NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
311571 | 1skl | 6168 | cing | 4-filtered-FRED | STAR | entry | full |
data_FRED_restraints_with_modified_coordinates_PDB_code_1skl # This FRED archive file contains, for PDB entry <1skl>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID rr_1skl _Entry.Title "wwPDB remediated NMR restraints for PDB entry 1skl" _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 1skl" save_ save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID rr_1skl _Assembly.ID 1 _Assembly.Name 1skl _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Paramagnetic no _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1066.2706 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 "cyclic hexapeptide RR NAL NAL RF" 1 $cyclic_hexapeptide_RR_NAL__NAL_RF A . no . . . . . . rr_1skl 1 stop_ save_ save_cyclic_hexapeptide_RR_NAL__NAL_RF _Entity.Sf_category entity _Entity.Sf_framecode cyclic_hexapeptide_RR_NAL__NAL_RF _Entity.Entry_ID rr_1skl _Entity.ID 1 _Entity.Name cyclic_hexapeptide_RR_NAL__NAL_RF _Entity.Type non-polymer _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_chirality yes _Entity.Nstd_linkage yes _Entity.Nonpolymer_comp_ID ARG _Entity.Nonpolymer_comp_label $chem_comp_ARG _Entity.Number_of_monomers 6 _Entity.Paramagnetic no _Entity.Thiol_state "not present" _Entity.Parent_entity_ID 1 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 . ARG . rr_1skl 1 2 . ARG . rr_1skl 1 3 . NAL . rr_1skl 1 4 . NAL . rr_1skl 1 5 . ARG . rr_1skl 1 6 . PHE . rr_1skl 1 stop_ save_ save_chem_comp_NAL _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NAL _Chem_comp.Entry_ID rr_1skl _Chem_comp.ID NAL _Chem_comp.Name BETA-(2-NAPHTHYL)-ALANINE _Chem_comp.Type non-polymer _Chem_comp.PDB_code NAL _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic yes _Chem_comp.Formula "C13 H13 N O2" _Chem_comp.Formula_weight 215.2512 save_ save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID rr_1skl _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 10 save_ save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID rr_1skl _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . rr_1skl 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_1skl 1 stop_ loop_ _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_atom_name _Atom_site.PDB_ins_code _Atom_site.PDB_model_num _Atom_site.PDB_residue_name _Atom_site.PDB_residue_no _Atom_site.PDB_strand_id _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_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 ARG C C 0.223 1.528 -4.487 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 1 . 2 . 1 1 1 ARG CA C 1.577 0.799 -4.614 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 1 . 3 . 1 1 1 ARG CB C 1.495 -0.170 -5.811 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 1 . 4 . 1 1 1 ARG CD C 2.700 -1.687 -7.421 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 1 . 5 . 1 1 1 ARG CG C 2.840 -0.818 -6.164 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 1 . 6 . 1 1 1 ARG CZ C 4.204 -3.039 -8.890 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 1 . 7 . 1 1 1 ARG HA H 2.347 1.539 -4.852 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 1 . 8 . 1 1 1 ARG HB2 H 0.763 -0.951 -5.593 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 1 . 9 . 1 1 1 ARG HB3 H 1.147 0.387 -6.681 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 1 . 10 . 1 1 1 ARG HD2 H 1.945 -2.455 -7.243 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 1 . 11 . 1 1 1 ARG HD3 H 2.374 -1.059 -8.252 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 1 . 12 . 1 1 1 ARG HE H 4.725 -2.233 -7.105 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 1 . 13 . 1 1 1 ARG HG2 H 3.579 -0.037 -6.354 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 1 . 14 . 1 1 1 ARG HG3 H 3.182 -1.441 -5.337 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 1 . 15 . 1 1 1 ARG HH11 H 2.342 -2.805 -9.695 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 1 . 16 . 1 1 1 ARG HH12 H 3.461 -3.746 -10.655 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 1 . 17 . 1 1 1 ARG HH21 H 6.138 -3.461 -8.388 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 1 . 18 . 1 1 1 ARG HH22 H 5.597 -4.113 -9.918 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 1 . 19 . 1 1 1 ARG N N 1.949 0.053 -3.409 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 1 . 20 . 1 1 1 ARG NE N 3.969 -2.332 -7.768 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 1 . 21 . 1 1 1 ARG NH1 N 3.260 -3.214 -9.822 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 1 . 22 . 1 1 1 ARG NH2 N 5.410 -3.584 -9.085 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 1 . 23 . 1 1 1 ARG O O -0.033 2.447 -5.262 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 1 . 24 . 1 1 2 ARG C C -2.169 2.971 -2.872 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 1 . 25 . 1 1 2 ARG CA C -2.033 1.555 -3.460 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 1 . 26 . 1 1 2 ARG CB C -2.873 0.541 -2.666 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 1 . 27 . 1 1 2 ARG CD C -3.636 -1.836 -2.330 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 1 . 28 . 1 1 2 ARG CG C -2.774 -0.903 -3.188 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 1 . 29 . 1 1 2 ARG CZ C -2.643 -4.124 -2.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 1 . 30 . 1 1 2 ARG H H -0.368 0.365 -2.925 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 1 . 31 . 1 1 2 ARG HA H -2.448 1.586 -4.465 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 1 . 32 . 1 1 2 ARG HB2 H -2.564 0.554 -1.619 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 1 . 33 . 1 1 2 ARG HB3 H -3.920 0.840 -2.739 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 1 . 34 . 1 1 2 ARG HD2 H -3.280 -1.816 -1.298 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 1 . 35 . 1 1 2 ARG HD3 H -4.667 -1.481 -2.343 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 1 . 36 . 1 1 2 ARG HE H -4.394 -3.494 -3.412 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 1 . 37 . 1 1 2 ARG HG2 H -3.120 -0.937 -4.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 1 . 38 . 1 1 2 ARG HG3 H -1.740 -1.245 -3.147 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 1 . 39 . 1 1 2 ARG HH11 H -1.467 -2.934 -1.445 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 1 . 40 . 1 1 2 ARG HH12 H -0.859 -4.551 -1.720 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 1 . 41 . 1 1 2 ARG HH21 H -3.561 -5.565 -3.731 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 1 . 42 . 1 1 2 ARG HH22 H -2.039 -6.033 -3.008 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 1 . 43 . 1 1 2 ARG N N -0.645 1.116 -3.546 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 1 . 44 . 1 1 2 ARG NE N -3.610 -3.215 -2.837 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 1 . 45 . 1 1 2 ARG NH1 N -1.567 -3.847 -1.866 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 1 . 46 . 1 1 2 ARG NH2 N -2.756 -5.340 -3.162 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 1 . 47 . 1 1 2 ARG O O -2.710 3.842 -3.545 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 1 . 48 . 1 1 3 NAL C1 C -3.893 2.279 0.423 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 1 . 49 . 1 1 3 NAL C10 C -1.945 4.405 -0.851 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 1 . 50 . 1 1 3 NAL C11 C -1.173 4.464 0.481 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 1 . 51 . 1 1 3 NAL C2 C -4.304 3.310 -0.434 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 1 . 52 . 1 1 3 NAL C3 C -5.488 3.147 -1.173 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 1 . 53 . 1 1 3 NAL C4 C -6.244 1.968 -1.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 1 . 54 . 1 1 3 NAL C4A C -5.807 0.926 -0.221 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 1 . 55 . 1 1 3 NAL C5 C -6.545 -0.275 -0.127 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 1 . 56 . 1 1 3 NAL C6 C -6.091 -1.304 0.715 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 1 . 57 . 1 1 3 NAL C7 C -4.907 -1.152 1.452 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 1 . 58 . 1 1 3 NAL C8 C -4.174 0.042 1.357 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 1 . 59 . 1 1 3 NAL C8A C -4.621 1.086 0.529 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 1 . 60 . 1 1 3 NAL C9 C -3.466 4.586 -0.596 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 1 . 61 . 1 1 3 NAL H1 H -2.979 2.389 0.992 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 1 . 62 . 1 1 3 NAL H10 H -1.605 5.257 -1.450 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 1 . 63 . 1 1 3 NAL H3 H -5.828 3.931 -1.844 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 1 . 64 . 1 1 3 NAL H4 H -7.147 1.852 -1.645 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 1 . 65 . 1 1 3 NAL H5 H -7.448 -0.403 -0.697 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 1 . 66 . 1 1 3 NAL H6 H -6.662 -2.224 0.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 1 . 67 . 1 1 3 NAL H7 H -4.560 -1.950 2.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 1 . 68 . 1 1 3 NAL H8 H -3.257 0.155 1.927 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 1 . 69 . 1 1 3 NAL H91 H -3.619 5.208 0.284 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 1 . 70 . 1 1 3 NAL H92 H -3.871 5.143 -1.439 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 1 . 71 . 1 1 3 NAL HN1 H -1.245 2.427 -1.142 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 1 . 72 . 1 1 3 NAL N N -1.702 3.190 -1.630 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 1 . 73 . 1 1 3 NAL O2 O -1.113 5.531 1.098 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 1 . 74 . 1 1 4 NAL C1 C -0.916 0.931 4.676 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 1 . 75 . 1 1 4 NAL C10 C 0.001 3.172 2.275 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 1 . 76 . 1 1 4 NAL C11 C 0.847 1.902 2.242 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 1 . 77 . 1 1 4 NAL C2 C -0.741 2.325 4.611 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 1 . 78 . 1 1 4 NAL C3 C -0.255 3.021 5.731 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 1 . 79 . 1 1 4 NAL C4 C 0.047 2.321 6.913 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 1 . 80 . 1 1 4 NAL C4A C -0.174 0.931 6.992 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 1 . 81 . 1 1 4 NAL C5 C 0.117 0.232 8.181 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 1 . 82 . 1 1 4 NAL C6 C -0.128 -1.152 8.247 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 1 . 83 . 1 1 4 NAL C7 C -0.658 -1.839 7.138 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 1 . 84 . 1 1 4 NAL C8 C -0.933 -1.151 5.942 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 1 . 85 . 1 1 4 NAL C8A C -0.680 0.234 5.870 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 1 . 86 . 1 1 4 NAL C9 C -1.111 3.048 3.327 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 1 . 87 . 1 1 4 NAL H1 H -1.198 0.395 3.783 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 1 . 88 . 1 1 4 NAL H10 H 0.623 4.041 2.526 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 1 . 89 . 1 1 4 NAL H3 H -0.108 4.092 5.688 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 1 . 90 . 1 1 4 NAL H4 H 0.435 2.858 7.768 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 1 . 91 . 1 1 4 NAL H5 H 0.526 0.755 9.039 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 1 . 92 . 1 1 4 NAL H6 H 0.087 -1.689 9.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 1 . 93 . 1 1 4 NAL H7 H -0.849 -2.899 7.205 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 1 . 94 . 1 1 4 NAL H8 H -1.340 -1.687 5.084 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 1 . 95 . 1 1 4 NAL H91 H -1.480 4.043 3.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 1 . 96 . 1 1 4 NAL H92 H -1.941 2.492 2.891 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 1 . 97 . 1 1 4 NAL HN1 H -0.665 2.505 0.384 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 1 . 98 . 1 1 4 NAL N N -0.598 3.341 0.951 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 1 . 99 . 1 1 4 NAL O2 O 0.319 0.831 1.929 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 1 . 100 . 1 1 5 ARG C C 3.228 0.043 1.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 1 . 101 . 1 1 5 ARG CA C 3.245 1.063 2.461 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 1 . 102 . 1 1 5 ARG CB C 3.685 0.538 3.844 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 1 . 103 . 1 1 5 ARG CD C 2.316 -1.615 3.927 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 1 . 104 . 1 1 5 ARG CG C 2.732 -0.338 4.655 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 1 . 105 . 1 1 5 ARG CZ C 2.215 -3.771 5.219 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 1 . 106 . 1 1 5 ARG H H 2.438 2.951 2.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 1 . 107 . 1 1 5 ARG HA H 4.055 1.717 2.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 1 . 108 . 1 1 5 ARG HB2 H 4.622 -0.014 3.755 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 1 . 109 . 1 1 5 ARG HB3 H 3.896 1.398 4.487 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 1 . 110 . 1 1 5 ARG HD2 H 1.593 -1.368 3.153 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 1 . 111 . 1 1 5 ARG HD3 H 3.192 -2.058 3.457 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 1 . 112 . 1 1 5 ARG HE H 0.831 -2.302 5.270 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 1 . 113 . 1 1 5 ARG HG2 H 3.257 -0.600 5.572 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 1 . 114 . 1 1 5 ARG HG3 H 1.859 0.254 4.915 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 1 . 115 . 1 1 5 ARG HH11 H 3.890 -3.677 4.058 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 1 . 116 . 1 1 5 ARG HH12 H 3.725 -5.133 5.013 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 1 . 117 . 1 1 5 ARG HH21 H 0.665 -4.180 6.477 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 1 . 118 . 1 1 5 ARG HH22 H 1.897 -5.419 6.382 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 1 . 119 . 1 1 5 ARG N N 2.148 2.034 2.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 1 . 120 . 1 1 5 ARG NE N 1.710 -2.578 4.861 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 1 . 121 . 1 1 5 ARG NH1 N 3.373 -4.233 4.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 1 . 122 . 1 1 5 ARG NH2 N 1.537 -4.518 6.095 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 1 . 123 . 1 1 5 ARG O O 3.998 -0.915 1.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 1 . 124 . 1 1 6 PHE C C 2.133 0.583 -2.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 1 . 125 . 1 1 6 PHE CA C 2.275 -0.417 -1.012 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 1 . 126 . 1 1 6 PHE CB C 1.035 -1.342 -1.011 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 1 . 127 . 1 1 6 PHE CD1 C 1.673 -3.227 0.562 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 1 . 128 . 1 1 6 PHE CD2 C -0.422 -2.043 0.941 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 1 . 129 . 1 1 6 PHE CE1 C 1.377 -4.085 1.635 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 1 . 130 . 1 1 6 PHE CE2 C -0.714 -2.898 2.017 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 1 . 131 . 1 1 6 PHE CG C 0.775 -2.201 0.212 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 1 . 132 . 1 1 6 PHE CZ C 0.183 -3.924 2.359 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 1 . 133 . 1 1 6 PHE H H 1.730 1.040 0.411 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 1 . 134 . 1 1 6 PHE HA H 3.168 -1.029 -1.181 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 1 . 135 . 1 1 6 PHE HB2 H 0.154 -0.718 -1.176 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 1 . 136 . 1 1 6 PHE HB3 H 1.117 -2.022 -1.859 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 1 . 137 . 1 1 6 PHE HD1 H 2.582 -3.369 -0.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 1 . 138 . 1 1 6 PHE HD2 H -1.130 -1.275 0.669 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 1 . 139 . 1 1 6 PHE HE1 H 2.066 -4.874 1.899 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 1 . 140 . 1 1 6 PHE HE2 H -1.632 -2.772 2.572 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 1 . 141 . 1 1 6 PHE HZ H -0.042 -4.586 3.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 1 . 142 . 1 1 6 PHE N N 2.403 0.291 0.248 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 1 . 143 . 1 1 6 PHE O O 2.132 1.796 -1.980 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 2 . 144 . 1 1 1 ARG C C 0.309 1.098 -4.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 2 . 145 . 1 1 1 ARG CA C 1.809 0.757 -4.579 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 2 . 146 . 1 1 1 ARG CB C 2.379 0.085 -5.846 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 2 . 147 . 1 1 1 ARG CD C 4.792 0.989 -5.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 2 . 148 . 1 1 1 ARG CG C 3.885 -0.235 -5.779 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 2 . 149 . 1 1 1 ARG CZ C 4.341 3.161 -6.782 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 2 . 150 . 1 1 1 ARG HA H 2.340 1.694 -4.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 2 . 151 . 1 1 1 ARG HB2 H 1.840 -0.847 -6.024 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 2 . 152 . 1 1 1 ARG HB3 H 2.203 0.740 -6.702 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 2 . 153 . 1 1 1 ARG HD2 H 4.508 1.519 -4.673 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 2 . 154 . 1 1 1 ARG HD3 H 5.816 0.637 -5.451 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 2 . 155 . 1 1 1 ARG HE H 5.122 1.494 -7.612 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 2 . 156 . 1 1 1 ARG HG2 H 4.068 -0.934 -4.962 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 2 . 157 . 1 1 1 ARG HG3 H 4.174 -0.735 -6.705 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 2 . 158 . 1 1 1 ARG HH11 H 3.800 3.287 -4.817 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 2 . 159 . 1 1 1 ARG HH12 H 3.545 4.738 -5.759 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 2 . 160 . 1 1 1 ARG HH21 H 4.778 3.389 -8.761 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 2 . 161 . 1 1 1 ARG HH22 H 4.097 4.796 -7.977 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 2 . 162 . 1 1 1 ARG N N 2.029 -0.111 -3.423 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 2 . 163 . 