data_Remediated_restraints_file_for_PDB_entry_2m7y # This BMRB archive file contains, for PDB entry 2m7y: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process, minor modifications could # have occurred to the NMR restraints information, or data could have been lost # because of parsing or conversion errors. The PDB file remains the # authoritative reference for the atomic coordinates and the originally deposited # restraints files remain the primary reference for these data. # # This file is generated as part of the wwPDB at the BioMagResBank (BMRB) in # collaboration with the PDBe (formerly MSD) group at the European # Bioinformatics Institute (EBI) and the CMBI/IMM group at the Radboud # University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389-396. ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID rr_2m7y _Entry.Title 'wwPDB remediated NMR restraints for PDB entry 2m7y' _Entry.Version_type original _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Contains the remediated restraint lists and coordinates for PDB entry 2m7y' _Entry.PDB_coordinate_file_version 3.20 loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2m7y 'Master copy' rr_2m7y stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID rr_2m7y _Assembly.ID 1 _Assembly.Name 2m7y _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 1 _Assembly.Non_standard_bonds no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 8324.4549 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 'Leader peptide' 1 $Leader_peptide A . no . . . . . . rr_2m7y 1 2 'ZINC ION' 2 $ZINC_ION B . no . . . . . . rr_2m7y 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Leader_peptide _Entity.Sf_category entity _Entity.Sf_framecode Leader_peptide _Entity.Entry_ID rr_2m7y _Entity.ID 1 _Entity.Name Leader_peptide _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code ; GSTAMATTMEQEICAHSMTF EECPKCSALQYRNGFYLLKY DEEWYPEELLTDGEDDVFDP DLDMEVVFETQ ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Number_of_monomers 71 _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Parent_entity_ID 1 _Entity.Formula_weight 8259.0749 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 . GLY . rr_2m7y 1 2 . SER . rr_2m7y 1 3 . THR . rr_2m7y 1 4 . ALA . rr_2m7y 1 5 . MET . rr_2m7y 1 6 . ALA . rr_2m7y 1 7 . THR . rr_2m7y 1 8 . THR . rr_2m7y 1 9 . MET . rr_2m7y 1 10 . GLU . rr_2m7y 1 11 . GLN . rr_2m7y 1 12 . GLU . rr_2m7y 1 13 . ILE . rr_2m7y 1 14 . CYS . rr_2m7y 1 15 . ALA . rr_2m7y 1 16 . HIS . rr_2m7y 1 17 . SER . rr_2m7y 1 18 . MET . rr_2m7y 1 19 . THR . rr_2m7y 1 20 . PHE . rr_2m7y 1 21 . GLU . rr_2m7y 1 22 . GLU . rr_2m7y 1 23 . CYS . rr_2m7y 1 24 . PRO . rr_2m7y 1 25 . LYS . rr_2m7y 1 26 . CYS . rr_2m7y 1 27 . SER . rr_2m7y 1 28 . ALA . rr_2m7y 1 29 . LEU . rr_2m7y 1 30 . GLN . rr_2m7y 1 31 . TYR . rr_2m7y 1 32 . ARG . rr_2m7y 1 33 . ASN . rr_2m7y 1 34 . GLY . rr_2m7y 1 35 . PHE . rr_2m7y 1 36 . TYR . rr_2m7y 1 37 . LEU . rr_2m7y 1 38 . LEU . rr_2m7y 1 39 . LYS . rr_2m7y 1 40 . TYR . rr_2m7y 1 41 . ASP . rr_2m7y 1 42 . GLU . rr_2m7y 1 43 . GLU . rr_2m7y 1 44 . TRP . rr_2m7y 1 45 . TYR . rr_2m7y 1 46 . PRO . rr_2m7y 1 47 . GLU . rr_2m7y 1 48 . GLU . rr_2m7y 1 49 . LEU . rr_2m7y 1 50 . LEU . rr_2m7y 1 51 . THR . rr_2m7y 1 52 . ASP . rr_2m7y 1 53 . GLY . rr_2m7y 1 54 . GLU . rr_2m7y 1 55 . ASP . rr_2m7y 1 56 . ASP . rr_2m7y 1 57 . VAL . rr_2m7y 1 58 . PHE . rr_2m7y 1 59 . ASP . rr_2m7y 1 60 . PRO . rr_2m7y 1 61 . ASP . rr_2m7y 1 62 . LEU . rr_2m7y 1 63 . ASP . rr_2m7y 1 64 . MET . rr_2m7y 1 65 . GLU . rr_2m7y 1 66 . VAL . rr_2m7y 1 67 . VAL . rr_2m7y 1 68 . PHE . rr_2m7y 1 69 . GLU . rr_2m7y 1 70 . THR . rr_2m7y 1 71 . GLN . rr_2m7y 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 rr_2m7y 1 . SER 2 2 rr_2m7y 1 . THR 3 3 rr_2m7y 1 . ALA 4 4 rr_2m7y 1 . MET 5 5 rr_2m7y 1 . ALA 6 6 rr_2m7y 1 . THR 7 7 rr_2m7y 1 . THR 8 8 rr_2m7y 1 . MET 9 9 rr_2m7y 1 . GLU 10 10 rr_2m7y 1 . GLN 11 11 rr_2m7y 1 . GLU 12 12 rr_2m7y 1 . ILE 13 13 rr_2m7y 1 . CYS 14 14 rr_2m7y 1 . ALA 15 15 rr_2m7y 1 . HIS 16 16 rr_2m7y 1 . SER 17 17 rr_2m7y 1 . MET 18 18 rr_2m7y 1 . THR 19 19 rr_2m7y 1 . PHE 20 20 rr_2m7y 1 . GLU 21 21 rr_2m7y 1 . GLU 22 22 rr_2m7y 1 . CYS 23 23 rr_2m7y 1 . PRO 24 24 rr_2m7y 1 . LYS 25 25 rr_2m7y 1 . CYS 26 26 rr_2m7y 1 . SER 27 27 rr_2m7y 1 . ALA 28 28 rr_2m7y 1 . LEU 29 29 rr_2m7y 1 . GLN 30 30 rr_2m7y 1 . TYR 31 31 rr_2m7y 1 . ARG 32 32 rr_2m7y 1 . ASN 33 33 rr_2m7y 1 . GLY 34 34 rr_2m7y 1 . PHE 35 35 rr_2m7y 1 . TYR 36 36 rr_2m7y 1 . LEU 37 37 rr_2m7y 1 . LEU 38 38 rr_2m7y 1 . LYS 39 39 rr_2m7y 1 . TYR 40 40 rr_2m7y 1 . ASP 41 41 rr_2m7y 1 . GLU 42 42 rr_2m7y 1 . GLU 43 43 rr_2m7y 1 . TRP 44 44 rr_2m7y 1 . TYR 45 45 rr_2m7y 1 . PRO 46 46 rr_2m7y 1 . GLU 47 47 rr_2m7y 1 . GLU 48 48 rr_2m7y 1 . LEU 49 49 rr_2m7y 1 . LEU 50 50 rr_2m7y 1 . THR 51 51 rr_2m7y 1 . ASP 52 52 rr_2m7y 1 . GLY 53 53 rr_2m7y 1 . GLU 54 54 rr_2m7y 1 . ASP 55 55 rr_2m7y 1 . ASP 56 56 rr_2m7y 1 . VAL 57 57 rr_2m7y 1 . PHE 58 58 rr_2m7y 1 . ASP 59 59 rr_2m7y 1 . PRO 60 60 rr_2m7y 1 . ASP 61 61 rr_2m7y 1 . LEU 62 62 rr_2m7y 1 . ASP 63 63 rr_2m7y 1 . MET 64 64 rr_2m7y 1 . GLU 65 65 rr_2m7y 1 . VAL 66 66 rr_2m7y 1 . VAL 67 67 rr_2m7y 1 . PHE 68 68 rr_2m7y 1 . GLU 69 69 rr_2m7y 1 . THR 70 70 rr_2m7y 1 . GLN 71 71 rr_2m7y 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Sf_framecode ZINC_ION _Entity.Entry_ID rr_2m7y _Entity.ID 2 _Entity.Name ZINC_ION _Entity.Type non-polymer _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_chirality yes _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Number_of_monomers 1 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Parent_entity_ID 2 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 . ZN . rr_2m7y 2 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID rr_2m7y _Chem_comp.ID ZN _Chem_comp.Name 'ZINC ION' _Chem_comp.Type non-polymer _Chem_comp.PDB_code ZN _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.38 save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID rr_2m7y _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 1 save_ ##################################### # Conformer family coordinate set # ##################################### 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_2m7y _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . rr_2m7y 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_2m7y 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 GLY C C 1.184 0.416 -2.419 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_2m7y 1 . 1 . 2 . 1 1 1 GLY CA C 2.073 0.000 -1.245 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_2m7y 1 . 1 . 3 . 1 1 1 GLY H1 H 1.884 0.000 0.829 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_2m7y 1 . 1 . 4 . 1 1 1 GLY HA2 H 2.919 0.683 -1.165 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_2m7y 1 . 1 . 5 . 1 1 1 GLY HA3 H 2.482 -0.994 -1.428 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_2m7y 1 . 1 . 6 . 1 1 1 GLY N N 1.325 0.000 0.000 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_2m7y 1 . 1 . 7 . 1 1 1 GLY O O 0.384 -0.379 -2.909 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_2m7y 1 . 1 . 8 . 1 1 2 SER C C -0.917 2.055 -3.647 . . . 1.0 . . . . . . . . . . . . A . 2 SER C . . . . . . . . . rr_2m7y 1 . 1 . 9 . 1 1 2 SER CA C 0.578 2.194 -3.943 . . . 1.0 . . . . . . . . . . . . A . 2 SER CA . . . . . . . . . rr_2m7y 1 . 1 . 10 . 1 1 2 SER CB C 0.928 1.484 -5.252 . . . 1.0 . . . . . . . . . . . . A . 2 SER CB . . . . . . . . . rr_2m7y 1 . 1 . 11 . 1 1 2 SER H H 2.008 2.303 -2.432 . . . 1.0 . . . . . . . . . . . . A . 2 SER H . . . . . . . . . rr_2m7y 1 . 