NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
381947 |
1jaa   |
5108 | cing | 4-filtered-FRED | STAR | entry | full | 64 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1jaa
# This FRED archive file contains, for PDB entry <1jaa>:
#
# - 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_1jaa
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1jaa
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1386.57
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 $DapE____Ace_IWG_Dap_SGKLIETTA_ANALOGUE_OF_HIV_GP41 A . 1 1
stop_
save_
save_DapE____Ace_IWG_Dap_SGKLIETTA_ANALOGUE_OF_HIV_GP41
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "DapE Ace IWG Dap SGKLIETTA ANALOGUE OF HIV GP41"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XIWGXSGKLIETTA
_Entity.Number_of_monomers 14
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 ACE $ACE 1 1
2 ILE . 1 1
3 TRP . 1 1
4 GLY . 1 1
5 . $. 1 1
6 SER . 1 1
7 GLY . 1 1
8 LYS . 1 1
9 LEU . 1 1
10 ILE . 1 1
11 GLU . 1 1
12 THR . 1 1
13 THR . 1 1
14 ALA . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
ACE 1 1 1 1
ILE 2 2 1 1
TRP 3 3 1 1
GLY 4 4 1 1
. 5 5 1 1
SER 6 6 1 1
GLY 7 7 1 1
LYS 8 8 1 1
LEU 9 9 1 1
ILE 10 10 1 1
GLU 11 11 1 1
THR 12 12 1 1
THR 13 13 1 1
ALA 14 14 1 1
stop_
save_
save_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACE
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_DYANA/DIANA_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
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 ILE H . 2 ILE HN 1 1
1 1 2 1 1 2 ILE HA . 2 ILE HA 1 1
2 1 1 1 1 2 ILE H . 2 ILE HN 1 1
2 1 2 1 1 2 ILE HB . 2 ILE HB 1 1
3 1 1 1 1 2 ILE H . 2 ILE HN 1 1
3 1 2 1 1 2 ILE MD . 2 ILE QD1 1 1
4 1 1 1 1 2 ILE H . 2 ILE HN 1 1
4 1 2 1 1 2 ILE QG . 2 ILE QG1 1 1
5 1 1 1 1 2 ILE H . 2 ILE HN 1 1
5 1 2 1 1 2 ILE MG . 2 ILE QG2 1 1
6 1 1 1 1 2 ILE H . 2 ILE HN 1 1
6 1 2 1 1 3 TRP H . 3 TRP HN 1 1
7 1 1 1 1 2 ILE HA . 2 ILE HA 1 1
7 1 2 1 1 3 TRP H . 3 TRP HN 1 1
8 1 1 1 1 2 ILE HA . 2 ILE HA 1 1
8 1 2 1 1 3 TRP HD1 . 3 TRP HD1 1 1
9 1 1 1 1 2 ILE HB . 2 ILE HB 1 1
9 1 2 1 1 3 TRP H . 3 TRP HN 1 1
10 1 1 1 1 2 ILE MD . 2 ILE QD1 1 1
10 1 2 1 1 3 TRP H . 3 TRP HN 1 1
11 1 1 1 1 2 ILE QG . 2 ILE QG1 1 1
11 1 2 1 1 3 TRP H . 3 TRP HN 1 1
12 1 1 1 1 3 TRP H . 3 TRP HN 1 1
12 1 2 1 1 3 TRP HA . 3 TRP HA 1 1
13 1 1 1 1 3 TRP H . 3 TRP HN 1 1
13 1 2 1 1 3 TRP QB . 3 TRP QB 1 1
14 1 1 1 1 3 TRP H . 3 TRP HN 1 1
14 1 2 1 1 4 GLY H . 4 GLY HN 1 1
15 1 1 1 1 3 TRP HA . 3 TRP HA 1 1
15 1 2 1 1 4 GLY H . 4 GLY HN 1 1
16 1 1 1 1 3 TRP QB . 3 TRP QB 1 1
16 1 2 1 1 4 GLY H . 4 GLY HN 1 1
17 1 1 1 1 3 TRP HD1 . 3 TRP HD1 1 1
17 1 2 1 1 4 GLY H . 4 GLY HN 1 1
18 1 1 1 1 3 TRP HE3 . 3 TRP HE3 1 1
18 1 2 1 1 4 GLY H . 4 GLY HN 1 1
19 1 1 1 1 4 GLY H . 4 GLY HN 1 1
19 1 2 1 1 4 GLY QA . 4 GLY QA 1 1
20 1 1 1 1 6 SER H . 6 SER HN 1 1
20 1 2 1 1 6 SER HA . 6 SER HA 1 1
21 1 1 1 1 6 SER H . 6 SER HN 1 1
21 1 2 1 1 7 GLY H . 7 GLY HN 1 1
22 1 1 1 1 6 SER HA . 6 SER HA 1 1
22 1 2 1 1 7 GLY H . 7 GLY HN 1 1
23 1 1 1 1 6 SER QB . 6 SER QB 1 1
23 1 2 1 1 7 GLY H . 7 GLY HN 1 1
24 1 1 1 1 7 GLY H . 7 GLY HN 1 1
24 1 2 1 1 7 GLY QA . 7 GLY QA 1 1
25 1 1 1 1 7 GLY H . 7 GLY HN 1 1
25 1 2 1 1 8 LYS H . 8 LYS HN 1 1
26 1 1 1 1 7 GLY QA . 7 GLY QA 1 1
26 1 2 1 1 8 LYS H . 8 LYS HN 1 1
27 1 1 1 1 8 LYS H . 8 LYS HN 1 1
27 1 2 1 1 8 LYS HA . 8 LYS HA 1 1
28 1 1 1 1 8 LYS H . 8 LYS HN 1 1
28 1 2 1 1 8 LYS QD . 8 LYS QD 1 1
29 1 1 1 1 8 LYS H . 8 LYS HN 1 1
29 1 2 1 1 8 LYS QE . 8 LYS QE 1 1
30 1 1 1 1 8 LYS H . 8 LYS HN 1 1
30 1 2 1 1 8 LYS QG . 8 LYS QG 1 1
31 1 1 1 1 8 LYS H . 8 LYS HN 1 1
31 1 2 1 1 9 LEU H . 9 LEU HN 1 1
32 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
32 1 2 1 1 9 LEU H . 9 LEU HN 1 1
33 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
33 1 2 1 1 10 ILE H . 10 ILE HN 1 1
34 1 1 1 1 8 LYS QB . 8 LYS QB 1 1
34 1 2 1 1 9 LEU H . 9 LEU HN 1 1
35 1 1 1 1 9 LEU H . 9 LEU HN 1 1
35 1 2 1 1 9 LEU HA . 9 LEU HA 1 1
36 1 1 1 1 9 LEU H . 9 LEU HN 1 1
36 1 2 1 1 9 LEU QD . 9 LEU QQD 1 1
37 1 1 1 1 9 LEU H . 9 LEU HN 1 1
37 1 2 1 1 9 LEU HG . 9 LEU HG 1 1
38 1 1 1 1 9 LEU H . 9 LEU HN 1 1
38 1 2 1 1 10 ILE H . 10 ILE HN 1 1
39 1 1 1 1 9 LEU QB . 9 LEU QB 1 1
39 1 2 1 1 10 ILE H . 10 ILE HN 1 1
40 1 1 1 1 9 LEU HG . 9 LEU HG 1 1
40 1 2 1 1 10 ILE H . 10 ILE HN 1 1
41 1 1 1 1 10 ILE H . 10 ILE HN 1 1
41 1 2 1 1 10 ILE HA . 10 ILE HA 1 1
42 1 1 1 1 10 ILE H . 10 ILE HN 1 1
42 1 2 1 1 10 ILE HB . 10 ILE HB 1 1
43 1 1 1 1 10 ILE H . 10 ILE HN 1 1
43 1 2 1 1 10 ILE MD . 10 ILE QD1 1 1
44 1 1 1 1 10 ILE H . 10 ILE HN 1 1
44 1 2 1 1 10 ILE QG . 10 ILE QG1 1 1
45 1 1 1 1 10 ILE H . 10 ILE HN 1 1
45 1 2 1 1 11 GLU H . 11 GLU HN 1 1
46 1 1 1 1 10 ILE HA . 10 ILE HA 1 1
46 1 2 1 1 11 GLU H . 11 GLU HN 1 1
47 1 1 1 1 10 ILE MD . 10 ILE QD1 1 1
47 1 2 1 1 11 GLU H . 11 GLU HN 1 1
48 1 1 1 1 10 ILE MD . 10 ILE QD1 1 1
48 1 2 1 1 12 THR H . 12 THR HN 1 1
49 1 1 1 1 10 ILE QG . 10 ILE QG1 1 1
49 1 2 1 1 11 GLU H . 11 GLU HN 1 1
50 1 1 1 1 10 ILE MG . 10 ILE QG2 1 1
50 1 2 1 1 11 GLU H . 11 GLU HN 1 1
51 1 1 1 1 11 GLU H . 11 GLU HN 1 1
51 1 2 1 1 11 GLU HA . 11 GLU HA 1 1
52 1 1 1 1 11 GLU H . 11 GLU HN 1 1
52 1 2 1 1 11 GLU QG . 11 GLU QG 1 1
53 1 1 1 1 11 GLU H . 11 GLU HN 1 1
53 1 2 1 1 12 THR H . 12 THR HN 1 1
54 1 1 1 1 11 GLU HA . 11 GLU HA 1 1
54 1 2 1 1 12 THR H . 12 THR HN 1 1
55 1 1 1 1 11 GLU QB . 11 GLU QB 1 1
55 1 2 1 1 12 THR H . 12 THR HN 1 1
56 1 1 1 1 11 GLU QG . 11 GLU QG 1 1
56 1 2 1 1 12 THR H . 12 THR HN 1 1
57 1 1 1 1 12 THR H . 12 THR HN 1 1
57 1 2 1 1 12 THR HA . 12 THR HA 1 1
58 1 1 1 1 12 THR H . 12 THR HN 1 1
58 1 2 1 1 12 THR HB . 12 THR HB 1 1
59 1 1 1 1 12 THR H . 12 THR HN 1 1
59 1 2 1 1 13 THR H . 13 THR HN 1 1
60 1 1 1 1 12 THR HA . 12 THR HA 1 1
60 1 2 1 1 13 THR H . 13 THR HN 1 1
61 1 1 1 1 13 THR H . 13 THR HN 1 1
61 1 2 1 1 13 THR HA . 13 THR HA 1 1
62 1 1 1 1 13 THR H . 13 THR HN 1 1
62 1 2 1 1 13 THR HB . 13 THR HB 1 1
63 1 1 1 1 13 THR H . 13 THR HN 1 1
63 1 2 1 1 13 THR MG . 13 THR QG2 1 1
64 1 1 1 1 14 ALA H . 14 ALA HN 1 1
64 1 2 1 1 14 ALA HA . 14 ALA HA 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 2.8 3.8 1 1
2 1 . . . . . . 2.8 3.8 1 1
3 1 . . . . . . 4.8 5.5 1 1
4 1 . . . . . . 3.8 5.5 1 1
5 1 . . . . . . 3.8 5.5 1 1
6 1 . . . . . . 3.8 4.8 1 1
7 1 . . . . . . 1.8 2.8 1 1
8 1 . . . . . . 4.8 5.5 1 1
9 1 . . . . . . 3.8 4.8 1 1
10 1 . . . . . . 4.8 5.5 1 1
11 1 . . . . . . 4.8 5.5 1 1
12 1 . . . . . . 2.8 3.8 1 1
13 1 . . . . . . 2.84 4.04 1 1
14 1 . . . . . . 2.8 3.8 1 1
15 1 . . . . . . 2.2 3.2 1 1
16 1 . . . . . . 3.39 4.59 1 1
17 1 . . . . . . 4.8 5.5 1 1
18 1 . . . . . . 4.8 5.5 1 1
19 1 . . . . . . 2.53 3.61 1 1
20 1 . . . . . . 2.8 3.8 1 1
21 1 . . . . . . 3.8 5.5 1 1
22 1 . . . . . . 2.2 3.2 1 1
23 1 . . . . . . 3.8 5.5 1 1
24 1 . . . . . . 2.2 3.2 1 1
25 1 . . . . . . 2.8 3.8 1 1
26 1 . . . . . . 2.8 3.8 1 1
27 1 . . . . . . 2.8 3.8 1 1
28 1 . . . . . . 3.8 5.5 1 1
29 1 . . . . . . 4.8 5.5 1 1
30 1 . . . . . . 4.42 5.5 1 1
31 1 . . . . . . 2.8 3.8 1 1
32 1 . . . . . . 1.8 2.8 1 1
33 1 . . . . . . 3.8 5.5 1 1
34 1 . . . . . . 3.8 5.5 1 1
35 1 . . . . . . 2.8 3.8 1 1
36 1 . . . . . . 3.8 5.5 1 1
37 1 . . . . . . 2.8 3.8 1 1
38 1 . . . . . . 1.8 5.5 1 1
39 1 . . . . . . 3.8 5.5 1 1
40 1 . . . . . . 3.8 5.5 1 1
41 1 . . . . . . 2.8 3.8 1 1
42 1 . . . . . . 2.8 3.8 1 1
43 1 . . . . . . 4.8 5.5 1 1
44 1 . . . . . . 3.8 5.5 1 1
45 1 . . . . . . 2.8 3.8 1 1
46 1 . . . . . . 1.8 2.8 1 1
47 1 . . . . . . 4.8 5.5 1 1
48 1 . . . . . . 4.8 5.5 1 1
49 1 . . . . . . 4.8 5.5 1 1
50 1 . . . . . . 4.8 5.5 1 1
51 1 . . . . . . 2.8 3.8 1 1
52 1 . . . . . . 3.36 4.66 1 1
53 1 . . . . . . 2.8 3.8 1 1
54 1 . . . . . . 2.8 3.8 1 1
55 1 . . . . . . 3.8 5.5 1 1
56 1 . . . . . . 3.8 5.5 1 1
57 1 . . . . . . 2.8 3.8 1 1
58 1 . . . . . . 2.8 3.8 1 1
59 1 . . . . . . 2.8 3.8 1 1
60 1 . . . . . . 2.8 3.8 1 1
61 1 . . . . . . 2.8 3.8 1 1
62 1 . . . . . . 2.8 3.8 1 1
63 1 . . . . . . 3.8 4.8 1 1
64 1 . . . . . . 2.8 3.8 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 ACE C C 2.979 4.725 0.291 1.00 . A A . 1 ACE C 1 1
1 2 1 1 1 ACE CH3 C 2.229 5.889 -0.348 1.00 . A A . 1 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 2.354 6.820 0.238 1.00 . A A . 1 ACE H1 1 1
1 4 1 1 1 ACE H2 H 2.582 6.083 -1.378 1.00 . A A . 1 ACE H2 1 1
1 5 1 1 1 ACE H3 H 1.145 5.681 -0.404 1.00 . A A . 1 ACE H3 1 1
1 6 1 1 1 ACE O O 2.367 3.722 0.664 1.00 . A A . 1 ACE O 1 1
1 7 1 1 2 ILE C C 6.107 4.640 2.004 1.00 . A A . 2 ILE C 1 1
1 8 1 1 2 ILE CA C 5.202 3.851 1.006 1.00 . A A . 2 ILE CA 1 1
1 9 1 1 2 ILE CB C 6.016 3.049 -0.078 1.00 . A A . 2 ILE CB 1 1
1 10 1 1 2 ILE CD1 C 4.248 1.178 -0.692 1.00 . A A . 2 ILE CD1 1 1
1 11 1 1 2 ILE CG1 C 5.158 2.327 -1.159 1.00 . A A . 2 ILE CG1 1 1
1 12 1 1 2 ILE CG2 C 7.034 2.049 0.534 1.00 . A A . 2 ILE CG2 1 1
1 13 1 1 2 ILE H H 4.659 5.775 0.046 1.00 . A A . 2 ILE H 1 1
1 14 1 1 2 ILE HA H 4.613 3.091 1.569 1.00 . A A . 2 ILE HA 1 1
1 15 1 1 2 ILE HB H 6.624 3.791 -0.635 1.00 . A A . 2 ILE HB 1 1
1 16 1 1 2 ILE HD11 H 3.650 0.786 -1.534 1.00 . A A . 2 ILE HD11 1 1
1 17 1 1 2 ILE HD12 H 4.829 0.331 -0.285 1.00 . A A . 2 ILE HD12 1 1
1 18 1 1 2 ILE HD13 H 3.535 1.496 0.089 1.00 . A A . 2 ILE HD13 1 1
1 19 1 1 2 ILE HG12 H 4.531 3.074 -1.678 1.00 . A A . 2 ILE HG12 1 1
1 20 1 1 2 ILE HG13 H 5.828 1.939 -1.948 1.00 . A A . 2 ILE HG13 1 1
1 21 1 1 2 ILE HG21 H 6.539 1.292 1.171 1.00 . A A . 2 ILE HG21 1 1
1 22 1 1 2 ILE HG22 H 7.599 1.506 -0.246 1.00 . A A . 2 ILE HG22 1 1
1 23 1 1 2 ILE HG23 H 7.786 2.557 1.164 1.00 . A A . 2 ILE HG23 1 1
1 24 1 1 2 ILE N N 4.303 4.880 0.400 1.00 . A A . 2 ILE N 1 1
1 25 1 1 2 ILE O O 7.125 5.219 1.605 1.00 . A A . 2 ILE O 1 1
1 26 1 1 3 TRP C C 6.701 4.364 5.540 1.00 . A A . 3 TRP C 1 1
1 27 1 1 3 TRP CA C 6.502 5.361 4.362 1.00 . A A . 3 TRP CA 1 1
1 28 1 1 3 TRP CB C 5.854 6.709 4.799 1.00 . A A . 3 TRP CB 1 1
1 29 1 1 3 TRP CD1 C 6.025 8.271 2.678 1.00 . A A . 3 TRP CD1 1 1
1 30 1 1 3 TRP CD2 C 7.097 9.006 4.482 1.00 . A A . 3 TRP CD2 1 1
1 31 1 1 3 TRP CE2 C 7.249 9.936 3.422 1.00 . A A . 3 TRP CE2 1 1
1 32 1 1 3 TRP CE3 C 7.679 9.266 5.751 1.00 . A A . 3 TRP CE3 1 1
1 33 1 1 3 TRP CG C 6.323 7.950 4.020 1.00 . A A . 3 TRP CG 1 1
1 34 1 1 3 TRP CH2 C 8.526 11.379 4.885 1.00 . A A . 3 TRP CH2 1 1
1 35 1 1 3 TRP CZ2 C 7.968 11.137 3.628 1.00 . A A . 3 TRP CZ2 1 1
1 36 1 1 3 TRP CZ3 C 8.384 10.457 5.929 1.00 . A A . 3 TRP CZ3 1 1
1 37 1 1 3 TRP H H 4.847 4.166 3.479 1.00 . A A . 3 TRP H 1 1
1 38 1 1 3 TRP HA H 7.522 5.608 3.997 1.00 . A A . 3 TRP HA 1 1
1 39 1 1 3 TRP HB2 H 4.751 6.645 4.788 1.00 . A A . 3 TRP HB2 1 1
1 40 1 1 3 TRP HB3 H 6.078 6.888 5.866 1.00 . A A . 3 TRP HB3 1 1
1 41 1 1 3 TRP HD1 H 5.397 7.682 2.033 1.00 . A A . 3 TRP HD1 1 1
1 42 1 1 3 TRP HE1 H 6.511 9.971 1.382 1.00 . A A . 3 TRP HE1 1 1
1 43 1 1 3 TRP HE3 H 7.574 8.569 6.569 1.00 . A A . 3 TRP HE3 1 1
1 44 1 1 3 TRP HH2 H 9.076 12.292 5.054 1.00 . A A . 3 TRP HH2 1 1
1 45 1 1 3 TRP HZ2 H 8.083 11.856 2.830 1.00 . A A . 3 TRP HZ2 1 1
1 46 1 1 3 TRP HZ3 H 8.826 10.671 6.891 1.00 . A A . 3 TRP HZ3 1 1
1 47 1 1 3 TRP N N 5.722 4.670 3.292 1.00 . A A . 3 TRP N 1 1
1 48 1 1 3 TRP NE1 N 6.602 9.490 2.284 1.00 . A A . 3 TRP NE1 1 1
1 49 1 1 3 TRP O O 5.970 4.388 6.536 1.00 . A A . 3 TRP O 1 1
1 50 1 1 4 GLY C C 6.972 1.559 7.021 1.00 . A A . 4 GLY C 1 1
1 51 1 1 4 GLY CA C 8.072 2.448 6.396 1.00 . A A . 4 GLY CA 1 1
1 52 1 1 4 GLY H H 8.185 3.568 4.480 1.00 . A A . 4 GLY H 1 1
1 53 1 1 4 GLY HA2 H 8.831 1.778 5.952 1.00 . A A . 4 GLY HA2 1 1
1 54 1 1 4 GLY HA3 H 8.614 2.955 7.217 1.00 . A A . 4 GLY HA3 1 1
1 55 1 1 4 GLY N N 7.703 3.475 5.382 1.00 . A A . 4 GLY N 1 1
1 56 1 1 4 GLY O O 6.887 1.500 8.251 1.00 . A A . 4 GLY O 1 1
1 57 1 1 5 . C C 3.831 0.772 7.255 1.00 . A A . 5 SET C 1 1
1 58 1 1 5 . CA C 5.065 -0.007 6.713 1.00 . A A . 5 SET CA 1 1
1 59 1 1 5 . CB C 4.699 -1.109 5.672 1.00 . A A . 5 SET CB 1 1
1 60 1 1 5 . H H 6.303 1.037 5.198 1.00 . A A . 5 SET H 1 1
1 61 1 1 5 . HA H 5.471 -0.506 7.616 1.00 . A A . 5 SET HA 1 1
1 62 1 1 5 . HB2 H 3.118 0.047 7.690 1.00 . A A . 5 SET HB2 1 1
1 63 1 1 5 . HB3 H 4.172 1.372 8.122 1.00 . A A . 5 SET HB3 1 1
1 64 1 1 5 . HNT2 H 3.073 1.477 5.295 1.00 . A A . 5 SET HNT2 1 1
1 65 1 1 5 . N N 6.153 0.873 6.200 1.00 . A A . 5 SET N 1 1
1 66 1 1 5 . NT N 3.088 1.642 6.307 1.00 . A A . 5 SET NT 1 1
1 67 1 1 5 . OG O 4.216 -0.811 4.575 1.00 . A A . 5 SET OG 1 1
1 68 1 1 6 SER C C 3.196 -4.096 5.454 1.00 . A A . 6 SER C 1 1
1 69 1 1 6 SER CA C 4.638 -3.566 5.185 1.00 . A A . 6 SER CA 1 1
1 70 1 1 6 SER CB C 5.717 -4.637 5.470 1.00 . A A . 6 SER CB 1 1
1 71 1 1 6 SER H H 5.275 -2.508 6.998 1.00 . A A . 6 SER H 1 1
1 72 1 1 6 SER HA H 4.735 -3.274 4.119 1.00 . A A . 6 SER HA 1 1
1 73 1 1 6 SER HB2 H 6.735 -4.209 5.377 1.00 . A A . 6 SER HB2 1 1
1 74 1 1 6 SER HB3 H 5.640 -5.015 6.508 1.00 . A A . 6 SER HB3 1 1
1 75 1 1 6 SER HG H 5.854 -5.393 3.698 1.00 . A A . 6 SER HG 1 1
1 76 1 1 6 SER N N 4.936 -2.386 6.041 1.00 . A A . 6 SER N 1 1
1 77 1 1 6 SER O O 2.675 -4.004 6.573 1.00 . A A . 6 SER O 1 1
1 78 1 1 6 SER OG O 5.608 -5.730 4.563 1.00 . A A . 6 SER OG 1 1
1 79 1 1 7 GLY C C 0.151 -4.176 3.960 1.00 . A A . 7 GLY C 1 1
1 80 1 1 7 GLY CA C 1.170 -5.190 4.520 1.00 . A A . 7 GLY CA 1 1
1 81 1 1 7 GLY H H 3.098 -4.710 3.544 1.00 . A A . 7 GLY H 1 1
1 82 1 1 7 GLY HA2 H 1.102 -6.129 3.940 1.00 . A A . 7 GLY HA2 1 1
1 83 1 1 7 GLY HA3 H 0.902 -5.476 5.556 1.00 . A A . 7 GLY HA3 1 1
1 84 1 1 7 GLY N N 2.560 -4.670 4.417 1.00 . A A . 7 GLY N 1 1
1 85 1 1 7 GLY O O -0.471 -4.427 2.925 1.00 . A A . 7 GLY O 1 1
1 86 1 1 8 LYS C C -0.046 -0.918 3.444 1.00 . A A . 8 LYS C 1 1
1 87 1 1 8 LYS CA C -0.909 -1.937 4.248 1.00 . A A . 8 LYS CA 1 1
1 88 1 1 8 LYS CB C -1.569 -1.353 5.530 1.00 . A A . 8 LYS CB 1 1
1 89 1 1 8 LYS CD C -3.909 -0.656 4.549 1.00 . A A . 8 LYS CD 1 1
1 90 1 1 8 LYS CE C -4.810 -1.668 5.285 1.00 . A A . 8 LYS CE 1 1
1 91 1 1 8 LYS CG C -2.633 -0.248 5.317 1.00 . A A . 8 LYS CG 1 1
1 92 1 1 8 LYS H H 0.641 -2.922 5.443 1.00 . A A . 8 LYS H 1 1
1 93 1 1 8 LYS HA H -1.722 -2.334 3.607 1.00 . A A . 8 LYS HA 1 1
1 94 1 1 8 LYS HB2 H -2.028 -2.169 6.120 1.00 . A A . 8 LYS HB2 1 1
1 95 1 1 8 LYS HB3 H -0.783 -0.945 6.194 1.00 . A A . 8 LYS HB3 1 1
1 96 1 1 8 LYS HD2 H -4.485 0.267 4.348 1.00 . A A . 8 LYS HD2 1 1
1 97 1 1 8 LYS HD3 H -3.629 -1.043 3.551 1.00 . A A . 8 LYS HD3 1 1
1 98 1 1 8 LYS HE2 H -4.263 -2.614 5.465 1.00 . A A . 8 LYS HE2 1 1
1 99 1 1 8 LYS HE3 H -5.086 -1.279 6.285 1.00 . A A . 8 LYS HE3 1 1
1 100 1 1 8 LYS HG2 H -2.920 0.165 6.302 1.00 . A A . 8 LYS HG2 1 1
1 101 1 1 8 LYS HG3 H -2.159 0.604 4.792 1.00 . A A . 8 LYS HG3 1 1
1 102 1 1 8 LYS HZ1 H -5.816 -2.341 3.583 1.00 . A A . 8 LYS HZ1 1 1
1 103 1 1 8 LYS HZ2 H -6.647 -2.622 4.981 1.00 . A A . 8 LYS HZ2 1 1
1 104 1 1 8 LYS HZ3 H -6.587 -1.100 4.345 1.00 . A A . 8 LYS HZ3 1 1
1 105 1 1 8 LYS N N -0.008 -3.037 4.660 1.00 . A A . 8 LYS N 1 1
1 106 1 1 8 LYS NZ N -6.033 -1.950 4.507 1.00 . A A . 8 LYS NZ 1 1
1 107 1 1 8 LYS O O 0.562 -0.004 4.015 1.00 . A A . 8 LYS O 1 1
1 108 1 1 9 LEU C C 0.008 1.072 0.772 1.00 . A A . 9 LEU C 1 1
1 109 1 1 9 LEU CA C 0.785 -0.227 1.188 1.00 . A A . 9 LEU CA 1 1
1 110 1 1 9 LEU CB C 1.266 -1.079 -0.031 1.00 . A A . 9 LEU CB 1 1
1 111 1 1 9 LEU CD1 C 2.223 -3.251 1.050 1.00 . A A . 9 LEU CD1 1 1
1 112 1 1 9 LEU CD2 C 3.063 -2.478 -1.182 1.00 . A A . 9 LEU CD2 1 1
1 113 1 1 9 LEU CG C 2.494 -2.014 0.176 1.00 . A A . 9 LEU CG 1 1
1 114 1 1 9 LEU H H -0.365 -2.010 1.814 1.00 . A A . 9 LEU H 1 1
1 115 1 1 9 LEU HA H 1.704 0.117 1.704 1.00 . A A . 9 LEU HA 1 1
1 116 1 1 9 LEU HB2 H 0.421 -1.644 -0.469 1.00 . A A . 9 LEU HB2 1 1
1 117 1 1 9 LEU HB3 H 1.549 -0.369 -0.833 1.00 . A A . 9 LEU HB3 1 1
1 118 1 1 9 LEU HD11 H 3.103 -3.917 1.112 1.00 . A A . 9 LEU HD11 1 1
1 119 1 1 9 LEU HD12 H 1.986 -2.962 2.088 1.00 . A A . 9 LEU HD12 1 1
1 120 1 1 9 LEU HD13 H 1.378 -3.856 0.670 1.00 . A A . 9 LEU HD13 1 1
1 121 1 1 9 LEU HD21 H 3.979 -3.087 -1.058 1.00 . A A . 9 LEU HD21 1 1
1 122 1 1 9 LEU HD22 H 2.337 -3.090 -1.750 1.00 . A A . 9 LEU HD22 1 1
1 123 1 1 9 LEU HD23 H 3.343 -1.625 -1.826 1.00 . A A . 9 LEU HD23 1 1
1 124 1 1 9 LEU HG H 3.279 -1.425 0.682 1.00 . A A . 9 LEU HG 1 1
1 125 1 1 9 LEU N N -0.005 -1.098 2.109 1.00 . A A . 9 LEU N 1 1
1 126 1 1 9 LEU O O -0.312 1.300 -0.399 1.00 . A A . 9 LEU O 1 1
1 127 1 1 10 ILE C C -0.616 3.999 2.920 1.00 . A A . 10 ILE C 1 1
1 128 1 1 10 ILE CA C -0.985 3.226 1.612 1.00 . A A . 10 ILE CA 1 1
1 129 1 1 10 ILE CB C -2.508 3.058 1.246 1.00 . A A . 10 ILE CB 1 1
1 130 1 1 10 ILE CD1 C -3.628 5.373 1.877 1.00 . A A . 10 ILE CD1 1 1
1 131 1 1 10 ILE CG1 C -3.220 4.364 0.793 1.00 . A A . 10 ILE CG1 1 1
1 132 1 1 10 ILE CG2 C -3.366 2.225 2.233 1.00 . A A . 10 ILE CG2 1 1
1 133 1 1 10 ILE H H 0.011 1.597 2.699 1.00 . A A . 10 ILE H 1 1
1 134 1 1 10 ILE HA H -0.517 3.762 0.760 1.00 . A A . 10 ILE HA 1 1
1 135 1 1 10 ILE HB H -2.506 2.449 0.322 1.00 . A A . 10 ILE HB 1 1
1 136 1 1 10 ILE HD11 H -4.295 4.916 2.632 1.00 . A A . 10 ILE HD11 1 1
1 137 1 1 10 ILE HD12 H -2.754 5.788 2.407 1.00 . A A . 10 ILE HD12 1 1
1 138 1 1 10 ILE HD13 H -4.178 6.223 1.434 1.00 . A A . 10 ILE HD13 1 1
1 139 1 1 10 ILE HG12 H -2.594 4.881 0.043 1.00 . A A . 10 ILE HG12 1 1
1 140 1 1 10 ILE HG13 H -4.136 4.085 0.236 1.00 . A A . 10 ILE HG13 1 1
1 141 1 1 10 ILE HG21 H -2.929 1.225 2.402 1.00 . A A . 10 ILE HG21 1 1
1 142 1 1 10 ILE HG22 H -3.465 2.710 3.221 1.00 . A A . 10 ILE HG22 1 1
1 143 1 1 10 ILE HG23 H -4.390 2.062 1.846 1.00 . A A . 10 ILE HG23 1 1
1 144 1 1 10 ILE N N -0.272 1.927 1.770 1.00 . A A . 10 ILE N 1 1
1 145 1 1 10 ILE O O -1.370 4.004 3.898 1.00 . A A . 10 ILE O 1 1
1 146 1 1 11 GLU C C 1.803 6.664 3.544 1.00 . A A . 11 GLU C 1 1
1 147 1 1 11 GLU CA C 1.123 5.364 4.098 1.00 . A A . 11 GLU CA 1 1
1 148 1 1 11 GLU CB C 2.110 4.475 4.912 1.00 . A A . 11 GLU CB 1 1
1 149 1 1 11 GLU CD C 2.288 2.626 6.745 1.00 . A A . 11 GLU CD 1 1
1 150 1 1 11 GLU CG C 1.409 3.349 5.716 1.00 . A A . 11 GLU CG 1 1
1 151 1 1 11 GLU H H 1.117 4.537 2.059 1.00 . A A . 11 GLU H 1 1
1 152 1 1 11 GLU HA H 0.326 5.573 4.834 1.00 . A A . 11 GLU HA 1 1
1 153 1 1 11 GLU HB2 H 2.888 4.044 4.251 1.00 . A A . 11 GLU HB2 1 1
1 154 1 1 11 GLU HB3 H 2.662 5.119 5.623 1.00 . A A . 11 GLU HB3 1 1
1 155 1 1 11 GLU HG2 H 0.548 3.786 6.265 1.00 . A A . 11 GLU HG2 1 1
1 156 1 1 11 GLU HG3 H 0.942 2.618 5.030 1.00 . A A . 11 GLU HG3 1 1
1 157 1 1 11 GLU N N 0.583 4.619 2.933 1.00 . A A . 11 GLU N 1 1
1 158 1 1 11 GLU O O 2.946 6.590 3.082 1.00 . A A . 11 GLU O 1 1
1 159 1 1 11 GLU OE1 O 2.200 2.943 7.934 1.00 . A A . 11 GLU OE1 1 1
1 160 1 1 12 THR C C 2.807 9.752 4.007 1.00 . A A . 12 THR C 1 1
1 161 1 1 12 THR CA C 1.746 9.126 3.036 1.00 . A A . 12 THR CA 1 1
1 162 1 1 12 THR CB C 0.667 10.173 2.598 1.00 . A A . 12 THR CB 1 1
1 163 1 1 12 THR CG2 C 1.212 11.399 1.825 1.00 . A A . 12 THR CG2 1 1
1 164 1 1 12 THR H H 0.140 7.816 3.798 1.00 . A A . 12 THR H 1 1
1 165 1 1 12 THR HA H 2.297 8.870 2.109 1.00 . A A . 12 THR HA 1 1
1 166 1 1 12 THR HB H 0.139 10.553 3.495 1.00 . A A . 12 THR HB 1 1
1 167 1 1 12 THR HG1 H -0.890 10.261 1.468 1.00 . A A . 12 THR HG1 1 1
1 168 1 1 12 THR HG21 H 0.404 12.089 1.517 1.00 . A A . 12 THR HG21 1 1
1 169 1 1 12 THR HG22 H 1.915 12.003 2.430 1.00 . A A . 12 THR HG22 1 1
1 170 1 1 12 THR HG23 H 1.751 11.110 0.902 1.00 . A A . 12 THR HG23 1 1
1 171 1 1 12 THR N N 1.133 7.845 3.546 1.00 . A A . 12 THR N 1 1
1 172 1 1 12 THR O O 3.800 10.299 3.524 1.00 . A A . 12 THR O 1 1
1 173 1 1 12 THR OG1 O -0.295 9.560 1.744 1.00 . A A . 12 THR OG1 1 1
1 174 1 1 13 THR C C 3.850 9.129 7.376 1.00 . A A . 13 THR C 1 1
1 175 1 1 13 THR CA C 3.534 10.265 6.351 1.00 . A A . 13 THR CA 1 1
1 176 1 1 13 THR CB C 3.004 11.600 6.962 1.00 . A A . 13 THR CB 1 1
1 177 1 1 13 THR CG2 C 3.965 12.252 7.969 1.00 . A A . 13 THR CG2 1 1
1 178 1 1 13 THR H H 1.716 9.252 5.611 1.00 . A A . 13 THR H 1 1
1 179 1 1 13 THR HA H 4.501 10.508 5.864 1.00 . A A . 13 THR HA 1 1
1 180 1 1 13 THR HB H 2.039 11.413 7.472 1.00 . A A . 13 THR HB 1 1
1 181 1 1 13 THR HG1 H 2.523 13.368 6.370 1.00 . A A . 13 THR HG1 1 1
1 182 1 1 13 THR HG21 H 4.947 12.475 7.511 1.00 . A A . 13 THR HG21 1 1
1 183 1 1 13 THR HG22 H 3.558 13.203 8.357 1.00 . A A . 13 THR HG22 1 1
1 184 1 1 13 THR HG23 H 4.149 11.599 8.843 1.00 . A A . 13 THR HG23 1 1
1 185 1 1 13 THR N N 2.587 9.719 5.337 1.00 . A A . 13 THR N 1 1
1 186 1 1 13 THR O O 4.995 8.676 7.432 1.00 . A A . 13 THR O 1 1
1 187 1 1 13 THR OG1 O 2.784 12.556 5.929 1.00 . A A . 13 THR OG1 1 1
1 188 1 1 14 ALA C C 2.673 6.230 8.556 1.00 . A A . 14 ALA C 1 1
1 189 1 1 14 ALA CA C 3.059 7.593 9.174 1.00 . A A . 14 ALA CA 1 1
1 190 1 1 14 ALA CB C 2.214 7.905 10.422 1.00 . A A . 14 ALA CB 1 1
1 191 1 1 14 ALA H H 1.954 9.133 8.049 1.00 . A A . 14 ALA H 1 1
1 192 1 1 14 ALA HXT H 3.461 4.502 8.175 1.00 . A A . 14 ALA HXT 1 1
1 193 1 1 14 ALA HA H 4.116 7.556 9.502 1.00 . A A . 14 ALA HA 1 1
1 194 1 1 14 ALA HB1 H 2.505 8.869 10.883 1.00 . A A . 14 ALA HB1 1 1
1 195 1 1 14 ALA HB2 H 1.131 7.961 10.198 1.00 . A A . 14 ALA HB2 1 1
1 196 1 1 14 ALA HB3 H 2.345 7.131 11.201 1.00 . A A . 14 ALA HB3 1 1
1 197 1 1 14 ALA N N 2.863 8.677 8.181 1.00 . A A . 14 ALA N 1 1
1 198 1 1 14 ALA O O 1.551 5.962 8.122 1.00 . A A . 14 ALA O 1 1
1 199 1 1 14 ALA OXT O 3.724 5.351 8.543 1.00 . A A . 14 ALA OXT 1 1
2 200 1 1 1 ACE C C 9.812 7.224 -1.250 1.00 . A A . 1 ACE C 1 1
2 201 1 1 1 ACE CH3 C 9.507 8.157 -2.417 1.00 . A A . 1 ACE CH3 1 1
2 202 1 1 1 ACE H1 H 8.424 8.360 -2.501 1.00 . A A . 1 ACE H1 1 1
2 203 1 1 1 ACE H2 H 10.030 9.126 -2.312 1.00 . A A . 1 ACE H2 1 1
2 204 1 1 1 ACE H3 H 9.832 7.713 -3.376 1.00 . A A . 1 ACE H3 1 1
2 205 1 1 1 ACE O O 10.339 6.127 -1.447 1.00 . A A . 1 ACE O 1 1
2 206 1 1 2 ILE C C 8.262 6.569 1.755 1.00 . A A . 2 ILE C 1 1
2 207 1 1 2 ILE CA C 9.688 6.913 1.219 1.00 . A A . 2 ILE CA 1 1
2 208 1 1 2 ILE CB C 10.618 7.678 2.234 1.00 . A A . 2 ILE CB 1 1
2 209 1 1 2 ILE CD1 C 12.939 6.855 1.249 1.00 . A A . 2 ILE CD1 1 1
2 210 1 1 2 ILE CG1 C 12.041 8.026 1.692 1.00 . A A . 2 ILE CG1 1 1
2 211 1 1 2 ILE CG2 C 10.759 6.959 3.602 1.00 . A A . 2 ILE CG2 1 1
2 212 1 1 2 ILE H H 8.944 8.571 -0.066 1.00 . A A . 2 ILE H 1 1
2 213 1 1 2 ILE HA H 10.228 5.959 1.025 1.00 . A A . 2 ILE HA 1 1
2 214 1 1 2 ILE HB H 10.133 8.647 2.456 1.00 . A A . 2 ILE HB 1 1
2 215 1 1 2 ILE HD11 H 12.492 6.284 0.413 1.00 . A A . 2 ILE HD11 1 1
2 216 1 1 2 ILE HD12 H 13.921 7.221 0.899 1.00 . A A . 2 ILE HD12 1 1
2 217 1 1 2 ILE HD13 H 13.133 6.146 2.073 1.00 . A A . 2 ILE HD13 1 1
2 218 1 1 2 ILE HG12 H 11.940 8.719 0.838 1.00 . A A . 2 ILE HG12 1 1
2 219 1 1 2 ILE HG13 H 12.587 8.610 2.455 1.00 . A A . 2 ILE HG13 1 1
2 220 1 1 2 ILE HG21 H 9.785 6.852 4.115 1.00 . A A . 2 ILE HG21 1 1
2 221 1 1 2 ILE HG22 H 11.184 5.943 3.499 1.00 . A A . 2 ILE HG22 1 1
2 222 1 1 2 ILE HG23 H 11.410 7.520 4.299 1.00 . A A . 2 ILE HG23 1 1
2 223 1 1 2 ILE N N 9.474 7.691 -0.041 1.00 . A A . 2 ILE N 1 1
2 224 1 1 2 ILE O O 7.687 7.318 2.551 1.00 . A A . 2 ILE O 1 1
2 225 1 1 3 TRP C C 6.193 3.424 1.631 1.00 . A A . 3 TRP C 1 1
2 226 1 1 3 TRP CA C 6.338 4.975 1.731 1.00 . A A . 3 TRP CA 1 1
2 227 1 1 3 TRP CB C 5.147 5.793 1.154 1.00 . A A . 3 TRP CB 1 1
2 228 1 1 3 TRP CD1 C 5.450 6.321 -1.387 1.00 . A A . 3 TRP CD1 1 1
2 229 1 1 3 TRP CD2 C 3.715 5.025 -0.904 1.00 . A A . 3 TRP CD2 1 1
2 230 1 1 3 TRP CE2 C 3.733 5.296 -2.296 1.00 . A A . 3 TRP CE2 1 1
2 231 1 1 3 TRP CE3 C 2.663 4.263 -0.333 1.00 . A A . 3 TRP CE3 1 1
2 232 1 1 3 TRP CG C 4.796 5.667 -0.331 1.00 . A A . 3 TRP CG 1 1
2 233 1 1 3 TRP CH2 C 1.662 4.072 -2.545 1.00 . A A . 3 TRP CH2 1 1
2 234 1 1 3 TRP CZ2 C 2.691 4.816 -3.125 1.00 . A A . 3 TRP CZ2 1 1
2 235 1 1 3 TRP CZ3 C 1.649 3.802 -1.172 1.00 . A A . 3 TRP CZ3 1 1
2 236 1 1 3 TRP H H 8.272 4.916 0.626 1.00 . A A . 3 TRP H 1 1
2 237 1 1 3 TRP HA H 6.279 5.183 2.820 1.00 . A A . 3 TRP HA 1 1
2 238 1 1 3 TRP HB2 H 4.250 5.524 1.740 1.00 . A A . 3 TRP HB2 1 1
2 239 1 1 3 TRP HB3 H 5.298 6.864 1.387 1.00 . A A . 3 TRP HB3 1 1
2 240 1 1 3 TRP HD1 H 6.309 6.952 -1.250 1.00 . A A . 3 TRP HD1 1 1
2 241 1 1 3 TRP HE1 H 5.065 6.475 -3.542 1.00 . A A . 3 TRP HE1 1 1
2 242 1 1 3 TRP HE3 H 2.651 4.043 0.726 1.00 . A A . 3 TRP HE3 1 1
2 243 1 1 3 TRP HH2 H 0.858 3.706 -3.166 1.00 . A A . 3 TRP HH2 1 1
2 244 1 1 3 TRP HZ2 H 2.683 5.030 -4.184 1.00 . A A . 3 TRP HZ2 1 1
2 245 1 1 3 TRP HZ3 H 0.831 3.238 -0.756 1.00 . A A . 3 TRP HZ3 1 1
2 246 1 1 3 TRP N N 7.685 5.445 1.281 1.00 . A A . 3 TRP N 1 1
2 247 1 1 3 TRP NE1 N 4.814 6.098 -2.621 1.00 . A A . 3 TRP NE1 1 1
2 248 1 1 3 TRP O O 5.375 2.879 0.884 1.00 . A A . 3 TRP O 1 1
2 249 1 1 4 GLY C C 6.454 0.755 3.868 1.00 . A A . 4 GLY C 1 1
2 250 1 1 4 GLY CA C 7.011 1.249 2.521 1.00 . A A . 4 GLY CA 1 1
2 251 1 1 4 GLY H H 7.712 3.329 2.867 1.00 . A A . 4 GLY H 1 1
2 252 1 1 4 GLY HA2 H 6.471 0.775 1.677 1.00 . A A . 4 GLY HA2 1 1
2 253 1 1 4 GLY HA3 H 8.056 0.903 2.416 1.00 . A A . 4 GLY HA3 1 1
2 254 1 1 4 GLY N N 7.002 2.728 2.442 1.00 . A A . 4 GLY N 1 1
2 255 1 1 4 GLY O O 7.224 0.380 4.755 1.00 . A A . 4 GLY O 1 1
2 256 1 1 5 . C C 3.057 1.101 5.443 1.00 . A A . 5 SET C 1 1
2 257 1 1 5 . CA C 4.408 0.310 5.234 1.00 . A A . 5 SET CA 1 1
2 258 1 1 5 . CB C 4.154 -1.229 5.162 1.00 . A A . 5 SET CB 1 1
2 259 1 1 5 . H H 4.610 1.157 3.204 1.00 . A A . 5 SET H 1 1
2 260 1 1 5 . HA H 5.107 0.477 6.086 1.00 . A A . 5 SET HA 1 1
2 261 1 1 5 . HB2 H 2.338 0.830 4.651 1.00 . A A . 5 SET HB2 1 1
2 262 1 1 5 . HB3 H 2.575 0.712 6.359 1.00 . A A . 5 SET HB3 1 1
2 263 1 1 5 . HNT2 H 2.904 3.094 6.468 1.00 . A A . 5 SET HNT2 1 1
2 264 1 1 5 . N N 5.115 0.741 3.996 1.00 . A A . 5 SET N 1 1
2 265 1 1 5 . NT N 3.061 2.594 5.577 1.00 . A A . 5 SET NT 1 1
2 266 1 1 5 . OG O 3.698 -1.752 4.139 1.00 . A A . 5 SET OG 1 1
2 267 1 1 6 SER C C 2.848 -3.966 6.117 1.00 . A A . 6 SER C 1 1
2 268 1 1 6 SER CA C 4.290 -3.422 6.363 1.00 . A A . 6 SER CA 1 1
2 269 1 1 6 SER CB C 4.831 -3.863 7.743 1.00 . A A . 6 SER CB 1 1
2 270 1 1 6 SER H H 4.736 -1.386 7.082 1.00 . A A . 6 SER H 1 1
2 271 1 1 6 SER HA H 4.990 -3.846 5.616 1.00 . A A . 6 SER HA 1 1
2 272 1 1 6 SER HB2 H 5.844 -3.452 7.920 1.00 . A A . 6 SER HB2 1 1
2 273 1 1 6 SER HB3 H 4.199 -3.475 8.566 1.00 . A A . 6 SER HB3 1 1
2 274 1 1 6 SER HG H 4.004 -5.607 7.788 1.00 . A A . 6 SER HG 1 1
2 275 1 1 6 SER N N 4.429 -1.941 6.275 1.00 . A A . 6 SER N 1 1
2 276 1 1 6 SER O O 1.909 -3.607 6.835 1.00 . A A . 6 SER O 1 1
2 277 1 1 6 SER OG O 4.907 -5.283 7.835 1.00 . A A . 6 SER OG 1 1
2 278 1 1 7 GLY C C 0.617 -4.599 3.691 1.00 . A A . 7 GLY C 1 1
2 279 1 1 7 GLY CA C 1.390 -5.427 4.733 1.00 . A A . 7 GLY CA 1 1
2 280 1 1 7 GLY H H 3.534 -4.999 4.527 1.00 . A A . 7 GLY H 1 1
2 281 1 1 7 GLY HA2 H 1.575 -6.435 4.315 1.00 . A A . 7 GLY HA2 1 1
2 282 1 1 7 GLY HA3 H 0.768 -5.614 5.632 1.00 . A A . 7 GLY HA3 1 1
2 283 1 1 7 GLY N N 2.697 -4.830 5.092 1.00 . A A . 7 GLY N 1 1
2 284 1 1 7 GLY O O 0.628 -4.917 2.500 1.00 . A A . 7 GLY O 1 1
2 285 1 1 8 LYS C C -0.067 -1.291 3.229 1.00 . A A . 8 LYS C 1 1
2 286 1 1 8 LYS CA C -0.856 -2.623 3.347 1.00 . A A . 8 LYS CA 1 1
2 287 1 1 8 LYS CB C -2.249 -2.473 4.019 1.00 . A A . 8 LYS CB 1 1
2 288 1 1 8 LYS CD C -3.733 -1.987 1.911 1.00 . A A . 8 LYS CD 1 1
2 289 1 1 8 LYS CE C -2.941 -1.332 0.762 1.00 . A A . 8 LYS CE 1 1
2 290 1 1 8 LYS CG C -3.281 -1.557 3.323 1.00 . A A . 8 LYS CG 1 1
2 291 1 1 8 LYS H H 0.162 -3.297 5.138 1.00 . A A . 8 LYS H 1 1
2 292 1 1 8 LYS HA H -1.029 -3.066 2.345 1.00 . A A . 8 LYS HA 1 1
2 293 1 1 8 LYS HB2 H -2.708 -3.474 4.137 1.00 . A A . 8 LYS HB2 1 1
2 294 1 1 8 LYS HB3 H -2.121 -2.104 5.056 1.00 . A A . 8 LYS HB3 1 1
2 295 1 1 8 LYS HD2 H -3.701 -3.092 1.829 1.00 . A A . 8 LYS HD2 1 1
2 296 1 1 8 LYS HD3 H -4.801 -1.720 1.810 1.00 . A A . 8 LYS HD3 1 1
2 297 1 1 8 LYS HE2 H -2.925 -0.231 0.884 1.00 . A A . 8 LYS HE2 1 1
2 298 1 1 8 LYS HE3 H -1.882 -1.648 0.787 1.00 . A A . 8 LYS HE3 1 1
2 299 1 1 8 LYS HG2 H -4.177 -1.530 3.972 1.00 . A A . 8 LYS HG2 1 1
2 300 1 1 8 LYS HG3 H -2.923 -0.511 3.318 1.00 . A A . 8 LYS HG3 1 1
2 301 1 1 8 LYS HZ1 H -3.514 -2.691 -0.718 1.00 . A A . 8 LYS HZ1 1 1
2 302 1 1 8 LYS HZ2 H -4.492 -1.366 -0.637 1.00 . A A . 8 LYS HZ2 1 1
2 303 1 1 8 LYS HZ3 H -2.998 -1.247 -1.327 1.00 . A A . 8 LYS HZ3 1 1
2 304 1 1 8 LYS N N -0.059 -3.546 4.175 1.00 . A A . 8 LYS N 1 1
2 305 1 1 8 LYS NZ N -3.517 -1.678 -0.553 1.00 . A A . 8 LYS NZ 1 1
2 306 1 1 8 LYS O O -0.027 -0.481 4.160 1.00 . A A . 8 LYS O 1 1
2 307 1 1 9 LEU C C 0.349 1.315 1.479 1.00 . A A . 9 LEU C 1 1
2 308 1 1 9 LEU CA C 1.335 0.135 1.738 1.00 . A A . 9 LEU CA 1 1
2 309 1 1 9 LEU CB C 2.289 -0.076 0.522 1.00 . A A . 9 LEU CB 1 1
2 310 1 1 9 LEU CD1 C 3.357 -2.420 0.864 1.00 . A A . 9 LEU CD1 1 1
2 311 1 1 9 LEU CD2 C 4.612 -0.624 -0.366 1.00 . A A . 9 LEU CD2 1 1
2 312 1 1 9 LEU CG C 3.588 -0.899 0.754 1.00 . A A . 9 LEU CG 1 1
2 313 1 1 9 LEU H H 0.581 -1.939 1.480 1.00 . A A . 9 LEU H 1 1
2 314 1 1 9 LEU HA H 1.987 0.379 2.597 1.00 . A A . 9 LEU HA 1 1
2 315 1 1 9 LEU HB2 H 1.728 -0.482 -0.342 1.00 . A A . 9 LEU HB2 1 1
2 316 1 1 9 LEU HB3 H 2.603 0.934 0.187 1.00 . A A . 9 LEU HB3 1 1
2 317 1 1 9 LEU HD11 H 2.862 -2.832 -0.035 1.00 . A A . 9 LEU HD11 1 1
2 318 1 1 9 LEU HD12 H 4.307 -2.969 0.996 1.00 . A A . 9 LEU HD12 1 1
2 319 1 1 9 LEU HD13 H 2.731 -2.683 1.736 1.00 . A A . 9 LEU HD13 1 1
2 320 1 1 9 LEU HD21 H 4.240 -0.937 -1.360 1.00 . A A . 9 LEU HD21 1 1
2 321 1 1 9 LEU HD22 H 4.863 0.452 -0.436 1.00 . A A . 9 LEU HD22 1 1
2 322 1 1 9 LEU HD23 H 5.566 -1.156 -0.190 1.00 . A A . 9 LEU HD23 1 1
2 323 1 1 9 LEU HG H 4.050 -0.558 1.698 1.00 . A A . 9 LEU HG 1 1
2 324 1 1 9 LEU N N 0.549 -1.089 2.052 1.00 . A A . 9 LEU N 1 1
2 325 1 1 9 LEU O O -0.301 1.368 0.429 1.00 . A A . 9 LEU O 1 1
2 326 1 1 10 ILE C C -0.200 4.517 3.359 1.00 . A A . 10 ILE C 1 1
2 327 1 1 10 ILE CA C -0.690 3.404 2.375 1.00 . A A . 10 ILE CA 1 1
2 328 1 1 10 ILE CB C -2.216 3.005 2.479 1.00 . A A . 10 ILE CB 1 1
2 329 1 1 10 ILE CD1 C -3.080 4.671 0.677 1.00 . A A . 10 ILE CD1 1 1
2 330 1 1 10 ILE CG1 C -3.200 4.153 2.117 1.00 . A A . 10 ILE CG1 1 1
2 331 1 1 10 ILE CG2 C -2.640 2.363 3.824 1.00 . A A . 10 ILE CG2 1 1
2 332 1 1 10 ILE H H 0.767 2.044 3.305 1.00 . A A . 10 ILE H 1 1
2 333 1 1 10 ILE HA H -0.550 3.820 1.357 1.00 . A A . 10 ILE HA 1 1
2 334 1 1 10 ILE HB H -2.392 2.218 1.721 1.00 . A A . 10 ILE HB 1 1
2 335 1 1 10 ILE HD11 H -2.115 5.183 0.503 1.00 . A A . 10 ILE HD11 1 1
2 336 1 1 10 ILE HD12 H -3.159 3.849 -0.060 1.00 . A A . 10 ILE HD12 1 1
2 337 1 1 10 ILE HD13 H -3.877 5.400 0.449 1.00 . A A . 10 ILE HD13 1 1
2 338 1 1 10 ILE HG12 H -4.242 3.804 2.257 1.00 . A A . 10 ILE HG12 1 1
2 339 1 1 10 ILE HG13 H -3.083 4.997 2.822 1.00 . A A . 10 ILE HG13 1 1
2 340 1 1 10 ILE HG21 H -2.644 3.086 4.659 1.00 . A A . 10 ILE HG21 1 1
2 341 1 1 10 ILE HG22 H -3.659 1.936 3.768 1.00 . A A . 10 ILE HG22 1 1
2 342 1 1 10 ILE HG23 H -1.968 1.537 4.116 1.00 . A A . 10 ILE HG23 1 1
2 343 1 1 10 ILE N N 0.213 2.222 2.466 1.00 . A A . 10 ILE N 1 1
2 344 1 1 10 ILE O O -0.799 4.757 4.412 1.00 . A A . 10 ILE O 1 1
2 345 1 1 11 GLU C C 2.292 7.296 2.915 1.00 . A A . 11 GLU C 1 1
2 346 1 1 11 GLU CA C 1.488 6.304 3.830 1.00 . A A . 11 GLU CA 1 1
2 347 1 1 11 GLU CB C 2.268 5.775 5.077 1.00 . A A . 11 GLU CB 1 1
2 348 1 1 11 GLU CD C 3.294 3.421 4.538 1.00 . A A . 11 GLU CD 1 1
2 349 1 1 11 GLU CG C 3.531 4.906 4.865 1.00 . A A . 11 GLU CG 1 1
2 350 1 1 11 GLU H H 1.361 4.872 2.149 1.00 . A A . 11 GLU H 1 1
2 351 1 1 11 GLU HA H 0.661 6.876 4.291 1.00 . A A . 11 GLU HA 1 1
2 352 1 1 11 GLU HB2 H 2.574 6.660 5.667 1.00 . A A . 11 GLU HB2 1 1
2 353 1 1 11 GLU HB3 H 1.570 5.245 5.752 1.00 . A A . 11 GLU HB3 1 1
2 354 1 1 11 GLU HG2 H 4.162 5.351 4.071 1.00 . A A . 11 GLU HG2 1 1
2 355 1 1 11 GLU HG3 H 4.177 4.989 5.759 1.00 . A A . 11 GLU HG3 1 1
2 356 1 1 11 GLU N N 0.906 5.201 3.007 1.00 . A A . 11 GLU N 1 1
2 357 1 1 11 GLU O O 3.465 7.571 3.186 1.00 . A A . 11 GLU O 1 1
2 358 1 1 11 GLU OE1 O 3.456 3.034 3.377 1.00 . A A . 11 GLU OE1 1 1
2 359 1 1 12 THR C C 2.466 10.268 1.498 1.00 . A A . 12 THR C 1 1
2 360 1 1 12 THR CA C 2.374 8.811 0.911 1.00 . A A . 12 THR CA 1 1
2 361 1 1 12 THR CB C 1.728 8.758 -0.518 1.00 . A A . 12 THR CB 1 1
2 362 1 1 12 THR CG2 C 2.577 9.429 -1.625 1.00 . A A . 12 THR CG2 1 1
2 363 1 1 12 THR H H 0.696 7.589 1.718 1.00 . A A . 12 THR H 1 1
2 364 1 1 12 THR HA H 3.397 8.417 0.733 1.00 . A A . 12 THR HA 1 1
2 365 1 1 12 THR HB H 0.740 9.258 -0.494 1.00 . A A . 12 THR HB 1 1
2 366 1 1 12 THR HG1 H 2.391 7.033 -1.067 1.00 . A A . 12 THR HG1 1 1
2 367 1 1 12 THR HG21 H 2.744 10.505 -1.434 1.00 . A A . 12 THR HG21 1 1
2 368 1 1 12 THR HG22 H 3.574 8.961 -1.734 1.00 . A A . 12 THR HG22 1 1
2 369 1 1 12 THR HG23 H 2.085 9.361 -2.615 1.00 . A A . 12 THR HG23 1 1
2 370 1 1 12 THR N N 1.672 7.879 1.856 1.00 . A A . 12 THR N 1 1
2 371 1 1 12 THR O O 1.758 11.172 1.041 1.00 . A A . 12 THR O 1 1
2 372 1 1 12 THR OG1 O 1.517 7.414 -0.940 1.00 . A A . 12 THR OG1 1 1
2 373 1 1 13 THR C C 5.055 12.051 3.333 1.00 . A A . 13 THR C 1 1
2 374 1 1 13 THR CA C 3.521 11.836 3.142 1.00 . A A . 13 THR CA 1 1
2 375 1 1 13 THR CB C 2.632 12.005 4.417 1.00 . A A . 13 THR CB 1 1
2 376 1 1 13 THR CG2 C 2.711 13.405 5.053 1.00 . A A . 13 THR CG2 1 1
2 377 1 1 13 THR H H 3.665 9.661 3.005 1.00 . A A . 13 THR H 1 1
2 378 1 1 13 THR HA H 3.200 12.623 2.429 1.00 . A A . 13 THR HA 1 1
2 379 1 1 13 THR HB H 2.934 11.262 5.179 1.00 . A A . 13 THR HB 1 1
2 380 1 1 13 THR HG1 H 1.046 12.380 3.389 1.00 . A A . 13 THR HG1 1 1
2 381 1 1 13 THR HG21 H 2.052 13.480 5.937 1.00 . A A . 13 THR HG21 1 1
2 382 1 1 13 THR HG22 H 3.735 13.644 5.396 1.00 . A A . 13 THR HG22 1 1
2 383 1 1 13 THR HG23 H 2.405 14.197 4.346 1.00 . A A . 13 THR HG23 1 1
2 384 1 1 13 THR N N 3.334 10.498 2.510 1.00 . A A . 13 THR N 1 1
2 385 1 1 13 THR O O 5.659 12.778 2.538 1.00 . A A . 13 THR O 1 1
2 386 1 1 13 THR OG1 O 1.261 11.776 4.104 1.00 . A A . 13 THR OG1 1 1
2 387 1 1 14 ALA C C 7.926 10.404 3.964 1.00 . A A . 14 ALA C 1 1
2 388 1 1 14 ALA CA C 7.140 11.567 4.614 1.00 . A A . 14 ALA CA 1 1
2 389 1 1 14 ALA CB C 7.345 11.669 6.138 1.00 . A A . 14 ALA CB 1 1
2 390 1 1 14 ALA H H 5.083 10.843 4.942 1.00 . A A . 14 ALA H 1 1
2 391 1 1 14 ALA HXT H 7.633 11.377 2.305 1.00 . A A . 14 ALA HXT 1 1
2 392 1 1 14 ALA HA H 7.523 12.513 4.185 1.00 . A A . 14 ALA HA 1 1
2 393 1 1 14 ALA HB1 H 8.414 11.803 6.392 1.00 . A A . 14 ALA HB1 1 1
2 394 1 1 14 ALA HB2 H 6.807 12.534 6.569 1.00 . A A . 14 ALA HB2 1 1
2 395 1 1 14 ALA HB3 H 6.998 10.764 6.672 1.00 . A A . 14 ALA HB3 1 1
2 396 1 1 14 ALA N N 5.686 11.424 4.351 1.00 . A A . 14 ALA N 1 1
2 397 1 1 14 ALA O O 8.372 9.435 4.580 1.00 . A A . 14 ALA O 1 1
2 398 1 1 14 ALA OXT O 8.073 10.579 2.609 1.00 . A A . 14 ALA OXT 1 1
3 399 1 1 1 ACE C C 8.565 9.322 1.917 1.00 . A A . 1 ACE C 1 1
3 400 1 1 1 ACE CH3 C 8.146 10.776 1.736 1.00 . A A . 1 ACE CH3 1 1
3 401 1 1 1 ACE H1 H 8.347 11.378 2.641 1.00 . A A . 1 ACE H1 1 1
3 402 1 1 1 ACE H2 H 8.696 11.246 0.900 1.00 . A A . 1 ACE H2 1 1
3 403 1 1 1 ACE H3 H 7.069 10.854 1.501 1.00 . A A . 1 ACE H3 1 1
3 404 1 1 1 ACE O O 9.376 8.803 1.148 1.00 . A A . 1 ACE O 1 1
3 405 1 1 2 ILE C C 6.981 6.491 2.873 1.00 . A A . 2 ILE C 1 1
3 406 1 1 2 ILE CA C 8.269 7.259 3.286 1.00 . A A . 2 ILE CA 1 1
3 407 1 1 2 ILE CB C 8.705 7.053 4.784 1.00 . A A . 2 ILE CB 1 1
3 408 1 1 2 ILE CD1 C 11.278 7.579 4.438 1.00 . A A . 2 ILE CD1 1 1
3 409 1 1 2 ILE CG1 C 9.979 7.842 5.223 1.00 . A A . 2 ILE CG1 1 1
3 410 1 1 2 ILE CG2 C 8.873 5.557 5.164 1.00 . A A . 2 ILE CG2 1 1
3 411 1 1 2 ILE H H 7.222 9.216 3.382 1.00 . A A . 2 ILE H 1 1
3 412 1 1 2 ILE HA H 9.109 6.886 2.667 1.00 . A A . 2 ILE HA 1 1
3 413 1 1 2 ILE HB H 7.880 7.431 5.419 1.00 . A A . 2 ILE HB 1 1
3 414 1 1 2 ILE HD11 H 11.177 7.850 3.371 1.00 . A A . 2 ILE HD11 1 1
3 415 1 1 2 ILE HD12 H 12.115 8.174 4.844 1.00 . A A . 2 ILE HD12 1 1
3 416 1 1 2 ILE HD13 H 11.582 6.518 4.485 1.00 . A A . 2 ILE HD13 1 1
3 417 1 1 2 ILE HG12 H 9.769 8.926 5.181 1.00 . A A . 2 ILE HG12 1 1
3 418 1 1 2 ILE HG13 H 10.180 7.652 6.296 1.00 . A A . 2 ILE HG13 1 1
3 419 1 1 2 ILE HG21 H 7.931 4.991 5.034 1.00 . A A . 2 ILE HG21 1 1
3 420 1 1 2 ILE HG22 H 9.641 5.053 4.549 1.00 . A A . 2 ILE HG22 1 1
3 421 1 1 2 ILE HG23 H 9.164 5.430 6.224 1.00 . A A . 2 ILE HG23 1 1
3 422 1 1 2 ILE N N 7.993 8.690 2.953 1.00 . A A . 2 ILE N 1 1
3 423 1 1 2 ILE O O 5.938 6.622 3.519 1.00 . A A . 2 ILE O 1 1
3 424 1 1 3 TRP C C 5.970 3.342 1.445 1.00 . A A . 3 TRP C 1 1
3 425 1 1 3 TRP CA C 5.945 4.896 1.248 1.00 . A A . 3 TRP CA 1 1
3 426 1 1 3 TRP CB C 5.818 5.271 -0.263 1.00 . A A . 3 TRP CB 1 1
3 427 1 1 3 TRP CD1 C 4.647 7.597 -0.039 1.00 . A A . 3 TRP CD1 1 1
3 428 1 1 3 TRP CD2 C 6.517 7.624 -1.234 1.00 . A A . 3 TRP CD2 1 1
3 429 1 1 3 TRP CE2 C 6.009 8.944 -1.116 1.00 . A A . 3 TRP CE2 1 1
3 430 1 1 3 TRP CE3 C 7.771 7.392 -1.856 1.00 . A A . 3 TRP CE3 1 1
3 431 1 1 3 TRP CG C 5.649 6.771 -0.577 1.00 . A A . 3 TRP CG 1 1
3 432 1 1 3 TRP CH2 C 7.965 9.786 -2.260 1.00 . A A . 3 TRP CH2 1 1
3 433 1 1 3 TRP CZ2 C 6.741 10.035 -1.638 1.00 . A A . 3 TRP CZ2 1 1
3 434 1 1 3 TRP CZ3 C 8.474 8.485 -2.366 1.00 . A A . 3 TRP CZ3 1 1
3 435 1 1 3 TRP H H 7.978 5.779 1.297 1.00 . A A . 3 TRP H 1 1
3 436 1 1 3 TRP HA H 5.001 5.219 1.727 1.00 . A A . 3 TRP HA 1 1
3 437 1 1 3 TRP HB2 H 6.687 4.867 -0.818 1.00 . A A . 3 TRP HB2 1 1
3 438 1 1 3 TRP HB3 H 4.948 4.746 -0.699 1.00 . A A . 3 TRP HB3 1 1
3 439 1 1 3 TRP HD1 H 3.926 7.235 0.676 1.00 . A A . 3 TRP HD1 1 1
3 440 1 1 3 TRP HE1 H 4.308 9.767 -0.054 1.00 . A A . 3 TRP HE1 1 1
3 441 1 1 3 TRP HE3 H 8.188 6.396 -1.912 1.00 . A A . 3 TRP HE3 1 1
3 442 1 1 3 TRP HH2 H 8.536 10.614 -2.657 1.00 . A A . 3 TRP HH2 1 1
3 443 1 1 3 TRP HZ2 H 6.368 11.044 -1.546 1.00 . A A . 3 TRP HZ2 1 1
3 444 1 1 3 TRP HZ3 H 9.432 8.326 -2.838 1.00 . A A . 3 TRP HZ3 1 1
3 445 1 1 3 TRP N N 7.094 5.679 1.809 1.00 . A A . 3 TRP N 1 1
3 446 1 1 3 TRP NE1 N 4.838 8.950 -0.378 1.00 . A A . 3 TRP NE1 1 1
3 447 1 1 3 TRP O O 5.111 2.655 0.881 1.00 . A A . 3 TRP O 1 1
3 448 1 1 4 GLY C C 6.475 0.901 3.880 1.00 . A A . 4 GLY C 1 1
3 449 1 1 4 GLY CA C 6.995 1.329 2.497 1.00 . A A . 4 GLY CA 1 1
3 450 1 1 4 GLY H H 7.491 3.470 2.724 1.00 . A A . 4 GLY H 1 1
3 451 1 1 4 GLY HA2 H 6.507 0.739 1.697 1.00 . A A . 4 GLY HA2 1 1
3 452 1 1 4 GLY HA3 H 8.063 1.052 2.426 1.00 . A A . 4 GLY HA3 1 1
3 453 1 1 4 GLY N N 6.892 2.786 2.255 1.00 . A A . 4 GLY N 1 1
3 454 1 1 4 GLY O O 7.266 0.733 4.811 1.00 . A A . 4 GLY O 1 1
3 455 1 1 5 . C C 3.130 1.080 5.487 1.00 . A A . 5 SET C 1 1
3 456 1 1 5 . CA C 4.473 0.288 5.246 1.00 . A A . 5 SET CA 1 1
3 457 1 1 5 . CB C 4.200 -1.246 5.173 1.00 . A A . 5 SET CB 1 1
3 458 1 1 5 . H H 4.620 0.986 3.150 1.00 . A A . 5 SET H 1 1
3 459 1 1 5 . HA H 5.191 0.434 6.085 1.00 . A A . 5 SET HA 1 1
3 460 1 1 5 . HB2 H 2.382 0.783 4.728 1.00 . A A . 5 SET HB2 1 1
3 461 1 1 5 . HB3 H 2.683 0.720 6.432 1.00 . A A . 5 SET HB3 1 1
3 462 1 1 5 . HNT2 H 3.088 3.105 6.453 1.00 . A A . 5 SET HNT2 1 1
3 463 1 1 5 . N N 5.150 0.707 3.984 1.00 . A A . 5 SET N 1 1
3 464 1 1 5 . NT N 3.148 2.574 5.569 1.00 . A A . 5 SET NT 1 1
3 465 1 1 5 . OG O 3.722 -1.761 4.154 1.00 . A A . 5 SET OG 1 1
3 466 1 1 6 SER C C 2.843 -3.950 6.146 1.00 . A A . 6 SER C 1 1
3 467 1 1 6 SER CA C 4.304 -3.446 6.360 1.00 . A A . 6 SER CA 1 1
3 468 1 1 6 SER CB C 4.868 -3.911 7.723 1.00 . A A . 6 SER CB 1 1
3 469 1 1 6 SER H H 4.814 -1.426 7.082 1.00 . A A . 6 SER H 1 1
3 470 1 1 6 SER HA H 4.975 -3.880 5.591 1.00 . A A . 6 SER HA 1 1
3 471 1 1 6 SER HB2 H 5.894 -3.525 7.878 1.00 . A A . 6 SER HB2 1 1
3 472 1 1 6 SER HB3 H 4.265 -3.515 8.563 1.00 . A A . 6 SER HB3 1 1
3 473 1 1 6 SER HG H 4.001 -5.635 7.775 1.00 . A A . 6 SER HG 1 1
3 474 1 1 6 SER N N 4.473 -1.969 6.280 1.00 . A A . 6 SER N 1 1
3 475 1 1 6 SER O O 1.926 -3.549 6.871 1.00 . A A . 6 SER O 1 1
3 476 1 1 6 SER OG O 4.912 -5.333 7.802 1.00 . A A . 6 SER OG 1 1
3 477 1 1 7 GLY C C 0.578 -4.598 3.728 1.00 . A A . 7 GLY C 1 1
3 478 1 1 7 GLY CA C 1.318 -5.396 4.818 1.00 . A A . 7 GLY CA 1 1
3 479 1 1 7 GLY H H 3.474 -5.045 4.576 1.00 . A A . 7 GLY H 1 1
3 480 1 1 7 GLY HA2 H 1.462 -6.431 4.459 1.00 . A A . 7 GLY HA2 1 1
3 481 1 1 7 GLY HA3 H 0.686 -5.505 5.723 1.00 . A A . 7 GLY HA3 1 1
3 482 1 1 7 GLY N N 2.648 -4.830 5.145 1.00 . A A . 7 GLY N 1 1
3 483 1 1 7 GLY O O 0.578 -4.988 2.557 1.00 . A A . 7 GLY O 1 1
3 484 1 1 8 LYS C C -0.025 -1.260 3.171 1.00 . A A . 8 LYS C 1 1
3 485 1 1 8 LYS CA C -0.819 -2.592 3.261 1.00 . A A . 8 LYS CA 1 1
3 486 1 1 8 LYS CB C -2.245 -2.435 3.856 1.00 . A A . 8 LYS CB 1 1
3 487 1 1 8 LYS CD C -3.629 -2.098 1.656 1.00 . A A . 8 LYS CD 1 1
3 488 1 1 8 LYS CE C -2.800 -1.490 0.507 1.00 . A A . 8 LYS CE 1 1
3 489 1 1 8 LYS CG C -3.250 -1.574 3.058 1.00 . A A . 8 LYS CG 1 1
3 490 1 1 8 LYS H H 0.173 -3.187 5.088 1.00 . A A . 8 LYS H 1 1
3 491 1 1 8 LYS HA H -0.934 -3.052 2.259 1.00 . A A . 8 LYS HA 1 1
3 492 1 1 8 LYS HB2 H -2.696 -3.436 4.000 1.00 . A A . 8 LYS HB2 1 1
3 493 1 1 8 LYS HB3 H -2.175 -2.013 4.880 1.00 . A A . 8 LYS HB3 1 1
3 494 1 1 8 LYS HD2 H -3.567 -3.205 1.642 1.00 . A A . 8 LYS HD2 1 1
3 495 1 1 8 LYS HD3 H -4.697 -1.864 1.495 1.00 . A A . 8 LYS HD3 1 1
3 496 1 1 8 LYS HE2 H -2.816 -0.385 0.564 1.00 . A A . 8 LYS HE2 1 1
3 497 1 1 8 LYS HE3 H -1.736 -1.777 0.598 1.00 . A A . 8 LYS HE3 1 1
3 498 1 1 8 LYS HG2 H -4.175 -1.514 3.662 1.00 . A A . 8 LYS HG2 1 1
3 499 1 1 8 LYS HG3 H -2.897 -0.528 3.002 1.00 . A A . 8 LYS HG3 1 1
3 500 1 1 8 LYS HZ1 H -2.767 -1.529 -1.586 1.00 . A A . 8 LYS HZ1 1 1
3 501 1 1 8 LYS HZ2 H -3.272 -2.949 -0.913 1.00 . A A . 8 LYS HZ2 1 1
3 502 1 1 8 LYS HZ3 H -4.285 -1.649 -0.953 1.00 . A A . 8 LYS HZ3 1 1
3 503 1 1 8 LYS N N -0.059 -3.493 4.146 1.00 . A A . 8 LYS N 1 1
3 504 1 1 8 LYS NZ N -3.308 -1.928 -0.809 1.00 . A A . 8 LYS NZ 1 1
3 505 1 1 8 LYS O O 0.021 -0.470 4.121 1.00 . A A . 8 LYS O 1 1
3 506 1 1 9 LEU C C 0.434 1.383 1.423 1.00 . A A . 9 LEU C 1 1
3 507 1 1 9 LEU CA C 1.393 0.181 1.706 1.00 . A A . 9 LEU CA 1 1
3 508 1 1 9 LEU CB C 2.377 -0.063 0.519 1.00 . A A . 9 LEU CB 1 1
3 509 1 1 9 LEU CD1 C 3.363 -2.443 0.907 1.00 . A A . 9 LEU CD1 1 1
3 510 1 1 9 LEU CD2 C 4.687 -0.718 -0.344 1.00 . A A . 9 LEU CD2 1 1
3 511 1 1 9 LEU CG C 3.644 -0.932 0.775 1.00 . A A . 9 LEU CG 1 1
3 512 1 1 9 LEU H H 0.590 -1.870 1.404 1.00 . A A . 9 LEU H 1 1
3 513 1 1 9 LEU HA H 2.023 0.422 2.583 1.00 . A A . 9 LEU HA 1 1
3 514 1 1 9 LEU HB2 H 1.827 -0.447 -0.363 1.00 . A A . 9 LEU HB2 1 1
3 515 1 1 9 LEU HB3 H 2.735 0.935 0.197 1.00 . A A . 9 LEU HB3 1 1
3 516 1 1 9 LEU HD11 H 2.859 -2.853 0.012 1.00 . A A . 9 LEU HD11 1 1
3 517 1 1 9 LEU HD12 H 4.297 -3.020 1.049 1.00 . A A . 9 LEU HD12 1 1
3 518 1 1 9 LEU HD13 H 2.730 -2.675 1.780 1.00 . A A . 9 LEU HD13 1 1
3 519 1 1 9 LEU HD21 H 4.313 -1.044 -1.333 1.00 . A A . 9 LEU HD21 1 1
3 520 1 1 9 LEU HD22 H 4.974 0.345 -0.441 1.00 . A A . 9 LEU HD22 1 1
3 521 1 1 9 LEU HD23 H 5.622 -1.275 -0.145 1.00 . A A . 9 LEU HD23 1 1
3 522 1 1 9 LEU HG H 4.110 -0.592 1.716 1.00 . A A . 9 LEU HG 1 1
3 523 1 1 9 LEU N N 0.587 -1.037 1.999 1.00 . A A . 9 LEU N 1 1
3 524 1 1 9 LEU O O -0.039 1.567 0.296 1.00 . A A . 9 LEU O 1 1
3 525 1 1 10 ILE C C -0.334 4.409 3.446 1.00 . A A . 10 ILE C 1 1
3 526 1 1 10 ILE CA C -0.772 3.354 2.379 1.00 . A A . 10 ILE CA 1 1
3 527 1 1 10 ILE CB C -2.292 2.922 2.399 1.00 . A A . 10 ILE CB 1 1
3 528 1 1 10 ILE CD1 C -3.147 4.554 0.564 1.00 . A A . 10 ILE CD1 1 1
3 529 1 1 10 ILE CG1 C -3.278 4.059 2.012 1.00 . A A . 10 ILE CG1 1 1
3 530 1 1 10 ILE CG2 C -2.777 2.248 3.710 1.00 . A A . 10 ILE CG2 1 1
3 531 1 1 10 ILE H H 0.524 1.879 3.368 1.00 . A A . 10 ILE H 1 1
3 532 1 1 10 ILE HA H -0.596 3.820 1.390 1.00 . A A . 10 ILE HA 1 1
3 533 1 1 10 ILE HB H -2.408 2.145 1.618 1.00 . A A . 10 ILE HB 1 1
3 534 1 1 10 ILE HD11 H -2.179 5.056 0.384 1.00 . A A . 10 ILE HD11 1 1
3 535 1 1 10 ILE HD12 H -3.231 3.720 -0.158 1.00 . A A . 10 ILE HD12 1 1
3 536 1 1 10 ILE HD13 H -3.941 5.284 0.322 1.00 . A A . 10 ILE HD13 1 1
3 537 1 1 10 ILE HG12 H -4.320 3.710 2.145 1.00 . A A . 10 ILE HG12 1 1
3 538 1 1 10 ILE HG13 H -3.171 4.914 2.707 1.00 . A A . 10 ILE HG13 1 1
3 539 1 1 10 ILE HG21 H -2.864 2.961 4.549 1.00 . A A . 10 ILE HG21 1 1
3 540 1 1 10 ILE HG22 H -3.772 1.784 3.582 1.00 . A A . 10 ILE HG22 1 1
3 541 1 1 10 ILE HG23 H -2.091 1.445 4.038 1.00 . A A . 10 ILE HG23 1 1
3 542 1 1 10 ILE N N 0.130 2.175 2.472 1.00 . A A . 10 ILE N 1 1
3 543 1 1 10 ILE O O -0.905 4.499 4.537 1.00 . A A . 10 ILE O 1 1
3 544 1 1 11 GLU C C 1.840 7.418 3.158 1.00 . A A . 11 GLU C 1 1
3 545 1 1 11 GLU CA C 1.233 6.263 4.031 1.00 . A A . 11 GLU CA 1 1
3 546 1 1 11 GLU CB C 2.185 5.688 5.126 1.00 . A A . 11 GLU CB 1 1
3 547 1 1 11 GLU CD C 3.225 3.354 4.473 1.00 . A A . 11 GLU CD 1 1
3 548 1 1 11 GLU CG C 3.427 4.865 4.693 1.00 . A A . 11 GLU CG 1 1
3 549 1 1 11 GLU H H 1.173 4.971 2.244 1.00 . A A . 11 GLU H 1 1
3 550 1 1 11 GLU HA H 0.404 6.679 4.641 1.00 . A A . 11 GLU HA 1 1
3 551 1 1 11 GLU HB2 H 2.548 6.542 5.728 1.00 . A A . 11 GLU HB2 1 1
3 552 1 1 11 GLU HB3 H 1.592 5.095 5.849 1.00 . A A . 11 GLU HB3 1 1
3 553 1 1 11 GLU HG2 H 3.841 5.294 3.763 1.00 . A A . 11 GLU HG2 1 1
3 554 1 1 11 GLU HG3 H 4.240 5.018 5.427 1.00 . A A . 11 GLU HG3 1 1
3 555 1 1 11 GLU N N 0.702 5.208 3.124 1.00 . A A . 11 GLU N 1 1
3 556 1 1 11 GLU O O 3.065 7.568 3.106 1.00 . A A . 11 GLU O 1 1
3 557 1 1 11 GLU OE1 O 3.263 2.910 3.323 1.00 . A A . 11 GLU OE1 1 1
3 558 1 1 12 THR C C 1.836 10.641 2.495 1.00 . A A . 12 THR C 1 1
3 559 1 1 12 THR CA C 1.524 9.376 1.618 1.00 . A A . 12 THR CA 1 1
3 560 1 1 12 THR CB C 0.579 9.670 0.403 1.00 . A A . 12 THR CB 1 1
3 561 1 1 12 THR CG2 C 1.176 10.630 -0.653 1.00 . A A . 12 THR CG2 1 1
3 562 1 1 12 THR H H 0.016 8.013 2.491 1.00 . A A . 12 THR H 1 1
3 563 1 1 12 THR HA H 2.451 9.035 1.115 1.00 . A A . 12 THR HA 1 1
3 564 1 1 12 THR HB H -0.368 10.116 0.766 1.00 . A A . 12 THR HB 1 1
3 565 1 1 12 THR HG1 H 1.082 8.162 -0.685 1.00 . A A . 12 THR HG1 1 1
3 566 1 1 12 THR HG21 H 1.405 11.628 -0.236 1.00 . A A . 12 THR HG21 1 1
3 567 1 1 12 THR HG22 H 2.115 10.243 -1.095 1.00 . A A . 12 THR HG22 1 1
3 568 1 1 12 THR HG23 H 0.478 10.798 -1.494 1.00 . A A . 12 THR HG23 1 1
3 569 1 1 12 THR N N 1.013 8.256 2.477 1.00 . A A . 12 THR N 1 1
3 570 1 1 12 THR O O 1.061 11.604 2.498 1.00 . A A . 12 THR O 1 1
3 571 1 1 12 THR OG1 O 0.262 8.463 -0.286 1.00 . A A . 12 THR OG1 1 1
3 572 1 1 13 THR C C 3.861 13.025 3.251 1.00 . A A . 13 THR C 1 1
3 573 1 1 13 THR CA C 3.375 11.801 4.096 1.00 . A A . 13 THR CA 1 1
3 574 1 1 13 THR CB C 4.386 11.342 5.199 1.00 . A A . 13 THR CB 1 1
3 575 1 1 13 THR CG2 C 4.670 12.410 6.270 1.00 . A A . 13 THR CG2 1 1
3 576 1 1 13 THR H H 3.341 9.714 3.445 1.00 . A A . 13 THR H 1 1
3 577 1 1 13 THR HA H 2.466 12.131 4.640 1.00 . A A . 13 THR HA 1 1
3 578 1 1 13 THR HB H 5.353 11.071 4.731 1.00 . A A . 13 THR HB 1 1
3 579 1 1 13 THR HG1 H 3.113 10.487 6.365 1.00 . A A . 13 THR HG1 1 1
3 580 1 1 13 THR HG21 H 5.372 12.032 7.037 1.00 . A A . 13 THR HG21 1 1
3 581 1 1 13 THR HG22 H 5.129 13.316 5.835 1.00 . A A . 13 THR HG22 1 1
3 582 1 1 13 THR HG23 H 3.750 12.724 6.795 1.00 . A A . 13 THR HG23 1 1
3 583 1 1 13 THR N N 2.974 10.649 3.230 1.00 . A A . 13 THR N 1 1
3 584 1 1 13 THR O O 3.203 14.069 3.286 1.00 . A A . 13 THR O 1 1
3 585 1 1 13 THR OG1 O 3.895 10.195 5.891 1.00 . A A . 13 THR OG1 1 1
3 586 1 1 14 ALA C C 5.808 13.457 0.254 1.00 . A A . 14 ALA C 1 1
3 587 1 1 14 ALA CA C 5.528 13.999 1.673 1.00 . A A . 14 ALA CA 1 1
3 588 1 1 14 ALA CB C 6.769 14.597 2.368 1.00 . A A . 14 ALA CB 1 1
3 589 1 1 14 ALA H H 5.439 11.985 2.575 1.00 . A A . 14 ALA H 1 1
3 590 1 1 14 ALA HXT H 3.872 13.477 0.058 1.00 . A A . 14 ALA HXT 1 1
3 591 1 1 14 ALA HA H 4.793 14.819 1.562 1.00 . A A . 14 ALA HA 1 1
3 592 1 1 14 ALA HB1 H 7.198 15.429 1.778 1.00 . A A . 14 ALA HB1 1 1
3 593 1 1 14 ALA HB2 H 6.522 15.008 3.364 1.00 . A A . 14 ALA HB2 1 1
3 594 1 1 14 ALA HB3 H 7.573 13.851 2.509 1.00 . A A . 14 ALA HB3 1 1
3 595 1 1 14 ALA N N 4.985 12.902 2.513 1.00 . A A . 14 ALA N 1 1
3 596 1 1 14 ALA O O 6.932 13.230 -0.194 1.00 . A A . 14 ALA O 1 1
3 597 1 1 14 ALA OXT O 4.651 13.255 -0.457 1.00 . A A . 14 ALA OXT 1 1
4 598 1 1 1 ACE C C 5.380 9.689 -0.004 1.00 . A A . 1 ACE C 1 1
4 599 1 1 1 ACE CH3 C 4.923 11.003 0.620 1.00 . A A . 1 ACE CH3 1 1
4 600 1 1 1 ACE H1 H 4.315 10.835 1.527 1.00 . A A . 1 ACE H1 1 1
4 601 1 1 1 ACE H2 H 5.784 11.636 0.903 1.00 . A A . 1 ACE H2 1 1
4 602 1 1 1 ACE H3 H 4.301 11.585 -0.085 1.00 . A A . 1 ACE H3 1 1
4 603 1 1 1 ACE O O 5.135 9.443 -1.187 1.00 . A A . 1 ACE O 1 1
4 604 1 1 2 ILE C C 5.714 6.468 1.120 1.00 . A A . 2 ILE C 1 1
4 605 1 1 2 ILE CA C 6.582 7.538 0.391 1.00 . A A . 2 ILE CA 1 1
4 606 1 1 2 ILE CB C 8.133 7.397 0.624 1.00 . A A . 2 ILE CB 1 1
4 607 1 1 2 ILE CD1 C 8.921 8.597 -1.603 1.00 . A A . 2 ILE CD1 1 1
4 608 1 1 2 ILE CG1 C 9.021 8.479 -0.071 1.00 . A A . 2 ILE CG1 1 1
4 609 1 1 2 ILE CG2 C 8.683 5.988 0.276 1.00 . A A . 2 ILE CG2 1 1
4 610 1 1 2 ILE H H 6.037 9.161 1.801 1.00 . A A . 2 ILE H 1 1
4 611 1 1 2 ILE HA H 6.410 7.416 -0.699 1.00 . A A . 2 ILE HA 1 1
4 612 1 1 2 ILE HB H 8.306 7.518 1.710 1.00 . A A . 2 ILE HB 1 1
4 613 1 1 2 ILE HD11 H 7.899 8.863 -1.932 1.00 . A A . 2 ILE HD11 1 1
4 614 1 1 2 ILE HD12 H 9.597 9.385 -1.984 1.00 . A A . 2 ILE HD12 1 1
4 615 1 1 2 ILE HD13 H 9.201 7.656 -2.111 1.00 . A A . 2 ILE HD13 1 1
4 616 1 1 2 ILE HG12 H 8.795 9.469 0.366 1.00 . A A . 2 ILE HG12 1 1
4 617 1 1 2 ILE HG13 H 10.084 8.310 0.193 1.00 . A A . 2 ILE HG13 1 1
4 618 1 1 2 ILE HG21 H 8.211 5.198 0.890 1.00 . A A . 2 ILE HG21 1 1
4 619 1 1 2 ILE HG22 H 8.508 5.723 -0.783 1.00 . A A . 2 ILE HG22 1 1
4 620 1 1 2 ILE HG23 H 9.771 5.911 0.461 1.00 . A A . 2 ILE HG23 1 1
4 621 1 1 2 ILE N N 6.053 8.871 0.816 1.00 . A A . 2 ILE N 1 1
4 622 1 1 2 ILE O O 5.526 6.499 2.341 1.00 . A A . 2 ILE O 1 1
4 623 1 1 3 TRP C C 5.126 3.114 1.246 1.00 . A A . 3 TRP C 1 1
4 624 1 1 3 TRP CA C 4.348 4.399 0.826 1.00 . A A . 3 TRP CA 1 1
4 625 1 1 3 TRP CB C 3.234 4.124 -0.238 1.00 . A A . 3 TRP CB 1 1
4 626 1 1 3 TRP CD1 C 1.557 6.152 -0.274 1.00 . A A . 3 TRP CD1 1 1
4 627 1 1 3 TRP CD2 C 2.949 6.043 -1.999 1.00 . A A . 3 TRP CD2 1 1
4 628 1 1 3 TRP CE2 C 2.180 7.229 -2.087 1.00 . A A . 3 TRP CE2 1 1
4 629 1 1 3 TRP CE3 C 4.043 5.831 -2.875 1.00 . A A . 3 TRP CE3 1 1
4 630 1 1 3 TRP CG C 2.545 5.351 -0.868 1.00 . A A . 3 TRP CG 1 1
4 631 1 1 3 TRP CH2 C 3.545 7.960 -3.947 1.00 . A A . 3 TRP CH2 1 1
4 632 1 1 3 TRP CZ2 C 2.484 8.202 -3.070 1.00 . A A . 3 TRP CZ2 1 1
4 633 1 1 3 TRP CZ3 C 4.316 6.795 -3.847 1.00 . A A . 3 TRP CZ3 1 1
4 634 1 1 3 TRP H H 5.468 5.583 -0.659 1.00 . A A . 3 TRP H 1 1
4 635 1 1 3 TRP HA H 3.803 4.758 1.723 1.00 . A A . 3 TRP HA 1 1
4 636 1 1 3 TRP HB2 H 3.651 3.507 -1.057 1.00 . A A . 3 TRP HB2 1 1
4 637 1 1 3 TRP HB3 H 2.460 3.476 0.216 1.00 . A A . 3 TRP HB3 1 1
4 638 1 1 3 TRP HD1 H 1.179 5.990 0.719 1.00 . A A . 3 TRP HD1 1 1
4 639 1 1 3 TRP HE1 H 0.705 8.104 -0.761 1.00 . A A . 3 TRP HE1 1 1
4 640 1 1 3 TRP HE3 H 4.689 4.971 -2.744 1.00 . A A . 3 TRP HE3 1 1
4 641 1 1 3 TRP HH2 H 3.794 8.699 -4.694 1.00 . A A . 3 TRP HH2 1 1
4 642 1 1 3 TRP HZ2 H 1.929 9.127 -3.124 1.00 . A A . 3 TRP HZ2 1 1
4 643 1 1 3 TRP HZ3 H 5.153 6.653 -4.515 1.00 . A A . 3 TRP HZ3 1 1
4 644 1 1 3 TRP N N 5.247 5.482 0.337 1.00 . A A . 3 TRP N 1 1
4 645 1 1 3 TRP NE1 N 1.288 7.305 -1.033 1.00 . A A . 3 TRP NE1 1 1
4 646 1 1 3 TRP O O 4.975 2.041 0.654 1.00 . A A . 3 TRP O 1 1
4 647 1 1 4 GLY C C 6.175 1.662 4.209 1.00 . A A . 4 GLY C 1 1
4 648 1 1 4 GLY CA C 6.745 2.121 2.855 1.00 . A A . 4 GLY CA 1 1
4 649 1 1 4 GLY H H 6.028 4.204 2.635 1.00 . A A . 4 GLY H 1 1
4 650 1 1 4 GLY HA2 H 6.830 1.271 2.150 1.00 . A A . 4 GLY HA2 1 1
4 651 1 1 4 GLY HA3 H 7.781 2.476 3.003 1.00 . A A . 4 GLY HA3 1 1
4 652 1 1 4 GLY N N 5.946 3.239 2.302 1.00 . A A . 4 GLY N 1 1
4 653 1 1 4 GLY O O 6.670 2.080 5.259 1.00 . A A . 4 GLY O 1 1
4 654 1 1 5 . C C 3.074 0.998 5.652 1.00 . A A . 5 SET C 1 1
4 655 1 1 5 . CA C 4.457 0.281 5.383 1.00 . A A . 5 SET CA 1 1
4 656 1 1 5 . CB C 4.240 -1.250 5.203 1.00 . A A . 5 SET CB 1 1
4 657 1 1 5 . H H 4.787 0.625 3.217 1.00 . A A . 5 SET H 1 1
4 658 1 1 5 . HA H 5.165 0.380 6.236 1.00 . A A . 5 SET HA 1 1
4 659 1 1 5 . HB2 H 2.354 0.713 4.858 1.00 . A A . 5 SET HB2 1 1
4 660 1 1 5 . HB3 H 2.627 0.568 6.567 1.00 . A A . 5 SET HB3 1 1
4 661 1 1 5 . HNT2 H 2.987 2.973 6.720 1.00 . A A . 5 SET HNT2 1 1
4 662 1 1 5 . N N 5.139 0.805 4.164 1.00 . A A . 5 SET N 1 1
4 663 1 1 5 . NT N 3.021 2.487 5.809 1.00 . A A . 5 SET NT 1 1
4 664 1 1 5 . OG O 3.790 -1.710 4.147 1.00 . A A . 5 SET OG 1 1
4 665 1 1 6 SER C C 2.934 -4.039 6.049 1.00 . A A . 6 SER C 1 1
4 666 1 1 6 SER CA C 4.397 -3.525 6.226 1.00 . A A . 6 SER CA 1 1
4 667 1 1 6 SER CB C 5.043 -4.084 7.515 1.00 . A A . 6 SER CB 1 1
4 668 1 1 6 SER H H 4.827 -1.548 7.107 1.00 . A A . 6 SER H 1 1
4 669 1 1 6 SER HA H 5.033 -3.881 5.390 1.00 . A A . 6 SER HA 1 1
4 670 1 1 6 SER HB2 H 6.068 -3.687 7.646 1.00 . A A . 6 SER HB2 1 1
4 671 1 1 6 SER HB3 H 4.479 -3.771 8.416 1.00 . A A . 6 SER HB3 1 1
4 672 1 1 6 SER HG H 4.213 -5.826 7.473 1.00 . A A . 6 SER HG 1 1
4 673 1 1 6 SER N N 4.523 -2.041 6.259 1.00 . A A . 6 SER N 1 1
4 674 1 1 6 SER O O 2.057 -3.730 6.864 1.00 . A A . 6 SER O 1 1
4 675 1 1 6 SER OG O 5.119 -5.506 7.476 1.00 . A A . 6 SER OG 1 1
4 676 1 1 7 GLY C C 0.532 -4.510 3.716 1.00 . A A . 7 GLY C 1 1
4 677 1 1 7 GLY CA C 1.355 -5.384 4.681 1.00 . A A . 7 GLY CA 1 1
4 678 1 1 7 GLY H H 3.485 -4.961 4.344 1.00 . A A . 7 GLY H 1 1
4 679 1 1 7 GLY HA2 H 1.494 -6.379 4.220 1.00 . A A . 7 GLY HA2 1 1
4 680 1 1 7 GLY HA3 H 0.782 -5.590 5.608 1.00 . A A . 7 GLY HA3 1 1
4 681 1 1 7 GLY N N 2.693 -4.822 4.980 1.00 . A A . 7 GLY N 1 1
4 682 1 1 7 GLY O O 0.460 -4.797 2.518 1.00 . A A . 7 GLY O 1 1
4 683 1 1 8 LYS C C -0.090 -1.199 3.322 1.00 . A A . 8 LYS C 1 1
4 684 1 1 8 LYS CA C -0.923 -2.500 3.508 1.00 . A A . 8 LYS CA 1 1
4 685 1 1 8 LYS CB C -2.252 -2.329 4.294 1.00 . A A . 8 LYS CB 1 1
4 686 1 1 8 LYS CD C -3.894 -1.873 2.292 1.00 . A A . 8 LYS CD 1 1
4 687 1 1 8 LYS CE C -3.180 -1.225 1.087 1.00 . A A . 8 LYS CE 1 1
4 688 1 1 8 LYS CG C -3.343 -1.434 3.667 1.00 . A A . 8 LYS CG 1 1
4 689 1 1 8 LYS H H 0.183 -3.248 5.226 1.00 . A A . 8 LYS H 1 1
4 690 1 1 8 LYS HA H -1.189 -2.935 2.525 1.00 . A A . 8 LYS HA 1 1
4 691 1 1 8 LYS HB2 H -2.702 -3.325 4.473 1.00 . A A . 8 LYS HB2 1 1
4 692 1 1 8 LYS HB3 H -2.034 -1.937 5.308 1.00 . A A . 8 LYS HB3 1 1
4 693 1 1 8 LYS HD2 H -3.872 -2.977 2.215 1.00 . A A . 8 LYS HD2 1 1
4 694 1 1 8 LYS HD3 H -4.965 -1.600 2.262 1.00 . A A . 8 LYS HD3 1 1
4 695 1 1 8 LYS HE2 H -3.173 -0.123 1.193 1.00 . A A . 8 LYS HE2 1 1
4 696 1 1 8 LYS HE3 H -2.117 -1.525 1.052 1.00 . A A . 8 LYS HE3 1 1
4 697 1 1 8 LYS HG2 H -4.189 -1.413 4.380 1.00 . A A . 8 LYS HG2 1 1
4 698 1 1 8 LYS HG3 H -2.995 -0.389 3.636 1.00 . A A . 8 LYS HG3 1 1
4 699 1 1 8 LYS HZ1 H -4.814 -1.300 -0.211 1.00 . A A . 8 LYS HZ1 1 1
4 700 1 1 8 LYS HZ2 H -3.368 -1.172 -0.996 1.00 . A A . 8 LYS HZ2 1 1
4 701 1 1 8 LYS HZ3 H -3.826 -2.613 -0.335 1.00 . A A . 8 LYS HZ3 1 1
4 702 1 1 8 LYS N N -0.090 -3.457 4.267 1.00 . A A . 8 LYS N 1 1
4 703 1 1 8 LYS NZ N -3.832 -1.597 -0.184 1.00 . A A . 8 LYS NZ 1 1
4 704 1 1 8 LYS O O 0.012 -0.360 4.222 1.00 . A A . 8 LYS O 1 1
4 705 1 1 9 LEU C C 0.483 1.341 1.365 1.00 . A A . 9 LEU C 1 1
4 706 1 1 9 LEU CA C 1.350 0.092 1.733 1.00 . A A . 9 LEU CA 1 1
4 707 1 1 9 LEU CB C 2.296 -0.312 0.553 1.00 . A A . 9 LEU CB 1 1
4 708 1 1 9 LEU CD1 C 3.166 -2.698 1.145 1.00 . A A . 9 LEU CD1 1 1
4 709 1 1 9 LEU CD2 C 4.510 -1.209 -0.347 1.00 . A A . 9 LEU CD2 1 1
4 710 1 1 9 LEU CG C 3.523 -1.228 0.840 1.00 . A A . 9 LEU CG 1 1
4 711 1 1 9 LEU H H 0.417 -1.917 1.557 1.00 . A A . 9 LEU H 1 1
4 712 1 1 9 LEU HA H 2.008 0.362 2.583 1.00 . A A . 9 LEU HA 1 1
4 713 1 1 9 LEU HB2 H 1.703 -0.734 -0.282 1.00 . A A . 9 LEU HB2 1 1
4 714 1 1 9 LEU HB3 H 2.702 0.631 0.137 1.00 . A A . 9 LEU HB3 1 1
4 715 1 1 9 LEU HD11 H 2.596 -3.170 0.324 1.00 . A A . 9 LEU HD11 1 1
4 716 1 1 9 LEU HD12 H 4.073 -3.312 1.309 1.00 . A A . 9 LEU HD12 1 1
4 717 1 1 9 LEU HD13 H 2.565 -2.798 2.065 1.00 . A A . 9 LEU HD13 1 1
4 718 1 1 9 LEU HD21 H 5.426 -1.793 -0.130 1.00 . A A . 9 LEU HD21 1 1
4 719 1 1 9 LEU HD22 H 4.066 -1.630 -1.269 1.00 . A A . 9 LEU HD22 1 1
4 720 1 1 9 LEU HD23 H 4.849 -0.187 -0.592 1.00 . A A . 9 LEU HD23 1 1
4 721 1 1 9 LEU HG H 4.059 -0.814 1.713 1.00 . A A . 9 LEU HG 1 1
4 722 1 1 9 LEU N N 0.493 -1.064 2.120 1.00 . A A . 9 LEU N 1 1
4 723 1 1 9 LEU O O 0.128 1.544 0.198 1.00 . A A . 9 LEU O 1 1
4 724 1 1 10 ILE C C -0.416 4.386 3.361 1.00 . A A . 10 ILE C 1 1
4 725 1 1 10 ILE CA C -0.683 3.401 2.176 1.00 . A A . 10 ILE CA 1 1
4 726 1 1 10 ILE CB C -2.199 3.093 1.859 1.00 . A A . 10 ILE CB 1 1
4 727 1 1 10 ILE CD1 C -2.515 4.759 -0.113 1.00 . A A . 10 ILE CD1 1 1
4 728 1 1 10 ILE CG1 C -2.983 4.303 1.278 1.00 . A A . 10 ILE CG1 1 1
4 729 1 1 10 ILE CG2 C -3.001 2.474 3.030 1.00 . A A . 10 ILE CG2 1 1
4 730 1 1 10 ILE H H 0.441 1.879 3.302 1.00 . A A . 10 ILE H 1 1
4 731 1 1 10 ILE HA H -0.276 3.889 1.268 1.00 . A A . 10 ILE HA 1 1
4 732 1 1 10 ILE HB H -2.210 2.322 1.066 1.00 . A A . 10 ILE HB 1 1
4 733 1 1 10 ILE HD11 H -1.493 5.177 -0.092 1.00 . A A . 10 ILE HD11 1 1
4 734 1 1 10 ILE HD12 H -2.519 3.923 -0.836 1.00 . A A . 10 ILE HD12 1 1
4 735 1 1 10 ILE HD13 H -3.178 5.546 -0.515 1.00 . A A . 10 ILE HD13 1 1
4 736 1 1 10 ILE HG12 H -4.056 4.045 1.193 1.00 . A A . 10 ILE HG12 1 1
4 737 1 1 10 ILE HG13 H -2.948 5.157 1.980 1.00 . A A . 10 ILE HG13 1 1
4 738 1 1 10 ILE HG21 H -3.293 3.223 3.787 1.00 . A A . 10 ILE HG21 1 1
4 739 1 1 10 ILE HG22 H -3.934 1.994 2.679 1.00 . A A . 10 ILE HG22 1 1
4 740 1 1 10 ILE HG23 H -2.413 1.703 3.557 1.00 . A A . 10 ILE HG23 1 1
4 741 1 1 10 ILE N N 0.129 2.167 2.372 1.00 . A A . 10 ILE N 1 1
4 742 1 1 10 ILE O O -1.159 4.429 4.346 1.00 . A A . 10 ILE O 1 1
4 743 1 1 11 GLU C C 1.640 7.406 3.505 1.00 . A A . 11 GLU C 1 1
4 744 1 1 11 GLU CA C 1.053 6.179 4.286 1.00 . A A . 11 GLU CA 1 1
4 745 1 1 11 GLU CB C 1.979 5.612 5.407 1.00 . A A . 11 GLU CB 1 1
4 746 1 1 11 GLU CD C 3.050 3.320 4.750 1.00 . A A . 11 GLU CD 1 1
4 747 1 1 11 GLU CG C 3.255 4.823 5.026 1.00 . A A . 11 GLU CG 1 1
4 748 1 1 11 GLU H H 1.305 4.937 2.493 1.00 . A A . 11 GLU H 1 1
4 749 1 1 11 GLU HA H 0.162 6.474 4.875 1.00 . A A . 11 GLU HA 1 1
4 750 1 1 11 GLU HB2 H 2.289 6.466 6.040 1.00 . A A . 11 GLU HB2 1 1
4 751 1 1 11 GLU HB3 H 1.369 4.992 6.093 1.00 . A A . 11 GLU HB3 1 1
4 752 1 1 11 GLU HG2 H 3.740 5.287 4.145 1.00 . A A . 11 GLU HG2 1 1
4 753 1 1 11 GLU HG3 H 4.013 4.952 5.821 1.00 . A A . 11 GLU HG3 1 1
4 754 1 1 11 GLU N N 0.668 5.175 3.262 1.00 . A A . 11 GLU N 1 1
4 755 1 1 11 GLU O O 2.848 7.423 3.247 1.00 . A A . 11 GLU O 1 1
4 756 1 1 11 GLU OE1 O 3.045 2.924 3.583 1.00 . A A . 11 GLU OE1 1 1
4 757 1 1 12 THR C C 1.949 10.697 3.343 1.00 . A A . 12 THR C 1 1
4 758 1 1 12 THR CA C 1.373 9.617 2.349 1.00 . A A . 12 THR CA 1 1
4 759 1 1 12 THR CB C 0.307 10.208 1.360 1.00 . A A . 12 THR CB 1 1
4 760 1 1 12 THR CG2 C 0.894 11.169 0.298 1.00 . A A . 12 THR CG2 1 1
4 761 1 1 12 THR H H -0.179 8.307 3.215 1.00 . A A . 12 THR H 1 1
4 762 1 1 12 THR HA H 2.189 9.271 1.680 1.00 . A A . 12 THR HA 1 1
4 763 1 1 12 THR HB H -0.459 10.760 1.938 1.00 . A A . 12 THR HB 1 1
4 764 1 1 12 THR HG1 H -1.018 9.624 0.092 1.00 . A A . 12 THR HG1 1 1
4 765 1 1 12 THR HG21 H 1.397 12.046 0.749 1.00 . A A . 12 THR HG21 1 1
4 766 1 1 12 THR HG22 H 1.640 10.674 -0.353 1.00 . A A . 12 THR HG22 1 1
4 767 1 1 12 THR HG23 H 0.111 11.575 -0.372 1.00 . A A . 12 THR HG23 1 1
4 768 1 1 12 THR N N 0.836 8.431 3.104 1.00 . A A . 12 THR N 1 1
4 769 1 1 12 THR O O 1.407 11.804 3.449 1.00 . A A . 12 THR O 1 1
4 770 1 1 12 THR OG1 O -0.367 9.179 0.640 1.00 . A A . 12 THR OG1 1 1
4 771 1 1 13 THR C C 5.220 11.128 4.963 1.00 . A A . 13 THR C 1 1
4 772 1 1 13 THR CA C 3.676 11.334 5.043 1.00 . A A . 13 THR CA 1 1
4 773 1 1 13 THR CB C 3.044 11.217 6.471 1.00 . A A . 13 THR CB 1 1
4 774 1 1 13 THR CG2 C 3.594 12.237 7.482 1.00 . A A . 13 THR CG2 1 1
4 775 1 1 13 THR H H 3.331 9.405 4.075 1.00 . A A . 13 THR H 1 1
4 776 1 1 13 THR HA H 3.495 12.372 4.698 1.00 . A A . 13 THR HA 1 1
4 777 1 1 13 THR HB H 3.224 10.201 6.872 1.00 . A A . 13 THR HB 1 1
4 778 1 1 13 THR HG1 H 1.499 12.248 5.956 1.00 . A A . 13 THR HG1 1 1
4 779 1 1 13 THR HG21 H 3.105 12.129 8.465 1.00 . A A . 13 THR HG21 1 1
4 780 1 1 13 THR HG22 H 4.681 12.108 7.645 1.00 . A A . 13 THR HG22 1 1
4 781 1 1 13 THR HG23 H 3.431 13.277 7.144 1.00 . A A . 13 THR HG23 1 1
4 782 1 1 13 THR N N 3.046 10.390 4.077 1.00 . A A . 13 THR N 1 1
4 783 1 1 13 THR O O 5.903 11.946 4.337 1.00 . A A . 13 THR O 1 1
4 784 1 1 13 THR OG1 O 1.634 11.417 6.419 1.00 . A A . 13 THR OG1 1 1
4 785 1 1 14 ALA C C 7.614 8.960 4.300 1.00 . A A . 14 ALA C 1 1
4 786 1 1 14 ALA CA C 7.224 9.768 5.558 1.00 . A A . 14 ALA CA 1 1
4 787 1 1 14 ALA CB C 7.590 9.049 6.869 1.00 . A A . 14 ALA CB 1 1
4 788 1 1 14 ALA H H 5.102 9.440 6.052 1.00 . A A . 14 ALA H 1 1
4 789 1 1 14 ALA HXT H 7.869 10.707 3.482 1.00 . A A . 14 ALA HXT 1 1
4 790 1 1 14 ALA HA H 7.794 10.718 5.554 1.00 . A A . 14 ALA HA 1 1
4 791 1 1 14 ALA HB1 H 8.675 8.837 6.924 1.00 . A A . 14 ALA HB1 1 1
4 792 1 1 14 ALA HB2 H 7.341 9.660 7.757 1.00 . A A . 14 ALA HB2 1 1
4 793 1 1 14 ALA HB3 H 7.066 8.080 6.979 1.00 . A A . 14 ALA HB3 1 1
4 794 1 1 14 ALA N N 5.769 10.051 5.569 1.00 . A A . 14 ALA N 1 1
4 795 1 1 14 ALA O O 7.606 7.730 4.236 1.00 . A A . 14 ALA O 1 1
4 796 1 1 14 ALA OXT O 7.957 9.779 3.254 1.00 . A A . 14 ALA OXT 1 1
5 797 1 1 1 ACE C C 5.861 10.043 1.463 1.00 . A A . 1 ACE C 1 1
5 798 1 1 1 ACE CH3 C 4.905 11.216 1.271 1.00 . A A . 1 ACE CH3 1 1
5 799 1 1 1 ACE H1 H 5.444 12.116 0.923 1.00 . A A . 1 ACE H1 1 1
5 800 1 1 1 ACE H2 H 4.132 10.985 0.517 1.00 . A A . 1 ACE H2 1 1
5 801 1 1 1 ACE H3 H 4.394 11.485 2.214 1.00 . A A . 1 ACE H3 1 1
5 802 1 1 1 ACE O O 7.046 10.154 1.148 1.00 . A A . 1 ACE O 1 1
5 803 1 1 2 ILE C C 5.369 6.524 1.496 1.00 . A A . 2 ILE C 1 1
5 804 1 1 2 ILE CA C 6.092 7.682 2.247 1.00 . A A . 2 ILE CA 1 1
5 805 1 1 2 ILE CB C 6.294 7.416 3.788 1.00 . A A . 2 ILE CB 1 1
5 806 1 1 2 ILE CD1 C 8.438 8.920 4.194 1.00 . A A . 2 ILE CD1 1 1
5 807 1 1 2 ILE CG1 C 6.991 8.562 4.582 1.00 . A A . 2 ILE CG1 1 1
5 808 1 1 2 ILE CG2 C 6.994 6.070 4.116 1.00 . A A . 2 ILE CG2 1 1
5 809 1 1 2 ILE H H 4.307 8.987 2.145 1.00 . A A . 2 ILE H 1 1
5 810 1 1 2 ILE HA H 7.091 7.779 1.782 1.00 . A A . 2 ILE HA 1 1
5 811 1 1 2 ILE HB H 5.283 7.334 4.229 1.00 . A A . 2 ILE HB 1 1
5 812 1 1 2 ILE HD11 H 8.521 9.228 3.137 1.00 . A A . 2 ILE HD11 1 1
5 813 1 1 2 ILE HD12 H 8.811 9.763 4.806 1.00 . A A . 2 ILE HD12 1 1
5 814 1 1 2 ILE HD13 H 9.130 8.073 4.352 1.00 . A A . 2 ILE HD13 1 1
5 815 1 1 2 ILE HG12 H 6.377 9.476 4.497 1.00 . A A . 2 ILE HG12 1 1
5 816 1 1 2 ILE HG13 H 6.970 8.328 5.664 1.00 . A A . 2 ILE HG13 1 1
5 817 1 1 2 ILE HG21 H 6.416 5.202 3.751 1.00 . A A . 2 ILE HG21 1 1
5 818 1 1 2 ILE HG22 H 8.000 6.004 3.661 1.00 . A A . 2 ILE HG22 1 1
5 819 1 1 2 ILE HG23 H 7.115 5.919 5.205 1.00 . A A . 2 ILE HG23 1 1
5 820 1 1 2 ILE N N 5.319 8.936 1.985 1.00 . A A . 2 ILE N 1 1
5 821 1 1 2 ILE O O 4.139 6.390 1.529 1.00 . A A . 2 ILE O 1 1
5 822 1 1 3 TRP C C 6.355 3.198 0.486 1.00 . A A . 3 TRP C 1 1
5 823 1 1 3 TRP CA C 5.645 4.515 0.043 1.00 . A A . 3 TRP CA 1 1
5 824 1 1 3 TRP CB C 5.771 4.811 -1.484 1.00 . A A . 3 TRP CB 1 1
5 825 1 1 3 TRP CD1 C 3.895 6.563 -2.058 1.00 . A A . 3 TRP CD1 1 1
5 826 1 1 3 TRP CD2 C 5.970 7.346 -2.118 1.00 . A A . 3 TRP CD2 1 1
5 827 1 1 3 TRP CE2 C 5.059 8.405 -2.358 1.00 . A A . 3 TRP CE2 1 1
5 828 1 1 3 TRP CE3 C 7.343 7.618 -1.895 1.00 . A A . 3 TRP CE3 1 1
5 829 1 1 3 TRP CG C 5.243 6.179 -1.963 1.00 . A A . 3 TRP CG 1 1
5 830 1 1 3 TRP CH2 C 6.886 9.986 -2.235 1.00 . A A . 3 TRP CH2 1 1
5 831 1 1 3 TRP CZ2 C 5.523 9.741 -2.413 1.00 . A A . 3 TRP CZ2 1 1
5 832 1 1 3 TRP CZ3 C 7.782 8.941 -1.974 1.00 . A A . 3 TRP CZ3 1 1
5 833 1 1 3 TRP H H 7.170 5.891 0.870 1.00 . A A . 3 TRP H 1 1
5 834 1 1 3 TRP HA H 4.564 4.366 0.241 1.00 . A A . 3 TRP HA 1 1
5 835 1 1 3 TRP HB2 H 6.829 4.714 -1.794 1.00 . A A . 3 TRP HB2 1 1
5 836 1 1 3 TRP HB3 H 5.250 4.014 -2.049 1.00 . A A . 3 TRP HB3 1 1
5 837 1 1 3 TRP HD1 H 3.084 5.929 -1.744 1.00 . A A . 3 TRP HD1 1 1
5 838 1 1 3 TRP HE1 H 2.895 8.487 -2.361 1.00 . A A . 3 TRP HE1 1 1
5 839 1 1 3 TRP HE3 H 8.014 6.821 -1.600 1.00 . A A . 3 TRP HE3 1 1
5 840 1 1 3 TRP HH2 H 7.250 11.002 -2.264 1.00 . A A . 3 TRP HH2 1 1
5 841 1 1 3 TRP HZ2 H 4.834 10.560 -2.560 1.00 . A A . 3 TRP HZ2 1 1
5 842 1 1 3 TRP HZ3 H 8.823 9.166 -1.794 1.00 . A A . 3 TRP HZ3 1 1
5 843 1 1 3 TRP N N 6.169 5.668 0.835 1.00 . A A . 3 TRP N 1 1
5 844 1 1 3 TRP NE1 N 3.758 7.932 -2.351 1.00 . A A . 3 TRP NE1 1 1
5 845 1 1 3 TRP O O 7.045 2.531 -0.293 1.00 . A A . 3 TRP O 1 1
5 846 1 1 4 GLY C C 6.222 1.393 3.783 1.00 . A A . 4 GLY C 1 1
5 847 1 1 4 GLY CA C 6.745 1.622 2.355 1.00 . A A . 4 GLY CA 1 1
5 848 1 1 4 GLY H H 5.698 3.547 2.324 1.00 . A A . 4 GLY H 1 1
5 849 1 1 4 GLY HA2 H 6.551 0.743 1.713 1.00 . A A . 4 GLY HA2 1 1
5 850 1 1 4 GLY HA3 H 7.842 1.749 2.393 1.00 . A A . 4 GLY HA3 1 1
5 851 1 1 4 GLY N N 6.148 2.826 1.759 1.00 . A A . 4 GLY N 1 1
5 852 1 1 4 GLY O O 6.806 1.893 4.746 1.00 . A A . 4 GLY O 1 1
5 853 1 1 5 . C C 3.150 1.129 5.456 1.00 . A A . 5 SET C 1 1
5 854 1 1 5 . CA C 4.469 0.304 5.192 1.00 . A A . 5 SET CA 1 1
5 855 1 1 5 . CB C 4.158 -1.226 5.157 1.00 . A A . 5 SET CB 1 1
5 856 1 1 5 . H H 4.728 0.318 2.999 1.00 . A A . 5 SET H 1 1
5 857 1 1 5 . HA H 5.226 0.444 5.995 1.00 . A A . 5 SET HA 1 1
5 858 1 1 5 . HB2 H 2.392 0.872 4.691 1.00 . A A . 5 SET HB2 1 1
5 859 1 1 5 . HB3 H 2.698 0.753 6.392 1.00 . A A . 5 SET HB3 1 1
5 860 1 1 5 . HNT2 H 3.103 3.116 6.489 1.00 . A A . 5 SET HNT2 1 1
5 861 1 1 5 . N N 5.116 0.640 3.893 1.00 . A A . 5 SET N 1 1
5 862 1 1 5 . NT N 3.201 2.617 5.590 1.00 . A A . 5 SET NT 1 1
5 863 1 1 5 . OG O 3.626 -1.749 4.170 1.00 . A A . 5 SET OG 1 1
5 864 1 1 6 SER C C 2.808 -3.915 6.174 1.00 . A A . 6 SER C 1 1
5 865 1 1 6 SER CA C 4.268 -3.408 6.388 1.00 . A A . 6 SER CA 1 1
5 866 1 1 6 SER CB C 4.824 -3.868 7.757 1.00 . A A . 6 SER CB 1 1
5 867 1 1 6 SER H H 4.836 -1.387 7.049 1.00 . A A . 6 SER H 1 1
5 868 1 1 6 SER HA H 4.935 -3.867 5.631 1.00 . A A . 6 SER HA 1 1
5 869 1 1 6 SER HB2 H 4.796 -4.972 7.829 1.00 . A A . 6 SER HB2 1 1
5 870 1 1 6 SER HB3 H 5.893 -3.600 7.858 1.00 . A A . 6 SER HB3 1 1
5 871 1 1 6 SER HG H 3.170 -3.491 8.679 1.00 . A A . 6 SER HG 1 1
5 872 1 1 6 SER N N 4.463 -1.935 6.265 1.00 . A A . 6 SER N 1 1
5 873 1 1 6 SER O O 1.887 -3.480 6.874 1.00 . A A . 6 SER O 1 1
5 874 1 1 6 SER OG O 4.099 -3.313 8.854 1.00 . A A . 6 SER OG 1 1
5 875 1 1 7 GLY C C 0.572 -4.634 3.754 1.00 . A A . 7 GLY C 1 1
5 876 1 1 7 GLY CA C 1.285 -5.397 4.886 1.00 . A A . 7 GLY CA 1 1
5 877 1 1 7 GLY H H 3.447 -5.083 4.657 1.00 . A A . 7 GLY H 1 1
5 878 1 1 7 GLY HA2 H 1.420 -6.449 4.571 1.00 . A A . 7 GLY HA2 1 1
5 879 1 1 7 GLY HA3 H 0.640 -5.459 5.785 1.00 . A A . 7 GLY HA3 1 1
5 880 1 1 7 GLY N N 2.618 -4.832 5.204 1.00 . A A . 7 GLY N 1 1
5 881 1 1 7 GLY O O 0.565 -5.082 2.604 1.00 . A A . 7 GLY O 1 1
5 882 1 1 8 LYS C C 0.025 -1.275 3.117 1.00 . A A . 8 LYS C 1 1
5 883 1 1 8 LYS CA C -0.764 -2.612 3.185 1.00 . A A . 8 LYS CA 1 1
5 884 1 1 8 LYS CB C -2.213 -2.443 3.718 1.00 . A A . 8 LYS CB 1 1
5 885 1 1 8 LYS CD C -3.509 -2.245 1.458 1.00 . A A . 8 LYS CD 1 1
5 886 1 1 8 LYS CE C -2.607 -1.801 0.287 1.00 . A A . 8 LYS CE 1 1
5 887 1 1 8 LYS CG C -3.190 -1.628 2.839 1.00 . A A . 8 LYS CG 1 1
5 888 1 1 8 LYS H H 0.192 -3.136 5.034 1.00 . A A . 8 LYS H 1 1
5 889 1 1 8 LYS HA H -0.825 -3.092 2.189 1.00 . A A . 8 LYS HA 1 1
5 890 1 1 8 LYS HB2 H -2.663 -3.441 3.887 1.00 . A A . 8 LYS HB2 1 1
5 891 1 1 8 LYS HB3 H -2.188 -1.978 4.723 1.00 . A A . 8 LYS HB3 1 1
5 892 1 1 8 LYS HD2 H -3.466 -3.348 1.544 1.00 . A A . 8 LYS HD2 1 1
5 893 1 1 8 LYS HD3 H -4.565 -2.033 1.207 1.00 . A A . 8 LYS HD3 1 1
5 894 1 1 8 LYS HE2 H -1.540 -1.911 0.545 1.00 . A A . 8 LYS HE2 1 1
5 895 1 1 8 LYS HE3 H -2.761 -2.491 -0.563 1.00 . A A . 8 LYS HE3 1 1
5 896 1 1 8 LYS HG2 H -4.139 -1.538 3.401 1.00 . A A . 8 LYS HG2 1 1
5 897 1 1 8 LYS HG3 H -2.833 -0.587 2.732 1.00 . A A . 8 LYS HG3 1 1
5 898 1 1 8 LYS HZ1 H -3.838 -0.276 -0.447 1.00 . A A . 8 LYS HZ1 1 1
5 899 1 1 8 LYS HZ2 H -2.690 0.263 0.605 1.00 . A A . 8 LYS HZ2 1 1
5 900 1 1 8 LYS HZ3 H -2.267 -0.133 -0.936 1.00 . A A . 8 LYS HZ3 1 1
5 901 1 1 8 LYS N N -0.037 -3.492 4.111 1.00 . A A . 8 LYS N 1 1
5 902 1 1 8 LYS NZ N -2.865 -0.411 -0.149 1.00 . A A . 8 LYS NZ 1 1
5 903 1 1 8 LYS O O 0.064 -0.500 4.080 1.00 . A A . 8 LYS O 1 1
5 904 1 1 9 LEU C C 0.455 1.402 1.437 1.00 . A A . 9 LEU C 1 1
5 905 1 1 9 LEU CA C 1.433 0.207 1.683 1.00 . A A . 9 LEU CA 1 1
5 906 1 1 9 LEU CB C 2.405 0.007 0.478 1.00 . A A . 9 LEU CB 1 1
5 907 1 1 9 LEU CD1 C 3.404 -2.383 0.745 1.00 . A A . 9 LEU CD1 1 1
5 908 1 1 9 LEU CD2 C 4.723 -0.581 -0.406 1.00 . A A . 9 LEU CD2 1 1
5 909 1 1 9 LEU CG C 3.677 -0.866 0.692 1.00 . A A . 9 LEU CG 1 1
5 910 1 1 9 LEU H H 0.655 -1.850 1.343 1.00 . A A . 9 LEU H 1 1
5 911 1 1 9 LEU HA H 2.069 0.432 2.560 1.00 . A A . 9 LEU HA 1 1
5 912 1 1 9 LEU HB2 H 1.848 -0.350 -0.410 1.00 . A A . 9 LEU HB2 1 1
5 913 1 1 9 LEU HB3 H 2.754 1.017 0.187 1.00 . A A . 9 LEU HB3 1 1
5 914 1 1 9 LEU HD11 H 2.898 -2.748 -0.167 1.00 . A A . 9 LEU HD11 1 1
5 915 1 1 9 LEU HD12 H 4.341 -2.962 0.853 1.00 . A A . 9 LEU HD12 1 1
5 916 1 1 9 LEU HD13 H 2.776 -2.662 1.609 1.00 . A A . 9 LEU HD13 1 1
5 917 1 1 9 LEU HD21 H 5.661 -1.144 -0.238 1.00 . A A . 9 LEU HD21 1 1
5 918 1 1 9 LEU HD22 H 4.357 -0.851 -1.415 1.00 . A A . 9 LEU HD22 1 1
5 919 1 1 9 LEU HD23 H 5.005 0.488 -0.437 1.00 . A A . 9 LEU HD23 1 1
5 920 1 1 9 LEU HG H 4.136 -0.578 1.652 1.00 . A A . 9 LEU HG 1 1
5 921 1 1 9 LEU N N 0.640 -1.025 1.951 1.00 . A A . 9 LEU N 1 1
5 922 1 1 9 LEU O O -0.039 1.598 0.321 1.00 . A A . 9 LEU O 1 1
5 923 1 1 10 ILE C C -0.372 4.374 3.540 1.00 . A A . 10 ILE C 1 1
5 924 1 1 10 ILE CA C -0.770 3.334 2.443 1.00 . A A . 10 ILE CA 1 1
5 925 1 1 10 ILE CB C -2.280 2.868 2.434 1.00 . A A . 10 ILE CB 1 1
5 926 1 1 10 ILE CD1 C -3.159 4.509 0.622 1.00 . A A . 10 ILE CD1 1 1
5 927 1 1 10 ILE CG1 C -3.287 3.991 2.064 1.00 . A A . 10 ILE CG1 1 1
5 928 1 1 10 ILE CG2 C -2.764 2.143 3.717 1.00 . A A . 10 ILE CG2 1 1
5 929 1 1 10 ILE H H 0.566 1.866 3.390 1.00 . A A . 10 ILE H 1 1
5 930 1 1 10 ILE HA H -0.594 3.831 1.469 1.00 . A A . 10 ILE HA 1 1
5 931 1 1 10 ILE HB H -2.372 2.112 1.632 1.00 . A A . 10 ILE HB 1 1
5 932 1 1 10 ILE HD11 H -2.198 5.026 0.452 1.00 . A A . 10 ILE HD11 1 1
5 933 1 1 10 ILE HD12 H -3.228 3.685 -0.111 1.00 . A A . 10 ILE HD12 1 1
5 934 1 1 10 ILE HD13 H -3.963 5.229 0.388 1.00 . A A . 10 ILE HD13 1 1
5 935 1 1 10 ILE HG12 H -4.322 3.622 2.188 1.00 . A A . 10 ILE HG12 1 1
5 936 1 1 10 ILE HG13 H -3.198 4.838 2.772 1.00 . A A . 10 ILE HG13 1 1
5 937 1 1 10 ILE HG21 H -2.867 2.824 4.580 1.00 . A A . 10 ILE HG21 1 1
5 938 1 1 10 ILE HG22 H -3.753 1.669 3.567 1.00 . A A . 10 ILE HG22 1 1
5 939 1 1 10 ILE HG23 H -2.071 1.337 4.022 1.00 . A A . 10 ILE HG23 1 1
5 940 1 1 10 ILE N N 0.156 2.170 2.504 1.00 . A A . 10 ILE N 1 1
5 941 1 1 10 ILE O O -0.963 4.427 4.622 1.00 . A A . 10 ILE O 1 1
5 942 1 1 11 GLU C C 1.700 7.496 3.407 1.00 . A A . 11 GLU C 1 1
5 943 1 1 11 GLU CA C 1.136 6.258 4.193 1.00 . A A . 11 GLU CA 1 1
5 944 1 1 11 GLU CB C 2.095 5.673 5.278 1.00 . A A . 11 GLU CB 1 1
5 945 1 1 11 GLU CD C 3.276 3.445 4.528 1.00 . A A . 11 GLU CD 1 1
5 946 1 1 11 GLU CG C 3.392 4.954 4.821 1.00 . A A . 11 GLU CG 1 1
5 947 1 1 11 GLU H H 1.133 5.008 2.370 1.00 . A A . 11 GLU H 1 1
5 948 1 1 11 GLU HA H 0.279 6.639 4.785 1.00 . A A . 11 GLU HA 1 1
5 949 1 1 11 GLU HB2 H 2.393 6.509 5.941 1.00 . A A . 11 GLU HB2 1 1
5 950 1 1 11 GLU HB3 H 1.522 5.007 5.951 1.00 . A A . 11 GLU HB3 1 1
5 951 1 1 11 GLU HG2 H 3.797 5.464 3.926 1.00 . A A . 11 GLU HG2 1 1
5 952 1 1 11 GLU HG3 H 4.182 5.113 5.580 1.00 . A A . 11 GLU HG3 1 1
5 953 1 1 11 GLU N N 0.652 5.201 3.255 1.00 . A A . 11 GLU N 1 1
5 954 1 1 11 GLU O O 2.806 7.963 3.692 1.00 . A A . 11 GLU O 1 1
5 955 1 1 11 GLU OE1 O 3.357 3.053 3.361 1.00 . A A . 11 GLU OE1 1 1
5 956 1 1 12 THR C C 0.997 10.587 2.373 1.00 . A A . 12 THR C 1 1
5 957 1 1 12 THR CA C 1.370 9.249 1.638 1.00 . A A . 12 THR CA 1 1
5 958 1 1 12 THR CB C 0.817 9.159 0.173 1.00 . A A . 12 THR CB 1 1
5 959 1 1 12 THR CG2 C 1.407 10.201 -0.802 1.00 . A A . 12 THR CG2 1 1
5 960 1 1 12 THR H H 0.024 7.604 2.304 1.00 . A A . 12 THR H 1 1
5 961 1 1 12 THR HA H 2.469 9.191 1.490 1.00 . A A . 12 THR HA 1 1
5 962 1 1 12 THR HB H -0.283 9.299 0.179 1.00 . A A . 12 THR HB 1 1
5 963 1 1 12 THR HG1 H 0.718 7.887 -1.271 1.00 . A A . 12 THR HG1 1 1
5 964 1 1 12 THR HG21 H 1.200 11.240 -0.486 1.00 . A A . 12 THR HG21 1 1
5 965 1 1 12 THR HG22 H 2.504 10.108 -0.900 1.00 . A A . 12 THR HG22 1 1
5 966 1 1 12 THR HG23 H 0.988 10.096 -1.820 1.00 . A A . 12 THR HG23 1 1
5 967 1 1 12 THR N N 0.923 8.075 2.457 1.00 . A A . 12 THR N 1 1
5 968 1 1 12 THR O O 0.049 11.267 1.968 1.00 . A A . 12 THR O 1 1
5 969 1 1 12 THR OG1 O 1.096 7.878 -0.389 1.00 . A A . 12 THR OG1 1 1
5 970 1 1 13 THR C C 2.813 12.936 4.451 1.00 . A A . 13 THR C 1 1
5 971 1 1 13 THR CA C 1.447 12.219 4.217 1.00 . A A . 13 THR CA 1 1
5 972 1 1 13 THR CB C 0.557 11.946 5.474 1.00 . A A . 13 THR CB 1 1
5 973 1 1 13 THR CG2 C 0.178 13.208 6.268 1.00 . A A . 13 THR CG2 1 1
5 974 1 1 13 THR H H 2.321 10.242 3.871 1.00 . A A . 13 THR H 1 1
5 975 1 1 13 THR HA H 0.866 12.917 3.580 1.00 . A A . 13 THR HA 1 1
5 976 1 1 13 THR HB H 1.083 11.252 6.156 1.00 . A A . 13 THR HB 1 1
5 977 1 1 13 THR HG1 H -0.432 10.648 4.450 1.00 . A A . 13 THR HG1 1 1
5 978 1 1 13 THR HG21 H -0.470 12.960 7.128 1.00 . A A . 13 THR HG21 1 1
5 979 1 1 13 THR HG22 H 1.067 13.725 6.673 1.00 . A A . 13 THR HG22 1 1
5 980 1 1 13 THR HG23 H -0.373 13.936 5.642 1.00 . A A . 13 THR HG23 1 1
5 981 1 1 13 THR N N 1.717 10.962 3.457 1.00 . A A . 13 THR N 1 1
5 982 1 1 13 THR O O 3.169 13.808 3.652 1.00 . A A . 13 THR O 1 1
5 983 1 1 13 THR OG1 O -0.668 11.333 5.081 1.00 . A A . 13 THR OG1 1 1
5 984 1 1 14 ALA C C 6.034 12.238 5.455 1.00 . A A . 14 ALA C 1 1
5 985 1 1 14 ALA CA C 4.885 13.203 5.815 1.00 . A A . 14 ALA CA 1 1
5 986 1 1 14 ALA CB C 4.884 13.619 7.299 1.00 . A A . 14 ALA CB 1 1
5 987 1 1 14 ALA H H 3.174 11.841 6.099 1.00 . A A . 14 ALA H 1 1
5 988 1 1 14 ALA HXT H 5.854 12.978 3.663 1.00 . A A . 14 ALA HXT 1 1
5 989 1 1 14 ALA HA H 5.029 14.134 5.233 1.00 . A A . 14 ALA HA 1 1
5 990 1 1 14 ALA HB1 H 5.834 14.112 7.580 1.00 . A A . 14 ALA HB1 1 1
5 991 1 1 14 ALA HB2 H 4.075 14.340 7.523 1.00 . A A . 14 ALA HB2 1 1
5 992 1 1 14 ALA HB3 H 4.754 12.756 7.980 1.00 . A A . 14 ALA HB3 1 1
5 993 1 1 14 ALA N N 3.577 12.573 5.505 1.00 . A A . 14 ALA N 1 1
5 994 1 1 14 ALA O O 6.567 11.465 6.253 1.00 . A A . 14 ALA O 1 1
5 995 1 1 14 ALA OXT O 6.392 12.337 4.133 1.00 . A A . 14 ALA OXT 1 1
6 996 1 1 1 ACE C C 4.678 6.509 -4.106 1.00 . A A . 1 ACE C 1 1
6 997 1 1 1 ACE CH3 C 3.566 7.206 -4.883 1.00 . A A . 1 ACE CH3 1 1
6 998 1 1 1 ACE H1 H 3.916 8.160 -5.319 1.00 . A A . 1 ACE H1 1 1
6 999 1 1 1 ACE H2 H 3.209 6.573 -5.717 1.00 . A A . 1 ACE H2 1 1
6 1000 1 1 1 ACE H3 H 2.693 7.423 -4.241 1.00 . A A . 1 ACE H3 1 1
6 1001 1 1 1 ACE O O 5.130 5.429 -4.495 1.00 . A A . 1 ACE O 1 1
6 1002 1 1 2 ILE C C 5.469 6.207 -0.804 1.00 . A A . 2 ILE C 1 1
6 1003 1 1 2 ILE CA C 6.182 6.633 -2.120 1.00 . A A . 2 ILE CA 1 1
6 1004 1 1 2 ILE CB C 7.352 7.669 -1.921 1.00 . A A . 2 ILE CB 1 1
6 1005 1 1 2 ILE CD1 C 8.699 7.057 -4.118 1.00 . A A . 2 ILE CD1 1 1
6 1006 1 1 2 ILE CG1 C 8.059 8.142 -3.232 1.00 . A A . 2 ILE CG1 1 1
6 1007 1 1 2 ILE CG2 C 8.425 7.186 -0.911 1.00 . A A . 2 ILE CG2 1 1
6 1008 1 1 2 ILE H H 4.508 7.950 -2.747 1.00 . A A . 2 ILE H 1 1
6 1009 1 1 2 ILE HA H 6.640 5.733 -2.575 1.00 . A A . 2 ILE HA 1 1
6 1010 1 1 2 ILE HB H 6.908 8.578 -1.471 1.00 . A A . 2 ILE HB 1 1
6 1011 1 1 2 ILE HD11 H 7.951 6.333 -4.489 1.00 . A A . 2 ILE HD11 1 1
6 1012 1 1 2 ILE HD12 H 9.182 7.505 -5.007 1.00 . A A . 2 ILE HD12 1 1
6 1013 1 1 2 ILE HD13 H 9.478 6.488 -3.580 1.00 . A A . 2 ILE HD13 1 1
6 1014 1 1 2 ILE HG12 H 7.340 8.709 -3.851 1.00 . A A . 2 ILE HG12 1 1
6 1015 1 1 2 ILE HG13 H 8.840 8.889 -2.982 1.00 . A A . 2 ILE HG13 1 1
6 1016 1 1 2 ILE HG21 H 7.995 7.006 0.090 1.00 . A A . 2 ILE HG21 1 1
6 1017 1 1 2 ILE HG22 H 8.905 6.243 -1.231 1.00 . A A . 2 ILE HG22 1 1
6 1018 1 1 2 ILE HG23 H 9.228 7.934 -0.771 1.00 . A A . 2 ILE HG23 1 1
6 1019 1 1 2 ILE N N 5.103 7.157 -3.013 1.00 . A A . 2 ILE N 1 1
6 1020 1 1 2 ILE O O 4.944 7.054 -0.072 1.00 . A A . 2 ILE O 1 1
6 1021 1 1 3 TRP C C 5.591 3.081 1.158 1.00 . A A . 3 TRP C 1 1
6 1022 1 1 3 TRP CA C 4.798 4.333 0.689 1.00 . A A . 3 TRP CA 1 1
6 1023 1 1 3 TRP CB C 3.284 3.963 0.541 1.00 . A A . 3 TRP CB 1 1
6 1024 1 1 3 TRP CD1 C 1.795 5.720 -0.708 1.00 . A A . 3 TRP CD1 1 1
6 1025 1 1 3 TRP CD2 C 2.340 3.919 -1.880 1.00 . A A . 3 TRP CD2 1 1
6 1026 1 1 3 TRP CE2 C 1.551 4.778 -2.682 1.00 . A A . 3 TRP CE2 1 1
6 1027 1 1 3 TRP CE3 C 2.908 2.741 -2.419 1.00 . A A . 3 TRP CE3 1 1
6 1028 1 1 3 TRP CG C 2.477 4.497 -0.640 1.00 . A A . 3 TRP CG 1 1
6 1029 1 1 3 TRP CH2 C 1.860 3.275 -4.554 1.00 . A A . 3 TRP CH2 1 1
6 1030 1 1 3 TRP CZ2 C 1.306 4.450 -4.037 1.00 . A A . 3 TRP CZ2 1 1
6 1031 1 1 3 TRP CZ3 C 2.650 2.434 -3.757 1.00 . A A . 3 TRP CZ3 1 1
6 1032 1 1 3 TRP H H 6.032 4.297 -1.129 1.00 . A A . 3 TRP H 1 1
6 1033 1 1 3 TRP HA H 4.825 5.117 1.473 1.00 . A A . 3 TRP HA 1 1
6 1034 1 1 3 TRP HB2 H 3.133 2.868 0.558 1.00 . A A . 3 TRP HB2 1 1
6 1035 1 1 3 TRP HB3 H 2.777 4.284 1.464 1.00 . A A . 3 TRP HB3 1 1
6 1036 1 1 3 TRP HD1 H 1.825 6.450 0.084 1.00 . A A . 3 TRP HD1 1 1
6 1037 1 1 3 TRP HE1 H 0.680 6.736 -2.301 1.00 . A A . 3 TRP HE1 1 1
6 1038 1 1 3 TRP HE3 H 3.556 2.122 -1.809 1.00 . A A . 3 TRP HE3 1 1
6 1039 1 1 3 TRP HH2 H 1.687 3.019 -5.589 1.00 . A A . 3 TRP HH2 1 1
6 1040 1 1 3 TRP HZ2 H 0.722 5.106 -4.667 1.00 . A A . 3 TRP HZ2 1 1
6 1041 1 1 3 TRP HZ3 H 3.081 1.543 -4.189 1.00 . A A . 3 TRP HZ3 1 1
6 1042 1 1 3 TRP N N 5.463 4.890 -0.518 1.00 . A A . 3 TRP N 1 1
6 1043 1 1 3 TRP NE1 N 1.191 5.912 -1.965 1.00 . A A . 3 TRP NE1 1 1
6 1044 1 1 3 TRP O O 5.637 2.061 0.463 1.00 . A A . 3 TRP O 1 1
6 1045 1 1 4 GLY C C 6.279 1.656 4.296 1.00 . A A . 4 GLY C 1 1
6 1046 1 1 4 GLY CA C 6.954 2.079 2.977 1.00 . A A . 4 GLY CA 1 1
6 1047 1 1 4 GLY H H 6.128 4.112 2.754 1.00 . A A . 4 GLY H 1 1
6 1048 1 1 4 GLY HA2 H 7.090 1.210 2.305 1.00 . A A . 4 GLY HA2 1 1
6 1049 1 1 4 GLY HA3 H 7.975 2.446 3.194 1.00 . A A . 4 GLY HA3 1 1
6 1050 1 1 4 GLY N N 6.189 3.178 2.347 1.00 . A A . 4 GLY N 1 1
6 1051 1 1 4 GLY O O 6.677 2.123 5.367 1.00 . A A . 4 GLY O 1 1
6 1052 1 1 5 . C C 3.093 1.009 5.564 1.00 . A A . 5 SET C 1 1
6 1053 1 1 5 . CA C 4.491 0.289 5.388 1.00 . A A . 5 SET CA 1 1
6 1054 1 1 5 . CB C 4.279 -1.244 5.216 1.00 . A A . 5 SET CB 1 1
6 1055 1 1 5 . H H 5.014 0.509 3.247 1.00 . A A . 5 SET H 1 1
6 1056 1 1 5 . HA H 5.144 0.402 6.284 1.00 . A A . 5 SET HA 1 1
6 1057 1 1 5 . HB2 H 2.416 0.705 4.741 1.00 . A A . 5 SET HB2 1 1
6 1058 1 1 5 . HB3 H 2.596 0.599 6.463 1.00 . A A . 5 SET HB3 1 1
6 1059 1 1 5 . HNT2 H 2.934 3.012 6.576 1.00 . A A . 5 SET HNT2 1 1
6 1060 1 1 5 . N N 5.261 0.778 4.205 1.00 . A A . 5 SET N 1 1
6 1061 1 1 5 . NT N 3.026 2.501 5.683 1.00 . A A . 5 SET NT 1 1
6 1062 1 1 5 . OG O 3.894 -1.718 4.141 1.00 . A A . 5 SET OG 1 1
6 1063 1 1 6 SER C C 2.904 -4.018 6.062 1.00 . A A . 6 SER C 1 1
6 1064 1 1 6 SER CA C 4.360 -3.501 6.282 1.00 . A A . 6 SER CA 1 1
6 1065 1 1 6 SER CB C 4.987 -4.084 7.572 1.00 . A A . 6 SER CB 1 1
6 1066 1 1 6 SER H H 4.739 -1.515 7.161 1.00 . A A . 6 SER H 1 1
6 1067 1 1 6 SER HA H 5.011 -3.863 5.459 1.00 . A A . 6 SER HA 1 1
6 1068 1 1 6 SER HB2 H 4.985 -5.189 7.530 1.00 . A A . 6 SER HB2 1 1
6 1069 1 1 6 SER HB3 H 6.054 -3.798 7.647 1.00 . A A . 6 SER HB3 1 1
6 1070 1 1 6 SER HG H 4.745 -4.092 9.489 1.00 . A A . 6 SER HG 1 1
6 1071 1 1 6 SER N N 4.495 -2.018 6.300 1.00 . A A . 6 SER N 1 1
6 1072 1 1 6 SER O O 1.994 -3.679 6.826 1.00 . A A . 6 SER O 1 1
6 1073 1 1 6 SER OG O 4.306 -3.660 8.752 1.00 . A A . 6 SER OG 1 1
6 1074 1 1 7 GLY C C 0.560 -4.529 3.692 1.00 . A A . 7 GLY C 1 1
6 1075 1 1 7 GLY CA C 1.370 -5.396 4.674 1.00 . A A . 7 GLY CA 1 1
6 1076 1 1 7 GLY H H 3.511 -4.987 4.400 1.00 . A A . 7 GLY H 1 1
6 1077 1 1 7 GLY HA2 H 1.527 -6.390 4.215 1.00 . A A . 7 GLY HA2 1 1
6 1078 1 1 7 GLY HA3 H 0.782 -5.609 5.588 1.00 . A A . 7 GLY HA3 1 1
6 1079 1 1 7 GLY N N 2.700 -4.829 5.005 1.00 . A A . 7 GLY N 1 1
6 1080 1 1 7 GLY O O 0.515 -4.813 2.493 1.00 . A A . 7 GLY O 1 1
6 1081 1 1 8 LYS C C -0.098 -1.223 3.285 1.00 . A A . 8 LYS C 1 1
6 1082 1 1 8 LYS CA C -0.914 -2.536 3.463 1.00 . A A . 8 LYS CA 1 1
6 1083 1 1 8 LYS CB C -2.257 -2.369 4.224 1.00 . A A . 8 LYS CB 1 1
6 1084 1 1 8 LYS CD C -3.873 -1.942 2.195 1.00 . A A . 8 LYS CD 1 1
6 1085 1 1 8 LYS CE C -3.149 -1.304 0.992 1.00 . A A . 8 LYS CE 1 1
6 1086 1 1 8 LYS CG C -3.341 -1.483 3.570 1.00 . A A . 8 LYS CG 1 1
6 1087 1 1 8 LYS H H 0.183 -3.263 5.192 1.00 . A A . 8 LYS H 1 1
6 1088 1 1 8 LYS HA H -1.162 -2.976 2.477 1.00 . A A . 8 LYS HA 1 1
6 1089 1 1 8 LYS HB2 H -2.705 -3.368 4.400 1.00 . A A . 8 LYS HB2 1 1
6 1090 1 1 8 LYS HB3 H -2.060 -1.971 5.239 1.00 . A A . 8 LYS HB3 1 1
6 1091 1 1 8 LYS HD2 H -3.841 -3.048 2.132 1.00 . A A . 8 LYS HD2 1 1
6 1092 1 1 8 LYS HD3 H -4.946 -1.680 2.150 1.00 . A A . 8 LYS HD3 1 1
6 1093 1 1 8 LYS HE2 H -3.146 -0.201 1.088 1.00 . A A . 8 LYS HE2 1 1
6 1094 1 1 8 LYS HE3 H -2.086 -1.603 0.969 1.00 . A A . 8 LYS HE3 1 1
6 1095 1 1 8 LYS HG2 H -4.196 -1.449 4.273 1.00 . A A . 8 LYS HG2 1 1
6 1096 1 1 8 LYS HG3 H -2.993 -0.437 3.524 1.00 . A A . 8 LYS HG3 1 1
6 1097 1 1 8 LYS HZ1 H -3.318 -1.268 -1.093 1.00 . A A . 8 LYS HZ1 1 1
6 1098 1 1 8 LYS HZ2 H -3.778 -2.706 -0.425 1.00 . A A . 8 LYS HZ2 1 1
6 1099 1 1 8 LYS HZ3 H -4.772 -1.394 -0.322 1.00 . A A . 8 LYS HZ3 1 1
6 1100 1 1 8 LYS N N -0.085 -3.484 4.234 1.00 . A A . 8 LYS N 1 1
6 1101 1 1 8 LYS NZ N -3.789 -1.689 -0.283 1.00 . A A . 8 LYS NZ 1 1
6 1102 1 1 8 LYS O O 0.004 -0.394 4.195 1.00 . A A . 8 LYS O 1 1
6 1103 1 1 9 LEU C C 0.395 1.339 1.369 1.00 . A A . 9 LEU C 1 1
6 1104 1 1 9 LEU CA C 1.301 0.107 1.695 1.00 . A A . 9 LEU CA 1 1
6 1105 1 1 9 LEU CB C 2.225 -0.263 0.489 1.00 . A A . 9 LEU CB 1 1
6 1106 1 1 9 LEU CD1 C 3.208 -2.602 1.085 1.00 . A A . 9 LEU CD1 1 1
6 1107 1 1 9 LEU CD2 C 4.456 -1.064 -0.446 1.00 . A A . 9 LEU CD2 1 1
6 1108 1 1 9 LEU CG C 3.495 -1.121 0.761 1.00 . A A . 9 LEU CG 1 1
6 1109 1 1 9 LEU H H 0.420 -1.924 1.518 1.00 . A A . 9 LEU H 1 1
6 1110 1 1 9 LEU HA H 1.972 0.374 2.534 1.00 . A A . 9 LEU HA 1 1
6 1111 1 1 9 LEU HB2 H 1.629 -0.718 -0.326 1.00 . A A . 9 LEU HB2 1 1
6 1112 1 1 9 LEU HB3 H 2.579 0.690 0.052 1.00 . A A . 9 LEU HB3 1 1
6 1113 1 1 9 LEU HD11 H 2.644 -3.104 0.277 1.00 . A A . 9 LEU HD11 1 1
6 1114 1 1 9 LEU HD12 H 4.142 -3.175 1.238 1.00 . A A . 9 LEU HD12 1 1
6 1115 1 1 9 LEU HD13 H 2.625 -2.719 2.016 1.00 . A A . 9 LEU HD13 1 1
6 1116 1 1 9 LEU HD21 H 5.406 -1.593 -0.241 1.00 . A A . 9 LEU HD21 1 1
6 1117 1 1 9 LEU HD22 H 4.017 -1.520 -1.353 1.00 . A A . 9 LEU HD22 1 1
6 1118 1 1 9 LEU HD23 H 4.729 -0.026 -0.709 1.00 . A A . 9 LEU HD23 1 1
6 1119 1 1 9 LEU HG H 4.026 -0.679 1.624 1.00 . A A . 9 LEU HG 1 1
6 1120 1 1 9 LEU N N 0.471 -1.068 2.079 1.00 . A A . 9 LEU N 1 1
6 1121 1 1 9 LEU O O -0.039 1.524 0.226 1.00 . A A . 9 LEU O 1 1
6 1122 1 1 10 ILE C C -0.324 4.459 3.301 1.00 . A A . 10 ILE C 1 1
6 1123 1 1 10 ILE CA C -0.745 3.386 2.243 1.00 . A A . 10 ILE CA 1 1
6 1124 1 1 10 ILE CB C -2.283 3.045 2.173 1.00 . A A . 10 ILE CB 1 1
6 1125 1 1 10 ILE CD1 C -2.888 4.776 0.316 1.00 . A A . 10 ILE CD1 1 1
6 1126 1 1 10 ILE CG1 C -3.183 4.231 1.722 1.00 . A A . 10 ILE CG1 1 1
6 1127 1 1 10 ILE CG2 C -2.871 2.422 3.465 1.00 . A A . 10 ILE CG2 1 1
6 1128 1 1 10 ILE H H 0.468 1.885 3.303 1.00 . A A . 10 ILE H 1 1
6 1129 1 1 10 ILE HA H -0.490 3.821 1.256 1.00 . A A . 10 ILE HA 1 1
6 1130 1 1 10 ILE HB H -2.399 2.267 1.393 1.00 . A A . 10 ILE HB 1 1
6 1131 1 1 10 ILE HD11 H -1.896 5.261 0.261 1.00 . A A . 10 ILE HD11 1 1
6 1132 1 1 10 ILE HD12 H -2.913 3.975 -0.445 1.00 . A A . 10 ILE HD12 1 1
6 1133 1 1 10 ILE HD13 H -3.633 5.537 0.024 1.00 . A A . 10 ILE HD13 1 1
6 1134 1 1 10 ILE HG12 H -4.243 3.915 1.738 1.00 . A A . 10 ILE HG12 1 1
6 1135 1 1 10 ILE HG13 H -3.119 5.058 2.454 1.00 . A A . 10 ILE HG13 1 1
6 1136 1 1 10 ILE HG21 H -3.002 3.166 4.272 1.00 . A A . 10 ILE HG21 1 1
6 1137 1 1 10 ILE HG22 H -3.865 1.971 3.282 1.00 . A A . 10 ILE HG22 1 1
6 1138 1 1 10 ILE HG23 H -2.222 1.626 3.869 1.00 . A A . 10 ILE HG23 1 1
6 1139 1 1 10 ILE N N 0.102 2.169 2.392 1.00 . A A . 10 ILE N 1 1
6 1140 1 1 10 ILE O O -0.987 4.673 4.319 1.00 . A A . 10 ILE O 1 1
6 1141 1 1 11 GLU C C 2.096 7.168 2.895 1.00 . A A . 11 GLU C 1 1
6 1142 1 1 11 GLU CA C 1.356 6.210 3.893 1.00 . A A . 11 GLU CA 1 1
6 1143 1 1 11 GLU CB C 2.209 5.702 5.095 1.00 . A A . 11 GLU CB 1 1
6 1144 1 1 11 GLU CD C 3.167 3.304 4.613 1.00 . A A . 11 GLU CD 1 1
6 1145 1 1 11 GLU CG C 3.445 4.798 4.864 1.00 . A A . 11 GLU CG 1 1
6 1146 1 1 11 GLU H H 1.340 4.773 2.238 1.00 . A A . 11 GLU H 1 1
6 1147 1 1 11 GLU HA H 0.523 6.711 4.420 1.00 . A A . 11 GLU HA 1 1
6 1148 1 1 11 GLU HB2 H 2.560 6.598 5.641 1.00 . A A . 11 GLU HB2 1 1
6 1149 1 1 11 GLU HB3 H 1.539 5.202 5.821 1.00 . A A . 11 GLU HB3 1 1
6 1150 1 1 11 GLU HG2 H 4.061 5.189 4.033 1.00 . A A . 11 GLU HG2 1 1
6 1151 1 1 11 GLU HG3 H 4.126 4.902 5.730 1.00 . A A . 11 GLU HG3 1 1
6 1152 1 1 11 GLU N N 0.803 5.137 3.033 1.00 . A A . 11 GLU N 1 1
6 1153 1 1 11 GLU O O 3.247 6.879 2.553 1.00 . A A . 11 GLU O 1 1
6 1154 1 1 11 GLU OE1 O 3.240 2.870 3.463 1.00 . A A . 11 GLU OE1 1 1
6 1155 1 1 12 THR C C 3.155 10.214 2.128 1.00 . A A . 12 THR C 1 1
6 1156 1 1 12 THR CA C 2.205 9.185 1.404 1.00 . A A . 12 THR CA 1 1
6 1157 1 1 12 THR CB C 1.208 9.832 0.381 1.00 . A A . 12 THR CB 1 1
6 1158 1 1 12 THR CG2 C 1.885 10.499 -0.841 1.00 . A A . 12 THR CG2 1 1
6 1159 1 1 12 THR H H 0.509 8.444 2.622 1.00 . A A . 12 THR H 1 1
6 1160 1 1 12 THR HA H 2.839 8.554 0.744 1.00 . A A . 12 THR HA 1 1
6 1161 1 1 12 THR HB H 0.597 10.599 0.895 1.00 . A A . 12 THR HB 1 1
6 1162 1 1 12 THR HG1 H -0.090 8.420 0.596 1.00 . A A . 12 THR HG1 1 1
6 1163 1 1 12 THR HG21 H 2.552 11.335 -0.557 1.00 . A A . 12 THR HG21 1 1
6 1164 1 1 12 THR HG22 H 2.495 9.784 -1.425 1.00 . A A . 12 THR HG22 1 1
6 1165 1 1 12 THR HG23 H 1.138 10.923 -1.540 1.00 . A A . 12 THR HG23 1 1
6 1166 1 1 12 THR N N 1.494 8.279 2.380 1.00 . A A . 12 THR N 1 1
6 1167 1 1 12 THR O O 2.988 11.432 2.009 1.00 . A A . 12 THR O 1 1
6 1168 1 1 12 THR OG1 O 0.327 8.847 -0.156 1.00 . A A . 12 THR OG1 1 1
6 1169 1 1 13 THR C C 6.465 9.662 3.597 1.00 . A A . 13 THR C 1 1
6 1170 1 1 13 THR CA C 5.162 10.526 3.615 1.00 . A A . 13 THR CA 1 1
