NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
481829 |
1i6y   |
5201 | cing | 3-converted-DOCR | STAR | entry | full | 82 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1i6y
# This DOCR archive file contains, for PDB entry <1i6y>:
#
# - 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, minor 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_1i6y
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1i6y"
_Entry.Version_type original
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 1i6y"
_Entry.PDB_coordinate_file_version 3.20
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 1i6y "Master copy" rr_1i6y
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1i6y
_Assembly.ID 1
_Assembly.Name 1i6y
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 1337.5306
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.PDB_chain_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Magnetic_equivalence_group_code
_Entity_assembly.Role
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 "ION SELECTIVE LIGAND A1" 1 $ION_SELECTIVE_LIGAND_A1 A . no . . . . . . rr_1i6y 1
stop_
save_
save_ION_SELECTIVE_LIGAND_A1
_Entity.Sf_category entity
_Entity.Sf_framecode ION_SELECTIVE_LIGAND_A1
_Entity.Entry_ID rr_1i6y
_Entity.ID 1
_Entity.Name ION_SELECTIVE_LIGAND_A1
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code XCRVVRGDYLDCX
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer yes
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage yes
_Entity.Number_of_monomers 13
_Entity.Paramagnetic no
_Entity.Thiol_state "all free"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 1337.5306
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . ACE . rr_1i6y 1
2 . CYS . rr_1i6y 1
3 . ARG . rr_1i6y 1
4 . VAL . rr_1i6y 1
5 . VAL . rr_1i6y 1
6 . ARG . rr_1i6y 1
7 . GLY . rr_1i6y 1
8 . ASP . rr_1i6y 1
9 . TYR . rr_1i6y 1
10 . LEU . rr_1i6y 1
11 . ASP . rr_1i6y 1
12 . CYS . rr_1i6y 1
13 . NH2 . rr_1i6y 1
stop_
loop_
_Entity_poly_seq.Hetero
_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 rr_1i6y 1
. CYS 2 2 rr_1i6y 1
. ARG 3 3 rr_1i6y 1
. VAL 4 4 rr_1i6y 1
. VAL 5 5 rr_1i6y 1
. ARG 6 6 rr_1i6y 1
. GLY 7 7 rr_1i6y 1
. ASP 8 8 rr_1i6y 1
. TYR 9 9 rr_1i6y 1
. LEU 10 10 rr_1i6y 1
. ASP 11 11 rr_1i6y 1
. CYS 12 12 rr_1i6y 1
. NH2 13 13 rr_1i6y 1
stop_
save_
save_chem_comp_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_ACE
_Chem_comp.Entry_ID rr_1i6y
_Chem_comp.ID ACE
_Chem_comp.Name "ACETYL GROUP"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code ACE
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C2 H3 O"
_Chem_comp.Formula_weight 43.0451
loop_
_Chem_comp_common_name.Name
_Chem_comp_common_name.Type
_Chem_comp_common_name.Entry_ID
_Chem_comp_common_name.Comp_ID
acetaldehyde name rr_1i6y ACE
stop_
save_
save_chem_comp_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NH2
_Chem_comp.Entry_ID rr_1i6y
_Chem_comp.ID NH2
_Chem_comp.Name "AMINO GROUP"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code NH2
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "H2 N"
_Chem_comp.Formula_weight 16.0225
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_1i6y
_Conformer_stat_list.ID 1
_Conformer_stat_list.Conf_family_coord_set_ID 1
_Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures
_Conformer_stat_list.Conformer_submitted_total_num 15
save_
save_ensemble_of_conformers
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Sf_framecode ensemble_of_conformers
_Conformer_family_coord_set.Entry_ID rr_1i6y
_Conformer_family_coord_set.ID 1
loop_
_Conformer_family_refinement.Refine_method
_Conformer_family_refinement.Refine_details
_Conformer_family_refinement.Software_ID
_Conformer_family_refinement.Software_label
_Conformer_family_refinement.Entry_ID
_Conformer_family_refinement.Conformer_family_coord_set_ID
1 . . . rr_1i6y 1
stop_
loop_
_Conformer_family_software.Software_ID
_Conformer_family_software.Software_label
_Conformer_family_software.Method_ID
_Conformer_family_software.Method_label
_Conformer_family_software.Entry_ID
_Conformer_family_software.Conformer_family_coord_set_ID
. . . . rr_1i6y 1
stop_
loop_
_Atom_site.Assembly_ID
_Atom_site.Model_ID
_Atom_site.Model_site_ID
_Atom_site.ID
_Atom_site.Assembly_atom_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.Cartn_x_esd
_Atom_site.Cartn_y_esd
_Atom_site.Cartn_z_esd
_Atom_site.Occupancy
_Atom_site.Occupancy_esd
_Atom_site.Uncertainty
_Atom_site.Ordered_flag
_Atom_site.Footnote_ID
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDBX_label_seq_ID
_Atom_site.PDBX_label_comp_ID
_Atom_site.PDBX_label_atom_ID
_Atom_site.PDBX_formal_charge
_Atom_site.PDBX_label_entity_ID
_Atom_site.PDB_record_ID
_Atom_site.PDB_model_num
_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.Auth_entity_assembly_ID
_Atom_site.Auth_asym_ID
_Atom_site.Auth_chain_ID
_Atom_site.Auth_seq_ID
_Atom_site.Auth_comp_ID
_Atom_site.Auth_atom_ID
_Atom_site.Auth_alt_ID
_Atom_site.Auth_atom_name
_Atom_site.Details
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
. 1 . 1 . 1 1 1 ACE C C 4.060 -5.509 -5.423 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 1 . 2 . 1 1 1 ACE CH3 C 3.703 -6.923 -4.966 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 1 . 3 . 1 1 1 ACE H1 H 4.384 -7.629 -5.419 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 1 . 4 . 1 1 1 ACE H2 H 2.692 -7.153 -5.269 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 1 . 5 . 1 1 1 ACE H3 H 3.781 -6.986 -3.891 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 1 . 6 . 1 1 1 ACE O O 5.169 -5.244 -5.846 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 1 . 7 . 1 1 2 CYS C C 2.874 -2.205 -4.750 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 1 . 8 . 1 1 2 CYS CA C 3.408 -3.207 -5.781 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 1 . 9 . 1 1 2 CYS CB C 2.649 -3.047 -7.102 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 1 . 10 . 1 1 2 CYS H H 2.239 -4.840 -5.003 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 1 . 11 . 1 1 2 CYS HA H 4.465 -3.062 -5.940 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 1 . 12 . 1 1 2 CYS HB2 H 1.713 -3.582 -7.044 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 1 . 13 . 1 1 2 CYS HB3 H 2.449 -1.999 -7.274 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 1 . 14 . 1 1 2 CYS N N 3.127 -4.603 -5.344 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 1 . 15 . 1 1 2 CYS O O 1.758 -2.321 -4.283 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 1 . 16 . 1 1 2 CYS SG S 3.636 -3.706 -8.471 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 1 . 17 . 1 1 3 ARG C C 2.486 0.938 -4.244 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 1 . 18 . 1 1 3 ARG CA C 3.168 -0.180 -3.446 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 1 . 19 . 1 1 3 ARG CB C 4.426 0.304 -2.709 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 1 . 20 . 1 1 3 ARG CD C 5.125 1.375 -0.552 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 1 . 21 . 1 1 3 ARG CG C 4.037 1.322 -1.630 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 1 . 22 . 1 1 3 ARG CZ C 5.518 -0.010 1.398 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 1 . 23 . 1 1 3 ARG H H 4.538 -1.119 -4.822 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 1 . 24 . 1 1 3 ARG HA H 2.477 -0.614 -2.754 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 1 . 25 . 1 1 3 ARG HB2 H 4.916 -0.539 -2.243 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 1 . 26 . 1 1 3 ARG HB3 H 5.101 0.768 -3.412 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 1 . 27 . 1 1 3 ARG HD2 H 6.072 1.050 -0.959 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 1 . 28 . 1 1 3 ARG HD3 H 5.209 2.375 -0.152 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 1 . 29 . 1 1 3 ARG HE H 3.729 0.161 0.552 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 1 . 30 . 1 1 3 ARG HG2 H 3.935 2.296 -2.081 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 1 . 31 . 1 1 3 ARG HG3 H 3.100 1.032 -1.180 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 1 . 32 . 1 1 3 ARG HH11 H 6.807 -0.702 0.033 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 1 . 33 . 1 1 3 ARG HH12 H 7.269 -0.938 1.685 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 1 . 34 . 1 1 3 ARG HH21 H 4.429 0.574 2.974 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 1 . 35 . 1 1 3 ARG HH22 H 5.924 -0.218 3.347 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 1 . 36 . 1 1 3 ARG N N 3.650 -1.207 -4.417 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 1 . 37 . 1 1 3 ARG NE N 4.667 0.439 0.514 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 1 . 38 . 1 1 3 ARG NH1 N 6.617 -0.595 1.008 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 1 . 39 . 1 1 3 ARG NH2 N 5.271 0.127 2.672 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 1 . 40 . 1 1 3 ARG O O 1.387 0.754 -4.734 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 1 . 41 . 1 1 4 VAL C C 3.508 3.834 -6.097 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 1 . 42 . 1 1 4 VAL CA C 2.462 3.141 -5.223 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 1 . 43 . 1 1 4 VAL CB C 1.799 4.109 -4.237 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 1 . 44 . 1 1 4 VAL CG1 C 0.276 3.971 -4.347 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 1 . 45 . 1 1 4 VAL CG2 C 2.219 3.809 -2.790 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 1 . 46 . 1 1 4 VAL H H 3.991 2.212 -4.040 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 1 . 47 . 1 1 4 VAL HA H 1.721 2.692 -5.865 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 1 . 48 . 1 1 4 VAL HB H 2.091 5.112 -4.489 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 1 . 49 . 1 1 4 VAL HG11 H -0.089 3.355 -3.538 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 1 . 50 . 1 1 4 VAL HG12 H 0.024 3.508 -5.290 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 1 . 51 . 1 1 4 VAL HG13 H -0.181 4.947 -4.291 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 1 . 52 . 1 1 4 VAL HG21 H 1.629 4.412 -2.116 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 1 . 53 . 1 1 4 VAL HG22 H 3.263 4.044 -2.662 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 1 . 54 . 1 1 4 VAL HG23 H 2.054 2.764 -2.574 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 1 . 55 . 1 1 4 VAL N N 3.109 2.071 -4.417 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 1 . 56 . 1 1 4 VAL O O 4.652 3.462 -6.083 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 1 . 57 . 1 1 5 VAL C C 4.771 6.665 -7.296 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 1 . 58 . 1 1 5 VAL CA C 4.133 5.399 -7.836 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 1 . 59 . 1 1 5 VAL CB C 3.354 5.717 -9.112 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 1 . 60 . 1 1 5 VAL CG1 C 4.317 6.225 -10.195 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 1 . 61 . 1 1 5 VAL CG2 C 2.647 4.455 -9.616 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 1 . 62 . 1 1 5 VAL H H 2.184 5.051 -6.956 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 1 . 63 . 1 1 5 VAL HA H 4.899 4.687 -8.060 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 1 . 64 . 1 1 5 VAL HB H 2.622 6.480 -8.896 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 1 . 65 . 1 1 5 VAL HG11 H 5.043 5.458 -10.422 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 1 . 66 . 1 1 5 VAL HG12 H 4.826 7.109 -9.842 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 1 . 67 . 1 1 5 VAL HG13 H 3.757 6.464 -11.086 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 1 . 68 . 1 1 5 VAL HG21 H 1.644 4.706 -9.924 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 1 . 69 . 1 1 5 VAL HG22 H 2.607 3.723 -8.825 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 1 . 70 . 1 1 5 VAL HG23 H 3.191 4.048 -10.455 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 1 . 71 . 1 1 5 VAL N N 3.126 4.786 -6.909 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 1 . 72 . 1 1 5 VAL O O 5.705 7.173 -7.880 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 1 . 73 . 1 1 6 ARG C C 6.384 8.024 -5.215 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 1 . 74 . 1 1 6 ARG CA C 4.993 8.404 -5.682 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 1 . 75 . 1 1 6 ARG CB C 4.117 8.854 -4.517 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 1 . 76 . 1 1 6 ARG CD C 2.782 10.782 -3.619 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 1 . 77 . 1 1 6 ARG CG C 3.859 10.362 -4.627 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 1 . 78 . 1 1 6 ARG CZ C 3.983 12.842 -3.142 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 1 . 79 . 1 1 6 ARG H H 3.617 6.735 -5.694 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 1 . 80 . 1 1 6 ARG HA H 5.029 9.164 -6.450 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 1 . 81 . 1 1 6 ARG HB2 H 3.177 8.316 -4.553 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 1 . 82 . 1 1 6 ARG HB3 H 4.618 8.638 -3.587 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 1 . 83 . 1 1 6 ARG HD2 H 1.803 10.486 -3.975 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 1 . 84 . 1 1 6 ARG HD3 H 2.978 10.343 -2.653 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 1 . 85 . 1 1 6 ARG HE H 2.098 12.824 -3.767 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 1 . 86 . 1 1 6 ARG HG2 H 4.776 10.898 -4.422 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 1 . 87 . 1 1 6 ARG HG3 H 3.524 10.595 -5.628 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 1 . 88 . 1 1 6 ARG HH11 H 3.570 12.667 -1.191 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 1 . 89 . 1 1 6 ARG HH12 H 5.081 13.421 -1.572 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 1 . 90 . 1 1 6 ARG HH21 H 4.646 13.155 -5.005 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 1 . 91 . 1 1 6 ARG HH22 H 5.695 13.697 -3.737 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 1 . 92 . 1 1 6 ARG N N 4.345 7.164 -6.186 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 1 . 93 . 1 1 6 ARG NE N 2.873 12.272 -3.532 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 1 . 94 . 1 1 6 ARG NH1 N 4.229 12.989 -1.870 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 1 . 95 . 1 1 6 ARG NH2 N 4.840 13.266 -4.030 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 1 . 96 . 1 1 6 ARG O O 6.654 7.856 -4.044 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 1 . 97 . 1 1 7 GLY C C 8.524 6.014 -5.224 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 1 . 98 . 1 1 7 GLY CA C 8.636 7.395 -5.859 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 1 . 99 . 1 1 7 GLY H H 6.990 7.942 -7.108 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 1 . 100 . 1 1 7 GLY HA2 H 9.226 7.346 -6.765 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 1 . 101 . 1 1 7 GLY HA3 H 9.089 8.077 -5.158 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 1 . 102 . 1 1 7 GLY N N 7.262 7.833 -6.172 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 1 . 103 . 1 1 7 GLY O O 9.271 5.676 -4.325 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 1 . 104 . 1 1 8 ASP C C 6.996 2.734 -5.935 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 1 . 105 . 1 1 8 ASP CA C 7.396 3.877 -4.990 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 1 . 106 . 1 1 8 ASP CB C 6.285 4.102 -3.965 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 1 . 107 . 1 1 8 ASP CG C 6.879 4.684 -2.685 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 1 . 108 . 1 1 8 ASP H H 6.927 5.523 -6.355 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 1 . 109 . 1 1 8 ASP HA H 8.299 3.618 -4.476 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 1 . 110 . 1 1 8 ASP HB2 H 5.558 4.791 -4.371 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 1 . 111 . 1 1 8 ASP HB3 H 5.804 3.161 -3.742 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 1 . 112 . 1 1 8 ASP N N 7.554 5.220 -5.649 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 1 . 113 . 1 1 8 ASP O O 6.982 1.586 -5.527 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 1 . 114 . 1 1 8 ASP OD1 O 7.648 3.986 -2.045 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 1 . 115 . 1 1 8 ASP OD2 O 6.555 5.815 -2.365 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 1 . 116 . 1 1 9 TYR C C 7.348 1.182 -8.704 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 1 . 117 . 1 1 9 TYR CA C 6.181 1.881 -8.035 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 1 . 118 . 1 1 9 TYR CB C 5.256 2.490 -9.096 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 1 . 119 . 1 1 9 TYR CD1 C 3.294 1.498 -7.891 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 1 . 120 . 1 1 9 TYR CD2 C 3.416 1.244 -10.295 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 1 . 121 . 1 1 9 TYR CE1 C 2.092 0.781 -7.875 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 1 . 122 . 1 1 9 TYR CE2 C 2.215 0.523 -10.282 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 1 . 123 . 1 1 9 TYR CG C 3.953 1.730 -9.098 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 1 . 124 . 1 1 9 TYR CZ C 1.551 0.290 -9.072 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 1 . 125 . 1 1 9 TYR H H 6.593 3.921 -7.465 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 1 . 126 . 1 1 9 TYR HA H 5.624 1.164 -7.452 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 1 . 127 . 1 1 9 TYR HB2 H 5.072 3.520 -8.867 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 1 . 128 . 1 1 9 TYR HB3 H 5.715 2.413 -10.070 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 1 . 129 . 1 1 9 TYR HD1 H 3.718 1.879 -6.971 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 1 . 130 . 1 1 9 TYR HD2 H 3.928 1.425 -11.227 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 1 . 131 . 1 1 9 TYR HE1 H 1.584 0.602 -6.942 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 1 . 132 . 1 1 9 TYR HE2 H 1.799 0.149 -11.206 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 1 . 133 . 1 1 9 TYR HH H -0.268 0.041 -9.605 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 1 . 134 . 1 1 9 TYR N N 6.626 3.003 -7.153 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 1 . 135 . 1 1 9 TYR O O 8.423 1.722 -8.868 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 1 . 136 . 1 1 9 TYR OH O 0.368 -0.425 -9.057 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 1 . 137 . 1 1 10 LEU C C 7.955 -0.850 -11.267 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 1 . 138 . 1 1 10 LEU CA C 8.175 -0.843 -9.746 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 1 . 139 . 1 1 10 LEU CB C 8.027 -2.251 -9.153 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 1 . 140 . 1 1 10 LEU CD1 C 9.533 -1.351 -7.334 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 1 . 141 . 1 1 10 LEU CD2 C 7.108 -1.777 -6.861 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 1 . 142 . 1 1 10 LEU CG C 8.336 -2.258 -7.645 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 1 . 143 . 1 1 10 LEU H H 6.220 -0.431 -8.917 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 1 . 144 . 1 1 10 LEU HA H 9.144 -0.448 -9.516 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 1 . 145 . 1 1 10 LEU HB2 H 7.012 -2.590 -9.305 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 1 . 146 . 1 1 10 LEU HB3 H 8.704 -2.921 -9.659 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 1 . 147 . 1 1 10 LEU HD11 H 10.268 -1.445 -8.119 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 1 . 148 . 1 1 10 LEU HD12 H 9.973 -1.644 -6.392 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 1 . 149 . 1 1 10 LEU HD13 H 9.201 -0.325 -7.271 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 1 . 150 . 1 1 10 LEU HD21 H 6.932 -2.441 -6.028 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 1 . 151 . 1 1 10 LEU HD22 H 6.243 -1.776 -7.508 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 1 . 152 . 1 1 10 LEU HD23 H 7.283 -0.777 -6.493 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 1 . 153 . 1 1 10 LEU HG H 8.576 -3.267 -7.342 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 1 . 154 . 1 1 10 LEU N N 7.114 -0.039 -9.082 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 1 . 155 . 1 1 10 LEU O O 8.277 0.104 -11.953 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 1 . 156 . 1 1 11 ASP C C 5.723 -2.428 -13.542 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 1 . 157 . 1 1 11 ASP CA C 7.162 -1.975 -13.268 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 1 . 158 . 1 1 11 ASP CB C 8.159 -3.008 -13.798 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 1 . 159 . 1 1 11 ASP CG C 8.459 -2.710 -15.269 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 1 . 160 . 1 1 11 ASP H H 7.157 -2.661 -11.227 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 1 . 161 . 1 1 11 ASP HA H 7.346 -1.016 -13.727 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 1 . 162 . 1 1 11 ASP HB2 H 9.073 -2.955 -13.225 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 1 . 163 . 1 1 11 ASP HB3 H 7.737 -3.998 -13.714 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 1 . 164 . 1 1 11 ASP N N 7.407 -1.910 -11.797 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 1 . 165 . 1 1 11 ASP O O 5.377 -2.798 -14.649 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 1 . 166 . 1 1 11 ASP OD1 O 7.676 -3.124 -16.108 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 1 . 167 . 1 1 11 ASP OD2 O 9.463 -2.067 -15.529 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 1 . 168 . 1 1 12 CYS C C 2.570 -1.582 -12.919 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 1 . 169 . 1 1 12 CYS CA C 3.464 -2.816 -12.741 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 1 . 170 . 1 1 12 CYS CB C 3.089 -3.588 -11.467 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 1 . 171 . 1 1 12 CYS H H 5.179 -2.089 -11.656 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 1 . 172 . 1 1 12 CYS HA H 3.385 -3.462 -13.600 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 1 . 173 . 1 1 12 CYS HB2 H 2.082 -3.968 -11.563 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 1 . 174 . 1 1 12 CYS HB3 H 3.771 -4.417 -11.338 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 1 . 175 . 1 1 12 CYS N N 4.880 -2.396 -12.540 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 1 . 176 . 1 1 12 CYS O O 1.364 -1.663 -12.798 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 1 . 177 . 1 1 12 CYS SG S 3.186 -2.489 -10.022 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 1 . 178 . 1 1 13 NH2 HN1 H 4.093 -0.364 -13.305 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 1 . 179 . 1 1 13 NH2 HN2 H 2.560 0.364 -13.328 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 1 . 180 . 1 1 13 NH2 N N 3.121 -0.431 -13.208 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 2 . 181 . 1 1 1 ACE C C 4.981 -1.445 -15.376 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 2 . 182 . 1 1 1 ACE CH3 C 4.904 -1.380 -16.903 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 2 . 183 . 1 1 1 ACE H1 H 4.018 -1.895 -17.240 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 2 . 184 . 1 1 1 ACE H2 H 5.778 -1.851 -17.327 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 2 . 185 . 1 1 1 ACE H3 H 4.863 -0.347 -17.216 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 2 . 186 . 1 1 1 ACE O O 5.997 -1.135 -14.785 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 2 . 187 . 1 1 2 CYS C C 4.283 -0.591 -12.616 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 2 . 188 . 1 1 2 CYS CA C 3.907 -1.941 -13.242 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 2 . 189 . 1 1 2 CYS CB C 4.947 -3.013 -12.900 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 2 . 190 . 1 1 2 CYS H H 3.109 -2.092 -15.241 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 2 . 191 . 1 1 2 CYS HA H 2.935 -2.254 -12.895 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 2 . 192 . 1 1 2 CYS HB2 H 5.860 -2.818 -13.443 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 2 . 193 . 1 1 2 CYS HB3 H 5.149 -2.994 -11.839 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 2 . 194 . 1 1 2 CYS N N 3.913 -1.849 -14.736 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 2 . 195 . 1 1 2 CYS O O 5.428 -0.180 -12.636 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 2 . 196 . 1 1 2 CYS SG S 4.307 -4.642 -13.364 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 2 . 197 . 1 1 3 ARG C C 2.626 1.690 -10.276 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 2 . 198 . 1 1 3 ARG CA C 3.606 1.423 -11.429 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 2 . 199 . 1 1 3 ARG CB C 3.425 2.453 -12.553 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 2 . 200 . 1 1 3 ARG CD C 1.475 3.622 -13.594 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 2 . 201 . 1 1 3 ARG CG C 2.074 2.255 -13.248 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 2 . 202 . 1 1 3 ARG CZ C -0.023 5.108 -12.405 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 2 . 203 . 1 1 3 ARG H H 2.408 -0.255 -12.056 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 2 . 204 . 1 1 3 ARG HA H 4.622 1.452 -11.068 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 2 . 205 . 1 1 3 ARG HB2 H 3.467 3.447 -12.137 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 2 . 206 . 1 1 3 ARG HB3 H 4.218 2.334 -13.276 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 2 . 207 . 1 1 3 ARG HD2 H 2.264 4.331 -13.808 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 2 . 208 . 1 1 3 ARG HD3 H 0.805 3.538 -14.435 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 2 . 209 . 1 1 3 ARG HE H 0.782 3.502 -11.557 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 2 . 210 . 1 1 3 ARG HG2 H 2.219 1.685 -14.156 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 2 . 211 . 1 1 3 ARG HG3 H 1.402 1.725 -12.593 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 2 . 212 . 1 1 3 ARG HH11 H 1.515 6.366 -12.154 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 2 . 213 . 1 1 3 ARG HH12 H -0.044 7.107 -12.295 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 2 . 214 . 1 1 3 ARG HH21 H -1.735 4.102 -12.661 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 2 . 215 . 1 1 3 ARG HH22 H -1.883 5.825 -12.582 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 2 . 216 . 1 1 3 ARG N N 3.320 0.099 -12.061 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 2 . 217 . 1 1 3 ARG NE N 0.721 4.035 -12.378 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 2 . 218 . 1 1 3 ARG NH1 N 0.525 6.285 -12.274 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 2 . 219 . 1 1 3 ARG NH2 N -1.314 5.004 -12.562 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 2 . 220 . 1 1 3 ARG O O 1.423 1.616 -10.443 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 2 . 221 . 1 1 4 VAL C C 2.162 3.800 -7.681 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 2 . 222 . 1 1 4 VAL CA C 2.217 2.294 -7.957 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 2 . 223 . 1 1 4 VAL CB C 2.779 1.530 -6.743 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 2 . 224 . 1 1 4 VAL CG1 C 2.014 0.218 -6.566 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 2 . 225 . 1 1 4 VAL CG2 C 4.270 1.228 -6.924 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 2 . 226 . 1 1 4 VAL H H 4.094 2.079 -8.993 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 2 . 227 . 1 1 4 VAL HA H 1.232 1.938 -8.176 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 2 . 228 . 1 1 4 VAL HB H 2.646 2.134 -5.863 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 2 . 229 . 1 1 4 VAL HG11 H 1.075 0.412 -6.070 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 2 . 230 . 1 1 4 VAL HG12 H 2.602 -0.463 -5.969 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 2 . 231 . 1 1 4 VAL HG13 H 1.826 -0.222 -7.535 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 2 . 232 . 1 1 4 VAL HG21 H 4.663 0.797 -6.015 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 2 . 233 . 1 1 4 VAL HG22 H 4.795 2.143 -7.145 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 2 . 234 . 1 1 4 VAL HG23 H 4.399 0.532 -7.738 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 2 . 235 . 1 1 4 VAL N N 3.126 2.011 -9.109 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 2 . 236 . 1 1 4 VAL O O 1.386 4.520 -8.283 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 2 . 237 . 1 1 5 VAL C C 4.299 6.390 -6.811 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 2 . 238 . 1 1 5 VAL CA C 2.949 5.735 -6.463 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 2 . 239 . 1 1 5 VAL CB C 2.636 5.840 -4.962 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 2 . 240 . 1 1 5 VAL CG1 C 1.119 5.890 -4.775 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 2 . 241 . 1 1 5 VAL CG2 C 3.188 4.641 -4.173 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 2 . 242 . 1 1 5 VAL H H 3.577 3.696 -6.307 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 2 . 243 . 1 1 5 VAL HA H 2.161 6.209 -7.025 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 2 . 244 . 1 1 5 VAL HB H 3.070 6.742 -4.583 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 2 . 245 . 1 1 5 VAL HG11 H 0.888 6.026 -3.729 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 2 . 246 . 1 1 5 VAL HG12 H 0.683 4.966 -5.124 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 2 . 247 . 1 1 5 VAL HG13 H 0.714 6.716 -5.344 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 2 . 248 . 1 1 5 VAL HG21 H 2.432 3.873 -4.104 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 2 . 249 . 1 1 5 VAL HG22 H 3.463 4.964 -3.178 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 2 . 250 . 1 1 5 VAL HG23 H 4.053 4.244 -4.669 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 2 . 251 . 1 1 5 VAL N N 2.968 4.284 -6.777 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 2 . 252 . 1 1 5 VAL O O 5.206 5.748 -7.312 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 2 . 253 . 1 1 6 ARG C C 6.834 8.048 -5.951 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 2 . 254 . 1 1 6 ARG CA C 5.712 8.369 -6.926 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 2 . 255 . 1 1 6 ARG CB C 5.384 9.860 -6.858 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 2 . 256 . 1 1 6 ARG CD C 3.717 11.579 -7.578 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 2 . 257 . 1 1 6 ARG CG C 4.338 10.220 -7.915 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 2 . 258 . 1 1 6 ARG CZ C 1.360 12.114 -7.742 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 2 . 259 . 1 1 6 ARG H H 3.696 8.176 -6.166 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 2 . 260 . 1 1 6 ARG HA H 6.005 8.107 -7.921 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 2 . 261 . 1 1 6 ARG HB2 H 4.998 10.095 -5.877 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 2 . 262 . 1 1 6 ARG HB3 H 6.283 10.432 -7.035 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 2 . 263 . 1 1 6 ARG HD2 H 3.554 11.662 -6.511 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 2 . 264 . 1 1 6 ARG HD3 H 4.352 12.380 -7.925 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 2 . 265 . 1 1 6 ARG HE H 2.360 11.232 -9.213 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 2 . 266 . 1 1 6 ARG HG2 H 4.812 10.270 -8.885 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 2 . 267 . 1 1 6 ARG HG3 H 3.566 9.466 -7.929 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 2 . 268 . 1 1 6 ARG HH11 H 1.722 13.975 -8.389 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 2 . 269 . 1 1 6 ARG HH12 H 0.293 13.781 -7.427 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 2 . 270 . 1 1 6 ARG HH21 H 0.745 10.376 -6.963 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 2 . 271 . 1 1 6 ARG HH22 H -0.259 11.746 -6.622 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 2 . 272 . 1 1 6 ARG N N 4.437 7.670 -6.561 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 2 . 273 . 1 1 6 ARG NE N 2.419 11.602 -8.307 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 2 . 274 . 1 1 6 ARG NH1 N 1.105 13.390 -7.862 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 2 . 275 . 1 1 6 ARG NH2 N 0.553 11.353 -7.055 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 2 . 276 . 1 1 6 ARG O O 7.996 8.260 -6.242 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 2 . 277 . 1 1 7 GLY C C 8.348 5.950 -4.386 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 2 . 278 . 1 1 7 GLY CA C 7.596 7.171 -3.855 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 2 . 279 . 1 1 7 GLY H H 5.580 7.331 -4.605 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 2 . 280 . 1 1 7 GLY HA2 H 8.277 8.006 -3.752 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 2 . 281 . 1 1 7 GLY HA3 H 7.164 6.936 -2.897 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 2 . 282 . 1 1 7 GLY N N 6.518 7.517 -4.816 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 2 . 283 . 1 1 7 GLY O O 9.521 5.763 -4.117 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 2 . 284 . 1 1 8 ASP C C 7.565 3.382 -6.903 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 2 . 285 . 1 1 8 ASP CA C 8.348 3.911 -5.701 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 2 . 286 . 1 1 8 ASP CB C 8.329 2.901 -4.555 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 2 . 287 . 1 1 8 ASP CG C 9.595 3.067 -3.711 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 2 . 288 . 1 1 8 ASP H H 6.740 5.299 -5.369 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 2 . 289 . 1 1 8 ASP HA H 9.367 4.135 -5.978 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 2 . 290 . 1 1 8 ASP HB2 H 7.458 3.075 -3.938 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 2 . 291 . 1 1 8 ASP HB3 H 8.292 1.901 -4.956 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 2 . 292 . 1 1 8 ASP N N 7.679 5.119 -5.146 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 2 . 293 . 1 1 8 ASP O O 6.757 2.489 -6.761 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 2 . 294 . 1 1 8 ASP OD1 O 10.657 2.709 -4.194 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 2 . 295 . 1 1 8 ASP OD2 O 9.481 3.551 -2.596 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 2 . 296 . 1 1 9 TYR C C 7.656 2.176 -9.876 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 2 . 297 . 1 1 9 TYR CA C 6.999 3.414 -9.257 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 2 . 298 . 1 1 9 TYR CB C 7.014 4.571 -10.256 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 2 . 299 . 1 1 9 TYR CD1 C 4.501 4.651 -10.313 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 2 . 300 . 1 1 9 TYR CD2 C 5.725 6.692 -9.868 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 2 . 301 . 1 1 9 TYR CE1 C 3.294 5.346 -10.192 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 2 . 302 . 1 1 9 TYR CE2 C 4.516 7.389 -9.752 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 2 . 303 . 1 1 9 TYR CG C 5.716 5.326 -10.150 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 2 . 304 . 1 1 9 TYR CZ C 3.300 6.715 -9.913 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 2 . 305 . 1 1 9 TYR H H 8.424 4.641 -8.185 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 2 . 306 . 1 1 9 TYR HA H 5.977 3.198 -8.967 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 2 . 307 . 1 1 9 TYR HB2 H 7.838 5.232 -10.032 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 2 . 308 . 1 1 9 TYR HB3 H 7.124 4.182 -11.257 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 2 . 309 . 1 1 9 TYR HD1 H 4.497 3.594 -10.528 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 2 . 310 . 1 1 9 TYR HD2 H 6.665 7.208 -9.741 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 2 . 311 . 1 1 9 TYR HE1 H 2.355 4.825 -10.319 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 2 . 312 . 1 1 9 TYR HE2 H 4.522 8.446 -9.538 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 2 . 313 . 1 1 9 TYR HH H 1.496 6.845 -9.301 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 2 . 314 . 1 1 9 TYR N N 7.778 3.911 -8.079 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 2 . 315 . 1 1 9 TYR O O 8.224 2.229 -10.951 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 2 . 316 . 1 1 9 TYR OH O 2.107 7.399 -9.793 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 2 . 317 . 1 1 10 LEU C C 7.301 -1.430 -9.342 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 2 . 318 . 1 1 10 LEU CA C 8.124 -0.208 -9.773 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 2 . 319 . 1 1 10 LEU CB C 9.574 -0.304 -9.282 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 2 . 320 . 1 1 10 LEU CD1 C 9.799 1.449 -7.492 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 2 . 321 . 1 1 10 LEU CD2 C 8.581 -0.682 -6.971 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 2 . 322 . 1 1 10 LEU CG C 9.725 -0.052 -7.775 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 2 . 323 . 1 1 10 LEU H H 7.054 1.035 -8.374 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 2 . 324 . 1 1 10 LEU HA H 8.134 -0.149 -10.841 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 2 . 325 . 1 1 10 LEU HB2 H 9.949 -1.291 -9.504 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 2 . 326 . 1 1 10 LEU HB3 H 10.169 0.420 -9.818 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 2 . 327 . 1 1 10 LEU HD11 H 10.831 1.735 -7.347 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 2 . 328 . 1 1 10 LEU HD12 H 9.239 1.674 -6.601 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 2 . 329 . 1 1 10 LEU HD13 H 9.390 1.997 -8.324 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 2 . 330 . 1 1 10 LEU HD21 H 8.780 -0.568 -5.915 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 2 . 331 . 1 1 10 LEU HD22 H 8.506 -1.732 -7.210 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 2 . 332 . 1 1 10 LEU HD23 H 7.652 -0.193 -7.214 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 2 . 333 . 1 1 10 LEU HG H 10.649 -0.501 -7.470 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 2 . 334 . 1 1 10 LEU N N 7.547 1.052 -9.217 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 2 . 335 . 1 1 10 LEU O O 7.742 -2.557 -9.459 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 2 . 336 . 1 1 11 ASP C C 4.242 -2.728 -9.482 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 2 . 337 . 1 1 11 ASP CA C 5.261 -2.364 -8.398 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 2 . 338 . 1 1 11 ASP CB C 4.547 -1.856 -7.148 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 2 . 339 . 1 1 11 ASP CG C 4.221 -3.032 -6.229 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 2 . 340 . 1 1 11 ASP H H 5.773 -0.303 -8.757 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 2 . 341 . 1 1 11 ASP HA H 5.874 -3.219 -8.151 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 2 . 342 . 1 1 11 ASP HB2 H 5.185 -1.157 -6.629 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 2 . 343 . 1 1 11 ASP HB3 H 3.632 -1.364 -7.436 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 2 . 344 . 1 1 11 ASP N N 6.111 -1.218 -8.842 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 2 . 345 . 1 1 11 ASP O O 3.925 -1.929 -10.338 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 2 . 346 . 1 1 11 ASP OD1 O 5.145 -3.714 -5.822 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 2 . 347 . 1 1 11 ASP OD2 O 3.050 -3.228 -5.945 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 2 . 348 . 1 1 12 CYS C C 1.310 -4.270 -9.900 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 2 . 349 . 1 1 12 CYS CA C 2.728 -4.338 -10.477 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 2 . 350 . 1 1 12 CYS CB C 3.095 -5.778 -10.830 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 2 . 351 . 1 1 12 CYS H H 3.994 -4.557 -8.749 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 2 . 352 . 1 1 12 CYS HA H 2.809 -3.711 -11.350 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 2 . 353 . 1 1 12 CYS HB2 H 3.202 -6.354 -9.923 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 2 . 354 . 1 1 12 CYS HB3 H 2.317 -6.210 -11.442 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 2 . 355 . 1 1 12 CYS N N 3.727 -3.927 -9.450 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 2 . 356 . 1 1 12 CYS O O 0.340 -4.249 -10.631 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 2 . 357 . 1 1 12 CYS SG S 4.659 -5.796 -11.743 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 2 . 358 . 1 1 13 NH2 HN1 H 1.929 -4.243 -8.013 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 2 . 359 . 1 1 13 NH2 HN2 H 0.246 -4.176 -8.226 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 2 . 360 . 1 1 13 NH2 N N 1.149 -4.227 -8.605 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 3 . 361 . 1 1 1 ACE C C 0.874 -5.165 -10.618 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 3 . 362 . 1 1 1 ACE CH3 C -0.102 -6.282 -10.244 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 3 . 363 . 1 1 1 ACE H1 H -0.857 -6.372 -11.010 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 3 . 364 . 1 1 1 ACE H2 H -0.571 -6.048 -9.300 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 3 . 365 . 1 1 1 ACE H3 H 0.436 -7.215 -10.158 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 3 . 366 . 1 1 1 ACE O O 1.762 -4.821 -9.860 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 3 . 367 . 1 1 2 CYS C C 1.114 -2.144 -11.722 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 3 . 368 . 1 1 2 CYS CA C 1.639 -3.500 -12.205 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 3 . 369 . 1 1 2 CYS CB C 1.654 -3.557 -13.734 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 3 . 370 . 1 1 2 CYS H H -0.001 -4.887 -12.381 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 3 . 371 . 1 1 2 CYS HA H 2.632 -3.675 -11.821 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 3 . 372 . 1 1 2 CYS HB2 H 0.662 -3.781 -14.094 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 3 . 373 . 1 1 2 CYS HB3 H 1.974 -2.603 -14.127 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 3 . 374 . 1 1 2 CYS N N 0.719 -4.594 -11.783 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 3 . 375 . 1 1 2 CYS O O 0.452 -1.428 -12.447 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 3 . 376 . 1 1 2 CYS SG S 2.794 -4.849 -14.283 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 3 . 377 . 