1 . 12 . 1 1 2 SER HA H 0.858 3.245 -4.014 . . . 1.0 . . . . . . . . . . . . A . 2 SER HA . . . . . . . . . rr_2m7y 1 . 1 . 13 . 1 1 2 SER HB2 H 0.270 0.625 -5.387 . . . 1.0 . . . . . . . . . . . . A . 2 SER HB2 . . . . . . . . . rr_2m7y 1 . 1 . 14 . 1 1 2 SER HB3 H 0.747 2.158 -6.090 . . . 1.0 . . . . . . . . . . . . A . 2 SER HB3 . . . . . . . . . rr_2m7y 1 . 1 . 15 . 1 1 2 SER HG H 2.348 0.152 -5.716 . . . 1.0 . . . . . . . . . . . . A . 2 SER HG . . . . . . . . . rr_2m7y 1 . 1 . 16 . 1 1 2 SER N N 1.355 1.662 -2.836 . . . 1.0 . . . . . . . . . . . . A . 2 SER N . . . . . . . . . rr_2m7y 1 . 1 . 17 . 1 1 2 SER O O -1.618 1.299 -4.317 . . . 1.0 . . . . . . . . . . . . A . 2 SER O . . . . . . . . . rr_2m7y 1 . 1 . 18 . 1 1 2 SER OG O 2.285 1.049 -5.278 . . . 1.0 . . . . . . . . . . . . A . 2 SER OG . . . . . . . . . rr_2m7y 1 . 1 . 19 . 1 1 3 THR C C -3.526 3.909 -2.922 . . . 1.0 . . . . . . . . . . . . A . 3 THR C . . . . . . . . . rr_2m7y 1 . 1 . 20 . 1 1 3 THR CA C -2.759 2.768 -2.251 . . . 1.0 . . . . . . . . . . . . A . 3 THR CA . . . . . . . . . rr_2m7y 1 . 1 . 21 . 1 1 3 THR CB C -2.822 2.809 -0.723 . . . 1.0 . . . . . . . . . . . . A . 3 THR CB . . . . . . . . . rr_2m7y 1 . 1 . 22 . 1 1 3 THR CG2 C -4.026 3.600 -0.208 . . . 1.0 . . . . . . . . . . . . A . 3 THR CG2 . . . . . . . . . rr_2m7y 1 . 1 . 23 . 1 1 3 THR H H -0.783 3.411 -2.104 . . . 1.0 . . . . . . . . . . . . A . 3 THR H . . . . . . . . . rr_2m7y 1 . 1 . 24 . 1 1 3 THR HA H -3.196 1.835 -2.609 . . . 1.0 . . . . . . . . . . . . A . 3 THR HA . . . . . . . . . rr_2m7y 1 . 1 . 25 . 1 1 3 THR HB H -1.893 3.197 -0.306 . . . 1.0 . . . . . . . . . . . . A . 3 THR HB . . . . . . . . . rr_2m7y 1 . 1 . 26 . 1 1 3 THR HG1 H -3.353 1.421 0.617 . . . 1.0 . . . . . . . . . . . . A . 3 THR HG1 . . . . . . . . . rr_2m7y 1 . 1 . 27 . 1 1 3 THR HG21 H -3.757 4.652 -0.116 . . . 1.0 . . . . . . . . . . . . A . 3 THR HG21 . . . . . . . . . rr_2m7y 1 . 1 . 28 . 1 1 3 THR HG22 H -4.855 3.497 -0.908 . . . 1.0 . . . . . . . . . . . . A . 3 THR HG22 . . . . . . . . . rr_2m7y 1 . 1 . 29 . 1 1 3 THR HG23 H -4.324 3.215 0.767 . . . 1.0 . . . . . . . . . . . . A . 3 THR HG23 . . . . . . . . . rr_2m7y 1 . 1 . 30 . 1 1 3 THR N N -1.360 2.798 -2.644 . . . 1.0 . . . . . . . . . . . . A . 3 THR N . . . . . . . . . rr_2m7y 1 . 1 . 31 . 1 1 3 THR O O -4.413 3.669 -3.740 . . . 1.0 . . . . . . . . . . . . A . 3 THR O . . . . . . . . . rr_2m7y 1 . 1 . 32 . 1 1 3 THR OG1 O -3.107 1.463 -0.351 . . . 1.0 . . . . . . . . . . . . A . 3 THR OG1 . . . . . . . . . rr_2m7y 1 . 1 . 33 . 1 1 4 ALA C C -2.727 7.312 -3.531 . . . 1.0 . . . . . . . . . . . . A . 4 ALA C . . . . . . . . . rr_2m7y 1 . 1 . 34 . 1 1 4 ALA CA C -3.798 6.305 -3.107 . . . 1.0 . . . . . . . . . . . . A . 4 ALA CA . . . . . . . . . rr_2m7y 1 . 1 . 35 . 1 1 4 ALA CB C -4.773 6.887 -2.081 . . . 1.0 . . . . . . . . . . . . A . 4 ALA CB . . . . . . . . . rr_2m7y 1 . 1 . 36 . 1 1 4 ALA H H -2.434 5.312 -1.886 . . . 1.0 . . . . . . . . . . . . A . 4 ALA H . . . . . . . . . rr_2m7y 1 . 1 . 37 . 1 1 4 ALA HA H -4.361 5.993 -3.987 . . . 1.0 . . . . . . . . . . . . A . 4 ALA HA . . . . . . . . . rr_2m7y 1 . 1 . 38 . 1 1 4 ALA HB1 H -5.750 7.022 -2.544 . . . 1.0 . . . . . . . . . . . . A . 4 ALA HB1 . . . . . . . . . rr_2m7y 1 . 1 . 39 . 1 1 4 ALA HB2 H -4.862 6.204 -1.236 . . . 1.0 . . . . . . . . . . . . A . 4 ALA HB2 . . . . . . . . . rr_2m7y 1 . 1 . 40 . 1 1 4 ALA HB3 H -4.400 7.850 -1.732 . . . 1.0 . . . . . . . . . . . . A . 4 ALA HB3 . . . . . . . . . rr_2m7y 1 . 1 . 41 . 1 1 4 ALA N N -3.156 5.126 -2.551 . . . 1.0 . . . . . . . . . . . . A . 4 ALA N . . . . . . . . . rr_2m7y 1 . 1 . 42 . 1 1 4 ALA O O -2.879 8.513 -3.314 . . . 1.0 . . . . . . . . . . . . A . 4 ALA O . . . . . . . . . rr_2m7y 1 . 1 . 43 . 1 1 5 MET C C -0.586 7.762 -6.108 . . . 1.0 . . . . . . . . . . . . A . 5 MET C . . . . . . . . . rr_2m7y 1 . 1 . 44 . 1 1 5 MET CA C -0.572 7.623 -4.584 . . . 1.0 . . . . . . . . . . . . A . 5 MET CA . . . . . . . . . rr_2m7y 1 . 1 . 45 . 1 1 5 MET CB C 0.758 7.011 -4.139 . . . 1.0 . . . . . . . . . . . . A . 5 MET CB . . . . . . . . . rr_2m7y 1 . 1 . 46 . 1 1 5 MET CE C 2.703 6.907 -0.831 . . . 1.0 . . . . . . . . . . . . A . 5 MET CE . . . . . . . . . rr_2m7y 1 . 1 . 47 . 1 1 5 MET CG C 0.703 6.590 -2.669 . . . 1.0 . . . . . . . . . . . . A . 5 MET CG . . . . . . . . . rr_2m7y 1 . 1 . 48 . 1 1 5 MET H H -1.553 5.807 -4.301 . . . 1.0 . . . . . . . . . . . . A . 5 MET H . . . . . . . . . rr_2m7y 1 . 1 . 49 . 1 1 5 MET HA H -0.736 8.596 -4.122 . . . 1.0 . . . . . . . . . . . . A . 5 MET HA . . . . . . . . . rr_2m7y 1 . 1 . 50 . 1 1 5 MET HB2 H 0.990 6.146 -4.761 . . . 1.0 . . . . . . . . . . . . A . 5 MET HB2 . . . . . . . . . rr_2m7y 1 . 1 . 51 . 1 1 5 MET HB3 H 1.561 7.733 -4.285 . . . 1.0 . . . . . . . . . . . . A . 5 MET HB3 . . . . . . . . . rr_2m7y 1 . 1 . 52 . 1 1 5 MET HE1 H 3.260 7.763 -1.210 . . . 1.0 . . . . . . . . . . . . A . 5 MET HE1 . . . . . . . . . rr_2m7y 1 . 1 . 53 . 1 1 5 MET HE2 H 1.801 7.255 -0.327 . . . 1.0 . . . . . . . . . . . . A . 5 MET HE2 . . . . . . . . . rr_2m7y 1 . 1 . 54 . 1 1 5 MET HE3 H 3.322 6.353 -0.126 . . . 1.0 . . . . . . . . . . . . A . 5 MET HE3 . . . . . . . . . rr_2m7y 1 . 1 . 55 . 1 1 5 MET HG2 H 0.499 7.457 -2.041 . . . 1.0 . . . . . . . . . . . . A . 5 MET HG2 . . . . . . . . . rr_2m7y 1 . 1 . 56 . 1 1 5 MET HG3 H -0.114 5.885 -2.514 . . . 1.0 . . . . . . . . . . . . A . 5 MET HG3 . . . . . . . . . rr_2m7y 1 . 1 . 57 . 1 1 5 MET N N -1.668 6.785 -4.128 . . . 1.0 . . . . . . . . . . . . A . 5 MET N . . . . . . . . . rr_2m7y 1 . 1 . 58 . 1 1 5 MET O O -1.186 6.945 -6.804 . . . 1.0 . . . . . . . . . . . . A . 5 MET O . . . . . . . . . rr_2m7y 1 . 1 . 59 . 1 1 5 MET SD S 2.251 5.842 -2.191 . . . 1.0 . . . . . . . . . . . . A . 5 MET SD . . . . . . . . . rr_2m7y 1 . 1 . 60 . 1 1 6 ALA C C 0.717 10.465 -8.242 . . . 1.0 . . . . . . . . . . . . A . 6 ALA C . . . . . . . . . rr_2m7y 1 . 1 . 61 . 1 1 6 ALA CA C 0.154 9.061 -8.009 . . . 1.0 . . . . . . . . . . . . A . 6 ALA CA . . . . . . . . . rr_2m7y 1 . 1 . 62 . 1 1 6 ALA CB C -1.231 8.877 -8.632 . . . 1.0 . . . . . . . . . . . . A . 6 ALA CB . . . . . . . . . rr_2m7y 1 . 1 . 63 . 1 1 6 ALA H H 0.567 9.464 -6.007 . . . 1.0 . . . . . . . . . . . . A . 6 ALA H . . . . . . . . . rr_2m7y 1 . 1 . 64 . 1 1 6 ALA HA H 0.834 8.329 -8.444 . . . 1.0 . . . . . . . . . . . . A . 6 ALA HA . . . . . . . . . rr_2m7y 1 . 1 . 65 . 1 1 6 ALA HB1 H -1.413 9.673 -9.354 . . . 1.0 . . . . . . . . . . . . A . 6 ALA HB1 . . . . . . . . . rr_2m7y 1 . 1 . 66 . 1 1 6 ALA HB2 H -1.278 7.911 -9.135 . . . 1.0 . . . . . . . . . . . . A . 6 ALA HB2 . . . . . . . . . rr_2m7y 1 . 1 . 67 . 1 1 6 ALA HB3 H -1.989 8.917 -7.849 . . . 1.0 . . . . . . . . . . . . A . 6 ALA HB3 . . . . . . . . . rr_2m7y 1 . 1 . 68 . 1 1 6 ALA N N 0.082 8.804 -6.581 . . . 1.0 . . . . . . . . . . . . A . 6 ALA N . . . . . . . . . rr_2m7y 1 . 1 . 69 . 1 1 6 ALA O O 1.416 10.701 -9.226 . . . 1.0 . . . . . . . . . . . . A . 6 ALA O . . . . . . . . . rr_2m7y 1 . 1 . 70 . 1 1 7 THR C C 2.300 12.775 -7.913 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . rr_2m7y 1 . 1 . 71 . 1 1 7 THR CA C 0.854 12.733 -7.414 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . rr_2m7y 1 . 1 . 72 . 1 1 7 THR CB C 0.663 13.390 -6.046 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . rr_2m7y 1 . 1 . 73 . 1 1 7 THR CG2 C 0.945 12.428 -4.890 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . rr_2m7y 1 . 1 . 74 . 1 1 7 THR H H -0.180 11.159 -6.524 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . rr_2m7y 1 . 