NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
|
|
384563 |
1kmr   |
5277 | cing | 3-converted-DOCR | STAR | entry | full |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1kmr
# This DOCR archive file contains, for PDB entry <1kmr>:
#
# - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_1kmr
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1kmr"
_Entry.NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 1kmr"
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1kmr
_Assembly.ID 1
_Assembly.Name 1kmr
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 1702.1906
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 "PULMONARY SURFACTANT ASSOCIATED PROTEIN B" 1 $PULMONARY_SURFACTANT_ASSOCIATED_PROTEIN_B A . no . . . . . . rr_1kmr 1
stop_
save_
save_PULMONARY_SURFACTANT_ASSOCIATED_PROTEIN_B
_Entity.Sf_category entity
_Entity.Sf_framecode PULMONARY_SURFACTANT_ASSOCIATED_PROTEIN_B
_Entity.Entry_ID rr_1kmr
_Entity.ID 1
_Entity.Name PULMONARY_SURFACTANT_ASSOCIATED_PROTEIN_B
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code CRALIKRIQAMIPKG
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Number_of_monomers 15
_Entity.Paramagnetic no
_Entity.Thiol_state "all free"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 1702.1906
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 . CYS . rr_1kmr 1
2 . ARG . rr_1kmr 1
3 . ALA . rr_1kmr 1
4 . LEU . rr_1kmr 1
5 . ILE . rr_1kmr 1
6 . LYS . rr_1kmr 1
7 . ARG . rr_1kmr 1
8 . ILE . rr_1kmr 1
9 . GLN . rr_1kmr 1
10 . ALA . rr_1kmr 1
11 . MET . rr_1kmr 1
12 . ILE . rr_1kmr 1
13 . PRO . rr_1kmr 1
14 . LYS . rr_1kmr 1
15 . GLY . rr_1kmr 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
. CYS 1 1 rr_1kmr 1
. ARG 2 2 rr_1kmr 1
. ALA 3 3 rr_1kmr 1
. LEU 4 4 rr_1kmr 1
. ILE 5 5 rr_1kmr 1
. LYS 6 6 rr_1kmr 1
. ARG 7 7 rr_1kmr 1
. ILE 8 8 rr_1kmr 1
. GLN 9 9 rr_1kmr 1
. ALA 10 10 rr_1kmr 1
. MET 11 11 rr_1kmr 1
. ILE 12 12 rr_1kmr 1
. PRO 13 13 rr_1kmr 1
. LYS 14 14 rr_1kmr 1
. GLY 15 15 rr_1kmr 1
stop_
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_1kmr
_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 17
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_1kmr
_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_1kmr 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_1kmr 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 CYS C C -3.837 -7.238 1.649 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 1 . 2 . 1 1 1 CYS CA C -4.882 -6.915 0.549 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 1 . 3 . 1 1 1 CYS CB C -5.867 -5.814 0.986 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 1 . 4 . 1 1 1 CYS H1 H -5.002 -8.882 -0.142 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 1 . 5 . 1 1 1 CYS H2 H -6.138 -8.519 1.001 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 1 . 6 . 1 1 1 CYS H3 H -6.317 -7.965 -0.544 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 1 . 7 . 1 1 1 CYS HA H -4.376 -6.566 -0.370 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 1 . 8 . 1 1 1 CYS HB2 H -6.470 -6.122 1.862 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 1 . 9 . 1 1 1 CYS HB3 H -5.319 -4.904 1.291 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 1 . 10 . 1 1 1 CYS HG H -7.637 -4.415 0.262 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 1 . 11 . 1 1 1 CYS N N -5.627 -8.142 0.195 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 1 . 12 . 1 1 1 CYS O O -4.202 -7.633 2.763 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 1 . 13 . 1 1 1 CYS SG S -6.980 -5.370 -0.389 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 1 . 14 . 1 1 2 ARG C C -0.182 -6.618 2.284 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 1 . 15 . 1 1 2 ARG CA C -1.421 -7.561 2.184 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 1 . 16 . 1 1 2 ARG CB C -1.214 -9.127 2.117 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 1 . 17 . 1 1 2 ARG CD C 0.265 -9.577 0.005 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 1 . 18 . 1 1 2 ARG CG C -1.062 -9.832 0.743 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 1 . 19 . 1 1 2 ARG CZ C 1.401 -10.321 -2.099 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 1 . 20 . 1 1 2 ARG H H -2.370 -6.753 0.363 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 1 . 21 . 1 1 2 ARG HA H -1.745 -7.390 3.212 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 1 . 22 . 1 1 2 ARG HB2 H -0.359 -9.405 2.765 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 1 . 23 . 1 1 2 ARG HB3 H -2.072 -9.597 2.625 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 1 . 24 . 1 1 2 ARG HD2 H 0.389 -8.497 -0.191 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 1 . 25 . 1 1 2 ARG HD3 H 1.114 -9.870 0.648 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 1 . 26 . 1 1 2 ARG HE H -0.479 -10.840 -1.636 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 1 . 27 . 1 1 2 ARG HG2 H -1.163 -10.920 0.913 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 1 . 28 . 1 1 2 ARG HG3 H -1.917 -9.563 0.095 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 1 . 29 . 1 1 2 ARG HH11 H 2.595 -9.193 -0.938 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 1 . 30 . 1 1 2 ARG HH12 H 3.293 -9.787 -2.527 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 1 . 31 . 1 1 2 ARG HH21 H 0.420 -11.461 -3.421 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 1 . 32 . 1 1 2 ARG HH22 H 2.142 -10.985 -3.836 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 1 . 33 . 1 1 2 ARG N N -2.536 -7.093 1.316 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 1 . 34 . 1 1 2 ARG NE N 0.326 -10.310 -1.283 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 1 . 35 . 1 1 2 ARG NH1 N 2.548 -9.701 -1.828 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 1 . 36 . 1 1 2 ARG NH2 N 1.311 -10.989 -3.234 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 1 . 37 . 1 1 2 ARG O O -0.303 -5.424 2.566 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 1 . 38 . 1 1 3 ALA C C 2.844 -5.428 1.513 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 1 . 39 . 1 1 3 ALA CA C 2.317 -6.610 2.380 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 1 . 40 . 1 1 3 ALA CB C 3.167 -7.883 2.124 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 1 . 41 . 1 1 3 ALA H H 0.921 -8.211 1.907 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 1 . 42 . 1 1 3 ALA HA H 2.373 -6.343 3.452 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 1 . 43 . 1 1 3 ALA HB1 H 4.238 -7.672 2.240 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 1 . 44 . 1 1 3 ALA HB2 H 2.888 -8.729 2.778 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 1 . 45 . 1 1 3 ALA HB3 H 3.038 -8.245 1.075 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 1 . 46 . 1 1 3 ALA N N 0.997 -7.211 2.124 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 1 . 47 . 1 1 3 ALA O O 3.010 -4.304 2.007 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 1 . 48 . 1 1 4 LEU C C 2.086 -3.765 -1.150 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 1 . 49 . 1 1 4 LEU CA C 3.316 -4.637 -0.798 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 1 . 50 . 1 1 4 LEU CB C 4.164 -5.182 -1.972 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 1 . 51 . 1 1 4 LEU CD1 C 4.563 -4.839 -4.454 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 1 . 52 . 1 1 4 LEU CD2 C 2.776 -6.517 -3.594 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 1 . 53 . 1 1 4 LEU CG C 3.525 -5.195 -3.389 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 1 . 54 . 1 1 4 LEU H H 2.649 -6.585 -0.074 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 1 . 55 . 1 1 4 LEU HA H 4.007 -3.934 -0.295 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 1 . 56 . 1 1 4 LEU HB2 H 5.064 -4.556 -1.975 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 1 . 57 . 1 1 4 LEU HB3 H 4.600 -6.175 -1.740 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 1 . 58 . 1 1 4 LEU HD11 H 4.970 -3.826 -4.252 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 1 . 59 . 1 1 4 LEU HD12 H 5.413 -5.541 -4.457 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 1 . 60 . 1 1 4 LEU HD13 H 4.110 -4.800 -5.459 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 1 . 61 . 1 1 4 LEU HD21 H 2.029 -6.662 -2.789 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 1 . 62 . 1 1 4 LEU HD22 H 2.228 -6.533 -4.549 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 1 . 63 . 1 1 4 LEU HD23 H 3.459 -7.384 -3.555 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 1 . 64 . 1 1 4 LEU HG H 2.776 -4.393 -3.495 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 1 . 65 . 1 1 4 LEU N N 3.036 -5.681 0.209 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 1 . 66 . 1 1 4 LEU O O 2.260 -2.612 -1.530 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 1 . 67 . 1 1 5 ILE C C -0.296 -2.412 0.124 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 1 . 68 . 1 1 5 ILE CA C -0.390 -3.539 -0.975 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 1 . 69 . 1 1 5 ILE CB C -1.604 -4.514 -0.808 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 1 . 70 . 1 1 5 ILE CD1 C -1.058 -6.851 -1.886 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 1 . 71 . 1 1 5 ILE CG1 C -1.782 -5.499 -2.021 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 1 . 72 . 1 1 5 ILE CG2 C -2.926 -3.714 -0.596 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 1 . 73 . 1 1 5 ILE H H 0.875 -5.303 -0.763 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 1 . 74 . 1 1 5 ILE HA H -0.543 -3.056 -1.953 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 1 . 75 . 1 1 5 ILE HB H -1.389 -5.113 0.104 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 1 . 76 . 1 1 5 ILE HD11 H -1.099 -7.436 -2.821 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 1 . 77 . 1 1 5 ILE HD12 H 0.011 -6.744 -1.630 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 1 . 78 . 1 1 5 ILE HD13 H -1.508 -7.476 -1.099 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 1 . 79 . 1 1 5 ILE HG12 H -2.851 -5.703 -2.215 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 1 . 80 . 1 1 5 ILE HG13 H -1.425 -5.022 -2.949 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 1 . 81 . 1 1 5 ILE HG21 H -2.911 -3.145 0.353 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 1 . 82 . 1 1 5 ILE HG22 H -3.096 -2.969 -1.398 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 1 . 83 . 1 1 5 ILE HG23 H -3.822 -4.352 -0.552 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 1 . 84 . 1 1 5 ILE N N 0.863 -4.323 -1.073 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 1 . 85 . 1 1 5 ILE O O -0.655 -1.283 -0.171 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 1 . 86 . 1 1 6 LYS C C 1.813 -0.728 1.975 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 1 . 87 . 1 1 6 LYS CA C 0.569 -1.613 2.316 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 1 . 88 . 1 1 6 LYS CB C 0.482 -2.213 3.739 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 1 . 89 . 1 1 6 LYS CD C -2.180 -2.500 3.409 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 1 . 90 . 1 1 6 LYS CE C -3.460 -2.781 4.223 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 1 . 91 . 1 1 6 LYS CG C -0.950 -2.304 4.351 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 1 . 92 . 1 1 6 LYS H H 0.507 -3.652 1.470 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 1 . 93 . 1 1 6 LYS HA H -0.250 -0.867 2.274 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 1 . 94 . 1 1 6 LYS HB2 H 0.963 -3.211 3.764 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 1 . 95 . 1 1 6 LYS HB3 H 1.098 -1.610 4.433 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 1 . 96 . 1 1 6 LYS HD2 H -2.317 -1.599 2.766 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 1 . 97 . 1 1 6 LYS HD3 H -2.001 -3.311 2.674 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 1 . 98 . 1 1 6 LYS HE2 H -3.315 -3.662 4.875 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 1 . 99 . 1 1 6 LYS HE3 H -3.677 -1.931 4.897 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 1 . 100 . 1 1 6 LYS HG2 H -0.930 -3.113 5.107 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 1 . 101 . 1 1 6 LYS HG3 H -1.124 -1.382 4.937 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 1 . 102 . 1 1 6 LYS HZ1 H -4.491 -3.828 2.748 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 1 . 103 . 1 1 6 LYS HZ2 H -5.477 -3.193 3.913 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 1 . 104 . 1 1 6 LYS HZ3 H -4.822 -2.210 2.759 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 1 . 105 . 1 1 6 LYS N N 0.228 -2.675 1.328 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 1 . 106 . 1 1 6 LYS NZ N -4.629 -3.018 3.362 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 1 . 107 . 1 1 6 LYS O O 1.791 0.443 2.348 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 1 . 108 . 1 1 7 ARG C C 3.249 0.710 -0.456 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 1 . 109 . 1 1 7 ARG CA C 3.863 -0.313 0.583 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 1 . 110 . 1 1 7 ARG CB C 4.982 -1.162 -0.104 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 1 . 111 . 1 1 7 ARG CD C 6.779 -1.172 1.779 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 1 . 112 . 1 1 7 ARG CG C 5.909 -1.992 0.810 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 1 . 113 . 1 1 7 ARG CZ C 7.828 0.968 0.940 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 1 . 114 . 1 1 7 ARG H H 2.910 -2.243 1.232 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 1 . 115 . 1 1 7 ARG HA H 4.341 0.303 1.366 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 1 . 116 . 1 1 7 ARG HB2 H 4.531 -1.838 -0.850 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 1 . 117 . 1 1 7 ARG HB3 H 5.628 -0.515 -0.720 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 1 . 118 . 1 1 7 ARG HD2 H 6.130 -0.555 2.426 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 1 . 119 . 1 1 7 ARG HD3 H 7.267 -1.887 2.460 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 1 . 120 . 1 1 7 ARG HE H 8.682 -0.829 0.725 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 1 . 121 . 1 1 7 ARG HG2 H 5.298 -2.704 1.395 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 1 . 122 . 1 1 7 ARG HG3 H 6.558 -2.633 0.182 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 1 . 123 . 1 1 7 ARG HH11 H 6.063 1.308 1.842 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 1 . 124 . 1 1 7 ARG HH12 H 6.950 2.765 1.166 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 1 . 125 . 1 1 7 ARG HH21 H 9.593 0.897 0.000 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 1 . 126 . 1 1 7 ARG HH22 H 8.811 2.545 0.196 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 1 . 127 . 1 1 7 ARG N N 2.865 -1.214 1.275 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 1 . 128 . 1 1 7 ARG NE N 7.848 -0.373 1.111 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 1 . 129 . 1 1 7 ARG NH1 N 6.846 1.762 1.359 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 1 . 130 . 1 1 7 ARG NH2 N 8.847 1.526 0.315 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 1 . 131 . 1 1 7 ARG O O 3.397 1.932 -0.307 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 1 . 132 . 1 1 8 ILE C C 0.667 1.961 -1.678 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 1 . 133 . 1 1 8 ILE CA C 1.701 1.050 -2.408 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 1 . 134 . 1 1 8 ILE CB C 1.110 0.282 -3.654 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 1 . 135 . 1 1 8 ILE CD1 C -1.420 -0.372 -3.206 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 1 . 136 . 1 1 8 ILE CG1 C 0.063 -0.812 -3.320 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 1 . 137 . 1 1 8 ILE CG2 C 2.235 -0.299 -4.549 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 1 . 138 . 1 1 8 ILE H H 2.484 -0.819 -1.517 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 1 . 139 . 1 1 8 ILE HA H 2.428 1.744 -2.864 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 1 . 140 . 1 1 8 ILE HB H 0.603 1.022 -4.298 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 1 . 141 . 1 1 8 ILE HD11 H -1.887 -0.163 -4.181 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 1 . 142 . 1 1 8 ILE HD12 H -2.035 -1.140 -2.698 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 1 . 143 . 1 1 8 ILE HD13 H -1.564 0.544 -2.606 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 1 . 144 . 1 1 8 ILE HG12 H 0.159 -1.675 -4.009 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 1 . 145 . 1 1 8 ILE HG13 H 0.368 -1.233 -2.358 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 1 . 146 . 1 1 8 ILE HG21 H 1.832 -0.732 -5.483 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 1 . 147 . 1 1 8 ILE HG22 H 2.961 0.479 -4.849 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 1 . 148 . 1 1 8 ILE HG23 H 2.804 -1.098 -4.037 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 1 . 149 . 1 1 8 ILE N N 2.502 0.206 -1.466 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 1 . 150 . 1 1 8 ILE O O 0.654 3.142 -1.994 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 1 . 151 . 1 1 9 GLN C C -0.438 3.371 1.038 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 1 . 152 . 1 1 9 GLN CA C -1.094 2.342 0.067 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 1 . 153 . 1 1 9 GLN CB C -2.197 1.545 0.817 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 1 . 154 . 1 1 9 GLN CD C -4.322 0.069 0.589 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 1 . 155 . 1 1 9 GLN CG C -3.124 0.727 -0.100 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 1 . 156 . 1 1 9 GLN H H -0.024 0.481 -0.499 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 1 . 157 . 1 1 9 GLN HA H -1.602 2.936 -0.714 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 1 . 158 . 1 1 9 GLN HB2 H -1.737 0.878 1.571 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 1 . 159 . 1 1 9 GLN HB3 H -2.824 2.249 1.398 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 1 . 160 . 1 1 9 GLN HE21 H -5.479 1.620 0.103 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 1 . 161 . 1 1 9 GLN HE22 H -6.261 0.264 1.062 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 1 . 162 . 1 1 9 GLN HG2 H -3.457 1.311 -0.970 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 1 . 163 . 1 1 9 GLN HG3 H -2.505 -0.052 -0.549 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 1 . 164 . 1 1 9 GLN N N -0.130 1.483 -0.693 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 1 . 165 . 1 1 9 GLN NE2 N -5.468 0.729 0.607 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 1 . 166 . 1 1 9 GLN O O -0.914 4.499 1.155 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 1 . 167 . 1 1 9 GLN OE1 O -4.237 -1.048 1.092 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 1 . 168 . 1 1 10 ALA C C 1.977 5.252 1.294 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 1 . 169 . 1 1 10 ALA CA C 1.639 4.043 2.241 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 1 . 170 . 1 1 10 ALA CB C 2.925 3.339 2.729 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 1 . 171 . 1 1 10 ALA H H 0.923 2.038 1.476 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 1 . 172 . 1 1 10 ALA HA H 1.138 4.468 3.132 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 1 . 173 . 1 1 10 ALA HB1 H 3.630 4.042 3.205 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 1 . 174 . 1 1 10 ALA HB2 H 2.712 2.548 3.471 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 1 . 175 . 1 1 10 ALA HB3 H 3.483 2.853 1.908 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 1 . 176 . 1 1 10 ALA N N 0.702 3.029 1.653 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 1 . 177 . 1 1 10 ALA O O 1.912 6.399 1.746 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 1 . 178 . 1 1 11 MET C C 0.778 6.642 -1.499 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 1 . 179 . 1 1 11 MET CA C 2.202 6.076 -1.060 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 1 . 180 . 1 1 11 MET CB C 2.975 5.598 -2.329 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 1 . 181 . 1 1 11 MET CE C 6.983 5.513 -1.161 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 1 . 182 . 1 1 11 MET CG C 4.420 5.100 -2.134 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 1 . 183 . 1 1 11 MET H H 2.407 4.006 -0.244 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 1 . 184 . 1 1 11 MET HA H 2.771 6.941 -0.666 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 1 . 185 . 1 1 11 MET HB2 H 2.406 4.794 -2.833 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 1 . 186 . 1 1 11 MET HB3 H 3.003 6.422 -3.067 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 1 . 187 . 1 1 11 MET HE1 H 7.378 5.052 -2.085 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 1 . 188 . 1 1 11 MET HE2 H 6.808 4.712 -0.421 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 1 . 189 . 1 1 11 MET HE3 H 7.760 6.188 -0.757 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 1 . 190 . 1 1 11 MET HG2 H 4.448 4.237 -1.440 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 1 . 191 . 1 1 11 MET HG3 H 4.824 4.740 -3.098 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 1 . 192 . 1 1 11 MET N N 2.237 5.004 -0.011 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 1 . 193 . 1 1 11 MET O O 0.631 7.856 -1.657 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 1 . 194 . 1 1 11 MET SD S 5.464 6.427 -1.495 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 1 . 195 . 1 1 12 ILE C C -2.647 6.793 -1.524 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 1 . 196 . 1 1 12 ILE CA C -1.535 6.095 -2.409 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 1 . 197 . 1 1 12 ILE CB C -1.810 4.882 -3.411 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 1 . 198 . 1 1 12 ILE CD1 C -0.277 3.568 -5.080 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 1 . 199 . 1 1 12 ILE CG1 C -0.846 4.926 -4.660 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 1 . 200 . 1 1 12 ILE CG2 C -3.236 4.611 -3.956 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 1 . 201 . 1 1 12 ILE H H 0.058 4.784 -1.615 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 1 . 202 . 1 1 12 ILE HA H -1.371 6.901 -3.103 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 1 . 203 . 1 1 12 ILE HB H -1.585 3.971 -2.826 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 1 . 204 . 1 1 12 ILE HD11 H 0.524 3.256 -4.389 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 1 . 205 . 1 1 12 ILE HD12 H -1.043 2.772 -5.085 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 1 . 206 . 1 1 12 ILE HD13 H 0.182 3.616 -6.081 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 1 . 207 . 1 1 12 ILE HG12 H -1.344 5.400 -5.527 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 1 . 208 . 1 1 12 ILE HG13 H 0.022 5.585 -4.473 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 1 . 209 . 1 1 12 ILE HG21 H -3.267 3.614 -4.445 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 1 . 210 . 1 1 12 ILE HG22 H -4.019 4.568 -3.186 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 1 . 211 . 1 1 12 ILE HG23 H -3.553 5.353 -4.704 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 1 . 212 . 1 1 12 ILE N N -0.210 5.761 -1.774 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 1 . 213 . 1 1 12 ILE O O -2.881 7.985 -1.760 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 1 . 214 . 1 1 13 PRO C C -3.946 6.842 2.013 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 1 . 215 . 1 1 13 PRO CA C -4.209 6.893 0.459 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 1 . 216 . 1 1 13 PRO CB C -5.509 6.175 0.045 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 1 . 217 . 1 1 13 PRO CD C -3.584 4.785 -0.471 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 1 . 218 . 1 1 13 PRO CG C -5.108 4.750 -0.358 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 1 . 219 . 1 1 13 PRO HA H -4.298 7.961 0.214 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 1 . 220 . 1 1 13 PRO HB2 H -6.301 6.192 0.818 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 1 . 221 . 1 1 13 PRO HB3 H -5.924 6.700 -0.837 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 1 . 222 . 1 1 13 PRO HD2 H -3.110 4.316 0.385 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 1 . 223 . 1 1 13 PRO HD3 H -3.200 4.247 -1.341 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 1 . 224 . 1 1 13 PRO HG2 H -5.436 3.998 0.383 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 1 . 225 . 1 1 13 PRO HG3 H -5.557 4.484 -1.332 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 1 . 226 . 1 1 13 PRO N N -3.227 6.200 -0.442 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 1 . 227 . 1 1 13 PRO O O -4.840 7.178 2.796 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 1 . 228 . 1 1 14 LYS C C -3.152 5.233 4.648 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 1 . 229 . 1 1 14 LYS CA C -2.318 6.307 3.867 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 1 . 230 . 1 1 14 LYS CB C -2.111 7.679 4.594 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 1 . 231 . 1 1 14 LYS CD C -0.955 9.680 3.255 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 1 . 232 . 1 1 14 LYS CE C -1.381 9.443 1.790 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 1 . 233 . 1 1 14 LYS CG C -0.824 8.469 4.216 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 1 . 234 . 1 1 14 LYS H H -2.088 6.188 1.685 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 1 . 235 . 1 1 14 LYS HA H -1.304 5.862 3.820 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 1 . 236 . 1 1 14 LYS HB2 H -3.010 8.318 4.505 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 1 . 237 . 1 1 14 LYS HB3 H -2.038 7.474 5.679 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 1 . 238 . 1 1 14 LYS HD2 H -1.653 10.411 3.704 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 1 . 239 . 1 1 14 LYS HD3 H 0.019 10.204 3.244 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 1 . 240 . 1 1 14 LYS HE2 H -2.441 9.139 1.747 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 1 . 241 . 1 1 14 LYS HE3 H -1.344 10.399 1.237 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 1 . 242 . 1 1 14 LYS HG2 H -0.398 8.866 5.156 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 1 . 243 . 1 1 14 LYS HG3 H -0.039 7.781 3.848 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 1 . 244 . 1 1 14 LYS HZ1 H 0.437 8.712 1.035 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 1 . 245 . 1 1 14 LYS HZ2 H -0.601 7.524 1.516 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 1 . 246 . 1 1 14 LYS HZ3 H -0.867 8.317 0.104 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 1 . 247 . 1 1 14 LYS N N -2.724 6.461 2.443 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 1 . 248 . 1 1 14 LYS NZ N -0.553 8.450 1.073 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 1 . 249 . 1 1 14 LYS O O -3.783 5.527 5.669 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 1 . 250 . 1 1 15 GLY C C -3.208 1.495 4.280 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 1 . 251 . 1 1 15 GLY CA C -3.713 2.826 4.847 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 1 . 252 . 1 1 15 GLY H H -2.731 3.932 3.196 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 1 . 253 . 1 1 15 GLY HA2 H -3.486 2.857 5.930 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 1 . 254 . 1 1 15 GLY HA3 H -4.815 2.883 4.763 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 1 . 255 . 1 1 15 GLY N N -3.103 3.980 4.153 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 1 . 256 . 1 1 15 GLY O O -1.991 1.211 4.364 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 1 . 257 . 1 1 15 GLY OXT O -4.033 0.713 3.759 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 2 . 258 . 1 1 1 CYS C C -3.856 -7.281 1.611 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 2 . 259 . 1 1 1 CYS CA C -4.896 -6.964 0.505 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 2 . 260 . 1 1 1 CYS CB C -5.915 -5.877 0.907 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 2 . 261 . 1 1 1 CYS H1 H -4.966 -8.923 -0.215 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 2 . 262 . 1 1 1 CYS H2 H -6.137 -8.593 0.902 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 2 . 263 . 1 1 1 CYS H3 H -6.284 -8.022 -0.641 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 2 . 264 . 1 1 1 CYS HA H -4.378 -6.599 -0.403 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 2 . 265 . 1 1 1 CYS HB2 H -5.400 -4.934 1.162 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 2 . 266 . 1 1 1 CYS HB3 H -6.575 -5.631 0.053 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 2 . 267 . 1 1 1 CYS HG H -6.123 -6.001 3.278 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 2 . 268 . 1 1 1 CYS N N -5.612 -8.197 0.115 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 2 . 269 . 1 1 1 CYS O O -4.219 -7.730 2.705 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 2 . 270 . 1 1 1 CYS SG S -6.960 -6.385 2.318 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 2 . 271 . 1 1 2 ARG C C -0.191 -6.610 2.255 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 2 . 272 . 1 1 2 ARG CA C -1.438 -7.543 2.175 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 2 . 273 . 1 1 2 ARG CB C -1.234 -9.111 2.147 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 2 . 274 . 1 1 2 ARG CD C 0.195 -9.632 0.016 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 2 . 275 . 1 1 2 ARG CG C -1.117 -9.854 0.789 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 2 . 276 . 1 1 2 ARG CZ C 1.301 -10.494 -2.060 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 2 . 277 . 1 1 2 ARG H H -2.385 -6.705 0.365 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 2 . 278 . 1 1 2 ARG HA H -1.764 -7.347 3.197 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 2 . 279 . 1 1 2 ARG HB2 H -0.365 -9.374 2.782 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 2 . 280 . 1 1 2 ARG HB3 H -2.081 -9.565 2.687 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 2 . 281 . 1 1 2 ARG HD2 H 0.319 -8.561 -0.219 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 2 . 282 . 1 1 2 ARG HD3 H 1.055 -9.908 0.653 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 2 . 283 . 1 1 2 ARG HE H -0.604 -10.906 -1.591 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 2 . 284 . 1 1 2 ARG HG2 H -1.222 -10.937 0.992 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 2 . 285 . 1 1 2 ARG HG3 H -1.984 -9.597 0.152 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 2 . 286 . 1 1 2 ARG HH11 H 2.546 -9.393 -0.926 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 2 . 287 . 1 1 2 ARG HH12 H 3.219 -10.067 -2.494 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 2 . 288 . 1 1 2 ARG HH21 H 0.269 -11.621 -3.353 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 2 . 289 . 1 1 2 ARG HH22 H 2.014 -11.244 -3.773 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 2 . 290 . 1 1 2 ARG N N -2.554 -7.083 1.304 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 2 . 291 . 1 1 2 ARG NE N 0.225 -10.406 -1.250 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 2 . 292 . 1 1 2 ARG NH1 N 2.476 -9.925 -1.800 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 2 . 293 . 1 1 2 ARG NH2 N 1.182 -11.189 -3.175 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 2 . 294 . 1 1 2 ARG O O -0.298 -5.425 2.575 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 2 . 295 . 1 1 3 ALA C C 2.836 -5.447 1.354 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 2 . 296 . 1 1 3 ALA CA C 2.309 -6.601 2.255 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 2 . 297 . 1 1 3 ALA CB C 3.151 -7.882 2.045 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 2 . 298 . 1 1 3 ALA H H 0.896 -8.190 1.785 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 2 . 299 . 1 1 3 ALA HA H 2.375 -6.301 3.317 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 2 . 300 . 1 1 3 ALA HB1 H 2.864 -8.700 2.732 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 2 . 301 . 1 1 3 ALA HB2 H 3.019 -8.281 1.010 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 2 . 302 . 1 1 3 ALA HB3 H 4.222 -7.673 2.162 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 2 . 303 . 1 1 3 ALA N N 0.981 -7.197 2.029 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 2 . 304 . 1 1 3 ALA O O 3.034 -4.320 1.828 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 2 . 305 . 1 1 4 LEU C C 2.031 -3.781 -1.261 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 2 . 306 . 1 1 4 LEU CA C 3.259 -4.682 -0.975 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 2 . 307 . 1 1 4 LEU CB C 3.980 -5.268 -2.216 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 2 . 308 . 1 1 4 LEU CD1 C 4.106 -5.221 -4.752 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 2 . 309 . 1 1 4 LEU CD2 C 2.381 -6.705 -3.553 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 2 . 310 . 1 1 4 LEU CG C 3.184 -5.400 -3.546 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 2 . 311 . 1 1 4 LEU H H 2.559 -6.608 -0.224 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 2 . 312 . 1 1 4 LEU HA H 4.018 -4.004 -0.535 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 2 . 313 . 1 1 4 LEU HB2 H 4.829 -4.595 -2.374 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 2 . 314 . 1 1 4 LEU HB3 H 4.493 -6.222 -1.980 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 2 . 315 . 1 1 4 LEU HD11 H 4.914 -5.973 -4.768 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 2 . 316 . 1 1 4 LEU HD12 H 3.540 -5.272 -5.698 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 2 . 317 . 1 1 4 LEU HD13 H 4.580 -4.219 -4.718 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 2 . 318 . 1 1 4 LEU HD21 H 1.744 -6.772 -2.652 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 2 . 319 . 1 1 4 LEU HD22 H 1.710 -6.765 -4.427 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 2 . 320 . 1 1 4 LEU HD23 H 3.040 -7.591 -3.548 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 2 . 321 . 1 1 4 LEU HG H 2.458 -4.575 -3.646 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 2 . 322 . 1 1 4 LEU N N 2.990 -5.721 0.046 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 2 . 323 . 1 1 4 LEU O O 2.221 -2.623 -1.612 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 2 . 324 . 1 1 5 ILE C C -0.336 -2.418 0.070 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 2 . 325 . 1 1 5 ILE CA C -0.450 -3.537 -1.027 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 2 . 326 . 1 1 5 ILE CB C -1.665 -4.507 -0.839 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 2 . 327 . 1 1 5 ILE CD1 C -1.163 -6.874 -1.859 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 2 . 328 . 1 1 5 ILE CG1 C -1.850 -5.509 -2.038 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 2 . 329 . 1 1 5 ILE CG2 C -2.984 -3.701 -0.632 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 2 . 330 . 1 1 5 ILE H H 0.805 -5.297 -0.814 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 2 . 331 . 1 1 5 ILE HA H -0.619 -3.053 -2.001 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 2 . 332 . 1 1 5 ILE HB H -1.443 -5.093 0.080 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 2 . 333 . 1 1 5 ILE HD11 H -0.140 -6.780 -1.455 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 2 . 334 . 1 1 5 ILE HD12 H -1.714 -7.527 -1.164 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 2 . 335 . 1 1 5 ILE HD13 H -1.077 -7.424 -2.813 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 2 . 336 . 1 1 5 ILE HG12 H -2.918 -5.682 -2.262 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 2 . 337 . 1 1 5 ILE HG13 H -1.452 -5.060 -2.964 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 2 . 338 . 1 1 5 ILE HG21 H -2.962 -3.113 0.304 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 2 . 339 . 1 1 5 ILE HG22 H -3.160 -2.971 -1.447 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 2 . 340 . 1 1 5 ILE HG23 H -3.880 -4.337 -0.569 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 2 . 341 . 1 1 5 ILE N N 0.799 -4.324 -1.147 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 2 . 342 . 1 1 5 ILE O O -0.663 -1.279 -0.224 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 2 . 343 . 1 1 6 LYS C C 1.699 -0.749 1.987 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 2 . 344 . 1 1 6 LYS CA C 0.468 -1.656 2.295 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 2 . 345 . 1 1 6 LYS CB C 0.368 -2.278 3.708 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 2 . 346 . 1 1 6 LYS CD C -2.284 -2.584 3.329 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 2 . 347 . 1 1 6 LYS CE C -3.579 -2.878 4.112 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 2 . 348 . 1 1 6 LYS CG C -1.072 -2.402 4.295 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 2 . 349 . 1 1 6 LYS H H 0.415 -3.686 1.422 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 2 . 350 . 1 1 6 LYS HA H -0.361 -0.921 2.253 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 2 . 351 . 1 1 6 LYS HB2 H 0.868 -3.266 3.726 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 2 . 352 . 1 1 6 LYS HB3 H 0.962 -1.673 4.420 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 2 . 353 . 1 1 6 LYS HD2 H -2.410 -1.672 2.699 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 2 . 354 . 1 1 6 LYS HD3 H -2.090 -3.381 2.582 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 2 . 355 . 1 1 6 LYS HE2 H -3.453 -3.783 4.736 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 2 . 356 . 1 1 6 LYS HE3 H -3.798 -2.049 4.811 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 2 . 357 . 1 1 6 LYS HG2 H -1.056 -3.230 5.030 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 2 . 358 . 1 1 6 LYS HG3 H -1.265 -1.497 4.902 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 2 . 359 . 1 1 6 LYS HZ1 H -5.595 -3.255 3.755 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 2 . 360 . 1 1 6 LYS HZ2 H -4.908 -2.240 2.647 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 2 . 361 . 1 1 6 LYS HZ3 H -4.596 -3.861 2.585 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 2 . 362 . 1 1 6 LYS N N 0.160 -2.702 1.280 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 2 . 363 . 1 1 6 LYS NZ N -4.736 -3.072 3.225 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 2 . 364 . 1 1 6 LYS O O 1.660 0.410 2.393 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 2 . 365 . 1 1 7 ARG C C 3.199 0.688 -0.458 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 2 . 366 . 1 1 7 ARG CA C 3.769 -0.292 0.654 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 2 . 367 . 1 1 7 ARG CB C 4.934 -1.157 0.104 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 2 . 368 . 1 1 7 ARG CD C 7.056 -0.601 1.340 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 2 . 369 . 1 1 7 ARG CG C 6.294 -0.449 0.019 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 2 . 370 . 1 1 7 ARG CZ C 8.366 1.499 1.791 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 2 . 371 . 1 1 7 ARG H H 2.814 -2.234 1.188 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 2 . 372 . 1 1 7 ARG HA H 4.174 0.337 1.471 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 2 . 373 . 1 1 7 ARG HB2 H 5.049 -2.111 0.658 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 2 . 374 . 1 1 7 ARG HB3 H 4.679 -1.471 -0.908 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 2 . 375 . 1 1 7 ARG HD2 H 6.385 -0.372 2.189 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 2 . 376 . 1 1 7 ARG HD3 H 7.313 -1.672 1.451 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 2 . 377 . 1 1 7 ARG HE H 9.186 -0.173 1.040 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 2 . 378 . 1 1 7 ARG HG2 H 6.889 -0.899 -0.798 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 2 . 379 . 1 1 7 ARG HG3 H 6.157 0.614 -0.257 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 2 . 380 . 1 1 7 ARG HH11 H 6.419 1.707 2.253 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 2 . 381 . 1 1 7 ARG HH12 H 7.501 3.164 2.521 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 2 . 382 . 1 1 7 ARG HH21 H 10.329 1.546 1.406 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 2 . 383 . 1 1 7 ARG HH22 H 9.566 3.076 2.071 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 2 . 384 . 1 1 7 ARG N N 2.759 -1.209 1.284 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 2 . 385 . 1 1 7 ARG NE N 8.297 0.214 1.374 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 2 . 386 . 1 1 7 ARG NH1 N 7.320 2.195 2.234 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 2 . 387 . 1 1 7 ARG NH2 N 9.539 2.101 1.752 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 2 . 388 . 1 1 7 ARG O O 3.340 1.913 -0.344 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 2 . 389 . 1 1 8 ILE C C 0.686 1.936 -1.764 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 2 . 390 . 1 1 8 ILE CA C 1.717 0.999 -2.473 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 2 . 391 . 1 1 8 ILE CB C 1.113 0.228 -3.712 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 2 . 392 . 1 1 8 ILE CD1 C -1.440 -0.367 -3.260 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 2 . 393 . 1 1 8 ILE CG1 C 0.035 -0.834 -3.371 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 2 . 394 . 1 1 8 ILE CG2 C 2.229 -0.395 -4.590 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 2 . 395 . 1 1 8 ILE H H 2.596 -0.857 -1.627 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 2 . 396 . 1 1 8 ILE HA H 2.451 1.679 -2.938 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 2 . 397 . 1 1 8 ILE HB H 0.630 0.971 -4.370 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 2 . 398 . 1 1 8 ILE HD11 H -1.570 0.559 -2.674 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 2 . 399 . 1 1 8 ILE HD12 H -1.907 -0.167 -4.237 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 2 . 400 . 1 1 8 ILE HD13 H -2.066 -1.119 -2.741 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 2 . 401 . 1 1 8 ILE HG12 H 0.103 -1.703 -4.054 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 2 . 402 . 1 1 8 ILE HG13 H 0.332 -1.253 -2.407 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 2 . 403 . 1 1 8 ILE HG21 H 1.822 -0.831 -5.521 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 2 . 404 . 1 1 8 ILE HG22 H 2.977 0.360 -4.896 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 2 . 405 . 1 1 8 ILE HG23 H 2.773 -1.201 -4.062 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 2 . 406 . 1 1 8 ILE N N 2.519 0.165 -1.513 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 2 . 407 . 1 1 8 ILE O O 0.686 3.113 -2.091 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 2 . 408 . 1 1 9 GLN C C -0.379 3.365 0.956 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 2 . 409 . 1 1 9 GLN CA C -1.059 2.345 -0.007 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 2 . 410 . 1 1 9 GLN CB C -2.165 1.561 0.752 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 2 . 411 . 1 1 9 GLN CD C -4.318 0.121 0.545 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 2 . 412 . 1 1 9 GLN CG C -3.112 0.753 -0.156 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 2 . 413 . 1 1 9 GLN H H -0.014 0.471 -0.573 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 2 . 414 . 1 1 9 GLN HA H -1.566 2.946 -0.784 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 2 . 415 . 1 1 9 GLN HB2 H -1.705 0.888 1.500 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 2 . 416 . 1 1 9 GLN HB3 H -2.777 2.271 1.340 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 2 . 417 . 1 1 9 GLN HE21 H -5.451 1.685 0.047 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 2 . 418 . 1 1 9 GLN HE22 H -6.251 0.354 1.024 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 2 . 419 . 1 1 9 GLN HG2 H -3.441 1.337 -1.028 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 2 . 420 . 1 1 9 GLN HG3 H -2.508 -0.039 -0.602 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 2 . 421 . 1 1 9 GLN N N -0.114 1.472 -0.776 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 2 . 422 . 1 1 9 GLN NE2 N -5.451 0.802 0.565 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 2 . 423 . 1 1 9 GLN O O -0.842 4.498 1.082 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 2 . 424 . 1 1 9 GLN OE1 O -4.251 -0.993 1.054 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 2 . 425 . 1 1 10 ALA C C 2.053 5.226 1.194 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 2 . 426 . 1 1 10 ALA CA C 1.722 4.010 2.137 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 2 . 427 . 1 1 10 ALA CB C 3.015 3.289 2.588 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 2 . 428 . 1 1 10 ALA H H 0.969 2.015 1.380 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 2 . 429 . 1 1 10 ALA HA H 1.241 4.428 3.042 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 2 . 430 . 1 1 10 ALA HB1 H 2.814 2.442 3.269 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 2 . 431 . 1 1 10 ALA HB2 H 3.593 2.871 1.748 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 2 . 432 . 1 1 10 ALA HB3 H 3.709 3.966 3.113 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 2 . 433 . 1 1 10 ALA N N 0.767 3.010 1.555 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 2 . 434 . 1 1 10 ALA O O 2.008 6.370 1.656 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 2 . 435 . 1 1 11 MET C C 0.821 6.627 -1.584 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 2 . 436 . 1 1 11 MET CA C 2.246 6.055 -1.162 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 2 . 437 . 1 1 11 MET CB C 3.000 5.578 -2.444 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 2 . 438 . 1 1 11 MET CE C 6.162 5.372 -0.100 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 2 . 439 . 1 1 11 MET CG C 4.424 5.015 -2.269 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 2 . 440 . 1 1 11 MET H H 2.423 3.983 -0.354 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 2 . 441 . 1 1 11 MET HA H 2.824 6.916 -0.773 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 2 . 442 . 1 1 11 MET HB2 H 2.400 4.810 -2.968 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 2 . 443 . 1 1 11 MET HB3 H 3.058 6.420 -3.159 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 2 . 444 . 1 1 11 MET HE1 H 5.345 5.075 0.583 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 2 . 445 . 1 1 11 MET HE2 H 6.865 6.009 0.464 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 2 . 446 . 1 1 11 MET HE3 H 6.701 4.458 -0.412 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 2 . 447 . 1 1 11 MET HG2 H 4.405 4.097 -1.649 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 2 . 448 . 1 1 11 MET HG3 H 4.826 4.710 -3.252 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 2 . 449 . 1 1 11 MET N N 2.288 4.983 -0.115 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 2 . 450 . 1 1 11 MET O O 0.676 7.842 -1.740 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 2 . 451 . 1 1 11 MET SD S 5.511 6.259 -1.533 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 2 . 452 . 1 1 12 ILE C C -2.600 6.794 -1.571 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 2 . 453 . 1 1 12 ILE CA C -1.503 6.088 -2.469 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 2 . 454 . 1 1 12 ILE CB C -1.795 4.874 -3.464 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 2 . 455 . 1 1 12 ILE CD1 C -0.305 3.537 -5.158 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 2 . 456 . 1 1 12 ILE CG1 C -0.842 4.903 -4.722 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 2 . 457 . 1 1 12 ILE CG2 C -3.229 4.618 -3.997 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 2 . 458 . 1 1 12 ILE H H 0.095 4.770 -1.694 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 2 . 459 . 1 1 12 ILE HA H -1.343 6.891 -3.167 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 2 . 460 . 1 1 12 ILE HB H -1.572 3.963 -2.878 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 2 . 461 . 1 1 12 ILE HD11 H 0.496 3.202 -4.479 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 2 . 462 . 1 1 12 ILE HD12 H -1.087 2.756 -5.164 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 2 . 463 . 1 1 12 ILE HD13 H 0.146 3.585 -6.163 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 2 . 464 . 1 1 12 ILE HG12 H -1.338 5.395 -5.581 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 2 . 465 . 1 1 12 ILE HG13 H 0.042 5.542 -4.539 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 2 . 466 . 1 1 12 ILE HG21 H -4.006 4.596 -3.220 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 2 . 467 . 1 1 12 ILE HG22 H -3.541 5.360 -4.748 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 2 . 468 . 1 1 12 ILE HG23 H -3.279 3.619 -4.477 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 2 . 469 . 1 1 12 ILE N N -0.172 5.748 -1.849 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 2 . 470 . 1 1 12 ILE O O -2.829 7.986 -1.805 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 2 . 471 . 1 1 13 PRO C C -3.850 6.846 1.985 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 2 . 472 . 1 1 13 PRO CA C -4.133 6.905 0.434 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 2 . 473 . 1 1 13 PRO CB C -5.446 6.201 0.035 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 2 . 474 . 1 1 13 PRO CD C -3.540 4.793 -0.507 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 2 . 475 . 1 1 13 PRO CG C -5.063 4.772 -0.373 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 2 . 476 . 1 1 13 PRO HA H -4.213 7.974 0.193 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 2 . 477 . 1 1 13 PRO HB2 H -6.228 6.225 0.817 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 2 . 478 . 1 1 13 PRO HB3 H -5.866 6.729 -0.842 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 2 . 479 . 1 1 13 PRO HD2 H -3.056 4.321 0.342 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 2 . 480 . 1 1 13 PRO HD3 H -3.174 4.253 -1.383 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 2 . 481 . 1 1 13 PRO HG2 H -5.387 4.024 0.374 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 2 . 482 . 1 1 13 PRO HG3 H -5.527 4.509 -1.341 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 2 . 483 . 1 1 13 PRO N N -3.170 6.204 -0.482 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 2 . 484 . 1 1 13 PRO O O -4.734 7.176 2.781 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 2 . 485 . 1 1 14 LYS C C -3.013 5.221 4.598 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 2 . 486 . 1 1 14 LYS CA C -2.194 6.304 3.812 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 2 . 487 . 1 1 14 LYS CB C -1.981 7.671 4.544 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 2 . 488 . 1 1 14 LYS CD C -0.834 9.672 3.194 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 2 . 489 . 1 1 14 LYS CE C -1.268 9.432 1.731 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 2 . 490 . 1 1 14 LYS CG C -0.698 8.464 4.158 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 2 . 491 . 1 1 14 LYS H H -1.996 6.199 1.626 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 2 . 492 . 1 1 14 LYS HA H -1.180 5.862 3.747 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 2 . 493 . 1 1 14 LYS HB2 H -2.881 8.311 4.467 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 2 . 494 . 1 1 14 LYS HB3 H -1.897 7.461 5.627 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 2 . 495 . 1 1 14 LYS HD2 H -1.529 10.404 3.645 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 2 . 496 . 1 1 14 LYS HD3 H 0.140 10.196 3.176 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 2 . 497 . 1 1 14 LYS HE2 H -2.330 9.135 1.694 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 2 . 498 . 1 1 14 LYS HE3 H -1.228 10.387 1.175 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 2 . 499 . 1 1 14 LYS HG2 H -0.269 8.865 5.095 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 2 . 500 . 1 1 14 LYS HG3 H 0.087 7.777 3.789 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 2 . 501 . 1 1 14 LYS HZ1 H -0.769 8.298 0.046 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 2 . 502 . 1 1 14 LYS HZ2 H 0.542 8.688 0.969 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 2 . 503 . 1 1 14 LYS HZ3 H -0.501 7.508 1.459 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 2 . 504 . 1 1 14 LYS N N -2.622 6.465 2.395 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 2 . 505 . 1 1 14 LYS NZ N -0.450 8.433 1.013 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 2 . 506 . 1 1 14 LYS O O -3.634 5.507 5.627 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 2 . 507 . 1 1 15 GLY C C -3.034 1.482 4.229 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 2 . 508 . 1 1 15 GLY CA C -3.552 2.809 4.797 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 2 . 509 . 1 1 15 GLY H H -2.601 3.929 3.136 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 2 . 510 . 1 1 15 GLY HA2 H -3.318 2.843 5.878 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 2 . 511 . 1 1 15 GLY HA3 H -4.655 2.853 4.719 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 2 . 512 . 1 1 15 GLY N N -2.960 3.970 4.098 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 2 . 513 . 1 1 15 GLY O O -1.812 1.216 4.299 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 2 . 514 . 1 1 15 GLY OXT O -3.855 0.687 3.722 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 3 . 515 . 1 1 1 CYS C C -3.741 -7.234 1.715 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 3 . 516 . 1 1 1 CYS CA C -4.840 -6.890 0.676 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 3 . 517 . 1 1 1 CYS CB C -5.757 -5.749 1.163 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 3 . 518 . 1 1 1 CYS H1 H -6.365 -7.908 -0.320 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 3 . 519 . 1 1 1 CYS H2 H -5.058 -8.860 0.019 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 3 . 520 . 1 1 1 CYS H3 H -6.115 -8.449 1.220 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 3 . 521 . 1 1 1 CYS HA H -4.378 -6.568 -0.277 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 3 . 522 . 1 1 1 CYS HB2 H -6.327 -6.031 2.070 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 3 . 523 . 1 1 1 CYS HB3 H -5.154 -4.866 1.443 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 3 . 524 . 1 1 1 CYS HG H -7.783 -6.232 0.001 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 3 . 525 . 1 1 1 CYS N N -5.641 -8.097 0.381 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 3 . 526 . 1 1 1 CYS O O -4.053 -7.630 2.844 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 3 . 527 . 1 1 1 CYS SG S -6.916 -5.235 -0.151 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 3 . 528 . 1 1 2 ARG C C -0.067 -6.615 2.196 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 3 . 529 . 1 1 2 ARG CA C -1.304 -7.560 2.138 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 3 . 530 . 1 1 2 ARG CB C -1.093 -9.125 2.084 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 3 . 531 . 1 1 2 ARG CD C 0.320 -9.619 -0.063 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 3 . 532 . 1 1 2 ARG CG C -0.988 -9.848 0.715 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 3 . 533 . 1 1 2 ARG CZ C 1.400 -10.433 -2.172 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 3 . 534 . 1 1 2 ARG H H -2.334 -6.757 0.357 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 3 . 535 . 1 1 2 ARG HA H -1.590 -7.382 3.176 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 3 . 536 . 1 1 2 ARG HB2 H -0.213 -9.390 2.704 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 3 . 537 . 1 1 2 ARG HB3 H -1.930 -9.591 2.630 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 3 . 538 . 1 1 2 ARG HD2 H 0.447 -8.545 -0.283 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 3 . 539 . 1 1 2 ARG HD3 H 1.184 -9.908 0.563 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 3 . 540 . 1 1 2 ARG HE H -0.487 -10.885 -1.672 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 3 . 541 . 1 1 2 ARG HG2 H -1.093 -10.934 0.904 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 3 . 542 . 1 1 2 ARG HG3 H -1.858 -9.580 0.089 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 3 . 543 . 1 1 2 ARG HH11 H 2.647 -9.325 -1.047 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 3 . 544 . 1 1 2 ARG HH12 H 3.302 -9.965 -2.636 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 3 . 545 . 1 1 2 ARG HH21 H 0.364 -11.561 -3.460 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 3 . 546 . 1 1 2 ARG HH22 H 2.094 -11.146 -3.909 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 3 . 547 . 1 1 2 ARG N N -2.456 -7.101 1.316 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 3 . 548 . 1 1 2 ARG NE N 0.340 -10.375 -1.340 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 3 . 549 . 1 1 2 ARG NH1 N 2.570 -9.845 -1.927 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 3 . 550 . 1 1 2 ARG NH2 N 1.273 -11.115 -3.294 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 3 . 551 . 1 1 2 ARG O O -0.183 -5.429 2.507 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 3 . 552 . 1 1 3 ALA C C 2.928 -5.413 1.274 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 3 . 553 . 1 1 3 ALA CA C 2.431 -6.581 2.174 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 3 . 554 . 1 1 3 ALA CB C 3.284 -7.851 1.936 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 3 . 555 . 1 1 3 ALA H H 1.030 -8.189 1.733 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 3 . 556 . 1 1 3 ALA HA H 2.509 -6.288 3.238 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 3 . 557 . 1 1 3 ALA HB1 H 3.136 -8.242 0.900 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 3 . 558 . 1 1 3 ALA HB2 H 4.355 -7.631 2.033 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 3 . 559 . 1 1 3 ALA HB3 H 3.021 -8.680 2.620 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 3 . 560 . 1 1 3 ALA N N 1.107 -7.194 1.967 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 3 . 561 . 1 1 3 ALA O O 3.112 -4.286 1.753 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 3 . 562 . 1 1 4 LEU C C 2.071 -3.742 -1.324 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 3 . 563 . 1 1 4 LEU CA C 3.313 -4.628 -1.055 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 3 . 564 . 1 1 4 LEU CB C 4.036 -5.193 -2.303 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 3 . 565 . 1 1 4 LEU CD1 C 4.158 -5.075 -4.837 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 3 . 566 . 1 1 4 LEU CD2 C 2.457 -6.619 -3.670 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 3 . 567 . 1 1 4 LEU CG C 3.241 -5.304 -3.635 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 3 . 568 . 1 1 4 LEU H H 2.658 -6.572 -0.308 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 3 . 569 . 1 1 4 LEU HA H 4.062 -3.941 -0.615 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 3 . 570 . 1 1 4 LEU HB2 H 4.888 -4.520 -2.447 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 3 . 571 . 1 1 4 LEU HB3 H 4.548 -6.152 -2.082 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 3 . 572 . 1 1 4 LEU HD11 H 3.591 -5.109 -5.782 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 3 . 573 . 1 1 4 LEU HD12 H 4.612 -4.065 -4.774 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 3 . 574 . 1 1 4 LEU HD13 H 4.979 -5.810 -4.874 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 3 . 575 . 1 1 4 LEU HD21 H 1.819 -6.712 -2.771 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 3 . 576 . 1 1 4 LEU HD22 H 1.789 -6.672 -4.545 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 3 . 577 . 1 1 4 LEU HD23 H 3.129 -7.495 -3.678 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 3 . 578 . 1 1 4 LEU HG H 2.502 -4.488 -3.715 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 3 . 579 . 1 1 4 LEU N N 3.070 -5.676 -0.038 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 3 . 580 . 1 1 4 LEU O O 2.241 -2.578 -1.665 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 3 . 581 . 1 1 5 ILE C C -0.301 -2.421 0.028 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 3 . 582 . 1 1 5 ILE CA C -0.411 -3.539 -1.071 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 3 . 583 . 1 1 5 ILE CB C -1.610 -4.528 -0.871 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 3 . 584 . 1 1 5 ILE CD1 C -1.090 -6.886 -1.897 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 3 . 585 . 1 1 5 ILE CG1 C -1.794 -5.530 -2.069 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 3 . 586 . 1 1 5 ILE CG2 C -2.940 -3.744 -0.653 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 3 . 587 . 1 1 5 ILE H H 0.872 -5.280 -0.879 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 3 . 588 . 1 1 5 ILE HA H -0.599 -3.058 -2.043 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 3 . 589 . 1 1 5 ILE HB H -1.370 -5.112 0.046 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 3 . 590 . 1 1 5 ILE HD11 H -1.044 -7.453 -2.843 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 3 . 591 . 1 1 5 ILE HD12 H -0.050 -6.778 -1.541 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 3 . 592 . 1 1 5 ILE HD13 H -1.606 -7.527 -1.164 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 3 . 593 . 1 1 5 ILE HG12 H -2.863 -5.717 -2.280 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 3 . 594 . 1 1 5 ILE HG13 H -1.413 -5.075 -3.000 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 3 . 595 . 1 1 5 ILE HG21 H -2.919 -3.137 0.271 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 3 . 596 . 1 1 5 ILE HG22 H -3.145 -3.039 -1.480 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 3 . 597 . 1 1 5 ILE HG23 H -3.818 -4.401 -0.562 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 3 . 598 . 1 1 5 ILE N N 0.848 -4.306 -1.204 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 3 . 599 . 1 1 5 ILE O O -0.643 -1.285 -0.260 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 3 . 600 . 1 1 6 LYS C C 1.695 -0.727 1.974 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 3 . 601 . 1 1 6 LYS CA C 0.483 -1.666 2.265 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 3 . 602 . 1 1 6 LYS CB C 0.364 -2.307 3.670 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 3 . 603 . 1 1 6 LYS CD C -2.269 -2.675 3.198 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 3 . 604 . 1 1 6 LYS CE C -3.628 -3.033 3.832 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 3 . 605 . 1 1 6 LYS CG C -1.090 -2.501 4.213 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 3 . 606 . 1 1 6 LYS H H 0.470 -3.687 1.370 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 3 . 607 . 1 1 6 LYS HA H -0.358 -0.945 2.224 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 3 . 608 . 1 1 6 LYS HB2 H 0.905 -3.274 3.692 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 3 . 609 . 1 1 6 LYS HB3 H 0.912 -1.687 4.404 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 3 . 610 . 1 1 6 LYS HD2 H -2.374 -1.765 2.566 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 3 . 611 . 1 1 6 LYS HD3 H -2.024 -3.458 2.454 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 3 . 612 . 1 1 6 LYS HE2 H -4.341 -3.300 3.031 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 3 . 613 . 1 1 6 LYS HE3 H -3.535 -3.935 4.464 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 3 . 614 . 1 1 6 LYS HG2 H -1.077 -3.361 4.910 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 3 . 615 . 1 1 6 LYS HG3 H -1.325 -1.629 4.851 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 3 . 616 . 1 1 6 LYS HZ1 H -4.346 -1.087 4.051 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 3 . 617 . 1 1 6 LYS HZ2 H -5.122 -2.180 5.016 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 3 . 618 . 1 1 6 LYS HZ3 H -3.602 -1.663 5.405 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 3 . 619 . 1 1 6 LYS N N 0.205 -2.705 1.234 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 3 . 620 . 1 1 6 LYS NZ N -4.209 -1.929 4.621 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 3 . 