NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
372938 |
1dlz   |
4601 | cing | 4-filtered-FRED | STAR | entry | full | 120 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dlz
# This FRED archive file contains, for PDB entry <1dlz>:
#
# - 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_1dlz
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1dlz
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1718.90
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 $ZERVAMICIN_IIB A . 1 1
stop_
save_
save_ZERVAMICIN_IIB
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "ZERVAMICIN IIB"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XWIQXITXLXXQXXXPX
_Entity.Number_of_monomers 17
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 ACE $ACE 1 1
2 TRP . 1 1
3 ILE . 1 1
4 GLN . 1 1
5 . $. 1 1
6 ILE . 1 1
7 THR . 1 1
8 ABA $ABA 1 1
9 LEU . 1 1
10 ABA $ABA 1 1
11 HYP $HYP 1 1
12 GLN . 1 1
13 ABA $ABA 1 1
14 HYP $HYP 1 1
15 ABA $ABA 1 1
16 PRO . 1 1
17 PHL $PHL 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
TRP 2 2 1 1
ILE 3 3 1 1
GLN 4 4 1 1
. 5 5 1 1
ILE 6 6 1 1
THR 7 7 1 1
ABA 8 8 1 1
LEU 9 9 1 1
ABA 10 10 1 1
HYP 11 11 1 1
GLN 12 12 1 1
ABA 13 13 1 1
HYP 14 14 1 1
ABA 15 15 1 1
PRO 16 16 1 1
PHL 17 17 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_ABA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ABA
_Chem_comp.Type non-polymer
save_
save_HYP
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID HYP
_Chem_comp.Type non-polymer
save_
save_PHL
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID PHL
_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_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
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 3 ILE MD . 3 ILE QD1 1 1
1 1 2 1 1 6 ILE HB . 6 ILE HB 1 1
2 1 1 1 1 6 ILE MG . 6 ILE QG2 1 1
2 1 2 1 1 7 THR HG1 . 7 THR HG1 1 1
3 1 1 1 1 11 HYP HB3 . 11 HYP HB2 1 1
3 1 2 1 1 11 HYP HD1 . 11 HYP HD1 1 1
4 1 1 1 1 11 HYP HA . 11 HYP HA 1 1
4 1 2 1 1 14 HYP HG . 14 HYP HG 1 1
5 1 1 1 1 12 GLN HA . 12 GLN HA 1 1
5 1 2 1 1 16 PRO QG . 16 PRO QG 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 3.0 . 1 1
2 1 . . . . . . 3.0 . 1 1
3 1 . . . . . . 3.0 . 1 1
4 1 . . . . . . 3.0 . 1 1
5 1 . . . . . . 3.0 . 1 1
stop_
save_
save_DYANA/DIANA_distance_constraints_7_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 2
19 1 . . . 1 2
20 1 . . . 1 2
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 1 . . . 1 2
26 1 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 1 . . . 1 2
39 1 . . . 1 2
40 1 . . . 1 2
41 1 . . . 1 2
42 1 . . . 1 2
43 1 . . . 1 2
44 1 . . . 1 2
45 1 . . . 1 2
46 1 . . . 1 2
47 1 . . . 1 2
48 1 . . . 1 2
49 1 . . . 1 2
50 1 . . . 1 2
51 1 . . . 1 2
52 1 . . . 1 2
53 1 . . . 1 2
54 1 . . . 1 2
55 1 . . . 1 2
56 1 . . . 1 2
57 1 . . . 1 2
58 1 . . . 1 2
59 1 . . . 1 2
60 1 . . . 1 2
61 1 . . . 1 2
62 1 . . . 1 2
63 1 . . . 1 2
64 1 . . . 1 2
65 1 . . . 1 2
66 1 . . . 1 2
67 1 . . . 1 2
68 1 . . . 1 2
69 1 . . . 1 2
70 1 . . . 1 2
71 1 . . . 1 2
72 1 . . . 1 2
73 1 . . . 1 2
74 1 . . . 1 2
75 1 . . . 1 2
76 1 . . . 1 2
77 1 . . . 1 2
78 1 . . . 1 2
79 1 . . . 1 2
80 1 . . . 1 2
81 1 . . . 1 2
82 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 TRP H . 2 TRP HN 1 2
1 1 2 1 1 2 TRP HD1 . 2 TRP HD1 1 2
2 1 1 1 1 2 TRP H . 2 TRP HN 1 2
2 1 2 1 1 3 ILE H . 3 ILE HN 1 2
3 1 1 1 1 2 TRP HA . 2 TRP HA 1 2
3 1 2 1 1 2 TRP HE3 . 2 TRP HE3 1 2
4 1 1 1 1 2 TRP HA . 2 TRP HA 1 2
4 1 2 1 1 3 ILE H . 3 ILE HN 1 2
5 1 1 1 1 2 TRP QB . 2 TRP QB 1 2
5 1 2 1 1 3 ILE H . 3 ILE HN 1 2
6 1 1 1 1 2 TRP QB . 2 TRP QB 1 2
6 1 2 1 1 6 ILE MD . 6 ILE QD1 1 2
7 1 1 1 1 2 TRP HE3 . 2 TRP HE3 1 2
7 1 2 1 1 3 ILE HA . 3 ILE HA 1 2
8 1 1 1 1 2 TRP HE3 . 2 TRP HE3 1 2
8 1 2 1 1 6 ILE MD . 6 ILE QD1 1 2
9 1 1 1 1 2 TRP HZ3 . 2 TRP HZ3 1 2
9 1 2 1 1 6 ILE MD . 6 ILE QD1 1 2
10 1 1 1 1 3 ILE H . 3 ILE HN 1 2
10 1 2 1 1 3 ILE HB . 3 ILE HB 1 2
11 1 1 1 1 3 ILE H . 3 ILE HN 1 2
11 1 2 1 1 4 GLN H . 4 GLN HN 1 2
12 1 1 1 1 3 ILE HA . 3 ILE HA 1 2
12 1 2 1 1 4 GLN H . 4 GLN HN 1 2
13 1 1 1 1 3 ILE HA . 3 ILE HA 1 2
13 1 2 1 1 6 ILE H . 6 ILE HN 1 2
14 1 1 1 1 3 ILE HA . 3 ILE HA 1 2
14 1 2 1 1 6 ILE HB . 6 ILE HB 1 2
15 1 1 1 1 3 ILE HA . 3 ILE HA 1 2
15 1 2 1 1 6 ILE MG . 6 ILE QG2 1 2
16 1 1 1 1 3 ILE HA . 3 ILE HA 1 2
16 1 2 1 1 6 ILE QG . 6 ILE QG1 1 2
17 1 1 1 1 3 ILE HA . 3 ILE HA 1 2
17 1 2 1 1 6 ILE MD . 6 ILE QD1 1 2
18 1 1 1 1 3 ILE HB . 3 ILE HB 1 2
18 1 2 1 1 4 GLN H . 4 GLN HN 1 2
19 1 1 1 1 3 ILE MD . 3 ILE QD1 1 2
19 1 2 1 1 4 GLN HA . 4 GLN HA 1 2
20 1 1 1 1 3 ILE MD . 3 ILE QD1 1 2
20 1 2 1 1 7 THR HG1 . 7 THR HG1 1 2
21 1 1 1 1 4 GLN H . 4 GLN HN 1 2
21 1 2 1 1 4 GLN HB2 . 4 GLN HB2 1 2
22 1 1 1 1 4 GLN HA . 4 GLN HA 1 2
22 1 2 1 1 4 GLN QG . 4 GLN QG 1 2
23 1 1 1 1 4 GLN HA . 4 GLN HA 1 2
23 1 2 1 1 7 THR H . 7 THR HN 1 2
24 1 1 1 1 4 GLN HA . 4 GLN HA 1 2
24 1 2 1 1 7 THR HB . 7 THR HB 1 2
25 1 1 1 1 4 GLN HA . 4 GLN HA 1 2
25 1 2 1 1 7 THR HG1 . 7 THR HG1 1 2
26 1 1 1 1 4 GLN HA . 4 GLN HA 1 2
26 1 2 1 1 8 ABA H . 8 AIB HN 1 2
27 1 1 1 1 4 GLN QG . 4 GLN QG 1 2
27 1 2 1 1 8 ABA H . 8 AIB HN 1 2
28 1 1 1 1 6 ILE H . 6 ILE HN 1 2
28 1 2 1 1 6 ILE HA . 6 ILE HA 1 2
29 1 1 1 1 6 ILE H . 6 ILE HN 1 2
29 1 2 1 1 6 ILE HB . 6 ILE HB 1 2
30 1 1 1 1 6 ILE H . 6 ILE HN 1 2
30 1 2 1 1 6 ILE HG13 . 6 ILE HG12 1 2
31 1 1 1 1 6 ILE HA . 6 ILE HA 1 2
31 1 2 1 1 9 LEU H . 9 LEU HN 1 2
32 1 1 1 1 6 ILE HA . 6 ILE HA 1 2
32 1 2 1 1 9 LEU HB2 . 9 LEU HB2 1 2
33 1 1 1 1 6 ILE HA . 6 ILE HA 1 2
33 1 2 1 1 10 ABA H . 10 AIB HN 1 2
34 1 1 1 1 6 ILE HB . 6 ILE HB 1 2
34 1 2 1 1 9 LEU H . 9 LEU HN 1 2
35 1 1 1 1 6 ILE MG . 6 ILE QG2 1 2
35 1 2 1 1 7 THR HA . 7 THR HA 1 2
36 1 1 1 1 7 THR H . 7 THR HN 1 2
36 1 2 1 1 7 THR HA . 7 THR HA 1 2
37 1 1 1 1 7 THR H . 7 THR HN 1 2
37 1 2 1 1 7 THR HB . 7 THR HB 1 2
38 1 1 1 1 7 THR H . 7 THR HN 1 2
38 1 2 1 1 7 THR HG1 . 7 THR HG1 1 2
39 1 1 1 1 7 THR H . 7 THR HN 1 2
39 1 2 1 1 9 LEU H . 9 LEU HN 1 2
40 1 1 1 1 7 THR HA . 7 THR HA 1 2
40 1 2 1 1 7 THR HB . 7 THR HB 1 2
41 1 1 1 1 7 THR HA . 7 THR HA 1 2
41 1 2 1 1 8 ABA H . 8 AIB HN 1 2
42 1 1 1 1 7 THR HA . 7 THR HA 1 2
42 1 2 1 1 9 LEU H . 9 LEU HN 1 2
43 1 1 1 1 7 THR HA . 7 THR HA 1 2
43 1 2 1 1 10 ABA H . 10 AIB HN 1 2
44 1 1 1 1 7 THR HA . 7 THR HA 1 2
44 1 2 1 1 11 HYP HD23 . 11 HYP HD23 1 2
45 1 1 1 1 7 THR HB . 7 THR HB 1 2
45 1 2 1 1 8 ABA H . 8 AIB HN 1 2
46 1 1 1 1 7 THR MG . 7 THR QG2 1 2
46 1 2 1 1 8 ABA H . 8 AIB HN 1 2
47 1 1 1 1 8 ABA H . 8 AIB HN 1 2
47 1 2 1 1 9 LEU H . 9 LEU HN 1 2
48 1 1 1 1 8 ABA H . 8 AIB HN 1 2
48 1 2 1 1 10 ABA H . 10 AIB HN 1 2
49 1 1 1 1 9 LEU H . 9 LEU HN 1 2
49 1 2 1 1 9 LEU HA . 9 LEU HA 1 2
50 1 1 1 1 9 LEU H . 9 LEU HN 1 2
50 1 2 1 1 9 LEU HB2 . 9 LEU HB2 1 2
51 1 1 1 1 9 LEU H . 9 LEU HN 1 2
51 1 2 1 1 9 LEU HG . 9 LEU HG 1 2
52 1 1 1 1 9 LEU H . 9 LEU HN 1 2
52 1 2 1 1 10 ABA H . 10 AIB HN 1 2
53 1 1 1 1 9 LEU H . 9 LEU HN 1 2
53 1 2 1 1 11 HYP HD22 . 11 HYP HD22 1 2
54 1 1 1 1 9 LEU HA . 9 LEU HA 1 2
54 1 2 1 1 11 HYP HD22 . 11 HYP HD22 1 2
55 1 1 1 1 9 LEU HA . 9 LEU HA 1 2
55 1 2 1 1 12 GLN H . 12 GLN HN 1 2
56 1 1 1 1 9 LEU HA . 9 LEU HA 1 2
56 1 2 1 1 12 GLN HB2 . 12 GLN HB2 1 2
57 1 1 1 1 9 LEU HA . 9 LEU HA 1 2
57 1 2 1 1 12 GLN QG . 12 GLN QG 1 2
58 1 1 1 1 9 LEU HB2 . 9 LEU HB2 1 2
58 1 2 1 1 10 ABA H . 10 AIB HN 1 2
59 1 1 1 1 10 ABA H . 10 AIB HN 1 2
59 1 2 1 1 11 HYP HD22 . 11 HYP HD22 1 2
60 1 1 1 1 10 ABA H . 10 AIB HN 1 2
60 1 2 1 1 11 HYP HD23 . 11 HYP HD23 1 2
61 1 1 1 1 11 HYP HA . 11 HYP HA 1 2
61 1 2 1 1 13 ABA H . 13 AIB HN 1 2
62 1 1 1 1 11 HYP HA . 11 HYP HA 1 2
62 1 2 1 1 14 HYP HD23 . 14 HYP HD23 1 2
63 1 1 1 1 11 HYP HB3 . 11 HYP HB2 1 2
63 1 2 1 1 12 GLN H . 12 GLN HN 1 2
64 1 1 1 1 11 HYP HD22 . 11 HYP HD22 1 2
64 1 2 1 1 12 GLN H . 12 GLN HN 1 2
65 1 1 1 1 11 HYP HD23 . 11 HYP HD23 1 2
65 1 2 1 1 12 GLN H . 12 GLN HN 1 2
66 1 1 1 1 11 HYP HD23 . 11 HYP HD23 1 2
66 1 2 1 1 13 ABA H . 13 AIB HN 1 2
67 1 1 1 1 12 GLN H . 12 GLN HN 1 2
67 1 2 1 1 12 GLN HA . 12 GLN HA 1 2
68 1 1 1 1 12 GLN H . 12 GLN HN 1 2
68 1 2 1 1 12 GLN HB2 . 12 GLN HB2 1 2
69 1 1 1 1 12 GLN H . 12 GLN HN 1 2
69 1 2 1 1 13 ABA H . 13 AIB HN 1 2
70 1 1 1 1 12 GLN HA . 12 GLN HA 1 2
70 1 2 1 1 13 ABA H . 13 AIB HN 1 2
71 1 1 1 1 12 GLN HA . 12 GLN HA 1 2
71 1 2 1 1 14 HYP HD22 . 14 HYP HD22 1 2
72 1 1 1 1 12 GLN HA . 12 GLN HA 1 2
72 1 2 1 1 15 ABA H . 15 AIB HN 1 2
73 1 1 1 1 12 GLN HB2 . 12 GLN HB2 1 2
73 1 2 1 1 13 ABA H . 13 AIB HN 1 2
74 1 1 1 1 12 GLN QG . 12 GLN QG 1 2
74 1 2 1 1 13 ABA H . 13 AIB HN 1 2
75 1 1 1 1 12 GLN QG . 12 GLN QG 1 2
75 1 2 1 1 15 ABA H . 15 AIB HN 1 2
76 1 1 1 1 13 ABA H . 13 AIB HN 1 2
76 1 2 1 1 14 HYP HD22 . 14 HYP HD22 1 2
77 1 1 1 1 13 ABA H . 13 AIB HN 1 2
77 1 2 1 1 14 HYP HD23 . 14 HYP HD23 1 2
78 1 1 1 1 13 ABA H . 13 AIB HN 1 2
78 1 2 1 1 15 ABA H . 15 AIB HN 1 2
79 1 1 1 1 14 HYP HB3 . 14 HYP HB2 1 2
79 1 2 1 1 15 ABA H . 15 AIB HN 1 2
80 1 1 1 1 14 HYP HD22 . 14 HYP HD22 1 2
80 1 2 1 1 15 ABA H . 15 AIB HN 1 2
81 1 1 1 1 14 HYP HD23 . 14 HYP HD23 1 2
81 1 2 1 1 15 ABA H . 15 AIB HN 1 2
82 1 1 1 1 15 ABA H . 15 AIB HN 1 2
82 1 2 1 1 16 PRO HD3 . 16 PRO HD2 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 4.72 1 2
2 1 . . . . . . . 3.33 1 2
3 1 . . . . . . . 5.5 1 2
4 1 . . . . . . . 3.58 1 2
5 1 . . . . . . . 4.86 1 2
6 1 . . . . . . . 7.4 1 2
7 1 . . . . . . . 5.5 1 2
8 1 . . . . . . . 6.19 1 2
9 1 . . . . . . . 6.53 1 2
10 1 . . . . . . . 2.96 1 2
11 1 . . . . . . . 3.17 1 2
12 1 . . . . . . . 3.45 1 2
13 1 . . . . . . . 3.64 1 2
14 1 . . . . . . . 3.48 1 2
15 1 . . . . . . . 4.42 1 2
16 1 . . . . . . . 5.45 1 2
17 1 . . . . . . . 5.1 1 2
18 1 . . . . . . . 3.55 1 2
19 1 . . . . . . . 6.53 1 2
20 1 . . . . . . . 6.53 1 2
21 1 . . . . . . . 3.08 1 2
22 1 . . . . . . . 3.71 1 2
23 1 . . . . . . . 3.61 1 2
24 1 . . . . . . . 2.87 1 2
25 1 . . . . . . . 5.5 1 2
26 1 . . . . . . . 4.04 1 2
27 1 . . . . . . . 6.0 1 2
28 1 . . . . . . . 2.77 1 2
29 1 . . . . . . . 2.68 1 2
30 1 . . . . . . . 4.29 1 2
31 1 . . . . . . . 4.17 1 2
32 1 . . . . . . . 3.21 1 2
33 1 . . . . . . . 4.48 1 2
34 1 . . . . . . . 5.5 1 2
35 1 . . . . . . . 6.53 1 2
36 1 . . . . . . . 2.93 1 2
37 1 . . . . . . . 2.8 1 2
38 1 . . . . . . . 4.35 1 2
39 1 . . . . . . . 5.5 1 2
40 1 . . . . . . . 3.02 1 2
41 1 . . . . . . . 3.55 1 2
42 1 . . . . . . . 5.5 1 2
43 1 . . . . . . . 3.67 1 2
44 1 . . . . . . . 5.0 1 2
45 1 . . . . . . . 2.83 1 2
46 1 . . . . . . . 6.53 1 2
47 1 . . . . . . . 2.71 1 2
48 1 . . . . . . . 3.83 1 2
49 1 . . . . . . . 2.93 1 2
50 1 . . . . . . . 2.71 1 2
51 1 . . . . . . . 4.04 1 2
52 1 . . . . . . . 2.71 1 2
53 1 . . . . . . . 5.5 1 2
54 1 . . . . . . . 4.01 1 2
55 1 . . . . . . . 4.11 1 2
56 1 . . . . . . . 3.92 1 2
57 1 . . . . . . . 6.38 1 2
58 1 . . . . . . . 3.98 1 2
59 1 . . . . . . . 4.04 1 2
60 1 . . . . . . . 3.24 1 2
61 1 . . . . . . . 5.1 1 2
62 1 . . . . . . . 5.5 1 2
63 1 . . . . . . . 3.83 1 2
64 1 . . . . . . . 3.27 1 2
65 1 . . . . . . . 5.19 1 2
66 1 . . . . . . . 5.5 1 2
67 1 . . . . . . . 2.84 1 2
68 1 . . . . . . . 2.9 1 2
69 1 . . . . . . . 2.68 1 2
70 1 . . . . . . . 3.61 1 2
71 1 . . . . . . . 4.17 1 2
72 1 . . . . . . . 4.01 1 2
73 1 . . . . . . . 4.11 1 2
74 1 . . . . . . . 6.38 1 2
75 1 . . . . . . . 6.38 1 2
76 1 . . . . . . . 3.76 1 2
77 1 . . . . . . . 2.96 1 2
78 1 . . . . . . . 4.79 1 2
79 1 . . . . . . . 4.07 1 2
80 1 . . . . . . . 3.61 1 2
81 1 . . . . . . . 4.82 1 2
82 1 . . . . . . . 3.8 1 2
stop_
save_
save_DYANA/DIANA_distance_constraints_5_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 3
2 1 . . . 1 3
3 1 . . . 1 3
4 1 . . . 1 3
5 1 . . . 1 3
6 1 . . . 1 3
7 1 . . . 1 3
8 1 . . . 1 3
9 1 . . . 1 3
10 1 . . . 1 3
11 1 . . . 1 3
12 1 . . . 1 3
13 1 . . . 1 3
14 1 . . . 1 3
15 1 . . . 1 3
16 1 . . . 1 3
17 1 . . . 1 3
18 1 . . . 1 3
19 1 . . . 1 3
20 1 . . . 1 3
21 1 . . . 1 3
22 1 . . . 1 3
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 TRP O . 2 TRP O 1 3
1 1 2 1 1 6 ILE H . 6 ILE HN 1 3
2 1 1 1 1 2 TRP O . 2 TRP O 1 3
2 1 2 1 1 6 ILE N . 6 ILE N 1 3
3 1 1 1 1 2 TRP C . 2 TRP C 1 3
3 1 2 1 1 6 ILE H . 6 ILE HN 1 3
4 1 1 1 1 3 ILE O . 3 ILE O 1 3
4 1 2 1 1 7 THR H . 7 THR HN 1 3
5 1 1 1 1 3 ILE O . 3 ILE O 1 3
5 1 2 1 1 7 THR N . 7 THR N 1 3
6 1 1 1 1 3 ILE C . 3 ILE C 1 3
6 1 2 1 1 7 THR H . 7 THR HN 1 3
7 1 1 1 1 4 GLN O . 4 GLN O 1 3
7 1 2 1 1 8 ABA H . 8 AIB HN 1 3
8 1 1 1 1 4 GLN O . 4 GLN O 1 3
8 1 2 1 1 8 ABA N . 8 AIB N 1 3
9 1 1 1 1 4 GLN C . 4 GLN C 1 3
9 1 2 1 1 8 ABA H . 8 AIB HN 1 3
10 1 1 1 1 6 ILE O . 6 ILE O 1 3
10 1 2 1 1 9 LEU H . 9 LEU HN 1 3
11 1 1 1 1 6 ILE O . 6 ILE O 1 3
11 1 2 1 1 9 LEU N . 9 LEU N 1 3
12 1 1 1 1 6 ILE C . 6 ILE C 1 3
12 1 2 1 1 9 LEU H . 9 LEU HN 1 3
13 1 1 1 1 7 THR O . 7 THR O 1 3
13 1 2 1 1 10 ABA H . 10 AIB HN 1 3
14 1 1 1 1 7 THR O . 7 THR O 1 3
14 1 2 1 1 10 ABA N . 10 AIB N 1 3
15 1 1 1 1 7 THR C . 7 THR C 1 3
15 1 2 1 1 10 ABA H . 10 AIB HN 1 3
16 1 1 1 1 9 LEU O . 9 LEU O 1 3
16 1 2 1 1 12 GLN H . 12 GLN HN 1 3
17 1 1 1 1 9 LEU O . 9 LEU O 1 3
17 1 2 1 1 12 GLN N . 12 GLN N 1 3
18 1 1 1 1 9 LEU C . 9 LEU C 1 3
18 1 2 1 1 12 GLN H . 12 GLN HN 1 3
19 1 1 1 1 10 ABA O . 10 AIB O 1 3
19 1 2 1 1 13 ABA H . 13 AIB HN 1 3
20 1 1 1 1 10 ABA O . 10 AIB O 1 3
20 1 2 1 1 13 ABA N . 13 AIB N 1 3
21 1 1 1 1 10 ABA C . 10 AIB C 1 3
21 1 2 1 1 13 ABA H . 13 AIB HN 1 3
22 1 1 1 1 13 ABA O . 13 AIB O 1 3
22 1 2 1 1 17 PHL N . 17 PHE N 1 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.8 2.3 1 3
2 1 . . . . . . 2.8 3.4 1 3
3 1 . . . . . . 2.5 3.6 1 3
4 1 . . . . . . 1.8 2.3 1 3
5 1 . . . . . . 2.8 3.4 1 3
6 1 . . . . . . 2.5 3.6 1 3
7 1 . . . . . . 1.8 2.3 1 3
8 1 . . . . . . 2.8 3.4 1 3
9 1 . . . . . . 2.5 3.6 1 3
10 1 . . . . . . 1.8 2.3 1 3
11 1 . . . . . . 2.8 3.4 1 3
12 1 . . . . . . 2.5 3.6 1 3
13 1 . . . . . . 1.8 2.3 1 3
14 1 . . . . . . 2.8 3.4 1 3
15 1 . . . . . . 2.5 3.6 1 3
16 1 . . . . . . 1.8 2.3 1 3
17 1 . . . . . . 2.8 3.4 1 3
18 1 . . . . . . 2.5 3.6 1 3
19 1 . . . . . . 1.8 2.3 1 3
20 1 . . . . . . 2.8 3.4 1 3
21 1 . . . . . . 2.5 3.6 1 3
22 1 . . . . . . 2.8 3.4 1 3
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 PHI 1 1 1 ACE C 1 1 2 TRP N 1 1 2 TRP CA 1 1 2 TRP C -70.0 -50.0 . . . . . . . . . . . . . . . . 1 1
2 PHI 1 1 2 TRP C 1 1 3 ILE N 1 1 3 ILE CA 1 1 3 ILE C -89.99999 -40.0 . . . . . . . . . . . . . . . . 1 1
3 PHI 1 1 3 ILE C 1 1 4 GLN N 1 1 4 GLN CA 1 1 4 GLN C -89.99999 -40.0 . . . . . . . . . . . . . . . . 1 1
4 CHI1 1 1 4 GLN N 1 1 4 GLN CA 1 1 4 GLN CB 1 1 4 GLN CG -89.99999 -30.0 . . . . . . . . . . . . . . . . 1 1
5 PHI 1 1 6 ILE C 1 1 7 THR N 1 1 7 THR CA 1 1 7 THR C -89.99999 -40.0 . . . . . . . . . . . . . . . . 1 1
6 PHI 1 1 8 ABA C 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU C -100.0 -70.0 . . . . . . . . . . . . . . . . 1 1
7 CHI1 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU CB 1 1 9 LEU CG -89.99999 -30.0 . . . . . . . . . . . . . . . . 1 1
8 PHI 1 1 11 HYP C 1 1 12 GLN N 1 1 12 GLN CA 1 1 12 GLN C -160.0 -80.0 . . . . . . . . . . . . . . . . 1 1
9 CHI1 1 1 12 GLN N 1 1 12 GLN CA 1 1 12 GLN CB 1 1 12 GLN CG -89.99999 -30.0 . . . . . . . . . . . . . . . . 1 1
10 PHI 1 1 16 PRO C 1 1 17 PHL N 1 1 17 PHL CA 1 1 17 PHL C -140.0 -100.0 . . . . . . . . . . . . . . . . 1 1
11 CHI1 1 1 17 PHL N 1 1 17 PHL CA 1 1 17 PHL CB 1 1 17 PHL CG -89.99999 -30.0 . . . . . . . . . . . . . . . . 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 ACE C C -1.775 10.446 1.248 1.00 . A A . 1 ACE C 1 1
1 2 1 1 1 ACE CH3 C -0.863 11.654 1.416 1.00 . A A . 1 ACE CH3 1 1
1 3 1 1 1 ACE H1 H -1.434 12.588 1.570 1.00 . A A . 1 ACE H1 1 1
1 4 1 1 1 ACE H2 H -0.180 11.521 2.274 1.00 . A A . 1 ACE H2 1 1
1 5 1 1 1 ACE H3 H -0.229 11.784 0.516 1.00 . A A . 1 ACE H3 1 1
1 6 1 1 1 ACE O O -1.596 9.426 1.916 1.00 . A A . 1 ACE O 1 1
1 7 1 1 2 TRP C C -2.472 8.469 -1.211 1.00 . A A . 2 TRP C 1 1
1 8 1 1 2 TRP CA C -3.381 9.384 -0.323 1.00 . A A . 2 TRP CA 1 1
1 9 1 1 2 TRP CB C -4.660 9.816 -1.096 1.00 . A A . 2 TRP CB 1 1
1 10 1 1 2 TRP CD1 C -6.231 11.736 -0.224 1.00 . A A . 2 TRP CD1 1 1
1 11 1 1 2 TRP CD2 C -6.558 9.751 0.728 1.00 . A A . 2 TRP CD2 1 1
1 12 1 1 2 TRP CE2 C -7.439 10.703 1.300 1.00 . A A . 2 TRP CE2 1 1
1 13 1 1 2 TRP CE3 C -6.560 8.407 1.185 1.00 . A A . 2 TRP CE3 1 1
1 14 1 1 2 TRP CG C -5.789 10.396 -0.228 1.00 . A A . 2 TRP CG 1 1
1 15 1 1 2 TRP CH2 C -8.307 8.995 2.778 1.00 . A A . 2 TRP CH2 1 1
1 16 1 1 2 TRP CZ2 C -8.322 10.320 2.338 1.00 . A A . 2 TRP CZ2 1 1
1 17 1 1 2 TRP CZ3 C -7.440 8.053 2.208 1.00 . A A . 2 TRP CZ3 1 1
1 18 1 1 2 TRP H H -2.817 11.492 -0.115 1.00 . A A . 2 TRP H 1 1
1 19 1 1 2 TRP HA H -3.716 8.765 0.522 1.00 . A A . 2 TRP HA 1 1
1 20 1 1 2 TRP HB2 H -4.393 10.528 -1.901 1.00 . A A . 2 TRP HB2 1 1
1 21 1 1 2 TRP HB3 H -5.082 8.943 -1.632 1.00 . A A . 2 TRP HB3 1 1
1 22 1 1 2 TRP HD1 H -5.824 12.516 -0.851 1.00 . A A . 2 TRP HD1 1 1
1 23 1 1 2 TRP HE1 H -7.759 12.820 0.919 1.00 . A A . 2 TRP HE1 1 1
1 24 1 1 2 TRP HE3 H -5.894 7.672 0.758 1.00 . A A . 2 TRP HE3 1 1
1 25 1 1 2 TRP HH2 H -8.972 8.692 3.573 1.00 . A A . 2 TRP HH2 1 1
1 26 1 1 2 TRP HZ2 H -8.993 11.039 2.789 1.00 . A A . 2 TRP HZ2 1 1
1 27 1 1 2 TRP HZ3 H -7.450 7.034 2.567 1.00 . A A . 2 TRP HZ3 1 1
1 28 1 1 2 TRP N N -2.697 10.560 0.280 1.00 . A A . 2 TRP N 1 1
1 29 1 1 2 TRP NE1 N -7.258 11.946 0.716 1.00 . A A . 2 TRP NE1 1 1
1 30 1 1 2 TRP O O -2.721 7.262 -1.283 1.00 . A A . 2 TRP O 1 1
1 31 1 1 3 ILE C C 0.491 7.344 -1.545 1.00 . A A . 3 ILE C 1 1
1 32 1 1 3 ILE CA C -0.356 8.207 -2.535 1.00 . A A . 3 ILE CA 1 1
1 33 1 1 3 ILE CB C 0.482 9.068 -3.555 1.00 . A A . 3 ILE CB 1 1
1 34 1 1 3 ILE CD1 C 0.276 10.825 -5.507 1.00 . A A . 3 ILE CD1 1 1
1 35 1 1 3 ILE CG1 C -0.408 9.752 -4.644 1.00 . A A . 3 ILE CG1 1 1
1 36 1 1 3 ILE CG2 C 1.604 8.247 -4.254 1.00 . A A . 3 ILE CG2 1 1
1 37 1 1 3 ILE H H -1.296 10.021 -1.693 1.00 . A A . 3 ILE H 1 1
1 38 1 1 3 ILE HA H -0.905 7.467 -3.126 1.00 . A A . 3 ILE HA 1 1
1 39 1 1 3 ILE HB H 0.983 9.865 -2.974 1.00 . A A . 3 ILE HB 1 1
1 40 1 1 3 ILE HD11 H 1.058 10.401 -6.162 1.00 . A A . 3 ILE HD11 1 1
1 41 1 1 3 ILE HD12 H -0.456 11.321 -6.169 1.00 . A A . 3 ILE HD12 1 1
1 42 1 1 3 ILE HD13 H 0.745 11.611 -4.888 1.00 . A A . 3 ILE HD13 1 1
1 43 1 1 3 ILE HG12 H -0.857 8.984 -5.301 1.00 . A A . 3 ILE HG12 1 1
1 44 1 1 3 ILE HG13 H -1.269 10.251 -4.162 1.00 . A A . 3 ILE HG13 1 1
1 45 1 1 3 ILE HG21 H 1.195 7.403 -4.841 1.00 . A A . 3 ILE HG21 1 1
1 46 1 1 3 ILE HG22 H 2.212 8.861 -4.942 1.00 . A A . 3 ILE HG22 1 1
1 47 1 1 3 ILE HG23 H 2.319 7.819 -3.526 1.00 . A A . 3 ILE HG23 1 1
1 48 1 1 3 ILE N N -1.409 9.013 -1.849 1.00 . A A . 3 ILE N 1 1
1 49 1 1 3 ILE O O 0.722 6.172 -1.839 1.00 . A A . 3 ILE O 1 1
1 50 1 1 4 GLN C C 0.610 6.168 1.515 1.00 . A A . 4 GLN C 1 1
1 51 1 1 4 GLN CA C 1.552 7.097 0.693 1.00 . A A . 4 GLN CA 1 1
1 52 1 1 4 GLN CB C 2.402 8.012 1.612 1.00 . A A . 4 GLN CB 1 1
1 53 1 1 4 GLN CD C 4.886 7.289 1.143 1.00 . A A . 4 GLN CD 1 1
1 54 1 1 4 GLN CG C 3.795 8.381 1.037 1.00 . A A . 4 GLN CG 1 1
1 55 1 1 4 GLN H H 0.607 8.855 -0.279 1.00 . A A . 4 GLN H 1 1
1 56 1 1 4 GLN HA H 2.256 6.408 0.195 1.00 . A A . 4 GLN HA 1 1
1 57 1 1 4 GLN HB2 H 1.831 8.934 1.839 1.00 . A A . 4 GLN HB2 1 1
1 58 1 1 4 GLN HB3 H 2.562 7.541 2.601 1.00 . A A . 4 GLN HB3 1 1
1 59 1 1 4 GLN HE21 H 6.306 8.687 0.923 1.00 . A A . 4 GLN HE21 1 1
1 60 1 1 4 GLN HE22 H 6.864 6.957 1.172 1.00 . A A . 4 GLN HE22 1 1
1 61 1 1 4 GLN HG2 H 3.692 8.681 -0.024 1.00 . A A . 4 GLN HG2 1 1
1 62 1 1 4 GLN HG3 H 4.142 9.289 1.565 1.00 . A A . 4 GLN HG3 1 1
1 63 1 1 4 GLN N N 0.923 7.892 -0.398 1.00 . A A . 4 GLN N 1 1
1 64 1 1 4 GLN NE2 N 6.147 7.684 1.066 1.00 . A A . 4 GLN NE2 1 1
1 65 1 1 4 GLN O O 1.105 5.146 1.992 1.00 . A A . 4 GLN O 1 1
1 66 1 1 4 GLN OE1 O 4.626 6.093 1.287 1.00 . A A . 4 GLN OE1 1 1
1 67 1 1 5 . C C -1.695 4.139 1.224 1.00 . A A . 5 DIV C 1 1
1 68 1 1 5 . CA C -1.750 5.453 2.113 1.00 . A A . 5 DIV CA 1 1
1 69 1 1 5 . CB1 C -1.562 5.181 3.656 1.00 . A A . 5 DIV CB1 1 1
1 70 1 1 5 . CB2 C -3.129 6.158 1.930 1.00 . A A . 5 DIV CB2 1 1
1 71 1 1 5 . CG1 C -2.666 4.404 4.413 1.00 . A A . 5 DIV CG1 1 1
1 72 1 1 5 . H H -0.986 7.328 1.205 1.00 . A A . 5 DIV H 1 1
1 73 1 1 5 . HB11 H -0.612 4.636 3.816 1.00 . A A . 5 DIV HB11 1 1
1 74 1 1 5 . HB12 H -1.418 6.139 4.193 1.00 . A A . 5 DIV HB12 1 1
1 75 1 1 5 . HB21 H -3.340 6.421 0.882 1.00 . A A . 5 DIV HB21 1 1
1 76 1 1 5 . HB22 H -3.971 5.512 2.240 1.00 . A A . 5 DIV HB22 1 1
1 77 1 1 5 . HB23 H -3.213 7.090 2.519 1.00 . A A . 5 DIV HB23 1 1
1 78 1 1 5 . HG11 H -2.951 3.470 3.900 1.00 . A A . 5 DIV HG11 1 1
1 79 1 1 5 . HG12 H -2.339 4.133 5.433 1.00 . A A . 5 DIV HG12 1 1
1 80 1 1 5 . HG13 H -3.583 5.010 4.525 1.00 . A A . 5 DIV HG13 1 1
1 81 1 1 5 . N N -0.712 6.447 1.653 1.00 . A A . 5 DIV N 1 1
1 82 1 1 5 . O O -1.498 3.043 1.758 1.00 . A A . 5 DIV O 1 1
1 83 1 1 6 ILE C C -0.192 2.485 -1.139 1.00 . A A . 6 ILE C 1 1
1 84 1 1 6 ILE CA C -1.630 3.086 -1.051 1.00 . A A . 6 ILE CA 1 1
1 85 1 1 6 ILE CB C -2.318 3.270 -2.450 1.00 . A A . 6 ILE CB 1 1
1 86 1 1 6 ILE CD1 C -2.118 4.400 -4.804 1.00 . A A . 6 ILE CD1 1 1
1 87 1 1 6 ILE CG1 C -1.742 4.429 -3.315 1.00 . A A . 6 ILE CG1 1 1
1 88 1 1 6 ILE CG2 C -3.861 3.362 -2.323 1.00 . A A . 6 ILE CG2 1 1
1 89 1 1 6 ILE H H -2.039 5.163 -0.506 1.00 . A A . 6 ILE H 1 1
1 90 1 1 6 ILE HA H -2.209 2.292 -0.563 1.00 . A A . 6 ILE HA 1 1
1 91 1 1 6 ILE HB H -2.128 2.331 -3.006 1.00 . A A . 6 ILE HB 1 1
1 92 1 1 6 ILE HD11 H -3.205 4.519 -4.960 1.00 . A A . 6 ILE HD11 1 1
1 93 1 1 6 ILE HD12 H -1.619 5.220 -5.351 1.00 . A A . 6 ILE HD12 1 1
1 94 1 1 6 ILE HD13 H -1.808 3.452 -5.282 1.00 . A A . 6 ILE HD13 1 1
1 95 1 1 6 ILE HG12 H -2.033 5.405 -2.889 1.00 . A A . 6 ILE HG12 1 1
1 96 1 1 6 ILE HG13 H -0.638 4.413 -3.267 1.00 . A A . 6 ILE HG13 1 1
1 97 1 1 6 ILE HG21 H -4.185 4.297 -1.828 1.00 . A A . 6 ILE HG21 1 1
1 98 1 1 6 ILE HG22 H -4.363 3.324 -3.306 1.00 . A A . 6 ILE HG22 1 1
1 99 1 1 6 ILE HG23 H -4.272 2.521 -1.732 1.00 . A A . 6 ILE HG23 1 1
1 100 1 1 6 ILE N N -1.783 4.246 -0.131 1.00 . A A . 6 ILE N 1 1
1 101 1 1 6 ILE O O -0.083 1.265 -1.050 1.00 . A A . 6 ILE O 1 1
1 102 1 1 7 THR C C 2.825 2.012 -0.145 1.00 . A A . 7 THR C 1 1
1 103 1 1 7 THR CA C 2.293 2.773 -1.410 1.00 . A A . 7 THR CA 1 1
1 104 1 1 7 THR CB C 3.239 3.920 -1.888 1.00 . A A . 7 THR CB 1 1
1 105 1 1 7 THR CG2 C 4.681 3.484 -2.209 1.00 . A A . 7 THR CG2 1 1
1 106 1 1 7 THR H H 0.670 4.283 -1.359 1.00 . A A . 7 THR H 1 1
1 107 1 1 7 THR HA H 2.281 2.032 -2.234 1.00 . A A . 7 THR HA 1 1
1 108 1 1 7 THR HB H 3.284 4.704 -1.107 1.00 . A A . 7 THR HB 1 1
1 109 1 1 7 THR HG1 H 3.314 5.253 -3.275 1.00 . A A . 7 THR HG1 1 1
1 110 1 1 7 THR HG21 H 5.283 4.330 -2.592 1.00 . A A . 7 THR HG21 1 1
1 111 1 1 7 THR HG22 H 5.206 3.096 -1.316 1.00 . A A . 7 THR HG22 1 1
1 112 1 1 7 THR HG23 H 4.705 2.692 -2.980 1.00 . A A . 7 THR HG23 1 1
1 113 1 1 7 THR N N 0.887 3.283 -1.288 1.00 . A A . 7 THR N 1 1
1 114 1 1 7 THR O O 3.450 0.960 -0.302 1.00 . A A . 7 THR O 1 1
1 115 1 1 7 THR OG1 O 2.732 4.516 -3.079 1.00 . A A . 7 THR OG1 1 1
1 116 1 1 8 ABA C C 1.862 0.362 2.397 1.00 . A A . 8 AIB C 1 1
1 117 1 1 8 ABA CA C 2.682 1.716 2.362 1.00 . A A . 8 AIB CA 1 1
1 118 1 1 8 ABA H H 1.914 3.301 1.030 1.00 . A A . 8 AIB H 1 1
1 119 1 1 8 ABA N N 2.545 2.498 1.085 1.00 . A A . 8 AIB N 1 1
1 120 1 1 8 ABA O O 2.334 -0.635 2.955 1.00 . A A . 8 AIB O 1 1
1 121 1 1 9 LEU C C 0.374 -1.763 0.294 1.00 . A A . 9 LEU C 1 1
1 122 1 1 9 LEU CA C -0.089 -0.942 1.537 1.00 . A A . 9 LEU CA 1 1
1 123 1 1 9 LEU CB C -1.620 -0.662 1.476 1.00 . A A . 9 LEU CB 1 1
1 124 1 1 9 LEU CD1 C -2.822 0.499 3.438 1.00 . A A . 9 LEU CD1 1 1
1 125 1 1 9 LEU CD2 C -3.626 -1.771 2.662 1.00 . A A . 9 LEU CD2 1 1
1 126 1 1 9 LEU CG C -2.400 -0.845 2.819 1.00 . A A . 9 LEU CG 1 1
1 127 1 1 9 LEU H H 0.361 1.138 1.260 1.00 . A A . 9 LEU H 1 1
1 128 1 1 9 LEU HA H 0.081 -1.608 2.391 1.00 . A A . 9 LEU HA 1 1
1 129 1 1 9 LEU HB2 H -1.833 0.321 1.010 1.00 . A A . 9 LEU HB2 1 1
1 130 1 1 9 LEU HB3 H -2.062 -1.361 0.743 1.00 . A A . 9 LEU HB3 1 1
1 131 1 1 9 LEU HD11 H -3.500 1.068 2.773 1.00 . A A . 9 LEU HD11 1 1
1 132 1 1 9 LEU HD12 H -3.349 0.357 4.399 1.00 . A A . 9 LEU HD12 1 1
1 133 1 1 9 LEU HD13 H -1.947 1.143 3.646 1.00 . A A . 9 LEU HD13 1 1
1 134 1 1 9 LEU HD21 H -3.330 -2.773 2.300 1.00 . A A . 9 LEU HD21 1 1
1 135 1 1 9 LEU HD22 H -4.151 -1.927 3.623 1.00 . A A . 9 LEU HD22 1 1
1 136 1 1 9 LEU HD23 H -4.364 -1.369 1.942 1.00 . A A . 9 LEU HD23 1 1
1 137 1 1 9 LEU HG H -1.747 -1.343 3.561 1.00 . A A . 9 LEU HG 1 1
1 138 1 1 9 LEU N N 0.639 0.318 1.804 1.00 . A A . 9 LEU N 1 1
1 139 1 1 9 LEU O O -0.048 -2.917 0.215 1.00 . A A . 9 LEU O 1 1
1 140 1 1 10 ABA C C 2.347 -3.435 -1.497 1.00 . A A . 10 AIB C 1 1
1 141 1 1 10 ABA CA C 1.683 -2.026 -1.853 1.00 . A A . 10 AIB CA 1 1
1 142 1 1 10 ABA H H 1.510 -0.282 -0.467 1.00 . A A . 10 AIB H 1 1
1 143 1 1 10 ABA N N 1.196 -1.249 -0.660 1.00 . A A . 10 AIB N 1 1
1 144 1 1 10 ABA O O 1.878 -4.447 -2.035 1.00 . A A . 10 AIB O 1 1
1 145 1 1 11 HYP C C 2.758 -5.744 0.812 1.00 . A A . 11 HYP C 1 1
1 146 1 1 11 HYP CA C 3.780 -4.956 -0.084 1.00 . A A . 11 HYP CA 1 1
1 147 1 1 11 HYP CB C 5.075 -4.615 0.676 1.00 . A A . 11 HYP CB 1 1
1 148 1 1 11 HYP CD C 3.913 -2.532 0.262 1.00 . A A . 11 HYP CD 1 1
1 149 1 1 11 HYP CG C 4.829 -3.228 1.277 1.00 . A A . 11 HYP CG 1 1
1 150 1 1 11 HYP HA H 4.037 -5.602 -0.945 1.00 . A A . 11 HYP HA 1 1
1 151 1 1 11 HYP HB2 H 5.334 -5.360 1.449 1.00 . A A . 11 HYP HB2 1 1
1 152 1 1 11 HYP HB3 H 5.930 -4.581 -0.030 1.00 . A A . 11 HYP HB3 1 1
1 153 1 1 11 HYP HD1 H 6.565 -3.054 2.080 1.00 . A A . 11 HYP HD1 1 1
1 154 1 1 11 HYP HD22 H 3.111 -2.008 0.803 1.00 . A A . 11 HYP HD22 1 1
1 155 1 1 11 HYP HD23 H 4.430 -1.780 -0.351 1.00 . A A . 11 HYP HD23 1 1
1 156 1 1 11 HYP HG H 4.300 -3.331 2.246 1.00 . A A . 11 HYP HG 1 1
1 157 1 1 11 HYP N N 3.359 -3.611 -0.581 1.00 . A A . 11 HYP N 1 1
1 158 1 1 11 HYP O O 2.900 -6.962 0.965 1.00 . A A . 11 HYP O 1 1
1 159 1 1 11 HYP OD1 O 6.046 -2.520 1.475 1.00 . A A . 11 HYP OD1 1 1
1 160 1 1 12 GLN C C -0.620 -6.072 1.089 1.00 . A A . 12 GLN C 1 1
1 161 1 1 12 GLN CA C 0.571 -5.665 2.029 1.00 . A A . 12 GLN CA 1 1
1 162 1 1 12 GLN CB C 0.085 -4.732 3.177 1.00 . A A . 12 GLN CB 1 1
1 163 1 1 12 GLN CD C 0.589 -3.421 5.347 1.00 . A A . 12 GLN CD 1 1
1 164 1 1 12 GLN CG C 1.125 -4.378 4.272 1.00 . A A . 12 GLN CG 1 1
1 165 1 1 12 GLN H H 1.723 -4.064 1.195 1.00 . A A . 12 GLN H 1 1
1 166 1 1 12 GLN HA H 0.952 -6.566 2.508 1.00 . A A . 12 GLN HA 1 1
1 167 1 1 12 GLN HB2 H -0.337 -3.804 2.743 1.00 . A A . 12 GLN HB2 1 1
1 168 1 1 12 GLN HB3 H -0.769 -5.214 3.689 1.00 . A A . 12 GLN HB3 1 1
1 169 1 1 12 GLN HE21 H 0.881 -4.803 6.769 1.00 . A A . 12 GLN HE21 1 1
1 170 1 1 12 GLN HE22 H 0.169 -3.195 7.294 1.00 . A A . 12 GLN HE22 1 1
1 171 1 1 12 GLN HG2 H 1.511 -5.315 4.720 1.00 . A A . 12 GLN HG2 1 1
1 172 1 1 12 GLN HG3 H 2.006 -3.894 3.810 1.00 . A A . 12 GLN HG3 1 1
1 173 1 1 12 GLN N N 1.735 -5.061 1.362 1.00 . A A . 12 GLN N 1 1
1 174 1 1 12 GLN NE2 N 0.520 -3.859 6.594 1.00 . A A . 12 GLN NE2 1 1
1 175 1 1 12 GLN O O -1.578 -6.621 1.629 1.00 . A A . 12 GLN O 1 1
1 176 1 1 12 GLN OE1 O 0.252 -2.269 5.071 1.00 . A A . 12 GLN OE1 1 1
1 177 1 1 13 ABA C C -1.247 -8.055 -1.431 1.00 . A A . 13 AIB C 1 1
1 178 1 1 13 ABA CA C -1.539 -6.493 -1.247 1.00 . A A . 13 AIB CA 1 1
1 179 1 1 13 ABA H H 0.284 -5.442 -0.608 1.00 . A A . 13 AIB H 1 1
1 180 1 1 13 ABA N N -0.604 -5.848 -0.259 1.00 . A A . 13 AIB N 1 1
1 181 1 1 13 ABA O O -2.204 -8.832 -1.330 1.00 . A A . 13 AIB O 1 1
1 182 1 1 14 HYP C C 0.124 -10.991 -0.648 1.00 . A A . 14 HYP C 1 1
1 183 1 1 14 HYP CA C 0.241 -10.057 -1.892 1.00 . A A . 14 HYP CA 1 1
1 184 1 1 14 HYP CB C 1.657 -10.089 -2.505 1.00 . A A . 14 HYP CB 1 1
1 185 1 1 14 HYP CD C 1.226 -7.812 -1.910 1.00 . A A . 14 HYP CD 1 1
1 186 1 1 14 HYP CG C 2.340 -8.853 -1.924 1.00 . A A . 14 HYP CG 1 1
1 187 1 1 14 HYP HA H -0.464 -10.431 -2.660 1.00 . A A . 14 HYP HA 1 1
1 188 1 1 14 HYP HB2 H 2.222 -11.016 -2.286 1.00 . A A . 14 HYP HB2 1 1
1 189 1 1 14 HYP HB3 H 1.595 -10.016 -3.606 1.00 . A A . 14 HYP HB3 1 1
1 190 1 1 14 HYP HD1 H 3.076 -8.130 -3.548 1.00 . A A . 14 HYP HD1 1 1
1 191 1 1 14 HYP HD22 H 1.424 -7.082 -1.116 1.00 . A A . 14 HYP HD22 1 1
1 192 1 1 14 HYP HD23 H 1.171 -7.246 -2.855 1.00 . A A . 14 HYP HD23 1 1
1 193 1 1 14 HYP HG H 2.654 -9.050 -0.877 1.00 . A A . 14 HYP HG 1 1
1 194 1 1 14 HYP N N -0.005 -8.598 -1.688 1.00 . A A . 14 HYP N 1 1
1 195 1 1 14 HYP O O -0.437 -12.079 -0.787 1.00 . A A . 14 HYP O 1 1
1 196 1 1 14 HYP OD1 O 3.444 -8.429 -2.714 1.00 . A A . 14 HYP OD1 1 1
1 197 1 1 15 ABA C C -0.939 -11.827 2.178 1.00 . A A . 15 AIB C 1 1
1 198 1 1 15 ABA CA C 0.548 -11.363 1.823 1.00 . A A . 15 AIB CA 1 1
1 199 1 1 15 ABA H H 1.080 -9.662 0.517 1.00 . A A . 15 AIB H 1 1
1 200 1 1 15 ABA N N 0.658 -10.597 0.538 1.00 . A A . 15 AIB N 1 1
1 201 1 1 15 ABA O O -1.131 -13.029 2.396 1.00 . A A . 15 AIB O 1 1
1 202 1 1 16 PRO C C -3.991 -12.091 0.892 1.00 . A A . 16 PRO C 1 1
1 203 1 1 16 PRO CA C -3.438 -11.488 2.228 1.00 . A A . 16 PRO CA 1 1
1 204 1 1 16 PRO CB C -4.212 -10.246 2.704 1.00 . A A . 16 PRO CB 1 1
1 205 1 1 16 PRO CD C -1.969 -9.527 2.110 1.00 . A A . 16 PRO CD 1 1
1 206 1 1 16 PRO CG C -3.424 -9.054 2.169 1.00 . A A . 16 PRO CG 1 1
1 207 1 1 16 PRO HA H -3.530 -12.266 3.013 1.00 . A A . 16 PRO HA 1 1
1 208 1 1 16 PRO HB2 H -5.269 -10.227 2.373 1.00 . A A . 16 PRO HB2 1 1
1 209 1 1 16 PRO HB3 H -4.229 -10.213 3.810 1.00 . A A . 16 PRO HB3 1 1
1 210 1 1 16 PRO HD2 H -1.493 -9.182 1.178 1.00 . A A . 16 PRO HD2 1 1
1 211 1 1 16 PRO HD3 H -1.380 -9.106 2.941 1.00 . A A . 16 PRO HD3 1 1
1 212 1 1 16 PRO HG2 H -3.775 -8.796 1.151 1.00 . A A . 16 PRO HG2 1 1
1 213 1 1 16 PRO HG3 H -3.552 -8.149 2.790 1.00 . A A . 16 PRO HG3 1 1
1 214 1 1 16 PRO N N -2.033 -10.996 2.181 1.00 . A A . 16 PRO N 1 1
1 215 1 1 16 PRO O O -4.631 -13.144 0.951 1.00 . A A . 16 PRO O 1 1
1 216 1 1 17 PHL C C -3.251 -12.476 -2.472 1.00 . A A . 17 PHL C 1 1
1 217 1 1 17 PHL CA C -4.363 -11.887 -1.573 1.00 . A A . 17 PHL CA 1 1
1 218 1 1 17 PHL CB C -5.095 -10.714 -2.287 1.00 . A A . 17 PHL CB 1 1
1 219 1 1 17 PHL CD1 C -7.559 -10.915 -1.654 1.00 . A A . 17 PHL CD1 1 1
1 220 1 1 17 PHL CD2 C -6.314 -9.024 -0.807 1.00 . A A . 17 PHL CD2 1 1
1 221 1 1 17 PHL CE1 C -8.689 -10.479 -0.966 1.00 . A A . 17 PHL CE1 1 1
1 222 1 1 17 PHL CE2 C -7.447 -8.590 -0.120 1.00 . A A . 17 PHL CE2 1 1
1 223 1 1 17 PHL CG C -6.360 -10.196 -1.572 1.00 . A A . 17 PHL CG 1 1
1 224 1 1 17 PHL CZ C -8.632 -9.316 -0.198 1.00 . A A . 17 PHL CZ 1 1
1 225 1 1 17 PHL H H -3.212 -10.583 -0.209 1.00 . A A . 17 PHL H 1 1
1 226 1 1 17 PHL HA H -5.110 -12.690 -1.417 1.00 . A A . 17 PHL HA 1 1
1 227 1 1 17 PHL HB2 H -4.388 -9.879 -2.469 1.00 . A A . 17 PHL HB2 1 1
1 228 1 1 17 PHL HB3 H -5.386 -11.036 -3.305 1.00 . A A . 17 PHL HB3 1 1
1 229 1 1 17 PHL HC1 H -2.458 -11.731 -2.666 1.00 . A A . 17 PHL HC1 1 1
1 230 1 1 17 PHL HC2 H -3.662 -12.750 -3.461 1.00 . A A . 17 PHL HC2 1 1
1 231 1 1 17 PHL HD1 H -7.616 -11.822 -2.237 1.00 . A A . 17 PHL HD1 1 1
1 232 1 1 17 PHL HD2 H -5.401 -8.455 -0.730 1.00 . A A . 17 PHL HD2 1 1
1 233 1 1 17 PHL HE1 H -9.608 -11.044 -1.022 1.00 . A A . 17 PHL HE1 1 1
1 234 1 1 17 PHL HE2 H -7.404 -7.692 0.478 1.00 . A A . 17 PHL HE2 1 1
1 235 1 1 17 PHL HO H -3.393 -14.275 -1.794 1.00 . A A . 17 PHL HO 1 1
1 236 1 1 17 PHL HZ H -9.507 -8.984 0.341 1.00 . A A . 17 PHL HZ 1 1
1 237 1 1 17 PHL N N -3.783 -11.438 -0.276 1.00 . A A . 17 PHL N 1 1
1 238 1 1 17 PHL O O -2.679 -13.643 -1.892 1.00 . A A . 17 PHL O 1 1
2 239 1 1 1 ACE C C -1.795 10.816 0.850 1.00 . A A . 1 ACE C 1 1
2 240 1 1 1 ACE CH3 C -1.136 12.186 0.774 1.00 . A A . 1 ACE CH3 1 1
2 241 1 1 1 ACE H1 H -0.755 12.373 -0.249 1.00 . A A . 1 ACE H1 1 1
2 242 1 1 1 ACE H2 H -1.845 12.994 1.027 1.00 . A A . 1 ACE H2 1 1
2 243 1 1 1 ACE H3 H -0.272 12.251 1.459 1.00 . A A . 1 ACE H3 1 1
2 244 1 1 1 ACE O O -1.297 9.907 1.519 1.00 . A A . 1 ACE O 1 1
2 245 1 1 2 TRP C C -2.563 8.426 -1.180 1.00 . A A . 2 TRP C 1 1
2 246 1 1 2 TRP CA C -3.455 9.344 -0.274 1.00 . A A . 2 TRP CA 1 1
2 247 1 1 2 TRP CB C -4.874 9.503 -0.892 1.00 . A A . 2 TRP CB 1 1
2 248 1 1 2 TRP CD1 C -6.511 9.562 1.164 1.00 . A A . 2 TRP CD1 1 1
2 249 1 1 2 TRP CD2 C -6.431 11.443 -0.026 1.00 . A A . 2 TRP CD2 1 1
2 250 1 1 2 TRP CE2 C -7.302 11.615 1.080 1.00 . A A . 2 TRP CE2 1 1
2 251 1 1 2 TRP CE3 C -6.190 12.516 -0.924 1.00 . A A . 2 TRP CE3 1 1
2 252 1 1 2 TRP CG C -5.925 10.155 0.025 1.00 . A A . 2 TRP CG 1 1
2 253 1 1 2 TRP CH2 C -7.689 13.905 0.402 1.00 . A A . 2 TRP CH2 1 1
2 254 1 1 2 TRP CZ2 C -7.934 12.864 1.299 1.00 . A A . 2 TRP CZ2 1 1
2 255 1 1 2 TRP CZ3 C -6.833 13.734 -0.694 1.00 . A A . 2 TRP CZ3 1 1
2 256 1 1 2 TRP H H -3.233 11.529 -0.358 1.00 . A A . 2 TRP H 1 1
2 257 1 1 2 TRP HA H -3.585 8.809 0.682 1.00 . A A . 2 TRP HA 1 1
2 258 1 1 2 TRP HB2 H -4.809 10.057 -1.848 1.00 . A A . 2 TRP HB2 1 1
2 259 1 1 2 TRP HB3 H -5.264 8.508 -1.179 1.00 . A A . 2 TRP HB3 1 1
2 260 1 1 2 TRP HD1 H -6.301 8.560 1.506 1.00 . A A . 2 TRP HD1 1 1
2 261 1 1 2 TRP HE1 H -7.890 10.294 2.703 1.00 . A A . 2 TRP HE1 1 1
2 262 1 1 2 TRP HE3 H -5.526 12.401 -1.766 1.00 . A A . 2 TRP HE3 1 1
2 263 1 1 2 TRP HH2 H -8.165 14.864 0.558 1.00 . A A . 2 TRP HH2 1 1
2 264 1 1 2 TRP HZ2 H -8.587 13.016 2.148 1.00 . A A . 2 TRP HZ2 1 1
2 265 1 1 2 TRP HZ3 H -6.662 14.559 -1.368 1.00 . A A . 2 TRP HZ3 1 1
2 266 1 1 2 TRP N N -2.875 10.673 0.070 1.00 . A A . 2 TRP N 1 1
2 267 1 1 2 TRP NE1 N -7.371 10.454 1.833 1.00 . A A . 2 TRP NE1 1 1
2 268 1 1 2 TRP O O -2.782 7.211 -1.196 1.00 . A A . 2 TRP O 1 1
2 269 1 1 3 ILE C C 0.347 7.269 -1.593 1.00 . A A . 3 ILE C 1 1
2 270 1 1 3 ILE CA C -0.493 8.152 -2.573 1.00 . A A . 3 ILE CA 1 1
2 271 1 1 3 ILE CB C 0.356 9.006 -3.592 1.00 . A A . 3 ILE CB 1 1
2 272 1 1 3 ILE CD1 C 0.162 10.687 -5.615 1.00 . A A . 3 ILE CD1 1 1
2 273 1 1 3 ILE CG1 C -0.526 9.653 -4.709 1.00 . A A . 3 ILE CG1 1 1
2 274 1 1 3 ILE CG2 C 1.512 8.198 -4.251 1.00 . A A . 3 ILE CG2 1 1
2 275 1 1 3 ILE H H -1.452 9.983 -1.795 1.00 . A A . 3 ILE H 1 1
2 276 1 1 3 ILE HA H -1.058 7.427 -3.167 1.00 . A A . 3 ILE HA 1 1
2 277 1 1 3 ILE HB H 0.826 9.823 -3.017 1.00 . A A . 3 ILE HB 1 1
2 278 1 1 3 ILE HD11 H 0.928 10.226 -6.263 1.00 . A A . 3 ILE HD11 1 1
2 279 1 1 3 ILE HD12 H -0.570 11.172 -6.285 1.00 . A A . 3 ILE HD12 1 1
2 280 1 1 3 ILE HD13 H 0.653 11.484 -5.028 1.00 . A A . 3 ILE HD13 1 1
2 281 1 1 3 ILE HG12 H -0.979 8.863 -5.338 1.00 . A A . 3 ILE HG12 1 1
2 282 1 1 3 ILE HG13 H -1.387 10.169 -4.246 1.00 . A A . 3 ILE HG13 1 1
2 283 1 1 3 ILE HG21 H 1.138 7.331 -4.829 1.00 . A A . 3 ILE HG21 1 1
2 284 1 1 3 ILE HG22 H 2.121 8.811 -4.939 1.00 . A A . 3 ILE HG22 1 1
2 285 1 1 3 ILE HG23 H 2.224 7.804 -3.503 1.00 . A A . 3 ILE HG23 1 1
2 286 1 1 3 ILE N N -1.540 8.966 -1.885 1.00 . A A . 3 ILE N 1 1
2 287 1 1 3 ILE O O 0.580 6.106 -1.922 1.00 . A A . 3 ILE O 1 1
2 288 1 1 4 GLN C C 0.625 6.065 1.487 1.00 . A A . 4 GLN C 1 1
2 289 1 1 4 GLN CA C 1.498 6.999 0.602 1.00 . A A . 4 GLN CA 1 1
2 290 1 1 4 GLN CB C 2.436 7.871 1.476 1.00 . A A . 4 GLN CB 1 1
2 291 1 1 4 GLN CD C 4.658 7.428 0.167 1.00 . A A . 4 GLN CD 1 1
2 292 1 1 4 GLN CG C 3.662 8.461 0.740 1.00 . A A . 4 GLN CG 1 1
2 293 1 1 4 GLN H H 0.475 8.755 -0.296 1.00 . A A . 4 GLN H 1 1
2 294 1 1 4 GLN HA H 2.159 6.313 0.050 1.00 . A A . 4 GLN HA 1 1
2 295 1 1 4 GLN HB2 H 1.858 8.691 1.946 1.00 . A A . 4 GLN HB2 1 1
2 296 1 1 4 GLN HB3 H 2.816 7.272 2.327 1.00 . A A . 4 GLN HB3 1 1
2 297 1 1 4 GLN HE21 H 4.483 8.219 -1.673 1.00 . A A . 4 GLN HE21 1 1
2 298 1 1 4 GLN HE22 H 5.610 6.786 -1.474 1.00 . A A . 4 GLN HE22 1 1
2 299 1 1 4 GLN HG2 H 3.301 9.145 -0.051 1.00 . A A . 4 GLN HG2 1 1
2 300 1 1 4 GLN HG3 H 4.213 9.099 1.451 1.00 . A A . 4 GLN HG3 1 1
2 301 1 1 4 GLN N N 0.784 7.795 -0.436 1.00 . A A . 4 GLN N 1 1
2 302 1 1 4 GLN NE2 N 4.948 7.488 -1.124 1.00 . A A . 4 GLN NE2 1 1
2 303 1 1 4 GLN O O 1.144 5.021 1.886 1.00 . A A . 4 GLN O 1 1
2 304 1 1 4 GLN OE1 O 5.171 6.566 0.878 1.00 . A A . 4 GLN OE1 1 1
2 305 1 1 5 . C C -1.655 4.048 1.230 1.00 . A A . 5 DIV C 1 1
2 306 1 1 5 . CA C -1.695 5.323 2.178 1.00 . A A . 5 DIV CA 1 1
2 307 1 1 5 . CB1 C -1.473 4.992 3.704 1.00 . A A . 5 DIV CB1 1 1
2 308 1 1 5 . CB2 C -3.076 6.029 2.044 1.00 . A A . 5 DIV CB2 1 1
2 309 1 1 5 . CG1 C -2.531 4.131 4.432 1.00 . A A . 5 DIV CG1 1 1
2 310 1 1 5 . H H -0.972 7.274 1.414 1.00 . A A . 5 DIV H 1 1
2 311 1 1 5 . HB11 H -0.494 4.491 3.829 1.00 . A A . 5 DIV HB11 1 1
2 312 1 1 5 . HB12 H -1.371 5.933 4.281 1.00 . A A . 5 DIV HB12 1 1
2 313 1 1 5 . HB21 H -3.296 6.348 1.012 1.00 . A A . 5 DIV HB21 1 1
2 314 1 1 5 . HB22 H -3.914 5.363 2.329 1.00 . A A . 5 DIV HB22 1 1
2 315 1 1 5 . HB23 H -3.159 6.930 2.683 1.00 . A A . 5 DIV HB23 1 1
2 316 1 1 5 . HG11 H -2.752 3.191 3.896 1.00 . A A . 5 DIV HG11 1 1
2 317 1 1 5 . HG12 H -2.193 3.852 5.448 1.00 . A A . 5 DIV HG12 1 1
2 318 1 1 5 . HG13 H -3.488 4.671 4.554 1.00 . A A . 5 DIV HG13 1 1
2 319 1 1 5 . N N -0.676 6.353 1.754 1.00 . A A . 5 DIV N 1 1
2 320 1 1 5 . O O -1.479 2.923 1.704 1.00 . A A . 5 DIV O 1 1
2 321 1 1 6 ILE C C -0.066 2.546 -1.114 1.00 . A A . 6 ILE C 1 1
2 322 1 1 6 ILE CA C -1.511 3.148 -1.118 1.00 . A A . 6 ILE CA 1 1
2 323 1 1 6 ILE CB C -2.040 3.564 -2.543 1.00 . A A . 6 ILE CB 1 1
2 324 1 1 6 ILE CD1 C -4.613 3.031 -2.181 1.00 . A A . 6 ILE CD1 1 1
2 325 1 1 6 ILE CG1 C -3.528 4.040 -2.602 1.00 . A A . 6 ILE CG1 1 1
2 326 1 1 6 ILE CG2 C -1.814 2.483 -3.635 1.00 . A A . 6 ILE CG2 1 1
2 327 1 1 6 ILE H H -1.955 5.173 -0.433 1.00 . A A . 6 ILE H 1 1
2 328 1 1 6 ILE HA H -2.164 2.335 -0.774 1.00 . A A . 6 ILE HA 1 1
2 329 1 1 6 ILE HB H -1.439 4.438 -2.860 1.00 . A A . 6 ILE HB 1 1
2 330 1 1 6 ILE HD11 H -4.490 2.701 -1.135 1.00 . A A . 6 ILE HD11 1 1
2 331 1 1 6 ILE HD12 H -5.621 3.481 -2.261 1.00 . A A . 6 ILE HD12 1 1
2 332 1 1 6 ILE HD13 H -4.608 2.128 -2.820 1.00 . A A . 6 ILE HD13 1 1
2 333 1 1 6 ILE HG12 H -3.651 4.944 -1.981 1.00 . A A . 6 ILE HG12 1 1
2 334 1 1 6 ILE HG13 H -3.761 4.389 -3.628 1.00 . A A . 6 ILE HG13 1 1
2 335 1 1 6 ILE HG21 H -2.304 1.526 -3.375 1.00 . A A . 6 ILE HG21 1 1
2 336 1 1 6 ILE HG22 H -2.199 2.797 -4.622 1.00 . A A . 6 ILE HG22 1 1
2 337 1 1 6 ILE HG23 H -0.741 2.265 -3.783 1.00 . A A . 6 ILE HG23 1 1
2 338 1 1 6 ILE N N -1.709 4.232 -0.118 1.00 . A A . 6 ILE N 1 1
2 339 1 1 6 ILE O O 0.032 1.329 -0.987 1.00 . A A . 6 ILE O 1 1
2 340 1 1 7 THR C C 2.931 1.994 -0.130 1.00 . A A . 7 THR C 1 1
2 341 1 1 7 THR CA C 2.425 2.807 -1.373 1.00 . A A . 7 THR CA 1 1
2 342 1 1 7 THR CB C 3.402 3.958 -1.787 1.00 . A A . 7 THR CB 1 1
2 343 1 1 7 THR CG2 C 4.835 3.506 -2.127 1.00 . A A . 7 THR CG2 1 1
2 344 1 1 7 THR H H 0.819 4.331 -1.345 1.00 . A A . 7 THR H 1 1
2 345 1 1 7 THR HA H 2.417 2.101 -2.227 1.00 . A A . 7 THR HA 1 1
2 346 1 1 7 THR HB H 3.464 4.689 -0.962 1.00 . A A . 7 THR HB 1 1
2 347 1 1 7 THR HG1 H 3.519 5.366 -3.096 1.00 . A A . 7 THR HG1 1 1
2 348 1 1 7 THR HG21 H 5.462 4.362 -2.443 1.00 . A A . 7 THR HG21 1 1
2 349 1 1 7 THR HG22 H 5.343 3.042 -1.261 1.00 . A A . 7 THR HG22 1 1
2 350 1 1 7 THR HG23 H 4.850 2.771 -2.954 1.00 . A A . 7 THR HG23 1 1
2 351 1 1 7 THR N N 1.024 3.331 -1.255 1.00 . A A . 7 THR N 1 1
2 352 1 1 7 THR O O 3.504 0.920 -0.312 1.00 . A A . 7 THR O 1 1
2 353 1 1 7 THR OG1 O 2.916 4.636 -2.942 1.00 . A A . 7 THR OG1 1 1
2 354 1 1 8 ABA C C 1.969 0.361 2.437 1.00 . A A . 8 AIB C 1 1
2 355 1 1 8 ABA CA C 2.828 1.688 2.377 1.00 . A A . 8 AIB CA 1 1
2 356 1 1 8 ABA H H 2.099 3.314 1.066 1.00 . A A . 8 AIB H 1 1
2 357 1 1 8 ABA N N 2.688 2.479 1.107 1.00 . A A . 8 AIB N 1 1
2 358 1 1 8 ABA O O 2.412 -0.645 3.002 1.00 . A A . 8 AIB O 1 1
2 359 1 1 9 LEU C C 0.379 -1.723 0.385 1.00 . A A . 9 LEU C 1 1
2 360 1 1 9 LEU CA C -0.045 -0.873 1.626 1.00 . A A . 9 LEU CA 1 1
2 361 1 1 9 LEU CB C -1.548 -0.490 1.515 1.00 . A A . 9 LEU CB 1 1
2 362 1 1 9 LEU CD1 C -3.708 0.423 2.485 1.00 . A A . 9 LEU CD1 1 1
2 363 1 1 9 LEU CD2 C -2.446 -1.310 3.804 1.00 . A A . 9 LEU CD2 1 1
2 364 1 1 9 LEU CG C -2.308 -0.125 2.824 1.00 . A A . 9 LEU CG 1 1
2 365 1 1 9 LEU H H 0.492 1.175 1.304 1.00 . A A . 9 LEU H 1 1
2 366 1 1 9 LEU HA H 0.075 -1.521 2.506 1.00 . A A . 9 LEU HA 1 1
2 367 1 1 9 LEU HB2 H -1.655 0.336 0.784 1.00 . A A . 9 LEU HB2 1 1
2 368 1 1 9 LEU HB3 H -2.094 -1.317 1.035 1.00 . A A . 9 LEU HB3 1 1
2 369 1 1 9 LEU HD11 H -4.332 -0.332 1.968 1.00 . A A . 9 LEU HD11 1 1
2 370 1 1 9 LEU HD12 H -4.254 0.737 3.392 1.00 . A A . 9 LEU HD12 1 1
2 371 1 1 9 LEU HD13 H -3.653 1.308 1.825 1.00 . A A . 9 LEU HD13 1 1
2 372 1 1 9 LEU HD21 H -1.467 -1.649 4.189 1.00 . A A . 9 LEU HD21 1 1
2 373 1 1 9 LEU HD22 H -3.049 -1.038 4.691 1.00 . A A . 9 LEU HD22 1 1
2 374 1 1 9 LEU HD23 H -2.935 -2.183 3.333 1.00 . A A . 9 LEU HD23 1 1
2 375 1 1 9 LEU HG H -1.754 0.681 3.343 1.00 . A A . 9 LEU HG 1 1
2 376 1 1 9 LEU N N 0.742 0.354 1.860 1.00 . A A . 9 LEU N 1 1
2 377 1 1 9 LEU O O -0.060 -2.873 0.331 1.00 . A A . 9 LEU O 1 1
2 378 1 1 10 ABA C C 2.322 -3.426 -1.448 1.00 . A A . 10 AIB C 1 1
2 379 1 1 10 ABA CA C 1.651 -2.015 -1.790 1.00 . A A . 10 AIB CA 1 1
2 380 1 1 10 ABA H H 1.520 -0.264 -0.414 1.00 . A A . 10 AIB H 1 1
2 381 1 1 10 ABA N N 1.188 -1.229 -0.594 1.00 . A A . 10 AIB N 1 1
2 382 1 1 10 ABA O O 1.876 -4.428 -2.024 1.00 . A A . 10 AIB O 1 1
2 383 1 1 11 HYP C C 2.734 -5.773 0.824 1.00 . A A . 11 HYP C 1 1
2 384 1 1 11 HYP CA C 3.756 -4.958 -0.046 1.00 . A A . 11 HYP CA 1 1
2 385 1 1 11 HYP CB C 5.044 -4.626 0.732 1.00 . A A . 11 HYP CB 1 1
2 386 1 1 11 HYP CD C 3.897 -2.536 0.313 1.00 . A A . 11 HYP CD 1 1
2 387 1 1 11 HYP CG C 4.796 -3.242 1.334 1.00 . A A . 11 HYP CG 1 1
2 388 1 1 11 HYP HA H 4.025 -5.585 -0.917 1.00 . A A . 11 HYP HA 1 1
2 389 1 1 11 HYP HB2 H 5.292 -5.377 1.508 1.00 . A A . 11 HYP HB2 1 1
2 390 1 1 11 HYP HB3 H 5.907 -4.592 0.038 1.00 . A A . 11 HYP HB3 1 1
2 391 1 1 11 HYP HD1 H 6.550 -3.108 2.103 1.00 . A A . 11 HYP HD1 1 1
2 392 1 1 11 HYP HD22 H 3.109 -1.989 0.847 1.00 . A A . 11 HYP HD22 1 1
2 393 1 1 11 HYP HD23 H 4.430 -1.802 -0.307 1.00 . A A . 11 HYP HD23 1 1
2 394 1 1 11 HYP HG H 4.253 -3.350 2.294 1.00 . A A . 11 HYP HG 1 1
2 395 1 1 11 HYP N N 3.327 -3.608 -0.526 1.00 . A A . 11 HYP N 1 1
2 396 1 1 11 HYP O O 2.881 -6.993 0.941 1.00 . A A . 11 HYP O 1 1
2 397 1 1 11 HYP OD1 O 6.010 -2.539 1.548 1.00 . A A . 11 HYP OD1 1 1
2 398 1 1 12 GLN C C -0.684 -6.019 1.042 1.00 . A A . 12 GLN C 1 1
2 399 1 1 12 GLN CA C 0.526 -5.738 2.005 1.00 . A A . 12 GLN CA 1 1
2 400 1 1 12 GLN CB C 0.104 -4.883 3.237 1.00 . A A . 12 GLN CB 1 1
2 401 1 1 12 GLN CD C 0.674 -3.938 5.574 1.00 . A A . 12 GLN CD 1 1
2 402 1 1 12 GLN CG C 1.076 -4.906 4.444 1.00 . A A . 12 GLN CG 1 1
2 403 1 1 12 GLN H H 1.679 -4.113 1.237 1.00 . A A . 12 GLN H 1 1
2 404 1 1 12 GLN HA H 0.867 -6.695 2.390 1.00 . A A . 12 GLN HA 1 1
2 405 1 1 12 GLN HB2 H -0.080 -3.839 2.919 1.00 . A A . 12 GLN HB2 1 1
2 406 1 1 12 GLN HB3 H -0.875 -5.233 3.616 1.00 . A A . 12 GLN HB3 1 1
2 407 1 1 12 GLN HE21 H 2.567 -3.299 5.723 1.00 . A A . 12 GLN HE21 1 1
2 408 1 1 12 GLN HE22 H 1.338 -2.552 6.862 1.00 . A A . 12 GLN HE22 1 1
2 409 1 1 12 GLN HG2 H 1.118 -5.928 4.862 1.00 . A A . 12 GLN HG2 1 1
2 410 1 1 12 GLN HG3 H 2.106 -4.694 4.096 1.00 . A A . 12 GLN HG3 1 1
2 411 1 1 12 GLN N N 1.706 -5.111 1.393 1.00 . A A . 12 GLN N 1 1
2 412 1 1 12 GLN NE2 N 1.621 -3.176 6.099 1.00 . A A . 12 GLN NE2 1 1
2 413 1 1 12 GLN O O -1.714 -6.441 1.562 1.00 . A A . 12 GLN O 1 1
2 414 1 1 12 GLN OE1 O -0.480 -3.872 5.997 1.00 . A A . 12 GLN OE1 1 1