1 . 75 . 1 1 7 THR HA H 0.245 13.252 -8.155 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . rr_2m7y 1 . 1 . 76 . 1 1 7 THR HB H -0.333 13.824 -5.958 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . rr_2m7y 1 . 1 . 77 . 1 1 7 THR HG1 H 1.372 15.256 -6.190 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG1 . . . . . . . . . rr_2m7y 1 . 1 . 78 . 1 1 7 THR HG21 H 1.428 11.530 -5.275 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . rr_2m7y 1 . 1 . 79 . 1 1 7 THR HG22 H 1.601 12.912 -4.167 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . rr_2m7y 1 . 1 . 80 . 1 1 7 THR HG23 H 0.007 12.157 -4.406 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . rr_2m7y 1 . 1 . 81 . 1 1 7 THR N N 0.390 11.359 -7.321 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . rr_2m7y 1 . 1 . 82 . 1 1 7 THR O O 2.544 12.946 -9.106 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . rr_2m7y 1 . 1 . 83 . 1 1 7 THR OG1 O 1.719 14.344 -5.969 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . rr_2m7y 1 . 1 . 84 . 1 1 8 THR C C 5.390 11.600 -6.464 . . . 1.0 . . . . . . . . . . . . A . 8 THR C . . . . . . . . . rr_2m7y 1 . 1 . 85 . 1 1 8 THR CA C 4.636 12.634 -7.302 . . . 1.0 . . . . . . . . . . . . A . 8 THR CA . . . . . . . . . rr_2m7y 1 . 1 . 86 . 1 1 8 THR CB C 5.148 14.063 -7.109 . . . 1.0 . . . . . . . . . . . . A . 8 THR CB . . . . . . . . . rr_2m7y 1 . 1 . 87 . 1 1 8 THR CG2 C 4.370 14.824 -6.033 . . . 1.0 . . . . . . . . . . . . A . 8 THR CG2 . . . . . . . . . rr_2m7y 1 . 1 . 88 . 1 1 8 THR H H 3.013 12.478 -6.005 . . . 1.0 . . . . . . . . . . . . A . 8 THR H . . . . . . . . . rr_2m7y 1 . 1 . 89 . 1 1 8 THR HA H 4.749 12.345 -8.346 . . . 1.0 . . . . . . . . . . . . A . 8 THR HA . . . . . . . . . rr_2m7y 1 . 1 . 90 . 1 1 8 THR HB H 5.143 14.609 -8.052 . . . 1.0 . . . . . . . . . . . . A . 8 THR HB . . . . . . . . . rr_2m7y 1 . 1 . 91 . 1 1 8 THR HG1 H 6.390 13.924 -5.546 . . . 1.0 . . . . . . . . . . . . A . 8 THR HG1 . . . . . . . . . rr_2m7y 1 . 1 . 92 . 1 1 8 THR HG21 H 5.055 15.455 -5.468 . . . 1.0 . . . . . . . . . . . . A . 8 THR HG21 . . . . . . . . . rr_2m7y 1 . 1 . 93 . 1 1 8 THR HG22 H 3.609 15.445 -6.506 . . . 1.0 . . . . . . . . . . . . A . 8 THR HG22 . . . . . . . . . rr_2m7y 1 . 1 . 94 . 1 1 8 THR HG23 H 3.891 14.113 -5.360 . . . 1.0 . . . . . . . . . . . . A . 8 THR HG23 . . . . . . . . . rr_2m7y 1 . 1 . 95 . 1 1 8 THR N N 3.220 12.617 -6.973 . . . 1.0 . . . . . . . . . . . . A . 8 THR N . . . . . . . . . rr_2m7y 1 . 1 . 96 . 1 1 8 THR O O 5.862 10.594 -6.992 . . . 1.0 . . . . . . . . . . . . A . 8 THR O . . . . . . . . . rr_2m7y 1 . 1 . 97 . 1 1 8 THR OG1 O 6.445 13.893 -6.544 . . . 1.0 . . . . . . . . . . . . A . 8 THR OG1 . . . . . . . . . rr_2m7y 1 . 1 . 98 . 1 1 9 MET C C 5.398 9.681 -4.083 . . . 1.0 . . . . . . . . . . . . A . 9 MET C . . . . . . . . . rr_2m7y 1 . 1 . 99 . 1 1 9 MET CA C 6.170 10.990 -4.257 . . . 1.0 . . . . . . . . . . . . A . 9 MET CA . . . . . . . . . rr_2m7y 1 . 1 . 100 . 1 1 9 MET CB C 6.329 11.674 -2.898 . . . 1.0 . . . . . . . . . . . . A . 9 MET CB . . . . . . . . . rr_2m7y 1 . 1 . 101 . 1 1 9 MET CE C 7.321 15.641 -3.367 . . . 1.0 . . . . . . . . . . . . A . 9 MET CE . . . . . . . . . rr_2m7y 1 . 1 . 102 . 1 1 9 MET CG C 7.193 12.932 -3.015 . . . 1.0 . . . . . . . . . . . . A . 9 MET CG . . . . . . . . . rr_2m7y 1 . 1 . 103 . 1 1 9 MET H H 5.094 12.703 -4.752 . . . 1.0 . . . . . . . . . . . . A . 9 MET H . . . . . . . . . rr_2m7y 1 . 1 . 104 . 1 1 9 MET HA H 7.138 10.790 -4.717 . . . 1.0 . . . . . . . . . . . . A . 9 MET HA . . . . . . . . . rr_2m7y 1 . 1 . 105 . 1 1 9 MET HB2 H 5.347 11.938 -2.504 . . . 1.0 . . . . . . . . . . . . A . 9 MET HB2 . . . . . . . . . rr_2m7y 1 . 1 . 106 . 1 1 9 MET HB3 H 6.782 10.982 -2.189 . . . 1.0 . . . . . . . . . . . . A . 9 MET HB3 . . . . . . . . . rr_2m7y 1 . 1 . 107 . 1 1 9 MET HE1 H 8.341 15.345 -3.119 . . . 1.0 . . . . . . . . . . . . A . 9 MET HE1 . . . . . . . . . rr_2m7y 1 . 1 . 108 . 1 1 9 MET HE2 H 7.228 15.753 -4.447 . . . 1.0 . . . . . . . . . . . . A . 9 MET HE2 . . . . . . . . . rr_2m7y 1 . 1 . 109 . 1 1 9 MET HE3 H 7.090 16.589 -2.882 . . . 1.0 . . . . . . . . . . . . A . 9 MET HE3 . . . . . . . . . rr_2m7y 1 . 1 . 110 . 1 1 9 MET HG2 H 7.983 12.911 -2.264 . . . 1.0 . . . . . . . . . . . . A . 9 MET HG2 . . . . . . . . . rr_2m7y 1 . 1 . 111 . 1 1 9 MET HG3 H 7.680 12.959 -3.990 . . . 1.0 . . . . . . . . . . . . A . 9 MET HG3 . . . . . . . . . rr_2m7y 1 . 1 . 112 . 1 1 9 MET N N 5.481 11.883 -5.173 . . . 1.0 . . . . . . . . . . . . A . 9 MET N . . . . . . . . . rr_2m7y 1 . 1 . 113 . 1 1 9 MET O O 4.175 9.690 -3.947 . . . 1.0 . . . . . . . . . . . . A . 9 MET O . . . . . . . . . rr_2m7y 1 . 1 . 114 . 1 1 9 MET SD S 6.184 14.388 -2.798 . . . 1.0 . . . . . . . . . . . . A . 9 MET SD . . . . . . . . . rr_2m7y 1 . 1 . 115 . 1 1 10 GLU C C 6.303 6.463 -2.882 . . . 1.0 . . . . . . . . . . . . A . 10 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 116 . 1 1 10 GLU CA C 5.544 7.271 -3.937 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 117 . 1 1 10 GLU CB C 5.501 6.526 -5.272 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 118 . 1 1 10 GLU CD C 3.950 4.901 -6.419 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 119 . 1 1 10 GLU CG C 4.058 6.247 -5.698 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 120 . 1 1 10 GLU H H 7.137 8.586 -4.203 . . . 1.0 . . . . . . . . . . . . A . 10 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 121 . 1 1 10 GLU HA H 4.524 7.456 -3.598 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 122 . 1 1 10 GLU HB2 H 6.002 7.117 -6.039 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 123 . 1 1 10 GLU HB3 H 6.047 5.587 -5.187 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 124 . 1 1 10 GLU HE2 H 4.277 3.626 -5.072 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 125 . 1 1 10 GLU HG2 H 3.410 6.247 -4.822 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 126 . 1 1 10 GLU HG3 H 3.708 7.044 -6.355 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 127 . 1 1 10 GLU N N 6.143 8.585 -4.092 . . . 1.0 . . . . . . . . . . . . A . 10 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 128 . 1 1 10 GLU O O 6.223 5.235 -2.860 . . . 1.0 . . . . . . . . . . . . A . 10 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 129 . 1 1 10 GLU OE1 O 3.202 4.782 -7.400 . . . 1.0 . . . . . . . . . . . . A . 10 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 130 . 1 1 10 GLU OE2 O 4.679 3.958 -5.925 . . . 1.0 . . . . . . . . . . . . A . 10 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 131 . 1 1 11 GLN C C 7.455 7.171 0.375 . . . 1.0 . . . . . . . . . . . . A . 11 GLN C . . . . . . . . . rr_2m7y 1 . 1 . 132 . 1 1 11 GLN CA C 7.795 6.549 -0.981 . . . 1.0 . . . . . . . . . . . . A . 11 GLN CA . . . . . . . . . rr_2m7y 1 . 1 . 133 . 1 1 11 GLN CB C 9.295 6.645 -1.267 . . . 1.0 . . . . . . . . . . . . A . 11 GLN CB . . . . . . . . . rr_2m7y 1 . 1 . 134 . 1 1 11 GLN CD C 11.265 5.083 -1.460 . . . 1.0 . . . . . . . . . . . . A . 11 GLN CD . . . . . . . . . rr_2m7y 1 . 1 . 135 . 1 1 11 GLN CG C 9.820 5.348 -1.886 . . . 1.0 . . . . . . . . . . . . A . 11 GLN CG . . . . . . . . . rr_2m7y 1 . 1 . 136 . 1 1 11 GLN H H 7.082 8.182 -2.061 . . . 1.0 . . . . . . . . . . . . A . 11 GLN H . . . . . . . . . rr_2m7y 1 . 1 . 137 . 1 1 11 GLN HA H 7.496 5.501 -0.993 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HA . . . . . . . . . rr_2m7y 1 . 1 . 138 . 1 1 11 GLN HB2 H 9.487 7.478 -1.943 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HB2 . . . . . . . . . rr_2m7y 1 . 