NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
589218 |
2n09   |
26536 | cing | 3-converted-DOCR | STAR | entry | full | 43 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_2n09
# This DOCR archive file contains, for PDB entry <2n09>:
#
# - 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_2n09
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 2n09"
_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 2n09"
_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 2n09 "Master copy" rr_2n09
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_2n09
_Assembly.ID 1
_Assembly.Name 2n09
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1271.3482
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 "Short hydrophobic peptide with cyclic constraints" 1 $Short_hydrophobic_peptide_with_cyclic_constraints A . no . . . . . . rr_2n09 1
stop_
save_
save_Short_hydrophobic_peptide_with_cyclic_constraints
_Entity.Sf_category entity
_Entity.Sf_framecode Short_hydrophobic_peptide_with_cyclic_constraints
_Entity.Entry_ID rr_2n09
_Entity.ID 1
_Entity.Name Short_hydrophobic_peptide_with_cyclic_constraints
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code HAEGTFTSDFFX
_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 12
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 1271.3482
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 . HIS . rr_2n09 1
2 . ABA . rr_2n09 1
3 . GLU . rr_2n09 1
4 . GLY . rr_2n09 1
5 . THR . rr_2n09 1
6 . PHE . rr_2n09 1
7 . THR . rr_2n09 1
8 . SER . rr_2n09 1
9 . ASP . rr_2n09 1
10 . PHE . rr_2n09 1
11 . PHE . rr_2n09 1
12 . NH2 . rr_2n09 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
. HIS 1 1 rr_2n09 1
. ABA 2 2 rr_2n09 1
. GLU 3 3 rr_2n09 1
. GLY 4 4 rr_2n09 1
. THR 5 5 rr_2n09 1
. PHE 6 6 rr_2n09 1
. THR 7 7 rr_2n09 1
. SER 8 8 rr_2n09 1
. ASP 9 9 rr_2n09 1
. PHE 10 10 rr_2n09 1
. PHE 11 11 rr_2n09 1
. NH2 12 12 rr_2n09 1
stop_
save_
save_chem_comp_ABA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_ABA
_Chem_comp.Entry_ID rr_2n09
_Chem_comp.ID ABA
_Chem_comp.Name "ALPHA-AMINOBUTYRIC ACID"
_Chem_comp.Type "L-peptide linking"
_Chem_comp.PDB_code ABA
_Chem_comp.Std_deriv_one_letter_code A
_Chem_comp.Std_deriv_three_letter_code Ala
_Chem_comp.Std_deriv_PDB_code ALA
_Chem_comp.Std_deriv_chem_comp_name ALANINE
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C4 H7 N O"
_Chem_comp.Formula_weight 85.1054
loop_
_Chem_comp_common_name.Name
_Chem_comp_common_name.Type
_Chem_comp_common_name.Entry_ID
_Chem_comp_common_name.Comp_ID
"(2R)-2-aminobutanoic acid" name rr_2n09 ABA
stop_
save_
save_chem_comp_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NH2
_Chem_comp.Entry_ID rr_2n09
_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_2n09
_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 10
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_2n09
_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_2n09 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_2n09 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 HIS C C -23.580 6.166 19.858 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 1 . 2 . 1 1 1 HIS CA C -23.276 7.081 21.040 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 1 . 3 . 1 1 1 HIS CB C -24.317 6.883 22.144 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 1 . 4 . 1 1 1 HIS CD2 C -23.197 8.001 24.200 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 1 . 5 . 1 1 1 HIS CE1 C -23.142 6.255 25.524 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 1 . 6 . 1 1 1 HIS CG C -23.745 6.962 23.526 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 1 . 7 . 1 1 1 HIS H1 H -22.705 9.072 21.284 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 1 . 8 . 1 1 1 HIS H2 H -24.259 8.878 20.645 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 1 . 9 . 1 1 1 HIS H3 H -22.904 8.608 19.669 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 1 . 10 . 1 1 1 HIS HA H -22.297 6.842 21.428 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 1 . 11 . 1 1 1 HIS HB2 H -25.076 7.645 22.055 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 1 . 12 . 1 1 1 HIS HB3 H -24.774 5.911 22.028 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 1 . 13 . 1 1 1 HIS HD1 H -24.017 4.979 24.184 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 1 . 14 . 1 1 1 HIS HD2 H -23.072 9.010 23.831 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 1 . 15 . 1 1 1 HIS HE1 H -22.972 5.619 26.380 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 1 . 16 . 1 1 1 HIS HE2 H -22.495 8.085 26.177 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 1 . 17 . 1 1 1 HIS N N -23.287 8.509 20.631 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 1 . 18 . 1 1 1 HIS ND1 N -23.695 5.883 24.383 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 1 . 19 . 1 1 1 HIS NE2 N -22.831 7.535 25.438 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 1 . 20 . 1 1 1 HIS O O -24.724 5.763 19.651 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 1 . 21 . 1 1 2 ABA C C -23.718 5.574 16.950 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 1 . 22 . 1 1 2 ABA CA C -22.693 4.970 17.919 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 1 . 23 . 1 1 2 ABA H H -21.659 6.197 19.307 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 1 . 24 . 1 1 2 ABA N N -22.546 5.842 19.087 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 1 . 25 . 1 1 2 ABA O O -23.353 6.298 16.024 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 1 . 26 . 1 1 3 GLU C C -26.020 7.313 16.254 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 1 . 27 . 1 1 3 GLU CA C -26.060 5.789 16.313 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 1 . 28 . 1 1 3 GLU CB C -27.424 5.322 16.822 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 1 . 29 . 1 1 3 GLU CD C -28.058 3.516 18.472 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 1 . 30 . 1 1 3 GLU CG C -27.490 3.829 17.102 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 1 . 31 . 1 1 3 GLU H H -25.232 4.693 17.922 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 1 . 32 . 1 1 3 GLU HA H -25.904 5.399 15.319 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 1 . 33 . 1 1 3 GLU HB2 H -27.654 5.849 17.737 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 1 . 34 . 1 1 3 GLU HB3 H -28.173 5.561 16.082 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 1 . 35 . 1 1 3 GLU HG2 H -28.116 3.364 16.355 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 1 . 36 . 1 1 3 GLU HG3 H -26.492 3.421 17.039 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 1 . 37 . 1 1 3 GLU N N -24.997 5.273 17.168 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 1 . 38 . 1 1 3 GLU O O -26.389 7.916 15.247 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 1 . 39 . 1 1 3 GLU OE1 O -28.748 4.387 19.043 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 1 . 40 . 1 1 3 GLU OE2 O -27.813 2.399 18.975 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 1 . 41 . 1 1 4 GLY C C -24.149 9.896 16.885 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 1 . 42 . 1 1 4 GLY CA C -25.481 9.376 17.390 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 1 . 43 . 1 1 4 GLY H H -25.281 7.396 18.113 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 1 . 44 . 1 1 4 GLY HA2 H -26.271 9.792 16.783 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 1 . 45 . 1 1 4 GLY HA3 H -25.617 9.699 18.411 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 1 . 46 . 1 1 4 GLY N N -25.565 7.928 17.340 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 1 . 47 . 1 1 4 GLY O O -24.057 11.029 16.414 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 1 . 48 . 1 1 5 THR C C -21.351 10.780 17.136 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 1 . 49 . 1 1 5 THR CA C -21.779 9.445 16.533 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 1 . 50 . 1 1 5 THR CB C -21.710 9.541 14.997 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 1 . 51 . 1 1 5 THR CG2 C -20.404 8.961 14.476 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 1 . 52 . 1 1 5 THR H H -23.252 8.174 17.367 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 1 . 53 . 1 1 5 THR HA H -21.090 8.679 16.855 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 1 . 54 . 1 1 5 THR HB H -21.763 10.582 14.712 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 1 . 55 . 1 1 5 THR HG1 H -23.334 9.448 13.880 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 1 . 56 . 1 1 5 THR HG21 H -20.596 8.386 13.582 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 1 . 57 . 1 1 5 THR HG22 H -19.969 8.320 15.229 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 1 . 58 . 1 1 5 THR HG23 H -19.719 9.764 14.248 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 1 . 59 . 1 1 5 THR N N -23.114 9.065 16.983 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 1 . 60 . 1 1 5 THR O O -22.054 11.350 17.970 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 1 . 61 . 1 1 5 THR OG1 O -22.815 8.840 14.412 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 1 . 62 . 1 1 6 PHE C C -20.468 13.714 16.643 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 1 . 63 . 1 1 6 PHE CA C -19.672 12.541 17.206 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 1 . 64 . 1 1 6 PHE CB C -18.194 12.687 16.838 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 1 . 65 . 1 1 6 PHE CD1 C -16.983 14.039 18.572 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 1 . 66 . 1 1 6 PHE CD2 C -17.592 15.103 16.526 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 1 . 67 . 1 1 6 PHE CE1 C -16.416 15.217 19.019 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 1 . 68 . 1 1 6 PHE CE2 C -17.026 16.284 16.968 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 1 . 69 . 1 1 6 PHE CG C -17.577 13.969 17.322 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 1 . 70 . 1 1 6 PHE CZ C -16.437 16.341 18.216 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 1 . 71 . 1 1 6 PHE H H -19.678 10.772 16.042 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 1 . 72 . 1 1 6 PHE HA H -19.768 12.539 18.281 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 1 . 73 . 1 1 6 PHE HB2 H -17.639 11.868 17.272 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 1 . 74 . 1 1 6 PHE HB3 H -18.093 12.654 15.763 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 1 . 75 . 1 1 6 PHE HD1 H -16.966 13.161 19.200 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 1 . 76 . 1 1 6 PHE HD2 H -18.053 15.060 15.550 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 1 . 77 . 1 1 6 PHE HE1 H -15.956 15.259 19.995 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 1 . 78 . 1 1 6 PHE HE2 H -17.044 17.161 16.338 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 1 . 79 . 1 1 6 PHE HZ H -15.994 17.263 18.564 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 1 . 80 . 1 1 6 PHE N N -20.193 11.273 16.708 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 1 . 81 . 1 1 6 PHE O O -20.640 14.736 17.307 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 1 . 82 . 1 1 7 THR C C -22.894 15.062 15.635 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 1 . 83 . 1 1 7 THR CA C -21.728 14.610 14.762 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 1 . 84 . 1 1 7 THR CB C -22.274 14.142 13.400 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 1 . 85 . 1 1 7 THR CG2 C -23.089 12.866 13.553 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 1 . 86 . 1 1 7 THR H H -20.781 12.724 14.934 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 1 . 87 . 1 1 7 THR HA H -21.072 15.452 14.591 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 1 . 88 . 1 1 7 THR HB H -21.440 13.941 12.744 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 1 . 89 . 1 1 7 THR HG1 H -23.501 14.834 12.019 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 1 . 90 . 1 1 7 THR HG21 H -22.705 12.291 14.383 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 1 . 91 . 1 1 7 THR HG22 H -23.018 12.283 12.647 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 1 . 92 . 1 1 7 THR HG23 H -24.123 13.119 13.738 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 1 . 93 . 1 1 7 THR N N -20.951 13.561 15.414 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 1 . 94 . 1 1 7 THR O O -23.138 16.259 15.792 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 1 . 95 . 1 1 7 THR OG1 O -23.089 15.167 12.820 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 1 . 96 . 1 1 8 SER C C -24.326 14.530 18.517 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 1 . 97 . 1 1 8 SER CA C -24.753 14.397 17.058 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 1 . 98 . 1 1 8 SER CB C -25.815 13.303 16.926 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 1 . 99 . 1 1 8 SER H H -23.369 13.163 16.038 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 1 . 100 . 1 1 8 SER HA H -25.175 15.335 16.732 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 1 . 101 . 1 1 8 SER HB2 H -25.535 12.458 17.536 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 1 . 102 . 1 1 8 SER HB3 H -26.768 13.688 17.258 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 1 . 103 . 1 1 8 SER HG H -26.127 13.628 15.019 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 1 . 104 . 1 1 8 SER N N -23.612 14.098 16.201 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 1 . 105 . 1 1 8 SER O O -24.871 15.346 19.261 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 1 . 106 . 1 1 8 SER OG O -25.939 12.873 15.581 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 1 . 107 . 1 1 9 ASP C C -21.698 14.726 20.462 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 1 . 108 . 1 1 9 ASP CA C -22.858 13.744 20.296 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 1 . 109 . 1 1 9 ASP CB C -22.415 12.343 20.720 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 1 . 110 . 1 1 9 ASP CG C -23.546 11.336 20.656 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 1 . 111 . 1 1 9 ASP H H -22.960 13.088 18.284 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 1 . 112 . 1 1 9 ASP HA H -23.671 14.059 20.932 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 1 . 113 . 1 1 9 ASP HB2 H -21.623 12.009 20.067 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 1 . 114 . 1 1 9 ASP HB3 H -22.047 12.380 21.735 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 1 . 115 . 1 1 9 ASP N N -23.352 13.720 18.922 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 1 . 116 . 1 1 9 ASP O O -20.941 14.641 21.429 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 1 . 117 . 1 1 9 ASP OD1 O -24.067 11.098 19.547 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 1 . 118 . 1 1 9 ASP OD2 O -23.912 10.786 21.716 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 1 . 119 . 1 1 10 PHE C C -20.411 17.309 20.944 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 1 . 120 . 1 1 10 PHE CA C -20.485 16.645 19.570 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 1 . 121 . 1 1 10 PHE CB C -20.691 17.707 18.488 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 1 . 122 . 1 1 10 PHE CD1 C -23.169 18.071 18.313 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 1 . 123 . 1 1 10 PHE CD2 C -21.832 19.804 19.261 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 1 . 124 . 1 1 10 PHE CE1 C -24.302 18.839 18.499 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 1 . 125 . 1 1 10 PHE CE2 C -22.962 20.577 19.450 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 1 . 126 . 1 1 10 PHE CG C -21.922 18.544 18.691 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 1 . 127 . 1 1 10 PHE CZ C -24.199 20.094 19.068 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 1 . 128 . 1 1 10 PHE H H -22.186 15.674 18.768 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 1 . 129 . 1 1 10 PHE HA H -19.554 16.132 19.383 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 1 . 130 . 1 1 10 PHE HB2 H -19.839 18.369 18.476 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 1 . 131 . 1 1 10 PHE HB3 H -20.775 17.219 17.527 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 1 . 132 . 1 1 10 PHE HD1 H -23.251 17.090 17.868 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 1 . 133 . 1 1 10 PHE HD2 H -20.866 20.182 19.560 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 1 . 134 . 1 1 10 PHE HE1 H -25.268 18.460 18.199 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 1 . 135 . 1 1 10 PHE HE2 H -22.878 21.557 19.895 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 1 . 136 . 1 1 10 PHE HZ H -25.083 20.696 19.214 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 1 . 137 . 1 1 10 PHE N N -21.558 15.654 19.518 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 1 . 138 . 1 1 10 PHE O O -21.262 17.079 21.803 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 1 . 139 . 1 1 11 PHE C C -18.970 17.836 23.546 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 1 . 140 . 1 1 11 PHE CA C -19.198 18.829 22.410 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 1 . 141 . 1 1 11 PHE CB C -20.409 19.712 22.718 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 1 . 142 . 1 1 11 PHE CD1 C -19.385 21.586 24.036 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 1 . 143 . 1 1 11 PHE CD2 C -20.996 20.194 25.110 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 1 . 144 . 1 1 11 PHE CE1 C -19.246 22.325 25.195 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 1 . 145 . 1 1 11 PHE CE2 C -20.861 20.929 26.273 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 1 . 146 . 1 1 11 PHE CG C -20.261 20.514 23.980 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 1 . 147 . 1 1 11 PHE CZ C -19.985 21.997 26.315 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 1 . 148 . 1 1 11 PHE H H -18.740 18.274 20.419 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 1 . 149 . 1 1 11 PHE HA H -18.323 19.455 22.315 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 1 . 150 . 1 1 11 PHE HB2 H -20.560 20.402 21.902 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 1 . 151 . 1 1 11 PHE HB3 H -21.284 19.087 22.821 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 1 . 152 . 1 1 11 PHE HD1 H -18.808 21.845 23.161 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 1 . 153 . 1 1 11 PHE HD2 H -21.681 19.360 25.078 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 1 . 154 . 1 1 11 PHE HE1 H -18.560 23.159 25.226 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 1 . 155 . 1 1 11 PHE HE2 H -21.440 20.670 27.147 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 1 . 156 . 1 1 11 PHE HZ H -19.878 22.573 27.222 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 1 . 157 . 1 1 11 PHE N N -19.386 18.133 21.142 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 1 . 158 . 1 1 11 PHE O O -19.686 17.847 24.548 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 1 . 159 . 1 1 12 NH2 HN1 H -17.802 16.327 24.104 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 1 . 160 . 1 1 12 NH2 HN2 H -17.442 17.026 22.566 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 1 . 161 . 1 1 12 NH2 N N -17.970 16.976 23.389 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 2 . 162 . 1 1 1 HIS C C -24.596 6.043 19.774 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 2 . 163 . 1 1 1 HIS CA C -24.662 6.866 21.056 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 2 . 164 . 1 1 1 HIS CB C -25.969 7.660 21.110 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 2 . 165 . 1 1 1 HIS CD2 C -28.313 6.573 20.884 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 2 . 166 . 1 1 1 HIS CE1 C -28.381 5.551 22.822 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 2 . 167 . 1 1 1 HIS CG C -27.151 6.842 21.526 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 2 . 168 . 1 1 1 HIS H1 H -22.648 7.310 21.366 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 2 . 169 . 1 1 1 HIS H2 H -23.705 8.526 21.881 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 2 . 170 . 1 1 1 HIS H3 H -23.404 8.311 20.230 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 2 . 171 . 1 1 1 HIS HA H -24.614 6.200 21.903 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 2 . 172 . 1 1 1 HIS HB2 H -25.861 8.469 21.817 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 2 . 173 . 1 1 1 HIS HB3 H -26.174 8.069 20.131 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 2 . 174 . 1 1 1 HIS HD1 H -26.534 6.189 23.432 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 2 . 175 . 1 1 1 HIS HD2 H -28.600 6.926 19.903 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 2 . 176 . 1 1 1 HIS HE1 H -28.714 4.955 23.659 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 2 . 177 . 1 1 1 HIS HE2 H -29.916 5.354 21.481 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 2 . 178 . 1 1 1 HIS N N -23.526 7.820 21.139 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 2 . 179 . 1 1 1 HIS ND1 N -27.226 6.187 22.738 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 2 . 180 . 1 1 1 HIS NE2 N -29.059 5.770 21.711 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 2 . 181 . 1 1 1 HIS O O -25.594 5.882 19.073 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 2 . 182 . 1 1 2 ABA C C -23.614 5.504 17.035 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 2 . 183 . 1 1 2 ABA CA C -23.196 4.709 18.280 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 2 . 184 . 1 1 2 ABA H H -22.656 5.689 20.083 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 2 . 185 . 1 1 2 ABA N N -23.409 5.524 19.480 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 2 . 186 . 1 1 2 ABA O O -22.799 6.211 16.441 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 2 . 187 . 1 1 3 GLU C C -25.200 7.601 15.622 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 2 . 188 . 1 1 3 GLU CA C -25.391 6.095 15.475 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 2 . 189 . 1 1 3 GLU CB C -26.872 5.771 15.260 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 2 . 190 . 1 1 3 GLU CD C -26.713 6.239 12.783 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 2 . 191 . 1 1 3 GLU CG C -27.189 5.280 13.857 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 2 . 192 . 1 1 3 GLU H H -25.491 4.812 17.154 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 2 . 193 . 1 1 3 GLU HA H -24.832 5.757 14.616 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 2 . 194 . 1 1 3 GLU HB2 H -27.166 5.004 15.961 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 2 . 195 . 1 1 3 GLU HB3 H -27.457 6.660 15.447 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 2 . 196 . 1 1 3 GLU HG2 H -26.706 4.326 13.705 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 2 . 197 . 1 1 3 GLU HG3 H -28.258 5.160 13.764 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 2 . 198 . 1 1 3 GLU N N -24.883 5.387 16.645 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 2 . 199 . 1 1 3 GLU O O -25.014 8.312 14.635 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 2 . 200 . 1 1 3 GLU OE1 O -26.736 7.463 13.028 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 2 . 201 . 1 1 3 GLU OE2 O -26.316 5.765 11.698 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 2 . 202 . 1 1 4 GLY C C -23.691 9.988 16.731 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 2 . 203 . 1 1 4 GLY CA C -25.074 9.498 17.111 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 2 . 204 . 1 1 4 GLY H H -25.395 7.465 17.609 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 2 . 205 . 1 1 4 GLY HA2 H -25.808 10.045 16.539 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 2 . 206 . 1 1 4 GLY HA3 H -25.236 9.689 18.162 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 2 . 207 . 1 1 4 GLY N N -25.246 8.080 16.860 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 2 . 208 . 1 1 4 GLY O O -23.539 11.088 16.200 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 2 . 209 . 1 1 5 THR C C -20.960 10.933 17.159 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 2 . 210 . 1 1 5 THR CA C -21.297 9.522 16.683 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 2 . 211 . 1 1 5 THR CB C -21.027 9.422 15.169 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 2 . 212 . 1 1 5 THR CG2 C -19.669 8.791 14.902 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 2 . 213 . 1 1 5 THR H H -22.864 8.303 17.424 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 2 . 