1 1 3 ARG C C 2.120 0.448 -9.724 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 3 . 378 . 1 1 3 ARG CA C 0.929 -0.483 -9.962 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 3 . 379 . 1 1 3 ARG CB C 0.244 -0.827 -8.639 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 3 . 380 . 1 1 3 ARG CD C -2.001 0.094 -9.228 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 3 . 381 . 1 1 3 ARG CG C -1.220 -1.180 -8.899 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 3 . 382 . 1 1 3 ARG CZ C -3.782 1.162 -7.982 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 3 . 383 . 1 1 3 ARG H H 1.941 -2.385 -9.933 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 3 . 384 . 1 1 3 ARG HA H 0.221 -0.029 -10.639 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 3 . 385 . 1 1 3 ARG HB2 H 0.744 -1.672 -8.186 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 3 . 386 . 1 1 3 ARG HB3 H 0.295 0.021 -7.974 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 3 . 387 . 1 1 3 ARG HD2 H -1.325 0.878 -9.541 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 3 . 388 . 1 1 3 ARG HD3 H -2.735 -0.101 -9.993 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 3 . 389 . 1 1 3 ARG HE H -2.297 0.189 -7.096 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 3 . 390 . 1 1 3 ARG HG2 H -1.283 -1.867 -9.732 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 3 . 391 . 1 1 3 ARG HG3 H -1.642 -1.642 -8.019 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 3 . 392 . 1 1 3 ARG HH11 H -2.872 2.870 -8.498 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 3 . 393 . 1 1 3 ARG HH12 H -4.592 2.965 -8.310 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 3 . 394 . 1 1 3 ARG HH21 H -4.950 -0.381 -7.472 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 3 . 395 . 1 1 3 ARG HH22 H -5.768 1.124 -7.728 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 3 . 396 . 1 1 3 ARG N N 1.405 -1.790 -10.499 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 3 . 397 . 1 1 3 ARG NE N -2.679 0.466 -7.955 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 3 . 398 . 1 1 3 ARG NH1 N -3.746 2.431 -8.287 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 3 . 399 . 1 1 3 ARG NH2 N -4.922 0.591 -7.706 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 3 . 400 . 1 1 3 ARG O O 3.257 0.013 -9.698 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 3 . 401 . 1 1 4 VAL C C 2.689 3.662 -8.198 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 3 . 402 . 1 1 4 VAL CA C 3.024 2.646 -9.296 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 3 . 403 . 1 1 4 VAL CB C 3.277 3.363 -10.635 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 3 . 404 . 1 1 4 VAL CG1 C 2.444 4.645 -10.725 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 3 . 405 . 1 1 4 VAL CG2 C 4.760 3.729 -10.735 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 3 . 406 . 1 1 4 VAL H H 0.962 2.062 -9.561 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 3 . 407 . 1 1 4 VAL HA H 3.902 2.083 -9.019 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 3 . 408 . 1 1 4 VAL HB H 3.012 2.708 -11.448 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 3 . 409 . 1 1 4 VAL HG11 H 2.356 4.946 -11.760 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 3 . 410 . 1 1 4 VAL HG12 H 2.931 5.430 -10.164 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 3 . 411 . 1 1 4 VAL HG13 H 1.461 4.466 -10.317 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 3 . 412 . 1 1 4 VAL HG21 H 4.930 4.297 -11.636 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 3 . 413 . 1 1 4 VAL HG22 H 5.354 2.827 -10.759 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 3 . 414 . 1 1 4 VAL HG23 H 5.043 4.322 -9.876 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 3 . 415 . 1 1 4 VAL N N 1.882 1.719 -9.539 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 3 . 416 . 1 1 4 VAL O O 1.541 3.959 -7.931 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 3 . 417 . 1 1 5 VAL C C 4.552 6.338 -6.777 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 3 . 418 . 1 1 5 VAL CA C 3.498 5.255 -6.550 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 3 . 419 . 1 1 5 VAL CB C 3.699 4.589 -5.180 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 3 . 420 . 1 1 5 VAL CG1 C 2.683 5.166 -4.192 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 3 . 421 . 1 1 5 VAL CG2 C 3.494 3.074 -5.276 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 3 . 422 . 1 1 5 VAL H H 4.616 3.976 -7.865 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 3 . 423 . 1 1 5 VAL HA H 2.505 5.675 -6.622 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 3 . 424 . 1 1 5 VAL HB H 4.698 4.805 -4.829 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 3 . 425 . 1 1 5 VAL HG11 H 3.028 6.126 -3.838 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 3 . 426 . 1 1 5 VAL HG12 H 2.570 4.492 -3.358 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 3 . 427 . 1 1 5 VAL HG13 H 1.730 5.288 -4.689 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 3 . 428 . 1 1 5 VAL HG21 H 2.470 2.866 -5.549 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 3 . 429 . 1 1 5 VAL HG22 H 3.709 2.621 -4.318 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 3 . 430 . 1 1 5 VAL HG23 H 4.156 2.663 -6.022 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 3 . 431 . 1 1 5 VAL N N 3.702 4.217 -7.598 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 3 . 432 . 1 1 5 VAL O O 5.631 6.061 -7.272 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 3 . 433 . 1 1 6 ARG C C 6.388 8.488 -5.579 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 3 . 434 . 1 1 6 ARG CA C 5.307 8.614 -6.647 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 3 . 435 . 1 1 6 ARG CB C 4.568 9.953 -6.546 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 3 . 436 . 1 1 6 ARG CD C 4.192 11.397 -4.551 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 3 . 437 . 1 1 6 ARG CG C 3.864 10.050 -5.194 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 3 . 438 . 1 1 6 ARG CZ C 3.240 13.579 -5.018 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 3 . 439 . 1 1 6 ARG H H 3.422 7.776 -6.006 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 3 . 440 . 1 1 6 ARG HA H 5.731 8.510 -7.625 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 3 . 441 . 1 1 6 ARG HB2 H 5.278 10.766 -6.642 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 3 . 442 . 1 1 6 ARG HB3 H 3.835 10.026 -7.337 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 3 . 443 . 1 1 6 ARG HD2 H 3.732 11.469 -3.574 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 3 . 444 . 1 1 6 ARG HD3 H 5.261 11.528 -4.475 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 3 . 445 . 1 1 6 ARG HE H 3.528 12.214 -6.432 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 3 . 446 . 1 1 6 ARG HG2 H 2.796 9.962 -5.339 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 3 . 447 . 1 1 6 ARG HG3 H 4.207 9.252 -4.554 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 3 . 448 . 1 1 6 ARG HH11 H 5.099 14.315 -4.905 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 3 . 449 . 1 1 6 ARG HH12 H 3.837 15.388 -4.402 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 3 . 450 . 1 1 6 ARG HH21 H 1.292 13.117 -5.023 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 3 . 451 . 1 1 6 ARG HH22 H 1.683 14.711 -4.469 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 3 . 452 . 1 1 6 ARG N N 4.282 7.558 -6.416 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 3 . 453 . 1 1 6 ARG NE N 3.619 12.414 -5.478 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 3 . 454 . 1 1 6 ARG NH1 N 4.128 14.499 -4.754 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 3 . 455 . 1 1 6 ARG NH2 N 1.973 13.821 -4.821 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 3 . 456 . 1 1 6 ARG O O 6.400 9.185 -4.586 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 3 . 457 . 1 1 7 GLY C C 8.644 5.793 -4.833 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 3 . 458 . 1 1 7 GLY CA C 8.380 7.295 -4.821 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 3 . 459 . 1 1 7 GLY H H 7.220 7.008 -6.594 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 3 . 460 . 1 1 7 GLY HA2 H 9.270 7.827 -5.126 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 3 . 461 . 1 1 7 GLY HA3 H 8.085 7.603 -3.830 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 3 . 462 . 1 1 7 GLY N N 7.283 7.559 -5.788 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 3 . 463 . 1 1 7 GLY O O 9.767 5.336 -4.721 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 3 . 464 . 1 1 8 ASP C C 7.270 3.100 -6.457 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 3 . 465 . 1 1 8 ASP CA C 7.760 3.549 -5.085 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 3 . 466 . 1 1 8 ASP CB C 6.864 2.987 -3.976 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 3 . 467 . 1 1 8 ASP CG C 7.626 2.992 -2.648 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 3 . 468 . 1 1 8 ASP H H 6.717 5.423 -5.142 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 3 . 469 . 1 1 8 ASP HA H 8.790 3.258 -4.928 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 3 . 470 . 1 1 8 ASP HB2 H 5.979 3.597 -3.886 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 3 . 471 . 1 1 8 ASP HB3 H 6.577 1.973 -4.220 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 3 . 472 . 1 1 8 ASP N N 7.605 5.024 -5.014 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 3 . 473 . 1 1 8 ASP O O 6.262 2.434 -6.584 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 3 . 474 . 1 1 8 ASP OD1 O 8.297 2.011 -2.369 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 3 . 475 . 1 1 8 ASP OD2 O 7.526 3.975 -1.935 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 3 . 476 . 1 1 9 TYR C C 7.859 1.646 -9.136 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 3 . 477 . 1 1 9 TYR CA C 7.515 3.109 -8.860 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 3 . 478 . 1 1 9 TYR CB C 8.303 4.017 -9.824 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 3 . 479 . 1 1 9 TYR CD1 C 7.026 6.193 -9.964 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 3 . 480 . 1 1 9 TYR CD2 C 9.072 6.128 -8.663 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 3 . 481 . 1 1 9 TYR CE1 C 6.869 7.547 -9.649 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 3 . 482 . 1 1 9 TYR CE2 C 8.914 7.483 -8.346 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 3 . 483 . 1 1 9 TYR CG C 8.127 5.481 -9.471 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 3 . 484 . 1 1 9 TYR CZ C 7.813 8.192 -8.839 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 3 . 485 . 1 1 9 TYR H H 8.764 4.036 -7.377 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 3 . 486 . 1 1 9 TYR HA H 6.457 3.285 -8.971 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 3 . 487 . 1 1 9 TYR HB2 H 9.347 3.765 -9.765 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 3 . 488 . 1 1 9 TYR HB3 H 7.954 3.852 -10.833 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 3 . 489 . 1 1 9 TYR HD1 H 6.296 5.697 -10.585 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 3 . 490 . 1 1 9 TYR HD2 H 9.922 5.582 -8.283 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 3 . 491 . 1 1 9 TYR HE1 H 6.019 8.095 -10.025 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 3 . 492 . 1 1 9 TYR HE2 H 9.642 7.979 -7.716 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 3 . 493 . 1 1 9 TYR HH H 8.179 10.039 -9.158 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 3 . 494 . 1 1 9 TYR N N 7.967 3.483 -7.495 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 3 . 495 . 1 1 9 TYR O O 8.730 1.344 -9.923 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 3 . 496 . 1 1 9 TYR OH O 7.660 9.528 -8.529 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 3 . 497 . 1 1 10 LEU C C 6.383 -1.205 -9.750 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 3 . 498 . 1 1 10 LEU CA C 7.416 -0.701 -8.743 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 3 . 499 . 1 1 10 LEU CB C 7.201 -1.373 -7.380 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 3 . 500 . 1 1 10 LEU CD1 C 9.700 -1.503 -7.139 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 3 . 501 . 1 1 10 LEU CD2 C 8.440 0.356 -6.044 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 3 . 502 . 1 1 10 LEU CG C 8.393 -1.122 -6.443 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 3 . 503 . 1 1 10 LEU H H 6.450 1.012 -7.890 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 3 . 504 . 1 1 10 LEU HA H 8.422 -0.864 -9.095 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 3 . 505 . 1 1 10 LEU HB2 H 6.305 -0.972 -6.927 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 3 . 506 . 1 1 10 LEU HB3 H 7.078 -2.438 -7.520 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 3 . 507 . 1 1 10 LEU HD11 H 10.460 -1.698 -6.395 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 3 . 508 . 1 1 10 LEU HD12 H 10.021 -0.690 -7.774 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 3 . 509 . 1 1 10 LEU HD13 H 9.546 -2.389 -7.737 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 3 . 510 . 1 1 10 LEU HD21 H 8.792 0.944 -6.878 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 3 . 511 . 1 1 10 LEU HD22 H 9.112 0.480 -5.208 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 3 . 512 . 1 1 10 LEU HD23 H 7.451 0.685 -5.763 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 3 . 513 . 1 1 10 LEU HG H 8.276 -1.727 -5.556 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 3 . 514 . 1 1 10 LEU N N 7.161 0.741 -8.508 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 3 . 515 . 1 1 10 LEU O O 5.848 -2.289 -9.617 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 3 . 516 . 1 1 11 ASP C C 5.688 -1.690 -12.821 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 3 . 517 . 1 1 11 ASP CA C 5.051 -0.810 -11.748 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 3 . 518 . 1 1 11 ASP CB C 4.549 0.512 -12.342 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 3 . 519 . 1 1 11 ASP CG C 5.716 1.247 -13.009 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 3 . 520 . 1 1 11 ASP H H 6.508 0.472 -10.812 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 3 . 521 . 1 1 11 ASP HA H 4.239 -1.326 -11.270 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 3 . 522 . 1 1 11 ASP HB2 H 3.779 0.317 -13.076 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 3 . 523 . 1 1 11 ASP HB3 H 4.140 1.127 -11.553 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 3 . 524 . 1 1 11 ASP N N 6.079 -0.407 -10.744 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 3 . 525 . 1 1 11 ASP O O 5.702 -1.360 -13.990 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 3 . 526 . 1 1 11 ASP OD1 O 6.678 1.534 -12.316 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 3 . 527 . 1 1 11 ASP OD2 O 5.628 1.506 -14.197 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 3 . 528 . 1 1 12 CYS C C 7.497 -3.078 -14.549 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 3 . 529 . 1 1 12 CYS CA C 6.875 -3.780 -13.337 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 3 . 530 . 1 1 12 CYS CB C 5.768 -4.744 -13.776 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 3 . 531 . 1 1 12 CYS H H 6.174 -3.029 -11.448 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 3 . 532 . 1 1 12 CYS HA H 7.638 -4.330 -12.806 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 3 . 533 . 1 1 12 CYS HB2 H 6.195 -5.515 -14.399 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 3 . 534 . 1 1 12 CYS HB3 H 5.323 -5.198 -12.902 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 3 . 535 . 1 1 12 CYS N N 6.216 -2.813 -12.404 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 3 . 536 . 1 1 12 CYS O O 7.378 -3.544 -15.665 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 3 . 537 . 1 1 12 CYS SG S 4.498 -3.859 -14.712 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 3 . 538 . 1 1 13 NH2 HN1 H 8.290 -1.610 -13.474 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 3 . 539 . 1 1 13 NH2 HN2 H 8.632 -1.562 -15.135 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 3 . 540 . 1 1 13 NH2 N N 8.193 -1.991 -14.372 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 4 . 541 . 1 1 1 ACE C C 2.372 -1.487 -15.143 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 4 . 542 . 1 1 1 ACE CH3 C 1.747 -1.850 -16.490 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 4 . 543 . 1 1 1 ACE H1 H 1.634 -2.923 -16.559 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 4 . 544 . 1 1 1 ACE H2 H 2.386 -1.502 -17.288 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 4 . 545 . 1 1 1 ACE H3 H 0.777 -1.381 -16.575 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 4 . 546 . 1 1 1 ACE O O 2.732 -0.350 -14.906 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 4 . 547 . 1 1 2 CYS C C 2.296 -1.029 -12.232 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 4 . 548 . 1 1 2 CYS CA C 3.097 -2.136 -12.916 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 4 . 549 . 1 1 2 CYS CB C 4.530 -1.662 -13.202 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 4 . 550 . 1 1 2 CYS H H 2.199 -3.347 -14.461 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 4 . 551 . 1 1 2 CYS HA H 3.115 -3.023 -12.304 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 4 . 552 . 1 1 2 CYS HB2 H 4.763 -1.824 -14.245 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 4 . 553 . 1 1 2 CYS HB3 H 4.612 -0.609 -12.976 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 4 . 554 . 1 1 2 CYS N N 2.500 -2.437 -14.253 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 4 . 555 . 1 1 2 CYS O O 1.309 -0.552 -12.758 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 4 . 556 . 1 1 2 CYS SG S 5.696 -2.591 -12.173 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 4 . 557 . 1 1 3 ARG C C 2.670 1.813 -10.640 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 4 . 558 . 1 1 3 ARG CA C 1.973 0.485 -10.382 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 4 . 559 . 1 1 3 ARG CB C 2.018 0.129 -8.900 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 4 . 560 . 1 1 3 ARG CD C 0.985 -1.412 -7.245 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 4 . 561 . 1 1 3 ARG CG C 0.746 -0.627 -8.531 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 4 . 562 . 1 1 3 ARG CZ C -1.118 -2.366 -6.548 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 4 . 563 . 1 1 3 ARG H H 3.522 -0.986 -10.668 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 4 . 564 . 1 1 3 ARG HA H 0.950 0.522 -10.724 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 4 . 565 . 1 1 3 ARG HB2 H 2.880 -0.492 -8.701 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 4 . 566 . 1 1 3 ARG HB3 H 2.079 1.033 -8.311 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 4 . 567 . 1 1 3 ARG HD2 H 1.981 -1.833 -7.243 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 4 . 568 . 1 1 3 ARG HD3 H 0.839 -0.778 -6.384 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 4 . 569 . 1 1 3 ARG HE H 0.106 -3.293 -7.804 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 4 . 570 . 1 1 3 ARG HG2 H -0.062 0.076 -8.383 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 4 . 571 . 1 1 3 ARG HG3 H 0.488 -1.311 -9.326 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 4 . 572 . 1 1 3 ARG HH11 H -1.729 -0.712 -7.495 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 4 . 573 . 1 1 3 ARG HH12 H -2.766 -1.277 -6.228 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 4 . 574 . 1 1 3 ARG HH21 H -0.749 -3.984 -5.431 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 4 . 575 . 1 1 3 ARG HH22 H -2.210 -3.132 -5.058 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 4 . 576 . 1 1 3 ARG N N 2.715 -0.602 -11.075 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 4 . 577 . 1 1 3 ARG NE N -0.035 -2.490 -7.260 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 4 . 578 . 1 1 3 ARG NH1 N -1.934 -1.374 -6.774 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 4 . 579 . 1 1 3 ARG NH2 N -1.379 -3.228 -5.605 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 4 . 580 . 1 1 3 ARG O O 3.738 1.856 -11.221 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 4 . 581 . 1 1 4 VAL C C 2.612 5.129 -9.248 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 4 . 582 . 1 1 4 VAL CA C 2.742 4.209 -10.466 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 4 . 583 . 1 1 4 VAL CB C 2.024 4.806 -11.681 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 4 . 584 . 1 1 4 VAL CG1 C 0.549 5.040 -11.350 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 4 . 585 . 1 1 4 VAL CG2 C 2.683 6.141 -12.050 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 4 . 586 . 1 1 4 VAL H H 1.223 2.855 -9.758 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 4 . 587 . 1 1 4 VAL HA H 3.785 4.057 -10.703 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 4 . 588 . 1 1 4 VAL HB H 2.102 4.123 -12.516 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 4 . 589 . 1 1 4 VAL HG11 H 0.248 4.373 -10.556 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 4 . 590 . 1 1 4 VAL HG12 H -0.052 4.849 -12.227 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 4 . 591 . 1 1 4 VAL HG13 H 0.411 6.062 -11.034 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 4 . 592 . 1 1 4 VAL HG21 H 2.217 6.938 -11.490 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 4 . 593 . 1 1 4 VAL HG22 H 2.563 6.325 -13.108 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 4 . 594 . 1 1 4 VAL HG23 H 3.736 6.101 -11.810 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 4 . 595 . 1 1 4 VAL N N 2.086 2.900 -10.222 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 4 . 596 . 1 1 4 VAL O O 2.115 6.234 -9.350 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 4 . 597 . 1 1 5 VAL C C 4.322 6.404 -6.892 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 4 . 598 . 1 1 5 VAL CA C 3.034 5.578 -6.914 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 4 . 599 . 1 1 5 VAL CB C 2.940 4.653 -5.691 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 4 . 600 . 1 1 5 VAL CG1 C 1.491 4.203 -5.518 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 4 . 601 . 1 1 5 VAL CG2 C 3.843 3.419 -5.845 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 4 . 602 . 1 1 5 VAL H H 3.509 3.827 -8.042 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 4 . 603 . 1 1 5 VAL HA H 2.169 6.225 -6.963 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 4 . 604 . 1 1 5 VAL HB H 3.241 5.204 -4.821 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 4 . 605 . 1 1 5 VAL HG11 H 1.404 3.605 -4.623 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 4 . 606 . 1 1 5 VAL HG12 H 1.191 3.618 -6.374 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 4 . 607 . 1 1 5 VAL HG13 H 0.855 5.071 -5.435 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 4 . 608 . 1 1 5 VAL HG21 H 3.281 2.614 -6.292 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 4 . 609 . 1 1 5 VAL HG22 H 4.199 3.111 -4.874 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 4 . 610 . 1 1 5 VAL HG23 H 4.685 3.663 -6.476 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 4 . 611 . 1 1 5 VAL N N 3.092 4.703 -8.107 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 4 . 612 . 1 1 5 VAL O O 5.406 5.900 -7.146 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 4 . 613 . 1 1 6 ARG C C 6.332 8.253 -5.465 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 4 . 614 . 1 1 6 ARG CA C 5.432 8.534 -6.662 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 4 . 615 . 1 1 6 ARG CB C 4.915 9.982 -6.633 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 4 . 616 . 1 1 6 ARG CD C 2.544 10.592 -6.106 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 4 . 617 . 1 1 6 ARG CG C 3.889 10.167 -5.506 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 4 . 618 . 1 1 6 ARG CZ C 0.316 10.656 -5.151 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 4 . 619 . 1 1 6 ARG H H 3.335 8.066 -6.450 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 4 . 620 . 1 1 6 ARG HA H 5.973 8.366 -7.582 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 4 . 621 . 1 1 6 ARG HB2 H 5.746 10.654 -6.471 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 4 . 622 . 1 1 6 ARG HB3 H 4.450 10.213 -7.581 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 4 . 623 . 1 1 6 ARG HD2 H 2.635 11.560 -6.579 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 4 . 624 . 1 1 6 ARG HD3 H 2.200 9.856 -6.818 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 4 . 625 . 1 1 6 ARG HE H 1.958 10.714 -4.037 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 4 . 626 . 1 1 6 ARG HG2 H 3.767 9.235 -4.970 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 4 . 627 . 1 1 6 ARG HG3 H 4.233 10.932 -4.825 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 4 . 628 . 1 1 6 ARG HH11 H 0.270 12.512 -5.902 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 4 . 629 . 1 1 6 ARG HH12 H -1.258 11.703 -5.814 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 4 . 630 . 1 1 6 ARG HH21 H 0.057 8.804 -4.438 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 4 . 631 . 1 1 6 ARG HH22 H -1.380 9.603 -4.986 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 4 . 632 . 1 1 6 ARG N N 4.215 7.674 -6.625 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 4 . 633 . 1 1 6 ARG NE N 1.606 10.662 -4.949 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 4 . 634 . 1 1 6 ARG NH1 N -0.270 11.705 -5.663 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 4 . 635 . 1 1 6 ARG NH2 N -0.391 9.605 -4.834 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 4 . 636 . 1 1 6 ARG O O 6.005 8.532 -4.330 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 4 . 637 . 1 1 7 GLY C C 8.904 5.881 -4.881 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 4 . 638 . 1 1 7 GLY CA C 8.450 7.328 -4.682 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 4 . 639 . 1 1 7 GLY H H 7.685 7.463 -6.679 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 4 . 640 . 1 1 7 GLY HA2 H 9.305 7.992 -4.745 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 4 . 641 . 1 1 7 GLY HA3 H 7.983 7.423 -3.712 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 4 . 642 . 1 1 7 GLY N N 7.474 7.676 -5.747 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 4 . 643 . 1 1 7 GLY O O 10.070 5.565 -4.749 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 4 . 644 . 1 1 8 ASP C C 7.290 2.868 -6.229 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 4 . 645 . 1 1 8 ASP CA C 8.370 3.576 -5.414 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 4 . 646 . 1 1 8 ASP CB C 8.477 2.985 -4.007 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 4 . 647 . 1 1 8 ASP CG C 9.907 3.160 -3.492 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 4 . 648 . 1 1 8 ASP H H 7.056 5.282 -5.327 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 4 . 649 . 1 1 8 ASP HA H 9.324 3.513 -5.918 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 4 . 650 . 1 1 8 ASP HB2 H 7.791 3.498 -3.350 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 4 . 651 . 1 1 8 ASP HB3 H 8.233 1.933 -4.037 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 4 . 652 . 1 1 8 ASP N N 7.989 5.001 -5.203 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 4 . 653 . 1 1 8 ASP O O 6.347 2.332 -5.682 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 4 . 654 . 1 1 8 ASP OD1 O 10.804 2.580 -4.083 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 4 . 655 . 1 1 8 ASP OD2 O 10.083 3.873 -2.518 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 4 . 656 . 1 1 9 TYR C C 6.997 1.323 -9.455 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 4 . 657 . 1 1 9 TYR CA C 6.366 2.213 -8.375 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 4 . 658 . 1 1 9 TYR CB C 5.600 3.374 -9.007 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 4 . 659 . 1 1 9 TYR CD1 C 7.394 5.083 -9.470 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 4 . 660 . 1 1 9 TYR CD2 C 6.428 3.868 -11.331 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 4 . 661 . 1 1 9 TYR CE1 C 8.228 5.778 -10.354 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 4 . 662 . 1 1 9 TYR CE2 C 7.261 4.560 -12.215 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 4 . 663 . 1 1 9 TYR CG C 6.494 4.128 -9.960 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 4 . 664 . 1 1 9 TYR CZ C 8.161 5.515 -11.726 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 4 . 665 . 1 1 9 TYR H H 8.167 3.330 -7.944 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 4 . 666 . 1 1 9 TYR HA H 5.695 1.627 -7.761 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 4 . 667 . 1 1 9 TYR HB2 H 4.743 2.991 -9.539 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 4 . 668 . 1 1 9 TYR HB3 H 5.270 4.041 -8.231 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 4 . 669 . 1 1 9 TYR HD1 H 7.442 5.284 -8.409 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 4 . 670 . 1 1 9 TYR HD2 H 5.733 3.132 -11.706 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 4 . 671 . 1 1 9 TYR HE1 H 8.924 6.514 -9.980 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 4 . 672 . 1 1 9 TYR HE2 H 7.210 4.358 -13.274 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 4 . 673 . 1 1 9 TYR HH H 8.428 6.700 -13.198 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 4 . 674 . 1 1 9 TYR N N 7.408 2.875 -7.527 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 4 . 675 . 1 1 9 TYR O O 6.360 0.979 -10.434 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 4 . 676 . 1 1 9 TYR OH O 8.984 6.198 -12.599 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 4 . 677 . 1 1 10 LEU C C 9.251 -1.295 -9.634 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 4 . 678 . 1 1 10 LEU CA C 8.878 0.039 -10.286 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 4 . 679 . 1 1 10 LEU CB C 10.129 0.789 -10.754 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 4 . 680 . 1 1 10 LEU CD1 C 11.057 2.293 -12.531 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 4 . 681 . 1 1 10 LEU CD2 C 9.636 0.340 -13.169 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 4 . 682 . 1 1 10 LEU CG C 9.860 1.433 -12.118 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 4 . 683 . 1 1 10 LEU H H 8.711 1.204 -8.478 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 4 . 684 . 1 1 10 LEU HA H 8.213 -0.125 -11.119 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 4 . 685 . 1 1 10 LEU HB2 H 10.379 1.557 -10.034 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 4 . 686 . 1 1 10 LEU HB3 H 10.950 0.095 -10.841 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 4 . 687 . 1 1 10 LEU HD11 H 10.888 2.694 -13.520 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 4 . 688 . 1 1 10 LEU HD12 H 11.951 1.688 -12.535 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 4 . 689 . 1 1 10 LEU HD13 H 11.176 3.106 -11.829 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 4 . 690 . 1 1 10 LEU HD21 H 10.581 0.085 -13.629 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 4 . 691 . 1 1 10 LEU HD22 H 8.954 0.701 -13.923 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 4 . 692 . 1 1 10 LEU HD23 H 9.219 -0.538 -12.697 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 4 . 693 . 1 1 10 LEU HG H 8.979 2.054 -12.052 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 4 . 694 . 1 1 10 LEU N N 8.225 0.929 -9.278 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 4 . 695 . 1 1 10 LEU O O 10.410 -1.640 -9.519 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 4 . 696 . 1 1 11 ASP C C 7.832 -4.484 -9.296 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 4 . 697 . 1 1 11 ASP CA C 8.556 -3.359 -8.551 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 4 . 698 . 1 1 11 ASP CB C 8.012 -3.221 -7.127 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 4 . 699 . 1 1 11 ASP CG C 8.331 -4.490 -6.332 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 4 . 700 . 1 1 11 ASP H H 7.343 -1.741 -9.303 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 4 . 701 . 1 1 11 ASP HA H 9.618 -3.545 -8.525 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 4 . 702 . 1 1 11 ASP HB2 H 8.471 -2.370 -6.646 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 4 . 703 . 1 1 11 ASP HB3 H 6.941 -3.081 -7.161 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 4 . 704 . 1 1 11 ASP N N 8.269 -2.044 -9.201 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 4 . 705 . 1 1 11 ASP O O 8.373 -5.551 -9.506 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 4 . 706 . 1 1 11 ASP OD1 O 9.504 -4.770 -6.147 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 4 . 707 . 1 1 11 ASP OD2 O 7.397 -5.159 -5.920 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 4 . 708 . 1 1 12 CYS C C 5.846 -6.616 -9.655 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 4 . 709 . 1 1 12 CYS CA C 5.837 -5.295 -10.435 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 4 . 710 . 1 1 12 CYS CB C 6.557 -5.462 -11.775 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 4 . 711 . 1 1 12 CYS H H 6.197 -3.377 -9.516 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 4 . 712 . 1 1 12 CYS HA H 4.826 -4.963 -10.598 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 4 . 713 . 1 1 12 CYS HB2 H 7.593 -5.170 -11.667 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 4 . 714 . 1 1 12 CYS HB3 H 6.504 -6.495 -12.083 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 4 . 715 . 1 1 12 CYS N N 6.609 -4.248 -9.698 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 4 . 716 . 1 1 12 CYS O O 6.501 -7.563 -10.041 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 4 . 717 . 1 1 12 CYS SG S 5.763 -4.421 -13.025 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 4 . 718 . 1 1 13 NH2 HN1 H 4.600 -5.962 -8.253 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 4 . 719 . 1 1 13 NH2 HN2 H 5.123 -7.566 -8.068 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 4 . 720 . 1 1 13 NH2 N N 5.131 -6.722 -8.568 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 5 . 721 . 1 1 1 ACE C C 1.959 -4.766 -5.990 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 5 . 722 . 1 1 1 ACE CH3 C 3.035 -5.829 -6.210 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 5 . 723 . 1 1 1 ACE H1 H 3.016 -6.151 -7.241 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 5 . 724 . 1 1 1 ACE H2 H 2.846 -6.674 -5.563 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 5 . 725 . 1 1 1 ACE H3 H 4.005 -5.411 -5.983 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 5 . 726 . 1 1 1 ACE O O 1.164 -4.853 -5.073 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 5 . 727 . 1 1 2 CYS C C 0.935 -2.082 -5.273 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 5 . 728 . 1 1 2 CYS CA C 0.898 -2.686 -6.683 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 5 . 729 . 1 1 2 CYS CB C -0.444 -3.376 -6.947 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 5 . 730 . 1 1 2 CYS H H 2.576 -3.719 -7.558 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 5 . 731 . 1 1 2 CYS HA H 1.062 -1.916 -7.420 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 5 . 732 . 1 1 2 CYS HB2 H -0.422 -4.377 -6.538 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 5 . 733 . 1 1 2 CYS HB3 H -1.237 -2.815 -6.478 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 5 . 734 . 1 1 2 CYS N N 1.925 -3.763 -6.827 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 5 . 735 . 1 1 2 CYS O O 0.031 -2.271 -4.482 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 5 . 736 . 1 1 2 CYS SG S -0.737 -3.461 -8.734 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 5 . 737 . 1 1 3 ARG C C 1.763 0.776 -3.699 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 5 . 738 . 1 1 3 ARG CA C 2.059 -0.718 -3.602 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 5 . 739 . 1 1 3 ARG CB C 3.497 -0.963 -3.137 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 5 . 740 . 1 1 3 ARG CD C 4.928 -1.211 -1.106 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 5 . 741 . 1 1 3 ARG CG C 3.642 -0.588 -1.661 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 5 . 742 . 1 1 3 ARG CZ C 6.407 -0.539 0.687 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 5 . 743 . 1 1 3 ARG H H 2.684 -1.198 -5.611 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 5 . 744 . 1 1 3 ARG HA H 1.374 -1.184 -2.932 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 5 . 745 . 1 1 3 ARG HB2 H 3.742 -2.006 -3.267 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 5 . 746 . 1 1 3 ARG HB3 H 4.171 -0.359 -3.721 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 5 . 747 . 1 1 3 ARG HD2 H 4.766 -2.253 -0.871 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 5 . 748 . 1 1 3 ARG HD3 H 5.733 -1.104 -1.818 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 5 . 749 . 1 1 3 ARG HE H 4.552 0.147 0.522 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 5 . 750 . 1 1 3 ARG HG2 H 3.689 0.488 -1.566 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 5 . 751 . 1 1 3 ARG HG3 H 2.794 -0.964 -1.109 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 5 . 752 . 1 1 3 ARG HH11 H 6.503 -2.530 0.491 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 5 . 753 . 1 1 3 ARG HH12 H 7.871 -1.786 1.248 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 5 . 754 . 1 1 3 ARG HH21 H 6.586 1.426 1.014 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 5 . 755 . 1 1 3 ARG HH22 H 7.918 0.453 1.544 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 5 . 756 . 1 1 3 ARG N N 1.971 -1.345 -4.955 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 5 . 757 . 1 1 3 ARG NE N 5.232 -0.438 0.129 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 5 . 758 . 1 1 3 ARG NH1 N 6.971 -1.710 0.819 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 5 . 759 . 1 1 3 ARG NH2 N 7.018 0.530 1.116 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 5 . 760 . 1 1 3 ARG O O 0.798 1.269 -3.148 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 5 . 761 . 1 1 4 VAL C C 2.820 3.434 -5.946 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 5 . 762 . 1 1 4 VAL CA C 2.372 2.961 -4.547 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 5 . 763 . 1 1 4 VAL CB C 3.205 3.586 -3.413 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 5 . 764 . 1 1 4 VAL CG1 C 4.666 3.747 -3.838 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 5 . 765 . 1 1 4 VAL CG2 C 2.623 4.954 -3.036 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 5 . 766 . 1 1 4 VAL H H 3.349 1.058 -4.827 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 5 . 767 . 1 1 4 VAL HA H 1.331 3.191 -4.398 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 5 . 768 . 1 1 4 VAL HB H 3.161 2.936 -2.551 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 5 . 769 . 1 1 4 VAL HG11 H 5.053 2.794 -4.165 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 5 . 770 . 1 1 4 VAL HG12 H 5.244 4.101 -2.997 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 5 . 771 . 1 1 4 VAL HG13 H 4.734 4.461 -4.643 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 5 . 772 . 1 1 4 VAL HG21 H 2.511 5.013 -1.962 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 5 . 773 . 1 1 4 VAL HG22 H 1.658 5.078 -3.504 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 5 . 774 . 1 1 4 VAL HG23 H 3.289 5.735 -3.370 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 5 . 775 . 1 1 4 VAL N N 2.588 1.491 -4.399 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 5 . 776 . 1 1 4 VAL O O 2.915 2.649 -6.871 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 5 . 777 . 1 1 5 VAL C C 4.671 6.206 -7.302 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 5 . 778 . 1 1 5 VAL CA C 3.510 5.218 -7.448 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 5 . 779 . 1 1 5 VAL CB C 2.267 5.917 -8.014 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 5 . 780 . 1 1 5 VAL CG1 C 2.609 6.595 -9.344 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 5 . 781 . 1 1 5 VAL CG2 C 1.163 4.883 -8.247 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 5 . 782 . 1 1 5 VAL H H 3.003 5.326 -5.365 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 5 . 783 . 1 1 5 VAL HA H 3.790 4.408 -8.082 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 5 . 784 . 1 1 5 VAL HB H 1.921 6.661 -7.311 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 5 . 785 . 1 1 5 VAL HG11 H 3.116 5.891 -9.988 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 5 . 786 . 1 1 5 VAL HG12 H 3.252 7.443 -9.161 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 5 . 787 . 1 1 5 VAL HG13 H 1.699 6.929 -9.821 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 5 . 788 . 1 1 5 VAL HG21 H 0.691 4.643 -7.306 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 5 . 789 . 1 1 5 VAL HG22 H 1.591 3.989 -8.673 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 5 . 790 . 1 1 5 VAL HG23 H 0.427 5.288 -8.926 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 5 . 791 . 1 1 5 VAL N N 3.085 4.707 -6.113 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 5 . 792 . 1 1 5 VAL O O 5.805 5.911 -7.628 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 5 . 793 . 1 1 6 ARG C C 6.334 8.055 -5.444 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 5 . 794 . 1 1 6 ARG CA C 5.469 8.397 -6.652 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 5 . 795 . 1 1 6 ARG CB C 4.747 9.733 -6.456 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 5 . 796 . 1 1 6 ARG CD C 2.516 10.391 -5.543 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 5 . 797 . 1 1 6 ARG CG C 3.825 9.659 -5.236 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 5 . 798 . 1 1 6 ARG CZ C 0.750 10.993 -4.001 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 5 . 799 . 1 1 6 ARG H H 3.471 7.579 -6.559 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 5 . 800 . 1 1 6 ARG HA H 6.077 8.438 -7.538 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 5 . 801 . 1 1 6 ARG HB2 H 5.478 10.513 -6.304 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 5 . 802 . 1 1 6 ARG HB3 H 4.162 9.955 -7.334 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 5 . 