621 . 1 1 6 LYS O O 1.624 0.431 2.379 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 3 . 622 . 1 1 7 ARG C C 3.142 0.755 -0.467 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 3 . 623 . 1 1 7 ARG CA C 3.748 -0.217 0.634 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 3 . 624 . 1 1 7 ARG CB C 4.935 -1.046 0.066 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 3 . 625 . 1 1 7 ARG CD C 6.996 -0.640 1.462 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 3 . 626 . 1 1 7 ARG CG C 6.311 -0.358 0.121 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 3 . 627 . 1 1 7 ARG CZ C 9.075 0.056 2.676 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 3 . 628 . 1 1 7 ARG H H 2.847 -2.184 1.172 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 3 . 629 . 1 1 7 ARG HA H 4.141 0.420 1.451 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 3 . 630 . 1 1 7 ARG HB2 H 5.012 -2.049 0.533 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 3 . 631 . 1 1 7 ARG HB3 H 4.728 -1.270 -0.983 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 3 . 632 . 1 1 7 ARG HD2 H 6.306 -0.364 2.280 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 3 . 633 . 1 1 7 ARG HD3 H 7.161 -1.733 1.539 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 3 . 634 . 1 1 7 ARG HE H 8.636 0.680 0.824 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 3 . 635 . 1 1 7 ARG HG2 H 6.941 -0.749 -0.699 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 3 . 636 . 1 1 7 ARG HG3 H 6.205 0.728 -0.065 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 3 . 637 . 1 1 7 ARG HH11 H 7.926 -1.184 3.767 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 3 . 638 . 1 1 7 ARG HH12 H 9.483 -0.592 4.538 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 3 . 639 . 1 1 7 ARG HH21 H 10.382 1.291 1.798 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 3 . 640 . 1 1 7 ARG HH22 H 10.779 0.716 3.494 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 3 . 641 . 1 1 7 ARG N N 2.768 -1.160 1.272 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 3 . 642 . 1 1 7 ARG NE N 8.282 0.092 1.586 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 3 . 643 . 1 1 7 ARG NH1 N 8.800 -0.646 3.774 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 3 . 644 . 1 1 7 ARG NH2 N 10.192 0.759 2.654 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 3 . 645 . 1 1 7 ARG O O 3.269 1.982 -0.356 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 3 . 646 . 1 1 8 ILE C C 0.576 1.955 -1.745 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 3 . 647 . 1 1 8 ILE CA C 1.630 1.048 -2.459 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 3 . 648 . 1 1 8 ILE CB C 1.056 0.283 -3.716 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 3 . 649 . 1 1 8 ILE CD1 C -1.486 -0.366 -3.282 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 3 . 650 . 1 1 8 ILE CG1 C -0.003 -0.806 -3.405 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 3 . 651 . 1 1 8 ILE CG2 C 2.194 -0.302 -4.591 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 3 . 652 . 1 1 8 ILE H H 2.544 -0.797 -1.629 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 3 . 653 . 1 1 8 ILE HA H 2.350 1.751 -2.911 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 3 . 654 . 1 1 8 ILE HB H 0.564 1.026 -4.367 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 3 . 655 . 1 1 8 ILE HD11 H -2.108 -1.158 -2.821 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 3 . 656 . 1 1 8 ILE HD12 H -1.637 0.518 -2.640 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 3 . 657 . 1 1 8 ILE HD13 H -1.942 -0.110 -4.252 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 3 . 658 . 1 1 8 ILE HG12 H 0.078 -1.651 -4.115 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 3 . 659 . 1 1 8 ILE HG13 H 0.306 -1.249 -2.456 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 3 . 660 . 1 1 8 ILE HG21 H 2.749 -1.105 -4.071 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 3 . 661 . 1 1 8 ILE HG22 H 1.805 -0.731 -5.534 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 3 . 662 . 1 1 8 ILE HG23 H 2.929 0.473 -4.877 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 3 . 663 . 1 1 8 ILE N N 2.447 0.222 -1.506 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 3 . 664 . 1 1 8 ILE O O 0.538 3.130 -2.081 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 3 . 665 . 1 1 9 GLN C C -0.491 3.371 0.981 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 3 . 666 . 1 1 9 GLN CA C -1.165 2.337 0.025 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 3 . 667 . 1 1 9 GLN CB C -2.260 1.541 0.792 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 3 . 668 . 1 1 9 GLN CD C -4.407 0.081 0.587 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 3 . 669 . 1 1 9 GLN CG C -3.180 0.689 -0.106 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 3 . 670 . 1 1 9 GLN H H -0.081 0.483 -0.538 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 3 . 671 . 1 1 9 GLN HA H -1.687 2.928 -0.749 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 3 . 672 . 1 1 9 GLN HB2 H -1.793 0.896 1.561 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 3 . 673 . 1 1 9 GLN HB3 H -2.892 2.252 1.358 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 3 . 674 . 1 1 9 GLN HE21 H -5.561 1.541 -0.143 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 3 . 675 . 1 1 9 GLN HE22 H -6.374 0.282 0.917 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 3 . 676 . 1 1 9 GLN HG2 H -3.485 1.238 -1.012 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 3 . 677 . 1 1 9 GLN HG3 H -2.562 -0.120 -0.500 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 3 . 678 . 1 1 9 GLN N N -0.208 1.479 -0.748 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 3 . 679 . 1 1 9 GLN NE2 N -5.564 0.708 0.454 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 3 . 680 . 1 1 9 GLN O O -0.974 4.496 1.116 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 3 . 681 . 1 1 9 GLN OE1 O -4.336 -0.965 1.229 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 3 . 682 . 1 1 10 ALA C C 1.916 5.272 1.180 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 3 . 683 . 1 1 10 ALA CA C 1.612 4.056 2.133 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 3 . 684 . 1 1 10 ALA CB C 2.915 3.354 2.584 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 3 . 685 . 1 1 10 ALA H H 0.887 2.044 1.400 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 3 . 686 . 1 1 10 ALA HA H 1.130 4.475 3.038 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 3 . 687 . 1 1 10 ALA HB1 H 3.603 4.043 3.101 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 3 . 688 . 1 1 10 ALA HB2 H 2.727 2.509 3.271 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 3 . 689 . 1 1 10 ALA HB3 H 3.494 2.937 1.743 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 3 . 690 . 1 1 10 ALA N N 0.667 3.037 1.568 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 3 . 691 . 1 1 10 ALA O O 1.848 6.418 1.634 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 3 . 692 . 1 1 11 MET C C 0.652 6.643 -1.603 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 3 . 693 . 1 1 11 MET CA C 2.085 6.095 -1.182 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 3 . 694 . 1 1 11 MET CB C 2.835 5.614 -2.464 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 3 . 695 . 1 1 11 MET CE C 6.911 5.780 -1.566 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 3 . 696 . 1 1 11 MET CG C 4.304 5.183 -2.303 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 3 . 697 . 1 1 11 MET H H 2.310 4.030 -0.363 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 3 . 698 . 1 1 11 MET HA H 2.652 6.968 -0.804 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 3 . 699 . 1 1 11 MET HB2 H 2.284 4.775 -2.928 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 3 . 700 . 1 1 11 MET HB3 H 2.808 6.418 -3.224 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 3 . 701 . 1 1 11 MET HE1 H 6.854 4.982 -0.804 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 3 . 702 . 1 1 11 MET HE2 H 7.672 6.511 -1.239 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 3 . 703 . 1 1 11 MET HE3 H 7.254 5.331 -2.516 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 3 . 704 . 1 1 11 MET HG2 H 4.398 4.357 -1.571 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 3 . 705 . 1 1 11 MET HG3 H 4.682 4.794 -3.266 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 3 . 706 . 1 1 11 MET N N 2.152 5.028 -0.129 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 3 . 707 . 1 1 11 MET O O 0.496 7.853 -1.781 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 3 . 708 . 1 1 11 MET SD S 5.311 6.586 -1.775 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 3 . 709 . 1 1 12 ILE C C -2.767 6.785 -1.565 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 3 . 710 . 1 1 12 ILE CA C -1.673 6.074 -2.461 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 3 . 711 . 1 1 12 ILE CB C -1.964 4.852 -3.447 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 3 . 712 . 1 1 12 ILE CD1 C -0.453 3.538 -5.138 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 3 . 713 . 1 1 12 ILE CG1 C -1.028 4.893 -4.718 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 3 . 714 . 1 1 12 ILE CG2 C -3.400 4.573 -3.960 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 3 . 715 . 1 1 12 ILE H H -0.062 4.778 -1.676 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 3 . 716 . 1 1 12 ILE HA H -1.523 6.873 -3.166 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 3 . 717 . 1 1 12 ILE HB H -1.722 3.945 -2.862 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 3 . 718 . 1 1 12 ILE HD11 H -1.206 2.730 -5.109 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 3 . 719 . 1 1 12 ILE HD12 H -0.027 3.579 -6.154 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 3 . 720 . 1 1 12 ILE HD13 H 0.375 3.247 -4.471 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 3 . 721 . 1 1 12 ILE HG12 H -1.550 5.354 -5.578 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 3 . 722 . 1 1 12 ILE HG13 H -0.163 5.563 -4.557 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 3 . 723 . 1 1 12 ILE HG21 H -3.435 3.582 -4.460 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 3 . 724 . 1 1 12 ILE HG22 H -4.162 4.513 -3.169 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 3 . 725 . 1 1 12 ILE HG23 H -3.743 5.322 -4.690 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 3 . 726 . 1 1 12 ILE N N -0.336 5.752 -1.846 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 3 . 727 . 1 1 12 ILE O O -3.012 7.971 -1.817 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 3 . 728 . 1 1 13 PRO C C -3.998 6.904 1.995 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 3 . 729 . 1 1 13 PRO CA C -4.289 6.913 0.447 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 3 . 730 . 1 1 13 PRO CB C -5.593 6.180 0.075 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 3 . 731 . 1 1 13 PRO CD C -3.672 4.791 -0.460 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 3 . 732 . 1 1 13 PRO CG C -5.192 4.751 -0.313 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 3 . 733 . 1 1 13 PRO HA H -4.391 7.975 0.179 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 3 . 734 . 1 1 13 PRO HB2 H -6.368 6.206 0.865 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 3 . 735 . 1 1 13 PRO HB3 H -6.030 6.687 -0.806 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 3 . 736 . 1 1 13 PRO HD2 H -3.177 4.336 0.392 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 3 . 737 . 1 1 13 PRO HD3 H -3.304 4.242 -1.331 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 3 . 738 . 1 1 13 PRO HG2 H -5.501 4.010 0.448 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 3 . 739 . 1 1 13 PRO HG3 H -5.661 4.466 -1.272 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 3 . 740 . 1 1 13 PRO N N -3.321 6.208 -0.460 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 3 . 741 . 1 1 13 PRO O O -4.872 7.284 2.780 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 3 . 742 . 1 1 14 LYS C C -3.204 5.381 4.681 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 3 . 743 . 1 1 14 LYS CA C -2.354 6.402 3.846 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 3 . 744 . 1 1 14 LYS CB C -2.113 7.795 4.520 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 3 . 745 . 1 1 14 LYS CD C -0.953 9.741 3.115 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 3 . 746 . 1 1 14 LYS CE C -1.416 9.472 1.667 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 3 . 747 . 1 1 14 LYS CG C -0.820 8.551 4.100 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 3 . 748 . 1 1 14 LYS H H -2.160 6.197 1.662 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 3 . 749 . 1 1 14 LYS HA H -1.352 5.932 3.805 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 3 . 750 . 1 1 14 LYS HB2 H -3.003 8.445 4.422 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 3 . 751 . 1 1 14 LYS HB3 H -2.027 7.628 5.611 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 3 . 752 . 1 1 14 LYS HD2 H -1.630 10.494 3.561 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 3 . 753 . 1 1 14 LYS HD3 H 0.028 10.250 3.069 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 3 . 754 . 1 1 14 LYS HE2 H -2.480 9.177 1.655 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 3 . 755 . 1 1 14 LYS HE3 H -1.382 10.412 1.086 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 3 . 756 . 1 1 14 LYS HG2 H -0.366 8.961 5.021 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 3 . 757 . 1 1 14 LYS HG3 H -0.056 7.840 3.730 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 3 . 758 . 1 1 14 LYS HZ1 H 0.379 8.701 0.899 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 3 . 759 . 1 1 14 LYS HZ2 H -0.661 7.539 1.434 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 3 . 760 . 1 1 14 LYS HZ3 H -0.947 8.293 0.004 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 3 . 761 . 1 1 14 LYS N N -2.777 6.511 2.419 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 3 . 762 . 1 1 14 LYS NZ N -0.614 8.451 0.963 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 3 . 763 . 1 1 14 LYS O O -3.790 5.725 5.713 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 3 . 764 . 1 1 15 GLY C C -3.681 1.683 4.226 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 3 . 765 . 1 1 15 GLY CA C -3.878 3.015 4.952 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 3 . 766 . 1 1 15 GLY H H -2.876 4.024 3.256 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 3 . 767 . 1 1 15 GLY HA2 H -3.465 2.936 5.976 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 3 . 768 . 1 1 15 GLY HA3 H -4.958 3.226 5.070 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 3 . 769 . 1 1 15 GLY N N -3.223 4.116 4.219 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 3 . 770 . 1 1 15 GLY O O -4.651 1.188 3.613 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 3 . 771 . 1 1 15 GLY OXT O -2.566 1.117 4.273 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 4 . 772 . 1 1 1 CYS C C -3.599 -7.190 1.868 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 4 . 773 . 1 1 1 CYS CA C -4.760 -6.842 0.900 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 4 . 774 . 1 1 1 CYS CB C -5.627 -5.682 1.431 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 4 . 775 . 1 1 1 CYS H1 H -5.062 -8.816 0.288 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 4 . 776 . 1 1 1 CYS H2 H -6.022 -8.368 1.555 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 4 . 777 . 1 1 1 CYS H3 H -6.372 -7.842 0.030 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 4 . 778 . 1 1 1 CYS HA H -4.359 -6.543 -0.087 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 4 . 779 . 1 1 1 CYS HB2 H -6.099 -5.936 2.400 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 4 . 780 . 1 1 1 CYS HB3 H -5.007 -4.785 1.617 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 4 . 781 . 1 1 1 CYS HG H -6.122 -4.787 -0.721 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 4 . 782 . 1 1 1 CYS N N -5.602 -8.036 0.680 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 4 . 783 . 1 1 1 CYS O O -3.842 -7.575 3.018 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 4 . 784 . 1 1 1 CYS SG S -6.931 -5.238 0.233 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 4 . 785 . 1 1 2 ARG C C 0.079 -6.557 2.166 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 4 . 786 . 1 1 2 ARG CA C -1.142 -7.527 2.148 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 4 . 787 . 1 1 2 ARG CB C -0.914 -9.087 2.047 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 4 . 788 . 1 1 2 ARG CD C 0.481 -9.507 -0.126 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 4 . 789 . 1 1 2 ARG CG C -0.818 -9.771 0.659 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 4 . 790 . 1 1 2 ARG CZ C 1.531 -10.216 -2.287 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 4 . 791 . 1 1 2 ARG H H -2.274 -6.736 0.422 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 4 . 792 . 1 1 2 ARG HA H -1.375 -7.378 3.203 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 4 . 793 . 1 1 2 ARG HB2 H -0.022 -9.357 2.648 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 4 . 794 . 1 1 2 ARG HB3 H -1.737 -9.578 2.592 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 4 . 795 . 1 1 2 ARG HD2 H 0.600 -8.425 -0.312 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 4 . 796 . 1 1 2 ARG HD3 H 1.353 -9.810 0.481 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 4 . 797 . 1 1 2 ARG HE H -0.323 -10.756 -1.750 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 4 . 798 . 1 1 2 ARG HG2 H -0.911 -10.862 0.818 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 4 . 799 . 1 1 2 ARG HG3 H -1.698 -9.495 0.049 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 4 . 800 . 1 1 2 ARG HH11 H 2.766 -9.094 -1.163 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 4 . 801 . 1 1 2 ARG HH12 H 3.400 -9.661 -2.788 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 4 . 802 . 1 1 2 ARG HH21 H 0.502 -11.345 -3.580 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 4 . 803 . 1 1 2 ARG HH22 H 2.201 -10.851 -4.063 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 4 . 804 . 1 1 2 ARG N N -2.340 -7.071 1.390 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 4 . 805 . 1 1 2 ARG NE N 0.493 -10.224 -1.425 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 4 . 806 . 1 1 2 ARG NH1 N 2.684 -9.591 -2.056 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 4 . 807 . 1 1 2 ARG NH2 N 1.398 -10.869 -3.425 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 4 . 808 . 1 1 2 ARG O O -0.053 -5.359 2.424 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 4 . 809 . 1 1 3 ALA C C 3.034 -5.312 1.262 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 4 . 810 . 1 1 3 ALA CA C 2.579 -6.502 2.159 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 4 . 811 . 1 1 3 ALA CB C 3.441 -7.758 1.861 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 4 . 812 . 1 1 3 ALA H H 1.195 -8.140 1.790 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 4 . 813 . 1 1 3 ALA HA H 2.683 -6.229 3.225 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 4 . 814 . 1 1 3 ALA HB1 H 3.262 -8.127 0.821 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 4 . 815 . 1 1 3 ALA HB2 H 4.513 -7.524 1.915 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 4 . 816 . 1 1 3 ALA HB3 H 3.217 -8.608 2.530 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 4 . 817 . 1 1 3 ALA N N 1.262 -7.134 1.977 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 4 . 818 . 1 1 3 ALA O O 3.193 -4.183 1.744 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 4 . 819 . 1 1 4 LEU C C 2.110 -3.683 -1.373 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 4 . 820 . 1 1 4 LEU CA C 3.375 -4.523 -1.074 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 4 . 821 . 1 1 4 LEU CB C 4.183 -5.056 -2.282 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 4 . 822 . 1 1 4 LEU CD1 C 4.471 -4.686 -4.776 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 4 . 823 . 1 1 4 LEU CD2 C 2.760 -6.413 -3.852 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 4 . 824 . 1 1 4 LEU CG C 3.487 -5.075 -3.672 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 4 . 825 . 1 1 4 LEU H H 2.803 -6.486 -0.309 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 4 . 826 . 1 1 4 LEU HA H 4.068 -3.796 -0.611 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 4 . 827 . 1 1 4 LEU HB2 H 5.076 -4.420 -2.319 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 4 . 828 . 1 1 4 LEU HB3 H 4.640 -6.044 -2.070 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 4 . 829 . 1 1 4 LEU HD11 H 4.860 -3.665 -4.583 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 4 . 830 . 1 1 4 LEU HD12 H 5.337 -5.367 -4.820 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 4 . 831 . 1 1 4 LEU HD13 H 3.975 -4.651 -5.761 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 4 . 832 . 1 1 4 LEU HD21 H 2.173 -6.437 -4.784 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 4 . 833 . 1 1 4 LEU HD22 H 3.463 -7.265 -3.844 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 4 . 834 . 1 1 4 LEU HD23 H 2.049 -6.577 -3.017 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 4 . 835 . 1 1 4 LEU HG H 2.715 -4.290 -3.743 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 4 . 836 . 1 1 4 LEU N N 3.169 -5.567 -0.049 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 4 . 837 . 1 1 4 LEU O O 2.240 -2.529 -1.767 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 4 . 838 . 1 1 5 ILE C C -0.231 -2.371 0.000 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 4 . 839 . 1 1 5 ILE CA C -0.358 -3.510 -1.083 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 4 . 840 . 1 1 5 ILE CB C -1.540 -4.509 -0.843 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 4 . 841 . 1 1 5 ILE CD1 C -1.006 -6.841 -1.924 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 4 . 842 . 1 1 5 ILE CG1 C -1.763 -5.507 -2.036 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 4 . 843 . 1 1 5 ILE CG2 C -2.868 -3.740 -0.571 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 4 . 844 . 1 1 5 ILE H H 0.954 -5.246 -0.923 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 4 . 845 . 1 1 5 ILE HA H -0.572 -3.043 -2.056 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 4 . 846 . 1 1 5 ILE HB H -1.267 -5.096 0.062 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 4 . 847 . 1 1 5 ILE HD11 H -1.121 -7.460 -2.830 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 4 . 848 . 1 1 5 ILE HD12 H 0.080 -6.709 -1.769 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 4 . 849 . 1 1 5 ILE HD13 H -1.374 -7.442 -1.078 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 4 . 850 . 1 1 5 ILE HG12 H -2.836 -5.735 -2.170 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 4 . 851 . 1 1 5 ILE HG13 H -1.467 -5.033 -2.988 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 4 . 852 . 1 1 5 ILE HG21 H -3.733 -4.409 -0.448 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 4 . 853 . 1 1 5 ILE HG22 H -2.818 -3.137 0.355 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 4 . 854 . 1 1 5 ILE HG23 H -3.114 -3.035 -1.387 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 4 . 855 . 1 1 5 ILE N N 0.906 -4.269 -1.234 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 4 . 856 . 1 1 5 ILE O O -0.618 -1.250 -0.289 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 4 . 857 . 1 1 6 LYS C C 1.888 -0.628 1.798 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 4 . 858 . 1 1 6 LYS CA C 0.680 -1.552 2.170 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 4 . 859 . 1 1 6 LYS CB C 0.626 -2.167 3.591 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 4 . 860 . 1 1 6 LYS CD C -2.026 -2.545 3.260 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 4 . 861 . 1 1 6 LYS CE C -3.345 -2.917 3.966 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 4 . 862 . 1 1 6 LYS CG C -0.801 -2.335 4.210 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 4 . 863 . 1 1 6 LYS H H 0.642 -3.590 1.321 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 4 . 864 . 1 1 6 LYS HA H -0.159 -0.827 2.152 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 4 . 865 . 1 1 6 LYS HB2 H 1.154 -3.141 3.603 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 4 . 866 . 1 1 6 LYS HB3 H 1.220 -1.543 4.285 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 4 . 867 . 1 1 6 LYS HD2 H -2.177 -1.649 2.617 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 4 . 868 . 1 1 6 LYS HD3 H -1.808 -3.339 2.519 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 4 . 869 . 1 1 6 LYS HE2 H -4.093 -3.209 3.207 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 4 . 870 . 1 1 6 LYS HE3 H -3.204 -3.809 4.605 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 4 . 871 . 1 1 6 LYS HG2 H -0.755 -3.167 4.938 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 4 . 872 . 1 1 6 LYS HG3 H -1.006 -1.439 4.825 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 4 . 873 . 1 1 6 LYS HZ1 H -3.265 -1.526 5.519 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 4 . 874 . 1 1 6 LYS HZ2 H -4.088 -0.982 4.198 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 4 . 875 . 1 1 6 LYS HZ3 H -4.793 -2.077 5.214 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 4 . 876 . 1 1 6 LYS N N 0.344 -2.618 1.184 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 4 . 877 . 1 1 6 LYS NZ N -3.906 -1.814 4.771 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 4 . 878 . 1 1 6 LYS O O 1.839 0.547 2.157 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 4 . 879 . 1 1 7 ARG C C 3.182 0.824 -0.691 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 4 . 880 . 1 1 7 ARG CA C 3.877 -0.178 0.324 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 4 . 881 . 1 1 7 ARG CB C 4.968 -1.022 -0.417 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 4 . 882 . 1 1 7 ARG CD C 6.789 -1.161 1.420 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 4 . 883 . 1 1 7 ARG CG C 5.895 -1.925 0.433 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 4 . 884 . 1 1 7 ARG CZ C 8.580 -1.688 3.091 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 4 . 885 . 1 1 7 ARG H H 2.995 -2.118 1.026 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 4 . 886 . 1 1 7 ARG HA H 4.394 0.449 1.075 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 4 . 887 . 1 1 7 ARG HB2 H 4.478 -1.664 -1.168 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 4 . 888 . 1 1 7 ARG HB3 H 5.593 -0.366 -1.048 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 4 . 889 . 1 1 7 ARG HD2 H 7.369 -0.398 0.869 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 4 . 890 . 1 1 7 ARG HD3 H 6.149 -0.627 2.147 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 4 . 891 . 1 1 7 ARG HE H 7.719 -3.085 1.943 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 4 . 892 . 1 1 7 ARG HG2 H 5.289 -2.669 0.984 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 4 . 893 . 1 1 7 ARG HG3 H 6.526 -2.517 -0.257 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 4 . 894 . 1 1 7 ARG HH11 H 8.125 0.271 3.046 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 4 . 895 . 1 1 7 ARG HH12 H 9.424 -0.257 4.228 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 4 . 896 . 1 1 7 ARG HH21 H 9.210 -3.574 3.324 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 4 . 897 . 1 1 7 ARG HH22 H 9.995 -2.290 4.373 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 4 . 898 . 1 1 7 ARG N N 2.931 -1.091 1.071 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 4 . 899 . 1 1 7 ARG NE N 7.707 -2.078 2.141 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 4 . 900 . 1 1 7 ARG NH1 N 8.725 -0.428 3.497 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 4 . 901 . 1 1 7 ARG NH2 N 9.338 -2.611 3.653 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 4 . 902 . 1 1 7 ARG O O 3.309 2.051 -0.561 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 4 . 903 . 1 1 8 ILE C C 0.502 2.002 -1.817 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 4 . 904 . 1 1 8 ILE CA C 1.540 1.116 -2.572 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 4 . 905 . 1 1 8 ILE CB C 0.941 0.338 -3.808 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 4 . 906 . 1 1 8 ILE CD1 C -1.559 -0.377 -3.289 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 4 . 907 . 1 1 8 ILE CG1 C -0.072 -0.783 -3.460 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 4 . 908 . 1 1 8 ILE CG2 C 2.062 -0.211 -4.729 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 4 . 909 . 1 1 8 ILE H H 2.407 -0.730 -1.711 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 4 . 910 . 1 1 8 ILE HA H 2.235 1.831 -3.046 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 4 . 911 . 1 1 8 ILE HB H 0.404 1.067 -4.439 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 4 . 912 . 1 1 8 ILE HD11 H -2.151 -1.187 -2.819 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 4 . 913 . 1 1 8 ILE HD12 H -1.707 0.495 -2.630 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 4 . 914 . 1 1 8 ILE HD13 H -2.048 -0.116 -4.241 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 4 . 915 . 1 1 8 ILE HG12 H 0.017 -1.627 -4.172 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 4 . 916 . 1 1 8 ILE HG13 H 0.278 -1.216 -2.521 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 4 . 917 . 1 1 8 ILE HG21 H 2.763 0.585 -5.041 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 4 . 918 . 1 1 8 ILE HG22 H 2.660 -1.000 -4.234 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 4 . 919 . 1 1 8 ILE HG23 H 1.650 -0.650 -5.658 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 4 . 920 . 1 1 8 ILE N N 2.392 0.296 -1.655 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 4 . 921 . 1 1 8 ILE O O 0.431 3.173 -2.157 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 4 . 922 . 1 1 9 GLN C C -0.519 3.428 0.919 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 4 . 923 . 1 1 9 GLN CA C -1.197 2.369 -0.005 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 4 . 924 . 1 1 9 GLN CB C -2.254 1.565 0.805 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 4 . 925 . 1 1 9 GLN CD C -4.368 0.052 0.689 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 4 . 926 . 1 1 9 GLN CG C -3.183 0.684 -0.053 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 4 . 927 . 1 1 9 GLN H H -0.094 0.527 -0.580 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 4 . 928 . 1 1 9 GLN HA H -1.752 2.939 -0.772 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 4 . 929 . 1 1 9 GLN HB2 H -1.754 0.941 1.570 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 4 . 930 . 1 1 9 GLN HB3 H -2.883 2.275 1.376 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 4 . 931 . 1 1 9 GLN HE21 H -5.582 1.486 0.004 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 4 . 932 . 1 1 9 GLN HE22 H -6.325 0.212 1.095 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 4 . 933 . 1 1 9 GLN HG2 H -3.532 1.219 -0.951 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 4 . 934 . 1 1 9 GLN HG3 H -2.560 -0.113 -0.463 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 4 . 935 . 1 1 9 GLN N N -0.241 1.520 -0.792 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 4 . 936 . 1 1 9 GLN NE2 N -5.544 0.652 0.598 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 4 . 937 . 1 1 9 GLN O O -1.016 4.547 1.045 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 4 . 938 . 1 1 9 GLN OE1 O -4.249 -0.989 1.331 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 4 . 939 . 1 1 10 ALA C C 1.861 5.367 1.027 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 4 . 940 . 1 1 10 ALA CA C 1.592 4.170 2.013 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 4 . 941 . 1 1 10 ALA CB C 2.912 3.504 2.457 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 4 . 942 . 1 1 10 ALA H H 0.893 2.133 1.324 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 4 . 943 . 1 1 10 ALA HA H 1.120 4.603 2.916 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 4 . 944 . 1 1 10 ALA HB1 H 3.616 4.231 2.897 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 4 . 945 . 1 1 10 ALA HB2 H 2.748 2.715 3.213 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 4 . 946 . 1 1 10 ALA HB3 H 3.450 3.025 1.619 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 4 . 947 . 1 1 10 ALA N N 0.656 3.122 1.487 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 4 . 948 . 1 1 10 ALA O O 1.788 6.520 1.460 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 4 . 949 . 1 1 11 MET C C 0.527 6.680 -1.743 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 4 . 950 . 1 1 11 MET CA C 1.976 6.150 -1.348 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 4 . 951 . 1 1 11 MET CB C 2.708 5.659 -2.634 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 4 . 952 . 1 1 11 MET CE C 5.641 6.410 -0.373 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 4 . 953 . 1 1 11 MET CG C 4.193 5.270 -2.497 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 4 . 954 . 1 1 11 MET H H 2.268 4.102 -0.501 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 4 . 955 . 1 1 11 MET HA H 2.540 7.035 -0.994 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 4 . 956 . 1 1 11 MET HB2 H 2.168 4.796 -3.065 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 4 . 957 . 1 1 11 MET HB3 H 2.644 6.442 -3.413 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 4 . 958 . 1 1 11 MET HE1 H 6.299 7.212 0.007 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 4 . 959 . 1 1 11 MET HE2 H 6.177 5.449 -0.271 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 4 . 960 . 1 1 11 MET HE3 H 4.742 6.374 0.268 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 4 . 961 . 1 1 11 MET HG2 H 4.333 4.470 -1.742 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 4 . 962 . 1 1 11 MET HG3 H 4.545 4.848 -3.456 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 4 . 963 . 1 1 11 MET N N 2.075 5.099 -0.282 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 4 . 964 . 1 1 11 MET O O 0.358 7.886 -1.939 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 4 . 965 . 1 1 11 MET SD S 5.197 6.721 -2.096 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 4 . 966 . 1 1 12 ILE C C -2.894 6.790 -1.619 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 4 . 967 . 1 1 12 ILE CA C -1.816 6.079 -2.533 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 4 . 968 . 1 1 12 ILE CB C -2.117 4.843 -3.497 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 4 . 969 . 1 1 12 ILE CD1 C -0.619 3.538 -5.203 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 4 . 970 . 1 1 12 ILE CG1 C -1.220 4.885 -4.794 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 4 . 971 . 1 1 12 ILE CG2 C -3.563 4.532 -3.964 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 4 . 972 . 1 1 12 ILE H H -0.174 4.811 -1.766 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 4 . 973 . 1 1 12 ILE HA H -1.691 6.872 -3.249 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 4 . 974 . 1 1 12 ILE HB H -1.846 3.946 -2.910 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 4 . 975 . 1 1 12 ILE HD11 H -1.350 2.712 -5.137 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 4 . 976 . 1 1 12 ILE HD12 H -0.221 3.570 -6.230 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 4 . 977 . 1 1 12 ILE HD13 H 0.233 3.285 -4.550 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 4 . 978 . 1 1 12 ILE HG12 H -1.779 5.313 -5.649 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 4 . 979 . 1 1 12 ILE HG13 H -0.370 5.582 -4.672 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 4 . 980 . 1 1 12 ILE HG21 H -3.593 3.536 -4.455 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 4 . 981 . 1 1 12 ILE HG22 H -4.299 4.462 -3.151 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 4 . 982 . 1 1 12 ILE HG23 H -3.942 5.267 -4.689 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 4 . 983 . 1 1 12 ILE N N -0.460 5.779 -1.946 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 4 . 984 . 1 1 12 ILE O O -3.158 7.970 -1.880 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 4 . 985 . 1 1 13 PRO C C -4.028 6.948 1.969 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 4 . 986 . 1 1 13 PRO CA C -4.363 6.928 0.430 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 4 . 987 . 1 1 13 PRO CB C -5.668 6.174 0.106 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 4 . 988 . 1 1 13 PRO CD C -3.745 4.800 -0.463 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 4 . 989 . 1 1 13 PRO CG C -5.262 4.745 -0.280 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 4 . 990 . 1 1 13 PRO HA H -4.485 7.984 0.149 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 4 . 991 . 1 1 13 PRO HB2 H -6.419 6.199 0.917 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 4 . 992 . 1 1 13 PRO HB3 H -6.137 6.666 -0.768 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 4 . 993 . 1 1 13 PRO HD2 H -3.228 4.362 0.383 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 4 . 994 . 1 1 13 PRO HD3 H -3.389 4.243 -1.334 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 4 . 995 . 1 1 13 PRO HG2 H -5.544 4.008 0.495 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 4 . 996 . 1 1 13 PRO HG3 H -5.750 4.446 -1.225 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 4 . 997 . 1 1 13 PRO N N -3.412 6.221 -0.493 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 4 . 998 . 1 1 13 PRO O O -4.883 7.332 2.772 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 4 . 999 . 1 1 14 LYS C C -3.137 5.480 4.655 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 4 . 1000 . 1 1 14 LYS CA C -2.325 6.497 3.779 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 4 . 1001 . 1 1 14 LYS CB C -2.083 7.903 4.424 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 4 . 1002 . 1 1 14 LYS CD C -0.986 9.841 2.958 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 4 . 1003 . 1 1 14 LYS CE C -1.490 9.545 1.529 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 4 . 1004 . 1 1 14 LYS CG C -0.811 8.667 3.956 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 4 . 1005 . 1 1 14 LYS H H -2.196 6.244 1.596 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 4 . 1006 . 1 1 14 LYS HA H -1.318 6.039 3.717 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 4 . 1007 . 1 1 14 LYS HB2 H -2.983 8.541 4.340 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 4 . 1008 . 1 1 14 LYS HB3 H -1.965 7.756 5.515 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 4 . 1009 . 1 1 14 LYS HD2 H -1.657 10.593 3.413 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 4 . 1010 . 1 1 14 LYS HD3 H -0.012 10.359 2.874 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 4 . 1011 . 1 1 14 LYS HE2 H -2.549 9.236 1.555 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 4 . 1012 . 1 1 14 LYS HE3 H -1.486 10.476 0.935 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 4 . 1013 . 1 1 14 LYS HG2 H -0.335 9.096 4.858 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 4 . 1014 . 1 1 14 LYS HG3 H -0.050 7.960 3.574 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 4 . 1015 . 1 1 14 LYS HZ1 H -1.057 8.348 -0.131 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 4 . 1016 . 1 1 14 LYS HZ2 H 0.290 8.786 0.716 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 4 . 1017 . 1 1 14 LYS HZ3 H -0.716 7.619 1.300 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 4 . 1018 . 1 1 14 LYS N N -2.790 6.576 2.364 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 4 . 1019 . 1 1 14 LYS NZ N -0.696 8.524 0.815 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 4 . 1020 . 1 1 14 LYS O O -3.700 5.833 5.697 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 4 . 1021 . 1 1 15 GLY C C -3.554 1.768 4.279 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 4 . 1022 . 1 1 15 GLY CA C -3.768 3.109 4.982 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 4 . 1023 . 1 1 15 GLY H H -2.828 4.104 3.244 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 4 . 1024 . 1 1 15 GLY HA2 H -3.335 3.060 6.000 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 4 . 1025 . 1 1 15 GLY HA3 H -4.850 3.300 5.115 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 4 . 1026 . 1 1 15 GLY N N -3.150 4.207 4.214 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 4 . 1027 . 1 1 15 GLY O O -2.423 1.231 4.311 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 4 . 1028 . 1 1 15 GLY OXT O -4.524 1.236 3.697 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 5 . 1029 . 1 1 1 CYS C C -3.391 -7.322 2.024 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 5 . 1030 . 1 1 1 CYS CA C -4.532 -7.068 1.003 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 5 . 1031 . 1 1 1 CYS CB C -5.586 -6.062 1.505 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 5 . 1032 . 1 1 1 CYS H1 H -5.930 -8.209 -0.046 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 5 . 1033 . 1 1 1 CYS H2 H -4.524 -9.020 0.260 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 5 . 1034 . 1 1 1 CYS H3 H -5.622 -8.784 1.471 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 5 . 1035 . 1 1 1 CYS HA H -4.113 -6.655 0.066 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 5 . 1036 . 1 1 1 CYS HB2 H -5.111 -5.093 1.741 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1037 . 1 1 1 CYS HB3 H -6.331 -5.846 0.716 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1038 . 1 1 1 CYS HG H -7.227 -5.594 3.152 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 5 . 1039 . 1 1 1 CYS N N -5.189 -8.344 0.651 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 5 . 1040 . 1 1 1 CYS O O -3.644 -7.750 3.156 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 5 . 1041 . 1 1 1 CYS SG S -6.458 -6.668 2.991 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 5 . 1042 . 1 1 2 ARG C C 0.271 -6.471 2.255 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 5 . 1043 . 1 1 2 ARG CA C -0.926 -7.459 2.399 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 5 . 1044 . 1 1 2 ARG CB C -0.630 -9.014 2.378 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 5 . 1045 . 1 1 2 ARG CD C 0.536 -9.423 0.057 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 5 . 1046 . 1 1 2 ARG CG C -0.606 -9.780 1.027 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 5 . 1047 . 1 1 2 ARG CZ C 1.244 -10.001 -2.276 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 5 . 1048 . 1 1 2 ARG H H -2.053 -6.732 0.643 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 5 . 1049 . 1 1 2 ARG HA H -1.172 -7.222 3.437 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 5 . 1050 . 1 1 2 ARG HB2 H 0.318 -9.207 2.919 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1051 . 1 1 2 ARG HB3 H -1.377 -9.506 3.018 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1052 . 1 1 2 ARG HD2 H 0.501 -8.345 -0.179 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 5 . 1053 . 1 1 2 ARG HD3 H 1.514 -9.598 0.541 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 5 . 1054 . 1 1 2 ARG HE H -0.231 -10.960 -1.317 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 5 . 1055 . 1 1 2 ARG HG2 H -0.543 -10.861 1.256 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1056 . 1 1 2 ARG HG3 H -1.580 -9.646 0.520 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1057 . 1 1 2 ARG HH11 H 2.330 -8.498 -1.494 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 5 . 1058 . 1 1 2 ARG HH12 H 2.735 -9.020 -3.206 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 5 . 1059 . 1 1 2 ARG HH21 H 0.317 -11.471 -3.270 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 5 . 1060 . 1 1 2 ARG HH22 H 1.671 -10.591 -4.140 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 5 . 1061 . 1 1 2 ARG N N -2.129 -7.086 1.603 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 5 . 1062 . 1 1 2 ARG NE N 0.455 -10.206 -1.200 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 5 . 1063 . 1 1 2 ARG NH1 N 2.201 -9.076 -2.332 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 5 . 1064 . 1 1 2 ARG NH2 N 1.058 -10.764 -3.336 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 5 . 1065 . 1 1 2 ARG O O 0.124 -5.262 2.449 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 5 . 1066 . 1 1 3 ALA C C 3.027 -5.220 1.004 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 5 . 1067 . 1 1 3 ALA CA C 2.759 -6.341 2.036 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 5 . 1068 . 1 1 3 ALA CB C 3.707 -7.523 1.728 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 5 . 1069 . 1 1 3 ALA H H 1.412 -8.044 1.887 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 5 . 1070 . 1 1 3 ALA HA H 2.940 -5.974 3.063 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 5 . 1071 . 1 1 3 ALA HB1 H 4.746 -7.171 1.642 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 5 . 1072 . 1 1 3 ALA HB2 H 3.630 -8.329 2.469 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1073 . 1 1 3 ALA HB3 H 3.459 -7.970 0.734 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1074 . 1 1 3 ALA N N 1.457 -7.026 2.005 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 5 . 1075 . 1 1 3 ALA O O 3.256 -4.066 1.375 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 5 . 1076 . 1 1 4 LEU C C 1.974 -3.708 -1.639 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 5 . 1077 . 1 1 4 LEU CA C 3.154 -4.674 -1.427 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 5 . 1078 . 1 1 4 LEU CB C 3.473 -5.528 -2.699 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 5 . 1079 . 1 1 4 LEU CD1 C 3.624 -3.834 -4.675 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 5 . 1080 . 1 1 4 LEU CD2 C 5.621 -4.284 -3.184 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 5 . 1081 . 1 1 4 LEU CG C 4.347 -4.876 -3.801 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 5 . 1082 . 1 1 4 LEU H H 2.499 -6.508 -0.381 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 5 . 1083 . 1 1 4 LEU HA H 4.024 -4.036 -1.155 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 5 . 1084 . 1 1 4 LEU HB2 H 4.020 -6.446 -2.401 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1085 . 1 1 4 LEU HB3 H 2.538 -5.922 -3.144 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1086 . 1 1 4 LEU HD11 H 2.680 -4.228 -5.089 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 5 . 1087 . 1 1 4 LEU HD12 H 3.381 -2.916 -4.113 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 5 . 1088 . 1 1 4 LEU HD13 H 4.252 -3.520 -5.530 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 5 . 1089 . 1 1 4 LEU HD21 H 6.058 -4.981 -2.443 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 5 . 1090 . 1 1 4 LEU HD22 H 6.374 -4.056 -3.949 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 5 . 1091 . 1 1 4 LEU HD23 H 5.393 -3.347 -2.641 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 5 . 1092 . 1 1 4 LEU HG H 4.657 -5.692 -4.480 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 5 . 1093 . 1 1 4 LEU N N 2.965 -5.597 -0.284 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 5 . 1094 . 1 1 4 LEU O O 2.193 -2.543 -1.959 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 5 . 1095 . 1 1 5 ILE C C -0.192 -2.274 -0.014 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 5 . 1096 . 1 1 5 ILE CA C -0.447 -3.398 -1.083 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 5 . 1097 . 1 1 5 ILE CB C -1.592 -4.410 -0.711 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 5 . 1098 . 1 1 5 ILE CD1 C -1.133 -6.785 -1.767 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 5 . 1099 . 1 1 5 ILE CG1 C -1.910 -5.453 -1.850 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 5 . 1100 . 1 1 5 ILE CG2 C -2.898 -3.647 -0.343 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 5 . 1101 . 1 1 5 ILE H H 0.785 -5.159 -0.991 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 5 . 1102 . 1 1 5 ILE HA H -0.742 -2.917 -2.030 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 5 . 1103 . 1 1 5 ILE HB H -1.233 -4.974 0.184 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 5 . 1104 . 1 1 5 ILE HD11 H -1.438 -7.386 -0.898 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 5 . 1105 . 1 1 5 ILE HD12 H -1.293 -7.415 -2.658 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 5 . 1106 . 1 1 5 ILE HD13 H -0.038 -6.649 -1.681 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 5 . 1107 . 1 1 5 ILE HG12 H -2.990 -5.680 -1.895 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 5 . 1108 . 1 1 5 ILE HG13 H -1.692 -5.005 -2.835 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 5 . 1109 . 1 1 5 ILE HG21 H -3.727 -4.322 -0.074 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 5 . 1110 . 1 1 5 ILE HG22 H -2.762 -2.976 0.525 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 5 . 1111 . 1 1 5 ILE HG23 H -3.250 -3.005 -1.173 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 5 . 1112 . 1 1 5 ILE N N 0.755 -4.199 -1.362 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 5 . 1113 . 1 1 5 ILE O O -0.597 -1.148 -0.252 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 5 . 1114 . 1 1 6 LYS C C 2.043 -0.562 1.710 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 5 . 1115 . 1 1 6 LYS CA C 0.848 -1.485 2.108 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 5 . 1116 . 1 1 6 LYS CB C 0.830 -2.095 3.531 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 5 . 1117 . 1 1 6 LYS CD C -1.836 -2.429 3.303 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 5 . 1118 . 1 1 6 LYS CE C -3.102 -2.675 4.145 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 5 . 1119 . 1 1 6 LYS CG C -0.578 -2.199 4.200 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 5 . 1120 . 1 1 6 LYS H H 0.753 -3.517 1.236 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 5 . 1121 . 1 1 6 LYS HA H 0.020 -0.749 2.122 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 5 . 1122 . 1 1 6 LYS HB2 H 1.320 -3.088 3.528 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1123 . 1 1 6 LYS HB3 H 1.470 -1.490 4.201 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1124 . 1 1 6 LYS HD2 H -1.992 -1.557 2.625 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 5 . 1125 . 1 1 6 LYS HD3 H -1.673 -3.271 2.601 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 5 . 1126 . 1 1 6 LYS HE2 H -2.968 -3.561 4.793 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 5 . 1127 . 1 1 6 LYS HE3 H -3.285 -1.820 4.822 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 5 . 1128 . 1 1 6 LYS HG2 H -0.521 -2.994 4.968 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1129 . 1 1 6 LYS HG3 H -0.745 -1.268 4.775 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1130 . 1 1 6 LYS HZ1 H -5.133 -3.042 3.863 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 5 . 1131 . 1 1 6 LYS HZ2 H -4.478 -2.056 2.712 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 5 . 1132 . 1 1 6 LYS HZ3 H -4.181 -3.681 2.673 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 5 . 1133 . 1 1 6 LYS N N 0.456 -2.541 1.127 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 5 . 1134 . 1 1 6 LYS NZ N -4.291 -2.877 3.300 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 5 . 1135 . 1 1 6 LYS O O 2.024 0.605 2.099 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 5 . 1136 . 1 1 7 ARG C C 3.356 0.924 -0.747 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 5 . 1137 . 1 1 7 ARG CA C 4.029 -0.125 0.231 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 5 . 1138 . 1 1 7 ARG CB C 5.083 -0.976 -0.555 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 5 . 1139 . 1 1 7 ARG CD C 6.566 -1.707 1.460 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 5 . 1140 . 1 1 7 ARG CG C 5.862 -2.105 0.158 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 5 . 1141 . 1 1 7 ARG CZ C 6.844 -3.688 2.991 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 5 . 1142 . 1 1 7 ARG H H 3.053 -2.044 0.811 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 5 . 1143 . 1 1 7 ARG HA H 4.575 0.450 1.003 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 5 . 1144 . 1 1 7 ARG HB2 H 4.593 -1.450 -1.424 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1145 . 1 1 7 ARG HB3 H 5.813 -0.290 -1.010 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1146 . 1 1 7 ARG HD2 H 7.273 -0.888 1.245 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 5 . 1147 . 1 1 7 ARG HD3 H 5.827 -1.300 2.175 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 5 . 1148 . 1 1 7 ARG HE H 8.250 -3.092 1.691 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 5 . 1149 . 1 1 7 ARG HG2 H 5.173 -2.938 0.368 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1150 . 1 1 7 ARG HG3 H 6.601 -2.520 -0.554 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1151 . 1 1 7 ARG HH11 H 5.061 -2.792 3.241 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 5 . 1152 . 1 1 7 ARG HH12 H 5.404 -4.271 4.271 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 5 . 1153 . 1 1 7 ARG HH21 H 8.538 -4.752 2.930 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 5 . 1154 . 1 1 7 ARG HH22 H 7.240 -5.305 4.103 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 5 . 1155 . 1 1 7 ARG N N 3.052 -1.026 0.941 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 5 . 1156 . 1 1 7 ARG NE N 7.317 -2.851 2.040 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 5 . 1157 . 1 1 7 ARG NH1 N 5.645 -3.573 3.559 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 5 . 1158 . 1 1 7 ARG NH2 N 7.618 -4.683 3.379 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 5 . 1159 . 1 1 7 ARG O O 3.498 2.147 -0.590 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 5 . 1160 . 1 1 8 ILE C C 0.668 2.121 -1.813 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 5 . 1161 . 1 1 8 ILE CA C 1.696 1.254 -2.600 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 5 . 1162 . 1 1 8 ILE CB C 1.063 0.466 -3.806 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 5 . 1163 . 1 1 8 ILE CD1 C -1.377 -0.399 -3.317 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 5 . 1164 . 1 1 8 ILE CG1 C 0.142 -0.712 -3.391 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 5 . 1165 . 1 1 8 ILE CG2 C 2.141 0.013 -4.821 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 5 . 1166 . 1 1 8 ILE H H 2.508 -0.606 -1.730 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 5 . 1167 . 1 1 8 ILE HA H 2.382 1.975 -3.081 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 5 . 1168 . 1 1 8 ILE HB H 0.441 1.173 -4.380 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 5 . 1169 . 1 1 8 ILE HD11 H -1.950 -1.208 -2.824 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 5 . 1170 . 1 1 8 ILE HD12 H -1.594 0.499 -2.707 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 5 . 1171 . 1 1 8 ILE HD13 H -1.836 -0.218 -4.302 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 5 . 1172 . 1 1 8 ILE HG12 H 0.402 -1.629 -3.962 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 5 . 1173 . 1 1 8 ILE HG13 H 0.431 -1.004 -2.379 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 5 . 1174 . 1 1 8 ILE HG21 H 1.693 -0.484 -5.702 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 5 . 1175 . 1 1 8 ILE HG22 H 2.726 0.870 -5.204 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 5 . 1176 . 1 1 8 ILE HG23 H 2.860 -0.697 -4.373 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 5 . 1177 . 1 1 8 ILE N N 2.557 0.419 -1.712 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 5 . 1178 . 1 1 8 ILE O O 0.640 3.311 -2.090 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 5 . 1179 . 1 1 9 GLN C C -0.355 3.504 0.918 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 5 . 1180 . 1 1 9 GLN CA C -1.039 2.448 -0.003 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 5 . 1181 . 1 1 9 GLN CB C -2.041 1.632 0.861 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 5 . 1182 . 1 1 9 GLN CD C -4.103 0.037 0.903 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 5 . 1183 . 1 1 9 GLN CG C -3.053 0.789 0.066 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 5 . 1184 . 1 1 9 GLN H H 0.010 0.601 -0.662 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 5 . 1185 . 1 1 9 GLN HA H -1.620 3.010 -0.755 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 5 . 1186 . 1 1 9 GLN HB2 H -1.486 0.981 1.564 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1187 . 1 1 9 GLN HB3 H -2.621 2.322 1.507 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1188 . 1 1 9 GLN HE21 H -4.903 -0.689 -0.785 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 5 . 1189 . 1 1 9 GLN HE22 H -5.701 -1.168 0.797 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 5 . 1190 . 1 1 9 GLN HG2 H -3.565 1.405 -0.688 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1191 . 1 1 9 GLN HG3 H -2.472 0.082 -0.531 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1192 . 1 1 9 GLN N N -0.105 1.607 -0.826 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 5 . 1193 . 1 1 9 GLN NE2 N -4.982 -0.695 0.238 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 5 . 1194 . 1 1 9 GLN O O -0.854 4.620 1.058 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 5 . 1195 . 1 1 9 GLN OE1 O -4.154 0.100 2.132 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 5 . 1196 . 1 1 10 ALA C C 2.011 5.452 1.079 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 5 . 1197 . 1 1 10 ALA CA C 1.758 4.222 2.027 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 5 . 1198 . 1 1 10 ALA CB C 3.081 3.548 2.449 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 5 . 1199 . 1 1 10 ALA H H 1.052 2.198 1.298 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 5 . 1200 . 1 1 10 ALA HA H 1.289 4.616 2.949 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 5 . 1201 . 1 1 10 ALA HB1 H 2.921 2.740 3.186 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 5 . 1202 . 1 1 10 ALA HB2 H 3.618 3.093 1.598 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1203 . 1 1 10 ALA HB3 H 3.783 4.265 2.909 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1204 . 1 1 10 ALA N N 0.825 3.189 1.471 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 5 . 1205 . 1 1 10 ALA O O 1.911 6.591 1.542 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 5 . 1206 . 1 1 11 MET C C 0.649 6.810 -1.677 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 5 . 1207 . 1 1 11 MET CA C 2.108 6.300 -1.275 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 5 . 1208 . 1 1 11 MET CB C 2.856 5.856 -2.571 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 5 . 1209 . 1 1 11 MET CE C 6.939 6.246 -1.775 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 5 . 1210 . 1 1 11 MET CG C 4.349 5.502 -2.434 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 5 . 1211 . 1 1 11 MET H H 2.458 4.237 -0.476 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 5 . 1212 . 1 1 11 MET HA H 2.650 7.189 -0.898 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 5 . 1213 . 1 1 11 MET HB2 H 2.339 4.990 -3.024 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1214 . 1 1 11 MET HB3 H 2.777 6.656 -3.331 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1215 . 1 1 11 MET HE1 H 7.667 7.019 -1.469 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 5 . 1216 . 1 1 11 MET HE2 H 7.278 5.818 -2.736 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 5 . 1217 . 1 1 11 MET HE3 H 6.951 5.444 -1.014 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 5 . 1218 . 1 1 11 MET HG2 H 4.498 4.687 -1.699 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1219 . 1 1 11 MET HG3 H 4.730 5.127 -3.402 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1220 . 1 1 11 MET N N 2.234 5.224 -0.235 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 5 . 1221 . 1 1 11 MET O O 0.447 8.018 -1.821 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 5 . 1222 . 1 1 11 MET SD S 5.291 6.959 -1.933 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 5 . 1223 . 1 1 12 ILE C C -2.782 6.851 -1.637 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 5 . 1224 . 1 1 12 ILE CA C -1.666 6.170 -2.526 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 5 . 1225 . 1 1 12 ILE CB C -1.923 4.924 -3.496 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 5 . 1226 . 1 1 12 ILE CD1 C -0.378 3.667 -5.189 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 5 . 1227 . 1 1 12 ILE CG1 C -1.014 4.997 -4.782 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 5 . 1228 . 1 1 12 ILE CG2 C -3.350 4.548 -3.978 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 5 . 1229 . 1 1 12 ILE H H 0.001 4.926 -1.775 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 5 . 1230 . 1 1 12 ILE HA H -1.544 6.966 -3.239 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 5 . 1231 . 1 1 12 ILE HB H -1.627 4.037 -2.905 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 5 . 1232 . 1 1 12 ILE HD11 H 0.065 3.722 -6.197 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 5 . 1233 . 1 1 12 ILE HD12 H 0.444 3.408 -4.501 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 5 . 1234 . 1 1 12 ILE HD13 H -1.104 2.833 -5.174 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 5 . 1235 . 1 1 12 ILE HG12 H -1.573 5.418 -5.641 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 5 . 1236 . 1 1 12 ILE HG13 H -0.180 5.712 -4.645 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 5 . 1237 . 1 1 12 ILE HG21 H -4.100 4.468 -3.178 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 5 . 1238 . 1 1 12 ILE HG22 H -3.746 5.246 -4.729 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 5 . 1239 . 1 1 12 ILE HG23 H -3.334 3.538 -4.441 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 5 . 1240 . 1 1 12 ILE N N -0.311 5.892 -1.925 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 5 . 1241 . 1 1 12 ILE O O -3.068 8.024 -1.904 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 5 . 1242 . 1 1 13 PRO C C -4.027 6.970 1.914 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 5 . 1243 . 1 1 13 PRO CA C -4.315 6.949 0.365 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 5 . 1244 . 1 1 13 PRO CB C -5.583 6.146 0.017 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 5 . 1245 . 1 1 13 PRO CD C -3.598 4.838 -0.496 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 5 . 1246 . 1 1 13 PRO CG C -5.115 4.728 -0.338 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 5 . 1247 . 1 1 13 PRO HA H -4.469 8.002 0.069 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 5 . 1248 . 1 1 13 PRO HB2 H -6.355 6.153 0.810 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1249 . 1 1 13 PRO HB3 H -6.045 6.611 -0.874 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1250 . 1 1 13 PRO HD2 H -3.074 4.421 0.359 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 5 . 1251 . 1 1 13 PRO HD3 H -3.210 4.293 -1.359 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 5 . 1252 . 1 1 13 PRO HG2 H -5.383 3.992 0.442 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1253 . 1 1 13 PRO HG3 H -5.573 4.398 -1.288 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1254 . 1 1 13 PRO N N -3.316 6.270 -0.527 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 5 . 1255 . 1 1 13 PRO O O -4.857 7.484 2.668 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 5 . 1256 . 1 1 14 LYS C C -3.138 5.237 4.570 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 5 . 1257 . 1 1 14 LYS CA C -2.425 6.383 3.785 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 5 . 1258 . 1 1 14 LYS CB C -2.276 7.755 4.523 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 5 . 1259 . 1 1 14 LYS CD C -1.160 9.773 3.162 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 5 . 1260 . 1 1 14 LYS CE C -1.531 9.498 1.687 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 5 . 1261 . 1 1 14 LYS CG C -1.015 8.592 4.158 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 5 . 