214 . 1 1 5 THR HA H -20.650 8.820 17.189 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 2 . 215 . 1 1 5 THR HB H -21.033 10.418 14.750 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 2 . 216 . 1 1 5 THR HG1 H -22.871 9.143 14.528 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 2 . 217 . 1 1 5 THR HG21 H -19.796 7.740 14.689 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 2 . 218 . 1 1 5 THR HG22 H -19.040 8.909 15.772 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 2 . 219 . 1 1 5 THR HG23 H -19.206 9.277 14.056 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 2 . 220 . 1 1 5 THR N N -22.678 9.168 17.001 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 2 . 221 . 1 1 5 THR O O -21.739 11.560 17.876 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 2 . 222 . 1 1 5 THR OG1 O -22.051 8.645 14.539 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 2 . 223 . 1 1 6 PHE C C -20.370 13.817 16.706 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 2 . 224 . 1 1 6 PHE CA C -19.351 12.762 17.132 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 2 . 225 . 1 1 6 PHE CB C -17.985 13.062 16.505 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 2 . 226 . 1 1 6 PHE CD1 C -17.692 15.124 17.908 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 2 . 227 . 1 1 6 PHE CD2 C -16.943 15.177 15.644 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 2 . 228 . 1 1 6 PHE CE1 C -17.276 16.431 18.079 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 2 . 229 . 1 1 6 PHE CE2 C -16.526 16.484 15.809 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 2 . 230 . 1 1 6 PHE CG C -17.530 14.483 16.690 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 2 . 231 . 1 1 6 PHE CZ C -16.692 17.111 17.028 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 2 . 232 . 1 1 6 PHE H H -19.217 10.877 16.180 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 2 . 233 . 1 1 6 PHE HA H -19.255 12.785 18.207 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 2 . 234 . 1 1 6 PHE HB2 H -17.244 12.417 16.952 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 2 . 235 . 1 1 6 PHE HB3 H -18.034 12.863 15.444 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 2 . 236 . 1 1 6 PHE HD1 H -18.148 14.592 18.730 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 2 . 237 . 1 1 6 PHE HD2 H -16.813 14.687 14.690 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 2 . 238 . 1 1 6 PHE HE1 H -17.408 16.919 19.033 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 2 . 239 . 1 1 6 PHE HE2 H -16.070 17.014 14.986 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 2 . 240 . 1 1 6 PHE HZ H -16.367 18.133 17.160 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 2 . 241 . 1 1 6 PHE N N -19.794 11.426 16.752 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 2 . 242 . 1 1 6 PHE O O -20.597 14.797 17.415 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 2 . 243 . 1 1 7 THR C C -23.104 14.763 16.015 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 2 . 244 . 1 1 7 THR CA C -21.970 14.543 15.019 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 2 . 245 . 1 1 7 THR CB C -22.562 14.047 13.686 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 2 . 246 . 1 1 7 THR CG2 C -23.146 12.650 13.837 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 2 . 247 . 1 1 7 THR H H -20.753 12.811 15.021 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 2 . 248 . 1 1 7 THR HA H -21.476 15.487 14.839 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 2 . 249 . 1 1 7 THR HB H -21.773 14.013 12.949 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 2 . 250 . 1 1 7 THR HG1 H -24.374 14.823 13.765 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 2 . 251 . 1 1 7 THR HG21 H -22.503 12.058 14.470 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 2 . 252 . 1 1 7 THR HG22 H -23.222 12.185 12.865 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 2 . 253 . 1 1 7 THR HG23 H -24.128 12.717 14.281 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 2 . 254 . 1 1 7 THR N N -20.978 13.610 15.542 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 2 . 255 . 1 1 7 THR O O -23.570 15.887 16.201 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 2 . 256 . 1 1 7 THR OG1 O -23.582 14.948 13.237 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 2 . 257 . 1 1 8 SER C C -24.074 14.108 19.017 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 2 . 258 . 1 1 8 SER CA C -24.620 13.764 17.635 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 2 . 259 . 1 1 8 SER CB C -25.388 12.442 17.691 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 2 . 260 . 1 1 8 SER H H -23.131 12.815 16.467 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 2 . 261 . 1 1 8 SER HA H -25.294 14.548 17.322 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 2 . 262 . 1 1 8 SER HB2 H -25.503 12.053 16.690 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 2 . 263 . 1 1 8 SER HB3 H -24.836 11.733 18.291 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 2 . 264 . 1 1 8 SER HG H -27.203 13.177 17.685 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 2 . 265 . 1 1 8 SER N N -23.542 13.684 16.656 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 2 . 266 . 1 1 8 SER O O -24.768 14.710 19.837 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 2 . 267 . 1 1 8 SER OG O -26.672 12.622 18.261 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 2 . 268 . 1 1 9 ASP C C -22.164 15.492 20.843 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 2 . 269 . 1 1 9 ASP CA C -22.187 13.995 20.553 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 2 . 270 . 1 1 9 ASP CB C -20.763 13.439 20.565 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 2 . 271 . 1 1 9 ASP CG C -20.733 11.930 20.716 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 2 . 272 . 1 1 9 ASP H H -22.322 13.249 18.577 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 2 . 273 . 1 1 9 ASP HA H -22.764 13.501 21.320 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 2 . 274 . 1 1 9 ASP HB2 H -20.273 13.698 19.639 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 2 . 275 . 1 1 9 ASP HB3 H -20.219 13.876 21.390 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 2 . 276 . 1 1 9 ASP N N -22.826 13.724 19.270 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 2 . 277 . 1 1 9 ASP O O -22.250 15.913 21.997 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 2 . 278 . 1 1 9 ASP OD1 O -21.442 11.408 21.603 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 2 . 279 . 1 1 9 ASP OD2 O -20.002 11.271 19.948 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 2 . 280 . 1 1 10 PHE C C -20.797 18.189 20.729 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 2 . 281 . 1 1 10 PHE CA C -22.018 17.744 19.928 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 2 . 282 . 1 1 10 PHE CB C -23.299 18.238 20.605 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 2 . 283 . 1 1 10 PHE CD1 C -23.976 19.997 18.948 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 2 . 284 . 1 1 10 PHE CD2 C -25.532 18.263 19.460 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 2 . 285 . 1 1 10 PHE CE1 C -24.885 20.558 18.070 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 2 . 286 . 1 1 10 PHE CE2 C -26.445 18.820 18.584 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 2 . 287 . 1 1 10 PHE CG C -24.289 18.845 19.651 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 2 . 288 . 1 1 10 PHE CZ C -26.121 19.968 17.888 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 2 . 289 . 1 1 10 PHE H H -21.987 15.897 18.892 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 2 . 290 . 1 1 10 PHE HA H -21.958 18.171 18.938 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 2 . 291 . 1 1 10 PHE HB2 H -23.781 17.407 21.097 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 2 . 292 . 1 1 10 PHE HB3 H -23.045 18.987 21.342 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 2 . 293 . 1 1 10 PHE HD1 H -23.010 20.459 19.090 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 2 . 294 . 1 1 10 PHE HD2 H -25.786 17.366 20.003 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 2 . 295 . 1 1 10 PHE HE1 H -24.629 21.456 17.527 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 2 . 296 . 1 1 10 PHE HE2 H -27.410 18.356 18.443 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 2 . 297 . 1 1 10 PHE HZ H -26.832 20.404 17.203 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 2 . 298 . 1 1 10 PHE N N -22.050 16.293 19.787 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 2 . 299 . 1 1 10 PHE O O -20.836 19.204 21.425 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 2 . 300 . 1 1 11 PHE C C -18.664 17.574 22.844 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 2 . 301 . 1 1 11 PHE CA C -18.480 17.739 21.338 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 2 . 302 . 1 1 11 PHE CB C -18.026 19.167 21.018 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 2 . 303 . 1 1 11 PHE CD1 C -15.573 19.172 21.549 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 2 . 304 . 1 1 11 PHE CD2 C -16.241 19.442 19.276 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 2 . 305 . 1 1 11 PHE CE1 C -14.246 19.260 21.173 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 2 . 306 . 1 1 11 PHE CE2 C -14.916 19.532 18.893 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 2 . 307 . 1 1 11 PHE CG C -16.584 19.262 20.606 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 2 . 308 . 1 1 11 PHE CZ C -13.917 19.440 19.843 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 2 . 309 . 1 1 11 PHE H H -19.744 16.629 20.052 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 2 . 310 . 1 1 11 PHE HA H -17.720 17.047 21.005 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 2 . 311 . 1 1 11 PHE HB2 H -18.627 19.555 20.210 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 2 . 312 . 1 1 11 PHE HB3 H -18.164 19.787 21.892 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 2 . 313 . 1 1 11 PHE HD1 H -15.829 19.031 22.589 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 2 . 314 . 1 1 11 PHE HD2 H -17.021 19.514 18.532 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 2 . 315 . 1 1 11 PHE HE1 H -13.467 19.188 21.917 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 2 . 316 . 1 1 11 PHE HE2 H -14.662 19.672 17.853 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 2 . 317 . 1 1 11 PHE HZ H -12.881 19.510 19.547 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 2 . 318 . 1 1 11 PHE N N -19.714 17.424 20.624 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 2 . 319 . 1 1 11 PHE O O -18.133 16.642 23.447 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 2 . 320 . 1 1 12 NH2 HN1 H -19.553 18.401 24.419 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 2 . 321 . 1 1 12 NH2 HN2 H -19.810 19.198 22.908 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 2 . 322 . 1 1 12 NH2 N N -19.419 18.483 23.452 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 3 . 323 . 1 1 1 HIS C C -25.295 5.902 19.416 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 3 . 324 . 1 1 1 HIS CA C -26.580 5.729 20.220 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 3 . 325 . 1 1 1 HIS CB C -27.141 7.095 20.627 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 3 . 326 . 1 1 1 HIS CD2 C -26.880 7.709 23.134 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 3 . 327 . 1 1 1 HIS CE1 C -24.949 8.741 23.014 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 3 . 328 . 1 1 1 HIS CG C -26.484 7.682 21.839 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 3 . 329 . 1 1 1 HIS H1 H -25.533 5.312 21.977 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 3 . 330 . 1 1 1 HIS H2 H -26.133 3.938 21.195 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 3 . 331 . 1 1 1 HIS H3 H -27.183 4.945 22.058 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 3 . 332 . 1 1 1 HIS HA H -27.308 5.214 19.611 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 3 . 333 . 1 1 1 HIS HB2 H -27.006 7.789 19.810 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 3 . 334 . 1 1 1 HIS HB3 H -28.196 6.995 20.835 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 3 . 335 . 1 1 1 HIS HD1 H -24.727 8.485 20.996 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 3 . 336 . 1 1 1 HIS HD2 H -27.791 7.287 23.535 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 3 . 337 . 1 1 1 HIS HE1 H -24.055 9.282 23.284 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 3 . 338 . 1 1 1 HIS HE2 H -25.943 8.582 24.799 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 3 . 339 . 1 1 1 HIS N N -26.341 4.925 21.448 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 3 . 340 . 1 1 1 HIS ND1 N -25.271 8.338 21.797 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 3 . 341 . 1 1 1 HIS NE2 N -25.909 8.372 23.842 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 3 . 342 . 1 1 1 HIS O O -24.747 7.001 19.330 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 3 . 343 . 1 1 2 ABA C C -23.771 5.797 16.852 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 3 . 344 . 1 1 2 ABA CA C -23.594 4.833 18.026 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 3 . 345 . 1 1 2 ABA H H -25.302 3.961 18.934 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 3 . 346 . 1 1 2 ABA N N -24.820 4.808 18.828 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 3 . 347 . 1 1 2 ABA O O -22.843 6.516 16.480 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 3 . 348 . 1 1 3 GLU C C -24.944 8.132 15.476 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 3 . 349 . 1 1 3 GLU CA C -25.267 6.679 15.144 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 3 . 350 . 1 1 3 GLU CB C -26.737 6.545 14.745 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 3 . 351 . 1 1 3 GLU CD C -27.558 4.161 14.597 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 3 . 352 . 1 1 3 GLU CG C -27.014 5.357 13.839 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 3 . 353 . 1 1 3 GLU H H -25.668 5.210 16.615 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 3 . 354 . 1 1 3 GLU HA H -24.650 6.367 14.314 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 3 . 355 . 1 1 3 GLU HB2 H -27.333 6.437 15.639 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 3 . 356 . 1 1 3 GLU HB3 H -27.041 7.443 14.227 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 3 . 357 . 1 1 3 GLU HG2 H -27.736 5.649 13.092 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 3 . 358 . 1 1 3 GLU HG3 H -26.093 5.068 13.354 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 3 . 359 . 1 1 3 GLU N N -24.968 5.805 16.274 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 3 . 360 . 1 1 3 GLU O O -24.600 8.919 14.593 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 3 . 361 . 1 1 3 GLU OE1 O -28.219 4.368 15.636 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 3 . 362 . 1 1 3 GLU OE2 O -27.323 3.019 14.150 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 3 . 363 . 1 1 4 GLY C C -23.295 10.181 17.044 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 3 . 364 . 1 1 4 GLY CA C -24.765 9.839 17.176 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 3 . 365 . 1 1 4 GLY H H -25.330 7.812 17.414 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 3 . 366 . 1 1 4 GLY HA2 H -25.340 10.524 16.570 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 3 . 367 . 1 1 4 GLY HA3 H -25.059 9.954 18.209 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 3 . 368 . 1 1 4 GLY N N -25.054 8.482 16.753 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 3 . 369 . 1 1 4 GLY O O -22.943 11.268 16.586 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 3 . 370 . 1 1 5 THR C C -20.562 10.810 17.871 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 3 . 371 . 1 1 5 THR CA C -20.987 9.428 17.375 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 3 . 372 . 1 1 5 THR CB C -20.462 9.213 15.940 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 3 . 373 . 1 1 5 THR CG2 C -21.022 10.258 14.986 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 3 . 374 . 1 1 5 THR H H -22.789 8.401 17.799 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 3 . 375 . 1 1 5 THR HA H -20.533 8.681 18.011 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 3 . 376 . 1 1 5 THR HB H -20.777 8.236 15.603 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 3 . 377 . 1 1 5 THR HG1 H -18.678 8.557 16.466 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 3 . 378 . 1 1 5 THR HG21 H -21.035 11.221 15.472 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 3 . 379 . 1 1 5 THR HG22 H -22.027 9.985 14.702 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 3 . 380 . 1 1 5 THR HG23 H -20.400 10.309 14.104 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 3 . 381 . 1 1 5 THR N N -22.437 9.244 17.446 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 3 . 382 . 1 1 5 THR O O -21.365 11.557 18.429 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 3 . 383 . 1 1 5 THR OG1 O -19.030 9.269 15.928 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 3 . 384 . 1 1 6 PHE C C -19.562 13.585 17.534 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 3 . 385 . 1 1 6 PHE CA C -18.742 12.425 18.092 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 3 . 386 . 1 1 6 PHE CB C -17.283 12.548 17.642 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 3 . 387 . 1 1 6 PHE CD1 C -16.748 14.407 19.243 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 3 . 388 . 1 1 6 PHE CD2 C -15.969 14.585 16.996 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 3 . 389 . 1 1 6 PHE CE1 C -16.169 15.626 19.543 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 3 . 390 . 1 1 6 PHE CE2 C -15.388 15.804 17.289 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 3 . 391 . 1 1 6 PHE CG C -16.655 13.874 17.967 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 3 . 392 . 1 1 6 PHE CZ C -15.488 16.325 18.565 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 3 . 393 . 1 1 6 PHE H H -18.698 10.496 17.219 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 3 . 394 . 1 1 6 PHE HA H -18.780 12.459 19.170 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 3 . 395 . 1 1 6 PHE HB2 H -16.700 11.779 18.126 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 3 . 396 . 1 1 6 PHE HB3 H -17.233 12.409 16.572 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 3 . 397 . 1 1 6 PHE HD1 H -17.279 13.861 20.008 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 3 . 398 . 1 1 6 PHE HD2 H -15.890 14.178 15.998 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 3 . 399 . 1 1 6 PHE HE1 H -16.248 16.031 20.541 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 3 . 400 . 1 1 6 PHE HE2 H -14.857 16.349 16.523 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 3 . 401 . 1 1 6 PHE HZ H -15.035 17.278 18.797 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 3 . 402 . 1 1 6 PHE N N -19.288 11.138 17.666 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 3 . 403 . 1 1 6 PHE O O -19.814 14.571 18.228 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 3 . 404 . 1 1 7 THR C C -21.974 14.900 16.461 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 3 . 405 . 1 1 7 THR CA C -20.763 14.502 15.620 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 3 . 406 . 1 1 7 THR CB C -21.247 14.043 14.232 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 3 . 407 . 1 1 7 THR CG2 C -21.288 15.212 13.259 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 3 . 408 . 1 1 7 THR H H -19.738 12.655 15.774 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 3 . 409 . 1 1 7 THR HA H -20.129 15.367 15.489 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 3 . 410 . 1 1 7 THR HB H -22.245 13.640 14.330 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 3 . 411 . 1 1 7 THR HG1 H -20.898 12.255 13.472 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 3 . 412 . 1 1 7 THR HG21 H -21.575 14.855 12.280 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 3 . 413 . 1 1 7 THR HG22 H -20.312 15.669 13.203 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 3 . 414 . 1 1 7 THR HG23 H -22.009 15.940 13.601 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 3 . 415 . 1 1 7 THR N N -19.974 13.463 16.276 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 3 . 416 . 1 1 7 THR O O -22.172 16.077 16.762 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 3 . 417 . 1 1 7 THR OG1 O -20.379 13.023 13.722 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 3 . 418 . 1 1 8 SER C C -23.626 14.294 19.116 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 3 . 419 . 1 1 8 SER CA C -23.975 14.164 17.636 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 3 . 420 . 1 1 8 SER CB C -24.992 13.039 17.440 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 3 . 421 . 1 1 8 SER H H -22.574 12.995 16.561 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 3 . 422 . 1 1 8 SER HA H -24.411 15.092 17.298 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 3 . 423 . 1 1 8 SER HB2 H -24.671 12.167 17.989 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 3 . 424 . 1 1 8 SER HB3 H -25.956 13.360 17.807 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 3 . 425 . 1 1 8 SER HG H -26.027 12.458 15.881 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 3 . 426 . 1 1 8 SER N N -22.783 13.913 16.834 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 3 . 427 . 1 1 8 SER O O -24.154 15.160 19.813 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 3 . 428 . 1 1 8 SER OG O -25.116 12.695 16.070 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 3 . 429 . 1 1 9 ASP C C -21.853 14.834 21.409 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 3 . 430 . 1 1 9 ASP CA C -22.320 13.443 20.990 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 3 . 431 . 1 1 9 ASP CB C -21.200 12.427 21.227 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 3 . 432 . 1 1 9 ASP CG C -21.732 11.043 21.542 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 3 . 433 . 1 1 9 ASP H H -22.353 12.758 18.986 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 3 . 434 . 1 1 9 ASP HA H -23.174 13.168 21.592 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 3 . 435 . 1 1 9 ASP HB2 H -20.587 12.364 20.341 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 3 . 436 . 1 1 9 ASP HB3 H -20.593 12.758 22.057 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 3 . 437 . 1 1 9 ASP N N -22.737 13.427 19.590 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 3 . 438 . 1 1 9 ASP O O -22.417 15.440 22.320 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 3 . 439 . 1 1 9 ASP OD1 O -22.789 10.949 22.200 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 3 . 440 . 1 1 9 ASP OD2 O -21.089 10.053 21.133 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 3 . 441 . 1 1 10 PHE C C -20.606 17.642 19.930 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 3 . 442 . 1 1 10 PHE CA C -20.277 16.651 21.041 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 3 . 443 . 1 1 10 PHE CB C -18.762 16.568 21.237 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 3 . 444 . 1 1 10 PHE CD1 C -19.005 15.519 23.503 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 3 . 445 . 1 1 10 PHE CD2 C -17.316 17.174 23.197 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 3 . 446 . 1 1 10 PHE CE1 C -18.633 15.378 24.826 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 3 . 447 . 1 1 10 PHE CE2 C -16.939 17.039 24.519 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 3 . 448 . 1 1 10 PHE CG C -18.353 16.417 22.674 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 3 . 449 . 1 1 10 PHE CZ C -17.598 16.139 25.335 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 3 . 450 . 1 1 10 PHE H H -20.413 14.800 20.023 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 3 . 451 . 1 1 10 PHE HA H -20.732 16.994 21.959 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 3 . 452 . 1 1 10 PHE HB2 H -18.382 15.716 20.693 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 3 . 453 . 1 1 10 PHE HB3 H -18.305 17.468 20.853 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 3 . 454 . 1 1 10 PHE HD1 H -19.814 14.923 23.106 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 3 . 