARG HD2 1 1
4 834 1 1 2 ARG HD3 H -9.504 3.382 0.038 1.00 . A A . 2 ARG HD3 1 1
4 835 1 1 2 ARG HE H -10.259 2.771 -2.513 1.00 . A A . 2 ARG HE 1 1
4 836 1 1 2 ARG HG2 H -11.995 2.249 -1.121 1.00 . A A . 2 ARG HG2 1 1
4 837 1 1 2 ARG HG3 H -12.018 2.747 0.571 1.00 . A A . 2 ARG HG3 1 1
4 838 1 1 2 ARG HH11 H -9.242 5.682 -0.881 1.00 . A A . 2 ARG HH11 1 1
4 839 1 1 2 ARG HH12 H -8.529 6.377 -2.299 1.00 . A A . 2 ARG HH12 1 1
4 840 1 1 2 ARG HH21 H -9.321 3.680 -4.377 1.00 . A A . 2 ARG HH21 1 1
4 841 1 1 2 ARG HH22 H -8.571 5.240 -4.283 1.00 . A A . 2 ARG HH22 1 1
4 842 1 1 2 ARG N N -10.359 0.185 -2.093 1.00 . A A . 2 ARG N 1 1
4 843 1 1 2 ARG NE N -10.015 3.550 -1.971 1.00 . A A . 2 ARG NE 1 1
4 844 1 1 2 ARG NH1 N -9.017 5.625 -1.854 1.00 . A A . 2 ARG NH1 1 1
4 845 1 1 2 ARG NH2 N -9.060 4.485 -3.845 1.00 . A A . 2 ARG NH2 1 1
4 846 1 1 2 ARG O O -9.292 -1.545 -0.017 1.00 . A A . 2 ARG O 1 1
4 847 1 1 3 MET C C -6.429 -2.328 -0.500 1.00 . A A . 3 MET C 1 1
4 848 1 1 3 MET CA C -6.586 -1.129 0.430 1.00 . A A . 3 MET CA 1 1
4 849 1 1 3 MET CB C -7.055 -1.595 1.811 1.00 . A A . 3 MET CB 1 1
4 850 1 1 3 MET CE C -7.237 -2.091 4.951 1.00 . A A . 3 MET CE 1 1
4 851 1 1 3 MET CG C -6.112 -2.588 2.469 1.00 . A A . 3 MET CG 1 1
4 852 1 1 3 MET H H -7.196 0.732 -0.377 1.00 . A A . 3 MET H 1 1
4 853 1 1 3 MET HA H -5.628 -0.641 0.532 1.00 . A A . 3 MET HA 1 1
4 854 1 1 3 MET HB2 H -7.145 -0.734 2.458 1.00 . A A . 3 MET HB2 1 1
4 855 1 1 3 MET HB3 H -8.023 -2.062 1.712 1.00 . A A . 3 MET HB3 1 1
4 856 1 1 3 MET HE1 H -7.446 -2.470 5.940 1.00 . A A . 3 MET HE1 1 1
4 857 1 1 3 MET HE2 H -8.097 -1.551 4.583 1.00 . A A . 3 MET HE2 1 1
4 858 1 1 3 MET HE3 H -6.386 -1.426 4.991 1.00 . A A . 3 MET HE3 1 1
4 859 1 1 3 MET HG2 H -5.805 -3.314 1.730 1.00 . A A . 3 MET HG2 1 1
4 860 1 1 3 MET HG3 H -5.244 -2.055 2.829 1.00 . A A . 3 MET HG3 1 1
4 861 1 1 3 MET N N -7.523 -0.158 -0.126 1.00 . A A . 3 MET N 1 1
4 862 1 1 3 MET O O -6.896 -3.427 -0.199 1.00 . A A . 3 MET O 1 1
4 863 1 1 3 MET SD S -6.875 -3.458 3.851 1.00 . A A . 3 MET SD 1 1
4 864 1 1 4 LEU C C -4.800 -2.657 -3.826 1.00 . A A . 4 LEU C 1 1
4 865 1 1 4 LEU CA C -5.540 -3.173 -2.606 1.00 . A A . 4 LEU CA 1 1
4 866 1 1 4 LEU CB C -6.866 -3.818 -3.026 1.00 . A A . 4 LEU CB 1 1
4 867 1 1 4 LEU CD1 C -7.006 -5.980 -1.765 1.00 . A A . 4 LEU CD1 1 1
4 868 1 1 4 LEU CD2 C -7.922 -5.828 -4.087 1.00 . A A . 4 LEU CD2 1 1
4 869 1 1 4 LEU CG C -6.838 -5.344 -3.136 1.00 . A A . 4 LEU CG 1 1
4 870 1 1 4 LEU H H -5.412 -1.214 -1.813 1.00 . A A . 4 LEU H 1 1
4 871 1 1 4 LEU HA H -4.934 -3.903 -2.148 1.00 . A A . 4 LEU HA 1 1
4 872 1 1 4 LEU HB2 H -7.620 -3.543 -2.304 1.00 . A A . 4 LEU HB2 1 1
4 873 1 1 4 LEU HB3 H -7.149 -3.417 -3.987 1.00 . A A . 4 LEU HB3 1 1
4 874 1 1 4 LEU HD11 H -8.042 -5.928 -1.467 1.00 . A A . 4 LEU HD11 1 1
4 875 1 1 4 LEU HD12 H -6.398 -5.452 -1.045 1.00 . A A . 4 LEU HD12 1 1
4 876 1 1 4 LEU HD13 H -6.696 -7.014 -1.807 1.00 . A A . 4 LEU HD13 1 1
4 877 1 1 4 LEU HD21 H -7.540 -5.831 -5.097 1.00 . A A . 4 LEU HD21 1 1
4 878 1 1 4 LEU HD22 H -8.775 -5.167 -4.027 1.00 . A A . 4 LEU HD22 1 1
4 879 1 1 4 LEU HD23 H -8.222 -6.829 -3.812 1.00 . A A . 4 LEU HD23 1 1
4 880 1 1 4 LEU HG H -5.881 -5.653 -3.532 1.00 . A A . 4 LEU HG 1 1
4 881 1 1 4 LEU N N -5.764 -2.111 -1.630 1.00 . A A . 4 LEU N 1 1
4 882 1 1 4 LEU O O -3.788 -3.220 -4.243 1.00 . A A . 4 LEU O 1 1
4 883 1 1 5 PRO C C -3.581 -0.051 -5.244 1.00 . A A . 5 PRO C 1 1
4 884 1 1 5 PRO CA C -4.744 -0.964 -5.607 1.00 . A A . 5 PRO CA 1 1
4 885 1 1 5 PRO CB C -5.946 -0.179 -6.169 1.00 . A A . 5 PRO CB 1 1
4 886 1 1 5 PRO CD C -6.510 -0.883 -3.999 1.00 . A A . 5 PRO CD 1 1
4 887 1 1 5 PRO CG C -7.103 -0.633 -5.330 1.00 . A A . 5 PRO CG 1 1
4 888 1 1 5 PRO HA H -4.417 -1.701 -6.326 1.00 . A A . 5 PRO HA 1 1
4 889 1 1 5 PRO HB2 H -5.769 0.882 -6.065 1.00 . A A . 5 PRO HB2 1 1
4 890 1 1 5 PRO HB3 H -6.092 -0.428 -7.209 1.00 . A A . 5 PRO HB3 1 1
4 891 1 1 5 PRO HD2 H -6.275 0.046 -3.496 1.00 . A A . 5 PRO HD2 1 1
4 892 1 1 5 PRO HD3 H -7.143 -1.511 -3.394 1.00 . A A . 5 PRO HD3 1 1
4 893 1 1 5 PRO HG2 H -7.861 0.127 -5.274 1.00 . A A . 5 PRO HG2 1 1
4 894 1 1 5 PRO HG3 H -7.504 -1.558 -5.718 1.00 . A A . 5 PRO HG3 1 1
4 895 1 1 5 PRO N N -5.311 -1.587 -4.417 1.00 . A A . 5 PRO N 1 1
4 896 1 1 5 PRO O O -2.775 0.326 -6.095 1.00 . A A . 5 PRO O 1 1
4 897 1 1 6 GLN C C -1.483 0.269 -2.567 1.00 . A A . 6 GLN C 1 1
4 898 1 1 6 GLN CA C -2.421 1.106 -3.438 1.00 . A A . 6 GLN CA 1 1
4 899 1 1 6 GLN CB C -2.998 2.267 -2.625 1.00 . A A . 6 GLN CB 1 1
4 900 1 1 6 GLN CD C -2.082 3.568 -0.660 1.00 . A A . 6 GLN CD 1 1
4 901 1 1 6 GLN CG C -1.948 3.254 -2.139 1.00 . A A . 6 GLN CG 1 1
4 902 1 1 6 GLN H H -4.157 -0.082 -3.332 1.00 . A A . 6 GLN H 1 1
4 903 1 1 6 GLN HA H -1.865 1.499 -4.276 1.00 . A A . 6 GLN HA 1 1
4 904 1 1 6 GLN HB2 H -3.707 2.802 -3.237 1.00 . A A . 6 GLN HB2 1 1
4 905 1 1 6 GLN HB3 H -3.511 1.867 -1.763 1.00 . A A . 6 GLN HB3 1 1
4 906 1 1 6 GLN HE21 H -3.870 4.381 -0.969 1.00 . A A . 6 GLN HE21 1 1
4 907 1 1 6 GLN HE22 H -3.314 4.387 0.667 1.00 . A A . 6 GLN HE22 1 1
4 908 1 1 6 GLN HG2 H -0.969 2.836 -2.314 1.00 . A A . 6 GLN HG2 1 1
4 909 1 1 6 GLN HG3 H -2.052 4.174 -2.697 1.00 . A A . 6 GLN HG3 1 1
4 910 1 1 6 GLN N N -3.492 0.272 -3.957 1.00 . A A . 6 GLN N 1 1
4 911 1 1 6 GLN NE2 N -3.202 4.173 -0.283 1.00 . A A . 6 GLN NE2 1 1
4 912 1 1 6 GLN O O -0.396 0.714 -2.204 1.00 . A A . 6 GLN O 1 1
4 913 1 1 6 GLN OE1 O -1.189 3.269 0.133 1.00 . A A . 6 GLN OE1 1 1
4 914 1 1 7 LEU C C 0.190 -2.213 -2.106 1.00 . A A . 7 LEU C 1 1
4 915 1 1 7 LEU CA C -1.116 -1.850 -1.410 1.00 . A A . 7 LEU CA 1 1
4 916 1 1 7 LEU CB C -1.907 -3.121 -1.091 1.00 . A A . 7 LEU CB 1 1
4 917 1 1 7 LEU CD1 C -2.118 -3.037 1.406 1.00 . A A . 7 LEU CD1 1 1
4 918 1 1 7 LEU CD2 C -2.014 -5.245 0.236 1.00 . A A . 7 LEU CD2 1 1
4 919 1 1 7 LEU CG C -1.534 -3.802 0.227 1.00 . A A . 7 LEU CG 1 1
4 920 1 1 7 LEU H H -2.790 -1.256 -2.553 1.00 . A A . 7 LEU H 1 1
4 921 1 1 7 LEU HA H -0.892 -1.341 -0.494 1.00 . A A . 7 LEU HA 1 1
4 922 1 1 7 LEU HB2 H -2.956 -2.867 -1.057 1.00 . A A . 7 LEU HB2 1 1
4 923 1 1 7 LEU HB3 H -1.751 -3.828 -1.892 1.00 . A A . 7 LEU HB3 1 1
4 924 1 1 7 LEU HD11 H -3.063 -3.476 1.687 1.00 . A A . 7 LEU HD11 1 1
4 925 1 1 7 LEU HD12 H -2.269 -2.005 1.125 1.00 . A A . 7 LEU HD12 1 1
4 926 1 1 7 LEU HD13 H -1.434 -3.087 2.241 1.00 . A A . 7 LEU HD13 1 1
4 927 1 1 7 LEU HD21 H -2.963 -5.306 0.750 1.00 . A A . 7 LEU HD21 1 1
4 928 1 1 7 LEU HD22 H -1.289 -5.863 0.744 1.00 . A A . 7 LEU HD22 1 1
4 929 1 1 7 LEU HD23 H -2.134 -5.591 -0.781 1.00 . A A . 7 LEU HD23 1 1
4 930 1 1 7 LEU HG H -0.459 -3.805 0.332 1.00 . A A . 7 LEU HG 1 1
4 931 1 1 7 LEU N N -1.914 -0.952 -2.234 1.00 . A A . 7 LEU N 1 1
4 932 1 1 7 LEU O O 1.225 -2.395 -1.465 1.00 . A A . 7 LEU O 1 1
4 933 1 1 8 VAL C C 2.305 -1.504 -4.170 1.00 . A A . 8 VAL C 1 1
4 934 1 1 8 VAL CA C 1.298 -2.631 -4.229 1.00 . A A . 8 VAL CA 1 1
4 935 1 1 8 VAL CB C 0.920 -2.894 -5.699 1.00 . A A . 8 VAL CB 1 1
4 936 1 1 8 VAL CG1 C 2.132 -3.365 -6.489 1.00 . A A . 8 VAL CG1 1 1
4 937 1 1 8 VAL CG2 C -0.210 -3.909 -5.787 1.00 . A A . 8 VAL CG2 1 1
4 938 1 1 8 VAL H H -0.721 -2.125 -3.869 1.00 . A A . 8 VAL H 1 1
4 939 1 1 8 VAL HA H 1.746 -3.518 -3.825 1.00 . A A . 8 VAL HA 1 1
4 940 1 1 8 VAL HB H 0.576 -1.965 -6.129 1.00 . A A . 8 VAL HB 1 1
4 941 1 1 8 VAL HG11 H 2.113 -2.923 -7.474 1.00 . A A . 8 VAL HG11 1 1
4 942 1 1 8 VAL HG12 H 2.108 -4.441 -6.577 1.00 . A A . 8 VAL HG12 1 1
4 943 1 1 8 VAL HG13 H 3.035 -3.067 -5.976 1.00 . A A . 8 VAL HG13 1 1
4 944 1 1 8 VAL HG21 H 0.197 -4.881 -6.024 1.00 . A A . 8 VAL HG21 1 1
4 945 1 1 8 VAL HG22 H -0.902 -3.609 -6.559 1.00 . A A . 8 VAL HG22 1 1
4 946 1 1 8 VAL HG23 H -0.727 -3.956 -4.840 1.00 . A A . 8 VAL HG23 1 1
4 947 1 1 8 VAL N N 0.130 -2.301 -3.425 1.00 . A A . 8 VAL N 1 1
4 948 1 1 8 VAL O O 3.397 -1.643 -3.609 1.00 . A A . 8 VAL O 1 1
4 949 1 1 9 CYS C C 3.081 1.161 -3.272 1.00 . A A . 9 CYS C 1 1
4 950 1 1 9 CYS CA C 2.770 0.796 -4.707 1.00 . A A . 9 CYS CA 1 1
4 951 1 1 9 CYS CB C 2.110 1.969 -5.435 1.00 . A A . 9 CYS CB 1 1
4 952 1 1 9 CYS H H 1.029 -0.326 -5.128 1.00 . A A . 9 CYS H 1 1
4 953 1 1 9 CYS HA H 3.697 0.536 -5.196 1.00 . A A . 9 CYS HA 1 1
4 954 1 1 9 CYS HB2 H 1.211 2.251 -4.907 1.00 . A A . 9 CYS HB2 1 1
4 955 1 1 9 CYS HB3 H 2.793 2.806 -5.445 1.00 . A A . 9 CYS HB3 1 1
4 956 1 1 9 CYS HG H 2.298 1.000 -7.506 1.00 . A A . 9 CYS HG 1 1
4 957 1 1 9 CYS N N 1.916 -0.374 -4.723 1.00 . A A . 9 CYS N 1 1
4 958 1 1 9 CYS O O 4.164 1.665 -2.977 1.00 . A A . 9 CYS O 1 1
4 959 1 1 9 CYS SG S 1.650 1.610 -7.147 1.00 . A A . 9 CYS SG 1 1
4 960 1 1 10 ARG C C 3.087 -0.062 -0.311 1.00 . A A . 10 ARG C 1 1
4 961 1 1 10 ARG CA C 2.406 1.117 -0.964 1.00 . A A . 10 ARG CA 1 1
4 962 1 1 10 ARG CB C 1.216 1.537 -0.143 1.00 . A A . 10 ARG CB 1 1
4 963 1 1 10 ARG CD C 0.927 1.574 2.355 1.00 . A A . 10 ARG CD 1 1
4 964 1 1 10 ARG CG C 1.700 2.134 1.172 1.00 . A A . 10 ARG CG 1 1
4 965 1 1 10 ARG CZ C 1.007 -0.379 3.855 1.00 . A A . 10 ARG CZ 1 1
4 966 1 1 10 ARG H H 1.319 0.410 -2.642 1.00 . A A . 10 ARG H 1 1
4 967 1 1 10 ARG HA H 3.118 1.932 -0.944 1.00 . A A . 10 ARG HA 1 1
4 968 1 1 10 ARG HB2 H 0.646 2.280 -0.685 1.00 . A A . 10 ARG HB2 1 1
4 969 1 1 10 ARG HB3 H 0.598 0.681 0.071 1.00 . A A . 10 ARG HB3 1 1
4 970 1 1 10 ARG HD2 H 1.006 2.266 3.181 1.00 . A A . 10 ARG HD2 1 1
4 971 1 1 10 ARG HD3 H -0.110 1.469 2.072 1.00 . A A . 10 ARG HD3 1 1
4 972 1 1 10 ARG HE H 2.134 -0.140 2.225 1.00 . A A . 10 ARG HE 1 1
4 973 1 1 10 ARG HG2 H 2.770 1.900 1.292 1.00 . A A . 10 ARG HG2 1 1
4 974 1 1 10 ARG HG3 H 1.575 3.204 1.137 1.00 . A A . 10 ARG HG3 1 1
4 975 1 1 10 ARG HH11 H -0.322 1.045 4.404 1.00 . A A . 10 ARG HH11 1 1
4 976 1 1 10 ARG HH12 H -0.251 -0.343 5.438 1.00 . A A . 10 ARG HH12 1 1
4 977 1 1 10 ARG HH21 H 2.228 -1.966 3.584 1.00 . A A . 10 ARG HH21 1 1
4 978 1 1 10 ARG HH22 H 1.196 -2.053 4.972 1.00 . A A . 10 ARG HH22 1 1
4 979 1 1 10 ARG N N 2.154 0.855 -2.365 1.00 . A A . 10 ARG N 1 1
4 980 1 1 10 ARG NE N 1.438 0.272 2.777 1.00 . A A . 10 ARG NE 1 1
4 981 1 1 10 ARG NH1 N 0.068 0.152 4.629 1.00 . A A . 10 ARG NH1 1 1
4 982 1 1 10 ARG NH2 N 1.519 -1.562 4.163 1.00 . A A . 10 ARG NH2 1 1
4 983 1 1 10 ARG O O 3.342 -0.044 0.868 1.00 . A A . 10 ARG O 1 1
4 984 1 1 11 LEU C C 5.557 -1.729 -0.547 1.00 . A A . 11 LEU C 1 1
4 985 1 1 11 LEU CA C 4.128 -2.215 -0.635 1.00 . A A . 11 LEU CA 1 1
4 986 1 1 11 LEU CB C 4.004 -3.399 -1.598 1.00 . A A . 11 LEU CB 1 1
4 987 1 1 11 LEU CD1 C 2.935 -5.668 -1.573 1.00 . A A . 11 LEU CD1 1 1
4 988 1 1 11 LEU CD2 C 5.362 -5.427 -1.022 1.00 . A A . 11 LEU CD2 1 1
4 989 1 1 11 LEU CG C 3.989 -4.777 -0.934 1.00 . A A . 11 LEU CG 1 1
4 990 1 1 11 LEU H H 3.176 -1.003 -2.017 1.00 . A A . 11 LEU H 1 1
4 991 1 1 11 LEU HA H 3.776 -2.475 0.340 1.00 . A A . 11 LEU HA 1 1
4 992 1 1 11 LEU HB2 H 3.090 -3.283 -2.162 1.00 . A A . 11 LEU HB2 1 1
4 993 1 1 11 LEU HB3 H 4.837 -3.365 -2.285 1.00 . A A . 11 LEU HB3 1 1
4 994 1 1 11 LEU HD11 H 2.052 -5.084 -1.787 1.00 . A A . 11 LEU HD11 1 1
4 995 1 1 11 LEU HD12 H 2.681 -6.469 -0.895 1.00 . A A . 11 LEU HD12 1 1
4 996 1 1 11 LEU HD13 H 3.323 -6.083 -2.492 1.00 . A A . 11 LEU HD13 1 1
4 997 1 1 11 LEU HD21 H 6.126 -4.670 -0.935 1.00 . A A . 11 LEU HD21 1 1
4 998 1 1 11 LEU HD22 H 5.460 -5.930 -1.973 1.00 . A A . 11 LEU HD22 1 1
4 999 1 1 11 LEU HD23 H 5.473 -6.145 -0.223 1.00 . A A . 11 LEU HD23 1 1
4 1000 1 1 11 LEU HG H 3.739 -4.663 0.112 1.00 . A A . 11 LEU HG 1 1
4 1001 1 1 11 LEU N N 3.396 -1.065 -1.102 1.00 . A A . 11 LEU N 1 1
4 1002 1 1 11 LEU O O 6.279 -1.957 0.431 1.00 . A A . 11 LEU O 1 1
4 1003 1 1 12 VAL C C 7.204 0.706 -0.413 1.00 . A A . 12 VAL C 1 1
4 1004 1 1 12 VAL CA C 7.221 -0.304 -1.536 1.00 . A A . 12 VAL CA 1 1
4 1005 1 1 12 VAL CB C 7.555 0.382 -2.872 1.00 . A A . 12 VAL CB 1 1
4 1006 1 1 12 VAL CG1 C 8.916 1.059 -2.808 1.00 . A A . 12 VAL CG1 1 1
4 1007 1 1 12 VAL CG2 C 7.504 -0.620 -4.015 1.00 . A A . 12 VAL CG2 1 1
4 1008 1 1 12 VAL H H 5.273 -0.718 -2.267 1.00 . A A . 12 VAL H 1 1
4 1009 1 1 12 VAL HA H 7.950 -1.046 -1.314 1.00 . A A . 12 VAL HA 1 1
4 1010 1 1 12 VAL HB H 6.807 1.139 -3.054 1.00 . A A . 12 VAL HB 1 1
4 1011 1 1 12 VAL HG11 H 8.905 1.817 -2.039 1.00 . A A . 12 VAL HG11 1 1
4 1012 1 1 12 VAL HG12 H 9.136 1.517 -3.762 1.00 . A A . 12 VAL HG12 1 1
4 1013 1 1 12 VAL HG13 H 9.673 0.324 -2.579 1.00 . A A . 12 VAL HG13 1 1
4 1014 1 1 12 VAL HG21 H 6.895 -1.464 -3.726 1.00 . A A . 12 VAL HG21 1 1
4 1015 1 1 12 VAL HG22 H 8.504 -0.959 -4.241 1.00 . A A . 12 VAL HG22 1 1
4 1016 1 1 12 VAL HG23 H 7.076 -0.150 -4.888 1.00 . A A . 12 VAL HG23 1 1
4 1017 1 1 12 VAL N N 5.924 -0.936 -1.549 1.00 . A A . 12 VAL N 1 1
4 1018 1 1 12 VAL O O 8.118 0.785 0.417 1.00 . A A . 12 VAL O 1 1
4 1019 1 1 13 LEU C C 5.422 1.585 1.967 1.00 . A A . 13 LEU C 1 1
4 1020 1 1 13 LEU CA C 5.909 2.345 0.749 1.00 . A A . 13 LEU CA 1 1
4 1021 1 1 13 LEU CB C 4.980 3.502 0.402 1.00 . A A . 13 LEU CB 1 1
4 1022 1 1 13 LEU CD1 C 3.537 4.317 -1.485 1.00 . A A . 13 LEU CD1 1 1
4 1023 1 1 13 LEU CD2 C 5.930 5.032 -1.340 1.00 . A A . 13 LEU CD2 1 1
4 1024 1 1 13 LEU CG C 4.944 3.904 -1.076 1.00 . A A . 13 LEU CG 1 1
4 1025 1 1 13 LEU H H 5.374 1.258 -0.972 1.00 . A A . 13 LEU H 1 1
4 1026 1 1 13 LEU HA H 6.868 2.741 0.982 1.00 . A A . 13 LEU HA 1 1
4 1027 1 1 13 LEU HB2 H 3.981 3.245 0.715 1.00 . A A . 13 LEU HB2 1 1
4 1028 1 1 13 LEU HB3 H 5.315 4.357 0.975 1.00 . A A . 13 LEU HB3 1 1
4 1029 1 1 13 LEU HD11 H 3.579 5.243 -2.038 1.00 . A A . 13 LEU HD11 1 1
4 1030 1 1 13 LEU HD12 H 2.929 4.452 -0.602 1.00 . A A . 13 LEU HD12 1 1
4 1031 1 1 13 LEU HD13 H 3.103 3.546 -2.106 1.00 . A A . 13 LEU HD13 1 1
4 1032 1 1 13 LEU HD21 H 6.142 5.085 -2.398 1.00 . A A . 13 LEU HD21 1 1
4 1033 1 1 13 LEU HD22 H 6.846 4.845 -0.799 1.00 . A A . 13 LEU HD22 1 1
4 1034 1 1 13 LEU HD23 H 5.504 5.968 -1.011 1.00 . A A . 13 LEU HD23 1 1
4 1035 1 1 13 LEU HG H 5.232 3.060 -1.681 1.00 . A A . 13 LEU HG 1 1
4 1036 1 1 13 LEU N N 6.096 1.417 -0.332 1.00 . A A . 13 LEU N 1 1
4 1037 1 1 13 LEU O O 5.205 2.164 3.029 1.00 . A A . 13 LEU O 1 1
4 1038 1 1 14 ARG C C 6.011 -0.424 3.937 1.00 . A A . 14 ARG C 1 1
4 1039 1 1 14 ARG CA C 4.877 -0.548 2.942 1.00 . A A . 14 ARG CA 1 1
4 1040 1 1 14 ARG CB C 4.639 -2.010 2.545 1.00 . A A . 14 ARG CB 1 1
4 1041 1 1 14 ARG CD C 5.458 -4.290 3.185 1.00 . A A . 14 ARG CD 1 1
4 1042 1 1 14 ARG CG C 4.792 -3.018 3.679 1.00 . A A . 14 ARG CG 1 1
4 1043 1 1 14 ARG CZ C 7.592 -4.880 2.101 1.00 . A A . 14 ARG CZ 1 1
4 1044 1 1 14 ARG H H 5.489 -0.166 0.975 1.00 . A A . 14 ARG H 1 1
4 1045 1 1 14 ARG HA H 3.967 -0.124 3.314 1.00 . A A . 14 ARG HA 1 1
4 1046 1 1 14 ARG HB2 H 3.636 -2.100 2.162 1.00 . A A . 14 ARG HB2 1 1
4 1047 1 1 14 ARG HB3 H 5.333 -2.277 1.772 1.00 . A A . 14 ARG HB3 1 1
4 1048 1 1 14 ARG HD2 H 5.350 -5.056 3.937 1.00 . A A . 14 ARG HD2 1 1
4 1049 1 1 14 ARG HD3 H 4.965 -4.605 2.276 1.00 . A A . 14 ARG HD3 1 1
4 1050 1 1 14 ARG HE H 7.322 -3.332 3.334 1.00 . A A . 14 ARG HE 1 1
4 1051 1 1 14 ARG HG2 H 5.397 -2.586 4.462 1.00 . A A . 14 ARG HG2 1 1
4 1052 1 1 14 ARG HG3 H 3.815 -3.260 4.068 1.00 . A A . 14 ARG HG3 1 1
4 1053 1 1 14 ARG HH11 H 6.063 -6.133 1.677 1.00 . A A . 14 ARG HH11 1 1
4 1054 1 1 14 ARG HH12 H 7.568 -6.513 0.911 1.00 . A A . 14 ARG HH12 1 1
4 1055 1 1 14 ARG HH21 H 9.305 -3.831 2.324 1.00 . A A . 14 ARG HH21 1 1
4 1056 1 1 14 ARG HH22 H 9.408 -5.209 1.281 1.00 . A A . 14 ARG HH22 1 1
4 1057 1 1 14 ARG N N 5.285 0.261 1.826 1.00 . A A . 14 ARG N 1 1
4 1058 1 1 14 ARG NE N 6.879 -4.094 2.906 1.00 . A A . 14 ARG NE 1 1
4 1059 1 1 14 ARG NH1 N 7.028 -5.928 1.516 1.00 . A A . 14 ARG NH1 1 1
4 1060 1 1 14 ARG NH2 N 8.873 -4.618 1.884 1.00 . A A . 14 ARG NH2 1 1
4 1061 1 1 14 ARG O O 5.824 -0.256 5.143 1.00 . A A . 14 ARG O 1 1
4 1062 1 1 15 CYS C C 8.808 1.191 4.180 1.00 . A A . 15 CYS C 1 1
4 1063 1 1 15 CYS CA C 8.460 -0.294 4.065 1.00 . A A . 15 CYS CA 1 1
4 1064 1 1 15 CYS CB C 9.578 -1.009 3.313 1.00 . A A . 15 CYS CB 1 1
4 1065 1 1 15 CYS H H 7.238 -0.563 2.365 1.00 . A A . 15 CYS H 1 1
4 1066 1 1 15 CYS HA H 8.354 -0.720 5.050 1.00 . A A . 15 CYS HA 1 1
4 1067 1 1 15 CYS HB2 H 9.172 -1.433 2.410 1.00 . A A . 15 CYS HB2 1 1
4 1068 1 1 15 CYS HB3 H 10.337 -0.289 3.048 1.00 . A A . 15 CYS HB3 1 1
4 1069 1 1 15 CYS HG H 11.315 -2.158 4.275 1.00 . A A . 15 CYS HG 1 1