2 415 1 1 13 ABA C C -1.239 -8.040 -1.478 1.00 . A A . 13 AIB C 1 1
2 416 1 1 13 ABA CA C -1.528 -6.473 -1.317 1.00 . A A . 13 AIB CA 1 1
2 417 1 1 13 ABA H H 0.309 -5.476 -0.629 1.00 . A A . 13 AIB H 1 1
2 418 1 1 13 ABA N N -0.607 -5.836 -0.308 1.00 . A A . 13 AIB N 1 1
2 419 1 1 13 ABA O O -2.199 -8.811 -1.361 1.00 . A A . 13 AIB O 1 1
2 420 1 1 14 HYP C C 0.082 -10.969 -0.682 1.00 . A A . 14 HYP C 1 1
2 421 1 1 14 HYP CA C 0.250 -10.049 -1.930 1.00 . A A . 14 HYP CA 1 1
2 422 1 1 14 HYP CB C 1.681 -10.092 -2.510 1.00 . A A . 14 HYP CB 1 1
2 423 1 1 14 HYP CD C 1.243 -7.810 -1.936 1.00 . A A . 14 HYP CD 1 1
2 424 1 1 14 HYP CG C 2.355 -8.853 -1.926 1.00 . A A . 14 HYP CG 1 1
2 425 1 1 14 HYP HA H -0.431 -10.421 -2.718 1.00 . A A . 14 HYP HA 1 1
2 426 1 1 14 HYP HB2 H 2.234 -11.020 -2.269 1.00 . A A . 14 HYP HB2 1 1
2 427 1 1 14 HYP HB3 H 1.642 -10.028 -3.614 1.00 . A A . 14 HYP HB3 1 1
2 428 1 1 14 HYP HD1 H 3.115 -8.118 -3.531 1.00 . A A . 14 HYP HD1 1 1
2 429 1 1 14 HYP HD22 H 1.425 -7.076 -1.141 1.00 . A A . 14 HYP HD22 1 1
2 430 1 1 14 HYP HD23 H 1.213 -7.253 -2.886 1.00 . A A . 14 HYP HD23 1 1
2 431 1 1 14 HYP HG H 2.659 -9.049 -0.874 1.00 . A A . 14 HYP HG 1 1
2 432 1 1 14 HYP N N 0.003 -8.588 -1.734 1.00 . A A . 14 HYP N 1 1
2 433 1 1 14 HYP O O -0.562 -12.014 -0.808 1.00 . A A . 14 HYP O 1 1
2 434 1 1 14 HYP OD1 O 3.473 -8.435 -2.698 1.00 . A A . 14 HYP OD1 1 1
2 435 1 1 15 ABA C C -0.967 -11.757 2.152 1.00 . A A . 15 AIB C 1 1
2 436 1 1 15 ABA CA C 0.529 -11.340 1.787 1.00 . A A . 15 AIB CA 1 1
2 437 1 1 15 ABA H H 1.136 -9.691 0.450 1.00 . A A . 15 AIB H 1 1
2 438 1 1 15 ABA N N 0.658 -10.598 0.491 1.00 . A A . 15 AIB N 1 1
2 439 1 1 15 ABA O O -1.191 -12.951 2.388 1.00 . A A . 15 AIB O 1 1
2 440 1 1 16 PRO C C -4.076 -11.965 0.941 1.00 . A A . 16 PRO C 1 1
2 441 1 1 16 PRO CA C -3.451 -11.351 2.236 1.00 . A A . 16 PRO CA 1 1
2 442 1 1 16 PRO CB C -4.181 -10.080 2.706 1.00 . A A . 16 PRO CB 1 1
2 443 1 1 16 PRO CD C -1.931 -9.426 2.087 1.00 . A A . 16 PRO CD 1 1
2 444 1 1 16 PRO CG C -3.378 -8.927 2.117 1.00 . A A . 16 PRO CG 1 1
2 445 1 1 16 PRO HA H -3.538 -12.108 3.041 1.00 . A A . 16 PRO HA 1 1
2 446 1 1 16 PRO HB2 H -5.247 -10.043 2.409 1.00 . A A . 16 PRO HB2 1 1
2 447 1 1 16 PRO HB3 H -4.163 -10.022 3.812 1.00 . A A . 16 PRO HB3 1 1
2 448 1 1 16 PRO HD2 H -1.418 -9.076 1.178 1.00 . A A . 16 PRO HD2 1 1
2 449 1 1 16 PRO HD3 H -1.362 -9.033 2.947 1.00 . A A . 16 PRO HD3 1 1
2 450 1 1 16 PRO HG2 H -3.723 -8.715 1.086 1.00 . A A . 16 PRO HG2 1 1
2 451 1 1 16 PRO HG3 H -3.498 -7.995 2.697 1.00 . A A . 16 PRO HG3 1 1
2 452 1 1 16 PRO N N -2.037 -10.895 2.143 1.00 . A A . 16 PRO N 1 1
2 453 1 1 16 PRO O O -4.830 -12.933 1.079 1.00 . A A . 16 PRO O 1 1
2 454 1 1 17 PHL C C -3.566 -12.165 -2.626 1.00 . A A . 17 PHL C 1 1
2 455 1 1 17 PHL CA C -4.566 -11.816 -1.501 1.00 . A A . 17 PHL CA 1 1
2 456 1 1 17 PHL CB C -5.602 -10.736 -1.936 1.00 . A A . 17 PHL CB 1 1
2 457 1 1 17 PHL CD1 C -7.733 -11.440 -0.717 1.00 . A A . 17 PHL CD1 1 1
2 458 1 1 17 PHL CD2 C -6.782 -9.281 -0.197 1.00 . A A . 17 PHL CD2 1 1
2 459 1 1 17 PHL CE1 C -8.734 -11.227 0.227 1.00 . A A . 17 PHL CE1 1 1
2 460 1 1 17 PHL CE2 C -7.785 -9.068 0.745 1.00 . A A . 17 PHL CE2 1 1
2 461 1 1 17 PHL CG C -6.746 -10.473 -0.934 1.00 . A A . 17 PHL CG 1 1
2 462 1 1 17 PHL CZ C -8.761 -10.038 0.955 1.00 . A A . 17 PHL CZ 1 1
2 463 1 1 17 PHL H H -3.202 -10.592 -0.276 1.00 . A A . 17 PHL H 1 1
2 464 1 1 17 PHL HA H -5.129 -12.753 -1.322 1.00 . A A . 17 PHL HA 1 1
2 465 1 1 17 PHL HB2 H -5.073 -9.792 -2.171 1.00 . A A . 17 PHL HB2 1 1
2 466 1 1 17 PHL HB3 H -6.054 -11.037 -2.901 1.00 . A A . 17 PHL HB3 1 1
2 467 1 1 17 PHL HC1 H -4.101 -12.646 -3.465 1.00 . A A . 17 PHL HC1 1 1
2 468 1 1 17 PHL HC2 H -2.831 -12.915 -2.279 1.00 . A A . 17 PHL HC2 1 1
2 469 1 1 17 PHL HD1 H -7.718 -12.372 -1.265 1.00 . A A . 17 PHL HD1 1 1
2 470 1 1 17 PHL HD2 H -6.023 -8.525 -0.337 1.00 . A A . 17 PHL HD2 1 1
2 471 1 1 17 PHL HE1 H -9.484 -11.985 0.402 1.00 . A A . 17 PHL HE1 1 1
2 472 1 1 17 PHL HE2 H -7.802 -8.153 1.319 1.00 . A A . 17 PHL HE2 1 1
2 473 1 1 17 PHL HO H -2.390 -10.663 -2.375 1.00 . A A . 17 PHL HO 1 1
2 474 1 1 17 PHL HZ H -9.539 -9.874 1.688 1.00 . A A . 17 PHL HZ 1 1
2 475 1 1 17 PHL N N -3.833 -11.406 -0.271 1.00 . A A . 17 PHL N 1 1
2 476 1 1 17 PHL O O -2.875 -11.022 -3.120 1.00 . A A . 17 PHL O 1 1
3 477 1 1 1 ACE C C -1.935 10.913 0.811 1.00 . A A . 1 ACE C 1 1
3 478 1 1 1 ACE CH3 C -1.272 12.280 0.746 1.00 . A A . 1 ACE CH3 1 1
3 479 1 1 1 ACE H1 H -0.838 12.452 -0.259 1.00 . A A . 1 ACE H1 1 1
3 480 1 1 1 ACE H2 H -1.988 13.092 0.957 1.00 . A A . 1 ACE H2 1 1
3 481 1 1 1 ACE H3 H -0.444 12.348 1.472 1.00 . A A . 1 ACE H3 1 1
3 482 1 1 1 ACE O O -1.481 10.029 1.543 1.00 . A A . 1 ACE O 1 1
3 483 1 1 2 TRP C C -2.513 8.436 -1.155 1.00 . A A . 2 TRP C 1 1
3 484 1 1 2 TRP CA C -3.489 9.385 -0.378 1.00 . A A . 2 TRP CA 1 1
3 485 1 1 2 TRP CB C -4.898 9.486 -1.032 1.00 . A A . 2 TRP CB 1 1
3 486 1 1 2 TRP CD1 C -5.038 9.017 -3.607 1.00 . A A . 2 TRP CD1 1 1
3 487 1 1 2 TRP CD2 C -5.031 11.175 -3.063 1.00 . A A . 2 TRP CD2 1 1
3 488 1 1 2 TRP CE2 C -5.101 11.038 -4.473 1.00 . A A . 2 TRP CE2 1 1
3 489 1 1 2 TRP CE3 C -5.018 12.463 -2.469 1.00 . A A . 2 TRP CE3 1 1
3 490 1 1 2 TRP CG C -4.983 9.905 -2.511 1.00 . A A . 2 TRP CG 1 1
3 491 1 1 2 TRP CH2 C -5.133 13.447 -4.694 1.00 . A A . 2 TRP CH2 1 1
3 492 1 1 2 TRP CZ2 C -5.153 12.189 -5.297 1.00 . A A . 2 TRP CZ2 1 1
3 493 1 1 2 TRP CZ3 C -5.067 13.582 -3.302 1.00 . A A . 2 TRP CZ3 1 1
3 494 1 1 2 TRP H H -3.275 11.566 -0.538 1.00 . A A . 2 TRP H 1 1
3 495 1 1 2 TRP HA H -3.673 8.898 0.594 1.00 . A A . 2 TRP HA 1 1
3 496 1 1 2 TRP HB2 H -5.392 8.500 -0.927 1.00 . A A . 2 TRP HB2 1 1
3 497 1 1 2 TRP HB3 H -5.543 10.154 -0.430 1.00 . A A . 2 TRP HB3 1 1
3 498 1 1 2 TRP HD1 H -5.027 7.940 -3.523 1.00 . A A . 2 TRP HD1 1 1
3 499 1 1 2 TRP HE1 H -5.155 9.301 -5.778 1.00 . A A . 2 TRP HE1 1 1
3 500 1 1 2 TRP HE3 H -4.973 12.582 -1.395 1.00 . A A . 2 TRP HE3 1 1
3 501 1 1 2 TRP HH2 H -5.165 14.331 -5.312 1.00 . A A . 2 TRP HH2 1 1
3 502 1 1 2 TRP HZ2 H -5.204 12.098 -6.374 1.00 . A A . 2 TRP HZ2 1 1
3 503 1 1 2 TRP HZ3 H -5.054 14.569 -2.865 1.00 . A A . 2 TRP HZ3 1 1
3 504 1 1 2 TRP N N -2.963 10.734 -0.034 1.00 . A A . 2 TRP N 1 1
3 505 1 1 2 TRP NE1 N -5.107 9.701 -4.835 1.00 . A A . 2 TRP NE1 1 1
3 506 1 1 2 TRP O O -2.717 7.220 -1.117 1.00 . A A . 2 TRP O 1 1
3 507 1 1 3 ILE C C 0.486 7.287 -1.496 1.00 . A A . 3 ILE C 1 1
3 508 1 1 3 ILE CA C -0.405 8.123 -2.466 1.00 . A A . 3 ILE CA 1 1
3 509 1 1 3 ILE CB C 0.374 8.901 -3.583 1.00 . A A . 3 ILE CB 1 1
3 510 1 1 3 ILE CD1 C 0.441 6.893 -5.280 1.00 . A A . 3 ILE CD1 1 1
3 511 1 1 3 ILE CG1 C 1.210 8.008 -4.551 1.00 . A A . 3 ILE CG1 1 1
3 512 1 1 3 ILE CG2 C 1.278 10.037 -3.043 1.00 . A A . 3 ILE CG2 1 1
3 513 1 1 3 ILE H H -1.393 9.983 -1.803 1.00 . A A . 3 ILE H 1 1
3 514 1 1 3 ILE HA H -0.998 7.372 -3.003 1.00 . A A . 3 ILE HA 1 1
3 515 1 1 3 ILE HB H -0.387 9.394 -4.218 1.00 . A A . 3 ILE HB 1 1
3 516 1 1 3 ILE HD11 H -0.440 7.285 -5.820 1.00 . A A . 3 ILE HD11 1 1
3 517 1 1 3 ILE HD12 H 1.084 6.387 -6.023 1.00 . A A . 3 ILE HD12 1 1
3 518 1 1 3 ILE HD13 H 0.086 6.114 -4.580 1.00 . A A . 3 ILE HD13 1 1
3 519 1 1 3 ILE HG12 H 1.672 8.651 -5.325 1.00 . A A . 3 ILE HG12 1 1
3 520 1 1 3 ILE HG13 H 2.065 7.553 -4.014 1.00 . A A . 3 ILE HG13 1 1
3 521 1 1 3 ILE HG21 H 2.119 9.650 -2.436 1.00 . A A . 3 ILE HG21 1 1
3 522 1 1 3 ILE HG22 H 1.716 10.631 -3.867 1.00 . A A . 3 ILE HG22 1 1
3 523 1 1 3 ILE HG23 H 0.715 10.744 -2.407 1.00 . A A . 3 ILE HG23 1 1
3 524 1 1 3 ILE N N -1.464 8.960 -1.835 1.00 . A A . 3 ILE N 1 1
3 525 1 1 3 ILE O O 0.867 6.180 -1.876 1.00 . A A . 3 ILE O 1 1
3 526 1 1 4 GLN C C 0.593 5.978 1.556 1.00 . A A . 4 GLN C 1 1
3 527 1 1 4 GLN CA C 1.488 6.971 0.765 1.00 . A A . 4 GLN CA 1 1
3 528 1 1 4 GLN CB C 2.318 7.843 1.740 1.00 . A A . 4 GLN CB 1 1
3 529 1 1 4 GLN CD C 4.628 7.750 0.472 1.00 . A A . 4 GLN CD 1 1
3 530 1 1 4 GLN CG C 3.504 8.601 1.099 1.00 . A A . 4 GLN CG 1 1
3 531 1 1 4 GLN H H 0.371 8.682 -0.077 1.00 . A A . 4 GLN H 1 1
3 532 1 1 4 GLN HA H 2.216 6.340 0.231 1.00 . A A . 4 GLN HA 1 1
3 533 1 1 4 GLN HB2 H 1.654 8.566 2.252 1.00 . A A . 4 GLN HB2 1 1
3 534 1 1 4 GLN HB3 H 2.727 7.207 2.549 1.00 . A A . 4 GLN HB3 1 1
3 535 1 1 4 GLN HE21 H 5.061 9.260 -0.775 1.00 . A A . 4 GLN HE21 1 1
3 536 1 1 4 GLN HE22 H 6.057 7.727 -0.937 1.00 . A A . 4 GLN HE22 1 1
3 537 1 1 4 GLN HG2 H 3.090 9.294 0.345 1.00 . A A . 4 GLN HG2 1 1
3 538 1 1 4 GLN HG3 H 3.958 9.233 1.879 1.00 . A A . 4 GLN HG3 1 1
3 539 1 1 4 GLN N N 0.792 7.774 -0.278 1.00 . A A . 4 GLN N 1 1
3 540 1 1 4 GLN NE2 N 5.316 8.299 -0.516 1.00 . A A . 4 GLN NE2 1 1
3 541 1 1 4 GLN O O 1.092 4.900 1.877 1.00 . A A . 4 GLN O 1 1
3 542 1 1 4 GLN OE1 O 4.896 6.615 0.865 1.00 . A A . 4 GLN OE1 1 1
3 543 1 1 5 . C C -1.699 3.980 1.234 1.00 . A A . 5 DIV C 1 1
3 544 1 1 5 . CA C -1.731 5.228 2.220 1.00 . A A . 5 DIV CA 1 1
3 545 1 1 5 . CB1 C -1.507 4.859 3.737 1.00 . A A . 5 DIV CB1 1 1
3 546 1 1 5 . CB2 C -3.103 5.954 2.100 1.00 . A A . 5 DIV CB2 1 1
3 547 1 1 5 . CG1 C -2.561 3.988 4.456 1.00 . A A . 5 DIV CG1 1 1
3 548 1 1 5 . H H -0.990 7.198 1.514 1.00 . A A . 5 DIV H 1 1
3 549 1 1 5 . HB11 H -0.531 4.351 3.846 1.00 . A A . 5 DIV HB11 1 1
3 550 1 1 5 . HB12 H -1.397 5.785 4.334 1.00 . A A . 5 DIV HB12 1 1
3 551 1 1 5 . HB21 H -3.316 6.302 1.075 1.00 . A A . 5 DIV HB21 1 1
3 552 1 1 5 . HB22 H -3.948 5.294 2.371 1.00 . A A . 5 DIV HB22 1 1
3 553 1 1 5 . HB23 H -3.174 6.841 2.759 1.00 . A A . 5 DIV HB23 1 1
3 554 1 1 5 . HG11 H -2.801 3.067 3.901 1.00 . A A . 5 DIV HG11 1 1
3 555 1 1 5 . HG12 H -2.207 3.680 5.455 1.00 . A A . 5 DIV HG12 1 1
3 556 1 1 5 . HG13 H -3.507 4.538 4.610 1.00 . A A . 5 DIV HG13 1 1
3 557 1 1 5 . N N -0.705 6.264 1.830 1.00 . A A . 5 DIV N 1 1
3 558 1 1 5 . O O -1.552 2.839 1.679 1.00 . A A . 5 DIV O 1 1
3 559 1 1 6 ILE C C -0.094 2.546 -1.164 1.00 . A A . 6 ILE C 1 1
3 560 1 1 6 ILE CA C -1.539 3.151 -1.142 1.00 . A A . 6 ILE CA 1 1
3 561 1 1 6 ILE CB C -2.078 3.615 -2.550 1.00 . A A . 6 ILE CB 1 1
3 562 1 1 6 ILE CD1 C -4.659 3.137 -2.135 1.00 . A A . 6 ILE CD1 1 1
3 563 1 1 6 ILE CG1 C -3.559 4.119 -2.583 1.00 . A A . 6 ILE CG1 1 1
3 564 1 1 6 ILE CG2 C -1.881 2.556 -3.668 1.00 . A A . 6 ILE CG2 1 1
3 565 1 1 6 ILE H H -1.974 5.154 -0.388 1.00 . A A . 6 ILE H 1 1
3 566 1 1 6 ILE HA H -2.194 2.330 -0.824 1.00 . A A . 6 ILE HA 1 1
3 567 1 1 6 ILE HB H -1.463 4.486 -2.855 1.00 . A A . 6 ILE HB 1 1
3 568 1 1 6 ILE HD11 H -4.539 2.834 -1.079 1.00 . A A . 6 ILE HD11 1 1
3 569 1 1 6 ILE HD12 H -5.660 3.599 -2.227 1.00 . A A . 6 ILE HD12 1 1
3 570 1 1 6 ILE HD13 H -4.669 2.217 -2.746 1.00 . A A . 6 ILE HD13 1 1
3 571 1 1 6 ILE HG12 H -3.648 5.026 -1.959 1.00 . A A . 6 ILE HG12 1 1
3 572 1 1 6 ILE HG13 H -3.803 4.474 -3.603 1.00 . A A . 6 ILE HG13 1 1
3 573 1 1 6 ILE HG21 H -2.386 1.601 -3.429 1.00 . A A . 6 ILE HG21 1 1
3 574 1 1 6 ILE HG22 H -2.264 2.900 -4.645 1.00 . A A . 6 ILE HG22 1 1
3 575 1 1 6 ILE HG23 H -0.813 2.323 -3.827 1.00 . A A . 6 ILE HG23 1 1
3 576 1 1 6 ILE N N -1.726 4.204 -0.108 1.00 . A A . 6 ILE N 1 1
3 577 1 1 6 ILE O O 0.004 1.327 -1.054 1.00 . A A . 6 ILE O 1 1
3 578 1 1 7 THR C C 2.932 2.009 -0.211 1.00 . A A . 7 THR C 1 1
3 579 1 1 7 THR CA C 2.394 2.791 -1.461 1.00 . A A . 7 THR CA 1 1
3 580 1 1 7 THR CB C 3.359 3.918 -1.950 1.00 . A A . 7 THR CB 1 1
3 581 1 1 7 THR CG2 C 4.802 3.465 -2.255 1.00 . A A . 7 THR CG2 1 1
3 582 1 1 7 THR H H 0.798 4.331 -1.402 1.00 . A A . 7 THR H 1 1
3 583 1 1 7 THR HA H 2.359 2.055 -2.287 1.00 . A A . 7 THR HA 1 1
3 584 1 1 7 THR HB H 3.407 4.713 -1.183 1.00 . A A . 7 THR HB 1 1
3 585 1 1 7 THR HG1 H 3.502 5.168 -3.408 1.00 . A A . 7 THR HG1 1 1
3 586 1 1 7 THR HG21 H 5.411 4.302 -2.645 1.00 . A A . 7 THR HG21 1 1
3 587 1 1 7 THR HG22 H 5.317 3.088 -1.351 1.00 . A A . 7 THR HG22 1 1
3 588 1 1 7 THR HG23 H 4.827 2.660 -3.013 1.00 . A A . 7 THR HG23 1 1
3 589 1 1 7 THR N N 0.997 3.327 -1.322 1.00 . A A . 7 THR N 1 1
3 590 1 1 7 THR O O 3.526 0.943 -0.390 1.00 . A A . 7 THR O 1 1
3 591 1 1 7 THR OG1 O 2.865 4.495 -3.156 1.00 . A A . 7 THR OG1 1 1
3 592 1 1 8 ABA C C 1.977 0.394 2.370 1.00 . A A . 8 AIB C 1 1
3 593 1 1 8 ABA CA C 2.856 1.709 2.300 1.00 . A A . 8 AIB CA 1 1
3 594 1 1 8 ABA H H 2.132 3.352 0.994 1.00 . A A . 8 AIB H 1 1
3 595 1 1 8 ABA N N 2.701 2.499 1.028 1.00 . A A . 8 AIB N 1 1
3 596 1 1 8 ABA O O 2.416 -0.612 2.941 1.00 . A A . 8 AIB O 1 1
3 597 1 1 9 LEU C C 0.401 -1.701 0.340 1.00 . A A . 9 LEU C 1 1
3 598 1 1 9 LEU CA C -0.043 -0.840 1.565 1.00 . A A . 9 LEU CA 1 1
3 599 1 1 9 LEU CB C -1.548 -0.471 1.408 1.00 . A A . 9 LEU CB 1 1
3 600 1 1 9 LEU CD1 C -3.780 0.326 2.298 1.00 . A A . 9 LEU CD1 1 1
3 601 1 1 9 LEU CD2 C -2.514 -1.381 3.638 1.00 . A A . 9 LEU CD2 1 1
3 602 1 1 9 LEU CG C -2.373 -0.168 2.692 1.00 . A A . 9 LEU CG 1 1
3 603 1 1 9 LEU H H 0.493 1.206 1.237 1.00 . A A . 9 LEU H 1 1
3 604 1 1 9 LEU HA H 0.063 -1.476 2.455 1.00 . A A . 9 LEU HA 1 1
3 605 1 1 9 LEU HB2 H -1.635 0.381 0.707 1.00 . A A . 9 LEU HB2 1 1
3 606 1 1 9 LEU HB3 H -2.067 -1.282 0.872 1.00 . A A . 9 LEU HB3 1 1
3 607 1 1 9 LEU HD11 H -4.354 -0.451 1.758 1.00 . A A . 9 LEU HD11 1 1
3 608 1 1 9 LEU HD12 H -4.374 0.618 3.184 1.00 . A A . 9 LEU HD12 1 1
3 609 1 1 9 LEU HD13 H -3.736 1.213 1.639 1.00 . A A . 9 LEU HD13 1 1
3 610 1 1 9 LEU HD21 H -1.543 -1.692 4.062 1.00 . A A . 9 LEU HD21 1 1
3 611 1 1 9 LEU HD22 H -3.171 -1.149 4.498 1.00 . A A . 9 LEU HD22 1 1
3 612 1 1 9 LEU HD23 H -2.948 -2.258 3.124 1.00 . A A . 9 LEU HD23 1 1
3 613 1 1 9 LEU HG H -1.873 0.645 3.250 1.00 . A A . 9 LEU HG 1 1
3 614 1 1 9 LEU N N 0.743 0.391 1.803 1.00 . A A . 9 LEU N 1 1
3 615 1 1 9 LEU O O -0.038 -2.851 0.288 1.00 . A A . 9 LEU O 1 1
3 616 1 1 10 ABA C C 2.325 -3.428 -1.487 1.00 . A A . 10 AIB C 1 1
3 617 1 1 10 ABA CA C 1.673 -2.009 -1.830 1.00 . A A . 10 AIB CA 1 1
3 618 1 1 10 ABA H H 1.528 -0.235 -0.476 1.00 . A A . 10 AIB H 1 1
3 619 1 1 10 ABA N N 1.216 -1.211 -0.638 1.00 . A A . 10 AIB N 1 1
3 620 1 1 10 ABA O O 1.860 -4.429 -2.050 1.00 . A A . 10 AIB O 1 1
3 621 1 1 11 HYP C C 2.729 -5.772 0.797 1.00 . A A . 11 HYP C 1 1
3 622 1 1 11 HYP CA C 3.750 -4.975 -0.089 1.00 . A A . 11 HYP CA 1 1
3 623 1 1 11 HYP CB C 5.050 -4.651 0.672 1.00 . A A . 11 HYP CB 1 1
3 624 1 1 11 HYP CD C 3.904 -2.552 0.275 1.00 . A A . 11 HYP CD 1 1
3 625 1 1 11 HYP CG C 4.820 -3.264 1.278 1.00 . A A . 11 HYP CG 1 1
3 626 1 1 11 HYP HA H 4.003 -5.611 -0.960 1.00 . A A . 11 HYP HA 1 1
3 627 1 1 11 HYP HB2 H 5.304 -5.399 1.447 1.00 . A A . 11 HYP HB2 1 1
3 628 1 1 11 HYP HB3 H 5.904 -4.621 -0.035 1.00 . A A . 11 HYP HB3 1 1
3 629 1 1 11 HYP HD1 H 6.603 -3.157 1.978 1.00 . A A . 11 HYP HD1 1 1
3 630 1 1 11 HYP HD22 H 3.110 -2.028 0.823 1.00 . A A . 11 HYP HD22 1 1
3 631 1 1 11 HYP HD23 H 4.418 -1.793 -0.333 1.00 . A A . 11 HYP HD23 1 1
3 632 1 1 11 HYP HG H 4.302 -3.365 2.251 1.00 . A A . 11 HYP HG 1 1
3 633 1 1 11 HYP N N 3.337 -3.620 -0.571 1.00 . A A . 11 HYP N 1 1
3 634 1 1 11 HYP O O 2.863 -6.992 0.936 1.00 . A A . 11 HYP O 1 1
3 635 1 1 11 HYP OD1 O 6.046 -2.570 1.461 1.00 . A A . 11 HYP OD1 1 1
3 636 1 1 12 GLN C C -0.669 -6.049 1.037 1.00 . A A . 12 GLN C 1 1
3 637 1 1 12 GLN CA C 0.524 -5.694 1.985 1.00 . A A . 12 GLN CA 1 1
3 638 1 1 12 GLN CB C 0.074 -4.770 3.153 1.00 . A A . 12 GLN CB 1 1
3 639 1 1 12 GLN CD C 0.711 -5.712 5.500 1.00 . A A . 12 GLN CD 1 1
3 640 1 1 12 GLN CG C 1.040 -4.727 4.364 1.00 . A A . 12 GLN CG 1 1
3 641 1 1 12 GLN H H 1.701 -4.094 1.193 1.00 . A A . 12 GLN H 1 1
3 642 1 1 12 GLN HA H 0.872 -6.620 2.435 1.00 . A A . 12 GLN HA 1 1
3 643 1 1 12 GLN HB2 H -0.065 -3.742 2.772 1.00 . A A . 12 GLN HB2 1 1
3 644 1 1 12 GLN HB3 H -0.936 -5.046 3.514 1.00 . A A . 12 GLN HB3 1 1
3 645 1 1 12 GLN HE21 H 2.604 -6.349 5.489 1.00 . A A . 12 GLN HE21 1 1
3 646 1 1 12 GLN HE22 H 1.480 -7.095 6.738 1.00 . A A . 12 GLN HE22 1 1
3 647 1 1 12 GLN HG2 H 2.079 -4.869 4.007 1.00 . A A . 12 GLN HG2 1 1
3 648 1 1 12 GLN HG3 H 1.025 -3.712 4.790 1.00 . A A . 12 GLN HG3 1 1
3 649 1 1 12 GLN N N 1.706 -5.093 1.350 1.00 . A A . 12 GLN N 1 1
3 650 1 1 12 GLN NE2 N 1.691 -6.485 5.939 1.00 . A A . 12 GLN NE2 1 1
3 651 1 1 12 GLN O O -1.650 -6.567 1.566 1.00 . A A . 12 GLN O 1 1
3 652 1 1 12 GLN OE1 O -0.406 -5.767 6.015 1.00 . A A . 12 GLN OE1 1 1
3 653 1 1 13 ABA C C -1.264 -8.023 -1.481 1.00 . A A . 13 AIB C 1 1
3 654 1 1 13 ABA CA C -1.554 -6.459 -1.309 1.00 . A A . 13 AIB CA 1 1
3 655 1 1 13 ABA H H 0.264 -5.428 -0.643 1.00 . A A . 13 AIB H 1 1
3 656 1 1 13 ABA N N -0.631 -5.822 -0.306 1.00 . A A . 13 AIB N 1 1
3 657 1 1 13 ABA O O -2.223 -8.799 -1.384 1.00 . A A . 13 AIB O 1 1
3 658 1 1 14 HYP C C 0.134 -10.923 -0.600 1.00 . A A . 14 HYP C 1 1
3 659 1 1 14 HYP CA C 0.231 -10.030 -1.875 1.00 . A A . 14 HYP CA 1 1
3 660 1 1 14 HYP CB C 1.639 -10.074 -2.502 1.00 . A A . 14 HYP CB 1 1
3 661 1 1 14 HYP CD C 1.217 -7.789 -1.935 1.00 . A A . 14 HYP CD 1 1
3 662 1 1 14 HYP CG C 2.328 -8.833 -1.944 1.00 . A A . 14 HYP CG 1 1
3 663 1 1 14 HYP HA H -0.480 -10.433 -2.622 1.00 . A A . 14 HYP HA 1 1
3 664 1 1 14 HYP HB2 H 2.200 -11.002 -2.282 1.00 . A A . 14 HYP HB2 1 1
3 665 1 1 14 HYP HB3 H 1.564 -10.014 -3.605 1.00 . A A . 14 HYP HB3 1 1
3 666 1 1 14 HYP HD1 H 3.060 -8.198 -3.605 1.00 . A A . 14 HYP HD1 1 1
3 667 1 1 14 HYP HD22 H 1.412 -7.057 -1.143 1.00 . A A . 14 HYP HD22 1 1
3 668 1 1 14 HYP HD23 H 1.173 -7.225 -2.881 1.00 . A A . 14 HYP HD23 1 1
3 669 1 1 14 HYP HG H 2.652 -9.023 -0.896 1.00 . A A . 14 HYP HG 1 1
3 670 1 1 14 HYP N N -0.018 -8.568 -1.712 1.00 . A A . 14 HYP N 1 1
3 671 1 1 14 HYP O O -0.369 -12.043 -0.734 1.00 . A A . 14 HYP O 1 1
3 672 1 1 14 HYP OD1 O 3.428 -8.424 -2.747 1.00 . A A . 14 HYP OD1 1 1
3 673 1 1 15 ABA C C -0.963 -11.745 2.222 1.00 . A A . 15 AIB C 1 1
3 674 1 1 15 ABA CA C 0.520 -11.261 1.876 1.00 . A A . 15 AIB CA 1 1
3 675 1 1 15 ABA H H 0.900 -9.488 0.622 1.00 . A A . 15 AIB H 1 1
3 676 1 1 15 ABA N N 0.614 -10.480 0.598 1.00 . A A . 15 AIB N 1 1
3 677 1 1 15 ABA O O -1.136 -12.943 2.474 1.00 . A A . 15 AIB O 1 1
3 678 1 1 16 PRO C C -4.012 -12.047 0.885 1.00 . A A . 16 PRO C 1 1
3 679 1 1 16 PRO CA C -3.468 -11.440 2.223 1.00 . A A . 16 PRO CA 1 1
3 680 1 1 16 PRO CB C -4.258 -10.201 2.689 1.00 . A A . 16 PRO CB 1 1
3 681 1 1 16 PRO CD C -2.025 -9.461 2.079 1.00 . A A . 16 PRO CD 1 1
3 682 1 1 16 PRO CG C -3.483 -9.002 2.148 1.00 . A A . 16 PRO CG 1 1
3 683 1 1 16 PRO HA H -3.558 -12.216 3.011 1.00 . A A . 16 PRO HA 1 1
3 684 1 1 16 PRO HB2 H -5.314 -10.200 2.355 1.00 . A A . 16 PRO HB2 1 1
3 685 1 1 16 PRO HB3 H -4.280 -10.159 3.794 1.00 . A A . 16 PRO HB3 1 1
3 686 1 1 16 PRO HD2 H -1.573 -9.138 1.129 1.00 . A A . 16 PRO HD2 1 1
3 687 1 1 16 PRO HD3 H -1.421 -9.013 2.884 1.00 . A A . 16 PRO HD3 1 1
3 688 1 1 16 PRO HG2 H -3.844 -8.749 1.133 1.00 . A A . 16 PRO HG2 1 1
3 689 1 1 16 PRO HG3 H -3.612 -8.099 2.772 1.00 . A A . 16 PRO HG3 1 1
3 690 1 1 16 PRO N N -2.070 -10.930 2.188 1.00 . A A . 16 PRO N 1 1
3 691 1 1 16 PRO O O -4.679 -13.084 0.951 1.00 . A A . 16 PRO O 1 1
3 692 1 1 17 PHL C C -3.261 -12.496 -2.447 1.00 . A A . 17 PHL C 1 1
3 693 1 1 17 PHL CA C -4.373 -11.862 -1.581 1.00 . A A . 17 PHL CA 1 1
3 694 1 1 17 PHL CB C -5.085 -10.679 -2.303 1.00 . A A . 17 PHL CB 1 1
3 695 1 1 17 PHL CD1 C -7.536 -10.786 -1.597 1.00 . A A . 17 PHL CD1 1 1
3 696 1 1 17 PHL CD2 C -6.223 -8.894 -0.869 1.00 . A A . 17 PHL CD2 1 1
3 697 1 1 17 PHL CE1 C -8.639 -10.281 -0.913 1.00 . A A . 17 PHL CE1 1 1
3 698 1 1 17 PHL CE2 C -7.326 -8.391 -0.185 1.00 . A A . 17 PHL CE2 1 1
3 699 1 1 17 PHL CG C -6.315 -10.099 -1.574 1.00 . A A . 17 PHL CG 1 1
3 700 1 1 17 PHL CZ C -8.535 -9.084 -0.207 1.00 . A A . 17 PHL CZ 1 1
3 701 1 1 17 PHL H H -3.185 -10.575 -0.242 1.00 . A A . 17 PHL H 1 1
3 702 1 1 17 PHL HA H -5.135 -12.649 -1.412 1.00 . A A . 17 PHL HA 1 1
3 703 1 1 17 PHL HB2 H -4.353 -9.876 -2.524 1.00 . A A . 17 PHL HB2 1 1
3 704 1 1 17 PHL HB3 H -5.415 -11.016 -3.304 1.00 . A A . 17 PHL HB3 1 1
3 705 1 1 17 PHL HC1 H -2.728 -13.282 -1.881 1.00 . A A . 17 PHL HC1 1 1
3 706 1 1 17 PHL HC2 H -2.495 -11.748 -2.729 1.00 . A A . 17 PHL HC2 1 1
3 707 1 1 17 PHL HD1 H -7.631 -11.718 -2.135 1.00 . A A . 17 PHL HD1 1 1
3 708 1 1 17 PHL HD2 H -5.291 -8.346 -0.840 1.00 . A A . 17 PHL HD2 1 1
3 709 1 1 17 PHL HE1 H -9.576 -10.820 -0.926 1.00 . A A . 17 PHL HE1 1 1
3 710 1 1 17 PHL HE2 H -7.249 -7.464 0.364 1.00 . A A . 17 PHL HE2 1 1
3 711 1 1 17 PHL HO H -4.222 -12.372 -4.110 1.00 . A A . 17 PHL HO 1 1
3 712 1 1 17 PHL HZ H -9.392 -8.695 0.325 1.00 . A A . 17 PHL HZ 1 1
3 713 1 1 17 PHL N N -3.776 -11.417 -0.292 1.00 . A A . 17 PHL N 1 1
3 714 1 1 17 PHL O O -3.802 -13.085 -3.623 1.00 . A A . 17 PHL O 1 1
4 715 1 1 1 ACE C C -1.770 10.913 1.024 1.00 . A A . 1 ACE C 1 1
4 716 1 1 1 ACE CH3 C -1.084 12.272 0.989 1.00 . A A . 1 ACE CH3 1 1
4 717 1 1 1 ACE H1 H -0.667 12.470 -0.018 1.00 . A A . 1 ACE H1 1 1
4 718 1 1 1 ACE H2 H -1.781 13.091 1.241 1.00 . A A . 1 ACE H2 1 1
4 719 1 1 1 ACE H3 H -0.239 12.305 1.700 1.00 . A A . 1 ACE H3 1 1
4 720 1 1 1 ACE O O -1.319 9.999 1.720 1.00 . A A . 1 ACE O 1 1
4 721 1 1 2 TRP C C -2.368 8.532 -1.024 1.00 . A A . 2 TRP C 1 1
4 722 1 1 2 TRP CA C -3.350 9.441 -0.202 1.00 . A A . 2 TRP CA 1 1
4 723 1 1 2 TRP CB C -4.768 9.564 -0.836 1.00 . A A . 2 TRP CB 1 1
4 724 1 1 2 TRP CD1 C -4.878 11.142 -2.949 1.00 . A A . 2 TRP CD1 1 1
4 725 1 1 2 TRP CD2 C -4.893 8.959 -3.385 1.00 . A A . 2 TRP CD2 1 1
4 726 1 1 2 TRP CE2 C -4.926 9.683 -4.601 1.00 . A A . 2 TRP CE2 1 1
4 727 1 1 2 TRP CE3 C -4.902 7.541 -3.392 1.00 . A A . 2 TRP CE3 1 1
4 728 1 1 2 TRP CG C -4.853 9.870 -2.341 1.00 . A A . 2 TRP CG 1 1
4 729 1 1 2 TRP CH2 C -4.978 7.593 -5.824 1.00 . A A . 2 TRP CH2 1 1
4 730 1 1 2 TRP CZ2 C -4.962 8.990 -5.838 1.00 . A A . 2 TRP CZ2 1 1
4 731 1 1 2 TRP CZ3 C -4.959 6.881 -4.618 1.00 . A A . 2 TRP CZ3 1 1
4 732 1 1 2 TRP H H -3.121 11.625 -0.287 1.00 . A A . 2 TRP H 1 1
4 733 1 1 2 TRP HA H -3.522 8.917 0.754 1.00 . A A . 2 TRP HA 1 1
4 734 1 1 2 TRP HB2 H -5.301 8.611 -0.655 1.00 . A A . 2 TRP HB2 1 1
4 735 1 1 2 TRP HB3 H -5.376 10.301 -0.276 1.00 . A A . 2 TRP HB3 1 1
4 736 1 1 2 TRP HD1 H -4.868 12.078 -2.409 1.00 . A A . 2 TRP HD1 1 1
4 737 1 1 2 TRP HE1 H -4.993 11.810 -5.037 1.00 . A A . 2 TRP HE1 1 1
4 738 1 1 2 TRP HE3 H -4.869 6.975 -2.470 1.00 . A A . 2 TRP HE3 1 1
4 739 1 1 2 TRP HH2 H -5.008 7.050 -6.756 1.00 . A A . 2 TRP HH2 1 1
4 740 1 1 2 TRP HZ2 H -4.982 9.525 -6.775 1.00 . A A . 2 TRP HZ2 1 1
4 741 1 1 2 TRP HZ3 H -4.996 5.804 -4.635 1.00 . A A . 2 TRP HZ3 1 1
4 742 1 1 2 TRP N N -2.815 10.775 0.190 1.00 . A A . 2 TRP N 1 1
4 743 1 1 2 TRP NE1 N -4.924 11.048 -4.355 1.00 . A A . 2 TRP NE1 1 1
4 744 1 1 2 TRP O O -2.511 7.309 -0.982 1.00 . A A . 2 TRP O 1 1
4 745 1 1 3 ILE C C 0.651 7.544 -1.450 1.00 . A A . 3 ILE C 1 1
4 746 1 1 3 ILE CA C -0.290 8.340 -2.418 1.00 . A A . 3 ILE CA 1 1
4 747 1 1 3 ILE CB C 0.453 9.168 -3.528 1.00 . A A . 3 ILE CB 1 1
4 748 1 1 3 ILE CD1 C 2.684 10.156 -2.560 1.00 . A A . 3 ILE CD1 1 1
4 749 1 1 3 ILE CG1 C 1.249 10.421 -3.044 1.00 . A A . 3 ILE CG1 1 1
4 750 1 1 3 ILE CG2 C -0.512 9.556 -4.681 1.00 . A A . 3 ILE CG2 1 1
4 751 1 1 3 ILE H H -1.378 10.134 -1.719 1.00 . A A . 3 ILE H 1 1
4 752 1 1 3 ILE HA H -0.810 7.549 -2.971 1.00 . A A . 3 ILE HA 1 1
4 753 1 1 3 ILE HB H 1.179 8.482 -4.006 1.00 . A A . 3 ILE HB 1 1
4 754 1 1 3 ILE HD11 H 3.322 9.763 -3.373 1.00 . A A . 3 ILE HD11 1 1
4 755 1 1 3 ILE HD12 H 3.153 11.087 -2.194 1.00 . A A . 3 ILE HD12 1 1
4 756 1 1 3 ILE HD13 H 2.731 9.433 -1.730 1.00 . A A . 3 ILE HD13 1 1
4 757 1 1 3 ILE HG12 H 1.335 11.159 -3.865 1.00 . A A . 3 ILE HG12 1 1
4 758 1 1 3 ILE HG13 H 0.685 10.952 -2.254 1.00 . A A . 3 ILE HG13 1 1
4 759 1 1 3 ILE HG21 H -1.284 10.280 -4.356 1.00 . A A . 3 ILE HG21 1 1
4 760 1 1 3 ILE HG22 H 0.023 10.014 -5.533 1.00 . A A . 3 ILE HG22 1 1
4 761 1 1 3 ILE HG23 H -1.048 8.674 -5.080 1.00 . A A . 3 ILE HG23 1 1
4 762 1 1 3 ILE N N -1.390 9.109 -1.757 1.00 . A A . 3 ILE N 1 1
4 763 1 1 3 ILE O O 1.079 6.442 -1.799 1.00 . A A . 3 ILE O 1 1
4 764 1 1 4 GLN C C 0.751 6.217 1.531 1.00 . A A . 4 GLN C 1 1
4 765 1 1 4 GLN CA C 1.603 7.329 0.857 1.00 . A A . 4 GLN CA 1 1
4 766 1 1 4 GLN CB C 2.142 8.336 1.907 1.00 . A A . 4 GLN CB 1 1
4 767 1 1 4 GLN CD C 3.327 10.619 1.627 1.00 . A A . 4 GLN CD 1 1
4 768 1 1 4 GLN CG C 3.418 9.093 1.462 1.00 . A A . 4 GLN CG 1 1
4 769 1 1 4 GLN H H 0.502 8.990 -0.089 1.00 . A A . 4 GLN H 1 1
4 770 1 1 4 GLN HA H 2.475 6.816 0.416 1.00 . A A . 4 GLN HA 1 1
4 771 1 1 4 GLN HB2 H 1.331 9.031 2.204 1.00 . A A . 4 GLN HB2 1 1
4 772 1 1 4 GLN HB3 H 2.391 7.806 2.847 1.00 . A A . 4 GLN HB3 1 1
4 773 1 1 4 GLN HE21 H 4.602 10.559 3.172 1.00 . A A . 4 GLN HE21 1 1
4 774 1 1 4 GLN HE22 H 3.969 12.207 2.667 1.00 . A A . 4 GLN HE22 1 1
4 775 1 1 4 GLN HG2 H 4.288 8.670 2.004 1.00 . A A . 4 GLN HG2 1 1
4 776 1 1 4 GLN HG3 H 3.645 8.880 0.400 1.00 . A A . 4 GLN HG3 1 1
4 777 1 1 4 GLN N N 0.925 8.072 -0.242 1.00 . A A . 4 GLN N 1 1
4 778 1 1 4 GLN NE2 N 4.035 11.186 2.590 1.00 . A A . 4 GLN NE2 1 1
4 779 1 1 4 GLN O O 1.302 5.147 1.800 1.00 . A A . 4 GLN O 1 1
4 780 1 1 4 GLN OE1 O 2.621 11.301 0.884 1.00 . A A . 4 GLN OE1 1 1
4 781 1 1 5 . C C -1.500 4.119 1.263 1.00 . A A . 5 DIV C 1 1
4 782 1 1 5 . CA C -1.543 5.384 2.223 1.00 . A A . 5 DIV CA 1 1
4 783 1 1 5 . CB1 C -1.261 5.070 3.742 1.00 . A A . 5 DIV CB1 1 1
4 784 1 1 5 . CB2 C -2.946 6.053 2.131 1.00 . A A . 5 DIV CB2 1 1
4 785 1 1 5 . CG1 C -2.251 4.169 4.511 1.00 . A A . 5 DIV CG1 1 1
4 786 1 1 5 . H H -0.884 7.362 1.472 1.00 . A A . 5 DIV H 1 1
4 787 1 1 5 . HB11 H -0.258 4.620 3.842 1.00 . A A . 5 DIV HB11 1 1
4 788 1 1 5 . HB12 H -1.190 6.016 4.312 1.00 . A A . 5 DIV HB12 1 1
4 789 1 1 5 . HB21 H -3.212 6.355 1.105 1.00 . A A . 5 DIV HB21 1 1
4 790 1 1 5 . HB22 H -3.754 5.367 2.447 1.00 . A A . 5 DIV HB22 1 1
4 791 1 1 5 . HB23 H -3.032 6.959 2.759 1.00 . A A . 5 DIV HB23 1 1
4 792 1 1 5 . HG11 H -2.412 3.201 4.009 1.00 . A A . 5 DIV HG11 1 1
4 793 1 1 5 . HG12 H -1.879 3.947 5.529 1.00 . A A . 5 DIV HG12 1 1
4 794 1 1 5 . HG13 H -3.241 4.644 4.629 1.00 . A A . 5 DIV HG13 1 1
4 795 1 1 5 . N N -0.565 6.441 1.786 1.00 . A A . 5 DIV N 1 1
4 796 1 1 5 . O O -1.285 2.996 1.726 1.00 . A A . 5 DIV O 1 1
4 797 1 1 6 ILE C C -0.126 2.560 -1.223 1.00 . A A . 6 ILE C 1 1
4 798 1 1 6 ILE CA C -1.537 3.213 -1.082 1.00 . A A . 6 ILE CA 1 1
4 799 1 1 6 ILE CB C -2.212 3.520 -2.465 1.00 . A A . 6 ILE CB 1 1
4 800 1 1 6 ILE CD1 C -1.919 4.750 -4.758 1.00 . A A . 6 ILE CD1 1 1
4 801 1 1 6 ILE CG1 C -1.591 4.706 -3.257 1.00 . A A . 6 ILE CG1 1 1
4 802 1 1 6 ILE CG2 C -3.748 3.666 -2.332 1.00 . A A . 6 ILE CG2 1 1
4 803 1 1 6 ILE H H -1.889 5.250 -0.366 1.00 . A A . 6 ILE H 1 1
4 804 1 1 6 ILE HA H -2.164 2.422 -0.648 1.00 . A A . 6 ILE HA 1 1
4 805 1 1 6 ILE HB H -2.057 2.614 -3.084 1.00 . A A . 6 ILE HB 1 1
4 806 1 1 6 ILE HD11 H -3.002 4.835 -4.943 1.00 . A A . 6 ILE HD11 1 1
4 807 1 1 6 ILE HD12 H -1.439 5.619 -5.247 1.00 . A A . 6 ILE HD12 1 1
4 808 1 1 6 ILE HD13 H -1.570 3.839 -5.279 1.00 . A A . 6 ILE HD13 1 1
4 809 1 1 6 ILE HG12 H -1.900 5.658 -2.793 1.00 . A A . 6 ILE HG12 1 1
4 810 1 1 6 ILE HG13 H -0.490 4.688 -3.172 1.00 . A A . 6 ILE HG13 1 1
4 811 1 1 6 ILE HG21 H -4.033 4.577 -1.775 1.00 . A A . 6 ILE HG21 1 1
4 812 1 1 6 ILE HG22 H -4.246 3.715 -3.317 1.00 . A A . 6 ILE HG22 1 1
4 813 1 1 6 ILE HG23 H -4.193 2.805 -1.801 1.00 . A A . 6 ILE HG23 1 1
4 814 1 1 6 ILE N N -1.629 4.308 -0.077 1.00 . A A . 6 ILE N 1 1
4 815 1 1 6 ILE O O -0.071 1.333 -1.234 1.00 . A A . 6 ILE O 1 1
4 816 1 1 7 THR C C 2.779 1.854 -0.156 1.00 . A A . 7 THR C 1 1
4 817 1 1 7 THR CA C 2.376 2.748 -1.381 1.00 . A A . 7 THR CA 1 1
4 818 1 1 7 THR CB C 3.410 3.879 -1.682 1.00 . A A . 7 THR CB 1 1
4 819 1 1 7 THR CG2 C 4.852 3.391 -1.920 1.00 . A A . 7 THR CG2 1 1
4 820 1 1 7 THR H H 0.824 4.333 -1.275 1.00 . A A . 7 THR H 1 1
4 821 1 1 7 THR HA H 2.389 2.082 -2.266 1.00 . A A . 7 THR HA 1 1
4 822 1 1 7 THR HB H 3.420 4.598 -0.841 1.00 . A A . 7 THR HB 1 1
4 823 1 1 7 THR HG1 H 3.705 5.264 -2.987 1.00 . A A . 7 THR HG1 1 1
4 824 1 1 7 THR HG21 H 5.526 4.227 -2.188 1.00 . A A . 7 THR HG21 1 1
4 825 1 1 7 THR HG22 H 5.282 2.909 -1.022 1.00 . A A . 7 THR HG22 1 1
4 826 1 1 7 THR HG23 H 4.899 2.655 -2.743 1.00 . A A . 7 THR HG23 1 1
4 827 1 1 7 THR N N 0.991 3.321 -1.300 1.00 . A A . 7 THR N 1 1
4 828 1 1 7 THR O O 3.326 0.770 -0.362 1.00 . A A . 7 THR O 1 1
4 829 1 1 7 THR OG1 O 3.035 4.588 -2.862 1.00 . A A . 7 THR OG1 1 1
4 830 1 1 8 ABA C C 1.574 0.144 2.265 1.00 . A A . 8 AIB C 1 1
4 831 1 1 8 ABA CA C 2.498 1.425 2.322 1.00 . A A . 8 AIB CA 1 1
4 832 1 1 8 ABA H H 1.876 3.110 1.044 1.00 . A A . 8 AIB H 1 1
4 833 1 1 8 ABA N N 2.475 2.284 1.089 1.00 . A A . 8 AIB N 1 1
4 834 1 1 8 ABA O O 1.913 -0.899 2.835 1.00 . A A . 8 AIB O 1 1
4 835 1 1 9 LEU C C 0.087 -1.826 0.034 1.00 . A A . 9 LEU C 1 1
4 836 1 1 9 LEU CA C -0.419 -0.968 1.233 1.00 . A A . 9 LEU CA 1 1
4 837 1 1 9 LEU CB C -1.884 -0.493 1.020 1.00 . A A . 9 LEU CB 1 1
4 838 1 1 9 LEU CD1 C -3.417 -1.920 2.508 1.00 . A A . 9 LEU CD1 1 1
4 839 1 1 9 LEU CD2 C -2.312 0.111 3.535 1.00 . A A . 9 LEU CD2 1 1
4 840 1 1 9 LEU CG C -2.852 -0.510 2.234 1.00 . A A . 9 LEU CG 1 1
4 841 1 1 9 LEU H H 0.192 1.091 1.102 1.00 . A A . 9 LEU H 1 1
4 842 1 1 9 LEU HA H -0.437 -1.644 2.097 1.00 . A A . 9 LEU HA 1 1
4 843 1 1 9 LEU HB2 H -1.901 0.518 0.571 1.00 . A A . 9 LEU HB2 1 1
4 844 1 1 9 LEU HB3 H -2.352 -1.111 0.234 1.00 . A A . 9 LEU HB3 1 1
4 845 1 1 9 LEU HD11 H -2.633 -2.626 2.841 1.00 . A A . 9 LEU HD11 1 1
4 846 1 1 9 LEU HD12 H -4.197 -1.902 3.290 1.00 . A A . 9 LEU HD12 1 1
4 847 1 1 9 LEU HD13 H -3.884 -2.359 1.607 1.00 . A A . 9 LEU HD13 1 1
4 848 1 1 9 LEU HD21 H -1.892 1.115 3.362 1.00 . A A . 9 LEU HD21 1 1
4 849 1 1 9 LEU HD22 H -3.109 0.222 4.293 1.00 . A A . 9 LEU HD22 1 1
4 850 1 1 9 LEU HD23 H -1.509 -0.498 3.989 1.00 . A A . 9 LEU HD23 1 1
4 851 1 1 9 LEU HG H -3.695 0.128 1.921 1.00 . A A . 9 LEU HG 1 1
4 852 1 1 9 LEU N N 0.406 0.212 1.581 1.00 . A A . 9 LEU N 1 1
4 853 1 1 9 LEU O O -0.342 -2.979 -0.036 1.00 . A A . 9 LEU O 1 1
4 854 1 1 10 ABA C C 2.236 -3.496 -1.568 1.00 . A A . 10 AIB C 1 1
4 855 1 1 10 ABA CA C 1.535 -2.133 -2.021 1.00 . A A . 10 AIB CA 1 1
4 856 1 1 10 ABA H H 1.341 -0.397 -0.636 1.00 . A A . 10 AIB H 1 1
4 857 1 1 10 ABA N N 0.955 -1.326 -0.892 1.00 . A A . 10 AIB N 1 1
4 858 1 1 10 ABA O O 1.875 -4.544 -2.120 1.00 . A A . 10 AIB O 1 1
4 859 1 1 11 HYP C C 2.587 -5.721 0.837 1.00 . A A . 11 HYP C 1 1
4 860 1 1 11 HYP CA C 3.628 -4.894 0.011 1.00 . A A . 11 HYP CA 1 1
4 861 1 1 11 HYP CB C 4.826 -4.472 0.882 1.00 . A A . 11 HYP CB 1 1
4 862 1 1 11 HYP CD C 3.690 -2.450 0.211 1.00 . A A . 11 HYP CD 1 1
4 863 1 1 11 HYP CG C 4.485 -3.063 1.367 1.00 . A A . 11 HYP CG 1 1
4 864 1 1 11 HYP HA H 3.997 -5.541 -0.807 1.00 . A A . 11 HYP HA 1 1
4 865 1 1 11 HYP HB2 H 5.010 -5.161 1.728 1.00 . A A . 11 HYP HB2 1 1
4 866 1 1 11 HYP HB3 H 5.755 -4.459 0.278 1.00 . A A . 11 HYP HB3 1 1
4 867 1 1 11 HYP HD1 H 6.119 -2.811 2.347 1.00 . A A . 11 HYP HD1 1 1
4 868 1 1 11 HYP HD22 H 2.882 -1.826 0.615 1.00 . A A . 11 HYP HD22 1 1
4 869 1 1 11 HYP HD23 H 4.297 -1.812 -0.442 1.00 . A A . 11 HYP HD23 1 1
4 870 1 1 11 HYP HG H 3.841 -3.133 2.265 1.00 . A A . 11 HYP HG 1 1
4 871 1 1 11 HYP N N 3.173 -3.592 -0.562 1.00 . A A . 11 HYP N 1 1
4 872 1 1 11 HYP O O 2.813 -6.916 1.047 1.00 . A A . 11 HYP O 1 1
4 873 1 1 11 HYP OD1 O 5.654 -2.313 1.670 1.00 . A A . 11 HYP OD1 1 1
4 874 1 1 12 GLN C C -0.877 -6.044 0.800 1.00 . A A . 12 GLN C 1 1
4 875 1 1 12 GLN CA C 0.296 -5.811 1.817 1.00 . A A . 12 GLN CA 1 1
4 876 1 1 12 GLN CB C -0.163 -5.142 3.148 1.00 . A A . 12 GLN CB 1 1
4 877 1 1 12 GLN CD C 0.306 -5.140 5.696 1.00 . A A . 12 GLN CD 1 1
4 878 1 1 12 GLN CG C 0.900 -5.087 4.280 1.00 . A A . 12 GLN CG 1 1
4 879 1 1 12 GLN H H 1.367 -4.133 1.042 1.00 . A A . 12 GLN H 1 1
4 880 1 1 12 GLN HA H 0.641 -6.801 2.088 1.00 . A A . 12 GLN HA 1 1
4 881 1 1 12 GLN HB2 H -0.548 -4.122 2.951 1.00 . A A . 12 GLN HB2 1 1
4 882 1 1 12 GLN HB3 H -1.040 -5.706 3.522 1.00 . A A . 12 GLN HB3 1 1
4 883 1 1 12 GLN HE21 H 0.260 -3.136 5.811 1.00 . A A . 12 GLN HE21 1 1
4 884 1 1 12 GLN HE22 H -0.381 -4.080 7.247 1.00 . A A . 12 GLN HE22 1 1
4 885 1 1 12 GLN HG2 H 1.599 -5.940 4.180 1.00 . A A . 12 GLN HG2 1 1
4 886 1 1 12 GLN HG3 H 1.543 -4.193 4.147 1.00 . A A . 12 GLN HG3 1 1
4 887 1 1 12 GLN N N 1.470 -5.108 1.280 1.00 . A A . 12 GLN N 1 1
4 888 1 1 12 GLN NE2 N 0.033 -4.001 6.312 1.00 . A A . 12 GLN NE2 1 1
4 889 1 1 12 GLN O O -1.970 -6.375 1.260 1.00 . A A . 12 GLN O 1 1
4 890 1 1 12 GLN OE1 O 0.082 -6.217 6.249 1.00 . A A . 12 GLN OE1 1 1
4 891 1 1 13 ABA C C -1.111 -8.254 -1.585 1.00 . A A . 13 AIB C 1 1
4 892 1 1 13 ABA CA C -1.489 -6.701 -1.581 1.00 . A A . 13 AIB CA 1 1
4 893 1 1 13 ABA H H 0.254 -5.603 -0.811 1.00 . A A . 13 AIB H 1 1
4 894 1 1 13 ABA N N -0.681 -5.961 -0.547 1.00 . A A . 13 AIB N 1 1
4 895 1 1 13 ABA O O -2.030 -9.069 -1.436 1.00 . A A . 13 AIB O 1 1
4 896 1 1 14 HYP C C 0.328 -10.997 -0.426 1.00 . A A . 14 HYP C 1 1
4 897 1 1 14 HYP CA C 0.501 -10.204 -1.758 1.00 . A A . 14 HYP CA 1 1
4 898 1 1 14 HYP CB C 1.958 -10.224 -2.266 1.00 . A A . 14 HYP CB 1 1
4 899 1 1 14 HYP CD C 1.382 -7.922 -1.930 1.00 . A A . 14 HYP CD 1 1
4 900 1 1 14 HYP CG C 2.540 -8.899 -1.771 1.00 . A A . 14 HYP CG 1 1
4 901 1 1 14 HYP HA H -0.129 -10.699 -2.524 1.00 . A A . 14 HYP HA 1 1
4 902 1 1 14 HYP HB2 H 2.545 -11.093 -1.914 1.00 . A A . 14 HYP HB2 1 1
4 903 1 1 14 HYP HB3 H 1.974 -10.267 -3.373 1.00 . A A . 14 HYP HB3 1 1
4 904 1 1 14 HYP HD1 H 3.343 -8.303 -3.413 1.00 . A A . 14 HYP HD1 1 1
4 905 1 1 14 HYP HD22 H 1.484 -7.114 -1.199 1.00 . A A . 14 HYP HD22 1 1
4 906 1 1 14 HYP HD23 H 1.374 -7.452 -2.925 1.00 . A A . 14 HYP HD23 1 1
4 907 1 1 14 HYP HG H 2.800 -8.982 -0.695 1.00 . A A . 14 HYP HG 1 1
4 908 1 1 14 HYP N N 0.173 -8.748 -1.725 1.00 . A A . 14 HYP N 1 1
4 909 1 1 14 HYP O O -0.239 -12.092 -0.472 1.00 . A A . 14 HYP O 1 1
4 910 1 1 14 HYP OD1 O 3.672 -8.496 -2.533 1.00 . A A . 14 HYP OD1 1 1
4 911 1 1 15 ABA C C -0.775 -11.613 2.445 1.00 . A A . 15 AIB C 1 1
4 912 1 1 15 ABA CA C 0.701 -11.128 2.081 1.00 . A A . 15 AIB CA 1 1
4 913 1 1 15 ABA H H 1.257 -9.558 0.621 1.00 . A A . 15 AIB H 1 1
4 914 1 1 15 ABA N N 0.816 -10.479 0.733 1.00 . A A . 15 AIB N 1 1
4 915 1 1 15 ABA O O -0.923 -12.794 2.783 1.00 . A A . 15 AIB O 1 1
4 916 1 1 16 PRO C C -3.771 -12.128 1.102 1.00 . A A . 16 PRO C 1 1
4 917 1 1 16 PRO CA C -3.280 -11.386 2.388 1.00 . A A . 16 PRO CA 1 1
4 918 1 1 16 PRO CB C -4.126 -10.148 2.734 1.00 . A A . 16 PRO CB 1 1
4 919 1 1 16 PRO CD C -1.893 -9.367 2.149 1.00 . A A . 16 PRO CD 1 1
4 920 1 1 16 PRO CG C -3.372 -8.967 2.121 1.00 . A A . 16 PRO CG 1 1
4 921 1 1 16 PRO HA H -3.359 -12.094 3.238 1.00 . A A . 16 PRO HA 1 1
4 922 1 1 16 PRO HB2 H -5.171 -10.205 2.373 1.00 . A A . 16 PRO HB2 1 1
4 923 1 1 16 PRO HB3 H -4.181 -10.020 3.833 1.00 . A A . 16 PRO HB3 1 1
4 924 1 1 16 PRO HD2 H -1.396 -9.068 1.212 1.00 . A A . 16 PRO HD2 1 1
4 925 1 1 16 PRO HD3 H -1.363 -8.861 2.971 1.00 . A A . 16 PRO HD3 1 1
4 926 1 1 16 PRO HG2 H -3.701 -8.815 1.076 1.00 . A A . 16 PRO HG2 1 1
4 927 1 1 16 PRO HG3 H -3.565 -8.022 2.662 1.00 . A A . 16 PRO HG3 1 1
4 928 1 1 16 PRO N N -1.899 -10.832 2.333 1.00 . A A . 16 PRO N 1 1
4 929 1 1 16 PRO O O -4.395 -13.184 1.242 1.00 . A A . 16 PRO O 1 1
4 930 1 1 17 PHL C C -2.959 -12.749 -2.214 1.00 . A A . 17 PHL C 1 1
4 931 1 1 17 PHL CA C -4.106 -12.142 -1.377 1.00 . A A . 17 PHL CA 1 1
4 932 1 1 17 PHL CB C -4.889 -11.046 -2.164 1.00 . A A . 17 PHL CB 1 1
4 933 1 1 17 PHL CD1 C -7.287 -11.193 -1.296 1.00 . A A . 17 PHL CD1 1 1
4 934 1 1 17 PHL CD2 C -6.045 -9.162 -0.890 1.00 . A A . 17 PHL CD2 1 1
4 935 1 1 17 PHL CE1 C -8.374 -10.665 -0.607 1.00 . A A . 17 PHL CE1 1 1
4 936 1 1 17 PHL CE2 C -7.135 -8.635 -0.200 1.00 . A A . 17 PHL CE2 1 1
4 937 1 1 17 PHL CG C -6.111 -10.447 -1.439 1.00 . A A . 17 PHL CG 1 1
4 938 1 1 17 PHL CZ C -8.299 -9.385 -0.059 1.00 . A A . 17 PHL CZ 1 1
4 939 1 1 17 PHL H H -2.984 -10.718 -0.123 1.00 . A A . 17 PHL H 1 1
4 940 1 1 17 PHL HA H -4.817 -12.963 -1.160 1.00 . A A . 17 PHL HA 1 1
4 941 1 1 17 PHL HB2 H -4.192 -10.243 -2.476 1.00 . A A . 17 PHL HB2 1 1
4 942 1 1 17 PHL HB3 H -5.238 -11.476 -3.121 1.00 . A A . 17 PHL HB3 1 1
4 943 1 1 17 PHL HC1 H -2.379 -13.474 -1.609 1.00 . A A . 17 PHL HC1 1 1
4 944 1 1 17 PHL HC2 H -2.239 -11.973 -2.536 1.00 . A A . 17 PHL HC2 1 1
4 945 1 1 17 PHL HD1 H -7.357 -12.190 -1.708 1.00 . A A . 17 PHL HD1 1 1
4 946 1 1 17 PHL HD2 H -5.146 -8.571 -0.985 1.00 . A A . 17 PHL HD2 1 1
4 947 1 1 17 PHL HE1 H -9.278 -11.248 -0.492 1.00 . A A . 17 PHL HE1 1 1
4 948 1 1 17 PHL HE2 H -7.077 -7.644 0.228 1.00 . A A . 17 PHL HE2 1 1
4 949 1 1 17 PHL HO H -3.894 -12.762 -3.895 1.00 . A A . 17 PHL HO 1 1
4 950 1 1 17 PHL HZ H -9.144 -8.977 0.476 1.00 . A A . 17 PHL HZ 1 1
4 951 1 1 17 PHL N N -3.535 -11.588 -0.119 1.00 . A A . 17 PHL N 1 1
4 952 1 1 17 PHL O O -3.462 -13.431 -3.359 1.00 . A A . 17 PHL O 1 1
5 953 1 1 1 ACE C C -1.981 10.332 1.265 1.00 . A A . 1 ACE C 1 1
5 954 1 1 1 ACE CH3 C -1.009 11.471 1.538 1.00 . A A . 1 ACE CH3 1 1
5 955 1 1 1 ACE H1 H -1.529 12.441 1.642 1.00 . A A . 1 ACE H1 1 1
5 956 1 1 1 ACE H2 H -0.429 11.290 2.460 1.00 . A A . 1 ACE H2 1 1
5 957 1 1 1 ACE H3 H -0.280 11.559 0.710 1.00 . A A . 1 ACE H3 1 1
5 958 1 1 1 ACE O O -1.939 9.295 1.931 1.00 . A A . 1 ACE O 1 1
5 959 1 1 2 TRP C C -2.555 8.430 -1.242 1.00 . A A . 2 TRP C 1 1
5 960 1 1 2 TRP CA C -3.508 9.406 -0.468 1.00 . A A . 2 TRP CA 1 1
5 961 1 1 2 TRP CB C -4.630 9.949 -1.404 1.00 . A A . 2 TRP CB 1 1
5 962 1 1 2 TRP CD1 C -6.335 10.704 0.478 1.00 . A A . 2 TRP CD1 1 1
5 963 1 1 2 TRP CD2 C -6.270 12.010 -1.324 1.00 . A A . 2 TRP CD2 1 1
5 964 1 1 2 TRP CE2 C -7.192 12.539 -0.382 1.00 . A A . 2 TRP CE2 1 1
5 965 1 1 2 TRP CE3 C -6.063 12.667 -2.566 1.00 . A A . 2 TRP CE3 1 1
5 966 1 1 2 TRP CG C -5.713 10.859 -0.783 1.00 . A A . 2 TRP CG 1 1
5 967 1 1 2 TRP CH2 C -7.680 14.361 -1.897 1.00 . A A . 2 TRP CH2 1 1
5 968 1 1 2 TRP CZ2 C -7.900 13.731 -0.671 1.00 . A A . 2 TRP CZ2 1 1
5 969 1 1 2 TRP CZ3 C -6.779 13.835 -2.830 1.00 . A A . 2 TRP CZ3 1 1
5 970 1 1 2 TRP H H -2.800 11.461 -0.176 1.00 . A A . 2 TRP H 1 1
5 971 1 1 2 TRP HA H -4.007 8.826 0.324 1.00 . A A . 2 TRP HA 1 1
5 972 1 1 2 TRP HB2 H -4.157 10.477 -2.254 1.00 . A A . 2 TRP HB2 1 1
5 973 1 1 2 TRP HB3 H -5.153 9.093 -1.869 1.00 . A A . 2 TRP HB3 1 1
5 974 1 1 2 TRP HD1 H -6.120 9.901 1.168 1.00 . A A . 2 TRP HD1 1 1
5 975 1 1 2 TRP HE1 H -7.823 11.871 1.587 1.00 . A A . 2 TRP HE1 1 1
5 976 1 1 2 TRP HE3 H -5.374 12.274 -3.300 1.00 . A A . 2 TRP HE3 1 1
5 977 1 1 2 TRP HH2 H -8.214 15.271 -2.129 1.00 . A A . 2 TRP HH2 1 1
5 978 1 1 2 TRP HZ2 H -8.597 14.150 0.040 1.00 . A A . 2 TRP HZ2 1 1
5 979 1 1 2 TRP HZ3 H -6.637 14.343 -3.774 1.00 . A A . 2 TRP HZ3 1 1
5 980 1 1 2 TRP N N -2.790 10.519 0.215 1.00 . A A . 2 TRP N 1 1
5 981 1 1 2 TRP NE1 N -7.248 11.739 0.748 1.00 . A A . 2 TRP NE1 1 1
5 982 1 1 2 TRP O O -2.737 7.212 -1.169 1.00 . A A . 2 TRP O 1 1
5 983 1 1 3 ILE C C 0.488 7.442 -1.489 1.00 . A A . 3 ILE C 1 1
5 984 1 1 3 ILE CA C -0.423 8.159 -2.543 1.00 . A A . 3 ILE CA 1 1
5 985 1 1 3 ILE CB C 0.357 8.960 -3.654 1.00 . A A . 3 ILE CB 1 1
5 986 1 1 3 ILE CD1 C -1.391 8.575 -5.602 1.00 . A A . 3 ILE CD1 1 1
5 987 1 1 3 ILE CG1 C -0.541 9.565 -4.782 1.00 . A A . 3 ILE CG1 1 1
5 988 1 1 3 ILE CG2 C 1.520 8.166 -4.309 1.00 . A A . 3 ILE CG2 1 1
5 989 1 1 3 ILE H H -1.491 9.993 -1.926 1.00 . A A . 3 ILE H 1 1
5 990 1 1 3 ILE HA H -0.921 7.343 -3.067 1.00 . A A . 3 ILE HA 1 1
5 991 1 1 3 ILE HB H 0.835 9.821 -3.147 1.00 . A A . 3 ILE HB 1 1
5 992 1 1 3 ILE HD11 H -2.107 8.022 -4.967 1.00 . A A . 3 ILE HD11 1 1
5 993 1 1 3 ILE HD12 H -1.983 9.101 -6.372 1.00 . A A . 3 ILE HD12 1 1
5 994 1 1 3 ILE HD13 H -0.767 7.828 -6.126 1.00 . A A . 3 ILE HD13 1 1
5 995 1 1 3 ILE HG12 H -1.220 10.318 -4.339 1.00 . A A . 3 ILE HG12 1 1
5 996 1 1 3 ILE HG13 H 0.087 10.152 -5.480 1.00 . A A . 3 ILE HG13 1 1
5 997 1 1 3 ILE HG21 H 1.170 7.227 -4.777 1.00 . A A . 3 ILE HG21 1 1
5 998 1 1 3 ILE HG22 H 2.033 8.753 -5.094 1.00 . A A . 3 ILE HG22 1 1
5 999 1 1 3 ILE HG23 H 2.296 7.890 -3.573 1.00 . A A . 3 ILE HG23 1 1
5 1000 1 1 3 ILE N N -1.528 8.967 -1.947 1.00 . A A . 3 ILE N 1 1
5 1001 1 1 3 ILE O O 0.858 6.289 -1.711 1.00 . A A . 3 ILE O 1 1
5 1002 1 1 4 GLN C C 0.731 6.307 1.502 1.00 . A A . 4 GLN C 1 1
5 1003 1 1 4 GLN CA C 1.518 7.447 0.790 1.00 . A A . 4 GLN CA 1 1
5 1004 1 1 4 GLN CB C 1.995 8.525 1.800 1.00 . A A . 4 GLN CB 1 1
5 1005 1 1 4 GLN CD C 3.637 10.459 2.244 1.00 . A A . 4 GLN CD 1 1
5 1006 1 1 4 GLN CG C 3.274 9.262 1.347 1.00 . A A . 4 GLN CG 1 1
5 1007 1 1 4 GLN H H 0.405 9.027 -0.305 1.00 . A A . 4 GLN H 1 1
5 1008 1 1 4 GLN HA H 2.422 6.960 0.378 1.00 . A A . 4 GLN HA 1 1
5 1009 1 1 4 GLN HB2 H 1.177 9.243 2.004 1.00 . A A . 4 GLN HB2 1 1
5 1010 1 1 4 GLN HB3 H 2.211 8.063 2.783 1.00 . A A . 4 GLN HB3 1 1
5 1011 1 1 4 GLN HE21 H 3.290 11.742 0.739 1.00 . A A . 4 GLN HE21 1 1
5 1012 1 1 4 GLN HE22 H 3.886 12.446 2.323 1.00 . A A . 4 GLN HE22 1 1
5 1013 1 1 4 GLN HG2 H 4.113 8.540 1.352 1.00 . A A . 4 GLN HG2 1 1
5 1014 1 1 4 GLN HG3 H 3.171 9.567 0.288 1.00 . A A . 4 GLN HG3 1 1
5 1015 1 1 4 GLN N N 0.819 8.094 -0.360 1.00 . A A . 4 GLN N 1 1
5 1016 1 1 4 GLN NE2 N 3.584 11.674 1.720 1.00 . A A . 4 GLN NE2 1 1
5 1017 1 1 4 GLN O O 1.327 5.261 1.768 1.00 . A A . 4 GLN O 1 1
5 1018 1 1 4 GLN OE1 O 3.979 10.301 3.415 1.00 . A A . 4 GLN OE1 1 1
5 1019 1 1 5 . C C -1.458 4.122 1.317 1.00 . A A . 5 DIV C 1 1
5 1020 1 1 5 . CA C -1.520 5.406 2.246 1.00 . A A . 5 DIV CA 1 1
5 1021 1 1 5 . CB1 C -1.202 5.131 3.764 1.00 . A A . 5 DIV CB1 1 1
5 1022 1 1 5 . CB2 C -2.941 6.036 2.156 1.00 . A A . 5 DIV CB2 1 1
5 1023 1 1 5 . CG1 C -2.145 4.206 4.562 1.00 . A A . 5 DIV CG1 1 1
5 1024 1 1 5 . H H -0.932 7.411 1.508 1.00 . A A . 5 DIV H 1 1
5 1025 1 1 5 . HB11 H -0.180 4.721 3.859 1.00 . A A . 5 DIV HB11 1 1
5 1026 1 1 5 . HB12 H -1.160 6.092 4.314 1.00 . A A . 5 DIV HB12 1 1
5 1027 1 1 5 . HB21 H -3.206 6.348 1.131 1.00 . A A . 5 DIV HB21 1 1
5 1028 1 1 5 . HB22 H -3.729 5.327 2.466 1.00 . A A . 5 DIV HB22 1 1
5 1029 1 1 5 . HB23 H -3.051 6.930 2.797 1.00 . A A . 5 DIV HB23 1 1
5 1030 1 1 5 . HG11 H -2.244 3.206 4.105 1.00 . A A . 5 DIV HG11 1 1
5 1031 1 1 5 . HG12 H -1.774 4.056 5.593 1.00 . A A . 5 DIV HG12 1 1
5 1032 1 1 5 . HG13 H -3.161 4.633 4.650 1.00 . A A . 5 DIV HG13 1 1
5 1033 1 1 5 . N N -0.585 6.485 1.776 1.00 . A A . 5 DIV N 1 1
5 1034 1 1 5 . O O -1.198 3.017 1.803 1.00 . A A . 5 DIV O 1 1
5 1035 1 1 6 ILE C C -0.134 2.505 -1.175 1.00 . A A . 6 ILE C 1 1
5 1036 1 1 6 ILE CA C -1.558 3.125 -0.985 1.00 . A A . 6 ILE CA 1 1
5 1037 1 1 6 ILE CB C -2.349 3.344 -2.326 1.00 . A A . 6 ILE CB 1 1
5 1038 1 1 6 ILE CD1 C -0.767 4.037 -4.300 1.00 . A A . 6 ILE CD1 1 1
5 1039 1 1 6 ILE CG1 C -1.822 4.468 -3.268 1.00 . A A . 6 ILE CG1 1 1
5 1040 1 1 6 ILE CG2 C -3.866 3.543 -2.073 1.00 . A A . 6 ILE CG2 1 1
5 1041 1 1 6 ILE H H -1.962 5.180 -0.340 1.00 . A A . 6 ILE H 1 1
5 1042 1 1 6 ILE HA H -2.129 2.332 -0.484 1.00 . A A . 6 ILE HA 1 1
5 1043 1 1 6 ILE HB H -2.294 2.392 -2.887 1.00 . A A . 6 ILE HB 1 1
5 1044 1 1 6 ILE HD11 H -1.181 3.299 -5.012 1.00 . A A . 6 ILE HD11 1 1
5 1045 1 1 6 ILE HD12 H -0.413 4.902 -4.892 1.00 . A A . 6 ILE HD12 1 1
5 1046 1 1 6 ILE HD13 H 0.125 3.582 -3.837 1.00 . A A . 6 ILE HD13 1 1
5 1047 1 1 6 ILE HG12 H -2.650 4.923 -3.847 1.00 . A A . 6 ILE HG12 1 1