6 1171 1 1 13 THR CB C 4.657 10.970 5.028 1.00 . A A . 13 THR CB 1 1
6 1172 1 1 13 THR CG2 C 5.673 11.813 5.816 1.00 . A A . 13 THR CG2 1 1
6 1173 1 1 13 THR H H 4.125 8.700 3.050 1.00 . A A . 13 THR H 1 1
6 1174 1 1 13 THR HA H 5.377 11.444 3.034 1.00 . A A . 13 THR HA 1 1
6 1175 1 1 13 THR HB H 4.410 10.074 5.629 1.00 . A A . 13 THR HB 1 1
6 1176 1 1 13 THR HG1 H 3.258 12.044 5.800 1.00 . A A . 13 THR HG1 1 1
6 1177 1 1 13 THR HG21 H 5.267 12.116 6.800 1.00 . A A . 13 THR HG21 1 1
6 1178 1 1 13 THR HG22 H 6.607 11.255 6.012 1.00 . A A . 13 THR HG22 1 1
6 1179 1 1 13 THR HG23 H 5.946 12.737 5.272 1.00 . A A . 13 THR HG23 1 1
6 1180 1 1 13 THR N N 4.161 9.712 2.876 1.00 . A A . 13 THR N 1 1
6 1181 1 1 13 THR O O 7.385 9.980 2.837 1.00 . A A . 13 THR O 1 1
6 1182 1 1 13 THR OG1 O 3.478 11.758 4.910 1.00 . A A . 13 THR OG1 1 1
6 1183 1 1 14 ALA C C 7.260 6.293 3.919 1.00 . A A . 14 ALA C 1 1
6 1184 1 1 14 ALA CA C 7.703 7.671 4.462 1.00 . A A . 14 ALA CA 1 1
6 1185 1 1 14 ALA CB C 8.231 7.622 5.909 1.00 . A A . 14 ALA CB 1 1
6 1186 1 1 14 ALA H H 5.707 8.431 4.994 1.00 . A A . 14 ALA H 1 1
6 1187 1 1 14 ALA HXT H 7.581 7.083 2.171 1.00 . A A . 14 ALA HXT 1 1
6 1188 1 1 14 ALA HA H 8.534 8.037 3.828 1.00 . A A . 14 ALA HA 1 1
6 1189 1 1 14 ALA HB1 H 9.106 6.951 5.996 1.00 . A A . 14 ALA HB1 1 1
6 1190 1 1 14 ALA HB2 H 8.558 8.619 6.260 1.00 . A A . 14 ALA HB2 1 1
6 1191 1 1 14 ALA HB3 H 7.470 7.254 6.624 1.00 . A A . 14 ALA HB3 1 1
6 1192 1 1 14 ALA N N 6.535 8.580 4.406 1.00 . A A . 14 ALA N 1 1
6 1193 1 1 14 ALA O O 6.889 5.354 4.624 1.00 . A A . 14 ALA O 1 1
6 1194 1 1 14 ALA OXT O 7.303 6.246 2.549 1.00 . A A . 14 ALA OXT 1 1
7 1195 1 1 1 ACE C C 6.315 9.842 -1.907 1.00 . A A . 1 ACE C 1 1
7 1196 1 1 1 ACE CH3 C 5.876 11.274 -1.614 1.00 . A A . 1 ACE CH3 1 1
7 1197 1 1 1 ACE H1 H 5.462 11.756 -2.519 1.00 . A A . 1 ACE H1 1 1
7 1198 1 1 1 ACE H2 H 5.089 11.304 -0.838 1.00 . A A . 1 ACE H2 1 1
7 1199 1 1 1 ACE H3 H 6.722 11.896 -1.266 1.00 . A A . 1 ACE H3 1 1
7 1200 1 1 1 ACE O O 6.167 9.358 -3.031 1.00 . A A . 1 ACE O 1 1
7 1201 1 1 2 ILE C C 6.520 6.955 0.104 1.00 . A A . 2 ILE C 1 1
7 1202 1 1 2 ILE CA C 7.348 7.779 -0.941 1.00 . A A . 2 ILE CA 1 1
7 1203 1 1 2 ILE CB C 8.909 7.692 -0.734 1.00 . A A . 2 ILE CB 1 1
7 1204 1 1 2 ILE CD1 C 9.647 8.184 -3.228 1.00 . A A . 2 ILE CD1 1 1
7 1205 1 1 2 ILE CG1 C 9.769 8.531 -1.732 1.00 . A A . 2 ILE CG1 1 1
7 1206 1 1 2 ILE CG2 C 9.460 6.242 -0.687 1.00 . A A . 2 ILE CG2 1 1
7 1207 1 1 2 ILE H H 6.821 9.708 0.016 1.00 . A A . 2 ILE H 1 1
7 1208 1 1 2 ILE HA H 7.139 7.369 -1.948 1.00 . A A . 2 ILE HA 1 1
7 1209 1 1 2 ILE HB H 9.122 8.113 0.266 1.00 . A A . 2 ILE HB 1 1
7 1210 1 1 2 ILE HD11 H 10.297 8.837 -3.839 1.00 . A A . 2 ILE HD11 1 1
7 1211 1 1 2 ILE HD12 H 9.947 7.141 -3.437 1.00 . A A . 2 ILE HD12 1 1
7 1212 1 1 2 ILE HD13 H 8.616 8.316 -3.601 1.00 . A A . 2 ILE HD13 1 1
7 1213 1 1 2 ILE HG12 H 9.531 9.604 -1.606 1.00 . A A . 2 ILE HG12 1 1
7 1214 1 1 2 ILE HG13 H 10.837 8.462 -1.447 1.00 . A A . 2 ILE HG13 1 1
7 1215 1 1 2 ILE HG21 H 9.032 5.665 0.153 1.00 . A A . 2 ILE HG21 1 1
7 1216 1 1 2 ILE HG22 H 9.236 5.681 -1.614 1.00 . A A . 2 ILE HG22 1 1
7 1217 1 1 2 ILE HG23 H 10.556 6.219 -0.545 1.00 . A A . 2 ILE HG23 1 1
7 1218 1 1 2 ILE N N 6.858 9.192 -0.871 1.00 . A A . 2 ILE N 1 1
7 1219 1 1 2 ILE O O 6.228 7.443 1.204 1.00 . A A . 2 ILE O 1 1
7 1220 1 1 3 TRP C C 6.170 3.476 0.872 1.00 . A A . 3 TRP C 1 1
7 1221 1 1 3 TRP CA C 5.380 4.801 0.631 1.00 . A A . 3 TRP CA 1 1
7 1222 1 1 3 TRP CB C 3.913 4.611 0.157 1.00 . A A . 3 TRP CB 1 1
7 1223 1 1 3 TRP CD1 C 4.276 3.076 -2.026 1.00 . A A . 3 TRP CD1 1 1
7 1224 1 1 3 TRP CD2 C 2.191 3.633 -1.506 1.00 . A A . 3 TRP CD2 1 1
7 1225 1 1 3 TRP CE2 C 2.187 2.823 -2.668 1.00 . A A . 3 TRP CE2 1 1
7 1226 1 1 3 TRP CE3 C 0.974 4.130 -0.976 1.00 . A A . 3 TRP CE3 1 1
7 1227 1 1 3 TRP CG C 3.501 3.801 -1.090 1.00 . A A . 3 TRP CG 1 1
7 1228 1 1 3 TRP CH2 C -0.222 3.017 -2.780 1.00 . A A . 3 TRP CH2 1 1
7 1229 1 1 3 TRP CZ2 C 0.966 2.509 -3.311 1.00 . A A . 3 TRP CZ2 1 1
7 1230 1 1 3 TRP CZ3 C -0.216 3.820 -1.633 1.00 . A A . 3 TRP CZ3 1 1
7 1231 1 1 3 TRP H H 6.789 5.243 -0.900 1.00 . A A . 3 TRP H 1 1
7 1232 1 1 3 TRP HA H 5.254 5.324 1.599 1.00 . A A . 3 TRP HA 1 1
7 1233 1 1 3 TRP HB2 H 3.357 4.174 1.007 1.00 . A A . 3 TRP HB2 1 1
7 1234 1 1 3 TRP HB3 H 3.464 5.616 0.052 1.00 . A A . 3 TRP HB3 1 1
7 1235 1 1 3 TRP HD1 H 5.348 2.973 -2.008 1.00 . A A . 3 TRP HD1 1 1
7 1236 1 1 3 TRP HE1 H 3.781 1.880 -3.799 1.00 . A A . 3 TRP HE1 1 1
7 1237 1 1 3 TRP HE3 H 0.981 4.737 -0.081 1.00 . A A . 3 TRP HE3 1 1
7 1238 1 1 3 TRP HH2 H -1.160 2.786 -3.263 1.00 . A A . 3 TRP HH2 1 1
7 1239 1 1 3 TRP HZ2 H 0.950 1.892 -4.198 1.00 . A A . 3 TRP HZ2 1 1
7 1240 1 1 3 TRP HZ3 H -1.151 4.195 -1.243 1.00 . A A . 3 TRP HZ3 1 1
7 1241 1 1 3 TRP N N 6.155 5.701 -0.248 1.00 . A A . 3 TRP N 1 1
7 1242 1 1 3 TRP NE1 N 3.477 2.459 -3.008 1.00 . A A . 3 TRP NE1 1 1
7 1243 1 1 3 TRP O O 6.772 2.876 -0.025 1.00 . A A . 3 TRP O 1 1
7 1244 1 1 4 GLY C C 6.246 1.466 3.991 1.00 . A A . 4 GLY C 1 1
7 1245 1 1 4 GLY CA C 6.815 1.824 2.607 1.00 . A A . 4 GLY CA 1 1
7 1246 1 1 4 GLY H H 5.667 3.691 2.750 1.00 . A A . 4 GLY H 1 1
7 1247 1 1 4 GLY HA2 H 6.670 0.996 1.887 1.00 . A A . 4 GLY HA2 1 1
7 1248 1 1 4 GLY HA3 H 7.902 2.005 2.685 1.00 . A A . 4 GLY HA3 1 1
7 1249 1 1 4 GLY N N 6.156 3.053 2.132 1.00 . A A . 4 GLY N 1 1
7 1250 1 1 4 GLY O O 6.806 1.872 5.013 1.00 . A A . 4 GLY O 1 1
7 1251 1 1 5 . C C 3.063 1.091 5.454 1.00 . A A . 5 SET C 1 1
7 1252 1 1 5 . CA C 4.425 0.306 5.254 1.00 . A A . 5 SET CA 1 1
7 1253 1 1 5 . CB C 4.175 -1.230 5.177 1.00 . A A . 5 SET CB 1 1
7 1254 1 1 5 . H H 4.762 0.482 3.077 1.00 . A A . 5 SET H 1 1
7 1255 1 1 5 . HA H 5.124 0.455 6.108 1.00 . A A . 5 SET HA 1 1
7 1256 1 1 5 . HB2 H 2.335 0.769 4.688 1.00 . A A . 5 SET HB2 1 1
7 1257 1 1 5 . HB3 H 2.601 0.747 6.398 1.00 . A A . 5 SET HB3 1 1
7 1258 1 1 5 . HNT2 H 2.996 3.147 6.363 1.00 . A A . 5 SET HNT2 1 1
7 1259 1 1 5 . N N 5.131 0.712 4.006 1.00 . A A . 5 SET N 1 1
7 1260 1 1 5 . NT N 3.055 2.589 5.496 1.00 . A A . 5 SET NT 1 1
7 1261 1 1 5 . OG O 3.733 -1.756 4.148 1.00 . A A . 5 SET OG 1 1
7 1262 1 1 6 SER C C 2.843 -3.965 6.124 1.00 . A A . 6 SER C 1 1
7 1263 1 1 6 SER CA C 4.286 -3.424 6.377 1.00 . A A . 6 SER CA 1 1
7 1264 1 1 6 SER CB C 4.851 -3.914 7.732 1.00 . A A . 6 SER CB 1 1
7 1265 1 1 6 SER H H 4.715 -1.391 7.112 1.00 . A A . 6 SER H 1 1
7 1266 1 1 6 SER HA H 4.974 -3.840 5.614 1.00 . A A . 6 SER HA 1 1
7 1267 1 1 6 SER HB2 H 4.845 -5.020 7.769 1.00 . A A . 6 SER HB2 1 1
7 1268 1 1 6 SER HB3 H 5.914 -3.625 7.835 1.00 . A A . 6 SER HB3 1 1
7 1269 1 1 6 SER HG H 4.520 -3.784 9.631 1.00 . A A . 6 SER HG 1 1
7 1270 1 1 6 SER N N 4.433 -1.944 6.293 1.00 . A A . 6 SER N 1 1
7 1271 1 1 6 SER O O 1.897 -3.587 6.824 1.00 . A A . 6 SER O 1 1
7 1272 1 1 6 SER OG O 4.117 -3.406 8.846 1.00 . A A . 6 SER OG 1 1
7 1273 1 1 7 GLY C C 0.618 -4.609 3.697 1.00 . A A . 7 GLY C 1 1
7 1274 1 1 7 GLY CA C 1.383 -5.434 4.748 1.00 . A A . 7 GLY CA 1 1
7 1275 1 1 7 GLY H H 3.533 -5.027 4.554 1.00 . A A . 7 GLY H 1 1
7 1276 1 1 7 GLY HA2 H 1.565 -6.445 4.339 1.00 . A A . 7 GLY HA2 1 1
7 1277 1 1 7 GLY HA3 H 0.756 -5.608 5.645 1.00 . A A . 7 GLY HA3 1 1
7 1278 1 1 7 GLY N N 2.693 -4.840 5.109 1.00 . A A . 7 GLY N 1 1
7 1279 1 1 7 GLY O O 0.620 -4.945 2.510 1.00 . A A . 7 GLY O 1 1
7 1280 1 1 8 LYS C C -0.035 -1.291 3.205 1.00 . A A . 8 LYS C 1 1
7 1281 1 1 8 LYS CA C -0.830 -2.619 3.326 1.00 . A A . 8 LYS CA 1 1
7 1282 1 1 8 LYS CB C -2.208 -2.443 4.017 1.00 . A A . 8 LYS CB 1 1
7 1283 1 1 8 LYS CD C -4.516 -1.283 4.021 1.00 . A A . 8 LYS CD 1 1
7 1284 1 1 8 LYS CE C -5.417 -2.504 4.289 1.00 . A A . 8 LYS CE 1 1
7 1285 1 1 8 LYS CG C -3.233 -1.598 3.228 1.00 . A A . 8 LYS CG 1 1
7 1286 1 1 8 LYS H H 0.174 -3.280 5.129 1.00 . A A . 8 LYS H 1 1
7 1287 1 1 8 LYS HA H -1.018 -3.061 2.324 1.00 . A A . 8 LYS HA 1 1
7 1288 1 1 8 LYS HB2 H -2.651 -3.442 4.201 1.00 . A A . 8 LYS HB2 1 1
7 1289 1 1 8 LYS HB3 H -2.066 -1.999 5.022 1.00 . A A . 8 LYS HB3 1 1
7 1290 1 1 8 LYS HD2 H -4.236 -0.795 4.975 1.00 . A A . 8 LYS HD2 1 1
7 1291 1 1 8 LYS HD3 H -5.079 -0.519 3.454 1.00 . A A . 8 LYS HD3 1 1
7 1292 1 1 8 LYS HE2 H -5.653 -3.023 3.340 1.00 . A A . 8 LYS HE2 1 1
7 1293 1 1 8 LYS HE3 H -4.884 -3.247 4.916 1.00 . A A . 8 LYS HE3 1 1
7 1294 1 1 8 LYS HG2 H -2.769 -0.636 2.939 1.00 . A A . 8 LYS HG2 1 1
7 1295 1 1 8 LYS HG3 H -3.483 -2.095 2.271 1.00 . A A . 8 LYS HG3 1 1
7 1296 1 1 8 LYS HZ1 H -6.487 -1.646 5.866 1.00 . A A . 8 LYS HZ1 1 1
7 1297 1 1 8 LYS HZ2 H -7.211 -1.439 4.399 1.00 . A A . 8 LYS HZ2 1 1
7 1298 1 1 8 LYS HZ3 H -7.282 -2.905 5.153 1.00 . A A . 8 LYS HZ3 1 1
7 1299 1 1 8 LYS N N -0.040 -3.539 4.166 1.00 . A A . 8 LYS N 1 1
7 1300 1 1 8 LYS NZ N -6.669 -2.103 4.964 1.00 . A A . 8 LYS NZ 1 1
7 1301 1 1 8 LYS O O 0.042 -0.501 4.153 1.00 . A A . 8 LYS O 1 1
7 1302 1 1 9 LEU C C 0.326 1.338 1.468 1.00 . A A . 9 LEU C 1 1
7 1303 1 1 9 LEU CA C 1.322 0.165 1.710 1.00 . A A . 9 LEU CA 1 1
7 1304 1 1 9 LEU CB C 2.279 -0.022 0.495 1.00 . A A . 9 LEU CB 1 1
7 1305 1 1 9 LEU CD1 C 3.360 -2.363 0.796 1.00 . A A . 9 LEU CD1 1 1
7 1306 1 1 9 LEU CD2 C 4.627 -0.519 -0.360 1.00 . A A . 9 LEU CD2 1 1
7 1307 1 1 9 LEU CG C 3.583 -0.838 0.730 1.00 . A A . 9 LEU CG 1 1
7 1308 1 1 9 LEU H H 0.571 -1.911 1.437 1.00 . A A . 9 LEU H 1 1
7 1309 1 1 9 LEU HA H 1.972 0.406 2.573 1.00 . A A . 9 LEU HA 1 1
7 1310 1 1 9 LEU HB2 H 1.726 -0.423 -0.378 1.00 . A A . 9 LEU HB2 1 1
7 1311 1 1 9 LEU HB3 H 2.586 0.993 0.172 1.00 . A A . 9 LEU HB3 1 1
7 1312 1 1 9 LEU HD11 H 2.878 -2.755 -0.120 1.00 . A A . 9 LEU HD11 1 1
7 1313 1 1 9 LEU HD12 H 4.312 -2.910 0.926 1.00 . A A . 9 LEU HD12 1 1
7 1314 1 1 9 LEU HD13 H 2.724 -2.651 1.652 1.00 . A A . 9 LEU HD13 1 1
7 1315 1 1 9 LEU HD21 H 5.577 -1.060 -0.192 1.00 . A A . 9 LEU HD21 1 1
7 1316 1 1 9 LEU HD22 H 4.269 -0.787 -1.372 1.00 . A A . 9 LEU HD22 1 1
7 1317 1 1 9 LEU HD23 H 4.880 0.558 -0.377 1.00 . A A . 9 LEU HD23 1 1
7 1318 1 1 9 LEU HG H 4.023 -0.520 1.691 1.00 . A A . 9 LEU HG 1 1
7 1319 1 1 9 LEU N N 0.542 -1.067 2.014 1.00 . A A . 9 LEU N 1 1
7 1320 1 1 9 LEU O O -0.303 1.425 0.409 1.00 . A A . 9 LEU O 1 1
7 1321 1 1 10 ILE C C -0.161 4.535 3.301 1.00 . A A . 10 ILE C 1 1
7 1322 1 1 10 ILE CA C -0.751 3.380 2.426 1.00 . A A . 10 ILE CA 1 1
7 1323 1 1 10 ILE CB C -2.249 2.967 2.697 1.00 . A A . 10 ILE CB 1 1
7 1324 1 1 10 ILE CD1 C -3.298 4.640 0.998 1.00 . A A . 10 ILE CD1 1 1
7 1325 1 1 10 ILE CG1 C -3.283 4.097 2.435 1.00 . A A . 10 ILE CG1 1 1
7 1326 1 1 10 ILE CG2 C -2.520 2.336 4.089 1.00 . A A . 10 ILE CG2 1 1
7 1327 1 1 10 ILE H H 0.703 1.995 3.328 1.00 . A A . 10 ILE H 1 1
7 1328 1 1 10 ILE HA H -0.728 3.756 1.386 1.00 . A A . 10 ILE HA 1 1
7 1329 1 1 10 ILE HB H -2.490 2.169 1.967 1.00 . A A . 10 ILE HB 1 1
7 1330 1 1 10 ILE HD11 H -2.366 5.183 0.756 1.00 . A A . 10 ILE HD11 1 1
7 1331 1 1 10 ILE HD12 H -3.412 3.827 0.258 1.00 . A A . 10 ILE HD12 1 1
7 1332 1 1 10 ILE HD13 H -4.132 5.347 0.850 1.00 . A A . 10 ILE HD13 1 1
7 1333 1 1 10 ILE HG12 H -4.301 3.725 2.659 1.00 . A A . 10 ILE HG12 1 1
7 1334 1 1 10 ILE HG13 H -3.123 4.936 3.139 1.00 . A A . 10 ILE HG13 1 1
7 1335 1 1 10 ILE HG21 H -2.383 3.057 4.914 1.00 . A A . 10 ILE HG21 1 1
7 1336 1 1 10 ILE HG22 H -3.552 1.947 4.167 1.00 . A A . 10 ILE HG22 1 1
7 1337 1 1 10 ILE HG23 H -1.849 1.481 4.290 1.00 . A A . 10 ILE HG23 1 1
7 1338 1 1 10 ILE N N 0.163 2.206 2.484 1.00 . A A . 10 ILE N 1 1
7 1339 1 1 10 ILE O O -0.677 4.861 4.374 1.00 . A A . 10 ILE O 1 1
7 1340 1 1 11 GLU C C 2.451 7.118 2.479 1.00 . A A . 11 GLU C 1 1
7 1341 1 1 11 GLU CA C 1.625 6.276 3.521 1.00 . A A . 11 GLU CA 1 1
7 1342 1 1 11 GLU CB C 2.429 5.807 4.775 1.00 . A A . 11 GLU CB 1 1
7 1343 1 1 11 GLU CD C 3.233 3.339 4.393 1.00 . A A . 11 GLU CD 1 1
7 1344 1 1 11 GLU CG C 3.604 4.819 4.593 1.00 . A A . 11 GLU CG 1 1
7 1345 1 1 11 GLU H H 1.304 4.753 1.952 1.00 . A A . 11 GLU H 1 1
7 1346 1 1 11 GLU HA H 0.860 6.932 3.976 1.00 . A A . 11 GLU HA 1 1
7 1347 1 1 11 GLU HB2 H 2.834 6.715 5.261 1.00 . A A . 11 GLU HB2 1 1
7 1348 1 1 11 GLU HB3 H 1.729 5.399 5.530 1.00 . A A . 11 GLU HB3 1 1
7 1349 1 1 11 GLU HG2 H 4.238 5.141 3.744 1.00 . A A . 11 GLU HG2 1 1
7 1350 1 1 11 GLU HG3 H 4.291 4.919 5.455 1.00 . A A . 11 GLU HG3 1 1
7 1351 1 1 11 GLU N N 0.935 5.156 2.821 1.00 . A A . 11 GLU N 1 1
7 1352 1 1 11 GLU O O 3.674 7.221 2.610 1.00 . A A . 11 GLU O 1 1
7 1353 1 1 11 GLU OE1 O 3.274 2.869 3.253 1.00 . A A . 11 GLU OE1 1 1
7 1354 1 1 12 THR C C 2.839 10.012 0.925 1.00 . A A . 12 THR C 1 1
7 1355 1 1 12 THR CA C 2.556 8.551 0.418 1.00 . A A . 12 THR CA 1 1
7 1356 1 1 12 THR CB C 1.824 8.507 -0.968 1.00 . A A . 12 THR CB 1 1
7 1357 1 1 12 THR CG2 C 2.651 9.064 -2.149 1.00 . A A . 12 THR CG2 1 1
7 1358 1 1 12 THR H H 0.804 7.595 1.409 1.00 . A A . 12 THR H 1 1
7 1359 1 1 12 THR HA H 3.518 8.042 0.198 1.00 . A A . 12 THR HA 1 1
7 1360 1 1 12 THR HB H 0.881 9.086 -0.910 1.00 . A A . 12 THR HB 1 1
7 1361 1 1 12 THR HG1 H 1.137 7.208 -2.211 1.00 . A A . 12 THR HG1 1 1
7 1362 1 1 12 THR HG21 H 2.932 10.124 -2.007 1.00 . A A . 12 THR HG21 1 1
7 1363 1 1 12 THR HG22 H 3.591 8.499 -2.303 1.00 . A A . 12 THR HG22 1 1
7 1364 1 1 12 THR HG23 H 2.093 9.016 -3.103 1.00 . A A . 12 THR HG23 1 1
7 1365 1 1 12 THR N N 1.818 7.753 1.458 1.00 . A A . 12 THR N 1 1
7 1366 1 1 12 THR O O 2.207 10.967 0.461 1.00 . A A . 12 THR O 1 1
7 1367 1 1 12 THR OG1 O 1.497 7.168 -1.323 1.00 . A A . 12 THR OG1 1 1
7 1368 1 1 13 THR C C 5.707 11.622 2.487 1.00 . A A . 13 THR C 1 1
7 1369 1 1 13 THR CA C 4.152 11.528 2.428 1.00 . A A . 13 THR CA 1 1
7 1370 1 1 13 THR CB C 3.402 11.820 3.770 1.00 . A A . 13 THR CB 1 1
7 1371 1 1 13 THR CG2 C 3.673 13.219 4.352 1.00 . A A . 13 THR CG2 1 1
7 1372 1 1 13 THR H H 4.084 9.343 2.373 1.00 . A A . 13 THR H 1 1
7 1373 1 1 13 THR HA H 3.833 12.317 1.716 1.00 . A A . 13 THR HA 1 1
7 1374 1 1 13 THR HB H 3.697 11.069 4.528 1.00 . A A . 13 THR HB 1 1
7 1375 1 1 13 THR HG1 H 1.595 11.973 4.419 1.00 . A A . 13 THR HG1 1 1
7 1376 1 1 13 THR HG21 H 3.110 13.383 5.289 1.00 . A A . 13 THR HG21 1 1
7 1377 1 1 13 THR HG22 H 4.742 13.367 4.590 1.00 . A A . 13 THR HG22 1 1
7 1378 1 1 13 THR HG23 H 3.378 14.020 3.647 1.00 . A A . 13 THR HG23 1 1
7 1379 1 1 13 THR N N 3.788 10.191 1.874 1.00 . A A . 13 THR N 1 1
7 1380 1 1 13 THR O O 6.295 12.348 1.680 1.00 . A A . 13 THR O 1 1
7 1381 1 1 13 THR OG1 O 1.994 11.726 3.581 1.00 . A A . 13 THR OG1 1 1
7 1382 1 1 14 ALA C C 8.513 9.934 2.570 1.00 . A A . 14 ALA C 1 1
7 1383 1 1 14 ALA CA C 7.848 10.922 3.556 1.00 . A A . 14 ALA CA 1 1
7 1384 1 1 14 ALA CB C 8.203 10.626 5.026 1.00 . A A . 14 ALA CB 1 1
7 1385 1 1 14 ALA H H 5.780 10.320 4.021 1.00 . A A . 14 ALA H 1 1
7 1386 1 1 14 ALA HXT H 8.587 11.465 1.371 1.00 . A A . 14 ALA HXT 1 1
7 1387 1 1 14 ALA HA H 8.228 11.940 3.342 1.00 . A A . 14 ALA HA 1 1
7 1388 1 1 14 ALA HB1 H 9.296 10.661 5.190 1.00 . A A . 14 ALA HB1 1 1
7 1389 1 1 14 ALA HB2 H 7.756 11.367 5.714 1.00 . A A . 14 ALA HB2 1 1
7 1390 1 1 14 ALA HB3 H 7.859 9.625 5.349 1.00 . A A . 14 ALA HB3 1 1
7 1391 1 1 14 ALA N N 6.373 10.897 3.415 1.00 . A A . 14 ALA N 1 1
7 1392 1 1 14 ALA O O 8.706 8.740 2.807 1.00 . A A . 14 ALA O 1 1
7 1393 1 1 14 ALA OXT O 8.848 10.542 1.385 1.00 . A A . 14 ALA OXT 1 1
8 1394 1 1 1 ACE C C 8.319 7.675 -2.129 1.00 . A A . 1 ACE C 1 1
8 1395 1 1 1 ACE CH3 C 7.517 8.878 -2.617 1.00 . A A . 1 ACE CH3 1 1
8 1396 1 1 1 ACE H1 H 8.183 9.696 -2.949 1.00 . A A . 1 ACE H1 1 1
8 1397 1 1 1 ACE H2 H 6.877 8.605 -3.476 1.00 . A A . 1 ACE H2 1 1
8 1398 1 1 1 ACE H3 H 6.853 9.275 -1.827 1.00 . A A . 1 ACE H3 1 1
8 1399 1 1 1 ACE O O 8.279 6.607 -2.744 1.00 . A A . 1 ACE O 1 1
8 1400 1 1 2 ILE C C 9.202 6.508 0.970 1.00 . A A . 2 ILE C 1 1
8 1401 1 1 2 ILE CA C 9.891 6.822 -0.392 1.00 . A A . 2 ILE CA 1 1
8 1402 1 1 2 ILE CB C 11.403 7.246 -0.280 1.00 . A A . 2 ILE CB 1 1
8 1403 1 1 2 ILE CD1 C 12.132 6.517 -2.721 1.00 . A A . 2 ILE CD1 1 1
8 1404 1 1 2 ILE CG1 C 12.098 7.606 -1.632 1.00 . A A . 2 ILE CG1 1 1
8 1405 1 1 2 ILE CG2 C 12.270 6.207 0.479 1.00 . A A . 2 ILE CG2 1 1
8 1406 1 1 2 ILE H H 8.865 8.782 -0.566 1.00 . A A . 2 ILE H 1 1
8 1407 1 1 2 ILE HA H 9.886 5.902 -1.014 1.00 . A A . 2 ILE HA 1 1
8 1408 1 1 2 ILE HB H 11.438 8.168 0.332 1.00 . A A . 2 ILE HB 1 1
8 1409 1 1 2 ILE HD11 H 12.657 6.877 -3.625 1.00 . A A . 2 ILE HD11 1 1
8 1410 1 1 2 ILE HD12 H 12.658 5.606 -2.381 1.00 . A A . 2 ILE HD12 1 1
8 1411 1 1 2 ILE HD13 H 11.115 6.218 -3.037 1.00 . A A . 2 ILE HD13 1 1
8 1412 1 1 2 ILE HG12 H 11.614 8.503 -2.062 1.00 . A A . 2 ILE HG12 1 1
8 1413 1 1 2 ILE HG13 H 13.139 7.930 -1.435 1.00 . A A . 2 ILE HG13 1 1
8 1414 1 1 2 ILE HG21 H 11.913 6.051 1.515 1.00 . A A . 2 ILE HG21 1 1
8 1415 1 1 2 ILE HG22 H 12.266 5.219 -0.017 1.00 . A A . 2 ILE HG22 1 1
8 1416 1 1 2 ILE HG23 H 13.325 6.530 0.562 1.00 . A A . 2 ILE HG23 1 1
8 1417 1 1 2 ILE N N 9.048 7.882 -1.024 1.00 . A A . 2 ILE N 1 1
8 1418 1 1 2 ILE O O 9.327 7.270 1.935 1.00 . A A . 2 ILE O 1 1
8 1419 1 1 3 TRP C C 7.384 3.433 2.049 1.00 . A A . 3 TRP C 1 1
8 1420 1 1 3 TRP CA C 7.734 4.934 2.234 1.00 . A A . 3 TRP CA 1 1
8 1421 1 1 3 TRP CB C 6.469 5.735 2.664 1.00 . A A . 3 TRP CB 1 1
8 1422 1 1 3 TRP CD1 C 5.843 7.711 1.174 1.00 . A A . 3 TRP CD1 1 1
8 1423 1 1 3 TRP CD2 C 4.541 5.949 0.837 1.00 . A A . 3 TRP CD2 1 1
8 1424 1 1 3 TRP CE2 C 4.122 7.016 0.000 1.00 . A A . 3 TRP CE2 1 1
8 1425 1 1 3 TRP CE3 C 3.860 4.709 0.811 1.00 . A A . 3 TRP CE3 1 1
8 1426 1 1 3 TRP CG C 5.617 6.396 1.578 1.00 . A A . 3 TRP CG 1 1
8 1427 1 1 3 TRP CH2 C 2.326 5.630 -0.839 1.00 . A A . 3 TRP CH2 1 1
8 1428 1 1 3 TRP CZ2 C 3.001 6.852 -0.848 1.00 . A A . 3 TRP CZ2 1 1
8 1429 1 1 3 TRP CZ3 C 2.752 4.572 -0.025 1.00 . A A . 3 TRP CZ3 1 1
8 1430 1 1 3 TRP H H 8.532 4.774 0.204 1.00 . A A . 3 TRP H 1 1
8 1431 1 1 3 TRP HA H 8.450 5.065 3.073 1.00 . A A . 3 TRP HA 1 1
8 1432 1 1 3 TRP HB2 H 5.825 5.113 3.310 1.00 . A A . 3 TRP HB2 1 1
8 1433 1 1 3 TRP HB3 H 6.799 6.533 3.356 1.00 . A A . 3 TRP HB3 1 1
8 1434 1 1 3 TRP HD1 H 6.667 8.271 1.588 1.00 . A A . 3 TRP HD1 1 1
8 1435 1 1 3 TRP HE1 H 4.870 9.041 -0.276 1.00 . A A . 3 TRP HE1 1 1
8 1436 1 1 3 TRP HE3 H 4.196 3.881 1.413 1.00 . A A . 3 TRP HE3 1 1
8 1437 1 1 3 TRP HH2 H 1.464 5.496 -1.475 1.00 . A A . 3 TRP HH2 1 1
8 1438 1 1 3 TRP HZ2 H 2.663 7.660 -1.480 1.00 . A A . 3 TRP HZ2 1 1
8 1439 1 1 3 TRP HZ3 H 2.217 3.633 -0.047 1.00 . A A . 3 TRP HZ3 1 1
8 1440 1 1 3 TRP N N 8.465 5.385 1.022 1.00 . A A . 3 TRP N 1 1
8 1441 1 1 3 TRP NE1 N 4.929 8.130 0.190 1.00 . A A . 3 TRP NE1 1 1
8 1442 1 1 3 TRP O O 6.767 3.024 1.058 1.00 . A A . 3 TRP O 1 1
8 1443 1 1 4 GLY C C 6.806 0.679 4.338 1.00 . A A . 4 GLY C 1 1
8 1444 1 1 4 GLY CA C 7.536 1.184 3.081 1.00 . A A . 4 GLY CA 1 1
8 1445 1 1 4 GLY H H 8.294 3.151 3.766 1.00 . A A . 4 GLY H 1 1
8 1446 1 1 4 GLY HA2 H 7.017 0.828 2.172 1.00 . A A . 4 GLY HA2 1 1
8 1447 1 1 4 GLY HA3 H 8.528 0.698 3.040 1.00 . A A . 4 GLY HA3 1 1
8 1448 1 1 4 GLY N N 7.762 2.644 3.058 1.00 . A A . 4 GLY N 1 1
8 1449 1 1 4 GLY O O 7.457 0.249 5.295 1.00 . A A . 4 GLY O 1 1
8 1450 1 1 5 . C C 3.207 0.945 5.515 1.00 . A A . 5 SET C 1 1
8 1451 1 1 5 . CA C 4.610 0.224 5.445 1.00 . A A . 5 SET CA 1 1
8 1452 1 1 5 . CB C 4.382 -1.312 5.276 1.00 . A A . 5 SET CB 1 1
8 1453 1 1 5 . H H 5.057 1.156 3.487 1.00 . A A . 5 SET H 1 1
8 1454 1 1 5 . HA H 5.196 0.358 6.384 1.00 . A A . 5 SET HA 1 1
8 1455 1 1 5 . HB2 H 2.590 0.626 4.651 1.00 . A A . 5 SET HB2 1 1
8 1456 1 1 5 . HB3 H 2.650 0.548 6.383 1.00 . A A . 5 SET HB3 1 1
8 1457 1 1 5 . HNT2 H 2.994 2.960 6.489 1.00 . A A . 5 SET HNT2 1 1
8 1458 1 1 5 . N N 5.461 0.708 4.317 1.00 . A A . 5 SET N 1 1
8 1459 1 1 5 . NT N 3.139 2.435 5.612 1.00 . A A . 5 SET NT 1 1
8 1460 1 1 5 . OG O 4.047 -1.791 4.185 1.00 . A A . 5 SET OG 1 1
8 1461 1 1 6 SER C C 2.923 -4.047 6.144 1.00 . A A . 6 SER C 1 1
8 1462 1 1 6 SER CA C 4.383 -3.552 6.374 1.00 . A A . 6 SER CA 1 1
8 1463 1 1 6 SER CB C 4.975 -4.122 7.685 1.00 . A A . 6 SER CB 1 1
8 1464 1 1 6 SER H H 4.758 -1.558 7.240 1.00 . A A . 6 SER H 1 1
8 1465 1 1 6 SER HA H 5.042 -3.939 5.569 1.00 . A A . 6 SER HA 1 1
8 1466 1 1 6 SER HB2 H 4.963 -5.228 7.658 1.00 . A A . 6 SER HB2 1 1
8 1467 1 1 6 SER HB3 H 6.042 -3.846 7.785 1.00 . A A . 6 SER HB3 1 1
8 1468 1 1 6 SER HG H 3.338 -3.856 8.673 1.00 . A A . 6 SER HG 1 1
8 1469 1 1 6 SER N N 4.536 -2.072 6.378 1.00 . A A . 6 SER N 1 1
8 1470 1 1 6 SER O O 2.027 -3.746 6.941 1.00 . A A . 6 SER O 1 1
8 1471 1 1 6 SER OG O 4.267 -3.677 8.842 1.00 . A A . 6 SER OG 1 1
8 1472 1 1 7 GLY C C 0.570 -4.495 3.710 1.00 . A A . 7 GLY C 1 1
8 1473 1 1 7 GLY CA C 1.366 -5.349 4.713 1.00 . A A . 7 GLY CA 1 1
8 1474 1 1 7 GLY H H 3.503 -4.930 4.428 1.00 . A A . 7 GLY H 1 1
8 1475 1 1 7 GLY HA2 H 1.511 -6.354 4.275 1.00 . A A . 7 GLY HA2 1 1
8 1476 1 1 7 GLY HA3 H 0.760 -5.542 5.623 1.00 . A A . 7 GLY HA3 1 1
8 1477 1 1 7 GLY N N 2.699 -4.803 5.051 1.00 . A A . 7 GLY N 1 1
8 1478 1 1 7 GLY O O 0.522 -4.817 2.520 1.00 . A A . 7 GLY O 1 1
8 1479 1 1 8 LYS C C -0.071 -1.187 3.195 1.00 . A A . 8 LYS C 1 1
8 1480 1 1 8 LYS CA C -0.881 -2.496 3.410 1.00 . A A . 8 LYS CA 1 1
8 1481 1 1 8 LYS CB C -2.210 -2.286 4.180 1.00 . A A . 8 LYS CB 1 1
8 1482 1 1 8 LYS CD C -4.534 -1.168 4.222 1.00 . A A . 8 LYS CD 1 1
8 1483 1 1 8 LYS CE C -5.415 -2.354 4.663 1.00 . A A . 8 LYS CE 1 1
8 1484 1 1 8 LYS CG C -3.309 -1.561 3.375 1.00 . A A . 8 LYS CG 1 1
8 1485 1 1 8 LYS H H 0.197 -3.163 5.166 1.00 . A A . 8 LYS H 1 1
8 1486 1 1 8 LYS HA H -1.144 -2.962 2.436 1.00 . A A . 8 LYS HA 1 1
8 1487 1 1 8 LYS HB2 H -2.617 -3.267 4.495 1.00 . A A . 8 LYS HB2 1 1
8 1488 1 1 8 LYS HB3 H -2.012 -1.739 5.123 1.00 . A A . 8 LYS HB3 1 1
8 1489 1 1 8 LYS HD2 H -4.189 -0.594 5.105 1.00 . A A . 8 LYS HD2 1 1
8 1490 1 1 8 LYS HD3 H -5.138 -0.459 3.628 1.00 . A A . 8 LYS HD3 1 1
8 1491 1 1 8 LYS HE2 H -5.735 -2.943 3.781 1.00 . A A . 8 LYS HE2 1 1
8 1492 1 1 8 LYS HE3 H -4.835 -3.050 5.301 1.00 . A A . 8 LYS HE3 1 1
8 1493 1 1 8 LYS HG2 H -2.887 -0.640 2.929 1.00 . A A . 8 LYS HG2 1 1
8 1494 1 1 8 LYS HG3 H -3.620 -2.176 2.509 1.00 . A A . 8 LYS HG3 1 1
8 1495 1 1 8 LYS HZ1 H -7.188 -1.261 4.835 1.00 . A A . 8 LYS HZ1 1 1
8 1496 1 1 8 LYS HZ2 H -7.203 -2.661 5.709 1.00 . A A . 8 LYS HZ2 1 1
8 1497 1 1 8 LYS HZ3 H -6.345 -1.359 6.248 1.00 . A A . 8 LYS HZ3 1 1
8 1498 1 1 8 LYS N N -0.060 -3.423 4.215 1.00 . A A . 8 LYS N 1 1
8 1499 1 1 8 LYS NZ N -6.603 -1.885 5.404 1.00 . A A . 8 LYS NZ 1 1
8 1500 1 1 8 LYS O O 0.097 -0.369 4.106 1.00 . A A . 8 LYS O 1 1
8 1501 1 1 9 LEU C C 0.289 1.394 1.259 1.00 . A A . 9 LEU C 1 1
8 1502 1 1 9 LEU CA C 1.213 0.165 1.531 1.00 . A A . 9 LEU CA 1 1
8 1503 1 1 9 LEU CB C 2.056 -0.213 0.272 1.00 . A A . 9 LEU CB 1 1
8 1504 1 1 9 LEU CD1 C 3.765 -1.797 -0.778 1.00 . A A . 9 LEU CD1 1 1
8 1505 1 1 9 LEU CD2 C 4.487 -0.247 1.067 1.00 . A A . 9 LEU CD2 1 1
8 1506 1 1 9 LEU CG C 3.320 -1.086 0.515 1.00 . A A . 9 LEU CG 1 1
8 1507 1 1 9 LEU H H 0.324 -1.878 1.404 1.00 . A A . 9 LEU H 1 1
8 1508 1 1 9 LEU HA H 1.925 0.437 2.335 1.00 . A A . 9 LEU HA 1 1
8 1509 1 1 9 LEU HB2 H 1.390 -0.708 -0.463 1.00 . A A . 9 LEU HB2 1 1
8 1510 1 1 9 LEU HB3 H 2.376 0.709 -0.252 1.00 . A A . 9 LEU HB3 1 1
8 1511 1 1 9 LEU HD11 H 4.026 -1.081 -1.580 1.00 . A A . 9 LEU HD11 1 1
8 1512 1 1 9 LEU HD12 H 4.649 -2.438 -0.609 1.00 . A A . 9 LEU HD12 1 1
8 1513 1 1 9 LEU HD13 H 2.968 -2.455 -1.173 1.00 . A A . 9 LEU HD13 1 1
8 1514 1 1 9 LEU HD21 H 5.355 -0.879 1.334 1.00 . A A . 9 LEU HD21 1 1
8 1515 1 1 9 LEU HD22 H 4.839 0.514 0.345 1.00 . A A . 9 LEU HD22 1 1
8 1516 1 1 9 LEU HD23 H 4.192 0.293 1.982 1.00 . A A . 9 LEU HD23 1 1
8 1517 1 1 9 LEU HG H 3.086 -1.873 1.256 1.00 . A A . 9 LEU HG 1 1
8 1518 1 1 9 LEU N N 0.415 -1.021 1.958 1.00 . A A . 9 LEU N 1 1
8 1519 1 1 9 LEU O O -0.159 1.622 0.130 1.00 . A A . 9 LEU O 1 1
8 1520 1 1 10 ILE C C -0.450 4.383 3.360 1.00 . A A . 10 ILE C 1 1
8 1521 1 1 10 ILE CA C -0.865 3.385 2.233 1.00 . A A . 10 ILE CA 1 1
8 1522 1 1 10 ILE CB C -2.396 3.007 2.159 1.00 . A A . 10 ILE CB 1 1
8 1523 1 1 10 ILE CD1 C -3.096 4.755 0.366 1.00 . A A . 10 ILE CD1 1 1
8 1524 1 1 10 ILE CG1 C -3.324 4.193 1.777 1.00 . A A . 10 ILE CG1 1 1
8 1525 1 1 10 ILE CG2 C -2.965 2.294 3.414 1.00 . A A . 10 ILE CG2 1 1
8 1526 1 1 10 ILE H H 0.369 1.850 3.214 1.00 . A A . 10 ILE H 1 1
8 1527 1 1 10 ILE HA H -0.622 3.884 1.273 1.00 . A A . 10 ILE HA 1 1
8 1528 1 1 10 ILE HB H -2.501 2.269 1.340 1.00 . A A . 10 ILE HB 1 1
8 1529 1 1 10 ILE HD11 H -3.853 5.519 0.116 1.00 . A A . 10 ILE HD11 1 1
8 1530 1 1 10 ILE HD12 H -2.105 5.236 0.267 1.00 . A A . 10 ILE HD12 1 1
8 1531 1 1 10 ILE HD13 H -3.160 3.961 -0.402 1.00 . A A . 10 ILE HD13 1 1
8 1532 1 1 10 ILE HG12 H -4.382 3.871 1.833 1.00 . A A . 10 ILE HG12 1 1
8 1533 1 1 10 ILE HG13 H -3.232 5.009 2.518 1.00 . A A . 10 ILE HG13 1 1
8 1534 1 1 10 ILE HG21 H -3.084 2.976 4.274 1.00 . A A . 10 ILE HG21 1 1
8 1535 1 1 10 ILE HG22 H -3.961 1.856 3.213 1.00 . A A . 10 ILE HG22 1 1
8 1536 1 1 10 ILE HG23 H -2.314 1.465 3.748 1.00 . A A . 10 ILE HG23 1 1
8 1537 1 1 10 ILE N N 0.002 2.178 2.317 1.00 . A A . 10 ILE N 1 1
8 1538 1 1 10 ILE O O -1.085 4.464 4.416 1.00 . A A . 10 ILE O 1 1
8 1539 1 1 11 GLU C C 1.783 7.339 3.301 1.00 . A A . 11 GLU C 1 1
8 1540 1 1 11 GLU CA C 1.148 6.149 4.103 1.00 . A A . 11 GLU CA 1 1
8 1541 1 1 11 GLU CB C 2.058 5.501 5.192 1.00 . A A . 11 GLU CB 1 1
8 1542 1 1 11 GLU CD C 3.229 3.221 4.525 1.00 . A A . 11 GLU CD 1 1
8 1543 1 1 11 GLU CG C 3.336 4.742 4.752 1.00 . A A . 11 GLU CG 1 1
8 1544 1 1 11 GLU H H 1.149 4.924 2.269 1.00 . A A . 11 GLU H 1 1
8 1545 1 1 11 GLU HA H 0.307 6.547 4.708 1.00 . A A . 11 GLU HA 1 1
8 1546 1 1 11 GLU HB2 H 2.373 6.313 5.874 1.00 . A A . 11 GLU HB2 1 1
8 1547 1 1 11 GLU HB3 H 1.443 4.845 5.840 1.00 . A A . 11 GLU HB3 1 1
8 1548 1 1 11 GLU HG2 H 3.719 5.201 3.824 1.00 . A A . 11 GLU HG2 1 1
8 1549 1 1 11 GLU HG3 H 4.142 4.934 5.485 1.00 . A A . 11 GLU HG3 1 1
8 1550 1 1 11 GLU N N 0.637 5.143 3.130 1.00 . A A . 11 GLU N 1 1
8 1551 1 1 11 GLU O O 3.005 7.515 3.329 1.00 . A A . 11 GLU O 1 1
8 1552 1 1 11 GLU OE1 O 3.362 2.769 3.386 1.00 . A A . 11 GLU OE1 1 1
8 1553 1 1 12 THR C C 1.803 10.586 2.715 1.00 . A A . 12 THR C 1 1
8 1554 1 1 12 THR CA C 1.510 9.337 1.802 1.00 . A A . 12 THR CA 1 1
8 1555 1 1 12 THR CB C 0.588 9.663 0.575 1.00 . A A . 12 THR CB 1 1
8 1556 1 1 12 THR CG2 C 1.221 10.620 -0.463 1.00 . A A . 12 THR CG2 1 1
8 1557 1 1 12 THR H H -0.011 7.907 2.546 1.00 . A A . 12 THR H 1 1
8 1558 1 1 12 THR HA H 2.454 9.014 1.317 1.00 . A A . 12 THR HA 1 1
8 1559 1 1 12 THR HB H -0.353 10.125 0.934 1.00 . A A . 12 THR HB 1 1
8 1560 1 1 12 THR HG1 H -0.278 8.756 -0.887 1.00 . A A . 12 THR HG1 1 1
8 1561 1 1 12 THR HG21 H 1.473 11.608 -0.033 1.00 . A A . 12 THR HG21 1 1
8 1562 1 1 12 THR HG22 H 2.155 10.213 -0.897 1.00 . A A . 12 THR HG22 1 1
8 1563 1 1 12 THR HG23 H 0.539 10.820 -1.313 1.00 . A A . 12 THR HG23 1 1
8 1564 1 1 12 THR N N 0.975 8.185 2.605 1.00 . A A . 12 THR N 1 1
8 1565 1 1 12 THR O O 1.090 11.593 2.644 1.00 . A A . 12 THR O 1 1
8 1566 1 1 12 THR OG1 O 0.247 8.474 -0.135 1.00 . A A . 12 THR OG1 1 1
8 1567 1 1 13 THR C C 4.793 11.756 4.418 1.00 . A A . 13 THR C 1 1
8 1568 1 1 13 THR CA C 3.238 11.637 4.480 1.00 . A A . 13 THR CA 1 1
8 1569 1 1 13 THR CB C 2.615 11.471 5.905 1.00 . A A . 13 THR CB 1 1
8 1570 1 1 13 THR CG2 C 2.933 12.626 6.871 1.00 . A A . 13 THR CG2 1 1
8 1571 1 1 13 THR H H 3.223 9.580 3.743 1.00 . A A . 13 THR H 1 1
8 1572 1 1 13 THR HA H 2.847 12.592 4.076 1.00 . A A . 13 THR HA 1 1
8 1573 1 1 13 THR HB H 2.978 10.530 6.360 1.00 . A A . 13 THR HB 1 1
8 1574 1 1 13 THR HG1 H 0.873 11.356 6.720 1.00 . A A . 13 THR HG1 1 1
8 1575 1 1 13 THR HG21 H 2.460 12.471 7.858 1.00 . A A . 13 THR HG21 1 1
8 1576 1 1 13 THR HG22 H 4.020 12.726 7.049 1.00 . A A . 13 THR HG22 1 1
8 1577 1 1 13 THR HG23 H 2.572 13.597 6.482 1.00 . A A . 13 THR HG23 1 1
8 1578 1 1 13 THR N N 2.848 10.522 3.572 1.00 . A A . 13 THR N 1 1
8 1579 1 1 13 THR O O 5.297 12.668 3.755 1.00 . A A . 13 THR O 1 1
8 1580 1 1 13 THR OG1 O 1.194 11.397 5.817 1.00 . A A . 13 THR OG1 1 1
8 1581 1 1 14 ALA C C 7.573 9.929 3.980 1.00 . A A . 14 ALA C 1 1
8 1582 1 1 14 ALA CA C 7.030 10.872 5.079 1.00 . A A . 14 ALA CA 1 1
8 1583 1 1 14 ALA CB C 7.524 10.506 6.492 1.00 . A A . 14 ALA CB 1 1
8 1584 1 1 14 ALA H H 5.016 10.135 5.589 1.00 . A A . 14 ALA H 1 1
8 1585 1 1 14 ALA HXT H 7.308 11.451 2.797 1.00 . A A . 14 ALA HXT 1 1
8 1586 1 1 14 ALA HA H 7.405 11.894 4.872 1.00 . A A . 14 ALA HA 1 1
8 1587 1 1 14 ALA HB1 H 8.628 10.528 6.550 1.00 . A A . 14 ALA HB1 1 1
8 1588 1 1 14 ALA HB2 H 7.152 11.216 7.253 1.00 . A A . 14 ALA HB2 1 1
8 1589 1 1 14 ALA HB3 H 7.203 9.492 6.801 1.00 . A A . 14 ALA HB3 1 1
8 1590 1 1 14 ALA N N 5.548 10.848 5.078 1.00 . A A . 14 ALA N 1 1
8 1591 1 1 14 ALA O O 7.897 8.756 4.171 1.00 . A A . 14 ALA O 1 1
8 1592 1 1 14 ALA OXT O 7.636 10.550 2.757 1.00 . A A . 14 ALA OXT 1 1
9 1593 1 1 1 ACE C C 7.599 8.219 -2.479 1.00 . A A . 1 ACE C 1 1
9 1594 1 1 1 ACE CH3 C 7.654 9.742 -2.555 1.00 . A A . 1 ACE CH3 1 1
9 1595 1 1 1 ACE H1 H 6.790 10.143 -3.116 1.00 . A A . 1 ACE H1 1 1
9 1596 1 1 1 ACE H2 H 7.627 10.199 -1.549 1.00 . A A . 1 ACE H2 1 1
9 1597 1 1 1 ACE H3 H 8.571 10.089 -3.066 1.00 . A A . 1 ACE H3 1 1
9 1598 1 1 1 ACE O O 6.719 7.595 -3.076 1.00 . A A . 1 ACE O 1 1
9 1599 1 1 2 ILE C C 8.404 5.922 -0.027 1.00 . A A . 2 ILE C 1 1
9 1600 1 1 2 ILE CA C 8.676 6.173 -1.540 1.00 . A A . 2 ILE CA 1 1
9 1601 1 1 2 ILE CB C 10.053 5.606 -2.052 1.00 . A A . 2 ILE CB 1 1
9 1602 1 1 2 ILE CD1 C 9.373 5.324 -4.596 1.00 . A A . 2 ILE CD1 1 1
9 1603 1 1 2 ILE CG1 C 10.370 5.874 -3.558 1.00 . A A . 2 ILE CG1 1 1
9 1604 1 1 2 ILE CG2 C 10.240 4.095 -1.753 1.00 . A A . 2 ILE CG2 1 1
9 1605 1 1 2 ILE H H 9.134 8.319 -1.213 1.00 . A A . 2 ILE H 1 1
9 1606 1 1 2 ILE HA H 7.886 5.658 -2.120 1.00 . A A . 2 ILE HA 1 1
9 1607 1 1 2 ILE HB H 10.847 6.124 -1.480 1.00 . A A . 2 ILE HB 1 1
9 1608 1 1 2 ILE HD11 H 9.701 5.563 -5.624 1.00 . A A . 2 ILE HD11 1 1
9 1609 1 1 2 ILE HD12 H 9.275 4.225 -4.534 1.00 . A A . 2 ILE HD12 1 1
9 1610 1 1 2 ILE HD13 H 8.365 5.758 -4.471 1.00 . A A . 2 ILE HD13 1 1
9 1611 1 1 2 ILE HG12 H 10.467 6.963 -3.721 1.00 . A A . 2 ILE HG12 1 1
9 1612 1 1 2 ILE HG13 H 11.375 5.479 -3.800 1.00 . A A . 2 ILE HG13 1 1
9 1613 1 1 2 ILE HG21 H 10.204 3.881 -0.669 1.00 . A A . 2 ILE HG21 1 1
9 1614 1 1 2 ILE HG22 H 9.459 3.476 -2.231 1.00 . A A . 2 ILE HG22 1 1
9 1615 1 1 2 ILE HG23 H 11.219 3.721 -2.109 1.00 . A A . 2 ILE HG23 1 1
9 1616 1 1 2 ILE N N 8.560 7.650 -1.740 1.00 . A A . 2 ILE N 1 1
9 1617 1 1 2 ILE O O 9.121 6.435 0.840 1.00 . A A . 2 ILE O 1 1
9 1618 1 1 3 TRP C C 6.473 3.317 1.650 1.00 . A A . 3 TRP C 1 1
9 1619 1 1 3 TRP CA C 6.962 4.794 1.667 1.00 . A A . 3 TRP CA 1 1
9 1620 1 1 3 TRP CB C 5.882 5.734 2.295 1.00 . A A . 3 TRP CB 1 1
9 1621 1 1 3 TRP CD1 C 6.450 8.299 2.040 1.00 . A A . 3 TRP CD1 1 1
9 1622 1 1 3 TRP CD2 C 4.912 7.495 0.656 1.00 . A A . 3 TRP CD2 1 1
9 1623 1 1 3 TRP CE2 C 5.142 8.858 0.357 1.00 . A A . 3 TRP CE2 1 1
9 1624 1 1 3 TRP CE3 C 4.077 6.703 -0.169 1.00 . A A . 3 TRP CE3 1 1
9 1625 1 1 3 TRP CG C 5.713 7.146 1.721 1.00 . A A . 3 TRP CG 1 1
9 1626 1 1 3 TRP CH2 C 3.681 8.660 -1.562 1.00 . A A . 3 TRP CH2 1 1
9 1627 1 1 3 TRP CZ2 C 4.518 9.448 -0.767 1.00 . A A . 3 TRP CZ2 1 1
9 1628 1 1 3 TRP CZ3 C 3.464 7.307 -1.266 1.00 . A A . 3 TRP CZ3 1 1
9 1629 1 1 3 TRP H H 6.902 4.679 -0.532 1.00 . A A . 3 TRP H 1 1
9 1630 1 1 3 TRP HA H 7.853 4.901 2.321 1.00 . A A . 3 TRP HA 1 1
9 1631 1 1 3 TRP HB2 H 4.885 5.258 2.248 1.00 . A A . 3 TRP HB2 1 1
9 1632 1 1 3 TRP HB3 H 6.075 5.813 3.382 1.00 . A A . 3 TRP HB3 1 1
9 1633 1 1 3 TRP HD1 H 7.274 8.304 2.737 1.00 . A A . 3 TRP HD1 1 1
9 1634 1 1 3 TRP HE1 H 6.542 10.307 1.155 1.00 . A A . 3 TRP HE1 1 1
9 1635 1 1 3 TRP HE3 H 3.978 5.641 0.031 1.00 . A A . 3 TRP HE3 1 1
9 1636 1 1 3 TRP HH2 H 3.209 9.097 -2.430 1.00 . A A . 3 TRP HH2 1 1
9 1637 1 1 3 TRP HZ2 H 4.703 10.482 -1.025 1.00 . A A . 3 TRP HZ2 1 1
9 1638 1 1 3 TRP HZ3 H 2.833 6.716 -1.914 1.00 . A A . 3 TRP HZ3 1 1
9 1639 1 1 3 TRP N N 7.368 5.114 0.270 1.00 . A A . 3 TRP N 1 1
9 1640 1 1 3 TRP NE1 N 6.097 9.385 1.213 1.00 . A A . 3 TRP NE1 1 1
9 1641 1 1 3 TRP O O 5.412 3.003 1.098 1.00 . A A . 3 TRP O 1 1
9 1642 1 1 4 GLY C C 6.425 0.521 3.698 1.00 . A A . 4 GLY C 1 1
9 1643 1 1 4 GLY CA C 6.953 0.982 2.330 1.00 . A A . 4 GLY CA 1 1
9 1644 1 1 4 GLY H H 8.116 2.835 2.640 1.00 . A A . 4 GLY H 1 1
9 1645 1 1 4 GLY HA2 H 6.261 0.671 1.525 1.00 . A A . 4 GLY HA2 1 1
9 1646 1 1 4 GLY HA3 H 7.884 0.427 2.111 1.00 . A A . 4 GLY HA3 1 1
9 1647 1 1 4 GLY N N 7.262 2.427 2.261 1.00 . A A . 4 GLY N 1 1
9 1648 1 1 4 GLY O O 7.189 -0.022 4.501 1.00 . A A . 4 GLY O 1 1
9 1649 1 1 5 . C C 3.115 1.101 5.472 1.00 . A A . 5 SET C 1 1
9 1650 1 1 5 . CA C 4.451 0.304 5.210 1.00 . A A . 5 SET CA 1 1
9 1651 1 1 5 . CB C 4.153 -1.229 5.159 1.00 . A A . 5 SET CB 1 1
9 1652 1 1 5 . H H 4.644 1.294 3.234 1.00 . A A . 5 SET H 1 1
9 1653 1 1 5 . HA H 5.191 0.464 6.026 1.00 . A A . 5 SET HA 1 1
9 1654 1 1 5 . HB2 H 2.387 0.876 4.671 1.00 . A A . 5 SET HB2 1 1
9 1655 1 1 5 . HB3 H 2.636 0.670 6.373 1.00 . A A . 5 SET HB3 1 1
9 1656 1 1 5 . HNT2 H 2.951 3.024 6.606 1.00 . A A . 5 SET HNT2 1 1
9 1657 1 1 5 . N N 5.115 0.714 3.938 1.00 . A A . 5 SET N 1 1
9 1658 1 1 5 . NT N 3.134 2.580 5.690 1.00 . A A . 5 SET NT 1 1
9 1659 1 1 5 . OG O 3.632 -1.743 4.163 1.00 . A A . 5 SET OG 1 1
9 1660 1 1 6 SER C C 2.828 -3.944 6.145 1.00 . A A . 6 SER C 1 1
9 1661 1 1 6 SER CA C 4.284 -3.423 6.363 1.00 . A A . 6 SER CA 1 1
9 1662 1 1 6 SER CB C 4.849 -3.898 7.724 1.00 . A A . 6 SER CB 1 1
9 1663 1 1 6 SER H H 4.840 -1.406 7.044 1.00 . A A . 6 SER H 1 1
9 1664 1 1 6 SER HA H 4.956 -3.866 5.600 1.00 . A A . 6 SER HA 1 1
9 1665 1 1 6 SER HB2 H 4.830 -5.004 7.779 1.00 . A A . 6 SER HB2 1 1
9 1666 1 1 6 SER HB3 H 5.916 -3.622 7.822 1.00 . A A . 6 SER HB3 1 1
9 1667 1 1 6 SER HG H 3.195 -3.544 8.655 1.00 . A A . 6 SER HG 1 1
9 1668 1 1 6 SER N N 4.464 -1.948 6.259 1.00 . A A . 6 SER N 1 1
9 1669 1 1 6 SER O O 1.910 -3.559 6.878 1.00 . A A . 6 SER O 1 1
9 1670 1 1 6 SER OG O 4.123 -3.364 8.830 1.00 . A A . 6 SER OG 1 1
9 1671 1 1 7 GLY C C 0.577 -4.582 3.724 1.00 . A A . 7 GLY C 1 1
9 1672 1 1 7 GLY CA C 1.317 -5.390 4.805 1.00 . A A . 7 GLY CA 1 1
9 1673 1 1 7 GLY H H 3.463 -5.004 4.552 1.00 . A A . 7 GLY H 1 1
9 1674 1 1 7 GLY HA2 H 1.468 -6.421 4.432 1.00 . A A . 7 GLY HA2 1 1
9 1675 1 1 7 GLY HA3 H 0.686 -5.514 5.709 1.00 . A A . 7 GLY HA3 1 1
9 1676 1 1 7 GLY N N 2.641 -4.816 5.135 1.00 . A A . 7 GLY N 1 1
9 1677 1 1 7 GLY O O 0.586 -4.952 2.547 1.00 . A A . 7 GLY O 1 1
9 1678 1 1 8 LYS C C -0.007 -1.262 3.179 1.00 . A A . 8 LYS C 1 1
9 1679 1 1 8 LYS CA C -0.830 -2.577 3.281 1.00 . A A . 8 LYS CA 1 1
9 1680 1 1 8 LYS CB C -2.226 -2.390 3.927 1.00 . A A . 8 LYS CB 1 1
9 1681 1 1 8 LYS CD C -4.548 -1.282 3.791 1.00 . A A . 8 LYS CD 1 1
9 1682 1 1 8 LYS CE C -5.445 -2.496 4.107 1.00 . A A . 8 LYS CE 1 1
9 1683 1 1 8 LYS CG C -3.242 -1.627 3.051 1.00 . A A . 8 LYS CG 1 1
9 1684 1 1 8 LYS H H 0.128 -3.207 5.116 1.00 . A A . 8 LYS H 1 1
9 1685 1 1 8 LYS HA H -0.985 -3.030 2.279 1.00 . A A . 8 LYS HA 1 1
9 1686 1 1 8 LYS HB2 H -2.657 -3.382 4.162 1.00 . A A . 8 LYS HB2 1 1
9 1687 1 1 8 LYS HB3 H -2.121 -1.880 4.905 1.00 . A A . 8 LYS HB3 1 1
9 1688 1 1 8 LYS HD2 H -4.298 -0.736 4.722 1.00 . A A . 8 LYS HD2 1 1
9 1689 1 1 8 LYS HD3 H -5.105 -0.560 3.166 1.00 . A A . 8 LYS HD3 1 1
9 1690 1 1 8 LYS HE2 H -5.655 -3.068 3.182 1.00 . A A . 8 LYS HE2 1 1
9 1691 1 1 8 LYS HE3 H -4.920 -3.196 4.785 1.00 . A A . 8 LYS HE3 1 1
9 1692 1 1 8 LYS HG2 H -2.784 -0.682 2.700 1.00 . A A . 8 LYS HG2 1 1
9 1693 1 1 8 LYS HG3 H -3.460 -2.198 2.130 1.00 . A A . 8 LYS HG3 1 1
9 1694 1 1 8 LYS HZ1 H -6.560 -1.562 5.607 1.00 . A A . 8 LYS HZ1 1 1
9 1695 1 1 8 LYS HZ2 H -7.251 -1.444 4.116 1.00 . A A . 8 LYS HZ2 1 1
9 1696 1 1 8 LYS HZ3 H -7.326 -2.866 4.949 1.00 . A A . 8 LYS HZ3 1 1
9 1697 1 1 8 LYS N N -0.069 -3.488 4.156 1.00 . A A . 8 LYS N 1 1
9 1698 1 1 8 LYS NZ N -6.716 -2.070 4.729 1.00 . A A . 8 LYS NZ 1 1
9 1699 1 1 8 LYS O O 0.080 -0.479 4.132 1.00 . A A . 8 LYS O 1 1
9 1700 1 1 9 LEU C C 0.494 1.381 1.427 1.00 . A A . 9 LEU C 1 1
9 1701 1 1 9 LEU CA C 1.420 0.150 1.695 1.00 . A A . 9 LEU CA 1 1
9 1702 1 1 9 LEU CB C 2.381 -0.127 0.497 1.00 . A A . 9 LEU CB 1 1
9 1703 1 1 9 LEU CD1 C 3.321 -2.524 0.894 1.00 . A A . 9 LEU CD1 1 1
9 1704 1 1 9 LEU CD2 C 4.657 -0.838 -0.399 1.00 . A A . 9 LEU CD2 1 1
9 1705 1 1 9 LEU CG C 3.632 -1.022 0.741 1.00 . A A . 9 LEU CG 1 1
9 1706 1 1 9 LEU H H 0.551 -1.884 1.404 1.00 . A A . 9 LEU H 1 1
9 1707 1 1 9 LEU HA H 2.068 0.374 2.563 1.00 . A A . 9 LEU HA 1 1
9 1708 1 1 9 LEU HB2 H 1.811 -0.504 -0.375 1.00 . A A . 9 LEU HB2 1 1
9 1709 1 1 9 LEU HB3 H 2.757 0.861 0.162 1.00 . A A . 9 LEU HB3 1 1
9 1710 1 1 9 LEU HD11 H 2.787 -2.932 0.014 1.00 . A A . 9 LEU HD11 1 1
9 1711 1 1 9 LEU HD12 H 4.243 -3.122 1.023 1.00 . A A . 9 LEU HD12 1 1
9 1712 1 1 9 LEU HD13 H 2.699 -2.731 1.783 1.00 . A A . 9 LEU HD13 1 1
9 1713 1 1 9 LEU HD21 H 5.585 -1.412 -0.214 1.00 . A A . 9 LEU HD21 1 1
9 1714 1 1 9 LEU HD22 H 4.258 -1.168 -1.377 1.00 . A A . 9 LEU HD22 1 1
9 1715 1 1 9 LEU HD23 H 4.960 0.219 -0.512 1.00 . A A . 9 LEU HD23 1 1
9 1716 1 1 9 LEU HG H 4.121 -0.683 1.672 1.00 . A A . 9 LEU HG 1 1
9 1717 1 1 9 LEU N N 0.586 -1.049 1.997 1.00 . A A . 9 LEU N 1 1
9 1718 1 1 9 LEU O O 0.076 1.623 0.289 1.00 . A A . 9 LEU O 1 1
9 1719 1 1 10 ILE C C -0.347 4.364 3.517 1.00 . A A . 10 ILE C 1 1
9 1720 1 1 10 ILE CA C -0.721 3.334 2.402 1.00 . A A . 10 ILE CA 1 1
9 1721 1 1 10 ILE CB C -2.241 2.913 2.326 1.00 . A A . 10 ILE CB 1 1
9 1722 1 1 10 ILE CD1 C -3.001 4.633 0.529 1.00 . A A . 10 ILE CD1 1 1
9 1723 1 1 10 ILE CG1 C -3.205 4.072 1.944 1.00 . A A . 10 ILE CG1 1 1
9 1724 1 1 10 ILE CG2 C -2.793 2.177 3.574 1.00 . A A . 10 ILE CG2 1 1
9 1725 1 1 10 ILE H H 0.496 1.793 3.395 1.00 . A A . 10 ILE H 1 1
9 1726 1 1 10 ILE HA H -0.492 3.831 1.438 1.00 . A A . 10 ILE HA 1 1
9 1727 1 1 10 ILE HB H -2.324 2.175 1.503 1.00 . A A . 10 ILE HB 1 1
9 1728 1 1 10 ILE HD11 H -3.778 5.378 0.284 1.00 . A A . 10 ILE HD11 1 1
9 1729 1 1 10 ILE HD12 H -2.023 5.135 0.421 1.00 . A A . 10 ILE HD12 1 1
9 1730 1 1 10 ILE HD13 H -3.054 3.835 -0.234 1.00 . A A . 10 ILE HD13 1 1
9 1731 1 1 10 ILE HG12 H -4.253 3.721 2.008 1.00 . A A . 10 ILE HG12 1 1
9 1732 1 1 10 ILE HG13 H -3.131 4.892 2.683 1.00 . A A . 10 ILE HG13 1 1
9 1733 1 1 10 ILE HG21 H -2.901 2.843 4.450 1.00 . A A . 10 ILE HG21 1 1
9 1734 1 1 10 ILE HG22 H -3.791 1.743 3.381 1.00 . A A . 10 ILE HG22 1 1
9 1735 1 1 10 ILE HG23 H -2.140 1.340 3.883 1.00 . A A . 10 ILE HG23 1 1
9 1736 1 1 10 ILE N N 0.167 2.142 2.491 1.00 . A A . 10 ILE N 1 1
9 1737 1 1 10 ILE O O -0.981 4.424 4.574 1.00 . A A . 10 ILE O 1 1
9 1738 1 1 11 GLU C C 1.758 7.405 3.386 1.00 . A A . 11 GLU C 1 1
9 1739 1 1 11 GLU CA C 1.155 6.225 4.227 1.00 . A A . 11 GLU CA 1 1
9 1740 1 1 11 GLU CB C 2.051 5.681 5.385 1.00 . A A . 11 GLU CB 1 1
9 1741 1 1 11 GLU CD C 3.294 3.464 4.686 1.00 . A A . 11 GLU CD 1 1
9 1742 1 1 11 GLU CG C 3.382 4.954 5.072 1.00 . A A . 11 GLU CG 1 1
9 1743 1 1 11 GLU H H 1.233 4.956 2.425 1.00 . A A . 11 GLU H 1 1
9 1744 1 1 11 GLU HA H 0.280 6.603 4.797 1.00 . A A . 11 GLU HA 1 1
9 1745 1 1 11 GLU HB2 H 2.295 6.543 6.033 1.00 . A A . 11 GLU HB2 1 1
9 1746 1 1 11 GLU HB3 H 1.437 5.032 6.039 1.00 . A A . 11 GLU HB3 1 1
9 1747 1 1 11 GLU HG2 H 3.916 5.501 4.276 1.00 . A A . 11 GLU HG2 1 1
9 1748 1 1 11 GLU HG3 H 4.061 5.063 5.938 1.00 . A A . 11 GLU HG3 1 1
9 1749 1 1 11 GLU N N 0.700 5.175 3.275 1.00 . A A . 11 GLU N 1 1
9 1750 1 1 11 GLU O O 2.983 7.537 3.314 1.00 . A A . 11 GLU O 1 1
9 1751 1 1 11 GLU OE1 O 3.480 3.138 3.511 1.00 . A A . 11 GLU OE1 1 1
9 1752 1 1 12 THR C C 1.883 10.626 2.830 1.00 . A A . 12 THR C 1 1
9 1753 1 1 12 THR CA C 1.431 9.426 1.917 1.00 . A A . 12 THR CA 1 1
9 1754 1 1 12 THR CB C 0.393 9.843 0.815 1.00 . A A . 12 THR CB 1 1
9 1755 1 1 12 THR CG2 C 0.889 10.905 -0.198 1.00 . A A . 12 THR CG2 1 1
9 1756 1 1 12 THR H H -0.059 7.997 2.721 1.00 . A A . 12 THR H 1 1
9 1757 1 1 12 THR HA H 2.294 9.071 1.316 1.00 . A A . 12 THR HA 1 1
9 1758 1 1 12 THR HB H -0.516 10.258 1.293 1.00 . A A . 12 THR HB 1 1
9 1759 1 1 12 THR HG1 H 0.801 8.427 -0.425 1.00 . A A . 12 THR HG1 1 1
9 1760 1 1 12 THR HG21 H 1.789 10.584 -0.749 1.00 . A A . 12 THR HG21 1 1
9 1761 1 1 12 THR HG22 H 0.120 11.136 -0.959 1.00 . A A . 12 THR HG22 1 1
9 1762 1 1 12 THR HG23 H 1.142 11.868 0.285 1.00 . A A . 12 THR HG23 1 1
9 1763 1 1 12 THR N N 0.928 8.275 2.747 1.00 . A A . 12 THR N 1 1
9 1764 1 1 12 THR O O 1.188 11.645 2.915 1.00 . A A . 12 THR O 1 1
9 1765 1 1 12 THR OG1 O 0.012 8.705 0.045 1.00 . A A . 12 THR OG1 1 1
9 1766 1 1 13 THR C C 4.363 12.641 3.537 1.00 . A A . 13 THR C 1 1
9 1767 1 1 13 THR CA C 3.586 11.590 4.393 1.00 . A A . 13 THR CA 1 1
9 1768 1 1 13 THR CB C 4.390 10.995 5.596 1.00 . A A . 13 THR CB 1 1
9 1769 1 1 13 THR CG2 C 4.767 12.038 6.664 1.00 . A A . 13 THR CG2 1 1
9 1770 1 1 13 THR H H 3.360 9.540 3.635 1.00 . A A . 13 THR H 1 1
9 1771 1 1 13 THR HA H 2.726 12.122 4.847 1.00 . A A . 13 THR HA 1 1
9 1772 1 1 13 THR HB H 5.332 10.535 5.236 1.00 . A A . 13 THR HB 1 1
9 1773 1 1 13 THR HG1 H 2.862 10.429 6.625 1.00 . A A . 13 THR HG1 1 1
9 1774 1 1 13 THR HG21 H 5.319 11.573 7.501 1.00 . A A . 13 THR HG21 1 1
9 1775 1 1 13 THR HG22 H 5.417 12.832 6.252 1.00 . A A . 13 THR HG22 1 1
9 1776 1 1 13 THR HG23 H 3.875 12.532 7.093 1.00 . A A . 13 THR HG23 1 1
9 1777 1 1 13 THR N N 3.048 10.511 3.508 1.00 . A A . 13 THR N 1 1
9 1778 1 1 13 THR O O 3.882 13.769 3.391 1.00 . A A . 13 THR O 1 1
9 1779 1 1 13 THR OG1 O 3.632 9.987 6.260 1.00 . A A . 13 THR OG1 1 1
9 1780 1 1 14 ALA C C 5.955 13.038 0.645 1.00 . A A . 14 ALA C 1 1
9 1781 1 1 14 ALA CA C 6.348 13.193 2.134 1.00 . A A . 14 ALA CA 1 1
9 1782 1 1 14 ALA CB C 7.836 12.901 2.407 1.00 . A A . 14 ALA CB 1 1
9 1783 1 1 14 ALA H H 5.815 11.309 3.150 1.00 . A A . 14 ALA H 1 1
9 1784 1 1 14 ALA HXT H 4.444 14.169 1.116 1.00 . A A . 14 ALA HXT 1 1
9 1785 1 1 14 ALA HA H 6.174 14.247 2.427 1.00 . A A . 14 ALA HA 1 1
9 1786 1 1 14 ALA HB1 H 8.117 11.863 2.146 1.00 . A A . 14 ALA HB1 1 1
9 1787 1 1 14 ALA HB2 H 8.492 13.570 1.818 1.00 . A A . 14 ALA HB2 1 1
9 1788 1 1 14 ALA HB3 H 8.098 13.056 3.471 1.00 . A A . 14 ALA HB3 1 1
9 1789 1 1 14 ALA N N 5.534 12.280 2.971 1.00 . A A . 14 ALA N 1 1
9 1790 1 1 14 ALA O O 6.580 12.361 -0.173 1.00 . A A . 14 ALA O 1 1
9 1791 1 1 14 ALA OXT O 4.812 13.735 0.343 1.00 . A A . 14 ALA OXT 1 1
10 1792 1 1 1 ACE C C 6.776 7.332 -4.056 1.00 . A A . 1 ACE C 1 1
10 1793 1 1 1 ACE CH3 C 5.799 7.876 -5.094 1.00 . A A . 1 ACE CH3 1 1
10 1794 1 1 1 ACE H1 H 5.874 8.976 -5.184 1.00 . A A . 1 ACE H1 1 1
10 1795 1 1 1 ACE H2 H 6.004 7.450 -6.093 1.00 . A A . 1 ACE H2 1 1
10 1796 1 1 1 ACE H3 H 4.753 7.623 -4.837 1.00 . A A . 1 ACE H3 1 1
10 1797 1 1 1 ACE O O 7.640 6.513 -4.376 1.00 . A A . 1 ACE O 1 1
10 1798 1 1 2 ILE C C 6.488 6.774 -0.627 1.00 . A A . 2 ILE C 1 1
10 1799 1 1 2 ILE CA C 7.467 7.405 -1.661 1.00 . A A . 2 ILE CA 1 1
10 1800 1 1 2 ILE CB C 8.320 8.605 -1.102 1.00 . A A . 2 ILE CB 1 1
10 1801 1 1 2 ILE CD1 C 10.412 8.333 -2.707 1.00 . A A . 2 ILE CD1 1 1
10 1802 1 1 2 ILE CG1 C 9.313 9.242 -2.127 1.00 . A A . 2 ILE CG1 1 1
10 1803 1 1 2 ILE CG2 C 9.079 8.269 0.208 1.00 . A A . 2 ILE CG2 1 1
10 1804 1 1 2 ILE H H 5.804 8.432 -2.710 1.00 . A A . 2 ILE H 1 1
10 1805 1 1 2 ILE HA H 8.202 6.634 -1.972 1.00 . A A . 2 ILE HA 1 1
10 1806 1 1 2 ILE HB H 7.610 9.409 -0.828 1.00 . A A . 2 ILE HB 1 1
10 1807 1 1 2 ILE HD11 H 11.058 8.892 -3.408 1.00 . A A . 2 ILE HD11 1 1
10 1808 1 1 2 ILE HD12 H 11.070 7.922 -1.919 1.00 . A A . 2 ILE HD12 1 1
10 1809 1 1 2 ILE HD13 H 9.991 7.479 -3.269 1.00 . A A . 2 ILE HD13 1 1
10 1810 1 1 2 ILE HG12 H 8.741 9.666 -2.973 1.00 . A A . 2 ILE HG12 1 1
10 1811 1 1 2 ILE HG13 H 9.802 10.119 -1.664 1.00 . A A . 2 ILE HG13 1 1
10 1812 1 1 2 ILE HG21 H 8.389 7.989 1.025 1.00 . A A . 2 ILE HG21 1 1
10 1813 1 1 2 ILE HG22 H 9.784 7.428 0.077 1.00 . A A . 2 ILE HG22 1 1
10 1814 1 1 2 ILE HG23 H 9.662 9.132 0.581 1.00 . A A . 2 ILE HG23 1 1
10 1815 1 1 2 ILE N N 6.615 7.814 -2.818 1.00 . A A . 2 ILE N 1 1
10 1816 1 1 2 ILE O O 5.721 7.495 0.022 1.00 . A A . 2 ILE O 1 1
10 1817 1 1 3 TRP C C 6.301 3.319 0.797 1.00 . A A . 3 TRP C 1 1
10 1818 1 1 3 TRP CA C 5.649 4.696 0.462 1.00 . A A . 3 TRP CA 1 1
10 1819 1 1 3 TRP CB C 4.148 4.609 0.068 1.00 . A A . 3 TRP CB 1 1
10 1820 1 1 3 TRP CD1 C 4.297 2.990 -2.077 1.00 . A A . 3 TRP CD1 1 1
10 1821 1 1 3 TRP CD2 C 2.283 3.694 -1.465 1.00 . A A . 3 TRP CD2 1 1
10 1822 1 1 3 TRP CE2 C 2.164 2.855 -2.598 1.00 . A A . 3 TRP CE2 1 1
10 1823 1 1 3 TRP CE3 C 1.135 4.294 -0.894 1.00 . A A . 3 TRP CE3 1 1
10 1824 1 1 3 TRP CG C 3.620 3.786 -1.122 1.00 . A A . 3 TRP CG 1 1
10 1825 1 1 3 TRP CH2 C -0.228 3.219 -2.600 1.00 . A A . 3 TRP CH2 1 1
10 1826 1 1 3 TRP CZ2 C 0.892 2.611 -3.172 1.00 . A A . 3 TRP CZ2 1 1
10 1827 1 1 3 TRP CZ3 C -0.108 4.052 -1.480 1.00 . A A . 3 TRP CZ3 1 1
10 1828 1 1 3 TRP H H 7.328 4.952 -0.872 1.00 . A A . 3 TRP H 1 1
10 1829 1 1 3 TRP HA H 5.650 5.319 1.382 1.00 . A A . 3 TRP HA 1 1
10 1830 1 1 3 TRP HB2 H 3.599 4.263 0.963 1.00 . A A . 3 TRP HB2 1 1
10 1831 1 1 3 TRP HB3 H 3.779 5.642 -0.070 1.00 . A A . 3 TRP HB3 1 1
10 1832 1 1 3 TRP HD1 H 5.362 2.831 -2.114 1.00 . A A . 3 TRP HD1 1 1
10 1833 1 1 3 TRP HE1 H 3.633 1.786 -3.787 1.00 . A A . 3 TRP HE1 1 1
10 1834 1 1 3 TRP HE3 H 1.233 4.931 -0.026 1.00 . A A . 3 TRP HE3 1 1
10 1835 1 1 3 TRP HH2 H -1.204 3.043 -3.029 1.00 . A A . 3 TRP HH2 1 1
10 1836 1 1 3 TRP HZ2 H 0.788 1.975 -4.039 1.00 . A A . 3 TRP HZ2 1 1
10 1837 1 1 3 TRP HZ3 H -0.991 4.509 -1.061 1.00 . A A . 3 TRP HZ3 1 1
10 1838 1 1 3 TRP N N 6.509 5.430 -0.492 1.00 . A A . 3 TRP N 1 1
10 1839 1 1 3 TRP NE1 N 3.408 2.399 -2.995 1.00 . A A . 3 TRP NE1 1 1
10 1840 1 1 3 TRP O O 6.753 2.571 -0.078 1.00 . A A . 3 TRP O 1 1
10 1841 1 1 4 GLY C C 6.293 1.450 3.991 1.00 . A A . 4 GLY C 1 1
10 1842 1 1 4 GLY CA C 6.912 1.752 2.618 1.00 . A A . 4 GLY CA 1 1
10 1843 1 1 4 GLY H H 5.961 3.730 2.697 1.00 . A A . 4 GLY H 1 1
10 1844 1 1 4 GLY HA2 H 6.749 0.915 1.913 1.00 . A A . 4 GLY HA2 1 1
10 1845 1 1 4 GLY HA3 H 8.005 1.874 2.725 1.00 . A A . 4 GLY HA3 1 1
10 1846 1 1 4 GLY N N 6.344 3.008 2.093 1.00 . A A . 4 GLY N 1 1
10 1847 1 1 4 GLY O O 6.793 1.931 5.012 1.00 . A A . 4 GLY O 1 1
10 1848 1 1 5 . C C 3.117 1.115 5.398 1.00 . A A . 5 SET C 1 1
10 1849 1 1 5 . CA C 4.463 0.297 5.238 1.00 . A A . 5 SET CA 1 1
10 1850 1 1 5 . CB C 4.189 -1.237 5.190 1.00 . A A . 5 SET CB 1 1
10 1851 1 1 5 . H H 4.886 0.364 3.069 1.00 . A A . 5 SET H 1 1
10 1852 1 1 5 . HA H 5.151 0.448 6.101 1.00 . A A . 5 SET HA 1 1
10 1853 1 1 5 . HB2 H 2.384 0.775 4.644 1.00 . A A . 5 SET HB2 1 1
10 1854 1 1 5 . HB3 H 2.645 0.824 6.354 1.00 . A A . 5 SET HB3 1 1
10 1855 1 1 5 . HNT2 H 3.118 3.206 6.218 1.00 . A A . 5 SET HNT2 1 1
10 1856 1 1 5 . N N 5.204 0.662 3.998 1.00 . A A . 5 SET N 1 1
10 1857 1 1 5 . NT N 3.143 2.614 5.373 1.00 . A A . 5 SET NT 1 1
10 1858 1 1 5 . OG O 3.760 -1.779 4.163 1.00 . A A . 5 SET OG 1 1
10 1859 1 1 6 SER C C 2.818 -3.955 6.142 1.00 . A A . 6 SER C 1 1
10 1860 1 1 6 SER CA C 4.246 -3.404 6.446 1.00 . A A . 6 SER CA 1 1
10 1861 1 1 6 SER CB C 4.730 -3.848 7.847 1.00 . A A . 6 SER CB 1 1
10 1862 1 1 6 SER H H 4.696 -1.361 7.135 1.00 . A A . 6 SER H 1 1
10 1863 1 1 6 SER HA H 4.973 -3.850 5.737 1.00 . A A . 6 SER HA 1 1
10 1864 1 1 6 SER HB2 H 4.724 -4.953 7.921 1.00 . A A . 6 SER HB2 1 1
10 1865 1 1 6 SER HB3 H 5.785 -3.554 8.009 1.00 . A A . 6 SER HB3 1 1
10 1866 1 1 6 SER HG H 3.016 -3.511 8.668 1.00 . A A . 6 SER HG 1 1
10 1867 1 1 6 SER N N 4.413 -1.928 6.328 1.00 . A A . 6 SER N 1 1
10 1868 1 1 6 SER O O 1.853 -3.609 6.833 1.00 . A A . 6 SER O 1 1
10 1869 1 1 6 SER OG O 3.928 -3.308 8.896 1.00 . A A . 6 SER OG 1 1
10 1870 1 1 7 GLY C C 0.648 -4.570 3.659 1.00 . A A . 7 GLY C 1 1
10 1871 1 1 7 GLY CA C 1.412 -5.412 4.698 1.00 . A A . 7 GLY CA 1 1
10 1872 1 1 7 GLY H H 3.558 -4.963 4.560 1.00 . A A . 7 GLY H 1 1
10 1873 1 1 7 GLY HA2 H 1.620 -6.405 4.260 1.00 . A A . 7 GLY HA2 1 1
10 1874 1 1 7 GLY HA3 H 0.774 -5.628 5.577 1.00 . A A . 7 GLY HA3 1 1
10 1875 1 1 7 GLY N N 2.704 -4.808 5.104 1.00 . A A . 7 GLY N 1 1
10 1876 1 1 7 GLY O O 0.684 -4.864 2.462 1.00 . A A . 7 GLY O 1 1
10 1877 1 1 8 LYS C C -0.039 -1.288 3.203 1.00 . A A . 8 LYS C 1 1
10 1878 1 1 8 LYS CA C -0.845 -2.608 3.330 1.00 . A A . 8 LYS CA 1 1
10 1879 1 1 8 LYS CB C -2.212 -2.423 4.038 1.00 . A A . 8 LYS CB 1 1
10 1880 1 1 8 LYS CD C -4.515 -1.251 4.064 1.00 . A A . 8 LYS CD 1 1
10 1881 1 1 8 LYS CE C -5.427 -2.466 4.325 1.00 . A A . 8 LYS CE 1 1
10 1882 1 1 8 LYS CG C -3.239 -1.569 3.262 1.00 . A A . 8 LYS CG 1 1
10 1883 1 1 8 LYS H H 0.156 -3.298 5.124 1.00 . A A . 8 LYS H 1 1
10 1884 1 1 8 LYS HA H -1.048 -3.046 2.330 1.00 . A A . 8 LYS HA 1 1
10 1885 1 1 8 LYS HB2 H -2.661 -3.418 4.226 1.00 . A A . 8 LYS HB2 1 1
10 1886 1 1 8 LYS HB3 H -2.055 -1.981 5.043 1.00 . A A . 8 LYS HB3 1 1
10 1887 1 1 8 LYS HD2 H -4.228 -0.773 5.023 1.00 . A A . 8 LYS HD2 1 1
10 1888 1 1 8 LYS HD3 H -5.076 -0.476 3.509 1.00 . A A . 8 LYS HD3 1 1
10 1889 1 1 8 LYS HE2 H -5.677 -2.969 3.370 1.00 . A A . 8 LYS HE2 1 1
10 1890 1 1 8 LYS HE3 H -4.896 -3.222 4.936 1.00 . A A . 8 LYS HE3 1 1
10 1891 1 1 8 LYS HG2 H -2.772 -0.607 2.975 1.00 . A A . 8 LYS HG2 1 1
10 1892 1 1 8 LYS HG3 H -3.499 -2.059 2.304 1.00 . A A . 8 LYS HG3 1 1
10 1893 1 1 8 LYS HZ1 H -6.476 -1.618 5.921 1.00 . A A . 8 LYS HZ1 1 1
10 1894 1 1 8 LYS HZ2 H -7.210 -1.385 4.464 1.00 . A A . 8 LYS HZ2 1 1
10 1895 1 1 8 LYS HZ3 H -7.288 -2.860 5.199 1.00 . A A . 8 LYS HZ3 1 1
10 1896 1 1 8 LYS N N -0.050 -3.537 4.154 1.00 . A A . 8 LYS N 1 1
10 1897 1 1 8 LYS NZ N -6.669 -2.061 5.015 1.00 . A A . 8 LYS NZ 1 1
10 1898 1 1 8 LYS O O 0.062 -0.503 4.153 1.00 . A A . 8 LYS O 1 1
10 1899 1 1 9 LEU C C 0.327 1.342 1.456 1.00 . A A . 9 LEU C 1 1
10 1900 1 1 9 LEU CA C 1.313 0.157 1.693 1.00 . A A . 9 LEU CA 1 1
10 1901 1 1 9 LEU CB C 2.267 -0.048 0.478 1.00 . A A . 9 LEU CB 1 1
10 1902 1 1 9 LEU CD1 C 3.338 -2.387 0.826 1.00 . A A . 9 LEU CD1 1 1
10 1903 1 1 9 LEU CD2 C 4.605 -0.578 -0.382 1.00 . A A . 9 LEU CD2 1 1
10 1904 1 1 9 LEU CG C 3.569 -0.866 0.722 1.00 . A A . 9 LEU CG 1 1
10 1905 1 1 9 LEU H H 0.540 -1.913 1.430 1.00 . A A . 9 LEU H 1 1
10 1906 1 1 9 LEU HA H 1.969 0.396 2.552 1.00 . A A . 9 LEU HA 1 1
10 1907 1 1 9 LEU HB2 H 1.711 -0.457 -0.389 1.00 . A A . 9 LEU HB2 1 1
10 1908 1 1 9 LEU HB3 H 2.577 0.962 0.142 1.00 . A A . 9 LEU HB3 1 1
10 1909 1 1 9 LEU HD11 H 2.847 -2.797 -0.076 1.00 . A A . 9 LEU HD11 1 1
10 1910 1 1 9 LEU HD12 H 4.289 -2.936 0.962 1.00 . A A . 9 LEU HD12 1 1
10 1911 1 1 9 LEU HD13 H 2.709 -2.653 1.695 1.00 . A A . 9 LEU HD13 1 1
10 1912 1 1 9 LEU HD21 H 5.554 -1.116 -0.205 1.00 . A A . 9 LEU HD21 1 1
10 1913 1 1 9 LEU HD22 H 4.240 -0.871 -1.385 1.00 . A A . 9 LEU HD22 1 1
10 1914 1 1 9 LEU HD23 H 4.860 0.497 -0.428 1.00 . A A . 9 LEU HD23 1 1
10 1915 1 1 9 LEU HG H 4.016 -0.526 1.674 1.00 . A A . 9 LEU HG 1 1
10 1916 1 1 9 LEU N N 0.522 -1.065 2.005 1.00 . A A . 9 LEU N 1 1
10 1917 1 1 9 LEU O O -0.262 1.471 0.378 1.00 . A A . 9 LEU O 1 1
10 1918 1 1 10 ILE C C -0.158 4.515 3.291 1.00 . A A . 10 ILE C 1 1
10 1919 1 1 10 ILE CA C -0.778 3.349 2.454 1.00 . A A . 10 ILE CA 1 1
10 1920 1 1 10 ILE CB C -2.264 2.937 2.782 1.00 . A A . 10 ILE CB 1 1
10 1921 1 1 10 ILE CD1 C -3.378 4.586 1.098 1.00 . A A . 10 ILE CD1 1 1
10 1922 1 1 10 ILE CG1 C -3.310 4.062 2.539 1.00 . A A . 10 ILE CG1 1 1
10 1923 1 1 10 ILE CG2 C -2.487 2.328 4.192 1.00 . A A . 10 ILE CG2 1 1
10 1924 1 1 10 ILE H H 0.631 1.919 3.354 1.00 . A A . 10 ILE H 1 1
10 1925 1 1 10 ILE HA H -0.793 3.714 1.409 1.00 . A A . 10 ILE HA 1 1
10 1926 1 1 10 ILE HB H -2.527 2.128 2.072 1.00 . A A . 10 ILE HB 1 1
10 1927 1 1 10 ILE HD11 H -4.223 5.285 0.969 1.00 . A A . 10 ILE HD11 1 1
10 1928 1 1 10 ILE HD12 H -2.460 5.134 0.818 1.00 . A A . 10 ILE HD12 1 1
10 1929 1 1 10 ILE HD13 H -3.511 3.763 0.371 1.00 . A A . 10 ILE HD13 1 1
10 1930 1 1 10 ILE HG12 H -4.318 3.691 2.805 1.00 . A A . 10 ILE HG12 1 1
10 1931 1 1 10 ILE HG13 H -3.127 4.911 3.227 1.00 . A A . 10 ILE HG13 1 1
10 1932 1 1 10 ILE HG21 H -1.811 1.475 4.383 1.00 . A A . 10 ILE HG21 1 1
10 1933 1 1 10 ILE HG22 H -2.321 3.063 5.001 1.00 . A A . 10 ILE HG22 1 1
10 1934 1 1 10 ILE HG23 H -3.517 1.942 4.312 1.00 . A A . 10 ILE HG23 1 1
10 1935 1 1 10 ILE N N 0.132 2.172 2.498 1.00 . A A . 10 ILE N 1 1
10 1936 1 1 10 ILE O O -0.630 4.860 4.378 1.00 . A A . 10 ILE O 1 1
10 1937 1 1 11 GLU C C 2.371 7.067 2.264 1.00 . A A . 11 GLU C 1 1
10 1938 1 1 11 GLU CA C 1.641 6.252 3.394 1.00 . A A . 11 GLU CA 1 1
10 1939 1 1 11 GLU CB C 2.543 5.804 4.588 1.00 . A A . 11 GLU CB 1 1
10 1940 1 1 11 GLU CD C 3.304 3.310 4.229 1.00 . A A . 11 GLU CD 1 1
10 1941 1 1 11 GLU CG C 3.692 4.795 4.348 1.00 . A A . 11 GLU CG 1 1
10 1942 1 1 11 GLU H H 1.252 4.692 1.884 1.00 . A A . 11 GLU H 1 1
10 1943 1 1 11 GLU HA H 0.907 6.909 3.900 1.00 . A A . 11 GLU HA 1 1
10 1944 1 1 11 GLU HB2 H 2.995 6.719 5.015 1.00 . A A . 11 GLU HB2 1 1
10 1945 1 1 11 GLU HB3 H 1.901 5.425 5.407 1.00 . A A . 11 GLU HB3 1 1
10 1946 1 1 11 GLU HG2 H 4.261 5.083 3.443 1.00 . A A . 11 GLU HG2 1 1
10 1947 1 1 11 GLU HG3 H 4.443 4.913 5.153 1.00 . A A . 11 GLU HG3 1 1
10 1948 1 1 11 GLU N N 0.920 5.119 2.755 1.00 . A A . 11 GLU N 1 1
10 1949 1 1 11 GLU O O 3.605 7.089 2.221 1.00 . A A . 11 GLU O 1 1
10 1950 1 1 11 GLU OE1 O 3.311 2.785 3.113 1.00 . A A . 11 GLU OE1 1 1
10 1951 1 1 12 THR C C 2.777 9.926 0.754 1.00 . A A . 12 THR C 1 1
10 1952 1 1 12 THR CA C 2.258 8.541 0.228 1.00 . A A . 12 THR CA 1 1
10 1953 1 1 12 THR CB C 1.300 8.685 -1.004 1.00 . A A . 12 THR CB 1 1
10 1954 1 1 12 THR CG2 C 1.981 9.253 -2.273 1.00 . A A . 12 THR CG2 1 1
10 1955 1 1 12 THR H H 0.622 7.666 1.434 1.00 . A A . 12 THR H 1 1
10 1956 1 1 12 THR HA H 3.090 7.938 -0.195 1.00 . A A . 12 THR HA 1 1
10 1957 1 1 12 THR HB H 0.454 9.350 -0.745 1.00 . A A . 12 THR HB 1 1
10 1958 1 1 12 THR HG1 H 0.253 7.568 -2.171 1.00 . A A . 12 THR HG1 1 1
10 1959 1 1 12 THR HG21 H 2.820 8.619 -2.619 1.00 . A A . 12 THR HG21 1 1
10 1960 1 1 12 THR HG22 H 1.274 9.335 -3.120 1.00 . A A . 12 THR HG22 1 1
10 1961 1 1 12 THR HG23 H 2.391 10.268 -2.113 1.00 . A A . 12 THR HG23 1 1
10 1962 1 1 12 THR N N 1.638 7.759 1.350 1.00 . A A . 12 THR N 1 1
10 1963 1 1 12 THR O O 2.096 10.947 0.604 1.00 . A A . 12 THR O 1 1
10 1964 1 1 12 THR OG1 O 0.765 7.418 -1.372 1.00 . A A . 12 THR OG1 1 1
10 1965 1 1 13 THR C C 4.954 12.242 0.764 1.00 . A A . 13 THR C 1 1
10 1966 1 1 13 THR CA C 4.590 11.223 1.899 1.00 . A A . 13 THR CA 1 1
10 1967 1 1 13 THR CB C 5.782 10.889 2.855 1.00 . A A . 13 THR CB 1 1
10 1968 1 1 13 THR CG2 C 6.363 12.110 3.592 1.00 . A A . 13 THR CG2 1 1
10 1969 1 1 13 THR H H 4.258 9.061 1.771 1.00 . A A . 13 THR H 1 1
10 1970 1 1 13 THR HA H 3.821 11.712 2.530 1.00 . A A . 13 THR HA 1 1
10 1971 1 1 13 THR HB H 6.605 10.426 2.275 1.00 . A A . 13 THR HB 1 1
10 1972 1 1 13 THR HG1 H 5.118 9.163 3.413 1.00 . A A . 13 THR HG1 1 1
10 1973 1 1 13 THR HG21 H 7.185 11.815 4.271 1.00 . A A . 13 THR HG21 1 1
10 1974 1 1 13 THR HG22 H 6.777 12.858 2.892 1.00 . A A . 13 THR HG22 1 1
10 1975 1 1 13 THR HG23 H 5.597 12.619 4.207 1.00 . A A . 13 THR HG23 1 1
10 1976 1 1 13 THR N N 3.982 9.964 1.367 1.00 . A A . 13 THR N 1 1
10 1977 1 1 13 THR O O 4.432 13.360 0.782 1.00 . A A . 13 THR O 1 1
10 1978 1 1 13 THR OG1 O 5.377 9.969 3.866 1.00 . A A . 13 THR OG1 1 1
10 1979 1 1 14 ALA C C 5.693 12.165 -2.651 1.00 . A A . 14 ALA C 1 1
10 1980 1 1 14 ALA CA C 6.230 12.740 -1.322 1.00 . A A . 14 ALA CA 1 1
10 1981 1 1 14 ALA CB C 7.758 12.931 -1.305 1.00 . A A . 14 ALA CB 1 1
10 1982 1 1 14 ALA H H 6.173 10.902 -0.093 1.00 . A A . 14 ALA H 1 1
10 1983 1 1 14 ALA HXT H 7.002 10.747 -2.410 1.00 . A A . 14 ALA HXT 1 1
10 1984 1 1 14 ALA HA H 5.790 13.750 -1.213 1.00 . A A . 14 ALA HA 1 1
10 1985 1 1 14 ALA HB1 H 8.093 13.585 -2.132 1.00 . A A . 14 ALA HB1 1 1
10 1986 1 1 14 ALA HB2 H 8.096 13.409 -0.367 1.00 . A A . 14 ALA HB2 1 1
10 1987 1 1 14 ALA HB3 H 8.308 11.977 -1.400 1.00 . A A . 14 ALA HB3 1 1
10 1988 1 1 14 ALA N N 5.825 11.862 -0.194 1.00 . A A . 14 ALA N 1 1
10 1989 1 1 14 ALA O O 4.788 12.699 -3.291 1.00 . A A . 14 ALA O 1 1
10 1990 1 1 14 ALA OXT O 6.318 11.003 -3.033 1.00 . A A . 14 ALA OXT 1 1
11 1991 1 1 1 ACE C C 6.655 4.699 -4.778 1.00 . A A . 1 ACE C 1 1
11 1992 1 1 1 ACE CH3 C 5.583 4.639 -5.862 1.00 . A A . 1 ACE CH3 1 1
11 1993 1 1 1 ACE H1 H 5.640 5.510 -6.540 1.00 . A A . 1 ACE H1 1 1
11 1994 1 1 1 ACE H2 H 5.696 3.731 -6.483 1.00 . A A . 1 ACE H2 1 1
11 1995 1 1 1 ACE H3 H 4.568 4.610 -5.423 1.00 . A A . 1 ACE H3 1 1
11 1996 1 1 1 ACE O O 7.490 3.798 -4.676 1.00 . A A . 1 ACE O 1 1
11 1997 1 1 2 ILE C C 6.718 5.889 -1.566 1.00 . A A . 2 ILE C 1 1
11 1998 1 1 2 ILE CA C 7.572 6.008 -2.866 1.00 . A A . 2 ILE CA 1 1
11 1999 1 1 2 ILE CB C 8.368 7.356 -3.020 1.00 . A A . 2 ILE CB 1 1
11 2000 1 1 2 ILE CD1 C 10.294 6.422 -4.584 1.00 . A A . 2 ILE CD1 1 1
11 2001 1 1 2 ILE CG1 C 9.206 7.483 -4.332 1.00 . A A . 2 ILE CG1 1 1
11 2002 1 1 2 ILE CG2 C 9.276 7.671 -1.801 1.00 . A A . 2 ILE CG2 1 1
11 2003 1 1 2 ILE H H 5.780 6.367 -4.127 1.00 . A A . 2 ILE H 1 1
11 2004 1 1 2 ILE HA H 8.351 5.218 -2.849 1.00 . A A . 2 ILE HA 1 1
11 2005 1 1 2 ILE HB H 7.622 8.174 -3.055 1.00 . A A . 2 ILE HB 1 1
11 2006 1 1 2 ILE HD11 H 10.830 6.621 -5.530 1.00 . A A . 2 ILE HD11 1 1
11 2007 1 1 2 ILE HD12 H 11.052 6.406 -3.780 1.00 . A A . 2 ILE HD12 1 1
11 2008 1 1 2 ILE HD13 H 9.869 5.404 -4.663 1.00 . A A . 2 ILE HD13 1 1
11 2009 1 1 2 ILE HG12 H 8.521 7.480 -5.198 1.00 . A A . 2 ILE HG12 1 1
11 2010 1 1 2 ILE HG13 H 9.683 8.481 -4.365 1.00 . A A . 2 ILE HG13 1 1
11 2011 1 1 2 ILE HG21 H 8.693 7.765 -0.866 1.00 . A A . 2 ILE HG21 1 1
11 2012 1 1 2 ILE HG22 H 10.033 6.883 -1.631 1.00 . A A . 2 ILE HG22 1 1
11 2013 1 1 2 ILE HG23 H 9.818 8.626 -1.924 1.00 . A A . 2 ILE HG23 1 1
11 2014 1 1 2 ILE N N 6.612 5.780 -3.988 1.00 . A A . 2 ILE N 1 1
11 2015 1 1 2 ILE O O 6.075 6.854 -1.142 1.00 . A A . 2 ILE O 1 1
11 2016 1 1 3 TRP C C 6.424 2.985 0.793 1.00 . A A . 3 TRP C 1 1
11 2017 1 1 3 TRP CA C 5.958 4.376 0.272 1.00 . A A . 3 TRP CA 1 1
11 2018 1 1 3 TRP CB C 4.411 4.507 0.186 1.00 . A A . 3 TRP CB 1 1
11 2019 1 1 3 TRP CD1 C 3.878 2.714 -1.753 1.00 . A A . 3 TRP CD1 1 1
11 2020 1 1 3 TRP CD2 C 2.239 4.069 -1.124 1.00 . A A . 3 TRP CD2 1 1
11 2021 1 1 3 TRP CE2 C 1.776 3.225 -2.159 1.00 . A A . 3 TRP CE2 1 1
11 2022 1 1 3 TRP CE3 C 1.390 5.043 -0.555 1.00 . A A . 3 TRP CE3 1 1
11 2023 1 1 3 TRP CG C 3.561 3.766 -0.862 1.00 . A A . 3 TRP CG 1 1
11 2024 1 1 3 TRP CH2 C -0.373 4.340 -2.077 1.00 . A A . 3 TRP CH2 1 1
11 2025 1 1 3 TRP CZ2 C 0.450 3.360 -2.642 1.00 . A A . 3 TRP CZ2 1 1
11 2026 1 1 3 TRP CZ3 C 0.094 5.174 -1.053 1.00 . A A . 3 TRP CZ3 1 1
11 2027 1 1 3 TRP H H 7.416 4.021 -1.293 1.00 . A A . 3 TRP H 1 1
11 2028 1 1 3 TRP HA H 6.272 5.155 0.998 1.00 . A A . 3 TRP HA 1 1
11 2029 1 1 3 TRP HB2 H 3.981 4.287 1.180 1.00 . A A . 3 TRP HB2 1 1
11 2030 1 1 3 TRP HB3 H 4.193 5.583 0.059 1.00 . A A . 3 TRP HB3 1 1
11 2031 1 1 3 TRP HD1 H 4.832 2.216 -1.810 1.00 . A A . 3 TRP HD1 1 1
11 2032 1 1 3 TRP HE1 H 2.738 1.643 -3.293 1.00 . A A . 3 TRP HE1 1 1
11 2033 1 1 3 TRP HE3 H 1.762 5.661 0.251 1.00 . A A . 3 TRP HE3 1 1
11 2034 1 1 3 TRP HH2 H -1.384 4.457 -2.438 1.00 . A A . 3 TRP HH2 1 1
11 2035 1 1 3 TRP HZ2 H 0.082 2.724 -3.434 1.00 . A A . 3 TRP HZ2 1 1
11 2036 1 1 3 TRP HZ3 H -0.555 5.931 -0.639 1.00 . A A . 3 TRP HZ3 1 1
11 2037 1 1 3 TRP N N 6.708 4.683 -0.968 1.00 . A A . 3 TRP N 1 1
11 2038 1 1 3 TRP NE1 N 2.780 2.363 -2.564 1.00 . A A . 3 TRP NE1 1 1
11 2039 1 1 3 TRP O O 6.559 2.017 0.037 1.00 . A A . 3 TRP O 1 1
11 2040 1 1 4 GLY C C 6.410 1.437 4.116 1.00 . A A . 4 GLY C 1 1
11 2041 1 1 4 GLY CA C 7.126 1.677 2.779 1.00 . A A . 4 GLY CA 1 1
11 2042 1 1 4 GLY H H 6.522 3.789 2.598 1.00 . A A . 4 GLY H 1 1
11 2043 1 1 4 GLY HA2 H 7.038 0.789 2.124 1.00 . A A . 4 GLY HA2 1 1
11 2044 1 1 4 GLY HA3 H 8.207 1.789 2.976 1.00 . A A . 4 GLY HA3 1 1
11 2045 1 1 4 GLY N N 6.664 2.909 2.106 1.00 . A A . 4 GLY N 1 1
11 2046 1 1 4 GLY O O 6.823 1.976 5.146 1.00 . A A . 4 GLY O 1 1
11 2047 1 1 5 . C C 3.192 1.069 5.410 1.00 . A A . 5 SET C 1 1
11 2048 1 1 5 . CA C 4.544 0.266 5.289 1.00 . A A . 5 SET CA 1 1
11 2049 1 1 5 . CB C 4.264 -1.267 5.220 1.00 . A A . 5 SET CB 1 1
11 2050 1 1 5 . H H 5.089 0.292 3.145 1.00 . A A . 5 SET H 1 1
11 2051 1 1 5 . HA H 5.200 0.408 6.179 1.00 . A A . 5 SET HA 1 1
11 2052 1 1 5 . HB2 H 2.510 0.771 4.593 1.00 . A A . 5 SET HB2 1 1
11 2053 1 1 5 . HB3 H 2.663 0.721 6.317 1.00 . A A . 5 SET HB3 1 1
11 2054 1 1 5 . HNT2 H 3.082 3.102 6.355 1.00 . A A . 5 SET HNT2 1 1
11 2055 1 1 5 . N N 5.344 0.620 4.082 1.00 . A A . 5 SET N 1 1
11 2056 1 1 5 . NT N 3.211 2.564 5.483 1.00 . A A . 5 SET NT 1 1
11 2057 1 1 5 . OG O 3.857 -1.796 4.180 1.00 . A A . 5 SET OG 1 1
11 2058 1 1 6 SER C C 2.831 -3.973 6.144 1.00 . A A . 6 SER C 1 1
11 2059 1 1 6 SER CA C 4.270 -3.450 6.445 1.00 . A A . 6 SER CA 1 1
11 2060 1 1 6 SER CB C 4.761 -3.927 7.833 1.00 . A A . 6 SER CB 1 1
11 2061 1 1 6 SER H H 4.723 -1.424 7.178 1.00 . A A . 6 SER H 1 1
11 2062 1 1 6 SER HA H 4.984 -3.893 5.721 1.00 . A A . 6 SER HA 1 1
11 2063 1 1 6 SER HB2 H 4.742 -5.033 7.885 1.00 . A A . 6 SER HB2 1 1
11 2064 1 1 6 SER HB3 H 5.821 -3.649 7.991 1.00 . A A . 6 SER HB3 1 1
11 2065 1 1 6 SER HG H 3.059 -3.586 8.677 1.00 . A A . 6 SER HG 1 1
11 2066 1 1 6 SER N N 4.452 -1.974 6.354 1.00 . A A . 6 SER N 1 1
11 2067 1 1 6 SER O O 1.880 -3.632 6.856 1.00 . A A . 6 SER O 1 1
11 2068 1 1 6 SER OG O 3.975 -3.398 8.900 1.00 . A A . 6 SER OG 1 1
11 2069 1 1 7 GLY C C 0.622 -4.522 3.662 1.00 . A A . 7 GLY C 1 1
11 2070 1 1 7 GLY CA C 1.390 -5.379 4.684 1.00 . A A . 7 GLY CA 1 1
11 2071 1 1 7 GLY H H 3.537 -4.947 4.525 1.00 . A A . 7 GLY H 1 1
11 2072 1 1 7 GLY HA2 H 1.581 -6.370 4.235 1.00 . A A . 7 GLY HA2 1 1
11 2073 1 1 7 GLY HA3 H 0.756 -5.597 5.567 1.00 . A A . 7 GLY HA3 1 1
11 2074 1 1 7 GLY N N 2.692 -4.799 5.087 1.00 . A A . 7 GLY N 1 1
11 2075 1 1 7 GLY O O 0.642 -4.809 2.462 1.00 . A A . 7 GLY O 1 1
11 2076 1 1 8 LYS C C -0.041 -1.237 3.217 1.00 . A A . 8 LYS C 1 1
11 2077 1 1 8 LYS CA C -0.861 -2.548 3.354 1.00 . A A . 8 LYS CA 1 1
11 2078 1 1 8 LYS CB C -2.218 -2.363 4.080 1.00 . A A . 8 LYS CB 1 1
11 2079 1 1 8 LYS CD C -4.545 -1.248 4.087 1.00 . A A . 8 LYS CD 1 1
11 2080 1 1 8 LYS CE C -5.437 -2.460 4.424 1.00 . A A . 8 LYS CE 1 1
11 2081 1 1 8 LYS CG C -3.281 -1.586 3.274 1.00 . A A . 8 LYS CG 1 1
11 2082 1 1 8 LYS H H 0.155 -3.252 5.137 1.00 . A A . 8 LYS H 1 1
11 2083 1 1 8 LYS HA H -1.080 -2.988 2.359 1.00 . A A . 8 LYS HA 1 1
11 2084 1 1 8 LYS HB2 H -2.642 -3.356 4.330 1.00 . A A . 8 LYS HB2 1 1
11 2085 1 1 8 LYS HB3 H -2.054 -1.864 5.057 1.00 . A A . 8 LYS HB3 1 1
11 2086 1 1 8 LYS HD2 H -4.243 -0.723 5.015 1.00 . A A . 8 LYS HD2 1 1
11 2087 1 1 8 LYS HD3 H -5.127 -0.509 3.508 1.00 . A A . 8 LYS HD3 1 1
11 2088 1 1 8 LYS HE2 H -5.715 -3.000 3.499 1.00 . A A . 8 LYS HE2 1 1
11 2089 1 1 8 LYS HE3 H -4.880 -3.188 5.046 1.00 . A A . 8 LYS HE3 1 1
11 2090 1 1 8 LYS HG2 H -2.842 -0.640 2.909 1.00 . A A . 8 LYS HG2 1 1
11 2091 1 1 8 LYS HG3 H -3.551 -2.146 2.357 1.00 . A A . 8 LYS HG3 1 1
11 2092 1 1 8 LYS HZ1 H -7.223 -1.387 4.582 1.00 . A A . 8 LYS HZ1 1 1
11 2093 1 1 8 LYS HZ2 H -7.265 -2.833 5.374 1.00 . A A . 8 LYS HZ2 1 1
11 2094 1 1 8 LYS HZ3 H -6.439 -1.560 6.021 1.00 . A A . 8 LYS HZ3 1 1
11 2095 1 1 8 LYS N N -0.062 -3.486 4.167 1.00 . A A . 8 LYS N 1 1
11 2096 1 1 8 LYS NZ N -6.659 -2.038 5.140 1.00 . A A . 8 LYS NZ 1 1
11 2097 1 1 8 LYS O O 0.084 -0.448 4.162 1.00 . A A . 8 LYS O 1 1
11 2098 1 1 9 LEU C C 0.389 1.374 1.379 1.00 . A A . 9 LEU C 1 1
11 2099 1 1 9 LEU CA C 1.331 0.163 1.673 1.00 . A A . 9 LEU CA 1 1
11 2100 1 1 9 LEU CB C 2.298 -0.144 0.489 1.00 . A A . 9 LEU CB 1 1
11 2101 1 1 9 LEU CD1 C 3.259 -2.511 1.010 1.00 . A A . 9 LEU CD1 1 1
11 2102 1 1 9 LEU CD2 C 4.578 -0.892 -0.372 1.00 . A A . 9 LEU CD2 1 1
11 2103 1 1 9 LEU CG C 3.557 -1.016 0.777 1.00 . A A . 9 LEU CG 1 1
11 2104 1 1 9 LEU H H 0.462 -1.874 1.431 1.00 . A A . 9 LEU H 1 1
11 2105 1 1 9 LEU HA H 1.980 0.420 2.530 1.00 . A A . 9 LEU HA 1 1
11 2106 1 1 9 LEU HB2 H 1.735 -0.557 -0.371 1.00 . A A . 9 LEU HB2 1 1
11 2107 1 1 9 LEU HB3 H 2.665 0.834 0.123 1.00 . A A . 9 LEU HB3 1 1
11 2108 1 1 9 LEU HD11 H 2.724 -2.969 0.157 1.00 . A A . 9 LEU HD11 1 1
11 2109 1 1 9 LEU HD12 H 4.187 -3.093 1.164 1.00 . A A . 9 LEU HD12 1 1
11 2110 1 1 9 LEU HD13 H 2.646 -2.677 1.913 1.00 . A A . 9 LEU HD13 1 1
11 2111 1 1 9 LEU HD21 H 5.510 -1.448 -0.159 1.00 . A A . 9 LEU HD21 1 1
11 2112 1 1 9 LEU HD22 H 4.178 -1.273 -1.331 1.00 . A A . 9 LEU HD22 1 1
11 2113 1 1 9 LEU HD23 H 4.875 0.158 -0.539 1.00 . A A . 9 LEU HD23 1 1
11 2114 1 1 9 LEU HG H 4.044 -0.621 1.687 1.00 . A A . 9 LEU HG 1 1
11 2115 1 1 9 LEU N N 0.508 -1.033 2.012 1.00 . A A . 9 LEU N 1 1
11 2116 1 1 9 LEU O O -0.046 1.585 0.243 1.00 . A A . 9 LEU O 1 1
11 2117 1 1 10 ILE C C -0.379 4.446 3.336 1.00 . A A . 10 ILE C 1 1
11 2118 1 1 10 ILE CA C -0.838 3.329 2.344 1.00 . A A . 10 ILE CA 1 1
11 2119 1 1 10 ILE CB C -2.348 2.874 2.444 1.00 . A A . 10 ILE CB 1 1
11 2120 1 1 10 ILE CD1 C -3.293 4.561 0.696 1.00 . A A . 10 ILE CD1 1 1
11 2121 1 1 10 ILE CG1 C -3.388 3.983 2.114 1.00 . A A . 10 ILE CG1 1 1
11 2122 1 1 10 ILE CG2 C -2.747 2.198 3.783 1.00 . A A . 10 ILE CG2 1 1
11 2123 1 1 10 ILE H H 0.422 1.822 3.337 1.00 . A A . 10 ILE H 1 1
11 2124 1 1 10 ILE HA H -0.716 3.765 1.333 1.00 . A A . 10 ILE HA 1 1
11 2125 1 1 10 ILE HB H -2.493 2.094 1.670 1.00 . A A . 10 ILE HB 1 1
11 2126 1 1 10 ILE HD11 H -4.143 5.232 0.482 1.00 . A A . 10 ILE HD11 1 1
11 2127 1 1 10 ILE HD12 H -2.372 5.156 0.566 1.00 . A A . 10 ILE HD12 1 1
11 2128 1 1 10 ILE HD13 H -3.291 3.765 -0.072 1.00 . A A . 10 ILE HD13 1 1
11 2129 1 1 10 ILE HG12 H -4.411 3.575 2.235 1.00 . A A . 10 ILE HG12 1 1
11 2130 1 1 10 ILE HG13 H -3.320 4.807 2.849 1.00 . A A . 10 ILE HG13 1 1
11 2131 1 1 10 ILE HG21 H -2.065 1.371 4.047 1.00 . A A . 10 ILE HG21 1 1
11 2132 1 1 10 ILE HG22 H -2.744 2.903 4.633 1.00 . A A . 10 ILE HG22 1 1
11 2133 1 1 10 ILE HG23 H -3.762 1.763 3.732 1.00 . A A . 10 ILE HG23 1 1
11 2134 1 1 10 ILE N N 0.068 2.149 2.435 1.00 . A A . 10 ILE N 1 1
11 2135 1 1 10 ILE O O -1.043 4.726 4.338 1.00 . A A . 10 ILE O 1 1
11 2136 1 1 11 GLU C C 1.969 7.390 3.105 1.00 . A A . 11 GLU C 1 1
11 2137 1 1 11 GLU CA C 1.318 6.199 3.897 1.00 . A A . 11 GLU CA 1 1
11 2138 1 1 11 GLU CB C 2.215 5.617 5.032 1.00 . A A . 11 GLU CB 1 1
11 2139 1 1 11 GLU CD C 3.355 3.340 4.391 1.00 . A A . 11 GLU CD 1 1
11 2140 1 1 11 GLU CG C 3.504 4.858 4.625 1.00 . A A . 11 GLU CG 1 1
11 2141 1 1 11 GLU H H 1.309 4.669 2.285 1.00 . A A . 11 GLU H 1 1
11 2142 1 1 11 GLU HA H 0.473 6.683 4.426 1.00 . A A . 11 GLU HA 1 1
11 2143 1 1 11 GLU HB2 H 2.514 6.459 5.685 1.00 . A A . 11 GLU HB2 1 1
11 2144 1 1 11 GLU HB3 H 1.599 4.985 5.702 1.00 . A A . 11 GLU HB3 1 1
11 2145 1 1 11 GLU HG2 H 3.943 5.326 3.720 1.00 . A A . 11 GLU HG2 1 1
11 2146 1 1 11 GLU HG3 H 4.279 5.022 5.396 1.00 . A A . 11 GLU HG3 1 1
11 2147 1 1 11 GLU N N 0.767 5.096 3.045 1.00 . A A . 11 GLU N 1 1
11 2148 1 1 11 GLU O O 2.939 7.993 3.573 1.00 . A A . 11 GLU O 1 1
11 2149 1 1 11 GLU OE1 O 3.480 2.889 3.249 1.00 . A A . 11 GLU OE1 1 1
11 2150 1 1 12 THR C C 0.681 9.304 0.204 1.00 . A A . 12 THR C 1 1
11 2151 1 1 12 THR CA C 1.915 8.879 1.080 1.00 . A A . 12 THR CA 1 1
11 2152 1 1 12 THR CB C 3.176 8.481 0.235 1.00 . A A . 12 THR CB 1 1
11 2153 1 1 12 THR CG2 C 3.789 9.648 -0.559 1.00 . A A . 12 THR CG2 1 1
11 2154 1 1 12 THR H H 0.561 7.251 1.685 1.00 . A A . 12 THR H 1 1
11 2155 1 1 12 THR HA H 2.244 9.722 1.724 1.00 . A A . 12 THR HA 1 1
11 2156 1 1 12 THR HB H 2.903 7.684 -0.481 1.00 . A A . 12 THR HB 1 1
11 2157 1 1 12 THR HG1 H 4.337 8.623 1.766 1.00 . A A . 12 THR HG1 1 1
11 2158 1 1 12 THR HG21 H 4.110 10.474 0.101 1.00 . A A . 12 THR HG21 1 1
11 2159 1 1 12 THR HG22 H 4.678 9.319 -1.129 1.00 . A A . 12 THR HG22 1 1
11 2160 1 1 12 THR HG23 H 3.078 10.068 -1.295 1.00 . A A . 12 THR HG23 1 1
11 2161 1 1 12 THR N N 1.414 7.762 1.933 1.00 . A A . 12 THR N 1 1
11 2162 1 1 12 THR O O 0.625 8.957 -0.982 1.00 . A A . 12 THR O 1 1
11 2163 1 1 12 THR OG1 O 4.217 7.978 1.065 1.00 . A A . 12 THR OG1 1 1
11 2164 1 1 13 THR C C -1.886 11.914 0.426 1.00 . A A . 13 THR C 1 1
11 2165 1 1 13 THR CA C -1.535 10.454 0.003 1.00 . A A . 13 THR CA 1 1
11 2166 1 1 13 THR CB C -2.696 9.410 0.125 1.00 . A A . 13 THR CB 1 1
11 2167 1 1 13 THR CG2 C -3.934 9.744 -0.725 1.00 . A A . 13 THR CG2 1 1
11 2168 1 1 13 THR H H -0.328 10.110 1.788 1.00 . A A . 13 THR H 1 1
11 2169 1 1 13 THR HA H -1.281 10.514 -1.074 1.00 . A A . 13 THR HA 1 1
11 2170 1 1 13 THR HB H -3.012 9.333 1.183 1.00 . A A . 13 THR HB 1 1
11 2171 1 1 13 THR HG1 H -1.918 8.227 -1.183 1.00 . A A . 13 THR HG1 1 1
11 2172 1 1 13 THR HG21 H -4.714 8.966 -0.619 1.00 . A A . 13 THR HG21 1 1
11 2173 1 1 13 THR HG22 H -4.393 10.703 -0.423 1.00 . A A . 13 THR HG22 1 1
11 2174 1 1 13 THR HG23 H -3.687 9.819 -1.800 1.00 . A A . 13 THR HG23 1 1
11 2175 1 1 13 THR N N -0.326 10.021 0.766 1.00 . A A . 13 THR N 1 1
11 2176 1 1 13 THR O O -1.633 12.839 -0.352 1.00 . A A . 13 THR O 1 1
11 2177 1 1 13 THR OG1 O -2.256 8.119 -0.290 1.00 . A A . 13 THR OG1 1 1
11 2178 1 1 14 ALA C C -1.621 14.144 2.849 1.00 . A A . 14 ALA C 1 1
11 2179 1 1 14 ALA CA C -2.818 13.482 2.125 1.00 . A A . 14 ALA CA 1 1
11 2180 1 1 14 ALA CB C -4.067 13.353 3.019 1.00 . A A . 14 ALA CB 1 1
11 2181 1 1 14 ALA H H -2.618 11.287 2.194 1.00 . A A . 14 ALA H 1 1
11 2182 1 1 14 ALA HXT H -1.112 14.744 1.068 1.00 . A A . 14 ALA HXT 1 1
11 2183 1 1 14 ALA HA H -3.111 14.128 1.274 1.00 . A A . 14 ALA HA 1 1
11 2184 1 1 14 ALA HB1 H -4.400 14.341 3.390 1.00 . A A . 14 ALA HB1 1 1
11 2185 1 1 14 ALA HB2 H -4.922 12.917 2.471 1.00 . A A . 14 ALA HB2 1 1
11 2186 1 1 14 ALA HB3 H -3.885 12.719 3.908 1.00 . A A . 14 ALA HB3 1 1
11 2187 1 1 14 ALA N N -2.449 12.132 1.636 1.00 . A A . 14 ALA N 1 1
11 2188 1 1 14 ALA O O -1.408 14.061 4.059 1.00 . A A . 14 ALA O 1 1
11 2189 1 1 14 ALA OXT O -0.810 14.826 1.976 1.00 . A A . 14 ALA OXT 1 1
12 2190 1 1 1 ACE C C 6.837 7.830 0.543 1.00 . A A . 1 ACE C 1 1
12 2191 1 1 1 ACE CH3 C 7.162 9.206 -0.028 1.00 . A A . 1 ACE CH3 1 1
12 2192 1 1 1 ACE H1 H 7.961 9.151 -0.790 1.00 . A A . 1 ACE H1 1 1
12 2193 1 1 1 ACE H2 H 6.275 9.652 -0.514 1.00 . A A . 1 ACE H2 1 1
12 2194 1 1 1 ACE H3 H 7.489 9.906 0.763 1.00 . A A . 1 ACE H3 1 1
12 2195 1 1 1 ACE O O 5.708 7.353 0.416 1.00 . A A . 1 ACE O 1 1
12 2196 1 1 2 ILE C C 8.136 6.043 3.276 1.00 . A A . 2 ILE C 1 1
12 2197 1 1 2 ILE CA C 7.728 5.858 1.783 1.00 . A A . 2 ILE CA 1 1
12 2198 1 1 2 ILE CB C 8.554 4.759 1.015 1.00 . A A . 2 ILE CB 1 1
12 2199 1 1 2 ILE CD1 C 6.718 4.081 -0.770 1.00 . A A . 2 ILE CD1 1 1
12 2200 1 1 2 ILE CG1 C 8.153 4.559 -0.480 1.00 . A A . 2 ILE CG1 1 1
12 2201 1 1 2 ILE CG2 C 8.575 3.384 1.734 1.00 . A A . 2 ILE CG2 1 1
12 2202 1 1 2 ILE H H 8.720 7.754 1.207 1.00 . A A . 2 ILE H 1 1
12 2203 1 1 2 ILE HA H 6.673 5.519 1.751 1.00 . A A . 2 ILE HA 1 1
12 2204 1 1 2 ILE HB H 9.607 5.102 1.002 1.00 . A A . 2 ILE HB 1 1
12 2205 1 1 2 ILE HD11 H 6.505 3.099 -0.309 1.00 . A A . 2 ILE HD11 1 1
12 2206 1 1 2 ILE HD12 H 5.961 4.795 -0.399 1.00 . A A . 2 ILE HD12 1 1
12 2207 1 1 2 ILE HD13 H 6.550 3.972 -1.857 1.00 . A A . 2 ILE HD13 1 1
12 2208 1 1 2 ILE HG12 H 8.321 5.503 -1.030 1.00 . A A . 2 ILE HG12 1 1
12 2209 1 1 2 ILE HG13 H 8.858 3.846 -0.952 1.00 . A A . 2 ILE HG13 1 1
12 2210 1 1 2 ILE HG21 H 9.023 3.450 2.743 1.00 . A A . 2 ILE HG21 1 1
12 2211 1 1 2 ILE HG22 H 7.560 2.963 1.860 1.00 . A A . 2 ILE HG22 1 1
12 2212 1 1 2 ILE HG23 H 9.173 2.637 1.179 1.00 . A A . 2 ILE HG23 1 1
12 2213 1 1 2 ILE N N 7.853 7.207 1.157 1.00 . A A . 2 ILE N 1 1
12 2214 1 1 2 ILE O O 9.324 6.146 3.601 1.00 . A A . 2 ILE O 1 1
12 2215 1 1 3 TRP C C 7.931 4.991 6.421 1.00 . A A . 3 TRP C 1 1
12 2216 1 1 3 TRP CA C 7.363 6.226 5.645 1.00 . A A . 3 TRP CA 1 1
12 2217 1 1 3 TRP CB C 6.062 6.685 6.377 1.00 . A A . 3 TRP CB 1 1
12 2218 1 1 3 TRP CD1 C 5.649 9.037 5.238 1.00 . A A . 3 TRP CD1 1 1
12 2219 1 1 3 TRP CD2 C 3.817 7.898 5.792 1.00 . A A . 3 TRP CD2 1 1
12 2220 1 1 3 TRP CE2 C 3.450 9.149 5.237 1.00 . A A . 3 TRP CE2 1 1
12 2221 1 1 3 TRP CE3 C 2.819 6.999 6.257 1.00 . A A . 3 TRP CE3 1 1
12 2222 1 1 3 TRP CG C 5.200 7.821 5.799 1.00 . A A . 3 TRP CG 1 1
12 2223 1 1 3 TRP CH2 C 1.119 8.618 5.617 1.00 . A A . 3 TRP CH2 1 1
12 2224 1 1 3 TRP CZ2 C 2.086 9.516 5.156 1.00 . A A . 3 TRP CZ2 1 1
12 2225 1 1 3 TRP CZ3 C 1.480 7.377 6.152 1.00 . A A . 3 TRP CZ3 1 1
12 2226 1 1 3 TRP H H 6.197 6.106 3.761 1.00 . A A . 3 TRP H 1 1
12 2227 1 1 3 TRP HA H 8.109 7.021 5.770 1.00 . A A . 3 TRP HA 1 1
12 2228 1 1 3 TRP HB2 H 5.406 5.805 6.514 1.00 . A A . 3 TRP HB2 1 1
12 2229 1 1 3 TRP HB3 H 6.324 6.980 7.412 1.00 . A A . 3 TRP HB3 1 1
12 2230 1 1 3 TRP HD1 H 6.688 9.306 5.115 1.00 . A A . 3 TRP HD1 1 1
12 2231 1 1 3 TRP HE1 H 4.614 10.810 4.461 1.00 . A A . 3 TRP HE1 1 1
12 2232 1 1 3 TRP HE3 H 3.079 6.042 6.685 1.00 . A A . 3 TRP HE3 1 1
12 2233 1 1 3 TRP HH2 H 0.074 8.883 5.554 1.00 . A A . 3 TRP HH2 1 1
12 2234 1 1 3 TRP HZ2 H 1.795 10.473 4.748 1.00 . A A . 3 TRP HZ2 1 1
12 2235 1 1 3 TRP HZ3 H 0.712 6.701 6.498 1.00 . A A . 3 TRP HZ3 1 1
12 2236 1 1 3 TRP N N 7.136 6.062 4.174 1.00 . A A . 3 TRP N 1 1
12 2237 1 1 3 TRP NE1 N 4.575 9.870 4.872 1.00 . A A . 3 TRP NE1 1 1
12 2238 1 1 3 TRP O O 8.691 5.150 7.380 1.00 . A A . 3 TRP O 1 1
12 2239 1 1 4 GLY C C 6.565 1.787 6.963 1.00 . A A . 4 GLY C 1 1
12 2240 1 1 4 GLY CA C 7.888 2.499 6.619 1.00 . A A . 4 GLY CA 1 1
12 2241 1 1 4 GLY H H 7.039 3.857 5.105 1.00 . A A . 4 GLY H 1 1
12 2242 1 1 4 GLY HA2 H 8.497 1.908 5.911 1.00 . A A . 4 GLY HA2 1 1
12 2243 1 1 4 GLY HA3 H 8.498 2.629 7.532 1.00 . A A . 4 GLY HA3 1 1
12 2244 1 1 4 GLY N N 7.520 3.790 6.003 1.00 . A A . 4 GLY N 1 1
12 2245 1 1 4 GLY O O 6.103 1.860 8.105 1.00 . A A . 4 GLY O 1 1
12 2246 1 1 5 . C C 3.464 1.352 5.709 1.00 . A A . 5 SET C 1 1
12 2247 1 1 5 . CA C 4.657 0.420 6.107 1.00 . A A . 5 SET CA 1 1
12 2248 1 1 5 . CB C 4.697 -0.922 5.315 1.00 . A A . 5 SET CB 1 1
12 2249 1 1 5 . H H 6.468 1.132 5.068 1.00 . A A . 5 SET H 1 1
12 2250 1 1 5 . HA H 4.497 0.196 7.181 1.00 . A A . 5 SET HA 1 1
12 2251 1 1 5 . HB2 H 2.522 0.784 5.819 1.00 . A A . 5 SET HB2 1 1
12 2252 1 1 5 . HB3 H 3.370 2.156 6.465 1.00 . A A . 5 SET HB3 1 1
12 2253 1 1 5 . HNT2 H 3.151 1.337 3.568 1.00 . A A . 5 SET HNT2 1 1
12 2254 1 1 5 . N N 5.965 1.116 5.963 1.00 . A A . 5 SET N 1 1
12 2255 1 1 5 . NT N 3.479 1.934 4.336 1.00 . A A . 5 SET NT 1 1
12 2256 1 1 5 . OG O 4.905 -0.928 4.097 1.00 . A A . 5 SET OG 1 1
12 2257 1 1 6 SER C C 3.096 -4.053 5.517 1.00 . A A . 6 SER C 1 1
12 2258 1 1 6 SER CA C 4.515 -3.418 5.424 1.00 . A A . 6 SER CA 1 1
12 2259 1 1 6 SER CB C 5.574 -4.263 6.167 1.00 . A A . 6 SER CB 1 1
12 2260 1 1 6 SER H H 4.256 -1.912 7.005 1.00 . A A . 6 SER H 1 1
12 2261 1 1 6 SER HA H 4.834 -3.367 4.364 1.00 . A A . 6 SER HA 1 1
12 2262 1 1 6 SER HB2 H 6.555 -3.751 6.163 1.00 . A A . 6 SER HB2 1 1
12 2263 1 1 6 SER HB3 H 5.305 -4.399 7.234 1.00 . A A . 6 SER HB3 1 1
12 2264 1 1 6 SER HG H 6.393 -6.007 6.060 1.00 . A A . 6 SER HG 1 1
12 2265 1 1 6 SER N N 4.503 -2.053 6.020 1.00 . A A . 6 SER N 1 1
12 2266 1 1 6 SER O O 2.424 -3.958 6.551 1.00 . A A . 6 SER O 1 1
12 2267 1 1 6 SER OG O 5.728 -5.538 5.551 1.00 . A A . 6 SER OG 1 1
12 2268 1 1 7 GLY C C 0.277 -4.399 3.752 1.00 . A A . 7 GLY C 1 1
12 2269 1 1 7 GLY CA C 1.310 -5.354 4.378 1.00 . A A . 7 GLY CA 1 1
12 2270 1 1 7 GLY H H 3.301 -4.744 3.638 1.00 . A A . 7 GLY H 1 1
12 2271 1 1 7 GLY HA2 H 1.378 -6.269 3.761 1.00 . A A . 7 GLY HA2 1 1
12 2272 1 1 7 GLY HA3 H 0.974 -5.707 5.374 1.00 . A A . 7 GLY HA3 1 1
12 2273 1 1 7 GLY N N 2.653 -4.718 4.433 1.00 . A A . 7 GLY N 1 1
12 2274 1 1 7 GLY O O -0.080 -4.548 2.580 1.00 . A A . 7 GLY O 1 1
12 2275 1 1 8 LYS C C -0.293 -1.212 3.546 1.00 . A A . 8 LYS C 1 1
12 2276 1 1 8 LYS CA C -1.152 -2.387 4.106 1.00 . A A . 8 LYS CA 1 1
12 2277 1 1 8 LYS CB C -2.039 -2.008 5.320 1.00 . A A . 8 LYS CB 1 1
12 2278 1 1 8 LYS CD C -4.049 -0.641 6.203 1.00 . A A . 8 LYS CD 1 1
12 2279 1 1 8 LYS CE C -3.373 0.423 7.091 1.00 . A A . 8 LYS CE 1 1
12 2280 1 1 8 LYS CG C -3.216 -1.069 4.977 1.00 . A A . 8 LYS CG 1 1
12 2281 1 1 8 LYS H H 0.258 -3.360 5.467 1.00 . A A . 8 LYS H 1 1
12 2282 1 1 8 LYS HA H -1.818 -2.796 3.319 1.00 . A A . 8 LYS HA 1 1
12 2283 1 1 8 LYS HB2 H -2.459 -2.928 5.773 1.00 . A A . 8 LYS HB2 1 1
12 2284 1 1 8 LYS HB3 H -1.411 -1.557 6.112 1.00 . A A . 8 LYS HB3 1 1
12 2285 1 1 8 LYS HD2 H -5.014 -0.247 5.832 1.00 . A A . 8 LYS HD2 1 1
12 2286 1 1 8 LYS HD3 H -4.307 -1.539 6.798 1.00 . A A . 8 LYS HD3 1 1
12 2287 1 1 8 LYS HE2 H -2.414 0.043 7.493 1.00 . A A . 8 LYS HE2 1 1
12 2288 1 1 8 LYS HE3 H -3.117 1.318 6.492 1.00 . A A . 8 LYS HE3 1 1
12 2289 1 1 8 LYS HG2 H -2.858 -0.173 4.436 1.00 . A A . 8 LYS HG2 1 1
12 2290 1 1 8 LYS HG3 H -3.883 -1.586 4.261 1.00 . A A . 8 LYS HG3 1 1
12 2291 1 1 8 LYS HZ1 H -4.486 0.015 8.811 1.00 . A A . 8 LYS HZ1 1 1
12 2292 1 1 8 LYS HZ2 H -3.820 1.524 8.815 1.00 . A A . 8 LYS HZ2 1 1
12 2293 1 1 8 LYS HZ3 H -5.142 1.206 7.880 1.00 . A A . 8 LYS HZ3 1 1
12 2294 1 1 8 LYS N N -0.191 -3.424 4.552 1.00 . A A . 8 LYS N 1 1
12 2295 1 1 8 LYS NZ N -4.253 0.815 8.211 1.00 . A A . 8 LYS NZ 1 1
12 2296 1 1 8 LYS O O 0.125 -0.306 4.277 1.00 . A A . 8 LYS O 1 1
12 2297 1 1 9 LEU C C -0.003 1.025 1.178 1.00 . A A . 9 LEU C 1 1
12 2298 1 1 9 LEU CA C 0.798 -0.268 1.512 1.00 . A A . 9 LEU CA 1 1
12 2299 1 1 9 LEU CB C 1.431 -0.923 0.247 1.00 . A A . 9 LEU CB 1 1
12 2300 1 1 9 LEU CD1 C 2.842 -2.795 -0.758 1.00 . A A . 9 LEU CD1 1 1
12 2301 1 1 9 LEU CD2 C 3.909 -1.213 0.884 1.00 . A A . 9 LEU CD2 1 1
12 2302 1 1 9 LEU CG C 2.599 -1.925 0.489 1.00 . A A . 9 LEU CG 1 1
12 2303 1 1 9 LEU H H -0.355 -2.147 1.803 1.00 . A A . 9 LEU H 1 1
12 2304 1 1 9 LEU HA H 1.646 0.018 2.167 1.00 . A A . 9 LEU HA 1 1
12 2305 1 1 9 LEU HB2 H 0.625 -1.414 -0.335 1.00 . A A . 9 LEU HB2 1 1
12 2306 1 1 9 LEU HB3 H 1.799 -0.130 -0.434 1.00 . A A . 9 LEU HB3 1 1
12 2307 1 1 9 LEU HD11 H 3.647 -3.535 -0.590 1.00 . A A . 9 LEU HD11 1 1
12 2308 1 1 9 LEU HD12 H 1.938 -3.371 -1.034 1.00 . A A . 9 LEU HD12 1 1
12 2309 1 1 9 LEU HD13 H 3.129 -2.192 -1.640 1.00 . A A . 9 LEU HD13 1 1
12 2310 1 1 9 LEU HD21 H 4.718 -1.935 1.101 1.00 . A A . 9 LEU HD21 1 1
12 2311 1 1 9 LEU HD22 H 4.275 -0.541 0.086 1.00 . A A . 9 LEU HD22 1 1
12 2312 1 1 9 LEU HD23 H 3.788 -0.598 1.793 1.00 . A A . 9 LEU HD23 1 1
12 2313 1 1 9 LEU HG H 2.325 -2.610 1.313 1.00 . A A . 9 LEU HG 1 1
12 2314 1 1 9 LEU N N -0.033 -1.273 2.230 1.00 . A A . 9 LEU N 1 1
12 2315 1 1 9 LEU O O -0.637 1.148 0.125 1.00 . A A . 9 LEU O 1 1
12 2316 1 1 10 ILE C C 0.310 4.314 2.733 1.00 . A A . 10 ILE C 1 1
12 2317 1 1 10 ILE CA C -0.628 3.302 2.000 1.00 . A A . 10 ILE CA 1 1
12 2318 1 1 10 ILE CB C -2.135 3.230 2.452 1.00 . A A . 10 ILE CB 1 1
12 2319 1 1 10 ILE CD1 C -3.179 4.694 0.579 1.00 . A A . 10 ILE CD1 1 1
12 2320 1 1 10 ILE CG1 C -2.948 4.500 2.085 1.00 . A A . 10 ILE CG1 1 1
12 2321 1 1 10 ILE CG2 C -2.375 2.866 3.939 1.00 . A A . 10 ILE CG2 1 1
12 2322 1 1 10 ILE H H 0.509 1.707 2.988 1.00 . A A . 10 ILE H 1 1
12 2323 1 1 10 ILE HA H -0.629 3.584 0.928 1.00 . A A . 10 ILE HA 1 1
12 2324 1 1 10 ILE HB H -2.595 2.399 1.881 1.00 . A A . 10 ILE HB 1 1
12 2325 1 1 10 ILE HD11 H -2.235 4.871 0.032 1.00 . A A . 10 ILE HD11 1 1
12 2326 1 1 10 ILE HD12 H -3.664 3.808 0.126 1.00 . A A . 10 ILE HD12 1 1
12 2327 1 1 10 ILE HD13 H -3.835 5.562 0.388 1.00 . A A . 10 ILE HD13 1 1
12 2328 1 1 10 ILE HG12 H -3.946 4.462 2.564 1.00 . A A . 10 ILE HG12 1 1
12 2329 1 1 10 ILE HG13 H -2.463 5.401 2.507 1.00 . A A . 10 ILE HG13 1 1
12 2330 1 1 10 ILE HG21 H -1.800 1.972 4.241 1.00 . A A . 10 ILE HG21 1 1
12 2331 1 1 10 ILE HG22 H -2.090 3.682 4.627 1.00 . A A . 10 ILE HG22 1 1
12 2332 1 1 10 ILE HG23 H -3.440 2.640 4.135 1.00 . A A . 10 ILE HG23 1 1
12 2333 1 1 10 ILE N N 0.042 1.982 2.119 1.00 . A A . 10 ILE N 1 1
12 2334 1 1 10 ILE O O 0.077 4.689 3.886 1.00 . A A . 10 ILE O 1 1
12 2335 1 1 11 GLU C C 2.222 7.184 2.159 1.00 . A A . 11 GLU C 1 1
12 2336 1 1 11 GLU CA C 2.392 5.690 2.620 1.00 . A A . 11 GLU CA 1 1
12 2337 1 1 11 GLU CB C 3.816 5.132 2.309 1.00 . A A . 11 GLU CB 1 1
12 2338 1 1 11 GLU CD C 4.000 3.163 4.076 1.00 . A A . 11 GLU CD 1 1
12 2339 1 1 11 GLU CG C 4.175 3.648 2.611 1.00 . A A . 11 GLU CG 1 1
12 2340 1 1 11 GLU H H 1.462 4.386 1.088 1.00 . A A . 11 GLU H 1 1
12 2341 1 1 11 GLU HA H 2.315 5.697 3.725 1.00 . A A . 11 GLU HA 1 1
12 2342 1 1 11 GLU HB2 H 4.037 5.307 1.238 1.00 . A A . 11 GLU HB2 1 1
12 2343 1 1 11 GLU HB3 H 4.547 5.768 2.843 1.00 . A A . 11 GLU HB3 1 1
12 2344 1 1 11 GLU HG2 H 3.643 3.004 1.890 1.00 . A A . 11 GLU HG2 1 1
12 2345 1 1 11 GLU HG3 H 5.244 3.533 2.336 1.00 . A A . 11 GLU HG3 1 1
12 2346 1 1 11 GLU N N 1.384 4.751 2.043 1.00 . A A . 11 GLU N 1 1
12 2347 1 1 11 GLU O O 3.209 7.884 1.912 1.00 . A A . 11 GLU O 1 1
12 2348 1 1 11 GLU OE1 O 4.400 3.903 4.979 1.00 . A A . 11 GLU OE1 1 1
12 2349 1 1 12 THR C C -0.613 9.555 2.414 1.00 . A A . 12 THR C 1 1
12 2350 1 1 12 THR CA C 0.664 9.088 1.650 1.00 . A A . 12 THR CA 1 1
12 2351 1 1 12 THR CB C 0.599 9.240 0.092 1.00 . A A . 12 THR CB 1 1
12 2352 1 1 12 THR CG2 C 0.404 10.689 -0.387 1.00 . A A . 12 THR CG2 1 1
12 2353 1 1 12 THR H H 0.254 7.053 2.436 1.00 . A A . 12 THR H 1 1
12 2354 1 1 12 THR HA H 1.485 9.746 2.000 1.00 . A A . 12 THR HA 1 1
12 2355 1 1 12 THR HB H -0.236 8.629 -0.301 1.00 . A A . 12 THR HB 1 1
12 2356 1 1 12 THR HG1 H 2.523 9.150 -0.010 1.00 . A A . 12 THR HG1 1 1
12 2357 1 1 12 THR HG21 H -0.549 11.118 -0.025 1.00 . A A . 12 THR HG21 1 1
12 2358 1 1 12 THR HG22 H 1.218 11.351 -0.038 1.00 . A A . 12 THR HG22 1 1
12 2359 1 1 12 THR HG23 H 0.384 10.748 -1.490 1.00 . A A . 12 THR HG23 1 1
12 2360 1 1 12 THR N N 0.974 7.691 2.082 1.00 . A A . 12 THR N 1 1
12 2361 1 1 12 THR O O -0.491 10.380 3.323 1.00 . A A . 12 THR O 1 1
12 2362 1 1 12 THR OG1 O 1.800 8.770 -0.515 1.00 . A A . 12 THR OG1 1 1
12 2363 1 1 13 THR C C -3.621 8.135 3.425 1.00 . A A . 13 THR C 1 1
12 2364 1 1 13 THR CA C -3.092 9.429 2.736 1.00 . A A . 13 THR CA 1 1
12 2365 1 1 13 THR CB C -4.093 10.093 1.739 1.00 . A A . 13 THR CB 1 1
12 2366 1 1 13 THR CG2 C -5.384 10.607 2.401 1.00 . A A . 13 THR CG2 1 1
12 2367 1 1 13 THR H H -1.800 8.436 1.236 1.00 . A A . 13 THR H 1 1
12 2368 1 1 13 THR HA H -2.903 10.189 3.523 1.00 . A A . 13 THR HA 1 1
12 2369 1 1 13 THR HB H -4.379 9.369 0.952 1.00 . A A . 13 THR HB 1 1
12 2370 1 1 13 THR HG1 H -4.163 11.609 0.551 1.00 . A A . 13 THR HG1 1 1
12 2371 1 1 13 THR HG21 H -5.956 9.789 2.876 1.00 . A A . 13 THR HG21 1 1
12 2372 1 1 13 THR HG22 H -5.173 11.360 3.183 1.00 . A A . 13 THR HG22 1 1
12 2373 1 1 13 THR HG23 H -6.057 11.080 1.662 1.00 . A A . 13 THR HG23 1 1
12 2374 1 1 13 THR N N -1.819 9.057 2.053 1.00 . A A . 13 THR N 1 1
12 2375 1 1 13 THR O O -4.397 7.375 2.835 1.00 . A A . 13 THR O 1 1
12 2376 1 1 13 THR OG1 O -3.485 11.219 1.109 1.00 . A A . 13 THR OG1 1 1
12 2377 1 1 14 ALA C C -4.816 7.024 6.349 1.00 . A A . 14 ALA C 1 1
12 2378 1 1 14 ALA CA C -3.588 6.710 5.466 1.00 . A A . 14 ALA CA 1 1
12 2379 1 1 14 ALA CB C -2.381 6.248 6.303 1.00 . A A . 14 ALA CB 1 1
12 2380 1 1 14 ALA H H -2.537 8.602 5.050 1.00 . A A . 14 ALA H 1 1
12 2381 1 1 14 ALA HXT H -6.694 6.575 6.478 1.00 . A A . 14 ALA HXT 1 1
12 2382 1 1 14 ALA HA H -3.840 5.870 4.789 1.00 . A A . 14 ALA HA 1 1
12 2383 1 1 14 ALA HB1 H -1.516 5.991 5.662 1.00 . A A . 14 ALA HB1 1 1
12 2384 1 1 14 ALA HB2 H -2.039 7.022 7.018 1.00 . A A . 14 ALA HB2 1 1
12 2385 1 1 14 ALA HB3 H -2.617 5.342 6.891 1.00 . A A . 14 ALA HB3 1 1
12 2386 1 1 14 ALA N N -3.187 7.900 4.679 1.00 . A A . 14 ALA N 1 1
12 2387 1 1 14 ALA O O -4.796 7.788 7.315 1.00 . A A . 14 ALA O 1 1
12 2388 1 1 14 ALA OXT O -5.937 6.359 5.928 1.00 . A A . 14 ALA OXT 1 1
13 2389 1 1 1 ACE C C 7.607 7.648 0.912 1.00 . A A . 1 ACE C 1 1
13 2390 1 1 1 ACE CH3 C 8.092 8.954 0.294 1.00 . A A . 1 ACE CH3 1 1
13 2391 1 1 1 ACE H1 H 7.239 9.591 -0.007 1.00 . A A . 1 ACE H1 1 1
13 2392 1 1 1 ACE H2 H 8.700 9.541 1.007 1.00 . A A . 1 ACE H2 1 1
13 2393 1 1 1 ACE H3 H 8.703 8.772 -0.609 1.00 . A A . 1 ACE H3 1 1
13 2394 1 1 1 ACE O O 6.403 7.385 0.945 1.00 . A A . 1 ACE O 1 1
13 2395 1 1 2 ILE C C 8.790 5.657 3.500 1.00 . A A . 2 ILE C 1 1
13 2396 1 1 2 ILE CA C 8.298 5.527 2.032 1.00 . A A . 2 ILE CA 1 1
13 2397 1 1 2 ILE CB C 8.933 4.322 1.242 1.00 . A A . 2 ILE CB 1 1
13 2398 1 1 2 ILE CD1 C 6.995 3.994 -0.534 1.00 . A A . 2 ILE CD1 1 1
13 2399 1 1 2 ILE CG1 C 8.496 4.192 -0.251 1.00 . A A . 2 ILE CG1 1 1
13 2400 1 1 2 ILE CG2 C 8.750 2.955 1.953 1.00 . A A . 2 ILE CG2 1 1
13 2401 1 1 2 ILE H H 9.508 7.263 1.372 1.00 . A A . 2 ILE H 1 1
13 2402 1 1 2 ILE HA H 7.206 5.358 2.065 1.00 . A A . 2 ILE HA 1 1
13 2403 1 1 2 ILE HB H 10.027 4.500 1.218 1.00 . A A . 2 ILE HB 1 1
13 2404 1 1 2 ILE HD11 H 6.604 3.072 -0.067 1.00 . A A . 2 ILE HD11 1 1
13 2405 1 1 2 ILE HD12 H 6.391 4.840 -0.162 1.00 . A A . 2 ILE HD12 1 1
13 2406 1 1 2 ILE HD13 H 6.803 3.913 -1.619 1.00 . A A . 2 ILE HD13 1 1
13 2407 1 1 2 ILE HG12 H 8.833 5.086 -0.809 1.00 . A A . 2 ILE HG12 1 1
13 2408 1 1 2 ILE HG13 H 9.050 3.358 -0.726 1.00 . A A . 2 ILE HG13 1 1
13 2409 1 1 2 ILE HG21 H 9.223 2.129 1.388 1.00 . A A . 2 ILE HG21 1 1
13 2410 1 1 2 ILE HG22 H 9.214 2.947 2.956 1.00 . A A . 2 ILE HG22 1 1
13 2411 1 1 2 ILE HG23 H 7.685 2.693 2.088 1.00 . A A . 2 ILE HG23 1 1
13 2412 1 1 2 ILE N N 8.571 6.846 1.386 1.00 . A A . 2 ILE N 1 1
13 2413 1 1 2 ILE O O 9.974 5.911 3.750 1.00 . A A . 2 ILE O 1 1
13 2414 1 1 3 TRP C C 7.869 4.300 6.771 1.00 . A A . 3 TRP C 1 1
13 2415 1 1 3 TRP CA C 8.182 5.576 5.920 1.00 . A A . 3 TRP CA 1 1
13 2416 1 1 3 TRP CB C 7.447 6.842 6.463 1.00 . A A . 3 TRP CB 1 1
13 2417 1 1 3 TRP CD1 C 8.895 8.848 5.584 1.00 . A A . 3 TRP CD1 1 1
13 2418 1 1 3 TRP CD2 C 6.809 8.794 4.831 1.00 . A A . 3 TRP CD2 1 1
13 2419 1 1 3 TRP CE2 C 7.488 9.902 4.264 1.00 . A A . 3 TRP CE2 1 1
13 2420 1 1 3 TRP CE3 C 5.509 8.445 4.391 1.00 . A A . 3 TRP CE3 1 1
13 2421 1 1 3 TRP CG C 7.675 8.157 5.697 1.00 . A A . 3 TRP CG 1 1
13 2422 1 1 3 TRP CH2 C 5.552 10.362 2.889 1.00 . A A . 3 TRP CH2 1 1
13 2423 1 1 3 TRP CZ2 C 6.848 10.698 3.284 1.00 . A A . 3 TRP CZ2 1 1
13 2424 1 1 3 TRP CZ3 C 4.899 9.249 3.430 1.00 . A A . 3 TRP CZ3 1 1
13 2425 1 1 3 TRP H H 6.920 5.258 4.125 1.00 . A A . 3 TRP H 1 1
13 2426 1 1 3 TRP HA H 9.264 5.757 6.070 1.00 . A A . 3 TRP HA 1 1
13 2427 1 1 3 TRP HB2 H 6.362 6.636 6.522 1.00 . A A . 3 TRP HB2 1 1
13 2428 1 1 3 TRP HB3 H 7.746 7.011 7.516 1.00 . A A . 3 TRP HB3 1 1
13 2429 1 1 3 TRP HD1 H 9.820 8.457 5.972 1.00 . A A . 3 TRP HD1 1 1
13 2430 1 1 3 TRP HE1 H 9.543 10.584 4.412 1.00 . A A . 3 TRP HE1 1 1
13 2431 1 1 3 TRP HE3 H 5.021 7.554 4.762 1.00 . A A . 3 TRP HE3 1 1