1262 . 1 1 14 LYS H H -2.269 6.089 1.607 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 5 . 1263 . 1 1 14 LYS HA H -1.385 6.009 3.705 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 5 . 1264 . 1 1 14 LYS HB2 H -3.194 8.365 4.438 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 5 . 1265 . 1 1 14 LYS HB3 H -2.203 7.539 5.607 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 5 . 1266 . 1 1 14 LYS HD2 H -1.895 10.490 3.573 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 5 . 1267 . 1 1 14 LYS HD3 H -0.205 10.331 3.169 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 5 . 1268 . 1 1 14 LYS HE2 H -2.585 9.187 1.614 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 5 . 1269 . 1 1 14 LYS HE3 H -1.487 10.444 1.117 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 5 . 1270 . 1 1 14 LYS HG2 H -0.636 9.032 5.100 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 5 . 1271 . 1 1 14 LYS HG3 H -0.189 7.931 3.834 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 5 . 1272 . 1 1 14 LYS HZ1 H -0.956 8.357 0.034 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 5 . 1273 . 1 1 14 LYS HZ2 H 0.315 8.773 1.000 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 5 . 1274 . 1 1 14 LYS HZ3 H -0.729 7.581 1.463 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 5 . 1275 . 1 1 14 LYS N N -2.860 6.452 2.363 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 5 . 1276 . 1 1 14 LYS NZ N -0.674 8.502 1.011 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 5 . 1277 . 1 1 14 LYS O O -2.498 4.219 4.855 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 5 . 1278 . 1 1 15 GLY C C -5.784 3.336 4.337 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 5 . 1279 . 1 1 15 GLY CA C -5.254 4.268 5.437 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 5 . 1280 . 1 1 15 GLY H H -4.872 6.254 4.566 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 5 . 1281 . 1 1 15 GLY HA2 H -4.680 3.690 6.187 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 5 . 1282 . 1 1 15 GLY HA3 H -6.107 4.697 5.993 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 5 . 1283 . 1 1 15 GLY N N -4.445 5.374 4.877 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 5 . 1284 . 1 1 15 GLY O O -5.123 2.315 4.040 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 5 . 1285 . 1 1 15 GLY OXT O -6.857 3.623 3.762 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 6 . 1286 . 1 1 1 CYS C C -3.813 -7.464 1.489 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 6 . 1287 . 1 1 1 CYS CA C -4.878 -7.118 0.417 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 6 . 1288 . 1 1 1 CYS CB C -6.052 -6.280 0.969 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 6 . 1289 . 1 1 1 CYS H1 H -4.661 -8.936 -0.588 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 6 . 1290 . 1 1 1 CYS H2 H -5.865 -8.952 0.543 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 6 . 1291 . 1 1 1 CYS H3 H -6.099 -8.183 -0.899 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 6 . 1292 . 1 1 1 CYS HA H -4.419 -6.546 -0.410 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 6 . 1293 . 1 1 1 CYS HB2 H -6.793 -6.073 0.174 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1294 . 1 1 1 CYS HB3 H -6.597 -6.814 1.772 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1295 . 1 1 1 CYS HG H -4.951 -5.150 2.751 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 6 . 1296 . 1 1 1 CYS N N -5.406 -8.370 -0.166 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 6 . 1297 . 1 1 1 CYS O O -4.151 -7.985 2.559 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 6 . 1298 . 1 1 1 CYS SG S -5.464 -4.680 1.617 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 6 . 1299 . 1 1 2 ARG C C -0.174 -6.650 2.118 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 6 . 1300 . 1 1 2 ARG CA C -1.383 -7.632 2.034 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 6 . 1301 . 1 1 2 ARG CB C -1.121 -9.191 1.978 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 6 . 1302 . 1 1 2 ARG CD C 0.361 -9.624 -0.135 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 6 . 1303 . 1 1 2 ARG CG C -0.958 -9.900 0.607 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 6 . 1304 . 1 1 2 ARG CZ C 1.540 -10.431 -2.193 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 6 . 1305 . 1 1 2 ARG H H -2.379 -6.761 0.266 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 6 . 1306 . 1 1 2 ARG HA H -1.709 -7.464 3.062 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 6 . 1307 . 1 1 2 ARG HB2 H -0.249 -9.431 2.619 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1308 . 1 1 2 ARG HB3 H -1.956 -9.688 2.499 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1309 . 1 1 2 ARG HD2 H 0.459 -8.545 -0.347 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 6 . 1310 . 1 1 2 ARG HD3 H 1.216 -9.887 0.515 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 6 . 1311 . 1 1 2 ARG HE H -0.372 -10.874 -1.790 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 6 . 1312 . 1 1 2 ARG HG2 H -1.035 -10.989 0.785 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1313 . 1 1 2 ARG HG3 H -1.820 -9.653 -0.040 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1314 . 1 1 2 ARG HH11 H 2.737 -9.339 -1.000 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 6 . 1315 . 1 1 2 ARG HH12 H 3.465 -9.972 -2.560 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 6 . 1316 . 1 1 2 ARG HH21 H 0.561 -11.543 -3.539 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 6 . 1317 . 1 1 2 ARG HH22 H 2.313 -11.136 -3.899 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 6 . 1318 . 1 1 2 ARG N N -2.524 -7.198 1.182 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 6 . 1319 . 1 1 2 ARG NE N 0.440 -10.372 -1.414 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 6 . 1320 . 1 1 2 ARG NH1 N 2.700 -9.853 -1.887 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 6 . 1321 . 1 1 2 ARG NH2 N 1.463 -11.104 -3.325 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 6 . 1322 . 1 1 2 ARG O O -0.331 -5.461 2.398 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 6 . 1323 . 1 1 3 ALA C C 2.834 -5.394 1.284 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 6 . 1324 . 1 1 3 ALA CA C 2.326 -6.555 2.184 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 6 . 1325 . 1 1 3 ALA CB C 3.214 -7.807 1.993 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 6 . 1326 . 1 1 3 ALA H H 0.978 -8.202 1.728 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 6 . 1327 . 1 1 3 ALA HA H 2.357 -6.232 3.243 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 6 . 1328 . 1 1 3 ALA HB1 H 2.945 -8.632 2.679 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 6 . 1329 . 1 1 3 ALA HB2 H 3.109 -8.213 0.958 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1330 . 1 1 3 ALA HB3 H 4.276 -7.560 2.122 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1331 . 1 1 3 ALA N N 1.023 -7.200 1.944 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 6 . 1332 . 1 1 3 ALA O O 3.012 -4.266 1.762 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 6 . 1333 . 1 1 4 LEU C C 2.013 -3.737 -1.321 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 6 . 1334 . 1 1 4 LEU CA C 3.259 -4.615 -1.038 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 6 . 1335 . 1 1 4 LEU CB C 3.994 -5.176 -2.281 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 6 . 1336 . 1 1 4 LEU CD1 C 4.119 -5.090 -4.817 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 6 . 1337 . 1 1 4 LEU CD2 C 2.433 -6.637 -3.632 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 6 . 1338 . 1 1 4 LEU CG C 3.203 -5.313 -3.612 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 6 . 1339 . 1 1 4 LEU H H 2.607 -6.563 -0.300 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 6 . 1340 . 1 1 4 LEU HA H 4.001 -3.926 -0.592 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 6 . 1341 . 1 1 4 LEU HB2 H 4.831 -4.486 -2.431 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1342 . 1 1 4 LEU HB3 H 4.525 -6.122 -2.051 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1343 . 1 1 4 LEU HD11 H 4.563 -4.075 -4.767 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 6 . 1344 . 1 1 4 LEU HD12 H 4.948 -5.817 -4.843 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 6 . 1345 . 1 1 4 LEU HD13 H 3.554 -5.143 -5.762 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 6 . 1346 . 1 1 4 LEU HD21 H 3.114 -7.506 -3.637 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 6 . 1347 . 1 1 4 LEU HD22 H 1.802 -6.729 -2.728 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 6 . 1348 . 1 1 4 LEU HD23 H 1.760 -6.704 -4.503 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 6 . 1349 . 1 1 4 LEU HG H 2.455 -4.506 -3.704 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 6 . 1350 . 1 1 4 LEU N N 3.007 -5.664 -0.023 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 6 . 1351 . 1 1 4 LEU O O 2.178 -2.572 -1.660 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 6 . 1352 . 1 1 5 ILE C C -0.377 -2.449 0.041 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 6 . 1353 . 1 1 5 ILE CA C -0.470 -3.550 -1.075 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 6 . 1354 . 1 1 5 ILE CB C -1.668 -4.545 -0.912 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 6 . 1355 . 1 1 5 ILE CD1 C -1.105 -6.886 -1.957 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 6 . 1356 . 1 1 5 ILE CG1 C -1.821 -5.534 -2.126 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 6 . 1357 . 1 1 5 ILE CG2 C -3.002 -3.762 -0.715 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 6 . 1358 . 1 1 5 ILE H H 0.821 -5.283 -0.890 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 6 . 1359 . 1 1 5 ILE HA H -0.647 -3.051 -2.041 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 6 . 1360 . 1 1 5 ILE HB H -1.447 -5.139 0.002 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 6 . 1361 . 1 1 5 ILE HD11 H -0.993 -7.420 -2.917 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 6 . 1362 . 1 1 5 ILE HD12 H -0.090 -6.774 -1.538 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 6 . 1363 . 1 1 5 ILE HD13 H -1.649 -7.562 -1.278 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 6 . 1364 . 1 1 5 ILE HG12 H -2.884 -5.724 -2.363 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 6 . 1365 . 1 1 5 ILE HG13 H -1.423 -5.064 -3.042 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 6 . 1366 . 1 1 5 ILE HG21 H -3.887 -4.414 -0.657 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 6 . 1367 . 1 1 5 ILE HG22 H -2.998 -3.174 0.221 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 6 . 1368 . 1 1 5 ILE HG23 H -3.184 -3.037 -1.531 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 6 . 1369 . 1 1 5 ILE N N 0.794 -4.308 -1.212 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 6 . 1370 . 1 1 5 ILE O O -0.742 -1.316 -0.235 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 6 . 1371 . 1 1 6 LYS C C 1.645 -0.737 1.949 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 6 . 1372 . 1 1 6 LYS CA C 0.437 -1.678 2.256 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 6 . 1373 . 1 1 6 LYS CB C 0.330 -2.252 3.689 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 6 . 1374 . 1 1 6 LYS CD C -2.354 -2.241 3.383 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 6 . 1375 . 1 1 6 LYS CE C -3.690 -2.624 4.053 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 6 . 1376 . 1 1 6 LYS CG C -1.087 -2.707 4.172 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 6 . 1377 . 1 1 6 LYS H H 0.430 -3.707 1.377 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 6 . 1378 . 1 1 6 LYS HA H -0.397 -0.954 2.199 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 6 . 1379 . 1 1 6 LYS HB2 H 1.047 -3.087 3.812 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1380 . 1 1 6 LYS HB3 H 0.700 -1.493 4.399 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1381 . 1 1 6 LYS HD2 H -2.333 -1.152 3.163 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 6 . 1382 . 1 1 6 LYS HD3 H -2.337 -2.686 2.365 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 6 . 1383 . 1 1 6 LYS HE2 H -4.517 -2.485 3.334 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 6 . 1384 . 1 1 6 LYS HE3 H -3.699 -3.699 4.313 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 6 . 1385 . 1 1 6 LYS HG2 H -1.101 -3.811 4.210 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1386 . 1 1 6 LYS HG3 H -1.187 -2.405 5.232 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1387 . 1 1 6 LYS HZ1 H -4.024 -0.818 5.038 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 6 . 1388 . 1 1 6 LYS HZ2 H -4.881 -2.077 5.679 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 6 . 1389 . 1 1 6 LYS HZ3 H -3.261 -1.940 5.977 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 6 . 1390 . 1 1 6 LYS N N 0.142 -2.732 1.246 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 6 . 1391 . 1 1 6 LYS NZ N -3.981 -1.820 5.257 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 6 . 1392 . 1 1 6 LYS O O 1.574 0.423 2.350 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 6 . 1393 . 1 1 7 ARG C C 3.119 0.751 -0.478 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 6 . 1394 . 1 1 7 ARG CA C 3.709 -0.226 0.627 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 6 . 1395 . 1 1 7 ARG CB C 4.900 -1.056 0.073 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 6 . 1396 . 1 1 7 ARG CD C 6.963 -0.642 1.466 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 6 . 1397 . 1 1 7 ARG CG C 6.274 -0.364 0.126 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 6 . 1398 . 1 1 7 ARG CZ C 9.039 0.067 2.678 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 6 . 1399 . 1 1 7 ARG H H 2.791 -2.191 1.141 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 6 . 1400 . 1 1 7 ARG HA H 4.093 0.406 1.452 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 6 . 1401 . 1 1 7 ARG HB2 H 4.977 -2.053 0.552 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1402 . 1 1 7 ARG HB3 H 4.697 -1.291 -0.974 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1403 . 1 1 7 ARG HD2 H 6.272 -0.370 2.286 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 6 . 1404 . 1 1 7 ARG HD3 H 7.134 -1.734 1.543 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 6 . 1405 . 1 1 7 ARG HE H 8.595 0.687 0.826 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 6 . 1406 . 1 1 7 ARG HG2 H 6.905 -0.753 -0.695 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1407 . 1 1 7 ARG HG3 H 6.165 0.722 -0.061 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1408 . 1 1 7 ARG HH11 H 7.897 -1.176 3.772 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 6 . 1409 . 1 1 7 ARG HH12 H 9.450 -0.575 4.541 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 6 . 1410 . 1 1 7 ARG HH21 H 10.338 1.309 1.798 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 6 . 1411 . 1 1 7 ARG HH22 H 10.738 0.739 3.495 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 6 . 1412 . 1 1 7 ARG N N 2.716 -1.169 1.246 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 6 . 1413 . 1 1 7 ARG NE N 8.245 0.097 1.589 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 6 . 1414 . 1 1 7 ARG NH1 N 8.768 -0.634 3.778 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 6 . 1415 . 1 1 7 ARG NH2 N 10.151 0.777 2.654 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 6 . 1416 . 1 1 7 ARG O O 3.252 1.977 -0.366 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 6 . 1417 . 1 1 8 ILE C C 0.559 1.955 -1.748 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 6 . 1418 . 1 1 8 ILE CA C 1.606 1.044 -2.469 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 6 . 1419 . 1 1 8 ILE CB C 1.015 0.271 -3.712 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 6 . 1420 . 1 1 8 ILE CD1 C -1.533 -0.339 -3.271 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 6 . 1421 . 1 1 8 ILE CG1 C -0.055 -0.800 -3.376 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 6 . 1422 . 1 1 8 ILE CG2 C 2.138 -0.338 -4.591 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 6 . 1423 . 1 1 8 ILE H H 2.516 -0.800 -1.636 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 6 . 1424 . 1 1 8 ILE HA H 2.324 1.742 -2.933 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 6 . 1425 . 1 1 8 ILE HB H 0.527 1.011 -4.369 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 6 . 1426 . 1 1 8 ILE HD11 H -2.160 -1.099 -2.765 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 6 . 1427 . 1 1 8 ILE HD12 H -1.672 0.579 -2.674 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 6 . 1428 . 1 1 8 ILE HD13 H -1.992 -0.128 -4.249 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 6 . 1429 . 1 1 8 ILE HG12 H 0.026 -1.670 -4.057 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 6 . 1430 . 1 1 8 ILE HG13 H 0.242 -1.214 -2.410 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 6 . 1431 . 1 1 8 ILE HG21 H 1.736 -0.773 -5.525 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 6 . 1432 . 1 1 8 ILE HG22 H 2.880 0.425 -4.893 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 6 . 1433 . 1 1 8 ILE HG23 H 2.689 -1.141 -4.067 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 6 . 1434 . 1 1 8 ILE N N 2.428 0.220 -1.520 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 6 . 1435 . 1 1 8 ILE O O 0.528 3.130 -2.080 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 6 . 1436 . 1 1 9 GLN C C -0.513 3.379 0.971 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 6 . 1437 . 1 1 9 GLN CA C -1.185 2.343 0.016 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 6 . 1438 . 1 1 9 GLN CB C -2.280 1.551 0.784 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 6 . 1439 . 1 1 9 GLN CD C -4.381 0.030 0.596 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 6 . 1440 . 1 1 9 GLN CG C -3.207 0.710 -0.116 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 6 . 1441 . 1 1 9 GLN H H -0.108 0.481 -0.546 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 6 . 1442 . 1 1 9 GLN HA H -1.705 2.933 -0.761 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 6 . 1443 . 1 1 9 GLN HB2 H -1.812 0.900 1.548 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1444 . 1 1 9 GLN HB3 H -2.908 2.262 1.356 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1445 . 1 1 9 GLN HE21 H -5.598 1.518 0.049 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 6 . 1446 . 1 1 9 GLN HE22 H -6.329 0.166 1.053 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 6 . 1447 . 1 1 9 GLN HG2 H -3.564 1.283 -0.985 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1448 . 1 1 9 GLN HG3 H -2.580 -0.058 -0.572 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1449 . 1 1 9 GLN N N -0.228 1.479 -0.754 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 6 . 1450 . 1 1 9 GLN NE2 N -5.553 0.643 0.580 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 6 . 1451 . 1 1 9 GLN O O -0.993 4.505 1.103 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 6 . 1452 . 1 1 9 GLN OE1 O -4.255 -1.061 1.145 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 6 . 1453 . 1 1 10 ALA C C 1.903 5.270 1.173 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 6 . 1454 . 1 1 10 ALA CA C 1.590 4.056 2.126 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 6 . 1455 . 1 1 10 ALA CB C 2.886 3.344 2.579 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 6 . 1456 . 1 1 10 ALA H H 0.860 2.050 1.383 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 6 . 1457 . 1 1 10 ALA HA H 1.109 4.478 3.030 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 6 . 1458 . 1 1 10 ALA HB1 H 2.690 2.497 3.263 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 6 . 1459 . 1 1 10 ALA HB2 H 3.465 2.925 1.739 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1460 . 1 1 10 ALA HB3 H 3.577 4.026 3.101 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1461 . 1 1 10 ALA N N 0.643 3.041 1.560 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 6 . 1462 . 1 1 10 ALA O O 1.837 6.416 1.626 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 6 . 1463 . 1 1 11 MET C C 0.655 6.644 -1.616 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 6 . 1464 . 1 1 11 MET CA C 2.085 6.090 -1.188 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 6 . 1465 . 1 1 11 MET CB C 2.836 5.604 -2.467 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 6 . 1466 . 1 1 11 MET CE C 6.911 5.754 -1.557 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 6 . 1467 . 1 1 11 MET CG C 4.303 5.168 -2.301 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 6 . 1468 . 1 1 11 MET H H 2.298 4.025 -0.368 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 6 . 1469 . 1 1 11 MET HA H 2.654 6.961 -0.809 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 6 . 1470 . 1 1 11 MET HB2 H 2.283 4.767 -2.932 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1471 . 1 1 11 MET HB3 H 2.816 6.407 -3.229 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1472 . 1 1 11 MET HE1 H 6.848 4.956 -0.795 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 6 . 1473 . 1 1 11 MET HE2 H 7.674 6.482 -1.229 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 6 . 1474 . 1 1 11 MET HE3 H 7.254 5.302 -2.505 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 6 . 1475 . 1 1 11 MET HG2 H 4.391 4.342 -1.568 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1476 . 1 1 11 MET HG3 H 4.682 4.775 -3.263 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1477 . 1 1 11 MET N N 2.142 5.024 -0.135 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 6 . 1478 . 1 1 11 MET O O 0.506 7.855 -1.796 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 6 . 1479 . 1 1 11 MET SD S 5.315 6.566 -1.772 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 6 . 1480 . 1 1 12 ILE C C -2.764 6.801 -1.594 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 6 . 1481 . 1 1 12 ILE CA C -1.669 6.085 -2.484 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 6 . 1482 . 1 1 12 ILE CB C -1.961 4.863 -3.469 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 6 . 1483 . 1 1 12 ILE CD1 C -0.451 3.534 -5.148 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 6 . 1484 . 1 1 12 ILE CG1 C -1.018 4.895 -4.734 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 6 . 1485 . 1 1 12 ILE CG2 C -3.397 4.595 -3.988 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 6 . 1486 . 1 1 12 ILE H H -0.066 4.783 -1.691 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 6 . 1487 . 1 1 12 ILE HA H -1.512 6.883 -3.189 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 6 . 1488 . 1 1 12 ILE HB H -1.728 3.957 -2.880 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 6 . 1489 . 1 1 12 ILE HD11 H 0.367 3.236 -4.472 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 6 . 1490 . 1 1 12 ILE HD12 H -1.212 2.734 -5.127 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 6 . 1491 . 1 1 12 ILE HD13 H -0.015 3.572 -6.160 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 6 . 1492 . 1 1 12 ILE HG12 H -1.532 5.358 -5.599 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 6 . 1493 . 1 1 12 ILE HG13 H -0.149 5.559 -4.570 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 6 . 1494 . 1 1 12 ILE HG21 H -4.163 4.545 -3.201 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 6 . 1495 . 1 1 12 ILE HG22 H -3.730 5.345 -4.722 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 6 . 1496 . 1 1 12 ILE HG23 H -3.438 3.604 -4.486 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 6 . 1497 . 1 1 12 ILE N N -0.336 5.758 -1.863 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 6 . 1498 . 1 1 12 ILE O O -3.001 7.988 -1.847 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 6 . 1499 . 1 1 13 PRO C C -4.010 6.933 1.957 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 6 . 1500 . 1 1 13 PRO CA C -4.297 6.937 0.408 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 6 . 1501 . 1 1 13 PRO CB C -5.600 6.204 0.034 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 6 . 1502 . 1 1 13 PRO CD C -3.679 4.810 -0.491 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 6 . 1503 . 1 1 13 PRO CG C -5.201 4.773 -0.350 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 6 . 1504 . 1 1 13 PRO HA H -4.395 7.998 0.138 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 6 . 1505 . 1 1 13 PRO HB2 H -6.378 6.233 0.820 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1506 . 1 1 13 PRO HB3 H -6.033 6.710 -0.851 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1507 . 1 1 13 PRO HD2 H -3.189 4.355 0.364 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 6 . 1508 . 1 1 13 PRO HD3 H -3.310 4.259 -1.360 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 6 . 1509 . 1 1 13 PRO HG2 H -5.514 4.034 0.411 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1510 . 1 1 13 PRO HG3 H -5.666 4.487 -1.311 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1511 . 1 1 13 PRO N N -3.327 6.226 -0.492 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 6 . 1512 . 1 1 13 PRO O O -4.887 7.311 2.739 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 6 . 1513 . 1 1 14 LYS C C -3.204 5.416 4.641 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 6 . 1514 . 1 1 14 LYS CA C -2.366 6.448 3.811 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 6 . 1515 . 1 1 14 LYS CB C -2.144 7.844 4.485 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 6 . 1516 . 1 1 14 LYS CD C -0.983 9.787 3.072 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 6 . 1517 . 1 1 14 LYS CE C -1.419 9.496 1.620 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 6 . 1518 . 1 1 14 LYS CG C -0.854 8.611 4.076 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 6 . 1519 . 1 1 14 LYS H H -2.173 6.221 1.630 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 6 . 1520 . 1 1 14 LYS HA H -1.357 5.992 3.772 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 6 . 1521 . 1 1 14 LYS HB2 H -3.039 8.486 4.378 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 6 . 1522 . 1 1 14 LYS HB3 H -2.067 7.680 5.577 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 6 . 1523 . 1 1 14 LYS HD2 H -1.673 10.539 3.497 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 6 . 1524 . 1 1 14 LYS HD3 H -0.005 10.303 3.035 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 6 . 1525 . 1 1 14 LYS HE2 H -2.482 9.200 1.594 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 6 . 1526 . 1 1 14 LYS HE3 H -1.376 10.428 1.028 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 6 . 1527 . 1 1 14 LYS HG2 H -0.421 9.040 4.999 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 6 . 1528 . 1 1 14 LYS HG3 H -0.075 7.905 3.730 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 6 . 1529 . 1 1 14 LYS HZ1 H -0.922 8.296 -0.019 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 6 . 1530 . 1 1 14 LYS HZ2 H 0.389 8.717 0.891 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 6 . 1531 . 1 1 14 LYS HZ3 H -0.658 7.561 1.424 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 6 . 1532 . 1 1 14 LYS N N -2.787 6.548 2.384 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 6 . 1533 . 1 1 14 LYS NZ N -0.604 8.467 0.943 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 6 . 1534 . 1 1 14 LYS O O -3.812 5.752 5.663 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 6 . 1535 . 1 1 15 GLY C C -3.435 1.690 4.295 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 6 . 1536 . 1 1 15 GLY CA C -3.824 3.034 4.914 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 6 . 1537 . 1 1 15 GLY H H -2.830 4.063 3.225 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 6 . 1538 . 1 1 15 GLY HA2 H -3.521 3.041 5.978 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 6 . 1539 . 1 1 15 GLY HA3 H -4.924 3.156 4.903 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 6 . 1540 . 1 1 15 GLY N N -3.188 4.148 4.185 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 6 . 1541 . 1 1 15 GLY O O -2.268 1.262 4.441 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 6 . 1542 . 1 1 15 GLY OXT O -4.303 1.046 3.667 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 7 . 1543 . 1 1 1 CYS C C -3.269 -7.230 2.328 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 7 . 1544 . 1 1 1 CYS CA C -4.517 -6.805 1.512 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 7 . 1545 . 1 1 1 CYS CB C -5.182 -5.550 2.112 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 7 . 1546 . 1 1 1 CYS H1 H -5.090 -8.753 1.023 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 7 . 1547 . 1 1 1 CYS H2 H -5.819 -8.179 2.389 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 7 . 1548 . 1 1 1 CYS H3 H -6.322 -7.659 0.905 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 7 . 1549 . 1 1 1 CYS HA H -4.229 -6.573 0.469 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 7 . 1550 . 1 1 1 CYS HB2 H -5.575 -5.737 3.130 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1551 . 1 1 1 CYS HB3 H -4.447 -4.729 2.211 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1552 . 1 1 1 CYS HG H -6.835 -3.891 1.756 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 7 . 1553 . 1 1 1 CYS N N -5.494 -7.914 1.453 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 7 . 1554 . 1 1 1 CYS O O -3.390 -7.635 3.491 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 7 . 1555 . 1 1 1 CYS SG S -6.537 -4.970 1.038 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 7 . 1556 . 1 1 2 ARG C C 0.393 -6.544 2.101 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 7 . 1557 . 1 1 2 ARG CA C -0.790 -7.517 2.370 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 7 . 1558 . 1 1 2 ARG CB C -0.522 -9.073 2.321 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 7 . 1559 . 1 1 2 ARG CD C 0.542 -9.512 -0.040 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 7 . 1560 . 1 1 2 ARG CG C -0.582 -9.825 0.965 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 7 . 1561 . 1 1 2 ARG CZ C 1.154 -10.127 -2.391 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 7 . 1562 . 1 1 2 ARG H H -2.102 -6.768 0.753 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 7 . 1563 . 1 1 2 ARG HA H -0.913 -7.274 3.428 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 7 . 1564 . 1 1 2 ARG HB2 H 0.453 -9.280 2.806 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1565 . 1 1 2 ARG HB3 H -1.238 -9.559 3.000 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1566 . 1 1 2 ARG HD2 H 0.544 -8.433 -0.276 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 7 . 1567 . 1 1 2 ARG HD3 H 1.527 -9.728 0.412 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 7 . 1568 . 1 1 2 ARG HE H -0.342 -11.008 -1.390 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 7 . 1569 . 1 1 2 ARG HG2 H -0.556 -10.909 1.185 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1570 . 1 1 2 ARG HG3 H -1.565 -9.644 0.494 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1571 . 1 1 2 ARG HH11 H 2.338 -8.684 -1.642 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 7 . 1572 . 1 1 2 ARG HH12 H 2.667 -9.224 -3.364 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 7 . 1573 . 1 1 2 ARG HH21 H 0.122 -11.544 -3.358 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 7 . 1574 . 1 1 2 ARG HH22 H 1.495 -10.736 -4.268 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 7 . 1575 . 1 1 2 ARG N N -2.070 -7.126 1.714 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 7 . 1576 . 1 1 2 ARG NE N 0.386 -10.291 -1.294 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 7 . 1577 . 1 1 2 ARG NH1 N 2.155 -9.253 -2.475 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 7 . 1578 . 1 1 2 ARG NH2 N 0.897 -10.877 -3.446 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 7 . 1579 . 1 1 2 ARG O O 0.247 -5.327 2.195 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 7 . 1580 . 1 1 3 ALA C C 3.089 -5.329 0.728 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 7 . 1581 . 1 1 3 ALA CA C 2.875 -6.419 1.807 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 7 . 1582 . 1 1 3 ALA CB C 3.802 -7.610 1.476 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 7 . 1583 . 1 1 3 ALA H H 1.537 -8.135 1.852 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 7 . 1584 . 1 1 3 ALA HA H 3.100 -6.008 2.810 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 7 . 1585 . 1 1 3 ALA HB1 H 4.833 -7.264 1.314 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 7 . 1586 . 1 1 3 ALA HB2 H 3.769 -8.397 2.241 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1587 . 1 1 3 ALA HB3 H 3.491 -8.084 0.511 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1588 . 1 1 3 ALA N N 1.577 -7.110 1.877 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 7 . 1589 . 1 1 3 ALA O O 3.378 -4.170 1.045 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 7 . 1590 . 1 1 4 LEU C C 1.904 -3.841 -1.838 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 7 . 1591 . 1 1 4 LEU CA C 3.063 -4.847 -1.711 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 7 . 1592 . 1 1 4 LEU CB C 3.279 -5.708 -2.997 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 7 . 1593 . 1 1 4 LEU CD1 C 3.314 -4.013 -4.975 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 7 . 1594 . 1 1 4 LEU CD2 C 5.408 -4.480 -3.629 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 7 . 1595 . 1 1 4 LEU CG C 4.087 -5.063 -4.155 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 7 . 1596 . 1 1 4 LEU H H 2.467 -6.658 -0.593 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 7 . 1597 . 1 1 4 LEU HA H 3.970 -4.248 -1.511 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 7 . 1598 . 1 1 4 LEU HB2 H 3.833 -6.631 -2.731 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1599 . 1 1 4 LEU HB3 H 2.311 -6.089 -3.376 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1600 . 1 1 4 LEU HD11 H 3.102 -3.102 -4.390 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 7 . 1601 . 1 1 4 LEU HD12 H 3.889 -3.690 -5.862 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 7 . 1602 . 1 1 4 LEU HD13 H 2.346 -4.404 -5.336 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 7 . 1603 . 1 1 4 LEU HD21 H 5.891 -5.184 -2.922 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 7 . 1604 . 1 1 4 LEU HD22 H 6.107 -4.258 -4.444 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 7 . 1605 . 1 1 4 LEU HD23 H 5.230 -3.541 -3.067 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 7 . 1606 . 1 1 4 LEU HG H 4.343 -5.881 -4.854 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 7 . 1607 . 1 1 4 LEU N N 2.928 -5.741 -0.542 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 7 . 1608 . 1 1 4 LEU O O 2.147 -2.670 -2.118 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 7 . 1609 . 1 1 5 ILE C C -0.212 -2.397 -0.142 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 7 . 1610 . 1 1 5 ILE CA C -0.498 -3.515 -1.204 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 7 . 1611 . 1 1 5 ILE CB C -1.625 -4.534 -0.800 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 7 . 1612 . 1 1 5 ILE CD1 C -1.219 -6.927 -1.794 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 7 . 1613 . 1 1 5 ILE CG1 C -1.968 -5.584 -1.924 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 7 . 1614 . 1 1 5 ILE CG2 C -2.922 -3.781 -0.396 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 7 . 1615 . 1 1 5 ILE H H 0.722 -5.284 -1.169 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 7 . 1616 . 1 1 5 ILE HA H -0.822 -3.028 -2.140 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 7 . 1617 . 1 1 5 ILE HB H -1.239 -5.095 0.086 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 7 . 1618 . 1 1 5 ILE HD11 H -0.119 -6.804 -1.766 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 7 . 1619 . 1 1 5 ILE HD12 H -1.492 -7.462 -0.869 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 7 . 1620 . 1 1 5 ILE HD13 H -1.430 -7.608 -2.635 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 7 . 1621 . 1 1 5 ILE HG12 H -3.054 -5.777 -1.975 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 7 . 1622 . 1 1 5 ILE HG13 H -1.729 -5.164 -2.917 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 7 . 1623 . 1 1 5 ILE HG21 H -2.774 -3.166 0.509 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 7 . 1624 . 1 1 5 ILE HG22 H -3.264 -3.092 -1.191 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 7 . 1625 . 1 1 5 ILE HG23 H -3.758 -4.459 -0.168 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 7 . 1626 . 1 1 5 ILE N N 0.691 -4.318 -1.523 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 7 . 1627 . 1 1 5 ILE O O -0.544 -1.253 -0.410 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 7 . 1628 . 1 1 6 LYS C C 1.926 -0.677 1.697 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 7 . 1629 . 1 1 6 LYS CA C 0.738 -1.631 2.025 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 7 . 1630 . 1 1 6 LYS CB C 0.653 -2.191 3.464 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 7 . 1631 . 1 1 6 LYS CD C -2.014 -1.868 3.392 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 7 . 1632 . 1 1 6 LYS CE C -3.288 -2.220 4.186 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 7 . 1633 . 1 1 6 LYS CG C -0.768 -2.622 3.954 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 7 . 1634 . 1 1 6 LYS H H 0.630 -3.666 1.160 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 7 . 1635 . 1 1 6 LYS HA H -0.091 -0.899 1.987 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 7 . 1636 . 1 1 6 LYS HB2 H 1.355 -3.038 3.581 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1637 . 1 1 6 LYS HB3 H 1.042 -1.434 4.165 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1638 . 1 1 6 LYS HD2 H -1.845 -0.772 3.380 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 7 . 1639 . 1 1 6 LYS HD3 H -2.150 -2.111 2.314 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 7 . 1640 . 1 1 6 LYS HE2 H -3.493 -3.305 4.120 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 7 . 1641 . 1 1 6 LYS HE3 H -3.144 -1.999 5.260 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 7 . 1642 . 1 1 6 LYS HG2 H -0.904 -3.697 3.738 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1643 . 1 1 6 LYS HG3 H -0.765 -2.566 5.059 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1644 . 1 1 6 LYS HZ1 H -4.661 -1.663 2.720 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 7 . 1645 . 1 1 6 LYS HZ2 H -5.311 -1.726 4.238 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 7 . 1646 . 1 1 6 LYS HZ3 H -4.340 -0.464 3.809 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 7 . 1647 . 1 1 6 LYS N N 0.387 -2.679 1.023 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 7 . 1648 . 1 1 6 LYS NZ N -4.467 -1.478 3.710 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 7 . 1649 . 1 1 6 LYS O O 1.875 0.473 2.130 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 7 . 1650 . 1 1 7 ARG C C 3.274 0.834 -0.762 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 7 . 1651 . 1 1 7 ARG CA C 3.928 -0.141 0.291 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 7 . 1652 . 1 1 7 ARG CB C 5.116 -0.958 -0.308 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 7 . 1653 . 1 1 7 ARG CD C 6.106 -1.816 1.891 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 7 . 1654 . 1 1 7 ARG CG C 6.377 -1.090 0.571 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 7 . 1655 . 1 1 7 ARG CZ C 7.395 -2.725 3.835 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 7 . 1656 . 1 1 7 ARG H H 2.987 -2.105 0.762 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 7 . 1657 . 1 1 7 ARG HA H 4.340 0.516 1.083 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 7 . 1658 . 1 1 7 ARG HB2 H 4.786 -1.959 -0.651 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1659 . 1 1 7 ARG HB3 H 5.457 -0.482 -1.232 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1660 . 1 1 7 ARG HD2 H 5.400 -1.204 2.483 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 7 . 1661 . 1 1 7 ARG HD3 H 5.598 -2.770 1.662 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 7 . 1662 . 1 1 7 ARG HE H 8.255 -1.703 2.342 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 7 . 1663 . 1 1 7 ARG HG2 H 7.151 -1.633 -0.006 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1664 . 1 1 7 ARG HG3 H 6.800 -0.087 0.768 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1665 . 1 1 7 ARG HH11 H 5.430 -3.138 3.953 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 7 . 1666 . 1 1 7 ARG HH12 H 6.494 -3.746 5.318 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 7 . 1667 . 1 1 7 ARG HH21 H 9.373 -2.442 3.948 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 7 . 1668 . 1 1 7 ARG HH22 H 8.579 -3.377 5.312 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 7 . 1669 . 1 1 7 ARG N N 2.967 -1.094 0.950 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 7 . 1670 . 1 1 7 ARG NE N 7.348 -2.053 2.667 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 7 . 1671 . 1 1 7 ARG NH1 N 6.330 -3.260 4.431 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 7 . 1672 . 1 1 7 ARG NH2 N 8.568 -2.862 4.425 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 7 . 1673 . 1 1 7 ARG O O 3.412 2.062 -0.652 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 7 . 1674 . 1 1 8 ILE C C 0.630 2.009 -1.888 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 7 . 1675 . 1 1 8 ILE CA C 1.662 1.125 -2.656 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 7 . 1676 . 1 1 8 ILE CB C 1.046 0.364 -3.887 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 7 . 1677 . 1 1 8 ILE CD1 C -1.427 -0.430 -3.382 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 7 . 1678 . 1 1 8 ILE CG1 C 0.080 -0.793 -3.522 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 7 . 1679 . 1 1 8 ILE CG2 C 2.151 -0.109 -4.865 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 7 . 1680 . 1 1 8 ILE H H 2.450 -0.729 -1.729 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 7 . 1681 . 1 1 8 ILE HA H 2.358 1.844 -3.124 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 7 . 1682 . 1 1 8 ILE HB H 0.461 1.090 -4.477 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 7 . 1683 . 1 1 8 ILE HD11 H -1.605 0.420 -2.697 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 7 . 1684 . 1 1 8 ILE HD12 H -1.903 -0.147 -4.334 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 7 . 1685 . 1 1 8 ILE HD13 H -2.018 -1.254 -2.941 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 7 . 1686 . 1 1 8 ILE HG12 H 0.273 -1.672 -4.171 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 7 . 1687 . 1 1 8 ILE HG13 H 0.395 -1.170 -2.550 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 7 . 1688 . 1 1 8 ILE HG21 H 2.837 -0.835 -4.394 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 7 . 1689 . 1 1 8 ILE HG22 H 1.726 -0.592 -5.765 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 7 . 1690 . 1 1 8 ILE HG23 H 2.767 0.736 -5.222 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 7 . 1691 . 1 1 8 ILE N N 2.516 0.295 -1.746 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 7 . 1692 . 1 1 8 ILE O O 0.596 3.195 -2.186 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 7 . 1693 . 1 1 9 GLN C C -0.369 3.404 0.848 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 7 . 1694 . 1 1 9 GLN CA C -1.065 2.361 -0.077 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 7 . 1695 . 1 1 9 GLN CB C -2.113 1.576 0.761 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 7 . 1696 . 1 1 9 GLN CD C -4.380 0.277 0.669 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 7 . 1697 . 1 1 9 GLN CG C -3.096 0.714 -0.056 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 7 . 1698 . 1 1 9 GLN H H -0.014 0.508 -0.705 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 7 . 1699 . 1 1 9 GLN HA H -1.622 2.938 -0.837 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 7 . 1700 . 1 1 9 GLN HB2 H -1.605 0.942 1.512 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1701 . 1 1 9 GLN HB3 H -2.703 2.299 1.358 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1702 . 1 1 9 GLN HE21 H -4.494 -1.341 -0.508 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 7 . 1703 . 1 1 9 GLN HE22 H -5.831 -1.103 0.726 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 7 . 1704 . 1 1 9 GLN HG2 H -3.387 1.205 -0.998 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1705 . 1 1 9 GLN HG3 H -2.519 -0.158 -0.380 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1706 . 1 1 9 GLN N N -0.134 1.510 -0.886 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 7 . 1707 . 1 1 9 GLN NE2 N -4.952 -0.845 0.264 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 7 . 1708 . 1 1 9 GLN O O -0.851 4.530 0.971 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 7 . 1709 . 1 1 9 GLN OE1 O -4.896 0.948 1.562 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 7 . 1710 . 1 1 10 ALA C C 2.008 5.337 1.044 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 7 . 1711 . 1 1 10 ALA CA C 1.741 4.101 1.982 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 7 . 1712 . 1 1 10 ALA CB C 3.059 3.410 2.400 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 7 . 1713 . 1 1 10 ALA H H 1.019 2.081 1.266 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 7 . 1714 . 1 1 10 ALA HA H 1.270 4.493 2.904 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 7 . 1715 . 1 1 10 ALA HB1 H 3.765 4.112 2.876 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 7 . 1716 . 1 1 10 ALA HB2 H 2.891 2.589 3.121 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1717 . 1 1 10 ALA HB3 H 3.599 2.965 1.546 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1718 . 1 1 10 ALA N N 0.804 3.078 1.413 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 7 . 1719 . 1 1 10 ALA O O 1.919 6.474 1.516 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 7 . 1720 . 1 1 11 MET C C 0.648 6.721 -1.692 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 7 . 1721 . 1 1 11 MET CA C 2.104 6.200 -1.305 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 7 . 1722 . 1 1 11 MET CB C 2.843 5.756 -2.606 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 7 . 1723 . 1 1 11 MET CE C 6.933 6.108 -1.829 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 7 . 1724 . 1 1 11 MET CG C 4.333 5.389 -2.477 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 7 . 1725 . 1 1 11 MET H H 2.415 4.129 -0.526 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 7 . 1726 . 1 1 11 MET HA H 2.655 7.083 -0.925 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 7 . 1727 . 1 1 11 MET HB2 H 2.317 4.896 -3.061 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1728 . 1 1 11 MET HB3 H 2.766 6.561 -3.363 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1729 . 1 1 11 MET HE1 H 7.669 6.874 -1.526 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 7 . 1730 . 1 1 11 MET HE2 H 7.264 5.679 -2.793 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 7 . 1731 . 1 1 11 MET HE3 H 6.941 5.305 -1.070 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 7 . 1732 . 1 1 11 MET HG2 H 4.479 4.571 -1.744 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1733 . 1 1 11 MET HG3 H 4.705 5.012 -3.448 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1734 . 1 1 11 MET N N 2.223 5.118 -0.273 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 7 . 1735 . 1 1 11 MET O O 0.443 7.932 -1.797 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 7 . 1736 . 1 1 11 MET SD S 5.290 6.836 -1.979 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 7 . 1737 . 1 1 12 ILE C C -2.771 6.768 -1.646 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 7 . 1738 . 1 1 12 ILE CA C -1.666 6.102 -2.559 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 7 . 1739 . 1 1 12 ILE CB C -1.935 4.875 -3.547 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 7 . 1740 . 1 1 12 ILE CD1 C -0.409 3.610 -5.256 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 7 . 1741 . 1 1 12 ILE CG1 C -1.017 4.947 -4.828 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 7 . 1742 . 1 1 12 ILE CG2 C -3.367 4.540 -4.041 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 7 . 1743 . 1 1 12 ILE H H 0.003 4.838 -1.846 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 7 . 1744 . 1 1 12 ILE HA H -1.545 6.910 -3.259 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 7 . 1745 . 1 1 12 ILE HB H -1.660 3.975 -2.966 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 7 . 1746 . 1 1 12 ILE HD11 H 0.420 3.331 -4.584 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 7 . 1747 . 1 1 12 ILE HD12 H -1.146 2.787 -5.238 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 7 . 1748 . 1 1 12 ILE HD13 H 0.022 3.669 -6.269 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 7 . 1749 . 1 1 12 ILE HG12 H -1.562 5.394 -5.682 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 7 . 1750 . 1 1 12 ILE HG13 H -0.170 5.642 -4.676 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 7 . 1751 . 1 1 12 ILE HG21 H -4.126 4.486 -3.248 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 7 . 1752 . 1 1 12 ILE HG22 H -3.736 5.251 -4.796 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 7 . 1753 . 1 1 12 ILE HG23 H -3.376 3.531 -4.505 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 7 . 1754 . 1 1 12 ILE N N -0.311 5.807 -1.965 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 7 . 1755 . 1 1 12 ILE O O -3.052 7.949 -1.882 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 7 . 1756 . 1 1 13 PRO C C -3.964 6.807 1.926 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 7 . 1757 . 1 1 13 PRO CA C -4.268 6.832 0.385 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 7 . 1758 . 1 1 13 PRO CB C -5.561 6.077 0.023 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 7 . 1759 . 1 1 13 PRO CD C -3.613 4.740 -0.556 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 7 . 1760 . 1 1 13 PRO CG C -5.131 4.662 -0.389 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 7 . 1761 . 1 1 13 PRO HA H -4.387 7.897 0.144 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 7 . 1762 . 1 1 13 PRO HB2 H -6.324 6.075 0.824 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1763 . 1 1 13 PRO HB3 H -6.021 6.585 -0.846 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1764 . 1 1 13 PRO HD2 H -3.092 4.291 0.284 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 7 . 1765 . 1 1 13 PRO HD3 H -3.244 4.209 -1.436 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 7 . 1766 . 1 1 13 PRO HG2 H -5.412 3.903 0.365 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1767 . 1 1 13 PRO HG3 H -5.605 4.378 -1.347 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1768 . 1 1 13 PRO N N -3.297 6.164 -0.544 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 7 . 1769 . 1 1 13 PRO O O -4.782 7.307 2.704 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 7 . 1770 . 1 1 14 LYS C C -3.385 5.622 4.801 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 7 . 1771 . 1 1 14 LYS CA C -2.343 6.150 3.757 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 7 . 1772 . 1 1 14 LYS CB C -1.448 7.356 4.183 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 7 . 1773 . 1 1 14 LYS CD C -1.342 9.754 3.090 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 7 . 1774 . 1 1 14 LYS CE C -1.595 9.513 1.583 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 7 . 1775 . 1 1 14 LYS CG C -2.025 8.796 4.104 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 7 . 1776 . 1 1 14 LYS H H -2.229 5.901 1.572 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 7 . 1777 . 1 1 14 LYS HA H -1.603 5.326 3.714 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 7 . 1778 . 1 1 14 LYS HB2 H -1.108 7.178 5.219 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 7 . 1779 . 1 1 14 LYS HB3 H -0.508 7.308 3.601 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 7 . 1780 . 1 1 14 LYS HD2 H -1.709 10.772 3.318 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 7 . 1781 . 1 1 14 LYS HD3 H -0.255 9.807 3.293 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 7 . 1782 . 1 1 14 LYS HE2 H -2.670 9.333 1.394 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 7 . 1783 . 1 1 14 LYS HE3 H -1.357 10.435 1.022 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 7 . 1784 . 1 1 14 LYS HG2 H -3.117 8.782 3.936 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 7 . 1785 . 1 1 14 LYS HG3 H -1.922 9.252 5.106 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 7 . 1786 . 1 1 14 LYS HZ1 H -0.984 8.287 0.003 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 7 . 1787 . 1 1 14 LYS HZ2 H 0.212 8.556 1.107 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 7 . 1788 . 1 1 14 LYS HZ3 H -1.016 7.509 1.448 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 7 . 1789 . 1 1 14 LYS N N -2.804 6.257 2.344 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 7 . 1790 . 1 1 14 LYS NZ N -0.798 8.410 1.006 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 7 . 1791 . 1 1 14 LYS O O -3.674 6.271 5.811 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 7 . 1792 . 1 1 15 GLY C C -4.994 2.258 4.968 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 7 . 1793 . 1 1 15 GLY CA C -4.835 3.710 5.426 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 7 . 1794 . 1 1 15 GLY H H -3.703 4.081 3.572 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 7 . 1795 . 1 1 15 GLY HA2 H -4.463 3.730 6.469 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 7 . 1796 . 1 1 15 GLY HA3 H -5.817 4.219 5.433 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 7 . 1797 . 1 1 15 GLY N N -3.906 4.412 4.523 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 7 . 1798 . 1 1 15 GLY O O -5.975 1.951 4.254 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 7 . 1799 . 1 1 15 GLY OXT O -4.140 1.413 5.319 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 8 . 1800 . 1 1 1 CYS C C -4.028 -7.357 1.325 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 8 . 1801 . 1 1 1 CYS CA C -5.060 -6.918 0.253 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 8 . 1802 . 1 1 1 CYS CB C -5.978 -5.790 0.764 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 8 . 1803 . 1 1 1 CYS H1 H -6.557 -7.821 -0.887 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 8 . 1804 . 1 1 1 CYS H2 H -5.294 -8.832 -0.549 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 8 . 1805 . 1 1 1 CYS H3 H -6.402 -8.472 0.623 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 8 . 1806 . 1 1 1 CYS HA H -4.539 -6.546 -0.650 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 8 . 1807 . 1 1 1 CYS HB2 H -6.595 -6.117 1.623 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1808 . 1 1 1 CYS HB3 H -5.378 -4.934 1.121 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1809 . 1 1 1 CYS HG H -7.663 -4.247 0.137 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 8 . 1810 . 1 1 1 CYS N N -5.875 -8.078 -0.165 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 8 . 1811 . 1 1 1 CYS O O -4.409 -7.829 2.403 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 8 . 1812 . 1 1 1 CYS SG S -7.068 -5.200 -0.575 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 8 . 1813 . 1 1 2 ARG C C -0.384 -6.808 2.053 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 8 . 1814 . 1 1 2 ARG CA C -1.622 -7.735 1.869 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 8 . 1815 . 1 1 2 ARG CB C -1.431 -9.301 1.779 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 8 . 1816 . 1 1 2 ARG CD C -0.027 -9.811 -0.383 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 8 . 1817 . 1 1 2 ARG CG C -1.342 -9.985 0.394 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 8 . 1818 . 1 1 2 ARG CZ C 2.268 -10.818 -0.472 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 8 . 1819 . 1 1 2 ARG H H -2.540 -6.804 0.089 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 8 . 1820 . 1 1 2 ARG HA H -1.963 -7.603 2.893 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 8 . 1821 . 1 1 2 ARG HB2 H -0.548 -9.600 2.375 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1822 . 1 1 2 ARG HB3 H -2.273 -9.770 2.316 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1823 . 1 1 2 ARG HD2 H -0.227 -10.049 -1.442 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 8 . 1824 . 1 1 2 ARG HD3 H 0.288 -8.753 -0.365 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 8 . 1825 . 1 1 2 ARG HE H 0.943 -11.255 0.966 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 8 . 1826 . 1 1 2 ARG HG2 H -1.541 -11.066 0.519 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 8 . 1827 . 1 1 2 ARG HG3 H -2.173 -9.622 -0.235 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 8 . 1828 . 1 1 2 ARG HH11 H 1.932 -9.536 -1.986 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 8 . 1829 . 1 1 2 ARG HH12 H 3.573 -10.355 -1.933 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 8 . 1830 . 1 1 2 ARG HH21 H 2.843 -12.129 0.927 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 8 . 1831 . 1 1 2 ARG HH22 H 4.051 -11.725 -0.392 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 8 . 1832 . 1 1 2 ARG N N -2.721 -7.214 1.012 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 8 . 1833 . 1 1 2 ARG NE N 1.064 -10.684 0.122 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 8 . 1834 . 1 1 2 ARG NH1 N 2.629 -10.168 -1.577 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 8 . 1835 . 1 1 2 ARG NH2 N 3.142 -11.639 0.077 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 8 . 1836 . 1 1 2 ARG O O -0.510 -5.637 2.416 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 8 . 1837 . 1 1 3 ALA C C 2.686 -5.611 1.369 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 8 . 1838 . 1 1 3 ALA CA C 2.108 -6.800 2.192 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 8 . 1839 . 1 1 3 ALA CB C 2.959 -8.073 1.979 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 8 . 1840 . 1 1 3 ALA H H 0.727 -8.369 1.577 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 8 . 1841 . 1 1 3 ALA HA H 2.111 -6.540 3.267 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 8 . 1842 . 1 1 3 ALA HB1 H 4.018 -7.879 2.183 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 8 . 1843 . 1 1 3 ALA HB2 H 2.618 -8.929 2.592 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1844 . 1 1 3 ALA HB3 H 2.899 -8.407 0.917 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1845 . 1 1 3 ALA N N 0.796 -7.388 1.868 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 8 . 1846 . 1 1 3 ALA O O 2.858 -4.506 1.900 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 8 . 1847 . 1 1 4 LEU C C 2.014 -3.854 -1.223 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 8 . 1848 . 1 1 4 LEU CA C 3.227 -4.761 -0.908 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 8 . 1849 . 1 1 4 LEU CB C 4.018 -5.308 -2.121 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 8 . 1850 . 1 1 4 LEU CD1 C 4.303 -5.135 -4.632 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 8 . 1851 . 1 1 4 LEU CD2 C 2.505 -6.680 -3.613 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 8 . 1852 . 1 1 4 LEU CG C 3.305 -5.377 -3.500 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 8 . 1853 . 1 1 4 LEU H H 2.511 -6.717 -0.260 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 8 . 1854 . 1 1 4 LEU HA H 3.954 -4.080 -0.421 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 8 . 1855 . 1 1 4 LEU HB2 H 4.887 -4.645 -2.197 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1856 . 1 1 4 LEU HB3 H 4.503 -6.279 -1.893 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1857 . 1 1 4 LEU HD11 H 3.801 -5.140 -5.614 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 8 . 1858 . 1 1 4 LEU HD12 H 4.765 -4.134 -4.515 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 8 . 1859 . 1 1 4 LEU HD13 H 5.116 -5.880 -4.630 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 8 . 1860 . 1 1 4 LEU HD21 H 1.907 -6.710 -4.539 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 8 . 1861 . 1 1 4 LEU HD22 H 3.160 -7.569 -3.580 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 8 . 1862 . 1 1 4 LEU HD23 H 1.797 -6.771 -2.768 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 8 . 1863 . 1 1 4 LEU HG H 2.584 -4.548 -3.607 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 8 . 1864 . 1 1 4 LEU N N 2.911 -5.833 0.063 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 8 . 1865 . 1 1 4 LEU O O 2.226 -2.690 -1.536 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 8 . 1866 . 1 1 5 ILE C C -0.386 -2.516 0.057 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 8 . 1867 . 1 1 5 ILE CA C -0.471 -3.594 -1.083 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 8 . 1868 . 1 1 5 ILE CB C -1.707 -4.550 -0.981 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 8 . 1869 . 1 1 5 ILE CD1 C -1.166 -6.868 -2.089 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 8 . 1870 . 1 1 5 ILE CG1 C -1.859 -5.496 -2.227 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 8 . 1871 . 1 1 5 ILE CG2 C -3.023 -3.732 -0.803 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 8 . 1872 . 1 1 5 ILE H H 0.759 -5.376 -0.894 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 8 . 1873 . 1 1 5 ILE HA H -0.597 -3.075 -2.046 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 8 . 1874 . 1 1 5 ILE HB H -1.533 -5.175 -0.077 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 8 . 1875 . 1 1 5 ILE HD11 H -1.736 -7.550 -1.438 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 8 . 1876 . 1 1 5 ILE HD12 H -1.054 -7.375 -3.062 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 8 . 1877 . 1 1 5 ILE HD13 H -0.155 -6.801 -1.648 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 8 . 1878 . 1 1 5 ILE HG12 H -2.923 -5.674 -2.466 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 8 . 1879 . 1 1 5 ILE HG13 H -1.471 -4.990 -3.131 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 8 . 1880 . 1 1 5 ILE HG21 H -3.169 -3.002 -1.623 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 8 . 1881 . 1 1 5 ILE HG22 H -3.922 -4.365 -0.767 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 8 . 1882 . 1 1 5 ILE HG23 H -3.028 -3.144 0.134 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 8 . 1883 . 1 1 5 ILE N N 0.775 -4.390 -1.181 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 8 . 1884 . 1 1 5 ILE O O -0.643 -1.355 -0.220 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 8 . 1885 . 1 1 6 LYS C C 1.489 -0.949 2.216 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 8 . 1886 . 1 1 6 LYS CA C 0.240 -1.865 2.377 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 8 . 1887 . 1 1 6 LYS CB C 0.009 -2.556 3.743 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 8 . 1888 . 1 1 6 LYS CD C -2.589 -2.841 3.077 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 8 . 1889 . 1 1 6 LYS CE C -4.003 -3.155 3.605 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 8 . 1890 . 1 1 6 LYS CG C -1.483 -2.729 4.178 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 8 . 1891 . 1 1 6 LYS H H 0.217 -3.857 1.413 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 8 . 1892 . 1 1 6 LYS HA H -0.570 -1.113 2.304 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 8 . 1893 . 1 1 6 LYS HB2 H 0.521 -3.537 3.763 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1894 . 1 1 6 LYS HB3 H 0.519 -1.979 4.538 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1895 . 1 1 6 LYS HD2 H -2.614 -1.917 2.458 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 8 . 1896 . 1 1 6 LYS HD3 H -2.316 -3.620 2.338 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 8 . 1897 . 1 1 6 LYS HE2 H -4.665 -3.382 2.750 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 8 . 1898 . 1 1 6 LYS HE3 H -3.991 -4.070 4.226 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 8 . 1899 . 1 1 6 LYS HG2 H -1.540 -3.610 4.845 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 8 . 1900 . 1 1 6 LYS HG3 H -1.741 -1.870 4.825 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 8 . 