4 1070 1 1 15 CYS N N 7.207 -0.455 3.347 1.00 . A A . 15 CYS N 1 1
4 1071 1 1 15 CYS O O 9.680 1.573 4.961 1.00 . A A . 15 CYS O 1 1
4 1072 1 1 15 CYS SG S 10.373 -2.338 4.248 1.00 . A A . 15 CYS SG 1 1
4 1073 1 1 16 SER C C 8.893 3.995 4.661 1.00 . A A . 16 SER C 1 1
4 1074 1 1 16 SER CA C 8.370 3.466 3.325 1.00 . A A . 16 SER CA 1 1
4 1075 1 1 16 SER CB C 7.081 4.221 2.982 1.00 . A A . 16 SER CB 1 1
4 1076 1 1 16 SER H H 7.487 1.628 2.739 1.00 . A A . 16 SER H 1 1
4 1077 1 1 16 SER HA H 9.087 3.655 2.549 1.00 . A A . 16 SER HA 1 1
4 1078 1 1 16 SER HB2 H 6.967 4.270 1.914 1.00 . A A . 16 SER HB2 1 1
4 1079 1 1 16 SER HB3 H 6.239 3.708 3.415 1.00 . A A . 16 SER HB3 1 1
4 1080 1 1 16 SER HG H 6.538 5.611 4.256 1.00 . A A . 16 SER HG 1 1
4 1081 1 1 16 SER N N 8.133 2.016 3.364 1.00 . A A . 16 SER N 1 1
4 1082 1 1 16 SER O O 8.219 3.773 5.689 1.00 . A A . 16 SER O 1 1
4 1083 1 1 16 SER OXT O 9.973 4.623 4.666 1.00 . A A . 16 SER OXT 1 1
4 1084 1 1 16 SER OG O 7.111 5.546 3.488 1.00 . A A . 16 SER OG 1 1
5 1085 1 1 1 GLY C C -9.651 0.488 -0.789 1.00 . A A . 1 GLY C 1 1
5 1086 1 1 1 GLY CA C -10.173 0.547 -2.211 1.00 . A A . 1 GLY CA 1 1
5 1087 1 1 1 GLY H1 H -11.878 1.376 -3.087 1.00 . A A . 1 GLY H1 1 1
5 1088 1 1 1 GLY H2 H -11.963 1.260 -1.403 1.00 . A A . 1 GLY H2 1 1
5 1089 1 1 1 GLY H3 H -12.145 -0.126 -2.354 1.00 . A A . 1 GLY H3 1 1
5 1090 1 1 1 GLY HA2 H -9.948 -0.386 -2.703 1.00 . A A . 1 GLY HA2 1 1
5 1091 1 1 1 GLY HA3 H -9.671 1.348 -2.734 1.00 . A A . 1 GLY HA3 1 1
5 1092 1 1 1 GLY N N -11.642 0.781 -2.268 1.00 . A A . 1 GLY N 1 1
5 1093 1 1 1 GLY O O -10.032 -0.390 -0.016 1.00 . A A . 1 GLY O 1 1
5 1094 1 1 2 ARG C C -7.409 0.203 1.192 1.00 . A A . 2 ARG C 1 1
5 1095 1 1 2 ARG CA C -8.196 1.474 0.894 1.00 . A A . 2 ARG CA 1 1
5 1096 1 1 2 ARG CB C -9.294 1.663 1.942 1.00 . A A . 2 ARG CB 1 1
5 1097 1 1 2 ARG CD C -11.023 3.031 0.740 1.00 . A A . 2 ARG CD 1 1
5 1098 1 1 2 ARG CG C -9.993 3.010 1.857 1.00 . A A . 2 ARG CG 1 1
5 1099 1 1 2 ARG CZ C -11.255 4.105 -1.466 1.00 . A A . 2 ARG CZ 1 1
5 1100 1 1 2 ARG H H -8.507 2.097 -1.106 1.00 . A A . 2 ARG H 1 1
5 1101 1 1 2 ARG HA H -7.523 2.318 0.933 1.00 . A A . 2 ARG HA 1 1
5 1102 1 1 2 ARG HB2 H -10.034 0.888 1.814 1.00 . A A . 2 ARG HB2 1 1
5 1103 1 1 2 ARG HB3 H -8.856 1.572 2.925 1.00 . A A . 2 ARG HB3 1 1
5 1104 1 1 2 ARG HD2 H -11.326 2.017 0.527 1.00 . A A . 2 ARG HD2 1 1
5 1105 1 1 2 ARG HD3 H -11.879 3.600 1.070 1.00 . A A . 2 ARG HD3 1 1
5 1106 1 1 2 ARG HE H -9.520 3.690 -0.573 1.00 . A A . 2 ARG HE 1 1
5 1107 1 1 2 ARG HG2 H -10.489 3.207 2.795 1.00 . A A . 2 ARG HG2 1 1
5 1108 1 1 2 ARG HG3 H -9.255 3.776 1.669 1.00 . A A . 2 ARG HG3 1 1
5 1109 1 1 2 ARG HH11 H -13.011 3.653 -0.569 1.00 . A A . 2 ARG HH11 1 1
5 1110 1 1 2 ARG HH12 H -13.144 4.407 -2.122 1.00 . A A . 2 ARG HH12 1 1
5 1111 1 1 2 ARG HH21 H -9.695 4.679 -2.615 1.00 . A A . 2 ARG HH21 1 1
5 1112 1 1 2 ARG HH22 H -11.262 4.989 -3.283 1.00 . A A . 2 ARG HH22 1 1
5 1113 1 1 2 ARG N N -8.772 1.425 -0.444 1.00 . A A . 2 ARG N 1 1
5 1114 1 1 2 ARG NE N -10.494 3.634 -0.482 1.00 . A A . 2 ARG NE 1 1
5 1115 1 1 2 ARG NH1 N -12.578 4.050 -1.378 1.00 . A A . 2 ARG NH1 1 1
5 1116 1 1 2 ARG NH2 N -10.690 4.634 -2.544 1.00 . A A . 2 ARG NH2 1 1
5 1117 1 1 2 ARG O O -7.984 -0.827 1.541 1.00 . A A . 2 ARG O 1 1
5 1118 1 1 3 MET C C -5.550 -2.009 0.353 1.00 . A A . 3 MET C 1 1
5 1119 1 1 3 MET CA C -5.225 -0.864 1.308 1.00 . A A . 3 MET CA 1 1
5 1120 1 1 3 MET CB C -5.375 -1.327 2.759 1.00 . A A . 3 MET CB 1 1
5 1121 1 1 3 MET CE C -2.798 -0.266 4.447 1.00 . A A . 3 MET CE 1 1
5 1122 1 1 3 MET CG C -4.270 -2.266 3.216 1.00 . A A . 3 MET CG 1 1
5 1123 1 1 3 MET H H -5.687 1.131 0.773 1.00 . A A . 3 MET H 1 1
5 1124 1 1 3 MET HA H -4.205 -0.553 1.143 1.00 . A A . 3 MET HA 1 1
5 1125 1 1 3 MET HB2 H -5.371 -0.461 3.403 1.00 . A A . 3 MET HB2 1 1
5 1126 1 1 3 MET HB3 H -6.321 -1.839 2.866 1.00 . A A . 3 MET HB3 1 1
5 1127 1 1 3 MET HE1 H -2.034 0.488 4.320 1.00 . A A . 3 MET HE1 1 1
5 1128 1 1 3 MET HE2 H -2.682 -0.736 5.413 1.00 . A A . 3 MET HE2 1 1
5 1129 1 1 3 MET HE3 H -3.772 0.195 4.385 1.00 . A A . 3 MET HE3 1 1
5 1130 1 1 3 MET HG2 H -4.474 -2.572 4.231 1.00 . A A . 3 MET HG2 1 1
5 1131 1 1 3 MET HG3 H -4.268 -3.134 2.574 1.00 . A A . 3 MET HG3 1 1
5 1132 1 1 3 MET N N -6.089 0.282 1.053 1.00 . A A . 3 MET N 1 1
5 1133 1 1 3 MET O O -5.893 -3.113 0.779 1.00 . A A . 3 MET O 1 1
5 1134 1 1 3 MET SD S -2.639 -1.501 3.159 1.00 . A A . 3 MET SD 1 1
5 1135 1 1 4 LEU C C -5.231 -2.282 -3.326 1.00 . A A . 4 LEU C 1 1
5 1136 1 1 4 LEU CA C -5.713 -2.742 -1.964 1.00 . A A . 4 LEU CA 1 1
5 1137 1 1 4 LEU CB C -7.210 -3.073 -2.011 1.00 . A A . 4 LEU CB 1 1
5 1138 1 1 4 LEU CD1 C -6.822 -5.333 -3.029 1.00 . A A . 4 LEU CD1 1 1
5 1139 1 1 4 LEU CD2 C -7.200 -5.119 -0.566 1.00 . A A . 4 LEU CD2 1 1
5 1140 1 1 4 LEU CG C -7.549 -4.562 -1.937 1.00 . A A . 4 LEU CG 1 1
5 1141 1 1 4 LEU H H -5.156 -0.840 -1.218 1.00 . A A . 4 LEU H 1 1
5 1142 1 1 4 LEU HA H -5.179 -3.613 -1.711 1.00 . A A . 4 LEU HA 1 1
5 1143 1 1 4 LEU HB2 H -7.692 -2.574 -1.182 1.00 . A A . 4 LEU HB2 1 1
5 1144 1 1 4 LEU HB3 H -7.617 -2.680 -2.930 1.00 . A A . 4 LEU HB3 1 1
5 1145 1 1 4 LEU HD11 H -5.882 -4.848 -3.249 1.00 . A A . 4 LEU HD11 1 1
5 1146 1 1 4 LEU HD12 H -7.432 -5.355 -3.921 1.00 . A A . 4 LEU HD12 1 1
5 1147 1 1 4 LEU HD13 H -6.637 -6.342 -2.695 1.00 . A A . 4 LEU HD13 1 1
5 1148 1 1 4 LEU HD21 H -7.593 -4.466 0.198 1.00 . A A . 4 LEU HD21 1 1
5 1149 1 1 4 LEU HD22 H -6.126 -5.184 -0.467 1.00 . A A . 4 LEU HD22 1 1
5 1150 1 1 4 LEU HD23 H -7.631 -6.103 -0.457 1.00 . A A . 4 LEU HD23 1 1
5 1151 1 1 4 LEU HG H -8.611 -4.690 -2.090 1.00 . A A . 4 LEU HG 1 1
5 1152 1 1 4 LEU N N -5.437 -1.738 -0.942 1.00 . A A . 4 LEU N 1 1
5 1153 1 1 4 LEU O O -4.444 -2.958 -3.986 1.00 . A A . 4 LEU O 1 1
5 1154 1 1 5 PRO C C -4.053 0.233 -4.955 1.00 . A A . 5 PRO C 1 1
5 1155 1 1 5 PRO CA C -5.367 -0.532 -5.045 1.00 . A A . 5 PRO CA 1 1
5 1156 1 1 5 PRO CB C -6.566 0.406 -5.300 1.00 . A A . 5 PRO CB 1 1
5 1157 1 1 5 PRO CD C -6.651 -0.277 -3.051 1.00 . A A . 5 PRO CD 1 1
5 1158 1 1 5 PRO CG C -7.523 0.097 -4.186 1.00 . A A . 5 PRO CG 1 1
5 1159 1 1 5 PRO HA H -5.305 -1.275 -5.827 1.00 . A A . 5 PRO HA 1 1
5 1160 1 1 5 PRO HB2 H -6.236 1.435 -5.269 1.00 . A A . 5 PRO HB2 1 1
5 1161 1 1 5 PRO HB3 H -7.000 0.189 -6.265 1.00 . A A . 5 PRO HB3 1 1
5 1162 1 1 5 PRO HD2 H -6.168 0.594 -2.628 1.00 . A A . 5 PRO HD2 1 1
5 1163 1 1 5 PRO HD3 H -7.193 -0.830 -2.301 1.00 . A A . 5 PRO HD3 1 1
5 1164 1 1 5 PRO HG2 H -8.119 0.957 -3.941 1.00 . A A . 5 PRO HG2 1 1
5 1165 1 1 5 PRO HG3 H -8.143 -0.746 -4.451 1.00 . A A . 5 PRO HG3 1 1
5 1166 1 1 5 PRO N N -5.711 -1.125 -3.760 1.00 . A A . 5 PRO N 1 1
5 1167 1 1 5 PRO O O -3.459 0.607 -5.966 1.00 . A A . 5 PRO O 1 1
5 1168 1 1 6 GLN C C -1.427 0.249 -2.597 1.00 . A A . 6 GLN C 1 1
5 1169 1 1 6 GLN CA C -2.348 1.122 -3.453 1.00 . A A . 6 GLN CA 1 1
5 1170 1 1 6 GLN CB C -2.614 2.450 -2.739 1.00 . A A . 6 GLN CB 1 1
5 1171 1 1 6 GLN CD C -1.542 4.472 -1.666 1.00 . A A . 6 GLN CD 1 1
5 1172 1 1 6 GLN CG C -1.413 3.384 -2.714 1.00 . A A . 6 GLN CG 1 1
5 1173 1 1 6 GLN H H -4.119 0.093 -2.963 1.00 . A A . 6 GLN H 1 1
5 1174 1 1 6 GLN HA H -1.867 1.319 -4.398 1.00 . A A . 6 GLN HA 1 1
5 1175 1 1 6 GLN HB2 H -3.426 2.957 -3.239 1.00 . A A . 6 GLN HB2 1 1
5 1176 1 1 6 GLN HB3 H -2.904 2.246 -1.719 1.00 . A A . 6 GLN HB3 1 1
5 1177 1 1 6 GLN HE21 H -1.629 3.108 -0.222 1.00 . A A . 6 GLN HE21 1 1
5 1178 1 1 6 GLN HE22 H -1.728 4.753 0.294 1.00 . A A . 6 GLN HE22 1 1
5 1179 1 1 6 GLN HG2 H -0.526 2.805 -2.501 1.00 . A A . 6 GLN HG2 1 1
5 1180 1 1 6 GLN HG3 H -1.314 3.848 -3.683 1.00 . A A . 6 GLN HG3 1 1
5 1181 1 1 6 GLN N N -3.600 0.434 -3.720 1.00 . A A . 6 GLN N 1 1
5 1182 1 1 6 GLN NE2 N -1.642 4.070 -0.405 1.00 . A A . 6 GLN NE2 1 1
5 1183 1 1 6 GLN O O -0.313 0.649 -2.275 1.00 . A A . 6 GLN O 1 1
5 1184 1 1 6 GLN OE1 O -1.550 5.660 -1.986 1.00 . A A . 6 GLN OE1 1 1
5 1185 1 1 7 LEU C C 0.197 -2.230 -2.107 1.00 . A A . 7 LEU C 1 1
5 1186 1 1 7 LEU CA C -1.104 -1.854 -1.406 1.00 . A A . 7 LEU CA 1 1
5 1187 1 1 7 LEU CB C -1.906 -3.116 -1.082 1.00 . A A . 7 LEU CB 1 1
5 1188 1 1 7 LEU CD1 C -1.902 -4.533 0.992 1.00 . A A . 7 LEU CD1 1 1
5 1189 1 1 7 LEU CD2 C -0.916 -5.422 -1.126 1.00 . A A . 7 LEU CD2 1 1
5 1190 1 1 7 LEU CG C -1.148 -4.178 -0.281 1.00 . A A . 7 LEU CG 1 1
5 1191 1 1 7 LEU H H -2.799 -1.223 -2.505 1.00 . A A . 7 LEU H 1 1
5 1192 1 1 7 LEU HA H -0.868 -1.346 -0.490 1.00 . A A . 7 LEU HA 1 1
5 1193 1 1 7 LEU HB2 H -2.782 -2.823 -0.519 1.00 . A A . 7 LEU HB2 1 1
5 1194 1 1 7 LEU HB3 H -2.231 -3.559 -2.012 1.00 . A A . 7 LEU HB3 1 1
5 1195 1 1 7 LEU HD11 H -2.035 -3.644 1.590 1.00 . A A . 7 LEU HD11 1 1
5 1196 1 1 7 LEU HD12 H -1.338 -5.264 1.552 1.00 . A A . 7 LEU HD12 1 1
5 1197 1 1 7 LEU HD13 H -2.868 -4.942 0.735 1.00 . A A . 7 LEU HD13 1 1
5 1198 1 1 7 LEU HD21 H 0.019 -5.881 -0.842 1.00 . A A . 7 LEU HD21 1 1
5 1199 1 1 7 LEU HD22 H -0.879 -5.147 -2.170 1.00 . A A . 7 LEU HD22 1 1
5 1200 1 1 7 LEU HD23 H -1.724 -6.122 -0.967 1.00 . A A . 7 LEU HD23 1 1
5 1201 1 1 7 LEU HG H -0.184 -3.783 0.003 1.00 . A A . 7 LEU HG 1 1
5 1202 1 1 7 LEU N N -1.898 -0.946 -2.226 1.00 . A A . 7 LEU N 1 1
5 1203 1 1 7 LEU O O 1.235 -2.410 -1.469 1.00 . A A . 7 LEU O 1 1
5 1204 1 1 8 VAL C C 2.307 -1.554 -4.186 1.00 . A A . 8 VAL C 1 1
5 1205 1 1 8 VAL CA C 1.293 -2.675 -4.227 1.00 . A A . 8 VAL CA 1 1
5 1206 1 1 8 VAL CB C 0.904 -2.955 -5.691 1.00 . A A . 8 VAL CB 1 1
5 1207 1 1 8 VAL CG1 C 2.109 -3.437 -6.486 1.00 . A A . 8 VAL CG1 1 1
5 1208 1 1 8 VAL CG2 C -0.229 -3.968 -5.758 1.00 . A A . 8 VAL CG2 1 1
5 1209 1 1 8 VAL H H -0.721 -2.155 -3.865 1.00 . A A . 8 VAL H 1 1
5 1210 1 1 8 VAL HA H 1.738 -3.559 -3.815 1.00 . A A . 8 VAL HA 1 1
5 1211 1 1 8 VAL HB H 0.558 -2.031 -6.130 1.00 . A A . 8 VAL HB 1 1
5 1212 1 1 8 VAL HG11 H 2.078 -3.015 -7.479 1.00 . A A . 8 VAL HG11 1 1
5 1213 1 1 8 VAL HG12 H 2.089 -4.515 -6.551 1.00 . A A . 8 VAL HG12 1 1
5 1214 1 1 8 VAL HG13 H 3.016 -3.124 -5.990 1.00 . A A . 8 VAL HG13 1 1
5 1215 1 1 8 VAL HG21 H -0.099 -4.596 -6.627 1.00 . A A . 8 VAL HG21 1 1
5 1216 1 1 8 VAL HG22 H -1.173 -3.448 -5.828 1.00 . A A . 8 VAL HG22 1 1
5 1217 1 1 8 VAL HG23 H -0.218 -4.579 -4.867 1.00 . A A . 8 VAL HG23 1 1
5 1218 1 1 8 VAL N N 0.130 -2.331 -3.424 1.00 . A A . 8 VAL N 1 1
5 1219 1 1 8 VAL O O 3.399 -1.687 -3.620 1.00 . A A . 8 VAL O 1 1
5 1220 1 1 9 CYS C C 3.100 1.113 -3.330 1.00 . A A . 9 CYS C 1 1
5 1221 1 1 9 CYS CA C 2.786 0.733 -4.760 1.00 . A A . 9 CYS CA 1 1
5 1222 1 1 9 CYS CB C 2.133 1.901 -5.504 1.00 . A A . 9 CYS CB 1 1
5 1223 1 1 9 CYS H H 1.038 -0.385 -5.165 1.00 . A A . 9 CYS H 1 1
5 1224 1 1 9 CYS HA H 3.712 0.462 -5.246 1.00 . A A . 9 CYS HA 1 1
5 1225 1 1 9 CYS HB2 H 1.286 1.532 -6.063 1.00 . A A . 9 CYS HB2 1 1
5 1226 1 1 9 CYS HB3 H 1.792 2.632 -4.785 1.00 . A A . 9 CYS HB3 1 1
5 1227 1 1 9 CYS HG H 3.242 2.240 -7.483 1.00 . A A . 9 CYS HG 1 1
5 1228 1 1 9 CYS N N 1.925 -0.432 -4.759 1.00 . A A . 9 CYS N 1 1
5 1229 1 1 9 CYS O O 4.191 1.596 -3.035 1.00 . A A . 9 CYS O 1 1
5 1230 1 1 9 CYS SG S 3.234 2.742 -6.666 1.00 . A A . 9 CYS SG 1 1
5 1231 1 1 10 ARG C C 3.097 -0.049 -0.358 1.00 . A A . 10 ARG C 1 1
5 1232 1 1 10 ARG CA C 2.410 1.119 -1.024 1.00 . A A . 10 ARG CA 1 1
5 1233 1 1 10 ARG CB C 1.213 1.537 -0.211 1.00 . A A . 10 ARG CB 1 1
5 1234 1 1 10 ARG CD C 0.912 1.586 2.286 1.00 . A A . 10 ARG CD 1 1
5 1235 1 1 10 ARG CG C 1.681 2.149 1.101 1.00 . A A . 10 ARG CG 1 1
5 1236 1 1 10 ARG CZ C 1.327 -0.044 4.085 1.00 . A A . 10 ARG CZ 1 1
5 1237 1 1 10 ARG H H 1.318 0.411 -2.699 1.00 . A A . 10 ARG H 1 1
5 1238 1 1 10 ARG HA H 3.115 1.940 -1.011 1.00 . A A . 10 ARG HA 1 1
5 1239 1 1 10 ARG HB2 H 0.637 2.268 -0.762 1.00 . A A . 10 ARG HB2 1 1
5 1240 1 1 10 ARG HB3 H 0.601 0.676 0.007 1.00 . A A . 10 ARG HB3 1 1
5 1241 1 1 10 ARG HD2 H 0.838 2.349 3.045 1.00 . A A . 10 ARG HD2 1 1
5 1242 1 1 10 ARG HD3 H -0.079 1.311 1.954 1.00 . A A . 10 ARG HD3 1 1
5 1243 1 1 10 ARG HE H 2.212 -0.064 2.295 1.00 . A A . 10 ARG HE 1 1
5 1244 1 1 10 ARG HG2 H 2.752 1.930 1.227 1.00 . A A . 10 ARG HG2 1 1
5 1245 1 1 10 ARG HG3 H 1.540 3.217 1.058 1.00 . A A . 10 ARG HG3 1 1
5 1246 1 1 10 ARG HH11 H -0.027 1.386 4.545 1.00 . A A . 10 ARG HH11 1 1
5 1247 1 1 10 ARG HH12 H 0.283 0.228 5.795 1.00 . A A . 10 ARG HH12 1 1
5 1248 1 1 10 ARG HH21 H 2.618 -1.593 3.940 1.00 . A A . 10 ARG HH21 1 1
5 1249 1 1 10 ARG HH22 H 1.782 -1.463 5.452 1.00 . A A . 10 ARG HH22 1 1
5 1250 1 1 10 ARG N N 2.161 0.841 -2.423 1.00 . A A . 10 ARG N 1 1
5 1251 1 1 10 ARG NE N 1.564 0.411 2.857 1.00 . A A . 10 ARG NE 1 1
5 1252 1 1 10 ARG NH1 N 0.456 0.574 4.872 1.00 . A A . 10 ARG NH1 1 1
5 1253 1 1 10 ARG NH2 N 1.961 -1.121 4.529 1.00 . A A . 10 ARG NH2 1 1
5 1254 1 1 10 ARG O O 3.362 -0.008 0.820 1.00 . A A . 10 ARG O 1 1
5 1255 1 1 11 LEU C C 5.570 -1.697 -0.558 1.00 . A A . 11 LEU C 1 1
5 1256 1 1 11 LEU CA C 4.148 -2.203 -0.651 1.00 . A A . 11 LEU CA 1 1
5 1257 1 1 11 LEU CB C 4.051 -3.397 -1.606 1.00 . A A . 11 LEU CB 1 1
5 1258 1 1 11 LEU CD1 C 5.548 -5.015 -0.411 1.00 . A A . 11 LEU CD1 1 1
5 1259 1 1 11 LEU CD2 C 3.122 -4.888 0.184 1.00 . A A . 11 LEU CD2 1 1
5 1260 1 1 11 LEU CG C 4.143 -4.771 -0.939 1.00 . A A . 11 LEU CG 1 1
5 1261 1 1 11 LEU H H 3.182 -1.020 -2.046 1.00 . A A . 11 LEU H 1 1
5 1262 1 1 11 LEU HA H 3.790 -2.461 0.323 1.00 . A A . 11 LEU HA 1 1
5 1263 1 1 11 LEU HB2 H 3.109 -3.337 -2.132 1.00 . A A . 11 LEU HB2 1 1
5 1264 1 1 11 LEU HB3 H 4.851 -3.318 -2.327 1.00 . A A . 11 LEU HB3 1 1
5 1265 1 1 11 LEU HD11 H 6.224 -5.160 -1.241 1.00 . A A . 11 LEU HD11 1 1
5 1266 1 1 11 LEU HD12 H 5.550 -5.895 0.213 1.00 . A A . 11 LEU HD12 1 1
5 1267 1 1 11 LEU HD13 H 5.868 -4.162 0.168 1.00 . A A . 11 LEU HD13 1 1
5 1268 1 1 11 LEU HD21 H 2.215 -4.376 -0.101 1.00 . A A . 11 LEU HD21 1 1
5 1269 1 1 11 LEU HD22 H 3.522 -4.441 1.081 1.00 . A A . 11 LEU HD22 1 1
5 1270 1 1 11 LEU HD23 H 2.906 -5.930 0.366 1.00 . A A . 11 LEU HD23 1 1
5 1271 1 1 11 LEU HG H 3.925 -5.535 -1.672 1.00 . A A . 11 LEU HG 1 1
5 1272 1 1 11 LEU N N 3.405 -1.066 -1.133 1.00 . A A . 11 LEU N 1 1
5 1273 1 1 11 LEU O O 6.291 -1.917 0.422 1.00 . A A . 11 LEU O 1 1
5 1274 1 1 12 VAL C C 7.192 0.747 -0.406 1.00 . A A . 12 VAL C 1 1
5 1275 1 1 12 VAL CA C 7.216 -0.244 -1.545 1.00 . A A . 12 VAL CA 1 1
5 1276 1 1 12 VAL CB C 7.526 0.471 -2.871 1.00 . A A . 12 VAL CB 1 1
5 1277 1 1 12 VAL CG1 C 8.882 1.159 -2.811 1.00 . A A . 12 VAL CG1 1 1
5 1278 1 1 12 VAL CG2 C 7.468 -0.511 -4.032 1.00 . A A . 12 VAL CG2 1 1
5 1279 1 1 12 VAL H H 5.274 -0.689 -2.279 1.00 . A A . 12 VAL H 1 1
5 1280 1 1 12 VAL HA H 7.959 -0.977 -1.342 1.00 . A A . 12 VAL HA 1 1
5 1281 1 1 12 VAL HB H 6.772 1.225 -3.029 1.00 . A A . 12 VAL HB 1 1
5 1282 1 1 12 VAL HG11 H 8.814 2.034 -2.181 1.00 . A A . 12 VAL HG11 1 1
5 1283 1 1 12 VAL HG12 H 9.180 1.455 -3.805 1.00 . A A . 12 VAL HG12 1 1
5 1284 1 1 12 VAL HG13 H 9.614 0.478 -2.403 1.00 . A A . 12 VAL HG13 1 1
5 1285 1 1 12 VAL HG21 H 6.629 -1.177 -3.898 1.00 . A A . 12 VAL HG21 1 1
5 1286 1 1 12 VAL HG22 H 8.382 -1.086 -4.064 1.00 . A A . 12 VAL HG22 1 1
5 1287 1 1 12 VAL HG23 H 7.352 0.033 -4.958 1.00 . A A . 12 VAL HG23 1 1
5 1288 1 1 12 VAL N N 5.927 -0.897 -1.559 1.00 . A A . 12 VAL N 1 1
5 1289 1 1 12 VAL O O 8.110 0.825 0.417 1.00 . A A . 12 VAL O 1 1
5 1290 1 1 13 LEU C C 5.405 1.574 1.996 1.00 . A A . 13 LEU C 1 1
5 1291 1 1 13 LEU CA C 5.887 2.354 0.789 1.00 . A A . 13 LEU CA 1 1
5 1292 1 1 13 LEU CB C 4.959 3.518 0.465 1.00 . A A . 13 LEU CB 1 1
5 1293 1 1 13 LEU CD1 C 3.513 4.557 -1.301 1.00 . A A . 13 LEU CD1 1 1
5 1294 1 1 13 LEU CD2 C 5.999 4.801 -1.419 1.00 . A A . 13 LEU CD2 1 1
5 1295 1 1 13 LEU CG C 4.849 3.890 -1.015 1.00 . A A . 13 LEU CG 1 1
5 1296 1 1 13 LEU H H 5.351 1.288 -0.946 1.00 . A A . 13 LEU H 1 1
5 1297 1 1 13 LEU HA H 6.847 2.746 1.027 1.00 . A A . 13 LEU HA 1 1
5 1298 1 1 13 LEU HB2 H 3.974 3.285 0.836 1.00 . A A . 13 LEU HB2 1 1
5 1299 1 1 13 LEU HB3 H 5.336 4.381 1.001 1.00 . A A . 13 LEU HB3 1 1
5 1300 1 1 13 LEU HD11 H 3.170 5.071 -0.415 1.00 . A A . 13 LEU HD11 1 1
5 1301 1 1 13 LEU HD12 H 2.789 3.808 -1.585 1.00 . A A . 13 LEU HD12 1 1
5 1302 1 1 13 LEU HD13 H 3.630 5.268 -2.105 1.00 . A A . 13 LEU HD13 1 1
5 1303 1 1 13 LEU HD21 H 5.949 4.993 -2.481 1.00 . A A . 13 LEU HD21 1 1
5 1304 1 1 13 LEU HD22 H 6.938 4.321 -1.185 1.00 . A A . 13 LEU HD22 1 1
5 1305 1 1 13 LEU HD23 H 5.927 5.733 -0.880 1.00 . A A . 13 LEU HD23 1 1