1 1 1 ARG NE N 4.768 1.886 -6.751 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 2 . 164 . 1 1 1 ARG NH1 N 3.853 3.778 -5.697 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 2 . 165 . 1 1 1 ARG NH2 N 4.408 3.837 -7.934 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 2 . 166 . 1 1 1 ARG O O -0.279 0.953 -5.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 2 . 167 . 1 1 2 ARG C C -2.079 3.014 -2.750 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 2 . 168 . 1 1 2 ARG CA C -1.759 1.686 -3.449 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 2 . 169 . 1 1 2 ARG CB C -2.398 0.500 -2.704 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 2 . 170 . 1 1 2 ARG CD C -2.722 -1.911 -2.282 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 2 . 171 . 1 1 2 ARG CG C -2.103 -0.898 -3.252 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 2 . 172 . 1 1 2 ARG CZ C -3.394 -3.985 -3.517 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 2 . 173 . 1 1 2 ARG H H 0.222 1.612 -2.734 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 2 . 174 . 1 1 2 ARG HA H -2.218 1.725 -4.431 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 2 . 175 . 1 1 2 ARG HB2 H -2.099 0.533 -1.655 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 2 . 176 . 1 1 2 ARG HB3 H -3.476 0.606 -2.777 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 2 . 177 . 1 1 2 ARG HD2 H -2.242 -1.818 -1.307 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 2 . 178 . 1 1 2 ARG HD3 H -3.783 -1.703 -2.153 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 2 . 179 . 1 1 2 ARG HE H -1.667 -3.716 -2.491 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 2 . 180 . 1 1 2 ARG HG2 H -2.550 -1.003 -4.241 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 2 . 181 . 1 1 2 ARG HG3 H -1.031 -1.072 -3.322 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 2 . 182 . 1 1 2 ARG HH11 H -4.799 -2.515 -3.692 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 2 . 183 . 1 1 2 ARG HH12 H -5.177 -4.012 -4.514 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 2 . 184 . 1 1 2 ARG HH21 H -2.217 -5.651 -3.548 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 2 . 185 . 1 1 2 ARG HH22 H -3.720 -5.778 -4.432 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 2 . 186 . 1 1 2 ARG N N -0.319 1.502 -3.577 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 2 . 187 . 1 1 2 ARG NE N -2.534 -3.283 -2.758 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 2 . 188 . 1 1 2 ARG NH1 N -4.553 -3.462 -3.941 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 2 . 189 . 1 1 2 ARG NH2 N -3.084 -5.240 -3.862 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 2 . 190 . 1 1 2 ARG O O -2.675 3.881 -3.388 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 2 . 191 . 1 1 3 NAL C1 C -3.956 1.896 0.340 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 2 . 192 . 1 1 3 NAL C10 C -2.149 4.301 -0.629 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 2 . 193 . 1 1 3 NAL C11 C -1.504 4.362 0.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 2 . 194 . 1 1 3 NAL C2 C -4.382 2.925 -0.523 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 2 . 195 . 1 1 3 NAL C3 C -5.424 2.673 -1.438 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 2 . 196 . 1 1 3 NAL C4 C -6.023 1.403 -1.502 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 2 . 197 . 1 1 3 NAL C4A C -5.577 0.369 -0.659 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 2 . 198 . 1 1 3 NAL C5 C -6.153 -0.913 -0.739 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 2 . 199 . 1 1 3 NAL C6 C -5.690 -1.947 0.094 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 2 . 200 . 1 1 3 NAL C7 C -4.652 -1.701 1.010 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 2 . 201 . 1 1 3 NAL C8 C -4.078 -0.421 1.098 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 2 . 202 . 1 1 3 NAL C8A C -4.538 0.617 0.266 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 2 . 203 . 1 1 3 NAL C9 C -3.699 4.290 -0.510 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 2 . 204 . 1 1 3 NAL H1 H -3.159 2.081 1.040 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 2 . 205 . 1 1 3 NAL H10 H -1.862 5.221 -1.139 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 2 . 206 . 1 1 3 NAL H3 H -5.761 3.451 -2.107 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 2 . 207 . 1 1 3 NAL H4 H -6.816 1.223 -2.213 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 2 . 208 . 1 1 3 NAL H5 H -6.949 -1.109 -1.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 2 . 209 . 1 1 3 NAL H6 H -6.132 -2.930 0.029 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 2 . 210 . 1 1 3 NAL H7 H -4.298 -2.497 1.649 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 2 . 211 . 1 1 3 NAL H8 H -3.281 -0.239 1.806 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 2 . 212 . 1 1 3 NAL H91 H -4.017 4.822 0.386 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 2 . 213 . 1 1 3 NAL H92 H -4.089 4.868 -1.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 2 . 214 . 1 1 3 NAL HN1 H -1.195 2.437 -1.006 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 2 . 215 . 1 1 3 NAL N N -1.702 3.177 -1.466 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 2 . 216 . 1 1 3 NAL O2 O -1.837 5.279 1.526 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 2 . 217 . 1 1 4 NAL C1 C -0.480 0.420 4.863 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 2 . 218 . 1 1 4 NAL C10 C -0.136 3.306 2.539 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 2 . 219 . 1 1 4 NAL C11 C 1.338 2.897 2.634 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 2 . 220 . 1 1 4 NAL C2 C -0.555 1.803 4.606 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 2 . 221 . 1 1 4 NAL C3 C -0.184 2.723 5.606 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 2 . 222 . 1 1 4 NAL C4 C 0.272 2.263 6.853 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 2 . 223 . 1 1 4 NAL C4A C 0.328 0.882 7.119 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 2 . 224 . 1 1 4 NAL C5 C 0.763 0.420 8.375 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 2 . 225 . 1 1 4 NAL C6 C 0.791 -0.958 8.647 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 2 . 226 . 1 1 4 NAL C7 C 0.377 -1.878 7.667 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 2 . 227 . 1 1 4 NAL C8 C -0.049 -1.423 6.406 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 2 . 228 . 1 1 4 NAL C8A C -0.064 -0.043 6.125 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 2 . 229 . 1 1 4 NAL C9 C -1.045 2.292 3.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 2 . 230 . 1 1 4 NAL H1 H -0.749 -0.285 4.089 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 2 . 231 . 1 1 4 NAL H10 H -0.222 4.268 3.052 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 2 . 232 . 1 1 4 NAL H3 H -0.239 3.785 5.418 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 2 . 233 . 1 1 4 NAL H4 H 0.564 2.976 7.610 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 2 . 234 . 1 1 4 NAL H5 H 1.071 1.122 9.137 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 2 . 235 . 1 1 4 NAL H6 H 1.121 -1.311 9.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 2 . 236 . 1 1 4 NAL H7 H 0.384 -2.935 7.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 2 . 237 . 1 1 4 NAL H8 H -0.374 -2.136 5.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 2 . 238 . 1 1 4 NAL H91 H -2.030 2.739 3.386 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 2 . 239 . 1 1 4 NAL H92 H -1.169 1.425 2.602 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 2 . 240 . 1 1 4 NAL HN1 H -0.330 2.713 0.499 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 2 . 241 . 1 1 4 NAL N N -0.607 3.431 1.153 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 2 . 242 . 1 1 4 NAL O2 O 2.140 3.674 3.151 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 2 . 243 . 1 1 5 ARG C C 3.296 0.413 0.770 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 2 . 244 . 1 1 5 ARG CA C 3.083 1.243 2.044 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 2 . 245 . 1 1 5 ARG CB C 3.527 0.543 3.355 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 2 . 246 . 1 1 5 ARG CD C 2.613 -1.845 3.052 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 2 . 247 . 1 1 5 ARG CG C 3.845 -0.962 3.291 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 2 . 248 . 1 1 5 ARG CZ C 2.611 -3.712 4.723 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 2 . 249 . 1 1 5 ARG H H 0.984 1.109 1.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 2 . 250 . 1 1 5 ARG HA H 3.703 2.131 1.938 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 2 . 251 . 1 1 5 ARG HB2 H 4.439 1.042 3.686 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 2 . 252 . 1 1 5 ARG HB3 H 2.783 0.709 4.137 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 2 . 253 . 1 1 5 ARG HD2 H 1.790 -1.240 2.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 2 . 254 . 1 1 5 ARG HD3 H 2.857 -2.592 2.295 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 2 . 255 . 1 1 5 ARG HE H 1.492 -2.028 4.844 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 2 . 256 . 1 1 5 ARG HG2 H 4.574 -1.146 2.502 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 2 . 257 . 1 1 5 ARG HG3 H 4.322 -1.254 4.228 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 2 . 258 . 1 1 5 ARG HH11 H 3.900 -4.068 3.181 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 2 . 259 . 1 1 5 ARG HH12 H 3.835 -5.315 4.405 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 2 . 260 . 1 1 5 ARG HH21 H 1.447 -3.676 6.396 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 2 . 261 . 1 1 5 ARG HH22 H 2.452 -5.095 6.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 2 . 262 . 1 1 5 ARG N N 1.696 1.706 2.134 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 2 . 263 . 1 1 5 ARG NE N 2.173 -2.519 4.282 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 2 . 264 . 1 1 5 ARG NH1 N 3.522 -4.425 4.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 2 . 265 . 1 1 5 ARG NH2 N 2.128 -4.203 5.869 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 2 . 266 . 1 1 5 ARG O O 4.416 0.334 0.267 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 2 . 267 . 1 1 6 PHE C C 2.156 0.316 -2.163 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 2 . 268 . 1 1 6 PHE CA C 2.136 -0.774 -1.078 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 2 . 269 . 1 1 6 PHE CB C 0.832 -1.588 -1.152 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 2 . 270 . 1 1 6 PHE CD1 C 1.299 -3.768 0.060 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 2 . 271 . 1 1 6 PHE CD2 C -0.344 -2.236 1.002 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 2 . 272 . 1 1 6 PHE CE1 C 1.071 -4.662 1.121 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 2 . 273 . 1 1 6 PHE CE2 C -0.571 -3.131 2.062 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 2 . 274 . 1 1 6 PHE CG C 0.592 -2.552 -0.003 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 2 . 275 . 1 1 6 PHE CZ C 0.136 -4.345 2.121 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 2 . 276 . 1 1 6 PHE H H 1.329 -0.063 0.716 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 2 . 277 . 1 1 6 PHE HA H 2.986 -1.445 -1.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 2 . 278 . 1 1 6 PHE HB2 H 0.000 -0.885 -1.188 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 2 . 279 . 1 1 6 PHE HB3 H 0.826 -2.162 -2.080 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 2 . 280 . 1 1 6 PHE HD1 H 2.018 -4.018 -0.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 2 . 281 . 1 1 6 PHE HD2 H -0.891 -1.305 0.965 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 2 . 282 . 1 1 6 PHE HE1 H 1.615 -5.594 1.167 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 2 . 283 . 1 1 6 PHE HE2 H -1.288 -2.886 2.833 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 2 . 284 . 1 1 6 PHE HZ H -0.037 -5.032 2.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 2 . 285 . 1 1 6 PHE N N 2.207 -0.153 0.230 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 2 . 286 . 1 1 6 PHE O O 2.232 1.513 -1.874 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 3 . 287 . 1 1 1 ARG C C 0.365 1.767 -4.274 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 3 . 288 . 1 1 1 ARG CA C 1.714 1.028 -4.385 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 3 . 289 . 1 1 1 ARG CB C 1.813 0.211 -5.692 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 3 . 290 . 1 1 1 ARG CD C 0.083 0.882 -7.460 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 3 . 291 . 1 1 1 ARG CG C 1.545 0.992 -6.995 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 3 . 292 . 1 1 1 ARG CZ C -0.761 2.877 -8.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 3 . 293 . 1 1 1 ARG HA H 2.512 1.773 -4.391 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 3 . 294 . 1 1 1 ARG HB2 H 2.828 -0.185 -5.750 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 3 . 295 . 1 1 1 ARG HB3 H 1.134 -0.642 -5.642 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 3 . 296 . 1 1 1 ARG HD2 H -0.134 -0.163 -7.683 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 3 . 297 . 1 1 1 ARG HD3 H -0.593 1.198 -6.668 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 3 . 298 . 1 1 1 ARG HE H 0.130 1.252 -9.547 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 3 . 299 . 1 1 1 ARG HG2 H 1.822 2.039 -6.866 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 3 . 300 . 1 1 1 ARG HG3 H 2.175 0.574 -7.781 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 3 . 301 . 1 1 1 ARG HH11 H -1.039 3.114 -6.730 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 3 . 302 . 1 1 1 ARG HH12 H -1.625 4.425 -7.727 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 3 . 303 . 1 1 1 ARG HH21 H -0.639 2.978 -10.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 3 . 304 . 1 1 1 ARG HH22 H -1.393 4.352 -9.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 3 . 305 . 1 1 1 ARG N N 1.929 0.108 -3.257 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 3 . 306 . 1 1 1 ARG NE N -0.164 1.672 -8.677 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 3 . 307 . 1 1 1 ARG NH1 N -1.179 3.524 -7.642 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 3 . 308 . 1 1 1 ARG NH2 N -0.945 3.449 -9.935 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 3 . 309 . 1 1 1 ARG O O 0.214 2.852 -4.834 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 3 . 310 . 1 1 2 ARG C C -2.229 2.980 -2.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 3 . 311 . 1 1 2 ARG CA C -2.005 1.578 -3.524 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 3 . 312 . 1 1 2 ARG CB C -2.823 0.507 -2.775 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 3 . 313 . 1 1 2 ARG CD C -3.253 -1.936 -2.300 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 3 . 314 . 1 1 2 ARG CG C -2.624 -0.935 -3.277 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 3 . 315 . 1 1 2 ARG CZ C -2.429 -4.284 -2.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 3 . 316 . 1 1 2 ARG H H -0.382 0.310 -3.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 3 . 317 . 1 1 2 ARG HA H -2.377 1.600 -4.544 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 3 . 318 . 1 1 2 ARG HB2 H -2.573 0.546 -1.714 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 3 . 319 . 1 1 2 ARG HB3 H -3.879 0.743 -2.911 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 3 . 320 . 1 1 2 ARG HD2 H -2.681 -1.945 -1.371 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 3 . 321 . 1 1 2 ARG HD3 H -4.267 -1.622 -2.060 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 3 . 322 . 1 1 2 ARG HE H -4.061 -3.463 -3.525 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 3 . 323 . 1 1 2 ARG HG2 H -3.090 -1.033 -4.258 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 3 . 324 . 1 1 2 ARG HG3 H -1.566 -1.179 -3.367 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 3 . 325 . 1 1 2 ARG HH11 H -1.256 -3.281 -1.324 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 3 . 326 . 1 1 2 ARG HH12 H -0.759 -4.921 -1.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 3 . 327 . 1 1 2 ARG HH21 H -3.370 -5.566 -3.938 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 3 . 328 . 1 1 2 ARG HH22 H -1.951 -6.207 -3.144 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 3 . 329 . 1 1 2 ARG N N -0.604 1.178 -3.557 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 3 . 330 . 1 1 2 ARG NE N -3.303 -3.286 -2.882 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 3 . 331 . 1 1 2 ARG NH1 N -1.394 -4.150 -1.820 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 3 . 332 . 1 1 2 ARG NH2 N -2.597 -5.447 -3.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 3 . 333 . 1 1 2 ARG O O -2.755 3.845 -3.628 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 3 . 334 . 1 1 3 NAL C1 C -4.231 2.228 0.155 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 3 . 335 . 1 1 3 NAL C10 C -2.166 4.370 -0.842 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 3 . 336 . 1 1 3 NAL C11 C -1.509 4.286 0.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 3 . 337 . 1 1 3 NAL C2 C -4.533 3.264 -0.725 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 3 . 338 . 1 1 3 NAL C3 C -5.599 3.093 -1.664 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 3 . 339 . 1 1 3 NAL C4 C -6.309 1.895 -1.704 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 3 . 340 . 1 1 3 NAL C4A C -5.971 0.840 -0.826 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 3 . 341 . 1 1 3 NAL C5 C -6.670 -0.396 -0.897 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 3 . 342 . 1 1 3 NAL C6 C -6.322 -1.441 -0.047 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 3 . 343 . 1 1 3 NAL C7 C -5.268 -1.269 0.896 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 3 . 344 . 1 1 3 NAL C8 C -4.590 -0.060 0.969 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 3 . 345 . 1 1 3 NAL C8A C -4.943 1.007 0.097 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 3 . 346 . 1 1 3 NAL C9 C -3.709 4.547 -0.758 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 3 . 347 . 1 1 3 NAL H1 H -3.421 2.343 0.862 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 3 . 348 . 1 1 3 NAL H10 H -1.750 5.247 -1.340 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 3 . 349 . 1 1 3 NAL H3 H -5.839 3.886 -2.351 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 3 . 