5 1048 1 1 6 ILE HG13 H -1.425 5.295 -2.659 1.00 . A A . 6 ILE HG13 1 1
5 1049 1 1 6 ILE HG21 H -4.080 4.499 -1.561 1.00 . A A . 6 ILE HG21 1 1
5 1050 1 1 6 ILE HG22 H -4.441 3.544 -3.018 1.00 . A A . 6 ILE HG22 1 1
5 1051 1 1 6 ILE HG23 H -4.287 2.734 -1.450 1.00 . A A . 6 ILE HG23 1 1
5 1052 1 1 6 ILE N N -1.635 4.263 -0.027 1.00 . A A . 6 ILE N 1 1
5 1053 1 1 6 ILE O O -0.039 1.278 -1.198 1.00 . A A . 6 ILE O 1 1
5 1054 1 1 7 THR C C 2.850 1.947 -0.158 1.00 . A A . 7 THR C 1 1
5 1055 1 1 7 THR CA C 2.358 2.779 -1.394 1.00 . A A . 7 THR CA 1 1
5 1056 1 1 7 THR CB C 3.315 3.956 -1.766 1.00 . A A . 7 THR CB 1 1
5 1057 1 1 7 THR CG2 C 4.781 3.555 -2.013 1.00 . A A . 7 THR CG2 1 1
5 1058 1 1 7 THR H H 0.758 4.304 -1.222 1.00 . A A . 7 THR H 1 1
5 1059 1 1 7 THR HA H 2.366 2.089 -2.261 1.00 . A A . 7 THR HA 1 1
5 1060 1 1 7 THR HB H 3.297 4.709 -0.953 1.00 . A A . 7 THR HB 1 1
5 1061 1 1 7 THR HG1 H 3.460 5.328 -3.109 1.00 . A A . 7 THR HG1 1 1
5 1062 1 1 7 THR HG21 H 5.390 4.426 -2.315 1.00 . A A . 7 THR HG21 1 1
5 1063 1 1 7 THR HG22 H 5.255 3.131 -1.109 1.00 . A A . 7 THR HG22 1 1
5 1064 1 1 7 THR HG23 H 4.865 2.800 -2.816 1.00 . A A . 7 THR HG23 1 1
5 1065 1 1 7 THR N N 0.955 3.298 -1.267 1.00 . A A . 7 THR N 1 1
5 1066 1 1 7 THR O O 3.424 0.872 -0.344 1.00 . A A . 7 THR O 1 1
5 1067 1 1 7 THR OG1 O 2.867 4.589 -2.962 1.00 . A A . 7 THR OG1 1 1
5 1068 1 1 8 ABA C C 1.803 0.311 2.367 1.00 . A A . 8 AIB C 1 1
5 1069 1 1 8 ABA CA C 2.685 1.623 2.343 1.00 . A A . 8 AIB CA 1 1
5 1070 1 1 8 ABA H H 1.982 3.243 1.020 1.00 . A A . 8 AIB H 1 1
5 1071 1 1 8 ABA N N 2.593 2.425 1.077 1.00 . A A . 8 AIB N 1 1
5 1072 1 1 8 ABA O O 2.196 -0.688 2.981 1.00 . A A . 8 AIB O 1 1
5 1073 1 1 9 LEU C C 0.290 -1.798 0.272 1.00 . A A . 9 LEU C 1 1
5 1074 1 1 9 LEU CA C -0.180 -0.919 1.473 1.00 . A A . 9 LEU CA 1 1
5 1075 1 1 9 LEU CB C -1.674 -0.512 1.301 1.00 . A A . 9 LEU CB 1 1
5 1076 1 1 9 LEU CD1 C -3.826 0.457 2.245 1.00 . A A . 9 LEU CD1 1 1
5 1077 1 1 9 LEU CD2 C -2.737 -1.467 3.451 1.00 . A A . 9 LEU CD2 1 1
5 1078 1 1 9 LEU CG C -2.479 -0.207 2.595 1.00 . A A . 9 LEU CG 1 1
5 1079 1 1 9 LEU H H 0.413 1.105 1.113 1.00 . A A . 9 LEU H 1 1
5 1080 1 1 9 LEU HA H -0.097 -1.553 2.367 1.00 . A A . 9 LEU HA 1 1
5 1081 1 1 9 LEU HB2 H -1.731 0.356 0.616 1.00 . A A . 9 LEU HB2 1 1
5 1082 1 1 9 LEU HB3 H -2.214 -1.302 0.749 1.00 . A A . 9 LEU HB3 1 1
5 1083 1 1 9 LEU HD11 H -4.470 -0.205 1.636 1.00 . A A . 9 LEU HD11 1 1
5 1084 1 1 9 LEU HD12 H -4.397 0.723 3.153 1.00 . A A . 9 LEU HD12 1 1
5 1085 1 1 9 LEU HD13 H -3.684 1.391 1.674 1.00 . A A . 9 LEU HD13 1 1
5 1086 1 1 9 LEU HD21 H -1.799 -1.921 3.817 1.00 . A A . 9 LEU HD21 1 1
5 1087 1 1 9 LEU HD22 H -3.342 -1.234 4.348 1.00 . A A . 9 LEU HD22 1 1
5 1088 1 1 9 LEU HD23 H -3.280 -2.249 2.886 1.00 . A A . 9 LEU HD23 1 1
5 1089 1 1 9 LEU HG H -1.907 0.514 3.208 1.00 . A A . 9 LEU HG 1 1
5 1090 1 1 9 LEU N N 0.614 0.305 1.717 1.00 . A A . 9 LEU N 1 1
5 1091 1 1 9 LEU O O -0.137 -2.951 0.230 1.00 . A A . 9 LEU O 1 1
5 1092 1 1 10 ABA C C 2.322 -3.527 -1.437 1.00 . A A . 10 AIB C 1 1
5 1093 1 1 10 ABA CA C 1.658 -2.128 -1.837 1.00 . A A . 10 AIB CA 1 1
5 1094 1 1 10 ABA H H 1.484 -0.361 -0.481 1.00 . A A . 10 AIB H 1 1
5 1095 1 1 10 ABA N N 1.133 -1.315 -0.685 1.00 . A A . 10 AIB N 1 1
5 1096 1 1 10 ABA O O 1.905 -4.547 -2.001 1.00 . A A . 10 AIB O 1 1
5 1097 1 1 11 HYP C C 2.687 -5.854 0.856 1.00 . A A . 11 HYP C 1 1
5 1098 1 1 11 HYP CA C 3.731 -5.016 0.040 1.00 . A A . 11 HYP CA 1 1
5 1099 1 1 11 HYP CB C 4.969 -4.644 0.880 1.00 . A A . 11 HYP CB 1 1
5 1100 1 1 11 HYP CD C 3.824 -2.580 0.352 1.00 . A A . 11 HYP CD 1 1
5 1101 1 1 11 HYP CG C 4.670 -3.250 1.437 1.00 . A A . 11 HYP CG 1 1
5 1102 1 1 11 HYP HA H 4.065 -5.640 -0.810 1.00 . A A . 11 HYP HA 1 1
5 1103 1 1 11 HYP HB2 H 5.186 -5.372 1.685 1.00 . A A . 11 HYP HB2 1 1
5 1104 1 1 11 HYP HB3 H 5.871 -4.613 0.236 1.00 . A A . 11 HYP HB3 1 1
5 1105 1 1 11 HYP HD1 H 6.233 -2.902 2.502 1.00 . A A . 11 HYP HD1 1 1
5 1106 1 1 11 HYP HD22 H 3.019 -2.008 0.832 1.00 . A A . 11 HYP HD22 1 1
5 1107 1 1 11 HYP HD23 H 4.389 -1.877 -0.276 1.00 . A A . 11 HYP HD23 1 1
5 1108 1 1 11 HYP HG H 4.076 -3.341 2.367 1.00 . A A . 11 HYP HG 1 1
5 1109 1 1 11 HYP N N 3.292 -3.680 -0.472 1.00 . A A . 11 HYP N 1 1
5 1110 1 1 11 HYP O O 2.868 -7.066 1.003 1.00 . A A . 11 HYP O 1 1
5 1111 1 1 11 HYP OD1 O 5.858 -2.516 1.707 1.00 . A A . 11 HYP OD1 1 1
5 1112 1 1 12 GLN C C -0.803 -6.044 0.973 1.00 . A A . 12 GLN C 1 1
5 1113 1 1 12 GLN CA C 0.427 -5.866 1.935 1.00 . A A . 12 GLN CA 1 1
5 1114 1 1 12 GLN CB C 0.073 -5.093 3.241 1.00 . A A . 12 GLN CB 1 1
5 1115 1 1 12 GLN CD C 0.795 -4.426 5.662 1.00 . A A . 12 GLN CD 1 1
5 1116 1 1 12 GLN CG C 1.121 -5.211 4.379 1.00 . A A . 12 GLN CG 1 1
5 1117 1 1 12 GLN H H 1.556 -4.223 1.178 1.00 . A A . 12 GLN H 1 1
5 1118 1 1 12 GLN HA H 0.742 -6.862 2.229 1.00 . A A . 12 GLN HA 1 1
5 1119 1 1 12 GLN HB2 H -0.116 -4.026 3.010 1.00 . A A . 12 GLN HB2 1 1
5 1120 1 1 12 GLN HB3 H -0.888 -5.464 3.645 1.00 . A A . 12 GLN HB3 1 1
5 1121 1 1 12 GLN HE21 H 2.212 -5.461 6.634 1.00 . A A . 12 GLN HE21 1 1
5 1122 1 1 12 GLN HE22 H 1.282 -4.207 7.594 1.00 . A A . 12 GLN HE22 1 1
5 1123 1 1 12 GLN HG2 H 1.252 -6.284 4.623 1.00 . A A . 12 GLN HG2 1 1
5 1124 1 1 12 GLN HG3 H 2.109 -4.869 4.013 1.00 . A A . 12 GLN HG3 1 1
5 1125 1 1 12 GLN N N 1.606 -5.216 1.347 1.00 . A A . 12 GLN N 1 1
5 1126 1 1 12 GLN NE2 N 1.499 -4.731 6.740 1.00 . A A . 12 GLN NE2 1 1
5 1127 1 1 12 GLN O O -1.869 -6.389 1.481 1.00 . A A . 12 GLN O 1 1
5 1128 1 1 12 GLN OE1 O -0.061 -3.540 5.707 1.00 . A A . 12 GLN OE1 1 1
5 1129 1 1 13 ABA C C -1.237 -8.100 -1.535 1.00 . A A . 13 AIB C 1 1
5 1130 1 1 13 ABA CA C -1.573 -6.543 -1.402 1.00 . A A . 13 AIB CA 1 1
5 1131 1 1 13 ABA H H 0.238 -5.528 -0.678 1.00 . A A . 13 AIB H 1 1
5 1132 1 1 13 ABA N N -0.689 -5.883 -0.377 1.00 . A A . 13 AIB N 1 1
5 1133 1 1 13 ABA O O -2.173 -8.899 -1.411 1.00 . A A . 13 AIB O 1 1
5 1134 1 1 14 HYP C C 0.170 -10.952 -0.629 1.00 . A A . 14 HYP C 1 1
5 1135 1 1 14 HYP CA C 0.311 -10.074 -1.911 1.00 . A A . 14 HYP CA 1 1
5 1136 1 1 14 HYP CB C 1.748 -10.093 -2.477 1.00 . A A . 14 HYP CB 1 1
5 1137 1 1 14 HYP CD C 1.246 -7.809 -1.960 1.00 . A A . 14 HYP CD 1 1
5 1138 1 1 14 HYP CG C 2.384 -8.821 -1.919 1.00 . A A . 14 HYP CG 1 1
5 1139 1 1 14 HYP HA H -0.361 -10.497 -2.684 1.00 . A A . 14 HYP HA 1 1
5 1140 1 1 14 HYP HB2 H 2.323 -10.998 -2.207 1.00 . A A . 14 HYP HB2 1 1
5 1141 1 1 14 HYP HB3 H 1.722 -10.061 -3.583 1.00 . A A . 14 HYP HB3 1 1
5 1142 1 1 14 HYP HD1 H 3.137 -8.103 -3.538 1.00 . A A . 14 HYP HD1 1 1
5 1143 1 1 14 HYP HD22 H 1.399 -7.060 -1.174 1.00 . A A . 14 HYP HD22 1 1
5 1144 1 1 14 HYP HD23 H 1.216 -7.269 -2.922 1.00 . A A . 14 HYP HD23 1 1
5 1145 1 1 14 HYP HG H 2.683 -8.984 -0.863 1.00 . A A . 14 HYP HG 1 1
5 1146 1 1 14 HYP N N 0.024 -8.616 -1.765 1.00 . A A . 14 HYP N 1 1
5 1147 1 1 14 HYP O O -0.422 -12.031 -0.722 1.00 . A A . 14 HYP O 1 1
5 1148 1 1 14 HYP OD1 O 3.496 -8.389 -2.694 1.00 . A A . 14 HYP OD1 1 1
5 1149 1 1 15 ABA C C -0.859 -11.706 2.231 1.00 . A A . 15 AIB C 1 1
5 1150 1 1 15 ABA CA C 0.618 -11.238 1.848 1.00 . A A . 15 AIB CA 1 1
5 1151 1 1 15 ABA H H 1.167 -9.600 0.468 1.00 . A A . 15 AIB H 1 1
5 1152 1 1 15 ABA N N 0.713 -10.518 0.537 1.00 . A A . 15 AIB N 1 1
5 1153 1 1 15 ABA O O -1.031 -12.900 2.505 1.00 . A A . 15 AIB O 1 1
5 1154 1 1 16 PRO C C -3.937 -12.056 0.983 1.00 . A A . 16 PRO C 1 1
5 1155 1 1 16 PRO CA C -3.358 -11.406 2.286 1.00 . A A . 16 PRO CA 1 1
5 1156 1 1 16 PRO CB C -4.142 -10.161 2.739 1.00 . A A . 16 PRO CB 1 1
5 1157 1 1 16 PRO CD C -1.922 -9.419 2.097 1.00 . A A . 16 PRO CD 1 1
5 1158 1 1 16 PRO CG C -3.390 -8.977 2.133 1.00 . A A . 16 PRO CG 1 1
5 1159 1 1 16 PRO HA H -3.424 -12.157 3.098 1.00 . A A . 16 PRO HA 1 1
5 1160 1 1 16 PRO HB2 H -5.208 -10.173 2.442 1.00 . A A . 16 PRO HB2 1 1
5 1161 1 1 16 PRO HB3 H -4.128 -10.085 3.844 1.00 . A A . 16 PRO HB3 1 1
5 1162 1 1 16 PRO HD2 H -1.438 -9.073 1.169 1.00 . A A . 16 PRO HD2 1 1
5 1163 1 1 16 PRO HD3 H -1.359 -8.978 2.935 1.00 . A A . 16 PRO HD3 1 1
5 1164 1 1 16 PRO HG2 H -3.751 -8.784 1.105 1.00 . A A . 16 PRO HG2 1 1
5 1165 1 1 16 PRO HG3 H -3.540 -8.048 2.711 1.00 . A A . 16 PRO HG3 1 1
5 1166 1 1 16 PRO N N -1.964 -10.890 2.198 1.00 . A A . 16 PRO N 1 1
5 1167 1 1 16 PRO O O -4.622 -13.076 1.102 1.00 . A A . 16 PRO O 1 1
5 1168 1 1 17 PHL C C -3.299 -11.990 -2.587 1.00 . A A . 17 PHL C 1 1
5 1169 1 1 17 PHL CA C -4.371 -11.927 -1.474 1.00 . A A . 17 PHL CA 1 1
5 1170 1 1 17 PHL CB C -5.554 -10.986 -1.852 1.00 . A A . 17 PHL CB 1 1
5 1171 1 1 17 PHL CD1 C -7.651 -12.149 -0.975 1.00 . A A . 17 PHL CD1 1 1
5 1172 1 1 17 PHL CD2 C -7.010 -10.045 0.023 1.00 . A A . 17 PHL CD2 1 1
5 1173 1 1 17 PHL CE1 C -8.733 -12.232 -0.101 1.00 . A A . 17 PHL CE1 1 1
5 1174 1 1 17 PHL CE2 C -8.091 -10.130 0.896 1.00 . A A . 17 PHL CE2 1 1
5 1175 1 1 17 PHL CG C -6.776 -11.056 -0.915 1.00 . A A . 17 PHL CG 1 1
5 1176 1 1 17 PHL CZ C -8.954 -11.222 0.833 1.00 . A A . 17 PHL CZ 1 1
5 1177 1 1 17 PHL H H -3.157 -10.607 -0.201 1.00 . A A . 17 PHL H 1 1
5 1178 1 1 17 PHL HA H -4.761 -12.959 -1.363 1.00 . A A . 17 PHL HA 1 1
5 1179 1 1 17 PHL HB2 H -5.188 -9.943 -1.938 1.00 . A A . 17 PHL HB2 1 1
5 1180 1 1 17 PHL HB3 H -5.897 -11.228 -2.876 1.00 . A A . 17 PHL HB3 1 1
5 1181 1 1 17 PHL HC1 H -2.435 -12.600 -2.263 1.00 . A A . 17 PHL HC1 1 1
5 1182 1 1 17 PHL HC2 H -2.893 -10.987 -2.820 1.00 . A A . 17 PHL HC2 1 1
5 1183 1 1 17 PHL HD1 H -7.487 -12.944 -1.688 1.00 . A A . 17 PHL HD1 1 1
5 1184 1 1 17 PHL HD2 H -6.344 -9.196 0.093 1.00 . A A . 17 PHL HD2 1 1
5 1185 1 1 17 PHL HE1 H -9.398 -13.082 -0.145 1.00 . A A . 17 PHL HE1 1 1
5 1186 1 1 17 PHL HE2 H -8.262 -9.353 1.626 1.00 . A A . 17 PHL HE2 1 1
5 1187 1 1 17 PHL HO H -4.516 -11.977 -4.077 1.00 . A A . 17 PHL HO 1 1
5 1188 1 1 17 PHL HZ H -9.792 -11.290 1.512 1.00 . A A . 17 PHL HZ 1 1
5 1189 1 1 17 PHL N N -3.717 -11.469 -0.219 1.00 . A A . 17 PHL N 1 1
5 1190 1 1 17 PHL O O -3.826 -12.572 -3.774 1.00 . A A . 17 PHL O 1 1
6 1191 1 1 1 ACE C C -1.878 10.973 0.977 1.00 . A A . 1 ACE C 1 1
6 1192 1 1 1 ACE CH3 C -1.288 12.375 0.965 1.00 . A A . 1 ACE CH3 1 1
6 1193 1 1 1 ACE H1 H -0.918 12.631 -0.047 1.00 . A A . 1 ACE H1 1 1
6 1194 1 1 1 ACE H2 H -2.031 13.134 1.263 1.00 . A A . 1 ACE H2 1 1
6 1195 1 1 1 ACE H3 H -0.426 12.447 1.650 1.00 . A A . 1 ACE H3 1 1
6 1196 1 1 1 ACE O O -1.351 10.073 1.638 1.00 . A A . 1 ACE O 1 1
6 1197 1 1 2 TRP C C -2.418 8.545 -1.065 1.00 . A A . 2 TRP C 1 1
6 1198 1 1 2 TRP CA C -3.413 9.434 -0.234 1.00 . A A . 2 TRP CA 1 1
6 1199 1 1 2 TRP CB C -4.837 9.533 -0.860 1.00 . A A . 2 TRP CB 1 1
6 1200 1 1 2 TRP CD1 C -5.095 8.988 -3.404 1.00 . A A . 2 TRP CD1 1 1
6 1201 1 1 2 TRP CD2 C -4.879 11.156 -2.951 1.00 . A A . 2 TRP CD2 1 1
6 1202 1 1 2 TRP CE2 C -4.980 10.966 -4.354 1.00 . A A . 2 TRP CE2 1 1
6 1203 1 1 2 TRP CE3 C -4.726 12.460 -2.415 1.00 . A A . 2 TRP CE3 1 1
6 1204 1 1 2 TRP CG C -4.943 9.911 -2.348 1.00 . A A . 2 TRP CG 1 1
6 1205 1 1 2 TRP CH2 C -4.765 13.353 -4.682 1.00 . A A . 2 TRP CH2 1 1
6 1206 1 1 2 TRP CZ2 C -4.921 12.079 -5.229 1.00 . A A . 2 TRP CZ2 1 1
6 1207 1 1 2 TRP CZ3 C -4.669 13.540 -3.296 1.00 . A A . 2 TRP CZ3 1 1
6 1208 1 1 2 TRP H H -3.304 11.632 -0.273 1.00 . A A . 2 TRP H 1 1
6 1209 1 1 2 TRP HA H -3.567 8.901 0.720 1.00 . A A . 2 TRP HA 1 1
6 1210 1 1 2 TRP HB2 H -5.338 8.555 -0.719 1.00 . A A . 2 TRP HB2 1 1
6 1211 1 1 2 TRP HB3 H -5.468 10.224 -0.268 1.00 . A A . 2 TRP HB3 1 1
6 1212 1 1 2 TRP HD1 H -5.167 7.918 -3.272 1.00 . A A . 2 TRP HD1 1 1
6 1213 1 1 2 TRP HE1 H -5.197 9.186 -5.583 1.00 . A A . 2 TRP HE1 1 1
6 1214 1 1 2 TRP HE3 H -4.652 12.622 -1.349 1.00 . A A . 2 TRP HE3 1 1
6 1215 1 1 2 TRP HH2 H -4.714 14.209 -5.339 1.00 . A A . 2 TRP HH2 1 1
6 1216 1 1 2 TRP HZ2 H -4.992 11.946 -6.299 1.00 . A A . 2 TRP HZ2 1 1
6 1217 1 1 2 TRP HZ3 H -4.547 14.539 -2.904 1.00 . A A . 2 TRP HZ3 1 1
6 1218 1 1 2 TRP N N -2.927 10.788 0.160 1.00 . A A . 2 TRP N 1 1
6 1219 1 1 2 TRP NE1 N -5.116 9.621 -4.658 1.00 . A A . 2 TRP NE1 1 1
6 1220 1 1 2 TRP O O -2.599 7.326 -1.114 1.00 . A A . 2 TRP O 1 1
6 1221 1 1 3 ILE C C 0.614 7.532 -1.377 1.00 . A A . 3 ILE C 1 1
6 1222 1 1 3 ILE CA C -0.268 8.383 -2.355 1.00 . A A . 3 ILE CA 1 1
6 1223 1 1 3 ILE CB C 0.498 9.309 -3.373 1.00 . A A . 3 ILE CB 1 1
6 1224 1 1 3 ILE CD1 C 2.143 7.534 -4.488 1.00 . A A . 3 ILE CD1 1 1
6 1225 1 1 3 ILE CG1 C 1.039 8.592 -4.645 1.00 . A A . 3 ILE CG1 1 1
6 1226 1 1 3 ILE CG2 C 1.552 10.253 -2.743 1.00 . A A . 3 ILE CG2 1 1
6 1227 1 1 3 ILE H H -1.330 10.154 -1.578 1.00 . A A . 3 ILE H 1 1
6 1228 1 1 3 ILE HA H -0.799 7.645 -2.966 1.00 . A A . 3 ILE HA 1 1
6 1229 1 1 3 ILE HB H -0.258 10.000 -3.800 1.00 . A A . 3 ILE HB 1 1
6 1230 1 1 3 ILE HD11 H 1.769 6.632 -3.974 1.00 . A A . 3 ILE HD11 1 1
6 1231 1 1 3 ILE HD12 H 2.511 7.202 -5.474 1.00 . A A . 3 ILE HD12 1 1
6 1232 1 1 3 ILE HD13 H 3.012 7.914 -3.923 1.00 . A A . 3 ILE HD13 1 1
6 1233 1 1 3 ILE HG12 H 0.190 8.122 -5.178 1.00 . A A . 3 ILE HG12 1 1
6 1234 1 1 3 ILE HG13 H 1.407 9.360 -5.352 1.00 . A A . 3 ILE HG13 1 1
6 1235 1 1 3 ILE HG21 H 2.419 9.699 -2.338 1.00 . A A . 3 ILE HG21 1 1
6 1236 1 1 3 ILE HG22 H 1.945 10.976 -3.482 1.00 . A A . 3 ILE HG22 1 1
6 1237 1 1 3 ILE HG23 H 1.125 10.846 -1.913 1.00 . A A . 3 ILE HG23 1 1
6 1238 1 1 3 ILE N N -1.373 9.137 -1.696 1.00 . A A . 3 ILE N 1 1
6 1239 1 1 3 ILE O O 0.893 6.367 -1.664 1.00 . A A . 3 ILE O 1 1
6 1240 1 1 4 GLN C C 0.738 6.195 1.527 1.00 . A A . 4 GLN C 1 1
6 1241 1 1 4 GLN CA C 1.617 7.318 0.906 1.00 . A A . 4 GLN CA 1 1
6 1242 1 1 4 GLN CB C 2.132 8.280 2.009 1.00 . A A . 4 GLN CB 1 1
6 1243 1 1 4 GLN CD C 3.979 9.994 2.676 1.00 . A A . 4 GLN CD 1 1
6 1244 1 1 4 GLN CG C 3.467 8.965 1.649 1.00 . A A . 4 GLN CG 1 1
6 1245 1 1 4 GLN H H 0.613 9.029 -0.082 1.00 . A A . 4 GLN H 1 1
6 1246 1 1 4 GLN HA H 2.495 6.805 0.475 1.00 . A A . 4 GLN HA 1 1
6 1247 1 1 4 GLN HB2 H 1.361 9.037 2.252 1.00 . A A . 4 GLN HB2 1 1
6 1248 1 1 4 GLN HB3 H 2.295 7.728 2.957 1.00 . A A . 4 GLN HB3 1 1
6 1249 1 1 4 GLN HE21 H 5.423 10.524 1.392 1.00 . A A . 4 GLN HE21 1 1
6 1250 1 1 4 GLN HE22 H 5.384 11.384 3.014 1.00 . A A . 4 GLN HE22 1 1
6 1251 1 1 4 GLN HG2 H 4.232 8.175 1.514 1.00 . A A . 4 GLN HG2 1 1
6 1252 1 1 4 GLN HG3 H 3.361 9.447 0.659 1.00 . A A . 4 GLN HG3 1 1
6 1253 1 1 4 GLN N N 0.987 8.085 -0.208 1.00 . A A . 4 GLN N 1 1
6 1254 1 1 4 GLN NE2 N 5.034 10.710 2.324 1.00 . A A . 4 GLN NE2 1 1
6 1255 1 1 4 GLN O O 1.267 5.106 1.762 1.00 . A A . 4 GLN O 1 1
6 1256 1 1 4 GLN OE1 O 3.461 10.159 3.781 1.00 . A A . 4 GLN OE1 1 1
6 1257 1 1 5 . C C -1.550 4.125 1.243 1.00 . A A . 5 DIV C 1 1
6 1258 1 1 5 . CA C -1.567 5.393 2.201 1.00 . A A . 5 DIV CA 1 1
6 1259 1 1 5 . CB1 C -1.273 5.079 3.719 1.00 . A A . 5 DIV CB1 1 1
6 1260 1 1 5 . CB2 C -2.959 6.082 2.112 1.00 . A A . 5 DIV CB2 1 1
6 1261 1 1 5 . CG1 C -2.264 4.206 4.515 1.00 . A A . 5 DIV CG1 1 1
6 1262 1 1 5 . H H -0.870 7.383 1.502 1.00 . A A . 5 DIV H 1 1
6 1263 1 1 5 . HB11 H -0.278 4.604 3.808 1.00 . A A . 5 DIV HB11 1 1
6 1264 1 1 5 . HB12 H -1.169 6.026 4.284 1.00 . A A . 5 DIV HB12 1 1
6 1265 1 1 5 . HB21 H -3.210 6.407 1.089 1.00 . A A . 5 DIV HB21 1 1
6 1266 1 1 5 . HB22 H -3.776 5.402 2.417 1.00 . A A . 5 DIV HB22 1 1
6 1267 1 1 5 . HB23 H -3.035 6.978 2.757 1.00 . A A . 5 DIV HB23 1 1
6 1268 1 1 5 . HG11 H -2.448 3.230 4.035 1.00 . A A . 5 DIV HG11 1 1
6 1269 1 1 5 . HG12 H -1.879 4.001 5.531 1.00 . A A . 5 DIV HG12 1 1
6 1270 1 1 5 . HG13 H -3.243 4.705 4.638 1.00 . A A . 5 DIV HG13 1 1
6 1271 1 1 5 . N N -0.576 6.436 1.766 1.00 . A A . 5 DIV N 1 1
6 1272 1 1 5 . O O -1.379 2.997 1.714 1.00 . A A . 5 DIV O 1 1
6 1273 1 1 6 ILE C C -0.120 2.546 -1.214 1.00 . A A . 6 ILE C 1 1
6 1274 1 1 6 ILE CA C -1.538 3.193 -1.091 1.00 . A A . 6 ILE CA 1 1
6 1275 1 1 6 ILE CB C -2.248 3.519 -2.451 1.00 . A A . 6 ILE CB 1 1
6 1276 1 1 6 ILE CD1 C -3.539 2.394 -4.440 1.00 . A A . 6 ILE CD1 1 1
6 1277 1 1 6 ILE CG1 C -2.571 2.225 -3.259 1.00 . A A . 6 ILE CG1 1 1
6 1278 1 1 6 ILE CG2 C -1.501 4.563 -3.318 1.00 . A A . 6 ILE CG2 1 1
6 1279 1 1 6 ILE H H -1.878 5.247 -0.418 1.00 . A A . 6 ILE H 1 1
6 1280 1 1 6 ILE HA H -2.167 2.412 -0.642 1.00 . A A . 6 ILE HA 1 1
6 1281 1 1 6 ILE HB H -3.227 3.970 -2.197 1.00 . A A . 6 ILE HB 1 1
6 1282 1 1 6 ILE HD11 H -3.123 3.051 -5.224 1.00 . A A . 6 ILE HD11 1 1
6 1283 1 1 6 ILE HD12 H -3.754 1.422 -4.920 1.00 . A A . 6 ILE HD12 1 1
6 1284 1 1 6 ILE HD13 H -4.504 2.823 -4.118 1.00 . A A . 6 ILE HD13 1 1
6 1285 1 1 6 ILE HG12 H -1.634 1.760 -3.623 1.00 . A A . 6 ILE HG12 1 1
6 1286 1 1 6 ILE HG13 H -3.014 1.473 -2.578 1.00 . A A . 6 ILE HG13 1 1
6 1287 1 1 6 ILE HG21 H -0.529 4.184 -3.690 1.00 . A A . 6 ILE HG21 1 1
6 1288 1 1 6 ILE HG22 H -2.093 4.870 -4.199 1.00 . A A . 6 ILE HG22 1 1
6 1289 1 1 6 ILE HG23 H -1.300 5.484 -2.746 1.00 . A A . 6 ILE HG23 1 1
6 1290 1 1 6 ILE N N -1.650 4.302 -0.104 1.00 . A A . 6 ILE N 1 1
6 1291 1 1 6 ILE O O -0.057 1.319 -1.234 1.00 . A A . 6 ILE O 1 1
6 1292 1 1 7 THR C C 2.784 1.850 -0.137 1.00 . A A . 7 THR C 1 1
6 1293 1 1 7 THR CA C 2.381 2.762 -1.348 1.00 . A A . 7 THR CA 1 1
6 1294 1 1 7 THR CB C 3.387 3.927 -1.607 1.00 . A A . 7 THR CB 1 1
6 1295 1 1 7 THR CG2 C 4.855 3.503 -1.797 1.00 . A A . 7 THR CG2 1 1
6 1296 1 1 7 THR H H 0.810 4.325 -1.236 1.00 . A A . 7 THR H 1 1
6 1297 1 1 7 THR HA H 2.416 2.117 -2.248 1.00 . A A . 7 THR HA 1 1
6 1298 1 1 7 THR HB H 3.346 4.640 -0.761 1.00 . A A . 7 THR HB 1 1
6 1299 1 1 7 THR HG1 H 3.637 5.367 -2.861 1.00 . A A . 7 THR HG1 1 1
6 1300 1 1 7 THR HG21 H 5.505 4.373 -2.001 1.00 . A A . 7 THR HG21 1 1
6 1301 1 1 7 THR HG22 H 5.262 3.005 -0.898 1.00 . A A . 7 THR HG22 1 1
6 1302 1 1 7 THR HG23 H 4.970 2.802 -2.647 1.00 . A A . 7 THR HG23 1 1
6 1303 1 1 7 THR N N 0.988 3.314 -1.274 1.00 . A A . 7 THR N 1 1
6 1304 1 1 7 THR O O 3.338 0.772 -0.354 1.00 . A A . 7 THR O 1 1
6 1305 1 1 7 THR OG1 O 3.023 4.633 -2.791 1.00 . A A . 7 THR OG1 1 1
6 1306 1 1 8 ABA C C 1.568 0.097 2.239 1.00 . A A . 8 AIB C 1 1
6 1307 1 1 8 ABA CA C 2.485 1.383 2.333 1.00 . A A . 8 AIB CA 1 1
6 1308 1 1 8 ABA H H 1.865 3.083 1.066 1.00 . A A . 8 AIB H 1 1
6 1309 1 1 8 ABA N N 2.470 2.259 1.111 1.00 . A A . 8 AIB N 1 1
6 1310 1 1 8 ABA O O 1.916 -0.958 2.783 1.00 . A A . 8 AIB O 1 1
6 1311 1 1 9 LEU C C 0.131 -1.847 -0.027 1.00 . A A . 9 LEU C 1 1
6 1312 1 1 9 LEU CA C -0.402 -1.013 1.176 1.00 . A A . 9 LEU CA 1 1
6 1313 1 1 9 LEU CB C -1.875 -0.565 0.959 1.00 . A A . 9 LEU CB 1 1
6 1314 1 1 9 LEU CD1 C -3.342 -2.023 2.481 1.00 . A A . 9 LEU CD1 1 1
6 1315 1 1 9 LEU CD2 C -2.314 0.067 3.470 1.00 . A A . 9 LEU CD2 1 1
6 1316 1 1 9 LEU CG C -2.838 -0.594 2.180 1.00 . A A . 9 LEU CG 1 1
6 1317 1 1 9 LEU H H 0.174 1.064 1.100 1.00 . A A . 9 LEU H 1 1
6 1318 1 1 9 LEU HA H -0.414 -1.693 2.036 1.00 . A A . 9 LEU HA 1 1
6 1319 1 1 9 LEU HB2 H -1.907 0.443 0.499 1.00 . A A . 9 LEU HB2 1 1
6 1320 1 1 9 LEU HB3 H -2.332 -1.201 0.179 1.00 . A A . 9 LEU HB3 1 1
6 1321 1 1 9 LEU HD11 H -2.531 -2.682 2.840 1.00 . A A . 9 LEU HD11 1 1
6 1322 1 1 9 LEU HD12 H -4.132 -2.025 3.254 1.00 . A A . 9 LEU HD12 1 1
6 1323 1 1 9 LEU HD13 H -3.780 -2.505 1.587 1.00 . A A . 9 LEU HD13 1 1
6 1324 1 1 9 LEU HD21 H -1.951 1.091 3.283 1.00 . A A . 9 LEU HD21 1 1
6 1325 1 1 9 LEU HD22 H -3.104 0.141 4.239 1.00 . A A . 9 LEU HD22 1 1
6 1326 1 1 9 LEU HD23 H -1.474 -0.500 3.914 1.00 . A A . 9 LEU HD23 1 1
6 1327 1 1 9 LEU HG H -3.704 0.008 1.862 1.00 . A A . 9 LEU HG 1 1
6 1328 1 1 9 LEU N N 0.405 0.170 1.549 1.00 . A A . 9 LEU N 1 1
6 1329 1 1 9 LEU O O -0.271 -3.009 -0.105 1.00 . A A . 9 LEU O 1 1
6 1330 1 1 10 ABA C C 2.283 -3.489 -1.631 1.00 . A A . 10 AIB C 1 1
6 1331 1 1 10 ABA CA C 1.583 -2.124 -2.081 1.00 . A A . 10 AIB CA 1 1
6 1332 1 1 10 ABA H H 1.365 -0.394 -0.694 1.00 . A A . 10 AIB H 1 1
6 1333 1 1 10 ABA N N 0.996 -1.332 -0.945 1.00 . A A . 10 AIB N 1 1
6 1334 1 1 10 ABA O O 1.890 -4.540 -2.157 1.00 . A A . 10 AIB O 1 1
6 1335 1 1 11 HYP C C 2.655 -5.690 0.787 1.00 . A A . 11 HYP C 1 1
6 1336 1 1 11 HYP CA C 3.695 -4.882 -0.064 1.00 . A A . 11 HYP CA 1 1
6 1337 1 1 11 HYP CB C 4.910 -4.453 0.780 1.00 . A A . 11 HYP CB 1 1
6 1338 1 1 11 HYP CD C 3.754 -2.438 0.125 1.00 . A A . 11 HYP CD 1 1
6 1339 1 1 11 HYP CG C 4.573 -3.043 1.267 1.00 . A A . 11 HYP CG 1 1
6 1340 1 1 11 HYP HA H 4.046 -5.542 -0.880 1.00 . A A . 11 HYP HA 1 1
6 1341 1 1 11 HYP HB2 H 5.127 -5.137 1.622 1.00 . A A . 11 HYP HB2 1 1
6 1342 1 1 11 HYP HB3 H 5.819 -4.435 0.149 1.00 . A A . 11 HYP HB3 1 1
6 1343 1 1 11 HYP HD1 H 6.248 -2.806 2.170 1.00 . A A . 11 HYP HD1 1 1
6 1344 1 1 11 HYP HD22 H 2.945 -1.821 0.540 1.00 . A A . 11 HYP HD22 1 1
6 1345 1 1 11 HYP HD23 H 4.343 -1.787 -0.532 1.00 . A A . 11 HYP HD23 1 1
6 1346 1 1 11 HYP HG H 3.948 -3.106 2.180 1.00 . A A . 11 HYP HG 1 1
6 1347 1 1 11 HYP N N 3.241 -3.582 -0.647 1.00 . A A . 11 HYP N 1 1
6 1348 1 1 11 HYP O O 2.854 -6.889 1.001 1.00 . A A . 11 HYP O 1 1
6 1349 1 1 11 HYP OD1 O 5.745 -2.289 1.538 1.00 . A A . 11 HYP OD1 1 1
6 1350 1 1 12 GLN C C -0.774 -6.060 0.856 1.00 . A A . 12 GLN C 1 1
6 1351 1 1 12 GLN CA C 0.388 -5.693 1.847 1.00 . A A . 12 GLN CA 1 1
6 1352 1 1 12 GLN CB C -0.115 -4.793 3.013 1.00 . A A . 12 GLN CB 1 1
6 1353 1 1 12 GLN CD C 0.357 -3.622 5.292 1.00 . A A . 12 GLN CD 1 1
6 1354 1 1 12 GLN CG C 0.853 -4.595 4.207 1.00 . A A . 12 GLN CG 1 1
6 1355 1 1 12 GLN H H 1.487 -4.066 1.013 1.00 . A A . 12 GLN H 1 1
6 1356 1 1 12 GLN HA H 0.748 -6.619 2.286 1.00 . A A . 12 GLN HA 1 1
6 1357 1 1 12 GLN HB2 H -0.403 -3.809 2.604 1.00 . A A . 12 GLN HB2 1 1
6 1358 1 1 12 GLN HB3 H -1.053 -5.210 3.424 1.00 . A A . 12 GLN HB3 1 1
6 1359 1 1 12 GLN HE21 H 2.039 -3.966 6.317 1.00 . A A . 12 GLN HE21 1 1
6 1360 1 1 12 GLN HE22 H 0.830 -2.799 7.058 1.00 . A A . 12 GLN HE22 1 1
6 1361 1 1 12 GLN HG2 H 1.062 -5.582 4.662 1.00 . A A . 12 GLN HG2 1 1
6 1362 1 1 12 GLN HG3 H 1.831 -4.231 3.837 1.00 . A A . 12 GLN HG3 1 1
6 1363 1 1 12 GLN N N 1.560 -5.048 1.239 1.00 . A A . 12 GLN N 1 1
6 1364 1 1 12 GLN NE2 N 1.157 -3.440 6.329 1.00 . A A . 12 GLN NE2 1 1
6 1365 1 1 12 GLN O O -1.809 -6.499 1.354 1.00 . A A . 12 GLN O 1 1
6 1366 1 1 12 GLN OE1 O -0.720 -3.023 5.224 1.00 . A A . 12 GLN OE1 1 1
6 1367 1 1 13 ABA C C -1.108 -8.247 -1.538 1.00 . A A . 13 AIB C 1 1
6 1368 1 1 13 ABA CA C -1.479 -6.691 -1.505 1.00 . A A . 13 AIB CA 1 1
6 1369 1 1 13 ABA H H 0.273 -5.563 -0.801 1.00 . A A . 13 AIB H 1 1
6 1370 1 1 13 ABA N N -0.642 -5.946 -0.499 1.00 . A A . 13 AIB N 1 1
6 1371 1 1 13 ABA O O -2.034 -9.060 -1.416 1.00 . A A . 13 AIB O 1 1
6 1372 1 1 14 HYP C C 0.315 -11.022 -0.408 1.00 . A A . 14 HYP C 1 1
6 1373 1 1 14 HYP CA C 0.491 -10.204 -1.726 1.00 . A A . 14 HYP CA 1 1
6 1374 1 1 14 HYP CB C 1.947 -10.219 -2.235 1.00 . A A . 14 HYP CB 1 1
6 1375 1 1 14 HYP CD C 1.381 -7.925 -1.875 1.00 . A A . 14 HYP CD 1 1
6 1376 1 1 14 HYP CG C 2.537 -8.907 -1.724 1.00 . A A . 14 HYP CG 1 1
6 1377 1 1 14 HYP HA H -0.140 -10.679 -2.503 1.00 . A A . 14 HYP HA 1 1
6 1378 1 1 14 HYP HB2 H 2.529 -11.100 -1.898 1.00 . A A . 14 HYP HB2 1 1
6 1379 1 1 14 HYP HB3 H 1.960 -10.240 -3.342 1.00 . A A . 14 HYP HB3 1 1
6 1380 1 1 14 HYP HD1 H 3.358 -8.322 -3.360 1.00 . A A . 14 HYP HD1 1 1
6 1381 1 1 14 HYP HD22 H 1.488 -7.124 -1.136 1.00 . A A . 14 HYP HD22 1 1
6 1382 1 1 14 HYP HD23 H 1.372 -7.447 -2.867 1.00 . A A . 14 HYP HD23 1 1
6 1383 1 1 14 HYP HG H 2.795 -9.000 -0.649 1.00 . A A . 14 HYP HG 1 1
6 1384 1 1 14 HYP N N 0.171 -8.746 -1.674 1.00 . A A . 14 HYP N 1 1
6 1385 1 1 14 HYP O O -0.221 -12.131 -0.473 1.00 . A A . 14 HYP O 1 1
6 1386 1 1 14 HYP OD1 O 3.675 -8.496 -2.471 1.00 . A A . 14 HYP OD1 1 1
6 1387 1 1 15 ABA C C -0.849 -11.641 2.440 1.00 . A A . 15 AIB C 1 1
6 1388 1 1 15 ABA CA C 0.635 -11.153 2.104 1.00 . A A . 15 AIB CA 1 1
6 1389 1 1 15 ABA H H 1.186 -9.567 0.671 1.00 . A A . 15 AIB H 1 1
6 1390 1 1 15 ABA N N 0.774 -10.502 0.761 1.00 . A A . 15 AIB N 1 1
6 1391 1 1 15 ABA O O -1.010 -12.832 2.738 1.00 . A A . 15 AIB O 1 1
6 1392 1 1 16 PRO C C -3.877 -12.083 1.090 1.00 . A A . 16 PRO C 1 1
6 1393 1 1 16 PRO CA C -3.358 -11.384 2.394 1.00 . A A . 16 PRO CA 1 1
6 1394 1 1 16 PRO CB C -4.175 -10.138 2.776 1.00 . A A . 16 PRO CB 1 1
6 1395 1 1 16 PRO CD C -1.947 -9.387 2.163 1.00 . A A . 16 PRO CD 1 1
6 1396 1 1 16 PRO CG C -3.417 -8.962 2.164 1.00 . A A . 16 PRO CG 1 1
6 1397 1 1 16 PRO HA H -3.447 -12.108 3.228 1.00 . A A . 16 PRO HA 1 1
6 1398 1 1 16 PRO HB2 H -5.230 -10.177 2.442 1.00 . A A . 16 PRO HB2 1 1
6 1399 1 1 16 PRO HB3 H -4.203 -10.026 3.878 1.00 . A A . 16 PRO HB3 1 1
6 1400 1 1 16 PRO HD2 H -1.463 -9.099 1.216 1.00 . A A . 16 PRO HD2 1 1
6 1401 1 1 16 PRO HD3 H -1.400 -8.885 2.978 1.00 . A A . 16 PRO HD3 1 1
6 1402 1 1 16 PRO HG2 H -3.758 -8.787 1.126 1.00 . A A . 16 PRO HG2 1 1
6 1403 1 1 16 PRO HG3 H -3.587 -8.020 2.718 1.00 . A A . 16 PRO HG3 1 1
6 1404 1 1 16 PRO N N -1.968 -10.848 2.343 1.00 . A A . 16 PRO N 1 1
6 1405 1 1 16 PRO O O -4.538 -13.116 1.211 1.00 . A A . 16 PRO O 1 1
6 1406 1 1 17 PHL C C -2.964 -12.598 -2.234 1.00 . A A . 17 PHL C 1 1
6 1407 1 1 17 PHL CA C -4.149 -12.061 -1.399 1.00 . A A . 17 PHL CA 1 1
6 1408 1 1 17 PHL CB C -4.954 -10.969 -2.163 1.00 . A A . 17 PHL CB 1 1
6 1409 1 1 17 PHL CD1 C -6.362 -9.333 -0.795 1.00 . A A . 17 PHL CD1 1 1
6 1410 1 1 17 PHL CD2 C -7.412 -11.355 -1.605 1.00 . A A . 17 PHL CD2 1 1
6 1411 1 1 17 PHL CE1 C -7.562 -8.955 -0.190 1.00 . A A . 17 PHL CE1 1 1
6 1412 1 1 17 PHL CE2 C -8.609 -10.975 -0.998 1.00 . A A . 17 PHL CE2 1 1
6 1413 1 1 17 PHL CG C -6.280 -10.537 -1.502 1.00 . A A . 17 PHL CG 1 1
6 1414 1 1 17 PHL CZ C -8.681 -9.777 -0.292 1.00 . A A . 17 PHL CZ 1 1
6 1415 1 1 17 PHL H H -3.027 -10.681 -0.095 1.00 . A A . 17 PHL H 1 1
6 1416 1 1 17 PHL HA H -4.828 -12.916 -1.218 1.00 . A A . 17 PHL HA 1 1
6 1417 1 1 17 PHL HB2 H -4.310 -10.086 -2.349 1.00 . A A . 17 PHL HB2 1 1
6 1418 1 1 17 PHL HB3 H -5.189 -11.338 -3.179 1.00 . A A . 17 PHL HB3 1 1
6 1419 1 1 17 PHL HC1 H -2.363 -13.313 -1.642 1.00 . A A . 17 PHL HC1 1 1
6 1420 1 1 17 PHL HC2 H -2.274 -11.781 -2.524 1.00 . A A . 17 PHL HC2 1 1
6 1421 1 1 17 PHL HD1 H -5.502 -8.687 -0.706 1.00 . A A . 17 PHL HD1 1 1
6 1422 1 1 17 PHL HD2 H -7.368 -12.287 -2.148 1.00 . A A . 17 PHL HD2 1 1
6 1423 1 1 17 PHL HE1 H -7.621 -8.027 0.356 1.00 . A A . 17 PHL HE1 1 1
6 1424 1 1 17 PHL HE2 H -9.478 -11.610 -1.077 1.00 . A A . 17 PHL HE2 1 1
6 1425 1 1 17 PHL HO H -3.850 -12.596 -3.943 1.00 . A A . 17 PHL HO 1 1
6 1426 1 1 17 PHL HZ H -9.609 -9.485 0.177 1.00 . A A . 17 PHL HZ 1 1
6 1427 1 1 17 PHL N N -3.615 -11.526 -0.116 1.00 . A A . 17 PHL N 1 1
6 1428 1 1 17 PHL O O -3.422 -13.266 -3.403 1.00 . A A . 17 PHL O 1 1
7 1429 1 1 1 ACE C C -1.770 10.330 1.336 1.00 . A A . 1 ACE C 1 1
7 1430 1 1 1 ACE CH3 C -0.801 11.476 1.594 1.00 . A A . 1 ACE CH3 1 1
7 1431 1 1 1 ACE H1 H -1.330 12.420 1.815 1.00 . A A . 1 ACE H1 1 1
7 1432 1 1 1 ACE H2 H -0.130 11.247 2.442 1.00 . A A . 1 ACE H2 1 1
7 1433 1 1 1 ACE H3 H -0.157 11.642 0.709 1.00 . A A . 1 ACE H3 1 1
7 1434 1 1 1 ACE O O -1.687 9.279 1.977 1.00 . A A . 1 ACE O 1 1
7 1435 1 1 2 TRP C C -2.432 8.485 -1.204 1.00 . A A . 2 TRP C 1 1
7 1436 1 1 2 TRP CA C -3.354 9.423 -0.352 1.00 . A A . 2 TRP CA 1 1
7 1437 1 1 2 TRP CB C -4.533 9.969 -1.208 1.00 . A A . 2 TRP CB 1 1
7 1438 1 1 2 TRP CD1 C -6.143 10.544 0.821 1.00 . A A . 2 TRP CD1 1 1
7 1439 1 1 2 TRP CD2 C -6.389 11.825 -0.985 1.00 . A A . 2 TRP CD2 1 1
7 1440 1 1 2 TRP CE2 C -7.297 12.239 0.025 1.00 . A A . 2 TRP CE2 1 1
7 1441 1 1 2 TRP CE3 C -6.380 12.472 -2.249 1.00 . A A . 2 TRP CE3 1 1
7 1442 1 1 2 TRP CG C -5.646 10.762 -0.487 1.00 . A A . 2 TRP CG 1 1
7 1443 1 1 2 TRP CH2 C -8.168 13.931 -1.470 1.00 . A A . 2 TRP CH2 1 1
7 1444 1 1 2 TRP CZ2 C -8.195 13.306 -0.220 1.00 . A A . 2 TRP CZ2 1 1
7 1445 1 1 2 TRP CZ3 C -7.279 13.518 -2.467 1.00 . A A . 2 TRP CZ3 1 1
7 1446 1 1 2 TRP H H -2.643 11.474 -0.060 1.00 . A A . 2 TRP H 1 1
7 1447 1 1 2 TRP HA H -3.798 8.812 0.447 1.00 . A A . 2 TRP HA 1 1
7 1448 1 1 2 TRP HB2 H -4.122 10.586 -2.031 1.00 . A A . 2 TRP HB2 1 1
7 1449 1 1 2 TRP HB3 H -5.027 9.122 -1.721 1.00 . A A . 2 TRP HB3 1 1
7 1450 1 1 2 TRP HD1 H -5.788 9.773 1.488 1.00 . A A . 2 TRP HD1 1 1
7 1451 1 1 2 TRP HE1 H -7.691 11.513 2.034 1.00 . A A . 2 TRP HE1 1 1
7 1452 1 1 2 TRP HE3 H -5.706 12.161 -3.032 1.00 . A A . 2 TRP HE3 1 1
7 1453 1 1 2 TRP HH2 H -8.852 14.744 -1.670 1.00 . A A . 2 TRP HH2 1 1
7 1454 1 1 2 TRP HZ2 H -8.892 13.633 0.538 1.00 . A A . 2 TRP HZ2 1 1
7 1455 1 1 2 TRP HZ3 H -7.290 14.015 -3.426 1.00 . A A . 2 TRP HZ3 1 1
7 1456 1 1 2 TRP N N -2.628 10.531 0.327 1.00 . A A . 2 TRP N 1 1
7 1457 1 1 2 TRP NE1 N -7.159 11.456 1.159 1.00 . A A . 2 TRP NE1 1 1
7 1458 1 1 2 TRP O O -2.658 7.271 -1.225 1.00 . A A . 2 TRP O 1 1
7 1459 1 1 3 ILE C C 0.580 7.377 -1.582 1.00 . A A . 3 ILE C 1 1
7 1460 1 1 3 ILE CA C -0.325 8.221 -2.537 1.00 . A A . 3 ILE CA 1 1
7 1461 1 1 3 ILE CB C 0.471 9.001 -3.646 1.00 . A A . 3 ILE CB 1 1
7 1462 1 1 3 ILE CD1 C 2.758 9.862 -2.705 1.00 . A A . 3 ILE CD1 1 1
7 1463 1 1 3 ILE CG1 C 1.336 10.212 -3.171 1.00 . A A . 3 ILE CG1 1 1
7 1464 1 1 3 ILE CG2 C -0.458 9.427 -4.812 1.00 . A A . 3 ILE CG2 1 1
7 1465 1 1 3 ILE H H -1.299 10.049 -1.769 1.00 . A A . 3 ILE H 1 1
7 1466 1 1 3 ILE HA H -0.880 7.448 -3.086 1.00 . A A . 3 ILE HA 1 1
7 1467 1 1 3 ILE HB H 1.160 8.271 -4.114 1.00 . A A . 3 ILE HB 1 1
7 1468 1 1 3 ILE HD11 H 3.345 9.381 -3.509 1.00 . A A . 3 ILE HD11 1 1
7 1469 1 1 3 ILE HD12 H 3.311 10.767 -2.397 1.00 . A A . 3 ILE HD12 1 1
7 1470 1 1 3 ILE HD13 H 2.763 9.175 -1.845 1.00 . A A . 3 ILE HD13 1 1
7 1471 1 1 3 ILE HG12 H 1.456 10.943 -3.994 1.00 . A A . 3 ILE HG12 1 1
7 1472 1 1 3 ILE HG13 H 0.811 10.773 -2.376 1.00 . A A . 3 ILE HG13 1 1
7 1473 1 1 3 ILE HG21 H -1.180 10.208 -4.506 1.00 . A A . 3 ILE HG21 1 1
7 1474 1 1 3 ILE HG22 H 0.116 9.828 -5.668 1.00 . A A . 3 ILE HG22 1 1
7 1475 1 1 3 ILE HG23 H -1.045 8.573 -5.200 1.00 . A A . 3 ILE HG23 1 1
7 1476 1 1 3 ILE N N -1.389 9.032 -1.876 1.00 . A A . 3 ILE N 1 1
7 1477 1 1 3 ILE O O 0.987 6.285 -1.980 1.00 . A A . 3 ILE O 1 1
7 1478 1 1 4 GLN C C 0.565 6.039 1.466 1.00 . A A . 4 GLN C 1 1
7 1479 1 1 4 GLN CA C 1.507 7.015 0.709 1.00 . A A . 4 GLN CA 1 1
7 1480 1 1 4 GLN CB C 2.311 7.877 1.719 1.00 . A A . 4 GLN CB 1 1
7 1481 1 1 4 GLN CD C 4.753 7.458 0.826 1.00 . A A . 4 GLN CD 1 1
7 1482 1 1 4 GLN CG C 3.637 8.463 1.186 1.00 . A A . 4 GLN CG 1 1
7 1483 1 1 4 GLN H H 0.437 8.744 -0.137 1.00 . A A . 4 GLN H 1 1
7 1484 1 1 4 GLN HA H 2.240 6.370 0.199 1.00 . A A . 4 GLN HA 1 1
7 1485 1 1 4 GLN HB2 H 1.673 8.699 2.094 1.00 . A A . 4 GLN HB2 1 1
7 1486 1 1 4 GLN HB3 H 2.558 7.282 2.621 1.00 . A A . 4 GLN HB3 1 1
7 1487 1 1 4 GLN HE21 H 5.617 8.838 -0.344 1.00 . A A . 4 GLN HE21 1 1
7 1488 1 1 4 GLN HE22 H 6.447 7.208 -0.213 1.00 . A A . 4 GLN HE22 1 1
7 1489 1 1 4 GLN HG2 H 3.404 9.103 0.318 1.00 . A A . 4 GLN HG2 1 1
7 1490 1 1 4 GLN HG3 H 4.037 9.140 1.961 1.00 . A A . 4 GLN HG3 1 1
7 1491 1 1 4 GLN N N 0.861 7.841 -0.347 1.00 . A A . 4 GLN N 1 1
7 1492 1 1 4 GLN NE2 N 5.696 7.873 -0.002 1.00 . A A . 4 GLN NE2 1 1
7 1493 1 1 4 GLN O O 1.043 4.967 1.834 1.00 . A A . 4 GLN O 1 1
7 1494 1 1 4 GLN OE1 O 4.795 6.317 1.294 1.00 . A A . 4 GLN OE1 1 1
7 1495 1 1 5 . C C -1.755 4.061 1.195 1.00 . A A . 5 DIV C 1 1
7 1496 1 1 5 . CA C -1.785 5.352 2.117 1.00 . A A . 5 DIV CA 1 1
7 1497 1 1 5 . CB1 C -1.576 5.053 3.652 1.00 . A A . 5 DIV CB1 1 1
7 1498 1 1 5 . CB2 C -3.152 6.078 1.961 1.00 . A A . 5 DIV CB2 1 1
7 1499 1 1 5 . CG1 C -2.632 4.204 4.395 1.00 . A A . 5 DIV CG1 1 1
7 1500 1 1 5 . H H -1.013 7.265 1.315 1.00 . A A . 5 DIV H 1 1
7 1501 1 1 5 . HB11 H -0.598 4.558 3.799 1.00 . A A . 5 DIV HB11 1 1
7 1502 1 1 5 . HB12 H -1.483 6.007 4.209 1.00 . A A . 5 DIV HB12 1 1
7 1503 1 1 5 . HB21 H -3.362 6.379 0.921 1.00 . A A . 5 DIV HB21 1 1
7 1504 1 1 5 . HB22 H -4.001 5.435 2.258 1.00 . A A . 5 DIV HB22 1 1
7 1505 1 1 5 . HB23 H -3.220 6.997 2.575 1.00 . A A . 5 DIV HB23 1 1
7 1506 1 1 5 . HG11 H -2.826 3.237 3.897 1.00 . A A . 5 DIV HG11 1 1
7 1507 1 1 5 . HG12 H -2.307 3.974 5.425 1.00 . A A . 5 DIV HG12 1 1
7 1508 1 1 5 . HG13 H -3.600 4.730 4.478 1.00 . A A . 5 DIV HG13 1 1
7 1509 1 1 5 . N N -0.741 6.346 1.681 1.00 . A A . 5 DIV N 1 1
7 1510 1 1 5 . O O -1.575 2.950 1.704 1.00 . A A . 5 DIV O 1 1
7 1511 1 1 6 ILE C C -0.167 2.500 -1.175 1.00 . A A . 6 ILE C 1 1
7 1512 1 1 6 ILE CA C -1.620 3.074 -1.104 1.00 . A A . 6 ILE CA 1 1
7 1513 1 1 6 ILE CB C -2.330 3.299 -2.487 1.00 . A A . 6 ILE CB 1 1
7 1514 1 1 6 ILE CD1 C -3.332 0.881 -2.738 1.00 . A A . 6 ILE CD1 1 1
7 1515 1 1 6 ILE CG1 C -2.487 2.011 -3.355 1.00 . A A . 6 ILE CG1 1 1
7 1516 1 1 6 ILE CG2 C -1.689 4.412 -3.349 1.00 . A A . 6 ILE CG2 1 1
7 1517 1 1 6 ILE H H -2.046 5.141 -0.504 1.00 . A A . 6 ILE H 1 1
7 1518 1 1 6 ILE HA H -2.214 2.277 -0.638 1.00 . A A . 6 ILE HA 1 1
7 1519 1 1 6 ILE HB H -3.360 3.642 -2.270 1.00 . A A . 6 ILE HB 1 1
7 1520 1 1 6 ILE HD11 H -4.338 1.234 -2.450 1.00 . A A . 6 ILE HD11 1 1
7 1521 1 1 6 ILE HD12 H -3.468 0.054 -3.458 1.00 . A A . 6 ILE HD12 1 1
7 1522 1 1 6 ILE HD13 H -2.856 0.449 -1.840 1.00 . A A . 6 ILE HD13 1 1
7 1523 1 1 6 ILE HG12 H -2.961 2.277 -4.319 1.00 . A A . 6 ILE HG12 1 1
7 1524 1 1 6 ILE HG13 H -1.493 1.608 -3.627 1.00 . A A . 6 ILE HG13 1 1
7 1525 1 1 6 ILE HG21 H -0.673 4.144 -3.693 1.00 . A A . 6 ILE HG21 1 1
7 1526 1 1 6 ILE HG22 H -2.293 4.634 -4.247 1.00 . A A . 6 ILE HG22 1 1
7 1527 1 1 6 ILE HG23 H -1.604 5.355 -2.784 1.00 . A A . 6 ILE HG23 1 1
7 1528 1 1 6 ILE N N -1.817 4.205 -0.158 1.00 . A A . 6 ILE N 1 1
7 1529 1 1 6 ILE O O -0.045 1.281 -1.076 1.00 . A A . 6 ILE O 1 1
7 1530 1 1 7 THR C C 2.855 2.007 -0.212 1.00 . A A . 7 THR C 1 1
7 1531 1 1 7 THR CA C 2.313 2.786 -1.460 1.00 . A A . 7 THR CA 1 1
7 1532 1 1 7 THR CB C 3.267 3.923 -1.944 1.00 . A A . 7 THR CB 1 1
7 1533 1 1 7 THR CG2 C 4.735 3.513 -2.178 1.00 . A A . 7 THR CG2 1 1
7 1534 1 1 7 THR H H 0.692 4.306 -1.385 1.00 . A A . 7 THR H 1 1
7 1535 1 1 7 THR HA H 2.293 2.050 -2.287 1.00 . A A . 7 THR HA 1 1
7 1536 1 1 7 THR HB H 3.260 4.743 -1.200 1.00 . A A . 7 THR HB 1 1
7 1537 1 1 7 THR HG1 H 3.400 5.157 -3.418 1.00 . A A . 7 THR HG1 1 1
7 1538 1 1 7 THR HG21 H 5.337 4.360 -2.554 1.00 . A A . 7 THR HG21 1 1
7 1539 1 1 7 THR HG22 H 5.221 3.167 -1.246 1.00 . A A . 7 THR HG22 1 1
7 1540 1 1 7 THR HG23 H 4.818 2.696 -2.918 1.00 . A A . 7 THR HG23 1 1
7 1541 1 1 7 THR N N 0.908 3.304 -1.328 1.00 . A A . 7 THR N 1 1
7 1542 1 1 7 THR O O 3.453 0.944 -0.390 1.00 . A A . 7 THR O 1 1
7 1543 1 1 7 THR OG1 O 2.801 4.445 -3.187 1.00 . A A . 7 THR OG1 1 1
7 1544 1 1 8 ABA C C 1.913 0.385 2.365 1.00 . A A . 8 AIB C 1 1
7 1545 1 1 8 ABA CA C 2.777 1.707 2.299 1.00 . A A . 8 AIB CA 1 1
7 1546 1 1 8 ABA H H 2.011 3.319 0.989 1.00 . A A . 8 AIB H 1 1
7 1547 1 1 8 ABA N N 2.617 2.494 1.026 1.00 . A A . 8 AIB N 1 1
7 1548 1 1 8 ABA O O 2.366 -0.623 2.917 1.00 . A A . 8 AIB O 1 1
7 1549 1 1 9 LEU C C 0.335 -1.735 0.369 1.00 . A A . 9 LEU C 1 1
7 1550 1 1 9 LEU CA C -0.108 -0.859 1.581 1.00 . A A . 9 LEU CA 1 1
7 1551 1 1 9 LEU CB C -1.611 -0.483 1.424 1.00 . A A . 9 LEU CB 1 1
7 1552 1 1 9 LEU CD1 C -3.801 0.405 2.345 1.00 . A A . 9 LEU CD1 1 1
7 1553 1 1 9 LEU CD2 C -2.597 -1.380 3.641 1.00 . A A . 9 LEU CD2 1 1
7 1554 1 1 9 LEU CG C -2.415 -0.158 2.714 1.00 . A A . 9 LEU CG 1 1
7 1555 1 1 9 LEU H H 0.430 1.184 1.226 1.00 . A A . 9 LEU H 1 1
7 1556 1 1 9 LEU HA H 0.001 -1.489 2.476 1.00 . A A . 9 LEU HA 1 1
7 1557 1 1 9 LEU HB2 H -1.696 0.364 0.716 1.00 . A A . 9 LEU HB2 1 1
7 1558 1 1 9 LEU HB3 H -2.143 -1.294 0.901 1.00 . A A . 9 LEU HB3 1 1
7 1559 1 1 9 LEU HD11 H -4.413 -0.330 1.791 1.00 . A A . 9 LEU HD11 1 1
7 1560 1 1 9 LEU HD12 H -4.374 0.700 3.244 1.00 . A A . 9 LEU HD12 1 1
7 1561 1 1 9 LEU HD13 H -3.720 1.305 1.711 1.00 . A A . 9 LEU HD13 1 1
7 1562 1 1 9 LEU HD21 H -1.635 -1.757 4.029 1.00 . A A . 9 LEU HD21 1 1
7 1563 1 1 9 LEU HD22 H -3.215 -1.129 4.525 1.00 . A A . 9 LEU HD22 1 1
7 1564 1 1 9 LEU HD23 H -3.097 -2.222 3.124 1.00 . A A . 9 LEU HD23 1 1
7 1565 1 1 9 LEU HG H -1.876 0.623 3.280 1.00 . A A . 9 LEU HG 1 1
7 1566 1 1 9 LEU N N 0.678 0.375 1.802 1.00 . A A . 9 LEU N 1 1
7 1567 1 1 9 LEU O O -0.102 -2.887 0.338 1.00 . A A . 9 LEU O 1 1
7 1568 1 1 10 ABA C C 2.281 -3.458 -1.431 1.00 . A A . 10 AIB C 1 1
7 1569 1 1 10 ABA CA C 1.606 -2.059 -1.800 1.00 . A A . 10 AIB CA 1 1
7 1570 1 1 10 ABA H H 1.497 -0.294 -0.443 1.00 . A A . 10 AIB H 1 1
7 1571 1 1 10 ABA N N 1.148 -1.255 -0.615 1.00 . A A . 10 AIB N 1 1
7 1572 1 1 10 ABA O O 1.840 -4.475 -1.981 1.00 . A A . 10 AIB O 1 1
7 1573 1 1 11 HYP C C 2.689 -5.737 0.911 1.00 . A A . 11 HYP C 1 1
7 1574 1 1 11 HYP CA C 3.706 -4.950 0.015 1.00 . A A . 11 HYP CA 1 1
7 1575 1 1 11 HYP CB C 5.015 -4.616 0.752 1.00 . A A . 11 HYP CB 1 1
7 1576 1 1 11 HYP CD C 3.904 -2.512 0.250 1.00 . A A . 11 HYP CD 1 1
7 1577 1 1 11 HYP CG C 4.854 -3.178 1.252 1.00 . A A . 11 HYP CG 1 1
7 1578 1 1 11 HYP HA H 3.956 -5.601 -0.843 1.00 . A A . 11 HYP HA 1 1
7 1579 1 1 11 HYP HB2 H 5.244 -5.316 1.579 1.00 . A A . 11 HYP HB2 1 1
7 1580 1 1 11 HYP HB3 H 5.868 -4.681 0.046 1.00 . A A . 11 HYP HB3 1 1
7 1581 1 1 11 HYP HD1 H 6.693 -3.099 1.796 1.00 . A A . 11 HYP HD1 1 1
7 1582 1 1 11 HYP HD22 H 3.138 -1.935 0.790 1.00 . A A . 11 HYP HD22 1 1
7 1583 1 1 11 HYP HD23 H 4.416 -1.808 -0.423 1.00 . A A . 11 HYP HD23 1 1
7 1584 1 1 11 HYP HG H 4.391 -3.183 2.256 1.00 . A A . 11 HYP HG 1 1
7 1585 1 1 11 HYP N N 3.282 -3.616 -0.502 1.00 . A A . 11 HYP N 1 1
7 1586 1 1 11 HYP O O 2.826 -6.959 1.020 1.00 . A A . 11 HYP O 1 1
7 1587 1 1 11 HYP OD1 O 6.108 -2.512 1.312 1.00 . A A . 11 HYP OD1 1 1
7 1588 1 1 12 GLN C C -0.699 -6.048 1.108 1.00 . A A . 12 GLN C 1 1
7 1589 1 1 12 GLN CA C 0.484 -5.720 2.088 1.00 . A A . 12 GLN CA 1 1
7 1590 1 1 12 GLN CB C -0.010 -4.922 3.334 1.00 . A A . 12 GLN CB 1 1
7 1591 1 1 12 GLN CD C 1.918 -3.799 4.680 1.00 . A A . 12 GLN CD 1 1
7 1592 1 1 12 GLN CG C 0.899 -4.945 4.591 1.00 . A A . 12 GLN CG 1 1
7 1593 1 1 12 GLN H H 1.624 -4.077 1.328 1.00 . A A . 12 GLN H 1 1
7 1594 1 1 12 GLN HA H 0.844 -6.673 2.467 1.00 . A A . 12 GLN HA 1 1
7 1595 1 1 12 GLN HB2 H -0.273 -3.884 3.052 1.00 . A A . 12 GLN HB2 1 1
7 1596 1 1 12 GLN HB3 H -0.972 -5.353 3.669 1.00 . A A . 12 GLN HB3 1 1
7 1597 1 1 12 GLN HE21 H 0.538 -2.599 5.507 1.00 . A A . 12 GLN HE21 1 1
7 1598 1 1 12 GLN HE22 H 2.214 -1.899 5.248 1.00 . A A . 12 GLN HE22 1 1
7 1599 1 1 12 GLN HG2 H 0.265 -4.939 5.498 1.00 . A A . 12 GLN HG2 1 1
7 1600 1 1 12 GLN HG3 H 1.433 -5.911 4.649 1.00 . A A . 12 GLN HG3 1 1
7 1601 1 1 12 GLN N N 1.669 -5.072 1.497 1.00 . A A . 12 GLN N 1 1
7 1602 1 1 12 GLN NE2 N 1.517 -2.651 5.203 1.00 . A A . 12 GLN NE2 1 1
7 1603 1 1 12 GLN O O -1.701 -6.547 1.615 1.00 . A A . 12 GLN O 1 1
7 1604 1 1 12 GLN OE1 O 3.077 -3.945 4.295 1.00 . A A . 12 GLN OE1 1 1
7 1605 1 1 13 ABA C C -1.254 -8.023 -1.438 1.00 . A A . 13 AIB C 1 1
7 1606 1 1 13 ABA CA C -1.548 -6.462 -1.253 1.00 . A A . 13 AIB CA 1 1
7 1607 1 1 13 ABA H H 0.268 -5.439 -0.549 1.00 . A A . 13 AIB H 1 1
7 1608 1 1 13 ABA N N -0.632 -5.833 -0.235 1.00 . A A . 13 AIB N 1 1
7 1609 1 1 13 ABA O O -2.205 -8.803 -1.306 1.00 . A A . 13 AIB O 1 1
7 1610 1 1 14 HYP C C 0.117 -10.948 -0.718 1.00 . A A . 14 HYP C 1 1
7 1611 1 1 14 HYP CA C 0.239 -10.009 -1.959 1.00 . A A . 14 HYP CA 1 1
7 1612 1 1 14 HYP CB C 1.652 -10.023 -2.579 1.00 . A A . 14 HYP CB 1 1
7 1613 1 1 14 HYP CD C 1.223 -7.764 -1.913 1.00 . A A . 14 HYP CD 1 1
7 1614 1 1 14 HYP CG C 2.338 -8.801 -1.975 1.00 . A A . 14 HYP CG 1 1
7 1615 1 1 14 HYP HA H -0.467 -10.378 -2.729 1.00 . A A . 14 HYP HA 1 1
7 1616 1 1 14 HYP HB2 H 2.217 -10.954 -2.384 1.00 . A A . 14 HYP HB2 1 1
7 1617 1 1 14 HYP HB3 H 1.584 -9.927 -3.678 1.00 . A A . 14 HYP HB3 1 1
7 1618 1 1 14 HYP HD1 H 3.051 -7.991 -3.573 1.00 . A A . 14 HYP HD1 1 1
7 1619 1 1 14 HYP HD22 H 1.414 -7.076 -1.081 1.00 . A A . 14 HYP HD22 1 1
7 1620 1 1 14 HYP HD23 H 1.178 -7.160 -2.832 1.00 . A A . 14 HYP HD23 1 1
7 1621 1 1 14 HYP HG H 2.677 -9.030 -0.941 1.00 . A A . 14 HYP HG 1 1
7 1622 1 1 14 HYP N N -0.014 -8.554 -1.731 1.00 . A A . 14 HYP N 1 1
7 1623 1 1 14 HYP O O -0.505 -12.006 -0.843 1.00 . A A . 14 HYP O 1 1
7 1624 1 1 14 HYP OD1 O 3.432 -8.347 -2.766 1.00 . A A . 14 HYP OD1 1 1
7 1625 1 1 15 ABA C C -0.853 -11.798 2.138 1.00 . A A . 15 AIB C 1 1
7 1626 1 1 15 ABA CA C 0.625 -11.345 1.736 1.00 . A A . 15 AIB CA 1 1
7 1627 1 1 15 ABA H H 1.178 -9.669 0.409 1.00 . A A . 15 AIB H 1 1
7 1628 1 1 15 ABA N N 0.709 -10.580 0.450 1.00 . A A . 15 AIB N 1 1
7 1629 1 1 15 ABA O O -1.041 -12.995 2.386 1.00 . A A . 15 AIB O 1 1
7 1630 1 1 16 PRO C C -3.956 -12.066 0.958 1.00 . A A . 16 PRO C 1 1
7 1631 1 1 16 PRO CA C -3.344 -11.450 2.256 1.00 . A A . 16 PRO CA 1 1
7 1632 1 1 16 PRO CB C -4.099 -10.204 2.754 1.00 . A A . 16 PRO CB 1 1
7 1633 1 1 16 PRO CD C -1.875 -9.492 2.097 1.00 . A A . 16 PRO CD 1 1
7 1634 1 1 16 PRO CG C -3.330 -9.022 2.172 1.00 . A A . 16 PRO CG 1 1
7 1635 1 1 16 PRO HA H -3.406 -12.216 3.055 1.00 . A A . 16 PRO HA 1 1
7 1636 1 1 16 PRO HB2 H -5.168 -10.188 2.468 1.00 . A A . 16 PRO HB2 1 1
7 1637 1 1 16 PRO HB3 H -4.070 -10.159 3.860 1.00 . A A . 16 PRO HB3 1 1
7 1638 1 1 16 PRO HD2 H -1.400 -9.132 1.172 1.00 . A A . 16 PRO HD2 1 1
7 1639 1 1 16 PRO HD3 H -1.286 -9.087 2.937 1.00 . A A . 16 PRO HD3 1 1
7 1640 1 1 16 PRO HG2 H -3.705 -8.791 1.156 1.00 . A A . 16 PRO HG2 1 1
7 1641 1 1 16 PRO HG3 H -3.452 -8.106 2.780 1.00 . A A . 16 PRO HG3 1 1
7 1642 1 1 16 PRO N N -1.943 -10.962 2.150 1.00 . A A . 16 PRO N 1 1
7 1643 1 1 16 PRO O O -4.633 -13.091 1.085 1.00 . A A . 16 PRO O 1 1
7 1644 1 1 17 PHL C C -3.499 -12.070 -2.654 1.00 . A A . 17 PHL C 1 1
7 1645 1 1 17 PHL CA C -4.490 -11.924 -1.476 1.00 . A A . 17 PHL CA 1 1
7 1646 1 1 17 PHL CB C -5.688 -10.993 -1.819 1.00 . A A . 17 PHL CB 1 1
7 1647 1 1 17 PHL CD1 C -7.056 -10.001 0.097 1.00 . A A . 17 PHL CD1 1 1
7 1648 1 1 17 PHL CD2 C -7.727 -12.142 -0.802 1.00 . A A . 17 PHL CD2 1 1
7 1649 1 1 17 PHL CE1 C -8.089 -10.072 1.029 1.00 . A A . 17 PHL CE1 1 1
7 1650 1 1 17 PHL CE2 C -8.757 -12.209 0.132 1.00 . A A . 17 PHL CE2 1 1
7 1651 1 1 17 PHL CG C -6.863 -11.039 -0.823 1.00 . A A . 17 PHL CG 1 1
7 1652 1 1 17 PHL CZ C -8.939 -11.174 1.045 1.00 . A A . 17 PHL CZ 1 1
7 1653 1 1 17 PHL H H -3.234 -10.591 -0.255 1.00 . A A . 17 PHL H 1 1
7 1654 1 1 17 PHL HA H -4.895 -12.946 -1.327 1.00 . A A . 17 PHL HA 1 1
7 1655 1 1 17 PHL HB2 H -5.326 -9.953 -1.946 1.00 . A A . 17 PHL HB2 1 1
7 1656 1 1 17 PHL HB3 H -6.078 -11.259 -2.820 1.00 . A A . 17 PHL HB3 1 1
7 1657 1 1 17 PHL HC1 H -3.998 -12.579 -3.499 1.00 . A A . 17 PHL HC1 1 1
7 1658 1 1 17 PHL HC2 H -2.653 -12.726 -2.378 1.00 . A A . 17 PHL HC2 1 1
7 1659 1 1 17 PHL HD1 H -6.396 -9.146 0.107 1.00 . A A . 17 PHL HD1 1 1
7 1660 1 1 17 PHL HD2 H -7.590 -12.958 -1.498 1.00 . A A . 17 PHL HD2 1 1
7 1661 1 1 17 PHL HE1 H -8.226 -9.275 1.745 1.00 . A A . 17 PHL HE1 1 1
7 1662 1 1 17 PHL HE2 H -9.412 -13.069 0.151 1.00 . A A . 17 PHL HE2 1 1
7 1663 1 1 17 PHL HO H -2.547 -10.425 -2.357 1.00 . A A . 17 PHL HO 1 1
7 1664 1 1 17 PHL HZ H -9.739 -11.230 1.771 1.00 . A A . 17 PHL HZ 1 1
7 1665 1 1 17 PHL N N -3.782 -11.464 -0.249 1.00 . A A . 17 PHL N 1 1
7 1666 1 1 17 PHL O O -2.998 -10.818 -3.107 1.00 . A A . 17 PHL O 1 1
8 1667 1 1 1 ACE C C -1.999 10.217 1.576 1.00 . A A . 1 ACE C 1 1
8 1668 1 1 1 ACE CH3 C -1.116 11.425 1.854 1.00 . A A . 1 ACE CH3 1 1
8 1669 1 1 1 ACE H1 H -1.710 12.338 2.041 1.00 . A A . 1 ACE H1 1 1
8 1670 1 1 1 ACE H2 H -0.467 11.248 2.731 1.00 . A A . 1 ACE H2 1 1
8 1671 1 1 1 ACE H3 H -0.451 11.618 0.991 1.00 . A A . 1 ACE H3 1 1