13 2432 1 1 3 TRP HH2 H 5.054 10.955 2.135 1.00 . A A . 3 TRP HH2 1 1
13 2433 1 1 3 TRP HZ2 H 7.360 11.534 2.828 1.00 . A A . 3 TRP HZ2 1 1
13 2434 1 1 3 TRP HZ3 H 3.911 8.995 3.088 1.00 . A A . 3 TRP HZ3 1 1
13 2435 1 1 3 TRP N N 7.870 5.445 4.461 1.00 . A A . 3 TRP N 1 1
13 2436 1 1 3 TRP NE1 N 8.793 9.959 4.726 1.00 . A A . 3 TRP NE1 1 1
13 2437 1 1 3 TRP O O 7.438 4.401 7.925 1.00 . A A . 3 TRP O 1 1
13 2438 1 1 4 GLY C C 6.393 1.433 7.053 1.00 . A A . 4 GLY C 1 1
13 2439 1 1 4 GLY CA C 7.882 1.813 6.921 1.00 . A A . 4 GLY CA 1 1
13 2440 1 1 4 GLY H H 8.408 3.163 5.236 1.00 . A A . 4 GLY H 1 1
13 2441 1 1 4 GLY HA2 H 8.428 1.010 6.394 1.00 . A A . 4 GLY HA2 1 1
13 2442 1 1 4 GLY HA3 H 8.341 1.841 7.929 1.00 . A A . 4 GLY HA3 1 1
13 2443 1 1 4 GLY N N 8.129 3.098 6.222 1.00 . A A . 4 GLY N 1 1
13 2444 1 1 4 GLY O O 5.814 1.589 8.131 1.00 . A A . 4 GLY O 1 1
13 2445 1 1 5 . C C 3.435 1.702 5.512 1.00 . A A . 5 SET C 1 1
13 2446 1 1 5 . CA C 4.358 0.522 5.937 1.00 . A A . 5 SET CA 1 1
13 2447 1 1 5 . CB C 4.192 -0.807 5.131 1.00 . A A . 5 SET CB 1 1
13 2448 1 1 5 . H H 6.386 0.887 5.124 1.00 . A A . 5 SET H 1 1
13 2449 1 1 5 . HA H 4.033 0.290 6.973 1.00 . A A . 5 SET HA 1 1
13 2450 1 1 5 . HB2 H 2.383 1.373 5.596 1.00 . A A . 5 SET HB2 1 1
13 2451 1 1 5 . HB3 H 3.517 2.521 6.255 1.00 . A A . 5 SET HB3 1 1
13 2452 1 1 5 . HNT2 H 3.295 1.597 3.376 1.00 . A A . 5 SET HNT2 1 1
13 2453 1 1 5 . N N 5.794 0.931 5.960 1.00 . A A . 5 SET N 1 1
13 2454 1 1 5 . NT N 3.637 2.203 4.131 1.00 . A A . 5 SET NT 1 1
13 2455 1 1 5 . OG O 3.738 -0.834 3.984 1.00 . A A . 5 SET OG 1 1
13 2456 1 1 6 SER C C 3.119 -3.947 5.458 1.00 . A A . 6 SER C 1 1
13 2457 1 1 6 SER CA C 4.513 -3.291 5.229 1.00 . A A . 6 SER CA 1 1
13 2458 1 1 6 SER CB C 5.653 -4.113 5.874 1.00 . A A . 6 SER CB 1 1
13 2459 1 1 6 SER H H 4.935 -1.700 6.721 1.00 . A A . 6 SER H 1 1
13 2460 1 1 6 SER HA H 4.728 -3.237 4.141 1.00 . A A . 6 SER HA 1 1
13 2461 1 1 6 SER HB2 H 6.625 -3.595 5.753 1.00 . A A . 6 SER HB2 1 1
13 2462 1 1 6 SER HB3 H 5.501 -4.226 6.964 1.00 . A A . 6 SER HB3 1 1
13 2463 1 1 6 SER HG H 4.951 -5.871 5.496 1.00 . A A . 6 SER HG 1 1
13 2464 1 1 6 SER N N 4.573 -1.914 5.790 1.00 . A A . 6 SER N 1 1
13 2465 1 1 6 SER O O 2.487 -3.759 6.505 1.00 . A A . 6 SER O 1 1
13 2466 1 1 6 SER OG O 5.760 -5.401 5.276 1.00 . A A . 6 SER OG 1 1
13 2467 1 1 7 GLY C C 0.277 -4.515 3.850 1.00 . A A . 7 GLY C 1 1
13 2468 1 1 7 GLY CA C 1.332 -5.407 4.531 1.00 . A A . 7 GLY CA 1 1
13 2469 1 1 7 GLY H H 3.262 -4.798 3.644 1.00 . A A . 7 GLY H 1 1
13 2470 1 1 7 GLY HA2 H 1.392 -6.374 3.998 1.00 . A A . 7 GLY HA2 1 1
13 2471 1 1 7 GLY HA3 H 1.036 -5.665 5.568 1.00 . A A . 7 GLY HA3 1 1
13 2472 1 1 7 GLY N N 2.661 -4.743 4.473 1.00 . A A . 7 GLY N 1 1
13 2473 1 1 7 GLY O O -0.098 -4.751 2.699 1.00 . A A . 7 GLY O 1 1
13 2474 1 1 8 LYS C C -0.294 -1.276 3.583 1.00 . A A . 8 LYS C 1 1
13 2475 1 1 8 LYS CA C -1.146 -2.482 4.085 1.00 . A A . 8 LYS CA 1 1
13 2476 1 1 8 LYS CB C -2.105 -2.165 5.262 1.00 . A A . 8 LYS CB 1 1
13 2477 1 1 8 LYS CD C -4.254 -0.994 6.085 1.00 . A A . 8 LYS CD 1 1
13 2478 1 1 8 LYS CE C -3.741 -0.241 7.333 1.00 . A A . 8 LYS CE 1 1
13 2479 1 1 8 LYS CG C -3.259 -1.200 4.920 1.00 . A A . 8 LYS CG 1 1
13 2480 1 1 8 LYS H H 0.245 -3.387 5.510 1.00 . A A . 8 LYS H 1 1
13 2481 1 1 8 LYS HA H -1.754 -2.899 3.256 1.00 . A A . 8 LYS HA 1 1
13 2482 1 1 8 LYS HB2 H -2.548 -3.112 5.633 1.00 . A A . 8 LYS HB2 1 1
13 2483 1 1 8 LYS HB3 H -1.527 -1.760 6.115 1.00 . A A . 8 LYS HB3 1 1
13 2484 1 1 8 LYS HD2 H -5.150 -0.482 5.691 1.00 . A A . 8 LYS HD2 1 1
13 2485 1 1 8 LYS HD3 H -4.618 -1.990 6.404 1.00 . A A . 8 LYS HD3 1 1
13 2486 1 1 8 LYS HE2 H -4.510 -0.297 8.128 1.00 . A A . 8 LYS HE2 1 1
13 2487 1 1 8 LYS HE3 H -2.852 -0.746 7.755 1.00 . A A . 8 LYS HE3 1 1
13 2488 1 1 8 LYS HG2 H -2.861 -0.226 4.580 1.00 . A A . 8 LYS HG2 1 1
13 2489 1 1 8 LYS HG3 H -3.816 -1.602 4.052 1.00 . A A . 8 LYS HG3 1 1
13 2490 1 1 8 LYS HZ1 H -2.693 1.283 6.362 1.00 . A A . 8 LYS HZ1 1 1
13 2491 1 1 8 LYS HZ2 H -4.252 1.691 6.713 1.00 . A A . 8 LYS HZ2 1 1
13 2492 1 1 8 LYS HZ3 H -3.113 1.673 7.908 1.00 . A A . 8 LYS HZ3 1 1
13 2493 1 1 8 LYS N N -0.176 -3.483 4.583 1.00 . A A . 8 LYS N 1 1
13 2494 1 1 8 LYS NZ N -3.433 1.181 7.066 1.00 . A A . 8 LYS NZ 1 1
13 2495 1 1 8 LYS O O 0.020 -0.351 4.342 1.00 . A A . 8 LYS O 1 1
13 2496 1 1 9 LEU C C 0.098 1.007 1.321 1.00 . A A . 9 LEU C 1 1
13 2497 1 1 9 LEU CA C 0.922 -0.273 1.650 1.00 . A A . 9 LEU CA 1 1
13 2498 1 1 9 LEU CB C 1.637 -0.838 0.382 1.00 . A A . 9 LEU CB 1 1
13 2499 1 1 9 LEU CD1 C 2.657 -3.085 1.196 1.00 . A A . 9 LEU CD1 1 1
13 2500 1 1 9 LEU CD2 C 3.715 -1.837 -0.710 1.00 . A A . 9 LEU CD2 1 1
13 2501 1 1 9 LEU CG C 2.921 -1.689 0.603 1.00 . A A . 9 LEU CG 1 1
13 2502 1 1 9 LEU H H -0.091 -2.224 1.842 1.00 . A A . 9 LEU H 1 1
13 2503 1 1 9 LEU HA H 1.734 0.001 2.356 1.00 . A A . 9 LEU HA 1 1
13 2504 1 1 9 LEU HB2 H 0.917 -1.384 -0.260 1.00 . A A . 9 LEU HB2 1 1
13 2505 1 1 9 LEU HB3 H 1.939 0.029 -0.239 1.00 . A A . 9 LEU HB3 1 1
13 2506 1 1 9 LEU HD11 H 3.589 -3.672 1.301 1.00 . A A . 9 LEU HD11 1 1
13 2507 1 1 9 LEU HD12 H 2.225 -3.016 2.208 1.00 . A A . 9 LEU HD12 1 1
13 2508 1 1 9 LEU HD13 H 1.960 -3.680 0.577 1.00 . A A . 9 LEU HD13 1 1
13 2509 1 1 9 LEU HD21 H 4.659 -2.391 -0.559 1.00 . A A . 9 LEU HD21 1 1
13 2510 1 1 9 LEU HD22 H 3.140 -2.375 -1.487 1.00 . A A . 9 LEU HD22 1 1
13 2511 1 1 9 LEU HD23 H 3.993 -0.853 -1.133 1.00 . A A . 9 LEU HD23 1 1
13 2512 1 1 9 LEU HG H 3.566 -1.146 1.316 1.00 . A A . 9 LEU HG 1 1
13 2513 1 1 9 LEU N N 0.081 -1.319 2.290 1.00 . A A . 9 LEU N 1 1
13 2514 1 1 9 LEU O O -0.603 1.085 0.307 1.00 . A A . 9 LEU O 1 1
13 2515 1 1 10 ILE C C 0.491 4.366 2.708 1.00 . A A . 10 ILE C 1 1
13 2516 1 1 10 ILE CA C -0.478 3.313 2.087 1.00 . A A . 10 ILE CA 1 1
13 2517 1 1 10 ILE CB C -1.956 3.276 2.628 1.00 . A A . 10 ILE CB 1 1
13 2518 1 1 10 ILE CD1 C -2.980 4.917 0.885 1.00 . A A . 10 ILE CD1 1 1
13 2519 1 1 10 ILE CG1 C -2.759 4.581 2.368 1.00 . A A . 10 ILE CG1 1 1
13 2520 1 1 10 ILE CG2 C -2.111 2.872 4.118 1.00 . A A . 10 ILE CG2 1 1
13 2521 1 1 10 ILE H H 0.732 1.768 3.061 1.00 . A A . 10 ILE H 1 1
13 2522 1 1 10 ILE HA H -0.549 3.550 1.006 1.00 . A A . 10 ILE HA 1 1
13 2523 1 1 10 ILE HB H -2.475 2.479 2.059 1.00 . A A . 10 ILE HB 1 1
13 2524 1 1 10 ILE HD11 H -2.030 5.152 0.371 1.00 . A A . 10 ILE HD11 1 1
13 2525 1 1 10 ILE HD12 H -3.455 4.077 0.347 1.00 . A A . 10 ILE HD12 1 1
13 2526 1 1 10 ILE HD13 H -3.635 5.799 0.773 1.00 . A A . 10 ILE HD13 1 1
13 2527 1 1 10 ILE HG12 H -3.759 4.505 2.838 1.00 . A A . 10 ILE HG12 1 1
13 2528 1 1 10 ILE HG13 H -2.272 5.440 2.868 1.00 . A A . 10 ILE HG13 1 1
13 2529 1 1 10 ILE HG21 H -1.591 1.923 4.342 1.00 . A A . 10 ILE HG21 1 1
13 2530 1 1 10 ILE HG22 H -1.709 3.636 4.808 1.00 . A A . 10 ILE HG22 1 1
13 2531 1 1 10 ILE HG23 H -3.173 2.721 4.387 1.00 . A A . 10 ILE HG23 1 1
13 2532 1 1 10 ILE N N 0.203 1.999 2.217 1.00 . A A . 10 ILE N 1 1
13 2533 1 1 10 ILE O O 0.300 4.826 3.839 1.00 . A A . 10 ILE O 1 1
13 2534 1 1 11 GLU C C 2.193 7.154 1.856 1.00 . A A . 11 GLU C 1 1
13 2535 1 1 11 GLU CA C 2.557 5.732 2.415 1.00 . A A . 11 GLU CA 1 1
13 2536 1 1 11 GLU CB C 3.987 5.251 2.018 1.00 . A A . 11 GLU CB 1 1
13 2537 1 1 11 GLU CD C 4.270 3.371 3.857 1.00 . A A . 11 GLU CD 1 1
13 2538 1 1 11 GLU CG C 4.454 3.812 2.382 1.00 . A A . 11 GLU CG 1 1
13 2539 1 1 11 GLU H H 1.633 4.263 1.051 1.00 . A A . 11 GLU H 1 1
13 2540 1 1 11 GLU HA H 2.597 5.766 3.525 1.00 . A A . 11 GLU HA 1 1
13 2541 1 1 11 GLU HB2 H 4.126 5.373 0.926 1.00 . A A . 11 GLU HB2 1 1
13 2542 1 1 11 GLU HB3 H 4.712 5.961 2.462 1.00 . A A . 11 GLU HB3 1 1
13 2543 1 1 11 GLU HG2 H 3.989 3.104 1.674 1.00 . A A . 11 GLU HG2 1 1
13 2544 1 1 11 GLU HG3 H 5.534 3.759 2.138 1.00 . A A . 11 GLU HG3 1 1
13 2545 1 1 11 GLU N N 1.543 4.747 1.950 1.00 . A A . 11 GLU N 1 1
13 2546 1 1 11 GLU O O 2.899 7.678 0.987 1.00 . A A . 11 GLU O 1 1
13 2547 1 1 11 GLU OE1 O 4.702 4.112 4.745 1.00 . A A . 11 GLU OE1 1 1
13 2548 1 1 12 THR C C 1.466 10.282 2.582 1.00 . A A . 12 THR C 1 1
13 2549 1 1 12 THR CA C 0.666 9.147 1.868 1.00 . A A . 12 THR CA 1 1
13 2550 1 1 12 THR CB C -0.888 9.332 1.905 1.00 . A A . 12 THR CB 1 1
13 2551 1 1 12 THR CG2 C -1.397 10.618 1.215 1.00 . A A . 12 THR CG2 1 1
13 2552 1 1 12 THR H H 0.504 7.222 2.964 1.00 . A A . 12 THR H 1 1
13 2553 1 1 12 THR HA H 0.929 9.217 0.793 1.00 . A A . 12 THR HA 1 1
13 2554 1 1 12 THR HB H -1.237 9.356 2.956 1.00 . A A . 12 THR HB 1 1
13 2555 1 1 12 THR HG1 H -1.273 8.287 0.333 1.00 . A A . 12 THR HG1 1 1
13 2556 1 1 12 THR HG21 H -1.008 11.535 1.697 1.00 . A A . 12 THR HG21 1 1
13 2557 1 1 12 THR HG22 H -1.107 10.667 0.148 1.00 . A A . 12 THR HG22 1 1
13 2558 1 1 12 THR HG23 H -2.500 10.692 1.250 1.00 . A A . 12 THR HG23 1 1
13 2559 1 1 12 THR N N 1.100 7.792 2.348 1.00 . A A . 12 THR N 1 1
13 2560 1 1 12 THR O O 2.261 10.956 1.921 1.00 . A A . 12 THR O 1 1
13 2561 1 1 12 THR OG1 O -1.532 8.239 1.256 1.00 . A A . 12 THR OG1 1 1
13 2562 1 1 13 THR C C 2.204 10.988 6.108 1.00 . A A . 13 THR C 1 1
13 2563 1 1 13 THR CA C 1.972 11.551 4.674 1.00 . A A . 13 THR CA 1 1
13 2564 1 1 13 THR CB C 1.165 12.889 4.671 1.00 . A A . 13 THR CB 1 1
13 2565 1 1 13 THR CG2 C 1.878 14.047 5.387 1.00 . A A . 13 THR CG2 1 1
13 2566 1 1 13 THR H H 0.542 9.912 4.334 1.00 . A A . 13 THR H 1 1
13 2567 1 1 13 THR HA H 2.955 11.756 4.201 1.00 . A A . 13 THR HA 1 1
13 2568 1 1 13 THR HB H 0.185 12.729 5.161 1.00 . A A . 13 THR HB 1 1
13 2569 1 1 13 THR HG1 H 1.778 13.373 2.908 1.00 . A A . 13 THR HG1 1 1
13 2570 1 1 13 THR HG21 H 2.040 13.825 6.458 1.00 . A A . 13 THR HG21 1 1
13 2571 1 1 13 THR HG22 H 2.865 14.259 4.937 1.00 . A A . 13 THR HG22 1 1
13 2572 1 1 13 THR HG23 H 1.280 14.974 5.336 1.00 . A A . 13 THR HG23 1 1
13 2573 1 1 13 THR N N 1.262 10.497 3.900 1.00 . A A . 13 THR N 1 1
13 2574 1 1 13 THR O O 1.249 10.799 6.869 1.00 . A A . 13 THR O 1 1
13 2575 1 1 13 THR OG1 O 0.920 13.327 3.337 1.00 . A A . 13 THR OG1 1 1
13 2576 1 1 14 ALA C C 5.229 10.767 8.196 1.00 . A A . 14 ALA C 1 1
13 2577 1 1 14 ALA CA C 3.849 10.200 7.803 1.00 . A A . 14 ALA CA 1 1
13 2578 1 1 14 ALA CB C 3.837 8.658 7.816 1.00 . A A . 14 ALA CB 1 1
13 2579 1 1 14 ALA H H 4.178 10.897 5.736 1.00 . A A . 14 ALA H 1 1
13 2580 1 1 14 ALA HXT H 6.011 12.008 9.458 1.00 . A A . 14 ALA HXT 1 1
13 2581 1 1 14 ALA HA H 3.113 10.541 8.559 1.00 . A A . 14 ALA HA 1 1
13 2582 1 1 14 ALA HB1 H 2.843 8.256 7.542 1.00 . A A . 14 ALA HB1 1 1
13 2583 1 1 14 ALA HB2 H 4.570 8.226 7.110 1.00 . A A . 14 ALA HB2 1 1
13 2584 1 1 14 ALA HB3 H 4.078 8.260 8.818 1.00 . A A . 14 ALA HB3 1 1
13 2585 1 1 14 ALA N N 3.477 10.729 6.466 1.00 . A A . 14 ALA N 1 1
13 2586 1 1 14 ALA O O 6.286 10.457 7.646 1.00 . A A . 14 ALA O 1 1
13 2587 1 1 14 ALA OXT O 5.146 11.663 9.228 1.00 . A A . 14 ALA OXT 1 1
14 2588 1 1 1 ACE C C 6.365 8.524 0.883 1.00 . A A . 1 ACE C 1 1
14 2589 1 1 1 ACE CH3 C 6.423 9.910 0.249 1.00 . A A . 1 ACE CH3 1 1
14 2590 1 1 1 ACE H1 H 5.520 10.107 -0.357 1.00 . A A . 1 ACE H1 1 1
14 2591 1 1 1 ACE H2 H 6.484 10.708 1.012 1.00 . A A . 1 ACE H2 1 1
14 2592 1 1 1 ACE H3 H 7.297 10.008 -0.421 1.00 . A A . 1 ACE H3 1 1
14 2593 1 1 1 ACE O O 5.462 7.739 0.581 1.00 . A A . 1 ACE O 1 1
14 2594 1 1 2 ILE C C 7.275 7.247 3.989 1.00 . A A . 2 ILE C 1 1
14 2595 1 1 2 ILE CA C 7.460 6.947 2.474 1.00 . A A . 2 ILE CA 1 1
14 2596 1 1 2 ILE CB C 8.786 6.174 2.129 1.00 . A A . 2 ILE CB 1 1
14 2597 1 1 2 ILE CD1 C 7.974 5.077 -0.140 1.00 . A A . 2 ILE CD1 1 1
14 2598 1 1 2 ILE CG1 C 9.036 5.899 0.611 1.00 . A A . 2 ILE CG1 1 1
14 2599 1 1 2 ILE CG2 C 8.944 4.847 2.919 1.00 . A A . 2 ILE CG2 1 1
14 2600 1 1 2 ILE H H 7.947 9.053 1.979 1.00 . A A . 2 ILE H 1 1
14 2601 1 1 2 ILE HA H 6.624 6.297 2.163 1.00 . A A . 2 ILE HA 1 1
14 2602 1 1 2 ILE HB H 9.626 6.819 2.457 1.00 . A A . 2 ILE HB 1 1
14 2603 1 1 2 ILE HD11 H 6.987 5.573 -0.133 1.00 . A A . 2 ILE HD11 1 1
14 2604 1 1 2 ILE HD12 H 8.256 4.937 -1.200 1.00 . A A . 2 ILE HD12 1 1
14 2605 1 1 2 ILE HD13 H 7.845 4.069 0.296 1.00 . A A . 2 ILE HD13 1 1
14 2606 1 1 2 ILE HG12 H 9.158 6.863 0.083 1.00 . A A . 2 ILE HG12 1 1
14 2607 1 1 2 ILE HG13 H 10.016 5.400 0.482 1.00 . A A . 2 ILE HG13 1 1
14 2608 1 1 2 ILE HG21 H 9.892 4.330 2.675 1.00 . A A . 2 ILE HG21 1 1
14 2609 1 1 2 ILE HG22 H 8.959 5.017 4.011 1.00 . A A . 2 ILE HG22 1 1
14 2610 1 1 2 ILE HG23 H 8.121 4.139 2.714 1.00 . A A . 2 ILE HG23 1 1
14 2611 1 1 2 ILE N N 7.345 8.251 1.755 1.00 . A A . 2 ILE N 1 1
14 2612 1 1 2 ILE O O 8.071 7.980 4.587 1.00 . A A . 2 ILE O 1 1
14 2613 1 1 3 TRP C C 5.826 5.551 6.914 1.00 . A A . 3 TRP C 1 1
14 2614 1 1 3 TRP CA C 5.909 6.854 6.046 1.00 . A A . 3 TRP CA 1 1
14 2615 1 1 3 TRP CB C 4.583 7.676 6.125 1.00 . A A . 3 TRP CB 1 1
14 2616 1 1 3 TRP CD1 C 5.369 10.103 5.534 1.00 . A A . 3 TRP CD1 1 1
14 2617 1 1 3 TRP CD2 C 3.866 9.242 4.145 1.00 . A A . 3 TRP CD2 1 1
14 2618 1 1 3 TRP CE2 C 4.258 10.523 3.684 1.00 . A A . 3 TRP CE2 1 1
14 2619 1 1 3 TRP CE3 C 3.041 8.410 3.346 1.00 . A A . 3 TRP CE3 1 1
14 2620 1 1 3 TRP CG C 4.535 8.990 5.328 1.00 . A A . 3 TRP CG 1 1
14 2621 1 1 3 TRP CH2 C 2.964 10.177 1.672 1.00 . A A . 3 TRP CH2 1 1
14 2622 1 1 3 TRP CZ2 C 3.796 10.997 2.434 1.00 . A A . 3 TRP CZ2 1 1
14 2623 1 1 3 TRP CZ3 C 2.596 8.901 2.120 1.00 . A A . 3 TRP CZ3 1 1
14 2624 1 1 3 TRP H H 5.607 6.130 3.971 1.00 . A A . 3 TRP H 1 1
14 2625 1 1 3 TRP HA H 6.692 7.467 6.533 1.00 . A A . 3 TRP HA 1 1
14 2626 1 1 3 TRP HB2 H 3.734 7.032 5.824 1.00 . A A . 3 TRP HB2 1 1
14 2627 1 1 3 TRP HB3 H 4.370 7.923 7.183 1.00 . A A . 3 TRP HB3 1 1
14 2628 1 1 3 TRP HD1 H 6.174 10.097 6.252 1.00 . A A . 3 TRP HD1 1 1
14 2629 1 1 3 TRP HE1 H 5.728 11.948 4.405 1.00 . A A . 3 TRP HE1 1 1
14 2630 1 1 3 TRP HE3 H 2.797 7.407 3.664 1.00 . A A . 3 TRP HE3 1 1
14 2631 1 1 3 TRP HH2 H 2.614 10.527 0.714 1.00 . A A . 3 TRP HH2 1 1
14 2632 1 1 3 TRP HZ2 H 4.105 11.963 2.059 1.00 . A A . 3 TRP HZ2 1 1
14 2633 1 1 3 TRP HZ3 H 1.962 8.283 1.503 1.00 . A A . 3 TRP HZ3 1 1
14 2634 1 1 3 TRP N N 6.239 6.640 4.599 1.00 . A A . 3 TRP N 1 1
14 2635 1 1 3 TRP NE1 N 5.189 11.086 4.542 1.00 . A A . 3 TRP NE1 1 1
14 2636 1 1 3 TRP O O 5.100 5.521 7.914 1.00 . A A . 3 TRP O 1 1
14 2637 1 1 4 GLY C C 5.320 2.372 7.035 1.00 . A A . 4 GLY C 1 1
14 2638 1 1 4 GLY CA C 6.581 3.212 7.330 1.00 . A A . 4 GLY CA 1 1
14 2639 1 1 4 GLY H H 7.149 4.649 5.732 1.00 . A A . 4 GLY H 1 1
14 2640 1 1 4 GLY HA2 H 7.498 2.641 7.086 1.00 . A A . 4 GLY HA2 1 1
14 2641 1 1 4 GLY HA3 H 6.649 3.402 8.418 1.00 . A A . 4 GLY HA3 1 1
14 2642 1 1 4 GLY N N 6.594 4.494 6.580 1.00 . A A . 4 GLY N 1 1
14 2643 1 1 4 GLY O O 4.314 2.519 7.734 1.00 . A A . 4 GLY O 1 1
14 2644 1 1 5 . C C 3.305 1.386 4.579 1.00 . A A . 5 SET C 1 1
14 2645 1 1 5 . CA C 4.229 0.655 5.601 1.00 . A A . 5 SET CA 1 1
14 2646 1 1 5 . CB C 4.701 -0.743 5.097 1.00 . A A . 5 SET CB 1 1
14 2647 1 1 5 . H H 6.274 1.498 5.500 1.00 . A A . 5 SET H 1 1
14 2648 1 1 5 . HA H 3.592 0.502 6.495 1.00 . A A . 5 SET HA 1 1
14 2649 1 1 5 . HB2 H 2.467 0.713 4.325 1.00 . A A . 5 SET HB2 1 1
14 2650 1 1 5 . HB3 H 2.801 2.229 5.097 1.00 . A A . 5 SET HB3 1 1
14 2651 1 1 5 . HNT2 H 4.118 1.204 2.537 1.00 . A A . 5 SET HNT2 1 1
14 2652 1 1 5 . N N 5.385 1.503 6.012 1.00 . A A . 5 SET N 1 1
14 2653 1 1 5 . NT N 3.928 1.853 3.308 1.00 . A A . 5 SET NT 1 1
14 2654 1 1 5 . OG O 5.551 -0.843 4.206 1.00 . A A . 5 SET OG 1 1
14 2655 1 1 6 SER C C 3.121 -4.034 5.456 1.00 . A A . 6 SER C 1 1
14 2656 1 1 6 SER CA C 4.444 -3.225 5.319 1.00 . A A . 6 SER CA 1 1
14 2657 1 1 6 SER CB C 5.565 -3.771 6.234 1.00 . A A . 6 SER CB 1 1
14 2658 1 1 6 SER H H 3.415 -1.611 6.383 1.00 . A A . 6 SER H 1 1
14 2659 1 1 6 SER HA H 4.812 -3.271 4.274 1.00 . A A . 6 SER HA 1 1
14 2660 1 1 6 SER HB2 H 6.463 -3.128 6.167 1.00 . A A . 6 SER HB2 1 1
14 2661 1 1 6 SER HB3 H 5.261 -3.759 7.299 1.00 . A A . 6 SER HB3 1 1
14 2662 1 1 6 SER HG H 5.165 -5.649 6.040 1.00 . A A . 6 SER HG 1 1
14 2663 1 1 6 SER N N 4.127 -1.816 5.676 1.00 . A A . 6 SER N 1 1
14 2664 1 1 6 SER O O 2.507 -4.053 6.530 1.00 . A A . 6 SER O 1 1
14 2665 1 1 6 SER OG O 5.929 -5.095 5.858 1.00 . A A . 6 SER OG 1 1
14 2666 1 1 7 GLY C C 0.302 -4.625 3.743 1.00 . A A . 7 GLY C 1 1
14 2667 1 1 7 GLY CA C 1.418 -5.483 4.369 1.00 . A A . 7 GLY CA 1 1
14 2668 1 1 7 GLY H H 3.278 -4.628 3.537 1.00 . A A . 7 GLY H 1 1
14 2669 1 1 7 GLY HA2 H 1.557 -6.399 3.767 1.00 . A A . 7 GLY HA2 1 1
14 2670 1 1 7 GLY HA3 H 1.132 -5.840 5.379 1.00 . A A . 7 GLY HA3 1 1
14 2671 1 1 7 GLY N N 2.690 -4.710 4.374 1.00 . A A . 7 GLY N 1 1
14 2672 1 1 7 GLY O O -0.040 -4.810 2.572 1.00 . A A . 7 GLY O 1 1
14 2673 1 1 8 LYS C C -0.432 -1.492 3.682 1.00 . A A . 8 LYS C 1 1
14 2674 1 1 8 LYS CA C -1.287 -2.729 4.078 1.00 . A A . 8 LYS CA 1 1
14 2675 1 1 8 LYS CB C -2.321 -2.526 5.217 1.00 . A A . 8 LYS CB 1 1
14 2676 1 1 8 LYS CD C -3.909 -0.434 5.230 1.00 . A A . 8 LYS CD 1 1
14 2677 1 1 8 LYS CE C -3.189 0.677 4.444 1.00 . A A . 8 LYS CE 1 1
14 2678 1 1 8 LYS CG C -3.674 -1.899 4.800 1.00 . A A . 8 LYS CG 1 1
14 2679 1 1 8 LYS H H 0.214 -3.523 5.430 1.00 . A A . 8 LYS H 1 1
14 2680 1 1 8 LYS HA H -1.825 -3.132 3.195 1.00 . A A . 8 LYS HA 1 1
14 2681 1 1 8 LYS HB2 H -2.565 -3.520 5.642 1.00 . A A . 8 LYS HB2 1 1
14 2682 1 1 8 LYS HB3 H -1.870 -1.980 6.069 1.00 . A A . 8 LYS HB3 1 1
14 2683 1 1 8 LYS HD2 H -4.997 -0.239 5.200 1.00 . A A . 8 LYS HD2 1 1
14 2684 1 1 8 LYS HD3 H -3.643 -0.338 6.300 1.00 . A A . 8 LYS HD3 1 1
14 2685 1 1 8 LYS HE2 H -3.410 1.650 4.922 1.00 . A A . 8 LYS HE2 1 1
14 2686 1 1 8 LYS HE3 H -2.096 0.566 4.533 1.00 . A A . 8 LYS HE3 1 1
14 2687 1 1 8 LYS HG2 H -3.866 -2.030 3.718 1.00 . A A . 8 LYS HG2 1 1
14 2688 1 1 8 LYS HG3 H -4.473 -2.497 5.279 1.00 . A A . 8 LYS HG3 1 1
14 2689 1 1 8 LYS HZ1 H -3.370 -0.138 2.527 1.00 . A A . 8 LYS HZ1 1 1
14 2690 1 1 8 LYS HZ2 H -4.582 0.915 2.899 1.00 . A A . 8 LYS HZ2 1 1
14 2691 1 1 8 LYS HZ3 H -3.081 1.482 2.510 1.00 . A A . 8 LYS HZ3 1 1
14 2692 1 1 8 LYS N N -0.256 -3.688 4.537 1.00 . A A . 8 LYS N 1 1
14 2693 1 1 8 LYS NZ N -3.577 0.740 3.017 1.00 . A A . 8 LYS NZ 1 1
14 2694 1 1 8 LYS O O -0.001 -0.695 4.525 1.00 . A A . 8 LYS O 1 1
14 2695 1 1 9 LEU C C 0.007 1.049 1.623 1.00 . A A . 9 LEU C 1 1
14 2696 1 1 9 LEU CA C 0.701 -0.331 1.800 1.00 . A A . 9 LEU CA 1 1
14 2697 1 1 9 LEU CB C 1.339 -0.818 0.463 1.00 . A A . 9 LEU CB 1 1
14 2698 1 1 9 LEU CD1 C 2.774 -2.435 -0.877 1.00 . A A . 9 LEU CD1 1 1
14 2699 1 1 9 LEU CD2 C 3.705 -1.502 1.268 1.00 . A A . 9 LEU CD2 1 1
14 2700 1 1 9 LEU CG C 2.418 -1.942 0.539 1.00 . A A . 9 LEU CG 1 1
14 2701 1 1 9 LEU H H -0.539 -2.176 1.830 1.00 . A A . 9 LEU H 1 1
14 2702 1 1 9 LEU HA H 1.558 -0.202 2.488 1.00 . A A . 9 LEU HA 1 1
14 2703 1 1 9 LEU HB2 H 0.525 -1.132 -0.221 1.00 . A A . 9 LEU HB2 1 1
14 2704 1 1 9 LEU HB3 H 1.801 0.048 -0.051 1.00 . A A . 9 LEU HB3 1 1
14 2705 1 1 9 LEU HD11 H 3.505 -3.264 -0.851 1.00 . A A . 9 LEU HD11 1 1
14 2706 1 1 9 LEU HD12 H 1.884 -2.818 -1.411 1.00 . A A . 9 LEU HD12 1 1
14 2707 1 1 9 LEU HD13 H 3.210 -1.633 -1.502 1.00 . A A . 9 LEU HD13 1 1
14 2708 1 1 9 LEU HD21 H 4.469 -2.302 1.271 1.00 . A A . 9 LEU HD21 1 1
14 2709 1 1 9 LEU HD22 H 4.167 -0.610 0.801 1.00 . A A . 9 LEU HD22 1 1
14 2710 1 1 9 LEU HD23 H 3.514 -1.258 2.327 1.00 . A A . 9 LEU HD23 1 1
14 2711 1 1 9 LEU HG H 2.009 -2.811 1.086 1.00 . A A . 9 LEU HG 1 1
14 2712 1 1 9 LEU N N -0.164 -1.391 2.372 1.00 . A A . 9 LEU N 1 1
14 2713 1 1 9 LEU O O -0.848 1.237 0.752 1.00 . A A . 9 LEU O 1 1
14 2714 1 1 10 ILE C C 1.190 4.330 2.200 1.00 . A A . 10 ILE C 1 1
14 2715 1 1 10 ILE CA C -0.061 3.415 2.458 1.00 . A A . 10 ILE CA 1 1
14 2716 1 1 10 ILE CB C -0.944 3.742 3.720 1.00 . A A . 10 ILE CB 1 1
14 2717 1 1 10 ILE CD1 C -2.638 5.341 2.530 1.00 . A A . 10 ILE CD1 1 1
14 2718 1 1 10 ILE CG1 C -1.639 5.132 3.680 1.00 . A A . 10 ILE CG1 1 1
14 2719 1 1 10 ILE CG2 C -0.226 3.567 5.086 1.00 . A A . 10 ILE CG2 1 1
14 2720 1 1 10 ILE H H 1.022 1.645 3.227 1.00 . A A . 10 ILE H 1 1
14 2721 1 1 10 ILE HA H -0.718 3.559 1.578 1.00 . A A . 10 ILE HA 1 1
14 2722 1 1 10 ILE HB H -1.764 3.003 3.722 1.00 . A A . 10 ILE HB 1 1
14 2723 1 1 10 ILE HD11 H -3.154 6.313 2.627 1.00 . A A . 10 ILE HD11 1 1
14 2724 1 1 10 ILE HD12 H -2.139 5.341 1.544 1.00 . A A . 10 ILE HD12 1 1
14 2725 1 1 10 ILE HD13 H -3.415 4.556 2.515 1.00 . A A . 10 ILE HD13 1 1
14 2726 1 1 10 ILE HG12 H -2.192 5.295 4.626 1.00 . A A . 10 ILE HG12 1 1
14 2727 1 1 10 ILE HG13 H -0.881 5.936 3.655 1.00 . A A . 10 ILE HG13 1 1
14 2728 1 1 10 ILE HG21 H 0.197 2.552 5.202 1.00 . A A . 10 ILE HG21 1 1
14 2729 1 1 10 ILE HG22 H 0.607 4.282 5.218 1.00 . A A . 10 ILE HG22 1 1
14 2730 1 1 10 ILE HG23 H -0.917 3.714 5.935 1.00 . A A . 10 ILE HG23 1 1
14 2731 1 1 10 ILE N N 0.407 1.996 2.486 1.00 . A A . 10 ILE N 1 1
14 2732 1 1 10 ILE O O 1.533 5.203 3.001 1.00 . A A . 10 ILE O 1 1
14 2733 1 1 11 GLU C C 2.821 5.638 -0.703 1.00 . A A . 11 GLU C 1 1
14 2734 1 1 11 GLU CA C 3.085 4.862 0.635 1.00 . A A . 11 GLU CA 1 1
14 2735 1 1 11 GLU CB C 4.232 3.796 0.550 1.00 . A A . 11 GLU CB 1 1
14 2736 1 1 11 GLU CD C 4.327 3.127 3.133 1.00 . A A . 11 GLU CD 1 1
14 2737 1 1 11 GLU CG C 5.059 3.497 1.829 1.00 . A A . 11 GLU CG 1 1
14 2738 1 1 11 GLU H H 1.475 3.364 0.470 1.00 . A A . 11 GLU H 1 1
14 2739 1 1 11 GLU HA H 3.398 5.607 1.398 1.00 . A A . 11 GLU HA 1 1
14 2740 1 1 11 GLU HB2 H 3.863 2.844 0.119 1.00 . A A . 11 GLU HB2 1 1
14 2741 1 1 11 GLU HB3 H 4.979 4.132 -0.194 1.00 . A A . 11 GLU HB3 1 1
14 2742 1 1 11 GLU HG2 H 5.815 2.722 1.596 1.00 . A A . 11 GLU HG2 1 1
14 2743 1 1 11 GLU HG3 H 5.672 4.389 2.041 1.00 . A A . 11 GLU HG3 1 1
14 2744 1 1 11 GLU N N 1.859 4.121 1.045 1.00 . A A . 11 GLU N 1 1
14 2745 1 1 11 GLU O O 3.522 5.429 -1.699 1.00 . A A . 11 GLU O 1 1
14 2746 1 1 11 GLU OE1 O 4.161 4.007 3.983 1.00 . A A . 11 GLU OE1 1 1
14 2747 1 1 12 THR C C 1.136 8.802 -1.484 1.00 . A A . 12 THR C 1 1
14 2748 1 1 12 THR CA C 1.466 7.347 -1.942 1.00 . A A . 12 THR CA 1 1
14 2749 1 1 12 THR CB C 0.371 6.640 -2.810 1.00 . A A . 12 THR CB 1 1
14 2750 1 1 12 THR CG2 C 0.016 7.383 -4.110 1.00 . A A . 12 THR CG2 1 1
14 2751 1 1 12 THR H H 1.234 6.584 0.110 1.00 . A A . 12 THR H 1 1
14 2752 1 1 12 THR HA H 2.363 7.437 -2.588 1.00 . A A . 12 THR HA 1 1
14 2753 1 1 12 THR HB H -0.553 6.527 -2.211 1.00 . A A . 12 THR HB 1 1
14 2754 1 1 12 THR HG1 H 0.127 4.995 -3.781 1.00 . A A . 12 THR HG1 1 1
14 2755 1 1 12 THR HG21 H -0.392 8.392 -3.910 1.00 . A A . 12 THR HG21 1 1
14 2756 1 1 12 THR HG22 H 0.899 7.509 -4.764 1.00 . A A . 12 THR HG22 1 1
14 2757 1 1 12 THR HG23 H -0.750 6.839 -4.691 1.00 . A A . 12 THR HG23 1 1
14 2758 1 1 12 THR N N 1.818 6.549 -0.732 1.00 . A A . 12 THR N 1 1
14 2759 1 1 12 THR O O 1.988 9.680 -1.648 1.00 . A A . 12 THR O 1 1
14 2760 1 1 12 THR OG1 O 0.805 5.339 -3.195 1.00 . A A . 12 THR OG1 1 1
14 2761 1 1 13 THR C C -1.188 10.214 0.920 1.00 . A A . 13 THR C 1 1
14 2762 1 1 13 THR CA C -0.482 10.411 -0.454 1.00 . A A . 13 THR CA 1 1
14 2763 1 1 13 THR CB C -1.375 11.121 -1.520 1.00 . A A . 13 THR CB 1 1
14 2764 1 1 13 THR CG2 C -1.804 12.548 -1.135 1.00 . A A . 13 THR CG2 1 1
14 2765 1 1 13 THR H H -0.720 8.268 -0.912 1.00 . A A . 13 THR H 1 1
14 2766 1 1 13 THR HA H 0.413 11.052 -0.310 1.00 . A A . 13 THR HA 1 1
14 2767 1 1 13 THR HB H -2.289 10.520 -1.693 1.00 . A A . 13 THR HB 1 1
14 2768 1 1 13 THR HG1 H -1.255 11.717 -3.347 1.00 . A A . 13 THR HG1 1 1
14 2769 1 1 13 THR HG21 H -2.410 12.559 -0.211 1.00 . A A . 13 THR HG21 1 1
14 2770 1 1 13 THR HG22 H -0.930 13.206 -0.967 1.00 . A A . 13 THR HG22 1 1
14 2771 1 1 13 THR HG23 H -2.418 13.013 -1.928 1.00 . A A . 13 THR HG23 1 1
14 2772 1 1 13 THR N N -0.068 9.059 -0.925 1.00 . A A . 13 THR N 1 1
14 2773 1 1 13 THR O O -2.346 9.783 0.981 1.00 . A A . 13 THR O 1 1
14 2774 1 1 13 THR OG1 O -0.676 11.229 -2.758 1.00 . A A . 13 THR OG1 1 1
14 2775 1 1 14 ALA C C -0.189 11.339 4.316 1.00 . A A . 14 ALA C 1 1
14 2776 1 1 14 ALA CA C -1.000 10.400 3.398 1.00 . A A . 14 ALA CA 1 1
14 2777 1 1 14 ALA CB C -0.937 8.940 3.895 1.00 . A A . 14 ALA CB 1 1
14 2778 1 1 14 ALA H H 0.485 10.842 1.833 1.00 . A A . 14 ALA H 1 1
14 2779 1 1 14 ALA HXT H -0.414 12.981 5.316 1.00 . A A . 14 ALA HXT 1 1
14 2780 1 1 14 ALA HA H -2.060 10.720 3.419 1.00 . A A . 14 ALA HA 1 1
14 2781 1 1 14 ALA HB1 H -1.544 8.272 3.257 1.00 . A A . 14 ALA HB1 1 1
14 2782 1 1 14 ALA HB2 H 0.093 8.539 3.900 1.00 . A A . 14 ALA HB2 1 1
14 2783 1 1 14 ALA HB3 H -1.332 8.843 4.923 1.00 . A A . 14 ALA HB3 1 1
14 2784 1 1 14 ALA N N -0.474 10.528 2.017 1.00 . A A . 14 ALA N 1 1
14 2785 1 1 14 ALA O O 0.990 11.157 4.624 1.00 . A A . 14 ALA O 1 1
14 2786 1 1 14 ALA OXT O -0.932 12.407 4.749 1.00 . A A . 14 ALA OXT 1 1
15 2787 1 1 1 ACE C C 5.364 9.308 3.475 1.00 . A A . 1 ACE C 1 1
15 2788 1 1 1 ACE CH3 C 5.070 10.803 3.477 1.00 . A A . 1 ACE CH3 1 1
15 2789 1 1 1 ACE H1 H 5.704 11.342 2.750 1.00 . A A . 1 ACE H1 1 1
15 2790 1 1 1 ACE H2 H 4.015 11.000 3.205 1.00 . A A . 1 ACE H2 1 1
15 2791 1 1 1 ACE H3 H 5.237 11.249 4.476 1.00 . A A . 1 ACE H3 1 1
15 2792 1 1 1 ACE O O 4.488 8.503 3.153 1.00 . A A . 1 ACE O 1 1
15 2793 1 1 2 ILE C C 7.264 7.231 5.410 1.00 . A A . 2 ILE C 1 1
15 2794 1 1 2 ILE CA C 7.073 7.543 3.897 1.00 . A A . 2 ILE CA 1 1
15 2795 1 1 2 ILE CB C 8.353 7.273 3.022 1.00 . A A . 2 ILE CB 1 1
15 2796 1 1 2 ILE CD1 C 7.161 7.083 0.657 1.00 . A A . 2 ILE CD1 1 1
15 2797 1 1 2 ILE CG1 C 8.274 7.704 1.522 1.00 . A A . 2 ILE CG1 1 1
15 2798 1 1 2 ILE CG2 C 8.825 5.796 3.105 1.00 . A A . 2 ILE CG2 1 1
15 2799 1 1 2 ILE H H 7.143 9.733 4.260 1.00 . A A . 2 ILE H 1 1
15 2800 1 1 2 ILE HA H 6.281 6.877 3.503 1.00 . A A . 2 ILE HA 1 1
15 2801 1 1 2 ILE HB H 9.173 7.877 3.459 1.00 . A A . 2 ILE HB 1 1
15 2802 1 1 2 ILE HD11 H 6.156 7.364 1.020 1.00 . A A . 2 ILE HD11 1 1
15 2803 1 1 2 ILE HD12 H 7.231 7.429 -0.390 1.00 . A A . 2 ILE HD12 1 1
15 2804 1 1 2 ILE HD13 H 7.216 5.979 0.636 1.00 . A A . 2 ILE HD13 1 1
15 2805 1 1 2 ILE HG12 H 8.177 8.804 1.465 1.00 . A A . 2 ILE HG12 1 1
15 2806 1 1 2 ILE HG13 H 9.245 7.499 1.030 1.00 . A A . 2 ILE HG13 1 1
15 2807 1 1 2 ILE HG21 H 9.738 5.619 2.508 1.00 . A A . 2 ILE HG21 1 1
15 2808 1 1 2 ILE HG22 H 9.070 5.498 4.141 1.00 . A A . 2 ILE HG22 1 1
15 2809 1 1 2 ILE HG23 H 8.052 5.092 2.742 1.00 . A A . 2 ILE HG23 1 1
15 2810 1 1 2 ILE N N 6.608 8.963 3.838 1.00 . A A . 2 ILE N 1 1
15 2811 1 1 2 ILE O O 8.148 7.792 6.065 1.00 . A A . 2 ILE O 1 1
15 2812 1 1 3 TRP C C 6.789 4.432 7.707 1.00 . A A . 3 TRP C 1 1
15 2813 1 1 3 TRP CA C 6.462 5.929 7.389 1.00 . A A . 3 TRP CA 1 1
15 2814 1 1 3 TRP CB C 5.074 6.322 7.988 1.00 . A A . 3 TRP CB 1 1
15 2815 1 1 3 TRP CD1 C 5.311 8.911 8.255 1.00 . A A . 3 TRP CD1 1 1
15 2816 1 1 3 TRP CD2 C 3.600 8.261 6.996 1.00 . A A . 3 TRP CD2 1 1
15 2817 1 1 3 TRP CE2 C 3.650 9.677 7.036 1.00 . A A . 3 TRP CE2 1 1
15 2818 1 1 3 TRP CE3 C 2.690 7.596 6.132 1.00 . A A . 3 TRP CE3 1 1
15 2819 1 1 3 TRP CG C 4.620 7.778 7.795 1.00 . A A . 3 TRP CG 1 1
15 2820 1 1 3 TRP CH2 C 1.850 9.770 5.428 1.00 . A A . 3 TRP CH2 1 1
15 2821 1 1 3 TRP CZ2 C 2.757 10.440 6.249 1.00 . A A . 3 TRP CZ2 1 1
15 2822 1 1 3 TRP CZ3 C 1.827 8.371 5.358 1.00 . A A . 3 TRP CZ3 1 1
15 2823 1 1 3 TRP H H 5.696 5.986 5.307 1.00 . A A . 3 TRP H 1 1
15 2824 1 1 3 TRP HA H 7.226 6.517 7.934 1.00 . A A . 3 TRP HA 1 1
15 2825 1 1 3 TRP HB2 H 4.296 5.639 7.593 1.00 . A A . 3 TRP HB2 1 1
15 2826 1 1 3 TRP HB3 H 5.077 6.124 9.077 1.00 . A A . 3 TRP HB3 1 1
15 2827 1 1 3 TRP HD1 H 6.277 8.845 8.732 1.00 . A A . 3 TRP HD1 1 1
15 2828 1 1 3 TRP HE1 H 5.044 11.067 7.953 1.00 . A A . 3 TRP HE1 1 1
15 2829 1 1 3 TRP HE3 H 2.689 6.518 6.046 1.00 . A A . 3 TRP HE3 1 1
15 2830 1 1 3 TRP HH2 H 1.162 10.346 4.831 1.00 . A A . 3 TRP HH2 1 1
15 2831 1 1 3 TRP HZ2 H 2.791 11.519 6.261 1.00 . A A . 3 TRP HZ2 1 1
15 2832 1 1 3 TRP HZ3 H 1.132 7.884 4.688 1.00 . A A . 3 TRP HZ3 1 1
15 2833 1 1 3 TRP N N 6.440 6.308 5.938 1.00 . A A . 3 TRP N 1 1
15 2834 1 1 3 TRP NE1 N 4.707 10.106 7.824 1.00 . A A . 3 TRP NE1 1 1
15 2835 1 1 3 TRP O O 6.453 3.950 8.796 1.00 . A A . 3 TRP O 1 1
15 2836 1 1 4 GLY C C 6.562 1.327 7.036 1.00 . A A . 4 GLY C 1 1
15 2837 1 1 4 GLY CA C 7.800 2.260 7.010 1.00 . A A . 4 GLY CA 1 1
15 2838 1 1 4 GLY H H 7.729 4.228 5.967 1.00 . A A . 4 GLY H 1 1
15 2839 1 1 4 GLY HA2 H 8.483 1.930 6.204 1.00 . A A . 4 GLY HA2 1 1
15 2840 1 1 4 GLY HA3 H 8.379 2.135 7.945 1.00 . A A . 4 GLY HA3 1 1
15 2841 1 1 4 GLY N N 7.478 3.701 6.810 1.00 . A A . 4 GLY N 1 1
15 2842 1 1 4 GLY O O 6.367 0.582 7.999 1.00 . A A . 4 GLY O 1 1
15 2843 1 1 5 . C C 3.405 1.445 5.125 1.00 . A A . 5 SET C 1 1
15 2844 1 1 5 . CA C 4.499 0.586 5.834 1.00 . A A . 5 SET CA 1 1
15 2845 1 1 5 . CB C 4.754 -0.806 5.178 1.00 . A A . 5 SET CB 1 1
15 2846 1 1 5 . H H 6.020 2.072 5.262 1.00 . A A . 5 SET H 1 1
15 2847 1 1 5 . HA H 4.096 0.438 6.857 1.00 . A A . 5 SET HA 1 1
15 2848 1 1 5 . HB2 H 2.460 0.868 5.126 1.00 . A A . 5 SET HB2 1 1
15 2849 1 1 5 . HB3 H 3.167 2.326 5.755 1.00 . A A . 5 SET HB3 1 1
15 2850 1 1 5 . HNT2 H 3.295 1.288 2.964 1.00 . A A . 5 SET HNT2 1 1
15 2851 1 1 5 . N N 5.751 1.376 5.966 1.00 . A A . 5 SET N 1 1
15 2852 1 1 5 . NT N 3.651 1.881 3.723 1.00 . A A . 5 SET NT 1 1
15 2853 1 1 5 . OG O 5.360 -0.897 4.106 1.00 . A A . 5 SET OG 1 1
15 2854 1 1 6 SER C C 3.067 -4.006 5.500 1.00 . A A . 6 SER C 1 1
15 2855 1 1 6 SER CA C 4.440 -3.283 5.368 1.00 . A A . 6 SER CA 1 1
15 2856 1 1 6 SER CB C 5.546 -3.981 6.192 1.00 . A A . 6 SER CB 1 1
15 2857 1 1 6 SER H H 3.790 -1.679 6.717 1.00 . A A . 6 SER H 1 1
15 2858 1 1 6 SER HA H 4.764 -3.289 4.307 1.00 . A A . 6 SER HA 1 1
15 2859 1 1 6 SER HB2 H 6.490 -3.404 6.136 1.00 . A A . 6 SER HB2 1 1
15 2860 1 1 6 SER HB3 H 5.282 -4.028 7.266 1.00 . A A . 6 SER HB3 1 1
15 2861 1 1 6 SER HG H 4.997 -5.803 5.876 1.00 . A A . 6 SER HG 1 1
15 2862 1 1 6 SER N N 4.287 -1.881 5.843 1.00 . A A . 6 SER N 1 1
15 2863 1 1 6 SER O O 2.414 -3.937 6.548 1.00 . A A . 6 SER O 1 1
15 2864 1 1 6 SER OG O 5.794 -5.295 5.705 1.00 . A A . 6 SER OG 1 1
15 2865 1 1 7 GLY C C 0.267 -4.560 3.746 1.00 . A A . 7 GLY C 1 1
15 2866 1 1 7 GLY CA C 1.338 -5.434 4.425 1.00 . A A . 7 GLY CA 1 1
15 2867 1 1 7 GLY H H 3.268 -4.718 3.625 1.00 . A A . 7 GLY H 1 1
15 2868 1 1 7 GLY HA2 H 1.452 -6.375 3.856 1.00 . A A . 7 GLY HA2 1 1
15 2869 1 1 7 GLY HA3 H 1.017 -5.748 5.438 1.00 . A A . 7 GLY HA3 1 1
15 2870 1 1 7 GLY N N 2.644 -4.721 4.439 1.00 . A A . 7 GLY N 1 1
15 2871 1 1 7 GLY O O -0.046 -4.763 2.570 1.00 . A A . 7 GLY O 1 1
15 2872 1 1 8 LYS C C -0.435 -1.393 3.549 1.00 . A A . 8 LYS C 1 1
15 2873 1 1 8 LYS CA C -1.284 -2.625 3.991 1.00 . A A . 8 LYS CA 1 1
15 2874 1 1 8 LYS CB C -2.337 -2.312 5.094 1.00 . A A . 8 LYS CB 1 1
15 2875 1 1 8 LYS CD C -3.764 -0.499 3.780 1.00 . A A . 8 LYS CD 1 1
15 2876 1 1 8 LYS CE C -3.754 -0.769 2.262 1.00 . A A . 8 LYS CE 1 1
15 2877 1 1 8 LYS CG C -3.719 -1.787 4.636 1.00 . A A . 8 LYS CG 1 1
15 2878 1 1 8 LYS H H 0.165 -3.443 5.409 1.00 . A A . 8 LYS H 1 1
15 2879 1 1 8 LYS HA H -1.824 -3.065 3.129 1.00 . A A . 8 LYS HA 1 1
15 2880 1 1 8 LYS HB2 H -2.544 -3.235 5.673 1.00 . A A . 8 LYS HB2 1 1
15 2881 1 1 8 LYS HB3 H -1.910 -1.619 5.846 1.00 . A A . 8 LYS HB3 1 1
15 2882 1 1 8 LYS HD2 H -4.691 0.049 4.036 1.00 . A A . 8 LYS HD2 1 1
15 2883 1 1 8 LYS HD3 H -2.940 0.182 4.070 1.00 . A A . 8 LYS HD3 1 1
15 2884 1 1 8 LYS HE2 H -2.835 -1.306 1.964 1.00 . A A . 8 LYS HE2 1 1
15 2885 1 1 8 LYS HE3 H -4.588 -1.447 1.994 1.00 . A A . 8 LYS HE3 1 1
15 2886 1 1 8 LYS HG2 H -4.276 -2.602 4.133 1.00 . A A . 8 LYS HG2 1 1
15 2887 1 1 8 LYS HG3 H -4.307 -1.598 5.555 1.00 . A A . 8 LYS HG3 1 1
15 2888 1 1 8 LYS HZ1 H -3.925 0.301 0.473 1.00 . A A . 8 LYS HZ1 1 1
15 2889 1 1 8 LYS HZ2 H -4.688 1.028 1.744 1.00 . A A . 8 LYS HZ2 1 1
15 2890 1 1 8 LYS HZ3 H -3.041 1.084 1.619 1.00 . A A . 8 LYS HZ3 1 1
15 2891 1 1 8 LYS N N -0.284 -3.591 4.504 1.00 . A A . 8 LYS N 1 1
15 2892 1 1 8 LYS NZ N -3.860 0.480 1.482 1.00 . A A . 8 LYS NZ 1 1
15 2893 1 1 8 LYS O O -0.123 -0.499 4.344 1.00 . A A . 8 LYS O 1 1
15 2894 1 1 9 LEU C C 0.013 1.007 1.434 1.00 . A A . 9 LEU C 1 1
15 2895 1 1 9 LEU CA C 0.796 -0.318 1.669 1.00 . A A . 9 LEU CA 1 1
15 2896 1 1 9 LEU CB C 1.464 -0.828 0.356 1.00 . A A . 9 LEU CB 1 1
15 2897 1 1 9 LEU CD1 C 2.946 -2.501 -0.866 1.00 . A A . 9 LEU CD1 1 1
15 2898 1 1 9 LEU CD2 C 3.899 -1.243 1.095 1.00 . A A . 9 LEU CD2 1 1
15 2899 1 1 9 LEU CG C 2.620 -1.863 0.498 1.00 . A A . 9 LEU CG 1 1
15 2900 1 1 9 LEU H H -0.336 -2.229 1.751 1.00 . A A . 9 LEU H 1 1
15 2901 1 1 9 LEU HA H 1.625 -0.117 2.378 1.00 . A A . 9 LEU HA 1 1
15 2902 1 1 9 LEU HB2 H 0.673 -1.239 -0.303 1.00 . A A . 9 LEU HB2 1 1
15 2903 1 1 9 LEU HB3 H 1.858 0.037 -0.215 1.00 . A A . 9 LEU HB3 1 1
15 2904 1 1 9 LEU HD11 H 3.740 -3.266 -0.780 1.00 . A A . 9 LEU HD11 1 1
15 2905 1 1 9 LEU HD12 H 2.064 -3.011 -1.297 1.00 . A A . 9 LEU HD12 1 1
15 2906 1 1 9 LEU HD13 H 3.287 -1.754 -1.606 1.00 . A A . 9 LEU HD13 1 1
15 2907 1 1 9 LEU HD21 H 3.725 -0.839 2.107 1.00 . A A . 9 LEU HD21 1 1
15 2908 1 1 9 LEU HD22 H 4.709 -1.990 1.195 1.00 . A A . 9 LEU HD22 1 1
15 2909 1 1 9 LEU HD23 H 4.291 -0.414 0.476 1.00 . A A . 9 LEU HD23 1 1
15 2910 1 1 9 LEU HG H 2.302 -2.682 1.170 1.00 . A A . 9 LEU HG 1 1
15 2911 1 1 9 LEU N N -0.052 -1.385 2.260 1.00 . A A . 9 LEU N 1 1
15 2912 1 1 9 LEU O O -0.804 1.120 0.514 1.00 . A A . 9 LEU O 1 1
15 2913 1 1 10 ILE C C 0.779 4.374 2.629 1.00 . A A . 10 ILE C 1 1
15 2914 1 1 10 ILE CA C -0.335 3.346 2.243 1.00 . A A . 10 ILE CA 1 1
15 2915 1 1 10 ILE CB C -1.690 3.411 3.041 1.00 . A A . 10 ILE CB 1 1
15 2916 1 1 10 ILE CD1 C -3.011 4.917 1.382 1.00 . A A . 10 ILE CD1 1 1
15 2917 1 1 10 ILE CG1 C -2.486 4.727 2.813 1.00 . A A . 10 ILE CG1 1 1
15 2918 1 1 10 ILE CG2 C -1.587 3.114 4.561 1.00 . A A . 10 ILE CG2 1 1
15 2919 1 1 10 ILE H H 0.887 1.729 3.084 1.00 . A A . 10 ILE H 1 1
15 2920 1 1 10 ILE HA H -0.586 3.555 1.185 1.00 . A A . 10 ILE HA 1 1
15 2921 1 1 10 ILE HB H -2.327 2.601 2.641 1.00 . A A . 10 ILE HB 1 1
15 2922 1 1 10 ILE HD11 H -3.643 5.820 1.310 1.00 . A A . 10 ILE HD11 1 1
15 2923 1 1 10 ILE HD12 H -2.189 5.038 0.652 1.00 . A A . 10 ILE HD12 1 1
15 2924 1 1 10 ILE HD13 H -3.623 4.056 1.056 1.00 . A A . 10 ILE HD13 1 1
15 2925 1 1 10 ILE HG12 H -3.361 4.760 3.491 1.00 . A A . 10 ILE HG12 1 1
15 2926 1 1 10 ILE HG13 H -1.872 5.604 3.097 1.00 . A A . 10 ILE HG13 1 1
15 2927 1 1 10 ILE HG21 H -1.080 2.152 4.757 1.00 . A A . 10 ILE HG21 1 1
15 2928 1 1 10 ILE HG22 H -1.029 3.894 5.109 1.00 . A A . 10 ILE HG22 1 1
15 2929 1 1 10 ILE HG23 H -2.585 3.042 5.031 1.00 . A A . 10 ILE HG23 1 1
15 2930 1 1 10 ILE N N 0.278 1.993 2.306 1.00 . A A . 10 ILE N 1 1
15 2931 1 1 10 ILE O O 0.777 4.947 3.723 1.00 . A A . 10 ILE O 1 1
15 2932 1 1 11 GLU C C 2.612 6.908 1.188 1.00 . A A . 11 GLU C 1 1
15 2933 1 1 11 GLU CA C 2.870 5.545 1.929 1.00 . A A . 11 GLU CA 1 1
15 2934 1 1 11 GLU CB C 4.216 4.866 1.514 1.00 . A A . 11 GLU CB 1 1
15 2935 1 1 11 GLU CD C 4.311 3.029 3.421 1.00 . A A . 11 GLU CD 1 1
15 2936 1 1 11 GLU CG C 4.550 3.408 1.936 1.00 . A A . 11 GLU CG 1 1
15 2937 1 1 11 GLU H H 1.644 4.060 0.839 1.00 . A A . 11 GLU H 1 1
15 2938 1 1 11 GLU HA H 3.001 5.753 3.013 1.00 . A A . 11 GLU HA 1 1
15 2939 1 1 11 GLU HB2 H 4.322 4.910 0.413 1.00 . A A . 11 GLU HB2 1 1
15 2940 1 1 11 GLU HB3 H 5.030 5.511 1.891 1.00 . A A . 11 GLU HB3 1 1
15 2941 1 1 11 GLU HG2 H 4.028 2.724 1.244 1.00 . A A . 11 GLU HG2 1 1
15 2942 1 1 11 GLU HG3 H 5.626 3.259 1.701 1.00 . A A . 11 GLU HG3 1 1
15 2943 1 1 11 GLU N N 1.734 4.607 1.703 1.00 . A A . 11 GLU N 1 1
15 2944 1 1 11 GLU O O 3.401 7.315 0.329 1.00 . A A . 11 GLU O 1 1
15 2945 1 1 11 GLU OE1 O 4.755 3.783 4.294 1.00 . A A . 11 GLU OE1 1 1
15 2946 1 1 12 THR C C 0.386 9.789 1.914 1.00 . A A . 12 THR C 1 1
15 2947 1 1 12 THR CA C 1.137 8.915 0.864 1.00 . A A . 12 THR CA 1 1
15 2948 1 1 12 THR CB C 0.379 8.709 -0.491 1.00 . A A . 12 THR CB 1 1
15 2949 1 1 12 THR CG2 C -0.024 10.009 -1.208 1.00 . A A . 12 THR CG2 1 1
15 2950 1 1 12 THR H H 0.902 7.189 2.219 1.00 . A A . 12 THR H 1 1
15 2951 1 1 12 THR HA H 2.071 9.464 0.627 1.00 . A A . 12 THR HA 1 1
15 2952 1 1 12 THR HB H -0.538 8.116 -0.309 1.00 . A A . 12 THR HB 1 1
15 2953 1 1 12 THR HG1 H 1.764 7.426 -0.870 1.00 . A A . 12 THR HG1 1 1
15 2954 1 1 12 THR HG21 H -0.727 10.614 -0.607 1.00 . A A . 12 THR HG21 1 1
15 2955 1 1 12 THR HG22 H 0.854 10.644 -1.429 1.00 . A A . 12 THR HG22 1 1
15 2956 1 1 12 THR HG23 H -0.525 9.798 -2.171 1.00 . A A . 12 THR HG23 1 1
15 2957 1 1 12 THR N N 1.503 7.616 1.507 1.00 . A A . 12 THR N 1 1
15 2958 1 1 12 THR O O 0.962 10.779 2.375 1.00 . A A . 12 THR O 1 1
15 2959 1 1 12 THR OG1 O 1.194 7.985 -1.407 1.00 . A A . 12 THR OG1 1 1
15 2960 1 1 13 THR C C -2.248 9.184 4.285 1.00 . A A . 13 THR C 1 1
15 2961 1 1 13 THR CA C -1.674 10.221 3.272 1.00 . A A . 13 THR CA 1 1
15 2962 1 1 13 THR CB C -2.765 11.087 2.567 1.00 . A A . 13 THR CB 1 1
15 2963 1 1 13 THR CG2 C -3.570 11.982 3.527 1.00 . A A . 13 THR CG2 1 1
15 2964 1 1 13 THR H H -1.305 8.710 1.714 1.00 . A A . 13 THR H 1 1
15 2965 1 1 13 THR HA H -1.019 10.929 3.821 1.00 . A A . 13 THR HA 1 1
15 2966 1 1 13 THR HB H -3.476 10.427 2.035 1.00 . A A . 13 THR HB 1 1
15 2967 1 1 13 THR HG1 H -1.561 12.516 2.097 1.00 . A A . 13 THR HG1 1 1
15 2968 1 1 13 THR HG21 H -4.131 11.387 4.271 1.00 . A A . 13 THR HG21 1 1
15 2969 1 1 13 THR HG22 H -2.919 12.681 4.084 1.00 . A A . 13 THR HG22 1 1
15 2970 1 1 13 THR HG23 H -4.312 12.591 2.979 1.00 . A A . 13 THR HG23 1 1
15 2971 1 1 13 THR N N -0.876 9.455 2.273 1.00 . A A . 13 THR N 1 1
15 2972 1 1 13 THR O O -3.228 8.490 3.996 1.00 . A A . 13 THR O 1 1
15 2973 1 1 13 THR OG1 O -2.166 11.955 1.608 1.00 . A A . 13 THR OG1 1 1
15 2974 1 1 14 ALA C C -1.466 8.684 7.883 1.00 . A A . 14 ALA C 1 1
15 2975 1 1 14 ALA CA C -2.026 8.155 6.546 1.00 . A A . 14 ALA CA 1 1
15 2976 1 1 14 ALA CB C -1.547 6.713 6.279 1.00 . A A . 14 ALA CB 1 1
15 2977 1 1 14 ALA H H -0.795 9.697 5.571 1.00 . A A . 14 ALA H 1 1
15 2978 1 1 14 ALA HXT H -2.094 9.410 9.565 1.00 . A A . 14 ALA HXT 1 1
15 2979 1 1 14 ALA HA H -3.133 8.139 6.610 1.00 . A A . 14 ALA HA 1 1
15 2980 1 1 14 ALA HB1 H -1.973 6.314 5.342 1.00 . A A . 14 ALA HB1 1 1
15 2981 1 1 14 ALA HB2 H -0.448 6.639 6.196 1.00 . A A . 14 ALA HB2 1 1
15 2982 1 1 14 ALA HB3 H -1.861 6.024 7.085 1.00 . A A . 14 ALA HB3 1 1
15 2983 1 1 14 ALA N N -1.613 9.086 5.467 1.00 . A A . 14 ALA N 1 1
15 2984 1 1 14 ALA O O -0.266 8.746 8.153 1.00 . A A . 14 ALA O 1 1
15 2985 1 1 14 ALA OXT O -2.459 9.083 8.739 1.00 . A A . 14 ALA OXT 1 1
16 2986 1 1 1 ACE C C 5.495 8.949 1.539 1.00 . A A . 1 ACE C 1 1
16 2987 1 1 1 ACE CH3 C 5.310 10.380 1.048 1.00 . A A . 1 ACE CH3 1 1
16 2988 1 1 1 ACE H1 H 6.094 10.660 0.321 1.00 . A A . 1 ACE H1 1 1
16 2989 1 1 1 ACE H2 H 4.333 10.502 0.544 1.00 . A A . 1 ACE H2 1 1
16 2990 1 1 1 ACE H3 H 5.341 11.107 1.882 1.00 . A A . 1 ACE H3 1 1
16 2991 1 1 1 ACE O O 4.672 8.080 1.247 1.00 . A A . 1 ACE O 1 1
16 2992 1 1 2 ILE C C 6.819 7.530 4.392 1.00 . A A . 2 ILE C 1 1
16 2993 1 1 2 ILE CA C 6.942 7.393 2.847 1.00 . A A . 2 ILE CA 1 1
16 2994 1 1 2 ILE CB C 8.344 6.876 2.354 1.00 . A A . 2 ILE CB 1 1
16 2995 1 1 2 ILE CD1 C 7.547 5.898 0.025 1.00 . A A . 2 ILE CD1 1 1
16 2996 1 1 2 ILE CG1 C 8.531 6.790 0.805 1.00 . A A . 2 ILE CG1 1 1
16 2997 1 1 2 ILE CG2 C 8.751 5.520 2.993 1.00 . A A . 2 ILE CG2 1 1
16 2998 1 1 2 ILE H H 7.090 9.587 2.549 1.00 . A A . 2 ILE H 1 1
16 2999 1 1 2 ILE HA H 6.195 6.651 2.514 1.00 . A A . 2 ILE HA 1 1
16 3000 1 1 2 ILE HB H 9.097 7.608 2.705 1.00 . A A . 2 ILE HB 1 1
16 3001 1 1 2 ILE HD11 H 6.505 6.249 0.128 1.00 . A A . 2 ILE HD11 1 1
16 3002 1 1 2 ILE HD12 H 7.781 5.900 -1.056 1.00 . A A . 2 ILE HD12 1 1
16 3003 1 1 2 ILE HD13 H 7.583 4.847 0.362 1.00 . A A . 2 ILE HD13 1 1
16 3004 1 1 2 ILE HG12 H 8.483 7.807 0.377 1.00 . A A . 2 ILE HG12 1 1
16 3005 1 1 2 ILE HG13 H 9.560 6.453 0.575 1.00 . A A . 2 ILE HG13 1 1
16 3006 1 1 2 ILE HG21 H 9.751 5.188 2.656 1.00 . A A . 2 ILE HG21 1 1
16 3007 1 1 2 ILE HG22 H 8.803 5.584 4.097 1.00 . A A . 2 ILE HG22 1 1
16 3008 1 1 2 ILE HG23 H 8.038 4.713 2.749 1.00 . A A . 2 ILE HG23 1 1
16 3009 1 1 2 ILE N N 6.591 8.732 2.281 1.00 . A A . 2 ILE N 1 1
16 3010 1 1 2 ILE O O 7.583 8.273 5.021 1.00 . A A . 2 ILE O 1 1
16 3011 1 1 3 TRP C C 5.709 5.468 7.231 1.00 . A A . 3 TRP C 1 1
16 3012 1 1 3 TRP CA C 5.607 6.830 6.463 1.00 . A A . 3 TRP CA 1 1
16 3013 1 1 3 TRP CB C 4.197 7.474 6.663 1.00 . A A . 3 TRP CB 1 1
16 3014 1 1 3 TRP CD1 C 4.689 10.015 6.269 1.00 . A A . 3 TRP CD1 1 1
16 3015 1 1 3 TRP CD2 C 3.162 9.140 4.916 1.00 . A A . 3 TRP CD2 1 1
16 3016 1 1 3 TRP CE2 C 3.367 10.502 4.582 1.00 . A A . 3 TRP CE2 1 1
16 3017 1 1 3 TRP CE3 C 2.349 8.313 4.101 1.00 . A A . 3 TRP CE3 1 1
16 3018 1 1 3 TRP CG C 3.960 8.843 6.003 1.00 . A A . 3 TRP CG 1 1
16 3019 1 1 3 TRP CH2 C 1.899 10.237 2.678 1.00 . A A . 3 TRP CH2 1 1
16 3020 1 1 3 TRP CZ2 C 2.721 11.058 3.453 1.00 . A A . 3 TRP CZ2 1 1
16 3021 1 1 3 TRP CZ3 C 1.727 8.882 2.988 1.00 . A A . 3 TRP CZ3 1 1
16 3022 1 1 3 TRP H H 5.240 6.297 4.341 1.00 . A A . 3 TRP H 1 1
16 3023 1 1 3 TRP HA H 6.338 7.494 6.966 1.00 . A A . 3 TRP HA 1 1
16 3024 1 1 3 TRP HB2 H 3.419 6.763 6.327 1.00 . A A . 3 TRP HB2 1 1
16 3025 1 1 3 TRP HB3 H 4.003 7.595 7.745 1.00 . A A . 3 TRP HB3 1 1
16 3026 1 1 3 TRP HD1 H 5.547 10.025 6.924 1.00 . A A . 3 TRP HD1 1 1
16 3027 1 1 3 TRP HE1 H 4.736 12.003 5.346 1.00 . A A . 3 TRP HE1 1 1
16 3028 1 1 3 TRP HE3 H 2.246 7.260 4.317 1.00 . A A . 3 TRP HE3 1 1
16 3029 1 1 3 TRP HH2 H 1.409 10.655 1.814 1.00 . A A . 3 TRP HH2 1 1
16 3030 1 1 3 TRP HZ2 H 2.879 12.091 3.177 1.00 . A A . 3 TRP HZ2 1 1
16 3031 1 1 3 TRP HZ3 H 1.108 8.264 2.355 1.00 . A A . 3 TRP HZ3 1 1
16 3032 1 1 3 TRP N N 5.875 6.778 4.988 1.00 . A A . 3 TRP N 1 1
16 3033 1 1 3 TRP NE1 N 4.313 11.071 5.418 1.00 . A A . 3 TRP NE1 1 1
16 3034 1 1 3 TRP O O 5.119 5.329 8.308 1.00 . A A . 3 TRP O 1 1
16 3035 1 1 4 GLY C C 5.378 2.274 7.130 1.00 . A A . 4 GLY C 1 1
16 3036 1 1 4 GLY CA C 6.621 3.152 7.382 1.00 . A A . 4 GLY CA 1 1
16 3037 1 1 4 GLY H H 6.940 4.735 5.850 1.00 . A A . 4 GLY H 1 1
16 3038 1 1 4 GLY HA2 H 7.538 2.658 7.009 1.00 . A A . 4 GLY HA2 1 1
16 3039 1 1 4 GLY HA3 H 6.781 3.266 8.471 1.00 . A A . 4 GLY HA3 1 1
16 3040 1 1 4 GLY N N 6.482 4.483 6.732 1.00 . A A . 4 GLY N 1 1
16 3041 1 1 4 GLY O O 4.431 2.314 7.921 1.00 . A A . 4 GLY O 1 1
16 3042 1 1 5 . C C 3.296 1.362 4.646 1.00 . A A . 5 SET C 1 1
16 3043 1 1 5 . CA C 4.244 0.626 5.645 1.00 . A A . 5 SET CA 1 1
16 3044 1 1 5 . CB C 4.720 -0.761 5.114 1.00 . A A . 5 SET CB 1 1
16 3045 1 1 5 . H H 6.236 1.573 5.458 1.00 . A A . 5 SET H 1 1
16 3046 1 1 5 . HA H 3.621 0.455 6.547 1.00 . A A . 5 SET HA 1 1
16 3047 1 1 5 . HB2 H 2.479 0.674 4.366 1.00 . A A . 5 SET HB2 1 1
16 3048 1 1 5 . HB3 H 2.767 2.170 5.191 1.00 . A A . 5 SET HB3 1 1
16 3049 1 1 5 . HNT2 H 4.142 1.276 2.609 1.00 . A A . 5 SET HNT2 1 1
16 3050 1 1 5 . N N 5.394 1.491 6.038 1.00 . A A . 5 SET N 1 1
16 3051 1 1 5 . NT N 3.909 1.894 3.395 1.00 . A A . 5 SET NT 1 1
16 3052 1 1 5 . OG O 5.577 -0.845 4.229 1.00 . A A . 5 SET OG 1 1
16 3053 1 1 6 SER C C 3.118 -4.049 5.423 1.00 . A A . 6 SER C 1 1
16 3054 1 1 6 SER CA C 4.446 -3.248 5.281 1.00 . A A . 6 SER CA 1 1
16 3055 1 1 6 SER CB C 5.576 -3.814 6.169 1.00 . A A . 6 SER CB 1 1
16 3056 1 1 6 SER H H 3.416 -1.651 6.367 1.00 . A A . 6 SER H 1 1
16 3057 1 1 6 SER HA H 4.796 -3.276 4.229 1.00 . A A . 6 SER HA 1 1
16 3058 1 1 6 SER HB2 H 6.471 -3.165 6.116 1.00 . A A . 6 SER HB2 1 1
16 3059 1 1 6 SER HB3 H 5.277 -3.837 7.235 1.00 . A A . 6 SER HB3 1 1
16 3060 1 1 6 SER HG H 6.637 -5.417 6.336 1.00 . A A . 6 SER HG 1 1
16 3061 1 1 6 SER N N 4.135 -1.844 5.663 1.00 . A A . 6 SER N 1 1
16 3062 1 1 6 SER O O 2.517 -4.078 6.505 1.00 . A A . 6 SER O 1 1
16 3063 1 1 6 SER OG O 5.938 -5.125 5.746 1.00 . A A . 6 SER OG 1 1
16 3064 1 1 7 GLY C C 0.268 -4.572 3.754 1.00 . A A . 7 GLY C 1 1
16 3065 1 1 7 GLY CA C 1.382 -5.462 4.340 1.00 . A A . 7 GLY CA 1 1
16 3066 1 1 7 GLY H H 3.250 -4.627 3.498 1.00 . A A . 7 GLY H 1 1
16 3067 1 1 7 GLY HA2 H 1.500 -6.366 3.713 1.00 . A A . 7 GLY HA2 1 1
16 3068 1 1 7 GLY HA3 H 1.112 -5.837 5.346 1.00 . A A . 7 GLY HA3 1 1
16 3069 1 1 7 GLY N N 2.664 -4.703 4.337 1.00 . A A . 7 GLY N 1 1
16 3070 1 1 7 GLY O O -0.112 -4.736 2.592 1.00 . A A . 7 GLY O 1 1
16 3071 1 1 8 LYS C C -0.403 -1.421 3.696 1.00 . A A . 8 LYS C 1 1
16 3072 1 1 8 LYS CA C -1.263 -2.641 4.154 1.00 . A A . 8 LYS CA 1 1
16 3073 1 1 8 LYS CB C -2.230 -2.348 5.336 1.00 . A A . 8 LYS CB 1 1
16 3074 1 1 8 LYS CD C -3.631 -0.349 4.298 1.00 . A A . 8 LYS CD 1 1
16 3075 1 1 8 LYS CE C -3.690 -0.442 2.760 1.00 . A A . 8 LYS CE 1 1
16 3076 1 1 8 LYS CG C -3.608 -1.727 4.998 1.00 . A A . 8 LYS CG 1 1
16 3077 1 1 8 LYS H H 0.253 -3.518 5.461 1.00 . A A . 8 LYS H 1 1
16 3078 1 1 8 LYS HA H -1.864 -3.043 3.313 1.00 . A A . 8 LYS HA 1 1
16 3079 1 1 8 LYS HB2 H -2.449 -3.296 5.866 1.00 . A A . 8 LYS HB2 1 1
16 3080 1 1 8 LYS HB3 H -1.725 -1.726 6.101 1.00 . A A . 8 LYS HB3 1 1
16 3081 1 1 8 LYS HD2 H -4.524 0.203 4.651 1.00 . A A . 8 LYS HD2 1 1
16 3082 1 1 8 LYS HD3 H -2.769 0.263 4.629 1.00 . A A . 8 LYS HD3 1 1
16 3083 1 1 8 LYS HE2 H -2.822 -0.999 2.366 1.00 . A A . 8 LYS HE2 1 1
16 3084 1 1 8 LYS HE3 H -4.576 -1.027 2.452 1.00 . A A . 8 LYS HE3 1 1
16 3085 1 1 8 LYS HG2 H -4.218 -2.459 4.433 1.00 . A A . 8 LYS HG2 1 1
16 3086 1 1 8 LYS HG3 H -4.150 -1.621 5.957 1.00 . A A . 8 LYS HG3 1 1
16 3087 1 1 8 LYS HZ1 H -3.806 0.844 1.112 1.00 . A A . 8 LYS HZ1 1 1
16 3088 1 1 8 LYS HZ2 H -4.530 1.451 2.466 1.00 . A A . 8 LYS HZ2 1 1
16 3089 1 1 8 LYS HZ3 H -2.885 1.439 2.339 1.00 . A A . 8 LYS HZ3 1 1
16 3090 1 1 8 LYS N N -0.242 -3.631 4.576 1.00 . A A . 8 LYS N 1 1
16 3091 1 1 8 LYS NZ N -3.732 0.897 2.135 1.00 . A A . 8 LYS NZ 1 1
16 3092 1 1 8 LYS O O -0.037 -0.547 4.491 1.00 . A A . 8 LYS O 1 1
16 3093 1 1 9 LEU C C 0.059 1.001 1.569 1.00 . A A . 9 LEU C 1 1
16 3094 1 1 9 LEU CA C 0.784 -0.358 1.785 1.00 . A A . 9 LEU CA 1 1
16 3095 1 1 9 LEU CB C 1.426 -0.884 0.465 1.00 . A A . 9 LEU CB 1 1
16 3096 1 1 9 LEU CD1 C 2.870 -2.543 -0.813 1.00 . A A . 9 LEU CD1 1 1
16 3097 1 1 9 LEU CD2 C 3.806 -1.497 1.278 1.00 . A A . 9 LEU CD2 1 1
16 3098 1 1 9 LEU CG C 2.521 -1.989 0.582 1.00 . A A . 9 LEU CG 1 1
16 3099 1 1 9 LEU H H -0.434 -2.213 1.875 1.00 . A A . 9 LEU H 1 1
16 3100 1 1 9 LEU HA H 1.635 -0.190 2.473 1.00 . A A . 9 LEU HA 1 1
16 3101 1 1 9 LEU HB2 H 0.616 -1.234 -0.204 1.00 . A A . 9 LEU HB2 1 1
16 3102 1 1 9 LEU HB3 H 1.874 -0.030 -0.082 1.00 . A A . 9 LEU HB3 1 1
16 3103 1 1 9 LEU HD11 H 3.614 -3.360 -0.754 1.00 . A A . 9 LEU HD11 1 1
16 3104 1 1 9 LEU HD12 H 1.982 -2.962 -1.320 1.00 . A A . 9 LEU HD12 1 1
16 3105 1 1 9 LEU HD13 H 3.289 -1.765 -1.479 1.00 . A A . 9 LEU HD13 1 1
16 3106 1 1 9 LEU HD21 H 3.619 -1.200 2.324 1.00 . A A . 9 LEU HD21 1 1
16 3107 1 1 9 LEU HD22 H 4.579 -2.288 1.319 1.00 . A A . 9 LEU HD22 1 1
16 3108 1 1 9 LEU HD23 H 4.255 -0.628 0.763 1.00 . A A . 9 LEU HD23 1 1
16 3109 1 1 9 LEU HG H 2.129 -2.837 1.173 1.00 . A A . 9 LEU HG 1 1
16 3110 1 1 9 LEU N N -0.077 -1.402 2.392 1.00 . A A . 9 LEU N 1 1
16 3111 1 1 9 LEU O O -0.758 1.159 0.656 1.00 . A A . 9 LEU O 1 1
16 3112 1 1 10 ILE C C 1.072 4.332 2.270 1.00 . A A . 10 ILE C 1 1
16 3113 1 1 10 ILE CA C -0.154 3.359 2.397 1.00 . A A . 10 ILE CA 1 1
16 3114 1 1 10 ILE CB C -1.167 3.614 3.574 1.00 . A A . 10 ILE CB 1 1
16 3115 1 1 10 ILE CD1 C -2.873 5.080 2.244 1.00 . A A . 10 ILE CD1 1 1
16 3116 1 1 10 ILE CG1 C -1.946 4.956 3.464 1.00 . A A . 10 ILE CG1 1 1
16 3117 1 1 10 ILE CG2 C -0.564 3.486 5.000 1.00 . A A . 10 ILE CG2 1 1
16 3118 1 1 10 ILE H H 1.007 1.665 3.200 1.00 . A A . 10 ILE H 1 1
16 3119 1 1 10 ILE HA H -0.729 3.489 1.460 1.00 . A A . 10 ILE HA 1 1
16 3120 1 1 10 ILE HB H -1.932 2.816 3.514 1.00 . A A . 10 ILE HB 1 1
16 3121 1 1 10 ILE HD11 H -3.468 6.010 2.291 1.00 . A A . 10 ILE HD11 1 1
16 3122 1 1 10 ILE HD12 H -2.308 5.111 1.294 1.00 . A A . 10 ILE HD12 1 1
16 3123 1 1 10 ILE HD13 H -3.586 4.238 2.184 1.00 . A A . 10 ILE HD13 1 1
16 3124 1 1 10 ILE HG12 H -2.574 5.097 4.365 1.00 . A A . 10 ILE HG12 1 1
16 3125 1 1 10 ILE HG13 H -1.244 5.811 3.473 1.00 . A A . 10 ILE HG13 1 1
16 3126 1 1 10 ILE HG21 H -0.064 2.512 5.150 1.00 . A A . 10 ILE HG21 1 1
16 3127 1 1 10 ILE HG22 H 0.183 4.271 5.215 1.00 . A A . 10 ILE HG22 1 1
16 3128 1 1 10 ILE HG23 H -1.343 3.558 5.782 1.00 . A A . 10 ILE HG23 1 1
16 3129 1 1 10 ILE N N 0.376 1.964 2.450 1.00 . A A . 10 ILE N 1 1
16 3130 1 1 10 ILE O O 1.315 5.185 3.128 1.00 . A A . 10 ILE O 1 1
16 3131 1 1 11 GLU C C 2.829 5.937 -0.361 1.00 . A A . 11 GLU C 1 1
16 3132 1 1 11 GLU CA C 3.053 5.004 0.880 1.00 . A A . 11 GLU CA 1 1
16 3133 1 1 11 GLU CB C 4.227 3.975 0.731 1.00 . A A . 11 GLU CB 1 1
16 3134 1 1 11 GLU CD C 4.277 3.185 3.272 1.00 . A A . 11 GLU CD 1 1
16 3135 1 1 11 GLU CG C 5.038 3.622 2.005 1.00 . A A . 11 GLU CG 1 1
16 3136 1 1 11 GLU H H 1.531 3.442 0.537 1.00 . A A . 11 GLU H 1 1
16 3137 1 1 11 GLU HA H 3.319 5.662 1.735 1.00 . A A . 11 GLU HA 1 1
16 3138 1 1 11 GLU HB2 H 3.888 3.041 0.240 1.00 . A A . 11 GLU HB2 1 1
16 3139 1 1 11 GLU HB3 H 4.972 4.370 0.018 1.00 . A A . 11 GLU HB3 1 1
16 3140 1 1 11 GLU HG2 H 5.805 2.866 1.749 1.00 . A A . 11 GLU HG2 1 1
16 3141 1 1 11 GLU HG3 H 5.639 4.510 2.274 1.00 . A A . 11 GLU HG3 1 1
16 3142 1 1 11 GLU N N 1.832 4.196 1.164 1.00 . A A . 11 GLU N 1 1
16 3143 1 1 11 GLU O O 3.598 5.901 -1.328 1.00 . A A . 11 GLU O 1 1
16 3144 1 1 11 GLU OE1 O 4.057 4.031 4.145 1.00 . A A . 11 GLU OE1 1 1
16 3145 1 1 12 THR C C 0.725 8.956 -0.791 1.00 . A A . 12 THR C 1 1
16 3146 1 1 12 THR CA C 1.443 7.734 -1.442 1.00 . A A . 12 THR CA 1 1
16 3147 1 1 12 THR CB C 0.673 7.045 -2.620 1.00 . A A . 12 THR CB 1 1
16 3148 1 1 12 THR CG2 C 0.298 7.988 -3.777 1.00 . A A . 12 THR CG2 1 1
16 3149 1 1 12 THR H H 1.171 6.705 0.487 1.00 . A A . 12 THR H 1 1
16 3150 1 1 12 THR HA H 2.391 8.126 -1.864 1.00 . A A . 12 THR HA 1 1
16 3151 1 1 12 THR HB H -0.256 6.588 -2.230 1.00 . A A . 12 THR HB 1 1
16 3152 1 1 12 THR HG1 H 2.063 5.718 -2.493 1.00 . A A . 12 THR HG1 1 1
16 3153 1 1 12 THR HG21 H -0.384 8.794 -3.451 1.00 . A A . 12 THR HG21 1 1
16 3154 1 1 12 THR HG22 H 1.191 8.467 -4.220 1.00 . A A . 12 THR HG22 1 1
16 3155 1 1 12 THR HG23 H -0.216 7.441 -4.589 1.00 . A A . 12 THR HG23 1 1
16 3156 1 1 12 THR N N 1.777 6.787 -0.337 1.00 . A A . 12 THR N 1 1
16 3157 1 1 12 THR O O 1.354 10.010 -0.654 1.00 . A A . 12 THR O 1 1
16 3158 1 1 12 THR OG1 O 1.467 6.009 -3.189 1.00 . A A . 12 THR OG1 1 1
16 3159 1 1 13 THR C C -2.152 9.267 1.401 1.00 . A A . 13 THR C 1 1
16 3160 1 1 13 THR CA C -1.347 9.920 0.237 1.00 . A A . 13 THR CA 1 1
16 3161 1 1 13 THR CB C -2.249 10.649 -0.808 1.00 . A A . 13 THR CB 1 1
16 3162 1 1 13 THR CG2 C -3.054 11.828 -0.233 1.00 . A A . 13 THR CG2 1 1
16 3163 1 1 13 THR H H -1.010 7.942 -0.666 1.00 . A A . 13 THR H 1 1
16 3164 1 1 13 THR HA H -0.658 10.684 0.655 1.00 . A A . 13 THR HA 1 1
16 3165 1 1 13 THR HB H -2.961 9.923 -1.247 1.00 . A A . 13 THR HB 1 1
16 3166 1 1 13 THR HG1 H -2.055 11.651 -2.442 1.00 . A A . 13 THR HG1 1 1
16 3167 1 1 13 THR HG21 H -3.752 11.502 0.559 1.00 . A A . 13 THR HG21 1 1
16 3168 1 1 13 THR HG22 H -2.393 12.600 0.205 1.00 . A A . 13 THR HG22 1 1
16 3169 1 1 13 THR HG23 H -3.662 12.320 -1.014 1.00 . A A . 13 THR HG23 1 1
16 3170 1 1 13 THR N N -0.564 8.826 -0.401 1.00 . A A . 13 THR N 1 1
16 3171 1 1 13 THR O O -3.110 8.523 1.160 1.00 . A A . 13 THR O 1 1
16 3172 1 1 13 THR OG1 O -1.451 11.180 -1.863 1.00 . A A . 13 THR OG1 1 1
16 3173 1 1 14 ALA C C -3.523 9.978 4.381 1.00 . A A . 14 ALA C 1 1
16 3174 1 1 14 ALA CA C -2.430 9.016 3.864 1.00 . A A . 14 ALA CA 1 1
16 3175 1 1 14 ALA CB C -1.372 8.700 4.937 1.00 . A A . 14 ALA CB 1 1
16 3176 1 1 14 ALA H H -0.947 10.182 2.722 1.00 . A A . 14 ALA H 1 1
16 3177 1 1 14 ALA HXT H -3.731 11.766 5.102 1.00 . A A . 14 ALA HXT 1 1
16 3178 1 1 14 ALA HA H -2.924 8.055 3.625 1.00 . A A . 14 ALA HA 1 1
16 3179 1 1 14 ALA HB1 H -0.648 7.942 4.585 1.00 . A A . 14 ALA HB1 1 1
16 3180 1 1 14 ALA HB2 H -0.791 9.593 5.236 1.00 . A A . 14 ALA HB2 1 1
16 3181 1 1 14 ALA HB3 H -1.834 8.290 5.855 1.00 . A A . 14 ALA HB3 1 1
16 3182 1 1 14 ALA N N -1.759 9.559 2.655 1.00 . A A . 14 ALA N 1 1
16 3183 1 1 14 ALA O O -4.715 9.678 4.419 1.00 . A A . 14 ALA O 1 1
16 3184 1 1 14 ALA OXT O -3.029 11.193 4.789 1.00 . A A . 14 ALA OXT 1 1
17 3185 1 1 1 ACE C C 8.806 6.181 0.589 1.00 . A A . 1 ACE C 1 1
17 3186 1 1 1 ACE CH3 C 9.559 7.246 -0.200 1.00 . A A . 1 ACE CH3 1 1
17 3187 1 1 1 ACE H1 H 10.383 6.804 -0.792 1.00 . A A . 1 ACE H1 1 1
17 3188 1 1 1 ACE H2 H 8.887 7.764 -0.908 1.00 . A A . 1 ACE H2 1 1
17 3189 1 1 1 ACE H3 H 9.989 8.016 0.466 1.00 . A A . 1 ACE H3 1 1
17 3190 1 1 1 ACE O O 7.613 5.963 0.361 1.00 . A A . 1 ACE O 1 1
17 3191 1 1 2 ILE C C 8.977 5.019 3.831 1.00 . A A . 2 ILE C 1 1
17 3192 1 1 2 ILE CA C 8.966 4.456 2.382 1.00 . A A . 2 ILE CA 1 1
17 3193 1 1 2 ILE CB C 9.693 3.072 2.207 1.00 . A A . 2 ILE CB 1 1
17 3194 1 1 2 ILE CD1 C 8.314 2.236 0.105 1.00 . A A . 2 ILE CD1 1 1
17 3195 1 1 2 ILE CG1 C 9.686 2.497 0.754 1.00 . A A . 2 ILE CG1 1 1
17 3196 1 1 2 ILE CG2 C 9.181 1.985 3.189 1.00 . A A . 2 ILE CG2 1 1
17 3197 1 1 2 ILE H H 10.475 5.906 1.647 1.00 . A A . 2 ILE H 1 1
17 3198 1 1 2 ILE HA H 7.912 4.285 2.103 1.00 . A A . 2 ILE HA 1 1
17 3199 1 1 2 ILE HB H 10.758 3.233 2.466 1.00 . A A . 2 ILE HB 1 1
17 3200 1 1 2 ILE HD11 H 7.720 3.164 0.006 1.00 . A A . 2 ILE HD11 1 1
17 3201 1 1 2 ILE HD12 H 8.429 1.819 -0.911 1.00 . A A . 2 ILE HD12 1 1
17 3202 1 1 2 ILE HD13 H 7.711 1.514 0.686 1.00 . A A . 2 ILE HD13 1 1
17 3203 1 1 2 ILE HG12 H 10.255 3.176 0.092 1.00 . A A . 2 ILE HG12 1 1
17 3204 1 1 2 ILE HG13 H 10.266 1.553 0.730 1.00 . A A . 2 ILE HG13 1 1
17 3205 1 1 2 ILE HG21 H 9.706 1.022 3.051 1.00 . A A . 2 ILE HG21 1 1
17 3206 1 1 2 ILE HG22 H 9.340 2.275 4.245 1.00 . A A . 2 ILE HG22 1 1
17 3207 1 1 2 ILE HG23 H 8.099 1.790 3.068 1.00 . A A . 2 ILE HG23 1 1
17 3208 1 1 2 ILE N N 9.531 5.528 1.508 1.00 . A A . 2 ILE N 1 1
17 3209 1 1 2 ILE O O 10.039 5.322 4.387 1.00 . A A . 2 ILE O 1 1
17 3210 1 1 3 TRP C C 6.909 4.677 6.802 1.00 . A A . 3 TRP C 1 1
17 3211 1 1 3 TRP CA C 7.603 5.674 5.813 1.00 . A A . 3 TRP CA 1 1
17 3212 1 1 3 TRP CB C 6.845 7.035 5.708 1.00 . A A . 3 TRP CB 1 1
17 3213 1 1 3 TRP CD1 C 8.634 8.714 4.764 1.00 . A A . 3 TRP CD1 1 1
17 3214 1 1 3 TRP CD2 C 6.867 8.389 3.461 1.00 . A A . 3 TRP CD2 1 1
17 3215 1 1 3 TRP CE2 C 7.765 9.282 2.825 1.00 . A A . 3 TRP CE2 1 1
17 3216 1 1 3 TRP CE3 C 5.723 7.910 2.777 1.00 . A A . 3 TRP CE3 1 1
17 3217 1 1 3 TRP CG C 7.390 8.062 4.698 1.00 . A A . 3 TRP CG 1 1
17 3218 1 1 3 TRP CH2 C 6.344 9.290 0.868 1.00 . A A . 3 TRP CH2 1 1
17 3219 1 1 3 TRP CZ2 C 7.495 9.744 1.514 1.00 . A A . 3 TRP CZ2 1 1
17 3220 1 1 3 TRP CZ3 C 5.476 8.384 1.489 1.00 . A A . 3 TRP CZ3 1 1
17 3221 1 1 3 TRP H H 6.975 4.854 3.854 1.00 . A A . 3 TRP H 1 1
17 3222 1 1 3 TRP HA H 8.588 5.898 6.268 1.00 . A A . 3 TRP HA 1 1
17 3223 1 1 3 TRP HB2 H 5.778 6.841 5.485 1.00 . A A . 3 TRP HB2 1 1
17 3224 1 1 3 TRP HB3 H 6.828 7.514 6.705 1.00 . A A . 3 TRP HB3 1 1
17 3225 1 1 3 TRP HD1 H 9.369 8.497 5.521 1.00 . A A . 3 TRP HD1 1 1
17 3226 1 1 3 TRP HE1 H 9.728 10.023 3.383 1.00 . A A . 3 TRP HE1 1 1
17 3227 1 1 3 TRP HE3 H 5.082 7.168 3.234 1.00 . A A . 3 TRP HE3 1 1
17 3228 1 1 3 TRP HH2 H 6.130 9.627 -0.136 1.00 . A A . 3 TRP HH2 1 1
17 3229 1 1 3 TRP HZ2 H 8.177 10.413 1.012 1.00 . A A . 3 TRP HZ2 1 1
17 3230 1 1 3 TRP HZ3 H 4.609 8.036 0.954 1.00 . A A . 3 TRP HZ3 1 1
17 3231 1 1 3 TRP N N 7.778 5.120 4.434 1.00 . A A . 3 TRP N 1 1
17 3232 1 1 3 TRP NE1 N 8.875 9.505 3.623 1.00 . A A . 3 TRP NE1 1 1
17 3233 1 1 3 TRP O O 6.066 5.070 7.616 1.00 . A A . 3 TRP O 1 1
17 3234 1 1 4 GLY C C 5.323 1.863 7.213 1.00 . A A . 4 GLY C 1 1
17 3235 1 1 4 GLY CA C 6.730 2.333 7.634 1.00 . A A . 4 GLY CA 1 1
17 3236 1 1 4 GLY H H 7.912 3.192 5.961 1.00 . A A . 4 GLY H 1 1
17 3237 1 1 4 GLY HA2 H 7.422 1.470 7.650 1.00 . A A . 4 GLY HA2 1 1
17 3238 1 1 4 GLY HA3 H 6.702 2.684 8.683 1.00 . A A . 4 GLY HA3 1 1
17 3239 1 1 4 GLY N N 7.300 3.389 6.760 1.00 . A A . 4 GLY N 1 1
17 3240 1 1 4 GLY O O 4.339 2.222 7.865 1.00 . A A . 4 GLY O 1 1
17 3241 1 1 5 . C C 3.191 1.612 4.759 1.00 . A A . 5 SET C 1 1
17 3242 1 1 5 . CA C 3.938 0.543 5.613 1.00 . A A . 5 SET CA 1 1
17 3243 1 1 5 . CB C 4.089 -0.850 4.923 1.00 . A A . 5 SET CB 1 1
17 3244 1 1 5 . H H 6.132 0.868 5.670 1.00 . A A . 5 SET H 1 1
17 3245 1 1 5 . HA H 3.267 0.358 6.477 1.00 . A A . 5 SET HA 1 1
17 3246 1 1 5 . HB2 H 2.236 1.182 4.407 1.00 . A A . 5 SET HB2 1 1
17 3247 1 1 5 . HB3 H 2.872 2.440 5.422 1.00 . A A . 5 SET HB3 1 1
17 3248 1 1 5 . HNT2 H 4.187 1.469 2.816 1.00 . A A . 5 SET HNT2 1 1
17 3249 1 1 5 . N N 5.238 1.062 6.136 1.00 . A A . 5 SET N 1 1
17 3250 1 1 5 . NT N 3.934 2.113 3.573 1.00 . A A . 5 SET NT 1 1
17 3251 1 1 5 . OG O 3.867 -1.010 3.719 1.00 . A A . 5 SET OG 1 1
17 3252 1 1 6 SER C C 3.273 -4.033 5.447 1.00 . A A . 6 SER C 1 1
17 3253 1 1 6 SER CA C 4.619 -3.270 5.273 1.00 . A A . 6 SER CA 1 1
17 3254 1 1 6 SER CB C 5.766 -3.915 6.080 1.00 . A A . 6 SER CB 1 1
17 3255 1 1 6 SER H H 4.656 -1.555 6.682 1.00 . A A . 6 SER H 1 1
17 3256 1 1 6 SER HA H 4.936 -3.274 4.209 1.00 . A A . 6 SER HA 1 1
17 3257 1 1 6 SER HB2 H 6.686 -3.303 6.008 1.00 . A A . 6 SER HB2 1 1
17 3258 1 1 6 SER HB3 H 5.518 -3.972 7.157 1.00 . A A . 6 SER HB3 1 1
17 3259 1 1 6 SER HG H 6.762 -5.568 6.139 1.00 . A A . 6 SER HG 1 1
17 3260 1 1 6 SER N N 4.443 -1.865 5.730 1.00 . A A . 6 SER N 1 1
17 3261 1 1 6 SER O O 2.697 -4.047 6.543 1.00 . A A . 6 SER O 1 1
17 3262 1 1 6 SER OG O 6.053 -5.221 5.591 1.00 . A A . 6 SER OG 1 1
17 3263 1 1 7 GLY C C 0.356 -4.495 3.855 1.00 . A A . 7 GLY C 1 1
17 3264 1 1 7 GLY CA C 1.483 -5.397 4.397 1.00 . A A . 7 GLY CA 1 1
17 3265 1 1 7 GLY H H 3.346 -4.596 3.516 1.00 . A A . 7 GLY H 1 1
17 3266 1 1 7 GLY HA2 H 1.567 -6.297 3.760 1.00 . A A . 7 GLY HA2 1 1
17 3267 1 1 7 GLY HA3 H 1.235 -5.780 5.406 1.00 . A A . 7 GLY HA3 1 1
17 3268 1 1 7 GLY N N 2.779 -4.668 4.368 1.00 . A A . 7 GLY N 1 1
17 3269 1 1 7 GLY O O -0.105 -4.685 2.727 1.00 . A A . 7 GLY O 1 1
17 3270 1 1 8 LYS C C -0.304 -1.331 3.696 1.00 . A A . 8 LYS C 1 1
17 3271 1 1 8 LYS CA C -1.109 -2.524 4.298 1.00 . A A . 8 LYS CA 1 1
17 3272 1 1 8 LYS CB C -1.959 -2.159 5.551 1.00 . A A . 8 LYS CB 1 1
17 3273 1 1 8 LYS CD C -3.483 -0.248 4.515 1.00 . A A . 8 LYS CD 1 1
17 3274 1 1 8 LYS CE C -3.710 -0.466 3.006 1.00 . A A . 8 LYS CE 1 1
17 3275 1 1 8 LYS CG C -3.370 -1.566 5.317 1.00 . A A . 8 LYS CG 1 1
17 3276 1 1 8 LYS H H 0.478 -3.391 5.524 1.00 . A A . 8 LYS H 1 1
17 3277 1 1 8 LYS HA H -1.793 -2.960 3.541 1.00 . A A . 8 LYS HA 1 1
17 3278 1 1 8 LYS HB2 H -2.118 -3.070 6.161 1.00 . A A . 8 LYS HB2 1 1
17 3279 1 1 8 LYS HB3 H -1.385 -1.489 6.220 1.00 . A A . 8 LYS HB3 1 1
17 3280 1 1 8 LYS HD2 H -4.336 0.329 4.921 1.00 . A A . 8 LYS HD2 1 1
17 3281 1 1 8 LYS HD3 H -2.595 0.389 4.698 1.00 . A A . 8 LYS HD3 1 1
17 3282 1 1 8 LYS HE2 H -2.874 -1.036 2.561 1.00 . A A . 8 LYS HE2 1 1
17 3283 1 1 8 LYS HE3 H -4.608 -1.093 2.848 1.00 . A A . 8 LYS HE3 1 1
17 3284 1 1 8 LYS HG2 H -4.030 -2.340 4.881 1.00 . A A . 8 LYS HG2 1 1
17 3285 1 1 8 LYS HG3 H -3.805 -1.383 6.318 1.00 . A A . 8 LYS HG3 1 1
17 3286 1 1 8 LYS HZ1 H -4.075 0.676 1.292 1.00 . A A . 8 LYS HZ1 1 1
17 3287 1 1 8 LYS HZ2 H -4.618 1.389 2.679 1.00 . A A . 8 LYS HZ2 1 1
17 3288 1 1 8 LYS HZ3 H -3.006 1.378 2.327 1.00 . A A . 8 LYS HZ3 1 1
17 3289 1 1 8 LYS N N -0.076 -3.517 4.677 1.00 . A A . 8 LYS N 1 1
17 3290 1 1 8 LYS NZ N -3.863 0.815 2.288 1.00 . A A . 8 LYS NZ 1 1
17 3291 1 1 8 LYS O O 0.143 -0.425 4.409 1.00 . A A . 8 LYS O 1 1
17 3292 1 1 9 LEU C C -0.089 1.022 1.506 1.00 . A A . 9 LEU C 1 1
17 3293 1 1 9 LEU CA C 0.648 -0.346 1.611 1.00 . A A . 9 LEU CA 1 1
17 3294 1 1 9 LEU CB C 1.015 -0.903 0.203 1.00 . A A . 9 LEU CB 1 1
17 3295 1 1 9 LEU CD1 C 2.141 -2.754 -1.147 1.00 . A A . 9 LEU CD1 1 1
17 3296 1 1 9 LEU CD2 C 3.566 -1.230 0.261 1.00 . A A . 9 LEU CD2 1 1
17 3297 1 1 9 LEU CG C 2.192 -1.922 0.148 1.00 . A A . 9 LEU CG 1 1
17 3298 1 1 9 LEU H H -0.462 -2.238 1.939 1.00 . A A . 9 LEU H 1 1
17 3299 1 1 9 LEU HA H 1.608 -0.192 2.146 1.00 . A A . 9 LEU HA 1 1
17 3300 1 1 9 LEU HB2 H 0.106 -1.344 -0.251 1.00 . A A . 9 LEU HB2 1 1
17 3301 1 1 9 LEU HB3 H 1.262 -0.067 -0.482 1.00 . A A . 9 LEU HB3 1 1
17 3302 1 1 9 LEU HD11 H 2.955 -3.503 -1.185 1.00 . A A . 9 LEU HD11 1 1
17 3303 1 1 9 LEU HD12 H 1.191 -3.316 -1.232 1.00 . A A . 9 LEU HD12 1 1
17 3304 1 1 9 LEU HD13 H 2.231 -2.125 -2.053 1.00 . A A . 9 LEU HD13 1 1
17 3305 1 1 9 LEU HD21 H 3.656 -0.630 1.183 1.00 . A A . 9 LEU HD21 1 1
17 3306 1 1 9 LEU HD22 H 4.393 -1.965 0.281 1.00 . A A . 9 LEU HD22 1 1
17 3307 1 1 9 LEU HD23 H 3.759 -0.546 -0.587 1.00 . A A . 9 LEU HD23 1 1
17 3308 1 1 9 LEU HG H 2.101 -2.632 0.992 1.00 . A A . 9 LEU HG 1 1
17 3309 1 1 9 LEU N N -0.123 -1.369 2.365 1.00 . A A . 9 LEU N 1 1
17 3310 1 1 9 LEU O O -1.051 1.185 0.748 1.00 . A A . 9 LEU O 1 1
17 3311 1 1 10 ILE C C 1.103 4.348 2.336 1.00 . A A . 10 ILE C 1 1
17 3312 1 1 10 ILE CA C -0.133 3.384 2.346 1.00 . A A . 10 ILE CA 1 1
17 3313 1 1 10 ILE CB C -1.187 3.559 3.502 1.00 . A A . 10 ILE CB 1 1
17 3314 1 1 10 ILE CD1 C -2.763 5.192 2.212 1.00 . A A . 10 ILE CD1 1 1
17 3315 1 1 10 ILE CG1 C -1.936 4.922 3.479 1.00 . A A . 10 ILE CG1 1 1
17 3316 1 1 10 ILE CG2 C -0.649 3.293 4.933 1.00 . A A . 10 ILE CG2 1 1
17 3317 1 1 10 ILE H H 1.127 1.682 2.946 1.00 . A A . 10 ILE H 1 1
17 3318 1 1 10 ILE HA H -0.668 3.580 1.396 1.00 . A A . 10 ILE HA 1 1
17 3319 1 1 10 ILE HB H -1.964 2.788 3.339 1.00 . A A . 10 ILE HB 1 1
17 3320 1 1 10 ILE HD11 H -3.348 6.123 2.314 1.00 . A A . 10 ILE HD11 1 1
17 3321 1 1 10 ILE HD12 H -2.122 5.311 1.320 1.00 . A A . 10 ILE HD12 1 1
17 3322 1 1 10 ILE HD13 H -3.476 4.372 2.008 1.00 . A A . 10 ILE HD13 1 1
17 3323 1 1 10 ILE HG12 H -2.629 4.976 4.342 1.00 . A A . 10 ILE HG12 1 1
17 3324 1 1 10 ILE HG13 H -1.224 5.755 3.633 1.00 . A A . 10 ILE HG13 1 1
17 3325 1 1 10 ILE HG21 H -0.179 2.296 5.018 1.00 . A A . 10 ILE HG21 1 1
17 3326 1 1 10 ILE HG22 H 0.108 4.036 5.246 1.00 . A A . 10 ILE HG22 1 1
17 3327 1 1 10 ILE HG23 H -1.458 3.320 5.687 1.00 . A A . 10 ILE HG23 1 1
17 3328 1 1 10 ILE N N 0.387 1.986 2.307 1.00 . A A . 10 ILE N 1 1
17 3329 1 1 10 ILE O O 1.347 5.099 3.285 1.00 . A A . 10 ILE O 1 1
17 3330 1 1 11 GLU C C 2.917 6.133 -0.150 1.00 . A A . 11 GLU C 1 1
17 3331 1 1 11 GLU CA C 3.102 5.141 1.048 1.00 . A A . 11 GLU CA 1 1
17 3332 1 1 11 GLU CB C 4.305 4.145 0.908 1.00 . A A . 11 GLU CB 1 1
17 3333 1 1 11 GLU CD C 4.331 3.395 3.460 1.00 . A A . 11 GLU CD 1 1
17 3334 1 1 11 GLU CG C 5.105 3.819 2.196 1.00 . A A . 11 GLU CG 1 1
17 3335 1 1 11 GLU H H 1.567 3.651 0.515 1.00 . A A . 11 GLU H 1 1
17 3336 1 1 11 GLU HA H 3.332 5.745 1.952 1.00 . A A . 11 GLU HA 1 1
17 3337 1 1 11 GLU HB2 H 3.999 3.202 0.414 1.00 . A A . 11 GLU HB2 1 1
17 3338 1 1 11 GLU HB3 H 5.052 4.564 0.207 1.00 . A A . 11 GLU HB3 1 1
17 3339 1 1 11 GLU HG2 H 5.880 3.065 1.964 1.00 . A A . 11 GLU HG2 1 1
17 3340 1 1 11 GLU HG3 H 5.681 4.728 2.455 1.00 . A A . 11 GLU HG3 1 1
17 3341 1 1 11 GLU N N 1.872 4.325 1.227 1.00 . A A . 11 GLU N 1 1
17 3342 1 1 11 GLU O O 3.594 6.005 -1.176 1.00 . A A . 11 GLU O 1 1
17 3343 1 1 11 GLU OE1 O 4.094 4.252 4.315 1.00 . A A . 11 GLU OE1 1 1
17 3344 1 1 12 THR C C 2.630 9.425 -0.757 1.00 . A A . 12 THR C 1 1
17 3345 1 1 12 THR CA C 1.777 8.161 -1.092 1.00 . A A . 12 THR CA 1 1
17 3346 1 1 12 THR CB C 0.257 8.421 -1.360 1.00 . A A . 12 THR CB 1 1
17 3347 1 1 12 THR CG2 C -0.022 9.324 -2.579 1.00 . A A . 12 THR CG2 1 1
17 3348 1 1 12 THR H H 1.409 7.085 0.807 1.00 . A A . 12 THR H 1 1
17 3349 1 1 12 THR HA H 2.171 7.772 -2.053 1.00 . A A . 12 THR HA 1 1
17 3350 1 1 12 THR HB H -0.207 8.899 -0.475 1.00 . A A . 12 THR HB 1 1
17 3351 1 1 12 THR HG1 H -0.043 6.832 -2.405 1.00 . A A . 12 THR HG1 1 1
17 3352 1 1 12 THR HG21 H 0.409 10.336 -2.457 1.00 . A A . 12 THR HG21 1 1
17 3353 1 1 12 THR HG22 H 0.392 8.905 -3.516 1.00 . A A . 12 THR HG22 1 1
17 3354 1 1 12 THR HG23 H -1.108 9.464 -2.743 1.00 . A A . 12 THR HG23 1 1
17 3355 1 1 12 THR N N 2.013 7.138 -0.022 1.00 . A A . 12 THR N 1 1
17 3356 1 1 12 THR O O 3.638 9.662 -1.426 1.00 . A A . 12 THR O 1 1
17 3357 1 1 12 THR OG1 O -0.419 7.190 -1.598 1.00 . A A . 12 THR OG1 1 1
17 3358 1 1 13 THR C C 2.765 11.568 2.219 1.00 . A A . 13 THR C 1 1
17 3359 1 1 13 THR CA C 2.973 11.447 0.679 1.00 . A A . 13 THR CA 1 1
17 3360 1 1 13 THR CB C 2.485 12.700 -0.113 1.00 . A A . 13 THR CB 1 1
17 3361 1 1 13 THR CG2 C 3.183 14.011 0.282 1.00 . A A . 13 THR CG2 1 1
17 3362 1 1 13 THR H H 1.363 9.951 0.717 1.00 . A A . 13 THR H 1 1
17 3363 1 1 13 THR HA H 4.055 11.319 0.466 1.00 . A A . 13 THR HA 1 1
17 3364 1 1 13 THR HB H 1.395 12.830 0.038 1.00 . A A . 13 THR HB 1 1
17 3365 1 1 13 THR HG1 H 2.507 11.605 -1.697 1.00 . A A . 13 THR HG1 1 1
17 3366 1 1 13 THR HG21 H 2.822 14.856 -0.333 1.00 . A A . 13 THR HG21 1 1
17 3367 1 1 13 THR HG22 H 2.991 14.274 1.339 1.00 . A A . 13 THR HG22 1 1
17 3368 1 1 13 THR HG23 H 4.278 13.945 0.147 1.00 . A A . 13 THR HG23 1 1
17 3369 1 1 13 THR N N 2.236 10.225 0.258 1.00 . A A . 13 THR N 1 1
17 3370 1 1 13 THR O O 1.656 11.866 2.676 1.00 . A A . 13 THR O 1 1
17 3371 1 1 13 THR OG1 O 2.723 12.522 -1.507 1.00 . A A . 13 THR OG1 1 1
17 3372 1 1 14 ALA C C 5.063 12.095 5.024 1.00 . A A . 14 ALA C 1 1
17 3373 1 1 14 ALA CA C 3.782 11.425 4.487 1.00 . A A . 14 ALA CA 1 1
17 3374 1 1 14 ALA CB C 3.526 10.037 5.111 1.00 . A A . 14 ALA CB 1 1
17 3375 1 1 14 ALA H H 4.691 11.074 2.507 1.00 . A A . 14 ALA H 1 1
17 3376 1 1 14 ALA HXT H 6.972 11.783 5.173 1.00 . A A . 14 ALA HXT 1 1
17 3377 1 1 14 ALA HA H 2.941 12.077 4.799 1.00 . A A . 14 ALA HA 1 1
17 3378 1 1 14 ALA HB1 H 3.440 10.097 6.211 1.00 . A A . 14 ALA HB1 1 1
17 3379 1 1 14 ALA HB2 H 2.586 9.590 4.739 1.00 . A A . 14 ALA HB2 1 1
17 3380 1 1 14 ALA HB3 H 4.338 9.320 4.889 1.00 . A A . 14 ALA HB3 1 1
17 3381 1 1 14 ALA N N 3.834 11.339 3.005 1.00 . A A . 14 ALA N 1 1
17 3382 1 1 14 ALA O O 5.065 13.198 5.568 1.00 . A A . 14 ALA O 1 1
17 3383 1 1 14 ALA OXT O 6.193 11.340 4.831 1.00 . A A . 14 ALA OXT 1 1
18 3384 1 1 1 ACE C C 5.481 8.957 1.612 1.00 . A A . 1 ACE C 1 1
18 3385 1 1 1 ACE CH3 C 5.283 10.399 1.160 1.00 . A A . 1 ACE CH3 1 1
18 3386 1 1 1 ACE H1 H 6.043 10.695 0.415 1.00 . A A . 1 ACE H1 1 1
18 3387 1 1 1 ACE H2 H 4.290 10.534 0.693 1.00 . A A . 1 ACE H2 1 1
18 3388 1 1 1 ACE H3 H 5.341 11.105 2.010 1.00 . A A . 1 ACE H3 1 1
18 3389 1 1 1 ACE O O 4.641 8.097 1.336 1.00 . A A . 1 ACE O 1 1
18 3390 1 1 2 ILE C C 6.908 7.472 4.376 1.00 . A A . 2 ILE C 1 1
18 3391 1 1 2 ILE CA C 6.974 7.368 2.825 1.00 . A A . 2 ILE CA 1 1
18 3392 1 1 2 ILE CB C 8.355 6.856 2.270 1.00 . A A . 2 ILE CB 1 1
18 3393 1 1 2 ILE CD1 C 7.470 5.938 -0.053 1.00 . A A . 2 ILE CD1 1 1
18 3394 1 1 2 ILE CG1 C 8.485 6.805 0.714 1.00 . A A . 2 ILE CG1 1 1
18 3395 1 1 2 ILE CG2 C 8.776 5.485 2.863 1.00 . A A . 2 ILE CG2 1 1
18 3396 1 1 2 ILE H H 7.119 9.567 2.570 1.00 . A A . 2 ILE H 1 1
18 3397 1 1 2 ILE HA H 6.213 6.634 2.502 1.00 . A A . 2 ILE HA 1 1
18 3398 1 1 2 ILE HB H 9.124 7.578 2.610 1.00 . A A . 2 ILE HB 1 1
18 3399 1 1 2 ILE HD11 H 6.434 6.294 0.094 1.00 . A A . 2 ILE HD11 1 1
18 3400 1 1 2 ILE HD12 H 7.667 5.960 -1.139 1.00 . A A . 2 ILE HD12 1 1
18 3401 1 1 2 ILE HD13 H 7.509 4.878 0.261 1.00 . A A . 2 ILE HD13 1 1
18 3402 1 1 2 ILE HG12 H 8.428 7.834 0.310 1.00 . A A . 2 ILE HG12 1 1
18 3403 1 1 2 ILE HG13 H 9.505 6.469 0.439 1.00 . A A . 2 ILE HG13 1 1
18 3404 1 1 2 ILE HG21 H 9.760 5.155 2.481 1.00 . A A . 2 ILE HG21 1 1
18 3405 1 1 2 ILE HG22 H 8.868 5.522 3.964 1.00 . A A . 2 ILE HG22 1 1
18 3406 1 1 2 ILE HG23 H 8.049 4.686 2.626 1.00 . A A . 2 ILE HG23 1 1
18 3407 1 1 2 ILE N N 6.607 8.719 2.301 1.00 . A A . 2 ILE N 1 1
18 3408 1 1 2 ILE O O 7.699 8.195 4.992 1.00 . A A . 2 ILE O 1 1
18 3409 1 1 3 TRP C C 5.900 5.359 7.210 1.00 . A A . 3 TRP C 1 1
18 3410 1 1 3 TRP CA C 5.763 6.734 6.472 1.00 . A A . 3 TRP CA 1 1
18 3411 1 1 3 TRP CB C 4.355 7.362 6.731 1.00 . A A . 3 TRP CB 1 1
18 3412 1 1 3 TRP CD1 C 4.815 9.911 6.362 1.00 . A A . 3 TRP CD1 1 1
18 3413 1 1 3 TRP CD2 C 3.241 9.049 5.054 1.00 . A A . 3 TRP CD2 1 1
18 3414 1 1 3 TRP CE2 C 3.428 10.417 4.732 1.00 . A A . 3 TRP CE2 1 1
18 3415 1 1 3 TRP CE3 C 2.401 8.231 4.258 1.00 . A A . 3 TRP CE3 1 1
18 3416 1 1 3 TRP CG C 4.082 8.740 6.104 1.00 . A A . 3 TRP CG 1 1
18 3417 1 1 3 TRP CH2 C 1.894 10.173 2.880 1.00 . A A . 3 TRP CH2 1 1
18 3418 1 1 3 TRP CZ2 C 2.740 10.986 3.635 1.00 . A A . 3 TRP CZ2 1 1
18 3419 1 1 3 TRP CZ3 C 1.736 8.813 3.177 1.00 . A A . 3 TRP CZ3 1 1
18 3420 1 1 3 TRP H H 5.317 6.251 4.353 1.00 . A A . 3 TRP H 1 1
18 3421 1 1 3 TRP HA H 6.504 7.396 6.962 1.00 . A A . 3 TRP HA 1 1
18 3422 1 1 3 TRP HB2 H 3.571 6.648 6.410 1.00 . A A . 3 TRP HB2 1 1
18 3423 1 1 3 TRP HB3 H 4.197 7.462 7.821 1.00 . A A . 3 TRP HB3 1 1
18 3424 1 1 3 TRP HD1 H 5.694 9.917 6.987 1.00 . A A . 3 TRP HD1 1 1
18 3425 1 1 3 TRP HE1 H 4.818 11.914 5.467 1.00 . A A . 3 TRP HE1 1 1
18 3426 1 1 3 TRP HE3 H 2.306 7.175 4.464 1.00 . A A . 3 TRP HE3 1 1
18 3427 1 1 3 TRP HH2 H 1.372 10.600 2.039 1.00 . A A . 3 TRP HH2 1 1
18 3428 1 1 3 TRP HZ2 H 2.886 12.022 3.367 1.00 . A A . 3 TRP HZ2 1 1
18 3429 1 1 3 TRP HZ3 H 1.095 8.203 2.559 1.00 . A A . 3 TRP HZ3 1 1
18 3430 1 1 3 TRP N N 5.979 6.713 4.988 1.00 . A A . 3 TRP N 1 1
18 3431 1 1 3 TRP NE1 N 4.403 10.979 5.541 1.00 . A A . 3 TRP NE1 1 1
18 3432 1 1 3 TRP O O 5.363 5.202 8.311 1.00 . A A . 3 TRP O 1 1
18 3433 1 1 4 GLY C C 5.540 2.178 7.090 1.00 . A A . 4 GLY C 1 1
18 3434 1 1 4 GLY CA C 6.808 3.037 7.274 1.00 . A A . 4 GLY CA 1 1
18 3435 1 1 4 GLY H H 7.067 4.651 5.762 1.00 . A A . 4 GLY H 1 1
18 3436 1 1 4 GLY HA2 H 7.691 2.537 6.833 1.00 . A A . 4 GLY HA2 1 1
18 3437 1 1 4 GLY HA3 H 7.042 3.132 8.352 1.00 . A A . 4 GLY HA3 1 1
18 3438 1 1 4 GLY N N 6.644 4.380 6.656 1.00 . A A . 4 GLY N 1 1
18 3439 1 1 4 GLY O O 4.678 2.164 7.973 1.00 . A A . 4 GLY O 1 1
18 3440 1 1 5 . C C 3.285 1.414 4.663 1.00 . A A . 5 SET C 1 1
18 3441 1 1 5 . CA C 4.255 0.640 5.609 1.00 . A A . 5 SET CA 1 1
18 3442 1 1 5 . CB C 4.670 -0.756 5.049 1.00 . A A . 5 SET CB 1 1
18 3443 1 1 5 . H H 6.221 1.602 5.296 1.00 . A A . 5 SET H 1 1
18 3444 1 1 5 . HA H 3.663 0.483 6.533 1.00 . A A . 5 SET HA 1 1
18 3445 1 1 5 . HB2 H 2.432 0.756 4.419 1.00 . A A . 5 SET HB2 1 1
18 3446 1 1 5 . HB3 H 2.810 2.234 5.239 1.00 . A A . 5 SET HB3 1 1
18 3447 1 1 5 . HNT2 H 4.064 1.304 2.606 1.00 . A A . 5 SET HNT2 1 1
18 3448 1 1 5 . N N 5.443 1.473 5.951 1.00 . A A . 5 SET N 1 1
18 3449 1 1 5 . NT N 3.859 1.934 3.389 1.00 . A A . 5 SET NT 1 1
18 3450 1 1 5 . OG O 5.426 -0.853 4.077 1.00 . A A . 5 SET OG 1 1
18 3451 1 1 6 SER C C 3.089 -4.023 5.471 1.00 . A A . 6 SER C 1 1
18 3452 1 1 6 SER CA C 4.423 -3.241 5.291 1.00 . A A . 6 SER CA 1 1
18 3453 1 1 6 SER CB C 5.555 -3.848 6.153 1.00 . A A . 6 SER CB 1 1
18 3454 1 1 6 SER H H 3.488 -1.619 6.427 1.00 . A A . 6 SER H 1 1
18 3455 1 1 6 SER HA H 4.744 -3.288 4.228 1.00 . A A . 6 SER HA 1 1
18 3456 1 1 6 SER HB2 H 5.333 -3.756 7.233 1.00 . A A . 6 SER HB2 1 1
18 3457 1 1 6 SER HB3 H 5.654 -4.932 5.956 1.00 . A A . 6 SER HB3 1 1
18 3458 1 1 6 SER HG H 6.656 -2.277 5.965 1.00 . A A . 6 SER HG 1 1
18 3459 1 1 6 SER N N 4.154 -1.829 5.677 1.00 . A A . 6 SER N 1 1
18 3460 1 1 6 SER O O 2.480 -3.987 6.547 1.00 . A A . 6 SER O 1 1
18 3461 1 1 6 SER OG O 6.802 -3.222 5.868 1.00 . A A . 6 SER OG 1 1
18 3462 1 1 7 GLY C C 0.260 -4.636 3.786 1.00 . A A . 7 GLY C 1 1
18 3463 1 1 7 GLY CA C 1.355 -5.490 4.457 1.00 . A A . 7 GLY CA 1 1
18 3464 1 1 7 GLY H H 3.226 -4.709 3.580 1.00 . A A . 7 GLY H 1 1
18 3465 1 1 7 GLY HA2 H 1.476 -6.438 3.900 1.00 . A A . 7 GLY HA2 1 1
18 3466 1 1 7 GLY HA3 H 1.062 -5.790 5.483 1.00 . A A . 7 GLY HA3 1 1
18 3467 1 1 7 GLY N N 2.642 -4.743 4.423 1.00 . A A . 7 GLY N 1 1
18 3468 1 1 7 GLY O O -0.094 -4.877 2.629 1.00 . A A . 7 GLY O 1 1
18 3469 1 1 8 LYS C C -0.411 -1.432 3.611 1.00 . A A . 8 LYS C 1 1
18 3470 1 1 8 LYS CA C -1.264 -2.674 4.018 1.00 . A A . 8 LYS CA 1 1
18 3471 1 1 8 LYS CB C -2.322 -2.405 5.129 1.00 . A A . 8 LYS CB 1 1
18 3472 1 1 8 LYS CD C -3.692 -0.417 4.037 1.00 . A A . 8 LYS CD 1 1
18 3473 1 1 8 LYS CE C -3.630 -0.464 2.498 1.00 . A A . 8 LYS CE 1 1
18 3474 1 1 8 LYS CG C -3.686 -1.815 4.698 1.00 . A A . 8 LYS CG 1 1
18 3475 1 1 8 LYS H H 0.190 -3.491 5.435 1.00 . A A . 8 LYS H 1 1
18 3476 1 1 8 LYS HA H -1.793 -3.091 3.138 1.00 . A A . 8 LYS HA 1 1
18 3477 1 1 8 LYS HB2 H -2.559 -3.360 5.638 1.00 . A A . 8 LYS HB2 1 1
18 3478 1 1 8 LYS HB3 H -1.886 -1.778 5.931 1.00 . A A . 8 LYS HB3 1 1
18 3479 1 1 8 LYS HD2 H -4.624 0.101 4.336 1.00 . A A . 8 LYS HD2 1 1
18 3480 1 1 8 LYS HD3 H -2.874 0.205 4.451 1.00 . A A . 8 LYS HD3 1 1
18 3481 1 1 8 LYS HE2 H -2.717 -0.985 2.157 1.00 . A A . 8 LYS HE2 1 1
18 3482 1 1 8 LYS HE3 H -4.471 -1.067 2.106 1.00 . A A . 8 LYS HE3 1 1
18 3483 1 1 8 LYS HG2 H -4.226 -2.547 4.067 1.00 . A A . 8 LYS HG2 1 1
18 3484 1 1 8 LYS HG3 H -4.305 -1.750 5.613 1.00 . A A . 8 LYS HG3 1 1
18 3485 1 1 8 LYS HZ1 H -2.859 1.453 2.202 1.00 . A A . 8 LYS HZ1 1 1
18 3486 1 1 8 LYS HZ2 H -3.655 0.868 0.885 1.00 . A A . 8 LYS HZ2 1 1
18 3487 1 1 8 LYS HZ3 H -4.509 1.408 2.191 1.00 . A A . 8 LYS HZ3 1 1
18 3488 1 1 8 LYS N N -0.257 -3.636 4.527 1.00 . A A . 8 LYS N 1 1
18 3489 1 1 8 LYS NZ N -3.668 0.891 1.912 1.00 . A A . 8 LYS NZ 1 1
18 3490 1 1 8 LYS O O -0.140 -0.542 4.427 1.00 . A A . 8 LYS O 1 1
18 3491 1 1 9 LEU C C 0.115 1.034 1.586 1.00 . A A . 9 LEU C 1 1
18 3492 1 1 9 LEU CA C 0.871 -0.311 1.793 1.00 . A A . 9 LEU CA 1 1
18 3493 1 1 9 LEU CB C 1.586 -0.766 0.483 1.00 . A A . 9 LEU CB 1 1
18 3494 1 1 9 LEU CD1 C 2.569 -3.099 1.071 1.00 . A A . 9 LEU CD1 1 1
18 3495 1 1 9 LEU CD2 C 3.676 -1.666 -0.670 1.00 . A A . 9 LEU CD2 1 1
18 3496 1 1 9 LEU CG C 2.860 -1.649 0.638 1.00 . A A . 9 LEU CG 1 1
18 3497 1 1 9 LEU H H -0.157 -2.262 1.812 1.00 . A A . 9 LEU H 1 1
18 3498 1 1 9 LEU HA H 1.690 -0.147 2.522 1.00 . A A . 9 LEU HA 1 1
18 3499 1 1 9 LEU HB2 H 0.865 -1.243 -0.211 1.00 . A A . 9 LEU HB2 1 1
18 3500 1 1 9 LEU HB3 H 1.904 0.148 -0.057 1.00 . A A . 9 LEU HB3 1 1
18 3501 1 1 9 LEU HD11 H 3.493 -3.702 1.136 1.00 . A A . 9 LEU HD11 1 1
18 3502 1 1 9 LEU HD12 H 2.108 -3.133 2.073 1.00 . A A . 9 LEU HD12 1 1
18 3503 1 1 9 LEU HD13 H 1.884 -3.615 0.373 1.00 . A A . 9 LEU HD13 1 1
18 3504 1 1 9 LEU HD21 H 3.111 -2.112 -1.510 1.00 . A A . 9 LEU HD21 1 1
18 3505 1 1 9 LEU HD22 H 3.974 -0.647 -0.981 1.00 . A A . 9 LEU HD22 1 1
18 3506 1 1 9 LEU HD23 H 4.613 -2.246 -0.563 1.00 . A A . 9 LEU HD23 1 1
18 3507 1 1 9 LEU HG H 3.501 -1.192 1.415 1.00 . A A . 9 LEU HG 1 1
18 3508 1 1 9 LEU N N 0.012 -1.395 2.333 1.00 . A A . 9 LEU N 1 1
18 3509 1 1 9 LEU O O -0.661 1.197 0.638 1.00 . A A . 9 LEU O 1 1
18 3510 1 1 10 ILE C C 1.005 4.357 2.332 1.00 . A A . 10 ILE C 1 1
18 3511 1 1 10 ILE CA C -0.203 3.362 2.464 1.00 . A A . 10 ILE CA 1 1
18 3512 1 1 10 ILE CB C -1.210 3.590 3.652 1.00 . A A . 10 ILE CB 1 1
18 3513 1 1 10 ILE CD1 C -2.967 5.030 2.357 1.00 . A A . 10 ILE CD1 1 1
18 3514 1 1 10 ILE CG1 C -2.013 4.919 3.557 1.00 . A A . 10 ILE CG1 1 1
18 3515 1 1 10 ILE CG2 C -0.592 3.463 5.070 1.00 . A A . 10 ILE CG2 1 1
18 3516 1 1 10 ILE H H 0.969 1.678 3.276 1.00 . A A . 10 ILE H 1 1
18 3517 1 1 10 ILE HA H -0.791 3.483 1.534 1.00 . A A . 10 ILE HA 1 1
18 3518 1 1 10 ILE HB H -1.961 2.777 3.592 1.00 . A A . 10 ILE HB 1 1
18 3519 1 1 10 ILE HD11 H -2.424 5.054 1.395 1.00 . A A . 10 ILE HD11 1 1
18 3520 1 1 10 ILE HD12 H -3.680 4.186 2.322 1.00 . A A . 10 ILE HD12 1 1
18 3521 1 1 10 ILE HD13 H -3.563 5.959 2.411 1.00 . A A . 10 ILE HD13 1 1
18 3522 1 1 10 ILE HG12 H -2.624 5.051 4.471 1.00 . A A . 10 ILE HG12 1 1
18 3523 1 1 10 ILE HG13 H -1.324 5.785 3.553 1.00 . A A . 10 ILE HG13 1 1
18 3524 1 1 10 ILE HG21 H -1.364 3.517 5.860 1.00 . A A . 10 ILE HG21 1 1
18 3525 1 1 10 ILE HG22 H -0.072 2.498 5.210 1.00 . A A . 10 ILE HG22 1 1
18 3526 1 1 10 ILE HG23 H 0.143 4.262 5.283 1.00 . A A . 10 ILE HG23 1 1
18 3527 1 1 10 ILE N N 0.362 1.980 2.507 1.00 . A A . 10 ILE N 1 1
18 3528 1 1 10 ILE O O 1.243 5.208 3.193 1.00 . A A . 10 ILE O 1 1
18 3529 1 1 11 GLU C C 2.707 6.037 -0.283 1.00 . A A . 11 GLU C 1 1
18 3530 1 1 11 GLU CA C 2.961 5.068 0.924 1.00 . A A . 11 GLU CA 1 1
18 3531 1 1 11 GLU CB C 4.134 4.045 0.718 1.00 . A A . 11 GLU CB 1 1
18 3532 1 1 11 GLU CD C 4.239 3.221 3.250 1.00 . A A . 11 GLU CD 1 1
18 3533 1 1 11 GLU CG C 4.972 3.647 1.961 1.00 . A A . 11 GLU CG 1 1
18 3534 1 1 11 GLU H H 1.456 3.491 0.583 1.00 . A A . 11 GLU H 1 1
18 3535 1 1 11 GLU HA H 3.245 5.702 1.791 1.00 . A A . 11 GLU HA 1 1
18 3536 1 1 11 GLU HB2 H 3.785 3.128 0.202 1.00 . A A . 11 GLU HB2 1 1
18 3537 1 1 11 GLU HB3 H 4.863 4.465 0.002 1.00 . A A . 11 GLU HB3 1 1
18 3538 1 1 11 GLU HG2 H 5.705 2.871 1.671 1.00 . A A . 11 GLU HG2 1 1
18 3539 1 1 11 GLU HG3 H 5.610 4.512 2.221 1.00 . A A . 11 GLU HG3 1 1
18 3540 1 1 11 GLU N N 1.755 4.240 1.216 1.00 . A A . 11 GLU N 1 1
18 3541 1 1 11 GLU O O 3.479 6.067 -1.248 1.00 . A A . 11 GLU O 1 1
18 3542 1 1 11 GLU OE1 O 4.051 4.074 4.123 1.00 . A A . 11 GLU OE1 1 1
18 3543 1 1 12 THR C C 0.579 9.042 -0.586 1.00 . A A . 12 THR C 1 1
18 3544 1 1 12 THR CA C 1.262 7.829 -1.288 1.00 . A A . 12 THR CA 1 1
18 3545 1 1 12 THR CB C 0.438 7.175 -2.451 1.00 . A A . 12 THR CB 1 1
18 3546 1 1 12 THR CG2 C 0.138 8.133 -3.617 1.00 . A A . 12 THR CG2 1 1
18 3547 1 1 12 THR H H 1.038 6.719 0.606 1.00 . A A . 12 THR H 1 1
18 3548 1 1 12 THR HA H 2.197 8.222 -1.737 1.00 . A A . 12 THR HA 1 1
18 3549 1 1 12 THR HB H -0.524 6.800 -2.053 1.00 . A A . 12 THR HB 1 1
18 3550 1 1 12 THR HG1 H 2.027 6.376 -3.192 1.00 . A A . 12 THR HG1 1 1
18 3551 1 1 12 THR HG21 H -0.476 8.995 -3.297 1.00 . A A . 12 THR HG21 1 1
18 3552 1 1 12 THR HG22 H 1.063 8.535 -4.069 1.00 . A A . 12 THR HG22 1 1
18 3553 1 1 12 THR HG23 H -0.424 7.622 -4.420 1.00 . A A . 12 THR HG23 1 1
18 3554 1 1 12 THR N N 1.632 6.855 -0.219 1.00 . A A . 12 THR N 1 1
18 3555 1 1 12 THR O O 1.211 10.094 -0.466 1.00 . A A . 12 THR O 1 1
18 3556 1 1 12 THR OG1 O 1.137 6.066 -3.006 1.00 . A A . 12 THR OG1 1 1
18 3557 1 1 13 THR C C -2.224 9.302 1.710 1.00 . A A . 13 THR C 1 1
18 3558 1 1 13 THR CA C -1.442 9.994 0.553 1.00 . A A . 13 THR CA 1 1
18 3559 1 1 13 THR CB C -2.352 10.776 -0.442 1.00 . A A . 13 THR CB 1 1
18 3560 1 1 13 THR CG2 C -3.151 11.926 0.198 1.00 . A A . 13 THR CG2 1 1
18 3561 1 1 13 THR H H -1.156 8.032 -0.399 1.00 . A A . 13 THR H 1 1
18 3562 1 1 13 THR HA H -0.730 10.728 0.985 1.00 . A A . 13 THR HA 1 1
18 3563 1 1 13 THR HB H -3.070 10.077 -0.913 1.00 . A A . 13 THR HB 1 1
18 3564 1 1 13 THR HG1 H -0.952 10.673 -1.759 1.00 . A A . 13 THR HG1 1 1
18 3565 1 1 13 THR HG21 H -3.756 12.462 -0.555 1.00 . A A . 13 THR HG21 1 1
18 3566 1 1 13 THR HG22 H -3.851 11.561 0.972 1.00 . A A . 13 THR HG22 1 1
18 3567 1 1 13 THR HG23 H -2.486 12.671 0.675 1.00 . A A . 13 THR HG23 1 1
18 3568 1 1 13 THR N N -0.693 8.911 -0.143 1.00 . A A . 13 THR N 1 1
18 3569 1 1 13 THR O O -3.212 8.599 1.468 1.00 . A A . 13 THR O 1 1
18 3570 1 1 13 THR OG1 O -1.558 11.359 -1.472 1.00 . A A . 13 THR OG1 1 1
18 3571 1 1 14 ALA C C -3.482 9.875 4.761 1.00 . A A . 14 ALA C 1 1
18 3572 1 1 14 ALA CA C -2.418 8.926 4.165 1.00 . A A . 14 ALA CA 1 1
18 3573 1 1 14 ALA CB C -1.331 8.550 5.189 1.00 . A A . 14 ALA CB 1 1
18 3574 1 1 14 ALA H H -0.946 10.112 3.031 1.00 . A A . 14 ALA H 1 1
18 3575 1 1 14 ALA HXT H -3.647 11.630 5.567 1.00 . A A . 14 ALA HXT 1 1
18 3576 1 1 14 ALA HA H -2.932 7.983 3.896 1.00 . A A . 14 ALA HA 1 1
18 3577 1 1 14 ALA HB1 H -1.768 8.098 6.099 1.00 . A A . 14 ALA HB1 1 1
18 3578 1 1 14 ALA HB2 H -0.624 7.805 4.778 1.00 . A A . 14 ALA HB2 1 1
18 3579 1 1 14 ALA HB3 H -0.733 9.423 5.513 1.00 . A A . 14 ALA HB3 1 1
18 3580 1 1 14 ALA N N -1.776 9.515 2.962 1.00 . A A . 14 ALA N 1 1
18 3581 1 1 14 ALA O O -4.676 9.584 4.826 1.00 . A A . 14 ALA O 1 1
18 3582 1 1 14 ALA OXT O -2.961 11.065 5.206 1.00 . A A . 14 ALA OXT 1 1
19 3583 1 1 1 ACE C C 7.826 4.312 -1.057 1.00 . A A . 1 ACE C 1 1
19 3584 1 1 1 ACE CH3 C 8.780 4.642 -2.199 1.00 . A A . 1 ACE CH3 1 1
19 3585 1 1 1 ACE H1 H 8.351 5.414 -2.863 1.00 . A A . 1 ACE H1 1 1
19 3586 1 1 1 ACE H2 H 9.741 5.036 -1.819 1.00 . A A . 1 ACE H2 1 1
19 3587 1 1 1 ACE H3 H 8.993 3.753 -2.822 1.00 . A A . 1 ACE H3 1 1
19 3588 1 1 1 ACE O O 6.745 4.896 -0.962 1.00 . A A . 1 ACE O 1 1
19 3589 1 1 2 ILE C C 8.326 3.267 2.213 1.00 . A A . 2 ILE C 1 1
19 3590 1 1 2 ILE CA C 7.453 2.915 0.975 1.00 . A A . 2 ILE CA 1 1
19 3591 1 1 2 ILE CB C 7.013 1.409 0.877 1.00 . A A . 2 ILE CB 1 1
19 3592 1 1 2 ILE CD1 C 4.806 1.778 -0.544 1.00 . A A . 2 ILE CD1 1 1
19 3593 1 1 2 ILE CG1 C 6.154 1.051 -0.378 1.00 . A A . 2 ILE CG1 1 1
19 3594 1 1 2 ILE CG2 C 6.297 0.890 2.151 1.00 . A A . 2 ILE CG2 1 1
19 3595 1 1 2 ILE H H 9.201 3.030 -0.385 1.00 . A A . 2 ILE H 1 1
19 3596 1 1 2 ILE HA H 6.530 3.520 1.042 1.00 . A A . 2 ILE HA 1 1
19 3597 1 1 2 ILE HB H 7.941 0.809 0.790 1.00 . A A . 2 ILE HB 1 1
19 3598 1 1 2 ILE HD11 H 4.930 2.874 -0.609 1.00 . A A . 2 ILE HD11 1 1
19 3599 1 1 2 ILE HD12 H 4.295 1.460 -1.471 1.00 . A A . 2 ILE HD12 1 1
19 3600 1 1 2 ILE HD13 H 4.115 1.569 0.293 1.00 . A A . 2 ILE HD13 1 1
19 3601 1 1 2 ILE HG12 H 6.753 1.228 -1.290 1.00 . A A . 2 ILE HG12 1 1
19 3602 1 1 2 ILE HG13 H 5.964 -0.039 -0.392 1.00 . A A . 2 ILE HG13 1 1
19 3603 1 1 2 ILE HG21 H 6.032 -0.182 2.070 1.00 . A A . 2 ILE HG21 1 1
19 3604 1 1 2 ILE HG22 H 6.930 0.986 3.052 1.00 . A A . 2 ILE HG22 1 1
19 3605 1 1 2 ILE HG23 H 5.361 1.441 2.351 1.00 . A A . 2 ILE HG23 1 1
19 3606 1 1 2 ILE N N 8.247 3.364 -0.208 1.00 . A A . 2 ILE N 1 1
19 3607 1 1 2 ILE O O 9.407 2.704 2.415 1.00 . A A . 2 ILE O 1 1
19 3608 1 1 3 TRP C C 7.854 4.172 5.570 1.00 . A A . 3 TRP C 1 1
19 3609 1 1 3 TRP CA C 8.522 4.684 4.259 1.00 . A A . 3 TRP CA 1 1
19 3610 1 1 3 TRP CB C 8.643 6.238 4.198 1.00 . A A . 3 TRP CB 1 1
19 3611 1 1 3 TRP CD1 C 10.347 6.811 2.267 1.00 . A A . 3 TRP CD1 1 1
19 3612 1 1 3 TRP CD2 C 8.234 7.344 1.866 1.00 . A A . 3 TRP CD2 1 1
19 3613 1 1 3 TRP CE2 C 9.019 7.658 0.731 1.00 . A A . 3 TRP CE2 1 1
19 3614 1 1 3 TRP CE3 C 6.820 7.396 1.799 1.00 . A A . 3 TRP CE3 1 1
19 3615 1 1 3 TRP CG C 9.070 6.853 2.850 1.00 . A A . 3 TRP CG 1 1
19 3616 1 1 3 TRP CH2 C 7.002 8.176 -0.500 1.00 . A A . 3 TRP CH2 1 1
19 3617 1 1 3 TRP CZ2 C 8.395 8.082 -0.467 1.00 . A A . 3 TRP CZ2 1 1
19 3618 1 1 3 TRP CZ3 C 6.226 7.830 0.614 1.00 . A A . 3 TRP CZ3 1 1
19 3619 1 1 3 TRP H H 6.919 4.589 2.740 1.00 . A A . 3 TRP H 1 1
19 3620 1 1 3 TRP HA H 9.569 4.317 4.261 1.00 . A A . 3 TRP HA 1 1
19 3621 1 1 3 TRP HB2 H 7.681 6.697 4.498 1.00 . A A . 3 TRP HB2 1 1
19 3622 1 1 3 TRP HB3 H 9.352 6.574 4.979 1.00 . A A . 3 TRP HB3 1 1
19 3623 1 1 3 TRP HD1 H 11.172 6.272 2.702 1.00 . A A . 3 TRP HD1 1 1
19 3624 1 1 3 TRP HE1 H 11.121 7.353 0.288 1.00 . A A . 3 TRP HE1 1 1
19 3625 1 1 3 TRP HE3 H 6.234 7.035 2.636 1.00 . A A . 3 TRP HE3 1 1
19 3626 1 1 3 TRP HH2 H 6.517 8.485 -1.413 1.00 . A A . 3 TRP HH2 1 1
19 3627 1 1 3 TRP HZ2 H 8.979 8.297 -1.350 1.00 . A A . 3 TRP HZ2 1 1
19 3628 1 1 3 TRP HZ3 H 5.149 7.874 0.544 1.00 . A A . 3 TRP HZ3 1 1
19 3629 1 1 3 TRP N N 7.806 4.179 3.052 1.00 . A A . 3 TRP N 1 1
19 3630 1 1 3 TRP NE1 N 10.349 7.345 0.963 1.00 . A A . 3 TRP NE1 1 1
19 3631 1 1 3 TRP O O 7.216 4.917 6.322 1.00 . A A . 3 TRP O 1 1
19 3632 1 1 4 GLY C C 5.983 1.809 6.986 1.00 . A A . 4 GLY C 1 1
19 3633 1 1 4 GLY CA C 7.481 2.182 7.018 1.00 . A A . 4 GLY CA 1 1
19 3634 1 1 4 GLY H H 8.430 2.383 5.010 1.00 . A A . 4 GLY H 1 1
19 3635 1 1 4 GLY HA2 H 8.069 1.262 7.187 1.00 . A A . 4 GLY HA2 1 1
19 3636 1 1 4 GLY HA3 H 7.680 2.795 7.918 1.00 . A A . 4 GLY HA3 1 1
19 3637 1 1 4 GLY N N 8.023 2.866 5.817 1.00 . A A . 4 GLY N 1 1
19 3638 1 1 4 GLY O O 5.207 2.320 7.796 1.00 . A A . 4 GLY O 1 1
19 3639 1 1 5 . C C 3.167 1.520 5.433 1.00 . A A . 5 SET C 1 1
19 3640 1 1 5 . CA C 4.183 0.438 5.919 1.00 . A A . 5 SET CA 1 1
19 3641 1 1 5 . CB C 4.166 -0.883 5.089 1.00 . A A . 5 SET CB 1 1
19 3642 1 1 5 . H H 6.316 0.616 5.407 1.00 . A A . 5 SET H 1 1
19 3643 1 1 5 . HA H 3.822 0.162 6.933 1.00 . A A . 5 SET HA 1 1
19 3644 1 1 5 . HB2 H 2.234 1.039 5.090 1.00 . A A . 5 SET HB2 1 1
19 3645 1 1 5 . HB3 H 2.875 2.096 6.333 1.00 . A A . 5 SET HB3 1 1
19 3646 1 1 5 . HNT2 H 4.458 2.185 3.802 1.00 . A A . 5 SET HNT2 1 1
19 3647 1 1 5 . N N 5.593 0.907 6.067 1.00 . A A . 5 SET N 1 1
19 3648 1 1 5 . NT N 3.653 2.448 4.381 1.00 . A A . 5 SET NT 1 1
19 3649 1 1 5 . OG O 3.806 -0.913 3.909 1.00 . A A . 5 SET OG 1 1
19 3650 1 1 6 SER C C 3.265 -4.075 5.442 1.00 . A A . 6 SER C 1 1
19 3651 1 1 6 SER CA C 4.619 -3.348 5.192 1.00 . A A . 6 SER CA 1 1
19 3652 1 1 6 SER CB C 5.799 -4.117 5.835 1.00 . A A . 6 SER CB 1 1
19 3653 1 1 6 SER H H 4.918 -1.754 6.699 1.00 . A A . 6 SER H 1 1
19 3654 1 1 6 SER HA H 4.825 -3.285 4.103 1.00 . A A . 6 SER HA 1 1
19 3655 1 1 6 SER HB2 H 5.720 -4.134 6.940 1.00 . A A . 6 SER HB2 1 1
19 3656 1 1 6 SER HB3 H 5.792 -5.177 5.519 1.00 . A A . 6 SER HB3 1 1
19 3657 1 1 6 SER HG H 7.729 -4.075 5.878 1.00 . A A . 6 SER HG 1 1
19 3658 1 1 6 SER N N 4.562 -1.977 5.766 1.00 . A A . 6 SER N 1 1
19 3659 1 1 6 SER O O 2.748 -4.076 6.566 1.00 . A A . 6 SER O 1 1
19 3660 1 1 6 SER OG O 7.048 -3.544 5.457 1.00 . A A . 6 SER OG 1 1
19 3661 1 1 7 GLY C C 0.310 -4.477 3.884 1.00 . A A . 7 GLY C 1 1
19 3662 1 1 7 GLY CA C 1.389 -5.397 4.487 1.00 . A A . 7 GLY CA 1 1
19 3663 1 1 7 GLY H H 3.185 -4.598 3.495 1.00 . A A . 7 GLY H 1 1
19 3664 1 1 7 GLY HA2 H 1.434 -6.339 3.911 1.00 . A A . 7 GLY HA2 1 1
19 3665 1 1 7 GLY HA3 H 1.131 -5.697 5.522 1.00 . A A . 7 GLY HA3 1 1
19 3666 1 1 7 GLY N N 2.705 -4.710 4.395 1.00 . A A . 7 GLY N 1 1
19 3667 1 1 7 GLY O O -0.114 -4.681 2.745 1.00 . A A . 7 GLY O 1 1
19 3668 1 1 8 LYS C C -0.260 -1.246 3.669 1.00 . A A . 8 LYS C 1 1
19 3669 1 1 8 LYS CA C -1.095 -2.445 4.216 1.00 . A A . 8 LYS CA 1 1
19 3670 1 1 8 LYS CB C -1.997 -2.096 5.428 1.00 . A A . 8 LYS CB 1 1
19 3671 1 1 8 LYS CD C -4.008 -0.745 6.328 1.00 . A A . 8 LYS CD 1 1
19 3672 1 1 8 LYS CE C -3.338 0.301 7.242 1.00 . A A . 8 LYS CE 1 1
19 3673 1 1 8 LYS CG C -3.167 -1.141 5.099 1.00 . A A . 8 LYS CG 1 1
19 3674 1 1 8 LYS H H 0.340 -3.388 5.576 1.00 . A A . 8 LYS H 1 1
19 3675 1 1 8 LYS HA H -1.748 -2.856 3.418 1.00 . A A . 8 LYS HA 1 1
19 3676 1 1 8 LYS HB2 H -2.423 -3.026 5.851 1.00 . A A . 8 LYS HB2 1 1
19 3677 1 1 8 LYS HB3 H -1.377 -1.666 6.238 1.00 . A A . 8 LYS HB3 1 1
19 3678 1 1 8 LYS HD2 H -4.971 -0.346 5.960 1.00 . A A . 8 LYS HD2 1 1
19 3679 1 1 8 LYS HD3 H -4.266 -1.657 6.902 1.00 . A A . 8 LYS HD3 1 1
19 3680 1 1 8 LYS HE2 H -2.379 -0.083 7.638 1.00 . A A . 8 LYS HE2 1 1
19 3681 1 1 8 LYS HE3 H -3.083 1.209 6.662 1.00 . A A . 8 LYS HE3 1 1
19 3682 1 1 8 LYS HG2 H -2.799 -0.230 4.589 1.00 . A A . 8 LYS HG2 1 1
19 3683 1 1 8 LYS HG3 H -3.827 -1.634 4.360 1.00 . A A . 8 LYS HG3 1 1
19 3684 1 1 8 LYS HZ1 H -5.112 1.063 8.041 1.00 . A A . 8 LYS HZ1 1 1
19 3685 1 1 8 LYS HZ2 H -4.456 -0.146 8.949 1.00 . A A . 8 LYS HZ2 1 1