803 . 1 1 6 ARG HD2 H 2.695 11.454 -5.638 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 5 . 804 . 1 1 6 ARG HD3 H 2.068 10.002 -6.444 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 5 . 805 . 1 1 6 ARG HE H 1.728 9.268 -3.885 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 5 . 806 . 1 1 6 ARG HG2 H 3.614 8.626 -5.002 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 5 . 807 . 1 1 6 ARG HG3 H 4.307 10.128 -4.392 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 5 . 808 . 1 1 6 ARG HH11 H -0.675 10.296 -5.222 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 5 . 809 . 1 1 6 ARG HH12 H -1.123 11.654 -4.245 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 5 . 810 . 1 1 6 ARG HH21 H 1.971 11.898 -2.698 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 5 . 811 . 1 1 6 ARG HH22 H 0.376 12.561 -2.816 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 5 . 812 . 1 1 6 ARG N N 4.390 7.375 -6.809 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 5 . 813 . 1 1 6 ARG NE N 1.638 10.113 -4.375 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 5 . 814 . 1 1 6 ARG NH1 N -0.442 10.981 -4.530 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 5 . 815 . 1 1 6 ARG NH2 N 1.056 11.887 -3.102 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 5 . 816 . 1 1 6 ARG O O 5.866 7.942 -4.328 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 5 . 817 . 1 1 7 GLY C C 8.814 5.960 -4.762 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 5 . 818 . 1 1 7 GLY CA C 8.531 7.454 -4.606 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 5 . 819 . 1 1 7 GLY H H 7.924 7.913 -6.612 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 5 . 820 . 1 1 7 GLY HA2 H 9.452 8.018 -4.695 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 5 . 821 . 1 1 7 GLY HA3 H 8.077 7.639 -3.645 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 5 . 822 . 1 1 7 GLY N N 7.595 7.844 -5.692 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 5 . 823 . 1 1 7 GLY O O 9.895 5.482 -4.485 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 5 . 824 . 1 1 8 ASP C C 7.021 3.317 -6.529 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 5 . 825 . 1 1 8 ASP CA C 8.009 3.768 -5.452 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 5 . 826 . 1 1 8 ASP CB C 7.714 3.109 -4.103 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 5 . 827 . 1 1 8 ASP CG C 9.013 2.980 -3.303 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 5 . 828 . 1 1 8 ASP H H 6.983 5.648 -5.478 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 5 . 829 . 1 1 8 ASP HA H 9.021 3.551 -5.757 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 5 . 830 . 1 1 8 ASP HB2 H 7.017 3.720 -3.552 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 5 . 831 . 1 1 8 ASP HB3 H 7.292 2.128 -4.261 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 5 . 832 . 1 1 8 ASP N N 7.837 5.226 -5.235 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 5 . 833 . 1 1 8 ASP O O 5.901 2.945 -6.243 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 5 . 834 . 1 1 8 ASP OD1 O 9.833 2.158 -3.673 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 5 . 835 . 1 1 8 ASP OD2 O 9.164 3.708 -2.336 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 5 . 836 . 1 1 9 TYR C C 6.529 1.472 -9.109 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 5 . 837 . 1 1 9 TYR CA C 6.503 2.989 -8.880 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 5 . 838 . 1 1 9 TYR CB C 7.066 3.692 -10.120 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 5 . 839 . 1 1 9 TYR CD1 C 5.609 5.713 -10.498 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 5 . 840 . 1 1 9 TYR CD2 C 7.798 6.024 -9.503 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 5 . 841 . 1 1 9 TYR CE1 C 5.379 7.093 -10.423 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 5 . 842 . 1 1 9 TYR CE2 C 7.567 7.403 -9.428 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 5 . 843 . 1 1 9 TYR CG C 6.819 5.179 -10.038 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 5 . 844 . 1 1 9 TYR CZ C 6.359 7.937 -9.887 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 5 . 845 . 1 1 9 TYR H H 8.315 3.710 -7.962 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 5 . 846 . 1 1 9 TYR HA H 5.496 3.335 -8.687 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 5 . 847 . 1 1 9 TYR HB2 H 8.129 3.509 -10.181 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 5 . 848 . 1 1 9 TYR HB3 H 6.585 3.297 -11.002 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 5 . 849 . 1 1 9 TYR HD1 H 4.853 5.062 -10.912 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 5 . 850 . 1 1 9 TYR HD2 H 8.730 5.613 -9.148 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 5 . 851 . 1 1 9 TYR HE1 H 4.446 7.506 -10.778 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 5 . 852 . 1 1 9 TYR HE2 H 8.323 8.055 -9.015 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 5 . 853 . 1 1 9 TYR HH H 5.834 9.599 -10.671 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 5 . 854 . 1 1 9 TYR N N 7.422 3.378 -7.765 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 5 . 855 . 1 1 9 TYR O O 7.284 0.970 -9.918 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 5 . 856 . 1 1 9 TYR OH O 6.133 9.297 -9.810 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 5 . 857 . 1 1 10 LEU C C 4.223 -1.116 -9.085 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 5 . 858 . 1 1 10 LEU CA C 5.631 -0.734 -8.613 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 5 . 859 . 1 1 10 LEU CB C 5.895 -1.339 -7.228 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 5 . 860 . 1 1 10 LEU CD1 C 8.320 -1.450 -7.891 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 5 . 861 . 1 1 10 LEU CD2 C 7.515 0.381 -6.390 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 5 . 862 . 1 1 10 LEU CG C 7.341 -1.090 -6.772 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 5 . 863 . 1 1 10 LEU H H 5.074 1.180 -7.791 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 5 . 864 . 1 1 10 LEU HA H 6.378 -1.063 -9.319 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 5 . 865 . 1 1 10 LEU HB2 H 5.223 -0.887 -6.522 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 5 . 866 . 1 1 10 LEU HB3 H 5.712 -2.404 -7.263 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 5 . 867 . 1 1 10 LEU HD11 H 8.360 -0.644 -8.607 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 5 . 868 . 1 1 10 LEU HD12 H 7.987 -2.354 -8.381 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 5 . 869 . 1 1 10 LEU HD13 H 9.302 -1.608 -7.471 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 5 . 870 . 1 1 10 LEU HD21 H 8.002 0.908 -7.196 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 5 . 871 . 1 1 10 LEU HD22 H 8.118 0.451 -5.498 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 5 . 872 . 1 1 10 LEU HD23 H 6.546 0.821 -6.205 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 5 . 873 . 1 1 10 LEU HG H 7.548 -1.709 -5.910 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 5 . 874 . 1 1 10 LEU N N 5.687 0.747 -8.423 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 5 . 875 . 1 1 10 LEU O O 3.418 -1.606 -8.319 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 5 . 876 . 1 1 11 ASP C C 2.489 -2.638 -11.368 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 5 . 877 . 1 1 11 ASP CA C 2.541 -1.207 -10.833 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 5 . 878 . 1 1 11 ASP CB C 2.280 -0.206 -11.960 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 5 . 879 . 1 1 11 ASP CG C 0.772 -0.067 -12.176 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 5 . 880 . 1 1 11 ASP H H 4.568 -0.469 -10.931 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 5 . 881 . 1 1 11 ASP HA H 1.811 -1.071 -10.048 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 5 . 882 . 1 1 11 ASP HB2 H 2.697 0.754 -11.691 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 5 . 883 . 1 1 11 ASP HB3 H 2.741 -0.559 -12.869 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 5 . 884 . 1 1 11 ASP N N 3.911 -0.879 -10.332 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 5 . 885 . 1 1 11 ASP O O 3.480 -3.187 -11.807 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 5 . 886 . 1 1 11 ASP OD1 O 0.220 -0.877 -12.902 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 5 . 887 . 1 1 11 ASP OD2 O 0.194 0.844 -11.606 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 5 . 888 . 1 1 12 CYS C C 1.014 -4.641 -13.340 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 5 . 889 . 1 1 12 CYS CA C 1.206 -4.640 -11.820 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 5 . 890 . 1 1 12 CYS CB C -0.032 -5.206 -11.115 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 5 . 891 . 1 1 12 CYS H H 0.552 -2.781 -10.958 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 5 . 892 . 1 1 12 CYS HA H 2.078 -5.213 -11.553 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 5 . 893 . 1 1 12 CYS HB2 H -0.897 -4.618 -11.382 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 5 . 894 . 1 1 12 CYS HB3 H -0.185 -6.229 -11.427 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 5 . 895 . 1 1 12 CYS N N 1.335 -3.245 -11.322 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 5 . 896 . 1 1 12 CYS O O 1.116 -5.668 -13.981 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 5 . 897 . 1 1 12 CYS SG S 0.208 -5.150 -9.318 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 5 . 898 . 1 1 13 NH2 HN1 H 0.660 -2.687 -13.437 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 5 . 899 . 1 1 13 NH2 HN2 H 0.624 -3.507 -14.924 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 5 . 900 . 1 1 13 NH2 N N 0.744 -3.518 -13.952 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 6 . 901 . 1 1 1 ACE C C -3.314 -3.472 -12.503 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 6 . 902 . 1 1 1 ACE CH3 C -4.521 -3.910 -13.334 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 6 . 903 . 1 1 1 ACE H1 H -5.384 -4.006 -12.692 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 6 . 904 . 1 1 1 ACE H2 H -4.310 -4.860 -13.801 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 6 . 905 . 1 1 1 ACE H3 H -4.719 -3.170 -14.096 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 6 . 906 . 1 1 1 ACE O O -3.307 -3.589 -11.292 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 6 . 907 . 1 1 2 CYS C C -1.274 -1.079 -11.889 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 6 . 908 . 1 1 2 CYS CA C -1.083 -2.519 -12.387 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 6 . 909 . 1 1 2 CYS CB C 0.070 -2.601 -13.395 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 6 . 910 . 1 1 2 CYS H H -2.319 -2.880 -14.118 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 6 . 911 . 1 1 2 CYS HA H -0.895 -3.180 -11.556 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 6 . 912 . 1 1 2 CYS HB2 H -0.306 -2.949 -14.346 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 6 . 913 . 1 1 2 CYS HB3 H 0.509 -1.621 -13.521 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 6 . 914 . 1 1 2 CYS N N -2.292 -2.966 -13.142 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 6 . 915 . 1 1 2 CYS O O -2.028 -0.313 -12.456 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 6 . 916 . 1 1 2 CYS SG S 1.329 -3.753 -12.786 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 6 . 917 . 1 1 3 ARG C C 0.656 1.228 -9.955 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 6 . 918 . 1 1 3 ARG CA C -0.729 0.678 -10.301 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 6 . 919 . 1 1 3 ARG CB C -1.595 0.539 -9.047 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 6 . 920 . 1 1 3 ARG CD C -3.949 0.561 -8.189 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 6 . 921 . 1 1 3 ARG CG C -3.061 0.780 -9.418 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 6 . 922 . 1 1 3 ARG CZ C -5.548 -1.227 -8.560 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 6 . 923 . 1 1 3 ARG H H 0.018 -1.341 -10.398 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 6 . 924 . 1 1 3 ARG HA H -1.218 1.315 -11.022 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 6 . 925 . 1 1 3 ARG HB2 H -1.483 -0.456 -8.639 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 6 . 926 . 1 1 3 ARG HB3 H -1.287 1.267 -8.311 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 6 . 927 . 1 1 3 ARG HD2 H -3.398 0.777 -7.285 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 6 . 928 . 1 1 3 ARG HD3 H -4.832 1.178 -8.248 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 6 . 929 . 1 1 3 ARG HE H -3.666 -1.568 -8.023 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 6 . 930 . 1 1 3 ARG HG2 H -3.180 1.795 -9.771 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 6 . 931 . 1 1 3 ARG HG3 H -3.353 0.092 -10.198 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 6 . 932 . 1 1 3 ARG HH11 H -5.189 -1.236 -10.529 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 6 . 933 . 1 1 3 ARG HH12 H -6.804 -1.647 -10.060 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 6 . 934 . 1 1 3 ARG HH21 H -6.193 -1.308 -6.666 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 6 . 935 . 1 1 3 ARG HH22 H -7.373 -1.688 -7.876 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 6 . 936 . 1 1 3 ARG N N -0.592 -0.708 -10.837 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 6 . 937 . 1 1 3 ARG NE N -4.330 -0.880 -8.236 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 6 . 938 . 1 1 3 ARG NH1 N -5.872 -1.382 -9.815 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 6 . 939 . 1 1 3 ARG NH2 N -6.440 -1.423 -7.628 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 6 . 940 . 1 1 3 ARG O O 1.621 0.490 -9.900 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 6 . 941 . 1 1 4 VAL C C 2.061 4.154 -8.342 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 6 . 942 . 1 1 4 VAL CA C 2.123 3.072 -9.427 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 6 . 943 . 1 1 4 VAL CB C 2.617 3.661 -10.752 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 6 . 944 . 1 1 4 VAL CG1 C 1.921 4.999 -11.028 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 6 . 945 . 1 1 4 VAL CG2 C 4.128 3.876 -10.668 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 6 . 946 . 1 1 4 VAL H H -0.005 3.103 -9.803 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 6 . 947 . 1 1 4 VAL HA H 2.782 2.282 -9.119 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 6 . 948 . 1 1 4 VAL HB H 2.395 2.975 -11.553 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 6 . 949 . 1 1 4 VAL HG11 H 2.255 5.733 -10.311 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 6 . 950 . 1 1 4 VAL HG12 H 0.852 4.872 -10.942 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 6 . 951 . 1 1 4 VAL HG13 H 2.165 5.331 -12.027 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 6 . 952 . 1 1 4 VAL HG21 H 4.336 4.722 -10.029 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 6 . 953 . 1 1 4 VAL HG22 H 4.519 4.066 -11.656 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 6 . 954 . 1 1 4 VAL HG23 H 4.593 2.992 -10.257 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 6 . 955 . 1 1 4 VAL N N 0.776 2.513 -9.742 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 6 . 956 . 1 1 4 VAL O O 1.066 4.829 -8.168 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 6 . 957 . 1 1 5 VAL C C 4.402 6.296 -6.832 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 6 . 958 . 1 1 5 VAL CA C 3.203 5.377 -6.568 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 6 . 959 . 1 1 5 VAL CB C 3.392 4.641 -5.225 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 6 . 960 . 1 1 5 VAL CG1 C 2.251 5.010 -4.279 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 6 . 961 . 1 1 5 VAL CG2 C 3.403 3.116 -5.419 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 6 . 962 . 1 1 5 VAL H H 3.938 3.782 -7.814 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 6 . 963 . 1 1 5 VAL HA H 2.286 5.947 -6.556 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 6 . 964 . 1 1 5 VAL HB H 4.329 4.953 -4.781 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 6 . 965 . 1 1 5 VAL HG11 H 2.188 6.086 -4.193 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 6 . 966 . 1 1 5 VAL HG12 H 2.439 4.582 -3.306 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 6 . 967 . 1 1 5 VAL HG13 H 1.320 4.625 -4.668 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 6 . 968 . 1 1 5 VAL HG21 H 3.691 2.639 -4.493 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 6 . 969 . 1 1 5 VAL HG22 H 4.110 2.853 -6.188 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 6 . 970 . 1 1 5 VAL HG23 H 2.419 2.780 -5.704 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 6 . 971 . 1 1 5 VAL N N 3.147 4.330 -7.632 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 6 . 972 . 1 1 5 VAL O O 5.435 5.854 -7.305 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 6 . 973 . 1 1 6 ARG C C 6.435 8.357 -5.589 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 6 . 974 . 1 1 6 ARG CA C 5.459 8.469 -6.758 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 6 . 975 . 1 1 6 ARG CB C 4.895 9.892 -6.898 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 6 . 976 . 1 1 6 ARG CD C 3.964 11.759 -5.536 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 6 . 977 . 1 1 6 ARG CG C 3.971 10.240 -5.728 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 6 . 978 . 1 1 6 ARG CZ C 1.984 12.659 -4.475 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 6 . 979 . 1 1 6 ARG H H 3.469 7.903 -6.118 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 6 . 980 . 1 1 6 ARG HA H 5.954 8.186 -7.675 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 6 . 981 . 1 1 6 ARG HB2 H 5.714 10.595 -6.922 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 6 . 982 . 1 1 6 ARG HB3 H 4.339 9.963 -7.822 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 6 . 983 . 1 1 6 ARG HD2 H 4.968 12.119 -5.354 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 6 . 984 . 1 1 6 ARG HD3 H 3.541 12.246 -6.403 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 6 . 985 . 1 1 6 ARG HE H 3.371 11.655 -3.470 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 6 . 986 . 1 1 6 ARG HG2 H 2.968 9.900 -5.946 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 6 . 987 . 1 1 6 ARG HG3 H 4.326 9.766 -4.827 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 6 . 988 . 1 1 6 ARG HH11 H 2.879 14.448 -4.542 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 6 . 989 . 1 1 6 ARG HH12 H 1.152 14.470 -4.665 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 6 . 990 . 1 1 6 ARG HH21 H 0.830 11.023 -4.442 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 6 . 991 . 1 1 6 ARG HH22 H -0.009 12.529 -4.608 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 6 . 992 . 1 1 6 ARG N N 4.296 7.561 -6.515 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 6 . 993 . 1 1 6 ARG NE N 3.101 11.996 -4.347 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 6 . 994 . 1 1 6 ARG NH1 N 2.007 13.960 -4.568 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 6 . 995 . 1 1 6 ARG NH2 N 0.847 12.021 -4.512 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 6 . 996 . 1 1 6 ARG O O 6.236 8.900 -4.520 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 6 . 997 . 1 1 7 GLY C C 8.795 5.862 -4.713 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 6 . 998 . 1 1 7 GLY CA C 8.484 7.365 -4.729 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 6 . 999 . 1 1 7 GLY H H 7.580 7.159 -6.664 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 6 . 1000 . 1 1 7 GLY HA2 H 9.383 7.929 -4.945 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 6 . 1001 . 1 1 7 GLY HA3 H 8.083 7.663 -3.772 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 6 . 1002 . 1 1 7 GLY N N 7.475 7.603 -5.796 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 6 . 1003 . 1 1 7 GLY O O 9.850 5.434 -4.292 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 6 . 1004 . 1 1 8 ASP C C 7.357 3.076 -6.525 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 6 . 1005 . 1 1 8 ASP CA C 8.071 3.589 -5.274 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 6 . 1006 . 1 1 8 ASP CB C 7.420 3.015 -4.013 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 6 . 1007 . 1 1 8 ASP CG C 8.289 3.335 -2.797 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 6 . 1008 . 1 1 8 ASP H H 7.044 5.448 -5.565 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 6 . 1009 . 1 1 8 ASP HA H 9.122 3.342 -5.304 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 6 . 1010 . 1 1 8 ASP HB2 H 6.440 3.451 -3.883 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 6 . 1011 . 1 1 8 ASP HB3 H 7.326 1.944 -4.114 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 6 . 1012 . 1 1 8 ASP N N 7.872 5.065 -5.206 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 6 . 1013 . 1 1 8 ASP O O 6.217 2.666 -6.473 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 6 . 1014 . 1 1 8 ASP OD1 O 9.478 3.063 -2.854 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 6 . 1015 . 1 1 8 ASP OD2 O 7.752 3.844 -1.828 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 6 . 1016 . 1 1 9 TYR C C 7.401 1.170 -9.095 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 6 . 1017 . 1 1 9 TYR CA C 7.341 2.690 -8.918 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 6 . 1018 . 1 1 9 TYR CB C 8.132 3.374 -10.031 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 6 . 1019 . 1 1 9 TYR CD1 C 8.221 5.749 -9.199 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 6 . 1020 . 1 1 9 TYR CD2 C 6.808 5.231 -11.100 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 6 . 1021 . 1 1 9 TYR CE1 C 7.825 7.092 -9.271 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 6 . 1022 . 1 1 9 TYR CE2 C 6.411 6.571 -11.170 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 6 . 1023 . 1 1 9 TYR CG C 7.713 4.821 -10.115 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 6 . 1024 . 1 1 9 TYR CZ C 6.920 7.502 -10.257 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 6 . 1025 . 1 1 9 TYR H H 8.914 3.491 -7.672 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 6 . 1026 . 1 1 9 TYR HA H 6.314 3.035 -8.941 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 6 . 1027 . 1 1 9 TYR HB2 H 9.187 3.315 -9.813 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 6 . 1028 . 1 1 9 TYR HB3 H 7.926 2.886 -10.970 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 6 . 1029 . 1 1 9 TYR HD1 H 8.918 5.431 -8.438 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 6 . 1030 . 1 1 9 TYR HD2 H 6.417 4.513 -11.805 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 6 . 1031 . 1 1 9 TYR HE1 H 8.218 7.809 -8.565 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 6 . 1032 . 1 1 9 TYR HE2 H 5.711 6.888 -11.930 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 6 . 1033 . 1 1 9 TYR HH H 6.870 9.192 -11.147 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 6 . 1034 . 1 1 9 TYR N N 8.006 3.128 -7.652 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 6 . 1035 . 1 1 9 TYR O O 8.455 0.581 -9.233 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 6 . 1036 . 1 1 9 TYR OH O 6.528 8.824 -10.329 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 6 . 1037 . 1 1 10 LEU C C 4.956 -1.249 -10.153 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 6 . 1038 . 1 1 10 LEU CA C 6.184 -0.929 -9.291 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 6 . 1039 . 1 1 10 LEU CB C 6.036 -1.494 -7.873 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 6 . 1040 . 1 1 10 LEU CD1 C 3.775 -1.946 -6.894 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 6 . 1041 . 1 1 10 LEU CD2 C 5.255 -0.221 -5.856 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 6 . 1042 . 1 1 10 LEU CG C 4.820 -0.866 -7.179 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 6 . 1043 . 1 1 10 LEU H H 5.427 1.053 -9.005 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 6 . 1044 . 1 1 10 LEU HA H 7.085 -1.302 -9.754 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 6 . 1045 . 1 1 10 LEU HB2 H 5.910 -2.565 -7.923 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 6 . 1046 . 1 1 10 LEU HB3 H 6.926 -1.266 -7.307 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 6 . 1047 . 1 1 10 LEU HD11 H 3.997 -2.424 -5.951 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 6 . 1048 . 1 1 10 LEU HD12 H 3.796 -2.683 -7.684 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 6 . 1049 . 1 1 10 LEU HD13 H 2.795 -1.495 -6.847 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 6 . 1050 . 1 1 10 LEU HD21 H 5.054 -0.900 -5.039 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 6 . 1051 . 1 1 10 LEU HD22 H 4.704 0.696 -5.705 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 6 . 1052 . 1 1 10 LEU HD23 H 6.311 -0.004 -5.890 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 6 . 1053 . 1 1 10 LEU HG H 4.389 -0.113 -7.821 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 6 . 1054 . 1 1 10 LEU N N 6.257 0.544 -9.107 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 6 . 1055 . 1 1 10 LEU O O 4.183 -2.136 -9.850 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 6 . 1056 . 1 1 11 ASP C C 3.945 -1.560 -13.337 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 6 . 1057 . 1 1 11 ASP CA C 3.577 -0.730 -12.104 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 6 . 1058 . 1 1 11 ASP CB C 3.129 0.671 -12.528 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 6 . 1059 . 1 1 11 ASP CG C 4.270 1.387 -13.259 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 6 . 1060 . 1 1 11 ASP H H 5.397 0.213 -11.427 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 6 . 1061 . 1 1 11 ASP HA H 2.784 -1.211 -11.555 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 6 . 1062 . 1 1 11 ASP HB2 H 2.276 0.588 -13.188 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 6 . 1063 . 1 1 11 ASP HB3 H 2.852 1.237 -11.653 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 6 . 1064 . 1 1 11 ASP N N 4.766 -0.507 -11.218 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 6 . 1065 . 1 1 11 ASP O O 4.045 -1.049 -14.435 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 6 . 1066 . 1 1 11 ASP OD1 O 5.354 1.455 -12.704 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 6 . 1067 . 1 1 11 ASP OD2 O 4.040 1.853 -14.364 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 6 . 1068 . 1 1 12 CYS C C 5.628 -3.144 -15.130 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 6 . 1069 . 1 1 12 CYS CA C 4.449 -3.716 -14.333 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 6 . 1070 . 1 1 12 CYS CB C 3.182 -3.721 -15.191 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 6 . 1071 . 1 1 12 CYS H H 4.010 -3.235 -12.278 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 6 . 1072 . 1 1 12 CYS HA H 4.667 -4.715 -13.998 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 6 . 1073 . 1 1 12 CYS HB2 H 2.801 -2.714 -15.273 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 6 . 1074 . 1 1 12 CYS HB3 H 3.417 -4.098 -16.174 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 6 . 1075 . 1 1 12 CYS N N 4.118 -2.841 -13.168 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 6 . 1076 . 1 1 12 CYS O O 5.626 -3.166 -16.345 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 6 . 1077 . 1 1 12 CYS SG S 1.924 -4.776 -14.424 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 6 . 1078 . 1 1 13 NH2 HN1 H 6.649 -2.607 -13.515 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 6 . 1079 . 1 1 13 NH2 HN2 H 7.399 -2.258 -14.997 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 6 . 1080 . 1 1 13 NH2 N N 6.642 -2.628 -14.493 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 7 . 1081 . 1 1 1 ACE C C 1.342 -4.770 -12.116 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 7 . 1082 . 1 1 1 ACE CH3 C 0.480 -5.910 -11.577 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 7 . 1083 . 1 1 1 ACE H1 H 1.068 -6.518 -10.904 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 7 . 1084 . 1 1 1 ACE H2 H 0.132 -6.518 -12.398 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 7 . 1085 . 1 1 1 ACE H3 H -0.367 -5.503 -11.045 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 7 . 1086 . 1 1 1 ACE O O 2.554 -4.856 -12.144 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 7 . 1087 . 1 1 2 CYS C C 0.938 -1.231 -12.554 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 7 . 1088 . 1 1 2 CYS CA C 1.514 -2.550 -13.077 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 7 . 1089 . 1 1 2 CYS CB C 1.373 -2.633 -14.598 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 7 . 1090 . 1 1 2 CYS H H -0.252 -3.653 -12.510 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 7 . 1091 . 1 1 2 CYS HA H 2.552 -2.642 -12.798 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 7 . 1092 . 1 1 2 CYS HB2 H 0.400 -3.028 -14.850 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1093 . 1 1 2 CYS HB3 H 1.481 -1.645 -15.023 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1094 . 1 1 2 CYS N N 0.726 -3.701 -12.543 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 7 . 1095 . 1 1 2 CYS O O -0.054 -0.734 -13.051 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 7 . 1096 . 1 1 2 CYS SG S 2.657 -3.723 -15.268 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 7 . 1097 . 1 1 3 ARG C C 2.242 1.583 -10.781 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 7 . 1098 . 1 1 3 ARG CA C 1.066 0.639 -11.010 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 7 . 1099 . 1 1 3 ARG CB C 0.400 0.278 -9.684 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 7 . 1100 . 1 1 3 ARG CD C -1.722 -0.617 -8.721 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 7 . 1101 . 1 1 3 ARG CG C -1.110 0.155 -9.890 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 7 . 1102 . 1 1 3 ARG CZ C -3.823 -0.248 -7.580 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 7 . 1103 . 1 1 3 ARG H H 2.366 -1.071 -11.185 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 7 . 1104 . 1 1 3 ARG HA H 0.344 1.083 -11.678 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 7 . 1105 . 1 1 3 ARG HB2 H 0.793 -0.665 -9.327 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1106 . 1 1 3 ARG HB3 H 0.601 1.050 -8.957 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1107 . 1 1 3 ARG HD2 H -1.635 -1.682 -8.888 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 7 . 1108 . 1 1 3 ARG HD3 H -1.245 -0.340 -7.795 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 7 . 1109 . 1 1 3 ARG HE H -3.592 0.091 -9.523 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 7 . 1110 . 1 1 3 ARG HG2 H -1.548 1.141 -9.941 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 7 . 1111 . 1 1 3 ARG HG3 H -1.306 -0.374 -10.811 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 7 . 1112 . 1 1 3 ARG HH11 H -3.180 -2.077 -7.086 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 7 . 1113 . 1 1 3 ARG HH12 H -4.262 -1.333 -5.958 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 7 . 1114 . 1 1 3 ARG HH21 H -4.619 1.575 -7.815 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 7 . 1115 . 1 1 3 ARG HH22 H -5.077 0.736 -6.370 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 7 . 1116 . 1 1 3 ARG N N 1.562 -0.655 -11.562 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 7 . 1117 . 1 1 3 ARG NE N -3.154 -0.208 -8.700 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 7 . 1118 . 1 1 3 ARG NH1 N -3.749 -1.301 -6.815 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 7 . 1119 . 1 1 3 ARG NH2 N -4.563 0.767 -7.228 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 7 . 1120 . 1 1 3 ARG O O 3.387 1.189 -10.888 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 7 . 1121 . 1 1 4 VAL C C 2.801 4.753 -9.120 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 7 . 1122 . 1 1 4 VAL CA C 3.111 3.767 -10.250 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 7 . 1123 . 1 1 4 VAL CB C 3.316 4.489 -11.590 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 7 . 1124 . 1 1 4 VAL CG1 C 3.754 5.940 -11.357 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 7 . 1125 . 1 1 4 VAL CG2 C 4.411 3.768 -12.381 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 7 . 1126 . 1 1 4 VAL H H 1.054 3.130 -10.392 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 7 . 1127 . 1 1 4 VAL HA H 4.005 3.211 -10.009 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 7 . 1128 . 1 1 4 VAL HB H 2.394 4.475 -12.154 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 7 . 1129 . 1 1 4 VAL HG11 H 2.881 6.566 -11.249 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 7 . 1130 . 1 1 4 VAL HG12 H 4.341 6.278 -12.197 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 7 . 1131 . 1 1 4 VAL HG13 H 4.351 5.994 -10.461 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 7 . 1132 . 1 1 4 VAL HG21 H 4.747 2.905 -11.828 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 7 . 1133 . 1 1 4 VAL HG22 H 5.243 4.439 -12.539 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 7 . 1134 . 1 1 4 VAL HG23 H 4.019 3.451 -13.338 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 7 . 1135 . 1 1 4 VAL N N 1.981 2.824 -10.472 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 7 . 1136 . 1 1 4 VAL O O 2.126 5.748 -9.294 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 7 . 1137 . 1 1 5 VAL C C 4.399 6.343 -6.816 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 7 . 1138 . 1 1 5 VAL CA C 3.180 5.399 -6.823 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 7 . 1139 . 1 1 5 VAL CB C 3.107 4.474 -5.588 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 7 . 1140 . 1 1 5 VAL CG1 C 1.704 3.866 -5.492 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 7 . 1141 . 1 1 5 VAL CG2 C 4.116 3.318 -5.687 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 7 . 1142 . 1 1 5 VAL H H 3.919 3.706 -7.898 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 7 . 1143 . 1 1 5 VAL HA H 2.268 5.966 -6.930 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 7 . 1144 . 1 1 5 VAL HB H 3.307 5.050 -4.705 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 7 . 1145 . 1 1 5 VAL HG11 H 1.491 3.319 -6.399 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 7 . 1146 . 1 1 5 VAL HG12 H 0.973 4.649 -5.360 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 7 . 1147 . 1 1 5 VAL HG13 H 1.666 3.190 -4.651 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 7 . 1148 . 1 1 5 VAL HG21 H 3.583 2.390 -5.835 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 7 . 1149 . 1 1 5 VAL HG22 H 4.686 3.256 -4.775 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 7 . 1150 . 1 1 5 VAL HG23 H 4.782 3.481 -6.514 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 7 . 1151 . 1 1 5 VAL N N 3.354 4.490 -7.980 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 7 . 1152 . 1 1 5 VAL O O 5.502 5.934 -7.144 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 7 . 1153 . 1 1 6 ARG C C 6.390 8.358 -5.487 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 7 . 1154 . 1 1 6 ARG CA C 5.384 8.551 -6.620 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 7 . 1155 . 1 1 6 ARG CB C 4.776 9.959 -6.573 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 7 . 1156 . 1 1 6 ARG CD C 3.283 11.583 -7.780 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 7 . 1157 . 1 1 6 ARG CG C 3.767 10.127 -7.716 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 7 . 1158 . 1 1 6 ARG CZ C 4.606 12.834 -9.387 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 7 . 1159 . 1 1 6 ARG H H 3.325 7.946 -6.303 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 7 . 1160 . 1 1 6 ARG HA H 5.876 8.413 -7.572 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 7 . 1161 . 1 1 6 ARG HB2 H 4.278 10.110 -5.624 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1162 . 1 1 6 ARG HB3 H 5.562 10.692 -6.684 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1163 . 1 1 6 ARG HD2 H 2.507 11.684 -8.528 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 7 . 1164 . 1 1 6 ARG HD3 H 2.919 11.902 -6.816 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 7 . 1165 . 1 1 6 ARG HE H 5.171 12.584 -7.499 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 7 . 1166 . 1 1 6 ARG HG2 H 4.235 9.862 -8.652 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 7 . 1167 . 1 1 6 ARG HG3 H 2.919 9.478 -7.542 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 7 . 1168 . 1 1 6 ARG HH11 H 3.064 14.107 -9.252 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 7 . 1169 . 1 1 6 ARG HH12 H 3.887 14.087 -10.775 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 7 . 1170 . 1 1 6 ARG HH21 H 6.182 11.675 -9.811 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 7 . 1171 . 1 1 6 ARG HH22 H 5.649 12.715 -11.090 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 7 . 1172 . 1 1 6 ARG N N 4.221 7.608 -6.516 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 7 . 1173 . 1 1 6 ARG NE N 4.480 12.385 -8.164 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 7 . 1174 . 1 1 6 ARG NH1 N 3.788 13.747 -9.839 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 7 . 1175 . 1 1 6 ARG NH2 N 5.552 12.372 -10.157 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 7 . 1176 . 1 1 6 ARG O O 6.222 8.818 -4.375 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 7 . 1177 . 1 1 7 GLY C C 8.825 5.884 -4.868 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 7 . 1178 . 1 1 7 GLY CA C 8.527 7.382 -4.814 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 7 . 1179 . 1 1 7 GLY H H 7.542 7.307 -6.715 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 7 . 1180 . 1 1 7 GLY HA2 H 9.415 7.947 -5.072 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 7 . 1181 . 1 1 7 GLY HA3 H 8.197 7.648 -3.822 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 7 . 1182 . 1 1 7 GLY N N 7.451 7.660 -5.804 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 7 . 1183 . 1 1 7 GLY O O 9.955 5.448 -4.779 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 7 . 1184 . 1 1 8 ASP C C 7.161 3.076 -6.326 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 7 . 1185 . 1 1 8 ASP CA C 7.963 3.613 -5.139 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 7 . 1186 . 1 1 8 ASP CB C 7.378 3.052 -3.836 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 7 . 1187 . 1 1 8 ASP CG C 8.448 3.004 -2.747 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 7 . 1188 . 1 1 8 ASP H H 6.909 5.503 -5.140 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 7 . 1189 . 1 1 8 ASP HA H 9.002 3.347 -5.227 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 7 . 1190 . 1 1 8 ASP HB2 H 6.562 3.681 -3.512 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1191 . 1 1 8 ASP HB3 H 7.006 2.051 -4.014 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1192 . 1 1 8 ASP N N 7.796 5.103 -5.047 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 7 . 1193 . 1 1 8 ASP O O 6.402 2.139 -6.190 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 7 . 1194 . 1 1 8 ASP OD1 O 9.068 4.027 -2.503 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 7 . 1195 . 1 1 8 ASP OD2 O 8.626 1.946 -2.166 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 7 . 1196 . 1 1 9 TYR C C 7.217 2.076 -9.442 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 7 . 1197 . 1 1 9 TYR CA C 6.502 3.172 -8.654 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 7 . 1198 . 1 1 9 TYR CB C 6.230 4.374 -9.584 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 7 . 1199 . 1 1 9 TYR CD1 C 8.636 5.159 -9.384 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 7 . 1200 . 1 1 9 TYR CD2 C 6.852 6.800 -9.344 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 7 . 1201 . 1 1 9 TYR CE1 C 9.579 6.181 -9.232 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 7 . 1202 . 1 1 9 TYR CE2 C 7.795 7.824 -9.194 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 7 . 1203 . 1 1 9 TYR CG C 7.270 5.470 -9.439 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 7 . 1204 . 1 1 9 TYR CZ C 9.159 7.514 -9.137 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 7 . 1205 . 1 1 9 TYR H H 7.922 4.415 -7.573 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 7 . 1206 . 1 1 9 TYR HA H 5.550 2.793 -8.290 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 7 . 1207 . 1 1 9 TYR HB2 H 6.225 4.033 -10.605 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1208 . 1 1 9 TYR HB3 H 5.259 4.778 -9.346 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1209 . 1 1 9 TYR HD1 H 8.959 4.131 -9.455 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 7 . 1210 . 1 1 9 TYR HD2 H 5.797 7.040 -9.387 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 7 . 1211 . 1 1 9 TYR HE1 H 10.630 5.944 -9.188 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 7 . 1212 . 1 1 9 TYR HE2 H 7.468 8.851 -9.122 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 7 . 1213 . 1 1 9 TYR HH H 10.438 8.733 -9.859 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 7 . 1214 . 1 1 9 TYR N N 7.307 3.661 -7.483 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 7 . 1215 . 1 1 9 TYR O O 8.029 2.337 -10.304 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 7 . 1216 . 1 1 9 TYR OH O 10.091 8.524 -8.988 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 7 . 1217 . 1 1 10 LEU C C 6.371 -0.811 -10.905 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 7 . 1218 . 1 1 10 LEU CA C 7.442 -0.287 -9.949 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 7 . 1219 . 1 1 10 LEU CB C 7.794 -1.337 -8.893 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 7 . 1220 . 1 1 10 LEU CD1 C 8.777 0.134 -7.123 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 7 . 1221 . 1 1 10 LEU CD2 C 9.688 -2.164 -7.491 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 7 . 1222 . 1 1 10 LEU CG C 9.085 -0.934 -8.175 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 7 . 1223 . 1 1 10 LEU H H 6.160 0.674 -8.520 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 7 . 1224 . 1 1 10 LEU HA H 8.325 0.022 -10.488 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 7 . 1225 . 1 1 10 LEU HB2 H 6.989 -1.408 -8.177 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1226 . 