350 . 1 1 3 NAL H4 H -7.107 1.770 -2.425 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 3 . 351 . 1 1 3 NAL H5 H -7.467 -0.526 -1.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 3 . 352 . 1 1 3 NAL H6 H -6.842 -2.385 -0.096 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 3 . 353 . 1 1 3 NAL H7 H -5.006 -2.088 1.549 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 3 . 354 . 1 1 3 NAL H8 H -3.791 0.075 1.684 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 3 . 355 . 1 1 3 NAL H91 H -3.976 5.152 0.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 3 . 356 . 1 1 3 NAL H92 H -4.011 5.127 -1.627 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 3 . 357 . 1 1 3 NAL HN1 H -1.401 2.434 -1.166 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 3 . 358 . 1 1 3 NAL N N -1.844 3.191 -1.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 3 . 359 . 1 1 3 NAL O2 O -1.898 5.018 1.470 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 3 . 360 . 1 1 4 NAL C1 C 0.024 0.069 4.167 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 3 . 361 . 1 1 4 NAL C10 C 0.058 2.997 2.033 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 3 . 362 . 1 1 4 NAL C11 C 1.522 2.564 1.789 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 3 . 363 . 1 1 4 NAL C2 C -0.491 1.368 3.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 3 . 364 . 1 1 4 NAL C3 C -0.661 2.199 5.125 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 3 . 365 . 1 1 4 NAL C4 C -0.324 1.730 6.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 3 . 366 . 1 1 4 NAL C4A C 0.198 0.430 6.566 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 3 . 367 . 1 1 4 NAL C5 C 0.561 -0.041 7.845 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 3 . 368 . 1 1 4 NAL C6 C 1.100 -1.326 7.996 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 3 . 369 . 1 1 4 NAL C7 C 1.287 -2.152 6.869 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 3 . 370 . 1 1 4 NAL C8 C 0.928 -1.689 5.595 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 3 . 371 . 1 1 4 NAL C8A C 0.378 -0.399 5.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 3 . 372 . 1 1 4 NAL C9 C -0.837 1.878 2.611 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 3 . 373 . 1 1 4 NAL H1 H 0.187 -0.559 3.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 3 . 374 . 1 1 4 NAL H10 H 0.059 3.847 2.717 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 3 . 375 . 1 1 4 NAL H3 H -1.043 3.201 4.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 3 . 376 . 1 1 4 NAL H4 H -0.458 2.374 7.261 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 3 . 377 . 1 1 4 NAL H5 H 0.428 0.589 8.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 3 . 378 . 1 1 4 NAL H6 H 1.378 -1.685 8.976 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 3 . 379 . 1 1 4 NAL H7 H 1.708 -3.139 6.988 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 3 . 380 . 1 1 4 NAL H8 H 1.085 -2.323 4.733 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 3 . 381 . 1 1 4 NAL H91 H -1.863 2.245 2.654 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 3 . 382 . 1 1 4 NAL H92 H -0.830 1.040 1.913 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 3 . 383 . 1 1 4 NAL HN1 H -0.233 2.841 -0.054 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 3 . 384 . 1 1 4 NAL N N -0.534 3.379 0.746 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 3 . 385 . 1 1 4 NAL O2 O 2.140 3.029 0.833 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 3 . 386 . 1 1 5 ARG C C 3.337 0.107 1.126 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 3 . 387 . 1 1 5 ARG CA C 3.370 0.998 2.411 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 3 . 388 . 1 1 5 ARG CB C 3.827 0.187 3.657 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 3 . 389 . 1 1 5 ARG CD C 3.486 2.114 5.338 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 3 . 390 . 1 1 5 ARG CG C 4.434 1.043 4.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 3 . 391 . 1 1 5 ARG CZ C 4.058 4.214 6.587 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 3 . 392 . 1 1 5 ARG H H 1.610 1.506 3.518 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 3 . 393 . 1 1 5 ARG HA H 4.120 1.766 2.226 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 3 . 394 . 1 1 5 ARG HB2 H 3.010 -0.413 4.062 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 3 . 395 . 1 1 5 ARG HB3 H 4.608 -0.527 3.377 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 3 . 396 . 1 1 5 ARG HD2 H 3.230 2.799 4.534 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 3 . 397 . 1 1 5 ARG HD3 H 2.578 1.632 5.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 3 . 398 . 1 1 5 ARG HE H 4.592 2.338 7.134 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 3 . 399 . 1 1 5 ARG HG2 H 4.725 0.377 5.602 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 3 . 400 . 1 1 5 ARG HG3 H 5.339 1.526 4.414 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 3 . 401 . 1 1 5 ARG HH11 H 2.963 4.615 4.910 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 3 . 402 . 1 1 5 ARG HH12 H 3.421 6.012 5.856 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 3 . 403 . 1 1 5 ARG HH21 H 5.151 4.188 8.309 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 3 . 404 . 1 1 5 ARG HH22 H 4.649 5.771 7.762 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 3 . 405 . 1 1 5 ARG N N 2.092 1.693 2.643 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 3 . 406 . 1 1 5 ARG NE N 4.099 2.876 6.437 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 3 . 407 . 1 1 5 ARG NH1 N 3.426 5.012 5.714 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 3 . 408 . 1 1 5 ARG NH2 N 4.669 4.769 7.640 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 3 . 409 . 1 1 5 ARG O O 4.363 -0.463 0.780 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 3 . 410 . 1 1 6 PHE C C 2.086 0.503 -1.987 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 3 . 411 . 1 1 6 PHE CA C 2.039 -0.593 -0.898 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 3 . 412 . 1 1 6 PHE CB C 0.685 -1.329 -0.971 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 3 . 413 . 1 1 6 PHE CD1 C 0.920 -2.958 0.991 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 3 . 414 . 1 1 6 PHE CD2 C -1.075 -1.575 0.823 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 3 . 415 . 1 1 6 PHE CE1 C 0.444 -3.503 2.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 3 . 416 . 1 1 6 PHE CE2 C -1.565 -2.139 2.026 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 3 . 417 . 1 1 6 PHE CG C 0.162 -1.971 0.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 3 . 418 . 1 1 6 PHE CZ C -0.807 -3.080 2.715 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 3 . 419 . 1 1 6 PHE H H 1.386 0.526 0.759 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 3 . 420 . 1 1 6 PHE HA H 2.841 -1.311 -1.063 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 3 . 421 . 1 1 6 PHE HB2 H -0.073 -0.623 -1.317 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 3 . 422 . 1 1 6 PHE HB3 H 0.773 -2.113 -1.729 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 3 . 423 . 1 1 6 PHE HD1 H 1.876 -3.270 0.595 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 3 . 424 . 1 1 6 PHE HD2 H -1.665 -0.820 0.323 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 3 . 425 . 1 1 6 PHE HE1 H 1.028 -4.235 2.721 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 3 . 426 . 1 1 6 PHE HE2 H -2.514 -1.811 2.424 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 3 . 427 . 1 1 6 PHE HZ H -1.156 -3.465 3.664 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 3 . 428 . 1 1 6 PHE N N 2.195 0.032 0.427 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 3 . 429 . 1 1 6 PHE O O 2.207 1.692 -1.691 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 4 . 430 . 1 1 1 ARG C C 0.403 1.502 -4.576 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 4 . 431 . 1 1 1 ARG CA C 1.818 0.885 -4.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 4 . 432 . 1 1 1 ARG CB C 2.232 0.174 -5.792 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 4 . 433 . 1 1 1 ARG CD C 2.016 -1.764 -7.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 4 . 434 . 1 1 1 ARG CG C 1.490 -1.143 -6.076 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 4 . 435 . 1 1 1 ARG CZ C 2.275 -4.106 -8.218 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 4 . 436 . 1 1 1 ARG HA H 2.509 1.717 -4.347 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 4 . 437 . 1 1 1 ARG HB2 H 2.088 0.854 -6.633 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 4 . 438 . 1 1 1 ARG HB3 H 3.300 -0.041 -5.728 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 4 . 439 . 1 1 1 ARG HD2 H 1.630 -1.203 -8.228 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 4 . 440 . 1 1 1 ARG HD3 H 3.104 -1.702 -7.378 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 4 . 441 . 1 1 1 ARG HE H 0.816 -3.469 -6.964 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 4 . 442 . 1 1 1 ARG HG2 H 1.667 -1.843 -5.259 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 4 . 443 . 1 1 1 ARG HG3 H 0.418 -0.962 -6.164 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 4 . 444 . 1 1 1 ARG HH11 H 3.669 -2.842 -9.011 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 4 . 445 . 1 1 1 ARG HH12 H 3.815 -4.516 -9.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 4 . 446 . 1 1 1 ARG HH21 H 1.059 -5.630 -7.617 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 4 . 447 . 1 1 1 ARG HH22 H 2.345 -6.083 -8.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 4 . 448 . 1 1 1 ARG N N 2.004 -0.028 -3.358 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 4 . 449 . 1 1 1 ARG NE N 1.621 -3.176 -7.498 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 4 . 450 . 1 1 1 ARG NH1 N 3.341 -3.796 -8.969 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 4 . 451 . 1 1 1 ARG NH2 N 1.856 -5.376 -8.182 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 4 . 452 . 1 1 1 ARG O O 0.114 2.201 -5.547 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 4 . 453 . 1 1 2 ARG C C -2.081 3.001 -2.837 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 4 . 454 . 1 1 2 ARG CA C -1.867 1.676 -3.586 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 4 . 455 . 1 1 2 ARG CB C -2.758 0.589 -2.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 4 . 456 . 1 1 2 ARG CD C -3.501 -1.793 -2.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 4 . 457 . 1 1 2 ARG CG C -2.563 -0.824 -3.520 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 4 . 458 . 1 1 2 ARG CZ C -3.660 -4.258 -2.437 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 4 . 459 . 1 1 2 ARG H H -0.180 0.661 -2.826 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 4 . 460 . 1 1 2 ARG HA H -2.195 1.808 -4.617 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 4 . 461 . 1 1 2 ARG HB2 H -2.561 0.548 -1.884 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 4 . 462 . 1 1 2 ARG HB3 H -3.801 0.876 -3.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 4 . 463 . 1 1 2 ARG HD2 H -3.425 -1.624 -1.718 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 4 . 464 . 1 1 2 ARG HD3 H -4.529 -1.606 -3.106 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 4 . 465 . 1 1 2 ARG HE H -2.437 -3.347 -3.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 4 . 466 . 1 1 2 ARG HG2 H -2.781 -0.832 -4.589 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 4 . 467 . 1 1 2 ARG HG3 H -1.534 -1.145 -3.358 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 4 . 468 . 1 1 2 ARG HH11 H -4.980 -3.216 -1.279 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 4 . 469 . 1 1 2 ARG HH12 H -4.990 -4.950 -1.050 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 4 . 470 . 1 1 2 ARG HH21 H -2.474 -5.590 -3.426 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 4 . 471 . 1 1 2 ARG HH22 H -3.575 -6.288 -2.260 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 4 . 472 . 1 1 2 ARG N N -0.471 1.253 -3.585 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 4 . 473 . 1 1 2 ARG NE N -3.147 -3.191 -3.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 4 . 474 . 1 1 2 ARG NH1 N -4.620 -4.131 -1.511 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 4 . 475 . 1 1 2 ARG NH2 N -3.200 -5.478 -2.733 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 4 . 476 . 1 1 2 ARG O O -2.596 3.936 -3.449 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 4 . 477 . 1 1 3 NAL C1 C -3.696 1.738 0.410 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 4 . 478 . 1 1 3 NAL C10 C -2.129 4.206 -0.678 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 4 . 479 . 1 1 3 NAL C11 C -1.443 4.322 0.705 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 4 . 480 . 1 1 3 NAL C2 C -4.336 2.787 -0.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 4 . 481 . 1 1 3 NAL C3 C -5.630 2.571 -0.794 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 4 . 482 . 1 1 3 NAL C4 C -6.267 1.327 -0.634 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 4 . 483 . 1 1 3 NAL C4A C -5.614 0.280 0.040 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 4 . 484 . 1 1 3 NAL C5 C -6.241 -0.971 0.198 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 4 . 485 . 1 1 3 NAL C6 C -5.578 -2.011 0.873 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 4 . 486 . 1 1 3 NAL C7 C -4.284 -1.807 1.384 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 4 . 487 . 1 1 3 NAL C8 C -3.657 -0.559 1.231 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 4 . 488 . 1 1 3 NAL C8A C -4.321 0.487 0.563 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 4 . 489 . 1 1 3 NAL C9 C -3.671 4.151 -0.491 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 4 . 490 . 1 1 3 NAL H1 H -2.708 1.875 0.808 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 4 . 491 . 1 1 3 NAL H10 H -1.894 5.129 -1.208 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 4 . 492 . 1 1 3 NAL H3 H -6.144 3.364 -1.316 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 4 . 493 . 1 1 3 NAL H4 H -7.261 1.182 -1.034 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 4 . 494 . 1 1 3 NAL H5 H -7.235 -1.135 -0.194 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 4 . 495 . 1 1 3 NAL H6 H -6.062 -2.968 0.998 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 4 . 496 . 1 1 3 NAL H7 H -3.775 -2.608 1.900 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 4 . 497 . 1 1 3 NAL H8 H -2.665 -0.406 1.630 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 4 . 498 . 1 1 3 NAL H91 H -3.971 4.801 0.330 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 4 . 499 . 1 1 3 NAL H92 H -4.115 4.590 -1.385 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 4 . 500 . 1 1 3 NAL HN1 H -1.276 2.297 -1.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 4 . 501 . 1 1 3 NAL N N -1.717 3.087 -1.538 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 4 . 502 . 1 1 3 NAL O2 O -1.758 5.277 1.418 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 4 . 503 . 1 1 4 NAL C1 C -0.491 0.169 4.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 4 . 504 . 1 1 4 NAL C10 C -0.057 3.365 2.512 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 4 . 505 . 1 1 4 NAL C11 C 1.406 2.923 2.619 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 4 . 506 . 1 1 4 NAL C2 C -0.415 1.568 4.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 4 . 507 . 1 1 4 NAL C3 C 0.186 2.117 5.550 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 4 . 508 . 1 1 4 NAL C4 C 0.711 1.270 6.543 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 4 . 509 . 1 1 4 NAL C4A C 0.621 -0.129 6.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 4 . 510 . 1 1 4 NAL C5 C 1.126 -0.982 7.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 4 . 511 . 1 1 4 NAL C6 C 1.016 -2.377 7.262 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 4 . 512 . 1 1 4 NAL C7 C 0.399 -2.925 6.124 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 4 . 513 . 1 1 4 NAL C8 C -0.102 -2.077 5.121 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 4 . 514 . 1 1 4 NAL C8A C 0.010 -0.680 5.256 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 4 . 515 . 1 1 4 NAL C9 C -1.013 2.461 3.326 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 4 . 516 . 1 1 4 NAL H1 H -0.948 -0.253 3.370 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 4 . 517 . 1 1 4 NAL H10 H -0.098 4.366 2.950 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 4 . 518 . 1 1 4 NAL H3 H 0.246 3.189 5.671 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 4 . 519 . 1 1 4 NAL H4 H 1.172 1.700 7.421 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 4 . 520 . 1 1 4 NAL H5 H 1.593 -0.570 8.285 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 4 . 521 . 1 1 4 NAL H6 H 1.397 -3.029 8.034 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 4 . 522 . 1 1 4 NAL H7 H 0.308 -3.996 6.020 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 4 . 523 . 1 1 4 NAL H8 H -0.578 -2.502 4.251 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 4 . 524 . 1 1 4 NAL H91 H -1.774 3.092 3.785 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 4 . 525 . 1 1 4 NAL H92 H -1.537 1.801 2.636 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 4 . 526 . 1 1 4 NAL HN1 H -0.274 2.657 0.503 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 4 . 527 . 1 1 4 NAL N N -0.541 3.411 1.120 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 4 . 528 . 1 1 4 NAL O2 O 2.219 3.674 3.156 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 4 . 529 . 1 1 5 ARG C C 3.297 0.310 0.833 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 4 . 530 . 1 1 5 ARG CA C 3.116 1.223 2.053 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 4 . 531 . 1 1 5 ARG CB C 3.541 0.649 3.427 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 4 . 532 . 1 1 5 ARG CD C 2.990 -1.849 3.238 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 4 . 533 . 1 1 5 ARG CG C 4.064 -0.792 3.521 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 4 . 534 . 1 1 5 ARG CZ C 4.088 -3.992 3.949 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 4 . 535 . 1 1 5 ARG H H 1.023 1.158 1.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 4 . 536 . 1 1 5 ARG HA H 3.758 2.084 1.867 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 4 . 