455 . 1 1 10 PHE HD2 H -16.801 17.878 22.560 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 3 . 456 . 1 1 10 PHE HE1 H -19.150 14.674 25.461 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 3 . 457 . 1 1 10 PHE HE2 H -16.130 17.634 24.915 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 3 . 458 . 1 1 10 PHE HZ H -17.305 16.031 26.369 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 3 . 459 . 1 1 10 PHE N N -20.820 15.332 20.738 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 3 . 460 . 1 1 10 PHE O O -21.325 17.315 18.986 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 3 . 461 . 1 1 11 PHE C C -21.769 20.333 19.058 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 3 . 462 . 1 1 11 PHE CA C -20.307 19.895 19.054 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 3 . 463 . 1 1 11 PHE CB C -19.910 19.401 17.660 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 3 . 464 . 1 1 11 PHE CD1 C -17.533 20.151 17.952 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 3 . 465 . 1 1 11 PHE CD2 C -18.578 20.494 15.836 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 3 . 466 . 1 1 11 PHE CE1 C -16.371 20.727 17.476 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 3 . 467 . 1 1 11 PHE CE2 C -17.419 21.072 15.354 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 3 . 468 . 1 1 11 PHE CG C -18.648 20.027 17.139 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 3 . 469 . 1 1 11 PHE CZ C -16.314 21.189 16.175 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 3 . 470 . 1 1 11 PHE H H -19.507 19.053 20.824 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 3 . 471 . 1 1 11 PHE HA H -19.691 20.743 19.313 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 3 . 472 . 1 1 11 PHE HB2 H -19.760 18.332 17.693 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 3 . 473 . 1 1 11 PHE HB3 H -20.705 19.626 16.964 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 3 . 474 . 1 1 11 PHE HD1 H -17.576 19.790 18.970 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 3 . 475 . 1 1 11 PHE HD2 H -19.442 20.403 15.194 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 3 . 476 . 1 1 11 PHE HE1 H -15.508 20.818 18.119 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 3 . 477 . 1 1 11 PHE HE2 H -17.377 21.431 14.336 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 3 . 478 . 1 1 11 PHE HZ H -15.408 21.640 15.800 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 3 . 479 . 1 1 11 PHE N N -20.072 18.854 20.048 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 3 . 480 . 1 1 11 PHE O O -22.108 21.393 19.584 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 3 . 481 . 1 1 12 NH2 HN1 H -23.580 19.775 18.458 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 3 . 482 . 1 1 12 NH2 HN2 H -22.293 18.689 18.072 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 3 . 483 . 1 1 12 NH2 N N -22.635 19.516 18.470 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 4 . 484 . 1 1 1 HIS C C -24.809 6.718 20.008 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 4 . 485 . 1 1 1 HIS CA C -25.105 7.834 21.005 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 4 . 486 . 1 1 1 HIS CB C -26.524 7.685 21.562 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 4 . 487 . 1 1 1 HIS CD2 C -28.693 8.949 20.909 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 4 . 488 . 1 1 1 HIS CE1 C -28.647 8.572 18.750 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 4 . 489 . 1 1 1 HIS CG C -27.589 8.209 20.649 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 4 . 490 . 1 1 1 HIS H1 H -23.983 9.463 20.340 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 4 . 491 . 1 1 1 HIS H2 H -25.520 9.877 20.909 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 4 . 492 . 1 1 1 HIS H3 H -25.350 9.140 19.396 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 4 . 493 . 1 1 1 HIS HA H -24.397 7.775 21.818 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 4 . 494 . 1 1 1 HIS HB2 H -26.725 6.639 21.738 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 4 . 495 . 1 1 1 HIS HB3 H -26.593 8.221 22.497 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 4 . 496 . 1 1 1 HIS HD1 H -26.916 7.483 18.789 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 4 . 497 . 1 1 1 HIS HD2 H -29.011 9.307 21.878 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 4 . 498 . 1 1 1 HIS HE1 H -28.907 8.566 17.701 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 4 . 499 . 1 1 1 HIS HE2 H -30.110 9.742 19.577 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 4 . 500 . 1 1 1 HIS N N -24.981 9.172 20.368 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 4 . 501 . 1 1 1 HIS ND1 N -27.590 7.989 19.287 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 4 . 502 . 1 1 1 HIS NE2 N -29.333 9.160 19.712 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 4 . 503 . 1 1 1 HIS O O -25.710 6.223 19.331 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 4 . 504 . 1 1 2 ABA C C -23.441 5.667 17.569 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 4 . 505 . 1 1 2 ABA CA C -23.116 5.263 19.011 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 4 . 506 . 1 1 2 ABA H H -22.871 6.760 20.495 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 4 . 507 . 1 1 2 ABA N N -23.541 6.326 19.926 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 4 . 508 . 1 1 2 ABA O O -22.582 6.179 16.852 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 4 . 509 . 1 1 3 GLU C C -25.044 7.286 15.577 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 4 . 510 . 1 1 3 GLU CA C -25.113 5.779 15.801 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 4 . 511 . 1 1 3 GLU CB C -26.538 5.280 15.555 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 4 . 512 . 1 1 3 GLU CD C -28.509 5.723 14.039 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 4 . 513 . 1 1 3 GLU CG C -27.015 5.480 14.126 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 4 . 514 . 1 1 3 GLU H H -25.327 5.027 17.768 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 4 . 515 . 1 1 3 GLU HA H -24.445 5.292 15.107 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 4 . 516 . 1 1 3 GLU HB2 H -26.582 4.225 15.781 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 4 . 517 . 1 1 3 GLU HB3 H -27.211 5.808 16.214 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 4 . 518 . 1 1 3 GLU HG2 H -26.503 6.333 13.705 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 4 . 519 . 1 1 3 GLU HG3 H -26.774 4.597 13.552 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 4 . 520 . 1 1 3 GLU N N -24.684 5.436 17.152 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 4 . 521 . 1 1 3 GLU O O -24.833 7.747 14.455 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 4 . 522 . 1 1 3 GLU OE1 O -29.066 6.340 14.971 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 4 . 523 . 1 1 3 GLU OE2 O -29.123 5.295 13.038 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 4 . 524 . 1 1 4 GLY C C -23.829 10.007 16.080 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 4 . 525 . 1 1 4 GLY CA C -25.177 9.495 16.551 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 4 . 526 . 1 1 4 GLY H H -25.388 7.623 17.520 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 4 . 527 . 1 1 4 GLY HA2 H -25.936 9.820 15.854 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 4 . 528 . 1 1 4 GLY HA3 H -25.391 9.918 17.521 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 4 . 529 . 1 1 4 GLY N N -25.223 8.048 16.651 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 4 . 530 . 1 1 4 GLY O O -23.719 11.137 15.605 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 4 . 531 . 1 1 5 THR C C -20.901 10.670 16.677 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 4 . 532 . 1 1 5 THR CA C -21.453 9.553 15.797 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 4 . 533 . 1 1 5 THR CB C -21.423 10.009 14.325 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 4 . 534 . 1 1 5 THR CG2 C -20.150 9.539 13.637 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 4 . 535 . 1 1 5 THR H H -22.947 8.287 16.598 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 4 . 536 . 1 1 5 THR HA H -20.818 8.684 15.896 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 4 . 537 . 1 1 5 THR HB H -21.453 11.089 14.297 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 4 . 538 . 1 1 5 THR HG1 H -22.875 10.144 12.996 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 4 . 539 . 1 1 5 THR HG21 H -19.709 10.363 13.096 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 4 . 540 . 1 1 5 THR HG22 H -20.386 8.742 12.948 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 4 . 541 . 1 1 5 THR HG23 H -19.451 9.180 14.378 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 4 . 542 . 1 1 5 THR N N -22.799 9.175 16.212 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 4 . 543 . 1 1 5 THR O O -21.624 11.251 17.486 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 4 . 544 . 1 1 5 THR OG1 O -22.565 9.493 13.629 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 4 . 545 . 1 1 6 PHE C C -19.667 13.354 17.099 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 4 . 546 . 1 1 6 PHE CA C -18.967 12.012 17.295 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 4 . 547 . 1 1 6 PHE CB C -17.492 12.132 16.905 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 4 . 548 . 1 1 6 PHE CD1 C -16.694 12.819 19.183 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 4 . 549 . 1 1 6 PHE CD2 C -15.966 14.085 17.297 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 4 . 550 . 1 1 6 PHE CE1 C -15.968 13.644 20.021 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 4 . 551 . 1 1 6 PHE CE2 C -15.239 14.913 18.131 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 4 . 552 . 1 1 6 PHE CG C -16.702 13.030 17.813 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 4 . 553 . 1 1 6 PHE CZ C -15.240 14.692 19.494 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 4 . 554 . 1 1 6 PHE H H -19.090 10.467 15.854 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 4 . 555 . 1 1 6 PHE HA H -19.032 11.736 18.337 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 4 . 556 . 1 1 6 PHE HB2 H -17.040 11.152 16.930 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 4 . 557 . 1 1 6 PHE HB3 H -17.424 12.528 15.902 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 4 . 558 . 1 1 6 PHE HD1 H -17.263 11.999 19.596 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 4 . 559 . 1 1 6 PHE HD2 H -15.965 14.258 16.232 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 4 . 560 . 1 1 6 PHE HE1 H -15.971 13.469 21.087 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 4 . 561 . 1 1 6 PHE HE2 H -14.670 15.732 17.716 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 4 . 562 . 1 1 6 PHE HZ H -14.672 15.339 20.147 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 4 . 563 . 1 1 6 PHE N N -19.615 10.965 16.514 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 4 . 564 . 1 1 6 PHE O O -19.672 14.199 17.994 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 4 . 565 . 1 1 7 THR C C -22.120 15.011 16.575 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 4 . 566 . 1 1 7 THR CA C -20.961 14.781 15.612 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 4 . 567 . 1 1 7 THR CB C -21.501 14.774 14.170 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 4 . 568 . 1 1 7 THR CG2 C -20.426 14.325 13.192 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 4 . 569 . 1 1 7 THR H H -20.220 12.832 15.249 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 4 . 570 . 1 1 7 THR HA H -20.258 15.596 15.708 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 4 . 571 . 1 1 7 THR HB H -21.805 15.778 13.911 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 4 . 572 . 1 1 7 THR HG1 H -22.349 12.993 14.185 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 4 . 573 . 1 1 7 THR HG21 H -20.586 13.289 12.932 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 4 . 574 . 1 1 7 THR HG22 H -19.454 14.436 13.649 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 4 . 575 . 1 1 7 THR HG23 H -20.475 14.931 12.299 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 4 . 576 . 1 1 7 THR N N -20.258 13.542 15.923 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 4 . 577 . 1 1 7 THR O O -22.195 16.048 17.235 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 4 . 578 . 1 1 7 THR OG1 O -22.634 13.903 14.074 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 4 . 579 . 1 1 8 SER C C -23.778 13.905 18.986 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 4 . 580 . 1 1 8 SER CA C -24.180 14.136 17.533 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 4 . 581 . 1 1 8 SER CB C -25.249 13.124 17.120 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 4 . 582 . 1 1 8 SER H H -22.909 13.237 16.099 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 4 . 583 . 1 1 8 SER HA H -24.585 15.133 17.439 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 4 . 584 . 1 1 8 SER HB2 H -24.876 12.123 17.282 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 4 . 585 . 1 1 8 SER HB3 H -26.137 13.277 17.716 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 4 . 586 . 1 1 8 SER HG H -26.507 13.026 15.622 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 4 . 587 . 1 1 8 SER N N -23.023 14.039 16.650 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 4 . 588 . 1 1 8 SER O O -24.371 14.473 19.902 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 4 . 589 . 1 1 8 SER OG O -25.587 13.268 15.752 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 4 . 590 . 1 1 9 ASP C C -21.813 14.025 21.243 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 4 . 591 . 1 1 9 ASP CA C -22.287 12.761 20.532 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 4 . 592 . 1 1 9 ASP CB C -21.151 11.740 20.469 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 4 . 593 . 1 1 9 ASP CG C -21.649 10.313 20.584 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 4 . 594 . 1 1 9 ASP H H -22.334 12.644 18.419 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 4 . 595 . 1 1 9 ASP HA H -23.110 12.337 21.088 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 4 . 596 . 1 1 9 ASP HB2 H -20.632 11.845 19.528 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 4 . 597 . 1 1 9 ASP HB3 H -20.461 11.927 21.279 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 4 . 598 . 1 1 9 ASP N N -22.767 13.067 19.190 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 4 . 599 . 1 1 9 ASP O O -22.351 14.401 22.285 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 4 . 600 . 1 1 9 ASP OD1 O -22.469 9.900 19.736 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 4 . 601 . 1 1 9 ASP OD2 O -21.222 9.608 21.522 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 4 . 602 . 1 1 10 PHE C C -20.956 17.129 20.692 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 4 . 603 . 1 1 10 PHE CA C -20.256 15.896 21.256 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 4 . 604 . 1 1 10 PHE CB C -18.752 15.981 20.991 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 4 . 605 . 1 1 10 PHE CD1 C -17.842 17.726 22.548 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 4 . 606 . 1 1 10 PHE CD2 C -17.311 15.440 22.973 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 4 . 607 . 1 1 10 PHE CE1 C -17.106 18.106 23.655 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 4 . 608 . 1 1 10 PHE CE2 C -16.574 15.814 24.081 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 4 . 609 . 1 1 10 PHE CG C -17.952 16.391 22.195 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 4 . 610 . 1 1 10 PHE CZ C -16.472 17.149 24.422 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 4 . 611 . 1 1 10 PHE H H -20.415 14.325 19.845 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 4 . 612 . 1 1 10 PHE HA H -20.424 15.858 22.322 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 4 . 613 . 1 1 10 PHE HB2 H -18.395 15.014 20.670 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 4 . 614 . 1 1 10 PHE HB3 H -18.570 16.704 20.209 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 4 . 615 . 1 1 10 PHE HD1 H -18.338 18.475 21.949 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 4 . 616 . 1 1 10 PHE HD2 H -17.391 14.397 22.707 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 4 . 617 . 1 1 10 PHE HE1 H -17.027 19.150 23.919 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 4 . 618 . 1 1 10 PHE HE2 H -16.079 15.064 24.679 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 4 . 619 . 1 1 10 PHE HZ H -15.896 17.443 25.287 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 4 . 620 . 1 1 10 PHE N N -20.803 14.675 20.675 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 4 . 621 . 1 1 10 PHE O O -21.489 17.100 19.582 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 4 . 622 . 1 1 11 PHE C C -20.926 19.998 19.777 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 4 . 623 . 1 1 11 PHE CA C -21.585 19.455 21.041 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 4 . 624 . 1 1 11 PHE CB C -21.508 20.497 22.158 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 4 . 625 . 1 1 11 PHE CD1 C -23.931 20.240 22.759 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 4 . 626 . 1 1 11 PHE CD2 C -22.336 20.399 24.525 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 4 . 627 . 1 1 11 PHE CE1 C -24.950 20.129 23.685 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 4 . 628 . 1 1 11 PHE CE2 C -23.351 20.289 25.456 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 4 . 629 . 1 1 11 PHE CG C -22.614 20.376 23.167 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 4 . 630 . 1 1 11 PHE CZ C -24.660 20.154 25.035 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 4 . 631 . 1 1 11 PHE H H -20.510 18.173 22.338 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 4 . 632 . 1 1 11 PHE HA H -22.622 19.242 20.829 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 4 . 633 . 1 1 11 PHE HB2 H -20.569 20.386 22.680 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 4 . 634 . 1 1 11 PHE HB3 H -21.559 21.484 21.723 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 4 . 635 . 1 1 11 PHE HD1 H -24.159 20.220 21.703 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 4 . 636 . 1 1 11 PHE HD2 H -21.313 20.505 24.854 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 4 . 637 . 1 1 11 PHE HE1 H -25.973 20.024 23.354 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 4 . 638 . 1 1 11 PHE HE2 H -23.122 20.308 26.511 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 4 . 639 . 1 1 11 PHE HZ H -25.455 20.067 25.761 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 4 . 640 . 1 1 11 PHE N N -20.951 18.211 21.464 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 4 . 641 . 1 1 11 PHE O O -19.707 20.152 19.717 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 4 . 642 . 1 1 12 NH2 HN1 H -21.339 20.641 17.941 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 4 . 643 . 1 1 12 NH2 HN2 H -22.697 20.141 18.884 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 4 . 644 . 1 1 12 NH2 N N -21.736 20.290 18.765 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 5 . 645 . 1 1 1 HIS C C -23.922 6.249 19.971 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 5 . 646 . 1 1 1 HIS CA C -24.824 6.238 21.201 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 5 . 647 . 1 1 1 HIS CB C -25.683 7.504 21.239 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 5 . 648 . 1 1 1 HIS CD2 C -26.007 8.031 23.758 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 5 . 649 . 1 1 1 HIS CE1 C -28.172 7.705 23.879 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 5 . 650 . 1 1 1 HIS CG C -26.434 7.678 22.523 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 5 . 651 . 1 1 1 HIS H1 H -24.639 5.934 23.256 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 5 . 652 . 1 1 1 HIS H2 H -23.572 7.090 22.636 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 5 . 653 . 1 1 1 HIS H3 H -23.286 5.445 22.365 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 5 . 654 . 1 1 1 HIS HA H -25.468 5.373 21.158 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 5 . 655 . 1 1 1 HIS HB2 H -25.048 8.367 21.107 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 5 . 656 . 1 1 1 HIS HB3 H -26.403 7.466 20.434 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 5 . 657 . 1 1 1 HIS HD1 H -28.395 7.215 21.905 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 5 . 658 . 1 1 1 HIS HD2 H -24.990 8.263 24.043 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 5 . 659 . 1 1 1 HIS HE1 H -29.180 7.627 24.258 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 5 . 660 . 1 1 1 HIS HE2 H -27.111 8.315 25.522 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 5 . 661 . 1 1 1 HIS N N -24.024 6.172 22.452 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 5 . 662 . 1 1 1 HIS ND1 N -27.795 7.480 22.632 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 5 . 663 . 1 1 1 HIS NE2 N -27.106 8.040 24.581 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 5 . 664 . 1 1 1 HIS O O -23.474 7.306 19.525 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 5 . 665 . 1 1 2 ABA C C -23.405 5.733 17.087 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 5 . 666 . 1 1 2 ABA CA C -22.803 4.932 18.245 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 5 . 667 . 1 1 2 ABA H H -24.043 4.258 19.830 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 5 . 668 . 1 1 2 ABA N N -23.657 5.064 19.428 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 5 . 669 . 1 1 2 ABA O O -22.724 6.545 16.459 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 5 . 670 . 1 1 3 GLU C C -25.264 7.710 15.898 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 5 . 671 . 1 1 3 GLU CA C -25.377 6.196 15.733 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 5 . 672 . 1 1 3 GLU CB C -26.850 5.785 15.693 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 5 . 673 . 1 1 3 GLU CD C -27.031 6.258 13.218 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 5 . 674 . 1 1 3 GLU CG C -27.643 6.466 14.589 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 5 . 675 . 1 1 3 GLU H H -25.176 4.841 17.348 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 5 . 676 . 1 1 3 GLU HA H -24.909 5.913 14.803 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 5 . 677 . 1 1 3 GLU HB2 H -26.910 4.717 15.543 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 5 . 678 . 1 1 3 GLU HB3 H -27.307 6.033 16.640 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 5 . 679 . 1 1 3 GLU HG2 H -28.646 6.065 14.583 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 5 . 680 . 1 1 3 GLU HG3 H -27.682 7.526 14.793 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 5 . 681 . 1 1 3 GLU N N -24.685 5.499 16.813 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 5 . 682 . 1 1 3 GLU O O -25.316 8.455 14.920 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 5 . 683 . 1 1 3 GLU OE1 O -26.652 5.110 12.905 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 5 . 684 . 1 1 3 GLU OE2 O -26.931 7.243 12.456 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 5 . 685 . 1 1 4 GLY C C -23.707 10.165 16.847 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 5 . 686 . 1 1 4 GLY CA C -24.988 9.578 17.406 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 5 . 687 . 1 1 4 GLY H H -25.072 7.517 17.881 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 5 . 688 . 1 1 4 GLY HA2 H -25.830 10.088 16.960 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 5 . 689 . 1 1 4 GLY HA3 H -25.009 9.737 18.474 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 5 . 690 . 1 1 4 GLY N N -25.107 8.157 17.140 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 5 . 691 . 1 1 4 GLY O O -23.717 11.247 16.259 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 5 . 692 . 1 1 5 THR C C -20.995 11.320 17.017 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 5 . 693 . 1 1 5 THR CA C -21.304 9.903 16.541 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 5 . 694 . 1 1 5 THR CB C -21.240 9.866 15.002 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 5 . 695 . 1 1 5 THR CG2 C -19.870 9.406 14.527 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 5 . 696 . 