5 1306 1 1 13 LEU HG H 4.907 2.993 -1.610 1.00 . A A . 13 LEU HG 1 1
5 1307 1 1 13 LEU N N 6.075 1.445 -0.307 1.00 . A A . 13 LEU N 1 1
5 1308 1 1 13 LEU O O 5.186 2.137 3.066 1.00 . A A . 13 LEU O 1 1
5 1309 1 1 14 ARG C C 5.994 -0.447 3.944 1.00 . A A . 14 ARG C 1 1
5 1310 1 1 14 ARG CA C 4.867 -0.575 2.940 1.00 . A A . 14 ARG CA 1 1
5 1311 1 1 14 ARG CB C 4.650 -2.039 2.530 1.00 . A A . 14 ARG CB 1 1
5 1312 1 1 14 ARG CD C 5.630 -4.264 3.158 1.00 . A A . 14 ARG CD 1 1
5 1313 1 1 14 ARG CG C 4.845 -3.058 3.649 1.00 . A A . 14 ARG CG 1 1
5 1314 1 1 14 ARG CZ C 7.976 -4.797 2.621 1.00 . A A . 14 ARG CZ 1 1
5 1315 1 1 14 ARG H H 5.478 -0.161 0.979 1.00 . A A . 14 ARG H 1 1
5 1316 1 1 14 ARG HA H 3.949 -0.164 3.307 1.00 . A A . 14 ARG HA 1 1
5 1317 1 1 14 ARG HB2 H 3.641 -2.145 2.164 1.00 . A A . 14 ARG HB2 1 1
5 1318 1 1 14 ARG HB3 H 5.333 -2.282 1.739 1.00 . A A . 14 ARG HB3 1 1
5 1319 1 1 14 ARG HD2 H 5.667 -5.000 3.946 1.00 . A A . 14 ARG HD2 1 1
5 1320 1 1 14 ARG HD3 H 5.123 -4.679 2.300 1.00 . A A . 14 ARG HD3 1 1
5 1321 1 1 14 ARG HE H 7.190 -2.963 2.617 1.00 . A A . 14 ARG HE 1 1
5 1322 1 1 14 ARG HG2 H 5.382 -2.597 4.463 1.00 . A A . 14 ARG HG2 1 1
5 1323 1 1 14 ARG HG3 H 3.876 -3.388 3.995 1.00 . A A . 14 ARG HG3 1 1
5 1324 1 1 14 ARG HH11 H 6.841 -6.401 3.101 1.00 . A A . 14 ARG HH11 1 1
5 1325 1 1 14 ARG HH12 H 8.491 -6.749 2.711 1.00 . A A . 14 ARG HH12 1 1
5 1326 1 1 14 ARG HH21 H 9.357 -3.420 2.095 1.00 . A A . 14 ARG HH21 1 1
5 1327 1 1 14 ARG HH22 H 9.923 -5.055 2.144 1.00 . A A . 14 ARG HH22 1 1
5 1328 1 1 14 ARG N N 5.273 0.252 1.836 1.00 . A A . 14 ARG N 1 1
5 1329 1 1 14 ARG NE N 6.995 -3.910 2.774 1.00 . A A . 14 ARG NE 1 1
5 1330 1 1 14 ARG NH1 N 7.751 -6.088 2.828 1.00 . A A . 14 ARG NH1 1 1
5 1331 1 1 14 ARG NH2 N 9.185 -4.391 2.256 1.00 . A A . 14 ARG NH2 1 1
5 1332 1 1 14 ARG O O 5.796 -0.300 5.151 1.00 . A A . 14 ARG O 1 1
5 1333 1 1 15 CYS C C 8.795 1.191 4.196 1.00 . A A . 15 CYS C 1 1
5 1334 1 1 15 CYS CA C 8.442 -0.293 4.085 1.00 . A A . 15 CYS CA 1 1
5 1335 1 1 15 CYS CB C 9.562 -1.014 3.342 1.00 . A A . 15 CYS CB 1 1
5 1336 1 1 15 CYS H H 7.231 -0.552 2.377 1.00 . A A . 15 CYS H 1 1
5 1337 1 1 15 CYS HA H 8.328 -0.715 5.071 1.00 . A A . 15 CYS HA 1 1
5 1338 1 1 15 CYS HB2 H 9.156 -1.451 2.445 1.00 . A A . 15 CYS HB2 1 1
5 1339 1 1 15 CYS HB3 H 10.319 -0.297 3.066 1.00 . A A . 15 CYS HB3 1 1
5 1340 1 1 15 CYS HG H 11.271 -2.068 4.453 1.00 . A A . 15 CYS HG 1 1
5 1341 1 1 15 CYS N N 7.194 -0.456 3.361 1.00 . A A . 15 CYS N 1 1
5 1342 1 1 15 CYS O O 9.665 1.570 4.980 1.00 . A A . 15 CYS O 1 1
5 1343 1 1 15 CYS SG S 10.362 -2.330 4.292 1.00 . A A . 15 CYS SG 1 1
5 1344 1 1 16 SER C C 8.891 3.993 4.674 1.00 . A A . 16 SER C 1 1
5 1345 1 1 16 SER CA C 8.375 3.465 3.334 1.00 . A A . 16 SER CA 1 1
5 1346 1 1 16 SER CB C 7.097 4.229 2.974 1.00 . A A . 16 SER CB 1 1
5 1347 1 1 16 SER H H 7.483 1.632 2.748 1.00 . A A . 16 SER H 1 1
5 1348 1 1 16 SER HA H 9.103 3.646 2.565 1.00 . A A . 16 SER HA 1 1
5 1349 1 1 16 SER HB2 H 7.016 4.307 1.903 1.00 . A A . 16 SER HB2 1 1
5 1350 1 1 16 SER HB3 H 6.243 3.703 3.365 1.00 . A A . 16 SER HB3 1 1
5 1351 1 1 16 SER HG H 7.479 6.149 2.876 1.00 . A A . 16 SER HG 1 1
5 1352 1 1 16 SER N N 8.129 2.017 3.374 1.00 . A A . 16 SER N 1 1
5 1353 1 1 16 SER O O 8.356 3.571 5.721 1.00 . A A . 16 SER O 1 1
5 1354 1 1 16 SER OXT O 9.825 4.823 4.662 1.00 . A A . 16 SER OXT 1 1
5 1355 1 1 16 SER OG O 7.107 5.539 3.518 1.00 . A A . 16 SER OG 1 1
6 1356 1 1 1 GLY C C -10.212 -0.624 -4.027 1.00 . A A . 1 GLY C 1 1
6 1357 1 1 1 GLY CA C -10.411 -0.622 -5.530 1.00 . A A . 1 GLY CA 1 1
6 1358 1 1 1 GLY H1 H -11.758 0.931 -5.902 1.00 . A A . 1 GLY H1 1 1
6 1359 1 1 1 GLY H2 H -12.479 -0.465 -5.274 1.00 . A A . 1 GLY H2 1 1
6 1360 1 1 1 GLY H3 H -11.983 -0.423 -6.892 1.00 . A A . 1 GLY H3 1 1
6 1361 1 1 1 GLY HA2 H -10.301 -1.632 -5.898 1.00 . A A . 1 GLY HA2 1 1
6 1362 1 1 1 GLY HA3 H -9.652 -0.002 -5.982 1.00 . A A . 1 GLY HA3 1 1
6 1363 1 1 1 GLY N N -11.752 -0.110 -5.927 1.00 . A A . 1 GLY N 1 1
6 1364 1 1 1 GLY O O -10.875 -1.370 -3.306 1.00 . A A . 1 GLY O 1 1
6 1365 1 1 2 ARG C C -8.446 -0.997 -1.585 1.00 . A A . 2 ARG C 1 1
6 1366 1 1 2 ARG CA C -9.009 0.315 -2.125 1.00 . A A . 2 ARG CA 1 1
6 1367 1 1 2 ARG CB C -10.275 0.696 -1.352 1.00 . A A . 2 ARG CB 1 1
6 1368 1 1 2 ARG CD C -10.727 2.919 -2.432 1.00 . A A . 2 ARG CD 1 1
6 1369 1 1 2 ARG CG C -10.425 2.192 -1.132 1.00 . A A . 2 ARG CG 1 1
6 1370 1 1 2 ARG CZ C -9.499 4.356 -4.014 1.00 . A A . 2 ARG CZ 1 1
6 1371 1 1 2 ARG H H -8.803 0.787 -4.179 1.00 . A A . 2 ARG H 1 1
6 1372 1 1 2 ARG HA H -8.271 1.091 -1.990 1.00 . A A . 2 ARG HA 1 1
6 1373 1 1 2 ARG HB2 H -11.137 0.346 -1.902 1.00 . A A . 2 ARG HB2 1 1
6 1374 1 1 2 ARG HB3 H -10.253 0.212 -0.387 1.00 . A A . 2 ARG HB3 1 1
6 1375 1 1 2 ARG HD2 H -11.232 2.239 -3.102 1.00 . A A . 2 ARG HD2 1 1
6 1376 1 1 2 ARG HD3 H -11.372 3.759 -2.218 1.00 . A A . 2 ARG HD3 1 1
6 1377 1 1 2 ARG HE H -8.660 3.005 -2.807 1.00 . A A . 2 ARG HE 1 1
6 1378 1 1 2 ARG HG2 H -11.235 2.364 -0.439 1.00 . A A . 2 ARG HG2 1 1
6 1379 1 1 2 ARG HG3 H -9.506 2.578 -0.717 1.00 . A A . 2 ARG HG3 1 1
6 1380 1 1 2 ARG HH11 H -11.503 4.628 -4.020 1.00 . A A . 2 ARG HH11 1 1
6 1381 1 1 2 ARG HH12 H -10.614 5.631 -5.117 1.00 . A A . 2 ARG HH12 1 1
6 1382 1 1 2 ARG HH21 H -7.492 4.325 -4.249 1.00 . A A . 2 ARG HH21 1 1
6 1383 1 1 2 ARG HH22 H -8.339 5.460 -5.247 1.00 . A A . 2 ARG HH22 1 1
6 1384 1 1 2 ARG N N -9.297 0.217 -3.553 1.00 . A A . 2 ARG N 1 1
6 1385 1 1 2 ARG NE N -9.512 3.406 -3.082 1.00 . A A . 2 ARG NE 1 1
6 1386 1 1 2 ARG NH1 N -10.632 4.917 -4.416 1.00 . A A . 2 ARG NH1 1 1
6 1387 1 1 2 ARG NH2 N -8.349 4.745 -4.548 1.00 . A A . 2 ARG NH2 1 1
6 1388 1 1 2 ARG O O -9.010 -2.067 -1.813 1.00 . A A . 2 ARG O 1 1
6 1389 1 1 3 MET C C -6.300 -3.079 -1.371 1.00 . A A . 3 MET C 1 1
6 1390 1 1 3 MET CA C -6.689 -2.077 -0.287 1.00 . A A . 3 MET CA 1 1
6 1391 1 1 3 MET CB C -7.618 -2.741 0.733 1.00 . A A . 3 MET CB 1 1
6 1392 1 1 3 MET CE C -8.278 -5.075 3.645 1.00 . A A . 3 MET CE 1 1
6 1393 1 1 3 MET CG C -6.927 -3.785 1.598 1.00 . A A . 3 MET CG 1 1
6 1394 1 1 3 MET H H -6.933 -0.019 -0.718 1.00 . A A . 3 MET H 1 1
6 1395 1 1 3 MET HA H -5.793 -1.748 0.218 1.00 . A A . 3 MET HA 1 1
6 1396 1 1 3 MET HB2 H -8.025 -1.979 1.381 1.00 . A A . 3 MET HB2 1 1
6 1397 1 1 3 MET HB3 H -8.428 -3.222 0.205 1.00 . A A . 3 MET HB3 1 1
6 1398 1 1 3 MET HE1 H -8.537 -5.132 4.692 1.00 . A A . 3 MET HE1 1 1
6 1399 1 1 3 MET HE2 H -7.701 -5.946 3.369 1.00 . A A . 3 MET HE2 1 1
6 1400 1 1 3 MET HE3 H -9.179 -5.036 3.051 1.00 . A A . 3 MET HE3 1 1
6 1401 1 1 3 MET HG2 H -7.245 -4.766 1.278 1.00 . A A . 3 MET HG2 1 1
6 1402 1 1 3 MET HG3 H -5.858 -3.694 1.464 1.00 . A A . 3 MET HG3 1 1
6 1403 1 1 3 MET N N -7.331 -0.902 -0.866 1.00 . A A . 3 MET N 1 1
6 1404 1 1 3 MET O O -6.637 -4.261 -1.288 1.00 . A A . 3 MET O 1 1
6 1405 1 1 3 MET SD S -7.305 -3.600 3.351 1.00 . A A . 3 MET SD 1 1
6 1406 1 1 4 LEU C C -4.387 -2.651 -4.535 1.00 . A A . 4 LEU C 1 1
6 1407 1 1 4 LEU CA C -5.144 -3.449 -3.487 1.00 . A A . 4 LEU CA 1 1
6 1408 1 1 4 LEU CB C -6.330 -4.175 -4.131 1.00 . A A . 4 LEU CB 1 1
6 1409 1 1 4 LEU CD1 C -4.885 -5.667 -5.535 1.00 . A A . 4 LEU CD1 1 1
6 1410 1 1 4 LEU CD2 C -5.759 -6.488 -3.344 1.00 . A A . 4 LEU CD2 1 1
6 1411 1 1 4 LEU CG C -6.048 -5.618 -4.557 1.00 . A A . 4 LEU CG 1 1
6 1412 1 1 4 LEU H H -5.345 -1.649 -2.387 1.00 . A A . 4 LEU H 1 1
6 1413 1 1 4 LEU HA H -4.482 -4.164 -3.089 1.00 . A A . 4 LEU HA 1 1
6 1414 1 1 4 LEU HB2 H -7.148 -4.182 -3.426 1.00 . A A . 4 LEU HB2 1 1
6 1415 1 1 4 LEU HB3 H -6.635 -3.619 -5.005 1.00 . A A . 4 LEU HB3 1 1
6 1416 1 1 4 LEU HD11 H -5.182 -5.218 -6.472 1.00 . A A . 4 LEU HD11 1 1
6 1417 1 1 4 LEU HD12 H -4.599 -6.695 -5.704 1.00 . A A . 4 LEU HD12 1 1
6 1418 1 1 4 LEU HD13 H -4.047 -5.123 -5.125 1.00 . A A . 4 LEU HD13 1 1
6 1419 1 1 4 LEU HD21 H -5.365 -5.876 -2.547 1.00 . A A . 4 LEU HD21 1 1
6 1420 1 1 4 LEU HD22 H -5.033 -7.244 -3.608 1.00 . A A . 4 LEU HD22 1 1
6 1421 1 1 4 LEU HD23 H -6.671 -6.965 -3.017 1.00 . A A . 4 LEU HD23 1 1
6 1422 1 1 4 LEU HG H -6.921 -6.015 -5.056 1.00 . A A . 4 LEU HG 1 1
6 1423 1 1 4 LEU N N -5.586 -2.598 -2.384 1.00 . A A . 4 LEU N 1 1
6 1424 1 1 4 LEU O O -3.291 -3.027 -4.953 1.00 . A A . 4 LEU O 1 1
6 1425 1 1 5 PRO C C -3.355 0.255 -5.403 1.00 . A A . 5 PRO C 1 1
6 1426 1 1 5 PRO CA C -4.407 -0.672 -6.000 1.00 . A A . 5 PRO CA 1 1
6 1427 1 1 5 PRO CB C -5.644 0.101 -6.495 1.00 . A A . 5 PRO CB 1 1
6 1428 1 1 5 PRO CD C -6.276 -1.059 -4.555 1.00 . A A . 5 PRO CD 1 1
6 1429 1 1 5 PRO CG C -6.798 -0.618 -5.863 1.00 . A A . 5 PRO CG 1 1
6 1430 1 1 5 PRO HA H -3.974 -1.235 -6.814 1.00 . A A . 5 PRO HA 1 1
6 1431 1 1 5 PRO HB2 H -5.587 1.130 -6.169 1.00 . A A . 5 PRO HB2 1 1
6 1432 1 1 5 PRO HB3 H -5.694 0.059 -7.572 1.00 . A A . 5 PRO HB3 1 1
6 1433 1 1 5 PRO HD2 H -6.186 -0.228 -3.870 1.00 . A A . 5 PRO HD2 1 1
6 1434 1 1 5 PRO HD3 H -6.875 -1.852 -4.136 1.00 . A A . 5 PRO HD3 1 1
6 1435 1 1 5 PRO HG2 H -7.639 0.037 -5.736 1.00 . A A . 5 PRO HG2 1 1
6 1436 1 1 5 PRO HG3 H -7.062 -1.486 -6.449 1.00 . A A . 5 PRO HG3 1 1
6 1437 1 1 5 PRO N N -4.977 -1.550 -4.980 1.00 . A A . 5 PRO N 1 1
6 1438 1 1 5 PRO O O -2.514 0.807 -6.113 1.00 . A A . 5 PRO O 1 1
6 1439 1 1 6 GLN C C -1.564 0.332 -2.468 1.00 . A A . 6 GLN C 1 1
6 1440 1 1 6 GLN CA C -2.446 1.213 -3.354 1.00 . A A . 6 GLN CA 1 1
6 1441 1 1 6 GLN CB C -3.180 2.249 -2.501 1.00 . A A . 6 GLN CB 1 1
6 1442 1 1 6 GLN CD C -2.999 4.710 -1.962 1.00 . A A . 6 GLN CD 1 1
6 1443 1 1 6 GLN CG C -2.286 3.373 -2.003 1.00 . A A . 6 GLN CG 1 1
6 1444 1 1 6 GLN H H -4.084 -0.095 -3.576 1.00 . A A . 6 GLN H 1 1
6 1445 1 1 6 GLN HA H -1.823 1.721 -4.075 1.00 . A A . 6 GLN HA 1 1
6 1446 1 1 6 GLN HB2 H -3.974 2.685 -3.089 1.00 . A A . 6 GLN HB2 1 1
6 1447 1 1 6 GLN HB3 H -3.610 1.754 -1.643 1.00 . A A . 6 GLN HB3 1 1
6 1448 1 1 6 GLN HE21 H -3.204 4.570 0.010 1.00 . A A . 6 GLN HE21 1 1
6 1449 1 1 6 GLN HE22 H -3.857 5.997 -0.712 1.00 . A A . 6 GLN HE22 1 1
6 1450 1 1 6 GLN HG2 H -1.949 3.132 -1.005 1.00 . A A . 6 GLN HG2 1 1
6 1451 1 1 6 GLN HG3 H -1.433 3.455 -2.659 1.00 . A A . 6 GLN HG3 1 1
6 1452 1 1 6 GLN N N -3.399 0.391 -4.082 1.00 . A A . 6 GLN N 1 1
6 1453 1 1 6 GLN NE2 N -3.393 5.136 -0.767 1.00 . A A . 6 GLN NE2 1 1
6 1454 1 1 6 GLN O O -0.593 0.802 -1.882 1.00 . A A . 6 GLN O 1 1
6 1455 1 1 6 GLN OE1 O -3.193 5.354 -2.993 1.00 . A A . 6 GLN OE1 1 1
6 1456 1 1 7 LEU C C 0.163 -2.254 -2.219 1.00 . A A . 7 LEU C 1 1
6 1457 1 1 7 LEU CA C -1.169 -1.908 -1.568 1.00 . A A . 7 LEU CA 1 1
6 1458 1 1 7 LEU CB C -1.995 -3.180 -1.366 1.00 . A A . 7 LEU CB 1 1
6 1459 1 1 7 LEU CD1 C -2.603 -3.403 1.054 1.00 . A A . 7 LEU CD1 1 1
6 1460 1 1 7 LEU CD2 C -1.939 -5.426 -0.259 1.00 . A A . 7 LEU CD2 1 1
6 1461 1 1 7 LEU CG C -1.720 -3.933 -0.065 1.00 . A A . 7 LEU CG 1 1
6 1462 1 1 7 LEU H H -2.702 -1.268 -2.869 1.00 . A A . 7 LEU H 1 1
6 1463 1 1 7 LEU HA H -0.985 -1.457 -0.615 1.00 . A A . 7 LEU HA 1 1
6 1464 1 1 7 LEU HB2 H -3.041 -2.912 -1.389 1.00 . A A . 7 LEU HB2 1 1
6 1465 1 1 7 LEU HB3 H -1.794 -3.848 -2.190 1.00 . A A . 7 LEU HB3 1 1
6 1466 1 1 7 LEU HD11 H -2.852 -4.209 1.729 1.00 . A A . 7 LEU HD11 1 1
6 1467 1 1 7 LEU HD12 H -3.509 -2.994 0.634 1.00 . A A . 7 LEU HD12 1 1
6 1468 1 1 7 LEU HD13 H -2.076 -2.631 1.594 1.00 . A A . 7 LEU HD13 1 1
6 1469 1 1 7 LEU HD21 H -2.314 -5.858 0.657 1.00 . A A . 7 LEU HD21 1 1
6 1470 1 1 7 LEU HD22 H -1.002 -5.896 -0.522 1.00 . A A . 7 LEU HD22 1 1
6 1471 1 1 7 LEU HD23 H -2.656 -5.585 -1.052 1.00 . A A . 7 LEU HD23 1 1
6 1472 1 1 7 LEU HG H -0.690 -3.779 0.221 1.00 . A A . 7 LEU HG 1 1
6 1473 1 1 7 LEU N N -1.917 -0.953 -2.377 1.00 . A A . 7 LEU N 1 1
6 1474 1 1 7 LEU O O 1.174 -2.452 -1.541 1.00 . A A . 7 LEU O 1 1
6 1475 1 1 8 VAL C C 2.343 -1.491 -4.211 1.00 . A A . 8 VAL C 1 1
6 1476 1 1 8 VAL CA C 1.353 -2.628 -4.302 1.00 . A A . 8 VAL CA 1 1
6 1477 1 1 8 VAL CB C 1.026 -2.901 -5.781 1.00 . A A . 8 VAL CB 1 1
6 1478 1 1 8 VAL CG1 C 2.262 -3.388 -6.522 1.00 . A A . 8 VAL CG1 1 1
6 1479 1 1 8 VAL CG2 C -0.107 -3.911 -5.899 1.00 . A A . 8 VAL CG2 1 1
6 1480 1 1 8 VAL H H -0.677 -2.125 -4.009 1.00 . A A . 8 VAL H 1 1
6 1481 1 1 8 VAL HA H 1.795 -3.508 -3.881 1.00 . A A . 8 VAL HA 1 1
6 1482 1 1 8 VAL HB H 0.703 -1.975 -6.233 1.00 . A A . 8 VAL HB 1 1
6 1483 1 1 8 VAL HG11 H 2.025 -3.529 -7.566 1.00 . A A . 8 VAL HG11 1 1
6 1484 1 1 8 VAL HG12 H 2.590 -4.325 -6.097 1.00 . A A . 8 VAL HG12 1 1
6 1485 1 1 8 VAL HG13 H 3.050 -2.656 -6.427 1.00 . A A . 8 VAL HG13 1 1
6 1486 1 1 8 VAL HG21 H 0.011 -4.480 -6.810 1.00 . A A . 8 VAL HG21 1 1
6 1487 1 1 8 VAL HG22 H -1.053 -3.389 -5.921 1.00 . A A . 8 VAL HG22 1 1
6 1488 1 1 8 VAL HG23 H -0.083 -4.579 -5.051 1.00 . A A . 8 VAL HG23 1 1
6 1489 1 1 8 VAL N N 0.155 -2.312 -3.539 1.00 . A A . 8 VAL N 1 1
6 1490 1 1 8 VAL O O 3.459 -1.645 -3.708 1.00 . A A . 8 VAL O 1 1
6 1491 1 1 9 CYS C C 3.058 1.163 -3.168 1.00 . A A . 9 CYS C 1 1
6 1492 1 1 9 CYS CA C 2.756 0.839 -4.616 1.00 . A A . 9 CYS CA 1 1
6 1493 1 1 9 CYS CB C 2.094 2.028 -5.313 1.00 . A A . 9 CYS CB 1 1
6 1494 1 1 9 CYS H H 1.013 -0.277 -5.039 1.00 . A A . 9 CYS H 1 1
6 1495 1 1 9 CYS HA H 3.690 0.602 -5.105 1.00 . A A . 9 CYS HA 1 1
6 1496 1 1 9 CYS HB2 H 1.820 1.741 -6.317 1.00 . A A . 9 CYS HB2 1 1
6 1497 1 1 9 CYS HB3 H 1.203 2.305 -4.767 1.00 . A A . 9 CYS HB3 1 1
6 1498 1 1 9 CYS HG H 3.308 3.817 -4.541 1.00 . A A . 9 CYS HG 1 1
6 1499 1 1 9 CYS N N 1.917 -0.338 -4.674 1.00 . A A . 9 CYS N 1 1
6 1500 1 1 9 CYS O O 4.132 1.672 -2.856 1.00 . A A . 9 CYS O 1 1
6 1501 1 1 9 CYS SG S 3.146 3.494 -5.431 1.00 . A A . 9 CYS SG 1 1
6 1502 1 1 10 ARG C C 3.058 -0.138 -0.219 1.00 . A A . 10 ARG C 1 1
6 1503 1 1 10 ARG CA C 2.385 1.052 -0.861 1.00 . A A . 10 ARG CA 1 1
6 1504 1 1 10 ARG CB C 1.202 1.478 -0.035 1.00 . A A . 10 ARG CB 1 1
6 1505 1 1 10 ARG CD C 0.945 1.488 2.466 1.00 . A A . 10 ARG CD 1 1
6 1506 1 1 10 ARG CG C 1.693 2.072 1.277 1.00 . A A . 10 ARG CG 1 1
6 1507 1 1 10 ARG CZ C 1.259 -0.318 4.112 1.00 . A A . 10 ARG CZ 1 1
6 1508 1 1 10 ARG H H 1.302 0.372 -2.560 1.00 . A A . 10 ARG H 1 1
6 1509 1 1 10 ARG HA H 3.106 1.861 -0.829 1.00 . A A . 10 ARG HA 1 1
6 1510 1 1 10 ARG HB2 H 0.632 2.222 -0.574 1.00 . A A . 10 ARG HB2 1 1
6 1511 1 1 10 ARG HB3 H 0.581 0.623 0.181 1.00 . A A . 10 ARG HB3 1 1
6 1512 1 1 10 ARG HD2 H 0.936 2.216 3.262 1.00 . A A . 10 ARG HD2 1 1
6 1513 1 1 10 ARG HD3 H -0.069 1.272 2.162 1.00 . A A . 10 ARG HD3 1 1
6 1514 1 1 10 ARG HE H 2.247 -0.159 2.385 1.00 . A A . 10 ARG HE 1 1
6 1515 1 1 10 ARG HG2 H 2.768 1.852 1.380 1.00 . A A . 10 ARG HG2 1 1
6 1516 1 1 10 ARG HG3 H 1.549 3.140 1.253 1.00 . A A . 10 ARG HG3 1 1
6 1517 1 1 10 ARG HH11 H -0.124 1.061 4.638 1.00 . A A . 10 ARG HH11 1 1
6 1518 1 1 10 ARG HH12 H 0.115 -0.220 5.777 1.00 . A A . 10 ARG HH12 1 1
6 1519 1 1 10 ARG HH21 H 2.561 -1.845 3.882 1.00 . A A . 10 ARG HH21 1 1
6 1520 1 1 10 ARG HH22 H 1.641 -1.870 5.348 1.00 . A A . 10 ARG HH22 1 1
6 1521 1 1 10 ARG N N 2.133 0.819 -2.270 1.00 . A A . 10 ARG N 1 1
6 1522 1 1 10 ARG NE N 1.566 0.259 2.953 1.00 . A A . 10 ARG NE 1 1
6 1523 1 1 10 ARG NH1 N 0.341 0.218 4.907 1.00 . A A . 10 ARG NH1 1 1
6 1524 1 1 10 ARG NH2 N 1.870 -1.437 4.477 1.00 . A A . 10 ARG NH2 1 1
6 1525 1 1 10 ARG O O 3.312 -0.133 0.965 1.00 . A A . 10 ARG O 1 1
6 1526 1 1 11 LEU C C 5.535 -1.807 -0.497 1.00 . A A . 11 LEU C 1 1
6 1527 1 1 11 LEU CA C 4.100 -2.285 -0.548 1.00 . A A . 11 LEU CA 1 1
6 1528 1 1 11 LEU CB C 3.940 -3.490 -1.482 1.00 . A A . 11 LEU CB 1 1
6 1529 1 1 11 LEU CD1 C 2.961 -5.745 -1.954 1.00 . A A . 11 LEU CD1 1 1
6 1530 1 1 11 LEU CD2 C 3.761 -5.192 0.348 1.00 . A A . 11 LEU CD2 1 1
6 1531 1 1 11 LEU CG C 3.116 -4.647 -0.916 1.00 . A A . 11 LEU CG 1 1
6 1532 1 1 11 LEU H H 3.158 -1.064 -1.935 1.00 . A A . 11 LEU H 1 1
6 1533 1 1 11 LEU HA H 3.768 -2.519 0.441 1.00 . A A . 11 LEU HA 1 1
6 1534 1 1 11 LEU HB2 H 3.468 -3.155 -2.390 1.00 . A A . 11 LEU HB2 1 1
6 1535 1 1 11 LEU HB3 H 4.924 -3.865 -1.725 1.00 . A A . 11 LEU HB3 1 1
6 1536 1 1 11 LEU HD11 H 2.875 -6.700 -1.458 1.00 . A A . 11 LEU HD11 1 1
6 1537 1 1 11 LEU HD12 H 3.825 -5.753 -2.602 1.00 . A A . 11 LEU HD12 1 1
6 1538 1 1 11 LEU HD13 H 2.073 -5.563 -2.541 1.00 . A A . 11 LEU HD13 1 1
6 1539 1 1 11 LEU HD21 H 4.836 -5.161 0.247 1.00 . A A . 11 LEU HD21 1 1
6 1540 1 1 11 LEU HD22 H 3.443 -6.214 0.502 1.00 . A A . 11 LEU HD22 1 1