1 1 10 LEU HB3 H 7.935 -2.295 -9.372 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1227 . 1 1 10 LEU HD11 H 7.900 -0.153 -6.563 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 7 . 1228 . 1 1 10 LEU HD12 H 8.599 1.080 -7.611 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 7 . 1229 . 1 1 10 LEU HD13 H 9.617 0.230 -6.449 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 7 . 1230 . 1 1 10 LEU HD21 H 10.640 -1.901 -7.047 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 7 . 1231 . 1 1 10 LEU HD22 H 9.837 -2.945 -8.221 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 7 . 1232 . 1 1 10 LEU HD23 H 9.018 -2.514 -6.720 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 7 . 1233 . 1 1 10 LEU HG H 9.788 -0.538 -8.893 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 7 . 1234 . 1 1 10 LEU N N 6.856 0.848 -9.189 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 7 . 1235 . 1 1 10 LEU O O 5.736 -1.817 -10.650 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 7 . 1236 . 1 1 11 ASP C C 5.674 -1.497 -13.987 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 7 . 1237 . 1 1 11 ASP CA C 5.082 -0.555 -12.944 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 7 . 1238 . 1 1 11 ASP CB C 4.587 0.736 -13.603 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 7 . 1239 . 1 1 11 ASP CG C 3.506 0.411 -14.636 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 7 . 1240 . 1 1 11 ASP H H 6.650 0.700 -12.163 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 7 . 1241 . 1 1 11 ASP HA H 4.269 -1.032 -12.418 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 7 . 1242 . 1 1 11 ASP HB2 H 4.176 1.385 -12.850 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1243 . 1 1 11 ASP HB3 H 5.412 1.232 -14.093 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1244 . 1 1 11 ASP N N 6.142 -0.117 -11.990 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 7 . 1245 . 1 1 11 ASP O O 6.564 -1.139 -14.735 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 7 . 1246 . 1 1 11 ASP OD1 O 2.350 0.344 -14.252 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 7 . 1247 . 1 1 11 ASP OD2 O 3.851 0.243 -15.794 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 7 . 1248 . 1 1 12 CYS C C 7.218 -3.871 -14.804 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 7 . 1249 . 1 1 12 CYS CA C 5.712 -3.691 -15.020 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 7 . 1250 . 1 1 12 CYS CB C 5.428 -3.103 -16.409 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 7 . 1251 . 1 1 12 CYS H H 4.472 -2.968 -13.418 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 7 . 1252 . 1 1 12 CYS HA H 5.204 -4.636 -14.906 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 7 . 1253 . 1 1 12 CYS HB2 H 6.086 -2.265 -16.584 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 7 . 1254 . 1 1 12 CYS HB3 H 5.611 -3.859 -17.160 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 7 . 1255 . 1 1 12 CYS N N 5.185 -2.706 -14.036 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 7 . 1256 . 1 1 12 CYS O O 7.955 -4.134 -15.733 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 7 . 1257 . 1 1 12 CYS SG S 3.704 -2.540 -16.533 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 7 . 1258 . 1 1 13 NH2 HN1 H 7.109 -3.525 -12.852 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 7 . 1259 . 1 1 13 NH2 HN2 H 8.667 -3.846 -13.445 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 7 . 1260 . 1 1 13 NH2 N N 7.705 -3.736 -13.601 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 8 . 1261 . 1 1 1 ACE C C 2.238 -4.573 -7.101 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 8 . 1262 . 1 1 1 ACE CH3 C 3.261 -5.354 -6.275 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 8 . 1263 . 1 1 1 ACE H1 H 3.679 -4.710 -5.516 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 8 . 1264 . 1 1 1 ACE H2 H 4.052 -5.708 -6.921 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 8 . 1265 . 1 1 1 ACE H3 H 2.777 -6.197 -5.804 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 8 . 1266 . 1 1 1 ACE O O 1.046 -4.678 -6.894 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 8 . 1267 . 1 1 2 CYS C C 0.759 -2.223 -8.034 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 8 . 1268 . 1 1 2 CYS CA C 1.771 -2.990 -8.897 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 8 . 1269 . 1 1 2 CYS CB C 1.055 -4.021 -9.779 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 8 . 1270 . 1 1 2 CYS H H 3.668 -3.727 -8.188 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 8 . 1271 . 1 1 2 CYS HA H 2.328 -2.307 -9.516 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 8 . 1272 . 1 1 2 CYS HB2 H 0.531 -4.727 -9.152 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1273 . 1 1 2 CYS HB3 H 0.347 -3.516 -10.420 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1274 . 1 1 2 CYS N N 2.702 -3.790 -8.042 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 8 . 1275 . 1 1 2 CYS O O -0.412 -2.156 -8.353 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 8 . 1276 . 1 1 2 CYS SG S 2.268 -4.904 -10.798 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 8 . 1277 . 1 1 3 ARG C C 0.953 0.316 -5.430 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 8 . 1278 . 1 1 3 ARG CA C 0.256 -0.894 -6.066 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 8 . 1279 . 1 1 3 ARG CB C -0.161 -1.900 -4.991 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 8 . 1280 . 1 1 3 ARG CD C -2.575 -1.742 -4.361 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 8 . 1281 . 1 1 3 ARG CG C -1.568 -2.419 -5.294 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 8 . 1282 . 1 1 3 ARG CZ C -4.401 -0.306 -5.047 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 8 . 1283 . 1 1 3 ARG H H 2.145 -1.714 -6.702 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 8 . 1284 . 1 1 3 ARG HA H -0.609 -0.578 -6.627 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 8 . 1285 . 1 1 3 ARG HB2 H 0.536 -2.726 -4.985 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1286 . 1 1 3 ARG HB3 H -0.156 -1.418 -4.024 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1287 . 1 1 3 ARG HD2 H -2.864 -2.418 -3.568 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 8 . 1288 . 1 1 3 ARG HD3 H -2.158 -0.835 -3.952 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 8 . 1289 . 1 1 3 ARG HE H -4.021 -2.045 -5.928 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 8 . 1290 . 1 1 3 ARG HG2 H -1.821 -2.197 -6.321 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 8 . 1291 . 1 1 3 ARG HG3 H -1.599 -3.487 -5.138 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 8 . 1292 . 1 1 3 ARG HH11 H -4.426 -0.454 -3.051 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 8 . 1293 . 1 1 3 ARG HH12 H -5.202 0.948 -3.708 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 8 . 1294 . 1 1 3 ARG HH21 H -4.529 0.105 -7.002 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 8 . 1295 . 1 1 3 ARG HH22 H -5.260 1.264 -5.943 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 8 . 1296 . 1 1 3 ARG N N 1.199 -1.647 -6.944 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 8 . 1297 . 1 1 3 ARG NE N -3.745 -1.420 -5.225 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 8 . 1298 . 1 1 3 ARG NH1 N -4.700 0.093 -3.841 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 8 . 1299 . 1 1 3 ARG NH2 N -4.758 0.410 -6.077 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 8 . 1300 . 1 1 3 ARG O O 0.774 0.601 -4.262 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 8 . 1301 . 1 1 4 VAL C C 2.533 3.333 -6.664 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 8 . 1302 . 1 1 4 VAL CA C 2.447 2.221 -5.617 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 8 . 1303 . 1 1 4 VAL CB C 3.846 1.733 -5.235 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 8 . 1304 . 1 1 4 VAL CG1 C 4.540 2.803 -4.392 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 8 . 1305 . 1 1 4 VAL CG2 C 3.740 0.442 -4.419 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 8 . 1306 . 1 1 4 VAL H H 1.874 0.787 -7.127 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 8 . 1307 . 1 1 4 VAL HA H 1.930 2.574 -4.739 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 8 . 1308 . 1 1 4 VAL HB H 4.420 1.549 -6.132 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 8 . 1309 . 1 1 4 VAL HG11 H 5.313 2.343 -3.795 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 8 . 1310 . 1 1 4 VAL HG12 H 3.818 3.274 -3.742 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 8 . 1311 . 1 1 4 VAL HG13 H 4.979 3.546 -5.039 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 8 . 1312 . 1 1 4 VAL HG21 H 3.463 -0.373 -5.071 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 8 . 1313 . 1 1 4 VAL HG22 H 2.989 0.562 -3.653 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 8 . 1314 . 1 1 4 VAL HG23 H 4.693 0.228 -3.959 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 8 . 1315 . 1 1 4 VAL N N 1.744 1.031 -6.187 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 8 . 1316 . 1 1 4 VAL O O 2.214 3.132 -7.821 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 8 . 1317 . 1 1 5 VAL C C 4.391 6.349 -7.181 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 8 . 1318 . 1 1 5 VAL CA C 3.034 5.616 -7.267 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 8 . 1319 . 1 1 5 VAL CB C 1.862 6.545 -6.926 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 8 . 1320 . 1 1 5 VAL CG1 C 1.629 7.509 -8.092 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 8 . 1321 . 1 1 5 VAL CG2 C 0.590 5.718 -6.697 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 8 . 1322 . 1 1 5 VAL H H 3.205 4.663 -5.340 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 8 . 1323 . 1 1 5 VAL HA H 2.897 5.215 -8.252 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 8 . 1324 . 1 1 5 VAL HB H 2.095 7.107 -6.034 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 8 . 1325 . 1 1 5 VAL HG11 H 2.577 7.774 -8.535 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 8 . 1326 . 1 1 5 VAL HG12 H 1.138 8.399 -7.730 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 8 . 1327 . 1 1 5 VAL HG13 H 1.006 7.031 -8.836 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 8 . 1328 . 1 1 5 VAL HG21 H -0.261 6.379 -6.626 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 8 . 1329 . 1 1 5 VAL HG22 H 0.687 5.156 -5.779 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 8 . 1330 . 1 1 5 VAL HG23 H 0.449 5.035 -7.522 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 8 . 1331 . 1 1 5 VAL N N 2.953 4.509 -6.276 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 8 . 1332 . 1 1 5 VAL O O 5.442 5.750 -7.350 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 8 . 1333 . 1 1 6 ARG C C 6.412 8.064 -5.564 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 8 . 1334 . 1 1 6 ARG CA C 5.686 8.372 -6.865 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 8 . 1335 . 1 1 6 ARG CB C 5.320 9.856 -6.943 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 8 . 1336 . 1 1 6 ARG CD C 7.688 10.677 -7.100 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 8 . 1337 . 1 1 6 ARG CG C 6.340 10.584 -7.826 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 8 . 1338 . 1 1 6 ARG CZ C 8.596 12.462 -5.735 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 8 . 1339 . 1 1 6 ARG H H 3.550 8.114 -6.787 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 8 . 1340 . 1 1 6 ARG HA H 6.303 8.104 -7.710 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 8 . 1341 . 1 1 6 ARG HB2 H 4.333 9.960 -7.369 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1342 . 1 1 6 ARG HB3 H 5.333 10.284 -5.952 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1343 . 1 1 6 ARG HD2 H 7.681 10.061 -6.211 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 8 . 1344 . 1 1 6 ARG HD3 H 8.491 10.381 -7.758 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 8 . 1345 . 1 1 6 ARG HE H 7.354 12.799 -7.248 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 8 . 1346 . 1 1 6 ARG HG2 H 6.468 10.038 -8.750 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 8 . 1347 . 1 1 6 ARG HG3 H 5.982 11.578 -8.043 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 8 . 1348 . 1 1 6 ARG HH11 H 10.260 12.573 -6.844 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 8 . 1349 . 1 1 6 ARG HH12 H 10.455 12.946 -5.164 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 8 . 1350 . 1 1 6 ARG HH21 H 7.109 12.435 -4.395 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 8 . 1351 . 1 1 6 ARG HH22 H 8.668 12.867 -3.775 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 8 . 1352 . 1 1 6 ARG N N 4.392 7.636 -6.921 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 8 . 1353 . 1 1 6 ARG NE N 7.833 12.114 -6.735 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 8 . 1354 . 1 1 6 ARG NH1 N 9.870 12.677 -5.929 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 8 . 1355 . 1 1 6 ARG NH2 N 8.085 12.598 -4.542 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 8 . 1356 . 1 1 6 ARG O O 5.835 8.031 -4.495 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 8 . 1357 . 1 1 7 GLY C C 8.829 5.939 -4.645 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 8 . 1358 . 1 1 7 GLY CA C 8.486 7.417 -4.491 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 8 . 1359 . 1 1 7 GLY H H 8.093 7.789 -6.564 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 8 . 1360 . 1 1 7 GLY HA2 H 9.391 8.011 -4.461 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 8 . 1361 . 1 1 7 GLY HA3 H 7.915 7.566 -3.589 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 8 . 1362 . 1 1 7 GLY N N 7.677 7.787 -5.677 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 8 . 1363 . 1 1 7 GLY O O 9.912 5.496 -4.316 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 8 . 1364 . 1 1 8 ASP C C 7.339 3.267 -6.618 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 8 . 1365 . 1 1 8 ASP CA C 8.149 3.727 -5.403 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 8 . 1366 . 1 1 8 ASP CB C 7.666 3.034 -4.127 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 8 . 1367 . 1 1 8 ASP CG C 8.802 2.996 -3.101 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 8 . 1368 . 1 1 8 ASP H H 7.044 5.573 -5.460 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 8 . 1369 . 1 1 8 ASP HA H 9.200 3.539 -5.554 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 8 . 1370 . 1 1 8 ASP HB2 H 6.828 3.581 -3.718 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1371 . 1 1 8 ASP HB3 H 7.359 2.026 -4.360 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1372 . 1 1 8 ASP N N 7.903 5.178 -5.179 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 8 . 1373 . 1 1 8 ASP O O 6.292 2.668 -6.481 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 8 . 1374 . 1 1 8 ASP OD1 O 9.776 2.305 -3.349 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 8 . 1375 . 1 1 8 ASP OD2 O 8.676 3.656 -2.082 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 8 . 1376 . 1 1 9 TYR C C 7.303 1.726 -9.421 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 8 . 1377 . 1 1 9 TYR CA C 7.010 3.173 -9.014 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 8 . 1378 . 1 1 9 TYR CB C 7.475 4.131 -10.111 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 8 . 1379 . 1 1 9 TYR CD1 C 5.139 4.800 -10.773 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 8 . 1380 . 1 1 9 TYR CD2 C 6.713 6.527 -10.128 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 8 . 1381 . 1 1 9 TYR CE1 C 4.156 5.773 -10.984 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 8 . 1382 . 1 1 9 TYR CE2 C 5.730 7.502 -10.340 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 8 . 1383 . 1 1 9 TYR CG C 6.417 5.179 -10.345 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 8 . 1384 . 1 1 9 TYR CZ C 4.451 7.126 -10.768 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 8 . 1385 . 1 1 9 TYR H H 8.623 4.077 -7.902 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 8 . 1386 . 1 1 9 TYR HA H 5.951 3.310 -8.837 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 8 . 1387 . 1 1 9 TYR HB2 H 8.394 4.610 -9.806 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1388 . 1 1 9 TYR HB3 H 7.642 3.580 -11.024 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1389 . 1 1 9 TYR HD1 H 4.913 3.757 -10.940 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 8 . 1390 . 1 1 9 TYR HD2 H 7.699 6.814 -9.792 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 8 . 1391 . 1 1 9 TYR HE1 H 3.170 5.480 -11.314 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 8 . 1392 . 1 1 9 TYR HE2 H 5.958 8.545 -10.173 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 8 . 1393 . 1 1 9 TYR HH H 2.752 7.682 -11.448 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 8 . 1394 . 1 1 9 TYR N N 7.793 3.566 -7.805 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 8 . 1395 . 1 1 9 TYR O O 8.371 1.398 -9.896 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 8 . 1396 . 1 1 9 TYR OH O 3.482 8.088 -10.975 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 8 . 1397 . 1 1 10 LEU C C 5.156 -1.049 -10.203 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 8 . 1398 . 1 1 10 LEU CA C 6.488 -0.562 -9.634 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 8 . 1399 . 1 1 10 LEU CB C 6.839 -1.311 -8.342 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 8 . 1400 . 1 1 10 LEU CD1 C 5.032 -2.178 -6.831 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 8 . 1401 . 1 1 10 LEU CD2 C 6.623 -0.437 -6.007 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 8 . 1402 . 1 1 10 LEU CG C 5.849 -0.945 -7.228 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 8 . 1403 . 1 1 10 LEU H H 5.480 1.180 -8.883 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 8 . 1404 . 1 1 10 LEU HA H 7.277 -0.678 -10.361 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 8 . 1405 . 1 1 10 LEU HB2 H 6.797 -2.375 -8.526 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1406 . 1 1 10 LEU HB3 H 7.839 -1.042 -8.036 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1407 . 1 1 10 LEU HD11 H 5.029 -2.279 -5.756 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 8 . 1408 . 1 1 10 LEU HD12 H 5.470 -3.061 -7.274 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 8 . 1409 . 1 1 10 LEU HD13 H 4.019 -2.066 -7.184 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 8 . 1410 . 1 1 10 LEU HD21 H 6.854 -1.268 -5.358 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 8 . 1411 . 1 1 10 LEU HD22 H 6.022 0.281 -5.472 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 8 . 1412 . 1 1 10 LEU HD23 H 7.540 0.031 -6.333 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 8 . 1413 . 1 1 10 LEU HG H 5.179 -0.173 -7.576 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 8 . 1414 . 1 1 10 LEU N N 6.333 0.871 -9.251 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 8 . 1415 . 1 1 10 LEU O O 4.624 -2.063 -9.798 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 8 . 1416 . 1 1 11 ASP C C 3.499 -1.609 -12.929 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 8 . 1417 . 1 1 11 ASP CA C 3.296 -0.690 -11.725 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 8 . 1418 . 1 1 11 ASP CB C 2.669 0.637 -12.156 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 8 . 1419 . 1 1 11 ASP CG C 1.206 0.411 -12.536 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 8 . 1420 . 1 1 11 ASP H H 5.055 0.511 -11.425 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 8 . 1421 . 1 1 11 ASP HA H 2.669 -1.167 -10.986 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 8 . 1422 . 1 1 11 ASP HB2 H 2.724 1.342 -11.338 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1423 . 1 1 11 ASP HB3 H 3.206 1.030 -13.006 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1424 . 1 1 11 ASP N N 4.608 -0.310 -11.131 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 8 . 1425 . 1 1 11 ASP O O 4.553 -1.635 -13.535 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 8 . 1426 . 1 1 11 ASP OD1 O 0.968 -0.129 -13.603 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 8 . 1427 . 1 1 11 ASP OD2 O 0.346 0.782 -11.752 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 8 . 1428 . 1 1 12 CYS C C 1.367 -3.265 -15.290 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 8 . 1429 . 1 1 12 CYS CA C 2.626 -3.315 -14.416 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 8 . 1430 . 1 1 12 CYS CB C 2.786 -4.699 -13.775 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 8 . 1431 . 1 1 12 CYS H H 1.666 -2.345 -12.752 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 8 . 1432 . 1 1 12 CYS HA H 3.500 -3.078 -14.999 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 8 . 1433 . 1 1 12 CYS HB2 H 2.788 -5.455 -14.546 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 8 . 1434 . 1 1 12 CYS HB3 H 3.721 -4.737 -13.234 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 8 . 1435 . 1 1 12 CYS N N 2.500 -2.377 -13.265 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 8 . 1436 . 1 1 12 CYS O O 0.684 -4.255 -15.456 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 8 . 1437 . 1 1 12 CYS SG S 1.416 -5.010 -12.629 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 8 . 1438 . 1 1 13 NH2 HN1 H 1.581 -1.340 -15.735 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 8 . 1439 . 1 1 13 NH2 HN2 H 0.231 -2.100 -16.428 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 8 . 1440 . 1 1 13 NH2 N N 1.033 -2.142 -15.865 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 9 . 1441 . 1 1 1 ACE C C 1.590 -5.491 -9.591 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 9 . 1442 . 1 1 1 ACE CH3 C 0.744 -6.617 -8.993 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 9 . 1443 . 1 1 1 ACE H1 H 1.355 -7.496 -8.865 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 9 . 1444 . 1 1 1 ACE H2 H -0.077 -6.842 -9.660 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 9 . 1445 . 1 1 1 ACE H3 H 0.355 -6.304 -8.036 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 9 . 1446 . 1 1 1 ACE O O 2.563 -5.057 -9.006 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 9 . 1447 . 1 1 2 CYS C C 1.414 -2.556 -11.010 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 9 . 1448 . 1 1 2 CYS CA C 2.014 -3.915 -11.384 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 9 . 1449 . 1 1 2 CYS CB C 1.898 -4.161 -12.889 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 9 . 1450 . 1 1 2 CYS H H 0.441 -5.379 -11.208 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 9 . 1451 . 1 1 2 CYS HA H 3.046 -3.969 -11.078 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 9 . 1452 . 1 1 2 CYS HB2 H 0.978 -4.686 -13.098 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1453 . 1 1 2 CYS HB3 H 1.902 -3.215 -13.409 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1454 . 1 1 2 CYS N N 1.228 -5.014 -10.752 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 9 . 1455 . 1 1 2 CYS O O 0.612 -2.000 -11.735 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 9 . 1456 . 1 1 2 CYS SG S 3.301 -5.161 -13.445 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 9 . 1457 . 1 1 3 ARG C C 2.387 0.298 -9.235 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 9 . 1458 . 1 1 3 ARG CA C 1.248 -0.698 -9.451 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 9 . 1459 . 1 1 3 ARG CB C 0.538 -0.979 -8.127 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 9 . 1460 . 1 1 3 ARG CD C -1.569 -1.824 -7.093 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 9 . 1461 . 1 1 3 ARG CG C -0.923 -1.339 -8.392 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 9 . 1462 . 1 1 3 ARG CZ C -1.811 -0.637 -4.996 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 9 . 1463 . 1 1 3 ARG H H 2.441 -2.488 -9.311 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 9 . 1464 . 1 1 3 ARG HA H 0.544 -0.325 -10.178 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 9 . 1465 . 1 1 3 ARG HB2 H 1.027 -1.802 -7.626 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1466 . 1 1 3 ARG HB3 H 0.583 -0.100 -7.501 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1467 . 1 1 3 ARG HD2 H -2.502 -2.330 -7.304 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 9 . 1468 . 1 1 3 ARG HD3 H -0.897 -2.479 -6.561 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 9 . 1469 . 1 1 3 ARG HE H -1.974 0.264 -6.757 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 9 . 1470 . 1 1 3 ARG HG2 H -1.448 -0.467 -8.755 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 9 . 1471 . 1 1 3 ARG HG3 H -0.972 -2.124 -9.132 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 9 . 1472 . 1 1 3 ARG HH11 H -3.583 -1.561 -4.878 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 9 . 1473 . 1 1 3 ARG HH12 H -2.813 -1.221 -3.364 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 9 . 1474 . 1 1 3 ARG HH21 H -0.038 0.275 -4.809 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 9 . 1475 . 1 1 3 ARG HH22 H -0.806 -0.181 -3.325 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 9 . 1476 . 1 1 3 ARG N N 1.795 -2.021 -9.879 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 9 . 1477 . 1 1 3 ARG NE N -1.812 -0.587 -6.300 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 9 . 1478 . 1 1 3 ARG NH1 N -2.814 -1.182 -4.363 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 9 . 1479 . 1 1 3 ARG NH2 N -0.807 -0.143 -4.324 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 9 . 1480 . 1 1 3 ARG O O 3.496 -0.080 -8.908 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 9 . 1481 . 1 1 4 VAL C C 2.821 3.648 -8.206 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 9 . 1482 . 1 1 4 VAL CA C 3.226 2.570 -9.214 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 9 . 1483 . 1 1 4 VAL CB C 3.469 3.205 -10.590 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 9 . 1484 . 1 1 4 VAL CG1 C 2.392 4.252 -10.888 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 9 . 1485 . 1 1 4 VAL CG2 C 4.838 3.889 -10.590 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 9 . 1486 . 1 1 4 VAL H H 1.239 1.866 -9.683 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 9 . 1487 . 1 1 4 VAL HA H 4.125 2.073 -8.883 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 9 . 1488 . 1 1 4 VAL HB H 3.447 2.443 -11.351 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 9 . 1489 . 1 1 4 VAL HG11 H 2.336 4.417 -11.954 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 9 . 1490 . 1 1 4 VAL HG12 H 2.647 5.179 -10.393 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 9 . 1491 . 1 1 4 VAL HG13 H 1.440 3.900 -10.524 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 9 . 1492 . 1 1 4 VAL HG21 H 5.000 4.375 -9.638 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 9 . 1493 . 1 1 4 VAL HG22 H 4.875 4.625 -11.378 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 9 . 1494 . 1 1 4 VAL HG23 H 5.611 3.151 -10.750 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 9 . 1495 . 1 1 4 VAL N N 2.136 1.571 -9.417 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 9 . 1496 . 1 1 4 VAL O O 1.668 4.027 -8.103 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 9 . 1497 . 1 1 5 VAL C C 4.547 6.362 -6.772 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 9 . 1498 . 1 1 5 VAL CA C 3.499 5.276 -6.534 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 9 . 1499 . 1 1 5 VAL CB C 3.642 4.697 -5.120 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 9 . 1500 . 1 1 5 VAL CG1 C 2.618 5.369 -4.202 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 9 . 1501 . 1 1 5 VAL CG2 C 3.388 3.187 -5.129 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 9 . 1502 . 1 1 5 VAL H H 4.703 3.876 -7.634 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 9 . 1503 . 1 1 5 VAL HA H 2.505 5.669 -6.685 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 9 . 1504 . 1 1 5 VAL HB H 4.637 4.901 -4.751 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 9 . 1505 . 1 1 5 VAL HG11 H 2.615 6.434 -4.384 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 9 . 1506 . 1 1 5 VAL HG12 H 2.880 5.181 -3.172 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 9 . 1507 . 1 1 5 VAL HG13 H 1.636 4.967 -4.405 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 9 . 1508 . 1 1 5 VAL HG21 H 4.170 2.695 -5.688 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 9 . 1509 . 1 1 5 VAL HG22 H 2.434 2.986 -5.592 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 9 . 1510 . 1 1 5 VAL HG23 H 3.380 2.815 -4.114 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 9 . 1511 . 1 1 5 VAL N N 3.779 4.177 -7.500 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 9 . 1512 . 1 1 5 VAL O O 5.621 6.084 -7.276 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 9 . 1513 . 1 1 6 ARG C C 6.393 8.513 -5.596 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 9 . 1514 . 1 1 6 ARG CA C 5.305 8.643 -6.660 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 9 . 1515 . 1 1 6 ARG CB C 4.571 9.983 -6.558 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 9 . 1516 . 1 1 6 ARG CD C 4.210 11.450 -4.582 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 9 . 1517 . 1 1 6 ARG CG C 3.887 10.090 -5.200 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 9 . 1518 . 1 1 6 ARG CZ C 2.169 12.636 -4.047 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 9 . 1519 . 1 1 6 ARG H H 3.420 7.810 -5.999 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 9 . 1520 . 1 1 6 ARG HA H 5.720 8.532 -7.647 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 9 . 1521 . 1 1 6 ARG HB2 H 5.285 10.789 -6.673 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1522 . 1 1 6 ARG HB3 H 3.829 10.048 -7.343 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1523 . 1 1 6 ARG HD2 H 5.129 11.391 -4.013 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 9 . 1524 . 1 1 6 ARG HD3 H 4.290 12.200 -5.351 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 9 . 1525 . 1 1 6 ARG HE H 2.972 11.288 -2.830 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 9 . 1526 . 1 1 6 ARG HG2 H 2.818 9.989 -5.324 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 9 . 1527 . 1 1 6 ARG HG3 H 4.250 9.306 -4.553 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 9 . 1528 . 1 1 6 ARG HH11 H 3.353 14.209 -3.675 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 9 . 1529 . 1 1 6 ARG HH12 H 1.769 14.586 -4.265 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 9 . 1530 . 1 1 6 ARG HH21 H 0.776 11.273 -4.501 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 9 . 1531 . 1 1 6 ARG HH22 H 0.311 12.925 -4.733 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 9 . 1532 . 1 1 6 ARG N N 4.276 7.588 -6.418 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 9 . 1533 . 1 1 6 ARG NE N 3.060 11.751 -3.689 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 9 . 1534 . 1 1 6 ARG NH1 N 2.453 13.909 -3.992 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 9 . 1535 . 1 1 6 ARG NH2 N 0.994 12.248 -4.458 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 9 . 1536 . 1 1 6 ARG O O 6.442 9.244 -4.627 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 9 . 1537 . 1 1 7 GLY C C 8.607 5.774 -4.824 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 9 . 1538 . 1 1 7 GLY CA C 8.354 7.278 -4.820 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 9 . 1539 . 1 1 7 GLY H H 7.163 6.971 -6.572 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 9 . 1540 . 1 1 7 GLY HA2 H 9.247 7.801 -5.128 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 9 . 1541 . 1 1 7 GLY HA3 H 8.063 7.593 -3.830 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 9 . 1542 . 1 1 7 GLY N N 7.255 7.547 -5.786 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 9 . 1543 . 1 1 7 GLY O O 9.726 5.312 -4.711 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 9 . 1544 . 1 1 8 ASP C C 7.315 3.085 -6.472 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 9 . 1545 . 1 1 8 ASP CA C 7.713 3.531 -5.069 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 9 . 1546 . 1 1 8 ASP CB C 6.748 2.968 -4.021 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 9 . 1547 . 1 1 8 ASP CG C 7.241 3.340 -2.621 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 9 . 1548 . 1 1 8 ASP H H 6.675 5.412 -5.132 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 9 . 1549 . 1 1 8 ASP HA H 8.727 3.240 -4.847 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 9 . 1550 . 1 1 8 ASP HB2 H 5.764 3.385 -4.179 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1551 . 1 1 8 ASP HB3 H 6.703 1.894 -4.111 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1552 . 1 1 8 ASP N N 7.562 5.008 -5.004 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 9 . 1553 . 1 1 8 ASP O O 6.339 2.385 -6.661 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 9 . 1554 . 1 1 8 ASP OD1 O 7.563 4.499 -2.417 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 9 . 1555 . 1 1 8 ASP OD2 O 7.289 2.460 -1.778 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 9 . 1556 . 1 1 9 TYR C C 8.131 1.683 -9.114 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 9 . 1557 . 1 1 9 TYR CA C 7.708 3.134 -8.857 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 9 . 1558 . 1 1 9 TYR CB C 8.530 4.081 -9.753 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 9 . 1559 . 1 1 9 TYR CD1 C 7.207 6.233 -9.913 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 9 . 1560 . 1 1 9 TYR CD2 C 9.186 6.190 -8.512 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 9 . 1561 . 1 1 9 TYR CE1 C 7.002 7.576 -9.581 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 9 . 1562 . 1 1 9 TYR CE2 C 8.981 7.535 -8.179 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 9 . 1563 . 1 1 9 TYR CG C 8.297 5.535 -9.379 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 9 . 1564 . 1 1 9 TYR CZ C 7.887 8.229 -8.714 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 9 . 1565 . 1 1 9 TYR H H 8.826 4.084 -7.287 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 9 . 1566 . 1 1 9 TYR HA H 6.650 3.273 -9.041 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 9 . 1567 . 1 1 9 TYR HB2 H 9.577 3.853 -9.639 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1568 . 1 1 9 TYR HB3 H 8.247 3.930 -10.787 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1569 . 1 1 9 TYR HD1 H 6.523 5.734 -10.581 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 9 . 1570 . 1 1 9 TYR HD2 H 10.029 5.659 -8.100 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 9 . 1571 . 1 1 9 TYR HE1 H 6.161 8.109 -9.995 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 9 . 1572 . 1 1 9 TYR HE2 H 9.665 8.036 -7.508 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 9 . 1573 . 1 1 9 TYR HH H 8.113 10.097 -9.057 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 9 . 1574 . 1 1 9 TYR N N 8.057 3.505 -7.461 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 9 . 1575 . 1 1 9 TYR O O 9.037 1.417 -9.875 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 9 . 1576 . 1 1 9 TYR OH O 7.685 9.556 -8.388 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 9 . 1577 . 1 1 10 LEU C C 6.864 -1.325 -9.704 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 9 . 1578 . 1 1 10 LEU CA C 7.820 -0.693 -8.688 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 9 . 1579 . 1 1 10 LEU CB C 7.610 -1.348 -7.316 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 9 . 1580 . 1 1 10 LEU CD1 C 10.106 -1.348 -7.015 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 9 . 1581 . 1 1 10 LEU CD2 C 8.729 0.464 -5.984 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 9 . 1582 . 1 1 10 LEU CG C 8.766 -1.020 -6.358 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 9 . 1583 . 1 1 10 LEU H H 6.737 0.983 -7.883 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 9 . 1584 . 1 1 10 LEU HA H 8.846 -0.797 -9.005 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 9 . 1585 . 1 1 10 LEU HB2 H 6.686 -0.982 -6.894 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1586 . 1 1 10 LEU HB3 H 7.543 -2.418 -7.440 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1587 . 1 1 10 LEU HD11 H 10.003 -2.243 -7.611 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 9 . 1588 . 1 1 10 LEU HD12 H 10.852 -1.508 -6.251 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 9 . 1589 . 1 1 10 LEU HD13 H 10.406 -0.526 -7.648 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 9 . 1590 . 1 1 10 LEU HD21 H 7.721 0.744 -5.714 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 9 . 1591 . 1 1 10 LEU HD22 H 9.053 1.057 -6.826 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 9 . 1592 . 1 1 10 LEU HD23 H 9.387 0.639 -5.145 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 9 . 1593 . 1 1 10 LEU HG H 8.655 -1.615 -5.462 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 9 . 1594 . 1 1 10 LEU N N 7.469 0.742 -8.485 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 9 . 1595 . 1 1 10 LEU O O 6.640 -2.523 -9.687 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 9 . 1596 . 1 1 11 ASP C C 6.090 -1.642 -12.770 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 9 . 1597 . 1 1 11 ASP CA C 5.323 -1.103 -11.566 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 9 . 1598 . 1 1 11 ASP CB C 4.437 0.071 -11.987 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 9 . 1599 . 1 1 11 ASP CG C 3.066 -0.437 -12.454 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 9 . 1600 . 1 1 11 ASP H H 6.465 0.428 -10.560 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 9 . 1601 . 1 1 11 ASP HA H 4.724 -1.878 -11.112 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 9 . 1602 . 1 1 11 ASP HB2 H 4.305 0.736 -11.150 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1603 . 1 1 11 ASP HB3 H 4.913 0.603 -12.797 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1604 . 1 1 11 ASP N N 6.283 -0.534 -10.573 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 9 . 1605 . 1 1 11 ASP O O 7.304 -1.606 -12.808 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 9 . 1606 . 1 1 11 ASP OD1 O 3.036 -1.297 -13.318 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 9 . 1607 . 1 1 11 ASP OD2 O 2.069 0.059 -11.952 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 9 . 1608 . 1 1 12 CYS C C 5.678 -1.949 -16.214 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 9 . 1609 . 1 1 12 CYS CA C 6.106 -2.694 -14.947 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 9 . 1610 . 1 1 12 CYS CB C 5.689 -4.162 -15.015 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 9 . 1611 . 1 1 12 CYS H H 4.421 -2.176 -13.705 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 9 . 1612 . 1 1 12 CYS HA H 7.173 -2.623 -14.813 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 9 . 1613 . 1 1 12 CYS HB2 H 6.153 -4.627 -15.872 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 9 . 1614 . 1 1 12 CYS HB3 H 6.010 -4.668 -14.115 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 9 . 1615 . 1 1 12 CYS N N 5.400 -2.148 -13.753 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 9 . 1616 . 1 1 12 CYS O O 5.734 -2.488 -17.301 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 9 . 1617 . 1 1 12 CYS SG S 3.889 -4.284 -15.166 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 9 . 1618 . 1 1 13 NH2 HN1 H 5.204 -0.289 -15.238 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 9 . 1619 . 1 1 13 NH2 HN2 H 4.977 -0.236 -16.921 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 9 . 1620 . 1 1 13 NH2 N N 5.249 -0.724 -16.116 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 10 . 1621 . 1 1 1 ACE C C 0.797 -5.086 -4.926 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 10 . 1622 . 1 1 1 ACE CH3 C 1.101 -6.297 -4.041 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 10 . 1623 . 1 1 1 ACE H1 H 1.856 -6.033 -3.315 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 10 . 1624 . 1 1 1 ACE H2 H 1.461 -7.109 -4.655 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 10 . 1625 . 1 1 1 ACE H3 H 0.200 -6.603 -3.530 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 10 . 1626 . 1 1 1 ACE O O -0.344 -4.786 -5.212 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 10 . 1627 . 1 1 2 CYS C C 0.609 -2.218 -5.591 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 10 . 1628 . 1 1 2 CYS CA C 1.605 -3.193 -6.233 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 10 . 1629 . 1 1 2 CYS CB C 1.041 -3.743 -7.547 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 10 . 1630 . 1 1 2 CYS H H 2.727 -4.657 -5.114 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 10 . 1631 . 1 1 2 CYS HA H 2.545 -2.698 -6.416 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 10 . 1632 . 1 1 2 CYS HB2 H 0.231 -4.424 -7.333 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1633 . 1 1 2 CYS HB3 H 0.673 -2.926 -8.150 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1634 . 1 1 2 CYS N N 1.817 -4.390 -5.360 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 10 . 1635 . 1 1 2 CYS O O -0.579 -2.279 -5.842 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 10 . 1636 . 1 1 2 CYS SG S 2.340 -4.622 -8.451 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 10 . 1637 . 1 1 3 ARG C C 0.845 1.016 -3.923 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 10 . 1638 . 1 1 3 ARG CA C 0.159 -0.343 -4.115 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 10 . 1639 . 1 1 3 ARG CB C -0.170 -0.973 -2.761 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 10 . 1640 . 1 1 3 ARG CD C -2.646 -0.745 -2.532 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 10 . 1641 . 1 1 3 ARG CG C -1.507 -1.712 -2.852 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 10 . 1642 . 1 1 3 ARG CZ C -4.552 -2.167 -2.083 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 10 . 1643 . 1 1 3 ARG H H 2.044 -1.280 -4.580 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 10 . 1644 . 1 1 3 ARG HA H -0.742 -0.231 -4.697 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 10 . 1645 . 1 1 3 ARG HB2 H 0.611 -1.669 -2.490 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1646 . 1 1 3 ARG HB3 H -0.238 -0.200 -2.010 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1647 . 1 1 3 ARG HD2 H -2.671 -0.532 -1.472 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 10 . 1648 . 