1901 . 1 1 6 LYS HZ1 H -4.040 -1.811 5.200 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 8 . 1902 . 1 1 6 LYS HZ2 H -4.661 -1.186 3.806 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 8 . 1903 . 1 1 6 LYS HZ3 H -5.546 -2.263 4.693 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 8 . 1904 . 1 1 6 LYS N N 0.013 -2.859 1.287 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 8 . 1905 . 1 1 6 LYS NZ N -4.598 -2.042 4.370 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 8 . 1906 . 1 1 6 LYS O O 1.417 0.193 2.667 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 8 . 1907 . 1 1 7 ARG C C 3.161 0.533 -0.089 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 8 . 1908 . 1 1 7 ARG CA C 3.650 -0.452 1.060 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 8 . 1909 . 1 1 7 ARG CB C 4.882 -1.313 0.672 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 8 . 1910 . 1 1 7 ARG CD C 6.446 0.152 -0.758 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 8 . 1911 . 1 1 7 ARG CG C 6.238 -0.586 0.576 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 8 . 1912 . 1 1 7 ARG CZ C 8.050 2.052 -0.385 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 8 . 1913 . 1 1 7 ARG H H 2.626 -2.404 1.411 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 8 . 1914 . 1 1 7 ARG HA H 3.962 0.179 1.915 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 8 . 1915 . 1 1 7 ARG HB2 H 5.029 -2.119 1.417 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1916 . 1 1 7 ARG HB3 H 4.665 -1.836 -0.274 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1917 . 1 1 7 ARG HD2 H 6.347 -0.578 -1.582 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 8 . 1918 . 1 1 7 ARG HD3 H 5.640 0.886 -0.929 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 8 . 1919 . 1 1 7 ARG HE H 8.574 0.324 -1.263 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 8 . 1920 . 1 1 7 ARG HG2 H 6.358 0.105 1.432 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 8 . 1921 . 1 1 7 ARG HG3 H 7.044 -1.336 0.692 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 8 . 1922 . 1 1 7 ARG HH11 H 6.214 2.450 0.336 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 8 . 1923 . 1 1 7 ARG HH12 H 7.488 3.757 0.526 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 8 . 1924 . 1 1 7 ARG HH21 H 9.944 1.895 -1.012 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 8 . 1925 . 1 1 7 ARG HH22 H 9.458 3.460 -0.188 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 8 . 1926 . 1 1 7 ARG N N 2.595 -1.386 1.576 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 8 . 1927 . 1 1 7 ARG NE N 7.776 0.809 -0.841 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 8 . 1928 . 1 1 7 ARG NH1 N 7.159 2.834 0.222 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 8 . 1929 . 1 1 7 ARG NH2 N 9.274 2.516 -0.544 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 8 . 1930 . 1 1 7 ARG O O 3.323 1.754 0.038 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 8 . 1931 . 1 1 8 ILE C C 0.761 1.866 -1.526 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 8 . 1932 . 1 1 8 ILE CA C 1.824 0.928 -2.186 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 8 . 1933 . 1 1 8 ILE CB C 1.306 0.230 -3.504 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 8 . 1934 . 1 1 8 ILE CD1 C -1.289 -0.334 -3.252 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 8 . 1935 . 1 1 8 ILE CG1 C 0.183 -0.822 -3.306 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 8 . 1936 . 1 1 8 ILE CG2 C 2.478 -0.377 -4.318 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 8 . 1937 . 1 1 8 ILE H H 2.607 -0.974 -1.332 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 8 . 1938 . 1 1 8 ILE HA H 2.604 1.610 -2.567 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 8 . 1939 . 1 1 8 ILE HB H 0.892 1.014 -4.161 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 8 . 1940 . 1 1 8 ILE HD11 H -1.453 0.515 -2.567 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 8 . 1941 . 1 1 8 ILE HD12 H -1.673 -0.007 -4.231 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 8 . 1942 . 1 1 8 ILE HD13 H -1.965 -1.127 -2.877 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 8 . 1943 . 1 1 8 ILE HG12 H 0.276 -1.642 -4.043 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 8 . 1944 . 1 1 8 ILE HG13 H 0.412 -1.311 -2.359 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 8 . 1945 . 1 1 8 ILE HG21 H 3.262 0.374 -4.527 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 8 . 1946 . 1 1 8 ILE HG22 H 2.963 -1.218 -3.787 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 8 . 1947 . 1 1 8 ILE HG23 H 2.140 -0.761 -5.298 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 8 . 1948 . 1 1 8 ILE N N 2.542 0.046 -1.195 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 8 . 1949 . 1 1 8 ILE O O 0.791 3.048 -1.834 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 8 . 1950 . 1 1 9 GLN C C -0.373 3.256 1.177 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 8 . 1951 . 1 1 9 GLN CA C -1.049 2.275 0.166 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 8 . 1952 . 1 1 9 GLN CB C -2.213 1.505 0.853 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 8 . 1953 . 1 1 9 GLN CD C -4.419 0.166 0.485 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 8 . 1954 . 1 1 9 GLN CG C -3.116 0.711 -0.114 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 8 . 1955 . 1 1 9 GLN H H -0.021 0.393 -0.400 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 8 . 1956 . 1 1 9 GLN HA H -1.506 2.910 -0.614 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 8 . 1957 . 1 1 9 GLN HB2 H -1.813 0.824 1.628 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1958 . 1 1 9 GLN HB3 H -2.846 2.225 1.406 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1959 . 1 1 9 GLN HE21 H -5.447 1.657 -0.359 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 8 . 1960 . 1 1 9 GLN HE22 H -6.396 0.453 0.651 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 8 . 1961 . 1 1 9 GLN HG2 H -3.326 1.280 -1.035 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 8 . 1962 . 1 1 9 GLN HG3 H -2.517 -0.129 -0.472 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 8 . 1963 . 1 1 9 GLN N N -0.098 1.399 -0.591 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 8 . 1964 . 1 1 9 GLN NE2 N -5.533 0.839 0.252 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 8 . 1965 . 1 1 9 GLN O O -0.824 4.391 1.334 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 8 . 1966 . 1 1 9 GLN OE1 O -4.447 -0.874 1.138 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 8 . 1967 . 1 1 10 ALA C C 2.084 5.068 1.543 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 8 . 1968 . 1 1 10 ALA CA C 1.710 3.823 2.433 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 8 . 1969 . 1 1 10 ALA CB C 2.982 3.063 2.889 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 8 . 1970 . 1 1 10 ALA H H 0.936 1.863 1.613 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 8 . 1971 . 1 1 10 ALA HA H 1.211 4.215 3.341 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 8 . 1972 . 1 1 10 ALA HB1 H 3.609 3.667 3.563 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 8 . 1973 . 1 1 10 ALA HB2 H 2.758 2.119 3.419 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1974 . 1 1 10 ALA HB3 H 3.647 2.787 2.054 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1975 . 1 1 10 ALA N N 0.753 2.861 1.792 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 8 . 1976 . 1 1 10 ALA O O 2.017 6.198 2.035 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 8 . 1977 . 1 1 11 MET C C 0.976 6.555 -1.253 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 8 . 1978 . 1 1 11 MET CA C 2.374 5.965 -0.779 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 8 . 1979 . 1 1 11 MET CB C 3.171 5.496 -2.035 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 8 . 1980 . 1 1 11 MET CE C 7.249 6.203 -1.458 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 8 . 1981 . 1 1 11 MET CG C 4.669 5.213 -1.836 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 8 . 1982 . 1 1 11 MET H H 2.517 3.868 -0.017 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 8 . 1983 . 1 1 11 MET HA H 2.937 6.818 -0.351 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 8 . 1984 . 1 1 11 MET HB2 H 2.698 4.594 -2.466 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 8 . 1985 . 1 1 11 MET HB3 H 3.090 6.257 -2.835 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 8 . 1986 . 1 1 11 MET HE1 H 7.937 7.066 -1.404 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 8 . 1987 . 1 1 11 MET HE2 H 7.511 5.611 -2.354 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 8 . 1988 . 1 1 11 MET HE3 H 7.418 5.577 -0.564 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 8 . 1989 . 1 1 11 MET HG2 H 4.840 4.504 -1.002 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 8 . 1990 . 1 1 11 MET HG3 H 5.069 4.736 -2.750 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 8 . 1991 . 1 1 11 MET N N 2.378 4.864 0.240 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 8 . 1992 . 1 1 11 MET O O 0.855 7.773 -1.402 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 8 . 1993 . 1 1 11 MET SD S 5.538 6.767 -1.529 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 8 . 1994 . 1 1 12 ILE C C -2.432 6.798 -1.382 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 8 . 1995 . 1 1 12 ILE CA C -1.315 6.075 -2.241 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 8 . 1996 . 1 1 12 ILE CB C -1.589 4.890 -3.275 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 8 . 1997 . 1 1 12 ILE CD1 C -0.010 3.584 -4.915 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 8 . 1998 . 1 1 12 ILE CG1 C -0.589 4.939 -4.497 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 8 . 1999 . 1 1 12 ILE CG2 C -3.005 4.670 -3.866 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 8 . 2000 . 1 1 12 ILE H H 0.222 4.711 -1.418 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 8 . 2001 . 1 1 12 ILE HA H -1.105 6.888 -2.915 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 8 . 2002 . 1 1 12 ILE HB H -1.404 3.960 -2.707 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 8 . 2003 . 1 1 12 ILE HD11 H -0.775 2.787 -4.937 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 8 . 2004 . 1 1 12 ILE HD12 H 0.463 3.640 -5.910 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 8 . 2005 . 1 1 12 ILE HD13 H 0.782 3.269 -4.217 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 8 . 2006 . 1 1 12 ILE HG12 H -1.059 5.423 -5.374 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 8 . 2007 . 1 1 12 ILE HG13 H 0.276 5.594 -4.280 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 8 . 2008 . 1 1 12 ILE HG21 H -3.805 4.601 -3.115 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 8 . 2009 . 1 1 12 ILE HG22 H -3.293 5.456 -4.581 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 8 . 2010 . 1 1 12 ILE HG23 H -3.041 3.701 -4.407 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 8 . 2011 . 1 1 12 ILE N N -0.020 5.697 -1.570 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 8 . 2012 . 1 1 12 ILE O O -2.629 7.996 -1.617 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 8 . 2013 . 1 1 13 PRO C C -3.850 6.866 2.112 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 8 . 2014 . 1 1 13 PRO CA C -4.053 6.925 0.551 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 8 . 2015 . 1 1 13 PRO CB C -5.354 6.239 0.092 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 8 . 2016 . 1 1 13 PRO CD C -3.445 4.807 -0.373 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 8 . 2017 . 1 1 13 PRO CG C -4.972 4.806 -0.303 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 8 . 2018 . 1 1 13 PRO HA H -4.110 7.996 0.306 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 8 . 2019 . 1 1 13 PRO HB2 H -6.171 6.271 0.837 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 8 . 2020 . 1 1 13 PRO HB3 H -5.726 6.776 -0.801 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 8 . 2021 . 1 1 13 PRO HD2 H -3.002 4.321 0.489 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 8 . 2022 . 1 1 13 PRO HD3 H -3.051 4.271 -1.241 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 8 . 2023 . 1 1 13 PRO HG2 H -5.336 4.061 0.429 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 8 . 2024 . 1 1 13 PRO HG3 H -5.399 4.550 -1.289 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 8 . 2025 . 1 1 13 PRO N N -3.057 6.213 -0.321 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 8 . 2026 . 1 1 13 PRO O O -4.753 7.258 2.857 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 8 . 2027 . 1 1 14 LYS C C -3.281 5.242 4.794 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 8 . 2028 . 1 1 14 LYS CA C -2.340 6.246 4.039 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 8 . 2029 . 1 1 14 LYS CB C -2.082 7.608 4.767 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 8 . 2030 . 1 1 14 LYS CD C -0.773 9.545 3.484 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 8 . 2031 . 1 1 14 LYS CE C -1.162 9.334 2.005 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 8 . 2032 . 1 1 14 LYS CG C -0.740 8.324 4.440 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 8 . 2033 . 1 1 14 LYS H H -2.015 6.117 1.864 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 8 . 2034 . 1 1 14 LYS HA H -1.358 5.734 4.043 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 8 . 2035 . 1 1 14 LYS HB2 H -2.939 8.296 4.641 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 8 . 2036 . 1 1 14 LYS HB3 H -2.063 7.408 5.856 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 8 . 2037 . 1 1 14 LYS HD2 H -1.447 10.311 3.913 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 8 . 2038 . 1 1 14 LYS HD3 H 0.227 10.018 3.508 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 8 . 2039 . 1 1 14 LYS HE2 H -2.233 9.080 1.924 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 8 . 2040 . 1 1 14 LYS HE3 H -1.060 10.287 1.455 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 8 . 2041 . 1 1 14 LYS HG2 H -0.322 8.691 5.396 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 8 . 2042 . 1 1 14 LYS HG3 H 0.015 7.594 4.091 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 8 . 2043 . 1 1 14 LYS HZ1 H 0.646 8.516 1.318 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 8 . 2044 . 1 1 14 LYS HZ2 H -0.464 7.381 1.759 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 8 . 2045 . 1 1 14 LYS HZ3 H -0.639 8.183 0.338 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 8 . 2046 . 1 1 14 LYS N N -2.672 6.414 2.595 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 8 . 2047 . 1 1 14 LYS NZ N -0.357 8.303 1.318 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 8 . 2048 . 1 1 14 LYS O O -3.905 5.582 5.804 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 8 . 2049 . 1 1 15 GLY C C -3.945 1.595 4.175 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 8 . 2050 . 1 1 15 GLY CA C -4.085 2.906 4.950 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 8 . 2051 . 1 1 15 GLY H H -2.938 3.910 3.346 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 8 . 2052 . 1 1 15 GLY HA2 H -3.717 2.760 5.983 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 8 . 2053 . 1 1 15 GLY HA3 H -5.154 3.180 5.038 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 8 . 2054 . 1 1 15 GLY N N -3.336 3.993 4.290 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 8 . 2055 . 1 1 15 GLY O O -4.921 1.184 3.511 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 8 . 2056 . 1 1 15 GLY OXT O -2.868 0.958 4.235 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 9 . 2057 . 1 1 1 CYS C C -3.852 -7.295 1.576 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 9 . 2058 . 1 1 1 CYS CA C -4.878 -7.004 0.450 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 9 . 2059 . 1 1 1 CYS CB C -5.923 -5.953 0.867 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 9 . 2060 . 1 1 1 CYS H1 H -4.890 -8.968 -0.261 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 9 . 2061 . 1 1 1 CYS H2 H -6.073 -8.666 0.851 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 9 . 2062 . 1 1 1 CYS H3 H -6.232 -8.106 -0.694 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 9 . 2063 . 1 1 1 CYS HA H -4.361 -6.624 -0.451 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 9 . 2064 . 1 1 1 CYS HB2 H -6.540 -6.298 1.719 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2065 . 1 1 1 CYS HB3 H -5.425 -5.025 1.201 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2066 . 1 1 1 CYS HG H -7.730 -4.625 0.102 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 9 . 2067 . 1 1 1 CYS N N -5.557 -8.259 0.063 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 9 . 2068 . 1 1 1 CYS O O -4.233 -7.694 2.683 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 9 . 2069 . 1 1 1 CYS SG S -7.009 -5.539 -0.540 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 9 . 2070 . 1 1 2 ARG C C -0.206 -6.615 2.261 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 9 . 2071 . 1 1 2 ARG CA C -1.443 -7.560 2.169 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 9 . 2072 . 1 1 2 ARG CB C -1.226 -9.126 2.154 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 9 . 2073 . 1 1 2 ARG CD C 0.227 -9.639 0.037 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 9 . 2074 . 1 1 2 ARG CG C -1.087 -9.878 0.803 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 9 . 2075 . 1 1 2 ARG CZ C 1.353 -10.480 -2.037 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 9 . 2076 . 1 1 2 ARG H H -2.366 -6.780 0.323 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 9 . 2077 . 1 1 2 ARG HA H -1.786 -7.360 3.185 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 9 . 2078 . 1 1 2 ARG HB2 H -0.362 -9.377 2.801 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2079 . 1 1 2 ARG HB3 H -2.075 -9.583 2.688 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2080 . 1 1 2 ARG HD2 H 0.336 -8.568 -0.203 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 9 . 2081 . 1 1 2 ARG HD3 H 1.087 -9.899 0.680 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 9 . 2082 . 1 1 2 ARG HE H -0.535 -10.950 -1.558 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 9 . 2083 . 1 1 2 ARG HG2 H -1.177 -10.960 1.012 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2084 . 1 1 2 ARG HG3 H -1.952 -9.637 0.157 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2085 . 1 1 2 ARG HH11 H 2.565 -9.330 -0.915 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 9 . 2086 . 1 1 2 ARG HH12 H 3.255 -9.993 -2.480 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 9 . 2087 . 1 1 2 ARG HH21 H 0.355 -11.650 -3.318 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 9 . 2088 . 1 1 2 ARG HH22 H 2.085 -11.219 -3.747 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 9 . 2089 . 1 1 2 ARG N N -2.546 -7.119 1.274 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 9 . 2090 . 1 1 2 ARG NE N 0.278 -10.420 -1.224 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 9 . 2091 . 1 1 2 ARG NH1 N 2.510 -9.870 -1.786 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 9 . 2092 . 1 1 2 ARG NH2 N 1.254 -11.187 -3.146 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 9 . 2093 . 1 1 2 ARG O O -0.329 -5.430 2.578 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 9 . 2094 . 1 1 3 ALA C C 2.818 -5.423 1.392 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 9 . 2095 . 1 1 3 ALA CA C 2.293 -6.583 2.287 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 9 . 2096 . 1 1 3 ALA CB C 3.150 -7.855 2.081 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 9 . 2097 . 1 1 3 ALA H H 0.900 -8.185 1.805 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 9 . 2098 . 1 1 3 ALA HA H 2.345 -6.281 3.350 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 9 . 2099 . 1 1 3 ALA HB1 H 2.866 -8.678 2.763 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 9 . 2100 . 1 1 3 ALA HB2 H 3.030 -8.252 1.044 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2101 . 1 1 3 ALA HB3 H 4.218 -7.636 2.207 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2102 . 1 1 3 ALA N N 0.973 -7.191 2.048 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 9 . 2103 . 1 1 3 ALA O O 3.002 -4.296 1.870 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 9 . 2104 . 1 1 4 LEU C C 2.029 -3.755 -1.225 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 9 . 2105 . 1 1 4 LEU CA C 3.258 -4.651 -0.931 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 9 . 2106 . 1 1 4 LEU CB C 3.996 -5.227 -2.166 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 9 . 2107 . 1 1 4 LEU CD1 C 4.154 -5.131 -4.700 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 9 . 2108 . 1 1 4 LEU CD2 C 2.422 -6.649 -3.544 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 9 . 2109 . 1 1 4 LEU CG C 3.219 -5.341 -3.508 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 9 . 2110 . 1 1 4 LEU H H 2.566 -6.584 -0.190 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 9 . 2111 . 1 1 4 LEU HA H 4.007 -3.970 -0.481 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 9 . 2112 . 1 1 4 LEU HB2 H 4.852 -4.558 -2.303 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2113 . 1 1 4 LEU HB3 H 4.500 -6.187 -1.932 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2114 . 1 1 4 LEU HD11 H 4.617 -4.126 -4.640 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 9 . 2115 . 1 1 4 LEU HD12 H 4.968 -5.875 -4.721 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 9 . 2116 . 1 1 4 LEU HD13 H 3.599 -5.167 -5.653 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 9 . 2117 . 1 1 4 LEU HD21 H 1.763 -6.700 -4.426 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 9 . 2118 . 1 1 4 LEU HD22 H 3.085 -7.531 -3.539 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 9 . 2119 . 1 1 4 LEU HD23 H 1.774 -6.729 -2.651 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 9 . 2120 . 1 1 4 LEU HG H 2.489 -4.519 -3.606 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 9 . 2121 . 1 1 4 LEU N N 2.986 -5.693 0.085 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 9 . 2122 . 1 1 4 LEU O O 2.214 -2.594 -1.568 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 9 . 2123 . 1 1 5 ILE C C -0.366 -2.416 0.077 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 9 . 2124 . 1 1 5 ILE CA C -0.456 -3.536 -1.021 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 9 . 2125 . 1 1 5 ILE CB C -1.660 -4.522 -0.849 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 9 . 2126 . 1 1 5 ILE CD1 C -1.123 -6.885 -1.866 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 9 . 2127 . 1 1 5 ILE CG1 C -1.817 -5.524 -2.053 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 9 . 2128 . 1 1 5 ILE CG2 C -2.993 -3.737 -0.662 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 9 . 2129 . 1 1 5 ILE H H 0.813 -5.282 -0.795 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 9 . 2130 . 1 1 5 ILE HA H -0.620 -3.054 -1.998 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 9 . 2131 . 1 1 5 ILE HB H -1.443 -5.106 0.073 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 9 . 2132 . 1 1 5 ILE HD11 H -1.683 -7.546 -1.185 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 9 . 2133 . 1 1 5 ILE HD12 H -1.013 -7.429 -2.820 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 9 . 2134 . 1 1 5 ILE HD13 H -0.109 -6.784 -1.440 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 9 . 2135 . 1 1 5 ILE HG12 H -2.880 -5.703 -2.298 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 9 . 2136 . 1 1 5 ILE HG13 H -1.405 -5.070 -2.971 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 9 . 2137 . 1 1 5 ILE HG21 H -3.185 -3.043 -1.503 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 9 . 2138 . 1 1 5 ILE HG22 H -3.873 -4.393 -0.574 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 9 . 2139 . 1 1 5 ILE HG23 H -2.986 -3.114 0.253 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 9 . 2140 . 1 1 5 ILE N N 0.801 -4.309 -1.127 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 9 . 2141 . 1 1 5 ILE O O -0.704 -1.281 -0.222 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 9 . 2142 . 1 1 6 LYS C C 1.629 -0.730 2.043 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 9 . 2143 . 1 1 6 LYS CA C 0.398 -1.650 2.317 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 9 . 2144 . 1 1 6 LYS CB C 0.243 -2.272 3.725 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 9 . 2145 . 1 1 6 LYS CD C -2.400 -2.555 3.228 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 9 . 2146 . 1 1 6 LYS CE C -3.743 -2.807 3.938 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 9 . 2147 . 1 1 6 LYS CG C -1.223 -2.425 4.247 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 9 . 2148 . 1 1 6 LYS H H 0.382 -3.676 1.437 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 9 . 2149 . 1 1 6 LYS HA H -0.425 -0.913 2.254 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 9 . 2150 . 1 1 6 LYS HB2 H 0.761 -3.250 3.767 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2151 . 1 1 6 LYS HB3 H 0.793 -1.655 4.461 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2152 . 1 1 6 LYS HD2 H -2.472 -1.638 2.599 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 9 . 2153 . 1 1 6 LYS HD3 H -2.201 -3.360 2.491 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 9 . 2154 . 1 1 6 LYS HE2 H -3.707 -3.755 4.507 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 9 . 2155 . 1 1 6 LYS HE3 H -3.942 -2.008 4.677 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 9 . 2156 . 1 1 6 LYS HG2 H -1.239 -3.288 4.939 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2157 . 1 1 6 LYS HG3 H -1.436 -1.551 4.891 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2158 . 1 1 6 LYS HZ1 H -4.956 -1.978 2.466 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 9 . 2159 . 1 1 6 LYS HZ2 H -4.738 -3.607 2.292 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 9 . 2160 . 1 1 6 LYS HZ3 H -5.757 -3.027 3.458 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 9 . 2161 . 1 1 6 LYS N N 0.118 -2.696 1.293 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 9 . 2162 . 1 1 6 LYS NZ N -4.863 -2.860 2.984 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 9 . 2163 . 1 1 6 LYS O O 1.573 0.427 2.452 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 9 . 2164 . 1 1 7 ARG C C 3.144 0.727 -0.375 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 9 . 2165 . 1 1 7 ARG CA C 3.715 -0.251 0.741 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 9 . 2166 . 1 1 7 ARG CB C 4.900 -1.099 0.200 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 9 . 2167 . 1 1 7 ARG CD C 6.963 -0.708 1.602 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 9 . 2168 . 1 1 7 ARG CG C 6.282 -0.425 0.258 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 9 . 2169 . 1 1 7 ARG CZ C 9.043 -0.025 2.820 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 9 . 2170 . 1 1 7 ARG H H 2.773 -2.203 1.261 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 9 . 2171 . 1 1 7 ARG HA H 4.101 0.381 1.565 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 9 . 2172 . 1 1 7 ARG HB2 H 4.961 -2.095 0.685 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2173 . 1 1 7 ARG HB3 H 4.702 -1.339 -0.847 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2174 . 1 1 7 ARG HD2 H 6.274 -0.421 2.418 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 9 . 2175 . 1 1 7 ARG HD3 H 7.115 -1.803 1.684 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 9 . 2176 . 1 1 7 ARG HE H 8.622 0.585 0.959 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 9 . 2177 . 1 1 7 ARG HG2 H 6.912 -0.824 -0.559 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2178 . 1 1 7 ARG HG3 H 6.189 0.662 0.069 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2179 . 1 1 7 ARG HH11 H 7.873 -1.238 3.918 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 9 . 2180 . 1 1 7 ARG HH12 H 9.432 -0.658 4.692 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 9 . 2181 . 1 1 7 ARG HH21 H 10.370 1.185 1.937 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 9 . 2182 . 1 1 7 ARG HH22 H 10.750 0.623 3.642 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 9 . 2183 . 1 1 7 ARG N N 2.707 -1.179 1.359 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 9 . 2184 . 1 1 7 ARG NE N 8.257 0.008 1.725 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 9 . 2185 . 1 1 7 ARG NH1 N 8.753 -0.712 3.924 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 9 . 2186 . 1 1 7 ARG NH2 N 10.169 0.664 2.797 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 9 . 2187 . 1 1 7 ARG O O 3.283 1.952 -0.265 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 9 . 2188 . 1 1 8 ILE C C 0.609 1.951 -1.682 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 9 . 2189 . 1 1 8 ILE CA C 1.660 1.033 -2.386 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 9 . 2190 . 1 1 8 ILE CB C 1.087 0.273 -3.646 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 9 . 2191 . 1 1 8 ILE CD1 C -1.467 -0.345 -3.238 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 9 . 2192 . 1 1 8 ILE CG1 C 0.013 -0.803 -3.342 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 9 . 2193 . 1 1 8 ILE CG2 C 2.226 -0.328 -4.511 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 9 . 2194 . 1 1 8 ILE H H 2.545 -0.821 -1.542 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 9 . 2195 . 1 1 8 ILE HA H 2.391 1.729 -2.833 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 9 . 2196 . 1 1 8 ILE HB H 0.611 1.021 -4.303 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 9 . 2197 . 1 1 8 ILE HD11 H -1.618 0.531 -2.585 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 9 . 2198 . 1 1 8 ILE HD12 H -1.903 -0.069 -4.211 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 9 . 2199 . 1 1 8 ILE HD13 H -2.107 -1.135 -2.798 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 9 . 2200 . 1 1 8 ILE HG12 H 0.094 -1.653 -4.047 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 9 . 2201 . 1 1 8 ILE HG13 H 0.306 -1.245 -2.388 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 9 . 2202 . 1 1 8 ILE HG21 H 2.973 0.438 -4.791 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 9 . 2203 . 1 1 8 ILE HG22 H 2.767 -1.137 -3.985 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 9 . 2204 . 1 1 8 ILE HG23 H 1.840 -0.754 -5.456 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 9 . 2205 . 1 1 8 ILE N N 2.461 0.200 -1.425 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 9 . 2206 . 1 1 8 ILE O O 0.581 3.124 -2.023 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 9 . 2207 . 1 1 9 GLN C C -0.444 3.394 1.026 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 9 . 2208 . 1 1 9 GLN CA C -1.128 2.357 0.083 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 9 . 2209 . 1 1 9 GLN CB C -2.212 1.577 0.877 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 9 . 2210 . 1 1 9 GLN CD C -4.373 0.097 0.733 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 9 . 2211 . 1 1 9 GLN CG C -3.177 0.743 0.012 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 9 . 2212 . 1 1 9 GLN H H -0.062 0.489 -0.468 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 9 . 2213 . 1 1 9 GLN HA H -1.654 2.941 -0.693 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 9 . 2214 . 1 1 9 GLN HB2 H -1.728 0.920 1.624 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2215 . 1 1 9 GLN HB3 H -2.813 2.294 1.470 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2216 . 1 1 9 GLN HE21 H -4.732 -1.009 -0.899 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 9 . 2217 . 1 1 9 GLN HE22 H -5.874 -1.213 0.523 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 9 . 2218 . 1 1 9 GLN HG2 H -3.557 1.329 -0.838 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2219 . 1 1 9 GLN HG3 H -2.565 -0.029 -0.461 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2220 . 1 1 9 GLN N N -0.183 1.484 -0.687 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 9 . 2221 . 1 1 9 GLN NE2 N -5.055 -0.812 0.054 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 9 . 2222 . 1 1 9 GLN O O -0.909 4.526 1.140 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 9 . 2223 . 1 1 9 GLN OE1 O -4.723 0.409 1.871 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 9 . 2224 . 1 1 10 ALA C C 1.980 5.272 1.245 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 9 . 2225 . 1 1 10 ALA CA C 1.655 4.059 2.195 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 9 . 2226 . 1 1 10 ALA CB C 2.945 3.339 2.655 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 9 . 2227 . 1 1 10 ALA H H 0.911 2.053 1.462 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 9 . 2228 . 1 1 10 ALA HA H 1.170 4.482 3.097 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 9 . 2229 . 1 1 10 ALA HB1 H 3.627 4.014 3.197 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 9 . 2230 . 1 1 10 ALA HB2 H 2.738 2.483 3.323 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2231 . 1 1 10 ALA HB3 H 3.535 2.934 1.817 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2232 . 1 1 10 ALA N N 0.706 3.050 1.622 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 9 . 2233 . 1 1 10 ALA O O 1.928 6.418 1.700 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 9 . 2234 . 1 1 11 MET C C 0.712 6.644 -1.533 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 9 . 2235 . 1 1 11 MET CA C 2.145 6.090 -1.118 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 9 . 2236 . 1 1 11 MET CB C 2.887 5.599 -2.400 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 9 . 2237 . 1 1 11 MET CE C 5.687 7.440 -3.267 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 9 . 2238 . 1 1 11 MET CG C 4.363 5.184 -2.243 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 9 . 2239 . 1 1 11 MET H H 2.358 4.024 -0.297 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 9 . 2240 . 1 1 11 MET HA H 2.718 6.962 -0.745 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 9 . 2241 . 1 1 11 MET HB2 H 2.340 4.749 -2.847 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2242 . 1 1 11 MET HB3 H 2.842 6.390 -3.172 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2243 . 1 1 11 MET HE1 H 4.743 7.806 -3.710 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 9 . 2244 . 1 1 11 MET HE2 H 6.178 6.772 -3.998 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 9 . 2245 . 1 1 11 MET HE3 H 6.347 8.312 -3.104 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 9 . 2246 . 1 1 11 MET HG2 H 4.461 4.367 -1.502 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2247 . 1 1 11 MET HG3 H 4.741 4.776 -3.199 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2248 . 1 1 11 MET N N 2.211 5.024 -0.064 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 9 . 2249 . 1 1 11 MET O O 0.561 7.854 -1.714 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 9 . 2250 . 1 1 11 MET SD S 5.382 6.580 -1.709 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 9 . 2251 . 1 1 12 ILE C C -2.709 6.791 -1.481 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 9 . 2252 . 1 1 12 ILE CA C -1.619 6.085 -2.386 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 9 . 2253 . 1 1 12 ILE CB C -1.914 4.869 -3.374 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 9 . 2254 . 1 1 12 ILE CD1 C -0.410 3.547 -5.070 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 9 . 2255 . 1 1 12 ILE CG1 C -0.976 4.905 -4.643 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 9 . 2256 . 1 1 12 ILE CG2 C -3.352 4.602 -3.890 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 9 . 2257 . 1 1 12 ILE H H -0.010 4.782 -1.605 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 9 . 2258 . 1 1 12 ILE HA H -1.474 6.887 -3.087 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 9 . 2259 . 1 1 12 ILE HB H -1.678 3.963 -2.786 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 9 . 2260 . 1 1 12 ILE HD11 H 0.419 3.249 -4.407 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 9 . 2261 . 1 1 12 ILE HD12 H -1.169 2.744 -5.040 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 9 . 2262 . 1 1 12 ILE HD13 H 0.011 3.590 -6.087 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 9 . 2263 . 1 1 12 ILE HG12 H -1.492 5.374 -5.503 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 9 . 2264 . 1 1 12 ILE HG13 H -0.105 5.568 -4.479 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 9 . 2265 . 1 1 12 ILE HG21 H -3.398 3.604 -4.374 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 9 . 2266 . 1 1 12 ILE HG22 H -4.119 4.567 -3.103 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 9 . 2267 . 1 1 12 ILE HG23 H -3.680 5.344 -4.633 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 9 . 2268 . 1 1 12 ILE N N -0.281 5.757 -1.775 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 9 . 2269 . 1 1 12 ILE O O -2.947 7.981 -1.717 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 9 . 2270 . 1 1 13 PRO C C -3.869 6.872 2.093 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 9 . 2271 . 1 1 13 PRO CA C -4.205 6.906 0.552 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 9 . 2272 . 1 1 13 PRO CB C -5.524 6.192 0.193 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 9 . 2273 . 1 1 13 PRO CD C -3.626 4.791 -0.392 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 9 . 2274 . 1 1 13 PRO CG C -5.145 4.766 -0.229 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 9 . 2275 . 1 1 13 PRO HA H -4.295 7.972 0.302 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 9 . 2276 . 1 1 13 PRO HB2 H -6.282 6.211 0.998 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2277 . 1 1 13 PRO HB3 H -5.974 6.715 -0.673 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2278 . 1 1 13 PRO HD2 H -3.128 4.325 0.451 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 9 . 2279 . 1 1 13 PRO HD3 H -3.273 4.248 -1.272 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 9 . 2280 . 1 1 13 PRO HG2 H -5.455 4.012 0.519 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2281 . 1 1 13 PRO HG3 H -5.626 4.507 -1.190 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2282 . 1 1 13 PRO N N -3.262 6.203 -0.381 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 9 . 2283 . 1 1 13 PRO O O -4.738 7.161 2.920 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 9 . 2284 . 1 1 14 LYS C C -2.783 5.341 4.689 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 9 . 2285 . 1 1 14 LYS CA C -2.103 6.478 3.855 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 9 . 2286 . 1 1 14 LYS CB C -1.974 7.871 4.560 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 9 . 2287 . 1 1 14 LYS CD C -0.934 9.873 3.123 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 9 . 2288 . 1 1 14 LYS CE C -1.337 9.531 1.672 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 9 . 2289 . 1 1 14 LYS CG C -0.743 8.733 4.157 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 9 . 2290 . 1 1 14 LYS H H -2.015 6.272 1.671 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 9 . 2291 . 1 1 14 LYS HA H -1.058 6.126 3.747 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 9 . 2292 . 1 1 14 LYS HB2 H -2.911 8.453 4.477 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 9 . 2293 . 1 1 14 LYS HB3 H -1.873 7.688 5.646 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 9 . 2294 . 1 1 14 LYS HD2 H -1.672 10.591 3.526 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 9 . 2295 . 1 1 14 LYS HD3 H 0.011 10.447 3.084 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 9 . 2296 . 1 1 14 LYS HE2 H -2.390 9.202 1.641 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 9 . 2297 . 1 1 14 LYS HE3 H -1.315 10.451 1.060 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 9 . 2298 . 1 1 14 LYS HG2 H -0.369 9.216 5.080 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 9 . 2299 . 1 1 14 LYS HG3 H 0.099 8.085 3.847 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 9 . 2300 . 1 1 14 LYS HZ1 H 0.502 8.788 0.976 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 9 . 2301 . 1 1 14 LYS HZ2 H -0.519 7.614 1.524 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 9 . 2302 . 1 1 14 LYS HZ3 H -0.788 8.311 0.065 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 9 . 2303 . 1 1 14 LYS N N -2.606 6.566 2.456 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 9 . 2304 . 1 1 14 LYS NZ N -0.484 8.512 1.026 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 9 . 2305 . 1 1 14 LYS O O -3.400 5.586 5.731 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 9 . 2306 . 1 1 15 GLY C C -2.297 1.627 4.468 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 9 . 2307 . 1 1 15 GLY CA C -3.011 2.888 4.973 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 9 . 2308 . 1 1 15 GLY H H -2.284 4.069 3.241 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 9 . 2309 . 1 1 15 GLY HA2 H -2.785 3.007 6.050 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 9 . 2310 . 1 1 15 GLY HA3 H -4.107 2.759 4.903 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 9 . 2311 . 1 1 15 GLY N N -2.610 4.092 4.216 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 9 . 2312 . 1 1 15 GLY O O -1.047 1.604 4.397 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 9 . 2313 . 1 1 15 GLY OXT O -2.992 0.636 4.157 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 10 . 2314 . 1 1 1 CYS C C -3.870 -7.132 1.669 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 10 . 2315 . 1 1 1 CYS CA C -4.967 -6.752 0.641 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 10 . 2316 . 1 1 1 CYS CB C -5.800 -5.533 1.088 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 10 . 2317 . 1 1 1 CYS H1 H -5.338 -8.717 0.040 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 10 . 2318 . 1 1 1 CYS H2 H -6.347 -8.197 1.240 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 10 . 2319 . 1 1 1 CYS H3 H -6.575 -7.680 -0.312 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 10 . 2320 . 1 1 1 CYS HA H -4.500 -6.497 -0.330 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 10 . 2321 . 1 1 1 CYS HB2 H -5.146 -4.658 1.262 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2322 . 1 1 1 CYS HB3 H -6.506 -5.225 0.293 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2323 . 1 1 1 CYS HG H -7.264 -4.655 2.734 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 10 . 2324 . 1 1 1 CYS N N -5.858 -7.904 0.387 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 10 . 2325 . 1 1 1 CYS O O -4.182 -7.532 2.797 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 10 . 2326 . 1 1 1 CYS SG S -6.742 -5.873 2.616 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 10 . 2327 . 1 1 2 ARG C C -0.199 -6.537 2.169 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 10 . 2328 . 1 1 2 ARG CA C -1.435 -7.482 2.095 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 10 . 2329 . 1 1 2 ARG CB C -1.230 -9.047 2.050 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 10 . 2330 . 1 1 2 ARG CD C 0.251 -9.572 -0.042 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 10 . 2331 . 1 1 2 ARG CG C -1.089 -9.774 0.687 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 10 . 2332 . 1 1 2 ARG CZ C 1.387 -10.388 -2.119 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 10 . 2333 . 1 1 2 ARG H H -2.456 -6.670 0.311 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 10 . 2334 . 1 1 2 ARG HA H -1.727 -7.304 3.131 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 10 . 2335 . 1 1 2 ARG HB2 H -0.369 -9.314 2.695 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2336 . 1 1 2 ARG HB3 H -2.084 -9.509 2.573 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2337 . 1 1 2 ARG HD2 H 0.409 -8.500 -0.255 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 10 . 2338 . 1 1 2 ARG HD3 H 1.085 -9.879 0.616 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 10 . 2339 . 1 1 2 ARG HE H -0.514 -10.835 -1.672 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 10 . 2340 . 1 1 2 ARG HG2 H -1.221 -10.857 0.873 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2341 . 1 1 2 ARG HG3 H -1.931 -9.492 0.029 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2342 . 1 1 2 ARG HH11 H 2.606 -9.284 -0.960 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 10 . 2343 . 1 1 2 ARG HH12 H 3.303 -9.925 -2.531 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 10 . 2344 . 1 1 2 ARG HH21 H 0.384 -11.513 -3.437 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 10 . 2345 . 1 1 2 ARG HH22 H 2.126 -11.103 -3.837 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 10 . 2346 . 1 1 2 ARG N N -2.583 -7.017 1.268 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 10 . 2347 . 1 1 2 ARG NE N 0.304 -10.328 -1.317 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 10 . 2348 . 1 1 2 ARG NH1 N 2.552 -9.804 -1.842 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 10 . 2349 . 1 1 2 ARG NH2 N 1.289 -11.069 -3.245 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 10 . 2350 . 1 1 2 ARG O O -0.322 -5.344 2.451 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 10 . 2351 . 1 1 3 ALA C C 2.827 -5.359 1.327 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 10 . 2352 . 1 1 3 ALA CA C 2.299 -6.513 2.227 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 10 . 2353 . 1 1 3 ALA CB C 3.154 -7.789 2.026 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 10 . 2354 . 1 1 3 ALA H H 0.906 -8.126 1.780 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 10 . 2355 . 1 1 3 ALA HA H 2.345 -6.205 3.288 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 10 . 2356 . 1 1 3 ALA HB1 H 3.033 -8.191 0.991 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 10 . 2357 . 1 1 3 ALA HB2 H 4.223 -7.570 2.148 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2358 . 1 1 3 ALA HB3 H 2.871 -8.609 2.711 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2359 . 1 1 3 ALA N N 0.980 -7.125 1.993 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 10 . 2360 . 1 1 3 ALA O O 3.000 -4.227 1.799 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 10 . 2361 . 1 1 4 LEU C C 2.049 -3.711 -1.307 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 10 . 2362 . 1 1 4 LEU CA C 3.281 -4.597 -0.997 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 10 . 2363 . 1 1 4 LEU CB C 4.030 -5.177 -2.225 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 10 . 2364 . 1 1 4 LEU CD1 C 4.212 -5.070 -4.759 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 10 . 2365 . 1 1 4 LEU CD2 C 2.464 -6.587 -3.624 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 10 . 2366 . 1 1 4 LEU CG C 3.267 -5.282 -3.577 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 10 . 2367 . 1 1 4 LEU H H 2.603 -6.535 -0.251 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 10 . 2368 . 1 1 4 LEU HA H 4.022 -3.909 -0.546 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 10 . 2369 . 1 1 4 LEU HB2 H 4.894 -4.516 -2.350 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2370 . 1 1 4 LEU HB3 H 4.522 -6.142 -1.987 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2371 . 1 1 4 LEU HD11 H 3.664 -5.099 -5.716 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 10 . 2372 . 1 1 4 LEU HD12 H 4.678 -4.065 -4.690 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 10 . 2373 . 1 1 4 LEU HD13 H 5.024 -5.815 -4.778 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 10 . 2374 . 1 1 4 LEU HD21 H 1.813 -6.631 -4.512 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 10 . 2375 . 1 1 4 LEU HD22 H 3.123 -7.472 -3.616 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 10 . 2376 . 1 1 4 LEU HD23 H 1.808 -6.666 -2.738 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 10 . 2377 . 1 1 4 LEU HG H 2.541 -4.457 -3.680 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 10 . 2378 . 1 1 4 LEU N N 3.006 -5.635 0.022 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 10 . 2379 . 1 1 4 LEU O O 2.231 -2.549 -1.652 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 10 . 2380 . 1 1 5 ILE C C -0.371 -2.370 -0.059 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 10 . 2381 . 1 1 5 ILE CA C -0.441 -3.506 -1.142 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 10 . 2382 . 1 1 5 ILE CB C -1.639 -4.501 -0.970 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 10 . 2383 . 1 1 5 ILE CD1 C -1.103 -6.874 -1.935 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 10 . 2384 . 1 1 5 ILE CG1 C -1.782 -5.514 -2.164 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 10 . 2385 . 1 1 5 ILE CG2 C -2.978 -3.727 -0.798 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 10 . 2386 . 1 1 5 ILE H H 0.837 -5.244 -0.882 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 10 . 2387 . 1 1 5 ILE HA H -0.596 -3.041 -2.128 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 10 . 2388 . 1 1 5 ILE HB H -1.427 -5.077 -0.041 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 10 . 2389 . 1 1 5 ILE HD11 H -1.649 -7.485 -1.200 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 10 . 2390 . 1 1 5 ILE HD12 H -1.037 -7.468 -2.864 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 10 . 2391 . 1 1 5 ILE HD13 H -0.073 -6.767 -1.552 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 10 . 2392 . 1 1 5 ILE HG12 H -2.841 -5.693 -2.423 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 10 . 2393 . 1 1 5 ILE HG13 H -1.351 -5.079 -3.083 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 10 . 2394 . 1 1 5 ILE HG21 H -2.992 -3.129 0.132 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 10 . 2395 . 1 1 5 ILE HG22 H -3.154 -3.017 -1.628 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 10 . 2396 . 1 1 5 ILE HG23 H -3.855 -4.390 -0.749 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 10 . 2397 . 1 1 5 ILE N N 0.823 -4.273 -1.219 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 10 . 2398 . 1 1 5 ILE O O -0.694 -1.238 -0.381 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 10 . 2399 . 1 1 6 LYS C C 1.573 -0.672 1.949 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 10 . 2400 . 1 1 6 LYS CA C 0.339 -1.593 2.199 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 10 . 2401 . 1 1 6 LYS CB C 0.170 -2.219 3.605 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 10 . 2402 . 1 1 6 LYS CD C -2.447 -2.610 3.060 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 10 . 2403 . 1 1 6 LYS CE C -3.830 -2.896 3.677 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 10 . 2404 . 1 1 6 LYS CG C -1.301 -2.393 4.104 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 10 . 2405 . 1 1 6 LYS H H 0.339 -3.622 1.328 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 10 . 2406 . 1 1 6 LYS HA H -0.489 -0.862 2.123 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 10 . 2407 . 1 1 6 LYS HB2 H 0.701 -3.189 3.655 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2408 . 1 1 6 LYS HB3 H 0.698 -1.595 4.351 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2409 . 1 1 6 LYS HD2 H -2.536 -1.705 2.416 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 10 . 2410 . 1 1 6 LYS HD3 H -2.191 -3.404 2.331 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 10 . 2411 . 1 1 6 LYS HE2 H -4.088 -2.121 4.422 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 10 . 2412 . 1 1 6 LYS HE3 H -4.604 -2.822 2.891 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 10 . 2413 . 1 1 6 LYS HG2 H -1.303 -3.225 4.833 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2414 . 1 1 6 LYS HG3 H -1.561 -1.499 4.701 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2415 . 1 1 6 LYS HZ1 H -3.730 -4.980 3.620 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 10 . 2416 . 1 1 6 LYS HZ2 H -3.244 -4.339 5.062 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 10 . 2417 . 1 1 6 LYS HZ3 H -4.851 -4.407 4.691 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 10 . 2418 . 1 1 6 LYS N N 0.085 -2.640 1.171 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 10 . 2419 . 1 1 6 LYS NZ N -3.920 -4.233 4.298 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 10 . 2420 . 1 1 6 LYS O O 1.509 0.484 2.363 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 10 . 2421 . 1 1 7 ARG C C 3.108 0.785 -0.448 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 10 . 2422 . 1 1 7 ARG CA C 3.674 -0.187 0.676 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 10 . 2423 . 1 1 7 ARG CB C 4.868 -1.030 0.147 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 10 . 2424 . 1 1 7 ARG CD C 6.928 -0.606 1.541 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 10 . 2425 . 1 1 7 ARG CG C 6.243 -0.342 0.197 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 10 . 2426 . 1 1 7 ARG CZ C 9.001 0.114 2.752 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 10 . 2427 . 1 1 7 ARG H H 2.735 -2.142 1.186 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 10 . 2428 . 1 1 7 ARG HA H 4.050 0.449 1.502 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 10 . 2429 . 1 1 7 ARG HB2 H 4.937 -2.018 0.646 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2430 . 1 1 7 ARG HB3 H 4.673 -1.286 -0.897 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2431 . 1 1 7 ARG HD2 H 6.236 -0.322 2.356 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 10 . 2432 . 1 1 7 ARG HD3 H 7.095 -1.698 1.632 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 10 . 2433 . 1 1 7 ARG HE H 8.569 0.705 0.888 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 10 . 2434 . 1 1 7 ARG HG2 H 6.875 -0.742 -0.618 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2435 . 1 1 7 ARG HG3 H 6.138 0.742 -0.003 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2436 . 1 1 7 ARG HH11 H 7.848 -1.108 3.860 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 10 . 2437 . 1 1 7 ARG HH12 H 9.400 -0.500 4.627 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 10 . 2438 . 1 1 7 ARG HH21 H 10.309 1.336 1.859 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 10 . 2439 . 1 1 7 ARG HH22 H 10.699 0.792 3.567 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 10 . 2440 . 1 1 7 ARG N N 2.665 -1.118 1.286 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 10 . 2441 . 1 1 7 ARG NE N 8.212 0.129 1.658 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 10 . 2442 . 1 1 7 ARG NH1 N 8.722 -0.569 3.861 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 10 . 2443 . 1 1 7 ARG NH2 N 10.116 0.818 2.723 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 10 . 2444 . 1 1 7 ARG O O 3.242 2.011 -0.340 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 10 . 2445 . 1 1 8 ILE C C 0.574 1.995 -1.775 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 10 . 2446 . 1 1 8 ILE CA C 1.638 1.083 -2.468 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 10 . 2447 . 1 1 8 ILE CB C 1.094 0.328 -3.743 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 10 . 2448 . 1 1 8 ILE CD1 C -1.454 -0.328 -3.355 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 10 . 2449 . 1 1 8 ILE CG1 C 0.031 -0.768 -3.474 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 10 . 2450 . 1 1 8 ILE CG2 C 2.255 -0.247 -4.596 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 10 . 2451 . 1 1 8 ILE H H 2.526 -0.768 -1.619 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 10 . 2452 . 1 1 8 ILE HA H 2.371 1.786 -2.901 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 10 . 2453 . 1 1 8 ILE HB H 0.617 1.076 -4.400 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 10 . 2454 . 1 1 8 ILE HD11 H -1.863 0.074 -4.297 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 10 . 2455 . 1 1 8 ILE HD12 H -2.104 -1.166 -3.039 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 10 . 2456 . 1 1 8 ILE HD13 H -1.628 0.453 -2.597 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 10 . 2457 . 1 1 8 ILE HG12 H 0.119 -1.590 -4.212 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 10 . 2458 . 1 1 8 ILE HG13 H 0.333 -1.246 -2.540 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 10 . 2459 . 1 1 8 ILE HG21 H 2.996 0.532 -4.856 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 10 . 2460 . 1 1 8 ILE HG22 H 2.798 -1.055 -4.070 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 10 . 2461 . 1 1 8 ILE HG23 H 1.892 -0.667 -5.552 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 10 . 2462 . 1 1 8 ILE N N 2.433 0.252 -1.501 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 10 . 2463 . 1 1 8 ILE O O 0.540 3.166 -2.125 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 10 . 2464 . 1 1 9 GLN C C -0.481 3.454 0.922 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 10 . 2465 . 1 1 9 GLN CA C -1.162 2.409 -0.014 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 10 . 2466 . 1 1 9 GLN CB C -2.239 1.641 0.799 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 10 . 2467 . 1 1 9 GLN CD C -4.501 0.369 0.711 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 10 . 2468 . 1 1 9 GLN CG C -3.217 0.786 -0.029 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 10 . 2469 . 1 1 9 GLN H H -0.091 0.540 -0.548 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 10 . 2470 . 1 1 9 GLN HA H -1.692 2.984 -0.794 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 10 . 2471 . 1 1 9 GLN HB2 H -1.754 1.004 1.561 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2472 . 1 1 9 GLN HB3 H -2.832 2.373 1.381 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2473 . 1 1 9 GLN HE21 H -4.269 -1.525 0.101 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 10 . 2474 . 1 1 9 GLN HE22 H -5.744 -1.144 1.125 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 10 . 2475 . 1 1 9 GLN HG2 H -3.506 1.283 -0.969 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2476 . 1 1 9 GLN HG3 H -2.642 -0.085 -0.357 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2477 . 1 1 9 GLN N N -0.216 1.533 -0.776 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 10 . 2478 . 1 1 9 GLN NE2 N -4.874 -0.897 0.642 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 10 . 2479 . 1 1 9 GLN O O -0.946 4.588 1.023 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 10 . 2480 . 1 1 9 GLN OE1 O -5.191 1.186 1.321 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 10 . 2481 . 1 1 10 ALA C C 1.938 5.335 1.157 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 10 . 2482 . 1 1 10 ALA CA C 1.609 4.123 2.107 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 10 . 2483 . 1 1 10 ALA CB C 2.894 3.401 2.575 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 10 . 2484 . 1 1 10 ALA H H 0.867 2.113 1.390 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 10 . 2485 . 1 1 10 ALA HA H 1.119 4.544 3.006 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 10 . 2486 . 1 1 10 ALA HB1 H 3.492 3.000 1.739 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 10 . 2487 . 1 1 10 ALA HB2 H 3.571 4.072 3.127 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2488 . 1 1 10 ALA HB3 H 2.681 2.540 3.235 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2489 . 1 1 10 ALA N N 0.665 3.113 1.528 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 10 . 2490 . 1 1 10 ALA O O 1.888 6.481 1.611 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 10 . 2491 . 1 1 11 MET C C 0.661 6.694 -1.624 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 10 . 2492 . 1 1 11 MET CA C 2.098 6.147 -1.208 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 10 . 2493 . 1 1 11 MET CB C 2.845 5.660 -2.489 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 10 . 2494 . 1 1 11 MET CE C 6.923 5.824 -1.598 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 10 . 2495 . 1 1 11 MET CG C 4.314 5.227 -2.325 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 10 . 2496 . 1 1 11 MET H H 2.312 4.084 -0.384 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 10 . 2497 . 1 1 11 MET HA H 2.666 7.023 -0.835 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 10 . 2498 . 1 1 11 MET HB2 H 2.292 4.820 -2.949 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2499 . 1 1 11 MET HB3 H 2.819 6.461 -3.253 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2500 . 1 1 11 MET HE1 H 7.263 5.365 -2.545 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 10 . 2501 . 1 1 11 MET HE2 H 6.866 5.032 -0.829 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 10 . 2502 . 1 1 11 MET HE3 H 7.686 6.556 -1.279 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 10 . 2503 . 1 1 11 MET HG2 H 4.405 4.407 -1.584 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2504 . 1 1 11 MET HG3 H 4.690 4.827 -3.285 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2505 . 1 1 11 MET N N 2.168 5.085 -0.152 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 10 . 2506 . 1 1 11 MET O O 0.499 7.905 -1.791 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 10 . 2507 . 1 1 11 MET SD S 5.325 6.631 -1.811 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 10 . 2508 . 1 1 12 ILE C C -2.762 6.821 -1.586 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 10 . 2509 . 1 1 12 ILE CA C -1.664 6.122 -2.488 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 10 . 2510 . 1 1 12 ILE CB C -1.950 4.901 -3.475 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 10 . 2511 . 1 1 12 ILE CD1 C -0.441 3.588 -5.171 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 10 . 2512 . 1 1 12 ILE CG1 C -1.012 4.943 -4.744 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 10 . 2513 . 1 1 12 ILE CG2 C -3.385 4.616 -3.990 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 10 . 2514 . 1 1 12 ILE H H -0.045 4.828 -1.713 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 10 . 2515 . 1 1 12 ILE HA H -1.519 6.924 -3.190 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 10 . 2516 . 1 1 12 ILE HB H -1.707 3.998 -2.887 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 10 . 2517 . 1 1 12 ILE HD11 H 0.392 3.295 -4.511 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 10 . 2518 . 1 1 12 ILE HD12 H -1.194 2.780 -5.137 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 10 . 2519 . 1 1 12 ILE HD13 H -0.023 3.631 -6.190 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 10 . 2520 . 1 1 12 ILE HG12 H -1.531 5.410 -5.603 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 10 . 2521 . 1 1 12 ILE HG13 H -0.145 5.610 -4.579 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 10 . 2522 . 1 1 12 ILE HG21 H -3.720 5.346 -4.742 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 10 . 2523 . 1 1 12 ILE HG22 H -3.420 3.612 -4.465 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 10 . 2524 . 1 1 12 ILE HG23 H -4.154 4.581 -3.206 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 10 . 2525 . 1 1 12 ILE N N -0.324 5.802 -1.875 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 10 . 2526 . 1 1 12 ILE O O -3.007 8.010 -1.825 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 10 . 2527 . 1 1 13 PRO C C -3.965 6.878 1.983 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 10 . 2528 . 1 1 13 PRO CA C -4.274 6.928 0.436 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 10 . 2529 . 1 1 13 PRO CB C -5.585 6.210 0.057 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 10 . 2530 . 1 1 13 PRO CD C -3.673 4.818 -0.501 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 10 . 2531 . 1 1 13 PRO CG C -5.194 4.784 -0.353 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 10 . 2532 . 1 1 13 PRO HA H -4.366 7.995 0.191 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 10 . 2533 . 1 1 13 PRO HB2 H -6.357 6.229 0.849 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2534 . 1 1 13 PRO HB3 H -6.022 6.731 -0.817 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2535 . 1 1 13 PRO HD2 H -3.178 4.359 0.348 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 10 . 2536 . 1 1 13 PRO HD3 H -3.307 4.276 -1.376 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 10 . 2537 . 1 1 13 PRO HG2 H -5.505 4.033 0.397 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2538 . 