6 1541 1 1 11 LEU HD23 H 3.461 -4.591 1.194 1.00 . A A . 11 LEU HD23 1 1
6 1542 1 1 11 LEU HG H 2.130 -4.286 -0.661 1.00 . A A . 11 LEU HG 1 1
6 1543 1 1 11 LEU N N 3.369 -1.134 -1.017 1.00 . A A . 11 LEU N 1 1
6 1544 1 1 11 LEU O O 6.278 -2.038 0.464 1.00 . A A . 11 LEU O 1 1
6 1545 1 1 12 VAL C C 7.163 0.652 -0.415 1.00 . A A . 12 VAL C 1 1
6 1546 1 1 12 VAL CA C 7.180 -0.383 -1.515 1.00 . A A . 12 VAL CA 1 1
6 1547 1 1 12 VAL CB C 7.507 0.273 -2.867 1.00 . A A . 12 VAL CB 1 1
6 1548 1 1 12 VAL CG1 C 8.888 0.908 -2.839 1.00 . A A . 12 VAL CG1 1 1
6 1549 1 1 12 VAL CG2 C 7.402 -0.745 -3.993 1.00 . A A . 12 VAL CG2 1 1
6 1550 1 1 12 VAL H H 5.216 -0.784 -2.205 1.00 . A A . 12 VAL H 1 1
6 1551 1 1 12 VAL HA H 7.908 -1.121 -1.280 1.00 . A A . 12 VAL HA 1 1
6 1552 1 1 12 VAL HB H 6.780 1.049 -3.046 1.00 . A A . 12 VAL HB 1 1
6 1553 1 1 12 VAL HG11 H 9.156 1.143 -1.819 1.00 . A A . 12 VAL HG11 1 1
6 1554 1 1 12 VAL HG12 H 8.880 1.814 -3.426 1.00 . A A . 12 VAL HG12 1 1
6 1555 1 1 12 VAL HG13 H 9.610 0.218 -3.251 1.00 . A A . 12 VAL HG13 1 1
6 1556 1 1 12 VAL HG21 H 7.617 -1.731 -3.608 1.00 . A A . 12 VAL HG21 1 1
6 1557 1 1 12 VAL HG22 H 8.113 -0.500 -4.768 1.00 . A A . 12 VAL HG22 1 1
6 1558 1 1 12 VAL HG23 H 6.403 -0.729 -4.402 1.00 . A A . 12 VAL HG23 1 1
6 1559 1 1 12 VAL N N 5.882 -1.011 -1.505 1.00 . A A . 12 VAL N 1 1
6 1560 1 1 12 VAL O O 8.065 0.733 0.428 1.00 . A A . 12 VAL O 1 1
6 1561 1 1 13 LEU C C 5.430 1.584 1.939 1.00 . A A . 13 LEU C 1 1
6 1562 1 1 13 LEU CA C 5.877 2.326 0.695 1.00 . A A . 13 LEU CA 1 1
6 1563 1 1 13 LEU CB C 4.913 3.450 0.339 1.00 . A A . 13 LEU CB 1 1
6 1564 1 1 13 LEU CD1 C 3.509 4.189 -1.608 1.00 . A A . 13 LEU CD1 1 1
6 1565 1 1 13 LEU CD2 C 5.821 5.096 -1.317 1.00 . A A . 13 LEU CD2 1 1
6 1566 1 1 13 LEU CG C 4.921 3.885 -1.129 1.00 . A A . 13 LEU CG 1 1
6 1567 1 1 13 LEU H H 5.346 1.215 -1.010 1.00 . A A . 13 LEU H 1 1
6 1568 1 1 13 LEU HA H 6.832 2.752 0.901 1.00 . A A . 13 LEU HA 1 1
6 1569 1 1 13 LEU HB2 H 3.914 3.143 0.604 1.00 . A A . 13 LEU HB2 1 1
6 1570 1 1 13 LEU HB3 H 5.188 4.306 0.945 1.00 . A A . 13 LEU HB3 1 1
6 1571 1 1 13 LEU HD11 H 3.385 5.258 -1.706 1.00 . A A . 13 LEU HD11 1 1
6 1572 1 1 13 LEU HD12 H 2.794 3.811 -0.892 1.00 . A A . 13 LEU HD12 1 1
6 1573 1 1 13 LEU HD13 H 3.343 3.718 -2.565 1.00 . A A . 13 LEU HD13 1 1
6 1574 1 1 13 LEU HD21 H 6.783 4.905 -0.863 1.00 . A A . 13 LEU HD21 1 1
6 1575 1 1 13 LEU HD22 H 5.368 5.957 -0.849 1.00 . A A . 13 LEU HD22 1 1
6 1576 1 1 13 LEU HD23 H 5.952 5.287 -2.371 1.00 . A A . 13 LEU HD23 1 1
6 1577 1 1 13 LEU HG H 5.313 3.081 -1.734 1.00 . A A . 13 LEU HG 1 1
6 1578 1 1 13 LEU N N 6.062 1.378 -0.364 1.00 . A A . 13 LEU N 1 1
6 1579 1 1 13 LEU O O 5.230 2.183 2.993 1.00 . A A . 13 LEU O 1 1
6 1580 1 1 14 ARG C C 6.104 -0.366 3.942 1.00 . A A . 14 ARG C 1 1
6 1581 1 1 14 ARG CA C 4.948 -0.536 2.980 1.00 . A A . 14 ARG CA 1 1
6 1582 1 1 14 ARG CB C 4.729 -2.015 2.631 1.00 . A A . 14 ARG CB 1 1
6 1583 1 1 14 ARG CD C 5.464 -4.312 3.316 1.00 . A A . 14 ARG CD 1 1
6 1584 1 1 14 ARG CG C 4.903 -2.983 3.795 1.00 . A A . 14 ARG CG 1 1
6 1585 1 1 14 ARG CZ C 7.626 -5.161 2.496 1.00 . A A . 14 ARG CZ 1 1
6 1586 1 1 14 ARG H H 5.504 -0.193 0.987 1.00 . A A . 14 ARG H 1 1
6 1587 1 1 14 ARG HA H 4.040 -0.119 3.363 1.00 . A A . 14 ARG HA 1 1
6 1588 1 1 14 ARG HB2 H 3.727 -2.133 2.255 1.00 . A A . 14 ARG HB2 1 1
6 1589 1 1 14 ARG HB3 H 5.425 -2.295 1.862 1.00 . A A . 14 ARG HB3 1 1
6 1590 1 1 14 ARG HD2 H 5.169 -5.086 4.008 1.00 . A A . 14 ARG HD2 1 1
6 1591 1 1 14 ARG HD3 H 5.054 -4.526 2.341 1.00 . A A . 14 ARG HD3 1 1
6 1592 1 1 14 ARG HE H 7.400 -3.593 3.711 1.00 . A A . 14 ARG HE 1 1
6 1593 1 1 14 ARG HG2 H 5.582 -2.558 4.517 1.00 . A A . 14 ARG HG2 1 1
6 1594 1 1 14 ARG HG3 H 3.943 -3.156 4.257 1.00 . A A . 14 ARG HG3 1 1
6 1595 1 1 14 ARG HH11 H 6.018 -6.211 1.861 1.00 . A A . 14 ARG HH11 1 1
6 1596 1 1 14 ARG HH12 H 7.548 -6.778 1.284 1.00 . A A . 14 ARG HH12 1 1
6 1597 1 1 14 ARG HH21 H 9.415 -4.339 2.950 1.00 . A A . 14 ARG HH21 1 1
6 1598 1 1 14 ARG HH22 H 9.477 -5.715 1.902 1.00 . A A . 14 ARG HH22 1 1
6 1599 1 1 14 ARG N N 5.314 0.253 1.832 1.00 . A A . 14 ARG N 1 1
6 1600 1 1 14 ARG NE N 6.922 -4.293 3.219 1.00 . A A . 14 ARG NE 1 1
6 1601 1 1 14 ARG NH1 N 7.014 -6.129 1.826 1.00 . A A . 14 ARG NH1 1 1
6 1602 1 1 14 ARG NH2 N 8.948 -5.064 2.446 1.00 . A A . 14 ARG NH2 1 1
6 1603 1 1 14 ARG O O 5.944 -0.137 5.141 1.00 . A A . 14 ARG O 1 1
6 1604 1 1 15 CYS C C 8.859 1.259 4.131 1.00 . A A . 15 CYS C 1 1
6 1605 1 1 15 CYS CA C 8.556 -0.235 4.012 1.00 . A A . 15 CYS CA 1 1
6 1606 1 1 15 CYS CB C 9.676 -0.904 3.223 1.00 . A A . 15 CYS CB 1 1
6 1607 1 1 15 CYS H H 7.296 -0.587 2.351 1.00 . A A . 15 CYS H 1 1
6 1608 1 1 15 CYS HA H 8.491 -0.672 4.996 1.00 . A A . 15 CYS HA 1 1
6 1609 1 1 15 CYS HB2 H 9.263 -1.320 2.319 1.00 . A A . 15 CYS HB2 1 1
6 1610 1 1 15 CYS HB3 H 10.409 -0.158 2.960 1.00 . A A . 15 CYS HB3 1 1
6 1611 1 1 15 CYS HG H 11.248 -1.839 4.607 1.00 . A A . 15 CYS HG 1 1
6 1612 1 1 15 CYS N N 7.288 -0.430 3.329 1.00 . A A . 15 CYS N 1 1
6 1613 1 1 15 CYS O O 9.749 1.661 4.881 1.00 . A A . 15 CYS O 1 1
6 1614 1 1 15 CYS SG S 10.524 -2.229 4.113 1.00 . A A . 15 CYS SG 1 1
6 1615 1 1 16 SER C C 8.878 4.059 4.633 1.00 . A A . 16 SER C 1 1
6 1616 1 1 16 SER CA C 8.314 3.526 3.317 1.00 . A A . 16 SER CA 1 1
6 1617 1 1 16 SER CB C 6.986 4.238 3.051 1.00 . A A . 16 SER CB 1 1
6 1618 1 1 16 SER H H 7.472 1.664 2.746 1.00 . A A . 16 SER H 1 1
6 1619 1 1 16 SER HA H 8.985 3.750 2.509 1.00 . A A . 16 SER HA 1 1
6 1620 1 1 16 SER HB2 H 6.731 4.148 2.012 1.00 . A A . 16 SER HB2 1 1
6 1621 1 1 16 SER HB3 H 6.213 3.792 3.655 1.00 . A A . 16 SER HB3 1 1
6 1622 1 1 16 SER HG H 6.435 5.823 4.063 1.00 . A A . 16 SER HG 1 1
6 1623 1 1 16 SER N N 8.127 2.068 3.351 1.00 . A A . 16 SER N 1 1
6 1624 1 1 16 SER O O 8.322 3.715 5.698 1.00 . A A . 16 SER O 1 1
6 1625 1 1 16 SER OXT O 9.873 4.814 4.589 1.00 . A A . 16 SER OXT 1 1
6 1626 1 1 16 SER OG O 7.071 5.616 3.374 1.00 . A A . 16 SER OG 1 1
7 1627 1 1 1 GLY C C -7.961 2.239 -2.204 1.00 . A A . 1 GLY C 1 1
7 1628 1 1 1 GLY CA C -9.254 1.978 -2.954 1.00 . A A . 1 GLY CA 1 1
7 1629 1 1 1 GLY H1 H -8.777 -0.040 -2.691 1.00 . A A . 1 GLY H1 1 1
7 1630 1 1 1 GLY H2 H -9.632 0.282 -4.114 1.00 . A A . 1 GLY H2 1 1
7 1631 1 1 1 GLY H3 H -10.435 0.286 -2.626 1.00 . A A . 1 GLY H3 1 1
7 1632 1 1 1 GLY HA2 H -9.184 2.426 -3.934 1.00 . A A . 1 GLY HA2 1 1
7 1633 1 1 1 GLY HA3 H -10.067 2.440 -2.416 1.00 . A A . 1 GLY HA3 1 1
7 1634 1 1 1 GLY N N -9.544 0.525 -3.107 1.00 . A A . 1 GLY N 1 1
7 1635 1 1 1 GLY O O -6.920 2.480 -2.814 1.00 . A A . 1 GLY O 1 1
7 1636 1 1 2 ARG C C -6.483 1.160 0.725 1.00 . A A . 2 ARG C 1 1
7 1637 1 1 2 ARG CA C -6.852 2.422 -0.044 1.00 . A A . 2 ARG CA 1 1
7 1638 1 1 2 ARG CB C -7.105 3.576 0.927 1.00 . A A . 2 ARG CB 1 1
7 1639 1 1 2 ARG CD C -7.797 5.857 0.130 1.00 . A A . 2 ARG CD 1 1
7 1640 1 1 2 ARG CG C -6.630 4.922 0.405 1.00 . A A . 2 ARG CG 1 1
7 1641 1 1 2 ARG CZ C -10.082 5.659 -0.770 1.00 . A A . 2 ARG CZ 1 1
7 1642 1 1 2 ARG H H -8.886 1.992 -0.448 1.00 . A A . 2 ARG H 1 1
7 1643 1 1 2 ARG HA H -6.032 2.681 -0.695 1.00 . A A . 2 ARG HA 1 1
7 1644 1 1 2 ARG HB2 H -8.165 3.641 1.122 1.00 . A A . 2 ARG HB2 1 1
7 1645 1 1 2 ARG HB3 H -6.588 3.372 1.854 1.00 . A A . 2 ARG HB3 1 1
7 1646 1 1 2 ARG HD2 H -8.235 6.151 1.071 1.00 . A A . 2 ARG HD2 1 1
7 1647 1 1 2 ARG HD3 H -7.425 6.733 -0.383 1.00 . A A . 2 ARG HD3 1 1
7 1648 1 1 2 ARG HE H -8.565 4.438 -1.221 1.00 . A A . 2 ARG HE 1 1
7 1649 1 1 2 ARG HG2 H -5.986 5.376 1.142 1.00 . A A . 2 ARG HG2 1 1
7 1650 1 1 2 ARG HG3 H -6.079 4.768 -0.511 1.00 . A A . 2 ARG HG3 1 1
7 1651 1 1 2 ARG HH11 H -9.818 7.194 0.520 1.00 . A A . 2 ARG HH11 1 1
7 1652 1 1 2 ARG HH12 H -11.414 7.039 -0.130 1.00 . A A . 2 ARG HH12 1 1
7 1653 1 1 2 ARG HH21 H -10.672 4.236 -2.077 1.00 . A A . 2 ARG HH21 1 1
7 1654 1 1 2 ARG HH22 H -11.900 5.359 -1.600 1.00 . A A . 2 ARG HH22 1 1
7 1655 1 1 2 ARG N N -8.027 2.190 -0.876 1.00 . A A . 2 ARG N 1 1
7 1656 1 1 2 ARG NE N -8.825 5.225 -0.695 1.00 . A A . 2 ARG NE 1 1
7 1657 1 1 2 ARG NH1 N -10.469 6.718 -0.069 1.00 . A A . 2 ARG NH1 1 1
7 1658 1 1 2 ARG NH2 N -10.956 5.033 -1.547 1.00 . A A . 2 ARG NH2 1 1
7 1659 1 1 2 ARG O O -6.042 1.219 1.873 1.00 . A A . 2 ARG O 1 1
7 1660 1 1 3 MET C C -6.337 -2.357 -0.389 1.00 . A A . 3 MET C 1 1
7 1661 1 1 3 MET CA C -6.365 -1.272 0.679 1.00 . A A . 3 MET CA 1 1
7 1662 1 1 3 MET CB C -7.402 -1.616 1.750 1.00 . A A . 3 MET CB 1 1
7 1663 1 1 3 MET CE C -11.264 -2.297 2.385 1.00 . A A . 3 MET CE 1 1
7 1664 1 1 3 MET CG C -8.825 -1.678 1.219 1.00 . A A . 3 MET CG 1 1
7 1665 1 1 3 MET H H -7.024 0.045 -0.837 1.00 . A A . 3 MET H 1 1
7 1666 1 1 3 MET HA H -5.389 -1.205 1.137 1.00 . A A . 3 MET HA 1 1
7 1667 1 1 3 MET HB2 H -7.157 -2.577 2.177 1.00 . A A . 3 MET HB2 1 1
7 1668 1 1 3 MET HB3 H -7.363 -0.866 2.527 1.00 . A A . 3 MET HB3 1 1
7 1669 1 1 3 MET HE1 H -12.110 -2.880 2.053 1.00 . A A . 3 MET HE1 1 1
7 1670 1 1 3 MET HE2 H -11.319 -1.306 1.960 1.00 . A A . 3 MET HE2 1 1
7 1671 1 1 3 MET HE3 H -11.277 -2.228 3.463 1.00 . A A . 3 MET HE3 1 1
7 1672 1 1 3 MET HG2 H -9.341 -0.772 1.504 1.00 . A A . 3 MET HG2 1 1
7 1673 1 1 3 MET HG3 H -8.790 -1.745 0.142 1.00 . A A . 3 MET HG3 1 1
7 1674 1 1 3 MET N N -6.670 0.019 0.077 1.00 . A A . 3 MET N 1 1
7 1675 1 1 3 MET O O -6.823 -3.468 -0.178 1.00 . A A . 3 MET O 1 1
7 1676 1 1 3 MET SD S -9.747 -3.091 1.857 1.00 . A A . 3 MET SD 1 1
7 1677 1 1 4 LEU C C -4.961 -2.337 -3.843 1.00 . A A . 4 LEU C 1 1
7 1678 1 1 4 LEU CA C -5.676 -2.956 -2.656 1.00 . A A . 4 LEU CA 1 1
7 1679 1 1 4 LEU CB C -7.071 -3.442 -3.067 1.00 . A A . 4 LEU CB 1 1
7 1680 1 1 4 LEU CD1 C -8.493 -5.116 -1.850 1.00 . A A . 4 LEU CD1 1 1
7 1681 1 1 4 LEU CD2 C -7.621 -5.648 -4.133 1.00 . A A . 4 LEU CD2 1 1
7 1682 1 1 4 LEU CG C -7.337 -4.930 -2.821 1.00 . A A . 4 LEU CG 1 1
7 1683 1 1 4 LEU H H -5.401 -1.118 -1.646 1.00 . A A . 4 LEU H 1 1
7 1684 1 1 4 LEU HA H -5.108 -3.781 -2.333 1.00 . A A . 4 LEU HA 1 1
7 1685 1 1 4 LEU HB2 H -7.803 -2.868 -2.516 1.00 . A A . 4 LEU HB2 1 1
7 1686 1 1 4 LEU HB3 H -7.204 -3.243 -4.120 1.00 . A A . 4 LEU HB3 1 1
7 1687 1 1 4 LEU HD11 H -8.647 -4.202 -1.293 1.00 . A A . 4 LEU HD11 1 1
7 1688 1 1 4 LEU HD12 H -8.265 -5.920 -1.167 1.00 . A A . 4 LEU HD12 1 1
7 1689 1 1 4 LEU HD13 H -9.391 -5.355 -2.400 1.00 . A A . 4 LEU HD13 1 1
7 1690 1 1 4 LEU HD21 H -8.027 -4.946 -4.846 1.00 . A A . 4 LEU HD21 1 1
7 1691 1 1 4 LEU HD22 H -8.334 -6.440 -3.963 1.00 . A A . 4 LEU HD22 1 1
7 1692 1 1 4 LEU HD23 H -6.704 -6.066 -4.520 1.00 . A A . 4 LEU HD23 1 1
7 1693 1 1 4 LEU HG H -6.458 -5.377 -2.380 1.00 . A A . 4 LEU HG 1 1
7 1694 1 1 4 LEU N N -5.767 -2.021 -1.542 1.00 . A A . 4 LEU N 1 1
7 1695 1 1 4 LEU O O -4.026 -2.916 -4.397 1.00 . A A . 4 LEU O 1 1
7 1696 1 1 5 PRO C C -3.588 0.315 -5.006 1.00 . A A . 5 PRO C 1 1
7 1697 1 1 5 PRO CA C -4.859 -0.431 -5.393 1.00 . A A . 5 PRO CA 1 1
7 1698 1 1 5 PRO CB C -6.010 0.530 -5.755 1.00 . A A . 5 PRO CB 1 1
7 1699 1 1 5 PRO CD C -6.523 -0.429 -3.675 1.00 . A A . 5 PRO CD 1 1
7 1700 1 1 5 PRO CG C -7.159 0.048 -4.919 1.00 . A A . 5 PRO CG 1 1
7 1701 1 1 5 PRO HA H -4.654 -1.088 -6.226 1.00 . A A . 5 PRO HA 1 1
7 1702 1 1 5 PRO HB2 H -5.732 1.543 -5.504 1.00 . A A . 5 PRO HB2 1 1
7 1703 1 1 5 PRO HB3 H -6.230 0.456 -6.808 1.00 . A A . 5 PRO HB3 1 1
7 1704 1 1 5 PRO HD2 H -6.190 0.400 -3.064 1.00 . A A . 5 PRO HD2 1 1
7 1705 1 1 5 PRO HD3 H -7.177 -1.087 -3.124 1.00 . A A . 5 PRO HD3 1 1
7 1706 1 1 5 PRO HG2 H -7.848 0.847 -4.714 1.00 . A A . 5 PRO HG2 1 1
7 1707 1 1 5 PRO HG3 H -7.651 -0.780 -5.406 1.00 . A A . 5 PRO HG3 1 1
7 1708 1 1 5 PRO N N -5.411 -1.160 -4.256 1.00 . A A . 5 PRO N 1 1
7 1709 1 1 5 PRO O O -2.787 0.696 -5.860 1.00 . A A . 5 PRO O 1 1
7 1710 1 1 6 GLN C C -1.361 0.152 -2.395 1.00 . A A . 6 GLN C 1 1
7 1711 1 1 6 GLN CA C -2.222 1.151 -3.169 1.00 . A A . 6 GLN CA 1 1
7 1712 1 1 6 GLN CB C -2.627 2.313 -2.258 1.00 . A A . 6 GLN CB 1 1
7 1713 1 1 6 GLN CD C -3.426 4.709 -2.154 1.00 . A A . 6 GLN CD 1 1
7 1714 1 1 6 GLN CG C -3.297 3.458 -3.001 1.00 . A A . 6 GLN CG 1 1
7 1715 1 1 6 GLN H H -4.071 0.142 -3.075 1.00 . A A . 6 GLN H 1 1
7 1716 1 1 6 GLN HA H -1.650 1.535 -4.000 1.00 . A A . 6 GLN HA 1 1
7 1717 1 1 6 GLN HB2 H -3.313 1.946 -1.510 1.00 . A A . 6 GLN HB2 1 1
7 1718 1 1 6 GLN HB3 H -1.744 2.697 -1.769 1.00 . A A . 6 GLN HB3 1 1
7 1719 1 1 6 GLN HE21 H -3.924 3.617 -0.569 1.00 . A A . 6 GLN HE21 1 1
7 1720 1 1 6 GLN HE22 H -3.864 5.325 -0.314 1.00 . A A . 6 GLN HE22 1 1
7 1721 1 1 6 GLN HG2 H -2.711 3.694 -3.876 1.00 . A A . 6 GLN HG2 1 1
7 1722 1 1 6 GLN HG3 H -4.284 3.143 -3.304 1.00 . A A . 6 GLN HG3 1 1
7 1723 1 1 6 GLN N N -3.402 0.489 -3.702 1.00 . A A . 6 GLN N 1 1
7 1724 1 1 6 GLN NE2 N -3.773 4.533 -0.884 1.00 . A A . 6 GLN NE2 1 1
7 1725 1 1 6 GLN O O -0.197 0.419 -2.100 1.00 . A A . 6 GLN O 1 1
7 1726 1 1 6 GLN OE1 O -3.215 5.823 -2.636 1.00 . A A . 6 GLN OE1 1 1
7 1727 1 1 7 LEU C C 0.029 -2.480 -2.069 1.00 . A A . 7 LEU C 1 1
7 1728 1 1 7 LEU CA C -1.238 -2.047 -1.335 1.00 . A A . 7 LEU CA 1 1
7 1729 1 1 7 LEU CB C -2.153 -3.254 -1.122 1.00 . A A . 7 LEU CB 1 1
7 1730 1 1 7 LEU CD1 C -2.166 -4.209 1.197 1.00 . A A . 7 LEU CD1 1 1
7 1731 1 1 7 LEU CD2 C -1.874 -5.722 -0.772 1.00 . A A . 7 LEU CD2 1 1
7 1732 1 1 7 LEU CG C -1.588 -4.340 -0.204 1.00 . A A . 7 LEU CG 1 1
7 1733 1 1 7 LEU H H -2.876 -1.164 -2.332 1.00 . A A . 7 LEU H 1 1
7 1734 1 1 7 LEU HA H -0.965 -1.645 -0.378 1.00 . A A . 7 LEU HA 1 1
7 1735 1 1 7 LEU HB2 H -3.084 -2.902 -0.702 1.00 . A A . 7 LEU HB2 1 1
7 1736 1 1 7 LEU HB3 H -2.358 -3.697 -2.085 1.00 . A A . 7 LEU HB3 1 1
7 1737 1 1 7 LEU HD11 H -2.254 -5.187 1.644 1.00 . A A . 7 LEU HD11 1 1
7 1738 1 1 7 LEU HD12 H -3.141 -3.748 1.142 1.00 . A A . 7 LEU HD12 1 1
7 1739 1 1 7 LEU HD13 H -1.513 -3.595 1.800 1.00 . A A . 7 LEU HD13 1 1
7 1740 1 1 7 LEU HD21 H -2.819 -6.080 -0.390 1.00 . A A . 7 LEU HD21 1 1
7 1741 1 1 7 LEU HD22 H -1.087 -6.401 -0.479 1.00 . A A . 7 LEU HD22 1 1
7 1742 1 1 7 LEU HD23 H -1.919 -5.666 -1.850 1.00 . A A . 7 LEU HD23 1 1
7 1743 1 1 7 LEU HG H -0.516 -4.222 -0.133 1.00 . A A . 7 LEU HG 1 1
7 1744 1 1 7 LEU N N -1.945 -1.005 -2.070 1.00 . A A . 7 LEU N 1 1
7 1745 1 1 7 LEU O O 0.957 -3.015 -1.462 1.00 . A A . 7 LEU O 1 1
7 1746 1 1 8 VAL C C 2.258 -1.509 -4.167 1.00 . A A . 8 VAL C 1 1
7 1747 1 1 8 VAL CA C 1.213 -2.608 -4.194 1.00 . A A . 8 VAL CA 1 1
7 1748 1 1 8 VAL CB C 0.805 -2.891 -5.652 1.00 . A A . 8 VAL CB 1 1
7 1749 1 1 8 VAL CG1 C 1.992 -3.410 -6.451 1.00 . A A . 8 VAL CG1 1 1
7 1750 1 1 8 VAL CG2 C -0.350 -3.880 -5.701 1.00 . A A . 8 VAL CG2 1 1
7 1751 1 1 8 VAL H H -0.705 -1.807 -3.800 1.00 . A A . 8 VAL H 1 1
7 1752 1 1 8 VAL HA H 1.643 -3.499 -3.783 1.00 . A A . 8 VAL HA 1 1
7 1753 1 1 8 VAL HB H 0.475 -1.966 -6.101 1.00 . A A . 8 VAL HB 1 1
7 1754 1 1 8 VAL HG11 H 2.309 -4.360 -6.047 1.00 . A A . 8 VAL HG11 1 1
7 1755 1 1 8 VAL HG12 H 2.805 -2.702 -6.386 1.00 . A A . 8 VAL HG12 1 1
7 1756 1 1 8 VAL HG13 H 1.703 -3.535 -7.483 1.00 . A A . 8 VAL HG13 1 1
7 1757 1 1 8 VAL HG21 H -0.339 -4.491 -4.810 1.00 . A A . 8 VAL HG21 1 1
7 1758 1 1 8 VAL HG22 H -0.247 -4.512 -6.571 1.00 . A A . 8 VAL HG22 1 1
7 1759 1 1 8 VAL HG23 H -1.284 -3.340 -5.756 1.00 . A A . 8 VAL HG23 1 1
7 1760 1 1 8 VAL N N 0.061 -2.243 -3.376 1.00 . A A . 8 VAL N 1 1
7 1761 1 1 8 VAL O O 3.318 -1.645 -3.551 1.00 . A A . 8 VAL O 1 1
7 1762 1 1 9 CYS C C 3.243 1.093 -3.435 1.00 . A A . 9 CYS C 1 1
7 1763 1 1 9 CYS CA C 2.854 0.726 -4.851 1.00 . A A . 9 CYS CA 1 1
7 1764 1 1 9 CYS CB C 2.218 1.922 -5.561 1.00 . A A . 9 CYS CB 1 1
7 1765 1 1 9 CYS H H 1.085 -0.353 -5.276 1.00 . A A . 9 CYS H 1 1
7 1766 1 1 9 CYS HA H 3.747 0.423 -5.377 1.00 . A A . 9 CYS HA 1 1
7 1767 1 1 9 CYS HB2 H 1.788 1.590 -6.495 1.00 . A A . 9 CYS HB2 1 1
7 1768 1 1 9 CYS HB3 H 1.436 2.328 -4.936 1.00 . A A . 9 CYS HB3 1 1
7 1769 1 1 9 CYS HG H 4.129 3.171 -5.347 1.00 . A A . 9 CYS HG 1 1
7 1770 1 1 9 CYS N N 1.946 -0.408 -4.821 1.00 . A A . 9 CYS N 1 1
7 1771 1 1 9 CYS O O 4.411 1.387 -3.147 1.00 . A A . 9 CYS O 1 1
7 1772 1 1 9 CYS SG S 3.376 3.259 -5.935 1.00 . A A . 9 CYS SG 1 1
7 1773 1 1 10 ARG C C 3.590 0.274 -0.676 1.00 . A A . 10 ARG C 1 1
7 1774 1 1 10 ARG CA C 2.633 1.322 -1.154 1.00 . A A . 10 ARG CA 1 1
7 1775 1 1 10 ARG CB C 1.464 1.415 -0.192 1.00 . A A . 10 ARG CB 1 1