1 1 5 THR H H -22.660 8.595 17.507 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 5 . 697 . 1 1 5 THR HA H -20.550 9.233 16.927 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 5 . 698 . 1 1 5 THR HB H -21.420 10.862 14.623 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 5 . 699 . 1 1 5 THR HG1 H -23.076 9.460 14.403 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 5 . 700 . 1 1 5 THR HG21 H -19.361 8.898 15.334 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 5 . 701 . 1 1 5 THR HG22 H -19.289 10.263 14.219 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 5 . 702 . 1 1 5 THR HG23 H -19.985 8.731 13.693 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 5 . 703 . 1 1 5 THR N N -22.601 9.450 17.031 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 5 . 704 . 1 1 5 THR O O -21.783 11.927 17.742 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 5 . 705 . 1 1 5 THR OG1 O -22.247 8.984 14.491 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 5 . 706 . 1 1 6 PHE C C -20.400 14.231 16.434 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 5 . 707 . 1 1 6 PHE CA C -19.433 13.186 16.985 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 5 . 708 . 1 1 6 PHE CB C -18.016 13.470 16.482 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 5 . 709 . 1 1 6 PHE CD1 C -16.907 14.782 18.311 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 5 . 710 . 1 1 6 PHE CD2 C -17.394 15.891 16.257 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 5 . 711 . 1 1 6 PHE CE1 C -16.364 15.949 18.816 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 5 . 712 . 1 1 6 PHE CE2 C -16.853 17.060 16.756 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 5 . 713 . 1 1 6 PHE CG C -17.428 14.740 17.028 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 5 . 714 . 1 1 6 PHE CZ C -16.337 17.089 18.037 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 5 . 715 . 1 1 6 PHE H H -19.260 11.308 16.025 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 5 . 716 . 1 1 6 PHE HA H -19.439 13.241 18.063 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 5 . 717 . 1 1 6 PHE HB2 H -17.370 12.655 16.769 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 5 . 718 . 1 1 6 PHE HB3 H -18.034 13.547 15.404 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 5 . 719 . 1 1 6 PHE HD1 H -16.928 13.891 18.921 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 5 . 720 . 1 1 6 PHE HD2 H -17.798 15.869 15.255 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 5 . 721 . 1 1 6 PHE HE1 H -15.962 15.969 19.818 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 5 . 722 . 1 1 6 PHE HE2 H -16.833 17.950 16.144 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 5 . 723 . 1 1 6 PHE HZ H -15.914 18.002 18.429 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 5 . 724 . 1 1 6 PHE N N -19.845 11.841 16.603 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 5 . 725 . 1 1 6 PHE O O -20.551 15.312 17.004 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 5 . 726 . 1 1 7 THR C C -23.094 15.234 15.675 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 5 . 727 . 1 1 7 THR CA C -22.004 14.812 14.695 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 5 . 728 . 1 1 7 THR CB C -22.663 14.170 13.460 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 5 . 729 . 1 1 7 THR CG2 C -23.502 15.189 12.703 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 5 . 730 . 1 1 7 THR H H -20.890 13.026 14.915 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 5 . 731 . 1 1 7 THR HA H -21.464 15.690 14.373 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 5 . 732 . 1 1 7 THR HB H -23.309 13.369 13.790 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 5 . 733 . 1 1 7 THR HG1 H -21.396 12.763 12.905 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 5 . 734 . 1 1 7 THR HG21 H -24.544 15.055 12.953 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 5 . 735 . 1 1 7 THR HG22 H -23.366 15.049 11.640 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 5 . 736 . 1 1 7 THR HG23 H -23.191 16.186 12.977 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 5 . 737 . 1 1 7 THR N N -21.052 13.901 15.323 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 5 . 738 . 1 1 7 THR O O -23.243 16.416 15.981 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 5 . 739 . 1 1 7 THR OG1 O -21.658 13.632 12.592 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 5 . 740 . 1 1 8 SER C C -24.385 14.693 18.523 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 5 . 741 . 1 1 8 SER CA C -24.931 14.530 17.108 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 5 . 742 . 1 1 8 SER CB C -25.963 13.401 17.074 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 5 . 743 . 1 1 8 SER H H -23.687 13.335 15.881 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 5 . 744 . 1 1 8 SER HA H -25.409 15.451 16.811 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 5 . 745 . 1 1 8 SER HB2 H -26.881 13.741 17.529 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 5 . 746 . 1 1 8 SER HB3 H -26.152 13.119 16.049 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 5 . 747 . 1 1 8 SER HG H -25.492 12.453 18.723 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 5 . 748 . 1 1 8 SER N N -23.854 14.259 16.163 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 5 . 749 . 1 1 8 SER O O -24.851 15.539 19.285 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 5 . 750 . 1 1 8 SER OG O -25.499 12.264 17.782 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 5 . 751 . 1 1 9 ASP C C -22.144 15.292 20.446 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 5 . 752 . 1 1 9 ASP CA C -22.784 13.930 20.190 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 5 . 753 . 1 1 9 ASP CB C -21.735 12.826 20.335 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 5 . 754 . 1 1 9 ASP CG C -21.160 12.755 21.736 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 5 . 755 . 1 1 9 ASP H H -23.066 13.223 18.215 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 5 . 756 . 1 1 9 ASP HA H -23.563 13.770 20.920 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 5 . 757 . 1 1 9 ASP HB2 H -22.188 11.874 20.104 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 5 . 758 . 1 1 9 ASP HB3 H -20.927 13.013 19.643 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 5 . 759 . 1 1 9 ASP N N -23.394 13.877 18.867 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 5 . 760 . 1 1 9 ASP O O -21.992 15.709 21.594 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 5 . 761 . 1 1 9 ASP OD1 O -21.952 12.716 22.701 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 5 . 762 . 1 1 9 ASP OD2 O -19.918 12.740 21.869 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 5 . 763 . 1 1 10 PHE C C -19.803 17.206 20.195 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 5 . 764 . 1 1 10 PHE CA C -21.147 17.296 19.477 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 5 . 765 . 1 1 10 PHE CB C -22.078 18.269 20.210 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 5 . 766 . 1 1 10 PHE CD1 C -20.925 20.366 19.449 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 5 . 767 . 1 1 10 PHE CD2 C -21.412 20.120 21.770 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 5 . 768 . 1 1 10 PHE CE1 C -20.356 21.601 19.696 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 5 . 769 . 1 1 10 PHE CE2 C -20.843 21.354 22.024 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 5 . 770 . 1 1 10 PHE CG C -21.459 19.612 20.482 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 5 . 771 . 1 1 10 PHE CZ C -20.315 22.095 20.985 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 5 . 772 . 1 1 10 PHE H H -21.917 15.595 18.481 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 5 . 773 . 1 1 10 PHE HA H -20.979 17.662 18.475 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 5 . 774 . 1 1 10 PHE HB2 H -22.962 18.428 19.612 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 5 . 775 . 1 1 10 PHE HB3 H -22.365 17.838 21.158 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 5 . 776 . 1 1 10 PHE HD1 H -20.957 19.980 18.440 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 5 . 777 . 1 1 10 PHE HD2 H -21.824 19.541 22.583 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 5 . 778 . 1 1 10 PHE HE1 H -19.943 22.178 18.882 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 5 . 779 . 1 1 10 PHE HE2 H -20.812 21.738 23.032 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 5 . 780 . 1 1 10 PHE HZ H -19.870 23.060 21.180 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 5 . 781 . 1 1 10 PHE N N -21.771 15.980 19.369 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 5 . 782 . 1 1 10 PHE O O -18.749 17.207 19.560 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 5 . 783 . 1 1 11 PHE C C -18.944 16.579 23.739 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 5 . 784 . 1 1 11 PHE CA C -18.630 17.044 22.321 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 5 . 785 . 1 1 11 PHE CB C -17.925 18.401 22.361 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 5 . 786 . 1 1 11 PHE CD1 C -15.809 17.720 23.525 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 5 . 787 . 1 1 11 PHE CD2 C -15.640 18.780 21.395 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 5 . 788 . 1 1 11 PHE CE1 C -14.432 17.625 23.590 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 5 . 789 . 1 1 11 PHE CE2 C -14.263 18.688 21.455 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 5 . 790 . 1 1 11 PHE CG C -16.428 18.298 22.428 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 5 . 791 . 1 1 11 PHE CZ C -13.658 18.110 22.554 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 5 . 792 . 1 1 11 PHE H H -20.715 17.137 21.973 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 5 . 793 . 1 1 11 PHE HA H -17.977 16.322 21.854 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 5 . 794 . 1 1 11 PHE HB2 H -18.179 18.957 21.471 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 5 . 795 . 1 1 11 PHE HB3 H -18.261 18.947 23.230 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 5 . 796 . 1 1 11 PHE HD1 H -16.414 17.341 24.335 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 5 . 797 . 1 1 11 PHE HD2 H -16.113 19.232 20.536 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 5 . 798 . 1 1 11 PHE HE1 H -13.962 17.173 24.451 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 5 . 799 . 1 1 11 PHE HE2 H -13.660 19.067 20.643 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 5 . 800 . 1 1 11 PHE HZ H -12.582 18.036 22.603 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 5 . 801 . 1 1 11 PHE N N -19.846 17.132 21.521 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 5 . 802 . 1 1 11 PHE O O -18.282 15.690 24.273 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 5 . 803 . 1 1 12 NH2 HN1 H -20.182 16.904 25.262 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 5 . 804 . 1 1 12 NH2 HN2 H -20.441 17.883 23.862 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 5 . 805 . 1 1 12 NH2 N N -19.958 17.183 24.349 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 6 . 806 . 1 1 1 HIS C C -24.527 6.436 20.178 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 6 . 807 . 1 1 1 HIS CA C -25.650 6.085 21.148 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 6 . 808 . 1 1 1 HIS CB C -26.814 7.067 20.989 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 6 . 809 . 1 1 1 HIS CD2 C -27.241 8.981 22.689 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 6 . 810 . 1 1 1 HIS CE1 C -25.634 10.333 22.061 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 6 . 811 . 1 1 1 HIS CG C -26.588 8.386 21.662 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 6 . 812 . 1 1 1 HIS H1 H -24.631 5.272 22.777 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 6 . 813 . 1 1 1 HIS H2 H -25.988 6.187 23.205 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 6 . 814 . 1 1 1 HIS H3 H -24.570 6.962 22.704 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 6 . 815 . 1 1 1 HIS HA H -25.998 5.085 20.935 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 6 . 816 . 1 1 1 HIS HB2 H -26.975 7.256 19.938 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 6 . 817 . 1 1 1 HIS HB3 H -27.706 6.627 21.410 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 6 . 818 . 1 1 1 HIS HD1 H -24.938 9.115 20.571 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 6 . 819 . 1 1 1 HIS HD2 H -28.087 8.578 23.229 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 6 . 820 . 1 1 1 HIS HE1 H -24.972 11.184 22.000 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 6 . 821 . 1 1 1 HIS HE2 H -26.832 10.800 23.654 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 6 . 822 . 1 1 1 HIS N N -25.177 6.130 22.556 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 6 . 823 . 1 1 1 HIS ND1 N -25.587 9.260 21.291 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 6 . 824 . 1 1 1 HIS NE2 N -26.629 10.188 22.916 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 6 . 825 . 1 1 1 HIS O O -24.426 7.571 19.713 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 6 . 826 . 1 1 2 ABA C C -23.089 6.095 17.589 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 6 . 827 . 1 1 2 ABA CA C -22.562 5.655 18.958 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 6 . 828 . 1 1 2 ABA H H -23.819 4.569 20.279 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 6 . 829 . 1 1 2 ABA N N -23.685 5.452 19.876 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 6 . 830 . 1 1 2 ABA O O -22.399 6.788 16.843 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 6 . 831 . 1 1 3 GLU C C -24.916 7.552 15.779 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 6 . 832 . 1 1 3 GLU CA C -24.928 6.040 15.992 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 6 . 833 . 1 1 3 GLU CB C -26.363 5.512 15.929 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 6 . 834 . 1 1 3 GLU CD C -28.139 4.359 14.550 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 6 . 835 . 1 1 3 GLU CG C -26.688 4.790 14.631 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 6 . 836 . 1 1 3 GLU H H -24.817 5.135 17.903 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 6 . 837 . 1 1 3 GLU HA H -24.349 5.575 15.208 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 6 . 838 . 1 1 3 GLU HB2 H -26.517 4.823 16.747 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 6 . 839 . 1 1 3 GLU HB3 H -27.047 6.341 16.036 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 6 . 840 . 1 1 3 GLU HG2 H -26.479 5.453 13.805 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 6 . 841 . 1 1 3 GLU HG3 H -26.061 3.913 14.556 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 6 . 842 . 1 1 3 GLU N N -24.314 5.687 17.268 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 6 . 843 . 1 1 3 GLU O O -24.873 8.028 14.645 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 6 . 844 . 1 1 3 GLU OE1 O -28.451 3.240 15.008 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 6 . 845 . 1 1 3 GLU OE2 O -28.962 5.139 14.028 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 6 . 846 . 1 1 4 GLY C C -23.632 10.287 16.247 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 6 . 847 . 1 1 4 GLY CA C -24.942 9.749 16.787 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 6 . 848 . 1 1 4 GLY H H -24.984 7.867 17.755 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 6 . 849 . 1 1 4 GLY HA2 H -25.744 10.064 16.135 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 6 . 850 . 1 1 4 GLY HA3 H -25.109 10.161 17.771 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 6 . 851 . 1 1 4 GLY N N -24.952 8.301 16.877 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 6 . 852 . 1 1 4 GLY O O -23.596 11.358 15.641 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 6 . 853 . 1 1 5 THR C C -20.862 11.334 16.522 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 6 . 854 . 1 1 5 THR CA C -21.230 9.949 16.001 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 6 . 855 . 1 1 5 THR CB C -21.152 9.954 14.462 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 6 . 856 . 1 1 5 THR CG2 C -21.780 8.695 13.883 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 6 . 857 . 1 1 5 THR H H -22.646 8.700 16.958 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 6 . 858 . 1 1 5 THR HA H -20.512 9.233 16.374 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 6 . 859 . 1 1 5 THR HB H -20.112 9.985 14.170 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 6 . 860 . 1 1 5 THR HG1 H -21.283 11.502 13.247 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 6 . 861 . 1 1 5 THR HG21 H -21.728 7.898 14.610 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 6 . 862 . 1 1 5 THR HG22 H -21.246 8.403 12.991 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 6 . 863 . 1 1 5 THR HG23 H -22.813 8.889 13.636 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 6 . 864 . 1 1 5 THR N N -22.552 9.543 16.468 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 6 . 865 . 1 1 5 THR O O -21.581 11.912 17.337 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 6 . 866 . 1 1 5 THR OG1 O -21.819 11.109 13.939 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 6 . 867 . 1 1 6 PHE C C -20.332 14.245 16.206 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 6 . 868 . 1 1 6 PHE CA C -19.271 13.179 16.467 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 6 . 869 . 1 1 6 PHE CB C -17.976 13.540 15.732 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 6 . 870 . 1 1 6 PHE CD1 C -17.470 15.389 17.354 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 6 . 871 . 1 1 6 PHE CD2 C -16.978 15.739 15.046 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 6 . 872 . 1 1 6 PHE CE1 C -17.001 16.655 17.649 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 6 . 873 . 1 1 6 PHE CE2 C -16.509 17.006 15.336 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 6 . 874 . 1 1 6 PHE CG C -17.464 14.917 16.051 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 6 . 875 . 1 1 6 PHE CZ C -16.520 17.464 16.638 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 6 . 876 . 1 1 6 PHE H H -19.207 11.351 15.401 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 6 . 877 . 1 1 6 PHE HA H -19.072 13.138 17.527 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 6 . 878 . 1 1 6 PHE HB2 H -17.209 12.831 16.001 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 6 . 879 . 1 1 6 PHE HB3 H -18.150 13.488 14.667 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 6 . 880 . 1 1 6 PHE HD1 H -17.847 14.757 18.145 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 6 . 881 . 1 1 6 PHE HD2 H -16.969 15.382 14.027 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 6 . 882 . 1 1 6 PHE HE1 H -17.011 17.011 18.668 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 6 . 883 . 1 1 6 PHE HE2 H -16.132 17.637 14.544 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 6 . 884 . 1 1 6 PHE HZ H -16.153 18.454 16.866 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 6 . 885 . 1 1 6 PHE N N -19.737 11.861 16.048 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 6 . 886 . 1 1 6 PHE O O -20.461 15.205 16.966 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 6 . 887 . 1 1 7 THR C C -23.163 15.163 15.882 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 6 . 888 . 1 1 7 THR CA C -22.134 15.021 14.765 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 6 . 889 . 1 1 7 THR CB C -22.852 14.597 13.470 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 6 . 890 . 1 1 7 THR CG2 C -23.257 15.815 12.654 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 6 . 891 . 1 1 7 THR H H -20.936 13.288 14.558 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 6 . 892 . 1 1 7 THR HA H -21.668 15.980 14.595 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 6 . 893 . 1 1 7 THR HB H -23.742 14.046 13.733 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 6 . 894 . 1 1 7 THR HG1 H -21.112 14.135 12.663 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 6 . 895 . 1 1 7 THR HG21 H -22.526 15.989 11.878 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 6 . 896 . 1 1 7 THR HG22 H -23.310 16.679 13.299 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 6 . 897 . 1 1 7 THR HG23 H -24.224 15.642 12.205 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 6 . 898 . 1 1 7 THR N N -21.087 14.071 15.127 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 6 . 899 . 1 1 7 THR O O -23.376 16.256 16.407 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 6 . 900 . 1 1 7 THR OG1 O -21.995 13.757 12.687 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 6 . 901 . 1 1 8 SER C C -24.157 14.113 18.672 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 6 . 902 . 1 1 8 SER CA C -24.808 14.057 17.293 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 6 . 903 . 1 1 8 SER CB C -25.696 12.816 17.182 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 6 . 904 . 1 1 8 SER H H -23.588 13.212 15.784 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 6 . 905 . 1 1 8 SER HA H -25.420 14.938 17.162 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 6 . 906 . 1 1 8 SER HB2 H -25.538 12.348 16.222 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 6 . 907 . 1 1 8 SER HB3 H -25.441 12.120 17.968 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 6 . 908 . 1 1 8 SER HG H -27.180 13.777 18.026 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 6 . 909 . 1 1 8 SER N N -23.800 14.053 16.239 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 6 . 910 . 1 1 8 SER O O -24.734 14.648 19.620 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 6 . 911 . 1 1 8 SER OG O -27.066 13.157 17.302 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 6 . 912 . 1 1 9 ASP C C -21.947 14.966 20.525 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 6 . 913 . 1 1 9 ASP CA C -22.226 13.546 20.042 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 6 . 914 . 1 1 9 ASP CB C -20.911 12.779 19.890 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 6 . 915 . 1 1 9 ASP CG C -21.106 11.277 19.964 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 6 . 916 . 1 1 9 ASP H H -22.546 13.147 17.987 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 6 . 917 . 1 1 9 ASP HA H -22.842 13.045 20.773 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 6 . 918 . 1 1 9 ASP HB2 H -20.470 13.019 18.935 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 6 . 919 . 1 1 9 ASP HB3 H -20.236 13.076 20.680 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 6 . 920 . 1 1 9 ASP N N -22.954 13.558 18.778 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 6 . 921 . 1 1 9 ASP O O -21.813 15.207 21.724 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 6 . 922 . 1 1 9 ASP OD1 O -22.151 10.839 20.490 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 6 . 923 . 1 1 9 ASP OD2 O -20.214 10.539 19.496 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 6 . 924 . 1 1 10 PHE C C -20.222 17.460 20.556 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 6 . 925 . 1 1 10 PHE CA C -21.596 17.300 19.910 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 6 . 926 . 1 1 10 PHE CB C -22.682 17.843 20.842 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 6 . 927 . 1 1 10 PHE CD1 C -24.466 17.557 19.100 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 6 . 928 . 1 1 10 PHE CD2 C -24.511 19.517 20.458 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 6 . 929 . 1 1 10 PHE CE1 C -25.596 17.989 18.433 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 6 . 930 . 1 1 10 PHE CE2 C -25.642 19.954 19.795 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 6 . 931 . 1 1 10 PHE CG C -23.911 18.315 20.119 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 6 . 932 . 1 1 10 PHE CZ C -26.185 19.189 18.781 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 6 . 933 . 1 1 10 PHE H H -21.974 15.647 18.644 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 6 . 934 . 1 1 10 PHE HA H -21.612 17.862 18.989 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 6 . 935 . 1 1 10 PHE HB2 H -22.981 17.066 21.530 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 6 . 936 . 1 1 10 PHE HB3 H -22.283 18.677 21.401 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 6 . 937 . 