537 . 1 1 5 ARG HB2 H 4.335 1.295 3.803 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 4 . 538 . 1 1 5 ARG HB3 H 2.717 0.747 4.135 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 4 . 539 . 1 1 5 ARG HD2 H 2.007 -1.426 3.436 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 4 . 540 . 1 1 5 ARG HD3 H 3.035 -2.140 2.190 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 4 . 541 . 1 1 5 ARG HE H 2.535 -3.101 4.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 4 . 542 . 1 1 5 ARG HG2 H 4.909 -0.934 2.847 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 4 . 543 . 1 1 5 ARG HG3 H 4.430 -0.928 4.540 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 4 . 544 . 1 1 5 ARG HH11 H 4.918 -3.247 2.240 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 4 . 545 . 1 1 5 ARG HH12 H 5.648 -4.716 2.848 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 4 . 546 . 1 1 5 ARG HH21 H 3.519 -4.984 5.638 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 4 . 547 . 1 1 5 ARG HH22 H 4.857 -5.696 4.766 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 4 . 548 . 1 1 5 ARG N N 1.744 1.732 2.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 4 . 549 . 1 1 5 ARG NE N 3.157 -3.034 4.094 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 4 . 550 . 1 1 5 ARG NH1 N 4.954 -3.987 2.926 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 4 . 551 . 1 1 5 ARG NH2 N 4.156 -4.975 4.854 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 4 . 552 . 1 1 5 ARG O O 4.422 0.118 0.372 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 4 . 553 . 1 1 6 PHE C C 2.042 0.342 -2.075 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 4 . 554 . 1 1 6 PHE CA C 2.116 -0.797 -1.040 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 4 . 555 . 1 1 6 PHE CB C 0.874 -1.701 -1.142 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 4 . 556 . 1 1 6 PHE CD1 C 1.780 -3.626 0.250 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 4 . 557 . 1 1 6 PHE CD2 C -0.470 -2.812 0.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 4 . 558 . 1 1 6 PHE CE1 C 1.644 -4.570 1.283 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 4 . 559 . 1 1 6 PHE CE2 C -0.608 -3.761 1.727 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 4 . 560 . 1 1 6 PHE CG C 0.727 -2.735 -0.038 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 4 . 561 . 1 1 6 PHE CZ C 0.451 -4.635 2.024 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 4 . 562 . 1 1 6 PHE H H 1.304 -0.040 0.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 4 . 563 . 1 1 6 PHE HA H 3.010 -1.395 -1.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 4 . 564 . 1 1 6 PHE HB2 H -0.014 -1.067 -1.151 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 4 . 565 . 1 1 6 PHE HB3 H 0.907 -2.236 -2.093 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 4 . 566 . 1 1 6 PHE HD1 H 2.701 -3.582 -0.312 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 4 . 567 . 1 1 6 PHE HD2 H -1.289 -2.145 0.478 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 4 . 568 . 1 1 6 PHE HE1 H 2.457 -5.242 1.510 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 4 . 569 . 1 1 6 PHE HE2 H -1.528 -3.815 2.291 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 4 . 570 . 1 1 6 PHE HZ H 0.348 -5.360 2.819 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 4 . 571 . 1 1 6 PHE N N 2.182 -0.193 0.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 4 . 572 . 1 1 6 PHE O O 1.980 1.525 -1.729 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 5 . 573 . 1 1 1 ARG C C 0.396 1.953 -4.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 5 . 574 . 1 1 1 ARG CA C 1.806 1.329 -4.054 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 5 . 575 . 1 1 1 ARG CB C 2.264 0.767 -5.415 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 5 . 576 . 1 1 1 ARG CD C 3.082 1.313 -7.763 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 5 . 577 . 1 1 1 ARG CG C 2.632 1.881 -6.412 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 5 . 578 . 1 1 1 ARG CZ C 2.788 3.221 -9.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 5 . 579 . 1 1 1 ARG HA H 2.498 2.132 -3.797 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 5 . 580 . 1 1 1 ARG HB2 H 3.151 0.150 -5.261 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 5 . 581 . 1 1 1 ARG HB3 H 1.477 0.139 -5.836 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 5 . 582 . 1 1 1 ARG HD2 H 3.900 0.612 -7.600 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 5 . 583 . 1 1 1 ARG HD3 H 2.255 0.777 -8.231 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 5 . 584 . 1 1 1 ARG HE H 4.559 2.475 -8.746 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 5 . 585 . 1 1 1 ARG HG2 H 1.774 2.528 -6.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 5 . 586 . 1 1 1 ARG HG3 H 3.442 2.477 -5.990 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 5 . 587 . 1 1 1 ARG HH11 H 0.989 2.479 -8.758 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 5 . 588 . 1 1 1 ARG HH12 H 0.902 3.820 -9.879 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 5 . 589 . 1 1 1 ARG HH21 H 4.382 4.202 -10.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 5 . 590 . 1 1 1 ARG HH22 H 2.811 4.789 -10.679 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 5 . 591 . 1 1 1 ARG N N 1.941 0.276 -3.024 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 5 . 592 . 1 1 1 ARG NE N 3.557 2.376 -8.665 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 5 . 593 . 1 1 1 ARG NH1 N 1.449 3.166 -9.336 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 5 . 594 . 1 1 1 ARG NH2 N 3.375 4.146 -10.143 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 5 . 595 . 1 1 1 ARG O O 0.262 3.074 -4.648 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 5 . 596 . 1 1 2 ARG C C -2.337 2.956 -3.017 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 5 . 597 . 1 1 2 ARG CA C -2.040 1.634 -3.743 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 5 . 598 . 1 1 2 ARG CB C -2.913 0.513 -3.148 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 5 . 599 . 1 1 2 ARG CD C -1.746 -1.724 -2.886 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 5 . 600 . 1 1 2 ARG CG C -2.696 -0.882 -3.742 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 5 . 601 . 1 1 2 ARG CZ C -0.535 -3.465 -4.227 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 5 . 602 . 1 1 2 ARG H H -0.442 0.341 -3.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 5 . 603 . 1 1 2 ARG HA H -2.318 1.751 -4.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 5 . 604 . 1 1 2 ARG HB2 H -2.751 0.465 -2.073 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 5 . 605 . 1 1 2 ARG HB3 H -3.956 0.763 -3.321 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 5 . 606 . 1 1 2 ARG HD2 H -0.782 -1.227 -2.785 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 5 . 607 . 1 1 2 ARG HD3 H -2.162 -1.846 -1.882 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 5 . 608 . 1 1 2 ARG HE H -2.375 -3.660 -3.392 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 5 . 609 . 1 1 2 ARG HG2 H -3.660 -1.393 -3.778 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 5 . 610 . 1 1 2 ARG HG3 H -2.318 -0.801 -4.763 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 5 . 611 . 1 1 2 ARG HH11 H 0.546 -1.737 -4.103 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 5 . 612 . 1 1 2 ARG HH12 H 1.287 -3.018 -5.036 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 5 . 613 . 1 1 2 ARG HH21 H -1.338 -5.307 -4.570 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 5 . 614 . 1 1 2 ARG HH22 H 0.225 -5.025 -5.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 5 . 615 . 1 1 2 ARG N N -0.637 1.242 -3.688 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 5 . 616 . 1 1 2 ARG NE N -1.578 -3.049 -3.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 5 . 617 . 1 1 2 ARG NH1 N 0.521 -2.674 -4.472 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 5 . 618 . 1 1 2 ARG NH2 N -0.552 -4.700 -4.739 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 5 . 619 . 1 1 2 ARG O O -3.006 3.810 -3.598 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 5 . 620 . 1 1 3 NAL C1 C -3.812 1.673 0.154 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 5 . 621 . 1 1 3 NAL C10 C -2.261 4.202 -0.858 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 5 . 622 . 1 1 3 NAL C11 C -1.470 4.208 0.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 5 . 623 . 1 1 3 NAL C2 C -4.422 2.728 -0.553 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 5 . 624 . 1 1 3 NAL C3 C -5.605 2.473 -1.276 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 5 . 625 . 1 1 3 NAL C4 C -6.154 1.178 -1.314 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 5 . 626 . 1 1 3 NAL C4A C -5.521 0.122 -0.633 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 5 . 627 . 1 1 3 NAL C5 C -6.034 -1.187 -0.708 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 5 . 628 . 1 1 3 NAL C6 C -5.375 -2.240 -0.048 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 5 . 629 . 1 1 3 NAL C7 C -4.208 -1.986 0.696 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 5 . 630 . 1 1 3 NAL C8 C -3.698 -0.679 0.778 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 5 . 631 . 1 1 3 NAL C8A C -4.350 0.375 0.113 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 5 . 632 . 1 1 3 NAL C9 C -3.790 4.121 -0.592 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 5 . 633 . 1 1 3 NAL H1 H -2.891 1.843 0.681 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 5 . 634 . 1 1 3 NAL H10 H -2.051 5.150 -1.355 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 5 . 635 . 1 1 3 NAL H3 H -6.088 3.268 -1.826 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 5 . 636 . 1 1 3 NAL H4 H -7.052 0.995 -1.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 5 . 637 . 1 1 3 NAL H5 H -6.928 -1.390 -1.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 5 . 638 . 1 1 3 NAL H6 H -5.767 -3.244 -0.111 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 5 . 639 . 1 1 3 NAL H7 H -3.705 -2.796 1.203 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 5 . 640 . 1 1 3 NAL H8 H -2.801 -0.487 1.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 5 . 641 . 1 1 3 NAL H91 H -4.043 4.638 0.332 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 5 . 642 . 1 1 3 NAL H92 H -4.281 4.682 -1.389 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 5 . 643 . 1 1 3 NAL HN1 H -1.304 2.383 -1.362 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 5 . 644 . 1 1 3 NAL N N -1.865 3.116 -1.766 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 5 . 645 . 1 1 3 NAL O2 O -1.777 5.014 1.354 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 5 . 646 . 1 1 4 NAL C1 C 0.020 0.337 4.427 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 5 . 647 . 1 1 4 NAL C10 C 0.194 3.048 1.927 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 5 . 648 . 1 1 4 NAL C11 C 1.635 2.553 1.666 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 5 . 649 . 1 1 4 NAL C2 C -0.294 1.669 4.094 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 5 . 650 . 1 1 4 NAL C3 C -0.206 2.669 5.076 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 5 . 651 . 1 1 4 NAL C4 C 0.196 2.354 6.395 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 5 . 652 . 1 1 4 NAL C4A C 0.514 1.009 6.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 5 . 653 . 1 1 4 NAL C5 C 0.934 0.694 8.026 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 5 . 654 . 1 1 4 NAL C6 C 1.255 -0.645 8.337 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 5 . 655 . 1 1 4 NAL C7 C 1.167 -1.643 7.361 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 5 . 656 . 1 1 4 NAL C8 C 0.752 -1.317 6.059 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 5 . 657 . 1 1 4 NAL C8A C 0.424 0.008 5.730 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 5 . 658 . 1 1 4 NAL C9 C -0.692 2.022 2.670 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 5 . 659 . 1 1 4 NAL H1 H -0.018 -0.438 3.663 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 5 . 660 . 1 1 4 NAL H10 H 0.257 3.963 2.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 5 . 661 . 1 1 4 NAL H3 H -0.436 3.700 4.835 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 5 . 662 . 1 1 4 NAL H4 H 0.260 3.116 7.139 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 5 . 663 . 1 1 4 NAL H5 H 1.008 1.450 8.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 5 . 664 . 1 1 4 NAL H6 H 1.568 -0.893 9.344 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 5 . 665 . 1 1 4 NAL H7 H 1.415 -2.661 7.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 5 . 666 . 1 1 4 NAL H8 H 0.680 -2.096 5.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 5 . 667 . 1 1 4 NAL H91 H -1.708 2.414 2.717 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 5 . 668 . 1 1 4 NAL H92 H -0.732 1.108 2.070 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 5 . 669 . 1 1 4 NAL HN1 H -0.240 2.707 -0.119 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 5 . 670 . 1 1 4 NAL N N -0.478 3.318 0.649 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 5 . 671 . 1 1 4 NAL O2 O 2.237 2.932 0.659 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 5 . 672 . 1 1 5 ARG C C 3.425 0.125 1.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 5 . 673 . 1 1 5 ARG CA C 3.460 0.978 2.351 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 5 . 674 . 1 1 5 ARG CB C 3.846 0.115 3.585 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 5 . 675 . 1 1 5 ARG CD C 3.941 2.200 5.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 5 . 676 . 1 1 5 ARG CG C 4.637 0.907 4.633 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 5 . 677 . 1 1 5 ARG CZ C 5.802 3.712 5.777 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 5 . 678 . 1 1 5 ARG H H 1.734 1.647 3.467 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 5 . 679 . 1 1 5 ARG HA H 4.252 1.712 2.197 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 5 . 680 . 1 1 5 ARG HB2 H 2.965 -0.334 4.049 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 5 . 681 . 1 1 5 ARG HB3 H 4.490 -0.719 3.282 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 5 . 682 . 1 1 5 ARG HD2 H 3.792 2.837 4.197 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 5 . 683 . 1 1 5 ARG HD3 H 2.966 1.948 5.485 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 5 . 684 . 1 1 5 ARG HE H 4.500 2.812 7.032 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 5 . 685 . 1 1 5 ARG HG2 H 4.791 0.276 5.509 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 5 . 686 . 1 1 5 ARG HG3 H 5.613 1.155 4.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 5 . 687 . 1 1 5 ARG HH11 H 5.732 3.492 3.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 5 . 688 . 1 1 5 ARG HH12 H 7.017 4.515 4.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 5 . 689 . 1 1 5 ARG HH21 H 6.180 4.145 7.734 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 5 . 690 . 1 1 5 ARG HH22 H 7.267 4.879 6.577 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 5 . 691 . 1 1 5 ARG N N 2.201 1.734 2.571 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 5 . 692 . 1 1 5 ARG NE N 4.747 2.933 6.059 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 5 . 693 . 1 1 5 ARG NH1 N 6.213 3.923 4.518 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 5 . 694 . 1 1 5 ARG NH2 N 6.471 4.295 6.780 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 5 . 695 . 1 1 5 ARG O O 4.486 -0.234 0.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 5 . 696 . 1 1 6 PHE C C 1.589 0.395 -1.735 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 5 . 697 . 1 1 6 PHE CA C 2.001 -0.741 -0.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 5 . 698 . 1 1 6 PHE CB C 0.889 -1.795 -0.651 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 5 . 699 . 1 1 6 PHE CD1 C 2.074 -3.318 1.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 5 . 700 . 1 1 6 PHE CD2 C -0.199 -2.583 1.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 5 . 701 . 1 1 6 PHE CE1 C 2.124 -3.950 2.272 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 5 . 702 . 1 1 6 PHE CE2 C -0.152 -3.222 2.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 5 . 703 . 1 1 6 PHE CG C 0.915 -2.614 0.631 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 5 . 704 . 1 1 6 PHE CZ C 1.016 -3.890 3.139 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 5 . 705 . 1 1 6 PHE H H 1.405 0.127 1.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 5 . 706 . 1 1 6 PHE HA H 2.909 -1.223 -1.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 5 . 707 . 1 1 6 PHE HB2 H -0.065 -1.269 -0.681 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 5 . 708 . 1 1 6 PHE HB3 H 0.937 -2.470 -1.505 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 5 . 709 . 1 1 6 PHE HD1 H 2.939 -3.339 0.371 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 5 . 710 . 1 1 6 PHE HD2 H -1.089 -2.043 1.207 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 5 . 711 . 1 1 6 PHE HE1 H 3.024 -4.464 2.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 5 . 712 . 1 1 6 PHE HE2 H -1.001 -3.173 3.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 5 . 713 . 1 1 6 PHE HZ H 1.060 -4.334 4.123 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 5 . 714 . 1 1 6 PHE N N 2.228 -0.152 0.533 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 5 . 715 . 1 1 6 PHE O O 0.955 1.355 -1.303 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 6 . 716 . 1 1 1 ARG C C 0.248 1.635 -4.396 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 6 . 717 . 1 1 1 ARG CA C 1.648 1.008 -4.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 6 . 718 . 1 1 1 ARG CB C 1.746 0.158 -5.755 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 6 . 719 . 1 1 1 ARG CD C 3.224 -0.858 -7.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 6 . 720 . 1 1 1 ARG CG C 3.197 -0.068 -6.204 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 6 . 721 . 1 1 1 ARG CZ C 5.084 -0.225 -9.095 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 6 . 722 . 1 1 1 ARG HA H 2.366 1.819 -4.559 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 6 . 723 . 1 1 1 ARG HB2 H 1.246 -0.801 -5.607 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 6 . 724 . 1 1 1 ARG HB3 H 1.231 0.683 -6.564 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 6 . 