19 3686 1 1 8 LYS HZ3 H -3.794 1.364 8.987 1.00 . A A . 8 LYS HZ3 1 1
19 3687 1 1 8 LYS N N -0.111 -3.460 4.661 1.00 . A A . 8 LYS N 1 1
19 3688 1 1 8 LYS NZ N -4.223 0.666 8.366 1.00 . A A . 8 LYS NZ 1 1
19 3689 1 1 8 LYS O O 0.087 -0.317 4.406 1.00 . A A . 8 LYS O 1 1
19 3690 1 1 9 LEU C C 0.034 1.023 1.383 1.00 . A A . 9 LEU C 1 1
19 3691 1 1 9 LEU CA C 0.871 -0.256 1.678 1.00 . A A . 9 LEU CA 1 1
19 3692 1 1 9 LEU CB C 1.512 -0.836 0.377 1.00 . A A . 9 LEU CB 1 1
19 3693 1 1 9 LEU CD1 C 2.606 -3.046 1.208 1.00 . A A . 9 LEU CD1 1 1
19 3694 1 1 9 LEU CD2 C 3.491 -1.896 -0.836 1.00 . A A . 9 LEU CD2 1 1
19 3695 1 1 9 LEU CG C 2.810 -1.680 0.531 1.00 . A A . 9 LEU CG 1 1
19 3696 1 1 9 LEU H H -0.130 -2.205 1.929 1.00 . A A . 9 LEU H 1 1
19 3697 1 1 9 LEU HA H 1.720 0.019 2.341 1.00 . A A . 9 LEU HA 1 1
19 3698 1 1 9 LEU HB2 H 0.758 -1.392 -0.213 1.00 . A A . 9 LEU HB2 1 1
19 3699 1 1 9 LEU HB3 H 1.776 0.022 -0.273 1.00 . A A . 9 LEU HB3 1 1
19 3700 1 1 9 LEU HD11 H 3.550 -3.623 1.266 1.00 . A A . 9 LEU HD11 1 1
19 3701 1 1 9 LEU HD12 H 2.256 -2.927 2.248 1.00 . A A . 9 LEU HD12 1 1
19 3702 1 1 9 LEU HD13 H 1.867 -3.674 0.676 1.00 . A A . 9 LEU HD13 1 1
19 3703 1 1 9 LEU HD21 H 4.458 -2.423 -0.735 1.00 . A A . 9 LEU HD21 1 1
19 3704 1 1 9 LEU HD22 H 2.864 -2.495 -1.525 1.00 . A A . 9 LEU HD22 1 1
19 3705 1 1 9 LEU HD23 H 3.708 -0.940 -1.346 1.00 . A A . 9 LEU HD23 1 1
19 3706 1 1 9 LEU HG H 3.506 -1.102 1.163 1.00 . A A . 9 LEU HG 1 1
19 3707 1 1 9 LEU N N 0.057 -1.296 2.362 1.00 . A A . 9 LEU N 1 1
19 3708 1 1 9 LEU O O -0.720 1.087 0.407 1.00 . A A . 9 LEU O 1 1
19 3709 1 1 10 ILE C C 0.554 4.502 2.279 1.00 . A A . 10 ILE C 1 1
19 3710 1 1 10 ILE CA C -0.504 3.350 2.136 1.00 . A A . 10 ILE CA 1 1
19 3711 1 1 10 ILE CB C -1.761 3.390 3.084 1.00 . A A . 10 ILE CB 1 1
19 3712 1 1 10 ILE CD1 C -3.371 4.632 1.447 1.00 . A A . 10 ILE CD1 1 1
19 3713 1 1 10 ILE CG1 C -2.719 4.591 2.838 1.00 . A A . 10 ILE CG1 1 1
19 3714 1 1 10 ILE CG2 C -1.434 3.295 4.599 1.00 . A A . 10 ILE CG2 1 1
19 3715 1 1 10 ILE H H 0.783 1.816 3.064 1.00 . A A . 10 ILE H 1 1
19 3716 1 1 10 ILE HA H -0.886 3.450 1.102 1.00 . A A . 10 ILE HA 1 1
19 3717 1 1 10 ILE HB H -2.359 2.485 2.857 1.00 . A A . 10 ILE HB 1 1
19 3718 1 1 10 ILE HD11 H -4.115 5.447 1.383 1.00 . A A . 10 ILE HD11 1 1
19 3719 1 1 10 ILE HD12 H -2.630 4.808 0.646 1.00 . A A . 10 ILE HD12 1 1
19 3720 1 1 10 ILE HD13 H -3.897 3.686 1.216 1.00 . A A . 10 ILE HD13 1 1
19 3721 1 1 10 ILE HG12 H -3.538 4.567 3.582 1.00 . A A . 10 ILE HG12 1 1
19 3722 1 1 10 ILE HG13 H -2.195 5.548 3.023 1.00 . A A . 10 ILE HG13 1 1
19 3723 1 1 10 ILE HG21 H -0.867 4.171 4.962 1.00 . A A . 10 ILE HG21 1 1
19 3724 1 1 10 ILE HG22 H -2.351 3.225 5.214 1.00 . A A . 10 ILE HG22 1 1
19 3725 1 1 10 ILE HG23 H -0.832 2.399 4.835 1.00 . A A . 10 ILE HG23 1 1
19 3726 1 1 10 ILE N N 0.183 2.029 2.260 1.00 . A A . 10 ILE N 1 1
19 3727 1 1 10 ILE O O 0.408 5.415 3.095 1.00 . A A . 10 ILE O 1 1
19 3728 1 1 11 GLU C C 2.900 5.980 -0.010 1.00 . A A . 11 GLU C 1 1
19 3729 1 1 11 GLU CA C 2.723 5.443 1.450 1.00 . A A . 11 GLU CA 1 1
19 3730 1 1 11 GLU CB C 4.001 4.743 2.015 1.00 . A A . 11 GLU CB 1 1
19 3731 1 1 11 GLU CD C 3.294 3.743 4.364 1.00 . A A . 11 GLU CD 1 1
19 3732 1 1 11 GLU CG C 4.163 4.724 3.554 1.00 . A A . 11 GLU CG 1 1
19 3733 1 1 11 GLU H H 1.619 3.646 0.815 1.00 . A A . 11 GLU H 1 1
19 3734 1 1 11 GLU HA H 2.530 6.286 2.144 1.00 . A A . 11 GLU HA 1 1
19 3735 1 1 11 GLU HB2 H 4.119 3.722 1.604 1.00 . A A . 11 GLU HB2 1 1
19 3736 1 1 11 GLU HB3 H 4.886 5.280 1.628 1.00 . A A . 11 GLU HB3 1 1
19 3737 1 1 11 GLU HG2 H 5.220 4.532 3.804 1.00 . A A . 11 GLU HG2 1 1
19 3738 1 1 11 GLU HG3 H 3.995 5.748 3.943 1.00 . A A . 11 GLU HG3 1 1
19 3739 1 1 11 GLU N N 1.612 4.457 1.442 1.00 . A A . 11 GLU N 1 1
19 3740 1 1 11 GLU O O 3.822 5.553 -0.715 1.00 . A A . 11 GLU O 1 1
19 3741 1 1 11 GLU OE1 O 2.345 4.181 5.018 1.00 . A A . 11 GLU OE1 1 1
19 3742 1 1 12 THR C C 3.248 8.583 -1.948 1.00 . A A . 12 THR C 1 1
19 3743 1 1 12 THR CA C 2.146 7.478 -1.872 1.00 . A A . 12 THR CA 1 1
19 3744 1 1 12 THR CB C 0.766 7.919 -2.466 1.00 . A A . 12 THR CB 1 1
19 3745 1 1 12 THR CG2 C 0.802 8.306 -3.963 1.00 . A A . 12 THR CG2 1 1
19 3746 1 1 12 THR H H 1.198 7.076 0.091 1.00 . A A . 12 THR H 1 1
19 3747 1 1 12 THR HA H 2.486 6.658 -2.537 1.00 . A A . 12 THR HA 1 1
19 3748 1 1 12 THR HB H 0.381 8.792 -1.904 1.00 . A A . 12 THR HB 1 1
19 3749 1 1 12 THR HG1 H 0.129 6.155 -2.907 1.00 . A A . 12 THR HG1 1 1
19 3750 1 1 12 THR HG21 H 1.460 9.174 -4.157 1.00 . A A . 12 THR HG21 1 1
19 3751 1 1 12 THR HG22 H 1.161 7.480 -4.605 1.00 . A A . 12 THR HG22 1 1
19 3752 1 1 12 THR HG23 H -0.201 8.587 -4.339 1.00 . A A . 12 THR HG23 1 1
19 3753 1 1 12 THR N N 2.034 6.912 -0.486 1.00 . A A . 12 THR N 1 1
19 3754 1 1 12 THR O O 4.245 8.381 -2.647 1.00 . A A . 12 THR O 1 1
19 3755 1 1 12 THR OG1 O -0.184 6.864 -2.341 1.00 . A A . 12 THR OG1 1 1
19 3756 1 1 13 THR C C 4.084 11.433 0.184 1.00 . A A . 13 THR C 1 1
19 3757 1 1 13 THR CA C 4.056 10.845 -1.258 1.00 . A A . 13 THR CA 1 1
19 3758 1 1 13 THR CB C 3.692 11.906 -2.346 1.00 . A A . 13 THR CB 1 1
19 3759 1 1 13 THR CG2 C 4.706 13.056 -2.458 1.00 . A A . 13 THR CG2 1 1
19 3760 1 1 13 THR H H 2.184 9.801 -0.749 1.00 . A A . 13 THR H 1 1
19 3761 1 1 13 THR HA H 5.063 10.453 -1.509 1.00 . A A . 13 THR HA 1 1
19 3762 1 1 13 THR HB H 2.699 12.341 -2.120 1.00 . A A . 13 THR HB 1 1
19 3763 1 1 13 THR HG1 H 4.472 10.879 -3.779 1.00 . A A . 13 THR HG1 1 1
19 3764 1 1 13 THR HG21 H 4.418 13.765 -3.255 1.00 . A A . 13 THR HG21 1 1
19 3765 1 1 13 THR HG22 H 4.771 13.636 -1.519 1.00 . A A . 13 THR HG22 1 1
19 3766 1 1 13 THR HG23 H 5.721 12.686 -2.692 1.00 . A A . 13 THR HG23 1 1
19 3767 1 1 13 THR N N 3.071 9.729 -1.256 1.00 . A A . 13 THR N 1 1
19 3768 1 1 13 THR O O 3.119 12.070 0.621 1.00 . A A . 13 THR O 1 1
19 3769 1 1 13 THR OG1 O 3.622 11.301 -3.634 1.00 . A A . 13 THR OG1 1 1
19 3770 1 1 14 ALA C C 6.191 13.040 2.301 1.00 . A A . 14 ALA C 1 1
19 3771 1 1 14 ALA CA C 5.380 11.725 2.292 1.00 . A A . 14 ALA CA 1 1
19 3772 1 1 14 ALA CB C 6.028 10.629 3.156 1.00 . A A . 14 ALA CB 1 1
19 3773 1 1 14 ALA H H 5.925 10.668 0.435 1.00 . A A . 14 ALA H 1 1
19 3774 1 1 14 ALA HXT H 7.950 13.723 1.855 1.00 . A A . 14 ALA HXT 1 1
19 3775 1 1 14 ALA HA H 4.396 11.942 2.753 1.00 . A A . 14 ALA HA 1 1
19 3776 1 1 14 ALA HB1 H 6.162 10.963 4.203 1.00 . A A . 14 ALA HB1 1 1
19 3777 1 1 14 ALA HB2 H 5.405 9.717 3.194 1.00 . A A . 14 ALA HB2 1 1
19 3778 1 1 14 ALA HB3 H 7.026 10.330 2.781 1.00 . A A . 14 ALA HB3 1 1
19 3779 1 1 14 ALA N N 5.201 11.222 0.906 1.00 . A A . 14 ALA N 1 1
19 3780 1 1 14 ALA O O 5.724 14.112 2.686 1.00 . A A . 14 ALA O 1 1
19 3781 1 1 14 ALA OXT O 7.475 12.889 1.838 1.00 . A A . 14 ALA OXT 1 1
20 3782 1 1 1 ACE C C 9.389 4.199 -0.274 1.00 . A A . 1 ACE C 1 1
20 3783 1 1 1 ACE CH3 C 10.464 4.718 -1.224 1.00 . A A . 1 ACE CH3 1 1
20 3784 1 1 1 ACE H1 H 11.063 5.519 -0.754 1.00 . A A . 1 ACE H1 1 1
20 3785 1 1 1 ACE H2 H 11.151 3.911 -1.540 1.00 . A A . 1 ACE H2 1 1
20 3786 1 1 1 ACE H3 H 10.011 5.142 -2.139 1.00 . A A . 1 ACE H3 1 1
20 3787 1 1 1 ACE O O 8.197 4.285 -0.575 1.00 . A A . 1 ACE O 1 1
20 3788 1 1 2 ILE C C 9.116 4.017 3.168 1.00 . A A . 2 ILE C 1 1
20 3789 1 1 2 ILE CA C 8.942 3.106 1.921 1.00 . A A . 2 ILE CA 1 1
20 3790 1 1 2 ILE CB C 9.173 1.575 2.201 1.00 . A A . 2 ILE CB 1 1
20 3791 1 1 2 ILE CD1 C 7.660 0.620 0.246 1.00 . A A . 2 ILE CD1 1 1
20 3792 1 1 2 ILE CG1 C 9.024 0.637 0.961 1.00 . A A . 2 ILE CG1 1 1
20 3793 1 1 2 ILE CG2 C 8.297 1.029 3.361 1.00 . A A . 2 ILE CG2 1 1
20 3794 1 1 2 ILE H H 10.854 3.758 1.008 1.00 . A A . 2 ILE H 1 1
20 3795 1 1 2 ILE HA H 7.897 3.205 1.583 1.00 . A A . 2 ILE HA 1 1
20 3796 1 1 2 ILE HB H 10.221 1.465 2.539 1.00 . A A . 2 ILE HB 1 1
20 3797 1 1 2 ILE HD11 H 7.401 1.612 -0.169 1.00 . A A . 2 ILE HD11 1 1
20 3798 1 1 2 ILE HD12 H 7.664 -0.091 -0.599 1.00 . A A . 2 ILE HD12 1 1
20 3799 1 1 2 ILE HD13 H 6.841 0.316 0.923 1.00 . A A . 2 ILE HD13 1 1
20 3800 1 1 2 ILE HG12 H 9.800 0.895 0.215 1.00 . A A . 2 ILE HG12 1 1
20 3801 1 1 2 ILE HG13 H 9.272 -0.402 1.256 1.00 . A A . 2 ILE HG13 1 1
20 3802 1 1 2 ILE HG21 H 8.467 -0.050 3.541 1.00 . A A . 2 ILE HG21 1 1
20 3803 1 1 2 ILE HG22 H 8.513 1.539 4.318 1.00 . A A . 2 ILE HG22 1 1
20 3804 1 1 2 ILE HG23 H 7.216 1.160 3.164 1.00 . A A . 2 ILE HG23 1 1
20 3805 1 1 2 ILE N N 9.843 3.657 0.866 1.00 . A A . 2 ILE N 1 1
20 3806 1 1 2 ILE O O 10.211 4.120 3.732 1.00 . A A . 2 ILE O 1 1
20 3807 1 1 3 TRP C C 7.048 5.047 5.890 1.00 . A A . 3 TRP C 1 1
20 3808 1 1 3 TRP CA C 8.000 5.577 4.770 1.00 . A A . 3 TRP CA 1 1
20 3809 1 1 3 TRP CB C 7.665 7.028 4.301 1.00 . A A . 3 TRP CB 1 1
20 3810 1 1 3 TRP CD1 C 9.750 7.839 2.903 1.00 . A A . 3 TRP CD1 1 1
20 3811 1 1 3 TRP CD2 C 7.879 7.542 1.748 1.00 . A A . 3 TRP CD2 1 1
20 3812 1 1 3 TRP CE2 C 8.926 7.906 0.865 1.00 . A A . 3 TRP CE2 1 1
20 3813 1 1 3 TRP CE3 C 6.609 7.171 1.245 1.00 . A A . 3 TRP CE3 1 1
20 3814 1 1 3 TRP CG C 8.383 7.531 3.034 1.00 . A A . 3 TRP CG 1 1
20 3815 1 1 3 TRP CH2 C 7.419 7.624 -1.007 1.00 . A A . 3 TRP CH2 1 1
20 3816 1 1 3 TRP CZ2 C 8.692 7.948 -0.531 1.00 . A A . 3 TRP CZ2 1 1
20 3817 1 1 3 TRP CZ3 C 6.395 7.239 -0.133 1.00 . A A . 3 TRP CZ3 1 1
20 3818 1 1 3 TRP H H 7.165 4.475 3.040 1.00 . A A . 3 TRP H 1 1
20 3819 1 1 3 TRP HA H 9.010 5.635 5.223 1.00 . A A . 3 TRP HA 1 1
20 3820 1 1 3 TRP HB2 H 6.573 7.119 4.144 1.00 . A A . 3 TRP HB2 1 1
20 3821 1 1 3 TRP HB3 H 7.874 7.731 5.129 1.00 . A A . 3 TRP HB3 1 1
20 3822 1 1 3 TRP HD1 H 10.461 7.726 3.705 1.00 . A A . 3 TRP HD1 1 1
20 3823 1 1 3 TRP HE1 H 11.037 8.296 1.186 1.00 . A A . 3 TRP HE1 1 1
20 3824 1 1 3 TRP HE3 H 5.845 6.805 1.920 1.00 . A A . 3 TRP HE3 1 1
20 3825 1 1 3 TRP HH2 H 7.226 7.652 -2.070 1.00 . A A . 3 TRP HH2 1 1
20 3826 1 1 3 TRP HZ2 H 9.482 8.214 -1.218 1.00 . A A . 3 TRP HZ2 1 1
20 3827 1 1 3 TRP HZ3 H 5.433 6.970 -0.536 1.00 . A A . 3 TRP HZ3 1 1
20 3828 1 1 3 TRP N N 8.006 4.644 3.601 1.00 . A A . 3 TRP N 1 1
20 3829 1 1 3 TRP NE1 N 10.103 8.109 1.566 1.00 . A A . 3 TRP NE1 1 1
20 3830 1 1 3 TRP O O 6.103 5.716 6.320 1.00 . A A . 3 TRP O 1 1
20 3831 1 1 4 GLY C C 5.255 2.464 6.931 1.00 . A A . 4 GLY C 1 1
20 3832 1 1 4 GLY CA C 6.553 3.145 7.420 1.00 . A A . 4 GLY CA 1 1
20 3833 1 1 4 GLY H H 8.058 3.363 5.798 1.00 . A A . 4 GLY H 1 1
20 3834 1 1 4 GLY HA2 H 7.195 2.385 7.904 1.00 . A A . 4 GLY HA2 1 1
20 3835 1 1 4 GLY HA3 H 6.311 3.857 8.233 1.00 . A A . 4 GLY HA3 1 1
20 3836 1 1 4 GLY N N 7.341 3.826 6.366 1.00 . A A . 4 GLY N 1 1
20 3837 1 1 4 GLY O O 4.166 2.878 7.336 1.00 . A A . 4 GLY O 1 1
20 3838 1 1 5 . C C 3.371 1.461 4.489 1.00 . A A . 5 SET C 1 1
20 3839 1 1 5 . CA C 4.204 0.677 5.544 1.00 . A A . 5 SET CA 1 1
20 3840 1 1 5 . CB C 4.663 -0.729 5.047 1.00 . A A . 5 SET CB 1 1
20 3841 1 1 5 . H H 6.330 1.194 5.797 1.00 . A A . 5 SET H 1 1
20 3842 1 1 5 . HA H 3.507 0.539 6.397 1.00 . A A . 5 SET HA 1 1
20 3843 1 1 5 . HB2 H 2.501 0.838 4.220 1.00 . A A . 5 SET HB2 1 1
20 3844 1 1 5 . HB3 H 2.908 2.339 4.981 1.00 . A A . 5 SET HB3 1 1
20 3845 1 1 5 . HNT2 H 4.121 1.214 2.438 1.00 . A A . 5 SET HNT2 1 1
20 3846 1 1 5 . N N 5.374 1.423 6.083 1.00 . A A . 5 SET N 1 1
20 3847 1 1 5 . NT N 4.043 1.868 3.226 1.00 . A A . 5 SET NT 1 1
20 3848 1 1 5 . OG O 5.505 -0.838 4.148 1.00 . A A . 5 SET OG 1 1
20 3849 1 1 6 SER C C 3.082 -4.009 5.424 1.00 . A A . 6 SER C 1 1
20 3850 1 1 6 SER CA C 4.412 -3.211 5.295 1.00 . A A . 6 SER CA 1 1
20 3851 1 1 6 SER CB C 5.505 -3.792 6.222 1.00 . A A . 6 SER CB 1 1
20 3852 1 1 6 SER H H 3.372 -1.579 6.330 1.00 . A A . 6 SER H 1 1
20 3853 1 1 6 SER HA H 4.785 -3.270 4.253 1.00 . A A . 6 SER HA 1 1
20 3854 1 1 6 SER HB2 H 5.221 -3.697 7.288 1.00 . A A . 6 SER HB2 1 1
20 3855 1 1 6 SER HB3 H 5.628 -4.876 6.036 1.00 . A A . 6 SER HB3 1 1
20 3856 1 1 6 SER HG H 7.381 -3.555 6.610 1.00 . A A . 6 SER HG 1 1
20 3857 1 1 6 SER N N 4.098 -1.796 5.642 1.00 . A A . 6 SER N 1 1
20 3858 1 1 6 SER O O 2.450 -4.005 6.489 1.00 . A A . 6 SER O 1 1
20 3859 1 1 6 SER OG O 6.757 -3.150 6.003 1.00 . A A . 6 SER OG 1 1
20 3860 1 1 7 GLY C C 0.277 -4.554 3.754 1.00 . A A . 7 GLY C 1 1
20 3861 1 1 7 GLY CA C 1.378 -5.460 4.340 1.00 . A A . 7 GLY CA 1 1
20 3862 1 1 7 GLY H H 3.262 -4.643 3.519 1.00 . A A . 7 GLY H 1 1
20 3863 1 1 7 GLY HA2 H 1.492 -6.359 3.707 1.00 . A A . 7 GLY HA2 1 1
20 3864 1 1 7 GLY HA3 H 1.102 -5.840 5.344 1.00 . A A . 7 GLY HA3 1 1
20 3865 1 1 7 GLY N N 2.661 -4.703 4.349 1.00 . A A . 7 GLY N 1 1
20 3866 1 1 7 GLY O O -0.090 -4.695 2.584 1.00 . A A . 7 GLY O 1 1
20 3867 1 1 8 LYS C C -0.361 -1.408 3.688 1.00 . A A . 8 LYS C 1 1
20 3868 1 1 8 LYS CA C -1.232 -2.609 4.173 1.00 . A A . 8 LYS CA 1 1
20 3869 1 1 8 LYS CB C -2.136 -2.292 5.391 1.00 . A A . 8 LYS CB 1 1
20 3870 1 1 8 LYS CD C -4.111 -0.913 6.326 1.00 . A A . 8 LYS CD 1 1
20 3871 1 1 8 LYS CE C -3.418 0.131 7.224 1.00 . A A . 8 LYS CE 1 1
20 3872 1 1 8 LYS CG C -3.294 -1.317 5.083 1.00 . A A . 8 LYS CG 1 1
20 3873 1 1 8 LYS H H 0.218 -3.561 5.500 1.00 . A A . 8 LYS H 1 1
20 3874 1 1 8 LYS HA H -1.873 -2.998 3.355 1.00 . A A . 8 LYS HA 1 1
20 3875 1 1 8 LYS HB2 H -2.569 -3.231 5.784 1.00 . A A . 8 LYS HB2 1 1
20 3876 1 1 8 LYS HB3 H -1.516 -1.891 6.217 1.00 . A A . 8 LYS HB3 1 1
20 3877 1 1 8 LYS HD2 H -5.079 -0.509 5.975 1.00 . A A . 8 LYS HD2 1 1
20 3878 1 1 8 LYS HD3 H -4.364 -1.822 6.908 1.00 . A A . 8 LYS HD3 1 1
20 3879 1 1 8 LYS HE2 H -2.452 -0.258 7.603 1.00 . A A . 8 LYS HE2 1 1
20 3880 1 1 8 LYS HE3 H -3.167 1.037 6.637 1.00 . A A . 8 LYS HE3 1 1
20 3881 1 1 8 LYS HG2 H -2.919 -0.409 4.573 1.00 . A A . 8 LYS HG2 1 1
20 3882 1 1 8 LYS HG3 H -3.972 -1.797 4.351 1.00 . A A . 8 LYS HG3 1 1
20 3883 1 1 8 LYS HZ1 H -3.832 1.200 8.975 1.00 . A A . 8 LYS HZ1 1 1
20 3884 1 1 8 LYS HZ2 H -5.171 0.904 8.057 1.00 . A A . 8 LYS HZ2 1 1
20 3885 1 1 8 LYS HZ3 H -4.503 -0.306 8.954 1.00 . A A . 8 LYS HZ3 1 1
20 3886 1 1 8 LYS N N -0.232 -3.622 4.585 1.00 . A A . 8 LYS N 1 1
20 3887 1 1 8 LYS NZ N -4.277 0.504 8.366 1.00 . A A . 8 LYS NZ 1 1
20 3888 1 1 8 LYS O O 0.049 -0.544 4.472 1.00 . A A . 8 LYS O 1 1
20 3889 1 1 9 LEU C C 0.105 0.997 1.535 1.00 . A A . 9 LEU C 1 1
20 3890 1 1 9 LEU CA C 0.797 -0.382 1.738 1.00 . A A . 9 LEU CA 1 1
20 3891 1 1 9 LEU CB C 1.403 -0.935 0.412 1.00 . A A . 9 LEU CB 1 1
20 3892 1 1 9 LEU CD1 C 2.789 -2.649 -0.860 1.00 . A A . 9 LEU CD1 1 1
20 3893 1 1 9 LEU CD2 C 3.811 -1.532 1.151 1.00 . A A . 9 LEU CD2 1 1
20 3894 1 1 9 LEU CG C 2.496 -2.042 0.525 1.00 . A A . 9 LEU CG 1 1
20 3895 1 1 9 LEU H H -0.439 -2.225 1.886 1.00 . A A . 9 LEU H 1 1
20 3896 1 1 9 LEU HA H 1.668 -0.228 2.406 1.00 . A A . 9 LEU HA 1 1
20 3897 1 1 9 LEU HB2 H 0.573 -1.294 -0.228 1.00 . A A . 9 LEU HB2 1 1
20 3898 1 1 9 LEU HB3 H 1.840 -0.095 -0.163 1.00 . A A . 9 LEU HB3 1 1
20 3899 1 1 9 LEU HD11 H 3.531 -3.466 -0.801 1.00 . A A . 9 LEU HD11 1 1
20 3900 1 1 9 LEU HD12 H 1.879 -3.082 -1.315 1.00 . A A . 9 LEU HD12 1 1
20 3901 1 1 9 LEU HD13 H 3.184 -1.897 -1.570 1.00 . A A . 9 LEU HD13 1 1
20 3902 1 1 9 LEU HD21 H 4.580 -2.325 1.194 1.00 . A A . 9 LEU HD21 1 1
20 3903 1 1 9 LEU HD22 H 4.244 -0.686 0.584 1.00 . A A . 9 LEU HD22 1 1
20 3904 1 1 9 LEU HD23 H 3.666 -1.190 2.190 1.00 . A A . 9 LEU HD23 1 1
20 3905 1 1 9 LEU HG H 2.123 -2.865 1.163 1.00 . A A . 9 LEU HG 1 1
20 3906 1 1 9 LEU N N -0.071 -1.404 2.376 1.00 . A A . 9 LEU N 1 1
20 3907 1 1 9 LEU O O -0.635 1.212 0.570 1.00 . A A . 9 LEU O 1 1
20 3908 1 1 10 ILE C C 1.126 4.243 2.370 1.00 . A A . 10 ILE C 1 1
20 3909 1 1 10 ILE CA C -0.133 3.314 2.461 1.00 . A A . 10 ILE CA 1 1
20 3910 1 1 10 ILE CB C -1.148 3.564 3.638 1.00 . A A . 10 ILE CB 1 1
20 3911 1 1 10 ILE CD1 C -2.697 5.237 2.357 1.00 . A A . 10 ILE CD1 1 1
20 3912 1 1 10 ILE CG1 C -1.836 4.959 3.600 1.00 . A A . 10 ILE CG1 1 1
20 3913 1 1 10 ILE CG2 C -0.585 3.315 5.064 1.00 . A A . 10 ILE CG2 1 1
20 3914 1 1 10 ILE H H 0.952 1.572 3.254 1.00 . A A . 10 ILE H 1 1
20 3915 1 1 10 ILE HA H -0.709 3.479 1.528 1.00 . A A . 10 ILE HA 1 1
20 3916 1 1 10 ILE HB H -1.960 2.820 3.511 1.00 . A A . 10 ILE HB 1 1
20 3917 1 1 10 ILE HD11 H -3.227 6.202 2.450 1.00 . A A . 10 ILE HD11 1 1
20 3918 1 1 10 ILE HD12 H -2.087 5.295 1.435 1.00 . A A . 10 ILE HD12 1 1
20 3919 1 1 10 ILE HD13 H -3.461 4.454 2.204 1.00 . A A . 10 ILE HD13 1 1
20 3920 1 1 10 ILE HG12 H -2.494 5.070 4.483 1.00 . A A . 10 ILE HG12 1 1
20 3921 1 1 10 ILE HG13 H -1.080 5.761 3.705 1.00 . A A . 10 ILE HG13 1 1
20 3922 1 1 10 ILE HG21 H 0.211 4.031 5.334 1.00 . A A . 10 ILE HG21 1 1
20 3923 1 1 10 ILE HG22 H -1.372 3.402 5.837 1.00 . A A . 10 ILE HG22 1 1
20 3924 1 1 10 ILE HG23 H -0.159 2.300 5.169 1.00 . A A . 10 ILE HG23 1 1
20 3925 1 1 10 ILE N N 0.375 1.914 2.479 1.00 . A A . 10 ILE N 1 1
20 3926 1 1 10 ILE O O 1.494 4.939 3.320 1.00 . A A . 10 ILE O 1 1
20 3927 1 1 11 GLU C C 2.695 6.088 -0.189 1.00 . A A . 11 GLU C 1 1
20 3928 1 1 11 GLU CA C 3.009 5.012 0.904 1.00 . A A . 11 GLU CA 1 1
20 3929 1 1 11 GLU CB C 4.118 3.972 0.521 1.00 . A A . 11 GLU CB 1 1
20 3930 1 1 11 GLU CD C 4.490 3.122 3.024 1.00 . A A . 11 GLU CD 1 1
20 3931 1 1 11 GLU CG C 5.077 3.497 1.646 1.00 . A A . 11 GLU CG 1 1
20 3932 1 1 11 GLU H H 1.366 3.602 0.490 1.00 . A A . 11 GLU H 1 1
20 3933 1 1 11 GLU HA H 3.396 5.529 1.808 1.00 . A A . 11 GLU HA 1 1
20 3934 1 1 11 GLU HB2 H 3.689 3.087 0.011 1.00 . A A . 11 GLU HB2 1 1
20 3935 1 1 11 GLU HB3 H 4.778 4.407 -0.254 1.00 . A A . 11 GLU HB3 1 1
20 3936 1 1 11 GLU HG2 H 5.696 2.667 1.262 1.00 . A A . 11 GLU HG2 1 1
20 3937 1 1 11 GLU HG3 H 5.804 4.315 1.812 1.00 . A A . 11 GLU HG3 1 1
20 3938 1 1 11 GLU N N 1.775 4.232 1.189 1.00 . A A . 11 GLU N 1 1
20 3939 1 1 11 GLU O O 3.158 5.971 -1.329 1.00 . A A . 11 GLU O 1 1
20 3940 1 1 11 GLU OE1 O 4.449 3.994 3.897 1.00 . A A . 11 GLU OE1 1 1
20 3941 1 1 12 THR C C 2.498 9.466 -0.583 1.00 . A A . 12 THR C 1 1
20 3942 1 1 12 THR CA C 1.557 8.240 -0.807 1.00 . A A . 12 THR CA 1 1
20 3943 1 1 12 THR CB C 0.028 8.581 -0.791 1.00 . A A . 12 THR CB 1 1
20 3944 1 1 12 THR CG2 C -0.416 9.551 -1.907 1.00 . A A . 12 THR CG2 1 1
20 3945 1 1 12 THR H H 1.438 7.056 1.061 1.00 . A A . 12 THR H 1 1
20 3946 1 1 12 THR HA H 1.753 7.887 -1.839 1.00 . A A . 12 THR HA 1 1
20 3947 1 1 12 THR HB H -0.246 9.039 0.179 1.00 . A A . 12 THR HB 1 1
20 3948 1 1 12 THR HG1 H -1.659 7.678 -1.009 1.00 . A A . 12 THR HG1 1 1
20 3949 1 1 12 THR HG21 H 0.090 10.532 -1.836 1.00 . A A . 12 THR HG21 1 1
20 3950 1 1 12 THR HG22 H -0.205 9.151 -2.917 1.00 . A A . 12 THR HG22 1 1
20 3951 1 1 12 THR HG23 H -1.503 9.756 -1.864 1.00 . A A . 12 THR HG23 1 1
20 3952 1 1 12 THR N N 1.912 7.142 0.152 1.00 . A A . 12 THR N 1 1
20 3953 1 1 12 THR O O 3.302 9.774 -1.467 1.00 . A A . 12 THR O 1 1
20 3954 1 1 12 THR OG1 O -0.743 7.394 -0.954 1.00 . A A . 12 THR OG1 1 1
20 3955 1 1 13 THR C C 4.709 10.903 1.260 1.00 . A A . 13 THR C 1 1
20 3956 1 1 13 THR CA C 3.254 11.341 0.897 1.00 . A A . 13 THR CA 1 1
20 3957 1 1 13 THR CB C 2.604 12.201 2.030 1.00 . A A . 13 THR CB 1 1
20 3958 1 1 13 THR CG2 C 3.279 13.566 2.254 1.00 . A A . 13 THR CG2 1 1
20 3959 1 1 13 THR H H 1.670 9.818 1.207 1.00 . A A . 13 THR H 1 1
20 3960 1 1 13 THR HA H 3.272 11.981 -0.011 1.00 . A A . 13 THR HA 1 1
20 3961 1 1 13 THR HB H 2.645 11.650 2.991 1.00 . A A . 13 THR HB 1 1
20 3962 1 1 13 THR HG1 H 1.239 13.033 0.954 1.00 . A A . 13 THR HG1 1 1
20 3963 1 1 13 THR HG21 H 2.765 14.144 3.044 1.00 . A A . 13 THR HG21 1 1
20 3964 1 1 13 THR HG22 H 4.333 13.458 2.572 1.00 . A A . 13 THR HG22 1 1
20 3965 1 1 13 THR HG23 H 3.273 14.186 1.338 1.00 . A A . 13 THR HG23 1 1
20 3966 1 1 13 THR N N 2.408 10.152 0.579 1.00 . A A . 13 THR N 1 1
20 3967 1 1 13 THR O O 4.918 10.029 2.111 1.00 . A A . 13 THR O 1 1
20 3968 1 1 13 THR OG1 O 1.236 12.476 1.735 1.00 . A A . 13 THR OG1 1 1
20 3969 1 1 14 ALA C C 7.697 11.854 2.154 1.00 . A A . 14 ALA C 1 1
20 3970 1 1 14 ALA CA C 7.138 11.245 0.847 1.00 . A A . 14 ALA CA 1 1
20 3971 1 1 14 ALA CB C 7.946 11.681 -0.387 1.00 . A A . 14 ALA CB 1 1
20 3972 1 1 14 ALA H H 5.398 12.243 -0.068 1.00 . A A . 14 ALA H 1 1
20 3973 1 1 14 ALA HXT H 7.937 13.565 3.029 1.00 . A A . 14 ALA HXT 1 1
20 3974 1 1 14 ALA HA H 7.252 10.151 0.926 1.00 . A A . 14 ALA HA 1 1
20 3975 1 1 14 ALA HB1 H 9.016 11.416 -0.282 1.00 . A A . 14 ALA HB1 1 1
20 3976 1 1 14 ALA HB2 H 7.590 11.180 -1.307 1.00 . A A . 14 ALA HB2 1 1
20 3977 1 1 14 ALA HB3 H 7.894 12.771 -0.563 1.00 . A A . 14 ALA HB3 1 1
20 3978 1 1 14 ALA N N 5.703 11.545 0.619 1.00 . A A . 14 ALA N 1 1
20 3979 1 1 14 ALA O O 8.192 11.172 3.051 1.00 . A A . 14 ALA O 1 1
20 3980 1 1 14 ALA OXT O 7.583 13.221 2.207 1.00 . A A . 14 ALA OXT 1 1
21 3981 1 1 1 ACE C C 5.552 8.965 1.602 1.00 . A A . 1 ACE C 1 1
21 3982 1 1 1 ACE CH3 C 5.393 10.402 1.118 1.00 . A A . 1 ACE CH3 1 1
21 3983 1 1 1 ACE H1 H 5.410 11.121 1.958 1.00 . A A . 1 ACE H1 1 1
21 3984 1 1 1 ACE H2 H 6.196 10.679 0.411 1.00 . A A . 1 ACE H2 1 1
21 3985 1 1 1 ACE H3 H 4.429 10.538 0.593 1.00 . A A . 1 ACE H3 1 1
21 3986 1 1 1 ACE O O 4.719 8.110 1.295 1.00 . A A . 1 ACE O 1 1
21 3987 1 1 2 ILE C C 6.810 7.509 4.462 1.00 . A A . 2 ILE C 1 1
21 3988 1 1 2 ILE CA C 6.960 7.382 2.918 1.00 . A A . 2 ILE CA 1 1
21 3989 1 1 2 ILE CB C 8.365 6.850 2.447 1.00 . A A . 2 ILE CB 1 1
21 3990 1 1 2 ILE CD1 C 7.594 5.893 0.101 1.00 . A A . 2 ILE CD1 1 1
21 3991 1 1 2 ILE CG1 C 8.576 6.768 0.901 1.00 . A A . 2 ILE CG1 1 1
21 3992 1 1 2 ILE CG2 C 8.745 5.488 3.087 1.00 . A A . 2 ILE CG2 1 1
21 3993 1 1 2 ILE H H 7.143 9.575 2.635 1.00 . A A . 2 ILE H 1 1
21 3994 1 1 2 ILE HA H 6.212 6.650 2.565 1.00 . A A . 2 ILE HA 1 1
21 3995 1 1 2 ILE HB H 9.120 7.572 2.815 1.00 . A A . 2 ILE HB 1 1
21 3996 1 1 2 ILE HD11 H 6.554 6.258 0.186 1.00 . A A . 2 ILE HD11 1 1
21 3997 1 1 2 ILE HD12 H 7.848 5.893 -0.975 1.00 . A A . 2 ILE HD12 1 1
21 3998 1 1 2 ILE HD13 H 7.609 4.840 0.435 1.00 . A A . 2 ILE HD13 1 1
21 3999 1 1 2 ILE HG12 H 8.549 7.789 0.477 1.00 . A A . 2 ILE HG12 1 1
21 4000 1 1 2 ILE HG13 H 9.605 6.418 0.687 1.00 . A A . 2 ILE HG13 1 1
21 4001 1 1 2 ILE HG21 H 9.747 5.145 2.766 1.00 . A A . 2 ILE HG21 1 1
21 4002 1 1 2 ILE HG22 H 8.780 5.545 4.191 1.00 . A A . 2 ILE HG22 1 1
21 4003 1 1 2 ILE HG23 H 8.026 4.689 2.828 1.00 . A A . 2 ILE HG23 1 1
21 4004 1 1 2 ILE N N 6.636 8.728 2.355 1.00 . A A . 2 ILE N 1 1
21 4005 1 1 2 ILE O O 7.567 8.240 5.110 1.00 . A A . 2 ILE O 1 1
21 4006 1 1 3 TRP C C 5.639 5.446 7.270 1.00 . A A . 3 TRP C 1 1
21 4007 1 1 3 TRP CA C 5.548 6.808 6.502 1.00 . A A . 3 TRP CA 1 1
21 4008 1 1 3 TRP CB C 4.134 7.447 6.676 1.00 . A A . 3 TRP CB 1 1
21 4009 1 1 3 TRP CD1 C 4.632 9.990 6.302 1.00 . A A . 3 TRP CD1 1 1
21 4010 1 1 3 TRP CD2 C 3.132 9.121 4.915 1.00 . A A . 3 TRP CD2 1 1
21 4011 1 1 3 TRP CE2 C 3.346 10.484 4.588 1.00 . A A . 3 TRP CE2 1 1
21 4012 1 1 3 TRP CE3 C 2.335 8.298 4.081 1.00 . A A . 3 TRP CE3 1 1
21 4013 1 1 3 TRP CG C 3.908 8.819 6.017 1.00 . A A . 3 TRP CG 1 1
21 4014 1 1 3 TRP CH2 C 1.918 10.227 2.654 1.00 . A A . 3 TRP CH2 1 1
21 4015 1 1 3 TRP CZ2 C 2.725 11.044 3.448 1.00 . A A . 3 TRP CZ2 1 1
21 4016 1 1 3 TRP CZ3 C 1.737 8.871 2.958 1.00 . A A . 3 TRP CZ3 1 1
21 4017 1 1 3 TRP H H 5.219 6.291 4.371 1.00 . A A . 3 TRP H 1 1
21 4018 1 1 3 TRP HA H 6.266 7.473 7.022 1.00 . A A . 3 TRP HA 1 1
21 4019 1 1 3 TRP HB2 H 3.364 6.735 6.320 1.00 . A A . 3 TRP HB2 1 1
21 4020 1 1 3 TRP HB3 H 3.915 7.564 7.753 1.00 . A A . 3 TRP HB3 1 1
21 4021 1 1 3 TRP HD1 H 5.475 9.997 6.976 1.00 . A A . 3 TRP HD1 1 1
21 4022 1 1 3 TRP HE1 H 4.701 11.981 5.386 1.00 . A A . 3 TRP HE1 1 1
21 4023 1 1 3 TRP HE3 H 2.223 7.245 4.293 1.00 . A A . 3 TRP HE3 1 1
21 4024 1 1 3 TRP HH2 H 1.446 10.647 1.781 1.00 . A A . 3 TRP HH2 1 1
21 4025 1 1 3 TRP HZ2 H 2.892 12.076 3.177 1.00 . A A . 3 TRP HZ2 1 1
21 4026 1 1 3 TRP HZ3 H 1.129 8.256 2.309 1.00 . A A . 3 TRP HZ3 1 1
21 4027 1 1 3 TRP N N 5.847 6.762 5.034 1.00 . A A . 3 TRP N 1 1
21 4028 1 1 3 TRP NE1 N 4.276 11.049 5.447 1.00 . A A . 3 TRP NE1 1 1
21 4029 1 1 3 TRP O O 5.037 5.306 8.341 1.00 . A A . 3 TRP O 1 1
21 4030 1 1 4 GLY C C 5.307 2.250 7.157 1.00 . A A . 4 GLY C 1 1
21 4031 1 1 4 GLY CA C 6.545 3.128 7.430 1.00 . A A . 4 GLY CA 1 1
21 4032 1 1 4 GLY H H 6.885 4.710 5.903 1.00 . A A . 4 GLY H 1 1
21 4033 1 1 4 GLY HA2 H 7.468 2.635 7.073 1.00 . A A . 4 GLY HA2 1 1
21 4034 1 1 4 GLY HA3 H 6.685 3.240 8.522 1.00 . A A . 4 GLY HA3 1 1
21 4035 1 1 4 GLY N N 6.416 4.457 6.779 1.00 . A A . 4 GLY N 1 1
21 4036 1 1 4 GLY O O 4.338 2.304 7.920 1.00 . A A . 4 GLY O 1 1
21 4037 1 1 5 . C C 3.258 1.322 4.672 1.00 . A A . 5 SET C 1 1
21 4038 1 1 5 . CA C 4.208 0.583 5.667 1.00 . A A . 5 SET CA 1 1
21 4039 1 1 5 . CB C 4.700 -0.793 5.121 1.00 . A A . 5 SET CB 1 1
21 4040 1 1 5 . H H 6.209 1.517 5.521 1.00 . A A . 5 SET H 1 1
21 4041 1 1 5 . HA H 3.582 0.398 6.564 1.00 . A A . 5 SET HA 1 1
21 4042 1 1 5 . HB2 H 2.453 0.627 4.373 1.00 . A A . 5 SET HB2 1 1
21 4043 1 1 5 . HB3 H 2.714 2.114 5.224 1.00 . A A . 5 SET HB3 1 1
21 4044 1 1 5 . HNT2 H 4.151 1.266 2.658 1.00 . A A . 5 SET HNT2 1 1
21 4045 1 1 5 . N N 5.351 1.450 6.078 1.00 . A A . 5 SET N 1 1
21 4046 1 1 5 . NT N 3.878 1.878 3.435 1.00 . A A . 5 SET NT 1 1
21 4047 1 1 5 . OG O 5.535 -0.855 4.213 1.00 . A A . 5 SET OG 1 1
21 4048 1 1 6 SER C C 3.157 -4.091 5.411 1.00 . A A . 6 SER C 1 1
21 4049 1 1 6 SER CA C 4.482 -3.286 5.291 1.00 . A A . 6 SER CA 1 1
21 4050 1 1 6 SER CB C 5.589 -3.886 6.191 1.00 . A A . 6 SER CB 1 1
21 4051 1 1 6 SER H H 3.441 -1.709 6.398 1.00 . A A . 6 SER H 1 1
21 4052 1 1 6 SER HA H 4.846 -3.310 4.244 1.00 . A A . 6 SER HA 1 1
21 4053 1 1 6 SER HB2 H 5.313 -3.824 7.261 1.00 . A A . 6 SER HB2 1 1
21 4054 1 1 6 SER HB3 H 5.719 -4.962 5.971 1.00 . A A . 6 SER HB3 1 1
21 4055 1 1 6 SER HG H 7.465 -3.642 6.571 1.00 . A A . 6 SER HG 1 1
21 4056 1 1 6 SER N N 4.153 -1.888 5.683 1.00 . A A . 6 SER N 1 1
21 4057 1 1 6 SER O O 2.566 -4.165 6.496 1.00 . A A . 6 SER O 1 1
21 4058 1 1 6 SER OG O 6.833 -3.226 5.979 1.00 . A A . 6 SER OG 1 1
21 4059 1 1 7 GLY C C 0.292 -4.529 3.752 1.00 . A A . 7 GLY C 1 1
21 4060 1 1 7 GLY CA C 1.405 -5.452 4.287 1.00 . A A . 7 GLY CA 1 1
21 4061 1 1 7 GLY H H 3.256 -4.574 3.457 1.00 . A A . 7 GLY H 1 1
21 4062 1 1 7 GLY HA2 H 1.509 -6.328 3.619 1.00 . A A . 7 GLY HA2 1 1
21 4063 1 1 7 GLY HA3 H 1.141 -5.869 5.279 1.00 . A A . 7 GLY HA3 1 1
21 4064 1 1 7 GLY N N 2.689 -4.699 4.302 1.00 . A A . 7 GLY N 1 1
21 4065 1 1 7 GLY O O -0.102 -4.638 2.588 1.00 . A A . 7 GLY O 1 1
21 4066 1 1 8 LYS C C -0.373 -1.381 3.753 1.00 . A A . 8 LYS C 1 1
21 4067 1 1 8 LYS CA C -1.214 -2.599 4.252 1.00 . A A . 8 LYS CA 1 1
21 4068 1 1 8 LYS CB C -2.083 -2.311 5.502 1.00 . A A . 8 LYS CB 1 1
21 4069 1 1 8 LYS CD C -4.078 -1.016 6.514 1.00 . A A . 8 LYS CD 1 1
21 4070 1 1 8 LYS CE C -3.389 -0.016 7.468 1.00 . A A . 8 LYS CE 1 1
21 4071 1 1 8 LYS CG C -3.262 -1.345 5.249 1.00 . A A . 8 LYS CG 1 1
21 4072 1 1 8 LYS H H 0.262 -3.588 5.529 1.00 . A A . 8 LYS H 1 1
21 4073 1 1 8 LYS HA H -1.879 -2.978 3.449 1.00 . A A . 8 LYS HA 1 1
21 4074 1 1 8 LYS HB2 H -2.494 -3.263 5.891 1.00 . A A . 8 LYS HB2 1 1
21 4075 1 1 8 LYS HB3 H -1.443 -1.918 6.316 1.00 . A A . 8 LYS HB3 1 1
21 4076 1 1 8 LYS HD2 H -5.049 -0.600 6.190 1.00 . A A . 8 LYS HD2 1 1
21 4077 1 1 8 LYS HD3 H -4.321 -1.957 7.047 1.00 . A A . 8 LYS HD3 1 1
21 4078 1 1 8 LYS HE2 H -2.421 -0.419 7.822 1.00 . A A . 8 LYS HE2 1 1
21 4079 1 1 8 LYS HE3 H -3.149 0.922 6.931 1.00 . A A . 8 LYS HE3 1 1
21 4080 1 1 8 LYS HG2 H -2.907 -0.408 4.778 1.00 . A A . 8 LYS HG2 1 1
21 4081 1 1 8 LYS HG3 H -3.937 -1.803 4.501 1.00 . A A . 8 LYS HG3 1 1
21 4082 1 1 8 LYS HZ1 H -3.810 0.950 9.277 1.00 . A A . 8 LYS HZ1 1 1
21 4083 1 1 8 LYS HZ2 H -5.147 0.694 8.345 1.00 . A A . 8 LYS HZ2 1 1
21 4084 1 1 8 LYS HZ3 H -4.469 -0.559 9.173 1.00 . A A . 8 LYS HZ3 1 1
21 4085 1 1 8 LYS N N -0.200 -3.618 4.618 1.00 . A A . 8 LYS N 1 1
21 4086 1 1 8 LYS NZ N -4.250 0.285 8.630 1.00 . A A . 8 LYS NZ 1 1
21 4087 1 1 8 LYS O O 0.025 -0.503 4.527 1.00 . A A . 8 LYS O 1 1
21 4088 1 1 9 LEU C C 0.021 1.001 1.534 1.00 . A A . 9 LEU C 1 1
21 4089 1 1 9 LEU CA C 0.747 -0.352 1.783 1.00 . A A . 9 LEU CA 1 1
21 4090 1 1 9 LEU CB C 1.369 -0.922 0.472 1.00 . A A . 9 LEU CB 1 1
21 4091 1 1 9 LEU CD1 C 2.792 -2.624 -0.774 1.00 . A A . 9 LEU CD1 1 1
21 4092 1 1 9 LEU CD2 C 3.756 -1.526 1.277 1.00 . A A . 9 LEU CD2 1 1
21 4093 1 1 9 LEU CG C 2.460 -2.029 0.608 1.00 . A A . 9 LEU CG 1 1
21 4094 1 1 9 LEU H H -0.477 -2.202 1.954 1.00 . A A . 9 LEU H 1 1
21 4095 1 1 9 LEU HA H 1.610 -0.161 2.448 1.00 . A A . 9 LEU HA 1 1
21 4096 1 1 9 LEU HB2 H 0.548 -1.290 -0.175 1.00 . A A . 9 LEU HB2 1 1
21 4097 1 1 9 LEU HB3 H 1.813 -0.089 -0.107 1.00 . A A . 9 LEU HB3 1 1
21 4098 1 1 9 LEU HD11 H 3.534 -3.442 -0.701 1.00 . A A . 9 LEU HD11 1 1
21 4099 1 1 9 LEU HD12 H 1.896 -3.054 -1.259 1.00 . A A . 9 LEU HD12 1 1
21 4100 1 1 9 LEU HD13 H 3.209 -1.867 -1.466 1.00 . A A . 9 LEU HD13 1 1
21 4101 1 1 9 LEU HD21 H 3.580 -1.199 2.317 1.00 . A A . 9 LEU HD21 1 1
21 4102 1 1 9 LEU HD22 H 4.525 -2.319 1.332 1.00 . A A . 9 LEU HD22 1 1
21 4103 1 1 9 LEU HD23 H 4.202 -0.672 0.734 1.00 . A A . 9 LEU HD23 1 1
21 4104 1 1 9 LEU HG H 2.071 -2.859 1.226 1.00 . A A . 9 LEU HG 1 1
21 4105 1 1 9 LEU N N -0.099 -1.380 2.439 1.00 . A A . 9 LEU N 1 1
21 4106 1 1 9 LEU O O -0.789 1.139 0.613 1.00 . A A . 9 LEU O 1 1
21 4107 1 1 10 ILE C C 1.047 4.349 2.224 1.00 . A A . 10 ILE C 1 1
21 4108 1 1 10 ILE CA C -0.185 3.380 2.302 1.00 . A A . 10 ILE CA 1 1
21 4109 1 1 10 ILE CB C -1.253 3.639 3.430 1.00 . A A . 10 ILE CB 1 1
21 4110 1 1 10 ILE CD1 C -2.909 5.086 2.025 1.00 . A A . 10 ILE CD1 1 1
21 4111 1 1 10 ILE CG1 C -2.025 4.981 3.276 1.00 . A A . 10 ILE CG1 1 1
21 4112 1 1 10 ILE CG2 C -0.718 3.516 4.881 1.00 . A A . 10 ILE CG2 1 1
21 4113 1 1 10 ILE H H 0.981 1.711 3.142 1.00 . A A . 10 ILE H 1 1
21 4114 1 1 10 ILE HA H -0.717 3.500 1.337 1.00 . A A . 10 ILE HA 1 1
21 4115 1 1 10 ILE HB H -2.015 2.839 3.332 1.00 . A A . 10 ILE HB 1 1
21 4116 1 1 10 ILE HD11 H -3.502 6.018 2.036 1.00 . A A . 10 ILE HD11 1 1
21 4117 1 1 10 ILE HD12 H -2.312 5.096 1.094 1.00 . A A . 10 ILE HD12 1 1
21 4118 1 1 10 ILE HD13 H -3.622 4.244 1.957 1.00 . A A . 10 ILE HD13 1 1
21 4119 1 1 10 ILE HG12 H -2.683 5.134 4.153 1.00 . A A . 10 ILE HG12 1 1
21 4120 1 1 10 ILE HG13 H -1.321 5.835 3.298 1.00 . A A . 10 ILE HG13 1 1
21 4121 1 1 10 ILE HG21 H 0.018 4.304 5.129 1.00 . A A . 10 ILE HG21 1 1
21 4122 1 1 10 ILE HG22 H -1.533 3.590 5.626 1.00 . A A . 10 ILE HG22 1 1
21 4123 1 1 10 ILE HG23 H -0.224 2.543 5.058 1.00 . A A . 10 ILE HG23 1 1
21 4124 1 1 10 ILE N N 0.344 1.987 2.389 1.00 . A A . 10 ILE N 1 1
21 4125 1 1 10 ILE O O 1.258 5.199 3.092 1.00 . A A . 10 ILE O 1 1
21 4126 1 1 11 GLU C C 2.914 5.965 -0.334 1.00 . A A . 11 GLU C 1 1
21 4127 1 1 11 GLU CA C 3.081 5.020 0.908 1.00 . A A . 11 GLU CA 1 1
21 4128 1 1 11 GLU CB C 4.255 3.987 0.799 1.00 . A A . 11 GLU CB 1 1
21 4129 1 1 11 GLU CD C 4.223 3.177 3.332 1.00 . A A . 11 GLU CD 1 1
21 4130 1 1 11 GLU CG C 5.025 3.634 2.098 1.00 . A A . 11 GLU CG 1 1
21 4131 1 1 11 GLU H H 1.565 3.468 0.502 1.00 . A A . 11 GLU H 1 1
21 4132 1 1 11 GLU HA H 3.316 5.675 1.776 1.00 . A A . 11 GLU HA 1 1
21 4133 1 1 11 GLU HB2 H 3.931 3.054 0.297 1.00 . A A . 11 GLU HB2 1 1
21 4134 1 1 11 GLU HB3 H 5.025 4.379 0.109 1.00 . A A . 11 GLU HB3 1 1
21 4135 1 1 11 GLU HG2 H 5.808 2.889 1.863 1.00 . A A . 11 GLU HG2 1 1
21 4136 1 1 11 GLU HG3 H 5.605 4.526 2.394 1.00 . A A . 11 GLU HG3 1 1
21 4137 1 1 11 GLU N N 1.848 4.214 1.147 1.00 . A A . 11 GLU N 1 1
21 4138 1 1 11 GLU O O 3.748 5.969 -1.244 1.00 . A A . 11 GLU O 1 1
21 4139 1 1 11 GLU OE1 O 3.955 4.015 4.199 1.00 . A A . 11 GLU OE1 1 1
21 4140 1 1 12 THR C C 0.832 8.975 -0.850 1.00 . A A . 12 THR C 1 1
21 4141 1 1 12 THR CA C 1.555 7.742 -1.474 1.00 . A A . 12 THR CA 1 1
21 4142 1 1 12 THR CB C 0.814 7.069 -2.679 1.00 . A A . 12 THR CB 1 1
21 4143 1 1 12 THR CG2 C 0.600 8.005 -3.881 1.00 . A A . 12 THR CG2 1 1
21 4144 1 1 12 THR H H 1.195 6.682 0.426 1.00 . A A . 12 THR H 1 1
21 4145 1 1 12 THR HA H 2.522 8.122 -1.864 1.00 . A A . 12 THR HA 1 1
21 4146 1 1 12 THR HB H -0.176 6.705 -2.343 1.00 . A A . 12 THR HB 1 1
21 4147 1 1 12 THR HG1 H 2.449 6.248 -3.283 1.00 . A A . 12 THR HG1 1 1
21 4148 1 1 12 THR HG21 H -0.027 8.878 -3.618 1.00 . A A . 12 THR HG21 1 1
21 4149 1 1 12 THR HG22 H 1.556 8.393 -4.277 1.00 . A A . 12 THR HG22 1 1
21 4150 1 1 12 THR HG23 H 0.089 7.482 -4.711 1.00 . A A . 12 THR HG23 1 1
21 4151 1 1 12 THR N N 1.843 6.791 -0.361 1.00 . A A . 12 THR N 1 1
21 4152 1 1 12 THR O O 1.467 10.022 -0.696 1.00 . A A . 12 THR O 1 1
21 4153 1 1 12 THR OG1 O 1.544 5.946 -3.163 1.00 . A A . 12 THR OG1 1 1
21 4154 1 1 13 THR C C -2.109 9.317 1.246 1.00 . A A . 13 THR C 1 1
21 4155 1 1 13 THR CA C -1.260 9.964 0.110 1.00 . A A . 13 THR CA 1 1
21 4156 1 1 13 THR CB C -2.120 10.703 -0.964 1.00 . A A . 13 THR CB 1 1
21 4157 1 1 13 THR CG2 C -2.930 11.891 -0.414 1.00 . A A . 13 THR CG2 1 1
21 4158 1 1 13 THR H H -0.917 7.980 -0.778 1.00 . A A . 13 THR H 1 1
21 4159 1 1 13 THR HA H -0.578 10.720 0.551 1.00 . A A . 13 THR HA 1 1
21 4160 1 1 13 THR HB H -2.825 9.986 -1.427 1.00 . A A . 13 THR HB 1 1
21 4161 1 1 13 THR HG1 H -1.861 11.701 -2.591 1.00 . A A . 13 THR HG1 1 1
21 4162 1 1 13 THR HG21 H -3.507 12.390 -1.215 1.00 . A A . 13 THR HG21 1 1
21 4163 1 1 13 THR HG22 H -3.656 11.572 0.355 1.00 . A A . 13 THR HG22 1 1
21 4164 1 1 13 THR HG23 H -2.275 12.655 0.045 1.00 . A A . 13 THR HG23 1 1
21 4165 1 1 13 THR N N -0.471 8.860 -0.501 1.00 . A A . 13 THR N 1 1
21 4166 1 1 13 THR O O -3.078 8.598 0.974 1.00 . A A . 13 THR O 1 1
21 4167 1 1 13 THR OG1 O -1.282 11.224 -1.991 1.00 . A A . 13 THR OG1 1 1
21 4168 1 1 14 ALA C C -3.509 10.052 4.197 1.00 . A A . 14 ALA C 1 1
21 4169 1 1 14 ALA CA C -2.452 9.042 3.697 1.00 . A A . 14 ALA CA 1 1
21 4170 1 1 14 ALA CB C -1.424 8.702 4.792 1.00 . A A . 14 ALA CB 1 1
21 4171 1 1 14 ALA H H -0.915 10.187 2.608 1.00 . A A . 14 ALA H 1 1
21 4172 1 1 14 ALA HXT H -5.431 10.243 4.306 1.00 . A A . 14 ALA HXT 1 1
21 4173 1 1 14 ALA HA H -2.961 8.093 3.438 1.00 . A A . 14 ALA HA 1 1
21 4174 1 1 14 ALA HB1 H -1.914 8.295 5.696 1.00 . A A . 14 ALA HB1 1 1
21 4175 1 1 14 ALA HB2 H -0.706 7.933 4.452 1.00 . A A . 14 ALA HB2 1 1
21 4176 1 1 14 ALA HB3 H -0.835 9.585 5.109 1.00 . A A . 14 ALA HB3 1 1
21 4177 1 1 14 ALA N N -1.740 9.584 2.513 1.00 . A A . 14 ALA N 1 1
21 4178 1 1 14 ALA O O -3.238 11.139 4.710 1.00 . A A . 14 ALA O 1 1
21 4179 1 1 14 ALA OXT O -4.787 9.603 3.997 1.00 . A A . 14 ALA OXT 1 1
22 4180 1 1 1 ACE C C 2.031 8.445 4.986 1.00 . A A . 1 ACE C 1 1
22 4181 1 1 1 ACE CH3 C 1.426 9.846 4.940 1.00 . A A . 1 ACE CH3 1 1
22 4182 1 1 1 ACE H1 H 1.312 10.296 5.944 1.00 . A A . 1 ACE H1 1 1
22 4183 1 1 1 ACE H2 H 2.050 10.524 4.332 1.00 . A A . 1 ACE H2 1 1
22 4184 1 1 1 ACE H3 H 0.421 9.823 4.481 1.00 . A A . 1 ACE H3 1 1
22 4185 1 1 1 ACE O O 1.688 7.599 4.159 1.00 . A A . 1 ACE O 1 1
22 4186 1 1 2 ILE C C 3.131 6.388 7.536 1.00 . A A . 2 ILE C 1 1
22 4187 1 1 2 ILE CA C 3.623 6.920 6.152 1.00 . A A . 2 ILE CA 1 1
22 4188 1 1 2 ILE CB C 5.189 7.032 6.022 1.00 . A A . 2 ILE CB 1 1
22 4189 1 1 2 ILE CD1 C 5.282 6.811 3.390 1.00 . A A . 2 ILE CD1 1 1
22 4190 1 1 2 ILE CG1 C 5.700 7.579 4.656 1.00 . A A . 2 ILE CG1 1 1
22 4191 1 1 2 ILE CG2 C 5.926 5.701 6.337 1.00 . A A . 2 ILE CG2 1 1
22 4192 1 1 2 ILE H H 3.032 9.009 6.616 1.00 . A A . 2 ILE H 1 1
22 4193 1 1 2 ILE HA H 3.345 6.185 5.366 1.00 . A A . 2 ILE HA 1 1
22 4194 1 1 2 ILE HB H 5.530 7.755 6.788 1.00 . A A . 2 ILE HB 1 1
22 4195 1 1 2 ILE HD11 H 4.194 6.893 3.222 1.00 . A A . 2 ILE HD11 1 1
22 4196 1 1 2 ILE HD12 H 5.774 7.219 2.490 1.00 . A A . 2 ILE HD12 1 1
22 4197 1 1 2 ILE HD13 H 5.540 5.737 3.441 1.00 . A A . 2 ILE HD13 1 1
22 4198 1 1 2 ILE HG12 H 5.363 8.625 4.545 1.00 . A A . 2 ILE HG12 1 1
22 4199 1 1 2 ILE HG13 H 6.803 7.646 4.676 1.00 . A A . 2 ILE HG13 1 1
22 4200 1 1 2 ILE HG21 H 5.737 5.354 7.369 1.00 . A A . 2 ILE HG21 1 1
22 4201 1 1 2 ILE HG22 H 5.613 4.884 5.661 1.00 . A A . 2 ILE HG22 1 1
22 4202 1 1 2 ILE HG23 H 7.024 5.804 6.243 1.00 . A A . 2 ILE HG23 1 1
22 4203 1 1 2 ILE N N 2.938 8.233 5.949 1.00 . A A . 2 ILE N 1 1
22 4204 1 1 2 ILE O O 3.742 6.676 8.570 1.00 . A A . 2 ILE O 1 1
22 4205 1 1 3 TRP C C 1.503 3.468 8.650 1.00 . A A . 3 TRP C 1 1
22 4206 1 1 3 TRP CA C 1.453 5.017 8.791 1.00 . A A . 3 TRP CA 1 1
22 4207 1 1 3 TRP CB C 0.093 5.599 9.273 1.00 . A A . 3 TRP CB 1 1
22 4208 1 1 3 TRP CD1 C -1.273 6.725 7.391 1.00 . A A . 3 TRP CD1 1 1
22 4209 1 1 3 TRP CD2 C -2.178 4.839 8.134 1.00 . A A . 3 TRP CD2 1 1
22 4210 1 1 3 TRP CE2 C -3.016 5.411 7.141 1.00 . A A . 3 TRP CE2 1 1
22 4211 1 1 3 TRP CE3 C -2.560 3.642 8.791 1.00 . A A . 3 TRP CE3 1 1
22 4212 1 1 3 TRP CG C -1.076 5.663 8.284 1.00 . A A . 3 TRP CG 1 1
22 4213 1 1 3 TRP CH2 C -4.586 3.596 7.440 1.00 . A A . 3 TRP CH2 1 1
22 4214 1 1 3 TRP CZ2 C -4.234 4.781 6.791 1.00 . A A . 3 TRP CZ2 1 1
22 4215 1 1 3 TRP CZ3 C -3.763 3.037 8.425 1.00 . A A . 3 TRP CZ3 1 1
22 4216 1 1 3 TRP H H 1.611 5.483 6.613 1.00 . A A . 3 TRP H 1 1
22 4217 1 1 3 TRP HA H 2.119 5.252 9.647 1.00 . A A . 3 TRP HA 1 1
22 4218 1 1 3 TRP HB2 H -0.232 5.049 10.176 1.00 . A A . 3 TRP HB2 1 1
22 4219 1 1 3 TRP HB3 H 0.277 6.624 9.648 1.00 . A A . 3 TRP HB3 1 1
22 4220 1 1 3 TRP HD1 H -0.595 7.560 7.342 1.00 . A A . 3 TRP HD1 1 1
22 4221 1 1 3 TRP HE1 H -2.857 7.230 5.958 1.00 . A A . 3 TRP HE1 1 1
22 4222 1 1 3 TRP HE3 H -1.937 3.203 9.557 1.00 . A A . 3 TRP HE3 1 1
22 4223 1 1 3 TRP HH2 H -5.512 3.104 7.179 1.00 . A A . 3 TRP HH2 1 1
22 4224 1 1 3 TRP HZ2 H -4.881 5.207 6.038 1.00 . A A . 3 TRP HZ2 1 1
22 4225 1 1 3 TRP HZ3 H -4.065 2.122 8.914 1.00 . A A . 3 TRP HZ3 1 1
22 4226 1 1 3 TRP N N 2.012 5.635 7.544 1.00 . A A . 3 TRP N 1 1
22 4227 1 1 3 TRP NE1 N -2.465 6.588 6.656 1.00 . A A . 3 TRP NE1 1 1
22 4228 1 1 3 TRP O O 0.496 2.780 8.460 1.00 . A A . 3 TRP O 1 1
22 4229 1 1 4 GLY C C 3.155 1.054 7.176 1.00 . A A . 4 GLY C 1 1
22 4230 1 1 4 GLY CA C 3.040 1.509 8.642 1.00 . A A . 4 GLY CA 1 1
22 4231 1 1 4 GLY H H 3.435 3.706 8.725 1.00 . A A . 4 GLY H 1 1
22 4232 1 1 4 GLY HA2 H 3.973 1.298 9.198 1.00 . A A . 4 GLY HA2 1 1
22 4233 1 1 4 GLY HA3 H 2.263 0.910 9.153 1.00 . A A . 4 GLY HA3 1 1
22 4234 1 1 4 GLY N N 2.738 2.954 8.753 1.00 . A A . 4 GLY N 1 1
22 4235 1 1 4 GLY O O 2.126 0.765 6.560 1.00 . A A . 4 GLY O 1 1
22 4236 1 1 5 . C C 5.544 1.635 4.518 1.00 . A A . 5 SET C 1 1
22 4237 1 1 5 . CA C 4.618 0.578 5.216 1.00 . A A . 5 SET CA 1 1
22 4238 1 1 5 . CB C 5.160 -0.885 5.128 1.00 . A A . 5 SET CB 1 1
22 4239 1 1 5 . H H 5.153 1.161 7.300 1.00 . A A . 5 SET H 1 1
22 4240 1 1 5 . HA H 3.625 0.598 4.709 1.00 . A A . 5 SET HA 1 1
22 4241 1 1 5 . HB2 H 5.375 2.644 4.948 1.00 . A A . 5 SET HB2 1 1
22 4242 1 1 5 . HB3 H 6.608 1.435 4.746 1.00 . A A . 5 SET HB3 1 1
22 4243 1 1 5 . HNT2 H 6.165 1.465 2.421 1.00 . A A . 5 SET HNT2 1 1
22 4244 1 1 5 . N N 4.389 0.987 6.636 1.00 . A A . 5 SET N 1 1
22 4245 1 1 5 . NT N 5.394 1.755 3.043 1.00 . A A . 5 SET NT 1 1
22 4246 1 1 5 . OG O 6.349 -1.135 4.915 1.00 . A A . 5 SET OG 1 1
22 4247 1 1 6 SER C C 3.102 -3.986 5.416 1.00 . A A . 6 SER C 1 1
22 4248 1 1 6 SER CA C 4.495 -3.307 5.290 1.00 . A A . 6 SER CA 1 1
22 4249 1 1 6 SER CB C 5.448 -3.784 6.418 1.00 . A A . 6 SER CB 1 1
22 4250 1 1 6 SER H H 3.289 -1.445 5.295 1.00 . A A . 6 SER H 1 1
22 4251 1 1 6 SER HA H 4.960 -3.560 4.316 1.00 . A A . 6 SER HA 1 1
22 4252 1 1 6 SER HB2 H 6.411 -3.243 6.375 1.00 . A A . 6 SER HB2 1 1
22 4253 1 1 6 SER HB3 H 5.024 -3.565 7.418 1.00 . A A . 6 SER HB3 1 1
22 4254 1 1 6 SER HG H 6.298 -5.405 7.027 1.00 . A A . 6 SER HG 1 1
22 4255 1 1 6 SER N N 4.234 -1.838 5.316 1.00 . A A . 6 SER N 1 1
22 4256 1 1 6 SER O O 2.431 -3.831 6.446 1.00 . A A . 6 SER O 1 1
22 4257 1 1 6 SER OG O 5.708 -5.179 6.304 1.00 . A A . 6 SER OG 1 1
22 4258 1 1 7 GLY C C 0.254 -4.426 3.857 1.00 . A A . 7 GLY C 1 1
22 4259 1 1 7 GLY CA C 1.321 -5.395 4.404 1.00 . A A . 7 GLY CA 1 1
22 4260 1 1 7 GLY H H 3.302 -4.822 3.593 1.00 . A A . 7 GLY H 1 1
22 4261 1 1 7 GLY HA2 H 1.358 -6.298 3.767 1.00 . A A . 7 GLY HA2 1 1
22 4262 1 1 7 GLY HA3 H 1.051 -5.763 5.414 1.00 . A A . 7 GLY HA3 1 1
22 4263 1 1 7 GLY N N 2.661 -4.740 4.388 1.00 . A A . 7 GLY N 1 1
22 4264 1 1 7 GLY O O -0.179 -4.554 2.708 1.00 . A A . 7 GLY O 1 1
22 4265 1 1 8 LYS C C -0.202 -1.253 3.756 1.00 . A A . 8 LYS C 1 1
22 4266 1 1 8 LYS CA C -1.109 -2.385 4.330 1.00 . A A . 8 LYS CA 1 1
22 4267 1 1 8 LYS CB C -1.898 -1.975 5.601 1.00 . A A . 8 LYS CB 1 1
22 4268 1 1 8 LYS CD C -3.542 -0.281 6.678 1.00 . A A . 8 LYS CD 1 1
22 4269 1 1 8 LYS CE C -4.291 -1.230 7.637 1.00 . A A . 8 LYS CE 1 1
22 4270 1 1 8 LYS CG C -2.983 -0.896 5.375 1.00 . A A . 8 LYS CG 1 1
22 4271 1 1 8 LYS H H 0.369 -3.409 5.578 1.00 . A A . 8 LYS H 1 1
22 4272 1 1 8 LYS HA H -1.832 -2.745 3.569 1.00 . A A . 8 LYS HA 1 1
22 4273 1 1 8 LYS HB2 H -2.380 -2.872 6.037 1.00 . A A . 8 LYS HB2 1 1
22 4274 1 1 8 LYS HB3 H -1.188 -1.622 6.377 1.00 . A A . 8 LYS HB3 1 1
22 4275 1 1 8 LYS HD2 H -2.700 0.180 7.230 1.00 . A A . 8 LYS HD2 1 1
22 4276 1 1 8 LYS HD3 H -4.195 0.574 6.419 1.00 . A A . 8 LYS HD3 1 1
22 4277 1 1 8 LYS HE2 H -3.658 -2.105 7.887 1.00 . A A . 8 LYS HE2 1 1
22 4278 1 1 8 LYS HE3 H -4.458 -0.711 8.601 1.00 . A A . 8 LYS HE3 1 1
22 4279 1 1 8 LYS HG2 H -2.560 -0.068 4.774 1.00 . A A . 8 LYS HG2 1 1
22 4280 1 1 8 LYS HG3 H -3.804 -1.306 4.757 1.00 . A A . 8 LYS HG3 1 1
22 4281 1 1 8 LYS HZ1 H -5.478 -2.200 6.218 1.00 . A A . 8 LYS HZ1 1 1
22 4282 1 1 8 LYS HZ2 H -6.088 -2.301 7.748 1.00 . A A . 8 LYS HZ2 1 1
22 4283 1 1 8 LYS HZ3 H -6.216 -0.893 6.897 1.00 . A A . 8 LYS HZ3 1 1
22 4284 1 1 8 LYS N N -0.154 -3.458 4.701 1.00 . A A . 8 LYS N 1 1
22 4285 1 1 8 LYS NZ N -5.591 -1.682 7.096 1.00 . A A . 8 LYS NZ 1 1
22 4286 1 1 8 LYS O O 0.295 -0.391 4.490 1.00 . A A . 8 LYS O 1 1
22 4287 1 1 9 LEU C C 0.192 1.010 1.370 1.00 . A A . 9 LEU C 1 1
22 4288 1 1 9 LEU CA C 0.900 -0.329 1.730 1.00 . A A . 9 LEU CA 1 1
22 4289 1 1 9 LEU CB C 1.574 -1.015 0.504 1.00 . A A . 9 LEU CB 1 1
22 4290 1 1 9 LEU CD1 C 2.999 -2.880 -0.487 1.00 . A A . 9 LEU CD1 1 1
22 4291 1 1 9 LEU CD2 C 3.934 -1.538 1.428 1.00 . A A . 9 LEU CD2 1 1
22 4292 1 1 9 LEU CG C 2.645 -2.109 0.799 1.00 . A A . 9 LEU CG 1 1
22 4293 1 1 9 LEU H H -0.392 -2.122 1.981 1.00 . A A . 9 LEU H 1 1
22 4294 1 1 9 LEU HA H 1.740 -0.069 2.406 1.00 . A A . 9 LEU HA 1 1
22 4295 1 1 9 LEU HB2 H 0.777 -1.438 -0.143 1.00 . A A . 9 LEU HB2 1 1
22 4296 1 1 9 LEU HB3 H 2.049 -0.241 -0.129 1.00 . A A . 9 LEU HB3 1 1
22 4297 1 1 9 LEU HD11 H 3.438 -2.222 -1.260 1.00 . A A . 9 LEU HD11 1 1
22 4298 1 1 9 LEU HD12 H 3.726 -3.689 -0.293 1.00 . A A . 9 LEU HD12 1 1
22 4299 1 1 9 LEU HD13 H 2.106 -3.358 -0.933 1.00 . A A . 9 LEU HD13 1 1
22 4300 1 1 9 LEU HD21 H 3.739 -1.054 2.402 1.00 . A A . 9 LEU HD21 1 1
22 4301 1 1 9 LEU HD22 H 4.681 -2.329 1.622 1.00 . A A . 9 LEU HD22 1 1
22 4302 1 1 9 LEU HD23 H 4.414 -0.782 0.779 1.00 . A A . 9 LEU HD23 1 1
22 4303 1 1 9 LEU HG H 2.225 -2.846 1.509 1.00 . A A . 9 LEU HG 1 1
22 4304 1 1 9 LEU N N 0.016 -1.296 2.431 1.00 . A A . 9 LEU N 1 1
22 4305 1 1 9 LEU O O -0.299 1.215 0.256 1.00 . A A . 9 LEU O 1 1
22 4306 1 1 10 ILE C C 0.873 4.201 2.307 1.00 . A A . 10 ILE C 1 1
22 4307 1 1 10 ILE CA C -0.393 3.289 2.244 1.00 . A A . 10 ILE CA 1 1
22 4308 1 1 10 ILE CB C -1.528 3.529 3.308 1.00 . A A . 10 ILE CB 1 1
22 4309 1 1 10 ILE CD1 C -2.902 5.249 1.893 1.00 . A A . 10 ILE CD1 1 1
22 4310 1 1 10 ILE CG1 C -2.193 4.932 3.219 1.00 . A A . 10 ILE CG1 1 1
22 4311 1 1 10 ILE CG2 C -1.134 3.254 4.786 1.00 . A A . 10 ILE CG2 1 1
22 4312 1 1 10 ILE H H 0.581 1.585 3.244 1.00 . A A . 10 ILE H 1 1
22 4313 1 1 10 ILE HA H -0.858 3.421 1.247 1.00 . A A . 10 ILE HA 1 1
22 4314 1 1 10 ILE HB H -2.324 2.794 3.078 1.00 . A A . 10 ILE HB 1 1
22 4315 1 1 10 ILE HD11 H -3.666 4.490 1.645 1.00 . A A . 10 ILE HD11 1 1
22 4316 1 1 10 ILE HD12 H -3.417 6.226 1.945 1.00 . A A . 10 ILE HD12 1 1
22 4317 1 1 10 ILE HD13 H -2.193 5.304 1.048 1.00 . A A . 10 ILE HD13 1 1
22 4318 1 1 10 ILE HG12 H -2.947 5.032 4.022 1.00 . A A . 10 ILE HG12 1 1
22 4319 1 1 10 ILE HG13 H -1.447 5.722 3.430 1.00 . A A . 10 ILE HG13 1 1
22 4320 1 1 10 ILE HG21 H -2.017 3.270 5.449 1.00 . A A . 10 ILE HG21 1 1
22 4321 1 1 10 ILE HG22 H -0.673 2.259 4.924 1.00 . A A . 10 ILE HG22 1 1
22 4322 1 1 10 ILE HG23 H -0.420 4.000 5.183 1.00 . A A . 10 ILE HG23 1 1
22 4323 1 1 10 ILE N N 0.167 1.912 2.364 1.00 . A A . 10 ILE N 1 1
22 4324 1 1 10 ILE O O 1.166 4.825 3.331 1.00 . A A . 10 ILE O 1 1
22 4325 1 1 11 GLU C C 2.714 6.370 0.382 1.00 . A A . 11 GLU C 1 1
22 4326 1 1 11 GLU CA C 2.915 4.999 1.110 1.00 . A A . 11 GLU CA 1 1
22 4327 1 1 11 GLU CB C 4.018 4.076 0.484 1.00 . A A . 11 GLU CB 1 1
22 4328 1 1 11 GLU CD C 4.314 2.371 2.506 1.00 . A A . 11 GLU CD 1 1
22 4329 1 1 11 GLU CG C 4.187 2.601 0.977 1.00 . A A . 11 GLU CG 1 1
22 4330 1 1 11 GLU H H 1.264 3.710 0.396 1.00 . A A . 11 GLU H 1 1
22 4331 1 1 11 GLU HA H 3.310 5.174 2.131 1.00 . A A . 11 GLU HA 1 1
22 4332 1 1 11 GLU HB2 H 3.861 4.028 -0.611 1.00 . A A . 11 GLU HB2 1 1
22 4333 1 1 11 GLU HB3 H 4.993 4.587 0.595 1.00 . A A . 11 GLU HB3 1 1
22 4334 1 1 11 GLU HG2 H 3.303 2.032 0.626 1.00 . A A . 11 GLU HG2 1 1
22 4335 1 1 11 GLU HG3 H 5.029 2.139 0.427 1.00 . A A . 11 GLU HG3 1 1
22 4336 1 1 11 GLU N N 1.630 4.253 1.186 1.00 . A A . 11 GLU N 1 1
22 4337 1 1 11 GLU O O 3.205 6.555 -0.737 1.00 . A A . 11 GLU O 1 1
22 4338 1 1 11 GLU OE1 O 3.378 2.731 3.226 1.00 . A A . 11 GLU OE1 1 1
22 4339 1 1 12 THR C C 3.005 9.597 0.332 1.00 . A A . 12 THR C 1 1
22 4340 1 1 12 THR CA C 1.739 8.683 0.390 1.00 . A A . 12 THR CA 1 1
22 4341 1 1 12 THR CB C 0.494 9.396 1.015 1.00 . A A . 12 THR CB 1 1
22 4342 1 1 12 THR CG2 C 0.022 10.665 0.266 1.00 . A A . 12 THR CG2 1 1
22 4343 1 1 12 THR H H 1.538 7.052 1.881 1.00 . A A . 12 THR H 1 1
22 4344 1 1 12 THR HA H 1.454 8.489 -0.665 1.00 . A A . 12 THR HA 1 1
22 4345 1 1 12 THR HB H 0.728 9.690 2.057 1.00 . A A . 12 THR HB 1 1
22 4346 1 1 12 THR HG1 H -0.846 8.321 0.141 1.00 . A A . 12 THR HG1 1 1
22 4347 1 1 12 THR HG21 H -0.248 10.460 -0.787 1.00 . A A . 12 THR HG21 1 1
22 4348 1 1 12 THR HG22 H -0.872 11.114 0.740 1.00 . A A . 12 THR HG22 1 1
22 4349 1 1 12 THR HG23 H 0.794 11.458 0.251 1.00 . A A . 12 THR HG23 1 1
22 4350 1 1 12 THR N N 2.005 7.342 1.010 1.00 . A A . 12 THR N 1 1
22 4351 1 1 12 THR O O 3.416 9.966 -0.772 1.00 . A A . 12 THR O 1 1
22 4352 1 1 12 THR OG1 O -0.622 8.509 1.055 1.00 . A A . 12 THR OG1 1 1
22 4353 1 1 13 THR C C 6.123 9.974 1.571 1.00 . A A . 13 THR C 1 1
22 4354 1 1 13 THR CA C 4.824 10.839 1.513 1.00 . A A . 13 THR CA 1 1
22 4355 1 1 13 THR CB C 4.735 11.896 2.658 1.00 . A A . 13 THR CB 1 1
22 4356 1 1 13 THR CG2 C 3.639 12.964 2.485 1.00 . A A . 13 THR CG2 1 1
22 4357 1 1 13 THR H H 3.244 9.512 2.328 1.00 . A A . 13 THR H 1 1
22 4358 1 1 13 THR HA H 4.881 11.435 0.578 1.00 . A A . 13 THR HA 1 1
22 4359 1 1 13 THR HB H 5.696 12.442 2.682 1.00 . A A . 13 THR HB 1 1
22 4360 1 1 13 THR HG1 H 5.325 10.686 4.033 1.00 . A A . 13 THR HG1 1 1
22 4361 1 1 13 THR HG21 H 2.625 12.524 2.487 1.00 . A A . 13 THR HG21 1 1
22 4362 1 1 13 THR HG22 H 3.672 13.710 3.302 1.00 . A A . 13 THR HG22 1 1
22 4363 1 1 13 THR HG23 H 3.757 13.523 1.538 1.00 . A A . 13 THR HG23 1 1
22 4364 1 1 13 THR N N 3.612 9.962 1.482 1.00 . A A . 13 THR N 1 1
22 4365 1 1 13 THR O O 6.779 9.877 2.614 1.00 . A A . 13 THR O 1 1
22 4366 1 1 13 THR OG1 O 4.570 11.272 3.930 1.00 . A A . 13 THR OG1 1 1
22 4367 1 1 14 ALA C C 8.911 9.270 -0.224 1.00 . A A . 14 ALA C 1 1
22 4368 1 1 14 ALA CA C 7.691 8.494 0.319 1.00 . A A . 14 ALA CA 1 1
22 4369 1 1 14 ALA CB C 7.335 7.267 -0.541 1.00 . A A . 14 ALA CB 1 1
22 4370 1 1 14 ALA H H 5.828 9.476 -0.346 1.00 . A A . 14 ALA H 1 1
22 4371 1 1 14 ALA HXT H 7.847 9.546 -1.830 1.00 . A A . 14 ALA HXT 1 1
22 4372 1 1 14 ALA HA H 7.970 8.101 1.318 1.00 . A A . 14 ALA HA 1 1
22 4373 1 1 14 ALA HB1 H 6.498 6.690 -0.102 1.00 . A A . 14 ALA HB1 1 1
22 4374 1 1 14 ALA HB2 H 7.037 7.540 -1.571 1.00 . A A . 14 ALA HB2 1 1
22 4375 1 1 14 ALA HB3 H 8.190 6.569 -0.624 1.00 . A A . 14 ALA HB3 1 1
22 4376 1 1 14 ALA N N 6.491 9.361 0.428 1.00 . A A . 14 ALA N 1 1
22 4377 1 1 14 ALA O O 9.946 9.424 0.423 1.00 . A A . 14 ALA O 1 1
22 4378 1 1 14 ALA OXT O 8.719 9.763 -1.493 1.00 . A A . 14 ALA OXT 1 1
23 4379 1 1 1 ACE C C -0.625 5.752 7.108 1.00 . A A . 1 ACE C 1 1
23 4380 1 1 1 ACE CH3 C -2.092 6.165 7.059 1.00 . A A . 1 ACE CH3 1 1
23 4381 1 1 1 ACE H1 H -2.697 5.422 6.508 1.00 . A A . 1 ACE H1 1 1
23 4382 1 1 1 ACE H2 H -2.523 6.251 8.074 1.00 . A A . 1 ACE H2 1 1
23 4383 1 1 1 ACE H3 H -2.221 7.138 6.548 1.00 . A A . 1 ACE H3 1 1
23 4384 1 1 1 ACE O O -0.252 4.705 6.574 1.00 . A A . 1 ACE O 1 1
23 4385 1 1 2 ILE C C 1.868 5.722 9.344 1.00 . A A . 2 ILE C 1 1
23 4386 1 1 2 ILE CA C 1.660 6.321 7.911 1.00 . A A . 2 ILE CA 1 1
23 4387 1 1 2 ILE CB C 2.535 7.583 7.554 1.00 . A A . 2 ILE CB 1 1
23 4388 1 1 2 ILE CD1 C 2.630 7.179 4.935 1.00 . A A . 2 ILE CD1 1 1
23 4389 1 1 2 ILE CG1 C 2.333 8.137 6.105 1.00 . A A . 2 ILE CG1 1 1
23 4390 1 1 2 ILE CG2 C 4.052 7.364 7.796 1.00 . A A . 2 ILE CG2 1 1
23 4391 1 1 2 ILE H H -0.313 7.289 8.324 1.00 . A A . 2 ILE H 1 1
23 4392 1 1 2 ILE HA H 2.002 5.558 7.171 1.00 . A A . 2 ILE HA 1 1
23 4393 1 1 2 ILE HB H 2.237 8.397 8.242 1.00 . A A . 2 ILE HB 1 1
23 4394 1 1 2 ILE HD11 H 1.995 6.277 4.967 1.00 . A A . 2 ILE HD11 1 1
23 4395 1 1 2 ILE HD12 H 2.441 7.670 3.966 1.00 . A A . 2 ILE HD12 1 1
23 4396 1 1 2 ILE HD13 H 3.684 6.846 4.928 1.00 . A A . 2 ILE HD13 1 1
23 4397 1 1 2 ILE HG12 H 1.296 8.500 5.991 1.00 . A A . 2 ILE HG12 1 1
23 4398 1 1 2 ILE HG13 H 2.948 9.046 5.968 1.00 . A A . 2 ILE HG13 1 1
23 4399 1 1 2 ILE HG21 H 4.277 7.136 8.854 1.00 . A A . 2 ILE HG21 1 1
23 4400 1 1 2 ILE HG22 H 4.455 6.528 7.193 1.00 . A A . 2 ILE HG22 1 1
23 4401 1 1 2 ILE HG23 H 4.644 8.264 7.544 1.00 . A A . 2 ILE HG23 1 1
23 4402 1 1 2 ILE N N 0.192 6.587 7.765 1.00 . A A . 2 ILE N 1 1
23 4403 1 1 2 ILE O O 2.199 6.431 10.299 1.00 . A A . 2 ILE O 1 1
23 4404 1 1 3 TRP C C 2.025 2.153 10.330 1.00 . A A . 3 TRP C 1 1
23 4405 1 1 3 TRP CA C 1.796 3.638 10.738 1.00 . A A . 3 TRP CA 1 1
23 4406 1 1 3 TRP CB C 0.717 3.859 11.841 1.00 . A A . 3 TRP CB 1 1
23 4407 1 1 3 TRP CD1 C -1.588 4.433 10.798 1.00 . A A . 3 TRP CD1 1 1
23 4408 1 1 3 TRP CD2 C -1.536 2.468 11.827 1.00 . A A . 3 TRP CD2 1 1
23 4409 1 1 3 TRP CE2 C -2.834 2.694 11.297 1.00 . A A . 3 TRP CE2 1 1
23 4410 1 1 3 TRP CE3 C -1.247 1.271 12.531 1.00 . A A . 3 TRP CE3 1 1
23 4411 1 1 3 TRP CG C -0.749 3.560 11.503 1.00 . A A . 3 TRP CG 1 1
23 4412 1 1 3 TRP CH2 C -3.542 0.547 12.156 1.00 . A A . 3 TRP CH2 1 1
23 4413 1 1 3 TRP CZ2 C -3.847 1.721 11.464 1.00 . A A . 3 TRP CZ2 1 1
23 4414 1 1 3 TRP CZ3 C -2.263 0.327 12.682 1.00 . A A . 3 TRP CZ3 1 1
23 4415 1 1 3 TRP H H 1.382 3.941 8.586 1.00 . A A . 3 TRP H 1 1
23 4416 1 1 3 TRP HA H 2.735 3.992 11.214 1.00 . A A . 3 TRP HA 1 1
23 4417 1 1 3 TRP HB2 H 1.004 3.276 12.737 1.00 . A A . 3 TRP HB2 1 1
23 4418 1 1 3 TRP HB3 H 0.782 4.909 12.185 1.00 . A A . 3 TRP HB3 1 1
23 4419 1 1 3 TRP HD1 H -1.251 5.390 10.445 1.00 . A A . 3 TRP HD1 1 1
23 4420 1 1 3 TRP HE1 H -3.698 4.358 10.198 1.00 . A A . 3 TRP HE1 1 1
23 4421 1 1 3 TRP HE3 H -0.262 1.086 12.935 1.00 . A A . 3 TRP HE3 1 1
23 4422 1 1 3 TRP HH2 H -4.308 -0.204 12.291 1.00 . A A . 3 TRP HH2 1 1
23 4423 1 1 3 TRP HZ2 H -4.839 1.879 11.063 1.00 . A A . 3 TRP HZ2 1 1
23 4424 1 1 3 TRP HZ3 H -2.058 -0.592 13.212 1.00 . A A . 3 TRP HZ3 1 1
23 4425 1 1 3 TRP N N 1.624 4.405 9.470 1.00 . A A . 3 TRP N 1 1
23 4426 1 1 3 TRP NE1 N -2.887 3.914 10.643 1.00 . A A . 3 TRP NE1 1 1
23 4427 1 1 3 TRP O O 1.128 1.306 10.369 1.00 . A A . 3 TRP O 1 1
23 4428 1 1 4 GLY C C 3.519 0.383 7.924 1.00 . A A . 4 GLY C 1 1
23 4429 1 1 4 GLY CA C 3.699 0.544 9.445 1.00 . A A . 4 GLY CA 1 1
23 4430 1 1 4 GLY H H 3.795 2.744 9.758 1.00 . A A . 4 GLY H 1 1
23 4431 1 1 4 GLY HA2 H 4.755 0.397 9.741 1.00 . A A . 4 GLY HA2 1 1
23 4432 1 1 4 GLY HA3 H 3.144 -0.257 9.969 1.00 . A A . 4 GLY HA3 1 1
23 4433 1 1 4 GLY N N 3.264 1.881 9.902 1.00 . A A . 4 GLY N 1 1
23 4434 1 1 4 GLY O O 2.415 0.068 7.470 1.00 . A A . 4 GLY O 1 1
23 4435 1 1 5 . C C 5.293 1.731 5.055 1.00 . A A . 5 SET C 1 1
23 4436 1 1 5 . CA C 4.573 0.486 5.664 1.00 . A A . 5 SET CA 1 1
23 4437 1 1 5 . CB C 5.166 -0.894 5.228 1.00 . A A . 5 SET CB 1 1
23 4438 1 1 5 . H H 5.473 0.714 7.689 1.00 . A A . 5 SET H 1 1
23 4439 1 1 5 . HA H 3.510 0.536 5.329 1.00 . A A . 5 SET HA 1 1
23 4440 1 1 5 . HB2 H 4.881 2.664 5.489 1.00 . A A . 5 SET HB2 1 1
23 4441 1 1 5 . HB3 H 6.357 1.738 5.356 1.00 . A A . 5 SET HB3 1 1
23 4442 1 1 5 . HNT2 H 6.104 1.635 3.032 1.00 . A A . 5 SET HNT2 1 1
23 4443 1 1 5 . N N 4.603 0.603 7.155 1.00 . A A . 5 SET N 1 1
23 4444 1 1 5 . NT N 5.255 1.844 3.575 1.00 . A A . 5 SET NT 1 1
23 4445 1 1 5 . OG O 6.318 -1.011 4.801 1.00 . A A . 5 SET OG 1 1
23 4446 1 1 6 SER C C 3.290 -4.104 5.226 1.00 . A A . 6 SER C 1 1
23 4447 1 1 6 SER CA C 4.637 -3.350 5.044 1.00 . A A . 6 SER CA 1 1
23 4448 1 1 6 SER CB C 5.751 -3.955 5.937 1.00 . A A . 6 SER CB 1 1
23 4449 1 1 6 SER H H 3.383 -1.617 5.617 1.00 . A A . 6 SER H 1 1
23 4450 1 1 6 SER HA H 4.972 -3.404 3.988 1.00 . A A . 6 SER HA 1 1
23 4451 1 1 6 SER HB2 H 6.686 -3.370 5.844 1.00 . A A . 6 SER HB2 1 1
23 4452 1 1 6 SER HB3 H 5.475 -3.913 7.007 1.00 . A A . 6 SER HB3 1 1
23 4453 1 1 6 SER HG H 5.235 -5.807 5.771 1.00 . A A . 6 SER HG 1 1
23 4454 1 1 6 SER N N 4.326 -1.930 5.372 1.00 . A A . 6 SER N 1 1
23 4455 1 1 6 SER O O 2.771 -4.175 6.349 1.00 . A A . 6 SER O 1 1
23 4456 1 1 6 SER OG O 6.027 -5.302 5.567 1.00 . A A . 6 SER OG 1 1
23 4457 1 1 7 GLY C C 0.263 -4.363 3.922 1.00 . A A . 7 GLY C 1 1
23 4458 1 1 7 GLY CA C 1.401 -5.367 4.220 1.00 . A A . 7 GLY CA 1 1
23 4459 1 1 7 GLY H H 3.243 -4.579 3.267 1.00 . A A . 7 GLY H 1 1
23 4460 1 1 7 GLY HA2 H 1.380 -6.179 3.470 1.00 . A A . 7 GLY HA2 1 1
23 4461 1 1 7 GLY HA3 H 1.242 -5.867 5.196 1.00 . A A . 7 GLY HA3 1 1
23 4462 1 1 7 GLY N N 2.721 -4.676 4.145 1.00 . A A . 7 GLY N 1 1
23 4463 1 1 7 GLY O O -0.385 -4.441 2.875 1.00 . A A . 7 GLY O 1 1
23 4464 1 1 8 LYS C C -0.124 -1.205 4.003 1.00 . A A . 8 LYS C 1 1
23 4465 1 1 8 LYS CA C -0.944 -2.317 4.731 1.00 . A A . 8 LYS CA 1 1
23 4466 1 1 8 LYS CB C -1.447 -1.971 6.162 1.00 . A A . 8 LYS CB 1 1
23 4467 1 1 8 LYS CD C -2.181 0.577 6.115 1.00 . A A . 8 LYS CD 1 1
23 4468 1 1 8 LYS CE C -1.071 1.148 7.027 1.00 . A A . 8 LYS CE 1 1
23 4469 1 1 8 LYS CG C -2.568 -0.911 6.298 1.00 . A A . 8 LYS CG 1 1
23 4470 1 1 8 LYS H H 0.734 -3.427 5.618 1.00 . A A . 8 LYS H 1 1
23 4471 1 1 8 LYS HA H -1.814 -2.637 4.122 1.00 . A A . 8 LYS HA 1 1
23 4472 1 1 8 LYS HB2 H -1.846 -2.901 6.613 1.00 . A A . 8 LYS HB2 1 1
23 4473 1 1 8 LYS HB3 H -0.597 -1.699 6.818 1.00 . A A . 8 LYS HB3 1 1
23 4474 1 1 8 LYS HD2 H -1.882 0.730 5.061 1.00 . A A . 8 LYS HD2 1 1
23 4475 1 1 8 LYS HD3 H -3.092 1.196 6.224 1.00 . A A . 8 LYS HD3 1 1
23 4476 1 1 8 LYS HE2 H -0.129 0.584 6.892 1.00 . A A . 8 LYS HE2 1 1
23 4477 1 1 8 LYS HE3 H -0.831 2.179 6.707 1.00 . A A . 8 LYS HE3 1 1
23 4478 1 1 8 LYS HG2 H -3.386 -1.159 5.594 1.00 . A A . 8 LYS HG2 1 1
23 4479 1 1 8 LYS HG3 H -3.029 -1.024 7.297 1.00 . A A . 8 LYS HG3 1 1
23 4480 1 1 8 LYS HZ1 H -2.230 1.779 8.650 1.00 . A A . 8 LYS HZ1 1 1
23 4481 1 1 8 LYS HZ2 H -1.697 0.225 8.792 1.00 . A A . 8 LYS HZ2 1 1
23 4482 1 1 8 LYS HZ3 H -0.658 1.475 9.053 1.00 . A A . 8 LYS HZ3 1 1
23 4483 1 1 8 LYS N N 0.041 -3.424 4.865 1.00 . A A . 8 LYS N 1 1
23 4484 1 1 8 LYS NZ N -1.435 1.158 8.458 1.00 . A A . 8 LYS NZ 1 1
23 4485 1 1 8 LYS O O 0.573 -0.398 4.628 1.00 . A A . 8 LYS O 1 1
23 4486 1 1 9 LEU C C -0.193 0.947 1.283 1.00 . A A . 9 LEU C 1 1
23 4487 1 1 9 LEU CA C 0.585 -0.296 1.800 1.00 . A A . 9 LEU CA 1 1
23 4488 1 1 9 LEU CB C 1.222 -1.097 0.624 1.00 . A A . 9 LEU CB 1 1
23 4489 1 1 9 LEU CD1 C 2.660 -3.010 -0.247 1.00 . A A . 9 LEU CD1 1 1
23 4490 1 1 9 LEU CD2 C 3.603 -1.521 1.554 1.00 . A A . 9 LEU CD2 1 1
23 4491 1 1 9 LEU CG C 2.314 -2.151 0.983 1.00 . A A . 9 LEU CG 1 1
23 4492 1 1 9 LEU H H -0.701 -2.031 2.289 1.00 . A A . 9 LEU H 1 1
23 4493 1 1 9 LEU HA H 1.457 0.074 2.377 1.00 . A A . 9 LEU HA 1 1
23 4494 1 1 9 LEU HB2 H 0.409 -1.591 0.056 1.00 . A A . 9 LEU HB2 1 1
23 4495 1 1 9 LEU HB3 H 1.666 -0.386 -0.100 1.00 . A A . 9 LEU HB3 1 1
23 4496 1 1 9 LEU HD11 H 3.085 -2.406 -1.072 1.00 . A A . 9 LEU HD11 1 1
23 4497 1 1 9 LEU HD12 H 3.399 -3.796 -0.003 1.00 . A A . 9 LEU HD12 1 1
23 4498 1 1 9 LEU HD13 H 1.768 -3.528 -0.645 1.00 . A A . 9 LEU HD13 1 1
23 4499 1 1 9 LEU HD21 H 3.419 -0.993 2.507 1.00 . A A . 9 LEU HD21 1 1
23 4500 1 1 9 LEU HD22 H 4.372 -2.286 1.771 1.00 . A A . 9 LEU HD22 1 1
23 4501 1 1 9 LEU HD23 H 4.055 -0.792 0.857 1.00 . A A . 9 LEU HD23 1 1
23 4502 1 1 9 LEU HG H 1.908 -2.837 1.750 1.00 . A A . 9 LEU HG 1 1
23 4503 1 1 9 LEU N N -0.198 -1.218 2.659 1.00 . A A . 9 LEU N 1 1
23 4504 1 1 9 LEU O O -0.969 0.893 0.324 1.00 . A A . 9 LEU O 1 1
23 4505 1 1 10 ILE C C 0.779 4.301 1.977 1.00 . A A . 10 ILE C 1 1
23 4506 1 1 10 ILE CA C -0.465 3.418 1.624 1.00 . A A . 10 ILE CA 1 1
23 4507 1 1 10 ILE CB C -1.850 3.739 2.293 1.00 . A A . 10 ILE CB 1 1
23 4508 1 1 10 ILE CD1 C -2.893 5.051 0.304 1.00 . A A . 10 ILE CD1 1 1
23 4509 1 1 10 ILE CG1 C -2.490 5.061 1.785 1.00 . A A . 10 ILE CG1 1 1
23 4510 1 1 10 ILE CG2 C -1.862 3.737 3.841 1.00 . A A . 10 ILE CG2 1 1
23 4511 1 1 10 ILE H H 0.689 1.952 2.763 1.00 . A A . 10 ILE H 1 1
23 4512 1 1 10 ILE HA H -0.610 3.465 0.527 1.00 . A A . 10 ILE HA 1 1
23 4513 1 1 10 ILE HB H -2.536 2.922 1.994 1.00 . A A . 10 ILE HB 1 1
23 4514 1 1 10 ILE HD11 H -3.562 4.200 0.073 1.00 . A A . 10 ILE HD11 1 1
23 4515 1 1 10 ILE HD12 H -3.431 5.977 0.035 1.00 . A A . 10 ILE HD12 1 1
23 4516 1 1 10 ILE HD13 H -2.016 4.978 -0.364 1.00 . A A . 10 ILE HD13 1 1
23 4517 1 1 10 ILE HG12 H -3.404 5.281 2.371 1.00 . A A . 10 ILE HG12 1 1
23 4518 1 1 10 ILE HG13 H -1.812 5.914 1.979 1.00 . A A . 10 ILE HG13 1 1
23 4519 1 1 10 ILE HG21 H -2.892 3.738 4.243 1.00 . A A . 10 ILE HG21 1 1
23 4520 1 1 10 ILE HG22 H -1.356 2.848 4.257 1.00 . A A . 10 ILE HG22 1 1
23 4521 1 1 10 ILE HG23 H -1.354 4.625 4.258 1.00 . A A . 10 ILE HG23 1 1
23 4522 1 1 10 ILE N N 0.059 2.068 1.966 1.00 . A A . 10 ILE N 1 1
23 4523 1 1 10 ILE O O 0.836 4.948 3.027 1.00 . A A . 10 ILE O 1 1
23 4524 1 1 11 GLU C C 3.170 6.399 0.640 1.00 . A A . 11 GLU C 1 1
23 4525 1 1 11 GLU CA C 3.088 4.988 1.309 1.00 . A A . 11 GLU CA 1 1
23 4526 1 1 11 GLU CB C 4.238 4.008 0.884 1.00 . A A . 11 GLU CB 1 1
23 4527 1 1 11 GLU CD C 4.174 2.323 2.923 1.00 . A A . 11 GLU CD 1 1
23 4528 1 1 11 GLU CG C 4.238 2.531 1.390 1.00 . A A . 11 GLU CG 1 1
23 4529 1 1 11 GLU H H 1.586 3.802 0.204 1.00 . A A . 11 GLU H 1 1
23 4530 1 1 11 GLU HA H 3.263 5.109 2.400 1.00 . A A . 11 GLU HA 1 1
23 4531 1 1 11 GLU HB2 H 4.277 3.969 -0.221 1.00 . A A . 11 GLU HB2 1 1
23 4532 1 1 11 GLU HB3 H 5.204 4.465 1.172 1.00 . A A . 11 GLU HB3 1 1
23 4533 1 1 11 GLU HG2 H 3.369 2.008 0.938 1.00 . A A . 11 GLU HG2 1 1
23 4534 1 1 11 GLU HG3 H 5.105 2.003 0.950 1.00 . A A . 11 GLU HG3 1 1
23 4535 1 1 11 GLU N N 1.789 4.305 1.076 1.00 . A A . 11 GLU N 1 1
23 4536 1 1 11 GLU O O 3.966 6.600 -0.282 1.00 . A A . 11 GLU O 1 1
23 4537 1 1 11 GLU OE1 O 3.121 2.590 3.511 1.00 . A A . 11 GLU OE1 1 1
23 4538 1 1 12 THR C C 3.638 9.535 1.111 1.00 . A A . 12 THR C 1 1
23 4539 1 1 12 THR CA C 2.392 8.780 0.540 1.00 . A A . 12 THR CA 1 1
23 4540 1 1 12 THR CB C 1.029 9.532 0.694 1.00 . A A . 12 THR CB 1 1
23 4541 1 1 12 THR CG2 C 0.969 10.895 -0.031 1.00 . A A . 12 THR CG2 1 1
23 4542 1 1 12 THR H H 1.664 7.090 1.795 1.00 . A A . 12 THR H 1 1
23 4543 1 1 12 THR HA H 2.550 8.697 -0.554 1.00 . A A . 12 THR HA 1 1
23 4544 1 1 12 THR HB H 0.818 9.712 1.766 1.00 . A A . 12 THR HB 1 1
23 4545 1 1 12 THR HG1 H 0.051 7.875 0.568 1.00 . A A . 12 THR HG1 1 1
23 4546 1 1 12 THR HG21 H 1.139 10.797 -1.120 1.00 . A A . 12 THR HG21 1 1
23 4547 1 1 12 THR HG22 H -0.018 11.380 0.094 1.00 . A A . 12 THR HG22 1 1
23 4548 1 1 12 THR HG23 H 1.721 11.609 0.351 1.00 . A A . 12 THR HG23 1 1
23 4549 1 1 12 THR N N 2.363 7.388 1.102 1.00 . A A . 12 THR N 1 1
23 4550 1 1 12 THR O O 4.588 9.768 0.359 1.00 . A A . 12 THR O 1 1
23 4551 1 1 12 THR OG1 O -0.029 8.739 0.159 1.00 . A A . 12 THR OG1 1 1
23 4552 1 1 13 THR C C 5.464 9.580 4.063 1.00 . A A . 13 THR C 1 1
23 4553 1 1 13 THR CA C 4.792 10.581 3.069 1.00 . A A . 13 THR CA 1 1
23 4554 1 1 13 THR CB C 4.349 11.922 3.733 1.00 . A A . 13 THR CB 1 1
23 4555 1 1 13 THR CG2 C 3.902 13.017 2.749 1.00 . A A . 13 THR CG2 1 1
23 4556 1 1 13 THR H H 2.783 9.680 2.931 1.00 . A A . 13 THR H 1 1
23 4557 1 1 13 THR HA H 5.566 10.854 2.323 1.00 . A A . 13 THR HA 1 1
23 4558 1 1 13 THR HB H 5.221 12.327 4.280 1.00 . A A . 13 THR HB 1 1
23 4559 1 1 13 THR HG1 H 3.662 11.100 5.333 1.00 . A A . 13 THR HG1 1 1
23 4560 1 1 13 THR HG21 H 4.690 13.248 2.009 1.00 . A A . 13 THR HG21 1 1
23 4561 1 1 13 THR HG22 H 2.997 12.722 2.188 1.00 . A A . 13 THR HG22 1 1
23 4562 1 1 13 THR HG23 H 3.666 13.959 3.278 1.00 . A A . 13 THR HG23 1 1
23 4563 1 1 13 THR N N 3.642 9.892 2.414 1.00 . A A . 13 THR N 1 1
23 4564 1 1 13 THR O O 5.363 9.727 5.286 1.00 . A A . 13 THR O 1 1
23 4565 1 1 13 THR OG1 O 3.307 11.713 4.684 1.00 . A A . 13 THR OG1 1 1
23 4566 1 1 14 ALA C C 8.324 7.910 4.583 1.00 . A A . 14 ALA C 1 1
23 4567 1 1 14 ALA CA C 6.849 7.524 4.337 1.00 . A A . 14 ALA CA 1 1
23 4568 1 1 14 ALA CB C 6.680 6.166 3.628 1.00 . A A . 14 ALA CB 1 1
23 4569 1 1 14 ALA H H 6.171 8.536 2.499 1.00 . A A . 14 ALA H 1 1
23 4570 1 1 14 ALA HXT H 7.619 8.921 6.089 1.00 . A A . 14 ALA HXT 1 1
23 4571 1 1 14 ALA HA H 6.353 7.419 5.322 1.00 . A A . 14 ALA HA 1 1
23 4572 1 1 14 ALA HB1 H 5.613 5.896 3.502 1.00 . A A . 14 ALA HB1 1 1
23 4573 1 1 14 ALA HB2 H 7.140 6.156 2.621 1.00 . A A . 14 ALA HB2 1 1
23 4574 1 1 14 ALA HB3 H 7.147 5.348 4.206 1.00 . A A . 14 ALA HB3 1 1
23 4575 1 1 14 ALA N N 6.171 8.562 3.524 1.00 . A A . 14 ALA N 1 1
23 4576 1 1 14 ALA O O 9.265 7.550 3.872 1.00 . A A . 14 ALA O 1 1
23 4577 1 1 14 ALA OXT O 8.465 8.717 5.684 1.00 . A A . 14 ALA OXT 1 1
24 4578 1 1 1 ACE C C 5.523 10.609 5.309 1.00 . A A . 1 ACE C 1 1
24 4579 1 1 1 ACE CH3 C 5.115 11.670 4.290 1.00 . A A . 1 ACE CH3 1 1
24 4580 1 1 1 ACE H1 H 5.749 12.571 4.379 1.00 . A A . 1 ACE H1 1 1
24 4581 1 1 1 ACE H2 H 5.220 11.297 3.254 1.00 . A A . 1 ACE H2 1 1
24 4582 1 1 1 ACE H3 H 4.066 11.987 4.436 1.00 . A A . 1 ACE H3 1 1
24 4583 1 1 1 ACE O O 6.423 10.836 6.121 1.00 . A A . 1 ACE O 1 1
24 4584 1 1 2 ILE C C 5.681 7.190 5.226 1.00 . A A . 2 ILE C 1 1
24 4585 1 1 2 ILE CA C 5.080 8.296 6.139 1.00 . A A . 2 ILE CA 1 1
24 4586 1 1 2 ILE CB C 3.850 7.890 7.050 1.00 . A A . 2 ILE CB 1 1
24 4587 1 1 2 ILE CD1 C 3.008 5.459 6.543 1.00 . A A . 2 ILE CD1 1 1
24 4588 1 1 2 ILE CG1 C 2.714 6.970 6.492 1.00 . A A . 2 ILE CG1 1 1
24 4589 1 1 2 ILE CG2 C 3.231 9.094 7.804 1.00 . A A . 2 ILE CG2 1 1
24 4590 1 1 2 ILE H H 4.236 9.393 4.417 1.00 . A A . 2 ILE H 1 1
24 4591 1 1 2 ILE HA H 5.873 8.576 6.860 1.00 . A A . 2 ILE HA 1 1
24 4592 1 1 2 ILE HB H 4.300 7.306 7.860 1.00 . A A . 2 ILE HB 1 1
24 4593 1 1 2 ILE HD11 H 3.120 5.104 7.585 1.00 . A A . 2 ILE HD11 1 1
24 4594 1 1 2 ILE HD12 H 2.183 4.878 6.092 1.00 . A A . 2 ILE HD12 1 1
24 4595 1 1 2 ILE HD13 H 3.927 5.177 6.005 1.00 . A A . 2 ILE HD13 1 1
24 4596 1 1 2 ILE HG12 H 1.783 7.097 7.081 1.00 . A A . 2 ILE HG12 1 1
24 4597 1 1 2 ILE HG13 H 2.426 7.260 5.468 1.00 . A A . 2 ILE HG13 1 1
24 4598 1 1 2 ILE HG21 H 2.535 8.769 8.600 1.00 . A A . 2 ILE HG21 1 1
24 4599 1 1 2 ILE HG22 H 4.005 9.712 8.297 1.00 . A A . 2 ILE HG22 1 1
24 4600 1 1 2 ILE HG23 H 2.662 9.758 7.129 1.00 . A A . 2 ILE HG23 1 1
24 4601 1 1 2 ILE N N 4.835 9.463 5.241 1.00 . A A . 2 ILE N 1 1
24 4602 1 1 2 ILE O O 4.997 6.705 4.320 1.00 . A A . 2 ILE O 1 1
24 4603 1 1 3 TRP C C 7.922 4.379 5.255 1.00 . A A . 3 TRP C 1 1
24 4604 1 1 3 TRP CA C 7.641 5.773 4.599 1.00 . A A . 3 TRP CA 1 1
24 4605 1 1 3 TRP CB C 8.907 6.427 3.964 1.00 . A A . 3 TRP CB 1 1
24 4606 1 1 3 TRP CD1 C 7.753 7.782 2.034 1.00 . A A . 3 TRP CD1 1 1
24 4607 1 1 3 TRP CD2 C 8.965 9.009 3.436 1.00 . A A . 3 TRP CD2 1 1
24 4608 1 1 3 TRP CE2 C 8.310 9.856 2.505 1.00 . A A . 3 TRP CE2 1 1
24 4609 1 1 3 TRP CE3 C 9.687 9.564 4.525 1.00 . A A . 3 TRP CE3 1 1
24 4610 1 1 3 TRP CG C 8.635 7.700 3.131 1.00 . A A . 3 TRP CG 1 1
24 4611 1 1 3 TRP CH2 C 9.124 11.789 3.709 1.00 . A A . 3 TRP CH2 1 1
24 4612 1 1 3 TRP CZ2 C 8.391 11.262 2.645 1.00 . A A . 3 TRP CZ2 1 1
24 4613 1 1 3 TRP CZ3 C 9.760 10.954 4.635 1.00 . A A . 3 TRP CZ3 1 1
24 4614 1 1 3 TRP H H 7.508 7.423 6.050 1.00 . A A . 3 TRP H 1 1
24 4615 1 1 3 TRP HA H 6.993 5.507 3.740 1.00 . A A . 3 TRP HA 1 1
24 4616 1 1 3 TRP HB2 H 9.654 6.637 4.752 1.00 . A A . 3 TRP HB2 1 1
24 4617 1 1 3 TRP HB3 H 9.405 5.696 3.300 1.00 . A A . 3 TRP HB3 1 1
24 4618 1 1 3 TRP HD1 H 7.167 6.944 1.689 1.00 . A A . 3 TRP HD1 1 1
24 4619 1 1 3 TRP HE1 H 6.903 9.455 0.901 1.00 . A A . 3 TRP HE1 1 1
24 4620 1 1 3 TRP HE3 H 10.146 8.929 5.269 1.00 . A A . 3 TRP HE3 1 1
24 4621 1 1 3 TRP HH2 H 9.185 12.861 3.832 1.00 . A A . 3 TRP HH2 1 1
24 4622 1 1 3 TRP HZ2 H 7.874 11.917 1.959 1.00 . A A . 3 TRP HZ2 1 1
24 4623 1 1 3 TRP HZ3 H 10.301 11.392 5.462 1.00 . A A . 3 TRP HZ3 1 1
24 4624 1 1 3 TRP N N 6.955 6.804 5.447 1.00 . A A . 3 TRP N 1 1
24 4625 1 1 3 TRP NE1 N 7.558 9.109 1.612 1.00 . A A . 3 TRP NE1 1 1
24 4626 1 1 3 TRP O O 8.629 3.562 4.657 1.00 . A A . 3 TRP O 1 1
24 4627 1 1 4 GLY C C 6.143 2.058 7.143 1.00 . A A . 4 GLY C 1 1
24 4628 1 1 4 GLY CA C 7.499 2.787 7.130 1.00 . A A . 4 GLY CA 1 1
24 4629 1 1 4 GLY H H 6.758 4.837 6.802 1.00 . A A . 4 GLY H 1 1
24 4630 1 1 4 GLY HA2 H 8.295 2.157 6.691 1.00 . A A . 4 GLY HA2 1 1
24 4631 1 1 4 GLY HA3 H 7.815 2.984 8.171 1.00 . A A . 4 GLY HA3 1 1
24 4632 1 1 4 GLY N N 7.345 4.083 6.435 1.00 . A A . 4 GLY N 1 1
24 4633 1 1 4 GLY O O 5.372 2.207 8.095 1.00 . A A . 4 GLY O 1 1
24 4634 1 1 5 . C C 3.493 1.398 5.209 1.00 . A A . 5 SET C 1 1
24 4635 1 1 5 . CA C 4.581 0.536 5.928 1.00 . A A . 5 SET CA 1 1
24 4636 1 1 5 . CB C 4.824 -0.851 5.254 1.00 . A A . 5 SET CB 1 1
24 4637 1 1 5 . H H 6.565 1.319 5.332 1.00 . A A . 5 SET H 1 1
24 4638 1 1 5 . HA H 4.176 0.358 6.944 1.00 . A A . 5 SET HA 1 1
24 4639 1 1 5 . HB2 H 2.537 0.843 5.251 1.00 . A A . 5 SET HB2 1 1
24 4640 1 1 5 . HB3 H 3.289 2.302 5.817 1.00 . A A . 5 SET HB3 1 1
24 4641 1 1 5 . HNT2 H 3.225 1.260 3.053 1.00 . A A . 5 SET HNT2 1 1
24 4642 1 1 5 . N N 5.865 1.278 6.082 1.00 . A A . 5 SET N 1 1
24 4643 1 1 5 . NT N 3.705 1.791 3.788 1.00 . A A . 5 SET NT 1 1
24 4644 1 1 5 . OG O 5.445 -0.932 4.189 1.00 . A A . 5 SET OG 1 1
24 4645 1 1 6 SER C C 3.077 -4.032 5.492 1.00 . A A . 6 SER C 1 1
24 4646 1 1 6 SER CA C 4.460 -3.326 5.378 1.00 . A A . 6 SER CA 1 1
24 4647 1 1 6 SER CB C 5.555 -4.058 6.189 1.00 . A A . 6 SER CB 1 1
24 4648 1 1 6 SER H H 3.812 -1.743 6.753 1.00 . A A . 6 SER H 1 1
24 4649 1 1 6 SER HA H 4.786 -3.313 4.318 1.00 . A A . 6 SER HA 1 1
24 4650 1 1 6 SER HB2 H 6.506 -3.495 6.147 1.00 . A A . 6 SER HB2 1 1
24 4651 1 1 6 SER HB3 H 5.288 -4.126 7.261 1.00 . A A . 6 SER HB3 1 1
24 4652 1 1 6 SER HG H 4.976 -5.863 5.825 1.00 . A A . 6 SER HG 1 1
24 4653 1 1 6 SER N N 4.322 -1.932 5.884 1.00 . A A . 6 SER N 1 1
24 4654 1 1 6 SER O O 2.432 -3.992 6.548 1.00 . A A . 6 SER O 1 1
24 4655 1 1 6 SER OG O 5.783 -5.366 5.672 1.00 . A A . 6 SER OG 1 1
24 4656 1 1 7 GLY C C 0.250 -4.469 3.747 1.00 . A A . 7 GLY C 1 1
24 4657 1 1 7 GLY CA C 1.313 -5.388 4.380 1.00 . A A . 7 GLY CA 1 1
24 4658 1 1 7 GLY H H 3.248 -4.672 3.589 1.00 . A A . 7 GLY H 1 1
24 4659 1 1 7 GLY HA2 H 1.406 -6.307 3.772 1.00 . A A . 7 GLY HA2 1 1
24 4660 1 1 7 GLY HA3 H 0.996 -5.736 5.382 1.00 . A A . 7 GLY HA3 1 1
24 4661 1 1 7 GLY N N 2.632 -4.700 4.409 1.00 . A A . 7 GLY N 1 1
24 4662 1 1 7 GLY O O -0.107 -4.642 2.579 1.00 . A A . 7 GLY O 1 1
24 4663 1 1 8 LYS C C -0.351 -1.303 3.561 1.00 . A A . 8 LYS C 1 1
24 4664 1 1 8 LYS CA C -1.225 -2.484 4.080 1.00 . A A . 8 LYS CA 1 1
24 4665 1 1 8 LYS CB C -2.155 -2.127 5.269 1.00 . A A . 8 LYS CB 1 1
24 4666 1 1 8 LYS CD C -4.134 -0.686 6.124 1.00 . A A . 8 LYS CD 1 1
24 4667 1 1 8 LYS CE C -5.044 -1.771 6.732 1.00 . A A . 8 LYS CE 1 1
24 4668 1 1 8 LYS CG C -3.302 -1.154 4.912 1.00 . A A . 8 LYS CG 1 1
24 4669 1 1 8 LYS H H 0.232 -3.388 5.436 1.00 . A A . 8 LYS H 1 1
24 4670 1 1 8 LYS HA H -1.859 -2.897 3.268 1.00 . A A . 8 LYS HA 1 1
24 4671 1 1 8 LYS HB2 H -2.596 -3.057 5.676 1.00 . A A . 8 LYS HB2 1 1
24 4672 1 1 8 LYS HB3 H -1.555 -1.700 6.098 1.00 . A A . 8 LYS HB3 1 1
24 4673 1 1 8 LYS HD2 H -3.451 -0.276 6.894 1.00 . A A . 8 LYS HD2 1 1
24 4674 1 1 8 LYS HD3 H -4.751 0.170 5.795 1.00 . A A . 8 LYS HD3 1 1
24 4675 1 1 8 LYS HE2 H -5.716 -2.188 5.957 1.00 . A A . 8 LYS HE2 1 1
24 4676 1 1 8 LYS HE3 H -4.439 -2.623 7.101 1.00 . A A . 8 LYS HE3 1 1
24 4677 1 1 8 LYS HG2 H -2.874 -0.255 4.428 1.00 . A A . 8 LYS HG2 1 1
24 4678 1 1 8 LYS HG3 H -3.961 -1.604 4.145 1.00 . A A . 8 LYS HG3 1 1
24 4679 1 1 8 LYS HZ1 H -5.258 -0.856 8.598 1.00 . A A . 8 LYS HZ1 1 1
24 4680 1 1 8 LYS HZ2 H -6.452 -0.453 7.535 1.00 . A A . 8 LYS HZ2 1 1
24 4681 1 1 8 LYS HZ3 H -6.462 -1.934 8.264 1.00 . A A . 8 LYS HZ3 1 1
24 4682 1 1 8 LYS N N -0.245 -3.498 4.539 1.00 . A A . 8 LYS N 1 1
24 4683 1 1 8 LYS NZ N -5.849 -1.225 7.844 1.00 . A A . 8 LYS NZ 1 1
24 4684 1 1 8 LYS O O 0.076 -0.428 4.322 1.00 . A A . 8 LYS O 1 1
24 4685 1 1 9 LEU C C 0.024 1.009 1.259 1.00 . A A . 9 LEU C 1 1
24 4686 1 1 9 LEU CA C 0.778 -0.318 1.574 1.00 . A A . 9 LEU CA 1 1
24 4687 1 1 9 LEU CB C 1.455 -0.934 0.312 1.00 . A A . 9 LEU CB 1 1
24 4688 1 1 9 LEU CD1 C 2.943 -2.663 -0.812 1.00 . A A . 9 LEU CD1 1 1
24 4689 1 1 9 LEU CD2 C 3.791 -1.518 1.265 1.00 . A A . 9 LEU CD2 1 1
24 4690 1 1 9 LEU CG C 2.535 -2.037 0.534 1.00 . A A . 9 LEU CG 1 1
24 4691 1 1 9 LEU H H -0.461 -2.158 1.779 1.00 . A A . 9 LEU H 1 1
24 4692 1 1 9 LEU HA H 1.615 -0.071 2.258 1.00 . A A . 9 LEU HA 1 1
24 4693 1 1 9 LEU HB2 H 0.661 -1.325 -0.355 1.00 . A A . 9 LEU HB2 1 1
24 4694 1 1 9 LEU HB3 H 1.923 -0.120 -0.274 1.00 . A A . 9 LEU HB3 1 1
24 4695 1 1 9 LEU HD11 H 2.075 -3.102 -1.338 1.00 . A A . 9 LEU HD11 1 1
24 4696 1 1 9 LEU HD12 H 3.400 -1.923 -1.497 1.00 . A A . 9 LEU HD12 1 1
24 4697 1 1 9 LEU HD13 H 3.677 -3.481 -0.679 1.00 . A A . 9 LEU HD13 1 1
24 4698 1 1 9 LEU HD21 H 4.269 -0.675 0.731 1.00 . A A . 9 LEU HD21 1 1
24 4699 1 1 9 LEU HD22 H 3.558 -1.171 2.287 1.00 . A A . 9 LEU HD22 1 1
24 4700 1 1 9 LEU HD23 H 4.556 -2.310 1.378 1.00 . A A . 9 LEU HD23 1 1
24 4701 1 1 9 LEU HG H 2.109 -2.851 1.148 1.00 . A A . 9 LEU HG 1 1
24 4702 1 1 9 LEU N N -0.082 -1.327 2.245 1.00 . A A . 9 LEU N 1 1
24 4703 1 1 9 LEU O O -0.613 1.172 0.215 1.00 . A A . 9 LEU O 1 1
24 4704 1 1 10 ILE C C 0.638 4.235 2.726 1.00 . A A . 10 ILE C 1 1
24 4705 1 1 10 ILE CA C -0.468 3.304 2.134 1.00 . A A . 10 ILE CA 1 1
24 4706 1 1 10 ILE CB C -1.904 3.360 2.780 1.00 . A A . 10 ILE CB 1 1
24 4707 1 1 10 ILE CD1 C -2.880 5.222 1.244 1.00 . A A . 10 ILE CD1 1 1
24 4708 1 1 10 ILE CG1 C -2.593 4.750 2.676 1.00 . A A . 10 ILE CG1 1 1
24 4709 1 1 10 ILE CG2 C -2.001 2.862 4.246 1.00 . A A . 10 ILE CG2 1 1
24 4710 1 1 10 ILE H H 0.588 1.635 3.072 1.00 . A A . 10 ILE H 1 1
24 4711 1 1 10 ILE HA H -0.590 3.578 1.067 1.00 . A A . 10 ILE HA 1 1
24 4712 1 1 10 ILE HB H -2.531 2.657 2.196 1.00 . A A . 10 ILE HB 1 1
24 4713 1 1 10 ILE HD11 H -3.447 6.170 1.246 1.00 . A A . 10 ILE HD11 1 1
24 4714 1 1 10 ILE HD12 H -1.950 5.400 0.674 1.00 . A A . 10 ILE HD12 1 1
24 4715 1 1 10 ILE HD13 H -3.481 4.480 0.685 1.00 . A A . 10 ILE HD13 1 1
24 4716 1 1 10 ILE HG12 H -3.561 4.728 3.212 1.00 . A A . 10 ILE HG12 1 1
24 4717 1 1 10 ILE HG13 H -1.993 5.516 3.201 1.00 . A A . 10 ILE HG13 1 1
24 4718 1 1 10 ILE HG21 H -3.049 2.812 4.596 1.00 . A A . 10 ILE HG21 1 1
24 4719 1 1 10 ILE HG22 H -1.583 1.847 4.369 1.00 . A A . 10 ILE HG22 1 1
24 4720 1 1 10 ILE HG23 H -1.460 3.521 4.946 1.00 . A A . 10 ILE HG23 1 1
24 4721 1 1 10 ILE N N 0.128 1.946 2.213 1.00 . A A . 10 ILE N 1 1
24 4722 1 1 10 ILE O O 0.573 4.649 3.888 1.00 . A A . 10 ILE O 1 1
24 4723 1 1 11 GLU C C 2.602 6.928 2.079 1.00 . A A . 11 GLU C 1 1
24 4724 1 1 11 GLU CA C 2.812 5.397 2.338 1.00 . A A . 11 GLU CA 1 1
24 4725 1 1 11 GLU CB C 4.112 4.821 1.688 1.00 . A A . 11 GLU CB 1 1
24 4726 1 1 11 GLU CD C 4.425 2.886 3.439 1.00 . A A . 11 GLU CD 1 1
24 4727 1 1 11 GLU CG C 4.502 3.337 1.957 1.00 . A A . 11 GLU CG 1 1
24 4728 1 1 11 GLU H H 1.634 4.120 0.979 1.00 . A A . 11 GLU H 1 1
24 4729 1 1 11 GLU HA H 2.983 5.265 3.427 1.00 . A A . 11 GLU HA 1 1
24 4730 1 1 11 GLU HB2 H 4.080 4.978 0.592 1.00 . A A . 11 GLU HB2 1 1
24 4731 1 1 11 GLU HB3 H 4.962 5.445 2.022 1.00 . A A . 11 GLU HB3 1 1
24 4732 1 1 11 GLU HG2 H 3.907 2.685 1.292 1.00 . A A . 11 GLU HG2 1 1
24 4733 1 1 11 GLU HG3 H 5.546 3.209 1.600 1.00 . A A . 11 GLU HG3 1 1
24 4734 1 1 11 GLU N N 1.659 4.563 1.903 1.00 . A A . 11 GLU N 1 1
24 4735 1 1 11 GLU O O 3.352 7.548 1.316 1.00 . A A . 11 GLU O 1 1
24 4736 1 1 11 GLU OE1 O 5.020 3.569 4.274 1.00 . A A . 11 GLU OE1 1 1
24 4737 1 1 12 THR C C 0.939 9.563 3.996 1.00 . A A . 12 THR C 1 1
24 4738 1 1 12 THR CA C 1.283 8.997 2.583 1.00 . A A . 12 THR CA 1 1
24 4739 1 1 12 THR CB C 0.224 9.258 1.460 1.00 . A A . 12 THR CB 1 1
24 4740 1 1 12 THR CG2 C -0.016 10.748 1.164 1.00 . A A . 12 THR CG2 1 1
24 4741 1 1 12 THR H H 0.933 6.925 3.219 1.00 . A A . 12 THR H 1 1
24 4742 1 1 12 THR HA H 2.206 9.527 2.269 1.00 . A A . 12 THR HA 1 1
24 4743 1 1 12 THR HB H -0.742 8.800 1.751 1.00 . A A . 12 THR HB 1 1
24 4744 1 1 12 THR HG1 H 1.510 9.004 0.049 1.00 . A A . 12 THR HG1 1 1
24 4745 1 1 12 THR HG21 H -0.395 11.289 2.049 1.00 . A A . 12 THR HG21 1 1
24 4746 1 1 12 THR HG22 H 0.910 11.258 0.840 1.00 . A A . 12 THR HG22 1 1
24 4747 1 1 12 THR HG23 H -0.763 10.883 0.361 1.00 . A A . 12 THR HG23 1 1
24 4748 1 1 12 THR N N 1.589 7.546 2.731 1.00 . A A . 12 THR N 1 1
24 4749 1 1 12 THR O O 1.791 10.232 4.588 1.00 . A A . 12 THR O 1 1
24 4750 1 1 12 THR OG1 O 0.631 8.662 0.232 1.00 . A A . 12 THR OG1 1 1
24 4751 1 1 13 THR C C -0.865 8.650 6.930 1.00 . A A . 13 THR C 1 1
24 4752 1 1 13 THR CA C -0.711 9.794 5.876 1.00 . A A . 13 THR CA 1 1
24 4753 1 1 13 THR CB C -2.002 10.667 5.786 1.00 . A A . 13 THR CB 1 1
24 4754 1 1 13 THR CG2 C -1.813 12.026 5.092 1.00 . A A . 13 THR CG2 1 1
24 4755 1 1 13 THR H H -0.935 8.833 3.907 1.00 . A A . 13 THR H 1 1
24 4756 1 1 13 THR HA H 0.069 10.461 6.295 1.00 . A A . 13 THR HA 1 1
24 4757 1 1 13 THR HB H -2.338 10.889 6.816 1.00 . A A . 13 THR HB 1 1
24 4758 1 1 13 THR HG1 H -3.797 10.583 5.090 1.00 . A A . 13 THR HG1 1 1
24 4759 1 1 13 THR HG21 H -1.531 11.912 4.030 1.00 . A A . 13 THR HG21 1 1
24 4760 1 1 13 THR HG22 H -2.741 12.627 5.120 1.00 . A A . 13 THR HG22 1 1
24 4761 1 1 13 THR HG23 H -1.025 12.628 5.580 1.00 . A A . 13 THR HG23 1 1
24 4762 1 1 13 THR N N -0.273 9.302 4.533 1.00 . A A . 13 THR N 1 1
24 4763 1 1 13 THR O O -0.304 8.770 8.023 1.00 . A A . 13 THR O 1 1
24 4764 1 1 13 THR OG1 O -3.059 9.969 5.130 1.00 . A A . 13 THR OG1 1 1
24 4765 1 1 14 ALA C C -0.604 5.509 7.712 1.00 . A A . 14 ALA C 1 1
24 4766 1 1 14 ALA CA C -1.834 6.440 7.576 1.00 . A A . 14 ALA CA 1 1
24 4767 1 1 14 ALA CB C -3.094 5.679 7.123 1.00 . A A . 14 ALA CB 1 1
24 4768 1 1 14 ALA H H -2.047 7.585 5.701 1.00 . A A . 14 ALA H 1 1
24 4769 1 1 14 ALA HXT H -0.138 6.641 9.225 1.00 . A A . 14 ALA HXT 1 1
24 4770 1 1 14 ALA HA H -2.066 6.856 8.576 1.00 . A A . 14 ALA HA 1 1
24 4771 1 1 14 ALA HB1 H -3.335 4.848 7.813 1.00 . A A . 14 ALA HB1 1 1
24 4772 1 1 14 ALA HB2 H -3.985 6.334 7.094 1.00 . A A . 14 ALA HB2 1 1
24 4773 1 1 14 ALA HB3 H -2.980 5.238 6.113 1.00 . A A . 14 ALA HB3 1 1
24 4774 1 1 14 ALA N N -1.612 7.563 6.630 1.00 . A A . 14 ALA N 1 1
24 4775 1 1 14 ALA O O -0.356 4.570 6.954 1.00 . A A . 14 ALA O 1 1
24 4776 1 1 14 ALA OXT O 0.185 5.854 8.780 1.00 . A A . 14 ALA OXT 1 1
25 4777 1 1 1 ACE C C 3.865 10.597 7.180 1.00 . A A . 1 ACE C 1 1
25 4778 1 1 1 ACE CH3 C 3.239 11.823 6.526 1.00 . A A . 1 ACE CH3 1 1
25 4779 1 1 1 ACE H1 H 3.741 12.748 6.860 1.00 . A A . 1 ACE H1 1 1
25 4780 1 1 1 ACE H2 H 3.314 11.796 5.424 1.00 . A A . 1 ACE H2 1 1
25 4781 1 1 1 ACE H3 H 2.171 11.910 6.796 1.00 . A A . 1 ACE H3 1 1
25 4782 1 1 1 ACE O O 4.553 10.730 8.194 1.00 . A A . 1 ACE O 1 1
25 4783 1 1 2 ILE C C 4.772 7.359 5.924 1.00 . A A . 2 ILE C 1 1
25 4784 1 1 2 ILE CA C 4.130 8.119 7.117 1.00 . A A . 2 ILE CA 1 1
25 4785 1 1 2 ILE CB C 3.096 7.300 7.989 1.00 . A A . 2 ILE CB 1 1
25 4786 1 1 2 ILE CD1 C 2.156 5.176 6.766 1.00 . A A . 2 ILE CD1 1 1
25 4787 1 1 2 ILE CG1 C 1.875 6.585 7.319 1.00 . A A . 2 ILE CG1 1 1
25 4788 1 1 2 ILE CG2 C 2.620 8.096 9.231 1.00 . A A . 2 ILE CG2 1 1
25 4789 1 1 2 ILE H H 3.148 9.461 5.692 1.00 . A A . 2 ILE H 1 1
25 4790 1 1 2 ILE HA H 4.974 8.346 7.795 1.00 . A A . 2 ILE HA 1 1
25 4791 1 1 2 ILE HB H 3.685 6.488 8.426 1.00 . A A . 2 ILE HB 1 1
25 4792 1 1 2 ILE HD11 H 2.587 4.511 7.537 1.00 . A A . 2 ILE HD11 1 1
25 4793 1 1 2 ILE HD12 H 1.228 4.693 6.412 1.00 . A A . 2 ILE HD12 1 1
25 4794 1 1 2 ILE HD13 H 2.852 5.177 5.912 1.00 . A A . 2 ILE HD13 1 1
25 4795 1 1 2 ILE HG12 H 1.063 6.437 8.062 1.00 . A A . 2 ILE HG12 1 1
25 4796 1 1 2 ILE HG13 H 1.421 7.217 6.537 1.00 . A A . 2 ILE HG13 1 1
25 4797 1 1 2 ILE HG21 H 2.071 7.457 9.948 1.00 . A A . 2 ILE HG21 1 1
25 4798 1 1 2 ILE HG22 H 3.470 8.535 9.787 1.00 . A A . 2 ILE HG22 1 1
25 4799 1 1 2 ILE HG23 H 1.947 8.929 8.955 1.00 . A A . 2 ILE HG23 1 1
25 4800 1 1 2 ILE N N 3.603 9.413 6.602 1.00 . A A . 2 ILE N 1 1
25 4801 1 1 2 ILE O O 4.080 7.040 4.950 1.00 . A A . 2 ILE O 1 1
25 4802 1 1 3 TRP C C 7.584 5.109 5.405 1.00 . A A . 3 TRP C 1 1
25 4803 1 1 3 TRP CA C 6.822 6.375 4.883 1.00 . A A . 3 TRP CA 1 1
25 4804 1 1 3 TRP CB C 7.715 7.369 4.086 1.00 . A A . 3 TRP CB 1 1
25 4805 1 1 3 TRP CD1 C 5.984 8.703 2.622 1.00 . A A . 3 TRP CD1 1 1
25 4806 1 1 3 TRP CD2 C 7.047 9.903 4.156 1.00 . A A . 3 TRP CD2 1 1
25 4807 1 1 3 TRP CE2 C 6.097 10.719 3.491 1.00 . A A . 3 TRP CE2 1 1
25 4808 1 1 3 TRP CE3 C 7.711 10.372 5.316 1.00 . A A . 3 TRP CE3 1 1
25 4809 1 1 3 TRP CG C 7.011 8.646 3.582 1.00 . A A . 3 TRP CG 1 1
25 4810 1 1 3 TRP CH2 C 6.543 12.495 5.073 1.00 . A A . 3 TRP CH2 1 1
25 4811 1 1 3 TRP CZ2 C 5.846 12.033 3.955 1.00 . A A . 3 TRP CZ2 1 1
25 4812 1 1 3 TRP CZ3 C 7.456 11.674 5.749 1.00 . A A . 3 TRP CZ3 1 1
25 4813 1 1 3 TRP H H 6.638 7.659 6.653 1.00 . A A . 3 TRP H 1 1
25 4814 1 1 3 TRP HA H 6.095 5.977 4.148 1.00 . A A . 3 TRP HA 1 1
25 4815 1 1 3 TRP HB2 H 8.594 7.650 4.696 1.00 . A A . 3 TRP HB2 1 1
25 4816 1 1 3 TRP HB3 H 8.148 6.845 3.213 1.00 . A A . 3 TRP HB3 1 1
25 4817 1 1 3 TRP HD1 H 5.545 7.821 2.191 1.00 . A A . 3 TRP HD1 1 1
25 4818 1 1 3 TRP HE1 H 4.595 10.277 1.992 1.00 . A A . 3 TRP HE1 1 1
25 4819 1 1 3 TRP HE3 H 8.345 9.705 5.885 1.00 . A A . 3 TRP HE3 1 1
25 4820 1 1 3 TRP HH2 H 6.350 13.491 5.444 1.00 . A A . 3 TRP HH2 1 1
25 4821 1 1 3 TRP HZ2 H 5.102 12.654 3.476 1.00 . A A . 3 TRP HZ2 1 1
25 4822 1 1 3 TRP HZ3 H 7.946 12.044 6.637 1.00 . A A . 3 TRP HZ3 1 1
25 4823 1 1 3 TRP N N 6.100 7.099 5.980 1.00 . A A . 3 TRP N 1 1
25 4824 1 1 3 TRP NE1 N 5.428 9.993 2.519 1.00 . A A . 3 TRP NE1 1 1
25 4825 1 1 3 TRP O O 8.772 4.896 5.145 1.00 . A A . 3 TRP O 1 1
25 4826 1 1 4 GLY C C 6.048 2.128 6.889 1.00 . A A . 4 GLY C 1 1
25 4827 1 1 4 GLY CA C 7.309 2.987 6.697 1.00 . A A . 4 GLY CA 1 1
25 4828 1 1 4 GLY H H 5.932 4.658 6.377 1.00 . A A . 4 GLY H 1 1
25 4829 1 1 4 GLY HA2 H 8.053 2.495 6.043 1.00 . A A . 4 GLY HA2 1 1
25 4830 1 1 4 GLY HA3 H 7.793 3.181 7.672 1.00 . A A . 4 GLY HA3 1 1
25 4831 1 1 4 GLY N N 6.837 4.258 6.120 1.00 . A A . 4 GLY N 1 1
25 4832 1 1 4 GLY O O 5.395 2.215 7.933 1.00 . A A . 4 GLY O 1 1
25 4833 1 1 5 . C C 3.299 1.255 5.197 1.00 . A A . 5 SET C 1 1
25 4834 1 1 5 . CA C 4.479 0.475 5.871 1.00 . A A . 5 SET CA 1 1
25 4835 1 1 5 . CB C 4.727 -0.919 5.218 1.00 . A A . 5 SET CB 1 1
25 4836 1 1 5 . H H 6.324 1.375 5.051 1.00 . A A . 5 SET H 1 1
25 4837 1 1 5 . HA H 4.162 0.322 6.923 1.00 . A A . 5 SET HA 1 1
25 4838 1 1 5 . HB2 H 2.393 0.622 5.233 1.00 . A A . 5 SET HB2 1 1
25 4839 1 1 5 . HB3 H 3.030 2.123 5.833 1.00 . A A . 5 SET HB3 1 1
25 4840 1 1 5 . HNT2 H 3.195 1.056 3.038 1.00 . A A . 5 SET HNT2 1 1
25 4841 1 1 5 . N N 5.713 1.310 5.874 1.00 . A A . 5 SET N 1 1
25 4842 1 1 5 . NT N 3.482 1.700 3.785 1.00 . A A . 5 SET NT 1 1
25 4843 1 1 5 . OG O 5.221 -1.010 4.090 1.00 . A A . 5 SET OG 1 1
25 4844 1 1 6 SER C C 3.128 -4.103 5.576 1.00 . A A . 6 SER C 1 1
25 4845 1 1 6 SER CA C 4.514 -3.404 5.474 1.00 . A A . 6 SER CA 1 1
25 4846 1 1 6 SER CB C 5.576 -4.136 6.329 1.00 . A A . 6 SER CB 1 1
25 4847 1 1 6 SER H H 3.920 -1.797 6.844 1.00 . A A . 6 SER H 1 1
25 4848 1 1 6 SER HA H 4.868 -3.429 4.423 1.00 . A A . 6 SER HA 1 1
25 4849 1 1 6 SER HB2 H 5.327 -4.094 7.408 1.00 . A A . 6 SER HB2 1 1
25 4850 1 1 6 SER HB3 H 5.609 -5.210 6.068 1.00 . A A . 6 SER HB3 1 1
25 4851 1 1 6 SER HG H 6.794 -2.643 6.309 1.00 . A A . 6 SER HG 1 1
25 4852 1 1 6 SER N N 4.362 -1.998 5.942 1.00 . A A . 6 SER N 1 1
25 4853 1 1 6 SER O O 2.488 -4.079 6.635 1.00 . A A . 6 SER O 1 1
25 4854 1 1 6 SER OG O 6.870 -3.581 6.116 1.00 . A A . 6 SER OG 1 1
25 4855 1 1 7 GLY C C 0.291 -4.508 3.773 1.00 . A A . 7 GLY C 1 1
25 4856 1 1 7 GLY CA C 1.345 -5.414 4.441 1.00 . A A . 7 GLY CA 1 1
25 4857 1 1 7 GLY H H 3.273 -4.689 3.652 1.00 . A A . 7 GLY H 1 1
25 4858 1 1 7 GLY HA2 H 1.442 -6.347 3.857 1.00 . A A . 7 GLY HA2 1 1
25 4859 1 1 7 GLY HA3 H 1.007 -5.740 5.445 1.00 . A A . 7 GLY HA3 1 1
25 4860 1 1 7 GLY N N 2.667 -4.736 4.479 1.00 . A A . 7 GLY N 1 1
25 4861 1 1 7 GLY O O -0.065 -4.722 2.612 1.00 . A A . 7 GLY O 1 1
25 4862 1 1 8 LYS C C -0.337 -1.293 3.523 1.00 . A A . 8 LYS C 1 1
25 4863 1 1 8 LYS CA C -1.177 -2.507 4.022 1.00 . A A . 8 LYS CA 1 1
25 4864 1 1 8 LYS CB C -2.161 -2.178 5.175 1.00 . A A . 8 LYS CB 1 1
25 4865 1 1 8 LYS CD C -4.216 -0.807 5.963 1.00 . A A . 8 LYS CD 1 1
25 4866 1 1 8 LYS CE C -5.126 -1.927 6.506 1.00 . A A . 8 LYS CE 1 1
25 4867 1 1 8 LYS CG C -3.317 -1.228 4.783 1.00 . A A . 8 LYS CG 1 1
25 4868 1 1 8 LYS H H 0.247 -3.385 5.437 1.00 . A A . 8 LYS H 1 1
25 4869 1 1 8 LYS HA H -1.774 -2.935 3.190 1.00 . A A . 8 LYS HA 1 1
25 4870 1 1 8 LYS HB2 H -2.597 -3.120 5.559 1.00 . A A . 8 LYS HB2 1 1
25 4871 1 1 8 LYS HB3 H -1.606 -1.745 6.031 1.00 . A A . 8 LYS HB3 1 1
25 4872 1 1 8 LYS HD2 H -3.582 -0.398 6.774 1.00 . A A . 8 LYS HD2 1 1
25 4873 1 1 8 LYS HD3 H -4.839 0.041 5.624 1.00 . A A . 8 LYS HD3 1 1
25 4874 1 1 8 LYS HE2 H -5.749 -2.345 5.689 1.00 . A A . 8 LYS HE2 1 1
25 4875 1 1 8 LYS HE3 H -4.519 -2.771 6.887 1.00 . A A . 8 LYS HE3 1 1
25 4876 1 1 8 LYS HG2 H -2.891 -0.308 4.338 1.00 . A A . 8 LYS HG2 1 1
25 4877 1 1 8 LYS HG3 H -3.928 -1.680 3.979 1.00 . A A . 8 LYS HG3 1 1
25 4878 1 1 8 LYS HZ1 H -5.456 -1.056 8.376 1.00 . A A . 8 LYS HZ1 1 1
25 4879 1 1 8 LYS HZ2 H -6.606 -0.660 7.263 1.00 . A A . 8 LYS HZ2 1 1
25 4880 1 1 8 LYS HZ3 H -6.614 -2.156 7.961 1.00 . A A . 8 LYS HZ3 1 1
25 4881 1 1 8 LYS N N -0.196 -3.501 4.522 1.00 . A A . 8 LYS N 1 1
25 4882 1 1 8 LYS NZ N -5.999 -1.423 7.586 1.00 . A A . 8 LYS NZ 1 1
25 4883 1 1 8 LYS O O 0.019 -0.397 4.297 1.00 . A A . 8 LYS O 1 1
25 4884 1 1 9 LEU C C -0.015 1.070 1.304 1.00 . A A . 9 LEU C 1 1
25 4885 1 1 9 LEU CA C 0.796 -0.234 1.577 1.00 . A A . 9 LEU CA 1 1
25 4886 1 1 9 LEU CB C 1.486 -0.776 0.287 1.00 . A A . 9 LEU CB 1 1
25 4887 1 1 9 LEU CD1 C 2.556 -3.016 1.068 1.00 . A A . 9 LEU CD1 1 1
25 4888 1 1 9 LEU CD2 C 3.554 -1.740 -0.853 1.00 . A A . 9 LEU CD2 1 1
25 4889 1 1 9 LEU CG C 2.785 -1.613 0.478 1.00 . A A . 9 LEU CG 1 1
25 4890 1 1 9 LEU H H -0.198 -2.197 1.763 1.00 . A A . 9 LEU H 1 1
25 4891 1 1 9 LEU HA H 1.629 0.013 2.268 1.00 . A A . 9 LEU HA 1 1
25 4892 1 1 9 LEU HB2 H 0.759 -1.326 -0.344 1.00 . A A . 9 LEU HB2 1 1
25 4893 1 1 9 LEU HB3 H 1.763 0.100 -0.333 1.00 . A A . 9 LEU HB3 1 1
25 4894 1 1 9 LEU HD11 H 2.152 -2.963 2.094 1.00 . A A . 9 LEU HD11 1 1
25 4895 1 1 9 LEU HD12 H 1.848 -3.615 0.464 1.00 . A A . 9 LEU HD12 1 1
25 4896 1 1 9 LEU HD13 H 3.497 -3.593 1.140 1.00 . A A . 9 LEU HD13 1 1
25 4897 1 1 9 LEU HD21 H 2.971 -2.283 -1.621 1.00 . A A . 9 LEU HD21 1 1
25 4898 1 1 9 LEU HD22 H 3.810 -0.750 -1.274 1.00 . A A . 9 LEU HD22 1 1
25 4899 1 1 9 LEU HD23 H 4.511 -2.281 -0.724 1.00 . A A . 9 LEU HD23 1 1
25 4900 1 1 9 LEU HG H 3.438 -1.065 1.183 1.00 . A A . 9 LEU HG 1 1
25 4901 1 1 9 LEU N N -0.027 -1.294 2.216 1.00 . A A . 9 LEU N 1 1
25 4902 1 1 9 LEU O O -0.734 1.198 0.309 1.00 . A A . 9 LEU O 1 1
25 4903 1 1 10 ILE C C 0.623 4.339 2.661 1.00 . A A . 10 ILE C 1 1
25 4904 1 1 10 ILE CA C -0.503 3.370 2.177 1.00 . A A . 10 ILE CA 1 1
25 4905 1 1 10 ILE CB C -1.883 3.406 2.936 1.00 . A A . 10 ILE CB 1 1
25 4906 1 1 10 ILE CD1 C -2.983 5.250 1.462 1.00 . A A . 10 ILE CD1 1 1
25 4907 1 1 10 ILE CG1 C -2.602 4.783 2.873 1.00 . A A . 10 ILE CG1 1 1
25 4908 1 1 10 ILE CG2 C -1.853 2.915 4.408 1.00 . A A . 10 ILE CG2 1 1
25 4909 1 1 10 ILE H H 0.678 1.748 3.053 1.00 . A A . 10 ILE H 1 1
25 4910 1 1 10 ILE HA H -0.715 3.619 1.118 1.00 . A A . 10 ILE HA 1 1
25 4911 1 1 10 ILE HB H -2.543 2.689 2.407 1.00 . A A . 10 ILE HB 1 1
25 4912 1 1 10 ILE HD11 H -2.091 5.450 0.840 1.00 . A A . 10 ILE HD11 1 1
25 4913 1 1 10 ILE HD12 H -3.598 4.495 0.936 1.00 . A A . 10 ILE HD12 1 1
25 4914 1 1 10 ILE HD13 H -3.569 6.186 1.500 1.00 . A A . 10 ILE HD13 1 1
25 4915 1 1 10 ILE HG12 H -3.534 4.743 3.469 1.00 . A A . 10 ILE HG12 1 1
25 4916 1 1 10 ILE HG13 H -1.986 5.561 3.362 1.00 . A A . 10 ILE HG13 1 1
25 4917 1 1 10 ILE HG21 H -2.862 2.906 4.861 1.00 . A A . 10 ILE HG21 1 1
25 4918 1 1 10 ILE HG22 H -1.468 1.883 4.489 1.00 . A A . 10 ILE HG22 1 1
25 4919 1 1 10 ILE HG23 H -1.215 3.547 5.051 1.00 . A A . 10 ILE HG23 1 1
25 4920 1 1 10 ILE N N 0.132 2.026 2.234 1.00 . A A . 10 ILE N 1 1
25 4921 1 1 10 ILE O O 0.616 4.809 3.802 1.00 . A A . 10 ILE O 1 1
25 4922 1 1 11 GLU C C 2.621 6.951 1.564 1.00 . A A . 11 GLU C 1 1
25 4923 1 1 11 GLU CA C 2.764 5.491 2.101 1.00 . A A . 11 GLU CA 1 1
25 4924 1 1 11 GLU CB C 4.062 4.773 1.610 1.00 . A A . 11 GLU CB 1 1
25 4925 1 1 11 GLU CD C 4.058 2.889 3.470 1.00 . A A . 11 GLU CD 1 1
25 4926 1 1 11 GLU CG C 4.313 3.282 1.988 1.00 . A A . 11 GLU CG 1 1
25 4927 1 1 11 GLU H H 1.520 4.150 0.868 1.00 . A A . 11 GLU H 1 1
25 4928 1 1 11 GLU HA H 2.903 5.539 3.201 1.00 . A A . 11 GLU HA 1 1
25 4929 1 1 11 GLU HB2 H 4.131 4.851 0.508 1.00 . A A . 11 GLU HB2 1 1
25 4930 1 1 11 GLU HB3 H 4.926 5.359 1.978 1.00 . A A . 11 GLU HB3 1 1
25 4931 1 1 11 GLU HG2 H 3.730 2.654 1.291 1.00 . A A . 11 GLU HG2 1 1
25 4932 1 1 11 GLU HG3 H 5.372 3.070 1.732 1.00 . A A . 11 GLU HG3 1 1
25 4933 1 1 11 GLU N N 1.591 4.639 1.766 1.00 . A A . 11 GLU N 1 1
25 4934 1 1 11 GLU O O 3.358 7.360 0.659 1.00 . A A . 11 GLU O 1 1
25 4935 1 1 11 GLU OE1 O 4.411 3.687 4.344 1.00 . A A . 11 GLU OE1 1 1
25 4936 1 1 12 THR C C 1.257 10.000 2.981 1.00 . A A . 12 THR C 1 1
25 4937 1 1 12 THR CA C 1.459 9.160 1.684 1.00 . A A . 12 THR CA 1 1
25 4938 1 1 12 THR CB C 0.351 9.272 0.585 1.00 . A A . 12 THR CB 1 1