1 1 3 ARG HD3 H -2.535 0.167 -3.098 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 10 . 1649 . 1 1 3 ARG HE H -4.197 -1.394 -3.877 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 10 . 1650 . 1 1 3 ARG HG2 H -1.634 -2.102 -3.851 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 10 . 1651 . 1 1 3 ARG HG3 H -1.517 -2.526 -2.142 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 10 . 1652 . 1 1 3 ARG HH11 H -5.186 -0.578 -1.043 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 10 . 1653 . 1 1 3 ARG HH12 H -5.713 -2.119 -0.453 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 10 . 1654 . 1 1 3 ARG HH21 H -4.074 -3.921 -2.921 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 10 . 1655 . 1 1 3 ARG HH22 H -5.083 -4.012 -1.517 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 10 . 1656 . 1 1 3 ARG N N 1.083 -1.316 -4.768 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 10 . 1657 . 1 1 3 ARG NE N -3.884 -1.458 -2.950 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 10 . 1658 . 1 1 3 ARG NH1 N -5.202 -1.575 -1.118 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 10 . 1659 . 1 1 3 ARG NH2 N -4.572 -3.468 -2.181 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 10 . 1660 . 1 1 3 ARG O O 0.644 1.681 -2.925 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 10 . 1661 . 1 1 4 VAL C C 2.657 3.381 -6.074 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 10 . 1662 . 1 1 4 VAL CA C 2.359 2.746 -4.703 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 10 . 1663 . 1 1 4 VAL CB C 3.645 2.407 -3.949 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 10 . 1664 . 1 1 4 VAL CG1 C 4.475 1.409 -4.762 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 10 . 1665 . 1 1 4 VAL CG2 C 4.453 3.684 -3.713 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 10 . 1666 . 1 1 4 VAL H H 1.821 0.883 -5.654 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 10 . 1667 . 1 1 4 VAL HA H 1.759 3.414 -4.109 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 10 . 1668 . 1 1 4 VAL HB H 3.389 1.964 -2.997 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 10 . 1669 . 1 1 4 VAL HG11 H 4.150 0.404 -4.537 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 10 . 1670 . 1 1 4 VAL HG12 H 5.517 1.516 -4.507 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 10 . 1671 . 1 1 4 VAL HG13 H 4.340 1.601 -5.816 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 10 . 1672 . 1 1 4 VAL HG21 H 3.802 4.454 -3.322 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 10 . 1673 . 1 1 4 VAL HG22 H 4.883 4.017 -4.645 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 10 . 1674 . 1 1 4 VAL HG23 H 5.240 3.484 -3.002 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 10 . 1675 . 1 1 4 VAL N N 1.662 1.432 -4.858 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 10 . 1676 . 1 1 4 VAL O O 2.514 2.751 -7.103 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 10 . 1677 . 1 1 5 VAL C C 4.596 6.218 -7.267 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 10 . 1678 . 1 1 5 VAL CA C 3.360 5.310 -7.387 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 10 . 1679 . 1 1 5 VAL CB C 2.082 6.105 -7.725 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 10 . 1680 . 1 1 5 VAL CG1 C 1.498 6.777 -6.474 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 10 . 1681 . 1 1 5 VAL CG2 C 2.381 7.168 -8.793 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 10 . 1682 . 1 1 5 VAL H H 3.169 5.119 -5.254 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 10 . 1683 . 1 1 5 VAL HA H 3.531 4.577 -8.144 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 10 . 1684 . 1 1 5 VAL HB H 1.353 5.421 -8.109 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 10 . 1685 . 1 1 5 VAL HG11 H 2.217 6.735 -5.671 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 10 . 1686 . 1 1 5 VAL HG12 H 0.599 6.260 -6.176 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 10 . 1687 . 1 1 5 VAL HG13 H 1.261 7.809 -6.695 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 10 . 1688 . 1 1 5 VAL HG21 H 1.595 7.168 -9.533 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 10 . 1689 . 1 1 5 VAL HG22 H 3.323 6.943 -9.272 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 10 . 1690 . 1 1 5 VAL HG23 H 2.438 8.141 -8.329 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 10 . 1691 . 1 1 5 VAL N N 3.063 4.630 -6.091 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 10 . 1692 . 1 1 5 VAL O O 5.710 5.807 -7.538 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 10 . 1693 . 1 1 6 ARG C C 6.369 8.020 -5.493 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 10 . 1694 . 1 1 6 ARG CA C 5.569 8.376 -6.738 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 10 . 1695 . 1 1 6 ARG CB C 4.958 9.773 -6.617 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 10 . 1696 . 1 1 6 ARG CD C 6.946 10.941 -7.605 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 10 . 1697 . 1 1 6 ARG CG C 6.064 10.805 -6.359 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 10 . 1698 . 1 1 6 ARG CZ C 9.323 11.352 -7.355 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 10 . 1699 . 1 1 6 ARG H H 3.511 7.743 -6.658 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 10 . 1700 . 1 1 6 ARG HA H 6.195 8.322 -7.608 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 10 . 1701 . 1 1 6 ARG HB2 H 4.442 10.018 -7.535 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1702 . 1 1 6 ARG HB3 H 4.256 9.787 -5.797 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1703 . 1 1 6 ARG HD2 H 7.282 9.967 -7.933 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 10 . 1704 . 1 1 6 ARG HD3 H 6.406 11.440 -8.395 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 10 . 1705 . 1 1 6 ARG HE H 7.944 12.644 -6.741 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 10 . 1706 . 1 1 6 ARG HG2 H 5.617 11.762 -6.130 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 10 . 1707 . 1 1 6 ARG HG3 H 6.670 10.484 -5.527 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 10 . 1708 . 1 1 6 ARG HH11 H 9.254 11.550 -9.346 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 10 . 1709 . 1 1 6 ARG HH12 H 10.749 10.957 -8.702 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 10 . 1710 . 1 1 6 ARG HH21 H 9.679 11.060 -5.406 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 10 . 1711 . 1 1 6 ARG HH22 H 10.990 10.681 -6.473 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 10 . 1712 . 1 1 6 ARG N N 4.409 7.440 -6.863 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 10 . 1713 . 1 1 6 ARG NE N 8.101 11.776 -7.169 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 10 . 1714 . 1 1 6 ARG NH1 N 9.813 11.281 -8.562 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 10 . 1715 . 1 1 6 ARG NH2 N 10.054 11.004 -6.332 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 10 . 1716 . 1 1 6 ARG O O 5.836 7.846 -4.416 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 10 . 1717 . 1 1 7 GLY C C 8.819 5.965 -4.712 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 10 . 1718 . 1 1 7 GLY CA C 8.520 7.451 -4.533 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 10 . 1719 . 1 1 7 GLY H H 8.037 7.967 -6.558 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 10 . 1720 . 1 1 7 GLY HA2 H 9.439 8.020 -4.552 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 10 . 1721 . 1 1 7 GLY HA3 H 8.008 7.609 -3.595 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 10 . 1722 . 1 1 7 GLY N N 7.651 7.857 -5.664 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 10 . 1723 . 1 1 7 GLY O O 9.890 5.485 -4.395 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 10 . 1724 . 1 1 8 ASP C C 7.077 3.351 -6.584 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 10 . 1725 . 1 1 8 ASP CA C 8.054 3.790 -5.490 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 10 . 1726 . 1 1 8 ASP CB C 7.749 3.108 -4.157 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 10 . 1727 . 1 1 8 ASP CG C 9.038 2.990 -3.342 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 10 . 1728 . 1 1 8 ASP H H 7.024 5.657 -5.514 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 10 . 1729 . 1 1 8 ASP HA H 9.071 3.588 -5.789 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 10 . 1730 . 1 1 8 ASP HB2 H 7.028 3.695 -3.609 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1731 . 1 1 8 ASP HB3 H 7.350 2.122 -4.340 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1732 . 1 1 8 ASP N N 7.867 5.238 -5.244 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 10 . 1733 . 1 1 8 ASP O O 5.942 3.021 -6.315 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 10 . 1734 . 1 1 8 ASP OD1 O 9.864 2.164 -3.695 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 10 . 1735 . 1 1 8 ASP OD2 O 9.178 3.729 -2.382 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 10 . 1736 . 1 1 9 TYR C C 6.570 1.464 -9.131 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 10 . 1737 . 1 1 9 TYR CA C 6.581 2.981 -8.930 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 10 . 1738 . 1 1 9 TYR CB C 7.160 3.654 -10.172 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 10 . 1739 . 1 1 9 TYR CD1 C 5.717 5.673 -10.599 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 10 . 1740 . 1 1 9 TYR CD2 C 7.866 5.977 -9.520 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 10 . 1741 . 1 1 9 TYR CE1 C 5.484 7.050 -10.525 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 10 . 1742 . 1 1 9 TYR CE2 C 7.632 7.354 -9.446 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 10 . 1743 . 1 1 9 TYR CG C 6.910 5.137 -10.096 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 10 . 1744 . 1 1 9 TYR CZ C 6.441 7.890 -9.949 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 10 . 1745 . 1 1 9 TYR H H 8.406 3.671 -8.004 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 10 . 1746 . 1 1 9 TYR HA H 5.581 3.352 -8.750 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 10 . 1747 . 1 1 9 TYR HB2 H 8.222 3.468 -10.219 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1748 . 1 1 9 TYR HB3 H 6.684 3.253 -11.054 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1749 . 1 1 9 TYR HD1 H 4.978 5.024 -11.045 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 10 . 1750 . 1 1 9 TYR HD2 H 8.783 5.563 -9.131 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 10 . 1751 . 1 1 9 TYR HE1 H 4.564 7.464 -10.911 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 10 . 1752 . 1 1 9 TYR HE2 H 8.371 8.005 -9.001 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 10 . 1753 . 1 1 9 TYR HH H 5.373 9.382 -9.424 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 10 . 1754 . 1 1 9 TYR N N 7.500 3.371 -7.813 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 10 . 1755 . 1 1 9 TYR O O 7.421 0.904 -9.794 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 10 . 1756 . 1 1 9 TYR OH O 6.209 9.249 -9.876 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 10 . 1757 . 1 1 10 LEU C C 4.017 -1.053 -8.908 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 10 . 1758 . 1 1 10 LEU CA C 5.489 -0.674 -8.751 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 10 . 1759 . 1 1 10 LEU CB C 6.072 -1.278 -7.469 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 10 . 1760 . 1 1 10 LEU CD1 C 7.551 0.473 -6.475 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 10 . 1761 . 1 1 10 LEU CD2 C 8.316 -1.902 -6.564 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 10 . 1762 . 1 1 10 LEU CG C 7.521 -0.819 -7.294 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 10 . 1763 . 1 1 10 LEU H H 4.906 1.280 -8.068 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 10 . 1764 . 1 1 10 LEU HA H 6.058 -0.998 -9.610 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 10 . 1765 . 1 1 10 LEU HB2 H 5.486 -0.952 -6.621 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1766 . 1 1 10 LEU HB3 H 6.042 -2.356 -7.533 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1767 . 1 1 10 LEU HD11 H 6.564 0.909 -6.457 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 10 . 1768 . 1 1 10 LEU HD12 H 8.244 1.168 -6.927 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 10 . 1769 . 1 1 10 LEU HD13 H 7.866 0.256 -5.465 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 10 . 1770 . 1 1 10 LEU HD21 H 9.332 -1.563 -6.418 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 10 . 1771 . 1 1 10 LEU HD22 H 8.320 -2.806 -7.154 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 10 . 1772 . 1 1 10 LEU HD23 H 7.860 -2.099 -5.605 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 10 . 1773 . 1 1 10 LEU HG H 7.962 -0.641 -8.264 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 10 . 1774 . 1 1 10 LEU N N 5.592 0.802 -8.580 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 10 . 1775 . 1 1 10 LEU O O 3.475 -1.804 -8.127 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 10 . 1776 . 1 1 11 ASP C C 1.768 -2.151 -10.889 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 10 . 1777 . 1 1 11 ASP CA C 1.919 -0.850 -10.101 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 10 . 1778 . 1 1 11 ASP CB C 1.357 0.330 -10.897 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 10 . 1779 . 1 1 11 ASP CG C -0.143 0.127 -11.130 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 10 . 1780 . 1 1 11 ASP H H 3.818 0.082 -10.528 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 10 . 1781 . 1 1 11 ASP HA H 1.419 -0.923 -9.147 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 10 . 1782 . 1 1 11 ASP HB2 H 1.514 1.242 -10.342 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1783 . 1 1 11 ASP HB3 H 1.862 0.395 -11.849 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1784 . 1 1 11 ASP N N 3.363 -0.530 -9.911 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 10 . 1785 . 1 1 11 ASP O O 2.607 -2.505 -11.694 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 10 . 1786 . 1 1 11 ASP OD1 O -0.898 0.318 -10.192 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 10 . 1787 . 1 1 11 ASP OD2 O -0.508 -0.222 -12.241 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 10 . 1788 . 1 1 12 CYS C C -0.515 -3.993 -12.484 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 10 . 1789 . 1 1 12 CYS CA C 0.505 -4.167 -11.355 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 10 . 1790 . 1 1 12 CYS CB C -0.030 -5.117 -10.283 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 10 . 1791 . 1 1 12 CYS H H 0.058 -2.576 -9.976 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 10 . 1792 . 1 1 12 CYS HA H 1.439 -4.536 -11.742 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 10 . 1793 . 1 1 12 CYS HB2 H -0.547 -4.548 -9.524 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 10 . 1794 . 1 1 12 CYS HB3 H -0.715 -5.820 -10.735 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 10 . 1795 . 1 1 12 CYS N N 0.712 -2.876 -10.642 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 10 . 1796 . 1 1 12 CYS O O -1.308 -4.873 -12.748 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 10 . 1797 . 1 1 12 CYS SG S 1.347 -6.018 -9.527 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 10 . 1798 . 1 1 13 NH2 HN1 H 0.115 -2.171 -12.957 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 10 . 1799 . 1 1 13 NH2 HN2 H -1.169 -2.761 -13.897 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 10 . 1800 . 1 1 13 NH2 N N -0.524 -2.883 -13.169 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 11 . 1801 . 1 1 1 ACE C C 2.589 -3.919 -3.965 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 11 . 1802 . 1 1 1 ACE CH3 C 2.577 -5.031 -2.915 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 11 . 1803 . 1 1 1 ACE H1 H 3.306 -5.781 -3.180 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 11 . 1804 . 1 1 1 ACE H2 H 1.595 -5.481 -2.879 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 11 . 1805 . 1 1 1 ACE H3 H 2.820 -4.617 -1.949 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 11 . 1806 . 1 1 1 ACE O O 3.393 -3.010 -3.907 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 11 . 1807 . 1 1 2 CYS C C 0.569 -1.908 -5.680 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 11 . 1808 . 1 1 2 CYS CA C 1.665 -2.936 -5.989 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 11 . 1809 . 1 1 2 CYS CB C 1.337 -3.692 -7.281 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 11 . 1810 . 1 1 2 CYS H H 1.066 -4.730 -4.952 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 11 . 1811 . 1 1 2 CYS HA H 2.627 -2.454 -6.076 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 11 . 1812 . 1 1 2 CYS HB2 H 0.398 -4.208 -7.163 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1813 . 1 1 2 CYS HB3 H 1.264 -2.992 -8.098 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1814 . 1 1 2 CYS N N 1.703 -3.987 -4.926 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 11 . 1815 . 1 1 2 CYS O O -0.577 -2.084 -6.049 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 11 . 1816 . 1 1 2 CYS SG S 2.644 -4.898 -7.634 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 11 . 1817 . 1 1 3 ARG C C 0.441 1.604 -4.705 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 11 . 1818 . 1 1 3 ARG CA C -0.130 0.187 -4.668 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 11 . 1819 . 1 1 3 ARG CB C -0.567 -0.151 -3.249 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 11 . 1820 . 1 1 3 ARG CD C -2.049 -1.617 -1.892 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 11 . 1821 . 1 1 3 ARG CG C -1.803 -1.045 -3.288 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 11 . 1822 . 1 1 3 ARG CZ C -2.793 -0.483 0.110 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 11 . 1823 . 1 1 3 ARG H H 1.832 -0.721 -4.713 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 11 . 1824 . 1 1 3 ARG HA H -0.962 0.107 -5.334 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 11 . 1825 . 1 1 3 ARG HB2 H 0.236 -0.666 -2.740 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1826 . 1 1 3 ARG HB3 H -0.801 0.760 -2.718 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1827 . 1 1 3 ARG HD2 H -2.609 -2.540 -1.957 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 11 . 1828 . 1 1 3 ARG HD3 H -1.113 -1.776 -1.382 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 11 . 1829 . 1 1 3 ARG HE H -3.397 0.050 -1.703 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 11 . 1830 . 1 1 3 ARG HG2 H -2.659 -0.461 -3.597 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 11 . 1831 . 1 1 3 ARG HG3 H -1.644 -1.853 -3.985 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 11 . 1832 . 1 1 3 ARG HH11 H -3.405 -2.364 0.409 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 11 . 1833 . 1 1 3 ARG HH12 H -3.083 -1.445 1.841 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 11 . 1834 . 1 1 3 ARG HH21 H -2.166 1.419 0.112 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 11 . 1835 . 1 1 3 ARG HH22 H -2.380 0.699 1.673 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 11 . 1836 . 1 1 3 ARG N N 0.906 -0.840 -5.003 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 11 . 1837 . 1 1 3 ARG NE N -2.841 -0.571 -1.189 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 11 . 1838 . 1 1 3 ARG NH1 N -3.119 -1.511 0.844 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 11 . 1839 . 1 1 3 ARG NH2 N -2.417 0.632 0.676 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 11 . 1840 . 1 1 3 ARG O O -0.276 2.568 -4.902 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 11 . 1841 . 1 1 4 VAL C C 2.762 3.500 -5.903 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 11 . 1842 . 1 1 4 VAL CA C 2.330 3.095 -4.492 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 11 . 1843 . 1 1 4 VAL CB C 3.538 2.983 -3.556 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 11 . 1844 . 1 1 4 VAL CG1 C 4.483 1.889 -4.057 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 11 . 1845 . 1 1 4 VAL CG2 C 4.283 4.319 -3.517 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 11 . 1846 . 1 1 4 VAL H H 2.258 0.952 -4.324 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 11 . 1847 . 1 1 4 VAL HA H 1.632 3.817 -4.097 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 11 . 1848 . 1 1 4 VAL HB H 3.197 2.732 -2.562 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 11 . 1849 . 1 1 4 VAL HG11 H 4.328 1.737 -5.115 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 11 . 1850 . 1 1 4 VAL HG12 H 4.280 0.970 -3.528 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 11 . 1851 . 1 1 4 VAL HG13 H 5.503 2.189 -3.881 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 11 . 1852 . 1 1 4 VAL HG21 H 3.583 5.118 -3.320 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 11 . 1853 . 1 1 4 VAL HG22 H 4.766 4.490 -4.467 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 11 . 1854 . 1 1 4 VAL HG23 H 5.028 4.294 -2.734 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 11 . 1855 . 1 1 4 VAL N N 1.714 1.739 -4.496 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 11 . 1856 . 1 1 4 VAL O O 2.819 2.691 -6.810 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 11 . 1857 . 1 1 5 VAL C C 4.662 6.188 -7.294 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 11 . 1858 . 1 1 5 VAL CA C 3.468 5.245 -7.431 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 11 . 1859 . 1 1 5 VAL CB C 2.239 5.978 -7.978 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 11 . 1860 . 1 1 5 VAL CG1 C 2.565 6.594 -9.339 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 11 . 1861 . 1 1 5 VAL CG2 C 1.086 4.984 -8.138 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 11 . 1862 . 1 1 5 VAL H H 2.991 5.389 -5.345 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 11 . 1863 . 1 1 5 VAL HA H 3.717 4.426 -8.066 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 11 . 1864 . 1 1 5 VAL HB H 1.948 6.759 -7.291 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 11 . 1865 . 1 1 5 VAL HG11 H 3.051 5.856 -9.960 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 11 . 1866 . 1 1 5 VAL HG12 H 3.222 7.441 -9.203 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 11 . 1867 . 1 1 5 VAL HG13 H 1.653 6.919 -9.815 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 11 . 1868 . 1 1 5 VAL HG21 H 0.616 4.822 -7.179 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 11 . 1869 . 1 1 5 VAL HG22 H 1.470 4.046 -8.511 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 11 . 1870 . 1 1 5 VAL HG23 H 0.362 5.380 -8.833 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 11 . 1871 . 1 1 5 VAL N N 3.051 4.759 -6.090 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 11 . 1872 . 1 1 5 VAL O O 5.795 5.830 -7.563 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 11 . 1873 . 1 1 6 ARG C C 6.341 8.012 -5.463 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 11 . 1874 . 1 1 6 ARG CA C 5.536 8.355 -6.703 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 11 . 1875 . 1 1 6 ARG CB C 4.874 9.719 -6.583 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 11 . 1876 . 1 1 6 ARG CD C 4.745 11.825 -7.916 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 11 . 1877 . 1 1 6 ARG CG C 4.712 10.302 -7.986 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 11 . 1878 . 1 1 6 ARG CZ C 2.994 13.478 -7.727 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 11 . 1879 . 1 1 6 ARG H H 3.505 7.640 -6.638 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 11 . 1880 . 1 1 6 ARG HA H 6.170 8.334 -7.569 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 11 . 1881 . 1 1 6 ARG HB2 H 3.904 9.610 -6.117 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1882 . 1 1 6 ARG HB3 H 5.494 10.373 -5.989 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1883 . 1 1 6 ARG HD2 H 5.379 12.150 -7.103 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 11 . 1884 . 1 1 6 ARG HD3 H 5.089 12.237 -8.852 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 11 . 1885 . 1 1 6 ARG HE H 2.658 11.541 -7.471 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 11 . 1886 . 1 1 6 ARG HG2 H 5.521 9.951 -8.611 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 11 . 1887 . 1 1 6 ARG HG3 H 3.770 9.980 -8.402 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 11 . 1888 . 1 1 6 ARG HH11 H 2.712 13.473 -9.708 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 11 . 1889 . 1 1 6 ARG HH12 H 2.427 14.985 -8.915 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 11 . 1890 . 1 1 6 ARG HH21 H 3.197 13.774 -5.759 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 11 . 1891 . 1 1 6 ARG HH22 H 2.701 15.157 -6.678 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 11 . 1892 . 1 1 6 ARG N N 4.419 7.385 -6.858 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 11 . 1893 . 1 1 6 ARG NE N 3.333 12.223 -7.672 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 11 . 1894 . 1 1 6 ARG NH1 N 2.687 14.021 -8.872 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 11 . 1895 . 1 1 6 ARG NH2 N 2.961 14.192 -6.636 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 11 . 1896 . 1 1 6 ARG O O 5.813 7.827 -4.383 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 11 . 1897 . 1 1 7 GLY C C 8.820 5.973 -4.744 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 11 . 1898 . 1 1 7 GLY CA C 8.508 7.453 -4.528 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 11 . 1899 . 1 1 7 GLY H H 7.996 7.972 -6.544 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 11 . 1900 . 1 1 7 GLY HA2 H 9.419 8.036 -4.549 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 11 . 1901 . 1 1 7 GLY HA3 H 8.002 7.583 -3.585 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 11 . 1902 . 1 1 7 GLY N N 7.620 7.861 -5.646 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 11 . 1903 . 1 1 7 GLY O O 9.924 5.512 -4.527 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 11 . 1904 . 1 1 8 ASP C C 7.005 3.388 -6.556 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 11 . 1905 . 1 1 8 ASP CA C 8.027 3.797 -5.494 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 11 . 1906 . 1 1 8 ASP CB C 7.768 3.074 -4.170 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 11 . 1907 . 1 1 8 ASP CG C 9.073 2.984 -3.375 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 11 . 1908 . 1 1 8 ASP H H 6.973 5.652 -5.408 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 11 . 1909 . 1 1 8 ASP HA H 9.032 3.605 -5.837 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 11 . 1910 . 1 1 8 ASP HB2 H 7.032 3.619 -3.596 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1911 . 1 1 8 ASP HB3 H 7.403 2.077 -4.369 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1912 . 1 1 8 ASP N N 7.840 5.239 -5.209 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 11 . 1913 . 1 1 8 ASP O O 5.903 2.983 -6.240 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 11 . 1914 . 1 1 8 ASP OD1 O 9.938 2.226 -3.783 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 11 . 1915 . 1 1 8 ASP OD2 O 9.185 3.673 -2.375 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 11 . 1916 . 1 1 9 TYR C C 6.300 1.634 -9.028 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 11 . 1917 . 1 1 9 TYR CA C 6.367 3.151 -8.881 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 11 . 1918 . 1 1 9 TYR CB C 6.915 3.771 -10.170 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 11 . 1919 . 1 1 9 TYR CD1 C 6.039 6.137 -10.200 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 11 . 1920 . 1 1 9 TYR CD2 C 8.353 5.754 -9.587 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 11 . 1921 . 1 1 9 TYR CE1 C 6.220 7.513 -10.019 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 11 . 1922 . 1 1 9 TYR CE2 C 8.532 7.130 -9.407 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 11 . 1923 . 1 1 9 TYR CG C 7.107 5.256 -9.982 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 11 . 1924 . 1 1 9 TYR CZ C 7.467 8.008 -9.623 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 11 . 1925 . 1 1 9 TYR H H 8.226 3.860 -8.037 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 11 . 1926 . 1 1 9 TYR HA H 5.390 3.562 -8.662 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 11 . 1927 . 1 1 9 TYR HB2 H 7.863 3.310 -10.411 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1928 . 1 1 9 TYR HB3 H 6.215 3.596 -10.974 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1929 . 1 1 9 TYR HD1 H 5.076 5.754 -10.503 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 11 . 1930 . 1 1 9 TYR HD2 H 9.176 5.074 -9.416 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 11 . 1931 . 1 1 9 TYR HE1 H 5.399 8.195 -10.186 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 11 . 1932 . 1 1 9 TYR HE2 H 9.496 7.513 -9.105 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 11 . 1933 . 1 1 9 TYR HH H 8.273 9.671 -10.110 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 11 . 1934 . 1 1 9 TYR N N 7.346 3.510 -7.807 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 11 . 1935 . 1 1 9 TYR O O 6.901 1.049 -9.906 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 11 . 1936 . 1 1 9 TYR OH O 7.647 9.368 -9.447 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 11 . 1937 . 1 1 10 LEU C C 3.983 -0.816 -8.631 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 11 . 1938 . 1 1 10 LEU CA C 5.417 -0.479 -8.233 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 11 . 1939 . 1 1 10 LEU CB C 5.714 -0.964 -6.809 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 11 . 1940 . 1 1 10 LEU CD1 C 8.008 0.017 -7.244 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 11 . 1941 . 1 1 10 LEU CD2 C 7.519 -1.123 -5.082 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 11 . 1942 . 1 1 10 LEU CG C 7.231 -1.130 -6.587 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 11 . 1943 . 1 1 10 LEU H H 5.073 1.501 -7.478 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 11 . 1944 . 1 1 10 LEU HA H 6.123 -0.902 -8.933 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 11 . 1945 . 1 1 10 LEU HB2 H 5.326 -0.244 -6.102 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1946 . 1 1 10 LEU HB3 H 5.226 -1.915 -6.650 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1947 . 1 1 10 LEU HD11 H 9.035 -0.005 -6.909 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 11 . 1948 . 1 1 10 LEU HD12 H 7.560 0.960 -6.969 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 11 . 1949 . 1 1 10 LEU HD13 H 7.977 -0.097 -8.318 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 11 . 1950 . 1 1 10 LEU HD21 H 7.060 -1.986 -4.623 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 11 . 1951 . 1 1 10 LEU HD22 H 7.114 -0.223 -4.644 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 11 . 1952 . 1 1 10 LEU HD23 H 8.586 -1.152 -4.921 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 11 . 1953 . 1 1 10 LEU HG H 7.554 -2.070 -7.009 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 11 . 1954 . 1 1 10 LEU N N 5.555 0.999 -8.169 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 11 . 1955 . 1 1 10 LEU O O 3.263 -1.469 -7.906 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 11 . 1956 . 1 1 11 ASP C C 2.101 -1.969 -10.952 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 11 . 1957 . 1 1 11 ASP CA C 2.156 -0.642 -10.201 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 11 . 1958 . 1 1 11 ASP CB C 1.770 0.517 -11.118 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 11 . 1959 . 1 1 11 ASP CG C 0.245 0.621 -11.186 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 11 . 1960 . 1 1 11 ASP H H 4.143 0.177 -10.347 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 11 . 1961 . 1 1 11 ASP HA H 1.501 -0.667 -9.345 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 11 . 1962 . 1 1 11 ASP HB2 H 2.176 1.438 -10.725 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1963 . 1 1 11 ASP HB3 H 2.164 0.343 -12.109 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1964 . 1 1 11 ASP N N 3.553 -0.360 -9.776 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 11 . 1965 . 1 1 11 ASP O O 3.004 -2.315 -11.690 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 11 . 1966 . 1 1 11 ASP OD1 O -0.393 -0.407 -11.339 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 11 . 1967 . 1 1 11 ASP OD2 O -0.259 1.728 -11.084 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 11 . 1968 . 1 1 12 CYS C C -0.444 -4.233 -12.022 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 11 . 1969 . 1 1 12 CYS CA C 0.954 -4.050 -11.426 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 11 . 1970 . 1 1 12 CYS CB C 1.209 -5.069 -10.313 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 11 . 1971 . 1 1 12 CYS H H 0.355 -2.438 -10.132 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 11 . 1972 . 1 1 12 CYS HA H 1.709 -4.143 -12.189 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 11 . 1973 . 1 1 12 CYS HB2 H 0.482 -4.930 -9.526 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 11 . 1974 . 1 1 12 CYS HB3 H 1.123 -6.069 -10.712 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 11 . 1975 . 1 1 12 CYS N N 1.060 -2.729 -10.747 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 11 . 1976 . 1 1 12 CYS O O -1.090 -5.238 -11.800 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 11 . 1977 . 1 1 12 CYS SG S 2.876 -4.827 -9.643 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 11 . 1978 . 1 1 13 NH2 HN1 H -0.422 -2.484 -12.962 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 11 . 1979 . 1 1 13 NH2 HN2 H -1.833 -3.403 -13.173 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 11 . 1980 . 1 1 13 NH2 N N -0.941 -3.295 -12.781 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 12 . 1981 . 1 1 1 ACE C C -2.177 -1.209 -15.643 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 12 . 1982 . 1 1 1 ACE CH3 C -3.368 -1.179 -16.605 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 12 . 1983 . 1 1 1 ACE H1 H -4.191 -1.730 -16.175 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 12 . 1984 . 1 1 1 ACE H2 H -3.084 -1.630 -17.545 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 12 . 1985 . 1 1 1 ACE H3 H -3.669 -0.155 -16.772 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 12 . 1986 . 1 1 1 ACE O O -1.992 -2.153 -14.900 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 12 . 1987 . 1 1 2 CYS C C -0.341 1.018 -13.743 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 12 . 1988 . 1 1 2 CYS CA C -0.192 -0.140 -14.735 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 12 . 1989 . 1 1 2 CYS CB C 1.015 0.096 -15.646 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 12 . 1990 . 1 1 2 CYS H H -1.544 0.571 -16.256 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 12 . 1991 . 1 1 2 CYS HA H -0.085 -1.077 -14.212 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 12 . 1992 . 1 1 2 CYS HB2 H 0.829 0.952 -16.278 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 12 . 1993 . 1 1 2 CYS HB3 H 1.892 0.278 -15.042 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 12 . 1994 . 1 1 2 CYS N N -1.372 -0.180 -15.651 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 12 . 1995 . 1 1 2 CYS O O -0.600 2.142 -14.126 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 12 . 1996 . 1 1 2 CYS SG S 1.293 -1.364 -16.682 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 12 . 1997 . 1 1 3 ARG C C 1.094 2.438 -11.193 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 12 . 1998 . 1 1 3 ARG CA C -0.288 1.851 -11.470 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 12 . 1999 . 1 1 3 ARG CB C -0.853 1.192 -10.211 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 12 . 2000 . 1 1 3 ARG CD C -3.128 0.407 -10.877 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 12 . 2001 . 1 1 3 ARG CG C -2.352 1.479 -10.109 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 12 . 2002 . 1 1 3 ARG CZ C -5.432 -0.251 -10.520 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 12 . 2003 . 1 1 3 ARG H H 0.050 -0.155 -12.187 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 12 . 2004 . 1 1 3 ARG HA H -0.960 2.617 -11.825 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 12 . 2005 . 1 1 3 ARG HB2 H -0.692 0.124 -10.260 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2006 . 1 1 3 ARG HB3 H -0.353 1.592 -9.341 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2007 . 1 1 3 ARG HD2 H -2.907 0.469 -11.934 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 12 . 2008 . 1 1 3 ARG HD3 H -2.891 -0.574 -10.498 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 12 . 2009 . 1 1 3 ARG HE H -4.855 1.649 -10.539 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 12 . 2010 . 1 1 3 ARG HG2 H -2.652 1.467 -9.071 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 12 . 2011 . 1 1 3 ARG HG3 H -2.564 2.448 -10.534 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 12 . 2012 . 1 1 3 ARG HH11 H -4.652 -1.324 -12.020 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 12 . 2013 . 1 1 3 ARG HH12 H -6.033 -2.019 -11.242 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 12 . 2014 . 1 1 3 ARG HH21 H -6.414 0.596 -8.995 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 12 . 2015 . 1 1 3 ARG HH22 H -7.032 -0.931 -9.528 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 12 . 2016 . 1 1 3 ARG N N -0.166 0.756 -12.476 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 12 . 2017 . 1 1 3 ARG NE N -4.563 0.717 -10.626 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 12 . 2018 . 1 1 3 ARG NH1 N -5.366 -1.278 -11.323 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 12 . 2019 . 1 1 3 ARG NH2 N -6.366 -0.191 -9.610 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 12 . 2020 . 1 1 3 ARG O O 2.102 1.823 -11.479 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 12 . 2021 . 1 1 4 VAL C C 2.417 5.123 -9.115 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 12 . 2022 . 1 1 4 VAL CA C 2.477 4.235 -10.363 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 12 . 2023 . 1 1 4 VAL CB C 2.801 5.077 -11.605 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 12 . 2024 . 1 1 4 VAL CG1 C 1.733 6.155 -11.796 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 12 . 2025 . 1 1 4 VAL CG2 C 4.171 5.743 -11.429 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 12 . 2026 . 1 1 4 VAL H H 0.327 4.101 -10.428 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 12 . 2027 . 1 1 4 VAL HA H 3.223 3.468 -10.242 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 12 . 2028 . 1 1 4 VAL HB H 2.822 4.436 -12.477 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 12 . 2029 . 1 1 4 VAL HG11 H 1.618 6.368 -12.848 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 12 . 2030 . 1 1 4 VAL HG12 H 2.033 7.055 -11.278 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 12 . 2031 . 1 1 4 VAL HG13 H 0.793 5.807 -11.395 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 12 . 2032 . 1 1 4 VAL HG21 H 4.325 5.982 -10.387 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 12 . 2033 . 1 1 4 VAL HG22 H 4.208 6.650 -12.015 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 12 . 2034 . 1 1 4 VAL HG23 H 4.946 5.068 -11.762 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 12 . 2035 . 1 1 4 VAL N N 1.151 3.620 -10.646 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 12 . 2036 . 1 1 4 VAL O O 1.858 6.201 -9.135 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 12 . 2037 . 1 1 5 VAL C C 4.336 6.360 -6.861 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 12 . 2038 . 1 1 5 VAL CA C 3.051 5.536 -6.822 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 12 . 2039 . 1 1 5 VAL CB C 3.058 4.581 -5.620 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 12 . 2040 . 1 1 5 VAL CG1 C 1.631 4.142 -5.295 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 12 . 2041 . 1 1 5 VAL CG2 C 3.912 3.339 -5.897 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 12 . 2042 . 1 1 5 VAL H H 3.503 3.843 -8.053 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 12 . 2043 . 1 1 5 VAL HA H 2.185 6.181 -6.787 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 12 . 2044 . 1 1 5 VAL HB H 3.466 5.105 -4.779 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 12 . 2045 . 1 1 5 VAL HG11 H 1.108 3.908 -6.210 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 12 . 2046 . 1 1 5 VAL HG12 H 1.118 4.939 -4.779 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 12 . 2047 . 1 1 5 VAL HG13 H 1.663 3.265 -4.664 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 12 . 2048 . 1 1 5 VAL HG21 H 3.326 2.611 -6.438 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 12 . 2049 . 1 1 5 VAL HG22 H 4.239 2.912 -4.961 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 12 . 2050 . 1 1 5 VAL HG23 H 4.771 3.617 -6.484 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 12 . 2051 . 1 1 5 VAL N N 3.029 4.695 -8.043 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 12 . 2052 . 1 1 5 VAL O O 5.410 5.844 -7.128 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 12 . 2053 . 1 1 6 ARG C C 6.377 8.231 -5.502 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 12 . 2054 . 1 1 6 ARG CA C 5.479 8.475 -6.708 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 12 . 2055 . 1 1 6 ARG CB C 5.000 9.931 -6.754 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 12 . 2056 . 1 1 6 ARG CD C 4.220 11.645 -5.119 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 12 . 2057 . 1 1 6 ARG CG C 4.019 10.211 -5.614 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 12 . 2058 . 1 1 6 ARG CZ C 4.848 11.681 -2.780 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 12 . 2059 . 1 1 6 ARG H H 3.379 8.043 -6.419 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 12 . 2060 . 1 1 6 ARG HA H 6.013 8.245 -7.619 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 12 . 2061 . 1 1 6 ARG HB2 H 5.853 10.586 -6.659 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2062 . 1 1 6 ARG HB3 H 4.511 10.116 -7.699 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2063 . 1 1 6 ARG HD2 H 4.599 12.266 -5.919 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 12 . 2064 . 1 1 6 ARG HD3 H 3.295 12.047 -4.737 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 12 . 2065 . 1 1 6 ARG HE H 6.166 11.372 -4.234 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 12 . 2066 . 1 1 6 ARG HG2 H 3.007 10.093 -5.975 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 12 . 