8 1672 1 1 1 ACE O O -1.815 9.152 2.167 1.00 . A A . 1 ACE O 1 1
8 1673 1 1 2 TRP C C -2.602 8.430 -1.044 1.00 . A A . 2 TRP C 1 1
8 1674 1 1 2 TRP CA C -3.554 9.251 -0.101 1.00 . A A . 2 TRP CA 1 1
8 1675 1 1 2 TRP CB C -4.828 9.773 -0.820 1.00 . A A . 2 TRP CB 1 1
8 1676 1 1 2 TRP CD1 C -6.564 7.822 -0.535 1.00 . A A . 2 TRP CD1 1 1
8 1677 1 1 2 TRP CD2 C -6.036 8.307 -2.642 1.00 . A A . 2 TRP CD2 1 1
8 1678 1 1 2 TRP CE2 C -6.977 7.246 -2.617 1.00 . A A . 2 TRP CE2 1 1
8 1679 1 1 2 TRP CE3 C -5.550 8.807 -3.878 1.00 . A A . 2 TRP CE3 1 1
8 1680 1 1 2 TRP CG C -5.773 8.677 -1.335 1.00 . A A . 2 TRP CG 1 1
8 1681 1 1 2 TRP CH2 C -6.963 7.193 -5.037 1.00 . A A . 2 TRP CH2 1 1
8 1682 1 1 2 TRP CZ2 C -7.448 6.686 -3.829 1.00 . A A . 2 TRP CZ2 1 1
8 1683 1 1 2 TRP CZ3 C -6.027 8.236 -5.059 1.00 . A A . 2 TRP CZ3 1 1
8 1684 1 1 2 TRP H H -3.013 11.343 0.261 1.00 . A A . 2 TRP H 1 1
8 1685 1 1 2 TRP HA H -3.903 8.574 0.694 1.00 . A A . 2 TRP HA 1 1
8 1686 1 1 2 TRP HB2 H -5.417 10.411 -0.130 1.00 . A A . 2 TRP HB2 1 1
8 1687 1 1 2 TRP HB3 H -4.544 10.449 -1.648 1.00 . A A . 2 TRP HB3 1 1
8 1688 1 1 2 TRP HD1 H -6.588 7.851 0.545 1.00 . A A . 2 TRP HD1 1 1
8 1689 1 1 2 TRP HE1 H -7.959 6.193 -0.988 1.00 . A A . 2 TRP HE1 1 1
8 1690 1 1 2 TRP HE3 H -4.832 9.614 -3.911 1.00 . A A . 2 TRP HE3 1 1
8 1691 1 1 2 TRP HH2 H -7.313 6.775 -5.967 1.00 . A A . 2 TRP HH2 1 1
8 1692 1 1 2 TRP HZ2 H -8.168 5.880 -3.824 1.00 . A A . 2 TRP HZ2 1 1
8 1693 1 1 2 TRP HZ3 H -5.670 8.608 -6.009 1.00 . A A . 2 TRP HZ3 1 1
8 1694 1 1 2 TRP N N -2.904 10.387 0.602 1.00 . A A . 2 TRP N 1 1
8 1695 1 1 2 TRP NE1 N -7.313 6.922 -1.313 1.00 . A A . 2 TRP NE1 1 1
8 1696 1 1 2 TRP O O -2.817 7.226 -1.213 1.00 . A A . 2 TRP O 1 1
8 1697 1 1 3 ILE C C 0.405 7.413 -1.438 1.00 . A A . 3 ILE C 1 1
8 1698 1 1 3 ILE CA C -0.473 8.317 -2.366 1.00 . A A . 3 ILE CA 1 1
8 1699 1 1 3 ILE CB C 0.328 9.259 -3.344 1.00 . A A . 3 ILE CB 1 1
8 1700 1 1 3 ILE CD1 C 0.021 11.047 -5.262 1.00 . A A . 3 ILE CD1 1 1
8 1701 1 1 3 ILE CG1 C -0.601 9.928 -4.410 1.00 . A A . 3 ILE CG1 1 1
8 1702 1 1 3 ILE CG2 C 1.498 8.531 -4.066 1.00 . A A . 3 ILE CG2 1 1
8 1703 1 1 3 ILE H H -1.464 10.048 -1.411 1.00 . A A . 3 ILE H 1 1
8 1704 1 1 3 ILE HA H -1.002 7.606 -3.008 1.00 . A A . 3 ILE HA 1 1
8 1705 1 1 3 ILE HB H 0.777 10.064 -2.730 1.00 . A A . 3 ILE HB 1 1
8 1706 1 1 3 ILE HD11 H 0.806 10.669 -5.939 1.00 . A A . 3 ILE HD11 1 1
8 1707 1 1 3 ILE HD12 H -0.745 11.527 -5.900 1.00 . A A . 3 ILE HD12 1 1
8 1708 1 1 3 ILE HD13 H 0.471 11.838 -4.634 1.00 . A A . 3 ILE HD13 1 1
8 1709 1 1 3 ILE HG12 H -1.024 9.155 -5.081 1.00 . A A . 3 ILE HG12 1 1
8 1710 1 1 3 ILE HG13 H -1.481 10.375 -3.912 1.00 . A A . 3 ILE HG13 1 1
8 1711 1 1 3 ILE HG21 H 1.144 7.690 -4.693 1.00 . A A . 3 ILE HG21 1 1
8 1712 1 1 3 ILE HG22 H 2.075 9.210 -4.720 1.00 . A A . 3 ILE HG22 1 1
8 1713 1 1 3 ILE HG23 H 2.232 8.117 -3.353 1.00 . A A . 3 ILE HG23 1 1
8 1714 1 1 3 ILE N N -1.548 9.048 -1.628 1.00 . A A . 3 ILE N 1 1
8 1715 1 1 3 ILE O O 0.688 6.275 -1.819 1.00 . A A . 3 ILE O 1 1
8 1716 1 1 4 GLN C C 0.590 6.021 1.525 1.00 . A A . 4 GLN C 1 1
8 1717 1 1 4 GLN CA C 1.486 7.048 0.778 1.00 . A A . 4 GLN CA 1 1
8 1718 1 1 4 GLN CB C 2.336 7.884 1.769 1.00 . A A . 4 GLN CB 1 1
8 1719 1 1 4 GLN CD C 4.734 7.418 0.822 1.00 . A A . 4 GLN CD 1 1
8 1720 1 1 4 GLN CG C 3.646 8.454 1.174 1.00 . A A . 4 GLN CG 1 1
8 1721 1 1 4 GLN H H 0.466 8.834 -0.060 1.00 . A A . 4 GLN H 1 1
8 1722 1 1 4 GLN HA H 2.204 6.425 0.224 1.00 . A A . 4 GLN HA 1 1
8 1723 1 1 4 GLN HB2 H 1.724 8.708 2.186 1.00 . A A . 4 GLN HB2 1 1
8 1724 1 1 4 GLN HB3 H 2.612 7.271 2.650 1.00 . A A . 4 GLN HB3 1 1
8 1725 1 1 4 GLN HE21 H 5.194 8.431 -0.849 1.00 . A A . 4 GLN HE21 1 1
8 1726 1 1 4 GLN HE22 H 6.160 6.913 -0.490 1.00 . A A . 4 GLN HE22 1 1
8 1727 1 1 4 GLN HG2 H 3.387 9.065 0.290 1.00 . A A . 4 GLN HG2 1 1
8 1728 1 1 4 GLN HG3 H 4.079 9.153 1.908 1.00 . A A . 4 GLN HG3 1 1
8 1729 1 1 4 GLN N N 0.813 7.893 -0.249 1.00 . A A . 4 GLN N 1 1
8 1730 1 1 4 GLN NE2 N 5.430 7.606 -0.288 1.00 . A A . 4 GLN NE2 1 1
8 1731 1 1 4 GLN O O 1.124 4.965 1.867 1.00 . A A . 4 GLN O 1 1
8 1732 1 1 4 GLN OE1 O 4.969 6.449 1.544 1.00 . A A . 4 GLN OE1 1 1
8 1733 1 1 5 . C C -1.628 3.959 1.042 1.00 . A A . 5 DIV C 1 1
8 1734 1 1 5 . CA C -1.732 5.170 2.067 1.00 . A A . 5 DIV CA 1 1
8 1735 1 1 5 . CB1 C -1.527 4.760 3.574 1.00 . A A . 5 DIV CB1 1 1
8 1736 1 1 5 . CB2 C -3.131 5.842 1.937 1.00 . A A . 5 DIV CB2 1 1
8 1737 1 1 5 . CG1 C -2.569 3.838 4.242 1.00 . A A . 5 DIV CG1 1 1
8 1738 1 1 5 . H H -1.050 7.176 1.423 1.00 . A A . 5 DIV H 1 1
8 1739 1 1 5 . HB11 H -0.543 4.272 3.688 1.00 . A A . 5 DIV HB11 1 1
8 1740 1 1 5 . HB12 H -1.453 5.668 4.205 1.00 . A A . 5 DIV HB12 1 1
8 1741 1 1 5 . HB21 H -3.348 6.187 0.915 1.00 . A A . 5 DIV HB21 1 1
8 1742 1 1 5 . HB22 H -3.951 5.145 2.190 1.00 . A A . 5 DIV HB22 1 1
8 1743 1 1 5 . HB23 H -3.246 6.719 2.602 1.00 . A A . 5 DIV HB23 1 1
8 1744 1 1 5 . HG11 H -2.734 2.908 3.669 1.00 . A A . 5 DIV HG11 1 1
8 1745 1 1 5 . HG12 H -2.247 3.543 5.255 1.00 . A A . 5 DIV HG12 1 1
8 1746 1 1 5 . HG13 H -3.549 4.335 4.350 1.00 . A A . 5 DIV HG13 1 1
8 1747 1 1 5 . N N -0.732 6.250 1.734 1.00 . A A . 5 DIV N 1 1
8 1748 1 1 5 . O O -1.440 2.812 1.449 1.00 . A A . 5 DIV O 1 1
8 1749 1 1 6 ILE C C -0.005 2.584 -1.321 1.00 . A A . 6 ILE C 1 1
8 1750 1 1 6 ILE CA C -1.427 3.232 -1.368 1.00 . A A . 6 ILE CA 1 1
8 1751 1 1 6 ILE CB C -1.838 3.827 -2.773 1.00 . A A . 6 ILE CB 1 1
8 1752 1 1 6 ILE CD1 C -3.678 5.251 -3.980 1.00 . A A . 6 ILE CD1 1 1
8 1753 1 1 6 ILE CG1 C -3.338 4.256 -2.855 1.00 . A A . 6 ILE CG1 1 1
8 1754 1 1 6 ILE CG2 C -1.532 2.865 -3.954 1.00 . A A . 6 ILE CG2 1 1
8 1755 1 1 6 ILE H H -1.946 5.181 -0.534 1.00 . A A . 6 ILE H 1 1
8 1756 1 1 6 ILE HA H -2.131 2.413 -1.150 1.00 . A A . 6 ILE HA 1 1
8 1757 1 1 6 ILE HB H -1.220 4.732 -2.932 1.00 . A A . 6 ILE HB 1 1
8 1758 1 1 6 ILE HD11 H -3.458 4.848 -4.985 1.00 . A A . 6 ILE HD11 1 1
8 1759 1 1 6 ILE HD12 H -4.753 5.500 -3.966 1.00 . A A . 6 ILE HD12 1 1
8 1760 1 1 6 ILE HD13 H -3.123 6.201 -3.871 1.00 . A A . 6 ILE HD13 1 1
8 1761 1 1 6 ILE HG12 H -3.987 3.364 -2.945 1.00 . A A . 6 ILE HG12 1 1
8 1762 1 1 6 ILE HG13 H -3.658 4.734 -1.912 1.00 . A A . 6 ILE HG13 1 1
8 1763 1 1 6 ILE HG21 H -2.065 1.902 -3.848 1.00 . A A . 6 ILE HG21 1 1
8 1764 1 1 6 ILE HG22 H -1.816 3.293 -4.932 1.00 . A A . 6 ILE HG22 1 1
8 1765 1 1 6 ILE HG23 H -0.454 2.636 -4.030 1.00 . A A . 6 ILE HG23 1 1
8 1766 1 1 6 ILE N N -1.644 4.235 -0.289 1.00 . A A . 6 ILE N 1 1
8 1767 1 1 6 ILE O O 0.054 1.364 -1.181 1.00 . A A . 6 ILE O 1 1
8 1768 1 1 7 THR C C 2.950 1.947 -0.265 1.00 . A A . 7 THR C 1 1
8 1769 1 1 7 THR CA C 2.487 2.762 -1.519 1.00 . A A . 7 THR CA 1 1
8 1770 1 1 7 THR CB C 3.557 3.807 -1.960 1.00 . A A . 7 THR CB 1 1
8 1771 1 1 7 THR CG2 C 3.353 4.388 -3.373 1.00 . A A . 7 THR CG2 1 1
8 1772 1 1 7 THR H H 0.927 4.343 -1.568 1.00 . A A . 7 THR H 1 1
8 1773 1 1 7 THR HA H 2.457 2.023 -2.346 1.00 . A A . 7 THR HA 1 1
8 1774 1 1 7 THR HB H 4.548 3.315 -1.967 1.00 . A A . 7 THR HB 1 1
8 1775 1 1 7 THR HG1 H 2.760 5.302 -1.055 1.00 . A A . 7 THR HG1 1 1
8 1776 1 1 7 THR HG21 H 4.131 5.135 -3.618 1.00 . A A . 7 THR HG21 1 1
8 1777 1 1 7 THR HG22 H 3.406 3.601 -4.148 1.00 . A A . 7 THR HG22 1 1
8 1778 1 1 7 THR HG23 H 2.375 4.893 -3.481 1.00 . A A . 7 THR HG23 1 1
8 1779 1 1 7 THR N N 1.104 3.340 -1.444 1.00 . A A . 7 THR N 1 1
8 1780 1 1 7 THR O O 3.506 0.861 -0.436 1.00 . A A . 7 THR O 1 1
8 1781 1 1 7 THR OG1 O 3.625 4.883 -1.036 1.00 . A A . 7 THR OG1 1 1
8 1782 1 1 8 ABA C C 1.893 0.321 2.282 1.00 . A A . 8 AIB C 1 1
8 1783 1 1 8 ABA CA C 2.785 1.626 2.241 1.00 . A A . 8 AIB CA 1 1
8 1784 1 1 8 ABA H H 2.114 3.278 0.926 1.00 . A A . 8 AIB H 1 1
8 1785 1 1 8 ABA N N 2.683 2.427 0.970 1.00 . A A . 8 AIB N 1 1
8 1786 1 1 8 ABA O O 2.295 -0.692 2.867 1.00 . A A . 8 AIB O 1 1
8 1787 1 1 9 LEU C C 0.351 -1.740 0.194 1.00 . A A . 9 LEU C 1 1
8 1788 1 1 9 LEU CA C -0.116 -0.879 1.407 1.00 . A A . 9 LEU CA 1 1
8 1789 1 1 9 LEU CB C -1.611 -0.483 1.228 1.00 . A A . 9 LEU CB 1 1
8 1790 1 1 9 LEU CD1 C -3.815 0.403 2.116 1.00 . A A . 9 LEU CD1 1 1
8 1791 1 1 9 LEU CD2 C -2.608 -1.348 3.457 1.00 . A A . 9 LEU CD2 1 1
8 1792 1 1 9 LEU CG C -2.427 -0.144 2.507 1.00 . A A . 9 LEU CG 1 1
8 1793 1 1 9 LEU H H 0.453 1.167 1.119 1.00 . A A . 9 LEU H 1 1
8 1794 1 1 9 LEU HA H -0.037 -1.526 2.293 1.00 . A A . 9 LEU HA 1 1
8 1795 1 1 9 LEU HB2 H -1.677 0.357 0.510 1.00 . A A . 9 LEU HB2 1 1
8 1796 1 1 9 LEU HB3 H -2.140 -1.296 0.705 1.00 . A A . 9 LEU HB3 1 1
8 1797 1 1 9 LEU HD11 H -4.419 -0.352 1.576 1.00 . A A . 9 LEU HD11 1 1
8 1798 1 1 9 LEU HD12 H -4.397 0.715 3.003 1.00 . A A . 9 LEU HD12 1 1
8 1799 1 1 9 LEU HD13 H -3.737 1.289 1.458 1.00 . A A . 9 LEU HD13 1 1
8 1800 1 1 9 LEU HD21 H -1.646 -1.711 3.859 1.00 . A A . 9 LEU HD21 1 1
8 1801 1 1 9 LEU HD22 H -3.233 -1.088 4.331 1.00 . A A . 9 LEU HD22 1 1
8 1802 1 1 9 LEU HD23 H -3.095 -2.203 2.951 1.00 . A A . 9 LEU HD23 1 1
8 1803 1 1 9 LEU HG H -1.897 0.652 3.063 1.00 . A A . 9 LEU HG 1 1
8 1804 1 1 9 LEU N N 0.683 0.336 1.670 1.00 . A A . 9 LEU N 1 1
8 1805 1 1 9 LEU O O -0.063 -2.900 0.157 1.00 . A A . 9 LEU O 1 1
8 1806 1 1 10 ABA C C 2.370 -3.449 -1.524 1.00 . A A . 10 AIB C 1 1
8 1807 1 1 10 ABA CA C 1.689 -2.062 -1.934 1.00 . A A . 10 AIB CA 1 1
8 1808 1 1 10 ABA H H 1.483 -0.271 -0.611 1.00 . A A . 10 AIB H 1 1
8 1809 1 1 10 ABA N N 1.170 -1.246 -0.779 1.00 . A A . 10 AIB N 1 1
8 1810 1 1 10 ABA O O 1.959 -4.481 -2.071 1.00 . A A . 10 AIB O 1 1
8 1811 1 1 11 HYP C C 2.770 -5.711 0.844 1.00 . A A . 11 HYP C 1 1
8 1812 1 1 11 HYP CA C 3.792 -4.903 -0.030 1.00 . A A . 11 HYP CA 1 1
8 1813 1 1 11 HYP CB C 5.059 -4.514 0.752 1.00 . A A . 11 HYP CB 1 1
8 1814 1 1 11 HYP CD C 3.885 -2.464 0.238 1.00 . A A . 11 HYP CD 1 1
8 1815 1 1 11 HYP CG C 4.787 -3.110 1.294 1.00 . A A . 11 HYP CG 1 1
8 1816 1 1 11 HYP HA H 4.091 -5.554 -0.874 1.00 . A A . 11 HYP HA 1 1
8 1817 1 1 11 HYP HB2 H 5.306 -5.225 1.560 1.00 . A A . 11 HYP HB2 1 1
8 1818 1 1 11 HYP HB3 H 5.932 -4.497 0.070 1.00 . A A . 11 HYP HB3 1 1
8 1819 1 1 11 HYP HD1 H 6.523 -2.903 2.085 1.00 . A A . 11 HYP HD1 1 1
8 1820 1 1 11 HYP HD22 H 3.076 -1.912 0.736 1.00 . A A . 11 HYP HD22 1 1
8 1821 1 1 11 HYP HD23 H 4.414 -1.743 -0.401 1.00 . A A . 11 HYP HD23 1 1
8 1822 1 1 11 HYP HG H 4.244 -3.181 2.257 1.00 . A A . 11 HYP HG 1 1
8 1823 1 1 11 HYP N N 3.347 -3.580 -0.562 1.00 . A A . 11 HYP N 1 1
8 1824 1 1 11 HYP O O 2.949 -6.920 1.009 1.00 . A A . 11 HYP O 1 1
8 1825 1 1 11 HYP OD1 O 5.991 -2.380 1.481 1.00 . A A . 11 HYP OD1 1 1
8 1826 1 1 12 GLN C C -0.673 -5.988 0.967 1.00 . A A . 12 GLN C 1 1
8 1827 1 1 12 GLN CA C 0.521 -5.708 1.949 1.00 . A A . 12 GLN CA 1 1
8 1828 1 1 12 GLN CB C 0.071 -4.894 3.199 1.00 . A A . 12 GLN CB 1 1
8 1829 1 1 12 GLN CD C 0.579 -4.076 5.584 1.00 . A A . 12 GLN CD 1 1
8 1830 1 1 12 GLN CG C 1.065 -4.903 4.385 1.00 . A A . 12 GLN CG 1 1
8 1831 1 1 12 GLN H H 1.660 -4.072 1.173 1.00 . A A . 12 GLN H 1 1
8 1832 1 1 12 GLN HA H 0.860 -6.673 2.310 1.00 . A A . 12 GLN HA 1 1
8 1833 1 1 12 GLN HB2 H -0.164 -3.852 2.905 1.00 . A A . 12 GLN HB2 1 1
8 1834 1 1 12 GLN HB3 H -0.886 -5.303 3.578 1.00 . A A . 12 GLN HB3 1 1
8 1835 1 1 12 GLN HE21 H 0.278 -5.748 6.651 1.00 . A A . 12 GLN HE21 1 1
8 1836 1 1 12 GLN HE22 H -0.167 -4.154 7.445 1.00 . A A . 12 GLN HE22 1 1
8 1837 1 1 12 GLN HG2 H 1.276 -5.951 4.678 1.00 . A A . 12 GLN HG2 1 1
8 1838 1 1 12 GLN HG3 H 2.041 -4.493 4.061 1.00 . A A . 12 GLN HG3 1 1
8 1839 1 1 12 GLN N N 1.707 -5.062 1.360 1.00 . A A . 12 GLN N 1 1
8 1840 1 1 12 GLN NE2 N 0.184 -4.726 6.668 1.00 . A A . 12 GLN NE2 1 1
8 1841 1 1 12 GLN O O -1.728 -6.371 1.469 1.00 . A A . 12 GLN O 1 1
8 1842 1 1 12 GLN OE1 O 0.555 -2.847 5.545 1.00 . A A . 12 GLN OE1 1 1
8 1843 1 1 13 ABA C C -1.155 -8.110 -1.473 1.00 . A A . 13 AIB C 1 1
8 1844 1 1 13 ABA CA C -1.426 -6.536 -1.403 1.00 . A A . 13 AIB CA 1 1
8 1845 1 1 13 ABA H H 0.390 -5.536 -0.689 1.00 . A A . 13 AIB H 1 1
8 1846 1 1 13 ABA N N -0.541 -5.866 -0.385 1.00 . A A . 13 AIB N 1 1
8 1847 1 1 13 ABA O O -2.129 -8.862 -1.356 1.00 . A A . 13 AIB O 1 1
8 1848 1 1 14 HYP C C 0.129 -10.989 -0.417 1.00 . A A . 14 HYP C 1 1
8 1849 1 1 14 HYP CA C 0.327 -10.157 -1.723 1.00 . A A . 14 HYP CA 1 1
8 1850 1 1 14 HYP CB C 1.775 -10.247 -2.248 1.00 . A A . 14 HYP CB 1 1
8 1851 1 1 14 HYP CD C 1.347 -7.928 -1.834 1.00 . A A . 14 HYP CD 1 1
8 1852 1 1 14 HYP CG C 2.438 -8.983 -1.703 1.00 . A A . 14 HYP CG 1 1
8 1853 1 1 14 HYP HA H -0.339 -10.588 -2.496 1.00 . A A . 14 HYP HA 1 1
8 1854 1 1 14 HYP HB2 H 2.310 -11.165 -1.940 1.00 . A A . 14 HYP HB2 1 1
8 1855 1 1 14 HYP HB3 H 1.779 -10.243 -3.356 1.00 . A A . 14 HYP HB3 1 1
8 1856 1 1 14 HYP HD1 H 3.296 -8.417 -3.323 1.00 . A A . 14 HYP HD1 1 1
8 1857 1 1 14 HYP HD22 H 1.506 -7.149 -1.081 1.00 . A A . 14 HYP HD22 1 1
8 1858 1 1 14 HYP HD23 H 1.365 -7.429 -2.817 1.00 . A A . 14 HYP HD23 1 1
8 1859 1 1 14 HYP HG H 2.672 -9.118 -0.625 1.00 . A A . 14 HYP HG 1 1
8 1860 1 1 14 HYP N N 0.090 -8.682 -1.642 1.00 . A A . 14 HYP N 1 1
8 1861 1 1 14 HYP O O -0.451 -12.074 -0.497 1.00 . A A . 14 HYP O 1 1
8 1862 1 1 14 HYP OD1 O 3.600 -8.626 -2.437 1.00 . A A . 14 HYP OD1 1 1
8 1863 1 1 15 ABA C C -1.102 -11.584 2.389 1.00 . A A . 15 AIB C 1 1
8 1864 1 1 15 ABA CA C 0.405 -11.149 2.098 1.00 . A A . 15 AIB CA 1 1
8 1865 1 1 15 ABA H H 1.075 -9.597 0.672 1.00 . A A . 15 AIB H 1 1
8 1866 1 1 15 ABA N N 0.610 -10.508 0.758 1.00 . A A . 15 AIB N 1 1
8 1867 1 1 15 ABA O O -1.310 -12.758 2.725 1.00 . A A . 15 AIB O 1 1
8 1868 1 1 16 PRO C C -4.012 -12.030 0.872 1.00 . A A . 16 PRO C 1 1
8 1869 1 1 16 PRO CA C -3.592 -11.270 2.176 1.00 . A A . 16 PRO CA 1 1
8 1870 1 1 16 PRO CB C -4.411 -9.997 2.453 1.00 . A A . 16 PRO CB 1 1
8 1871 1 1 16 PRO CD C -2.123 -9.306 2.024 1.00 . A A . 16 PRO CD 1 1
8 1872 1 1 16 PRO CG C -3.580 -8.854 1.875 1.00 . A A . 16 PRO CG 1 1
8 1873 1 1 16 PRO HA H -3.749 -11.956 3.031 1.00 . A A . 16 PRO HA 1 1
8 1874 1 1 16 PRO HB2 H -5.433 -10.023 2.029 1.00 . A A . 16 PRO HB2 1 1
8 1875 1 1 16 PRO HB3 H -4.530 -9.851 3.544 1.00 . A A . 16 PRO HB3 1 1
8 1876 1 1 16 PRO HD2 H -1.539 -9.021 1.137 1.00 . A A . 16 PRO HD2 1 1
8 1877 1 1 16 PRO HD3 H -1.637 -8.817 2.883 1.00 . A A . 16 PRO HD3 1 1
8 1878 1 1 16 PRO HG2 H -3.827 -8.720 0.804 1.00 . A A . 16 PRO HG2 1 1
8 1879 1 1 16 PRO HG3 H -3.781 -7.888 2.375 1.00 . A A . 16 PRO HG3 1 1
8 1880 1 1 16 PRO N N -2.191 -10.768 2.202 1.00 . A A . 16 PRO N 1 1
8 1881 1 1 16 PRO O O -4.585 -13.115 1.004 1.00 . A A . 16 PRO O 1 1
8 1882 1 1 17 PHL C C -3.153 -12.077 -2.695 1.00 . A A . 17 PHL C 1 1
8 1883 1 1 17 PHL CA C -4.255 -12.107 -1.613 1.00 . A A . 17 PHL CA 1 1
8 1884 1 1 17 PHL CB C -5.570 -11.427 -2.090 1.00 . A A . 17 PHL CB 1 1
8 1885 1 1 17 PHL CD1 C -7.450 -13.130 -1.902 1.00 . A A . 17 PHL CD1 1 1
8 1886 1 1 17 PHL CD2 C -7.400 -11.318 -0.305 1.00 . A A . 17 PHL CD2 1 1
8 1887 1 1 17 PHL CE1 C -8.580 -13.651 -1.277 1.00 . A A . 17 PHL CE1 1 1
8 1888 1 1 17 PHL CE2 C -8.530 -11.844 0.322 1.00 . A A . 17 PHL CE2 1 1
8 1889 1 1 17 PHL CG C -6.847 -11.964 -1.417 1.00 . A A . 17 PHL CG 1 1
8 1890 1 1 17 PHL CZ C -9.118 -13.008 -0.165 1.00 . A A . 17 PHL CZ 1 1
8 1891 1 1 17 PHL H H -3.330 -10.556 -0.365 1.00 . A A . 17 PHL H 1 1
8 1892 1 1 17 PHL HA H -4.455 -13.185 -1.454 1.00 . A A . 17 PHL HA 1 1
8 1893 1 1 17 PHL HB2 H -5.503 -10.327 -1.981 1.00 . A A . 17 PHL HB2 1 1
8 1894 1 1 17 PHL HB3 H -5.680 -11.567 -3.182 1.00 . A A . 17 PHL HB3 1 1
8 1895 1 1 17 PHL HC1 H -3.445 -12.731 -3.536 1.00 . A A . 17 PHL HC1 1 1
8 1896 1 1 17 PHL HC2 H -2.210 -12.508 -2.313 1.00 . A A . 17 PHL HC2 1 1
8 1897 1 1 17 PHL HD1 H -7.039 -13.645 -2.759 1.00 . A A . 17 PHL HD1 1 1
8 1898 1 1 17 PHL HD2 H -6.948 -10.418 0.088 1.00 . A A . 17 PHL HD2 1 1
8 1899 1 1 17 PHL HE1 H -9.033 -14.557 -1.651 1.00 . A A . 17 PHL HE1 1 1
8 1900 1 1 17 PHL HE2 H -8.945 -11.350 1.188 1.00 . A A . 17 PHL HE2 1 1
8 1901 1 1 17 PHL HO H -2.652 -10.233 -2.451 1.00 . A A . 17 PHL HO 1 1
8 1902 1 1 17 PHL HZ H -9.991 -13.417 0.321 1.00 . A A . 17 PHL HZ 1 1
8 1903 1 1 17 PHL N N -3.775 -11.484 -0.349 1.00 . A A . 17 PHL N 1 1
8 1904 1 1 17 PHL O O -2.911 -10.771 -3.205 1.00 . A A . 17 PHL O 1 1
9 1905 1 1 1 ACE C C -2.014 10.455 1.327 1.00 . A A . 1 ACE C 1 1
9 1906 1 1 1 ACE CH3 C -1.206 11.710 1.622 1.00 . A A . 1 ACE CH3 1 1
9 1907 1 1 1 ACE H1 H -1.829 12.625 1.627 1.00 . A A . 1 ACE H1 1 1
9 1908 1 1 1 ACE H2 H -0.697 11.634 2.598 1.00 . A A . 1 ACE H2 1 1
9 1909 1 1 1 ACE H3 H -0.418 11.837 0.855 1.00 . A A . 1 ACE H3 1 1
9 1910 1 1 1 ACE O O -1.775 9.401 1.920 1.00 . A A . 1 ACE O 1 1
9 1911 1 1 2 TRP C C -2.455 8.518 -1.174 1.00 . A A . 2 TRP C 1 1
9 1912 1 1 2 TRP CA C -3.483 9.395 -0.377 1.00 . A A . 2 TRP CA 1 1
9 1913 1 1 2 TRP CB C -4.730 9.802 -1.212 1.00 . A A . 2 TRP CB 1 1
9 1914 1 1 2 TRP CD1 C -4.468 9.954 -3.816 1.00 . A A . 2 TRP CD1 1 1
9 1915 1 1 2 TRP CD2 C -4.352 11.913 -2.763 1.00 . A A . 2 TRP CD2 1 1
9 1916 1 1 2 TRP CE2 C -4.217 12.111 -4.162 1.00 . A A . 2 TRP CE2 1 1
9 1917 1 1 2 TRP CE3 C -4.328 13.020 -1.878 1.00 . A A . 2 TRP CE3 1 1
9 1918 1 1 2 TRP CG C -4.509 10.554 -2.538 1.00 . A A . 2 TRP CG 1 1
9 1919 1 1 2 TRP CH2 C -4.033 14.495 -3.794 1.00 . A A . 2 TRP CH2 1 1
9 1920 1 1 2 TRP CZ2 C -4.061 13.419 -4.684 1.00 . A A . 2 TRP CZ2 1 1
9 1921 1 1 2 TRP CZ3 C -4.163 14.298 -2.414 1.00 . A A . 2 TRP CZ3 1 1
9 1922 1 1 2 TRP H H -3.042 11.519 -0.027 1.00 . A A . 2 TRP H 1 1
9 1923 1 1 2 TRP HA H -3.882 8.751 0.425 1.00 . A A . 2 TRP HA 1 1
9 1924 1 1 2 TRP HB2 H -5.307 8.884 -1.430 1.00 . A A . 2 TRP HB2 1 1
9 1925 1 1 2 TRP HB3 H -5.420 10.393 -0.578 1.00 . A A . 2 TRP HB3 1 1
9 1926 1 1 2 TRP HD1 H -4.579 8.894 -3.993 1.00 . A A . 2 TRP HD1 1 1
9 1927 1 1 2 TRP HE1 H -4.250 10.741 -5.850 1.00 . A A . 2 TRP HE1 1 1
9 1928 1 1 2 TRP HE3 H -4.433 12.885 -0.812 1.00 . A A . 2 TRP HE3 1 1
9 1929 1 1 2 TRP HH2 H -3.913 15.498 -4.178 1.00 . A A . 2 TRP HH2 1 1
9 1930 1 1 2 TRP HZ2 H -3.969 13.587 -5.748 1.00 . A A . 2 TRP HZ2 1 1
9 1931 1 1 2 TRP HZ3 H -4.133 15.151 -1.752 1.00 . A A . 2 TRP HZ3 1 1
9 1932 1 1 2 TRP N N -2.907 10.571 0.331 1.00 . A A . 2 TRP N 1 1
9 1933 1 1 2 TRP NE1 N -4.287 10.904 -4.837 1.00 . A A . 2 TRP NE1 1 1
9 1934 1 1 2 TRP O O -2.616 7.296 -1.239 1.00 . A A . 2 TRP O 1 1
9 1935 1 1 3 ILE C C 0.675 7.632 -1.394 1.00 . A A . 3 ILE C 1 1
9 1936 1 1 3 ILE CA C -0.256 8.420 -2.375 1.00 . A A . 3 ILE CA 1 1
9 1937 1 1 3 ILE CB C 0.518 9.328 -3.396 1.00 . A A . 3 ILE CB 1 1
9 1938 1 1 3 ILE CD1 C 2.140 11.376 -3.652 1.00 . A A . 3 ILE CD1 1 1
9 1939 1 1 3 ILE CG1 C 1.158 10.602 -2.761 1.00 . A A . 3 ILE CG1 1 1
9 1940 1 1 3 ILE CG2 C -0.369 9.669 -4.624 1.00 . A A . 3 ILE CG2 1 1
9 1941 1 1 3 ILE H H -1.387 10.155 -1.617 1.00 . A A . 3 ILE H 1 1
9 1942 1 1 3 ILE HA H -0.719 7.623 -2.972 1.00 . A A . 3 ILE HA 1 1
9 1943 1 1 3 ILE HB H 1.349 8.714 -3.795 1.00 . A A . 3 ILE HB 1 1
9 1944 1 1 3 ILE HD11 H 1.636 11.828 -4.527 1.00 . A A . 3 ILE HD11 1 1
9 1945 1 1 3 ILE HD12 H 2.614 12.203 -3.091 1.00 . A A . 3 ILE HD12 1 1
9 1946 1 1 3 ILE HD13 H 2.952 10.727 -4.030 1.00 . A A . 3 ILE HD13 1 1
9 1947 1 1 3 ILE HG12 H 0.367 11.292 -2.413 1.00 . A A . 3 ILE HG12 1 1
9 1948 1 1 3 ILE HG13 H 1.708 10.315 -1.846 1.00 . A A . 3 ILE HG13 1 1
9 1949 1 1 3 ILE HG21 H -1.203 10.345 -4.360 1.00 . A A . 3 ILE HG21 1 1
9 1950 1 1 3 ILE HG22 H 0.205 10.159 -5.430 1.00 . A A . 3 ILE HG22 1 1
9 1951 1 1 3 ILE HG23 H -0.820 8.763 -5.068 1.00 . A A . 3 ILE HG23 1 1
9 1952 1 1 3 ILE N N -1.403 9.138 -1.749 1.00 . A A . 3 ILE N 1 1
9 1953 1 1 3 ILE O O 1.122 6.534 -1.740 1.00 . A A . 3 ILE O 1 1
9 1954 1 1 4 GLN C C 0.753 6.265 1.548 1.00 . A A . 4 GLN C 1 1
9 1955 1 1 4 GLN CA C 1.597 7.412 0.922 1.00 . A A . 4 GLN CA 1 1
9 1956 1 1 4 GLN CB C 2.078 8.404 2.013 1.00 . A A . 4 GLN CB 1 1
9 1957 1 1 4 GLN CD C 3.223 10.709 1.756 1.00 . A A . 4 GLN CD 1 1
9 1958 1 1 4 GLN CG C 3.365 9.182 1.644 1.00 . A A . 4 GLN CG 1 1
9 1959 1 1 4 GLN H H 0.470 9.059 -0.029 1.00 . A A . 4 GLN H 1 1
9 1960 1 1 4 GLN HA H 2.495 6.933 0.492 1.00 . A A . 4 GLN HA 1 1
9 1961 1 1 4 GLN HB2 H 1.248 9.085 2.292 1.00 . A A . 4 GLN HB2 1 1
9 1962 1 1 4 GLN HB3 H 2.292 7.860 2.953 1.00 . A A . 4 GLN HB3 1 1
9 1963 1 1 4 GLN HE21 H 4.290 10.712 3.454 1.00 . A A . 4 GLN HE21 1 1
9 1964 1 1 4 GLN HE22 H 3.693 12.333 2.830 1.00 . A A . 4 GLN HE22 1 1
9 1965 1 1 4 GLN HG2 H 4.197 8.801 2.270 1.00 . A A . 4 GLN HG2 1 1
9 1966 1 1 4 GLN HG3 H 3.681 8.939 0.611 1.00 . A A . 4 GLN HG3 1 1
9 1967 1 1 4 GLN N N 0.933 8.161 -0.184 1.00 . A A . 4 GLN N 1 1
9 1968 1 1 4 GLN NE2 N 3.795 11.312 2.786 1.00 . A A . 4 GLN NE2 1 1
9 1969 1 1 4 GLN O O 1.313 5.193 1.789 1.00 . A A . 4 GLN O 1 1
9 1970 1 1 4 GLN OE1 O 2.596 11.356 0.917 1.00 . A A . 4 GLN OE1 1 1
9 1971 1 1 5 . C C -1.469 4.143 1.219 1.00 . A A . 5 DIV C 1 1
9 1972 1 1 5 . CA C -1.545 5.401 2.182 1.00 . A A . 5 DIV CA 1 1
9 1973 1 1 5 . CB1 C -1.310 5.071 3.705 1.00 . A A . 5 DIV CB1 1 1
9 1974 1 1 5 . CB2 C -2.944 6.066 2.040 1.00 . A A . 5 DIV CB2 1 1
9 1975 1 1 5 . CG1 C -2.326 4.159 4.429 1.00 . A A . 5 DIV CG1 1 1
9 1976 1 1 5 . H H -0.884 7.405 1.520 1.00 . A A . 5 DIV H 1 1
9 1977 1 1 5 . HB11 H -0.309 4.616 3.830 1.00 . A A . 5 DIV HB11 1 1
9 1978 1 1 5 . HB12 H -1.254 6.012 4.287 1.00 . A A . 5 DIV HB12 1 1
9 1979 1 1 5 . HB21 H -3.142 6.429 1.017 1.00 . A A . 5 DIV HB21 1 1
9 1980 1 1 5 . HB22 H -3.764 5.359 2.267 1.00 . A A . 5 DIV HB22 1 1
9 1981 1 1 5 . HB23 H -3.076 6.935 2.715 1.00 . A A . 5 DIV HB23 1 1
9 1982 1 1 5 . HG11 H -2.474 3.194 3.912 1.00 . A A . 5 DIV HG11 1 1
9 1983 1 1 5 . HG12 H -1.985 3.929 5.455 1.00 . A A . 5 DIV HG12 1 1
9 1984 1 1 5 . HG13 H -3.314 4.645 4.520 1.00 . A A . 5 DIV HG13 1 1
9 1985 1 1 5 . N N -0.565 6.469 1.789 1.00 . A A . 5 DIV N 1 1
9 1986 1 1 5 . O O -1.241 3.022 1.685 1.00 . A A . 5 DIV O 1 1
9 1987 1 1 6 ILE C C -0.084 2.585 -1.258 1.00 . A A . 6 ILE C 1 1
9 1988 1 1 6 ILE CA C -1.502 3.227 -1.115 1.00 . A A . 6 ILE CA 1 1
9 1989 1 1 6 ILE CB C -2.240 3.555 -2.460 1.00 . A A . 6 ILE CB 1 1
9 1990 1 1 6 ILE CD1 C -3.701 2.429 -4.316 1.00 . A A . 6 ILE CD1 1 1
9 1991 1 1 6 ILE CG1 C -2.587 2.268 -3.269 1.00 . A A . 6 ILE CG1 1 1
9 1992 1 1 6 ILE CG2 C -1.508 4.591 -3.346 1.00 . A A . 6 ILE CG2 1 1
9 1993 1 1 6 ILE H H -1.862 5.270 -0.423 1.00 . A A . 6 ILE H 1 1
9 1994 1 1 6 ILE HA H -2.135 2.447 -0.662 1.00 . A A . 6 ILE HA 1 1
9 1995 1 1 6 ILE HB H -3.210 4.009 -2.177 1.00 . A A . 6 ILE HB 1 1
9 1996 1 1 6 ILE HD11 H -3.435 3.162 -5.098 1.00 . A A . 6 ILE HD11 1 1
9 1997 1 1 6 ILE HD12 H -3.906 1.471 -4.826 1.00 . A A . 6 ILE HD12 1 1
9 1998 1 1 6 ILE HD13 H -4.648 2.761 -3.852 1.00 . A A . 6 ILE HD13 1 1
9 1999 1 1 6 ILE HG12 H -1.678 1.869 -3.759 1.00 . A A . 6 ILE HG12 1 1
9 2000 1 1 6 ILE HG13 H -2.906 1.465 -2.577 1.00 . A A . 6 ILE HG13 1 1
9 2001 1 1 6 ILE HG21 H -0.574 4.183 -3.779 1.00 . A A . 6 ILE HG21 1 1
9 2002 1 1 6 ILE HG22 H -2.139 4.932 -4.186 1.00 . A A . 6 ILE HG22 1 1
9 2003 1 1 6 ILE HG23 H -1.232 5.487 -2.769 1.00 . A A . 6 ILE HG23 1 1
9 2004 1 1 6 ILE N N -1.597 4.330 -0.123 1.00 . A A . 6 ILE N 1 1
9 2005 1 1 6 ILE O O -0.026 1.359 -1.272 1.00 . A A . 6 ILE O 1 1
9 2006 1 1 7 THR C C 2.833 1.914 -0.170 1.00 . A A . 7 THR C 1 1
9 2007 1 1 7 THR CA C 2.417 2.786 -1.405 1.00 . A A . 7 THR CA 1 1
9 2008 1 1 7 THR CB C 3.446 3.918 -1.722 1.00 . A A . 7 THR CB 1 1
9 2009 1 1 7 THR CG2 C 4.890 3.435 -1.965 1.00 . A A . 7 THR CG2 1 1
9 2010 1 1 7 THR H H 0.853 4.363 -1.314 1.00 . A A . 7 THR H 1 1
9 2011 1 1 7 THR HA H 2.428 2.107 -2.280 1.00 . A A . 7 THR HA 1 1
9 2012 1 1 7 THR HB H 3.460 4.643 -0.885 1.00 . A A . 7 THR HB 1 1
9 2013 1 1 7 THR HG1 H 3.727 5.291 -3.038 1.00 . A A . 7 THR HG1 1 1
9 2014 1 1 7 THR HG21 H 5.556 4.273 -2.244 1.00 . A A . 7 THR HG21 1 1
9 2015 1 1 7 THR HG22 H 5.328 2.966 -1.064 1.00 . A A . 7 THR HG22 1 1
9 2016 1 1 7 THR HG23 H 4.937 2.692 -2.782 1.00 . A A . 7 THR HG23 1 1
9 2017 1 1 7 THR N N 1.028 3.352 -1.331 1.00 . A A . 7 THR N 1 1
9 2018 1 1 7 THR O O 3.371 0.822 -0.362 1.00 . A A . 7 THR O 1 1
9 2019 1 1 7 THR OG1 O 3.058 4.617 -2.901 1.00 . A A . 7 THR OG1 1 1
9 2020 1 1 8 ABA C C 1.659 0.233 2.262 1.00 . A A . 8 AIB C 1 1
9 2021 1 1 8 ABA CA C 2.570 1.528 2.315 1.00 . A A . 8 AIB CA 1 1
9 2022 1 1 8 ABA H H 1.940 3.188 1.011 1.00 . A A . 8 AIB H 1 1
9 2023 1 1 8 ABA N N 2.549 2.368 1.069 1.00 . A A . 8 AIB N 1 1
9 2024 1 1 8 ABA O O 2.017 -0.812 2.817 1.00 . A A . 8 AIB O 1 1
9 2025 1 1 9 LEU C C 0.124 -1.746 0.062 1.00 . A A . 9 LEU C 1 1
9 2026 1 1 9 LEU CA C -0.356 -0.863 1.254 1.00 . A A . 9 LEU CA 1 1
9 2027 1 1 9 LEU CB C -1.824 -0.383 1.076 1.00 . A A . 9 LEU CB 1 1
9 2028 1 1 9 LEU CD1 C -3.939 0.406 2.292 1.00 . A A . 9 LEU CD1 1 1
9 2029 1 1 9 LEU CD2 C -3.262 -2.018 2.424 1.00 . A A . 9 LEU CD2 1 1
9 2030 1 1 9 LEU CG C -2.745 -0.567 2.318 1.00 . A A . 9 LEU CG 1 1
9 2031 1 1 9 LEU H H 0.339 1.163 1.049 1.00 . A A . 9 LEU H 1 1
9 2032 1 1 9 LEU HA H -0.363 -1.529 2.120 1.00 . A A . 9 LEU HA 1 1
9 2033 1 1 9 LEU HB2 H -1.849 0.670 0.734 1.00 . A A . 9 LEU HB2 1 1
9 2034 1 1 9 LEU HB3 H -2.282 -0.931 0.238 1.00 . A A . 9 LEU HB3 1 1
9 2035 1 1 9 LEU HD11 H -4.579 0.261 1.401 1.00 . A A . 9 LEU HD11 1 1
9 2036 1 1 9 LEU HD12 H -4.581 0.282 3.185 1.00 . A A . 9 LEU HD12 1 1
9 2037 1 1 9 LEU HD13 H -3.605 1.462 2.290 1.00 . A A . 9 LEU HD13 1 1
9 2038 1 1 9 LEU HD21 H -2.439 -2.750 2.443 1.00 . A A . 9 LEU HD21 1 1
9 2039 1 1 9 LEU HD22 H -3.845 -2.183 3.349 1.00 . A A . 9 LEU HD22 1 1
9 2040 1 1 9 LEU HD23 H -3.910 -2.296 1.570 1.00 . A A . 9 LEU HD23 1 1
9 2041 1 1 9 LEU HG H -2.162 -0.339 3.232 1.00 . A A . 9 LEU HG 1 1
9 2042 1 1 9 LEU N N 0.487 0.306 1.589 1.00 . A A . 9 LEU N 1 1
9 2043 1 1 9 LEU O O -0.307 -2.899 0.007 1.00 . A A . 9 LEU O 1 1
9 2044 1 1 10 ABA C C 2.208 -3.433 -1.614 1.00 . A A . 10 AIB C 1 1
9 2045 1 1 10 ABA CA C 1.503 -2.064 -2.037 1.00 . A A . 10 AIB CA 1 1
9 2046 1 1 10 ABA H H 1.385 -0.339 -0.634 1.00 . A A . 10 AIB H 1 1
9 2047 1 1 10 ABA N N 0.979 -1.261 -0.880 1.00 . A A . 10 AIB N 1 1
9 2048 1 1 10 ABA O O 1.796 -4.480 -2.129 1.00 . A A . 10 AIB O 1 1
9 2049 1 1 11 HYP C C 2.649 -5.632 0.796 1.00 . A A . 11 HYP C 1 1
9 2050 1 1 11 HYP CA C 3.663 -4.839 -0.099 1.00 . A A . 11 HYP CA 1 1
9 2051 1 1 11 HYP CB C 4.908 -4.418 0.704 1.00 . A A . 11 HYP CB 1 1
9 2052 1 1 11 HYP CD C 3.753 -2.398 0.091 1.00 . A A . 11 HYP CD 1 1
9 2053 1 1 11 HYP CG C 4.579 -3.015 1.220 1.00 . A A . 11 HYP CG 1 1
9 2054 1 1 11 HYP HA H 3.985 -5.511 -0.917 1.00 . A A . 11 HYP HA 1 1
9 2055 1 1 11 HYP HB2 H 5.147 -5.112 1.529 1.00 . A A . 11 HYP HB2 1 1
9 2056 1 1 11 HYP HB3 H 5.798 -4.389 0.047 1.00 . A A . 11 HYP HB3 1 1
9 2057 1 1 11 HYP HD1 H 6.192 -2.717 2.221 1.00 . A A . 11 HYP HD1 1 1
9 2058 1 1 11 HYP HD22 H 2.971 -1.760 0.526 1.00 . A A . 11 HYP HD22 1 1
9 2059 1 1 11 HYP HD23 H 4.340 -1.770 -0.586 1.00 . A A . 11 HYP HD23 1 1
9 2060 1 1 11 HYP HG H 3.958 -3.092 2.137 1.00 . A A . 11 HYP HG 1 1
9 2061 1 1 11 HYP N N 3.201 -3.535 -0.667 1.00 . A A . 11 HYP N 1 1
9 2062 1 1 11 HYP O O 2.866 -6.821 1.043 1.00 . A A . 11 HYP O 1 1
9 2063 1 1 11 HYP OD1 O 5.750 -2.261 1.501 1.00 . A A . 11 HYP OD1 1 1
9 2064 1 1 12 GLN C C -0.720 -6.136 0.933 1.00 . A A . 12 GLN C 1 1
9 2065 1 1 12 GLN CA C 0.406 -5.625 1.897 1.00 . A A . 12 GLN CA 1 1
9 2066 1 1 12 GLN CB C -0.165 -4.663 2.975 1.00 . A A . 12 GLN CB 1 1
9 2067 1 1 12 GLN CD C 0.158 -3.282 5.120 1.00 . A A . 12 GLN CD 1 1
9 2068 1 1 12 GLN CG C 0.793 -4.264 4.123 1.00 . A A . 12 GLN CG 1 1
9 2069 1 1 12 GLN H H 1.491 -4.003 1.014 1.00 . A A . 12 GLN H 1 1
9 2070 1 1 12 GLN HA H 0.808 -6.483 2.431 1.00 . A A . 12 GLN HA 1 1
9 2071 1 1 12 GLN HB2 H -0.535 -3.753 2.476 1.00 . A A . 12 GLN HB2 1 1
9 2072 1 1 12 GLN HB3 H -1.061 -5.123 3.434 1.00 . A A . 12 GLN HB3 1 1
9 2073 1 1 12 GLN HE21 H 0.459 -4.574 6.624 1.00 . A A . 12 GLN HE21 1 1
9 2074 1 1 12 GLN HE22 H -0.356 -2.981 7.032 1.00 . A A . 12 GLN HE22 1 1
9 2075 1 1 12 GLN HG2 H 1.152 -5.182 4.630 1.00 . A A . 12 GLN HG2 1 1
9 2076 1 1 12 GLN HG3 H 1.699 -3.784 3.711 1.00 . A A . 12 GLN HG3 1 1
9 2077 1 1 12 GLN N N 1.559 -4.986 1.250 1.00 . A A . 12 GLN N 1 1
9 2078 1 1 12 GLN NE2 N 0.055 -3.661 6.383 1.00 . A A . 12 GLN NE2 1 1
9 2079 1 1 12 GLN O O -1.656 -6.735 1.459 1.00 . A A . 12 GLN O 1 1
9 2080 1 1 12 GLN OE1 O -0.231 -2.168 4.764 1.00 . A A . 12 GLN OE1 1 1
9 2081 1 1 13 ABA C C -1.155 -8.285 -1.449 1.00 . A A . 13 AIB C 1 1
9 2082 1 1 13 ABA CA C -1.510 -6.725 -1.405 1.00 . A A . 13 AIB CA 1 1
9 2083 1 1 13 ABA H H 0.204 -5.501 -0.747 1.00 . A A . 13 AIB H 1 1
9 2084 1 1 13 ABA N N -0.668 -5.957 -0.420 1.00 . A A . 13 AIB N 1 1
9 2085 1 1 13 ABA O O -2.087 -9.091 -1.337 1.00 . A A . 13 AIB O 1 1
9 2086 1 1 14 HYP C C 0.272 -11.116 -0.415 1.00 . A A . 14 HYP C 1 1
9 2087 1 1 14 HYP CA C 0.432 -10.252 -1.702 1.00 . A A . 14 HYP CA 1 1
9 2088 1 1 14 HYP CB C 1.884 -10.258 -2.229 1.00 . A A . 14 HYP CB 1 1
9 2089 1 1 14 HYP CD C 1.332 -7.972 -1.780 1.00 . A A . 14 HYP CD 1 1
9 2090 1 1 14 HYP CG C 2.484 -8.968 -1.673 1.00 . A A . 14 HYP CG 1 1
9 2091 1 1 14 HYP HA H -0.208 -10.697 -2.487 1.00 . A A . 14 HYP HA 1 1
9 2092 1 1 14 HYP HB2 H 2.464 -11.151 -1.929 1.00 . A A . 14 HYP HB2 1 1
9 2093 1 1 14 HYP HB3 H 1.885 -10.240 -3.336 1.00 . A A . 14 HYP HB3 1 1
9 2094 1 1 14 HYP HD1 H 3.285 -8.296 -3.285 1.00 . A A . 14 HYP HD1 1 1
9 2095 1 1 14 HYP HD22 H 1.450 -7.201 -1.009 1.00 . A A . 14 HYP HD22 1 1
9 2096 1 1 14 HYP HD23 H 1.324 -7.452 -2.750 1.00 . A A . 14 HYP HD23 1 1
9 2097 1 1 14 HYP HG H 2.743 -9.101 -0.600 1.00 . A A . 14 HYP HG 1 1
9 2098 1 1 14 HYP N N 0.119 -8.792 -1.598 1.00 . A A . 14 HYP N 1 1
9 2099 1 1 14 HYP O O -0.262 -12.223 -0.518 1.00 . A A . 14 HYP O 1 1
9 2100 1 1 14 HYP OD1 O 3.616 -8.538 -2.416 1.00 . A A . 14 HYP OD1 1 1
9 2101 1 1 15 ABA C C -0.885 -11.859 2.393 1.00 . A A . 15 AIB C 1 1
9 2102 1 1 15 ABA CA C 0.595 -11.338 2.089 1.00 . A A . 15 AIB CA 1 1
9 2103 1 1 15 ABA H H 1.151 -9.704 0.708 1.00 . A A . 15 AIB H 1 1
9 2104 1 1 15 ABA N N 0.742 -10.643 0.768 1.00 . A A . 15 AIB N 1 1
9 2105 1 1 15 ABA O O -1.029 -13.054 2.684 1.00 . A A . 15 AIB O 1 1
9 2106 1 1 16 PRO C C -3.885 -12.311 0.945 1.00 . A A . 16 PRO C 1 1
9 2107 1 1 16 PRO CA C -3.396 -11.646 2.279 1.00 . A A . 16 PRO CA 1 1
9 2108 1 1 16 PRO CB C -4.237 -10.416 2.676 1.00 . A A . 16 PRO CB 1 1
9 2109 1 1 16 PRO CD C -2.014 -9.622 2.138 1.00 . A A . 16 PRO CD 1 1
9 2110 1 1 16 PRO CG C -3.489 -9.217 2.097 1.00 . A A . 16 PRO CG 1 1
9 2111 1 1 16 PRO HA H -3.493 -12.400 3.086 1.00 . A A . 16 PRO HA 1 1
9 2112 1 1 16 PRO HB2 H -5.286 -10.464 2.325 1.00 . A A . 16 PRO HB2 1 1
9 2113 1 1 16 PRO HB3 H -4.282 -10.332 3.778 1.00 . A A . 16 PRO HB3 1 1
9 2114 1 1 16 PRO HD2 H -1.497 -9.292 1.223 1.00 . A A . 16 PRO HD2 1 1
9 2115 1 1 16 PRO HD3 H -1.498 -9.141 2.986 1.00 . A A . 16 PRO HD3 1 1
9 2116 1 1 16 PRO HG2 H -3.802 -9.042 1.048 1.00 . A A . 16 PRO HG2 1 1
9 2117 1 1 16 PRO HG3 H -3.691 -8.284 2.653 1.00 . A A . 16 PRO HG3 1 1
9 2118 1 1 16 PRO N N -2.014 -11.088 2.275 1.00 . A A . 16 PRO N 1 1
9 2119 1 1 16 PRO O O -4.563 -13.338 1.025 1.00 . A A . 16 PRO O 1 1
9 2120 1 1 17 PHL C C -2.961 -12.346 -2.535 1.00 . A A . 17 PHL C 1 1
9 2121 1 1 17 PHL CA C -4.138 -12.215 -1.542 1.00 . A A . 17 PHL CA 1 1
9 2122 1 1 17 PHL CB C -5.249 -11.252 -2.055 1.00 . A A . 17 PHL CB 1 1
9 2123 1 1 17 PHL CD1 C -7.490 -12.438 -1.802 1.00 . A A . 17 PHL CD1 1 1
9 2124 1 1 17 PHL CD2 C -7.006 -10.602 -0.309 1.00 . A A . 17 PHL CD2 1 1
9 2125 1 1 17 PHL CE1 C -8.721 -12.622 -1.174 1.00 . A A . 17 PHL CE1 1 1
9 2126 1 1 17 PHL CE2 C -8.236 -10.788 0.318 1.00 . A A . 17 PHL CE2 1 1
9 2127 1 1 17 PHL CG C -6.621 -11.429 -1.369 1.00 . A A . 17 PHL CG 1 1
9 2128 1 1 17 PHL CZ C -9.092 -11.799 -0.116 1.00 . A A . 17 PHL CZ 1 1
9 2129 1 1 17 PHL H H -3.027 -10.872 -0.195 1.00 . A A . 17 PHL H 1 1
9 2130 1 1 17 PHL HA H -4.565 -13.231 -1.437 1.00 . A A . 17 PHL HA 1 1
9 2131 1 1 17 PHL HB2 H -4.910 -10.198 -1.981 1.00 . A A . 17 PHL HB2 1 1
9 2132 1 1 17 PHL HB3 H -5.394 -11.396 -3.143 1.00 . A A . 17 PHL HB3 1 1
9 2133 1 1 17 PHL HC1 H -2.151 -12.958 -2.102 1.00 . A A . 17 PHL HC1 1 1
9 2134 1 1 17 PHL HC2 H -2.514 -11.361 -2.769 1.00 . A A . 17 PHL HC2 1 1
9 2135 1 1 17 PHL HD1 H -7.215 -13.087 -2.619 1.00 . A A . 17 PHL HD1 1 1
9 2136 1 1 17 PHL HD2 H -6.352 -9.816 0.041 1.00 . A A . 17 PHL HD2 1 1
9 2137 1 1 17 PHL HE1 H -9.385 -13.407 -1.509 1.00 . A A . 17 PHL HE1 1 1
9 2138 1 1 17 PHL HE2 H -8.530 -10.154 1.141 1.00 . A A . 17 PHL HE2 1 1
9 2139 1 1 17 PHL HO H -3.956 -12.341 -4.182 1.00 . A A . 17 PHL HO 1 1
9 2140 1 1 17 PHL HZ H -10.047 -11.947 0.371 1.00 . A A . 17 PHL HZ 1 1
9 2141 1 1 17 PHL N N -3.597 -11.730 -0.244 1.00 . A A . 17 PHL N 1 1
9 2142 1 1 17 PHL O O -3.380 -12.970 -3.742 1.00 . A A . 17 PHL O 1 1
10 2143 1 1 1 ACE C C -2.473 10.088 1.451 1.00 . A A . 1 ACE C 1 1
10 2144 1 1 1 ACE CH3 C -1.648 11.313 1.813 1.00 . A A . 1 ACE CH3 1 1
10 2145 1 1 1 ACE H1 H -2.238 12.246 1.774 1.00 . A A . 1 ACE H1 1 1
10 2146 1 1 1 ACE H2 H -1.218 11.215 2.826 1.00 . A A . 1 ACE H2 1 1
10 2147 1 1 1 ACE H3 H -0.800 11.413 1.107 1.00 . A A . 1 ACE H3 1 1
10 2148 1 1 1 ACE O O -2.320 9.031 2.067 1.00 . A A . 1 ACE O 1 1
10 2149 1 1 2 TRP C C -2.662 8.270 -1.150 1.00 . A A . 2 TRP C 1 1
10 2150 1 1 2 TRP CA C -3.777 9.064 -0.390 1.00 . A A . 2 TRP CA 1 1
10 2151 1 1 2 TRP CB C -4.926 9.519 -1.333 1.00 . A A . 2 TRP CB 1 1
10 2152 1 1 2 TRP CD1 C -5.516 7.774 -3.205 1.00 . A A . 2 TRP CD1 1 1
10 2153 1 1 2 TRP CD2 C -6.760 7.634 -1.364 1.00 . A A . 2 TRP CD2 1 1
10 2154 1 1 2 TRP CE2 C -7.151 6.626 -2.281 1.00 . A A . 2 TRP CE2 1 1
10 2155 1 1 2 TRP CE3 C -7.401 7.744 -0.102 1.00 . A A . 2 TRP CE3 1 1
10 2156 1 1 2 TRP CG C -5.734 8.362 -1.939 1.00 . A A . 2 TRP CG 1 1
10 2157 1 1 2 TRP CH2 C -8.820 5.858 -0.708 1.00 . A A . 2 TRP CH2 1 1
10 2158 1 1 2 TRP CZ2 C -8.194 5.728 -1.949 1.00 . A A . 2 TRP CZ2 1 1
10 2159 1 1 2 TRP CZ3 C -8.429 6.848 0.201 1.00 . A A . 2 TRP CZ3 1 1
10 2160 1 1 2 TRP H H -3.376 11.178 0.028 1.00 . A A . 2 TRP H 1 1
10 2161 1 1 2 TRP HA H -4.228 8.388 0.352 1.00 . A A . 2 TRP HA 1 1
10 2162 1 1 2 TRP HB2 H -5.631 10.175 -0.786 1.00 . A A . 2 TRP HB2 1 1
10 2163 1 1 2 TRP HB3 H -4.524 10.159 -2.144 1.00 . A A . 2 TRP HB3 1 1
10 2164 1 1 2 TRP HD1 H -4.753 8.092 -3.900 1.00 . A A . 2 TRP HD1 1 1
10 2165 1 1 2 TRP HE1 H -6.427 6.083 -4.258 1.00 . A A . 2 TRP HE1 1 1
10 2166 1 1 2 TRP HE3 H -7.106 8.501 0.610 1.00 . A A . 2 TRP HE3 1 1
10 2167 1 1 2 TRP HH2 H -9.623 5.184 -0.445 1.00 . A A . 2 TRP HH2 1 1
10 2168 1 1 2 TRP HZ2 H -8.505 4.958 -2.640 1.00 . A A . 2 TRP HZ2 1 1
10 2169 1 1 2 TRP HZ3 H -8.931 6.923 1.155 1.00 . A A . 2 TRP HZ3 1 1
10 2170 1 1 2 TRP N N -3.269 10.227 0.382 1.00 . A A . 2 TRP N 1 1
10 2171 1 1 2 TRP NE1 N -6.385 6.693 -3.436 1.00 . A A . 2 TRP NE1 1 1
10 2172 1 1 2 TRP O O -2.740 7.040 -1.200 1.00 . A A . 2 TRP O 1 1
10 2173 1 1 3 ILE C C 0.417 7.416 -1.474 1.00 . A A . 3 ILE C 1 1
10 2174 1 1 3 ILE CA C -0.500 8.265 -2.412 1.00 . A A . 3 ILE CA 1 1
10 2175 1 1 3 ILE CB C 0.216 9.248 -3.408 1.00 . A A . 3 ILE CB 1 1
10 2176 1 1 3 ILE CD1 C 2.241 7.878 -4.476 1.00 . A A . 3 ILE CD1 1 1
10 2177 1 1 3 ILE CG1 C 0.875 8.566 -4.645 1.00 . A A . 3 ILE CG1 1 1
10 2178 1 1 3 ILE CG2 C 1.137 10.301 -2.741 1.00 . A A . 3 ILE CG2 1 1
10 2179 1 1 3 ILE H H -1.686 9.963 -1.624 1.00 . A A . 3 ILE H 1 1
10 2180 1 1 3 ILE HA H -0.995 7.512 -3.036 1.00 . A A . 3 ILE HA 1 1
10 2181 1 1 3 ILE HB H -0.595 9.844 -3.872 1.00 . A A . 3 ILE HB 1 1
10 2182 1 1 3 ILE HD11 H 2.229 7.099 -3.696 1.00 . A A . 3 ILE HD11 1 1
10 2183 1 1 3 ILE HD12 H 2.553 7.388 -5.416 1.00 . A A . 3 ILE HD12 1 1
10 2184 1 1 3 ILE HD13 H 3.035 8.602 -4.213 1.00 . A A . 3 ILE HD13 1 1
10 2185 1 1 3 ILE HG12 H 0.166 7.832 -5.073 1.00 . A A . 3 ILE HG12 1 1
10 2186 1 1 3 ILE HG13 H 0.987 9.326 -5.440 1.00 . A A . 3 ILE HG13 1 1
10 2187 1 1 3 ILE HG21 H 2.024 9.840 -2.269 1.00 . A A . 3 ILE HG21 1 1
10 2188 1 1 3 ILE HG22 H 1.506 11.041 -3.476 1.00 . A A . 3 ILE HG22 1 1
10 2189 1 1 3 ILE HG23 H 0.606 10.868 -1.953 1.00 . A A . 3 ILE HG23 1 1
10 2190 1 1 3 ILE N N -1.644 8.943 -1.732 1.00 . A A . 3 ILE N 1 1
10 2191 1 1 3 ILE O O 0.726 6.271 -1.814 1.00 . A A . 3 ILE O 1 1
10 2192 1 1 4 GLN C C 0.651 6.094 1.504 1.00 . A A . 4 GLN C 1 1
10 2193 1 1 4 GLN CA C 1.492 7.169 0.763 1.00 . A A . 4 GLN CA 1 1
10 2194 1 1 4 GLN CB C 2.231 8.109 1.752 1.00 . A A . 4 GLN CB 1 1
10 2195 1 1 4 GLN CD C 4.767 7.538 1.370 1.00 . A A . 4 GLN CD 1 1
10 2196 1 1 4 GLN CG C 3.625 8.573 1.263 1.00 . A A . 4 GLN CG 1 1
10 2197 1 1 4 GLN H H 0.420 8.887 -0.145 1.00 . A A . 4 GLN H 1 1
10 2198 1 1 4 GLN HA H 2.276 6.591 0.250 1.00 . A A . 4 GLN HA 1 1
10 2199 1 1 4 GLN HB2 H 1.602 8.992 1.982 1.00 . A A . 4 GLN HB2 1 1
10 2200 1 1 4 GLN HB3 H 2.367 7.614 2.734 1.00 . A A . 4 GLN HB3 1 1
10 2201 1 1 4 GLN HE21 H 6.089 8.961 0.866 1.00 . A A . 4 GLN HE21 1 1
10 2202 1 1 4 GLN HE22 H 6.754 7.292 1.247 1.00 . A A . 4 GLN HE22 1 1
10 2203 1 1 4 GLN HG2 H 3.546 8.915 0.215 1.00 . A A . 4 GLN HG2 1 1
10 2204 1 1 4 GLN HG3 H 3.906 9.466 1.850 1.00 . A A . 4 GLN HG3 1 1
10 2205 1 1 4 GLN N N 0.791 7.946 -0.295 1.00 . A A . 4 GLN N 1 1
10 2206 1 1 4 GLN NE2 N 5.994 7.971 1.122 1.00 . A A . 4 GLN NE2 1 1
10 2207 1 1 4 GLN O O 1.227 5.053 1.820 1.00 . A A . 4 GLN O 1 1
10 2208 1 1 4 GLN OE1 O 4.579 6.358 1.673 1.00 . A A . 4 GLN OE1 1 1
10 2209 1 1 5 . C C -1.526 3.930 1.176 1.00 . A A . 5 DIV C 1 1
10 2210 1 1 5 . CA C -1.621 5.178 2.154 1.00 . A A . 5 DIV CA 1 1
10 2211 1 1 5 . CB1 C -1.345 4.837 3.668 1.00 . A A . 5 DIV CB1 1 1
10 2212 1 1 5 . CB2 C -3.048 5.792 2.054 1.00 . A A . 5 DIV CB2 1 1
10 2213 1 1 5 . CG1 C -2.320 3.905 4.420 1.00 . A A . 5 DIV CG1 1 1
10 2214 1 1 5 . H H -1.020 7.196 1.445 1.00 . A A . 5 DIV H 1 1
10 2215 1 1 5 . HB11 H -0.338 4.395 3.765 1.00 . A A . 5 DIV HB11 1 1
10 2216 1 1 5 . HB12 H -1.285 5.771 4.258 1.00 . A A . 5 DIV HB12 1 1
10 2217 1 1 5 . HB21 H -3.291 6.145 1.037 1.00 . A A . 5 DIV HB21 1 1
10 2218 1 1 5 . HB22 H -3.834 5.057 2.312 1.00 . A A . 5 DIV HB22 1 1
10 2219 1 1 5 . HB23 H -3.188 6.653 2.734 1.00 . A A . 5 DIV HB23 1 1
10 2220 1 1 5 . HG11 H -2.480 2.946 3.897 1.00 . A A . 5 DIV HG11 1 1
10 2221 1 1 5 . HG12 H -1.937 3.660 5.427 1.00 . A A . 5 DIV HG12 1 1
10 2222 1 1 5 . HG13 H -3.311 4.374 4.561 1.00 . A A . 5 DIV HG13 1 1
10 2223 1 1 5 . N N -0.672 6.278 1.746 1.00 . A A . 5 DIV N 1 1
10 2224 1 1 5 . O O -1.308 2.802 1.624 1.00 . A A . 5 DIV O 1 1
10 2225 1 1 6 ILE C C 0.003 2.496 -1.249 1.00 . A A . 6 ILE C 1 1
10 2226 1 1 6 ILE CA C -1.440 3.090 -1.199 1.00 . A A . 6 ILE CA 1 1
10 2227 1 1 6 ILE CB C -2.010 3.577 -2.587 1.00 . A A . 6 ILE CB 1 1
10 2228 1 1 6 ILE CD1 C -4.547 2.866 -2.254 1.00 . A A . 6 ILE CD1 1 1
10 2229 1 1 6 ILE CG1 C -3.525 3.966 -2.591 1.00 . A A . 6 ILE CG1 1 1
10 2230 1 1 6 ILE CG2 C -1.731 2.609 -3.770 1.00 . A A . 6 ILE CG2 1 1
10 2231 1 1 6 ILE H H -1.890 5.080 -0.449 1.00 . A A . 6 ILE H 1 1
10 2232 1 1 6 ILE HA H -2.073 2.256 -0.869 1.00 . A A . 6 ILE HA 1 1
10 2233 1 1 6 ILE HB H -1.463 4.507 -2.843 1.00 . A A . 6 ILE HB 1 1
10 2234 1 1 6 ILE HD11 H -4.413 2.475 -1.229 1.00 . A A . 6 ILE HD11 1 1
10 2235 1 1 6 ILE HD12 H -5.579 3.257 -2.319 1.00 . A A . 6 ILE HD12 1 1
10 2236 1 1 6 ILE HD13 H -4.481 2.010 -2.950 1.00 . A A . 6 ILE HD13 1 1
10 2237 1 1 6 ILE HG12 H -3.693 4.803 -1.893 1.00 . A A . 6 ILE HG12 1 1
10 2238 1 1 6 ILE HG13 H -3.787 4.390 -3.579 1.00 . A A . 6 ILE HG13 1 1
10 2239 1 1 6 ILE HG21 H -2.153 1.603 -3.590 1.00 . A A . 6 ILE HG21 1 1
10 2240 1 1 6 ILE HG22 H -2.151 2.983 -4.721 1.00 . A A . 6 ILE HG22 1 1
10 2241 1 1 6 ILE HG23 H -0.648 2.480 -3.945 1.00 . A A . 6 ILE HG23 1 1
10 2242 1 1 6 ILE N N -1.609 4.143 -0.164 1.00 . A A . 6 ILE N 1 1
10 2243 1 1 6 ILE O O 0.118 1.279 -1.131 1.00 . A A . 6 ILE O 1 1
10 2244 1 1 7 THR C C 3.023 2.022 -0.269 1.00 . A A . 7 THR C 1 1
10 2245 1 1 7 THR CA C 2.476 2.764 -1.535 1.00 . A A . 7 THR CA 1 1
10 2246 1 1 7 THR CB C 3.480 3.826 -2.075 1.00 . A A . 7 THR CB 1 1
10 2247 1 1 7 THR CG2 C 3.225 4.245 -3.537 1.00 . A A . 7 THR CG2 1 1
10 2248 1 1 7 THR H H 0.866 4.294 -1.508 1.00 . A A . 7 THR H 1 1
10 2249 1 1 7 THR HA H 2.443 1.983 -2.323 1.00 . A A . 7 THR HA 1 1
10 2250 1 1 7 THR HB H 4.500 3.400 -2.046 1.00 . A A . 7 THR HB 1 1
10 2251 1 1 7 THR HG1 H 2.612 5.391 -1.377 1.00 . A A . 7 THR HG1 1 1
10 2252 1 1 7 THR HG21 H 3.971 4.981 -3.887 1.00 . A A . 7 THR HG21 1 1
10 2253 1 1 7 THR HG22 H 3.278 3.380 -4.224 1.00 . A A . 7 THR HG22 1 1
10 2254 1 1 7 THR HG23 H 2.228 4.703 -3.665 1.00 . A A . 7 THR HG23 1 1
10 2255 1 1 7 THR N N 1.076 3.293 -1.429 1.00 . A A . 7 THR N 1 1
10 2256 1 1 7 THR O O 3.635 0.962 -0.420 1.00 . A A . 7 THR O 1 1
10 2257 1 1 7 THR OG1 O 3.478 4.993 -1.262 1.00 . A A . 7 THR OG1 1 1
10 2258 1 1 8 ABA C C 2.038 0.430 2.328 1.00 . A A . 8 AIB C 1 1
10 2259 1 1 8 ABA CA C 2.907 1.752 2.246 1.00 . A A . 8 AIB CA 1 1
10 2260 1 1 8 ABA H H 2.158 3.348 0.910 1.00 . A A . 8 AIB H 1 1
10 2261 1 1 8 ABA N N 2.761 2.523 0.961 1.00 . A A . 8 AIB N 1 1
10 2262 1 1 8 ABA O O 2.477 -0.564 2.918 1.00 . A A . 8 AIB O 1 1
10 2263 1 1 9 LEU C C 0.503 -1.715 0.327 1.00 . A A . 9 LEU C 1 1
10 2264 1 1 9 LEU CA C 0.035 -0.829 1.522 1.00 . A A . 9 LEU CA 1 1
10 2265 1 1 9 LEU CB C -1.470 -0.472 1.341 1.00 . A A . 9 LEU CB 1 1
10 2266 1 1 9 LEU CD1 C -3.704 0.333 2.222 1.00 . A A . 9 LEU CD1 1 1
10 2267 1 1 9 LEU CD2 C -2.468 -1.418 3.533 1.00 . A A . 9 LEU CD2 1 1
10 2268 1 1 9 LEU CG C -2.307 -0.185 2.618 1.00 . A A . 9 LEU CG 1 1
10 2269 1 1 9 LEU H H 0.562 1.220 1.174 1.00 . A A . 9 LEU H 1 1
10 2270 1 1 9 LEU HA H 0.136 -1.450 2.424 1.00 . A A . 9 LEU HA 1 1
10 2271 1 1 9 LEU HB2 H -1.556 0.381 0.640 1.00 . A A . 9 LEU HB2 1 1
10 2272 1 1 9 LEU HB3 H -1.980 -1.287 0.797 1.00 . A A . 9 LEU HB3 1 1
10 2273 1 1 9 LEU HD11 H -4.275 -0.420 1.643 1.00 . A A . 9 LEU HD11 1 1
10 2274 1 1 9 LEU HD12 H -4.313 0.594 3.107 1.00 . A A . 9 LEU HD12 1 1
10 2275 1 1 9 LEU HD13 H -3.643 1.244 1.597 1.00 . A A . 9 LEU HD13 1 1
10 2276 1 1 9 LEU HD21 H -1.503 -1.751 3.956 1.00 . A A . 9 LEU HD21 1 1
10 2277 1 1 9 LEU HD22 H -3.126 -1.204 4.395 1.00 . A A . 9 LEU HD22 1 1
10 2278 1 1 9 LEU HD23 H -2.905 -2.281 2.996 1.00 . A A . 9 LEU HD23 1 1
10 2279 1 1 9 LEU HG H -1.807 0.610 3.199 1.00 . A A . 9 LEU HG 1 1
10 2280 1 1 9 LEU N N 0.813 0.411 1.747 1.00 . A A . 9 LEU N 1 1
10 2281 1 1 9 LEU O O 0.051 -2.861 0.283 1.00 . A A . 9 LEU O 1 1
10 2282 1 1 10 ABA C C 2.455 -3.519 -1.382 1.00 . A A . 10 AIB C 1 1
10 2283 1 1 10 ABA CA C 1.862 -2.089 -1.778 1.00 . A A . 10 AIB CA 1 1
10 2284 1 1 10 ABA H H 1.672 -0.279 -0.478 1.00 . A A . 10 AIB H 1 1
10 2285 1 1 10 ABA N N 1.362 -1.257 -0.627 1.00 . A A . 10 AIB N 1 1
10 2286 1 1 10 ABA O O 2.001 -4.513 -1.961 1.00 . A A . 10 AIB O 1 1
10 2287 1 1 11 HYP C C 2.687 -5.873 0.909 1.00 . A A . 11 HYP C 1 1
10 2288 1 1 11 HYP CA C 3.773 -5.086 0.094 1.00 . A A . 11 HYP CA 1 1
10 2289 1 1 11 HYP CB C 5.034 -4.786 0.923 1.00 . A A . 11 HYP CB 1 1
10 2290 1 1 11 HYP CD C 3.954 -2.664 0.459 1.00 . A A . 11 HYP CD 1 1
10 2291 1 1 11 HYP CG C 4.815 -3.386 1.503 1.00 . A A . 11 HYP CG 1 1
10 2292 1 1 11 HYP HA H 4.063 -5.720 -0.766 1.00 . A A . 11 HYP HA 1 1
10 2293 1 1 11 HYP HB2 H 5.232 -5.536 1.709 1.00 . A A . 11 HYP HB2 1 1
10 2294 1 1 11 HYP HB3 H 5.923 -4.786 0.261 1.00 . A A . 11 HYP HB3 1 1
10 2295 1 1 11 HYP HD1 H 6.566 -3.300 2.292 1.00 . A A . 11 HYP HD1 1 1