25 4939 1 1 12 THR CG2 C 0.173 10.693 0.022 1.00 . A A . 12 THR CG2 1 1
25 4940 1 1 12 THR H H 0.997 7.293 2.732 1.00 . A A . 12 THR H 1 1
25 4941 1 1 12 THR HA H 2.392 9.550 1.228 1.00 . A A . 12 THR HA 1 1
25 4942 1 1 12 THR HB H -0.618 8.936 1.000 1.00 . A A . 12 THR HB 1 1
25 4943 1 1 12 THR HG1 H 1.541 8.682 -0.812 1.00 . A A . 12 THR HG1 1 1
25 4944 1 1 12 THR HG21 H -0.607 10.719 -0.761 1.00 . A A . 12 THR HG21 1 1
25 4945 1 1 12 THR HG22 H -0.133 11.410 0.805 1.00 . A A . 12 THR HG22 1 1
25 4946 1 1 12 THR HG23 H 1.106 11.076 -0.431 1.00 . A A . 12 THR HG23 1 1
25 4947 1 1 12 THR N N 1.676 7.748 2.113 1.00 . A A . 12 THR N 1 1
25 4948 1 1 12 THR O O 2.220 10.617 3.444 1.00 . A A . 12 THR O 1 1
25 4949 1 1 12 THR OG1 O 0.660 8.432 -0.525 1.00 . A A . 12 THR OG1 1 1
25 4950 1 1 13 THR C C -0.509 9.781 5.986 1.00 . A A . 13 THR C 1 1
25 4951 1 1 13 THR CA C -0.279 10.774 4.807 1.00 . A A . 13 THR CA 1 1
25 4952 1 1 13 THR CB C -1.433 11.806 4.603 1.00 . A A . 13 THR CB 1 1
25 4953 1 1 13 THR CG2 C -1.052 13.022 3.742 1.00 . A A . 13 THR CG2 1 1
25 4954 1 1 13 THR H H -0.687 9.493 3.063 1.00 . A A . 13 THR H 1 1
25 4955 1 1 13 THR HA H 0.599 11.379 5.107 1.00 . A A . 13 THR HA 1 1
25 4956 1 1 13 THR HB H -1.717 12.195 5.597 1.00 . A A . 13 THR HB 1 1
25 4957 1 1 13 THR HG1 H -2.398 11.098 3.096 1.00 . A A . 13 THR HG1 1 1
25 4958 1 1 13 THR HG21 H -0.778 12.731 2.711 1.00 . A A . 13 THR HG21 1 1
25 4959 1 1 13 THR HG22 H -1.889 13.741 3.669 1.00 . A A . 13 THR HG22 1 1
25 4960 1 1 13 THR HG23 H -0.191 13.569 4.169 1.00 . A A . 13 THR HG23 1 1
25 4961 1 1 13 THR N N 0.038 10.018 3.560 1.00 . A A . 13 THR N 1 1
25 4962 1 1 13 THR O O 0.317 9.740 6.901 1.00 . A A . 13 THR O 1 1
25 4963 1 1 13 THR OG1 O -2.591 11.201 4.032 1.00 . A A . 13 THR OG1 1 1
25 4964 1 1 14 ALA C C -2.293 6.675 6.360 1.00 . A A . 14 ALA C 1 1
25 4965 1 1 14 ALA CA C -1.926 8.014 7.034 1.00 . A A . 14 ALA CA 1 1
25 4966 1 1 14 ALA CB C -3.047 8.569 7.934 1.00 . A A . 14 ALA CB 1 1
25 4967 1 1 14 ALA H H -2.241 9.165 5.181 1.00 . A A . 14 ALA H 1 1
25 4968 1 1 14 ALA HXT H -0.383 6.304 6.457 1.00 . A A . 14 ALA HXT 1 1
25 4969 1 1 14 ALA HA H -1.047 7.832 7.685 1.00 . A A . 14 ALA HA 1 1
25 4970 1 1 14 ALA HB1 H -3.307 7.859 8.740 1.00 . A A . 14 ALA HB1 1 1
25 4971 1 1 14 ALA HB2 H -2.744 9.512 8.426 1.00 . A A . 14 ALA HB2 1 1
25 4972 1 1 14 ALA HB3 H -3.975 8.777 7.369 1.00 . A A . 14 ALA HB3 1 1
25 4973 1 1 14 ALA N N -1.608 8.996 5.971 1.00 . A A . 14 ALA N 1 1
25 4974 1 1 14 ALA O O -3.434 6.356 6.022 1.00 . A A . 14 ALA O 1 1
25 4975 1 1 14 ALA OXT O -1.193 5.883 6.161 1.00 . A A . 14 ALA OXT 1 1
26 4976 1 1 1 ACE C C 4.132 10.620 7.228 1.00 . A A . 1 ACE C 1 1
26 4977 1 1 1 ACE CH3 C 3.661 11.916 6.577 1.00 . A A . 1 ACE CH3 1 1
26 4978 1 1 1 ACE H1 H 3.728 11.882 5.475 1.00 . A A . 1 ACE H1 1 1
26 4979 1 1 1 ACE H2 H 2.613 12.137 6.850 1.00 . A A . 1 ACE H2 1 1
26 4980 1 1 1 ACE H3 H 4.276 12.771 6.911 1.00 . A A . 1 ACE H3 1 1
26 4981 1 1 1 ACE O O 4.827 10.667 8.246 1.00 . A A . 1 ACE O 1 1
26 4982 1 1 2 ILE C C 4.684 7.331 5.954 1.00 . A A . 2 ILE C 1 1
26 4983 1 1 2 ILE CA C 4.101 8.128 7.155 1.00 . A A . 2 ILE CA 1 1
26 4984 1 1 2 ILE CB C 2.975 7.399 7.985 1.00 . A A . 2 ILE CB 1 1
26 4985 1 1 2 ILE CD1 C 1.850 5.370 6.754 1.00 . A A . 2 ILE CD1 1 1
26 4986 1 1 2 ILE CG1 C 1.712 6.814 7.272 1.00 . A A . 2 ILE CG1 1 1
26 4987 1 1 2 ILE CG2 C 2.552 8.217 9.232 1.00 . A A . 2 ILE CG2 1 1
26 4988 1 1 2 ILE H H 3.312 9.586 5.723 1.00 . A A . 2 ILE H 1 1
26 4989 1 1 2 ILE HA H 4.942 8.252 7.865 1.00 . A A . 2 ILE HA 1 1
26 4990 1 1 2 ILE HB H 3.483 6.531 8.414 1.00 . A A . 2 ILE HB 1 1
26 4991 1 1 2 ILE HD11 H 2.598 5.266 5.950 1.00 . A A . 2 ILE HD11 1 1
26 4992 1 1 2 ILE HD12 H 2.137 4.673 7.563 1.00 . A A . 2 ILE HD12 1 1
26 4993 1 1 2 ILE HD13 H 0.888 5.007 6.347 1.00 . A A . 2 ILE HD13 1 1
26 4994 1 1 2 ILE HG12 H 0.854 6.779 7.976 1.00 . A A . 2 ILE HG12 1 1
26 4995 1 1 2 ILE HG13 H 1.368 7.471 6.456 1.00 . A A . 2 ILE HG13 1 1
26 4996 1 1 2 ILE HG21 H 1.916 7.627 9.918 1.00 . A A . 2 ILE HG21 1 1
26 4997 1 1 2 ILE HG22 H 3.427 8.551 9.820 1.00 . A A . 2 ILE HG22 1 1
26 4998 1 1 2 ILE HG23 H 1.982 9.123 8.956 1.00 . A A . 2 ILE HG23 1 1
26 4999 1 1 2 ILE N N 3.728 9.477 6.648 1.00 . A A . 2 ILE N 1 1
26 5000 1 1 2 ILE O O 3.969 7.054 4.986 1.00 . A A . 2 ILE O 1 1
26 5001 1 1 3 TRP C C 7.279 4.839 5.295 1.00 . A A . 3 TRP C 1 1
26 5002 1 1 3 TRP CA C 6.680 6.238 4.911 1.00 . A A . 3 TRP CA 1 1
26 5003 1 1 3 TRP CB C 7.706 7.190 4.220 1.00 . A A . 3 TRP CB 1 1
26 5004 1 1 3 TRP CD1 C 6.072 8.576 2.710 1.00 . A A . 3 TRP CD1 1 1
26 5005 1 1 3 TRP CD2 C 7.256 9.786 4.148 1.00 . A A . 3 TRP CD2 1 1
26 5006 1 1 3 TRP CE2 C 6.336 10.622 3.463 1.00 . A A . 3 TRP CE2 1 1
26 5007 1 1 3 TRP CE3 C 8.020 10.296 5.229 1.00 . A A . 3 TRP CE3 1 1
26 5008 1 1 3 TRP CG C 7.110 8.499 3.660 1.00 . A A . 3 TRP CG 1 1
26 5009 1 1 3 TRP CH2 C 6.975 12.469 4.887 1.00 . A A . 3 TRP CH2 1 1
26 5010 1 1 3 TRP CZ2 C 6.195 11.979 3.838 1.00 . A A . 3 TRP CZ2 1 1
26 5011 1 1 3 TRP CZ3 C 7.871 11.639 5.573 1.00 . A A . 3 TRP CZ3 1 1
26 5012 1 1 3 TRP H H 6.552 7.550 6.668 1.00 . A A . 3 TRP H 1 1
26 5013 1 1 3 TRP HA H 5.944 5.977 4.125 1.00 . A A . 3 TRP HA 1 1
26 5014 1 1 3 TRP HB2 H 8.534 7.415 4.919 1.00 . A A . 3 TRP HB2 1 1
26 5015 1 1 3 TRP HB3 H 8.192 6.657 3.381 1.00 . A A . 3 TRP HB3 1 1
26 5016 1 1 3 TRP HD1 H 5.578 7.701 2.321 1.00 . A A . 3 TRP HD1 1 1
26 5017 1 1 3 TRP HE1 H 4.779 10.199 2.013 1.00 . A A . 3 TRP HE1 1 1
26 5018 1 1 3 TRP HE3 H 8.678 9.650 5.795 1.00 . A A . 3 TRP HE3 1 1
26 5019 1 1 3 TRP HH2 H 6.870 13.501 5.189 1.00 . A A . 3 TRP HH2 1 1
26 5020 1 1 3 TRP HZ2 H 5.478 12.618 3.344 1.00 . A A . 3 TRP HZ2 1 1
26 5021 1 1 3 TRP HZ3 H 8.442 12.041 6.398 1.00 . A A . 3 TRP HZ3 1 1
26 5022 1 1 3 TRP N N 5.992 6.994 6.009 1.00 . A A . 3 TRP N 1 1
26 5023 1 1 3 TRP NE1 N 5.596 9.889 2.551 1.00 . A A . 3 TRP NE1 1 1
26 5024 1 1 3 TRP O O 8.038 4.267 4.505 1.00 . A A . 3 TRP O 1 1
26 5025 1 1 4 GLY C C 6.110 2.057 7.073 1.00 . A A . 4 GLY C 1 1
26 5026 1 1 4 GLY CA C 7.363 2.937 6.920 1.00 . A A . 4 GLY CA 1 1
26 5027 1 1 4 GLY H H 6.246 4.825 7.001 1.00 . A A . 4 GLY H 1 1
26 5028 1 1 4 GLY HA2 H 8.113 2.479 6.247 1.00 . A A . 4 GLY HA2 1 1
26 5029 1 1 4 GLY HA3 H 7.857 3.049 7.902 1.00 . A A . 4 GLY HA3 1 1
26 5030 1 1 4 GLY N N 6.912 4.270 6.460 1.00 . A A . 4 GLY N 1 1
26 5031 1 1 4 GLY O O 5.482 2.053 8.136 1.00 . A A . 4 GLY O 1 1
26 5032 1 1 5 . C C 3.362 1.225 5.272 1.00 . A A . 5 SET C 1 1
26 5033 1 1 5 . CA C 4.545 0.461 5.958 1.00 . A A . 5 SET CA 1 1
26 5034 1 1 5 . CB C 4.834 -0.921 5.294 1.00 . A A . 5 SET CB 1 1
26 5035 1 1 5 . H H 6.345 1.477 5.174 1.00 . A A . 5 SET H 1 1
26 5036 1 1 5 . HA H 4.210 0.279 6.999 1.00 . A A . 5 SET HA 1 1
26 5037 1 1 5 . HB2 H 2.463 0.581 5.305 1.00 . A A . 5 SET HB2 1 1
26 5038 1 1 5 . HB3 H 3.078 2.093 5.901 1.00 . A A . 5 SET HB3 1 1
26 5039 1 1 5 . HNT2 H 3.261 1.019 3.111 1.00 . A A . 5 SET HNT2 1 1
26 5040 1 1 5 . N N 5.762 1.320 6.003 1.00 . A A . 5 SET N 1 1
26 5041 1 1 5 . NT N 3.548 1.662 3.859 1.00 . A A . 5 SET NT 1 1
26 5042 1 1 5 . OG O 5.466 -0.994 4.235 1.00 . A A . 5 SET OG 1 1
26 5043 1 1 6 SER C C 3.132 -4.111 5.510 1.00 . A A . 6 SER C 1 1
26 5044 1 1 6 SER CA C 4.515 -3.403 5.427 1.00 . A A . 6 SER CA 1 1
26 5045 1 1 6 SER CB C 5.576 -4.152 6.266 1.00 . A A . 6 SER CB 1 1
26 5046 1 1 6 SER H H 3.835 -1.826 6.794 1.00 . A A . 6 SER H 1 1
26 5047 1 1 6 SER HA H 4.868 -3.396 4.376 1.00 . A A . 6 SER HA 1 1
26 5048 1 1 6 SER HB2 H 5.321 -4.141 7.342 1.00 . A A . 6 SER HB2 1 1
26 5049 1 1 6 SER HB3 H 5.612 -5.219 5.973 1.00 . A A . 6 SER HB3 1 1
26 5050 1 1 6 SER HG H 7.472 -4.094 6.625 1.00 . A A . 6 SER HG 1 1
26 5051 1 1 6 SER N N 4.344 -2.007 5.923 1.00 . A A . 6 SER N 1 1
26 5052 1 1 6 SER O O 2.501 -4.134 6.574 1.00 . A A . 6 SER O 1 1
26 5053 1 1 6 SER OG O 6.871 -3.588 6.074 1.00 . A A . 6 SER OG 1 1
26 5054 1 1 7 GLY C C 0.277 -4.443 3.740 1.00 . A A . 7 GLY C 1 1
26 5055 1 1 7 GLY CA C 1.344 -5.381 4.336 1.00 . A A . 7 GLY CA 1 1
26 5056 1 1 7 GLY H H 3.267 -4.621 3.564 1.00 . A A . 7 GLY H 1 1
26 5057 1 1 7 GLY HA2 H 1.435 -6.279 3.698 1.00 . A A . 7 GLY HA2 1 1
26 5058 1 1 7 GLY HA3 H 1.027 -5.766 5.325 1.00 . A A . 7 GLY HA3 1 1
26 5059 1 1 7 GLY N N 2.666 -4.700 4.390 1.00 . A A . 7 GLY N 1 1
26 5060 1 1 7 GLY O O -0.094 -4.587 2.573 1.00 . A A . 7 GLY O 1 1
26 5061 1 1 8 LYS C C -0.341 -1.275 3.602 1.00 . A A . 8 LYS C 1 1
26 5062 1 1 8 LYS CA C -1.196 -2.466 4.134 1.00 . A A . 8 LYS CA 1 1
26 5063 1 1 8 LYS CB C -2.098 -2.123 5.348 1.00 . A A . 8 LYS CB 1 1
26 5064 1 1 8 LYS CD C -4.070 -0.715 6.269 1.00 . A A . 8 LYS CD 1 1
26 5065 1 1 8 LYS CE C -4.981 -1.818 6.845 1.00 . A A . 8 LYS CE 1 1
26 5066 1 1 8 LYS CG C -3.249 -1.141 5.035 1.00 . A A . 8 LYS CG 1 1
26 5067 1 1 8 LYS H H 0.277 -3.403 5.455 1.00 . A A . 8 LYS H 1 1
26 5068 1 1 8 LYS HA H -1.850 -2.871 3.334 1.00 . A A . 8 LYS HA 1 1
26 5069 1 1 8 LYS HB2 H -2.533 -3.059 5.750 1.00 . A A . 8 LYS HB2 1 1
26 5070 1 1 8 LYS HB3 H -1.479 -1.713 6.172 1.00 . A A . 8 LYS HB3 1 1
26 5071 1 1 8 LYS HD2 H -3.382 -0.334 7.048 1.00 . A A . 8 LYS HD2 1 1
26 5072 1 1 8 LYS HD3 H -4.688 0.155 5.977 1.00 . A A . 8 LYS HD3 1 1
26 5073 1 1 8 LYS HE2 H -5.662 -2.201 6.061 1.00 . A A . 8 LYS HE2 1 1
26 5074 1 1 8 LYS HE3 H -4.377 -2.686 7.175 1.00 . A A . 8 LYS HE3 1 1
26 5075 1 1 8 LYS HG2 H -2.826 -0.226 4.578 1.00 . A A . 8 LYS HG2 1 1
26 5076 1 1 8 LYS HG3 H -3.916 -1.566 4.260 1.00 . A A . 8 LYS HG3 1 1
26 5077 1 1 8 LYS HZ1 H -6.386 -2.032 8.383 1.00 . A A . 8 LYS HZ1 1 1
26 5078 1 1 8 LYS HZ2 H -5.171 -0.974 8.747 1.00 . A A . 8 LYS HZ2 1 1
26 5079 1 1 8 LYS HZ3 H -6.373 -0.524 7.713 1.00 . A A . 8 LYS HZ3 1 1
26 5080 1 1 8 LYS N N -0.208 -3.489 4.559 1.00 . A A . 8 LYS N 1 1
26 5081 1 1 8 LYS NZ N -5.771 -1.310 7.984 1.00 . A A . 8 LYS NZ 1 1
26 5082 1 1 8 LYS O O 0.081 -0.391 4.355 1.00 . A A . 8 LYS O 1 1
26 5083 1 1 9 LEU C C -0.022 1.025 1.266 1.00 . A A . 9 LEU C 1 1
26 5084 1 1 9 LEU CA C 0.752 -0.284 1.598 1.00 . A A . 9 LEU CA 1 1
26 5085 1 1 9 LEU CB C 1.437 -0.904 0.342 1.00 . A A . 9 LEU CB 1 1
26 5086 1 1 9 LEU CD1 C 2.952 -2.614 -0.777 1.00 . A A . 9 LEU CD1 1 1
26 5087 1 1 9 LEU CD2 C 3.772 -1.469 1.311 1.00 . A A . 9 LEU CD2 1 1
26 5088 1 1 9 LEU CG C 2.527 -1.996 0.569 1.00 . A A . 9 LEU CG 1 1
26 5089 1 1 9 LEU H H -0.465 -2.136 1.824 1.00 . A A . 9 LEU H 1 1
26 5090 1 1 9 LEU HA H 1.587 -0.019 2.277 1.00 . A A . 9 LEU HA 1 1
26 5091 1 1 9 LEU HB2 H 0.647 -1.306 -0.323 1.00 . A A . 9 LEU HB2 1 1
26 5092 1 1 9 LEU HB3 H 1.898 -0.089 -0.249 1.00 . A A . 9 LEU HB3 1 1
26 5093 1 1 9 LEU HD11 H 2.091 -3.060 -1.309 1.00 . A A . 9 LEU HD11 1 1
26 5094 1 1 9 LEU HD12 H 3.405 -1.867 -1.455 1.00 . A A . 9 LEU HD12 1 1
26 5095 1 1 9 LEU HD13 H 3.691 -3.425 -0.640 1.00 . A A . 9 LEU HD13 1 1
26 5096 1 1 9 LEU HD21 H 4.241 -0.614 0.787 1.00 . A A . 9 LEU HD21 1 1
26 5097 1 1 9 LEU HD22 H 3.529 -1.133 2.334 1.00 . A A . 9 LEU HD22 1 1
26 5098 1 1 9 LEU HD23 H 4.547 -2.251 1.423 1.00 . A A . 9 LEU HD23 1 1
26 5099 1 1 9 LEU HG H 2.104 -2.817 1.177 1.00 . A A . 9 LEU HG 1 1
26 5100 1 1 9 LEU N N -0.089 -1.300 2.284 1.00 . A A . 9 LEU N 1 1
26 5101 1 1 9 LEU O O -0.697 1.145 0.240 1.00 . A A . 9 LEU O 1 1
26 5102 1 1 10 ILE C C 0.605 4.310 2.609 1.00 . A A . 10 ILE C 1 1
26 5103 1 1 10 ILE CA C -0.503 3.350 2.070 1.00 . A A . 10 ILE CA 1 1
26 5104 1 1 10 ILE CB C -1.926 3.415 2.742 1.00 . A A . 10 ILE CB 1 1
26 5105 1 1 10 ILE CD1 C -2.948 5.169 1.111 1.00 . A A . 10 ILE CD1 1 1
26 5106 1 1 10 ILE CG1 C -2.639 4.785 2.565 1.00 . A A . 10 ILE CG1 1 1
26 5107 1 1 10 ILE CG2 C -1.983 2.997 4.236 1.00 . A A . 10 ILE CG2 1 1
26 5108 1 1 10 ILE H H 0.613 1.726 3.028 1.00 . A A . 10 ILE H 1 1
26 5109 1 1 10 ILE HA H -0.644 3.584 0.996 1.00 . A A . 10 ILE HA 1 1
26 5110 1 1 10 ILE HB H -2.552 2.671 2.211 1.00 . A A . 10 ILE HB 1 1
26 5111 1 1 10 ILE HD11 H -2.026 5.339 0.525 1.00 . A A . 10 ILE HD11 1 1
26 5112 1 1 10 ILE HD12 H -3.532 4.383 0.600 1.00 . A A . 10 ILE HD12 1 1
26 5113 1 1 10 ILE HD13 H -3.536 6.103 1.066 1.00 . A A . 10 ILE HD13 1 1
26 5114 1 1 10 ILE HG12 H -3.599 4.779 3.117 1.00 . A A . 10 ILE HG12 1 1
26 5115 1 1 10 ILE HG13 H -2.043 5.590 3.035 1.00 . A A . 10 ILE HG13 1 1
26 5116 1 1 10 ILE HG21 H -3.023 2.960 4.613 1.00 . A A . 10 ILE HG21 1 1
26 5117 1 1 10 ILE HG22 H -1.559 1.990 4.399 1.00 . A A . 10 ILE HG22 1 1
26 5118 1 1 10 ILE HG23 H -1.428 3.691 4.894 1.00 . A A . 10 ILE HG23 1 1
26 5119 1 1 10 ILE N N 0.104 1.996 2.182 1.00 . A A . 10 ILE N 1 1
26 5120 1 1 10 ILE O O 0.535 4.799 3.740 1.00 . A A . 10 ILE O 1 1
26 5121 1 1 11 GLU C C 2.662 6.908 1.705 1.00 . A A . 11 GLU C 1 1
26 5122 1 1 11 GLU CA C 2.793 5.423 2.171 1.00 . A A . 11 GLU CA 1 1
26 5123 1 1 11 GLU CB C 4.101 4.728 1.677 1.00 . A A . 11 GLU CB 1 1
26 5124 1 1 11 GLU CD C 4.120 2.853 3.542 1.00 . A A . 11 GLU CD 1 1
26 5125 1 1 11 GLU CG C 4.371 3.242 2.059 1.00 . A A . 11 GLU CG 1 1
26 5126 1 1 11 GLU H H 1.599 4.097 0.871 1.00 . A A . 11 GLU H 1 1
26 5127 1 1 11 GLU HA H 2.909 5.413 3.275 1.00 . A A . 11 GLU HA 1 1
26 5128 1 1 11 GLU HB2 H 4.170 4.811 0.575 1.00 . A A . 11 GLU HB2 1 1
26 5129 1 1 11 GLU HB3 H 4.957 5.325 2.046 1.00 . A A . 11 GLU HB3 1 1
26 5130 1 1 11 GLU HG2 H 3.800 2.604 1.362 1.00 . A A . 11 GLU HG2 1 1
26 5131 1 1 11 GLU HG3 H 5.434 3.045 1.807 1.00 . A A . 11 GLU HG3 1 1
26 5132 1 1 11 GLU N N 1.630 4.584 1.774 1.00 . A A . 11 GLU N 1 1
26 5133 1 1 11 GLU O O 3.393 7.346 0.808 1.00 . A A . 11 GLU O 1 1
26 5134 1 1 11 GLU OE1 O 4.471 3.650 4.417 1.00 . A A . 11 GLU OE1 1 1
26 5135 1 1 12 THR C C 1.436 9.903 3.309 1.00 . A A . 12 THR C 1 1
26 5136 1 1 12 THR CA C 1.542 9.128 1.961 1.00 . A A . 12 THR CA 1 1
26 5137 1 1 12 THR CB C 0.379 9.318 0.931 1.00 . A A . 12 THR CB 1 1
26 5138 1 1 12 THR CG2 C 0.161 10.776 0.487 1.00 . A A . 12 THR CG2 1 1
26 5139 1 1 12 THR H H 1.058 7.221 2.915 1.00 . A A . 12 THR H 1 1
26 5140 1 1 12 THR HA H 2.456 9.519 1.470 1.00 . A A . 12 THR HA 1 1
26 5141 1 1 12 THR HB H -0.565 8.943 1.370 1.00 . A A . 12 THR HB 1 1
26 5142 1 1 12 THR HG1 H -0.070 8.776 -0.863 1.00 . A A . 12 THR HG1 1 1
26 5143 1 1 12 THR HG21 H -0.654 10.855 -0.256 1.00 . A A . 12 THR HG21 1 1
26 5144 1 1 12 THR HG22 H -0.115 11.429 1.335 1.00 . A A . 12 THR HG22 1 1
26 5145 1 1 12 THR HG23 H 1.070 11.204 0.024 1.00 . A A . 12 THR HG23 1 1
26 5146 1 1 12 THR N N 1.741 7.692 2.311 1.00 . A A . 12 THR N 1 1
26 5147 1 1 12 THR O O 2.444 10.451 3.763 1.00 . A A . 12 THR O 1 1
26 5148 1 1 12 THR OG1 O 0.641 8.569 -0.252 1.00 . A A . 12 THR OG1 1 1
26 5149 1 1 13 THR C C -0.687 9.705 6.271 1.00 . A A . 13 THR C 1 1
26 5150 1 1 13 THR CA C 0.004 10.642 5.233 1.00 . A A . 13 THR CA 1 1
26 5151 1 1 13 THR CB C -0.761 11.988 5.038 1.00 . A A . 13 THR CB 1 1
26 5152 1 1 13 THR CG2 C 0.062 13.099 4.365 1.00 . A A . 13 THR CG2 1 1
26 5153 1 1 13 THR H H -0.538 9.544 3.414 1.00 . A A . 13 THR H 1 1
26 5154 1 1 13 THR HA H 0.977 10.901 5.694 1.00 . A A . 13 THR HA 1 1
26 5155 1 1 13 THR HB H -1.042 12.360 6.038 1.00 . A A . 13 THR HB 1 1
26 5156 1 1 13 THR HG1 H -2.349 12.679 4.194 1.00 . A A . 13 THR HG1 1 1
26 5157 1 1 13 THR HG21 H 0.353 12.830 3.333 1.00 . A A . 13 THR HG21 1 1
26 5158 1 1 13 THR HG22 H -0.506 14.046 4.309 1.00 . A A . 13 THR HG22 1 1
26 5159 1 1 13 THR HG23 H 0.993 13.310 4.924 1.00 . A A . 13 THR HG23 1 1
26 5160 1 1 13 THR N N 0.245 9.936 3.942 1.00 . A A . 13 THR N 1 1
26 5161 1 1 13 THR O O -0.150 9.535 7.369 1.00 . A A . 13 THR O 1 1
26 5162 1 1 13 THR OG1 O -1.964 11.805 4.294 1.00 . A A . 13 THR OG1 1 1
26 5163 1 1 14 ALA C C -2.013 6.763 6.911 1.00 . A A . 14 ALA C 1 1
26 5164 1 1 14 ALA CA C -2.589 8.200 6.867 1.00 . A A . 14 ALA CA 1 1
26 5165 1 1 14 ALA CB C -4.073 8.186 6.458 1.00 . A A . 14 ALA CB 1 1
26 5166 1 1 14 ALA H H -2.243 9.396 5.042 1.00 . A A . 14 ALA H 1 1
26 5167 1 1 14 ALA HXT H -1.948 6.877 4.972 1.00 . A A . 14 ALA HXT 1 1
26 5168 1 1 14 ALA HA H -2.541 8.610 7.895 1.00 . A A . 14 ALA HA 1 1
26 5169 1 1 14 ALA HB1 H -4.675 7.562 7.144 1.00 . A A . 14 ALA HB1 1 1
26 5170 1 1 14 ALA HB2 H -4.516 9.199 6.485 1.00 . A A . 14 ALA HB2 1 1
26 5171 1 1 14 ALA HB3 H -4.227 7.788 5.437 1.00 . A A . 14 ALA HB3 1 1
26 5172 1 1 14 ALA N N -1.857 9.111 5.950 1.00 . A A . 14 ALA N 1 1
26 5173 1 1 14 ALA O O -1.822 6.153 7.962 1.00 . A A . 14 ALA O 1 1
26 5174 1 1 14 ALA OXT O -1.752 6.244 5.666 1.00 . A A . 14 ALA OXT 1 1
27 5175 1 1 1 ACE C C 5.674 10.634 4.991 1.00 . A A . 1 ACE C 1 1
27 5176 1 1 1 ACE CH3 C 5.270 11.680 3.958 1.00 . A A . 1 ACE CH3 1 1
27 5177 1 1 1 ACE H1 H 5.971 12.536 3.964 1.00 . A A . 1 ACE H1 1 1
27 5178 1 1 1 ACE H2 H 5.273 11.262 2.934 1.00 . A A . 1 ACE H2 1 1
27 5179 1 1 1 ACE H3 H 4.259 12.079 4.161 1.00 . A A . 1 ACE H3 1 1
27 5180 1 1 1 ACE O O 6.632 10.833 5.741 1.00 . A A . 1 ACE O 1 1
27 5181 1 1 2 ILE C C 5.671 7.223 5.044 1.00 . A A . 2 ILE C 1 1
27 5182 1 1 2 ILE CA C 5.146 8.382 5.936 1.00 . A A . 2 ILE CA 1 1
27 5183 1 1 2 ILE CB C 3.938 8.062 6.908 1.00 . A A . 2 ILE CB 1 1
27 5184 1 1 2 ILE CD1 C 2.901 5.694 6.443 1.00 . A A . 2 ILE CD1 1 1
27 5185 1 1 2 ILE CG1 C 2.707 7.221 6.426 1.00 . A A . 2 ILE CG1 1 1
27 5186 1 1 2 ILE CG2 C 3.449 9.318 7.671 1.00 . A A . 2 ILE CG2 1 1
27 5187 1 1 2 ILE H H 4.268 9.466 4.222 1.00 . A A . 2 ILE H 1 1
27 5188 1 1 2 ILE HA H 5.976 8.653 6.618 1.00 . A A . 2 ILE HA 1 1
27 5189 1 1 2 ILE HB H 4.385 7.455 7.703 1.00 . A A . 2 ILE HB 1 1
27 5190 1 1 2 ILE HD11 H 3.721 5.352 5.792 1.00 . A A . 2 ILE HD11 1 1
27 5191 1 1 2 ILE HD12 H 3.118 5.324 7.461 1.00 . A A . 2 ILE HD12 1 1
27 5192 1 1 2 ILE HD13 H 1.987 5.176 6.100 1.00 . A A . 2 ILE HD13 1 1
27 5193 1 1 2 ILE HG12 H 1.837 7.392 7.094 1.00 . A A . 2 ILE HG12 1 1
27 5194 1 1 2 ILE HG13 H 2.355 7.547 5.432 1.00 . A A . 2 ILE HG13 1 1
27 5195 1 1 2 ILE HG21 H 2.765 9.060 8.502 1.00 . A A . 2 ILE HG21 1 1
27 5196 1 1 2 ILE HG22 H 4.288 9.882 8.119 1.00 . A A . 2 ILE HG22 1 1
27 5197 1 1 2 ILE HG23 H 2.903 10.017 7.009 1.00 . A A . 2 ILE HG23 1 1
27 5198 1 1 2 ILE N N 4.916 9.530 5.008 1.00 . A A . 2 ILE N 1 1
27 5199 1 1 2 ILE O O 4.942 6.747 4.169 1.00 . A A . 2 ILE O 1 1
27 5200 1 1 3 TRP C C 7.817 4.326 5.106 1.00 . A A . 3 TRP C 1 1
27 5201 1 1 3 TRP CA C 7.549 5.700 4.406 1.00 . A A . 3 TRP CA 1 1
27 5202 1 1 3 TRP CB C 8.807 6.284 3.693 1.00 . A A . 3 TRP CB 1 1
27 5203 1 1 3 TRP CD1 C 7.620 7.599 1.757 1.00 . A A . 3 TRP CD1 1 1
27 5204 1 1 3 TRP CD2 C 8.939 8.837 3.048 1.00 . A A . 3 TRP CD2 1 1
27 5205 1 1 3 TRP CE2 C 8.279 9.667 2.106 1.00 . A A . 3 TRP CE2 1 1
27 5206 1 1 3 TRP CE3 C 9.733 9.409 4.076 1.00 . A A . 3 TRP CE3 1 1
27 5207 1 1 3 TRP CG C 8.544 7.530 2.819 1.00 . A A . 3 TRP CG 1 1
27 5208 1 1 3 TRP CH2 C 9.229 11.616 3.178 1.00 . A A . 3 TRP CH2 1 1
27 5209 1 1 3 TRP CZ2 C 8.426 11.073 2.173 1.00 . A A . 3 TRP CZ2 1 1
27 5210 1 1 3 TRP CZ3 C 9.870 10.797 4.116 1.00 . A A . 3 TRP CZ3 1 1
27 5211 1 1 3 TRP H H 7.534 7.408 5.796 1.00 . A A . 3 TRP H 1 1
27 5212 1 1 3 TRP HA H 6.857 5.423 3.588 1.00 . A A . 3 TRP HA 1 1
27 5213 1 1 3 TRP HB2 H 9.593 6.499 4.441 1.00 . A A . 3 TRP HB2 1 1
27 5214 1 1 3 TRP HB3 H 9.254 5.510 3.041 1.00 . A A . 3 TRP HB3 1 1
27 5215 1 1 3 TRP HD1 H 6.989 6.770 1.473 1.00 . A A . 3 TRP HD1 1 1
27 5216 1 1 3 TRP HE1 H 6.788 9.252 0.582 1.00 . A A . 3 TRP HE1 1 1
27 5217 1 1 3 TRP HE3 H 10.196 8.789 4.829 1.00 . A A . 3 TRP HE3 1 1
27 5218 1 1 3 TRP HH2 H 9.342 12.689 3.244 1.00 . A A . 3 TRP HH2 1 1
27 5219 1 1 3 TRP HZ2 H 7.908 11.718 1.477 1.00 . A A . 3 TRP HZ2 1 1
27 5220 1 1 3 TRP HZ3 H 10.467 11.248 4.894 1.00 . A A . 3 TRP HZ3 1 1
27 5221 1 1 3 TRP N N 6.933 6.788 5.239 1.00 . A A . 3 TRP N 1 1
27 5222 1 1 3 TRP NE1 N 7.459 8.913 1.282 1.00 . A A . 3 TRP NE1 1 1
27 5223 1 1 3 TRP O O 8.460 3.459 4.505 1.00 . A A . 3 TRP O 1 1
27 5224 1 1 4 GLY C C 6.099 2.083 7.100 1.00 . A A . 4 GLY C 1 1
27 5225 1 1 4 GLY CA C 7.449 2.825 7.065 1.00 . A A . 4 GLY CA 1 1
27 5226 1 1 4 GLY H H 6.747 4.883 6.689 1.00 . A A . 4 GLY H 1 1
27 5227 1 1 4 GLY HA2 H 8.253 2.186 6.651 1.00 . A A . 4 GLY HA2 1 1
27 5228 1 1 4 GLY HA3 H 7.761 3.057 8.099 1.00 . A A . 4 GLY HA3 1 1
27 5229 1 1 4 GLY N N 7.296 4.099 6.327 1.00 . A A . 4 GLY N 1 1
27 5230 1 1 4 GLY O O 5.338 2.235 8.059 1.00 . A A . 4 GLY O 1 1
27 5231 1 1 5 . C C 3.439 1.360 5.203 1.00 . A A . 5 SET C 1 1
27 5232 1 1 5 . CA C 4.548 0.524 5.920 1.00 . A A . 5 SET CA 1 1
27 5233 1 1 5 . CB C 4.809 -0.864 5.256 1.00 . A A . 5 SET CB 1 1
27 5234 1 1 5 . H H 6.511 1.332 5.294 1.00 . A A . 5 SET H 1 1
27 5235 1 1 5 . HA H 4.154 0.348 6.942 1.00 . A A . 5 SET HA 1 1
27 5236 1 1 5 . HB2 H 2.493 0.788 5.249 1.00 . A A . 5 SET HB2 1 1
27 5237 1 1 5 . HB3 H 3.220 2.266 5.805 1.00 . A A . 5 SET HB3 1 1
27 5238 1 1 5 . HNT2 H 3.212 1.169 3.047 1.00 . A A . 5 SET HNT2 1 1
27 5239 1 1 5 . N N 5.822 1.286 6.053 1.00 . A A . 5 SET N 1 1
27 5240 1 1 5 . NT N 3.646 1.745 3.778 1.00 . A A . 5 SET NT 1 1
27 5241 1 1 5 . OG O 5.434 -0.948 4.194 1.00 . A A . 5 SET OG 1 1
27 5242 1 1 6 SER C C 3.102 -4.062 5.502 1.00 . A A . 6 SER C 1 1
27 5243 1 1 6 SER CA C 4.479 -3.345 5.398 1.00 . A A . 6 SER CA 1 1
27 5244 1 1 6 SER CB C 5.561 -4.084 6.220 1.00 . A A . 6 SER CB 1 1
27 5245 1 1 6 SER H H 3.800 -1.758 6.758 1.00 . A A . 6 SER H 1 1
27 5246 1 1 6 SER HA H 4.813 -3.341 4.340 1.00 . A A . 6 SER HA 1 1
27 5247 1 1 6 SER HB2 H 5.335 -4.059 7.303 1.00 . A A . 6 SER HB2 1 1
27 5248 1 1 6 SER HB3 H 5.594 -5.155 5.944 1.00 . A A . 6 SER HB3 1 1
27 5249 1 1 6 SER HG H 6.766 -2.581 6.170 1.00 . A A . 6 SER HG 1 1
27 5250 1 1 6 SER N N 4.320 -1.948 5.894 1.00 . A A . 6 SER N 1 1
27 5251 1 1 6 SER O O 2.470 -4.056 6.567 1.00 . A A . 6 SER O 1 1
27 5252 1 1 6 SER OG O 6.848 -3.521 5.988 1.00 . A A . 6 SER OG 1 1
27 5253 1 1 7 GLY C C 0.261 -4.468 3.747 1.00 . A A . 7 GLY C 1 1
27 5254 1 1 7 GLY CA C 1.327 -5.387 4.369 1.00 . A A . 7 GLY CA 1 1
27 5255 1 1 7 GLY H H 3.236 -4.623 3.569 1.00 . A A . 7 GLY H 1 1
27 5256 1 1 7 GLY HA2 H 1.423 -6.302 3.755 1.00 . A A . 7 GLY HA2 1 1
27 5257 1 1 7 GLY HA3 H 1.012 -5.746 5.370 1.00 . A A . 7 GLY HA3 1 1
27 5258 1 1 7 GLY N N 2.644 -4.694 4.403 1.00 . A A . 7 GLY N 1 1
27 5259 1 1 7 GLY O O -0.102 -4.635 2.580 1.00 . A A . 7 GLY O 1 1
27 5260 1 1 8 LYS C C -0.348 -1.301 3.570 1.00 . A A . 8 LYS C 1 1
27 5261 1 1 8 LYS CA C -1.215 -2.486 4.093 1.00 . A A . 8 LYS CA 1 1
27 5262 1 1 8 LYS CB C -2.138 -2.132 5.287 1.00 . A A . 8 LYS CB 1 1
27 5263 1 1 8 LYS CD C -4.121 -0.706 6.157 1.00 . A A . 8 LYS CD 1 1
27 5264 1 1 8 LYS CE C -5.028 -1.797 6.759 1.00 . A A . 8 LYS CE 1 1
27 5265 1 1 8 LYS CG C -3.290 -1.161 4.941 1.00 . A A . 8 LYS CG 1 1
27 5266 1 1 8 LYS H H 0.248 -3.393 5.439 1.00 . A A . 8 LYS H 1 1
27 5267 1 1 8 LYS HA H -1.854 -2.898 3.284 1.00 . A A . 8 LYS HA 1 1
27 5268 1 1 8 LYS HB2 H -2.576 -3.064 5.694 1.00 . A A . 8 LYS HB2 1 1
27 5269 1 1 8 LYS HB3 H -1.536 -1.708 6.115 1.00 . A A . 8 LYS HB3 1 1
27 5270 1 1 8 LYS HD2 H -3.438 -0.300 6.929 1.00 . A A . 8 LYS HD2 1 1
27 5271 1 1 8 LYS HD3 H -4.741 0.153 5.837 1.00 . A A . 8 LYS HD3 1 1
27 5272 1 1 8 LYS HE2 H -5.700 -2.208 5.981 1.00 . A A . 8 LYS HE2 1 1
27 5273 1 1 8 LYS HE3 H -4.421 -2.651 7.119 1.00 . A A . 8 LYS HE3 1 1
27 5274 1 1 8 LYS HG2 H -2.867 -0.258 4.462 1.00 . A A . 8 LYS HG2 1 1
27 5275 1 1 8 LYS HG3 H -3.950 -1.609 4.172 1.00 . A A . 8 LYS HG3 1 1
27 5276 1 1 8 LYS HZ1 H -6.436 -0.487 7.576 1.00 . A A . 8 LYS HZ1 1 1
27 5277 1 1 8 LYS HZ2 H -6.443 -1.973 8.292 1.00 . A A . 8 LYS HZ2 1 1
27 5278 1 1 8 LYS HZ3 H -5.240 -0.897 8.632 1.00 . A A . 8 LYS HZ3 1 1
27 5279 1 1 8 LYS N N -0.231 -3.500 4.544 1.00 . A A . 8 LYS N 1 1
27 5280 1 1 8 LYS NZ N -5.832 -1.260 7.877 1.00 . A A . 8 LYS NZ 1 1
27 5281 1 1 8 LYS O O 0.083 -0.426 4.330 1.00 . A A . 8 LYS O 1 1
27 5282 1 1 9 LEU C C 0.001 1.014 1.273 1.00 . A A . 9 LEU C 1 1
27 5283 1 1 9 LEU CA C 0.765 -0.308 1.577 1.00 . A A . 9 LEU CA 1 1
27 5284 1 1 9 LEU CB C 1.434 -0.916 0.308 1.00 . A A . 9 LEU CB 1 1
27 5285 1 1 9 LEU CD1 C 2.924 -2.629 -0.839 1.00 . A A . 9 LEU CD1 1 1
27 5286 1 1 9 LEU CD2 C 3.777 -1.501 1.245 1.00 . A A . 9 LEU CD2 1 1
27 5287 1 1 9 LEU CG C 2.520 -2.017 0.515 1.00 . A A . 9 LEU CG 1 1
27 5288 1 1 9 LEU H H -0.465 -2.154 1.789 1.00 . A A . 9 LEU H 1 1
27 5289 1 1 9 LEU HA H 1.606 -0.062 2.256 1.00 . A A . 9 LEU HA 1 1
27 5290 1 1 9 LEU HB2 H 0.637 -1.305 -0.356 1.00 . A A . 9 LEU HB2 1 1
27 5291 1 1 9 LEU HB3 H 1.896 -0.096 -0.278 1.00 . A A . 9 LEU HB3 1 1
27 5292 1 1 9 LEU HD11 H 2.055 -3.066 -1.364 1.00 . A A . 9 LEU HD11 1 1
27 5293 1 1 9 LEU HD12 H 3.375 -1.880 -1.518 1.00 . A A . 9 LEU HD12 1 1
27 5294 1 1 9 LEU HD13 H 3.660 -3.445 -0.716 1.00 . A A . 9 LEU HD13 1 1
27 5295 1 1 9 LEU HD21 H 4.248 -0.650 0.720 1.00 . A A . 9 LEU HD21 1 1
27 5296 1 1 9 LEU HD22 H 3.548 -1.167 2.274 1.00 . A A . 9 LEU HD22 1 1
27 5297 1 1 9 LEU HD23 H 4.547 -2.290 1.346 1.00 . A A . 9 LEU HD23 1 1
27 5298 1 1 9 LEU HG H 2.098 -2.838 1.124 1.00 . A A . 9 LEU HG 1 1
27 5299 1 1 9 LEU N N -0.087 -1.322 2.253 1.00 . A A . 9 LEU N 1 1
27 5300 1 1 9 LEU O O -0.672 1.165 0.248 1.00 . A A . 9 LEU O 1 1
27 5301 1 1 10 ILE C C 0.658 4.261 2.679 1.00 . A A . 10 ILE C 1 1
27 5302 1 1 10 ILE CA C -0.467 3.318 2.143 1.00 . A A . 10 ILE CA 1 1
27 5303 1 1 10 ILE CB C -1.874 3.374 2.850 1.00 . A A . 10 ILE CB 1 1
27 5304 1 1 10 ILE CD1 C -2.889 5.262 1.370 1.00 . A A . 10 ILE CD1 1 1
27 5305 1 1 10 ILE CG1 C -2.562 4.767 2.786 1.00 . A A . 10 ILE CG1 1 1
27 5306 1 1 10 ILE CG2 C -1.907 2.859 4.315 1.00 . A A . 10 ILE CG2 1 1
27 5307 1 1 10 ILE H H 0.629 1.661 3.056 1.00 . A A . 10 ILE H 1 1
27 5308 1 1 10 ILE HA H -0.635 3.581 1.078 1.00 . A A . 10 ILE HA 1 1
27 5309 1 1 10 ILE HB H -2.528 2.680 2.287 1.00 . A A . 10 ILE HB 1 1
27 5310 1 1 10 ILE HD11 H -1.974 5.446 0.778 1.00 . A A . 10 ILE HD11 1 1
27 5311 1 1 10 ILE HD12 H -3.505 4.529 0.817 1.00 . A A . 10 ILE HD12 1 1
27 5312 1 1 10 ILE HD13 H -3.452 6.211 1.403 1.00 . A A . 10 ILE HD13 1 1
27 5313 1 1 10 ILE HG12 H -3.514 4.738 3.351 1.00 . A A . 10 ILE HG12 1 1
27 5314 1 1 10 ILE HG13 H -1.945 5.524 3.308 1.00 . A A . 10 ILE HG13 1 1
27 5315 1 1 10 ILE HG21 H -2.930 2.862 4.732 1.00 . A A . 10 ILE HG21 1 1
27 5316 1 1 10 ILE HG22 H -1.540 1.821 4.394 1.00 . A A . 10 ILE HG22 1 1
27 5317 1 1 10 ILE HG23 H -1.280 3.472 4.987 1.00 . A A . 10 ILE HG23 1 1
27 5318 1 1 10 ILE N N 0.135 1.961 2.212 1.00 . A A . 10 ILE N 1 1
27 5319 1 1 10 ILE O O 0.625 4.707 3.831 1.00 . A A . 10 ILE O 1 1
27 5320 1 1 11 GLU C C 2.656 6.912 1.826 1.00 . A A . 11 GLU C 1 1
27 5321 1 1 11 GLU CA C 2.826 5.400 2.202 1.00 . A A . 11 GLU CA 1 1
27 5322 1 1 11 GLU CB C 4.113 4.750 1.600 1.00 . A A . 11 GLU CB 1 1
27 5323 1 1 11 GLU CD C 4.329 2.861 3.423 1.00 . A A . 11 GLU CD 1 1
27 5324 1 1 11 GLU CG C 4.451 3.266 1.929 1.00 . A A . 11 GLU CG 1 1
27 5325 1 1 11 GLU H H 1.606 4.091 0.911 1.00 . A A . 11 GLU H 1 1
27 5326 1 1 11 GLU HA H 2.990 5.339 3.298 1.00 . A A . 11 GLU HA 1 1
27 5327 1 1 11 GLU HB2 H 4.102 4.862 0.498 1.00 . A A . 11 GLU HB2 1 1
27 5328 1 1 11 GLU HB3 H 4.978 5.361 1.922 1.00 . A A . 11 GLU HB3 1 1
27 5329 1 1 11 GLU HG2 H 3.850 2.615 1.271 1.00 . A A . 11 GLU HG2 1 1
27 5330 1 1 11 GLU HG3 H 5.498 3.099 1.598 1.00 . A A . 11 GLU HG3 1 1
27 5331 1 1 11 GLU N N 1.654 4.566 1.819 1.00 . A A . 11 GLU N 1 1
27 5332 1 1 11 GLU O O 3.404 7.433 0.992 1.00 . A A . 11 GLU O 1 1
27 5333 1 1 11 GLU OE1 O 4.865 3.589 4.260 1.00 . A A . 11 GLU OE1 1 1
27 5334 1 1 12 THR C C 1.080 9.768 3.514 1.00 . A A . 12 THR C 1 1
27 5335 1 1 12 THR CA C 1.439 9.073 2.163 1.00 . A A . 12 THR CA 1 1
27 5336 1 1 12 THR CB C 0.428 9.277 0.984 1.00 . A A . 12 THR CB 1 1
27 5337 1 1 12 THR CG2 C 0.182 10.749 0.607 1.00 . A A . 12 THR CG2 1 1
27 5338 1 1 12 THR H H 1.029 7.091 3.023 1.00 . A A . 12 THR H 1 1
27 5339 1 1 12 THR HA H 2.390 9.541 1.839 1.00 . A A . 12 THR HA 1 1
27 5340 1 1 12 THR HB H -0.543 8.817 1.249 1.00 . A A . 12 THR HB 1 1
27 5341 1 1 12 THR HG1 H 1.297 7.806 0.094 1.00 . A A . 12 THR HG1 1 1
27 5342 1 1 12 THR HG21 H -0.523 10.833 -0.241 1.00 . A A . 12 THR HG21 1 1
27 5343 1 1 12 THR HG22 H -0.250 11.325 1.444 1.00 . A A . 12 THR HG22 1 1
27 5344 1 1 12 THR HG23 H 1.118 11.255 0.304 1.00 . A A . 12 THR HG23 1 1
27 5345 1 1 12 THR N N 1.682 7.625 2.439 1.00 . A A . 12 THR N 1 1
27 5346 1 1 12 THR O O 1.961 10.390 4.113 1.00 . A A . 12 THR O 1 1
27 5347 1 1 12 THR OG1 O 0.909 8.637 -0.195 1.00 . A A . 12 THR OG1 1 1
27 5348 1 1 13 THR C C -0.565 9.310 6.471 1.00 . A A . 13 THR C 1 1
27 5349 1 1 13 THR CA C -0.630 10.301 5.269 1.00 . A A . 13 THR CA 1 1
27 5350 1 1 13 THR CB C -2.023 10.998 5.136 1.00 . A A . 13 THR CB 1 1
27 5351 1 1 13 THR CG2 C -2.023 12.279 4.282 1.00 . A A . 13 THR CG2 1 1
27 5352 1 1 13 THR H H -0.820 9.117 3.409 1.00 . A A . 13 THR H 1 1
27 5353 1 1 13 THR HA H 0.074 11.117 5.530 1.00 . A A . 13 THR HA 1 1
27 5354 1 1 13 THR HB H -2.351 11.298 6.147 1.00 . A A . 13 THR HB 1 1
27 5355 1 1 13 THR HG1 H -2.872 10.101 3.661 1.00 . A A . 13 THR HG1 1 1
27 5356 1 1 13 THR HG21 H -1.742 12.081 3.232 1.00 . A A . 13 THR HG21 1 1
27 5357 1 1 13 THR HG22 H -3.022 12.753 4.269 1.00 . A A . 13 THR HG22 1 1
27 5358 1 1 13 THR HG23 H -1.316 13.033 4.677 1.00 . A A . 13 THR HG23 1 1
27 5359 1 1 13 THR N N -0.180 9.670 3.989 1.00 . A A . 13 THR N 1 1
27 5360 1 1 13 THR O O 0.155 9.589 7.433 1.00 . A A . 13 THR O 1 1
27 5361 1 1 13 THR OG1 O -3.007 10.110 4.611 1.00 . A A . 13 THR OG1 1 1
27 5362 1 1 14 ALA C C -1.422 5.762 6.940 1.00 . A A . 14 ALA C 1 1
27 5363 1 1 14 ALA CA C -1.324 7.183 7.529 1.00 . A A . 14 ALA CA 1 1
27 5364 1 1 14 ALA CB C -2.458 7.487 8.531 1.00 . A A . 14 ALA CB 1 1
27 5365 1 1 14 ALA H H -1.885 8.087 5.590 1.00 . A A . 14 ALA H 1 1
27 5366 1 1 14 ALA HXT H -3.182 6.295 6.305 1.00 . A A . 14 ALA HXT 1 1
27 5367 1 1 14 ALA HA H -0.371 7.223 8.091 1.00 . A A . 14 ALA HA 1 1
27 5368 1 1 14 ALA HB1 H -2.475 6.753 9.358 1.00 . A A . 14 ALA HB1 1 1
27 5369 1 1 14 ALA HB2 H -2.331 8.484 8.993 1.00 . A A . 14 ALA HB2 1 1
27 5370 1 1 14 ALA HB3 H -3.458 7.472 8.058 1.00 . A A . 14 ALA HB3 1 1
27 5371 1 1 14 ALA N N -1.313 8.187 6.436 1.00 . A A . 14 ALA N 1 1
27 5372 1 1 14 ALA O O -0.526 4.926 7.060 1.00 . A A . 14 ALA O 1 1
27 5373 1 1 14 ALA OXT O -2.605 5.528 6.281 1.00 . A A . 14 ALA OXT 1 1
28 5374 1 1 1 ACE C C 3.769 10.490 7.272 1.00 . A A . 1 ACE C 1 1
28 5375 1 1 1 ACE CH3 C 3.196 11.747 6.629 1.00 . A A . 1 ACE CH3 1 1
28 5376 1 1 1 ACE H1 H 3.713 12.652 6.998 1.00 . A A . 1 ACE H1 1 1
28 5377 1 1 1 ACE H2 H 3.303 11.739 5.530 1.00 . A A . 1 ACE H2 1 1
28 5378 1 1 1 ACE H3 H 2.123 11.861 6.870 1.00 . A A . 1 ACE H3 1 1
28 5379 1 1 1 ACE O O 4.499 10.586 8.261 1.00 . A A . 1 ACE O 1 1
28 5380 1 1 2 ILE C C 4.523 7.261 6.003 1.00 . A A . 2 ILE C 1 1
28 5381 1 1 2 ILE CA C 3.880 8.001 7.208 1.00 . A A . 2 ILE CA 1 1
28 5382 1 1 2 ILE CB C 2.804 7.190 8.032 1.00 . A A . 2 ILE CB 1 1
28 5383 1 1 2 ILE CD1 C 1.881 5.085 6.758 1.00 . A A . 2 ILE CD1 1 1
28 5384 1 1 2 ILE CG1 C 1.600 6.493 7.316 1.00 . A A . 2 ILE CG1 1 1
28 5385 1 1 2 ILE CG2 C 2.299 7.980 9.266 1.00 . A A . 2 ILE CG2 1 1
28 5386 1 1 2 ILE H H 2.935 9.405 5.814 1.00 . A A . 2 ILE H 1 1
28 5387 1 1 2 ILE HA H 4.707 8.177 7.922 1.00 . A A . 2 ILE HA 1 1
28 5388 1 1 2 ILE HB H 3.372 6.367 8.479 1.00 . A A . 2 ILE HB 1 1
28 5389 1 1 2 ILE HD11 H 0.958 4.630 6.355 1.00 . A A . 2 ILE HD11 1 1
28 5390 1 1 2 ILE HD12 H 2.618 5.080 5.938 1.00 . A A . 2 ILE HD12 1 1
28 5391 1 1 2 ILE HD13 H 2.258 4.403 7.542 1.00 . A A . 2 ILE HD13 1 1
28 5392 1 1 2 ILE HG12 H 0.762 6.344 8.030 1.00 . A A . 2 ILE HG12 1 1
28 5393 1 1 2 ILE HG13 H 1.172 7.134 6.525 1.00 . A A . 2 ILE HG13 1 1
28 5394 1 1 2 ILE HG21 H 1.715 7.344 9.956 1.00 . A A . 2 ILE HG21 1 1
28 5395 1 1 2 ILE HG22 H 3.137 8.398 9.856 1.00 . A A . 2 ILE HG22 1 1
28 5396 1 1 2 ILE HG23 H 1.652 8.828 8.978 1.00 . A A . 2 ILE HG23 1 1
28 5397 1 1 2 ILE N N 3.414 9.325 6.710 1.00 . A A . 2 ILE N 1 1
28 5398 1 1 2 ILE O O 3.839 6.972 5.014 1.00 . A A . 2 ILE O 1 1
28 5399 1 1 3 TRP C C 7.219 4.896 5.333 1.00 . A A . 3 TRP C 1 1
28 5400 1 1 3 TRP CA C 6.585 6.287 4.971 1.00 . A A . 3 TRP CA 1 1
28 5401 1 1 3 TRP CB C 7.591 7.291 4.332 1.00 . A A . 3 TRP CB 1 1
28 5402 1 1 3 TRP CD1 C 5.936 8.632 2.803 1.00 . A A . 3 TRP CD1 1 1
28 5403 1 1 3 TRP CD2 C 7.022 9.867 4.297 1.00 . A A . 3 TRP CD2 1 1
28 5404 1 1 3 TRP CE2 C 6.077 10.671 3.606 1.00 . A A . 3 TRP CE2 1 1
28 5405 1 1 3 TRP CE3 C 7.730 10.389 5.409 1.00 . A A . 3 TRP CE3 1 1
28 5406 1 1 3 TRP CG C 6.953 8.585 3.778 1.00 . A A . 3 TRP CG 1 1
28 5407 1 1 3 TRP CH2 C 6.578 12.511 5.094 1.00 . A A . 3 TRP CH2 1 1
28 5408 1 1 3 TRP CZ2 C 5.853 12.008 4.012 1.00 . A A . 3 TRP CZ2 1 1
28 5409 1 1 3 TRP CZ3 C 7.500 11.713 5.782 1.00 . A A . 3 TRP CZ3 1 1
28 5410 1 1 3 TRP H H 6.369 7.564 6.743 1.00 . A A . 3 TRP H 1 1
28 5411 1 1 3 TRP HA H 5.878 6.020 4.162 1.00 . A A . 3 TRP HA 1 1
28 5412 1 1 3 TRP HB2 H 8.388 7.538 5.059 1.00 . A A . 3 TRP HB2 1 1
28 5413 1 1 3 TRP HB3 H 8.123 6.797 3.497 1.00 . A A . 3 TRP HB3 1 1
28 5414 1 1 3 TRP HD1 H 5.493 7.743 2.385 1.00 . A A . 3 TRP HD1 1 1
28 5415 1 1 3 TRP HE1 H 4.578 10.205 2.113 1.00 . A A . 3 TRP HE1 1 1
28 5416 1 1 3 TRP HE3 H 8.410 9.768 5.976 1.00 . A A . 3 TRP HE3 1 1
28 5417 1 1 3 TRP HH2 H 6.410 13.528 5.418 1.00 . A A . 3 TRP HH2 1 1
28 5418 1 1 3 TRP HZ2 H 5.115 12.620 3.514 1.00 . A A . 3 TRP HZ2 1 1
28 5419 1 1 3 TRP HZ3 H 8.029 12.125 6.631 1.00 . A A . 3 TRP HZ3 1 1
28 5420 1 1 3 TRP N N 5.845 6.987 6.072 1.00 . A A . 3 TRP N 1 1
28 5421 1 1 3 TRP NE1 N 5.399 9.923 2.658 1.00 . A A . 3 TRP NE1 1 1
28 5422 1 1 3 TRP O O 8.000 4.362 4.540 1.00 . A A . 3 TRP O 1 1
28 5423 1 1 4 GLY C C 6.092 2.069 7.072 1.00 . A A . 4 GLY C 1 1
28 5424 1 1 4 GLY CA C 7.336 2.964 6.923 1.00 . A A . 4 GLY CA 1 1
28 5425 1 1 4 GLY H H 6.175 4.822 7.033 1.00 . A A . 4 GLY H 1 1
28 5426 1 1 4 GLY HA2 H 8.085 2.526 6.236 1.00 . A A . 4 GLY HA2 1 1
28 5427 1 1 4 GLY HA3 H 7.838 3.071 7.903 1.00 . A A . 4 GLY HA3 1 1
28 5428 1 1 4 GLY N N 6.858 4.294 6.484 1.00 . A A . 4 GLY N 1 1
28 5429 1 1 4 GLY O O 5.471 2.047 8.138 1.00 . A A . 4 GLY O 1 1
28 5430 1 1 5 . C C 3.358 1.230 5.248 1.00 . A A . 5 SET C 1 1
28 5431 1 1 5 . CA C 4.537 0.472 5.944 1.00 . A A . 5 SET CA 1 1
28 5432 1 1 5 . CB C 4.840 -0.911 5.289 1.00 . A A . 5 SET CB 1 1
28 5433 1 1 5 . H H 6.331 1.504 5.168 1.00 . A A . 5 SET H 1 1
28 5434 1 1 5 . HA H 4.194 0.291 6.984 1.00 . A A . 5 SET HA 1 1
28 5435 1 1 5 . HB2 H 2.459 0.586 5.276 1.00 . A A . 5 SET HB2 1 1
28 5436 1 1 5 . HB3 H 3.067 2.100 5.869 1.00 . A A . 5 SET HB3 1 1
28 5437 1 1 5 . HNT2 H 3.276 1.011 3.086 1.00 . A A . 5 SET HNT2 1 1
28 5438 1 1 5 . N N 5.748 1.340 5.996 1.00 . A A . 5 SET N 1 1
28 5439 1 1 5 . NT N 3.552 1.660 3.833 1.00 . A A . 5 SET NT 1 1
28 5440 1 1 5 . OG O 5.502 -0.988 4.248 1.00 . A A . 5 SET OG 1 1
28 5441 1 1 6 SER C C 3.131 -4.108 5.506 1.00 . A A . 6 SER C 1 1
28 5442 1 1 6 SER CA C 4.509 -3.391 5.413 1.00 . A A . 6 SER CA 1 1
28 5443 1 1 6 SER CB C 5.583 -4.130 6.244 1.00 . A A . 6 SER CB 1 1
28 5444 1 1 6 SER H H 3.809 -1.814 6.769 1.00 . A A . 6 SER H 1 1
28 5445 1 1 6 SER HA H 4.852 -3.383 4.359 1.00 . A A . 6 SER HA 1 1
28 5446 1 1 6 SER HB2 H 5.322 -4.146 7.320 1.00 . A A . 6 SER HB2 1 1
28 5447 1 1 6 SER HB3 H 5.646 -5.191 5.934 1.00 . A A . 6 SER HB3 1 1
28 5448 1 1 6 SER HG H 7.030 -3.493 5.133 1.00 . A A . 6 SER HG 1 1
28 5449 1 1 6 SER N N 4.329 -1.996 5.904 1.00 . A A . 6 SER N 1 1
28 5450 1 1 6 SER O O 2.508 -4.136 6.575 1.00 . A A . 6 SER O 1 1
28 5451 1 1 6 SER OG O 6.867 -3.534 6.079 1.00 . A A . 6 SER OG 1 1
28 5452 1 1 7 GLY C C 0.274 -4.454 3.742 1.00 . A A . 7 GLY C 1 1
28 5453 1 1 7 GLY CA C 1.341 -5.387 4.346 1.00 . A A . 7 GLY CA 1 1
28 5454 1 1 7 GLY H H 3.252 -4.614 3.558 1.00 . A A . 7 GLY H 1 1
28 5455 1 1 7 GLY HA2 H 1.432 -6.290 3.716 1.00 . A A . 7 GLY HA2 1 1
28 5456 1 1 7 GLY HA3 H 1.023 -5.762 5.340 1.00 . A A . 7 GLY HA3 1 1
28 5457 1 1 7 GLY N N 2.658 -4.699 4.390 1.00 . A A . 7 GLY N 1 1
28 5458 1 1 7 GLY O O -0.088 -4.601 2.571 1.00 . A A . 7 GLY O 1 1
28 5459 1 1 8 LYS C C -0.349 -1.288 3.602 1.00 . A A . 8 LYS C 1 1
28 5460 1 1 8 LYS CA C -1.208 -2.481 4.120 1.00 . A A . 8 LYS CA 1 1
28 5461 1 1 8 LYS CB C -2.127 -2.143 5.322 1.00 . A A . 8 LYS CB 1 1
28 5462 1 1 8 LYS CD C -4.118 -0.742 6.215 1.00 . A A . 8 LYS CD 1 1
28 5463 1 1 8 LYS CE C -5.034 -1.850 6.770 1.00 . A A . 8 LYS CE 1 1
28 5464 1 1 8 LYS CG C -3.275 -1.161 4.993 1.00 . A A . 8 LYS CG 1 1
28 5465 1 1 8 LYS H H 0.253 -3.413 5.456 1.00 . A A . 8 LYS H 1 1
28 5466 1 1 8 LYS HA H -1.851 -2.886 3.310 1.00 . A A . 8 LYS HA 1 1
28 5467 1 1 8 LYS HB2 H -2.566 -3.081 5.715 1.00 . A A . 8 LYS HB2 1 1
28 5468 1 1 8 LYS HB3 H -1.521 -1.735 6.154 1.00 . A A . 8 LYS HB3 1 1
28 5469 1 1 8 LYS HD2 H -3.443 -0.364 7.008 1.00 . A A . 8 LYS HD2 1 1
28 5470 1 1 8 LYS HD3 H -4.732 0.128 5.916 1.00 . A A . 8 LYS HD3 1 1
28 5471 1 1 8 LYS HE2 H -5.698 -2.235 5.971 1.00 . A A . 8 LYS HE2 1 1
28 5472 1 1 8 LYS HE3 H -4.435 -2.715 7.112 1.00 . A A . 8 LYS HE3 1 1
28 5473 1 1 8 LYS HG2 H -2.846 -0.243 4.547 1.00 . A A . 8 LYS HG2 1 1
28 5474 1 1 8 LYS HG3 H -3.927 -1.584 4.206 1.00 . A A . 8 LYS HG3 1 1
28 5475 1 1 8 LYS HZ1 H -6.470 -2.071 8.278 1.00 . A A . 8 LYS HZ1 1 1
28 5476 1 1 8 LYS HZ2 H -5.271 -1.008 8.669 1.00 . A A . 8 LYS HZ2 1 1
28 5477 1 1 8 LYS HZ3 H -6.452 -0.562 7.609 1.00 . A A . 8 LYS HZ3 1 1
28 5478 1 1 8 LYS N N -0.221 -3.501 4.555 1.00 . A A . 8 LYS N 1 1
28 5479 1 1 8 LYS NZ N -5.852 -1.346 7.893 1.00 . A A . 8 LYS NZ 1 1
28 5480 1 1 8 LYS O O 0.066 -0.406 4.363 1.00 . A A . 8 LYS O 1 1
28 5481 1 1 9 LEU C C -0.008 1.023 1.284 1.00 . A A . 9 LEU C 1 1
28 5482 1 1 9 LEU CA C 0.766 -0.288 1.616 1.00 . A A . 9 LEU CA 1 1
28 5483 1 1 9 LEU CB C 1.463 -0.897 0.362 1.00 . A A . 9 LEU CB 1 1
28 5484 1 1 9 LEU CD1 C 2.994 -2.590 -0.760 1.00 . A A . 9 LEU CD1 1 1
28 5485 1 1 9 LEU CD2 C 3.778 -1.488 1.365 1.00 . A A . 9 LEU CD2 1 1
28 5486 1 1 9 LEU CG C 2.546 -1.996 0.590 1.00 . A A . 9 LEU CG 1 1
28 5487 1 1 9 LEU H H -0.456 -2.139 1.819 1.00 . A A . 9 LEU H 1 1
28 5488 1 1 9 LEU HA H 1.593 -0.026 2.304 1.00 . A A . 9 LEU HA 1 1
28 5489 1 1 9 LEU HB2 H 0.680 -1.289 -0.319 1.00 . A A . 9 LEU HB2 1 1
28 5490 1 1 9 LEU HB3 H 1.935 -0.077 -0.214 1.00 . A A . 9 LEU HB3 1 1
28 5491 1 1 9 LEU HD11 H 2.142 -3.023 -1.317 1.00 . A A . 9 LEU HD11 1 1
28 5492 1 1 9 LEU HD12 H 3.464 -1.833 -1.414 1.00 . A A . 9 LEU HD12 1 1
28 5493 1 1 9 LEU HD13 H 3.728 -3.407 -0.623 1.00 . A A . 9 LEU HD13 1 1
28 5494 1 1 9 LEU HD21 H 4.258 -0.624 0.869 1.00 . A A . 9 LEU HD21 1 1
28 5495 1 1 9 LEU HD22 H 3.516 -1.174 2.391 1.00 . A A . 9 LEU HD22 1 1
28 5496 1 1 9 LEU HD23 H 4.549 -2.273 1.474 1.00 . A A . 9 LEU HD23 1 1
28 5497 1 1 9 LEU HG H 2.109 -2.828 1.174 1.00 . A A . 9 LEU HG 1 1
28 5498 1 1 9 LEU N N -0.082 -1.307 2.286 1.00 . A A . 9 LEU N 1 1
28 5499 1 1 9 LEU O O -0.682 1.145 0.257 1.00 . A A . 9 LEU O 1 1
28 5500 1 1 10 ILE C C 0.628 4.315 2.597 1.00 . A A . 10 ILE C 1 1
28 5501 1 1 10 ILE CA C -0.489 3.346 2.091 1.00 . A A . 10 ILE CA 1 1
28 5502 1 1 10 ILE CB C -1.897 3.419 2.795 1.00 . A A . 10 ILE CB 1 1
28 5503 1 1 10 ILE CD1 C -2.904 5.240 1.223 1.00 . A A . 10 ILE CD1 1 1
28 5504 1 1 10 ILE CG1 C -2.599 4.800 2.663 1.00 . A A . 10 ILE CG1 1 1
28 5505 1 1 10 ILE CG2 C -1.924 2.978 4.283 1.00 . A A . 10 ILE CG2 1 1
28 5506 1 1 10 ILE H H 0.629 1.722 3.046 1.00 . A A . 10 ILE H 1 1
28 5507 1 1 10 ILE HA H -0.656 3.575 1.019 1.00 . A A . 10 ILE HA 1 1
28 5508 1 1 10 ILE HB H -2.544 2.693 2.265 1.00 . A A . 10 ILE HB 1 1
28 5509 1 1 10 ILE HD11 H -3.495 4.478 0.684 1.00 . A A . 10 ILE HD11 1 1
28 5510 1 1 10 ILE HD12 H -3.485 6.180 1.212 1.00 . A A . 10 ILE HD12 1 1
28 5511 1 1 10 ILE HD13 H -1.980 5.422 0.645 1.00 . A A . 10 ILE HD13 1 1
28 5512 1 1 10 ILE HG12 H -3.561 4.781 3.212 1.00 . A A . 10 ILE HG12 1 1
28 5513 1 1 10 ILE HG13 H -2.001 5.584 3.166 1.00 . A A . 10 ILE HG13 1 1
28 5514 1 1 10 ILE HG21 H -2.952 2.978 4.694 1.00 . A A . 10 ILE HG21 1 1
28 5515 1 1 10 ILE HG22 H -1.535 1.952 4.416 1.00 . A A . 10 ILE HG22 1 1
28 5516 1 1 10 ILE HG23 H -1.318 3.638 4.928 1.00 . A A . 10 ILE HG23 1 1
28 5517 1 1 10 ILE N N 0.119 1.994 2.201 1.00 . A A . 10 ILE N 1 1
28 5518 1 1 10 ILE O O 0.571 4.830 3.718 1.00 . A A . 10 ILE O 1 1
28 5519 1 1 11 GLU C C 2.667 6.885 1.585 1.00 . A A . 11 GLU C 1 1
28 5520 1 1 11 GLU CA C 2.809 5.419 2.109 1.00 . A A . 11 GLU CA 1 1
28 5521 1 1 11 GLU CB C 4.119 4.714 1.632 1.00 . A A . 11 GLU CB 1 1
28 5522 1 1 11 GLU CD C 4.121 2.852 3.514 1.00 . A A . 11 GLU CD 1 1
28 5523 1 1 11 GLU CG C 4.386 3.232 2.030 1.00 . A A . 11 GLU CG 1 1
28 5524 1 1 11 GLU H H 1.608 4.054 0.858 1.00 . A A . 11 GLU H 1 1
28 5525 1 1 11 GLU HA H 2.928 5.450 3.211 1.00 . A A . 11 GLU HA 1 1
28 5526 1 1 11 GLU HB2 H 4.195 4.783 0.529 1.00 . A A . 11 GLU HB2 1 1
28 5527 1 1 11 GLU HB3 H 4.973 5.314 1.999 1.00 . A A . 11 GLU HB3 1 1
28 5528 1 1 11 GLU HG2 H 3.823 2.587 1.333 1.00 . A A . 11 GLU HG2 1 1
28 5529 1 1 11 GLU HG3 H 5.452 3.034 1.790 1.00 . A A . 11 GLU HG3 1 1
28 5530 1 1 11 GLU N N 1.644 4.570 1.743 1.00 . A A . 11 GLU N 1 1
28 5531 1 1 11 GLU O O 3.399 7.296 0.678 1.00 . A A . 11 GLU O 1 1
28 5532 1 1 11 GLU OE1 O 4.459 3.656 4.385 1.00 . A A . 11 GLU OE1 1 1
28 5533 1 1 12 THR C C 1.280 9.935 3.020 1.00 . A A . 12 THR C 1 1
28 5534 1 1 12 THR CA C 1.512 9.100 1.723 1.00 . A A . 12 THR CA 1 1
28 5535 1 1 12 THR CB C 0.427 9.210 0.601 1.00 . A A . 12 THR CB 1 1
28 5536 1 1 12 THR CG2 C 0.199 10.638 0.078 1.00 . A A . 12 THR CG2 1 1
28 5537 1 1 12 THR H H 1.056 7.235 2.778 1.00 . A A . 12 THR H 1 1
28 5538 1 1 12 THR HA H 2.451 9.496 1.287 1.00 . A A . 12 THR HA 1 1
28 5539 1 1 12 THR HB H -0.536 8.818 0.981 1.00 . A A . 12 THR HB 1 1
28 5540 1 1 12 THR HG1 H 1.158 7.605 -0.173 1.00 . A A . 12 THR HG1 1 1
28 5541 1 1 12 THR HG21 H -0.556 10.654 -0.730 1.00 . A A . 12 THR HG21 1 1
28 5542 1 1 12 THR HG22 H -0.164 11.317 0.870 1.00 . A A . 12 THR HG22 1 1
28 5543 1 1 12 THR HG23 H 1.128 11.076 -0.334 1.00 . A A . 12 THR HG23 1 1
28 5544 1 1 12 THR N N 1.725 7.684 2.141 1.00 . A A . 12 THR N 1 1
28 5545 1 1 12 THR O O 2.230 10.558 3.502 1.00 . A A . 12 THR O 1 1
28 5546 1 1 12 THR OG1 O 0.806 8.426 -0.526 1.00 . A A . 12 THR OG1 1 1
28 5547 1 1 13 THR C C -0.594 9.730 5.999 1.00 . A A . 13 THR C 1 1
28 5548 1 1 13 THR CA C -0.295 10.700 4.816 1.00 . A A . 13 THR CA 1 1
28 5549 1 1 13 THR CB C -1.425 11.751 4.575 1.00 . A A . 13 THR CB 1 1
28 5550 1 1 13 THR CG2 C -0.993 12.967 3.741 1.00 . A A . 13 THR CG2 1 1
28 5551 1 1 13 THR H H -0.663 9.416 3.064 1.00 . A A . 13 THR H 1 1
28 5552 1 1 13 THR HA H 0.583 11.289 5.145 1.00 . A A . 13 THR HA 1 1
28 5553 1 1 13 THR HB H -1.743 12.138 5.560 1.00 . A A . 13 THR HB 1 1
28 5554 1 1 13 THR HG1 H -2.346 11.078 3.025 1.00 . A A . 13 THR HG1 1 1
28 5555 1 1 13 THR HG21 H -0.680 12.682 2.721 1.00 . A A . 13 THR HG21 1 1
28 5556 1 1 13 THR HG22 H -1.817 13.698 3.639 1.00 . A A . 13 THR HG22 1 1
28 5557 1 1 13 THR HG23 H -0.144 13.500 4.208 1.00 . A A . 13 THR HG23 1 1
28 5558 1 1 13 THR N N 0.051 9.942 3.578 1.00 . A A . 13 THR N 1 1
28 5559 1 1 13 THR O O 0.153 9.745 6.982 1.00 . A A . 13 THR O 1 1
28 5560 1 1 13 THR OG1 O -2.568 11.166 3.954 1.00 . A A . 13 THR OG1 1 1
28 5561 1 1 14 ALA C C -2.326 6.560 6.390 1.00 . A A . 14 ALA C 1 1
28 5562 1 1 14 ALA CA C -2.044 7.954 6.991 1.00 . A A . 14 ALA CA 1 1
28 5563 1 1 14 ALA CB C -3.237 8.508 7.793 1.00 . A A . 14 ALA CB 1 1
28 5564 1 1 14 ALA H H -2.225 9.034 5.070 1.00 . A A . 14 ALA H 1 1
28 5565 1 1 14 ALA HXT H -3.809 7.412 5.460 1.00 . A A . 14 ALA HXT 1 1
28 5566 1 1 14 ALA HA H -1.208 7.822 7.706 1.00 . A A . 14 ALA HA 1 1
28 5567 1 1 14 ALA HB1 H -3.532 7.819 8.607 1.00 . A A . 14 ALA HB1 1 1
28 5568 1 1 14 ALA HB2 H -2.990 9.475 8.270 1.00 . A A . 14 ALA HB2 1 1
28 5569 1 1 14 ALA HB3 H -4.133 8.674 7.165 1.00 . A A . 14 ALA HB3 1 1
28 5570 1 1 14 ALA N N -1.665 8.912 5.921 1.00 . A A . 14 ALA N 1 1
28 5571 1 1 14 ALA O O -1.654 5.568 6.664 1.00 . A A . 14 ALA O 1 1
28 5572 1 1 14 ALA OXT O -3.403 6.545 5.535 1.00 . A A . 14 ALA OXT 1 1
29 5573 1 1 1 ACE C C 7.388 10.730 5.087 1.00 . A A . 1 ACE C 1 1
29 5574 1 1 1 ACE CH3 C 6.514 11.889 4.621 1.00 . A A . 1 ACE CH3 1 1
29 5575 1 1 1 ACE H1 H 6.085 12.442 5.477 1.00 . A A . 1 ACE H1 1 1
29 5576 1 1 1 ACE H2 H 7.097 12.612 4.022 1.00 . A A . 1 ACE H2 1 1
29 5577 1 1 1 ACE H3 H 5.677 11.538 3.988 1.00 . A A . 1 ACE H3 1 1
29 5578 1 1 1 ACE O O 8.593 10.708 4.824 1.00 . A A . 1 ACE O 1 1
29 5579 1 1 2 ILE C C 6.697 7.364 5.654 1.00 . A A . 2 ILE C 1 1
29 5580 1 1 2 ILE CA C 7.425 8.570 6.329 1.00 . A A . 2 ILE CA 1 1
29 5581 1 1 2 ILE CB C 7.415 8.530 7.903 1.00 . A A . 2 ILE CB 1 1
29 5582 1 1 2 ILE CD1 C 9.572 10.006 8.333 1.00 . A A . 2 ILE CD1 1 1
29 5583 1 1 2 ILE CG1 C 8.076 9.757 8.603 1.00 . A A . 2 ILE CG1 1 1
29 5584 1 1 2 ILE CG2 C 8.006 7.219 8.483 1.00 . A A . 2 ILE CG2 1 1
29 5585 1 1 2 ILE H H 5.731 9.894 5.806 1.00 . A A . 2 ILE H 1 1
29 5586 1 1 2 ILE HA H 8.500 8.549 6.046 1.00 . A A . 2 ILE HA 1 1
29 5587 1 1 2 ILE HB H 6.357 8.544 8.223 1.00 . A A . 2 ILE HB 1 1
29 5588 1 1 2 ILE HD11 H 9.929 10.899 8.878 1.00 . A A . 2 ILE HD11 1 1
29 5589 1 1 2 ILE HD12 H 10.198 9.156 8.658 1.00 . A A . 2 ILE HD12 1 1
29 5590 1 1 2 ILE HD13 H 9.775 10.181 7.261 1.00 . A A . 2 ILE HD13 1 1
29 5591 1 1 2 ILE HG12 H 7.521 10.672 8.325 1.00 . A A . 2 ILE HG12 1 1
29 5592 1 1 2 ILE HG13 H 7.929 9.673 9.696 1.00 . A A . 2 ILE HG13 1 1
29 5593 1 1 2 ILE HG21 H 9.059 7.065 8.180 1.00 . A A . 2 ILE HG21 1 1
29 5594 1 1 2 ILE HG22 H 7.978 7.208 9.590 1.00 . A A . 2 ILE HG22 1 1
29 5595 1 1 2 ILE HG23 H 7.442 6.328 8.152 1.00 . A A . 2 ILE HG23 1 1
29 5596 1 1 2 ILE N N 6.753 9.787 5.790 1.00 . A A . 2 ILE N 1 1
29 5597 1 1 2 ILE O O 5.607 6.967 6.075 1.00 . A A . 2 ILE O 1 1
29 5598 1 1 3 TRP C C 7.553 4.379 4.332 1.00 . A A . 3 TRP C 1 1
29 5599 1 1 3 TRP CA C 6.751 5.623 3.869 1.00 . A A . 3 TRP CA 1 1
29 5600 1 1 3 TRP CB C 6.800 5.831 2.328 1.00 . A A . 3 TRP CB 1 1
29 5601 1 1 3 TRP CD1 C 5.154 7.783 1.746 1.00 . A A . 3 TRP CD1 1 1
29 5602 1 1 3 TRP CD2 C 4.476 5.769 1.103 1.00 . A A . 3 TRP CD2 1 1
29 5603 1 1 3 TRP CE2 C 3.513 6.736 0.722 1.00 . A A . 3 TRP CE2 1 1
29 5604 1 1 3 TRP CE3 C 4.254 4.393 0.841 1.00 . A A . 3 TRP CE3 1 1
29 5605 1 1 3 TRP CG C 5.519 6.426 1.733 1.00 . A A . 3 TRP CG 1 1
29 5606 1 1 3 TRP CH2 C 2.129 4.978 -0.194 1.00 . A A . 3 TRP CH2 1 1
29 5607 1 1 3 TRP CZ2 C 2.323 6.335 0.070 1.00 . A A . 3 TRP CZ2 1 1
29 5608 1 1 3 TRP CZ3 C 3.078 4.022 0.190 1.00 . A A . 3 TRP CZ3 1 1
29 5609 1 1 3 TRP H H 8.234 7.182 4.386 1.00 . A A . 3 TRP H 1 1
29 5610 1 1 3 TRP HA H 5.683 5.466 4.134 1.00 . A A . 3 TRP HA 1 1
29 5611 1 1 3 TRP HB2 H 7.675 6.442 2.032 1.00 . A A . 3 TRP HB2 1 1
29 5612 1 1 3 TRP HB3 H 6.980 4.864 1.820 1.00 . A A . 3 TRP HB3 1 1
29 5613 1 1 3 TRP HD1 H 5.725 8.546 2.245 1.00 . A A . 3 TRP HD1 1 1
29 5614 1 1 3 TRP HE1 H 3.422 8.890 0.980 1.00 . A A . 3 TRP HE1 1 1
29 5615 1 1 3 TRP HE3 H 4.974 3.642 1.136 1.00 . A A . 3 TRP HE3 1 1
29 5616 1 1 3 TRP HH2 H 1.233 4.660 -0.706 1.00 . A A . 3 TRP HH2 1 1
29 5617 1 1 3 TRP HZ2 H 1.579 7.063 -0.221 1.00 . A A . 3 TRP HZ2 1 1
29 5618 1 1 3 TRP HZ3 H 2.902 2.979 -0.026 1.00 . A A . 3 TRP HZ3 1 1
29 5619 1 1 3 TRP N N 7.308 6.798 4.597 1.00 . A A . 3 TRP N 1 1
29 5620 1 1 3 TRP NE1 N 3.927 8.004 1.095 1.00 . A A . 3 TRP NE1 1 1
29 5621 1 1 3 TRP O O 8.607 4.044 3.777 1.00 . A A . 3 TRP O 1 1
29 5622 1 1 4 GLY C C 6.736 1.638 6.791 1.00 . A A . 4 GLY C 1 1
29 5623 1 1 4 GLY CA C 7.671 2.513 5.942 1.00 . A A . 4 GLY CA 1 1
29 5624 1 1 4 GLY H H 6.256 4.210 5.816 1.00 . A A . 4 GLY H 1 1
29 5625 1 1 4 GLY HA2 H 8.129 1.901 5.142 1.00 . A A . 4 GLY HA2 1 1
29 5626 1 1 4 GLY HA3 H 8.508 2.852 6.577 1.00 . A A . 4 GLY HA3 1 1
29 5627 1 1 4 GLY N N 7.027 3.710 5.368 1.00 . A A . 4 GLY N 1 1
29 5628 1 1 4 GLY O O 6.708 1.776 8.017 1.00 . A A . 4 GLY O 1 1
29 5629 1 1 5 . C C 3.777 0.442 7.415 1.00 . A A . 5 SET C 1 1
29 5630 1 1 5 . CA C 5.055 -0.207 6.812 1.00 . A A . 5 SET CA 1 1
29 5631 1 1 5 . CB C 4.742 -1.396 5.852 1.00 . A A . 5 SET CB 1 1
29 5632 1 1 5 . H H 6.065 0.769 5.112 1.00 . A A . 5 SET H 1 1
29 5633 1 1 5 . HA H 5.605 -0.600 7.692 1.00 . A A . 5 SET HA 1 1
29 5634 1 1 5 . HB2 H 3.195 -0.338 7.939 1.00 . A A . 5 SET HB2 1 1
29 5635 1 1 5 . HB3 H 4.093 1.144 8.211 1.00 . A A . 5 SET HB3 1 1
29 5636 1 1 5 . HNT2 H 3.058 1.171 5.459 1.00 . A A . 5 SET HNT2 1 1
29 5637 1 1 5 . N N 5.987 0.735 6.133 1.00 . A A . 5 SET N 1 1
29 5638 1 1 5 . NT N 2.886 1.154 6.470 1.00 . A A . 5 SET NT 1 1
29 5639 1 1 5 . OG O 4.214 -1.199 4.753 1.00 . A A . 5 SET OG 1 1
29 5640 1 1 6 SER C C 3.350 -4.345 5.615 1.00 . A A . 6 SER C 1 1
29 5641 1 1 6 SER CA C 4.827 -3.867 5.492 1.00 . A A . 6 SER CA 1 1
29 5642 1 1 6 SER CB C 5.803 -4.968 5.972 1.00 . A A . 6 SER CB 1 1
29 5643 1 1 6 SER H H 5.449 -2.673 7.234 1.00 . A A . 6 SER H 1 1
29 5644 1 1 6 SER HA H 5.076 -3.659 4.431 1.00 . A A . 6 SER HA 1 1
29 5645 1 1 6 SER HB2 H 5.689 -5.168 7.055 1.00 . A A . 6 SER HB2 1 1
29 5646 1 1 6 SER HB3 H 5.584 -5.927 5.466 1.00 . A A . 6 SER HB3 1 1
29 5647 1 1 6 SER HG H 7.698 -5.343 6.008 1.00 . A A . 6 SER HG 1 1
29 5648 1 1 6 SER N N 5.058 -2.630 6.289 1.00 . A A . 6 SER N 1 1
29 5649 1 1 6 SER O O 2.826 -4.477 6.727 1.00 . A A . 6 SER O 1 1
29 5650 1 1 6 SER OG O 7.156 -4.614 5.693 1.00 . A A . 6 SER OG 1 1
29 5651 1 1 7 GLY C C 0.297 -3.954 3.972 1.00 . A A . 7 GLY C 1 1
29 5652 1 1 7 GLY CA C 1.273 -5.050 4.448 1.00 . A A . 7 GLY CA 1 1
29 5653 1 1 7 GLY H H 3.211 -4.420 3.603 1.00 . A A . 7 GLY H 1 1
29 5654 1 1 7 GLY HA2 H 1.194 -5.917 3.766 1.00 . A A . 7 GLY HA2 1 1
29 5655 1 1 7 GLY HA3 H 0.937 -5.439 5.429 1.00 . A A . 7 GLY HA3 1 1
29 5656 1 1 7 GLY N N 2.693 -4.608 4.468 1.00 . A A . 7 GLY N 1 1
29 5657 1 1 7 GLY O O -0.430 -4.157 2.996 1.00 . A A . 7 GLY O 1 1
29 5658 1 1 8 LYS C C 0.135 -0.788 3.275 1.00 . A A . 8 LYS C 1 1
29 5659 1 1 8 LYS CA C -0.596 -1.654 4.344 1.00 . A A . 8 LYS CA 1 1
29 5660 1 1 8 LYS CB C -0.916 -0.893 5.658 1.00 . A A . 8 LYS CB 1 1
29 5661 1 1 8 LYS CD C -2.217 1.033 6.812 1.00 . A A . 8 LYS CD 1 1
29 5662 1 1 8 LYS CE C -3.076 0.272 7.841 1.00 . A A . 8 LYS CE 1 1
29 5663 1 1 8 LYS CG C -1.939 0.258 5.508 1.00 . A A . 8 LYS CG 1 1
29 5664 1 1 8 LYS H H 1.035 -2.702 5.347 1.00 . A A . 8 LYS H 1 1
29 5665 1 1 8 LYS HA H -1.564 -2.034 3.953 1.00 . A A . 8 LYS HA 1 1
29 5666 1 1 8 LYS HB2 H -1.306 -1.611 6.405 1.00 . A A . 8 LYS HB2 1 1
29 5667 1 1 8 LYS HB3 H 0.020 -0.496 6.100 1.00 . A A . 8 LYS HB3 1 1
29 5668 1 1 8 LYS HD2 H -1.254 1.335 7.268 1.00 . A A . 8 LYS HD2 1 1
29 5669 1 1 8 LYS HD3 H -2.721 1.981 6.542 1.00 . A A . 8 LYS HD3 1 1
29 5670 1 1 8 LYS HE2 H -4.044 -0.024 7.390 1.00 . A A . 8 LYS HE2 1 1
29 5671 1 1 8 LYS HE3 H -2.579 -0.669 8.143 1.00 . A A . 8 LYS HE3 1 1
29 5672 1 1 8 LYS HG2 H -1.561 0.979 4.758 1.00 . A A . 8 LYS HG2 1 1
29 5673 1 1 8 LYS HG3 H -2.888 -0.124 5.083 1.00 . A A . 8 LYS HG3 1 1
29 5674 1 1 8 LYS HZ1 H -3.813 1.973 8.806 1.00 . A A . 8 LYS HZ1 1 1
29 5675 1 1 8 LYS HZ2 H -3.890 0.615 9.740 1.00 . A A . 8 LYS HZ2 1 1
29 5676 1 1 8 LYS HZ3 H -2.444 1.373 9.501 1.00 . A A . 8 LYS HZ3 1 1
29 5677 1 1 8 LYS N N 0.271 -2.806 4.679 1.00 . A A . 8 LYS N 1 1
29 5678 1 1 8 LYS NZ N -3.320 1.103 9.039 1.00 . A A . 8 LYS NZ 1 1
29 5679 1 1 8 LYS O O 1.023 0.015 3.580 1.00 . A A . 8 LYS O 1 1
29 5680 1 1 9 LEU C C 0.029 1.275 0.679 1.00 . A A . 9 LEU C 1 1
29 5681 1 1 9 LEU CA C 0.302 -0.266 0.835 1.00 . A A . 9 LEU CA 1 1
29 5682 1 1 9 LEU CB C 0.002 -1.070 -0.470 1.00 . A A . 9 LEU CB 1 1
29 5683 1 1 9 LEU CD1 C -1.362 -1.539 -2.577 1.00 . A A . 9 LEU CD1 1 1
29 5684 1 1 9 LEU CD2 C -2.529 -1.658 -0.352 1.00 . A A . 9 LEU CD2 1 1
29 5685 1 1 9 LEU CG C -1.401 -0.968 -1.144 1.00 . A A . 9 LEU CG 1 1
29 5686 1 1 9 LEU H H -0.800 -1.862 1.941 1.00 . A A . 9 LEU H 1 1
29 5687 1 1 9 LEU HA H 1.402 -0.330 0.952 1.00 . A A . 9 LEU HA 1 1
29 5688 1 1 9 LEU HB2 H 0.752 -0.731 -1.213 1.00 . A A . 9 LEU HB2 1 1
29 5689 1 1 9 LEU HB3 H 0.261 -2.137 -0.320 1.00 . A A . 9 LEU HB3 1 1
29 5690 1 1 9 LEU HD11 H -0.616 -1.019 -3.205 1.00 . A A . 9 LEU HD11 1 1
29 5691 1 1 9 LEU HD12 H -1.110 -2.616 -2.595 1.00 . A A . 9 LEU HD12 1 1
29 5692 1 1 9 LEU HD13 H -2.334 -1.424 -3.093 1.00 . A A . 9 LEU HD13 1 1
29 5693 1 1 9 LEU HD21 H -3.499 -1.587 -0.880 1.00 . A A . 9 LEU HD21 1 1
29 5694 1 1 9 LEU HD22 H -2.325 -2.732 -0.187 1.00 . A A . 9 LEU HD22 1 1
29 5695 1 1 9 LEU HD23 H -2.681 -1.190 0.637 1.00 . A A . 9 LEU HD23 1 1
29 5696 1 1 9 LEU HG H -1.666 0.100 -1.237 1.00 . A A . 9 LEU HG 1 1
29 5697 1 1 9 LEU N N -0.270 -0.988 2.015 1.00 . A A . 9 LEU N 1 1
29 5698 1 1 9 LEU O O 0.565 1.873 -0.258 1.00 . A A . 9 LEU O 1 1
29 5699 1 1 10 ILE C C -0.769 3.954 2.916 1.00 . A A . 10 ILE C 1 1
29 5700 1 1 10 ILE CA C -1.087 3.365 1.505 1.00 . A A . 10 ILE CA 1 1
29 5701 1 1 10 ILE CB C -2.533 3.602 0.926 1.00 . A A . 10 ILE CB 1 1
29 5702 1 1 10 ILE CD1 C -2.051 5.754 -0.465 1.00 . A A . 10 ILE CD1 1 1
29 5703 1 1 10 ILE CG1 C -2.869 5.097 0.658 1.00 . A A . 10 ILE CG1 1 1
29 5704 1 1 10 ILE CG2 C -3.695 2.956 1.728 1.00 . A A . 10 ILE CG2 1 1
29 5705 1 1 10 ILE H H -1.163 1.322 2.296 1.00 . A A . 10 ILE H 1 1
29 5706 1 1 10 ILE HA H -0.397 3.856 0.794 1.00 . A A . 10 ILE HA 1 1
29 5707 1 1 10 ILE HB H -2.557 3.103 -0.063 1.00 . A A . 10 ILE HB 1 1
29 5708 1 1 10 ILE HD11 H -2.133 5.189 -1.411 1.00 . A A . 10 ILE HD11 1 1
29 5709 1 1 10 ILE HD12 H -2.407 6.781 -0.664 1.00 . A A . 10 ILE HD12 1 1
29 5710 1 1 10 ILE HD13 H -0.979 5.826 -0.208 1.00 . A A . 10 ILE HD13 1 1
29 5711 1 1 10 ILE HG12 H -3.936 5.195 0.377 1.00 . A A . 10 ILE HG12 1 1
29 5712 1 1 10 ILE HG13 H -2.764 5.687 1.587 1.00 . A A . 10 ILE HG13 1 1
29 5713 1 1 10 ILE HG21 H -3.847 3.433 2.714 1.00 . A A . 10 ILE HG21 1 1
29 5714 1 1 10 ILE HG22 H -4.655 3.033 1.185 1.00 . A A . 10 ILE HG22 1 1
29 5715 1 1 10 ILE HG23 H -3.525 1.879 1.908 1.00 . A A . 10 ILE HG23 1 1
29 5716 1 1 10 ILE N N -0.775 1.911 1.555 1.00 . A A . 10 ILE N 1 1
29 5717 1 1 10 ILE O O -1.651 4.059 3.773 1.00 . A A . 10 ILE O 1 1
29 5718 1 1 11 GLU C C 1.711 6.236 4.204 1.00 . A A . 11 GLU C 1 1
29 5719 1 1 11 GLU CA C 0.959 4.891 4.454 1.00 . A A . 11 GLU CA 1 1
29 5720 1 1 11 GLU CB C 1.842 3.881 5.236 1.00 . A A . 11 GLU CB 1 1
29 5721 1 1 11 GLU CD C 1.857 1.898 6.898 1.00 . A A . 11 GLU CD 1 1
29 5722 1 1 11 GLU CG C 1.070 2.687 5.844 1.00 . A A . 11 GLU CG 1 1
29 5723 1 1 11 GLU H H 1.179 4.099 2.412 1.00 . A A . 11 GLU H 1 1
29 5724 1 1 11 GLU HA H 0.106 5.044 5.146 1.00 . A A . 11 GLU HA 1 1
29 5725 1 1 11 GLU HB2 H 2.677 3.518 4.605 1.00 . A A . 11 GLU HB2 1 1
29 5726 1 1 11 GLU HB3 H 2.329 4.427 6.067 1.00 . A A . 11 GLU HB3 1 1
29 5727 1 1 11 GLU HG2 H 0.144 3.062 6.324 1.00 . A A . 11 GLU HG2 1 1
29 5728 1 1 11 GLU HG3 H 0.711 2.016 5.045 1.00 . A A . 11 GLU HG3 1 1
29 5729 1 1 11 GLU N N 0.509 4.321 3.156 1.00 . A A . 11 GLU N 1 1
29 5730 1 1 11 GLU O O 2.934 6.216 4.018 1.00 . A A . 11 GLU O 1 1
29 5731 1 1 11 GLU OE1 O 1.528 1.979 8.086 1.00 . A A . 11 GLU OE1 1 1
29 5732 1 1 12 THR C C 2.739 9.047 5.141 1.00 . A A . 12 THR C 1 1
29 5733 1 1 12 THR CA C 1.692 8.738 4.016 1.00 . A A . 12 THR CA 1 1
29 5734 1 1 12 THR CB C 0.676 9.904 3.792 1.00 . A A . 12 THR CB 1 1
29 5735 1 1 12 THR CG2 C 1.308 11.274 3.439 1.00 . A A . 12 THR CG2 1 1
29 5736 1 1 12 THR H H 0.002 7.320 4.075 1.00 . A A . 12 THR H 1 1
29 5737 1 1 12 THR HA H 2.263 8.665 3.073 1.00 . A A . 12 THR HA 1 1
29 5738 1 1 12 THR HB H 0.069 10.035 4.708 1.00 . A A . 12 THR HB 1 1
29 5739 1 1 12 THR HG1 H -0.769 10.344 2.597 1.00 . A A . 12 THR HG1 1 1
29 5740 1 1 12 THR HG21 H 1.962 11.659 4.246 1.00 . A A . 12 THR HG21 1 1
29 5741 1 1 12 THR HG22 H 1.927 11.231 2.522 1.00 . A A . 12 THR HG22 1 1
29 5742 1 1 12 THR HG23 H 0.542 12.055 3.269 1.00 . A A . 12 THR HG23 1 1
29 5743 1 1 12 THR N N 1.018 7.405 4.207 1.00 . A A . 12 THR N 1 1
29 5744 1 1 12 THR O O 3.887 9.363 4.816 1.00 . A A . 12 THR O 1 1
29 5745 1 1 12 THR OG1 O -0.205 9.577 2.721 1.00 . A A . 12 THR OG1 1 1
29 5746 1 1 13 THR C C 3.017 8.014 8.567 1.00 . A A . 13 THR C 1 1
29 5747 1 1 13 THR CA C 3.253 9.201 7.583 1.00 . A A . 13 THR CA 1 1
29 5748 1 1 13 THR CB C 3.022 10.613 8.201 1.00 . A A . 13 THR CB 1 1
29 5749 1 1 13 THR CG2 C 3.980 10.946 9.357 1.00 . A A . 13 THR CG2 1 1
29 5750 1 1 13 THR H H 1.362 8.706 6.564 1.00 . A A . 13 THR H 1 1
29 5751 1 1 13 THR HA H 4.307 9.173 7.246 1.00 . A A . 13 THR HA 1 1
29 5752 1 1 13 THR HB H 1.982 10.686 8.576 1.00 . A A . 13 THR HB 1 1
29 5753 1 1 13 THR HG1 H 4.131 11.576 6.954 1.00 . A A . 13 THR HG1 1 1
29 5754 1 1 13 THR HG21 H 5.038 10.903 9.039 1.00 . A A . 13 THR HG21 1 1
29 5755 1 1 13 THR HG22 H 3.795 11.963 9.749 1.00 . A A . 13 THR HG22 1 1
29 5756 1 1 13 THR HG23 H 3.859 10.247 10.204 1.00 . A A . 13 THR HG23 1 1
29 5757 1 1 13 THR N N 2.346 8.964 6.430 1.00 . A A . 13 THR N 1 1
29 5758 1 1 13 THR O O 2.067 8.025 9.357 1.00 . A A . 13 THR O 1 1
29 5759 1 1 13 THR OG1 O 3.207 11.623 7.213 1.00 . A A . 13 THR OG1 1 1
29 5760 1 1 14 ALA C C 4.484 6.031 10.738 1.00 . A A . 14 ALA C 1 1
29 5761 1 1 14 ALA CA C 3.811 5.789 9.367 1.00 . A A . 14 ALA CA 1 1
29 5762 1 1 14 ALA CB C 4.467 4.608 8.626 1.00 . A A . 14 ALA CB 1 1
29 5763 1 1 14 ALA H H 4.600 7.076 7.764 1.00 . A A . 14 ALA H 1 1
29 5764 1 1 14 ALA HXT H 4.021 6.109 12.616 1.00 . A A . 14 ALA HXT 1 1
29 5765 1 1 14 ALA HA H 2.748 5.519 9.526 1.00 . A A . 14 ALA HA 1 1
29 5766 1 1 14 ALA HB1 H 3.984 4.409 7.653 1.00 . A A . 14 ALA HB1 1 1
29 5767 1 1 14 ALA HB2 H 5.542 4.777 8.424 1.00 . A A . 14 ALA HB2 1 1
29 5768 1 1 14 ALA HB3 H 4.392 3.670 9.208 1.00 . A A . 14 ALA HB3 1 1
29 5769 1 1 14 ALA N N 3.895 6.993 8.506 1.00 . A A . 14 ALA N 1 1
29 5770 1 1 14 ALA O O 5.683 6.275 10.886 1.00 . A A . 14 ALA O 1 1
29 5771 1 1 14 ALA OXT O 3.590 5.950 11.773 1.00 . A A . 14 ALA OXT 1 1
30 5772 1 1 1 ACE C C 7.366 10.763 5.193 1.00 . A A . 1 ACE C 1 1
30 5773 1 1 1 ACE CH3 C 6.471 11.925 4.778 1.00 . A A . 1 ACE CH3 1 1
30 5774 1 1 1 ACE H1 H 7.042 12.689 4.220 1.00 . A A . 1 ACE H1 1 1
30 5775 1 1 1 ACE H2 H 5.647 11.586 4.123 1.00 . A A . 1 ACE H2 1 1
30 5776 1 1 1 ACE H3 H 6.023 12.425 5.656 1.00 . A A . 1 ACE H3 1 1
30 5777 1 1 1 ACE O O 8.564 10.754 4.899 1.00 . A A . 1 ACE O 1 1
30 5778 1 1 2 ILE C C 6.723 7.375 5.686 1.00 . A A . 2 ILE C 1 1
30 5779 1 1 2 ILE CA C 7.446 8.572 6.381 1.00 . A A . 2 ILE CA 1 1
30 5780 1 1 2 ILE CB C 7.465 8.494 7.954 1.00 . A A . 2 ILE CB 1 1
30 5781 1 1 2 ILE CD1 C 9.634 9.953 8.376 1.00 . A A . 2 ILE CD1 1 1
30 5782 1 1 2 ILE CG1 C 8.144 9.701 8.672 1.00 . A A . 2 ILE CG1 1 1
30 5783 1 1 2 ILE CG2 C 8.061 7.166 8.493 1.00 . A A . 2 ILE CG2 1 1
30 5784 1 1 2 ILE H H 5.734 9.908 5.944 1.00 . A A . 2 ILE H 1 1
30 5785 1 1 2 ILE HA H 8.516 8.571 6.079 1.00 . A A . 2 ILE HA 1 1
30 5786 1 1 2 ILE HB H 6.411 8.504 8.292 1.00 . A A . 2 ILE HB 1 1
30 5787 1 1 2 ILE HD11 H 10.007 10.828 8.939 1.00 . A A . 2 ILE HD11 1 1
30 5788 1 1 2 ILE HD12 H 10.266 9.092 8.660 1.00 . A A . 2 ILE HD12 1 1
30 5789 1 1 2 ILE HD13 H 9.813 10.161 7.305 1.00 . A A . 2 ILE HD13 1 1
30 5790 1 1 2 ILE HG12 H 7.586 10.624 8.431 1.00 . A A . 2 ILE HG12 1 1
30 5791 1 1 2 ILE HG13 H 8.021 9.588 9.766 1.00 . A A . 2 ILE HG13 1 1
30 5792 1 1 2 ILE HG21 H 9.107 7.015 8.165 1.00 . A A . 2 ILE HG21 1 1
30 5793 1 1 2 ILE HG22 H 8.054 7.130 9.598 1.00 . A A . 2 ILE HG22 1 1
30 5794 1 1 2 ILE HG23 H 7.486 6.286 8.154 1.00 . A A . 2 ILE HG23 1 1
30 5795 1 1 2 ILE N N 6.754 9.797 5.888 1.00 . A A . 2 ILE N 1 1
30 5796 1 1 2 ILE O O 5.644 6.955 6.116 1.00 . A A . 2 ILE O 1 1
30 5797 1 1 3 TRP C C 7.570 4.424 4.307 1.00 . A A . 3 TRP C 1 1
30 5798 1 1 3 TRP CA C 6.769 5.676 3.861 1.00 . A A . 3 TRP CA 1 1
30 5799 1 1 3 TRP CB C 6.821 5.907 2.324 1.00 . A A . 3 TRP CB 1 1
30 5800 1 1 3 TRP CD1 C 5.173 7.862 1.764 1.00 . A A . 3 TRP CD1 1 1
30 5801 1 1 3 TRP CD2 C 4.492 5.852 1.111 1.00 . A A . 3 TRP CD2 1 1
30 5802 1 1 3 TRP CE2 C 3.525 6.822 0.745 1.00 . A A . 3 TRP CE2 1 1
30 5803 1 1 3 TRP CE3 C 4.265 4.476 0.847 1.00 . A A . 3 TRP CE3 1 1
30 5804 1 1 3 TRP CG C 5.538 6.506 1.738 1.00 . A A . 3 TRP CG 1 1
30 5805 1 1 3 TRP CH2 C 2.127 5.066 -0.159 1.00 . A A . 3 TRP CH2 1 1
30 5806 1 1 3 TRP CZ2 C 2.326 6.423 0.108 1.00 . A A . 3 TRP CZ2 1 1
30 5807 1 1 3 TRP CZ3 C 3.082 4.110 0.209 1.00 . A A . 3 TRP CZ3 1 1
30 5808 1 1 3 TRP H H 8.242 7.238 4.393 1.00 . A A . 3 TRP H 1 1
30 5809 1 1 3 TRP HA H 5.700 5.516 4.124 1.00 . A A . 3 TRP HA 1 1
30 5810 1 1 3 TRP HB2 H 7.694 6.526 2.039 1.00 . A A . 3 TRP HB2 1 1
30 5811 1 1 3 TRP HB3 H 7.004 4.948 1.802 1.00 . A A . 3 TRP HB3 1 1
30 5812 1 1 3 TRP HD1 H 5.745 8.620 2.270 1.00 . A A . 3 TRP HD1 1 1
30 5813 1 1 3 TRP HE1 H 3.433 8.974 1.023 1.00 . A A . 3 TRP HE1 1 1
30 5814 1 1 3 TRP HE3 H 4.988 3.726 1.133 1.00 . A A . 3 TRP HE3 1 1
30 5815 1 1 3 TRP HH2 H 1.225 4.749 -0.659 1.00 . A A . 3 TRP HH2 1 1
30 5816 1 1 3 TRP HZ2 H 1.577 7.152 -0.171 1.00 . A A . 3 TRP HZ2 1 1
30 5817 1 1 3 TRP HZ3 H 2.903 3.067 -0.008 1.00 . A A . 3 TRP HZ3 1 1
30 5818 1 1 3 TRP N N 7.324 6.840 4.609 1.00 . A A . 3 TRP N 1 1
30 5819 1 1 3 TRP NE1 N 3.941 8.088 1.123 1.00 . A A . 3 TRP NE1 1 1
30 5820 1 1 3 TRP O O 8.620 4.094 3.746 1.00 . A A . 3 TRP O 1 1
30 5821 1 1 4 GLY C C 6.759 1.666 6.752 1.00 . A A . 4 GLY C 1 1
30 5822 1 1 4 GLY CA C 7.686 2.538 5.892 1.00 . A A . 4 GLY CA 1 1
30 5823 1 1 4 GLY H H 6.278 4.241 5.793 1.00 . A A . 4 GLY H 1 1
30 5824 1 1 4 GLY HA2 H 8.127 1.927 5.081 1.00 . A A . 4 GLY HA2 1 1
30 5825 1 1 4 GLY HA3 H 8.537 2.866 6.516 1.00 . A A . 4 GLY HA3 1 1
30 5826 1 1 4 GLY N N 7.044 3.743 5.336 1.00 . A A . 4 GLY N 1 1
30 5827 1 1 4 GLY O O 6.744 1.807 7.978 1.00 . A A . 4 GLY O 1 1
30 5828 1 1 5 . C C 3.808 0.474 7.408 1.00 . A A . 5 SET C 1 1
30 5829 1 1 5 . CA C 5.078 -0.180 6.794 1.00 . A A . 5 SET CA 1 1
30 5830 1 1 5 . CB C 4.748 -1.367 5.840 1.00 . A A . 5 SET CB 1 1
30 5831 1 1 5 . H H 6.072 0.792 5.081 1.00 . A A . 5 SET H 1 1
30 5832 1 1 5 . HA H 5.638 -0.575 7.667 1.00 . A A . 5 SET HA 1 1
30 5833 1 1 5 . HB2 H 3.231 -0.304 7.945 1.00 . A A . 5 SET HB2 1 1
30 5834 1 1 5 . HB3 H 4.131 1.181 8.196 1.00 . A A . 5 SET HB3 1 1
30 5835 1 1 5 . HNT2 H 3.077 1.212 5.458 1.00 . A A . 5 SET HNT2 1 1
30 5836 1 1 5 . N N 6.005 0.760 6.103 1.00 . A A . 5 SET N 1 1
30 5837 1 1 5 . NT N 2.904 1.180 6.469 1.00 . A A . 5 SET NT 1 1
30 5838 1 1 5 . OG O 4.230 -1.167 4.736 1.00 . A A . 5 SET OG 1 1
30 5839 1 1 6 SER C C 3.290 -4.285 5.607 1.00 . A A . 6 SER C 1 1
30 5840 1 1 6 SER CA C 4.779 -3.841 5.492 1.00 . A A . 6 SER CA 1 1
30 5841 1 1 6 SER CB C 5.747 -4.940 5.983 1.00 . A A . 6 SER CB 1 1
30 5842 1 1 6 SER H H 5.400 -2.655 7.240 1.00 . A A . 6 SER H 1 1
30 5843 1 1 6 SER HA H 5.038 -3.636 4.433 1.00 . A A . 6 SER HA 1 1
30 5844 1 1 6 SER HB2 H 6.793 -4.578 5.967 1.00 . A A . 6 SER HB2 1 1
30 5845 1 1 6 SER HB3 H 5.535 -5.223 7.032 1.00 . A A . 6 SER HB3 1 1
30 5846 1 1 6 SER HG H 6.280 -6.737 5.515 1.00 . A A . 6 SER HG 1 1
30 5847 1 1 6 SER N N 5.037 -2.608 6.284 1.00 . A A . 6 SER N 1 1
30 5848 1 1 6 SER O O 2.715 -4.291 6.702 1.00 . A A . 6 SER O 1 1
30 5849 1 1 6 SER OG O 5.660 -6.096 5.155 1.00 . A A . 6 SER OG 1 1
30 5850 1 1 7 GLY C C 0.287 -3.976 3.958 1.00 . A A . 7 GLY C 1 1
30 5851 1 1 7 GLY CA C 1.255 -5.084 4.430 1.00 . A A . 7 GLY CA 1 1
30 5852 1 1 7 GLY H H 3.263 -4.629 3.625 1.00 . A A . 7 GLY H 1 1
30 5853 1 1 7 GLY HA2 H 1.172 -5.945 3.742 1.00 . A A . 7 GLY HA2 1 1
30 5854 1 1 7 GLY HA3 H 0.913 -5.480 5.407 1.00 . A A . 7 GLY HA3 1 1
30 5855 1 1 7 GLY N N 2.679 -4.659 4.468 1.00 . A A . 7 GLY N 1 1
30 5856 1 1 7 GLY O O -0.434 -4.168 2.975 1.00 . A A . 7 GLY O 1 1
30 5857 1 1 8 LYS C C 0.149 -0.801 3.289 1.00 . A A . 8 LYS C 1 1
30 5858 1 1 8 LYS CA C -0.594 -1.674 4.345 1.00 . A A . 8 LYS CA 1 1
30 5859 1 1 8 LYS CB C -0.915 -0.924 5.666 1.00 . A A . 8 LYS CB 1 1
30 5860 1 1 8 LYS CD C -2.200 1.007 6.830 1.00 . A A . 8 LYS CD 1 1
30 5861 1 1 8 LYS CE C -3.061 0.248 7.859 1.00 . A A . 8 LYS CE 1 1
30 5862 1 1 8 LYS CG C -1.931 0.234 5.522 1.00 . A A . 8 LYS CG 1 1
30 5863 1 1 8 LYS H H 1.023 -2.745 5.349 1.00 . A A . 8 LYS H 1 1
30 5864 1 1 8 LYS HA H -1.562 -2.045 3.946 1.00 . A A . 8 LYS HA 1 1
30 5865 1 1 8 LYS HB2 H -1.312 -1.645 6.405 1.00 . A A . 8 LYS HB2 1 1
30 5866 1 1 8 LYS HB3 H 0.021 -0.535 6.115 1.00 . A A . 8 LYS HB3 1 1
30 5867 1 1 8 LYS HD2 H -1.234 1.301 7.284 1.00 . A A . 8 LYS HD2 1 1
30 5868 1 1 8 LYS HD3 H -2.699 1.958 6.564 1.00 . A A . 8 LYS HD3 1 1
30 5869 1 1 8 LYS HE2 H -4.034 -0.037 7.411 1.00 . A A . 8 LYS HE2 1 1
30 5870 1 1 8 LYS HE3 H -2.571 -0.699 8.154 1.00 . A A . 8 LYS HE3 1 1
30 5871 1 1 8 LYS HG2 H -1.550 0.956 4.774 1.00 . A A . 8 LYS HG2 1 1
30 5872 1 1 8 LYS HG3 H -2.883 -0.139 5.096 1.00 . A A . 8 LYS HG3 1 1
30 5873 1 1 8 LYS HZ1 H -3.863 0.589 9.763 1.00 . A A . 8 LYS HZ1 1 1
30 5874 1 1 8 LYS HZ2 H -2.411 1.335 9.520 1.00 . A A . 8 LYS HZ2 1 1
30 5875 1 1 8 LYS HZ3 H -3.778 1.951 8.836 1.00 . A A . 8 LYS HZ3 1 1
30 5876 1 1 8 LYS N N 0.263 -2.835 4.675 1.00 . A A . 8 LYS N 1 1
30 5877 1 1 8 LYS NZ N -3.293 1.074 9.061 1.00 . A A . 8 LYS NZ 1 1
30 5878 1 1 8 LYS O O 1.033 0.000 3.608 1.00 . A A . 8 LYS O 1 1
30 5879 1 1 9 LEU C C 0.064 1.278 0.703 1.00 . A A . 9 LEU C 1 1
30 5880 1 1 9 LEU CA C 0.342 -0.262 0.856 1.00 . A A . 9 LEU CA 1 1
30 5881 1 1 9 LEU CB C 0.066 -1.061 -0.459 1.00 . A A . 9 LEU CB 1 1
30 5882 1 1 9 LEU CD1 C -1.263 -1.531 -2.587 1.00 . A A . 9 LEU CD1 1 1
30 5883 1 1 9 LEU CD2 C -2.465 -1.658 -0.381 1.00 . A A . 9 LEU CD2 1 1
30 5884 1 1 9 LEU CG C -1.327 -0.963 -1.154 1.00 . A A . 9 LEU CG 1 1
30 5885 1 1 9 LEU H H -0.774 -1.865 1.938 1.00 . A A . 9 LEU H 1 1
30 5886 1 1 9 LEU HA H 1.441 -0.321 0.987 1.00 . A A . 9 LEU HA 1 1
30 5887 1 1 9 LEU HB2 H 0.826 -0.714 -1.187 1.00 . A A . 9 LEU HB2 1 1
30 5888 1 1 9 LEU HB3 H 0.328 -2.127 -0.309 1.00 . A A . 9 LEU HB3 1 1
30 5889 1 1 9 LEU HD11 H -0.507 -1.007 -3.202 1.00 . A A . 9 LEU HD11 1 1
30 5890 1 1 9 LEU HD12 H -1.008 -2.607 -2.602 1.00 . A A . 9 LEU HD12 1 1
30 5891 1 1 9 LEU HD13 H -2.228 -1.418 -3.118 1.00 . A A . 9 LEU HD13 1 1
30 5892 1 1 9 LEU HD21 H -3.427 -1.589 -0.924 1.00 . A A . 9 LEU HD21 1 1
30 5893 1 1 9 LEU HD22 H -2.260 -2.732 -0.214 1.00 . A A . 9 LEU HD22 1 1
30 5894 1 1 9 LEU HD23 H -2.633 -1.192 0.606 1.00 . A A . 9 LEU HD23 1 1
30 5895 1 1 9 LEU HG H -1.593 0.104 -1.250 1.00 . A A . 9 LEU HG 1 1
30 5896 1 1 9 LEU N N -0.243 -0.993 2.023 1.00 . A A . 9 LEU N 1 1
30 5897 1 1 9 LEU O O 0.617 1.886 -0.218 1.00 . A A . 9 LEU O 1 1
30 5898 1 1 10 ILE C C -0.770 3.945 2.931 1.00 . A A . 10 ILE C 1 1
30 5899 1 1 10 ILE CA C -1.083 3.358 1.518 1.00 . A A . 10 ILE CA 1 1
30 5900 1 1 10 ILE CB C -2.530 3.586 0.939 1.00 . A A . 10 ILE CB 1 1
30 5901 1 1 10 ILE CD1 C -2.070 5.738 -0.458 1.00 . A A . 10 ILE CD1 1 1
30 5902 1 1 10 ILE CG1 C -2.876 5.078 0.671 1.00 . A A . 10 ILE CG1 1 1
30 5903 1 1 10 ILE CG2 C -3.688 2.931 1.740 1.00 . A A . 10 ILE CG2 1 1
30 5904 1 1 10 ILE H H -1.161 1.310 2.296 1.00 . A A . 10 ILE H 1 1
30 5905 1 1 10 ILE HA H -0.395 3.855 0.808 1.00 . A A . 10 ILE HA 1 1
30 5906 1 1 10 ILE HB H -2.551 3.086 -0.051 1.00 . A A . 10 ILE HB 1 1
30 5907 1 1 10 ILE HD11 H -2.156 5.171 -1.405 1.00 . A A . 10 ILE HD11 1 1
30 5908 1 1 10 ILE HD12 H -2.433 6.763 -0.657 1.00 . A A . 10 ILE HD12 1 1
30 5909 1 1 10 ILE HD13 H -0.997 5.816 -0.210 1.00 . A A . 10 ILE HD13 1 1
30 5910 1 1 10 ILE HG12 H -3.946 5.171 0.397 1.00 . A A . 10 ILE HG12 1 1
30 5911 1 1 10 ILE HG13 H -2.768 5.671 1.599 1.00 . A A . 10 ILE HG13 1 1
30 5912 1 1 10 ILE HG21 H -3.845 3.407 2.725 1.00 . A A . 10 ILE HG21 1 1
30 5913 1 1 10 ILE HG22 H -4.648 3.000 1.195 1.00 . A A . 10 ILE HG22 1 1
30 5914 1 1 10 ILE HG23 H -3.511 1.856 1.920 1.00 . A A . 10 ILE HG23 1 1
30 5915 1 1 10 ILE N N -0.763 1.905 1.566 1.00 . A A . 10 ILE N 1 1
30 5916 1 1 10 ILE O O -1.652 4.031 3.791 1.00 . A A . 10 ILE O 1 1
30 5917 1 1 11 GLU C C 1.703 6.242 4.217 1.00 . A A . 11 GLU C 1 1
30 5918 1 1 11 GLU CA C 0.946 4.900 4.469 1.00 . A A . 11 GLU CA 1 1
30 5919 1 1 11 GLU CB C 1.832 3.893 5.253 1.00 . A A . 11 GLU CB 1 1
30 5920 1 1 11 GLU CD C 1.862 1.901 6.904 1.00 . A A . 11 GLU CD 1 1
30 5921 1 1 11 GLU CG C 1.067 2.692 5.857 1.00 . A A . 11 GLU CG 1 1
30 5922 1 1 11 GLU H H 1.173 4.127 2.422 1.00 . A A . 11 GLU H 1 1
30 5923 1 1 11 GLU HA H 0.092 5.053 5.158 1.00 . A A . 11 GLU HA 1 1
30 5924 1 1 11 GLU HB2 H 2.672 3.536 4.624 1.00 . A A . 11 GLU HB2 1 1
30 5925 1 1 11 GLU HB3 H 2.314 4.440 6.087 1.00 . A A . 11 GLU HB3 1 1
30 5926 1 1 11 GLU HG2 H 0.140 3.059 6.339 1.00 . A A . 11 GLU HG2 1 1
30 5927 1 1 11 GLU HG3 H 0.711 2.023 5.053 1.00 . A A . 11 GLU HG3 1 1
30 5928 1 1 11 GLU N N 0.502 4.330 3.170 1.00 . A A . 11 GLU N 1 1
30 5929 1 1 11 GLU O O 2.921 6.216 4.009 1.00 . A A . 11 GLU O 1 1
30 5930 1 1 11 GLU OE1 O 1.528 1.962 8.091 1.00 . A A . 11 GLU OE1 1 1
30 5931 1 1 12 THR C C 2.766 9.037 5.156 1.00 . A A . 12 THR C 1 1
30 5932 1 1 12 THR CA C 1.698 8.746 4.045 1.00 . A A . 12 THR CA 1 1
30 5933 1 1 12 THR CB C 0.686 9.921 3.843 1.00 . A A . 12 THR CB 1 1
30 5934 1 1 12 THR CG2 C 1.326 11.288 3.493 1.00 . A A . 12 THR CG2 1 1
30 5935 1 1 12 THR H H -0.001 7.339 4.117 1.00 . A A . 12 THR H 1 1
30 5936 1 1 12 THR HA H 2.251 8.674 3.093 1.00 . A A . 12 THR HA 1 1
30 5937 1 1 12 THR HB H 0.093 10.049 4.770 1.00 . A A . 12 THR HB 1 1
30 5938 1 1 12 THR HG1 H -0.770 10.381 2.671 1.00 . A A . 12 THR HG1 1 1
30 5939 1 1 12 THR HG21 H 1.994 11.660 4.292 1.00 . A A . 12 THR HG21 1 1
30 5940 1 1 12 THR HG22 H 1.930 11.247 2.566 1.00 . A A . 12 THR HG22 1 1
30 5941 1 1 12 THR HG23 H 0.564 12.077 3.339 1.00 . A A . 12 THR HG23 1 1
30 5942 1 1 12 THR N N 1.018 7.416 4.239 1.00 . A A . 12 THR N 1 1
30 5943 1 1 12 THR O O 3.919 9.310 4.813 1.00 . A A . 12 THR O 1 1
30 5944 1 1 12 THR OG1 O -0.211 9.608 2.782 1.00 . A A . 12 THR OG1 1 1
30 5945 1 1 13 THR C C 3.056 8.035 8.589 1.00 . A A . 13 THR C 1 1
30 5946 1 1 13 THR CA C 3.308 9.206 7.590 1.00 . A A . 13 THR CA 1 1
30 5947 1 1 13 THR CB C 3.125 10.631 8.192 1.00 . A A . 13 THR CB 1 1
30 5948 1 1 13 THR CG2 C 4.082 10.946 9.354 1.00 . A A . 13 THR CG2 1 1
30 5949 1 1 13 THR H H 1.394 8.751 6.595 1.00 . A A . 13 THR H 1 1
30 5950 1 1 13 THR HA H 4.358 9.147 7.242 1.00 . A A . 13 THR HA 1 1
30 5951 1 1 13 THR HB H 2.085 10.748 8.555 1.00 . A A . 13 THR HB 1 1
30 5952 1 1 13 THR HG1 H 3.264 12.467 7.630 1.00 . A A . 13 THR HG1 1 1
30 5953 1 1 13 THR HG21 H 5.140 10.865 9.043 1.00 . A A . 13 THR HG21 1 1
30 5954 1 1 13 THR HG22 H 3.928 11.970 9.739 1.00 . A A . 13 THR HG22 1 1
30 5955 1 1 13 THR HG23 H 3.935 10.255 10.206 1.00 . A A . 13 THR HG23 1 1
30 5956 1 1 13 THR N N 2.382 8.981 6.449 1.00 . A A . 13 THR N 1 1
30 5957 1 1 13 THR O O 2.111 8.073 9.385 1.00 . A A . 13 THR O 1 1
30 5958 1 1 13 THR OG1 O 3.364 11.618 7.192 1.00 . A A . 13 THR OG1 1 1
30 5959 1 1 14 ALA C C 4.511 6.052 10.770 1.00 . A A . 14 ALA C 1 1
30 5960 1 1 14 ALA CA C 3.817 5.807 9.411 1.00 . A A . 14 ALA CA 1 1
30 5961 1 1 14 ALA CB C 4.443 4.606 8.674 1.00 . A A . 14 ALA CB 1 1
30 5962 1 1 14 ALA H H 4.619 7.064 7.790 1.00 . A A . 14 ALA H 1 1
30 5963 1 1 14 ALA HXT H 4.075 6.152 12.653 1.00 . A A . 14 ALA HXT 1 1
30 5964 1 1 14 ALA HA H 2.750 5.560 9.585 1.00 . A A . 14 ALA HA 1 1
30 5965 1 1 14 ALA HB1 H 3.943 4.404 7.711 1.00 . A A . 14 ALA HB1 1 1
30 5966 1 1 14 ALA HB2 H 5.518 4.756 8.456 1.00 . A A . 14 ALA HB2 1 1
30 5967 1 1 14 ALA HB3 H 4.361 3.677 9.269 1.00 . A A . 14 ALA HB3 1 1
30 5968 1 1 14 ALA N N 3.915 6.999 8.536 1.00 . A A . 14 ALA N 1 1
30 5969 1 1 14 ALA O O 5.715 6.281 10.901 1.00 . A A . 14 ALA O 1 1
30 5970 1 1 14 ALA OXT O 3.631 5.991 11.817 1.00 . A A . 14 ALA OXT 1 1
31 5971 1 1 1 ACE C C 7.419 10.733 5.154 1.00 . A A . 1 ACE C 1 1
31 5972 1 1 1 ACE CH3 C 6.538 11.900 4.715 1.00 . A A . 1 ACE CH3 1 1
31 5973 1 1 1 ACE H1 H 6.077 12.409 5.581 1.00 . A A . 1 ACE H1 1 1
31 5974 1 1 1 ACE H2 H 7.125 12.655 4.162 1.00 . A A . 1 ACE H2 1 1
31 5975 1 1 1 ACE H3 H 5.724 11.561 4.046 1.00 . A A . 1 ACE H3 1 1
31 5976 1 1 1 ACE O O 8.618 10.709 4.868 1.00 . A A . 1 ACE O 1 1
31 5977 1 1 2 ILE C C 6.740 7.359 5.689 1.00 . A A . 2 ILE C 1 1
31 5978 1 1 2 ILE CA C 7.467 8.559 6.373 1.00 . A A . 2 ILE CA 1 1
31 5979 1 1 2 ILE CB C 7.470 8.503 7.947 1.00 . A A . 2 ILE CB 1 1
31 5980 1 1 2 ILE CD1 C 9.653 9.946 8.367 1.00 . A A . 2 ILE CD1 1 1
31 5981 1 1 2 ILE CG1 C 8.158 9.713 8.654 1.00 . A A . 2 ILE CG1 1 1
31 5982 1 1 2 ILE CG2 C 8.048 7.178 8.512 1.00 . A A . 2 ILE CG2 1 1
31 5983 1 1 2 ILE H H 5.773 9.907 5.906 1.00 . A A . 2 ILE H 1 1
31 5984 1 1 2 ILE HA H 8.540 8.544 6.083 1.00 . A A . 2 ILE HA 1 1
31 5985 1 1 2 ILE HB H 6.415 8.530 8.277 1.00 . A A . 2 ILE HB 1 1
31 5986 1 1 2 ILE HD11 H 10.030 10.823 8.922 1.00 . A A . 2 ILE HD11 1 1
31 5987 1 1 2 ILE HD12 H 10.272 9.082 8.667 1.00 . A A . 2 ILE HD12 1 1
31 5988 1 1 2 ILE HD13 H 9.843 10.137 7.295 1.00 . A A . 2 ILE HD13 1 1
31 5989 1 1 2 ILE HG12 H 7.612 10.639 8.396 1.00 . A A . 2 ILE HG12 1 1
31 5990 1 1 2 ILE HG13 H 8.024 9.617 9.748 1.00 . A A . 2 ILE HG13 1 1
31 5991 1 1 2 ILE HG21 H 9.094 7.010 8.194 1.00 . A A . 2 ILE HG21 1 1
31 5992 1 1 2 ILE HG22 H 8.033 7.158 9.617 1.00 . A A . 2 ILE HG22 1 1
31 5993 1 1 2 ILE HG23 H 7.465 6.299 8.181 1.00 . A A . 2 ILE HG23 1 1
31 5994 1 1 2 ILE N N 6.791 9.785 5.857 1.00 . A A . 2 ILE N 1 1
31 5995 1 1 2 ILE O O 5.656 6.952 6.117 1.00 . A A . 2 ILE O 1 1
31 5996 1 1 3 TRP C C 7.577 4.387 4.357 1.00 . A A . 3 TRP C 1 1
31 5997 1 1 3 TRP CA C 6.786 5.636 3.887 1.00 . A A . 3 TRP CA 1 1
31 5998 1 1 3 TRP CB C 6.850 5.842 2.347 1.00 . A A . 3 TRP CB 1 1
31 5999 1 1 3 TRP CD1 C 5.243 7.817 1.742 1.00 . A A . 3 TRP CD1 1 1
31 6000 1 1 3 TRP CD2 C 4.526 5.808 1.122 1.00 . A A . 3 TRP CD2 1 1
31 6001 1 1 3 TRP CE2 C 3.580 6.790 0.733 1.00 . A A . 3 TRP CE2 1 1
31 6002 1 1 3 TRP CE3 C 4.273 4.433 0.884 1.00 . A A . 3 TRP CE3 1 1
31 6003 1 1 3 TRP CG C 5.581 6.453 1.743 1.00 . A A . 3 TRP CG 1 1
31 6004 1 1 3 TRP CH2 C 2.151 5.046 -0.142 1.00 . A A . 3 TRP CH2 1 1
31 6005 1 1 3 TRP CZ2 C 2.375 6.403 0.099 1.00 . A A . 3 TRP CZ2 1 1
31 6006 1 1 3 TRP CZ3 C 3.084 4.076 0.248 1.00 . A A . 3 TRP CZ3 1 1
31 6007 1 1 3 TRP H H 8.265 7.198 4.405 1.00 . A A . 3 TRP H 1 1
31 6008 1 1 3 TRP HA H 5.715 5.486 4.143 1.00 . A A . 3 TRP HA 1 1
31 6009 1 1 3 TRP HB2 H 7.735 6.441 2.057 1.00 . A A . 3 TRP HB2 1 1
31 6010 1 1 3 TRP HB3 H 7.019 4.872 1.841 1.00 . A A . 3 TRP HB3 1 1
31 6011 1 1 3 TRP HD1 H 5.827 8.570 2.238 1.00 . A A . 3 TRP HD1 1 1
31 6012 1 1 3 TRP HE1 H 3.530 8.948 0.971 1.00 . A A . 3 TRP HE1 1 1
31 6013 1 1 3 TRP HE3 H 4.979 3.674 1.187 1.00 . A A . 3 TRP HE3 1 1
31 6014 1 1 3 TRP HH2 H 1.245 4.738 -0.642 1.00 . A A . 3 TRP HH2 1 1
31 6015 1 1 3 TRP HZ2 H 1.643 7.141 -0.196 1.00 . A A . 3 TRP HZ2 1 1
31 6016 1 1 3 TRP HZ3 H 2.886 3.034 0.051 1.00 . A A . 3 TRP HZ3 1 1
31 6017 1 1 3 TRP N N 7.344 6.807 4.622 1.00 . A A . 3 TRP N 1 1
31 6018 1 1 3 TRP NE1 N 4.018 8.054 1.090 1.00 . A A . 3 TRP NE1 1 1
31 6019 1 1 3 TRP O O 8.632 4.044 3.808 1.00 . A A . 3 TRP O 1 1
31 6020 1 1 4 GLY C C 6.732 1.648 6.809 1.00 . A A . 4 GLY C 1 1
31 6021 1 1 4 GLY CA C 7.675 2.525 5.971 1.00 . A A . 4 GLY CA 1 1
31 6022 1 1 4 GLY H H 6.275 4.235 5.835 1.00 . A A . 4 GLY H 1 1
31 6023 1 1 4 GLY HA2 H 8.144 1.914 5.177 1.00 . A A . 4 GLY HA2 1 1
31 6024 1 1 4 GLY HA3 H 8.505 2.863 6.618 1.00 . A A . 4 GLY HA3 1 1
31 6025 1 1 4 GLY N N 7.042 3.724 5.391 1.00 . A A . 4 GLY N 1 1
31 6026 1 1 4 GLY O O 6.690 1.785 8.035 1.00 . A A . 4 GLY O 1 1
31 6027 1 1 5 . C C 3.774 0.440 7.404 1.00 . A A . 5 SET C 1 1
31 6028 1 1 5 . CA C 5.057 -0.203 6.809 1.00 . A A . 5 SET CA 1 1
31 6029 1 1 5 . CB C 4.756 -1.390 5.844 1.00 . A A . 5 SET CB 1 1
31 6030 1 1 5 . H H 6.081 0.781 5.121 1.00 . A A . 5 SET H 1 1
31 6031 1 1 5 . HA H 5.603 -0.599 7.690 1.00 . A A . 5 SET HA 1 1
31 6032 1 1 5 . HB2 H 3.190 -0.345 7.921 1.00 . A A . 5 SET HB2 1 1
31 6033 1 1 5 . HB3 H 4.082 1.138 8.207 1.00 . A A . 5 SET HB3 1 1
31 6034 1 1 5 . HNT2 H 3.065 1.188 5.449 1.00 . A A . 5 SET HNT2 1 1
31 6035 1 1 5 . N N 5.995 0.743 6.141 1.00 . A A . 5 SET N 1 1
31 6036 1 1 5 . NT N 2.885 1.155 6.459 1.00 . A A . 5 SET NT 1 1
31 6037 1 1 5 . OG O 4.258 -1.189 4.730 1.00 . A A . 5 SET OG 1 1
31 6038 1 1 6 SER C C 3.348 -4.344 5.612 1.00 . A A . 6 SER C 1 1
31 6039 1 1 6 SER CA C 4.823 -3.863 5.485 1.00 . A A . 6 SER CA 1 1
31 6040 1 1 6 SER CB C 5.806 -4.960 5.954 1.00 . A A . 6 SER CB 1 1
31 6041 1 1 6 SER H H 5.368 -2.678 7.259 1.00 . A A . 6 SER H 1 1
31 6042 1 1 6 SER HA H 5.066 -3.650 4.423 1.00 . A A . 6 SER HA 1 1
31 6043 1 1 6 SER HB2 H 5.707 -5.161 7.039 1.00 . A A . 6 SER HB2 1 1
31 6044 1 1 6 SER HB3 H 5.585 -5.922 5.453 1.00 . A A . 6 SER HB3 1 1
31 6045 1 1 6 SER HG H 7.309 -3.758 6.082 1.00 . A A . 6 SER HG 1 1
31 6046 1 1 6 SER N N 5.050 -2.628 6.287 1.00 . A A . 6 SER N 1 1
31 6047 1 1 6 SER O O 2.828 -4.477 6.726 1.00 . A A . 6 SER O 1 1
31 6048 1 1 6 SER OG O 7.154 -4.605 5.656 1.00 . A A . 6 SER OG 1 1
31 6049 1 1 7 GLY C C 0.291 -3.958 3.973 1.00 . A A . 7 GLY C 1 1
31 6050 1 1 7 GLY CA C 1.269 -5.053 4.451 1.00 . A A . 7 GLY CA 1 1
31 6051 1 1 7 GLY H H 3.203 -4.422 3.600 1.00 . A A . 7 GLY H 1 1
31 6052 1 1 7 GLY HA2 H 1.190 -5.923 3.773 1.00 . A A . 7 GLY HA2 1 1
31 6053 1 1 7 GLY HA3 H 0.934 -5.439 5.434 1.00 . A A . 7 GLY HA3 1 1
31 6054 1 1 7 GLY N N 2.688 -4.609 4.469 1.00 . A A . 7 GLY N 1 1
31 6055 1 1 7 GLY O O -0.434 -4.165 2.996 1.00 . A A . 7 GLY O 1 1
31 6056 1 1 8 LYS C C 0.134 -0.792 3.277 1.00 . A A . 8 LYS C 1 1
31 6057 1 1 8 LYS CA C -0.603 -1.660 4.341 1.00 . A A . 8 LYS CA 1 1
31 6058 1 1 8 LYS CB C -0.929 -0.900 5.654 1.00 . A A . 8 LYS CB 1 1
31 6059 1 1 8 LYS CD C -2.230 1.028 6.804 1.00 . A A . 8 LYS CD 1 1
31 6060 1 1 8 LYS CE C -3.089 0.268 7.834 1.00 . A A . 8 LYS CE 1 1
31 6061 1 1 8 LYS CG C -1.952 0.252 5.501 1.00 . A A . 8 LYS CG 1 1
31 6062 1 1 8 LYS H H 1.026 -2.706 5.347 1.00 . A A . 8 LYS H 1 1
31 6063 1 1 8 LYS HA H -1.569 -2.039 3.945 1.00 . A A . 8 LYS HA 1 1
31 6064 1 1 8 LYS HB2 H -1.322 -1.618 6.399 1.00 . A A . 8 LYS HB2 1 1
31 6065 1 1 8 LYS HB3 H 0.005 -0.503 6.101 1.00 . A A . 8 LYS HB3 1 1
31 6066 1 1 8 LYS HD2 H -1.268 1.333 7.259 1.00 . A A . 8 LYS HD2 1 1
31 6067 1 1 8 LYS HD3 H -2.736 1.975 6.531 1.00 . A A . 8 LYS HD3 1 1
31 6068 1 1 8 LYS HE2 H -4.055 -0.030 7.384 1.00 . A A . 8 LYS HE2 1 1
31 6069 1 1 8 LYS HE3 H -2.589 -0.671 8.138 1.00 . A A . 8 LYS HE3 1 1
31 6070 1 1 8 LYS HG2 H -1.572 0.971 4.751 1.00 . A A . 8 LYS HG2 1 1
31 6071 1 1 8 LYS HG3 H -2.900 -0.130 5.076 1.00 . A A . 8 LYS HG3 1 1
31 6072 1 1 8 LYS HZ1 H -3.901 0.613 9.733 1.00 . A A . 8 LYS HZ1 1 1
31 6073 1 1 8 LYS HZ2 H -2.458 1.374 9.492 1.00 . A A . 8 LYS HZ2 1 1
31 6074 1 1 8 LYS HZ3 H -3.827 1.970 8.797 1.00 . A A . 8 LYS HZ3 1 1
31 6075 1 1 8 LYS N N 0.263 -2.810 4.679 1.00 . A A . 8 LYS N 1 1
31 6076 1 1 8 LYS NZ N -3.333 1.101 9.030 1.00 . A A . 8 LYS NZ 1 1
31 6077 1 1 8 LYS O O 1.021 0.010 3.588 1.00 . A A . 8 LYS O 1 1
31 6078 1 1 9 LEU C C 0.041 1.277 0.687 1.00 . A A . 9 LEU C 1 1
31 6079 1 1 9 LEU CA C 0.313 -0.264 0.841 1.00 . A A . 9 LEU CA 1 1
31 6080 1 1 9 LEU CB C 0.023 -1.065 -0.469 1.00 . A A . 9 LEU CB 1 1
31 6081 1 1 9 LEU CD1 C -1.328 -1.536 -2.586 1.00 . A A . 9 LEU CD1 1 1
31 6082 1 1 9 LEU CD2 C -2.510 -1.652 -0.368 1.00 . A A . 9 LEU CD2 1 1
31 6083 1 1 9 LEU CG C -1.377 -0.964 -1.154 1.00 . A A . 9 LEU CG 1 1
31 6084 1 1 9 LEU H H -0.798 -1.860 1.936 1.00 . A A . 9 LEU H 1 1
31 6085 1 1 9 LEU HA H 1.413 -0.328 0.963 1.00 . A A . 9 LEU HA 1 1
31 6086 1 1 9 LEU HB2 H 0.776 -0.723 -1.206 1.00 . A A . 9 LEU HB2 1 1
31 6087 1 1 9 LEU HB3 H 0.281 -2.132 -0.320 1.00 . A A . 9 LEU HB3 1 1
31 6088 1 1 9 LEU HD11 H -0.575 -1.016 -3.209 1.00 . A A . 9 LEU HD11 1 1
31 6089 1 1 9 LEU HD12 H -1.076 -2.613 -2.600 1.00 . A A . 9 LEU HD12 1 1
31 6090 1 1 9 LEU HD13 H -2.297 -1.420 -3.108 1.00 . A A . 9 LEU HD13 1 1
31 6091 1 1 9 LEU HD21 H -3.476 -1.581 -0.903 1.00 . A A . 9 LEU HD21 1 1
31 6092 1 1 9 LEU HD22 H -2.307 -2.727 -0.201 1.00 . A A . 9 LEU HD22 1 1
31 6093 1 1 9 LEU HD23 H -2.668 -1.183 0.620 1.00 . A A . 9 LEU HD23 1 1
31 6094 1 1 9 LEU HG H -1.639 0.105 -1.249 1.00 . A A . 9 LEU HG 1 1
31 6095 1 1 9 LEU N N -0.266 -0.989 2.014 1.00 . A A . 9 LEU N 1 1
31 6096 1 1 9 LEU O O 0.591 1.880 -0.239 1.00 . A A . 9 LEU O 1 1
31 6097 1 1 10 ILE C C -0.768 3.953 2.916 1.00 . A A . 10 ILE C 1 1
31 6098 1 1 10 ILE CA C -1.090 3.363 1.506 1.00 . A A . 10 ILE CA 1 1
31 6099 1 1 10 ILE CB C -2.538 3.598 0.931 1.00 . A A . 10 ILE CB 1 1
31 6100 1 1 10 ILE CD1 C -2.065 5.751 -0.462 1.00 . A A . 10 ILE CD1 1 1
31 6101 1 1 10 ILE CG1 C -2.877 5.093 0.664 1.00 . A A . 10 ILE CG1 1 1
31 6102 1 1 10 ILE CG2 C -3.697 2.951 1.737 1.00 . A A . 10 ILE CG2 1 1
31 6103 1 1 10 ILE H H -1.171 1.317 2.288 1.00 . A A . 10 ILE H 1 1
31 6104 1 1 10 ILE HA H -0.403 3.855 0.792 1.00 . A A . 10 ILE HA 1 1
31 6105 1 1 10 ILE HB H -2.566 3.099 -0.058 1.00 . A A . 10 ILE HB 1 1
31 6106 1 1 10 ILE HD11 H -2.152 5.185 -1.409 1.00 . A A . 10 ILE HD11 1 1
31 6107 1 1 10 ILE HD12 H -2.423 6.777 -0.660 1.00 . A A . 10 ILE HD12 1 1
31 6108 1 1 10 ILE HD13 H -0.992 5.824 -0.212 1.00 . A A . 10 ILE HD13 1 1
31 6109 1 1 10 ILE HG12 H -3.945 5.191 0.389 1.00 . A A . 10 ILE HG12 1 1
31 6110 1 1 10 ILE HG13 H -2.768 5.684 1.593 1.00 . A A . 10 ILE HG13 1 1
31 6111 1 1 10 ILE HG21 H -3.845 3.427 2.724 1.00 . A A . 10 ILE HG21 1 1
31 6112 1 1 10 ILE HG22 H -4.659 3.027 1.198 1.00 . A A . 10 ILE HG22 1 1
31 6113 1 1 10 ILE HG23 H -3.525 1.874 1.916 1.00 . A A . 10 ILE HG23 1 1
31 6114 1 1 10 ILE N N -0.777 1.909 1.553 1.00 . A A . 10 ILE N 1 1
31 6115 1 1 10 ILE O O -1.647 4.056 3.777 1.00 . A A . 10 ILE O 1 1
31 6116 1 1 11 GLU C C 1.730 6.227 4.186 1.00 . A A . 11 GLU C 1 1
31 6117 1 1 11 GLU CA C 0.965 4.891 4.447 1.00 . A A . 11 GLU CA 1 1
31 6118 1 1 11 GLU CB C 1.843 3.877 5.229 1.00 . A A . 11 GLU CB 1 1
31 6119 1 1 11 GLU CD C 1.848 1.888 6.887 1.00 . A A . 11 GLU CD 1 1
31 6120 1 1 11 GLU CG C 1.065 2.685 5.836 1.00 . A A . 11 GLU CG 1 1
31 6121 1 1 11 GLU H H 1.177 4.101 2.403 1.00 . A A . 11 GLU H 1 1
31 6122 1 1 11 GLU HA H 0.114 5.055 5.138 1.00 . A A . 11 GLU HA 1 1
31 6123 1 1 11 GLU HB2 H 2.676 3.510 4.598 1.00 . A A . 11 GLU HB2 1 1
31 6124 1 1 11 GLU HB3 H 2.333 4.421 6.061 1.00 . A A . 11 GLU HB3 1 1
31 6125 1 1 11 GLU HG2 H 0.142 3.064 6.316 1.00 . A A . 11 GLU HG2 1 1
31 6126 1 1 11 GLU HG3 H 0.703 2.018 5.035 1.00 . A A . 11 GLU HG3 1 1
31 6127 1 1 11 GLU N N 0.510 4.321 3.150 1.00 . A A . 11 GLU N 1 1
31 6128 1 1 11 GLU O O 2.951 6.194 3.992 1.00 . A A . 11 GLU O 1 1
31 6129 1 1 11 GLU OE1 O 1.509 1.952 8.072 1.00 . A A . 11 GLU OE1 1 1
31 6130 1 1 12 THR C C 2.796 9.034 5.097 1.00 . A A . 12 THR C 1 1
31 6131 1 1 12 THR CA C 1.738 8.727 3.981 1.00 . A A . 12 THR CA 1 1
31 6132 1 1 12 THR CB C 0.734 9.904 3.749 1.00 . A A . 12 THR CB 1 1
31 6133 1 1 12 THR CG2 C 1.382 11.259 3.372 1.00 . A A . 12 THR CG2 1 1
31 6134 1 1 12 THR H H 0.031 7.332 4.068 1.00 . A A . 12 THR H 1 1
31 6135 1 1 12 THR HA H 2.302 8.638 3.036 1.00 . A A . 12 THR HA 1 1
31 6136 1 1 12 THR HB H 0.136 10.055 4.668 1.00 . A A . 12 THR HB 1 1
31 6137 1 1 12 THR HG1 H -0.713 10.346 2.557 1.00 . A A . 12 THR HG1 1 1
31 6138 1 1 12 THR HG21 H 2.050 11.647 4.164 1.00 . A A . 12 THR HG21 1 1
31 6139 1 1 12 THR HG22 H 1.989 11.196 2.448 1.00 . A A . 12 THR HG22 1 1
31 6140 1 1 12 THR HG23 H 0.625 12.049 3.198 1.00 . A A . 12 THR HG23 1 1
31 6141 1 1 12 THR N N 1.050 7.405 4.187 1.00 . A A . 12 THR N 1 1
31 6142 1 1 12 THR O O 3.945 9.328 4.762 1.00 . A A . 12 THR O 1 1
31 6143 1 1 12 THR OG1 O -0.159 9.573 2.690 1.00 . A A . 12 THR OG1 1 1
31 6144 1 1 13 THR C C 3.054 8.066 8.552 1.00 . A A . 13 THR C 1 1
31 6145 1 1 13 THR CA C 3.325 9.215 7.534 1.00 . A A . 13 THR CA 1 1
31 6146 1 1 13 THR CB C 3.149 10.653 8.107 1.00 . A A . 13 THR CB 1 1
31 6147 1 1 13 THR CG2 C 4.096 10.980 9.274 1.00 . A A . 13 THR CG2 1 1
31 6148 1 1 13 THR H H 1.424 8.722 6.534 1.00 . A A . 13 THR H 1 1
31 6149 1 1 13 THR HA H 4.377 9.141 7.195 1.00 . A A . 13 THR HA 1 1
31 6150 1 1 13 THR HB H 2.107 10.788 8.456 1.00 . A A . 13 THR HB 1 1
31 6151 1 1 13 THR HG1 H 2.867 11.360 6.340 1.00 . A A . 13 THR HG1 1 1
31 6152 1 1 13 THR HG21 H 5.156 10.879 8.978 1.00 . A A . 13 THR HG21 1 1
31 6153 1 1 13 THR HG22 H 3.950 12.017 9.628 1.00 . A A . 13 THR HG22 1 1
31 6154 1 1 13 THR HG23 H 3.926 10.314 10.139 1.00 . A A . 13 THR HG23 1 1
31 6155 1 1 13 THR N N 2.407 8.978 6.389 1.00 . A A . 13 THR N 1 1
31 6156 1 1 13 THR O O 2.100 8.124 9.335 1.00 . A A . 13 THR O 1 1
31 6157 1 1 13 THR OG1 O 3.411 11.615 7.089 1.00 . A A . 13 THR OG1 1 1
31 6158 1 1 14 ALA C C 4.485 6.110 10.777 1.00 . A A . 14 ALA C 1 1
31 6159 1 1 14 ALA CA C 3.792 5.847 9.421 1.00 . A A . 14 ALA CA 1 1
31 6160 1 1 14 ALA CB C 4.405 4.627 8.708 1.00 . A A . 14 ALA CB 1 1
31 6161 1 1 14 ALA H H 4.622 7.071 7.790 1.00 . A A . 14 ALA H 1 1
31 6162 1 1 14 ALA HXT H 4.041 6.274 12.655 1.00 . A A . 14 ALA HXT 1 1
31 6163 1 1 14 ALA HA H 2.722 5.616 9.597 1.00 . A A . 14 ALA HA 1 1
31 6164 1 1 14 ALA HB1 H 4.312 3.710 9.320 1.00 . A A . 14 ALA HB1 1 1
31 6165 1 1 14 ALA HB2 H 3.902 4.413 7.747 1.00 . A A . 14 ALA HB2 1 1
31 6166 1 1 14 ALA HB3 H 5.481 4.760 8.487 1.00 . A A . 14 ALA HB3 1 1
31 6167 1 1 14 ALA N N 3.907 7.023 8.526 1.00 . A A . 14 ALA N 1 1
31 6168 1 1 14 ALA O O 5.694 6.309 10.910 1.00 . A A . 14 ALA O 1 1
31 6169 1 1 14 ALA OXT O 3.597 6.103 11.822 1.00 . A A . 14 ALA OXT 1 1
32 6170 1 1 1 ACE C C 7.687 10.681 3.720 1.00 . A A . 1 ACE C 1 1
32 6171 1 1 1 ACE CH3 C 6.834 11.839 3.214 1.00 . A A . 1 ACE CH3 1 1
32 6172 1 1 1 ACE H1 H 5.938 11.474 2.677 1.00 . A A . 1 ACE H1 1 1
32 6173 1 1 1 ACE H2 H 6.493 12.484 4.044 1.00 . A A . 1 ACE H2 1 1
32 6174 1 1 1 ACE H3 H 7.401 12.477 2.513 1.00 . A A . 1 ACE H3 1 1
32 6175 1 1 1 ACE O O 8.848 10.538 3.329 1.00 . A A . 1 ACE O 1 1
32 6176 1 1 2 ILE C C 6.875 7.456 4.773 1.00 . A A . 2 ILE C 1 1
32 6177 1 1 2 ILE CA C 7.740 8.681 5.208 1.00 . A A . 2 ILE CA 1 1
32 6178 1 1 2 ILE CB C 7.909 8.825 6.767 1.00 . A A . 2 ILE CB 1 1
32 6179 1 1 2 ILE CD1 C 10.177 10.193 6.777 1.00 . A A . 2 ILE CD1 1 1
32 6180 1 1 2 ILE CG1 C 8.713 10.076 7.240 1.00 . A A . 2 ILE CG1 1 1
32 6181 1 1 2 ILE CG2 C 8.488 7.553 7.439 1.00 . A A . 2 ILE CG2 1 1
32 6182 1 1 2 ILE H H 6.081 10.067 4.723 1.00 . A A . 2 ILE H 1 1
32 6183 1 1 2 ILE HA H 8.771 8.554 4.814 1.00 . A A . 2 ILE HA 1 1
32 6184 1 1 2 ILE HB H 6.896 8.950 7.194 1.00 . A A . 2 ILE HB 1 1
32 6185 1 1 2 ILE HD11 H 10.644 11.113 7.170 1.00 . A A . 2 ILE HD11 1 1
32 6186 1 1 2 ILE HD12 H 10.791 9.342 7.125 1.00 . A A . 2 ILE HD12 1 1
32 6187 1 1 2 ILE HD13 H 10.260 10.235 5.675 1.00 . A A . 2 ILE HD13 1 1
32 6188 1 1 2 ILE HG12 H 8.178 10.990 6.922 1.00 . A A . 2 ILE HG12 1 1
32 6189 1 1 2 ILE HG13 H 8.694 10.124 8.346 1.00 . A A . 2 ILE HG13 1 1
32 6190 1 1 2 ILE HG21 H 9.489 7.293 7.047 1.00 . A A . 2 ILE HG21 1 1
32 6191 1 1 2 ILE HG22 H 8.583 7.670 8.535 1.00 . A A . 2 ILE HG22 1 1