1 1 10 PHE HD1 H -24.006 16.618 18.828 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 6 . 938 . 1 1 10 PHE HD2 H -24.087 20.116 21.251 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 6 . 939 . 1 1 10 PHE HE1 H -26.019 17.389 17.641 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 6 . 940 . 1 1 10 PHE HE2 H -26.101 20.893 20.069 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 6 . 941 . 1 1 10 PHE HZ H -27.068 19.529 18.261 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 6 . 942 . 1 1 10 PHE N N -21.859 15.902 19.583 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 6 . 943 . 1 1 10 PHE O O -19.261 17.862 19.900 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 6 . 944 . 1 1 11 PHE C C -18.800 16.205 23.680 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 6 . 945 . 1 1 11 PHE CA C -18.878 17.253 22.575 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 6 . 946 . 1 1 11 PHE CB C -18.731 18.653 23.173 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 6 . 947 . 1 1 11 PHE CD1 C -20.982 19.589 23.771 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 6 . 948 . 1 1 11 PHE CD2 C -19.614 18.717 25.520 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 6 . 949 . 1 1 11 PHE CE1 C -21.964 19.903 24.692 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 6 . 950 . 1 1 11 PHE CE2 C -20.593 19.029 26.445 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 6 . 951 . 1 1 11 PHE CG C -19.797 18.993 24.175 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 6 . 952 . 1 1 11 PHE CZ C -21.769 19.622 26.030 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 6 . 953 . 1 1 11 PHE H H -20.936 16.828 22.314 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 6 . 954 . 1 1 11 PHE HA H -18.073 17.083 21.876 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 6 . 955 . 1 1 11 PHE HB2 H -17.775 18.727 23.668 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 6 . 956 . 1 1 11 PHE HB3 H -18.776 19.383 22.377 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 6 . 957 . 1 1 11 PHE HD1 H -21.136 19.809 22.725 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 6 . 958 . 1 1 11 PHE HD2 H -18.695 18.253 25.845 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 6 . 959 . 1 1 11 PHE HE1 H -22.883 20.367 24.365 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 6 . 960 . 1 1 11 PHE HE2 H -20.438 18.808 27.491 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 6 . 961 . 1 1 11 PHE HZ H -22.536 19.866 26.751 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 6 . 962 . 1 1 11 PHE N N -20.135 17.144 21.844 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 6 . 963 . 1 1 11 PHE O O -19.773 15.502 23.954 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 6 . 964 . 1 1 12 NH2 HN1 H -17.561 15.434 25.031 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 6 . 965 . 1 1 12 NH2 HN2 H -16.907 16.692 24.044 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 6 . 966 . 1 1 12 NH2 N N -17.639 16.100 24.316 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 7 . 967 . 1 1 1 HIS C C -24.642 6.768 20.063 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 7 . 968 . 1 1 1 HIS CA C -25.023 7.899 21.014 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 7 . 969 . 1 1 1 HIS CB C -26.350 8.536 20.591 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 7 . 970 . 1 1 1 HIS CD2 C -28.100 7.765 22.343 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 7 . 971 . 1 1 1 HIS CE1 C -28.501 9.708 23.274 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 7 . 972 . 1 1 1 HIS CG C -27.328 8.683 21.715 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 7 . 973 . 1 1 1 HIS H1 H -24.330 9.797 21.538 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 7 . 974 . 1 1 1 HIS H2 H -23.724 9.228 20.065 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 7 . 975 . 1 1 1 HIS H3 H -23.126 8.607 21.520 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 7 . 976 . 1 1 1 HIS HA H -25.122 7.498 22.011 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 7 . 977 . 1 1 1 HIS HB2 H -26.157 9.520 20.190 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 7 . 978 . 1 1 1 HIS HB3 H -26.810 7.926 19.828 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 7 . 979 . 1 1 1 HIS HD1 H -27.199 10.753 22.090 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 7 . 980 . 1 1 1 HIS HD2 H -28.142 6.707 22.125 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 7 . 981 . 1 1 1 HIS HE1 H -28.907 10.477 23.915 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 7 . 982 . 1 1 1 HIS HE2 H -29.532 8.037 23.854 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 7 . 983 . 1 1 1 HIS N N -23.978 8.956 21.036 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 7 . 984 . 1 1 1 HIS ND1 N -27.603 9.891 22.322 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 7 . 985 . 1 1 1 HIS NE2 N -28.819 8.428 23.307 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 7 . 986 . 1 1 1 HIS O O -25.460 6.308 19.266 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 7 . 987 . 1 1 2 ABA C C -23.044 5.625 17.834 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 7 . 988 . 1 1 2 ABA CA C -22.888 5.241 19.312 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 7 . 989 . 1 1 2 ABA H H -22.795 6.733 20.818 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 7 . 990 . 1 1 2 ABA N N -23.394 6.325 20.159 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 7 . 991 . 1 1 2 ABA O O -22.126 6.183 17.231 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 7 . 992 . 1 1 3 GLU C C -24.522 7.157 15.646 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 7 . 993 . 1 1 3 GLU CA C -24.468 5.648 15.858 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 7 . 994 . 1 1 3 GLU CB C -25.780 5.009 15.401 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 7 . 995 . 1 1 3 GLU CD C -27.983 4.295 16.410 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 7 . 996 . 1 1 3 GLU CG C -26.981 5.419 16.237 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 7 . 997 . 1 1 3 GLU H H -24.905 4.887 17.783 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 7 . 998 . 1 1 3 GLU HA H -23.657 5.243 15.270 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 7 . 999 . 1 1 3 GLU HB2 H -25.968 5.294 14.377 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 7 . 1000 . 1 1 3 GLU HB3 H -25.682 3.935 15.455 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 7 . 1001 . 1 1 3 GLU HG2 H -26.636 5.726 17.214 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 7 . 1002 . 1 1 3 GLU HG3 H -27.474 6.250 15.753 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 7 . 1003 . 1 1 3 GLU N N -24.207 5.328 17.257 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 7 . 1004 . 1 1 3 GLU O O -24.279 7.648 14.543 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 7 . 1005 . 1 1 3 GLU OE1 O -27.623 3.268 17.023 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 7 . 1006 . 1 1 3 GLU OE2 O -29.127 4.440 15.930 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 7 . 1007 . 1 1 4 GLY C C -23.633 9.956 16.105 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 7 . 1008 . 1 1 4 GLY CA C -24.918 9.336 16.618 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 7 . 1009 . 1 1 4 GLY H H -25.023 7.446 17.563 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 7 . 1010 . 1 1 4 GLY HA2 H -25.725 9.601 15.950 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 7 . 1011 . 1 1 4 GLY HA3 H -25.131 9.735 17.598 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 7 . 1012 . 1 1 4 GLY N N -24.841 7.890 16.709 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 7 . 1013 . 1 1 4 GLY O O -23.649 11.041 15.522 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 7 . 1014 . 1 1 5 THR C C -20.932 11.151 16.414 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 7 . 1015 . 1 1 5 THR CA C -21.215 9.752 15.875 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 7 . 1016 . 1 1 5 THR CB C -21.119 9.776 14.337 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 7 . 1017 . 1 1 5 THR CG2 C -21.665 8.487 13.738 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 7 . 1018 . 1 1 5 THR H H -22.569 8.406 16.790 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 7 . 1019 . 1 1 5 THR HA H -20.461 9.076 16.250 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 7 . 1020 . 1 1 5 THR HB H -20.079 9.871 14.058 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 7 . 1021 . 1 1 5 THR HG1 H -21.775 10.904 12.858 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 7 . 1022 . 1 1 5 THR HG21 H -22.660 8.662 13.356 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 7 . 1023 . 1 1 5 THR HG22 H -21.701 7.723 14.501 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 7 . 1024 . 1 1 5 THR HG23 H -21.022 8.163 12.933 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 7 . 1025 . 1 1 5 THR N N -22.517 9.265 16.320 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 7 . 1026 . 1 1 5 THR O O -21.652 11.653 17.278 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 7 . 1027 . 1 1 5 THR OG1 O -21.846 10.894 13.815 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 7 . 1028 . 1 1 6 PHE C C -20.663 14.087 16.235 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 7 . 1029 . 1 1 6 PHE CA C -19.488 13.115 16.326 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 7 . 1030 . 1 1 6 PHE CB C -18.323 13.622 15.473 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 7 . 1031 . 1 1 6 PHE CD1 C -17.706 15.390 17.143 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 7 . 1032 . 1 1 6 PHE CD2 C -17.647 15.950 14.826 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 7 . 1033 . 1 1 6 PHE CE1 C -17.302 16.672 17.466 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 7 . 1034 . 1 1 6 PHE CE2 C -17.242 17.233 15.143 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 7 . 1035 . 1 1 6 PHE CG C -17.883 15.016 15.821 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 7 . 1036 . 1 1 6 PHE CZ C -17.070 17.594 16.465 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 7 . 1037 . 1 1 6 PHE H H -19.342 11.318 15.216 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 7 . 1038 . 1 1 6 PHE HA H -19.166 13.054 17.355 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 7 . 1039 . 1 1 6 PHE HB2 H -17.477 12.965 15.605 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 7 . 1040 . 1 1 6 PHE HB3 H -18.619 13.616 14.434 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 7 . 1041 . 1 1 6 PHE HD1 H -17.887 14.669 17.927 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 7 . 1042 . 1 1 6 PHE HD2 H -17.782 15.669 13.792 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 7 . 1043 . 1 1 6 PHE HE1 H -17.168 16.951 18.501 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 7 . 1044 . 1 1 6 PHE HE2 H -17.062 17.953 14.358 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 7 . 1045 . 1 1 6 PHE HZ H -16.754 18.596 16.715 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 7 . 1046 . 1 1 6 PHE N N -19.876 11.774 15.900 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 7 . 1047 . 1 1 6 PHE O O -20.781 15.009 17.043 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 7 . 1048 . 1 1 7 THR C C -23.518 14.853 16.331 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 7 . 1049 . 1 1 7 THR CA C -22.691 14.739 15.053 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 7 . 1050 . 1 1 7 THR CB C -23.591 14.221 13.915 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 7 . 1051 . 1 1 7 THR CG2 C -23.251 14.909 12.601 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 7 . 1052 . 1 1 7 THR H H -21.381 13.128 14.634 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 7 . 1053 . 1 1 7 THR HA H -22.333 15.722 14.780 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 7 . 1054 . 1 1 7 THR HB H -24.621 14.439 14.161 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 7 . 1055 . 1 1 7 THR HG1 H -24.188 12.357 14.167 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 7 . 1056 . 1 1 7 THR HG21 H -23.260 14.183 11.801 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 7 . 1057 . 1 1 7 THR HG22 H -22.270 15.355 12.672 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 7 . 1058 . 1 1 7 THR HG23 H -23.982 15.678 12.398 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 7 . 1059 . 1 1 7 THR N N -21.528 13.877 15.247 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 7 . 1060 . 1 1 7 THR O O -23.469 15.868 17.025 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 7 . 1061 . 1 1 7 THR OG1 O -23.436 12.804 13.771 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 7 . 1062 . 1 1 8 SER C C -24.269 13.886 19.095 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 7 . 1063 . 1 1 8 SER CA C -25.115 13.788 17.829 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 7 . 1064 . 1 1 8 SER CB C -25.961 12.514 17.866 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 7 . 1065 . 1 1 8 SER H H -24.274 13.024 16.043 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 7 . 1066 . 1 1 8 SER HA H -25.773 14.643 17.784 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 7 . 1067 . 1 1 8 SER HB2 H -26.774 12.603 17.161 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 7 . 1068 . 1 1 8 SER HB3 H -25.344 11.669 17.598 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 7 . 1069 . 1 1 8 SER HG H -26.673 11.359 19.279 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 7 . 1070 . 1 1 8 SER N N -24.277 13.805 16.635 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 7 . 1071 . 1 1 8 SER O O -24.724 14.397 20.118 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 7 . 1072 . 1 1 8 SER OG O -26.500 12.296 19.158 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 7 . 1073 . 1 1 9 ASP C C -21.904 14.855 20.639 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 7 . 1074 . 1 1 9 ASP CA C -22.130 13.424 20.161 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 7 . 1075 . 1 1 9 ASP CB C -20.792 12.779 19.795 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 7 . 1076 . 1 1 9 ASP CG C -20.804 11.275 19.987 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 7 . 1077 . 1 1 9 ASP H H -22.731 12.996 18.177 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 7 . 1078 . 1 1 9 ASP HA H -22.585 12.859 20.961 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 7 . 1079 . 1 1 9 ASP HB2 H -20.570 12.989 18.760 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 7 . 1080 . 1 1 9 ASP HB3 H -20.015 13.197 20.418 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 7 . 1081 . 1 1 9 ASP N N -23.037 13.392 19.019 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 7 . 1082 . 1 1 9 ASP O O -21.657 15.093 21.821 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 7 . 1083 . 1 1 9 ASP OD1 O -21.907 10.691 20.027 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 7 . 1084 . 1 1 9 ASP OD2 O -19.711 10.682 20.096 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 7 . 1085 . 1 1 10 PHE C C -20.358 17.481 20.474 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 7 . 1086 . 1 1 10 PHE CA C -21.796 17.215 20.038 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 7 . 1087 . 1 1 10 PHE CB C -22.767 17.648 21.140 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 7 . 1088 . 1 1 10 PHE CD1 C -24.644 17.978 19.508 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 7 . 1089 . 1 1 10 PHE CD2 C -24.375 19.571 21.262 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 7 . 1090 . 1 1 10 PHE CE1 C -25.734 18.681 19.032 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 7 . 1091 . 1 1 10 PHE CE2 C -25.465 20.278 20.791 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 7 . 1092 . 1 1 10 PHE CG C -23.953 18.414 20.627 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 7 . 1093 . 1 1 10 PHE CZ C -26.145 19.832 19.675 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 7 . 1094 . 1 1 10 PHE H H -22.190 15.553 18.787 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 7 . 1095 . 1 1 10 PHE HA H -22.000 17.789 19.147 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 7 . 1096 . 1 1 10 PHE HB2 H -23.136 16.771 21.652 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 7 . 1097 . 1 1 10 PHE HB3 H -22.244 18.277 21.846 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 7 . 1098 . 1 1 10 PHE HD1 H -24.323 17.077 19.005 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 7 . 1099 . 1 1 10 PHE HD2 H -23.844 19.920 22.135 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 7 . 1100 . 1 1 10 PHE HE1 H -26.264 18.330 18.159 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 7 . 1101 . 1 1 10 PHE HE2 H -25.785 21.178 21.295 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 7 . 1102 . 1 1 10 PHE HZ H -26.997 20.383 19.305 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 7 . 1103 . 1 1 10 PHE N N -21.990 15.805 19.712 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 7 . 1104 . 1 1 10 PHE O O -19.557 18.017 19.708 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 7 . 1105 . 1 1 11 PHE C C -18.531 16.583 23.576 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 7 . 1106 . 1 1 11 PHE CA C -18.697 17.306 22.244 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 7 . 1107 . 1 1 11 PHE CB C -18.413 18.799 22.421 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 7 . 1108 . 1 1 11 PHE CD1 C -19.949 19.265 24.351 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 7 . 1109 . 1 1 11 PHE CD2 C -20.203 20.558 22.363 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 7 . 1110 . 1 1 11 PHE CE1 C -20.989 19.959 24.940 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 7 . 1111 . 1 1 11 PHE CE2 C -21.244 21.256 22.947 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 7 . 1112 . 1 1 11 PHE CG C -19.545 19.556 23.058 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 7 . 1113 . 1 1 11 PHE CZ C -21.637 20.956 24.236 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 7 . 1114 . 1 1 11 PHE H H -20.720 16.684 22.271 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 7 . 1115 . 1 1 11 PHE HA H -17.993 16.896 21.535 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 7 . 1116 . 1 1 11 PHE HB2 H -17.541 18.920 23.045 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 7 . 1117 . 1 1 11 PHE HB3 H -18.221 19.239 21.453 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 7 . 1118 . 1 1 11 PHE HD1 H -19.443 18.486 24.902 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 7 . 1119 . 1 1 11 PHE HD2 H -19.896 20.793 21.355 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 7 . 1120 . 1 1 11 PHE HE1 H -21.295 19.723 25.948 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 7 . 1121 . 1 1 11 PHE HE2 H -21.749 22.035 22.395 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 7 . 1122 . 1 1 11 PHE HZ H -22.450 21.500 24.694 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 7 . 1123 . 1 1 11 PHE N N -20.038 17.105 21.708 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 7 . 1124 . 1 1 11 PHE O O -19.496 16.061 24.135 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 7 . 1125 . 1 1 12 NH2 HN1 H -17.171 16.093 24.941 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 7 . 1126 . 1 1 12 NH2 HN2 H -16.585 16.989 23.584 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 7 . 1127 . 1 1 12 NH2 N N -17.305 16.552 24.085 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 8 . 1128 . 1 1 1 HIS C C -25.702 5.098 19.383 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 8 . 1129 . 1 1 1 HIS CA C -26.959 4.799 20.194 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 8 . 1130 . 1 1 1 HIS CB C -27.481 6.077 20.854 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 8 . 1131 . 1 1 1 HIS CD2 C -29.665 5.923 22.245 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 8 . 1132 . 1 1 1 HIS CE1 C -31.104 6.156 20.608 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 8 . 1133 . 1 1 1 HIS CG C -28.957 6.064 21.099 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 8 . 1134 . 1 1 1 HIS H1 H -26.698 2.837 20.853 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 8 . 1135 . 1 1 1 HIS H2 H -27.410 3.857 21.999 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 8 . 1136 . 1 1 1 HIS H3 H -25.753 3.971 21.681 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 8 . 1137 . 1 1 1 HIS HA H -27.717 4.405 19.535 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 8 . 1138 . 1 1 1 HIS HB2 H -26.988 6.210 21.805 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 8 . 1139 . 1 1 1 HIS HB3 H -27.255 6.921 20.217 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 8 . 1140 . 1 1 1 HIS HD1 H -29.689 6.330 19.140 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 8 . 1141 . 1 1 1 HIS HD2 H -29.258 5.788 23.237 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 8 . 1142 . 1 1 1 HIS HE1 H -32.029 6.240 20.056 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 8 . 1143 . 1 1 1 HIS HE2 H -31.742 5.994 22.547 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 8 . 1144 . 1 1 1 HIS N N -26.686 3.796 21.256 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 8 . 1145 . 1 1 1 HIS ND1 N -29.889 6.208 20.092 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 8 . 1146 . 1 1 1 HIS NE2 N -30.996 5.983 21.912 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 8 . 1147 . 1 1 1 HIS O O -25.114 6.174 19.501 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 8 . 1148 . 1 1 2 ABA C C -24.289 5.490 16.786 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 8 . 1149 . 1 1 2 ABA CA C -24.102 4.295 17.724 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 8 . 1150 . 1 1 2 ABA H H -25.804 3.303 18.510 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 8 . 1151 . 1 1 2 ABA N N -25.294 4.138 18.559 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 8 . 1152 . 1 1 2 ABA O O -23.350 6.246 16.532 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 8 . 1153 . 1 1 3 GLU C C -25.275 8.076 15.890 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 8 . 1154 . 1 1 3 GLU CA C -25.826 6.751 15.368 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 8 . 1155 . 1 1 3 GLU CB C -27.341 6.855 15.171 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 8 . 1156 . 1 1 3 GLU CD C -27.220 7.596 12.759 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 8 . 1157 . 1 1 3 GLU CG C -27.788 6.591 13.742 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 8 . 1158 . 1 1 3 GLU H H -26.214 5.016 16.520 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 8 . 1159 . 1 1 3 GLU HA H -25.364 6.535 14.417 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 8 . 1160 . 1 1 3 GLU HB2 H -27.826 6.136 15.815 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 8 . 1161 . 1 1 3 GLU HB3 H -27.664 7.848 15.448 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 8 . 1162 . 1 1 3 GLU HG2 H -27.461 5.604 13.453 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 8 . 1163 . 1 1 3 GLU HG3 H -28.866 6.638 13.701 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 8 . 1164 . 1 1 3 GLU N N -25.509 5.652 16.278 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 8 . 1165 . 1 1 3 GLU O O -24.947 8.972 15.112 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 8 . 1166 . 1 1 3 GLU OE1 O -26.201 8.239 13.089 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 8 . 1167 . 1 1 3 GLU OE2 O -27.794 7.740 11.659 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 8 . 1168 . 1 1 4 GLY C C -23.299 9.796 17.266 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 8 . 1169 . 1 1 4 GLY CA C -24.660 9.409 17.812 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 8 . 1170 . 1 1 4 GLY H H -25.449 7.445 17.782 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 8 . 1171 . 1 1 4 GLY HA2 H -25.355 10.213 17.621 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 8 . 1172 . 1 1 4 GLY HA3 H -24.579 9.264 18.879 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 8 . 1173 . 1 1 4 GLY N N -25.174 8.192 17.211 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 8 . 1174 . 1 1 4 GLY O O -23.121 10.900 16.752 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 8 . 1175 . 1 1 5 THR C C -20.469 10.499 17.308 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 8 . 1176 . 1 1 5 THR CA C -20.983 9.125 16.883 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 8 . 