10 2296 1 1 11 HYP HD22 H 3.143 -2.125 0.968 1.00 . A A . 11 HYP HD22 1 1
10 2297 1 1 11 HYP HD23 H 4.509 -1.916 -0.128 1.00 . A A . 11 HYP HD23 1 1
10 2298 1 1 11 HYP HG H 4.259 -3.464 2.456 1.00 . A A . 11 HYP HG 1 1
10 2299 1 1 11 HYP N N 3.404 -3.726 -0.405 1.00 . A A . 11 HYP N 1 1
10 2300 1 1 11 HYP O O 2.789 -7.097 1.024 1.00 . A A . 11 HYP O 1 1
10 2301 1 1 11 HYP OD1 O 6.051 -2.720 1.726 1.00 . A A . 11 HYP OD1 1 1
10 2302 1 1 12 GLN C C -0.772 -5.955 0.981 1.00 . A A . 12 GLN C 1 1
10 2303 1 1 12 GLN CA C 0.424 -5.773 1.979 1.00 . A A . 12 GLN CA 1 1
10 2304 1 1 12 GLN CB C 0.026 -4.956 3.248 1.00 . A A . 12 GLN CB 1 1
10 2305 1 1 12 GLN CD C 0.792 -6.530 5.202 1.00 . A A . 12 GLN CD 1 1
10 2306 1 1 12 GLN CG C 0.927 -5.168 4.490 1.00 . A A . 12 GLN CG 1 1
10 2307 1 1 12 GLN H H 1.665 -4.185 1.278 1.00 . A A . 12 GLN H 1 1
10 2308 1 1 12 GLN HA H 0.696 -6.769 2.313 1.00 . A A . 12 GLN HA 1 1
10 2309 1 1 12 GLN HB2 H -0.005 -3.876 3.005 1.00 . A A . 12 GLN HB2 1 1
10 2310 1 1 12 GLN HB3 H -1.012 -5.185 3.554 1.00 . A A . 12 GLN HB3 1 1
10 2311 1 1 12 GLN HE21 H 2.406 -6.095 6.312 1.00 . A A . 12 GLN HE21 1 1
10 2312 1 1 12 GLN HE22 H 1.572 -7.698 6.629 1.00 . A A . 12 GLN HE22 1 1
10 2313 1 1 12 GLN HG2 H 1.984 -4.997 4.206 1.00 . A A . 12 GLN HG2 1 1
10 2314 1 1 12 GLN HG3 H 0.690 -4.377 5.224 1.00 . A A . 12 GLN HG3 1 1
10 2315 1 1 12 GLN N N 1.655 -5.182 1.432 1.00 . A A . 12 GLN N 1 1
10 2316 1 1 12 GLN NE2 N 1.685 -6.804 6.141 1.00 . A A . 12 GLN NE2 1 1
10 2317 1 1 12 GLN O O -1.848 -6.306 1.463 1.00 . A A . 12 GLN O 1 1
10 2318 1 1 12 GLN OE1 O -0.102 -7.337 4.945 1.00 . A A . 12 GLN OE1 1 1
10 2319 1 1 13 ABA C C -1.266 -7.965 -1.549 1.00 . A A . 13 AIB C 1 1
10 2320 1 1 13 ABA CA C -1.525 -6.396 -1.408 1.00 . A A . 13 AIB CA 1 1
10 2321 1 1 13 ABA H H 0.317 -5.479 -0.649 1.00 . A A . 13 AIB H 1 1
10 2322 1 1 13 ABA N N -0.627 -5.789 -0.364 1.00 . A A . 13 AIB N 1 1
10 2323 1 1 13 ABA O O -2.240 -8.720 -1.440 1.00 . A A . 13 AIB O 1 1
10 2324 1 1 14 HYP C C 0.024 -10.884 -0.628 1.00 . A A . 14 HYP C 1 1
10 2325 1 1 14 HYP CA C 0.181 -10.011 -1.914 1.00 . A A . 14 HYP CA 1 1
10 2326 1 1 14 HYP CB C 1.600 -10.097 -2.511 1.00 . A A . 14 HYP CB 1 1
10 2327 1 1 14 HYP CD C 1.230 -7.793 -1.962 1.00 . A A . 14 HYP CD 1 1
10 2328 1 1 14 HYP CG C 2.313 -8.867 -1.948 1.00 . A A . 14 HYP CG 1 1
10 2329 1 1 14 HYP HA H -0.525 -10.404 -2.672 1.00 . A A . 14 HYP HA 1 1
10 2330 1 1 14 HYP HB2 H 2.132 -11.037 -2.267 1.00 . A A . 14 HYP HB2 1 1
10 2331 1 1 14 HYP HB3 H 1.550 -10.046 -3.616 1.00 . A A . 14 HYP HB3 1 1
10 2332 1 1 14 HYP HD1 H 3.087 -8.249 -3.595 1.00 . A A . 14 HYP HD1 1 1
10 2333 1 1 14 HYP HD22 H 1.425 -7.067 -1.166 1.00 . A A . 14 HYP HD22 1 1
10 2334 1 1 14 HYP HD23 H 1.221 -7.236 -2.913 1.00 . A A . 14 HYP HD23 1 1
10 2335 1 1 14 HYP HG H 2.614 -9.056 -0.898 1.00 . A A . 14 HYP HG 1 1
10 2336 1 1 14 HYP N N -0.030 -8.541 -1.769 1.00 . A A . 14 HYP N 1 1
10 2337 1 1 14 HYP O O -0.573 -11.957 -0.731 1.00 . A A . 14 HYP O 1 1
10 2338 1 1 14 HYP OD1 O 3.435 -8.493 -2.734 1.00 . A A . 14 HYP OD1 1 1
10 2339 1 1 15 ABA C C -1.035 -11.620 2.236 1.00 . A A . 15 AIB C 1 1
10 2340 1 1 15 ABA CA C 0.458 -11.206 1.850 1.00 . A A . 15 AIB CA 1 1
10 2341 1 1 15 ABA H H 0.967 -9.518 0.519 1.00 . A A . 15 AIB H 1 1
10 2342 1 1 15 ABA N N 0.562 -10.463 0.549 1.00 . A A . 15 AIB N 1 1
10 2343 1 1 15 ABA O O -1.248 -12.809 2.505 1.00 . A A . 15 AIB O 1 1
10 2344 1 1 16 PRO C C -4.125 -11.809 0.962 1.00 . A A . 16 PRO C 1 1
10 2345 1 1 16 PRO CA C -3.523 -11.230 2.286 1.00 . A A . 16 PRO CA 1 1
10 2346 1 1 16 PRO CB C -4.258 -9.970 2.782 1.00 . A A . 16 PRO CB 1 1
10 2347 1 1 16 PRO CD C -2.015 -9.297 2.120 1.00 . A A . 16 PRO CD 1 1
10 2348 1 1 16 PRO CG C -3.461 -8.796 2.215 1.00 . A A . 16 PRO CG 1 1
10 2349 1 1 16 PRO HA H -3.621 -12.005 3.071 1.00 . A A . 16 PRO HA 1 1
10 2350 1 1 16 PRO HB2 H -5.325 -9.932 2.488 1.00 . A A . 16 PRO HB2 1 1
10 2351 1 1 16 PRO HB3 H -4.240 -9.929 3.889 1.00 . A A . 16 PRO HB3 1 1
10 2352 1 1 16 PRO HD2 H -1.560 -8.974 1.169 1.00 . A A . 16 PRO HD2 1 1
10 2353 1 1 16 PRO HD3 H -1.399 -8.878 2.932 1.00 . A A . 16 PRO HD3 1 1
10 2354 1 1 16 PRO HG2 H -3.837 -8.536 1.208 1.00 . A A . 16 PRO HG2 1 1
10 2355 1 1 16 PRO HG3 H -3.554 -7.887 2.837 1.00 . A A . 16 PRO HG3 1 1
10 2356 1 1 16 PRO N N -2.111 -10.765 2.212 1.00 . A A . 16 PRO N 1 1
10 2357 1 1 16 PRO O O -4.839 -12.812 1.042 1.00 . A A . 16 PRO O 1 1
10 2358 1 1 17 PHL C C -3.456 -12.022 -2.489 1.00 . A A . 17 PHL C 1 1
10 2359 1 1 17 PHL CA C -4.547 -11.572 -1.492 1.00 . A A . 17 PHL CA 1 1
10 2360 1 1 17 PHL CB C -5.406 -10.398 -2.049 1.00 . A A . 17 PHL CB 1 1
10 2361 1 1 17 PHL CD1 C -6.553 -8.751 -0.465 1.00 . A A . 17 PHL CD1 1 1
10 2362 1 1 17 PHL CD2 C -7.724 -10.781 -1.050 1.00 . A A . 17 PHL CD2 1 1
10 2363 1 1 17 PHL CE1 C -7.619 -8.373 0.349 1.00 . A A . 17 PHL CE1 1 1
10 2364 1 1 17 PHL CE2 C -8.787 -10.403 -0.233 1.00 . A A . 17 PHL CE2 1 1
10 2365 1 1 17 PHL CG C -6.596 -9.960 -1.171 1.00 . A A . 17 PHL CG 1 1
10 2366 1 1 17 PHL CZ C -8.735 -9.200 0.464 1.00 . A A . 17 PHL CZ 1 1
10 2367 1 1 17 PHL H H -3.260 -10.366 -0.168 1.00 . A A . 17 PHL H 1 1
10 2368 1 1 17 PHL HA H -5.219 -12.441 -1.342 1.00 . A A . 17 PHL HA 1 1
10 2369 1 1 17 PHL HB2 H -4.753 -9.532 -2.274 1.00 . A A . 17 PHL HB2 1 1
10 2370 1 1 17 PHL HB3 H -5.808 -10.687 -3.039 1.00 . A A . 17 PHL HB3 1 1
10 2371 1 1 17 PHL HC1 H -2.808 -12.797 -2.032 1.00 . A A . 17 PHL HC1 1 1
10 2372 1 1 17 PHL HC2 H -2.789 -11.185 -2.762 1.00 . A A . 17 PHL HC2 1 1
10 2373 1 1 17 PHL HD1 H -5.693 -8.101 -0.540 1.00 . A A . 17 PHL HD1 1 1
10 2374 1 1 17 PHL HD2 H -7.776 -11.721 -1.581 1.00 . A A . 17 PHL HD2 1 1
10 2375 1 1 17 PHL HE1 H -7.582 -7.439 0.891 1.00 . A A . 17 PHL HE1 1 1
10 2376 1 1 17 PHL HE2 H -9.651 -11.045 -0.141 1.00 . A A . 17 PHL HE2 1 1
10 2377 1 1 17 PHL HO H -4.498 -11.845 -4.095 1.00 . A A . 17 PHL HO 1 1
10 2378 1 1 17 PHL HZ H -9.560 -8.907 1.096 1.00 . A A . 17 PHL HZ 1 1
10 2379 1 1 17 PHL N N -3.885 -11.184 -0.216 1.00 . A A . 17 PHL N 1 1
10 2380 1 1 17 PHL O O -4.033 -12.569 -3.668 1.00 . A A . 17 PHL O 1 1
11 2381 1 1 1 ACE C C -2.065 10.240 1.104 1.00 . A A . 1 ACE C 1 1
11 2382 1 1 1 ACE CH3 C -1.124 11.417 1.333 1.00 . A A . 1 ACE CH3 1 1
11 2383 1 1 1 ACE H1 H -1.555 12.384 1.009 1.00 . A A . 1 ACE H1 1 1
11 2384 1 1 1 ACE H2 H -0.853 11.501 2.400 1.00 . A A . 1 ACE H2 1 1
11 2385 1 1 1 ACE H3 H -0.185 11.261 0.766 1.00 . A A . 1 ACE H3 1 1
11 2386 1 1 1 ACE O O -1.940 9.211 1.773 1.00 . A A . 1 ACE O 1 1
11 2387 1 1 2 TRP C C -2.649 8.243 -1.324 1.00 . A A . 2 TRP C 1 1
11 2388 1 1 2 TRP CA C -3.614 9.208 -0.547 1.00 . A A . 2 TRP CA 1 1
11 2389 1 1 2 TRP CB C -4.868 9.662 -1.358 1.00 . A A . 2 TRP CB 1 1
11 2390 1 1 2 TRP CD1 C -5.101 9.253 -3.926 1.00 . A A . 2 TRP CD1 1 1
11 2391 1 1 2 TRP CD2 C -4.119 11.185 -3.413 1.00 . A A . 2 TRP CD2 1 1
11 2392 1 1 2 TRP CE2 C -4.173 11.030 -4.823 1.00 . A A . 2 TRP CE2 1 1
11 2393 1 1 2 TRP CE3 C -3.497 12.325 -2.842 1.00 . A A . 2 TRP CE3 1 1
11 2394 1 1 2 TRP CG C -4.700 10.062 -2.839 1.00 . A A . 2 TRP CG 1 1
11 2395 1 1 2 TRP CH2 C -2.981 13.117 -5.088 1.00 . A A . 2 TRP CH2 1 1
11 2396 1 1 2 TRP CZ2 C -3.594 12.006 -5.669 1.00 . A A . 2 TRP CZ2 1 1
11 2397 1 1 2 TRP CZ3 C -2.935 13.275 -3.697 1.00 . A A . 2 TRP CZ3 1 1
11 2398 1 1 2 TRP H H -3.003 11.306 -0.315 1.00 . A A . 2 TRP H 1 1
11 2399 1 1 2 TRP HA H -4.028 8.627 0.293 1.00 . A A . 2 TRP HA 1 1
11 2400 1 1 2 TRP HB2 H -5.594 8.828 -1.320 1.00 . A A . 2 TRP HB2 1 1
11 2401 1 1 2 TRP HB3 H -5.395 10.477 -0.827 1.00 . A A . 2 TRP HB3 1 1
11 2402 1 1 2 TRP HD1 H -5.573 8.287 -3.825 1.00 . A A . 2 TRP HD1 1 1
11 2403 1 1 2 TRP HE1 H -4.965 9.464 -6.101 1.00 . A A . 2 TRP HE1 1 1
11 2404 1 1 2 TRP HE3 H -3.451 12.462 -1.771 1.00 . A A . 2 TRP HE3 1 1
11 2405 1 1 2 TRP HH2 H -2.529 13.864 -5.723 1.00 . A A . 2 TRP HH2 1 1
11 2406 1 1 2 TRP HZ2 H -3.613 11.891 -6.742 1.00 . A A . 2 TRP HZ2 1 1
11 2407 1 1 2 TRP HZ3 H -2.450 14.147 -3.280 1.00 . A A . 2 TRP HZ3 1 1
11 2408 1 1 2 TRP N N -2.941 10.373 0.095 1.00 . A A . 2 TRP N 1 1
11 2409 1 1 2 TRP NE1 N -4.792 9.839 -5.163 1.00 . A A . 2 TRP NE1 1 1
11 2410 1 1 2 TRP O O -2.840 7.027 -1.296 1.00 . A A . 2 TRP O 1 1
11 2411 1 1 3 ILE C C 0.356 7.198 -1.567 1.00 . A A . 3 ILE C 1 1
11 2412 1 1 3 ILE CA C -0.511 7.986 -2.600 1.00 . A A . 3 ILE CA 1 1
11 2413 1 1 3 ILE CB C 0.310 8.846 -3.630 1.00 . A A . 3 ILE CB 1 1
11 2414 1 1 3 ILE CD1 C -1.369 8.583 -5.658 1.00 . A A . 3 ILE CD1 1 1
11 2415 1 1 3 ILE CG1 C -0.542 9.520 -4.753 1.00 . A A . 3 ILE CG1 1 1
11 2416 1 1 3 ILE CG2 C 1.500 8.094 -4.285 1.00 . A A . 3 ILE CG2 1 1
11 2417 1 1 3 ILE H H -1.576 9.813 -1.964 1.00 . A A . 3 ILE H 1 1
11 2418 1 1 3 ILE HA H -1.014 7.200 -3.171 1.00 . A A . 3 ILE HA 1 1
11 2419 1 1 3 ILE HB H 0.767 9.676 -3.056 1.00 . A A . 3 ILE HB 1 1
11 2420 1 1 3 ILE HD11 H -2.122 8.015 -5.081 1.00 . A A . 3 ILE HD11 1 1
11 2421 1 1 3 ILE HD12 H -1.920 9.159 -6.423 1.00 . A A . 3 ILE HD12 1 1
11 2422 1 1 3 ILE HD13 H -0.734 7.852 -6.191 1.00 . A A . 3 ILE HD13 1 1
11 2423 1 1 3 ILE HG12 H -1.234 10.251 -4.296 1.00 . A A . 3 ILE HG12 1 1
11 2424 1 1 3 ILE HG13 H 0.113 10.138 -5.393 1.00 . A A . 3 ILE HG13 1 1
11 2425 1 1 3 ILE HG21 H 1.170 7.183 -4.816 1.00 . A A . 3 ILE HG21 1 1
11 2426 1 1 3 ILE HG22 H 2.038 8.724 -5.017 1.00 . A A . 3 ILE HG22 1 1
11 2427 1 1 3 ILE HG23 H 2.250 7.780 -3.536 1.00 . A A . 3 ILE HG23 1 1
11 2428 1 1 3 ILE N N -1.607 8.788 -1.989 1.00 . A A . 3 ILE N 1 1
11 2429 1 1 3 ILE O O 0.742 6.076 -1.888 1.00 . A A . 3 ILE O 1 1
11 2430 1 1 4 GLN C C 0.385 6.020 1.556 1.00 . A A . 4 GLN C 1 1
11 2431 1 1 4 GLN CA C 1.296 6.973 0.732 1.00 . A A . 4 GLN CA 1 1
11 2432 1 1 4 GLN CB C 2.134 7.879 1.669 1.00 . A A . 4 GLN CB 1 1
11 2433 1 1 4 GLN CD C 4.422 7.584 0.437 1.00 . A A . 4 GLN CD 1 1
11 2434 1 1 4 GLN CG C 3.372 8.550 1.031 1.00 . A A . 4 GLN CG 1 1
11 2435 1 1 4 GLN H H 0.182 8.633 -0.207 1.00 . A A . 4 GLN H 1 1
11 2436 1 1 4 GLN HA H 2.021 6.302 0.248 1.00 . A A . 4 GLN HA 1 1
11 2437 1 1 4 GLN HB2 H 1.491 8.658 2.122 1.00 . A A . 4 GLN HB2 1 1
11 2438 1 1 4 GLN HB3 H 2.489 7.281 2.530 1.00 . A A . 4 GLN HB3 1 1
11 2439 1 1 4 GLN HE21 H 4.373 8.565 -1.314 1.00 . A A . 4 GLN HE21 1 1
11 2440 1 1 4 GLN HE22 H 5.518 7.139 -1.177 1.00 . A A . 4 GLN HE22 1 1
11 2441 1 1 4 GLN HG2 H 3.023 9.275 0.272 1.00 . A A . 4 GLN HG2 1 1
11 2442 1 1 4 GLN HG3 H 3.874 9.151 1.807 1.00 . A A . 4 GLN HG3 1 1
11 2443 1 1 4 GLN N N 0.638 7.736 -0.366 1.00 . A A . 4 GLN N 1 1
11 2444 1 1 4 GLN NE2 N 4.809 7.782 -0.813 1.00 . A A . 4 GLN NE2 1 1
11 2445 1 1 4 GLN O O 0.904 5.004 2.017 1.00 . A A . 4 GLN O 1 1
11 2446 1 1 4 GLN OE1 O 4.885 6.650 1.092 1.00 . A A . 4 GLN OE1 1 1
11 2447 1 1 5 . C C -1.820 3.925 1.207 1.00 . A A . 5 DIV C 1 1
11 2448 1 1 5 . CA C -1.955 5.229 2.109 1.00 . A A . 5 DIV CA 1 1
11 2449 1 1 5 . CB1 C -1.804 4.954 3.654 1.00 . A A . 5 DIV CB1 1 1
11 2450 1 1 5 . CB2 C -3.341 5.898 1.871 1.00 . A A . 5 DIV CB2 1 1
11 2451 1 1 5 . CG1 C -2.924 4.161 4.360 1.00 . A A . 5 DIV CG1 1 1
11 2452 1 1 5 . H H -1.230 7.184 1.350 1.00 . A A . 5 DIV H 1 1
11 2453 1 1 5 . HB11 H -0.854 4.420 3.837 1.00 . A A . 5 DIV HB11 1 1
11 2454 1 1 5 . HB12 H -1.687 5.909 4.203 1.00 . A A . 5 DIV HB12 1 1
11 2455 1 1 5 . HB21 H -3.504 6.190 0.822 1.00 . A A . 5 DIV HB21 1 1
11 2456 1 1 5 . HB22 H -4.179 5.219 2.116 1.00 . A A . 5 DIV HB22 1 1
11 2457 1 1 5 . HB23 H -3.485 6.811 2.483 1.00 . A A . 5 DIV HB23 1 1
11 2458 1 1 5 . HG11 H -3.214 3.258 3.797 1.00 . A A . 5 DIV HG11 1 1
11 2459 1 1 5 . HG12 H -2.621 3.837 5.372 1.00 . A A . 5 DIV HG12 1 1
11 2460 1 1 5 . HG13 H -3.838 4.774 4.481 1.00 . A A . 5 DIV HG13 1 1
11 2461 1 1 5 . N N -0.939 6.269 1.711 1.00 . A A . 5 DIV N 1 1
11 2462 1 1 5 . O O -1.610 2.828 1.732 1.00 . A A . 5 DIV O 1 1
11 2463 1 1 6 ILE C C -0.059 2.441 -1.012 1.00 . A A . 6 ILE C 1 1
11 2464 1 1 6 ILE CA C -1.538 2.941 -1.095 1.00 . A A . 6 ILE CA 1 1
11 2465 1 1 6 ILE CB C -2.102 3.236 -2.543 1.00 . A A . 6 ILE CB 1 1
11 2466 1 1 6 ILE CD1 C -4.461 4.362 -2.114 1.00 . A A . 6 ILE CD1 1 1
11 2467 1 1 6 ILE CG1 C -3.662 3.159 -2.646 1.00 . A A . 6 ILE CG1 1 1
11 2468 1 1 6 ILE CG2 C -1.535 2.286 -3.640 1.00 . A A . 6 ILE CG2 1 1
11 2469 1 1 6 ILE H H -2.115 4.966 -0.510 1.00 . A A . 6 ILE H 1 1
11 2470 1 1 6 ILE HA H -2.123 2.093 -0.713 1.00 . A A . 6 ILE HA 1 1
11 2471 1 1 6 ILE HB H -1.783 4.254 -2.846 1.00 . A A . 6 ILE HB 1 1
11 2472 1 1 6 ILE HD11 H -4.166 5.300 -2.618 1.00 . A A . 6 ILE HD11 1 1
11 2473 1 1 6 ILE HD12 H -5.544 4.232 -2.301 1.00 . A A . 6 ILE HD12 1 1
11 2474 1 1 6 ILE HD13 H -4.342 4.506 -1.024 1.00 . A A . 6 ILE HD13 1 1
11 2475 1 1 6 ILE HG12 H -3.974 3.043 -3.702 1.00 . A A . 6 ILE HG12 1 1
11 2476 1 1 6 ILE HG13 H -4.026 2.241 -2.146 1.00 . A A . 6 ILE HG13 1 1
11 2477 1 1 6 ILE HG21 H -1.769 1.224 -3.438 1.00 . A A . 6 ILE HG21 1 1
11 2478 1 1 6 ILE HG22 H -1.930 2.524 -4.646 1.00 . A A . 6 ILE HG22 1 1
11 2479 1 1 6 ILE HG23 H -0.436 2.366 -3.729 1.00 . A A . 6 ILE HG23 1 1
11 2480 1 1 6 ILE N N -1.824 4.055 -0.149 1.00 . A A . 6 ILE N 1 1
11 2481 1 1 6 ILE O O 0.116 1.253 -0.763 1.00 . A A . 6 ILE O 1 1
11 2482 1 1 7 THR C C 2.955 2.115 -0.009 1.00 . A A . 7 THR C 1 1
11 2483 1 1 7 THR CA C 2.408 2.837 -1.289 1.00 . A A . 7 THR CA 1 1
11 2484 1 1 7 THR CB C 3.319 4.009 -1.776 1.00 . A A . 7 THR CB 1 1
11 2485 1 1 7 THR CG2 C 4.793 3.643 -2.037 1.00 . A A . 7 THR CG2 1 1
11 2486 1 1 7 THR H H 0.706 4.260 -1.362 1.00 . A A . 7 THR H 1 1
11 2487 1 1 7 THR HA H 2.443 2.085 -2.100 1.00 . A A . 7 THR HA 1 1
11 2488 1 1 7 THR HB H 3.304 4.819 -1.024 1.00 . A A . 7 THR HB 1 1
11 2489 1 1 7 THR HG1 H 3.415 5.264 -3.233 1.00 . A A . 7 THR HG1 1 1
11 2490 1 1 7 THR HG21 H 5.352 4.503 -2.451 1.00 . A A . 7 THR HG21 1 1
11 2491 1 1 7 THR HG22 H 5.315 3.340 -1.108 1.00 . A A . 7 THR HG22 1 1
11 2492 1 1 7 THR HG23 H 4.888 2.808 -2.759 1.00 . A A . 7 THR HG23 1 1
11 2493 1 1 7 THR N N 0.976 3.282 -1.212 1.00 . A A . 7 THR N 1 1
11 2494 1 1 7 THR O O 3.651 1.107 -0.152 1.00 . A A . 7 THR O 1 1
11 2495 1 1 7 THR OG1 O 2.831 4.536 -3.007 1.00 . A A . 7 THR OG1 1 1
11 2496 1 1 8 ABA C C 2.110 0.404 2.504 1.00 . A A . 8 AIB C 1 1
11 2497 1 1 8 ABA CA C 2.794 1.832 2.498 1.00 . A A . 8 AIB CA 1 1
11 2498 1 1 8 ABA H H 1.944 3.361 1.147 1.00 . A A . 8 AIB H 1 1
11 2499 1 1 8 ABA N N 2.613 2.589 1.212 1.00 . A A . 8 AIB N 1 1
11 2500 1 1 8 ABA O O 2.708 -0.573 2.968 1.00 . A A . 8 AIB O 1 1
11 2501 1 1 9 LEU C C 0.738 -1.785 0.423 1.00 . A A . 9 LEU C 1 1
11 2502 1 1 9 LEU CA C 0.224 -1.022 1.683 1.00 . A A . 9 LEU CA 1 1
11 2503 1 1 9 LEU CB C -1.325 -0.843 1.603 1.00 . A A . 9 LEU CB 1 1
11 2504 1 1 9 LEU CD1 C -2.103 0.277 3.805 1.00 . A A . 9 LEU CD1 1 1
11 2505 1 1 9 LEU CD2 C -3.558 -1.452 2.699 1.00 . A A . 9 LEU CD2 1 1
11 2506 1 1 9 LEU CG C -2.104 -0.994 2.941 1.00 . A A . 9 LEU CG 1 1
11 2507 1 1 9 LEU H H 0.458 1.117 1.557 1.00 . A A . 9 LEU H 1 1
11 2508 1 1 9 LEU HA H 0.432 -1.687 2.536 1.00 . A A . 9 LEU HA 1 1
11 2509 1 1 9 LEU HB2 H -1.602 0.098 1.087 1.00 . A A . 9 LEU HB2 1 1
11 2510 1 1 9 LEU HB3 H -1.721 -1.621 0.922 1.00 . A A . 9 LEU HB3 1 1
11 2511 1 1 9 LEU HD11 H -2.647 1.102 3.314 1.00 . A A . 9 LEU HD11 1 1
11 2512 1 1 9 LEU HD12 H -2.593 0.102 4.781 1.00 . A A . 9 LEU HD12 1 1
11 2513 1 1 9 LEU HD13 H -1.081 0.633 4.022 1.00 . A A . 9 LEU HD13 1 1
11 2514 1 1 9 LEU HD21 H -3.596 -2.414 2.151 1.00 . A A . 9 LEU HD21 1 1
11 2515 1 1 9 LEU HD22 H -4.103 -1.613 3.649 1.00 . A A . 9 LEU HD22 1 1
11 2516 1 1 9 LEU HD23 H -4.138 -0.717 2.108 1.00 . A A . 9 LEU HD23 1 1
11 2517 1 1 9 LEU HG H -1.608 -1.788 3.526 1.00 . A A . 9 LEU HG 1 1
11 2518 1 1 9 LEU N N 0.866 0.278 1.975 1.00 . A A . 9 LEU N 1 1
11 2519 1 1 9 LEU O O 0.373 -2.954 0.321 1.00 . A A . 9 LEU O 1 1
11 2520 1 1 10 ABA C C 2.646 -3.381 -1.495 1.00 . A A . 10 AIB C 1 1
11 2521 1 1 10 ABA CA C 2.016 -1.936 -1.760 1.00 . A A . 10 AIB CA 1 1
11 2522 1 1 10 ABA H H 1.768 -0.228 -0.344 1.00 . A A . 10 AIB H 1 1
11 2523 1 1 10 ABA N N 1.531 -1.217 -0.527 1.00 . A A . 10 AIB N 1 1
11 2524 1 1 10 ABA O O 2.125 -4.356 -2.057 1.00 . A A . 10 AIB O 1 1
11 2525 1 1 11 HYP C C 3.098 -5.851 0.604 1.00 . A A . 11 HYP C 1 1
11 2526 1 1 11 HYP CA C 4.112 -4.996 -0.236 1.00 . A A . 11 HYP CA 1 1
11 2527 1 1 11 HYP CB C 5.421 -4.715 0.525 1.00 . A A . 11 HYP CB 1 1
11 2528 1 1 11 HYP CD C 4.227 -2.610 0.310 1.00 . A A . 11 HYP CD 1 1
11 2529 1 1 11 HYP CG C 5.206 -3.366 1.216 1.00 . A A . 11 HYP CG 1 1
11 2530 1 1 11 HYP HA H 4.358 -5.572 -1.150 1.00 . A A . 11 HYP HA 1 1
11 2531 1 1 11 HYP HB2 H 5.698 -5.514 1.240 1.00 . A A . 11 HYP HB2 1 1
11 2532 1 1 11 HYP HB3 H 6.261 -4.645 -0.193 1.00 . A A . 11 HYP HB3 1 1
11 2533 1 1 11 HYP HD1 H 6.982 -3.221 1.932 1.00 . A A . 11 HYP HD1 1 1
11 2534 1 1 11 HYP HD22 H 3.414 -2.186 0.918 1.00 . A A . 11 HYP HD22 1 1
11 2535 1 1 11 HYP HD23 H 4.685 -1.765 -0.223 1.00 . A A . 11 HYP HD23 1 1
11 2536 1 1 11 HYP HG H 4.743 -3.529 2.208 1.00 . A A . 11 HYP HG 1 1
11 2537 1 1 11 HYP N N 3.685 -3.617 -0.624 1.00 . A A . 11 HYP N 1 1
11 2538 1 1 11 HYP O O 3.204 -7.080 0.607 1.00 . A A . 11 HYP O 1 1
11 2539 1 1 11 HYP OD1 O 6.432 -2.663 1.376 1.00 . A A . 11 HYP OD1 1 1
11 2540 1 1 12 GLN C C -0.319 -5.972 1.106 1.00 . A A . 12 GLN C 1 1
11 2541 1 1 12 GLN CA C 0.992 -5.827 1.962 1.00 . A A . 12 GLN CA 1 1
11 2542 1 1 12 GLN CB C 0.719 -5.043 3.282 1.00 . A A . 12 GLN CB 1 1
11 2543 1 1 12 GLN CD C 1.533 -4.292 5.643 1.00 . A A . 12 GLN CD 1 1
11 2544 1 1 12 GLN CG C 1.853 -5.051 4.341 1.00 . A A . 12 GLN CG 1 1
11 2545 1 1 12 GLN H H 2.123 -4.196 1.198 1.00 . A A . 12 GLN H 1 1
11 2546 1 1 12 GLN HA H 1.319 -6.825 2.244 1.00 . A A . 12 GLN HA 1 1
11 2547 1 1 12 GLN HB2 H 0.448 -3.996 3.045 1.00 . A A . 12 GLN HB2 1 1
11 2548 1 1 12 GLN HB3 H -0.178 -5.464 3.774 1.00 . A A . 12 GLN HB3 1 1
11 2549 1 1 12 GLN HE21 H 3.010 -5.274 6.576 1.00 . A A . 12 GLN HE21 1 1
11 2550 1 1 12 GLN HE22 H 2.060 -4.056 7.564 1.00 . A A . 12 GLN HE22 1 1
11 2551 1 1 12 GLN HG2 H 2.114 -6.103 4.574 1.00 . A A . 12 GLN HG2 1 1
11 2552 1 1 12 GLN HG3 H 2.771 -4.609 3.908 1.00 . A A . 12 GLN HG3 1 1
11 2553 1 1 12 GLN N N 2.132 -5.201 1.282 1.00 . A A . 12 GLN N 1 1
11 2554 1 1 12 GLN NE2 N 2.276 -4.572 6.703 1.00 . A A . 12 GLN NE2 1 1
11 2555 1 1 12 GLN O O -1.327 -6.347 1.699 1.00 . A A . 12 GLN O 1 1
11 2556 1 1 12 GLN OE1 O 0.644 -3.445 5.719 1.00 . A A . 12 GLN OE1 1 1
11 2557 1 1 13 ABA C C -1.343 -7.794 -1.393 1.00 . A A . 13 AIB C 1 1
11 2558 1 1 13 ABA CA C -1.428 -6.211 -1.172 1.00 . A A . 13 AIB CA 1 1
11 2559 1 1 13 ABA H H 0.536 -5.374 -0.631 1.00 . A A . 13 AIB H 1 1
11 2560 1 1 13 ABA N N -0.355 -5.722 -0.235 1.00 . A A . 13 AIB N 1 1
11 2561 1 1 13 ABA O O -2.375 -8.449 -1.212 1.00 . A A . 13 AIB O 1 1
11 2562 1 1 14 HYP C C -0.340 -10.883 -0.804 1.00 . A A . 14 HYP C 1 1
11 2563 1 1 14 HYP CA C -0.148 -9.940 -2.029 1.00 . A A . 14 HYP CA 1 1
11 2564 1 1 14 HYP CB C 1.221 -10.130 -2.715 1.00 . A A . 14 HYP CB 1 1
11 2565 1 1 14 HYP CD C 1.117 -7.840 -2.016 1.00 . A A . 14 HYP CD 1 1
11 2566 1 1 14 HYP CG C 2.089 -9.007 -2.151 1.00 . A A . 14 HYP CG 1 1
11 2567 1 1 14 HYP HA H -0.927 -10.190 -2.773 1.00 . A A . 14 HYP HA 1 1
11 2568 1 1 14 HYP HB2 H 1.673 -11.126 -2.547 1.00 . A A . 14 HYP HB2 1 1
11 2569 1 1 14 HYP HB3 H 1.113 -10.022 -3.812 1.00 . A A . 14 HYP HB3 1 1
11 2570 1 1 14 HYP HD1 H 2.771 -8.322 -3.809 1.00 . A A . 14 HYP HD1 1 1
11 2571 1 1 14 HYP HD22 H 1.449 -7.192 -1.195 1.00 . A A . 14 HYP HD22 1 1
11 2572 1 1 14 HYP HD23 H 1.097 -7.225 -2.930 1.00 . A A . 14 HYP HD23 1 1
11 2573 1 1 14 HYP HG H 2.465 -9.286 -1.142 1.00 . A A . 14 HYP HG 1 1
11 2574 1 1 14 HYP N N -0.197 -8.472 -1.762 1.00 . A A . 14 HYP N 1 1
11 2575 1 1 14 HYP O O -1.126 -11.829 -0.911 1.00 . A A . 14 HYP O 1 1
11 2576 1 1 14 HYP OD1 O 3.169 -8.686 -3.016 1.00 . A A . 14 HYP OD1 1 1
11 2577 1 1 15 ABA C C -1.243 -11.677 2.084 1.00 . A A . 15 AIB C 1 1
11 2578 1 1 15 ABA CA C 0.257 -11.433 1.597 1.00 . A A . 15 AIB CA 1 1
11 2579 1 1 15 ABA H H 0.957 -9.804 0.282 1.00 . A A . 15 AIB H 1 1
11 2580 1 1 15 ABA N N 0.369 -10.643 0.330 1.00 . A A . 15 AIB N 1 1
11 2581 1 1 15 ABA O O -1.591 -12.845 2.304 1.00 . A A . 15 AIB O 1 1
11 2582 1 1 16 PRO C C -4.433 -11.458 1.148 1.00 . A A . 16 PRO C 1 1
11 2583 1 1 16 PRO CA C -3.639 -10.973 2.405 1.00 . A A . 16 PRO CA 1 1
11 2584 1 1 16 PRO CB C -4.164 -9.644 2.982 1.00 . A A . 16 PRO CB 1 1
11 2585 1 1 16 PRO CD C -1.914 -9.243 2.173 1.00 . A A . 16 PRO CD 1 1
11 2586 1 1 16 PRO CG C -3.276 -8.568 2.366 1.00 . A A . 16 PRO CG 1 1
11 2587 1 1 16 PRO HA H -3.752 -11.747 3.191 1.00 . A A . 16 PRO HA 1 1
11 2588 1 1 16 PRO HB2 H -5.236 -9.465 2.780 1.00 . A A . 16 PRO HB2 1 1
11 2589 1 1 16 PRO HB3 H -4.047 -9.636 4.082 1.00 . A A . 16 PRO HB3 1 1
11 2590 1 1 16 PRO HD2 H -1.458 -8.926 1.222 1.00 . A A . 16 PRO HD2 1 1
11 2591 1 1 16 PRO HD3 H -1.220 -8.952 2.978 1.00 . A A . 16 PRO HD3 1 1
11 2592 1 1 16 PRO HG2 H -3.688 -8.254 1.387 1.00 . A A . 16 PRO HG2 1 1
11 2593 1 1 16 PRO HG3 H -3.220 -7.665 2.999 1.00 . A A . 16 PRO HG3 1 1
11 2594 1 1 16 PRO N N -2.193 -10.691 2.199 1.00 . A A . 16 PRO N 1 1
11 2595 1 1 16 PRO O O -5.254 -12.366 1.311 1.00 . A A . 16 PRO O 1 1
11 2596 1 1 17 PHL C C -4.234 -11.456 -2.479 1.00 . A A . 17 PHL C 1 1
11 2597 1 1 17 PHL CA C -5.106 -11.167 -1.237 1.00 . A A . 17 PHL CA 1 1
11 2598 1 1 17 PHL CB C -6.146 -10.035 -1.489 1.00 . A A . 17 PHL CB 1 1
11 2599 1 1 17 PHL CD1 C -7.181 -8.842 0.519 1.00 . A A . 17 PHL CD1 1 1
11 2600 1 1 17 PHL CD2 C -8.257 -10.841 -0.307 1.00 . A A . 17 PHL CD2 1 1
11 2601 1 1 17 PHL CE1 C -8.133 -8.751 1.532 1.00 . A A . 17 PHL CE1 1 1
11 2602 1 1 17 PHL CE2 C -9.208 -10.748 0.708 1.00 . A A . 17 PHL CE2 1 1
11 2603 1 1 17 PHL CG C -7.234 -9.893 -0.405 1.00 . A A . 17 PHL CG 1 1
11 2604 1 1 17 PHL CZ C -9.145 -9.701 1.625 1.00 . A A . 17 PHL CZ 1 1
11 2605 1 1 17 PHL H H -3.565 -10.090 -0.090 1.00 . A A . 17 PHL H 1 1
11 2606 1 1 17 PHL HA H -5.674 -12.103 -1.071 1.00 . A A . 17 PHL HA 1 1
11 2607 1 1 17 PHL HB2 H -5.619 -9.072 -1.641 1.00 . A A . 17 PHL HB2 1 1
11 2608 1 1 17 PHL HB3 H -6.650 -10.214 -2.457 1.00 . A A . 17 PHL HB3 1 1
11 2609 1 1 17 PHL HC1 H -4.867 -11.857 -3.292 1.00 . A A . 17 PHL HC1 1 1
11 2610 1 1 17 PHL HC2 H -3.499 -12.256 -2.264 1.00 . A A . 17 PHL HC2 1 1
11 2611 1 1 17 PHL HD1 H -6.393 -8.105 0.469 1.00 . A A . 17 PHL HD1 1 1
11 2612 1 1 17 PHL HD2 H -8.311 -11.667 -1.003 1.00 . A A . 17 PHL HD2 1 1
11 2613 1 1 17 PHL HE1 H -8.082 -7.945 2.250 1.00 . A A . 17 PHL HE1 1 1
11 2614 1 1 17 PHL HE2 H -9.987 -11.492 0.788 1.00 . A A . 17 PHL HE2 1 1
11 2615 1 1 17 PHL HO H -3.012 -9.992 -2.230 1.00 . A A . 17 PHL HO 1 1
11 2616 1 1 17 PHL HZ H -9.882 -9.631 2.412 1.00 . A A . 17 PHL HZ 1 1
11 2617 1 1 17 PHL N N -4.249 -10.860 -0.058 1.00 . A A . 17 PHL N 1 1
11 2618 1 1 17 PHL O O -3.552 -10.304 -2.960 1.00 . A A . 17 PHL O 1 1
12 2619 1 1 1 ACE C C -2.127 10.891 0.654 1.00 . A A . 1 ACE C 1 1
12 2620 1 1 1 ACE CH3 C -1.617 12.319 0.512 1.00 . A A . 1 ACE CH3 1 1
12 2621 1 1 1 ACE H1 H -1.257 12.503 -0.519 1.00 . A A . 1 ACE H1 1 1
12 2622 1 1 1 ACE H2 H -2.405 13.058 0.739 1.00 . A A . 1 ACE H2 1 1
12 2623 1 1 1 ACE H3 H -0.763 12.502 1.189 1.00 . A A . 1 ACE H3 1 1
12 2624 1 1 1 ACE O O -1.562 10.092 1.405 1.00 . A A . 1 ACE O 1 1
12 2625 1 1 2 TRP C C -2.552 8.303 -1.234 1.00 . A A . 2 TRP C 1 1
12 2626 1 1 2 TRP CA C -3.567 9.168 -0.404 1.00 . A A . 2 TRP CA 1 1
12 2627 1 1 2 TRP CB C -4.996 9.149 -1.018 1.00 . A A . 2 TRP CB 1 1
12 2628 1 1 2 TRP CD1 C -5.836 6.696 -1.478 1.00 . A A . 2 TRP CD1 1 1
12 2629 1 1 2 TRP CD2 C -6.546 7.602 0.426 1.00 . A A . 2 TRP CD2 1 1
12 2630 1 1 2 TRP CE2 C -7.045 6.280 0.315 1.00 . A A . 2 TRP CE2 1 1
12 2631 1 1 2 TRP CE3 C -6.868 8.398 1.557 1.00 . A A . 2 TRP CE3 1 1
12 2632 1 1 2 TRP CG C -5.783 7.870 -0.697 1.00 . A A . 2 TRP CG 1 1
12 2633 1 1 2 TRP CH2 C -8.193 6.548 2.428 1.00 . A A . 2 TRP CH2 1 1
12 2634 1 1 2 TRP CZ2 C -7.880 5.747 1.327 1.00 . A A . 2 TRP CZ2 1 1
12 2635 1 1 2 TRP CZ3 C -7.695 7.852 2.541 1.00 . A A . 2 TRP CZ3 1 1
12 2636 1 1 2 TRP H H -3.565 11.346 -0.676 1.00 . A A . 2 TRP H 1 1
12 2637 1 1 2 TRP HA H -3.640 8.707 0.596 1.00 . A A . 2 TRP HA 1 1
12 2638 1 1 2 TRP HB2 H -5.596 10.001 -0.647 1.00 . A A . 2 TRP HB2 1 1
12 2639 1 1 2 TRP HB3 H -4.951 9.306 -2.113 1.00 . A A . 2 TRP HB3 1 1
12 2640 1 1 2 TRP HD1 H -5.328 6.570 -2.424 1.00 . A A . 2 TRP HD1 1 1
12 2641 1 1 2 TRP HE1 H -6.795 4.743 -1.202 1.00 . A A . 2 TRP HE1 1 1
12 2642 1 1 2 TRP HE3 H -6.493 9.406 1.656 1.00 . A A . 2 TRP HE3 1 1
12 2643 1 1 2 TRP HH2 H -8.838 6.157 3.202 1.00 . A A . 2 TRP HH2 1 1
12 2644 1 1 2 TRP HZ2 H -8.272 4.744 1.250 1.00 . A A . 2 TRP HZ2 1 1
12 2645 1 1 2 TRP HZ3 H -7.960 8.449 3.402 1.00 . A A . 2 TRP HZ3 1 1
12 2646 1 1 2 TRP N N -3.158 10.574 -0.146 1.00 . A A . 2 TRP N 1 1
12 2647 1 1 2 TRP NE1 N -6.610 5.693 -0.863 1.00 . A A . 2 TRP NE1 1 1
12 2648 1 1 2 TRP O O -2.626 7.072 -1.172 1.00 . A A . 2 TRP O 1 1
12 2649 1 1 3 ILE C C 0.547 7.532 -1.459 1.00 . A A . 3 ILE C 1 1
12 2650 1 1 3 ILE CA C -0.402 8.197 -2.516 1.00 . A A . 3 ILE CA 1 1
12 2651 1 1 3 ILE CB C 0.343 8.999 -3.644 1.00 . A A . 3 ILE CB 1 1
12 2652 1 1 3 ILE CD1 C 2.495 10.134 -2.696 1.00 . A A . 3 ILE CD1 1 1
12 2653 1 1 3 ILE CG1 C 1.058 10.315 -3.207 1.00 . A A . 3 ILE CG1 1 1
12 2654 1 1 3 ILE CG2 C -0.575 9.273 -4.862 1.00 . A A . 3 ILE CG2 1 1
12 2655 1 1 3 ILE H H -1.635 9.940 -1.949 1.00 . A A . 3 ILE H 1 1
12 2656 1 1 3 ILE HA H -0.843 7.333 -3.034 1.00 . A A . 3 ILE HA 1 1
12 2657 1 1 3 ILE HB H 1.120 8.321 -4.049 1.00 . A A . 3 ILE HB 1 1
12 2658 1 1 3 ILE HD11 H 3.131 9.609 -3.433 1.00 . A A . 3 ILE HD11 1 1
12 2659 1 1 3 ILE HD12 H 2.970 11.112 -2.499 1.00 . A A . 3 ILE HD12 1 1
12 2660 1 1 3 ILE HD13 H 2.538 9.558 -1.755 1.00 . A A . 3 ILE HD13 1 1
12 2661 1 1 3 ILE HG12 H 1.124 11.018 -4.058 1.00 . A A . 3 ILE HG12 1 1
12 2662 1 1 3 ILE HG13 H 0.455 10.851 -2.451 1.00 . A A . 3 ILE HG13 1 1
12 2663 1 1 3 ILE HG21 H -1.377 9.996 -4.624 1.00 . A A . 3 ILE HG21 1 1
12 2664 1 1 3 ILE HG22 H -0.007 9.686 -5.717 1.00 . A A . 3 ILE HG22 1 1
12 2665 1 1 3 ILE HG23 H -1.063 8.351 -5.227 1.00 . A A . 3 ILE HG23 1 1
12 2666 1 1 3 ILE N N -1.587 8.916 -1.960 1.00 . A A . 3 ILE N 1 1
12 2667 1 1 3 ILE O O 1.120 6.484 -1.761 1.00 . A A . 3 ILE O 1 1
12 2668 1 1 4 GLN C C 0.507 6.215 1.514 1.00 . A A . 4 GLN C 1 1
12 2669 1 1 4 GLN CA C 1.323 7.395 0.914 1.00 . A A . 4 GLN CA 1 1
12 2670 1 1 4 GLN CB C 1.731 8.377 2.042 1.00 . A A . 4 GLN CB 1 1
12 2671 1 1 4 GLN CD C 2.514 10.801 1.557 1.00 . A A . 4 GLN CD 1 1
12 2672 1 1 4 GLN CG C 2.911 9.319 1.707 1.00 . A A . 4 GLN CG 1 1
12 2673 1 1 4 GLN H H 0.108 8.927 -0.098 1.00 . A A . 4 GLN H 1 1
12 2674 1 1 4 GLN HA H 2.260 6.954 0.533 1.00 . A A . 4 GLN HA 1 1
12 2675 1 1 4 GLN HB2 H 0.848 8.936 2.409 1.00 . A A . 4 GLN HB2 1 1
12 2676 1 1 4 GLN HB3 H 2.047 7.786 2.924 1.00 . A A . 4 GLN HB3 1 1
12 2677 1 1 4 GLN HE21 H 3.245 10.852 -0.308 1.00 . A A . 4 GLN HE21 1 1
12 2678 1 1 4 GLN HE22 H 2.519 12.401 0.350 1.00 . A A . 4 GLN HE22 1 1
12 2679 1 1 4 GLN HG2 H 3.655 9.240 2.522 1.00 . A A . 4 GLN HG2 1 1
12 2680 1 1 4 GLN HG3 H 3.455 8.940 0.816 1.00 . A A . 4 GLN HG3 1 1
12 2681 1 1 4 GLN N N 0.675 8.087 -0.234 1.00 . A A . 4 GLN N 1 1
12 2682 1 1 4 GLN NE2 N 2.797 11.416 0.421 1.00 . A A . 4 GLN NE2 1 1
12 2683 1 1 4 GLN O O 1.100 5.163 1.765 1.00 . A A . 4 GLN O 1 1
12 2684 1 1 4 GLN OE1 O 1.965 11.415 2.471 1.00 . A A . 4 GLN OE1 1 1
12 2685 1 1 5 . C C -1.615 3.980 1.276 1.00 . A A . 5 DIV C 1 1
12 2686 1 1 5 . CA C -1.757 5.279 2.180 1.00 . A A . 5 DIV CA 1 1
12 2687 1 1 5 . CB1 C -1.499 5.023 3.714 1.00 . A A . 5 DIV CB1 1 1
12 2688 1 1 5 . CB2 C -3.188 5.872 2.022 1.00 . A A . 5 DIV CB2 1 1
12 2689 1 1 5 . CG1 C -2.470 4.106 4.491 1.00 . A A . 5 DIV CG1 1 1
12 2690 1 1 5 . H H -1.167 7.301 1.472 1.00 . A A . 5 DIV H 1 1
12 2691 1 1 5 . HB11 H -0.481 4.609 3.845 1.00 . A A . 5 DIV HB11 1 1
12 2692 1 1 5 . HB12 H -1.470 5.987 4.258 1.00 . A A . 5 DIV HB12 1 1
12 2693 1 1 5 . HB21 H -3.424 6.156 0.981 1.00 . A A . 5 DIV HB21 1 1
12 2694 1 1 5 . HB22 H -3.973 5.147 2.315 1.00 . A A . 5 DIV HB22 1 1
12 2695 1 1 5 . HB23 H -3.347 6.776 2.641 1.00 . A A . 5 DIV HB23 1 1
12 2696 1 1 5 . HG11 H -2.633 3.136 3.988 1.00 . A A . 5 DIV HG11 1 1
12 2697 1 1 5 . HG12 H -2.077 3.886 5.500 1.00 . A A . 5 DIV HG12 1 1
12 2698 1 1 5 . HG13 H -3.458 4.581 4.629 1.00 . A A . 5 DIV HG13 1 1
12 2699 1 1 5 . N N -0.822 6.375 1.742 1.00 . A A . 5 DIV N 1 1
12 2700 1 1 5 . O O -1.367 2.885 1.794 1.00 . A A . 5 DIV O 1 1
12 2701 1 1 6 ILE C C -0.019 2.453 -1.118 1.00 . A A . 6 ILE C 1 1
12 2702 1 1 6 ILE CA C -1.487 2.982 -1.025 1.00 . A A . 6 ILE CA 1 1
12 2703 1 1 6 ILE CB C -2.205 3.219 -2.399 1.00 . A A . 6 ILE CB 1 1
12 2704 1 1 6 ILE CD1 C -3.414 1.959 -4.352 1.00 . A A . 6 ILE CD1 1 1
12 2705 1 1 6 ILE CG1 C -2.414 1.889 -3.187 1.00 . A A . 6 ILE CG1 1 1
12 2706 1 1 6 ILE CG2 C -1.533 4.302 -3.278 1.00 . A A . 6 ILE CG2 1 1
12 2707 1 1 6 ILE H H -1.962 5.028 -0.427 1.00 . A A . 6 ILE H 1 1
12 2708 1 1 6 ILE HA H -2.058 2.167 -0.559 1.00 . A A . 6 ILE HA 1 1
12 2709 1 1 6 ILE HB H -3.219 3.593 -2.159 1.00 . A A . 6 ILE HB 1 1
12 2710 1 1 6 ILE HD11 H -3.096 2.676 -5.130 1.00 . A A . 6 ILE HD11 1 1
12 2711 1 1 6 ILE HD12 H -3.518 0.975 -4.845 1.00 . A A . 6 ILE HD12 1 1
12 2712 1 1 6 ILE HD13 H -4.419 2.261 -4.006 1.00 . A A . 6 ILE HD13 1 1
12 2713 1 1 6 ILE HG12 H -1.444 1.513 -3.563 1.00 . A A . 6 ILE HG12 1 1
12 2714 1 1 6 ILE HG13 H -2.772 1.102 -2.495 1.00 . A A . 6 ILE HG13 1 1
12 2715 1 1 6 ILE HG21 H -0.558 3.968 -3.678 1.00 . A A . 6 ILE HG21 1 1
12 2716 1 1 6 ILE HG22 H -2.163 4.584 -4.140 1.00 . A A . 6 ILE HG22 1 1
12 2717 1 1 6 ILE HG23 H -1.348 5.223 -2.703 1.00 . A A . 6 ILE HG23 1 1
12 2718 1 1 6 ILE N N -1.697 4.107 -0.076 1.00 . A A . 6 ILE N 1 1
12 2719 1 1 6 ILE O O 0.142 1.236 -1.079 1.00 . A A . 6 ILE O 1 1
12 2720 1 1 7 THR C C 2.952 2.025 -0.068 1.00 . A A . 7 THR C 1 1
12 2721 1 1 7 THR CA C 2.456 2.844 -1.312 1.00 . A A . 7 THR CA 1 1
12 2722 1 1 7 THR CB C 3.384 4.049 -1.669 1.00 . A A . 7 THR CB 1 1
12 2723 1 1 7 THR CG2 C 4.876 3.706 -1.848 1.00 . A A . 7 THR CG2 1 1
12 2724 1 1 7 THR H H 0.771 4.298 -1.266 1.00 . A A . 7 THR H 1 1
12 2725 1 1 7 THR HA H 2.509 2.153 -2.176 1.00 . A A . 7 THR HA 1 1
12 2726 1 1 7 THR HB H 3.302 4.817 -0.876 1.00 . A A . 7 THR HB 1 1
12 2727 1 1 7 THR HG1 H 3.496 5.426 -3.009 1.00 . A A . 7 THR HG1 1 1
12 2728 1 1 7 THR HG21 H 5.462 4.596 -2.145 1.00 . A A . 7 THR HG21 1 1
12 2729 1 1 7 THR HG22 H 5.327 3.327 -0.912 1.00 . A A . 7 THR HG22 1 1
12 2730 1 1 7 THR HG23 H 5.028 2.935 -2.624 1.00 . A A . 7 THR HG23 1 1
12 2731 1 1 7 THR N N 1.027 3.304 -1.228 1.00 . A A . 7 THR N 1 1
12 2732 1 1 7 THR O O 3.576 0.977 -0.246 1.00 . A A . 7 THR O 1 1
12 2733 1 1 7 THR OG1 O 2.963 4.636 -2.898 1.00 . A A . 7 THR OG1 1 1
12 2734 1 1 8 ABA C C 1.952 0.307 2.412 1.00 . A A . 8 AIB C 1 1
12 2735 1 1 8 ABA CA C 2.741 1.678 2.431 1.00 . A A . 8 AIB CA 1 1
12 2736 1 1 8 ABA H H 1.993 3.270 1.100 1.00 . A A . 8 AIB H 1 1
12 2737 1 1 8 ABA N N 2.640 2.482 1.164 1.00 . A A . 8 AIB N 1 1
12 2738 1 1 8 ABA O O 2.431 -0.700 2.945 1.00 . A A . 8 AIB O 1 1
12 2739 1 1 9 LEU C C 0.513 -1.818 0.301 1.00 . A A . 9 LEU C 1 1
12 2740 1 1 9 LEU CA C 0.008 -0.984 1.515 1.00 . A A . 9 LEU CA 1 1
12 2741 1 1 9 LEU CB C -1.499 -0.644 1.329 1.00 . A A . 9 LEU CB 1 1
12 2742 1 1 9 LEU CD1 C -3.725 0.137 2.243 1.00 . A A . 9 LEU CD1 1 1
12 2743 1 1 9 LEU CD2 C -2.542 -1.775 3.398 1.00 . A A . 9 LEU CD2 1 1
12 2744 1 1 9 LEU CG C -2.352 -0.456 2.614 1.00 . A A . 9 LEU CG 1 1
12 2745 1 1 9 LEU H H 0.495 1.089 1.240 1.00 . A A . 9 LEU H 1 1
12 2746 1 1 9 LEU HA H 0.109 -1.633 2.396 1.00 . A A . 9 LEU HA 1 1
12 2747 1 1 9 LEU HB2 H -1.594 0.250 0.683 1.00 . A A . 9 LEU HB2 1 1
12 2748 1 1 9 LEU HB3 H -1.987 -1.433 0.729 1.00 . A A . 9 LEU HB3 1 1
12 2749 1 1 9 LEU HD11 H -4.304 -0.533 1.578 1.00 . A A . 9 LEU HD11 1 1
12 2750 1 1 9 LEU HD12 H -4.345 0.328 3.139 1.00 . A A . 9 LEU HD12 1 1
12 2751 1 1 9 LEU HD13 H -3.619 1.106 1.718 1.00 . A A . 9 LEU HD13 1 1
12 2752 1 1 9 LEU HD21 H -1.585 -2.163 3.793 1.00 . A A . 9 LEU HD21 1 1
12 2753 1 1 9 LEU HD22 H -3.208 -1.642 4.272 1.00 . A A . 9 LEU HD22 1 1
12 2754 1 1 9 LEU HD23 H -2.982 -2.575 2.771 1.00 . A A . 9 LEU HD23 1 1
12 2755 1 1 9 LEU HG H -1.847 0.272 3.277 1.00 . A A . 9 LEU HG 1 1
12 2756 1 1 9 LEU N N 0.746 0.268 1.796 1.00 . A A . 9 LEU N 1 1
12 2757 1 1 9 LEU O O 0.105 -2.978 0.225 1.00 . A A . 9 LEU O 1 1
12 2758 1 1 10 ABA C C 2.486 -3.467 -1.533 1.00 . A A . 10 AIB C 1 1
12 2759 1 1 10 ABA CA C 1.830 -2.045 -1.850 1.00 . A A . 10 AIB CA 1 1
12 2760 1 1 10 ABA H H 1.683 -0.340 -0.415 1.00 . A A . 10 AIB H 1 1
12 2761 1 1 10 ABA N N 1.348 -1.296 -0.639 1.00 . A A . 10 AIB N 1 1
12 2762 1 1 10 ABA O O 2.011 -4.459 -2.101 1.00 . A A . 10 AIB O 1 1
12 2763 1 1 11 HYP C C 2.929 -5.876 0.662 1.00 . A A . 11 HYP C 1 1
12 2764 1 1 11 HYP CA C 3.940 -5.030 -0.189 1.00 . A A . 11 HYP CA 1 1
12 2765 1 1 11 HYP CB C 5.219 -4.711 0.607 1.00 . A A . 11 HYP CB 1 1
12 2766 1 1 11 HYP CD C 4.056 -2.619 0.251 1.00 . A A . 11 HYP CD 1 1
12 2767 1 1 11 HYP CG C 4.951 -3.352 1.257 1.00 . A A . 11 HYP CG 1 1
12 2768 1 1 11 HYP HA H 4.214 -5.629 -1.079 1.00 . A A . 11 HYP HA 1 1
12 2769 1 1 11 HYP HB2 H 5.473 -5.488 1.353 1.00 . A A . 11 HYP HB2 1 1
12 2770 1 1 11 HYP HB3 H 6.085 -4.644 -0.081 1.00 . A A . 11 HYP HB3 1 1
12 2771 1 1 11 HYP HD1 H 6.597 -3.136 2.219 1.00 . A A . 11 HYP HD1 1 1
12 2772 1 1 11 HYP HD22 H 3.260 -2.086 0.794 1.00 . A A . 11 HYP HD22 1 1
12 2773 1 1 11 HYP HD23 H 4.593 -1.868 -0.340 1.00 . A A . 11 HYP HD23 1 1
12 2774 1 1 11 HYP HG H 4.398 -3.502 2.206 1.00 . A A . 11 HYP HG 1 1
12 2775 1 1 11 HYP N N 3.501 -3.669 -0.627 1.00 . A A . 11 HYP N 1 1
12 2776 1 1 11 HYP O O 3.100 -7.094 0.761 1.00 . A A . 11 HYP O 1 1
12 2777 1 1 11 HYP OD1 O 6.158 -2.646 1.518 1.00 . A A . 11 HYP OD1 1 1
12 2778 1 1 12 GLN C C -0.532 -6.024 0.996 1.00 . A A . 12 GLN C 1 1
12 2779 1 1 12 GLN CA C 0.750 -5.883 1.891 1.00 . A A . 12 GLN CA 1 1
12 2780 1 1 12 GLN CB C 0.457 -5.137 3.225 1.00 . A A . 12 GLN CB 1 1
12 2781 1 1 12 GLN CD C 1.216 -4.470 5.586 1.00 . A A . 12 GLN CD 1 1
12 2782 1 1 12 GLN CG C 1.553 -5.261 4.313 1.00 . A A . 12 GLN CG 1 1
12 2783 1 1 12 GLN H H 1.850 -4.238 1.101 1.00 . A A . 12 GLN H 1 1
12 2784 1 1 12 GLN HA H 1.071 -6.888 2.150 1.00 . A A . 12 GLN HA 1 1
12 2785 1 1 12 GLN HB2 H 0.258 -4.067 3.016 1.00 . A A . 12 GLN HB2 1 1
12 2786 1 1 12 GLN HB3 H -0.483 -5.520 3.666 1.00 . A A . 12 GLN HB3 1 1
12 2787 1 1 12 GLN HE21 H 2.250 -2.886 4.913 1.00 . A A . 12 GLN HE21 1 1
12 2788 1 1 12 GLN HE22 H 1.442 -2.728 6.553 1.00 . A A . 12 GLN HE22 1 1
12 2789 1 1 12 GLN HG2 H 1.689 -6.326 4.581 1.00 . A A . 12 GLN HG2 1 1
12 2790 1 1 12 GLN HG3 H 2.533 -4.937 3.912 1.00 . A A . 12 GLN HG3 1 1
12 2791 1 1 12 GLN N N 1.899 -5.236 1.246 1.00 . A A . 12 GLN N 1 1
12 2792 1 1 12 GLN NE2 N 1.675 -3.232 5.689 1.00 . A A . 12 GLN NE2 1 1
12 2793 1 1 12 GLN O O -1.563 -6.386 1.561 1.00 . A A . 12 GLN O 1 1
12 2794 1 1 12 GLN OE1 O 0.534 -4.964 6.483 1.00 . A A . 12 GLN OE1 1 1
12 2795 1 1 13 ABA C C -1.292 -7.978 -1.472 1.00 . A A . 13 AIB C 1 1
12 2796 1 1 13 ABA CA C -1.501 -6.402 -1.318 1.00 . A A . 13 AIB CA 1 1
12 2797 1 1 13 ABA H H 0.388 -5.451 -0.714 1.00 . A A . 13 AIB H 1 1
12 2798 1 1 13 ABA N N -0.514 -5.809 -0.351 1.00 . A A . 13 AIB N 1 1
12 2799 1 1 13 ABA O O -2.286 -8.698 -1.320 1.00 . A A . 13 AIB O 1 1
12 2800 1 1 14 HYP C C -0.090 -10.972 -0.684 1.00 . A A . 14 HYP C 1 1
12 2801 1 1 14 HYP CA C 0.073 -10.062 -1.941 1.00 . A A . 14 HYP CA 1 1
12 2802 1 1 14 HYP CB C 1.472 -10.182 -2.579 1.00 . A A . 14 HYP CB 1 1
12 2803 1 1 14 HYP CD C 1.188 -7.878 -1.991 1.00 . A A . 14 HYP CD 1 1
12 2804 1 1 14 HYP CG C 2.241 -8.983 -2.029 1.00 . A A . 14 HYP CG 1 1
12 2805 1 1 14 HYP HA H -0.666 -10.398 -2.693 1.00 . A A . 14 HYP HA 1 1
12 2806 1 1 14 HYP HB2 H 1.984 -11.140 -2.361 1.00 . A A . 14 HYP HB2 1 1
12 2807 1 1 14 HYP HB3 H 1.391 -10.118 -3.681 1.00 . A A . 14 HYP HB3 1 1
12 2808 1 1 14 HYP HD1 H 2.960 -8.298 -3.676 1.00 . A A . 14 HYP HD1 1 1
12 2809 1 1 14 HYP HD22 H 1.444 -7.163 -1.198 1.00 . A A . 14 HYP HD22 1 1
12 2810 1 1 14 HYP HD23 H 1.154 -7.315 -2.939 1.00 . A A . 14 HYP HD23 1 1
12 2811 1 1 14 HYP HG H 2.586 -9.193 -0.994 1.00 . A A . 14 HYP HG 1 1
12 2812 1 1 14 HYP N N -0.083 -8.591 -1.745 1.00 . A A . 14 HYP N 1 1
12 2813 1 1 14 HYP O O -0.761 -12.000 -0.796 1.00 . A A . 14 HYP O 1 1
12 2814 1 1 14 HYP OD1 O 3.340 -8.626 -2.856 1.00 . A A . 14 HYP OD1 1 1
12 2815 1 1 15 ABA C C -1.098 -11.714 2.195 1.00 . A A . 15 AIB C 1 1
12 2816 1 1 15 ABA CA C 0.408 -11.391 1.765 1.00 . A A . 15 AIB CA 1 1
12 2817 1 1 15 ABA H H 1.029 -9.734 0.441 1.00 . A A . 15 AIB H 1 1
12 2818 1 1 15 ABA N N 0.520 -10.623 0.479 1.00 . A A . 15 AIB N 1 1
12 2819 1 1 15 ABA O O -1.395 -12.897 2.399 1.00 . A A . 15 AIB O 1 1
12 2820 1 1 16 PRO C C -4.257 -11.663 1.148 1.00 . A A . 16 PRO C 1 1
12 2821 1 1 16 PRO CA C -3.540 -11.134 2.439 1.00 . A A . 16 PRO CA 1 1
12 2822 1 1 16 PRO CB C -4.151 -9.827 2.979 1.00 . A A . 16 PRO CB 1 1
12 2823 1 1 16 PRO CD C -1.897 -9.320 2.223 1.00 . A A . 16 PRO CD 1 1
12 2824 1 1 16 PRO CG C -3.294 -8.713 2.386 1.00 . A A . 16 PRO CG 1 1
12 2825 1 1 16 PRO HA H -3.646 -11.907 3.227 1.00 . A A . 16 PRO HA 1 1
12 2826 1 1 16 PRO HB2 H -5.224 -9.703 2.733 1.00 . A A . 16 PRO HB2 1 1
12 2827 1 1 16 PRO HB3 H -4.078 -9.800 4.083 1.00 . A A . 16 PRO HB3 1 1
12 2828 1 1 16 PRO HD2 H -1.453 -9.007 1.264 1.00 . A A . 16 PRO HD2 1 1
12 2829 1 1 16 PRO HD3 H -1.224 -8.969 3.023 1.00 . A A . 16 PRO HD3 1 1
12 2830 1 1 16 PRO HG2 H -3.695 -8.416 1.398 1.00 . A A . 16 PRO HG2 1 1
12 2831 1 1 16 PRO HG3 H -3.293 -7.805 3.017 1.00 . A A . 16 PRO HG3 1 1
12 2832 1 1 16 PRO N N -2.100 -10.778 2.287 1.00 . A A . 16 PRO N 1 1
12 2833 1 1 16 PRO O O -5.026 -12.621 1.261 1.00 . A A . 16 PRO O 1 1
12 2834 1 1 17 PHL C C -3.685 -12.010 -2.271 1.00 . A A . 17 PHL C 1 1
12 2835 1 1 17 PHL CA C -4.732 -11.419 -1.299 1.00 . A A . 17 PHL CA 1 1
12 2836 1 1 17 PHL CB C -5.461 -10.190 -1.917 1.00 . A A . 17 PHL CB 1 1
12 2837 1 1 17 PHL CD1 C -7.901 -10.296 -1.185 1.00 . A A . 17 PHL CD1 1 1
12 2838 1 1 17 PHL CD2 C -6.516 -8.531 -0.288 1.00 . A A . 17 PHL CD2 1 1
12 2839 1 1 17 PHL CE1 C -8.980 -9.828 -0.439 1.00 . A A . 17 PHL CE1 1 1
12 2840 1 1 17 PHL CE2 C -7.599 -8.066 0.461 1.00 . A A . 17 PHL CE2 1 1
12 2841 1 1 17 PHL CG C -6.659 -9.655 -1.108 1.00 . A A . 17 PHL CG 1 1
12 2842 1 1 17 PHL CZ C -8.827 -8.715 0.385 1.00 . A A . 17 PHL CZ 1 1
12 2843 1 1 17 PHL H H -3.360 -10.271 -0.005 1.00 . A A . 17 PHL H 1 1
12 2844 1 1 17 PHL HA H -5.488 -12.209 -1.117 1.00 . A A . 17 PHL HA 1 1
12 2845 1 1 17 PHL HB2 H -4.737 -9.374 -2.114 1.00 . A A . 17 PHL HB2 1 1
12 2846 1 1 17 PHL HB3 H -5.830 -10.458 -2.927 1.00 . A A . 17 PHL HB3 1 1
12 2847 1 1 17 PHL HC1 H -3.136 -12.844 -1.795 1.00 . A A . 17 PHL HC1 1 1
12 2848 1 1 17 PHL HC2 H -2.922 -11.257 -2.548 1.00 . A A . 17 PHL HC2 1 1
12 2849 1 1 17 PHL HD1 H -8.033 -11.162 -1.818 1.00 . A A . 17 PHL HD1 1 1
12 2850 1 1 17 PHL HD2 H -5.569 -8.016 -0.219 1.00 . A A . 17 PHL HD2 1 1
12 2851 1 1 17 PHL HE1 H -9.935 -10.329 -0.499 1.00 . A A . 17 PHL HE1 1 1
12 2852 1 1 17 PHL HE2 H -7.483 -7.201 1.096 1.00 . A A . 17 PHL HE2 1 1
12 2853 1 1 17 PHL HO H -4.852 -11.790 -3.782 1.00 . A A . 17 PHL HO 1 1
12 2854 1 1 17 PHL HZ H -9.667 -8.355 0.966 1.00 . A A . 17 PHL HZ 1 1
12 2855 1 1 17 PHL N N -4.036 -11.045 -0.037 1.00 . A A . 17 PHL N 1 1
12 2856 1 1 17 PHL O O -4.312 -12.509 -3.445 1.00 . A A . 17 PHL O 1 1
13 2857 1 1 1 ACE C C -2.205 10.244 1.225 1.00 . A A . 1 ACE C 1 1
13 2858 1 1 1 ACE CH3 C -1.277 11.410 1.534 1.00 . A A . 1 ACE CH3 1 1
13 2859 1 1 1 ACE H1 H -1.835 12.354 1.669 1.00 . A A . 1 ACE H1 1 1
13 2860 1 1 1 ACE H2 H -0.691 11.219 2.449 1.00 . A A . 1 ACE H2 1 1
13 2861 1 1 1 ACE H3 H -0.553 11.555 0.709 1.00 . A A . 1 ACE H3 1 1
13 2862 1 1 1 ACE O O -2.184 9.220 1.910 1.00 . A A . 1 ACE O 1 1
13 2863 1 1 2 TRP C C -2.617 8.330 -1.316 1.00 . A A . 2 TRP C 1 1
13 2864 1 1 2 TRP CA C -3.624 9.272 -0.573 1.00 . A A . 2 TRP CA 1 1
13 2865 1 1 2 TRP CB C -4.734 9.786 -1.537 1.00 . A A . 2 TRP CB 1 1
13 2866 1 1 2 TRP CD1 C -6.749 10.167 0.115 1.00 . A A . 2 TRP CD1 1 1
13 2867 1 1 2 TRP CD2 C -6.249 11.917 -1.168 1.00 . A A . 2 TRP CD2 1 1
13 2868 1 1 2 TRP CE2 C -7.322 12.251 -0.303 1.00 . A A . 2 TRP CE2 1 1
13 2869 1 1 2 TRP CE3 C -5.749 12.876 -2.090 1.00 . A A . 2 TRP CE3 1 1
13 2870 1 1 2 TRP CG C -5.875 10.607 -0.904 1.00 . A A . 2 TRP CG 1 1
13 2871 1 1 2 TRP CH2 C -7.391 14.472 -1.259 1.00 . A A . 2 TRP CH2 1 1
13 2872 1 1 2 TRP CZ2 C -7.897 13.546 -0.346 1.00 . A A . 2 TRP CZ2 1 1
13 2873 1 1 2 TRP CZ3 C -6.337 14.141 -2.120 1.00 . A A . 2 TRP CZ3 1 1
13 2874 1 1 2 TRP H H -2.947 11.333 -0.287 1.00 . A A . 2 TRP H 1 1
13 2875 1 1 2 TRP HA H -4.130 8.678 0.205 1.00 . A A . 2 TRP HA 1 1
13 2876 1 1 2 TRP HB2 H -4.265 10.368 -2.353 1.00 . A A . 2 TRP HB2 1 1
13 2877 1 1 2 TRP HB3 H -5.195 8.919 -2.050 1.00 . A A . 2 TRP HB3 1 1
13 2878 1 1 2 TRP HD1 H -6.720 9.183 0.559 1.00 . A A . 2 TRP HD1 1 1
13 2879 1 1 2 TRP HE1 H -8.375 11.128 1.230 1.00 . A A . 2 TRP HE1 1 1
13 2880 1 1 2 TRP HE3 H -4.936 12.639 -2.760 1.00 . A A . 2 TRP HE3 1 1
13 2881 1 1 2 TRP HH2 H -7.820 15.463 -1.302 1.00 . A A . 2 TRP HH2 1 1
13 2882 1 1 2 TRP HZ2 H -8.708 13.817 0.314 1.00 . A A . 2 TRP HZ2 1 1
13 2883 1 1 2 TRP HZ3 H -5.973 14.881 -2.819 1.00 . A A . 2 TRP HZ3 1 1
13 2884 1 1 2 TRP N N -2.959 10.403 0.130 1.00 . A A . 2 TRP N 1 1
13 2885 1 1 2 TRP NE1 N -7.651 11.174 0.507 1.00 . A A . 2 TRP NE1 1 1
13 2886 1 1 2 TRP O O -2.742 7.106 -1.222 1.00 . A A . 2 TRP O 1 1
13 2887 1 1 3 ILE C C 0.474 7.463 -1.457 1.00 . A A . 3 ILE C 1 1
13 2888 1 1 3 ILE CA C -0.427 8.147 -2.536 1.00 . A A . 3 ILE CA 1 1
13 2889 1 1 3 ILE CB C 0.389 8.940 -3.621 1.00 . A A . 3 ILE CB 1 1
13 2890 1 1 3 ILE CD1 C 2.545 10.059 -2.642 1.00 . A A . 3 ILE CD1 1 1
13 2891 1 1 3 ILE CG1 C 1.098 10.244 -3.131 1.00 . A A . 3 ILE CG1 1 1
13 2892 1 1 3 ILE CG2 C -0.469 9.229 -4.879 1.00 . A A . 3 ILE CG2 1 1
13 2893 1 1 3 ILE H H -1.628 9.929 -2.026 1.00 . A A . 3 ILE H 1 1
13 2894 1 1 3 ILE HA H -0.868 7.295 -3.070 1.00 . A A . 3 ILE HA 1 1
13 2895 1 1 3 ILE HB H 1.176 8.255 -3.991 1.00 . A A . 3 ILE HB 1 1
13 2896 1 1 3 ILE HD11 H 3.215 9.764 -3.469 1.00 . A A . 3 ILE HD11 1 1
13 2897 1 1 3 ILE HD12 H 2.944 10.997 -2.215 1.00 . A A . 3 ILE HD12 1 1
13 2898 1 1 3 ILE HD13 H 2.634 9.285 -1.860 1.00 . A A . 3 ILE HD13 1 1
13 2899 1 1 3 ILE HG12 H 1.139 10.997 -3.941 1.00 . A A . 3 ILE HG12 1 1
13 2900 1 1 3 ILE HG13 H 0.501 10.731 -2.337 1.00 . A A . 3 ILE HG13 1 1
13 2901 1 1 3 ILE HG21 H -1.279 9.952 -4.672 1.00 . A A . 3 ILE HG21 1 1
13 2902 1 1 3 ILE HG22 H 0.139 9.643 -5.705 1.00 . A A . 3 ILE HG22 1 1
13 2903 1 1 3 ILE HG23 H -0.945 8.309 -5.267 1.00 . A A . 3 ILE HG23 1 1
13 2904 1 1 3 ILE N N -1.608 8.904 -2.016 1.00 . A A . 3 ILE N 1 1
13 2905 1 1 3 ILE O O 0.969 6.363 -1.703 1.00 . A A . 3 ILE O 1 1
13 2906 1 1 4 GLN C C 0.556 6.309 1.571 1.00 . A A . 4 GLN C 1 1
13 2907 1 1 4 GLN CA C 1.340 7.466 0.890 1.00 . A A . 4 GLN CA 1 1
13 2908 1 1 4 GLN CB C 1.736 8.569 1.907 1.00 . A A . 4 GLN CB 1 1
13 2909 1 1 4 GLN CD C 3.280 10.590 2.348 1.00 . A A . 4 GLN CD 1 1
13 2910 1 1 4 GLN CG C 3.018 9.329 1.506 1.00 . A A . 4 GLN CG 1 1
13 2911 1 1 4 GLN H H 0.174 8.986 -0.215 1.00 . A A . 4 GLN H 1 1