7 1776 1 1 10 ARG CD C 1.365 0.852 2.258 1.00 . A A . 10 ARG CD 1 1
7 1777 1 1 10 ARG CG C 1.937 1.792 1.210 1.00 . A A . 10 ARG CG 1 1
7 1778 1 1 10 ARG CZ C -0.788 0.639 3.440 1.00 . A A . 10 ARG CZ 1 1
7 1779 1 1 10 ARG H H 1.371 0.753 -2.758 1.00 . A A . 10 ARG H 1 1
7 1780 1 1 10 ARG HA H 3.154 2.262 -1.159 1.00 . A A . 10 ARG HA 1 1
7 1781 1 1 10 ARG HB2 H 0.772 2.168 -0.544 1.00 . A A . 10 ARG HB2 1 1
7 1782 1 1 10 ARG HB3 H 0.966 0.460 -0.142 1.00 . A A . 10 ARG HB3 1 1
7 1783 1 1 10 ARG HD2 H 1.618 -0.163 1.989 1.00 . A A . 10 ARG HD2 1 1
7 1784 1 1 10 ARG HD3 H 1.802 1.092 3.215 1.00 . A A . 10 ARG HD3 1 1
7 1785 1 1 10 ARG HE H -0.568 1.307 1.572 1.00 . A A . 10 ARG HE 1 1
7 1786 1 1 10 ARG HG2 H 3.033 1.743 1.243 1.00 . A A . 10 ARG HG2 1 1
7 1787 1 1 10 ARG HG3 H 1.619 2.801 1.426 1.00 . A A . 10 ARG HG3 1 1
7 1788 1 1 10 ARG HH11 H 0.816 0.047 4.521 1.00 . A A . 10 ARG HH11 1 1
7 1789 1 1 10 ARG HH12 H -0.711 -0.081 5.327 1.00 . A A . 10 ARG HH12 1 1
7 1790 1 1 10 ARG HH21 H -2.573 1.141 2.634 1.00 . A A . 10 ARG HH21 1 1
7 1791 1 1 10 ARG HH22 H -2.634 0.542 4.258 1.00 . A A . 10 ARG HH22 1 1
7 1792 1 1 10 ARG N N 2.284 1.030 -2.518 1.00 . A A . 10 ARG N 1 1
7 1793 1 1 10 ARG NE N -0.088 0.966 2.356 1.00 . A A . 10 ARG NE 1 1
7 1794 1 1 10 ARG NH1 N -0.177 0.163 4.517 1.00 . A A . 10 ARG NH1 1 1
7 1795 1 1 10 ARG NH2 N -2.107 0.786 3.443 1.00 . A A . 10 ARG NH2 1 1
7 1796 1 1 10 ARG O O 4.580 0.609 -0.101 1.00 . A A . 10 ARG O 1 1
7 1797 1 1 11 LEU C C 5.603 -1.564 -0.617 1.00 . A A . 11 LEU C 1 1
7 1798 1 1 11 LEU CA C 4.200 -2.090 -0.604 1.00 . A A . 11 LEU CA 1 1
7 1799 1 1 11 LEU CB C 4.060 -3.267 -1.572 1.00 . A A . 11 LEU CB 1 1
7 1800 1 1 11 LEU CD1 C 5.510 -4.747 -0.159 1.00 . A A . 11 LEU CD1 1 1
7 1801 1 1 11 LEU CD2 C 3.021 -4.945 -0.028 1.00 . A A . 11 LEU CD2 1 1
7 1802 1 1 11 LEU CG C 4.206 -4.649 -0.935 1.00 . A A . 11 LEU CG 1 1
7 1803 1 1 11 LEU H H 2.541 -1.180 -1.474 1.00 . A A . 11 LEU H 1 1
7 1804 1 1 11 LEU HA H 3.948 -2.405 0.386 1.00 . A A . 11 LEU HA 1 1
7 1805 1 1 11 LEU HB2 H 3.087 -3.210 -2.036 1.00 . A A . 11 LEU HB2 1 1
7 1806 1 1 11 LEU HB3 H 4.814 -3.169 -2.339 1.00 . A A . 11 LEU HB3 1 1
7 1807 1 1 11 LEU HD11 H 6.336 -4.811 -0.851 1.00 . A A . 11 LEU HD11 1 1
7 1808 1 1 11 LEU HD12 H 5.493 -5.628 0.465 1.00 . A A . 11 LEU HD12 1 1
7 1809 1 1 11 LEU HD13 H 5.626 -3.869 0.461 1.00 . A A . 11 LEU HD13 1 1
7 1810 1 1 11 LEU HD21 H 2.631 -4.019 0.368 1.00 . A A . 11 LEU HD21 1 1
7 1811 1 1 11 LEU HD22 H 3.340 -5.578 0.786 1.00 . A A . 11 LEU HD22 1 1
7 1812 1 1 11 LEU HD23 H 2.251 -5.446 -0.594 1.00 . A A . 11 LEU HD23 1 1
7 1813 1 1 11 LEU HG H 4.226 -5.397 -1.714 1.00 . A A . 11 LEU HG 1 1
7 1814 1 1 11 LEU N N 3.315 -0.993 -0.974 1.00 . A A . 11 LEU N 1 1
7 1815 1 1 11 LEU O O 6.390 -1.768 0.321 1.00 . A A . 11 LEU O 1 1
7 1816 1 1 12 VAL C C 7.287 0.717 -0.479 1.00 . A A . 12 VAL C 1 1
7 1817 1 1 12 VAL CA C 7.153 -0.132 -1.720 1.00 . A A . 12 VAL CA 1 1
7 1818 1 1 12 VAL CB C 7.327 0.726 -2.987 1.00 . A A . 12 VAL CB 1 1
7 1819 1 1 12 VAL CG1 C 8.774 1.171 -3.135 1.00 . A A . 12 VAL CG1 1 1
7 1820 1 1 12 VAL CG2 C 6.869 -0.040 -4.220 1.00 . A A . 12 VAL CG2 1 1
7 1821 1 1 12 VAL H H 5.183 -0.583 -2.318 1.00 . A A . 12 VAL H 1 1
7 1822 1 1 12 VAL HA H 7.884 -0.896 -1.692 1.00 . A A . 12 VAL HA 1 1
7 1823 1 1 12 VAL HB H 6.712 1.608 -2.888 1.00 . A A . 12 VAL HB 1 1
7 1824 1 1 12 VAL HG11 H 9.035 1.205 -4.183 1.00 . A A . 12 VAL HG11 1 1
7 1825 1 1 12 VAL HG12 H 9.420 0.471 -2.627 1.00 . A A . 12 VAL HG12 1 1
7 1826 1 1 12 VAL HG13 H 8.896 2.153 -2.703 1.00 . A A . 12 VAL HG13 1 1
7 1827 1 1 12 VAL HG21 H 5.843 0.211 -4.440 1.00 . A A . 12 VAL HG21 1 1
7 1828 1 1 12 VAL HG22 H 6.949 -1.101 -4.034 1.00 . A A . 12 VAL HG22 1 1
7 1829 1 1 12 VAL HG23 H 7.493 0.225 -5.061 1.00 . A A . 12 VAL HG23 1 1
7 1830 1 1 12 VAL N N 5.880 -0.777 -1.647 1.00 . A A . 12 VAL N 1 1
7 1831 1 1 12 VAL O O 8.287 0.658 0.236 1.00 . A A . 12 VAL O 1 1
7 1832 1 1 13 LEU C C 5.616 1.479 2.201 1.00 . A A . 13 LEU C 1 1
7 1833 1 1 13 LEU CA C 6.179 2.259 1.010 1.00 . A A . 13 LEU CA 1 1
7 1834 1 1 13 LEU CB C 5.451 3.584 0.838 1.00 . A A . 13 LEU CB 1 1
7 1835 1 1 13 LEU CD1 C 4.193 5.140 -0.674 1.00 . A A . 13 LEU CD1 1 1
7 1836 1 1 13 LEU CD2 C 6.577 4.575 -1.172 1.00 . A A . 13 LEU CD2 1 1
7 1837 1 1 13 LEU CG C 5.262 4.061 -0.605 1.00 . A A . 13 LEU CG 1 1
7 1838 1 1 13 LEU H H 5.444 1.419 -0.796 1.00 . A A . 13 LEU H 1 1
7 1839 1 1 13 LEU HA H 7.181 2.472 1.240 1.00 . A A . 13 LEU HA 1 1
7 1840 1 1 13 LEU HB2 H 4.481 3.504 1.305 1.00 . A A . 13 LEU HB2 1 1
7 1841 1 1 13 LEU HB3 H 6.031 4.333 1.373 1.00 . A A . 13 LEU HB3 1 1
7 1842 1 1 13 LEU HD11 H 3.740 5.134 -1.655 1.00 . A A . 13 LEU HD11 1 1
7 1843 1 1 13 LEU HD12 H 4.642 6.105 -0.492 1.00 . A A . 13 LEU HD12 1 1
7 1844 1 1 13 LEU HD13 H 3.438 4.946 0.073 1.00 . A A . 13 LEU HD13 1 1
7 1845 1 1 13 LEU HD21 H 6.415 4.955 -2.169 1.00 . A A . 13 LEU HD21 1 1
7 1846 1 1 13 LEU HD22 H 7.295 3.769 -1.206 1.00 . A A . 13 LEU HD22 1 1
7 1847 1 1 13 LEU HD23 H 6.956 5.368 -0.542 1.00 . A A . 13 LEU HD23 1 1
7 1848 1 1 13 LEU HG H 4.936 3.231 -1.213 1.00 . A A . 13 LEU HG 1 1
7 1849 1 1 13 LEU N N 6.223 1.456 -0.196 1.00 . A A . 13 LEU N 1 1
7 1850 1 1 13 LEU O O 5.571 2.003 3.312 1.00 . A A . 13 LEU O 1 1
7 1851 1 1 14 ARG C C 5.946 -0.539 4.091 1.00 . A A . 14 ARG C 1 1
7 1852 1 1 14 ARG CA C 4.803 -0.617 3.105 1.00 . A A . 14 ARG CA 1 1
7 1853 1 1 14 ARG CB C 4.540 -2.068 2.683 1.00 . A A . 14 ARG CB 1 1
7 1854 1 1 14 ARG CD C 5.938 -3.844 3.785 1.00 . A A . 14 ARG CD 1 1
7 1855 1 1 14 ARG CG C 4.629 -3.071 3.826 1.00 . A A . 14 ARG CG 1 1
7 1856 1 1 14 ARG CZ C 7.550 -4.774 5.401 1.00 . A A . 14 ARG CZ 1 1
7 1857 1 1 14 ARG H H 5.361 -0.199 1.119 1.00 . A A . 14 ARG H 1 1
7 1858 1 1 14 ARG HA H 3.905 -0.174 3.502 1.00 . A A . 14 ARG HA 1 1
7 1859 1 1 14 ARG HB2 H 3.548 -2.131 2.261 1.00 . A A . 14 ARG HB2 1 1
7 1860 1 1 14 ARG HB3 H 5.259 -2.350 1.931 1.00 . A A . 14 ARG HB3 1 1
7 1861 1 1 14 ARG HD2 H 5.823 -4.686 3.119 1.00 . A A . 14 ARG HD2 1 1
7 1862 1 1 14 ARG HD3 H 6.713 -3.193 3.409 1.00 . A A . 14 ARG HD3 1 1
7 1863 1 1 14 ARG HE H 5.645 -4.337 5.807 1.00 . A A . 14 ARG HE 1 1
7 1864 1 1 14 ARG HG2 H 4.565 -2.541 4.763 1.00 . A A . 14 ARG HG2 1 1
7 1865 1 1 14 ARG HG3 H 3.808 -3.767 3.746 1.00 . A A . 14 ARG HG3 1 1
7 1866 1 1 14 ARG HH11 H 8.305 -4.457 3.551 1.00 . A A . 14 ARG HH11 1 1
7 1867 1 1 14 ARG HH12 H 9.418 -5.111 4.706 1.00 . A A . 14 ARG HH12 1 1
7 1868 1 1 14 ARG HH21 H 7.109 -5.200 7.326 1.00 . A A . 14 ARG HH21 1 1
7 1869 1 1 14 ARG HH22 H 8.738 -5.536 6.847 1.00 . A A . 14 ARG HH22 1 1
7 1870 1 1 14 ARG N N 5.257 0.199 1.999 1.00 . A A . 14 ARG N 1 1
7 1871 1 1 14 ARG NE N 6.329 -4.334 5.105 1.00 . A A . 14 ARG NE 1 1
7 1872 1 1 14 ARG NH1 N 8.502 -4.781 4.476 1.00 . A A . 14 ARG NH1 1 1
7 1873 1 1 14 ARG NH2 N 7.821 -5.205 6.625 1.00 . A A . 14 ARG NH2 1 1
7 1874 1 1 14 ARG O O 5.777 -0.414 5.306 1.00 . A A . 14 ARG O 1 1
7 1875 1 1 15 CYS C C 8.656 1.118 4.317 1.00 . A A . 15 CYS C 1 1
7 1876 1 1 15 CYS CA C 8.392 -0.367 4.161 1.00 . A A . 15 CYS CA 1 1
7 1877 1 1 15 CYS CB C 9.506 -0.985 3.321 1.00 . A A . 15 CYS CB 1 1
7 1878 1 1 15 CYS H H 7.142 -0.581 2.486 1.00 . A A . 15 CYS H 1 1
7 1879 1 1 15 CYS HA H 8.339 -0.840 5.123 1.00 . A A . 15 CYS HA 1 1
7 1880 1 1 15 CYS HB2 H 9.057 -1.545 2.528 1.00 . A A . 15 CYS HB2 1 1
7 1881 1 1 15 CYS HB3 H 10.101 -0.198 2.882 1.00 . A A . 15 CYS HB3 1 1
7 1882 1 1 15 CYS HG H 11.366 -2.281 3.666 1.00 . A A . 15 CYS HG 1 1
7 1883 1 1 15 CYS N N 7.130 -0.528 3.475 1.00 . A A . 15 CYS N 1 1
7 1884 1 1 15 CYS O O 9.116 1.589 5.357 1.00 . A A . 15 CYS O 1 1
7 1885 1 1 15 CYS SG S 10.614 -2.086 4.230 1.00 . A A . 15 CYS SG 1 1
7 1886 1 1 16 SER C C 7.326 4.025 3.735 1.00 . A A . 16 SER C 1 1
7 1887 1 1 16 SER CA C 8.546 3.279 3.202 1.00 . A A . 16 SER CA 1 1
7 1888 1 1 16 SER CB C 8.886 3.750 1.784 1.00 . A A . 16 SER CB 1 1
7 1889 1 1 16 SER H H 8.003 1.382 2.457 1.00 . A A . 16 SER H 1 1
7 1890 1 1 16 SER HA H 9.367 3.491 3.831 1.00 . A A . 16 SER HA 1 1
7 1891 1 1 16 SER HB2 H 9.132 2.894 1.172 1.00 . A A . 16 SER HB2 1 1
7 1892 1 1 16 SER HB3 H 8.036 4.264 1.361 1.00 . A A . 16 SER HB3 1 1
7 1893 1 1 16 SER HG H 9.734 5.476 1.415 1.00 . A A . 16 SER HG 1 1
7 1894 1 1 16 SER N N 8.356 1.840 3.243 1.00 . A A . 16 SER N 1 1
7 1895 1 1 16 SER O O 6.971 5.074 3.157 1.00 . A A . 16 SER O 1 1
7 1896 1 1 16 SER OXT O 6.743 3.561 4.738 1.00 . A A . 16 SER OXT 1 1
7 1897 1 1 16 SER OG O 9.995 4.634 1.792 1.00 . A A . 16 SER OG 1 1
8 1898 1 1 1 GLY C C -10.007 1.800 -0.275 1.00 . A A . 1 GLY C 1 1
8 1899 1 1 1 GLY CA C -11.026 1.319 -1.290 1.00 . A A . 1 GLY CA 1 1
8 1900 1 1 1 GLY H1 H -12.296 2.802 -0.551 1.00 . A A . 1 GLY H1 1 1
8 1901 1 1 1 GLY H2 H -12.955 1.245 -0.493 1.00 . A A . 1 GLY H2 1 1
8 1902 1 1 1 GLY H3 H -12.854 2.066 -1.968 1.00 . A A . 1 GLY H3 1 1
8 1903 1 1 1 GLY HA2 H -11.093 0.242 -1.233 1.00 . A A . 1 GLY HA2 1 1
8 1904 1 1 1 GLY HA3 H -10.691 1.596 -2.278 1.00 . A A . 1 GLY HA3 1 1
8 1905 1 1 1 GLY N N -12.378 1.898 -1.059 1.00 . A A . 1 GLY N 1 1
8 1906 1 1 1 GLY O O -10.115 1.497 0.914 1.00 . A A . 1 GLY O 1 1
8 1907 1 1 2 ARG C C -7.272 1.945 0.879 1.00 . A A . 2 ARG C 1 1
8 1908 1 1 2 ARG CA C -7.970 3.075 0.128 1.00 . A A . 2 ARG CA 1 1
8 1909 1 1 2 ARG CB C -8.560 4.084 1.117 1.00 . A A . 2 ARG CB 1 1
8 1910 1 1 2 ARG CD C -8.572 5.977 -0.535 1.00 . A A . 2 ARG CD 1 1
8 1911 1 1 2 ARG CG C -8.135 5.519 0.846 1.00 . A A . 2 ARG CG 1 1
8 1912 1 1 2 ARG CZ C -7.793 5.748 -2.861 1.00 . A A . 2 ARG CZ 1 1
8 1913 1 1 2 ARG H H -8.984 2.755 -1.702 1.00 . A A . 2 ARG H 1 1
8 1914 1 1 2 ARG HA H -7.244 3.573 -0.494 1.00 . A A . 2 ARG HA 1 1
8 1915 1 1 2 ARG HB2 H -9.638 4.035 1.063 1.00 . A A . 2 ARG HB2 1 1
8 1916 1 1 2 ARG HB3 H -8.247 3.823 2.116 1.00 . A A . 2 ARG HB3 1 1
8 1917 1 1 2 ARG HD2 H -9.490 5.471 -0.795 1.00 . A A . 2 ARG HD2 1 1
8 1918 1 1 2 ARG HD3 H -8.746 7.043 -0.509 1.00 . A A . 2 ARG HD3 1 1
8 1919 1 1 2 ARG HE H -6.672 5.426 -1.242 1.00 . A A . 2 ARG HE 1 1
8 1920 1 1 2 ARG HG2 H -8.585 6.163 1.587 1.00 . A A . 2 ARG HG2 1 1
8 1921 1 1 2 ARG HG3 H -7.059 5.584 0.914 1.00 . A A . 2 ARG HG3 1 1
8 1922 1 1 2 ARG HH11 H -9.729 6.308 -2.679 1.00 . A A . 2 ARG HH11 1 1
8 1923 1 1 2 ARG HH12 H -9.154 6.140 -4.304 1.00 . A A . 2 ARG HH12 1 1
8 1924 1 1 2 ARG HH21 H -5.916 5.205 -3.378 1.00 . A A . 2 ARG HH21 1 1
8 1925 1 1 2 ARG HH22 H -6.990 5.512 -4.700 1.00 . A A . 2 ARG HH22 1 1
8 1926 1 1 2 ARG N N -9.015 2.550 -0.744 1.00 . A A . 2 ARG N 1 1
8 1927 1 1 2 ARG NE N -7.565 5.684 -1.552 1.00 . A A . 2 ARG NE 1 1
8 1928 1 1 2 ARG NH1 N -8.990 6.093 -3.319 1.00 . A A . 2 ARG NH1 1 1
8 1929 1 1 2 ARG NH2 N -6.820 5.465 -3.717 1.00 . A A . 2 ARG NH2 1 1
8 1930 1 1 2 ARG O O -6.874 2.102 2.034 1.00 . A A . 2 ARG O 1 1
8 1931 1 1 3 MET C C -6.532 -1.549 -0.152 1.00 . A A . 3 MET C 1 1
8 1932 1 1 3 MET CA C -6.475 -0.357 0.800 1.00 . A A . 3 MET CA 1 1
8 1933 1 1 3 MET CB C -7.134 -0.724 2.132 1.00 . A A . 3 MET CB 1 1
8 1934 1 1 3 MET CE C -10.669 -1.817 3.686 1.00 . A A . 3 MET CE 1 1
8 1935 1 1 3 MET CG C -8.644 -0.875 2.042 1.00 . A A . 3 MET CG 1 1
8 1936 1 1 3 MET H H -7.463 0.753 -0.709 1.00 . A A . 3 MET H 1 1
8 1937 1 1 3 MET HA H -5.440 -0.104 0.978 1.00 . A A . 3 MET HA 1 1
8 1938 1 1 3 MET HB2 H -6.720 -1.658 2.481 1.00 . A A . 3 MET HB2 1 1
8 1939 1 1 3 MET HB3 H -6.913 0.048 2.855 1.00 . A A . 3 MET HB3 1 1
8 1940 1 1 3 MET HE1 H -11.262 -2.659 4.010 1.00 . A A . 3 MET HE1 1 1
8 1941 1 1 3 MET HE2 H -11.262 -1.182 3.045 1.00 . A A . 3 MET HE2 1 1
8 1942 1 1 3 MET HE3 H -10.342 -1.254 4.548 1.00 . A A . 3 MET HE3 1 1
8 1943 1 1 3 MET HG2 H -9.107 -0.044 2.552 1.00 . A A . 3 MET HG2 1 1
8 1944 1 1 3 MET HG3 H -8.932 -0.860 1.000 1.00 . A A . 3 MET HG3 1 1
8 1945 1 1 3 MET N N -7.125 0.809 0.209 1.00 . A A . 3 MET N 1 1
8 1946 1 1 3 MET O O -7.055 -2.608 0.194 1.00 . A A . 3 MET O 1 1
8 1947 1 1 3 MET SD S -9.239 -2.408 2.783 1.00 . A A . 3 MET SD 1 1
8 1948 1 1 4 LEU C C -5.180 -2.042 -3.578 1.00 . A A . 4 LEU C 1 1
8 1949 1 1 4 LEU CA C -5.979 -2.434 -2.350 1.00 . A A . 4 LEU CA 1 1
8 1950 1 1 4 LEU CB C -7.409 -2.820 -2.744 1.00 . A A . 4 LEU CB 1 1
8 1951 1 1 4 LEU CD1 C -8.778 -4.390 -1.337 1.00 . A A . 4 LEU CD1 1 1
8 1952 1 1 4 LEU CD2 C -8.345 -4.925 -3.744 1.00 . A A . 4 LEU CD2 1 1
8 1953 1 1 4 LEU CG C -7.780 -4.284 -2.483 1.00 . A A . 4 LEU CG 1 1
8 1954 1 1 4 LEU H H -5.583 -0.505 -1.568 1.00 . A A . 4 LEU H 1 1
8 1955 1 1 4 LEU HA H -5.508 -3.267 -1.917 1.00 . A A . 4 LEU HA 1 1
8 1956 1 1 4 LEU HB2 H -8.093 -2.191 -2.192 1.00 . A A . 4 LEU HB2 1 1
8 1957 1 1 4 LEU HB3 H -7.537 -2.621 -3.798 1.00 . A A . 4 LEU HB3 1 1
8 1958 1 1 4 LEU HD11 H -8.846 -3.440 -0.828 1.00 . A A . 4 LEU HD11 1 1
8 1959 1 1 4 LEU HD12 H -8.448 -5.147 -0.642 1.00 . A A . 4 LEU HD12 1 1
8 1960 1 1 4 LEU HD13 H -9.749 -4.659 -1.728 1.00 . A A . 4 LEU HD13 1 1
8 1961 1 1 4 LEU HD21 H -8.778 -4.162 -4.373 1.00 . A A . 4 LEU HD21 1 1
8 1962 1 1 4 LEU HD22 H -9.104 -5.644 -3.473 1.00 . A A . 4 LEU HD22 1 1
8 1963 1 1 4 LEU HD23 H -7.551 -5.425 -4.279 1.00 . A A . 4 LEU HD23 1 1
8 1964 1 1 4 LEU HG H -6.892 -4.828 -2.201 1.00 . A A . 4 LEU HG 1 1
8 1965 1 1 4 LEU N N -5.989 -1.369 -1.351 1.00 . A A . 4 LEU N 1 1
8 1966 1 1 4 LEU O O -4.280 -2.762 -4.009 1.00 . A A . 4 LEU O 1 1
8 1967 1 1 5 PRO C C -3.557 0.339 -4.974 1.00 . A A . 5 PRO C 1 1
8 1968 1 1 5 PRO CA C -4.853 -0.367 -5.344 1.00 . A A . 5 PRO CA 1 1
8 1969 1 1 5 PRO CB C -5.910 0.614 -5.888 1.00 . A A . 5 PRO CB 1 1
8 1970 1 1 5 PRO CD C -6.557 0.002 -3.713 1.00 . A A . 5 PRO CD 1 1
8 1971 1 1 5 PRO CG C -7.115 0.368 -5.030 1.00 . A A . 5 PRO CG 1 1
8 1972 1 1 5 PRO HA H -4.654 -1.141 -6.071 1.00 . A A . 5 PRO HA 1 1
8 1973 1 1 5 PRO HB2 H -5.551 1.629 -5.790 1.00 . A A . 5 PRO HB2 1 1
8 1974 1 1 5 PRO HB3 H -6.112 0.395 -6.925 1.00 . A A . 5 PRO HB3 1 1
8 1975 1 1 5 PRO HD2 H -6.158 0.868 -3.204 1.00 . A A . 5 PRO HD2 1 1
8 1976 1 1 5 PRO HD3 H -7.283 -0.513 -3.104 1.00 . A A . 5 PRO HD3 1 1
8 1977 1 1 5 PRO HG2 H -7.720 1.252 -4.954 1.00 . A A . 5 PRO HG2 1 1
8 1978 1 1 5 PRO HG3 H -7.684 -0.464 -5.417 1.00 . A A . 5 PRO HG3 1 1
8 1979 1 1 5 PRO N N -5.508 -0.895 -4.154 1.00 . A A . 5 PRO N 1 1
8 1980 1 1 5 PRO O O -2.744 0.683 -5.831 1.00 . A A . 5 PRO O 1 1
8 1981 1 1 6 GLN C C -1.326 0.132 -2.393 1.00 . A A . 6 GLN C 1 1
8 1982 1 1 6 GLN CA C -2.188 1.160 -3.129 1.00 . A A . 6 GLN CA 1 1
8 1983 1 1 6 GLN CB C -2.593 2.289 -2.178 1.00 . A A . 6 GLN CB 1 1
8 1984 1 1 6 GLN CD C -4.381 2.432 -0.394 1.00 . A A . 6 GLN CD 1 1
8 1985 1 1 6 GLN CG C -3.063 1.810 -0.811 1.00 . A A . 6 GLN CG 1 1
8 1986 1 1 6 GLN H H -4.064 0.212 -3.049 1.00 . A A . 6 GLN H 1 1
8 1987 1 1 6 GLN HA H -1.622 1.572 -3.950 1.00 . A A . 6 GLN HA 1 1
8 1988 1 1 6 GLN HB2 H -1.748 2.944 -2.035 1.00 . A A . 6 GLN HB2 1 1
8 1989 1 1 6 GLN HB3 H -3.399 2.847 -2.632 1.00 . A A . 6 GLN HB3 1 1
8 1990 1 1 6 GLN HE21 H -3.539 3.180 1.245 1.00 . A A . 6 GLN HE21 1 1
8 1991 1 1 6 GLN HE22 H -5.219 3.528 1.038 1.00 . A A . 6 GLN HE22 1 1
8 1992 1 1 6 GLN HG2 H -3.183 0.737 -0.842 1.00 . A A . 6 GLN HG2 1 1
8 1993 1 1 6 GLN HG3 H -2.312 2.066 -0.077 1.00 . A A . 6 GLN HG3 1 1
8 1994 1 1 6 GLN N N -3.376 0.525 -3.671 1.00 . A A . 6 GLN N 1 1
8 1995 1 1 6 GLN NE2 N -4.380 3.115 0.745 1.00 . A A . 6 GLN NE2 1 1
8 1996 1 1 6 GLN O O -0.149 0.368 -2.131 1.00 . A A . 6 GLN O 1 1
8 1997 1 1 6 GLN OE1 O -5.390 2.300 -1.088 1.00 . A A . 6 GLN OE1 1 1
8 1998 1 1 7 LEU C C 0.037 -2.500 -2.087 1.00 . A A . 7 LEU C 1 1
8 1999 1 1 7 LEU CA C -1.232 -2.076 -1.352 1.00 . A A . 7 LEU CA 1 1
8 2000 1 1 7 LEU CB C -2.155 -3.284 -1.177 1.00 . A A . 7 LEU CB 1 1
8 2001 1 1 7 LEU CD1 C -2.115 -4.208 1.154 1.00 . A A . 7 LEU CD1 1 1
8 2002 1 1 7 LEU CD2 C -2.003 -5.759 -0.806 1.00 . A A . 7 LEU CD2 1 1
8 2003 1 1 7 LEU CG C -1.610 -4.389 -0.269 1.00 . A A . 7 LEU CG 1 1
8 2004 1 1 7 LEU H H -2.871 -1.137 -2.294 1.00 . A A . 7 LEU H 1 1
8 2005 1 1 7 LEU HA H -0.962 -1.702 -0.382 1.00 . A A . 7 LEU HA 1 1
8 2006 1 1 7 LEU HB2 H -3.091 -2.936 -0.764 1.00 . A A . 7 LEU HB2 1 1
8 2007 1 1 7 LEU HB3 H -2.347 -3.708 -2.150 1.00 . A A . 7 LEU HB3 1 1
8 2008 1 1 7 LEU HD11 H -2.240 -5.174 1.617 1.00 . A A . 7 LEU HD11 1 1
8 2009 1 1 7 LEU HD12 H -3.062 -3.690 1.136 1.00 . A A . 7 LEU HD12 1 1
8 2010 1 1 7 LEU HD13 H -1.398 -3.628 1.718 1.00 . A A . 7 LEU HD13 1 1