1177 . 1 1 5 THR CB C -20.916 9.015 15.347 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 8 . 1178 . 1 1 5 THR CG2 C -19.661 8.272 14.912 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 8 . 1179 . 1 1 5 THR H H -22.546 8.018 17.788 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 8 . 1180 . 1 1 5 THR HA H -20.337 8.368 17.303 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 8 . 1181 . 1 1 5 THR HB H -20.889 10.011 14.929 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 8 . 1182 . 1 1 5 THR HG1 H -21.969 8.162 13.915 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 8 . 1183 . 1 1 5 THR HG21 H -19.899 7.233 14.740 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 8 . 1184 . 1 1 5 THR HG22 H -18.912 8.346 15.686 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 8 . 1185 . 1 1 5 THR HG23 H -19.281 8.710 14.001 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 8 . 1186 . 1 1 5 THR N N -22.338 8.881 17.373 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 8 . 1187 . 1 1 5 THR O O -21.086 11.178 18.130 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 8 . 1188 . 1 1 5 THR OG1 O -22.074 8.332 14.853 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 8 . 1189 . 1 1 6 PHE C C -19.702 13.331 16.719 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 8 . 1190 . 1 1 6 PHE CA C -18.741 12.195 17.056 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 8 . 1191 . 1 1 6 PHE CB C -17.430 12.375 16.289 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 8 . 1192 . 1 1 6 PHE CD1 C -16.997 14.817 16.680 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 8 . 1193 . 1 1 6 PHE CD2 C -15.364 13.243 17.417 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 8 . 1194 . 1 1 6 PHE CE1 C -16.216 15.854 17.154 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 8 . 1195 . 1 1 6 PHE CE2 C -14.579 14.276 17.894 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 8 . 1196 . 1 1 6 PHE CG C -16.580 13.501 16.806 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 8 . 1197 . 1 1 6 PHE CZ C -15.006 15.583 17.762 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 8 . 1198 . 1 1 6 PHE H H -18.893 10.318 16.092 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 8 . 1199 . 1 1 6 PHE HA H -18.535 12.216 18.116 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 8 . 1200 . 1 1 6 PHE HB2 H -16.853 11.465 16.358 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 8 . 1201 . 1 1 6 PHE HB3 H -17.655 12.576 15.252 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 8 . 1202 . 1 1 6 PHE HD1 H -17.943 15.029 16.205 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 8 . 1203 . 1 1 6 PHE HD2 H -15.029 12.221 17.521 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 8 . 1204 . 1 1 6 PHE HE1 H -16.553 16.874 17.051 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 8 . 1205 . 1 1 6 PHE HE2 H -13.633 14.061 18.369 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 8 . 1206 . 1 1 6 PHE HZ H -14.394 16.392 18.134 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 8 . 1207 . 1 1 6 PHE N N -19.337 10.903 16.741 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 8 . 1208 . 1 1 6 PHE O O -19.721 14.363 17.392 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 8 . 1209 . 1 1 7 THR C C -22.394 14.523 16.400 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 8 . 1210 . 1 1 7 THR CA C -21.471 14.136 15.250 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 8 . 1211 . 1 1 7 THR CB C -22.322 13.634 14.070 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 8 . 1212 . 1 1 7 THR CG2 C -22.992 12.311 14.409 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 8 . 1213 . 1 1 7 THR H H -20.442 12.287 15.182 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 8 . 1214 . 1 1 7 THR HA H -20.925 15.010 14.929 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 8 . 1215 . 1 1 7 THR HB H -21.676 13.485 13.217 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 8 . 1216 . 1 1 7 THR HG1 H -24.012 14.596 14.401 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 8 . 1217 . 1 1 7 THR HG21 H -22.240 11.589 14.693 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 8 . 1218 . 1 1 7 THR HG22 H -23.532 11.948 13.547 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 8 . 1219 . 1 1 7 THR HG23 H -23.680 12.456 15.229 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 8 . 1220 . 1 1 7 THR N N -20.503 13.131 15.676 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 8 . 1221 . 1 1 7 THR O O -22.791 15.681 16.529 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 8 . 1222 . 1 1 7 THR OG1 O -23.320 14.606 13.736 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 8 . 1223 . 1 1 8 SER C C -22.807 14.404 19.530 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 8 . 1224 . 1 1 8 SER CA C -23.595 13.782 18.383 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 8 . 1225 . 1 1 8 SER CB C -24.242 12.473 18.840 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 8 . 1226 . 1 1 8 SER H H -22.372 12.644 17.084 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 8 . 1227 . 1 1 8 SER HA H -24.368 14.470 18.077 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 8 . 1228 . 1 1 8 SER HB2 H -24.945 12.141 18.091 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 8 . 1229 . 1 1 8 SER HB3 H -23.476 11.723 18.974 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 8 . 1230 . 1 1 8 SER HG H -25.456 13.449 20.028 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 8 . 1231 . 1 1 8 SER N N -22.726 13.545 17.237 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 8 . 1232 . 1 1 8 SER O O -23.312 15.264 20.251 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 8 . 1233 . 1 1 8 SER OG O -24.931 12.646 20.067 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 8 . 1234 . 1 1 9 ASP C C -20.472 15.983 20.577 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 8 . 1235 . 1 1 9 ASP CA C -20.696 14.481 20.741 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 8 . 1236 . 1 1 9 ASP CB C -19.354 13.747 20.732 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 8 . 1237 . 1 1 9 ASP CG C -19.333 12.571 21.688 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 8 . 1238 . 1 1 9 ASP H H -21.215 13.281 19.076 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 8 . 1239 . 1 1 9 ASP HA H -21.186 14.304 21.687 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 8 . 1240 . 1 1 9 ASP HB2 H -19.157 13.381 19.735 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 8 . 1241 . 1 1 9 ASP HB3 H -18.572 14.435 21.019 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 8 . 1242 . 1 1 9 ASP N N -21.561 13.965 19.687 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 8 . 1243 . 1 1 9 ASP O O -20.131 16.676 21.536 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 8 . 1244 . 1 1 9 ASP OD1 O -19.602 12.777 22.890 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 8 . 1245 . 1 1 9 ASP OD2 O -19.048 11.442 21.234 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 8 . 1246 . 1 1 10 PHE C C -21.170 18.771 20.120 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 8 . 1247 . 1 1 10 PHE CA C -20.489 17.902 19.065 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 8 . 1248 . 1 1 10 PHE CB C -21.052 18.234 17.682 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 8 . 1249 . 1 1 10 PHE CD1 C -18.782 18.613 16.680 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 8 . 1250 . 1 1 10 PHE CD2 C -20.390 17.390 15.414 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 8 . 1251 . 1 1 10 PHE CE1 C -17.863 18.470 15.658 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 8 . 1252 . 1 1 10 PHE CE2 C -19.476 17.243 14.388 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 8 . 1253 . 1 1 10 PHE CG C -20.054 18.075 16.570 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 8 . 1254 . 1 1 10 PHE CZ C -18.211 17.783 14.510 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 8 . 1255 . 1 1 10 PHE H H -20.939 15.879 18.633 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 8 . 1256 . 1 1 10 PHE HA H -19.430 18.111 19.072 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 8 . 1257 . 1 1 10 PHE HB2 H -21.885 17.580 17.475 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 8 . 1258 . 1 1 10 PHE HB3 H -21.395 19.258 17.678 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 8 . 1259 . 1 1 10 PHE HD1 H -18.509 19.150 17.577 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 8 . 1260 . 1 1 10 PHE HD2 H -21.379 16.967 15.318 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 8 . 1261 . 1 1 10 PHE HE1 H -16.875 18.893 15.756 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 8 . 1262 . 1 1 10 PHE HE2 H -19.750 16.705 13.493 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 8 . 1263 . 1 1 10 PHE HZ H -17.494 17.670 13.710 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 8 . 1264 . 1 1 10 PHE N N -20.668 16.481 19.356 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 8 . 1265 . 1 1 10 PHE O O -22.359 18.613 20.395 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 8 . 1266 . 1 1 11 PHE C C -19.884 21.588 22.176 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 8 . 1267 . 1 1 11 PHE CA C -20.939 20.580 21.730 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 8 . 1268 . 1 1 11 PHE CB C -21.430 19.773 22.933 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 8 . 1269 . 1 1 11 PHE CD1 C -23.718 20.801 22.863 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 8 . 1270 . 1 1 11 PHE CD2 C -22.673 20.505 24.986 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 8 . 1271 . 1 1 11 PHE CE1 C -24.824 21.352 23.481 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 8 . 1272 . 1 1 11 PHE CE2 C -23.776 21.055 25.609 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 8 . 1273 . 1 1 11 PHE CG C -22.631 20.372 23.607 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 8 . 1274 . 1 1 11 PHE CZ C -24.853 21.480 24.856 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 8 . 1275 . 1 1 11 PHE H H -19.467 19.767 20.445 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 8 . 1276 . 1 1 11 PHE HA H -21.774 21.116 21.302 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 8 . 1277 . 1 1 11 PHE HB2 H -21.695 18.779 22.606 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 8 . 1278 . 1 1 11 PHE HB3 H -20.636 19.708 23.662 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 8 . 1279 . 1 1 11 PHE HD1 H -23.695 20.702 21.788 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 8 . 1280 . 1 1 11 PHE HD2 H -21.831 20.173 25.576 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 8 . 1281 . 1 1 11 PHE HE1 H -25.665 21.683 22.889 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 8 . 1282 . 1 1 11 PHE HE2 H -23.797 21.153 26.685 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 8 . 1283 . 1 1 11 PHE HZ H -25.717 21.910 25.341 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 8 . 1284 . 1 1 11 PHE N N -20.408 19.688 20.706 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 8 . 1285 . 1 1 11 PHE O O -18.752 21.570 21.694 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 8 . 1286 . 1 1 12 NH2 HN1 H -19.599 23.126 23.403 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 8 . 1287 . 1 1 12 NH2 HN2 H -21.176 22.422 23.436 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 8 . 1288 . 1 1 12 NH2 N N -20.258 22.467 23.098 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 9 . 1289 . 1 1 1 HIS C C -23.971 6.640 20.324 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 9 . 1290 . 1 1 1 HIS CA C -23.924 7.766 21.353 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 9 . 1291 . 1 1 1 HIS CB C -25.300 7.943 22.010 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 9 . 1292 . 1 1 1 HIS CD2 C -26.534 10.228 22.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 9 . 1293 . 1 1 1 HIS CE1 C -27.222 10.253 19.963 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 9 . 1294 . 1 1 1 HIS CG C -26.101 9.085 21.459 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 9 . 1295 . 1 1 1 HIS H1 H -24.138 9.268 19.920 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 9 . 1296 . 1 1 1 HIS H2 H -22.536 8.984 20.380 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 9 . 1297 . 1 1 1 HIS H3 H -23.577 9.822 21.416 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 9 . 1298 . 1 1 1 HIS HA H -23.199 7.513 22.113 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 9 . 1299 . 1 1 1 HIS HB2 H -25.876 7.041 21.870 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 9 . 1300 . 1 1 1 HIS HB3 H -25.164 8.114 23.068 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 9 . 1301 . 1 1 1 HIS HD1 H -26.398 8.446 19.473 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 9 . 1302 . 1 1 1 HIS HD2 H -26.364 10.527 23.069 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 9 . 1303 . 1 1 1 HIS HE1 H -27.689 10.559 19.038 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 9 . 1304 . 1 1 1 HIS HE2 H -27.730 11.761 21.252 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 9 . 1305 . 1 1 1 HIS N N -23.515 9.049 20.723 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 9 . 1306 . 1 1 1 HIS ND1 N -26.550 9.132 20.155 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 9 . 1307 . 1 1 1 HIS NE2 N -27.227 10.935 21.093 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 9 . 1308 . 1 1 1 HIS O O -25.046 6.180 19.940 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 9 . 1309 . 1 1 2 ABA C C -23.380 5.556 17.596 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 9 . 1310 . 1 1 2 ABA CA C -22.690 5.126 18.896 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 9 . 1311 . 1 1 2 ABA H H -21.974 6.611 20.231 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 9 . 1312 . 1 1 2 ABA N N -22.794 6.202 19.884 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 9 . 1313 . 1 1 2 ABA O O -22.729 6.045 16.673 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 9 . 1314 . 1 1 3 GLU C C -25.441 7.256 16.141 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 9 . 1315 . 1 1 3 GLU CA C -25.461 5.745 16.348 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 9 . 1316 . 1 1 3 GLU CB C -26.904 5.254 16.471 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 9 . 1317 . 1 1 3 GLU CD C -28.593 6.691 15.260 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 9 . 1318 . 1 1 3 GLU CG C -27.724 5.449 15.206 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 9 . 1319 . 1 1 3 GLU H H -25.164 4.982 18.299 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 9 . 1320 . 1 1 3 GLU HA H -25.000 5.271 15.494 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 9 . 1321 . 1 1 3 GLU HB2 H -26.895 4.201 16.709 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 9 . 1322 . 1 1 3 GLU HB3 H -27.388 5.791 17.274 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 9 . 1323 . 1 1 3 GLU HG2 H -27.052 5.537 14.366 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 9 . 1324 . 1 1 3 GLU HG3 H -28.361 4.587 15.068 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 9 . 1325 . 1 1 3 GLU N N -24.696 5.374 17.532 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 9 . 1326 . 1 1 3 GLU O O -25.531 7.739 15.012 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 9 . 1327 . 1 1 3 GLU OE1 O -29.706 6.612 15.823 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 9 . 1328 . 1 1 3 GLU OE2 O -28.161 7.741 14.740 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 9 . 1329 . 1 1 4 GLY C C -24.056 9.961 16.439 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 9 . 1330 . 1 1 4 GLY CA C -25.290 9.446 17.154 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 9 . 1331 . 1 1 4 GLY H H -25.252 7.558 18.110 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 9 . 1332 . 1 1 4 GLY HA2 H -26.168 9.783 16.623 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 9 . 1333 . 1 1 4 GLY HA3 H -25.309 9.853 18.154 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 9 . 1334 . 1 1 4 GLY N N -25.321 7.998 17.237 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 9 . 1335 . 1 1 4 GLY O O -24.072 11.052 15.870 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 9 . 1336 . 1 1 5 THR C C -21.247 10.913 16.320 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 9 . 1337 . 1 1 5 THR CA C -21.736 9.559 15.816 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 9 . 1338 . 1 1 5 THR CB C -21.892 9.621 14.285 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 9 . 1339 . 1 1 5 THR CG2 C -22.651 8.407 13.768 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 9 . 1340 . 1 1 5 THR H H -23.032 8.316 16.937 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 9 . 1341 . 1 1 5 THR HA H -20.994 8.810 16.052 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 9 . 1342 . 1 1 5 THR HB H -20.909 9.628 13.838 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 9 . 1343 . 1 1 5 THR HG1 H -22.015 11.357 13.356 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 9 . 1344 . 1 1 5 THR HG21 H -22.581 7.605 14.489 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 9 . 1345 . 1 1 5 THR HG22 H -22.221 8.086 12.831 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 9 . 1346 . 1 1 5 THR HG23 H -23.688 8.667 13.618 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 9 . 1347 . 1 1 5 THR N N -22.984 9.175 16.467 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 9 . 1348 . 1 1 5 THR O O -21.915 11.566 17.122 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 9 . 1349 . 1 1 5 THR OG1 O -22.585 10.817 13.909 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 9 . 1350 . 1 1 6 PHE C C -20.466 13.757 15.994 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 9 . 1351 . 1 1 6 PHE CA C -19.495 12.606 16.247 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 9 . 1352 . 1 1 6 PHE CB C -18.186 12.851 15.493 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 9 . 1353 . 1 1 6 PHE CD1 C -17.435 14.581 17.150 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 9 . 1354 . 1 1 6 PHE CD2 C -17.008 14.968 14.836 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 9 . 1355 . 1 1 6 PHE CE1 C -16.831 15.783 17.466 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 9 . 1356 . 1 1 6 PHE CE2 C -16.404 16.171 15.145 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 9 . 1357 . 1 1 6 PHE CG C -17.529 14.160 15.833 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 9 . 1358 . 1 1 6 PHE CZ C -16.315 16.580 16.462 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 9 . 1359 . 1 1 6 PHE H H -19.592 10.763 15.208 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 9 . 1360 . 1 1 6 PHE HA H -19.285 12.555 17.305 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 9 . 1361 . 1 1 6 PHE HB2 H -17.490 12.060 15.728 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 9 . 1362 . 1 1 6 PHE HB3 H -18.385 12.845 14.431 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 9 . 1363 . 1 1 6 PHE HD1 H -17.837 13.958 17.936 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 9 . 1364 . 1 1 6 PHE HD2 H -17.077 14.649 13.806 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 9 . 1365 . 1 1 6 PHE HE1 H -16.764 16.101 18.496 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 9 . 1366 . 1 1 6 PHE HE2 H -16.001 16.792 14.359 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 9 . 1367 . 1 1 6 PHE HZ H -15.844 17.520 16.706 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 9 . 1368 . 1 1 6 PHE N N -20.077 11.329 15.845 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 9 . 1369 . 1 1 6 PHE O O -20.529 14.710 16.771 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 9 . 1370 . 1 1 7 THR C C -23.199 14.915 15.663 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 9 . 1371 . 1 1 7 THR CA C -22.182 14.698 14.548 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 9 . 1372 . 1 1 7 THR CB C -22.930 14.348 13.249 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 9 . 1373 . 1 1 7 THR CG2 C -23.757 15.530 12.767 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 9 . 1374 . 1 1 7 THR H H -21.121 12.880 14.322 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 9 . 1375 . 1 1 7 THR HA H -21.638 15.618 14.388 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 9 . 1376 . 1 1 7 THR HB H -23.594 13.518 13.445 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 9 . 1377 . 1 1 7 THR HG1 H -21.456 14.727 11.994 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 9 . 1378 . 1 1 7 THR HG21 H -23.386 16.437 13.219 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 9 . 1379 . 1 1 7 THR HG22 H -24.790 15.384 13.047 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 9 . 1380 . 1 1 7 THR HG23 H -23.683 15.607 11.692 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 9 . 1381 . 1 1 7 THR N N -21.218 13.663 14.903 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 9 . 1382 . 1 1 7 THR O O -23.306 16.010 16.214 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 9 . 1383 . 1 1 7 THR OG1 O -21.994 13.969 12.232 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 9 . 1384 . 1 1 8 SER C C -24.309 13.977 18.422 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 9 . 1385 . 1 1 8 SER CA C -24.956 13.946 17.040 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 9 . 1386 . 1 1 8 SER CB C -25.920 12.762 16.944 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 9 . 1387 . 1 1 8 SER H H -23.816 13.018 15.515 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 9 . 1388 . 1 1 8 SER HA H -25.510 14.861 16.896 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 9 . 1389 . 1 1 8 SER HB2 H -25.498 11.913 17.460 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 9 . 1390 . 1 1 8 SER HB3 H -26.861 13.030 17.401 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 9 . 1391 . 1 1 8 SER HG H -25.430 11.858 15.276 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 9 . 1392 . 1 1 8 SER N N -23.946 13.866 15.991 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 9 . 1393 . 1 1 8 SER O O -24.865 14.541 19.364 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 9 . 1394 . 1 1 8 SER OG O -26.154 12.404 15.593 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 9 . 1395 . 1 1 9 ASP C C -22.149 14.737 20.329 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 9 . 1396 . 1 1 9 ASP CA C -22.414 13.329 19.807 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 9 . 1397 . 1 1 9 ASP CB C -21.092 12.574 19.650 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 9 . 1398 . 1 1 9 ASP CG C -21.233 11.093 19.940 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 9 . 1399 . 1 1 9 ASP H H -22.738 12.935 17.752 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 9 . 1400 . 1 1 9 ASP HA H -23.034 12.805 20.520 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 9 . 1401 . 1 1 9 ASP HB2 H -20.735 12.692 18.639 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 9 . 1402 . 1 1 9 ASP HB3 H -20.366 12.989 20.334 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 9 . 1403 . 1 1 9 ASP N N -23.132 13.368 18.537 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 9 . 1404 . 1 1 9 ASP O O -22.843 15.218 21.225 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 9 . 1405 . 1 1 9 ASP OD1 O -21.603 10.744 21.081 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 9 . 1406 . 1 1 9 ASP OD2 O -20.972 10.282 19.027 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 9 . 1407 . 1 1 10 PHE C C -20.353 16.767 21.642 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 9 . 1408 . 1 1 10 PHE CA C -20.780 16.745 20.177 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 9 . 1409 . 1 1 10 PHE CB C -21.958 17.698 19.959 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 9 . 1410 . 1 1 10 PHE CD1 C -21.580 17.721 17.476 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 9 . 1411 . 1 1 10 PHE CD2 C -22.232 19.752 18.543 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 9 . 1412 . 1 1 10 PHE CE1 C -21.547 18.369 16.256 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 9 . 1413 . 1 1 10 PHE CE2 C -22.200 20.405 17.325 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 9 . 1414 . 1 1 10 PHE CG C -21.922 18.404 18.633 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 9 . 1415 . 1 1 10 PHE CZ C -21.857 19.713 16.180 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 9 . 1416 . 1 1 10 PHE H H -20.621 14.956 19.057 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 9 . 1417 . 1 1 10 PHE HA H -19.949 17.068 19.568 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 9 . 1418 . 1 1 10 PHE HB2 H -22.879 17.138 20.011 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 9 . 1419 . 1 1 10 PHE HB3 H -21.954 18.448 20.736 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 9 . 1420 . 1 1 10 PHE HD1 H -21.337 16.670 17.534 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 9 . 1421 . 1 1 10 PHE HD2 H -22.500 20.295 19.438 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 9 . 1422 . 1 1 10 PHE HE1 H -21.278 17.825 15.362 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 9 . 1423 . 1 1 10 PHE HE2 H -22.443 21.456 17.269 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 9 . 1424 . 1 1 10 PHE HZ H -21.832 20.221 15.228 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 9 . 1425 . 1 1 10 PHE N N -21.139 15.393 19.765 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 9 . 1426 . 1 1 10 PHE O O -20.845 15.984 22.454 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 9 . 1427 . 1 1 11 PHE C C -19.437 19.074 23.987 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 9 . 1428 . 1 1 11 PHE CA C -18.939 17.786 23.339 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 9 . 1429 . 1 1 11 PHE CB C -17.410 17.750 23.355 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 9 . 1430 . 1 1 11 PHE CD1 C -17.374 15.357 22.598 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 9 . 1431 . 1 1 11 PHE CD2 C -15.734 16.849 21.718 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 9 . 1432 . 1 1 11 PHE CE1 C -16.840 14.325 21.850 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 9 . 1433 . 1 1 11 PHE CE2 C -15.196 15.820 20.967 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 9 . 1434 . 1 1 11 PHE CG C -16.828 16.630 22.540 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 9 . 1435 . 1 1 11 PHE CZ C -15.750 14.556 21.033 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 9 . 1436 . 1 1 11 PHE H H -19.076 18.262 21.280 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 9 . 1437 . 1 1 11 PHE HA H -19.316 16.945 23.902 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 9 . 1438 . 1 1 11 PHE HB2 H -17.031 18.680 22.959 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 9 . 1439 . 1 1 11 PHE HB3 H -17.071 17.633 24.374 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 9 . 1440 . 1 1 11 PHE HD1 H -18.226 15.174 23.235 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 9 . 1441 . 1 1 11 PHE HD2 H -15.300 17.837 21.665 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 9 . 1442 . 1 1 11 PHE HE1 H -17.275 13.337 21.903 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 9 . 1443 . 1 1 11 PHE HE2 H -14.345 16.005 20.330 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 9 . 1444 . 1 1 11 PHE HZ H -15.332 13.751 20.448 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 9 . 1445 . 1 1 11 PHE N N -19.433 17.666 21.972 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 9 . 1446 . 1 1 11 PHE O O -19.917 19.979 23.305 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 9 . 1447 . 1 1 12 NH2 HN1 H -19.637 19.971 25.750 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 9 . 1448 . 1 1 12 NH2 HN2 H -18.931 18.394 25.786 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 9 . 1449 . 1 1 12 NH2 N N -19.323 19.154 25.308 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 1