13 2912 1 1 4 GLN HA H 2.274 7.012 0.514 1.00 . A A . 4 GLN HA 1 1
13 2913 1 1 4 GLN HB2 H 0.893 9.274 2.054 1.00 . A A . 4 GLN HB2 1 1
13 2914 1 1 4 GLN HB3 H 1.908 8.129 2.908 1.00 . A A . 4 GLN HB3 1 1
13 2915 1 1 4 GLN HE21 H 3.280 11.729 0.694 1.00 . A A . 4 GLN HE21 1 1
13 2916 1 1 4 GLN HE22 H 3.604 12.568 2.292 1.00 . A A . 4 GLN HE22 1 1
13 2917 1 1 4 GLN HG2 H 3.877 8.640 1.608 1.00 . A A . 4 GLN HG2 1 1
13 2918 1 1 4 GLN HG3 H 2.978 9.573 0.426 1.00 . A A . 4 GLN HG3 1 1
13 2919 1 1 4 GLN N N 0.657 8.087 -0.281 1.00 . A A . 4 GLN N 1 1
13 2920 1 1 4 GLN NE2 N 3.379 11.751 1.715 1.00 . A A . 4 GLN NE2 1 1
13 2921 1 1 4 GLN O O 1.165 5.276 1.857 1.00 . A A . 4 GLN O 1 1
13 2922 1 1 4 GLN OE1 O 3.408 10.535 3.571 1.00 . A A . 4 GLN OE1 1 1
13 2923 1 1 5 . C C -1.541 4.066 1.309 1.00 . A A . 5 DIV C 1 1
13 2924 1 1 5 . CA C -1.707 5.359 2.216 1.00 . A A . 5 DIV CA 1 1
13 2925 1 1 5 . CB1 C -1.483 5.108 3.755 1.00 . A A . 5 DIV CB1 1 1
13 2926 1 1 5 . CB2 C -3.139 5.944 2.031 1.00 . A A . 5 DIV CB2 1 1
13 2927 1 1 5 . CG1 C -2.461 4.174 4.499 1.00 . A A . 5 DIV CG1 1 1
13 2928 1 1 5 . H H -1.122 7.386 1.528 1.00 . A A . 5 DIV H 1 1
13 2929 1 1 5 . HB11 H -0.463 4.716 3.917 1.00 . A A . 5 DIV HB11 1 1
13 2930 1 1 5 . HB12 H -1.493 6.073 4.297 1.00 . A A . 5 DIV HB12 1 1
13 2931 1 1 5 . HB21 H -3.349 6.249 0.990 1.00 . A A . 5 DIV HB21 1 1
13 2932 1 1 5 . HB22 H -3.922 5.206 2.287 1.00 . A A . 5 DIV HB22 1 1
13 2933 1 1 5 . HB23 H -3.323 6.833 2.663 1.00 . A A . 5 DIV HB23 1 1
13 2934 1 1 5 . HG11 H -2.520 3.176 4.034 1.00 . A A . 5 DIV HG11 1 1
13 2935 1 1 5 . HG12 H -2.148 4.026 5.548 1.00 . A A . 5 DIV HG12 1 1
13 2936 1 1 5 . HG13 H -3.487 4.584 4.526 1.00 . A A . 5 DIV HG13 1 1
13 2937 1 1 5 . N N -0.772 6.459 1.795 1.00 . A A . 5 DIV N 1 1
13 2938 1 1 5 . O O -1.246 2.986 1.829 1.00 . A A . 5 DIV O 1 1
13 2939 1 1 6 ILE C C -0.014 2.487 -1.108 1.00 . A A . 6 ILE C 1 1
13 2940 1 1 6 ILE CA C -1.477 3.020 -0.968 1.00 . A A . 6 ILE CA 1 1
13 2941 1 1 6 ILE CB C -2.276 3.177 -2.308 1.00 . A A . 6 ILE CB 1 1
13 2942 1 1 6 ILE CD1 C -3.559 1.769 -4.125 1.00 . A A . 6 ILE CD1 1 1
13 2943 1 1 6 ILE CG1 C -2.492 1.803 -3.017 1.00 . A A . 6 ILE CG1 1 1
13 2944 1 1 6 ILE CG2 C -1.692 4.245 -3.263 1.00 . A A . 6 ILE CG2 1 1
13 2945 1 1 6 ILE H H -1.995 5.076 -0.393 1.00 . A A . 6 ILE H 1 1
13 2946 1 1 6 ILE HA H -2.013 2.216 -0.447 1.00 . A A . 6 ILE HA 1 1
13 2947 1 1 6 ILE HB H -3.288 3.532 -2.027 1.00 . A A . 6 ILE HB 1 1
13 2948 1 1 6 ILE HD11 H -3.306 2.439 -4.967 1.00 . A A . 6 ILE HD11 1 1
13 2949 1 1 6 ILE HD12 H -3.661 0.750 -4.542 1.00 . A A . 6 ILE HD12 1 1
13 2950 1 1 6 ILE HD13 H -4.554 2.067 -3.744 1.00 . A A . 6 ILE HD13 1 1
13 2951 1 1 6 ILE HG12 H -1.535 1.430 -3.429 1.00 . A A . 6 ILE HG12 1 1
13 2952 1 1 6 ILE HG13 H -2.787 1.045 -2.266 1.00 . A A . 6 ILE HG13 1 1
13 2953 1 1 6 ILE HG21 H -0.698 3.963 -3.654 1.00 . A A . 6 ILE HG21 1 1
13 2954 1 1 6 ILE HG22 H -2.349 4.430 -4.131 1.00 . A A . 6 ILE HG22 1 1
13 2955 1 1 6 ILE HG23 H -1.576 5.212 -2.746 1.00 . A A . 6 ILE HG23 1 1
13 2956 1 1 6 ILE N N -1.658 4.175 -0.043 1.00 . A A . 6 ILE N 1 1
13 2957 1 1 6 ILE O O 0.143 1.270 -1.057 1.00 . A A . 6 ILE O 1 1
13 2958 1 1 7 THR C C 2.939 2.033 -0.063 1.00 . A A . 7 THR C 1 1
13 2959 1 1 7 THR CA C 2.464 2.867 -1.305 1.00 . A A . 7 THR CA 1 1
13 2960 1 1 7 THR CB C 3.413 4.067 -1.622 1.00 . A A . 7 THR CB 1 1
13 2961 1 1 7 THR CG2 C 4.897 3.696 -1.812 1.00 . A A . 7 THR CG2 1 1
13 2962 1 1 7 THR H H 0.787 4.325 -1.264 1.00 . A A . 7 THR H 1 1
13 2963 1 1 7 THR HA H 2.528 2.186 -2.176 1.00 . A A . 7 THR HA 1 1
13 2964 1 1 7 THR HB H 3.345 4.806 -0.801 1.00 . A A . 7 THR HB 1 1
13 2965 1 1 7 THR HG1 H 3.605 5.454 -2.942 1.00 . A A . 7 THR HG1 1 1
13 2966 1 1 7 THR HG21 H 5.507 4.581 -2.073 1.00 . A A . 7 THR HG21 1 1
13 2967 1 1 7 THR HG22 H 5.337 3.266 -0.894 1.00 . A A . 7 THR HG22 1 1
13 2968 1 1 7 THR HG23 H 5.030 2.951 -2.619 1.00 . A A . 7 THR HG23 1 1
13 2969 1 1 7 THR N N 1.035 3.330 -1.243 1.00 . A A . 7 THR N 1 1
13 2970 1 1 7 THR O O 3.567 0.985 -0.239 1.00 . A A . 7 THR O 1 1
13 2971 1 1 7 THR OG1 O 3.011 4.708 -2.829 1.00 . A A . 7 THR OG1 1 1
13 2972 1 1 8 ABA C C 1.907 0.305 2.390 1.00 . A A . 8 AIB C 1 1
13 2973 1 1 8 ABA CA C 2.697 1.675 2.428 1.00 . A A . 8 AIB CA 1 1
13 2974 1 1 8 ABA H H 1.936 3.254 1.094 1.00 . A A . 8 AIB H 1 1
13 2975 1 1 8 ABA N N 2.605 2.483 1.166 1.00 . A A . 8 AIB N 1 1
13 2976 1 1 8 ABA O O 2.377 -0.708 2.921 1.00 . A A . 8 AIB O 1 1
13 2977 1 1 9 LEU C C 0.500 -1.821 0.257 1.00 . A A . 9 LEU C 1 1
13 2978 1 1 9 LEU CA C -0.025 -0.983 1.460 1.00 . A A . 9 LEU CA 1 1
13 2979 1 1 9 LEU CB C -1.531 -0.636 1.279 1.00 . A A . 9 LEU CB 1 1
13 2980 1 1 9 LEU CD1 C -2.837 -2.126 2.915 1.00 . A A . 9 LEU CD1 1 1
13 2981 1 1 9 LEU CD2 C -1.946 0.091 3.761 1.00 . A A . 9 LEU CD2 1 1
13 2982 1 1 9 LEU CG C -2.453 -0.681 2.528 1.00 . A A . 9 LEU CG 1 1
13 2983 1 1 9 LEU H H 0.396 1.122 1.289 1.00 . A A . 9 LEU H 1 1
13 2984 1 1 9 LEU HA H 0.042 -1.639 2.337 1.00 . A A . 9 LEU HA 1 1
13 2985 1 1 9 LEU HB2 H -1.644 0.351 0.792 1.00 . A A . 9 LEU HB2 1 1
13 2986 1 1 9 LEU HB3 H -1.975 -1.322 0.537 1.00 . A A . 9 LEU HB3 1 1
13 2987 1 1 9 LEU HD11 H -1.970 -2.708 3.278 1.00 . A A . 9 LEU HD11 1 1
13 2988 1 1 9 LEU HD12 H -3.604 -2.147 3.712 1.00 . A A . 9 LEU HD12 1 1
13 2989 1 1 9 LEU HD13 H -3.263 -2.682 2.057 1.00 . A A . 9 LEU HD13 1 1
13 2990 1 1 9 LEU HD21 H -1.674 1.127 3.507 1.00 . A A . 9 LEU HD21 1 1
13 2991 1 1 9 LEU HD22 H -2.720 0.148 4.548 1.00 . A A . 9 LEU HD22 1 1
13 2992 1 1 9 LEU HD23 H -1.050 -0.376 4.208 1.00 . A A . 9 LEU HD23 1 1
13 2993 1 1 9 LEU HG H -3.375 -0.167 2.206 1.00 . A A . 9 LEU HG 1 1
13 2994 1 1 9 LEU N N 0.709 0.267 1.761 1.00 . A A . 9 LEU N 1 1
13 2995 1 1 9 LEU O O 0.079 -2.973 0.170 1.00 . A A . 9 LEU O 1 1
13 2996 1 1 10 ABA C C 2.507 -3.507 -1.509 1.00 . A A . 10 AIB C 1 1
13 2997 1 1 10 ABA CA C 1.882 -2.076 -1.848 1.00 . A A . 10 AIB CA 1 1
13 2998 1 1 10 ABA H H 1.696 -0.354 -0.434 1.00 . A A . 10 AIB H 1 1
13 2999 1 1 10 ABA N N 1.367 -1.310 -0.659 1.00 . A A . 10 AIB N 1 1
13 3000 1 1 10 ABA O O 2.026 -4.496 -2.080 1.00 . A A . 10 AIB O 1 1
13 3001 1 1 11 HYP C C 2.849 -5.904 0.710 1.00 . A A . 11 HYP C 1 1
13 3002 1 1 11 HYP CA C 3.901 -5.090 -0.121 1.00 . A A . 11 HYP CA 1 1
13 3003 1 1 11 HYP CB C 5.165 -4.789 0.705 1.00 . A A . 11 HYP CB 1 1
13 3004 1 1 11 HYP CD C 4.038 -2.681 0.317 1.00 . A A . 11 HYP CD 1 1
13 3005 1 1 11 HYP CG C 4.905 -3.422 1.341 1.00 . A A . 11 HYP CG 1 1
13 3006 1 1 11 HYP HA H 4.193 -5.704 -0.995 1.00 . A A . 11 HYP HA 1 1
13 3007 1 1 11 HYP HB2 H 5.381 -5.563 1.465 1.00 . A A . 11 HYP HB2 1 1
13 3008 1 1 11 HYP HB3 H 6.052 -4.742 0.042 1.00 . A A . 11 HYP HB3 1 1
13 3009 1 1 11 HYP HD1 H 6.582 -3.270 2.267 1.00 . A A . 11 HYP HD1 1 1
13 3010 1 1 11 HYP HD22 H 3.228 -2.155 0.842 1.00 . A A . 11 HYP HD22 1 1
13 3011 1 1 11 HYP HD23 H 4.585 -1.921 -0.255 1.00 . A A . 11 HYP HD23 1 1
13 3012 1 1 11 HYP HG H 4.335 -3.555 2.281 1.00 . A A . 11 HYP HG 1 1
13 3013 1 1 11 HYP N N 3.501 -3.723 -0.579 1.00 . A A . 11 HYP N 1 1
13 3014 1 1 11 HYP O O 2.993 -7.123 0.839 1.00 . A A . 11 HYP O 1 1
13 3015 1 1 11 HYP OD1 O 6.119 -2.735 1.618 1.00 . A A . 11 HYP OD1 1 1
13 3016 1 1 12 GLN C C -0.626 -6.021 0.938 1.00 . A A . 12 GLN C 1 1
13 3017 1 1 12 GLN CA C 0.625 -5.845 1.858 1.00 . A A . 12 GLN CA 1 1
13 3018 1 1 12 GLN CB C 0.299 -5.039 3.153 1.00 . A A . 12 GLN CB 1 1
13 3019 1 1 12 GLN CD C 1.341 -6.491 5.083 1.00 . A A . 12 GLN CD 1 1
13 3020 1 1 12 GLN CG C 1.325 -5.156 4.309 1.00 . A A . 12 GLN CG 1 1
13 3021 1 1 12 GLN H H 1.796 -4.236 1.093 1.00 . A A . 12 GLN H 1 1
13 3022 1 1 12 GLN HA H 0.923 -6.845 2.152 1.00 . A A . 12 GLN HA 1 1
13 3023 1 1 12 GLN HB2 H 0.188 -3.969 2.893 1.00 . A A . 12 GLN HB2 1 1
13 3024 1 1 12 GLN HB3 H -0.692 -5.320 3.555 1.00 . A A . 12 GLN HB3 1 1
13 3025 1 1 12 GLN HE21 H 1.789 -5.518 6.777 1.00 . A A . 12 GLN HE21 1 1
13 3026 1 1 12 GLN HE22 H 1.648 -7.343 6.871 1.00 . A A . 12 GLN HE22 1 1
13 3027 1 1 12 GLN HG2 H 2.344 -4.970 3.922 1.00 . A A . 12 GLN HG2 1 1
13 3028 1 1 12 GLN HG3 H 1.124 -4.324 5.010 1.00 . A A . 12 GLN HG3 1 1
13 3029 1 1 12 GLN N N 1.807 -5.235 1.240 1.00 . A A . 12 GLN N 1 1
13 3030 1 1 12 GLN NE2 N 1.613 -6.445 6.377 1.00 . A A . 12 GLN NE2 1 1
13 3031 1 1 12 GLN O O -1.659 -6.412 1.478 1.00 . A A . 12 GLN O 1 1
13 3032 1 1 12 GLN OE1 O 1.139 -7.573 4.536 1.00 . A A . 12 GLN OE1 1 1
13 3033 1 1 13 ABA C C -1.289 -8.006 -1.519 1.00 . A A . 13 AIB C 1 1
13 3034 1 1 13 ABA CA C -1.523 -6.429 -1.396 1.00 . A A . 13 AIB CA 1 1
13 3035 1 1 13 ABA H H 0.341 -5.459 -0.747 1.00 . A A . 13 AIB H 1 1
13 3036 1 1 13 ABA N N -0.571 -5.816 -0.407 1.00 . A A . 13 AIB N 1 1
13 3037 1 1 13 ABA O O -2.267 -8.745 -1.358 1.00 . A A . 13 AIB O 1 1
13 3038 1 1 14 HYP C C -0.050 -10.967 -0.682 1.00 . A A . 14 HYP C 1 1
13 3039 1 1 14 HYP CA C 0.113 -10.070 -1.947 1.00 . A A . 14 HYP CA 1 1
13 3040 1 1 14 HYP CB C 1.523 -10.178 -2.562 1.00 . A A . 14 HYP CB 1 1
13 3041 1 1 14 HYP CD C 1.198 -7.872 -2.006 1.00 . A A . 14 HYP CD 1 1
13 3042 1 1 14 HYP CG C 2.267 -8.960 -2.017 1.00 . A A . 14 HYP CG 1 1
13 3043 1 1 14 HYP HA H -0.611 -10.431 -2.704 1.00 . A A . 14 HYP HA 1 1
13 3044 1 1 14 HYP HB2 H 2.047 -11.124 -2.328 1.00 . A A . 14 HYP HB2 1 1
13 3045 1 1 14 HYP HB3 H 1.457 -10.130 -3.667 1.00 . A A . 14 HYP HB3 1 1
13 3046 1 1 14 HYP HD1 H 2.997 -8.375 -3.695 1.00 . A A . 14 HYP HD1 1 1
13 3047 1 1 14 HYP HD22 H 1.431 -7.142 -1.224 1.00 . A A . 14 HYP HD22 1 1
13 3048 1 1 14 HYP HD23 H 1.166 -7.321 -2.960 1.00 . A A . 14 HYP HD23 1 1
13 3049 1 1 14 HYP HG H 2.603 -9.156 -0.977 1.00 . A A . 14 HYP HG 1 1
13 3050 1 1 14 HYP N N -0.068 -8.599 -1.771 1.00 . A A . 14 HYP N 1 1
13 3051 1 1 14 HYP O O -0.690 -12.015 -0.805 1.00 . A A . 14 HYP O 1 1
13 3052 1 1 14 HYP OD1 O 3.369 -8.601 -2.840 1.00 . A A . 14 HYP OD1 1 1
13 3053 1 1 15 ABA C C -1.030 -11.753 2.209 1.00 . A A . 15 AIB C 1 1
13 3054 1 1 15 ABA CA C 0.462 -11.410 1.757 1.00 . A A . 15 AIB CA 1 1
13 3055 1 1 15 ABA H H 0.907 -9.644 0.512 1.00 . A A . 15 AIB H 1 1
13 3056 1 1 15 ABA N N 0.529 -10.601 0.495 1.00 . A A . 15 AIB N 1 1
13 3057 1 1 15 ABA O O -1.303 -12.941 2.418 1.00 . A A . 15 AIB O 1 1
13 3058 1 1 16 PRO C C -4.219 -11.682 1.192 1.00 . A A . 16 PRO C 1 1
13 3059 1 1 16 PRO CA C -3.475 -11.207 2.484 1.00 . A A . 16 PRO CA 1 1
13 3060 1 1 16 PRO CB C -4.086 -9.929 3.091 1.00 . A A . 16 PRO CB 1 1
13 3061 1 1 16 PRO CD C -1.860 -9.367 2.286 1.00 . A A . 16 PRO CD 1 1
13 3062 1 1 16 PRO CG C -3.260 -8.782 2.509 1.00 . A A . 16 PRO CG 1 1
13 3063 1 1 16 PRO HA H -3.559 -12.012 3.243 1.00 . A A . 16 PRO HA 1 1
13 3064 1 1 16 PRO HB2 H -5.167 -9.811 2.884 1.00 . A A . 16 PRO HB2 1 1
13 3065 1 1 16 PRO HB3 H -3.979 -9.941 4.193 1.00 . A A . 16 PRO HB3 1 1
13 3066 1 1 16 PRO HD2 H -1.451 -9.024 1.321 1.00 . A A . 16 PRO HD2 1 1
13 3067 1 1 16 PRO HD3 H -1.171 -9.028 3.077 1.00 . A A . 16 PRO HD3 1 1
13 3068 1 1 16 PRO HG2 H -3.692 -8.460 1.542 1.00 . A A . 16 PRO HG2 1 1
13 3069 1 1 16 PRO HG3 H -3.249 -7.894 3.169 1.00 . A A . 16 PRO HG3 1 1
13 3070 1 1 16 PRO N N -2.044 -10.830 2.316 1.00 . A A . 16 PRO N 1 1
13 3071 1 1 16 PRO O O -4.996 -12.636 1.294 1.00 . A A . 16 PRO O 1 1
13 3072 1 1 17 PHL C C -3.897 -11.870 -2.292 1.00 . A A . 17 PHL C 1 1
13 3073 1 1 17 PHL CA C -4.834 -11.304 -1.202 1.00 . A A . 17 PHL CA 1 1
13 3074 1 1 17 PHL CB C -5.582 -10.026 -1.689 1.00 . A A . 17 PHL CB 1 1
13 3075 1 1 17 PHL CD1 C -7.805 -10.122 -0.437 1.00 . A A . 17 PHL CD1 1 1
13 3076 1 1 17 PHL CD2 C -6.380 -8.205 -0.084 1.00 . A A . 17 PHL CD2 1 1
13 3077 1 1 17 PHL CE1 C -8.732 -9.595 0.459 1.00 . A A . 17 PHL CE1 1 1
13 3078 1 1 17 PHL CE2 C -7.310 -7.678 0.808 1.00 . A A . 17 PHL CE2 1 1
13 3079 1 1 17 PHL CG C -6.618 -9.431 -0.712 1.00 . A A . 17 PHL CG 1 1
13 3080 1 1 17 PHL CZ C -8.486 -8.374 1.081 1.00 . A A . 17 PHL CZ 1 1
13 3081 1 1 17 PHL H H -3.335 -10.266 0.037 1.00 . A A . 17 PHL H 1 1
13 3082 1 1 17 PHL HA H -5.600 -12.080 -1.002 1.00 . A A . 17 PHL HA 1 1
13 3083 1 1 17 PHL HB2 H -4.844 -9.253 -1.985 1.00 . A A . 17 PHL HB2 1 1
13 3084 1 1 17 PHL HB3 H -6.110 -10.260 -2.632 1.00 . A A . 17 PHL HB3 1 1
13 3085 1 1 17 PHL HC1 H -3.295 -12.710 -1.893 1.00 . A A . 17 PHL HC1 1 1
13 3086 1 1 17 PHL HC2 H -3.169 -11.110 -2.636 1.00 . A A . 17 PHL HC2 1 1
13 3087 1 1 17 PHL HD1 H -8.009 -11.072 -0.909 1.00 . A A . 17 PHL HD1 1 1
13 3088 1 1 17 PHL HD2 H -5.473 -7.653 -0.284 1.00 . A A . 17 PHL HD2 1 1
13 3089 1 1 17 PHL HE1 H -9.643 -10.137 0.674 1.00 . A A . 17 PHL HE1 1 1
13 3090 1 1 17 PHL HE2 H -7.122 -6.728 1.289 1.00 . A A . 17 PHL HE2 1 1
13 3091 1 1 17 PHL HO H -5.062 -11.581 -3.799 1.00 . A A . 17 PHL HO 1 1
13 3092 1 1 17 PHL HZ H -9.207 -7.967 1.774 1.00 . A A . 17 PHL HZ 1 1
13 3093 1 1 17 PHL N N -4.032 -11.024 0.020 1.00 . A A . 17 PHL N 1 1
13 3094 1 1 17 PHL O O -4.641 -12.351 -3.407 1.00 . A A . 17 PHL O 1 1
14 3095 1 1 1 ACE C C -2.157 10.906 0.539 1.00 . A A . 1 ACE C 1 1
14 3096 1 1 1 ACE CH3 C -1.632 12.325 0.377 1.00 . A A . 1 ACE CH3 1 1
14 3097 1 1 1 ACE H1 H -1.231 12.478 -0.643 1.00 . A A . 1 ACE H1 1 1
14 3098 1 1 1 ACE H2 H -2.427 13.072 0.546 1.00 . A A . 1 ACE H2 1 1
14 3099 1 1 1 ACE H3 H -0.808 12.527 1.084 1.00 . A A . 1 ACE H3 1 1
14 3100 1 1 1 ACE O O -1.626 10.123 1.332 1.00 . A A . 1 ACE O 1 1
14 3101 1 1 2 TRP C C -2.523 8.276 -1.306 1.00 . A A . 2 TRP C 1 1
14 3102 1 1 2 TRP CA C -3.561 9.162 -0.532 1.00 . A A . 2 TRP CA 1 1
14 3103 1 1 2 TRP CB C -4.968 9.132 -1.196 1.00 . A A . 2 TRP CB 1 1
14 3104 1 1 2 TRP CD1 C -5.777 6.710 -1.833 1.00 . A A . 2 TRP CD1 1 1
14 3105 1 1 2 TRP CD2 C -6.408 7.425 0.179 1.00 . A A . 2 TRP CD2 1 1
14 3106 1 1 2 TRP CE2 C -6.861 6.097 -0.017 1.00 . A A . 2 TRP CE2 1 1
14 3107 1 1 2 TRP CE3 C -6.668 8.104 1.398 1.00 . A A . 2 TRP CE3 1 1
14 3108 1 1 2 TRP CG C -5.722 7.816 -0.958 1.00 . A A . 2 TRP CG 1 1
14 3109 1 1 2 TRP CH2 C -7.847 6.126 2.193 1.00 . A A . 2 TRP CH2 1 1
14 3110 1 1 2 TRP CZ2 C -7.590 5.440 1.004 1.00 . A A . 2 TRP CZ2 1 1
14 3111 1 1 2 TRP CZ3 C -7.392 7.435 2.388 1.00 . A A . 2 TRP CZ3 1 1
14 3112 1 1 2 TRP H H -3.546 11.335 -0.850 1.00 . A A . 2 TRP H 1 1
14 3113 1 1 2 TRP HA H -3.674 8.723 0.473 1.00 . A A . 2 TRP HA 1 1
14 3114 1 1 2 TRP HB2 H -5.604 9.951 -0.803 1.00 . A A . 2 TRP HB2 1 1
14 3115 1 1 2 TRP HB3 H -4.887 9.340 -2.281 1.00 . A A . 2 TRP HB3 1 1
14 3116 1 1 2 TRP HD1 H -5.304 6.676 -2.804 1.00 . A A . 2 TRP HD1 1 1
14 3117 1 1 2 TRP HE1 H -6.643 4.701 -1.667 1.00 . A A . 2 TRP HE1 1 1
14 3118 1 1 2 TRP HE3 H -6.322 9.115 1.562 1.00 . A A . 2 TRP HE3 1 1
14 3119 1 1 2 TRP HH2 H -8.410 5.637 2.975 1.00 . A A . 2 TRP HH2 1 1
14 3120 1 1 2 TRP HZ2 H -7.944 4.429 0.867 1.00 . A A . 2 TRP HZ2 1 1
14 3121 1 1 2 TRP HZ3 H -7.606 7.940 3.320 1.00 . A A . 2 TRP HZ3 1 1
14 3122 1 1 2 TRP N N -3.159 10.574 -0.291 1.00 . A A . 2 TRP N 1 1
14 3123 1 1 2 TRP NE1 N -6.478 5.631 -1.265 1.00 . A A . 2 TRP NE1 1 1
14 3124 1 1 2 TRP O O -2.587 7.049 -1.194 1.00 . A A . 2 TRP O 1 1
14 3125 1 1 3 ILE C C 0.555 7.464 -1.423 1.00 . A A . 3 ILE C 1 1
14 3126 1 1 3 ILE CA C -0.334 8.143 -2.519 1.00 . A A . 3 ILE CA 1 1
14 3127 1 1 3 ILE CB C 0.513 8.985 -3.540 1.00 . A A . 3 ILE CB 1 1
14 3128 1 1 3 ILE CD1 C 2.221 10.958 -3.785 1.00 . A A . 3 ILE CD1 1 1
14 3129 1 1 3 ILE CG1 C 1.091 10.315 -2.963 1.00 . A A . 3 ILE CG1 1 1
14 3130 1 1 3 ILE CG2 C -0.257 9.223 -4.865 1.00 . A A . 3 ILE CG2 1 1
14 3131 1 1 3 ILE H H -1.609 9.889 -2.073 1.00 . A A . 3 ILE H 1 1
14 3132 1 1 3 ILE HA H -0.741 7.292 -3.079 1.00 . A A . 3 ILE HA 1 1
14 3133 1 1 3 ILE HB H 1.379 8.354 -3.818 1.00 . A A . 3 ILE HB 1 1
14 3134 1 1 3 ILE HD11 H 1.874 11.281 -4.784 1.00 . A A . 3 ILE HD11 1 1
14 3135 1 1 3 ILE HD12 H 2.620 11.854 -3.276 1.00 . A A . 3 ILE HD12 1 1
14 3136 1 1 3 ILE HD13 H 3.066 10.261 -3.932 1.00 . A A . 3 ILE HD13 1 1
14 3137 1 1 3 ILE HG12 H 0.279 11.053 -2.815 1.00 . A A . 3 ILE HG12 1 1
14 3138 1 1 3 ILE HG13 H 1.495 10.134 -1.949 1.00 . A A . 3 ILE HG13 1 1
14 3139 1 1 3 ILE HG21 H -1.135 9.882 -4.722 1.00 . A A . 3 ILE HG21 1 1
14 3140 1 1 3 ILE HG22 H 0.381 9.687 -5.637 1.00 . A A . 3 ILE HG22 1 1
14 3141 1 1 3 ILE HG23 H -0.629 8.273 -5.295 1.00 . A A . 3 ILE HG23 1 1
14 3142 1 1 3 ILE N N -1.547 8.866 -2.034 1.00 . A A . 3 ILE N 1 1
14 3143 1 1 3 ILE O O 1.096 6.387 -1.672 1.00 . A A . 3 ILE O 1 1
14 3144 1 1 4 GLN C C 0.540 6.277 1.609 1.00 . A A . 4 GLN C 1 1
14 3145 1 1 4 GLN CA C 1.336 7.443 0.954 1.00 . A A . 4 GLN CA 1 1
14 3146 1 1 4 GLN CB C 1.710 8.547 1.979 1.00 . A A . 4 GLN CB 1 1
14 3147 1 1 4 GLN CD C 3.136 10.680 2.307 1.00 . A A . 4 GLN CD 1 1
14 3148 1 1 4 GLN CG C 2.965 9.347 1.563 1.00 . A A . 4 GLN CG 1 1
14 3149 1 1 4 GLN H H 0.139 8.931 -0.146 1.00 . A A . 4 GLN H 1 1
14 3150 1 1 4 GLN HA H 2.280 6.996 0.598 1.00 . A A . 4 GLN HA 1 1
14 3151 1 1 4 GLN HB2 H 0.844 9.218 2.139 1.00 . A A . 4 GLN HB2 1 1
14 3152 1 1 4 GLN HB3 H 1.905 8.103 2.975 1.00 . A A . 4 GLN HB3 1 1
14 3153 1 1 4 GLN HE21 H 4.895 10.080 3.062 1.00 . A A . 4 GLN HE21 1 1
14 3154 1 1 4 GLN HE22 H 4.329 11.772 3.488 1.00 . A A . 4 GLN HE22 1 1
14 3155 1 1 4 GLN HG2 H 3.852 8.690 1.675 1.00 . A A . 4 GLN HG2 1 1
14 3156 1 1 4 GLN HG3 H 2.921 9.571 0.481 1.00 . A A . 4 GLN HG3 1 1
14 3157 1 1 4 GLN N N 0.675 8.065 -0.225 1.00 . A A . 4 GLN N 1 1
14 3158 1 1 4 GLN NE2 N 4.221 10.852 3.046 1.00 . A A . 4 GLN NE2 1 1
14 3159 1 1 4 GLN O O 1.150 5.248 1.903 1.00 . A A . 4 GLN O 1 1
14 3160 1 1 4 GLN OE1 O 2.306 11.581 2.202 1.00 . A A . 4 GLN OE1 1 1
14 3161 1 1 5 . C C -1.561 4.011 1.318 1.00 . A A . 5 DIV C 1 1
14 3162 1 1 5 . CA C -1.718 5.299 2.231 1.00 . A A . 5 DIV CA 1 1
14 3163 1 1 5 . CB1 C -1.475 5.031 3.767 1.00 . A A . 5 DIV CB1 1 1
14 3164 1 1 5 . CB2 C -3.154 5.876 2.054 1.00 . A A . 5 DIV CB2 1 1
14 3165 1 1 5 . CG1 C -2.437 4.091 4.523 1.00 . A A . 5 DIV CG1 1 1
14 3166 1 1 5 . H H -1.158 7.320 1.497 1.00 . A A . 5 DIV H 1 1
14 3167 1 1 5 . HB11 H -0.453 4.632 3.908 1.00 . A A . 5 DIV HB11 1 1
14 3168 1 1 5 . HB12 H -1.466 5.990 4.321 1.00 . A A . 5 DIV HB12 1 1
14 3169 1 1 5 . HB21 H -3.373 6.167 1.012 1.00 . A A . 5 DIV HB21 1 1
14 3170 1 1 5 . HB22 H -3.931 5.136 2.323 1.00 . A A . 5 DIV HB22 1 1
14 3171 1 1 5 . HB23 H -3.339 6.772 2.678 1.00 . A A . 5 DIV HB23 1 1
14 3172 1 1 5 . HG11 H -2.536 3.104 4.038 1.00 . A A . 5 DIV HG11 1 1
14 3173 1 1 5 . HG12 H -2.082 3.907 5.552 1.00 . A A . 5 DIV HG12 1 1
14 3174 1 1 5 . HG13 H -3.451 4.519 4.608 1.00 . A A . 5 DIV HG13 1 1
14 3175 1 1 5 . N N -0.796 6.412 1.807 1.00 . A A . 5 DIV N 1 1
14 3176 1 1 5 . O O -1.299 2.917 1.828 1.00 . A A . 5 DIV O 1 1
14 3177 1 1 6 ILE C C -0.040 2.457 -1.108 1.00 . A A . 6 ILE C 1 1
14 3178 1 1 6 ILE CA C -1.494 3.011 -0.984 1.00 . A A . 6 ILE CA 1 1
14 3179 1 1 6 ILE CB C -2.228 3.267 -2.349 1.00 . A A . 6 ILE CB 1 1
14 3180 1 1 6 ILE CD1 C -3.475 2.034 -4.299 1.00 . A A . 6 ILE CD1 1 1
14 3181 1 1 6 ILE CG1 C -2.474 1.943 -3.134 1.00 . A A . 6 ILE CG1 1 1
14 3182 1 1 6 ILE CG2 C -1.550 4.337 -3.240 1.00 . A A . 6 ILE CG2 1 1
14 3183 1 1 6 ILE H H -1.890 5.066 -0.388 1.00 . A A . 6 ILE H 1 1
14 3184 1 1 6 ILE HA H -2.079 2.211 -0.509 1.00 . A A . 6 ILE HA 1 1
14 3185 1 1 6 ILE HB H -3.232 3.661 -2.095 1.00 . A A . 6 ILE HB 1 1
14 3186 1 1 6 ILE HD11 H -3.142 2.743 -5.079 1.00 . A A . 6 ILE HD11 1 1
14 3187 1 1 6 ILE HD12 H -3.601 1.053 -4.790 1.00 . A A . 6 ILE HD12 1 1
14 3188 1 1 6 ILE HD13 H -4.472 2.362 -3.951 1.00 . A A . 6 ILE HD13 1 1
14 3189 1 1 6 ILE HG12 H -1.514 1.542 -3.512 1.00 . A A . 6 ILE HG12 1 1
14 3190 1 1 6 ILE HG13 H -2.850 1.169 -2.438 1.00 . A A . 6 ILE HG13 1 1
14 3191 1 1 6 ILE HG21 H -0.595 3.983 -3.672 1.00 . A A . 6 ILE HG21 1 1
14 3192 1 1 6 ILE HG22 H -2.199 4.648 -4.080 1.00 . A A . 6 ILE HG22 1 1
14 3193 1 1 6 ILE HG23 H -1.325 5.244 -2.661 1.00 . A A . 6 ILE HG23 1 1
14 3194 1 1 6 ILE N N -1.659 4.139 -0.033 1.00 . A A . 6 ILE N 1 1
14 3195 1 1 6 ILE O O 0.099 1.238 -1.083 1.00 . A A . 6 ILE O 1 1
14 3196 1 1 7 THR C C 2.926 2.007 -0.059 1.00 . A A . 7 THR C 1 1
14 3197 1 1 7 THR CA C 2.435 2.818 -1.309 1.00 . A A . 7 THR CA 1 1
14 3198 1 1 7 THR CB C 3.373 4.007 -1.686 1.00 . A A . 7 THR CB 1 1
14 3199 1 1 7 THR CG2 C 4.855 3.638 -1.892 1.00 . A A . 7 THR CG2 1 1
14 3200 1 1 7 THR H H 0.776 4.290 -1.205 1.00 . A A . 7 THR H 1 1
14 3201 1 1 7 THR HA H 2.475 2.115 -2.164 1.00 . A A . 7 THR HA 1 1
14 3202 1 1 7 THR HB H 3.319 4.779 -0.892 1.00 . A A . 7 THR HB 1 1
14 3203 1 1 7 THR HG1 H 3.486 5.375 -3.035 1.00 . A A . 7 THR HG1 1 1
14 3204 1 1 7 THR HG21 H 5.448 4.515 -2.214 1.00 . A A . 7 THR HG21 1 1
14 3205 1 1 7 THR HG22 H 5.321 3.264 -0.961 1.00 . A A . 7 THR HG22 1 1
14 3206 1 1 7 THR HG23 H 4.978 2.853 -2.661 1.00 . A A . 7 THR HG23 1 1
14 3207 1 1 7 THR N N 1.015 3.294 -1.219 1.00 . A A . 7 THR N 1 1
14 3208 1 1 7 THR O O 3.538 0.950 -0.229 1.00 . A A . 7 THR O 1 1
14 3209 1 1 7 THR OG1 O 2.939 4.596 -2.910 1.00 . A A . 7 THR OG1 1 1
14 3210 1 1 8 ABA C C 1.921 0.326 2.446 1.00 . A A . 8 AIB C 1 1
14 3211 1 1 8 ABA CA C 2.732 1.684 2.441 1.00 . A A . 8 AIB CA 1 1
14 3212 1 1 8 ABA H H 1.964 3.258 1.104 1.00 . A A . 8 AIB H 1 1
14 3213 1 1 8 ABA N N 2.620 2.477 1.170 1.00 . A A . 8 AIB N 1 1
14 3214 1 1 8 ABA O O 2.371 -0.671 3.020 1.00 . A A . 8 AIB O 1 1
14 3215 1 1 9 LEU C C 0.462 -1.814 0.340 1.00 . A A . 9 LEU C 1 1
14 3216 1 1 9 LEU CA C -0.029 -0.965 1.554 1.00 . A A . 9 LEU CA 1 1
14 3217 1 1 9 LEU CB C -1.536 -0.611 1.374 1.00 . A A . 9 LEU CB 1 1
14 3218 1 1 9 LEU CD1 C -3.717 0.306 2.297 1.00 . A A . 9 LEU CD1 1 1
14 3219 1 1 9 LEU CD2 C -2.593 -1.592 3.517 1.00 . A A . 9 LEU CD2 1 1
14 3220 1 1 9 LEU CG C -2.360 -0.328 2.662 1.00 . A A . 9 LEU CG 1 1
14 3221 1 1 9 LEU H H 0.482 1.092 1.236 1.00 . A A . 9 LEU H 1 1
14 3222 1 1 9 LEU HA H 0.070 -1.607 2.442 1.00 . A A . 9 LEU HA 1 1
14 3223 1 1 9 LEU HB2 H -1.616 0.253 0.686 1.00 . A A . 9 LEU HB2 1 1
14 3224 1 1 9 LEU HB3 H -2.046 -1.418 0.817 1.00 . A A . 9 LEU HB3 1 1
14 3225 1 1 9 LEU HD11 H -4.336 -0.368 1.674 1.00 . A A . 9 LEU HD11 1 1
14 3226 1 1 9 LEU HD12 H -4.307 0.555 3.198 1.00 . A A . 9 LEU HD12 1 1
14 3227 1 1 9 LEU HD13 H -3.588 1.246 1.731 1.00 . A A . 9 LEU HD13 1 1
14 3228 1 1 9 LEU HD21 H -1.647 -2.034 3.879 1.00 . A A . 9 LEU HD21 1 1
14 3229 1 1 9 LEU HD22 H -3.195 -1.368 4.417 1.00 . A A . 9 LEU HD22 1 1
14 3230 1 1 9 LEU HD23 H -3.129 -2.381 2.958 1.00 . A A . 9 LEU HD23 1 1
14 3231 1 1 9 LEU HG H -1.812 0.406 3.280 1.00 . A A . 9 LEU HG 1 1
14 3232 1 1 9 LEU N N 0.723 0.282 1.812 1.00 . A A . 9 LEU N 1 1
14 3233 1 1 9 LEU O O 0.059 -2.975 0.279 1.00 . A A . 9 LEU O 1 1
14 3234 1 1 10 ABA C C 2.444 -3.471 -1.495 1.00 . A A . 10 AIB C 1 1
14 3235 1 1 10 ABA CA C 1.775 -2.057 -1.816 1.00 . A A . 10 AIB CA 1 1
14 3236 1 1 10 ABA H H 1.626 -0.345 -0.401 1.00 . A A . 10 AIB H 1 1
14 3237 1 1 10 ABA N N 1.283 -1.298 -0.617 1.00 . A A . 10 AIB N 1 1
14 3238 1 1 10 ABA O O 1.996 -4.467 -2.078 1.00 . A A . 10 AIB O 1 1
14 3239 1 1 11 HYP C C 2.901 -5.905 0.643 1.00 . A A . 11 HYP C 1 1
14 3240 1 1 11 HYP CA C 3.920 -5.017 -0.149 1.00 . A A . 11 HYP CA 1 1
14 3241 1 1 11 HYP CB C 5.168 -4.679 0.687 1.00 . A A . 11 HYP CB 1 1
14 3242 1 1 11 HYP CD C 3.981 -2.607 0.315 1.00 . A A . 11 HYP CD 1 1
14 3243 1 1 11 HYP CG C 4.850 -3.334 1.344 1.00 . A A . 11 HYP CG 1 1
14 3244 1 1 11 HYP HA H 4.244 -5.588 -1.040 1.00 . A A . 11 HYP HA 1 1
14 3245 1 1 11 HYP HB2 H 5.416 -5.455 1.436 1.00 . A A . 11 HYP HB2 1 1
14 3246 1 1 11 HYP HB3 H 6.056 -4.582 0.031 1.00 . A A . 11 HYP HB3 1 1
14 3247 1 1 11 HYP HD1 H 6.503 -3.114 2.306 1.00 . A A . 11 HYP HD1 1 1
14 3248 1 1 11 HYP HD22 H 3.179 -2.069 0.840 1.00 . A A . 11 HYP HD22 1 1
14 3249 1 1 11 HYP HD23 H 4.531 -1.859 -0.269 1.00 . A A . 11 HYP HD23 1 1
14 3250 1 1 11 HYP HG H 4.270 -3.506 2.271 1.00 . A A . 11 HYP HG 1 1
14 3251 1 1 11 HYP N N 3.451 -3.662 -0.572 1.00 . A A . 11 HYP N 1 1
14 3252 1 1 11 HYP O O 3.069 -7.126 0.679 1.00 . A A . 11 HYP O 1 1
14 3253 1 1 11 HYP OD1 O 6.027 -2.600 1.649 1.00 . A A . 11 HYP OD1 1 1
14 3254 1 1 12 GLN C C -0.589 -6.012 0.976 1.00 . A A . 12 GLN C 1 1
14 3255 1 1 12 GLN CA C 0.710 -5.973 1.858 1.00 . A A . 12 GLN CA 1 1
14 3256 1 1 12 GLN CB C 0.468 -5.344 3.264 1.00 . A A . 12 GLN CB 1 1
14 3257 1 1 12 GLN CD C 1.362 -4.910 5.663 1.00 . A A . 12 GLN CD 1 1
14 3258 1 1 12 GLN CG C 1.594 -5.592 4.303 1.00 . A A . 12 GLN CG 1 1
14 3259 1 1 12 GLN H H 1.777 -4.298 1.097 1.00 . A A . 12 GLN H 1 1
14 3260 1 1 12 GLN HA H 1.007 -7.004 2.013 1.00 . A A . 12 GLN HA 1 1
14 3261 1 1 12 GLN HB2 H 0.286 -4.255 3.154 1.00 . A A . 12 GLN HB2 1 1
14 3262 1 1 12 GLN HB3 H -0.469 -5.746 3.698 1.00 . A A . 12 GLN HB3 1 1
14 3263 1 1 12 GLN HE21 H 2.113 -6.507 6.606 1.00 . A A . 12 GLN HE21 1 1
14 3264 1 1 12 GLN HE22 H 1.553 -5.104 7.648 1.00 . A A . 12 GLN HE22 1 1
14 3265 1 1 12 GLN HG2 H 1.724 -6.685 4.424 1.00 . A A . 12 GLN HG2 1 1
14 3266 1 1 12 GLN HG3 H 2.559 -5.228 3.905 1.00 . A A . 12 GLN HG3 1 1
14 3267 1 1 12 GLN N N 1.859 -5.294 1.247 1.00 . A A . 12 GLN N 1 1
14 3268 1 1 12 GLN NE2 N 1.702 -5.579 6.751 1.00 . A A . 12 GLN NE2 1 1
14 3269 1 1 12 GLN O O -1.651 -6.278 1.538 1.00 . A A . 12 GLN O 1 1
14 3270 1 1 12 GLN OE1 O 0.909 -3.767 5.753 1.00 . A A . 12 GLN OE1 1 1
14 3271 1 1 13 ABA C C -1.321 -7.978 -1.511 1.00 . A A . 13 AIB C 1 1
14 3272 1 1 13 ABA CA C -1.533 -6.403 -1.353 1.00 . A A . 13 AIB CA 1 1
14 3273 1 1 13 ABA H H 0.375 -5.507 -0.729 1.00 . A A . 13 AIB H 1 1
14 3274 1 1 13 ABA N N -0.545 -5.825 -0.375 1.00 . A A . 13 AIB N 1 1
14 3275 1 1 13 ABA O O -2.303 -8.707 -1.324 1.00 . A A . 13 AIB O 1 1
14 3276 1 1 14 HYP C C -0.111 -10.944 -0.734 1.00 . A A . 14 HYP C 1 1
14 3277 1 1 14 HYP CA C 0.045 -10.056 -2.006 1.00 . A A . 14 HYP CA 1 1
14 3278 1 1 14 HYP CB C 1.444 -10.178 -2.645 1.00 . A A . 14 HYP CB 1 1
14 3279 1 1 14 HYP CD C 1.151 -7.865 -2.073 1.00 . A A . 14 HYP CD 1 1
14 3280 1 1 14 HYP CG C 2.210 -8.964 -2.118 1.00 . A A . 14 HYP CG 1 1
14 3281 1 1 14 HYP HA H -0.699 -10.411 -2.747 1.00 . A A . 14 HYP HA 1 1
14 3282 1 1 14 HYP HB2 H 1.961 -11.129 -2.409 1.00 . A A . 14 HYP HB2 1 1
14 3283 1 1 14 HYP HB3 H 1.365 -10.139 -3.748 1.00 . A A . 14 HYP HB3 1 1
14 3284 1 1 14 HYP HD1 H 2.897 -8.311 -3.788 1.00 . A A . 14 HYP HD1 1 1
14 3285 1 1 14 HYP HD22 H 1.406 -7.148 -1.285 1.00 . A A . 14 HYP HD22 1 1
14 3286 1 1 14 HYP HD23 H 1.104 -7.304 -3.020 1.00 . A A . 14 HYP HD23 1 1
14 3287 1 1 14 HYP HG H 2.572 -9.169 -1.090 1.00 . A A . 14 HYP HG 1 1
14 3288 1 1 14 HYP N N -0.117 -8.582 -1.822 1.00 . A A . 14 HYP N 1 1
14 3289 1 1 14 HYP O O -0.824 -11.948 -0.809 1.00 . A A . 14 HYP O 1 1
14 3290 1 1 14 HYP OD1 O 3.293 -8.604 -2.964 1.00 . A A . 14 HYP OD1 1 1
14 3291 1 1 15 ABA C C -0.993 -11.697 2.178 1.00 . A A . 15 AIB C 1 1
14 3292 1 1 15 ABA CA C 0.491 -11.369 1.692 1.00 . A A . 15 AIB CA 1 1
14 3293 1 1 15 ABA H H 1.077 -9.727 0.331 1.00 . A A . 15 AIB H 1 1
14 3294 1 1 15 ABA N N 0.551 -10.603 0.405 1.00 . A A . 15 AIB N 1 1
14 3295 1 1 15 ABA O O -1.272 -12.882 2.399 1.00 . A A . 15 AIB O 1 1
14 3296 1 1 16 PRO C C -4.213 -11.636 1.243 1.00 . A A . 16 PRO C 1 1
14 3297 1 1 16 PRO CA C -3.426 -11.139 2.502 1.00 . A A . 16 PRO CA 1 1
14 3298 1 1 16 PRO CB C -4.017 -9.849 3.101 1.00 . A A . 16 PRO CB 1 1
14 3299 1 1 16 PRO CD C -1.805 -9.306 2.259 1.00 . A A . 16 PRO CD 1 1
14 3300 1 1 16 PRO CG C -3.198 -8.713 2.495 1.00 . A A . 16 PRO CG 1 1
14 3301 1 1 16 PRO HA H -3.494 -11.930 3.274 1.00 . A A . 16 PRO HA 1 1
14 3302 1 1 16 PRO HB2 H -5.102 -9.726 2.915 1.00 . A A . 16 PRO HB2 1 1
14 3303 1 1 16 PRO HB3 H -3.890 -9.848 4.202 1.00 . A A . 16 PRO HB3 1 1
14 3304 1 1 16 PRO HD2 H -1.389 -8.962 1.297 1.00 . A A . 16 PRO HD2 1 1
14 3305 1 1 16 PRO HD3 H -1.110 -8.975 3.050 1.00 . A A . 16 PRO HD3 1 1
14 3306 1 1 16 PRO HG2 H -3.641 -8.397 1.531 1.00 . A A . 16 PRO HG2 1 1
14 3307 1 1 16 PRO HG3 H -3.175 -7.819 3.146 1.00 . A A . 16 PRO HG3 1 1
14 3308 1 1 16 PRO N N -2.000 -10.767 2.292 1.00 . A A . 16 PRO N 1 1
14 3309 1 1 16 PRO O O -5.032 -12.545 1.394 1.00 . A A . 16 PRO O 1 1
14 3310 1 1 17 PHL C C -3.999 -11.681 -2.354 1.00 . A A . 17 PHL C 1 1
14 3311 1 1 17 PHL CA C -4.876 -11.294 -1.143 1.00 . A A . 17 PHL CA 1 1
14 3312 1 1 17 PHL CB C -5.756 -10.048 -1.470 1.00 . A A . 17 PHL CB 1 1
14 3313 1 1 17 PHL CD1 C -7.859 -10.464 -0.081 1.00 . A A . 17 PHL CD1 1 1
14 3314 1 1 17 PHL CD2 C -6.589 -8.455 0.351 1.00 . A A . 17 PHL CD2 1 1
14 3315 1 1 17 PHL CE1 C -8.739 -10.129 0.945 1.00 . A A . 17 PHL CE1 1 1
14 3316 1 1 17 PHL CE2 C -7.474 -8.120 1.374 1.00 . A A . 17 PHL CE2 1 1
14 3317 1 1 17 PHL CG C -6.771 -9.635 -0.381 1.00 . A A . 17 PHL CG 1 1
14 3318 1 1 17 PHL CZ C -8.545 -8.956 1.672 1.00 . A A . 17 PHL CZ 1 1
14 3319 1 1 17 PHL H H -3.312 -10.282 0.040 1.00 . A A . 17 PHL H 1 1
14 3320 1 1 17 PHL HA H -5.559 -12.149 -0.963 1.00 . A A . 17 PHL HA 1 1
14 3321 1 1 17 PHL HB2 H -5.105 -9.193 -1.735 1.00 . A A . 17 PHL HB2 1 1
14 3322 1 1 17 PHL HB3 H -6.324 -10.247 -2.397 1.00 . A A . 17 PHL HB3 1 1
14 3323 1 1 17 PHL HC1 H -3.275 -10.884 -2.605 1.00 . A A . 17 PHL HC1 1 1
14 3324 1 1 17 PHL HC2 H -4.628 -11.807 -3.255 1.00 . A A . 17 PHL HC2 1 1
14 3325 1 1 17 PHL HD1 H -8.013 -11.383 -0.629 1.00 . A A . 17 PHL HD1 1 1
14 3326 1 1 17 PHL HD2 H -5.756 -7.799 0.141 1.00 . A A . 17 PHL HD2 1 1
14 3327 1 1 17 PHL HE1 H -9.565 -10.782 1.181 1.00 . A A . 17 PHL HE1 1 1
14 3328 1 1 17 PHL HE2 H -7.327 -7.212 1.942 1.00 . A A . 17 PHL HE2 1 1
14 3329 1 1 17 PHL HO H -3.979 -13.586 -2.070 1.00 . A A . 17 PHL HO 1 1
14 3330 1 1 17 PHL HZ H -9.227 -8.701 2.469 1.00 . A A . 17 PHL HZ 1 1
14 3331 1 1 17 PHL N N -4.016 -11.033 0.046 1.00 . A A . 17 PHL N 1 1
14 3332 1 1 17 PHL O O -3.307 -12.903 -2.127 1.00 . A A . 17 PHL O 1 1
15 3333 1 1 1 ACE C C -2.181 10.219 1.350 1.00 . A A . 1 ACE C 1 1
15 3334 1 1 1 ACE CH3 C -1.272 11.391 1.696 1.00 . A A . 1 ACE CH3 1 1
15 3335 1 1 1 ACE H1 H -1.848 12.271 2.029 1.00 . A A . 1 ACE H1 1 1
15 3336 1 1 1 ACE H2 H -0.562 11.118 2.496 1.00 . A A . 1 ACE H2 1 1
15 3337 1 1 1 ACE H3 H -0.666 11.687 0.816 1.00 . A A . 1 ACE H3 1 1
15 3338 1 1 1 ACE O O -2.127 9.168 1.991 1.00 . A A . 1 ACE O 1 1
15 3339 1 1 2 TRP C C -2.560 8.395 -1.266 1.00 . A A . 2 TRP C 1 1
15 3340 1 1 2 TRP CA C -3.581 9.284 -0.479 1.00 . A A . 2 TRP CA 1 1
15 3341 1 1 2 TRP CB C -4.697 9.793 -1.437 1.00 . A A . 2 TRP CB 1 1
15 3342 1 1 2 TRP CD1 C -6.211 11.887 -0.996 1.00 . A A . 2 TRP CD1 1 1
15 3343 1 1 2 TRP CD2 C -6.819 10.054 0.111 1.00 . A A . 2 TRP CD2 1 1
15 3344 1 1 2 TRP CE2 C -7.697 11.121 0.434 1.00 . A A . 2 TRP CE2 1 1
15 3345 1 1 2 TRP CE3 C -6.999 8.775 0.697 1.00 . A A . 2 TRP CE3 1 1
15 3346 1 1 2 TRP CG C -5.876 10.532 -0.785 1.00 . A A . 2 TRP CG 1 1
15 3347 1 1 2 TRP CH2 C -8.913 9.652 1.925 1.00 . A A . 2 TRP CH2 1 1
15 3348 1 1 2 TRP CZ2 C -8.755 10.917 1.354 1.00 . A A . 2 TRP CZ2 1 1
15 3349 1 1 2 TRP CZ3 C -8.051 8.597 1.598 1.00 . A A . 2 TRP CZ3 1 1
15 3350 1 1 2 TRP H H -2.983 11.356 -0.096 1.00 . A A . 2 TRP H 1 1
15 3351 1 1 2 TRP HA H -4.067 8.643 0.271 1.00 . A A . 2 TRP HA 1 1
15 3352 1 1 2 TRP HB2 H -4.245 10.436 -2.218 1.00 . A A . 2 TRP HB2 1 1
15 3353 1 1 2 TRP HB3 H -5.116 8.935 -1.998 1.00 . A A . 2 TRP HB3 1 1
15 3354 1 1 2 TRP HD1 H -5.669 12.556 -1.648 1.00 . A A . 2 TRP HD1 1 1
15 3355 1 1 2 TRP HE1 H -7.813 13.182 -0.243 1.00 . A A . 2 TRP HE1 1 1
15 3356 1 1 2 TRP HE3 H -6.343 7.952 0.456 1.00 . A A . 2 TRP HE3 1 1
15 3357 1 1 2 TRP HH2 H -9.713 9.485 2.630 1.00 . A A . 2 TRP HH2 1 1
15 3358 1 1 2 TRP HZ2 H -9.428 11.721 1.613 1.00 . A A . 2 TRP HZ2 1 1
15 3359 1 1 2 TRP HZ3 H -8.201 7.629 2.052 1.00 . A A . 2 TRP HZ3 1 1
15 3360 1 1 2 TRP N N -2.955 10.405 0.272 1.00 . A A . 2 TRP N 1 1
15 3361 1 1 2 TRP NE1 N -7.343 12.271 -0.252 1.00 . A A . 2 TRP NE1 1 1
15 3362 1 1 2 TRP O O -2.712 7.170 -1.286 1.00 . A A . 2 TRP O 1 1
15 3363 1 1 3 ILE C C 0.482 7.487 -1.401 1.00 . A A . 3 ILE C 1 1
15 3364 1 1 3 ILE CA C -0.361 8.266 -2.469 1.00 . A A . 3 ILE CA 1 1
15 3365 1 1 3 ILE CB C 0.471 9.177 -3.452 1.00 . A A . 3 ILE CB 1 1
15 3366 1 1 3 ILE CD1 C 0.244 10.834 -5.496 1.00 . A A . 3 ILE CD1 1 1
15 3367 1 1 3 ILE CG1 C -0.392 9.728 -4.634 1.00 . A A . 3 ILE CG1 1 1
15 3368 1 1 3 ILE CG2 C 1.726 8.459 -4.027 1.00 . A A . 3 ILE CG2 1 1
15 3369 1 1 3 ILE H H -1.514 10.026 -1.783 1.00 . A A . 3 ILE H 1 1
15 3370 1 1 3 ILE HA H -0.812 7.479 -3.081 1.00 . A A . 3 ILE HA 1 1
15 3371 1 1 3 ILE HB H 0.841 10.042 -2.867 1.00 . A A . 3 ILE HB 1 1
15 3372 1 1 3 ILE HD11 H 1.119 10.469 -6.063 1.00 . A A . 3 ILE HD11 1 1
15 3373 1 1 3 ILE HD12 H -0.478 11.215 -6.240 1.00 . A A . 3 ILE HD12 1 1
15 3374 1 1 3 ILE HD13 H 0.572 11.694 -4.884 1.00 . A A . 3 ILE HD13 1 1
15 3375 1 1 3 ILE HG12 H -0.708 8.895 -5.290 1.00 . A A . 3 ILE HG12 1 1
15 3376 1 1 3 ILE HG13 H -1.336 10.151 -4.243 1.00 . A A . 3 ILE HG13 1 1
15 3377 1 1 3 ILE HG21 H 1.456 7.553 -4.601 1.00 . A A . 3 ILE HG21 1 1
15 3378 1 1 3 ILE HG22 H 2.318 9.107 -4.695 1.00 . A A . 3 ILE HG22 1 1
15 3379 1 1 3 ILE HG23 H 2.420 8.142 -3.227 1.00 . A A . 3 ILE HG23 1 1
15 3380 1 1 3 ILE N N -1.519 9.003 -1.879 1.00 . A A . 3 ILE N 1 1
15 3381 1 1 3 ILE O O 0.881 6.355 -1.674 1.00 . A A . 3 ILE O 1 1
15 3382 1 1 4 GLN C C 0.504 6.184 1.535 1.00 . A A . 4 GLN C 1 1
15 3383 1 1 4 GLN CA C 1.351 7.342 0.935 1.00 . A A . 4 GLN CA 1 1
15 3384 1 1 4 GLN CB C 1.793 8.314 2.059 1.00 . A A . 4 GLN CB 1 1
15 3385 1 1 4 GLN CD C 2.505 10.650 1.181 1.00 . A A . 4 GLN CD 1 1
15 3386 1 1 4 GLN CG C 2.955 9.270 1.699 1.00 . A A . 4 GLN CG 1 1
15 3387 1 1 4 GLN H H 0.279 8.977 -0.112 1.00 . A A . 4 GLN H 1 1
15 3388 1 1 4 GLN HA H 2.273 6.872 0.543 1.00 . A A . 4 GLN HA 1 1
15 3389 1 1 4 GLN HB2 H 0.924 8.873 2.462 1.00 . A A . 4 GLN HB2 1 1
15 3390 1 1 4 GLN HB3 H 2.146 7.712 2.919 1.00 . A A . 4 GLN HB3 1 1
15 3391 1 1 4 GLN HE21 H 2.901 10.121 -0.712 1.00 . A A . 4 GLN HE21 1 1
15 3392 1 1 4 GLN HE22 H 2.212 11.797 -0.439 1.00 . A A . 4 GLN HE22 1 1
15 3393 1 1 4 GLN HG2 H 3.554 9.424 2.618 1.00 . A A . 4 GLN HG2 1 1
15 3394 1 1 4 GLN HG3 H 3.651 8.766 0.999 1.00 . A A . 4 GLN HG3 1 1
15 3395 1 1 4 GLN N N 0.724 8.062 -0.210 1.00 . A A . 4 GLN N 1 1
15 3396 1 1 4 GLN NE2 N 2.571 10.889 -0.121 1.00 . A A . 4 GLN NE2 1 1
15 3397 1 1 4 GLN O O 1.076 5.128 1.810 1.00 . A A . 4 GLN O 1 1
15 3398 1 1 4 GLN OE1 O 2.089 11.514 1.953 1.00 . A A . 4 GLN OE1 1 1
15 3399 1 1 5 . C C -1.641 4.004 1.146 1.00 . A A . 5 DIV C 1 1
15 3400 1 1 5 . CA C -1.794 5.271 2.091 1.00 . A A . 5 DIV CA 1 1
15 3401 1 1 5 . CB1 C -1.598 4.965 3.625 1.00 . A A . 5 DIV CB1 1 1
15 3402 1 1 5 . CB2 C -3.212 5.884 1.908 1.00 . A A . 5 DIV CB2 1 1
15 3403 1 1 5 . CG1 C -2.608 4.035 4.334 1.00 . A A . 5 DIV CG1 1 1
15 3404 1 1 5 . H H -1.158 7.281 1.412 1.00 . A A . 5 DIV H 1 1
15 3405 1 1 5 . HB11 H -0.588 4.541 3.787 1.00 . A A . 5 DIV HB11 1 1
15 3406 1 1 5 . HB12 H -1.587 5.914 4.197 1.00 . A A . 5 DIV HB12 1 1
15 3407 1 1 5 . HB21 H -3.413 6.202 0.871 1.00 . A A . 5 DIV HB21 1 1
15 3408 1 1 5 . HB22 H -4.011 5.161 2.157 1.00 . A A . 5 DIV HB22 1 1
15 3409 1 1 5 . HB23 H -3.379 6.771 2.549 1.00 . A A . 5 DIV HB23 1 1
15 3410 1 1 5 . HG11 H -2.736 3.071 3.809 1.00 . A A . 5 DIV HG11 1 1
15 3411 1 1 5 . HG12 H -2.278 3.805 5.363 1.00 . A A . 5 DIV HG12 1 1
15 3412 1 1 5 . HG13 H -3.605 4.505 4.415 1.00 . A A . 5 DIV HG13 1 1
15 3413 1 1 5 . N N -0.829 6.359 1.715 1.00 . A A . 5 DIV N 1 1
15 3414 1 1 5 . O O -1.410 2.896 1.639 1.00 . A A . 5 DIV O 1 1
15 3415 1 1 6 ILE C C 0.001 2.506 -1.217 1.00 . A A . 6 ILE C 1 1
15 3416 1 1 6 ILE CA C -1.463 3.055 -1.169 1.00 . A A . 6 ILE CA 1 1
15 3417 1 1 6 ILE CB C -2.146 3.284 -2.562 1.00 . A A . 6 ILE CB 1 1
15 3418 1 1 6 ILE CD1 C -3.354 1.963 -4.475 1.00 . A A . 6 ILE CD1 1 1
15 3419 1 1 6 ILE CG1 C -2.284 1.958 -3.373 1.00 . A A . 6 ILE CG1 1 1
15 3420 1 1 6 ILE CG2 C -1.498 4.400 -3.416 1.00 . A A . 6 ILE CG2 1 1
15 3421 1 1 6 ILE H H -1.949 5.100 -0.545 1.00 . A A . 6 ILE H 1 1
15 3422 1 1 6 ILE HA H -2.060 2.245 -0.729 1.00 . A A . 6 ILE HA 1 1
15 3423 1 1 6 ILE HB H -3.179 3.618 -2.342 1.00 . A A . 6 ILE HB 1 1
15 3424 1 1 6 ILE HD11 H -3.148 2.717 -5.257 1.00 . A A . 6 ILE HD11 1 1
15 3425 1 1 6 ILE HD12 H -3.408 0.981 -4.978 1.00 . A A . 6 ILE HD12 1 1
15 3426 1 1 6 ILE HD13 H -4.358 2.173 -4.062 1.00 . A A . 6 ILE HD13 1 1
15 3427 1 1 6 ILE HG12 H -1.308 1.674 -3.810 1.00 . A A . 6 ILE HG12 1 1
15 3428 1 1 6 ILE HG13 H -2.534 1.126 -2.685 1.00 . A A . 6 ILE HG13 1 1
15 3429 1 1 6 ILE HG21 H -0.471 4.140 -3.736 1.00 . A A . 6 ILE HG21 1 1
15 3430 1 1 6 ILE HG22 H -2.080 4.611 -4.330 1.00 . A A . 6 ILE HG22 1 1
15 3431 1 1 6 ILE HG23 H -1.435 5.348 -2.855 1.00 . A A . 6 ILE HG23 1 1
15 3432 1 1 6 ILE N N -1.693 4.170 -0.208 1.00 . A A . 6 ILE N 1 1
15 3433 1 1 6 ILE O O 0.148 1.289 -1.185 1.00 . A A . 6 ILE O 1 1
15 3434 1 1 7 THR C C 2.928 2.024 -0.063 1.00 . A A . 7 THR C 1 1
15 3435 1 1 7 THR CA C 2.488 2.877 -1.305 1.00 . A A . 7 THR CA 1 1
15 3436 1 1 7 THR CB C 3.448 4.082 -1.575 1.00 . A A . 7 THR CB 1 1
15 3437 1 1 7 THR CG2 C 4.931 3.706 -1.764 1.00 . A A . 7 THR CG2 1 1
15 3438 1 1 7 THR H H 0.815 4.340 -1.311 1.00 . A A . 7 THR H 1 1
15 3439 1 1 7 THR HA H 2.573 2.211 -2.187 1.00 . A A . 7 THR HA 1 1
15 3440 1 1 7 THR HB H 3.378 4.792 -0.728 1.00 . A A . 7 THR HB 1 1
15 3441 1 1 7 THR HG1 H 3.625 5.549 -2.805 1.00 . A A . 7 THR HG1 1 1
15 3442 1 1 7 THR HG21 H 5.547 4.597 -1.982 1.00 . A A . 7 THR HG21 1 1
15 3443 1 1 7 THR HG22 H 5.356 3.235 -0.858 1.00 . A A . 7 THR HG22 1 1
15 3444 1 1 7 THR HG23 H 5.067 2.997 -2.600 1.00 . A A . 7 THR HG23 1 1
15 3445 1 1 7 THR N N 1.061 3.345 -1.272 1.00 . A A . 7 THR N 1 1
15 3446 1 1 7 THR O O 3.528 0.962 -0.239 1.00 . A A . 7 THR O 1 1
15 3447 1 1 7 THR OG1 O 3.060 4.774 -2.758 1.00 . A A . 7 THR OG1 1 1
15 3448 1 1 8 ABA C C 1.840 0.309 2.379 1.00 . A A . 8 AIB C 1 1
15 3449 1 1 8 ABA CA C 2.658 1.661 2.425 1.00 . A A . 8 AIB CA 1 1
15 3450 1 1 8 ABA H H 1.984 3.289 1.091 1.00 . A A . 8 AIB H 1 1
15 3451 1 1 8 ABA N N 2.601 2.477 1.164 1.00 . A A . 8 AIB N 1 1
15 3452 1 1 8 ABA O O 2.274 -0.705 2.938 1.00 . A A . 8 AIB O 1 1
15 3453 1 1 9 LEU C C 0.469 -1.800 0.227 1.00 . A A . 9 LEU C 1 1
15 3454 1 1 9 LEU CA C -0.085 -0.950 1.409 1.00 . A A . 9 LEU CA 1 1
15 3455 1 1 9 LEU CB C -1.579 -0.601 1.150 1.00 . A A . 9 LEU CB 1 1
15 3456 1 1 9 LEU CD1 C -3.840 0.200 1.962 1.00 . A A . 9 LEU CD1 1 1
15 3457 1 1 9 LEU CD2 C -2.737 -1.731 3.161 1.00 . A A . 9 LEU CD2 1 1
15 3458 1 1 9 LEU CG C -2.491 -0.412 2.392 1.00 . A A . 9 LEU CG 1 1
15 3459 1 1 9 LEU H H 0.441 1.113 1.146 1.00 . A A . 9 LEU H 1 1
15 3460 1 1 9 LEU HA H -0.033 -1.594 2.298 1.00 . A A . 9 LEU HA 1 1
15 3461 1 1 9 LEU HB2 H -1.633 0.297 0.507 1.00 . A A . 9 LEU HB2 1 1
15 3462 1 1 9 LEU HB3 H -2.041 -1.384 0.523 1.00 . A A . 9 LEU HB3 1 1
15 3463 1 1 9 LEU HD11 H -4.393 -0.458 1.263 1.00 . A A . 9 LEU HD11 1 1
15 3464 1 1 9 LEU HD12 H -4.502 0.391 2.827 1.00 . A A . 9 LEU HD12 1 1
15 3465 1 1 9 LEU HD13 H -3.700 1.172 1.450 1.00 . A A . 9 LEU HD13 1 1
15 3466 1 1 9 LEU HD21 H -1.803 -2.145 3.585 1.00 . A A . 9 LEU HD21 1 1
15 3467 1 1 9 LEU HD22 H -3.429 -1.588 4.011 1.00 . A A . 9 LEU HD22 1 1
15 3468 1 1 9 LEU HD23 H -3.174 -2.515 2.513 1.00 . A A . 9 LEU HD23 1 1
15 3469 1 1 9 LEU HG H -2.010 0.307 3.084 1.00 . A A . 9 LEU HG 1 1
15 3470 1 1 9 LEU N N 0.658 0.289 1.715 1.00 . A A . 9 LEU N 1 1
15 3471 1 1 9 LEU O O 0.099 -2.972 0.176 1.00 . A A . 9 LEU O 1 1
15 3472 1 1 10 ABA C C 2.488 -3.447 -1.547 1.00 . A A . 10 AIB C 1 1
15 3473 1 1 10 ABA CA C 1.822 -2.039 -1.899 1.00 . A A . 10 AIB CA 1 1
15 3474 1 1 10 ABA H H 1.627 -0.313 -0.492 1.00 . A A . 10 AIB H 1 1
15 3475 1 1 10 ABA N N 1.305 -1.274 -0.712 1.00 . A A . 10 AIB N 1 1
15 3476 1 1 10 ABA O O 2.013 -4.461 -2.078 1.00 . A A . 10 AIB O 1 1
15 3477 1 1 11 HYP C C 2.951 -5.811 0.662 1.00 . A A . 11 HYP C 1 1
15 3478 1 1 11 HYP CA C 3.967 -4.961 -0.178 1.00 . A A . 11 HYP CA 1 1
15 3479 1 1 11 HYP CB C 5.233 -4.607 0.626 1.00 . A A . 11 HYP CB 1 1
15 3480 1 1 11 HYP CD C 4.032 -2.544 0.231 1.00 . A A . 11 HYP CD 1 1
15 3481 1 1 11 HYP CG C 4.934 -3.243 1.255 1.00 . A A . 11 HYP CG 1 1
15 3482 1 1 11 HYP HA H 4.267 -5.566 -1.055 1.00 . A A . 11 HYP HA 1 1
15 3483 1 1 11 HYP HB2 H 5.500 -5.371 1.381 1.00 . A A . 11 HYP HB2 1 1
15 3484 1 1 11 HYP HB3 H 6.102 -4.528 -0.058 1.00 . A A . 11 HYP HB3 1 1
15 3485 1 1 11 HYP HD1 H 6.658 -3.055 2.085 1.00 . A A . 11 HYP HD1 1 1
15 3486 1 1 11 HYP HD22 H 3.218 -2.022 0.759 1.00 . A A . 11 HYP HD22 1 1
15 3487 1 1 11 HYP HD23 H 4.557 -1.788 -0.364 1.00 . A A . 11 HYP HD23 1 1
15 3488 1 1 11 HYP HG H 4.376 -3.387 2.204 1.00 . A A . 11 HYP HG 1 1
15 3489 1 1 11 HYP N N 3.509 -3.615 -0.641 1.00 . A A . 11 HYP N 1 1
15 3490 1 1 11 HYP O O 3.114 -7.031 0.755 1.00 . A A . 11 HYP O 1 1
15 3491 1 1 11 HYP OD1 O 6.125 -2.507 1.503 1.00 . A A . 11 HYP OD1 1 1
15 3492 1 1 12 GLN C C -0.486 -6.053 1.042 1.00 . A A . 12 GLN C 1 1
15 3493 1 1 12 GLN CA C 0.786 -5.803 1.925 1.00 . A A . 12 GLN CA 1 1
15 3494 1 1 12 GLN CB C 0.467 -4.946 3.185 1.00 . A A . 12 GLN CB 1 1
15 3495 1 1 12 GLN CD C 1.285 -3.977 5.421 1.00 . A A . 12 GLN CD 1 1
15 3496 1 1 12 GLN CG C 1.517 -5.026 4.321 1.00 . A A . 12 GLN CG 1 1
15 3497 1 1 12 GLN H H 1.872 -4.169 1.098 1.00 . A A . 12 GLN H 1 1
15 3498 1 1 12 GLN HA H 1.138 -6.772 2.268 1.00 . A A . 12 GLN HA 1 1
15 3499 1 1 12 GLN HB2 H 0.309 -3.891 2.885 1.00 . A A . 12 GLN HB2 1 1
15 3500 1 1 12 GLN HB3 H -0.500 -5.259 3.621 1.00 . A A . 12 GLN HB3 1 1
15 3501 1 1 12 GLN HE21 H 2.974 -3.031 4.901 1.00 . A A . 12 GLN HE21 1 1
15 3502 1 1 12 GLN HE22 H 2.004 -2.314 6.285 1.00 . A A . 12 GLN HE22 1 1
15 3503 1 1 12 GLN HG2 H 1.488 -6.032 4.779 1.00 . A A . 12 GLN HG2 1 1
15 3504 1 1 12 GLN HG3 H 2.542 -4.931 3.908 1.00 . A A . 12 GLN HG3 1 1
15 3505 1 1 12 GLN N N 1.919 -5.168 1.243 1.00 . A A . 12 GLN N 1 1
15 3506 1 1 12 GLN NE2 N 2.173 -3.001 5.543 1.00 . A A . 12 GLN NE2 1 1
15 3507 1 1 12 GLN O O -1.468 -6.517 1.619 1.00 . A A . 12 GLN O 1 1
15 3508 1 1 12 GLN OE1 O 0.306 -4.030 6.164 1.00 . A A . 12 GLN OE1 1 1
15 3509 1 1 13 ABA C C -1.308 -8.009 -1.398 1.00 . A A . 13 AIB C 1 1
15 3510 1 1 13 ABA CA C -1.503 -6.429 -1.253 1.00 . A A . 13 AIB CA 1 1
15 3511 1 1 13 ABA H H 0.373 -5.421 -0.680 1.00 . A A . 13 AIB H 1 1
15 3512 1 1 13 ABA N N -0.509 -5.818 -0.303 1.00 . A A . 13 AIB N 1 1
15 3513 1 1 13 ABA O O -2.300 -8.727 -1.231 1.00 . A A . 13 AIB O 1 1
15 3514 1 1 14 HYP C C -0.108 -11.007 -0.644 1.00 . A A . 14 HYP C 1 1
15 3515 1 1 14 HYP CA C 0.048 -10.094 -1.898 1.00 . A A . 14 HYP CA 1 1
15 3516 1 1 14 HYP CB C 1.444 -10.212 -2.546 1.00 . A A . 14 HYP CB 1 1
15 3517 1 1 14 HYP CD C 1.167 -7.914 -1.931 1.00 . A A . 14 HYP CD 1 1
15 3518 1 1 14 HYP CG C 2.221 -9.017 -1.997 1.00 . A A . 14 HYP CG 1 1
15 3519 1 1 14 HYP HA H -0.695 -10.424 -2.648 1.00 . A A . 14 HYP HA 1 1
15 3520 1 1 14 HYP HB2 H 1.957 -11.172 -2.337 1.00 . A A . 14 HYP HB2 1 1
15 3521 1 1 14 HYP HB3 H 1.356 -10.140 -3.647 1.00 . A A . 14 HYP HB3 1 1
15 3522 1 1 14 HYP HD1 H 2.911 -8.318 -3.646 1.00 . A A . 14 HYP HD1 1 1
15 3523 1 1 14 HYP HD22 H 1.431 -7.212 -1.129 1.00 . A A . 14 HYP HD22 1 1
15 3524 1 1 14 HYP HD23 H 1.129 -7.334 -2.867 1.00 . A A . 14 HYP HD23 1 1
15 3525 1 1 14 HYP HG H 2.580 -9.234 -0.968 1.00 . A A . 14 HYP HG 1 1
15 3526 1 1 14 HYP N N -0.106 -8.624 -1.690 1.00 . A A . 14 HYP N 1 1
15 3527 1 1 14 HYP O O -0.803 -12.020 -0.747 1.00 . A A . 14 HYP O 1 1
15 3528 1 1 14 HYP OD1 O 3.307 -8.651 -2.837 1.00 . A A . 14 HYP OD1 1 1