8 2011 1 1 7 LEU HD21 H -2.917 -6.082 -0.331 1.00 . A A . 7 LEU HD21 1 1
8 2012 1 1 7 LEU HD22 H -1.216 -6.468 -0.592 1.00 . A A . 7 LEU HD22 1 1
8 2013 1 1 7 LEU HD23 H -2.153 -5.698 -1.874 1.00 . A A . 7 LEU HD23 1 1
8 2014 1 1 7 LEU HG H -0.531 -4.332 -0.252 1.00 . A A . 7 LEU HG 1 1
8 2015 1 1 7 LEU N N -1.930 -1.010 -2.061 1.00 . A A . 7 LEU N 1 1
8 2016 1 1 7 LEU O O 0.965 -3.038 -1.483 1.00 . A A . 7 LEU O 1 1
8 2017 1 1 8 VAL C C 2.263 -1.503 -4.172 1.00 . A A . 8 VAL C 1 1
8 2018 1 1 8 VAL CA C 1.225 -2.607 -4.205 1.00 . A A . 8 VAL CA 1 1
8 2019 1 1 8 VAL CB C 0.823 -2.888 -5.666 1.00 . A A . 8 VAL CB 1 1
8 2020 1 1 8 VAL CG1 C 2.013 -3.404 -6.458 1.00 . A A . 8 VAL CG1 1 1
8 2021 1 1 8 VAL CG2 C -0.330 -3.879 -5.719 1.00 . A A . 8 VAL CG2 1 1
8 2022 1 1 8 VAL H H -0.695 -1.815 -3.811 1.00 . A A . 8 VAL H 1 1
8 2023 1 1 8 VAL HA H 1.659 -3.498 -3.797 1.00 . A A . 8 VAL HA 1 1
8 2024 1 1 8 VAL HB H 0.494 -1.963 -6.114 1.00 . A A . 8 VAL HB 1 1
8 2025 1 1 8 VAL HG11 H 1.675 -4.121 -7.192 1.00 . A A . 8 VAL HG11 1 1
8 2026 1 1 8 VAL HG12 H 2.714 -3.879 -5.788 1.00 . A A . 8 VAL HG12 1 1
8 2027 1 1 8 VAL HG13 H 2.499 -2.579 -6.958 1.00 . A A . 8 VAL HG13 1 1
8 2028 1 1 8 VAL HG21 H -0.225 -4.508 -6.590 1.00 . A A . 8 VAL HG21 1 1
8 2029 1 1 8 VAL HG22 H -1.266 -3.341 -5.774 1.00 . A A . 8 VAL HG22 1 1
8 2030 1 1 8 VAL HG23 H -0.320 -4.491 -4.829 1.00 . A A . 8 VAL HG23 1 1
8 2031 1 1 8 VAL N N 0.071 -2.252 -3.389 1.00 . A A . 8 VAL N 1 1
8 2032 1 1 8 VAL O O 3.326 -1.637 -3.561 1.00 . A A . 8 VAL O 1 1
8 2033 1 1 9 CYS C C 3.233 1.102 -3.422 1.00 . A A . 9 CYS C 1 1
8 2034 1 1 9 CYS CA C 2.843 0.743 -4.839 1.00 . A A . 9 CYS CA 1 1
8 2035 1 1 9 CYS CB C 2.197 1.938 -5.541 1.00 . A A . 9 CYS CB 1 1
8 2036 1 1 9 CYS H H 1.078 -0.344 -5.266 1.00 . A A . 9 CYS H 1 1
8 2037 1 1 9 CYS HA H 3.737 0.448 -5.368 1.00 . A A . 9 CYS HA 1 1
8 2038 1 1 9 CYS HB2 H 1.123 1.845 -5.479 1.00 . A A . 9 CYS HB2 1 1
8 2039 1 1 9 CYS HB3 H 2.505 2.847 -5.046 1.00 . A A . 9 CYS HB3 1 1
8 2040 1 1 9 CYS HG H 1.907 2.529 -7.739 1.00 . A A . 9 CYS HG 1 1
8 2041 1 1 9 CYS N N 1.942 -0.397 -4.816 1.00 . A A . 9 CYS N 1 1
8 2042 1 1 9 CYS O O 4.400 1.403 -3.137 1.00 . A A . 9 CYS O 1 1
8 2043 1 1 9 CYS SG S 2.632 2.090 -7.290 1.00 . A A . 9 CYS SG 1 1
8 2044 1 1 10 ARG C C 3.597 0.259 -0.674 1.00 . A A . 10 ARG C 1 1
8 2045 1 1 10 ARG CA C 2.630 1.304 -1.138 1.00 . A A . 10 ARG CA 1 1
8 2046 1 1 10 ARG CB C 1.464 1.380 -0.170 1.00 . A A . 10 ARG CB 1 1
8 2047 1 1 10 ARG CD C 1.435 0.746 2.268 1.00 . A A . 10 ARG CD 1 1
8 2048 1 1 10 ARG CG C 1.941 1.741 1.235 1.00 . A A . 10 ARG CG 1 1
8 2049 1 1 10 ARG CZ C -0.665 0.387 3.507 1.00 . A A . 10 ARG CZ 1 1
8 2050 1 1 10 ARG H H 1.369 0.738 -2.741 1.00 . A A . 10 ARG H 1 1
8 2051 1 1 10 ARG HA H 3.142 2.248 -1.136 1.00 . A A . 10 ARG HA 1 1
8 2052 1 1 10 ARG HB2 H 0.768 2.134 -0.509 1.00 . A A . 10 ARG HB2 1 1
8 2053 1 1 10 ARG HB3 H 0.969 0.421 -0.130 1.00 . A A . 10 ARG HB3 1 1
8 2054 1 1 10 ARG HD2 H 1.706 -0.250 1.951 1.00 . A A . 10 ARG HD2 1 1
8 2055 1 1 10 ARG HD3 H 1.904 0.962 3.216 1.00 . A A . 10 ARG HD3 1 1
8 2056 1 1 10 ARG HE H -0.532 1.200 1.690 1.00 . A A . 10 ARG HE 1 1
8 2057 1 1 10 ARG HG2 H 3.039 1.744 1.250 1.00 . A A . 10 ARG HG2 1 1
8 2058 1 1 10 ARG HG3 H 1.580 2.727 1.485 1.00 . A A . 10 ARG HG3 1 1
8 2059 1 1 10 ARG HH11 H 0.996 -0.226 4.486 1.00 . A A . 10 ARG HH11 1 1
8 2060 1 1 10 ARG HH12 H -0.494 -0.462 5.335 1.00 . A A . 10 ARG HH12 1 1
8 2061 1 1 10 ARG HH21 H -2.492 0.889 2.804 1.00 . A A . 10 ARG HH21 1 1
8 2062 1 1 10 ARG HH22 H -2.475 0.168 4.380 1.00 . A A . 10 ARG HH22 1 1
8 2063 1 1 10 ARG N N 2.279 1.022 -2.501 1.00 . A A . 10 ARG N 1 1
8 2064 1 1 10 ARG NE N -0.015 0.815 2.427 1.00 . A A . 10 ARG NE 1 1
8 2065 1 1 10 ARG NH1 N 0.000 -0.144 4.526 1.00 . A A . 10 ARG NH1 1 1
8 2066 1 1 10 ARG NH2 N -1.985 0.490 3.569 1.00 . A A . 10 ARG NH2 1 1
8 2067 1 1 10 ARG O O 4.595 0.599 -0.118 1.00 . A A . 10 ARG O 1 1
8 2068 1 1 11 LEU C C 5.611 -1.574 -0.618 1.00 . A A . 11 LEU C 1 1
8 2069 1 1 11 LEU CA C 4.211 -2.106 -0.613 1.00 . A A . 11 LEU CA 1 1
8 2070 1 1 11 LEU CB C 4.078 -3.270 -1.597 1.00 . A A . 11 LEU CB 1 1
8 2071 1 1 11 LEU CD1 C 5.727 -4.836 -0.542 1.00 . A A . 11 LEU CD1 1 1
8 2072 1 1 11 LEU CD2 C 3.335 -4.868 0.184 1.00 . A A . 11 LEU CD2 1 1
8 2073 1 1 11 LEU CG C 4.284 -4.658 -0.987 1.00 . A A . 11 LEU CG 1 1
8 2074 1 1 11 LEU H H 2.540 -1.196 -1.455 1.00 . A A . 11 LEU H 1 1
8 2075 1 1 11 LEU HA H 3.962 -2.437 0.373 1.00 . A A . 11 LEU HA 1 1
8 2076 1 1 11 LEU HB2 H 3.091 -3.234 -2.034 1.00 . A A . 11 LEU HB2 1 1
8 2077 1 1 11 LEU HB3 H 4.805 -3.137 -2.383 1.00 . A A . 11 LEU HB3 1 1
8 2078 1 1 11 LEU HD11 H 6.010 -4.016 0.101 1.00 . A A . 11 LEU HD11 1 1
8 2079 1 1 11 LEU HD12 H 6.371 -4.851 -1.409 1.00 . A A . 11 LEU HD12 1 1
8 2080 1 1 11 LEU HD13 H 5.825 -5.767 -0.004 1.00 . A A . 11 LEU HD13 1 1
8 2081 1 1 11 LEU HD21 H 3.841 -4.626 1.107 1.00 . A A . 11 LEU HD21 1 1
8 2082 1 1 11 LEU HD22 H 3.017 -5.900 0.208 1.00 . A A . 11 LEU HD22 1 1
8 2083 1 1 11 LEU HD23 H 2.472 -4.228 0.068 1.00 . A A . 11 LEU HD23 1 1
8 2084 1 1 11 LEU HG H 4.069 -5.408 -1.732 1.00 . A A . 11 LEU HG 1 1
8 2085 1 1 11 LEU N N 3.320 -1.009 -0.968 1.00 . A A . 11 LEU N 1 1
8 2086 1 1 11 LEU O O 6.395 -1.781 0.321 1.00 . A A . 11 LEU O 1 1
8 2087 1 1 12 VAL C C 7.284 0.722 -0.472 1.00 . A A . 12 VAL C 1 1
8 2088 1 1 12 VAL CA C 7.155 -0.129 -1.712 1.00 . A A . 12 VAL CA 1 1
8 2089 1 1 12 VAL CB C 7.325 0.728 -2.982 1.00 . A A . 12 VAL CB 1 1
8 2090 1 1 12 VAL CG1 C 8.744 1.266 -3.076 1.00 . A A . 12 VAL CG1 1 1
8 2091 1 1 12 VAL CG2 C 6.970 -0.078 -4.222 1.00 . A A . 12 VAL CG2 1 1
8 2092 1 1 12 VAL H H 5.187 -0.587 -2.314 1.00 . A A . 12 VAL H 1 1
8 2093 1 1 12 VAL HA H 7.889 -0.889 -1.684 1.00 . A A . 12 VAL HA 1 1
8 2094 1 1 12 VAL HB H 6.650 1.568 -2.918 1.00 . A A . 12 VAL HB 1 1
8 2095 1 1 12 VAL HG11 H 8.964 1.526 -4.101 1.00 . A A . 12 VAL HG11 1 1
8 2096 1 1 12 VAL HG12 H 9.439 0.510 -2.739 1.00 . A A . 12 VAL HG12 1 1
8 2097 1 1 12 VAL HG13 H 8.839 2.144 -2.454 1.00 . A A . 12 VAL HG13 1 1
8 2098 1 1 12 VAL HG21 H 6.341 -0.910 -3.942 1.00 . A A . 12 VAL HG21 1 1
8 2099 1 1 12 VAL HG22 H 7.873 -0.448 -4.682 1.00 . A A . 12 VAL HG22 1 1
8 2100 1 1 12 VAL HG23 H 6.442 0.552 -4.921 1.00 . A A . 12 VAL HG23 1 1
8 2101 1 1 12 VAL N N 5.885 -0.781 -1.644 1.00 . A A . 12 VAL N 1 1
8 2102 1 1 12 VAL O O 8.280 0.663 0.248 1.00 . A A . 12 VAL O 1 1
8 2103 1 1 13 LEU C C 5.597 1.502 2.198 1.00 . A A . 13 LEU C 1 1
8 2104 1 1 13 LEU CA C 6.174 2.272 1.008 1.00 . A A . 13 LEU CA 1 1
8 2105 1 1 13 LEU CB C 5.462 3.604 0.823 1.00 . A A . 13 LEU CB 1 1
8 2106 1 1 13 LEU CD1 C 4.344 5.261 -0.689 1.00 . A A . 13 LEU CD1 1 1
8 2107 1 1 13 LEU CD2 C 6.628 4.408 -1.244 1.00 . A A . 13 LEU CD2 1 1
8 2108 1 1 13 LEU CG C 5.282 4.066 -0.624 1.00 . A A . 13 LEU CG 1 1
8 2109 1 1 13 LEU H H 5.445 1.430 -0.799 1.00 . A A . 13 LEU H 1 1
8 2110 1 1 13 LEU HA H 7.176 2.476 1.244 1.00 . A A . 13 LEU HA 1 1
8 2111 1 1 13 LEU HB2 H 4.491 3.539 1.290 1.00 . A A . 13 LEU HB2 1 1
8 2112 1 1 13 LEU HB3 H 6.052 4.349 1.351 1.00 . A A . 13 LEU HB3 1 1
8 2113 1 1 13 LEU HD11 H 4.514 5.802 -1.609 1.00 . A A . 13 LEU HD11 1 1
8 2114 1 1 13 LEU HD12 H 4.530 5.911 0.152 1.00 . A A . 13 LEU HD12 1 1
8 2115 1 1 13 LEU HD13 H 3.320 4.917 -0.660 1.00 . A A . 13 LEU HD13 1 1
8 2116 1 1 13 LEU HD21 H 6.475 4.843 -2.220 1.00 . A A . 13 LEU HD21 1 1
8 2117 1 1 13 LEU HD22 H 7.221 3.509 -1.339 1.00 . A A . 13 LEU HD22 1 1
8 2118 1 1 13 LEU HD23 H 7.147 5.115 -0.611 1.00 . A A . 13 LEU HD23 1 1
8 2119 1 1 13 LEU HG H 4.843 3.264 -1.199 1.00 . A A . 13 LEU HG 1 1
8 2120 1 1 13 LEU N N 6.220 1.464 -0.195 1.00 . A A . 13 LEU N 1 1
8 2121 1 1 13 LEU O O 5.551 2.033 3.307 1.00 . A A . 13 LEU O 1 1
8 2122 1 1 14 ARG C C 5.913 -0.520 4.093 1.00 . A A . 14 ARG C 1 1
8 2123 1 1 14 ARG CA C 4.765 -0.579 3.110 1.00 . A A . 14 ARG CA 1 1
8 2124 1 1 14 ARG CB C 4.478 -2.025 2.691 1.00 . A A . 14 ARG CB 1 1
8 2125 1 1 14 ARG CD C 5.804 -3.516 4.222 1.00 . A A . 14 ARG CD 1 1
8 2126 1 1 14 ARG CG C 4.421 -3.003 3.855 1.00 . A A . 14 ARG CG 1 1
8 2127 1 1 14 ARG CZ C 5.492 -5.890 4.807 1.00 . A A . 14 ARG CZ 1 1
8 2128 1 1 14 ARG H H 5.339 -0.181 1.126 1.00 . A A . 14 ARG H 1 1
8 2129 1 1 14 ARG HA H 3.876 -0.120 3.510 1.00 . A A . 14 ARG HA 1 1
8 2130 1 1 14 ARG HB2 H 3.525 -2.054 2.184 1.00 . A A . 14 ARG HB2 1 1
8 2131 1 1 14 ARG HB3 H 5.249 -2.353 2.013 1.00 . A A . 14 ARG HB3 1 1
8 2132 1 1 14 ARG HD2 H 6.539 -2.991 3.631 1.00 . A A . 14 ARG HD2 1 1
8 2133 1 1 14 ARG HD3 H 5.980 -3.321 5.270 1.00 . A A . 14 ARG HD3 1 1
8 2134 1 1 14 ARG HE H 6.386 -5.228 3.150 1.00 . A A . 14 ARG HE 1 1
8 2135 1 1 14 ARG HG2 H 3.995 -2.503 4.712 1.00 . A A . 14 ARG HG2 1 1
8 2136 1 1 14 ARG HG3 H 3.796 -3.841 3.578 1.00 . A A . 14 ARG HG3 1 1
8 2137 1 1 14 ARG HH11 H 4.754 -4.588 6.168 1.00 . A A . 14 ARG HH11 1 1
8 2138 1 1 14 ARG HH12 H 4.550 -6.263 6.556 1.00 . A A . 14 ARG HH12 1 1
8 2139 1 1 14 ARG HH21 H 6.115 -7.431 3.659 1.00 . A A . 14 ARG HH21 1 1
8 2140 1 1 14 ARG HH22 H 5.321 -7.878 5.131 1.00 . A A . 14 ARG HH22 1 1
8 2141 1 1 14 ARG N N 5.230 0.225 2.003 1.00 . A A . 14 ARG N 1 1
8 2142 1 1 14 ARG NE N 5.939 -4.951 3.976 1.00 . A A . 14 ARG NE 1 1
8 2143 1 1 14 ARG NH1 N 4.882 -5.552 5.937 1.00 . A A . 14 ARG NH1 1 1
8 2144 1 1 14 ARG NH2 N 5.656 -7.172 4.507 1.00 . A A . 14 ARG NH2 1 1
8 2145 1 1 14 ARG O O 5.750 -0.396 5.307 1.00 . A A . 14 ARG O 1 1
8 2146 1 1 15 CYS C C 8.652 1.101 4.301 1.00 . A A . 15 CYS C 1 1
8 2147 1 1 15 CYS CA C 8.363 -0.381 4.154 1.00 . A A . 15 CYS CA 1 1
8 2148 1 1 15 CYS CB C 9.462 -1.025 3.314 1.00 . A A . 15 CYS CB 1 1
8 2149 1 1 15 CYS H H 7.104 -0.574 2.483 1.00 . A A . 15 CYS H 1 1
8 2150 1 1 15 CYS HA H 8.304 -0.847 5.119 1.00 . A A . 15 CYS HA 1 1
8 2151 1 1 15 CYS HB2 H 9.002 -1.549 2.503 1.00 . A A . 15 CYS HB2 1 1
8 2152 1 1 15 CYS HB3 H 10.096 -0.254 2.902 1.00 . A A . 15 CYS HB3 1 1
8 2153 1 1 15 CYS HG H 10.416 -2.011 5.153 1.00 . A A . 15 CYS HG 1 1
8 2154 1 1 15 CYS N N 7.096 -0.523 3.472 1.00 . A A . 15 CYS N 1 1
8 2155 1 1 15 CYS O O 9.126 1.570 5.336 1.00 . A A . 15 CYS O 1 1
8 2156 1 1 15 CYS SG S 10.510 -2.191 4.215 1.00 . A A . 15 CYS SG 1 1
8 2157 1 1 16 SER C C 7.352 4.029 3.703 1.00 . A A . 16 SER C 1 1
8 2158 1 1 16 SER CA C 8.562 3.262 3.174 1.00 . A A . 16 SER CA 1 1
8 2159 1 1 16 SER CB C 8.909 3.718 1.753 1.00 . A A . 16 SER CB 1 1
8 2160 1 1 16 SER H H 7.985 1.368 2.446 1.00 . A A . 16 SER H 1 1
8 2161 1 1 16 SER HA H 9.385 3.468 3.802 1.00 . A A . 16 SER HA 1 1
8 2162 1 1 16 SER HB2 H 9.133 2.854 1.145 1.00 . A A . 16 SER HB2 1 1
8 2163 1 1 16 SER HB3 H 8.068 4.248 1.331 1.00 . A A . 16 SER HB3 1 1
8 2164 1 1 16 SER HG H 9.886 5.300 2.367 1.00 . A A . 16 SER HG 1 1
8 2165 1 1 16 SER N N 8.352 1.824 3.225 1.00 . A A . 16 SER N 1 1
8 2166 1 1 16 SER O O 7.016 5.082 3.121 1.00 . A A . 16 SER O 1 1
8 2167 1 1 16 SER OXT O 6.759 3.576 4.705 1.00 . A A . 16 SER OXT 1 1
8 2168 1 1 16 SER OG O 10.036 4.576 1.755 1.00 . A A . 16 SER OG 1 1
9 2169 1 1 1 GLY C C -9.100 1.964 -3.217 1.00 . A A . 1 GLY C 1 1
9 2170 1 1 1 GLY CA C -10.389 1.498 -3.863 1.00 . A A . 1 GLY CA 1 1
9 2171 1 1 1 GLY H1 H -11.242 -0.263 -4.593 1.00 . A A . 1 GLY H1 1 1
9 2172 1 1 1 GLY H2 H -10.711 -0.372 -2.992 1.00 . A A . 1 GLY H2 1 1
9 2173 1 1 1 GLY H3 H -9.589 -0.390 -4.257 1.00 . A A . 1 GLY H3 1 1
9 2174 1 1 1 GLY HA2 H -10.441 1.898 -4.866 1.00 . A A . 1 GLY HA2 1 1
9 2175 1 1 1 GLY HA3 H -11.223 1.879 -3.293 1.00 . A A . 1 GLY HA3 1 1
9 2176 1 1 1 GLY N N -10.490 0.015 -3.931 1.00 . A A . 1 GLY N 1 1
9 2177 1 1 1 GLY O O -8.072 2.085 -3.883 1.00 . A A . 1 GLY O 1 1
9 2178 1 1 2 ARG C C -7.458 1.586 -0.257 1.00 . A A . 2 ARG C 1 1
9 2179 1 1 2 ARG CA C -7.981 2.684 -1.178 1.00 . A A . 2 ARG CA 1 1
9 2180 1 1 2 ARG CB C -8.318 3.934 -0.364 1.00 . A A . 2 ARG CB 1 1
9 2181 1 1 2 ARG CD C -8.168 6.147 -1.552 1.00 . A A . 2 ARG CD 1 1
9 2182 1 1 2 ARG CG C -9.073 4.991 -1.155 1.00 . A A . 2 ARG CG 1 1
9 2183 1 1 2 ARG CZ C -6.473 6.584 -3.286 1.00 . A A . 2 ARG CZ 1 1
9 2184 1 1 2 ARG H H -10.003 2.112 -1.439 1.00 . A A . 2 ARG H 1 1
9 2185 1 1 2 ARG HA H -7.214 2.929 -1.897 1.00 . A A . 2 ARG HA 1 1
9 2186 1 1 2 ARG HB2 H -8.926 3.646 0.481 1.00 . A A . 2 ARG HB2 1 1
9 2187 1 1 2 ARG HB3 H -7.400 4.373 -0.002 1.00 . A A . 2 ARG HB3 1 1
9 2188 1 1 2 ARG HD2 H -8.772 6.925 -1.995 1.00 . A A . 2 ARG HD2 1 1
9 2189 1 1 2 ARG HD3 H -7.685 6.529 -0.665 1.00 . A A . 2 ARG HD3 1 1
9 2190 1 1 2 ARG HE H -6.949 4.779 -2.581 1.00 . A A . 2 ARG HE 1 1
9 2191 1 1 2 ARG HG2 H -9.476 4.539 -2.049 1.00 . A A . 2 ARG HG2 1 1
9 2192 1 1 2 ARG HG3 H -9.882 5.372 -0.547 1.00 . A A . 2 ARG HG3 1 1
9 2193 1 1 2 ARG HH11 H -7.400 8.240 -2.585 1.00 . A A . 2 ARG HH11 1 1
9 2194 1 1 2 ARG HH12 H -6.203 8.520 -3.805 1.00 . A A . 2 ARG HH12 1 1
9 2195 1 1 2 ARG HH21 H -5.374 5.145 -4.185 1.00 . A A . 2 ARG HH21 1 1
9 2196 1 1 2 ARG HH22 H -5.054 6.764 -4.714 1.00 . A A . 2 ARG HH22 1 1
9 2197 1 1 2 ARG N N -9.154 2.228 -1.916 1.00 . A A . 2 ARG N 1 1
9 2198 1 1 2 ARG NE N -7.146 5.736 -2.511 1.00 . A A . 2 ARG NE 1 1
9 2199 1 1 2 ARG NH1 N -6.712 7.888 -3.220 1.00 . A A . 2 ARG NH1 1 1
9 2200 1 1 2 ARG NH2 N -5.559 6.126 -4.131 1.00 . A A . 2 ARG NH2 1 1
9 2201 1 1 2 ARG O O -7.044 1.852 0.872 1.00 . A A . 2 ARG O 1 1
9 2202 1 1 3 MET C C -6.831 -2.014 -0.864 1.00 . A A . 3 MET C 1 1
9 2203 1 1 3 MET CA C -7.008 -0.790 0.028 1.00 . A A . 3 MET CA 1 1
9 2204 1 1 3 MET CB C -7.987 -1.102 1.162 1.00 . A A . 3 MET CB 1 1
9 2205 1 1 3 MET CE C -9.854 -2.169 3.277 1.00 . A A . 3 MET CE 1 1
9 2206 1 1 3 MET CG C -9.427 -1.250 0.697 1.00 . A A . 3 MET CG 1 1
9 2207 1 1 3 MET H H -7.821 0.204 -1.655 1.00 . A A . 3 MET H 1 1
9 2208 1 1 3 MET HA H -6.050 -0.528 0.453 1.00 . A A . 3 MET HA 1 1
9 2209 1 1 3 MET HB2 H -7.688 -2.025 1.637 1.00 . A A . 3 MET HB2 1 1
9 2210 1 1 3 MET HB3 H -7.946 -0.304 1.888 1.00 . A A . 3 MET HB3 1 1
9 2211 1 1 3 MET HE1 H -9.047 -1.640 3.761 1.00 . A A . 3 MET HE1 1 1
9 2212 1 1 3 MET HE2 H -9.467 -3.055 2.797 1.00 . A A . 3 MET HE2 1 1
9 2213 1 1 3 MET HE3 H -10.593 -2.451 4.013 1.00 . A A . 3 MET HE3 1 1
9 2214 1 1 3 MET HG2 H -9.637 -0.480 -0.030 1.00 . A A . 3 MET HG2 1 1
9 2215 1 1 3 MET HG3 H -9.544 -2.219 0.236 1.00 . A A . 3 MET HG3 1 1
9 2216 1 1 3 MET N N -7.480 0.351 -0.748 1.00 . A A . 3 MET N 1 1
9 2217 1 1 3 MET O O -7.393 -3.077 -0.600 1.00 . A A . 3 MET O 1 1
9 2218 1 1 3 MET SD S -10.611 -1.106 2.050 1.00 . A A . 3 MET SD 1 1
9 2219 1 1 4 LEU C C -4.931 -2.478 -4.026 1.00 . A A . 4 LEU C 1 1
9 2220 1 1 4 LEU CA C -5.791 -2.942 -2.866 1.00 . A A . 4 LEU CA 1 1
9 2221 1 1 4 LEU CB C -7.106 -3.535 -3.385 1.00 . A A . 4 LEU CB 1 1
9 2222 1 1 4 LEU CD1 C -8.335 -5.433 -2.292 1.00 . A A . 4 LEU CD1 1 1
9 2223 1 1 4 LEU CD2 C -7.469 -5.689 -4.624 1.00 . A A . 4 LEU CD2 1 1
9 2224 1 1 4 LEU CG C -7.224 -5.057 -3.261 1.00 . A A . 4 LEU CG 1 1
9 2225 1 1 4 LEU H H -5.627 -0.981 -2.081 1.00 . A A . 4 LEU H 1 1
9 2226 1 1 4 LEU HA H -5.259 -3.690 -2.351 1.00 . A A . 4 LEU HA 1 1
9 2227 1 1 4 LEU HB2 H -7.920 -3.083 -2.836 1.00 . A A . 4 LEU HB2 1 1
9 2228 1 1 4 LEU HB3 H -7.210 -3.270 -4.427 1.00 . A A . 4 LEU HB3 1 1
9 2229 1 1 4 LEU HD11 H -8.006 -5.250 -1.279 1.00 . A A . 4 LEU HD11 1 1
9 2230 1 1 4 LEU HD12 H -8.576 -6.479 -2.409 1.00 . A A . 4 LEU HD12 1 1
9 2231 1 1 4 LEU HD13 H -9.210 -4.835 -2.499 1.00 . A A . 4 LEU HD13 1 1
9 2232 1 1 4 LEU HD21 H -8.532 -5.791 -4.787 1.00 . A A . 4 LEU HD21 1 1
9 2233 1 1 4 LEU HD22 H -7.005 -6.662 -4.660 1.00 . A A . 4 LEU HD22 1 1
9 2234 1 1 4 LEU HD23 H -7.047 -5.060 -5.394 1.00 . A A . 4 LEU HD23 1 1
9 2235 1 1 4 LEU HG H -6.296 -5.452 -2.872 1.00 . A A . 4 LEU HG 1 1
9 2236 1 1 4 LEU N N -6.047 -1.854 -1.926 1.00 . A A . 4 LEU N 1 1
9 2237 1 1 4 LEU O O -3.923 -3.098 -4.362 1.00 . A A . 4 LEU O 1 1
9 2238 1 1 5 PRO C C -3.444 0.026 -5.357 1.00 . A A . 5 PRO C 1 1
9 2239 1 1 5 PRO CA C -4.642 -0.800 -5.803 1.00 . A A . 5 PRO CA 1 1
9 2240 1 1 5 PRO CB C -5.743 0.070 -6.441 1.00 . A A . 5 PRO CB 1 1
9 2241 1 1 5 PRO CD C -6.521 -0.612 -4.335 1.00 . A A . 5 PRO CD 1 1
9 2242 1 1 5 PRO CG C -6.989 -0.324 -5.705 1.00 . A A . 5 PRO CG 1 1
9 2243 1 1 5 PRO HA H -4.321 -1.558 -6.503 1.00 . A A . 5 PRO HA 1 1
9 2244 1 1 5 PRO HB2 H -5.510 1.115 -6.300 1.00 . A A . 5 PRO HB2 1 1
9 2245 1 1 5 PRO HB3 H -5.820 -0.153 -7.495 1.00 . A A . 5 PRO HB3 1 1