2067 . 1 1 6 ARG HG3 H 4.194 9.523 -4.804 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 12 . 2068 . 1 1 6 ARG HH11 H 3.379 10.328 -2.914 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 12 . 2069 . 1 1 6 ARG HH12 H 3.564 11.082 -1.366 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 12 . 2070 . 1 1 6 ARG HH21 H 6.231 13.066 -2.354 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 12 . 2071 . 1 1 6 ARG HH22 H 5.177 12.632 -1.048 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 12 . 2072 . 1 1 6 ARG N N 4.247 7.637 -6.620 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 12 . 2073 . 1 1 6 ARG NE N 5.224 11.542 -4.022 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 12 . 2074 . 1 1 6 ARG NH1 N 3.853 10.975 -2.318 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 12 . 2075 . 1 1 6 ARG NH2 N 5.468 12.525 -2.000 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 12 . 2076 . 1 1 6 ARG O O 6.021 8.475 -4.367 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 12 . 2077 . 1 1 7 GLY C C 8.902 5.924 -4.832 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 12 . 2078 . 1 1 7 GLY CA C 8.509 7.394 -4.685 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 12 . 2079 . 1 1 7 GLY H H 7.782 7.514 -6.697 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 12 . 2080 . 1 1 7 GLY HA2 H 9.386 8.021 -4.782 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 12 . 2081 . 1 1 7 GLY HA3 H 8.048 7.549 -3.725 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 12 . 2082 . 1 1 7 GLY N N 7.545 7.714 -5.767 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 12 . 2083 . 1 1 7 GLY O O 10.051 5.554 -4.690 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 12 . 2084 . 1 1 8 ASP C C 7.210 3.037 -6.303 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 12 . 2085 . 1 1 8 ASP CA C 8.226 3.634 -5.326 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 12 . 2086 . 1 1 8 ASP CB C 8.077 3.015 -3.933 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 12 . 2087 . 1 1 8 ASP CG C 9.220 3.494 -3.035 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 12 . 2088 . 1 1 8 ASP H H 7.023 5.427 -5.273 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 12 . 2089 . 1 1 8 ASP HA H 9.229 3.491 -5.690 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 12 . 2090 . 1 1 8 ASP HB2 H 7.132 3.315 -3.504 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2091 . 1 1 8 ASP HB3 H 8.113 1.938 -4.010 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2092 . 1 1 8 ASP N N 7.940 5.089 -5.140 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 12 . 2093 . 1 1 8 ASP O O 6.398 2.208 -5.936 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 12 . 2094 . 1 1 8 ASP OD1 O 10.326 3.014 -3.215 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 12 . 2095 . 1 1 8 ASP OD2 O 8.970 4.334 -2.188 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 12 . 2096 . 1 1 9 TYR C C 6.767 1.762 -9.348 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 12 . 2097 . 1 1 9 TYR CA C 6.222 2.936 -8.523 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 12 . 2098 . 1 1 9 TYR CB C 5.845 4.105 -9.455 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 12 . 2099 . 1 1 9 TYR CD1 C 8.234 4.538 -10.185 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 12 . 2100 . 1 1 9 TYR CD2 C 6.865 6.410 -9.483 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 12 . 2101 . 1 1 9 TYR CE1 C 9.302 5.413 -10.426 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 12 . 2102 . 1 1 9 TYR CE2 C 7.931 7.284 -9.726 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 12 . 2103 . 1 1 9 TYR CG C 7.015 5.036 -9.712 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 12 . 2104 . 1 1 9 TYR CZ C 9.149 6.786 -10.195 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 12 . 2105 . 1 1 9 TYR H H 7.875 4.149 -7.808 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 12 . 2106 . 1 1 9 TYR HA H 5.331 2.618 -7.993 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 12 . 2107 . 1 1 9 TYR HB2 H 5.503 3.705 -10.395 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2108 . 1 1 9 TYR HB3 H 5.042 4.666 -9.001 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2109 . 1 1 9 TYR HD1 H 8.353 3.482 -10.367 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 12 . 2110 . 1 1 9 TYR HD2 H 5.925 6.795 -9.120 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 12 . 2111 . 1 1 9 TYR HE1 H 10.244 5.029 -10.790 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 12 . 2112 . 1 1 9 TYR HE2 H 7.813 8.344 -9.549 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 12 . 2113 . 1 1 9 TYR HH H 9.917 8.290 -11.092 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 12 . 2114 . 1 1 9 TYR N N 7.226 3.468 -7.538 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 12 . 2115 . 1 1 9 TYR O O 7.956 1.609 -9.548 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 12 . 2116 . 1 1 9 TYR OH O 10.201 7.648 -10.435 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 12 . 2117 . 1 1 10 LEU C C 5.213 -0.368 -11.798 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 12 . 2118 . 1 1 10 LEU CA C 6.251 -0.232 -10.676 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 12 . 2119 . 1 1 10 LEU CB C 6.191 -1.455 -9.750 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 12 . 2120 . 1 1 10 LEU CD1 C 6.829 -2.390 -7.527 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 12 . 2121 . 1 1 10 LEU CD2 C 8.478 -1.037 -8.823 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 12 . 2122 . 1 1 10 LEU CG C 6.997 -1.200 -8.475 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 12 . 2123 . 1 1 10 LEU H H 4.925 1.107 -9.652 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 12 . 2124 . 1 1 10 LEU HA H 7.243 -0.110 -11.082 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 12 . 2125 . 1 1 10 LEU HB2 H 5.161 -1.653 -9.489 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2126 . 1 1 10 LEU HB3 H 6.600 -2.312 -10.263 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2127 . 1 1 10 LEU HD11 H 5.948 -2.246 -6.919 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 12 . 2128 . 1 1 10 LEU HD12 H 7.697 -2.467 -6.889 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 12 . 2129 . 1 1 10 LEU HD13 H 6.724 -3.298 -8.103 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 12 . 2130 . 1 1 10 LEU HD21 H 8.573 -0.578 -9.795 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 12 . 2131 . 1 1 10 LEU HD22 H 8.954 -2.007 -8.835 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 12 . 2132 . 1 1 10 LEU HD23 H 8.954 -0.413 -8.082 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 12 . 2133 . 1 1 10 LEU HG H 6.635 -0.304 -7.992 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 12 . 2134 . 1 1 10 LEU N N 5.871 0.941 -9.834 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 12 . 2135 . 1 1 10 LEU O O 4.460 -1.319 -11.847 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 12 . 2136 . 1 1 11 ASP C C 4.693 -0.099 -15.039 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 12 . 2137 . 1 1 11 ASP CA C 4.124 0.547 -13.772 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 12 . 2138 . 1 1 11 ASP CB C 3.765 2.014 -14.033 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 12 . 2139 . 1 1 11 ASP CG C 5.009 2.788 -14.484 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 12 . 2140 . 1 1 11 ASP H H 5.745 1.369 -12.604 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 12 . 2141 . 1 1 11 ASP HA H 3.245 0.013 -13.441 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 12 . 2142 . 1 1 11 ASP HB2 H 3.010 2.067 -14.804 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2143 . 1 1 11 ASP HB3 H 3.382 2.455 -13.126 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2144 . 1 1 11 ASP N N 5.144 0.597 -12.678 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 12 . 2145 . 1 1 11 ASP O O 5.034 0.577 -15.988 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 12 . 2146 . 1 1 11 ASP OD1 O 6.094 2.233 -14.406 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 12 . 2147 . 1 1 11 ASP OD2 O 4.855 3.924 -14.901 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 12 . 2148 . 1 1 12 CYS C C 6.250 -1.287 -17.090 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 12 . 2149 . 1 1 12 CYS CA C 5.293 -2.151 -16.259 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 12 . 2150 . 1 1 12 CYS CB C 4.055 -2.527 -17.083 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 12 . 2151 . 1 1 12 CYS H H 4.469 -1.917 -14.278 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 12 . 2152 . 1 1 12 CYS HA H 5.793 -3.049 -15.940 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 12 . 2153 . 1 1 12 CYS HB2 H 4.369 -3.020 -17.990 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 12 . 2154 . 1 1 12 CYS HB3 H 3.432 -3.197 -16.509 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 12 . 2155 . 1 1 12 CYS N N 4.771 -1.410 -15.059 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 12 . 2156 . 1 1 12 CYS O O 6.130 -1.209 -18.297 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 12 . 2157 . 1 1 12 CYS SG S 3.107 -1.043 -17.511 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 12 . 2158 . 1 1 13 NH2 HN1 H 7.299 -0.690 -15.515 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 12 . 2159 . 1 1 13 NH2 HN2 H 7.814 -0.068 -17.008 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 12 . 2160 . 1 1 13 NH2 N N 7.200 -0.629 -16.487 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 13 . 2161 . 1 1 1 ACE C C -4.134 -2.657 -12.392 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 13 . 2162 . 1 1 1 ACE CH3 C -4.932 -2.797 -13.688 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 13 . 2163 . 1 1 1 ACE H1 H -4.252 -2.876 -14.524 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 13 . 2164 . 1 1 1 ACE H2 H -5.562 -1.930 -13.818 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 13 . 2165 . 1 1 1 ACE H3 H -5.546 -3.685 -13.639 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 13 . 2166 . 1 1 1 ACE O O -4.659 -2.821 -11.308 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 13 . 2167 . 1 1 2 CYS C C -2.115 -0.748 -10.765 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 13 . 2168 . 1 1 2 CYS CA C -2.033 -2.195 -11.268 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 13 . 2169 . 1 1 2 CYS CB C -0.611 -2.541 -11.714 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 13 . 2170 . 1 1 2 CYS H H -2.466 -2.224 -13.380 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 13 . 2171 . 1 1 2 CYS HA H -2.359 -2.878 -10.503 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 13 . 2172 . 1 1 2 CYS HB2 H -0.531 -2.426 -12.784 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2173 . 1 1 2 CYS HB3 H 0.091 -1.882 -11.227 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2174 . 1 1 2 CYS N N -2.868 -2.351 -12.495 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 13 . 2175 . 1 1 2 CYS O O -3.021 -0.018 -11.117 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 13 . 2176 . 1 1 2 CYS SG S -0.242 -4.254 -11.261 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 13 . 2177 . 1 1 3 ARG C C 0.174 1.662 -9.320 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 13 . 2178 . 1 1 3 ARG CA C -1.238 1.075 -9.433 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 13 . 2179 . 1 1 3 ARG CB C -1.900 0.974 -8.055 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 13 . 2180 . 1 1 3 ARG CD C -3.477 2.839 -8.644 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 13 . 2181 . 1 1 3 ARG CG C -3.374 1.389 -8.156 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 13 . 2182 . 1 1 3 ARG CZ C -4.026 4.919 -7.531 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 13 . 2183 . 1 1 3 ARG H H -0.462 -0.924 -9.667 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 13 . 2184 . 1 1 3 ARG HA H -1.841 1.684 -10.086 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 13 . 2185 . 1 1 3 ARG HB2 H -1.839 -0.045 -7.701 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2186 . 1 1 3 ARG HB3 H -1.393 1.626 -7.361 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2187 . 1 1 3 ARG HD2 H -2.549 3.148 -9.103 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 13 . 2188 . 1 1 3 ARG HD3 H -4.295 2.944 -9.340 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 13 . 2189 . 1 1 3 ARG HE H -3.708 3.229 -6.535 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 13 . 2190 . 1 1 3 ARG HG2 H -3.881 0.738 -8.856 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 13 . 2191 . 1 1 3 ARG HG3 H -3.840 1.303 -7.186 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 13 . 2192 . 1 1 3 ARG HH11 H -2.143 5.460 -7.942 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 13 . 2193 . 1 1 3 ARG HH12 H -3.299 6.749 -7.898 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 13 . 2194 . 1 1 3 ARG HH21 H -5.977 4.677 -7.149 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 13 . 2195 . 1 1 3 ARG HH22 H -5.468 6.306 -7.450 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 13 . 2196 . 1 1 3 ARG N N -1.188 -0.326 -9.945 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 13 . 2197 . 1 1 3 ARG NE N -3.745 3.649 -7.421 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 13 . 2198 . 1 1 3 ARG NH1 N -3.082 5.776 -7.812 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 13 . 2199 . 1 1 3 ARG NH2 N -5.253 5.333 -7.363 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 13 . 2200 . 1 1 3 ARG O O 1.088 1.023 -8.834 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 13 . 2201 . 1 1 4 VAL C C 1.834 4.385 -8.455 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 13 . 2202 . 1 1 4 VAL CA C 1.706 3.511 -9.715 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 13 . 2203 . 1 1 4 VAL CB C 1.796 4.367 -10.986 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 13 . 2204 . 1 1 4 VAL CG1 C 0.658 5.394 -11.009 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 13 . 2205 . 1 1 4 VAL CG2 C 3.139 5.102 -11.019 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 13 . 2206 . 1 1 4 VAL H H -0.398 3.357 -10.172 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 13 . 2207 . 1 1 4 VAL HA H 2.474 2.758 -9.725 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 13 . 2208 . 1 1 4 VAL HB H 1.716 3.726 -11.853 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 13 . 2209 . 1 1 4 VAL HG11 H 0.060 5.247 -11.899 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 13 . 2210 . 1 1 4 VAL HG12 H 1.069 6.392 -11.014 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 13 . 2211 . 1 1 4 VAL HG13 H 0.037 5.267 -10.135 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 13 . 2212 . 1 1 4 VAL HG21 H 3.940 4.397 -10.855 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 13 . 2213 . 1 1 4 VAL HG22 H 3.157 5.854 -10.244 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 13 . 2214 . 1 1 4 VAL HG23 H 3.266 5.574 -11.982 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 13 . 2215 . 1 1 4 VAL N N 0.356 2.871 -9.779 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 13 . 2216 . 1 1 4 VAL O O 0.873 4.969 -7.996 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 13 . 2217 . 1 1 5 VAL C C 4.405 6.280 -6.882 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 13 . 2218 . 1 1 5 VAL CA C 3.215 5.331 -6.683 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 13 . 2219 . 1 1 5 VAL CB C 3.503 4.383 -5.510 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 13 . 2220 . 1 1 5 VAL CG1 C 2.474 4.612 -4.402 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 13 . 2221 . 1 1 5 VAL CG2 C 3.441 2.916 -5.958 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 13 . 2222 . 1 1 5 VAL H H 3.784 4.012 -8.299 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 13 . 2223 . 1 1 5 VAL HA H 2.319 5.900 -6.483 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 13 . 2224 . 1 1 5 VAL HB H 4.487 4.603 -5.124 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 13 . 2225 . 1 1 5 VAL HG11 H 2.227 5.662 -4.351 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 13 . 2226 . 1 1 5 VAL HG12 H 2.888 4.292 -3.457 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 13 . 2227 . 1 1 5 VAL HG13 H 1.582 4.043 -4.615 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 13 . 2228 . 1 1 5 VAL HG21 H 4.092 2.769 -6.804 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 13 . 2229 . 1 1 5 VAL HG22 H 2.428 2.668 -6.236 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 13 . 2230 . 1 1 5 VAL HG23 H 3.759 2.280 -5.143 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 13 . 2231 . 1 1 5 VAL N N 3.021 4.484 -7.904 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 13 . 2232 . 1 1 5 VAL O O 5.440 5.903 -7.405 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 13 . 2233 . 1 1 6 ARG C C 6.422 8.285 -5.513 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 13 . 2234 . 1 1 6 ARG CA C 5.384 8.482 -6.615 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 13 . 2235 . 1 1 6 ARG CB C 4.732 9.868 -6.514 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 13 . 2236 . 1 1 6 ARG CD C 2.895 11.038 -5.287 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 13 . 2237 . 1 1 6 ARG CG C 4.048 10.040 -5.154 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 13 . 2238 . 1 1 6 ARG CZ C 0.622 10.529 -5.961 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 13 . 2239 . 1 1 6 ARG H H 3.435 7.769 -6.017 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 13 . 2240 . 1 1 6 ARG HA H 5.841 8.367 -7.587 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 13 . 2241 . 1 1 6 ARG HB2 H 5.491 10.628 -6.631 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2242 . 1 1 6 ARG HB3 H 3.999 9.976 -7.300 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2243 . 1 1 6 ARG HD2 H 2.917 11.746 -4.470 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 13 . 2244 . 1 1 6 ARG HD3 H 2.949 11.554 -6.234 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 13 . 2245 . 1 1 6 ARG HE H 1.615 9.434 -4.635 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 13 . 2246 . 1 1 6 ARG HG2 H 3.667 9.089 -4.816 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 13 . 2247 . 1 1 6 ARG HG3 H 4.764 10.414 -4.437 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 13 . 2248 . 1 1 6 ARG HH11 H 0.872 12.503 -5.739 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 13 . 2249 . 1 1 6 ARG HH12 H -0.476 12.023 -6.716 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 13 . 2250 . 1 1 6 ARG HH21 H 0.126 8.630 -6.354 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 13 . 2251 . 1 1 6 ARG HH22 H -0.898 9.834 -7.064 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 13 . 2252 . 1 1 6 ARG N N 4.268 7.502 -6.450 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 13 . 2253 . 1 1 6 ARG NE N 1.656 10.213 -5.227 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 13 . 2254 . 1 1 6 ARG NH1 N 0.315 11.783 -6.154 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 13 . 2255 . 1 1 6 ARG NH2 N -0.106 9.591 -6.502 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 13 . 2256 . 1 1 6 ARG O O 6.229 8.668 -4.375 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 13 . 2257 . 1 1 7 GLY C C 8.847 5.908 -4.791 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 13 . 2258 . 1 1 7 GLY CA C 8.580 7.411 -4.846 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 13 . 2259 . 1 1 7 GLY H H 7.641 7.361 -6.774 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 13 . 2260 . 1 1 7 GLY HA2 H 9.484 7.936 -5.127 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 13 . 2261 . 1 1 7 GLY HA3 H 8.250 7.749 -3.876 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 13 . 2262 . 1 1 7 GLY N N 7.521 7.670 -5.851 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 13 . 2263 . 1 1 7 GLY O O 9.886 5.471 -4.336 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 13 . 2264 . 1 1 8 ASP C C 7.312 3.001 -6.368 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 13 . 2265 . 1 1 8 ASP CA C 8.125 3.638 -5.248 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 13 . 2266 . 1 1 8 ASP CB C 7.632 3.174 -3.880 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 13 . 2267 . 1 1 8 ASP CG C 8.756 3.343 -2.857 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 13 . 2268 . 1 1 8 ASP H H 7.093 5.474 -5.649 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 13 . 2269 . 1 1 8 ASP HA H 9.173 3.404 -5.365 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 13 . 2270 . 1 1 8 ASP HB2 H 6.778 3.766 -3.585 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2271 . 1 1 8 ASP HB3 H 7.350 2.132 -3.933 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2272 . 1 1 8 ASP N N 7.918 5.107 -5.265 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 13 . 2273 . 1 1 8 ASP O O 6.158 2.664 -6.196 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 13 . 2274 . 1 1 8 ASP OD1 O 9.807 2.758 -3.059 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 13 . 2275 . 1 1 8 ASP OD2 O 8.548 4.059 -1.892 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 13 . 2276 . 1 1 9 TYR C C 7.031 0.729 -8.471 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 13 . 2277 . 1 1 9 TYR CA C 7.154 2.242 -8.656 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 13 . 2278 . 1 1 9 TYR CB C 8.010 2.561 -9.884 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 13 . 2279 . 1 1 9 TYR CD1 C 6.322 2.630 -11.745 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 13 . 2280 . 1 1 9 TYR CD2 C 7.232 4.713 -10.904 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 13 . 2281 . 1 1 9 TYR CE1 C 5.532 3.341 -12.654 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 13 . 2282 . 1 1 9 TYR CE2 C 6.442 5.426 -11.814 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 13 . 2283 . 1 1 9 TYR CG C 7.172 3.319 -10.873 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 13 . 2284 . 1 1 9 TYR CZ C 5.591 4.739 -12.690 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 13 . 2285 . 1 1 9 TYR H H 8.821 3.145 -7.628 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 13 . 2286 . 1 1 9 TYR HA H 6.179 2.698 -8.759 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 13 . 2287 . 1 1 9 TYR HB2 H 8.855 3.168 -9.591 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2288 . 1 1 9 TYR HB3 H 8.360 1.644 -10.336 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2289 . 1 1 9 TYR HD1 H 6.277 1.552 -11.717 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 13 . 2290 . 1 1 9 TYR HD2 H 7.888 5.237 -10.223 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 13 . 2291 . 1 1 9 TYR HE1 H 4.874 2.812 -13.328 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 13 . 2292 . 1 1 9 TYR HE2 H 6.488 6.507 -11.842 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 13 . 2293 . 1 1 9 TYR HH H 4.038 4.908 -13.795 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 13 . 2294 . 1 1 9 TYR N N 7.899 2.843 -7.512 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 13 . 2295 . 1 1 9 TYR O O 7.834 0.105 -7.805 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 13 . 2296 . 1 1 9 TYR OH O 4.808 5.443 -13.585 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 13 . 2297 . 1 1 10 LEU C C 6.358 -2.073 -10.105 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 13 . 2298 . 1 1 10 LEU CA C 5.805 -1.324 -8.886 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 13 . 2299 . 1 1 10 LEU CB C 4.286 -1.474 -8.796 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 13 . 2300 . 1 1 10 LEU CD1 C 3.786 -2.035 -6.410 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 13 . 2301 . 1 1 10 LEU CD2 C 2.598 -3.226 -8.256 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 13 . 2302 . 1 1 10 LEU CG C 3.925 -2.599 -7.826 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 13 . 2303 . 1 1 10 LEU H H 5.367 0.674 -9.554 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 13 . 2304 . 1 1 10 LEU HA H 6.266 -1.682 -7.980 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 13 . 2305 . 1 1 10 LEU HB2 H 3.853 -0.549 -8.447 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2306 . 1 1 10 LEU HB3 H 3.892 -1.709 -9.773 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2307 . 1 1 10 LEU HD11 H 3.117 -2.661 -5.839 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 13 . 2308 . 1 1 10 LEU HD12 H 3.386 -1.032 -6.459 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 13 . 2309 . 1 1 10 LEU HD13 H 4.754 -2.014 -5.931 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 13 . 2310 . 1 1 10 LEU HD21 H 2.412 -4.112 -7.668 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 13 . 2311 . 1 1 10 LEU HD22 H 2.646 -3.490 -9.301 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 13 . 2312 . 1 1 10 LEU HD23 H 1.799 -2.516 -8.100 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 13 . 2313 . 1 1 10 LEU HG H 4.704 -3.350 -7.839 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 13 . 2314 . 1 1 10 LEU N N 6.012 0.144 -9.038 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 13 . 2315 . 1 1 10 LEU O O 7.360 -1.690 -10.679 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 13 . 2316 . 1 1 11 ASP C C 5.011 -4.414 -12.501 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 13 . 2317 . 1 1 11 ASP CA C 6.202 -3.917 -11.675 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 13 . 2318 . 1 1 11 ASP CB C 6.972 -5.091 -11.069 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 13 . 2319 . 1 1 11 ASP CG C 8.045 -5.562 -12.051 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 13 . 2320 . 1 1 11 ASP H H 4.916 -3.434 -10.019 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 13 . 2321 . 1 1 11 ASP HA H 6.862 -3.317 -12.286 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 13 . 2322 . 1 1 11 ASP HB2 H 7.439 -4.776 -10.146 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2323 . 1 1 11 ASP HB3 H 6.290 -5.903 -10.866 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2324 . 1 1 11 ASP N N 5.717 -3.140 -10.500 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 13 . 2325 . 1 1 11 ASP O O 4.715 -5.593 -12.533 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 13 . 2326 . 1 1 11 ASP OD1 O 8.934 -4.780 -12.348 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 13 . 2327 . 1 1 11 ASP OD2 O 7.960 -6.697 -12.491 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 13 . 2328 . 1 1 12 CYS C C 3.189 -3.304 -15.374 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 13 . 2329 . 1 1 12 CYS CA C 3.145 -3.948 -13.984 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 13 . 2330 . 1 1 12 CYS CB C 1.923 -3.457 -13.206 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 13 . 2331 . 1 1 12 CYS H H 4.572 -2.576 -13.127 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 13 . 2332 . 1 1 12 CYS HA H 3.116 -5.022 -14.068 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 13 . 2333 . 1 1 12 CYS HB2 H 2.067 -2.424 -12.922 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 13 . 2334 . 1 1 12 CYS HB3 H 1.042 -3.540 -13.827 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 13 . 2335 . 1 1 12 CYS N N 4.320 -3.522 -13.168 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 13 . 2336 . 1 1 12 CYS O O 2.164 -3.009 -15.956 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 13 . 2337 . 1 1 12 CYS SG S 1.711 -4.467 -11.721 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 13 . 2338 . 1 1 13 NH2 HN1 H 5.170 -3.316 -15.470 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 13 . 2339 . 1 1 13 NH2 HN2 H 4.381 -2.677 -16.828 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 13 . 2340 . 1 1 13 NH2 N N 4.342 -3.080 -15.937 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 14 . 2341 . 1 1 1 ACE C C 0.862 -4.635 -5.315 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 14 . 2342 . 1 1 1 ACE CH3 C 1.637 -5.640 -4.459 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 14 . 2343 . 1 1 1 ACE H1 H 1.316 -5.562 -3.430 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 14 . 2344 . 1 1 1 ACE H2 H 2.695 -5.427 -4.523 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 14 . 2345 . 1 1 1 ACE H3 H 1.450 -6.640 -4.820 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 14 . 2346 . 1 1 1 ACE O O -0.337 -4.489 -5.183 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 14 . 2347 . 1 1 2 CYS C C -0.001 -1.981 -6.228 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 14 . 2348 . 1 1 2 CYS CA C 0.849 -2.944 -7.069 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 14 . 2349 . 1 1 2 CYS CB C -0.043 -3.778 -7.994 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 14 . 2350 . 1 1 2 CYS H H 2.507 -4.080 -6.281 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 14 . 2351 . 1 1 2 CYS HA H 1.570 -2.395 -7.654 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 14 . 2352 . 1 1 2 CYS HB2 H 0.378 -4.765 -8.110 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2353 . 1 1 2 CYS HB3 H -1.032 -3.857 -7.564 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2354 . 1 1 2 CYS N N 1.540 -3.942 -6.194 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 14 . 2355 . 1 1 2 CYS O O -1.206 -1.916 -6.376 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 14 . 2356 . 1 1 2 CYS SG S -0.153 -2.968 -9.610 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 14 . 2357 . 1 1 3 ARG C C 0.605 1.017 -4.249 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 14 . 2358 . 1 1 3 ARG CA C -0.174 -0.282 -4.502 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 14 . 2359 . 1 1 3 ARG CB C -0.401 -1.023 -3.184 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 14 . 2360 . 1 1 3 ARG CD C -2.352 -1.712 -1.780 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 14 . 2361 . 1 1 3 ARG CG C -1.778 -1.691 -3.199 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 14 . 2362 . 1 1 3 ARG CZ C -4.671 -1.771 -2.477 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 14 . 2363 . 1 1 3 ARG H H 1.585 -1.296 -5.237 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 14 . 2364 . 1 1 3 ARG HA H -1.122 -0.068 -4.967 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 14 . 2365 . 1 1 3 ARG HB2 H 0.363 -1.777 -3.058 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2366 . 1 1 3 ARG HB3 H -0.354 -0.322 -2.364 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2367 . 1 1 3 ARG HD2 H -1.701 -2.271 -1.121 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 14 . 2368 . 1 1 3 ARG HD3 H -2.486 -0.706 -1.413 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 14 . 2369 . 1 1 3 ARG HE H -3.792 -3.299 -1.565 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 14 . 2370 . 1 1 3 ARG HG2 H -2.439 -1.135 -3.848 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 14 . 2371 . 1 1 3 ARG HG3 H -1.684 -2.703 -3.562 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 14 . 2372 . 1 1 3 ARG HH11 H -5.123 -0.685 -0.856 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 14 . 2373 . 1 1 3 ARG HH12 H -6.125 -0.414 -2.242 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 14 . 2374 . 1 1 3 ARG HH21 H -4.456 -2.713 -4.230 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 14 . 2375 . 1 1 3 ARG HH22 H -5.748 -1.562 -4.151 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 14 . 2376 . 1 1 3 ARG N N 0.614 -1.232 -5.345 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 14 . 2377 . 1 1 3 ARG NE N -3.672 -2.389 -1.908 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 14 . 2378 . 1 1 3 ARG NH1 N -5.360 -0.888 -1.805 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 14 . 2379 . 1 1 3 ARG NH2 N -4.983 -2.036 -3.716 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 14 . 2380 . 1 1 3 ARG O O 0.357 1.712 -3.282 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 14 . 2381 . 1 1 4 VAL C C 2.641 3.314 -6.200 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 14 . 2382 . 1 1 4 VAL CA C 2.324 2.613 -4.869 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 14 . 2383 . 1 1 4 VAL CB C 3.596 2.163 -4.153 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 14 . 2384 . 1 1 4 VAL CG1 C 4.416 1.240 -5.061 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 14 . 2385 . 1 1 4 VAL CG2 C 4.422 3.393 -3.771 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 14 . 2386 . 1 1 4 VAL H H 1.742 0.786 -5.869 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 14 . 2387 . 1 1 4 VAL HA H 1.767 3.278 -4.229 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 14 . 2388 . 1 1 4 VAL HB H 3.326 1.624 -3.255 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 14 . 2389 . 1 1 4 VAL HG11 H 5.459 1.299 -4.788 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 14 . 2390 . 1 1 4 VAL HG12 H 4.296 1.544 -6.090 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 14 . 2391 . 1 1 4 VAL HG13 H 4.072 0.224 -4.944 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 14 . 2392 . 1 1 4 VAL HG21 H 5.093 3.138 -2.964 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 14 . 2393 . 1 1 4 VAL HG22 H 3.760 4.184 -3.454 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 14 . 2394 . 1 1 4 VAL HG23 H 4.993 3.724 -4.624 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 14 . 2395 . 1 1 4 VAL N N 1.545 1.355 -5.095 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 14 . 2396 . 1 1 4 VAL O O 2.487 2.742 -7.262 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 14 . 2397 . 1 1 5 VAL C C 4.590 6.214 -7.265 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 14 . 2398 . 1 1 5 VAL CA C 3.363 5.297 -7.413 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 14 . 2399 . 1 1 5 VAL CB C 2.078 6.095 -7.716 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 14 . 2400 . 1 1 5 VAL CG1 C 1.513 6.747 -6.444 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 14 . 2401 . 1 1 5 VAL CG2 C 2.362 7.179 -8.768 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 14 . 2402 . 1 1 5 VAL H H 3.168 5.002 -5.289 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 14 . 2403 . 1 1 5 VAL HA H 3.536 4.601 -8.205 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 14 . 2404 . 1 1 5 VAL HB H 1.344 5.419 -8.102 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 14 . 2405 . 1 1 5 VAL HG11 H 2.195 6.592 -5.622 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 14 . 2406 . 1 1 5 VAL HG12 H 0.559 6.302 -6.207 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 14 . 2407 . 1 1 5 VAL HG13 H 1.382 7.807 -6.609 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 14 . 2408 . 1 1 5 VAL HG21 H 1.606 7.139 -9.538 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 14 . 2409 . 1 1 5 VAL HG22 H 3.333 7.009 -9.210 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 14 . 2410 . 1 1 5 VAL HG23 H 2.345 8.151 -8.299 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 14 . 2411 . 1 1 5 VAL N N 3.062 4.556 -6.150 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 14 . 2412 . 1 1 5 VAL O O 5.707 5.840 -7.576 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 14 . 2413 . 1 1 6 ARG C C 6.386 8.019 -5.480 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 14 . 2414 . 1 1 6 ARG CA C 5.522 8.379 -6.684 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 14 . 2415 . 1 1 6 ARG CB C 4.866 9.749 -6.487 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 14 . 2416 . 1 1 6 ARG CD C 4.751 10.423 -4.080 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 14 . 2417 . 1 1 6 ARG CG C 4.000 9.735 -5.222 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 14 . 2418 . 1 1 6 ARG CZ C 3.430 12.218 -3.133 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 14 . 2419 . 1 1 6 ARG H H 3.482 7.695 -6.597 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 14 . 2420 . 1 1 6 ARG HA H 6.116 8.384 -7.583 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 14 . 2421 . 1 1 6 ARG HB2 H 5.633 10.504 -6.391 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2422 . 1 1 6 ARG HB3 H 4.246 9.974 -7.342 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2423 . 1 1 6 ARG HD2 H 4.529 9.935 -3.140 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 14 . 2424 . 1 1 6 ARG HD3 H 5.813 10.415 -4.269 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 14 . 2425 . 1 1 6 ARG HE H 4.521 12.447 -4.775 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 14 . 2426 . 1 1 6 ARG HG2 H 3.075 10.261 -5.414 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 14 . 2427 . 1 1 6 ARG HG3 H 3.782 8.715 -4.945 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 14 . 2428 . 1 1 6 ARG HH11 H 4.897 12.755 -1.881 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 14 . 2429 . 1 1 6 ARG HH12 H 3.285 12.996 -1.294 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 14 . 2430 . 1 1 6 ARG HH21 H 1.773 11.775 -4.166 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 14 . 2431 . 1 1 6 ARG HH22 H 1.516 12.441 -2.588 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 14 . 2432 . 1 1 6 ARG N N 4.386 7.418 -6.815 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 14 . 2433 . 1 1 6 ARG NE N 4.243 11.822 -4.074 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 14 . 2434 . 1 1 6 ARG NH1 N 3.908 12.693 -2.016 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 14 . 2435 . 1 1 6 ARG NH2 N 2.139 12.138 -3.310 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 14 . 2436 . 1 1 6 ARG O O 5.908 7.846 -4.377 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 14 . 2437 . 1 1 7 GLY C C 8.826 5.972 -4.723 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 14 . 2438 . 1 1 7 GLY CA C 8.588 7.478 -4.618 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 14 . 2439 . 1 1 7 GLY H H 8.008 7.989 -6.622 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 14 . 2440 . 1 1 7 GLY HA2 H 9.525 8.009 -4.724 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 14 . 2441 . 1 1 7 GLY HA3 H 8.142 7.704 -3.663 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 14 . 2442 . 1 1 7 GLY N N 7.663 7.869 -5.712 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 14 . 2443 . 1 1 7 GLY O O 9.876 5.466 -4.377 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 14 . 2444 . 1 1 8 ASP C C 7.089 3.364 -6.552 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 14 . 2445 . 1 1 8 ASP CA C 7.982 3.792 -5.388 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 14 . 2446 . 1 1 8 ASP CB C 7.510 3.194 -4.064 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 14 . 2447 . 1 1 8 ASP CG C 8.704 3.047 -3.117 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 14 . 2448 . 1 1 8 ASP H H 7.024 5.697 -5.517 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 14 . 2449 . 1 1 8 ASP HA H 9.009 3.523 -5.578 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 14 . 2450 . 1 1 8 ASP HB2 H 6.779 3.849 -3.617 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2451 . 1 1 8 ASP HB3 H 7.070 2.224 -4.239 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2452 . 1 1 8 ASP N N 7.850 5.259 -5.222 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 14 . 2453 . 1 1 8 ASP O O 5.933 3.039 -6.376 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 14 . 2454 . 1 1 8 ASP OD1 O 9.788 2.763 -3.600 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 14 . 2455 . 1 1 8 ASP OD2 O 8.512 3.221 -1.924 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 14 . 2456 . 1 1 9 TYR C C 6.680 1.518 -9.082 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 14 . 2457 . 1 1 9 TYR CA C 6.778 3.035 -8.931 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 14 . 2458 . 1 1 9 TYR CB C 7.515 3.642 -10.127 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 14 . 2459 . 1 1 9 TYR CD1 C 6.449 5.921 -10.227 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 14 . 2460 . 1 1 9 TYR CD2 C 8.771 5.750 -9.551 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 14 . 2461 . 1 1 9 TYR CE1 C 6.507 7.311 -10.072 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 14 . 2462 . 1 1 9 TYR CE2 C 8.828 7.139 -9.394 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 14 . 2463 . 1 1 9 TYR CG C 7.582 5.142 -9.967 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 14 . 2464 . 1 1 9 TYR CZ C 7.695 7.920 -9.656 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 14 . 2465 . 1 1 9 TYR H H 8.527 3.694 -7.857 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 14 . 2466 . 1 1 9 TYR HA H 5.792 3.471 -8.851 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 14 . 2467 . 1 1 9 TYR HB2 H 8.517 3.240 -10.174 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2468 . 1 1 9 TYR HB3 H 6.987 3.400 -11.036 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2469 . 1 1 9 TYR HD1 H 5.531 5.451 -10.548 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 14 . 2470 . 1 1 9 TYR HD2 H 9.646 5.147 -9.351 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 14 . 2471 . 1 1 9 TYR HE1 H 5.634 7.914 -10.273 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 14 . 2472 . 1 1 9 TYR HE2 H 9.746 7.609 -9.074 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 14 . 2473 . 1 1 9 TYR HH H 7.303 9.691 -10.249 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 14 . 2474 . 1 1 9 TYR N N 7.607 3.397 -7.742 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 14 . 2475 . 1 1 9 TYR O O 7.037 0.956 -10.100 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 14 . 2476 . 1 1 9 TYR OH O 7.753 9.290 -9.502 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 14 . 2477 . 1 1 10 LEU C C 4.540 -0.935 -8.484 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 14 . 2478 . 1 1 10 LEU CA C 6.001 -0.618 -8.155 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 14 . 2479 . 1 1 10 LEU CB C 6.360 -1.128 -6.757 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 14 . 2480 . 1 1 10 LEU CD1 C 8.593 -0.002 -6.937 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 14 . 2481 . 1 1 10 LEU CD2 C 8.219 -1.776 -5.221 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 14 . 2482 . 1 1 10 LEU CG C 7.875 -1.322 -6.642 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 14 . 2483 . 1 1 10 LEU H H 5.864 1.342 -7.284 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 14 . 2484 . 1 1 10 LEU HA H 6.663 -1.042 -8.893 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 14 . 2485 . 1 1 10 LEU HB2 H 6.033 -0.410 -6.019 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2486 . 1 1 10 LEU HB3 H 5.865 -2.071 -6.582 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2487 . 1 1 10 LEU HD11 H 9.613 -0.060 -6.587 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 14 . 2488 . 1 1 10 LEU HD12 H 8.084 0.806 -6.433 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 14 . 2489 . 1 1 10 LEU HD13 H 8.588 0.179 -8.003 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 14 . 2490 . 1 1 10 LEU HD21 H 7.726 -2.714 -5.014 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 14 . 2491 . 1 1 10 LEU HD22 H 7.885 -1.030 -4.514 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 14 . 2492 . 1 1 10 LEU HD23 H 9.287 -1.903 -5.132 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 14 . 2493 . 1 1 10 LEU HG H 8.197 -2.073 -7.348 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 14 . 2494 . 1 1 10 LEU N N 6.165 0.859 -8.081 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 14 . 2495 . 1 1 10 LEU O O 3.809 -1.460 -7.669 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 14 . 2496 . 1 1 11 ASP C C 2.569 -2.179 -10.811 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 14 . 2497 . 1 1 11 ASP CA C 2.690 -0.854 -10.055 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 14 . 2498 . 1 1 11 ASP CB C 2.300 0.321 -10.959 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 14 . 2499 . 1 1 11 ASP CG C 3.212 0.356 -12.188 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 14 . 2500 . 1 1 11 ASP H H 4.716 -0.161 -10.305 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 14 . 2501 . 1 1 11 ASP HA H 2.061 -0.863 -9.178 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 14 . 2502 . 1 1 11 ASP HB2 H 1.274 0.204 -11.275 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2503 . 1 1 11 ASP HB3 H 2.405 1.245 -10.410 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2504 . 1 1 11 ASP N N 4.109 -0.597 -9.671 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 14 . 2505 . 1 1 11 ASP O O 1.971 -2.244 -11.866 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 14 . 2506 . 1 1 11 ASP OD1 O 4.397 0.590 -12.016 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 14 . 2507 . 1 1 11 ASP OD2 O 2.710 0.148 -13.280 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 14 . 2508 . 1 1 12 CYS C C 2.976 -4.482 -12.433 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 14 . 2509 . 1 1 12 CYS CA C 3.048 -4.582 -10.902 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 14 . 2510 . 1 1 12 CYS CB C 1.779 -5.228 -10.322 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 14 . 2511 . 1 1 12 CYS H H 3.583 -3.133 -9.400 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 14 . 2512 . 1 1 12 CYS HA H 3.906 -5.166 -10.615 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 14 . 2513 . 1 1 12 CYS HB2 H 1.755 -6.272 -10.596 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 14 . 2514 . 1 1 12 CYS HB3 H 1.801 -5.145 -9.246 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 14 . 2515 . 1 1 12 CYS N N 3.121 -3.230 -10.258 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 14 . 2516 . 1 1 12 CYS O O 2.186 -5.153 -13.066 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 14 . 2517 . 1 1 12 CYS SG S 0.289 -4.410 -10.961 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 14 . 2518 . 1 1 13 NH2 HN1 H 4.418 -3.122 -12.548 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 14 . 2519 . 1 1 13 NH2 HN2 H 3.741 -3.588 -14.033 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 14 . 2520 . 1 1 13 NH2 N N 3.778 -3.662 -13.057 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