32 6192 1 1 2 ILE HG23 H 7.841 6.671 7.279 1.00 . A A . 2 ILE HG23 1 1
32 6193 1 1 2 ILE N N 7.083 9.874 4.599 1.00 . A A . 2 ILE N 1 1
32 6194 1 1 2 ILE O O 5.800 7.212 5.328 1.00 . A A . 2 ILE O 1 1
32 6195 1 1 3 TRP C C 7.450 4.261 3.826 1.00 . A A . 3 TRP C 1 1
32 6196 1 1 3 TRP CA C 6.659 5.476 3.268 1.00 . A A . 3 TRP CA 1 1
32 6197 1 1 3 TRP CB C 6.565 5.477 1.714 1.00 . A A . 3 TRP CB 1 1
32 6198 1 1 3 TRP CD1 C 4.879 7.380 1.068 1.00 . A A . 3 TRP CD1 1 1
32 6199 1 1 3 TRP CD2 C 4.200 5.321 0.575 1.00 . A A . 3 TRP CD2 1 1
32 6200 1 1 3 TRP CE2 C 3.230 6.258 0.140 1.00 . A A . 3 TRP CE2 1 1
32 6201 1 1 3 TRP CE3 C 4.000 3.931 0.365 1.00 . A A . 3 TRP CE3 1 1
32 6202 1 1 3 TRP CG C 5.249 6.024 1.148 1.00 . A A . 3 TRP CG 1 1
32 6203 1 1 3 TRP CH2 C 1.891 4.445 -0.737 1.00 . A A . 3 TRP CH2 1 1
32 6204 1 1 3 TRP CZ2 C 2.061 5.815 -0.524 1.00 . A A . 3 TRP CZ2 1 1
32 6205 1 1 3 TRP CZ3 C 2.840 3.517 -0.292 1.00 . A A . 3 TRP CZ3 1 1
32 6206 1 1 3 TRP H H 8.283 6.967 3.439 1.00 . A A . 3 TRP H 1 1
32 6207 1 1 3 TRP HA H 5.620 5.422 3.658 1.00 . A A . 3 TRP HA 1 1
32 6208 1 1 3 TRP HB2 H 7.419 6.014 1.260 1.00 . A A . 3 TRP HB2 1 1
32 6209 1 1 3 TRP HB3 H 6.685 4.445 1.331 1.00 . A A . 3 TRP HB3 1 1
32 6210 1 1 3 TRP HD1 H 5.468 8.190 1.464 1.00 . A A . 3 TRP HD1 1 1
32 6211 1 1 3 TRP HE1 H 3.145 8.426 0.223 1.00 . A A . 3 TRP HE1 1 1
32 6212 1 1 3 TRP HE3 H 4.728 3.204 0.694 1.00 . A A . 3 TRP HE3 1 1
32 6213 1 1 3 TRP HH2 H 1.008 4.093 -1.252 1.00 . A A . 3 TRP HH2 1 1
32 6214 1 1 3 TRP HZ2 H 1.319 6.519 -0.870 1.00 . A A . 3 TRP HZ2 1 1
32 6215 1 1 3 TRP HZ3 H 2.677 2.465 -0.468 1.00 . A A . 3 TRP HZ3 1 1
32 6216 1 1 3 TRP N N 7.352 6.696 3.771 1.00 . A A . 3 TRP N 1 1
32 6217 1 1 3 TRP NE1 N 3.635 7.549 0.431 1.00 . A A . 3 TRP NE1 1 1
32 6218 1 1 3 TRP O O 8.427 3.800 3.224 1.00 . A A . 3 TRP O 1 1
32 6219 1 1 4 GLY C C 6.721 1.785 6.550 1.00 . A A . 4 GLY C 1 1
32 6220 1 1 4 GLY CA C 7.657 2.619 5.660 1.00 . A A . 4 GLY CA 1 1
32 6221 1 1 4 GLY H H 6.299 4.347 5.440 1.00 . A A . 4 GLY H 1 1
32 6222 1 1 4 GLY HA2 H 8.148 1.954 4.924 1.00 . A A . 4 GLY HA2 1 1
32 6223 1 1 4 GLY HA3 H 8.475 3.019 6.287 1.00 . A A . 4 GLY HA3 1 1
32 6224 1 1 4 GLY N N 7.007 3.762 4.990 1.00 . A A . 4 GLY N 1 1
32 6225 1 1 4 GLY O O 6.734 1.943 7.773 1.00 . A A . 4 GLY O 1 1
32 6226 1 1 5 . C C 3.766 0.687 7.303 1.00 . A A . 5 SET C 1 1
32 6227 1 1 5 . CA C 4.989 -0.009 6.643 1.00 . A A . 5 SET CA 1 1
32 6228 1 1 5 . CB C 4.608 -1.186 5.691 1.00 . A A . 5 SET CB 1 1
32 6229 1 1 5 . H H 5.973 0.919 4.903 1.00 . A A . 5 SET H 1 1
32 6230 1 1 5 . HA H 5.557 -0.418 7.504 1.00 . A A . 5 SET HA 1 1
32 6231 1 1 5 . HB2 H 3.157 -0.076 7.823 1.00 . A A . 5 SET HB2 1 1
32 6232 1 1 5 . HB3 H 4.147 1.344 8.108 1.00 . A A . 5 SET HB3 1 1
32 6233 1 1 5 . HNT2 H 2.957 1.417 5.387 1.00 . A A . 5 SET HNT2 1 1
32 6234 1 1 5 . N N 5.929 0.895 5.926 1.00 . A A . 5 SET N 1 1
32 6235 1 1 5 . NT N 2.885 1.473 6.408 1.00 . A A . 5 SET NT 1 1
32 6236 1 1 5 . OG O 3.979 -0.981 4.647 1.00 . A A . 5 SET OG 1 1
32 6237 1 1 6 SER C C 3.302 -4.215 5.510 1.00 . A A . 6 SER C 1 1
32 6238 1 1 6 SER CA C 4.735 -3.652 5.280 1.00 . A A . 6 SER CA 1 1
32 6239 1 1 6 SER CB C 5.806 -4.705 5.664 1.00 . A A . 6 SER CB 1 1
32 6240 1 1 6 SER H H 5.465 -2.463 6.979 1.00 . A A . 6 SER H 1 1
32 6241 1 1 6 SER HA H 4.880 -3.419 4.205 1.00 . A A . 6 SER HA 1 1
32 6242 1 1 6 SER HB2 H 5.805 -4.910 6.754 1.00 . A A . 6 SER HB2 1 1
32 6243 1 1 6 SER HB3 H 5.595 -5.679 5.185 1.00 . A A . 6 SER HB3 1 1
32 6244 1 1 6 SER HG H 7.086 -4.183 4.315 1.00 . A A . 6 SER HG 1 1
32 6245 1 1 6 SER N N 4.994 -2.418 6.073 1.00 . A A . 6 SER N 1 1
32 6246 1 1 6 SER O O 2.844 -4.318 6.654 1.00 . A A . 6 SER O 1 1
32 6247 1 1 6 SER OG O 7.111 -4.288 5.269 1.00 . A A . 6 SER OG 1 1
32 6248 1 1 7 GLY C C 0.210 -4.142 3.907 1.00 . A A . 7 GLY C 1 1
32 6249 1 1 7 GLY CA C 1.228 -5.136 4.489 1.00 . A A . 7 GLY CA 1 1
32 6250 1 1 7 GLY H H 3.044 -4.377 3.511 1.00 . A A . 7 GLY H 1 1
32 6251 1 1 7 GLY HA2 H 1.189 -6.075 3.906 1.00 . A A . 7 GLY HA2 1 1
32 6252 1 1 7 GLY HA3 H 0.934 -5.431 5.517 1.00 . A A . 7 GLY HA3 1 1
32 6253 1 1 7 GLY N N 2.609 -4.595 4.416 1.00 . A A . 7 GLY N 1 1
32 6254 1 1 7 GLY O O -0.306 -4.351 2.805 1.00 . A A . 7 GLY O 1 1
32 6255 1 1 8 LYS C C -0.135 -0.923 3.509 1.00 . A A . 8 LYS C 1 1
32 6256 1 1 8 LYS CA C -1.004 -1.988 4.244 1.00 . A A . 8 LYS CA 1 1
32 6257 1 1 8 LYS CB C -1.763 -1.503 5.512 1.00 . A A . 8 LYS CB 1 1
32 6258 1 1 8 LYS CD C -2.725 0.920 5.084 1.00 . A A . 8 LYS CD 1 1
32 6259 1 1 8 LYS CE C -2.135 1.697 6.278 1.00 . A A . 8 LYS CE 1 1
32 6260 1 1 8 LYS CG C -2.992 -0.591 5.282 1.00 . A A . 8 LYS CG 1 1
32 6261 1 1 8 LYS H H 0.524 -2.967 5.491 1.00 . A A . 8 LYS H 1 1
32 6262 1 1 8 LYS HA H -1.767 -2.399 3.551 1.00 . A A . 8 LYS HA 1 1
32 6263 1 1 8 LYS HB2 H -2.147 -2.396 6.043 1.00 . A A . 8 LYS HB2 1 1
32 6264 1 1 8 LYS HB3 H -1.064 -1.040 6.234 1.00 . A A . 8 LYS HB3 1 1
32 6265 1 1 8 LYS HD2 H -2.055 1.055 4.216 1.00 . A A . 8 LYS HD2 1 1
32 6266 1 1 8 LYS HD3 H -3.670 1.405 4.774 1.00 . A A . 8 LYS HD3 1 1
32 6267 1 1 8 LYS HE2 H -1.171 1.254 6.593 1.00 . A A . 8 LYS HE2 1 1
32 6268 1 1 8 LYS HE3 H -1.889 2.723 5.946 1.00 . A A . 8 LYS HE3 1 1
32 6269 1 1 8 LYS HG2 H -3.570 -0.970 4.417 1.00 . A A . 8 LYS HG2 1 1
32 6270 1 1 8 LYS HG3 H -3.685 -0.712 6.136 1.00 . A A . 8 LYS HG3 1 1
32 6271 1 1 8 LYS HZ1 H -3.290 0.853 7.802 1.00 . A A . 8 LYS HZ1 1 1
32 6272 1 1 8 LYS HZ2 H -2.652 2.318 8.211 1.00 . A A . 8 LYS HZ2 1 1
32 6273 1 1 8 LYS HZ3 H -3.941 2.234 7.184 1.00 . A A . 8 LYS HZ3 1 1
32 6274 1 1 8 LYS N N -0.070 -3.065 4.664 1.00 . A A . 8 LYS N 1 1
32 6275 1 1 8 LYS NZ N -3.055 1.781 7.434 1.00 . A A . 8 LYS NZ 1 1
32 6276 1 1 8 LYS O O 0.410 0.001 4.124 1.00 . A A . 8 LYS O 1 1
32 6277 1 1 9 LEU C C 0.132 1.120 0.814 1.00 . A A . 9 LEU C 1 1
32 6278 1 1 9 LEU CA C 0.806 -0.209 1.298 1.00 . A A . 9 LEU CA 1 1
32 6279 1 1 9 LEU CB C 1.512 -1.032 0.173 1.00 . A A . 9 LEU CB 1 1
32 6280 1 1 9 LEU CD1 C 1.542 -1.845 -2.253 1.00 . A A . 9 LEU CD1 1 1
32 6281 1 1 9 LEU CD2 C 0.037 -3.013 -0.619 1.00 . A A . 9 LEU CD2 1 1
32 6282 1 1 9 LEU CG C 0.676 -1.660 -0.987 1.00 . A A . 9 LEU CG 1 1
32 6283 1 1 9 LEU H H -0.434 -1.976 1.867 1.00 . A A . 9 LEU H 1 1
32 6284 1 1 9 LEU HA H 1.667 0.136 1.909 1.00 . A A . 9 LEU HA 1 1
32 6285 1 1 9 LEU HB2 H 2.260 -0.347 -0.271 1.00 . A A . 9 LEU HB2 1 1
32 6286 1 1 9 LEU HB3 H 2.139 -1.820 0.636 1.00 . A A . 9 LEU HB3 1 1
32 6287 1 1 9 LEU HD11 H 1.966 -0.884 -2.604 1.00 . A A . 9 LEU HD11 1 1
32 6288 1 1 9 LEU HD12 H 2.391 -2.533 -2.086 1.00 . A A . 9 LEU HD12 1 1
32 6289 1 1 9 LEU HD13 H 0.955 -2.251 -3.100 1.00 . A A . 9 LEU HD13 1 1
32 6290 1 1 9 LEU HD21 H -0.528 -3.441 -1.470 1.00 . A A . 9 LEU HD21 1 1
32 6291 1 1 9 LEU HD22 H 0.793 -3.764 -0.324 1.00 . A A . 9 LEU HD22 1 1
32 6292 1 1 9 LEU HD23 H -0.682 -2.922 0.214 1.00 . A A . 9 LEU HD23 1 1
32 6293 1 1 9 LEU HG H -0.140 -0.966 -1.259 1.00 . A A . 9 LEU HG 1 1
32 6294 1 1 9 LEU N N -0.015 -1.094 2.178 1.00 . A A . 9 LEU N 1 1
32 6295 1 1 9 LEU O O 0.016 1.406 -0.381 1.00 . A A . 9 LEU O 1 1
32 6296 1 1 10 ILE C C -0.628 4.060 2.894 1.00 . A A . 10 ILE C 1 1
32 6297 1 1 10 ILE CA C -0.893 3.284 1.564 1.00 . A A . 10 ILE CA 1 1
32 6298 1 1 10 ILE CB C -2.365 3.236 1.007 1.00 . A A . 10 ILE CB 1 1
32 6299 1 1 10 ILE CD1 C -2.196 5.353 -0.495 1.00 . A A . 10 ILE CD1 1 1
32 6300 1 1 10 ILE CG1 C -2.943 4.629 0.636 1.00 . A A . 10 ILE CG1 1 1
32 6301 1 1 10 ILE CG2 C -3.386 2.469 1.880 1.00 . A A . 10 ILE CG2 1 1
32 6302 1 1 10 ILE H H -0.130 1.598 2.734 1.00 . A A . 10 ILE H 1 1
32 6303 1 1 10 ILE HA H -0.293 3.787 0.784 1.00 . A A . 10 ILE HA 1 1
32 6304 1 1 10 ILE HB H -2.319 2.666 0.058 1.00 . A A . 10 ILE HB 1 1
32 6305 1 1 10 ILE HD11 H -1.170 5.635 -0.196 1.00 . A A . 10 ILE HD11 1 1
32 6306 1 1 10 ILE HD12 H -2.119 4.720 -1.398 1.00 . A A . 10 ILE HD12 1 1
32 6307 1 1 10 ILE HD13 H -2.718 6.282 -0.783 1.00 . A A . 10 ILE HD13 1 1
32 6308 1 1 10 ILE HG12 H -3.998 4.522 0.316 1.00 . A A . 10 ILE HG12 1 1
32 6309 1 1 10 ILE HG13 H -2.979 5.281 1.530 1.00 . A A . 10 ILE HG13 1 1
32 6310 1 1 10 ILE HG21 H -3.564 2.963 2.852 1.00 . A A . 10 ILE HG21 1 1
32 6311 1 1 10 ILE HG22 H -4.367 2.380 1.379 1.00 . A A . 10 ILE HG22 1 1
32 6312 1 1 10 ILE HG23 H -3.050 1.437 2.086 1.00 . A A . 10 ILE HG23 1 1
32 6313 1 1 10 ILE N N -0.276 1.951 1.785 1.00 . A A . 10 ILE N 1 1
32 6314 1 1 10 ILE O O -1.527 4.228 3.723 1.00 . A A . 10 ILE O 1 1
32 6315 1 1 11 GLU C C 1.829 6.523 3.909 1.00 . A A . 11 GLU C 1 1
32 6316 1 1 11 GLU CA C 1.056 5.232 4.320 1.00 . A A . 11 GLU CA 1 1
32 6317 1 1 11 GLU CB C 1.935 4.302 5.205 1.00 . A A . 11 GLU CB 1 1
32 6318 1 1 11 GLU CD C 1.985 2.340 6.894 1.00 . A A . 11 GLU CD 1 1
32 6319 1 1 11 GLU CG C 1.162 3.143 5.881 1.00 . A A . 11 GLU CG 1 1
32 6320 1 1 11 GLU H H 1.308 4.269 2.363 1.00 . A A . 11 GLU H 1 1
32 6321 1 1 11 GLU HA H 0.196 5.454 4.980 1.00 . A A . 11 GLU HA 1 1
32 6322 1 1 11 GLU HB2 H 2.789 3.902 4.624 1.00 . A A . 11 GLU HB2 1 1
32 6323 1 1 11 GLU HB3 H 2.393 4.916 6.004 1.00 . A A . 11 GLU HB3 1 1
32 6324 1 1 11 GLU HG2 H 0.285 3.565 6.410 1.00 . A A . 11 GLU HG2 1 1
32 6325 1 1 11 GLU HG3 H 0.731 2.468 5.118 1.00 . A A . 11 GLU HG3 1 1
32 6326 1 1 11 GLU N N 0.631 4.515 3.093 1.00 . A A . 11 GLU N 1 1
32 6327 1 1 11 GLU O O 3.040 6.445 3.672 1.00 . A A . 11 GLU O 1 1
32 6328 1 1 11 GLU OE1 O 1.794 2.515 8.101 1.00 . A A . 11 GLU OE1 1 1
32 6329 1 1 12 THR C C 3.023 9.360 4.455 1.00 . A A . 12 THR C 1 1
32 6330 1 1 12 THR CA C 1.868 8.994 3.461 1.00 . A A . 12 THR CA 1 1
32 6331 1 1 12 THR CB C 0.867 10.174 3.230 1.00 . A A . 12 THR CB 1 1
32 6332 1 1 12 THR CG2 C 1.502 11.491 2.716 1.00 . A A . 12 THR CG2 1 1
32 6333 1 1 12 THR H H 0.146 7.642 3.747 1.00 . A A . 12 THR H 1 1
32 6334 1 1 12 THR HA H 2.349 8.821 2.481 1.00 . A A . 12 THR HA 1 1
32 6335 1 1 12 THR HB H 0.348 10.395 4.183 1.00 . A A . 12 THR HB 1 1
32 6336 1 1 12 THR HG1 H 0.338 9.734 1.431 1.00 . A A . 12 THR HG1 1 1
32 6337 1 1 12 THR HG21 H 2.227 11.920 3.434 1.00 . A A . 12 THR HG21 1 1
32 6338 1 1 12 THR HG22 H 2.042 11.358 1.759 1.00 . A A . 12 THR HG22 1 1
32 6339 1 1 12 THR HG23 H 0.741 12.277 2.543 1.00 . A A . 12 THR HG23 1 1
32 6340 1 1 12 THR N N 1.169 7.708 3.820 1.00 . A A . 12 THR N 1 1
32 6341 1 1 12 THR O O 4.143 9.593 3.996 1.00 . A A . 12 THR O 1 1
32 6342 1 1 12 THR OG1 O -0.119 9.797 2.273 1.00 . A A . 12 THR OG1 1 1
32 6343 1 1 13 THR C C 3.574 8.652 7.936 1.00 . A A . 13 THR C 1 1
32 6344 1 1 13 THR CA C 3.772 9.714 6.812 1.00 . A A . 13 THR CA 1 1
32 6345 1 1 13 THR CB C 3.674 11.194 7.289 1.00 . A A . 13 THR CB 1 1
32 6346 1 1 13 THR CG2 C 4.736 11.583 8.330 1.00 . A A . 13 THR CG2 1 1
32 6347 1 1 13 THR H H 1.775 9.213 6.024 1.00 . A A . 13 THR H 1 1
32 6348 1 1 13 THR HA H 4.787 9.591 6.386 1.00 . A A . 13 THR HA 1 1
32 6349 1 1 13 THR HB H 2.672 11.376 7.727 1.00 . A A . 13 THR HB 1 1
32 6350 1 1 13 THR HG1 H 3.807 12.966 6.546 1.00 . A A . 13 THR HG1 1 1
32 6351 1 1 13 THR HG21 H 5.761 11.439 7.940 1.00 . A A . 13 THR HG21 1 1
32 6352 1 1 13 THR HG22 H 4.641 12.644 8.626 1.00 . A A . 13 THR HG22 1 1
32 6353 1 1 13 THR HG23 H 4.646 10.981 9.253 1.00 . A A . 13 THR HG23 1 1
32 6354 1 1 13 THR N N 2.750 9.411 5.775 1.00 . A A . 13 THR N 1 1
32 6355 1 1 13 THR O O 2.702 8.796 8.799 1.00 . A A . 13 THR O 1 1
32 6356 1 1 13 THR OG1 O 3.846 12.077 6.184 1.00 . A A . 13 THR OG1 1 1
32 6357 1 1 14 ALA C C 5.164 6.823 10.165 1.00 . A A . 14 ALA C 1 1
32 6358 1 1 14 ALA CA C 4.340 6.483 8.902 1.00 . A A . 14 ALA CA 1 1
32 6359 1 1 14 ALA CB C 4.855 5.193 8.232 1.00 . A A . 14 ALA CB 1 1
32 6360 1 1 14 ALA H H 5.033 7.551 7.105 1.00 . A A . 14 ALA H 1 1
32 6361 1 1 14 ALA HXT H 4.902 7.135 12.058 1.00 . A A . 14 ALA HXT 1 1
32 6362 1 1 14 ALA HA H 3.287 6.297 9.193 1.00 . A A . 14 ALA HA 1 1
32 6363 1 1 14 ALA HB1 H 4.791 4.326 8.916 1.00 . A A . 14 ALA HB1 1 1
32 6364 1 1 14 ALA HB2 H 4.265 4.928 7.336 1.00 . A A . 14 ALA HB2 1 1
32 6365 1 1 14 ALA HB3 H 5.911 5.274 7.911 1.00 . A A . 14 ALA HB3 1 1
32 6366 1 1 14 ALA N N 4.397 7.585 7.911 1.00 . A A . 14 ALA N 1 1
32 6367 1 1 14 ALA O O 6.383 6.999 10.168 1.00 . A A . 14 ALA O 1 1
32 6368 1 1 14 ALA OXT O 4.378 6.917 11.284 1.00 . A A . 14 ALA OXT 1 1
33 6369 1 1 1 ACE C C 5.278 -4.220 0.653 1.00 . A A . 1 ACE C 1 1
33 6370 1 1 1 ACE CH3 C 4.551 -4.950 -0.472 1.00 . A A . 1 ACE CH3 1 1
33 6371 1 1 1 ACE H1 H 4.011 -4.252 -1.136 1.00 . A A . 1 ACE H1 1 1
33 6372 1 1 1 ACE H2 H 5.260 -5.529 -1.092 1.00 . A A . 1 ACE H2 1 1
33 6373 1 1 1 ACE H3 H 3.809 -5.662 -0.068 1.00 . A A . 1 ACE H3 1 1
33 6374 1 1 1 ACE O O 5.159 -4.597 1.822 1.00 . A A . 1 ACE O 1 1
33 6375 1 1 2 ILE C C 6.781 -0.836 0.851 1.00 . A A . 2 ILE C 1 1
33 6376 1 1 2 ILE CA C 6.825 -2.356 1.227 1.00 . A A . 2 ILE CA 1 1
33 6377 1 1 2 ILE CB C 8.265 -2.968 1.472 1.00 . A A . 2 ILE CB 1 1
33 6378 1 1 2 ILE CD1 C 8.365 -2.851 4.067 1.00 . A A . 2 ILE CD1 1 1
33 6379 1 1 2 ILE CG1 C 8.980 -2.405 2.735 1.00 . A A . 2 ILE CG1 1 1
33 6380 1 1 2 ILE CG2 C 9.268 -2.921 0.284 1.00 . A A . 2 ILE CG2 1 1
33 6381 1 1 2 ILE H H 5.978 -2.995 -0.740 1.00 . A A . 2 ILE H 1 1
33 6382 1 1 2 ILE HA H 6.329 -2.431 2.219 1.00 . A A . 2 ILE HA 1 1
33 6383 1 1 2 ILE HB H 8.117 -4.050 1.666 1.00 . A A . 2 ILE HB 1 1
33 6384 1 1 2 ILE HD11 H 8.310 -3.955 4.132 1.00 . A A . 2 ILE HD11 1 1
33 6385 1 1 2 ILE HD12 H 8.971 -2.501 4.921 1.00 . A A . 2 ILE HD12 1 1
33 6386 1 1 2 ILE HD13 H 7.344 -2.455 4.206 1.00 . A A . 2 ILE HD13 1 1
33 6387 1 1 2 ILE HG12 H 10.039 -2.732 2.752 1.00 . A A . 2 ILE HG12 1 1
33 6388 1 1 2 ILE HG13 H 9.025 -1.300 2.695 1.00 . A A . 2 ILE HG13 1 1
33 6389 1 1 2 ILE HG21 H 8.834 -3.312 -0.651 1.00 . A A . 2 ILE HG21 1 1
33 6390 1 1 2 ILE HG22 H 9.641 -1.900 0.079 1.00 . A A . 2 ILE HG22 1 1
33 6391 1 1 2 ILE HG23 H 10.168 -3.534 0.491 1.00 . A A . 2 ILE HG23 1 1
33 6392 1 1 2 ILE N N 6.031 -3.181 0.266 1.00 . A A . 2 ILE N 1 1
33 6393 1 1 2 ILE O O 7.665 -0.342 0.143 1.00 . A A . 2 ILE O 1 1
33 6394 1 1 3 TRP C C 5.583 2.006 2.492 1.00 . A A . 3 TRP C 1 1
33 6395 1 1 3 TRP CA C 5.644 1.387 1.066 1.00 . A A . 3 TRP CA 1 1
33 6396 1 1 3 TRP CB C 4.439 1.764 0.165 1.00 . A A . 3 TRP CB 1 1
33 6397 1 1 3 TRP CD1 C 4.534 0.348 -2.018 1.00 . A A . 3 TRP CD1 1 1
33 6398 1 1 3 TRP CD2 C 5.193 2.455 -2.259 1.00 . A A . 3 TRP CD2 1 1
33 6399 1 1 3 TRP CE2 C 5.319 1.771 -3.496 1.00 . A A . 3 TRP CE2 1 1
33 6400 1 1 3 TRP CE3 C 5.587 3.812 -2.144 1.00 . A A . 3 TRP CE3 1 1
33 6401 1 1 3 TRP CG C 4.697 1.560 -1.329 1.00 . A A . 3 TRP CG 1 1
33 6402 1 1 3 TRP CH2 C 6.214 3.782 -4.499 1.00 . A A . 3 TRP CH2 1 1
33 6403 1 1 3 TRP CZ2 C 5.834 2.444 -4.629 1.00 . A A . 3 TRP CZ2 1 1
33 6404 1 1 3 TRP CZ3 C 6.098 4.452 -3.274 1.00 . A A . 3 TRP CZ3 1 1
33 6405 1 1 3 TRP H H 5.040 -0.564 1.877 1.00 . A A . 3 TRP H 1 1
33 6406 1 1 3 TRP HA H 6.556 1.790 0.580 1.00 . A A . 3 TRP HA 1 1
33 6407 1 1 3 TRP HB2 H 3.541 1.199 0.474 1.00 . A A . 3 TRP HB2 1 1
33 6408 1 1 3 TRP HB3 H 4.166 2.825 0.324 1.00 . A A . 3 TRP HB3 1 1
33 6409 1 1 3 TRP HD1 H 4.227 -0.563 -1.535 1.00 . A A . 3 TRP HD1 1 1
33 6410 1 1 3 TRP HE1 H 4.924 -0.283 -4.083 1.00 . A A . 3 TRP HE1 1 1
33 6411 1 1 3 TRP HE3 H 5.507 4.340 -1.207 1.00 . A A . 3 TRP HE3 1 1
33 6412 1 1 3 TRP HH2 H 6.613 4.306 -5.355 1.00 . A A . 3 TRP HH2 1 1
33 6413 1 1 3 TRP HZ2 H 5.938 1.935 -5.577 1.00 . A A . 3 TRP HZ2 1 1
33 6414 1 1 3 TRP HZ3 H 6.411 5.483 -3.202 1.00 . A A . 3 TRP HZ3 1 1
33 6415 1 1 3 TRP N N 5.743 -0.091 1.296 1.00 . A A . 3 TRP N 1 1
33 6416 1 1 3 TRP NE1 N 4.902 0.456 -3.372 1.00 . A A . 3 TRP NE1 1 1
33 6417 1 1 3 TRP O O 4.545 2.483 2.961 1.00 . A A . 3 TRP O 1 1
33 6418 1 1 4 GLY C C 6.632 1.257 5.525 1.00 . A A . 4 GLY C 1 1
33 6419 1 1 4 GLY CA C 6.892 2.442 4.565 1.00 . A A . 4 GLY CA 1 1
33 6420 1 1 4 GLY H H 7.471 1.454 2.658 1.00 . A A . 4 GLY H 1 1
33 6421 1 1 4 GLY HA2 H 7.922 2.815 4.713 1.00 . A A . 4 GLY HA2 1 1
33 6422 1 1 4 GLY HA3 H 6.229 3.302 4.787 1.00 . A A . 4 GLY HA3 1 1
33 6423 1 1 4 GLY N N 6.749 1.977 3.167 1.00 . A A . 4 GLY N 1 1
33 6424 1 1 4 GLY O O 7.568 0.635 6.035 1.00 . A A . 4 GLY O 1 1
33 6425 1 1 5 . C C 3.622 0.256 7.441 1.00 . A A . 5 SET C 1 1
33 6426 1 1 5 . CA C 4.859 -0.165 6.589 1.00 . A A . 5 SET CA 1 1
33 6427 1 1 5 . CB C 4.560 -1.415 5.701 1.00 . A A . 5 SET CB 1 1
33 6428 1 1 5 . H H 4.686 1.547 5.207 1.00 . A A . 5 SET H 1 1
33 6429 1 1 5 . HA H 5.652 -0.422 7.319 1.00 . A A . 5 SET HA 1 1
33 6430 1 1 5 . HB2 H 3.235 -0.614 8.004 1.00 . A A . 5 SET HB2 1 1
33 6431 1 1 5 . HB3 H 3.978 0.955 8.224 1.00 . A A . 5 SET HB3 1 1
33 6432 1 1 5 . HNT2 H 2.442 0.751 5.655 1.00 . A A . 5 SET HNT2 1 1
33 6433 1 1 5 . N N 5.340 0.961 5.737 1.00 . A A . 5 SET N 1 1
33 6434 1 1 5 . NT N 2.501 0.868 6.674 1.00 . A A . 5 SET NT 1 1
33 6435 1 1 5 . OG O 3.916 -1.308 4.650 1.00 . A A . 5 SET OG 1 1
33 6436 1 1 6 SER C C 3.315 -4.365 5.552 1.00 . A A . 6 SER C 1 1
33 6437 1 1 6 SER CA C 4.790 -3.883 5.409 1.00 . A A . 6 SER CA 1 1
33 6438 1 1 6 SER CB C 5.786 -4.941 5.931 1.00 . A A . 6 SER CB 1 1
33 6439 1 1 6 SER H H 5.539 -2.582 7.025 1.00 . A A . 6 SER H 1 1
33 6440 1 1 6 SER HA H 5.036 -3.705 4.343 1.00 . A A . 6 SER HA 1 1
33 6441 1 1 6 SER HB2 H 6.818 -4.545 5.946 1.00 . A A . 6 SER HB2 1 1
33 6442 1 1 6 SER HB3 H 5.559 -5.225 6.977 1.00 . A A . 6 SER HB3 1 1
33 6443 1 1 6 SER HG H 6.003 -5.820 4.225 1.00 . A A . 6 SER HG 1 1
33 6444 1 1 6 SER N N 5.011 -2.608 6.146 1.00 . A A . 6 SER N 1 1
33 6445 1 1 6 SER O O 2.777 -4.413 6.665 1.00 . A A . 6 SER O 1 1
33 6446 1 1 6 SER OG O 5.761 -6.104 5.109 1.00 . A A . 6 SER OG 1 1
33 6447 1 1 7 GLY C C 0.273 -4.047 3.992 1.00 . A A . 7 GLY C 1 1
33 6448 1 1 7 GLY CA C 1.253 -5.159 4.425 1.00 . A A . 7 GLY CA 1 1
33 6449 1 1 7 GLY H H 3.223 -4.641 3.561 1.00 . A A . 7 GLY H 1 1
33 6450 1 1 7 GLY HA2 H 1.159 -6.011 3.726 1.00 . A A . 7 GLY HA2 1 1
33 6451 1 1 7 GLY HA3 H 0.942 -5.569 5.406 1.00 . A A . 7 GLY HA3 1 1
33 6452 1 1 7 GLY N N 2.672 -4.715 4.424 1.00 . A A . 7 GLY N 1 1
33 6453 1 1 7 GLY O O -0.456 -4.219 3.011 1.00 . A A . 7 GLY O 1 1
33 6454 1 1 8 LYS C C 0.191 -0.796 3.517 1.00 . A A . 8 LYS C 1 1
33 6455 1 1 8 LYS CA C -0.619 -1.758 4.437 1.00 . A A . 8 LYS CA 1 1
33 6456 1 1 8 LYS CB C -1.062 -1.143 5.791 1.00 . A A . 8 LYS CB 1 1
33 6457 1 1 8 LYS CD C -2.746 0.374 7.035 1.00 . A A . 8 LYS CD 1 1
33 6458 1 1 8 LYS CE C -1.818 1.238 7.909 1.00 . A A . 8 LYS CE 1 1
33 6459 1 1 8 LYS CG C -2.146 -0.049 5.679 1.00 . A A . 8 LYS CG 1 1
33 6460 1 1 8 LYS H H 0.938 -2.878 5.484 1.00 . A A . 8 LYS H 1 1
33 6461 1 1 8 LYS HA H -1.542 -2.103 3.923 1.00 . A A . 8 LYS HA 1 1
33 6462 1 1 8 LYS HB2 H -1.460 -1.951 6.438 1.00 . A A . 8 LYS HB2 1 1
33 6463 1 1 8 LYS HB3 H -0.182 -0.746 6.333 1.00 . A A . 8 LYS HB3 1 1
33 6464 1 1 8 LYS HD2 H -3.679 0.931 6.833 1.00 . A A . 8 LYS HD2 1 1
33 6465 1 1 8 LYS HD3 H -3.061 -0.534 7.587 1.00 . A A . 8 LYS HD3 1 1
33 6466 1 1 8 LYS HE2 H -0.868 0.708 8.114 1.00 . A A . 8 LYS HE2 1 1
33 6467 1 1 8 LYS HE3 H -1.543 2.163 7.369 1.00 . A A . 8 LYS HE3 1 1
33 6468 1 1 8 LYS HG2 H -1.752 0.834 5.139 1.00 . A A . 8 LYS HG2 1 1
33 6469 1 1 8 LYS HG3 H -2.970 -0.429 5.045 1.00 . A A . 8 LYS HG3 1 1
33 6470 1 1 8 LYS HZ1 H -2.711 0.760 9.737 1.00 . A A . 8 LYS HZ1 1 1
33 6471 1 1 8 LYS HZ2 H -1.854 2.170 9.782 1.00 . A A . 8 LYS HZ2 1 1
33 6472 1 1 8 LYS HZ3 H -3.332 2.123 9.047 1.00 . A A . 8 LYS HZ3 1 1
33 6473 1 1 8 LYS N N 0.244 -2.923 4.737 1.00 . A A . 8 LYS N 1 1
33 6474 1 1 8 LYS NZ N -2.464 1.592 9.190 1.00 . A A . 8 LYS NZ 1 1
33 6475 1 1 8 LYS O O 0.952 0.063 3.976 1.00 . A A . 8 LYS O 1 1
33 6476 1 1 9 LEU C C 0.366 1.350 1.052 1.00 . A A . 9 LEU C 1 1
33 6477 1 1 9 LEU CA C 0.703 -0.177 1.149 1.00 . A A . 9 LEU CA 1 1
33 6478 1 1 9 LEU CB C 0.564 -0.866 -0.248 1.00 . A A . 9 LEU CB 1 1
33 6479 1 1 9 LEU CD1 C 1.146 -3.353 0.198 1.00 . A A . 9 LEU CD1 1 1
33 6480 1 1 9 LEU CD2 C 1.535 -2.351 -2.077 1.00 . A A . 9 LEU CD2 1 1
33 6481 1 1 9 LEU CG C 1.509 -2.063 -0.561 1.00 . A A . 9 LEU CG 1 1
33 6482 1 1 9 LEU H H -0.523 -1.831 2.001 1.00 . A A . 9 LEU H 1 1
33 6483 1 1 9 LEU HA H 1.782 -0.202 1.400 1.00 . A A . 9 LEU HA 1 1
33 6484 1 1 9 LEU HB2 H -0.488 -1.149 -0.443 1.00 . A A . 9 LEU HB2 1 1
33 6485 1 1 9 LEU HB3 H 0.774 -0.106 -1.026 1.00 . A A . 9 LEU HB3 1 1
33 6486 1 1 9 LEU HD11 H 0.088 -3.641 0.053 1.00 . A A . 9 LEU HD11 1 1
33 6487 1 1 9 LEU HD12 H 1.761 -4.213 -0.123 1.00 . A A . 9 LEU HD12 1 1
33 6488 1 1 9 LEU HD13 H 1.318 -3.244 1.283 1.00 . A A . 9 LEU HD13 1 1
33 6489 1 1 9 LEU HD21 H 2.238 -3.166 -2.332 1.00 . A A . 9 LEU HD21 1 1
33 6490 1 1 9 LEU HD22 H 0.541 -2.644 -2.464 1.00 . A A . 9 LEU HD22 1 1
33 6491 1 1 9 LEU HD23 H 1.863 -1.466 -2.655 1.00 . A A . 9 LEU HD23 1 1
33 6492 1 1 9 LEU HG H 2.538 -1.780 -0.267 1.00 . A A . 9 LEU HG 1 1
33 6493 1 1 9 LEU N N 0.002 -0.974 2.200 1.00 . A A . 9 LEU N 1 1
33 6494 1 1 9 LEU O O 1.185 2.075 0.478 1.00 . A A . 9 LEU O 1 1
33 6495 1 1 10 ILE C C -0.565 4.158 2.735 1.00 . A A . 10 ILE C 1 1
33 6496 1 1 10 ILE CA C -1.100 3.327 1.503 1.00 . A A . 10 ILE CA 1 1
33 6497 1 1 10 ILE CB C -2.612 3.486 1.088 1.00 . A A . 10 ILE CB 1 1
33 6498 1 1 10 ILE CD1 C -2.731 6.127 0.855 1.00 . A A . 10 ILE CD1 1 1
33 6499 1 1 10 ILE CG1 C -2.925 4.742 0.224 1.00 . A A . 10 ILE CG1 1 1
33 6500 1 1 10 ILE CG2 C -3.639 3.271 2.226 1.00 . A A . 10 ILE CG2 1 1
33 6501 1 1 10 ILE H H -1.321 1.230 2.164 1.00 . A A . 10 ILE H 1 1
33 6502 1 1 10 ILE HA H -0.542 3.754 0.644 1.00 . A A . 10 ILE HA 1 1
33 6503 1 1 10 ILE HB H -2.833 2.670 0.368 1.00 . A A . 10 ILE HB 1 1
33 6504 1 1 10 ILE HD11 H -1.666 6.329 1.070 1.00 . A A . 10 ILE HD11 1 1
33 6505 1 1 10 ILE HD12 H -3.077 6.924 0.173 1.00 . A A . 10 ILE HD12 1 1
33 6506 1 1 10 ILE HD13 H -3.294 6.231 1.800 1.00 . A A . 10 ILE HD13 1 1
33 6507 1 1 10 ILE HG12 H -2.311 4.700 -0.696 1.00 . A A . 10 ILE HG12 1 1
33 6508 1 1 10 ILE HG13 H -3.967 4.671 -0.138 1.00 . A A . 10 ILE HG13 1 1
33 6509 1 1 10 ILE HG21 H -3.465 2.319 2.759 1.00 . A A . 10 ILE HG21 1 1
33 6510 1 1 10 ILE HG22 H -3.606 4.077 2.982 1.00 . A A . 10 ILE HG22 1 1
33 6511 1 1 10 ILE HG23 H -4.675 3.237 1.839 1.00 . A A . 10 ILE HG23 1 1
33 6512 1 1 10 ILE N N -0.770 1.868 1.580 1.00 . A A . 10 ILE N 1 1
33 6513 1 1 10 ILE O O -1.253 5.033 3.268 1.00 . A A . 10 ILE O 1 1
33 6514 1 1 11 GLU C C 2.352 5.741 3.816 1.00 . A A . 11 GLU C 1 1
33 6515 1 1 11 GLU CA C 1.354 4.623 4.288 1.00 . A A . 11 GLU CA 1 1
33 6516 1 1 11 GLU CB C 2.028 3.641 5.283 1.00 . A A . 11 GLU CB 1 1
33 6517 1 1 11 GLU CD C 1.789 1.897 7.156 1.00 . A A . 11 GLU CD 1 1
33 6518 1 1 11 GLU CG C 1.056 2.780 6.131 1.00 . A A . 11 GLU CG 1 1
33 6519 1 1 11 GLU H H 1.025 2.988 2.814 1.00 . A A . 11 GLU H 1 1
33 6520 1 1 11 GLU HA H 0.587 5.155 4.883 1.00 . A A . 11 GLU HA 1 1
33 6521 1 1 11 GLU HB2 H 2.740 2.983 4.751 1.00 . A A . 11 GLU HB2 1 1
33 6522 1 1 11 GLU HB3 H 2.654 4.215 5.996 1.00 . A A . 11 GLU HB3 1 1
33 6523 1 1 11 GLU HG2 H 0.361 3.452 6.675 1.00 . A A . 11 GLU HG2 1 1
33 6524 1 1 11 GLU HG3 H 0.403 2.162 5.487 1.00 . A A . 11 GLU HG3 1 1
33 6525 1 1 11 GLU N N 0.685 3.893 3.166 1.00 . A A . 11 GLU N 1 1
33 6526 1 1 11 GLU O O 2.583 6.671 4.593 1.00 . A A . 11 GLU O 1 1
33 6527 1 1 11 GLU OE1 O 1.743 2.185 8.355 1.00 . A A . 11 GLU OE1 1 1
33 6528 1 1 12 THR C C 3.109 7.406 0.927 1.00 . A A . 12 THR C 1 1
33 6529 1 1 12 THR CA C 3.897 6.696 2.072 1.00 . A A . 12 THR CA 1 1
33 6530 1 1 12 THR CB C 5.273 6.052 1.708 1.00 . A A . 12 THR CB 1 1
33 6531 1 1 12 THR CG2 C 6.317 7.050 1.176 1.00 . A A . 12 THR CG2 1 1
33 6532 1 1 12 THR H H 2.533 4.999 1.952 1.00 . A A . 12 THR H 1 1
33 6533 1 1 12 THR HA H 4.105 7.463 2.844 1.00 . A A . 12 THR HA 1 1
33 6534 1 1 12 THR HB H 5.124 5.268 0.941 1.00 . A A . 12 THR HB 1 1
33 6535 1 1 12 THR HG1 H 5.177 4.806 3.172 1.00 . A A . 12 THR HG1 1 1
33 6536 1 1 12 THR HG21 H 6.533 7.850 1.908 1.00 . A A . 12 THR HG21 1 1
33 6537 1 1 12 THR HG22 H 7.276 6.545 0.954 1.00 . A A . 12 THR HG22 1 1
33 6538 1 1 12 THR HG23 H 5.987 7.536 0.240 1.00 . A A . 12 THR HG23 1 1
33 6539 1 1 12 THR N N 2.959 5.665 2.605 1.00 . A A . 12 THR N 1 1
33 6540 1 1 12 THR O O 2.585 8.501 1.157 1.00 . A A . 12 THR O 1 1
33 6541 1 1 12 THR OG1 O 5.838 5.431 2.859 1.00 . A A . 12 THR OG1 1 1
33 6542 1 1 13 THR C C 1.211 6.261 -1.847 1.00 . A A . 13 THR C 1 1
33 6543 1 1 13 THR CA C 2.246 7.349 -1.424 1.00 . A A . 13 THR CA 1 1
33 6544 1 1 13 THR CB C 3.160 7.903 -2.560 1.00 . A A . 13 THR CB 1 1
33 6545 1 1 13 THR CG2 C 3.919 9.189 -2.195 1.00 . A A . 13 THR CG2 1 1
33 6546 1 1 13 THR H H 3.607 5.975 -0.403 1.00 . A A . 13 THR H 1 1
33 6547 1 1 13 THR HA H 1.629 8.208 -1.088 1.00 . A A . 13 THR HA 1 1
33 6548 1 1 13 THR HB H 2.510 8.140 -3.420 1.00 . A A . 13 THR HB 1 1
33 6549 1 1 13 THR HG1 H 4.641 7.367 -3.665 1.00 . A A . 13 THR HG1 1 1
33 6550 1 1 13 THR HG21 H 4.503 9.571 -3.052 1.00 . A A . 13 THR HG21 1 1
33 6551 1 1 13 THR HG22 H 3.229 9.997 -1.886 1.00 . A A . 13 THR HG22 1 1
33 6552 1 1 13 THR HG23 H 4.628 9.027 -1.362 1.00 . A A . 13 THR HG23 1 1
33 6553 1 1 13 THR N N 3.006 6.794 -0.272 1.00 . A A . 13 THR N 1 1
33 6554 1 1 13 THR O O 0.038 6.374 -1.474 1.00 . A A . 13 THR O 1 1
33 6555 1 1 13 THR OG1 O 4.111 6.935 -2.991 1.00 . A A . 13 THR OG1 1 1
33 6556 1 1 14 ALA C C 1.553 2.844 -3.271 1.00 . A A . 14 ALA C 1 1
33 6557 1 1 14 ALA CA C 0.724 4.125 -3.043 1.00 . A A . 14 ALA CA 1 1
33 6558 1 1 14 ALA CB C -0.087 4.530 -4.293 1.00 . A A . 14 ALA CB 1 1
33 6559 1 1 14 ALA H H 2.615 5.251 -2.865 1.00 . A A . 14 ALA H 1 1
33 6560 1 1 14 ALA HXT H 2.938 2.139 -4.430 1.00 . A A . 14 ALA HXT 1 1
33 6561 1 1 14 ALA HA H 0.002 3.894 -2.234 1.00 . A A . 14 ALA HA 1 1
33 6562 1 1 14 ALA HB1 H 0.564 4.783 -5.151 1.00 . A A . 14 ALA HB1 1 1
33 6563 1 1 14 ALA HB2 H -0.763 3.717 -4.620 1.00 . A A . 14 ALA HB2 1 1
33 6564 1 1 14 ALA HB3 H -0.724 5.412 -4.095 1.00 . A A . 14 ALA HB3 1 1
33 6565 1 1 14 ALA N N 1.624 5.217 -2.597 1.00 . A A . 14 ALA N 1 1
33 6566 1 1 14 ALA O O 1.441 1.839 -2.573 1.00 . A A . 14 ALA O 1 1
33 6567 1 1 14 ALA OXT O 2.426 2.945 -4.327 1.00 . A A . 14 ALA OXT 1 1
34 6568 1 1 1 ACE C C 5.755 -1.816 -1.871 1.00 . A A . 1 ACE C 1 1
34 6569 1 1 1 ACE CH3 C 6.574 -1.952 -3.150 1.00 . A A . 1 ACE CH3 1 1
34 6570 1 1 1 ACE H1 H 5.982 -2.431 -3.953 1.00 . A A . 1 ACE H1 1 1
34 6571 1 1 1 ACE H2 H 6.901 -0.966 -3.530 1.00 . A A . 1 ACE H2 1 1
34 6572 1 1 1 ACE H3 H 7.475 -2.574 -2.992 1.00 . A A . 1 ACE H3 1 1
34 6573 1 1 1 ACE O O 4.597 -2.232 -1.825 1.00 . A A . 1 ACE O 1 1
34 6574 1 1 2 ILE C C 6.318 0.384 0.935 1.00 . A A . 2 ILE C 1 1
34 6575 1 1 2 ILE CA C 5.778 -1.014 0.493 1.00 . A A . 2 ILE CA 1 1
34 6576 1 1 2 ILE CB C 5.982 -2.186 1.531 1.00 . A A . 2 ILE CB 1 1
34 6577 1 1 2 ILE CD1 C 7.952 -1.885 3.239 1.00 . A A . 2 ILE CD1 1 1
34 6578 1 1 2 ILE CG1 C 7.419 -2.603 1.986 1.00 . A A . 2 ILE CG1 1 1
34 6579 1 1 2 ILE CG2 C 5.174 -3.448 1.132 1.00 . A A . 2 ILE CG2 1 1
34 6580 1 1 2 ILE H H 7.281 -0.804 -1.070 1.00 . A A . 2 ILE H 1 1
34 6581 1 1 2 ILE HA H 4.678 -0.931 0.378 1.00 . A A . 2 ILE HA 1 1
34 6582 1 1 2 ILE HB H 5.484 -1.828 2.437 1.00 . A A . 2 ILE HB 1 1
34 6583 1 1 2 ILE HD11 H 8.960 -2.250 3.507 1.00 . A A . 2 ILE HD11 1 1
34 6584 1 1 2 ILE HD12 H 8.030 -0.793 3.116 1.00 . A A . 2 ILE HD12 1 1
34 6585 1 1 2 ILE HD13 H 7.302 -2.064 4.116 1.00 . A A . 2 ILE HD13 1 1
34 6586 1 1 2 ILE HG12 H 7.448 -3.682 2.246 1.00 . A A . 2 ILE HG12 1 1
34 6587 1 1 2 ILE HG13 H 8.141 -2.502 1.159 1.00 . A A . 2 ILE HG13 1 1
34 6588 1 1 2 ILE HG21 H 4.115 -3.208 0.922 1.00 . A A . 2 ILE HG21 1 1
34 6589 1 1 2 ILE HG22 H 5.585 -3.933 0.228 1.00 . A A . 2 ILE HG22 1 1
34 6590 1 1 2 ILE HG23 H 5.168 -4.210 1.932 1.00 . A A . 2 ILE HG23 1 1
34 6591 1 1 2 ILE N N 6.392 -1.252 -0.840 1.00 . A A . 2 ILE N 1 1
34 6592 1 1 2 ILE O O 7.526 0.532 1.156 1.00 . A A . 2 ILE O 1 1
34 6593 1 1 3 TRP C C 5.926 2.875 3.010 1.00 . A A . 3 TRP C 1 1
34 6594 1 1 3 TRP CA C 5.897 2.796 1.454 1.00 . A A . 3 TRP CA 1 1
34 6595 1 1 3 TRP CB C 5.026 3.915 0.805 1.00 . A A . 3 TRP CB 1 1
34 6596 1 1 3 TRP CD1 C 5.534 4.007 -1.762 1.00 . A A . 3 TRP CD1 1 1
34 6597 1 1 3 TRP CD2 C 6.430 5.660 -0.582 1.00 . A A . 3 TRP CD2 1 1
34 6598 1 1 3 TRP CE2 C 6.768 5.814 -1.951 1.00 . A A . 3 TRP CE2 1 1
34 6599 1 1 3 TRP CE3 C 6.931 6.567 0.385 1.00 . A A . 3 TRP CE3 1 1
34 6600 1 1 3 TRP CG C 5.636 4.529 -0.461 1.00 . A A . 3 TRP CG 1 1
34 6601 1 1 3 TRP CH2 C 8.051 7.789 -1.398 1.00 . A A . 3 TRP CH2 1 1
34 6602 1 1 3 TRP CZ2 C 7.588 6.891 -2.363 1.00 . A A . 3 TRP CZ2 1 1
34 6603 1 1 3 TRP CZ3 C 7.729 7.628 -0.045 1.00 . A A . 3 TRP CZ3 1 1
34 6604 1 1 3 TRP H H 4.507 1.259 0.694 1.00 . A A . 3 TRP H 1 1
34 6605 1 1 3 TRP HA H 6.935 2.970 1.096 1.00 . A A . 3 TRP HA 1 1
34 6606 1 1 3 TRP HB2 H 3.998 3.556 0.605 1.00 . A A . 3 TRP HB2 1 1
34 6607 1 1 3 TRP HB3 H 4.866 4.743 1.521 1.00 . A A . 3 TRP HB3 1 1
34 6608 1 1 3 TRP HD1 H 5.027 3.088 -1.996 1.00 . A A . 3 TRP HD1 1 1
34 6609 1 1 3 TRP HE1 H 6.320 4.629 -3.714 1.00 . A A . 3 TRP HE1 1 1
34 6610 1 1 3 TRP HE3 H 6.722 6.436 1.436 1.00 . A A . 3 TRP HE3 1 1
34 6611 1 1 3 TRP HH2 H 8.677 8.616 -1.701 1.00 . A A . 3 TRP HH2 1 1
34 6612 1 1 3 TRP HZ2 H 7.853 7.020 -3.403 1.00 . A A . 3 TRP HZ2 1 1
34 6613 1 1 3 TRP HZ3 H 8.115 8.330 0.680 1.00 . A A . 3 TRP HZ3 1 1
34 6614 1 1 3 TRP N N 5.461 1.430 1.023 1.00 . A A . 3 TRP N 1 1
34 6615 1 1 3 TRP NE1 N 6.214 4.796 -2.707 1.00 . A A . 3 TRP NE1 1 1
34 6616 1 1 3 TRP O O 4.978 3.317 3.670 1.00 . A A . 3 TRP O 1 1
34 6617 1 1 4 GLY C C 6.839 1.084 5.703 1.00 . A A . 4 GLY C 1 1
34 6618 1 1 4 GLY CA C 7.305 2.385 5.021 1.00 . A A . 4 GLY CA 1 1
34 6619 1 1 4 GLY H H 7.642 1.932 2.868 1.00 . A A . 4 GLY H 1 1
34 6620 1 1 4 GLY HA2 H 8.393 2.495 5.183 1.00 . A A . 4 GLY HA2 1 1
34 6621 1 1 4 GLY HA3 H 6.861 3.270 5.517 1.00 . A A . 4 GLY HA3 1 1
34 6622 1 1 4 GLY N N 7.058 2.414 3.561 1.00 . A A . 4 GLY N 1 1
34 6623 1 1 4 GLY O O 7.648 0.198 5.988 1.00 . A A . 4 GLY O 1 1
34 6624 1 1 5 . C C 3.598 0.264 7.381 1.00 . A A . 5 SET C 1 1
34 6625 1 1 5 . CA C 4.885 -0.173 6.620 1.00 . A A . 5 SET CA 1 1
34 6626 1 1 5 . CB C 4.606 -1.356 5.642 1.00 . A A . 5 SET CB 1 1
34 6627 1 1 5 . H H 4.979 1.791 5.604 1.00 . A A . 5 SET H 1 1
34 6628 1 1 5 . HA H 5.580 -0.516 7.416 1.00 . A A . 5 SET HA 1 1
34 6629 1 1 5 . HB2 H 3.133 -0.617 7.866 1.00 . A A . 5 SET HB2 1 1
34 6630 1 1 5 . HB3 H 3.907 0.914 8.225 1.00 . A A . 5 SET HB3 1 1
34 6631 1 1 5 . HNT2 H 2.611 0.959 5.534 1.00 . A A . 5 SET HNT2 1 1
34 6632 1 1 5 . N N 5.527 0.999 5.960 1.00 . A A . 5 SET N 1 1
34 6633 1 1 5 . NT N 2.568 0.956 6.560 1.00 . A A . 5 SET NT 1 1
34 6634 1 1 5 . OG O 4.018 -1.165 4.571 1.00 . A A . 5 SET OG 1 1
34 6635 1 1 6 SER C C 3.372 -4.367 5.495 1.00 . A A . 6 SER C 1 1
34 6636 1 1 6 SER CA C 4.804 -3.810 5.233 1.00 . A A . 6 SER CA 1 1
34 6637 1 1 6 SER CB C 5.907 -4.830 5.583 1.00 . A A . 6 SER CB 1 1
34 6638 1 1 6 SER H H 5.477 -2.617 6.954 1.00 . A A . 6 SER H 1 1
34 6639 1 1 6 SER HA H 4.933 -3.554 4.163 1.00 . A A . 6 SER HA 1 1
34 6640 1 1 6 SER HB2 H 6.912 -4.375 5.481 1.00 . A A . 6 SER HB2 1 1
34 6641 1 1 6 SER HB3 H 5.829 -5.160 6.638 1.00 . A A . 6 SER HB3 1 1
34 6642 1 1 6 SER HG H 6.058 -5.658 3.845 1.00 . A A . 6 SER HG 1 1
34 6643 1 1 6 SER N N 5.015 -2.578 6.039 1.00 . A A . 6 SER N 1 1
34 6644 1 1 6 SER O O 2.973 -4.555 6.651 1.00 . A A . 6 SER O 1 1
34 6645 1 1 6 SER OG O 5.838 -5.967 4.729 1.00 . A A . 6 SER OG 1 1
34 6646 1 1 7 GLY C C 0.215 -4.056 4.036 1.00 . A A . 7 GLY C 1 1
34 6647 1 1 7 GLY CA C 1.215 -5.125 4.522 1.00 . A A . 7 GLY CA 1 1
34 6648 1 1 7 GLY H H 3.053 -4.436 3.510 1.00 . A A . 7 GLY H 1 1
34 6649 1 1 7 GLY HA2 H 1.114 -6.031 3.897 1.00 . A A . 7 GLY HA2 1 1
34 6650 1 1 7 GLY HA3 H 0.948 -5.453 5.546 1.00 . A A . 7 GLY HA3 1 1
34 6651 1 1 7 GLY N N 2.614 -4.631 4.417 1.00 . A A . 7 GLY N 1 1
34 6652 1 1 7 GLY O O -0.472 -4.267 3.034 1.00 . A A . 7 GLY O 1 1
34 6653 1 1 8 LYS C C 0.111 -0.835 3.513 1.00 . A A . 8 LYS C 1 1
34 6654 1 1 8 LYS CA C -0.745 -1.782 4.404 1.00 . A A . 8 LYS CA 1 1
34 6655 1 1 8 LYS CB C -1.264 -1.146 5.718 1.00 . A A . 8 LYS CB 1 1
34 6656 1 1 8 LYS CD C -3.040 0.364 6.834 1.00 . A A . 8 LYS CD 1 1
34 6657 1 1 8 LYS CE C -2.195 1.347 7.666 1.00 . A A . 8 LYS CE 1 1
34 6658 1 1 8 LYS CG C -2.377 -0.093 5.518 1.00 . A A . 8 LYS CG 1 1
34 6659 1 1 8 LYS H H 0.802 -2.840 5.526 1.00 . A A . 8 LYS H 1 1
34 6660 1 1 8 LYS HA H -1.632 -2.149 3.846 1.00 . A A . 8 LYS HA 1 1
34 6661 1 1 8 LYS HB2 H -1.665 -1.946 6.371 1.00 . A A . 8 LYS HB2 1 1
34 6662 1 1 8 LYS HB3 H -0.423 -0.702 6.288 1.00 . A A . 8 LYS HB3 1 1
34 6663 1 1 8 LYS HD2 H -4.005 0.841 6.579 1.00 . A A . 8 LYS HD2 1 1
34 6664 1 1 8 LYS HD3 H -3.304 -0.528 7.435 1.00 . A A . 8 LYS HD3 1 1
34 6665 1 1 8 LYS HE2 H -1.207 0.910 7.904 1.00 . A A . 8 LYS HE2 1 1
34 6666 1 1 8 LYS HE3 H -1.995 2.261 7.075 1.00 . A A . 8 LYS HE3 1 1
34 6667 1 1 8 LYS HG2 H -1.994 0.778 4.953 1.00 . A A . 8 LYS HG2 1 1
34 6668 1 1 8 LYS HG3 H -3.165 -0.529 4.874 1.00 . A A . 8 LYS HG3 1 1
34 6669 1 1 8 LYS HZ1 H -3.791 2.161 8.741 1.00 . A A . 8 LYS HZ1 1 1
34 6670 1 1 8 LYS HZ2 H -3.066 0.897 9.511 1.00 . A A . 8 LYS HZ2 1 1
34 6671 1 1 8 LYS HZ3 H -2.332 2.374 9.484 1.00 . A A . 8 LYS HZ3 1 1
34 6672 1 1 8 LYS N N 0.130 -2.922 4.760 1.00 . A A . 8 LYS N 1 1
34 6673 1 1 8 LYS NZ N -2.883 1.716 8.921 1.00 . A A . 8 LYS NZ 1 1
34 6674 1 1 8 LYS O O 0.878 0.004 3.999 1.00 . A A . 8 LYS O 1 1
34 6675 1 1 9 LEU C C 0.478 1.314 1.111 1.00 . A A . 9 LEU C 1 1
34 6676 1 1 9 LEU CA C 0.720 -0.232 1.168 1.00 . A A . 9 LEU CA 1 1
34 6677 1 1 9 LEU CB C 0.560 -0.885 -0.248 1.00 . A A . 9 LEU CB 1 1
34 6678 1 1 9 LEU CD1 C 1.121 -3.394 0.205 1.00 . A A . 9 LEU CD1 1 1
34 6679 1 1 9 LEU CD2 C 1.405 -2.429 -2.094 1.00 . A A . 9 LEU CD2 1 1
34 6680 1 1 9 LEU CG C 1.453 -2.114 -0.583 1.00 . A A . 9 LEU CG 1 1
34 6681 1 1 9 LEU H H -0.563 -1.861 1.979 1.00 . A A . 9 LEU H 1 1
34 6682 1 1 9 LEU HA H 1.792 -0.333 1.430 1.00 . A A . 9 LEU HA 1 1
34 6683 1 1 9 LEU HB2 H -0.500 -1.128 -0.462 1.00 . A A . 9 LEU HB2 1 1
34 6684 1 1 9 LEU HB3 H 0.812 -0.123 -1.016 1.00 . A A . 9 LEU HB3 1 1
34 6685 1 1 9 LEU HD11 H 0.067 -3.703 0.078 1.00 . A A . 9 LEU HD11 1 1
34 6686 1 1 9 LEU HD12 H 1.753 -4.246 -0.110 1.00 . A A . 9 LEU HD12 1 1
34 6687 1 1 9 LEU HD13 H 1.304 -3.263 1.286 1.00 . A A . 9 LEU HD13 1 1
34 6688 1 1 9 LEU HD21 H 0.390 -2.706 -2.434 1.00 . A A . 9 LEU HD21 1 1
34 6689 1 1 9 LEU HD22 H 1.732 -1.565 -2.704 1.00 . A A . 9 LEU HD22 1 1
34 6690 1 1 9 LEU HD23 H 2.077 -3.266 -2.362 1.00 . A A . 9 LEU HD23 1 1
34 6691 1 1 9 LEU HG H 2.495 -1.841 -0.337 1.00 . A A . 9 LEU HG 1 1
34 6692 1 1 9 LEU N N -0.036 -1.009 2.192 1.00 . A A . 9 LEU N 1 1
34 6693 1 1 9 LEU O O 1.416 2.006 0.703 1.00 . A A . 9 LEU O 1 1
34 6694 1 1 10 ILE C C -0.744 4.030 2.829 1.00 . A A . 10 ILE C 1 1
34 6695 1 1 10 ILE CA C -0.952 3.342 1.439 1.00 . A A . 10 ILE CA 1 1
34 6696 1 1 10 ILE CB C -2.304 3.609 0.677 1.00 . A A . 10 ILE CB 1 1
34 6697 1 1 10 ILE CD1 C -2.537 6.244 0.971 1.00 . A A . 10 ILE CD1 1 1
34 6698 1 1 10 ILE CG1 C -2.434 5.026 0.038 1.00 . A A . 10 ILE CG1 1 1
34 6699 1 1 10 ILE CG2 C -3.600 3.184 1.414 1.00 . A A . 10 ILE CG2 1 1
34 6700 1 1 10 ILE H H -1.336 1.258 2.023 1.00 . A A . 10 ILE H 1 1
34 6701 1 1 10 ILE HA H -0.191 3.804 0.777 1.00 . A A . 10 ILE HA 1 1
34 6702 1 1 10 ILE HB H -2.272 2.949 -0.214 1.00 . A A . 10 ILE HB 1 1
34 6703 1 1 10 ILE HD11 H -1.609 6.401 1.548 1.00 . A A . 10 ILE HD11 1 1
34 6704 1 1 10 ILE HD12 H -2.713 7.169 0.393 1.00 . A A . 10 ILE HD12 1 1
34 6705 1 1 10 ILE HD13 H -3.370 6.145 1.691 1.00 . A A . 10 ILE HD13 1 1
34 6706 1 1 10 ILE HG12 H -1.580 5.193 -0.646 1.00 . A A . 10 ILE HG12 1 1
34 6707 1 1 10 ILE HG13 H -3.316 5.032 -0.629 1.00 . A A . 10 ILE HG13 1 1
34 6708 1 1 10 ILE HG21 H -3.544 2.140 1.772 1.00 . A A . 10 ILE HG21 1 1
34 6709 1 1 10 ILE HG22 H -3.815 3.817 2.293 1.00 . A A . 10 ILE HG22 1 1
34 6710 1 1 10 ILE HG23 H -4.483 3.247 0.751 1.00 . A A . 10 ILE HG23 1 1
34 6711 1 1 10 ILE N N -0.694 1.871 1.505 1.00 . A A . 10 ILE N 1 1
34 6712 1 1 10 ILE O O -1.692 4.481 3.478 1.00 . A A . 10 ILE O 1 1
34 6713 1 1 11 GLU C C 1.629 6.162 4.404 1.00 . A A . 11 GLU C 1 1
34 6714 1 1 11 GLU CA C 0.913 4.774 4.553 1.00 . A A . 11 GLU CA 1 1
34 6715 1 1 11 GLU CB C 1.739 3.803 5.441 1.00 . A A . 11 GLU CB 1 1
34 6716 1 1 11 GLU CD C 1.687 1.814 7.096 1.00 . A A . 11 GLU CD 1 1
34 6717 1 1 11 GLU CG C 0.892 2.697 6.122 1.00 . A A . 11 GLU CG 1 1
34 6718 1 1 11 GLU H H 1.142 3.426 2.808 1.00 . A A . 11 GLU H 1 1
34 6719 1 1 11 GLU HA H 0.002 5.008 5.137 1.00 . A A . 11 GLU HA 1 1
34 6720 1 1 11 GLU HB2 H 2.566 3.352 4.860 1.00 . A A . 11 GLU HB2 1 1
34 6721 1 1 11 GLU HB3 H 2.240 4.372 6.248 1.00 . A A . 11 GLU HB3 1 1
34 6722 1 1 11 GLU HG2 H 0.075 3.185 6.688 1.00 . A A . 11 GLU HG2 1 1
34 6723 1 1 11 GLU HG3 H 0.375 2.077 5.368 1.00 . A A . 11 GLU HG3 1 1
34 6724 1 1 11 GLU N N 0.527 4.110 3.267 1.00 . A A . 11 GLU N 1 1
34 6725 1 1 11 GLU O O 1.653 6.900 5.394 1.00 . A A . 11 GLU O 1 1
34 6726 1 1 11 GLU OE1 O 1.512 1.934 8.311 1.00 . A A . 11 GLU OE1 1 1
34 6727 1 1 12 THR C C 2.349 8.439 1.701 1.00 . A A . 12 THR C 1 1
34 6728 1 1 12 THR CA C 2.897 7.840 3.034 1.00 . A A . 12 THR CA 1 1
34 6729 1 1 12 THR CB C 4.445 7.673 3.150 1.00 . A A . 12 THR CB 1 1
34 6730 1 1 12 THR CG2 C 5.243 8.977 2.993 1.00 . A A . 12 THR CG2 1 1
34 6731 1 1 12 THR H H 2.027 5.924 2.436 1.00 . A A . 12 THR H 1 1
34 6732 1 1 12 THR HA H 2.598 8.549 3.832 1.00 . A A . 12 THR HA 1 1
34 6733 1 1 12 THR HB H 4.781 6.962 2.376 1.00 . A A . 12 THR HB 1 1
34 6734 1 1 12 THR HG1 H 5.751 7.094 4.443 1.00 . A A . 12 THR HG1 1 1
34 6735 1 1 12 THR HG21 H 4.959 9.727 3.755 1.00 . A A . 12 THR HG21 1 1
34 6736 1 1 12 THR HG22 H 6.331 8.800 3.095 1.00 . A A . 12 THR HG22 1 1
34 6737 1 1 12 THR HG23 H 5.088 9.437 2.002 1.00 . A A . 12 THR HG23 1 1
34 6738 1 1 12 THR N N 2.206 6.536 3.237 1.00 . A A . 12 THR N 1 1
34 6739 1 1 12 THR O O 1.503 9.335 1.765 1.00 . A A . 12 THR O 1 1
34 6740 1 1 12 THR OG1 O 4.792 7.132 4.422 1.00 . A A . 12 THR OG1 1 1
34 6741 1 1 13 THR C C 1.533 7.335 -1.539 1.00 . A A . 13 THR C 1 1
34 6742 1 1 13 THR CA C 2.330 8.458 -0.805 1.00 . A A . 13 THR CA 1 1
34 6743 1 1 13 THR CB C 3.481 9.110 -1.638 1.00 . A A . 13 THR CB 1 1
34 6744 1 1 13 THR CG2 C 4.007 10.441 -1.075 1.00 . A A . 13 THR CG2 1 1
34 6745 1 1 13 THR H H 3.578 7.294 0.582 1.00 . A A . 13 THR H 1 1
34 6746 1 1 13 THR HA H 1.590 9.269 -0.658 1.00 . A A . 13 THR HA 1 1
34 6747 1 1 13 THR HB H 3.085 9.324 -2.647 1.00 . A A . 13 THR HB 1 1
34 6748 1 1 13 THR HG1 H 5.267 8.722 -2.243 1.00 . A A . 13 THR HG1 1 1
34 6749 1 1 13 THR HG21 H 4.774 10.884 -1.737 1.00 . A A . 13 THR HG21 1 1
34 6750 1 1 13 THR HG22 H 3.198 11.187 -0.970 1.00 . A A . 13 THR HG22 1 1
34 6751 1 1 13 THR HG23 H 4.469 10.314 -0.081 1.00 . A A . 13 THR HG23 1 1
34 6752 1 1 13 THR N N 2.800 7.957 0.519 1.00 . A A . 13 THR N 1 1
34 6753 1 1 13 THR O O 0.299 7.358 -1.496 1.00 . A A . 13 THR O 1 1
34 6754 1 1 13 THR OG1 O 4.585 8.224 -1.785 1.00 . A A . 13 THR OG1 1 1
34 6755 1 1 14 ALA C C 1.222 4.037 -2.030 1.00 . A A . 14 ALA C 1 1
34 6756 1 1 14 ALA CA C 1.535 5.258 -2.924 1.00 . A A . 14 ALA CA 1 1
34 6757 1 1 14 ALA CB C 2.403 4.869 -4.134 1.00 . A A . 14 ALA CB 1 1
34 6758 1 1 14 ALA H H 3.228 6.453 -2.156 1.00 . A A . 14 ALA H 1 1
34 6759 1 1 14 ALA HXT H 2.088 2.800 -0.820 1.00 . A A . 14 ALA HXT 1 1
34 6760 1 1 14 ALA HA H 0.572 5.621 -3.334 1.00 . A A . 14 ALA HA 1 1
34 6761 1 1 14 ALA HB1 H 3.394 4.481 -3.834 1.00 . A A . 14 ALA HB1 1 1
34 6762 1 1 14 ALA HB2 H 1.919 4.085 -4.745 1.00 . A A . 14 ALA HB2 1 1
34 6763 1 1 14 ALA HB3 H 2.579 5.730 -4.806 1.00 . A A . 14 ALA HB3 1 1
34 6764 1 1 14 ALA N N 2.206 6.360 -2.186 1.00 . A A . 14 ALA N 1 1
34 6765 1 1 14 ALA O O 0.092 3.563 -1.914 1.00 . A A . 14 ALA O 1 1
34 6766 1 1 14 ALA OXT O 2.327 3.533 -1.397 1.00 . A A . 14 ALA OXT 1 1
35 6767 1 1 1 ACE C C 6.847 -2.282 -1.498 1.00 . A A . 1 ACE C 1 1
35 6768 1 1 1 ACE CH3 C 7.727 -2.424 -2.736 1.00 . A A . 1 ACE CH3 1 1
35 6769 1 1 1 ACE H1 H 8.677 -2.939 -2.502 1.00 . A A . 1 ACE H1 1 1
35 6770 1 1 1 ACE H2 H 7.218 -3.017 -3.519 1.00 . A A . 1 ACE H2 1 1
35 6771 1 1 1 ACE H3 H 7.970 -1.440 -3.177 1.00 . A A . 1 ACE H3 1 1
35 6772 1 1 1 ACE O O 5.733 -2.807 -1.461 1.00 . A A . 1 ACE O 1 1
35 6773 1 1 2 ILE C C 7.021 0.172 1.139 1.00 . A A . 2 ILE C 1 1
35 6774 1 1 2 ILE CA C 6.697 -1.317 0.798 1.00 . A A . 2 ILE CA 1 1
35 6775 1 1 2 ILE CB C 7.000 -2.361 1.942 1.00 . A A . 2 ILE CB 1 1
35 6776 1 1 2 ILE CD1 C 8.639 -1.601 3.834 1.00 . A A . 2 ILE CD1 1 1
35 6777 1 1 2 ILE CG1 C 8.428 -2.458 2.573 1.00 . A A . 2 ILE CG1 1 1
35 6778 1 1 2 ILE CG2 C 6.489 -3.780 1.589 1.00 . A A . 2 ILE CG2 1 1
35 6779 1 1 2 ILE H H 8.239 -1.075 -0.722 1.00 . A A . 2 ILE H 1 1
35 6780 1 1 2 ILE HA H 5.602 -1.396 0.650 1.00 . A A . 2 ILE HA 1 1
35 6781 1 1 2 ILE HB H 6.342 -2.040 2.755 1.00 . A A . 2 ILE HB 1 1
35 6782 1 1 2 ILE HD11 H 7.945 -1.895 4.644 1.00 . A A . 2 ILE HD11 1 1
35 6783 1 1 2 ILE HD12 H 9.665 -1.720 4.230 1.00 . A A . 2 ILE HD12 1 1
35 6784 1 1 2 ILE HD13 H 8.486 -0.523 3.655 1.00 . A A . 2 ILE HD13 1 1
35 6785 1 1 2 ILE HG12 H 8.651 -3.497 2.895 1.00 . A A . 2 ILE HG12 1 1
35 6786 1 1 2 ILE HG13 H 9.209 -2.230 1.829 1.00 . A A . 2 ILE HG13 1 1
35 6787 1 1 2 ILE HG21 H 5.434 -3.767 1.257 1.00 . A A . 2 ILE HG21 1 1
35 6788 1 1 2 ILE HG22 H 7.081 -4.242 0.778 1.00 . A A . 2 ILE HG22 1 1
35 6789 1 1 2 ILE HG23 H 6.537 -4.464 2.455 1.00 . A A . 2 ILE HG23 1 1
35 6790 1 1 2 ILE N N 7.387 -1.583 -0.490 1.00 . A A . 2 ILE N 1 1
35 6791 1 1 2 ILE O O 8.178 0.490 1.438 1.00 . A A . 2 ILE O 1 1
35 6792 1 1 3 TRP C C 6.092 2.745 2.931 1.00 . A A . 3 TRP C 1 1
35 6793 1 1 3 TRP CA C 6.271 2.545 1.396 1.00 . A A . 3 TRP CA 1 1
35 6794 1 1 3 TRP CB C 5.376 3.501 0.551 1.00 . A A . 3 TRP CB 1 1
35 6795 1 1 3 TRP CD1 C 6.086 3.347 -1.960 1.00 . A A . 3 TRP CD1 1 1
35 6796 1 1 3 TRP CD2 C 6.793 5.172 -0.915 1.00 . A A . 3 TRP CD2 1 1
35 6797 1 1 3 TRP CE2 C 7.232 5.195 -2.263 1.00 . A A . 3 TRP CE2 1 1
35 6798 1 1 3 TRP CE3 C 7.168 6.208 -0.022 1.00 . A A . 3 TRP CE3 1 1
35 6799 1 1 3 TRP CG C 6.051 4.016 -0.727 1.00 . A A . 3 TRP CG 1 1
35 6800 1 1 3 TRP CH2 C 8.378 7.284 -1.842 1.00 . A A . 3 TRP CH2 1 1
35 6801 1 1 3 TRP CZ2 C 8.034 6.264 -2.732 1.00 . A A . 3 TRP CZ2 1 1
35 6802 1 1 3 TRP CZ3 C 7.951 7.256 -0.508 1.00 . A A . 3 TRP CZ3 1 1
35 6803 1 1 3 TRP H H 5.141 0.786 0.681 1.00 . A A . 3 TRP H 1 1
35 6804 1 1 3 TRP HA H 7.321 2.815 1.150 1.00 . A A . 3 TRP HA 1 1
35 6805 1 1 3 TRP HB2 H 4.403 3.031 0.314 1.00 . A A . 3 TRP HB2 1 1
35 6806 1 1 3 TRP HB3 H 5.092 4.389 1.147 1.00 . A A . 3 TRP HB3 1 1
35 6807 1 1 3 TRP HD1 H 5.656 2.374 -2.114 1.00 . A A . 3 TRP HD1 1 1
35 6808 1 1 3 TRP HE1 H 6.999 3.792 -3.904 1.00 . A A . 3 TRP HE1 1 1
35 6809 1 1 3 TRP HE3 H 6.875 6.186 1.015 1.00 . A A . 3 TRP HE3 1 1
35 6810 1 1 3 TRP HH2 H 8.988 8.106 -2.187 1.00 . A A . 3 TRP HH2 1 1
35 6811 1 1 3 TRP HZ2 H 8.380 6.289 -3.755 1.00 . A A . 3 TRP HZ2 1 1
35 6812 1 1 3 TRP HZ3 H 8.243 8.053 0.161 1.00 . A A . 3 TRP HZ3 1 1
35 6813 1 1 3 TRP N N 6.039 1.105 1.058 1.00 . A A . 3 TRP N 1 1
35 6814 1 1 3 TRP NE1 N 6.800 4.066 -2.935 1.00 . A A . 3 TRP NE1 1 1
35 6815 1 1 3 TRP O O 5.031 3.135 3.431 1.00 . A A . 3 TRP O 1 1
35 6816 1 1 4 GLY C C 6.806 1.251 5.848 1.00 . A A . 4 GLY C 1 1
35 6817 1 1 4 GLY CA C 7.239 2.544 5.127 1.00 . A A . 4 GLY CA 1 1
35 6818 1 1 4 GLY H H 7.901 1.988 3.076 1.00 . A A . 4 GLY H 1 1
35 6819 1 1 4 GLY HA2 H 8.283 2.772 5.413 1.00 . A A . 4 GLY HA2 1 1
35 6820 1 1 4 GLY HA3 H 6.654 3.412 5.491 1.00 . A A . 4 GLY HA3 1 1
35 6821 1 1 4 GLY N N 7.183 2.443 3.652 1.00 . A A . 4 GLY N 1 1
35 6822 1 1 4 GLY O O 7.646 0.478 6.315 1.00 . A A . 4 GLY O 1 1
35 6823 1 1 5 . C C 3.571 0.294 7.360 1.00 . A A . 5 SET C 1 1
35 6824 1 1 5 . CA C 4.861 -0.134 6.593 1.00 . A A . 5 SET CA 1 1
35 6825 1 1 5 . CB C 4.590 -1.309 5.602 1.00 . A A . 5 SET CB 1 1
35 6826 1 1 5 . H H 4.921 1.756 5.445 1.00 . A A . 5 SET H 1 1
35 6827 1 1 5 . HA H 5.556 -0.483 7.383 1.00 . A A . 5 SET HA 1 1
35 6828 1 1 5 . HB2 H 3.109 -0.590 7.839 1.00 . A A . 5 SET HB2 1 1
35 6829 1 1 5 . HB3 H 3.881 0.938 8.209 1.00 . A A . 5 SET HB3 1 1
35 6830 1 1 5 . HNT2 H 2.560 0.957 5.517 1.00 . A A . 5 SET HNT2 1 1
35 6831 1 1 5 . N N 5.484 1.048 5.930 1.00 . A A . 5 SET N 1 1
35 6832 1 1 5 . NT N 2.541 0.990 6.544 1.00 . A A . 5 SET NT 1 1
35 6833 1 1 5 . OG O 4.041 -1.108 4.511 1.00 . A A . 5 SET OG 1 1
35 6834 1 1 6 SER C C 3.304 -4.311 5.428 1.00 . A A . 6 SER C 1 1
35 6835 1 1 6 SER CA C 4.748 -3.769 5.197 1.00 . A A . 6 SER CA 1 1
35 6836 1 1 6 SER CB C 5.831 -4.802 5.581 1.00 . A A . 6 SER CB 1 1
35 6837 1 1 6 SER H H 5.410 -2.589 6.929 1.00 . A A . 6 SER H 1 1
35 6838 1 1 6 SER HA H 4.897 -3.521 4.128 1.00 . A A . 6 SER HA 1 1
35 6839 1 1 6 SER HB2 H 6.843 -4.367 5.476 1.00 . A A . 6 SER HB2 1 1
35 6840 1 1 6 SER HB3 H 5.737 -5.104 6.642 1.00 . A A . 6 SER HB3 1 1
35 6841 1 1 6 SER HG H 5.961 -5.678 3.865 1.00 . A A . 6 SER HG 1 1
35 6842 1 1 6 SER N N 4.962 -2.540 6.008 1.00 . A A . 6 SER N 1 1
35 6843 1 1 6 SER O O 2.841 -4.409 6.572 1.00 . A A . 6 SER O 1 1
35 6844 1 1 6 SER OG O 5.748 -5.961 4.757 1.00 . A A . 6 SER OG 1 1
35 6845 1 1 7 GLY C C 0.218 -4.055 3.969 1.00 . A A . 7 GLY C 1 1
35 6846 1 1 7 GLY CA C 1.200 -5.158 4.412 1.00 . A A . 7 GLY CA 1 1
35 6847 1 1 7 GLY H H 3.090 -4.545 3.442 1.00 . A A . 7 GLY H 1 1
35 6848 1 1 7 GLY HA2 H 1.094 -6.032 3.742 1.00 . A A . 7 GLY HA2 1 1
35 6849 1 1 7 GLY HA3 H 0.931 -5.535 5.419 1.00 . A A . 7 GLY HA3 1 1
35 6850 1 1 7 GLY N N 2.603 -4.668 4.336 1.00 . A A . 7 GLY N 1 1
35 6851 1 1 7 GLY O O -0.412 -4.173 2.915 1.00 . A A . 7 GLY O 1 1
35 6852 1 1 8 LYS C C 0.135 -0.864 3.646 1.00 . A A . 8 LYS C 1 1
35 6853 1 1 8 LYS CA C -0.758 -1.815 4.498 1.00 . A A . 8 LYS CA 1 1
35 6854 1 1 8 LYS CB C -1.230 -1.229 5.853 1.00 . A A . 8 LYS CB 1 1
35 6855 1 1 8 LYS CD C -2.879 0.332 7.089 1.00 . A A . 8 LYS CD 1 1
35 6856 1 1 8 LYS CE C -1.935 1.161 7.983 1.00 . A A . 8 LYS CE 1 1
35 6857 1 1 8 LYS CG C -2.273 -0.095 5.735 1.00 . A A . 8 LYS CG 1 1
35 6858 1 1 8 LYS H H 0.756 -2.967 5.565 1.00 . A A . 8 LYS H 1 1
35 6859 1 1 8 LYS HA H -1.660 -2.129 3.933 1.00 . A A . 8 LYS HA 1 1
35 6860 1 1 8 LYS HB2 H -1.676 -2.041 6.459 1.00 . A A . 8 LYS HB2 1 1
35 6861 1 1 8 LYS HB3 H -0.359 -0.874 6.438 1.00 . A A . 8 LYS HB3 1 1
35 6862 1 1 8 LYS HD2 H -3.792 0.920 6.882 1.00 . A A . 8 LYS HD2 1 1
35 6863 1 1 8 LYS HD3 H -3.228 -0.571 7.629 1.00 . A A . 8 LYS HD3 1 1
35 6864 1 1 8 LYS HE2 H -0.997 0.607 8.184 1.00 . A A . 8 LYS HE2 1 1
35 6865 1 1 8 LYS HE3 H -1.636 2.086 7.456 1.00 . A A . 8 LYS HE3 1 1
35 6866 1 1 8 LYS HG2 H -1.839 0.780 5.214 1.00 . A A . 8 LYS HG2 1 1
35 6867 1 1 8 LYS HG3 H -3.100 -0.439 5.084 1.00 . A A . 8 LYS HG3 1 1
35 6868 1 1 8 LYS HZ1 H -2.848 0.681 9.799 1.00 . A A . 8 LYS HZ1 1 1
35 6869 1 1 8 LYS HZ2 H -1.962 2.070 9.865 1.00 . A A . 8 LYS HZ2 1 1
35 6870 1 1 8 LYS HZ3 H -3.435 2.064 9.122 1.00 . A A . 8 LYS HZ3 1 1
35 6871 1 1 8 LYS N N 0.094 -2.992 4.790 1.00 . A A . 8 LYS N 1 1
35 6872 1 1 8 LYS NZ N -2.580 1.514 9.262 1.00 . A A . 8 LYS NZ 1 1
35 6873 1 1 8 LYS O O 0.918 -0.061 4.159 1.00 . A A . 8 LYS O 1 1
35 6874 1 1 9 LEU C C 0.543 1.290 1.204 1.00 . A A . 9 LEU C 1 1
35 6875 1 1 9 LEU CA C 0.813 -0.241 1.330 1.00 . A A . 9 LEU CA 1 1
35 6876 1 1 9 LEU CB C 0.801 -0.935 -0.072 1.00 . A A . 9 LEU CB 1 1
35 6877 1 1 9 LEU CD1 C 1.270 -2.866 -1.660 1.00 . A A . 9 LEU CD1 1 1
35 6878 1 1 9 LEU CD2 C 2.944 -2.363 0.148 1.00 . A A . 9 LEU CD2 1 1
35 6879 1 1 9 LEU CG C 1.450 -2.346 -0.220 1.00 . A A . 9 LEU CG 1 1
35 6880 1 1 9 LEU H H -0.678 -1.737 2.090 1.00 . A A . 9 LEU H 1 1
35 6881 1 1 9 LEU HA H 1.863 -0.294 1.680 1.00 . A A . 9 LEU HA 1 1
35 6882 1 1 9 LEU HB2 H -0.241 -0.982 -0.444 1.00 . A A . 9 LEU HB2 1 1
35 6883 1 1 9 LEU HB3 H 1.317 -0.276 -0.802 1.00 . A A . 9 LEU HB3 1 1
35 6884 1 1 9 LEU HD11 H 1.771 -2.219 -2.404 1.00 . A A . 9 LEU HD11 1 1
35 6885 1 1 9 LEU HD12 H 1.682 -3.885 -1.782 1.00 . A A . 9 LEU HD12 1 1
35 6886 1 1 9 LEU HD13 H 0.202 -2.922 -1.942 1.00 . A A . 9 LEU HD13 1 1
35 6887 1 1 9 LEU HD21 H 3.111 -2.126 1.215 1.00 . A A . 9 LEU HD21 1 1
35 6888 1 1 9 LEU HD22 H 3.397 -3.357 -0.024 1.00 . A A . 9 LEU HD22 1 1
35 6889 1 1 9 LEU HD23 H 3.521 -1.631 -0.449 1.00 . A A . 9 LEU HD23 1 1
35 6890 1 1 9 LEU HG H 0.943 -3.074 0.439 1.00 . A A . 9 LEU HG 1 1
35 6891 1 1 9 LEU N N 0.006 -1.011 2.320 1.00 . A A . 9 LEU N 1 1
35 6892 1 1 9 LEU O O 1.484 1.993 0.825 1.00 . A A . 9 LEU O 1 1
35 6893 1 1 10 ILE C C -0.680 4.078 2.722 1.00 . A A . 10 ILE C 1 1
35 6894 1 1 10 ILE CA C -0.938 3.299 1.385 1.00 . A A . 10 ILE CA 1 1
35 6895 1 1 10 ILE CB C -2.312 3.505 0.646 1.00 . A A . 10 ILE CB 1 1
35 6896 1 1 10 ILE CD1 C -2.438 6.157 0.656 1.00 . A A . 10 ILE CD1 1 1
35 6897 1 1 10 ILE CG1 C -2.439 4.842 -0.141 1.00 . A A . 10 ILE CG1 1 1
35 6898 1 1 10 ILE CG2 C -3.582 3.190 1.476 1.00 . A A . 10 ILE CG2 1 1
35 6899 1 1 10 ILE H H -1.337 1.211 1.973 1.00 . A A . 10 ILE H 1 1
35 6900 1 1 10 ILE HA H -0.199 3.727 0.677 1.00 . A A . 10 ILE HA 1 1
35 6901 1 1 10 ILE HB H -2.332 2.753 -0.170 1.00 . A A . 10 ILE HB 1 1
35 6902 1 1 10 ILE HD11 H -1.469 6.333 1.156 1.00 . A A . 10 ILE HD11 1 1
35 6903 1 1 10 ILE HD12 H -2.616 7.023 -0.007 1.00 . A A . 10 ILE HD12 1 1
35 6904 1 1 10 ILE HD13 H -3.225 6.170 1.432 1.00 . A A . 10 ILE HD13 1 1
35 6905 1 1 10 ILE HG12 H -1.625 4.897 -0.889 1.00 . A A . 10 ILE HG12 1 1
35 6906 1 1 10 ILE HG13 H -3.363 4.813 -0.750 1.00 . A A . 10 ILE HG13 1 1
35 6907 1 1 10 ILE HG21 H -3.523 2.194 1.953 1.00 . A A . 10 ILE HG21 1 1
35 6908 1 1 10 ILE HG22 H -3.757 3.926 2.282 1.00 . A A . 10 ILE HG22 1 1
35 6909 1 1 10 ILE HG23 H -4.490 3.186 0.844 1.00 . A A . 10 ILE HG23 1 1
35 6910 1 1 10 ILE N N -0.662 1.833 1.513 1.00 . A A . 10 ILE N 1 1
35 6911 1 1 10 ILE O O -1.585 4.680 3.308 1.00 . A A . 10 ILE O 1 1
35 6912 1 1 11 GLU C C 1.825 6.119 4.168 1.00 . A A . 11 GLU C 1 1
35 6913 1 1 11 GLU CA C 1.022 4.792 4.418 1.00 . A A . 11 GLU CA 1 1
35 6914 1 1 11 GLU CB C 1.808 3.831 5.351 1.00 . A A . 11 GLU CB 1 1
35 6915 1 1 11 GLU CD C 1.705 1.900 7.066 1.00 . A A . 11 GLU CD 1 1
35 6916 1 1 11 GLU CG C 0.927 2.781 6.074 1.00 . A A . 11 GLU CG 1 1
35 6917 1 1 11 GLU H H 1.145 3.308 2.778 1.00 . A A . 11 GLU H 1 1
35 6918 1 1 11 GLU HA H 0.133 5.111 4.995 1.00 . A A . 11 GLU HA 1 1
35 6919 1 1 11 GLU HB2 H 2.623 3.331 4.792 1.00 . A A . 11 GLU HB2 1 1
35 6920 1 1 11 GLU HB3 H 2.325 4.417 6.136 1.00 . A A . 11 GLU HB3 1 1
35 6921 1 1 11 GLU HG2 H 0.131 3.315 6.629 1.00 . A A . 11 GLU HG2 1 1
35 6922 1 1 11 GLU HG3 H 0.383 2.154 5.345 1.00 . A A . 11 GLU HG3 1 1
35 6923 1 1 11 GLU N N 0.586 4.070 3.183 1.00 . A A . 11 GLU N 1 1
35 6924 1 1 11 GLU O O 1.928 6.914 5.107 1.00 . A A . 11 GLU O 1 1
35 6925 1 1 11 GLU OE1 O 1.561 2.070 8.279 1.00 . A A . 11 GLU OE1 1 1
35 6926 1 1 12 THR C C 2.677 8.104 1.265 1.00 . A A . 12 THR C 1 1
35 6927 1 1 12 THR CA C 3.168 7.611 2.661 1.00 . A A . 12 THR CA 1 1
35 6928 1 1 12 THR CB C 4.701 7.366 2.829 1.00 . A A . 12 THR CB 1 1
35 6929 1 1 12 THR CG2 C 5.574 8.604 2.566 1.00 . A A . 12 THR CG2 1 1
35 6930 1 1 12 THR H H 2.145 5.732 2.212 1.00 . A A . 12 THR H 1 1
35 6931 1 1 12 THR HA H 2.893 8.408 3.380 1.00 . A A . 12 THR HA 1 1
35 6932 1 1 12 THR HB H 5.011 6.565 2.136 1.00 . A A . 12 THR HB 1 1
35 6933 1 1 12 THR HG1 H 4.652 7.607 4.740 1.00 . A A . 12 THR HG1 1 1
35 6934 1 1 12 THR HG21 H 5.310 9.445 3.234 1.00 . A A . 12 THR HG21 1 1
35 6935 1 1 12 THR HG22 H 6.645 8.380 2.726 1.00 . A A . 12 THR HG22 1 1
35 6936 1 1 12 THR HG23 H 5.476 8.962 1.526 1.00 . A A . 12 THR HG23 1 1
35 6937 1 1 12 THR N N 2.396 6.375 2.968 1.00 . A A . 12 THR N 1 1
35 6938 1 1 12 THR O O 1.893 9.057 1.223 1.00 . A A . 12 THR O 1 1
35 6939 1 1 12 THR OG1 O 4.995 6.929 4.153 1.00 . A A . 12 THR OG1 1 1
35 6940 1 1 13 THR C C 1.959 6.666 -1.911 1.00 . A A . 13 THR C 1 1
35 6941 1 1 13 THR CA C 2.682 7.869 -1.230 1.00 . A A . 13 THR CA 1 1
35 6942 1 1 13 THR CB C 3.839 8.508 -2.061 1.00 . A A . 13 THR CB 1 1
35 6943 1 1 13 THR CG2 C 4.304 9.888 -1.567 1.00 . A A . 13 THR CG2 1 1
35 6944 1 1 13 THR H H 3.848 6.785 0.280 1.00 . A A . 13 THR H 1 1
35 6945 1 1 13 THR HA H 1.903 8.657 -1.170 1.00 . A A . 13 THR HA 1 1
35 6946 1 1 13 THR HB H 3.470 8.643 -3.092 1.00 . A A . 13 THR HB 1 1
35 6947 1 1 13 THR HG1 H 5.656 8.143 -2.585 1.00 . A A . 13 THR HG1 1 1
35 6948 1 1 13 THR HG21 H 5.078 10.314 -2.230 1.00 . A A . 13 THR HG21 1 1
35 6949 1 1 13 THR HG22 H 3.468 10.611 -1.535 1.00 . A A . 13 THR HG22 1 1
35 6950 1 1 13 THR HG23 H 4.735 9.838 -0.551 1.00 . A A . 13 THR HG23 1 1
35 6951 1 1 13 THR N N 3.107 7.477 0.144 1.00 . A A . 13 THR N 1 1
35 6952 1 1 13 THR O O 0.724 6.642 -1.914 1.00 . A A . 13 THR O 1 1
35 6953 1 1 13 THR OG1 O 4.974 7.652 -2.120 1.00 . A A . 13 THR OG1 1 1
35 6954 1 1 14 ALA C C 1.948 3.308 -2.167 1.00 . A A . 14 ALA C 1 1
35 6955 1 1 14 ALA CA C 2.094 4.498 -3.139 1.00 . A A . 14 ALA CA 1 1
35 6956 1 1 14 ALA CB C 2.958 4.145 -4.363 1.00 . A A . 14 ALA CB 1 1
35 6957 1 1 14 ALA H H 3.709 5.811 -2.402 1.00 . A A . 14 ALA H 1 1
35 6958 1 1 14 ALA HXT H 0.588 2.417 -1.122 1.00 . A A . 14 ALA HXT 1 1
35 6959 1 1 14 ALA HA H 1.090 4.756 -3.532 1.00 . A A . 14 ALA HA 1 1
35 6960 1 1 14 ALA HB1 H 3.993 3.870 -4.085 1.00 . A A . 14 ALA HB1 1 1
35 6961 1 1 14 ALA HB2 H 2.535 3.291 -4.923 1.00 . A A . 14 ALA HB2 1 1
35 6962 1 1 14 ALA HB3 H 3.024 4.989 -5.077 1.00 . A A . 14 ALA HB3 1 1
35 6963 1 1 14 ALA N N 2.693 5.673 -2.459 1.00 . A A . 14 ALA N 1 1
35 6964 1 1 14 ALA O O 2.878 2.588 -1.805 1.00 . A A . 14 ALA O 1 1
35 6965 1 1 14 ALA OXT O 0.654 3.142 -1.748 1.00 . A A . 14 ALA OXT 1 1
36 6966 1 1 1 ACE C C 8.467 8.005 3.437 1.00 . A A . 1 ACE C 1 1
36 6967 1 1 1 ACE CH3 C 9.157 9.349 3.232 1.00 . A A . 1 ACE CH3 1 1
36 6968 1 1 1 ACE H1 H 8.899 10.060 4.038 1.00 . A A . 1 ACE H1 1 1
36 6969 1 1 1 ACE H2 H 10.258 9.243 3.207 1.00 . A A . 1 ACE H2 1 1
36 6970 1 1 1 ACE H3 H 8.850 9.812 2.277 1.00 . A A . 1 ACE H3 1 1
36 6971 1 1 1 ACE O O 7.646 7.593 2.614 1.00 . A A . 1 ACE O 1 1
36 6972 1 1 2 ILE C C 7.209 6.293 6.053 1.00 . A A . 2 ILE C 1 1
36 6973 1 1 2 ILE CA C 8.237 6.011 4.914 1.00 . A A . 2 ILE CA 1 1
36 6974 1 1 2 ILE CB C 9.334 4.927 5.233 1.00 . A A . 2 ILE CB 1 1
36 6975 1 1 2 ILE CD1 C 9.706 4.135 2.732 1.00 . A A . 2 ILE CD1 1 1
36 6976 1 1 2 ILE CG1 C 10.319 4.625 4.058 1.00 . A A . 2 ILE CG1 1 1
36 6977 1 1 2 ILE CG2 C 8.752 3.587 5.758 1.00 . A A . 2 ILE CG2 1 1
36 6978 1 1 2 ILE H H 9.391 7.896 5.195 1.00 . A A . 2 ILE H 1 1
36 6979 1 1 2 ILE HA H 7.677 5.593 4.053 1.00 . A A . 2 ILE HA 1 1
36 6980 1 1 2 ILE HB H 9.954 5.321 6.063 1.00 . A A . 2 ILE HB 1 1
36 6981 1 1 2 ILE HD11 H 10.493 3.924 1.985 1.00 . A A . 2 ILE HD11 1 1
36 6982 1 1 2 ILE HD12 H 9.124 3.204 2.861 1.00 . A A . 2 ILE HD12 1 1
36 6983 1 1 2 ILE HD13 H 9.033 4.889 2.285 1.00 . A A . 2 ILE HD13 1 1
36 6984 1 1 2 ILE HG12 H 10.918 5.529 3.843 1.00 . A A . 2 ILE HG12 1 1
36 6985 1 1 2 ILE HG13 H 11.068 3.878 4.388 1.00 . A A . 2 ILE HG13 1 1
36 6986 1 1 2 ILE HG21 H 9.549 2.864 6.014 1.00 . A A . 2 ILE HG21 1 1
36 6987 1 1 2 ILE HG22 H 8.153 3.724 6.676 1.00 . A A . 2 ILE HG22 1 1
36 6988 1 1 2 ILE HG23 H 8.095 3.097 5.016 1.00 . A A . 2 ILE HG23 1 1
36 6989 1 1 2 ILE N N 8.821 7.339 4.547 1.00 . A A . 2 ILE N 1 1
36 6990 1 1 2 ILE O O 7.550 6.290 7.240 1.00 . A A . 2 ILE O 1 1
36 6991 1 1 3 TRP C C 4.134 5.621 7.293 1.00 . A A . 3 TRP C 1 1
36 6992 1 1 3 TRP CA C 4.828 6.834 6.603 1.00 . A A . 3 TRP CA 1 1
36 6993 1 1 3 TRP CB C 3.805 7.778 5.910 1.00 . A A . 3 TRP CB 1 1
36 6994 1 1 3 TRP CD1 C 4.636 9.642 4.241 1.00 . A A . 3 TRP CD1 1 1
36 6995 1 1 3 TRP CD2 C 4.704 10.194 6.393 1.00 . A A . 3 TRP CD2 1 1
36 6996 1 1 3 TRP CE2 C 5.179 11.275 5.612 1.00 . A A . 3 TRP CE2 1 1
36 6997 1 1 3 TRP CE3 C 4.690 10.277 7.807 1.00 . A A . 3 TRP CE3 1 1
36 6998 1 1 3 TRP CG C 4.353 9.166 5.540 1.00 . A A . 3 TRP CG 1 1
36 6999 1 1 3 TRP CH2 C 5.601 12.530 7.638 1.00 . A A . 3 TRP CH2 1 1
36 7000 1 1 3 TRP CZ2 C 5.633 12.459 6.243 1.00 . A A . 3 TRP CZ2 1 1
36 7001 1 1 3 TRP CZ3 C 5.138 11.455 8.407 1.00 . A A . 3 TRP CZ3 1 1
36 7002 1 1 3 TRP H H 5.857 6.670 4.641 1.00 . A A . 3 TRP H 1 1
36 7003 1 1 3 TRP HA H 5.259 7.388 7.447 1.00 . A A . 3 TRP HA 1 1
36 7004 1 1 3 TRP HB2 H 3.378 7.287 5.014 1.00 . A A . 3 TRP HB2 1 1
36 7005 1 1 3 TRP HB3 H 2.932 7.937 6.571 1.00 . A A . 3 TRP HB3 1 1
36 7006 1 1 3 TRP HD1 H 4.485 9.075 3.335 1.00 . A A . 3 TRP HD1 1 1
36 7007 1 1 3 TRP HE1 H 5.437 11.533 3.469 1.00 . A A . 3 TRP HE1 1 1
36 7008 1 1 3 TRP HE3 H 4.362 9.435 8.400 1.00 . A A . 3 TRP HE3 1 1
36 7009 1 1 3 TRP HH2 H 5.946 13.427 8.131 1.00 . A A . 3 TRP HH2 1 1
36 7010 1 1 3 TRP HZ2 H 6.003 13.289 5.660 1.00 . A A . 3 TRP HZ2 1 1
36 7011 1 1 3 TRP HZ3 H 5.136 11.534 9.485 1.00 . A A . 3 TRP HZ3 1 1
36 7012 1 1 3 TRP N N 5.947 6.530 5.655 1.00 . A A . 3 TRP N 1 1
36 7013 1 1 3 TRP NE1 N 5.144 10.954 4.264 1.00 . A A . 3 TRP NE1 1 1
36 7014 1 1 3 TRP O O 3.738 5.715 8.458 1.00 . A A . 3 TRP O 1 1
36 7015 1 1 4 GLY C C 3.308 2.222 5.953 1.00 . A A . 4 GLY C 1 1
36 7016 1 1 4 GLY CA C 3.358 3.277 7.070 1.00 . A A . 4 GLY CA 1 1
36 7017 1 1 4 GLY H H 4.517 4.555 5.708 1.00 . A A . 4 GLY H 1 1
36 7018 1 1 4 GLY HA2 H 3.928 2.900 7.939 1.00 . A A . 4 GLY HA2 1 1
36 7019 1 1 4 GLY HA3 H 2.333 3.495 7.421 1.00 . A A . 4 GLY HA3 1 1
36 7020 1 1 4 GLY N N 3.975 4.516 6.567 1.00 . A A . 4 GLY N 1 1
36 7021 1 1 4 GLY O O 2.234 1.970 5.402 1.00 . A A . 4 GLY O 1 1
36 7022 1 1 5 . C C 5.650 0.994 3.499 1.00 . A A . 5 SET C 1 1
36 7023 1 1 5 . CA C 4.570 0.582 4.562 1.00 . A A . 5 SET CA 1 1
36 7024 1 1 5 . CB C 4.956 -0.792 5.187 1.00 . A A . 5 SET CB 1 1
36 7025 1 1 5 . H H 5.281 1.912 6.177 1.00 . A A . 5 SET H 1 1
36 7026 1 1 5 . HA H 3.574 0.471 4.080 1.00 . A A . 5 SET HA 1 1
36 7027 1 1 5 . HB2 H 6.620 1.169 4.007 1.00 . A A . 5 SET HB2 1 1
36 7028 1 1 5 . HB3 H 5.856 0.115 2.860 1.00 . A A . 5 SET HB3 1 1
36 7029 1 1 5 . HNT2 H 5.262 1.949 1.546 1.00 . A A . 5 SET HNT2 1 1
36 7030 1 1 5 . N N 4.463 1.599 5.642 1.00 . A A . 5 SET N 1 1
36 7031 1 1 5 . NT N 5.386 2.115 2.555 1.00 . A A . 5 SET NT 1 1
36 7032 1 1 5 . OG O 6.113 -1.028 5.549 1.00 . A A . 5 SET OG 1 1
36 7033 1 1 6 SER C C 2.751 -3.786 5.707 1.00 . A A . 6 SER C 1 1
36 7034 1 1 6 SER CA C 4.116 -3.057 5.869 1.00 . A A . 6 SER CA 1 1
36 7035 1 1 6 SER CB C 4.576 -3.076 7.353 1.00 . A A . 6 SER CB 1 1
36 7036 1 1 6 SER H H 3.124 -1.372 4.788 1.00 . A A . 6 SER H 1 1
36 7037 1 1 6 SER HA H 4.890 -3.582 5.274 1.00 . A A . 6 SER HA 1 1
36 7038 1 1 6 SER HB2 H 5.519 -2.515 7.485 1.00 . A A . 6 SER HB2 1 1
36 7039 1 1 6 SER HB3 H 3.835 -2.573 8.006 1.00 . A A . 6 SER HB3 1 1
36 7040 1 1 6 SER HG H 5.060 -4.346 8.722 1.00 . A A . 6 SER HG 1 1
36 7041 1 1 6 SER N N 3.955 -1.680 5.307 1.00 . A A . 6 SER N 1 1
36 7042 1 1 6 SER O O 1.802 -3.458 6.431 1.00 . A A . 6 SER O 1 1
36 7043 1 1 6 SER OG O 4.783 -4.410 7.805 1.00 . A A . 6 SER OG 1 1
36 7044 1 1 7 GLY C C 0.379 -4.662 3.682 1.00 . A A . 7 GLY C 1 1
36 7045 1 1 7 GLY CA C 1.359 -5.494 4.539 1.00 . A A . 7 GLY CA 1 1
36 7046 1 1 7 GLY H H 3.502 -5.036 4.302 1.00 . A A . 7 GLY H 1 1
36 7047 1 1 7 GLY HA2 H 1.583 -6.439 4.012 1.00 . A A . 7 GLY HA2 1 1
36 7048 1 1 7 GLY HA3 H 0.891 -5.805 5.496 1.00 . A A . 7 GLY HA3 1 1
36 7049 1 1 7 GLY N N 2.636 -4.765 4.779 1.00 . A A . 7 GLY N 1 1
36 7050 1 1 7 GLY O O 0.240 -4.879 2.475 1.00 . A A . 7 GLY O 1 1
36 7051 1 1 8 LYS C C -0.316 -1.512 3.454 1.00 . A A . 8 LYS C 1 1
36 7052 1 1 8 LYS CA C -1.223 -2.746 3.735 1.00 . A A . 8 LYS CA 1 1
36 7053 1 1 8 LYS CB C -2.373 -2.477 4.738 1.00 . A A . 8 LYS CB 1 1
36 7054 1 1 8 LYS CD C -4.518 -1.134 5.283 1.00 . A A . 8 LYS CD 1 1
36 7055 1 1 8 LYS CE C -5.447 -2.287 5.709 1.00 . A A . 8 LYS CE 1 1
36 7056 1 1 8 LYS CG C -3.467 -1.516 4.220 1.00 . A A . 8 LYS CG 1 1
36 7057 1 1 8 LYS H H 0.093 -3.524 5.282 1.00 . A A . 8 LYS H 1 1
36 7058 1 1 8 LYS HA H -1.661 -3.158 2.803 1.00 . A A . 8 LYS HA 1 1
36 7059 1 1 8 LYS HB2 H -2.848 -3.440 5.008 1.00 . A A . 8 LYS HB2 1 1
36 7060 1 1 8 LYS HB3 H -1.959 -2.080 5.687 1.00 . A A . 8 LYS HB3 1 1
36 7061 1 1 8 LYS HD2 H -4.000 -0.711 6.166 1.00 . A A . 8 LYS HD2 1 1
36 7062 1 1 8 LYS HD3 H -5.122 -0.303 4.872 1.00 . A A . 8 LYS HD3 1 1
36 7063 1 1 8 LYS HE2 H -5.935 -2.735 4.821 1.00 . A A . 8 LYS HE2 1 1
36 7064 1 1 8 LYS HE3 H -4.861 -3.102 6.177 1.00 . A A . 8 LYS HE3 1 1
36 7065 1 1 8 LYS HG2 H -2.991 -0.583 3.865 1.00 . A A . 8 LYS HG2 1 1
36 7066 1 1 8 LYS HG3 H -3.962 -1.946 3.329 1.00 . A A . 8 LYS HG3 1 1
36 7067 1 1 8 LYS HZ1 H -7.105 -2.572 6.957 1.00 . A A . 8 LYS HZ1 1 1
36 7068 1 1 8 LYS HZ2 H -6.058 -1.422 7.511 1.00 . A A . 8 LYS HZ2 1 1
36 7069 1 1 8 LYS HZ3 H -7.065 -1.081 6.252 1.00 . A A . 8 LYS HZ3 1 1
36 7070 1 1 8 LYS N N -0.293 -3.713 4.355 1.00 . A A . 8 LYS N 1 1
36 7071 1 1 8 LYS NZ N -6.476 -1.816 6.660 1.00 . A A . 8 LYS NZ 1 1
36 7072 1 1 8 LYS O O -0.007 -0.715 4.348 1.00 . A A . 8 LYS O 1 1
36 7073 1 1 9 LEU C C 0.334 1.061 1.635 1.00 . A A . 9 LEU C 1 1
36 7074 1 1 9 LEU CA C 1.039 -0.325 1.735 1.00 . A A . 9 LEU CA 1 1
36 7075 1 1 9 LEU CB C 1.721 -0.723 0.389 1.00 . A A . 9 LEU CB 1 1
36 7076 1 1 9 LEU CD1 C 3.155 -2.256 -1.045 1.00 . A A . 9 LEU CD1 1 1
36 7077 1 1 9 LEU CD2 C 4.027 -1.560 1.210 1.00 . A A . 9 LEU CD2 1 1
36 7078 1 1 9 LEU CG C 2.760 -1.886 0.397 1.00 . A A . 9 LEU CG 1 1
36 7079 1 1 9 LEU H H -0.218 -2.166 1.598 1.00 . A A . 9 LEU H 1 1
36 7080 1 1 9 LEU HA H 1.859 -0.242 2.477 1.00 . A A . 9 LEU HA 1 1
36 7081 1 1 9 LEU HB2 H 0.925 -0.949 -0.348 1.00 . A A . 9 LEU HB2 1 1
36 7082 1 1 9 LEU HB3 H 2.226 0.170 -0.029 1.00 . A A . 9 LEU HB3 1 1
36 7083 1 1 9 LEU HD11 H 3.860 -3.109 -1.071 1.00 . A A . 9 LEU HD11 1 1
36 7084 1 1 9 LEU HD12 H 2.276 -2.558 -1.644 1.00 . A A . 9 LEU HD12 1 1
36 7085 1 1 9 LEU HD13 H 3.638 -1.414 -1.575 1.00 . A A . 9 LEU HD13 1 1
36 7086 1 1 9 LEU HD21 H 3.798 -1.401 2.277 1.00 . A A . 9 LEU HD21 1 1
36 7087 1 1 9 LEU HD22 H 4.764 -2.384 1.171 1.00 . A A . 9 LEU HD22 1 1
36 7088 1 1 9 LEU HD23 H 4.535 -0.649 0.840 1.00 . A A . 9 LEU HD23 1 1
36 7089 1 1 9 LEU HG H 2.307 -2.790 0.844 1.00 . A A . 9 LEU HG 1 1
36 7090 1 1 9 LEU N N 0.123 -1.404 2.192 1.00 . A A . 9 LEU N 1 1
36 7091 1 1 9 LEU O O -0.362 1.358 0.658 1.00 . A A . 9 LEU O 1 1
36 7092 1 1 10 ILE C C 1.171 4.218 3.065 1.00 . A A . 10 ILE C 1 1
36 7093 1 1 10 ILE CA C -0.031 3.266 2.762 1.00 . A A . 10 ILE CA 1 1
36 7094 1 1 10 ILE CB C -1.275 3.321 3.725 1.00 . A A . 10 ILE CB 1 1
36 7095 1 1 10 ILE CD1 C -2.780 4.942 2.350 1.00 . A A . 10 ILE CD1 1 1
36 7096 1 1 10 ILE CG1 C -2.044 4.672 3.671 1.00 . A A . 10 ILE CG1 1 1
36 7097 1 1 10 ILE CG2 C -0.997 2.943 5.204 1.00 . A A . 10 ILE CG2 1 1
36 7098 1 1 10 ILE H H 1.051 1.486 3.462 1.00 . A A . 10 ILE H 1 1
36 7099 1 1 10 ILE HA H -0.412 3.556 1.764 1.00 . A A . 10 ILE HA 1 1
36 7100 1 1 10 ILE HB H -1.984 2.549 3.363 1.00 . A A . 10 ILE HB 1 1
36 7101 1 1 10 ILE HD11 H -3.481 4.122 2.101 1.00 . A A . 10 ILE HD11 1 1
36 7102 1 1 10 ILE HD12 H -3.372 5.872 2.408 1.00 . A A . 10 ILE HD12 1 1
36 7103 1 1 10 ILE HD13 H -2.084 5.053 1.498 1.00 . A A . 10 ILE HD13 1 1
36 7104 1 1 10 ILE HG12 H -2.801 4.707 4.478 1.00 . A A . 10 ILE HG12 1 1
36 7105 1 1 10 ILE HG13 H -1.357 5.512 3.889 1.00 . A A . 10 ILE HG13 1 1
36 7106 1 1 10 ILE HG21 H -0.499 1.960 5.291 1.00 . A A . 10 ILE HG21 1 1
36 7107 1 1 10 ILE HG22 H -0.356 3.681 5.719 1.00 . A A . 10 ILE HG22 1 1
36 7108 1 1 10 ILE HG23 H -1.933 2.870 5.790 1.00 . A A . 10 ILE HG23 1 1
36 7109 1 1 10 ILE N N 0.532 1.890 2.676 1.00 . A A . 10 ILE N 1 1
36 7110 1 1 10 ILE O O 1.384 4.660 4.199 1.00 . A A . 10 ILE O 1 1
36 7111 1 1 11 GLU C C 2.842 6.951 1.929 1.00 . A A . 11 GLU C 1 1
36 7112 1 1 11 GLU CA C 3.155 5.420 2.122 1.00 . A A . 11 GLU CA 1 1
36 7113 1 1 11 GLU CB C 4.226 4.820 1.143 1.00 . A A . 11 GLU CB 1 1
36 7114 1 1 11 GLU CD C 5.588 3.405 2.892 1.00 . A A . 11 GLU CD 1 1
36 7115 1 1 11 GLU CG C 5.595 4.473 1.774 1.00 . A A . 11 GLU CG 1 1
36 7116 1 1 11 GLU H H 1.678 4.106 1.128 1.00 . A A . 11 GLU H 1 1
36 7117 1 1 11 GLU HA H 3.577 5.325 3.145 1.00 . A A . 11 GLU HA 1 1
36 7118 1 1 11 GLU HB2 H 3.873 3.905 0.626 1.00 . A A . 11 GLU HB2 1 1
36 7119 1 1 11 GLU HB3 H 4.406 5.514 0.300 1.00 . A A . 11 GLU HB3 1 1
36 7120 1 1 11 GLU HG2 H 6.297 4.160 0.979 1.00 . A A . 11 GLU HG2 1 1
36 7121 1 1 11 GLU HG3 H 6.042 5.403 2.174 1.00 . A A . 11 GLU HG3 1 1
36 7122 1 1 11 GLU N N 1.953 4.541 2.015 1.00 . A A . 11 GLU N 1 1
36 7123 1 1 11 GLU O O 3.555 7.667 1.221 1.00 . A A . 11 GLU O 1 1
36 7124 1 1 11 GLU OE1 O 5.768 3.774 4.053 1.00 . A A . 11 GLU OE1 1 1
36 7125 1 1 12 THR C C 0.706 9.174 3.946 1.00 . A A . 12 THR C 1 1
36 7126 1 1 12 THR CA C 1.332 8.874 2.546 1.00 . A A . 12 THR CA 1 1
36 7127 1 1 12 THR CB C 0.409 9.175 1.319 1.00 . A A . 12 THR CB 1 1
36 7128 1 1 12 THR CG2 C -0.005 10.652 1.199 1.00 . A A . 12 THR CG2 1 1
36 7129 1 1 12 THR H H 1.296 6.766 3.186 1.00 . A A . 12 THR H 1 1
36 7130 1 1 12 THR HA H 2.224 9.525 2.453 1.00 . A A . 12 THR HA 1 1
36 7131 1 1 12 THR HB H -0.509 8.561 1.387 1.00 . A A . 12 THR HB 1 1
36 7132 1 1 12 THR HG1 H 1.919 9.277 0.124 1.00 . A A . 12 THR HG1 1 1
36 7133 1 1 12 THR HG21 H -0.637 10.820 0.308 1.00 . A A . 12 THR HG21 1 1
36 7134 1 1 12 THR HG22 H -0.591 10.988 2.075 1.00 . A A . 12 THR HG22 1 1
36 7135 1 1 12 THR HG23 H 0.872 11.321 1.112 1.00 . A A . 12 THR HG23 1 1
36 7136 1 1 12 THR N N 1.783 7.454 2.600 1.00 . A A . 12 THR N 1 1
36 7137 1 1 12 THR O O 1.335 9.873 4.746 1.00 . A A . 12 THR O 1 1
36 7138 1 1 12 THR OG1 O 1.066 8.835 0.101 1.00 . A A . 12 THR OG1 1 1
36 7139 1 1 13 THR C C -0.663 7.750 6.548 1.00 . A A . 13 THR C 1 1
36 7140 1 1 13 THR CA C -1.172 8.857 5.570 1.00 . A A . 13 THR CA 1 1
36 7141 1 1 13 THR CB C -2.729 8.851 5.432 1.00 . A A . 13 THR CB 1 1
36 7142 1 1 13 THR CG2 C -3.466 9.268 6.718 1.00 . A A . 13 THR CG2 1 1
36 7143 1 1 13 THR H H -0.994 8.231 3.453 1.00 . A A . 13 THR H 1 1
36 7144 1 1 13 THR HA H -0.896 9.861 5.953 1.00 . A A . 13 THR HA 1 1
36 7145 1 1 13 THR HB H -3.084 7.837 5.160 1.00 . A A . 13 THR HB 1 1
36 7146 1 1 13 THR HG1 H -2.904 10.633 4.720 1.00 . A A . 13 THR HG1 1 1
36 7147 1 1 13 THR HG21 H -3.180 10.284 7.048 1.00 . A A . 13 THR HG21 1 1
36 7148 1 1 13 THR HG22 H -4.562 9.268 6.569 1.00 . A A . 13 THR HG22 1 1
36 7149 1 1 13 THR HG23 H -3.256 8.577 7.555 1.00 . A A . 13 THR HG23 1 1
36 7150 1 1 13 THR N N -0.506 8.654 4.251 1.00 . A A . 13 THR N 1 1
36 7151 1 1 13 THR O O -0.846 6.553 6.298 1.00 . A A . 13 THR O 1 1
36 7152 1 1 13 THR OG1 O -3.146 9.756 4.413 1.00 . A A . 13 THR OG1 1 1
36 7153 1 1 14 ALA C C -0.592 6.586 9.567 1.00 . A A . 14 ALA C 1 1
36 7154 1 1 14 ALA CA C 0.502 7.231 8.683 1.00 . A A . 14 ALA CA 1 1
36 7155 1 1 14 ALA CB C 1.550 7.975 9.532 1.00 . A A . 14 ALA CB 1 1
36 7156 1 1 14 ALA H H 0.064 9.183 7.753 1.00 . A A . 14 ALA H 1 1
36 7157 1 1 14 ALA HXT H -2.017 7.075 10.788 1.00 . A A . 14 ALA HXT 1 1
36 7158 1 1 14 ALA HA H 1.037 6.411 8.164 1.00 . A A . 14 ALA HA 1 1
36 7159 1 1 14 ALA HB1 H 2.023 7.302 10.270 1.00 . A A . 14 ALA HB1 1 1
36 7160 1 1 14 ALA HB2 H 2.367 8.378 8.908 1.00 . A A . 14 ALA HB2 1 1
36 7161 1 1 14 ALA HB3 H 1.115 8.824 10.093 1.00 . A A . 14 ALA HB3 1 1
36 7162 1 1 14 ALA N N -0.039 8.167 7.665 1.00 . A A . 14 ALA N 1 1
36 7163 1 1 14 ALA O O -0.765 5.369 9.640 1.00 . A A . 14 ALA O 1 1
36 7164 1 1 14 ALA OXT O -1.347 7.506 10.252 1.00 . A A . 14 ALA OXT 1 1
37 7165 1 1 1 ACE C C 7.830 8.287 3.309 1.00 . A A . 1 ACE C 1 1
37 7166 1 1 1 ACE CH3 C 8.401 9.685 3.094 1.00 . A A . 1 ACE CH3 1 1
37 7167 1 1 1 ACE H1 H 9.504 9.689 3.169 1.00 . A A . 1 ACE H1 1 1
37 7168 1 1 1 ACE H2 H 8.139 10.071 2.093 1.00 . A A . 1 ACE H2 1 1
37 7169 1 1 1 ACE H3 H 8.004 10.402 3.837 1.00 . A A . 1 ACE H3 1 1
37 7170 1 1 1 ACE O O 7.155 7.748 2.429 1.00 . A A . 1 ACE O 1 1
37 7171 1 1 2 ILE C C 6.527 6.572 5.953 1.00 . A A . 2 ILE C 1 1
37 7172 1 1 2 ILE CA C 7.636 6.361 4.876 1.00 . A A . 2 ILE CA 1 1
37 7173 1 1 2 ILE CB C 8.811 5.398 5.289 1.00 . A A . 2 ILE CB 1 1
37 7174 1 1 2 ILE CD1 C 9.400 4.562 2.843 1.00 . A A . 2 ILE CD1 1 1
37 7175 1 1 2 ILE CG1 C 9.884 5.159 4.180 1.00 . A A . 2 ILE CG1 1 1
37 7176 1 1 2 ILE CG2 C 8.330 4.023 5.826 1.00 . A A . 2 ILE CG2 1 1
37 7177 1 1 2 ILE H H 8.573 8.362 5.155 1.00 . A A . 2 ILE H 1 1
37 7178 1 1 2 ILE HA H 7.165 5.858 4.008 1.00 . A A . 2 ILE HA 1 1
37 7179 1 1 2 ILE HB H 9.343 5.874 6.136 1.00 . A A . 2 ILE HB 1 1
37 7180 1 1 2 ILE HD11 H 8.912 3.580 2.978 1.00 . A A . 2 ILE HD11 1 1
37 7181 1 1 2 ILE HD12 H 8.677 5.226 2.333 1.00 . A A . 2 ILE HD12 1 1
37 7182 1 1 2 ILE HD13 H 10.245 4.412 2.147 1.00 . A A . 2 ILE HD13 1 1
37 7183 1 1 2 ILE HG12 H 10.399 6.113 3.961 1.00 . A A . 2 ILE HG12 1 1
37 7184 1 1 2 ILE HG13 H 10.686 4.506 4.578 1.00 . A A . 2 ILE HG13 1 1
37 7185 1 1 2 ILE HG21 H 9.175 3.384 6.142 1.00 . A A . 2 ILE HG21 1 1
37 7186 1 1 2 ILE HG22 H 7.675 4.126 6.711 1.00 . A A . 2 ILE HG22 1 1
37 7187 1 1 2 ILE HG23 H 7.758 3.455 5.070 1.00 . A A . 2 ILE HG23 1 1
37 7188 1 1 2 ILE N N 8.118 7.724 4.491 1.00 . A A . 2 ILE N 1 1
37 7189 1 1 2 ILE O O 6.804 6.619 7.156 1.00 . A A . 2 ILE O 1 1
37 7190 1 1 3 TRP C C 3.542 5.635 7.128 1.00 . A A . 3 TRP C 1 1
37 7191 1 1 3 TRP CA C 4.084 6.897 6.382 1.00 . A A . 3 TRP CA 1 1
37 7192 1 1 3 TRP CB C 2.966 7.631 5.585 1.00 . A A . 3 TRP CB 1 1
37 7193 1 1 3 TRP CD1 C 3.766 9.987 4.705 1.00 . A A . 3 TRP CD1 1 1
37 7194 1 1 3 TRP CD2 C 2.489 10.017 6.527 1.00 . A A . 3 TRP CD2 1 1
37 7195 1 1 3 TRP CE2 C 2.796 11.345 6.142 1.00 . A A . 3 TRP CE2 1 1
37 7196 1 1 3 TRP CE3 C 1.672 9.765 7.657 1.00 . A A . 3 TRP CE3 1 1
37 7197 1 1 3 TRP CG C 3.081 9.158 5.619 1.00 . A A . 3 TRP CG 1 1
37 7198 1 1 3 TRP CH2 C 1.445 12.169 7.974 1.00 . A A . 3 TRP CH2 1 1
37 7199 1 1 3 TRP CZ2 C 2.263 12.435 6.872 1.00 . A A . 3 TRP CZ2 1 1
37 7200 1 1 3 TRP CZ3 C 1.156 10.854 8.362 1.00 . A A . 3 TRP CZ3 1 1
37 7201 1 1 3 TRP H H 5.210 6.772 4.469 1.00 . A A . 3 TRP H 1 1
37 7202 1 1 3 TRP HA H 4.401 7.548 7.209 1.00 . A A . 3 TRP HA 1 1
37 7203 1 1 3 TRP HB2 H 2.915 7.280 4.535 1.00 . A A . 3 TRP HB2 1 1
37 7204 1 1 3 TRP HB3 H 1.968 7.369 5.983 1.00 . A A . 3 TRP HB3 1 1
37 7205 1 1 3 TRP HD1 H 4.293 9.635 3.831 1.00 . A A . 3 TRP HD1 1 1
37 7206 1 1 3 TRP HE1 H 3.953 12.164 4.497 1.00 . A A . 3 TRP HE1 1 1
37 7207 1 1 3 TRP HE3 H 1.453 8.751 7.962 1.00 . A A . 3 TRP HE3 1 1
37 7208 1 1 3 TRP HH2 H 1.030 12.991 8.537 1.00 . A A . 3 TRP HH2 1 1
37 7209 1 1 3 TRP HZ2 H 2.478 13.453 6.582 1.00 . A A . 3 TRP HZ2 1 1
37 7210 1 1 3 TRP HZ3 H 0.525 10.678 9.220 1.00 . A A . 3 TRP HZ3 1 1
37 7211 1 1 3 TRP N N 5.270 6.701 5.491 1.00 . A A . 3 TRP N 1 1
37 7212 1 1 3 TRP NE1 N 3.607 11.352 5.019 1.00 . A A . 3 TRP NE1 1 1
37 7213 1 1 3 TRP O O 3.043 5.752 8.251 1.00 . A A . 3 TRP O 1 1
37 7214 1 1 4 GLY C C 3.189 2.118 5.954 1.00 . A A . 4 GLY C 1 1
37 7215 1 1 4 GLY CA C 3.173 3.182 7.061 1.00 . A A . 4 GLY CA 1 1
37 7216 1 1 4 GLY H H 4.213 4.519 5.668 1.00 . A A . 4 GLY H 1 1
37 7217 1 1 4 GLY HA2 H 3.830 2.892 7.902 1.00 . A A . 4 GLY HA2 1 1
37 7218 1 1 4 GLY HA3 H 2.150 3.287 7.464 1.00 . A A . 4 GLY HA3 1 1
37 7219 1 1 4 GLY N N 3.624 4.464 6.496 1.00 . A A . 4 GLY N 1 1
37 7220 1 1 4 GLY O O 2.132 1.794 5.408 1.00 . A A . 4 GLY O 1 1
37 7221 1 1 5 . C C 5.624 1.018 3.523 1.00 . A A . 5 SET C 1 1
37 7222 1 1 5 . CA C 4.542 0.560 4.561 1.00 . A A . 5 SET CA 1 1
37 7223 1 1 5 . CB C 4.951 -0.807 5.185 1.00 . A A . 5 SET CB 1 1
37 7224 1 1 5 . H H 5.179 1.944 6.162 1.00 . A A . 5 SET H 1 1
37 7225 1 1 5 . HA H 3.561 0.425 4.055 1.00 . A A . 5 SET HA 1 1
37 7226 1 1 5 . HB2 H 6.560 1.290 4.054 1.00 . A A . 5 SET HB2 1 1
37 7227 1 1 5 . HB3 H 5.922 0.138 2.925 1.00 . A A . 5 SET HB3 1 1
37 7228 1 1 5 . HNT2 H 5.292 1.849 1.514 1.00 . A A . 5 SET HNT2 1 1
37 7229 1 1 5 . N N 4.379 1.572 5.638 1.00 . A A . 5 SET N 1 1
37 7230 1 1 5 . NT N 5.304 2.072 2.521 1.00 . A A . 5 SET NT 1 1
37 7231 1 1 5 . OG O 6.113 -1.029 5.543 1.00 . A A . 5 SET OG 1 1
37 7232 1 1 6 SER C C 2.777 -3.820 5.704 1.00 . A A . 6 SER C 1 1
37 7233 1 1 6 SER CA C 4.139 -3.085 5.866 1.00 . A A . 6 SER CA 1 1
37 7234 1 1 6 SER CB C 4.602 -3.100 7.349 1.00 . A A . 6 SER CB 1 1
37 7235 1 1 6 SER H H 3.121 -1.403 4.803 1.00 . A A . 6 SER H 1 1
37 7236 1 1 6 SER HA H 4.915 -3.602 5.266 1.00 . A A . 6 SER HA 1 1
37 7237 1 1 6 SER HB2 H 5.538 -2.527 7.483 1.00 . A A . 6 SER HB2 1 1
37 7238 1 1 6 SER HB3 H 3.857 -2.609 8.004 1.00 . A A . 6 SER HB3 1 1
37 7239 1 1 6 SER HG H 5.572 -4.769 7.300 1.00 . A A . 6 SER HG 1 1
37 7240 1 1 6 SER N N 3.962 -1.709 5.307 1.00 . A A . 6 SER N 1 1
37 7241 1 1 6 SER O O 1.833 -3.509 6.441 1.00 . A A . 6 SER O 1 1
37 7242 1 1 6 SER OG O 4.826 -4.432 7.803 1.00 . A A . 6 SER OG 1 1
37 7243 1 1 7 GLY C C 0.393 -4.659 3.680 1.00 . A A . 7 GLY C 1 1
37 7244 1 1 7 GLY CA C 1.376 -5.508 4.517 1.00 . A A . 7 GLY CA 1 1
37 7245 1 1 7 GLY H H 3.519 -5.050 4.273 1.00 . A A . 7 GLY H 1 1
37 7246 1 1 7 GLY HA2 H 1.597 -6.445 3.971 1.00 . A A . 7 GLY HA2 1 1
37 7247 1 1 7 GLY HA3 H 0.916 -5.834 5.471 1.00 . A A . 7 GLY HA3 1 1
37 7248 1 1 7 GLY N N 2.656 -4.782 4.758 1.00 . A A . 7 GLY N 1 1
37 7249 1 1 7 GLY O O 0.245 -4.853 2.471 1.00 . A A . 7 GLY O 1 1
37 7250 1 1 8 LYS C C -0.297 -1.502 3.499 1.00 . A A . 8 LYS C 1 1
37 7251 1 1 8 LYS CA C -1.200 -2.738 3.780 1.00 . A A . 8 LYS CA 1 1
37 7252 1 1 8 LYS CB C -2.352 -2.476 4.787 1.00 . A A . 8 LYS CB 1 1
37 7253 1 1 8 LYS CD C -4.220 -1.644 3.141 1.00 . A A . 8 LYS CD 1 1
37 7254 1 1 8 LYS CE C -3.641 -1.001 1.864 1.00 . A A . 8 LYS CE 1 1
37 7255 1 1 8 LYS CG C -3.388 -1.389 4.418 1.00 . A A . 8 LYS CG 1 1
37 7256 1 1 8 LYS H H 0.118 -3.549 5.301 1.00 . A A . 8 LYS H 1 1
37 7257 1 1 8 LYS HA H -1.644 -3.140 2.846 1.00 . A A . 8 LYS HA 1 1
37 7258 1 1 8 LYS HB2 H -2.893 -3.425 4.972 1.00 . A A . 8 LYS HB2 1 1
37 7259 1 1 8 LYS HB3 H -1.927 -2.204 5.774 1.00 . A A . 8 LYS HB3 1 1
37 7260 1 1 8 LYS HD2 H -4.362 -2.734 3.002 1.00 . A A . 8 LYS HD2 1 1
37 7261 1 1 8 LYS HD3 H -5.232 -1.238 3.319 1.00 . A A . 8 LYS HD3 1 1
37 7262 1 1 8 LYS HE2 H -3.469 0.081 2.022 1.00 . A A . 8 LYS HE2 1 1
37 7263 1 1 8 LYS HE3 H -2.651 -1.429 1.624 1.00 . A A . 8 LYS HE3 1 1
37 7264 1 1 8 LYS HG2 H -4.091 -1.313 5.269 1.00 . A A . 8 LYS HG2 1 1
37 7265 1 1 8 LYS HG3 H -2.905 -0.393 4.382 1.00 . A A . 8 LYS HG3 1 1
37 7266 1 1 8 LYS HZ1 H -4.701 -2.191 0.511 1.00 . A A . 8 LYS HZ1 1 1
37 7267 1 1 8 LYS HZ2 H -5.467 -0.779 0.875 1.00 . A A . 8 LYS HZ2 1 1
37 7268 1 1 8 LYS HZ3 H -4.173 -0.773 -0.147 1.00 . A A . 8 LYS HZ3 1 1
37 7269 1 1 8 LYS N N -0.271 -3.719 4.373 1.00 . A A . 8 LYS N 1 1
37 7270 1 1 8 LYS NZ N -4.544 -1.197 0.712 1.00 . A A . 8 LYS NZ 1 1
37 7271 1 1 8 LYS O O 0.009 -0.702 4.391 1.00 . A A . 8 LYS O 1 1
37 7272 1 1 9 LEU C C 0.306 1.062 1.670 1.00 . A A . 9 LEU C 1 1
37 7273 1 1 9 LEU CA C 1.044 -0.307 1.774 1.00 . A A . 9 LEU CA 1 1
37 7274 1 1 9 LEU CB C 1.720 -0.692 0.422 1.00 . A A . 9 LEU CB 1 1
37 7275 1 1 9 LEU CD1 C 3.164 -2.198 -1.031 1.00 . A A . 9 LEU CD1 1 1
37 7276 1 1 9 LEU CD2 C 4.038 -1.516 1.227 1.00 . A A . 9 LEU CD2 1 1
37 7277 1 1 9 LEU CG C 2.770 -1.847 0.416 1.00 . A A . 9 LEU CG 1 1
37 7278 1 1 9 LEU H H -0.186 -2.163 1.644 1.00 . A A . 9 LEU H 1 1
37 7279 1 1 9 LEU HA H 1.864 -0.209 2.513 1.00 . A A . 9 LEU HA 1 1
37 7280 1 1 9 LEU HB2 H 0.922 -0.922 -0.312 1.00 . A A . 9 LEU HB2 1 1
37 7281 1 1 9 LEU HB3 H 2.215 0.207 0.006 1.00 . A A . 9 LEU HB3 1 1
37 7282 1 1 9 LEU HD11 H 3.877 -3.043 -1.068 1.00 . A A . 9 LEU HD11 1 1
37 7283 1 1 9 LEU HD12 H 2.285 -2.501 -1.632 1.00 . A A . 9 LEU HD12 1 1
37 7284 1 1 9 LEU HD13 H 3.639 -1.346 -1.555 1.00 . A A . 9 LEU HD13 1 1
37 7285 1 1 9 LEU HD21 H 4.534 -0.596 0.868 1.00 . A A . 9 LEU HD21 1 1
37 7286 1 1 9 LEU HD22 H 3.809 -1.374 2.297 1.00 . A A . 9 LEU HD22 1 1
37 7287 1 1 9 LEU HD23 H 4.782 -2.333 1.176 1.00 . A A . 9 LEU HD23 1 1
37 7288 1 1 9 LEU HG H 2.329 -2.760 0.855 1.00 . A A . 9 LEU HG 1 1
37 7289 1 1 9 LEU N N 0.140 -1.394 2.235 1.00 . A A . 9 LEU N 1 1
37 7290 1 1 9 LEU O O -0.452 1.310 0.727 1.00 . A A . 9 LEU O 1 1
37 7291 1 1 10 ILE C C 1.139 4.299 2.914 1.00 . A A . 10 ILE C 1 1
37 7292 1 1 10 ILE CA C -0.050 3.292 2.749 1.00 . A A . 10 ILE CA 1 1
37 7293 1 1 10 ILE CB C -1.228 3.355 3.792 1.00 . A A . 10 ILE CB 1 1
37 7294 1 1 10 ILE CD1 C -2.812 4.982 2.522 1.00 . A A . 10 ILE CD1 1 1
37 7295 1 1 10 ILE CG1 C -1.996 4.709 3.795 1.00 . A A . 10 ILE CG1 1 1
37 7296 1 1 10 ILE CG2 C -0.855 2.966 5.247 1.00 . A A . 10 ILE CG2 1 1
37 7297 1 1 10 ILE H H 1.102 1.557 3.447 1.00 . A A . 10 ILE H 1 1
37 7298 1 1 10 ILE HA H -0.516 3.532 1.772 1.00 . A A . 10 ILE HA 1 1
37 7299 1 1 10 ILE HB H -1.963 2.589 3.479 1.00 . A A . 10 ILE HB 1 1
37 7300 1 1 10 ILE HD11 H -2.170 5.093 1.630 1.00 . A A . 10 ILE HD11 1 1
37 7301 1 1 10 ILE HD12 H -3.529 4.165 2.316 1.00 . A A . 10 ILE HD12 1 1
37 7302 1 1 10 ILE HD13 H -3.398 5.913 2.621 1.00 . A A . 10 ILE HD13 1 1
37 7303 1 1 10 ILE HG12 H -2.706 4.737 4.643 1.00 . A A . 10 ILE HG12 1 1
37 7304 1 1 10 ILE HG13 H -1.302 5.549 3.982 1.00 . A A . 10 ILE HG13 1 1
37 7305 1 1 10 ILE HG21 H -0.474 1.931 5.303 1.00 . A A . 10 ILE HG21 1 1
37 7306 1 1 10 ILE HG22 H -0.077 3.621 5.675 1.00 . A A . 10 ILE HG22 1 1
37 7307 1 1 10 ILE HG23 H -1.728 3.008 5.925 1.00 . A A . 10 ILE HG23 1 1
37 7308 1 1 10 ILE N N 0.538 1.926 2.674 1.00 . A A . 10 ILE N 1 1
37 7309 1 1 10 ILE O O 1.391 4.845 3.992 1.00 . A A . 10 ILE O 1 1
37 7310 1 1 11 GLU C C 2.606 6.873 1.191 1.00 . A A . 11 GLU C 1 1
37 7311 1 1 11 GLU CA C 3.031 5.457 1.739 1.00 . A A . 11 GLU CA 1 1
37 7312 1 1 11 GLU CB C 4.135 4.715 0.900 1.00 . A A . 11 GLU CB 1 1
37 7313 1 1 11 GLU CD C 5.372 3.389 2.810 1.00 . A A . 11 GLU CD 1 1
37 7314 1 1 11 GLU CG C 5.452 4.396 1.643 1.00 . A A . 11 GLU CG 1 1
37 7315 1 1 11 GLU H H 1.551 4.007 0.975 1.00 . A A . 11 GLU H 1 1
37 7316 1 1 11 GLU HA H 3.456 5.603 2.755 1.00 . A A . 11 GLU HA 1 1
37 7317 1 1 11 GLU HB2 H 3.769 3.775 0.439 1.00 . A A . 11 GLU HB2 1 1
37 7318 1 1 11 GLU HB3 H 4.414 5.314 0.014 1.00 . A A . 11 GLU HB3 1 1
37 7319 1 1 11 GLU HG2 H 6.207 4.049 0.913 1.00 . A A . 11 GLU HG2 1 1
37 7320 1 1 11 GLU HG3 H 5.876 5.346 2.022 1.00 . A A . 11 GLU HG3 1 1
37 7321 1 1 11 GLU N N 1.857 4.539 1.797 1.00 . A A . 11 GLU N 1 1
37 7322 1 1 11 GLU O O 3.164 7.365 0.205 1.00 . A A . 11 GLU O 1 1
37 7323 1 1 11 GLU OE1 O 5.406 3.824 3.962 1.00 . A A . 11 GLU OE1 1 1
37 7324 1 1 12 THR C C 0.568 9.595 2.694 1.00 . A A . 12 THR C 1 1
37 7325 1 1 12 THR CA C 1.093 8.876 1.413 1.00 . A A . 12 THR CA 1 1
37 7326 1 1 12 THR CB C 0.059 8.777 0.242 1.00 . A A . 12 THR CB 1 1
37 7327 1 1 12 THR CG2 C -0.522 10.126 -0.221 1.00 . A A . 12 THR CG2 1 1
37 7328 1 1 12 THR H H 1.245 7.068 2.663 1.00 . A A . 12 THR H 1 1
37 7329 1 1 12 THR HA H 1.945 9.483 1.044 1.00 . A A . 12 THR HA 1 1
37 7330 1 1 12 THR HB H -0.782 8.127 0.552 1.00 . A A . 12 THR HB 1 1
37 7331 1 1 12 THR HG1 H 1.336 7.588 -0.572 1.00 . A A . 12 THR HG1 1 1
37 7332 1 1 12 THR HG21 H -1.217 9.993 -1.070 1.00 . A A . 12 THR HG21 1 1
37 7333 1 1 12 THR HG22 H -1.090 10.630 0.583 1.00 . A A . 12 THR HG22 1 1
37 7334 1 1 12 THR HG23 H 0.272 10.821 -0.552 1.00 . A A . 12 THR HG23 1 1
37 7335 1 1 12 THR N N 1.615 7.537 1.829 1.00 . A A . 12 THR N 1 1
37 7336 1 1 12 THR O O 1.175 10.582 3.110 1.00 . A A . 12 THR O 1 1
37 7337 1 1 12 THR OG1 O 0.667 8.192 -0.906 1.00 . A A . 12 THR OG1 1 1
37 7338 1 1 13 THR C C -1.750 8.562 5.313 1.00 . A A . 13 THR C 1 1
37 7339 1 1 13 THR CA C -1.125 9.752 4.528 1.00 . A A . 13 THR CA 1 1
37 7340 1 1 13 THR CB C -2.128 10.906 4.215 1.00 . A A . 13 THR CB 1 1
37 7341 1 1 13 THR CG2 C -2.735 11.566 5.466 1.00 . A A . 13 THR CG2 1 1
37 7342 1 1 13 THR H H -1.097 8.457 2.757 1.00 . A A . 13 THR H 1 1
37 7343 1 1 13 THR HA H -0.304 10.193 5.133 1.00 . A A . 13 THR HA 1 1
37 7344 1 1 13 THR HB H -2.953 10.517 3.589 1.00 . A A . 13 THR HB 1 1
37 7345 1 1 13 THR HG1 H -0.862 11.502 2.891 1.00 . A A . 13 THR HG1 1 1
37 7346 1 1 13 THR HG21 H -1.952 11.982 6.128 1.00 . A A . 13 THR HG21 1 1
37 7347 1 1 13 THR HG22 H -3.411 12.395 5.192 1.00 . A A . 13 THR HG22 1 1
37 7348 1 1 13 THR HG23 H -3.328 10.848 6.062 1.00 . A A . 13 THR HG23 1 1
37 7349 1 1 13 THR N N -0.563 9.152 3.289 1.00 . A A . 13 THR N 1 1
37 7350 1 1 13 THR O O -2.846 8.094 4.984 1.00 . A A . 13 THR O 1 1
37 7351 1 1 13 THR OG1 O -1.469 11.942 3.493 1.00 . A A . 13 THR OG1 1 1
37 7352 1 1 14 ALA C C -2.218 7.455 8.459 1.00 . A A . 14 ALA C 1 1
37 7353 1 1 14 ALA CA C -1.488 6.950 7.194 1.00 . A A . 14 ALA CA 1 1
37 7354 1 1 14 ALA CB C -0.281 6.059 7.536 1.00 . A A . 14 ALA CB 1 1
37 7355 1 1 14 ALA H H -0.144 8.559 6.515 1.00 . A A . 14 ALA H 1 1
37 7356 1 1 14 ALA HXT H -1.907 8.526 10.045 1.00 . A A . 14 ALA HXT 1 1
37 7357 1 1 14 ALA HA H -2.198 6.311 6.631 1.00 . A A . 14 ALA HA 1 1
37 7358 1 1 14 ALA HB1 H -0.587 5.156 8.096 1.00 . A A . 14 ALA HB1 1 1
37 7359 1 1 14 ALA HB2 H 0.240 5.705 6.626 1.00 . A A . 14 ALA HB2 1 1
37 7360 1 1 14 ALA HB3 H 0.470 6.584 8.154 1.00 . A A . 14 ALA HB3 1 1
37 7361 1 1 14 ALA N N -1.035 8.079 6.346 1.00 . A A . 14 ALA N 1 1
37 7362 1 1 14 ALA O O -3.393 7.186 8.706 1.00 . A A . 14 ALA O 1 1
37 7363 1 1 14 ALA OXT O -1.424 8.229 9.270 1.00 . A A . 14 ALA OXT 1 1
38 7364 1 1 1 ACE C C 7.686 10.403 5.776 1.00 . A A . 1 ACE C 1 1
38 7365 1 1 1 ACE CH3 C 7.610 11.913 5.577 1.00 . A A . 1 ACE CH3 1 1
38 7366 1 1 1 ACE H1 H 7.767 12.182 4.517 1.00 . A A . 1 ACE H1 1 1
38 7367 1 1 1 ACE H2 H 6.620 12.310 5.871 1.00 . A A . 1 ACE H2 1 1
38 7368 1 1 1 ACE H3 H 8.381 12.439 6.169 1.00 . A A . 1 ACE H3 1 1
38 7369 1 1 1 ACE O O 7.944 9.661 4.826 1.00 . A A . 1 ACE O 1 1
38 7370 1 1 2 ILE C C 5.981 8.117 7.494 1.00 . A A . 2 ILE C 1 1
38 7371 1 1 2 ILE CA C 7.482 8.527 7.405 1.00 . A A . 2 ILE CA 1 1
38 7372 1 1 2 ILE CB C 8.334 8.235 8.696 1.00 . A A . 2 ILE CB 1 1
38 7373 1 1 2 ILE CD1 C 10.686 8.048 7.485 1.00 . A A . 2 ILE CD1 1 1
38 7374 1 1 2 ILE CG1 C 9.835 8.661 8.614 1.00 . A A . 2 ILE CG1 1 1
38 7375 1 1 2 ILE CG2 C 8.250 6.754 9.152 1.00 . A A . 2 ILE CG2 1 1
38 7376 1 1 2 ILE H H 7.063 10.699 7.637 1.00 . A A . 2 ILE H 1 1
38 7377 1 1 2 ILE HA H 7.963 7.934 6.600 1.00 . A A . 2 ILE HA 1 1
38 7378 1 1 2 ILE HB H 7.894 8.826 9.521 1.00 . A A . 2 ILE HB 1 1
38 7379 1 1 2 ILE HD11 H 10.716 6.944 7.541 1.00 . A A . 2 ILE HD11 1 1
38 7380 1 1 2 ILE HD12 H 10.302 8.321 6.485 1.00 . A A . 2 ILE HD12 1 1
38 7381 1 1 2 ILE HD13 H 11.730 8.404 7.537 1.00 . A A . 2 ILE HD13 1 1
38 7382 1 1 2 ILE HG12 H 9.898 9.761 8.529 1.00 . A A . 2 ILE HG12 1 1
38 7383 1 1 2 ILE HG13 H 10.334 8.439 9.578 1.00 . A A . 2 ILE HG13 1 1
38 7384 1 1 2 ILE HG21 H 8.841 6.569 10.068 1.00 . A A . 2 ILE HG21 1 1
38 7385 1 1 2 ILE HG22 H 7.211 6.454 9.389 1.00 . A A . 2 ILE HG22 1 1
38 7386 1 1 2 ILE HG23 H 8.618 6.058 8.376 1.00 . A A . 2 ILE HG23 1 1
38 7387 1 1 2 ILE N N 7.463 9.975 7.028 1.00 . A A . 2 ILE N 1 1
38 7388 1 1 2 ILE O O 5.309 8.359 8.502 1.00 . A A . 2 ILE O 1 1
38 7389 1 1 3 TRP C C 3.655 5.688 6.919 1.00 . A A . 3 TRP C 1 1
38 7390 1 1 3 TRP CA C 4.059 7.059 6.302 1.00 . A A . 3 TRP CA 1 1
38 7391 1 1 3 TRP CB C 3.560 7.190 4.832 1.00 . A A . 3 TRP CB 1 1
38 7392 1 1 3 TRP CD1 C 4.569 8.499 2.802 1.00 . A A . 3 TRP CD1 1 1
38 7393 1 1 3 TRP CD2 C 3.737 9.806 4.401 1.00 . A A . 3 TRP CD2 1 1
38 7394 1 1 3 TRP CE2 C 4.297 10.605 3.372 1.00 . A A . 3 TRP CE2 1 1
38 7395 1 1 3 TRP CE3 C 3.173 10.415 5.551 1.00 . A A . 3 TRP CE3 1 1
38 7396 1 1 3 TRP CG C 3.905 8.475 4.047 1.00 . A A . 3 TRP CG 1 1
38 7397 1 1 3 TRP CH2 C 3.701 12.597 4.608 1.00 . A A . 3 TRP CH2 1 1
38 7398 1 1 3 TRP CZ2 C 4.275 12.016 3.476 1.00 . A A . 3 TRP CZ2 1 1
38 7399 1 1 3 TRP CZ3 C 3.160 11.807 5.631 1.00 . A A . 3 TRP CZ3 1 1
38 7400 1 1 3 TRP H H 6.114 7.513 5.604 1.00 . A A . 3 TRP H 1 1
38 7401 1 1 3 TRP HA H 3.470 7.774 6.883 1.00 . A A . 3 TRP HA 1 1
38 7402 1 1 3 TRP HB2 H 3.932 6.317 4.262 1.00 . A A . 3 TRP HB2 1 1
38 7403 1 1 3 TRP HB3 H 2.459 7.081 4.817 1.00 . A A . 3 TRP HB3 1 1
38 7404 1 1 3 TRP HD1 H 4.877 7.620 2.256 1.00 . A A . 3 TRP HD1 1 1
38 7405 1 1 3 TRP HE1 H 5.284 10.115 1.502 1.00 . A A . 3 TRP HE1 1 1
38 7406 1 1 3 TRP HE3 H 2.761 9.824 6.354 1.00 . A A . 3 TRP HE3 1 1
38 7407 1 1 3 TRP HH2 H 3.678 13.673 4.699 1.00 . A A . 3 TRP HH2 1 1
38 7408 1 1 3 TRP HZ2 H 4.695 12.636 2.696 1.00 . A A . 3 TRP HZ2 1 1
38 7409 1 1 3 TRP HZ3 H 2.729 12.284 6.500 1.00 . A A . 3 TRP HZ3 1 1
38 7410 1 1 3 TRP N N 5.488 7.483 6.418 1.00 . A A . 3 TRP N 1 1
38 7411 1 1 3 TRP NE1 N 4.813 9.813 2.362 1.00 . A A . 3 TRP NE1 1 1
38 7412 1 1 3 TRP O O 2.553 5.562 7.460 1.00 . A A . 3 TRP O 1 1
38 7413 1 1 4 GLY C C 3.808 2.354 6.250 1.00 . A A . 4 GLY C 1 1
38 7414 1 1 4 GLY CA C 4.275 3.321 7.350 1.00 . A A . 4 GLY CA 1 1
38 7415 1 1 4 GLY H H 5.418 4.994 6.429 1.00 . A A . 4 GLY H 1 1
38 7416 1 1 4 GLY HA2 H 5.201 2.953 7.834 1.00 . A A . 4 GLY HA2 1 1
38 7417 1 1 4 GLY HA3 H 3.525 3.336 8.165 1.00 . A A . 4 GLY HA3 1 1
38 7418 1 1 4 GLY N N 4.527 4.679 6.817 1.00 . A A . 4 GLY N 1 1
38 7419 1 1 4 GLY O O 2.606 2.252 5.992 1.00 . A A . 4 GLY O 1 1
38 7420 1 1 5 . C C 5.313 1.010 3.249 1.00 . A A . 5 SET C 1 1
38 7421 1 1 5 . CA C 4.479 0.675 4.533 1.00 . A A . 5 SET CA 1 1
38 7422 1 1 5 . CB C 4.866 -0.745 5.050 1.00 . A A . 5 SET CB 1 1
38 7423 1 1 5 . H H 5.722 1.857 5.927 1.00 . A A . 5 SET H 1 1
38 7424 1 1 5 . HA H 3.391 0.691 4.317 1.00 . A A . 5 SET HA 1 1
38 7425 1 1 5 . HB2 H 6.362 1.233 3.531 1.00 . A A . 5 SET HB2 1 1
38 7426 1 1 5 . HB3 H 5.419 0.087 2.649 1.00 . A A . 5 SET HB3 1 1
38 7427 1 1 5 . HNT2 H 4.722 1.775 1.283 1.00 . A A . 5 SET HNT2 1 1
38 7428 1 1 5 . N N 4.765 1.649 5.621 1.00 . A A . 5 SET N 1 1
38 7429 1 1 5 . NT N 4.844 2.033 2.274 1.00 . A A . 5 SET NT 1 1
38 7430 1 1 5 . OG O 6.049 -1.040 5.256 1.00 . A A . 5 SET OG 1 1
38 7431 1 1 6 SER C C 2.690 -3.756 5.660 1.00 . A A . 6 SER C 1 1
38 7432 1 1 6 SER CA C 4.054 -3.012 5.748 1.00 . A A . 6 SER CA 1 1
38 7433 1 1 6 SER CB C 4.606 -3.065 7.200 1.00 . A A . 6 SER CB 1 1
38 7434 1 1 6 SER H H 2.975 -1.292 4.838 1.00 . A A . 6 SER H 1 1
38 7435 1 1 6 SER HA H 4.795 -3.511 5.090 1.00 . A A . 6 SER HA 1 1
38 7436 1 1 6 SER HB2 H 5.558 -2.508 7.281 1.00 . A A . 6 SER HB2 1 1
38 7437 1 1 6 SER HB3 H 3.913 -2.576 7.910 1.00 . A A . 6 SER HB3 1 1
38 7438 1 1 6 SER HG H 3.983 -4.833 7.658 1.00 . A A . 6 SER HG 1 1
38 7439 1 1 6 SER N N 3.858 -1.614 5.252 1.00 . A A . 6 SER N 1 1
38 7440 1 1 6 SER O O 1.759 -3.416 6.400 1.00 . A A . 6 SER O 1 1
38 7441 1 1 6 SER OG O 4.843 -4.407 7.613 1.00 . A A . 6 SER OG 1 1
38 7442 1 1 7 GLY C C 0.337 -4.759 3.674 1.00 . A A . 7 GLY C 1 1
38 7443 1 1 7 GLY CA C 1.298 -5.536 4.599 1.00 . A A . 7 GLY CA 1 1
38 7444 1 1 7 GLY H H 3.403 -4.979 4.221 1.00 . A A . 7 GLY H 1 1
38 7445 1 1 7 GLY HA2 H 1.528 -6.516 4.141 1.00 . A A . 7 GLY HA2 1 1
38 7446 1 1 7 GLY HA3 H 0.825 -5.774 5.572 1.00 . A A . 7 GLY HA3 1 1