1 . 139 . 1 1 11 GLN HB3 H 9.833 6.855 -0.342 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HB3 . . . . . . . . . rr_2m7y 1 . 1 . 140 . 1 1 11 GLN HE21 H 11.853 6.576 -2.694 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HE21 . . . . . . . . . rr_2m7y 1 . 1 . 141 . 1 1 11 GLN HE22 H 13.128 5.785 -1.829 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HE22 . . . . . . . . . rr_2m7y 1 . 1 . 142 . 1 1 11 GLN HG2 H 9.188 4.514 -1.580 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HG2 . . . . . . . . . rr_2m7y 1 . 1 . 143 . 1 1 11 GLN HG3 H 9.762 5.410 -2.972 . . . 1.0 . . . . . . . . . . . . A . 11 GLN HG3 . . . . . . . . . rr_2m7y 1 . 1 . 144 . 1 1 11 GLN N N 7.022 7.184 -2.035 . . . 1.0 . . . . . . . . . . . . A . 11 GLN N . . . . . . . . . rr_2m7y 1 . 1 . 145 . 1 1 11 GLN NE2 N 12.156 5.881 -2.043 . . . 1.0 . . . . . . . . . . . . A . 11 GLN NE2 . . . . . . . . . rr_2m7y 1 . 1 . 146 . 1 1 11 GLN O O 8.108 6.881 1.376 . . . 1.0 . . . . . . . . . . . . A . 11 GLN O . . . . . . . . . rr_2m7y 1 . 1 . 147 . 1 1 11 GLN OE1 O 11.553 4.212 -0.656 . . . 1.0 . . . . . . . . . . . . A . 11 GLN OE1 . . . . . . . . . rr_2m7y 1 . 1 . 148 . 1 1 12 GLU C C 5.691 7.647 2.668 . . . 1.0 . . . . . . . . . . . . A . 12 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 149 . 1 1 12 GLU CA C 5.997 8.678 1.580 . . . 1.0 . . . . . . . . . . . . A . 12 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 150 . 1 1 12 GLU CB C 4.783 9.571 1.313 . . . 1.0 . . . . . . . . . . . . A . 12 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 151 . 1 1 12 GLU CD C 5.243 12.010 0.867 . . . 1.0 . . . . . . . . . . . . A . 12 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 152 . 1 1 12 GLU CG C 5.098 10.620 0.244 . . . 1.0 . . . . . . . . . . . . A . 12 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 153 . 1 1 12 GLU H H 5.906 8.243 -0.455 . . . 1.0 . . . . . . . . . . . . A . 12 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 154 . 1 1 12 GLU HA H 6.838 9.301 1.886 . . . 1.0 . . . . . . . . . . . . A . 12 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 155 . 1 1 12 GLU HB2 H 3.942 8.958 0.989 . . . 1.0 . . . . . . . . . . . . A . 12 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 156 . 1 1 12 GLU HB3 H 4.481 10.066 2.236 . . . 1.0 . . . . . . . . . . . . A . 12 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 157 . 1 1 12 GLU HE2 H 3.974 13.340 1.275 . . . 1.0 . . . . . . . . . . . . A . 12 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 158 . 1 1 12 GLU HG2 H 6.019 10.352 -0.273 . . . 1.0 . . . . . . . . . . . . A . 12 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 159 . 1 1 12 GLU HG3 H 4.305 10.632 -0.503 . . . 1.0 . . . . . . . . . . . . A . 12 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 160 . 1 1 12 GLU N N 6.432 8.013 0.363 . . . 1.0 . . . . . . . . . . . . A . 12 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 161 . 1 1 12 GLU O O 5.619 7.988 3.848 . . . 1.0 . . . . . . . . . . . . A . 12 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 162 . 1 1 12 GLU OE1 O 6.155 12.235 1.675 . . . 1.0 . . . . . . . . . . . . A . 12 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 163 . 1 1 12 GLU OE2 O 4.365 12.873 0.482 . . . 1.0 . . . . . . . . . . . . A . 12 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 164 . 1 1 13 ILE C C 5.935 4.054 2.689 . . . 1.0 . . . . . . . . . . . . A . 13 ILE C . . . . . . . . . rr_2m7y 1 . 1 . 165 . 1 1 13 ILE CA C 5.223 5.325 3.155 . . . 1.0 . . . . . . . . . . . . A . 13 ILE CA . . . . . . . . . rr_2m7y 1 . 1 . 166 . 1 1 13 ILE CB C 3.710 5.158 3.316 . . . 1.0 . . . . . . . . . . . . A . 13 ILE CB . . . . . . . . . rr_2m7y 1 . 1 . 167 . 1 1 13 ILE CD1 C 3.257 7.259 4.635 . . . 1.0 . . . . . . . . . . . . A . 13 ILE CD1 . . . . . . . . . rr_2m7y 1 . 1 . 168 . 1 1 13 ILE CG1 C 3.006 6.516 3.322 . . . 1.0 . . . . . . . . . . . . A . 13 ILE CG1 . . . . . . . . . rr_2m7y 1 . 1 . 169 . 1 1 13 ILE CG2 C 3.379 4.336 4.564 . . . 1.0 . . . . . . . . . . . . A . 13 ILE CG2 . . . . . . . . . rr_2m7y 1 . 1 . 170 . 1 1 13 ILE H H 5.580 6.139 1.271 . . . 1.0 . . . . . . . . . . . . A . 13 ILE H . . . . . . . . . rr_2m7y 1 . 1 . 171 . 1 1 13 ILE HA H 5.621 5.607 4.129 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HA . . . . . . . . . rr_2m7y 1 . 1 . 172 . 1 1 13 ILE HB H 3.334 4.604 2.457 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HB . . . . . . . . . rr_2m7y 1 . 1 . 173 . 1 1 13 ILE HD11 H 3.442 8.313 4.427 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HD11 . . . . . . . . . rr_2m7y 1 . 1 . 174 . 1 1 13 ILE HD12 H 2.383 7.164 5.280 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HD12 . . . . . . . . . rr_2m7y 1 . 1 . 175 . 1 1 13 ILE HD13 H 4.126 6.830 5.135 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HD13 . . . . . . . . . rr_2m7y 1 . 1 . 176 . 1 1 13 ILE HG12 H 3.363 7.118 2.486 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HG12 . . . . . . . . . rr_2m7y 1 . 1 . 177 . 1 1 13 ILE HG13 H 1.935 6.375 3.178 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HG13 . . . . . . . . . rr_2m7y 1 . 1 . 178 . 1 1 13 ILE HG21 H 3.521 4.951 5.452 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HG21 . . . . . . . . . rr_2m7y 1 . 1 . 179 . 1 1 13 ILE HG22 H 2.343 4.002 4.514 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HG22 . . . . . . . . . rr_2m7y 1 . 1 . 180 . 1 1 13 ILE HG23 H 4.039 3.470 4.613 . . . 1.0 . . . . . . . . . . . . A . 13 ILE HG23 . . . . . . . . . rr_2m7y 1 . 1 . 181 . 1 1 13 ILE N N 5.519 6.408 2.233 . . . 1.0 . . . . . . . . . . . . A . 13 ILE N . . . . . . . . . rr_2m7y 1 . 1 . 182 . 1 1 13 ILE O O 5.644 3.534 1.613 . . . 1.0 . . . . . . . . . . . . A . 13 ILE O . . . . . . . . . rr_2m7y 1 . 1 . 183 . 1 1 14 CYS C C 6.629 1.227 3.064 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_2m7y 1 . 1 . 184 . 1 1 14 CYS CA C 7.612 2.390 3.208 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_2m7y 1 . 1 . 185 . 1 1 14 CYS CB C 8.684 2.106 4.262 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_2m7y 1 . 1 . 186 . 1 1 14 CYS H H 7.087 4.020 4.394 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_2m7y 1 . 1 . 187 . 1 1 14 CYS HA H 8.126 2.581 2.266 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_2m7y 1 . 1 . 188 . 1 1 14 CYS HB2 H 8.572 2.792 5.101 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_2m7y 1 . 1 . 189 . 1 1 14 CYS HB3 H 8.559 1.097 4.657 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_2m7y 1 . 1 . 190 . 1 1 14 CYS N N 6.856 3.591 3.521 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_2m7y 1 . 1 . 191 . 1 1 14 CYS O O 5.464 1.344 3.439 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_2m7y 1 . 1 . 192 . 1 1 14 CYS SG S 10.350 2.286 3.526 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_2m7y 1 . 1 . 193 . 1 1 15 ALA C C 5.974 -1.665 3.684 . . . 1.0 . . . . . . . . . . . . A . 15 ALA C . . . . . . . . . rr_2m7y 1 . 1 . 194 . 1 1 15 ALA CA C 6.317 -1.054 2.324 . . . 1.0 . . . . . . . . . . . . A . 15 ALA CA . . . . . . . . . rr_2m7y 1 . 1 . 195 . 1 1 15 ALA CB C 7.054 -2.038 1.413 . . . 1.0 . . . . . . . . . . . . A . 15 ALA CB . . . . . . . . . rr_2m7y 1 . 1 . 196 . 1 1 15 ALA H H 8.085 0.042 2.220 . . . 1.0 . . . . . . . . . . . . A . 15 ALA H . . . . . . . . . rr_2m7y 1 . 1 . 197 . 1 1 15 ALA HA H 5.396 -0.743 1.832 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HA . . . . . . . . . rr_2m7y 1 . 1 . 198 . 1 1 15 ALA HB1 H 7.808 -1.504 0.835 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HB1 . . . . . . . . . rr_2m7y 1 . 