725 . 1 1 1 ARG HD2 H 2.853 -1.865 -7.329 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 6 . 726 . 1 1 1 ARG HD3 H 2.558 -0.383 -8.240 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 6 . 727 . 1 1 1 ARG HE H 5.190 -1.642 -7.654 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 6 . 728 . 1 1 1 ARG HG2 H 3.676 0.901 -6.357 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 6 . 729 . 1 1 1 ARG HG3 H 3.742 -0.619 -5.436 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 6 . 730 . 1 1 1 ARG HH11 H 3.408 0.891 -9.442 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 6 . 731 . 1 1 1 ARG HH12 H 4.769 1.236 -10.485 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 6 . 732 . 1 1 1 ARG HH21 H 6.911 -1.138 -9.051 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 6 . 733 . 1 1 1 ARG HH22 H 6.720 0.106 -10.265 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 6 . 734 . 1 1 1 ARG N N 1.968 0.184 -3.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 6 . 735 . 1 1 1 ARG NE N 4.585 -0.953 -8.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 6 . 736 . 1 1 1 ARG NH1 N 4.361 0.712 -9.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 6 . 737 . 1 1 1 ARG NH2 N 6.341 -0.437 -9.502 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 6 . 738 . 1 1 1 ARG O O 0.006 2.609 -5.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 6 . 739 . 1 1 2 ARG C C -2.260 2.954 -2.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 6 . 740 . 1 1 2 ARG CA C -2.053 1.568 -3.579 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 6 . 741 . 1 1 2 ARG CB C -2.965 0.538 -2.905 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 6 . 742 . 1 1 2 ARG CD C -2.073 -1.856 -2.626 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 6 . 743 . 1 1 2 ARG CG C -2.913 -0.889 -3.478 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 6 . 744 . 1 1 2 ARG CZ C -1.493 -4.292 -2.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 6 . 745 . 1 1 2 ARG H H -0.437 0.303 -3.023 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 6 . 746 . 1 1 2 ARG HA H -2.363 1.640 -4.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 6 . 747 . 1 1 2 ARG HB2 H -2.749 0.505 -1.834 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 6 . 748 . 1 1 2 ARG HB3 H -3.983 0.891 -3.056 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 6 . 749 . 1 1 2 ARG HD2 H -1.059 -1.478 -2.561 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 6 . 750 . 1 1 2 ARG HD3 H -2.488 -1.924 -1.614 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 6 . 751 . 1 1 2 ARG HE H -2.395 -3.270 -4.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 6 . 752 . 1 1 2 ARG HG2 H -3.932 -1.270 -3.511 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 6 . 753 . 1 1 2 ARG HG3 H -2.526 -0.855 -4.495 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 6 . 754 . 1 1 2 ARG HH11 H -0.940 -3.425 -0.910 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 6 . 755 . 1 1 2 ARG HH12 H -0.566 -5.126 -1.057 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 6 . 756 . 1 1 2 ARG HH21 H -1.886 -5.462 -4.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 6 . 757 . 1 1 2 ARG HH22 H -1.098 -6.275 -2.965 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 6 . 758 . 1 1 2 ARG N N -0.665 1.131 -3.573 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 6 . 759 . 1 1 2 ARG NE N -2.023 -3.192 -3.236 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 6 . 760 . 1 1 2 ARG NH1 N -0.960 -4.280 -1.446 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 6 . 761 . 1 1 2 ARG NH2 N -1.492 -5.436 -3.369 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 6 . 762 . 1 1 2 ARG O O -2.842 3.823 -3.581 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 6 . 763 . 1 1 3 NAL C1 C -3.902 1.934 0.234 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 6 . 764 . 1 1 3 NAL C10 C -2.153 4.307 -0.846 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 6 . 765 . 1 1 3 NAL C11 C -1.387 4.324 0.491 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 6 . 766 . 1 1 3 NAL C2 C -4.414 2.993 -0.542 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 6 . 767 . 1 1 3 NAL C3 C -5.572 2.779 -1.318 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 6 . 768 . 1 1 3 NAL C4 C -6.203 1.514 -1.334 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 6 . 769 . 1 1 3 NAL C4A C -5.658 0.455 -0.596 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 6 . 770 . 1 1 3 NAL C5 C -6.240 -0.841 -0.644 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 6 . 771 . 1 1 3 NAL C6 C -5.665 -1.902 0.068 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 6 . 772 . 1 1 3 NAL C7 C -4.528 -1.682 0.868 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 6 . 773 . 1 1 3 NAL C8 C -3.963 -0.397 0.940 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 6 . 774 . 1 1 3 NAL C8A C -4.514 0.663 0.199 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 6 . 775 . 1 1 3 NAL C9 C -3.691 4.350 -0.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 6 . 776 . 1 1 3 NAL H1 H -3.012 2.070 0.814 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 6 . 777 . 1 1 3 NAL H10 H -1.872 5.217 -1.386 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 6 . 778 . 1 1 3 NAL H3 H -5.975 3.577 -1.924 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 6 . 779 . 1 1 3 NAL H4 H -7.086 1.374 -1.932 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 6 . 780 . 1 1 3 NAL H5 H -7.134 -1.011 -1.235 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 6 . 781 . 1 1 3 NAL H6 H -6.101 -2.887 0.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 6 . 782 . 1 1 3 NAL H7 H -4.100 -2.492 1.435 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 6 . 783 . 1 1 3 NAL H8 H -3.101 -0.227 1.576 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 6 . 784 . 1 1 3 NAL H91 H -3.928 4.925 0.277 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 6 . 785 . 1 1 3 NAL H92 H -4.124 4.907 -1.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 6 . 786 . 1 1 3 NAL HN1 H -1.357 2.385 -1.210 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 6 . 787 . 1 1 3 NAL N N -1.815 3.141 -1.679 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 6 . 788 . 1 1 3 NAL O2 O -1.632 5.213 1.312 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 6 . 789 . 1 1 4 NAL C1 C -0.488 0.598 4.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 6 . 790 . 1 1 4 NAL C10 C 0.130 3.139 2.066 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 6 . 791 . 1 1 4 NAL C11 C 1.560 2.577 1.902 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 6 . 792 . 1 1 4 NAL C2 C -0.521 1.939 4.297 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 6 . 793 . 1 1 4 NAL C3 C -0.249 2.972 5.218 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 6 . 794 . 1 1 4 NAL C4 C 0.124 2.657 6.539 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 6 . 795 . 1 1 4 NAL C4A C 0.195 1.313 6.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 6 . 796 . 1 1 4 NAL C5 C 0.591 0.980 8.265 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 6 . 797 . 1 1 4 NAL C6 C 0.566 -0.361 8.691 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 6 . 798 . 1 1 4 NAL C7 C 0.168 -1.374 7.805 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 6 . 799 . 1 1 4 NAL C8 C -0.153 -1.060 6.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 6 . 800 . 1 1 4 NAL C8A C -0.145 0.283 6.050 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 6 . 801 . 1 1 4 NAL C9 C -0.861 2.246 2.852 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 6 . 802 . 1 1 4 NAL H1 H -0.733 -0.196 4.035 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 6 . 803 . 1 1 4 NAL H10 H 0.220 4.089 2.586 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 6 . 804 . 1 1 4 NAL H3 H -0.330 4.014 4.920 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 6 . 805 . 1 1 4 NAL H4 H 0.340 3.454 7.234 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 6 . 806 . 1 1 4 NAL H5 H 0.911 1.741 8.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 6 . 807 . 1 1 4 NAL H6 H 0.842 -0.613 9.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 6 . 808 . 1 1 4 NAL H7 H 0.106 -2.391 8.149 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 6 . 809 . 1 1 4 NAL H8 H -0.425 -1.848 5.788 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 6 . 810 . 1 1 4 NAL H91 H -1.836 2.739 2.860 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 6 . 811 . 1 1 4 NAL H92 H -0.991 1.306 2.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 6 . 812 . 1 1 4 NAL HN1 H -0.267 2.689 0.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 6 . 813 . 1 1 4 NAL N N -0.479 3.367 0.746 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 6 . 814 . 1 1 4 NAL O2 O 2.288 3.052 1.026 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 6 . 815 . 1 1 5 ARG C C 3.304 0.007 1.270 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 6 . 816 . 1 1 5 ARG CA C 3.240 0.823 2.583 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 6 . 817 . 1 1 5 ARG CB C 3.540 -0.061 3.837 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 6 . 818 . 1 1 5 ARG CD C 3.563 1.906 5.414 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 6 . 819 . 1 1 5 ARG CG C 4.325 0.681 4.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 6 . 820 . 1 1 5 ARG CZ C 3.967 3.816 6.968 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 6 . 821 . 1 1 5 ARG H H 1.383 1.422 3.534 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 6 . 822 . 1 1 5 ARG HA H 4.056 1.549 2.499 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 6 . 823 . 1 1 5 ARG HB2 H 2.621 -0.454 4.269 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 6 . 824 . 1 1 5 ARG HB3 H 4.151 -0.930 3.573 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 6 . 825 . 1 1 5 ARG HD2 H 3.481 2.606 4.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 6 . 826 . 1 1 5 ARG HD3 H 2.578 1.572 5.721 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 6 . 827 . 1 1 5 ARG HE H 4.965 2.050 7.003 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 6 . 828 . 1 1 5 ARG HG2 H 4.473 0.005 5.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 6 . 829 . 1 1 5 ARG HG3 H 5.301 0.986 4.545 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 6 . 830 . 1 1 5 ARG HH11 H 2.484 4.169 5.618 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 6 . 831 . 1 1 5 ARG HH12 H 2.816 5.491 6.714 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 6 . 832 . 1 1 5 ARG HH21 H 5.399 3.770 8.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 6 . 833 . 1 1 5 ARG HH22 H 4.491 5.259 8.318 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 6 . 834 . 1 1 5 ARG N N 1.985 1.614 2.738 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 6 . 835 . 1 1 5 ARG NE N 4.237 2.571 6.538 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 6 . 836 . 1 1 5 ARG NH1 N 3.010 4.555 6.389 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 6 . 837 . 1 1 5 ARG NH2 N 4.673 4.322 7.987 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 6 . 838 . 1 1 5 ARG O O 4.257 -0.744 1.061 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 6 . 839 . 1 1 6 PHE C C 1.987 0.628 -2.032 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 6 . 840 . 1 1 6 PHE CA C 2.221 -0.437 -0.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 6 . 841 . 1 1 6 PHE CB C 1.068 -1.452 -0.907 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 6 . 842 . 1 1 6 PHE CD1 C 1.953 -3.282 0.593 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 6 . 843 . 1 1 6 PHE CD2 C -0.076 -2.122 1.276 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 6 . 844 . 1 1 6 PHE CE1 C 1.897 -4.067 1.760 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 6 . 845 . 1 1 6 PHE CE2 C -0.135 -2.913 2.442 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 6 . 846 . 1 1 6 PHE CG C 0.971 -2.309 0.347 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 6 . 847 . 1 1 6 PHE CZ C 0.853 -3.881 2.682 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 6 . 848 . 1 1 6 PHE H H 1.565 0.798 0.638 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 6 . 849 . 1 1 6 PHE HA H 3.145 -0.964 -1.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 6 . 850 . 1 1 6 PHE HB2 H 0.137 -0.896 -1.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 6 . 851 . 1 1 6 PHE HB3 H 1.170 -2.110 -1.769 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 6 . 852 . 1 1 6 PHE HD1 H 2.764 -3.420 -0.106 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 6 . 853 . 1 1 6 PHE HD2 H -0.833 -1.369 1.110 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 6 . 854 . 1 1 6 PHE HE1 H 2.662 -4.804 1.948 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 6 . 855 . 1 1 6 PHE HE2 H -0.933 -2.770 3.155 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 6 . 856 . 1 1 6 PHE HZ H 0.816 -4.481 3.581 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 6 . 857 . 1 1 6 PHE N N 2.324 0.187 0.377 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 6 . 858 . 1 1 6 PHE O O 1.799 1.810 -1.732 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 7 . 859 . 1 1 1 ARG C C 0.418 1.324 -4.662 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 7 . 860 . 1 1 1 ARG CA C 1.692 0.452 -4.586 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 7 . 861 . 1 1 1 ARG CB C 1.704 -0.528 -5.778 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 7 . 862 . 1 1 1 ARG CD C 2.923 -2.239 -7.152 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 7 . 863 . 1 1 1 ARG CG C 2.965 -1.401 -5.868 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 7 . 864 . 1 1 1 ARG CZ C 4.148 -4.404 -6.823 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 7 . 865 . 1 1 1 ARG HA H 2.554 1.115 -4.677 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 7 . 866 . 1 1 1 ARG HB2 H 0.829 -1.178 -5.710 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 7 . 867 . 1 1 1 ARG HB3 H 1.629 0.045 -6.703 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 7 . 868 . 1 1 1 ARG HD2 H 2.002 -2.823 -7.175 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 7 . 869 . 1 1 1 ARG HD3 H 2.922 -1.570 -8.013 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 7 . 870 . 1 1 1 ARG HE H 4.905 -2.749 -7.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 7 . 871 . 1 1 1 ARG HG2 H 3.850 -0.762 -5.884 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 7 . 872 . 1 1 1 ARG HG3 H 3.018 -2.068 -5.007 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 7 . 873 . 1 1 1 ARG HH11 H 2.250 -4.488 -6.076 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 7 . 874 . 1 1 1 ARG HH12 H 3.187 -5.955 -5.905 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 7 . 875 . 1 1 1 ARG HH21 H 6.066 -4.669 -7.463 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 7 . 876 . 1 1 1 ARG HH22 H 5.338 -6.056 -6.687 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 7 . 877 . 1 1 1 ARG N N 1.845 -0.316 -3.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 7 . 878 . 1 1 1 ARG NE N 4.086 -3.133 -7.257 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 7 . 879 . 1 1 1 ARG NH1 N 3.111 -4.997 -6.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 7 . 880 . 1 1 1 ARG NH2 N 5.277 -5.099 -7.003 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 7 . 881 . 1 1 1 ARG O O 0.171 1.897 -5.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 7 . 882 . 1 1 2 ARG C C -1.915 3.281 -2.813 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 7 . 883 . 1 1 2 ARG CA C -1.729 2.015 -3.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 7 . 884 . 1 1 2 ARG CB C -2.795 0.959 -3.302 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 7 . 885 . 1 1 2 ARG CD C -1.899 -1.430 -3.394 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 7 . 886 . 1 1 2 ARG CG C -2.721 -0.348 -4.106 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 7 . 887 . 1 1 2 ARG CZ C -1.484 -3.867 -3.785 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 7 . 888 . 1 1 2 ARG H H -0.131 0.973 -2.731 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 7 . 889 . 1 1 2 ARG HA H -1.937 2.304 -4.687 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 7 . 890 . 1 1 2 ARG HB2 H -2.746 0.728 -2.238 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 7 . 891 . 1 1 2 ARG HB3 H -3.769 1.401 -3.508 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 7 . 892 . 1 1 2 ARG HD2 H -0.892 -1.067 -3.193 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 7 . 893 . 1 1 2 ARG HD3 H -2.382 -1.671 -2.446 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 7 . 894 . 1 1 2 ARG HE H -2.014 -2.517 -5.202 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 7 . 895 . 1 1 2 ARG HG2 H -3.735 -0.731 -4.233 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 7 . 896 . 1 1 2 ARG HG3 H -2.307 -0.152 -5.097 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 7 . 897 . 1 1 2 ARG HH11 H -1.266 -3.361 -1.819 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 7 . 898 . 1 1 2 ARG HH12 H -0.991 -5.047 -2.192 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 7 . 899 . 1 1 2 ARG HH21 H -1.636 -4.710 -5.636 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 7 . 900 . 1 1 2 ARG HH22 H -1.202 -5.808 -4.347 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 7 . 901 . 1 1 2 ARG N N -0.389 1.434 -3.589 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 7 . 902 . 1 1 2 ARG NE N -1.805 -2.637 -4.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 7 . 903 . 1 1 2 ARG NH1 N -1.218 -4.110 -2.494 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 7 . 904 . 1 1 2 ARG NH2 N -1.431 -4.876 -4.662 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 7 . 905 . 1 1 2 ARG O O -2.250 4.315 -3.390 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 7 . 906 . 1 1 3 NAL C1 C -4.094 1.923 -0.018 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 7 . 907 . 1 1 3 NAL C10 C -2.157 4.306 -0.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 7 . 908 . 1 1 3 NAL C11 C -1.633 4.221 0.866 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 7 . 909 . 1 1 3 NAL C2 C -4.486 3.081 -0.723 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 7 . 910 . 1 1 3 NAL C3 C -5.600 3.017 -1.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 7 . 911 . 1 1 3 NAL C4 C -6.301 1.812 -1.757 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 7 . 