. 10 . 1450 . 1 1 1 HIS C C -25.101 4.981 19.737 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . rr_2n09 1
. 10 . 1451 . 1 1 1 HIS CA C -26.233 4.433 20.599 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . rr_2n09 1
. 10 . 1452 . 1 1 1 HIS CB C -27.330 5.492 20.768 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . rr_2n09 1
. 10 . 1453 . 1 1 1 HIS CD2 C -26.617 7.453 22.314 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . rr_2n09 1
. 10 . 1454 . 1 1 1 HIS CE1 C -27.557 6.756 24.168 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . rr_2n09 1
. 10 . 1455 . 1 1 1 HIS CG C -27.231 6.277 22.042 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . rr_2n09 1
. 10 . 1456 . 1 1 1 HIS H1 H -25.232 4.815 22.391 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . rr_2n09 1
. 10 . 1457 . 1 1 1 HIS H2 H -25.090 3.218 21.854 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . rr_2n09 1
. 10 . 1458 . 1 1 1 HIS H3 H -26.538 3.750 22.548 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . rr_2n09 1
. 10 . 1459 . 1 1 1 HIS HA H -26.653 3.564 20.113 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . rr_2n09 1
. 10 . 1460 . 1 1 1 HIS HB2 H -27.273 6.190 19.947 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . rr_2n09 1
. 10 . 1461 . 1 1 1 HIS HB3 H -28.293 5.005 20.752 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . rr_2n09 1
. 10 . 1462 . 1 1 1 HIS HD1 H -28.330 5.046 23.353 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . rr_2n09 1
. 10 . 1463 . 1 1 1 HIS HD2 H -26.059 8.061 21.616 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . rr_2n09 1
. 10 . 1464 . 1 1 1 HIS HE1 H -27.885 6.697 25.196 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . rr_2n09 1
. 10 . 1465 . 1 1 1 HIS HE2 H -26.590 8.559 24.098 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . rr_2n09 1
. 10 . 1466 . 1 1 1 HIS N N -25.739 4.025 21.942 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . rr_2n09 1
. 10 . 1467 . 1 1 1 HIS ND1 N -27.810 5.867 23.224 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . rr_2n09 1
. 10 . 1468 . 1 1 1 HIS NE2 N -26.834 7.727 23.642 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . rr_2n09 1
. 10 . 1469 . 1 1 1 HIS O O -24.805 6.176 19.766 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . rr_2n09 1
. 10 . 1470 . 1 1 2 ABA C C -23.863 5.509 17.061 . . . 1.0 . . . . . . . . . . . . A . 2 AIB C . . . . . . . . . rr_2n09 1
. 10 . 1471 . 1 1 2 ABA CA C -23.367 4.488 18.089 . . . 1.0 . . . . . . . . . . . . A . 2 AIB CA . . . . . . . . . rr_2n09 1
. 10 . 1472 . 1 1 2 ABA H H -24.755 3.160 18.988 . . . 1.0 . . . . . . . . . . . . A . 2 AIB H . . . . . . . . . rr_2n09 1
. 10 . 1473 . 1 1 2 ABA N N -24.471 4.097 18.968 . . . 1.0 . . . . . . . . . . . . A . 2 AIB N . . . . . . . . . rr_2n09 1
. 10 . 1474 . 1 1 2 ABA O O -23.085 6.316 16.551 . . . 1.0 . . . . . . . . . . . . A . 2 AIB O . . . . . . . . . rr_2n09 1
. 10 . 1475 . 1 1 3 GLU C C -25.392 7.835 16.118 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2n09 1
. 10 . 1476 . 1 1 3 GLU CA C -25.753 6.387 15.795 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2n09 1
. 10 . 1477 . 1 1 3 GLU CB C -27.274 6.221 15.768 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2n09 1
. 10 . 1478 . 1 1 3 GLU CD C -28.628 5.388 17.733 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2n09 1
. 10 . 1479 . 1 1 3 GLU CG C -27.950 6.578 17.083 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2n09 1
. 10 . 1480 . 1 1 3 GLU H H -25.730 4.802 17.198 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2n09 1
. 10 . 1481 . 1 1 3 GLU HA H -25.358 6.141 14.820 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2n09 1
. 10 . 1482 . 1 1 3 GLU HB2 H -27.680 6.857 14.996 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2n09 1
. 10 . 1483 . 1 1 3 GLU HB3 H -27.508 5.193 15.535 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2n09 1
. 10 . 1484 . 1 1 3 GLU HG2 H -27.205 6.964 17.763 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2n09 1
. 10 . 1485 . 1 1 3 GLU HG3 H -28.693 7.339 16.895 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2n09 1
. 10 . 1486 . 1 1 3 GLU N N -25.159 5.467 16.761 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2n09 1
. 10 . 1487 . 1 1 3 GLU O O -25.362 8.689 15.232 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2n09 1
. 10 . 1488 . 1 1 3 GLU OE1 O -27.952 4.357 17.934 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2n09 1
. 10 . 1489 . 1 1 3 GLU OE2 O -29.834 5.486 18.041 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2n09 1
. 10 . 1490 . 1 1 4 GLY C C -23.536 9.971 17.076 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . rr_2n09 1
. 10 . 1491 . 1 1 4 GLY CA C -24.760 9.449 17.802 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . rr_2n09 1
. 10 . 1492 . 1 1 4 GLY H H -25.156 7.385 18.055 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . rr_2n09 1
. 10 . 1493 . 1 1 4 GLY HA2 H -25.592 10.108 17.602 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . rr_2n09 1
. 10 . 1494 . 1 1 4 GLY HA3 H -24.563 9.448 18.864 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . rr_2n09 1
. 10 . 1495 . 1 1 4 GLY N N -25.117 8.105 17.391 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . rr_2n09 1
. 10 . 1496 . 1 1 4 GLY O O -23.556 11.068 16.519 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . rr_2n09 1
. 10 . 1497 . 1 1 5 THR C C -20.761 10.948 16.869 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . rr_2n09 1
. 10 . 1498 . 1 1 5 THR CA C -21.224 9.565 16.418 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . rr_2n09 1
. 10 . 1499 . 1 1 5 THR CB C -21.380 9.560 14.882 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . rr_2n09 1
. 10 . 1500 . 1 1 5 THR CG2 C -20.577 8.428 14.260 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . rr_2n09 1
. 10 . 1501 . 1 1 5 THR H H -22.513 8.317 17.542 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . rr_2n09 1
. 10 . 1502 . 1 1 5 THR HA H -20.468 8.841 16.684 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . rr_2n09 1
. 10 . 1503 . 1 1 5 THR HB H -21.012 10.498 14.492 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . rr_2n09 1
. 10 . 1504 . 1 1 5 THR HG1 H -23.196 10.272 14.587 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . rr_2n09 1
. 10 . 1505 . 1 1 5 THR HG21 H -21.084 7.490 14.430 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . rr_2n09 1
. 10 . 1506 . 1 1 5 THR HG22 H -19.595 8.393 14.709 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . rr_2n09 1
. 10 . 1507 . 1 1 5 THR HG23 H -20.481 8.596 13.197 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . rr_2n09 1
. 10 . 1508 . 1 1 5 THR N N -22.466 9.181 17.082 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . rr_2n09 1
. 10 . 1509 . 1 1 5 THR O O -21.333 11.537 17.786 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . rr_2n09 1
. 10 . 1510 . 1 1 5 THR OG1 O -22.761 9.419 14.528 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . rr_2n09 1
. 10 . 1511 . 1 1 6 PHE C C -20.169 13.876 16.189 . . . 1.0 . . . . . . . . . . . . A . 6 PHE C . . . . . . . . . rr_2n09 1
. 10 . 1512 . 1 1 6 PHE CA C -19.181 12.772 16.552 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CA . . . . . . . . . rr_2n09 1
. 10 . 1513 . 1 1 6 PHE CB C -17.854 12.998 15.826 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CB . . . . . . . . . rr_2n09 1
. 10 . 1514 . 1 1 6 PHE CD1 C -16.881 14.639 17.457 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD1 . . . . . . . . . rr_2n09 1
. 10 . 1515 . 1 1 6 PHE CD2 C -16.931 15.230 15.147 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CD2 . . . . . . . . . rr_2n09 1
. 10 . 1516 . 1 1 6 PHE CE1 C -16.288 15.850 17.758 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE1 . . . . . . . . . rr_2n09 1
. 10 . 1517 . 1 1 6 PHE CE2 C -16.338 16.443 15.442 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CE2 . . . . . . . . . rr_2n09 1
. 10 . 1518 . 1 1 6 PHE CG C -17.209 14.316 16.150 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CG . . . . . . . . . rr_2n09 1
. 10 . 1519 . 1 1 6 PHE CZ C -16.016 16.753 16.748 . . . 1.0 . . . . . . . . . . . . A . 6 PHE CZ . . . . . . . . . rr_2n09 1
. 10 . 1520 . 1 1 6 PHE H H -19.307 10.941 15.497 . . . 1.0 . . . . . . . . . . . . A . 6 PHE H . . . . . . . . . rr_2n09 1
. 10 . 1521 . 1 1 6 PHE HA H -19.007 12.797 17.617 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HA . . . . . . . . . rr_2n09 1
. 10 . 1522 . 1 1 6 PHE HB2 H -17.163 12.215 16.100 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB2 . . . . . . . . . rr_2n09 1
. 10 . 1523 . 1 1 6 PHE HB3 H -18.025 12.964 14.760 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HB3 . . . . . . . . . rr_2n09 1
. 10 . 1524 . 1 1 6 PHE HD1 H -17.093 13.933 18.246 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD1 . . . . . . . . . rr_2n09 1
. 10 . 1525 . 1 1 6 PHE HD2 H -17.182 14.989 14.125 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HD2 . . . . . . . . . rr_2n09 1
. 10 . 1526 . 1 1 6 PHE HE1 H -16.038 16.090 18.780 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE1 . . . . . . . . . rr_2n09 1
. 10 . 1527 . 1 1 6 PHE HE2 H -16.126 17.147 14.651 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HE2 . . . . . . . . . rr_2n09 1
. 10 . 1528 . 1 1 6 PHE HZ H -15.552 17.701 16.981 . . . 1.0 . . . . . . . . . . . . A . 6 PHE HZ . . . . . . . . . rr_2n09 1
. 10 . 1529 . 1 1 6 PHE N N -19.721 11.459 16.219 . . . 1.0 . . . . . . . . . . . . A . 6 PHE N . . . . . . . . . rr_2n09 1
. 10 . 1530 . 1 1 6 PHE O O -20.220 14.917 16.844 . . . 1.0 . . . . . . . . . . . . A . 6 PHE O . . . . . . . . . rr_2n09 1
. 10 . 1531 . 1 1 7 THR C C -22.918 14.968 15.806 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2n09 1
. 10 . 1532 . 1 1 7 THR CA C -21.941 14.615 14.690 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2n09 1
. 10 . 1533 . 1 1 7 THR CB C -22.733 14.091 13.477 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2n09 1
. 10 . 1534 . 1 1 7 THR CG2 C -23.371 12.745 13.788 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2n09 1
. 10 . 1535 . 1 1 7 THR H H -20.865 12.792 14.659 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2n09 1
. 10 . 1536 . 1 1 7 THR HA H -21.414 15.509 14.390 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2n09 1
. 10 . 1537 . 1 1 7 THR HB H -22.052 13.966 12.648 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2n09 1
. 10 . 1538 . 1 1 7 THR HG1 H -24.437 15.038 13.781 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2n09 1
. 10 . 1539 . 1 1 7 THR HG21 H -24.371 12.899 14.165 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2n09 1
. 10 . 1540 . 1 1 7 THR HG22 H -22.781 12.230 14.531 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2n09 1
. 10 . 1541 . 1 1 7 THR HG23 H -23.414 12.151 12.887 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2n09 1
. 10 . 1542 . 1 1 7 THR N N -20.953 13.641 15.141 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2n09 1
. 10 . 1543 . 1 1 7 THR O O -23.260 16.135 15.999 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2n09 1
. 10 . 1544 . 1 1 7 THR OG1 O -23.749 15.032 13.111 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2n09 1
. 10 . 1545 . 1 1 8 SER C C -23.578 14.643 18.890 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . rr_2n09 1
. 10 . 1546 . 1 1 8 SER CA C -24.301 14.157 17.637 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . rr_2n09 1
. 10 . 1547 . 1 1 8 SER CB C -25.052 12.859 17.941 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . rr_2n09 1
. 10 . 1548 . 1 1 8 SER H H -23.054 13.045 16.337 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . rr_2n09 1
. 10 . 1549 . 1 1 8 SER HA H -25.012 14.910 17.331 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . rr_2n09 1
. 10 . 1550 . 1 1 8 SER HB2 H -25.487 12.476 17.030 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . rr_2n09 1
. 10 . 1551 . 1 1 8 SER HB3 H -24.362 12.132 18.344 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . rr_2n09 1
. 10 . 1552 . 1 1 8 SER HG H -25.881 12.613 19.699 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . rr_2n09 1
. 10 . 1553 . 1 1 8 SER N N -23.363 13.953 16.539 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . rr_2n09 1
. 10 . 1554 . 1 1 8 SER O O -24.155 15.351 19.716 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . rr_2n09 1
. 10 . 1555 . 1 1 8 SER OG O -26.088 13.077 18.884 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . rr_2n09 1
. 10 . 1556 . 1 1 9 ASP C C -21.432 16.177 20.289 . . . 1.0 . . . . . . . . . . . . A . 9 ASP C . . . . . . . . . rr_2n09 1
. 10 . 1557 . 1 1 9 ASP CA C -21.511 14.657 20.177 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CA . . . . . . . . . rr_2n09 1
. 10 . 1558 . 1 1 9 ASP CB C -20.103 14.064 20.074 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CB . . . . . . . . . rr_2n09 1
. 10 . 1559 . 1 1 9 ASP CG C -19.685 13.343 21.340 . . . 1.0 . . . . . . . . . . . . A . 9 ASP CG . . . . . . . . . rr_2n09 1
. 10 . 1560 . 1 1 9 ASP H H -21.907 13.695 18.333 . . . 1.0 . . . . . . . . . . . . A . 9 ASP H . . . . . . . . . rr_2n09 1
. 10 . 1561 . 1 1 9 ASP HA H -21.991 14.268 21.062 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HA . . . . . . . . . rr_2n09 1
. 10 . 1562 . 1 1 9 ASP HB2 H -20.076 13.359 19.256 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB2 . . . . . . . . . rr_2n09 1
. 10 . 1563 . 1 1 9 ASP HB3 H -19.396 14.857 19.883 . . . 1.0 . . . . . . . . . . . . A . 9 ASP HB3 . . . . . . . . . rr_2n09 1
. 10 . 1564 . 1 1 9 ASP N N -22.312 14.260 19.024 . . . 1.0 . . . . . . . . . . . . A . 9 ASP N . . . . . . . . . rr_2n09 1
. 10 . 1565 . 1 1 9 ASP O O -22.053 16.776 21.166 . . . 1.0 . . . . . . . . . . . . A . 9 ASP O . . . . . . . . . rr_2n09 1
. 10 . 1566 . 1 1 9 ASP OD1 O -20.314 12.316 21.673 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD1 . . . . . . . . . rr_2n09 1
. 10 . 1567 . 1 1 9 ASP OD2 O -18.730 13.804 21.999 . . . 1.0 . . . . . . . . . . . . A . 9 ASP OD2 . . . . . . . . . rr_2n09 1
. 10 . 1568 . 1 1 10 PHE C C -19.764 18.717 20.638 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2n09 1
. 10 . 1569 . 1 1 10 PHE CA C -20.499 18.244 19.386 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2n09 1
. 10 . 1570 . 1 1 10 PHE CB C -21.859 18.939 19.282 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2n09 1
. 10 . 1571 . 1 1 10 PHE CD1 C -21.208 21.010 18.022 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2n09 1
. 10 . 1572 . 1 1 10 PHE CD2 C -22.221 21.260 20.166 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2n09 1
. 10 . 1573 . 1 1 10 PHE CE1 C -21.117 22.383 17.901 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2n09 1
. 10 . 1574 . 1 1 10 PHE CE2 C -22.132 22.634 20.052 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2n09 1
. 10 . 1575 . 1 1 10 PHE CG C -21.760 20.433 19.154 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2n09 1
. 10 . 1576 . 1 1 10 PHE CZ C -21.579 23.197 18.917 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2n09 1
. 10 . 1577 . 1 1 10 PHE H H -20.196 16.257 18.719 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2n09 1
. 10 . 1578 . 1 1 10 PHE HA H -19.907 18.502 18.521 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2n09 1
. 10 . 1579 . 1 1 10 PHE HB2 H -22.380 18.566 18.413 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2n09 1
. 10 . 1580 . 1 1 10 PHE HB3 H -22.438 18.718 20.166 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2n09 1
. 10 . 1581 . 1 1 10 PHE HD1 H -20.847 20.375 17.226 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2n09 1
. 10 . 1582 . 1 1 10 PHE HD2 H -22.653 20.821 21.054 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2n09 1
. 10 . 1583 . 1 1 10 PHE HE1 H -20.684 22.820 17.013 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2n09 1
. 10 . 1584 . 1 1 10 PHE HE2 H -22.494 23.268 20.848 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2n09 1
. 10 . 1585 . 1 1 10 PHE HZ H -21.508 24.270 18.825 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2n09 1
. 10 . 1586 . 1 1 10 PHE N N -20.664 16.792 19.393 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2n09 1
. 10 . 1587 . 1 1 10 PHE O O -18.606 19.128 20.570 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2n09 1
. 10 . 1588 . 1 1 11 PHE C C -18.582 18.288 23.343 . . . 1.0 . . . . . . . . . . . . A . 11 PHE C . . . . . . . . . rr_2n09 1
. 10 . 1589 . 1 1 11 PHE CA C -19.853 19.078 23.044 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CA . . . . . . . . . rr_2n09 1
. 10 . 1590 . 1 1 11 PHE CB C -20.856 18.899 24.185 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CB . . . . . . . . . rr_2n09 1
. 10 . 1591 . 1 1 11 PHE CD1 C -20.342 20.963 25.516 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD1 . . . . . . . . . rr_2n09 1
. 10 . 1592 . 1 1 11 PHE CD2 C -20.163 18.844 26.595 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CD2 . . . . . . . . . rr_2n09 1
. 10 . 1593 . 1 1 11 PHE CE1 C -19.964 21.595 26.686 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE1 . . . . . . . . . rr_2n09 1
. 10 . 1594 . 1 1 11 PHE CE2 C -19.784 19.470 27.768 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CE2 . . . . . . . . . rr_2n09 1
. 10 . 1595 . 1 1 11 PHE CG C -20.446 19.583 25.458 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CG . . . . . . . . . rr_2n09 1
. 10 . 1596 . 1 1 11 PHE CZ C -19.685 20.847 27.813 . . . 1.0 . . . . . . . . . . . . A . 11 PHE CZ . . . . . . . . . rr_2n09 1
. 10 . 1597 . 1 1 11 PHE H H -21.363 18.318 21.770 . . . 1.0 . . . . . . . . . . . . A . 11 PHE H . . . . . . . . . rr_2n09 1
. 10 . 1598 . 1 1 11 PHE HA H -19.600 20.124 22.959 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HA . . . . . . . . . rr_2n09 1
. 10 . 1599 . 1 1 11 PHE HB2 H -21.810 19.306 23.883 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB2 . . . . . . . . . rr_2n09 1
. 10 . 1600 . 1 1 11 PHE HB3 H -20.970 17.846 24.394 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HB3 . . . . . . . . . rr_2n09 1
. 10 . 1601 . 1 1 11 PHE HD1 H -20.561 21.549 24.635 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD1 . . . . . . . . . rr_2n09 1
. 10 . 1602 . 1 1 11 PHE HD2 H -20.240 17.768 26.561 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HD2 . . . . . . . . . rr_2n09 1
. 10 . 1603 . 1 1 11 PHE HE1 H -19.887 22.671 26.718 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE1 . . . . . . . . . rr_2n09 1
. 10 . 1604 . 1 1 11 PHE HE2 H -19.567 18.883 28.648 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HE2 . . . . . . . . . rr_2n09 1
. 10 . 1605 . 1 1 11 PHE HZ H -19.389 21.338 28.728 . . . 1.0 . . . . . . . . . . . . A . 11 PHE HZ . . . . . . . . . rr_2n09 1
. 10 . 1606 . 1 1 11 PHE N N -20.443 18.656 21.779 . . . 1.0 . . . . . . . . . . . . A . 11 PHE N . . . . . . . . . rr_2n09 1
. 10 . 1607 . 1 1 11 PHE O O -17.588 18.844 23.810 . . . 1.0 . . . . . . . . . . . . A . 11 PHE O . . . . . . . . . rr_2n09 1
. 10 . 1608 . 1 1 12 NH2 HN1 H -17.811 16.457 23.252 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN1 . . . . . . . . . rr_2n09 1
. 10 . 1609 . 1 1 12 NH2 HN2 H -19.440 16.614 22.699 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 HN2 . . . . . . . . . rr_2n09 1
. 10 . 1610 . 1 1 12 NH2 N N -18.614 16.988 23.070 . . . 1.0 . . . . . . . . . . . . A . 12 NH2 N . . . . . . . . . rr_2n09 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_2n09
_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 2n09.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_2n09 1
1 2n09.mr . . XPLOR/CNS 2 distance NOE simple 46 rr_2n09 1
1 2n09.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 10 rr_2n09 1
1 2n09.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_2n09 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_2n09
_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: '2n09'" . . . . distance "general distance" . 33 rr_2n09 1
2 "From CCPN project: '2n09'" . . . . distance "hydrogen bond" . 10 rr_2n09 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 2n09.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_2n09 1
1 2n09.mr . . XPLOR/CNS 2 distance NOE simple 46 rr_2n09 1
1 2n09.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 10 rr_2n09 1
1 2n09.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_2n09 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_2n09
_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_2n09 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 OR . 1 1 3 3 GLU H H . . . 1 1 2 2 ABA HB2 H . . . . . 0.0 0.0 6.0 . . . . . A . 3 GLU H . . A . 2 AIB HB2 . . . 3 . HN . . . . . 2 . HB* . . rr_2n09 1
1 2 OR . 1 1 3 3 GLU H H . . . 1 1 2 2 ABA HB3 H . . . . . 0.0 0.0 6.0 . . . . . A . 3 GLU H . . A . 2 AIB HB3 . . . 3 . HN . . . . . 2 . HB* . . rr_2n09 1