1 . 199 . 1 1 15 ALA HB2 H 7.536 -2.805 2.020 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HB2 . . . . . . . . . rr_2m7y 1 . 1 . 200 . 1 1 15 ALA HB3 H 6.342 -2.508 0.734 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HB3 . . . . . . . . . rr_2m7y 1 . 1 . 201 . 1 1 15 ALA N N 7.136 0.130 2.521 . . . 1.0 . . . . . . . . . . . . A . 15 ALA N . . . . . . . . . rr_2m7y 1 . 1 . 202 . 1 1 15 ALA O O 5.236 -2.645 3.760 . . . 1.0 . . . . . . . . . . . . A . 15 ALA O . . . . . . . . . rr_2m7y 1 . 1 . 203 . 1 1 16 HIS C C 5.026 -0.870 6.637 . . . 1.0 . . . . . . . . . . . . A . 16 HIS C . . . . . . . . . rr_2m7y 1 . 1 . 204 . 1 1 16 HIS CA C 6.288 -1.530 6.079 . . . 1.0 . . . . . . . . . . . . A . 16 HIS CA . . . . . . . . . rr_2m7y 1 . 1 . 205 . 1 1 16 HIS CB C 7.518 -1.299 6.959 . . . 1.0 . . . . . . . . . . . . A . 16 HIS CB . . . . . . . . . rr_2m7y 1 . 1 . 206 . 1 1 16 HIS CD2 C 9.676 0.119 6.557 . . . 1.0 . . . . . . . . . . . . A . 16 HIS CD2 . . . . . . . . . rr_2m7y 1 . 1 . 207 . 1 1 16 HIS CE1 C 10.160 -0.611 4.552 . . . 1.0 . . . . . . . . . . . . A . 16 HIS CE1 . . . . . . . . . rr_2m7y 1 . 1 . 208 . 1 1 16 HIS CG C 8.726 -0.794 6.207 . . . 1.0 . . . . . . . . . . . . A . 16 HIS CG . . . . . . . . . rr_2m7y 1 . 1 . 209 . 1 1 16 HIS H H 7.126 -0.261 4.655 . . . 1.0 . . . . . . . . . . . . A . 16 HIS H . . . . . . . . . rr_2m7y 1 . 1 . 210 . 1 1 16 HIS HA H 6.125 -2.606 6.011 . . . 1.0 . . . . . . . . . . . . A . 16 HIS HA . . . . . . . . . rr_2m7y 1 . 1 . 211 . 1 1 16 HIS HB2 H 7.263 -0.582 7.740 . . . 1.0 . . . . . . . . . . . . A . 16 HIS HB2 . . . . . . . . . rr_2m7y 1 . 1 . 212 . 1 1 16 HIS HB3 H 7.777 -2.233 7.457 . . . 1.0 . . . . . . . . . . . . A . 16 HIS HB3 . . . . . . . . . rr_2m7y 1 . 1 . 213 . 1 1 16 HIS HD1 H 8.550 -1.913 4.403 . . . 1.0 . . . . . . . . . . . . A . 16 HIS HD1 . . . . . . . . . rr_2m7y 1 . 1 . 214 . 1 1 16 HIS HD2 H 9.718 0.667 7.498 . . . 1.0 . . . . . . . . . . . . A . 16 HIS HD2 . . . . . . . . . rr_2m7y 1 . 1 . 215 . 1 1 16 HIS HE1 H 10.671 -0.744 3.598 . . . 1.0 . . . . . . . . . . . . A . 16 HIS HE1 . . . . . . . . . rr_2m7y 1 . 1 . 216 . 1 1 16 HIS N N 6.526 -1.059 4.725 . . . 1.0 . . . . . . . . . . . . A . 16 HIS N . . . . . . . . . rr_2m7y 1 . 1 . 217 . 1 1 16 HIS ND1 N 9.057 -1.236 4.938 . . . 1.0 . . . . . . . . . . . . A . 16 HIS ND1 . . . . . . . . . rr_2m7y 1 . 1 . 218 . 1 1 16 HIS NE2 N 10.542 0.228 5.557 . . . 1.0 . . . . . . . . . . . . A . 16 HIS NE2 . . . . . . . . . rr_2m7y 1 . 1 . 219 . 1 1 16 HIS O O 4.928 -0.627 7.839 . . . 1.0 . . . . . . . . . . . . A . 16 HIS O . . . . . . . . . rr_2m7y 1 . 1 . 220 . 1 1 17 SER C C 3.110 1.172 7.109 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . rr_2m7y 1 . 1 . 221 . 1 1 17 SER CA C 2.840 0.030 6.126 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . rr_2m7y 1 . 1 . 222 . 1 1 17 SER CB C 1.882 -0.989 6.746 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . rr_2m7y 1 . 1 . 223 . 1 1 17 SER H H 4.179 -0.798 4.763 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . rr_2m7y 1 . 1 . 224 . 1 1 17 SER HA H 2.411 0.415 5.201 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . rr_2m7y 1 . 1 . 225 . 1 1 17 SER HB2 H 2.258 -1.996 6.566 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . rr_2m7y 1 . 1 . 226 . 1 1 17 SER HB3 H 1.852 -0.848 7.826 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . rr_2m7y 1 . 1 . 227 . 1 1 17 SER HG H 0.474 -1.438 5.397 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . rr_2m7y 1 . 1 . 228 . 1 1 17 SER N N 4.092 -0.597 5.738 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . rr_2m7y 1 . 1 . 229 . 1 1 17 SER O O 2.516 1.222 8.185 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . rr_2m7y 1 . 1 . 230 . 1 1 17 SER OG O 0.564 -0.873 6.217 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . rr_2m7y 1 . 1 . 231 . 1 1 18 MET C C 5.328 4.130 6.804 . . . 1.0 . . . . . . . . . . . . A . 18 MET C . . . . . . . . . rr_2m7y 1 . 1 . 232 . 1 1 18 MET CA C 4.361 3.197 7.535 . . . 1.0 . . . . . . . . . . . . A . 18 MET CA . . . . . . . . . rr_2m7y 1 . 1 . 233 . 1 1 18 MET CB C 5.009 2.701 8.829 . . . 1.0 . . . . . . . . . . . . A . 18 MET CB . . . . . . . . . rr_2m7y 1 . 1 . 234 . 1 1 18 MET CE C 4.375 3.201 12.769 . . . 1.0 . . . . . . . . . . . . A . 18 MET CE . . . . . . . . . rr_2m7y 1 . 1 . 235 . 1 1 18 MET CG C 4.160 3.073 10.046 . . . 1.0 . . . . . . . . . . . . A . 18 MET CG . . . . . . . . . rr_2m7y 1 . 1 . 236 . 1 1 18 MET H H 4.484 2.011 5.827 . . . 1.0 . . . . . . . . . . . . A . 18 MET H . . . . . . . . . rr_2m7y 1 . 1 . 237 . 1 1 18 MET HA H 3.424 3.718 7.735 . . . 1.0 . . . . . . . . . . . . A . 18 MET HA . . . . . . . . . rr_2m7y 1 . 1 . 238 . 1 1 18 MET HB2 H 5.134 1.619 8.786 . . . 1.0 . . . . . . . . . . . . A . 18 MET HB2 . . . . . . . . . rr_2m7y 1 . 1 . 239 . 1 1 18 MET HB3 H 6.005 3.133 8.930 . . . 1.0 . . . . . . . . . . . . A . 18 MET HB3 . . . . . . . . . rr_2m7y 1 . 1 . 240 . 1 1 18 MET HE1 H 3.825 2.292 12.526 . . . 1.0 . . . . . . . . . . . . A . 18 MET HE1 . . . . . . . . . rr_2m7y 1 . 1 . 241 . 1 1 18 MET HE2 H 5.121 2.982 13.533 . . . 1.0 . . . . . . . . . . . . A . 18 MET HE2 . . . . . . . . . rr_2m7y 1 . 1 . 242 . 1 1 18 MET HE3 H 3.682 3.955 13.144 . . . 1.0 . . . . . . . . . . . . A . 18 MET HE3 . . . . . . . . . rr_2m7y 1 . 1 . 243 . 1 1 18 MET HG2 H 3.372 3.767 9.752 . . . 1.0 . . . . . . . . . . . . A . 18 MET HG2 . . . . . . . . . rr_2m7y 1 . 1 . 244 . 1 1 18 MET HG3 H 3.669 2.185 10.443 . . . 1.0 . . . . . . . . . . . . A . 18 MET HG3 . . . . . . . . . rr_2m7y 1 . 1 . 245 . 1 1 18 MET N N 4.005 2.060 6.704 . . . 1.0 . . . . . . . . . . . . A . 18 MET N . . . . . . . . . rr_2m7y 1 . 1 . 246 . 1 1 18 MET O O 5.889 3.764 5.772 . . . 1.0 . . . . . . . . . . . . A . 18 MET O . . . . . . . . . rr_2m7y 1 . 1 . 247 . 1 1 18 MET SD S 5.186 3.816 11.303 . . . 1.0 . . . . . . . . . . . . A . 18 MET SD . . . . . . . . . rr_2m7y 1 . 1 . 248 . 1 1 19 THR C C 7.768 5.699 6.538 . . . 1.0 . . . . . . . . . . . . A . 19 THR C . . . . . . . . . rr_2m7y 1 . 1 . 249 . 1 1 19 THR CA C 6.385 6.305 6.782 . . . 1.0 . . . . . . . . . . . . A . 19 THR CA . . . . . . . . . rr_2m7y 1 . 1 . 250 . 1 1 19 THR CB C 6.410 7.525 7.706 . . . 1.0 . . . . . . . . . . . . A . 19 THR CB . . . . . . . . . rr_2m7y 1 . 1 . 251 . 1 1 19 THR CG2 C 7.704 8.331 7.576 . . . 1.0 . . . . . . . . . . . . A . 19 THR CG2 . . . . . . . . . rr_2m7y 1 . 1 . 252 . 1 1 19 THR H H 5.035 5.607 8.207 . . . 1.0 . . . . . . . . . . . . A . 19 THR H . . . . . . . . . rr_2m7y 1 . 1 . 253 . 1 1 19 THR HA H 5.986 6.594 5.810 . . . 1.0 . . . . . . . . . . . . A . 19 THR HA . . . . . . . . . rr_2m7y 1 . 1 . 254 . 1 1 19 THR HB H 6.236 7.233 8.741 . . . 1.0 . . . . . . . . . . . . A . 19 THR HB . . . . . . . . . rr_2m7y 1 . 1 . 255 . 1 1 19 THR HG1 H 4.740 8.613 7.878 . . . 1.0 . . . . . . . . . . . . A . 19 THR HG1 . . . . . . . . . rr_2m7y 1 . 1 . 256 . 1 1 19 THR HG21 H 7.750 9.075 8.371 . . . 1.0 . . . . . . . . . . . . A . 19 THR HG21 . . . . . . . . . rr_2m7y 1 . 1 . 257 . 1 1 19 THR HG22 H 8.560 7.660 7.656 . . . 1.0 . . . . . . . . . . . . A . 19 THR HG22 . . . . . . . . . rr_2m7y 1 . 1 . 258 . 1 1 19 THR HG23 H 7.725 8.832 6.608 . . . 1.0 . . . . . . . . . . . . A . 19 THR HG23 . . . . . . . . . rr_2m7y 1 . 1 . 259 . 1 1 19 THR N N 5.495 5.317 7.368 . . . 1.0 . . . . . . . . . . . . A . 19 THR N . . . . . . . . . rr_2m7y 1 . 1 . 260 . 1 1 19 THR O O 8.272 4.940 7.365 . . . 1.0 . . . . . . . . . . . . A . 19 THR O . . . . . . . . . rr_2m7y 1 . 1 . 261 . 1 1 19 THR OG1 O 5.410 8.387 7.171 . . . 