. 15 . 2521 . 1 1 1 ACE C C 4.522 -4.297 -4.163 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . rr_1i6y 1
. 15 . 2522 . 1 1 1 ACE CH3 C 4.493 -5.605 -3.369 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . rr_1i6y 1
. 15 . 2523 . 1 1 1 ACE H1 H 4.493 -5.386 -2.311 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . rr_1i6y 1
. 15 . 2524 . 1 1 1 ACE H2 H 5.364 -6.194 -3.616 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . rr_1i6y 1
. 15 . 2525 . 1 1 1 ACE H3 H 3.602 -6.160 -3.621 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . rr_1i6y 1
. 15 . 2526 . 1 1 1 ACE O O 5.004 -3.285 -3.693 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . rr_1i6y 1
. 15 . 2527 . 1 1 2 CYS C C 2.624 -2.413 -6.141 . . . 1.0 . . . . . . . . . . . . A . 2 CYS C . . . . . . . . . rr_1i6y 1
. 15 . 2528 . 1 1 2 CYS CA C 4.007 -3.072 -6.194 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CA . . . . . . . . . rr_1i6y 1
. 15 . 2529 . 1 1 2 CYS CB C 4.324 -3.543 -7.620 . . . 1.0 . . . . . . . . . . . . A . 2 CYS CB . . . . . . . . . rr_1i6y 1
. 15 . 2530 . 1 1 2 CYS H H 3.628 -5.141 -5.722 . . . 1.0 . . . . . . . . . . . . A . 2 CYS H . . . . . . . . . rr_1i6y 1
. 15 . 2531 . 1 1 2 CYS HA H 4.766 -2.388 -5.852 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HA . . . . . . . . . rr_1i6y 1
. 15 . 2532 . 1 1 2 CYS HB2 H 3.552 -4.221 -7.953 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2533 . 1 1 2 CYS HB3 H 4.361 -2.689 -8.279 . . . 1.0 . . . . . . . . . . . . A . 2 CYS HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2534 . 1 1 2 CYS N N 4.010 -4.313 -5.364 . . . 1.0 . . . . . . . . . . . . A . 2 CYS N . . . . . . . . . rr_1i6y 1
. 15 . 2535 . 1 1 2 CYS O O 1.786 -2.639 -6.992 . . . 1.0 . . . . . . . . . . . . A . 2 CYS O . . . . . . . . . rr_1i6y 1
. 15 . 2536 . 1 1 2 CYS SG S 5.924 -4.398 -7.649 . . . 1.0 . . . . . . . . . . . . A . 2 CYS SG . . . . . . . . . rr_1i6y 1
. 15 . 2537 . 1 1 3 ARG C C 1.214 0.565 -4.753 . . . 1.0 . . . . . . . . . . . . A . 3 ARG C . . . . . . . . . rr_1i6y 1
. 15 . 2538 . 1 1 3 ARG CA C 1.044 -0.935 -5.033 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CA . . . . . . . . . rr_1i6y 1
. 15 . 2539 . 1 1 3 ARG CB C 0.355 -1.628 -3.854 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CB . . . . . . . . . rr_1i6y 1
. 15 . 2540 . 1 1 3 ARG CD C -0.905 -3.666 -3.133 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CD . . . . . . . . . rr_1i6y 1
. 15 . 2541 . 1 1 3 ARG CG C -0.183 -2.990 -4.302 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CG . . . . . . . . . rr_1i6y 1
. 15 . 2542 . 1 1 3 ARG CZ C -2.387 -2.136 -1.979 . . . 1.0 . . . . . . . . . . . . A . 3 ARG CZ . . . . . . . . . rr_1i6y 1
. 15 . 2543 . 1 1 3 ARG H H 3.064 -1.437 -4.466 . . . 1.0 . . . . . . . . . . . . A . 3 ARG H . . . . . . . . . rr_1i6y 1
. 15 . 2544 . 1 1 3 ARG HA H 0.473 -1.087 -5.935 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HA . . . . . . . . . rr_1i6y 1
. 15 . 2545 . 1 1 3 ARG HB2 H 1.067 -1.768 -3.054 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2546 . 1 1 3 ARG HB3 H -0.465 -1.018 -3.505 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2547 . 1 1 3 ARG HD2 H -1.088 -4.708 -3.357 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD2 . . . . . . . . . rr_1i6y 1
. 15 . 2548 . 1 1 3 ARG HD3 H -0.328 -3.570 -2.227 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HD3 . . . . . . . . . rr_1i6y 1
. 15 . 2549 . 1 1 3 ARG HE H -2.891 -3.036 -3.676 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HE . . . . . . . . . rr_1i6y 1
. 15 . 2550 . 1 1 3 ARG HG2 H -0.873 -2.852 -5.122 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG2 . . . . . . . . . rr_1i6y 1
. 15 . 2551 . 1 1 3 ARG HG3 H 0.638 -3.613 -4.624 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HG3 . . . . . . . . . rr_1i6y 1
. 15 . 2552 . 1 1 3 ARG HH11 H -1.785 -3.482 -0.625 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH11 . . . . . . . . . rr_1i6y 1
. 15 . 2553 . 1 1 3 ARG HH12 H -2.280 -1.948 0.010 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH12 . . . . . . . . . rr_1i6y 1
. 15 . 2554 . 1 1 3 ARG HH21 H -3.033 -0.606 -3.096 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH21 . . . . . . . . . rr_1i6y 1
. 15 . 2555 . 1 1 3 ARG HH22 H -2.987 -0.321 -1.389 . . . 1.0 . . . . . . . . . . . . A . 3 ARG HH22 . . . . . . . . . rr_1i6y 1
. 15 . 2556 . 1 1 3 ARG N N 2.376 -1.601 -5.144 . . . 1.0 . . . . . . . . . . . . A . 3 ARG N . . . . . . . . . rr_1i6y 1
. 15 . 2557 . 1 1 3 ARG NE N -2.192 -2.928 -2.999 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NE . . . . . . . . . rr_1i6y 1
. 15 . 2558 . 1 1 3 ARG NH1 N -2.131 -2.555 -0.770 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH1 . . . . . . . . . rr_1i6y 1
. 15 . 2559 . 1 1 3 ARG NH2 N -2.838 -0.927 -2.169 . . . 1.0 . . . . . . . . . . . . A . 3 ARG NH2 . . . . . . . . . rr_1i6y 1
. 15 . 2560 . 1 1 3 ARG O O 0.343 1.205 -4.195 . . . 1.0 . . . . . . . . . . . . A . 3 ARG O . . . . . . . . . rr_1i6y 1
. 15 . 2561 . 1 1 4 VAL C C 2.990 3.265 -6.211 . . . 1.0 . . . . . . . . . . . . A . 4 VAL C . . . . . . . . . rr_1i6y 1
. 15 . 2562 . 1 1 4 VAL CA C 2.556 2.588 -4.900 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CA . . . . . . . . . rr_1i6y 1
. 15 . 2563 . 1 1 4 VAL CB C 3.651 2.649 -3.822 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CB . . . . . . . . . rr_1i6y 1
. 15 . 2564 . 1 1 4 VAL CG1 C 4.784 1.680 -4.165 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG1 . . . . . . . . . rr_1i6y 1
. 15 . 2565 . 1 1 4 VAL CG2 C 4.211 4.071 -3.723 . . . 1.0 . . . . . . . . . . . . A . 4 VAL CG2 . . . . . . . . . rr_1i6y 1
. 15 . 2566 . 1 1 4 VAL H H 3.014 0.596 -5.589 . . . 1.0 . . . . . . . . . . . . A . 4 VAL H . . . . . . . . . rr_1i6y 1
. 15 . 2567 . 1 1 4 VAL HA H 1.653 3.045 -4.529 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HA . . . . . . . . . rr_1i6y 1
. 15 . 2568 . 1 1 4 VAL HB H 3.223 2.368 -2.870 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HB . . . . . . . . . rr_1i6y 1
. 15 . 2569 . 1 1 4 VAL HG11 H 5.730 2.144 -3.944 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG11 . . . . . . . . . rr_1i6y 1
. 15 . 2570 . 1 1 4 VAL HG12 H 4.741 1.432 -5.215 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG12 . . . . . . . . . rr_1i6y 1
. 15 . 2571 . 1 1 4 VAL HG13 H 4.680 0.780 -3.577 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG13 . . . . . . . . . rr_1i6y 1
. 15 . 2572 . 1 1 4 VAL HG21 H 4.888 4.134 -2.884 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG21 . . . . . . . . . rr_1i6y 1
. 15 . 2573 . 1 1 4 VAL HG22 H 3.399 4.770 -3.585 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG22 . . . . . . . . . rr_1i6y 1
. 15 . 2574 . 1 1 4 VAL HG23 H 4.741 4.312 -4.632 . . . 1.0 . . . . . . . . . . . . A . 4 VAL HG23 . . . . . . . . . rr_1i6y 1
. 15 . 2575 . 1 1 4 VAL N N 2.327 1.130 -5.139 . . . 1.0 . . . . . . . . . . . . A . 4 VAL N . . . . . . . . . rr_1i6y 1
. 15 . 2576 . 1 1 4 VAL O O 3.236 2.605 -7.201 . . . 1.0 . . . . . . . . . . . . A . 4 VAL O . . . . . . . . . rr_1i6y 1
. 15 . 2577 . 1 1 5 VAL C C 4.647 6.212 -7.290 . . . 1.0 . . . . . . . . . . . . A . 5 VAL C . . . . . . . . . rr_1i6y 1
. 15 . 2578 . 1 1 5 VAL CA C 3.452 5.268 -7.497 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CA . . . . . . . . . rr_1i6y 1
. 15 . 2579 . 1 1 5 VAL CB C 2.199 6.044 -7.910 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CB . . . . . . . . . rr_1i6y 1
. 15 . 2580 . 1 1 5 VAL CG1 C 2.493 6.885 -9.155 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG1 . . . . . . . . . rr_1i6y 1
. 15 . 2581 . 1 1 5 VAL CG2 C 1.077 5.054 -8.226 . . . 1.0 . . . . . . . . . . . . A . 5 VAL CG2 . . . . . . . . . rr_1i6y 1
. 15 . 2582 . 1 1 5 VAL H H 2.843 5.092 -5.437 . . . 1.0 . . . . . . . . . . . . A . 5 VAL H . . . . . . . . . rr_1i6y 1
. 15 . 2583 . 1 1 5 VAL HA H 3.685 4.549 -8.251 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HA . . . . . . . . . rr_1i6y 1
. 15 . 2584 . 1 1 5 VAL HB H 1.891 6.690 -7.101 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HB . . . . . . . . . rr_1i6y 1
. 15 . 2585 . 1 1 5 VAL HG11 H 2.856 6.245 -9.946 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG11 . . . . . . . . . rr_1i6y 1
. 15 . 2586 . 1 1 5 VAL HG12 H 3.243 7.626 -8.918 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG12 . . . . . . . . . rr_1i6y 1
. 15 . 2587 . 1 1 5 VAL HG13 H 1.589 7.380 -9.477 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG13 . . . . . . . . . rr_1i6y 1
. 15 . 2588 . 1 1 5 VAL HG21 H 0.137 5.583 -8.282 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG21 . . . . . . . . . rr_1i6y 1
. 15 . 2589 . 1 1 5 VAL HG22 H 1.025 4.308 -7.446 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG22 . . . . . . . . . rr_1i6y 1
. 15 . 2590 . 1 1 5 VAL HG23 H 1.277 4.572 -9.172 . . . 1.0 . . . . . . . . . . . . A . 5 VAL HG23 . . . . . . . . . rr_1i6y 1
. 15 . 2591 . 1 1 5 VAL N N 3.062 4.572 -6.235 . . . 1.0 . . . . . . . . . . . . A . 5 VAL N . . . . . . . . . rr_1i6y 1
. 15 . 2592 . 1 1 5 VAL O O 5.785 5.861 -7.543 . . . 1.0 . . . . . . . . . . . . A . 5 VAL O . . . . . . . . . rr_1i6y 1
. 15 . 2593 . 1 1 6 ARG C C 6.332 8.047 -5.431 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . rr_1i6y 1
. 15 . 2594 . 1 1 6 ARG CA C 5.509 8.392 -6.667 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . rr_1i6y 1
. 15 . 2595 . 1 1 6 ARG CB C 4.817 9.748 -6.501 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . rr_1i6y 1
. 15 . 2596 . 1 1 6 ARG CD C 5.410 12.132 -6.059 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . rr_1i6y 1
. 15 . 2597 . 1 1 6 ARG CG C 5.803 10.871 -6.824 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . rr_1i6y 1
. 15 . 2598 . 1 1 6 ARG CZ C 4.508 14.062 -7.194 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . rr_1i6y 1
. 15 . 2599 . 1 1 6 ARG H H 3.473 7.672 -6.668 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . rr_1i6y 1
. 15 . 2600 . 1 1 6 ARG HA H 6.140 8.409 -7.538 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . rr_1i6y 1
. 15 . 2601 . 1 1 6 ARG HB2 H 3.974 9.806 -7.173 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2602 . 1 1 6 ARG HB3 H 4.473 9.855 -5.485 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2603 . 1 1 6 ARG HD2 H 4.982 11.870 -5.099 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . rr_1i6y 1
. 15 . 2604 . 1 1 6 ARG HD3 H 6.265 12.774 -5.930 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . rr_1i6y 1
. 15 . 2605 . 1 1 6 ARG HE H 3.647 12.280 -7.283 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . rr_1i6y 1
. 15 . 2606 . 1 1 6 ARG HG2 H 6.798 10.575 -6.533 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . rr_1i6y 1
. 15 . 2607 . 1 1 6 ARG HG3 H 5.783 11.077 -7.883 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . rr_1i6y 1
. 15 . 2608 . 1 1 6 ARG HH11 H 6.479 13.968 -7.544 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . rr_1i6y 1
. 15 . 2609 . 1 1 6 ARG HH12 H 5.760 15.533 -7.721 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . rr_1i6y 1
. 15 . 2610 . 1 1 6 ARG HH21 H 2.566 14.445 -6.905 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . rr_1i6y 1
. 15 . 2611 . 1 1 6 ARG HH22 H 3.539 15.804 -7.358 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . rr_1i6y 1
. 15 . 2612 . 1 1 6 ARG N N 4.395 7.412 -6.849 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . rr_1i6y 1
. 15 . 2613 . 1 1 6 ARG NE N 4.397 12.795 -6.920 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . rr_1i6y 1
. 15 . 2614 . 1 1 6 ARG NH1 N 5.673 14.561 -7.511 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . rr_1i6y 1
. 15 . 2615 . 1 1 6 ARG NH2 N 3.456 14.831 -7.149 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . rr_1i6y 1
. 15 . 2616 . 1 1 6 ARG O O 5.833 7.972 -4.325 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . rr_1i6y 1
. 15 . 2617 . 1 1 7 GLY C C 8.851 5.939 -4.766 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . rr_1i6y 1
. 15 . 2618 . 1 1 7 GLY CA C 8.507 7.403 -4.540 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . rr_1i6y 1
. 15 . 2619 . 1 1 7 GLY H H 7.948 7.834 -6.559 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . rr_1i6y 1
. 15 . 2620 . 1 1 7 GLY HA2 H 9.405 8.009 -4.570 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . rr_1i6y 1
. 15 . 2621 . 1 1 7 GLY HA3 H 8.011 7.517 -3.590 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . rr_1i6y 1
. 15 . 2622 . 1 1 7 GLY N N 7.598 7.796 -5.645 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . rr_1i6y 1
. 15 . 2623 . 1 1 7 GLY O O 9.967 5.498 -4.579 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . rr_1i6y 1
. 15 . 2624 . 1 1 8 ASP C C 6.972 3.382 -6.504 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1i6y 1
. 15 . 2625 . 1 1 8 ASP CA C 8.074 3.772 -5.532 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1i6y 1
. 15 . 2626 . 1 1 8 ASP CB C 7.951 3.025 -4.205 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1i6y 1
. 15 . 2627 . 1 1 8 ASP CG C 9.325 2.970 -3.536 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1i6y 1
. 15 . 2628 . 1 1 8 ASP H H 7.005 5.609 -5.403 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1i6y 1
. 15 . 2629 . 1 1 8 ASP HA H 9.045 3.609 -5.971 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1i6y 1
. 15 . 2630 . 1 1 8 ASP HB2 H 7.253 3.541 -3.562 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2631 . 1 1 8 ASP HB3 H 7.605 2.020 -4.389 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2632 . 1 1 8 ASP N N 7.880 5.200 -5.219 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1i6y 1
. 15 . 2633 . 1 1 8 ASP O O 5.867 3.081 -6.108 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1i6y 1
. 15 . 2634 . 1 1 8 ASP OD1 O 10.173 2.243 -4.029 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1i6y 1
. 15 . 2635 . 1 1 8 ASP OD2 O 9.511 3.660 -2.548 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1i6y 1
. 15 . 2636 . 1 1 9 TYR C C 5.971 1.606 -8.860 . . . 1.0 . . . . . . . . . . . . A . 9 TYR C . . . . . . . . . rr_1i6y 1
. 15 . 2637 . 1 1 9 TYR CA C 6.178 3.112 -8.761 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CA . . . . . . . . . rr_1i6y 1
. 15 . 2638 . 1 1 9 TYR CB C 6.690 3.673 -10.089 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CB . . . . . . . . . rr_1i6y 1
. 15 . 2639 . 1 1 9 TYR CD1 C 5.299 5.720 -10.551 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD1 . . . . . . . . . rr_1i6y 1
. 15 . 2640 . 1 1 9 TYR CD2 C 7.516 6.001 -9.613 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CD2 . . . . . . . . . rr_1i6y 1
. 15 . 2641 . 1 1 9 TYR CE1 C 5.116 7.108 -10.537 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE1 . . . . . . . . . rr_1i6y 1
. 15 . 2642 . 1 1 9 TYR CE2 C 7.334 7.388 -9.600 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CE2 . . . . . . . . . rr_1i6y 1
. 15 . 2643 . 1 1 9 TYR CG C 6.499 5.168 -10.090 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CG . . . . . . . . . rr_1i6y 1
. 15 . 2644 . 1 1 9 TYR CZ C 6.134 7.941 -10.061 . . . 1.0 . . . . . . . . . . . . A . 9 TYR CZ . . . . . . . . . rr_1i6y 1
. 15 . 2645 . 1 1 9 TYR H H 8.126 3.718 -8.065 . . . 1.0 . . . . . . . . . . . . A . 9 TYR H . . . . . . . . . rr_1i6y 1
. 15 . 2646 . 1 1 9 TYR HA H 5.258 3.604 -8.489 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HA . . . . . . . . . rr_1i6y 1
. 15 . 2647 . 1 1 9 TYR HB2 H 7.739 3.440 -10.201 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2648 . 1 1 9 TYR HB3 H 6.134 3.238 -10.905 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2649 . 1 1 9 TYR HD1 H 4.515 5.076 -10.920 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD1 . . . . . . . . . rr_1i6y 1
. 15 . 2650 . 1 1 9 TYR HD2 H 8.442 5.574 -9.259 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HD2 . . . . . . . . . rr_1i6y 1
. 15 . 2651 . 1 1 9 TYR HE1 H 4.188 7.534 -10.888 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE1 . . . . . . . . . rr_1i6y 1
. 15 . 2652 . 1 1 9 TYR HE2 H 8.120 8.032 -9.230 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HE2 . . . . . . . . . rr_1i6y 1
. 15 . 2653 . 1 1 9 TYR HH H 6.270 9.660 -10.887 . . . 1.0 . . . . . . . . . . . . A . 9 TYR HH . . . . . . . . . rr_1i6y 1
. 15 . 2654 . 1 1 9 TYR N N 7.243 3.431 -7.770 . . . 1.0 . . . . . . . . . . . . A . 9 TYR N . . . . . . . . . rr_1i6y 1
. 15 . 2655 . 1 1 9 TYR O O 6.870 0.825 -8.621 . . . 1.0 . . . . . . . . . . . . A . 9 TYR O . . . . . . . . . rr_1i6y 1
. 15 . 2656 . 1 1 9 TYR OH O 5.956 9.310 -10.048 . . . 1.0 . . . . . . . . . . . . A . 9 TYR OH . . . . . . . . . rr_1i6y 1
. 15 . 2657 . 1 1 10 LEU C C 4.626 -0.738 -10.722 . . . 1.0 . . . . . . . . . . . . A . 10 LEU C . . . . . . . . . rr_1i6y 1
. 15 . 2658 . 1 1 10 LEU CA C 4.481 -0.255 -9.281 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CA . . . . . . . . . rr_1i6y 1
. 15 . 2659 . 1 1 10 LEU CB C 3.029 -0.382 -8.815 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CB . . . . . . . . . rr_1i6y 1
. 15 . 2660 . 1 1 10 LEU CD1 C 0.986 -0.534 -10.247 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD1 . . . . . . . . . rr_1i6y 1
. 15 . 2661 . 1 1 10 LEU CD2 C 1.519 1.597 -9.063 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CD2 . . . . . . . . . rr_1i6y 1
. 15 . 2662 . 1 1 10 LEU CG C 2.113 0.384 -9.777 . . . 1.0 . . . . . . . . . . . . A . 10 LEU CG . . . . . . . . . rr_1i6y 1
. 15 . 2663 . 1 1 10 LEU H H 4.067 1.853 -9.362 . . . 1.0 . . . . . . . . . . . . A . 10 LEU H . . . . . . . . . rr_1i6y 1
. 15 . 2664 . 1 1 10 LEU HA H 5.129 -0.811 -8.627 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HA . . . . . . . . . rr_1i6y 1
. 15 . 2665 . 1 1 10 LEU HB2 H 2.748 -1.425 -8.798 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2666 . 1 1 10 LEU HB3 H 2.934 0.032 -7.823 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2667 . 1 1 10 LEU HD11 H 0.470 -0.939 -9.389 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD11 . . . . . . . . . rr_1i6y 1
. 15 . 2668 . 1 1 10 LEU HD12 H 1.399 -1.343 -10.832 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD12 . . . . . . . . . rr_1i6y 1
. 15 . 2669 . 1 1 10 LEU HD13 H 0.291 0.029 -10.850 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD13 . . . . . . . . . rr_1i6y 1
. 15 . 2670 . 1 1 10 LEU HD21 H 2.158 2.454 -9.217 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD21 . . . . . . . . . rr_1i6y 1
. 15 . 2671 . 1 1 10 LEU HD22 H 1.439 1.392 -8.007 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD22 . . . . . . . . . rr_1i6y 1
. 15 . 2672 . 1 1 10 LEU HD23 H 0.538 1.804 -9.465 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HD23 . . . . . . . . . rr_1i6y 1
. 15 . 2673 . 1 1 10 LEU HG H 2.685 0.713 -10.633 . . . 1.0 . . . . . . . . . . . . A . 10 LEU HG . . . . . . . . . rr_1i6y 1
. 15 . 2674 . 1 1 10 LEU N N 4.776 1.199 -9.188 . . . 1.0 . . . . . . . . . . . . A . 10 LEU N . . . . . . . . . rr_1i6y 1
. 15 . 2675 . 1 1 10 LEU O O 3.789 -1.456 -11.233 . . . 1.0 . . . . . . . . . . . . A . 10 LEU O . . . . . . . . . rr_1i6y 1
. 15 . 2676 . 1 1 11 ASP C C 6.678 -2.126 -12.736 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1i6y 1
. 15 . 2677 . 1 1 11 ASP CA C 5.892 -0.820 -12.775 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1i6y 1
. 15 . 2678 . 1 1 11 ASP CB C 6.689 0.296 -13.459 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1i6y 1
. 15 . 2679 . 1 1 11 ASP CG C 6.992 -0.106 -14.902 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1i6y 1
. 15 . 2680 . 1 1 11 ASP H H 6.359 0.203 -10.939 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1i6y 1
. 15 . 2681 . 1 1 11 ASP HA H 4.943 -0.963 -13.270 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1i6y 1
. 15 . 2682 . 1 1 11 ASP HB2 H 6.106 1.206 -13.454 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2683 . 1 1 11 ASP HB3 H 7.616 0.459 -12.929 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2684 . 1 1 11 ASP N N 5.690 -0.365 -11.375 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1i6y 1
. 15 . 2685 . 1 1 11 ASP O O 7.783 -2.227 -13.232 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1i6y 1
. 15 . 2686 . 1 1 11 ASP OD1 O 6.075 -0.546 -15.578 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1i6y 1
. 15 . 2687 . 1 1 11 ASP OD2 O 8.134 0.032 -15.308 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1i6y 1
. 15 . 2688 . 1 1 12 CYS C C 6.303 -5.384 -13.095 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1i6y 1
. 15 . 2689 . 1 1 12 CYS CA C 6.782 -4.435 -11.992 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1i6y 1
. 15 . 2690 . 1 1 12 CYS CB C 6.367 -4.952 -10.610 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1i6y 1
. 15 . 2691 . 1 1 12 CYS H H 5.218 -2.992 -11.713 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1i6y 1
. 15 . 2692 . 1 1 12 CYS HA H 7.850 -4.312 -12.035 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1i6y 1
. 15 . 2693 . 1 1 12 CYS HB2 H 5.297 -5.104 -10.591 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1i6y 1
. 15 . 2694 . 1 1 12 CYS HB3 H 6.865 -5.889 -10.410 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1i6y 1
. 15 . 2695 . 1 1 12 CYS N N 6.103 -3.120 -12.117 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1i6y 1
. 15 . 2696 . 1 1 12 CYS O O 6.192 -6.575 -12.886 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1i6y 1
. 15 . 2697 . 1 1 12 CYS SG S 6.825 -3.740 -9.337 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1i6y 1
. 15 . 2698 . 1 1 13 NH2 HN1 H 6.100 -3.940 -14.441 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN1 . . . . . . . . . rr_1i6y 1
. 15 . 2699 . 1 1 13 NH2 HN2 H 5.703 -5.498 -14.984 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 HN2 . . . . . . . . . rr_1i6y 1
. 15 . 2700 . 1 1 13 NH2 N N 6.012 -4.900 -14.271 . . . 1.0 . . . . . . . . . . . . A . 13 NH2 N . . . . . . . . . rr_1i6y 1
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_framecode global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID rr_1i6y
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 1i6y.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 2 distance NOE simple 117 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 10 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 4 "coupling constant" "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 5 "chemical shift" "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 6 "chemical shift" "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1i6y 1
stop_
save_
save_constraint_statistics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Sf_framecode constraint_statistics
_Constraint_stat_list.Entry_ID rr_1i6y
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 "From CCPN project: '1i6y'" . . . . distance "general distance" . 73 rr_1i6y 1
2 "From CCPN project: '1i6y'" . . . . "dihedral angle" "Not applicable" . 9 rr_1i6y 1
stop_
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 1i6y.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 2 distance NOE simple 117 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 10 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 4 "coupling constant" "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 5 "chemical shift" "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . XPLOR/CNS 6 "chemical shift" "Not applicable" "Not applicable" 0 rr_1i6y 1
1 1i6y.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1i6y 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_1i6y
_Gen_dist_constraint_list.ID 1
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 2
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . rr_1i6y 1
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 2 2 CYS HA H . . . 1 1 2 2 CYS H H . . . . . 5.0 1.8 5.00 . . . . . A . 2 CYS HA . . A . 2 CYS H . . . 3 . HA . . . . . 3 . HN . . rr_1i6y 1
2 1 OR . 1 1 2 2 CYS H H . . . 1 1 2 2 CYS HB2 H . . . . . 3.3 1.8 4.18 . . . . . A . 2 CYS H . . A . 2 CYS HB2 . . . 3 . HN . . . . . 3 . HB* . . rr_1i6y 1
2 2 OR . 1 1 2 2 CYS HB3 H . . . 1 1 2 2 CYS H H . . . . . 3.3 1.8 4.18 . . . . . A . 2 CYS HB3 . . A . 2 CYS H . . . 3 . HB* . . . . . 3 . HN . . rr_1i6y 1
3 1 . . 1 1 2 2 CYS HA H . . . 1 1 3 3 ARG HA H . . . . . 5.0 1.8 5.00 . . . . . A . 2 CYS HA . . A . 3 ARG HA . . . 3 . HA . . . . . 4 . HA . . rr_1i6y 1
4 1 . . 1 1 2 2 CYS HA H . . . 1 1 3 3 ARG HG3 H . . . . . 5.0 1.8 6.53 . . . . . A . 2 CYS HA . . A . 3 ARG HG3 . . . 3 . HA . . . . . 4 . HG1* . . rr_1i6y 1
5 1 OR . 1 1 3 3 ARG HA H . . . 1 1 3 3 ARG HG2 H . . . . . 2.7 1.8 3.96 . . . . . A . 3 ARG HA . . A . 3 ARG HG2 . . . 4 . HA . . . . . 4 . HG** . . rr_1i6y 1
5 2 OR . 1 1 3 3 ARG HA H . . . 1 1 3 3 ARG HG3 H . . . . . 2.7 1.8 3.96 . . . . . A . 3 ARG HA . . A . 3 ARG HG3 . . . 4 . HA . . . . . 4 . HG** . . rr_1i6y 1
6 1 . . 1 1 2 2 CYS HA H . . . 1 1 3 3 ARG H H . . . . . 3.3 1.8 3.30 . . . . . A . 2 CYS HA . . A . 3 ARG H . . . 3 . HA . . . . . 4 . HN . . rr_1i6y 1
7 1 OR . 1 1 3 3 ARG H H . . . 1 1 2 2 CYS HB2 H . . . . . 3.3 1.8 4.18 . . . . . A . 3 ARG H . . A . 2 CYS HB2 . . . 4 . HN . . . . . 3 . HB* . . rr_1i6y 1
7 2 OR . 1 1 2 2 CYS HB3 H . . . 1 1 3 3 ARG H H . . . . . 3.3 1.8 4.18 . . . . . A . 2 CYS HB3 . . A . 3 ARG H . . . 3 . HB* . . . . . 4 . HN . . rr_1i6y 1
8 1 . . 1 1 2 2 CYS H H . . . 1 1 3 3 ARG H H . . . . . 5.0 1.8 5.00 . . . . . A . 2 CYS H . . A . 3 ARG H . . . 3 . HN . . . . . 4 . HN . . rr_1i6y 1
9 1 . . 1 1 3 3 ARG HA H . . . 1 1 3 3 ARG H H . . . . . 5.0 1.8 5.00 . . . . . A . 3 ARG HA . . A . 3 ARG H . . . 4 . HA . . . . . 4 . HN . . rr_1i6y 1
10 1 OR . 1 1 3 3 ARG H H . . . 1 1 3 3 ARG HG2 H . . . . . 5.0 1.8 7.23 . . . . . A . 3 ARG H . . A . 3 ARG HG2 . . . 4 . HN . . . . . 4 . HG** . . rr_1i6y 1
10 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 3 3 ARG H H . . . . . 5.0 1.8 7.23 . . . . . A . 3 ARG HG3 . . A . 3 ARG H . . . 4 . HG** . . . . . 4 . HN . . rr_1i6y 1
11 1 OR . 1 1 3 3 ARG H H . . . 1 1 4 4 VAL MG1 H . . . . . 6.0 3.0 8.81 . . . . . A . 3 ARG H . . A . 4 VAL MG1 . . . 4 . HN . . . . . 5 . HG** . . rr_1i6y 1
11 2 OR . 1 1 3 3 ARG H H . . . 1 1 4 4 VAL MG2 H . . . . . 6.0 3.0 8.81 . . . . . A . 3 ARG H . . A . 4 VAL MG2 . . . 4 . HN . . . . . 5 . HG** . . rr_1i6y 1
12 1 . . 1 1 3 3 ARG H H . . . 1 1 4 4 VAL H H . . . . . 5.0 1.8 5.00 . . . . . A . 3 ARG H . . A . 4 VAL H . . . 4 . HN . . . . . 5 . HN . . rr_1i6y 1
13 1 OR . 1 1 4 4 VAL HA H . . . 1 1 4 4 VAL MG1 H . . . . . 2.7 1.8 3.96 . . . . . A . 4 VAL HA . . A . 4 VAL MG1 . . . 5 . HA . . . . . 5 . HG** . . rr_1i6y 1
13 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 4 4 VAL HA H . . . . . 2.7 1.8 3.96 . . . . . A . 4 VAL MG2 . . A . 4 VAL HA . . . 5 . HG** . . . . . 5 . HA . . rr_1i6y 1
14 1 OR . 1 1 5 5 VAL HA H . . . 1 1 4 4 VAL MG1 H . . . . . 6.0 3.0 8.81 . . . . . A . 5 VAL HA . . A . 4 VAL MG1 . . . 6 . HA . . . . . 5 . HG** . . rr_1i6y 1
14 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 5 5 VAL HA H . . . . . 6.0 3.0 8.81 . . . . . A . 4 VAL MG2 . . A . 5 VAL HA . . . 5 . HG** . . . . . 6 . HA . . rr_1i6y 1
15 1 OR . 1 1 4 4 VAL MG2 H . . . 1 1 5 5 VAL MG1 H . . . . . 3.3 1.8 6.94 . . . . . A . 4 VAL MG2 . . A . 5 VAL MG1 . . . 5 . HG** . . . . . 6 . HG* . . rr_1i6y 1
15 2 OR . 1 1 4 4 VAL MG1 H . . . 1 1 5 5 VAL MG1 H . . . . . 3.3 1.8 6.94 . . . . . A . 4 VAL MG1 . . A . 5 VAL MG1 . . . 5 . HG** . . . . . 6 . HG* . . rr_1i6y 1
15 3 OR . 1 1 5 5 VAL MG2 H . . . 1 1 4 4 VAL MG1 H . . . . . 3.3 1.8 6.94 . . . . . A . 5 VAL MG2 . . A . 4 VAL MG1 . . . 6 . HG* . . . . . 5 . HG** . . rr_1i6y 1
15 4 OR . 1 1 4 4 VAL MG2 H . . . 1 1 5 5 VAL MG2 H . . . . . 3.3 1.8 6.94 . . . . . A . 4 VAL MG2 . . A . 5 VAL MG2 . . . 5 . HG** . . . . . 6 . HG* . . rr_1i6y 1
16 1 . . 1 1 3 3 ARG HA H . . . 1 1 4 4 VAL H H . . . . . 3.3 1.8 3.30 . . . . . A . 3 ARG HA . . A . 4 VAL H . . . 4 . HA . . . . . 5 . HN . . rr_1i6y 1
17 1 OR . 1 1 4 4 VAL H H . . . 1 1 3 3 ARG HG2 H . . . . . 5.0 1.8 7.81 . . . . . A . 4 VAL H . . A . 3 ARG HG2 . . . 5 . HN . . . . . 4 . HG** . . rr_1i6y 1
17 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 4 4 VAL H H . . . . . 5.0 1.8 7.81 . . . . . A . 3 ARG HG3 . . A . 4 VAL H . . . 4 . HG** . . . . . 5 . HN . . rr_1i6y 1
18 1 . . 1 1 4 4 VAL H H . . . 1 1 4 4 VAL HA H . . . . . 5.0 1.8 5.00 . . . . . A . 4 VAL H . . A . 4 VAL HA . . . 5 . HN . . . . . 5 . HA . . rr_1i6y 1
19 1 . . 1 1 4 4 VAL H H . . . 1 1 4 4 VAL HB H . . . . . 3.3 1.8 3.30 . . . . . A . 4 VAL H . . A . 4 VAL HB . . . 5 . HN . . . . . 5 . HB . . rr_1i6y 1
20 1 OR . 1 1 4 4 VAL H H . . . 1 1 4 4 VAL MG1 H . . . . . 3.3 1.8 5.53 . . . . . A . 4 VAL H . . A . 4 VAL MG1 . . . 5 . HN . . . . . 5 . HG** . . rr_1i6y 1
20 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 4 4 VAL H H . . . . . 3.3 1.8 5.53 . . . . . A . 4 VAL MG2 . . A . 4 VAL H . . . 5 . HG** . . . . . 5 . HN . . rr_1i6y 1
21 1 . . 1 1 4 4 VAL H H . . . 1 1 5 5 VAL H H . . . . . 5.0 1.8 5.00 . . . . . A . 4 VAL H . . A . 5 VAL H . . . 5 . HN . . . . . 6 . HN . . rr_1i6y 1
22 1 OR . 1 1 5 5 VAL HA H . . . 1 1 5 5 VAL MG1 H . . . . . 3.3 1.8 3.92 . . . . . A . 5 VAL HA . . A . 5 VAL MG1 . . . 6 . HA . . . . . 6 . HG* . . rr_1i6y 1
22 2 OR . 1 1 5 5 VAL HA H . . . 1 1 5 5 VAL MG2 H . . . . . 3.3 1.8 3.92 . . . . . A . 5 VAL HA . . A . 5 VAL MG2 . . . 6 . HA . . . . . 6 . HG* . . rr_1i6y 1
23 1 . . 1 1 4 4 VAL HA H . . . 1 1 5 5 VAL H H . . . . . 3.3 1.8 3.30 . . . . . A . 4 VAL HA . . A . 5 VAL H . . . 5 . HA . . . . . 6 . HN . . rr_1i6y 1
24 1 . . 1 1 4 4 VAL HB H . . . 1 1 5 5 VAL H H . . . . . 3.3 1.8 3.30 . . . . . A . 4 VAL HB . . A . 5 VAL H . . . 5 . HB . . . . . 6 . HN . . rr_1i6y 1
25 1 OR . 1 1 5 5 VAL H H . . . 1 1 4 4 VAL MG1 H . . . . . 3.3 1.8 6.11 . . . . . A . 5 VAL H . . A . 4 VAL MG1 . . . 6 . HN . . . . . 5 . HG** . . rr_1i6y 1
25 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 5 5 VAL H H . . . . . 3.3 1.8 6.11 . . . . . A . 4 VAL MG2 . . A . 5 VAL H . . . 5 . HG** . . . . . 6 . HN . . rr_1i6y 1
26 1 . . 1 1 5 5 VAL HA H . . . 1 1 5 5 VAL H H . . . . . 3.3 1.8 3.30 . . . . . A . 5 VAL HA . . A . 5 VAL H . . . 6 . HA . . . . . 6 . HN . . rr_1i6y 1
27 1 . . 1 1 5 5 VAL H H . . . 1 1 5 5 VAL HB H . . . . . 3.3 1.8 3.92 . . . . . A . 5 VAL H . . A . 5 VAL HB . . . 6 . HN . . . . . 6 . HB* . . rr_1i6y 1
28 1 OR . 1 1 5 5 VAL H H . . . 1 1 5 5 VAL MG1 H . . . . . 5.0 1.8 5.88 . . . . . A . 5 VAL H . . A . 5 VAL MG1 . . . 6 . HN . . . . . 6 . HG* . . rr_1i6y 1
28 2 OR . 1 1 5 5 VAL MG2 H . . . 1 1 5 5 VAL H H . . . . . 5.0 1.8 5.88 . . . . . A . 5 VAL MG2 . . A . 5 VAL H . . . 6 . HG* . . . . . 6 . HN . . rr_1i6y 1
29 1 . . 1 1 5 5 VAL HA H . . . 1 1 6 6 ARG H H . . . . . 3.3 1.8 3.30 . . . . . A . 5 VAL HA . . A . 6 ARG H . . . 6 . HA . . . . . 7 . HN . . rr_1i6y 1
30 1 . . 1 1 5 5 VAL HB H . . . 1 1 6 6 ARG H H . . . . . 5.0 1.8 5.88 . . . . . A . 5 VAL HB . . A . 6 ARG H . . . 6 . HB* . . . . . 7 . HN . . rr_1i6y 1
31 1 OR . 1 1 6 6 ARG H H . . . 1 1 5 5 VAL MG1 H . . . . . 6.0 3.0 6.88 . . . . . A . 6 ARG H . . A . 5 VAL MG1 . . . 7 . HN . . . . . 6 . HG* . . rr_1i6y 1
31 2 OR . 1 1 5 5 VAL MG2 H . . . 1 1 6 6 ARG H H . . . . . 6.0 3.0 6.88 . . . . . A . 5 VAL MG2 . . A . 6 ARG H . . . 6 . HG* . . . . . 7 . HN . . rr_1i6y 1
32 1 . . 1 1 5 5 VAL H H . . . 1 1 6 6 ARG H H . . . . . 5.0 1.8 5.00 . . . . . A . 5 VAL H . . A . 6 ARG H . . . 6 . HN . . . . . 7 . HN . . rr_1i6y 1
33 1 . . 1 1 6 6 ARG H H . . . 1 1 6 6 ARG HA H . . . . . 2.7 1.8 3.22 . . . . . A . 6 ARG H . . A . 6 ARG HA . . . 7 . HN . . . . . 7 . HA* . . rr_1i6y 1
34 1 . . 1 1 6 6 ARG HA H . . . 1 1 7 7 GLY H H . . . . . 5.0 1.8 5.80 . . . . . A . 6 ARG HA . . A . 7 GLY H . . . 7 . HA* . . . . . 8 . HN . . rr_1i6y 1
35 1 . . 1 1 6 6 ARG H H . . . 1 1 7 7 GLY H H . . . . . 3.3 1.8 3.30 . . . . . A . 6 ARG H . . A . 7 GLY H . . . 7 . HN . . . . . 8 . HN . . rr_1i6y 1
36 1 . . 1 1 7 7 GLY H H . . . 1 1 8 8 ASP H H . . . . . 3.3 1.8 3.30 . . . . . A . 7 GLY H . . A . 8 ASP H . . . 8 . HN . . . . . 9 . HN . . rr_1i6y 1
37 1 . . 1 1 8 8 ASP H H . . . 1 1 8 8 ASP HA H . . . . . 3.3 1.8 3.30 . . . . . A . 8 ASP H . . A . 8 ASP HA . . . 9 . HN . . . . . 9 . HA . . rr_1i6y 1
38 1 OR . 1 1 8 8 ASP H H . . . 1 1 8 8 ASP HB2 H . . . . . 2.7 1.8 3.32 . . . . . A . 8 ASP H . . A . 8 ASP HB2 . . . 9 . HN . . . . . 9 . HB* . . rr_1i6y 1
38 2 OR . 1 1 8 8 ASP H H . . . 1 1 8 8 ASP HB3 H . . . . . 2.7 1.8 3.32 . . . . . A . 8 ASP H . . A . 8 ASP HB3 . . . 9 . HN . . . . . 9 . HB* . . rr_1i6y 1
39 1 . . 1 1 8 8 ASP H H . . . 1 1 9 9 TYR H H . . . . . 5.0 1.8 5.00 . . . . . A . 8 ASP H . . A . 9 TYR H . . . 9 . HN . . . . . 10 . HN . . rr_1i6y 1
40 1 . . 1 1 9 9 TYR QD H . . . 1 1 9 9 TYR HA H . . . . . 3.3 1.8 4.88 . . . . . A . 9 TYR QD . . A . 9 TYR HA . . . 10 . HD** . . . . . 10 . HA . . rr_1i6y 1
41 1 . . 1 1 8 8 ASP HA H . . . 1 1 9 9 TYR H H . . . . . 3.3 1.8 3.30 . . . . . A . 8 ASP HA . . A . 9 TYR H . . . 9 . HA . . . . . 10 . HN . . rr_1i6y 1
42 1 OR . 1 1 9 9 TYR H H . . . 1 1 8 8 ASP HB2 H . . . . . 3.3 1.8 4.18 . . . . . A . 9 TYR H . . A . 8 ASP HB2 . . . 10 . HN . . . . . 9 . HB* . . rr_1i6y 1
42 2 OR . 1 1 8 8 ASP HB3 H . . . 1 1 9 9 TYR H H . . . . . 3.3 1.8 4.18 . . . . . A . 8 ASP HB3 . . A . 9 TYR H . . . 9 . HB* . . . . . 10 . HN . . rr_1i6y 1
43 1 . . 1 1 9 9 TYR H H . . . 1 1 9 9 TYR HA H . . . . . 5.0 1.8 5.00 . . . . . A . 9 TYR H . . A . 9 TYR HA . . . 10 . HN . . . . . 10 . HA . . rr_1i6y 1
44 1 OR . 1 1 9 9 TYR H H . . . 1 1 9 9 TYR HB2 H . . . . . 3.3 1.8 3.95 . . . . . A . 9 TYR H . . A . 9 TYR HB2 . . . 10 . HN . . . . . 10 . HB* . . rr_1i6y 1
44 2 OR . 1 1 9 9 TYR H H . . . 1 1 9 9 TYR HB3 H . . . . . 3.3 1.8 3.95 . . . . . A . 9 TYR H . . A . 9 TYR HB3 . . . 10 . HN . . . . . 10 . HB* . . rr_1i6y 1
45 1 . . 1 1 9 9 TYR QD H . . . 1 1 9 9 TYR H H . . . . . 5.0 1.8 7.81 . . . . . A . 9 TYR QD . . A . 9 TYR H . . . 10 . HD** . . . . . 10 . HN . . rr_1i6y 1
46 1 . . 1 1 9 9 TYR H H . . . 1 1 10 10 LEU H H . . . . . 5.0 1.8 5.00 . . . . . A . 9 TYR H . . A . 10 LEU H . . . 10 . HN . . . . . 11 . HN . . rr_1i6y 1
47 1 . . 1 1 9 9 TYR HA H . . . 1 1 10 10 LEU H H . . . . . 3.3 1.8 3.30 . . . . . A . 9 TYR HA . . A . 10 LEU H . . . 10 . HA . . . . . 11 . HN . . rr_1i6y 1
48 1 . . 1 1 9 9 TYR QD H . . . 1 1 10 10 LEU H H . . . . . 5.0 1.8 7.81 . . . . . A . 9 TYR QD . . A . 10 LEU H . . . 10 . HD** . . . . . 11 . HN . . rr_1i6y 1
49 1 . . 1 1 10 10 LEU H H . . . 1 1 10 10 LEU HA H . . . . . 3.3 1.8 3.30 . . . . . A . 10 LEU H . . A . 10 LEU HA . . . 11 . HN . . . . . 11 . HA . . rr_1i6y 1
50 1 OR . 1 1 10 10 LEU H H . . . 1 1 10 10 LEU HB2 H . . . . . 3.3 1.8 4.18 . . . . . A . 10 LEU H . . A . 10 LEU HB2 . . . 11 . HN . . . . . 11 . HB* . . rr_1i6y 1
50 2 OR . 1 1 10 10 LEU H H . . . 1 1 10 10 LEU HB3 H . . . . . 3.3 1.8 4.18 . . . . . A . 10 LEU H . . A . 10 LEU HB3 . . . 11 . HN . . . . . 11 . HB* . . rr_1i6y 1
51 1 OR . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HB2 H . . . . . 3.3 1.8 4.18 . . . . . A . 11 ASP H . . A . 11 ASP HB2 . . . 12 . HN . . . . . 12 . HB* . . rr_1i6y 1
51 2 OR . 1 1 11 11 ASP HB3 H . . . 1 1 11 11 ASP H H . . . . . 3.3 1.8 4.18 . . . . . A . 11 ASP HB3 . . A . 11 ASP H . . . 12 . HB* . . . . . 12 . HN . . rr_1i6y 1
52 1 OR . 1 1 6 6 ARG HA H . . . 1 1 3 3 ARG HG2 H . . . . . 5.0 1.8 8.41 . . . . . A . 6 ARG HA . . A . 3 ARG HG2 . . . 7 . HA* . . . . . 4 . HG** . . rr_1i6y 1
52 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 6 6 ARG HA H . . . . . 5.0 1.8 8.41 . . . . . A . 3 ARG HG3 . . A . 6 ARG HA . . . 4 . HG** . . . . . 7 . HA* . . rr_1i6y 1
53 1 OR . 1 1 4 4 VAL MG2 H . . . 1 1 10 10 LEU HB2 H . . . . . 5.0 1.8 8.41 . . . . . A . 4 VAL MG2 . . A . 10 LEU HB2 . . . 5 . HG** . . . . . 11 . HB* . . rr_1i6y 1
53 2 OR . 1 1 4 4 VAL MG1 H . . . 1 1 10 10 LEU HB2 H . . . . . 5.0 1.8 8.41 . . . . . A . 4 VAL MG1 . . A . 10 LEU HB2 . . . 5 . HG** . . . . . 11 . HB* . . rr_1i6y 1
53 3 OR . 1 1 10 10 LEU HB3 H . . . 1 1 4 4 VAL MG1 H . . . . . 5.0 1.8 8.41 . . . . . A . 10 LEU HB3 . . A . 4 VAL MG1 . . . 11 . HB* . . . . . 5 . HG** . . rr_1i6y 1
53 4 OR . 1 1 4 4 VAL MG2 H . . . 1 1 10 10 LEU HB3 H . . . . . 5.0 1.8 8.41 . . . . . A . 4 VAL MG2 . . A . 10 LEU HB3 . . . 5 . HG** . . . . . 11 . HB* . . rr_1i6y 1
54 1 . . 1 1 4 4 VAL H H . . . 1 1 7 7 GLY H H . . . . . 5.0 1.8 5.00 . . . . . A . 4 VAL H . . A . 7 GLY H . . . 5 . HN . . . . . 8 . HN . . rr_1i6y 1
55 1 OR . 1 1 5 5 VAL H H . . . 1 1 3 3 ARG HG2 H . . . . . 6.0 3.0 8.81 . . . . . A . 5 VAL H . . A . 3 ARG HG2 . . . 6 . HN . . . . . 4 . HG** . . rr_1i6y 1
55 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 5 5 VAL H H . . . . . 6.0 3.0 8.81 . . . . . A . 3 ARG HG3 . . A . 5 VAL H . . . 4 . HG** . . . . . 6 . HN . . rr_1i6y 1
56 1 OR . 1 1 6 6 ARG H H . . . 1 1 3 3 ARG HG2 H . . . . . 5.0 1.8 7.81 . . . . . A . 6 ARG H . . A . 3 ARG HG2 . . . 7 . HN . . . . . 4 . HG** . . rr_1i6y 1
56 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 6 6 ARG H H . . . . . 5.0 1.8 7.81 . . . . . A . 3 ARG HG3 . . A . 6 ARG H . . . 4 . HG** . . . . . 7 . HN . . rr_1i6y 1
57 1 . . 1 1 4 4 VAL HA H . . . 1 1 6 6 ARG H H . . . . . 6.0 3.0 6.00 . . . . . A . 4 VAL HA . . A . 6 ARG H . . . 5 . HA . . . . . 7 . HN . . rr_1i6y 1
58 1 OR . 1 1 6 6 ARG H H . . . 1 1 4 4 VAL MG1 H . . . . . 6.0 3.0 8.81 . . . . . A . 6 ARG H . . A . 4 VAL MG1 . . . 7 . HN . . . . . 5 . HG** . . rr_1i6y 1
58 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 6 6 ARG H H . . . . . 6.0 3.0 8.81 . . . . . A . 4 VAL MG2 . . A . 6 ARG H . . . 5 . HG** . . . . . 7 . HN . . rr_1i6y 1
59 1 OR . 1 1 7 7 GLY H H . . . 1 1 3 3 ARG HG2 H . . . . . 5.0 1.8 7.81 . . . . . A . 7 GLY H . . A . 3 ARG HG2 . . . 8 . HN . . . . . 4 . HG** . . rr_1i6y 1
59 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 7 7 GLY H H . . . . . 5.0 1.8 7.81 . . . . . A . 3 ARG HG3 . . A . 7 GLY H . . . 4 . HG** . . . . . 8 . HN . . rr_1i6y 1
60 1 OR . 1 1 7 7 GLY H H . . . 1 1 4 4 VAL MG1 H . . . . . 6.0 3.0 8.81 . . . . . A . 7 GLY H . . A . 4 VAL MG1 . . . 8 . HN . . . . . 5 . HG** . . rr_1i6y 1
60 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 7 7 GLY H H . . . . . 6.0 3.0 8.81 . . . . . A . 4 VAL MG2 . . A . 7 GLY H . . . 5 . HG** . . . . . 8 . HN . . rr_1i6y 1
61 1 . . 1 1 5 5 VAL HA H . . . 1 1 7 7 GLY H H . . . . . 6.0 3.0 6.00 . . . . . A . 5 VAL HA . . A . 7 GLY H . . . 6 . HA . . . . . 8 . HN . . rr_1i6y 1
62 1 OR . 1 1 8 8 ASP H H . . . 1 1 3 3 ARG HG2 H . . . . . 5.0 1.8 7.81 . . . . . A . 8 ASP H . . A . 3 ARG HG2 . . . 9 . HN . . . . . 4 . HG** . . rr_1i6y 1
62 2 OR . 1 1 3 3 ARG HG3 H . . . 1 1 8 8 ASP H H . . . . . 5.0 1.8 7.81 . . . . . A . 3 ARG HG3 . . A . 8 ASP H . . . 4 . HG** . . . . . 9 . HN . . rr_1i6y 1
63 1 OR . 1 1 8 8 ASP H H . . . 1 1 4 4 VAL MG1 H . . . . . 6.0 3.0 8.81 . . . . . A . 8 ASP H . . A . 4 VAL MG1 . . . 9 . HN . . . . . 5 . HG** . . rr_1i6y 1