912 . 1 1 3 NAL C4A C -5.891 0.653 -1.073 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 7 . 913 . 1 1 3 NAL C5 C -6.572 -0.564 -1.266 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 7 . 914 . 1 1 3 NAL C6 C -6.148 -1.722 -0.592 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 7 . 915 . 1 1 3 NAL C7 C -5.044 -1.666 0.277 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 7 . 916 . 1 1 3 NAL C8 C -4.363 -0.452 0.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 7 . 917 . 1 1 3 NAL C8A C -4.785 0.710 -0.198 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 7 . 918 . 1 1 3 NAL C9 C -3.709 4.391 -0.608 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 7 . 919 . 1 1 3 NAL H1 H -3.234 1.950 0.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 7 . 920 . 1 1 3 NAL H10 H -1.767 5.241 -0.988 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 7 . 921 . 1 1 3 NAL H3 H -5.915 3.895 -2.130 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 7 . 922 . 1 1 3 NAL H4 H -7.147 1.779 -2.428 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 7 . 923 . 1 1 3 NAL H5 H -7.420 -0.614 -1.934 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 7 . 924 . 1 1 3 NAL H6 H -6.671 -2.655 -0.741 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 7 . 925 . 1 1 3 NAL H7 H -4.721 -2.558 0.795 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 7 . 926 . 1 1 3 NAL H8 H -3.515 -0.417 1.144 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 7 . 927 . 1 1 3 NAL H91 H -4.081 4.933 0.261 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 7 . 928 . 1 1 3 NAL H92 H -3.976 5.005 -1.468 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 7 . 929 . 1 1 3 NAL HN1 H -1.432 2.352 -1.059 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 7 . 930 . 1 1 3 NAL N N -1.727 3.220 -1.481 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 7 . 931 . 1 1 3 NAL O2 O -2.101 4.987 1.709 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 7 . 932 . 1 1 4 NAL C1 C -0.081 -0.186 4.278 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 7 . 933 . 1 1 4 NAL C10 C -0.270 3.063 2.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 7 . 934 . 1 1 4 NAL C11 C 1.245 2.860 2.683 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 7 . 935 . 1 1 4 NAL C2 C -0.480 1.165 4.322 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 7 . 936 . 1 1 4 NAL C3 C -0.312 1.903 5.509 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 7 . 937 . 1 1 4 NAL C4 C 0.282 1.305 6.635 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 7 . 938 . 1 1 4 NAL C4A C 0.711 -0.034 6.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 7 . 939 . 1 1 4 NAL C5 C 1.337 -0.629 7.695 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 7 . 940 . 1 1 4 NAL C6 C 1.771 -1.964 7.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 7 . 941 . 1 1 4 NAL C7 C 1.582 -2.711 6.457 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 7 . 942 . 1 1 4 NAL C8 C 0.957 -2.122 5.344 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 7 . 943 . 1 1 4 NAL C8A C 0.521 -0.785 5.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 7 . 944 . 1 1 4 NAL C9 C -1.046 1.830 3.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 7 . 945 . 1 1 4 NAL H1 H -0.205 -0.759 3.370 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 7 . 946 . 1 1 4 NAL H10 H -0.524 3.911 3.206 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 7 . 947 . 1 1 4 NAL H3 H -0.619 2.937 5.554 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 7 . 948 . 1 1 4 NAL H4 H 0.419 1.885 7.537 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 7 . 949 . 1 1 4 NAL H5 H 1.494 -0.061 8.599 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 7 . 950 . 1 1 4 NAL H6 H 2.251 -2.416 8.488 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 7 . 951 . 1 1 4 NAL H7 H 1.917 -3.737 6.409 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 7 . 952 . 1 1 4 NAL H8 H 0.820 -2.699 4.444 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 7 . 953 . 1 1 4 NAL H91 H -2.078 2.123 3.275 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 7 . 954 . 1 1 4 NAL H92 H -1.072 1.086 2.278 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 7 . 955 . 1 1 4 NAL HN1 H -0.299 2.734 0.462 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 7 . 956 . 1 1 4 NAL N N -0.684 3.324 1.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 7 . 957 . 1 1 4 NAL O2 O 1.902 3.576 3.438 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 7 . 958 . 1 1 5 ARG C C 3.425 0.498 0.796 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 7 . 959 . 1 1 5 ARG CA C 3.167 1.416 2.001 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 7 . 960 . 1 1 5 ARG CB C 3.422 0.770 3.383 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 7 . 961 . 1 1 5 ARG CD C 3.957 -1.704 3.060 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 7 . 962 . 1 1 5 ARG CG C 4.483 -0.332 3.511 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 7 . 963 . 1 1 5 ARG CZ C 5.742 -3.396 3.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 7 . 964 . 1 1 5 ARG H H 1.161 1.360 1.342 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 7 . 965 . 1 1 5 ARG HA H 3.827 2.280 1.901 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 7 . 966 . 1 1 5 ARG HB2 H 3.709 1.574 4.062 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 7 . 967 . 1 1 5 ARG HB3 H 2.490 0.367 3.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 7 . 968 . 1 1 5 ARG HD2 H 2.881 -1.755 3.223 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 7 . 969 . 1 1 5 ARG HD3 H 4.145 -1.842 1.996 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 7 . 970 . 1 1 5 ARG HE H 4.070 -3.090 4.658 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 7 . 971 . 1 1 5 ARG HG2 H 5.384 -0.067 2.957 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 7 . 972 . 1 1 5 ARG HG3 H 4.746 -0.397 4.569 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 7 . 973 . 1 1 5 ARG HH11 H 6.169 -2.313 1.882 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 7 . 974 . 1 1 5 ARG HH12 H 7.363 -3.512 2.323 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 7 . 975 . 1 1 5 ARG HH21 H 5.636 -4.630 5.178 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 7 . 976 . 1 1 5 ARG HH22 H 7.062 -4.819 4.185 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 7 . 977 . 1 1 5 ARG N N 1.779 1.879 1.949 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 7 . 978 . 1 1 5 ARG NE N 4.571 -2.796 3.831 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 7 . 979 . 1 1 5 ARG NH1 N 6.484 -3.049 2.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 7 . 980 . 1 1 5 ARG NH2 N 6.181 -4.363 4.371 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 7 . 981 . 1 1 5 ARG O O 4.556 0.413 0.319 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 7 . 982 . 1 1 6 PHE C C 2.071 0.188 -2.129 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 7 . 983 . 1 1 6 PHE CA C 2.327 -0.831 -0.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 7 . 984 . 1 1 6 PHE CB C 1.244 -1.924 -0.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 7 . 985 . 1 1 6 PHE CD1 C 2.676 -3.680 0.219 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 7 . 986 . 1 1 6 PHE CD2 C 0.470 -3.194 1.130 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 7 . 987 . 1 1 6 PHE CE1 C 2.891 -4.623 1.238 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 7 . 988 . 1 1 6 PHE CE2 C 0.681 -4.149 2.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 7 . 989 . 1 1 6 PHE CG C 1.468 -2.954 0.165 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 7 . 990 . 1 1 6 PHE CZ C 1.894 -4.858 2.200 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 7 . 991 . 1 1 6 PHE H H 1.479 -0.051 0.762 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 7 . 992 . 1 1 6 PHE HA H 3.291 -1.307 -1.182 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 7 . 993 . 1 1 6 PHE HB2 H 0.274 -1.445 -0.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 7 . 994 . 1 1 6 PHE HB3 H 1.209 -2.460 -1.877 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 7 . 995 . 1 1 6 PHE HD1 H 3.446 -3.511 -0.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 7 . 996 . 1 1 6 PHE HD2 H -0.462 -2.649 1.099 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 7 . 997 . 1 1 6 PHE HE1 H 3.822 -5.169 1.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 7 . 998 . 1 1 6 PHE HE2 H -0.088 -4.335 2.875 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 7 . 999 . 1 1 6 PHE HZ H 2.058 -5.584 2.982 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 7 . 1000 . 1 1 6 PHE N N 2.361 -0.137 0.279 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 7 . 1001 . 1 1 6 PHE O O 2.096 1.400 -1.908 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 8 . 1002 . 1 1 1 ARG C C 0.439 1.269 -4.701 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 8 . 1003 . 1 1 1 ARG CA C 1.810 0.552 -4.611 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 8 . 1004 . 1 1 1 ARG CB C 2.020 -0.341 -5.855 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 8 . 1005 . 1 1 1 ARG CD C 4.553 -0.839 -5.487 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 8 . 1006 . 1 1 1 ARG CG C 3.158 -1.380 -5.832 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 8 . 1007 . 1 1 1 ARG CZ C 6.048 -0.880 -3.473 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 8 . 1008 . 1 1 1 ARG HA H 2.598 1.306 -4.583 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 8 . 1009 . 1 1 1 ARG HB2 H 1.096 -0.890 -6.042 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 8 . 1010 . 1 1 1 ARG HB3 H 2.186 0.315 -6.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 8 . 1011 . 1 1 1 ARG HD2 H 5.288 -1.445 -6.017 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 8 . 1012 . 1 1 1 ARG HD3 H 4.646 0.194 -5.823 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 8 . 1013 . 1 1 1 ARG HE H 4.035 -1.072 -3.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 8 . 1014 . 1 1 1 ARG HG2 H 2.901 -2.190 -5.148 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 8 . 1015 . 1 1 1 ARG HG3 H 3.211 -1.815 -6.831 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 8 . 1016 . 1 1 1 ARG HH11 H 7.095 -0.572 -5.197 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 8 . 1017 . 1 1 1 ARG HH12 H 8.060 -0.657 -3.741 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 8 . 1018 . 1 1 1 ARG HH21 H 5.320 -1.173 -1.589 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 8 . 1019 . 1 1 1 ARG HH22 H 7.056 -1.003 -1.706 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 8 . 1020 . 1 1 1 ARG N N 1.917 -0.269 -3.406 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 8 . 1021 . 1 1 1 ARG NE N 4.833 -0.928 -4.045 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 8 . 1022 . 1 1 1 ARG NH1 N 7.159 -0.688 -4.196 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 8 . 1023 . 1 1 1 ARG NH2 N 6.149 -1.033 -2.148 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 8 . 1024 . 1 1 1 ARG O O 0.012 1.611 -5.804 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 8 . 1025 . 1 1 2 ARG C C -1.939 3.151 -2.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 8 . 1026 . 1 1 2 ARG CA C -1.670 1.859 -3.533 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 8 . 1027 . 1 1 2 ARG CB C -2.520 0.693 -2.980 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 8 . 1028 . 1 1 2 ARG CD C -3.009 -1.831 -2.939 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 8 . 1029 . 1 1 2 ARG CG C -2.234 -0.684 -3.612 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 8 . 1030 . 1 1 2 ARG CZ C -4.993 -2.202 -4.437 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 8 . 1031 . 1 1 2 ARG H H 0.158 1.218 -2.691 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 8 . 1032 . 1 1 2 ARG HA H -2.019 2.032 -4.546 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 8 . 1033 . 1 1 2 ARG HB2 H -2.355 0.607 -1.906 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 8 . 1034 . 1 1 2 ARG HB3 H -3.564 0.950 -3.161 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 8 . 1035 . 1 1 2 ARG HD2 H -2.570 -2.779 -3.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 8 . 1036 . 1 1 2 ARG HD3 H -2.888 -1.756 -1.857 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 8 . 1037 . 1 1 2 ARG HE H -5.082 -1.670 -2.492 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 8 . 1038 . 1 1 2 ARG HG2 H -2.456 -0.648 -4.678 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 8 . 1039 . 1 1 2 ARG HG3 H -1.177 -0.921 -3.496 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 8 . 1040 . 1 1 2 ARG HH11 H -3.236 -2.571 -5.410 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 8 . 1041 . 1 1 2 ARG HH12 H -4.683 -2.823 -6.359 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 8 . 1042 . 1 1 2 ARG HH21 H -6.906 -1.935 -3.783 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 8 . 1043 . 1 1 2 ARG HH22 H -6.748 -2.465 -5.442 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 8 . 1044 . 1 1 2 ARG N N -0.262 1.473 -3.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 8 . 1045 . 1 1 2 ARG NE N -4.448 -1.851 -3.258 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 8 . 1046 . 1 1 2 ARG NH1 N -4.242 -2.562 -5.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 8 . 1047 . 1 1 2 ARG NH2 N -6.324 -2.201 -4.564 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 8 . 1048 . 1 1 2 ARG O O -2.371 4.124 -3.366 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 8 . 1049 . 1 1 3 NAL C1 C -3.926 1.776 0.255 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 8 . 1050 . 1 1 3 NAL C10 C -2.203 4.259 -0.555 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 8 . 1051 . 1 1 3 NAL C11 C -1.628 4.273 0.880 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 8 . 1052 . 1 1 3 NAL C2 C -4.423 2.837 -0.530 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 8 . 1053 . 1 1 3 NAL C3 C -5.551 2.614 -1.346 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 8 . 1054 . 1 1 3 NAL C4 C -6.169 1.352 -1.382 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 8 . 1055 . 1 1 3 NAL C4A C -5.663 0.295 -0.603 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 8 . 1056 . 1 1 3 NAL C5 C -6.275 -0.973 -0.638 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 8 . 1057 . 1 1 3 NAL C6 C -5.754 -2.027 0.133 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 8 . 1058 . 1 1 3 NAL C7 C -4.623 -1.817 0.942 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 8 . 1059 . 1 1 3 NAL C8 C -4.014 -0.551 0.985 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 8 . 1060 . 1 1 3 NAL C8A C -4.533 0.508 0.215 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 8 . 1061 . 1 1 3 NAL C9 C -3.755 4.213 -0.529 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 8 . 1062 . 1 1 3 NAL H1 H -3.058 1.924 0.872 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 8 . 1063 . 1 1 3 NAL H10 H -1.904 5.205 -1.010 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 8 . 1064 . 1 1 3 NAL H3 H -5.947 3.414 -1.954 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 8 . 1065 . 1 1 3 NAL H4 H -7.032 1.199 -2.013 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 8 . 1066 . 1 1 3 NAL H5 H -7.144 -1.142 -1.258 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 8 . 1067 . 1 1 3 NAL H6 H -6.224 -2.999 0.105 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 8 . 1068 . 1 1 3 NAL H7 H -4.226 -2.628 1.535 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 8 . 1069 . 1 1 3 NAL H8 H -3.149 -0.395 1.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 8 . 1070 . 1 1 3 NAL H91 H -4.139 4.778 0.320 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 8 . 1071 . 1 1 3 NAL H92 H -4.102 4.745 -1.415 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 8 . 1072 . 1 1 3 NAL HN1 H -1.344 2.355 -0.963 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 8 . 1073 . 1 1 3 NAL N N -1.715 3.174 -1.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 8 . 1074 . 1 1 3 NAL O2 O -2.086 5.082 1.689 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 8 . 1075 . 1 1 4 NAL C1 C -0.016 0.067 4.326 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 8 . 1076 . 1 1 4 NAL C10 C -0.205 3.224 2.612 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 8 . 1077 . 1 1 4 NAL C11 C 1.292 2.902 2.689 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 8 . 1078 . 1 1 4 NAL C2 C -0.456 1.399 4.447 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 8 . 1079 . 1 1 4 NAL C3 C -0.300 2.074 5.672 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 8 . 1080 . 1 1 4 NAL C4 C 0.306 1.425 6.764 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 8 . 1081 . 1 1 4 NAL C4A C 0.776 0.104 6.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 8 . 1082 . 1 1 4 NAL C5 C 1.417 -0.541 7.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 8 . 1083 . 1 1 4 NAL C6 C 1.910 -1.849 7.554 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 8 . 1084 . 1 1 4 NAL C7 C 1.770 -2.517 6.324 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 8 . 1085 . 1 1 4 NAL C8 C 1.125 -1.880 5.250 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 8 . 1086 . 1 1 4 NAL C8A C 0.618 -0.576 5.404 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 8 . 1087 . 1 1 4 NAL C9 C -1.061 2.104 3.244 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 8 . 1088 . 1 1 4 NAL H1 H -0.131 -0.456 3.390 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 8 . 1089 . 1 1 4 NAL H10 H -0.359 4.141 3.186 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 8 . 1090 . 1 1 4 NAL H3 H -0.633 3.097 5.772 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 8 . 1091 . 1 1 4 NAL H4 H 0.425 1.953 7.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 8 . 1092 . 1 1 4 NAL H5 H 1.540 -0.031 8.652 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 8 . 1093 . 1 1 4 NAL H6 H 2.404 -2.339 8.380 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 8 . 1094 . 1 1 4 NAL H7 H 2.159 -3.517 6.205 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 8 . 1095 . 1 1 4 NAL H8 H 1.038 -2.390 4.301 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 8 . 1096 . 1 1 4 NAL H91 H -2.027 2.521 3.529 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 8 . 1097 . 1 1 4 NAL H92 H -1.254 1.346 2.482 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 8 . 