1.0 . . . . . . . . . . . . A . 19 THR OG1 . . . . . . . . . rr_2m7y 1 . 1 . 262 . 1 1 20 PHE C C 10.736 6.132 5.956 . . . 1.0 . . . . . . . . . . . . A . 20 PHE C . . . . . . . . . rr_2m7y 1 . 1 . 263 . 1 1 20 PHE CA C 9.658 5.557 5.036 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CA . . . . . . . . . rr_2m7y 1 . 1 . 264 . 1 1 20 PHE CB C 9.930 6.015 3.602 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CB . . . . . . . . . rr_2m7y 1 . 1 . 265 . 1 1 20 PHE CD1 C 9.130 8.372 3.320 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CD1 . . . . . . . . . rr_2m7y 1 . 1 . 266 . 1 1 20 PHE CD2 C 11.450 8.003 3.491 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CD2 . . . . . . . . . rr_2m7y 1 . 1 . 267 . 1 1 20 PHE CE1 C 9.361 9.767 3.194 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CE1 . . . . . . . . . rr_2m7y 1 . 1 . 268 . 1 1 20 PHE CE2 C 11.681 9.398 3.365 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CE2 . . . . . . . . . rr_2m7y 1 . 1 . 269 . 1 1 20 PHE CG C 10.179 7.519 3.466 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CG . . . . . . . . . rr_2m7y 1 . 1 . 270 . 1 1 20 PHE CZ C 10.632 10.251 3.219 . . . 1.0 . . . . . . . . . . . . A . 20 PHE CZ . . . . . . . . . rr_2m7y 1 . 1 . 271 . 1 1 20 PHE H H 7.926 6.674 4.732 . . . 1.0 . . . . . . . . . . . . A . 20 PHE H . . . . . . . . . rr_2m7y 1 . 1 . 272 . 1 1 20 PHE HA H 9.633 4.472 5.142 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HA . . . . . . . . . rr_2m7y 1 . 1 . 273 . 1 1 20 PHE HB2 H 10.797 5.478 3.217 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HB2 . . . . . . . . . rr_2m7y 1 . 1 . 274 . 1 1 20 PHE HB3 H 9.081 5.740 2.976 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HB3 . . . . . . . . . rr_2m7y 1 . 1 . 275 . 1 1 20 PHE HD1 H 8.111 7.984 3.300 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HD1 . . . . . . . . . rr_2m7y 1 . 1 . 276 . 1 1 20 PHE HD2 H 12.291 7.319 3.608 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HD2 . . . . . . . . . rr_2m7y 1 . 1 . 277 . 1 1 20 PHE HE1 H 8.520 10.450 3.077 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HE1 . . . . . . . . . rr_2m7y 1 . 1 . 278 . 1 1 20 PHE HE2 H 12.700 9.786 3.385 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HE2 . . . . . . . . . rr_2m7y 1 . 1 . 279 . 1 1 20 PHE HZ H 10.809 11.322 3.122 . . . 1.0 . . . . . . . . . . . . A . 20 PHE HZ . . . . . . . . . rr_2m7y 1 . 1 . 280 . 1 1 20 PHE N N 8.343 6.056 5.399 . . . 1.0 . . . . . . . . . . . . A . 20 PHE N . . . . . . . . . rr_2m7y 1 . 1 . 281 . 1 1 20 PHE O O 11.637 5.414 6.388 . . . 1.0 . . . . . . . . . . . . A . 20 PHE O . . . . . . . . . rr_2m7y 1 . 1 . 282 . 1 1 21 GLU C C 11.271 7.785 8.558 . . . 1.0 . . . . . . . . . . . . A . 21 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 283 . 1 1 21 GLU CA C 11.562 8.102 7.090 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 284 . 1 1 21 GLU CB C 11.545 9.612 6.842 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 285 . 1 1 21 GLU CD C 13.792 9.520 7.984 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 286 . 1 1 21 GLU CG C 12.511 10.333 7.784 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 287 . 1 1 21 GLU H H 9.874 7.999 5.874 . . . 1.0 . . . . . . . . . . . . A . 21 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 288 . 1 1 21 GLU HA H 12.539 7.706 6.812 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 289 . 1 1 21 GLU HB2 H 11.820 9.817 5.807 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 290 . 1 1 21 GLU HB3 H 10.536 9.997 6.986 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 291 . 1 1 21 GLU HE2 H 14.490 10.175 9.605 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 292 . 1 1 21 GLU HG2 H 12.759 11.314 7.376 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 293 . 1 1 21 GLU HG3 H 12.029 10.501 8.746 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 294 . 1 1 21 GLU N N 10.610 7.422 6.229 . . . 1.0 . . . . . . . . . . . . A . 21 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 295 . 1 1 21 GLU O O 11.845 8.401 9.455 . . . 1.0 . . . . . . . . . . . . A . 21 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 296 . 1 1 21 GLU OE1 O 14.420 9.101 7.000 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 297 . 1 1 21 GLU OE2 O 14.130 9.329 9.214 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 298 . 1 1 22 GLU C C 10.484 4.990 10.376 . . . 1.0 . . . . . . . . . . . . A . 22 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 299 . 1 1 22 GLU CA C 10.007 6.418 10.102 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 300 . 1 1 22 GLU CB C 8.497 6.541 10.312 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 301 . 1 1 22 GLU CD C 8.960 8.908 11.051 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 302 . 1 1 22 GLU CG C 8.174 7.627 11.340 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 303 . 1 1 22 GLU H H 9.919 6.328 8.022 . . . 1.0 . . . . . . . . . . . . A . 22 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 304 . 1 1 22 GLU HA H 10.519 7.113 10.767 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 305 . 1 1 22 GLU HB2 H 8.012 6.777 9.364 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 306 . 1 1 22 GLU HB3 H 8.093 5.586 10.647 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 307 . 1 1 22 GLU HE2 H 10.129 9.689 9.800 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 308 . 1 1 22 GLU HG2 H 7.105 7.841 11.325 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 309 . 1 1 22 GLU HG3 H 8.412 7.267 12.341 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 310 . 1 1 22 GLU N N 10.381 6.824 8.758 . . . 1.0 . . . . . . . . . . . . A . 22 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 311 . 1 1 22 GLU O O 10.159 4.412 11.412 . . . 1.0 . . . . . . . . . . . . A . 22 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 312 . 1 1 22 GLU OE1 O 9.147 9.737 11.954 . . . 1.0 . . . . . . . . . . . . A . 22 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 313 . 1 1 22 GLU OE2 O 9.383 9.026 9.838 . . . 1.0 . . . . . . . . . . . . A . 22 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 314 . 1 1 23 CYS C C 13.234 3.206 9.997 . . . 1.0 . . . . . . . . . . . . A . 23 CYS C . . . . . . . . . rr_2m7y 1 . 1 . 315 . 1 1 23 CYS CA C 11.771 3.113 9.556 . . . 1.0 . . . . . . . . . . . . A . 23 CYS CA . . . . . . . . . rr_2m7y 1 . 1 . 316 . 1 1 23 CYS CB C 11.616 2.321 8.257 . . . 1.0 . . . . . . . . . . . . A . 23 CYS CB . . . . . . . . . rr_2m7y 1 . 1 . 317 . 1 1 23 CYS H H 11.506 4.940 8.590 . . . 1.0 . . . . . . . . . . . . A . 23 CYS H . . . . . . . . . rr_2m7y 1 . 1 . 318 . 1 1 23 CYS HA H 11.170 2.614 10.315 . . . 1.0 . . . . . . . . . . . . A . 23 CYS HA . . . . . . . . . rr_2m7y 1 . 1 . 319 . 1 1 23 CYS HB2 H 12.571 2.272 7.734 . . . 1.0 . . . . . . . . . . . . A . 23 CYS HB2 . . . . . . . . . rr_2m7y 1 . 1 . 320 . 1 1 23 CYS HB3 H 11.321 1.296 8.479 . . . 1.0 . . . . . . . . . . . . A . 23 CYS HB3 . . . . . . . . . rr_2m7y 1 . 1 . 321 . 1 1 23 CYS HG H 9.354 3.005 8.051 . . . 1.0 . . . . . . . . . . . . A . 23 CYS HG . . . . . . . . . rr_2m7y 1 . 1 . 322 . 1 1 23 CYS N N 11.247 4.463 9.430 . . . 1.0 . . . . . . . . . . . . A . 23 CYS N . . . . . . . . . rr_2m7y 1 . 1 . 323 . 1 1 23 CYS O O 13.829 4.282 9.961 . . . 1.0 . . . . . . . . . . . . A . 23 CYS O . . . . . . . . . rr_2m7y 1 . 1 . 324 . 1 1 23 CYS SG S 10.359 3.114 7.187 . . . 1.0 . . . . . . . . . . . . A . 23 CYS SG . . . . . . . . . rr_2m7y 1 . 1 . 325 . 1 1 24 PRO C C 16.129 2.045 9.671 . . . 1.0 . . . . . . . . . . . . A . 