1 1 13 PRO HG3 H -5.665 4.516 -1.316 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2539 . 1 1 13 PRO N N -3.317 6.233 -0.489 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 10 . 2540 . 1 1 13 PRO O O -4.846 7.171 2.796 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 10 . 2541 . 1 1 14 LYS C C -3.013 5.289 4.579 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 10 . 2542 . 1 1 14 LYS CA C -2.253 6.401 3.777 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 10 . 2543 . 1 1 14 LYS CB C -2.074 7.776 4.504 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 10 . 2544 . 1 1 14 LYS CD C -0.995 9.794 3.121 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 10 . 2545 . 1 1 14 LYS CE C -1.429 9.522 1.664 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 10 . 2546 . 1 1 14 LYS CG C -0.819 8.605 4.103 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 10 . 2547 . 1 1 14 LYS H H -2.092 6.309 1.588 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 10 . 2548 . 1 1 14 LYS HA H -1.224 5.997 3.690 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 10 . 2549 . 1 1 14 LYS HB2 H -2.993 8.388 4.436 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 10 . 2550 . 1 1 14 LYS HB3 H -1.972 7.571 5.586 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 10 . 2551 . 1 1 14 LYS HD2 H -1.708 10.513 3.565 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 10 . 2552 . 1 1 14 LYS HD3 H -0.036 10.345 3.091 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 10 . 2553 . 1 1 14 LYS HE2 H -2.485 9.202 1.637 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 10 . 2554 . 1 1 14 LYS HE3 H -1.412 10.468 1.094 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 10 . 2555 . 1 1 14 LYS HG2 H -0.403 9.035 5.034 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 10 . 2556 . 1 1 14 LYS HG3 H -0.012 7.939 3.744 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 10 . 2557 . 1 1 14 LYS HZ1 H -0.625 7.609 1.416 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 10 . 2558 . 1 1 14 LYS HZ2 H -0.917 8.372 -0.006 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 10 . 2559 . 1 1 14 LYS HZ3 H 0.392 8.802 0.902 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 10 . 2560 . 1 1 14 LYS N N -2.715 6.544 2.369 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 10 . 2561 . 1 1 14 LYS NZ N -0.595 8.528 0.957 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 10 . 2562 . 1 1 14 LYS O O -3.636 5.554 5.613 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 10 . 2563 . 1 1 15 GLY C C -2.775 1.555 4.310 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 10 . 2564 . 1 1 15 GLY CA C -3.430 2.853 4.800 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 10 . 2565 . 1 1 15 GLY H H -2.562 4.010 3.119 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 10 . 2566 . 1 1 15 GLY HA2 H -3.258 2.940 5.890 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 10 . 2567 . 1 1 15 GLY HA3 H -4.528 2.798 4.667 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 10 . 2568 . 1 1 15 GLY N N -2.908 4.038 4.086 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 10 . 2569 . 1 1 15 GLY O O -3.507 0.647 3.859 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 10 . 2570 . 1 1 15 GLY OXT O -1.531 1.424 4.385 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 11 . 2571 . 1 1 1 CYS C C -3.634 -7.237 1.780 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 11 . 2572 . 1 1 1 CYS CA C -4.785 -6.899 0.796 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 11 . 2573 . 1 1 1 CYS CB C -5.658 -5.735 1.309 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 11 . 2574 . 1 1 1 CYS H1 H -5.080 -8.879 0.200 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 11 . 2575 . 1 1 1 CYS H2 H -6.054 -8.420 1.453 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 11 . 2576 . 1 1 1 CYS H3 H -6.388 -7.908 -0.081 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 11 . 2577 . 1 1 1 CYS HA H -4.374 -6.610 -0.190 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 11 . 2578 . 1 1 1 CYS HB2 H -6.141 -5.982 2.273 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2579 . 1 1 1 CYS HB3 H -5.040 -4.837 1.495 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2580 . 1 1 1 CYS HG H -6.127 -4.858 -0.856 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 11 . 2581 . 1 1 1 CYS N N -5.625 -8.096 0.579 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 11 . 2582 . 1 1 1 CYS O O -3.889 -7.619 2.928 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 11 . 2583 . 1 1 1 CYS SG S -6.948 -5.300 0.092 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 11 . 2584 . 1 1 2 ARG C C 0.029 -6.567 2.135 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 11 . 2585 . 1 1 2 ARG CA C -1.178 -7.554 2.094 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 11 . 2586 . 1 1 2 ARG CB C -0.931 -9.111 1.993 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 11 . 2587 . 1 1 2 ARG CD C 0.521 -9.510 -0.146 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 11 . 2588 . 1 1 2 ARG CG C -0.794 -9.788 0.604 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 11 . 2589 . 1 1 2 ARG CZ C 1.628 -10.191 -2.288 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 11 . 2590 . 1 1 2 ARG H H -2.294 -6.781 0.349 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 11 . 2591 . 1 1 2 ARG HA H -1.430 -7.412 3.147 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 11 . 2592 . 1 1 2 ARG HB2 H -0.050 -9.373 2.612 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2593 . 1 1 2 ARG HB3 H -1.760 -9.613 2.517 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2594 . 1 1 2 ARG HD2 H 0.635 -8.426 -0.325 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 11 . 2595 . 1 1 2 ARG HD3 H 1.381 -9.808 0.481 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 11 . 2596 . 1 1 2 ARG HE H -0.227 -10.766 -1.791 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 11 . 2597 . 1 1 2 ARG HG2 H -0.881 -10.881 0.757 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2598 . 1 1 2 ARG HG3 H -1.662 -9.518 -0.025 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2599 . 1 1 2 ARG HH11 H 2.819 -9.051 -1.135 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 11 . 2600 . 1 1 2 ARG HH12 H 3.496 -9.600 -2.749 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 11 . 2601 . 1 1 2 ARG HH21 H 0.646 -11.333 -3.606 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 11 . 2602 . 1 1 2 ARG HH22 H 2.345 -10.806 -4.052 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 11 . 2603 . 1 1 2 ARG N N -2.370 -7.111 1.317 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 11 . 2604 . 1 1 2 ARG NE N 0.572 -10.221 -1.448 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 11 . 2605 . 1 1 2 ARG NH1 N 2.764 -9.546 -2.031 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 11 . 2606 . 1 1 2 ARG NH2 N 1.530 -10.842 -3.431 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 11 . 2607 . 1 1 2 ARG O O -0.125 -5.369 2.378 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 11 . 2608 . 1 1 3 ALA C C 2.988 -5.290 1.307 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 11 . 2609 . 1 1 3 ALA CA C 2.527 -6.485 2.192 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 11 . 2610 . 1 1 3 ALA CB C 3.412 -7.730 1.910 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 11 . 2611 . 1 1 3 ALA H H 1.172 -8.141 1.805 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 11 . 2612 . 1 1 3 ALA HA H 2.603 -6.210 3.261 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 11 . 2613 . 1 1 3 ALA HB1 H 3.185 -8.584 2.572 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 11 . 2614 . 1 1 3 ALA HB2 H 3.259 -8.098 0.866 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2615 . 1 1 3 ALA HB3 H 4.479 -7.483 1.986 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2616 . 1 1 3 ALA N N 1.222 -7.133 1.983 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 11 . 2617 . 1 1 3 ALA O O 3.122 -4.160 1.795 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 11 . 2618 . 1 1 4 LEU C C 2.108 -3.659 -1.339 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 11 . 2619 . 1 1 4 LEU CA C 3.373 -4.490 -1.019 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 11 . 2620 . 1 1 4 LEU CB C 4.204 -5.013 -2.216 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 11 . 2621 . 1 1 4 LEU CD1 C 4.533 -4.621 -4.705 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 11 . 2622 . 1 1 4 LEU CD2 C 2.807 -6.355 -3.821 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 11 . 2623 . 1 1 4 LEU CG C 3.534 -5.020 -3.619 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 11 . 2624 . 1 1 4 LEU H H 2.807 -6.463 -0.273 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 11 . 2625 . 1 1 4 LEU HA H 4.053 -3.762 -0.540 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 11 . 2626 . 1 1 4 LEU HB2 H 5.098 -4.376 -2.232 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2627 . 1 1 4 LEU HB3 H 4.657 -6.003 -2.004 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2628 . 1 1 4 LEU HD11 H 4.918 -3.600 -4.497 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 11 . 2629 . 1 1 4 LEU HD12 H 5.400 -5.301 -4.742 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 11 . 2630 . 1 1 4 LEU HD13 H 4.051 -4.577 -5.696 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 11 . 2631 . 1 1 4 LEU HD21 H 3.509 -7.208 -3.810 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 11 . 2632 . 1 1 4 LEU HD22 H 2.085 -6.525 -2.998 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 11 . 2633 . 1 1 4 LEU HD23 H 2.234 -6.371 -4.761 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 11 . 2634 . 1 1 4 LEU HG H 2.763 -4.235 -3.698 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 11 . 2635 . 1 1 4 LEU N N 3.155 -5.540 -0.002 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 11 . 2636 . 1 1 4 LEU O O 2.235 -2.503 -1.726 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 11 . 2637 . 1 1 5 ILE C C -0.286 -2.367 -0.037 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 11 . 2638 . 1 1 5 ILE CA C -0.370 -3.514 -1.116 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 11 . 2639 . 1 1 5 ILE CB C -1.538 -4.536 -0.904 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 11 . 2640 . 1 1 5 ILE CD1 C -0.956 -6.860 -1.972 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 11 . 2641 . 1 1 5 ILE CG1 C -1.717 -5.532 -2.108 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 11 . 2642 . 1 1 5 ILE CG2 C -2.885 -3.797 -0.656 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 11 . 2643 . 1 1 5 ILE H H 0.959 -5.235 -0.919 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 11 . 2644 . 1 1 5 ILE HA H -0.566 -3.054 -2.097 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 11 . 2645 . 1 1 5 ILE HB H -1.276 -5.123 0.003 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 11 . 2646 . 1 1 5 ILE HD11 H 0.123 -6.719 -1.776 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 11 . 2647 . 1 1 5 ILE HD12 H -1.349 -7.465 -1.140 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 11 . 2648 . 1 1 5 ILE HD13 H -1.032 -7.478 -2.883 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 11 . 2649 . 1 1 5 ILE HG12 H -2.784 -5.765 -2.279 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 11 . 2650 . 1 1 5 ILE HG13 H -1.392 -5.055 -3.048 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 11 . 2651 . 1 1 5 ILE HG21 H -3.129 -3.094 -1.475 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 11 . 2652 . 1 1 5 ILE HG22 H -3.736 -4.486 -0.554 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 11 . 2653 . 1 1 5 ILE HG23 H -2.864 -3.199 0.275 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 11 . 2654 . 1 1 5 ILE N N 0.907 -4.257 -1.229 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 11 . 2655 . 1 1 5 ILE O O -0.659 -1.247 -0.350 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 11 . 2656 . 1 1 6 LYS C C 1.774 -0.615 1.828 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 11 . 2657 . 1 1 6 LYS CA C 0.557 -1.542 2.162 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 11 . 2658 . 1 1 6 LYS CB C 0.477 -2.164 3.579 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 11 . 2659 . 1 1 6 LYS CD C -2.170 -2.550 3.203 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 11 . 2660 . 1 1 6 LYS CE C -3.494 -2.931 3.896 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 11 . 2661 . 1 1 6 LYS CG C -0.960 -2.335 4.172 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 11 . 2662 . 1 1 6 LYS H H 0.541 -3.582 1.316 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 11 . 2663 . 1 1 6 LYS HA H -0.285 -0.823 2.126 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 11 . 2664 . 1 1 6 LYS HB2 H 1.006 -3.137 3.598 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2665 . 1 1 6 LYS HB3 H 1.056 -1.542 4.287 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2666 . 1 1 6 LYS HD2 H -2.323 -1.654 2.557 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 11 . 2667 . 1 1 6 LYS HD3 H -1.934 -3.344 2.468 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 11 . 2668 . 1 1 6 LYS HE2 H -4.234 -3.223 3.129 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 11 . 2669 . 1 1 6 LYS HE3 H -3.353 -3.826 4.530 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 11 . 2670 . 1 1 6 LYS HG2 H -0.921 -3.169 4.899 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2671 . 1 1 6 LYS HG3 H -1.176 -1.441 4.784 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2672 . 1 1 6 LYS HZ1 H -4.245 -0.999 4.137 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 11 . 2673 . 1 1 6 LYS HZ2 H -4.955 -2.104 5.138 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 11 . 2674 . 1 1 6 LYS HZ3 H -3.432 -1.552 5.460 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 11 . 2675 . 1 1 6 LYS N N 0.250 -2.610 1.167 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 11 . 2676 . 1 1 6 LYS NZ N -4.065 -1.836 4.704 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 11 . 2677 . 1 1 6 LYS O O 1.716 0.557 2.196 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 11 . 2678 . 1 1 7 ARG C C 3.128 0.848 -0.612 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 11 . 2679 . 1 1 7 ARG CA C 3.804 -0.156 0.412 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 11 . 2680 . 1 1 7 ARG CB C 4.916 -0.991 -0.308 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 11 . 2681 . 1 1 7 ARG CD C 6.707 -1.118 1.558 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 11 . 2682 . 1 1 7 ARG CG C 5.830 -1.889 0.562 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 11 . 2683 . 1 1 7 ARG CZ C 8.471 -1.633 3.262 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 11 . 2684 . 1 1 7 ARG H H 2.910 -2.100 1.085 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 11 . 2685 . 1 1 7 ARG HA H 4.299 0.469 1.179 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 11 . 2686 . 1 1 7 ARG HB2 H 4.447 -1.634 -1.070 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2687 . 1 1 7 ARG HB3 H 5.552 -0.331 -0.926 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2688 . 1 1 7 ARG HD2 H 7.296 -0.359 1.012 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 11 . 2689 . 1 1 7 ARG HD3 H 6.055 -0.579 2.271 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 11 . 2690 . 1 1 7 ARG HE H 7.627 -3.038 2.111 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 11 . 2691 . 1 1 7 ARG HG2 H 5.215 -2.630 1.107 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2692 . 1 1 7 ARG HG3 H 6.473 -2.483 -0.114 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2693 . 1 1 7 ARG HH11 H 8.018 0.326 3.195 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 11 . 2694 . 1 1 7 ARG HH12 H 9.297 -0.194 4.402 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 11 . 2695 . 1 1 7 ARG HH21 H 9.095 -3.517 3.520 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 11 . 2696 . 1 1 7 ARG HH22 H 9.864 -2.226 4.571 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 11 . 2697 . 1 1 7 ARG N N 2.839 -1.073 1.129 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 11 . 2698 . 1 1 7 ARG NE N 7.612 -2.030 2.301 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 11 . 2699 . 1 1 7 ARG NH1 N 8.610 -0.370 3.661 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 11 . 2700 . 1 1 7 ARG NH2 N 9.219 -2.552 3.843 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 11 . 2701 . 1 1 7 ARG O O 3.254 2.075 -0.479 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 11 . 2702 . 1 1 8 ILE C C 0.458 2.025 -1.767 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 11 . 2703 . 1 1 8 ILE CA C 1.512 1.147 -2.512 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 11 . 2704 . 1 1 8 ILE CB C 0.947 0.384 -3.772 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 11 . 2705 . 1 1 8 ILE CD1 C -1.550 -0.366 -3.290 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 11 . 2706 . 1 1 8 ILE CG1 C -0.059 -0.757 -3.473 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 11 . 2707 . 1 1 8 ILE CG2 C 2.094 -0.134 -4.679 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 11 . 2708 . 1 1 8 ILE H H 2.372 -0.703 -1.652 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 11 . 2709 . 1 1 8 ILE HA H 2.212 1.872 -2.963 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 11 . 2710 . 1 1 8 ILE HB H 0.415 1.118 -4.400 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 11 . 2711 . 1 1 8 ILE HD11 H -2.007 0.042 -4.207 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 11 . 2712 . 1 1 8 ILE HD12 H -2.163 -1.228 -2.965 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 11 . 2713 . 1 1 8 ILE HD13 H -1.713 0.397 -2.511 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 11 . 2714 . 1 1 8 ILE HG12 H 0.037 -1.567 -4.223 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 11 . 2715 . 1 1 8 ILE HG13 H 0.294 -1.233 -2.557 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 11 . 2716 . 1 1 8 ILE HG21 H 1.708 -0.558 -5.625 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 11 . 2717 . 1 1 8 ILE HG22 H 2.792 0.676 -4.960 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 11 . 2718 . 1 1 8 ILE HG23 H 2.690 -0.925 -4.186 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 11 . 2719 . 1 1 8 ILE N N 2.354 0.323 -1.591 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 11 . 2720 . 1 1 8 ILE O O 0.376 3.191 -2.123 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 11 . 2721 . 1 1 9 GLN C C -0.556 3.480 0.958 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 11 . 2722 . 1 1 9 GLN CA C -1.236 2.415 0.043 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 11 . 2723 . 1 1 9 GLN CB C -2.301 1.640 0.868 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 11 . 2724 . 1 1 9 GLN CD C -4.554 0.354 0.734 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 11 . 2725 . 1 1 9 GLN CG C -3.231 0.725 0.046 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 11 . 2726 . 1 1 9 GLN H H -0.131 0.564 -0.506 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 11 . 2727 . 1 1 9 GLN HA H -1.789 2.979 -0.731 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 11 . 2728 . 1 1 9 GLN HB2 H -1.811 1.043 1.661 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2729 . 1 1 9 GLN HB3 H -2.926 2.374 1.413 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2730 . 1 1 9 GLN HE21 H -4.011 -1.572 0.832 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 11 . 2731 . 1 1 9 GLN HE22 H -5.661 -1.126 1.503 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 11 . 2732 . 1 1 9 GLN HG2 H -3.472 1.160 -0.938 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2733 . 1 1 9 GLN HG3 H -2.639 -0.164 -0.193 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2734 . 1 1 9 GLN N N -0.285 1.552 -0.736 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 11 . 2735 . 1 1 9 GLN NE2 N -4.763 -0.912 1.056 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 11 . 2736 . 1 1 9 GLN O O -1.044 4.605 1.066 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 11 . 2737 . 1 1 9 GLN OE1 O -5.414 1.205 0.958 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 11 . 2738 . 1 1 10 ALA C C 1.836 5.408 1.066 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 11 . 2739 . 1 1 10 ALA CA C 1.552 4.220 2.059 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 11 . 2740 . 1 1 10 ALA CB C 2.861 3.542 2.518 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 11 . 2741 . 1 1 10 ALA H H 0.844 2.179 1.402 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 11 . 2742 . 1 1 10 ALA HA H 1.077 4.663 2.956 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 11 . 2743 . 1 1 10 ALA HB1 H 3.412 3.071 1.685 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 11 . 2744 . 1 1 10 ALA HB2 H 3.559 4.261 2.980 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2745 . 1 1 10 ALA HB3 H 2.680 2.744 3.262 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2746 . 1 1 10 ALA N N 0.613 3.173 1.539 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 11 . 2747 . 1 1 10 ALA O O 1.772 6.565 1.490 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 11 . 2748 . 1 1 11 MET C C 0.497 6.703 -1.713 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 11 . 2749 . 1 1 11 MET CA C 1.945 6.170 -1.318 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 11 . 2750 . 1 1 11 MET CB C 2.672 5.663 -2.602 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 11 . 2751 . 1 1 11 MET CE C 6.767 5.955 -1.827 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 11 . 2752 . 1 1 11 MET CG C 4.153 5.269 -2.457 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 11 . 2753 . 1 1 11 MET H H 2.227 4.128 -0.453 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 11 . 2754 . 1 1 11 MET HA H 2.514 7.056 -0.973 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 11 . 2755 . 1 1 11 MET HB2 H 2.127 4.799 -3.025 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2756 . 1 1 11 MET HB3 H 2.611 6.441 -3.387 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2757 . 1 1 11 MET HE1 H 7.091 5.480 -2.770 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 11 . 2758 . 1 1 11 MET HE2 H 6.753 5.184 -1.036 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 11 . 2759 . 1 1 11 MET HE3 H 7.519 6.716 -1.551 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 11 . 2760 . 1 1 11 MET HG2 H 4.281 4.478 -1.692 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2761 . 1 1 11 MET HG3 H 4.519 4.848 -3.412 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2762 . 1 1 11 MET N N 2.044 5.129 -0.242 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 11 . 2763 . 1 1 11 MET O O 0.332 7.908 -1.918 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 11 . 2764 . 1 1 11 MET SD S 5.141 6.714 -2.013 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 11 . 2765 . 1 1 12 ILE C C -2.926 6.826 -1.585 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 11 . 2766 . 1 1 12 ILE CA C -1.850 6.106 -2.496 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 11 . 2767 . 1 1 12 ILE CB C -2.156 4.865 -3.454 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 11 . 2768 . 1 1 12 ILE CD1 C -0.655 3.565 -5.160 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 11 . 2769 . 1 1 12 ILE CG1 C -1.268 4.908 -4.758 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 11 . 2770 . 1 1 12 ILE CG2 C -3.602 4.540 -3.910 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 11 . 2771 . 1 1 12 ILE H H -0.212 4.836 -1.723 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 11 . 2772 . 1 1 12 ILE HA H -1.723 6.895 -3.215 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 11 . 2773 . 1 1 12 ILE HB H -1.878 3.972 -2.866 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 11 . 2774 . 1 1 12 ILE HD11 H -1.374 2.730 -5.077 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 11 . 2775 . 1 1 12 ILE HD12 H -0.271 3.590 -6.194 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 11 . 2776 . 1 1 12 ILE HD13 H 0.209 3.330 -4.516 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 11 . 2777 . 1 1 12 ILE HG12 H -1.837 5.323 -5.612 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 11 . 2778 . 1 1 12 ILE HG13 H -0.425 5.616 -4.647 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 11 . 2779 . 1 1 12 ILE HG21 H -3.994 5.270 -4.634 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 11 . 2780 . 1 1 12 ILE HG22 H -3.626 3.543 -4.398 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 11 . 2781 . 1 1 12 ILE HG23 H -4.333 4.463 -3.092 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 11 . 2782 . 1 1 12 ILE N N -0.495 5.805 -1.910 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 11 . 2783 . 1 1 12 ILE O O -3.187 8.005 -1.854 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 11 . 2784 . 1 1 13 PRO C C -4.048 7.004 2.005 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 11 . 2785 . 1 1 13 PRO CA C -4.389 6.981 0.466 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 11 . 2786 . 1 1 13 PRO CB C -5.697 6.230 0.148 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 11 . 2787 . 1 1 13 PRO CD C -3.780 4.847 -0.415 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 11 . 2788 . 1 1 13 PRO CG C -5.297 4.798 -0.231 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 11 . 2789 . 1 1 13 PRO HA H -4.509 8.036 0.180 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 11 . 2790 . 1 1 13 PRO HB2 H -6.447 6.261 0.962 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2791 . 1 1 13 PRO HB3 H -6.167 6.719 -0.727 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2792 . 1 1 13 PRO HD2 H -3.265 4.417 0.438 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 11 . 2793 . 1 1 13 PRO HD3 H -3.422 4.281 -1.279 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 11 . 2794 . 1 1 13 PRO HG2 H -5.582 4.065 0.546 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2795 . 1 1 13 PRO HG3 H -5.787 4.496 -1.175 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2796 . 1 1 13 PRO N N -3.443 6.266 -0.455 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 11 . 2797 . 1 1 13 PRO O O -4.903 7.384 2.811 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 11 . 2798 . 1 1 14 LYS C C -3.140 5.550 4.692 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 11 . 2799 . 1 1 14 LYS CA C -2.335 6.566 3.808 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 11 . 2800 . 1 1 14 LYS CB C -2.091 7.975 4.447 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 11 . 2801 . 1 1 14 LYS CD C -1.001 9.905 2.966 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 11 . 2802 . 1 1 14 LYS CE C -1.509 9.601 1.540 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 11 . 2803 . 1 1 14 LYS CG C -0.822 8.737 3.970 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 11 . 2804 . 1 1 14 LYS H H -2.209 6.324 1.624 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 11 . 2805 . 1 1 14 LYS HA H -1.328 6.109 3.742 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 11 . 2806 . 1 1 14 LYS HB2 H -2.992 8.612 4.363 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 11 . 2807 . 1 1 14 LYS HB3 H -1.970 7.832 5.537 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 11 . 2808 . 1 1 14 LYS HD2 H -1.671 10.660 3.419 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 11 . 2809 . 1 1 14 LYS HD3 H -0.027 10.423 2.876 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 11 . 2810 . 1 1 14 LYS HE2 H -2.569 9.293 1.572 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 11 . 2811 . 1 1 14 LYS HE3 H -1.507 10.529 0.941 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 11 . 2812 . 1 1 14 LYS HG2 H -0.344 9.172 4.868 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 11 . 2813 . 1 1 14 LYS HG3 H -0.061 8.029 3.590 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 11 . 2814 . 1 1 14 LYS HZ1 H 0.268 8.837 0.725 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 11 . 2815 . 1 1 14 LYS HZ2 H -0.737 7.673 1.319 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 11 . 2816 . 1 1 14 LYS HZ3 H -1.083 8.395 -0.114 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 11 . 2817 . 1 1 14 LYS N N -2.807 6.639 2.396 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 11 . 2818 . 1 1 14 LYS NZ N -0.719 8.576 0.829 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 11 . 2819 . 1 1 14 LYS O O -3.701 5.907 5.734 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 11 . 2820 . 1 1 15 GLY C C -3.506 1.824 4.377 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 11 . 2821 . 1 1 15 GLY CA C -3.752 3.178 5.044 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 11 . 2822 . 1 1 15 GLY H H -2.835 4.166 3.288 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 11 . 2823 . 1 1 15 GLY HA2 H -3.331 3.158 6.068 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 11 . 2824 . 1 1 15 GLY HA3 H -4.839 3.351 5.162 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 11 . 2825 . 1 1 15 GLY N N -3.148 4.273 4.261 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 11 . 2826 . 1 1 15 GLY O O -2.360 1.321 4.408 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 11 . 2827 . 1 1 15 GLY OXT O -4.468 1.244 3.828 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 12 . 2828 . 1 1 1 CYS C C -3.929 -7.293 1.514 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 12 . 2829 . 1 1 1 CYS CA C -4.963 -6.991 0.398 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 12 . 2830 . 1 1 1 CYS CB C -6.143 -6.121 0.879 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 12 . 2831 . 1 1 1 CYS H1 H -5.968 -8.809 0.590 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 12 . 2832 . 1 1 1 CYS H2 H -6.159 -8.111 -0.895 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 12 . 2833 . 1 1 1 CYS H3 H -4.736 -8.858 -0.510 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 12 . 2834 . 1 1 1 CYS HA H -4.478 -6.463 -0.444 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 12 . 2835 . 1 1 1 CYS HB2 H -6.867 -5.945 0.060 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2836 . 1 1 1 CYS HB3 H -6.706 -6.610 1.697 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2837 . 1 1 1 CYS HG H -6.736 -4.014 1.785 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 12 . 2838 . 1 1 1 CYS N N -5.486 -8.266 -0.135 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 12 . 2839 . 1 1 1 CYS O O -4.302 -7.726 2.610 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 12 . 2840 . 1 1 1 CYS SG S -5.543 -4.504 1.463 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 12 . 2841 . 1 1 2 ARG C C -0.283 -6.596 2.215 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 12 . 2842 . 1 1 2 ARG CA C -1.516 -7.547 2.101 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 12 . 2843 . 1 1 2 ARG CB C -1.298 -9.114 2.052 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 12 . 2844 . 1 1 2 ARG CD C 0.226 -9.577 -0.025 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 12 . 2845 . 1 1 2 ARG CG C -1.116 -9.829 0.687 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 12 . 2846 . 1 1 2 ARG CZ C 1.404 -10.324 -2.105 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 12 . 2847 . 1 1 2 ARG H H -2.447 -6.732 0.271 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 12 . 2848 . 1 1 2 ARG HA H -1.858 -7.370 3.122 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 12 . 2849 . 1 1 2 ARG HB2 H -0.454 -9.382 2.719 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2850 . 1 1 2 ARG HB3 H -2.162 -9.585 2.548 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2851 . 1 1 2 ARG HD2 H 0.353 -8.498 -0.225 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 12 . 2852 . 1 1 2 ARG HD3 H 1.062 -9.865 0.639 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 12 . 2853 . 1 1 2 ARG HE H -0.476 -10.862 -1.667 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 12 . 2854 . 1 1 2 ARG HG2 H -1.218 -10.917 0.863 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 12 . 2855 . 1 1 2 ARG HG3 H -1.957 -9.567 0.019 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 12 . 2856 . 1 1 2 ARG HH11 H 2.566 -9.171 -0.934 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 12 . 2857 . 1 1 2 ARG HH12 H 3.297 -9.769 -2.507 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 12 . 2858 . 1 1 2 ARG HH21 H 0.459 -11.485 -3.433 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 12 . 2859 . 1 1 2 ARG HH22 H 2.181 -10.991 -3.824 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 12 . 2860 . 1 1 2 ARG N N -2.624 -7.097 1.214 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 12 . 2861 . 1 1 2 ARG NE N 0.317 -10.319 -1.306 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 12 . 2862 . 1 1 2 ARG NH1 N 2.539 -9.687 -1.820 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 12 . 2863 . 1 1 2 ARG NH2 N 1.341 -11.001 -3.235 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 12 . 2864 . 1 1 2 ARG O O -0.416 -5.400 2.480 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 12 . 2865 . 1 1 3 ALA C C 2.762 -5.410 1.501 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 12 . 2866 . 1 1 3 ALA CA C 2.215 -6.583 2.367 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 12 . 2867 . 1 1 3 ALA CB C 3.074 -7.856 2.141 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 12 . 2868 . 1 1 3 ALA H H 0.832 -8.191 1.884 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 12 . 2869 . 1 1 3 ALA HA H 2.247 -6.303 3.437 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 12 . 2870 . 1 1 3 ALA HB1 H 2.784 -8.697 2.796 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 12 . 2871 . 1 1 3 ALA HB2 H 2.967 -8.228 1.093 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2872 . 1 1 3 ALA HB3 H 4.142 -7.641 2.276 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2873 . 1 1 3 ALA N N 0.902 -7.189 2.090 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 12 . 2874 . 1 1 3 ALA O O 2.922 -4.285 1.991 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 12 . 2875 . 1 1 4 LEU C C 2.062 -3.762 -1.182 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 12 . 2876 . 1 1 4 LEU CA C 3.283 -4.637 -0.805 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 12 . 2877 . 1 1 4 LEU CB C 4.142 -5.192 -1.967 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 12 . 2878 . 1 1 4 LEU CD1 C 4.573 -4.841 -4.447 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 12 . 2879 . 1 1 4 LEU CD2 C 2.761 -6.508 -3.609 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 12 . 2880 . 1 1 4 LEU CG C 3.523 -5.195 -3.394 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 12 . 2881 . 1 1 4 LEU H H 2.598 -6.579 -0.083 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 12 . 2882 . 1 1 4 LEU HA H 3.971 -3.935 -0.296 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 12 . 2883 . 1 1 4 LEU HB2 H 5.051 -4.578 -1.957 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2884 . 1 1 4 LEU HB3 H 4.561 -6.191 -1.731 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2885 . 1 1 4 LEU HD11 H 4.983 -3.831 -4.236 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 12 . 2886 . 1 1 4 LEU HD12 H 5.418 -5.548 -4.446 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 12 . 2887 . 1 1 4 LEU HD13 H 4.129 -4.793 -5.455 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 12 . 2888 . 1 1 4 LEU HD21 H 2.005 -6.646 -2.812 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 12 . 2889 . 1 1 4 LEU HD22 H 2.221 -6.514 -4.569 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 12 . 2890 . 1 1 4 LEU HD23 H 3.434 -7.382 -3.566 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 12 . 2891 . 1 1 4 LEU HG H 2.782 -4.386 -3.509 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 12 . 2892 . 1 1 4 LEU N N 2.981 -5.674 0.202 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 12 . 2893 . 1 1 4 LEU O O 2.245 -2.612 -1.566 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 12 . 2894 . 1 1 5 ILE C C -0.341 -2.394 0.027 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 12 . 2895 . 1 1 5 ILE CA C -0.416 -3.535 -1.061 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 12 . 2896 . 1 1 5 ILE CB C -1.628 -4.515 -0.908 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 12 . 2897 . 1 1 5 ILE CD1 C -1.065 -6.861 -1.953 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 12 . 2898 . 1 1 5 ILE CG1 C -1.780 -5.509 -2.118 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 12 . 2899 . 1 1 5 ILE CG2 C -2.956 -3.720 -0.733 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 12 . 2900 . 1 1 5 ILE H H 0.844 -5.296 -0.804 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 12 . 2901 . 1 1 5 ILE HA H -0.551 -3.064 -2.047 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 12 . 2902 . 1 1 5 ILE HB H -1.434 -5.106 0.013 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 12 . 2903 . 1 1 5 ILE HD11 H -1.540 -7.482 -1.177 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 12 . 2904 . 1 1 5 ILE HD12 H -1.078 -7.452 -2.885 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 12 . 2905 . 1 1 5 ILE HD13 H -0.004 -6.754 -1.665 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 12 . 2906 . 1 1 5 ILE HG12 H -2.844 -5.708 -2.341 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 12 . 2907 . 1 1 5 ILE HG13 H -1.395 -5.041 -3.040 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 12 . 2908 . 1 1 5 ILE HG21 H -3.122 -3.004 -1.561 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 12 . 2909 . 1 1 5 ILE HG22 H -3.845 -4.367 -0.682 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 12 . 2910 . 1 1 5 ILE HG23 H -2.959 -3.124 0.199 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 12 . 2911 . 1 1 5 ILE N N 0.838 -4.319 -1.123 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 12 . 2912 . 1 1 5 ILE O O -0.681 -1.265 -0.293 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 12 . 2913 . 1 1 6 LYS C C 1.732 -0.711 1.941 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 12 . 2914 . 1 1 6 LYS CA C 0.472 -1.590 2.243 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 12 . 2915 . 1 1 6 LYS CB C 0.317 -2.182 3.665 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 12 . 2916 . 1 1 6 LYS CD C -2.334 -2.440 3.211 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 12 . 2917 . 1 1 6 LYS CE C -3.700 -2.663 3.890 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 12 . 2918 . 1 1 6 LYS CG C -1.143 -2.268 4.213 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 12 . 2919 . 1 1 6 LYS H H 0.416 -3.630 1.402 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 12 . 2920 . 1 1 6 LYS HA H -0.335 -0.835 2.171 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 12 . 2921 . 1 1 6 LYS HB2 H 0.795 -3.180 3.715 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2922 . 1 1 6 LYS HB3 H 0.903 -1.576 4.382 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2923 . 1 1 6 LYS HD2 H -2.409 -1.534 2.568 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 12 . 2924 . 1 1 6 LYS HD3 H -2.141 -3.246 2.476 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 12 . 2925 . 1 1 6 LYS HE2 H -3.879 -1.894 4.664 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 12 . 2926 . 1 1 6 LYS HE3 H -4.506 -2.525 3.146 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 12 . 2927 . 1 1 6 LYS HG2 H -1.166 -3.085 4.959 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 12 . 2928 . 1 1 6 LYS HG3 H -1.336 -1.352 4.801 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 12 . 2929 . 1 1 6 LYS HZ1 H -3.721 -4.747 3.782 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 12 . 2930 . 1 1 6 LYS HZ2 H -3.129 -4.171 5.212 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 12 . 2931 . 1 1 6 LYS HZ3 H -4.754 -4.140 4.920 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 12 . 2932 . 1 1 6 LYS N N 0.151 -2.652 1.247 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 12 . 2933 . 1 1 6 LYS NZ N -3.835 -4.008 4.484 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 12 . 2934 . 1 1 6 LYS O O 1.711 0.459 2.319 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 12 . 2935 . 1 1 7 ARG C C 3.208 0.709 -0.466 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 12 . 2936 . 1 1 7 ARG CA C 3.809 -0.312 0.582 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 12 . 2937 . 1 1 7 ARG CB C 4.933 -1.167 -0.090 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 12 . 2938 . 1 1 7 ARG CD C 6.710 -1.185 1.814 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 12 . 2939 . 1 1 7 ARG CG C 5.846 -2.000 0.835 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 12 . 2940 . 1 1 7 ARG CZ C 7.764 0.964 1.004 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 12 . 2941 . 1 1 7 ARG H H 2.835 -2.232 1.221 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 12 . 2942 . 1 1 7 ARG HA H 4.281 0.305 1.369 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 12 . 2943 . 1 1 7 ARG HB2 H 4.488 -1.841 -0.840 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2944 . 1 1 7 ARG HB3 H 5.590 -0.526 -0.701 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2945 . 1 1 7 ARG HD2 H 6.055 -0.574 2.460 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 12 . 2946 . 1 1 7 ARG HD3 H 7.196 -1.904 2.493 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 12 . 2947 . 1 1 7 ARG HE H 8.614 -0.832 0.765 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 12 . 2948 . 1 1 7 ARG HG2 H 5.225 -2.709 1.414 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 12 . 2949 . 1 1 7 ARG HG3 H 6.498 -2.644 0.215 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 12 . 2950 . 1 1 7 ARG HH11 H 5.999 1.296 1.910 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 12 . 2951 . 1 1 7 ARG HH12 H 6.890 2.759 1.254 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 12 . 2952 . 1 1 7 ARG HH21 H 9.529 0.902 0.064 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 12 . 2953 . 1 1 7 ARG HH22 H 8.750 2.548 0.282 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 12 . 2954 . 1 1 7 ARG N N 2.798 -1.204 1.267 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 12 . 2955 . 1 1 7 ARG NE N 7.781 -0.380 1.157 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 12 . 2956 . 1 1 7 ARG NH1 N 6.783 1.755 1.433 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 12 . 2957 . 1 1 7 ARG NH2 N 8.784 1.528 0.387 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 12 . 2958 . 1 1 7 ARG O O 3.368 1.931 -0.325 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 12 . 2959 . 1 1 8 ILE C C 0.634 1.972 -1.710 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 12 . 2960 . 1 1 8 ILE CA C 1.676 1.057 -2.425 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 12 . 2961 . 1 1 8 ILE CB C 1.113 0.304 -3.692 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 12 . 2962 . 1 1 8 ILE CD1 C -1.422 -0.351 -3.283 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 12 . 2963 . 1 1 8 ILE CG1 C 0.060 -0.796 -3.400 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 12 . 2964 . 1 1 8 ILE CG2 C 2.260 -0.265 -4.568 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 12 . 2965 . 1 1 8 ILE H H 2.442 -0.818 -1.531 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 12 . 2966 . 1 1 8 ILE HA H 2.413 1.753 -2.862 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 12 . 2967 . 1 1 8 ILE HB H 0.622 1.051 -4.338 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 12 . 2968 . 1 1 8 ILE HD11 H -2.071 -1.174 -2.928 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 12 . 2969 . 1 1 8 ILE HD12 H -1.584 0.461 -2.554 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 12 . 2970 . 1 1 8 ILE HD13 H -1.840 0.017 -4.234 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 12 . 2971 . 1 1 8 ILE HG12 H 0.158 -1.634 -4.120 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 12 . 2972 . 1 1 8 ILE HG13 H 0.363 -1.254 -2.456 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 12 . 2973 . 1 1 8 ILE HG21 H 2.993 0.517 -4.842 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 12 . 2974 . 1 1 8 ILE HG22 H 2.816 -1.071 -4.054 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 12 . 2975 . 1 1 8 ILE HG23 H 1.879 -0.686 -5.518 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 12 . 2976 . 1 1 8 ILE N N 2.462 0.208 -1.477 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 12 . 2977 . 1 1 8 ILE O O 0.614 3.145 -2.052 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 12 . 2978 . 1 1 9 GLN C C -0.418 3.438 0.989 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 12 . 2979 . 1 1 9 GLN CA C -1.102 2.401 0.046 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 12 . 2980 . 1 1 9 GLN CB C -2.199 1.649 0.846 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 12 . 2981 . 1 1 9 GLN CD C -4.472 0.406 0.724 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 12 . 2982 . 1 1 9 GLN CG C -3.172 0.803 0.004 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 12 . 2983 . 1 1 9 GLN H H -0.050 0.518 -0.489 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 12 . 2984 . 1 1 9 GLN HA H -1.618 2.984 -0.739 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 12 . 2985 . 1 1 9 GLN HB2 H -1.734 1.009 1.619 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 12 . 2986 . 1 1 9 GLN HB3 H -2.793 2.392 1.415 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 12 . 2987 . 1 1 9 GLN HE21 H -4.170 -1.522 0.271 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 12 . 2988 . 1 1 9 GLN HE22 H -5.691 -1.106 1.211 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 12 . 2989 . 1 1 9 GLN HG2 H -3.442 1.303 -0.941 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 12 . 2990 . 1 1 9 GLN HG3 H -2.602 -0.074 -0.317 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 12 . 2991 . 1 1 9 GLN N N -0.159 1.514 -0.710 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 12 . 2992 . 1 1 9 GLN NE2 N -4.811 -0.872 0.739 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 12 . 2993 . 1 1 9 GLN O O -0.871 4.578 1.083 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 12 . 2994 . 1 1 9 GLN OE1 O -5.202 1.248 1.247 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 12 . 2995 . 1 1 10 ALA C C 2.023 5.290 1.211 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 12 . 2996 . 1 1 10 ALA CA C 1.670 4.099 2.177 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 12 . 2997 . 1 1 10 ALA CB C 2.945 3.382 2.673 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 12 . 2998 . 1 1 10 ALA H H 0.916 2.088 1.469 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 12 . 2999 . 1 1 10 ALA HA H 1.176 4.545 3.063 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 12 . 3000 . 1 1 10 ALA HB1 H 3.510 2.902 1.855 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 12 . 3001 . 1 1 10 ALA HB2 H 3.648 4.078 3.163 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 12 . 3002 . 1 1 10 ALA HB3 H 2.719 2.585 3.405 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 12 . 3003 . 1 1 10 ALA N N 0.719 3.089 1.608 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 12 . 3004 . 1 1 10 ALA O O 1.989 6.443 1.649 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 12 . 3005 . 1 1 11 MET C C 0.807 6.654 -1.589 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 12 . 3006 . 1 1 11 MET CA C 2.228 6.073 -1.158 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 12 . 3007 . 1 1 11 MET CB C 2.982 5.564 -2.427 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 12 . 3008 . 1 1 11 MET CE C 6.132 5.529 -0.078 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 12 . 3009 . 1 1 11 MET CG C 4.413 5.027 -2.232 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 12 . 3010 . 1 1 11 MET H H 2.408 4.014 -0.311 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 12 . 3011 . 1 1 11 MET HA H 2.813 6.935 -0.784 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 12 . 3012 . 1 1 11 MET HB2 H 2.389 4.773 -2.924 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 12 . 3013 . 1 1 11 MET HB3 H 3.029 6.383 -3.170 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 12 . 3014 . 1 1 11 MET HE1 H 6.681 4.604 -0.329 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 12 . 3015 . 1 1 11 MET HE2 H 5.311 5.267 0.615 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 12 . 3016 . 1 1 11 MET HE3 H 6.824 6.207 0.453 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 12 . 3017 . 1 1 11 MET HG2 H 4.409 4.141 -1.566 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 12 . 3018 . 1 1 11 MET HG3 H 4.815 4.680 -3.202 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 12 . 3019 . 1 1 11 MET N N 2.259 5.018 -0.093 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 12 . 3020 . 1 1 11 MET O O 0.677 7.867 -1.767 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 12 . 3021 . 1 1 11 MET SD S 5.488 6.321 -1.568 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 12 . 3022 . 1 1 12 ILE C C -2.617 6.852 -1.574 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 12 . 3023 . 1 1 12 ILE CA C -1.526 6.127 -2.463 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 12 . 3024 . 1 1 12 ILE CB C -1.829 4.906 -3.446 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 12 . 3025 . 1 1 12 ILE CD1 C -0.325 3.565 -5.120 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 12 . 3026 . 1 1 12 ILE CG1 C -0.887 4.930 -4.712 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 12 . 3027 . 1 1 12 ILE CG2 C -3.265 4.634 -3.964 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 12 . 3028 . 1 1 12 ILE H H 0.058 4.805 -1.666 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 12 . 3029 . 1 1 12 ILE HA H -1.361 6.923 -3.167 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 12 . 3030 . 1 1 12 ILE HB H -1.601 4.001 -2.854 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 12 . 3031 . 1 1 12 ILE HD11 H 0.103 3.593 -6.135 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 12 . 3032 . 1 1 12 ILE HD12 H 0.497 3.272 -4.447 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 12 . 3033 . 1 1 12 ILE HD13 H -1.088 2.766 -5.086 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 12 . 3034 . 1 1 12 ILE HG12 H -1.400 5.390 -5.579 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 12 . 3035 . 1 1 12 ILE HG13 H -0.016 5.591 -4.552 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 12 . 3036 . 1 1 12 ILE HG21 H -3.592 5.366 -4.717 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 12 . 3037 . 1 1 12 ILE HG22 H -3.308 3.630 -4.437 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 12 . 3038 . 1 1 12 ILE HG23 H -4.036 4.605 -3.181 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 12 . 3039 . 1 1 12 ILE N N -0.197 5.784 -1.839 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 12 . 3040 . 1 1 12 ILE O O -2.838 8.044 -1.822 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 12 . 3041 . 1 1 13 PRO C C -3.847 6.963 1.982 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 12 . 3042 . 1 1 13 PRO CA C -4.144 6.998 0.434 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 12 . 3043 . 1 1 13 PRO CB C -5.461 6.293 0.053 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 12 . 3044 . 1 1 13 PRO CD C -3.565 4.870 -0.480 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 12 . 3045 . 1 1 13 PRO CG C -5.088 4.859 -0.345 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 12 . 3046 . 1 1 13 PRO HA H -4.221 8.063 0.176 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 12 . 3047 . 1 1 13 PRO HB2 H -6.237 6.328 0.840 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 12 . 3048 . 1 1 13 PRO HB3 H -5.887 6.813 -0.827 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 12 . 3049 . 1 1 13 PRO HD2 H -3.087 4.410 0.378 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 12 . 3050 . 1 1 13 PRO HD3 H -3.198 4.315 -1.345 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 12 . 3051 . 1 1 13 PRO HG2 H -5.416 4.117 0.407 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 12 . 3052 . 1 1 13 PRO HG3 H -5.554 4.591 -1.310 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 12 . 3053 . 1 1 13 PRO N N -3.189 6.280 -0.476 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 12 . 3054 . 1 1 13 PRO O O -4.726 7.293 2.783 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 12 . 3055 . 1 1 14 LYS C C -2.958 5.390 4.611 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 12 . 3056 . 1 1 14 LYS CA C -2.163 6.470 3.799 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 12 . 3057 . 1 1 14 LYS CB C -1.959 7.851 4.507 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 12 . 3058 . 1 1 14 LYS CD C -0.830 9.831 3.110 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 12 . 3059 . 1 1 14 LYS CE C -1.265 9.555 1.654 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 12 . 3060 . 1 1 14 LYS CG C -0.683 8.647 4.103 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 12 . 3061 . 1 1 14 LYS H H -1.991 6.326 1.614 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 12 . 3062 . 1 1 14 LYS HA H -1.144 6.041 3.729 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 12 . 3063 . 1 1 14 LYS HB2 H -2.864 8.483 4.423 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 12 . 3064 . 1 1 14 LYS HB3 H -1.868 7.660 5.593 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 12 . 3065 . 1 1 14 LYS HD2 H -1.529 10.570 3.545 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 12 . 3066 . 1 1 14 LYS HD3 H 0.141 10.361 3.078 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 12 . 3067 . 1 1 14 LYS HE2 H -2.327 9.254 1.627 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 12 . 3068 . 1 1 14 LYS HE3 H -1.229 10.495 1.076 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 12 . 3069 . 1 1 14 LYS HG2 H -0.259 9.075 5.031 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 12 . 3070 . 1 1 14 LYS HG3 H 0.109 7.960 3.751 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 12 . 3071 . 1 1 14 LYS HZ1 H -0.495 7.626 1.427 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 12 . 3072 . 1 1 14 LYS HZ2 H -0.769 8.380 -0.004 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 12 . 3073 . 1 1 14 LYS HZ3 H 0.545 8.794 0.906 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 12 . 3074 . 1 1 14 LYS N N -2.609 6.602 2.385 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 12 . 3075 . 1 1 14 LYS NZ N -0.447 8.539 0.959 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 12 . 3076 . 1 1 14 LYS O O -3.576 5.684 5.639 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 12 . 3077 . 1 1 15 GLY C C -2.855 1.649 4.353 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 12 . 3078 . 1 1 15 GLY CA C -3.447 2.971 4.858 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 12 . 3079 . 1 1 15 GLY H H -2.536 4.081 3.168 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 12 . 3080 . 1 1 15 GLY HA2 H -3.249 3.051 5.944 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 12 . 3081 . 1 1 15 GLY HA3 H -4.548 2.962 4.746 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 12 . 3082 . 1 1 15 GLY N N -2.887 4.131 4.133 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 12 . 3083 . 1 1 15 GLY O O -1.621 1.452 4.440 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 12 . 3084 . 1 1 15 GLY OXT O -3.628 0.789 3.879 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 13 . 3085 . 1 1 1 CYS C C -3.630 -7.258 1.728 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 13 . 3086 . 1 1 1 CYS CA C -4.745 -6.916 0.705 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 13 . 3087 . 1 1 1 CYS CB C -5.672 -5.775 1.173 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 13 . 3088 . 1 1 1 CYS H1 H -4.969 -8.881 0.034 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 13 . 3089 . 1 1 1 CYS H2 H -6.024 -8.476 1.238 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 13 . 3090 . 1 1 1 CYS H3 H -6.274 -7.924 -0.298 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 13 . 3091 . 1 1 1 CYS HA H -4.289 -6.594 -0.252 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 13 . 3092 . 1 1 1 CYS HB2 H -5.090 -4.855 1.363 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3093 . 1 1 1 CYS HB3 H -6.394 -5.510 0.378 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3094 . 1 1 1 CYS HG H -5.658 -5.866 3.554 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 13 . 3095 . 1 1 1 CYS N N -5.549 -8.119 0.402 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 13 . 3096 . 1 1 1 CYS O O -3.917 -7.736 2.832 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 13 . 3097 . 1 1 1 CYS SG S -6.604 -6.208 2.684 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 13 . 3098 . 1 1 2 ARG C C 0.031 -6.491 2.195 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 13 . 3099 . 1 1 2 ARG CA C -1.179 -7.476 2.146 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 13 . 3100 . 1 1 2 ARG CB C -0.925 -9.035 2.063 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 13 . 3101 . 1 1 2 ARG CD C 0.515 -9.447 -0.082 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 13 . 3102 . 1 1 2 ARG CG C -0.792 -9.728 0.682 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 13 . 3103 . 1 1 2 ARG CZ C 1.618 -10.159 -2.215 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 13 . 3104 . 1 1 2 ARG H H -2.247 -6.637 0.403 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 13 . 3105 . 1 1 2 ARG HA H -1.457 -7.320 3.189 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 13 . 3106 . 1 1 2 ARG HB2 H -0.042 -9.288 2.683 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3107 . 1 1 2 ARG HB3 H -1.751 -9.535 2.595 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3108 . 1 1 2 ARG HD2 H 0.618 -8.364 -0.274 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 13 . 3109 . 1 1 2 ARG HD3 H 1.381 -9.731 0.542 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 13 . 3110 . 1 1 2 ARG HE H -0.243 -10.712 -1.716 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 13 . 3111 . 1 1 2 ARG HG2 H -0.870 -10.819 0.847 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3112 . 1 1 2 ARG HG3 H -1.667 -9.471 0.055 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3113 . 1 1 2 ARG HH11 H 2.818 -9.020 -1.071 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 13 . 3114 . 1 1 2 ARG HH12 H 3.492 -9.591 -2.679 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 13 . 3115 . 1 1 2 ARG HH21 H 0.627 -11.305 -3.524 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 13 . 3116 . 1 1 2 ARG HH22 H 2.332 -10.798 -3.972 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 13 . 3117 . 1 1 2 ARG N N -2.353 -7.037 1.342 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 13 . 3118 . 1 1 2 ARG NE N 0.561 -10.171 -1.377 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 13 . 3119 . 1 1 2 ARG NH1 N 2.760 -9.523 -1.963 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 13 . 3120 . 1 1 2 ARG NH2 N 1.515 -10.820 -3.353 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 13 . 3121 . 1 1 2 ARG O O -0.120 -5.297 2.459 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 13 . 3122 . 1 1 3 ALA C C 2.998 -5.226 1.332 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 13 . 3123 . 1 1 3 ALA CA C 2.532 -6.411 2.228 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 13 . 3124 . 1 1 3 ALA CB C 3.412 -7.661 1.959 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 13 . 3125 . 1 1 3 ALA H H 1.170 -8.059 1.822 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 13 . 3126 . 1 1 3 ALA HA H 2.608 -6.127 3.294 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 13 . 3127 . 1 1 3 ALA HB1 H 3.179 -8.508 2.628 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 13 . 3128 . 1 1 3 ALA HB2 H 3.262 -8.038 0.917 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3129 . 1 1 3 ALA HB3 H 4.480 -7.416 2.037 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3130 . 1 1 3 ALA N N 1.223 -7.053 2.018 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 13 . 3131 . 1 1 3 ALA O O 3.149 -4.095 1.811 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 13 . 3132 . 1 1 4 LEU C C 2.114 -3.614 -1.324 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 13 . 3133 . 1 1 4 LEU CA C 3.375 -4.451 -1.004 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 13 . 3134 . 1 1 4 LEU CB C 4.200 -4.988 -2.197 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 13 . 3135 . 1 1 4 LEU CD1 C 4.520 -4.633 -4.691 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 13 . 3136 . 1 1 4 LEU CD2 C 2.798 -6.355 -3.777 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 13 . 3137 . 1 1 4 LEU CG C 3.523 -5.016 -3.596 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 13 . 3138 . 1 1 4 LEU H H 2.794 -6.410 -0.236 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 13 . 3139 . 1 1 4 LEU HA H 4.060 -3.721 -0.536 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 13 . 3140 . 1 1 4 LEU HB2 H 5.093 -4.351 -2.227 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3141 . 1 1 4 LEU HB3 H 4.656 -5.975 -1.975 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3142 . 1 1 4 LEU HD11 H 4.036 -4.603 -5.682 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 13 . 3143 . 1 1 4 LEU HD12 H 4.906 -3.610 -4.500 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 13 . 3144 . 1 1 4 LEU HD13 H 5.387 -5.313 -4.721 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 13 . 3145 . 1 1 4 LEU HD21 H 3.502 -7.206 -3.759 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 13 . 3146 . 1 1 4 LEU HD22 H 2.080 -6.516 -2.949 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 13 . 3147 . 1 1 4 LEU HD23 H 2.221 -6.384 -4.715 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 13 . 3148 . 1 1 4 LEU HG H 2.751 -4.232 -3.682 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 13 . 3149 . 1 1 4 LEU N N 3.157 -5.489 0.025 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 13 . 3150 . 1 1 4 LEU O O 2.245 -2.461 -1.720 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 13 . 3151 . 1 1 5 ILE C C -0.260 -2.311 0.014 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 13 . 3152 . 1 1 5 ILE CA C -0.358 -3.452 -1.071 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 13 . 3153 . 1 1 5 ILE CB C -1.535 -4.462 -0.858 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 13 . 3154 . 1 1 5 ILE CD1 C -0.962 -6.793 -1.926 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 13 . 3155 . 1 1 5 ILE CG1 C -1.723 -5.462 -2.057 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 13 . 3156 . 1 1 5 ILE CG2 C -2.874 -3.704 -0.616 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 13 . 3157 . 1 1 5 ILE H H 0.960 -5.179 -0.883 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 13 . 3158 . 1 1 5 ILE HA H -0.555 -2.983 -2.048 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 13 . 3159 . 1 1 5 ILE HB H -1.277 -5.046 0.053 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 13 . 3160 . 1 1 5 ILE HD11 H -1.362 -7.408 -1.104 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 13 . 3161 . 1 1 5 ILE HD12 H -1.032 -7.402 -2.844 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 13 . 3162 . 1 1 5 ILE HD13 H 0.114 -6.656 -1.721 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 13 . 3163 . 1 1 5 ILE HG12 H -2.790 -5.694 -2.221 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 13 . 3164 . 1 1 5 ILE HG13 H -1.402 -4.987 -2.999 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 13 . 3165 . 1 1 5 ILE HG21 H -3.100 -2.994 -1.435 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 13 . 3166 . 1 1 5 ILE HG22 H -3.740 -4.378 -0.524 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 13 . 3167 . 1 1 5 ILE HG23 H -2.851 -3.106 0.315 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 13 . 3168 . 1 1 5 ILE N N 0.911 -4.204 -1.201 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 13 . 3169 . 1 1 5 ILE O O -0.664 -1.197 -0.280 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 13 . 3170 . 1 1 6 LYS C C 1.859 -0.551 1.812 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 13 . 