1098 . 1 1 4 NAL HN1 H -0.284 2.782 0.528 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 8 . 1099 . 1 1 4 NAL N N -0.658 3.409 1.226 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 8 . 1100 . 1 1 4 NAL O2 O 2.020 3.577 3.415 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 8 . 1101 . 1 1 5 ARG C C 3.304 0.478 0.696 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 8 . 1102 . 1 1 5 ARG CA C 3.121 1.388 1.920 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 8 . 1103 . 1 1 5 ARG CB C 3.454 0.728 3.278 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 8 . 1104 . 1 1 5 ARG CD C 3.893 -1.729 2.781 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 8 . 1105 . 1 1 5 ARG CG C 4.482 -0.411 3.310 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 8 . 1106 . 1 1 5 ARG CZ C 4.171 -4.157 3.318 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 8 . 1107 . 1 1 5 ARG H H 1.075 1.385 1.375 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 8 . 1108 . 1 1 5 ARG HA H 3.788 2.242 1.789 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 8 . 1109 . 1 1 5 ARG HB2 H 3.816 1.516 3.940 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 8 . 1110 . 1 1 5 ARG HB3 H 2.542 0.348 3.726 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 8 . 1111 . 1 1 5 ARG HD2 H 2.807 -1.646 2.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 8 . 1112 . 1 1 5 ARG HD3 H 4.289 -1.915 1.783 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 8 . 1113 . 1 1 5 ARG HE H 4.396 -2.634 4.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 8 . 1114 . 1 1 5 ARG HG2 H 5.369 -0.138 2.738 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 8 . 1115 . 1 1 5 ARG HG3 H 4.783 -0.548 4.351 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 8 . 1116 . 1 1 5 ARG HH11 H 3.766 -3.846 1.343 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 8 . 1117 . 1 1 5 ARG HH12 H 3.910 -5.522 1.822 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 8 . 1118 . 1 1 5 ARG HH21 H 4.558 -4.817 5.208 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 8 . 1119 . 1 1 5 ARG HH22 H 4.355 -6.069 4.004 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 8 . 1120 . 1 1 5 ARG N N 1.741 1.880 1.949 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 8 . 1121 . 1 1 5 ARG NE N 4.201 -2.861 3.667 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 8 . 1122 . 1 1 5 ARG NH1 N 3.932 -4.540 2.057 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 8 . 1123 . 1 1 5 ARG NH2 N 4.381 -5.090 4.253 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 8 . 1124 . 1 1 5 ARG O O 4.400 0.417 0.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 8 . 1125 . 1 1 6 PHE C C 2.130 0.194 -2.170 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 8 . 1126 . 1 1 6 PHE CA C 2.121 -0.855 -1.039 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 8 . 1127 . 1 1 6 PHE CB C 0.820 -1.682 -1.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 8 . 1128 . 1 1 6 PHE CD1 C 1.252 -4.032 -0.242 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 8 . 1129 . 1 1 6 PHE CD2 C -0.039 -2.514 1.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 8 . 1130 . 1 1 6 PHE CE1 C 1.077 -5.056 0.705 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 8 . 1131 . 1 1 6 PHE CE2 C -0.208 -3.538 2.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 8 . 1132 . 1 1 6 PHE CG C 0.692 -2.759 -0.018 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 8 . 1133 . 1 1 6 PHE CZ C 0.351 -4.808 1.883 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 8 . 1134 . 1 1 6 PHE H H 1.375 -0.138 0.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 8 . 1135 . 1 1 6 PHE HA H 2.971 -1.527 -1.166 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 8 . 1136 . 1 1 6 PHE HB2 H -0.031 -1.003 -0.998 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 8 . 1137 . 1 1 6 PHE HB3 H 0.744 -2.187 -2.041 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 8 . 1138 . 1 1 6 PHE HD1 H 1.804 -4.231 -1.149 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 8 . 1139 . 1 1 6 PHE HD2 H -0.485 -1.546 1.331 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 8 . 1140 . 1 1 6 PHE HE1 H 1.499 -6.034 0.526 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 8 . 1141 . 1 1 6 PHE HE2 H -0.776 -3.351 3.008 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 8 . 1142 . 1 1 6 PHE HZ H 0.217 -5.595 2.610 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 8 . 1143 . 1 1 6 PHE N N 2.220 -0.179 0.247 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 8 . 1144 . 1 1 6 PHE O O 2.298 1.394 -1.939 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 9 . 1145 . 1 1 1 ARG C C 0.346 1.660 -4.366 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 9 . 1146 . 1 1 1 ARG CA C 1.746 1.000 -4.396 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 9 . 1147 . 1 1 1 ARG CB C 1.961 0.150 -5.665 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 9 . 1148 . 1 1 1 ARG CD C 2.430 0.009 -8.128 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 9 . 1149 . 1 1 1 ARG CG C 2.022 0.941 -6.981 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 9 . 1150 . 1 1 1 ARG CZ C 2.866 0.188 -10.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 9 . 1151 . 1 1 1 ARG HA H 2.499 1.790 -4.373 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 9 . 1152 . 1 1 1 ARG HB2 H 2.908 -0.383 -5.556 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 9 . 1153 . 1 1 1 ARG HB3 H 1.164 -0.593 -5.735 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 9 . 1154 . 1 1 1 ARG HD2 H 3.429 -0.381 -7.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 9 . 1155 . 1 1 1 ARG HD3 H 1.728 -0.824 -8.180 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 9 . 1156 . 1 1 1 ARG HE H 2.062 1.648 -9.428 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 9 . 1157 . 1 1 1 ARG HG2 H 1.043 1.365 -7.205 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 9 . 1158 . 1 1 1 ARG HG3 H 2.753 1.745 -6.892 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 9 . 1159 . 1 1 1 ARG HH11 H 3.441 -1.616 -9.817 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 9 . 1160 . 1 1 1 ARG HH12 H 3.694 -1.417 -11.536 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 9 . 1161 . 1 1 1 ARG HH21 H 2.408 1.856 -11.664 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 9 . 1162 . 1 1 1 ARG HH22 H 3.112 0.541 -12.576 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 9 . 1163 . 1 1 1 ARG N N 1.980 0.115 -3.255 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 9 . 1164 . 1 1 1 ARG NE N 2.432 0.709 -9.421 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 9 . 1165 . 1 1 1 ARG NH1 N 3.374 -1.051 -10.651 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 9 . 1166 . 1 1 1 ARG NH2 N 2.790 0.922 -11.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 9 . 1167 . 1 1 1 ARG O O 0.086 2.570 -5.152 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 9 . 1168 . 1 1 2 ARG C C -2.230 2.962 -2.889 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 9 . 1169 . 1 1 2 ARG CA C -1.968 1.559 -3.458 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 9 . 1170 . 1 1 2 ARG CB C -2.765 0.498 -2.671 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 9 . 1171 . 1 1 2 ARG CD C -3.280 -1.969 -2.252 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 9 . 1172 . 1 1 2 ARG CG C -2.467 -0.958 -3.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 9 . 1173 . 1 1 2 ARG CZ C -5.268 -3.456 -2.641 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 9 . 1174 . 1 1 2 ARG H H -0.261 0.487 -2.828 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 9 . 1175 . 1 1 2 ARG HA H -2.338 1.543 -4.478 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 9 . 1176 . 1 1 2 ARG HB2 H -2.547 0.601 -1.608 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 9 . 1177 . 1 1 2 ARG HB3 H -3.825 0.697 -2.838 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 9 . 1178 . 1 1 2 ARG HD2 H -2.629 -2.802 -1.977 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 9 . 1179 . 1 1 2 ARG HD3 H -3.621 -1.509 -1.322 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 9 . 1180 . 1 1 2 ARG HE H -4.548 -2.112 -3.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 9 . 1181 . 1 1 2 ARG HG2 H -2.665 -1.090 -4.143 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 9 . 1182 . 1 1 2 ARG HG3 H -1.413 -1.172 -2.910 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 9 . 1183 . 1 1 2 ARG HH11 H -4.418 -3.788 -0.816 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 9 . 1184 . 1 1 2 ARG HH12 H -5.800 -4.793 -1.195 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 9 . 1185 . 1 1 2 ARG HH21 H -6.340 -3.381 -4.374 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 9 . 1186 . 1 1 2 ARG HH22 H -6.887 -4.561 -3.207 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 9 . 1187 . 1 1 2 ARG N N -0.551 1.208 -3.472 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 9 . 1188 . 1 1 2 ARG NE N -4.424 -2.484 -3.025 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 9 . 1189 . 1 1 2 ARG NH1 N -5.151 -4.064 -1.453 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 9 . 1190 . 1 1 2 ARG NH2 N -6.245 -3.829 -3.474 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 9 . 1191 . 1 1 2 ARG O O -2.814 3.792 -3.585 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 9 . 1192 . 1 1 3 NAL C1 C -4.083 2.155 0.305 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 9 . 1193 . 1 1 3 NAL C10 C -2.167 4.385 -0.828 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 9 . 1194 . 1 1 3 NAL C11 C -1.463 4.370 0.550 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 9 . 1195 . 1 1 3 NAL C2 C -4.484 3.174 -0.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 9 . 1196 . 1 1 3 NAL C3 C -5.598 2.957 -1.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 9 . 1197 . 1 1 3 NAL C4 C -6.295 1.737 -1.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 9 . 1198 . 1 1 3 NAL C4A C -5.882 0.717 -0.499 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 9 . 1199 . 1 1 3 NAL C5 C -6.569 -0.511 -0.459 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 9 . 1200 . 1 1 3 NAL C6 C -6.147 -1.524 0.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 9 . 1201 . 1 1 3 NAL C7 C -5.030 -1.319 1.249 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 9 . 1202 . 1 1 3 NAL C8 C -4.341 -0.095 1.212 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 9 . 1203 . 1 1 3 NAL C8A C -4.769 0.928 0.344 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 9 . 1204 . 1 1 3 NAL C9 C -3.708 4.487 -0.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 9 . 1205 . 1 1 3 NAL H1 H -3.228 2.305 0.940 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 9 . 1206 . 1 1 3 NAL H10 H -1.818 5.272 -1.358 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 9 . 1207 . 1 1 3 NAL H3 H -5.919 3.726 -2.107 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 9 . 1208 . 1 1 3 NAL H4 H -7.145 1.585 -2.025 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 9 . 1209 . 1 1 3 NAL H5 H -7.423 -0.679 -1.099 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 9 . 1210 . 1 1 3 NAL H6 H -6.679 -2.463 0.454 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 9 . 1211 . 1 1 3 NAL H7 H -4.704 -2.102 1.918 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 9 . 1212 . 1 1 3 NAL H8 H -3.486 0.058 1.855 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 9 . 1213 . 1 1 3 NAL H91 H -3.961 5.097 0.192 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 9 . 1214 . 1 1 3 NAL H92 H -4.080 5.033 -1.542 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 9 . 1215 . 1 1 3 NAL HN1 H -1.328 2.481 -1.142 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 9 . 1216 . 1 1 3 NAL N N -1.820 3.208 -1.634 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 9 . 1217 . 1 1 3 NAL O2 O -1.735 5.236 1.381 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 9 . 1218 . 1 1 4 NAL C1 C -0.501 0.533 4.761 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 9 . 1219 . 1 1 4 NAL C10 C 0.053 3.123 2.100 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 9 . 1220 . 1 1 4 NAL C11 C 1.470 2.573 1.847 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 9 . 1221 . 1 1 4 NAL C2 C -0.467 1.868 4.319 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 9 . 1222 . 1 1 4 NAL C3 C -0.045 2.884 5.200 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 9 . 1223 . 1 1 4 NAL C4 C 0.362 2.562 6.506 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 9 . 1224 . 1 1 4 NAL C4A C 0.332 1.226 6.946 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 9 . 1225 . 1 1 4 NAL C5 C 0.737 0.899 8.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 9 . 1226 . 1 1 4 NAL C6 C 0.688 -0.436 8.693 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 9 . 1227 . 1 1 4 NAL C7 C 0.233 -1.446 7.829 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 9 . 1228 . 1 1 4 NAL C8 C -0.166 -1.125 6.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 9 . 1229 . 1 1 4 NAL C8A C -0.112 0.208 6.073 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 9 . 1230 . 1 1 4 NAL C9 C -0.883 2.192 2.895 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 9 . 1231 . 1 1 4 NAL H1 H -0.830 -0.240 4.085 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 9 . 1232 . 1 1 4 NAL H10 H 0.167 4.062 2.648 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 9 . 1233 . 1 1 4 NAL H3 H -0.026 3.915 4.879 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 9 . 1234 . 1 1 4 NAL H4 H 0.692 3.347 7.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 9 . 1235 . 1 1 4 NAL H5 H 1.083 1.670 8.926 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 9 . 1236 . 1 1 4 NAL H6 H 0.996 -0.685 9.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 9 . 1237 . 1 1 4 NAL H7 H 0.189 -2.469 8.172 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 9 . 1238 . 1 1 4 NAL H8 H -0.514 -1.907 5.859 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 9 . 1239 . 1 1 4 NAL H91 H -1.868 2.656 2.948 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 9 . 1240 . 1 1 4 NAL H92 H -0.994 1.262 2.333 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 9 . 1241 . 1 1 4 NAL HN1 H -0.373 2.732 0.067 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 9 . 1242 . 1 1 4 NAL N N -0.579 3.390 0.805 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 9 . 1243 . 1 1 4 NAL O2 O 2.139 3.096 0.953 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 9 . 1244 . 1 1 5 ARG C C 3.369 0.314 0.959 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 9 . 1245 . 1 1 5 ARG CA C 3.298 0.999 2.341 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 9 . 1246 . 1 1 5 ARG CB C 3.885 0.119 3.483 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 9 . 1247 . 1 1 5 ARG CD C 2.449 -2.022 3.143 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 9 . 1248 . 1 1 5 ARG CG C 3.845 -1.409 3.287 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 9 . 1249 . 1 1 5 ARG CZ C 2.044 -3.794 4.867 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 9 . 1250 . 1 1 5 ARG H H 1.385 1.205 3.360 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 9 . 1251 . 1 1 5 ARG HA H 3.956 1.863 2.288 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 9 . 1252 . 1 1 5 ARG HB2 H 4.951 0.366 3.567 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 9 . 1253 . 1 1 5 ARG HB3 H 3.448 0.378 4.447 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 9 . 1254 . 1 1 5 ARG HD2 H 1.754 -1.287 2.744 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 9 . 1255 . 1 1 5 ARG HD3 H 2.516 -2.842 2.429 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 9 . 1256 . 1 1 5 ARG HE H 1.446 -1.862 5.007 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 9 . 1257 . 1 1 5 ARG HG2 H 4.417 -1.659 2.393 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 9 . 1258 . 1 1 5 ARG HG3 H 4.362 -1.883 4.123 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 9 . 1259 . 1 1 5 ARG HH11 H 3.088 -4.511 3.266 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 9 . 1260 . 1 1 5 ARG HH12 H 2.749 -5.680 4.522 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 9 . 1261 . 1 1 5 ARG HH21 H 1.031 -3.425 6.597 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 9 . 1262 . 1 1 5 ARG HH22 H 1.590 -5.070 6.390 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 9 . 1263 . 1 1 5 ARG N N 1.965 1.576 2.614 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 9 . 1264 . 1 1 5 ARG NE N 1.929 -2.528 4.422 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 9 . 1265 . 1 1 5 ARG NH1 N 2.680 -4.739 4.161 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 9 . 1266 . 1 1 5 ARG NH2 N 1.510 -4.123 6.047 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 9 . 1267 . 1 1 5 ARG O O 4.460 0.196 0.400 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 9 . 1268 . 1 1 6 PHE C C 2.061 0.499 -1.977 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 9 . 1269 . 1 1 6 PHE CA C 2.089 -0.641 -0.945 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 9 . 1270 . 1 1 6 PHE CB C 0.793 -1.468 -1.055 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 9 . 1271 . 1 1 6 PHE CD1 C 1.218 -3.702 0.063 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 9 . 1272 . 1 1 6 PHE CD2 C -0.460 -2.218 1.021 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 9 . 1273 . 1 1 6 PHE CE1 C 0.927 -4.664 1.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 9 . 1274 . 1 1 6 PHE CE2 C -0.748 -3.179 2.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 9 . 1275 . 1 1 6 PHE CG C 0.525 -2.477 0.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 9 . 1276 . 1 1 6 PHE CZ C -0.057 -4.403 2.016 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 9 . 1277 . 1 1 6 PHE H H 1.357 0.030 0.904 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 9 . 1278 . 1 1 6 PHE HA H 2.936 -1.297 -1.154 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 9 . 1279 . 1 1 6 PHE HB2 H -0.049 -0.775 -1.093 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 9 . 1280 . 1 1 6 PHE HB3 H 0.820 -2.024 -1.997 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 9 . 1281 . 1 1 6 PHE HD1 H 1.969 -3.912 -0.686 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 9 . 1282 . 1 1 6 PHE HD2 H -1.005 -1.285 1.011 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 9 . 