63 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 8 8 ASP H H . . . . . 6.0 3.0 8.81 . . . . . A . 4 VAL MG2 . . A . 8 ASP H . . . 5 . HG** . . . . . 9 . HN . . rr_1i6y 1
64 1 . . 1 1 4 4 VAL H H . . . 1 1 8 8 ASP H H . . . . . 6.0 3.0 6.00 . . . . . A . 4 VAL H . . A . 8 ASP H . . . 5 . HN . . . . . 9 . HN . . rr_1i6y 1
65 1 OR . 1 1 2 2 CYS HB2 H . . . 1 1 9 9 TYR HB2 H . . . . . 6.0 3.0 8.06 . . . . . A . 2 CYS HB2 . . A . 9 TYR HB2 . . . 3 . HB* . . . . . 10 . HB* . . rr_1i6y 1
65 2 OR . 1 1 2 2 CYS HB3 H . . . 1 1 9 9 TYR HB2 H . . . . . 6.0 3.0 8.06 . . . . . A . 2 CYS HB3 . . A . 9 TYR HB2 . . . 3 . HB* . . . . . 10 . HB* . . rr_1i6y 1
65 3 OR . 1 1 9 9 TYR HB3 H . . . 1 1 2 2 CYS HB2 H . . . . . 6.0 3.0 8.06 . . . . . A . 9 TYR HB3 . . A . 2 CYS HB2 . . . 10 . HB* . . . . . 3 . HB* . . rr_1i6y 1
65 4 OR . 1 1 2 2 CYS HB3 H . . . 1 1 9 9 TYR HB3 H . . . . . 6.0 3.0 8.06 . . . . . A . 2 CYS HB3 . . A . 9 TYR HB3 . . . 3 . HB* . . . . . 10 . HB* . . rr_1i6y 1
66 1 OR . 1 1 9 9 TYR QD H . . . 1 1 2 2 CYS HB2 H . . . . . 6.0 3.0 8.81 . . . . . A . 9 TYR QD . . A . 2 CYS HB2 . . . 10 . HD** . . . . . 3 . HB* . . rr_1i6y 1
66 2 OR . 1 1 2 2 CYS HB3 H . . . 1 1 9 9 TYR QD H . . . . . 6.0 3.0 8.81 . . . . . A . 2 CYS HB3 . . A . 9 TYR QD . . . 3 . HB* . . . . . 10 . HD** . . rr_1i6y 1
67 1 . . 1 1 3 3 ARG HA H . . . 1 1 9 9 TYR QD H . . . . . 5.0 1.8 7.81 . . . . . A . 3 ARG HA . . A . 9 TYR QD . . . 4 . HA . . . . . 10 . HD** . . rr_1i6y 1
68 1 . . 1 1 2 2 CYS H H . . . 1 1 9 9 TYR H H . . . . . 6.0 3.0 6.00 . . . . . A . 2 CYS H . . A . 9 TYR H . . . 3 . HN . . . . . 10 . HN . . rr_1i6y 1
69 1 . . 1 1 3 3 ARG HA H . . . 1 1 9 9 TYR H H . . . . . 6.0 3.0 6.00 . . . . . A . 3 ARG HA . . A . 9 TYR H . . . 4 . HA . . . . . 10 . HN . . rr_1i6y 1
70 1 OR . 1 1 9 9 TYR H H . . . 1 1 4 4 VAL MG1 H . . . . . 6.0 3.0 8.81 . . . . . A . 9 TYR H . . A . 4 VAL MG1 . . . 10 . HN . . . . . 5 . HG** . . rr_1i6y 1
70 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 9 9 TYR H H . . . . . 6.0 3.0 8.81 . . . . . A . 4 VAL MG2 . . A . 9 TYR H . . . 5 . HG** . . . . . 10 . HN . . rr_1i6y 1
71 1 OR . 1 1 10 10 LEU H H . . . 1 1 4 4 VAL MG1 H . . . . . 5.0 1.8 7.81 . . . . . A . 10 LEU H . . A . 4 VAL MG1 . . . 11 . HN . . . . . 5 . HG** . . rr_1i6y 1
71 2 OR . 1 1 4 4 VAL MG2 H . . . 1 1 10 10 LEU H H . . . . . 5.0 1.8 7.81 . . . . . A . 4 VAL MG2 . . A . 10 LEU H . . . 5 . HG** . . . . . 11 . HN . . rr_1i6y 1
72 1 . . 1 1 7 7 GLY H H . . . 1 1 4 4 VAL O O . . . . . 2.3 1.5 2.30 . . . . . A . 7 GLY H . . A . 4 VAL O . . . 8 . HN . . . . . 5 . O . . rr_1i6y 1
73 1 . . 1 1 4 4 VAL O O . . . 1 1 7 7 GLY N N . . . . . 3.3 2.4 3.30 . . . . . A . 4 VAL O . . A . 7 GLY N . . . 5 . O . . . . . 8 . N . . rr_1i6y 1
stop_
loop_
_Gen_dist_constraint_comment_org.ID
_Gen_dist_constraint_comment_org.Comment_text
_Gen_dist_constraint_comment_org.Comment_begin_line
_Gen_dist_constraint_comment_org.Comment_begin_column
_Gen_dist_constraint_comment_org.Comment_end_line
_Gen_dist_constraint_comment_org.Comment_end_column
_Gen_dist_constraint_comment_org.Entry_ID
_Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID
1
;A1 NOE_constraints
C1
;
1 1 2 4 rr_1i6y 1
2 R2 5 1 5 4 rr_1i6y 1
3 V3 16 1 16 4 rr_1i6y 1
4 V4 29 1 29 4 rr_1i6y 1
5 R5 40 1 40 4 rr_1i6y 1
6 G6 51 1 51 4 rr_1i6y 1
7 D7 57 1 57 4 rr_1i6y 1
8 Y8 63 1 63 4 rr_1i6y 1
9 L9 78 1 78 4 rr_1i6y 1
10 D10 87 1 87 5 rr_1i6y 1
11 C11 92 1 92 5 rr_1i6y 1
12 "long rang" 97 1 97 11 rr_1i6y 1
stop_
loop_
_Gen_dist_constraint_conv_err.ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID
_Gen_dist_constraint_conv_err.Parse_file_constraint_ID
_Gen_dist_constraint_conv_err.Conv_error_type
_Gen_dist_constraint_conv_err.Conv_error_note
_Gen_dist_constraint_conv_err.Entry_ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID
1 2 1 1 "Not handling restraint 1, item 1, resonance(s) ' .2.HN' (nmrStar names),' .1.HA*' (nmrStar names) not linked" rr_1i6y 1
2 2 2 1 "Not handling restraint 2, item 1, resonance(s) ' .2.HN' (nmrStar names),' .2.HB*' (nmrStar names) not linked" rr_1i6y 1
3 2 3 1 "Not handling restraint 3, item 1, resonance(s) ' .3.HD*' (nmrStar names) not linked" rr_1i6y 1
4 2 3 1 "Not handling restraint 3, item 1, resonance(s) ' .3.HD*' (nmrStar names) not linked" rr_1i6y 1
5 2 4 1 "Not handling restraint 4, item 1, resonance(s) ' .3.HG*' (nmrStar names) not linked" rr_1i6y 1
6 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .3.HE' (nmrStar names) not linked" rr_1i6y 1
7 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .3.HE' (nmrStar names) not linked" rr_1i6y 1
8 2 6 1 "Not handling restraint 6, item 1, resonance(s) ' .3.HG*' (nmrStar names),' .3.HE' (nmrStar names) not linked" rr_1i6y 1
9 2 9 1 "Not handling restraint 9, item 1, resonance(s) ' .3.HG*' (nmrStar names) not linked" rr_1i6y 1
10 2 10 1 "Not handling restraint 10, item 1, resonance(s) ' .3.HD*' (nmrStar names) not linked" rr_1i6y 1
11 2 11 1 "Not handling restraint 11, item 1, resonance(s) ' .2.HA' (nmrStar names) not linked" rr_1i6y 1
12 2 12 1 "Not handling restraint 12, item 1, resonance(s) ' .2.HB*' (nmrStar names) not linked" rr_1i6y 1
13 2 18 1 "Not handling restraint 18, item 1, resonance(s) ' .3.HG*' (nmrStar names) not linked" rr_1i6y 1
14 2 21 1 "Not handling restraint 21, item 1, resonance(s) ' .4.HB' (nmrStar names) not linked" rr_1i6y 1
15 2 29 1 "Not handling restraint 29, item 1, resonance(s) ' .4.HB' (nmrStar names) not linked" rr_1i6y 1
16 2 35 1 "Not handling restraint 35, item 1, resonance(s) ' .6.HD*' (nmrStar names) not linked" rr_1i6y 1
17 2 37 1 "Not handling restraint 37, item 1, resonance(s) ' .6.HE' (nmrStar names) not linked" rr_1i6y 1
18 2 38 1 "Not handling restraint 38, item 1, resonance(s) ' .6.HE' (nmrStar names) not linked" rr_1i6y 1
19 2 38 1 "Not handling restraint 38, item 1, resonance(s) ' .6.HE' (nmrStar names) not linked" rr_1i6y 1
20 2 52 1 "Not handling restraint 52, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
21 2 53 1 "Not handling restraint 53, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
22 2 55 1 "Not handling restraint 55, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
23 2 56 1 "Not handling restraint 56, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
24 2 56 1 "Not handling restraint 56, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
25 2 57 1 "Not handling restraint 57, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
26 2 58 1 "Not handling restraint 58, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
27 2 59 1 "Not handling restraint 59, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
28 2 59 1 "Not handling restraint 59, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
29 2 60 1 "Not handling restraint 60, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
30 2 61 1 "Not handling restraint 61, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
31 2 62 1 "Not handling restraint 62, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
32 2 63 1 "Not handling restraint 63, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
33 2 64 1 "Not handling restraint 64, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
34 2 65 1 "Not handling restraint 65, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
35 2 69 1 "Not handling restraint 69, item 1, resonance(s) ' .10.HG*' (nmrStar names) not linked" rr_1i6y 1
36 2 81 1 "Not handling restraint 81, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" rr_1i6y 1
37 2 81 1 "Not handling restraint 81, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" rr_1i6y 1
38 2 82 1 "Not handling restraint 82, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" rr_1i6y 1
39 2 83 1 "Not handling restraint 83, item 1, resonance(s) ' .12.H2' (nmrStar names) not linked" rr_1i6y 1
40 2 86 1 "Not handling restraint 86, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
41 2 86 1 "Not handling restraint 86, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
42 2 88 1 "Not handling restraint 88, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
43 2 97 1 "Not handling restraint 97, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
44 2 97 1 "Not handling restraint 97, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
45 2 98 1 "Not handling restraint 98, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
46 2 99 1 "Not handling restraint 99, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
47 2 99 1 "Not handling restraint 99, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
48 2 100 1 "Not handling restraint 100, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
49 2 101 1 "Not handling restraint 101, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
50 2 101 1 "Not handling restraint 101, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
51 2 102 1 "Not handling restraint 102, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
52 2 102 1 "Not handling restraint 102, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
53 2 103 1 "Not handling restraint 103, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
54 2 103 1 "Not handling restraint 103, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
55 2 113 1 "Not handling restraint 113, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
56 2 115 1 "Not handling restraint 115, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_1i6y
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
loop_
_Distance_constraint_software.Software_ID
_Distance_constraint_software.Software_label
_Distance_constraint_software.Method_ID
_Distance_constraint_software.Method_label
_Distance_constraint_software.Entry_ID
_Distance_constraint_software.Distance_constraint_list_ID
. . . . rr_1i6y 1
stop_
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 . . . rr_1i6y 1
2 1 2 . OR rr_1i6y 1
2 2 . 3 . rr_1i6y 1
2 3 . . . rr_1i6y 1
3 1 . . . rr_1i6y 1
4 1 . . . rr_1i6y 1
5 1 2 . OR rr_1i6y 1
5 2 . 3 . rr_1i6y 1
5 3 . . . rr_1i6y 1
6 1 . . . rr_1i6y 1
7 1 2 . OR rr_1i6y 1
7 2 . 3 . rr_1i6y 1
7 3 . . . rr_1i6y 1
8 1 . . . rr_1i6y 1
9 1 . . . rr_1i6y 1
10 1 2 . OR rr_1i6y 1
10 2 . 3 . rr_1i6y 1
10 3 . . . rr_1i6y 1
11 1 2 . OR rr_1i6y 1
11 2 . 3 . rr_1i6y 1
11 3 . . . rr_1i6y 1
12 1 . . . rr_1i6y 1
13 1 2 . OR rr_1i6y 1
13 2 . 3 . rr_1i6y 1
13 3 . . . rr_1i6y 1
14 1 2 . OR rr_1i6y 1
14 2 . 3 . rr_1i6y 1
14 3 . . . rr_1i6y 1
15 1 2 . OR rr_1i6y 1
15 2 . 3 . rr_1i6y 1
15 3 . 4 . rr_1i6y 1
15 4 . 5 . rr_1i6y 1
15 5 . . . rr_1i6y 1
16 1 . . . rr_1i6y 1
17 1 2 . OR rr_1i6y 1
17 2 . 3 . rr_1i6y 1
17 3 . . . rr_1i6y 1
18 1 . . . rr_1i6y 1
19 1 . . . rr_1i6y 1
20 1 2 . OR rr_1i6y 1
20 2 . 3 . rr_1i6y 1
20 3 . . . rr_1i6y 1
21 1 . . . rr_1i6y 1
22 1 2 . OR rr_1i6y 1
22 2 . 3 . rr_1i6y 1
22 3 . . . rr_1i6y 1
23 1 . . . rr_1i6y 1
24 1 . . . rr_1i6y 1
25 1 2 . OR rr_1i6y 1
25 2 . 3 . rr_1i6y 1
25 3 . . . rr_1i6y 1
26 1 . . . rr_1i6y 1
27 1 . . . rr_1i6y 1
28 1 2 . OR rr_1i6y 1
28 2 . 3 . rr_1i6y 1
28 3 . . . rr_1i6y 1
29 1 . . . rr_1i6y 1
30 1 . . . rr_1i6y 1
31 1 2 . OR rr_1i6y 1
31 2 . 3 . rr_1i6y 1
31 3 . . . rr_1i6y 1
32 1 . . . rr_1i6y 1
33 1 . . . rr_1i6y 1
34 1 . . . rr_1i6y 1
35 1 . . . rr_1i6y 1
36 1 . . . rr_1i6y 1
37 1 . . . rr_1i6y 1
38 1 2 . OR rr_1i6y 1
38 2 . 3 . rr_1i6y 1
38 3 . . . rr_1i6y 1
39 1 . . . rr_1i6y 1
40 1 . . . rr_1i6y 1
41 1 . . . rr_1i6y 1
42 1 2 . OR rr_1i6y 1
42 2 . 3 . rr_1i6y 1
42 3 . . . rr_1i6y 1
43 1 . . . rr_1i6y 1
44 1 2 . OR rr_1i6y 1
44 2 . 3 . rr_1i6y 1
44 3 . . . rr_1i6y 1
45 1 . . . rr_1i6y 1
46 1 . . . rr_1i6y 1
47 1 . . . rr_1i6y 1
48 1 . . . rr_1i6y 1
49 1 . . . rr_1i6y 1
50 1 2 . OR rr_1i6y 1
50 2 . 3 . rr_1i6y 1
50 3 . . . rr_1i6y 1
51 1 2 . OR rr_1i6y 1
51 2 . 3 . rr_1i6y 1
51 3 . . . rr_1i6y 1
52 1 2 . OR rr_1i6y 1
52 2 . 3 . rr_1i6y 1
52 3 . . . rr_1i6y 1
53 1 2 . OR rr_1i6y 1
53 2 . 3 . rr_1i6y 1
53 3 . 4 . rr_1i6y 1
53 4 . 5 . rr_1i6y 1
53 5 . . . rr_1i6y 1
54 1 . . . rr_1i6y 1
55 1 2 . OR rr_1i6y 1
55 2 . 3 . rr_1i6y 1
55 3 . . . rr_1i6y 1
56 1 2 . OR rr_1i6y 1
56 2 . 3 . rr_1i6y 1
56 3 . . . rr_1i6y 1
57 1 . . . rr_1i6y 1
58 1 2 . OR rr_1i6y 1
58 2 . 3 . rr_1i6y 1
58 3 . . . rr_1i6y 1
59 1 2 . OR rr_1i6y 1
59 2 . 3 . rr_1i6y 1
59 3 . . . rr_1i6y 1
60 1 2 . OR rr_1i6y 1
60 2 . 3 . rr_1i6y 1
60 3 . . . rr_1i6y 1
61 1 . . . rr_1i6y 1
62 1 2 . OR rr_1i6y 1
62 2 . 3 . rr_1i6y 1
62 3 . . . rr_1i6y 1
63 1 2 . OR rr_1i6y 1
63 2 . 3 . rr_1i6y 1
63 3 . . . rr_1i6y 1
64 1 . . . rr_1i6y 1
65 1 2 . OR rr_1i6y 1
65 2 . 3 . rr_1i6y 1
65 3 . 4 . rr_1i6y 1
65 4 . 5 . rr_1i6y 1
65 5 . . . rr_1i6y 1
66 1 2 . OR rr_1i6y 1
66 2 . 3 . rr_1i6y 1
66 3 . . . rr_1i6y 1
67 1 . . . rr_1i6y 1
68 1 . . . rr_1i6y 1
69 1 . . . rr_1i6y 1
70 1 2 . OR rr_1i6y 1
70 2 . 3 . rr_1i6y 1
70 3 . . . rr_1i6y 1
71 1 2 . OR rr_1i6y 1
71 2 . 3 . rr_1i6y 1
71 3 . . . rr_1i6y 1
72 1 . . . rr_1i6y 1
73 1 . . . rr_1i6y 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Contribution_fractional_val
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Atom_type
_Dist_constraint.Atom_isotope_number
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_entity_assembly_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 2 CYS H H . . . . 3 . HN rr_1i6y 1
1 1 . 2 . 1 1 2 2 CYS HA H . . . . 3 . HA rr_1i6y 1
2 2 . 1 . 1 1 2 2 CYS H H . . . . 3 . HN rr_1i6y 1
2 2 . 2 . 1 1 2 2 CYS HB2 H . . . . 3 . HB* rr_1i6y 1
2 3 . 1 . 1 1 2 2 CYS H H . . . . 3 . HN rr_1i6y 1
2 3 . 2 . 1 1 2 2 CYS HB3 H . . . . 3 . HB* rr_1i6y 1
3 1 . 1 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
3 1 . 2 . 1 1 2 2 CYS HA H . . . . 3 . HA rr_1i6y 1
4 1 . 1 . 1 1 3 3 ARG HG3 H . . . . 4 . HG1* rr_1i6y 1
4 1 . 2 . 1 1 2 2 CYS HA H . . . . 3 . HA rr_1i6y 1
5 2 . 1 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
5 2 . 2 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
5 3 . 1 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
5 3 . 2 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
6 1 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
6 1 . 2 . 1 1 2 2 CYS HA H . . . . 3 . HA rr_1i6y 1
7 2 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
7 2 . 2 . 1 1 2 2 CYS HB2 H . . . . 3 . HB* rr_1i6y 1
7 3 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
7 3 . 2 . 1 1 2 2 CYS HB3 H . . . . 3 . HB* rr_1i6y 1
8 1 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
8 1 . 2 . 1 1 2 2 CYS H H . . . . 3 . HN rr_1i6y 1
9 1 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
9 1 . 2 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
10 2 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
10 2 . 2 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
10 3 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
10 3 . 2 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
11 2 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
11 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
11 3 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
11 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
12 1 . 1 . 1 1 3 3 ARG H H . . . . 4 . HN rr_1i6y 1
12 1 . 2 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
13 2 . 1 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
13 2 . 2 . 1 1 4 4 VAL HA H . . . . 5 . HA rr_1i6y 1
13 3 . 1 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
13 3 . 2 . 1 1 4 4 VAL HA H . . . . 5 . HA rr_1i6y 1
14 2 . 1 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
14 2 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
14 3 . 1 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
14 3 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
15 2 . 1 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
15 2 . 2 . 1 1 5 5 VAL MG1 H . . . . 6 . HG* rr_1i6y 1
15 3 . 1 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
15 3 . 2 . 1 1 5 5 VAL MG1 H . . . . 6 . HG* rr_1i6y 1
15 4 . 1 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
15 4 . 2 . 1 1 5 5 VAL MG2 H . . . . 6 . HG* rr_1i6y 1
15 5 . 1 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
15 5 . 2 . 1 1 5 5 VAL MG2 H . . . . 6 . HG* rr_1i6y 1
16 1 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
16 1 . 2 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
17 2 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
17 2 . 2 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
17 3 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
17 3 . 2 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
18 1 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
18 1 . 2 . 1 1 4 4 VAL HA H . . . . 5 . HA rr_1i6y 1
19 1 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
19 1 . 2 . 1 1 4 4 VAL HB H . . . . 5 . HB rr_1i6y 1
20 2 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
20 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
20 3 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
20 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
21 1 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
21 1 . 2 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
22 2 . 1 . 1 1 5 5 VAL MG1 H . . . . 6 . HG* rr_1i6y 1
22 2 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
22 3 . 1 . 1 1 5 5 VAL MG2 H . . . . 6 . HG* rr_1i6y 1
22 3 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
23 1 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
23 1 . 2 . 1 1 4 4 VAL HA H . . . . 5 . HA rr_1i6y 1
24 1 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
24 1 . 2 . 1 1 4 4 VAL HB H . . . . 5 . HB rr_1i6y 1
25 2 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
25 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
25 3 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
25 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
26 1 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
26 1 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
27 1 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
27 1 . 2 . 1 1 5 5 VAL HB H . . . . 6 . HB* rr_1i6y 1
28 2 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
28 2 . 2 . 1 1 5 5 VAL MG1 H . . . . 6 . HG* rr_1i6y 1
28 3 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
28 3 . 2 . 1 1 5 5 VAL MG2 H . . . . 6 . HG* rr_1i6y 1
29 1 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
29 1 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
30 1 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
30 1 . 2 . 1 1 5 5 VAL HB H . . . . 6 . HB* rr_1i6y 1
31 2 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
31 2 . 2 . 1 1 5 5 VAL MG1 H . . . . 6 . HG* rr_1i6y 1
31 3 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
31 3 . 2 . 1 1 5 5 VAL MG2 H . . . . 6 . HG* rr_1i6y 1
32 1 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
32 1 . 2 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
33 1 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
33 1 . 2 . 1 1 6 6 ARG HA H . . . . 7 . HA* rr_1i6y 1
34 1 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
34 1 . 2 . 1 1 6 6 ARG HA H . . . . 7 . HA* rr_1i6y 1
35 1 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
35 1 . 2 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
36 1 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
36 1 . 2 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
37 1 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
37 1 . 2 . 1 1 8 8 ASP HA H . . . . 9 . HA rr_1i6y 1
38 2 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
38 2 . 2 . 1 1 8 8 ASP HB2 H . . . . 9 . HB* rr_1i6y 1
38 3 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
38 3 . 2 . 1 1 8 8 ASP HB3 H . . . . 9 . HB* rr_1i6y 1
39 1 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
39 1 . 2 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
40 1 . 1 . 1 1 9 9 TYR QD H . . . . 10 . HD** rr_1i6y 1
40 1 . 2 . 1 1 9 9 TYR HA H . . . . 10 . HA rr_1i6y 1
41 1 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
41 1 . 2 . 1 1 8 8 ASP HA H . . . . 9 . HA rr_1i6y 1
42 2 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
42 2 . 2 . 1 1 8 8 ASP HB2 H . . . . 9 . HB* rr_1i6y 1
42 3 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
42 3 . 2 . 1 1 8 8 ASP HB3 H . . . . 9 . HB* rr_1i6y 1
43 1 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
43 1 . 2 . 1 1 9 9 TYR HA H . . . . 10 . HA rr_1i6y 1
44 2 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
44 2 . 2 . 1 1 9 9 TYR HB2 H . . . . 10 . HB* rr_1i6y 1
44 3 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
44 3 . 2 . 1 1 9 9 TYR HB3 H . . . . 10 . HB* rr_1i6y 1
45 1 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
45 1 . 2 . 1 1 9 9 TYR QD H . . . . 10 . HD** rr_1i6y 1
46 1 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
46 1 . 2 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
47 1 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
47 1 . 2 . 1 1 9 9 TYR HA H . . . . 10 . HA rr_1i6y 1
48 1 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
48 1 . 2 . 1 1 9 9 TYR QD H . . . . 10 . HD** rr_1i6y 1
49 1 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
49 1 . 2 . 1 1 10 10 LEU HA H . . . . 11 . HA rr_1i6y 1
50 2 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
50 2 . 2 . 1 1 10 10 LEU HB2 H . . . . 11 . HB* rr_1i6y 1
50 3 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
50 3 . 2 . 1 1 10 10 LEU HB3 H . . . . 11 . HB* rr_1i6y 1
51 2 . 1 . 1 1 11 11 ASP H H . . . . 12 . HN rr_1i6y 1
51 2 . 2 . 1 1 11 11 ASP HB2 H . . . . 12 . HB* rr_1i6y 1
51 3 . 1 . 1 1 11 11 ASP H H . . . . 12 . HN rr_1i6y 1
51 3 . 2 . 1 1 11 11 ASP HB3 H . . . . 12 . HB* rr_1i6y 1
52 2 . 1 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
52 2 . 2 . 1 1 6 6 ARG HA H . . . . 7 . HA* rr_1i6y 1
52 3 . 1 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
52 3 . 2 . 1 1 6 6 ARG HA H . . . . 7 . HA* rr_1i6y 1
53 2 . 1 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
53 2 . 2 . 1 1 10 10 LEU HB2 H . . . . 11 . HB* rr_1i6y 1
53 3 . 1 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
53 3 . 2 . 1 1 10 10 LEU HB2 H . . . . 11 . HB* rr_1i6y 1
53 4 . 1 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
53 4 . 2 . 1 1 10 10 LEU HB3 H . . . . 11 . HB* rr_1i6y 1
53 5 . 1 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
53 5 . 2 . 1 1 10 10 LEU HB3 H . . . . 11 . HB* rr_1i6y 1
54 1 . 1 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
54 1 . 2 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
55 2 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
55 2 . 2 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
55 3 . 1 . 1 1 5 5 VAL H H . . . . 6 . HN rr_1i6y 1
55 3 . 2 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
56 2 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
56 2 . 2 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
56 3 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
56 3 . 2 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
57 1 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
57 1 . 2 . 1 1 4 4 VAL HA H . . . . 5 . HA rr_1i6y 1
58 2 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
58 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
58 3 . 1 . 1 1 6 6 ARG H H . . . . 7 . HN rr_1i6y 1
58 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
59 2 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
59 2 . 2 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
59 3 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
59 3 . 2 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
60 2 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
60 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
60 3 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
60 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
61 1 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
61 1 . 2 . 1 1 5 5 VAL HA H . . . . 6 . HA rr_1i6y 1
62 2 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
62 2 . 2 . 1 1 3 3 ARG HG2 H . . . . 4 . HG** rr_1i6y 1
62 3 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
62 3 . 2 . 1 1 3 3 ARG HG3 H . . . . 4 . HG** rr_1i6y 1
63 2 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
63 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
63 3 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
63 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
64 1 . 1 . 1 1 8 8 ASP H H . . . . 9 . HN rr_1i6y 1
64 1 . 2 . 1 1 4 4 VAL H H . . . . 5 . HN rr_1i6y 1
65 2 . 1 . 1 1 9 9 TYR HB2 H . . . . 10 . HB* rr_1i6y 1
65 2 . 2 . 1 1 2 2 CYS HB2 H . . . . 3 . HB* rr_1i6y 1
65 3 . 1 . 1 1 9 9 TYR HB2 H . . . . 10 . HB* rr_1i6y 1
65 3 . 2 . 1 1 2 2 CYS HB3 H . . . . 3 . HB* rr_1i6y 1
65 4 . 1 . 1 1 9 9 TYR HB3 H . . . . 10 . HB* rr_1i6y 1
65 4 . 2 . 1 1 2 2 CYS HB2 H . . . . 3 . HB* rr_1i6y 1
65 5 . 1 . 1 1 9 9 TYR HB3 H . . . . 10 . HB* rr_1i6y 1
65 5 . 2 . 1 1 2 2 CYS HB3 H . . . . 3 . HB* rr_1i6y 1
66 2 . 1 . 1 1 9 9 TYR QD H . . . . 10 . HD** rr_1i6y 1
66 2 . 2 . 1 1 2 2 CYS HB2 H . . . . 3 . HB* rr_1i6y 1
66 3 . 1 . 1 1 9 9 TYR QD H . . . . 10 . HD** rr_1i6y 1
66 3 . 2 . 1 1 2 2 CYS HB3 H . . . . 3 . HB* rr_1i6y 1
67 1 . 1 . 1 1 9 9 TYR QD H . . . . 10 . HD** rr_1i6y 1
67 1 . 2 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
68 1 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
68 1 . 2 . 1 1 2 2 CYS H H . . . . 3 . HN rr_1i6y 1
69 1 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
69 1 . 2 . 1 1 3 3 ARG HA H . . . . 4 . HA rr_1i6y 1
70 2 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
70 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
70 3 . 1 . 1 1 9 9 TYR H H . . . . 10 . HN rr_1i6y 1
70 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
71 2 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
71 2 . 2 . 1 1 4 4 VAL MG1 H . . . . 5 . HG** rr_1i6y 1
71 3 . 1 . 1 1 10 10 LEU H H . . . . 11 . HN rr_1i6y 1
71 3 . 2 . 1 1 4 4 VAL MG2 H . . . . 5 . HG** rr_1i6y 1
72 1 . 1 . 1 1 7 7 GLY H H . . . . 8 . HN rr_1i6y 1
72 1 . 2 . 1 1 4 4 VAL O O . . . . 5 . O rr_1i6y 1
73 1 . 1 . 1 1 7 7 GLY N N . . . . 8 . N rr_1i6y 1
73 1 . 2 . 1 1 4 4 VAL O O . . . . 5 . O rr_1i6y 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.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
2 2 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
2 3 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
3 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
4 1 . . . . . . 5.0 1.8 6.53 rr_1i6y 1
5 2 . . . . . . 2.7 1.8 3.96 rr_1i6y 1
5 3 . . . . . . 2.7 1.8 3.96 rr_1i6y 1
6 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
7 2 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
7 3 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
8 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
9 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
10 2 . . . . . . 5.0 1.8 7.23 rr_1i6y 1
10 3 . . . . . . 5.0 1.8 7.23 rr_1i6y 1
11 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
11 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
12 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
13 2 . . . . . . 2.7 1.8 3.96 rr_1i6y 1
13 3 . . . . . . 2.7 1.8 3.96 rr_1i6y 1
14 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
14 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
15 2 . . . . . . 3.3 1.8 6.94 rr_1i6y 1
15 3 . . . . . . 3.3 1.8 6.94 rr_1i6y 1
15 4 . . . . . . 3.3 1.8 6.94 rr_1i6y 1
15 5 . . . . . . 3.3 1.8 6.94 rr_1i6y 1
16 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
17 2 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
17 3 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
18 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
19 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
20 2 . . . . . . 3.3 1.8 5.53 rr_1i6y 1
20 3 . . . . . . 3.3 1.8 5.53 rr_1i6y 1
21 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
22 2 . . . . . . 3.3 1.8 3.92 rr_1i6y 1
22 3 . . . . . . 3.3 1.8 3.92 rr_1i6y 1
23 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
24 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
25 2 . . . . . . 3.3 1.8 6.11 rr_1i6y 1
25 3 . . . . . . 3.3 1.8 6.11 rr_1i6y 1
26 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
27 1 . . . . . . 3.3 1.8 3.92 rr_1i6y 1
28 2 . . . . . . 5.0 1.8 5.88 rr_1i6y 1
28 3 . . . . . . 5.0 1.8 5.88 rr_1i6y 1
29 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
30 1 . . . . . . 5.0 1.8 5.88 rr_1i6y 1
31 2 . . . . . . 6.0 3.0 6.88 rr_1i6y 1
31 3 . . . . . . 6.0 3.0 6.88 rr_1i6y 1
32 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
33 1 . . . . . . 2.7 1.8 3.22 rr_1i6y 1
34 1 . . . . . . 5.0 1.8 5.80 rr_1i6y 1
35 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
36 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
37 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
38 2 . . . . . . 2.7 1.8 3.32 rr_1i6y 1
38 3 . . . . . . 2.7 1.8 3.32 rr_1i6y 1
39 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
40 1 . . . . . . 3.3 1.8 4.88 rr_1i6y 1
41 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
42 2 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
42 3 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
43 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
44 2 . . . . . . 3.3 1.8 3.95 rr_1i6y 1
44 3 . . . . . . 3.3 1.8 3.95 rr_1i6y 1
45 1 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
46 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
47 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
48 1 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
49 1 . . . . . . 3.3 1.8 3.30 rr_1i6y 1
50 2 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
50 3 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
51 2 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
51 3 . . . . . . 3.3 1.8 4.18 rr_1i6y 1
52 2 . . . . . . 5.0 1.8 8.41 rr_1i6y 1
52 3 . . . . . . 5.0 1.8 8.41 rr_1i6y 1
53 2 . . . . . . 5.0 1.8 8.41 rr_1i6y 1
53 3 . . . . . . 5.0 1.8 8.41 rr_1i6y 1
53 4 . . . . . . 5.0 1.8 8.41 rr_1i6y 1
53 5 . . . . . . 5.0 1.8 8.41 rr_1i6y 1
54 1 . . . . . . 5.0 1.8 5.00 rr_1i6y 1
55 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
55 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
56 2 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
56 3 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
57 1 . . . . . . 6.0 3.0 6.00 rr_1i6y 1
58 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
58 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
59 2 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
59 3 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
60 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
60 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
61 1 . . . . . . 6.0 3.0 6.00 rr_1i6y 1
62 2 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
62 3 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
63 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
63 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
64 1 . . . . . . 6.0 3.0 6.00 rr_1i6y 1
65 2 . . . . . . 6.0 3.0 8.06 rr_1i6y 1
65 3 . . . . . . 6.0 3.0 8.06 rr_1i6y 1
65 4 . . . . . . 6.0 3.0 8.06 rr_1i6y 1
65 5 . . . . . . 6.0 3.0 8.06 rr_1i6y 1
66 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
66 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
67 1 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
68 1 . . . . . . 6.0 3.0 6.00 rr_1i6y 1
69 1 . . . . . . 6.0 3.0 6.00 rr_1i6y 1
70 2 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
70 3 . . . . . . 6.0 3.0 8.81 rr_1i6y 1
71 2 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
71 3 . . . . . . 5.0 1.8 7.81 rr_1i6y 1
72 1 . . . . . . 2.3 1.5 2.30 rr_1i6y 1
73 1 . . . . . . 3.3 2.4 3.30 rr_1i6y 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1
;A1 NOE_constraints
C1
;
1 1 2 4 rr_1i6y 1
2 R2 5 1 5 4 rr_1i6y 1
3 V3 16 1 16 4 rr_1i6y 1
4 V4 29 1 29 4 rr_1i6y 1
5 R5 40 1 40 4 rr_1i6y 1
6 G6 51 1 51 4 rr_1i6y 1
7 D7 57 1 57 4 rr_1i6y 1
8 Y8 63 1 63 4 rr_1i6y 1
9 L9 78 1 78 4 rr_1i6y 1
10 D10 87 1 87 5 rr_1i6y 1
11 C11 92 1 92 5 rr_1i6y 1
12 "long rang" 97 1 97 11 rr_1i6y 1
stop_
loop_
_Dist_constraint_conv_err.ID
_Dist_constraint_conv_err.Dist_constraint_parse_file_ID
_Dist_constraint_conv_err.Parse_file_constraint_ID
_Dist_constraint_conv_err.Conv_error_type
_Dist_constraint_conv_err.Conv_error_note
_Dist_constraint_conv_err.Entry_ID
_Dist_constraint_conv_err.Distance_constraint_list_ID
1 2 1 1 "Not handling restraint 1, item 1, resonance(s) ' .2.HN' (nmrStar names),' .1.HA*' (nmrStar names) not linked" rr_1i6y 1
2 2 2 1 "Not handling restraint 2, item 1, resonance(s) ' .2.HN' (nmrStar names),' .2.HB*' (nmrStar names) not linked" rr_1i6y 1
3 2 3 1 "Not handling restraint 3, item 1, resonance(s) ' .3.HD*' (nmrStar names) not linked" rr_1i6y 1
4 2 3 1 "Not handling restraint 3, item 1, resonance(s) ' .3.HD*' (nmrStar names) not linked" rr_1i6y 1
5 2 4 1 "Not handling restraint 4, item 1, resonance(s) ' .3.HG*' (nmrStar names) not linked" rr_1i6y 1
6 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .3.HE' (nmrStar names) not linked" rr_1i6y 1
7 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .3.HE' (nmrStar names) not linked" rr_1i6y 1
8 2 6 1 "Not handling restraint 6, item 1, resonance(s) ' .3.HG*' (nmrStar names),' .3.HE' (nmrStar names) not linked" rr_1i6y 1
9 2 9 1 "Not handling restraint 9, item 1, resonance(s) ' .3.HG*' (nmrStar names) not linked" rr_1i6y 1
10 2 10 1 "Not handling restraint 10, item 1, resonance(s) ' .3.HD*' (nmrStar names) not linked" rr_1i6y 1
11 2 11 1 "Not handling restraint 11, item 1, resonance(s) ' .2.HA' (nmrStar names) not linked" rr_1i6y 1
12 2 12 1 "Not handling restraint 12, item 1, resonance(s) ' .2.HB*' (nmrStar names) not linked" rr_1i6y 1
13 2 18 1 "Not handling restraint 18, item 1, resonance(s) ' .3.HG*' (nmrStar names) not linked" rr_1i6y 1
14 2 21 1 "Not handling restraint 21, item 1, resonance(s) ' .4.HB' (nmrStar names) not linked" rr_1i6y 1
15 2 29 1 "Not handling restraint 29, item 1, resonance(s) ' .4.HB' (nmrStar names) not linked" rr_1i6y 1
16 2 35 1 "Not handling restraint 35, item 1, resonance(s) ' .6.HD*' (nmrStar names) not linked" rr_1i6y 1
17 2 37 1 "Not handling restraint 37, item 1, resonance(s) ' .6.HE' (nmrStar names) not linked" rr_1i6y 1
18 2 38 1 "Not handling restraint 38, item 1, resonance(s) ' .6.HE' (nmrStar names) not linked" rr_1i6y 1
19 2 38 1 "Not handling restraint 38, item 1, resonance(s) ' .6.HE' (nmrStar names) not linked" rr_1i6y 1
20 2 52 1 "Not handling restraint 52, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
21 2 53 1 "Not handling restraint 53, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
22 2 55 1 "Not handling restraint 55, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
23 2 56 1 "Not handling restraint 56, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
24 2 56 1 "Not handling restraint 56, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
25 2 57 1 "Not handling restraint 57, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
26 2 58 1 "Not handling restraint 58, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
27 2 59 1 "Not handling restraint 59, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
28 2 59 1 "Not handling restraint 59, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
29 2 60 1 "Not handling restraint 60, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
30 2 61 1 "Not handling restraint 61, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
31 2 62 1 "Not handling restraint 62, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
32 2 63 1 "Not handling restraint 63, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
33 2 64 1 "Not handling restraint 64, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
34 2 65 1 "Not handling restraint 65, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
35 2 69 1 "Not handling restraint 69, item 1, resonance(s) ' .10.HG*' (nmrStar names) not linked" rr_1i6y 1
36 2 81 1 "Not handling restraint 81, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" rr_1i6y 1
37 2 81 1 "Not handling restraint 81, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" rr_1i6y 1
38 2 82 1 "Not handling restraint 82, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" rr_1i6y 1
39 2 83 1 "Not handling restraint 83, item 1, resonance(s) ' .12.H2' (nmrStar names) not linked" rr_1i6y 1
40 2 86 1 "Not handling restraint 86, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
41 2 86 1 "Not handling restraint 86, item 1, resonance(s) ' .8.HA' (nmrStar names) not linked" rr_1i6y 1
42 2 88 1 "Not handling restraint 88, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
43 2 97 1 "Not handling restraint 97, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
44 2 97 1 "Not handling restraint 97, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
45 2 98 1 "Not handling restraint 98, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
46 2 99 1 "Not handling restraint 99, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
47 2 99 1 "Not handling restraint 99, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
48 2 100 1 "Not handling restraint 100, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
49 2 101 1 "Not handling restraint 101, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
50 2 101 1 "Not handling restraint 101, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
51 2 102 1 "Not handling restraint 102, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
52 2 102 1 "Not handling restraint 102, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
53 2 103 1 "Not handling restraint 103, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
54 2 103 1 "Not handling restraint 103, item 1, resonance(s) ' .9.HE*' (nmrStar names) not linked" rr_1i6y 1
55 2 113 1 "Not handling restraint 113, item 1, resonance(s) ' .8.HB*' (nmrStar names) not linked" rr_1i6y 1
56 2 115 1 "Not handling restraint 115, item 1, resonance(s) ' .9.HD*' (nmrStar names) not linked" rr_1i6y 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Entry_ID rr_1i6y
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
loop_
_Torsion_angle_constraint_software.Software_ID
_Torsion_angle_constraint_software.Software_label
_Torsion_angle_constraint_software.Method_ID
_Torsion_angle_constraint_software.Method_label
_Torsion_angle_constraint_software.Entry_ID
_Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID
. . . . rr_1i6y 1
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_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_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_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_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_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_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_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.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 ACE C C . . 1 1 2 2 CYS N N . . 1 1 2 2 CYS CA C . . 1 1 2 2 CYS C C . -145.0 -55.0 . . . A . 1 ACE C . . A . 2 CYS N . . A . 2 CYS CA . . A . 2 CYS C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . rr_1i6y 1
2 . . 1 1 2 2 CYS C C . . 1 1 3 3 ARG N N . . 1 1 3 3 ARG CA C . . 1 1 3 3 ARG C C . -145.0 -55.0 . . . A . 2 CYS C . . A . 3 ARG N . . A . 3 ARG CA . . A . 3 ARG C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . rr_1i6y 1
3 . . 1 1 3 3 ARG C C . . 1 1 4 4 VAL N N . . 1 1 4 4 VAL CA C . . 1 1 4 4 VAL C C . -165.0 -75.0 . . . A . 3 ARG C . . A . 4 VAL N . . A . 4 VAL CA . . A . 4 VAL C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . rr_1i6y 1
4 . . 1 1 4 4 VAL C C . . 1 1 5 5 VAL N N . . 1 1 5 5 VAL CA C . . 1 1 5 5 VAL C C . -145.0 -55.0 . . . A . 4 VAL C . . A . 5 VAL N . . A . 5 VAL CA . . A . 5 VAL C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . rr_1i6y 1
5 . . 1 1 6 6 ARG C C . . 1 1 7 7 GLY N N . . 1 1 7 7 GLY CA C . . 1 1 7 7 GLY C C . -145.0 -55.0 . . . A . 6 ARG C . . A . 7 GLY N . . A . 7 GLY CA . . A . 7 GLY C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . rr_1i6y 1
6 . . 1 1 7 7 GLY C C . . 1 1 8 8 ASP N N . . 1 1 8 8 ASP CA C . . 1 1 8 8 ASP C C . -145.0 -55.0 . . . A . 7 GLY C . . A . 8 ASP N . . A . 8 ASP CA . . A . 8 ASP C . . . 8 . C . . . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . rr_1i6y 1
7 . . 1 1 8 8 ASP C C . . 1 1 9 9 TYR N N . . 1 1 9 9 TYR CA C . . 1 1 9 9 TYR C C . -145.0 -55.0 . . . A . 8 ASP C . . A . 9 TYR N . . A . 9 TYR CA . . A . 9 TYR C . . . 9 . C . . . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . rr_1i6y 1
8 . . 1 1 9 9 TYR C C . . 1 1 10 10 LEU N N . . 1 1 10 10 LEU CA C . . 1 1 10 10 LEU C C . -145.0 -55.0 . . . A . 9 TYR C . . A . 10 LEU N . . A . 10 LEU CA . . A . 10 LEU C . . . 10 . C . . . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . rr_1i6y 1
9 . . 1 1 11 11 ASP N N . . 1 1 11 11 ASP CA C . . 1 1 11 11 ASP CB C . . 1 1 11 11 ASP CG C . 30.0 90.0 . . . A . 11 ASP N . . A . 11 ASP CA . . A . 11 ASP CB . . A . 11 ASP CG . . . 12 . N . . . . . 12 . CA . . . . . 12 . CB . . . . . 12 . CG . . rr_1i6y 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1
;A1 Dihedral angle constrains
Phi-angles
!R2
;
1 1 4 5 rr_1i6y 1
2 !V3 7 1 7 5 rr_1i6y 1
3 !V4 10 1 10 5 rr_1i6y 1
4 !R5 13 1 13 5 rr_1i6y 1
5 !D7 16 1 16 5 rr_1i6y 1
6 !Y8 19 1 19 5 rr_1i6y 1
7 !L9 22 1 22 5 rr_1i6y 1
8 !D10 25 1 25 6 rr_1i6y 1
9 Chi-angles 29 1 29 12 rr_1i6y 1
stop_
loop_
_TA_constraint_conv_err.ID
_TA_constraint_conv_err.Parse_file_ID
_TA_constraint_conv_err.Parse_file_constraint_ID
_TA_constraint_conv_err.Conv_error_type
_TA_constraint_conv_err.Conv_error_note
_TA_constraint_conv_err.Entry_ID
_TA_constraint_conv_err.Torsion_angle_constraint_list_ID
1 3 9 1 "Not handling restraint 9, resonance(s) ' .8.CB' (nmrStar names),' .8.CG' (nmrStar names) not linked" rr_1i6y 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_framecode MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1i6y
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "*HEADER CELL ADHESION 06-MAR-01 1I6Y *TITLE NMR ENSEMBLE OF ION-SELECTIVE LIGAND A1 FOR PLATELET *TITLE 2 INTEGRIN ALPHAIIB-BETA3 *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: ION-SELECTIVE LIGAND A1; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED: *SOURCE 4 COMMERCIAL SOLID PHASE WITH CYCLIZATION VIA SELECTIVE *SOURCE 5 DISULPHIDE OXIDATION. *KEYWDS INTEGRIN, RGD *EXPDTA NMR, 15 STRUCTURES *AUTHOR J.W.SMITH, H.LE CALVEZ, L.PARRA-GESSERT, N.E.PREECE, X.JIA, *AUTHOR 2 N.ASSA-MUNT *REVDAT 1 10-JUL-02 1I6Y 0"
save_
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