3171 . 1 1 6 LYS CA C 0.644 -1.468 2.178 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 13 . 3172 . 1 1 6 LYS CB C 0.569 -2.057 3.608 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 13 . 3173 . 1 1 6 LYS CD C -2.098 -2.357 3.274 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 13 . 3174 . 1 1 6 LYS CE C -3.393 -2.610 4.068 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 13 . 3175 . 1 1 6 LYS CG C -0.865 -2.182 4.219 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 13 . 3176 . 1 1 6 LYS H H 0.619 -3.514 1.346 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 13 . 3177 . 1 1 6 LYS HA H -0.186 -0.737 2.142 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 13 . 3178 . 1 1 6 LYS HB2 H 1.076 -3.041 3.642 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3179 . 1 1 6 LYS HB3 H 1.169 -1.432 4.295 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3180 . 1 1 6 LYS HD2 H -2.218 -1.458 2.626 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 13 . 3181 . 1 1 6 LYS HD3 H -1.931 -3.179 2.548 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 13 . 3182 . 1 1 6 LYS HE2 H -3.313 -3.549 4.647 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 13 . 3183 . 1 1 6 LYS HE3 H -3.555 -1.803 4.808 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 13 . 3184 . 1 1 6 LYS HG2 H -0.840 -3.013 4.949 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3185 . 1 1 6 LYS HG3 H -1.043 -1.279 4.832 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3186 . 1 1 6 LYS HZ1 H -5.430 -2.854 3.715 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 13 . 3187 . 1 1 6 LYS HZ2 H -4.701 -1.812 2.662 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 13 . 3188 . 1 1 6 LYS HZ3 H -4.479 -3.441 2.497 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 13 . 3189 . 1 1 6 LYS N N 0.307 -2.547 1.205 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 13 . 3190 . 1 1 6 LYS NZ N -4.568 -2.686 3.185 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 13 . 3191 . 1 1 6 LYS O O 1.818 0.623 2.177 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 13 . 3192 . 1 1 7 ARG C C 3.195 0.890 -0.667 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 13 . 3193 . 1 1 7 ARG CA C 3.869 -0.110 0.363 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 13 . 3194 . 1 1 7 ARG CB C 4.976 -0.955 -0.352 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 13 . 3195 . 1 1 7 ARG CD C 6.727 -1.153 1.554 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 13 . 3196 . 1 1 7 ARG CG C 5.859 -1.880 0.516 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 13 . 3197 . 1 1 7 ARG CZ C 7.202 -2.720 3.466 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 13 . 3198 . 1 1 7 ARG H H 2.968 -2.046 1.055 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 13 . 3199 . 1 1 7 ARG HA H 4.371 0.519 1.122 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 13 . 3200 . 1 1 7 ARG HB2 H 4.509 -1.593 -1.119 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3201 . 1 1 7 ARG HB3 H 5.628 -0.301 -0.958 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3202 . 1 1 7 ARG HD2 H 7.384 -0.436 1.032 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 13 . 3203 . 1 1 7 ARG HD3 H 6.093 -0.549 2.230 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 13 . 3204 . 1 1 7 ARG HE H 8.496 -2.377 1.969 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 13 . 3205 . 1 1 7 ARG HG2 H 5.221 -2.620 1.032 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3206 . 1 1 7 ARG HG3 H 6.507 -2.474 -0.157 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3207 . 1 1 7 ARG HH11 H 5.380 -1.881 3.613 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 13 . 3208 . 1 1 7 ARG HH12 H 5.865 -3.061 4.932 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 13 . 3209 . 1 1 7 ARG HH21 H 8.955 -3.683 3.543 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 13 . 3210 . 1 1 7 ARG HH22 H 7.755 -4.012 4.891 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 13 . 3211 . 1 1 7 ARG N N 2.905 -1.019 1.094 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 13 . 3212 . 1 1 7 ARG NE N 7.572 -2.105 2.320 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 13 . 3213 . 1 1 7 ARG NH1 N 6.027 -2.536 4.065 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 13 . 3214 . 1 1 7 ARG NH2 N 8.056 -3.558 4.022 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 13 . 3215 . 1 1 7 ARG O O 3.317 2.118 -0.536 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 13 . 3216 . 1 1 8 ILE C C 0.534 2.060 -1.804 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 13 . 3217 . 1 1 8 ILE CA C 1.566 1.175 -2.563 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 13 . 3218 . 1 1 8 ILE CB C 0.951 0.407 -3.796 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 13 . 3219 . 1 1 8 ILE CD1 C -1.550 -0.314 -3.277 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 13 . 3220 . 1 1 8 ILE CG1 C -0.059 -0.716 -3.438 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 13 . 3221 . 1 1 8 ILE CG2 C 2.060 -0.141 -4.730 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 13 . 3222 . 1 1 8 ILE H H 2.427 -0.668 -1.688 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 13 . 3223 . 1 1 8 ILE HA H 2.262 1.887 -3.040 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 13 . 3224 . 1 1 8 ILE HB H 0.408 1.145 -4.415 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 13 . 3225 . 1 1 8 ILE HD11 H -1.703 0.570 -2.634 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 13 . 3226 . 1 1 8 ILE HD12 H -2.041 -0.074 -4.234 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 13 . 3227 . 1 1 8 ILE HD13 H -2.140 -1.118 -2.794 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 13 . 3228 . 1 1 8 ILE HG12 H 0.039 -1.572 -4.136 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 13 . 3229 . 1 1 8 ILE HG13 H 0.287 -1.136 -2.490 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 13 . 3230 . 1 1 8 ILE HG21 H 2.759 0.656 -5.047 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 13 . 3231 . 1 1 8 ILE HG22 H 2.663 -0.931 -4.243 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 13 . 3232 . 1 1 8 ILE HG23 H 1.638 -0.577 -5.655 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 13 . 3233 . 1 1 8 ILE N N 2.421 0.358 -1.645 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 13 . 3234 . 1 1 8 ILE O O 0.482 3.232 -2.138 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 13 . 3235 . 1 1 9 GLN C C -0.510 3.491 0.920 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 13 . 3236 . 1 1 9 GLN CA C -1.175 2.431 -0.005 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 13 . 3237 . 1 1 9 GLN CB C -2.223 1.631 0.818 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 13 . 3238 . 1 1 9 GLN CD C -4.351 0.103 0.732 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 13 . 3239 . 1 1 9 GLN CG C -3.184 0.766 -0.020 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 13 . 3240 . 1 1 9 GLN H H -0.083 0.583 -0.579 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 13 . 3241 . 1 1 9 GLN HA H -1.723 3.005 -0.776 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 13 . 3242 . 1 1 9 GLN HB2 H -1.709 0.993 1.562 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3243 . 1 1 9 GLN HB3 H -2.831 2.338 1.416 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3244 . 1 1 9 GLN HE21 H -4.650 -1.106 -0.838 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 13 . 3245 . 1 1 9 GLN HE22 H -5.790 -1.284 0.588 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 13 . 3246 . 1 1 9 GLN HG2 H -3.593 1.332 -0.868 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3247 . 1 1 9 GLN HG3 H -2.560 0.003 -0.494 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3248 . 1 1 9 GLN N N -0.220 1.578 -0.787 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 13 . 3249 . 1 1 9 GLN NE2 N -4.987 -0.871 0.102 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 13 . 3250 . 1 1 9 GLN O O -1.010 4.609 1.035 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 13 . 3251 . 1 1 9 GLN OE1 O -4.723 0.463 1.848 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 13 . 3252 . 1 1 10 ALA C C 1.835 5.454 1.047 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 13 . 3253 . 1 1 10 ALA CA C 1.582 4.251 2.030 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 13 . 3254 . 1 1 10 ALA CB C 2.907 3.594 2.475 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 13 . 3255 . 1 1 10 ALA H H 0.903 2.207 1.334 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 13 . 3256 . 1 1 10 ALA HA H 1.101 4.677 2.932 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 13 . 3257 . 1 1 10 ALA HB1 H 2.747 2.797 3.224 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 13 . 3258 . 1 1 10 ALA HB2 H 3.453 3.128 1.635 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3259 . 1 1 10 ALA HB3 H 3.601 4.324 2.925 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3260 . 1 1 10 ALA N N 0.661 3.195 1.498 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 13 . 3261 . 1 1 10 ALA O O 1.726 6.606 1.477 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 13 . 3262 . 1 1 11 MET C C 0.423 6.672 -1.757 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 13 . 3263 . 1 1 11 MET CA C 1.900 6.223 -1.336 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 13 . 3264 . 1 1 11 MET CB C 2.738 5.792 -2.576 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 13 . 3265 . 1 1 11 MET CE C 6.674 6.862 -1.657 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 13 . 3266 . 1 1 11 MET CG C 4.261 5.684 -2.358 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 13 . 3267 . 1 1 11 MET H H 2.307 4.198 -0.460 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 13 . 3268 . 1 1 11 MET HA H 2.380 7.150 -0.965 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 13 . 3269 . 1 1 11 MET HB2 H 2.373 4.821 -2.958 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3270 . 1 1 11 MET HB3 H 2.569 6.507 -3.403 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3271 . 1 1 11 MET HE1 H 7.122 6.427 -2.569 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 13 . 3272 . 1 1 11 MET HE2 H 6.770 6.125 -0.838 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 13 . 3273 . 1 1 11 MET HE3 H 7.260 7.757 -1.381 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 13 . 3274 . 1 1 11 MET HG2 H 4.493 4.954 -1.558 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3275 . 1 1 11 MET HG3 H 4.751 5.312 -3.277 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3276 . 1 1 11 MET N N 2.060 5.188 -0.259 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 13 . 3277 . 1 1 11 MET O O 0.225 7.863 -2.011 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 13 . 3278 . 1 1 11 MET SD S 4.947 7.299 -1.931 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 13 . 3279 . 1 1 12 ILE C C -2.969 6.758 -1.601 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 13 . 3280 . 1 1 12 ILE CA C -1.917 6.019 -2.529 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 13 . 3281 . 1 1 12 ILE CB C -2.289 4.778 -3.475 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 13 . 3282 . 1 1 12 ILE CD1 C -0.100 4.379 -4.905 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 13 . 3283 . 1 1 12 ILE CG1 C -1.567 4.799 -4.876 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 13 . 3284 . 1 1 12 ILE CG2 C -3.775 4.496 -3.823 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 13 . 3285 . 1 1 12 ILE H H -0.261 4.788 -1.717 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 13 . 3286 . 1 1 12 ILE HA H -1.793 6.800 -3.256 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 13 . 3287 . 1 1 12 ILE HB H -1.963 3.878 -2.924 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 13 . 3288 . 1 1 12 ILE HD11 H 0.016 3.344 -4.542 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 13 . 3289 . 1 1 12 ILE HD12 H 0.302 4.409 -5.931 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 13 . 3290 . 1 1 12 ILE HD13 H 0.528 5.036 -4.284 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 13 . 3291 . 1 1 12 ILE HG12 H -2.067 4.120 -5.596 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 13 . 3292 . 1 1 12 ILE HG13 H -1.666 5.801 -5.333 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 13 . 3293 . 1 1 12 ILE HG21 H -3.867 3.471 -4.243 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 13 . 3294 . 1 1 12 ILE HG22 H -4.464 4.512 -2.970 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 13 . 3295 . 1 1 12 ILE HG23 H -4.173 5.193 -4.578 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 13 . 3296 . 1 1 12 ILE N N -0.558 5.748 -1.928 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 13 . 3297 . 1 1 12 ILE O O -3.243 7.931 -1.880 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 13 . 3298 . 1 1 13 PRO C C -3.944 6.962 2.034 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 13 . 3299 . 1 1 13 PRO CA C -4.353 6.942 0.510 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 13 . 3300 . 1 1 13 PRO CB C -5.675 6.193 0.243 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 13 . 3301 . 1 1 13 PRO CD C -3.781 4.795 -0.366 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 13 . 3302 . 1 1 13 PRO CG C -5.291 4.754 -0.131 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 13 . 3303 . 1 1 13 PRO HA H -4.470 7.999 0.232 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 13 . 3304 . 1 1 13 PRO HB2 H -6.397 6.238 1.079 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3305 . 1 1 13 PRO HB3 H -6.170 6.670 -0.625 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3306 . 1 1 13 PRO HD2 H -3.240 4.382 0.478 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 13 . 3307 . 1 1 13 PRO HD3 H -3.447 4.212 -1.229 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 13 . 3308 . 1 1 13 PRO HG2 H -5.552 4.031 0.665 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3309 . 1 1 13 PRO HG3 H -5.813 4.443 -1.053 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3310 . 1 1 13 PRO N N -3.450 6.214 -0.444 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 13 . 3311 . 1 1 13 PRO O O -4.773 7.283 2.891 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 13 . 3312 . 1 1 14 LYS C C -2.729 5.499 4.618 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 13 . 3313 . 1 1 14 LYS CA C -2.097 6.618 3.722 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 13 . 3314 . 1 1 14 LYS CB C -1.937 8.029 4.380 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 13 . 3315 . 1 1 14 LYS CD C -0.990 10.002 2.841 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 13 . 3316 . 1 1 14 LYS CE C -1.494 9.631 1.429 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 13 . 3317 . 1 1 14 LYS CG C -0.734 8.883 3.885 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 13 . 3318 . 1 1 14 LYS H H -2.116 6.338 1.545 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 13 . 3319 . 1 1 14 LYS HA H -1.057 6.266 3.573 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 13 . 3320 . 1 1 14 LYS HB2 H -2.880 8.606 4.332 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 13 . 3321 . 1 1 14 LYS HB3 H -1.776 7.877 5.464 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 13 . 3322 . 1 1 14 LYS HD2 H -1.696 10.733 3.277 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 13 . 3323 . 1 1 14 LYS HD3 H -0.047 10.569 2.725 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 13 . 3324 . 1 1 14 LYS HE2 H -2.547 9.306 1.479 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 13 . 3325 . 1 1 14 LYS HE3 H -1.512 10.538 0.797 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 13 . 3326 . 1 1 14 LYS HG2 H -0.304 9.385 4.772 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 13 . 3327 . 1 1 14 LYS HG3 H 0.088 8.229 3.536 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 13 . 3328 . 1 1 14 LYS HZ1 H -0.696 7.707 1.264 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 13 . 3329 . 1 1 14 LYS HZ2 H -1.065 8.372 -0.186 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 13 . 3330 . 1 1 14 LYS HZ3 H 0.289 8.861 0.620 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 13 . 3331 . 1 1 14 LYS N N -2.666 6.665 2.348 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 13 . 3332 . 1 1 14 LYS NZ N -0.693 8.595 0.746 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 13 . 3333 . 1 1 14 LYS O O -3.290 5.767 5.685 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 13 . 3334 . 1 1 15 GLY C C -2.259 1.783 4.429 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 13 . 3335 . 1 1 15 GLY CA C -2.929 3.053 4.969 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 13 . 3336 . 1 1 15 GLY H H -2.296 4.195 3.175 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 13 . 3337 . 1 1 15 GLY HA2 H -2.625 3.188 6.024 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 13 . 3338 . 1 1 15 GLY HA3 H -4.029 2.929 4.979 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 13 . 3339 . 1 1 15 GLY N N -2.575 4.240 4.164 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 13 . 3340 . 1 1 15 GLY O O -2.983 0.813 4.119 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 13 . 3341 . 1 1 15 GLY OXT O -1.011 1.734 4.328 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 14 . 3342 . 1 1 1 CYS C C -4.025 -7.356 1.431 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 14 . 3343 . 1 1 1 CYS CA C -4.989 -7.036 0.259 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 14 . 3344 . 1 1 1 CYS CB C -6.055 -5.992 0.644 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 14 . 3345 . 1 1 1 CYS H1 H -4.964 -8.981 -0.499 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 14 . 3346 . 1 1 1 CYS H2 H -6.205 -8.705 0.555 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 14 . 3347 . 1 1 1 CYS H3 H -6.280 -8.107 -0.982 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 14 . 3348 . 1 1 1 CYS HA H -4.424 -6.633 -0.603 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 14 . 3349 . 1 1 1 CYS HB2 H -6.716 -6.356 1.455 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3350 . 1 1 1 CYS HB3 H -5.575 -5.073 1.024 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3351 . 1 1 1 CYS HG H -7.821 -4.647 -0.184 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 14 . 3352 . 1 1 1 CYS N N -5.647 -8.279 -0.193 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 14 . 3353 . 1 1 1 CYS O O -4.467 -7.769 2.510 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 14 . 3354 . 1 1 1 CYS SG S -7.065 -5.546 -0.808 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 14 . 3355 . 1 1 2 ARG C C -0.407 -6.733 2.302 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 14 . 3356 . 1 1 2 ARG CA C -1.652 -7.659 2.139 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 14 . 3357 . 1 1 2 ARG CB C -1.454 -9.228 2.111 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 14 . 3358 . 1 1 2 ARG CD C 0.085 -9.726 0.052 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 14 . 3359 . 1 1 2 ARG CG C -1.263 -9.962 0.757 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 14 . 3360 . 1 1 2 ARG CZ C 1.301 -10.561 -1.972 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 14 . 3361 . 1 1 2 ARG H H -2.473 -6.839 0.263 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 14 . 3362 . 1 1 2 ARG HA H -2.041 -7.468 3.140 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 14 . 3363 . 1 1 2 ARG HB2 H -0.624 -9.499 2.793 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3364 . 1 1 2 ARG HB3 H -2.333 -9.681 2.598 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3365 . 1 1 2 ARG HD2 H 0.212 -8.652 -0.170 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 14 . 3366 . 1 1 2 ARG HD3 H 0.914 -9.998 0.731 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 14 . 3367 . 1 1 2 ARG HE H -0.616 -11.006 -1.594 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 14 . 3368 . 1 1 2 ARG HG2 H -1.371 -11.047 0.947 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3369 . 1 1 2 ARG HG3 H -2.097 -9.705 0.077 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3370 . 1 1 2 ARG HH11 H 2.473 -9.443 -0.778 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 14 . 3371 . 1 1 2 ARG HH12 H 3.230 -10.101 -2.315 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 14 . 3372 . 1 1 2 ARG HH21 H 0.350 -11.701 -3.315 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 14 . 3373 . 1 1 2 ARG HH22 H 2.106 -11.293 -3.652 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 14 . 3374 . 1 1 2 ARG N N -2.704 -7.192 1.198 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 14 . 3375 . 1 1 2 ARG NE N 0.187 -10.494 -1.213 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 14 . 3376 . 1 1 2 ARG NH1 N 2.453 -9.973 -1.657 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 14 . 3377 . 1 1 2 ARG NH2 N 1.247 -11.254 -3.093 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 14 . 3378 . 1 1 2 ARG O O -0.530 -5.552 2.634 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 14 . 3379 . 1 1 3 ALA C C 2.674 -5.569 1.589 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 14 . 3380 . 1 1 3 ALA CA C 2.089 -6.734 2.440 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 14 . 3381 . 1 1 3 ALA CB C 2.935 -8.017 2.255 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 14 . 3382 . 1 1 3 ALA H H 0.698 -8.310 1.869 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 14 . 3383 . 1 1 3 ALA HA H 2.094 -6.448 3.509 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 14 . 3384 . 1 1 3 ALA HB1 H 3.999 -7.815 2.433 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 14 . 3385 . 1 1 3 ALA HB2 H 2.608 -8.845 2.911 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3386 . 1 1 3 ALA HB3 H 2.858 -8.396 1.208 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3387 . 1 1 3 ALA N N 0.773 -7.321 2.132 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 14 . 3388 . 1 1 3 ALA O O 2.853 -4.454 2.093 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 14 . 3389 . 1 1 4 LEU C C 2.019 -3.871 -1.046 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 14 . 3390 . 1 1 4 LEU CA C 3.226 -4.776 -0.706 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 14 . 3391 . 1 1 4 LEU CB C 4.018 -5.356 -1.905 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 14 . 3392 . 1 1 4 LEU CD1 C 4.318 -5.231 -4.420 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 14 . 3393 . 1 1 4 LEU CD2 C 2.502 -6.737 -3.383 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 14 . 3394 . 1 1 4 LEU CG C 3.313 -5.440 -3.287 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 14 . 3395 . 1 1 4 LEU H H 2.481 -6.707 -0.014 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 14 . 3396 . 1 1 4 LEU HA H 3.956 -4.089 -0.232 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 14 . 3397 . 1 1 4 LEU HB2 H 4.897 -4.707 -1.987 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3398 . 1 1 4 LEU HB3 H 4.488 -6.329 -1.656 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3399 . 1 1 4 LEU HD11 H 5.122 -5.986 -4.401 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 14 . 3400 . 1 1 4 LEU HD12 H 3.820 -5.248 -5.404 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 14 . 3401 . 1 1 4 LEU HD13 H 4.792 -4.233 -4.320 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 14 . 3402 . 1 1 4 LEU HD21 H 1.895 -6.771 -4.303 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 14 . 3403 . 1 1 4 LEU HD22 H 3.152 -7.629 -3.349 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 14 . 3404 . 1 1 4 LEU HD23 H 1.801 -6.818 -2.531 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 14 . 3405 . 1 1 4 LEU HG H 2.601 -4.606 -3.413 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 14 . 3406 . 1 1 4 LEU N N 2.900 -5.824 0.289 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 14 . 3407 . 1 1 4 LEU O O 2.235 -2.714 -1.379 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 14 . 3408 . 1 1 5 ILE C C -0.401 -2.506 0.183 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 14 . 3409 . 1 1 5 ILE CA C -0.466 -3.608 -0.935 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 14 . 3410 . 1 1 5 ILE CB C -1.697 -4.571 -0.831 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 14 . 3411 . 1 1 5 ILE CD1 C -1.150 -6.924 -1.870 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 14 . 3412 . 1 1 5 ILE CG1 C -1.820 -5.550 -2.057 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 14 . 3413 . 1 1 5 ILE CG2 C -3.019 -3.756 -0.692 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 14 . 3414 . 1 1 5 ILE H H 0.763 -5.383 -0.687 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 14 . 3415 . 1 1 5 ILE HA H -0.580 -3.109 -1.910 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 14 . 3416 . 1 1 5 ILE HB H -1.532 -5.172 0.090 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 14 . 3417 . 1 1 5 ILE HD11 H -1.741 -7.590 -1.222 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 14 . 3418 . 1 1 5 ILE HD12 H -1.014 -7.453 -2.830 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 14 . 3419 . 1 1 5 ILE HD13 H -0.149 -6.846 -1.409 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 14 . 3420 . 1 1 5 ILE HG12 H -2.875 -5.709 -2.345 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 14 . 3421 . 1 1 5 ILE HG13 H -1.368 -5.086 -2.951 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 14 . 3422 . 1 1 5 ILE HG21 H -3.916 -4.393 -0.646 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 14 . 3423 . 1 1 5 ILE HG22 H -3.037 -3.141 0.228 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 14 . 3424 . 1 1 5 ILE HG23 H -3.160 -3.050 -1.533 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 14 . 3425 . 1 1 5 ILE N N 0.780 -4.405 -1.002 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 14 . 3426 . 1 1 5 ILE O O -0.681 -1.356 -0.118 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 14 . 3427 . 1 1 6 LYS C C 1.498 -0.894 2.297 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 14 . 3428 . 1 1 6 LYS CA C 0.241 -1.794 2.480 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 14 . 3429 . 1 1 6 LYS CB C 0.001 -2.436 3.867 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 14 . 3430 . 1 1 6 LYS CD C -2.613 -2.663 3.228 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 14 . 3431 . 1 1 6 LYS CE C -3.997 -2.895 3.862 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 14 . 3432 . 1 1 6 LYS CG C -1.491 -2.571 4.310 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 14 . 3433 . 1 1 6 LYS H H 0.223 -3.808 1.566 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 14 . 3434 . 1 1 6 LYS HA H -0.559 -1.035 2.386 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 14 . 3435 . 1 1 6 LYS HB2 H 0.500 -3.423 3.920 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3436 . 1 1 6 LYS HB3 H 0.521 -1.841 4.642 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3437 . 1 1 6 LYS HD2 H -2.632 -1.736 2.609 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 14 . 3438 . 1 1 6 LYS HD3 H -2.389 -3.461 2.491 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 14 . 3439 . 1 1 6 LYS HE2 H -4.002 -3.837 4.442 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 14 . 3440 . 1 1 6 LYS HE3 H -4.229 -2.086 4.581 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 14 . 3441 . 1 1 6 LYS HG2 H -1.558 -3.447 4.983 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3442 . 1 1 6 LYS HG3 H -1.722 -1.705 4.958 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3443 . 1 1 6 LYS HZ1 H -4.904 -3.705 2.172 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 14 . 3444 . 1 1 6 LYS HZ2 H -5.982 -3.102 3.270 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 14 . 3445 . 1 1 6 LYS HZ3 H -5.115 -2.072 2.314 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 14 . 3446 . 1 1 6 LYS N N 0.001 -2.817 1.421 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 14 . 3447 . 1 1 6 LYS NZ N -5.061 -2.948 2.846 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 14 . 3448 . 1 1 6 LYS O O 1.437 0.254 2.730 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 14 . 3449 . 1 1 7 ARG C C 3.200 0.536 -0.022 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 14 . 3450 . 1 1 7 ARG CA C 3.670 -0.433 1.148 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 14 . 3451 . 1 1 7 ARG CB C 4.903 -1.306 0.793 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 14 . 3452 . 1 1 7 ARG CD C 6.492 0.108 -0.663 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 14 . 3453 . 1 1 7 ARG CG C 6.261 -0.581 0.693 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 14 . 3454 . 1 1 7 ARG CZ C 8.058 2.046 -0.332 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 14 . 3455 . 1 1 7 ARG H H 2.629 -2.373 1.526 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 14 . 3456 . 1 1 7 ARG HA H 3.975 0.212 1.996 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 14 . 3457 . 1 1 7 ARG HB2 H 5.040 -2.092 1.561 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3458 . 1 1 7 ARG HB3 H 4.696 -1.853 -0.141 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3459 . 1 1 7 ARG HD2 H 6.424 -0.655 -1.460 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 14 . 3460 . 1 1 7 ARG HD3 H 5.680 0.823 -0.882 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 14 . 3461 . 1 1 7 ARG HE H 8.632 0.287 -1.112 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 14 . 3462 . 1 1 7 ARG HG2 H 6.366 0.140 1.526 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3463 . 1 1 7 ARG HG3 H 7.066 -1.325 0.851 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3464 . 1 1 7 ARG HH11 H 6.196 2.451 0.312 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 14 . 3465 . 1 1 7 ARG HH12 H 7.446 3.784 0.479 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 14 . 3466 . 1 1 7 ARG HH21 H 9.973 1.888 -0.893 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 14 . 3467 . 1 1 7 ARG HH22 H 9.441 3.483 -0.159 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 14 . 3468 . 1 1 7 ARG N N 2.601 -1.351 1.668 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 14 . 3469 . 1 1 7 ARG NE N 7.815 0.779 -0.738 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 14 . 3470 . 1 1 7 ARG NH1 N 7.138 2.843 0.209 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 14 . 3471 . 1 1 7 ARG NH2 N 9.281 2.520 -0.476 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 14 . 3472 . 1 1 7 ARG O O 3.365 1.758 0.085 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 14 . 3473 . 1 1 8 ILE C C 0.812 1.850 -1.478 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 14 . 3474 . 1 1 8 ILE CA C 1.866 0.895 -2.128 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 14 . 3475 . 1 1 8 ILE CB C 1.333 0.170 -3.425 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 14 . 3476 . 1 1 8 ILE CD1 C -1.264 -0.375 -3.156 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 14 . 3477 . 1 1 8 ILE CG1 C 0.205 -0.870 -3.194 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 14 . 3478 . 1 1 8 ILE CG2 C 2.495 -0.461 -4.234 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 14 . 3479 . 1 1 8 ILE H H 2.639 -0.993 -1.234 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 14 . 3480 . 1 1 8 ILE HA H 2.646 1.565 -2.528 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 14 . 3481 . 1 1 8 ILE HB H 0.919 0.943 -4.097 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 14 . 3482 . 1 1 8 ILE HD11 H -1.425 0.495 -2.497 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 14 . 3483 . 1 1 8 ILE HD12 H -1.646 -0.078 -4.146 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 14 . 3484 . 1 1 8 ILE HD13 H -1.943 -1.155 -2.758 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 14 . 3485 . 1 1 8 ILE HG12 H 0.295 -1.713 -3.907 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 14 . 3486 . 1 1 8 ILE HG13 H 0.432 -1.333 -2.232 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 14 . 3487 . 1 1 8 ILE HG21 H 2.147 -0.865 -5.203 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 14 . 3488 . 1 1 8 ILE HG22 H 3.282 0.281 -4.467 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 14 . 3489 . 1 1 8 ILE HG23 H 2.980 -1.293 -3.689 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 14 . 3490 . 1 1 8 ILE N N 2.586 0.030 -1.123 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 14 . 3491 . 1 1 8 ILE O O 0.856 3.030 -1.796 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 14 . 3492 . 1 1 9 GLN C C -0.308 3.296 1.200 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 14 . 3493 . 1 1 9 GLN CA C -0.986 2.292 0.215 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 14 . 3494 . 1 1 9 GLN CB C -2.112 1.529 0.963 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 14 . 3495 . 1 1 9 GLN CD C -4.276 0.071 0.771 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 14 . 3496 . 1 1 9 GLN CG C -3.081 0.735 0.066 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 14 . 3497 . 1 1 9 GLN H H 0.021 0.395 -0.336 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 14 . 3498 . 1 1 9 GLN HA H -1.462 2.901 -0.571 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 14 . 3499 . 1 1 9 GLN HB2 H -1.660 0.845 1.705 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3500 . 1 1 9 GLN HB3 H -2.707 2.250 1.559 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3501 . 1 1 9 GLN HE21 H -4.788 -0.793 -0.963 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 14 . 3502 . 1 1 9 GLN HE22 H -5.862 -1.121 0.488 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 14 . 3503 . 1 1 9 GLN HG2 H -3.453 1.353 -0.764 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3504 . 1 1 9 GLN HG3 H -2.477 -0.027 -0.434 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3505 . 1 1 9 GLN N N -0.049 1.398 -0.538 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 14 . 3506 . 1 1 9 GLN NE2 N -5.046 -0.705 0.026 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 14 . 3507 . 1 1 9 GLN O O -0.770 4.428 1.352 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 14 . 3508 . 1 1 9 GLN OE1 O -4.539 0.245 1.962 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 14 . 3509 . 1 1 10 ALA C C 2.145 5.105 1.565 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 14 . 3510 . 1 1 10 ALA CA C 1.779 3.859 2.456 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 14 . 3511 . 1 1 10 ALA CB C 3.055 3.103 2.905 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 14 . 3512 . 1 1 10 ALA H H 0.996 1.903 1.638 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 14 . 3513 . 1 1 10 ALA HA H 1.286 4.232 3.375 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 14 . 3514 . 1 1 10 ALA HB1 H 2.836 2.150 3.421 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 14 . 3515 . 1 1 10 ALA HB2 H 3.727 2.847 2.068 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3516 . 1 1 10 ALA HB3 H 3.671 3.703 3.592 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3517 . 1 1 10 ALA N N 0.822 2.904 1.810 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 14 . 3518 . 1 1 10 ALA O O 2.085 6.234 2.056 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 14 . 3519 . 1 1 11 MET C C 0.974 6.547 -1.238 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 14 . 3520 . 1 1 11 MET CA C 2.388 5.989 -0.769 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 14 . 3521 . 1 1 11 MET CB C 3.185 5.528 -2.028 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 14 . 3522 . 1 1 11 MET CE C 7.257 6.250 -1.425 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 14 . 3523 . 1 1 11 MET CG C 4.686 5.255 -1.837 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 14 . 3524 . 1 1 11 MET H H 2.566 3.899 0.006 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 14 . 3525 . 1 1 11 MET HA H 2.937 6.856 -0.352 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 14 . 3526 . 1 1 11 MET HB2 H 2.718 4.622 -2.459 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3527 . 1 1 11 MET HB3 H 3.094 6.290 -2.827 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3528 . 1 1 11 MET HE1 H 7.535 5.670 -2.324 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 14 . 3529 . 1 1 11 MET HE2 H 7.413 5.613 -0.537 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 14 . 3530 . 1 1 11 MET HE3 H 7.942 7.113 -1.348 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 14 . 3531 . 1 1 11 MET HG2 H 4.865 4.540 -1.010 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3532 . 1 1 11 MET HG3 H 5.087 4.789 -2.756 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3533 . 1 1 11 MET N N 2.426 4.896 0.258 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 14 . 3534 . 1 1 11 MET O O 0.826 7.763 -1.385 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 14 . 3535 . 1 1 11 MET SD S 5.546 6.811 -1.517 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 14 . 3536 . 1 1 12 ILE C C -2.453 6.721 -1.368 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 14 . 3537 . 1 1 12 ILE CA C -1.311 6.021 -2.218 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 14 . 3538 . 1 1 12 ILE CB C -1.561 4.827 -3.249 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 14 . 3539 . 1 1 12 ILE CD1 C 0.027 3.526 -4.883 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 14 . 3540 . 1 1 12 ILE CG1 C -0.555 4.880 -4.465 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 14 . 3541 . 1 1 12 ILE CG2 C -2.971 4.586 -3.847 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 14 . 3542 . 1 1 12 ILE H H 0.257 4.688 -1.400 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 14 . 3543 . 1 1 12 ILE HA H -1.114 6.834 -2.896 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 14 . 3544 . 1 1 12 ILE HB H -1.365 3.903 -2.673 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 14 . 3545 . 1 1 12 ILE HD11 H 0.511 3.586 -5.872 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 14 . 3546 . 1 1 12 ILE HD12 H 0.812 3.206 -4.178 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 14 . 3547 . 1 1 12 ILE HD13 H -0.737 2.729 -4.917 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 14 . 3548 . 1 1 12 ILE HG12 H -1.023 5.365 -5.344 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 14 . 3549 . 1 1 12 ILE HG13 H 0.307 5.536 -4.243 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 14 . 3550 . 1 1 12 ILE HG21 H -2.996 3.610 -4.376 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 14 . 3551 . 1 1 12 ILE HG22 H -3.776 4.519 -3.101 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 14 . 3552 . 1 1 12 ILE HG23 H -3.262 5.361 -4.573 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 14 . 3553 . 1 1 12 ILE N N -0.005 5.669 -1.551 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 14 . 3554 . 1 1 12 ILE O O -2.669 7.916 -1.604 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 14 . 3555 . 1 1 13 PRO C C -3.966 6.754 2.096 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 14 . 3556 . 1 1 13 PRO CA C -4.124 6.813 0.531 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 14 . 3557 . 1 1 13 PRO CB C -5.394 6.106 0.026 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 14 . 3558 . 1 1 13 PRO CD C -3.439 4.713 -0.365 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 14 . 3559 . 1 1 13 PRO CG C -4.968 4.676 -0.329 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 14 . 3560 . 1 1 13 PRO HA H -4.186 7.886 0.295 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 14 . 3561 . 1 1 13 PRO HB2 H -6.245 6.136 0.733 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3562 . 1 1 13 PRO HB3 H -5.729 6.635 -0.887 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3563 . 1 1 13 PRO HD2 H -2.993 4.247 0.509 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 14 . 3564 . 1 1 13 PRO HD3 H -3.020 4.185 -1.225 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 14 . 3565 . 1 1 13 PRO HG2 H -5.330 3.937 0.411 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3566 . 1 1 13 PRO HG3 H -5.367 4.388 -1.318 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3567 . 1 1 13 PRO N N -3.085 6.126 -0.314 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 14 . 3568 . 1 1 13 PRO O O -4.931 6.977 2.832 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 14 . 3569 . 1 1 14 LYS C C -2.690 5.444 4.887 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 14 . 3570 . 1 1 14 LYS CA C -2.313 6.684 4.004 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 14 . 3571 . 1 1 14 LYS CB C -2.631 8.064 4.674 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 14 . 3572 . 1 1 14 LYS CD C -1.242 9.760 3.137 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 14 . 3573 . 1 1 14 LYS CE C -1.154 9.393 1.633 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 14 . 3574 . 1 1 14 LYS CG C -2.563 9.377 3.851 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 14 . 3575 . 1 1 14 LYS H H -2.054 6.260 1.859 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 14 . 3576 . 1 1 14 LYS HA H -1.207 6.667 3.954 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 14 . 3577 . 1 1 14 LYS HB2 H -3.654 8.019 5.094 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 14 . 3578 . 1 1 14 LYS HB3 H -1.980 8.176 5.562 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 14 . 3579 . 1 1 14 LYS HD2 H -1.162 10.862 3.193 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 14 . 3580 . 1 1 14 LYS HD3 H -0.363 9.405 3.709 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 14 . 3581 . 1 1 14 LYS HE2 H -2.160 9.262 1.186 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 14 . 3582 . 1 1 14 LYS HE3 H -0.705 10.229 1.068 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 14 . 3583 . 1 1 14 LYS HG2 H -3.402 9.397 3.131 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 14 . 3584 . 1 1 14 LYS HG3 H -2.806 10.190 4.558 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 14 . 3585 . 1 1 14 LYS HZ1 H -0.304 7.975 0.368 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 14 . 3586 . 1 1 14 LYS HZ2 H 0.615 8.275 1.704 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 14 . 3587 . 1 1 14 LYS HZ3 H -0.753 7.355 1.821 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 14 . 3588 . 1 1 14 LYS N N -2.731 6.538 2.578 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 14 . 3589 . 1 1 14 LYS NZ N -0.351 8.186 1.372 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 14 . 3590 . 1 1 14 LYS O O -3.291 5.580 5.959 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 14 . 3591 . 1 1 15 GLY C C -1.858 1.773 4.556 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 14 . 3592 . 1 1 15 GLY CA C -2.528 2.993 5.194 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 14 . 3593 . 1 1 15 GLY H H -1.999 4.277 3.447 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 14 . 3594 . 1 1 15 GLY HA2 H -2.146 3.102 6.227 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 14 . 3595 . 1 1 15 GLY HA3 H -3.616 2.815 5.291 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 14 . 3596 . 1 1 15 GLY N N -2.296 4.241 4.431 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 14 . 3597 . 1 1 15 GLY O O -0.610 1.730 4.476 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 14 . 3598 . 1 1 15 GLY OXT O -2.579 0.833 4.156 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 15 . 3599 . 1 1 1 CYS C C -3.976 -7.811 1.514 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 15 . 3600 . 1 1 1 CYS CA C -4.910 -7.590 0.295 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 15 . 3601 . 1 1 1 CYS CB C -6.119 -6.694 0.629 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 15 . 3602 . 1 1 1 CYS H1 H -4.600 -9.505 -0.481 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 15 . 3603 . 1 1 1 CYS H2 H -5.920 -9.404 0.507 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 15 . 3604 . 1 1 1 CYS H3 H -5.988 -8.794 -1.026 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 15 . 3605 . 1 1 1 CYS HA H -4.354 -7.103 -0.528 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 15 . 3606 . 1 1 1 CYS HB2 H -6.769 -7.154 1.398 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3607 . 1 1 1 CYS HB3 H -5.783 -5.729 1.048 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3608 . 1 1 1 CYS HG H -6.183 -5.644 -1.506 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 15 . 3609 . 1 1 1 CYS N N -5.381 -8.899 -0.206 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 15 . 3610 . 1 1 1 CYS O O -4.431 -8.222 2.588 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 15 . 3611 . 1 1 1 CYS SG S -7.108 -6.356 -0.867 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 15 . 3612 . 1 1 2 ARG C C -0.404 -6.952 2.336 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 15 . 3613 . 1 1 2 ARG CA C -1.620 -7.927 2.326 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 15 . 3614 . 1 1 2 ARG CB C -1.335 -9.484 2.390 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 15 . 3615 . 1 1 2 ARG CD C 0.058 -9.913 0.203 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 15 . 3616 . 1 1 2 ARG CG C -1.152 -10.294 1.076 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 15 . 3617 . 1 1 2 ARG CZ C 1.014 -10.533 -2.029 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 15 . 3618 . 1 1 2 ARG H H -2.416 -7.230 0.388 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 15 . 3619 . 1 1 2 ARG HA H -2.033 -7.659 3.302 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 15 . 3620 . 1 1 2 ARG HB2 H -0.464 -9.667 3.049 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3621 . 1 1 2 ARG HB3 H -2.158 -9.953 2.948 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3622 . 1 1 2 ARG HD2 H 0.002 -8.842 -0.064 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 15 . 3623 . 1 1 2 ARG HD3 H 0.995 -10.036 0.776 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 15 . 3624 . 1 1 2 ARG HE H -0.537 -11.497 -1.203 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 15 . 3625 . 1 1 2 ARG HG2 H -1.068 -11.363 1.347 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3626 . 1 1 2 ARG HG3 H -2.079 -10.216 0.478 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3627 . 1 1 2 ARG HH11 H 1.987 -8.991 -1.177 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 15 . 3628 . 1 1 2 ARG HH12 H 2.578 -9.545 -2.823 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 15 . 3629 . 1 1 2 ARG HH21 H 0.221 -12.043 -3.075 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 15 . 3630 . 1 1 2 ARG HH22 H 1.643 -11.158 -3.823 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 15 . 3631 . 1 1 2 ARG N N -2.661 -7.568 1.325 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 15 . 3632 . 1 1 2 ARG NE N 0.120 -10.727 -1.036 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 15 . 3633 . 1 1 2 ARG NH1 N 1.955 -9.591 -2.008 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 15 . 3634 . 1 1 2 ARG NH2 N 0.952 -11.324 -3.083 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 15 . 3635 . 1 1 2 ARG O O -0.566 -5.743 2.502 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 15 . 3636 . 1 1 3 ALA C C 2.503 -5.715 1.453 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 15 . 3637 . 1 1 3 ALA CA C 2.097 -6.843 2.432 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 15 . 3638 . 1 1 3 ALA CB C 3.067 -8.028 2.218 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 15 . 3639 . 1 1 3 ALA H H 0.761 -8.534 2.119 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 15 . 3640 . 1 1 3 ALA HA H 2.148 -6.481 3.477 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 15 . 3641 . 1 1 3 ALA HB1 H 4.111 -7.682 2.250 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 15 . 3642 . 1 1 3 ALA HB2 H 2.902 -8.845 2.931 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3643 . 1 1 3 ALA HB3 H 2.930 -8.458 1.194 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3644 . 1 1 3 ALA N N 0.800 -7.516 2.237 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 15 . 3645 . 1 1 3 ALA O O 2.761 -4.578 1.858 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 15 . 3646 . 1 1 4 LEU C C 1.819 -4.139 -1.246 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 15 . 3647 . 1 1 4 LEU CA C 2.914 -5.178 -0.943 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 15 . 3648 . 1 1 4 LEU CB C 3.295 -6.069 -2.173 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 15 . 3649 . 1 1 4 LEU CD1 C 3.484 -4.534 -4.262 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 15 . 3650 . 1 1 4 LEU CD2 C 5.411 -4.745 -2.603 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 15 . 3651 . 1 1 4 LEU CG C 4.213 -5.448 -3.258 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 15 . 3652 . 1 1 4 LEU H H 2.081 -6.984 0.011 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 15 . 3653 . 1 1 4 LEU HA H 3.800 -4.602 -0.600 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 15 . 3654 . 1 1 4 LEU HB2 H 3.839 -6.967 -1.816 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3655 . 1 1 4 LEU HB3 H 2.384 -6.488 -2.643 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3656 . 1 1 4 LEU HD11 H 4.159 -4.211 -5.077 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 15 . 3657 . 1 1 4 LEU HD12 H 2.632 -5.053 -4.739 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 15 . 3658 . 1 1 4 LEU HD13 H 3.088 -3.618 -3.792 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 15 . 3659 . 1 1 4 LEU HD21 H 5.096 -3.799 -2.118 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 15 . 3660 . 1 1 4 LEU HD22 H 5.842 -5.380 -1.802 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 15 . 3661 . 1 1 4 LEU HD23 H 6.199 -4.514 -3.330 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 15 . 3662 . 1 1 4 LEU HG H 4.615 -6.293 -3.849 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 15 . 3663 . 1 1 4 LEU N N 2.556 -6.086 0.165 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 15 . 3664 . 1 1 4 LEU O O 2.145 -2.982 -1.486 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 15 . 3665 . 1 1 5 ILE C C -0.547 -2.655 0.096 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 15 . 3666 . 1 1 5 ILE CA C -0.658 -3.760 -1.020 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 15 . 3667 . 1 1 5 ILE CB C -1.836 -4.793 -0.846 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 15 . 3668 . 1 1 5 ILE CD1 C -1.264 -7.159 -1.864 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 15 . 3669 . 1 1 5 ILE CG1 C -1.974 -5.801 -2.054 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 15 . 3670 . 1 1 5 ILE CG2 C -3.196 -4.067 -0.648 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 15 . 3671 . 1 1 5 ILE H H 0.505 -5.552 -0.805 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 15 . 3672 . 1 1 5 ILE HA H -0.820 -3.260 -1.990 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 15 . 3673 . 1 1 5 ILE HB H -1.605 -5.383 0.075 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 15 . 3674 . 1 1 5 ILE HD11 H -1.221 -7.739 -2.801 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 15 . 3675 . 1 1 5 ILE HD12 H -0.216 -7.056 -1.520 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 15 . 3676 . 1 1 5 ILE HD13 H -1.772 -7.794 -1.122 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 15 . 3677 . 1 1 5 ILE HG12 H -3.032 -5.972 -2.319 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 15 . 3678 . 1 1 5 ILE HG13 H -1.554 -5.342 -2.966 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 15 . 3679 . 1 1 5 ILE HG21 H -4.014 -4.772 -0.428 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 15 . 3680 . 1 1 5 ILE HG22 H -3.176 -3.351 0.191 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 15 . 3681 . 1 1 5 ILE HG23 H -3.487 -3.485 -1.543 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 15 . 3682 . 1 1 5 ILE N N 0.557 -4.581 -1.142 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 15 . 3683 . 1 1 5 ILE O O -0.797 -1.496 -0.205 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 15 . 3684 . 1 1 6 LYS C C 1.228 -1.082 2.413 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 15 . 3685 . 1 1 6 LYS CA C -0.027 -1.996 2.456 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 15 . 3686 . 1 1 6 LYS CB C -0.322 -2.697 3.806 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 15 . 3687 . 1 1 6 LYS CD C -2.880 -3.003 3.032 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 15 . 3688 . 1 1 6 LYS CE C -4.303 -3.250 3.565 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 15 . 3689 . 1 1 6 LYS CG C -1.825 -2.898 4.173 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 15 . 3690 . 1 1 6 LYS H H -0.006 -3.988 1.486 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 15 . 3691 . 1 1 6 LYS HA H -0.824 -1.235 2.342 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 15 . 3692 . 1 1 6 LYS HB2 H 0.209 -3.667 3.851 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3693 . 1 1 6 LYS HB3 H 0.137 -2.118 4.631 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3694 . 1 1 6 LYS HD2 H -2.869 -2.078 2.411 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 15 . 3695 . 1 1 6 LYS HD3 H -2.595 -3.804 2.321 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 15 . 3696 . 1 1 6 LYS HE2 H -4.347 -4.209 4.115 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 15 . 3697 . 1 1 6 LYS HE3 H -4.585 -2.463 4.289 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 15 . 3698 . 1 1 6 LYS HG2 H -1.891 -3.797 4.816 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3699 . 1 1 6 LYS HG3 H -2.120 -2.060 4.831 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3700 . 1 1 6 LYS HZ1 H -6.242 -3.438 2.827 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 15 . 3701 . 1 1 6 LYS HZ2 H -5.313 -2.380 1.965 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 15 . 3702 . 1 1 6 LYS HZ3 H -5.089 -4.007 1.790 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 15 . 3703 . 1 1 6 LYS N N -0.193 -2.989 1.346 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 15 . 3704 . 1 1 6 LYS NZ N -5.293 -3.271 2.474 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 15 . 3705 . 1 1 6 LYS O O 1.121 0.060 2.860 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 15 . 3706 . 1 1 7 ARG C C 3.114 0.344 0.271 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 15 . 3707 . 1 1 7 ARG CA C 3.490 -0.608 1.476 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 15 . 3708 . 1 1 7 ARG CB C 4.747 -1.487 1.239 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 15 . 3709 . 1 1 7 ARG CD C 6.327 -0.270 -0.398 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 15 . 3710 . 1 1 7 ARG CG C 6.099 -0.764 1.041 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 15 . 3711 . 1 1 7 ARG CZ C 8.049 1.071 -1.634 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 15 . 3712 . 1 1 7 ARG H H 2.400 -2.531 1.650 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 15 . 3713 . 1 1 7 ARG HA H 3.722 0.040 2.344 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 15 . 3714 . 1 1 7 ARG HB2 H 4.880 -2.161 2.109 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3715 . 1 1 7 ARG HB3 H 4.556 -2.162 0.389 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3716 . 1 1 7 ARG HD2 H 6.195 -1.116 -1.099 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 15 . 3717 . 1 1 7 ARG HD3 H 5.552 0.469 -0.660 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 15 . 3718 . 1 1 7 ARG HE H 8.400 0.227 0.149 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 15 . 3719 . 1 1 7 ARG HG2 H 6.191 0.069 1.764 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3720 . 1 1 7 ARG HG3 H 6.906 -1.474 1.304 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3721 . 1 1 7 ARG HH11 H 6.309 0.945 -2.637 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 15 . 3722 . 1 1 7 ARG HH12 H 7.658 1.907 -3.424 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 15 . 3723 . 1 1 7 ARG HH21 H 9.864 1.346 -0.839 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 15 . 3724 . 1 1 7 ARG HH22 H 9.536 2.117 -2.471 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 15 . 3725 . 1 1 7 ARG N N 2.384 -1.530 1.889 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 15 . 3726 . 1 1 7 ARG NE N 7.673 0.336 -0.567 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 15 . 3727 . 1 1 7 ARG NH1 N 7.257 1.334 -2.673 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 15 . 3728 . 1 1 7 ARG NH2 N 9.274 1.560 -1.650 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 15 . 3729 . 1 1 7 ARG O O 3.400 1.548 0.328 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 15 . 3730 . 1 1 8 ILE C C 0.796 1.718 -1.246 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 15 . 3731 . 1 1 8 ILE CA C 1.845 0.738 -1.847 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 15 . 3732 . 1 1 8 ILE CB C 1.423 0.083 -3.214 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 15 . 3733 . 1 1 8 ILE CD1 C -1.149 -0.581 -3.151 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 15 . 3734 . 1 1 8 ILE CG1 C 0.339 -1.018 -3.125 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 15 . 3735 . 1 1 8 ILE CG2 C 2.669 -0.438 -3.979 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 15 . 3736 . 1 1 8 ILE H H 2.249 -1.159 -0.763 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 15 . 3737 . 1 1 8 ILE HA H 2.678 1.395 -2.159 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 15 . 3738 . 1 1 8 ILE HB H 1.015 0.880 -3.862 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 15 . 3739 . 1 1 8 ILE HD11 H -1.441 -0.068 -4.081 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 15 . 3740 . 1 1 8 ILE HD12 H -1.831 -1.444 -3.018 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 15 . 3741 . 1 1 8 ILE HD13 H -1.411 0.100 -2.321 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 15 . 3742 . 1 1 8 ILE HG12 H 0.556 -1.820 -3.857 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 15 . 3743 . 1 1 8 ILE HG13 H 0.495 -1.529 -2.178 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 15 . 3744 . 1 1 8 ILE HG21 H 2.405 -0.830 -4.979 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 15 . 3745 . 1 1 8 ILE HG22 H 3.412 0.365 -4.145 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 15 . 3746 . 1 1 8 ILE HG23 H 3.184 -1.249 -3.433 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 15 . 3747 . 1 1 8 ILE N N 2.449 -0.154 -0.803 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 15 . 3748 . 1 1 8 ILE O O 0.969 2.898 -1.510 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 15 . 3749 . 1 1 9 GLN C C -0.308 3.267 1.337 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 15 . 3750 . 1 1 9 GLN CA C -1.046 2.315 0.344 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 15 . 3751 . 1 1 9 GLN CB C -2.311 1.780 1.064 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 15 . 3752 . 1 1 9 GLN CD C -4.535 0.485 0.985 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 15 . 3753 . 1 1 9 GLN CG C -3.128 0.662 0.392 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 15 . 3754 . 1 1 9 GLN H H -0.215 0.319 -0.194 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 15 . 3755 . 1 1 9 GLN HA H -1.418 2.964 -0.468 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 15 . 3756 . 1 1 9 GLN HB2 H -2.054 1.437 2.086 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3757 . 1 1 9 GLN HB3 H -2.961 2.666 1.206 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3758 . 1 1 9 GLN HE21 H -5.363 1.170 -0.708 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 15 . 3759 . 1 1 9 GLN HE22 H -6.500 0.649 0.635 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 15 . 3760 . 1 1 9 GLN HG2 H -3.159 0.775 -0.710 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3761 . 1 1 9 GLN HG3 H -2.578 -0.269 0.579 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3762 . 1 1 9 GLN N N -0.176 1.327 -0.381 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 15 . 3763 . 1 1 9 GLN NE2 N -5.572 0.815 0.232 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 15 . 3764 . 1 1 9 GLN O O -0.689 4.429 1.477 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 15 . 3765 . 1 1 9 GLN OE1 O -4.701 0.041 2.120 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 15 . 3766 . 1 1 10 ALA C C 2.198 4.948 1.772 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 15 . 3767 . 1 1 10 ALA CA C 1.747 3.727 2.667 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 15 . 3768 . 1 1 10 ALA CB C 2.943 2.885 3.172 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 15 . 3769 . 1 1 10 ALA H H 0.920 1.803 1.876 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 15 . 3770 . 1 1 10 ALA HA H 1.233 4.135 3.559 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 15 . 3771 . 1 1 10 ALA HB1 H 3.634 2.590 2.366 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 15 . 3772 . 1 1 10 ALA HB2 H 3.560 3.435 3.899 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3773 . 1 1 10 ALA HB3 H 2.631 1.942 3.662 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3774 . 1 1 10 ALA N N 0.775 2.815 1.991 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 15 . 3775 . 1 1 10 ALA O O 2.128 6.088 2.233 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 15 . 3776 . 1 1 11 MET C C 1.273 6.352 -1.228 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 15 . 3777 . 1 1 11 MET CA C 2.612 5.779 -0.562 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 15 . 3778 . 1 1 11 MET CB C 3.571 5.298 -1.694 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 15 . 3779 . 1 1 11 MET CE C 6.175 7.508 -2.017 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 15 . 3780 . 1 1 11 MET CG C 5.041 5.038 -1.293 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 15 . 3781 . 1 1 11 MET H H 2.713 3.708 0.279 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 15 . 3782 . 1 1 11 MET HA H 3.104 6.659 -0.107 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 15 . 3783 . 1 1 11 MET HB2 H 3.167 4.380 -2.163 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3784 . 1 1 11 MET HB3 H 3.583 6.045 -2.510 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3785 . 1 1 11 MET HE1 H 5.251 7.804 -2.545 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 15 . 3786 . 1 1 11 MET HE2 H 6.816 6.950 -2.724 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 15 . 3787 . 1 1 11 MET HE3 H 6.709 8.430 -1.725 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 15 . 3788 . 1 1 11 MET HG2 H 5.099 4.210 -0.561 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3789 . 1 1 11 MET HG3 H 5.631 4.710 -2.169 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3790 . 1 1 11 MET N N 2.561 4.711 0.494 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 15 . 3791 . 1 1 11 MET O O 1.229 7.549 -1.522 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 15 . 3792 . 1 1 11 MET SD S 5.797 6.510 -0.561 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 15 . 3793 . 1 1 12 ILE C C -2.029 6.933 -1.733 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 15 . 3794 . 1 1 12 ILE CA C -0.992 5.898 -2.306 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 15 . 3795 . 1 1 12 ILE CB C -1.442 4.578 -3.118 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 15 . 3796 . 1 1 12 ILE CD1 C 0.832 4.067 -4.378 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 15 . 3797 . 1 1 12 ILE CG1 C -0.658 4.389 -4.468 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 15 . 3798 . 1 1 12 ILE CG2 C -2.925 4.361 -3.510 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 15 . 3799 . 1 1 12 ILE H H 0.403 4.547 -1.249 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 15 . 3800 . 1 1 12 ILE HA H -0.620 6.522 -3.097 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 15 . 3801 . 1 1 12 ILE HB H -1.251 3.708 -2.461 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 15 . 3802 . 1 1 12 ILE HD11 H 0.993 3.092 -3.895 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 15 . 3803 . 1 1 12 ILE HD12 H 1.279 4.004 -5.383 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 15 . 3804 . 1 1 12 ILE HD13 H 1.390 4.830 -3.811 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 15 . 3805 . 1 1 12 ILE HG12 H -1.098 3.576 -5.078 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 15 . 