9 2246 1 1 5 PRO HD2 H -6.276 0.300 -3.806 1.00 . A A . 5 PRO HD2 1 1
9 2247 1 1 5 PRO HD3 H -7.236 -1.205 -3.789 1.00 . A A . 5 PRO HD3 1 1
9 2248 1 1 5 PRO HG2 H -7.705 0.477 -5.704 1.00 . A A . 5 PRO HG2 1 1
9 2249 1 1 5 PRO HG3 H -7.406 -1.223 -6.132 1.00 . A A . 5 PRO HG3 1 1
9 2250 1 1 5 PRO N N -5.334 -1.384 -4.658 1.00 . A A . 5 PRO N 1 1
9 2251 1 1 5 PRO O O -2.542 0.320 -6.143 1.00 . A A . 5 PRO O 1 1
9 2252 1 1 6 GLN C C -1.500 0.209 -2.592 1.00 . A A . 6 GLN C 1 1
9 2253 1 1 6 GLN CA C -2.343 1.126 -3.479 1.00 . A A . 6 GLN CA 1 1
9 2254 1 1 6 GLN CB C -2.889 2.297 -2.659 1.00 . A A . 6 GLN CB 1 1
9 2255 1 1 6 GLN CD C -2.250 3.977 -0.884 1.00 . A A . 6 GLN CD 1 1
9 2256 1 1 6 GLN CG C -1.810 3.222 -2.123 1.00 . A A . 6 GLN CG 1 1
9 2257 1 1 6 GLN H H -4.173 0.082 -3.498 1.00 . A A . 6 GLN H 1 1
9 2258 1 1 6 GLN HA H -1.725 1.507 -4.279 1.00 . A A . 6 GLN HA 1 1
9 2259 1 1 6 GLN HB2 H -3.554 2.876 -3.280 1.00 . A A . 6 GLN HB2 1 1
9 2260 1 1 6 GLN HB3 H -3.446 1.905 -1.820 1.00 . A A . 6 GLN HB3 1 1
9 2261 1 1 6 GLN HE21 H -1.643 2.481 0.275 1.00 . A A . 6 GLN HE21 1 1
9 2262 1 1 6 GLN HE22 H -2.332 3.835 1.097 1.00 . A A . 6 GLN HE22 1 1
9 2263 1 1 6 GLN HG2 H -0.939 2.634 -1.876 1.00 . A A . 6 GLN HG2 1 1
9 2264 1 1 6 GLN HG3 H -1.554 3.938 -2.891 1.00 . A A . 6 GLN HG3 1 1
9 2265 1 1 6 GLN N N -3.433 0.369 -4.072 1.00 . A A . 6 GLN N 1 1
9 2266 1 1 6 GLN NE2 N -2.055 3.369 0.280 1.00 . A A . 6 GLN NE2 1 1
9 2267 1 1 6 GLN O O -0.357 0.524 -2.263 1.00 . A A . 6 GLN O 1 1
9 2268 1 1 6 GLN OE1 O -2.761 5.094 -0.973 1.00 . A A . 6 GLN OE1 1 1
9 2269 1 1 7 LEU C C -0.091 -2.376 -2.029 1.00 . A A . 7 LEU C 1 1
9 2270 1 1 7 LEU CA C -1.389 -1.907 -1.375 1.00 . A A . 7 LEU CA 1 1
9 2271 1 1 7 LEU CB C -2.297 -3.107 -1.102 1.00 . A A . 7 LEU CB 1 1
9 2272 1 1 7 LEU CD1 C -3.173 -4.466 0.816 1.00 . A A . 7 LEU CD1 1 1
9 2273 1 1 7 LEU CD2 C -0.998 -5.077 -0.257 1.00 . A A . 7 LEU CD2 1 1
9 2274 1 1 7 LEU CG C -1.923 -3.934 0.130 1.00 . A A . 7 LEU CG 1 1
9 2275 1 1 7 LEU H H -2.990 -1.132 -2.513 1.00 . A A . 7 LEU H 1 1
9 2276 1 1 7 LEU HA H -1.156 -1.427 -0.441 1.00 . A A . 7 LEU HA 1 1
9 2277 1 1 7 LEU HB2 H -3.306 -2.745 -0.976 1.00 . A A . 7 LEU HB2 1 1
9 2278 1 1 7 LEU HB3 H -2.270 -3.756 -1.964 1.00 . A A . 7 LEU HB3 1 1
9 2279 1 1 7 LEU HD11 H -2.965 -5.436 1.242 1.00 . A A . 7 LEU HD11 1 1
9 2280 1 1 7 LEU HD12 H -3.970 -4.553 0.092 1.00 . A A . 7 LEU HD12 1 1
9 2281 1 1 7 LEU HD13 H -3.471 -3.785 1.600 1.00 . A A . 7 LEU HD13 1 1
9 2282 1 1 7 LEU HD21 H -1.187 -5.926 0.382 1.00 . A A . 7 LEU HD21 1 1
9 2283 1 1 7 LEU HD22 H 0.030 -4.762 -0.143 1.00 . A A . 7 LEU HD22 1 1
9 2284 1 1 7 LEU HD23 H -1.179 -5.353 -1.286 1.00 . A A . 7 LEU HD23 1 1
9 2285 1 1 7 LEU HG H -1.400 -3.302 0.835 1.00 . A A . 7 LEU HG 1 1
9 2286 1 1 7 LEU N N -2.078 -0.935 -2.214 1.00 . A A . 7 LEU N 1 1
9 2287 1 1 7 LEU O O 0.811 -2.875 -1.355 1.00 . A A . 7 LEU O 1 1
9 2288 1 1 8 VAL C C 2.217 -1.505 -4.073 1.00 . A A . 8 VAL C 1 1
9 2289 1 1 8 VAL CA C 1.179 -2.608 -4.093 1.00 . A A . 8 VAL CA 1 1
9 2290 1 1 8 VAL CB C 0.831 -2.947 -5.554 1.00 . A A . 8 VAL CB 1 1
9 2291 1 1 8 VAL CG1 C 2.043 -3.514 -6.277 1.00 . A A . 8 VAL CG1 1 1
9 2292 1 1 8 VAL CG2 C -0.339 -3.918 -5.613 1.00 . A A . 8 VAL CG2 1 1
9 2293 1 1 8 VAL H H -0.752 -1.798 -3.821 1.00 . A A . 8 VAL H 1 1
9 2294 1 1 8 VAL HA H 1.591 -3.481 -3.629 1.00 . A A . 8 VAL HA 1 1
9 2295 1 1 8 VAL HB H 0.538 -2.035 -6.051 1.00 . A A . 8 VAL HB 1 1
9 2296 1 1 8 VAL HG11 H 2.067 -3.139 -7.289 1.00 . A A . 8 VAL HG11 1 1
9 2297 1 1 8 VAL HG12 H 1.980 -4.593 -6.294 1.00 . A A . 8 VAL HG12 1 1
9 2298 1 1 8 VAL HG13 H 2.944 -3.216 -5.760 1.00 . A A . 8 VAL HG13 1 1
9 2299 1 1 8 VAL HG21 H -0.330 -4.547 -4.735 1.00 . A A . 8 VAL HG21 1 1
9 2300 1 1 8 VAL HG22 H -0.251 -4.533 -6.498 1.00 . A A . 8 VAL HG22 1 1
9 2301 1 1 8 VAL HG23 H -1.265 -3.364 -5.650 1.00 . A A . 8 VAL HG23 1 1
9 2302 1 1 8 VAL N N -0.005 -2.208 -3.345 1.00 . A A . 8 VAL N 1 1
9 2303 1 1 8 VAL O O 3.279 -1.632 -3.458 1.00 . A A . 8 VAL O 1 1
9 2304 1 1 9 CYS C C 3.198 1.091 -3.358 1.00 . A A . 9 CYS C 1 1
9 2305 1 1 9 CYS CA C 2.794 0.731 -4.770 1.00 . A A . 9 CYS CA 1 1
9 2306 1 1 9 CYS CB C 2.138 1.925 -5.465 1.00 . A A . 9 CYS CB 1 1
9 2307 1 1 9 CYS H H 1.033 -0.365 -5.186 1.00 . A A . 9 CYS H 1 1
9 2308 1 1 9 CYS HA H 3.683 0.437 -5.311 1.00 . A A . 9 CYS HA 1 1
9 2309 1 1 9 CYS HB2 H 1.710 1.597 -6.401 1.00 . A A . 9 CYS HB2 1 1
9 2310 1 1 9 CYS HB3 H 1.352 2.313 -4.833 1.00 . A A . 9 CYS HB3 1 1
9 2311 1 1 9 CYS HG H 4.081 2.908 -6.189 1.00 . A A . 9 CYS HG 1 1
9 2312 1 1 9 CYS N N 1.896 -0.409 -4.733 1.00 . A A . 9 CYS N 1 1
9 2313 1 1 9 CYS O O 4.363 1.413 -3.085 1.00 . A A . 9 CYS O 1 1
9 2314 1 1 9 CYS SG S 3.275 3.284 -5.829 1.00 . A A . 9 CYS SG 1 1
9 2315 1 1 10 ARG C C 3.595 0.223 -0.610 1.00 . A A . 10 ARG C 1 1
9 2316 1 1 10 ARG CA C 2.616 1.265 -1.062 1.00 . A A . 10 ARG CA 1 1
9 2317 1 1 10 ARG CB C 1.454 1.323 -0.089 1.00 . A A . 10 ARG CB 1 1
9 2318 1 1 10 ARG CD C 1.592 0.355 2.226 1.00 . A A . 10 ARG CD 1 1
9 2319 1 1 10 ARG CG C 1.945 1.540 1.340 1.00 . A A . 10 ARG CG 1 1
9 2320 1 1 10 ARG CZ C -0.033 1.196 3.878 1.00 . A A . 10 ARG CZ 1 1
9 2321 1 1 10 ARG H H 1.349 0.684 -2.657 1.00 . A A . 10 ARG H 1 1
9 2322 1 1 10 ARG HA H 3.119 2.214 -1.058 1.00 . A A . 10 ARG HA 1 1
9 2323 1 1 10 ARG HB2 H 0.800 2.139 -0.363 1.00 . A A . 10 ARG HB2 1 1
9 2324 1 1 10 ARG HB3 H 0.908 0.393 -0.130 1.00 . A A . 10 ARG HB3 1 1
9 2325 1 1 10 ARG HD2 H 1.640 -0.546 1.631 1.00 . A A . 10 ARG HD2 1 1
9 2326 1 1 10 ARG HD3 H 2.311 0.296 3.028 1.00 . A A . 10 ARG HD3 1 1
9 2327 1 1 10 ARG HE H -0.472 -0.008 2.347 1.00 . A A . 10 ARG HE 1 1
9 2328 1 1 10 ARG HG2 H 3.038 1.662 1.329 1.00 . A A . 10 ARG HG2 1 1
9 2329 1 1 10 ARG HG3 H 1.487 2.432 1.740 1.00 . A A . 10 ARG HG3 1 1
9 2330 1 1 10 ARG HH11 H 1.862 1.841 4.168 1.00 . A A . 10 ARG HH11 1 1
9 2331 1 1 10 ARG HH12 H 0.701 2.409 5.319 1.00 . A A . 10 ARG HH12 1 1
9 2332 1 1 10 ARG HH21 H -2.002 0.739 3.861 1.00 . A A . 10 ARG HH21 1 1
9 2333 1 1 10 ARG HH22 H -1.492 1.784 5.146 1.00 . A A . 10 ARG HH22 1 1
9 2334 1 1 10 ARG N N 2.256 0.985 -2.425 1.00 . A A . 10 ARG N 1 1
9 2335 1 1 10 ARG NE N 0.253 0.476 2.795 1.00 . A A . 10 ARG NE 1 1
9 2336 1 1 10 ARG NH1 N 0.922 1.870 4.506 1.00 . A A . 10 ARG NH1 1 1
9 2337 1 1 10 ARG NH2 N -1.277 1.243 4.332 1.00 . A A . 10 ARG NH2 1 1
9 2338 1 1 10 ARG O O 4.578 0.562 -0.023 1.00 . A A . 10 ARG O 1 1
9 2339 1 1 11 LEU C C 5.646 -1.576 -0.613 1.00 . A A . 11 LEU C 1 1
9 2340 1 1 11 LEU CA C 4.249 -2.127 -0.597 1.00 . A A . 11 LEU CA 1 1
9 2341 1 1 11 LEU CB C 4.119 -3.290 -1.584 1.00 . A A . 11 LEU CB 1 1
9 2342 1 1 11 LEU CD1 C 5.735 -4.694 -0.276 1.00 . A A . 11 LEU CD1 1 1
9 2343 1 1 11 LEU CD2 C 3.274 -5.086 -0.052 1.00 . A A . 11 LEU CD2 1 1
9 2344 1 1 11 LEU CG C 4.395 -4.676 -0.996 1.00 . A A . 11 LEU CG 1 1
9 2345 1 1 11 LEU H H 2.573 -1.228 -1.441 1.00 . A A . 11 LEU H 1 1
9 2346 1 1 11 LEU HA H 4.008 -2.462 0.388 1.00 . A A . 11 LEU HA 1 1
9 2347 1 1 11 LEU HB2 H 3.113 -3.285 -1.981 1.00 . A A . 11 LEU HB2 1 1
9 2348 1 1 11 LEU HB3 H 4.809 -3.124 -2.397 1.00 . A A . 11 LEU HB3 1 1
9 2349 1 1 11 LEU HD11 H 6.393 -3.962 -0.721 1.00 . A A . 11 LEU HD11 1 1
9 2350 1 1 11 LEU HD12 H 6.178 -5.675 -0.365 1.00 . A A . 11 LEU HD12 1 1
9 2351 1 1 11 LEU HD13 H 5.587 -4.459 0.767 1.00 . A A . 11 LEU HD13 1 1
9 2352 1 1 11 LEU HD21 H 3.690 -5.609 0.796 1.00 . A A . 11 LEU HD21 1 1
9 2353 1 1 11 LEU HD22 H 2.585 -5.734 -0.572 1.00 . A A . 11 LEU HD22 1 1
9 2354 1 1 11 LEU HD23 H 2.751 -4.205 0.290 1.00 . A A . 11 LEU HD23 1 1
9 2355 1 1 11 LEU HG H 4.438 -5.397 -1.799 1.00 . A A . 11 LEU HG 1 1
9 2356 1 1 11 LEU N N 3.344 -1.038 -0.940 1.00 . A A . 11 LEU N 1 1
9 2357 1 1 11 LEU O O 6.446 -1.776 0.316 1.00 . A A . 11 LEU O 1 1
9 2358 1 1 12 VAL C C 7.281 0.738 -0.462 1.00 . A A . 12 VAL C 1 1
9 2359 1 1 12 VAL CA C 7.155 -0.097 -1.711 1.00 . A A . 12 VAL CA 1 1
9 2360 1 1 12 VAL CB C 7.295 0.780 -2.969 1.00 . A A . 12 VAL CB 1 1
9 2361 1 1 12 VAL CG1 C 8.705 1.339 -3.079 1.00 . A A . 12 VAL CG1 1 1
9 2362 1 1 12 VAL CG2 C 6.929 -0.013 -4.215 1.00 . A A . 12 VAL CG2 1 1
9 2363 1 1 12 VAL H H 5.189 -0.579 -2.294 1.00 . A A . 12 VAL H 1 1
9 2364 1 1 12 VAL HA H 7.903 -0.845 -1.700 1.00 . A A . 12 VAL HA 1 1
9 2365 1 1 12 VAL HB H 6.608 1.609 -2.882 1.00 . A A . 12 VAL HB 1 1
9 2366 1 1 12 VAL HG11 H 8.812 1.866 -4.015 1.00 . A A . 12 VAL HG11 1 1
9 2367 1 1 12 VAL HG12 H 9.418 0.529 -3.038 1.00 . A A . 12 VAL HG12 1 1
9 2368 1 1 12 VAL HG13 H 8.888 2.020 -2.260 1.00 . A A . 12 VAL HG13 1 1
9 2369 1 1 12 VAL HG21 H 5.866 -0.197 -4.225 1.00 . A A . 12 VAL HG21 1 1
9 2370 1 1 12 VAL HG22 H 7.458 -0.955 -4.210 1.00 . A A . 12 VAL HG22 1 1
9 2371 1 1 12 VAL HG23 H 7.206 0.551 -5.094 1.00 . A A . 12 VAL HG23 1 1
9 2372 1 1 12 VAL N N 5.897 -0.769 -1.634 1.00 . A A . 12 VAL N 1 1
9 2373 1 1 12 VAL O O 8.288 0.689 0.246 1.00 . A A . 12 VAL O 1 1
9 2374 1 1 13 LEU C C 5.670 1.407 2.245 1.00 . A A . 13 LEU C 1 1
9 2375 1 1 13 LEU CA C 6.158 2.234 1.055 1.00 . A A . 13 LEU CA 1 1
9 2376 1 1 13 LEU CB C 5.356 3.522 0.926 1.00 . A A . 13 LEU CB 1 1
9 2377 1 1 13 LEU CD1 C 4.027 5.065 -0.536 1.00 . A A . 13 LEU CD1 1 1
9 2378 1 1 13 LEU CD2 C 6.430 4.612 -1.061 1.00 . A A . 13 LEU CD2 1 1
9 2379 1 1 13 LEU CG C 5.140 4.030 -0.503 1.00 . A A . 13 LEU CG 1 1
9 2380 1 1 13 LEU H H 5.423 1.406 -0.754 1.00 . A A . 13 LEU H 1 1
9 2381 1 1 13 LEU HA H 7.154 2.497 1.260 1.00 . A A . 13 LEU HA 1 1
9 2382 1 1 13 LEU HB2 H 4.394 3.372 1.389 1.00 . A A . 13 LEU HB2 1 1
9 2383 1 1 13 LEU HB3 H 5.897 4.285 1.482 1.00 . A A . 13 LEU HB3 1 1
9 2384 1 1 13 LEU HD11 H 3.546 5.045 -1.502 1.00 . A A . 13 LEU HD11 1 1
9 2385 1 1 13 LEU HD12 H 4.443 6.047 -0.360 1.00 . A A . 13 LEU HD12 1 1
9 2386 1 1 13 LEU HD13 H 3.302 4.839 0.233 1.00 . A A . 13 LEU HD13 1 1
9 2387 1 1 13 LEU HD21 H 6.215 5.155 -1.969 1.00 . A A . 13 LEU HD21 1 1
9 2388 1 1 13 LEU HD22 H 7.123 3.812 -1.274 1.00 . A A . 13 LEU HD22 1 1
9 2389 1 1 13 LEU HD23 H 6.866 5.283 -0.335 1.00 . A A . 13 LEU HD23 1 1
9 2390 1 1 13 LEU HG H 4.844 3.204 -1.131 1.00 . A A . 13 LEU HG 1 1
9 2391 1 1 13 LEU N N 6.206 1.450 -0.161 1.00 . A A . 13 LEU N 1 1
9 2392 1 1 13 LEU O O 5.631 1.912 3.366 1.00 . A A . 13 LEU O 1 1
9 2393 1 1 14 ARG C C 6.134 -0.595 4.104 1.00 . A A . 14 ARG C 1 1
9 2394 1 1 14 ARG CA C 4.984 -0.738 3.137 1.00 . A A . 14 ARG CA 1 1
9 2395 1 1 14 ARG CB C 4.821 -2.204 2.724 1.00 . A A . 14 ARG CB 1 1
9 2396 1 1 14 ARG CD C 3.281 -3.914 3.736 1.00 . A A . 14 ARG CD 1 1
9 2397 1 1 14 ARG CG C 3.388 -2.705 2.820 1.00 . A A . 14 ARG CG 1 1
9 2398 1 1 14 ARG CZ C 3.672 -4.452 6.108 1.00 . A A . 14 ARG CZ 1 1
9 2399 1 1 14 ARG H H 5.462 -0.265 1.140 1.00 . A A . 14 ARG H 1 1
9 2400 1 1 14 ARG HA H 4.064 -0.359 3.551 1.00 . A A . 14 ARG HA 1 1
9 2401 1 1 14 ARG HB2 H 5.159 -2.320 1.713 1.00 . A A . 14 ARG HB2 1 1
9 2402 1 1 14 ARG HB3 H 5.435 -2.815 3.369 1.00 . A A . 14 ARG HB3 1 1
9 2403 1 1 14 ARG HD2 H 2.298 -4.348 3.624 1.00 . A A . 14 ARG HD2 1 1
9 2404 1 1 14 ARG HD3 H 4.028 -4.637 3.443 1.00 . A A . 14 ARG HD3 1 1
9 2405 1 1 14 ARG HE H 3.486 -2.608 5.368 1.00 . A A . 14 ARG HE 1 1
9 2406 1 1 14 ARG HG2 H 2.765 -1.915 3.213 1.00 . A A . 14 ARG HG2 1 1
9 2407 1 1 14 ARG HG3 H 3.042 -2.980 1.835 1.00 . A A . 14 ARG HG3 1 1
9 2408 1 1 14 ARG HH11 H 3.542 -6.065 4.894 1.00 . A A . 14 ARG HH11 1 1
9 2409 1 1 14 ARG HH12 H 3.818 -6.415 6.567 1.00 . A A . 14 ARG HH12 1 1
9 2410 1 1 14 ARG HH21 H 3.849 -3.067 7.569 1.00 . A A . 14 ARG HH21 1 1
9 2411 1 1 14 ARG HH22 H 3.993 -4.714 8.086 1.00 . A A . 14 ARG HH22 1 1
9 2412 1 1 14 ARG N N 5.366 0.114 2.031 1.00 . A A . 14 ARG N 1 1
9 2413 1 1 14 ARG NE N 3.486 -3.560 5.137 1.00 . A A . 14 ARG NE 1 1
9 2414 1 1 14 ARG NH1 N 3.677 -5.750 5.833 1.00 . A A . 14 ARG NH1 1 1
9 2415 1 1 14 ARG NH2 N 3.853 -4.044 7.356 1.00 . A A . 14 ARG NH2 1 1
9 2416 1 1 14 ARG O O 5.980 -0.470 5.319 1.00 . A A . 14 ARG O 1 1
9 2417 1 1 15 CYS C C 8.750 1.190 4.300 1.00 . A A . 15 CYS C 1 1
9 2418 1 1 15 CYS CA C 8.569 -0.305 4.125 1.00 . A A . 15 CYS CA 1 1
9 2419 1 1 15 CYS CB C 9.697 -0.843 3.249 1.00 . A A . 15 CYS CB 1 1
9 2420 1 1 15 CYS H H 7.299 -0.593 2.474 1.00 . A A . 15 CYS H 1 1
9 2421 1 1 15 CYS HA H 8.567 -0.795 5.079 1.00 . A A . 15 CYS HA 1 1
9 2422 1 1 15 CYS HB2 H 9.263 -1.425 2.463 1.00 . A A . 15 CYS HB2 1 1
9 2423 1 1 15 CYS HB3 H 10.229 -0.015 2.802 1.00 . A A . 15 CYS HB3 1 1
9 2424 1 1 15 CYS HG H 10.415 -2.445 4.726 1.00 . A A . 15 CYS HG 1 1
9 2425 1 1 15 CYS N N 7.305 -0.531 3.465 1.00 . A A . 15 CYS N 1 1
9 2426 1 1 15 CYS O O 9.190 1.672 5.344 1.00 . A A . 15 CYS O 1 1
9 2427 1 1 15 CYS SG S 10.897 -1.878 4.119 1.00 . A A . 15 CYS SG 1 1
9 2428 1 1 16 SER C C 7.269 4.027 3.797 1.00 . A A . 16 SER C 1 1
9 2429 1 1 16 SER CA C 8.511 3.357 3.218 1.00 . A A . 16 SER CA 1 1
9 2430 1 1 16 SER CB C 8.788 3.870 1.800 1.00 . A A . 16 SER CB 1 1
9 2431 1 1 16 SER H H 8.069 1.443 2.449 1.00 . A A . 16 SER H 1 1
9 2432 1 1 16 SER HA H 9.337 3.603 3.829 1.00 . A A . 16 SER HA 1 1
9 2433 1 1 16 SER HB2 H 9.069 3.041 1.168 1.00 . A A . 16 SER HB2 1 1
9 2434 1 1 16 SER HB3 H 7.898 4.337 1.407 1.00 . A A . 16 SER HB3 1 1
9 2435 1 1 16 SER HG H 10.674 4.373 1.638 1.00 . A A . 16 SER HG 1 1
9 2436 1 1 16 SER N N 8.402 1.909 3.238 1.00 . A A . 16 SER N 1 1
9 2437 1 1 16 SER O O 6.847 5.068 3.252 1.00 . A A . 16 SER O 1 1
9 2438 1 1 16 SER OXT O 6.734 3.511 4.801 1.00 . A A . 16 SER OXT 1 1
9 2439 1 1 16 SER OG O 9.840 4.819 1.798 1.00 . A A . 16 SER OG 1 1
10 2440 1 1 1 GLY C C -8.452 2.537 -1.349 1.00 . A A . 1 GLY C 1 1
10 2441 1 1 1 GLY CA C -9.802 2.111 -1.896 1.00 . A A . 1 GLY CA 1 1
10 2442 1 1 1 GLY H1 H -11.781 2.761 -1.740 1.00 . A A . 1 GLY H1 1 1
10 2443 1 1 1 GLY H2 H -10.689 3.665 -0.817 1.00 . A A . 1 GLY H2 1 1
10 2444 1 1 1 GLY H3 H -11.155 2.122 -0.303 1.00 . A A . 1 GLY H3 1 1
10 2445 1 1 1 GLY HA2 H -9.874 1.035 -1.845 1.00 . A A . 1 GLY HA2 1 1
10 2446 1 1 1 GLY HA3 H -9.873 2.420 -2.927 1.00 . A A . 1 GLY HA3 1 1
10 2447 1 1 1 GLY N N -10.936 2.706 -1.136 1.00 . A A . 1 GLY N 1 1
10 2448 1 1 1 GLY O O -7.484 2.665 -2.100 1.00 . A A . 1 GLY O 1 1
10 2449 1 1 2 ARG C C -6.449 1.980 1.252 1.00 . A A . 2 ARG C 1 1
10 2450 1 1 2 ARG CA C -7.147 3.171 0.604 1.00 . A A . 2 ARG CA 1 1
10 2451 1 1 2 ARG CB C -7.428 4.247 1.655 1.00 . A A . 2 ARG CB 1 1
10 2452 1 1 2 ARG CD C -9.153 5.574 0.394 1.00 . A A . 2 ARG CD 1 1
10 2453 1 1 2 ARG CG C -7.786 5.600 1.059 1.00 . A A . 2 ARG CG 1 1
10 2454 1 1 2 ARG CZ C -8.954 6.919 -1.663 1.00 . A A . 2 ARG CZ 1 1
10 2455 1 1 2 ARG H H -9.193 2.638 0.505 1.00 . A A . 2 ARG H 1 1
10 2456 1 1 2 ARG HA H -6.500 3.581 -0.156 1.00 . A A . 2 ARG HA 1 1
10 2457 1 1 2 ARG HB2 H -8.249 3.922 2.276 1.00 . A A . 2 ARG HB2 1 1
10 2458 1 1 2 ARG HB3 H -6.550 4.370 2.271 1.00 . A A . 2 ARG HB3 1 1
10 2459 1 1 2 ARG HD2 H -9.627 4.628 0.608 1.00 . A A . 2 ARG HD2 1 1
10 2460 1 1 2 ARG HD3 H -9.752 6.376 0.800 1.00 . A A . 2 ARG HD3 1 1
10 2461 1 1 2 ARG HE H -9.079 4.927 -1.605 1.00 . A A . 2 ARG HE 1 1
10 2462 1 1 2 ARG HG2 H -7.794 6.338 1.847 1.00 . A A . 2 ARG HG2 1 1
10 2463 1 1 2 ARG HG3 H -7.041 5.866 0.323 1.00 . A A . 2 ARG HG3 1 1
10 2464 1 1 2 ARG HH11 H -8.975 8.005 0.043 1.00 . A A . 2 ARG HH11 1 1
10 2465 1 1 2 ARG HH12 H -8.840 8.922 -1.418 1.00 . A A . 2 ARG HH12 1 1
10 2466 1 1 2 ARG HH21 H -8.901 6.135 -3.526 1.00 . A A . 2 ARG HH21 1 1
10 2467 1 1 2 ARG HH22 H -8.798 7.863 -3.444 1.00 . A A . 2 ARG HH22 1 1
10 2468 1 1 2 ARG N N -8.387 2.756 -0.041 1.00 . A A . 2 ARG N 1 1
10 2469 1 1 2 ARG NE N -9.060 5.739 -1.055 1.00 . A A . 2 ARG NE 1 1
10 2470 1 1 2 ARG NH1 N -8.920 8.040 -0.954 1.00 . A A . 2 ARG NH1 1 1
10 2471 1 1 2 ARG NH2 N -8.878 6.976 -2.986 1.00 . A A . 2 ARG NH2 1 1
10 2472 1 1 2 ARG O O -5.885 2.091 2.341 1.00 . A A . 2 ARG O 1 1
10 2473 1 1 3 MET C C -6.035 -1.524 0.083 1.00 . A A . 3 MET C 1 1
10 2474 1 1 3 MET CA C -5.866 -0.378 1.076 1.00 . A A . 3 MET CA 1 1
10 2475 1 1 3 MET CB C -6.468 -0.767 2.429 1.00 . A A . 3 MET CB 1 1
10 2476 1 1 3 MET CE C -10.195 0.109 3.873 1.00 . A A . 3 MET CE 1 1
10 2477 1 1 3 MET CG C -7.988 -0.764 2.440 1.00 . A A . 3 MET CG 1 1
10 2478 1 1 3 MET H H -6.957 0.815 -0.290 1.00 . A A . 3 MET H 1 1
10 2479 1 1 3 MET HA H -4.812 -0.182 1.204 1.00 . A A . 3 MET HA 1 1
10 2480 1 1 3 MET HB2 H -6.128 -1.758 2.689 1.00 . A A . 3 MET HB2 1 1