2 1 OR . 1 1 4 4 GLY H H . . . 1 1 2 2 ABA HB2 H . . . . . 0.0 0.0 6.0 . . . . . A . 4 GLY H . . A . 2 AIB HB2 . . . 4 . HN . . . . . 2 . HB* . . rr_2n09 1
2 2 OR . 1 1 2 2 ABA HB3 H . . . 1 1 4 4 GLY H H . . . . . 0.0 0.0 6.0 . . . . . A . 2 AIB HB3 . . A . 4 GLY H . . . 2 . HB* . . . . . 4 . HN . . rr_2n09 1
3 1 . . 1 1 4 4 GLY H H . . . 1 1 3 3 GLU HA H . . . . . 0.0 0.0 3.5 . . . . . A . 4 GLY H . . A . 3 GLU HA . . . 4 . HN . . . . . 3 . HA . . rr_2n09 1
4 1 . . 1 1 3 3 GLU HA H . . . 1 1 5 5 THR H H . . . . . 0.0 0.0 6.0 . . . . . A . 3 GLU HA . . A . 5 THR H . . . 3 . HA . . . . . 5 . HN . . rr_2n09 1
5 1 . . 1 1 4 4 GLY H H . . . 1 1 3 3 GLU HB2 H . . . . . 0.0 0.0 6.0 . . . . . A . 4 GLY H . . A . 3 GLU HB2 . . . 4 . HN . . . . . 3 . HB1 . . rr_2n09 1
6 1 . . 1 1 4 4 GLY H H . . . 1 1 3 3 GLU HB3 H . . . . . 0.0 0.0 6.0 . . . . . A . 4 GLY H . . A . 3 GLU HB3 . . . 4 . HN . . . . . 3 . HB2 . . rr_2n09 1
7 1 OR . 1 1 4 4 GLY H H . . . 1 1 3 3 GLU HG2 H . . . . . 0.0 0.0 6.0 . . . . . A . 4 GLY H . . A . 3 GLU HG2 . . . 4 . HN . . . . . 3 . HG* . . rr_2n09 1
7 2 OR . 1 1 4 4 GLY H H . . . 1 1 3 3 GLU HG3 H . . . . . 0.0 0.0 6.0 . . . . . A . 4 GLY H . . A . 3 GLU HG3 . . . 4 . HN . . . . . 3 . HG* . . rr_2n09 1
8 1 . . 1 1 5 5 THR H H . . . 1 1 4 4 GLY HA2 H . . . . . 0.0 0.0 3.5 . . . . . A . 5 THR H . . A . 4 GLY HA2 . . . 5 . HN . . . . . 4 . HA1 . . rr_2n09 1
9 1 . . 1 1 4 4 GLY H H . . . 1 1 5 5 THR H H . . . . . 0.0 0.0 5.0 . . . . . A . 4 GLY H . . A . 5 THR H . . . 4 . HN . . . . . 5 . HN . . rr_2n09 1
10 1 . . 1 1 5 5 THR HA H . . . 1 1 6 6 PHE H H . . . . . 0.0 0.0 2.7 . . . . . A . 5 THR HA . . A . 6 PHE H . . . 5 . HA . . . . . 6 . HN . . rr_2n09 1
11 1 . . 1 1 5 5 THR HA H . . . 1 1 7 7 THR H H . . . . . 0.0 0.0 5.0 . . . . . A . 5 THR HA . . A . 7 THR H . . . 5 . HA . . . . . 7 . HN . . rr_2n09 1
12 1 . . 1 1 5 5 THR H H . . . 1 1 6 6 PHE H H . . . . . 0.0 0.0 5.0 . . . . . A . 5 THR H . . A . 6 PHE H . . . 5 . HN . . . . . 6 . HN . . rr_2n09 1
13 1 . . 1 1 5 5 THR H H . . . 1 1 7 7 THR H H . . . . . 0.0 0.0 6.0 . . . . . A . 5 THR H . . A . 7 THR H . . . 5 . HN . . . . . 7 . HN . . rr_2n09 1
14 1 . . 1 1 6 6 PHE H H . . . 1 1 6 6 PHE HB2 H . . . . . 0.0 0.0 2.7 . . . . . A . 6 PHE H . . A . 6 PHE HB2 . . . 6 . HN . . . . . 6 . HB1 . . rr_2n09 1
15 1 . . 1 1 6 6 PHE H H . . . 1 1 6 6 PHE HB3 H . . . . . 0.0 0.0 5.0 . . . . . A . 6 PHE H . . A . 6 PHE HB3 . . . 6 . HN . . . . . 6 . HB2 . . rr_2n09 1
16 1 . . 1 1 7 7 THR H H . . . 1 1 6 6 PHE HB2 H . . . . . 0.0 0.0 3.5 . . . . . A . 7 THR H . . A . 6 PHE HB2 . . . 7 . HN . . . . . 6 . HB1 . . rr_2n09 1
17 1 . . 1 1 7 7 THR H H . . . 1 1 6 6 PHE HB3 H . . . . . 0.0 0.0 5.0 . . . . . A . 7 THR H . . A . 6 PHE HB3 . . . 7 . HN . . . . . 6 . HB2 . . rr_2n09 1
18 1 . . 1 1 6 6 PHE H H . . . 1 1 7 7 THR H H . . . . . 0.0 0.0 5.0 . . . . . A . 6 PHE H . . A . 7 THR H . . . 6 . HN . . . . . 7 . HN . . rr_2n09 1
19 1 . . 1 1 7 7 THR H H . . . 1 1 8 8 SER H H . . . . . 0.0 0.0 5.0 . . . . . A . 7 THR H . . A . 8 SER H . . . 7 . HN . . . . . 8 . HN . . rr_2n09 1
20 1 . . 1 1 8 8 SER HA H . . . 1 1 9 9 ASP H H . . . . . 0.0 0.0 6.0 . . . . . A . 8 SER HA . . A . 9 ASP H . . . 8 . HA . . . . . 9 . HN . . rr_2n09 1
21 1 . . 1 1 8 8 SER HA H . . . 1 1 10 10 PHE H H . . . . . 0.0 0.0 6.0 . . . . . A . 8 SER HA . . A . 10 PHE H . . . 8 . HA . . . . . 10 . HN . . rr_2n09 1
22 1 OR . 1 1 9 9 ASP H H . . . 1 1 8 8 SER HB2 H . . . . . 0.0 0.0 6.0 . . . . . A . 9 ASP H . . A . 8 SER HB2 . . . 9 . HN . . . . . 8 . HB* . . rr_2n09 1
22 2 OR . 1 1 9 9 ASP H H . . . 1 1 8 8 SER HB3 H . . . . . 0.0 0.0 6.0 . . . . . A . 9 ASP H . . A . 8 SER HB3 . . . 9 . HN . . . . . 8 . HB* . . rr_2n09 1
23 1 . . 1 1 8 8 SER H H . . . 1 1 9 9 ASP H H . . . . . 0.0 0.0 5.0 . . . . . A . 8 SER H . . A . 9 ASP H . . . 8 . HN . . . . . 9 . HN . . rr_2n09 1
24 1 . . 1 1 10 10 PHE H H . . . 1 1 9 9 ASP HA H . . . . . 0.0 0.0 5.0 . . . . . A . 10 PHE H . . A . 9 ASP HA . . . 10 . HN . . . . . 9 . HA . . rr_2n09 1
25 1 . . 1 1 9 9 ASP H H . . . 1 1 10 10 PHE H H . . . . . 0.0 0.0 5.0 . . . . . A . 9 ASP H . . A . 10 PHE H . . . 9 . HN . . . . . 10 . HN . . rr_2n09 1
26 1 . . 1 1 10 10 PHE HA H . . . 1 1 11 11 PHE H H . . . . . 0.0 0.0 5.0 . . . . . A . 10 PHE HA . . A . 11 PHE H . . . 10 . HA . . . . . 11 . HN . . rr_2n09 1
27 1 . . 1 1 10 10 PHE HA H . . . 1 1 10 10 PHE HB3 H . . . . . 0.0 0.0 5.0 . . . . . A . 10 PHE HA . . A . 10 PHE HB3 . . . 10 . HA . . . . . 10 . HB2 . . rr_2n09 1
28 1 OR . 1 1 10 10 PHE HA H . . . 1 1 9 9 ASP HB2 H . . . . . 0.0 0.0 6.0 . . . . . A . 10 PHE HA . . A . 9 ASP HB2 . . . 10 . HA . . . . . 9 . HB* . . rr_2n09 1
28 2 OR . 1 1 10 10 PHE HA H . . . 1 1 9 9 ASP HB3 H . . . . . 0.0 0.0 6.0 . . . . . A . 10 PHE HA . . A . 9 ASP HB3 . . . 10 . HA . . . . . 9 . HB* . . rr_2n09 1
29 1 . . 1 1 10 10 PHE H H . . . 1 1 11 11 PHE H H . . . . . 0.0 0.0 5.0 . . . . . A . 10 PHE H . . A . 11 PHE H . . . 10 . HN . . . . . 11 . HN . . rr_2n09 1
30 1 . . 1 1 11 11 PHE HA H . . . 1 1 11 11 PHE HB2 H . . . . . 0.0 0.0 5.0 . . . . . A . 11 PHE HA . . A . 11 PHE HB2 . . . 11 . HA . . . . . 11 . HB1 . . rr_2n09 1
31 1 . . 1 1 11 11 PHE HA H . . . 1 1 11 11 PHE HB3 H . . . . . 0.0 0.0 6.0 . . . . . A . 11 PHE HA . . A . 11 PHE HB3 . . . 11 . HA . . . . . 11 . HB2 . . rr_2n09 1
32 1 . . 1 1 11 11 PHE HA H . . . 1 1 11 11 PHE QD H . . . . . 0.0 0.0 6.0 . . . . . A . 11 PHE HA . . A . 11 PHE QD . . . 11 . HA . . . . . 11 . HD* . . rr_2n09 1
33 1 OR . 1 1 11 11 PHE QD H . . . 1 1 11 11 PHE HB2 H . . . . . 0.0 0.0 5.0 . . . . . A . 11 PHE QD . . A . 11 PHE HB2 . . . 11 . HD* . . . . . 11 . HB* . . rr_2n09 1
33 2 OR . 1 1 11 11 PHE QD H . . . 1 1 11 11 PHE HB3 H . . . . . 0.0 0.0 5.0 . . . . . A . 11 PHE QD . . A . 11 PHE HB3 . . . 11 . HD* . . . . . 11 . HB* . . rr_2n09 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
;DapARA-NH2 cyclic NOE Assignment Table (from visual inspection)
H A E G T F T S D F F NH2 7(S) 6-5(M) 4,3 (W) and 2,1 (vW)
H1
;
1 1 5 4 rr_2n09 1
2 (7)s 6 74 6 80 rr_2n09 1
3 (4)w 9 74 9 80 rr_2n09 1
4
;(4)w
A2
;
10 75 12 4 rr_2n09 1
5 (2)vw 13 75 13 82 rr_2n09 1
6 "(6)m + 1.0 corr" 15 75 15 92 rr_2n09 1
7 "(4)w + 1.0 corr" 16 75 16 92 rr_2n09 1
8
;(5)w + 1.0 corr
E3
;
18 75 21 4 rr_2n09 1
9 (8)m 22 76 22 82 rr_2n09 1
10 "(3) w" 23 76 23 83 rr_2n09 1
11 (2)vw 24 76 24 83 rr_2n09 1
12 (2)vw 25 76 25 83 rr_2n09 1
13
;(2)vw
G4
;
26 76 29 4 rr_2n09 1
14 (7)m 30 80 30 86 rr_2n09 1
15
;(3)w
T5
;
31 79 33 4 rr_2n09 1
16 (7)s 34 79 34 85 rr_2n09 1
17 (3)w 35 79 35 85 rr_2n09 1
18 "(3)w + corr" 36 80 36 93 rr_2n09 1
19 (3)w 37 79 37 85 rr_2n09 1
20
;(2)w
F6
;
38 79 40 4 rr_2n09 1
21 (7)s 41 80 41 86 rr_2n09 1
22 (4)w 42 80 42 86 rr_2n09 1
23 (6)m 43 79 43 85 rr_2n09 1
24 "(3 w" 44 79 44 85 rr_2n09 1
25 (1)vw 45 80 45 87 rr_2n09 1
26 (3)w 46 78 46 84 rr_2n09 1
27
;(1)vw
T7
;
47 80 49 4 rr_2n09 1
28 (1)vw 50 80 50 87 rr_2n09 1
29 (3)w 51 80 51 86 rr_2n09 1
30 (2)vw 52 80 52 87 rr_2n09 1
31
;(3)w
S8
;
53 79 56 4 rr_2n09 1
32 (2)vw 57 79 57 86 rr_2n09 1
33 (2)vw 58 79 58 87 rr_2n09 1
34 "(2 v w" 59 79 59 87 rr_2n09 1
35
;(4 w
D9
;
60 78 62 4 rr_2n09 1
36 (3)w 63 79 63 85 rr_2n09 1
37
;(4)w
F10
;
64 79 68 5 rr_2n09 1
38 (4)w 69 79 69 85 rr_2n09 1
39 (3)w 70 80 70 86 rr_2n09 1
40 (2)vw 71 79 71 86 rr_2n09 1
41
;(3)w
F11
;
72 79 75 5 rr_2n09 1
42 (4)w 76 79 76 86 rr_2n09 1
43 (3)w 77 79 77 85 rr_2n09 1
44 (3)w 78 80 78 87 rr_2n09 1
45 (2)vw 79 80 79 87 rr_2n09 1
46 (4)w 80 80 80 86 rr_2n09 1
47 (4)w 81 81 81 87 rr_2n09 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) not linked" rr_2n09 1
2 2 2 1 "Not handling restraint 2, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
3 2 3 1 "Not handling restraint 3, item 1, resonance(s) ' .2.HD2' (nmrStar names) not linked" rr_2n09 1
4 2 4 1 "Not handling restraint 4, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
5 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
6 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
7 2 17 1 "Not handling restraint 17, item 1, resonance(s) ' .5.HG2' (nmrStar names) not linked" rr_2n09 1
8 2 24 1 "Not handling restraint 24, item 1, resonance(s) ' .5.HD2' (nmrStar names) not linked" rr_2n09 1
9 2 26 1 "Not handling restraint 26, item 1, resonance(s) ' .7.HG2' (nmrStar names) not linked" rr_2n09 1
10 2 27 1 "Not handling restraint 27, item 1, resonance(s) ' .11.HD' (nmrStar names) not linked" rr_2n09 1
11 2 28 1 "Not handling restraint 28, item 1, resonance(s) ' .10.HD' (nmrStar names) not linked" rr_2n09 1
12 2 29 1 "Not handling restraint 29, item 1, resonance(s) ' .7.HG2' (nmrStar names) not linked" rr_2n09 1
13 2 41 1 "Not handling restraint 41, item 1, resonance(s) ' .11.H1' (nmrStar names) not linked" rr_2n09 1
14 2 42 1 "Not handling restraint 42, item 1, resonance(s) ' .11.H2' (nmrStar names) not linked" rr_2n09 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3
_Gen_dist_constraint_list.Entry_ID rr_2n09
_Gen_dist_constraint_list.ID 2
_Gen_dist_constraint_list.Constraint_type "hydrogen bond"
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 3
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_2n09 2
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 4 4 GLY H H . . . 1 1 1 1 HIS O O . . . . . 1.88 1.58 2.3 . . . . . A . 4 GLY H . . A . 1 HIS O . . . 4 . HN . . . . . 1 . O . . rr_2n09 2
2 1 . . 1 1 1 1 HIS O O . . . 1 1 4 4 GLY N N . . . . . 2.88 2.58 3.3 . . . . . A . 1 HIS O . . A . 4 GLY N . . . 1 . O . . . . . 4 . N . . rr_2n09 2
3 1 . . 1 1 5 5 THR H H . . . 1 1 2 2 ABA O O . . . . . 1.88 1.58 2.3 . . . . . A . 5 THR H . . A . 2 AIB O . . . 5 . HN . . . . . 2 . O . . rr_2n09 2
4 1 . . 1 1 2 2 ABA O O . . . 1 1 5 5 THR N N . . . . . 2.88 2.58 3.3 . . . . . A . 2 AIB O . . A . 5 THR N . . . 2 . O . . . . . 5 . N . . rr_2n09 2
5 1 . . 1 1 9 9 ASP H H . . . 1 1 5 5 THR O O . . . . . 1.88 1.58 2.3 . . . . . A . 9 ASP H . . A . 5 THR O . . . 9 . HN . . . . . 5 . O . . rr_2n09 2
6 1 . . 1 1 5 5 THR O O . . . 1 1 9 9 ASP N N . . . . . 2.88 2.58 3.3 . . . . . A . 5 THR O . . A . 9 ASP N . . . 5 . O . . . . . 9 . N . . rr_2n09 2
7 1 . . 1 1 8 8 SER H H . . . 1 1 4 4 GLY O O . . . . . 1.88 1.58 2.3 . . . . . A . 8 SER H . . A . 4 GLY O . . . 8 . HN . . . . . 4 . O . . rr_2n09 2
8 1 . . 1 1 4 4 GLY O O . . . 1 1 8 8 SER N N . . . . . 2.88 2.58 3.3 . . . . . A . 4 GLY O . . A . 8 SER N . . . 4 . O . . . . . 8 . N . . rr_2n09 2
9 1 . . 1 1 10 10 PHE H H . . . 1 1 6 6 PHE O O . . . . . 1.88 1.58 2.3 . . . . . A . 10 PHE H . . A . 6 PHE O . . . 10 . HN . . . . . 6 . O . . rr_2n09 2
10 1 . . 1 1 6 6 PHE O O . . . 1 1 10 10 PHE N N . . . . . 2.88 2.58 3.3 . . . . . A . 6 PHE O . . A . 10 PHE N . . . 6 . O . . . . . 10 . N . . rr_2n09 2
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 H-Bonds 1 1 1 9 rr_2n09 2
2
;assign (resid 7 and name O )(resid 11 and name HN ) 1.88 0.3 0.42
assign (resid 7 and name O )(resid 11 and name N ) 2.88 0.3 0.42
;
18 1 19 76 rr_2n09 2
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_2n09
_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_2n09 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 2 . OR rr_2n09 1
1 2 . 3 . rr_2n09 1
1 3 . . . rr_2n09 1
2 1 2 . OR rr_2n09 1
2 2 . 3 . rr_2n09 1
2 3 . . . rr_2n09 1
3 1 . . . rr_2n09 1
4 1 . . . rr_2n09 1
5 1 . . . rr_2n09 1
6 1 . . . rr_2n09 1
7 1 2 . OR rr_2n09 1
7 2 . 3 . rr_2n09 1
7 3 . . . rr_2n09 1
8 1 . . . rr_2n09 1
9 1 . . . rr_2n09 1
10 1 . . . rr_2n09 1
11 1 . . . rr_2n09 1
12 1 . . . rr_2n09 1
13 1 . . . rr_2n09 1
14 1 . . . rr_2n09 1
15 1 . . . rr_2n09 1
16 1 . . . rr_2n09 1
17 1 . . . rr_2n09 1
18 1 . . . rr_2n09 1
19 1 . . . rr_2n09 1
20 1 . . . rr_2n09 1
21 1 . . . rr_2n09 1
22 1 2 . OR rr_2n09 1
22 2 . 3 . rr_2n09 1
22 3 . . . rr_2n09 1
23 1 . . . rr_2n09 1
24 1 . . . rr_2n09 1
25 1 . . . rr_2n09 1
26 1 . . . rr_2n09 1
27 1 . . . rr_2n09 1
28 1 2 . OR rr_2n09 1
28 2 . 3 . rr_2n09 1
28 3 . . . rr_2n09 1
29 1 . . . rr_2n09 1
30 1 . . . rr_2n09 1
31 1 . . . rr_2n09 1
32 1 . . . rr_2n09 1
33 1 2 . OR rr_2n09 1
33 2 . 3 . rr_2n09 1
33 3 . . . rr_2n09 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 2 . 1 . 1 1 2 2 ABA HB2 H . . . . 2 . HB* rr_2n09 1
1 2 . 2 . 1 1 3 3 GLU H H . . . . 3 . HN rr_2n09 1
1 3 . 1 . 1 1 2 2 ABA HB3 H . . . . 2 . HB* rr_2n09 1
1 3 . 2 . 1 1 3 3 GLU H H . . . . 3 . HN rr_2n09 1
2 2 . 1 . 1 1 2 2 ABA HB2 H . . . . 2 . HB* rr_2n09 1
2 2 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
2 3 . 1 . 1 1 2 2 ABA HB3 H . . . . 2 . HB* rr_2n09 1
2 3 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
3 1 . 1 . 1 1 3 3 GLU HA H . . . . 3 . HA rr_2n09 1
3 1 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
4 1 . 1 . 1 1 3 3 GLU HA H . . . . 3 . HA rr_2n09 1
4 1 . 2 . 1 1 5 5 THR H H . . . . 5 . HN rr_2n09 1
5 1 . 1 . 1 1 3 3 GLU HB2 H . . . . 3 . HB1 rr_2n09 1
5 1 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
6 1 . 1 . 1 1 3 3 GLU HB3 H . . . . 3 . HB2 rr_2n09 1
6 1 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
7 2 . 1 . 1 1 3 3 GLU HG2 H . . . . 3 . HG* rr_2n09 1
7 2 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
7 3 . 1 . 1 1 3 3 GLU HG3 H . . . . 3 . HG* rr_2n09 1
7 3 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
8 1 . 1 . 1 1 4 4 GLY HA2 H . . . . 4 . HA1 rr_2n09 1
8 1 . 2 . 1 1 5 5 THR H H . . . . 5 . HN rr_2n09 1
9 1 . 1 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 1
9 1 . 2 . 1 1 5 5 THR H H . . . . 5 . HN rr_2n09 1
10 1 . 1 . 1 1 5 5 THR HA H . . . . 5 . HA rr_2n09 1
10 1 . 2 . 1 1 6 6 PHE H H . . . . 6 . HN rr_2n09 1
11 1 . 1 . 1 1 5 5 THR HA H . . . . 5 . HA rr_2n09 1
11 1 . 2 . 1 1 7 7 THR H H . . . . 7 . HN rr_2n09 1
12 1 . 1 . 1 1 5 5 THR H H . . . . 5 . HN rr_2n09 1
12 1 . 2 . 1 1 6 6 PHE H H . . . . 6 . HN rr_2n09 1
13 1 . 1 . 1 1 5 5 THR H H . . . . 5 . HN rr_2n09 1
13 1 . 2 . 1 1 7 7 THR H H . . . . 7 . HN rr_2n09 1
14 1 . 1 . 1 1 6 6 PHE H H . . . . 6 . HN rr_2n09 1
14 1 . 2 . 1 1 6 6 PHE HB2 H . . . . 6 . HB1 rr_2n09 1
15 1 . 1 . 1 1 6 6 PHE H H . . . . 6 . HN rr_2n09 1
15 1 . 2 . 1 1 6 6 PHE HB3 H . . . . 6 . HB2 rr_2n09 1
16 1 . 1 . 1 1 6 6 PHE HB2 H . . . . 6 . HB1 rr_2n09 1
16 1 . 2 . 1 1 7 7 THR H H . . . . 7 . HN rr_2n09 1
17 1 . 1 . 1 1 6 6 PHE HB3 H . . . . 6 . HB2 rr_2n09 1
17 1 . 2 . 1 1 7 7 THR H H . . . . 7 . HN rr_2n09 1
18 1 . 1 . 1 1 6 6 PHE H H . . . . 6 . HN rr_2n09 1
18 1 . 2 . 1 1 7 7 THR H H . . . . 7 . HN rr_2n09 1
19 1 . 1 . 1 1 7 7 THR H H . . . . 7 . HN rr_2n09 1
19 1 . 2 . 1 1 8 8 SER H H . . . . 8 . HN rr_2n09 1
20 1 . 1 . 1 1 8 8 SER HA H . . . . 8 . HA rr_2n09 1
20 1 . 2 . 1 1 9 9 ASP H H . . . . 9 . HN rr_2n09 1
21 1 . 1 . 1 1 8 8 SER HA H . . . . 8 . HA rr_2n09 1
21 1 . 2 . 1 1 10 10 PHE H H . . . . 10 . HN rr_2n09 1
22 2 . 1 . 1 1 8 8 SER HB2 H . . . . 8 . HB* rr_2n09 1
22 2 . 2 . 1 1 9 9 ASP H H . . . . 9 . HN rr_2n09 1
22 3 . 1 . 1 1 8 8 SER HB3 H . . . . 8 . HB* rr_2n09 1
22 3 . 2 . 1 1 9 9 ASP H H . . . . 9 . HN rr_2n09 1
23 1 . 1 . 1 1 8 8 SER H H . . . . 8 . HN rr_2n09 1
23 1 . 2 . 1 1 9 9 ASP H H . . . . 9 . HN rr_2n09 1
24 1 . 1 . 1 1 9 9 ASP HA H . . . . 9 . HA rr_2n09 1
24 1 . 2 . 1 1 10 10 PHE H H . . . . 10 . HN rr_2n09 1
25 1 . 1 . 1 1 9 9 ASP H H . . . . 9 . HN rr_2n09 1
25 1 . 2 . 1 1 10 10 PHE H H . . . . 10 . HN rr_2n09 1
26 1 . 1 . 1 1 10 10 PHE HA H . . . . 10 . HA rr_2n09 1
26 1 . 2 . 1 1 11 11 PHE H H . . . . 11 . HN rr_2n09 1
27 1 . 1 . 1 1 10 10 PHE HA H . . . . 10 . HA rr_2n09 1
27 1 . 2 . 1 1 10 10 PHE HB3 H . . . . 10 . HB2 rr_2n09 1
28 2 . 1 . 1 1 10 10 PHE HA H . . . . 10 . HA rr_2n09 1
28 2 . 2 . 1 1 9 9 ASP HB2 H . . . . 9 . HB* rr_2n09 1
28 3 . 1 . 1 1 10 10 PHE HA H . . . . 10 . HA rr_2n09 1
28 3 . 2 . 1 1 9 9 ASP HB3 H . . . . 9 . HB* rr_2n09 1
29 1 . 1 . 1 1 10 10 PHE H H . . . . 10 . HN rr_2n09 1
29 1 . 2 . 1 1 11 11 PHE H H . . . . 11 . HN rr_2n09 1
30 1 . 1 . 1 1 11 11 PHE HA H . . . . 11 . HA rr_2n09 1
30 1 . 2 . 1 1 11 11 PHE HB2 H . . . . 11 . HB1 rr_2n09 1
31 1 . 1 . 1 1 11 11 PHE HA H . . . . 11 . HA rr_2n09 1
31 1 . 2 . 1 1 11 11 PHE HB3 H . . . . 11 . HB2 rr_2n09 1
32 1 . 1 . 1 1 11 11 PHE HA H . . . . 11 . HA rr_2n09 1
32 1 . 2 . 1 1 11 11 PHE QD H . . . . 11 . HD* rr_2n09 1
33 2 . 1 . 1 1 11 11 PHE HB2 H . . . . 11 . HB* rr_2n09 1
33 2 . 2 . 1 1 11 11 PHE QD H . . . . 11 . HD* rr_2n09 1
33 3 . 1 . 1 1 11 11 PHE HB3 H . . . . 11 . HB* rr_2n09 1
33 3 . 2 . 1 1 11 11 PHE QD H . . . . 11 . HD* rr_2n09 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 2 . . . . . . 0.0 0.0 6.0 rr_2n09 1
1 3 . . . . . . 0.0 0.0 6.0 rr_2n09 1
2 2 . . . . . . 0.0 0.0 6.0 rr_2n09 1
2 3 . . . . . . 0.0 0.0 6.0 rr_2n09 1
3 1 . . . . . . 0.0 0.0 3.5 rr_2n09 1
4 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
5 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
6 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
7 2 . . . . . . 0.0 0.0 6.0 rr_2n09 1
7 3 . . . . . . 0.0 0.0 6.0 rr_2n09 1
8 1 . . . . . . 0.0 0.0 3.5 rr_2n09 1
9 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
10 1 . . . . . . 0.0 0.0 2.7 rr_2n09 1
11 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
12 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
13 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
14 1 . . . . . . 0.0 0.0 2.7 rr_2n09 1
15 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
16 1 . . . . . . 0.0 0.0 3.5 rr_2n09 1
17 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
18 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
19 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
20 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
21 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
22 2 . . . . . . 0.0 0.0 6.0 rr_2n09 1
22 3 . . . . . . 0.0 0.0 6.0 rr_2n09 1
23 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
24 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
25 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
26 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
27 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
28 2 . . . . . . 0.0 0.0 6.0 rr_2n09 1
28 3 . . . . . . 0.0 0.0 6.0 rr_2n09 1
29 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
30 1 . . . . . . 0.0 0.0 5.0 rr_2n09 1
31 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
32 1 . . . . . . 0.0 0.0 6.0 rr_2n09 1
33 2 . . . . . . 0.0 0.0 5.0 rr_2n09 1
33 3 . . . . . . 0.0 0.0 5.0 rr_2n09 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
;DapARA-NH2 cyclic NOE Assignment Table (from visual inspection)
H A E G T F T S D F F NH2 7(S) 6-5(M) 4,3 (W) and 2,1 (vW)
H1
;
1 1 5 4 rr_2n09 1
2 (7)s 6 74 6 80 rr_2n09 1
3 (4)w 9 74 9 80 rr_2n09 1
4
;(4)w
A2
;
10 75 12 4 rr_2n09 1
5 (2)vw 13 75 13 82 rr_2n09 1
6 "(6)m + 1.0 corr" 15 75 15 92 rr_2n09 1
7 "(4)w + 1.0 corr" 16 75 16 92 rr_2n09 1
8
;(5)w + 1.0 corr
E3
;
18 75 21 4 rr_2n09 1
9 (8)m 22 76 22 82 rr_2n09 1
10 "(3) w" 23 76 23 83 rr_2n09 1
11 (2)vw 24 76 24 83 rr_2n09 1
12 (2)vw 25 76 25 83 rr_2n09 1
13
;(2)vw
G4
;
26 76 29 4 rr_2n09 1
14 (7)m 30 80 30 86 rr_2n09 1
15
;(3)w
T5
;
31 79 33 4 rr_2n09 1
16 (7)s 34 79 34 85 rr_2n09 1
17 (3)w 35 79 35 85 rr_2n09 1
18 "(3)w + corr" 36 80 36 93 rr_2n09 1
19 (3)w 37 79 37 85 rr_2n09 1
20
;(2)w
F6
;
38 79 40 4 rr_2n09 1
21 (7)s 41 80 41 86 rr_2n09 1
22 (4)w 42 80 42 86 rr_2n09 1
23 (6)m 43 79 43 85 rr_2n09 1
24 "(3 w" 44 79 44 85 rr_2n09 1
25 (1)vw 45 80 45 87 rr_2n09 1
26 (3)w 46 78 46 84 rr_2n09 1
27
;(1)vw
T7
;
47 80 49 4 rr_2n09 1
28 (1)vw 50 80 50 87 rr_2n09 1
29 (3)w 51 80 51 86 rr_2n09 1
30 (2)vw 52 80 52 87 rr_2n09 1
31
;(3)w
S8
;
53 79 56 4 rr_2n09 1
32 (2)vw 57 79 57 86 rr_2n09 1
33 (2)vw 58 79 58 87 rr_2n09 1
34 "(2 v w" 59 79 59 87 rr_2n09 1
35
;(4 w
D9
;
60 78 62 4 rr_2n09 1
36 (3)w 63 79 63 85 rr_2n09 1
37
;(4)w
F10
;
64 79 68 5 rr_2n09 1
38 (4)w 69 79 69 85 rr_2n09 1
39 (3)w 70 80 70 86 rr_2n09 1
40 (2)vw 71 79 71 86 rr_2n09 1
41
;(3)w
F11
;
72 79 75 5 rr_2n09 1
42 (4)w 76 79 76 86 rr_2n09 1
43 (3)w 77 79 77 85 rr_2n09 1
44 (3)w 78 80 78 87 rr_2n09 1
45 (2)vw 79 80 79 87 rr_2n09 1
46 (4)w 80 80 80 86 rr_2n09 1
47 (4)w 81 81 81 87 rr_2n09 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) not linked" rr_2n09 1
2 2 2 1 "Not handling restraint 2, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
3 2 3 1 "Not handling restraint 3, item 1, resonance(s) ' .2.HD2' (nmrStar names) not linked" rr_2n09 1
4 2 4 1 "Not handling restraint 4, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
5 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
6 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .2.HN' (nmrStar names) not linked" rr_2n09 1
7 2 17 1 "Not handling restraint 17, item 1, resonance(s) ' .5.HG2' (nmrStar names) not linked" rr_2n09 1
8 2 24 1 "Not handling restraint 24, item 1, resonance(s) ' .5.HD2' (nmrStar names) not linked" rr_2n09 1
9 2 26 1 "Not handling restraint 26, item 1, resonance(s) ' .7.HG2' (nmrStar names) not linked" rr_2n09 1
10 2 27 1 "Not handling restraint 27, item 1, resonance(s) ' .11.HD' (nmrStar names) not linked" rr_2n09 1
11 2 28 1 "Not handling restraint 28, item 1, resonance(s) ' .10.HD' (nmrStar names) not linked" rr_2n09 1
12 2 29 1 "Not handling restraint 29, item 1, resonance(s) ' .7.HG2' (nmrStar names) not linked" rr_2n09 1
13 2 41 1 "Not handling restraint 41, item 1, resonance(s) ' .11.H1' (nmrStar names) not linked" rr_2n09 1
14 2 42 1 "Not handling restraint 42, item 1, resonance(s) ' .11.H2' (nmrStar names) not linked" rr_2n09 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Entry_ID rr_2n09
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
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_2n09 2
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_2n09 2
2 1 . . . rr_2n09 2
3 1 . . . rr_2n09 2
4 1 . . . rr_2n09 2
5 1 . . . rr_2n09 2
6 1 . . . rr_2n09 2
7 1 . . . rr_2n09 2
8 1 . . . rr_2n09 2
9 1 . . . rr_2n09 2
10 1 . . . rr_2n09 2
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 1 1 HIS O O . . . . 1 . O rr_2n09 2
1 1 . 2 . 1 1 4 4 GLY H H . . . . 4 . HN rr_2n09 2
2 1 . 1 . 1 1 1 1 HIS O O . . . . 1 . O rr_2n09 2
2 1 . 2 . 1 1 4 4 GLY N N . . . . 4 . N rr_2n09 2
3 1 . 1 . 1 1 2 2 ABA O O . . . . 2 . O rr_2n09 2
3 1 . 2 . 1 1 5 5 THR H H . . . . 5 . HN rr_2n09 2
4 1 . 1 . 1 1 2 2 ABA O O . . . . 2 . O rr_2n09 2
4 1 . 2 . 1 1 5 5 THR N N . . . . 5 . N rr_2n09 2
5 1 . 1 . 1 1 5 5 THR O O . . . . 5 . O rr_2n09 2
5 1 . 2 . 1 1 9 9 ASP H H . . . . 9 . HN rr_2n09 2
6 1 . 1 . 1 1 5 5 THR O O . . . . 5 . O rr_2n09 2
6 1 . 2 . 1 1 9 9 ASP N N . . . . 9 . N rr_2n09 2
7 1 . 1 . 1 1 4 4 GLY O O . . . . 4 . O rr_2n09 2
7 1 . 2 . 1 1 8 8 SER H H . . . . 8 . HN rr_2n09 2
8 1 . 1 . 1 1 4 4 GLY O O . . . . 4 . O rr_2n09 2
8 1 . 2 . 1 1 8 8 SER N N . . . . 8 . N rr_2n09 2
9 1 . 1 . 1 1 6 6 PHE O O . . . . 6 . O rr_2n09 2
9 1 . 2 . 1 1 10 10 PHE H H . . . . 10 . HN rr_2n09 2
10 1 . 1 . 1 1 6 6 PHE O O . . . . 6 . O rr_2n09 2
10 1 . 2 . 1 1 10 10 PHE N N . . . . 10 . N rr_2n09 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.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 . . . . . . 1.88 1.58 2.3 rr_2n09 2
2 1 . . . . . . 2.88 2.58 3.3 rr_2n09 2
3 1 . . . . . . 1.88 1.58 2.3 rr_2n09 2
4 1 . . . . . . 2.88 2.58 3.3 rr_2n09 2
5 1 . . . . . . 1.88 1.58 2.3 rr_2n09 2
6 1 . . . . . . 2.88 2.58 3.3 rr_2n09 2
7 1 . . . . . . 1.88 1.58 2.3 rr_2n09 2
8 1 . . . . . . 2.88 2.58 3.3 rr_2n09 2
9 1 . . . . . . 1.88 1.58 2.3 rr_2n09 2
10 1 . . . . . . 2.88 2.58 3.3 rr_2n09 2
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 H-Bonds 1 1 1 9 rr_2n09 2
2
;assign (resid 7 and name O )(resid 11 and name HN ) 1.88 0.3 0.42
assign (resid 7 and name O )(resid 11 and name N ) 2.88 0.3 0.42
;
18 1 19 76 rr_2n09 2
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_2n09
_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 DE NOVO PROTEIN 04-MAR-15 2N09 *TITLE NMR STRUCTURE OF A SHORT HYDROPHOBIC 11MER PEPTIDE IN DMSO-D6/H2O *TITLE 2 (1:3) SOLUTION *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: SHORT HYDROPHOBIC PEPTIDE WITH CYCLIC CONSTRAINTS; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES *KEYWDS HYDROPHOBIC PEPTIDE, GLP-1R AGONIST, DE NOVO PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR H.N.HOANG, K.SONG, T.A.HILL, D.R.DERKSEN, D.J.EDMONDS, W.M.KOK, *AUTHOR 2 C.LIMBERAKIS, S.LIRAS, P.M.LORIA, V.MASCITTI, A.M.MATHIOWETZ, *AUTHOR 3 J.M.MITCHELL, D.W.PIOTROWSKI, D.A.PRICE, R.V.STANTON, J.Y.SUEN, *AUTHOR 4 J.M.WITHKA, D.A.GRIFFITH, D.P.FAIRLIE *REVDAT 1 15-APR-15 2N09 0"
save_
Contact the webmaster for help, if required. Tuesday, May 28, 2024 11:52:14 PM GMT (wattos1)