24 PRO C . . . . . . . . . rr_2m7y 1 . 1 . 326 . 1 1 24 PRO CA C 15.166 1.973 10.858 . . . 1.0 . . . . . . . . . . . . A . 24 PRO CA . . . . . . . . . rr_2m7y 1 . 1 . 327 . 1 1 24 PRO CB C 15.272 0.668 11.630 . . . 1.0 . . . . . . . . . . . . A . 24 PRO CB . . . . . . . . . rr_2m7y 1 . 1 . 328 . 1 1 24 PRO CD C 13.109 0.741 10.466 . . . 1.0 . . . . . . . . . . . . A . 24 PRO CD . . . . . . . . . rr_2m7y 1 . 1 . 329 . 1 1 24 PRO CG C 14.081 -0.172 11.196 . . . 1.0 . . . . . . . . . . . . A . 24 PRO CG . . . . . . . . . rr_2m7y 1 . 1 . 330 . 1 1 24 PRO HA H 15.380 2.762 11.433 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HA . . . . . . . . . rr_2m7y 1 . 1 . 331 . 1 1 24 PRO HB2 H 16.210 0.159 11.410 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HB2 . . . . . . . . . rr_2m7y 1 . 1 . 332 . 1 1 24 PRO HB3 H 15.252 0.848 12.705 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HB3 . . . . . . . . . rr_2m7y 1 . 1 . 333 . 1 1 24 PRO HD2 H 12.889 0.366 9.467 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HD2 . . . . . . . . . rr_2m7y 1 . 1 . 334 . 1 1 24 PRO HD3 H 12.159 0.812 10.996 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HD3 . . . . . . . . . rr_2m7y 1 . 1 . 335 . 1 1 24 PRO HG2 H 14.404 -0.984 10.546 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HG2 . . . . . . . . . rr_2m7y 1 . 1 . 336 . 1 1 24 PRO HG3 H 13.601 -0.628 12.062 . . . 1.0 . . . . . . . . . . . . A . 24 PRO HG3 . . . . . . . . . rr_2m7y 1 . 1 . 337 . 1 1 24 PRO N N 13.784 2.034 10.411 . . . 1.0 . . . . . . . . . . . . A . 24 PRO N . . . . . . . . . rr_2m7y 1 . 1 . 338 . 1 1 24 PRO O O 16.789 3.062 9.465 . . . 1.0 . . . . . . . . . . . . A . 24 PRO O . . . . . . . . . rr_2m7y 1 . 1 . 339 . 1 1 25 LYS C C 16.885 2.150 6.925 . . . 1.0 . . . . . . . . . . . . A . 25 LYS C . . . . . . . . . rr_2m7y 1 . 1 . 340 . 1 1 25 LYS CA C 17.051 0.880 7.763 . . . 1.0 . . . . . . . . . . . . A . 25 LYS CA . . . . . . . . . rr_2m7y 1 . 1 . 341 . 1 1 25 LYS CB C 16.795 -0.410 6.981 . . . 1.0 . . . . . . . . . . . . A . 25 LYS CB . . . . . . . . . rr_2m7y 1 . 1 . 342 . 1 1 25 LYS CD C 17.778 -2.679 6.488 . . . 1.0 . . . . . . . . . . . . A . 25 LYS CD . . . . . . . . . rr_2m7y 1 . 1 . 343 . 1 1 25 LYS CE C 17.184 -2.811 5.084 . . . 1.0 . . . . . . . . . . . . A . 25 LYS CE . . . . . . . . . rr_2m7y 1 . 1 . 344 . 1 1 25 LYS CG C 18.085 -1.217 6.819 . . . 1.0 . . . . . . . . . . . . A . 25 LYS CG . . . . . . . . . rr_2m7y 1 . 1 . 345 . 1 1 25 LYS H H 15.639 0.130 9.098 . . . 1.0 . . . . . . . . . . . . A . 25 LYS H . . . . . . . . . rr_2m7y 1 . 1 . 346 . 1 1 25 LYS HA H 18.077 0.838 8.127 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HA . . . . . . . . . rr_2m7y 1 . 1 . 347 . 1 1 25 LYS HB2 H 16.048 -1.012 7.499 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HB2 . . . . . . . . . rr_2m7y 1 . 1 . 348 . 1 1 25 LYS HB3 H 16.386 -0.170 6.000 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HB3 . . . . . . . . . rr_2m7y 1 . 1 . 349 . 1 1 25 LYS HD2 H 18.691 -3.271 6.557 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HD2 . . . . . . . . . rr_2m7y 1 . 1 . 350 . 1 1 25 LYS HD3 H 17.081 -3.084 7.221 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HD3 . . . . . . . . . rr_2m7y 1 . 1 . 351 . 1 1 25 LYS HE2 H 16.853 -3.836 4.917 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HE2 . . . . . . . . . rr_2m7y 1 . 1 . 352 . 1 1 25 LYS HE3 H 16.304 -2.174 4.994 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HE3 . . . . . . . . . rr_2m7y 1 . 1 . 353 . 1 1 25 LYS HG2 H 18.693 -0.781 6.026 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HG2 . . . . . . . . . rr_2m7y 1 . 1 . 354 . 1 1 25 LYS HG3 H 18.670 -1.164 7.737 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HG3 . . . . . . . . . rr_2m7y 1 . 1 . 355 . 1 1 25 LYS HZ1 H 17.788 -2.428 3.127 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HZ1 . . . . . . . . . rr_2m7y 1 . 1 . 356 . 1 1 25 LYS HZ3 H 18.970 -3.073 4.043 . . . 1.0 . . . . . . . . . . . . A . 25 LYS HZ3 . . . . . . . . . rr_2m7y 1 . 1 . 357 . 1 1 25 LYS N N 16.179 0.953 8.923 . . . 1.0 . . . . . . . . . . . . A . 25 LYS N . . . . . . . . . rr_2m7y 1 . 1 . 358 . 1 1 25 LYS NZ N 18.184 -2.433 4.060 . . . 1.0 . . . . . . . . . . . . A . 25 LYS NZ . . . . . . . . . rr_2m7y 1 . 1 . 359 . 1 1 25 LYS O O 17.799 2.545 6.203 . . . 1.0 . . . . . . . . . . . . A . 25 LYS O . . . . . . . . . rr_2m7y 1 . 1 . 360 . 1 1 26 CYS C C 16.282 5.097 6.878 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . rr_2m7y 1 . 1 . 361 . 1 1 26 CYS CA C 15.415 3.970 6.313 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . rr_2m7y 1 . 1 . 362 . 1 1 26 CYS CB C 13.925 4.314 6.366 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . rr_2m7y 1 . 1 . 363 . 1 1 26 CYS H H 14.974 2.425 7.639 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . rr_2m7y 1 . 1 . 364 . 1 1 26 CYS HA H 15.667 3.774 5.271 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . rr_2m7y 1 . 1 . 365 . 1 1 26 CYS HB2 H 13.475 3.881 7.259 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . rr_2m7y 1 . 1 . 366 . 1 1 26 CYS HB3 H 13.795 5.394 6.435 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . rr_2m7y 1 . 1 . 367 . 1 1 26 CYS HG H 13.995 2.756 4.579 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HG . . . . . . . . . rr_2m7y 1 . 1 . 368 . 1 1 26 CYS N N 15.712 2.753 7.050 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . rr_2m7y 1 . 1 . 369 . 1 1 26 CYS O O 16.866 5.874 6.124 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . rr_2m7y 1 . 1 . 370 . 1 1 26 CYS SG S 13.083 3.678 4.871 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . rr_2m7y 1 . 1 . 371 . 1 1 27 SER C C 18.596 5.761 8.907 . . . 1.0 . . . . . . . . . . . . A . 27 SER C . . . . . . . . . rr_2m7y 1 . 1 . 372 . 1 1 27 SER CA C 17.123 6.171 8.876 . . . 1.0 . . . . . . . . . . . . A . 27 SER CA . . . . . . . . . rr_2m7y 1 . 1 . 373 . 1 1 27 SER CB C 16.608 6.411 10.297 . . . 1.0 . . . . . . . . . . . . A . 27 SER CB . . . . . . . . . rr_2m7y 1 . 1 . 374 . 1 1 27 SER H H 15.859 4.516 8.807 . . . 1.0 . . . . . . . . . . . . A . 27 SER H . . . . . . . . . rr_2m7y 1 . 1 . 375 . 1 1 27 SER HA H 16.990 7.076 8.284 . . . 1.0 . . . . . . . . . . . . A . 27 SER HA . . . . . . . . . rr_2m7y 1 . 1 . 376 . 1 1 27 SER HB2 H 16.534 7.484 10.478 . . . 1.0 . . . . . . . . . . . . A . 27 SER HB2 . . . . . . . . . rr_2m7y 1 . 1 . 377 . 1 1 27 SER HB3 H 15.603 6.001 10.392 . . . 1.0 . . . . . . . . . . . . A . 27 SER HB3 . . . . . . . . . rr_2m7y 1 . 1 . 378 . 1 1 27 SER HG H 17.750 6.515 11.937 . . . 1.0 . . . . . . . . . . . . A . 27 SER HG . . . . . . . . . rr_2m7y 1 . 1 . 379 . 1 1 27 SER N N 16.337 5.151 8.201 . . . 1.0 . . . . . . . . . . . . A . 27 SER N . . . . . . . . . rr_2m7y 1 . 1 . 380 . 1 1 27 SER O O 19.472 6.595 9.131 . . . 1.0 . . . . . . . . . . . . A . 27 SER O . . . . . . . . . rr_2m7y 1 . 1 . 381 . 1 1 27 SER OG O 17.456 5.822 11.278 . . . 1.0 . . . . . . . . . . . . A . 27 SER OG . . . . . . . . . rr_2m7y 1 . 1 . 382 . 1 1 28 ALA C C 20.915 4.441 7.434 . . . 1.0 . . . . . . . . . . . . A . 28 ALA C . . . . . . . . . rr_2m7y 1 . 1 . 383 . 1 1 28 ALA CA C 20.178 3.945 8.679 . . . 1.0 . . . . . . . . . . . . A . 28 ALA CA . . . . . . . . . rr_2m7y 1 . 1 . 384 . 1 1 28 ALA CB C 20.127 2.417 8.757 . . . 1.0 . . . . . . . . . . . . A . 28 ALA CB . . . . . . . . . rr_2m7y 1 . 1 . 385 . 1 1 28 ALA H H 18.107 3.803 8.498 . . . 1.0 . . . . . . . . . . . . A . 28 ALA H . . . . . . . . . rr_2m7y 1 . 1 . 386 . 1 1 28 ALA HA H 20.683 4.325 9.567 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HA . . . . . . . . . rr_2m7y 1 . 