1283 . 1 1 6 PHE HE1 H 1.458 -5.605 1.055 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 9 . 1284 . 1 1 6 PHE HE2 H -1.505 -2.980 2.749 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 9 . 1285 . 1 1 6 PHE HZ H -0.281 -5.144 2.770 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 9 . 1286 . 1 1 6 PHE N N 2.219 -0.105 0.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 9 . 1287 . 1 1 6 PHE O O 2.052 1.683 -1.636 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 1 10 . 1288 . 1 1 1 ARG C C 0.271 1.206 -4.617 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C . . rr_1skl 1 10 . 1289 . 1 1 1 ARG CA C 1.728 0.872 -4.259 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA . . rr_1skl 1 10 . 1290 . 1 1 1 ARG CB C 2.570 0.265 -5.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB . . rr_1skl 1 10 . 1291 . 1 1 1 ARG CD C 2.492 2.101 -7.276 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD . . rr_1skl 1 10 . 1292 . 1 1 1 ARG CG C 3.318 1.301 -6.255 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG . . rr_1skl 1 10 . 1293 . 1 1 1 ARG CZ C 1.607 4.460 -7.168 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ . . rr_1skl 1 10 . 1294 . 1 1 1 ARG HA H 2.204 1.824 -4.000 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA . . rr_1skl 1 10 . 1295 . 1 1 1 ARG HB2 H 3.336 -0.368 -4.954 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2 . . rr_1skl 1 10 . 1296 . 1 1 1 ARG HB3 H 1.962 -0.372 -6.041 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3 . . rr_1skl 1 10 . 1297 . 1 1 1 ARG HD2 H 3.181 2.497 -8.022 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2 . . rr_1skl 1 10 . 1298 . 1 1 1 ARG HD3 H 1.796 1.432 -7.786 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3 . . rr_1skl 1 10 . 1299 . 1 1 1 ARG HE H 1.236 2.998 -5.822 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE . . rr_1skl 1 10 . 1300 . 1 1 1 ARG HG2 H 3.846 1.988 -5.593 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2 . . rr_1skl 1 10 . 1301 . 1 1 1 ARG HG3 H 4.063 0.744 -6.816 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3 . . rr_1skl 1 10 . 1302 . 1 1 1 ARG HH11 H 2.827 4.210 -8.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 10 . 1303 . 1 1 1 ARG HH12 H 2.109 5.795 -8.629 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 10 . 1304 . 1 1 1 ARG HH21 H 0.335 5.060 -5.689 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 10 . 1305 . 1 1 1 ARG HH22 H 0.715 6.271 -6.890 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 10 . 1306 . 1 1 1 ARG N N 1.745 -0.013 -3.090 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N . . rr_1skl 1 10 . 1307 . 1 1 1 ARG NE N 1.739 3.216 -6.671 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE . . rr_1skl 1 10 . 1308 . 1 1 1 ARG NH1 N 2.231 4.854 -8.289 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1 . . rr_1skl 1 10 . 1309 . 1 1 1 ARG NH2 N 0.825 5.336 -6.527 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2 . . rr_1skl 1 10 . 1310 . 1 1 1 ARG O O -0.152 1.031 -5.767 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O . . rr_1skl 1 10 . 1311 . 1 1 2 ARG C C -2.220 3.294 -2.960 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C . . rr_1skl 1 10 . 1312 . 1 1 2 ARG CA C -1.904 2.015 -3.752 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA . . rr_1skl 1 10 . 1313 . 1 1 2 ARG CB C -2.821 0.857 -3.298 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB . . rr_1skl 1 10 . 1314 . 1 1 2 ARG CD C -1.659 -1.427 -3.172 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD . . rr_1skl 1 10 . 1315 . 1 1 2 ARG CG C -2.607 -0.512 -3.954 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG . . rr_1skl 1 10 . 1316 . 1 1 2 ARG CZ C -0.680 -3.147 -4.717 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ . . rr_1skl 1 10 . 1317 . 1 1 2 ARG H H -0.102 1.737 -2.694 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H . . rr_1skl 1 10 . 1318 . 1 1 2 ARG HA H -2.131 2.216 -4.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA . . rr_1skl 1 10 . 1319 . 1 1 2 ARG HB2 H -2.767 0.741 -2.220 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2 . . rr_1skl 1 10 . 1320 . 1 1 2 ARG HB3 H -3.827 1.139 -3.573 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3 . . rr_1skl 1 10 . 1321 . 1 1 2 ARG HD2 H -0.668 -0.988 -3.112 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2 . . rr_1skl 1 10 . 1322 . 1 1 2 ARG HD3 H -2.018 -1.558 -2.147 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3 . . rr_1skl 1 10 . 1323 . 1 1 2 ARG HE H -2.391 -3.336 -3.645 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE . . rr_1skl 1 10 . 1324 . 1 1 2 ARG HG2 H -3.581 -1.011 -4.000 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2 . . rr_1skl 1 10 . 1325 . 1 1 2 ARG HG3 H -2.258 -0.387 -4.981 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3 . . rr_1skl 1 10 . 1326 . 1 1 2 ARG HH11 H 0.439 -1.441 -4.704 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 10 . 1327 . 1 1 2 ARG HH12 H 1.016 -2.706 -5.763 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 10 . 1328 . 1 1 2 ARG HH21 H -1.563 -4.964 -5.012 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 10 . 1329 . 1 1 2 ARG HH22 H -0.111 -4.675 -5.944 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 10 . 1330 . 1 1 2 ARG N N -0.502 1.651 -3.618 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N . . rr_1skl 1 10 . 1331 . 1 1 2 ARG NE N -1.601 -2.737 -3.825 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE . . rr_1skl 1 10 . 1332 . 1 1 2 ARG NH1 N 0.347 -2.371 -5.085 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1 . . rr_1skl 1 10 . 1333 . 1 1 2 ARG NH2 N -0.793 -4.362 -5.267 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2 . . rr_1skl 1 10 . 1334 . 1 1 2 ARG O O -2.700 4.264 -3.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O . . rr_1skl 1 10 . 1335 . 1 1 3 NAL C1 C -4.464 2.009 -0.295 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1 . . rr_1skl 1 10 . 1336 . 1 1 3 NAL C10 C -2.347 4.364 -0.693 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10 . . rr_1skl 1 10 . 1337 . 1 1 3 NAL C11 C -1.686 4.173 0.693 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11 . . rr_1skl 1 10 . 1338 . 1 1 3 NAL C2 C -4.695 3.226 -0.967 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2 . . rr_1skl 1 10 . 1339 . 1 1 3 NAL C3 C -5.632 3.271 -2.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3 . . rr_1skl 1 10 . 1340 . 1 1 3 NAL C4 C -6.311 2.108 -2.418 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4 . . rr_1skl 1 10 . 1341 . 1 1 3 NAL C4A C -6.053 0.886 -1.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A . . rr_1skl 1 10 . 1342 . 1 1 3 NAL C5 C -6.686 -0.296 -2.210 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5 . . rr_1skl 1 10 . 1343 . 1 1 3 NAL C6 C -6.398 -1.520 -1.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6 . . rr_1skl 1 10 . 1344 . 1 1 3 NAL C7 C -5.487 -1.568 -0.517 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7 . . rr_1skl 1 10 . 1345 . 1 1 3 NAL C8 C -4.858 -0.389 -0.074 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8 . . rr_1skl 1 10 . 1346 . 1 1 3 NAL C8A C -5.132 0.840 -0.702 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A . . rr_1skl 1 10 . 1347 . 1 1 3 NAL C9 C -3.894 4.474 -0.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9 . . rr_1skl 1 10 . 1348 . 1 1 3 NAL H1 H -3.731 1.970 0.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1 . . rr_1skl 1 10 . 1349 . 1 1 3 NAL H10 H -1.966 5.309 -1.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10 . . rr_1skl 1 10 . 1350 . 1 1 3 NAL H3 H -5.818 4.197 -2.547 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3 . . rr_1skl 1 10 . 1351 . 1 1 3 NAL H4 H -7.014 2.153 -3.240 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4 . . rr_1skl 1 10 . 1352 . 1 1 3 NAL H5 H -7.386 -0.266 -3.033 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5 . . rr_1skl 1 10 . 1353 . 1 1 3 NAL H6 H -6.879 -2.425 -1.924 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6 . . rr_1skl 1 10 . 1354 . 1 1 3 NAL H7 H -5.266 -2.509 -0.035 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7 . . rr_1skl 1 10 . 1355 . 1 1 3 NAL H8 H -4.159 -0.432 0.747 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8 . . rr_1skl 1 10 . 1356 . 1 1 3 NAL H91 H -4.199 4.808 0.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91 . . rr_1skl 1 10 . 1357 . 1 1 3 NAL H92 H -4.189 5.265 -1.300 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92 . . rr_1skl 1 10 . 1358 . 1 1 3 NAL HN1 H -1.574 2.477 -1.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1 . . rr_1skl 1 10 . 1359 . 1 1 3 NAL N N -1.959 3.309 -1.647 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N . . rr_1skl 1 10 . 1360 . 1 1 3 NAL O2 O -2.045 4.875 1.639 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2 . . rr_1skl 1 10 . 1361 . 1 1 4 NAL C1 C 0.304 0.150 4.345 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1 . . rr_1skl 1 10 . 1362 . 1 1 4 NAL C10 C 0.004 2.914 2.061 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10 . . rr_1skl 1 10 . 1363 . 1 1 4 NAL C11 C 1.444 2.497 1.701 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11 . . rr_1skl 1 10 . 1364 . 1 1 4 NAL C2 C -0.294 1.414 4.177 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2 . . rr_1skl 1 10 . 1365 . 1 1 4 NAL C3 C -0.353 2.298 5.273 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3 . . rr_1skl 1 10 . 1366 . 1 1 4 NAL C4 C 0.214 1.929 6.508 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4 . . rr_1skl 1 10 . 1367 . 1 1 4 NAL C4A C 0.871 0.690 6.645 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A . . rr_1skl 1 10 . 1368 . 1 1 4 NAL C5 C 1.522 0.350 7.843 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5 . . rr_1skl 1 10 . 1369 . 1 1 4 NAL C6 C 2.220 -0.868 7.947 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6 . . rr_1skl 1 10 . 1370 . 1 1 4 NAL C7 C 2.275 -1.748 6.851 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7 . . rr_1skl 1 10 . 1371 . 1 1 4 NAL C8 C 1.624 -1.418 5.652 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8 . . rr_1skl 1 10 . 1372 . 1 1 4 NAL C8A C 0.919 -0.203 5.555 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A . . rr_1skl 1 10 . 1373 . 1 1 4 NAL C9 C -0.811 1.830 2.806 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9 . . rr_1skl 1 10 . 1374 . 1 1 4 NAL H1 H 0.340 -0.542 3.527 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1 . . rr_1skl 1 10 . 1375 . 1 1 4 NAL H10 H 0.057 3.796 2.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10 . . rr_1skl 1 10 . 1376 . 1 1 4 NAL H3 H -0.819 3.268 5.165 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3 . . rr_1skl 1 10 . 1377 . 1 1 4 NAL H4 H 0.177 2.620 7.336 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4 . . rr_1skl 1 10 . 1378 . 1 1 4 NAL H5 H 1.508 1.029 8.682 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5 . . rr_1skl 1 10 . 1379 . 1 1 4 NAL H6 H 2.729 -1.122 8.868 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6 . . rr_1skl 1 10 . 1380 . 1 1 4 NAL H7 H 2.828 -2.673 6.929 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7 . . rr_1skl 1 10 . 1381 . 1 1 4 NAL H8 H 1.705 -2.079 4.797 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8 . . rr_1skl 1 10 . 1382 . 1 1 4 NAL H91 H -1.832 2.189 2.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91 . . rr_1skl 1 10 . 1383 . 1 1 4 NAL H92 H -0.861 0.952 2.166 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92 . . rr_1skl 1 10 . 1384 . 1 1 4 NAL HN1 H -0.458 2.719 0.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1 . . rr_1skl 1 10 . 1385 . 1 1 4 NAL N N -0.720 3.244 0.828 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N . . rr_1skl 1 10 . 1386 . 1 1 4 NAL O2 O 1.921 2.855 0.607 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2 . . rr_1skl 1 10 . 1387 . 1 1 5 ARG C C 3.502 0.285 1.030 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C . . rr_1skl 1 10 . 1388 . 1 1 5 ARG CA C 3.519 1.176 2.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA . . rr_1skl 1 10 . 1389 . 1 1 5 ARG CB C 4.083 0.370 3.477 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB . . rr_1skl 1 10 . 1390 . 1 1 5 ARG CD C 3.646 2.338 5.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD . . rr_1skl 1 10 . 1391 . 1 1 5 ARG CG C 4.557 1.162 4.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG . . rr_1skl 1 10 . 1392 . 1 1 5 ARG CZ C 3.567 4.248 6.657 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ . . rr_1skl 1 10 . 1393 . 1 1 5 ARG H H 1.780 1.607 3.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H . . rr_1skl 1 10 . 1394 . 1 1 5 ARG HA H 4.195 2.009 2.087 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA . . rr_1skl 1 10 . 1395 . 1 1 5 ARG HB2 H 3.351 -0.379 3.791 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2 . . rr_1skl 1 10 . 1396 . 1 1 5 ARG HB3 H 4.952 -0.204 3.138 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3 . . rr_1skl 1 10 . 1397 . 1 1 5 ARG HD2 H 3.634 3.034 4.234 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2 . . rr_1skl 1 10 . 1398 . 1 1 5 ARG HD3 H 2.640 1.960 5.232 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3 . . rr_1skl 1 10 . 1399 . 1 1 5 ARG HE H 4.842 2.672 6.799 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE . . rr_1skl 1 10 . 1400 . 1 1 5 ARG HG2 H 4.619 0.475 5.559 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2 . . rr_1skl 1 10 . 1401 . 1 1 5 ARG HG3 H 5.560 1.540 4.516 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3 . . rr_1skl 1 10 . 1402 . 1 1 5 ARG HH11 H 2.183 4.394 5.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 10 . 1403 . 1 1 5 ARG HH12 H 2.198 5.724 6.295 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 10 . 1404 . 1 1 5 ARG HH21 H 4.819 4.435 8.256 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 10 . 1405 . 1 1 5 ARG HH22 H 3.680 5.745 8.037 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 10 . 1406 . 1 1 5 ARG N N 2.175 1.765 2.570 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N . . rr_1skl 1 10 . 1407 . 1 1 5 ARG NE N 4.085 3.072 6.263 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE . . rr_1skl 1 10 . 1408 . 1 1 5 ARG NH1 N 2.563 4.836 5.984 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1 . . rr_1skl 1 10 . 1409 . 1 1 5 ARG NH2 N 4.060 4.858 7.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2 . . rr_1skl 1 10 . 1410 . 1 1 5 ARG O O 4.599 -0.040 0.512 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O . . rr_1skl 1 10 . 1411 . 1 1 6 PHE C C 2.346 0.218 -1.926 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C . . rr_1skl 1 10 . 1412 . 1 1 6 PHE CA C 2.101 -0.764 -0.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA . . rr_1skl 1 10 . 1413 . 1 1 6 PHE CB C 0.641 -1.291 -0.747 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB . . rr_1skl 1 10 . 1414 . 1 1 6 PHE CD1 C 0.696 -2.699 1.417 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1 . . rr_1skl 1 10 . 1415 . 1 1 6 PHE CD2 C -1.270 -1.368 0.907 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2 . . rr_1skl 1 10 . 1416 . 1 1 6 PHE CE1 C 0.094 -3.102 2.630 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1 . . rr_1skl 1 10 . 1417 . 1 1 6 PHE CE2 C -1.865 -1.763 2.122 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2 . . rr_1skl 1 10 . 1418 . 1 1 6 PHE CG C 0.018 -1.803 0.557 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG . . rr_1skl 1 10 . 1419 . 1 1 6 PHE CZ C -1.179 -2.617 3.000 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ . . rr_1skl 1 10 . 1420 . 1 1 6 PHE H H 1.507 0.216 1.015 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H . . rr_1skl 1 10 . 1421 . 1 1 6 PHE HA H 2.776 -1.608 -0.834 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA . . rr_1skl 1 10 . 1422 . 1 1 6 PHE HB2 H 0.010 -0.477 -1.091 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2 . . rr_1skl 1 10 . 1423 . 1 1 6 PHE HB3 H 0.593 -2.107 -1.474 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3 . . rr_1skl 1 10 . 1424 . 1 1 6 PHE HD1 H 1.677 -3.057 1.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1 . . rr_1skl 1 10 . 1425 . 1 1 6 PHE HD2 H -1.811 -0.693 0.257 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2 . . rr_1skl 1 10 . 1426 . 1 1 6 PHE HE1 H 0.628 -3.767 3.293 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1 . . rr_1skl 1 10 . 1427 . 1 1 6 PHE HE2 H -2.840 -1.391 2.394 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2 . . rr_1skl 1 10 . 1428 . 1 1 6 PHE HZ H -1.626 -2.865 3.968 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ . . rr_1skl 1 10 . 1429 . 1 1 6 PHE N N 2.344 -0.090 0.527 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N . . rr_1skl 1 10 . 1430 . 1 1 6 PHE O O 3.071 1.223 -1.770 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O . . rr_1skl 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_1skl _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 1skl.mr . $. "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1skl 1 1 1skl.mr . $. AMBER 2 distance NOE simple 0 rr_1skl 1 1 1skl.mr . $. AMBER 3 "dihedral angle" "Not applicable" "Not applicable" 0 rr_1skl 1 1 1skl.mr . $. AMBER 4 stereochemistry chirality "Not applicable" 0 rr_1skl 1 1 1skl.mr . $. "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1skl 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_1skl _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 ANTIMICROBIAL PROTEIN 05-MAR-04 1SKL *TITLE 2 BOUND TO DPC MICELLES *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: CYCLIC HEXAPEPTIDE RR(NAL)(NAL)RF; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES; *COMPND 5 OTHER_DETAILS: NAL = L-2-NAPHTYLALANINE *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: SYNTHESIS OF THE LINEAR PEPTIDE BY THE *SOURCE 4 SOLID-PHASE METHOD USING STANDARD FMOC CHEMISTRY IN *SOURCE 5 CONTINUOUS FLOW MODE (MILLIGEN 9050 PEPTIDE SYNTHESIZER; *SOURCE 6 MILLIPORE, USA). CYCLIZATION MANUALLY BY APPLYING HAPYU- *SOURCE 7 CHEMISTRY. PURIFICATION BY RP-HPLC (SHIMADZU LC-10AD *SOURCE 8 SYSTEM), CHARACTERIZATION BY MATRIX-ASSISTED LASER *SOURCE 9 DESORPTION MASS SPECTROMETRY (MALDI II, KRATOS, MANCHESTER, *SOURCE 10 UK). *KEYWDS CYCLIC PEPTIDE; ANTIMICROBIAL PEPTIDE *EXPDTA NMR, 10 STRUCTURES *AUTHOR C.APPELT, J.A.SODERHALL, M.BIENERT, M.DATHE, P.SCHMIEDER *REVDAT 1 15-MAR-05 1SKL 0 " save_
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