15 3529 1 1 15 ABA C C -1.064 -11.796 2.235 1.00 . A A . 15 AIB C 1 1
15 3530 1 1 15 ABA CA C 0.431 -11.443 1.794 1.00 . A A . 15 AIB CA 1 1
15 3531 1 1 15 ABA H H 1.057 -9.796 0.462 1.00 . A A . 15 AIB H 1 1
15 3532 1 1 15 ABA N N 0.532 -10.675 0.510 1.00 . A A . 15 AIB N 1 1
15 3533 1 1 15 ABA O O -1.331 -12.979 2.475 1.00 . A A . 15 AIB O 1 1
15 3534 1 1 16 PRO C C -4.246 -11.789 1.161 1.00 . A A . 16 PRO C 1 1
15 3535 1 1 16 PRO CA C -3.523 -11.264 2.450 1.00 . A A . 16 PRO CA 1 1
15 3536 1 1 16 PRO CB C -4.148 -9.967 2.999 1.00 . A A . 16 PRO CB 1 1
15 3537 1 1 16 PRO CD C -1.918 -9.421 2.226 1.00 . A A . 16 PRO CD 1 1
15 3538 1 1 16 PRO CG C -3.324 -8.840 2.384 1.00 . A A . 16 PRO CG 1 1
15 3539 1 1 16 PRO HA H -3.617 -12.042 3.234 1.00 . A A . 16 PRO HA 1 1
15 3540 1 1 16 PRO HB2 H -5.229 -9.868 2.778 1.00 . A A . 16 PRO HB2 1 1
15 3541 1 1 16 PRO HB3 H -4.054 -9.938 4.100 1.00 . A A . 16 PRO HB3 1 1
15 3542 1 1 16 PRO HD2 H -1.472 -9.103 1.270 1.00 . A A . 16 PRO HD2 1 1
15 3543 1 1 16 PRO HD3 H -1.256 -9.058 3.030 1.00 . A A . 16 PRO HD3 1 1
15 3544 1 1 16 PRO HG2 H -3.733 -8.569 1.391 1.00 . A A . 16 PRO HG2 1 1
15 3545 1 1 16 PRO HG3 H -3.341 -7.922 2.999 1.00 . A A . 16 PRO HG3 1 1
15 3546 1 1 16 PRO N N -2.091 -10.883 2.292 1.00 . A A . 16 PRO N 1 1
15 3547 1 1 16 PRO O O -5.024 -12.737 1.285 1.00 . A A . 16 PRO O 1 1
15 3548 1 1 17 PHL C C -3.817 -11.697 -2.418 1.00 . A A . 17 PHL C 1 1
15 3549 1 1 17 PHL CA C -4.817 -11.499 -1.256 1.00 . A A . 17 PHL CA 1 1
15 3550 1 1 17 PHL CB C -5.864 -10.386 -1.558 1.00 . A A . 17 PHL CB 1 1
15 3551 1 1 17 PHL CD1 C -8.089 -11.260 -0.662 1.00 . A A . 17 PHL CD1 1 1
15 3552 1 1 17 PHL CD2 C -7.115 -9.320 0.402 1.00 . A A . 17 PHL CD2 1 1
15 3553 1 1 17 PHL CE1 C -9.157 -11.212 0.232 1.00 . A A . 17 PHL CE1 1 1
15 3554 1 1 17 PHL CE2 C -8.184 -9.274 1.293 1.00 . A A . 17 PHL CE2 1 1
15 3555 1 1 17 PHL CG C -7.056 -10.316 -0.581 1.00 . A A . 17 PHL CG 1 1
15 3556 1 1 17 PHL CZ C -9.204 -10.219 1.207 1.00 . A A . 17 PHL CZ 1 1
15 3557 1 1 17 PHL H H -3.380 -10.379 -0.015 1.00 . A A . 17 PHL H 1 1
15 3558 1 1 17 PHL HA H -5.352 -12.461 -1.138 1.00 . A A . 17 PHL HA 1 1
15 3559 1 1 17 PHL HB2 H -5.358 -9.399 -1.626 1.00 . A A . 17 PHL HB2 1 1
15 3560 1 1 17 PHL HB3 H -6.273 -10.540 -2.576 1.00 . A A . 17 PHL HB3 1 1
15 3561 1 1 17 PHL HC1 H -3.032 -12.420 -2.133 1.00 . A A . 17 PHL HC1 1 1
15 3562 1 1 17 PHL HC2 H -3.294 -10.756 -2.671 1.00 . A A . 17 PHL HC2 1 1
15 3563 1 1 17 PHL HD1 H -8.064 -12.038 -1.410 1.00 . A A . 17 PHL HD1 1 1
15 3564 1 1 17 PHL HD2 H -6.329 -8.585 0.485 1.00 . A A . 17 PHL HD2 1 1
15 3565 1 1 17 PHL HE1 H -9.947 -11.948 0.172 1.00 . A A . 17 PHL HE1 1 1
15 3566 1 1 17 PHL HE2 H -8.223 -8.507 2.055 1.00 . A A . 17 PHL HE2 1 1
15 3567 1 1 17 PHL HO H -5.004 -11.476 -3.915 1.00 . A A . 17 PHL HO 1 1
15 3568 1 1 17 PHL HZ H -10.033 -10.184 1.902 1.00 . A A . 17 PHL HZ 1 1
15 3569 1 1 17 PHL N N -4.045 -11.167 -0.027 1.00 . A A . 17 PHL N 1 1
15 3570 1 1 17 PHL O O -4.474 -12.200 -3.577 1.00 . A A . 17 PHL O 1 1
16 3571 1 1 1 ACE C C -2.159 10.636 0.937 1.00 . A A . 1 ACE C 1 1
16 3572 1 1 1 ACE CH3 C -1.493 12.006 0.985 1.00 . A A . 1 ACE CH3 1 1
16 3573 1 1 1 ACE H1 H -1.084 12.275 -0.008 1.00 . A A . 1 ACE H1 1 1
16 3574 1 1 1 ACE H2 H -2.207 12.793 1.286 1.00 . A A . 1 ACE H2 1 1
16 3575 1 1 1 ACE H3 H -0.647 12.014 1.693 1.00 . A A . 1 ACE H3 1 1
16 3576 1 1 1 ACE O O -1.760 9.710 1.648 1.00 . A A . 1 ACE O 1 1
16 3577 1 1 2 TRP C C -2.631 8.320 -1.250 1.00 . A A . 2 TRP C 1 1
16 3578 1 1 2 TRP CA C -3.650 9.197 -0.444 1.00 . A A . 2 TRP CA 1 1
16 3579 1 1 2 TRP CB C -4.976 9.376 -1.243 1.00 . A A . 2 TRP CB 1 1
16 3580 1 1 2 TRP CD1 C -6.772 9.568 0.670 1.00 . A A . 2 TRP CD1 1 1
16 3581 1 1 2 TRP CD2 C -6.702 11.306 -0.721 1.00 . A A . 2 TRP CD2 1 1
16 3582 1 1 2 TRP CE2 C -7.659 11.548 0.299 1.00 . A A . 2 TRP CE2 1 1
16 3583 1 1 2 TRP CE3 C -6.460 12.283 -1.723 1.00 . A A . 2 TRP CE3 1 1
16 3584 1 1 2 TRP CG C -6.131 10.063 -0.488 1.00 . A A . 2 TRP CG 1 1
16 3585 1 1 2 TRP CH2 C -8.120 13.719 -0.665 1.00 . A A . 2 TRP CH2 1 1
16 3586 1 1 2 TRP CZ2 C -8.371 12.772 0.330 1.00 . A A . 2 TRP CZ2 1 1
16 3587 1 1 2 TRP CZ3 C -7.183 13.477 -1.677 1.00 . A A . 2 TRP CZ3 1 1
16 3588 1 1 2 TRP H H -3.412 11.381 -0.445 1.00 . A A . 2 TRP H 1 1
16 3589 1 1 2 TRP HA H -3.906 8.634 0.468 1.00 . A A . 2 TRP HA 1 1
16 3590 1 1 2 TRP HB2 H -4.769 9.917 -2.187 1.00 . A A . 2 TRP HB2 1 1
16 3591 1 1 2 TRP HB3 H -5.340 8.383 -1.569 1.00 . A A . 2 TRP HB3 1 1
16 3592 1 1 2 TRP HD1 H -6.533 8.626 1.142 1.00 . A A . 2 TRP HD1 1 1
16 3593 1 1 2 TRP HE1 H -8.300 10.381 2.015 1.00 . A A . 2 TRP HE1 1 1
16 3594 1 1 2 TRP HE3 H -5.738 12.114 -2.509 1.00 . A A . 2 TRP HE3 1 1
16 3595 1 1 2 TRP HH2 H -8.656 14.657 -0.652 1.00 . A A . 2 TRP HH2 1 1
16 3596 1 1 2 TRP HZ2 H -9.091 12.978 1.109 1.00 . A A . 2 TRP HZ2 1 1
16 3597 1 1 2 TRP HZ3 H -7.016 14.229 -2.435 1.00 . A A . 2 TRP HZ3 1 1
16 3598 1 1 2 TRP N N -3.128 10.517 0.019 1.00 . A A . 2 TRP N 1 1
16 3599 1 1 2 TRP NE1 N -7.722 10.475 1.173 1.00 . A A . 2 TRP NE1 1 1
16 3600 1 1 2 TRP O O -2.759 7.092 -1.244 1.00 . A A . 2 TRP O 1 1
16 3601 1 1 3 ILE C C 0.435 7.467 -1.391 1.00 . A A . 3 ILE C 1 1
16 3602 1 1 3 ILE CA C -0.436 8.198 -2.466 1.00 . A A . 3 ILE CA 1 1
16 3603 1 1 3 ILE CB C 0.388 9.109 -3.454 1.00 . A A . 3 ILE CB 1 1
16 3604 1 1 3 ILE CD1 C -1.262 8.886 -5.511 1.00 . A A . 3 ILE CD1 1 1
16 3605 1 1 3 ILE CG1 C -0.447 9.803 -4.579 1.00 . A A . 3 ILE CG1 1 1
16 3606 1 1 3 ILE CG2 C 1.602 8.391 -4.098 1.00 . A A . 3 ILE CG2 1 1
16 3607 1 1 3 ILE H H -1.620 9.950 -1.834 1.00 . A A . 3 ILE H 1 1
16 3608 1 1 3 ILE HA H -0.865 7.394 -3.068 1.00 . A A . 3 ILE HA 1 1
16 3609 1 1 3 ILE HB H 0.814 9.928 -2.844 1.00 . A A . 3 ILE HB 1 1
16 3610 1 1 3 ILE HD11 H -2.004 8.287 -4.952 1.00 . A A . 3 ILE HD11 1 1
16 3611 1 1 3 ILE HD12 H -1.823 9.479 -6.257 1.00 . A A . 3 ILE HD12 1 1
16 3612 1 1 3 ILE HD13 H -0.618 8.184 -6.070 1.00 . A A . 3 ILE HD13 1 1
16 3613 1 1 3 ILE HG12 H -1.141 10.528 -4.116 1.00 . A A . 3 ILE HG12 1 1
16 3614 1 1 3 ILE HG13 H 0.220 10.431 -5.200 1.00 . A A . 3 ILE HG13 1 1
16 3615 1 1 3 ILE HG21 H 1.295 7.500 -4.678 1.00 . A A . 3 ILE HG21 1 1
16 3616 1 1 3 ILE HG22 H 2.162 9.055 -4.784 1.00 . A A . 3 ILE HG22 1 1
16 3617 1 1 3 ILE HG23 H 2.331 8.049 -3.340 1.00 . A A . 3 ILE HG23 1 1
16 3618 1 1 3 ILE N N -1.610 8.927 -1.898 1.00 . A A . 3 ILE N 1 1
16 3619 1 1 3 ILE O O 0.829 6.322 -1.619 1.00 . A A . 3 ILE O 1 1
16 3620 1 1 4 GLN C C 0.568 6.274 1.578 1.00 . A A . 4 GLN C 1 1
16 3621 1 1 4 GLN CA C 1.363 7.445 0.931 1.00 . A A . 4 GLN CA 1 1
16 3622 1 1 4 GLN CB C 1.752 8.517 1.983 1.00 . A A . 4 GLN CB 1 1
16 3623 1 1 4 GLN CD C 2.864 10.847 1.906 1.00 . A A . 4 GLN CD 1 1
16 3624 1 1 4 GLN CG C 3.004 9.345 1.604 1.00 . A A . 4 GLN CG 1 1
16 3625 1 1 4 GLN H H 0.260 9.020 -0.179 1.00 . A A . 4 GLN H 1 1
16 3626 1 1 4 GLN HA H 2.302 6.997 0.559 1.00 . A A . 4 GLN HA 1 1
16 3627 1 1 4 GLN HB2 H 0.878 9.166 2.190 1.00 . A A . 4 GLN HB2 1 1
16 3628 1 1 4 GLN HB3 H 1.959 8.038 2.960 1.00 . A A . 4 GLN HB3 1 1
16 3629 1 1 4 GLN HE21 H 2.380 11.206 -0.009 1.00 . A A . 4 GLN HE21 1 1
16 3630 1 1 4 GLN HE22 H 2.437 12.646 1.125 1.00 . A A . 4 GLN HE22 1 1
16 3631 1 1 4 GLN HG2 H 3.872 8.937 2.156 1.00 . A A . 4 GLN HG2 1 1
16 3632 1 1 4 GLN HG3 H 3.273 9.189 0.540 1.00 . A A . 4 GLN HG3 1 1
16 3633 1 1 4 GLN N N 0.710 8.104 -0.239 1.00 . A A . 4 GLN N 1 1
16 3634 1 1 4 GLN NE2 N 2.523 11.647 0.906 1.00 . A A . 4 GLN NE2 1 1
16 3635 1 1 4 GLN O O 1.178 5.242 1.869 1.00 . A A . 4 GLN O 1 1
16 3636 1 1 4 GLN OE1 O 3.053 11.296 3.036 1.00 . A A . 4 GLN OE1 1 1
16 3637 1 1 5 . C C -1.536 4.021 1.243 1.00 . A A . 5 DIV C 1 1
16 3638 1 1 5 . CA C -1.692 5.294 2.181 1.00 . A A . 5 DIV CA 1 1
16 3639 1 1 5 . CB1 C -1.454 4.999 3.712 1.00 . A A . 5 DIV CB1 1 1
16 3640 1 1 5 . CB2 C -3.123 5.886 2.024 1.00 . A A . 5 DIV CB2 1 1
16 3641 1 1 5 . CG1 C -2.433 4.061 4.448 1.00 . A A . 5 DIV CG1 1 1
16 3642 1 1 5 . H H -1.132 7.319 1.470 1.00 . A A . 5 DIV H 1 1
16 3643 1 1 5 . HB11 H -0.437 4.588 3.848 1.00 . A A . 5 DIV HB11 1 1
16 3644 1 1 5 . HB12 H -1.438 5.950 4.279 1.00 . A A . 5 DIV HB12 1 1
16 3645 1 1 5 . HB21 H -3.345 6.206 0.991 1.00 . A A . 5 DIV HB21 1 1
16 3646 1 1 5 . HB22 H -3.904 5.149 2.286 1.00 . A A . 5 DIV HB22 1 1
16 3647 1 1 5 . HB23 H -3.290 6.770 2.670 1.00 . A A . 5 DIV HB23 1 1
16 3648 1 1 5 . HG11 H -2.566 3.096 3.929 1.00 . A A . 5 DIV HG11 1 1
16 3649 1 1 5 . HG12 H -2.072 3.835 5.466 1.00 . A A . 5 DIV HG12 1 1
16 3650 1 1 5 . HG13 H -3.433 4.518 4.559 1.00 . A A . 5 DIV HG13 1 1
16 3651 1 1 5 . N N -0.768 6.407 1.771 1.00 . A A . 5 DIV N 1 1
16 3652 1 1 5 . O O -1.249 2.927 1.739 1.00 . A A . 5 DIV O 1 1
16 3653 1 1 6 ILE C C 0.005 2.488 -1.186 1.00 . A A . 6 ILE C 1 1
16 3654 1 1 6 ILE CA C -1.457 3.023 -1.061 1.00 . A A . 6 ILE CA 1 1
16 3655 1 1 6 ILE CB C -2.212 3.228 -2.423 1.00 . A A . 6 ILE CB 1 1
16 3656 1 1 6 ILE CD1 C -3.084 0.752 -2.652 1.00 . A A . 6 ILE CD1 1 1
16 3657 1 1 6 ILE CG1 C -2.361 1.946 -3.298 1.00 . A A . 6 ILE CG1 1 1
16 3658 1 1 6 ILE CG2 C -1.623 4.355 -3.301 1.00 . A A . 6 ILE CG2 1 1
16 3659 1 1 6 ILE H H -1.950 5.072 -0.450 1.00 . A A . 6 ILE H 1 1
16 3660 1 1 6 ILE HA H -2.019 2.214 -0.577 1.00 . A A . 6 ILE HA 1 1
16 3661 1 1 6 ILE HB H -3.243 3.544 -2.170 1.00 . A A . 6 ILE HB 1 1
16 3662 1 1 6 ILE HD11 H -4.076 1.036 -2.255 1.00 . A A . 6 ILE HD11 1 1
16 3663 1 1 6 ILE HD12 H -3.244 -0.058 -3.388 1.00 . A A . 6 ILE HD12 1 1
16 3664 1 1 6 ILE HD13 H -2.501 0.313 -1.820 1.00 . A A . 6 ILE HD13 1 1
16 3665 1 1 6 ILE HG12 H -2.918 2.199 -4.219 1.00 . A A . 6 ILE HG12 1 1
16 3666 1 1 6 ILE HG13 H -1.368 1.607 -3.649 1.00 . A A . 6 ILE HG13 1 1
16 3667 1 1 6 ILE HG21 H -0.615 4.102 -3.682 1.00 . A A . 6 ILE HG21 1 1
16 3668 1 1 6 ILE HG22 H -2.262 4.572 -4.178 1.00 . A A . 6 ILE HG22 1 1
16 3669 1 1 6 ILE HG23 H -1.529 5.295 -2.736 1.00 . A A . 6 ILE HG23 1 1
16 3670 1 1 6 ILE N N -1.650 4.155 -0.109 1.00 . A A . 6 ILE N 1 1
16 3671 1 1 6 ILE O O 0.162 1.267 -1.192 1.00 . A A . 6 ILE O 1 1
16 3672 1 1 7 THR C C 2.952 2.026 -0.101 1.00 . A A . 7 THR C 1 1
16 3673 1 1 7 THR CA C 2.483 2.879 -1.334 1.00 . A A . 7 THR CA 1 1
16 3674 1 1 7 THR CB C 3.412 4.099 -1.634 1.00 . A A . 7 THR CB 1 1
16 3675 1 1 7 THR CG2 C 4.900 3.754 -1.846 1.00 . A A . 7 THR CG2 1 1
16 3676 1 1 7 THR H H 0.806 4.331 -1.236 1.00 . A A . 7 THR H 1 1
16 3677 1 1 7 THR HA H 2.553 2.213 -2.218 1.00 . A A . 7 THR HA 1 1
16 3678 1 1 7 THR HB H 3.345 4.820 -0.796 1.00 . A A . 7 THR HB 1 1
16 3679 1 1 7 THR HG1 H 3.511 5.566 -2.878 1.00 . A A . 7 THR HG1 1 1
16 3680 1 1 7 THR HG21 H 5.492 4.655 -2.092 1.00 . A A . 7 THR HG21 1 1
16 3681 1 1 7 THR HG22 H 5.355 3.311 -0.940 1.00 . A A . 7 THR HG22 1 1
16 3682 1 1 7 THR HG23 H 5.042 3.031 -2.672 1.00 . A A . 7 THR HG23 1 1
16 3683 1 1 7 THR N N 1.054 3.335 -1.262 1.00 . A A . 7 THR N 1 1
16 3684 1 1 7 THR O O 3.563 0.972 -0.289 1.00 . A A . 7 THR O 1 1
16 3685 1 1 7 THR OG1 O 2.984 4.766 -2.821 1.00 . A A . 7 THR OG1 1 1
16 3686 1 1 8 ABA C C 1.886 0.296 2.367 1.00 . A A . 8 AIB C 1 1
16 3687 1 1 8 ABA CA C 2.713 1.644 2.391 1.00 . A A . 8 AIB CA 1 1
16 3688 1 1 8 ABA H H 1.965 3.242 1.070 1.00 . A A . 8 AIB H 1 1
16 3689 1 1 8 ABA N N 2.626 2.464 1.136 1.00 . A A . 8 AIB N 1 1
16 3690 1 1 8 ABA O O 2.315 -0.711 2.946 1.00 . A A . 8 AIB O 1 1
16 3691 1 1 9 LEU C C 0.488 -1.829 0.240 1.00 . A A . 9 LEU C 1 1
16 3692 1 1 9 LEU CA C -0.048 -0.974 1.428 1.00 . A A . 9 LEU CA 1 1
16 3693 1 1 9 LEU CB C -1.543 -0.619 1.181 1.00 . A A . 9 LEU CB 1 1
16 3694 1 1 9 LEU CD1 C -3.777 0.272 1.967 1.00 . A A . 9 LEU CD1 1 1
16 3695 1 1 9 LEU CD2 C -2.694 -1.600 3.272 1.00 . A A . 9 LEU CD2 1 1
16 3696 1 1 9 LEU CG C -2.436 -0.338 2.421 1.00 . A A . 9 LEU CG 1 1
16 3697 1 1 9 LEU H H 0.480 1.083 1.132 1.00 . A A . 9 LEU H 1 1
16 3698 1 1 9 LEU HA H 0.013 -1.611 2.322 1.00 . A A . 9 LEU HA 1 1
16 3699 1 1 9 LEU HB2 H -1.588 0.244 0.491 1.00 . A A . 9 LEU HB2 1 1
16 3700 1 1 9 LEU HB3 H -2.029 -1.421 0.600 1.00 . A A . 9 LEU HB3 1 1
16 3701 1 1 9 LEU HD11 H -4.351 -0.421 1.322 1.00 . A A . 9 LEU HD11 1 1
16 3702 1 1 9 LEU HD12 H -4.423 0.532 2.827 1.00 . A A . 9 LEU HD12 1 1
16 3703 1 1 9 LEU HD13 H -3.627 1.203 1.390 1.00 . A A . 9 LEU HD13 1 1
16 3704 1 1 9 LEU HD21 H -1.760 -2.022 3.687 1.00 . A A . 9 LEU HD21 1 1
16 3705 1 1 9 LEU HD22 H -3.347 -1.381 4.138 1.00 . A A . 9 LEU HD22 1 1
16 3706 1 1 9 LEU HD23 H -3.183 -2.403 2.689 1.00 . A A . 9 LEU HD23 1 1
16 3707 1 1 9 LEU HG H -1.932 0.412 3.059 1.00 . A A . 9 LEU HG 1 1
16 3708 1 1 9 LEU N N 0.701 0.269 1.711 1.00 . A A . 9 LEU N 1 1
16 3709 1 1 9 LEU O O 0.095 -2.993 0.178 1.00 . A A . 9 LEU O 1 1
16 3710 1 1 10 ABA C C 2.521 -3.490 -1.519 1.00 . A A . 10 AIB C 1 1
16 3711 1 1 10 ABA CA C 1.861 -2.080 -1.874 1.00 . A A . 10 AIB CA 1 1
16 3712 1 1 10 ABA H H 1.673 -0.358 -0.467 1.00 . A A . 10 AIB H 1 1
16 3713 1 1 10 ABA N N 1.337 -1.312 -0.692 1.00 . A A . 10 AIB N 1 1
16 3714 1 1 10 ABA O O 2.077 -4.494 -2.093 1.00 . A A . 10 AIB O 1 1
16 3715 1 1 11 HYP C C 2.906 -5.872 0.709 1.00 . A A . 11 HYP C 1 1
16 3716 1 1 11 HYP CA C 3.943 -5.026 -0.107 1.00 . A A . 11 HYP CA 1 1
16 3717 1 1 11 HYP CB C 5.194 -4.689 0.723 1.00 . A A . 11 HYP CB 1 1
16 3718 1 1 11 HYP CD C 4.031 -2.604 0.300 1.00 . A A . 11 HYP CD 1 1
16 3719 1 1 11 HYP CG C 4.906 -3.317 1.338 1.00 . A A . 11 HYP CG 1 1
16 3720 1 1 11 HYP HA H 4.254 -5.628 -0.983 1.00 . A A . 11 HYP HA 1 1
16 3721 1 1 11 HYP HB2 H 5.432 -5.451 1.493 1.00 . A A . 11 HYP HB2 1 1
16 3722 1 1 11 HYP HB3 H 6.083 -4.630 0.062 1.00 . A A . 11 HYP HB3 1 1
16 3723 1 1 11 HYP HD1 H 6.597 -3.135 2.227 1.00 . A A . 11 HYP HD1 1 1
16 3724 1 1 11 HYP HD22 H 3.216 -2.072 0.811 1.00 . A A . 11 HYP HD22 1 1
16 3725 1 1 11 HYP HD23 H 4.582 -1.858 -0.289 1.00 . A A . 11 HYP HD23 1 1
16 3726 1 1 11 HYP HG H 4.338 -3.448 2.281 1.00 . A A . 11 HYP HG 1 1
16 3727 1 1 11 HYP N N 3.505 -3.673 -0.571 1.00 . A A . 11 HYP N 1 1
16 3728 1 1 11 HYP O O 3.048 -7.096 0.781 1.00 . A A . 11 HYP O 1 1
16 3729 1 1 11 HYP OD1 O 6.105 -2.599 1.600 1.00 . A A . 11 HYP OD1 1 1
16 3730 1 1 12 GLN C C -0.537 -6.038 0.960 1.00 . A A . 12 GLN C 1 1
16 3731 1 1 12 GLN CA C 0.706 -5.868 1.903 1.00 . A A . 12 GLN CA 1 1
16 3732 1 1 12 GLN CB C 0.345 -5.082 3.200 1.00 . A A . 12 GLN CB 1 1
16 3733 1 1 12 GLN CD C 1.012 -4.313 5.555 1.00 . A A . 12 GLN CD 1 1
16 3734 1 1 12 GLN CG C 1.377 -5.192 4.350 1.00 . A A . 12 GLN CG 1 1
16 3735 1 1 12 GLN H H 1.818 -4.229 1.130 1.00 . A A . 12 GLN H 1 1
16 3736 1 1 12 GLN HA H 1.027 -6.862 2.204 1.00 . A A . 12 GLN HA 1 1
16 3737 1 1 12 GLN HB2 H 0.171 -4.016 2.952 1.00 . A A . 12 GLN HB2 1 1
16 3738 1 1 12 GLN HB3 H -0.624 -5.440 3.599 1.00 . A A . 12 GLN HB3 1 1
16 3739 1 1 12 GLN HE21 H 2.291 -2.891 4.944 1.00 . A A . 12 GLN HE21 1 1
16 3740 1 1 12 GLN HE22 H 1.352 -2.573 6.487 1.00 . A A . 12 GLN HE22 1 1
16 3741 1 1 12 GLN HG2 H 1.445 -6.246 4.684 1.00 . A A . 12 GLN HG2 1 1
16 3742 1 1 12 GLN HG3 H 2.394 -4.943 3.985 1.00 . A A . 12 GLN HG3 1 1
16 3743 1 1 12 GLN N N 1.876 -5.224 1.294 1.00 . A A . 12 GLN N 1 1
16 3744 1 1 12 GLN NE2 N 1.597 -3.128 5.661 1.00 . A A . 12 GLN NE2 1 1
16 3745 1 1 12 GLN O O -1.591 -6.397 1.486 1.00 . A A . 12 GLN O 1 1
16 3746 1 1 12 GLN OE1 O 0.200 -4.689 6.398 1.00 . A A . 12 GLN OE1 1 1
16 3747 1 1 13 ABA C C -1.286 -7.995 -1.496 1.00 . A A . 13 AIB C 1 1
16 3748 1 1 13 ABA CA C -1.441 -6.408 -1.383 1.00 . A A . 13 AIB CA 1 1
16 3749 1 1 13 ABA H H 0.454 -5.514 -0.731 1.00 . A A . 13 AIB H 1 1
16 3750 1 1 13 ABA N N -0.466 -5.841 -0.387 1.00 . A A . 13 AIB N 1 1
16 3751 1 1 13 ABA O O -2.301 -8.685 -1.329 1.00 . A A . 13 AIB O 1 1
16 3752 1 1 14 HYP C C -0.134 -10.994 -0.640 1.00 . A A . 14 HYP C 1 1
16 3753 1 1 14 HYP CA C 0.035 -10.118 -1.917 1.00 . A A . 14 HYP CA 1 1
16 3754 1 1 14 HYP CB C 1.433 -10.281 -2.553 1.00 . A A . 14 HYP CB 1 1
16 3755 1 1 14 HYP CD C 1.203 -7.964 -1.994 1.00 . A A . 14 HYP CD 1 1
16 3756 1 1 14 HYP CG C 2.230 -9.088 -2.025 1.00 . A A . 14 HYP CG 1 1
16 3757 1 1 14 HYP HA H -0.714 -10.457 -2.661 1.00 . A A . 14 HYP HA 1 1
16 3758 1 1 14 HYP HB2 H 1.922 -11.242 -2.318 1.00 . A A . 14 HYP HB2 1 1
16 3759 1 1 14 HYP HB3 H 1.352 -10.238 -3.656 1.00 . A A . 14 HYP HB3 1 1
16 3760 1 1 14 HYP HD1 H 2.939 -8.400 -3.674 1.00 . A A . 14 HYP HD1 1 1
16 3761 1 1 14 HYP HD22 H 1.473 -7.247 -1.210 1.00 . A A . 14 HYP HD22 1 1
16 3762 1 1 14 HYP HD23 H 1.182 -7.409 -2.946 1.00 . A A . 14 HYP HD23 1 1
16 3763 1 1 14 HYP HG H 2.584 -9.290 -0.992 1.00 . A A . 14 HYP HG 1 1
16 3764 1 1 14 HYP N N -0.091 -8.641 -1.749 1.00 . A A . 14 HYP N 1 1
16 3765 1 1 14 HYP O O -0.844 -11.999 -0.719 1.00 . A A . 14 HYP O 1 1
16 3766 1 1 14 HYP OD1 O 3.325 -8.763 -2.873 1.00 . A A . 14 HYP OD1 1 1
16 3767 1 1 15 ABA C C -1.084 -11.700 2.252 1.00 . A A . 15 AIB C 1 1
16 3768 1 1 15 ABA CA C 0.414 -11.381 1.803 1.00 . A A . 15 AIB CA 1 1
16 3769 1 1 15 ABA H H 1.051 -9.772 0.429 1.00 . A A . 15 AIB H 1 1
16 3770 1 1 15 ABA N N 0.514 -10.643 0.502 1.00 . A A . 15 AIB N 1 1
16 3771 1 1 15 ABA O O -1.366 -12.878 2.506 1.00 . A A . 15 AIB O 1 1
16 3772 1 1 16 PRO C C -4.224 -11.708 1.152 1.00 . A A . 16 PRO C 1 1
16 3773 1 1 16 PRO CA C -3.533 -11.141 2.437 1.00 . A A . 16 PRO CA 1 1
16 3774 1 1 16 PRO CB C -4.168 -9.832 2.945 1.00 . A A . 16 PRO CB 1 1
16 3775 1 1 16 PRO CD C -1.907 -9.314 2.208 1.00 . A A . 16 PRO CD 1 1
16 3776 1 1 16 PRO CG C -3.311 -8.713 2.356 1.00 . A A . 16 PRO CG 1 1
16 3777 1 1 16 PRO HA H -3.637 -11.896 3.243 1.00 . A A . 16 PRO HA 1 1
16 3778 1 1 16 PRO HB2 H -5.237 -9.721 2.676 1.00 . A A . 16 PRO HB2 1 1
16 3779 1 1 16 PRO HB3 H -4.117 -9.792 4.050 1.00 . A A . 16 PRO HB3 1 1
16 3780 1 1 16 PRO HD2 H -1.463 -9.015 1.245 1.00 . A A . 16 PRO HD2 1 1
16 3781 1 1 16 PRO HD3 H -1.237 -8.946 3.002 1.00 . A A . 16 PRO HD3 1 1
16 3782 1 1 16 PRO HG2 H -3.703 -8.419 1.364 1.00 . A A . 16 PRO HG2 1 1
16 3783 1 1 16 PRO HG3 H -3.316 -7.809 2.991 1.00 . A A . 16 PRO HG3 1 1
16 3784 1 1 16 PRO N N -2.098 -10.774 2.294 1.00 . A A . 16 PRO N 1 1
16 3785 1 1 16 PRO O O -4.955 -12.695 1.286 1.00 . A A . 16 PRO O 1 1
16 3786 1 1 17 PHL C C -3.812 -12.269 -2.216 1.00 . A A . 17 PHL C 1 1
16 3787 1 1 17 PHL CA C -4.779 -11.517 -1.276 1.00 . A A . 17 PHL CA 1 1
16 3788 1 1 17 PHL CB C -5.453 -10.303 -1.986 1.00 . A A . 17 PHL CB 1 1
16 3789 1 1 17 PHL CD1 C -6.077 -8.103 -0.865 1.00 . A A . 17 PHL CD1 1 1
16 3790 1 1 17 PHL CD2 C -7.572 -9.978 -0.583 1.00 . A A . 17 PHL CD2 1 1
16 3791 1 1 17 PHL CE1 C -6.900 -7.324 -0.056 1.00 . A A . 17 PHL CE1 1 1
16 3792 1 1 17 PHL CE2 C -8.394 -9.198 0.230 1.00 . A A . 17 PHL CE2 1 1
16 3793 1 1 17 PHL CG C -6.402 -9.439 -1.128 1.00 . A A . 17 PHL CG 1 1
16 3794 1 1 17 PHL CZ C -8.058 -7.873 0.492 1.00 . A A . 17 PHL CZ 1 1
16 3795 1 1 17 PHL H H -3.387 -10.305 -0.061 1.00 . A A . 17 PHL H 1 1
16 3796 1 1 17 PHL HA H -5.592 -12.225 -1.019 1.00 . A A . 17 PHL HA 1 1
16 3797 1 1 17 PHL HB2 H -4.671 -9.670 -2.453 1.00 . A A . 17 PHL HB2 1 1
16 3798 1 1 17 PHL HB3 H -6.038 -10.679 -2.847 1.00 . A A . 17 PHL HB3 1 1
16 3799 1 1 17 PHL HC1 H -3.304 -13.093 -1.678 1.00 . A A . 17 PHL HC1 1 1
16 3800 1 1 17 PHL HC2 H -3.006 -11.603 -2.583 1.00 . A A . 17 PHL HC2 1 1
16 3801 1 1 17 PHL HD1 H -5.186 -7.668 -1.282 1.00 . A A . 17 PHL HD1 1 1
16 3802 1 1 17 PHL HD2 H -7.842 -11.007 -0.771 1.00 . A A . 17 PHL HD2 1 1
16 3803 1 1 17 PHL HE1 H -6.643 -6.294 0.143 1.00 . A A . 17 PHL HE1 1 1
16 3804 1 1 17 PHL HE2 H -9.293 -9.622 0.654 1.00 . A A . 17 PHL HE2 1 1
16 3805 1 1 17 PHL HO H -4.982 -12.101 -3.735 1.00 . A A . 17 PHL HO 1 1
16 3806 1 1 17 PHL HZ H -8.697 -7.266 1.119 1.00 . A A . 17 PHL HZ 1 1
16 3807 1 1 17 PHL N N -4.038 -11.105 -0.050 1.00 . A A . 17 PHL N 1 1
16 3808 1 1 17 PHL O O -4.512 -12.829 -3.322 1.00 . A A . 17 PHL O 1 1
17 3809 1 1 1 ACE C C -2.278 10.672 0.664 1.00 . A A . 1 ACE C 1 1
17 3810 1 1 1 ACE CH3 C -1.774 12.102 0.542 1.00 . A A . 1 ACE CH3 1 1
17 3811 1 1 1 ACE H1 H -1.448 12.309 -0.494 1.00 . A A . 1 ACE H1 1 1
17 3812 1 1 1 ACE H2 H -2.554 12.834 0.812 1.00 . A A . 1 ACE H2 1 1
17 3813 1 1 1 ACE H3 H -0.900 12.268 1.196 1.00 . A A . 1 ACE H3 1 1
17 3814 1 1 1 ACE O O -1.671 9.850 1.356 1.00 . A A . 1 ACE O 1 1
17 3815 1 1 2 TRP C C -2.820 8.116 -1.244 1.00 . A A . 2 TRP C 1 1
17 3816 1 1 2 TRP CA C -3.783 8.974 -0.342 1.00 . A A . 2 TRP CA 1 1
17 3817 1 1 2 TRP CB C -5.256 8.984 -0.841 1.00 . A A . 2 TRP CB 1 1
17 3818 1 1 2 TRP CD1 C -6.468 7.115 0.543 1.00 . A A . 2 TRP CD1 1 1
17 3819 1 1 2 TRP CD2 C -6.373 6.733 -1.647 1.00 . A A . 2 TRP CD2 1 1
17 3820 1 1 2 TRP CE2 C -7.061 5.672 -1.005 1.00 . A A . 2 TRP CE2 1 1
17 3821 1 1 2 TRP CE3 C -6.188 6.721 -3.055 1.00 . A A . 2 TRP CE3 1 1
17 3822 1 1 2 TRP CG C -5.998 7.649 -0.679 1.00 . A A . 2 TRP CG 1 1
17 3823 1 1 2 TRP CH2 C -7.402 4.611 -3.151 1.00 . A A . 2 TRP CH2 1 1
17 3824 1 1 2 TRP CZ2 C -7.589 4.603 -1.768 1.00 . A A . 2 TRP CZ2 1 1
17 3825 1 1 2 TRP CZ3 C -6.707 5.649 -3.784 1.00 . A A . 2 TRP CZ3 1 1
17 3826 1 1 2 TRP H H -3.801 11.166 -0.554 1.00 . A A . 2 TRP H 1 1
17 3827 1 1 2 TRP HA H -3.799 8.496 0.651 1.00 . A A . 2 TRP HA 1 1
17 3828 1 1 2 TRP HB2 H -5.843 9.739 -0.280 1.00 . A A . 2 TRP HB2 1 1
17 3829 1 1 2 TRP HB3 H -5.303 9.328 -1.893 1.00 . A A . 2 TRP HB3 1 1
17 3830 1 1 2 TRP HD1 H -6.347 7.593 1.505 1.00 . A A . 2 TRP HD1 1 1
17 3831 1 1 2 TRP HE1 H -7.544 5.281 1.078 1.00 . A A . 2 TRP HE1 1 1
17 3832 1 1 2 TRP HE3 H -5.662 7.519 -3.557 1.00 . A A . 2 TRP HE3 1 1
17 3833 1 1 2 TRP HH2 H -7.788 3.792 -3.741 1.00 . A A . 2 TRP HH2 1 1
17 3834 1 1 2 TRP HZ2 H -8.115 3.789 -1.289 1.00 . A A . 2 TRP HZ2 1 1
17 3835 1 1 2 TRP HZ3 H -6.569 5.618 -4.855 1.00 . A A . 2 TRP HZ3 1 1
17 3836 1 1 2 TRP N N -3.350 10.375 -0.088 1.00 . A A . 2 TRP N 1 1
17 3837 1 1 2 TRP NE1 N -7.123 5.883 0.362 1.00 . A A . 2 TRP NE1 1 1
17 3838 1 1 2 TRP O O -2.932 6.886 -1.226 1.00 . A A . 2 TRP O 1 1
17 3839 1 1 3 ILE C C 0.236 7.243 -1.573 1.00 . A A . 3 ILE C 1 1
17 3840 1 1 3 ILE CA C -0.705 7.979 -2.581 1.00 . A A . 3 ILE CA 1 1
17 3841 1 1 3 ILE CB C 0.034 8.837 -3.669 1.00 . A A . 3 ILE CB 1 1
17 3842 1 1 3 ILE CD1 C 1.345 8.609 -5.925 1.00 . A A . 3 ILE CD1 1 1
17 3843 1 1 3 ILE CG1 C 0.931 7.960 -4.595 1.00 . A A . 3 ILE CG1 1 1
17 3844 1 1 3 ILE CG2 C 0.824 10.040 -3.087 1.00 . A A . 3 ILE CG2 1 1
17 3845 1 1 3 ILE H H -1.848 9.744 -1.915 1.00 . A A . 3 ILE H 1 1
17 3846 1 1 3 ILE HA H -1.200 7.171 -3.129 1.00 . A A . 3 ILE HA 1 1
17 3847 1 1 3 ILE HB H -0.755 9.261 -4.321 1.00 . A A . 3 ILE HB 1 1
17 3848 1 1 3 ILE HD11 H 1.951 9.521 -5.772 1.00 . A A . 3 ILE HD11 1 1
17 3849 1 1 3 ILE HD12 H 1.952 7.913 -6.531 1.00 . A A . 3 ILE HD12 1 1
17 3850 1 1 3 ILE HD13 H 0.465 8.887 -6.531 1.00 . A A . 3 ILE HD13 1 1
17 3851 1 1 3 ILE HG12 H 1.838 7.633 -4.051 1.00 . A A . 3 ILE HG12 1 1
17 3852 1 1 3 ILE HG13 H 0.400 7.021 -4.845 1.00 . A A . 3 ILE HG13 1 1
17 3853 1 1 3 ILE HG21 H 1.685 9.713 -2.475 1.00 . A A . 3 ILE HG21 1 1
17 3854 1 1 3 ILE HG22 H 1.223 10.695 -3.883 1.00 . A A . 3 ILE HG22 1 1
17 3855 1 1 3 ILE HG23 H 0.190 10.675 -2.442 1.00 . A A . 3 ILE HG23 1 1
17 3856 1 1 3 ILE N N -1.850 8.720 -1.971 1.00 . A A . 3 ILE N 1 1
17 3857 1 1 3 ILE O O 0.637 6.117 -1.862 1.00 . A A . 3 ILE O 1 1
17 3858 1 1 4 GLN C C 0.515 6.147 1.518 1.00 . A A . 4 GLN C 1 1
17 3859 1 1 4 GLN CA C 1.311 7.186 0.679 1.00 . A A . 4 GLN CA 1 1
17 3860 1 1 4 GLN CB C 2.041 8.221 1.575 1.00 . A A . 4 GLN CB 1 1
17 3861 1 1 4 GLN CD C 4.542 7.620 1.242 1.00 . A A . 4 GLN CD 1 1
17 3862 1 1 4 GLN CG C 3.421 8.660 1.035 1.00 . A A . 4 GLN CG 1 1
17 3863 1 1 4 GLN H H 0.134 8.777 -0.321 1.00 . A A . 4 GLN H 1 1
17 3864 1 1 4 GLN HA H 2.099 6.589 0.193 1.00 . A A . 4 GLN HA 1 1
17 3865 1 1 4 GLN HB2 H 1.401 9.113 1.730 1.00 . A A . 4 GLN HB2 1 1
17 3866 1 1 4 GLN HB3 H 2.192 7.817 2.594 1.00 . A A . 4 GLN HB3 1 1
17 3867 1 1 4 GLN HE21 H 5.162 8.574 2.893 1.00 . A A . 4 GLN HE21 1 1
17 3868 1 1 4 GLN HE22 H 6.066 7.051 2.412 1.00 . A A . 4 GLN HE22 1 1
17 3869 1 1 4 GLN HG2 H 3.337 8.883 -0.046 1.00 . A A . 4 GLN HG2 1 1
17 3870 1 1 4 GLN HG3 H 3.699 9.620 1.507 1.00 . A A . 4 GLN HG3 1 1
17 3871 1 1 4 GLN N N 0.564 7.858 -0.423 1.00 . A A . 4 GLN N 1 1
17 3872 1 1 4 GLN NE2 N 5.343 7.766 2.285 1.00 . A A . 4 GLN NE2 1 1
17 3873 1 1 4 GLN O O 1.137 5.169 1.936 1.00 . A A . 4 GLN O 1 1
17 3874 1 1 4 GLN OE1 O 4.693 6.673 0.472 1.00 . A A . 4 GLN OE1 1 1
17 3875 1 1 5 . C C -1.545 3.876 1.270 1.00 . A A . 5 DIV C 1 1
17 3876 1 1 5 . CA C -1.720 5.164 2.192 1.00 . A A . 5 DIV CA 1 1
17 3877 1 1 5 . CB1 C -1.451 4.904 3.724 1.00 . A A . 5 DIV CB1 1 1
17 3878 1 1 5 . CB2 C -3.171 5.710 2.047 1.00 . A A . 5 DIV CB2 1 1
17 3879 1 1 5 . CG1 C -2.394 3.957 4.493 1.00 . A A . 5 DIV CG1 1 1
17 3880 1 1 5 . H H -1.217 7.149 1.344 1.00 . A A . 5 DIV H 1 1
17 3881 1 1 5 . HB11 H -0.424 4.517 3.853 1.00 . A A . 5 DIV HB11 1 1
17 3882 1 1 5 . HB12 H -1.445 5.865 4.272 1.00 . A A . 5 DIV HB12 1 1
17 3883 1 1 5 . HB21 H -3.425 5.991 1.008 1.00 . A A . 5 DIV HB21 1 1
17 3884 1 1 5 . HB22 H -3.929 4.962 2.343 1.00 . A A . 5 DIV HB22 1 1
17 3885 1 1 5 . HB23 H -3.353 6.608 2.668 1.00 . A A . 5 DIV HB23 1 1
17 3886 1 1 5 . HG11 H -2.549 2.997 3.971 1.00 . A A . 5 DIV HG11 1 1
17 3887 1 1 5 . HG12 H -1.991 3.720 5.495 1.00 . A A . 5 DIV HG12 1 1
17 3888 1 1 5 . HG13 H -3.390 4.412 4.650 1.00 . A A . 5 DIV HG13 1 1
17 3889 1 1 5 . N N -0.821 6.286 1.733 1.00 . A A . 5 DIV N 1 1
17 3890 1 1 5 . O O -1.233 2.788 1.763 1.00 . A A . 5 DIV O 1 1
17 3891 1 1 6 ILE C C 0.090 2.455 -1.104 1.00 . A A . 6 ILE C 1 1
17 3892 1 1 6 ILE CA C -1.390 2.958 -1.077 1.00 . A A . 6 ILE CA 1 1
17 3893 1 1 6 ILE CB C -1.984 3.370 -2.480 1.00 . A A . 6 ILE CB 1 1
17 3894 1 1 6 ILE CD1 C -4.441 2.463 -2.098 1.00 . A A . 6 ILE CD1 1 1
17 3895 1 1 6 ILE CG1 C -3.525 3.641 -2.484 1.00 . A A . 6 ILE CG1 1 1
17 3896 1 1 6 ILE CG2 C -1.632 2.399 -3.638 1.00 . A A . 6 ILE CG2 1 1
17 3897 1 1 6 ILE H H -2.051 4.917 -0.384 1.00 . A A . 6 ILE H 1 1
17 3898 1 1 6 ILE HA H -1.976 2.094 -0.731 1.00 . A A . 6 ILE HA 1 1
17 3899 1 1 6 ILE HB H -1.510 4.331 -2.757 1.00 . A A . 6 ILE HB 1 1
17 3900 1 1 6 ILE HD11 H -4.272 2.137 -1.056 1.00 . A A . 6 ILE HD11 1 1
17 3901 1 1 6 ILE HD12 H -5.504 2.743 -2.175 1.00 . A A . 6 ILE HD12 1 1
17 3902 1 1 6 ILE HD13 H -4.292 1.588 -2.755 1.00 . A A . 6 ILE HD13 1 1
17 3903 1 1 6 ILE HG12 H -3.752 4.483 -1.802 1.00 . A A . 6 ILE HG12 1 1
17 3904 1 1 6 ILE HG13 H -3.831 4.017 -3.480 1.00 . A A . 6 ILE HG13 1 1
17 3905 1 1 6 ILE HG21 H -1.981 1.369 -3.441 1.00 . A A . 6 ILE HG21 1 1
17 3906 1 1 6 ILE HG22 H -2.075 2.720 -4.600 1.00 . A A . 6 ILE HG22 1 1
17 3907 1 1 6 ILE HG23 H -0.543 2.343 -3.811 1.00 . A A . 6 ILE HG23 1 1
17 3908 1 1 6 ILE N N -1.648 4.029 -0.077 1.00 . A A . 6 ILE N 1 1
17 3909 1 1 6 ILE O O 0.280 1.249 -0.982 1.00 . A A . 6 ILE O 1 1
17 3910 1 1 7 THR C C 3.096 2.135 -0.104 1.00 . A A . 7 THR C 1 1
17 3911 1 1 7 THR CA C 2.553 2.900 -1.360 1.00 . A A . 7 THR CA 1 1
17 3912 1 1 7 THR CB C 3.430 4.130 -1.759 1.00 . A A . 7 THR CB 1 1
17 3913 1 1 7 THR CG2 C 4.921 3.837 -2.014 1.00 . A A . 7 THR CG2 1 1
17 3914 1 1 7 THR H H 0.835 4.305 -1.351 1.00 . A A . 7 THR H 1 1
17 3915 1 1 7 THR HA H 2.616 2.183 -2.202 1.00 . A A . 7 THR HA 1 1
17 3916 1 1 7 THR HB H 3.371 4.883 -0.950 1.00 . A A . 7 THR HB 1 1
17 3917 1 1 7 THR HG1 H 3.436 5.539 -3.069 1.00 . A A . 7 THR HG1 1 1
17 3918 1 1 7 THR HG21 H 5.455 4.751 -2.334 1.00 . A A . 7 THR HG21 1 1
17 3919 1 1 7 THR HG22 H 5.434 3.470 -1.106 1.00 . A A . 7 THR HG22 1 1
17 3920 1 1 7 THR HG23 H 5.062 3.079 -2.807 1.00 . A A . 7 THR HG23 1 1
17 3921 1 1 7 THR N N 1.115 3.319 -1.266 1.00 . A A . 7 THR N 1 1
17 3922 1 1 7 THR O O 3.736 1.094 -0.267 1.00 . A A . 7 THR O 1 1
17 3923 1 1 7 THR OG1 O 2.933 4.731 -2.953 1.00 . A A . 7 THR OG1 1 1
17 3924 1 1 8 ABA C C 2.223 0.472 2.463 1.00 . A A . 8 AIB C 1 1
17 3925 1 1 8 ABA CA C 2.983 1.860 2.408 1.00 . A A . 8 AIB CA 1 1
17 3926 1 1 8 ABA H H 2.124 3.382 1.062 1.00 . A A . 8 AIB H 1 1
17 3927 1 1 8 ABA N N 2.801 2.618 1.124 1.00 . A A . 8 AIB N 1 1
17 3928 1 1 8 ABA O O 2.747 -0.504 3.013 1.00 . A A . 8 AIB O 1 1
17 3929 1 1 9 LEU C C 0.742 -1.744 0.464 1.00 . A A . 9 LEU C 1 1
17 3930 1 1 9 LEU CA C 0.273 -0.894 1.688 1.00 . A A . 9 LEU CA 1 1
17 3931 1 1 9 LEU CB C -1.252 -0.596 1.567 1.00 . A A . 9 LEU CB 1 1
17 3932 1 1 9 LEU CD1 C -3.458 0.214 2.526 1.00 . A A . 9 LEU CD1 1 1
17 3933 1 1 9 LEU CD2 C -2.180 -1.543 3.789 1.00 . A A . 9 LEU CD2 1 1
17 3934 1 1 9 LEU CG C -2.049 -0.309 2.871 1.00 . A A . 9 LEU CG 1 1
17 3935 1 1 9 LEU H H 0.693 1.177 1.329 1.00 . A A . 9 LEU H 1 1
17 3936 1 1 9 LEU HA H 0.430 -1.518 2.581 1.00 . A A . 9 LEU HA 1 1
17 3937 1 1 9 LEU HB2 H -1.392 0.241 0.854 1.00 . A A . 9 LEU HB2 1 1
17 3938 1 1 9 LEU HB3 H -1.753 -1.437 1.058 1.00 . A A . 9 LEU HB3 1 1
17 3939 1 1 9 LEU HD11 H -4.055 -0.533 1.968 1.00 . A A . 9 LEU HD11 1 1
17 3940 1 1 9 LEU HD12 H -4.032 0.476 3.434 1.00 . A A . 9 LEU HD12 1 1
17 3941 1 1 9 LEU HD13 H -3.415 1.126 1.904 1.00 . A A . 9 LEU HD13 1 1
17 3942 1 1 9 LEU HD21 H -1.199 -1.893 4.160 1.00 . A A . 9 LEU HD21 1 1
17 3943 1 1 9 LEU HD22 H -2.792 -1.322 4.686 1.00 . A A . 9 LEU HD22 1 1
17 3944 1 1 9 LEU HD23 H -2.659 -2.399 3.274 1.00 . A A . 9 LEU HD23 1 1
17 3945 1 1 9 LEU HG H -1.532 0.485 3.438 1.00 . A A . 9 LEU HG 1 1
17 3946 1 1 9 LEU N N 0.992 0.381 1.898 1.00 . A A . 9 LEU N 1 1
17 3947 1 1 9 LEU O O 0.314 -2.896 0.399 1.00 . A A . 9 LEU O 1 1
17 3948 1 1 10 ABA C C 2.633 -3.458 -1.396 1.00 . A A . 10 AIB C 1 1
17 3949 1 1 10 ABA CA C 2.033 -2.010 -1.703 1.00 . A A . 10 AIB CA 1 1
17 3950 1 1 10 ABA H H 1.862 -0.265 -0.328 1.00 . A A . 10 AIB H 1 1
17 3951 1 1 10 ABA N N 1.572 -1.244 -0.493 1.00 . A A . 10 AIB N 1 1
17 3952 1 1 10 ABA O O 2.127 -4.429 -1.978 1.00 . A A . 10 AIB O 1 1
17 3953 1 1 11 HYP C C 2.973 -5.908 0.755 1.00 . A A . 11 HYP C 1 1
17 3954 1 1 11 HYP CA C 4.023 -5.086 -0.065 1.00 . A A . 11 HYP CA 1 1
17 3955 1 1 11 HYP CB C 5.314 -4.831 0.733 1.00 . A A . 11 HYP CB 1 1
17 3956 1 1 11 HYP CD C 4.207 -2.687 0.418 1.00 . A A . 11 HYP CD 1 1
17 3957 1 1 11 HYP CG C 5.133 -3.451 1.374 1.00 . A A . 11 HYP CG 1 1
17 3958 1 1 11 HYP HA H 4.281 -5.678 -0.963 1.00 . A A . 11 HYP HA 1 1
17 3959 1 1 11 HYP HB2 H 5.536 -5.619 1.479 1.00 . A A . 11 HYP HB2 1 1
17 3960 1 1 11 HYP HB3 H 6.180 -4.821 0.042 1.00 . A A . 11 HYP HB3 1 1
17 3961 1 1 11 HYP HD1 H 6.902 -3.366 2.118 1.00 . A A . 11 HYP HD1 1 1
17 3962 1 1 11 HYP HD22 H 3.406 -2.201 0.994 1.00 . A A . 11 HYP HD22 1 1
17 3963 1 1 11 HYP HD23 H 4.715 -1.887 -0.147 1.00 . A A . 11 HYP HD23 1 1
17 3964 1 1 11 HYP HG H 4.641 -3.562 2.358 1.00 . A A . 11 HYP HG 1 1
17 3965 1 1 11 HYP N N 3.636 -3.704 -0.485 1.00 . A A . 11 HYP N 1 1
17 3966 1 1 11 HYP O O 3.065 -7.138 0.788 1.00 . A A . 11 HYP O 1 1
17 3967 1 1 11 HYP OD1 O 6.384 -2.795 1.546 1.00 . A A . 11 HYP OD1 1 1
17 3968 1 1 12 GLN C C -0.458 -5.977 1.087 1.00 . A A . 12 GLN C 1 1
17 3969 1 1 12 GLN CA C 0.808 -5.843 2.003 1.00 . A A . 12 GLN CA 1 1
17 3970 1 1 12 GLN CB C 0.494 -5.066 3.318 1.00 . A A . 12 GLN CB 1 1
17 3971 1 1 12 GLN CD C 2.261 -3.826 4.826 1.00 . A A . 12 GLN CD 1 1
17 3972 1 1 12 GLN CG C 1.555 -5.148 4.453 1.00 . A A . 12 GLN CG 1 1
17 3973 1 1 12 GLN H H 1.994 -4.229 1.279 1.00 . A A . 12 GLN H 1 1
17 3974 1 1 12 GLN HA H 1.108 -6.847 2.293 1.00 . A A . 12 GLN HA 1 1
17 3975 1 1 12 GLN HB2 H 0.232 -4.014 3.081 1.00 . A A . 12 GLN HB2 1 1
17 3976 1 1 12 GLN HB3 H -0.442 -5.470 3.745 1.00 . A A . 12 GLN HB3 1 1
17 3977 1 1 12 GLN HE21 H 3.888 -4.841 5.424 1.00 . A A . 12 GLN HE21 1 1
17 3978 1 1 12 GLN HE22 H 3.929 -3.020 5.600 1.00 . A A . 12 GLN HE22 1 1
17 3979 1 1 12 GLN HG2 H 1.066 -5.534 5.368 1.00 . A A . 12 GLN HG2 1 1
17 3980 1 1 12 GLN HG3 H 2.307 -5.921 4.202 1.00 . A A . 12 GLN HG3 1 1
17 3981 1 1 12 GLN N N 1.989 -5.233 1.385 1.00 . A A . 12 GLN N 1 1
17 3982 1 1 12 GLN NE2 N 3.492 -3.903 5.313 1.00 . A A . 12 GLN NE2 1 1
17 3983 1 1 12 GLN O O -1.495 -6.352 1.629 1.00 . A A . 12 GLN O 1 1
17 3984 1 1 12 GLN OE1 O 1.708 -2.733 4.725 1.00 . A A . 12 GLN OE1 1 1
17 3985 1 1 13 ABA C C -1.340 -7.802 -1.461 1.00 . A A . 13 AIB C 1 1
17 3986 1 1 13 ABA CA C -1.446 -6.223 -1.243 1.00 . A A . 13 AIB CA 1 1
17 3987 1 1 13 ABA H H 0.486 -5.399 -0.608 1.00 . A A . 13 AIB H 1 1
17 3988 1 1 13 ABA N N -0.429 -5.725 -0.253 1.00 . A A . 13 AIB N 1 1
17 3989 1 1 13 ABA O O -2.376 -8.463 -1.328 1.00 . A A . 13 AIB O 1 1
17 3990 1 1 14 HYP C C -0.304 -10.878 -0.794 1.00 . A A . 14 HYP C 1 1
17 3991 1 1 14 HYP CA C -0.113 -9.945 -2.028 1.00 . A A . 14 HYP CA 1 1
17 3992 1 1 14 HYP CB C 1.266 -10.131 -2.694 1.00 . A A . 14 HYP CB 1 1
17 3993 1 1 14 HYP CD C 1.140 -7.835 -1.998 1.00 . A A . 14 HYP CD 1 1
17 3994 1 1 14 HYP CG C 2.117 -8.999 -2.112 1.00 . A A . 14 HYP CG 1 1
17 3995 1 1 14 HYP HA H -0.884 -10.219 -2.776 1.00 . A A . 14 HYP HA 1 1
17 3996 1 1 14 HYP HB2 H 1.718 -11.124 -2.515 1.00 . A A . 14 HYP HB2 1 1
17 3997 1 1 14 HYP HB3 H 1.171 -10.029 -3.791 1.00 . A A . 14 HYP HB3 1 1
17 3998 1 1 14 HYP HD1 H 2.835 -8.299 -3.752 1.00 . A A . 14 HYP HD1 1 1
17 3999 1 1 14 HYP HD22 H 1.442 -7.187 -1.167 1.00 . A A . 14 HYP HD22 1 1
17 4000 1 1 14 HYP HD23 H 1.136 -7.218 -2.911 1.00 . A A . 14 HYP HD23 1 1
17 4001 1 1 14 HYP HG H 2.471 -9.276 -1.098 1.00 . A A . 14 HYP HG 1 1
17 4002 1 1 14 HYP N N -0.176 -8.474 -1.779 1.00 . A A . 14 HYP N 1 1
17 4003 1 1 14 HYP O O -1.043 -11.857 -0.912 1.00 . A A . 14 HYP O 1 1
17 4004 1 1 14 HYP OD1 O 3.214 -8.677 -2.955 1.00 . A A . 14 HYP OD1 1 1
17 4005 1 1 15 ABA C C -1.290 -11.668 2.072 1.00 . A A . 15 AIB C 1 1
17 4006 1 1 15 ABA CA C 0.221 -11.381 1.636 1.00 . A A . 15 AIB CA 1 1
17 4007 1 1 15 ABA H H 0.915 -9.741 0.324 1.00 . A A . 15 AIB H 1 1
17 4008 1 1 15 ABA N N 0.354 -10.600 0.363 1.00 . A A . 15 AIB N 1 1
17 4009 1 1 15 ABA O O -1.608 -12.841 2.299 1.00 . A A . 15 AIB O 1 1
17 4010 1 1 16 PRO C C -4.460 -11.491 0.979 1.00 . A A . 16 PRO C 1 1
17 4011 1 1 16 PRO CA C -3.720 -11.032 2.280 1.00 . A A . 16 PRO CA 1 1
17 4012 1 1 16 PRO CB C -4.287 -9.721 2.861 1.00 . A A . 16 PRO CB 1 1
17 4013 1 1 16 PRO CD C -2.035 -9.258 2.095 1.00 . A A . 16 PRO CD 1 1
17 4014 1 1 16 PRO CG C -3.418 -8.618 2.260 1.00 . A A . 16 PRO CG 1 1
17 4015 1 1 16 PRO HA H -3.853 -11.826 3.044 1.00 . A A . 16 PRO HA 1 1
17 4016 1 1 16 PRO HB2 H -5.362 -9.566 2.650 1.00 . A A . 16 PRO HB2 1 1
17 4017 1 1 16 PRO HB3 H -4.181 -9.715 3.964 1.00 . A A . 16 PRO HB3 1 1
17 4018 1 1 16 PRO HD2 H -1.580 -8.944 1.142 1.00 . A A . 16 PRO HD2 1 1
17 4019 1 1 16 PRO HD3 H -1.357 -8.932 2.898 1.00 . A A . 16 PRO HD3 1 1
17 4020 1 1 16 PRO HG2 H -3.819 -8.315 1.273 1.00 . A A . 16 PRO HG2 1 1
17 4021 1 1 16 PRO HG3 H -3.396 -7.712 2.892 1.00 . A A . 16 PRO HG3 1 1
17 4022 1 1 16 PRO N N -2.273 -10.711 2.138 1.00 . A A . 16 PRO N 1 1
17 4023 1 1 16 PRO O O -5.298 -12.392 1.076 1.00 . A A . 16 PRO O 1 1
17 4024 1 1 17 PHL C C -3.970 -11.258 -2.607 1.00 . A A . 17 PHL C 1 1
17 4025 1 1 17 PHL CA C -4.974 -11.128 -1.441 1.00 . A A . 17 PHL CA 1 1
17 4026 1 1 17 PHL CB C -6.027 -10.003 -1.680 1.00 . A A . 17 PHL CB 1 1
17 4027 1 1 17 PHL CD1 C -7.282 -9.098 0.357 1.00 . A A . 17 PHL CD1 1 1
17 4028 1 1 17 PHL CD2 C -8.244 -10.957 -0.849 1.00 . A A . 17 PHL CD2 1 1
17 4029 1 1 17 PHL CE1 C -8.343 -9.136 1.259 1.00 . A A . 17 PHL CE1 1 1
17 4030 1 1 17 PHL CE2 C -9.305 -10.990 0.053 1.00 . A A . 17 PHL CE2 1 1
17 4031 1 1 17 PHL CG C -7.221 -10.010 -0.702 1.00 . A A . 17 PHL CG 1 1
17 4032 1 1 17 PHL CZ C -9.357 -10.079 1.104 1.00 . A A . 17 PHL CZ 1 1
17 4033 1 1 17 PHL H H -3.524 -10.095 -0.151 1.00 . A A . 17 PHL H 1 1
17 4034 1 1 17 PHL HA H -5.506 -12.099 -1.380 1.00 . A A . 17 PHL HA 1 1
17 4035 1 1 17 PHL HB2 H -5.529 -9.013 -1.682 1.00 . A A . 17 PHL HB2 1 1
17 4036 1 1 17 PHL HB3 H -6.431 -10.095 -2.705 1.00 . A A . 17 PHL HB3 1 1
17 4037 1 1 17 PHL HC1 H -3.198 -12.014 -2.367 1.00 . A A . 17 PHL HC1 1 1
17 4038 1 1 17 PHL HC2 H -3.424 -10.314 -2.790 1.00 . A A . 17 PHL HC2 1 1
17 4039 1 1 17 PHL HD1 H -6.497 -8.367 0.498 1.00 . A A . 17 PHL HD1 1 1
17 4040 1 1 17 PHL HD2 H -8.212 -11.677 -1.653 1.00 . A A . 17 PHL HD2 1 1
17 4041 1 1 17 PHL HE1 H -8.381 -8.436 2.081 1.00 . A A . 17 PHL HE1 1 1
17 4042 1 1 17 PHL HE2 H -10.086 -11.728 -0.061 1.00 . A A . 17 PHL HE2 1 1
17 4043 1 1 17 PHL HO H -5.215 -10.944 -4.038 1.00 . A A . 17 PHL HO 1 1
17 4044 1 1 17 PHL HZ H -10.181 -10.106 1.802 1.00 . A A . 17 PHL HZ 1 1
17 4045 1 1 17 PHL N N -4.206 -10.863 -0.196 1.00 . A A . 17 PHL N 1 1
17 4046 1 1 17 PHL O O -4.623 -11.663 -3.804 1.00 . A A . 17 PHL O 1 1
18 4047 1 1 1 ACE C C -2.450 10.142 1.391 1.00 . A A . 1 ACE C 1 1
18 4048 1 1 1 ACE CH3 C -1.648 11.378 1.774 1.00 . A A . 1 ACE CH3 1 1
18 4049 1 1 1 ACE H1 H -2.298 12.253 1.950 1.00 . A A . 1 ACE H1 1 1
18 4050 1 1 1 ACE H2 H -1.055 11.196 2.688 1.00 . A A . 1 ACE H2 1 1
18 4051 1 1 1 ACE H3 H -0.930 11.634 0.970 1.00 . A A . 1 ACE H3 1 1
18 4052 1 1 1 ACE O O -2.276 9.073 1.980 1.00 . A A . 1 ACE O 1 1
18 4053 1 1 2 TRP C C -2.622 8.327 -1.202 1.00 . A A . 2 TRP C 1 1
18 4054 1 1 2 TRP CA C -3.747 9.145 -0.476 1.00 . A A . 2 TRP CA 1 1
18 4055 1 1 2 TRP CB C -4.859 9.652 -1.437 1.00 . A A . 2 TRP CB 1 1
18 4056 1 1 2 TRP CD1 C -6.216 7.437 -1.855 1.00 . A A . 2 TRP CD1 1 1
18 4057 1 1 2 TRP CD2 C -5.445 8.431 -3.694 1.00 . A A . 2 TRP CD2 1 1
18 4058 1 1 2 TRP CE2 C -6.098 7.222 -4.043 1.00 . A A . 2 TRP CE2 1 1
18 4059 1 1 2 TRP CE3 C -4.855 9.244 -4.696 1.00 . A A . 2 TRP CE3 1 1
18 4060 1 1 2 TRP CG C -5.512 8.572 -2.317 1.00 . A A . 2 TRP CG 1 1
18 4061 1 1 2 TRP CH2 C -5.588 7.635 -6.371 1.00 . A A . 2 TRP CH2 1 1
18 4062 1 1 2 TRP CZ2 C -6.167 6.818 -5.398 1.00 . A A . 2 TRP CZ2 1 1
18 4063 1 1 2 TRP CZ3 C -4.944 8.830 -6.026 1.00 . A A . 2 TRP CZ3 1 1
18 4064 1 1 2 TRP H H -3.370 11.253 -0.005 1.00 . A A . 2 TRP H 1 1
18 4065 1 1 2 TRP HA H -4.242 8.467 0.238 1.00 . A A . 2 TRP HA 1 1
18 4066 1 1 2 TRP HB2 H -5.664 10.138 -0.851 1.00 . A A . 2 TRP HB2 1 1
18 4067 1 1 2 TRP HB3 H -4.460 10.461 -2.079 1.00 . A A . 2 TRP HB3 1 1
18 4068 1 1 2 TRP HD1 H -6.406 7.220 -0.815 1.00 . A A . 2 TRP HD1 1 1
18 4069 1 1 2 TRP HE1 H -7.074 5.686 -2.855 1.00 . A A . 2 TRP HE1 1 1
18 4070 1 1 2 TRP HE3 H -4.350 10.167 -4.446 1.00 . A A . 2 TRP HE3 1 1
18 4071 1 1 2 TRP HH2 H -5.640 7.342 -7.410 1.00 . A A . 2 TRP HH2 1 1
18 4072 1 1 2 TRP HZ2 H -6.654 5.896 -5.677 1.00 . A A . 2 TRP HZ2 1 1
18 4073 1 1 2 TRP HZ3 H -4.507 9.442 -6.802 1.00 . A A . 2 TRP HZ3 1 1
18 4074 1 1 2 TRP N N -3.253 10.294 0.327 1.00 . A A . 2 TRP N 1 1
18 4075 1 1 2 TRP NE1 N -6.583 6.584 -2.912 1.00 . A A . 2 TRP NE1 1 1
18 4076 1 1 2 TRP O O -2.751 7.105 -1.301 1.00 . A A . 2 TRP O 1 1
18 4077 1 1 3 ILE C C 0.448 7.400 -1.361 1.00 . A A . 3 ILE C 1 1
18 4078 1 1 3 ILE CA C -0.400 8.266 -2.344 1.00 . A A . 3 ILE CA 1 1
18 4079 1 1 3 ILE CB C 0.416 9.223 -3.289 1.00 . A A . 3 ILE CB 1 1
18 4080 1 1 3 ILE CD1 C -1.175 9.003 -5.395 1.00 . A A . 3 ILE CD1 1 1
18 4081 1 1 3 ILE CG1 C -0.433 9.919 -4.404 1.00 . A A . 3 ILE CG1 1 1
18 4082 1 1 3 ILE CG2 C 1.666 8.567 -3.935 1.00 . A A . 3 ILE CG2 1 1
18 4083 1 1 3 ILE H H -1.545 9.987 -1.552 1.00 . A A . 3 ILE H 1 1
18 4084 1 1 3 ILE HA H -0.866 7.517 -2.991 1.00 . A A . 3 ILE HA 1 1
18 4085 1 1 3 ILE HB H 0.807 10.035 -2.649 1.00 . A A . 3 ILE HB 1 1
18 4086 1 1 3 ILE HD11 H -1.909 8.352 -4.887 1.00 . A A . 3 ILE HD11 1 1
18 4087 1 1 3 ILE HD12 H -1.736 9.598 -6.139 1.00 . A A . 3 ILE HD12 1 1
18 4088 1 1 3 ILE HD13 H -0.482 8.348 -5.956 1.00 . A A . 3 ILE HD13 1 1
18 4089 1 1 3 ILE HG12 H -1.180 10.581 -3.927 1.00 . A A . 3 ILE HG12 1 1
18 4090 1 1 3 ILE HG13 H 0.211 10.610 -4.979 1.00 . A A . 3 ILE HG13 1 1
18 4091 1 1 3 ILE HG21 H 1.406 7.684 -4.547 1.00 . A A . 3 ILE HG21 1 1
18 4092 1 1 3 ILE HG22 H 2.213 9.272 -4.587 1.00 . A A . 3 ILE HG22 1 1
18 4093 1 1 3 ILE HG23 H 2.392 8.231 -3.171 1.00 . A A . 3 ILE HG23 1 1
18 4094 1 1 3 ILE N N -1.546 8.972 -1.702 1.00 . A A . 3 ILE N 1 1
18 4095 1 1 3 ILE O O 0.801 6.280 -1.732 1.00 . A A . 3 ILE O 1 1
18 4096 1 1 4 GLN C C 0.420 6.010 1.626 1.00 . A A . 4 GLN C 1 1
18 4097 1 1 4 GLN CA C 1.365 7.023 0.918 1.00 . A A . 4 GLN CA 1 1
18 4098 1 1 4 GLN CB C 2.163 7.860 1.950 1.00 . A A . 4 GLN CB 1 1
18 4099 1 1 4 GLN CD C 4.561 7.448 1.000 1.00 . A A . 4 GLN CD 1 1
18 4100 1 1 4 GLN CG C 3.487 8.470 1.429 1.00 . A A . 4 GLN CG 1 1
18 4101 1 1 4 GLN H H 0.343 8.788 0.048 1.00 . A A . 4 GLN H 1 1
18 4102 1 1 4 GLN HA H 2.110 6.389 0.408 1.00 . A A . 4 GLN HA 1 1
18 4103 1 1 4 GLN HB2 H 1.522 8.664 2.358 1.00 . A A . 4 GLN HB2 1 1
18 4104 1 1 4 GLN HB3 H 2.409 7.234 2.830 1.00 . A A . 4 GLN HB3 1 1
18 4105 1 1 4 GLN HE21 H 4.692 8.304 -0.810 1.00 . A A . 4 GLN HE21 1 1
18 4106 1 1 4 GLN HE22 H 5.787 6.871 -0.478 1.00 . A A . 4 GLN HE22 1 1
18 4107 1 1 4 GLN HG2 H 3.255 9.177 0.609 1.00 . A A . 4 GLN HG2 1 1
18 4108 1 1 4 GLN HG3 H 3.918 9.086 2.237 1.00 . A A . 4 GLN HG3 1 1
18 4109 1 1 4 GLN N N 0.753 7.873 -0.141 1.00 . A A . 4 GLN N 1 1
18 4110 1 1 4 GLN NE2 N 5.060 7.548 -0.224 1.00 . A A . 4 GLN NE2 1 1
18 4111 1 1 4 GLN O O 0.928 4.973 2.054 1.00 . A A . 4 GLN O 1 1
18 4112 1 1 4 GLN OE1 O 4.951 6.563 1.760 1.00 . A A . 4 GLN OE1 1 1
18 4113 1 1 5 . C C -1.756 3.917 1.096 1.00 . A A . 5 DIV C 1 1
18 4114 1 1 5 . CA C -1.938 5.178 2.042 1.00 . A A . 5 DIV CA 1 1
18 4115 1 1 5 . CB1 C -1.842 4.846 3.580 1.00 . A A . 5 DIV CB1 1 1
18 4116 1 1 5 . CB2 C -3.333 5.822 1.789 1.00 . A A . 5 DIV CB2 1 1
18 4117 1 1 5 . CG1 C -2.910 3.920 4.203 1.00 . A A . 5 DIV CG1 1 1
18 4118 1 1 5 . H H -1.196 7.150 1.343 1.00 . A A . 5 DIV H 1 1
18 4119 1 1 5 . HB11 H -0.855 4.398 3.796 1.00 . A A . 5 DIV HB11 1 1
18 4120 1 1 5 . HB12 H -1.850 5.786 4.164 1.00 . A A . 5 DIV HB12 1 1
18 4121 1 1 5 . HB21 H -3.494 6.108 0.738 1.00 . A A . 5 DIV HB21 1 1
18 4122 1 1 5 . HB22 H -4.160 5.126 2.025 1.00 . A A . 5 DIV HB22 1 1
18 4123 1 1 5 . HB23 H -3.501 6.731 2.396 1.00 . A A . 5 DIV HB23 1 1
18 4124 1 1 5 . HG11 H -3.011 2.966 3.659 1.00 . A A . 5 DIV HG11 1 1
18 4125 1 1 5 . HG12 H -2.658 3.673 5.250 1.00 . A A . 5 DIV HG12 1 1
18 4126 1 1 5 . HG13 H -3.907 4.395 4.217 1.00 . A A . 5 DIV HG13 1 1
18 4127 1 1 5 . N N -0.917 6.237 1.717 1.00 . A A . 5 DIV N 1 1
18 4128 1 1 5 . O O -1.523 2.809 1.584 1.00 . A A . 5 DIV O 1 1
18 4129 1 1 6 ILE C C -0.028 2.471 -1.237 1.00 . A A . 6 ILE C 1 1
18 4130 1 1 6 ILE CA C -1.500 2.993 -1.222 1.00 . A A . 6 ILE CA 1 1
18 4131 1 1 6 ILE CB C -2.109 3.247 -2.649 1.00 . A A . 6 ILE CB 1 1
18 4132 1 1 6 ILE CD1 C -1.859 4.605 -4.886 1.00 . A A . 6 ILE CD1 1 1
18 4133 1 1 6 ILE CG1 C -1.539 4.495 -3.388 1.00 . A A . 6 ILE CG1 1 1
18 4134 1 1 6 ILE CG2 C -3.660 3.261 -2.615 1.00 . A A . 6 ILE CG2 1 1
18 4135 1 1 6 ILE H H -2.051 5.010 -0.594 1.00 . A A . 6 ILE H 1 1
18 4136 1 1 6 ILE HA H -2.071 2.145 -0.822 1.00 . A A . 6 ILE HA 1 1
18 4137 1 1 6 ILE HB H -1.836 2.363 -3.258 1.00 . A A . 6 ILE HB 1 1
18 4138 1 1 6 ILE HD11 H -2.943 4.724 -5.071 1.00 . A A . 6 ILE HD11 1 1
18 4139 1 1 6 ILE HD12 H -1.357 5.485 -5.327 1.00 . A A . 6 ILE HD12 1 1
18 4140 1 1 6 ILE HD13 H -1.512 3.713 -5.440 1.00 . A A . 6 ILE HD13 1 1
18 4141 1 1 6 ILE HG12 H -1.879 5.415 -2.887 1.00 . A A . 6 ILE HG12 1 1
18 4142 1 1 6 ILE HG13 H -0.439 4.508 -3.298 1.00 . A A . 6 ILE HG13 1 1
18 4143 1 1 6 ILE HG21 H -4.057 4.138 -2.072 1.00 . A A . 6 ILE HG21 1 1
18 4144 1 1 6 ILE HG22 H -4.097 3.280 -3.628 1.00 . A A . 6 ILE HG22 1 1
18 4145 1 1 6 ILE HG23 H -4.066 2.360 -2.119 1.00 . A A . 6 ILE HG23 1 1