38 7447 1 1 7 GLY N N 2.569 -4.777 4.782 1.00 . A A . 7 GLY N 1 1
38 7448 1 1 7 GLY O O 0.233 -5.038 2.478 1.00 . A A . 7 GLY O 1 1
38 7449 1 1 8 LYS C C -0.372 -1.566 3.455 1.00 . A A . 8 LYS C 1 1
38 7450 1 1 8 LYS CA C -1.255 -2.842 3.585 1.00 . A A . 8 LYS CA 1 1
38 7451 1 1 8 LYS CB C -2.547 -2.666 4.427 1.00 . A A . 8 LYS CB 1 1
38 7452 1 1 8 LYS CD C -4.187 -1.917 2.524 1.00 . A A . 8 LYS CD 1 1
38 7453 1 1 8 LYS CE C -3.471 -1.195 1.365 1.00 . A A . 8 LYS CE 1 1
38 7454 1 1 8 LYS CG C -3.584 -1.638 3.918 1.00 . A A . 8 LYS CG 1 1
38 7455 1 1 8 LYS H H -0.060 -3.600 5.242 1.00 . A A . 8 LYS H 1 1
38 7456 1 1 8 LYS HA H -1.541 -3.231 2.586 1.00 . A A . 8 LYS HA 1 1
38 7457 1 1 8 LYS HB2 H -3.050 -3.648 4.524 1.00 . A A . 8 LYS HB2 1 1
38 7458 1 1 8 LYS HB3 H -2.280 -2.386 5.464 1.00 . A A . 8 LYS HB3 1 1
38 7459 1 1 8 LYS HD2 H -4.218 -3.010 2.345 1.00 . A A . 8 LYS HD2 1 1
38 7460 1 1 8 LYS HD3 H -5.245 -1.597 2.549 1.00 . A A . 8 LYS HD3 1 1
38 7461 1 1 8 LYS HE2 H -3.424 -0.106 1.562 1.00 . A A . 8 LYS HE2 1 1
38 7462 1 1 8 LYS HE3 H -2.420 -1.527 1.283 1.00 . A A . 8 LYS HE3 1 1
38 7463 1 1 8 LYS HG2 H -4.412 -1.626 4.652 1.00 . A A . 8 LYS HG2 1 1
38 7464 1 1 8 LYS HG3 H -3.167 -0.614 3.971 1.00 . A A . 8 LYS HG3 1 1
38 7465 1 1 8 LYS HZ1 H -5.129 -1.104 0.097 1.00 . A A . 8 LYS HZ1 1 1
38 7466 1 1 8 LYS HZ2 H -3.694 -0.960 -0.703 1.00 . A A . 8 LYS HZ2 1 1
38 7467 1 1 8 LYS HZ3 H -4.191 -2.435 -0.155 1.00 . A A . 8 LYS HZ3 1 1
38 7468 1 1 8 LYS N N -0.353 -3.781 4.280 1.00 . A A . 8 LYS N 1 1
38 7469 1 1 8 LYS NZ N -4.158 -1.436 0.080 1.00 . A A . 8 LYS NZ 1 1
38 7470 1 1 8 LYS O O -0.289 -0.747 4.378 1.00 . A A . 8 LYS O 1 1
38 7471 1 1 9 LEU C C 0.500 1.046 1.827 1.00 . A A . 9 LEU C 1 1
38 7472 1 1 9 LEU CA C 1.238 -0.310 2.030 1.00 . A A . 9 LEU CA 1 1
38 7473 1 1 9 LEU CB C 2.178 -0.632 0.827 1.00 . A A . 9 LEU CB 1 1
38 7474 1 1 9 LEU CD1 C 2.908 -3.112 1.120 1.00 . A A . 9 LEU CD1 1 1
38 7475 1 1 9 LEU CD2 C 4.441 -1.472 -0.004 1.00 . A A . 9 LEU CD2 1 1
38 7476 1 1 9 LEU CG C 3.346 -1.636 1.069 1.00 . A A . 9 LEU CG 1 1
38 7477 1 1 9 LEU H H 0.207 -2.231 1.664 1.00 . A A . 9 LEU H 1 1
38 7478 1 1 9 LEU HA H 1.906 -0.219 2.908 1.00 . A A . 9 LEU HA 1 1
38 7479 1 1 9 LEU HB2 H 1.585 -0.939 -0.057 1.00 . A A . 9 LEU HB2 1 1
38 7480 1 1 9 LEU HB3 H 2.641 0.327 0.517 1.00 . A A . 9 LEU HB3 1 1
38 7481 1 1 9 LEU HD11 H 3.771 -3.794 1.240 1.00 . A A . 9 LEU HD11 1 1
38 7482 1 1 9 LEU HD12 H 2.245 -3.311 1.978 1.00 . A A . 9 LEU HD12 1 1
38 7483 1 1 9 LEU HD13 H 2.370 -3.421 0.204 1.00 . A A . 9 LEU HD13 1 1
38 7484 1 1 9 LEU HD21 H 4.067 -1.696 -1.020 1.00 . A A . 9 LEU HD21 1 1
38 7485 1 1 9 LEU HD22 H 4.843 -0.442 -0.024 1.00 . A A . 9 LEU HD22 1 1
38 7486 1 1 9 LEU HD23 H 5.303 -2.140 0.182 1.00 . A A . 9 LEU HD23 1 1
38 7487 1 1 9 LEU HG H 3.810 -1.400 2.044 1.00 . A A . 9 LEU HG 1 1
38 7488 1 1 9 LEU N N 0.304 -1.432 2.298 1.00 . A A . 9 LEU N 1 1
38 7489 1 1 9 LEU O O -0.086 1.299 0.770 1.00 . A A . 9 LEU O 1 1
38 7490 1 1 10 ILE C C 1.079 4.294 2.764 1.00 . A A . 10 ILE C 1 1
38 7491 1 1 10 ILE CA C -0.079 3.250 2.856 1.00 . A A . 10 ILE CA 1 1
38 7492 1 1 10 ILE CB C -1.124 3.417 4.021 1.00 . A A . 10 ILE CB 1 1
38 7493 1 1 10 ILE CD1 C -2.909 4.851 2.752 1.00 . A A . 10 ILE CD1 1 1
38 7494 1 1 10 ILE CG1 C -1.944 4.739 3.945 1.00 . A A . 10 ILE CG1 1 1
38 7495 1 1 10 ILE CG2 C -0.556 3.249 5.455 1.00 . A A . 10 ILE CG2 1 1
38 7496 1 1 10 ILE H H 1.007 1.527 3.708 1.00 . A A . 10 ILE H 1 1
38 7497 1 1 10 ILE HA H -0.677 3.359 1.929 1.00 . A A . 10 ILE HA 1 1
38 7498 1 1 10 ILE HB H -1.856 2.594 3.905 1.00 . A A . 10 ILE HB 1 1
38 7499 1 1 10 ILE HD11 H -2.376 4.880 1.784 1.00 . A A . 10 ILE HD11 1 1
38 7500 1 1 10 ILE HD12 H -3.619 4.005 2.720 1.00 . A A . 10 ILE HD12 1 1
38 7501 1 1 10 ILE HD13 H -3.509 5.777 2.815 1.00 . A A . 10 ILE HD13 1 1
38 7502 1 1 10 ILE HG12 H -2.554 4.852 4.862 1.00 . A A . 10 ILE HG12 1 1
38 7503 1 1 10 ILE HG13 H -1.264 5.611 3.948 1.00 . A A . 10 ILE HG13 1 1
38 7504 1 1 10 ILE HG21 H -0.043 2.278 5.581 1.00 . A A . 10 ILE HG21 1 1
38 7505 1 1 10 ILE HG22 H 0.171 4.038 5.722 1.00 . A A . 10 ILE HG22 1 1
38 7506 1 1 10 ILE HG23 H -1.355 3.276 6.219 1.00 . A A . 10 ILE HG23 1 1
38 7507 1 1 10 ILE N N 0.544 1.895 2.870 1.00 . A A . 10 ILE N 1 1
38 7508 1 1 10 ILE O O 1.474 4.916 3.754 1.00 . A A . 10 ILE O 1 1
38 7509 1 1 11 GLU C C 2.176 6.694 0.537 1.00 . A A . 11 GLU C 1 1
38 7510 1 1 11 GLU CA C 2.729 5.410 1.250 1.00 . A A . 11 GLU CA 1 1
38 7511 1 1 11 GLU CB C 3.824 4.614 0.461 1.00 . A A . 11 GLU CB 1 1
38 7512 1 1 11 GLU CD C 5.020 3.352 2.480 1.00 . A A . 11 GLU CD 1 1
38 7513 1 1 11 GLU CG C 5.116 4.275 1.244 1.00 . A A . 11 GLU CG 1 1
38 7514 1 1 11 GLU H H 1.221 3.860 0.813 1.00 . A A . 11 GLU H 1 1
38 7515 1 1 11 GLU HA H 3.223 5.736 2.188 1.00 . A A . 11 GLU HA 1 1
38 7516 1 1 11 GLU HB2 H 3.427 3.691 -0.005 1.00 . A A . 11 GLU HB2 1 1
38 7517 1 1 11 GLU HB3 H 4.160 5.203 -0.414 1.00 . A A . 11 GLU HB3 1 1
38 7518 1 1 11 GLU HG2 H 5.858 3.853 0.540 1.00 . A A . 11 GLU HG2 1 1
38 7519 1 1 11 GLU HG3 H 5.582 5.228 1.562 1.00 . A A . 11 GLU HG3 1 1
38 7520 1 1 11 GLU N N 1.615 4.468 1.539 1.00 . A A . 11 GLU N 1 1
38 7521 1 1 11 GLU O O 2.492 6.951 -0.629 1.00 . A A . 11 GLU O 1 1
38 7522 1 1 11 GLU OE1 O 5.187 3.846 3.597 1.00 . A A . 11 GLU OE1 1 1
38 7523 1 1 12 THR C C 0.685 9.799 1.815 1.00 . A A . 12 THR C 1 1
38 7524 1 1 12 THR CA C 0.749 8.755 0.658 1.00 . A A . 12 THR CA 1 1
38 7525 1 1 12 THR CB C -0.592 8.481 -0.101 1.00 . A A . 12 THR CB 1 1
38 7526 1 1 12 THR CG2 C -1.242 9.732 -0.718 1.00 . A A . 12 THR CG2 1 1
38 7527 1 1 12 THR H H 1.026 7.169 2.144 1.00 . A A . 12 THR H 1 1
38 7528 1 1 12 THR HA H 1.454 9.178 -0.086 1.00 . A A . 12 THR HA 1 1
38 7529 1 1 12 THR HB H -1.319 8.020 0.595 1.00 . A A . 12 THR HB 1 1
38 7530 1 1 12 THR HG1 H 0.281 6.940 -0.856 1.00 . A A . 12 THR HG1 1 1
38 7531 1 1 12 THR HG21 H -2.170 9.475 -1.262 1.00 . A A . 12 THR HG21 1 1
38 7532 1 1 12 THR HG22 H -1.516 10.479 0.050 1.00 . A A . 12 THR HG22 1 1
38 7533 1 1 12 THR HG23 H -0.568 10.231 -1.439 1.00 . A A . 12 THR HG23 1 1
38 7534 1 1 12 THR N N 1.336 7.507 1.225 1.00 . A A . 12 THR N 1 1
38 7535 1 1 12 THR O O 1.531 10.696 1.855 1.00 . A A . 12 THR O 1 1
38 7536 1 1 12 THR OG1 O -0.371 7.570 -1.173 1.00 . A A . 12 THR OG1 1 1
38 7537 1 1 13 THR C C -1.013 9.789 5.053 1.00 . A A . 13 THR C 1 1
38 7538 1 1 13 THR CA C -0.446 10.640 3.879 1.00 . A A . 13 THR CA 1 1
38 7539 1 1 13 THR CB C -1.332 11.872 3.513 1.00 . A A . 13 THR CB 1 1
38 7540 1 1 13 THR CG2 C -1.435 12.910 4.642 1.00 . A A . 13 THR CG2 1 1
38 7541 1 1 13 THR H H -1.021 9.001 2.535 1.00 . A A . 13 THR H 1 1
38 7542 1 1 13 THR HA H 0.555 11.029 4.163 1.00 . A A . 13 THR HA 1 1
38 7543 1 1 13 THR HB H -2.354 11.531 3.259 1.00 . A A . 13 THR HB 1 1
38 7544 1 1 13 THR HG1 H 0.118 12.731 2.579 1.00 . A A . 13 THR HG1 1 1
38 7545 1 1 13 THR HG21 H -0.440 13.297 4.934 1.00 . A A . 13 THR HG21 1 1
38 7546 1 1 13 THR HG22 H -2.050 13.775 4.333 1.00 . A A . 13 THR HG22 1 1
38 7547 1 1 13 THR HG23 H -1.906 12.484 5.547 1.00 . A A . 13 THR HG23 1 1
38 7548 1 1 13 THR N N -0.303 9.705 2.732 1.00 . A A . 13 THR N 1 1
38 7549 1 1 13 THR O O -2.213 9.499 5.101 1.00 . A A . 13 THR O 1 1
38 7550 1 1 13 THR OG1 O -0.804 12.554 2.379 1.00 . A A . 13 THR OG1 1 1
38 7551 1 1 14 ALA C C 0.419 8.914 8.338 1.00 . A A . 14 ALA C 1 1
38 7552 1 1 14 ALA CA C -0.519 8.567 7.165 1.00 . A A . 14 ALA CA 1 1
38 7553 1 1 14 ALA CB C -0.484 7.066 6.813 1.00 . A A . 14 ALA CB 1 1
38 7554 1 1 14 ALA H H 0.838 9.666 5.818 1.00 . A A . 14 ALA H 1 1
38 7555 1 1 14 ALA HXT H 0.400 9.907 10.001 1.00 . A A . 14 ALA HXT 1 1
38 7556 1 1 14 ALA HA H -1.555 8.813 7.474 1.00 . A A . 14 ALA HA 1 1
38 7557 1 1 14 ALA HB1 H -0.711 6.433 7.692 1.00 . A A . 14 ALA HB1 1 1
38 7558 1 1 14 ALA HB2 H -1.233 6.818 6.041 1.00 . A A . 14 ALA HB2 1 1
38 7559 1 1 14 ALA HB3 H 0.501 6.747 6.425 1.00 . A A . 14 ALA HB3 1 1
38 7560 1 1 14 ALA N N -0.134 9.383 5.989 1.00 . A A . 14 ALA N 1 1
38 7561 1 1 14 ALA O O 1.591 8.543 8.424 1.00 . A A . 14 ALA O 1 1
38 7562 1 1 14 ALA OXT O -0.197 9.698 9.278 1.00 . A A . 14 ALA OXT 1 1
39 7563 1 1 1 ACE C C 5.662 8.686 1.600 1.00 . A A . 1 ACE C 1 1
39 7564 1 1 1 ACE CH3 C 5.291 10.034 0.993 1.00 . A A . 1 ACE CH3 1 1
39 7565 1 1 1 ACE H1 H 4.926 9.913 -0.045 1.00 . A A . 1 ACE H1 1 1
39 7566 1 1 1 ACE H2 H 4.483 10.527 1.566 1.00 . A A . 1 ACE H2 1 1
39 7567 1 1 1 ACE H3 H 6.158 10.719 0.960 1.00 . A A . 1 ACE H3 1 1
39 7568 1 1 1 ACE O O 5.565 7.654 0.935 1.00 . A A . 1 ACE O 1 1
39 7569 1 1 2 ILE C C 5.674 7.604 4.953 1.00 . A A . 2 ILE C 1 1
39 7570 1 1 2 ILE CA C 6.501 7.511 3.634 1.00 . A A . 2 ILE CA 1 1
39 7571 1 1 2 ILE CB C 8.054 7.409 3.864 1.00 . A A . 2 ILE CB 1 1
39 7572 1 1 2 ILE CD1 C 8.761 6.260 1.578 1.00 . A A . 2 ILE CD1 1 1
39 7573 1 1 2 ILE CG1 C 8.927 7.426 2.572 1.00 . A A . 2 ILE CG1 1 1
39 7574 1 1 2 ILE CG2 C 8.456 6.198 4.749 1.00 . A A . 2 ILE CG2 1 1
39 7575 1 1 2 ILE H H 6.109 9.663 3.282 1.00 . A A . 2 ILE H 1 1
39 7576 1 1 2 ILE HA H 6.219 6.581 3.093 1.00 . A A . 2 ILE HA 1 1
39 7577 1 1 2 ILE HB H 8.354 8.311 4.432 1.00 . A A . 2 ILE HB 1 1
39 7578 1 1 2 ILE HD11 H 8.977 5.281 2.043 1.00 . A A . 2 ILE HD11 1 1
39 7579 1 1 2 ILE HD12 H 7.740 6.216 1.164 1.00 . A A . 2 ILE HD12 1 1
39 7580 1 1 2 ILE HD13 H 9.450 6.371 0.721 1.00 . A A . 2 ILE HD13 1 1
39 7581 1 1 2 ILE HG12 H 8.744 8.369 2.027 1.00 . A A . 2 ILE HG12 1 1
39 7582 1 1 2 ILE HG13 H 9.993 7.481 2.862 1.00 . A A . 2 ILE HG13 1 1
39 7583 1 1 2 ILE HG21 H 9.550 6.144 4.903 1.00 . A A . 2 ILE HG21 1 1
39 7584 1 1 2 ILE HG22 H 8.004 6.255 5.755 1.00 . A A . 2 ILE HG22 1 1
39 7585 1 1 2 ILE HG23 H 8.137 5.237 4.307 1.00 . A A . 2 ILE HG23 1 1
39 7586 1 1 2 ILE N N 6.104 8.727 2.863 1.00 . A A . 2 ILE N 1 1
39 7587 1 1 2 ILE O O 6.077 8.288 5.901 1.00 . A A . 2 ILE O 1 1
39 7588 1 1 3 TRP C C 3.245 5.459 6.600 1.00 . A A . 3 TRP C 1 1
39 7589 1 1 3 TRP CA C 3.619 6.919 6.197 1.00 . A A . 3 TRP CA 1 1
39 7590 1 1 3 TRP CB C 2.391 7.850 5.966 1.00 . A A . 3 TRP CB 1 1
39 7591 1 1 3 TRP CD1 C 3.250 10.320 5.747 1.00 . A A . 3 TRP CD1 1 1
39 7592 1 1 3 TRP CD2 C 2.074 9.899 7.582 1.00 . A A . 3 TRP CD2 1 1
39 7593 1 1 3 TRP CE2 C 2.421 11.273 7.544 1.00 . A A . 3 TRP CE2 1 1
39 7594 1 1 3 TRP CE3 C 1.328 9.377 8.669 1.00 . A A . 3 TRP CE3 1 1
39 7595 1 1 3 TRP CG C 2.578 9.297 6.442 1.00 . A A . 3 TRP CG 1 1
39 7596 1 1 3 TRP CH2 C 1.262 11.609 9.641 1.00 . A A . 3 TRP CH2 1 1
39 7597 1 1 3 TRP CZ2 C 2.006 12.139 8.584 1.00 . A A . 3 TRP CZ2 1 1
39 7598 1 1 3 TRP CZ3 C 0.931 10.249 9.683 1.00 . A A . 3 TRP CZ3 1 1
39 7599 1 1 3 TRP H H 4.311 6.387 4.148 1.00 . A A . 3 TRP H 1 1
39 7600 1 1 3 TRP HA H 4.162 7.310 7.082 1.00 . A A . 3 TRP HA 1 1
39 7601 1 1 3 TRP HB2 H 2.072 7.838 4.904 1.00 . A A . 3 TRP HB2 1 1
39 7602 1 1 3 TRP HB3 H 1.507 7.451 6.495 1.00 . A A . 3 TRP HB3 1 1
39 7603 1 1 3 TRP HD1 H 3.763 10.171 4.814 1.00 . A A . 3 TRP HD1 1 1
39 7604 1 1 3 TRP HE1 H 3.554 12.460 6.122 1.00 . A A . 3 TRP HE1 1 1
39 7605 1 1 3 TRP HE3 H 1.079 8.328 8.719 1.00 . A A . 3 TRP HE3 1 1
39 7606 1 1 3 TRP HH2 H 0.940 12.260 10.441 1.00 . A A . 3 TRP HH2 1 1
39 7607 1 1 3 TRP HZ2 H 2.259 13.189 8.565 1.00 . A A . 3 TRP HZ2 1 1
39 7608 1 1 3 TRP HZ3 H 0.360 9.867 10.517 1.00 . A A . 3 TRP HZ3 1 1
39 7609 1 1 3 TRP N N 4.509 6.933 4.994 1.00 . A A . 3 TRP N 1 1
39 7610 1 1 3 TRP NE1 N 3.158 11.557 6.409 1.00 . A A . 3 TRP NE1 1 1
39 7611 1 1 3 TRP O O 2.072 5.072 6.638 1.00 . A A . 3 TRP O 1 1
39 7612 1 1 4 GLY C C 3.734 2.264 6.235 1.00 . A A . 4 GLY C 1 1
39 7613 1 1 4 GLY CA C 4.093 3.250 7.367 1.00 . A A . 4 GLY CA 1 1
39 7614 1 1 4 GLY H H 5.178 5.132 6.858 1.00 . A A . 4 GLY H 1 1
39 7615 1 1 4 GLY HA2 H 5.014 2.921 7.886 1.00 . A A . 4 GLY HA2 1 1
39 7616 1 1 4 GLY HA3 H 3.310 3.191 8.147 1.00 . A A . 4 GLY HA3 1 1
39 7617 1 1 4 GLY N N 4.270 4.661 6.946 1.00 . A A . 4 GLY N 1 1
39 7618 1 1 4 GLY O O 2.550 2.088 5.932 1.00 . A A . 4 GLY O 1 1
39 7619 1 1 5 . C C 5.474 0.958 3.306 1.00 . A A . 5 SET C 1 1
39 7620 1 1 5 . CA C 4.558 0.635 4.538 1.00 . A A . 5 SET CA 1 1
39 7621 1 1 5 . CB C 4.919 -0.778 5.095 1.00 . A A . 5 SET CB 1 1
39 7622 1 1 5 . H H 5.686 1.890 5.969 1.00 . A A . 5 SET H 1 1
39 7623 1 1 5 . HA H 3.485 0.633 4.251 1.00 . A A . 5 SET HA 1 1
39 7624 1 1 5 . HB2 H 6.497 1.206 3.655 1.00 . A A . 5 SET HB2 1 1
39 7625 1 1 5 . HB3 H 5.635 0.026 2.733 1.00 . A A . 5 SET HB3 1 1
39 7626 1 1 5 . HNT2 H 4.929 1.667 1.299 1.00 . A A . 5 SET HNT2 1 1
39 7627 1 1 5 . N N 4.753 1.624 5.636 1.00 . A A . 5 SET N 1 1
39 7628 1 1 5 . NT N 5.048 1.952 2.285 1.00 . A A . 5 SET NT 1 1
39 7629 1 1 5 . OG O 6.093 -1.071 5.347 1.00 . A A . 5 SET OG 1 1
39 7630 1 1 6 SER C C 2.688 -3.752 5.682 1.00 . A A . 6 SER C 1 1
39 7631 1 1 6 SER CA C 4.061 -3.031 5.807 1.00 . A A . 6 SER CA 1 1
39 7632 1 1 6 SER CB C 4.538 -3.098 7.287 1.00 . A A . 6 SER CB 1 1
39 7633 1 1 6 SER H H 3.027 -1.310 4.850 1.00 . A A . 6 SER H 1 1
39 7634 1 1 6 SER HA H 4.811 -3.559 5.184 1.00 . A A . 6 SER HA 1 1
39 7635 1 1 6 SER HB2 H 3.948 -2.413 7.926 1.00 . A A . 6 SER HB2 1 1
39 7636 1 1 6 SER HB3 H 4.378 -4.110 7.706 1.00 . A A . 6 SER HB3 1 1
39 7637 1 1 6 SER HG H 6.074 -2.022 6.854 1.00 . A A . 6 SER HG 1 1
39 7638 1 1 6 SER N N 3.900 -1.638 5.281 1.00 . A A . 6 SER N 1 1
39 7639 1 1 6 SER O O 1.738 -3.386 6.386 1.00 . A A . 6 SER O 1 1
39 7640 1 1 6 SER OG O 5.921 -2.794 7.408 1.00 . A A . 6 SER OG 1 1
39 7641 1 1 7 GLY C C 0.356 -4.737 3.662 1.00 . A A . 7 GLY C 1 1
39 7642 1 1 7 GLY CA C 1.301 -5.522 4.595 1.00 . A A . 7 GLY CA 1 1
39 7643 1 1 7 GLY H H 3.422 -5.002 4.278 1.00 . A A . 7 GLY H 1 1
39 7644 1 1 7 GLY HA2 H 1.533 -6.500 4.134 1.00 . A A . 7 GLY HA2 1 1
39 7645 1 1 7 GLY HA3 H 0.813 -5.767 5.559 1.00 . A A . 7 GLY HA3 1 1
39 7646 1 1 7 GLY N N 2.576 -4.778 4.809 1.00 . A A . 7 GLY N 1 1
39 7647 1 1 7 GLY O O 0.277 -4.999 2.459 1.00 . A A . 7 GLY O 1 1
39 7648 1 1 8 LYS C C -0.368 -1.556 3.439 1.00 . A A . 8 LYS C 1 1
39 7649 1 1 8 LYS CA C -1.249 -2.832 3.580 1.00 . A A . 8 LYS CA 1 1
39 7650 1 1 8 LYS CB C -2.528 -2.650 4.442 1.00 . A A . 8 LYS CB 1 1
39 7651 1 1 8 LYS CD C -4.165 -1.816 2.576 1.00 . A A . 8 LYS CD 1 1
39 7652 1 1 8 LYS CE C -3.392 -1.227 1.376 1.00 . A A . 8 LYS CE 1 1
39 7653 1 1 8 LYS CG C -3.552 -1.590 3.976 1.00 . A A . 8 LYS CG 1 1
39 7654 1 1 8 LYS H H -0.062 -3.577 5.226 1.00 . A A . 8 LYS H 1 1
39 7655 1 1 8 LYS HA H -1.545 -3.232 2.591 1.00 . A A . 8 LYS HA 1 1
39 7656 1 1 8 LYS HB2 H -3.048 -3.625 4.524 1.00 . A A . 8 LYS HB2 1 1
39 7657 1 1 8 LYS HB3 H -2.244 -2.398 5.483 1.00 . A A . 8 LYS HB3 1 1
39 7658 1 1 8 LYS HD2 H -4.293 -2.905 2.420 1.00 . A A . 8 LYS HD2 1 1
39 7659 1 1 8 LYS HD3 H -5.195 -1.414 2.574 1.00 . A A . 8 LYS HD3 1 1
39 7660 1 1 8 LYS HE2 H -2.346 -1.579 1.371 1.00 . A A . 8 LYS HE2 1 1
39 7661 1 1 8 LYS HE3 H -3.823 -1.626 0.442 1.00 . A A . 8 LYS HE3 1 1
39 7662 1 1 8 LYS HG2 H -4.377 -1.589 4.713 1.00 . A A . 8 LYS HG2 1 1
39 7663 1 1 8 LYS HG3 H -3.117 -0.576 4.057 1.00 . A A . 8 LYS HG3 1 1
39 7664 1 1 8 LYS HZ1 H -4.367 0.622 1.263 1.00 . A A . 8 LYS HZ1 1 1
39 7665 1 1 8 LYS HZ2 H -2.999 0.662 2.183 1.00 . A A . 8 LYS HZ2 1 1
39 7666 1 1 8 LYS HZ3 H -2.882 0.626 0.539 1.00 . A A . 8 LYS HZ3 1 1
39 7667 1 1 8 LYS N N -0.350 -3.773 4.269 1.00 . A A . 8 LYS N 1 1
39 7668 1 1 8 LYS NZ N -3.412 0.253 1.336 1.00 . A A . 8 LYS NZ 1 1
39 7669 1 1 8 LYS O O -0.274 -0.736 4.361 1.00 . A A . 8 LYS O 1 1
39 7670 1 1 9 LEU C C 0.450 1.057 1.782 1.00 . A A . 9 LEU C 1 1
39 7671 1 1 9 LEU CA C 1.209 -0.286 1.991 1.00 . A A . 9 LEU CA 1 1
39 7672 1 1 9 LEU CB C 2.146 -0.610 0.788 1.00 . A A . 9 LEU CB 1 1
39 7673 1 1 9 LEU CD1 C 2.978 -3.035 1.239 1.00 . A A . 9 LEU CD1 1 1
39 7674 1 1 9 LEU CD2 C 4.402 -1.433 -0.073 1.00 . A A . 9 LEU CD2 1 1
39 7675 1 1 9 LEU CG C 3.357 -1.554 1.055 1.00 . A A . 9 LEU CG 1 1
39 7676 1 1 9 LEU H H 0.197 -2.221 1.642 1.00 . A A . 9 LEU H 1 1
39 7677 1 1 9 LEU HA H 1.881 -0.180 2.867 1.00 . A A . 9 LEU HA 1 1
39 7678 1 1 9 LEU HB2 H 1.556 -0.976 -0.076 1.00 . A A . 9 LEU HB2 1 1
39 7679 1 1 9 LEU HB3 H 2.567 0.352 0.433 1.00 . A A . 9 LEU HB3 1 1
39 7680 1 1 9 LEU HD11 H 3.872 -3.675 1.373 1.00 . A A . 9 LEU HD11 1 1
39 7681 1 1 9 LEU HD12 H 2.359 -3.189 2.140 1.00 . A A . 9 LEU HD12 1 1
39 7682 1 1 9 LEU HD13 H 2.414 -3.434 0.375 1.00 . A A . 9 LEU HD13 1 1
39 7683 1 1 9 LEU HD21 H 3.996 -1.750 -1.053 1.00 . A A . 9 LEU HD21 1 1
39 7684 1 1 9 LEU HD22 H 4.762 -0.393 -0.188 1.00 . A A . 9 LEU HD22 1 1
39 7685 1 1 9 LEU HD23 H 5.296 -2.053 0.126 1.00 . A A . 9 LEU HD23 1 1
39 7686 1 1 9 LEU HG H 3.850 -1.224 1.987 1.00 . A A . 9 LEU HG 1 1
39 7687 1 1 9 LEU N N 0.289 -1.416 2.273 1.00 . A A . 9 LEU N 1 1
39 7688 1 1 9 LEU O O -0.160 1.296 0.734 1.00 . A A . 9 LEU O 1 1
39 7689 1 1 10 ILE C C 1.055 4.291 2.807 1.00 . A A . 10 ILE C 1 1
39 7690 1 1 10 ILE CA C -0.125 3.264 2.818 1.00 . A A . 10 ILE CA 1 1
39 7691 1 1 10 ILE CB C -1.208 3.386 3.954 1.00 . A A . 10 ILE CB 1 1
39 7692 1 1 10 ILE CD1 C -2.878 4.973 2.723 1.00 . A A . 10 ILE CD1 1 1
39 7693 1 1 10 ILE CG1 C -1.983 4.737 3.950 1.00 . A A . 10 ILE CG1 1 1
39 7694 1 1 10 ILE CG2 C -0.702 3.087 5.389 1.00 . A A . 10 ILE CG2 1 1
39 7695 1 1 10 ILE H H 0.978 1.550 3.652 1.00 . A A . 10 ILE H 1 1
39 7696 1 1 10 ILE HA H -0.681 3.410 1.870 1.00 . A A . 10 ILE HA 1 1
39 7697 1 1 10 ILE HB H -1.963 2.601 3.751 1.00 . A A . 10 ILE HB 1 1
39 7698 1 1 10 ILE HD11 H -3.453 5.912 2.828 1.00 . A A . 10 ILE HD11 1 1
39 7699 1 1 10 ILE HD12 H -2.293 5.054 1.789 1.00 . A A . 10 ILE HD12 1 1
39 7700 1 1 10 ILE HD13 H -3.611 4.156 2.590 1.00 . A A . 10 ILE HD13 1 1
39 7701 1 1 10 ILE HG12 H -2.638 4.793 4.841 1.00 . A A . 10 ILE HG12 1 1
39 7702 1 1 10 ILE HG13 H -1.281 5.584 4.064 1.00 . A A . 10 ILE HG13 1 1
39 7703 1 1 10 ILE HG21 H -0.264 2.075 5.470 1.00 . A A . 10 ILE HG21 1 1
39 7704 1 1 10 ILE HG22 H 0.076 3.798 5.715 1.00 . A A . 10 ILE HG22 1 1
39 7705 1 1 10 ILE HG23 H -1.516 3.132 6.135 1.00 . A A . 10 ILE HG23 1 1
39 7706 1 1 10 ILE N N 0.499 1.910 2.819 1.00 . A A . 10 ILE N 1 1
39 7707 1 1 10 ILE O O 1.371 4.935 3.810 1.00 . A A . 10 ILE O 1 1
39 7708 1 1 11 GLU C C 2.441 6.745 0.871 1.00 . A A . 11 GLU C 1 1
39 7709 1 1 11 GLU CA C 2.861 5.335 1.422 1.00 . A A . 11 GLU CA 1 1
39 7710 1 1 11 GLU CB C 3.881 4.531 0.540 1.00 . A A . 11 GLU CB 1 1
39 7711 1 1 11 GLU CD C 5.201 3.278 2.466 1.00 . A A . 11 GLU CD 1 1
39 7712 1 1 11 GLU CG C 5.229 4.180 1.212 1.00 . A A . 11 GLU CG 1 1
39 7713 1 1 11 GLU H H 1.335 3.838 0.876 1.00 . A A . 11 GLU H 1 1
39 7714 1 1 11 GLU HA H 3.374 5.513 2.391 1.00 . A A . 11 GLU HA 1 1
39 7715 1 1 11 GLU HB2 H 3.454 3.595 0.123 1.00 . A A . 11 GLU HB2 1 1
39 7716 1 1 11 GLU HB3 H 4.131 5.102 -0.375 1.00 . A A . 11 GLU HB3 1 1
39 7717 1 1 11 GLU HG2 H 5.907 3.740 0.456 1.00 . A A . 11 GLU HG2 1 1
39 7718 1 1 11 GLU HG3 H 5.731 5.127 1.478 1.00 . A A . 11 GLU HG3 1 1
39 7719 1 1 11 GLU N N 1.691 4.437 1.628 1.00 . A A . 11 GLU N 1 1
39 7720 1 1 11 GLU O O 2.882 7.163 -0.204 1.00 . A A . 11 GLU O 1 1
39 7721 1 1 11 GLU OE1 O 5.365 3.797 3.572 1.00 . A A . 11 GLU OE1 1 1
39 7722 1 1 12 THR C C 0.867 9.607 2.554 1.00 . A A . 12 THR C 1 1
39 7723 1 1 12 THR CA C 1.122 8.850 1.216 1.00 . A A . 12 THR CA 1 1
39 7724 1 1 12 THR CB C -0.069 8.827 0.195 1.00 . A A . 12 THR CB 1 1
39 7725 1 1 12 THR CG2 C -0.489 10.224 -0.294 1.00 . A A . 12 THR CG2 1 1
39 7726 1 1 12 THR H H 1.206 7.045 2.452 1.00 . A A . 12 THR H 1 1
39 7727 1 1 12 THR HA H 1.962 9.377 0.720 1.00 . A A . 12 THR HA 1 1
39 7728 1 1 12 THR HB H -0.947 8.344 0.665 1.00 . A A . 12 THR HB 1 1
39 7729 1 1 12 THR HG1 H 1.140 8.370 -1.234 1.00 . A A . 12 THR HG1 1 1
39 7730 1 1 12 THR HG21 H -1.320 10.161 -1.019 1.00 . A A . 12 THR HG21 1 1
39 7731 1 1 12 THR HG22 H -0.836 10.866 0.537 1.00 . A A . 12 THR HG22 1 1
39 7732 1 1 12 THR HG23 H 0.344 10.753 -0.794 1.00 . A A . 12 THR HG23 1 1
39 7733 1 1 12 THR N N 1.590 7.492 1.612 1.00 . A A . 12 THR N 1 1
39 7734 1 1 12 THR O O 1.746 10.352 2.997 1.00 . A A . 12 THR O 1 1
39 7735 1 1 12 THR OG1 O 0.267 8.073 -0.965 1.00 . A A . 12 THR OG1 1 1
39 7736 1 1 13 THR C C -1.662 9.086 5.169 1.00 . A A . 13 THR C 1 1
39 7737 1 1 13 THR CA C -0.672 10.070 4.477 1.00 . A A . 13 THR CA 1 1
39 7738 1 1 13 THR CB C -1.265 11.500 4.286 1.00 . A A . 13 THR CB 1 1
39 7739 1 1 13 THR CG2 C -1.555 12.216 5.615 1.00 . A A . 13 THR CG2 1 1
39 7740 1 1 13 THR H H -0.995 8.851 2.687 1.00 . A A . 13 THR H 1 1
39 7741 1 1 13 THR HA H 0.242 10.171 5.097 1.00 . A A . 13 THR HA 1 1
39 7742 1 1 13 THR HB H -2.208 11.437 3.708 1.00 . A A . 13 THR HB 1 1
39 7743 1 1 13 THR HG1 H 0.480 12.271 4.021 1.00 . A A . 13 THR HG1 1 1
39 7744 1 1 13 THR HG21 H -0.643 12.308 6.234 1.00 . A A . 13 THR HG21 1 1
39 7745 1 1 13 THR HG22 H -1.946 13.233 5.439 1.00 . A A . 13 THR HG22 1 1
39 7746 1 1 13 THR HG23 H -2.311 11.674 6.212 1.00 . A A . 13 THR HG23 1 1
39 7747 1 1 13 THR N N -0.312 9.423 3.191 1.00 . A A . 13 THR N 1 1
39 7748 1 1 13 THR O O -2.804 8.927 4.720 1.00 . A A . 13 THR O 1 1
39 7749 1 1 13 THR OG1 O -0.363 12.331 3.565 1.00 . A A . 13 THR OG1 1 1
39 7750 1 1 14 ALA C C -2.828 8.154 8.168 1.00 . A A . 14 ALA C 1 1
39 7751 1 1 14 ALA CA C -2.055 7.468 7.019 1.00 . A A . 14 ALA CA 1 1
39 7752 1 1 14 ALA CB C -1.168 6.311 7.511 1.00 . A A . 14 ALA CB 1 1
39 7753 1 1 14 ALA H H -0.261 8.662 6.543 1.00 . A A . 14 ALA H 1 1
39 7754 1 1 14 ALA HXT H -2.519 9.114 9.824 1.00 . A A . 14 ALA HXT 1 1
39 7755 1 1 14 ALA HA H -2.806 7.013 6.344 1.00 . A A . 14 ALA HA 1 1
39 7756 1 1 14 ALA HB1 H -0.632 5.826 6.676 1.00 . A A . 14 ALA HB1 1 1
39 7757 1 1 14 ALA HB2 H -0.403 6.639 8.239 1.00 . A A . 14 ALA HB2 1 1
39 7758 1 1 14 ALA HB3 H -1.767 5.523 8.005 1.00 . A A . 14 ALA HB3 1 1
39 7759 1 1 14 ALA N N -1.221 8.437 6.262 1.00 . A A . 14 ALA N 1 1
39 7760 1 1 14 ALA O O -4.055 8.209 8.210 1.00 . A A . 14 ALA O 1 1
39 7761 1 1 14 ALA OXT O -2.007 8.693 9.128 1.00 . A A . 14 ALA OXT 1 1
40 7762 1 1 1 ACE C C 6.739 10.668 6.832 1.00 . A A . 1 ACE C 1 1
40 7763 1 1 1 ACE CH3 C 6.459 12.162 6.713 1.00 . A A . 1 ACE CH3 1 1
40 7764 1 1 1 ACE H1 H 5.392 12.390 6.893 1.00 . A A . 1 ACE H1 1 1
40 7765 1 1 1 ACE H2 H 7.061 12.747 7.433 1.00 . A A . 1 ACE H2 1 1
40 7766 1 1 1 ACE H3 H 6.704 12.533 5.701 1.00 . A A . 1 ACE H3 1 1
40 7767 1 1 1 ACE O O 7.210 10.044 5.878 1.00 . A A . 1 ACE O 1 1
40 7768 1 1 2 ILE C C 5.215 8.042 8.204 1.00 . A A . 2 ILE C 1 1
40 7769 1 1 2 ILE CA C 6.639 8.665 8.312 1.00 . A A . 2 ILE CA 1 1
40 7770 1 1 2 ILE CB C 7.385 8.402 9.672 1.00 . A A . 2 ILE CB 1 1
40 7771 1 1 2 ILE CD1 C 9.851 8.639 8.731 1.00 . A A . 2 ILE CD1 1 1
40 7772 1 1 2 ILE CG1 C 8.806 9.041 9.789 1.00 . A A . 2 ILE CG1 1 1
40 7773 1 1 2 ILE CG2 C 7.473 6.894 10.030 1.00 . A A . 2 ILE CG2 1 1
40 7774 1 1 2 ILE H H 5.878 10.733 8.619 1.00 . A A . 2 ILE H 1 1
40 7775 1 1 2 ILE HA H 7.284 8.207 7.533 1.00 . A A . 2 ILE HA 1 1
40 7776 1 1 2 ILE HB H 6.776 8.862 10.476 1.00 . A A . 2 ILE HB 1 1
40 7777 1 1 2 ILE HD11 H 9.539 8.928 7.711 1.00 . A A . 2 ILE HD11 1 1
40 7778 1 1 2 ILE HD12 H 10.821 9.135 8.923 1.00 . A A . 2 ILE HD12 1 1
40 7779 1 1 2 ILE HD13 H 10.040 7.550 8.727 1.00 . A A . 2 ILE HD13 1 1
40 7780 1 1 2 ILE HG12 H 8.712 10.142 9.775 1.00 . A A . 2 ILE HG12 1 1
40 7781 1 1 2 ILE HG13 H 9.228 8.821 10.789 1.00 . A A . 2 ILE HG13 1 1
40 7782 1 1 2 ILE HG21 H 7.986 6.727 10.996 1.00 . A A . 2 ILE HG21 1 1
40 7783 1 1 2 ILE HG22 H 6.473 6.433 10.128 1.00 . A A . 2 ILE HG22 1 1
40 7784 1 1 2 ILE HG23 H 8.020 6.315 9.263 1.00 . A A . 2 ILE HG23 1 1
40 7785 1 1 2 ILE N N 6.444 10.120 8.020 1.00 . A A . 2 ILE N 1 1
40 7786 1 1 2 ILE O O 4.412 8.110 9.141 1.00 . A A . 2 ILE O 1 1
40 7787 1 1 3 TRP C C 3.345 5.367 7.257 1.00 . A A . 3 TRP C 1 1
40 7788 1 1 3 TRP CA C 3.607 6.813 6.740 1.00 . A A . 3 TRP CA 1 1
40 7789 1 1 3 TRP CB C 3.263 6.960 5.227 1.00 . A A . 3 TRP CB 1 1
40 7790 1 1 3 TRP CD1 C 4.337 8.569 3.461 1.00 . A A . 3 TRP CD1 1 1
40 7791 1 1 3 TRP CD2 C 3.044 9.586 4.959 1.00 . A A . 3 TRP CD2 1 1
40 7792 1 1 3 TRP CE2 C 3.635 10.551 4.104 1.00 . A A . 3 TRP CE2 1 1
40 7793 1 1 3 TRP CE3 C 2.203 9.994 6.026 1.00 . A A . 3 TRP CE3 1 1
40 7794 1 1 3 TRP CG C 3.488 8.334 4.563 1.00 . A A . 3 TRP CG 1 1
40 7795 1 1 3 TRP CH2 C 2.533 12.309 5.349 1.00 . A A . 3 TRP CH2 1 1
40 7796 1 1 3 TRP CZ2 C 3.376 11.929 4.303 1.00 . A A . 3 TRP CZ2 1 1
40 7797 1 1 3 TRP CZ3 C 1.957 11.356 6.198 1.00 . A A . 3 TRP CZ3 1 1
40 7798 1 1 3 TRP H H 5.633 7.603 6.310 1.00 . A A . 3 TRP H 1 1
40 7799 1 1 3 TRP HA H 2.858 7.405 7.278 1.00 . A A . 3 TRP HA 1 1
40 7800 1 1 3 TRP HB2 H 3.825 6.193 4.661 1.00 . A A . 3 TRP HB2 1 1
40 7801 1 1 3 TRP HB3 H 2.199 6.694 5.077 1.00 . A A . 3 TRP HB3 1 1
40 7802 1 1 3 TRP HD1 H 4.881 7.798 2.935 1.00 . A A . 3 TRP HD1 1 1
40 7803 1 1 3 TRP HE1 H 4.995 10.385 2.422 1.00 . A A . 3 TRP HE1 1 1
40 7804 1 1 3 TRP HE3 H 1.763 9.271 6.695 1.00 . A A . 3 TRP HE3 1 1
40 7805 1 1 3 TRP HH2 H 2.327 13.357 5.509 1.00 . A A . 3 TRP HH2 1 1
40 7806 1 1 3 TRP HZ2 H 3.820 12.673 3.658 1.00 . A A . 3 TRP HZ2 1 1
40 7807 1 1 3 TRP HZ3 H 1.314 11.680 7.004 1.00 . A A . 3 TRP HZ3 1 1
40 7808 1 1 3 TRP N N 4.936 7.426 7.043 1.00 . A A . 3 TRP N 1 1
40 7809 1 1 3 TRP NE1 N 4.434 9.938 3.155 1.00 . A A . 3 TRP NE1 1 1
40 7810 1 1 3 TRP O O 2.222 5.055 7.662 1.00 . A A . 3 TRP O 1 1
40 7811 1 1 4 GLY C C 3.811 2.110 6.598 1.00 . A A . 4 GLY C 1 1
40 7812 1 1 4 GLY CA C 4.262 3.098 7.688 1.00 . A A . 4 GLY CA 1 1
40 7813 1 1 4 GLY H H 5.231 4.966 6.946 1.00 . A A . 4 GLY H 1 1
40 7814 1 1 4 GLY HA2 H 5.242 2.791 8.098 1.00 . A A . 4 GLY HA2 1 1
40 7815 1 1 4 GLY HA3 H 3.573 3.023 8.552 1.00 . A A . 4 GLY HA3 1 1
40 7816 1 1 4 GLY N N 4.363 4.501 7.221 1.00 . A A . 4 GLY N 1 1
40 7817 1 1 4 GLY O O 2.629 1.764 6.532 1.00 . A A . 4 GLY O 1 1
40 7818 1 1 5 . C C 5.327 1.044 3.395 1.00 . A A . 5 SET C 1 1
40 7819 1 1 5 . CA C 4.489 0.685 4.669 1.00 . A A . 5 SET CA 1 1
40 7820 1 1 5 . CB C 4.896 -0.743 5.152 1.00 . A A . 5 SET CB 1 1
40 7821 1 1 5 . H H 5.694 2.055 5.917 1.00 . A A . 5 SET H 1 1
40 7822 1 1 5 . HA H 3.398 0.700 4.447 1.00 . A A . 5 SET HA 1 1
40 7823 1 1 5 . HB2 H 6.381 1.234 3.683 1.00 . A A . 5 SET HB2 1 1
40 7824 1 1 5 . HB3 H 5.410 0.138 2.767 1.00 . A A . 5 SET HB3 1 1
40 7825 1 1 5 . HNT2 H 4.746 1.883 1.460 1.00 . A A . 5 SET HNT2 1 1
40 7826 1 1 5 . N N 4.765 1.646 5.771 1.00 . A A . 5 SET N 1 1
40 7827 1 1 5 . NT N 4.881 2.106 2.457 1.00 . A A . 5 SET NT 1 1
40 7828 1 1 5 . OG O 6.083 -1.022 5.356 1.00 . A A . 5 SET OG 1 1
40 7829 1 1 6 SER C C 2.752 -3.787 5.650 1.00 . A A . 6 SER C 1 1
40 7830 1 1 6 SER CA C 4.110 -3.042 5.783 1.00 . A A . 6 SER CA 1 1
40 7831 1 1 6 SER CB C 4.621 -3.165 7.246 1.00 . A A . 6 SER CB 1 1
40 7832 1 1 6 SER H H 3.012 -1.293 4.937 1.00 . A A . 6 SER H 1 1
40 7833 1 1 6 SER HA H 4.857 -3.522 5.120 1.00 . A A . 6 SER HA 1 1
40 7834 1 1 6 SER HB2 H 4.030 -2.526 7.930 1.00 . A A . 6 SER HB2 1 1
40 7835 1 1 6 SER HB3 H 4.499 -4.199 7.621 1.00 . A A . 6 SER HB3 1 1
40 7836 1 1 6 SER HG H 6.119 -2.027 6.832 1.00 . A A . 6 SER HG 1 1
40 7837 1 1 6 SER N N 3.902 -1.630 5.325 1.00 . A A . 6 SER N 1 1
40 7838 1 1 6 SER O O 1.823 -3.506 6.417 1.00 . A A . 6 SER O 1 1
40 7839 1 1 6 SER OG O 5.999 -2.828 7.352 1.00 . A A . 6 SER OG 1 1
40 7840 1 1 7 GLY C C 0.364 -4.654 3.646 1.00 . A A . 7 GLY C 1 1
40 7841 1 1 7 GLY CA C 1.362 -5.494 4.471 1.00 . A A . 7 GLY CA 1 1
40 7842 1 1 7 GLY H H 3.466 -4.920 4.136 1.00 . A A . 7 GLY H 1 1
40 7843 1 1 7 GLY HA2 H 1.594 -6.424 3.919 1.00 . A A . 7 GLY HA2 1 1
40 7844 1 1 7 GLY HA3 H 0.917 -5.829 5.428 1.00 . A A . 7 GLY HA3 1 1
40 7845 1 1 7 GLY N N 2.629 -4.740 4.696 1.00 . A A . 7 GLY N 1 1
40 7846 1 1 7 GLY O O 0.224 -4.828 2.432 1.00 . A A . 7 GLY O 1 1
40 7847 1 1 8 LYS C C -0.366 -1.529 3.482 1.00 . A A . 8 LYS C 1 1
40 7848 1 1 8 LYS CA C -1.264 -2.766 3.782 1.00 . A A . 8 LYS CA 1 1
40 7849 1 1 8 LYS CB C -2.378 -2.506 4.831 1.00 . A A . 8 LYS CB 1 1
40 7850 1 1 8 LYS CD C -4.721 -2.385 3.685 1.00 . A A . 8 LYS CD 1 1
40 7851 1 1 8 LYS CE C -4.497 -2.994 2.285 1.00 . A A . 8 LYS CE 1 1
40 7852 1 1 8 LYS CG C -3.554 -1.626 4.356 1.00 . A A . 8 LYS CG 1 1
40 7853 1 1 8 LYS H H 0.010 -3.626 5.312 1.00 . A A . 8 LYS H 1 1
40 7854 1 1 8 LYS HA H -1.710 -3.171 2.857 1.00 . A A . 8 LYS HA 1 1
40 7855 1 1 8 LYS HB2 H -2.780 -3.466 5.212 1.00 . A A . 8 LYS HB2 1 1
40 7856 1 1 8 LYS HB3 H -1.928 -2.031 5.725 1.00 . A A . 8 LYS HB3 1 1
40 7857 1 1 8 LYS HD2 H -5.036 -3.197 4.368 1.00 . A A . 8 LYS HD2 1 1
40 7858 1 1 8 LYS HD3 H -5.590 -1.705 3.643 1.00 . A A . 8 LYS HD3 1 1
40 7859 1 1 8 LYS HE2 H -3.700 -3.760 2.317 1.00 . A A . 8 LYS HE2 1 1
40 7860 1 1 8 LYS HE3 H -5.405 -3.552 1.990 1.00 . A A . 8 LYS HE3 1 1
40 7861 1 1 8 LYS HG2 H -3.969 -1.122 5.250 1.00 . A A . 8 LYS HG2 1 1
40 7862 1 1 8 LYS HG3 H -3.199 -0.793 3.720 1.00 . A A . 8 LYS HG3 1 1
40 7863 1 1 8 LYS HZ1 H -4.060 -2.398 0.323 1.00 . A A . 8 LYS HZ1 1 1
40 7864 1 1 8 LYS HZ2 H -4.956 -1.293 1.158 1.00 . A A . 8 LYS HZ2 1 1
40 7865 1 1 8 LYS HZ3 H -3.346 -1.449 1.469 1.00 . A A . 8 LYS HZ3 1 1
40 7866 1 1 8 LYS N N -0.319 -3.742 4.356 1.00 . A A . 8 LYS N 1 1
40 7867 1 1 8 LYS NZ N -4.197 -1.978 1.251 1.00 . A A . 8 LYS NZ 1 1
40 7868 1 1 8 LYS O O -0.050 -0.723 4.365 1.00 . A A . 8 LYS O 1 1
40 7869 1 1 9 LEU C C 0.283 1.034 1.695 1.00 . A A . 9 LEU C 1 1
40 7870 1 1 9 LEU CA C 0.973 -0.363 1.732 1.00 . A A . 9 LEU CA 1 1
40 7871 1 1 9 LEU CB C 1.585 -0.739 0.348 1.00 . A A . 9 LEU CB 1 1
40 7872 1 1 9 LEU CD1 C 2.955 -2.225 -1.195 1.00 . A A . 9 LEU CD1 1 1
40 7873 1 1 9 LEU CD2 C 3.904 -1.644 1.062 1.00 . A A . 9 LEU CD2 1 1
40 7874 1 1 9 LEU CG C 2.608 -1.915 0.275 1.00 . A A . 9 LEU CG 1 1
40 7875 1 1 9 LEU H H -0.275 -2.216 1.642 1.00 . A A . 9 LEU H 1 1
40 7876 1 1 9 LEU HA H 1.827 -0.309 2.437 1.00 . A A . 9 LEU HA 1 1
40 7877 1 1 9 LEU HB2 H 0.754 -0.935 -0.359 1.00 . A A . 9 LEU HB2 1 1
40 7878 1 1 9 LEU HB3 H 2.085 0.158 -0.070 1.00 . A A . 9 LEU HB3 1 1
40 7879 1 1 9 LEU HD11 H 3.647 -3.084 -1.280 1.00 . A A . 9 LEU HD11 1 1
40 7880 1 1 9 LEU HD12 H 2.054 -2.487 -1.780 1.00 . A A . 9 LEU HD12 1 1
40 7881 1 1 9 LEU HD13 H 3.437 -1.366 -1.701 1.00 . A A . 9 LEU HD13 1 1
40 7882 1 1 9 LEU HD21 H 4.415 -0.726 0.717 1.00 . A A . 9 LEU HD21 1 1
40 7883 1 1 9 LEU HD22 H 3.710 -1.530 2.143 1.00 . A A . 9 LEU HD22 1 1
40 7884 1 1 9 LEU HD23 H 4.625 -2.478 0.965 1.00 . A A . 9 LEU HD23 1 1
40 7885 1 1 9 LEU HG H 2.160 -2.835 0.692 1.00 . A A . 9 LEU HG 1 1
40 7886 1 1 9 LEU N N 0.062 -1.437 2.214 1.00 . A A . 9 LEU N 1 1
40 7887 1 1 9 LEU O O -0.482 1.348 0.777 1.00 . A A . 9 LEU O 1 1
40 7888 1 1 10 ILE C C 1.276 4.170 2.854 1.00 . A A . 10 ILE C 1 1
40 7889 1 1 10 ILE CA C 0.035 3.224 2.878 1.00 . A A . 10 ILE CA 1 1
40 7890 1 1 10 ILE CB C -0.936 3.321 4.115 1.00 . A A . 10 ILE CB 1 1
40 7891 1 1 10 ILE CD1 C -2.826 4.832 3.147 1.00 . A A . 10 ILE CD1 1 1
40 7892 1 1 10 ILE CG1 C -1.713 4.668 4.194 1.00 . A A . 10 ILE CG1 1 1
40 7893 1 1 10 ILE CG2 C -0.305 3.006 5.496 1.00 . A A . 10 ILE CG2 1 1
40 7894 1 1 10 ILE H H 1.156 1.425 3.455 1.00 . A A . 10 ILE H 1 1
40 7895 1 1 10 ILE HA H -0.587 3.472 1.995 1.00 . A A . 10 ILE HA 1 1
40 7896 1 1 10 ILE HB H -1.701 2.533 3.973 1.00 . A A . 10 ILE HB 1 1
40 7897 1 1 10 ILE HD11 H -2.434 4.841 2.115 1.00 . A A . 10 ILE HD11 1 1
40 7898 1 1 10 ILE HD12 H -3.570 4.015 3.214 1.00 . A A . 10 ILE HD12 1 1
40 7899 1 1 10 ILE HD13 H -3.374 5.781 3.297 1.00 . A A . 10 ILE HD13 1 1
40 7900 1 1 10 ILE HG12 H -2.194 4.770 5.186 1.00 . A A . 10 ILE HG12 1 1
40 7901 1 1 10 ILE HG13 H -1.012 5.523 4.133 1.00 . A A . 10 ILE HG13 1 1
40 7902 1 1 10 ILE HG21 H 0.205 2.027 5.499 1.00 . A A . 10 ILE HG21 1 1
40 7903 1 1 10 ILE HG22 H 0.436 3.763 5.812 1.00 . A A . 10 ILE HG22 1 1
40 7904 1 1 10 ILE HG23 H -1.070 2.958 6.293 1.00 . A A . 10 ILE HG23 1 1
40 7905 1 1 10 ILE N N 0.572 1.846 2.727 1.00 . A A . 10 ILE N 1 1
40 7906 1 1 10 ILE O O 1.875 4.467 3.891 1.00 . A A . 10 ILE O 1 1
40 7907 1 1 11 GLU C C 2.408 6.843 0.719 1.00 . A A . 11 GLU C 1 1
40 7908 1 1 11 GLU CA C 2.840 5.505 1.423 1.00 . A A . 11 GLU CA 1 1
40 7909 1 1 11 GLU CB C 3.931 4.669 0.670 1.00 . A A . 11 GLU CB 1 1
40 7910 1 1 11 GLU CD C 5.099 3.414 2.697 1.00 . A A . 11 GLU CD 1 1
40 7911 1 1 11 GLU CG C 5.209 4.360 1.482 1.00 . A A . 11 GLU CG 1 1
40 7912 1 1 11 GLU H H 1.159 4.198 0.852 1.00 . A A . 11 GLU H 1 1
40 7913 1 1 11 GLU HA H 3.287 5.807 2.392 1.00 . A A . 11 GLU HA 1 1
40 7914 1 1 11 GLU HB2 H 3.534 3.721 0.251 1.00 . A A . 11 GLU HB2 1 1
40 7915 1 1 11 GLU HB3 H 4.267 5.204 -0.237 1.00 . A A . 11 GLU HB3 1 1
40 7916 1 1 11 GLU HG2 H 5.975 3.958 0.792 1.00 . A A . 11 GLU HG2 1 1
40 7917 1 1 11 GLU HG3 H 5.642 5.321 1.822 1.00 . A A . 11 GLU HG3 1 1
40 7918 1 1 11 GLU N N 1.670 4.604 1.642 1.00 . A A . 11 GLU N 1 1
40 7919 1 1 11 GLU O O 2.998 7.246 -0.288 1.00 . A A . 11 GLU O 1 1
40 7920 1 1 11 GLU OE1 O 5.287 3.873 3.826 1.00 . A A . 11 GLU OE1 1 1
40 7921 1 1 12 THR C C 0.450 9.729 1.913 1.00 . A A . 12 THR C 1 1
40 7922 1 1 12 THR CA C 0.883 8.841 0.706 1.00 . A A . 12 THR CA 1 1
40 7923 1 1 12 THR CB C -0.213 8.620 -0.391 1.00 . A A . 12 THR CB 1 1
40 7924 1 1 12 THR CG2 C -0.736 9.919 -1.030 1.00 . A A . 12 THR CG2 1 1
40 7925 1 1 12 THR H H 0.982 7.145 2.109 1.00 . A A . 12 THR H 1 1
40 7926 1 1 12 THR HA H 1.722 9.375 0.218 1.00 . A A . 12 THR HA 1 1
40 7927 1 1 12 THR HB H -1.073 8.083 0.054 1.00 . A A . 12 THR HB 1 1
40 7928 1 1 12 THR HG1 H -0.396 7.786 -2.116 1.00 . A A . 12 THR HG1 1 1
40 7929 1 1 12 THR HG21 H -1.495 9.711 -1.806 1.00 . A A . 12 THR HG21 1 1
40 7930 1 1 12 THR HG22 H -1.214 10.583 -0.285 1.00 . A A . 12 THR HG22 1 1
40 7931 1 1 12 THR HG23 H 0.076 10.495 -1.510 1.00 . A A . 12 THR HG23 1 1
40 7932 1 1 12 THR N N 1.398 7.556 1.268 1.00 . A A . 12 THR N 1 1
40 7933 1 1 12 THR O O 1.149 10.697 2.221 1.00 . A A . 12 THR O 1 1
40 7934 1 1 12 THR OG1 O 0.298 7.825 -1.455 1.00 . A A . 12 THR OG1 1 1
40 7935 1 1 13 THR C C -1.827 9.149 4.696 1.00 . A A . 13 THR C 1 1
40 7936 1 1 13 THR CA C -1.183 10.199 3.744 1.00 . A A . 13 THR CA 1 1
40 7937 1 1 13 THR CB C -2.156 11.344 3.322 1.00 . A A . 13 THR CB 1 1
40 7938 1 1 13 THR CG2 C -2.624 12.221 4.494 1.00 . A A . 13 THR CG2 1 1
40 7939 1 1 13 THR H H -1.276 8.710 2.135 1.00 . A A . 13 THR H 1 1
40 7940 1 1 13 THR HA H -0.323 10.676 4.261 1.00 . A A . 13 THR HA 1 1
40 7941 1 1 13 THR HB H -3.049 10.908 2.833 1.00 . A A . 13 THR HB 1 1
40 7942 1 1 13 THR HG1 H -0.706 12.499 2.794 1.00 . A A . 13 THR HG1 1 1
40 7943 1 1 13 THR HG21 H -1.772 12.696 5.017 1.00 . A A . 13 THR HG21 1 1
40 7944 1 1 13 THR HG22 H -3.292 13.030 4.146 1.00 . A A . 13 THR HG22 1 1
40 7945 1 1 13 THR HG23 H -3.190 11.636 5.242 1.00 . A A . 13 THR HG23 1 1
40 7946 1 1 13 THR N N -0.692 9.430 2.572 1.00 . A A . 13 THR N 1 1
40 7947 1 1 13 THR O O -2.953 8.693 4.464 1.00 . A A . 13 THR O 1 1
40 7948 1 1 13 THR OG1 O -1.527 12.216 2.385 1.00 . A A . 13 THR OG1 1 1
40 7949 1 1 14 ALA C C -2.182 8.498 7.979 1.00 . A A . 14 ALA C 1 1
40 7950 1 1 14 ALA CA C -1.573 7.777 6.758 1.00 . A A . 14 ALA CA 1 1
40 7951 1 1 14 ALA CB C -0.397 6.871 7.160 1.00 . A A . 14 ALA CB 1 1
40 7952 1 1 14 ALA H H -0.177 9.213 5.836 1.00 . A A . 14 ALA H 1 1
40 7953 1 1 14 ALA HXT H -3.894 8.732 8.853 1.00 . A A . 14 ALA HXT 1 1
40 7954 1 1 14 ALA HA H -2.342 7.116 6.310 1.00 . A A . 14 ALA HA 1 1
40 7955 1 1 14 ALA HB1 H 0.040 6.350 6.287 1.00 . A A . 14 ALA HB1 1 1
40 7956 1 1 14 ALA HB2 H 0.422 7.433 7.648 1.00 . A A . 14 ALA HB2 1 1
40 7957 1 1 14 ALA HB3 H -0.714 6.085 7.869 1.00 . A A . 14 ALA HB3 1 1
40 7958 1 1 14 ALA N N -1.098 8.768 5.762 1.00 . A A . 14 ALA N 1 1
40 7959 1 1 14 ALA O O -1.538 9.201 8.759 1.00 . A A . 14 ALA O 1 1
40 7960 1 1 14 ALA OXT O -3.529 8.273 8.093 1.00 . A A . 14 ALA OXT 1 1
41 7961 1 1 1 ACE C C 7.669 7.456 0.398 1.00 . A A . 1 ACE C 1 1
41 7962 1 1 1 ACE CH3 C 8.022 8.772 -0.288 1.00 . A A . 1 ACE CH3 1 1
41 7963 1 1 1 ACE H1 H 9.094 8.816 -0.554 1.00 . A A . 1 ACE H1 1 1
41 7964 1 1 1 ACE H2 H 7.447 8.899 -1.223 1.00 . A A . 1 ACE H2 1 1
41 7965 1 1 1 ACE H3 H 7.792 9.640 0.358 1.00 . A A . 1 ACE H3 1 1
41 7966 1 1 1 ACE O O 6.849 6.689 -0.111 1.00 . A A . 1 ACE O 1 1
41 7967 1 1 2 ILE C C 7.668 6.504 3.778 1.00 . A A . 2 ILE C 1 1
41 7968 1 1 2 ILE CA C 8.104 5.991 2.369 1.00 . A A . 2 ILE CA 1 1
41 7969 1 1 2 ILE CB C 9.374 5.060 2.390 1.00 . A A . 2 ILE CB 1 1
41 7970 1 1 2 ILE CD1 C 8.879 3.692 0.174 1.00 . A A . 2 ILE CD1 1 1
41 7971 1 1 2 ILE CG1 C 9.856 4.559 0.992 1.00 . A A . 2 ILE CG1 1 1
41 7972 1 1 2 ILE CG2 C 9.234 3.847 3.348 1.00 . A A . 2 ILE CG2 1 1
41 7973 1 1 2 ILE H H 8.931 7.979 1.853 1.00 . A A . 2 ILE H 1 1
41 7974 1 1 2 ILE HA H 7.286 5.370 1.944 1.00 . A A . 2 ILE HA 1 1
41 7975 1 1 2 ILE HB H 10.208 5.665 2.795 1.00 . A A . 2 ILE HB 1 1
41 7976 1 1 2 ILE HD11 H 7.949 4.238 -0.070 1.00 . A A . 2 ILE HD11 1 1
41 7977 1 1 2 ILE HD12 H 9.332 3.384 -0.785 1.00 . A A . 2 ILE HD12 1 1
41 7978 1 1 2 ILE HD13 H 8.593 2.769 0.710 1.00 . A A . 2 ILE HD13 1 1
41 7979 1 1 2 ILE HG12 H 10.143 5.430 0.374 1.00 . A A . 2 ILE HG12 1 1
41 7980 1 1 2 ILE HG13 H 10.800 3.994 1.114 1.00 . A A . 2 ILE HG13 1 1
41 7981 1 1 2 ILE HG21 H 10.148 3.224 3.362 1.00 . A A . 2 ILE HG21 1 1
41 7982 1 1 2 ILE HG22 H 9.059 4.164 4.394 1.00 . A A . 2 ILE HG22 1 1
41 7983 1 1 2 ILE HG23 H 8.392 3.188 3.068 1.00 . A A . 2 ILE HG23 1 1
41 7984 1 1 2 ILE N N 8.314 7.219 1.547 1.00 . A A . 2 ILE N 1 1
41 7985 1 1 2 ILE O O 8.501 6.970 4.563 1.00 . A A . 2 ILE O 1 1
41 7986 1 1 3 TRP C C 4.924 5.691 5.959 1.00 . A A . 3 TRP C 1 1
41 7987 1 1 3 TRP CA C 5.786 6.850 5.382 1.00 . A A . 3 TRP CA 1 1
41 7988 1 1 3 TRP CB C 5.006 8.191 5.239 1.00 . A A . 3 TRP CB 1 1
41 7989 1 1 3 TRP CD1 C 6.768 10.075 4.786 1.00 . A A . 3 TRP CD1 1 1
41 7990 1 1 3 TRP CD2 C 5.790 10.164 6.781 1.00 . A A . 3 TRP CD2 1 1
41 7991 1 1 3 TRP CE2 C 6.706 11.237 6.654 1.00 . A A . 3 TRP CE2 1 1
41 7992 1 1 3 TRP CE3 C 5.056 9.984 7.982 1.00 . A A . 3 TRP CE3 1 1
41 7993 1 1 3 TRP CG C 5.817 9.437 5.604 1.00 . A A . 3 TRP CG 1 1
41 7994 1 1 3 TRP CH2 C 6.145 11.961 8.895 1.00 . A A . 3 TRP CH2 1 1
41 7995 1 1 3 TRP CZ2 C 6.885 12.146 7.725 1.00 . A A . 3 TRP CZ2 1 1
41 7996 1 1 3 TRP CZ3 C 5.245 10.895 9.021 1.00 . A A . 3 TRP CZ3 1 1
41 7997 1 1 3 TRP H H 5.785 5.977 3.349 1.00 . A A . 3 TRP H 1 1
41 7998 1 1 3 TRP HA H 6.595 7.017 6.124 1.00 . A A . 3 TRP HA 1 1
41 7999 1 1 3 TRP HB2 H 4.583 8.306 4.223 1.00 . A A . 3 TRP HB2 1 1
41 8000 1 1 3 TRP HB3 H 4.109 8.185 5.887 1.00 . A A . 3 TRP HB3 1 1
41 8001 1 1 3 TRP HD1 H 7.057 9.718 3.811 1.00 . A A . 3 TRP HD1 1 1
41 8002 1 1 3 TRP HE1 H 8.054 11.834 5.057 1.00 . A A . 3 TRP HE1 1 1
41 8003 1 1 3 TRP HE3 H 4.373 9.156 8.099 1.00 . A A . 3 TRP HE3 1 1
41 8004 1 1 3 TRP HH2 H 6.273 12.649 9.719 1.00 . A A . 3 TRP HH2 1 1
41 8005 1 1 3 TRP HZ2 H 7.583 12.968 7.643 1.00 . A A . 3 TRP HZ2 1 1
41 8006 1 1 3 TRP HZ3 H 4.691 10.771 9.940 1.00 . A A . 3 TRP HZ3 1 1
41 8007 1 1 3 TRP N N 6.358 6.423 4.075 1.00 . A A . 3 TRP N 1 1
41 8008 1 1 3 TRP NE1 N 7.331 11.202 5.418 1.00 . A A . 3 TRP NE1 1 1
41 8009 1 1 3 TRP O O 3.690 5.707 5.902 1.00 . A A . 3 TRP O 1 1
41 8010 1 1 4 GLY C C 4.214 2.544 6.190 1.00 . A A . 4 GLY C 1 1
41 8011 1 1 4 GLY CA C 4.975 3.497 7.134 1.00 . A A . 4 GLY CA 1 1
41 8012 1 1 4 GLY H H 6.633 4.805 6.448 1.00 . A A . 4 GLY H 1 1
41 8013 1 1 4 GLY HA2 H 5.750 2.932 7.685 1.00 . A A . 4 GLY HA2 1 1
41 8014 1 1 4 GLY HA3 H 4.281 3.831 7.927 1.00 . A A . 4 GLY HA3 1 1
41 8015 1 1 4 GLY N N 5.616 4.680 6.513 1.00 . A A . 4 GLY N 1 1
41 8016 1 1 4 GLY O O 2.995 2.672 6.050 1.00 . A A . 4 GLY O 1 1
41 8017 1 1 5 . C C 4.773 0.782 3.161 1.00 . A A . 5 SET C 1 1
41 8018 1 1 5 . CA C 4.332 0.588 4.655 1.00 . A A . 5 SET CA 1 1
41 8019 1 1 5 . CB C 4.808 -0.827 5.116 1.00 . A A . 5 SET CB 1 1
41 8020 1 1 5 . H H 5.944 1.627 5.757 1.00 . A A . 5 SET H 1 1
41 8021 1 1 5 . HA H 3.227 0.621 4.779 1.00 . A A . 5 SET HA 1 1
41 8022 1 1 5 . HB2 H 5.881 0.774 3.105 1.00 . A A . 5 SET HB2 1 1
41 8023 1 1 5 . HB3 H 4.491 -0.133 2.609 1.00 . A A . 5 SET HB3 1 1
41 8024 1 1 5 . HNT2 H 3.587 1.704 1.561 1.00 . A A . 5 SET HNT2 1 1
41 8025 1 1 5 . N N 4.936 1.594 5.572 1.00 . A A . 5 SET N 1 1
41 8026 1 1 5 . NT N 4.252 1.904 2.327 1.00 . A A . 5 SET NT 1 1
41 8027 1 1 5 . OG O 6.011 -1.114 5.140 1.00 . A A . 5 SET OG 1 1
41 8028 1 1 6 SER C C 2.791 -3.876 5.784 1.00 . A A . 6 SER C 1 1
41 8029 1 1 6 SER CA C 4.132 -3.104 5.918 1.00 . A A . 6 SER CA 1 1
41 8030 1 1 6 SER CB C 4.673 -3.179 7.370 1.00 . A A . 6 SER CB 1 1
41 8031 1 1 6 SER H H 2.893 -1.370 5.327 1.00 . A A . 6 SER H 1 1
41 8032 1 1 6 SER HA H 4.889 -3.562 5.248 1.00 . A A . 6 SER HA 1 1
41 8033 1 1 6 SER HB2 H 4.031 -2.605 8.066 1.00 . A A . 6 SER HB2 1 1
41 8034 1 1 6 SER HB3 H 4.658 -4.222 7.738 1.00 . A A . 6 SER HB3 1 1
41 8035 1 1 6 SER HG H 6.046 -1.911 6.900 1.00 . A A . 6 SER HG 1 1
41 8036 1 1 6 SER N N 3.853 -1.708 5.468 1.00 . A A . 6 SER N 1 1
41 8037 1 1 6 SER O O 1.876 -3.666 6.589 1.00 . A A . 6 SER O 1 1
41 8038 1 1 6 SER OG O 6.011 -2.700 7.449 1.00 . A A . 6 SER OG 1 1
41 8039 1 1 7 GLY C C 0.410 -4.672 3.690 1.00 . A A . 7 GLY C 1 1
41 8040 1 1 7 GLY CA C 1.401 -5.514 4.527 1.00 . A A . 7 GLY CA 1 1
41 8041 1 1 7 GLY H H 3.498 -4.899 4.189 1.00 . A A . 7 GLY H 1 1
41 8042 1 1 7 GLY HA2 H 1.641 -6.443 3.978 1.00 . A A . 7 GLY HA2 1 1
41 8043 1 1 7 GLY HA3 H 0.938 -5.851 5.475 1.00 . A A . 7 GLY HA3 1 1
41 8044 1 1 7 GLY N N 2.662 -4.758 4.767 1.00 . A A . 7 GLY N 1 1
41 8045 1 1 7 GLY O O 0.230 -4.907 2.493 1.00 . A A . 7 GLY O 1 1
41 8046 1 1 8 LYS C C -0.275 -1.490 3.420 1.00 . A A . 8 LYS C 1 1
41 8047 1 1 8 LYS CA C -1.158 -2.729 3.746 1.00 . A A . 8 LYS CA 1 1
41 8048 1 1 8 LYS CB C -2.308 -2.447 4.751 1.00 . A A . 8 LYS CB 1 1
41 8049 1 1 8 LYS CD C -4.205 -1.673 3.107 1.00 . A A . 8 LYS CD 1 1
41 8050 1 1 8 LYS CE C -3.640 -1.093 1.795 1.00 . A A . 8 LYS CE 1 1
41 8051 1 1 8 LYS CG C -3.353 -1.375 4.360 1.00 . A A . 8 LYS CG 1 1
41 8052 1 1 8 LYS H H 0.122 -3.531 5.306 1.00 . A A . 8 LYS H 1 1
41 8053 1 1 8 LYS HA H -1.608 -3.159 2.828 1.00 . A A . 8 LYS HA 1 1
41 8054 1 1 8 LYS HB2 H -2.843 -3.393 4.964 1.00 . A A . 8 LYS HB2 1 1
41 8055 1 1 8 LYS HB3 H -1.878 -2.146 5.727 1.00 . A A . 8 LYS HB3 1 1
41 8056 1 1 8 LYS HD2 H -4.366 -2.765 3.017 1.00 . A A . 8 LYS HD2 1 1
41 8057 1 1 8 LYS HD3 H -5.211 -1.245 3.283 1.00 . A A . 8 LYS HD3 1 1
41 8058 1 1 8 LYS HE2 H -3.446 -0.007 1.905 1.00 . A A . 8 LYS HE2 1 1
41 8059 1 1 8 LYS HE3 H -2.662 -1.548 1.554 1.00 . A A . 8 LYS HE3 1 1
41 8060 1 1 8 LYS HG2 H -4.042 -1.273 5.219 1.00 . A A . 8 LYS HG2 1 1
41 8061 1 1 8 LYS HG3 H -2.873 -0.379 4.284 1.00 . A A . 8 LYS HG3 1 1
41 8062 1 1 8 LYS HZ1 H -4.206 -0.935 -0.213 1.00 . A A . 8 LYS HZ1 1 1
41 8063 1 1 8 LYS HZ2 H -4.747 -2.316 0.512 1.00 . A A . 8 LYS HZ2 1 1
41 8064 1 1 8 LYS HZ3 H -5.481 -0.875 0.831 1.00 . A A . 8 LYS HZ3 1 1
41 8065 1 1 8 LYS N N -0.226 -3.695 4.361 1.00 . A A . 8 LYS N 1 1
41 8066 1 1 8 LYS NZ N -4.568 -1.317 0.668 1.00 . A A . 8 LYS NZ 1 1
41 8067 1 1 8 LYS O O 0.046 -0.677 4.294 1.00 . A A . 8 LYS O 1 1
41 8068 1 1 9 LEU C C 0.213 1.072 1.614 1.00 . A A . 9 LEU C 1 1
41 8069 1 1 9 LEU CA C 0.985 -0.285 1.636 1.00 . A A . 9 LEU CA 1 1
41 8070 1 1 9 LEU CB C 1.565 -0.634 0.230 1.00 . A A . 9 LEU CB 1 1
41 8071 1 1 9 LEU CD1 C 2.474 -3.059 0.521 1.00 . A A . 9 LEU CD1 1 1
41 8072 1 1 9 LEU CD2 C 3.458 -1.539 -1.224 1.00 . A A . 9 LEU CD2 1 1
41 8073 1 1 9 LEU CG C 2.792 -1.594 0.167 1.00 . A A . 9 LEU CG 1 1
41 8074 1 1 9 LEU H H -0.075 -2.238 1.609 1.00 . A A . 9 LEU H 1 1
41 8075 1 1 9 LEU HA H 1.856 -0.195 2.318 1.00 . A A . 9 LEU HA 1 1
41 8076 1 1 9 LEU HB2 H 0.762 -0.997 -0.441 1.00 . A A . 9 LEU HB2 1 1
41 8077 1 1 9 LEU HB3 H 1.889 0.318 -0.236 1.00 . A A . 9 LEU HB3 1 1
41 8078 1 1 9 LEU HD11 H 3.363 -3.709 0.413 1.00 . A A . 9 LEU HD11 1 1
41 8079 1 1 9 LEU HD12 H 2.145 -3.165 1.570 1.00 . A A . 9 LEU HD12 1 1
41 8080 1 1 9 LEU HD13 H 1.680 -3.483 -0.123 1.00 . A A . 9 LEU HD13 1 1
41 8081 1 1 9 LEU HD21 H 2.779 -1.887 -2.026 1.00 . A A . 9 LEU HD21 1 1
41 8082 1 1 9 LEU HD22 H 3.776 -0.514 -1.487 1.00 . A A . 9 LEU HD22 1 1
41 8083 1 1 9 LEU HD23 H 4.367 -2.169 -1.269 1.00 . A A . 9 LEU HD23 1 1
41 8084 1 1 9 LEU HG H 3.542 -1.235 0.894 1.00 . A A . 9 LEU HG 1 1
41 8085 1 1 9 LEU N N 0.120 -1.385 2.141 1.00 . A A . 9 LEU N 1 1
41 8086 1 1 9 LEU O O -0.644 1.308 0.756 1.00 . A A . 9 LEU O 1 1
41 8087 1 1 10 ILE C C 1.080 4.252 3.135 1.00 . A A . 10 ILE C 1 1
41 8088 1 1 10 ILE CA C -0.078 3.281 2.745 1.00 . A A . 10 ILE CA 1 1
41 8089 1 1 10 ILE CB C -1.328 3.230 3.705 1.00 . A A . 10 ILE CB 1 1
41 8090 1 1 10 ILE CD1 C -2.840 4.947 2.460 1.00 . A A . 10 ILE CD1 1 1
41 8091 1 1 10 ILE CG1 C -2.129 4.561 3.766 1.00 . A A . 10 ILE CG1 1 1
41 8092 1 1 10 ILE CG2 C -1.050 2.741 5.152 1.00 . A A . 10 ILE CG2 1 1
41 8093 1 1 10 ILE H H 1.171 1.570 3.302 1.00 . A A . 10 ILE H 1 1
41 8094 1 1 10 ILE HA H -0.455 3.612 1.756 1.00 . A A . 10 ILE HA 1 1
41 8095 1 1 10 ILE HB H -2.018 2.476 3.276 1.00 . A A . 10 ILE HB 1 1
41 8096 1 1 10 ILE HD11 H -2.124 5.161 1.646 1.00 . A A . 10 ILE HD11 1 1
41 8097 1 1 10 ILE HD12 H -3.513 4.140 2.113 1.00 . A A . 10 ILE HD12 1 1
41 8098 1 1 10 ILE HD13 H -3.456 5.853 2.599 1.00 . A A . 10 ILE HD13 1 1
41 8099 1 1 10 ILE HG12 H -2.908 4.495 4.550 1.00 . A A . 10 ILE HG12 1 1
41 8100 1 1 10 ILE HG13 H -1.472 5.392 4.088 1.00 . A A . 10 ILE HG13 1 1
41 8101 1 1 10 ILE HG21 H -0.501 1.781 5.167 1.00 . A A . 10 ILE HG21 1 1
41 8102 1 1 10 ILE HG22 H -0.454 3.463 5.739 1.00 . A A . 10 ILE HG22 1 1
41 8103 1 1 10 ILE HG23 H -1.989 2.570 5.711 1.00 . A A . 10 ILE HG23 1 1
41 8104 1 1 10 ILE N N 0.536 1.937 2.590 1.00 . A A . 10 ILE N 1 1
41 8105 1 1 10 ILE O O 1.308 4.530 4.316 1.00 . A A . 10 ILE O 1 1
41 8106 1 1 11 GLU C C 2.479 7.198 2.399 1.00 . A A . 11 GLU C 1 1
41 8107 1 1 11 GLU CA C 2.954 5.700 2.365 1.00 . A A . 11 GLU CA 1 1
41 8108 1 1 11 GLU CB C 4.074 5.452 1.311 1.00 . A A . 11 GLU CB 1 1
41 8109 1 1 11 GLU CD C 4.895 3.093 2.252 1.00 . A A . 11 GLU CD 1 1
41 8110 1 1 11 GLU CG C 4.622 4.025 1.039 1.00 . A A . 11 GLU CG 1 1
41 8111 1 1 11 GLU H H 1.584 4.427 1.190 1.00 . A A . 11 GLU H 1 1
41 8112 1 1 11 GLU HA H 3.447 5.450 3.327 1.00 . A A . 11 GLU HA 1 1
41 8113 1 1 11 GLU HB2 H 3.755 5.865 0.334 1.00 . A A . 11 GLU HB2 1 1
41 8114 1 1 11 GLU HB3 H 4.933 6.087 1.596 1.00 . A A . 11 GLU HB3 1 1
41 8115 1 1 11 GLU HG2 H 3.974 3.544 0.286 1.00 . A A . 11 GLU HG2 1 1
41 8116 1 1 11 GLU HG3 H 5.579 4.168 0.492 1.00 . A A . 11 GLU HG3 1 1
41 8117 1 1 11 GLU N N 1.811 4.776 2.128 1.00 . A A . 11 GLU N 1 1
41 8118 1 1 11 GLU O O 2.825 7.979 1.506 1.00 . A A . 11 GLU O 1 1
41 8119 1 1 11 GLU OE1 O 5.721 3.450 3.095 1.00 . A A . 11 GLU OE1 1 1
41 8120 1 1 12 THR C C 1.558 9.551 4.954 1.00 . A A . 12 THR C 1 1
41 8121 1 1 12 THR CA C 1.180 9.010 3.542 1.00 . A A . 12 THR CA 1 1
41 8122 1 1 12 THR CB C -0.331 9.095 3.144 1.00 . A A . 12 THR CB 1 1
41 8123 1 1 12 THR CG2 C -0.903 10.524 3.143 1.00 . A A . 12 THR CG2 1 1
41 8124 1 1 12 THR H H 1.346 6.877 4.050 1.00 . A A . 12 THR H 1 1
41 8125 1 1 12 THR HA H 1.717 9.668 2.830 1.00 . A A . 12 THR HA 1 1
41 8126 1 1 12 THR HB H -0.932 8.483 3.843 1.00 . A A . 12 THR HB 1 1
41 8127 1 1 12 THR HG1 H 0.023 9.104 1.250 1.00 . A A . 12 THR HG1 1 1
41 8128 1 1 12 THR HG21 H -1.965 10.532 2.836 1.00 . A A . 12 THR HG21 1 1
41 8129 1 1 12 THR HG22 H -0.856 10.990 4.145 1.00 . A A . 12 THR HG22 1 1
41 8130 1 1 12 THR HG23 H -0.357 11.187 2.445 1.00 . A A . 12 THR HG23 1 1
41 8131 1 1 12 THR N N 1.693 7.612 3.421 1.00 . A A . 12 THR N 1 1
41 8132 1 1 12 THR O O 2.515 10.324 5.059 1.00 . A A . 12 THR O 1 1
41 8133 1 1 12 THR OG1 O -0.527 8.574 1.832 1.00 . A A . 12 THR OG1 1 1
41 8134 1 1 13 THR C C 0.888 8.387 8.333 1.00 . A A . 13 THR C 1 1
41 8135 1 1 13 THR CA C 1.110 9.621 7.408 1.00 . A A . 13 THR CA 1 1
41 8136 1 1 13 THR CB C 0.250 10.870 7.784 1.00 . A A . 13 THR CB 1 1
41 8137 1 1 13 THR CG2 C 0.573 11.443 9.173 1.00 . A A . 13 THR CG2 1 1
41 8138 1 1 13 THR H H 0.012 8.581 5.809 1.00 . A A . 13 THR H 1 1
41 8139 1 1 13 THR HA H 2.171 9.932 7.490 1.00 . A A . 13 THR HA 1 1
41 8140 1 1 13 THR HB H -0.823 10.599 7.757 1.00 . A A . 13 THR HB 1 1
41 8141 1 1 13 THR HG1 H 1.409 12.087 6.840 1.00 . A A . 13 THR HG1 1 1
41 8142 1 1 13 THR HG21 H 1.636 11.739 9.257 1.00 . A A . 13 THR HG21 1 1
41 8143 1 1 13 THR HG22 H -0.040 12.338 9.386 1.00 . A A . 13 THR HG22 1 1
41 8144 1 1 13 THR HG23 H 0.367 10.711 9.975 1.00 . A A . 13 THR HG23 1 1
41 8145 1 1 13 THR N N 0.825 9.168 6.021 1.00 . A A . 13 THR N 1 1
41 8146 1 1 13 THR O O -0.232 8.125 8.783 1.00 . A A . 13 THR O 1 1
41 8147 1 1 13 THR OG1 O 0.463 11.924 6.849 1.00 . A A . 13 THR OG1 1 1
41 8148 1 1 14 ALA C C 3.292 6.237 10.163 1.00 . A A . 14 ALA C 1 1
41 8149 1 1 14 ALA CA C 1.930 6.425 9.458 1.00 . A A . 14 ALA CA 1 1
41 8150 1 1 14 ALA CB C 1.508 5.174 8.660 1.00 . A A . 14 ALA CB 1 1
41 8151 1 1 14 ALA H H 2.827 7.919 8.110 1.00 . A A . 14 ALA H 1 1
41 8152 1 1 14 ALA HXT H 5.178 6.025 9.764 1.00 . A A . 14 ALA HXT 1 1
41 8153 1 1 14 ALA HA H 1.182 6.573 10.262 1.00 . A A . 14 ALA HA 1 1
41 8154 1 1 14 ALA HB1 H 0.501 5.294 8.221 1.00 . A A . 14 ALA HB1 1 1
41 8155 1 1 14 ALA HB2 H 2.197 4.952 7.826 1.00 . A A . 14 ALA HB2 1 1
41 8156 1 1 14 ALA HB3 H 1.471 4.273 9.302 1.00 . A A . 14 ALA HB3 1 1
41 8157 1 1 14 ALA N N 1.970 7.630 8.595 1.00 . A A . 14 ALA N 1 1
41 8158 1 1 14 ALA O O 3.410 6.181 11.386 1.00 . A A . 14 ALA O 1 1
41 8159 1 1 14 ALA OXT O 4.350 6.138 9.292 1.00 . A A . 14 ALA OXT 1 1
42 8160 1 1 1 ACE C C 7.728 7.057 0.038 1.00 . A A . 1 ACE C 1 1
42 8161 1 1 1 ACE CH3 C 8.096 8.329 -0.721 1.00 . A A . 1 ACE CH3 1 1
42 8162 1 1 1 ACE H1 H 9.144 8.303 -1.072 1.00 . A A . 1 ACE H1 1 1
42 8163 1 1 1 ACE H2 H 7.455 8.459 -1.612 1.00 . A A . 1 ACE H2 1 1
42 8164 1 1 1 ACE H3 H 7.966 9.228 -0.090 1.00 . A A . 1 ACE H3 1 1
42 8165 1 1 1 ACE O O 6.830 6.323 -0.376 1.00 . A A . 1 ACE O 1 1
42 8166 1 1 2 ILE C C 7.912 6.218 3.431 1.00 . A A . 2 ILE C 1 1
42 8167 1 1 2 ILE CA C 8.241 5.634 2.020 1.00 . A A . 2 ILE CA 1 1
42 8168 1 1 2 ILE CB C 9.466 4.646 1.993 1.00 . A A . 2 ILE CB 1 1
42 8169 1 1 2 ILE CD1 C 8.749 3.224 -0.127 1.00 . A A . 2 ILE CD1 1 1
42 8170 1 1 2 ILE CG1 C 9.821 4.072 0.586 1.00 . A A . 2 ILE CG1 1 1
42 8171 1 1 2 ILE CG2 C 9.339 3.476 3.006 1.00 . A A . 2 ILE CG2 1 1
42 8172 1 1 2 ILE H H 9.124 7.560 1.373 1.00 . A A . 2 ILE H 1 1
42 8173 1 1 2 ILE HA H 7.378 5.023 1.674 1.00 . A A . 2 ILE HA 1 1
42 8174 1 1 2 ILE HB H 10.354 5.225 2.315 1.00 . A A . 2 ILE HB 1 1
42 8175 1 1 2 ILE HD11 H 8.458 2.337 0.465 1.00 . A A . 2 ILE HD11 1 1
42 8176 1 1 2 ILE HD12 H 7.832 3.805 -0.330 1.00 . A A . 2 ILE HD12 1 1
42 8177 1 1 2 ILE HD13 H 9.118 2.857 -1.101 1.00 . A A . 2 ILE HD13 1 1
42 8178 1 1 2 ILE HG12 H 10.099 4.905 -0.084 1.00 . A A . 2 ILE HG12 1 1
42 8179 1 1 2 ILE HG13 H 10.745 3.467 0.664 1.00 . A A . 2 ILE HG13 1 1
42 8180 1 1 2 ILE HG21 H 10.221 2.809 2.980 1.00 . A A . 2 ILE HG21 1 1
42 8181 1 1 2 ILE HG22 H 9.255 3.837 4.048 1.00 . A A . 2 ILE HG22 1 1
42 8182 1 1 2 ILE HG23 H 8.449 2.850 2.810 1.00 . A A . 2 ILE HG23 1 1
42 8183 1 1 2 ILE N N 8.452 6.821 1.140 1.00 . A A . 2 ILE N 1 1
42 8184 1 1 2 ILE O O 8.820 6.553 4.200 1.00 . A A . 2 ILE O 1 1
42 8185 1 1 3 TRP C C 5.265 5.777 5.753 1.00 . A A . 3 TRP C 1 1
42 8186 1 1 3 TRP CA C 6.138 6.867 5.068 1.00 . A A . 3 TRP CA 1 1
42 8187 1 1 3 TRP CB C 5.413 8.234 4.933 1.00 . A A . 3 TRP CB 1 1
42 8188 1 1 3 TRP CD1 C 6.975 9.972 3.778 1.00 . A A . 3 TRP CD1 1 1
42 8189 1 1 3 TRP CD2 C 6.747 10.250 5.968 1.00 . A A . 3 TRP CD2 1 1
42 8190 1 1 3 TRP CE2 C 7.599 11.257 5.450 1.00 . A A . 3 TRP CE2 1 1
42 8191 1 1 3 TRP CE3 C 6.471 10.189 7.357 1.00 . A A . 3 TRP CE3 1 1
42 8192 1 1 3 TRP CG C 6.345 9.448 4.916 1.00 . A A . 3 TRP CG 1 1
42 8193 1 1 3 TRP CH2 C 7.869 12.155 7.680 1.00 . A A . 3 TRP CH2 1 1
42 8194 1 1 3 TRP CZ2 C 8.166 12.223 6.317 1.00 . A A . 3 TRP CZ2 1 1
42 8195 1 1 3 TRP CZ3 C 7.036 11.152 8.192 1.00 . A A . 3 TRP CZ3 1 1
42 8196 1 1 3 TRP H H 5.968 6.010 3.027 1.00 . A A . 3 TRP H 1 1
42 8197 1 1 3 TRP HA H 6.996 7.036 5.753 1.00 . A A . 3 TRP HA 1 1
42 8198 1 1 3 TRP HB2 H 4.759 8.244 4.041 1.00 . A A . 3 TRP HB2 1 1
42 8199 1 1 3 TRP HB3 H 4.711 8.374 5.777 1.00 . A A . 3 TRP HB3 1 1
42 8200 1 1 3 TRP HD1 H 6.890 9.526 2.804 1.00 . A A . 3 TRP HD1 1 1
42 8201 1 1 3 TRP HE1 H 8.330 11.667 3.444 1.00 . A A . 3 TRP HE1 1 1
42 8202 1 1 3 TRP HE3 H 5.854 9.404 7.763 1.00 . A A . 3 TRP HE3 1 1
42 8203 1 1 3 TRP HH2 H 8.296 12.886 8.353 1.00 . A A . 3 TRP HH2 1 1
42 8204 1 1 3 TRP HZ2 H 8.818 12.995 5.935 1.00 . A A . 3 TRP HZ2 1 1
42 8205 1 1 3 TRP HZ3 H 6.833 11.118 9.253 1.00 . A A . 3 TRP HZ3 1 1
42 8206 1 1 3 TRP N N 6.611 6.357 3.746 1.00 . A A . 3 TRP N 1 1
42 8207 1 1 3 TRP NE1 N 7.758 11.102 4.082 1.00 . A A . 3 TRP NE1 1 1
42 8208 1 1 3 TRP O O 4.039 5.885 5.870 1.00 . A A . 3 TRP O 1 1
42 8209 1 1 4 GLY C C 4.474 2.635 6.040 1.00 . A A . 4 GLY C 1 1
42 8210 1 1 4 GLY CA C 5.332 3.575 6.909 1.00 . A A . 4 GLY CA 1 1
42 8211 1 1 4 GLY H H 6.946 4.778 5.940 1.00 . A A . 4 GLY H 1 1
42 8212 1 1 4 GLY HA2 H 6.130 3.002 7.419 1.00 . A A . 4 GLY HA2 1 1
42 8213 1 1 4 GLY HA3 H 4.701 3.947 7.739 1.00 . A A . 4 GLY HA3 1 1
42 8214 1 1 4 GLY N N 5.956 4.721 6.210 1.00 . A A . 4 GLY N 1 1
42 8215 1 1 4 GLY O O 3.277 2.885 5.871 1.00 . A A . 4 GLY O 1 1
42 8216 1 1 5 . C C 4.696 0.691 3.145 1.00 . A A . 5 SET C 1 1
42 8217 1 1 5 . CA C 4.371 0.558 4.675 1.00 . A A . 5 SET CA 1 1
42 8218 1 1 5 . CB C 4.816 -0.865 5.138 1.00 . A A . 5 SET CB 1 1
42 8219 1 1 5 . H H 6.087 1.485 5.717 1.00 . A A . 5 SET H 1 1
42 8220 1 1 5 . HA H 3.282 0.648 4.888 1.00 . A A . 5 SET HA 1 1
42 8221 1 1 5 . HB2 H 5.793 0.607 2.999 1.00 . A A . 5 SET HB2 1 1
42 8222 1 1 5 . HB3 H 4.310 -0.216 2.645 1.00 . A A . 5 SET HB3 1 1
42 8223 1 1 5 . HNT2 H 3.451 1.659 1.617 1.00 . A A . 5 SET HNT2 1 1
42 8224 1 1 5 . N N 5.085 1.560 5.513 1.00 . A A . 5 SET N 1 1
42 8225 1 1 5 . NT N 4.184 1.828 2.328 1.00 . A A . 5 SET NT 1 1
42 8226 1 1 5 . OG O 6.003 -1.204 5.084 1.00 . A A . 5 SET OG 1 1
42 8227 1 1 6 SER C C 2.773 -3.870 5.836 1.00 . A A . 6 SER C 1 1
42 8228 1 1 6 SER CA C 4.102 -3.093 6.032 1.00 . A A . 6 SER CA 1 1
42 8229 1 1 6 SER CB C 4.572 -3.152 7.509 1.00 . A A . 6 SER CB 1 1
42 8230 1 1 6 SER H H 2.894 -1.329 5.470 1.00 . A A . 6 SER H 1 1
42 8231 1 1 6 SER HA H 4.894 -3.555 5.408 1.00 . A A . 6 SER HA 1 1
42 8232 1 1 6 SER HB2 H 3.865 -2.618 8.174 1.00 . A A . 6 SER HB2 1 1
42 8233 1 1 6 SER HB3 H 4.588 -4.200 7.863 1.00 . A A . 6 SER HB3 1 1
42 8234 1 1 6 SER HG H 6.087 -2.668 8.600 1.00 . A A . 6 SER HG 1 1
42 8235 1 1 6 SER N N 3.847 -1.697 5.567 1.00 . A A . 6 SER N 1 1
42 8236 1 1 6 SER O O 1.829 -3.688 6.616 1.00 . A A . 6 SER O 1 1
42 8237 1 1 6 SER OG O 5.877 -2.605 7.665 1.00 . A A . 6 SER OG 1 1
42 8238 1 1 7 GLY C C 0.453 -4.655 3.652 1.00 . A A . 7 GLY C 1 1
42 8239 1 1 7 GLY CA C 1.442 -5.493 4.495 1.00 . A A . 7 GLY CA 1 1
42 8240 1 1 7 GLY H H 3.537 -4.829 4.231 1.00 . A A . 7 GLY H 1 1
42 8241 1 1 7 GLY HA2 H 1.715 -6.404 3.932 1.00 . A A . 7 GLY HA2 1 1
42 8242 1 1 7 GLY HA3 H 0.959 -5.862 5.422 1.00 . A A . 7 GLY HA3 1 1
42 8243 1 1 7 GLY N N 2.684 -4.726 4.794 1.00 . A A . 7 GLY N 1 1
42 8244 1 1 7 GLY O O 0.304 -4.875 2.448 1.00 . A A . 7 GLY O 1 1
42 8245 1 1 8 LYS C C -0.302 -1.497 3.376 1.00 . A A . 8 LYS C 1 1
42 8246 1 1 8 LYS CA C -1.161 -2.752 3.703 1.00 . A A . 8 LYS CA 1 1
42 8247 1 1 8 LYS CB C -2.319 -2.485 4.703 1.00 . A A . 8 LYS CB 1 1
42 8248 1 1 8 LYS CD C -4.230 -1.745 3.056 1.00 . A A . 8 LYS CD 1 1
42 8249 1 1 8 LYS CE C -3.670 -1.166 1.741 1.00 . A A . 8 LYS CE 1 1
42 8250 1 1 8 LYS CG C -3.381 -1.431 4.307 1.00 . A A . 8 LYS CG 1 1
42 8251 1 1 8 LYS H H 0.110 -3.540 5.275 1.00 . A A . 8 LYS H 1 1
42 8252 1 1 8 LYS HA H -1.602 -3.191 2.786 1.00 . A A . 8 LYS HA 1 1
42 8253 1 1 8 LYS HB2 H -2.840 -3.440 4.916 1.00 . A A . 8 LYS HB2 1 1
42 8254 1 1 8 LYS HB3 H -1.898 -2.175 5.680 1.00 . A A . 8 LYS HB3 1 1
42 8255 1 1 8 LYS HD2 H -4.378 -2.839 2.971 1.00 . A A . 8 LYS HD2 1 1
42 8256 1 1 8 LYS HD3 H -5.239 -1.328 3.229 1.00 . A A . 8 LYS HD3 1 1
42 8257 1 1 8 LYS HE2 H -3.484 -0.078 1.847 1.00 . A A . 8 LYS HE2 1 1
42 8258 1 1 8 LYS HE3 H -2.689 -1.614 1.501 1.00 . A A . 8 LYS HE3 1 1
42 8259 1 1 8 LYS HG2 H -4.072 -1.337 5.167 1.00 . A A . 8 LYS HG2 1 1
42 8260 1 1 8 LYS HG3 H -2.916 -0.429 4.228 1.00 . A A . 8 LYS HG3 1 1
42 8261 1 1 8 LYS HZ1 H -4.768 -2.402 0.462 1.00 . A A . 8 LYS HZ1 1 1
42 8262 1 1 8 LYS HZ2 H -5.514 -0.967 0.779 1.00 . A A . 8 LYS HZ2 1 1
42 8263 1 1 8 LYS HZ3 H -4.240 -1.020 -0.268 1.00 . A A . 8 LYS HZ3 1 1
42 8264 1 1 8 LYS N N -0.219 -3.703 4.323 1.00 . A A . 8 LYS N 1 1
42 8265 1 1 8 LYS NZ N -4.598 -1.402 0.616 1.00 . A A . 8 LYS NZ 1 1
42 8266 1 1 8 LYS O O 0.017 -0.684 4.251 1.00 . A A . 8 LYS O 1 1
42 8267 1 1 9 LEU C C 0.148 1.094 1.600 1.00 . A A . 9 LEU C 1 1
42 8268 1 1 9 LEU CA C 0.917 -0.265 1.582 1.00 . A A . 9 LEU CA 1 1
42 8269 1 1 9 LEU CB C 1.463 -0.588 0.155 1.00 . A A . 9 LEU CB 1 1
42 8270 1 1 9 LEU CD1 C 2.441 -2.989 0.410 1.00 . A A . 9 LEU CD1 1 1
42 8271 1 1 9 LEU CD2 C 3.329 -1.441 -1.363 1.00 . A A . 9 LEU CD2 1 1
42 8272 1 1 9 LEU CG C 2.710 -1.516 0.049 1.00 . A A . 9 LEU CG 1 1
42 8273 1 1 9 LEU H H -0.097 -2.243 1.568 1.00 . A A . 9 LEU H 1 1
42 8274 1 1 9 LEU HA H 1.805 -0.185 2.242 1.00 . A A . 9 LEU HA 1 1
42 8275 1 1 9 LEU HB2 H 0.649 -0.965 -0.494 1.00 . A A . 9 LEU HB2 1 1
42 8276 1 1 9 LEU HB3 H 1.750 0.374 -0.314 1.00 . A A . 9 LEU HB3 1 1
42 8277 1 1 9 LEU HD11 H 3.344 -3.615 0.275 1.00 . A A . 9 LEU HD11 1 1
42 8278 1 1 9 LEU HD12 H 2.145 -3.105 1.467 1.00 . A A . 9 LEU HD12 1 1
42 8279 1 1 9 LEU HD13 H 1.641 -3.432 -0.212 1.00 . A A . 9 LEU HD13 1 1
42 8280 1 1 9 LEU HD21 H 2.636 -1.804 -2.144 1.00 . A A . 9 LEU HD21 1 1
42 8281 1 1 9 LEU HD22 H 3.614 -0.407 -1.632 1.00 . A A . 9 LEU HD22 1 1
42 8282 1 1 9 LEU HD23 H 4.252 -2.047 -1.439 1.00 . A A . 9 LEU HD23 1 1
42 8283 1 1 9 LEU HG H 3.473 -1.140 0.752 1.00 . A A . 9 LEU HG 1 1
42 8284 1 1 9 LEU N N 0.075 -1.380 2.093 1.00 . A A . 9 LEU N 1 1
42 8285 1 1 9 LEU O O -0.732 1.347 0.770 1.00 . A A . 9 LEU O 1 1
42 8286 1 1 10 ILE C C 1.089 4.232 3.151 1.00 . A A . 10 ILE C 1 1
42 8287 1 1 10 ILE CA C -0.095 3.289 2.774 1.00 . A A . 10 ILE CA 1 1
42 8288 1 1 10 ILE CB C -1.325 3.240 3.759 1.00 . A A . 10 ILE CB 1 1
42 8289 1 1 10 ILE CD1 C -2.821 5.018 2.584 1.00 . A A . 10 ILE CD1 1 1
42 8290 1 1 10 ILE CG1 C -2.098 4.584 3.868 1.00 . A A . 10 ILE CG1 1 1
42 8291 1 1 10 ILE CG2 C -1.023 2.714 5.189 1.00 . A A . 10 ILE CG2 1 1
42 8292 1 1 10 ILE H H 1.149 1.557 3.272 1.00 . A A . 10 ILE H 1 1
42 8293 1 1 10 ILE HA H -0.489 3.641 1.799 1.00 . A A . 10 ILE HA 1 1
42 8294 1 1 10 ILE HB H -2.038 2.508 3.330 1.00 . A A . 10 ILE HB 1 1
42 8295 1 1 10 ILE HD11 H -3.416 5.932 2.757 1.00 . A A . 10 ILE HD11 1 1
42 8296 1 1 10 ILE HD12 H -2.113 5.242 1.766 1.00 . A A . 10 ILE HD12 1 1
42 8297 1 1 10 ILE HD13 H -3.515 4.236 2.225 1.00 . A A . 10 ILE HD13 1 1
42 8298 1 1 10 ILE HG12 H -2.865 4.513 4.662 1.00 . A A . 10 ILE HG12 1 1
42 8299 1 1 10 ILE HG13 H -1.419 5.392 4.200 1.00 . A A . 10 ILE HG13 1 1
42 8300 1 1 10 ILE HG21 H -0.396 3.411 5.774 1.00 . A A . 10 ILE HG21 1 1
42 8301 1 1 10 ILE HG22 H -1.952 2.554 5.768 1.00 . A A . 10 ILE HG22 1 1
42 8302 1 1 10 ILE HG23 H -0.497 1.742 5.171 1.00 . A A . 10 ILE HG23 1 1
42 8303 1 1 10 ILE N N 0.500 1.941 2.580 1.00 . A A . 10 ILE N 1 1
42 8304 1 1 10 ILE O O 1.332 4.513 4.329 1.00 . A A . 10 ILE O 1 1
42 8305 1 1 11 GLU C C 2.567 7.134 2.401 1.00 . A A . 11 GLU C 1 1
42 8306 1 1 11 GLU CA C 2.997 5.623 2.354 1.00 . A A . 11 GLU CA 1 1
42 8307 1 1 11 GLU CB C 4.077 5.343 1.263 1.00 . A A . 11 GLU CB 1 1
42 8308 1 1 11 GLU CD C 4.887 2.975 2.182 1.00 . A A . 11 GLU CD 1 1
42 8309 1 1 11 GLU CG C 4.578 3.901 0.976 1.00 . A A . 11 GLU CG 1 1
42 8310 1 1 11 GLU H H 1.561 4.402 1.200 1.00 . A A . 11 GLU H 1 1
42 8311 1 1 11 GLU HA H 3.507 5.353 3.302 1.00 . A A . 11 GLU HA 1 1
42 8312 1 1 11 GLU HB2 H 3.734 5.760 0.296 1.00 . A A . 11 GLU HB2 1 1
42 8313 1 1 11 GLU HB3 H 4.962 5.957 1.510 1.00 . A A . 11 GLU HB3 1 1
42 8314 1 1 11 GLU HG2 H 3.887 3.426 0.257 1.00 . A A . 11 GLU HG2 1 1
42 8315 1 1 11 GLU HG3 H 5.511 4.014 0.382 1.00 . A A . 11 GLU HG3 1 1
42 8316 1 1 11 GLU N N 1.825 4.731 2.135 1.00 . A A . 11 GLU N 1 1
42 8317 1 1 11 GLU O O 2.944 7.912 1.518 1.00 . A A . 11 GLU O 1 1
42 8318 1 1 11 GLU OE1 O 5.795 3.295 2.953 1.00 . A A . 11 GLU OE1 1 1
42 8319 1 1 12 THR C C 2.072 9.681 4.718 1.00 . A A . 12 THR C 1 1
42 8320 1 1 12 THR CA C 1.316 8.978 3.552 1.00 . A A . 12 THR CA 1 1
42 8321 1 1 12 THR CB C -0.248 9.059 3.594 1.00 . A A . 12 THR CB 1 1
42 8322 1 1 12 THR CG2 C -0.808 10.495 3.544 1.00 . A A . 12 THR CG2 1 1
42 8323 1 1 12 THR H H 1.469 6.836 4.077 1.00 . A A . 12 THR H 1 1
42 8324 1 1 12 THR HA H 1.597 9.545 2.641 1.00 . A A . 12 THR HA 1 1
42 8325 1 1 12 THR HB H -0.624 8.582 4.519 1.00 . A A . 12 THR HB 1 1
42 8326 1 1 12 THR HG1 H -0.491 8.811 1.700 1.00 . A A . 12 THR HG1 1 1
42 8327 1 1 12 THR HG21 H -1.914 10.500 3.558 1.00 . A A . 12 THR HG21 1 1
42 8328 1 1 12 THR HG22 H -0.476 11.100 4.409 1.00 . A A . 12 THR HG22 1 1
42 8329 1 1 12 THR HG23 H -0.493 11.033 2.630 1.00 . A A . 12 THR HG23 1 1
42 8330 1 1 12 THR N N 1.791 7.565 3.427 1.00 . A A . 12 THR N 1 1
42 8331 1 1 12 THR O O 3.009 10.439 4.450 1.00 . A A . 12 THR O 1 1
42 8332 1 1 12 THR OG1 O -0.812 8.362 2.486 1.00 . A A . 12 THR OG1 1 1
42 8333 1 1 13 THR C C 2.279 9.024 8.327 1.00 . A A . 13 THR C 1 1
42 8334 1 1 13 THR CA C 2.329 10.068 7.172 1.00 . A A . 13 THR CA 1 1
42 8335 1 1 13 THR CB C 1.641 11.417 7.554 1.00 . A A . 13 THR CB 1 1
42 8336 1 1 13 THR CG2 C 2.332 12.160 8.708 1.00 . A A . 13 THR CG2 1 1
42 8337 1 1 13 THR H H 0.859 8.843 6.092 1.00 . A A . 13 THR H 1 1
42 8338 1 1 13 THR HA H 3.389 10.295 6.927 1.00 . A A . 13 THR HA 1 1
42 8339 1 1 13 THR HB H 0.590 11.227 7.842 1.00 . A A . 13 THR HB 1 1
42 8340 1 1 13 THR HG1 H 2.547 12.382 6.152 1.00 . A A . 13 THR HG1 1 1
42 8341 1 1 13 THR HG21 H 3.390 12.381 8.475 1.00 . A A . 13 THR HG21 1 1
42 8342 1 1 13 THR HG22 H 1.829 13.120 8.922 1.00 . A A . 13 THR HG22 1 1
42 8343 1 1 13 THR HG23 H 2.313 11.567 9.642 1.00 . A A . 13 THR HG23 1 1
42 8344 1 1 13 THR N N 1.681 9.446 5.988 1.00 . A A . 13 THR N 1 1
42 8345 1 1 13 THR O O 1.198 8.619 8.770 1.00 . A A . 13 THR O 1 1
42 8346 1 1 13 THR OG1 O 1.635 12.313 6.444 1.00 . A A . 13 THR OG1 1 1
42 8347 1 1 14 ALA C C 4.727 8.080 10.870 1.00 . A A . 14 ALA C 1 1
42 8348 1 1 14 ALA CA C 3.601 7.631 9.914 1.00 . A A . 14 ALA CA 1 1
42 8349 1 1 14 ALA CB C 3.842 6.220 9.346 1.00 . A A . 14 ALA CB 1 1
42 8350 1 1 14 ALA H H 4.281 9.022 8.349 1.00 . A A . 14 ALA H 1 1
42 8351 1 1 14 ALA HXT H 6.642 8.381 10.901 1.00 . A A . 14 ALA HXT 1 1
42 8352 1 1 14 ALA HA H 2.670 7.593 10.514 1.00 . A A . 14 ALA HA 1 1
42 8353 1 1 14 ALA HB1 H 3.016 5.898 8.684 1.00 . A A . 14 ALA HB1 1 1
42 8354 1 1 14 ALA HB2 H 4.774 6.164 8.754 1.00 . A A . 14 ALA HB2 1 1
42 8355 1 1 14 ALA HB3 H 3.918 5.465 10.150 1.00 . A A . 14 ALA HB3 1 1
42 8356 1 1 14 ALA N N 3.464 8.612 8.811 1.00 . A A . 14 ALA N 1 1
42 8357 1 1 14 ALA O O 4.524 8.388 12.043 1.00 . A A . 14 ALA O 1 1
42 8358 1 1 14 ALA OXT O 5.968 8.103 10.278 1.00 . A A . 14 ALA OXT 1 1
43 8359 1 1 1 ACE C C 8.360 6.771 0.113 1.00 . A A . 1 ACE C 1 1
43 8360 1 1 1 ACE CH3 C 8.934 7.916 -0.714 1.00 . A A . 1 ACE CH3 1 1
43 8361 1 1 1 ACE H1 H 8.206 8.262 -1.471 1.00 . A A . 1 ACE H1 1 1
43 8362 1 1 1 ACE H2 H 9.183 8.785 -0.079 1.00 . A A . 1 ACE H2 1 1
43 8363 1 1 1 ACE H3 H 9.850 7.611 -1.255 1.00 . A A . 1 ACE H3 1 1
43 8364 1 1 1 ACE O O 7.205 6.381 -0.075 1.00 . A A . 1 ACE O 1 1
43 8365 1 1 2 ILE C C 8.562 5.782 3.329 1.00 . A A . 2 ILE C 1 1
43 8366 1 1 2 ILE CA C 8.797 5.126 1.934 1.00 . A A . 2 ILE CA 1 1
43 8367 1 1 2 ILE CB C 9.816 3.926 1.908 1.00 . A A . 2 ILE CB 1 1
43 8368 1 1 2 ILE CD1 C 8.778 2.697 -0.197 1.00 . A A . 2 ILE CD1 1 1
43 8369 1 1 2 ILE CG1 C 10.024 3.268 0.507 1.00 . A A . 2 ILE CG1 1 1
43 8370 1 1 2 ILE CG2 C 9.485 2.818 2.943 1.00 . A A . 2 ILE CG2 1 1
43 8371 1 1 2 ILE H H 10.051 6.794 1.160 1.00 . A A . 2 ILE H 1 1
43 8372 1 1 2 ILE HA H 7.836 4.684 1.600 1.00 . A A . 2 ILE HA 1 1
43 8373 1 1 2 ILE HB H 10.803 4.328 2.210 1.00 . A A . 2 ILE HB 1 1
43 8374 1 1 2 ILE HD11 H 9.047 2.232 -1.163 1.00 . A A . 2 ILE HD11 1 1
43 8375 1 1 2 ILE HD12 H 8.277 1.920 0.409 1.00 . A A . 2 ILE HD12 1 1
43 8376 1 1 2 ILE HD13 H 8.031 3.482 -0.416 1.00 . A A . 2 ILE HD13 1 1
43 8377 1 1 2 ILE HG12 H 10.494 4.001 -0.174 1.00 . A A . 2 ILE HG12 1 1
43 8378 1 1 2 ILE HG13 H 10.775 2.458 0.588 1.00 . A A . 2 ILE HG13 1 1
43 8379 1 1 2 ILE HG21 H 10.233 2.004 2.929 1.00 . A A . 2 ILE HG21 1 1
43 8380 1 1 2 ILE HG22 H 9.472 3.206 3.978 1.00 . A A . 2 ILE HG22 1 1
43 8381 1 1 2 ILE HG23 H 8.497 2.357 2.760 1.00 . A A . 2 ILE HG23 1 1
43 8382 1 1 2 ILE N N 9.193 6.246 1.024 1.00 . A A . 2 ILE N 1 1
43 8383 1 1 2 ILE O O 9.485 5.923 4.139 1.00 . A A . 2 ILE O 1 1
43 8384 1 1 3 TRP C C 6.288 5.940 5.984 1.00 . A A . 3 TRP C 1 1
43 8385 1 1 3 TRP CA C 6.881 6.842 4.850 1.00 . A A . 3 TRP CA 1 1
43 8386 1 1 3 TRP CB C 5.864 7.957 4.483 1.00 . A A . 3 TRP CB 1 1
43 8387 1 1 3 TRP CD1 C 6.004 9.341 2.257 1.00 . A A . 3 TRP CD1 1 1
43 8388 1 1 3 TRP CD2 C 7.300 10.073 3.906 1.00 . A A . 3 TRP CD2 1 1
43 8389 1 1 3 TRP CE2 C 7.458 10.910 2.774 1.00 . A A . 3 TRP CE2 1 1
43 8390 1 1 3 TRP CE3 C 8.048 10.305 5.084 1.00 . A A . 3 TRP CE3 1 1
43 8391 1 1 3 TRP CG C 6.381 9.094 3.591 1.00 . A A . 3 TRP CG 1 1
43 8392 1 1 3 TRP CH2 C 9.079 12.226 3.998 1.00 . A A . 3 TRP CH2 1 1
43 8393 1 1 3 TRP CZ2 C 8.359 12.002 2.822 1.00 . A A . 3 TRP CZ2 1 1
43 8394 1 1 3 TRP CZ3 C 8.928 11.388 5.112 1.00 . A A . 3 TRP CZ3 1 1
43 8395 1 1 3 TRP H H 6.682 6.116 2.762 1.00 . A A . 3 TRP H 1 1
43 8396 1 1 3 TRP HA H 7.760 7.328 5.310 1.00 . A A . 3 TRP HA 1 1
43 8397 1 1 3 TRP HB2 H 4.967 7.505 4.026 1.00 . A A . 3 TRP HB2 1 1
43 8398 1 1 3 TRP HB3 H 5.484 8.424 5.408 1.00 . A A . 3 TRP HB3 1 1
43 8399 1 1 3 TRP HD1 H 5.303 8.734 1.705 1.00 . A A . 3 TRP HD1 1 1
43 8400 1 1 3 TRP HE1 H 6.569 10.873 0.790 1.00 . A A . 3 TRP HE1 1 1
43 8401 1 1 3 TRP HE3 H 7.953 9.635 5.927 1.00 . A A . 3 TRP HE3 1 1
43 8402 1 1 3 TRP HH2 H 9.771 13.055 4.047 1.00 . A A . 3 TRP HH2 1 1
43 8403 1 1 3 TRP HZ2 H 8.492 12.647 1.966 1.00 . A A . 3 TRP HZ2 1 1
43 8404 1 1 3 TRP HZ3 H 9.507 11.577 6.003 1.00 . A A . 3 TRP HZ3 1 1
43 8405 1 1 3 TRP N N 7.303 6.176 3.578 1.00 . A A . 3 TRP N 1 1
43 8406 1 1 3 TRP NE1 N 6.660 10.471 1.730 1.00 . A A . 3 TRP NE1 1 1
43 8407 1 1 3 TRP O O 5.975 6.452 7.064 1.00 . A A . 3 TRP O 1 1
43 8408 1 1 4 GLY C C 4.629 2.702 6.028 1.00 . A A . 4 GLY C 1 1
43 8409 1 1 4 GLY CA C 5.591 3.670 6.733 1.00 . A A . 4 GLY CA 1 1
43 8410 1 1 4 GLY H H 6.529 4.342 4.857 1.00 . A A . 4 GLY H 1 1
43 8411 1 1 4 GLY HA2 H 6.426 3.128 7.213 1.00 . A A . 4 GLY HA2 1 1
43 8412 1 1 4 GLY HA3 H 5.048 4.184 7.548 1.00 . A A . 4 GLY HA3 1 1
43 8413 1 1 4 GLY N N 6.141 4.629 5.756 1.00 . A A . 4 GLY N 1 1
43 8414 1 1 4 GLY O O 3.420 2.944 6.015 1.00 . A A . 4 GLY O 1 1
43 8415 1 1 5 . C C 4.590 0.691 3.172 1.00 . A A . 5 SET C 1 1
43 8416 1 1 5 . CA C 4.374 0.595 4.727 1.00 . A A . 5 SET CA 1 1
43 8417 1 1 5 . CB C 4.817 -0.829 5.184 1.00 . A A . 5 SET CB 1 1
43 8418 1 1 5 . H H 6.197 1.557 5.524 1.00 . A A . 5 SET H 1 1
43 8419 1 1 5 . HA H 3.306 0.716 5.017 1.00 . A A . 5 SET HA 1 1
43 8420 1 1 5 . HB2 H 5.656 0.487 2.943 1.00 . A A . 5 SET HB2 1 1
43 8421 1 1 5 . HB3 H 4.069 -0.168 2.712 1.00 . A A . 5 SET HB3 1 1
43 8422 1 1 5 . HNT2 H 3.351 1.831 1.745 1.00 . A A . 5 SET HNT2 1 1
43 8423 1 1 5 . N N 5.175 1.615 5.456 1.00 . A A . 5 SET N 1 1
43 8424 1 1 5 . NT N 4.156 1.888 2.389 1.00 . A A . 5 SET NT 1 1
43 8425 1 1 5 . OG O 6.010 -1.156 5.179 1.00 . A A . 5 SET OG 1 1
43 8426 1 1 6 SER C C 2.757 -3.850 5.838 1.00 . A A . 6 SER C 1 1
43 8427 1 1 6 SER CA C 4.094 -3.079 6.014 1.00 . A A . 6 SER CA 1 1
43 8428 1 1 6 SER CB C 4.593 -3.152 7.480 1.00 . A A . 6 SER CB 1 1
43 8429 1 1 6 SER H H 2.889 -1.314 5.450 1.00 . A A . 6 SER H 1 1
43 8430 1 1 6 SER HA H 4.871 -3.539 5.372 1.00 . A A . 6 SER HA 1 1
43 8431 1 1 6 SER HB2 H 3.928 -2.583 8.159 1.00 . A A . 6 SER HB2 1 1
43 8432 1 1 6 SER HB3 H 4.575 -4.197 7.846 1.00 . A A . 6 SER HB3 1 1
43 8433 1 1 6 SER HG H 5.966 -1.867 7.061 1.00 . A A . 6 SER HG 1 1
43 8434 1 1 6 SER N N 3.842 -1.678 5.563 1.00 . A A . 6 SER N 1 1
43 8435 1 1 6 SER O O 1.816 -3.646 6.616 1.00 . A A . 6 SER O 1 1
43 8436 1 1 6 SER OG O 5.925 -2.664 7.598 1.00 . A A . 6 SER OG 1 1
43 8437 1 1 7 GLY C C 0.439 -4.675 3.656 1.00 . A A . 7 GLY C 1 1
43 8438 1 1 7 GLY CA C 1.416 -5.491 4.530 1.00 . A A . 7 GLY CA 1 1
43 8439 1 1 7 GLY H H 3.506 -4.831 4.240 1.00 . A A . 7 GLY H 1 1
43 8440 1 1 7 GLY HA2 H 1.686 -6.421 3.998 1.00 . A A . 7 GLY HA2 1 1
43 8441 1 1 7 GLY HA3 H 0.926 -5.830 5.465 1.00 . A A . 7 GLY HA3 1 1
43 8442 1 1 7 GLY N N 2.662 -4.725 4.813 1.00 . A A . 7 GLY N 1 1
43 8443 1 1 7 GLY O O 0.307 -4.919 2.455 1.00 . A A . 7 GLY O 1 1
43 8444 1 1 8 LYS C C -0.324 -1.520 3.322 1.00 . A A . 8 LYS C 1 1
43 8445 1 1 8 LYS CA C -1.183 -2.776 3.644 1.00 . A A . 8 LYS CA 1 1
43 8446 1 1 8 LYS CB C -2.342 -2.502 4.635 1.00 . A A . 8 LYS CB 1 1
43 8447 1 1 8 LYS CD C -4.502 -1.177 5.160 1.00 . A A . 8 LYS CD 1 1
43 8448 1 1 8 LYS CE C -5.336 -2.303 5.808 1.00 . A A . 8 LYS CE 1 1
43 8449 1 1 8 LYS CG C -3.473 -1.601 4.088 1.00 . A A . 8 LYS CG 1 1
43 8450 1 1 8 LYS H H 0.064 -3.531 5.255 1.00 . A A . 8 LYS H 1 1
43 8451 1 1 8 LYS HA H -1.611 -3.227 2.725 1.00 . A A . 8 LYS HA 1 1
43 8452 1 1 8 LYS HB2 H -2.785 -3.470 4.944 1.00 . A A . 8 LYS HB2 1 1
43 8453 1 1 8 LYS HB3 H -1.939 -2.057 5.567 1.00 . A A . 8 LYS HB3 1 1
43 8454 1 1 8 LYS HD2 H -3.961 -0.638 5.962 1.00 . A A . 8 LYS HD2 1 1
43 8455 1 1 8 LYS HD3 H -5.177 -0.415 4.727 1.00 . A A . 8 LYS HD3 1 1
43 8456 1 1 8 LYS HE2 H -4.674 -3.095 6.211 1.00 . A A . 8 LYS HE2 1 1
43 8457 1 1 8 LYS HE3 H -5.865 -1.896 6.690 1.00 . A A . 8 LYS HE3 1 1
43 8458 1 1 8 LYS HG2 H -3.032 -0.681 3.659 1.00 . A A . 8 LYS HG2 1 1
43 8459 1 1 8 LYS HG3 H -3.979 -2.099 3.240 1.00 . A A . 8 LYS HG3 1 1
43 8460 1 1 8 LYS HZ1 H -6.979 -2.186 4.520 1.00 . A A . 8 LYS HZ1 1 1
43 8461 1 1 8 LYS HZ2 H -5.870 -3.315 4.058 1.00 . A A . 8 LYS HZ2 1 1
43 8462 1 1 8 LYS HZ3 H -6.886 -3.627 5.321 1.00 . A A . 8 LYS HZ3 1 1
43 8463 1 1 8 LYS N N -0.243 -3.710 4.298 1.00 . A A . 8 LYS N 1 1
43 8464 1 1 8 LYS NZ N -6.324 -2.892 4.877 1.00 . A A . 8 LYS NZ 1 1
43 8465 1 1 8 LYS O O 0.003 -0.718 4.205 1.00 . A A . 8 LYS O 1 1
43 8466 1 1 9 LEU C C 0.158 1.102 1.586 1.00 . A A . 9 LEU C 1 1
43 8467 1 1 9 LEU CA C 0.897 -0.273 1.542 1.00 . A A . 9 LEU CA 1 1
43 8468 1 1 9 LEU CB C 1.445 -0.583 0.113 1.00 . A A . 9 LEU CB 1 1
43 8469 1 1 9 LEU CD1 C 2.396 -2.998 0.329 1.00 . A A . 9 LEU CD1 1 1
43 8470 1 1 9 LEU CD2 C 3.318 -1.424 -1.402 1.00 . A A . 9 LEU CD2 1 1
43 8471 1 1 9 LEU CG C 2.684 -1.520 0.002 1.00 . A A . 9 LEU CG 1 1
43 8472 1 1 9 LEU H H -0.131 -2.248 1.512 1.00 . A A . 9 LEU H 1 1
43 8473 1 1 9 LEU HA H 1.786 -0.216 2.202 1.00 . A A . 9 LEU HA 1 1
43 8474 1 1 9 LEU HB2 H 0.630 -0.945 -0.544 1.00 . A A . 9 LEU HB2 1 1
43 8475 1 1 9 LEU HB3 H 1.741 0.382 -0.343 1.00 . A A . 9 LEU HB3 1 1
43 8476 1 1 9 LEU HD11 H 2.085 -3.132 1.380 1.00 . A A . 9 LEU HD11 1 1
43 8477 1 1 9 LEU HD12 H 1.598 -3.419 -0.312 1.00 . A A . 9 LEU HD12 1 1
43 8478 1 1 9 LEU HD13 H 3.293 -3.631 0.192 1.00 . A A . 9 LEU HD13 1 1
43 8479 1 1 9 LEU HD21 H 2.628 -1.762 -2.197 1.00 . A A . 9 LEU HD21 1 1
43 8480 1 1 9 LEU HD22 H 3.616 -0.388 -1.647 1.00 . A A . 9 LEU HD22 1 1
43 8481 1 1 9 LEU HD23 H 4.235 -2.037 -1.483 1.00 . A A . 9 LEU HD23 1 1
43 8482 1 1 9 LEU HG H 3.446 -1.165 0.719 1.00 . A A . 9 LEU HG 1 1
43 8483 1 1 9 LEU N N 0.048 -1.390 2.041 1.00 . A A . 9 LEU N 1 1
43 8484 1 1 9 LEU O O -0.694 1.403 0.746 1.00 . A A . 9 LEU O 1 1
43 8485 1 1 10 ILE C C 1.136 4.178 3.253 1.00 . A A . 10 ILE C 1 1
43 8486 1 1 10 ILE CA C -0.057 3.269 2.820 1.00 . A A . 10 ILE CA 1 1
43 8487 1 1 10 ILE CB C -1.308 3.207 3.779 1.00 . A A . 10 ILE CB 1 1
43 8488 1 1 10 ILE CD1 C -2.793 5.002 2.620 1.00 . A A . 10 ILE CD1 1 1
43 8489 1 1 10 ILE CG1 C -2.074 4.554 3.901 1.00 . A A . 10 ILE CG1 1 1
43 8490 1 1 10 ILE CG2 C -1.043 2.646 5.202 1.00 . A A . 10 ILE CG2 1 1
43 8491 1 1 10 ILE H H 1.138 1.495 3.289 1.00 . A A . 10 ILE H 1 1
43 8492 1 1 10 ILE HA H -0.425 3.658 1.849 1.00 . A A . 10 ILE HA 1 1
43 8493 1 1 10 ILE HB H -2.018 2.491 3.319 1.00 . A A . 10 ILE HB 1 1
43 8494 1 1 10 ILE HD11 H -3.381 5.920 2.798 1.00 . A A . 10 ILE HD11 1 1
43 8495 1 1 10 ILE HD12 H -2.084 5.221 1.802 1.00 . A A . 10 ILE HD12 1 1
43 8496 1 1 10 ILE HD13 H -3.495 4.228 2.257 1.00 . A A . 10 ILE HD13 1 1
43 8497 1 1 10 ILE HG12 H -2.845 4.478 4.692 1.00 . A A . 10 ILE HG12 1 1
43 8498 1 1 10 ILE HG13 H -1.392 5.355 4.243 1.00 . A A . 10 ILE HG13 1 1
43 8499 1 1 10 ILE HG21 H -0.432 3.329 5.821 1.00 . A A . 10 ILE HG21 1 1
43 8500 1 1 10 ILE HG22 H -1.986 2.473 5.753 1.00 . A A . 10 ILE HG22 1 1
43 8501 1 1 10 ILE HG23 H -0.515 1.676 5.174 1.00 . A A . 10 ILE HG23 1 1
43 8502 1 1 10 ILE N N 0.514 1.916 2.597 1.00 . A A . 10 ILE N 1 1
43 8503 1 1 10 ILE O O 1.375 4.392 4.445 1.00 . A A . 10 ILE O 1 1
43 8504 1 1 11 GLU C C 2.611 7.087 2.661 1.00 . A A . 11 GLU C 1 1
43 8505 1 1 11 GLU CA C 3.067 5.586 2.542 1.00 . A A . 11 GLU CA 1 1
43 8506 1 1 11 GLU CB C 4.164 5.379 1.451 1.00 . A A . 11 GLU CB 1 1
43 8507 1 1 11 GLU CD C 4.970 2.956 2.202 1.00 . A A . 11 GLU CD 1 1
43 8508 1 1 11 GLU CG C 4.647 3.955 1.062 1.00 . A A . 11 GLU CG 1 1
43 8509 1 1 11 GLU H H 1.615 4.467 1.316 1.00 . A A . 11 GLU H 1 1
43 8510 1 1 11 GLU HA H 3.575 5.257 3.475 1.00 . A A . 11 GLU HA 1 1
43 8511 1 1 11 GLU HB2 H 3.843 5.870 0.512 1.00 . A A . 11 GLU HB2 1 1
43 8512 1 1 11 GLU HB3 H 5.053 5.960 1.761 1.00 . A A . 11 GLU HB3 1 1
43 8513 1 1 11 GLU HG2 H 3.939 3.524 0.332 1.00 . A A . 11 GLU HG2 1 1
43 8514 1 1 11 GLU HG3 H 5.572 4.093 0.460 1.00 . A A . 11 GLU HG3 1 1
43 8515 1 1 11 GLU N N 1.888 4.719 2.270 1.00 . A A . 11 GLU N 1 1
43 8516 1 1 11 GLU O O 2.836 7.874 1.735 1.00 . A A . 11 GLU O 1 1
43 8517 1 1 11 GLU OE1 O 5.978 3.152 2.884 1.00 . A A . 11 GLU OE1 1 1
43 8518 1 1 12 THR C C 2.638 9.805 4.568 1.00 . A A . 12 THR C 1 1
43 8519 1 1 12 THR CA C 1.503 8.910 3.975 1.00 . A A . 12 THR CA 1 1
43 8520 1 1 12 THR CB C 0.121 8.988 4.711 1.00 . A A . 12 THR CB 1 1
43 8521 1 1 12 THR CG2 C -0.510 10.398 4.732 1.00 . A A . 12 THR CG2 1 1
43 8522 1 1 12 THR H H 1.667 6.738 4.407 1.00 . A A . 12 THR H 1 1
43 8523 1 1 12 THR HA H 1.291 9.332 2.971 1.00 . A A . 12 THR HA 1 1
43 8524 1 1 12 THR HB H 0.237 8.657 5.760 1.00 . A A . 12 THR HB 1 1
43 8525 1 1 12 THR HG1 H -0.955 8.477 3.197 1.00 . A A . 12 THR HG1 1 1
43 8526 1 1 12 THR HG21 H -1.491 10.399 5.245 1.00 . A A . 12 THR HG21 1 1
43 8527 1 1 12 THR HG22 H 0.121 11.134 5.265 1.00 . A A . 12 THR HG22 1 1
43 8528 1 1 12 THR HG23 H -0.684 10.799 3.715 1.00 . A A . 12 THR HG23 1 1
43 8529 1 1 12 THR N N 1.978 7.498 3.788 1.00 . A A . 12 THR N 1 1
43 8530 1 1 12 THR O O 3.300 10.510 3.799 1.00 . A A . 12 THR O 1 1
43 8531 1 1 12 THR OG1 O -0.824 8.127 4.081 1.00 . A A . 12 THR OG1 1 1
43 8532 1 1 13 THR C C 4.458 9.833 7.796 1.00 . A A . 13 THR C 1 1
43 8533 1 1 13 THR CA C 3.912 10.620 6.563 1.00 . A A . 13 THR CA 1 1
43 8534 1 1 13 THR CB C 3.334 12.016 6.967 1.00 . A A . 13 THR CB 1 1
43 8535 1 1 13 THR CG2 C 4.374 12.981 7.559 1.00 . A A . 13 THR CG2 1 1
43 8536 1 1 13 THR H H 2.223 9.213 6.449 1.00 . A A . 13 THR H 1 1
43 8537 1 1 13 THR HA H 4.743 10.789 5.847 1.00 . A A . 13 THR HA 1 1
43 8538 1 1 13 THR HB H 2.527 11.877 7.713 1.00 . A A . 13 THR HB 1 1
43 8539 1 1 13 THR HG1 H 3.456 12.682 5.162 1.00 . A A . 13 THR HG1 1 1
43 8540 1 1 13 THR HG21 H 5.213 13.153 6.861 1.00 . A A . 13 THR HG21 1 1
43 8541 1 1 13 THR HG22 H 3.920 13.962 7.787 1.00 . A A . 13 THR HG22 1 1
43 8542 1 1 13 THR HG23 H 4.797 12.594 8.504 1.00 . A A . 13 THR HG23 1 1
43 8543 1 1 13 THR N N 2.865 9.790 5.898 1.00 . A A . 13 THR N 1 1
43 8544 1 1 13 THR O O 3.690 9.285 8.597 1.00 . A A . 13 THR O 1 1
43 8545 1 1 13 THR OG1 O 2.774 12.680 5.837 1.00 . A A . 13 THR OG1 1 1
43 8546 1 1 14 ALA C C 6.435 9.963 10.395 1.00 . A A . 14 ALA C 1 1
43 8547 1 1 14 ALA CA C 6.465 9.128 9.093 1.00 . A A . 14 ALA CA 1 1
43 8548 1 1 14 ALA CB C 7.906 8.765 8.690 1.00 . A A . 14 ALA CB 1 1
43 8549 1 1 14 ALA H H 6.326 10.331 7.249 1.00 . A A . 14 ALA H 1 1
43 8550 1 1 14 ALA HXT H 7.012 11.678 11.093 1.00 . A A . 14 ALA HXT 1 1
43 8551 1 1 14 ALA HA H 5.941 8.172 9.296 1.00 . A A . 14 ALA HA 1 1
43 8552 1 1 14 ALA HB1 H 7.931 8.108 7.801 1.00 . A A . 14 ALA HB1 1 1
43 8553 1 1 14 ALA HB2 H 8.517 9.657 8.455 1.00 . A A . 14 ALA HB2 1 1
43 8554 1 1 14 ALA HB3 H 8.427 8.216 9.498 1.00 . A A . 14 ALA HB3 1 1
43 8555 1 1 14 ALA N N 5.795 9.821 7.963 1.00 . A A . 14 ALA N 1 1
43 8556 1 1 14 ALA O O 5.913 9.565 11.436 1.00 . A A . 14 ALA O 1 1
43 8557 1 1 14 ALA OXT O 7.048 11.186 10.270 1.00 . A A . 14 ALA OXT 1 1
44 8558 1 1 1 ACE C C 8.457 3.184 -3.331 1.00 . A A . 1 ACE C 1 1
44 8559 1 1 1 ACE CH3 C 7.986 3.976 -4.547 1.00 . A A . 1 ACE CH3 1 1
44 8560 1 1 1 ACE H1 H 8.301 3.485 -5.486 1.00 . A A . 1 ACE H1 1 1
44 8561 1 1 1 ACE H2 H 6.884 4.051 -4.570 1.00 . A A . 1 ACE H2 1 1
44 8562 1 1 1 ACE H3 H 8.399 5.002 -4.560 1.00 . A A . 1 ACE H3 1 1
44 8563 1 1 1 ACE O O 8.893 2.038 -3.468 1.00 . A A . 1 ACE O 1 1
44 8564 1 1 2 ILE C C 7.699 3.630 0.185 1.00 . A A . 2 ILE C 1 1
44 8565 1 1 2 ILE CA C 8.779 3.212 -0.860 1.00 . A A . 2 ILE CA 1 1
44 8566 1 1 2 ILE CB C 10.270 3.498 -0.433 1.00 . A A . 2 ILE CB 1 1
44 8567 1 1 2 ILE CD1 C 10.639 5.464 1.263 1.00 . A A . 2 ILE CD1 1 1
44 8568 1 1 2 ILE CG1 C 10.755 4.966 -0.189 1.00 . A A . 2 ILE CG1 1 1
44 8569 1 1 2 ILE CG2 C 11.280 2.760 -1.348 1.00 . A A . 2 ILE CG2 1 1
44 8570 1 1 2 ILE H H 7.817 4.675 -2.162 1.00 . A A . 2 ILE H 1 1
44 8571 1 1 2 ILE HA H 8.716 2.109 -0.960 1.00 . A A . 2 ILE HA 1 1
44 8572 1 1 2 ILE HB H 10.368 2.990 0.531 1.00 . A A . 2 ILE HB 1 1
44 8573 1 1 2 ILE HD11 H 11.033 6.491 1.361 1.00 . A A . 2 ILE HD11 1 1
44 8574 1 1 2 ILE HD12 H 9.602 5.487 1.635 1.00 . A A . 2 ILE HD12 1 1
44 8575 1 1 2 ILE HD13 H 11.216 4.825 1.955 1.00 . A A . 2 ILE HD13 1 1
44 8576 1 1 2 ILE HG12 H 11.832 5.068 -0.438 1.00 . A A . 2 ILE HG12 1 1
44 8577 1 1 2 ILE HG13 H 10.251 5.672 -0.870 1.00 . A A . 2 ILE HG13 1 1
44 8578 1 1 2 ILE HG21 H 12.306 2.788 -0.936 1.00 . A A . 2 ILE HG21 1 1
44 8579 1 1 2 ILE HG22 H 11.021 1.691 -1.472 1.00 . A A . 2 ILE HG22 1 1
44 8580 1 1 2 ILE HG23 H 11.322 3.205 -2.360 1.00 . A A . 2 ILE HG23 1 1
44 8581 1 1 2 ILE N N 8.377 3.821 -2.154 1.00 . A A . 2 ILE N 1 1
44 8582 1 1 2 ILE O O 7.603 4.805 0.549 1.00 . A A . 2 ILE O 1 1
44 8583 1 1 3 TRP C C 6.200 2.943 3.166 1.00 . A A . 3 TRP C 1 1
44 8584 1 1 3 TRP CA C 5.795 2.944 1.659 1.00 . A A . 3 TRP CA 1 1
44 8585 1 1 3 TRP CB C 4.564 2.023 1.405 1.00 . A A . 3 TRP CB 1 1
44 8586 1 1 3 TRP CD1 C 3.625 1.709 -1.034 1.00 . A A . 3 TRP CD1 1 1
44 8587 1 1 3 TRP CD2 C 2.908 3.525 0.029 1.00 . A A . 3 TRP CD2 1 1
44 8588 1 1 3 TRP CE2 C 2.344 3.485 -1.269 1.00 . A A . 3 TRP CE2 1 1
44 8589 1 1 3 TRP CE3 C 2.627 4.606 0.900 1.00 . A A . 3 TRP CE3 1 1
44 8590 1 1 3 TRP CG C 3.718 2.413 0.183 1.00 . A A . 3 TRP CG 1 1
44 8591 1 1 3 TRP CH2 C 1.230 5.588 -0.836 1.00 . A A . 3 TRP CH2 1 1
44 8592 1 1 3 TRP CZ2 C 1.491 4.526 -1.705 1.00 . A A . 3 TRP CZ2 1 1
44 8593 1 1 3 TRP CZ3 C 1.795 5.631 0.445 1.00 . A A . 3 TRP CZ3 1 1
44 8594 1 1 3 TRP H H 6.891 1.794 0.118 1.00 . A A . 3 TRP H 1 1
44 8595 1 1 3 TRP HA H 5.458 3.977 1.515 1.00 . A A . 3 TRP HA 1 1
44 8596 1 1 3 TRP HB2 H 4.881 0.965 1.338 1.00 . A A . 3 TRP HB2 1 1
44 8597 1 1 3 TRP HB3 H 3.886 2.046 2.281 1.00 . A A . 3 TRP HB3 1 1
44 8598 1 1 3 TRP HD1 H 4.138 0.783 -1.247 1.00 . A A . 3 TRP HD1 1 1
44 8599 1 1 3 TRP HE1 H 2.536 2.070 -2.906 1.00 . A A . 3 TRP HE1 1 1
44 8600 1 1 3 TRP HE3 H 3.077 4.653 1.881 1.00 . A A . 3 TRP HE3 1 1
44 8601 1 1 3 TRP HH2 H 0.590 6.395 -1.161 1.00 . A A . 3 TRP HH2 1 1
44 8602 1 1 3 TRP HZ2 H 1.057 4.509 -2.695 1.00 . A A . 3 TRP HZ2 1 1
44 8603 1 1 3 TRP HZ3 H 1.585 6.470 1.092 1.00 . A A . 3 TRP HZ3 1 1
44 8604 1 1 3 TRP N N 6.867 2.673 0.647 1.00 . A A . 3 TRP N 1 1
44 8605 1 1 3 TRP NE1 N 2.774 2.358 -1.950 1.00 . A A . 3 TRP NE1 1 1
44 8606 1 1 3 TRP O O 5.497 3.556 3.976 1.00 . A A . 3 TRP O 1 1
44 8607 1 1 4 GLY C C 7.269 0.941 5.672 1.00 . A A . 4 GLY C 1 1
44 8608 1 1 4 GLY CA C 7.780 2.193 4.936 1.00 . A A . 4 GLY CA 1 1
44 8609 1 1 4 GLY H H 7.784 1.870 2.733 1.00 . A A . 4 GLY H 1 1
44 8610 1 1 4 GLY HA2 H 8.886 2.168 4.920 1.00 . A A . 4 GLY HA2 1 1
44 8611 1 1 4 GLY HA3 H 7.531 3.111 5.505 1.00 . A A . 4 GLY HA3 1 1
44 8612 1 1 4 GLY N N 7.297 2.268 3.538 1.00 . A A . 4 GLY N 1 1
44 8613 1 1 4 GLY O O 8.003 -0.037 5.832 1.00 . A A . 4 GLY O 1 1
44 8614 1 1 5 . C C 4.304 0.422 7.885 1.00 . A A . 5 SET C 1 1
44 8615 1 1 5 . CA C 5.330 -0.110 6.840 1.00 . A A . 5 SET CA 1 1
44 8616 1 1 5 . CB C 4.732 -1.155 5.841 1.00 . A A . 5 SET CB 1 1
44 8617 1 1 5 . H H 5.507 1.855 5.834 1.00 . A A . 5 SET H 1 1
44 8618 1 1 5 . HA H 6.105 -0.605 7.461 1.00 . A A . 5 SET HA 1 1
44 8619 1 1 5 . HB2 H 3.809 -0.441 8.368 1.00 . A A . 5 SET HB2 1 1
44 8620 1 1 5 . HB3 H 4.861 0.893 8.720 1.00 . A A . 5 SET HB3 1 1
44 8621 1 1 5 . HNT2 H 2.364 0.985 7.003 1.00 . A A . 5 SET HNT2 1 1
44 8622 1 1 5 . N N 6.004 1.001 6.112 1.00 . A A . 5 SET N 1 1
44 8623 1 1 5 . NT N 3.238 1.340 7.402 1.00 . A A . 5 SET NT 1 1
44 8624 1 1 5 . OG O 3.973 -0.808 4.930 1.00 . A A . 5 SET OG 1 1
44 8625 1 1 6 SER C C 3.174 -4.033 5.476 1.00 . A A . 6 SER C 1 1
44 8626 1 1 6 SER CA C 4.635 -3.569 5.183 1.00 . A A . 6 SER CA 1 1
44 8627 1 1 6 SER CB C 5.662 -4.711 5.372 1.00 . A A . 6 SER CB 1 1
44 8628 1 1 6 SER H H 5.643 -2.609 6.884 1.00 . A A . 6 SER H 1 1
44 8629 1 1 6 SER HA H 4.704 -3.240 4.125 1.00 . A A . 6 SER HA 1 1
44 8630 1 1 6 SER HB2 H 6.696 -4.343 5.214 1.00 . A A . 6 SER HB2 1 1
44 8631 1 1 6 SER HB3 H 5.638 -5.108 6.405 1.00 . A A . 6 SER HB3 1 1
44 8632 1 1 6 SER HG H 4.595 -6.174 4.704 1.00 . A A . 6 SER HG 1 1
44 8633 1 1 6 SER N N 5.086 -2.440 6.042 1.00 . A A . 6 SER N 1 1
44 8634 1 1 6 SER O O 2.659 -3.875 6.587 1.00 . A A . 6 SER O 1 1
44 8635 1 1 6 SER OG O 5.433 -5.775 4.453 1.00 . A A . 6 SER OG 1 1
44 8636 1 1 7 GLY C C 0.141 -4.087 3.944 1.00 . A A . 7 GLY C 1 1
44 8637 1 1 7 GLY CA C 1.121 -5.101 4.563 1.00 . A A . 7 GLY CA 1 1
44 8638 1 1 7 GLY H H 3.052 -4.675 3.576 1.00 . A A . 7 GLY H 1 1
44 8639 1 1 7 GLY HA2 H 1.033 -6.062 4.025 1.00 . A A . 7 GLY HA2 1 1
44 8640 1 1 7 GLY HA3 H 0.834 -5.332 5.608 1.00 . A A . 7 GLY HA3 1 1
44 8641 1 1 7 GLY N N 2.524 -4.622 4.454 1.00 . A A . 7 GLY N 1 1
44 8642 1 1 7 GLY O O -0.419 -4.330 2.872 1.00 . A A . 7 GLY O 1 1
44 8643 1 1 8 LYS C C -0.020 -0.913 3.338 1.00 . A A . 8 LYS C 1 1
44 8644 1 1 8 LYS CA C -0.922 -1.847 4.194 1.00 . A A . 8 LYS CA 1 1
44 8645 1 1 8 LYS CB C -1.501 -1.153 5.454 1.00 . A A . 8 LYS CB 1 1
44 8646 1 1 8 LYS CD C -2.894 0.808 6.411 1.00 . A A . 8 LYS CD 1 1
44 8647 1 1 8 LYS CE C -1.802 1.764 6.937 1.00 . A A . 8 LYS CE 1 1
44 8648 1 1 8 LYS CG C -2.483 0.006 5.161 1.00 . A A . 8 LYS CG 1 1
44 8649 1 1 8 LYS H H 0.583 -2.814 5.426 1.00 . A A . 8 LYS H 1 1
44 8650 1 1 8 LYS HA H -1.773 -2.238 3.598 1.00 . A A . 8 LYS HA 1 1
44 8651 1 1 8 LYS HB2 H -2.025 -1.899 6.083 1.00 . A A . 8 LYS HB2 1 1
44 8652 1 1 8 LYS HB3 H -0.667 -0.783 6.083 1.00 . A A . 8 LYS HB3 1 1
44 8653 1 1 8 LYS HD2 H -3.796 1.394 6.149 1.00 . A A . 8 LYS HD2 1 1
44 8654 1 1 8 LYS HD3 H -3.215 0.109 7.207 1.00 . A A . 8 LYS HD3 1 1
44 8655 1 1 8 LYS HE2 H -0.908 1.196 7.260 1.00 . A A . 8 LYS HE2 1 1
44 8656 1 1 8 LYS HE3 H -1.454 2.432 6.125 1.00 . A A . 8 LYS HE3 1 1
44 8657 1 1 8 LYS HG2 H -2.063 0.699 4.406 1.00 . A A . 8 LYS HG2 1 1
44 8658 1 1 8 LYS HG3 H -3.392 -0.414 4.687 1.00 . A A . 8 LYS HG3 1 1
44 8659 1 1 8 LYS HZ1 H -3.108 3.151 7.790 1.00 . A A . 8 LYS HZ1 1 1
44 8660 1 1 8 LYS HZ2 H -2.608 1.992 8.850 1.00 . A A . 8 LYS HZ2 1 1
44 8661 1 1 8 LYS HZ3 H -1.588 3.218 8.427 1.00 . A A . 8 LYS HZ3 1 1
44 8662 1 1 8 LYS N N -0.057 -2.955 4.644 1.00 . A A . 8 LYS N 1 1
44 8663 1 1 8 LYS NZ N -2.302 2.576 8.063 1.00 . A A . 8 LYS NZ 1 1
44 8664 1 1 8 LYS O O 0.709 -0.065 3.867 1.00 . A A . 8 LYS O 1 1
44 8665 1 1 9 LEU C C 0.017 1.082 0.660 1.00 . A A . 9 LEU C 1 1
44 8666 1 1 9 LEU CA C 0.708 -0.277 1.039 1.00 . A A . 9 LEU CA 1 1
44 8667 1 1 9 LEU CB C 1.123 -1.147 -0.186 1.00 . A A . 9 LEU CB 1 1
44 8668 1 1 9 LEU CD1 C 2.306 -3.125 -1.256 1.00 . A A . 9 LEU CD1 1 1
44 8669 1 1 9 LEU CD2 C 3.447 -1.952 0.660 1.00 . A A . 9 LEU CD2 1 1
44 8670 1 1 9 LEU CG C 2.084 -2.352 0.058 1.00 . A A . 9 LEU CG 1 1
44 8671 1 1 9 LEU H H -0.658 -1.909 1.762 1.00 . A A . 9 LEU H 1 1
44 8672 1 1 9 LEU HA H 1.661 0.021 1.519 1.00 . A A . 9 LEU HA 1 1
44 8673 1 1 9 LEU HB2 H 0.203 -1.507 -0.685 1.00 . A A . 9 LEU HB2 1 1
44 8674 1 1 9 LEU HB3 H 1.598 -0.486 -0.937 1.00 . A A . 9 LEU HB3 1 1
44 8675 1 1 9 LEU HD11 H 2.939 -4.019 -1.103 1.00 . A A . 9 LEU HD11 1 1
44 8676 1 1 9 LEU HD12 H 1.351 -3.486 -1.683 1.00 . A A . 9 LEU HD12 1 1
44 8677 1 1 9 LEU HD13 H 2.796 -2.504 -2.028 1.00 . A A . 9 LEU HD13 1 1
44 8678 1 1 9 LEU HD21 H 3.339 -1.491 1.658 1.00 . A A . 9 LEU HD21 1 1
44 8679 1 1 9 LEU HD22 H 4.107 -2.830 0.797 1.00 . A A . 9 LEU HD22 1 1
44 8680 1 1 9 LEU HD23 H 3.990 -1.232 0.021 1.00 . A A . 9 LEU HD23 1 1
44 8681 1 1 9 LEU HG H 1.610 -3.058 0.766 1.00 . A A . 9 LEU HG 1 1
44 8682 1 1 9 LEU N N -0.088 -1.094 2.009 1.00 . A A . 9 LEU N 1 1
44 8683 1 1 9 LEU O O -0.214 1.417 -0.505 1.00 . A A . 9 LEU O 1 1
44 8684 1 1 10 ILE C C -0.691 3.732 3.147 1.00 . A A . 10 ILE C 1 1
44 8685 1 1 10 ILE CA C -0.898 3.208 1.684 1.00 . A A . 10 ILE CA 1 1
44 8686 1 1 10 ILE CB C -2.365 3.256 1.107 1.00 . A A . 10 ILE CB 1 1
44 8687 1 1 10 ILE CD1 C -2.187 5.757 0.359 1.00 . A A . 10 ILE CD1 1 1
44 8688 1 1 10 ILE CG1 C -3.004 4.674 1.081 1.00 . A A . 10 ILE CG1 1 1
44 8689 1 1 10 ILE CG2 C -3.363 2.266 1.761 1.00 . A A . 10 ILE CG2 1 1
44 8690 1 1 10 ILE H H -0.085 1.403 2.610 1.00 . A A . 10 ILE H 1 1
44 8691 1 1 10 ILE HA H -0.279 3.832 1.013 1.00 . A A . 10 ILE HA 1 1
44 8692 1 1 10 ILE HB H -2.288 2.941 0.047 1.00 . A A . 10 ILE HB 1 1
44 8693 1 1 10 ILE HD11 H -1.917 5.450 -0.667 1.00 . A A . 10 ILE HD11 1 1
44 8694 1 1 10 ILE HD12 H -2.751 6.704 0.290 1.00 . A A . 10 ILE HD12 1 1
44 8695 1 1 10 ILE HD13 H -1.248 5.982 0.898 1.00 . A A . 10 ILE HD13 1 1
44 8696 1 1 10 ILE HG12 H -3.995 4.619 0.591 1.00 . A A . 10 ILE HG12 1 1
44 8697 1 1 10 ILE HG13 H -3.214 5.018 2.111 1.00 . A A . 10 ILE HG13 1 1
44 8698 1 1 10 ILE HG21 H -2.994 1.223 1.720 1.00 . A A . 10 ILE HG21 1 1