3806 . 1 1 12 ILE HG13 H -0.778 5.300 -5.082 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 15 . 3807 . 1 1 12 ILE HG21 H -3.282 5.101 -4.243 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 15 . 3808 . 1 1 12 ILE HG22 H -3.054 3.355 -3.967 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 15 . 3809 . 1 1 12 ILE HG23 H -3.617 4.351 -2.660 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 15 . 3810 . 1 1 12 ILE N N 0.222 5.529 -1.483 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 15 . 3811 . 1 1 12 ILE O O -2.123 8.022 -2.314 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 15 . 3812 . 1 1 13 PRO C C -3.342 8.296 1.420 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 15 . 3813 . 1 1 13 PRO CA C -3.656 7.727 0.006 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 15 . 3814 . 1 1 13 PRO CB C -4.988 6.963 -0.107 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 15 . 3815 . 1 1 13 PRO CD C -3.126 5.394 -0.169 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 15 . 3816 . 1 1 13 PRO CG C -4.651 5.465 -0.107 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 15 . 3817 . 1 1 13 PRO HA H -3.702 8.636 -0.599 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 15 . 3818 . 1 1 13 PRO HB2 H -5.731 7.239 0.666 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3819 . 1 1 13 PRO HB3 H -5.432 7.212 -1.089 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3820 . 1 1 13 PRO HD2 H -2.694 5.234 0.812 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 15 . 3821 . 1 1 13 PRO HD3 H -2.736 4.595 -0.809 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 15 . 3822 . 1 1 13 PRO HG2 H -5.050 4.942 0.780 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3823 . 1 1 13 PRO HG3 H -5.083 4.979 -1.000 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3824 . 1 1 13 PRO N N -2.720 6.727 -0.588 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 15 . 3825 . 1 1 13 PRO O O -3.984 9.270 1.826 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 15 . 3826 . 1 1 14 LYS C C -0.423 8.428 3.476 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 15 . 3827 . 1 1 14 LYS CA C -1.962 8.182 3.489 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 15 . 3828 . 1 1 14 LYS CB C -2.405 7.095 4.500 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 15 . 3829 . 1 1 14 LYS CD C -4.447 5.603 5.148 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 15 . 3830 . 1 1 14 LYS CE C -4.774 4.690 3.943 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 15 . 3831 . 1 1 14 LYS CG C -3.927 7.017 4.795 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 15 . 3832 . 1 1 14 LYS H H -2.037 6.836 1.725 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 15 . 3833 . 1 1 14 LYS HA H -2.463 9.132 3.771 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 15 . 3834 . 1 1 14 LYS HB2 H -2.021 6.123 4.140 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 15 . 3835 . 1 1 14 LYS HB3 H -1.887 7.270 5.455 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 15 . 3836 . 1 1 14 LYS HD2 H -3.759 5.097 5.852 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 15 . 3837 . 1 1 14 LYS HD3 H -5.384 5.730 5.722 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 15 . 3838 . 1 1 14 LYS HE2 H -5.350 3.815 4.294 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 15 . 3839 . 1 1 14 LYS HE3 H -5.444 5.218 3.238 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 15 . 3840 . 1 1 14 LYS HG2 H -4.151 7.706 5.632 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 15 . 3841 . 1 1 14 LYS HG3 H -4.521 7.414 3.951 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 15 . 3842 . 1 1 14 LYS HZ1 H -2.949 3.660 3.801 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 15 . 3843 . 1 1 14 LYS HZ2 H -3.845 3.604 2.417 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 15 . 3844 . 1 1 14 LYS HZ3 H -3.040 4.976 2.813 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 15 . 3845 . 1 1 14 LYS N N -2.366 7.720 2.137 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 15 . 3846 . 1 1 14 LYS NZ N -3.588 4.204 3.212 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 15 . 3847 . 1 1 14 LYS O O 0.364 7.564 3.877 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 15 . 3848 . 1 1 15 GLY C C 1.987 9.578 1.472 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 15 . 3849 . 1 1 15 GLY CA C 1.415 9.979 2.840 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 15 . 3850 . 1 1 15 GLY H H -0.766 10.241 2.677 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 15 . 3851 . 1 1 15 GLY HA2 H 1.517 11.073 2.955 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 15 . 3852 . 1 1 15 GLY HA3 H 2.027 9.546 3.656 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 15 . 3853 . 1 1 15 GLY N N -0.013 9.620 2.994 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 15 . 3854 . 1 1 15 GLY O O 1.476 10.048 0.431 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 15 . 3855 . 1 1 15 GLY OXT O 2.966 8.802 1.435 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 16 . 3856 . 1 1 1 CYS C C -4.069 -7.688 1.449 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 16 . 3857 . 1 1 1 CYS CA C -5.039 -7.378 0.278 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 16 . 3858 . 1 1 1 CYS CB C -6.115 -6.337 0.647 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 16 . 3859 . 1 1 1 CYS H1 H -6.245 -9.059 0.549 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 16 . 3860 . 1 1 1 CYS H2 H -6.308 -8.451 -0.985 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 16 . 3861 . 1 1 1 CYS H3 H -4.991 -9.319 -0.494 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 16 . 3862 . 1 1 1 CYS HA H -4.473 -6.970 -0.581 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 16 . 3863 . 1 1 1 CYS HB2 H -5.645 -5.394 0.982 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 16 . 3864 . 1 1 1 CYS HB3 H -6.724 -6.071 -0.238 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 16 . 3865 . 1 1 1 CYS HG H -7.966 -5.837 2.043 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 16 . 3866 . 1 1 1 CYS N N -5.682 -8.624 -0.190 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 16 . 3867 . 1 1 1 CYS O O -4.501 -8.119 2.524 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 16 . 3868 . 1 1 1 CYS SG S -7.226 -6.940 1.966 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 16 . 3869 . 1 1 2 ARG C C -0.468 -6.936 2.224 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 16 . 3870 . 1 1 2 ARG CA C -1.696 -7.893 2.192 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 16 . 3871 . 1 1 2 ARG CB C -1.435 -9.454 2.208 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 16 . 3872 . 1 1 2 ARG CD C 0.029 -9.868 0.065 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 16 . 3873 . 1 1 2 ARG CG C -1.236 -10.219 0.871 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 16 . 3874 . 1 1 2 ARG CZ C 1.052 -10.464 -2.143 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 16 . 3875 . 1 1 2 ARG H H -2.522 -7.130 0.290 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 16 . 3876 . 1 1 2 ARG HA H -2.091 -7.648 3.182 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 16 . 3877 . 1 1 2 ARG HB2 H -0.579 -9.671 2.878 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 16 . 3878 . 1 1 2 ARG HB3 H -2.276 -9.930 2.733 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 16 . 3879 . 1 1 2 ARG HD2 H 0.034 -8.789 -0.169 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 16 . 3880 . 1 1 2 ARG HD3 H 0.932 -10.053 0.674 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 16 . 3881 . 1 1 2 ARG HE H -0.576 -11.379 -1.417 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 16 . 3882 . 1 1 2 ARG HG2 H -1.212 -11.300 1.103 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 16 . 3883 . 1 1 2 ARG HG3 H -2.131 -10.075 0.238 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 16 . 3884 . 1 1 2 ARG HH11 H 2.057 -8.997 -1.200 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 16 . 3885 . 1 1 2 ARG HH12 H 2.693 -9.527 -2.838 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 16 . 3886 . 1 1 2 ARG HH21 H 0.237 -11.901 -3.272 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 16 . 3887 . 1 1 2 ARG HH22 H 1.729 -11.061 -3.929 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 16 . 3888 . 1 1 2 ARG N N -2.752 -7.490 1.223 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 16 . 3889 . 1 1 2 ARG NE N 0.109 -10.647 -1.196 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 16 . 3890 . 1 1 2 ARG NH1 N 2.035 -9.569 -2.052 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 16 . 3891 . 1 1 2 ARG NH2 N 1.000 -11.217 -3.225 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 16 . 3892 . 1 1 2 ARG O O -0.616 -5.724 2.380 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 16 . 3893 . 1 1 3 ALA C C 2.468 -5.725 1.428 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 16 . 3894 . 1 1 3 ALA CA C 2.031 -6.858 2.389 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 16 . 3895 . 1 1 3 ALA CB C 2.992 -8.051 2.183 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 16 . 3896 . 1 1 3 ALA H H 0.683 -8.535 2.054 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 16 . 3897 . 1 1 3 ALA HA H 2.064 -6.507 3.438 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 16 . 3898 . 1 1 3 ALA HB1 H 2.870 -8.472 1.154 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 16 . 3899 . 1 1 3 ALA HB2 H 4.040 -7.716 2.236 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 16 . 3900 . 1 1 3 ALA HB3 H 2.806 -8.872 2.887 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 16 . 3901 . 1 1 3 ALA N N 0.731 -7.516 2.166 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 16 . 3902 . 1 1 3 ALA O O 2.722 -4.591 1.846 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 16 . 3903 . 1 1 4 LEU C C 1.854 -4.128 -1.276 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 16 . 3904 . 1 1 4 LEU CA C 2.936 -5.174 -0.955 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 16 . 3905 . 1 1 4 LEU CB C 3.341 -6.057 -2.183 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 16 . 3906 . 1 1 4 LEU CD1 C 3.586 -4.503 -4.252 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 16 . 3907 . 1 1 4 LEU CD2 C 5.473 -4.742 -2.553 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 16 . 3908 . 1 1 4 LEU CG C 4.286 -5.432 -3.241 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 16 . 3909 . 1 1 4 LEU H H 2.076 -6.984 -0.033 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 16 . 3910 . 1 1 4 LEU HA H 3.816 -4.604 -0.588 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 16 . 3911 . 1 1 4 LEU HB2 H 3.873 -6.960 -1.820 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 16 . 3912 . 1 1 4 LEU HB3 H 2.439 -6.468 -2.677 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 16 . 3913 . 1 1 4 LEU HD11 H 3.188 -3.587 -3.782 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 16 . 3914 . 1 1 4 LEU HD12 H 4.281 -4.178 -5.049 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 16 . 3915 . 1 1 4 LEU HD13 H 2.740 -5.010 -4.751 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 16 . 3916 . 1 1 4 LEU HD21 H 6.279 -4.509 -3.260 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 16 . 3917 . 1 1 4 LEU HD22 H 5.153 -3.798 -2.067 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 16 . 3918 . 1 1 4 LEU HD23 H 5.882 -5.386 -1.749 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 16 . 3919 . 1 1 4 LEU HG H 4.696 -6.273 -3.831 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 16 . 3920 . 1 1 4 LEU N N 2.548 -6.087 0.138 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 16 . 3921 . 1 1 4 LEU O O 2.192 -2.970 -1.498 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 16 . 3922 . 1 1 5 ILE C C -0.527 -2.636 0.019 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 16 . 3923 . 1 1 5 ILE CA C -0.625 -3.733 -1.106 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 16 . 3924 . 1 1 5 ILE CB C -1.818 -4.751 -0.960 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 16 . 3925 . 1 1 5 ILE CD1 C -1.251 -7.121 -1.964 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 16 . 3926 . 1 1 5 ILE CG1 C -1.944 -5.757 -2.170 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 16 . 3927 . 1 1 5 ILE CG2 C -3.172 -4.007 -0.794 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 16 . 3928 . 1 1 5 ILE H H 0.520 -5.536 -0.876 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 16 . 3929 . 1 1 5 ILE HA H -0.762 -3.227 -2.077 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 16 . 3930 . 1 1 5 ILE HB H -1.615 -5.345 -0.035 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 16 . 3931 . 1 1 5 ILE HD11 H -0.195 -7.026 -1.648 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 16 . 3932 . 1 1 5 ILE HD12 H -1.752 -7.728 -1.193 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 16 . 3933 . 1 1 5 ILE HD13 H -1.241 -7.725 -2.887 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 16 . 3934 . 1 1 5 ILE HG12 H -3.000 -5.924 -2.448 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 16 . 3935 . 1 1 5 ILE HG13 H -1.508 -5.304 -3.076 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 16 . 3936 . 1 1 5 ILE HG21 H -4.008 -4.703 -0.618 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 16 . 3937 . 1 1 5 ILE HG22 H -3.171 -3.310 0.062 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 16 . 3938 . 1 1 5 ILE HG23 H -3.422 -3.404 -1.685 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 16 . 3939 . 1 1 5 ILE N N 0.586 -4.563 -1.205 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 16 . 3940 . 1 1 5 ILE O O -0.749 -1.471 -0.281 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 16 . 3941 . 1 1 6 LYS C C 1.172 -1.085 2.399 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 16 . 3942 . 1 1 6 LYS CA C -0.083 -2.000 2.400 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 16 . 3943 . 1 1 6 LYS CB C -0.407 -2.719 3.734 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 16 . 3944 . 1 1 6 LYS CD C -2.922 -3.125 2.870 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 16 . 3945 . 1 1 6 LYS CE C -4.377 -3.413 3.288 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 16 . 3946 . 1 1 6 LYS CG C -1.918 -2.945 4.052 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 16 . 3947 . 1 1 6 LYS H H -0.041 -3.983 1.414 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 16 . 3948 . 1 1 6 LYS HA H -0.884 -1.244 2.274 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 16 . 3949 . 1 1 6 LYS HB2 H 0.136 -3.682 3.785 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 16 . 3950 . 1 1 6 LYS HB3 H 0.017 -2.142 4.578 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 16 . 3951 . 1 1 6 LYS HD2 H -2.922 -2.205 2.242 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 16 . 3952 . 1 1 6 LYS HD3 H -2.572 -3.906 2.168 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 16 . 3953 . 1 1 6 LYS HE2 H -4.732 -2.649 4.005 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 16 . 3954 . 1 1 6 LYS HE3 H -5.035 -3.319 2.404 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 16 . 3955 . 1 1 6 LYS HG2 H -1.983 -3.820 4.727 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 16 . 3956 . 1 1 6 LYS HG3 H -2.264 -2.092 4.663 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 16 . 3957 . 1 1 6 LYS HZ1 H -5.535 -4.934 4.124 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 16 . 3958 . 1 1 6 LYS HZ2 H -4.279 -5.496 3.209 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 16 . 3959 . 1 1 6 LYS HZ3 H -3.994 -4.884 4.716 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 16 . 3960 . 1 1 6 LYS N N -0.211 -2.981 1.275 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 16 . 3961 . 1 1 6 LYS NZ N -4.557 -4.759 3.867 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 16 . 3962 . 1 1 6 LYS O O 1.052 0.056 2.845 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 16 . 3963 . 1 1 7 ARG C C 3.111 0.349 0.314 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 16 . 3964 . 1 1 7 ARG CA C 3.458 -0.610 1.522 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 16 . 3965 . 1 1 7 ARG CB C 4.718 -1.490 1.306 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 16 . 3966 . 1 1 7 ARG CD C 6.334 -0.266 -0.291 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 16 . 3967 . 1 1 7 ARG CG C 6.076 -0.768 1.140 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 16 . 3968 . 1 1 7 ARG CZ C 8.082 1.080 -1.483 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 16 . 3969 . 1 1 7 ARG H H 2.365 -2.533 1.664 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 16 . 3970 . 1 1 7 ARG HA H 3.672 0.033 2.398 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 16 . 3971 . 1 1 7 ARG HB2 H 4.831 -2.169 2.174 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 16 . 3972 . 1 1 7 ARG HB3 H 4.544 -2.159 0.448 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 16 . 3973 . 1 1 7 ARG HD2 H 6.214 -1.107 -0.999 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 16 . 3974 . 1 1 7 ARG HD3 H 5.566 0.477 -0.564 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 16 . 3975 . 1 1 7 ARG HE H 8.397 0.222 0.300 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 16 . 3976 . 1 1 7 ARG HG2 H 6.155 0.060 1.870 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 16 . 3977 . 1 1 7 ARG HG3 H 6.876 -1.481 1.416 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 16 . 3978 . 1 1 7 ARG HH11 H 6.362 0.967 -2.520 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 16 . 3979 . 1 1 7 ARG HH12 H 7.729 1.931 -3.273 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 16 . 3980 . 1 1 7 ARG HH21 H 9.883 1.344 -0.650 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 16 . 3981 . 1 1 7 ARG HH22 H 9.588 2.129 -2.282 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 16 . 3982 . 1 1 7 ARG N N 2.343 -1.532 1.905 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 16 . 3983 . 1 1 7 ARG NE N 7.684 0.337 -0.429 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 16 . 3984 . 1 1 7 ARG NH1 N 7.312 1.353 -2.535 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 16 . 3985 . 1 1 7 ARG NH2 N 9.309 1.566 -1.471 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 16 . 3986 . 1 1 7 ARG O O 3.397 1.553 0.385 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 16 . 3987 . 1 1 8 ILE C C 0.838 1.740 -1.260 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 16 . 3988 . 1 1 8 ILE CA C 1.901 0.759 -1.836 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 16 . 3989 . 1 1 8 ILE CB C 1.521 0.116 -3.221 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 16 . 3990 . 1 1 8 ILE CD1 C -1.053 -0.549 -3.230 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 16 . 3991 . 1 1 8 ILE CG1 C 0.434 -0.986 -3.176 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 16 . 3992 . 1 1 8 ILE CG2 C 2.789 -0.399 -3.951 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 16 . 3993 . 1 1 8 ILE H H 2.269 -1.146 -0.752 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 16 . 3994 . 1 1 8 ILE HA H 2.745 1.416 -2.118 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 16 . 3995 . 1 1 8 ILE HB H 1.133 0.918 -3.875 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 16 . 3996 . 1 1 8 ILE HD11 H -1.322 -0.011 -4.153 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 16 . 3997 . 1 1 8 ILE HD12 H -1.738 -1.414 -3.137 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 16 . 3998 . 1 1 8 ILE HD13 H -1.337 0.109 -2.389 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 16 . 3999 . 1 1 8 ILE HG12 H 0.668 -1.774 -3.918 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 16 . 4000 . 1 1 8 ILE HG13 H 0.569 -1.514 -2.236 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 16 . 4001 . 1 1 8 ILE HG21 H 2.556 -0.783 -4.962 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 16 . 4002 . 1 1 8 ILE HG22 H 3.538 0.403 -4.086 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 16 . 4003 . 1 1 8 ILE HG23 H 3.286 -1.217 -3.396 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 16 . 4004 . 1 1 8 ILE N N 2.473 -0.141 -0.780 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 16 . 4005 . 1 1 8 ILE O O 1.022 2.921 -1.510 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 16 . 4006 . 1 1 9 GLN C C -0.337 3.273 1.302 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 16 . 4007 . 1 1 9 GLN CA C -1.049 2.329 0.281 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 16 . 4008 . 1 1 9 GLN CB C -2.330 1.784 0.963 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 16 . 4009 . 1 1 9 GLN CD C -4.535 0.458 0.833 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 16 . 4010 . 1 1 9 GLN CG C -3.131 0.679 0.251 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 16 . 4011 . 1 1 9 GLN H H -0.206 0.336 -0.249 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 16 . 4012 . 1 1 9 GLN HA H -1.398 2.984 -0.536 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 16 . 4013 . 1 1 9 GLN HB2 H -2.096 1.421 1.984 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 16 . 4014 . 1 1 9 GLN HB3 H -2.984 2.667 1.106 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 16 . 4015 . 1 1 9 GLN HE21 H -5.365 1.354 -0.757 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 16 . 4016 . 1 1 9 GLN HE22 H -6.499 0.690 0.524 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 16 . 4017 . 1 1 9 GLN HG2 H -3.164 0.832 -0.846 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 16 . 4018 . 1 1 9 GLN HG3 H -2.568 -0.250 0.401 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 16 . 4019 . 1 1 9 GLN N N -0.159 1.346 -0.426 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 16 . 4020 . 1 1 9 GLN NE2 N -5.572 0.896 0.138 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 16 . 4021 . 1 1 9 GLN O O -0.721 4.434 1.440 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 16 . 4022 . 1 1 9 GLN OE1 O -4.700 -0.118 1.908 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 16 . 4023 . 1 1 10 ALA C C 2.159 4.947 1.814 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 16 . 4024 . 1 1 10 ALA CA C 1.682 3.722 2.689 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 16 . 4025 . 1 1 10 ALA CB C 2.864 2.875 3.221 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 16 . 4026 . 1 1 10 ALA H H 0.877 1.804 1.861 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 16 . 4027 . 1 1 10 ALA HA H 1.145 4.124 3.569 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 16 . 4028 . 1 1 10 ALA HB1 H 3.576 2.584 2.432 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 16 . 4029 . 1 1 10 ALA HB2 H 3.461 3.419 3.968 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 16 . 4030 . 1 1 10 ALA HB3 H 2.538 1.929 3.696 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 16 . 4031 . 1 1 10 ALA N N 0.728 2.815 1.982 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 16 . 4032 . 1 1 10 ALA O O 2.076 6.085 2.280 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 16 . 4033 . 1 1 11 MET C C 1.324 6.372 -1.202 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 16 . 4034 . 1 1 11 MET CA C 2.642 5.791 -0.502 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 16 . 4035 . 1 1 11 MET CB C 3.633 5.315 -1.609 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 16 . 4036 . 1 1 11 MET CE C 6.247 7.525 -1.843 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 16 . 4037 . 1 1 11 MET CG C 5.090 5.051 -1.167 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 16 . 4038 . 1 1 11 MET H H 2.715 3.715 0.329 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 16 . 4039 . 1 1 11 MET HA H 3.123 6.668 -0.027 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 16 . 4040 . 1 1 11 MET HB2 H 3.242 4.401 -2.094 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 16 . 4041 . 1 1 11 MET HB3 H 3.669 6.067 -2.420 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 16 . 4042 . 1 1 11 MET HE1 H 6.773 8.444 -1.530 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 16 . 4043 . 1 1 11 MET HE2 H 5.338 7.825 -2.396 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 16 . 4044 . 1 1 11 MET HE3 H 6.907 6.971 -2.535 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 16 . 4045 . 1 1 11 MET HG2 H 5.126 4.219 -0.439 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 16 . 4046 . 1 1 11 MET HG3 H 5.705 4.728 -2.027 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 16 . 4047 . 1 1 11 MET N N 2.559 4.717 0.545 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 16 . 4048 . 1 1 11 MET O O 1.291 7.571 -1.490 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 16 . 4049 . 1 1 11 MET SD S 5.826 6.519 -0.404 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 16 . 4050 . 1 1 12 ILE C C -1.961 6.960 -1.799 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 16 . 4051 . 1 1 12 ILE CA C -0.908 5.928 -2.350 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 16 . 4052 . 1 1 12 ILE CB C -1.336 4.615 -3.183 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 16 . 4053 . 1 1 12 ILE CD1 C 0.977 4.105 -4.374 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 16 . 4054 . 1 1 12 ILE CG1 C -0.510 4.429 -4.508 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 16 . 4055 . 1 1 12 ILE CG2 C -2.806 4.407 -3.627 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 16 . 4056 . 1 1 12 ILE H H 0.452 4.569 -1.261 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 16 . 4057 . 1 1 12 ILE HA H -0.513 6.557 -3.126 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 16 . 4058 . 1 1 12 ILE HB H -1.171 3.741 -2.524 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 16 . 4059 . 1 1 12 ILE HD11 H 1.454 4.043 -5.365 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 16 . 4060 . 1 1 12 ILE HD12 H 1.518 4.865 -3.788 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 16 . 4061 . 1 1 12 ILE HD13 H 1.122 3.128 -3.889 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 16 . 4062 . 1 1 12 ILE HG12 H -0.932 3.618 -5.134 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 16 . 4063 . 1 1 12 ILE HG13 H -0.610 5.341 -5.123 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 16 . 4064 . 1 1 12 ILE HG21 H -3.133 5.149 -4.372 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 16 . 4065 . 1 1 12 ILE HG22 H -2.926 3.402 -4.087 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 16 . 4066 . 1 1 12 ILE HG23 H -3.528 4.403 -2.801 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 16 . 4067 . 1 1 12 ILE N N 0.280 5.552 -1.495 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 16 . 4068 . 1 1 12 ILE O O -2.035 8.054 -2.374 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 16 . 4069 . 1 1 13 PRO C C -3.366 8.302 1.322 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 16 . 4070 . 1 1 13 PRO CA C -3.638 7.743 -0.104 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 16 . 4071 . 1 1 13 PRO CB C -4.967 6.983 -0.262 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 16 . 4072 . 1 1 13 PRO CD C -3.106 5.410 -0.283 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 16 . 4073 . 1 1 13 PRO CG C -4.632 5.484 -0.263 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 16 . 4074 . 1 1 13 PRO HA H -3.665 8.656 -0.703 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 16 . 4075 . 1 1 13 PRO HB2 H -5.733 7.254 0.489 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 16 . 4076 . 1 1 13 PRO HB3 H -5.380 7.239 -1.256 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 16 . 4077 . 1 1 13 PRO HD2 H -2.702 5.240 0.708 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 16 . 4078 . 1 1 13 PRO HD3 H -2.701 4.616 -0.919 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 16 . 4079 . 1 1 13 PRO HG2 H -5.057 4.956 0.610 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 16 . 4080 . 1 1 13 PRO HG3 H -5.039 5.004 -1.171 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 16 . 4081 . 1 1 13 PRO N N -2.685 6.746 -0.677 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 16 . 4082 . 1 1 13 PRO O O -4.019 9.275 1.715 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 16 . 4083 . 1 1 14 LYS C C -0.505 8.425 3.457 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 16 . 4084 . 1 1 14 LYS CA C -2.044 8.180 3.428 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 16 . 4085 . 1 1 14 LYS CB C -2.514 7.093 4.425 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 16 . 4086 . 1 1 14 LYS CD C -4.577 5.601 5.005 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 16 . 4087 . 1 1 14 LYS CE C -4.872 4.700 3.783 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 16 . 4088 . 1 1 14 LYS CG C -4.044 7.016 4.680 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 16 . 4089 . 1 1 14 LYS H H -2.073 6.837 1.659 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 16 . 4090 . 1 1 14 LYS HA H -2.551 9.130 3.698 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 16 . 4091 . 1 1 14 LYS HB2 H -2.121 6.121 4.075 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 16 . 4092 . 1 1 14 LYS HB3 H -2.022 7.267 5.394 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 16 . 4093 . 1 1 14 LYS HD2 H -3.911 5.086 5.724 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 16 . 4094 . 1 1 14 LYS HD3 H -5.530 5.725 5.553 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 16 . 4095 . 1 1 14 LYS HE2 H -5.460 3.822 4.110 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 16 . 4096 . 1 1 14 LYS HE3 H -5.520 5.235 3.064 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 16 . 4097 . 1 1 14 LYS HG2 H -4.288 7.698 5.517 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 16 . 4098 . 1 1 14 LYS HG3 H -4.614 7.423 3.824 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 16 . 4099 . 1 1 14 LYS HZ1 H -3.105 4.990 2.706 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 16 . 4100 . 1 1 14 LYS HZ2 H -3.046 3.665 3.684 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 16 . 4101 . 1 1 14 LYS HZ3 H -3.902 3.624 2.275 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 16 . 4102 . 1 1 14 LYS N N -2.412 7.721 2.065 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 16 . 4103 . 1 1 14 LYS NZ N -3.667 4.216 3.082 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 16 . 4104 . 1 1 14 LYS O O 0.271 7.559 3.876 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 16 . 4105 . 1 1 15 GLY C C 1.962 9.584 1.526 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 16 . 4106 . 1 1 15 GLY CA C 1.351 9.978 2.879 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 16 . 4107 . 1 1 15 GLY H H -0.825 10.241 2.655 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 16 . 4108 . 1 1 15 GLY HA2 H 1.449 11.071 3.003 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 16 . 4109 . 1 1 15 GLY HA3 H 1.939 9.541 3.710 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 16 . 4110 . 1 1 15 GLY N N -0.081 9.618 2.991 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 16 . 4111 . 1 1 15 GLY O O 2.938 8.803 1.513 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 16 . 4112 . 1 1 15 GLY OXT O 1.484 10.064 0.474 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 1
. 17 . 4113 . 1 1 1 CYS C C -3.341 -7.681 2.046 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . rr_1kmr 1
. 17 . 4114 . 1 1 1 CYS CA C -4.488 -7.512 1.015 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . rr_1kmr 1
. 17 . 4115 . 1 1 1 CYS CB C -5.638 -6.635 1.546 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . rr_1kmr 1
. 17 . 4116 . 1 1 1 CYS H1 H -4.276 -9.438 0.235 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H1 . . . . . . . . . rr_1kmr 1
. 17 . 4117 . 1 1 1 CYS H2 H -5.395 -9.341 1.446 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H2 . . . . . . . . . rr_1kmr 1
. 17 . 4118 . 1 1 1 CYS H3 H -5.759 -8.772 -0.061 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H3 . . . . . . . . . rr_1kmr 1
. 17 . 4119 . 1 1 1 CYS HA H -4.107 -7.033 0.093 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . rr_1kmr 1
. 17 . 4120 . 1 1 1 CYS HB2 H -6.130 -7.089 2.428 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4121 . 1 1 1 CYS HB3 H -5.255 -5.653 1.877 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4122 . 1 1 1 CYS HG H -7.682 -5.582 0.970 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HG . . . . . . . . . rr_1kmr 1
. 17 . 4123 . 1 1 1 CYS N N -5.009 -8.843 0.636 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . rr_1kmr 1
. 17 . 4124 . 1 1 1 CYS O O -3.581 -8.077 3.192 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . rr_1kmr 1
. 17 . 4125 . 1 1 1 CYS SG S -6.879 -6.350 0.239 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . rr_1kmr 1
. 17 . 4126 . 1 1 2 ARG C C 0.300 -6.729 2.187 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . rr_1kmr 1
. 17 . 4127 . 1 1 2 ARG CA C -0.874 -7.730 2.410 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . rr_1kmr 1
. 17 . 4128 . 1 1 2 ARG CB C -0.545 -9.280 2.439 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . rr_1kmr 1
. 17 . 4129 . 1 1 2 ARG CD C 0.449 -9.721 0.046 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . rr_1kmr 1
. 17 . 4130 . 1 1 2 ARG CG C -0.582 -10.106 1.123 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . rr_1kmr 1
. 17 . 4131 . 1 1 2 ARG CZ C 0.991 -10.343 -2.320 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . rr_1kmr 1
. 17 . 4132 . 1 1 2 ARG H H -2.030 -7.089 0.642 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . rr_1kmr 1
. 17 . 4133 . 1 1 2 ARG HA H -1.107 -7.455 3.442 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . rr_1kmr 1
. 17 . 4134 . 1 1 2 ARG HB2 H 0.434 -9.434 2.933 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4135 . 1 1 2 ARG HB3 H -1.245 -9.758 3.141 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4136 . 1 1 2 ARG HD2 H 0.333 -8.654 -0.216 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . rr_1kmr 1
. 17 . 4137 . 1 1 2 ARG HD3 H 1.474 -9.826 0.445 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . rr_1kmr 1
. 17 . 4138 . 1 1 2 ARG HE H -0.352 -11.338 -1.214 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . rr_1kmr 1
. 17 . 4139 . 1 1 2 ARG HG2 H -0.434 -11.170 1.387 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4140 . 1 1 2 ARG HG3 H -1.601 -10.050 0.696 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4141 . 1 1 2 ARG HH11 H 2.061 -8.764 -1.676 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . rr_1kmr 1
. 17 . 4142 . 1 1 2 ARG HH12 H 2.351 -9.324 -3.399 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . rr_1kmr 1
. 17 . 4143 . 1 1 2 ARG HH21 H 0.061 -11.887 -3.190 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . rr_1kmr 1
. 17 . 4144 . 1 1 2 ARG HH22 H 1.294 -10.974 -4.196 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . rr_1kmr 1
. 17 . 4145 . 1 1 2 ARG N N -2.090 -7.411 1.614 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . rr_1kmr 1
. 17 . 4146 . 1 1 2 ARG NE N 0.303 -10.548 -1.178 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . rr_1kmr 1
. 17 . 4147 . 1 1 2 ARG NH1 N 1.893 -9.375 -2.483 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . rr_1kmr 1
. 17 . 4148 . 1 1 2 ARG NH2 N 0.757 -11.148 -3.339 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . rr_1kmr 1
. 17 . 4149 . 1 1 2 ARG O O 0.146 -5.521 2.368 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . rr_1kmr 1
. 17 . 4150 . 1 1 3 ALA C C 2.967 -5.459 0.765 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_1kmr 1
. 17 . 4151 . 1 1 3 ALA CA C 2.773 -6.570 1.824 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_1kmr 1
. 17 . 4152 . 1 1 3 ALA CB C 3.718 -7.741 1.472 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_1kmr 1
. 17 . 4153 . 1 1 3 ALA H H 1.441 -8.291 1.776 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_1kmr 1
. 17 . 4154 . 1 1 3 ALA HA H 3.003 -6.182 2.834 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_1kmr 1
. 17 . 4155 . 1 1 3 ALA HB1 H 3.696 -8.541 2.224 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_1kmr 1
. 17 . 4156 . 1 1 3 ALA HB2 H 3.419 -8.201 0.499 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4157 . 1 1 3 ALA HB3 H 4.746 -7.375 1.323 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4158 . 1 1 3 ALA N N 1.478 -7.270 1.876 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_1kmr 1
. 17 . 4159 . 1 1 3 ALA O O 3.256 -4.304 1.097 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_1kmr 1
. 17 . 4160 . 1 1 4 LEU C C 1.770 -3.930 -1.772 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . rr_1kmr 1
. 17 . 4161 . 1 1 4 LEU CA C 2.923 -4.945 -1.669 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . rr_1kmr 1
. 17 . 4162 . 1 1 4 LEU CB C 3.119 -5.792 -2.968 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . rr_1kmr 1
. 17 . 4163 . 1 1 4 LEU CD1 C 3.115 -4.078 -4.932 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . rr_1kmr 1
. 17 . 4164 . 1 1 4 LEU CD2 C 5.233 -4.552 -3.624 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . rr_1kmr 1
. 17 . 4165 . 1 1 4 LEU CG C 3.905 -5.132 -4.133 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . rr_1kmr 1
. 17 . 4166 . 1 1 4 LEU H H 2.318 -6.762 -0.565 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . rr_1kmr 1
. 17 . 4167 . 1 1 4 LEU HA H 3.838 -4.357 -1.472 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . rr_1kmr 1
. 17 . 4168 . 1 1 4 LEU HB2 H 3.678 -6.717 -2.721 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4169 . 1 1 4 LEU HB3 H 2.144 -6.169 -3.334 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4170 . 1 1 4 LEU HD11 H 2.139 -4.466 -5.273 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . rr_1kmr 1
. 17 . 4171 . 1 1 4 LEU HD12 H 2.918 -3.166 -4.342 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . rr_1kmr 1
. 17 . 4172 . 1 1 4 LEU HD13 H 3.672 -3.754 -5.831 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . rr_1kmr 1
. 17 . 4173 . 1 1 4 LEU HD21 H 5.731 -5.263 -2.936 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . rr_1kmr 1
. 17 . 4174 . 1 1 4 LEU HD22 H 5.917 -4.318 -4.450 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . rr_1kmr 1
. 17 . 4175 . 1 1 4 LEU HD23 H 5.063 -3.621 -3.048 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . rr_1kmr 1
. 17 . 4176 . 1 1 4 LEU HG H 4.150 -5.944 -4.844 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . rr_1kmr 1
. 17 . 4177 . 1 1 4 LEU N N 2.796 -5.854 -0.510 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . rr_1kmr 1
. 17 . 4178 . 1 1 4 LEU O O 2.014 -2.758 -2.044 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . rr_1kmr 1
. 17 . 4179 . 1 1 5 ILE C C -0.352 -2.489 -0.060 . . . 1.0 . . . . . . . . . . . . A . 15 ILE C . . . . . . . . . rr_1kmr 1
. 17 . 4180 . 1 1 5 ILE CA C -0.635 -3.616 -1.120 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CA . . . . . . . . . rr_1kmr 1
. 17 . 4181 . 1 1 5 ILE CB C -1.732 -4.674 -0.712 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CB . . . . . . . . . rr_1kmr 1
. 17 . 4182 . 1 1 5 ILE CD1 C -1.280 -7.045 -1.781 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CD1 . . . . . . . . . rr_1kmr 1
. 17 . 4183 . 1 1 5 ILE CG1 C -2.063 -5.716 -1.852 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG1 . . . . . . . . . rr_1kmr 1
. 17 . 4184 . 1 1 5 ILE CG2 C -3.051 -3.976 -0.280 . . . 1.0 . . . . . . . . . . . . A . 15 ILE CG2 . . . . . . . . . rr_1kmr 1
. 17 . 4185 . 1 1 5 ILE H H 0.594 -5.377 -1.104 . . . 1.0 . . . . . . . . . . . . A . 15 ILE H . . . . . . . . . rr_1kmr 1
. 17 . 4186 . 1 1 5 ILE HA H -0.979 -3.140 -2.053 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HA . . . . . . . . . rr_1kmr 1
. 17 . 4187 . 1 1 5 ILE HB H -1.319 -5.236 0.161 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HB . . . . . . . . . rr_1kmr 1
. 17 . 4188 . 1 1 5 ILE HD11 H -0.190 -6.903 -1.651 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD11 . . . . . . . . . rr_1kmr 1
. 17 . 4189 . 1 1 5 ILE HD12 H -1.611 -7.677 -0.942 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD12 . . . . . . . . . rr_1kmr 1
. 17 . 4190 . 1 1 5 ILE HD13 H -1.402 -7.648 -2.696 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HD13 . . . . . . . . . rr_1kmr 1
. 17 . 4191 . 1 1 5 ILE HG12 H -3.144 -5.938 -1.898 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG12 . . . . . . . . . rr_1kmr 1
. 17 . 4192 . 1 1 5 ILE HG13 H -1.849 -5.266 -2.836 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG13 . . . . . . . . . rr_1kmr 1
. 17 . 4193 . 1 1 5 ILE HG21 H -3.504 -3.402 -1.110 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG21 . . . . . . . . . rr_1kmr 1
. 17 . 4194 . 1 1 5 ILE HG22 H -3.805 -4.696 0.077 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG22 . . . . . . . . . rr_1kmr 1
. 17 . 4195 . 1 1 5 ILE HG23 H -2.898 -3.258 0.545 . . . 1.0 . . . . . . . . . . . . A . 15 ILE HG23 . . . . . . . . . rr_1kmr 1
. 17 . 4196 . 1 1 5 ILE N N 0.559 -4.407 -1.449 . . . 1.0 . . . . . . . . . . . . A . 15 ILE N . . . . . . . . . rr_1kmr 1
. 17 . 4197 . 1 1 5 ILE O O -0.717 -1.349 -0.313 . . . 1.0 . . . . . . . . . . . . A . 15 ILE O . . . . . . . . . rr_1kmr 1
. 17 . 4198 . 1 1 6 LYS C C 1.826 -0.788 1.772 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . rr_1kmr 1
. 17 . 4199 . 1 1 6 LYS CA C 0.640 -1.743 2.109 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . rr_1kmr 1
. 17 . 4200 . 1 1 6 LYS CB C 0.645 -2.407 3.509 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . rr_1kmr 1
. 17 . 4201 . 1 1 6 LYS CD C -2.008 -2.811 3.271 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . rr_1kmr 1
. 17 . 4202 . 1 1 6 LYS CE C -3.279 -3.101 4.090 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . rr_1kmr 1
. 17 . 4203 . 1 1 6 LYS CG C -0.753 -2.613 4.176 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . rr_1kmr 1
. 17 . 4204 . 1 1 6 LYS H H 0.546 -3.760 1.199 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . rr_1kmr 1
. 17 . 4205 . 1 1 6 LYS HA H -0.202 -1.024 2.145 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . rr_1kmr 1
. 17 . 4206 . 1 1 6 LYS HB2 H 1.188 -3.371 3.469 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4207 . 1 1 6 LYS HB3 H 1.252 -1.798 4.205 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4208 . 1 1 6 LYS HD2 H -2.169 -1.913 2.631 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . rr_1kmr 1
. 17 . 4209 . 1 1 6 LYS HD3 H -1.832 -3.626 2.541 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . rr_1kmr 1
. 17 . 4210 . 1 1 6 LYS HE2 H -3.151 -4.025 4.685 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . rr_1kmr 1
. 17 . 4211 . 1 1 6 LYS HE3 H -3.463 -2.287 4.816 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . rr_1kmr 1
. 17 . 4212 . 1 1 6 LYS HG2 H -0.663 -3.468 4.873 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4213 . 1 1 6 LYS HG3 H -0.942 -1.740 4.827 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4214 . 1 1 6 LYS HZ1 H -4.348 -4.012 2.551 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 17 . 4215 . 1 1 6 LYS HZ2 H -5.309 -3.442 3.768 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 17 . 4216 . 1 1 6 LYS HZ3 H -4.640 -2.391 2.684 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 17 . 4217 . 1 1 6 LYS N N 0.281 -2.775 1.087 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . rr_1kmr 1
. 17 . 4218 . 1 1 6 LYS NZ N -4.461 -3.245 3.224 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . rr_1kmr 1
. 17 . 4219 . 1 1 6 LYS O O 1.771 0.368 2.191 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . rr_1kmr 1
. 17 . 4220 . 1 1 7 ARG C C 3.176 0.707 -0.689 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_1kmr 1
. 17 . 4221 . 1 1 7 ARG CA C 3.830 -0.271 0.357 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_1kmr 1
. 17 . 4222 . 1 1 7 ARG CB C 5.004 -1.096 -0.262 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_1kmr 1
. 17 . 4223 . 1 1 7 ARG CD C 6.033 -1.965 1.916 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_1kmr 1
. 17 . 4224 . 1 1 7 ARG CG C 6.280 -1.231 0.595 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_1kmr 1
. 17 . 4225 . 1 1 7 ARG CZ C 7.362 -2.870 3.835 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_1kmr 1
. 17 . 4226 . 1 1 7 ARG H H 2.887 -2.227 0.851 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_1kmr 1
. 17 . 4227 . 1 1 7 ARG HA H 4.256 0.381 1.144 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_1kmr 1
. 17 . 4228 . 1 1 7 ARG HB2 H 4.663 -2.096 -0.596 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4229 . 1 1 7 ARG HB3 H 5.336 -0.624 -1.192 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4230 . 1 1 7 ARG HD2 H 5.334 -1.358 2.522 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_1kmr 1
. 17 . 4231 . 1 1 7 ARG HD3 H 5.526 -2.921 1.691 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_1kmr 1
. 17 . 4232 . 1 1 7 ARG HE H 8.191 -1.845 2.326 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_1kmr 1
. 17 . 4233 . 1 1 7 ARG HG2 H 7.044 -1.770 0.002 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4234 . 1 1 7 ARG HG3 H 6.705 -0.228 0.790 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4235 . 1 1 7 ARG HH11 H 5.401 -3.288 3.991 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_1kmr 1
. 17 . 4236 . 1 1 7 ARG HH12 H 6.493 -3.894 5.335 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_1kmr 1
. 17 . 4237 . 1 1 7 ARG HH21 H 9.341 -2.581 3.910 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_1kmr 1
. 17 . 4238 . 1 1 7 ARG HH22 H 8.576 -3.518 5.289 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_1kmr 1
. 17 . 4239 . 1 1 7 ARG N N 2.866 -1.214 1.026 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_1kmr 1
. 17 . 4240 . 1 1 7 ARG NE N 7.290 -2.198 2.668 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_1kmr 1
. 17 . 4241 . 1 1 7 ARG NH1 N 6.310 -3.407 4.450 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_1kmr 1
. 17 . 4242 . 1 1 7 ARG NH2 N 8.546 -3.004 4.402 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_1kmr 1
. 17 . 4243 . 1 1 7 ARG O O 3.373 1.930 -0.609 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_1kmr 1
. 17 . 4244 . 1 1 8 ILE C C 0.531 1.942 -1.694 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . rr_1kmr 1
. 17 . 4245 . 1 1 8 ILE CA C 1.491 1.026 -2.511 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . rr_1kmr 1
. 17 . 4246 . 1 1 8 ILE CB C 0.828 0.311 -3.746 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . rr_1kmr 1
. 17 . 4247 . 1 1 8 ILE CD1 C -1.604 -0.570 -3.223 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . rr_1kmr 1
. 17 . 4248 . 1 1 8 ILE CG1 C -0.095 -0.885 -3.400 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . rr_1kmr 1
. 17 . 4249 . 1 1 8 ILE CG2 C 1.898 -0.105 -4.788 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . rr_1kmr 1
. 17 . 4250 . 1 1 8 ILE H H 2.255 -0.841 -1.594 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . rr_1kmr 1
. 17 . 4251 . 1 1 8 ILE HA H 2.198 1.727 -2.992 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . rr_1kmr 1
. 17 . 4252 . 1 1 8 ILE HB H 0.208 1.057 -4.276 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . rr_1kmr 1
. 17 . 4253 . 1 1 8 ILE HD11 H -2.179 -1.456 -2.893 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . rr_1kmr 1
. 17 . 4254 . 1 1 8 ILE HD12 H -1.788 0.183 -2.435 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . rr_1kmr 1
. 17 . 4255 . 1 1 8 ILE HD13 H -2.081 -0.186 -4.138 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . rr_1kmr 1
. 17 . 4256 . 1 1 8 ILE HG12 H 0.106 -1.741 -4.078 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . rr_1kmr 1
. 17 . 4257 . 1 1 8 ILE HG13 H 0.250 -1.284 -2.447 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . rr_1kmr 1
. 17 . 4258 . 1 1 8 ILE HG21 H 1.441 -0.548 -5.693 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . rr_1kmr 1
. 17 . 4259 . 1 1 8 ILE HG22 H 2.495 0.761 -5.129 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . rr_1kmr 1
. 17 . 4260 . 1 1 8 ILE HG23 H 2.607 -0.848 -4.379 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . rr_1kmr 1
. 17 . 4261 . 1 1 8 ILE N N 2.352 0.180 -1.628 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . rr_1kmr 1
. 17 . 4262 . 1 1 8 ILE O O 0.651 3.139 -1.906 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . rr_1kmr 1
. 17 . 4263 . 1 1 9 GLN C C -0.340 3.429 1.007 . . . 1.0 . . . . . . . . . . . . A . 19 GLN C . . . . . . . . . rr_1kmr 1
. 17 . 4264 . 1 1 9 GLN CA C -1.134 2.423 0.116 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CA . . . . . . . . . rr_1kmr 1
. 17 . 4265 . 1 1 9 GLN CB C -2.253 1.817 1.005 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CB . . . . . . . . . rr_1kmr 1
. 17 . 4266 . 1 1 9 GLN CD C -4.420 0.447 1.216 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CD . . . . . . . . . rr_1kmr 1
. 17 . 4267 . 1 1 9 GLN CG C -3.130 0.697 0.420 . . . 1.0 . . . . . . . . . . . . A . 19 GLN CG . . . . . . . . . rr_1kmr 1
. 17 . 4268 . 1 1 9 GLN H H -0.312 0.470 -0.589 . . . 1.0 . . . . . . . . . . . . A . 19 GLN H . . . . . . . . . rr_1kmr 1
. 17 . 4269 . 1 1 9 GLN HA H -1.649 3.041 -0.643 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HA . . . . . . . . . rr_1kmr 1
. 17 . 4270 . 1 1 9 GLN HB2 H -1.824 1.445 1.958 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4271 . 1 1 9 GLN HB3 H -2.908 2.665 1.290 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4272 . 1 1 9 GLN HE21 H -5.514 1.289 -0.239 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE21 . . . . . . . . . rr_1kmr 1
. 17 . 4273 . 1 1 9 GLN HE22 H -6.414 0.634 1.220 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HE22 . . . . . . . . . rr_1kmr 1
. 17 . 4274 . 1 1 9 GLN HG2 H -3.338 0.850 -0.657 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4275 . 1 1 9 GLN HG3 H -2.528 -0.216 0.476 . . . 1.0 . . . . . . . . . . . . A . 19 GLN HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4276 . 1 1 9 GLN N N -0.304 1.487 -0.723 . . . 1.0 . . . . . . . . . . . . A . 19 GLN N . . . . . . . . . rr_1kmr 1
. 17 . 4277 . 1 1 9 GLN NE2 N -5.565 0.842 0.683 . . . 1.0 . . . . . . . . . . . . A . 19 GLN NE2 . . . . . . . . . rr_1kmr 1
. 17 . 4278 . 1 1 9 GLN O O -0.780 4.562 1.196 . . . 1.0 . . . . . . . . . . . . A . 19 GLN O . . . . . . . . . rr_1kmr 1
. 17 . 4279 . 1 1 9 GLN OE1 O -4.397 -0.107 2.314 . . . 1.0 . . . . . . . . . . . . A . 19 GLN OE1 . . . . . . . . . rr_1kmr 1
. 17 . 4280 . 1 1 10 ALA C C 2.081 5.281 1.101 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1kmr 1
. 17 . 4281 . 1 1 10 ALA CA C 1.824 4.052 2.059 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1kmr 1
. 17 . 4282 . 1 1 10 ALA CB C 3.123 3.311 2.450 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1kmr 1
. 17 . 4283 . 1 1 10 ALA H H 1.046 2.060 1.381 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1kmr 1
. 17 . 4284 . 1 1 10 ALA HA H 1.386 4.452 2.995 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1kmr 1
. 17 . 4285 . 1 1 10 ALA HB1 H 3.854 3.982 2.931 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1kmr 1
. 17 . 4286 . 1 1 10 ALA HB2 H 2.934 2.483 3.160 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4287 . 1 1 10 ALA HB3 H 3.637 2.862 1.583 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4288 . 1 1 10 ALA N N 0.845 3.059 1.521 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1kmr 1
. 17 . 4289 . 1 1 10 ALA O O 1.975 6.422 1.554 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1kmr 1
. 17 . 4290 . 1 1 11 MET C C 0.771 6.599 -1.794 . . . 1.0 . . . . . . . . . . . . A . 21 MET C . . . . . . . . . rr_1kmr 1
. 17 . 4291 . 1 1 11 MET CA C 2.202 6.109 -1.268 . . . 1.0 . . . . . . . . . . . . A . 21 MET CA . . . . . . . . . rr_1kmr 1
. 17 . 4292 . 1 1 11 MET CB C 3.066 5.677 -2.492 . . . 1.0 . . . . . . . . . . . . A . 21 MET CB . . . . . . . . . rr_1kmr 1
. 17 . 4293 . 1 1 11 MET CE C 6.998 6.627 -1.432 . . . 1.0 . . . . . . . . . . . . A . 21 MET CE . . . . . . . . . rr_1kmr 1
. 17 . 4294 . 1 1 11 MET CG C 4.581 5.528 -2.245 . . . 1.0 . . . . . . . . . . . . A . 21 MET CG . . . . . . . . . rr_1kmr 1
. 17 . 4295 . 1 1 11 MET H H 2.531 4.056 -0.434 . . . 1.0 . . . . . . . . . . . . A . 21 MET H . . . . . . . . . rr_1kmr 1
. 17 . 4296 . 1 1 11 MET HA H 2.686 7.021 -0.868 . . . 1.0 . . . . . . . . . . . . A . 21 MET HA . . . . . . . . . rr_1kmr 1
. 17 . 4297 . 1 1 11 MET HB2 H 2.679 4.726 -2.906 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4298 . 1 1 11 MET HB3 H 2.945 6.411 -3.311 . . . 1.0 . . . . . . . . . . . . A . 21 MET HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4299 . 1 1 11 MET HE1 H 7.461 6.221 -2.350 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE1 . . . . . . . . . rr_1kmr 1
. 17 . 4300 . 1 1 11 MET HE2 H 7.057 5.856 -0.642 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE2 . . . . . . . . . rr_1kmr 1
. 17 . 4301 . 1 1 11 MET HE3 H 7.593 7.498 -1.104 . . . 1.0 . . . . . . . . . . . . A . 21 MET HE3 . . . . . . . . . rr_1kmr 1
. 17 . 4302 . 1 1 11 MET HG2 H 4.783 4.759 -1.474 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4303 . 1 1 11 MET HG3 H 5.086 5.186 -3.168 . . . 1.0 . . . . . . . . . . . . A . 21 MET HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4304 . 1 1 11 MET N N 2.325 5.048 -0.207 . . . 1.0 . . . . . . . . . . . . A . 21 MET N . . . . . . . . . rr_1kmr 1
. 17 . 4305 . 1 1 11 MET O O 0.628 7.786 -2.097 . . . 1.0 . . . . . . . . . . . . A . 21 MET O . . . . . . . . . rr_1kmr 1
. 17 . 4306 . 1 1 11 MET SD S 5.287 7.109 -1.732 . . . 1.0 . . . . . . . . . . . . A . 21 MET SD . . . . . . . . . rr_1kmr 1
. 17 . 4307 . 1 1 12 ILE C C -2.593 6.982 -1.948 . . . 1.0 . . . . . . . . . . . . A . 22 ILE C . . . . . . . . . rr_1kmr 1
. 17 . 4308 . 1 1 12 ILE CA C -1.565 5.996 -2.617 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CA . . . . . . . . . rr_1kmr 1
. 17 . 4309 . 1 1 12 ILE CB C -2.021 4.627 -3.339 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CB . . . . . . . . . rr_1kmr 1
. 17 . 4310 . 1 1 12 ILE CD1 C 0.142 4.205 -4.807 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CD1 . . . . . . . . . rr_1kmr 1
. 17 . 4311 . 1 1 12 ILE CG1 C -1.368 4.427 -4.754 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG1 . . . . . . . . . rr_1kmr 1
. 17 . 4312 . 1 1 12 ILE CG2 C -3.522 4.322 -3.571 . . . 1.0 . . . . . . . . . . . . A . 22 ILE CG2 . . . . . . . . . rr_1kmr 1
. 17 . 4313 . 1 1 12 ILE H H 0.009 4.750 -1.692 . . . 1.0 . . . . . . . . . . . . A . 22 ILE H . . . . . . . . . rr_1kmr 1
. 17 . 4314 . 1 1 12 ILE HA H -1.326 6.618 -3.458 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HA . . . . . . . . . rr_1kmr 1
. 17 . 4315 . 1 1 12 ILE HB H -1.716 3.791 -2.680 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HB . . . . . . . . . rr_1kmr 1
. 17 . 4316 . 1 1 12 ILE HD11 H 0.421 3.277 -4.287 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD11 . . . . . . . . . rr_1kmr 1
. 17 . 4317 . 1 1 12 ILE HD12 H 0.486 4.102 -5.849 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD12 . . . . . . . . . rr_1kmr 1
. 17 . 4318 . 1 1 12 ILE HD13 H 0.701 5.038 -4.349 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HD13 . . . . . . . . . rr_1kmr 1
. 17 . 4319 . 1 1 12 ILE HG12 H -1.812 3.560 -5.280 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG12 . . . . . . . . . rr_1kmr 1
. 17 . 4320 . 1 1 12 ILE HG13 H -1.612 5.299 -5.389 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG13 . . . . . . . . . rr_1kmr 1
. 17 . 4321 . 1 1 12 ILE HG21 H -3.989 5.013 -4.290 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG21 . . . . . . . . . rr_1kmr 1
. 17 . 4322 . 1 1 12 ILE HG22 H -3.645 3.294 -3.974 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG22 . . . . . . . . . rr_1kmr 1
. 17 . 4323 . 1 1 12 ILE HG23 H -4.123 4.318 -2.653 . . . 1.0 . . . . . . . . . . . . A . 22 ILE HG23 . . . . . . . . . rr_1kmr 1
. 17 . 4324 . 1 1 12 ILE N N -0.252 5.714 -1.924 . . . 1.0 . . . . . . . . . . . . A . 22 ILE N . . . . . . . . . rr_1kmr 1
. 17 . 4325 . 1 1 12 ILE O O -2.814 8.051 -2.531 . . . 1.0 . . . . . . . . . . . . A . 22 ILE O . . . . . . . . . rr_1kmr 1
. 17 . 4326 . 1 1 13 PRO C C -3.612 8.408 1.242 . . . 1.0 . . . . . . . . . . . . A . 23 PRO C . . . . . . . . . rr_1kmr 1
. 17 . 4327 . 1 1 13 PRO CA C -4.077 7.704 -0.061 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CA . . . . . . . . . rr_1kmr 1
. 17 . 4328 . 1 1 13 PRO CB C -5.341 6.835 0.066 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CB . . . . . . . . . rr_1kmr 1
. 17 . 4329 . 1 1 13 PRO CD C -3.395 5.411 -0.246 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CD . . . . . . . . . rr_1kmr 1
. 17 . 4330 . 1 1 13 PRO CG C -4.901 5.367 -0.001 . . . 1.0 . . . . . . . . . . . . A . 23 PRO CG . . . . . . . . . rr_1kmr 1
. 17 . 4331 . 1 1 13 PRO HA H -4.297 8.557 -0.701 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HA . . . . . . . . . rr_1kmr 1
. 17 . 4332 . 1 1 13 PRO HB2 H -5.959 7.063 0.954 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4333 . 1 1 13 PRO HB3 H -5.964 7.028 -0.822 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4334 . 1 1 13 PRO HD2 H -2.834 5.313 0.675 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD2 . . . . . . . . . rr_1kmr 1
. 17 . 4335 . 1 1 13 PRO HD3 H -3.028 4.623 -0.913 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HD3 . . . . . . . . . rr_1kmr 1
. 17 . 4336 . 1 1 13 PRO HG2 H -5.160 4.804 0.912 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4337 . 1 1 13 PRO HG3 H -5.399 4.861 -0.848 . . . 1.0 . . . . . . . . . . . . A . 23 PRO HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4338 . 1 1 13 PRO N N -3.140 6.758 -0.732 . . . 1.0 . . . . . . . . . . . . A . 23 PRO N . . . . . . . . . rr_1kmr 1
. 17 . 4339 . 1 1 13 PRO O O -4.102 9.502 1.541 . . . 1.0 . . . . . . . . . . . . A . 23 PRO O . . . . . . . . . rr_1kmr 1
. 17 . 4340 . 1 1 14 LYS C C -0.664 8.737 3.004 . . . 1.0 . . . . . . . . . . . . A . 24 LYS C . . . . . . . . . rr_1kmr 1
. 17 . 4341 . 1 1 14 LYS CA C -2.158 8.366 3.252 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CA . . . . . . . . . rr_1kmr 1
. 17 . 4342 . 1 1 14 LYS CB C -2.346 7.326 4.386 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CB . . . . . . . . . rr_1kmr 1
. 17 . 4343 . 1 1 14 LYS CD C -4.831 6.386 4.130 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CD . . . . . . . . . rr_1kmr 1
. 17 . 4344 . 1 1 14 LYS CE C -4.671 4.864 3.923 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CE . . . . . . . . . rr_1kmr 1
. 17 . 4345 . 1 1 14 LYS CG C -3.766 7.124 4.982 . . . 1.0 . . . . . . . . . . . . A . 24 LYS CG . . . . . . . . . rr_1kmr 1
. 17 . 4346 . 1 1 14 LYS H H -2.436 6.864 1.637 . . . 1.0 . . . . . . . . . . . . A . 24 LYS H . . . . . . . . . rr_1kmr 1
. 17 . 4347 . 1 1 14 LYS HA H -2.706 9.281 3.556 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HA . . . . . . . . . rr_1kmr 1
. 17 . 4348 . 1 1 14 LYS HB2 H -1.917 6.361 4.064 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB2 . . . . . . . . . rr_1kmr 1
. 17 . 4349 . 1 1 14 LYS HB3 H -1.709 7.659 5.219 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HB3 . . . . . . . . . rr_1kmr 1
. 17 . 4350 . 1 1 14 LYS HD2 H -5.804 6.537 4.633 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD2 . . . . . . . . . rr_1kmr 1
. 17 . 4351 . 1 1 14 LYS HD3 H -4.965 6.887 3.157 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HD3 . . . . . . . . . rr_1kmr 1
. 17 . 4352 . 1 1 14 LYS HE2 H -4.648 4.350 4.899 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE2 . . . . . . . . . rr_1kmr 1
. 17 . 4353 . 1 1 14 LYS HE3 H -5.573 4.487 3.405 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HE3 . . . . . . . . . rr_1kmr 1
. 17 . 4354 . 1 1 14 LYS HG2 H -3.667 6.590 5.946 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG2 . . . . . . . . . rr_1kmr 1
. 17 . 4355 . 1 1 14 LYS HG3 H -4.167 8.117 5.259 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HG3 . . . . . . . . . rr_1kmr 1
. 17 . 4356 . 1 1 14 LYS HZ1 H -3.506 4.878 2.192 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ1 . . . . . . . . . rr_1kmr 1
. 17 . 4357 . 1 1 14 LYS HZ2 H -2.608 4.755 3.562 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ2 . . . . . . . . . rr_1kmr 1
. 17 . 4358 . 1 1 14 LYS HZ3 H -3.439 3.446 2.993 . . . 1.0 . . . . . . . . . . . . A . 24 LYS HZ3 . . . . . . . . . rr_1kmr 1
. 17 . 4359 . 1 1 14 LYS N N -2.690 7.794 1.994 . . . 1.0 . . . . . . . . . . . . A . 24 LYS N . . . . . . . . . rr_1kmr 1
. 17 . 4360 . 1 1 14 LYS NZ N -3.492 4.462 3.132 . . . 1.0 . . . . . . . . . . . . A . 24 LYS NZ . . . . . . . . . rr_1kmr 1
. 17 . 4361 . 1 1 14 LYS O O 0.241 7.931 3.247 . . . 1.0 . . . . . . . . . . . . A . 24 LYS O . . . . . . . . . rr_1kmr 1
. 17 . 4362 . 1 1 15 GLY C C 1.296 10.036 0.678 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . rr_1kmr 1
. 17 . 4363 . 1 1 15 GLY CA C 0.922 10.430 2.114 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . rr_1kmr 1
. 17 . 4364 . 1 1 15 GLY H H -1.268 10.527 2.318 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . rr_1kmr 1
. 17 . 4365 . 1 1 15 GLY HA2 H 0.953 11.531 2.198 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . rr_1kmr 1
. 17 . 4366 . 1 1 15 GLY HA3 H 1.687 10.065 2.827 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . rr_1kmr 1
. 17 . 4367 . 1 1 15 GLY N N -0.430 9.963 2.494 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . rr_1kmr 1
. 17 . 4368 . 1 1 15 GLY O O 0.676 10.552 -0.279 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . rr_1kmr 1
. 17 . 4369 . 1 1 15 GLY OXT O 2.221 9.213 0.502 . . . 1.0 . . . . . . . . . . . . A . 25 GLY OXT . . . . . . . . . rr_1kmr 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_1kmr
_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 1kmr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1kmr 1
1 1kmr.mr . . DISCOVER 2 distance NOE simple 275 rr_1kmr 1
1 1kmr.mr . . DISCOVER 3 distance "hydrogen bond" simple 6 rr_1kmr 1
1 1kmr.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 34 rr_1kmr 1
1 1kmr.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1kmr 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_1kmr
_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: '1kmr'" . . . . distance "general distance" . 0 rr_1kmr 1
2 "From CCPN project: '1kmr'" . . . . distance "hydrogen bond" . 0 rr_1kmr 1
3 "From CCPN project: '1kmr'" . . . . "dihedral angle" "Not applicable" . 0 rr_1kmr 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 1kmr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1kmr 1
1 1kmr.mr . . DISCOVER 2 distance NOE simple 275 rr_1kmr 1
1 1kmr.mr . . DISCOVER 3 distance "hydrogen bond" simple 6 rr_1kmr 1
1 1kmr.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 34 rr_1kmr 1
1 1kmr.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1kmr 1
stop_
save_
save_Discover_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_1kmr
_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_1kmr 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
;BIOSYM restraint 1
b11_x1.rstrnt :
Fulll set of NMR-derived restraints (unedited from b11_r results) for second annealing from extended structures
second annealing from extended structures All distance spring consts = 10 kcal/(mol-angstrom^2)
"Thus," a 1 kT rise corresponds to a 0.24 angstrom deviation
three-level set of upper "bounds," plus 0.5 angstroms for pseudoatoms
includes all possible chiral restraints All torsion spring consts = 50 "kcal/(mol-rad^2)," which is 0.0152 kcal/(mol-degree^2)
"Thus," a 1 kT rise corresponds to a 6.22 degree deviation distance HNi-HN1+1
;
1 1 16 20 rr_1kmr 1
2 HAi-HNi 26 1 27 14 rr_1kmr 1
3 HAi-HNi+1 41 1 42 16 rr_1kmr 1
4 HAi-HNi+3 55 1 56 16 rr_1kmr 1
5 HAi-HNi+2 65 1 66 16 rr_1kmr 1
6 HAi-HNi+4 73 1 74 16 rr_1kmr 1
7 HNi-Xi 78 1 79 13 rr_1kmr 1
8 HN-Xother 110 1 112 16 rr_1kmr 1
9 "! HN-X vague HAi-Xi" 142 1 146 13 rr_1kmr 1
10 HA-Xother 187 1 188 16 rr_1kmr 1
11
;HA-X vague
!
!