10 2481 1 1 3 MET HB3 H -6.122 -0.068 3.177 1.00 . A A . 3 MET HB3 1 1
10 2482 1 1 3 MET HE1 H -10.035 -0.897 4.231 1.00 . A A . 3 MET HE1 1 1
10 2483 1 1 3 MET HE2 H -10.969 0.105 3.120 1.00 . A A . 3 MET HE2 1 1
10 2484 1 1 3 MET HE3 H -10.496 0.740 4.696 1.00 . A A . 3 MET HE3 1 1
10 2485 1 1 3 MET HG2 H -8.343 -0.851 1.424 1.00 . A A . 3 MET HG2 1 1
10 2486 1 1 3 MET HG3 H -8.331 -1.613 3.013 1.00 . A A . 3 MET HG3 1 1
10 2487 1 1 3 MET N N -6.492 0.838 0.573 1.00 . A A . 3 MET N 1 1
10 2488 1 1 3 MET O O -6.255 -2.671 0.473 1.00 . A A . 3 MET O 1 1
10 2489 1 1 3 MET SD S -8.675 0.738 3.163 1.00 . A A . 3 MET SD 1 1
10 2490 1 1 4 LEU C C -5.314 -1.804 -3.510 1.00 . A A . 4 LEU C 1 1
10 2491 1 1 4 LEU CA C -6.071 -2.204 -2.258 1.00 . A A . 4 LEU CA 1 1
10 2492 1 1 4 LEU CB C -7.550 -2.460 -2.594 1.00 . A A . 4 LEU CB 1 1
10 2493 1 1 4 LEU CD1 C -9.882 -1.613 -2.227 1.00 . A A . 4 LEU CD1 1 1
10 2494 1 1 4 LEU CD2 C -8.783 -3.029 -0.482 1.00 . A A . 4 LEU CD2 1 1
10 2495 1 1 4 LEU CG C -8.565 -1.970 -1.555 1.00 . A A . 4 LEU CG 1 1
10 2496 1 1 4 LEU H H -5.750 -0.272 -1.445 1.00 . A A . 4 LEU H 1 1
10 2497 1 1 4 LEU HA H -5.644 -3.098 -1.903 1.00 . A A . 4 LEU HA 1 1
10 2498 1 1 4 LEU HB2 H -7.770 -1.976 -3.534 1.00 . A A . 4 LEU HB2 1 1
10 2499 1 1 4 LEU HB3 H -7.685 -3.524 -2.719 1.00 . A A . 4 LEU HB3 1 1
10 2500 1 1 4 LEU HD11 H -10.595 -1.304 -1.477 1.00 . A A . 4 LEU HD11 1 1
10 2501 1 1 4 LEU HD12 H -10.263 -2.475 -2.753 1.00 . A A . 4 LEU HD12 1 1
10 2502 1 1 4 LEU HD13 H -9.721 -0.806 -2.926 1.00 . A A . 4 LEU HD13 1 1
10 2503 1 1 4 LEU HD21 H -9.713 -3.545 -0.670 1.00 . A A . 4 LEU HD21 1 1
10 2504 1 1 4 LEU HD22 H -8.823 -2.555 0.487 1.00 . A A . 4 LEU HD22 1 1
10 2505 1 1 4 LEU HD23 H -7.967 -3.737 -0.504 1.00 . A A . 4 LEU HD23 1 1
10 2506 1 1 4 LEU HG H -8.185 -1.080 -1.076 1.00 . A A . 4 LEU HG 1 1
10 2507 1 1 4 LEU N N -5.929 -1.202 -1.203 1.00 . A A . 4 LEU N 1 1
10 2508 1 1 4 LEU O O -4.488 -2.558 -4.022 1.00 . A A . 4 LEU O 1 1
10 2509 1 1 5 PRO C C -3.620 0.519 -4.928 1.00 . A A . 5 PRO C 1 1
10 2510 1 1 5 PRO CA C -4.987 -0.081 -5.231 1.00 . A A . 5 PRO CA 1 1
10 2511 1 1 5 PRO CB C -6.004 0.991 -5.670 1.00 . A A . 5 PRO CB 1 1
10 2512 1 1 5 PRO CD C -6.577 0.321 -3.494 1.00 . A A . 5 PRO CD 1 1
10 2513 1 1 5 PRO CG C -7.179 0.772 -4.765 1.00 . A A . 5 PRO CG 1 1
10 2514 1 1 5 PRO HA H -4.891 -0.834 -5.999 1.00 . A A . 5 PRO HA 1 1
10 2515 1 1 5 PRO HB2 H -5.577 1.975 -5.538 1.00 . A A . 5 PRO HB2 1 1
10 2516 1 1 5 PRO HB3 H -6.270 0.841 -6.706 1.00 . A A . 5 PRO HB3 1 1
10 2517 1 1 5 PRO HD2 H -6.102 1.142 -2.975 1.00 . A A . 5 PRO HD2 1 1
10 2518 1 1 5 PRO HD3 H -7.299 -0.177 -2.866 1.00 . A A . 5 PRO HD3 1 1
10 2519 1 1 5 PRO HG2 H -7.730 1.682 -4.622 1.00 . A A . 5 PRO HG2 1 1
10 2520 1 1 5 PRO HG3 H -7.810 -0.012 -5.156 1.00 . A A . 5 PRO HG3 1 1
10 2521 1 1 5 PRO N N -5.604 -0.616 -4.023 1.00 . A A . 5 PRO N 1 1
10 2522 1 1 5 PRO O O -2.820 0.772 -5.827 1.00 . A A . 5 PRO O 1 1
10 2523 1 1 6 GLN C C -1.296 0.173 -2.441 1.00 . A A . 6 GLN C 1 1
10 2524 1 1 6 GLN CA C -2.091 1.252 -3.178 1.00 . A A . 6 GLN CA 1 1
10 2525 1 1 6 GLN CB C -2.318 2.453 -2.255 1.00 . A A . 6 GLN CB 1 1
10 2526 1 1 6 GLN CD C -3.289 4.784 -2.236 1.00 . A A . 6 GLN CD 1 1
10 2527 1 1 6 GLN CG C -3.470 3.347 -2.684 1.00 . A A . 6 GLN CG 1 1
10 2528 1 1 6 GLN H H -4.039 0.474 -2.975 1.00 . A A . 6 GLN H 1 1
10 2529 1 1 6 GLN HA H -1.529 1.572 -4.043 1.00 . A A . 6 GLN HA 1 1
10 2530 1 1 6 GLN HB2 H -2.523 2.091 -1.258 1.00 . A A . 6 GLN HB2 1 1
10 2531 1 1 6 GLN HB3 H -1.417 3.049 -2.233 1.00 . A A . 6 GLN HB3 1 1
10 2532 1 1 6 GLN HE21 H -4.535 4.494 -0.715 1.00 . A A . 6 GLN HE21 1 1
10 2533 1 1 6 GLN HE22 H -3.868 6.083 -0.846 1.00 . A A . 6 GLN HE22 1 1
10 2534 1 1 6 GLN HG2 H -3.543 3.327 -3.761 1.00 . A A . 6 GLN HG2 1 1
10 2535 1 1 6 GLN HG3 H -4.384 2.963 -2.255 1.00 . A A . 6 GLN HG3 1 1
10 2536 1 1 6 GLN N N -3.361 0.715 -3.638 1.00 . A A . 6 GLN N 1 1
10 2537 1 1 6 GLN NE2 N -3.966 5.158 -1.156 1.00 . A A . 6 GLN NE2 1 1
10 2538 1 1 6 GLN O O -0.102 0.328 -2.204 1.00 . A A . 6 GLN O 1 1
10 2539 1 1 6 GLN OE1 O -2.550 5.551 -2.855 1.00 . A A . 6 GLN OE1 1 1
10 2540 1 1 7 LEU C C -0.041 -2.469 -2.071 1.00 . A A . 7 LEU C 1 1
10 2541 1 1 7 LEU CA C -1.321 -2.022 -1.368 1.00 . A A . 7 LEU CA 1 1
10 2542 1 1 7 LEU CB C -2.283 -3.204 -1.240 1.00 . A A . 7 LEU CB 1 1
10 2543 1 1 7 LEU CD1 C -1.912 -3.574 1.212 1.00 . A A . 7 LEU CD1 1 1
10 2544 1 1 7 LEU CD2 C -2.877 -5.403 -0.194 1.00 . A A . 7 LEU CD2 1 1
10 2545 1 1 7 LEU CG C -1.914 -4.226 -0.162 1.00 . A A . 7 LEU CG 1 1
10 2546 1 1 7 LEU H H -2.922 -0.991 -2.290 1.00 . A A . 7 LEU H 1 1
10 2547 1 1 7 LEU HA H -1.069 -1.671 -0.383 1.00 . A A . 7 LEU HA 1 1
10 2548 1 1 7 LEU HB2 H -3.267 -2.819 -1.020 1.00 . A A . 7 LEU HB2 1 1
10 2549 1 1 7 LEU HB3 H -2.320 -3.716 -2.190 1.00 . A A . 7 LEU HB3 1 1
10 2550 1 1 7 LEU HD11 H -2.236 -4.291 1.951 1.00 . A A . 7 LEU HD11 1 1
10 2551 1 1 7 LEU HD12 H -2.583 -2.728 1.210 1.00 . A A . 7 LEU HD12 1 1
10 2552 1 1 7 LEU HD13 H -0.912 -3.240 1.449 1.00 . A A . 7 LEU HD13 1 1
10 2553 1 1 7 LEU HD21 H -3.668 -5.240 0.523 1.00 . A A . 7 LEU HD21 1 1
10 2554 1 1 7 LEU HD22 H -2.346 -6.310 0.057 1.00 . A A . 7 LEU HD22 1 1
10 2555 1 1 7 LEU HD23 H -3.301 -5.496 -1.182 1.00 . A A . 7 LEU HD23 1 1
10 2556 1 1 7 LEU HG H -0.920 -4.601 -0.356 1.00 . A A . 7 LEU HG 1 1
10 2557 1 1 7 LEU N N -1.968 -0.922 -2.079 1.00 . A A . 7 LEU N 1 1
10 2558 1 1 7 LEU O O 0.877 -2.991 -1.439 1.00 . A A . 7 LEU O 1 1
10 2559 1 1 8 VAL C C 2.229 -1.536 -4.133 1.00 . A A . 8 VAL C 1 1
10 2560 1 1 8 VAL CA C 1.178 -2.631 -4.169 1.00 . A A . 8 VAL CA 1 1
10 2561 1 1 8 VAL CB C 0.799 -2.927 -5.634 1.00 . A A . 8 VAL CB 1 1
10 2562 1 1 8 VAL CG1 C 2.000 -3.461 -6.401 1.00 . A A . 8 VAL CG1 1 1
10 2563 1 1 8 VAL CG2 C -0.360 -3.909 -5.697 1.00 . A A . 8 VAL CG2 1 1
10 2564 1 1 8 VAL H H -0.749 -1.829 -3.821 1.00 . A A . 8 VAL H 1 1
10 2565 1 1 8 VAL HA H 1.595 -3.521 -3.742 1.00 . A A . 8 VAL HA 1 1
10 2566 1 1 8 VAL HB H 0.486 -2.004 -6.099 1.00 . A A . 8 VAL HB 1 1
10 2567 1 1 8 VAL HG11 H 2.689 -3.927 -5.713 1.00 . A A . 8 VAL HG11 1 1
10 2568 1 1 8 VAL HG12 H 2.495 -2.646 -6.909 1.00 . A A . 8 VAL HG12 1 1
10 2569 1 1 8 VAL HG13 H 1.669 -4.188 -7.127 1.00 . A A . 8 VAL HG13 1 1
10 2570 1 1 8 VAL HG21 H -0.233 -4.565 -6.545 1.00 . A A . 8 VAL HG21 1 1
10 2571 1 1 8 VAL HG22 H -1.288 -3.365 -5.799 1.00 . A A . 8 VAL HG22 1 1
10 2572 1 1 8 VAL HG23 H -0.386 -4.495 -4.789 1.00 . A A . 8 VAL HG23 1 1
10 2573 1 1 8 VAL N N 0.012 -2.255 -3.379 1.00 . A A . 8 VAL N 1 1
10 2574 1 1 8 VAL O O 3.280 -1.672 -3.498 1.00 . A A . 8 VAL O 1 1
10 2575 1 1 9 CYS C C 3.237 1.047 -3.409 1.00 . A A . 9 CYS C 1 1
10 2576 1 1 9 CYS CA C 2.843 0.694 -4.826 1.00 . A A . 9 CYS CA 1 1
10 2577 1 1 9 CYS CB C 2.205 1.897 -5.524 1.00 . A A . 9 CYS CB 1 1
10 2578 1 1 9 CYS H H 1.074 -0.384 -5.268 1.00 . A A . 9 CYS H 1 1
10 2579 1 1 9 CYS HA H 3.732 0.394 -5.359 1.00 . A A . 9 CYS HA 1 1
10 2580 1 1 9 CYS HB2 H 1.148 1.914 -5.302 1.00 . A A . 9 CYS HB2 1 1
10 2581 1 1 9 CYS HB3 H 2.660 2.803 -5.151 1.00 . A A . 9 CYS HB3 1 1
10 2582 1 1 9 CYS HG H 1.564 2.201 -7.705 1.00 . A A . 9 CYS HG 1 1
10 2583 1 1 9 CYS N N 1.930 -0.437 -4.800 1.00 . A A . 9 CYS N 1 1
10 2584 1 1 9 CYS O O 4.397 1.375 -3.128 1.00 . A A . 9 CYS O 1 1
10 2585 1 1 9 CYS SG S 2.387 1.889 -7.322 1.00 . A A . 9 CYS SG 1 1
10 2586 1 1 10 ARG C C 3.625 0.178 -0.669 1.00 . A A . 10 ARG C 1 1
10 2587 1 1 10 ARG CA C 2.623 1.196 -1.117 1.00 . A A . 10 ARG CA 1 1
10 2588 1 1 10 ARG CB C 1.445 1.191 -0.164 1.00 . A A . 10 ARG CB 1 1
10 2589 1 1 10 ARG CD C 0.845 2.328 1.991 1.00 . A A . 10 ARG CD 1 1
10 2590 1 1 10 ARG CG C 1.886 1.499 1.262 1.00 . A A . 10 ARG CG 1 1
10 2591 1 1 10 ARG CZ C -1.010 1.863 3.547 1.00 . A A . 10 ARG CZ 1 1
10 2592 1 1 10 ARG H H 1.390 0.623 -2.735 1.00 . A A . 10 ARG H 1 1
10 2593 1 1 10 ARG HA H 3.092 2.160 -1.087 1.00 . A A . 10 ARG HA 1 1
10 2594 1 1 10 ARG HB2 H 0.730 1.939 -0.477 1.00 . A A . 10 ARG HB2 1 1
10 2595 1 1 10 ARG HB3 H 0.978 0.218 -0.176 1.00 . A A . 10 ARG HB3 1 1
10 2596 1 1 10 ARG HD2 H 1.324 2.866 2.794 1.00 . A A . 10 ARG HD2 1 1
10 2597 1 1 10 ARG HD3 H 0.410 3.029 1.293 1.00 . A A . 10 ARG HD3 1 1
10 2598 1 1 10 ARG HE H -0.349 0.606 2.142 1.00 . A A . 10 ARG HE 1 1
10 2599 1 1 10 ARG HG2 H 2.030 0.568 1.791 1.00 . A A . 10 ARG HG2 1 1
10 2600 1 1 10 ARG HG3 H 2.836 2.048 1.233 1.00 . A A . 10 ARG HG3 1 1
10 2601 1 1 10 ARG HH11 H -0.160 3.682 3.786 1.00 . A A . 10 ARG HH11 1 1
10 2602 1 1 10 ARG HH12 H -1.464 3.326 4.867 1.00 . A A . 10 ARG HH12 1 1
10 2603 1 1 10 ARG HH21 H -2.067 0.139 3.563 1.00 . A A . 10 ARG HH21 1 1
10 2604 1 1 10 ARG HH22 H -2.547 1.316 4.741 1.00 . A A . 10 ARG HH22 1 1
10 2605 1 1 10 ARG N N 2.289 0.927 -2.488 1.00 . A A . 10 ARG N 1 1
10 2606 1 1 10 ARG NE N -0.219 1.492 2.543 1.00 . A A . 10 ARG NE 1 1
10 2607 1 1 10 ARG NH1 N -0.866 3.055 4.113 1.00 . A A . 10 ARG NH1 1 1
10 2608 1 1 10 ARG NH2 N -1.952 1.038 3.986 1.00 . A A . 10 ARG NH2 1 1
10 2609 1 1 10 ARG O O 4.617 0.544 -0.120 1.00 . A A . 10 ARG O 1 1
10 2610 1 1 11 LEU C C 5.691 -1.585 -0.639 1.00 . A A . 11 LEU C 1 1
10 2611 1 1 11 LEU CA C 4.310 -2.166 -0.630 1.00 . A A . 11 LEU CA 1 1
10 2612 1 1 11 LEU CB C 4.205 -3.324 -1.624 1.00 . A A . 11 LEU CB 1 1
10 2613 1 1 11 LEU CD1 C 5.940 -4.690 -0.437 1.00 . A A . 11 LEU CD1 1 1
10 2614 1 1 11 LEU CD2 C 3.512 -5.119 -0.020 1.00 . A A . 11 LEU CD2 1 1
10 2615 1 1 11 LEU CG C 4.549 -4.699 -1.052 1.00 . A A . 11 LEU CG 1 1
10 2616 1 1 11 LEU H H 2.602 -1.300 -1.449 1.00 . A A . 11 LEU H 1 1
10 2617 1 1 11 LEU HA H 4.079 -2.512 0.356 1.00 . A A . 11 LEU HA 1 1
10 2618 1 1 11 LEU HB2 H 3.194 -3.355 -2.003 1.00 . A A . 11 LEU HB2 1 1
10 2619 1 1 11 LEU HB3 H 4.875 -3.125 -2.449 1.00 . A A . 11 LEU HB3 1 1
10 2620 1 1 11 LEU HD11 H 6.355 -5.687 -0.469 1.00 . A A . 11 LEU HD11 1 1
10 2621 1 1 11 LEU HD12 H 5.878 -4.358 0.589 1.00 . A A . 11 LEU HD12 1 1
10 2622 1 1 11 LEU HD13 H 6.575 -4.017 -0.995 1.00 . A A . 11 LEU HD13 1 1
10 2623 1 1 11 LEU HD21 H 2.526 -5.068 -0.460 1.00 . A A . 11 LEU HD21 1 1
10 2624 1 1 11 LEU HD22 H 3.561 -4.456 0.830 1.00 . A A . 11 LEU HD22 1 1
10 2625 1 1 11 LEU HD23 H 3.711 -6.131 0.299 1.00 . A A . 11 LEU HD23 1 1
10 2626 1 1 11 LEU HG H 4.542 -5.427 -1.850 1.00 . A A . 11 LEU HG 1 1
10 2627 1 1 11 LEU N N 3.382 -1.094 -0.969 1.00 . A A . 11 LEU N 1 1
10 2628 1 1 11 LEU O O 6.486 -1.767 0.294 1.00 . A A . 11 LEU O 1 1
10 2629 1 1 12 VAL C C 7.273 0.772 -0.481 1.00 . A A . 12 VAL C 1 1
10 2630 1 1 12 VAL CA C 7.173 -0.073 -1.730 1.00 . A A . 12 VAL CA 1 1
10 2631 1 1 12 VAL CB C 7.305 0.803 -2.991 1.00 . A A . 12 VAL CB 1 1
10 2632 1 1 12 VAL CG1 C 8.708 1.384 -3.096 1.00 . A A . 12 VAL CG1 1 1
10 2633 1 1 12 VAL CG2 C 6.958 0.002 -4.238 1.00 . A A . 12 VAL CG2 1 1
10 2634 1 1 12 VAL H H 5.219 -0.601 -2.326 1.00 . A A . 12 VAL H 1 1
10 2635 1 1 12 VAL HA H 7.939 -0.805 -1.711 1.00 . A A . 12 VAL HA 1 1
10 2636 1 1 12 VAL HB H 6.607 1.623 -2.910 1.00 . A A . 12 VAL HB 1 1
10 2637 1 1 12 VAL HG11 H 8.985 1.468 -4.136 1.00 . A A . 12 VAL HG11 1 1
10 2638 1 1 12 VAL HG12 H 9.405 0.733 -2.589 1.00 . A A . 12 VAL HG12 1 1
10 2639 1 1 12 VAL HG13 H 8.728 2.361 -2.636 1.00 . A A . 12 VAL HG13 1 1
10 2640 1 1 12 VAL HG21 H 6.377 -0.865 -3.959 1.00 . A A . 12 VAL HG21 1 1
10 2641 1 1 12 VAL HG22 H 7.867 -0.316 -4.726 1.00 . A A . 12 VAL HG22 1 1
10 2642 1 1 12 VAL HG23 H 6.384 0.619 -4.913 1.00 . A A . 12 VAL HG23 1 1
10 2643 1 1 12 VAL N N 5.929 -0.775 -1.661 1.00 . A A . 12 VAL N 1 1
10 2644 1 1 12 VAL O O 8.276 0.749 0.233 1.00 . A A . 12 VAL O 1 1
10 2645 1 1 13 LEU C C 5.568 1.449 2.208 1.00 . A A . 13 LEU C 1 1
10 2646 1 1 13 LEU CA C 6.098 2.258 1.021 1.00 . A A . 13 LEU CA 1 1
10 2647 1 1 13 LEU CB C 5.318 3.553 0.856 1.00 . A A . 13 LEU CB 1 1
10 2648 1 1 13 LEU CD1 C 4.079 5.136 -0.641 1.00 . A A . 13 LEU CD1 1 1
10 2649 1 1 13 LEU CD2 C 6.445 4.516 -1.164 1.00 . A A . 13 LEU CD2 1 1
10 2650 1 1 13 LEU CG C 5.124 4.033 -0.583 1.00 . A A . 13 LEU CG 1 1
10 2651 1 1 13 LEU H H 5.404 1.400 -0.790 1.00 . A A . 13 LEU H 1 1
10 2652 1 1 13 LEU HA H 7.088 2.511 1.254 1.00 . A A . 13 LEU HA 1 1
10 2653 1 1 13 LEU HB2 H 4.349 3.429 1.314 1.00 . A A . 13 LEU HB2 1 1
10 2654 1 1 13 LEU HB3 H 5.865 4.318 1.402 1.00 . A A . 13 LEU HB3 1 1
10 2655 1 1 13 LEU HD11 H 4.336 5.836 -1.421 1.00 . A A . 13 LEU HD11 1 1
10 2656 1 1 13 LEU HD12 H 4.045 5.651 0.308 1.00 . A A . 13 LEU HD12 1 1
10 2657 1 1 13 LEU HD13 H 3.111 4.704 -0.850 1.00 . A A . 13 LEU HD13 1 1
10 2658 1 1 13 LEU HD21 H 6.265 5.000 -2.113 1.00 . A A . 13 LEU HD21 1 1
10 2659 1 1 13 LEU HD22 H 7.104 3.674 -1.310 1.00 . A A . 13 LEU HD22 1 1
10 2660 1 1 13 LEU HD23 H 6.902 5.218 -0.483 1.00 . A A . 13 LEU HD23 1 1
10 2661 1 1 13 LEU HG H 4.773 3.209 -1.187 1.00 . A A . 13 LEU HG 1 1
10 2662 1 1 13 LEU N N 6.179 1.464 -0.190 1.00 . A A . 13 LEU N 1 1
10 2663 1 1 13 LEU O O 5.505 1.965 3.322 1.00 . A A . 13 LEU O 1 1
10 2664 1 1 14 ARG C C 5.996 -0.574 4.078 1.00 . A A . 14 ARG C 1 1
10 2665 1 1 14 ARG CA C 4.844 -0.679 3.104 1.00 . A A . 14 ARG CA 1 1
10 2666 1 1 14 ARG CB C 4.622 -2.134 2.673 1.00 . A A . 14 ARG CB 1 1
10 2667 1 1 14 ARG CD C 5.956 -3.932 3.817 1.00 . A A . 14 ARG CD 1 1
10 2668 1 1 14 ARG CG C 4.665 -3.131 3.822 1.00 . A A . 14 ARG CG 1 1
10 2669 1 1 14 ARG CZ C 7.631 -4.662 5.471 1.00 . A A . 14 ARG CZ 1 1
10 2670 1 1 14 ARG H H 5.382 -0.234 1.119 1.00 . A A . 14 ARG H 1 1
10 2671 1 1 14 ARG HA H 3.939 -0.266 3.516 1.00 . A A . 14 ARG HA 1 1
10 2672 1 1 14 ARG HB2 H 3.654 -2.210 2.202 1.00 . A A . 14 ARG HB2 1 1
10 2673 1 1 14 ARG HB3 H 5.382 -2.408 1.960 1.00 . A A . 14 ARG HB3 1 1
10 2674 1 1 14 ARG HD2 H 5.799 -4.840 3.256 1.00 . A A . 14 ARG HD2 1 1
10 2675 1 1 14 ARG HD3 H 6.727 -3.344 3.341 1.00 . A A . 14 ARG HD3 1 1
10 2676 1 1 14 ARG HE H 5.728 -4.227 5.886 1.00 . A A . 14 ARG HE 1 1
10 2677 1 1 14 ARG HG2 H 4.592 -2.592 4.756 1.00 . A A . 14 ARG HG2 1 1
10 2678 1 1 14 ARG HG3 H 3.830 -3.809 3.730 1.00 . A A . 14 ARG HG3 1 1
10 2679 1 1 14 ARG HH11 H 8.329 -4.520 3.578 1.00 . A A . 14 ARG HH11 1 1
10 2680 1 1 14 ARG HH12 H 9.486 -5.033 4.759 1.00 . A A . 14 ARG HH12 1 1
10 2681 1 1 14 ARG HH21 H 7.249 -4.901 7.442 1.00 . A A . 14 ARG HH21 1 1
10 2682 1 1 14 ARG HH22 H 8.873 -5.250 6.953 1.00 . A A . 14 ARG HH22 1 1
10 2683 1 1 14 ARG N N 5.261 0.158 2.001 1.00 . A A . 14 ARG N 1 1
10 2684 1 1 14 ARG NE N 6.392 -4.280 5.168 1.00 . A A . 14 ARG NE 1 1
10 2685 1 1 14 ARG NH1 N 8.558 -4.745 4.525 1.00 . A A . 14 ARG NH1 1 1
10 2686 1 1 14 ARG NH2 N 7.943 -4.962 6.724 1.00 . A A . 14 ARG NH2 1 1
10 2687 1 1 14 ARG O O 5.838 -0.470 5.294 1.00 . A A . 14 ARG O 1 1
10 2688 1 1 15 CYS C C 8.650 1.178 4.289 1.00 . A A . 15 CYS C 1 1
10 2689 1 1 15 CYS CA C 8.436 -0.316 4.123 1.00 . A A . 15 CYS CA 1 1
10 2690 1 1 15 CYS CB C 9.561 -0.891 3.268 1.00 . A A . 15 CYS CB 1 1
10 2691 1 1 15 CYS H H 7.176 -0.552 2.459 1.00 . A A . 15 CYS H 1 1
10 2692 1 1 15 CYS HA H 8.408 -0.797 5.082 1.00 . A A . 15 CYS HA 1 1
10 2693 1 1 15 CYS HB2 H 9.123 -1.428 2.453 1.00 . A A . 15 CYS HB2 1 1
10 2694 1 1 15 CYS HB3 H 10.152 -0.083 2.862 1.00 . A A . 15 CYS HB3 1 1
10 2695 1 1 15 CYS HG H 11.246 -1.484 4.708 1.00 . A A . 15 CYS HG 1 1
10 2696 1 1 15 CYS N N 7.174 -0.512 3.449 1.00 . A A . 15 CYS N 1 1
10 2697 1 1 15 CYS O O 9.104 1.657 5.329 1.00 . A A . 15 CYS O 1 1
10 2698 1 1 15 CYS SG S 10.675 -2.013 4.145 1.00 . A A . 15 CYS SG 1 1
10 2699 1 1 16 SER C C 7.203 4.041 3.744 1.00 . A A . 16 SER C 1 1
10 2700 1 1 16 SER CA C 8.446 3.346 3.195 1.00 . A A . 16 SER CA 1 1
10 2701 1 1 16 SER CB C 8.756 3.841 1.778 1.00 . A A . 16 SER CB 1 1
10 2702 1 1 16 SER H H 7.963 1.435 2.440 1.00 . A A . 16 SER H 1 1
10 2703 1 1 16 SER HA H 9.263 3.585 3.819 1.00 . A A . 16 SER HA 1 1
10 2704 1 1 16 SER HB2 H 9.023 2.999 1.155 1.00 . A A . 16 SER HB2 1 1
10 2705 1 1 16 SER HB3 H 7.885 4.330 1.369 1.00 . A A . 16 SER HB3 1 1
10 2706 1 1 16 SER HG H 10.653 4.294 1.595 1.00 . A A . 16 SER HG 1 1
10 2707 1 1 16 SER N N 8.309 1.899 3.226 1.00 . A A . 16 SER N 1 1
10 2708 1 1 16 SER O O 6.806 5.083 3.180 1.00 . A A . 16 SER O 1 1
10 2709 1 1 16 SER OXT O 6.643 3.545 4.745 1.00 . A A . 16 SER OXT 1 1
10 2710 1 1 16 SER OG O 9.835 4.760 1.784 1.00 . A A . 16 SER OG 1 1
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