44 8699 1 1 10 ILE HG22 H -3.554 2.500 2.825 1.00 . A A . 10 ILE HG22 1 1
44 8700 1 1 10 ILE HG23 H -4.341 2.269 1.246 1.00 . A A . 10 ILE HG23 1 1
44 8701 1 1 10 ILE N N -0.273 1.861 1.713 1.00 . A A . 10 ILE N 1 1
44 8702 1 1 10 ILE O O -1.643 3.820 3.928 1.00 . A A . 10 ILE O 1 1
44 8703 1 1 11 GLU C C 1.348 6.032 4.985 1.00 . A A . 11 GLU C 1 1
44 8704 1 1 11 GLU CA C 0.937 4.524 4.873 1.00 . A A . 11 GLU CA 1 1
44 8705 1 1 11 GLU CB C 1.947 3.474 5.438 1.00 . A A . 11 GLU CB 1 1
44 8706 1 1 11 GLU CD C 3.363 2.681 7.463 1.00 . A A . 11 GLU CD 1 1
44 8707 1 1 11 GLU CG C 2.192 3.544 6.962 1.00 . A A . 11 GLU CG 1 1
44 8708 1 1 11 GLU H H 1.280 3.791 2.824 1.00 . A A . 11 GLU H 1 1
44 8709 1 1 11 GLU HA H 0.048 4.424 5.528 1.00 . A A . 11 GLU HA 1 1
44 8710 1 1 11 GLU HB2 H 1.580 2.442 5.238 1.00 . A A . 11 GLU HB2 1 1
44 8711 1 1 11 GLU HB3 H 2.912 3.528 4.902 1.00 . A A . 11 GLU HB3 1 1
44 8712 1 1 11 GLU HG2 H 2.393 4.593 7.253 1.00 . A A . 11 GLU HG2 1 1
44 8713 1 1 11 GLU HG3 H 1.269 3.271 7.508 1.00 . A A . 11 GLU HG3 1 1
44 8714 1 1 11 GLU N N 0.568 4.074 3.507 1.00 . A A . 11 GLU N 1 1
44 8715 1 1 11 GLU O O 0.722 6.714 5.802 1.00 . A A . 11 GLU O 1 1
44 8716 1 1 11 GLU OE1 O 4.365 3.241 7.914 1.00 . A A . 11 GLU OE1 1 1
44 8717 1 1 12 THR C C 3.498 8.403 3.036 1.00 . A A . 12 THR C 1 1
44 8718 1 1 12 THR CA C 2.770 8.010 4.365 1.00 . A A . 12 THR CA 1 1
44 8719 1 1 12 THR CB C 3.589 8.324 5.671 1.00 . A A . 12 THR CB 1 1
44 8720 1 1 12 THR CG2 C 4.041 9.789 5.815 1.00 . A A . 12 THR CG2 1 1
44 8721 1 1 12 THR H H 2.568 6.117 3.359 1.00 . A A . 12 THR H 1 1
44 8722 1 1 12 THR HA H 1.853 8.631 4.406 1.00 . A A . 12 THR HA 1 1
44 8723 1 1 12 THR HB H 4.490 7.681 5.696 1.00 . A A . 12 THR HB 1 1
44 8724 1 1 12 THR HG1 H 2.155 7.401 6.566 1.00 . A A . 12 THR HG1 1 1
44 8725 1 1 12 THR HG21 H 4.725 10.095 5.002 1.00 . A A . 12 THR HG21 1 1
44 8726 1 1 12 THR HG22 H 3.182 10.485 5.806 1.00 . A A . 12 THR HG22 1 1
44 8727 1 1 12 THR HG23 H 4.582 9.950 6.765 1.00 . A A . 12 THR HG23 1 1
44 8728 1 1 12 THR N N 2.355 6.578 4.250 1.00 . A A . 12 THR N 1 1
44 8729 1 1 12 THR O O 2.887 9.050 2.181 1.00 . A A . 12 THR O 1 1
44 8730 1 1 12 THR OG1 O 2.823 8.039 6.836 1.00 . A A . 12 THR OG1 1 1
44 8731 1 1 13 THR C C 5.189 7.420 0.453 1.00 . A A . 13 THR C 1 1
44 8732 1 1 13 THR CA C 5.591 8.335 1.647 1.00 . A A . 13 THR CA 1 1
44 8733 1 1 13 THR CB C 7.121 8.225 1.961 1.00 . A A . 13 THR CB 1 1
44 8734 1 1 13 THR CG2 C 8.045 8.735 0.840 1.00 . A A . 13 THR CG2 1 1
44 8735 1 1 13 THR H H 5.163 7.501 3.665 1.00 . A A . 13 THR H 1 1
44 8736 1 1 13 THR HA H 5.392 9.396 1.387 1.00 . A A . 13 THR HA 1 1
44 8737 1 1 13 THR HB H 7.394 7.168 2.150 1.00 . A A . 13 THR HB 1 1
44 8738 1 1 13 THR HG1 H 8.397 8.904 3.235 1.00 . A A . 13 THR HG1 1 1
44 8739 1 1 13 THR HG21 H 7.843 9.793 0.588 1.00 . A A . 13 THR HG21 1 1
44 8740 1 1 13 THR HG22 H 9.109 8.662 1.129 1.00 . A A . 13 THR HG22 1 1
44 8741 1 1 13 THR HG23 H 7.929 8.143 -0.088 1.00 . A A . 13 THR HG23 1 1
44 8742 1 1 13 THR N N 4.780 8.008 2.860 1.00 . A A . 13 THR N 1 1
44 8743 1 1 13 THR O O 5.128 6.200 0.604 1.00 . A A . 13 THR O 1 1
44 8744 1 1 13 THR OG1 O 7.447 8.986 3.122 1.00 . A A . 13 THR OG1 1 1
44 8745 1 1 14 ALA C C 5.598 6.201 -2.442 1.00 . A A . 14 ALA C 1 1
44 8746 1 1 14 ALA CA C 4.561 7.242 -1.951 1.00 . A A . 14 ALA CA 1 1
44 8747 1 1 14 ALA CB C 4.187 8.237 -3.063 1.00 . A A . 14 ALA CB 1 1
44 8748 1 1 14 ALA H H 5.019 9.030 -0.735 1.00 . A A . 14 ALA H 1 1
44 8749 1 1 14 ALA HXT H 6.852 7.685 -2.490 1.00 . A A . 14 ALA HXT 1 1
44 8750 1 1 14 ALA HA H 3.641 6.682 -1.707 1.00 . A A . 14 ALA HA 1 1
44 8751 1 1 14 ALA HB1 H 5.044 8.862 -3.377 1.00 . A A . 14 ALA HB1 1 1
44 8752 1 1 14 ALA HB2 H 3.816 7.715 -3.965 1.00 . A A . 14 ALA HB2 1 1
44 8753 1 1 14 ALA HB3 H 3.379 8.923 -2.745 1.00 . A A . 14 ALA HB3 1 1
44 8754 1 1 14 ALA N N 4.960 8.005 -0.738 1.00 . A A . 14 ALA N 1 1
44 8755 1 1 14 ALA O O 5.328 5.009 -2.584 1.00 . A A . 14 ALA O 1 1
44 8756 1 1 14 ALA OXT O 6.838 6.744 -2.678 1.00 . A A . 14 ALA OXT 1 1
45 8757 1 1 1 ACE C C 9.496 6.112 -1.698 1.00 . A A . 1 ACE C 1 1
45 8758 1 1 1 ACE CH3 C 9.099 7.314 -2.548 1.00 . A A . 1 ACE CH3 1 1
45 8759 1 1 1 ACE H1 H 9.708 8.200 -2.293 1.00 . A A . 1 ACE H1 1 1
45 8760 1 1 1 ACE H2 H 9.245 7.105 -3.624 1.00 . A A . 1 ACE H2 1 1
45 8761 1 1 1 ACE H3 H 8.036 7.580 -2.410 1.00 . A A . 1 ACE H3 1 1
45 8762 1 1 1 ACE O O 10.187 5.210 -2.180 1.00 . A A . 1 ACE O 1 1
45 8763 1 1 2 ILE C C 8.058 4.872 1.407 1.00 . A A . 2 ILE C 1 1
45 8764 1 1 2 ILE CA C 9.351 5.067 0.557 1.00 . A A . 2 ILE CA 1 1
45 8765 1 1 2 ILE CB C 10.660 5.308 1.410 1.00 . A A . 2 ILE CB 1 1
45 8766 1 1 2 ILE CD1 C 10.306 6.465 3.746 1.00 . A A . 2 ILE CD1 1 1
45 8767 1 1 2 ILE CG1 C 10.799 6.594 2.293 1.00 . A A . 2 ILE CG1 1 1
45 8768 1 1 2 ILE CG2 C 11.938 5.118 0.556 1.00 . A A . 2 ILE CG2 1 1
45 8769 1 1 2 ILE H H 8.325 6.811 -0.241 1.00 . A A . 2 ILE H 1 1
45 8770 1 1 2 ILE HA H 9.515 4.119 0.004 1.00 . A A . 2 ILE HA 1 1
45 8771 1 1 2 ILE HB H 10.691 4.472 2.115 1.00 . A A . 2 ILE HB 1 1
45 8772 1 1 2 ILE HD11 H 10.485 7.400 4.310 1.00 . A A . 2 ILE HD11 1 1
45 8773 1 1 2 ILE HD12 H 9.228 6.250 3.824 1.00 . A A . 2 ILE HD12 1 1
45 8774 1 1 2 ILE HD13 H 10.839 5.660 4.286 1.00 . A A . 2 ILE HD13 1 1
45 8775 1 1 2 ILE HG12 H 11.867 6.887 2.382 1.00 . A A . 2 ILE HG12 1 1
45 8776 1 1 2 ILE HG13 H 10.320 7.461 1.809 1.00 . A A . 2 ILE HG13 1 1
45 8777 1 1 2 ILE HG21 H 12.850 5.083 1.181 1.00 . A A . 2 ILE HG21 1 1
45 8778 1 1 2 ILE HG22 H 11.915 4.175 -0.019 1.00 . A A . 2 ILE HG22 1 1
45 8779 1 1 2 ILE HG23 H 12.074 5.941 -0.172 1.00 . A A . 2 ILE HG23 1 1
45 8780 1 1 2 ILE N N 9.069 6.139 -0.430 1.00 . A A . 2 ILE N 1 1
45 8781 1 1 2 ILE O O 7.609 5.803 2.084 1.00 . A A . 2 ILE O 1 1
45 8782 1 1 3 TRP C C 6.417 3.167 3.688 1.00 . A A . 3 TRP C 1 1
45 8783 1 1 3 TRP CA C 6.203 3.375 2.154 1.00 . A A . 3 TRP CA 1 1
45 8784 1 1 3 TRP CB C 5.396 2.189 1.547 1.00 . A A . 3 TRP CB 1 1
45 8785 1 1 3 TRP CD1 C 4.999 1.534 -0.960 1.00 . A A . 3 TRP CD1 1 1
45 8786 1 1 3 TRP CD2 C 3.831 3.291 -0.259 1.00 . A A . 3 TRP CD2 1 1
45 8787 1 1 3 TRP CE2 C 3.446 2.964 -1.585 1.00 . A A . 3 TRP CE2 1 1
45 8788 1 1 3 TRP CE3 C 3.169 4.328 0.440 1.00 . A A . 3 TRP CE3 1 1
45 8789 1 1 3 TRP CG C 4.797 2.387 0.146 1.00 . A A . 3 TRP CG 1 1
45 8790 1 1 3 TRP CH2 C 1.747 4.686 -1.500 1.00 . A A . 3 TRP CH2 1 1
45 8791 1 1 3 TRP CZ2 C 2.378 3.659 -2.205 1.00 . A A . 3 TRP CZ2 1 1
45 8792 1 1 3 TRP CZ3 C 2.145 5.023 -0.201 1.00 . A A . 3 TRP CZ3 1 1
45 8793 1 1 3 TRP H H 7.698 3.073 0.565 1.00 . A A . 3 TRP H 1 1
45 8794 1 1 3 TRP HA H 5.567 4.266 2.101 1.00 . A A . 3 TRP HA 1 1
45 8795 1 1 3 TRP HB2 H 6.014 1.271 1.561 1.00 . A A . 3 TRP HB2 1 1
45 8796 1 1 3 TRP HB3 H 4.544 1.948 2.214 1.00 . A A . 3 TRP HB3 1 1
45 8797 1 1 3 TRP HD1 H 5.656 0.676 -0.957 1.00 . A A . 3 TRP HD1 1 1
45 8798 1 1 3 TRP HE1 H 4.084 1.401 -2.950 1.00 . A A . 3 TRP HE1 1 1
45 8799 1 1 3 TRP HE3 H 3.443 4.564 1.454 1.00 . A A . 3 TRP HE3 1 1
45 8800 1 1 3 TRP HH2 H 0.937 5.229 -1.965 1.00 . A A . 3 TRP HH2 1 1
45 8801 1 1 3 TRP HZ2 H 2.056 3.400 -3.203 1.00 . A A . 3 TRP HZ2 1 1
45 8802 1 1 3 TRP HZ3 H 1.641 5.821 0.324 1.00 . A A . 3 TRP HZ3 1 1
45 8803 1 1 3 TRP N N 7.433 3.674 1.354 1.00 . A A . 3 TRP N 1 1
45 8804 1 1 3 TRP NE1 N 4.177 1.883 -2.049 1.00 . A A . 3 TRP NE1 1 1
45 8805 1 1 3 TRP O O 5.551 3.545 4.483 1.00 . A A . 3 TRP O 1 1
45 8806 1 1 4 GLY C C 7.368 0.962 6.063 1.00 . A A . 4 GLY C 1 1
45 8807 1 1 4 GLY CA C 7.890 2.296 5.498 1.00 . A A . 4 GLY CA 1 1
45 8808 1 1 4 GLY H H 8.188 2.437 3.299 1.00 . A A . 4 GLY H 1 1
45 8809 1 1 4 GLY HA2 H 8.993 2.302 5.582 1.00 . A A . 4 GLY HA2 1 1
45 8810 1 1 4 GLY HA3 H 7.566 3.139 6.141 1.00 . A A . 4 GLY HA3 1 1
45 8811 1 1 4 GLY N N 7.542 2.550 4.082 1.00 . A A . 4 GLY N 1 1
45 8812 1 1 4 GLY O O 8.124 0.001 6.227 1.00 . A A . 4 GLY O 1 1
45 8813 1 1 5 . C C 4.224 0.228 7.910 1.00 . A A . 5 SET C 1 1
45 8814 1 1 5 . CA C 5.358 -0.235 6.942 1.00 . A A . 5 SET CA 1 1
45 8815 1 1 5 . CB C 4.848 -1.238 5.862 1.00 . A A . 5 SET CB 1 1
45 8816 1 1 5 . H H 5.570 1.795 6.077 1.00 . A A . 5 SET H 1 1
45 8817 1 1 5 . HA H 6.083 -0.753 7.604 1.00 . A A . 5 SET HA 1 1
45 8818 1 1 5 . HB2 H 3.733 -0.665 8.337 1.00 . A A . 5 SET HB2 1 1
45 8819 1 1 5 . HB3 H 4.682 0.714 8.795 1.00 . A A . 5 SET HB3 1 1
45 8820 1 1 5 . HNT2 H 2.305 0.723 6.925 1.00 . A A . 5 SET HNT2 1 1
45 8821 1 1 5 . N N 6.064 0.941 6.363 1.00 . A A . 5 SET N 1 1
45 8822 1 1 5 . NT N 3.157 1.105 7.351 1.00 . A A . 5 SET NT 1 1
45 8823 1 1 5 . OG O 4.193 -0.847 4.889 1.00 . A A . 5 SET OG 1 1
45 8824 1 1 6 SER C C 3.272 -4.119 5.454 1.00 . A A . 6 SER C 1 1
45 8825 1 1 6 SER CA C 4.723 -3.632 5.148 1.00 . A A . 6 SER CA 1 1
45 8826 1 1 6 SER CB C 5.761 -4.772 5.281 1.00 . A A . 6 SER CB 1 1
45 8827 1 1 6 SER H H 5.661 -2.745 6.925 1.00 . A A . 6 SER H 1 1
45 8828 1 1 6 SER HA H 4.777 -3.257 4.105 1.00 . A A . 6 SER HA 1 1
45 8829 1 1 6 SER HB2 H 6.792 -4.387 5.162 1.00 . A A . 6 SER HB2 1 1
45 8830 1 1 6 SER HB3 H 5.722 -5.230 6.289 1.00 . A A . 6 SER HB3 1 1
45 8831 1 1 6 SER HG H 5.759 -5.386 3.451 1.00 . A A . 6 SER HG 1 1
45 8832 1 1 6 SER N N 5.142 -2.538 6.067 1.00 . A A . 6 SER N 1 1
45 8833 1 1 6 SER O O 2.811 -4.083 6.602 1.00 . A A . 6 SER O 1 1
45 8834 1 1 6 SER OG O 5.546 -5.782 4.300 1.00 . A A . 6 SER OG 1 1
45 8835 1 1 7 GLY C C 0.166 -4.027 3.979 1.00 . A A . 7 GLY C 1 1
45 8836 1 1 7 GLY CA C 1.159 -5.061 4.543 1.00 . A A . 7 GLY CA 1 1
45 8837 1 1 7 GLY H H 3.056 -4.579 3.512 1.00 . A A . 7 GLY H 1 1
45 8838 1 1 7 GLY HA2 H 1.055 -6.007 3.980 1.00 . A A . 7 GLY HA2 1 1
45 8839 1 1 7 GLY HA3 H 0.893 -5.321 5.586 1.00 . A A . 7 GLY HA3 1 1
45 8840 1 1 7 GLY N N 2.562 -4.586 4.411 1.00 . A A . 7 GLY N 1 1
45 8841 1 1 7 GLY O O -0.442 -4.258 2.931 1.00 . A A . 7 GLY O 1 1
45 8842 1 1 8 LYS C C -0.024 -0.875 3.336 1.00 . A A . 8 LYS C 1 1
45 8843 1 1 8 LYS CA C -0.871 -1.781 4.274 1.00 . A A . 8 LYS CA 1 1
45 8844 1 1 8 LYS CB C -1.371 -1.043 5.544 1.00 . A A . 8 LYS CB 1 1
45 8845 1 1 8 LYS CD C -2.766 0.921 6.493 1.00 . A A . 8 LYS CD 1 1
45 8846 1 1 8 LYS CE C -1.692 1.971 6.842 1.00 . A A . 8 LYS CE 1 1
45 8847 1 1 8 LYS CG C -2.418 0.060 5.263 1.00 . A A . 8 LYS CG 1 1
45 8848 1 1 8 LYS H H 0.669 -2.766 5.456 1.00 . A A . 8 LYS H 1 1
45 8849 1 1 8 LYS HA H -1.764 -2.180 3.749 1.00 . A A . 8 LYS HA 1 1
45 8850 1 1 8 LYS HB2 H -1.817 -1.771 6.249 1.00 . A A . 8 LYS HB2 1 1
45 8851 1 1 8 LYS HB3 H -0.504 -0.615 6.085 1.00 . A A . 8 LYS HB3 1 1
45 8852 1 1 8 LYS HD2 H -3.723 1.433 6.283 1.00 . A A . 8 LYS HD2 1 1
45 8853 1 1 8 LYS HD3 H -2.964 0.261 7.360 1.00 . A A . 8 LYS HD3 1 1
45 8854 1 1 8 LYS HE2 H -0.733 1.477 7.093 1.00 . A A . 8 LYS HE2 1 1
45 8855 1 1 8 LYS HE3 H -1.479 2.611 5.962 1.00 . A A . 8 LYS HE3 1 1
45 8856 1 1 8 LYS HG2 H -2.088 0.718 4.437 1.00 . A A . 8 LYS HG2 1 1
45 8857 1 1 8 LYS HG3 H -3.342 -0.421 4.890 1.00 . A A . 8 LYS HG3 1 1
45 8858 1 1 8 LYS HZ1 H -2.990 3.322 7.763 1.00 . A A . 8 LYS HZ1 1 1
45 8859 1 1 8 LYS HZ2 H -2.296 2.265 8.820 1.00 . A A . 8 LYS HZ2 1 1
45 8860 1 1 8 LYS HZ3 H -1.418 3.525 8.217 1.00 . A A . 8 LYS HZ3 1 1
45 8861 1 1 8 LYS N N 0.007 -2.895 4.692 1.00 . A A . 8 LYS N 1 1
45 8862 1 1 8 LYS NZ N -2.120 2.818 7.973 1.00 . A A . 8 LYS NZ 1 1
45 8863 1 1 8 LYS O O 0.765 -0.034 3.783 1.00 . A A . 8 LYS O 1 1
45 8864 1 1 9 LEU C C 0.291 1.229 0.922 1.00 . A A . 9 LEU C 1 1
45 8865 1 1 9 LEU CA C 0.515 -0.318 0.967 1.00 . A A . 9 LEU CA 1 1
45 8866 1 1 9 LEU CB C 0.327 -0.985 -0.433 1.00 . A A . 9 LEU CB 1 1
45 8867 1 1 9 LEU CD1 C 0.639 -2.993 -1.967 1.00 . A A . 9 LEU CD1 1 1
45 8868 1 1 9 LEU CD2 C 2.671 -1.963 -0.894 1.00 . A A . 9 LEU CD2 1 1
45 8869 1 1 9 LEU CG C 1.167 -2.266 -0.716 1.00 . A A . 9 LEU CG 1 1
45 8870 1 1 9 LEU H H -0.778 -1.918 1.857 1.00 . A A . 9 LEU H 1 1
45 8871 1 1 9 LEU HA H 1.591 -0.410 1.215 1.00 . A A . 9 LEU HA 1 1
45 8872 1 1 9 LEU HB2 H -0.748 -1.198 -0.590 1.00 . A A . 9 LEU HB2 1 1
45 8873 1 1 9 LEU HB3 H 0.569 -0.259 -1.237 1.00 . A A . 9 LEU HB3 1 1
45 8874 1 1 9 LEU HD11 H 1.198 -3.926 -2.167 1.00 . A A . 9 LEU HD11 1 1
45 8875 1 1 9 LEU HD12 H -0.423 -3.281 -1.854 1.00 . A A . 9 LEU HD12 1 1
45 8876 1 1 9 LEU HD13 H 0.712 -2.366 -2.877 1.00 . A A . 9 LEU HD13 1 1
45 8877 1 1 9 LEU HD21 H 3.119 -1.523 0.015 1.00 . A A . 9 LEU HD21 1 1
45 8878 1 1 9 LEU HD22 H 3.250 -2.880 -1.112 1.00 . A A . 9 LEU HD22 1 1
45 8879 1 1 9 LEU HD23 H 2.857 -1.254 -1.723 1.00 . A A . 9 LEU HD23 1 1
45 8880 1 1 9 LEU HG H 1.066 -2.970 0.131 1.00 . A A . 9 LEU HG 1 1
45 8881 1 1 9 LEU N N -0.212 -1.081 2.025 1.00 . A A . 9 LEU N 1 1
45 8882 1 1 9 LEU O O 1.155 1.901 0.364 1.00 . A A . 9 LEU O 1 1
45 8883 1 1 10 ILE C C -0.653 3.807 2.925 1.00 . A A . 10 ILE C 1 1
45 8884 1 1 10 ILE CA C -1.025 3.284 1.496 1.00 . A A . 10 ILE CA 1 1
45 8885 1 1 10 ILE CB C -2.453 3.641 0.938 1.00 . A A . 10 ILE CB 1 1
45 8886 1 1 10 ILE CD1 C -1.778 5.922 -0.164 1.00 . A A . 10 ILE CD1 1 1
45 8887 1 1 10 ILE CG1 C -2.723 5.168 0.786 1.00 . A A . 10 ILE CG1 1 1
45 8888 1 1 10 ILE CG2 C -3.645 2.998 1.696 1.00 . A A . 10 ILE CG2 1 1
45 8889 1 1 10 ILE H H -1.415 1.173 2.000 1.00 . A A . 10 ILE H 1 1
45 8890 1 1 10 ILE HA H -0.319 3.765 0.793 1.00 . A A . 10 ILE HA 1 1
45 8891 1 1 10 ILE HB H -2.497 3.223 -0.088 1.00 . A A . 10 ILE HB 1 1
45 8892 1 1 10 ILE HD11 H -1.738 5.452 -1.164 1.00 . A A . 10 ILE HD11 1 1
45 8893 1 1 10 ILE HD12 H -2.106 6.967 -0.303 1.00 . A A . 10 ILE HD12 1 1
45 8894 1 1 10 ILE HD13 H -0.746 5.961 0.230 1.00 . A A . 10 ILE HD13 1 1
45 8895 1 1 10 ILE HG12 H -3.752 5.323 0.411 1.00 . A A . 10 ILE HG12 1 1
45 8896 1 1 10 ILE HG13 H -2.704 5.659 1.777 1.00 . A A . 10 ILE HG13 1 1
45 8897 1 1 10 ILE HG21 H -4.607 3.192 1.185 1.00 . A A . 10 ILE HG21 1 1
45 8898 1 1 10 ILE HG22 H -3.548 1.900 1.766 1.00 . A A . 10 ILE HG22 1 1
45 8899 1 1 10 ILE HG23 H -3.746 3.382 2.728 1.00 . A A . 10 ILE HG23 1 1
45 8900 1 1 10 ILE N N -0.799 1.806 1.477 1.00 . A A . 10 ILE N 1 1
45 8901 1 1 10 ILE O O -1.532 4.133 3.729 1.00 . A A . 10 ILE O 1 1
45 8902 1 1 11 GLU C C 2.010 5.660 4.593 1.00 . A A . 11 GLU C 1 1
45 8903 1 1 11 GLU CA C 1.175 4.332 4.552 1.00 . A A . 11 GLU CA 1 1
45 8904 1 1 11 GLU CB C 1.920 3.136 5.223 1.00 . A A . 11 GLU CB 1 1
45 8905 1 1 11 GLU CD C 3.258 2.446 7.357 1.00 . A A . 11 GLU CD 1 1
45 8906 1 1 11 GLU CG C 2.104 3.264 6.759 1.00 . A A . 11 GLU CG 1 1
45 8907 1 1 11 GLU H H 1.243 3.359 2.558 1.00 . A A . 11 GLU H 1 1
45 8908 1 1 11 GLU HA H 0.305 4.530 5.209 1.00 . A A . 11 GLU HA 1 1
45 8909 1 1 11 GLU HB2 H 1.369 2.186 5.057 1.00 . A A . 11 GLU HB2 1 1
45 8910 1 1 11 GLU HB3 H 2.898 2.973 4.732 1.00 . A A . 11 GLU HB3 1 1
45 8911 1 1 11 GLU HG2 H 2.286 4.321 7.029 1.00 . A A . 11 GLU HG2 1 1
45 8912 1 1 11 GLU HG3 H 1.160 3.013 7.276 1.00 . A A . 11 GLU HG3 1 1
45 8913 1 1 11 GLU N N 0.665 3.889 3.220 1.00 . A A . 11 GLU N 1 1
45 8914 1 1 11 GLU O O 1.798 6.414 5.549 1.00 . A A . 11 GLU O 1 1
45 8915 1 1 11 GLU OE1 O 4.227 3.046 7.830 1.00 . A A . 11 GLU OE1 1 1
45 8916 1 1 12 THR C C 3.849 7.889 2.321 1.00 . A A . 12 THR C 1 1
45 8917 1 1 12 THR CA C 3.769 7.218 3.729 1.00 . A A . 12 THR CA 1 1
45 8918 1 1 12 THR CB C 5.138 6.941 4.443 1.00 . A A . 12 THR CB 1 1
45 8919 1 1 12 THR CG2 C 6.009 8.188 4.666 1.00 . A A . 12 THR CG2 1 1
45 8920 1 1 12 THR H H 2.914 5.461 2.773 1.00 . A A . 12 THR H 1 1
45 8921 1 1 12 THR HA H 3.249 7.964 4.363 1.00 . A A . 12 THR HA 1 1
45 8922 1 1 12 THR HB H 5.721 6.220 3.840 1.00 . A A . 12 THR HB 1 1
45 8923 1 1 12 THR HG1 H 4.473 5.528 5.573 1.00 . A A . 12 THR HG1 1 1
45 8924 1 1 12 THR HG21 H 6.293 8.672 3.713 1.00 . A A . 12 THR HG21 1 1
45 8925 1 1 12 THR HG22 H 5.491 8.945 5.282 1.00 . A A . 12 THR HG22 1 1
45 8926 1 1 12 THR HG23 H 6.951 7.930 5.185 1.00 . A A . 12 THR HG23 1 1
45 8927 1 1 12 THR N N 2.947 5.973 3.660 1.00 . A A . 12 THR N 1 1
45 8928 1 1 12 THR O O 3.025 8.765 2.043 1.00 . A A . 12 THR O 1 1
45 8929 1 1 12 THR OG1 O 4.930 6.359 5.728 1.00 . A A . 12 THR OG1 1 1
45 8930 1 1 13 THR C C 5.171 7.017 -0.992 1.00 . A A . 13 THR C 1 1
45 8931 1 1 13 THR CA C 4.979 8.120 0.096 1.00 . A A . 13 THR CA 1 1
45 8932 1 1 13 THR CB C 6.184 9.118 0.141 1.00 . A A . 13 THR CB 1 1
45 8933 1 1 13 THR CG2 C 6.377 9.963 -1.131 1.00 . A A . 13 THR CG2 1 1
45 8934 1 1 13 THR H H 5.459 6.795 1.800 1.00 . A A . 13 THR H 1 1
45 8935 1 1 13 THR HA H 4.074 8.709 -0.159 1.00 . A A . 13 THR HA 1 1
45 8936 1 1 13 THR HB H 7.118 8.551 0.326 1.00 . A A . 13 THR HB 1 1
45 8937 1 1 13 THR HG1 H 6.778 10.647 1.153 1.00 . A A . 13 THR HG1 1 1
45 8938 1 1 13 THR HG21 H 5.485 10.579 -1.349 1.00 . A A . 13 THR HG21 1 1
45 8939 1 1 13 THR HG22 H 7.237 10.651 -1.031 1.00 . A A . 13 THR HG22 1 1
45 8940 1 1 13 THR HG23 H 6.571 9.340 -2.021 1.00 . A A . 13 THR HG23 1 1
45 8941 1 1 13 THR N N 4.802 7.498 1.444 1.00 . A A . 13 THR N 1 1
45 8942 1 1 13 THR O O 5.862 6.014 -0.781 1.00 . A A . 13 THR O 1 1
45 8943 1 1 13 THR OG1 O 6.024 10.056 1.203 1.00 . A A . 13 THR OG1 1 1
45 8944 1 1 14 ALA C C 6.002 6.386 -4.094 1.00 . A A . 14 ALA C 1 1
45 8945 1 1 14 ALA CA C 4.662 6.301 -3.328 1.00 . A A . 14 ALA CA 1 1
45 8946 1 1 14 ALA CB C 3.463 6.549 -4.264 1.00 . A A . 14 ALA CB 1 1
45 8947 1 1 14 ALA H H 4.011 8.097 -2.223 1.00 . A A . 14 ALA H 1 1
45 8948 1 1 14 ALA HXT H 5.558 8.258 -4.383 1.00 . A A . 14 ALA HXT 1 1
45 8949 1 1 14 ALA HA H 4.572 5.267 -2.949 1.00 . A A . 14 ALA HA 1 1
45 8950 1 1 14 ALA HB1 H 3.475 7.560 -4.713 1.00 . A A . 14 ALA HB1 1 1
45 8951 1 1 14 ALA HB2 H 3.446 5.823 -5.098 1.00 . A A . 14 ALA HB2 1 1
45 8952 1 1 14 ALA HB3 H 2.497 6.441 -3.736 1.00 . A A . 14 ALA HB3 1 1
45 8953 1 1 14 ALA N N 4.576 7.243 -2.182 1.00 . A A . 14 ALA N 1 1
45 8954 1 1 14 ALA O O 6.754 5.422 -4.229 1.00 . A A . 14 ALA O 1 1
45 8955 1 1 14 ALA OXT O 6.260 7.639 -4.596 1.00 . A A . 14 ALA OXT 1 1
46 8956 1 1 1 ACE C C 9.109 4.638 -2.956 1.00 . A A . 1 ACE C 1 1
46 8957 1 1 1 ACE CH3 C 8.838 5.750 -3.961 1.00 . A A . 1 ACE CH3 1 1
46 8958 1 1 1 ACE H1 H 9.594 6.552 -3.882 1.00 . A A . 1 ACE H1 1 1
46 8959 1 1 1 ACE H2 H 8.868 5.365 -4.998 1.00 . A A . 1 ACE H2 1 1
46 8960 1 1 1 ACE H3 H 7.842 6.204 -3.813 1.00 . A A . 1 ACE H3 1 1
46 8961 1 1 1 ACE O O 9.600 3.569 -3.325 1.00 . A A . 1 ACE O 1 1
46 8962 1 1 2 ILE C C 7.751 4.137 0.376 1.00 . A A . 2 ILE C 1 1
46 8963 1 1 2 ILE CA C 8.993 3.982 -0.555 1.00 . A A . 2 ILE CA 1 1
46 8964 1 1 2 ILE CB C 10.384 4.121 0.177 1.00 . A A . 2 ILE CB 1 1
46 8965 1 1 2 ILE CD1 C 10.401 5.639 2.325 1.00 . A A . 2 ILE CD1 1 1
46 8966 1 1 2 ILE CG1 C 10.793 5.477 0.845 1.00 . A A . 2 ILE CG1 1 1
46 8967 1 1 2 ILE CG2 C 11.546 3.604 -0.708 1.00 . A A . 2 ILE CG2 1 1
46 8968 1 1 2 ILE H H 8.201 5.742 -1.562 1.00 . A A . 2 ILE H 1 1
46 8969 1 1 2 ILE HA H 8.961 2.948 -0.959 1.00 . A A . 2 ILE HA 1 1
46 8970 1 1 2 ILE HB H 10.340 3.399 0.998 1.00 . A A . 2 ILE HB 1 1
46 8971 1 1 2 ILE HD11 H 10.767 6.600 2.729 1.00 . A A . 2 ILE HD11 1 1
46 8972 1 1 2 ILE HD12 H 9.311 5.619 2.493 1.00 . A A . 2 ILE HD12 1 1
46 8973 1 1 2 ILE HD13 H 10.841 4.840 2.952 1.00 . A A . 2 ILE HD13 1 1
46 8974 1 1 2 ILE HG12 H 11.897 5.597 0.832 1.00 . A A . 2 ILE HG12 1 1
46 8975 1 1 2 ILE HG13 H 10.420 6.335 0.260 1.00 . A A . 2 ILE HG13 1 1
46 8976 1 1 2 ILE HG21 H 12.488 3.507 -0.137 1.00 . A A . 2 ILE HG21 1 1
46 8977 1 1 2 ILE HG22 H 11.331 2.604 -1.129 1.00 . A A . 2 ILE HG22 1 1
46 8978 1 1 2 ILE HG23 H 11.750 4.280 -1.559 1.00 . A A . 2 ILE HG23 1 1
46 8979 1 1 2 ILE N N 8.804 4.928 -1.684 1.00 . A A . 2 ILE N 1 1
46 8980 1 1 2 ILE O O 7.515 5.218 0.926 1.00 . A A . 2 ILE O 1 1
46 8981 1 1 3 TRP C C 5.995 3.110 2.962 1.00 . A A . 3 TRP C 1 1
46 8982 1 1 3 TRP CA C 5.732 3.108 1.423 1.00 . A A . 3 TRP CA 1 1
46 8983 1 1 3 TRP CB C 4.727 1.978 1.054 1.00 . A A . 3 TRP CB 1 1
46 8984 1 1 3 TRP CD1 C 4.048 1.183 -1.354 1.00 . A A . 3 TRP CD1 1 1
46 8985 1 1 3 TRP CD2 C 3.058 3.050 -0.669 1.00 . A A . 3 TRP CD2 1 1
46 8986 1 1 3 TRP CE2 C 2.530 2.669 -1.926 1.00 . A A . 3 TRP CE2 1 1
46 8987 1 1 3 TRP CE3 C 2.602 4.226 -0.029 1.00 . A A . 3 TRP CE3 1 1
46 8988 1 1 3 TRP CG C 3.998 2.108 -0.290 1.00 . A A . 3 TRP CG 1 1
46 8989 1 1 3 TRP CH2 C 1.093 4.616 -1.897 1.00 . A A . 3 TRP CH2 1 1
46 8990 1 1 3 TRP CZ2 C 1.521 3.451 -2.539 1.00 . A A . 3 TRP CZ2 1 1
46 8991 1 1 3 TRP CZ3 C 1.636 5.005 -0.667 1.00 . A A . 3 TRP CZ3 1 1
46 8992 1 1 3 TRP H H 7.044 2.325 -0.163 1.00 . A A . 3 TRP H 1 1
46 8993 1 1 3 TRP HA H 5.235 4.070 1.245 1.00 . A A . 3 TRP HA 1 1
46 8994 1 1 3 TRP HB2 H 5.229 0.993 1.117 1.00 . A A . 3 TRP HB2 1 1
46 8995 1 1 3 TRP HB3 H 3.934 1.919 1.825 1.00 . A A . 3 TRP HB3 1 1
46 8996 1 1 3 TRP HD1 H 4.666 0.297 -1.365 1.00 . A A . 3 TRP HD1 1 1
46 8997 1 1 3 TRP HE1 H 2.959 1.003 -3.251 1.00 . A A . 3 TRP HE1 1 1
46 8998 1 1 3 TRP HE3 H 3.002 4.521 0.927 1.00 . A A . 3 TRP HE3 1 1
46 8999 1 1 3 TRP HH2 H 0.336 5.230 -2.362 1.00 . A A . 3 TRP HH2 1 1
46 9000 1 1 3 TRP HZ2 H 1.104 3.167 -3.494 1.00 . A A . 3 TRP HZ2 1 1
46 9001 1 1 3 TRP HZ3 H 1.291 5.913 -0.194 1.00 . A A . 3 TRP HZ3 1 1
46 9002 1 1 3 TRP N N 6.935 3.071 0.534 1.00 . A A . 3 TRP N 1 1
46 9003 1 1 3 TRP NE1 N 3.142 1.513 -2.380 1.00 . A A . 3 TRP NE1 1 1
46 9004 1 1 3 TRP O O 5.210 3.700 3.709 1.00 . A A . 3 TRP O 1 1
46 9005 1 1 4 GLY C C 6.863 1.115 5.572 1.00 . A A . 4 GLY C 1 1
46 9006 1 1 4 GLY CA C 7.423 2.362 4.858 1.00 . A A . 4 GLY CA 1 1
46 9007 1 1 4 GLY H H 7.654 2.120 2.653 1.00 . A A . 4 GLY H 1 1
46 9008 1 1 4 GLY HA2 H 8.526 2.345 4.933 1.00 . A A . 4 GLY HA2 1 1
46 9009 1 1 4 GLY HA3 H 7.126 3.282 5.399 1.00 . A A . 4 GLY HA3 1 1
46 9010 1 1 4 GLY N N 7.060 2.439 3.422 1.00 . A A . 4 GLY N 1 1
46 9011 1 1 4 GLY O O 7.602 0.170 5.856 1.00 . A A . 4 GLY O 1 1
46 9012 1 1 5 . C C 3.575 0.561 7.304 1.00 . A A . 5 SET C 1 1
46 9013 1 1 5 . CA C 4.833 0.032 6.550 1.00 . A A . 5 SET CA 1 1
46 9014 1 1 5 . CB C 4.490 -1.152 5.591 1.00 . A A . 5 SET CB 1 1
46 9015 1 1 5 . H H 5.066 1.967 5.489 1.00 . A A . 5 SET H 1 1
46 9016 1 1 5 . HA H 5.504 -0.330 7.356 1.00 . A A . 5 SET HA 1 1
46 9017 1 1 5 . HB2 H 3.054 -0.281 7.798 1.00 . A A . 5 SET HB2 1 1
46 9018 1 1 5 . HB3 H 3.926 1.200 8.141 1.00 . A A . 5 SET HB3 1 1
46 9019 1 1 5 . HNT2 H 2.660 1.298 5.445 1.00 . A A . 5 SET HNT2 1 1
46 9020 1 1 5 . N N 5.552 1.142 5.859 1.00 . A A . 5 SET N 1 1
46 9021 1 1 5 . NT N 2.600 1.310 6.470 1.00 . A A . 5 SET NT 1 1
46 9022 1 1 5 . OG O 3.847 -0.959 4.554 1.00 . A A . 5 SET OG 1 1
46 9023 1 1 6 SER C C 3.223 -4.161 5.424 1.00 . A A . 6 SER C 1 1
46 9024 1 1 6 SER CA C 4.660 -3.611 5.174 1.00 . A A . 6 SER CA 1 1
46 9025 1 1 6 SER CB C 5.748 -4.645 5.542 1.00 . A A . 6 SER CB 1 1
46 9026 1 1 6 SER H H 5.412 -2.413 6.861 1.00 . A A . 6 SER H 1 1
46 9027 1 1 6 SER HA H 4.790 -3.370 4.099 1.00 . A A . 6 SER HA 1 1
46 9028 1 1 6 SER HB2 H 6.760 -4.209 5.418 1.00 . A A . 6 SER HB2 1 1
46 9029 1 1 6 SER HB3 H 5.676 -4.948 6.604 1.00 . A A . 6 SER HB3 1 1
46 9030 1 1 6 SER HG H 4.824 -6.224 4.929 1.00 . A A . 6 SER HG 1 1
46 9031 1 1 6 SER N N 4.913 -2.376 5.966 1.00 . A A . 6 SER N 1 1
46 9032 1 1 6 SER O O 2.715 -4.130 6.552 1.00 . A A . 6 SER O 1 1
46 9033 1 1 6 SER OG O 5.658 -5.800 4.714 1.00 . A A . 6 SER OG 1 1
46 9034 1 1 7 GLY C C 0.192 -4.152 3.929 1.00 . A A . 7 GLY C 1 1
46 9035 1 1 7 GLY CA C 1.192 -5.205 4.443 1.00 . A A . 7 GLY CA 1 1
46 9036 1 1 7 GLY H H 3.100 -4.638 3.476 1.00 . A A . 7 GLY H 1 1
46 9037 1 1 7 GLY HA2 H 1.118 -6.114 3.818 1.00 . A A . 7 GLY HA2 1 1
46 9038 1 1 7 GLY HA3 H 0.922 -5.537 5.465 1.00 . A A . 7 GLY HA3 1 1
46 9039 1 1 7 GLY N N 2.581 -4.680 4.360 1.00 . A A . 7 GLY N 1 1
46 9040 1 1 7 GLY O O -0.378 -4.309 2.846 1.00 . A A . 7 GLY O 1 1
46 9041 1 1 8 LYS C C 0.013 -0.954 3.571 1.00 . A A . 8 LYS C 1 1
46 9042 1 1 8 LYS CA C -0.889 -1.944 4.366 1.00 . A A . 8 LYS CA 1 1
46 9043 1 1 8 LYS CB C -1.466 -1.355 5.680 1.00 . A A . 8 LYS CB 1 1
46 9044 1 1 8 LYS CD C -2.961 0.439 6.791 1.00 . A A . 8 LYS CD 1 1
46 9045 1 1 8 LYS CE C -1.938 1.430 7.381 1.00 . A A . 8 LYS CE 1 1
46 9046 1 1 8 LYS CG C -2.500 -0.224 5.477 1.00 . A A . 8 LYS CG 1 1
46 9047 1 1 8 LYS H H 0.608 -3.023 5.535 1.00 . A A . 8 LYS H 1 1
46 9048 1 1 8 LYS HA H -1.740 -2.292 3.744 1.00 . A A . 8 LYS HA 1 1
46 9049 1 1 8 LYS HB2 H -1.948 -2.160 6.268 1.00 . A A . 8 LYS HB2 1 1
46 9050 1 1 8 LYS HB3 H -0.634 -0.992 6.317 1.00 . A A . 8 LYS HB3 1 1
46 9051 1 1 8 LYS HD2 H -3.908 0.973 6.588 1.00 . A A . 8 LYS HD2 1 1
46 9052 1 1 8 LYS HD3 H -3.216 -0.346 7.529 1.00 . A A . 8 LYS HD3 1 1
46 9053 1 1 8 LYS HE2 H -0.974 0.924 7.586 1.00 . A A . 8 LYS HE2 1 1
46 9054 1 1 8 LYS HE3 H -1.710 2.224 6.643 1.00 . A A . 8 LYS HE3 1 1
46 9055 1 1 8 LYS HG2 H -2.107 0.549 4.789 1.00 . A A . 8 LYS HG2 1 1
46 9056 1 1 8 LYS HG3 H -3.384 -0.645 4.960 1.00 . A A . 8 LYS HG3 1 1
46 9057 1 1 8 LYS HZ1 H -1.763 2.703 9.032 1.00 . A A . 8 LYS HZ1 1 1
46 9058 1 1 8 LYS HZ2 H -3.310 2.568 8.471 1.00 . A A . 8 LYS HZ2 1 1
46 9059 1 1 8 LYS HZ3 H -2.640 1.341 9.346 1.00 . A A . 8 LYS HZ3 1 1
46 9060 1 1 8 LYS N N -0.011 -3.081 4.725 1.00 . A A . 8 LYS N 1 1
46 9061 1 1 8 LYS NZ N -2.439 2.046 8.626 1.00 . A A . 8 LYS NZ 1 1
46 9062 1 1 8 LYS O O 0.675 -0.079 4.142 1.00 . A A . 8 LYS O 1 1
46 9063 1 1 9 LEU C C 0.176 1.041 0.876 1.00 . A A . 9 LEU C 1 1
46 9064 1 1 9 LEU CA C 0.857 -0.296 1.318 1.00 . A A . 9 LEU CA 1 1
46 9065 1 1 9 LEU CB C 1.346 -1.180 0.128 1.00 . A A . 9 LEU CB 1 1
46 9066 1 1 9 LEU CD1 C 2.576 -3.173 -0.860 1.00 . A A . 9 LEU CD1 1 1
46 9067 1 1 9 LEU CD2 C 3.646 -1.947 1.060 1.00 . A A . 9 LEU CD2 1 1
46 9068 1 1 9 LEU CG C 2.306 -2.372 0.427 1.00 . A A . 9 LEU CG 1 1
46 9069 1 1 9 LEU H H -0.533 -1.933 1.940 1.00 . A A . 9 LEU H 1 1
46 9070 1 1 9 LEU HA H 1.778 0.017 1.849 1.00 . A A . 9 LEU HA 1 1
46 9071 1 1 9 LEU HB2 H 0.455 -1.557 -0.413 1.00 . A A . 9 LEU HB2 1 1
46 9072 1 1 9 LEU HB3 H 1.848 -0.524 -0.609 1.00 . A A . 9 LEU HB3 1 1
46 9073 1 1 9 LEU HD11 H 3.215 -4.055 -0.668 1.00 . A A . 9 LEU HD11 1 1
46 9074 1 1 9 LEU HD12 H 1.639 -3.553 -1.308 1.00 . A A . 9 LEU HD12 1 1
46 9075 1 1 9 LEU HD13 H 3.084 -2.563 -1.632 1.00 . A A . 9 LEU HD13 1 1
46 9076 1 1 9 LEU HD21 H 3.501 -1.441 2.030 1.00 . A A . 9 LEU HD21 1 1
46 9077 1 1 9 LEU HD22 H 4.299 -2.817 1.260 1.00 . A A . 9 LEU HD22 1 1
46 9078 1 1 9 LEU HD23 H 4.213 -1.255 0.411 1.00 . A A . 9 LEU HD23 1 1
46 9079 1 1 9 LEU HG H 1.817 -3.066 1.136 1.00 . A A . 9 LEU HG 1 1
46 9080 1 1 9 LEU N N 0.026 -1.126 2.239 1.00 . A A . 9 LEU N 1 1
46 9081 1 1 9 LEU O O -0.035 1.311 -0.311 1.00 . A A . 9 LEU O 1 1
46 9082 1 1 10 ILE C C -0.383 4.093 2.935 1.00 . A A . 10 ILE C 1 1
46 9083 1 1 10 ILE CA C -0.761 3.227 1.685 1.00 . A A . 10 ILE CA 1 1
46 9084 1 1 10 ILE CB C -2.285 3.159 1.288 1.00 . A A . 10 ILE CB 1 1
46 9085 1 1 10 ILE CD1 C -2.202 5.347 -0.137 1.00 . A A . 10 ILE CD1 1 1
46 9086 1 1 10 ILE CG1 C -2.927 4.535 0.946 1.00 . A A . 10 ILE CG1 1 1
46 9087 1 1 10 ILE CG2 C -3.191 2.407 2.296 1.00 . A A . 10 ILE CG2 1 1
46 9088 1 1 10 ILE H H -0.045 1.472 2.805 1.00 . A A . 10 ILE H 1 1
46 9089 1 1 10 ILE HA H -0.246 3.693 0.826 1.00 . A A . 10 ILE HA 1 1
46 9090 1 1 10 ILE HB H -2.334 2.570 0.352 1.00 . A A . 10 ILE HB 1 1
46 9091 1 1 10 ILE HD11 H -2.776 6.248 -0.415 1.00 . A A . 10 ILE HD11 1 1
46 9092 1 1 10 ILE HD12 H -1.212 5.694 0.213 1.00 . A A . 10 ILE HD12 1 1
46 9093 1 1 10 ILE HD13 H -2.040 4.752 -1.055 1.00 . A A . 10 ILE HD13 1 1
46 9094 1 1 10 ILE HG12 H -3.969 4.378 0.608 1.00 . A A . 10 ILE HG12 1 1
46 9095 1 1 10 ILE HG13 H -3.013 5.156 1.858 1.00 . A A . 10 ILE HG13 1 1
46 9096 1 1 10 ILE HG21 H -4.226 2.307 1.922 1.00 . A A . 10 ILE HG21 1 1
46 9097 1 1 10 ILE HG22 H -2.828 1.380 2.486 1.00 . A A . 10 ILE HG22 1 1
46 9098 1 1 10 ILE HG23 H -3.247 2.919 3.275 1.00 . A A . 10 ILE HG23 1 1
46 9099 1 1 10 ILE N N -0.142 1.885 1.872 1.00 . A A . 10 ILE N 1 1
46 9100 1 1 10 ILE O O -1.249 4.487 3.722 1.00 . A A . 10 ILE O 1 1
46 9101 1 1 11 GLU C C 2.456 6.334 3.995 1.00 . A A . 11 GLU C 1 1
46 9102 1 1 11 GLU CA C 1.442 5.169 4.269 1.00 . A A . 11 GLU CA 1 1
46 9103 1 1 11 GLU CB C 2.069 4.183 5.298 1.00 . A A . 11 GLU CB 1 1
46 9104 1 1 11 GLU CD C 1.789 2.248 6.984 1.00 . A A . 11 GLU CD 1 1
46 9105 1 1 11 GLU CG C 1.095 3.184 5.981 1.00 . A A . 11 GLU CG 1 1
46 9106 1 1 11 GLU H H 1.517 3.722 2.593 1.00 . A A . 11 GLU H 1 1
46 9107 1 1 11 GLU HA H 0.596 5.653 4.791 1.00 . A A . 11 GLU HA 1 1
46 9108 1 1 11 GLU HB2 H 2.891 3.623 4.815 1.00 . A A . 11 GLU HB2 1 1
46 9109 1 1 11 GLU HB3 H 2.562 4.757 6.108 1.00 . A A . 11 GLU HB3 1 1
46 9110 1 1 11 GLU HG2 H 0.304 3.756 6.506 1.00 . A A . 11 GLU HG2 1 1
46 9111 1 1 11 GLU HG3 H 0.554 2.581 5.228 1.00 . A A . 11 GLU HG3 1 1
46 9112 1 1 11 GLU N N 0.926 4.391 3.101 1.00 . A A . 11 GLU N 1 1
46 9113 1 1 11 GLU O O 2.552 7.194 4.878 1.00 . A A . 11 GLU O 1 1
46 9114 1 1 11 GLU OE1 O 1.604 2.398 8.194 1.00 . A A . 11 GLU OE1 1 1
46 9115 1 1 12 THR C C 4.212 7.904 1.135 1.00 . A A . 12 THR C 1 1
46 9116 1 1 12 THR CA C 4.209 7.502 2.644 1.00 . A A . 12 THR CA 1 1
46 9117 1 1 12 THR CB C 5.608 7.144 3.260 1.00 . A A . 12 THR CB 1 1
46 9118 1 1 12 THR CG2 C 6.660 8.261 3.152 1.00 . A A . 12 THR CG2 1 1
46 9119 1 1 12 THR H H 2.921 5.843 2.076 1.00 . A A . 12 THR H 1 1
46 9120 1 1 12 THR HA H 3.865 8.411 3.178 1.00 . A A . 12 THR HA 1 1
46 9121 1 1 12 THR HB H 6.008 6.247 2.753 1.00 . A A . 12 THR HB 1 1
46 9122 1 1 12 THR HG1 H 5.015 7.567 5.044 1.00 . A A . 12 THR HG1 1 1
46 9123 1 1 12 THR HG21 H 6.888 8.514 2.100 1.00 . A A . 12 THR HG21 1 1
46 9124 1 1 12 THR HG22 H 6.329 9.189 3.652 1.00 . A A . 12 THR HG22 1 1
46 9125 1 1 12 THR HG23 H 7.616 7.957 3.619 1.00 . A A . 12 THR HG23 1 1
46 9126 1 1 12 THR N N 3.219 6.409 2.874 1.00 . A A . 12 THR N 1 1
46 9127 1 1 12 THR O O 3.515 8.861 0.783 1.00 . A A . 12 THR O 1 1
46 9128 1 1 12 THR OG1 O 5.492 6.834 4.646 1.00 . A A . 12 THR OG1 1 1
46 9129 1 1 13 THR C C 4.988 6.258 -2.074 1.00 . A A . 13 THR C 1 1
46 9130 1 1 13 THR CA C 5.060 7.548 -1.196 1.00 . A A . 13 THR CA 1 1
46 9131 1 1 13 THR CB C 6.381 8.355 -1.441 1.00 . A A . 13 THR CB 1 1
46 9132 1 1 13 THR CG2 C 6.541 8.930 -2.859 1.00 . A A . 13 THR CG2 1 1
46 9133 1 1 13 THR H H 5.539 6.462 0.668 1.00 . A A . 13 THR H 1 1
46 9134 1 1 13 THR HA H 4.211 8.206 -1.473 1.00 . A A . 13 THR HA 1 1
46 9135 1 1 13 THR HB H 7.249 7.700 -1.231 1.00 . A A . 13 THR HB 1 1
46 9136 1 1 13 THR HG1 H 7.269 9.938 -0.792 1.00 . A A . 13 THR HG1 1 1
46 9137 1 1 13 THR HG21 H 5.713 9.616 -3.117 1.00 . A A . 13 THR HG21 1 1
46 9138 1 1 13 THR HG22 H 7.484 9.500 -2.957 1.00 . A A . 13 THR HG22 1 1
46 9139 1 1 13 THR HG23 H 6.568 8.140 -3.630 1.00 . A A . 13 THR HG23 1 1
46 9140 1 1 13 THR N N 4.961 7.201 0.255 1.00 . A A . 13 THR N 1 1
46 9141 1 1 13 THR O O 5.519 5.201 -1.719 1.00 . A A . 13 THR O 1 1
46 9142 1 1 13 THR OG1 O 6.458 9.478 -0.565 1.00 . A A . 13 THR OG1 1 1
46 9143 1 1 14 ALA C C 5.481 4.988 -5.044 1.00 . A A . 14 ALA C 1 1
46 9144 1 1 14 ALA CA C 4.202 5.258 -4.220 1.00 . A A . 14 ALA CA 1 1
46 9145 1 1 14 ALA CB C 2.990 5.542 -5.129 1.00 . A A . 14 ALA CB 1 1
46 9146 1 1 14 ALA H H 3.935 7.300 -3.427 1.00 . A A . 14 ALA H 1 1
46 9147 1 1 14 ALA HXT H 5.288 6.814 -5.684 1.00 . A A . 14 ALA HXT 1 1
46 9148 1 1 14 ALA HA H 3.979 4.332 -3.661 1.00 . A A . 14 ALA HA 1 1
46 9149 1 1 14 ALA HB1 H 3.127 6.448 -5.749 1.00 . A A . 14 ALA HB1 1 1
46 9150 1 1 14 ALA HB2 H 2.799 4.700 -5.820 1.00 . A A . 14 ALA HB2 1 1
46 9151 1 1 14 ALA HB3 H 2.062 5.686 -4.546 1.00 . A A . 14 ALA HB3 1 1
46 9152 1 1 14 ALA N N 4.352 6.379 -3.257 1.00 . A A . 14 ALA N 1 1
46 9153 1 1 14 ALA O O 6.079 3.913 -5.014 1.00 . A A . 14 ALA O 1 1
46 9154 1 1 14 ALA OXT O 5.878 6.067 -5.797 1.00 . A A . 14 ALA OXT 1 1
47 9155 1 1 1 ACE C C 8.383 1.842 -3.547 1.00 . A A . 1 ACE C 1 1
47 9156 1 1 1 ACE CH3 C 8.269 2.594 -4.868 1.00 . A A . 1 ACE CH3 1 1
47 9157 1 1 1 ACE H1 H 8.253 1.896 -5.724 1.00 . A A . 1 ACE H1 1 1
47 9158 1 1 1 ACE H2 H 7.342 3.192 -4.914 1.00 . A A . 1 ACE H2 1 1
47 9159 1 1 1 ACE H3 H 9.125 3.280 -5.021 1.00 . A A . 1 ACE H3 1 1
47 9160 1 1 1 ACE O O 8.383 0.608 -3.528 1.00 . A A . 1 ACE O 1 1
47 9161 1 1 2 ILE C C 7.656 2.934 -0.187 1.00 . A A . 2 ILE C 1 1
47 9162 1 1 2 ILE CA C 8.610 2.076 -1.076 1.00 . A A . 2 ILE CA 1 1
47 9163 1 1 2 ILE CB C 10.088 1.928 -0.545 1.00 . A A . 2 ILE CB 1 1
47 9164 1 1 2 ILE CD1 C 10.944 3.831 1.047 1.00 . A A . 2 ILE CD1 1 1
47 9165 1 1 2 ILE CG1 C 10.996 3.188 -0.351 1.00 . A A . 2 ILE CG1 1 1
47 9166 1 1 2 ILE CG2 C 10.868 0.837 -1.322 1.00 . A A . 2 ILE CG2 1 1
47 9167 1 1 2 ILE H H 8.304 3.603 -2.603 1.00 . A A . 2 ILE H 1 1
47 9168 1 1 2 ILE HA H 8.213 1.040 -1.067 1.00 . A A . 2 ILE HA 1 1
47 9169 1 1 2 ILE HB H 9.965 1.500 0.455 1.00 . A A . 2 ILE HB 1 1
47 9170 1 1 2 ILE HD11 H 11.633 4.691 1.111 1.00 . A A . 2 ILE HD11 1 1
47 9171 1 1 2 ILE HD12 H 9.944 4.203 1.319 1.00 . A A . 2 ILE HD12 1 1
47 9172 1 1 2 ILE HD13 H 11.247 3.113 1.833 1.00 . A A . 2 ILE HD13 1 1
47 9173 1 1 2 ILE HG12 H 12.065 2.925 -0.497 1.00 . A A . 2 ILE HG12 1 1
47 9174 1 1 2 ILE HG13 H 10.794 3.949 -1.124 1.00 . A A . 2 ILE HG13 1 1
47 9175 1 1 2 ILE HG21 H 11.826 0.584 -0.830 1.00 . A A . 2 ILE HG21 1 1
47 9176 1 1 2 ILE HG22 H 10.297 -0.106 -1.397 1.00 . A A . 2 ILE HG22 1 1
47 9177 1 1 2 ILE HG23 H 11.106 1.157 -2.354 1.00 . A A . 2 ILE HG23 1 1
47 9178 1 1 2 ILE N N 8.495 2.611 -2.455 1.00 . A A . 2 ILE N 1 1
47 9179 1 1 2 ILE O O 7.914 4.116 0.055 1.00 . A A . 2 ILE O 1 1
47 9180 1 1 3 TRP C C 5.899 3.207 2.665 1.00 . A A . 3 TRP C 1 1
47 9181 1 1 3 TRP CA C 5.541 3.062 1.148 1.00 . A A . 3 TRP CA 1 1
47 9182 1 1 3 TRP CB C 4.148 2.383 1.009 1.00 . A A . 3 TRP CB 1 1
47 9183 1 1 3 TRP CD1 C 3.124 1.942 -1.373 1.00 . A A . 3 TRP CD1 1 1
47 9184 1 1 3 TRP CD2 C 2.665 3.928 -0.488 1.00 . A A . 3 TRP CD2 1 1
47 9185 1 1 3 TRP CE2 C 1.999 3.800 -1.731 1.00 . A A . 3 TRP CE2 1 1
47 9186 1 1 3 TRP CE3 C 2.540 5.112 0.277 1.00 . A A . 3 TRP CE3 1 1
47 9187 1 1 3 TRP CG C 3.364 2.760 -0.251 1.00 . A A . 3 TRP CG 1 1
47 9188 1 1 3 TRP CH2 C 1.092 6.024 -1.456 1.00 . A A . 3 TRP CH2 1 1
47 9189 1 1 3 TRP CZ2 C 1.201 4.861 -2.220 1.00 . A A . 3 TRP CZ2 1 1
47 9190 1 1 3 TRP CZ3 C 1.745 6.145 -0.223 1.00 . A A . 3 TRP CZ3 1 1
47 9191 1 1 3 TRP H H 6.312 1.437 -0.143 1.00 . A A . 3 TRP H 1 1
47 9192 1 1 3 TRP HA H 5.460 4.102 0.795 1.00 . A A . 3 TRP HA 1 1
47 9193 1 1 3 TRP HB2 H 4.240 1.284 1.094 1.00 . A A . 3 TRP HB2 1 1
47 9194 1 1 3 TRP HB3 H 3.499 2.652 1.866 1.00 . A A . 3 TRP HB3 1 1
47 9195 1 1 3 TRP HD1 H 3.491 0.933 -1.482 1.00 . A A . 3 TRP HD1 1 1
47 9196 1 1 3 TRP HE1 H 1.918 2.193 -3.190 1.00 . A A . 3 TRP HE1 1 1
47 9197 1 1 3 TRP HE3 H 3.060 5.212 1.219 1.00 . A A . 3 TRP HE3 1 1
47 9198 1 1 3 TRP HH2 H 0.485 6.842 -1.817 1.00 . A A . 3 TRP HH2 1 1
47 9199 1 1 3 TRP HZ2 H 0.690 4.778 -3.169 1.00 . A A . 3 TRP HZ2 1 1
47 9200 1 1 3 TRP HZ3 H 1.630 7.053 0.349 1.00 . A A . 3 TRP HZ3 1 1
47 9201 1 1 3 TRP N N 6.528 2.352 0.268 1.00 . A A . 3 TRP N 1 1
47 9202 1 1 3 TRP NE1 N 2.279 2.571 -2.308 1.00 . A A . 3 TRP NE1 1 1
47 9203 1 1 3 TRP O O 5.303 4.047 3.347 1.00 . A A . 3 TRP O 1 1
47 9204 1 1 4 GLY C C 6.787 1.161 5.355 1.00 . A A . 4 GLY C 1 1
47 9205 1 1 4 GLY CA C 7.265 2.412 4.593 1.00 . A A . 4 GLY CA 1 1
47 9206 1 1 4 GLY H H 7.274 1.830 2.447 1.00 . A A . 4 GLY H 1 1
47 9207 1 1 4 GLY HA2 H 8.369 2.442 4.614 1.00 . A A . 4 GLY HA2 1 1
47 9208 1 1 4 GLY HA3 H 6.947 3.335 5.116 1.00 . A A . 4 GLY HA3 1 1
47 9209 1 1 4 GLY N N 6.834 2.393 3.176 1.00 . A A . 4 GLY N 1 1
47 9210 1 1 4 GLY O O 7.565 0.231 5.579 1.00 . A A . 4 GLY O 1 1
47 9211 1 1 5 . C C 3.632 0.531 7.301 1.00 . A A . 5 SET C 1 1
47 9212 1 1 5 . CA C 4.867 0.035 6.489 1.00 . A A . 5 SET CA 1 1
47 9213 1 1 5 . CB C 4.508 -1.176 5.568 1.00 . A A . 5 SET CB 1 1
47 9214 1 1 5 . H H 4.974 1.996 5.470 1.00 . A A . 5 SET H 1 1
47 9215 1 1 5 . HA H 5.597 -0.295 7.257 1.00 . A A . 5 SET HA 1 1
47 9216 1 1 5 . HB2 H 3.164 -0.323 7.830 1.00 . A A . 5 SET HB2 1 1
47 9217 1 1 5 . HB3 H 4.001 1.191 8.111 1.00 . A A . 5 SET HB3 1 1
47 9218 1 1 5 . HNT2 H 2.631 1.270 5.487 1.00 . A A . 5 SET HNT2 1 1
47 9219 1 1 5 . N N 5.502 1.161 5.746 1.00 . A A . 5 SET N 1 1
47 9220 1 1 5 . NT N 2.591 1.241 6.514 1.00 . A A . 5 SET NT 1 1
47 9221 1 1 5 . OG O 3.861 -1.011 4.528 1.00 . A A . 5 SET OG 1 1
47 9222 1 1 6 SER C C 3.206 -4.161 5.473 1.00 . A A . 6 SER C 1 1
47 9223 1 1 6 SER CA C 4.657 -3.647 5.227 1.00 . A A . 6 SER CA 1 1
47 9224 1 1 6 SER CB C 5.721 -4.689 5.641 1.00 . A A . 6 SER CB 1 1
47 9225 1 1 6 SER H H 5.425 -2.405 6.874 1.00 . A A . 6 SER H 1 1
47 9226 1 1 6 SER HA H 4.806 -3.442 4.146 1.00 . A A . 6 SER HA 1 1
47 9227 1 1 6 SER HB2 H 6.741 -4.271 5.536 1.00 . A A . 6 SER HB2 1 1
47 9228 1 1 6 SER HB3 H 5.613 -4.970 6.707 1.00 . A A . 6 SER HB3 1 1
47 9229 1 1 6 SER HG H 6.311 -6.457 5.142 1.00 . A A . 6 SER HG 1 1
47 9230 1 1 6 SER N N 4.924 -2.390 5.981 1.00 . A A . 6 SER N 1 1
47 9231 1 1 6 SER O O 2.682 -4.083 6.591 1.00 . A A . 6 SER O 1 1
47 9232 1 1 6 SER OG O 5.629 -5.856 4.831 1.00 . A A . 6 SER OG 1 1
47 9233 1 1 7 GLY C C 0.199 -4.146 3.929 1.00 . A A . 7 GLY C 1 1
47 9234 1 1 7 GLY CA C 1.172 -5.197 4.492 1.00 . A A . 7 GLY CA 1 1
47 9235 1 1 7 GLY H H 3.117 -4.723 3.548 1.00 . A A . 7 GLY H 1 1
47 9236 1 1 7 GLY HA2 H 1.094 -6.123 3.894 1.00 . A A . 7 GLY HA2 1 1
47 9237 1 1 7 GLY HA3 H 0.883 -5.493 5.519 1.00 . A A . 7 GLY HA3 1 1
47 9238 1 1 7 GLY N N 2.571 -4.697 4.415 1.00 . A A . 7 GLY N 1 1
47 9239 1 1 7 GLY O O -0.317 -4.308 2.819 1.00 . A A . 7 GLY O 1 1
47 9240 1 1 8 LYS C C 0.010 -0.938 3.543 1.00 . A A . 8 LYS C 1 1
47 9241 1 1 8 LYS CA C -0.910 -1.943 4.297 1.00 . A A . 8 LYS CA 1 1
47 9242 1 1 8 LYS CB C -1.574 -1.351 5.567 1.00 . A A . 8 LYS CB 1 1
47 9243 1 1 8 LYS CD C -3.206 0.399 6.546 1.00 . A A . 8 LYS CD 1 1
47 9244 1 1 8 LYS CE C -2.276 1.472 7.145 1.00 . A A . 8 LYS CE 1 1
47 9245 1 1 8 LYS CG C -2.645 -0.274 5.278 1.00 . A A . 8 LYS CG 1 1
47 9246 1 1 8 LYS H H 0.527 -3.010 5.552 1.00 . A A . 8 LYS H 1 1
47 9247 1 1 8 LYS HA H -1.722 -2.306 3.634 1.00 . A A . 8 LYS HA 1 1
47 9248 1 1 8 LYS HB2 H -2.054 -2.163 6.150 1.00 . A A . 8 LYS HB2 1 1
47 9249 1 1 8 LYS HB3 H -0.793 -0.940 6.237 1.00 . A A . 8 LYS HB3 1 1
47 9250 1 1 8 LYS HD2 H -4.175 0.863 6.283 1.00 . A A . 8 LYS HD2 1 1
47 9251 1 1 8 LYS HD3 H -3.446 -0.377 7.299 1.00 . A A . 8 LYS HD3 1 1
47 9252 1 1 8 LYS HE2 H -1.293 1.035 7.407 1.00 . A A . 8 LYS HE2 1 1
47 9253 1 1 8 LYS HE3 H -2.068 2.256 6.390 1.00 . A A . 8 LYS HE3 1 1
47 9254 1 1 8 LYS HG2 H -2.251 0.499 4.590 1.00 . A A . 8 LYS HG2 1 1
47 9255 1 1 8 LYS HG3 H -3.479 -0.748 4.726 1.00 . A A . 8 LYS HG3 1 1
47 9256 1 1 8 LYS HZ1 H -2.261 2.807 8.756 1.00 . A A . 8 LYS HZ1 1 1
47 9257 1 1 8 LYS HZ2 H -3.768 2.548 8.136 1.00 . A A . 8 LYS HZ2 1 1
47 9258 1 1 8 LYS HZ3 H -3.058 1.398 9.080 1.00 . A A . 8 LYS HZ3 1 1
47 9259 1 1 8 LYS N N -0.043 -3.071 4.707 1.00 . A A . 8 LYS N 1 1
47 9260 1 1 8 LYS NZ N -2.872 2.091 8.345 1.00 . A A . 8 LYS NZ 1 1
47 9261 1 1 8 LYS O O 0.635 -0.055 4.143 1.00 . A A . 8 LYS O 1 1
47 9262 1 1 9 LEU C C 0.206 1.057 0.872 1.00 . A A . 9 LEU C 1 1
47 9263 1 1 9 LEU CA C 0.923 -0.260 1.323 1.00 . A A . 9 LEU CA 1 1
47 9264 1 1 9 LEU CB C 1.432 -1.144 0.143 1.00 . A A . 9 LEU CB 1 1
47 9265 1 1 9 LEU CD1 C 2.673 -3.181 -0.742 1.00 . A A . 9 LEU CD1 1 1
47 9266 1 1 9 LEU CD2 C 3.845 -1.685 0.909 1.00 . A A . 9 LEU CD2 1 1
47 9267 1 1 9 LEU CG C 2.480 -2.252 0.471 1.00 . A A . 9 LEU CG 1 1
47 9268 1 1 9 LEU H H -0.419 -1.947 1.898 1.00 . A A . 9 LEU H 1 1
47 9269 1 1 9 LEU HA H 1.825 0.067 1.877 1.00 . A A . 9 LEU HA 1 1
47 9270 1 1 9 LEU HB2 H 0.554 -1.600 -0.356 1.00 . A A . 9 LEU HB2 1 1
47 9271 1 1 9 LEU HB3 H 1.866 -0.493 -0.636 1.00 . A A . 9 LEU HB3 1 1
47 9272 1 1 9 LEU HD11 H 3.380 -4.002 -0.520 1.00 . A A . 9 LEU HD11 1 1
47 9273 1 1 9 LEU HD12 H 1.723 -3.658 -1.046 1.00 . A A . 9 LEU HD12 1 1
47 9274 1 1 9 LEU HD13 H 3.065 -2.641 -1.624 1.00 . A A . 9 LEU HD13 1 1
47 9275 1 1 9 LEU HD21 H 3.767 -1.085 1.833 1.00 . A A . 9 LEU HD21 1 1
47 9276 1 1 9 LEU HD22 H 4.572 -2.492 1.127 1.00 . A A . 9 LEU HD22 1 1
47 9277 1 1 9 LEU HD23 H 4.297 -1.039 0.134 1.00 . A A . 9 LEU HD23 1 1
47 9278 1 1 9 LEU HG H 2.100 -2.880 1.299 1.00 . A A . 9 LEU HG 1 1
47 9279 1 1 9 LEU N N 0.076 -1.106 2.214 1.00 . A A . 9 LEU N 1 1
47 9280 1 1 9 LEU O O -0.064 1.288 -0.311 1.00 . A A . 9 LEU O 1 1
47 9281 1 1 10 ILE C C -0.539 3.989 3.056 1.00 . A A . 10 ILE C 1 1
47 9282 1 1 10 ILE CA C -0.734 3.247 1.692 1.00 . A A . 10 ILE CA 1 1
47 9283 1 1 10 ILE CB C -2.214 3.165 1.145 1.00 . A A . 10 ILE CB 1 1
47 9284 1 1 10 ILE CD1 C -2.146 5.507 0.006 1.00 . A A . 10 ILE CD1 1 1
47 9285 1 1 10 ILE CG1 C -2.905 4.540 0.923 1.00 . A A . 10 ILE CG1 1 1
47 9286 1 1 10 ILE CG2 C -3.168 2.245 1.954 1.00 . A A . 10 ILE CG2 1 1
47 9287 1 1 10 ILE H H 0.125 1.556 2.797 1.00 . A A . 10 ILE H 1 1
47 9288 1 1 10 ILE HA H -0.147 3.799 0.932 1.00 . A A . 10 ILE HA 1 1
47 9289 1 1 10 ILE HB H -2.149 2.703 0.142 1.00 . A A . 10 ILE HB 1 1
47 9290 1 1 10 ILE HD11 H -2.742 6.412 -0.202 1.00 . A A . 10 ILE HD11 1 1
47 9291 1 1 10 ILE HD12 H -1.200 5.840 0.469 1.00 . A A . 10 ILE HD12 1 1
47 9292 1 1 10 ILE HD13 H -1.897 5.037 -0.964 1.00 . A A . 10 ILE HD13 1 1
47 9293 1 1 10 ILE HG12 H -3.910 4.381 0.487 1.00 . A A . 10 ILE HG12 1 1
47 9294 1 1 10 ILE HG13 H -3.091 5.039 1.894 1.00 . A A . 10 ILE HG13 1 1
47 9295 1 1 10 ILE HG21 H -4.153 2.143 1.460 1.00 . A A . 10 ILE HG21 1 1
47 9296 1 1 10 ILE HG22 H -2.764 1.222 2.056 1.00 . A A . 10 ILE HG22 1 1
47 9297 1 1 10 ILE HG23 H -3.357 2.625 2.975 1.00 . A A . 10 ILE HG23 1 1
47 9298 1 1 10 ILE N N -0.073 1.924 1.862 1.00 . A A . 10 ILE N 1 1
47 9299 1 1 10 ILE O O -1.485 4.126 3.840 1.00 . A A . 10 ILE O 1 1
47 9300 1 1 11 GLU C C 1.738 6.544 4.550 1.00 . A A . 11 GLU C 1 1
47 9301 1 1 11 GLU CA C 1.024 5.153 4.627 1.00 . A A . 11 GLU CA 1 1
47 9302 1 1 11 GLU CB C 1.782 4.187 5.588 1.00 . A A . 11 GLU CB 1 1
47 9303 1 1 11 GLU CD C 1.720 2.087 7.083 1.00 . A A . 11 GLU CD 1 1
47 9304 1 1 11 GLU CG C 0.934 3.011 6.139 1.00 . A A . 11 GLU CG 1 1
47 9305 1 1 11 GLU H H 1.413 4.008 2.760 1.00 . A A . 11 GLU H 1 1
47 9306 1 1 11 GLU HA H 0.078 5.384 5.154 1.00 . A A . 11 GLU HA 1 1
47 9307 1 1 11 GLU HB2 H 2.695 3.796 5.098 1.00 . A A . 11 GLU HB2 1 1
47 9308 1 1 11 GLU HB3 H 2.154 4.749 6.468 1.00 . A A . 11 GLU HB3 1 1
47 9309 1 1 11 GLU HG2 H 0.065 3.427 6.688 1.00 . A A . 11 GLU HG2 1 1
47 9310 1 1 11 GLU HG3 H 0.487 2.422 5.317 1.00 . A A . 11 GLU HG3 1 1
47 9311 1 1 11 GLU N N 0.698 4.462 3.339 1.00 . A A . 11 GLU N 1 1
47 9312 1 1 11 GLU O O 1.463 7.348 5.445 1.00 . A A . 11 GLU O 1 1
47 9313 1 1 11 GLU OE1 O 1.553 2.172 8.302 1.00 . A A . 11 GLU OE1 1 1
47 9314 1 1 12 THR C C 3.489 8.578 2.039 1.00 . A A . 12 THR C 1 1
47 9315 1 1 12 THR CA C 3.326 8.188 3.541 1.00 . A A . 12 THR CA 1 1
47 9316 1 1 12 THR CB C 4.648 8.249 4.382 1.00 . A A . 12 THR CB 1 1
47 9317 1 1 12 THR CG2 C 4.499 8.539 5.890 1.00 . A A . 12 THR CG2 1 1
47 9318 1 1 12 THR H H 2.664 6.314 2.723 1.00 . A A . 12 THR H 1 1
47 9319 1 1 12 THR HA H 2.652 8.966 3.953 1.00 . A A . 12 THR HA 1 1
47 9320 1 1 12 THR HB H 5.235 9.081 3.969 1.00 . A A . 12 THR HB 1 1
47 9321 1 1 12 THR HG1 H 4.894 6.344 4.538 1.00 . A A . 12 THR HG1 1 1
47 9322 1 1 12 THR HG21 H 3.954 9.483 6.082 1.00 . A A . 12 THR HG21 1 1
47 9323 1 1 12 THR HG22 H 3.969 7.736 6.433 1.00 . A A . 12 THR HG22 1 1
47 9324 1 1 12 THR HG23 H 5.488 8.653 6.379 1.00 . A A . 12 THR HG23 1 1
47 9325 1 1 12 THR N N 2.639 6.867 3.587 1.00 . A A . 12 THR N 1 1
47 9326 1 1 12 THR O O 2.624 9.277 1.504 1.00 . A A . 12 THR O 1 1
47 9327 1 1 12 THR OG1 O 5.433 7.071 4.218 1.00 . A A . 12 THR OG1 1 1
47 9328 1 1 13 THR C C 5.609 7.245 -0.693 1.00 . A A . 13 THR C 1 1
47 9329 1 1 13 THR CA C 4.839 8.449 -0.068 1.00 . A A . 13 THR CA 1 1
47 9330 1 1 13 THR CB C 5.648 9.784 -0.190 1.00 . A A . 13 THR CB 1 1
47 9331 1 1 13 THR CG2 C 5.914 10.241 -1.633 1.00 . A A . 13 THR CG2 1 1
47 9332 1 1 13 THR H H 5.254 7.619 1.926 1.00 . A A . 13 THR H 1 1
47 9333 1 1 13 THR HA H 3.872 8.577 -0.597 1.00 . A A . 13 THR HA 1 1
47 9334 1 1 13 THR HB H 6.625 9.665 0.317 1.00 . A A . 13 THR HB 1 1
47 9335 1 1 13 THR HG1 H 4.079 10.877 0.058 1.00 . A A . 13 THR HG1 1 1
47 9336 1 1 13 THR HG21 H 4.974 10.369 -2.201 1.00 . A A . 13 THR HG21 1 1
47 9337 1 1 13 THR HG22 H 6.448 11.208 -1.651 1.00 . A A . 13 THR HG22 1 1
47 9338 1 1 13 THR HG23 H 6.541 9.516 -2.182 1.00 . A A . 13 THR HG23 1 1
47 9339 1 1 13 THR N N 4.568 8.132 1.361 1.00 . A A . 13 THR N 1 1
47 9340 1 1 13 THR O O 6.554 6.714 -0.098 1.00 . A A . 13 THR O 1 1
47 9341 1 1 13 THR OG1 O 4.957 10.856 0.445 1.00 . A A . 13 THR OG1 1 1
47 9342 1 1 14 ALA C C 7.254 6.141 -3.235 1.00 . A A . 14 ALA C 1 1
47 9343 1 1 14 ALA CA C 5.876 5.734 -2.653 1.00 . A A . 14 ALA CA 1 1
47 9344 1 1 14 ALA CB C 4.929 5.229 -3.755 1.00 . A A . 14 ALA CB 1 1
47 9345 1 1 14 ALA H H 4.413 7.351 -2.304 1.00 . A A . 14 ALA H 1 1
47 9346 1 1 14 ALA HXT H 6.271 7.470 -4.260 1.00 . A A . 14 ALA HXT 1 1
47 9347 1 1 14 ALA HA H 6.037 4.890 -1.953 1.00 . A A . 14 ALA HA 1 1
47 9348 1 1 14 ALA HB1 H 3.959 4.903 -3.343 1.00 . A A . 14 ALA HB1 1 1
47 9349 1 1 14 ALA HB2 H 4.712 6.000 -4.518 1.00 . A A . 14 ALA HB2 1 1
47 9350 1 1 14 ALA HB3 H 5.351 4.355 -4.284 1.00 . A A . 14 ALA HB3 1 1
47 9351 1 1 14 ALA N N 5.223 6.851 -1.923 1.00 . A A . 14 ALA N 1 1
47 9352 1 1 14 ALA O O 8.307 5.601 -2.902 1.00 . A A . 14 ALA O 1 1
47 9353 1 1 14 ALA OXT O 7.174 7.170 -4.143 1.00 . A A . 14 ALA OXT 1 1
48 9354 1 1 1 ACE C C 9.033 4.653 -2.992 1.00 . A A . 1 ACE C 1 1
48 9355 1 1 1 ACE CH3 C 8.727 5.732 -4.024 1.00 . A A . 1 ACE CH3 1 1
48 9356 1 1 1 ACE H1 H 8.718 5.313 -5.046 1.00 . A A . 1 ACE H1 1 1
48 9357 1 1 1 ACE H2 H 7.740 6.198 -3.855 1.00 . A A . 1 ACE H2 1 1
48 9358 1 1 1 ACE H3 H 9.489 6.533 -3.999 1.00 . A A . 1 ACE H3 1 1
48 9359 1 1 1 ACE O O 9.551 3.590 -3.338 1.00 . A A . 1 ACE O 1 1
48 9360 1 1 2 ILE C C 7.706 4.197 0.359 1.00 . A A . 2 ILE C 1 1
48 9361 1 1 2 ILE CA C 8.945 4.052 -0.577 1.00 . A A . 2 ILE CA 1 1
48 9362 1 1 2 ILE CB C 10.337 4.246 0.145 1.00 . A A . 2 ILE CB 1 1
48 9363 1 1 2 ILE CD1 C 10.324 5.816 2.255 1.00 . A A . 2 ILE CD1 1 1
48 9364 1 1 2 ILE CG1 C 10.712 5.630 0.776 1.00 . A A . 2 ILE CG1 1 1
48 9365 1 1 2 ILE CG2 C 11.508 3.739 -0.733 1.00 . A A . 2 ILE CG2 1 1
48 9366 1 1 2 ILE H H 8.099 5.763 -1.621 1.00 . A A . 2 ILE H 1 1
48 9367 1 1 2 ILE HA H 8.939 3.008 -0.954 1.00 . A A . 2 ILE HA 1 1
48 9368 1 1 2 ILE HB H 10.315 3.543 0.984 1.00 . A A . 2 ILE HB 1 1
48 9369 1 1 2 ILE HD11 H 9.238 5.769 2.431 1.00 . A A . 2 ILE HD11 1 1
48 9370 1 1 2 ILE HD12 H 10.792 5.046 2.897 1.00 . A A . 2 ILE HD12 1 1
48 9371 1 1 2 ILE HD13 H 10.666 6.798 2.632 1.00 . A A . 2 ILE HD13 1 1
48 9372 1 1 2 ILE HG12 H 11.812 5.779 0.751 1.00 . A A . 2 ILE HG12 1 1
48 9373 1 1 2 ILE HG13 H 10.311 6.462 0.174 1.00 . A A . 2 ILE HG13 1 1
48 9374 1 1 2 ILE HG21 H 12.455 3.682 -0.165 1.00 . A A . 2 ILE HG21 1 1
48 9375 1 1 2 ILE HG22 H 11.318 2.723 -1.129 1.00 . A A . 2 ILE HG22 1 1
48 9376 1 1 2 ILE HG23 H 11.689 4.398 -1.603 1.00 . A A . 2 ILE HG23 1 1
48 9377 1 1 2 ILE N N 8.725 4.965 -1.726 1.00 . A A . 2 ILE N 1 1
48 9378 1 1 2 ILE O O 7.449 5.283 0.888 1.00 . A A . 2 ILE O 1 1
48 9379 1 1 3 TRP C C 5.985 3.143 2.971 1.00 . A A . 3 TRP C 1 1
48 9380 1 1 3 TRP CA C 5.712 3.145 1.433 1.00 . A A . 3 TRP CA 1 1
48 9381 1 1 3 TRP CB C 4.710 2.013 1.064 1.00 . A A . 3 TRP CB 1 1
48 9382 1 1 3 TRP CD1 C 4.033 1.211 -1.343 1.00 . A A . 3 TRP CD1 1 1
48 9383 1 1 3 TRP CD2 C 3.042 3.080 -0.665 1.00 . A A . 3 TRP CD2 1 1
48 9384 1 1 3 TRP CE2 C 2.514 2.692 -1.920 1.00 . A A . 3 TRP CE2 1 1
48 9385 1 1 3 TRP CE3 C 2.582 4.257 -0.028 1.00 . A A . 3 TRP CE3 1 1
48 9386 1 1 3 TRP CG C 3.982 2.140 -0.283 1.00 . A A . 3 TRP CG 1 1
48 9387 1 1 3 TRP CH2 C 1.064 4.630 -1.892 1.00 . A A . 3 TRP CH2 1 1
48 9388 1 1 3 TRP CZ2 C 1.496 3.466 -2.531 1.00 . A A . 3 TRP CZ2 1 1
48 9389 1 1 3 TRP CZ3 C 1.611 5.027 -0.666 1.00 . A A . 3 TRP CZ3 1 1
48 9390 1 1 3 TRP H H 7.042 2.357 -0.138 1.00 . A A . 3 TRP H 1 1
48 9391 1 1 3 TRP HA H 5.210 4.105 1.262 1.00 . A A . 3 TRP HA 1 1
48 9392 1 1 3 TRP HB2 H 5.211 1.029 1.129 1.00 . A A . 3 TRP HB2 1 1
48 9393 1 1 3 TRP HB3 H 3.914 1.956 1.833 1.00 . A A . 3 TRP HB3 1 1
48 9394 1 1 3 TRP HD1 H 4.652 0.324 -1.349 1.00 . A A . 3 TRP HD1 1 1
48 9395 1 1 3 TRP HE1 H 2.940 1.019 -3.236 1.00 . A A . 3 TRP HE1 1 1
48 9396 1 1 3 TRP HE3 H 2.984 4.557 0.925 1.00 . A A . 3 TRP HE3 1 1
48 9397 1 1 3 TRP HH2 H 0.301 5.238 -2.355 1.00 . A A . 3 TRP HH2 1 1
48 9398 1 1 3 TRP HZ2 H 1.076 3.175 -3.483 1.00 . A A . 3 TRP HZ2 1 1
48 9399 1 1 3 TRP HZ3 H 1.264 5.936 -0.196 1.00 . A A . 3 TRP HZ3 1 1
48 9400 1 1 3 TRP N N 6.913 3.118 0.540 1.00 . A A . 3 TRP N 1 1
48 9401 1 1 3 TRP NE1 N 3.126 1.535 -2.369 1.00 . A A . 3 TRP NE1 1 1
48 9402 1 1 3 TRP O O 5.213 3.744 3.723 1.00 . A A . 3 TRP O 1 1
48 9403 1 1 4 GLY C C 6.862 1.124 5.566 1.00 . A A . 4 GLY C 1 1
48 9404 1 1 4 GLY CA C 7.416 2.375 4.855 1.00 . A A . 4 GLY CA 1 1
48 9405 1 1 4 GLY H H 7.634 2.143 2.649 1.00 . A A . 4 GLY H 1 1
48 9406 1 1 4 GLY HA2 H 8.519 2.358 4.924 1.00 . A A . 4 GLY HA2 1 1
48 9407 1 1 4 GLY HA3 H 7.122 3.291 5.405 1.00 . A A . 4 GLY HA3 1 1
48 9408 1 1 4 GLY N N 7.045 2.458 3.423 1.00 . A A . 4 GLY N 1 1
48 9409 1 1 4 GLY O O 7.604 0.179 5.845 1.00 . A A . 4 GLY O 1 1
48 9410 1 1 5 . C C 3.579 0.554 7.303 1.00 . A A . 5 SET C 1 1
48 9411 1 1 5 . CA C 4.839 0.031 6.548 1.00 . A A . 5 SET CA 1 1
48 9412 1 1 5 . CB C 4.499 -1.156 5.591 1.00 . A A . 5 SET CB 1 1
48 9413 1 1 5 . H H 5.062 1.971 5.495 1.00 . A A . 5 SET H 1 1
48 9414 1 1 5 . HA H 5.512 -0.329 7.353 1.00 . A A . 5 SET HA 1 1
48 9415 1 1 5 . HB2 H 3.060 -0.292 7.796 1.00 . A A . 5 SET HB2 1 1
48 9416 1 1 5 . HB3 H 3.925 1.193 8.140 1.00 . A A . 5 SET HB3 1 1
48 9417 1 1 5 . HNT2 H 2.659 1.288 5.444 1.00 . A A . 5 SET HNT2 1 1
48 9418 1 1 5 . N N 5.552 1.146 5.859 1.00 . A A . 5 SET N 1 1
48 9419 1 1 5 . NT N 2.599 1.298 6.469 1.00 . A A . 5 SET NT 1 1
48 9420 1 1 5 . OG O 3.864 -0.963 4.548 1.00 . A A . 5 SET OG 1 1
48 9421 1 1 6 SER C C 3.224 -4.163 5.429 1.00 . A A . 6 SER C 1 1
48 9422 1 1 6 SER CA C 4.663 -3.617 5.183 1.00 . A A . 6 SER CA 1 1
48 9423 1 1 6 SER CB C 5.748 -4.651 5.557 1.00 . A A . 6 SER CB 1 1
48 9424 1 1 6 SER H H 5.408 -2.416 6.870 1.00 . A A . 6 SER H 1 1
48 9425 1 1 6 SER HA H 4.796 -3.378 4.107 1.00 . A A . 6 SER HA 1 1
48 9426 1 1 6 SER HB2 H 6.760 -4.217 5.435 1.00 . A A . 6 SER HB2 1 1
48 9427 1 1 6 SER HB3 H 5.673 -4.949 6.621 1.00 . A A . 6 SER HB3 1 1
48 9428 1 1 6 SER HG H 4.822 -6.230 4.946 1.00 . A A . 6 SER HG 1 1
48 9429 1 1 6 SER N N 4.914 -2.380 5.973 1.00 . A A . 6 SER N 1 1
48 9430 1 1 6 SER O O 2.715 -4.135 6.557 1.00 . A A . 6 SER O 1 1
48 9431 1 1 6 SER OG O 5.658 -5.809 4.733 1.00 . A A . 6 SER OG 1 1
48 9432 1 1 7 GLY C C 0.193 -4.150 3.928 1.00 . A A . 7 GLY C 1 1
48 9433 1 1 7 GLY CA C 1.193 -5.203 4.446 1.00 . A A . 7 GLY CA 1 1
48 9434 1 1 7 GLY H H 3.102 -4.637 3.481 1.00 . A A . 7 GLY H 1 1
48 9435 1 1 7 GLY HA2 H 1.120 -6.113 3.822 1.00 . A A . 7 GLY HA2 1 1
48 9436 1 1 7 GLY HA3 H 0.921 -5.532 5.469 1.00 . A A . 7 GLY HA3 1 1
48 9437 1 1 7 GLY N N 2.582 -4.680 4.365 1.00 . A A . 7 GLY N 1 1
48 9438 1 1 7 GLY O O -0.372 -4.309 2.844 1.00 . A A . 7 GLY O 1 1
48 9439 1 1 8 LYS C C 0.011 -0.953 3.564 1.00 . A A . 8 LYS C 1 1
48 9440 1 1 8 LYS CA C -0.891 -1.944 4.360 1.00 . A A . 8 LYS CA 1 1
48 9441 1 1 8 LYS CB C -1.472 -1.352 5.670 1.00 . A A . 8 LYS CB 1 1
48 9442 1 1 8 LYS CD C -2.974 0.443 6.771 1.00 . A A . 8 LYS CD 1 1
48 9443 1 1 8 LYS CE C -1.956 1.441 7.357 1.00 . A A . 8 LYS CE 1 1
48 9444 1 1 8 LYS CG C -2.510 -0.226 5.461 1.00 . A A . 8 LYS CG 1 1
48 9445 1 1 8 LYS H H 0.604 -3.020 5.534 1.00 . A A . 8 LYS H 1 1
48 9446 1 1 8 LYS HA H -1.740 -2.294 3.737 1.00 . A A . 8 LYS HA 1 1
48 9447 1 1 8 LYS HB2 H -1.952 -2.156 6.260 1.00 . A A . 8 LYS HB2 1 1
48 9448 1 1 8 LYS HB3 H -0.642 -0.985 6.307 1.00 . A A . 8 LYS HB3 1 1
48 9449 1 1 8 LYS HD2 H -3.924 0.971 6.564 1.00 . A A . 8 LYS HD2 1 1
48 9450 1 1 8 LYS HD3 H -3.228 -0.340 7.513 1.00 . A A . 8 LYS HD3 1 1
48 9451 1 1 8 LYS HE2 H -0.992 0.940 7.568 1.00 . A A . 8 LYS HE2 1 1
48 9452 1 1 8 LYS HE3 H -1.730 2.232 6.616 1.00 . A A . 8 LYS HE3 1 1
48 9453 1 1 8 LYS HG2 H -2.118 0.546 4.770 1.00 . A A . 8 LYS HG2 1 1
48 9454 1 1 8 LYS HG3 H -3.391 -0.651 4.944 1.00 . A A . 8 LYS HG3 1 1
48 9455 1 1 8 LYS HZ1 H -1.789 2.724 9.001 1.00 . A A . 8 LYS HZ1 1 1
48 9456 1 1 8 LYS HZ2 H -3.334 2.581 8.438 1.00 . A A . 8 LYS HZ2 1 1
48 9457 1 1 8 LYS HZ3 H -2.662 1.362 9.321 1.00 . A A . 8 LYS HZ3 1 1
48 9458 1 1 8 LYS N N -0.012 -3.080 4.722 1.00 . A A . 8 LYS N 1 1
48 9459 1 1 8 LYS NZ N -2.463 2.062 8.598 1.00 . A A . 8 LYS NZ 1 1
48 9460 1 1 8 LYS O O 0.673 -0.078 4.136 1.00 . A A . 8 LYS O 1 1
48 9461 1 1 9 LEU C C 0.169 1.043 0.871 1.00 . A A . 9 LEU C 1 1
48 9462 1 1 9 LEU CA C 0.854 -0.294 1.312 1.00 . A A . 9 LEU CA 1 1
48 9463 1 1 9 LEU CB C 1.341 -1.175 0.120 1.00 . A A . 9 LEU CB 1 1
48 9464 1 1 9 LEU CD1 C 2.576 -3.164 -0.870 1.00 . A A . 9 LEU CD1 1 1
48 9465 1 1 9 LEU CD2 C 3.644 -1.939 1.052 1.00 . A A . 9 LEU CD2 1 1
48 9466 1 1 9 LEU CG C 2.304 -2.365 0.419 1.00 . A A . 9 LEU CG 1 1
48 9467 1 1 9 LEU H H -0.533 -1.932 1.934 1.00 . A A . 9 LEU H 1 1
48 9468 1 1 9 LEU HA H 1.775 0.021 1.843 1.00 . A A . 9 LEU HA 1 1
48 9469 1 1 9 LEU HB2 H 0.452 -1.553 -0.420 1.00 . A A . 9 LEU HB2 1 1
48 9470 1 1 9 LEU HB3 H 1.842 -0.518 -0.616 1.00 . A A . 9 LEU HB3 1 1
48 9471 1 1 9 LEU HD11 H 3.216 -4.046 -0.679 1.00 . A A . 9 LEU HD11 1 1
48 9472 1 1 9 LEU HD12 H 1.640 -3.545 -1.319 1.00 . A A . 9 LEU HD12 1 1
48 9473 1 1 9 LEU HD13 H 3.083 -2.552 -1.640 1.00 . A A . 9 LEU HD13 1 1
48 9474 1 1 9 LEU HD21 H 3.497 -1.435 2.023 1.00 . A A . 9 LEU HD21 1 1
48 9475 1 1 9 LEU HD22 H 4.299 -2.807 1.250 1.00 . A A . 9 LEU HD22 1 1
48 9476 1 1 9 LEU HD23 H 4.209 -1.244 0.406 1.00 . A A . 9 LEU HD23 1 1
48 9477 1 1 9 LEU HG H 1.816 -3.061 1.126 1.00 . A A . 9 LEU HG 1 1
48 9478 1 1 9 LEU N N 0.022 -1.125 2.232 1.00 . A A . 9 LEU N 1 1
48 9479 1 1 9 LEU O O -0.050 1.313 -0.314 1.00 . A A . 9 LEU O 1 1
48 9480 1 1 10 ILE C C -0.384 4.087 2.942 1.00 . A A . 10 ILE C 1 1
48 9481 1 1 10 ILE CA C -0.763 3.229 1.687 1.00 . A A . 10 ILE CA 1 1
48 9482 1 1 10 ILE CB C -2.288 3.163 1.293 1.00 . A A . 10 ILE CB 1 1
48 9483 1 1 10 ILE CD1 C -2.210 5.366 -0.109 1.00 . A A . 10 ILE CD1 1 1
48 9484 1 1 10 ILE CG1 C -2.932 4.541 0.966 1.00 . A A . 10 ILE CG1 1 1
48 9485 1 1 10 ILE CG2 C -3.192 2.401 2.296 1.00 . A A . 10 ILE CG2 1 1
48 9486 1 1 10 ILE H H -0.036 1.477 2.802 1.00 . A A . 10 ILE H 1 1
48 9487 1 1 10 ILE HA H -0.250 3.699 0.831 1.00 . A A . 10 ILE HA 1 1
48 9488 1 1 10 ILE HB H -2.339 2.583 0.352 1.00 . A A . 10 ILE HB 1 1
48 9489 1 1 10 ILE HD11 H -2.786 6.269 -0.377 1.00 . A A . 10 ILE HD11 1 1
48 9490 1 1 10 ILE HD12 H -1.220 5.710 0.242 1.00 . A A . 10 ILE HD12 1 1
48 9491 1 1 10 ILE HD13 H -2.050 4.780 -1.034 1.00 . A A . 10 ILE HD13 1 1
48 9492 1 1 10 ILE HG12 H -3.974 4.386 0.629 1.00 . A A . 10 ILE HG12 1 1
48 9493 1 1 10 ILE HG13 H -3.019 5.153 1.885 1.00 . A A . 10 ILE HG13 1 1
48 9494 1 1 10 ILE HG21 H -4.228 2.304 1.922 1.00 . A A . 10 ILE HG21 1 1
48 9495 1 1 10 ILE HG22 H -2.827 1.372 2.474 1.00 . A A . 10 ILE HG22 1 1
48 9496 1 1 10 ILE HG23 H -3.246 2.902 3.280 1.00 . A A . 10 ILE HG23 1 1
48 9497 1 1 10 ILE N N -0.142 1.888 1.871 1.00 . A A . 10 ILE N 1 1
48 9498 1 1 10 ILE O O -1.249 4.468 3.738 1.00 . A A . 10 ILE O 1 1
48 9499 1 1 11 GLU C C 2.454 6.330 4.014 1.00 . A A . 11 GLU C 1 1
48 9500 1 1 11 GLU CA C 1.440 5.164 4.278 1.00 . A A . 11 GLU CA 1 1
48 9501 1 1 11 GLU CB C 2.067 4.170 5.301 1.00 . A A . 11 GLU CB 1 1
48 9502 1 1 11 GLU CD C 1.786 2.233 6.983 1.00 . A A . 11 GLU CD 1 1
48 9503 1 1 11 GLU CG C 1.092 3.171 5.981 1.00 . A A . 11 GLU CG 1 1
48 9504 1 1 11 GLU H H 1.517 3.734 2.585 1.00 . A A . 11 GLU H 1 1
48 9505 1 1 11 GLU HA H 0.594 5.644 4.802 1.00 . A A . 11 GLU HA 1 1
48 9506 1 1 11 GLU HB2 H 2.886 3.609 4.812 1.00 . A A . 11 GLU HB2 1 1
48 9507 1 1 11 GLU HB3 H 2.562 4.739 6.113 1.00 . A A . 11 GLU HB3 1 1
48 9508 1 1 11 GLU HG2 H 0.300 3.741 6.506 1.00 . A A . 11 GLU HG2 1 1
48 9509 1 1 11 GLU HG3 H 0.550 2.568 5.227 1.00 . A A . 11 GLU HG3 1 1
48 9510 1 1 11 GLU N N 0.925 4.393 3.104 1.00 . A A . 11 GLU N 1 1
48 9511 1 1 11 GLU O O 2.552 7.179 4.907 1.00 . A A . 11 GLU O 1 1
48 9512 1 1 11 GLU OE1 O 1.599 2.382 8.193 1.00 . A A . 11 GLU OE1 1 1
48 9513 1 1 12 THR C C 4.207 7.941 1.177 1.00 . A A . 12 THR C 1 1
48 9514 1 1 12 THR CA C 4.212 7.512 2.678 1.00 . A A . 12 THR CA 1 1
48 9515 1 1 12 THR CB C 5.613 7.139 3.277 1.00 . A A . 12 THR CB 1 1
48 9516 1 1 12 THR CG2 C 6.681 8.242 3.163 1.00 . A A . 12 THR CG2 1 1
48 9517 1 1 12 THR H H 2.917 5.864 2.091 1.00 . A A . 12 THR H 1 1
48 9518 1 1 12 THR HA H 3.876 8.413 3.231 1.00 . A A . 12 THR HA 1 1
48 9519 1 1 12 THR HB H 5.996 6.239 2.764 1.00 . A A . 12 THR HB 1 1
48 9520 1 1 12 THR HG1 H 4.810 6.168 4.731 1.00 . A A . 12 THR HG1 1 1
48 9521 1 1 12 THR HG21 H 6.902 8.497 2.111 1.00 . A A . 12 THR HG21 1 1
48 9522 1 1 12 THR HG22 H 6.365 9.172 3.671 1.00 . A A . 12 THR HG22 1 1
48 9523 1 1 12 THR HG23 H 7.635 7.923 3.622 1.00 . A A . 12 THR HG23 1 1
48 9524 1 1 12 THR N N 3.221 6.416 2.897 1.00 . A A . 12 THR N 1 1
48 9525 1 1 12 THR O O 3.517 8.911 0.846 1.00 . A A . 12 THR O 1 1
48 9526 1 1 12 THR OG1 O 5.504 6.829 4.662 1.00 . A A . 12 THR OG1 1 1
48 9527 1 1 13 THR C C 4.926 6.343 -2.066 1.00 . A A . 13 THR C 1 1
48 9528 1 1 13 THR CA C 5.036 7.614 -1.166 1.00 . A A . 13 THR CA 1 1
48 9529 1 1 13 THR CB C 6.373 8.394 -1.409 1.00 . A A . 13 THR CB 1 1
48 9530 1 1 13 THR CG2 C 6.545 8.978 -2.823 1.00 . A A . 13 THR CG2 1 1
48 9531 1 1 13 THR H H 5.514 6.492 0.677 1.00 . A A . 13 THR H 1 1
48 9532 1 1 13 THR HA H 4.201 8.297 -1.425 1.00 . A A . 13 THR HA 1 1
48 9533 1 1 13 THR HB H 7.227 7.718 -1.208 1.00 . A A . 13 THR HB 1 1
48 9534 1 1 13 THR HG1 H 7.299 9.949 -0.744 1.00 . A A . 13 THR HG1 1 1
48 9535 1 1 13 THR HG21 H 5.730 9.684 -3.075 1.00 . A A . 13 THR HG21 1 1
48 9536 1 1 13 THR HG22 H 7.498 9.530 -2.918 1.00 . A A . 13 THR HG22 1 1
48 9537 1 1 13 THR HG23 H 6.554 8.194 -3.600 1.00 . A A . 13 THR HG23 1 1
48 9538 1 1 13 THR N N 4.942 7.245 0.279 1.00 . A A . 13 THR N 1 1
48 9539 1 1 13 THR O O 5.448 5.271 -1.741 1.00 . A A . 13 THR O 1 1
48 9540 1 1 13 THR OG1 O 6.476 9.507 -0.523 1.00 . A A . 13 THR OG1 1 1
48 9541 1 1 14 ALA C C 5.331 5.130 -5.080 1.00 . A A . 14 ALA C 1 1
48 9542 1 1 14 ALA CA C 4.079 5.397 -4.214 1.00 . A A . 14 ALA CA 1 1
48 9543 1 1 14 ALA CB C 2.847 5.712 -5.082 1.00 . A A . 14 ALA CB 1 1
48 9544 1 1 14 ALA H H 3.861 7.427 -3.377 1.00 . A A . 14 ALA H 1 1
48 9545 1 1 14 ALA HXT H 5.154 6.979 -5.658 1.00 . A A . 14 ALA HXT 1 1
48 9546 1 1 14 ALA HA H 3.864 4.461 -3.668 1.00 . A A . 14 ALA HA 1 1
48 9547 1 1 14 ALA HB1 H 1.936 5.852 -4.471 1.00 . A A . 14 ALA HB1 1 1
48 9548 1 1 14 ALA HB2 H 2.976 6.629 -5.687 1.00 . A A . 14 ALA HB2 1 1
48 9549 1 1 14 ALA HB3 H 2.627 4.886 -5.785 1.00 . A A . 14 ALA HB3 1 1
48 9550 1 1 14 ALA N N 4.268 6.496 -3.233 1.00 . A A . 14 ALA N 1 1
48 9551 1 1 14 ALA O O 5.909 4.044 -5.099 1.00 . A A . 14 ALA O 1 1
48 9552 1 1 14 ALA OXT O 5.728 6.224 -5.810 1.00 . A A . 14 ALA OXT 1 1
49 9553 1 1 1 ACE C C 6.368 5.987 -3.968 1.00 . A A . 1 ACE C 1 1
49 9554 1 1 1 ACE CH3 C 5.601 6.951 -4.867 1.00 . A A . 1 ACE CH3 1 1
49 9555 1 1 1 ACE H1 H 4.555 7.076 -4.527 1.00 . A A . 1 ACE H1 1 1
49 9556 1 1 1 ACE H2 H 6.076 7.950 -4.890 1.00 . A A . 1 ACE H2 1 1
49 9557 1 1 1 ACE H3 H 5.564 6.580 -5.907 1.00 . A A . 1 ACE H3 1 1
49 9558 1 1 1 ACE O O 6.869 4.961 -4.435 1.00 . A A . 1 ACE O 1 1
49 9559 1 1 2 ILE C C 6.205 5.545 -0.412 1.00 . A A . 2 ILE C 1 1
49 9560 1 1 2 ILE CA C 7.159 5.551 -1.644 1.00 . A A . 2 ILE CA 1 1
49 9561 1 1 2 ILE CB C 8.651 5.972 -1.361 1.00 . A A . 2 ILE CB 1 1
49 9562 1 1 2 ILE CD1 C 9.009 7.523 0.729 1.00 . A A . 2 ILE CD1 1 1
49 9563 1 1 2 ILE CG1 C 8.986 7.396 -0.805 1.00 . A A . 2 ILE CG1 1 1
49 9564 1 1 2 ILE CG2 C 9.566 5.656 -2.570 1.00 . A A . 2 ILE CG2 1 1
49 9565 1 1 2 ILE H H 5.845 7.118 -2.408 1.00 . A A . 2 ILE H 1 1
49 9566 1 1 2 ILE HA H 7.221 4.501 -2.003 1.00 . A A . 2 ILE HA 1 1
49 9567 1 1 2 ILE HB H 8.979 5.272 -0.585 1.00 . A A . 2 ILE HB 1 1
49 9568 1 1 2 ILE HD11 H 8.033 7.320 1.196 1.00 . A A . 2 ILE HD11 1 1
49 9569 1 1 2 ILE HD12 H 9.737 6.827 1.184 1.00 . A A . 2 ILE HD12 1 1
49 9570 1 1 2 ILE HD13 H 9.302 8.542 1.039 1.00 . A A . 2 ILE HD13 1 1
49 9571 1 1 2 ILE HG12 H 10.002 7.707 -1.127 1.00 . A A . 2 ILE HG12 1 1
49 9572 1 1 2 ILE HG13 H 8.318 8.160 -1.238 1.00 . A A . 2 ILE HG13 1 1
49 9573 1 1 2 ILE HG21 H 9.428 4.619 -2.933 1.00 . A A . 2 ILE HG21 1 1
49 9574 1 1 2 ILE HG22 H 9.368 6.328 -3.424 1.00 . A A . 2 ILE HG22 1 1
49 9575 1 1 2 ILE HG23 H 10.638 5.757 -2.315 1.00 . A A . 2 ILE HG23 1 1
49 9576 1 1 2 ILE N N 6.464 6.356 -2.684 1.00 . A A . 2 ILE N 1 1
49 9577 1 1 2 ILE O O 5.970 6.586 0.208 1.00 . A A . 2 ILE O 1 1
49 9578 1 1 3 TRP C C 5.291 3.888 2.446 1.00 . A A . 3 TRP C 1 1
49 9579 1 1 3 TRP CA C 4.673 4.234 1.063 1.00 . A A . 3 TRP CA 1 1
49 9580 1 1 3 TRP CB C 3.484 3.293 0.712 1.00 . A A . 3 TRP CB 1 1
49 9581 1 1 3 TRP CD1 C 2.487 2.807 -1.664 1.00 . A A . 3 TRP CD1 1 1
49 9582 1 1 3 TRP CD2 C 1.973 4.811 -0.845 1.00 . A A . 3 TRP CD2 1 1
49 9583 1 1 3 TRP CE2 C 1.391 4.656 -2.130 1.00 . A A . 3 TRP CE2 1 1
49 9584 1 1 3 TRP CE3 C 1.826 6.029 -0.137 1.00 . A A . 3 TRP CE3 1 1
49 9585 1 1 3 TRP CG C 2.662 3.647 -0.542 1.00 . A A . 3 TRP CG 1 1
49 9586 1 1 3 TRP CH2 C 0.520 6.909 -1.992 1.00 . A A . 3 TRP CH2 1 1
49 9587 1 1 3 TRP CZ2 C 0.656 5.718 -2.709 1.00 . A A . 3 TRP CZ2 1 1
49 9588 1 1 3 TRP CZ3 C 1.097 7.062 -0.726 1.00 . A A . 3 TRP CZ3 1 1
49 9589 1 1 3 TRP H H 5.649 3.672 -0.836 1.00 . A A . 3 TRP H 1 1
49 9590 1 1 3 TRP HA H 4.235 5.220 1.244 1.00 . A A . 3 TRP HA 1 1
49 9591 1 1 3 TRP HB2 H 3.850 2.254 0.625 1.00 . A A . 3 TRP HB2 1 1
49 9592 1 1 3 TRP HB3 H 2.781 3.263 1.565 1.00 . A A . 3 TRP HB3 1 1
49 9593 1 1 3 TRP HD1 H 2.922 1.824 -1.764 1.00 . A A . 3 TRP HD1 1 1
49 9594 1 1 3 TRP HE1 H 1.425 3.032 -3.570 1.00 . A A . 3 TRP HE1 1 1
49 9595 1 1 3 TRP HE3 H 2.284 6.163 0.831 1.00 . A A . 3 TRP HE3 1 1
49 9596 1 1 3 TRP HH2 H -0.038 7.727 -2.425 1.00 . A A . 3 TRP HH2 1 1
49 9597 1 1 3 TRP HZ2 H 0.216 5.616 -3.690 1.00 . A A . 3 TRP HZ2 1 1
49 9598 1 1 3 TRP HZ3 H 0.976 7.996 -0.199 1.00 . A A . 3 TRP HZ3 1 1
49 9599 1 1 3 TRP N N 5.623 4.372 -0.085 1.00 . A A . 3 TRP N 1 1
49 9600 1 1 3 TRP NE1 N 1.694 3.412 -2.655 1.00 . A A . 3 TRP NE1 1 1
49 9601 1 1 3 TRP O O 4.831 4.419 3.458 1.00 . A A . 3 TRP O 1 1
49 9602 1 1 4 GLY C C 6.058 2.007 4.891 1.00 . A A . 4 GLY C 1 1
49 9603 1 1 4 GLY CA C 6.957 2.585 3.770 1.00 . A A . 4 GLY CA 1 1
49 9604 1 1 4 GLY H H 6.636 2.794 1.563 1.00 . A A . 4 GLY H 1 1
49 9605 1 1 4 GLY HA2 H 7.744 1.845 3.534 1.00 . A A . 4 GLY HA2 1 1
49 9606 1 1 4 GLY HA3 H 7.512 3.454 4.173 1.00 . A A . 4 GLY HA3 1 1
49 9607 1 1 4 GLY N N 6.284 2.991 2.503 1.00 . A A . 4 GLY N 1 1
49 9608 1 1 4 GLY O O 5.998 2.579 5.982 1.00 . A A . 4 GLY O 1 1
49 9609 1 1 5 . C C 2.998 0.837 5.485 1.00 . A A . 5 SET C 1 1
49 9610 1 1 5 . CA C 4.451 0.232 5.582 1.00 . A A . 5 SET CA 1 1
49 9611 1 1 5 . CB C 4.396 -1.292 5.258 1.00 . A A . 5 SET CB 1 1
49 9612 1 1 5 . H H 5.511 0.524 3.662 1.00 . A A . 5 SET H 1 1
49 9613 1 1 5 . HA H 4.908 0.284 6.605 1.00 . A A . 5 SET HA 1 1
49 9614 1 1 5 . HB2 H 2.608 0.640 4.468 1.00 . A A . 5 SET HB2 1 1
49 9615 1 1 5 . HB3 H 2.334 0.247 6.148 1.00 . A A . 5 SET HB3 1 1
49 9616 1 1 5 . HNT2 H 3.459 3.044 5.732 1.00 . A A . 5 SET HNT2 1 1
49 9617 1 1 5 . N N 5.370 0.889 4.610 1.00 . A A . 5 SET N 1 1
49 9618 1 1 5 . NT N 2.760 2.291 5.750 1.00 . A A . 5 SET NT 1 1
49 9619 1 1 5 . OG O 4.269 -1.705 4.100 1.00 . A A . 5 SET OG 1 1
49 9620 1 1 6 SER C C 2.999 -4.159 5.917 1.00 . A A . 6 SER C 1 1
49 9621 1 1 6 SER CA C 4.435 -3.611 6.174 1.00 . A A . 6 SER CA 1 1
49 9622 1 1 6 SER CB C 5.069 -4.221 7.446 1.00 . A A . 6 SER CB 1 1
49 9623 1 1 6 SER H H 4.466 -1.657 7.223 1.00 . A A . 6 SER H 1 1
49 9624 1 1 6 SER HA H 5.110 -3.889 5.338 1.00 . A A . 6 SER HA 1 1
49 9625 1 1 6 SER HB2 H 6.071 -3.786 7.630 1.00 . A A . 6 SER HB2 1 1
49 9626 1 1 6 SER HB3 H 4.468 -3.990 8.347 1.00 . A A . 6 SER HB3 1 1
49 9627 1 1 6 SER HG H 4.320 -5.990 7.274 1.00 . A A . 6 SER HG 1 1
49 9628 1 1 6 SER N N 4.454 -2.130 6.311 1.00 . A A . 6 SER N 1 1
49 9629 1 1 6 SER O O 2.119 -4.031 6.775 1.00 . A A . 6 SER O 1 1
49 9630 1 1 6 SER OG O 5.210 -5.632 7.320 1.00 . A A . 6 SER OG 1 1
49 9631 1 1 7 GLY C C 0.530 -4.318 3.655 1.00 . A A . 7 GLY C 1 1
49 9632 1 1 7 GLY CA C 1.457 -5.329 4.359 1.00 . A A . 7 GLY CA 1 1
49 9633 1 1 7 GLY H H 3.577 -4.782 4.089 1.00 . A A . 7 GLY H 1 1
49 9634 1 1 7 GLY HA2 H 1.628 -6.184 3.679 1.00 . A A . 7 GLY HA2 1 1
49 9635 1 1 7 GLY HA3 H 0.946 -5.775 5.236 1.00 . A A . 7 GLY HA3 1 1
49 9636 1 1 7 GLY N N 2.778 -4.765 4.734 1.00 . A A . 7 GLY N 1 1
49 9637 1 1 7 GLY O O 0.341 -4.385 2.437 1.00 . A A . 7 GLY O 1 1
49 9638 1 1 8 LYS C C -0.100 -1.110 3.502 1.00 . A A . 8 LYS C 1 1
49 9639 1 1 8 LYS CA C -0.955 -2.337 3.947 1.00 . A A . 8 LYS CA 1 1
49 9640 1 1 8 LYS CB C -1.944 -2.023 5.106 1.00 . A A . 8 LYS CB 1 1
49 9641 1 1 8 LYS CD C -3.586 -0.162 5.894 1.00 . A A . 8 LYS CD 1 1
49 9642 1 1 8 LYS CE C -2.593 0.956 6.283 1.00 . A A . 8 LYS CE 1 1
49 9643 1 1 8 LYS CG C -3.096 -1.056 4.736 1.00 . A A . 8 LYS CG 1 1
49 9644 1 1 8 LYS H H 0.304 -3.382 5.405 1.00 . A A . 8 LYS H 1 1
49 9645 1 1 8 LYS HA H -1.553 -2.719 3.094 1.00 . A A . 8 LYS HA 1 1
49 9646 1 1 8 LYS HB2 H -2.402 -2.957 5.486 1.00 . A A . 8 LYS HB2 1 1
49 9647 1 1 8 LYS HB3 H -1.370 -1.631 5.967 1.00 . A A . 8 LYS HB3 1 1
49 9648 1 1 8 LYS HD2 H -4.546 0.293 5.587 1.00 . A A . 8 LYS HD2 1 1
49 9649 1 1 8 LYS HD3 H -3.824 -0.792 6.772 1.00 . A A . 8 LYS HD3 1 1
49 9650 1 1 8 LYS HE2 H -1.640 0.525 6.647 1.00 . A A . 8 LYS HE2 1 1
49 9651 1 1 8 LYS HE3 H -2.319 1.561 5.397 1.00 . A A . 8 LYS HE3 1 1
49 9652 1 1 8 LYS HG2 H -2.809 -0.415 3.884 1.00 . A A . 8 LYS HG2 1 1
49 9653 1 1 8 LYS HG3 H -3.945 -1.651 4.351 1.00 . A A . 8 LYS HG3 1 1
49 9654 1 1 8 LYS HZ1 H -3.385 1.326 8.180 1.00 . A A . 8 LYS HZ1 1 1
49 9655 1 1 8 LYS HZ2 H -2.500 2.586 7.588 1.00 . A A . 8 LYS HZ2 1 1
49 9656 1 1 8 LYS HZ3 H -4.019 2.298 7.009 1.00 . A A . 8 LYS HZ3 1 1
49 9657 1 1 8 LYS N N -0.044 -3.395 4.444 1.00 . A A . 8 LYS N 1 1
49 9658 1 1 8 LYS NZ N -3.155 1.841 7.323 1.00 . A A . 8 LYS NZ 1 1
49 9659 1 1 8 LYS O O 0.175 -0.200 4.291 1.00 . A A . 8 LYS O 1 1
49 9660 1 1 9 LEU C C 0.326 1.239 1.213 1.00 . A A . 9 LEU C 1 1
49 9661 1 1 9 LEU CA C 1.140 -0.030 1.622 1.00 . A A . 9 LEU CA 1 1
49 9662 1 1 9 LEU CB C 1.936 -0.638 0.423 1.00 . A A . 9 LEU CB 1 1
49 9663 1 1 9 LEU CD1 C 3.536 -2.458 -0.376 1.00 . A A . 9 LEU CD1 1 1
49 9664 1 1 9 LEU CD2 C 4.396 -0.651 1.149 1.00 . A A . 9 LEU CD2 1 1
49 9665 1 1 9 LEU CG C 3.170 -1.512 0.782 1.00 . A A . 9 LEU CG 1 1
49 9666 1 1 9 LEU H H 0.132 -2.004 1.755 1.00 . A A . 9 LEU H 1 1
49 9667 1 1 9 LEU HA H 1.895 0.295 2.364 1.00 . A A . 9 LEU HA 1 1
49 9668 1 1 9 LEU HB2 H 1.232 -1.209 -0.215 1.00 . A A . 9 LEU HB2 1 1
49 9669 1 1 9 LEU HB3 H 2.283 0.172 -0.245 1.00 . A A . 9 LEU HB3 1 1
49 9670 1 1 9 LEU HD11 H 4.396 -3.105 -0.120 1.00 . A A . 9 LEU HD11 1 1
49 9671 1 1 9 LEU HD12 H 2.698 -3.135 -0.628 1.00 . A A . 9 LEU HD12 1 1
49 9672 1 1 9 LEU HD13 H 3.800 -1.908 -1.298 1.00 . A A . 9 LEU HD13 1 1
49 9673 1 1 9 LEU HD21 H 4.181 0.036 1.988 1.00 . A A . 9 LEU HD21 1 1
49 9674 1 1 9 LEU HD22 H 5.252 -1.275 1.467 1.00 . A A . 9 LEU HD22 1 1
49 9675 1 1 9 LEU HD23 H 4.740 -0.030 0.302 1.00 . A A . 9 LEU HD23 1 1
49 9676 1 1 9 LEU HG H 2.920 -2.148 1.654 1.00 . A A . 9 LEU HG 1 1
49 9677 1 1 9 LEU N N 0.297 -1.105 2.220 1.00 . A A . 9 LEU N 1 1
49 9678 1 1 9 LEU O O -0.043 1.412 0.047 1.00 . A A . 9 LEU O 1 1
49 9679 1 1 10 ILE C C -0.393 4.369 3.173 1.00 . A A . 10 ILE C 1 1
49 9680 1 1 10 ILE CA C -0.679 3.404 1.973 1.00 . A A . 10 ILE CA 1 1
49 9681 1 1 10 ILE CB C -2.197 3.206 1.583 1.00 . A A . 10 ILE CB 1 1
49 9682 1 1 10 ILE CD1 C -2.345 5.106 -0.178 1.00 . A A . 10 ILE CD1 1 1
49 9683 1 1 10 ILE CG1 C -2.916 4.499 1.111 1.00 . A A . 10 ILE CG1 1 1
49 9684 1 1 10 ILE CG2 C -3.062 2.494 2.649 1.00 . A A . 10 ILE CG2 1 1
49 9685 1 1 10 ILE H H 0.364 1.851 3.127 1.00 . A A . 10 ILE H 1 1
49 9686 1 1 10 ILE HA H -0.205 3.874 1.089 1.00 . A A . 10 ILE HA 1 1
49 9687 1 1 10 ILE HB H -2.217 2.526 0.709 1.00 . A A . 10 ILE HB 1 1
49 9688 1 1 10 ILE HD11 H -2.311 4.365 -0.997 1.00 . A A . 10 ILE HD11 1 1
49 9689 1 1 10 ILE HD12 H -2.956 5.958 -0.522 1.00 . A A . 10 ILE HD12 1 1
49 9690 1 1 10 ILE HD13 H -1.317 5.482 -0.029 1.00 . A A . 10 ILE HD13 1 1
49 9691 1 1 10 ILE HG12 H -3.986 4.285 0.927 1.00 . A A . 10 ILE HG12 1 1
49 9692 1 1 10 ILE HG13 H -2.909 5.261 1.913 1.00 . A A . 10 ILE HG13 1 1
49 9693 1 1 10 ILE HG21 H -4.058 2.222 2.254 1.00 . A A . 10 ILE HG21 1 1
49 9694 1 1 10 ILE HG22 H -2.586 1.556 2.979 1.00 . A A . 10 ILE HG22 1 1
49 9695 1 1 10 ILE HG23 H -3.228 3.114 3.548 1.00 . A A . 10 ILE HG23 1 1
49 9696 1 1 10 ILE N N 0.060 2.128 2.191 1.00 . A A . 10 ILE N 1 1
49 9697 1 1 10 ILE O O -1.232 4.550 4.061 1.00 . A A . 10 ILE O 1 1
49 9698 1 1 11 GLU C C 1.995 7.087 3.511 1.00 . A A . 11 GLU C 1 1
49 9699 1 1 11 GLU CA C 1.216 5.948 4.259 1.00 . A A . 11 GLU CA 1 1
49 9700 1 1 11 GLU CB C 2.091 5.320 5.382 1.00 . A A . 11 GLU CB 1 1
49 9701 1 1 11 GLU CD C 1.530 2.789 5.975 1.00 . A A . 11 GLU CD 1 1
49 9702 1 1 11 GLU CG C 1.432 4.287 6.334 1.00 . A A . 11 GLU CG 1 1
49 9703 1 1 11 GLU H H 1.465 4.689 2.469 1.00 . A A . 11 GLU H 1 1
49 9704 1 1 11 GLU HA H 0.326 6.331 4.799 1.00 . A A . 11 GLU HA 1 1
49 9705 1 1 11 GLU HB2 H 3.020 4.904 4.961 1.00 . A A . 11 GLU HB2 1 1
49 9706 1 1 11 GLU HB3 H 2.444 6.152 6.021 1.00 . A A . 11 GLU HB3 1 1
49 9707 1 1 11 GLU HG2 H 1.882 4.404 7.338 1.00 . A A . 11 GLU HG2 1 1
49 9708 1 1 11 GLU HG3 H 0.370 4.556 6.492 1.00 . A A . 11 GLU HG3 1 1
49 9709 1 1 11 GLU N N 0.811 4.980 3.203 1.00 . A A . 11 GLU N 1 1
49 9710 1 1 11 GLU O O 3.190 6.908 3.237 1.00 . A A . 11 GLU O 1 1
49 9711 1 1 11 GLU OE1 O 0.513 2.094 6.016 1.00 . A A . 11 GLU OE1 1 1
49 9712 1 1 12 THR C C 3.375 9.920 3.141 1.00 . A A . 12 THR C 1 1
49 9713 1 1 12 THR CA C 2.086 9.366 2.439 1.00 . A A . 12 THR CA 1 1
49 9714 1 1 12 THR CB C 1.101 10.515 2.034 1.00 . A A . 12 THR CB 1 1
49 9715 1 1 12 THR CG2 C 1.688 11.615 1.111 1.00 . A A . 12 THR CG2 1 1
49 9716 1 1 12 THR H H 0.348 8.251 3.218 1.00 . A A . 12 THR H 1 1
49 9717 1 1 12 THR HA H 2.438 8.928 1.484 1.00 . A A . 12 THR HA 1 1
49 9718 1 1 12 THR HB H 0.733 11.007 2.955 1.00 . A A . 12 THR HB 1 1
49 9719 1 1 12 THR HG1 H -0.561 10.730 1.084 1.00 . A A . 12 THR HG1 1 1
49 9720 1 1 12 THR HG21 H 2.523 12.167 1.583 1.00 . A A . 12 THR HG21 1 1
49 9721 1 1 12 THR HG22 H 2.077 11.207 0.158 1.00 . A A . 12 THR HG22 1 1
49 9722 1 1 12 THR HG23 H 0.935 12.381 0.841 1.00 . A A . 12 THR HG23 1 1
49 9723 1 1 12 THR N N 1.374 8.246 3.162 1.00 . A A . 12 THR N 1 1
49 9724 1 1 12 THR O O 4.361 10.187 2.448 1.00 . A A . 12 THR O 1 1
49 9725 1 1 12 THR OG1 O -0.024 9.977 1.344 1.00 . A A . 12 THR OG1 1 1
49 9726 1 1 13 THR C C 5.757 9.575 5.271 1.00 . A A . 13 THR C 1 1
49 9727 1 1 13 THR CA C 4.567 10.593 5.238 1.00 . A A . 13 THR CA 1 1
49 9728 1 1 13 THR CB C 4.215 11.105 6.670 1.00 . A A . 13 THR CB 1 1
49 9729 1 1 13 THR CG2 C 3.469 12.452 6.719 1.00 . A A . 13 THR CG2 1 1
49 9730 1 1 13 THR H H 2.563 9.665 4.942 1.00 . A A . 13 THR H 1 1
49 9731 1 1 13 THR HA H 4.954 11.475 4.690 1.00 . A A . 13 THR HA 1 1
49 9732 1 1 13 THR HB H 5.161 11.269 7.221 1.00 . A A . 13 THR HB 1 1
49 9733 1 1 13 THR HG1 H 3.279 10.530 8.252 1.00 . A A . 13 THR HG1 1 1
49 9734 1 1 13 THR HG21 H 2.482 12.405 6.224 1.00 . A A . 13 THR HG21 1 1
49 9735 1 1 13 THR HG22 H 3.297 12.783 7.760 1.00 . A A . 13 THR HG22 1 1
49 9736 1 1 13 THR HG23 H 4.047 13.258 6.228 1.00 . A A . 13 THR HG23 1 1
49 9737 1 1 13 THR N N 3.373 10.095 4.479 1.00 . A A . 13 THR N 1 1
49 9738 1 1 13 THR O O 6.895 9.983 5.021 1.00 . A A . 13 THR O 1 1
49 9739 1 1 13 THR OG1 O 3.461 10.137 7.395 1.00 . A A . 13 THR OG1 1 1
49 9740 1 1 14 ALA C C 7.129 6.807 4.224 1.00 . A A . 14 ALA C 1 1
49 9741 1 1 14 ALA CA C 6.574 7.240 5.610 1.00 . A A . 14 ALA CA 1 1
49 9742 1 1 14 ALA CB C 6.024 6.023 6.374 1.00 . A A . 14 ALA CB 1 1
49 9743 1 1 14 ALA H H 4.531 8.068 5.782 1.00 . A A . 14 ALA H 1 1
49 9744 1 1 14 ALA HXT H 5.371 7.256 3.510 1.00 . A A . 14 ALA HXT 1 1
49 9745 1 1 14 ALA HA H 7.428 7.632 6.195 1.00 . A A . 14 ALA HA 1 1
49 9746 1 1 14 ALA HB1 H 5.690 6.291 7.394 1.00 . A A . 14 ALA HB1 1 1
49 9747 1 1 14 ALA HB2 H 5.166 5.554 5.859 1.00 . A A . 14 ALA HB2 1 1
49 9748 1 1 14 ALA HB3 H 6.794 5.238 6.494 1.00 . A A . 14 ALA HB3 1 1
49 9749 1 1 14 ALA N N 5.512 8.279 5.570 1.00 . A A . 14 ALA N 1 1
49 9750 1 1 14 ALA O O 8.276 6.390 4.072 1.00 . A A . 14 ALA O 1 1
49 9751 1 1 14 ALA OXT O 6.219 6.928 3.200 1.00 . A A . 14 ALA OXT 1 1
50 9752 1 1 1 ACE C C 3.945 2.299 -4.836 1.00 . A A . 1 ACE C 1 1
50 9753 1 1 1 ACE CH3 C 3.674 3.208 -6.031 1.00 . A A . 1 ACE CH3 1 1
50 9754 1 1 1 ACE H1 H 4.552 3.270 -6.701 1.00 . A A . 1 ACE H1 1 1
50 9755 1 1 1 ACE H2 H 2.828 2.831 -6.634 1.00 . A A . 1 ACE H2 1 1
50 9756 1 1 1 ACE H3 H 3.416 4.234 -5.709 1.00 . A A . 1 ACE H3 1 1
50 9757 1 1 1 ACE O O 3.261 1.289 -4.651 1.00 . A A . 1 ACE O 1 1
50 9758 1 1 2 ILE C C 5.615 3.012 -1.737 1.00 . A A . 2 ILE C 1 1
50 9759 1 1 2 ILE CA C 5.380 1.928 -2.834 1.00 . A A . 2 ILE CA 1 1
50 9760 1 1 2 ILE CB C 6.551 0.896 -3.052 1.00 . A A . 2 ILE CB 1 1
50 9761 1 1 2 ILE CD1 C 8.947 1.730 -2.388 1.00 . A A . 2 ILE CD1 1 1
50 9762 1 1 2 ILE CG1 C 7.962 1.382 -3.518 1.00 . A A . 2 ILE CG1 1 1
50 9763 1 1 2 ILE CG2 C 6.096 -0.302 -3.923 1.00 . A A . 2 ILE CG2 1 1
50 9764 1 1 2 ILE H H 5.308 3.619 -4.207 1.00 . A A . 2 ILE H 1 1
50 9765 1 1 2 ILE HA H 4.523 1.310 -2.493 1.00 . A A . 2 ILE HA 1 1
50 9766 1 1 2 ILE HB H 6.706 0.460 -2.060 1.00 . A A . 2 ILE HB 1 1
50 9767 1 1 2 ILE HD11 H 9.121 0.863 -1.723 1.00 . A A . 2 ILE HD11 1 1
50 9768 1 1 2 ILE HD12 H 9.929 2.027 -2.797 1.00 . A A . 2 ILE HD12 1 1
50 9769 1 1 2 ILE HD13 H 8.603 2.560 -1.750 1.00 . A A . 2 ILE HD13 1 1
50 9770 1 1 2 ILE HG12 H 8.474 0.588 -4.102 1.00 . A A . 2 ILE HG12 1 1
50 9771 1 1 2 ILE HG13 H 7.880 2.227 -4.222 1.00 . A A . 2 ILE HG13 1 1
50 9772 1 1 2 ILE HG21 H 5.143 -0.736 -3.564 1.00 . A A . 2 ILE HG21 1 1
50 9773 1 1 2 ILE HG22 H 5.944 -0.011 -4.979 1.00 . A A . 2 ILE HG22 1 1
50 9774 1 1 2 ILE HG23 H 6.837 -1.124 -3.914 1.00 . A A . 2 ILE HG23 1 1
50 9775 1 1 2 ILE N N 4.965 2.672 -4.052 1.00 . A A . 2 ILE N 1 1
50 9776 1 1 2 ILE O O 6.559 3.804 -1.822 1.00 . A A . 2 ILE O 1 1
50 9777 1 1 3 TRP C C 5.733 3.714 1.619 1.00 . A A . 3 TRP C 1 1
50 9778 1 1 3 TRP CA C 4.836 4.070 0.392 1.00 . A A . 3 TRP CA 1 1
50 9779 1 1 3 TRP CB C 3.410 4.468 0.866 1.00 . A A . 3 TRP CB 1 1
50 9780 1 1 3 TRP CD1 C 1.405 4.850 -0.786 1.00 . A A . 3 TRP CD1 1 1
50 9781 1 1 3 TRP CD2 C 2.823 6.554 -0.618 1.00 . A A . 3 TRP CD2 1 1
50 9782 1 1 3 TRP CE2 C 1.803 6.876 -1.546 1.00 . A A . 3 TRP CE2 1 1
50 9783 1 1 3 TRP CE3 C 3.873 7.472 -0.355 1.00 . A A . 3 TRP CE3 1 1
50 9784 1 1 3 TRP CG C 2.580 5.280 -0.139 1.00 . A A . 3 TRP CG 1 1
50 9785 1 1 3 TRP CH2 C 2.874 9.006 -1.960 1.00 . A A . 3 TRP CH2 1 1
50 9786 1 1 3 TRP CZ2 C 1.831 8.117 -2.229 1.00 . A A . 3 TRP CZ2 1 1
50 9787 1 1 3 TRP CZ3 C 3.877 8.690 -1.035 1.00 . A A . 3 TRP CZ3 1 1
50 9788 1 1 3 TRP H H 3.876 2.522 -0.862 1.00 . A A . 3 TRP H 1 1
50 9789 1 1 3 TRP HA H 5.315 4.977 -0.012 1.00 . A A . 3 TRP HA 1 1
50 9790 1 1 3 TRP HB2 H 2.852 3.569 1.192 1.00 . A A . 3 TRP HB2 1 1
50 9791 1 1 3 TRP HB3 H 3.485 5.089 1.778 1.00 . A A . 3 TRP HB3 1 1
50 9792 1 1 3 TRP HD1 H 0.954 3.880 -0.644 1.00 . A A . 3 TRP HD1 1 1
50 9793 1 1 3 TRP HE1 H 0.082 5.769 -2.276 1.00 . A A . 3 TRP HE1 1 1
50 9794 1 1 3 TRP HE3 H 4.655 7.229 0.351 1.00 . A A . 3 TRP HE3 1 1
50 9795 1 1 3 TRP HH2 H 2.905 9.957 -2.472 1.00 . A A . 3 TRP HH2 1 1
50 9796 1 1 3 TRP HZ2 H 1.064 8.372 -2.946 1.00 . A A . 3 TRP HZ2 1 1
50 9797 1 1 3 TRP HZ3 H 4.669 9.400 -0.845 1.00 . A A . 3 TRP HZ3 1 1
50 9798 1 1 3 TRP N N 4.730 3.073 -0.722 1.00 . A A . 3 TRP N 1 1
50 9799 1 1 3 TRP NE1 N 0.900 5.831 -1.660 1.00 . A A . 3 TRP NE1 1 1
50 9800 1 1 3 TRP O O 6.064 4.612 2.401 1.00 . A A . 3 TRP O 1 1
50 9801 1 1 4 GLY C C 6.185 1.707 4.226 1.00 . A A . 4 GLY C 1 1
50 9802 1 1 4 GLY CA C 6.963 1.991 2.926 1.00 . A A . 4 GLY CA 1 1
50 9803 1 1 4 GLY H H 5.825 1.854 1.010 1.00 . A A . 4 GLY H 1 1
50 9804 1 1 4 GLY HA2 H 7.509 1.080 2.617 1.00 . A A . 4 GLY HA2 1 1
50 9805 1 1 4 GLY HA3 H 7.761 2.732 3.129 1.00 . A A . 4 GLY HA3 1 1
50 9806 1 1 4 GLY N N 6.113 2.443 1.796 1.00 . A A . 4 GLY N 1 1
50 9807 1 1 4 GLY O O 6.321 2.447 5.205 1.00 . A A . 4 GLY O 1 1
50 9808 1 1 5 . C C 3.167 0.963 5.431 1.00 . A A . 5 SET C 1 1
50 9809 1 1 5 . CA C 4.555 0.213 5.385 1.00 . A A . 5 SET CA 1 1
50 9810 1 1 5 . CB C 4.334 -1.326 5.261 1.00 . A A . 5 SET CB 1 1
50 9811 1 1 5 . H H 5.367 0.115 3.334 1.00 . A A . 5 SET H 1 1
50 9812 1 1 5 . HA H 5.172 0.323 6.315 1.00 . A A . 5 SET HA 1 1
50 9813 1 1 5 . HB2 H 2.563 0.641 4.564 1.00 . A A . 5 SET HB2 1 1
50 9814 1 1 5 . HB3 H 2.600 0.578 6.300 1.00 . A A . 5 SET HB3 1 1
50 9815 1 1 5 . HNT2 H 3.892 3.113 5.352 1.00 . A A . 5 SET HNT2 1 1
50 9816 1 1 5 . N N 5.379 0.634 4.218 1.00 . A A . 5 SET N 1 1
50 9817 1 1 5 . NT N 3.104 2.461 5.464 1.00 . A A . 5 SET NT 1 1
50 9818 1 1 5 . OG O 4.042 -1.853 4.183 1.00 . A A . 5 SET OG 1 1
50 9819 1 1 6 SER C C 2.884 -4.061 6.093 1.00 . A A . 6 SER C 1 1
50 9820 1 1 6 SER CA C 4.306 -3.526 6.447 1.00 . A A . 6 SER CA 1 1
50 9821 1 1 6 SER CB C 4.761 -3.993 7.850 1.00 . A A . 6 SER CB 1 1
50 9822 1 1 6 SER H H 4.650 -1.484 7.234 1.00 . A A . 6 SER H 1 1
50 9823 1 1 6 SER HA H 5.053 -3.942 5.740 1.00 . A A . 6 SER HA 1 1
50 9824 1 1 6 SER HB2 H 5.763 -3.590 8.093 1.00 . A A . 6 SER HB2 1 1
50 9825 1 1 6 SER HB3 H 4.082 -3.616 8.639 1.00 . A A . 6 SER HB3 1 1
50 9826 1 1 6 SER HG H 3.923 -5.732 7.818 1.00 . A A . 6 SER HG 1 1
50 9827 1 1 6 SER N N 4.444 -2.044 6.398 1.00 . A A . 6 SER N 1 1
50 9828 1 1 6 SER O O 1.922 -3.827 6.833 1.00 . A A . 6 SER O 1 1
50 9829 1 1 6 SER OG O 4.824 -5.415 7.921 1.00 . A A . 6 SER OG 1 1
50 9830 1 1 7 GLY C C 0.635 -4.433 3.613 1.00 . A A . 7 GLY C 1 1
50 9831 1 1 7 GLY CA C 1.489 -5.362 4.497 1.00 . A A . 7 GLY CA 1 1
50 9832 1 1 7 GLY H H 3.624 -4.843 4.391 1.00 . A A . 7 GLY H 1 1
50 9833 1 1 7 GLY HA2 H 1.721 -6.274 3.916 1.00 . A A . 7 GLY HA2 1 1
50 9834 1 1 7 GLY HA3 H 0.892 -5.735 5.353 1.00 . A A . 7 GLY HA3 1 1
50 9835 1 1 7 GLY N N 2.772 -4.779 4.957 1.00 . A A . 7 GLY N 1 1
50 9836 1 1 7 GLY O O 0.574 -4.604 2.394 1.00 . A A . 7 GLY O 1 1
50 9837 1 1 8 LYS C C -0.106 -1.170 3.354 1.00 . A A . 8 LYS C 1 1
50 9838 1 1 8 LYS CA C -0.911 -2.479 3.601 1.00 . A A . 8 LYS CA 1 1
50 9839 1 1 8 LYS CB C -2.131 -2.323 4.548 1.00 . A A . 8 LYS CB 1 1
50 9840 1 1 8 LYS CD C -4.511 -1.396 4.938 1.00 . A A . 8 LYS CD 1 1
50 9841 1 1 8 LYS CE C -4.323 -0.686 6.299 1.00 . A A . 8 LYS CE 1 1
50 9842 1 1 8 LYS CG C -3.292 -1.474 3.993 1.00 . A A . 8 LYS CG 1 1
50 9843 1 1 8 LYS H H 0.200 -3.371 5.251 1.00 . A A . 8 LYS H 1 1
50 9844 1 1 8 LYS HA H -1.292 -2.884 2.640 1.00 . A A . 8 LYS HA 1 1
50 9845 1 1 8 LYS HB2 H -2.541 -3.324 4.793 1.00 . A A . 8 LYS HB2 1 1
50 9846 1 1 8 LYS HB3 H -1.796 -1.903 5.517 1.00 . A A . 8 LYS HB3 1 1
50 9847 1 1 8 LYS HD2 H -5.345 -0.920 4.390 1.00 . A A . 8 LYS HD2 1 1
50 9848 1 1 8 LYS HD3 H -4.857 -2.429 5.133 1.00 . A A . 8 LYS HD3 1 1
50 9849 1 1 8 LYS HE2 H -5.245 -0.810 6.900 1.00 . A A . 8 LYS HE2 1 1
50 9850 1 1 8 LYS HE3 H -3.528 -1.181 6.888 1.00 . A A . 8 LYS HE3 1 1
50 9851 1 1 8 LYS HG2 H -2.936 -0.459 3.746 1.00 . A A . 8 LYS HG2 1 1
50 9852 1 1 8 LYS HG3 H -3.622 -1.904 3.028 1.00 . A A . 8 LYS HG3 1 1
50 9853 1 1 8 LYS HZ1 H -3.932 1.217 7.084 1.00 . A A . 8 LYS HZ1 1 1
50 9854 1 1 8 LYS HZ2 H -3.149 0.921 5.662 1.00 . A A . 8 LYS HZ2 1 1
50 9855 1 1 8 LYS HZ3 H -4.763 1.256 5.659 1.00 . A A . 8 LYS HZ3 1 1
50 9856 1 1 8 LYS N N -0.028 -3.465 4.261 1.00 . A A . 8 LYS N 1 1
50 9857 1 1 8 LYS NZ N -4.027 0.757 6.170 1.00 . A A . 8 LYS NZ 1 1
50 9858 1 1 8 LYS O O 0.010 -0.310 4.233 1.00 . A A . 8 LYS O 1 1
50 9859 1 1 9 LEU C C 0.344 1.343 1.322 1.00 . A A . 9 LEU C 1 1
50 9860 1 1 9 LEU CA C 1.249 0.131 1.708 1.00 . A A . 9 LEU CA 1 1
50 9861 1 1 9 LEU CB C 2.238 -0.239 0.558 1.00 . A A . 9 LEU CB 1 1
50 9862 1 1 9 LEU CD1 C 3.216 -2.567 1.155 1.00 . A A . 9 LEU CD1 1 1
50 9863 1 1 9 LEU CD2 C 4.588 -0.928 -0.160 1.00 . A A . 9 LEU CD2 1 1
50 9864 1 1 9 LEU CG C 3.503 -1.069 0.925 1.00 . A A . 9 LEU CG 1 1
50 9865 1 1 9 LEU H H 0.415 -1.925 1.605 1.00 . A A . 9 LEU H 1 1
50 9866 1 1 9 LEU HA H 1.891 0.447 2.551 1.00 . A A . 9 LEU HA 1 1
50 9867 1 1 9 LEU HB2 H 1.694 -0.719 -0.279 1.00 . A A . 9 LEU HB2 1 1
50 9868 1 1 9 LEU HB3 H 2.598 0.717 0.127 1.00 . A A . 9 LEU HB3 1 1
50 9869 1 1 9 LEU HD11 H 4.141 -3.135 1.369 1.00 . A A . 9 LEU HD11 1 1
50 9870 1 1 9 LEU HD12 H 2.557 -2.729 2.025 1.00 . A A . 9 LEU HD12 1 1
50 9871 1 1 9 LEU HD13 H 2.733 -3.041 0.281 1.00 . A A . 9 LEU HD13 1 1
50 9872 1 1 9 LEU HD21 H 4.894 0.125 -0.290 1.00 . A A . 9 LEU HD21 1 1
50 9873 1 1 9 LEU HD22 H 5.505 -1.489 0.098 1.00 . A A . 9 LEU HD22 1 1
50 9874 1 1 9 LEU HD23 H 4.244 -1.295 -1.145 1.00 . A A . 9 LEU HD23 1 1
50 9875 1 1 9 LEU HG H 3.930 -0.655 1.857 1.00 . A A . 9 LEU HG 1 1
50 9876 1 1 9 LEU N N 0.436 -1.045 2.129 1.00 . A A . 9 LEU N 1 1
50 9877 1 1 9 LEU O O -0.042 1.506 0.160 1.00 . A A . 9 LEU O 1 1
50 9878 1 1 10 ILE C C -0.438 4.464 3.198 1.00 . A A . 10 ILE C 1 1
50 9879 1 1 10 ILE CA C -0.830 3.400 2.123 1.00 . A A . 10 ILE CA 1 1
50 9880 1 1 10 ILE CB C -2.362 3.063 1.974 1.00 . A A . 10 ILE CB 1 1
50 9881 1 1 10 ILE CD1 C -2.862 4.721 0.029 1.00 . A A . 10 ILE CD1 1 1
50 9882 1 1 10 ILE CG1 C -3.224 4.244 1.445 1.00 . A A . 10 ILE CG1 1 1
50 9883 1 1 10 ILE CG2 C -3.023 2.470 3.242 1.00 . A A . 10 ILE CG2 1 1
50 9884 1 1 10 ILE H H 0.327 1.905 3.251 1.00 . A A . 10 ILE H 1 1
50 9885 1 1 10 ILE HA H -0.527 3.835 1.153 1.00 . A A . 10 ILE HA 1 1
50 9886 1 1 10 ILE HB H -2.439 2.268 1.208 1.00 . A A . 10 ILE HB 1 1
50 9887 1 1 10 ILE HD11 H -3.588 5.471 -0.333 1.00 . A A . 10 ILE HD11 1 1
50 9888 1 1 10 ILE HD12 H -1.864 5.193 -0.006 1.00 . A A . 10 ILE HD12 1 1
50 9889 1 1 10 ILE HD13 H -2.862 3.884 -0.694 1.00 . A A . 10 ILE HD13 1 1
50 9890 1 1 10 ILE HG12 H -4.289 3.944 1.430 1.00 . A A . 10 ILE HG12 1 1
50 9891 1 1 10 ILE HG13 H -3.175 5.100 2.144 1.00 . A A . 10 ILE HG13 1 1
50 9892 1 1 10 ILE HG21 H -4.001 2.009 3.013 1.00 . A A . 10 ILE HG21 1 1
50 9893 1 1 10 ILE HG22 H -2.391 1.687 3.696 1.00 . A A . 10 ILE HG22 1 1
50 9894 1 1 10 ILE HG23 H -3.199 3.233 4.023 1.00 . A A . 10 ILE HG23 1 1
50 9895 1 1 10 ILE N N 0.009 2.185 2.319 1.00 . A A . 10 ILE N 1 1
50 9896 1 1 10 ILE O O -1.169 4.715 4.160 1.00 . A A . 10 ILE O 1 1
50 9897 1 1 11 GLU C C 1.666 7.365 3.051 1.00 . A A . 11 GLU C 1 1
50 9898 1 1 11 GLU CA C 1.271 6.130 3.932 1.00 . A A . 11 GLU CA 1 1
50 9899 1 1 11 GLU CB C 2.444 5.563 4.788 1.00 . A A . 11 GLU CB 1 1
50 9900 1 1 11 GLU CD C 1.957 3.116 5.714 1.00 . A A . 11 GLU CD 1 1
50 9901 1 1 11 GLU CG C 2.055 4.637 5.971 1.00 . A A . 11 GLU CG 1 1
50 9902 1 1 11 GLU H H 1.277 4.762 2.205 1.00 . A A . 11 GLU H 1 1
50 9903 1 1 11 GLU HA H 0.513 6.451 4.677 1.00 . A A . 11 GLU HA 1 1
50 9904 1 1 11 GLU HB2 H 3.216 5.088 4.152 1.00 . A A . 11 GLU HB2 1 1
50 9905 1 1 11 GLU HB3 H 2.969 6.428 5.238 1.00 . A A . 11 GLU HB3 1 1
50 9906 1 1 11 GLU HG2 H 2.778 4.795 6.794 1.00 . A A . 11 GLU HG2 1 1
50 9907 1 1 11 GLU HG3 H 1.100 4.989 6.414 1.00 . A A . 11 GLU HG3 1 1
50 9908 1 1 11 GLU N N 0.743 5.083 3.018 1.00 . A A . 11 GLU N 1 1
50 9909 1 1 11 GLU O O 2.858 7.627 2.854 1.00 . A A . 11 GLU O 1 1
50 9910 1 1 11 GLU OE1 O 0.872 2.544 5.858 1.00 . A A . 11 GLU OE1 1 1
50 9911 1 1 12 THR C C 1.605 10.500 2.493 1.00 . A A . 12 THR C 1 1
50 9912 1 1 12 THR CA C 0.958 9.342 1.666 1.00 . A A . 12 THR CA 1 1
50 9913 1 1 12 THR CB C -0.283 9.780 0.818 1.00 . A A . 12 THR CB 1 1
50 9914 1 1 12 THR CG2 C -0.025 10.933 -0.181 1.00 . A A . 12 THR CG2 1 1
50 9915 1 1 12 THR H H -0.260 7.717 2.563 1.00 . A A . 12 THR H 1 1
50 9916 1 1 12 THR HA H 1.720 9.035 0.924 1.00 . A A . 12 THR HA 1 1
50 9917 1 1 12 THR HB H -1.095 10.109 1.495 1.00 . A A . 12 THR HB 1 1
50 9918 1 1 12 THR HG1 H -0.051 8.435 -0.542 1.00 . A A . 12 THR HG1 1 1
50 9919 1 1 12 THR HG21 H 0.271 11.871 0.324 1.00 . A A . 12 THR HG21 1 1
50 9920 1 1 12 THR HG22 H 0.772 10.697 -0.909 1.00 . A A . 12 THR HG22 1 1
50 9921 1 1 12 THR HG23 H -0.930 11.174 -0.772 1.00 . A A . 12 THR HG23 1 1
50 9922 1 1 12 THR N N 0.679 8.133 2.518 1.00 . A A . 12 THR N 1 1
50 9923 1 1 12 THR O O 2.749 10.865 2.213 1.00 . A A . 12 THR O 1 1
50 9924 1 1 12 THR OG1 O -0.762 8.675 0.056 1.00 . A A . 12 THR OG1 1 1
50 9925 1 1 13 THR C C 1.920 11.522 5.683 1.00 . A A . 13 THR C 1 1
50 9926 1 1 13 THR CA C 1.410 12.157 4.353 1.00 . A A . 13 THR CA 1 1
50 9927 1 1 13 THR CB C 0.356 13.288 4.565 1.00 . A A . 13 THR CB 1 1
50 9928 1 1 13 THR CG2 C 0.070 14.134 3.312 1.00 . A A . 13 THR CG2 1 1
50 9929 1 1 13 THR H H -0.037 10.644 3.647 1.00 . A A . 13 THR H 1 1
50 9930 1 1 13 THR HA H 2.274 12.650 3.863 1.00 . A A . 13 THR HA 1 1
50 9931 1 1 13 THR HB H 0.753 13.980 5.332 1.00 . A A . 13 THR HB 1 1
50 9932 1 1 13 THR HG1 H -1.463 13.528 5.153 1.00 . A A . 13 THR HG1 1 1
50 9933 1 1 13 THR HG21 H -0.368 13.530 2.496 1.00 . A A . 13 THR HG21 1 1
50 9934 1 1 13 THR HG22 H -0.640 14.952 3.531 1.00 . A A . 13 THR HG22 1 1
50 9935 1 1 13 THR HG23 H 0.990 14.604 2.917 1.00 . A A . 13 THR HG23 1 1
50 9936 1 1 13 THR N N 0.887 11.060 3.489 1.00 . A A . 13 THR N 1 1
50 9937 1 1 13 THR O O 1.183 11.416 6.669 1.00 . A A . 13 THR O 1 1
50 9938 1 1 13 THR OG1 O -0.881 12.770 5.048 1.00 . A A . 13 THR OG1 1 1
50 9939 1 1 14 ALA C C 4.514 11.526 7.766 1.00 . A A . 14 ALA C 1 1
50 9940 1 1 14 ALA CA C 3.835 10.462 6.872 1.00 . A A . 14 ALA CA 1 1
50 9941 1 1 14 ALA CB C 4.805 9.376 6.370 1.00 . A A . 14 ALA CB 1 1
50 9942 1 1 14 ALA H H 3.698 11.206 4.802 1.00 . A A . 14 ALA H 1 1
50 9943 1 1 14 ALA HXT H 2.743 11.738 8.542 1.00 . A A . 14 ALA HXT 1 1
50 9944 1 1 14 ALA HA H 3.072 9.937 7.482 1.00 . A A . 14 ALA HA 1 1
50 9945 1 1 14 ALA HB1 H 5.285 8.843 7.212 1.00 . A A . 14 ALA HB1 1 1
50 9946 1 1 14 ALA HB2 H 4.286 8.609 5.763 1.00 . A A . 14 ALA HB2 1 1
50 9947 1 1 14 ALA HB3 H 5.618 9.793 5.745 1.00 . A A . 14 ALA HB3 1 1
50 9948 1 1 14 ALA N N 3.201 11.099 5.694 1.00 . A A . 14 ALA N 1 1
50 9949 1 1 14 ALA O O 5.701 11.847 7.686 1.00 . A A . 14 ALA O 1 1
50 9950 1 1 14 ALA OXT O 3.631 12.085 8.655 1.00 . A A . 14 ALA OXT 1 1
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