Xi-Xi
;
223 1 227 12 rr_1kmr 1
12 "X-X vague X-X other" 289 1 293 15 rr_1kmr 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) '1.13A.HN' (nmrStar names),'1.14A.HN' (nmrStar names) not linked" rr_1kmr 1
2 2 2 1 "Not handling restraint 2, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.15A.HN' (nmrStar names) not linked" rr_1kmr 1
3 2 3 1 "Not handling restraint 3, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.16A.HN' (nmrStar names) not linked" rr_1kmr 1
4 2 4 1 "Not handling restraint 4, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.17A.HN' (nmrStar names) not linked" rr_1kmr 1
5 2 5 1 "Not handling restraint 5, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.19A.HN' (nmrStar names) not linked" rr_1kmr 1
6 2 6 1 "Not handling restraint 6, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.20A.HN' (nmrStar names) not linked" rr_1kmr 1
7 2 7 1 "Not handling restraint 7, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.21A.HN' (nmrStar names) not linked" rr_1kmr 1
8 2 8 1 "Not handling restraint 8, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.22A.HN' (nmrStar names) not linked" rr_1kmr 1
9 2 9 1 "Not handling restraint 9, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.25A.HN' (nmrStar names) not linked" rr_1kmr 1
10 2 10 1 "Not handling restraint 10, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.HN' (nmrStar names) not linked" rr_1kmr 1
11 2 11 1 "Not handling restraint 11, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.13A.HA' (nmrStar names) not linked" rr_1kmr 1
12 2 12 1 "Not handling restraint 12, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.HA' (nmrStar names) not linked" rr_1kmr 1
13 2 13 1 "Not handling restraint 13, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
14 2 14 1 "Not handling restraint 14, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
15 2 15 1 "Not handling restraint 15, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
16 2 16 1 "Not handling restraint 16, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
17 2 17 1 "Not handling restraint 17, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
18 2 18 1 "Not handling restraint 18, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.20A.HA' (nmrStar names) not linked" rr_1kmr 1
19 2 19 1 "Not handling restraint 19, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.21A.HA' (nmrStar names) not linked" rr_1kmr 1
20 2 20 1 "Not handling restraint 20, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.HA' (nmrStar names) not linked" rr_1kmr 1
21 2 21 1 "Not handling restraint 21, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.24A.HA' (nmrStar names) not linked" rr_1kmr 1
22 2 22 1 "Not handling restraint 22, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.25A.X' (nmrStar names) not linked" rr_1kmr 1
23 2 23 1 "Not handling restraint 23, item 1, resonance(s) '1.12A.HN' (nmrStar names),'1.11A.HA' (nmrStar names) not linked" rr_1kmr 1
24 2 24 1 "Not handling restraint 24, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.HA' (nmrStar names) not linked" rr_1kmr 1
25 2 25 1 "Not handling restraint 25, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.14A.HA' (nmrStar names) not linked" rr_1kmr 1
26 2 26 1 "Not handling restraint 26, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
27 2 27 1 "Not handling restraint 27, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
28 2 28 1 "Not handling restraint 28, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
29 2 29 1 "Not handling restraint 29, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
30 2 30 1 "Not handling restraint 30, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
31 2 31 1 "Not handling restraint 31, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.20A.HA' (nmrStar names) not linked" rr_1kmr 1
32 2 32 1 "Not handling restraint 32, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.21A.HA' (nmrStar names) not linked" rr_1kmr 1
33 2 33 1 "Not handling restraint 33, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.23A.HA' (nmrStar names) not linked" rr_1kmr 1
34 2 34 1 "Not handling restraint 34, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.24A.HA' (nmrStar names) not linked" rr_1kmr 1
35 2 35 1 "Not handling restraint 35, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.12A.HA' (nmrStar names) not linked" rr_1kmr 1
36 2 36 1 "Not handling restraint 36, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.13A.HA' (nmrStar names) not linked" rr_1kmr 1
37 2 37 1 "Not handling restraint 37, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.14A.HA' (nmrStar names) not linked" rr_1kmr 1
38 2 38 1 "Not handling restraint 38, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
39 2 39 1 "Not handling restraint 39, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
40 2 40 1 "Not handling restraint 40, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
41 2 41 1 "Not handling restraint 41, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
42 2 42 1 "Not handling restraint 42, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
43 2 43 1 "Not handling restraint 43, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.12A.HA' (nmrStar names) not linked" rr_1kmr 1
44 2 44 1 "Not handling restraint 44, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
45 2 45 1 "Not handling restraint 45, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
46 2 46 1 "Not handling restraint 46, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
47 2 47 1 "Not handling restraint 47, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.20A.HA' (nmrStar names) not linked" rr_1kmr 1
48 2 48 1 "Not handling restraint 48, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.23A.HA' (nmrStar names) not linked" rr_1kmr 1
49 2 49 1 "Not handling restraint 49, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
50 2 50 1 "Not handling restraint 50, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
51 2 51 1 "Not handling restraint 51, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
52 2 52 1 "Not handling restraint 52, item 1, resonance(s) '1.12A.HN' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
53 2 53 1 "Not handling restraint 53, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
54 2 54 1 "Not handling restraint 54, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.HB1' (nmrStar names) not linked" rr_1kmr 1
55 2 55 1 "Not handling restraint 55, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.HB2' (nmrStar names) not linked" rr_1kmr 1
56 2 56 1 "Not handling restraint 56, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
57 2 57 1 "Not handling restraint 57, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
58 2 58 1 "Not handling restraint 58, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
59 2 59 1 "Not handling restraint 59, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HG11' (nmrStar names) not linked" rr_1kmr 1
60 2 60 1 "Not handling restraint 60, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HG12' (nmrStar names) not linked" rr_1kmr 1
61 2 61 1 "Not handling restraint 61, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
62 2 62 1 "Not handling restraint 62, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
63 2 63 1 "Not handling restraint 63, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.HB1' (nmrStar names) not linked" rr_1kmr 1
64 2 64 1 "Not handling restraint 64, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
65 2 65 1 "Not handling restraint 65, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
66 2 66 1 "Not handling restraint 66, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.17A.X1' (nmrStar names) not linked" rr_1kmr 1
67 2 67 1 "Not handling restraint 67, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
68 2 68 1 "Not handling restraint 68, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HB' (nmrStar names) not linked" rr_1kmr 1
69 2 69 1 "Not handling restraint 69, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
70 2 70 1 "Not handling restraint 70, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HG12' (nmrStar names) not linked" rr_1kmr 1
71 2 71 1 "Not handling restraint 71, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
72 2 72 1 "Not handling restraint 72, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
73 2 73 1 "Not handling restraint 73, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
74 2 74 1 "Not handling restraint 74, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.21A.HG1' (nmrStar names) not linked" rr_1kmr 1
75 2 75 1 "Not handling restraint 75, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
76 2 76 1 "Not handling restraint 76, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.HB' (nmrStar names) not linked" rr_1kmr 1
77 2 77 1 "Not handling restraint 77, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.HG12' (nmrStar names) not linked" rr_1kmr 1
78 2 78 1 "Not handling restraint 78, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
79 2 79 1 "Not handling restraint 79, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
80 2 80 1 "Not handling restraint 80, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
81 2 81 1 "Not handling restraint 81, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.24A.X2' (nmrStar names) not linked" rr_1kmr 1
82 2 82 1 "Not handling restraint 82, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
83 2 83 1 "Not handling restraint 83, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
84 2 84 1 "Not handling restraint 84, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
85 2 85 1 "Not handling restraint 85, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
86 2 86 1 "Not handling restraint 86, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
87 2 87 1 "Not handling restraint 87, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.14A.HB2' (nmrStar names) not linked" rr_1kmr 1
88 2 88 1 "Not handling restraint 88, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
89 2 89 1 "Not handling restraint 89, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
90 2 90 1 "Not handling restraint 90, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
91 2 91 1 "Not handling restraint 91, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
92 2 92 1 "Not handling restraint 92, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.16A.HB1' (nmrStar names) not linked" rr_1kmr 1
93 2 93 1 "Not handling restraint 93, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
94 2 94 1 "Not handling restraint 94, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
95 2 95 1 "Not handling restraint 95, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
96 2 96 1 "Not handling restraint 96, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
97 2 97 1 "Not handling restraint 97, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
98 2 98 1 "Not handling restraint 98, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
99 2 99 1 "Not handling restraint 99, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
100 2 100 1 "Not handling restraint 100, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
101 2 101 1 "Not handling restraint 101, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HG2' (nmrStar names) not linked" rr_1kmr 1
102 2 102 1 "Not handling restraint 102, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
103 2 103 1 "Not handling restraint 103, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
104 2 104 1 "Not handling restraint 104, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
105 2 105 1 "Not handling restraint 105, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
106 2 106 1 "Not handling restraint 106, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
107 2 107 1 "Not handling restraint 107, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
108 2 108 1 "Not handling restraint 108, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
109 2 109 1 "Not handling restraint 109, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.24A.X1' (nmrStar names) not linked" rr_1kmr 1
110 2 110 1 "Not handling restraint 110, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
111 2 111 1 "Not handling restraint 111, item 1, resonance(s) '1.11A.HA' (nmrStar names),'1.11A.X' (nmrStar names) not linked" rr_1kmr 1
112 2 112 1 "Not handling restraint 112, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
113 2 113 1 "Not handling restraint 113, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
114 2 114 1 "Not handling restraint 114, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
115 2 115 1 "Not handling restraint 115, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
116 2 116 1 "Not handling restraint 116, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
117 2 117 1 "Not handling restraint 117, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.14A.HB2' (nmrStar names) not linked" rr_1kmr 1
118 2 118 1 "Not handling restraint 118, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
119 2 119 1 "Not handling restraint 119, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
120 2 120 1 "Not handling restraint 120, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
121 2 121 1 "Not handling restraint 121, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.HG11' (nmrStar names) not linked" rr_1kmr 1
122 2 122 1 "Not handling restraint 122, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.HG12' (nmrStar names) not linked" rr_1kmr 1
123 2 123 1 "Not handling restraint 123, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
124 2 124 1 "Not handling restraint 124, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
125 2 125 1 "Not handling restraint 125, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.16A.HB1' (nmrStar names) not linked" rr_1kmr 1
126 2 126 1 "Not handling restraint 126, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
127 2 127 1 "Not handling restraint 127, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
128 2 128 1 "Not handling restraint 128, item 1, resonance(s) '1.17A.HA' (nmrStar names),'1.17A.X1' (nmrStar names) not linked" rr_1kmr 1
129 2 129 1 "Not handling restraint 129, item 1, resonance(s) '1.17A.HA' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
130 2 130 1 "Not handling restraint 130, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.HB' (nmrStar names) not linked" rr_1kmr 1
131 2 131 1 "Not handling restraint 131, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.HG12' (nmrStar names) not linked" rr_1kmr 1
132 2 132 1 "Not handling restraint 132, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
133 2 133 1 "Not handling restraint 133, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
134 2 134 1 "Not handling restraint 134, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
135 2 135 1 "Not handling restraint 135, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
136 2 136 1 "Not handling restraint 136, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
137 2 137 1 "Not handling restraint 137, item 1, resonance(s) '1.20A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
138 2 138 1 "Not handling restraint 138, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.21A.HG1' (nmrStar names) not linked" rr_1kmr 1
139 2 139 1 "Not handling restraint 139, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
140 2 140 1 "Not handling restraint 140, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.21A.X2' (nmrStar names) not linked" rr_1kmr 1
141 2 141 1 "Not handling restraint 141, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.HB' (nmrStar names) not linked" rr_1kmr 1
142 2 142 1 "Not handling restraint 142, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.HG12' (nmrStar names) not linked" rr_1kmr 1
143 2 143 1 "Not handling restraint 143, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
144 2 144 1 "Not handling restraint 144, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
145 2 145 1 "Not handling restraint 145, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
146 2 146 1 "Not handling restraint 146, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
147 2 147 1 "Not handling restraint 147, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
148 2 148 1 "Not handling restraint 148, item 1, resonance(s) '1.24A.HA' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
149 2 149 1 "Not handling restraint 149, item 1, resonance(s) '1.24A.HA' (nmrStar names),'1.24A.X1' (nmrStar names) not linked" rr_1kmr 1
150 2 150 1 "Not handling restraint 150, item 1, resonance(s) '1.24A.HA' (nmrStar names),'1.24A.X2' (nmrStar names) not linked" rr_1kmr 1
151 2 151 1 "Not handling restraint 151, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
152 2 152 1 "Not handling restraint 152, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
153 2 153 1 "Not handling restraint 153, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
154 2 154 1 "Not handling restraint 154, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
155 2 155 1 "Not handling restraint 155, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
156 2 156 1 "Not handling restraint 156, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
157 2 157 1 "Not handling restraint 157, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
158 2 158 1 "Not handling restraint 158, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
159 2 159 1 "Not handling restraint 159, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
160 2 160 1 "Not handling restraint 160, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
161 2 161 1 "Not handling restraint 161, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
162 2 162 1 "Not handling restraint 162, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
163 2 163 1 "Not handling restraint 163, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
164 2 164 1 "Not handling restraint 164, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.19A.HB1' (nmrStar names) not linked" rr_1kmr 1
165 2 165 1 "Not handling restraint 165, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
166 2 166 1 "Not handling restraint 166, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
167 2 167 1 "Not handling restraint 167, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
168 2 168 1 "Not handling restraint 168, item 1, resonance(s) '1.17A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
169 2 169 1 "Not handling restraint 169, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
170 2 170 1 "Not handling restraint 170, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.21A.HG1' (nmrStar names) not linked" rr_1kmr 1
171 2 171 1 "Not handling restraint 171, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
172 2 172 1 "Not handling restraint 172, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.HB' (nmrStar names) not linked" rr_1kmr 1
173 2 173 1 "Not handling restraint 173, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.HG12' (nmrStar names) not linked" rr_1kmr 1
174 2 174 1 "Not handling restraint 174, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
175 2 175 1 "Not handling restraint 175, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
176 2 176 1 "Not handling restraint 176, item 1, resonance(s) '1.20A.HA' (nmrStar names),'1.24A.X4' (nmrStar names) not linked" rr_1kmr 1
177 2 177 1 "Not handling restraint 177, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
178 2 178 1 "Not handling restraint 178, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
179 2 179 1 "Not handling restraint 179, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
180 2 180 1 "Not handling restraint 180, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
181 2 181 1 "Not handling restraint 181, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
182 2 182 1 "Not handling restraint 182, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
183 2 183 1 "Not handling restraint 183, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
184 2 184 1 "Not handling restraint 184, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
185 2 185 1 "Not handling restraint 185, item 1, resonance(s) '1.11A.HB1' (nmrStar names),'1.11A.HB2' (nmrStar names) not linked" rr_1kmr 1
186 2 186 1 "Not handling restraint 186, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
187 2 187 1 "Not handling restraint 187, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
188 2 188 1 "Not handling restraint 188, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
189 2 189 1 "Not handling restraint 189, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.HE' (nmrStar names) not linked" rr_1kmr 1
190 2 190 1 "Not handling restraint 190, item 1, resonance(s) '1.12A.HB2' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
191 2 191 1 "Not handling restraint 191, item 1, resonance(s) '1.12A.HB2' (nmrStar names),'1.12A.HE' (nmrStar names) not linked" rr_1kmr 1
192 2 192 1 "Not handling restraint 192, item 1, resonance(s) '1.12A.X1' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
193 2 193 1 "Not handling restraint 193, item 1, resonance(s) '1.12A.X2' (nmrStar names),'1.12A.HE' (nmrStar names) not linked" rr_1kmr 1
194 2 194 1 "Not handling restraint 194, item 1, resonance(s) '1.12A.X2' (nmrStar names),'1.12A.X3' (nmrStar names) not linked" rr_1kmr 1
195 2 195 1 "Not handling restraint 195, item 1, resonance(s) '1.12A.X2' (nmrStar names),'1.12A.X4' (nmrStar names) not linked" rr_1kmr 1
196 2 196 1 "Not handling restraint 196, item 1, resonance(s) '1.14A.HB2' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
197 2 197 1 "Not handling restraint 197, item 1, resonance(s) '1.14A.HB2' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
198 2 198 1 "Not handling restraint 198, item 1, resonance(s) '1.14A.X1' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
199 2 199 1 "Not handling restraint 199, item 1, resonance(s) '1.15A.HB' (nmrStar names),'1.15A.HG11' (nmrStar names) not linked" rr_1kmr 1
200 2 200 1 "Not handling restraint 200, item 1, resonance(s) '1.15A.HB' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
201 2 201 1 "Not handling restraint 201, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.15A.HG12' (nmrStar names) not linked" rr_1kmr 1
202 2 202 1 "Not handling restraint 202, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
203 2 203 1 "Not handling restraint 203, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
204 2 204 1 "Not handling restraint 204, item 1, resonance(s) '1.15A.HG12' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
205 2 205 1 "Not handling restraint 205, item 1, resonance(s) '1.15A.HG12' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
206 2 206 1 "Not handling restraint 206, item 1, resonance(s) '1.16A.HB1' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
207 2 207 1 "Not handling restraint 207, item 1, resonance(s) '1.16A.HB2' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
208 2 208 1 "Not handling restraint 208, item 1, resonance(s) '1.16A.X2' (nmrStar names),'1.16A.HE1' (nmrStar names) not linked" rr_1kmr 1
209 2 209 1 "Not handling restraint 209, item 1, resonance(s) '1.16A.X2' (nmrStar names),'1.16A.HE2' (nmrStar names) not linked" rr_1kmr 1
210 2 210 1 "Not handling restraint 210, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
211 2 211 1 "Not handling restraint 211, item 1, resonance(s) '1.17A.HB2' (nmrStar names),'1.17A.HE' (nmrStar names) not linked" rr_1kmr 1
212 2 212 1 "Not handling restraint 212, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.HB1' (nmrStar names) not linked" rr_1kmr 1
213 2 213 1 "Not handling restraint 213, item 1, resonance(s) '1.17A.HE' (nmrStar names),'1.17A.HB1' (nmrStar names) not linked" rr_1kmr 1
214 2 214 1 "Not handling restraint 214, item 1, resonance(s) '1.17A.X1' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
215 2 215 1 "Not handling restraint 215, item 1, resonance(s) '1.17A.X1' (nmrStar names),'1.17A.HE' (nmrStar names) not linked" rr_1kmr 1
216 2 216 1 "Not handling restraint 216, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.X3' (nmrStar names) not linked" rr_1kmr 1
217 2 217 1 "Not handling restraint 217, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.X4' (nmrStar names) not linked" rr_1kmr 1
218 2 218 1 "Not handling restraint 218, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.HE' (nmrStar names) not linked" rr_1kmr 1
219 2 219 1 "Not handling restraint 219, item 1, resonance(s) '1.18A.HG11' (nmrStar names),'1.18A.HG12' (nmrStar names) not linked" rr_1kmr 1
220 2 220 1 "Not handling restraint 220, item 1, resonance(s) '1.18A.HG12' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
221 2 221 1 "Not handling restraint 221, item 1, resonance(s) '1.18A.HG11' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
222 2 222 1 "Not handling restraint 222, item 1, resonance(s) '1.18A.HG11' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
223 2 223 1 "Not handling restraint 223, item 1, resonance(s) '1.19A.HB2' (nmrStar names),'1.19A.HB1' (nmrStar names) not linked" rr_1kmr 1
224 2 224 1 "Not handling restraint 224, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
225 2 225 1 "Not handling restraint 225, item 1, resonance(s) '1.19A.HB2' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
226 2 226 1 "Not handling restraint 226, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HG2' (nmrStar names) not linked" rr_1kmr 1
227 2 227 1 "Not handling restraint 227, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HE21' (nmrStar names) not linked" rr_1kmr 1
228 2 228 1 "Not handling restraint 228, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
229 2 229 1 "Not handling restraint 229, item 1, resonance(s) '1.19A.HG2' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
230 2 230 1 "Not handling restraint 230, item 1, resonance(s) '1.21A.HG1' (nmrStar names),'1.21A.X2' (nmrStar names) not linked" rr_1kmr 1
231 2 231 1 "Not handling restraint 231, item 1, resonance(s) '1.21A.HG1' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
232 2 232 1 "Not handling restraint 232, item 1, resonance(s) '1.21A.HG2' (nmrStar names),'1.21A.X2' (nmrStar names) not linked" rr_1kmr 1
233 2 233 1 "Not handling restraint 233, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
234 2 234 1 "Not handling restraint 234, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
235 2 235 1 "Not handling restraint 235, item 1, resonance(s) '1.22A.HG12' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
236 2 236 1 "Not handling restraint 236, item 1, resonance(s) '1.22A.X1' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
237 2 237 1 "Not handling restraint 237, item 1, resonance(s) '1.23A.HB2' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
238 2 238 1 "Not handling restraint 238, item 1, resonance(s) '1.23A.HB2' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
239 2 239 1 "Not handling restraint 239, item 1, resonance(s) '1.23A.HD2' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
240 2 240 1 "Not handling restraint 240, item 1, resonance(s) '1.23A.HG2' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
241 2 241 1 "Not handling restraint 241, item 1, resonance(s) '1.23A.HD2' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
242 2 242 1 "Not handling restraint 242, item 1, resonance(s) '1.23A.HD2' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
243 2 243 1 "Not handling restraint 243, item 1, resonance(s) '1.24A.X1' (nmrStar names),'1.24A.X3' (nmrStar names) not linked" rr_1kmr 1
244 2 244 1 "Not handling restraint 244, item 1, resonance(s) '1.24A.X1' (nmrStar names),'1.24A.X4' (nmrStar names) not linked" rr_1kmr 1
245 2 245 1 "Not handling restraint 245, item 1, resonance(s) '1.24A.X4' (nmrStar names),'1.24A.X3' (nmrStar names) not linked" rr_1kmr 1
246 2 246 1 "Not handling restraint 246, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
247 2 247 1 "Not handling restraint 247, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
248 2 248 1 "Not handling restraint 248, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
249 2 249 1 "Not handling restraint 249, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
250 2 250 1 "Not handling restraint 250, item 1, resonance(s) '1.15A.HG12' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
251 2 251 1 "Not handling restraint 251, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
252 2 252 1 "Not handling restraint 252, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
253 2 253 1 "Not handling restraint 253, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
254 2 254 1 "Not handling restraint 254, item 1, resonance(s) '1.14A.X1' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
255 2 255 1 "Not handling restraint 255, item 1, resonance(s) '1.14A.X1' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
256 2 256 1 "Not handling restraint 256, item 1, resonance(s) '1.14A.X2' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
257 2 257 1 "Not handling restraint 257, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
258 2 258 1 "Not handling restraint 258, item 1, resonance(s) '1.15A.X2' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
259 2 259 1 "Not handling restraint 259, item 1, resonance(s) '1.15A.X2' (nmrStar names),'1.19A.HE21' (nmrStar names) not linked" rr_1kmr 1
260 2 260 1 "Not handling restraint 260, item 1, resonance(s) '1.15A.X2' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
261 2 261 1 "Not handling restraint 261, item 1, resonance(s) '1.18A.X1' (nmrStar names),'1.16A.X2' (nmrStar names) not linked" rr_1kmr 1
262 2 262 1 "Not handling restraint 262, item 1, resonance(s) '1.20A.X' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
263 2 263 1 "Not handling restraint 263, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
264 2 264 1 "Not handling restraint 264, item 1, resonance(s) '1.18A.X1' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
265 2 265 1 "Not handling restraint 265, item 1, resonance(s) '1.18A.X1' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
266 2 266 1 "Not handling restraint 266, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
267 2 267 1 "Not handling restraint 267, item 1, resonance(s) '1.21A.HG1' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
268 2 268 1 "Not handling restraint 268, item 1, resonance(s) '1.22A.X1' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
269 2 269 1 "Not handling restraint 269, item 1, resonance(s) '1.21A.HG2' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
270 2 270 1 "Not handling restraint 270, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.24A.X4' (nmrStar names) not linked" rr_1kmr 1
271 2 271 1 "Not handling restraint 271, item 1, resonance(s) '1.23A.HB2' (nmrStar names),'1.24A.X3' (nmrStar names) not linked" rr_1kmr 1
272 2 272 1 "Not handling restraint 272, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
273 2 273 1 "Not handling restraint 273, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
274 2 274 1 "Not handling restraint 274, item 1, resonance(s) '1.22A.X1' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
275 2 275 1 "Not handling restraint 275, item 1, resonance(s) '1.22A.X2' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
stop_
save_
save_Discover_distance_constraints_3
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_3
_Gen_dist_constraint_list.Entry_ID rr_1kmr
_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_1kmr 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-bond restraints" 1 1 2 7 rr_1kmr 2
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 3 1 1 "Not handling restraint 1, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.13A.O' (nmrStar names) not linked" rr_1kmr 2
2 3 2 1 "Not handling restraint 2, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.14A.O' (nmrStar names) not linked" rr_1kmr 2
3 3 3 1 "Not handling restraint 3, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.15A.O' (nmrStar names) not linked" rr_1kmr 2
4 3 4 1 "Not handling restraint 4, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.16A.O' (nmrStar names) not linked" rr_1kmr 2
5 3 5 1 "Not handling restraint 5, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.17A.O' (nmrStar names) not linked" rr_1kmr 2
6 3 6 1 "Not handling restraint 6, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.18A.O' (nmrStar names) not linked" rr_1kmr 2
stop_
save_
save_Discover_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_1kmr
_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_1kmr 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
;BIOSYM restraint 1
b11_x1.rstrnt :
Fulll set of NMR-derived restraints (unedited from b11_r results) for second annealing from extended structures
second annealing from extended structures All distance spring consts = 10 kcal/(mol-angstrom^2)
"Thus," a 1 kT rise corresponds to a 0.24 angstrom deviation
three-level set of upper "bounds," plus 0.5 angstroms for pseudoatoms
includes all possible chiral restraints All torsion spring consts = 50 "kcal/(mol-rad^2)," which is 0.0152 kcal/(mol-degree^2)
"Thus," a 1 kT rise corresponds to a 6.22 degree deviation distance HNi-HN1+1
;
1 1 16 20 rr_1kmr 1
2 HAi-HNi 26 1 27 14 rr_1kmr 1
3 HAi-HNi+1 41 1 42 16 rr_1kmr 1
4 HAi-HNi+3 55 1 56 16 rr_1kmr 1
5 HAi-HNi+2 65 1 66 16 rr_1kmr 1
6 HAi-HNi+4 73 1 74 16 rr_1kmr 1
7 HNi-Xi 78 1 79 13 rr_1kmr 1
8 HN-Xother 110 1 112 16 rr_1kmr 1
9 "! HN-X vague HAi-Xi" 142 1 146 13 rr_1kmr 1
10 HA-Xother 187 1 188 16 rr_1kmr 1
11
;HA-X vague
!
!
Xi-Xi
;
223 1 227 12 rr_1kmr 1
12 "X-X vague X-X other" 289 1 293 15 rr_1kmr 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) '1.13A.HN' (nmrStar names),'1.14A.HN' (nmrStar names) not linked" rr_1kmr 1
2 2 2 1 "Not handling restraint 2, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.15A.HN' (nmrStar names) not linked" rr_1kmr 1
3 2 3 1 "Not handling restraint 3, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.16A.HN' (nmrStar names) not linked" rr_1kmr 1
4 2 4 1 "Not handling restraint 4, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.17A.HN' (nmrStar names) not linked" rr_1kmr 1
5 2 5 1 "Not handling restraint 5, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.19A.HN' (nmrStar names) not linked" rr_1kmr 1
6 2 6 1 "Not handling restraint 6, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.20A.HN' (nmrStar names) not linked" rr_1kmr 1
7 2 7 1 "Not handling restraint 7, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.21A.HN' (nmrStar names) not linked" rr_1kmr 1
8 2 8 1 "Not handling restraint 8, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.22A.HN' (nmrStar names) not linked" rr_1kmr 1
9 2 9 1 "Not handling restraint 9, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.25A.HN' (nmrStar names) not linked" rr_1kmr 1
10 2 10 1 "Not handling restraint 10, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.HN' (nmrStar names) not linked" rr_1kmr 1
11 2 11 1 "Not handling restraint 11, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.13A.HA' (nmrStar names) not linked" rr_1kmr 1
12 2 12 1 "Not handling restraint 12, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.HA' (nmrStar names) not linked" rr_1kmr 1
13 2 13 1 "Not handling restraint 13, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
14 2 14 1 "Not handling restraint 14, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
15 2 15 1 "Not handling restraint 15, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
16 2 16 1 "Not handling restraint 16, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
17 2 17 1 "Not handling restraint 17, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
18 2 18 1 "Not handling restraint 18, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.20A.HA' (nmrStar names) not linked" rr_1kmr 1
19 2 19 1 "Not handling restraint 19, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.21A.HA' (nmrStar names) not linked" rr_1kmr 1
20 2 20 1 "Not handling restraint 20, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.HA' (nmrStar names) not linked" rr_1kmr 1
21 2 21 1 "Not handling restraint 21, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.24A.HA' (nmrStar names) not linked" rr_1kmr 1
22 2 22 1 "Not handling restraint 22, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.25A.X' (nmrStar names) not linked" rr_1kmr 1
23 2 23 1 "Not handling restraint 23, item 1, resonance(s) '1.12A.HN' (nmrStar names),'1.11A.HA' (nmrStar names) not linked" rr_1kmr 1
24 2 24 1 "Not handling restraint 24, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.HA' (nmrStar names) not linked" rr_1kmr 1
25 2 25 1 "Not handling restraint 25, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.14A.HA' (nmrStar names) not linked" rr_1kmr 1
26 2 26 1 "Not handling restraint 26, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
27 2 27 1 "Not handling restraint 27, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
28 2 28 1 "Not handling restraint 28, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
29 2 29 1 "Not handling restraint 29, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
30 2 30 1 "Not handling restraint 30, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
31 2 31 1 "Not handling restraint 31, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.20A.HA' (nmrStar names) not linked" rr_1kmr 1
32 2 32 1 "Not handling restraint 32, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.21A.HA' (nmrStar names) not linked" rr_1kmr 1
33 2 33 1 "Not handling restraint 33, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.23A.HA' (nmrStar names) not linked" rr_1kmr 1
34 2 34 1 "Not handling restraint 34, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.24A.HA' (nmrStar names) not linked" rr_1kmr 1
35 2 35 1 "Not handling restraint 35, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.12A.HA' (nmrStar names) not linked" rr_1kmr 1
36 2 36 1 "Not handling restraint 36, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.13A.HA' (nmrStar names) not linked" rr_1kmr 1
37 2 37 1 "Not handling restraint 37, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.14A.HA' (nmrStar names) not linked" rr_1kmr 1
38 2 38 1 "Not handling restraint 38, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
39 2 39 1 "Not handling restraint 39, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
40 2 40 1 "Not handling restraint 40, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
41 2 41 1 "Not handling restraint 41, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
42 2 42 1 "Not handling restraint 42, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
43 2 43 1 "Not handling restraint 43, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.12A.HA' (nmrStar names) not linked" rr_1kmr 1
44 2 44 1 "Not handling restraint 44, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.17A.HA' (nmrStar names) not linked" rr_1kmr 1
45 2 45 1 "Not handling restraint 45, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
46 2 46 1 "Not handling restraint 46, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.19A.HA' (nmrStar names) not linked" rr_1kmr 1
47 2 47 1 "Not handling restraint 47, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.20A.HA' (nmrStar names) not linked" rr_1kmr 1
48 2 48 1 "Not handling restraint 48, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.23A.HA' (nmrStar names) not linked" rr_1kmr 1
49 2 49 1 "Not handling restraint 49, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.15A.HA' (nmrStar names) not linked" rr_1kmr 1
50 2 50 1 "Not handling restraint 50, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.16A.HA' (nmrStar names) not linked" rr_1kmr 1
51 2 51 1 "Not handling restraint 51, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.18A.HA' (nmrStar names) not linked" rr_1kmr 1
52 2 52 1 "Not handling restraint 52, item 1, resonance(s) '1.12A.HN' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
53 2 53 1 "Not handling restraint 53, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
54 2 54 1 "Not handling restraint 54, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.HB1' (nmrStar names) not linked" rr_1kmr 1
55 2 55 1 "Not handling restraint 55, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.HB2' (nmrStar names) not linked" rr_1kmr 1
56 2 56 1 "Not handling restraint 56, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
57 2 57 1 "Not handling restraint 57, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
58 2 58 1 "Not handling restraint 58, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
59 2 59 1 "Not handling restraint 59, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HG11' (nmrStar names) not linked" rr_1kmr 1
60 2 60 1 "Not handling restraint 60, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.HG12' (nmrStar names) not linked" rr_1kmr 1
61 2 61 1 "Not handling restraint 61, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
62 2 62 1 "Not handling restraint 62, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
63 2 63 1 "Not handling restraint 63, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.HB1' (nmrStar names) not linked" rr_1kmr 1
64 2 64 1 "Not handling restraint 64, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
65 2 65 1 "Not handling restraint 65, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
66 2 66 1 "Not handling restraint 66, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.17A.X1' (nmrStar names) not linked" rr_1kmr 1
67 2 67 1 "Not handling restraint 67, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
68 2 68 1 "Not handling restraint 68, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HB' (nmrStar names) not linked" rr_1kmr 1
69 2 69 1 "Not handling restraint 69, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
70 2 70 1 "Not handling restraint 70, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.HG12' (nmrStar names) not linked" rr_1kmr 1
71 2 71 1 "Not handling restraint 71, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
72 2 72 1 "Not handling restraint 72, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
73 2 73 1 "Not handling restraint 73, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
74 2 74 1 "Not handling restraint 74, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.21A.HG1' (nmrStar names) not linked" rr_1kmr 1
75 2 75 1 "Not handling restraint 75, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
76 2 76 1 "Not handling restraint 76, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.HB' (nmrStar names) not linked" rr_1kmr 1
77 2 77 1 "Not handling restraint 77, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.HG12' (nmrStar names) not linked" rr_1kmr 1
78 2 78 1 "Not handling restraint 78, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
79 2 79 1 "Not handling restraint 79, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
80 2 80 1 "Not handling restraint 80, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
81 2 81 1 "Not handling restraint 81, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.24A.X2' (nmrStar names) not linked" rr_1kmr 1
82 2 82 1 "Not handling restraint 82, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
83 2 83 1 "Not handling restraint 83, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
84 2 84 1 "Not handling restraint 84, item 1, resonance(s) '1.13A.HN' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
85 2 85 1 "Not handling restraint 85, item 1, resonance(s) '1.14A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
86 2 86 1 "Not handling restraint 86, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
87 2 87 1 "Not handling restraint 87, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.14A.HB2' (nmrStar names) not linked" rr_1kmr 1
88 2 88 1 "Not handling restraint 88, item 1, resonance(s) '1.15A.HN' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
89 2 89 1 "Not handling restraint 89, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
90 2 90 1 "Not handling restraint 90, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
91 2 91 1 "Not handling restraint 91, item 1, resonance(s) '1.16A.HN' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
92 2 92 1 "Not handling restraint 92, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.16A.HB1' (nmrStar names) not linked" rr_1kmr 1
93 2 93 1 "Not handling restraint 93, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
94 2 94 1 "Not handling restraint 94, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
95 2 95 1 "Not handling restraint 95, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
96 2 96 1 "Not handling restraint 96, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
97 2 97 1 "Not handling restraint 97, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
98 2 98 1 "Not handling restraint 98, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
99 2 99 1 "Not handling restraint 99, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
100 2 100 1 "Not handling restraint 100, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
101 2 101 1 "Not handling restraint 101, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.19A.HG2' (nmrStar names) not linked" rr_1kmr 1
102 2 102 1 "Not handling restraint 102, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
103 2 103 1 "Not handling restraint 103, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
104 2 104 1 "Not handling restraint 104, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
105 2 105 1 "Not handling restraint 105, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
106 2 106 1 "Not handling restraint 106, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
107 2 107 1 "Not handling restraint 107, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
108 2 108 1 "Not handling restraint 108, item 1, resonance(s) '1.24A.HN' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
109 2 109 1 "Not handling restraint 109, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.24A.X1' (nmrStar names) not linked" rr_1kmr 1
110 2 110 1 "Not handling restraint 110, item 1, resonance(s) '1.25A.HN' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
111 2 111 1 "Not handling restraint 111, item 1, resonance(s) '1.11A.HA' (nmrStar names),'1.11A.X' (nmrStar names) not linked" rr_1kmr 1
112 2 112 1 "Not handling restraint 112, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
113 2 113 1 "Not handling restraint 113, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
114 2 114 1 "Not handling restraint 114, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
115 2 115 1 "Not handling restraint 115, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
116 2 116 1 "Not handling restraint 116, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
117 2 117 1 "Not handling restraint 117, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.14A.HB2' (nmrStar names) not linked" rr_1kmr 1
118 2 118 1 "Not handling restraint 118, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
119 2 119 1 "Not handling restraint 119, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
120 2 120 1 "Not handling restraint 120, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
121 2 121 1 "Not handling restraint 121, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.HG11' (nmrStar names) not linked" rr_1kmr 1
122 2 122 1 "Not handling restraint 122, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.HG12' (nmrStar names) not linked" rr_1kmr 1
123 2 123 1 "Not handling restraint 123, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
124 2 124 1 "Not handling restraint 124, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
125 2 125 1 "Not handling restraint 125, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.16A.HB1' (nmrStar names) not linked" rr_1kmr 1
126 2 126 1 "Not handling restraint 126, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
127 2 127 1 "Not handling restraint 127, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
128 2 128 1 "Not handling restraint 128, item 1, resonance(s) '1.17A.HA' (nmrStar names),'1.17A.X1' (nmrStar names) not linked" rr_1kmr 1
129 2 129 1 "Not handling restraint 129, item 1, resonance(s) '1.17A.HA' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
130 2 130 1 "Not handling restraint 130, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.HB' (nmrStar names) not linked" rr_1kmr 1
131 2 131 1 "Not handling restraint 131, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.HG12' (nmrStar names) not linked" rr_1kmr 1
132 2 132 1 "Not handling restraint 132, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
133 2 133 1 "Not handling restraint 133, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
134 2 134 1 "Not handling restraint 134, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
135 2 135 1 "Not handling restraint 135, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
136 2 136 1 "Not handling restraint 136, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
137 2 137 1 "Not handling restraint 137, item 1, resonance(s) '1.20A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
138 2 138 1 "Not handling restraint 138, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.21A.HG1' (nmrStar names) not linked" rr_1kmr 1
139 2 139 1 "Not handling restraint 139, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
140 2 140 1 "Not handling restraint 140, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.21A.X2' (nmrStar names) not linked" rr_1kmr 1
141 2 141 1 "Not handling restraint 141, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.HB' (nmrStar names) not linked" rr_1kmr 1
142 2 142 1 "Not handling restraint 142, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.HG12' (nmrStar names) not linked" rr_1kmr 1
143 2 143 1 "Not handling restraint 143, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
144 2 144 1 "Not handling restraint 144, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
145 2 145 1 "Not handling restraint 145, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
146 2 146 1 "Not handling restraint 146, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
147 2 147 1 "Not handling restraint 147, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
148 2 148 1 "Not handling restraint 148, item 1, resonance(s) '1.24A.HA' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
149 2 149 1 "Not handling restraint 149, item 1, resonance(s) '1.24A.HA' (nmrStar names),'1.24A.X1' (nmrStar names) not linked" rr_1kmr 1
150 2 150 1 "Not handling restraint 150, item 1, resonance(s) '1.24A.HA' (nmrStar names),'1.24A.X2' (nmrStar names) not linked" rr_1kmr 1
151 2 151 1 "Not handling restraint 151, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
152 2 152 1 "Not handling restraint 152, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
153 2 153 1 "Not handling restraint 153, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
154 2 154 1 "Not handling restraint 154, item 1, resonance(s) '1.12A.HA' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
155 2 155 1 "Not handling restraint 155, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.12A.HB1' (nmrStar names) not linked" rr_1kmr 1
156 2 156 1 "Not handling restraint 156, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
157 2 157 1 "Not handling restraint 157, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.16A.HB2' (nmrStar names) not linked" rr_1kmr 1
158 2 158 1 "Not handling restraint 158, item 1, resonance(s) '1.13A.HA' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
159 2 159 1 "Not handling restraint 159, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
160 2 160 1 "Not handling restraint 160, item 1, resonance(s) '1.14A.HA' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
161 2 161 1 "Not handling restraint 161, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
162 2 162 1 "Not handling restraint 162, item 1, resonance(s) '1.15A.HA' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
163 2 163 1 "Not handling restraint 163, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
164 2 164 1 "Not handling restraint 164, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.19A.HB1' (nmrStar names) not linked" rr_1kmr 1
165 2 165 1 "Not handling restraint 165, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
166 2 166 1 "Not handling restraint 166, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
167 2 167 1 "Not handling restraint 167, item 1, resonance(s) '1.16A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
168 2 168 1 "Not handling restraint 168, item 1, resonance(s) '1.17A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
169 2 169 1 "Not handling restraint 169, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
170 2 170 1 "Not handling restraint 170, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.21A.HG1' (nmrStar names) not linked" rr_1kmr 1
171 2 171 1 "Not handling restraint 171, item 1, resonance(s) '1.18A.HA' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
172 2 172 1 "Not handling restraint 172, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.HB' (nmrStar names) not linked" rr_1kmr 1
173 2 173 1 "Not handling restraint 173, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.HG12' (nmrStar names) not linked" rr_1kmr 1
174 2 174 1 "Not handling restraint 174, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
175 2 175 1 "Not handling restraint 175, item 1, resonance(s) '1.19A.HA' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
176 2 176 1 "Not handling restraint 176, item 1, resonance(s) '1.20A.HA' (nmrStar names),'1.24A.X4' (nmrStar names) not linked" rr_1kmr 1
177 2 177 1 "Not handling restraint 177, item 1, resonance(s) '1.21A.HA' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
178 2 178 1 "Not handling restraint 178, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
179 2 179 1 "Not handling restraint 179, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
180 2 180 1 "Not handling restraint 180, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
181 2 181 1 "Not handling restraint 181, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
182 2 182 1 "Not handling restraint 182, item 1, resonance(s) '1.22A.HA' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
183 2 183 1 "Not handling restraint 183, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
184 2 184 1 "Not handling restraint 184, item 1, resonance(s) '1.23A.HA' (nmrStar names),'1.24A.X' (nmrStar names) not linked" rr_1kmr 1
185 2 185 1 "Not handling restraint 185, item 1, resonance(s) '1.11A.HB1' (nmrStar names),'1.11A.HB2' (nmrStar names) not linked" rr_1kmr 1
186 2 186 1 "Not handling restraint 186, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
187 2 187 1 "Not handling restraint 187, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
188 2 188 1 "Not handling restraint 188, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
189 2 189 1 "Not handling restraint 189, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.12A.HE' (nmrStar names) not linked" rr_1kmr 1
190 2 190 1 "Not handling restraint 190, item 1, resonance(s) '1.12A.HB2' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
191 2 191 1 "Not handling restraint 191, item 1, resonance(s) '1.12A.HB2' (nmrStar names),'1.12A.HE' (nmrStar names) not linked" rr_1kmr 1
192 2 192 1 "Not handling restraint 192, item 1, resonance(s) '1.12A.X1' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
193 2 193 1 "Not handling restraint 193, item 1, resonance(s) '1.12A.X2' (nmrStar names),'1.12A.HE' (nmrStar names) not linked" rr_1kmr 1
194 2 194 1 "Not handling restraint 194, item 1, resonance(s) '1.12A.X2' (nmrStar names),'1.12A.X3' (nmrStar names) not linked" rr_1kmr 1
195 2 195 1 "Not handling restraint 195, item 1, resonance(s) '1.12A.X2' (nmrStar names),'1.12A.X4' (nmrStar names) not linked" rr_1kmr 1
196 2 196 1 "Not handling restraint 196, item 1, resonance(s) '1.14A.HB2' (nmrStar names),'1.14A.X1' (nmrStar names) not linked" rr_1kmr 1
197 2 197 1 "Not handling restraint 197, item 1, resonance(s) '1.14A.HB2' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
198 2 198 1 "Not handling restraint 198, item 1, resonance(s) '1.14A.X1' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
199 2 199 1 "Not handling restraint 199, item 1, resonance(s) '1.15A.HB' (nmrStar names),'1.15A.HG11' (nmrStar names) not linked" rr_1kmr 1
200 2 200 1 "Not handling restraint 200, item 1, resonance(s) '1.15A.HB' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
201 2 201 1 "Not handling restraint 201, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.15A.HG12' (nmrStar names) not linked" rr_1kmr 1
202 2 202 1 "Not handling restraint 202, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
203 2 203 1 "Not handling restraint 203, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
204 2 204 1 "Not handling restraint 204, item 1, resonance(s) '1.15A.HG12' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
205 2 205 1 "Not handling restraint 205, item 1, resonance(s) '1.15A.HG12' (nmrStar names),'1.15A.X2' (nmrStar names) not linked" rr_1kmr 1
206 2 206 1 "Not handling restraint 206, item 1, resonance(s) '1.16A.HB1' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
207 2 207 1 "Not handling restraint 207, item 1, resonance(s) '1.16A.HB2' (nmrStar names),'1.16A.X1' (nmrStar names) not linked" rr_1kmr 1
208 2 208 1 "Not handling restraint 208, item 1, resonance(s) '1.16A.X2' (nmrStar names),'1.16A.HE1' (nmrStar names) not linked" rr_1kmr 1
209 2 209 1 "Not handling restraint 209, item 1, resonance(s) '1.16A.X2' (nmrStar names),'1.16A.HE2' (nmrStar names) not linked" rr_1kmr 1
210 2 210 1 "Not handling restraint 210, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
211 2 211 1 "Not handling restraint 211, item 1, resonance(s) '1.17A.HB2' (nmrStar names),'1.17A.HE' (nmrStar names) not linked" rr_1kmr 1
212 2 212 1 "Not handling restraint 212, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.HB1' (nmrStar names) not linked" rr_1kmr 1
213 2 213 1 "Not handling restraint 213, item 1, resonance(s) '1.17A.HE' (nmrStar names),'1.17A.HB1' (nmrStar names) not linked" rr_1kmr 1
214 2 214 1 "Not handling restraint 214, item 1, resonance(s) '1.17A.X1' (nmrStar names),'1.17A.X2' (nmrStar names) not linked" rr_1kmr 1
215 2 215 1 "Not handling restraint 215, item 1, resonance(s) '1.17A.X1' (nmrStar names),'1.17A.HE' (nmrStar names) not linked" rr_1kmr 1
216 2 216 1 "Not handling restraint 216, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.X3' (nmrStar names) not linked" rr_1kmr 1
217 2 217 1 "Not handling restraint 217, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.X4' (nmrStar names) not linked" rr_1kmr 1
218 2 218 1 "Not handling restraint 218, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.17A.HE' (nmrStar names) not linked" rr_1kmr 1
219 2 219 1 "Not handling restraint 219, item 1, resonance(s) '1.18A.HG11' (nmrStar names),'1.18A.HG12' (nmrStar names) not linked" rr_1kmr 1
220 2 220 1 "Not handling restraint 220, item 1, resonance(s) '1.18A.HG12' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
221 2 221 1 "Not handling restraint 221, item 1, resonance(s) '1.18A.HG11' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
222 2 222 1 "Not handling restraint 222, item 1, resonance(s) '1.18A.HG11' (nmrStar names),'1.18A.X2' (nmrStar names) not linked" rr_1kmr 1
223 2 223 1 "Not handling restraint 223, item 1, resonance(s) '1.19A.HB2' (nmrStar names),'1.19A.HB1' (nmrStar names) not linked" rr_1kmr 1
224 2 224 1 "Not handling restraint 224, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HB2' (nmrStar names) not linked" rr_1kmr 1
225 2 225 1 "Not handling restraint 225, item 1, resonance(s) '1.19A.HB2' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
226 2 226 1 "Not handling restraint 226, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HG2' (nmrStar names) not linked" rr_1kmr 1
227 2 227 1 "Not handling restraint 227, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HE21' (nmrStar names) not linked" rr_1kmr 1
228 2 228 1 "Not handling restraint 228, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
229 2 229 1 "Not handling restraint 229, item 1, resonance(s) '1.19A.HG2' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
230 2 230 1 "Not handling restraint 230, item 1, resonance(s) '1.21A.HG1' (nmrStar names),'1.21A.X2' (nmrStar names) not linked" rr_1kmr 1
231 2 231 1 "Not handling restraint 231, item 1, resonance(s) '1.21A.HG1' (nmrStar names),'1.21A.HG2' (nmrStar names) not linked" rr_1kmr 1
232 2 232 1 "Not handling restraint 232, item 1, resonance(s) '1.21A.HG2' (nmrStar names),'1.21A.X2' (nmrStar names) not linked" rr_1kmr 1
233 2 233 1 "Not handling restraint 233, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
234 2 234 1 "Not handling restraint 234, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
235 2 235 1 "Not handling restraint 235, item 1, resonance(s) '1.22A.HG12' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
236 2 236 1 "Not handling restraint 236, item 1, resonance(s) '1.22A.X1' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
237 2 237 1 "Not handling restraint 237, item 1, resonance(s) '1.23A.HB2' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
238 2 238 1 "Not handling restraint 238, item 1, resonance(s) '1.23A.HB2' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
239 2 239 1 "Not handling restraint 239, item 1, resonance(s) '1.23A.HD2' (nmrStar names),'1.23A.HB2' (nmrStar names) not linked" rr_1kmr 1
240 2 240 1 "Not handling restraint 240, item 1, resonance(s) '1.23A.HG2' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
241 2 241 1 "Not handling restraint 241, item 1, resonance(s) '1.23A.HD2' (nmrStar names),'1.23A.HG2' (nmrStar names) not linked" rr_1kmr 1
242 2 242 1 "Not handling restraint 242, item 1, resonance(s) '1.23A.HD2' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
243 2 243 1 "Not handling restraint 243, item 1, resonance(s) '1.24A.X1' (nmrStar names),'1.24A.X3' (nmrStar names) not linked" rr_1kmr 1
244 2 244 1 "Not handling restraint 244, item 1, resonance(s) '1.24A.X1' (nmrStar names),'1.24A.X4' (nmrStar names) not linked" rr_1kmr 1
245 2 245 1 "Not handling restraint 245, item 1, resonance(s) '1.24A.X4' (nmrStar names),'1.24A.X3' (nmrStar names) not linked" rr_1kmr 1
246 2 246 1 "Not handling restraint 246, item 1, resonance(s) '1.12A.HB1' (nmrStar names),'1.13A.X' (nmrStar names) not linked" rr_1kmr 1
247 2 247 1 "Not handling restraint 247, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.12A.HB2' (nmrStar names) not linked" rr_1kmr 1
248 2 248 1 "Not handling restraint 248, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.12A.X1' (nmrStar names) not linked" rr_1kmr 1
249 2 249 1 "Not handling restraint 249, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
250 2 250 1 "Not handling restraint 250, item 1, resonance(s) '1.15A.HG12' (nmrStar names),'1.12A.X2' (nmrStar names) not linked" rr_1kmr 1
251 2 251 1 "Not handling restraint 251, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.14A.X2' (nmrStar names) not linked" rr_1kmr 1
252 2 252 1 "Not handling restraint 252, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.15A.HB' (nmrStar names) not linked" rr_1kmr 1
253 2 253 1 "Not handling restraint 253, item 1, resonance(s) '1.13A.X' (nmrStar names),'1.15A.X1' (nmrStar names) not linked" rr_1kmr 1
254 2 254 1 "Not handling restraint 254, item 1, resonance(s) '1.14A.X1' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
255 2 255 1 "Not handling restraint 255, item 1, resonance(s) '1.14A.X1' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
256 2 256 1 "Not handling restraint 256, item 1, resonance(s) '1.14A.X2' (nmrStar names),'1.18A.HG11' (nmrStar names) not linked" rr_1kmr 1
257 2 257 1 "Not handling restraint 257, item 1, resonance(s) '1.15A.HG11' (nmrStar names),'1.18A.X1' (nmrStar names) not linked" rr_1kmr 1
258 2 258 1 "Not handling restraint 258, item 1, resonance(s) '1.15A.X2' (nmrStar names),'1.19A.HG1' (nmrStar names) not linked" rr_1kmr 1
259 2 259 1 "Not handling restraint 259, item 1, resonance(s) '1.15A.X2' (nmrStar names),'1.19A.HE21' (nmrStar names) not linked" rr_1kmr 1
260 2 260 1 "Not handling restraint 260, item 1, resonance(s) '1.15A.X2' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
261 2 261 1 "Not handling restraint 261, item 1, resonance(s) '1.18A.X1' (nmrStar names),'1.16A.X2' (nmrStar names) not linked" rr_1kmr 1
262 2 262 1 "Not handling restraint 262, item 1, resonance(s) '1.20A.X' (nmrStar names),'1.17A.HB2' (nmrStar names) not linked" rr_1kmr 1
263 2 263 1 "Not handling restraint 263, item 1, resonance(s) '1.17A.X2' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
264 2 264 1 "Not handling restraint 264, item 1, resonance(s) '1.18A.X1' (nmrStar names),'1.19A.HE22' (nmrStar names) not linked" rr_1kmr 1
265 2 265 1 "Not handling restraint 265, item 1, resonance(s) '1.18A.X1' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
266 2 266 1 "Not handling restraint 266, item 1, resonance(s) '1.19A.HG1' (nmrStar names),'1.22A.X2' (nmrStar names) not linked" rr_1kmr 1
267 2 267 1 "Not handling restraint 267, item 1, resonance(s) '1.21A.HG1' (nmrStar names),'1.20A.X' (nmrStar names) not linked" rr_1kmr 1
268 2 268 1 "Not handling restraint 268, item 1, resonance(s) '1.22A.X1' (nmrStar names),'1.21A.HB1' (nmrStar names) not linked" rr_1kmr 1
269 2 269 1 "Not handling restraint 269, item 1, resonance(s) '1.21A.HG2' (nmrStar names),'1.22A.X1' (nmrStar names) not linked" rr_1kmr 1
270 2 270 1 "Not handling restraint 270, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.24A.X4' (nmrStar names) not linked" rr_1kmr 1
271 2 271 1 "Not handling restraint 271, item 1, resonance(s) '1.23A.HB2' (nmrStar names),'1.24A.X3' (nmrStar names) not linked" rr_1kmr 1
272 2 272 1 "Not handling restraint 272, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.23A.HD1' (nmrStar names) not linked" rr_1kmr 1
273 2 273 1 "Not handling restraint 273, item 1, resonance(s) '1.22A.HB' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
274 2 274 1 "Not handling restraint 274, item 1, resonance(s) '1.22A.X1' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
275 2 275 1 "Not handling restraint 275, item 1, resonance(s) '1.22A.X2' (nmrStar names),'1.23A.HD2' (nmrStar names) not linked" rr_1kmr 1
stop_
save_
save_Discover_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_3_1
_Distance_constraint_list.Entry_ID rr_1kmr
_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_1kmr 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-bond restraints" 1 1 2 7 rr_1kmr 2
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 3 1 1 "Not handling restraint 1, item 1, resonance(s) '1.17A.HN' (nmrStar names),'1.13A.O' (nmrStar names) not linked" rr_1kmr 2
2 3 2 1 "Not handling restraint 2, item 1, resonance(s) '1.18A.HN' (nmrStar names),'1.14A.O' (nmrStar names) not linked" rr_1kmr 2
3 3 3 1 "Not handling restraint 3, item 1, resonance(s) '1.19A.HN' (nmrStar names),'1.15A.O' (nmrStar names) not linked" rr_1kmr 2
4 3 4 1 "Not handling restraint 4, item 1, resonance(s) '1.20A.HN' (nmrStar names),'1.16A.O' (nmrStar names) not linked" rr_1kmr 2
5 3 5 1 "Not handling restraint 5, item 1, resonance(s) '1.21A.HN' (nmrStar names),'1.17A.O' (nmrStar names) not linked" rr_1kmr 2
6 3 6 1 "Not handling restraint 6, item 1, resonance(s) '1.22A.HN' (nmrStar names),'1.18A.O' (nmrStar names) not linked" rr_1kmr 2
stop_
save_
save_Discover_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode Discover_dihedral_4
_Torsion_angle_constraint_list.Entry_ID rr_1kmr
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
loop_
_Torsion_angle_constraint_software.Software_ID
_Torsion_angle_constraint_software.Software_label
_Torsion_angle_constraint_software.Method_ID
_Torsion_angle_constraint_software.Method_label
_Torsion_angle_constraint_software.Entry_ID
_Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID
. . . . rr_1kmr 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1
;Conservation of Peptide bond planarity
NMR_dihedral
;
1 1 2 21 rr_1kmr 1
2
;Constrain to alpha helix dihedrals
Phi: C'-N-CA-C' ~ -60
;
17 1 19 27 rr_1kmr 1
3 "Psi: N-CA-C'-N" 30 1 30 22 rr_1kmr 1
stop_
loop_
_TA_constraint_conv_err.ID
_TA_constraint_conv_err.Parse_file_ID
_TA_constraint_conv_err.Parse_file_constraint_ID
_TA_constraint_conv_err.Conv_error_type
_TA_constraint_conv_err.Conv_error_note
_TA_constraint_conv_err.Entry_ID
_TA_constraint_conv_err.Torsion_angle_constraint_list_ID
1 4 1 1 "Not handling restraint 1, resonance(s) '1.11A.CA' (nmrStar names),'1.11A.C' (nmrStar names),'1.12A.N' (nmrStar names),'1.12A.CA' (nmrStar names) not linked" rr_1kmr 1
2 4 2 1 "Not handling restraint 2, resonance(s) '1.12A.CA' (nmrStar names),'1.12A.C' (nmrStar names),'1.13A.N' (nmrStar names),'1.13A.CA' (nmrStar names) not linked" rr_1kmr 1
3 4 3 1 "Not handling restraint 3, resonance(s) '1.13A.CA' (nmrStar names),'1.13A.C' (nmrStar names),'1.14A.N' (nmrStar names),'1.14A.CA' (nmrStar names) not linked" rr_1kmr 1
4 4 4 1 "Not handling restraint 4, resonance(s) '1.14A.CA' (nmrStar names),'1.14A.C' (nmrStar names),'1.15A.N' (nmrStar names),'1.15A.CA' (nmrStar names) not linked" rr_1kmr 1
5 4 5 1 "Not handling restraint 5, resonance(s) '1.15A.CA' (nmrStar names),'1.15A.C' (nmrStar names),'1.16A.N' (nmrStar names),'1.16A.CA' (nmrStar names) not linked" rr_1kmr 1
6 4 6 1 "Not handling restraint 6, resonance(s) '1.16A.CA' (nmrStar names),'1.16A.C' (nmrStar names),'1.17A.N' (nmrStar names),'1.17A.CA' (nmrStar names) not linked" rr_1kmr 1
7 4 7 1 "Not handling restraint 7, resonance(s) '1.17A.CA' (nmrStar names),'1.17A.C' (nmrStar names),'1.18A.N' (nmrStar names),'1.18A.CA' (nmrStar names) not linked" rr_1kmr 1
8 4 8 1 "Not handling restraint 8, resonance(s) '1.18A.CA' (nmrStar names),'1.18A.C' (nmrStar names),'1.19A.N' (nmrStar names),'1.19A.CA' (nmrStar names) not linked" rr_1kmr 1
9 4 9 1 "Not handling restraint 9, resonance(s) '1.19A.CA' (nmrStar names),'1.19A.C' (nmrStar names),'1.20A.N' (nmrStar names),'1.20A.CA' (nmrStar names) not linked" rr_1kmr 1
10 4 10 1 "Not handling restraint 10, resonance(s) '1.20A.CA' (nmrStar names),'1.20A.C' (nmrStar names),'1.21A.N' (nmrStar names),'1.21A.CA' (nmrStar names) not linked" rr_1kmr 1
11 4 11 1 "Not handling restraint 11, resonance(s) '1.21A.CA' (nmrStar names),'1.21A.C' (nmrStar names),'1.22A.N' (nmrStar names),'1.22A.CA' (nmrStar names) not linked" rr_1kmr 1
12 4 12 1 "Not handling restraint 12, resonance(s) '1.22A.CA' (nmrStar names),'1.22A.C' (nmrStar names),'1.23A.N' (nmrStar names),'1.23A.CA' (nmrStar names) not linked" rr_1kmr 1
13 4 13 1 "Not handling restraint 13, resonance(s) '1.23A.CA' (nmrStar names),'1.23A.C' (nmrStar names),'1.24A.N' (nmrStar names),'1.24A.CA' (nmrStar names) not linked" rr_1kmr 1
14 4 14 1 "Not handling restraint 14, resonance(s) '1.24A.CA' (nmrStar names),'1.24A.C' (nmrStar names),'1.25A.N' (nmrStar names),'1.25A.CA' (nmrStar names) not linked" rr_1kmr 1
15 4 15 1 "Not handling restraint 15, resonance(s) '1.12A.C' (nmrStar names),'1.13A.N' (nmrStar names),'1.13A.CA' (nmrStar names),'1.13A.C' (nmrStar names) not linked" rr_1kmr 1
16 4 16 1 "Not handling restraint 16, resonance(s) '1.13A.C' (nmrStar names),'1.14A.N' (nmrStar names),'1.14A.CA' (nmrStar names),'1.14A.C' (nmrStar names) not linked" rr_1kmr 1
17 4 17 1 "Not handling restraint 17, resonance(s) '1.14A.C' (nmrStar names),'1.15A.N' (nmrStar names),'1.15A.CA' (nmrStar names),'1.15A.C' (nmrStar names) not linked" rr_1kmr 1
18 4 18 1 "Not handling restraint 18, resonance(s) '1.15A.C' (nmrStar names),'1.16A.N' (nmrStar names),'1.16A.CA' (nmrStar names),'1.16A.C' (nmrStar names) not linked" rr_1kmr 1
19 4 19 1 "Not handling restraint 19, resonance(s) '1.16A.C' (nmrStar names),'1.17A.N' (nmrStar names),'1.17A.CA' (nmrStar names),'1.17A.C' (nmrStar names) not linked" rr_1kmr 1
20 4 20 1 "Not handling restraint 20, resonance(s) '1.17A.C' (nmrStar names),'1.18A.N' (nmrStar names),'1.18A.CA' (nmrStar names),'1.18A.C' (nmrStar names) not linked" rr_1kmr 1
21 4 21 1 "Not handling restraint 21, resonance(s) '1.18A.C' (nmrStar names),'1.19A.N' (nmrStar names),'1.19A.CA' (nmrStar names),'1.19A.C' (nmrStar names) not linked" rr_1kmr 1
22 4 22 1 "Not handling restraint 22, resonance(s) '1.19A.C' (nmrStar names),'1.20A.N' (nmrStar names),'1.20A.CA' (nmrStar names),'1.20A.C' (nmrStar names) not linked" rr_1kmr 1
23 4 23 1 "Not handling restraint 23, resonance(s) '1.20A.C' (nmrStar names),'1.21A.N' (nmrStar names),'1.21A.CA' (nmrStar names),'1.21A.C' (nmrStar names) not linked" rr_1kmr 1
24 4 24 1 "Not handling restraint 24, resonance(s) '1.21A.C' (nmrStar names),'1.22A.N' (nmrStar names),'1.22A.CA' (nmrStar names),'1.22A.C' (nmrStar names) not linked" rr_1kmr 1
25 4 25 1 "Not handling restraint 25, resonance(s) '1.13A.N' (nmrStar names),'1.13A.CA' (nmrStar names),'1.13A.C' (nmrStar names),'1.14A.N' (nmrStar names) not linked" rr_1kmr 1
26 4 26 1 "Not handling restraint 26, resonance(s) '1.14A.N' (nmrStar names),'1.14A.CA' (nmrStar names),'1.14A.C' (nmrStar names),'1.15A.N' (nmrStar names) not linked" rr_1kmr 1
27 4 27 1 "Not handling restraint 27, resonance(s) '1.15A.N' (nmrStar names),'1.15A.CA' (nmrStar names),'1.15A.C' (nmrStar names),'1.16A.N' (nmrStar names) not linked" rr_1kmr 1
28 4 28 1 "Not handling restraint 28, resonance(s) '1.16A.N' (nmrStar names),'1.16A.CA' (nmrStar names),'1.16A.C' (nmrStar names),'1.17A.N' (nmrStar names) not linked" rr_1kmr 1
29 4 29 1 "Not handling restraint 29, resonance(s) '1.17A.N' (nmrStar names),'1.17A.CA' (nmrStar names),'1.17A.C' (nmrStar names),'1.18A.N' (nmrStar names) not linked" rr_1kmr 1
30 4 30 1 "Not handling restraint 30, resonance(s) '1.18A.N' (nmrStar names),'1.18A.CA' (nmrStar names),'1.18A.C' (nmrStar names),'1.19A.N' (nmrStar names) not linked" rr_1kmr 1
31 4 31 1 "Not handling restraint 31, resonance(s) '1.19A.N' (nmrStar names),'1.19A.CA' (nmrStar names),'1.19A.C' (nmrStar names),'1.20A.N' (nmrStar names) not linked" rr_1kmr 1
32 4 32 1 "Not handling restraint 32, resonance(s) '1.20A.N' (nmrStar names),'1.20A.CA' (nmrStar names),'1.20A.C' (nmrStar names),'1.21A.N' (nmrStar names) not linked" rr_1kmr 1
33 4 33 1 "Not handling restraint 33, resonance(s) '1.21A.N' (nmrStar names),'1.21A.CA' (nmrStar names),'1.21A.C' (nmrStar names),'1.22A.N' (nmrStar names) not linked" rr_1kmr 1
34 4 34 1 "Not handling restraint 34, resonance(s) '1.22A.N' (nmrStar names),'1.22A.CA' (nmrStar names),'1.22A.C' (nmrStar names),'1.23A.N' (nmrStar names) not linked" rr_1kmr 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_framecode MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1kmr
_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 LIPID BINDING PROTEIN 17-DEC-01 1KMR *TITLE SOLUTION NMR STRUCTURE OF SURFACTANT PROTEIN B (11-25) (SP- *TITLE 2 B11-25) *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: PULMONARY SURFACTANT-ASSOCIATED PROTEIN B; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: SEQUENCE DATABASE RESIDUES 211-225, NUMBERED 11- *COMPND 5 25; *COMPND 6 SYNONYM: SP-B, PULMONARY SURFACTANT-ASSOCIATED *COMPND 7 PROTEOLIPID SPL(PHE), 18 KDA PULMONARY-SURFACTANT PROTEIN; *COMPND 8 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: THE PROTEIN WAS CHEMICALLY SYNTHESIZED. THE *SOURCE 4 SEQUENCE OF THE PROTEIN IS NATURALLY FOUND IN HOMO SAPIENS *SOURCE 5 (HUMANS). *KEYWDS HELIX *EXPDTA NMR, 17 STRUCTURES *AUTHOR J.W.KURUTZ, K.Y.C.LEE *REVDAT 1 07-AUG-02 1KMR 0"
save_
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