18 4146 1 1 6 ILE N N -1.768 4.089 -0.253 1.00 . A A . 6 ILE N 1 1
18 4147 1 1 6 ILE O O 0.150 1.261 -1.131 1.00 . A A . 6 ILE O 1 1
18 4148 1 1 7 THR C C 2.981 2.096 -0.210 1.00 . A A . 7 THR C 1 1
18 4149 1 1 7 THR CA C 2.442 2.901 -1.445 1.00 . A A . 7 THR CA 1 1
18 4150 1 1 7 THR CB C 3.344 4.116 -1.837 1.00 . A A . 7 THR CB 1 1
18 4151 1 1 7 THR CG2 C 4.817 3.773 -2.127 1.00 . A A . 7 THR CG2 1 1
18 4152 1 1 7 THR H H 0.739 4.319 -1.403 1.00 . A A . 7 THR H 1 1
18 4153 1 1 7 THR HA H 2.486 2.206 -2.307 1.00 . A A . 7 THR HA 1 1
18 4154 1 1 7 THR HB H 3.320 4.864 -1.023 1.00 . A A . 7 THR HB 1 1
18 4155 1 1 7 THR HG1 H 3.407 5.504 -3.173 1.00 . A A . 7 THR HG1 1 1
18 4156 1 1 7 THR HG21 H 5.381 4.668 -2.448 1.00 . A A . 7 THR HG21 1 1
18 4157 1 1 7 THR HG22 H 5.331 3.372 -1.236 1.00 . A A . 7 THR HG22 1 1
18 4158 1 1 7 THR HG23 H 4.910 3.017 -2.931 1.00 . A A . 7 THR HG23 1 1
18 4159 1 1 7 THR N N 1.010 3.332 -1.335 1.00 . A A . 7 THR N 1 1
18 4160 1 1 7 THR O O 3.613 1.057 -0.410 1.00 . A A . 7 THR O 1 1
18 4161 1 1 7 THR OG1 O 2.847 4.738 -3.021 1.00 . A A . 7 THR OG1 1 1
18 4162 1 1 8 ABA C C 2.076 0.363 2.307 1.00 . A A . 8 AIB C 1 1
18 4163 1 1 8 ABA CA C 2.875 1.727 2.291 1.00 . A A . 8 AIB CA 1 1
18 4164 1 1 8 ABA H H 2.028 3.309 1.006 1.00 . A A . 8 AIB H 1 1
18 4165 1 1 8 ABA N N 2.701 2.542 1.037 1.00 . A A . 8 AIB N 1 1
18 4166 1 1 8 ABA O O 2.553 -0.633 2.861 1.00 . A A . 8 AIB O 1 1
18 4167 1 1 9 LEU C C 0.627 -1.785 0.248 1.00 . A A . 9 LEU C 1 1
18 4168 1 1 9 LEU CA C 0.123 -0.940 1.456 1.00 . A A . 9 LEU CA 1 1
18 4169 1 1 9 LEU CB C -1.389 -0.607 1.317 1.00 . A A . 9 LEU CB 1 1
18 4170 1 1 9 LEU CD1 C -2.658 -2.021 3.047 1.00 . A A . 9 LEU CD1 1 1
18 4171 1 1 9 LEU CD2 C -1.715 0.199 3.801 1.00 . A A . 9 LEU CD2 1 1
18 4172 1 1 9 LEU CG C -2.266 -0.596 2.601 1.00 . A A . 9 LEU CG 1 1
18 4173 1 1 9 LEU H H 0.551 1.151 1.204 1.00 . A A . 9 LEU H 1 1
18 4174 1 1 9 LEU HA H 0.223 -1.580 2.344 1.00 . A A . 9 LEU HA 1 1
18 4175 1 1 9 LEU HB2 H -1.524 0.353 0.784 1.00 . A A . 9 LEU HB2 1 1
18 4176 1 1 9 LEU HB3 H -1.858 -1.328 0.622 1.00 . A A . 9 LEU HB3 1 1
18 4177 1 1 9 LEU HD11 H -1.787 -2.599 3.412 1.00 . A A . 9 LEU HD11 1 1
18 4178 1 1 9 LEU HD12 H -3.405 -2.004 3.862 1.00 . A A . 9 LEU HD12 1 1
18 4179 1 1 9 LEU HD13 H -3.110 -2.602 2.219 1.00 . A A . 9 LEU HD13 1 1
18 4180 1 1 9 LEU HD21 H -1.416 1.223 3.521 1.00 . A A . 9 LEU HD21 1 1
18 4181 1 1 9 LEU HD22 H -2.474 0.296 4.598 1.00 . A A . 9 LEU HD22 1 1
18 4182 1 1 9 LEU HD23 H -0.826 -0.282 4.251 1.00 . A A . 9 LEU HD23 1 1
18 4183 1 1 9 LEU HG H -3.192 -0.080 2.294 1.00 . A A . 9 LEU HG 1 1
18 4184 1 1 9 LEU N N 0.860 0.316 1.711 1.00 . A A . 9 LEU N 1 1
18 4185 1 1 9 LEU O O 0.228 -2.947 0.191 1.00 . A A . 9 LEU O 1 1
18 4186 1 1 10 ABA C C 2.618 -3.471 -1.526 1.00 . A A . 10 AIB C 1 1
18 4187 1 1 10 ABA CA C 1.979 -2.051 -1.879 1.00 . A A . 10 AIB CA 1 1
18 4188 1 1 10 ABA H H 1.736 -0.290 -0.518 1.00 . A A . 10 AIB H 1 1
18 4189 1 1 10 ABA N N 1.461 -1.272 -0.700 1.00 . A A . 10 AIB N 1 1
18 4190 1 1 10 ABA O O 2.141 -4.475 -2.073 1.00 . A A . 10 AIB O 1 1
18 4191 1 1 11 HYP C C 3.003 -5.825 0.714 1.00 . A A . 11 HYP C 1 1
18 4192 1 1 11 HYP CA C 4.044 -5.015 -0.136 1.00 . A A . 11 HYP CA 1 1
18 4193 1 1 11 HYP CB C 5.323 -4.694 0.658 1.00 . A A . 11 HYP CB 1 1
18 4194 1 1 11 HYP CD C 4.150 -2.601 0.275 1.00 . A A . 11 HYP CD 1 1
18 4195 1 1 11 HYP CG C 5.083 -3.310 1.267 1.00 . A A . 11 HYP CG 1 1
18 4196 1 1 11 HYP HA H 4.322 -5.640 -1.008 1.00 . A A . 11 HYP HA 1 1
18 4197 1 1 11 HYP HB2 H 5.566 -5.454 1.425 1.00 . A A . 11 HYP HB2 1 1
18 4198 1 1 11 HYP HB3 H 6.191 -4.664 -0.029 1.00 . A A . 11 HYP HB3 1 1
18 4199 1 1 11 HYP HD1 H 6.851 -3.158 2.005 1.00 . A A . 11 HYP HD1 1 1
18 4200 1 1 11 HYP HD22 H 3.326 -2.124 0.827 1.00 . A A . 11 HYP HD22 1 1
18 4201 1 1 11 HYP HD23 H 4.647 -1.806 -0.299 1.00 . A A . 11 HYP HD23 1 1
18 4202 1 1 11 HYP HG H 4.575 -3.418 2.245 1.00 . A A . 11 HYP HG 1 1
18 4203 1 1 11 HYP N N 3.626 -3.660 -0.608 1.00 . A A . 11 HYP N 1 1
18 4204 1 1 11 HYP O O 3.131 -7.048 0.814 1.00 . A A . 11 HYP O 1 1
18 4205 1 1 11 HYP OD1 O 6.306 -2.604 1.440 1.00 . A A . 11 HYP OD1 1 1
18 4206 1 1 12 GLN C C -0.431 -5.988 1.029 1.00 . A A . 12 GLN C 1 1
18 4207 1 1 12 GLN CA C 0.824 -5.764 1.944 1.00 . A A . 12 GLN CA 1 1
18 4208 1 1 12 GLN CB C 0.468 -4.910 3.198 1.00 . A A . 12 GLN CB 1 1
18 4209 1 1 12 GLN CD C 1.116 -3.986 5.504 1.00 . A A . 12 GLN CD 1 1
18 4210 1 1 12 GLN CG C 1.523 -4.892 4.331 1.00 . A A . 12 GLN CG 1 1
18 4211 1 1 12 GLN H H 1.972 -4.150 1.157 1.00 . A A . 12 GLN H 1 1
18 4212 1 1 12 GLN HA H 1.152 -6.736 2.303 1.00 . A A . 12 GLN HA 1 1
18 4213 1 1 12 GLN HB2 H 0.240 -3.873 2.883 1.00 . A A . 12 GLN HB2 1 1
18 4214 1 1 12 GLN HB3 H -0.475 -5.284 3.641 1.00 . A A . 12 GLN HB3 1 1
18 4215 1 1 12 GLN HE21 H 2.168 -2.460 4.731 1.00 . A A . 12 GLN HE21 1 1
18 4216 1 1 12 GLN HE22 H 1.285 -2.157 6.310 1.00 . A A . 12 GLN HE22 1 1
18 4217 1 1 12 GLN HG2 H 1.672 -5.921 4.713 1.00 . A A . 12 GLN HG2 1 1
18 4218 1 1 12 GLN HG3 H 2.511 -4.587 3.937 1.00 . A A . 12 GLN HG3 1 1
18 4219 1 1 12 GLN N N 1.988 -5.152 1.294 1.00 . A A . 12 GLN N 1 1
18 4220 1 1 12 GLN NE2 N 1.559 -2.737 5.510 1.00 . A A . 12 GLN NE2 1 1
18 4221 1 1 12 GLN O O -1.450 -6.390 1.588 1.00 . A A . 12 GLN O 1 1
18 4222 1 1 12 GLN OE1 O 0.394 -4.399 6.409 1.00 . A A . 12 GLN OE1 1 1
18 4223 1 1 13 ABA C C -1.260 -7.932 -1.438 1.00 . A A . 13 AIB C 1 1
18 4224 1 1 13 ABA CA C -1.413 -6.350 -1.285 1.00 . A A . 13 AIB CA 1 1
18 4225 1 1 13 ABA H H 0.496 -5.437 -0.688 1.00 . A A . 13 AIB H 1 1
18 4226 1 1 13 ABA N N -0.410 -5.781 -0.321 1.00 . A A . 13 AIB N 1 1
18 4227 1 1 13 ABA O O -2.283 -8.614 -1.305 1.00 . A A . 13 AIB O 1 1
18 4228 1 1 14 HYP C C -0.188 -10.948 -0.606 1.00 . A A . 14 HYP C 1 1
18 4229 1 1 14 HYP CA C 0.036 -10.068 -1.873 1.00 . A A . 14 HYP CA 1 1
18 4230 1 1 14 HYP CB C 1.445 -10.250 -2.474 1.00 . A A . 14 HYP CB 1 1
18 4231 1 1 14 HYP CD C 1.231 -7.927 -1.917 1.00 . A A . 14 HYP CD 1 1
18 4232 1 1 14 HYP CG C 2.242 -9.069 -1.923 1.00 . A A . 14 HYP CG 1 1
18 4233 1 1 14 HYP HA H -0.697 -10.390 -2.639 1.00 . A A . 14 HYP HA 1 1
18 4234 1 1 14 HYP HB2 H 1.916 -11.221 -2.225 1.00 . A A . 14 HYP HB2 1 1
18 4235 1 1 14 HYP HB3 H 1.395 -10.202 -3.579 1.00 . A A . 14 HYP HB3 1 1
18 4236 1 1 14 HYP HD1 H 3.012 -8.443 -3.567 1.00 . A A . 14 HYP HD1 1 1
18 4237 1 1 14 HYP HD22 H 1.499 -7.217 -1.122 1.00 . A A . 14 HYP HD22 1 1
18 4238 1 1 14 HYP HD23 H 1.239 -7.366 -2.866 1.00 . A A . 14 HYP HD23 1 1
18 4239 1 1 14 HYP HG H 2.558 -9.278 -0.878 1.00 . A A . 14 HYP HG 1 1
18 4240 1 1 14 HYP N N -0.073 -8.589 -1.697 1.00 . A A . 14 HYP N 1 1
18 4241 1 1 14 HYP O O -0.906 -11.945 -0.711 1.00 . A A . 14 HYP O 1 1
18 4242 1 1 14 HYP OD1 O 3.368 -8.763 -2.734 1.00 . A A . 14 HYP OD1 1 1
18 4243 1 1 15 ABA C C -1.254 -11.644 2.261 1.00 . A A . 15 AIB C 1 1
18 4244 1 1 15 ABA CA C 0.265 -11.350 1.855 1.00 . A A . 15 AIB CA 1 1
18 4245 1 1 15 ABA H H 0.964 -9.741 0.513 1.00 . A A . 15 AIB H 1 1
18 4246 1 1 15 ABA N N 0.420 -10.609 0.561 1.00 . A A . 15 AIB N 1 1
18 4247 1 1 15 ABA O O -1.569 -12.816 2.502 1.00 . A A . 15 AIB O 1 1
18 4248 1 1 16 PRO C C -4.395 -11.537 1.097 1.00 . A A . 16 PRO C 1 1
18 4249 1 1 16 PRO CA C -3.695 -11.025 2.402 1.00 . A A . 16 PRO CA 1 1
18 4250 1 1 16 PRO CB C -4.293 -9.701 2.920 1.00 . A A . 16 PRO CB 1 1
18 4251 1 1 16 PRO CD C -2.020 -9.241 2.209 1.00 . A A . 16 PRO CD 1 1
18 4252 1 1 16 PRO CG C -3.408 -8.607 2.329 1.00 . A A . 16 PRO CG 1 1
18 4253 1 1 16 PRO HA H -3.840 -11.792 3.189 1.00 . A A . 16 PRO HA 1 1
18 4254 1 1 16 PRO HB2 H -5.359 -9.561 2.658 1.00 . A A . 16 PRO HB2 1 1
18 4255 1 1 16 PRO HB3 H -4.236 -9.667 4.024 1.00 . A A . 16 PRO HB3 1 1
18 4256 1 1 16 PRO HD2 H -1.546 -8.952 1.258 1.00 . A A . 16 PRO HD2 1 1
18 4257 1 1 16 PRO HD3 H -1.364 -8.890 3.020 1.00 . A A . 16 PRO HD3 1 1
18 4258 1 1 16 PRO HG2 H -3.781 -8.317 1.329 1.00 . A A . 16 PRO HG2 1 1
18 4259 1 1 16 PRO HG3 H -3.404 -7.691 2.950 1.00 . A A . 16 PRO HG3 1 1
18 4260 1 1 16 PRO N N -2.247 -10.695 2.288 1.00 . A A . 16 PRO N 1 1
18 4261 1 1 16 PRO O O -5.231 -12.439 1.205 1.00 . A A . 16 PRO O 1 1
18 4262 1 1 17 PHL C C -3.905 -11.585 -2.488 1.00 . A A . 17 PHL C 1 1
18 4263 1 1 17 PHL CA C -4.878 -11.235 -1.339 1.00 . A A . 17 PHL CA 1 1
18 4264 1 1 17 PHL CB C -5.776 -10.021 -1.723 1.00 . A A . 17 PHL CB 1 1
18 4265 1 1 17 PHL CD1 C -8.003 -10.550 -0.589 1.00 . A A . 17 PHL CD1 1 1
18 4266 1 1 17 PHL CD2 C -6.823 -8.555 0.093 1.00 . A A . 17 PHL CD2 1 1
18 4267 1 1 17 PHL CE1 C -8.991 -10.286 0.356 1.00 . A A . 17 PHL CE1 1 1
18 4268 1 1 17 PHL CE2 C -7.812 -8.291 1.033 1.00 . A A . 17 PHL CE2 1 1
18 4269 1 1 17 PHL CG C -6.904 -9.691 -0.724 1.00 . A A . 17 PHL CG 1 1
18 4270 1 1 17 PHL CZ C -8.898 -9.158 1.166 1.00 . A A . 17 PHL CZ 1 1
18 4271 1 1 17 PHL H H -3.404 -10.209 -0.055 1.00 . A A . 17 PHL H 1 1
18 4272 1 1 17 PHL HA H -5.538 -12.118 -1.211 1.00 . A A . 17 PHL HA 1 1
18 4273 1 1 17 PHL HB2 H -5.142 -9.127 -1.900 1.00 . A A . 17 PHL HB2 1 1
18 4274 1 1 17 PHL HB3 H -6.244 -10.216 -2.707 1.00 . A A . 17 PHL HB3 1 1
18 4275 1 1 17 PHL HC1 H -3.172 -10.775 -2.662 1.00 . A A . 17 PHL HC1 1 1
18 4276 1 1 17 PHL HC2 H -4.461 -11.698 -3.435 1.00 . A A . 17 PHL HC2 1 1
18 4277 1 1 17 PHL HD1 H -8.083 -11.437 -1.202 1.00 . A A . 17 PHL HD1 1 1
18 4278 1 1 17 PHL HD2 H -5.981 -7.881 0.012 1.00 . A A . 17 PHL HD2 1 1
18 4279 1 1 17 PHL HE1 H -9.828 -10.962 0.466 1.00 . A A . 17 PHL HE1 1 1
18 4280 1 1 17 PHL HE2 H -7.740 -7.421 1.669 1.00 . A A . 17 PHL HE2 1 1
18 4281 1 1 17 PHL HO H -3.893 -13.486 -2.176 1.00 . A A . 17 PHL HO 1 1
18 4282 1 1 17 PHL HZ H -9.663 -8.956 1.902 1.00 . A A . 17 PHL HZ 1 1
18 4283 1 1 17 PHL N N -4.112 -10.953 -0.092 1.00 . A A . 17 PHL N 1 1
18 4284 1 1 17 PHL O O -3.219 -12.805 -2.228 1.00 . A A . 17 PHL O 1 1
19 4285 1 1 1 ACE C C -2.030 10.870 0.557 1.00 . A A . 1 ACE C 1 1
19 4286 1 1 1 ACE CH3 C -1.282 12.187 0.398 1.00 . A A . 1 ACE CH3 1 1
19 4287 1 1 1 ACE H1 H -0.855 12.275 -0.619 1.00 . A A . 1 ACE H1 1 1
19 4288 1 1 1 ACE H2 H -1.940 13.056 0.572 1.00 . A A . 1 ACE H2 1 1
19 4289 1 1 1 ACE H3 H -0.437 12.246 1.108 1.00 . A A . 1 ACE H3 1 1
19 4290 1 1 1 ACE O O -1.666 10.042 1.397 1.00 . A A . 1 ACE O 1 1
19 4291 1 1 2 TRP C C -2.603 8.289 -1.251 1.00 . A A . 2 TRP C 1 1
19 4292 1 1 2 TRP CA C -3.590 9.300 -0.570 1.00 . A A . 2 TRP CA 1 1
19 4293 1 1 2 TRP CB C -5.000 9.372 -1.222 1.00 . A A . 2 TRP CB 1 1
19 4294 1 1 2 TRP CD1 C -4.715 10.618 -3.527 1.00 . A A . 2 TRP CD1 1 1
19 4295 1 1 2 TRP CD2 C -5.569 8.564 -3.659 1.00 . A A . 2 TRP CD2 1 1
19 4296 1 1 2 TRP CE2 C -5.471 9.122 -4.958 1.00 . A A . 2 TRP CE2 1 1
19 4297 1 1 2 TRP CE3 C -6.100 7.259 -3.475 1.00 . A A . 2 TRP CE3 1 1
19 4298 1 1 2 TRP CG C -5.093 9.501 -2.752 1.00 . A A . 2 TRP CG 1 1
19 4299 1 1 2 TRP CH2 C -6.434 7.102 -5.882 1.00 . A A . 2 TRP CH2 1 1
19 4300 1 1 2 TRP CZ2 C -5.911 8.382 -6.084 1.00 . A A . 2 TRP CZ2 1 1
19 4301 1 1 2 TRP CZ3 C -6.525 6.550 -4.599 1.00 . A A . 2 TRP CZ3 1 1
19 4302 1 1 2 TRP H H -3.273 11.446 -0.921 1.00 . A A . 2 TRP H 1 1
19 4303 1 1 2 TRP HA H -3.788 8.896 0.438 1.00 . A A . 2 TRP HA 1 1
19 4304 1 1 2 TRP HB2 H -5.549 8.459 -0.918 1.00 . A A . 2 TRP HB2 1 1
19 4305 1 1 2 TRP HB3 H -5.593 10.184 -0.760 1.00 . A A . 2 TRP HB3 1 1
19 4306 1 1 2 TRP HD1 H -4.310 11.532 -3.122 1.00 . A A . 2 TRP HD1 1 1
19 4307 1 1 2 TRP HE1 H -4.767 11.048 -5.678 1.00 . A A . 2 TRP HE1 1 1
19 4308 1 1 2 TRP HE3 H -6.183 6.818 -2.492 1.00 . A A . 2 TRP HE3 1 1
19 4309 1 1 2 TRP HH2 H -6.773 6.529 -6.731 1.00 . A A . 2 TRP HH2 1 1
19 4310 1 1 2 TRP HZ2 H -5.847 8.795 -7.079 1.00 . A A . 2 TRP HZ2 1 1
19 4311 1 1 2 TRP HZ3 H -6.934 5.557 -4.476 1.00 . A A . 2 TRP HZ3 1 1
19 4312 1 1 2 TRP N N -3.029 10.657 -0.319 1.00 . A A . 2 TRP N 1 1
19 4313 1 1 2 TRP NE1 N -4.935 10.400 -4.901 1.00 . A A . 2 TRP NE1 1 1
19 4314 1 1 2 TRP O O -2.680 7.097 -0.960 1.00 . A A . 2 TRP O 1 1
19 4315 1 1 3 ILE C C 0.454 7.355 -1.430 1.00 . A A . 3 ILE C 1 1
19 4316 1 1 3 ILE CA C -0.474 7.957 -2.543 1.00 . A A . 3 ILE CA 1 1
19 4317 1 1 3 ILE CB C 0.362 8.700 -3.648 1.00 . A A . 3 ILE CB 1 1
19 4318 1 1 3 ILE CD1 C 2.129 10.581 -4.078 1.00 . A A . 3 ILE CD1 1 1
19 4319 1 1 3 ILE CG1 C 0.986 10.056 -3.193 1.00 . A A . 3 ILE CG1 1 1
19 4320 1 1 3 ILE CG2 C -0.437 8.849 -4.967 1.00 . A A . 3 ILE CG2 1 1
19 4321 1 1 3 ILE H H -1.717 9.764 -2.285 1.00 . A A . 3 ILE H 1 1
19 4322 1 1 3 ILE HA H -0.912 7.068 -3.023 1.00 . A A . 3 ILE HA 1 1
19 4323 1 1 3 ILE HB H 1.206 8.029 -3.897 1.00 . A A . 3 ILE HB 1 1
19 4324 1 1 3 ILE HD11 H 1.788 10.817 -5.101 1.00 . A A . 3 ILE HD11 1 1
19 4325 1 1 3 ILE HD12 H 2.563 11.507 -3.659 1.00 . A A . 3 ILE HD12 1 1
19 4326 1 1 3 ILE HD13 H 2.950 9.845 -4.159 1.00 . A A . 3 ILE HD13 1 1
19 4327 1 1 3 ILE HG12 H 0.201 10.834 -3.114 1.00 . A A . 3 ILE HG12 1 1
19 4328 1 1 3 ILE HG13 H 1.388 9.957 -2.168 1.00 . A A . 3 ILE HG13 1 1
19 4329 1 1 3 ILE HG21 H -1.296 9.537 -4.859 1.00 . A A . 3 ILE HG21 1 1
19 4330 1 1 3 ILE HG22 H 0.193 9.236 -5.788 1.00 . A A . 3 ILE HG22 1 1
19 4331 1 1 3 ILE HG23 H -0.836 7.875 -5.310 1.00 . A A . 3 ILE HG23 1 1
19 4332 1 1 3 ILE N N -1.653 8.758 -2.093 1.00 . A A . 3 ILE N 1 1
19 4333 1 1 3 ILE O O 1.066 6.314 -1.668 1.00 . A A . 3 ILE O 1 1
19 4334 1 1 4 GLN C C 0.566 6.265 1.655 1.00 . A A . 4 GLN C 1 1
19 4335 1 1 4 GLN CA C 1.288 7.436 0.928 1.00 . A A . 4 GLN CA 1 1
19 4336 1 1 4 GLN CB C 1.677 8.585 1.894 1.00 . A A . 4 GLN CB 1 1
19 4337 1 1 4 GLN CD C 3.227 10.664 2.210 1.00 . A A . 4 GLN CD 1 1
19 4338 1 1 4 GLN CG C 2.883 9.406 1.387 1.00 . A A . 4 GLN CG 1 1
19 4339 1 1 4 GLN H H -0.011 8.836 -0.176 1.00 . A A . 4 GLN H 1 1
19 4340 1 1 4 GLN HA H 2.230 7.009 0.546 1.00 . A A . 4 GLN HA 1 1
19 4341 1 1 4 GLN HB2 H 0.805 9.244 2.077 1.00 . A A . 4 GLN HB2 1 1
19 4342 1 1 4 GLN HB3 H 1.934 8.177 2.893 1.00 . A A . 4 GLN HB3 1 1
19 4343 1 1 4 GLN HE21 H 4.549 11.210 0.801 1.00 . A A . 4 GLN HE21 1 1
19 4344 1 1 4 GLN HE22 H 4.367 12.308 2.259 1.00 . A A . 4 GLN HE22 1 1
19 4345 1 1 4 GLN HG2 H 3.764 8.736 1.353 1.00 . A A . 4 GLN HG2 1 1
19 4346 1 1 4 GLN HG3 H 2.694 9.694 0.336 1.00 . A A . 4 GLN HG3 1 1
19 4347 1 1 4 GLN N N 0.553 7.985 -0.244 1.00 . A A . 4 GLN N 1 1
19 4348 1 1 4 GLN NE2 N 4.142 11.475 1.704 1.00 . A A . 4 GLN NE2 1 1
19 4349 1 1 4 GLN O O 1.217 5.251 1.913 1.00 . A A . 4 GLN O 1 1
19 4350 1 1 4 GLN OE1 O 2.697 10.925 3.290 1.00 . A A . 4 GLN OE1 1 1
19 4351 1 1 5 . C C -1.486 3.975 1.336 1.00 . A A . 5 DIV C 1 1
19 4352 1 1 5 . CA C -1.640 5.212 2.328 1.00 . A A . 5 DIV CA 1 1
19 4353 1 1 5 . CB1 C -1.356 4.880 3.843 1.00 . A A . 5 DIV CB1 1 1
19 4354 1 1 5 . CB2 C -3.096 5.755 2.218 1.00 . A A . 5 DIV CB2 1 1
19 4355 1 1 5 . CG1 C -2.292 3.903 4.586 1.00 . A A . 5 DIV CG1 1 1
19 4356 1 1 5 . H H -1.153 7.273 1.655 1.00 . A A . 5 DIV H 1 1
19 4357 1 1 5 . HB11 H -0.325 4.494 3.946 1.00 . A A . 5 DIV HB11 1 1
19 4358 1 1 5 . HB12 H -1.349 5.817 4.435 1.00 . A A . 5 DIV HB12 1 1
19 4359 1 1 5 . HB21 H -3.356 6.086 1.198 1.00 . A A . 5 DIV HB21 1 1
19 4360 1 1 5 . HB22 H -3.843 4.982 2.480 1.00 . A A . 5 DIV HB22 1 1
19 4361 1 1 5 . HB23 H -3.283 6.614 2.890 1.00 . A A . 5 DIV HB23 1 1
19 4362 1 1 5 . HG11 H -2.414 2.945 4.053 1.00 . A A . 5 DIV HG11 1 1
19 4363 1 1 5 . HG12 H -1.901 3.668 5.593 1.00 . A A . 5 DIV HG12 1 1
19 4364 1 1 5 . HG13 H -3.301 4.332 4.732 1.00 . A A . 5 DIV HG13 1 1
19 4365 1 1 5 . N N -0.756 6.371 1.939 1.00 . A A . 5 DIV N 1 1
19 4366 1 1 5 . O O -1.273 2.842 1.774 1.00 . A A . 5 DIV O 1 1
19 4367 1 1 6 ILE C C 0.045 2.564 -1.135 1.00 . A A . 6 ILE C 1 1
19 4368 1 1 6 ILE CA C -1.396 3.171 -1.055 1.00 . A A . 6 ILE CA 1 1
19 4369 1 1 6 ILE CB C -1.988 3.666 -2.430 1.00 . A A . 6 ILE CB 1 1
19 4370 1 1 6 ILE CD1 C -4.536 3.069 -1.969 1.00 . A A . 6 ILE CD1 1 1
19 4371 1 1 6 ILE CG1 C -3.487 4.113 -2.393 1.00 . A A . 6 ILE CG1 1 1
19 4372 1 1 6 ILE CG2 C -1.794 2.665 -3.600 1.00 . A A . 6 ILE CG2 1 1
19 4373 1 1 6 ILE H H -1.829 5.154 -0.259 1.00 . A A . 6 ILE H 1 1
19 4374 1 1 6 ILE HA H -2.046 2.347 -0.724 1.00 . A A . 6 ILE HA 1 1
19 4375 1 1 6 ILE HB H -1.413 4.568 -2.718 1.00 . A A . 6 ILE HB 1 1
19 4376 1 1 6 ILE HD11 H -4.369 2.718 -0.934 1.00 . A A . 6 ILE HD11 1 1
19 4377 1 1 6 ILE HD12 H -5.553 3.501 -2.003 1.00 . A A . 6 ILE HD12 1 1
19 4378 1 1 6 ILE HD13 H -4.534 2.183 -2.629 1.00 . A A . 6 ILE HD13 1 1
19 4379 1 1 6 ILE HG12 H -3.594 4.972 -1.711 1.00 . A A . 6 ILE HG12 1 1
19 4380 1 1 6 ILE HG13 H -3.774 4.522 -3.381 1.00 . A A . 6 ILE HG13 1 1
19 4381 1 1 6 ILE HG21 H -2.276 1.691 -3.400 1.00 . A A . 6 ILE HG21 1 1
19 4382 1 1 6 ILE HG22 H -2.210 3.051 -4.549 1.00 . A A . 6 ILE HG22 1 1
19 4383 1 1 6 ILE HG23 H -0.725 2.464 -3.797 1.00 . A A . 6 ILE HG23 1 1
19 4384 1 1 6 ILE N N -1.539 4.211 -0.001 1.00 . A A . 6 ILE N 1 1
19 4385 1 1 6 ILE O O 0.139 1.343 -1.074 1.00 . A A . 6 ILE O 1 1
19 4386 1 1 7 THR C C 2.977 1.984 -0.062 1.00 . A A . 7 THR C 1 1
19 4387 1 1 7 THR CA C 2.540 2.820 -1.317 1.00 . A A . 7 THR CA 1 1
19 4388 1 1 7 THR CB C 3.547 3.967 -1.660 1.00 . A A . 7 THR CB 1 1
19 4389 1 1 7 THR CG2 C 5.013 3.524 -1.849 1.00 . A A . 7 THR CG2 1 1
19 4390 1 1 7 THR H H 0.936 4.358 -1.313 1.00 . A A . 7 THR H 1 1
19 4391 1 1 7 THR HA H 2.572 2.125 -2.179 1.00 . A A . 7 THR HA 1 1
19 4392 1 1 7 THR HB H 3.524 4.722 -0.850 1.00 . A A . 7 THR HB 1 1
19 4393 1 1 7 THR HG1 H 3.772 5.342 -2.989 1.00 . A A . 7 THR HG1 1 1
19 4394 1 1 7 THR HG21 H 5.663 4.381 -2.108 1.00 . A A . 7 THR HG21 1 1
19 4395 1 1 7 THR HG22 H 5.432 3.076 -0.929 1.00 . A A . 7 THR HG22 1 1
19 4396 1 1 7 THR HG23 H 5.118 2.775 -2.655 1.00 . A A . 7 THR HG23 1 1
19 4397 1 1 7 THR N N 1.136 3.354 -1.260 1.00 . A A . 7 THR N 1 1
19 4398 1 1 7 THR O O 3.557 0.909 -0.228 1.00 . A A . 7 THR O 1 1
19 4399 1 1 7 THR OG1 O 3.164 4.608 -2.873 1.00 . A A . 7 THR OG1 1 1
19 4400 1 1 8 ABA C C 1.906 0.323 2.430 1.00 . A A . 8 AIB C 1 1
19 4401 1 1 8 ABA CA C 2.746 1.664 2.435 1.00 . A A . 8 AIB CA 1 1
19 4402 1 1 8 ABA H H 2.060 3.279 1.088 1.00 . A A . 8 AIB H 1 1
19 4403 1 1 8 ABA N N 2.669 2.461 1.162 1.00 . A A . 8 AIB N 1 1
19 4404 1 1 8 ABA O O 2.338 -0.688 2.996 1.00 . A A . 8 AIB O 1 1
19 4405 1 1 9 LEU C C 0.434 -1.772 0.305 1.00 . A A . 9 LEU C 1 1
19 4406 1 1 9 LEU CA C -0.062 -0.922 1.513 1.00 . A A . 9 LEU CA 1 1
19 4407 1 1 9 LEU CB C -1.558 -0.547 1.308 1.00 . A A . 9 LEU CB 1 1
19 4408 1 1 9 LEU CD1 C -3.777 0.306 2.184 1.00 . A A . 9 LEU CD1 1 1
19 4409 1 1 9 LEU CD2 C -2.666 -1.616 3.382 1.00 . A A . 9 LEU CD2 1 1
19 4410 1 1 9 LEU CG C -2.423 -0.318 2.578 1.00 . A A . 9 LEU CG 1 1
19 4411 1 1 9 LEU H H 0.484 1.136 1.236 1.00 . A A . 9 LEU H 1 1
19 4412 1 1 9 LEU HA H 0.008 -1.568 2.398 1.00 . A A . 9 LEU HA 1 1
19 4413 1 1 9 LEU HB2 H -1.617 0.345 0.652 1.00 . A A . 9 LEU HB2 1 1
19 4414 1 1 9 LEU HB3 H -2.060 -1.326 0.709 1.00 . A A . 9 LEU HB3 1 1
19 4415 1 1 9 LEU HD11 H -4.361 -0.360 1.520 1.00 . A A . 9 LEU HD11 1 1
19 4416 1 1 9 LEU HD12 H -4.405 0.521 3.069 1.00 . A A . 9 LEU HD12 1 1
19 4417 1 1 9 LEU HD13 H -3.643 1.265 1.647 1.00 . A A . 9 LEU HD13 1 1
19 4418 1 1 9 LEU HD21 H -1.726 -2.051 3.766 1.00 . A A . 9 LEU HD21 1 1
19 4419 1 1 9 LEU HD22 H -3.309 -1.436 4.263 1.00 . A A . 9 LEU HD22 1 1
19 4420 1 1 9 LEU HD23 H -3.160 -2.396 2.772 1.00 . A A . 9 LEU HD23 1 1
19 4421 1 1 9 LEU HG H -1.906 0.403 3.238 1.00 . A A . 9 LEU HG 1 1
19 4422 1 1 9 LEU N N 0.710 0.311 1.796 1.00 . A A . 9 LEU N 1 1
19 4423 1 1 9 LEU O O 0.032 -2.934 0.251 1.00 . A A . 9 LEU O 1 1
19 4424 1 1 10 ABA C C 2.399 -3.432 -1.534 1.00 . A A . 10 AIB C 1 1
19 4425 1 1 10 ABA CA C 1.729 -2.020 -1.858 1.00 . A A . 10 AIB CA 1 1
19 4426 1 1 10 ABA H H 1.590 -0.298 -0.447 1.00 . A A . 10 AIB H 1 1
19 4427 1 1 10 ABA N N 1.253 -1.256 -0.654 1.00 . A A . 10 AIB N 1 1
19 4428 1 1 10 ABA O O 1.934 -4.436 -2.090 1.00 . A A . 10 AIB O 1 1
19 4429 1 1 11 HYP C C 2.873 -5.805 0.697 1.00 . A A . 11 HYP C 1 1
19 4430 1 1 11 HYP CA C 3.868 -4.969 -0.176 1.00 . A A . 11 HYP CA 1 1
19 4431 1 1 11 HYP CB C 5.162 -4.640 0.586 1.00 . A A . 11 HYP CB 1 1
19 4432 1 1 11 HYP CD C 3.991 -2.548 0.213 1.00 . A A . 11 HYP CD 1 1
19 4433 1 1 11 HYP CG C 4.925 -3.256 1.199 1.00 . A A . 11 HYP CG 1 1
19 4434 1 1 11 HYP HA H 4.127 -5.582 -1.061 1.00 . A A . 11 HYP HA 1 1
19 4435 1 1 11 HYP HB2 H 5.421 -5.395 1.352 1.00 . A A . 11 HYP HB2 1 1
19 4436 1 1 11 HYP HB3 H 6.017 -4.606 -0.120 1.00 . A A . 11 HYP HB3 1 1
19 4437 1 1 11 HYP HD1 H 6.652 -3.058 2.012 1.00 . A A . 11 HYP HD1 1 1
19 4438 1 1 11 HYP HD22 H 3.202 -2.018 0.766 1.00 . A A . 11 HYP HD22 1 1
19 4439 1 1 11 HYP HD23 H 4.508 -1.799 -0.402 1.00 . A A . 11 HYP HD23 1 1
19 4440 1 1 11 HYP HG H 4.419 -3.366 2.177 1.00 . A A . 11 HYP HG 1 1
19 4441 1 1 11 HYP N N 3.421 -3.616 -0.628 1.00 . A A . 11 HYP N 1 1
19 4442 1 1 11 HYP O O 3.042 -7.022 0.801 1.00 . A A . 11 HYP O 1 1
19 4443 1 1 11 HYP OD1 O 6.148 -2.550 1.373 1.00 . A A . 11 HYP OD1 1 1
19 4444 1 1 12 GLN C C -0.560 -6.027 1.025 1.00 . A A . 12 GLN C 1 1
19 4445 1 1 12 GLN CA C 0.702 -5.815 1.932 1.00 . A A . 12 GLN CA 1 1
19 4446 1 1 12 GLN CB C 0.379 -5.026 3.239 1.00 . A A . 12 GLN CB 1 1
19 4447 1 1 12 GLN CD C 1.972 -3.791 4.880 1.00 . A A . 12 GLN CD 1 1
19 4448 1 1 12 GLN CG C 1.438 -5.141 4.374 1.00 . A A . 12 GLN CG 1 1
19 4449 1 1 12 GLN H H 1.795 -4.163 1.141 1.00 . A A . 12 GLN H 1 1
19 4450 1 1 12 GLN HA H 1.044 -6.802 2.233 1.00 . A A . 12 GLN HA 1 1
19 4451 1 1 12 GLN HB2 H 0.170 -3.966 2.985 1.00 . A A . 12 GLN HB2 1 1
19 4452 1 1 12 GLN HB3 H -0.576 -5.388 3.664 1.00 . A A . 12 GLN HB3 1 1
19 4453 1 1 12 GLN HE21 H 0.543 -3.722 6.281 1.00 . A A . 12 GLN HE21 1 1
19 4454 1 1 12 GLN HE22 H 1.709 -2.307 6.202 1.00 . A A . 12 GLN HE22 1 1
19 4455 1 1 12 GLN HG2 H 1.027 -5.737 5.212 1.00 . A A . 12 GLN HG2 1 1
19 4456 1 1 12 GLN HG3 H 2.307 -5.739 4.037 1.00 . A A . 12 GLN HG3 1 1
19 4457 1 1 12 GLN N N 1.849 -5.162 1.291 1.00 . A A . 12 GLN N 1 1
19 4458 1 1 12 GLN NE2 N 1.346 -3.215 5.893 1.00 . A A . 12 GLN NE2 1 1
19 4459 1 1 12 GLN O O -1.577 -6.434 1.583 1.00 . A A . 12 GLN O 1 1
19 4460 1 1 12 GLN OE1 O 2.950 -3.254 4.358 1.00 . A A . 12 GLN OE1 1 1
19 4461 1 1 13 ABA C C -1.299 -7.992 -1.460 1.00 . A A . 13 AIB C 1 1
19 4462 1 1 13 ABA CA C -1.512 -6.417 -1.301 1.00 . A A . 13 AIB CA 1 1
19 4463 1 1 13 ABA H H 0.360 -5.447 -0.681 1.00 . A A . 13 AIB H 1 1
19 4464 1 1 13 ABA N N -0.537 -5.818 -0.324 1.00 . A A . 13 AIB N 1 1
19 4465 1 1 13 ABA O O -2.288 -8.716 -1.307 1.00 . A A . 13 AIB O 1 1
19 4466 1 1 14 HYP C C -0.093 -10.987 -0.713 1.00 . A A . 14 HYP C 1 1
19 4467 1 1 14 HYP CA C 0.068 -10.067 -1.963 1.00 . A A . 14 HYP CA 1 1
19 4468 1 1 14 HYP CB C 1.464 -10.181 -2.608 1.00 . A A . 14 HYP CB 1 1
19 4469 1 1 14 HYP CD C 1.183 -7.882 -1.979 1.00 . A A . 14 HYP CD 1 1
19 4470 1 1 14 HYP CG C 2.234 -8.984 -2.051 1.00 . A A . 14 HYP CG 1 1
19 4471 1 1 14 HYP HA H -0.677 -10.399 -2.715 1.00 . A A . 14 HYP HA 1 1
19 4472 1 1 14 HYP HB2 H 1.975 -11.139 -2.399 1.00 . A A . 14 HYP HB2 1 1
19 4473 1 1 14 HYP HB3 H 1.376 -10.111 -3.709 1.00 . A A . 14 HYP HB3 1 1
19 4474 1 1 14 HYP HD1 H 2.927 -8.323 -3.720 1.00 . A A . 14 HYP HD1 1 1
19 4475 1 1 14 HYP HD22 H 1.436 -7.186 -1.170 1.00 . A A . 14 HYP HD22 1 1
19 4476 1 1 14 HYP HD23 H 1.143 -7.295 -2.912 1.00 . A A . 14 HYP HD23 1 1
19 4477 1 1 14 HYP HG H 2.597 -9.208 -1.025 1.00 . A A . 14 HYP HG 1 1
19 4478 1 1 14 HYP N N -0.090 -8.598 -1.747 1.00 . A A . 14 HYP N 1 1
19 4479 1 1 14 HYP O O -0.800 -11.992 -0.821 1.00 . A A . 14 HYP O 1 1
19 4480 1 1 14 HYP OD1 O 3.320 -8.616 -2.894 1.00 . A A . 14 HYP OD1 1 1
19 4481 1 1 15 ABA C C -1.038 -11.784 2.161 1.00 . A A . 15 AIB C 1 1
19 4482 1 1 15 ABA CA C 0.459 -11.449 1.716 1.00 . A A . 15 AIB CA 1 1
19 4483 1 1 15 ABA H H 1.101 -9.804 0.386 1.00 . A A . 15 AIB H 1 1
19 4484 1 1 15 ABA N N 0.555 -10.671 0.438 1.00 . A A . 15 AIB N 1 1
19 4485 1 1 15 ABA O O -1.319 -12.969 2.376 1.00 . A A . 15 AIB O 1 1
19 4486 1 1 16 PRO C C -4.206 -11.736 1.117 1.00 . A A . 16 PRO C 1 1
19 4487 1 1 16 PRO CA C -3.485 -11.229 2.410 1.00 . A A . 16 PRO CA 1 1
19 4488 1 1 16 PRO CB C -4.097 -9.942 2.995 1.00 . A A . 16 PRO CB 1 1
19 4489 1 1 16 PRO CD C -1.856 -9.398 2.225 1.00 . A A . 16 PRO CD 1 1
19 4490 1 1 16 PRO CG C -3.254 -8.803 2.425 1.00 . A A . 16 PRO CG 1 1
19 4491 1 1 16 PRO HA H -3.575 -12.022 3.182 1.00 . A A . 16 PRO HA 1 1
19 4492 1 1 16 PRO HB2 H -5.173 -9.818 2.767 1.00 . A A . 16 PRO HB2 1 1
19 4493 1 1 16 PRO HB3 H -4.010 -9.949 4.100 1.00 . A A . 16 PRO HB3 1 1
19 4494 1 1 16 PRO HD2 H -1.422 -9.055 1.272 1.00 . A A . 16 PRO HD2 1 1
19 4495 1 1 16 PRO HD3 H -1.175 -9.072 3.029 1.00 . A A . 16 PRO HD3 1 1
19 4496 1 1 16 PRO HG2 H -3.669 -8.477 1.452 1.00 . A A . 16 PRO HG2 1 1
19 4497 1 1 16 PRO HG3 H -3.246 -7.918 3.087 1.00 . A A . 16 PRO HG3 1 1
19 4498 1 1 16 PRO N N -2.051 -10.859 2.247 1.00 . A A . 16 PRO N 1 1
19 4499 1 1 16 PRO O O -4.891 -12.760 1.195 1.00 . A A . 16 PRO O 1 1
19 4500 1 1 17 PHL C C -3.788 -12.113 -2.240 1.00 . A A . 17 PHL C 1 1
19 4501 1 1 17 PHL CA C -4.788 -11.409 -1.293 1.00 . A A . 17 PHL CA 1 1
19 4502 1 1 17 PHL CB C -5.433 -10.154 -1.949 1.00 . A A . 17 PHL CB 1 1
19 4503 1 1 17 PHL CD1 C -6.486 -8.408 -0.404 1.00 . A A . 17 PHL CD1 1 1
19 4504 1 1 17 PHL CD2 C -7.902 -10.140 -1.315 1.00 . A A . 17 PHL CD2 1 1
19 4505 1 1 17 PHL CE1 C -7.582 -7.869 0.269 1.00 . A A . 17 PHL CE1 1 1
19 4506 1 1 17 PHL CE2 C -8.996 -9.600 -0.640 1.00 . A A . 17 PHL CE2 1 1
19 4507 1 1 17 PHL CG C -6.638 -9.550 -1.197 1.00 . A A . 17 PHL CG 1 1
19 4508 1 1 17 PHL CZ C -8.836 -8.465 0.148 1.00 . A A . 17 PHL CZ 1 1
19 4509 1 1 17 PHL H H -3.452 -10.225 0.001 1.00 . A A . 17 PHL H 1 1
19 4510 1 1 17 PHL HA H -5.603 -12.133 -1.085 1.00 . A A . 17 PHL HA 1 1
19 4511 1 1 17 PHL HB2 H -4.663 -9.377 -2.125 1.00 . A A . 17 PHL HB2 1 1
19 4512 1 1 17 PHL HB3 H -5.774 -10.413 -2.969 1.00 . A A . 17 PHL HB3 1 1
19 4513 1 1 17 PHL HC1 H -3.279 -12.948 -1.721 1.00 . A A . 17 PHL HC1 1 1
19 4514 1 1 17 PHL HC2 H -2.988 -11.424 -2.569 1.00 . A A . 17 PHL HC2 1 1
19 4515 1 1 17 PHL HD1 H -5.521 -7.933 -0.303 1.00 . A A . 17 PHL HD1 1 1
19 4516 1 1 17 PHL HD2 H -8.043 -11.020 -1.926 1.00 . A A . 17 PHL HD2 1 1
19 4517 1 1 17 PHL HE1 H -7.462 -6.985 0.879 1.00 . A A . 17 PHL HE1 1 1
19 4518 1 1 17 PHL HE2 H -9.968 -10.063 -0.731 1.00 . A A . 17 PHL HE2 1 1
19 4519 1 1 17 PHL HO H -4.743 -11.887 -3.894 1.00 . A A . 17 PHL HO 1 1
19 4520 1 1 17 PHL HZ H -9.686 -8.045 0.669 1.00 . A A . 17 PHL HZ 1 1
19 4521 1 1 17 PHL N N -4.079 -11.038 -0.038 1.00 . A A . 17 PHL N 1 1
19 4522 1 1 17 PHL O O -4.450 -12.643 -3.382 1.00 . A A . 17 PHL O 1 1
20 4523 1 1 1 ACE C C -2.321 9.997 1.559 1.00 . A A . 1 ACE C 1 1
20 4524 1 1 1 ACE CH3 C -1.416 11.104 2.079 1.00 . A A . 1 ACE CH3 1 1
20 4525 1 1 1 ACE H1 H -1.997 11.993 2.385 1.00 . A A . 1 ACE H1 1 1
20 4526 1 1 1 ACE H2 H -0.828 10.759 2.948 1.00 . A A . 1 ACE H2 1 1
20 4527 1 1 1 ACE H3 H -0.691 11.412 1.301 1.00 . A A . 1 ACE H3 1 1
20 4528 1 1 1 ACE O O -2.348 8.896 2.110 1.00 . A A . 1 ACE O 1 1
20 4529 1 1 2 TRP C C -2.552 8.408 -1.196 1.00 . A A . 2 TRP C 1 1
20 4530 1 1 2 TRP CA C -3.614 9.276 -0.440 1.00 . A A . 2 TRP CA 1 1
20 4531 1 1 2 TRP CB C -4.609 9.939 -1.435 1.00 . A A . 2 TRP CB 1 1
20 4532 1 1 2 TRP CD1 C -5.975 11.895 -0.339 1.00 . A A . 2 TRP CD1 1 1
20 4533 1 1 2 TRP CD2 C -7.114 10.003 -0.611 1.00 . A A . 2 TRP CD2 1 1
20 4534 1 1 2 TRP CE2 C -7.953 10.985 -0.025 1.00 . A A . 2 TRP CE2 1 1
20 4535 1 1 2 TRP CE3 C -7.619 8.710 -0.904 1.00 . A A . 2 TRP CE3 1 1
20 4536 1 1 2 TRP CG C -5.866 10.569 -0.810 1.00 . A A . 2 TRP CG 1 1
20 4537 1 1 2 TRP CH2 C -9.783 9.403 -0.026 1.00 . A A . 2 TRP CH2 1 1
20 4538 1 1 2 TRP CZ2 C -9.304 10.681 0.270 1.00 . A A . 2 TRP CZ2 1 1
20 4539 1 1 2 TRP CZ3 C -8.954 8.433 -0.604 1.00 . A A . 2 TRP CZ3 1 1
20 4540 1 1 2 TRP H H -2.969 11.279 0.163 1.00 . A A . 2 TRP H 1 1
20 4541 1 1 2 TRP HA H -4.201 8.604 0.206 1.00 . A A . 2 TRP HA 1 1
20 4542 1 1 2 TRP HB2 H -4.081 10.702 -2.037 1.00 . A A . 2 TRP HB2 1 1
20 4543 1 1 2 TRP HB3 H -4.939 9.187 -2.179 1.00 . A A . 2 TRP HB3 1 1
20 4544 1 1 2 TRP HD1 H -5.172 12.616 -0.354 1.00 . A A . 2 TRP HD1 1 1
20 4545 1 1 2 TRP HE1 H -7.615 13.055 0.543 1.00 . A A . 2 TRP HE1 1 1
20 4546 1 1 2 TRP HE3 H -6.993 7.954 -1.355 1.00 . A A . 2 TRP HE3 1 1
20 4547 1 1 2 TRP HH2 H -10.814 9.160 0.192 1.00 . A A . 2 TRP HH2 1 1
20 4548 1 1 2 TRP HZ2 H -9.957 11.421 0.710 1.00 . A A . 2 TRP HZ2 1 1
20 4549 1 1 2 TRP HZ3 H -9.355 7.455 -0.824 1.00 . A A . 2 TRP HZ3 1 1
20 4550 1 1 2 TRP N N -3.000 10.301 0.447 1.00 . A A . 2 TRP N 1 1
20 4551 1 1 2 TRP NE1 N -7.262 12.173 0.157 1.00 . A A . 2 TRP NE1 1 1
20 4552 1 1 2 TRP O O -2.675 7.182 -1.219 1.00 . A A . 2 TRP O 1 1
20 4553 1 1 3 ILE C C 0.562 7.564 -1.306 1.00 . A A . 3 ILE C 1 1
20 4554 1 1 3 ILE CA C -0.323 8.340 -2.340 1.00 . A A . 3 ILE CA 1 1
20 4555 1 1 3 ILE CB C 0.457 9.246 -3.360 1.00 . A A . 3 ILE CB 1 1
20 4556 1 1 3 ILE CD1 C 0.797 7.466 -5.252 1.00 . A A . 3 ILE CD1 1 1
20 4557 1 1 3 ILE CG1 C 1.438 8.490 -4.304 1.00 . A A . 3 ILE CG1 1 1
20 4558 1 1 3 ILE CG2 C 1.213 10.419 -2.695 1.00 . A A . 3 ILE CG2 1 1
20 4559 1 1 3 ILE H H -1.549 10.070 -1.705 1.00 . A A . 3 ILE H 1 1
20 4560 1 1 3 ILE HA H -0.773 7.550 -2.947 1.00 . A A . 3 ILE HA 1 1
20 4561 1 1 3 ILE HB H -0.297 9.713 -4.023 1.00 . A A . 3 ILE HB 1 1
20 4562 1 1 3 ILE HD11 H -0.012 7.919 -5.857 1.00 . A A . 3 ILE HD11 1 1
20 4563 1 1 3 ILE HD12 H 1.544 7.057 -5.958 1.00 . A A . 3 ILE HD12 1 1
20 4564 1 1 3 ILE HD13 H 0.369 6.609 -4.704 1.00 . A A . 3 ILE HD13 1 1
20 4565 1 1 3 ILE HG12 H 1.976 9.223 -4.935 1.00 . A A . 3 ILE HG12 1 1
20 4566 1 1 3 ILE HG13 H 2.230 7.989 -3.714 1.00 . A A . 3 ILE HG13 1 1
20 4567 1 1 3 ILE HG21 H 2.083 10.062 -2.115 1.00 . A A . 3 ILE HG21 1 1
20 4568 1 1 3 ILE HG22 H 1.597 11.137 -3.443 1.00 . A A . 3 ILE HG22 1 1
20 4569 1 1 3 ILE HG23 H 0.570 10.995 -2.003 1.00 . A A . 3 ILE HG23 1 1
20 4570 1 1 3 ILE N N -1.511 9.047 -1.782 1.00 . A A . 3 ILE N 1 1
20 4571 1 1 3 ILE O O 1.059 6.487 -1.646 1.00 . A A . 3 ILE O 1 1
20 4572 1 1 4 GLN C C 0.483 6.083 1.551 1.00 . A A . 4 GLN C 1 1
20 4573 1 1 4 GLN CA C 1.330 7.289 1.053 1.00 . A A . 4 GLN CA 1 1
20 4574 1 1 4 GLN CB C 1.731 8.181 2.258 1.00 . A A . 4 GLN CB 1 1
20 4575 1 1 4 GLN CD C 2.522 10.568 1.641 1.00 . A A . 4 GLN CD 1 1
20 4576 1 1 4 GLN CG C 2.927 9.132 2.021 1.00 . A A . 4 GLN CG 1 1
20 4577 1 1 4 GLN H H 0.222 8.946 0.088 1.00 . A A . 4 GLN H 1 1
20 4578 1 1 4 GLN HA H 2.268 6.857 0.661 1.00 . A A . 4 GLN HA 1 1
20 4579 1 1 4 GLN HB2 H 0.853 8.726 2.656 1.00 . A A . 4 GLN HB2 1 1
20 4580 1 1 4 GLN HB3 H 2.035 7.517 3.091 1.00 . A A . 4 GLN HB3 1 1
20 4581 1 1 4 GLN HE21 H 3.062 10.265 -0.262 1.00 . A A . 4 GLN HE21 1 1
20 4582 1 1 4 GLN HE22 H 2.375 11.908 0.165 1.00 . A A . 4 GLN HE22 1 1
20 4583 1 1 4 GLN HG2 H 3.507 9.182 2.960 1.00 . A A . 4 GLN HG2 1 1
20 4584 1 1 4 GLN HG3 H 3.631 8.685 1.290 1.00 . A A . 4 GLN HG3 1 1
20 4585 1 1 4 GLN N N 0.721 8.066 -0.064 1.00 . A A . 4 GLN N 1 1
20 4586 1 1 4 GLN NE2 N 2.713 10.969 0.398 1.00 . A A . 4 GLN NE2 1 1
20 4587 1 1 4 GLN O O 1.062 5.015 1.757 1.00 . A A . 4 GLN O 1 1
20 4588 1 1 4 GLN OE1 O 2.034 11.333 2.474 1.00 . A A . 4 GLN OE1 1 1
20 4589 1 1 5 . C C -1.649 3.905 1.066 1.00 . A A . 5 DIV C 1 1
20 4590 1 1 5 . CA C -1.806 5.125 2.064 1.00 . A A . 5 DIV CA 1 1
20 4591 1 1 5 . CB1 C -1.599 4.760 3.585 1.00 . A A . 5 DIV CB1 1 1
20 4592 1 1 5 . CB2 C -3.232 5.729 1.906 1.00 . A A . 5 DIV CB2 1 1
20 4593 1 1 5 . CG1 C -2.578 3.776 4.257 1.00 . A A . 5 DIV CG1 1 1
20 4594 1 1 5 . H H -1.182 7.180 1.506 1.00 . A A . 5 DIV H 1 1
20 4595 1 1 5 . HB11 H -0.580 4.359 3.729 1.00 . A A . 5 DIV HB11 1 1
20 4596 1 1 5 . HB12 H -1.613 5.685 4.195 1.00 . A A . 5 DIV HB12 1 1
20 4597 1 1 5 . HB21 H -3.423 6.119 0.891 1.00 . A A . 5 DIV HB21 1 1
20 4598 1 1 5 . HB22 H -4.024 4.976 2.093 1.00 . A A . 5 DIV HB22 1 1
20 4599 1 1 5 . HB23 H -3.423 6.565 2.607 1.00 . A A . 5 DIV HB23 1 1
20 4600 1 1 5 . HG11 H -2.640 2.811 3.725 1.00 . A A . 5 DIV HG11 1 1
20 4601 1 1 5 . HG12 H -2.266 3.555 5.293 1.00 . A A . 5 DIV HG12 1 1
20 4602 1 1 5 . HG13 H -3.601 4.189 4.312 1.00 . A A . 5 DIV HG13 1 1
20 4603 1 1 5 . N N -0.851 6.237 1.735 1.00 . A A . 5 DIV N 1 1
20 4604 1 1 5 . O O -1.410 2.777 1.508 1.00 . A A . 5 DIV O 1 1
20 4605 1 1 6 ILE C C 0.017 2.517 -1.298 1.00 . A A . 6 ILE C 1 1
20 4606 1 1 6 ILE CA C -1.445 3.067 -1.291 1.00 . A A . 6 ILE CA 1 1
20 4607 1 1 6 ILE CB C -2.066 3.416 -2.690 1.00 . A A . 6 ILE CB 1 1
20 4608 1 1 6 ILE CD1 C -1.172 1.559 -4.388 1.00 . A A . 6 ILE CD1 1 1
20 4609 1 1 6 ILE CG1 C -2.343 2.184 -3.605 1.00 . A A . 6 ILE CG1 1 1
20 4610 1 1 6 ILE CG2 C -1.375 4.571 -3.445 1.00 . A A . 6 ILE CG2 1 1
20 4611 1 1 6 ILE H H -1.989 5.068 -0.567 1.00 . A A . 6 ILE H 1 1
20 4612 1 1 6 ILE HA H -2.067 2.237 -0.930 1.00 . A A . 6 ILE HA 1 1
20 4613 1 1 6 ILE HB H -3.080 3.799 -2.467 1.00 . A A . 6 ILE HB 1 1
20 4614 1 1 6 ILE HD11 H -0.356 1.208 -3.735 1.00 . A A . 6 ILE HD11 1 1
20 4615 1 1 6 ILE HD12 H -1.513 0.684 -4.972 1.00 . A A . 6 ILE HD12 1 1
20 4616 1 1 6 ILE HD13 H -0.736 2.275 -5.109 1.00 . A A . 6 ILE HD13 1 1
20 4617 1 1 6 ILE HG12 H -2.829 1.389 -3.005 1.00 . A A . 6 ILE HG12 1 1
20 4618 1 1 6 ILE HG13 H -3.114 2.470 -4.345 1.00 . A A . 6 ILE HG13 1 1
20 4619 1 1 6 ILE HG21 H -0.343 4.319 -3.749 1.00 . A A . 6 ILE HG21 1 1
20 4620 1 1 6 ILE HG22 H -1.928 4.860 -4.359 1.00 . A A . 6 ILE HG22 1 1
20 4621 1 1 6 ILE HG23 H -1.313 5.470 -2.811 1.00 . A A . 6 ILE HG23 1 1
20 4622 1 1 6 ILE N N -1.700 4.128 -0.277 1.00 . A A . 6 ILE N 1 1
20 4623 1 1 6 ILE O O 0.162 1.298 -1.238 1.00 . A A . 6 ILE O 1 1
20 4624 1 1 7 THR C C 2.920 1.995 -0.123 1.00 . A A . 7 THR C 1 1
20 4625 1 1 7 THR CA C 2.507 2.890 -1.344 1.00 . A A . 7 THR CA 1 1
20 4626 1 1 7 THR CB C 3.443 4.125 -1.557 1.00 . A A . 7 THR CB 1 1
20 4627 1 1 7 THR CG2 C 4.946 3.808 -1.671 1.00 . A A . 7 THR CG2 1 1
20 4628 1 1 7 THR H H 0.836 4.350 -1.364 1.00 . A A . 7 THR H 1 1
20 4629 1 1 7 THR HA H 2.621 2.257 -2.246 1.00 . A A . 7 THR HA 1 1
20 4630 1 1 7 THR HB H 3.308 4.828 -0.710 1.00 . A A . 7 THR HB 1 1
20 4631 1 1 7 THR HG1 H 3.617 5.610 -2.768 1.00 . A A . 7 THR HG1 1 1
20 4632 1 1 7 THR HG21 H 5.536 4.724 -1.860 1.00 . A A . 7 THR HG21 1 1
20 4633 1 1 7 THR HG22 H 5.343 3.353 -0.744 1.00 . A A . 7 THR HG22 1 1
20 4634 1 1 7 THR HG23 H 5.149 3.107 -2.502 1.00 . A A . 7 THR HG23 1 1
20 4635 1 1 7 THR N N 1.077 3.353 -1.335 1.00 . A A . 7 THR N 1 1
20 4636 1 1 7 THR O O 3.510 0.929 -0.326 1.00 . A A . 7 THR O 1 1
20 4637 1 1 7 THR OG1 O 3.090 4.809 -2.758 1.00 . A A . 7 THR OG1 1 1
20 4638 1 1 8 ABA C C 1.803 0.225 2.288 1.00 . A A . 8 AIB C 1 1
20 4639 1 1 8 ABA CA C 2.638 1.564 2.355 1.00 . A A . 8 AIB CA 1 1
20 4640 1 1 8 ABA H H 1.942 3.206 1.056 1.00 . A A . 8 AIB H 1 1
20 4641 1 1 8 ABA N N 2.580 2.409 1.114 1.00 . A A . 8 AIB N 1 1
20 4642 1 1 8 ABA O O 2.219 -0.801 2.840 1.00 . A A . 8 AIB O 1 1
20 4643 1 1 9 LEU C C 0.425 -1.830 0.097 1.00 . A A . 9 LEU C 1 1
20 4644 1 1 9 LEU CA C -0.134 -0.993 1.285 1.00 . A A . 9 LEU CA 1 1
20 4645 1 1 9 LEU CB C -1.622 -0.619 1.014 1.00 . A A . 9 LEU CB 1 1
20 4646 1 1 9 LEU CD1 C -3.868 0.243 1.834 1.00 . A A . 9 LEU CD1 1 1
20 4647 1 1 9 LEU CD2 C -2.816 -1.714 3.023 1.00 . A A . 9 LEU CD2 1 1
20 4648 1 1 9 LEU CG C -2.532 -0.404 2.255 1.00 . A A . 9 LEU CG 1 1
20 4649 1 1 9 LEU H H 0.405 1.078 1.088 1.00 . A A . 9 LEU H 1 1
20 4650 1 1 9 LEU HA H -0.103 -1.651 2.165 1.00 . A A . 9 LEU HA 1 1
20 4651 1 1 9 LEU HB2 H -1.656 0.277 0.366 1.00 . A A . 9 LEU HB2 1 1
20 4652 1 1 9 LEU HB3 H -2.094 -1.395 0.386 1.00 . A A . 9 LEU HB3 1 1
20 4653 1 1 9 LEU HD11 H -4.443 -0.400 1.140 1.00 . A A . 9 LEU HD11 1 1
20 4654 1 1 9 LEU HD12 H -4.518 0.446 2.707 1.00 . A A . 9 LEU HD12 1 1
20 4655 1 1 9 LEU HD13 H -3.711 1.213 1.325 1.00 . A A . 9 LEU HD13 1 1
20 4656 1 1 9 LEU HD21 H -1.894 -2.171 3.427 1.00 . A A . 9 LEU HD21 1 1
20 4657 1 1 9 LEU HD22 H -3.484 -1.544 3.888 1.00 . A A . 9 LEU HD22 1 1
20 4658 1 1 9 LEU HD23 H -3.300 -2.477 2.382 1.00 . A A . 9 LEU HD23 1 1
20 4659 1 1 9 LEU HG H -2.032 0.299 2.946 1.00 . A A . 9 LEU HG 1 1
20 4660 1 1 9 LEU N N 0.625 0.231 1.621 1.00 . A A . 9 LEU N 1 1
20 4661 1 1 9 LEU O O 0.054 -3.000 0.034 1.00 . A A . 9 LEU O 1 1
20 4662 1 1 10 ABA C C 2.509 -3.460 -1.611 1.00 . A A . 10 AIB C 1 1
20 4663 1 1 10 ABA CA C 1.825 -2.070 -1.999 1.00 . A A . 10 AIB CA 1 1
20 4664 1 1 10 ABA H H 1.604 -0.347 -0.592 1.00 . A A . 10 AIB H 1 1
20 4665 1 1 10 ABA N N 1.271 -1.301 -0.830 1.00 . A A . 10 AIB N 1 1
20 4666 1 1 10 ABA O O 2.063 -4.491 -2.134 1.00 . A A . 10 AIB O 1 1
20 4667 1 1 11 HYP C C 2.959 -5.762 0.680 1.00 . A A . 11 HYP C 1 1
20 4668 1 1 11 HYP CA C 3.976 -4.923 -0.171 1.00 . A A . 11 HYP CA 1 1
20 4669 1 1 11 HYP CB C 5.226 -4.535 0.642 1.00 . A A . 11 HYP CB 1 1
20 4670 1 1 11 HYP CD C 4.021 -2.493 0.160 1.00 . A A . 11 HYP CD 1 1
20 4671 1 1 11 HYP CG C 4.903 -3.157 1.224 1.00 . A A . 11 HYP CG 1 1
20 4672 1 1 11 HYP HA H 4.296 -5.546 -1.029 1.00 . A A . 11 HYP HA 1 1
20 4673 1 1 11 HYP HB2 H 5.475 -5.267 1.434 1.00 . A A . 11 HYP HB2 1 1
20 4674 1 1 11 HYP HB3 H 6.115 -4.475 -0.019 1.00 . A A . 11 HYP HB3 1 1
20 4675 1 1 11 HYP HD1 H 6.605 -2.922 2.089 1.00 . A A . 11 HYP HD1 1 1
20 4676 1 1 11 HYP HD22 H 3.206 -1.944 0.653 1.00 . A A . 11 HYP HD22 1 1
20 4677 1 1 11 HYP HD23 H 4.565 -1.766 -0.457 1.00 . A A . 11 HYP HD23 1 1
20 4678 1 1 11 HYP HG H 4.328 -3.280 2.164 1.00 . A A . 11 HYP HG 1 1
20 4679 1 1 11 HYP N N 3.509 -3.596 -0.677 1.00 . A A . 11 HYP N 1 1
20 4680 1 1 11 HYP O O 3.137 -6.979 0.808 1.00 . A A . 11 HYP O 1 1
20 4681 1 1 11 HYP OD1 O 6.081 -2.400 1.476 1.00 . A A . 11 HYP OD1 1 1
20 4682 1 1 12 GLN C C -0.492 -5.998 0.988 1.00 . A A . 12 GLN C 1 1
20 4683 1 1 12 GLN CA C 0.766 -5.749 1.897 1.00 . A A . 12 GLN CA 1 1
20 4684 1 1 12 GLN CB C 0.413 -4.907 3.161 1.00 . A A . 12 GLN CB 1 1
20 4685 1 1 12 GLN CD C 1.126 -3.972 5.473 1.00 . A A . 12 GLN CD 1 1
20 4686 1 1 12 GLN CG C 1.479 -4.893 4.289 1.00 . A A . 12 GLN CG 1 1
20 4687 1 1 12 GLN H H 1.836 -4.128 1.030 1.00 . A A . 12 GLN H 1 1
20 4688 1 1 12 GLN HA H 1.114 -6.718 2.246 1.00 . A A . 12 GLN HA 1 1
20 4689 1 1 12 GLN HB2 H 0.177 -3.868 2.861 1.00 . A A . 12 GLN HB2 1 1
20 4690 1 1 12 GLN HB3 H -0.523 -5.290 3.610 1.00 . A A . 12 GLN HB3 1 1
20 4691 1 1 12 GLN HE21 H 3.059 -3.496 5.706 1.00 . A A . 12 GLN HE21 1 1
20 4692 1 1 12 GLN HE22 H 1.859 -2.732 6.868 1.00 . A A . 12 GLN HE22 1 1
20 4693 1 1 12 GLN HG2 H 1.618 -5.920 4.676 1.00 . A A . 12 GLN HG2 1 1
20 4694 1 1 12 GLN HG3 H 2.460 -4.603 3.864 1.00 . A A . 12 GLN HG3 1 1
20 4695 1 1 12 GLN N N 1.912 -5.115 1.233 1.00 . A A . 12 GLN N 1 1
20 4696 1 1 12 GLN NE2 N 2.115 -3.325 6.069 1.00 . A A . 12 GLN NE2 1 1
20 4697 1 1 12 GLN O O -1.513 -6.387 1.555 1.00 . A A . 12 GLN O 1 1
20 4698 1 1 12 GLN OE1 O -0.029 -3.837 5.878 1.00 . A A . 12 GLN OE1 1 1
20 4699 1 1 13 ABA C C -1.235 -8.034 -1.431 1.00 . A A . 13 AIB C 1 1
20 4700 1 1 13 ABA CA C -1.449 -6.454 -1.325 1.00 . A A . 13 AIB CA 1 1
20 4701 1 1 13 ABA H H 0.422 -5.444 -0.736 1.00 . A A . 13 AIB H 1 1
20 4702 1 1 13 ABA N N -0.469 -5.827 -0.368 1.00 . A A . 13 AIB N 1 1
20 4703 1 1 13 ABA O O -2.232 -8.753 -1.289 1.00 . A A . 13 AIB O 1 1
20 4704 1 1 14 HYP C C -0.043 -11.007 -0.543 1.00 . A A . 14 HYP C 1 1
20 4705 1 1 14 HYP CA C 0.145 -10.126 -1.817 1.00 . A A . 14 HYP CA 1 1
20 4706 1 1 14 HYP CB C 1.557 -10.259 -2.420 1.00 . A A . 14 HYP CB 1 1
20 4707 1 1 14 HYP CD C 1.257 -7.943 -1.894 1.00 . A A . 14 HYP CD 1 1
20 4708 1 1 14 HYP CG C 2.311 -9.045 -1.884 1.00 . A A . 14 HYP CG 1 1
20 4709 1 1 14 HYP HA H -0.578 -10.483 -2.576 1.00 . A A . 14 HYP HA 1 1
20 4710 1 1 14 HYP HB2 H 2.065 -11.209 -2.170 1.00 . A A . 14 HYP HB2 1 1
20 4711 1 1 14 HYP HB3 H 1.498 -10.220 -3.524 1.00 . A A . 14 HYP HB3 1 1
20 4712 1 1 14 HYP HD1 H 3.060 -8.426 -3.541 1.00 . A A . 14 HYP HD1 1 1
20 4713 1 1 14 HYP HD22 H 1.494 -7.209 -1.115 1.00 . A A . 14 HYP HD22 1 1
20 4714 1 1 14 HYP HD23 H 1.240 -7.403 -2.856 1.00 . A A . 14 HYP HD23 1 1
20 4715 1 1 14 HYP HG H 2.637 -9.227 -0.837 1.00 . A A . 14 HYP HG 1 1
20 4716 1 1 14 HYP N N -0.020 -8.651 -1.661 1.00 . A A . 14 HYP N 1 1
20 4717 1 1 14 HYP O O -0.693 -12.048 -0.649 1.00 . A A . 14 HYP O 1 1
20 4718 1 1 14 HYP OD1 O 3.425 -8.708 -2.700 1.00 . A A . 14 HYP OD1 1 1
20 4719 1 1 15 ABA C C -1.125 -11.673 2.325 1.00 . A A . 15 AIB C 1 1
20 4720 1 1 15 ABA CA C 0.391 -11.365 1.927 1.00 . A A . 15 AIB CA 1 1
20 4721 1 1 15 ABA H H 1.011 -9.722 0.586 1.00 . A A . 15 AIB H 1 1
20 4722 1 1 15 ABA N N 0.526 -10.625 0.630 1.00 . A A . 15 AIB N 1 1
20 4723 1 1 15 ABA O O -1.430 -12.852 2.544 1.00 . A A . 15 AIB O 1 1
20 4724 1 1 16 PRO C C -4.262 -11.624 1.215 1.00 . A A . 16 PRO C 1 1
20 4725 1 1 16 PRO CA C -3.570 -11.083 2.511 1.00 . A A . 16 PRO CA 1 1
20 4726 1 1 16 PRO CB C -4.188 -9.771 3.034 1.00 . A A . 16 PRO CB 1 1
20 4727 1 1 16 PRO CD C -1.921 -9.277 2.298 1.00 . A A . 16 PRO CD 1 1
20 4728 1 1 16 PRO CG C -3.316 -8.660 2.452 1.00 . A A . 16 PRO CG 1 1
20 4729 1 1 16 PRO HA H -3.690 -11.849 3.304 1.00 . A A . 16 PRO HA 1 1
20 4730 1 1 16 PRO HB2 H -5.254 -9.646 2.764 1.00 . A A . 16 PRO HB2 1 1
20 4731 1 1 16 PRO HB3 H -4.138 -9.745 4.137 1.00 . A A . 16 PRO HB3 1 1
20 4732 1 1 16 PRO HD2 H -1.471 -8.976 1.339 1.00 . A A . 16 PRO HD2 1 1
20 4733 1 1 16 PRO HD3 H -1.253 -8.921 3.097 1.00 . A A . 16 PRO HD3 1 1
20 4734 1 1 16 PRO HG2 H -3.703 -8.354 1.461 1.00 . A A . 16 PRO HG2 1 1
20 4735 1 1 16 PRO HG3 H -3.314 -7.757 3.091 1.00 . A A . 16 PRO HG3 1 1
20 4736 1 1 16 PRO N N -2.129 -10.736 2.372 1.00 . A A . 16 PRO N 1 1
20 4737 1 1 16 PRO O O -4.955 -12.642 1.304 1.00 . A A . 16 PRO O 1 1
20 4738 1 1 17 PHL C C -3.697 -11.986 -2.166 1.00 . A A . 17 PHL C 1 1
20 4739 1 1 17 PHL CA C -4.757 -11.372 -1.224 1.00 . A A . 17 PHL CA 1 1
20 4740 1 1 17 PHL CB C -5.473 -10.170 -1.904 1.00 . A A . 17 PHL CB 1 1
20 4741 1 1 17 PHL CD1 C -7.937 -10.196 -1.220 1.00 . A A . 17 PHL CD1 1 1
20 4742 1 1 17 PHL CD2 C -6.526 -8.446 -0.339 1.00 . A A . 17 PHL CD2 1 1
20 4743 1 1 17 PHL CE1 C -9.018 -9.683 -0.510 1.00 . A A . 17 PHL CE1 1 1
20 4744 1 1 17 PHL CE2 C -7.608 -7.934 0.371 1.00 . A A . 17 PHL CE2 1 1
20 4745 1 1 17 PHL CG C -6.679 -9.588 -1.137 1.00 . A A . 17 PHL CG 1 1
20 4746 1 1 17 PHL CZ C -8.854 -8.551 0.287 1.00 . A A . 17 PHL CZ 1 1
20 4747 1 1 17 PHL H H -3.465 -10.150 0.084 1.00 . A A . 17 PHL H 1 1
20 4748 1 1 17 PHL HA H -5.526 -12.150 -1.043 1.00 . A A . 17 PHL HA 1 1
20 4749 1 1 17 PHL HB2 H -4.741 -9.369 -2.128 1.00 . A A . 17 PHL HB2 1 1
20 4750 1 1 17 PHL HB3 H -5.829 -10.488 -2.903 1.00 . A A . 17 PHL HB3 1 1
20 4751 1 1 17 PHL HC1 H -2.866 -11.279 -2.357 1.00 . A A . 17 PHL HC1 1 1
20 4752 1 1 17 PHL HC2 H -4.137 -12.206 -3.155 1.00 . A A . 17 PHL HC2 1 1
20 4753 1 1 17 PHL HD1 H -8.081 -11.077 -1.833 1.00 . A A . 17 PHL HD1 1 1
20 4754 1 1 17 PHL HD2 H -5.564 -7.957 -0.262 1.00 . A A . 17 PHL HD2 1 1
20 4755 1 1 17 PHL HE1 H -9.985 -10.162 -0.573 1.00 . A A . 17 PHL HE1 1 1
20 4756 1 1 17 PHL HE2 H -7.483 -7.057 0.990 1.00 . A A . 17 PHL HE2 1 1
20 4757 1 1 17 PHL HO H -3.938 -13.696 -1.318 1.00 . A A . 17 PHL HO 1 1
20 4758 1 1 17 PHL HZ H -9.693 -8.156 0.839 1.00 . A A . 17 PHL HZ 1 1
20 4759 1 1 17 PHL N N -4.101 -10.958 0.047 1.00 . A A . 17 PHL N 1 1
20 4760 1 1 17 PHL O O -3.179 -13.197 -1.628 1.00 . A A . 17 PHL O 1 1
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