1 . 387 . 1 1 28 ALA HB1 H 19.463 2.117 9.567 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HB1 . . . . . . . . . rr_2m7y 1 . 1 . 388 . 1 1 28 ALA HB2 H 19.754 2.018 7.814 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HB2 . . . . . . . . . rr_2m7y 1 . 1 . 389 . 1 1 28 ALA HB3 H 21.128 2.030 8.945 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HB3 . . . . . . . . . rr_2m7y 1 . 1 . 390 . 1 1 28 ALA N N 18.825 4.476 8.680 . . . 1.0 . . . . . . . . . . . . A . 28 ALA N . . . . . . . . . rr_2m7y 1 . 1 . 391 . 1 1 28 ALA O O 22.142 4.527 7.428 . . . 1.0 . . . . . . . . . . . . A . 28 ALA O . . . . . . . . . rr_2m7y 1 . 1 . 392 . 1 1 29 LEU C C 21.517 6.505 5.434 . . . 1.0 . . . . . . . . . . . . A . 29 LEU C . . . . . . . . . rr_2m7y 1 . 1 . 393 . 1 1 29 LEU CA C 20.700 5.240 5.162 . . . 1.0 . . . . . . . . . . . . A . 29 LEU CA . . . . . . . . . rr_2m7y 1 . 1 . 394 . 1 1 29 LEU CB C 19.600 5.432 4.115 . . . 1.0 . . . . . . . . . . . . A . 29 LEU CB . . . . . . . . . rr_2m7y 1 . 1 . 395 . 1 1 29 LEU CD1 C 21.014 4.504 2.245 . . . 1.0 . . . . . . . . . . . . A . 29 LEU CD1 . . . . . . . . . rr_2m7y 1 . 1 . 396 . 1 1 29 LEU CD2 C 19.227 3.066 3.327 . . . 1.0 . . . . . . . . . . . . A . 29 LEU CD2 . . . . . . . . . rr_2m7y 1 . 1 . 397 . 1 1 29 LEU CG C 19.640 4.481 2.918 . . . 1.0 . . . . . . . . . . . . A . 29 LEU CG . . . . . . . . . rr_2m7y 1 . 1 . 398 . 1 1 29 LEU H H 19.139 4.682 6.422 . . . 1.0 . . . . . . . . . . . . A . 29 LEU H . . . . . . . . . rr_2m7y 1 . 1 . 399 . 1 1 29 LEU HA H 21.372 4.469 4.785 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HA . . . . . . . . . rr_2m7y 1 . 1 . 400 . 1 1 29 LEU HB2 H 18.634 5.323 4.608 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 401 . 1 1 29 LEU HB3 H 19.655 6.455 3.743 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 402 . 1 1 29 LEU HD11 H 20.938 5.006 1.280 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HD11 . . . . . . . . . rr_2m7y 1 . 1 . 403 . 1 1 29 LEU HD12 H 21.720 5.040 2.879 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HD12 . . . . . . . . . rr_2m7y 1 . 1 . 404 . 1 1 29 LEU HD13 H 21.364 3.482 2.096 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HD13 . . . . . . . . . rr_2m7y 1 . 1 . 405 . 1 1 29 LEU HD21 H 18.625 3.112 4.235 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HD21 . . . . . . . . . rr_2m7y 1 . 1 . 406 . 1 1 29 LEU HD22 H 18.642 2.612 2.527 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HD22 . . . . . . . . . rr_2m7y 1 . 1 . 407 . 1 1 29 LEU HD23 H 20.118 2.466 3.512 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HD23 . . . . . . . . . rr_2m7y 1 . 1 . 408 . 1 1 29 LEU HG H 18.916 4.827 2.181 . . . 1.0 . . . . . . . . . . . . A . 29 LEU HG . . . . . . . . . rr_2m7y 1 . 1 . 409 . 1 1 29 LEU N N 20.136 4.755 6.409 . . . 1.0 . . . . . . . . . . . . A . 29 LEU N . . . . . . . . . rr_2m7y 1 . 1 . 410 . 1 1 29 LEU O O 22.337 6.907 4.611 . . . 1.0 . . . . . . . . . . . . A . 29 LEU O . . . . . . . . . rr_2m7y 1 . 1 . 411 . 1 1 30 GLN C C 21.241 9.540 6.439 . . . 1.0 . . . . . . . . . . . . A . 30 GLN C . . . . . . . . . rr_2m7y 1 . 1 . 412 . 1 1 30 GLN CA C 21.965 8.307 6.983 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CA . . . . . . . . . rr_2m7y 1 . 1 . 413 . 1 1 30 GLN CB C 23.421 8.274 6.512 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CB . . . . . . . . . rr_2m7y 1 . 1 . 414 . 1 1 30 GLN CD C 24.999 8.289 8.479 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CD . . . . . . . . . rr_2m7y 1 . 1 . 415 . 1 1 30 GLN CG C 24.307 9.138 7.411 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CG . . . . . . . . . rr_2m7y 1 . 1 . 416 . 1 1 30 GLN H H 20.594 6.762 7.256 . . . 1.0 . . . . . . . . . . . . A . 30 GLN H . . . . . . . . . rr_2m7y 1 . 1 . 417 . 1 1 30 GLN HA H 21.943 8.316 8.073 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HA . . . . . . . . . rr_2m7y 1 . 1 . 418 . 1 1 30 GLN HB2 H 23.784 7.247 6.516 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HB2 . . . . . . . . . rr_2m7y 1 . 1 . 419 . 1 1 30 GLN HB3 H 23.482 8.630 5.484 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HB3 . . . . . . . . . rr_2m7y 1 . 1 . 420 . 1 1 30 GLN HE21 H 26.750 8.570 7.503 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HE21 . . . . . . . . . rr_2m7y 1 . 1 . 421 . 1 1 30 GLN HE22 H 26.848 7.603 8.937 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HE22 . . . . . . . . . rr_2m7y 1 . 1 . 422 . 1 1 30 GLN HG2 H 25.057 9.648 6.806 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HG2 . . . . . . . . . rr_2m7y 1 . 1 . 423 . 1 1 30 GLN HG3 H 23.704 9.910 7.889 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HG3 . . . . . . . . . rr_2m7y 1 . 1 . 424 . 1 1 30 GLN N N 21.264 7.096 6.592 . . . 1.0 . . . . . . . . . . . . A . 30 GLN N . . . . . . . . . rr_2m7y 1 . 1 . 425 . 1 1 30 GLN NE2 N 26.307 8.142 8.291 . . . 1.0 . . . . . . . . . . . . A . 30 GLN NE2 . . . . . . . . . rr_2m7y 1 . 1 . 426 . 1 1 30 GLN O O 21.811 10.310 5.668 . . . 1.0 . . . . . . . . . . . . A . 30 GLN O . . . . . . . . . rr_2m7y 1 . 1 . 427 . 1 1 30 GLN OE1 O 24.385 7.799 9.413 . . . 1.0 . . . . . . . . . . . . A . 30 GLN OE1 . . . . . . . . . rr_2m7y 1 . 1 . 428 . 1 1 31 TYR C C 19.079 11.872 7.528 . . . 1.0 . . . . . . . . . . . . A . 31 TYR C . . . . . . . . . rr_2m7y 1 . 1 . 429 . 1 1 31 TYR CA C 19.185 10.815 6.427 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CA . . . . . . . . . rr_2m7y 1 . 1 . 430 . 1 1 31 TYR CB C 17.792 10.249 6.143 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CB . . . . . . . . . rr_2m7y 1 . 1 . 431 . 1 1 31 TYR CD1 C 17.224 11.802 4.240 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CD1 . . . . . . . . . rr_2m7y 1 . 1 . 432 . 1 1 31 TYR CD2 C 15.635 11.546 6.007 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CD2 . . . . . . . . . rr_2m7y 1 . 1 . 433 . 1 1 31 TYR CE1 C 16.340 12.727 3.578 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CE1 . . . . . . . . . rr_2m7y 1 . 1 . 434 . 1 1 31 TYR CE2 C 14.751 12.471 5.345 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CE2 . . . . . . . . . rr_2m7y 1 . 1 . 435 . 1 1 31 TYR CG C 16.853 11.231 5.440 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CG . . . . . . . . . rr_2m7y 1 . 1 . 436 . 1 1 31 TYR CZ C 15.147 13.016 4.164 . . . 1.0 . . . . . . . . . . . . A . 31 TYR CZ . . . . . . . . . rr_2m7y 1 . 1 . 437 . 1 1 31 TYR H H 19.537 9.058 7.489 . . . 1.0 . . . . . . . . . . . . A . 31 TYR H . . . . . . . . . rr_2m7y 1 . 1 . 438 . 1 1 31 TYR HA H 19.666 11.257 5.554 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HA . . . . . . . . . rr_2m7y 1 . 1 . 439 . 1 1 31 TYR HB2 H 17.893 9.355 5.528 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HB2 . . . . . . . . . rr_2m7y 1 . 1 . 440 . 1 1 31 TYR HB3 H 17.339 9.939 7.084 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HB3 . . . . . . . . . rr_2m7y 1 . 1 . 441 . 1 1 31 TYR HD1 H 18.187 11.554 3.793 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HD1 . . . . . . . . . rr_2m7y 1 . 1 . 442 . 1 1 31 TYR HD2 H 15.342 11.095 6.955 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HD2 . . . . . . . . . rr_2m7y 1 . 1 . 443 . 1 1 31 TYR HE1 H 16.621 13.185 2.630 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HE1 . . . . . . . . . rr_2m7y 1 . 1 . 444 . 1 1 31 TYR HE2 H 13.786 12.728 5.781 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HE2 . . . . . . . . . rr_2m7y 1 . 1 . 445 . 1 1 31 TYR HH H 13.691 13.393 2.933 . . . 1.0 . . . . . . . . . . . . A . 31 TYR HH . . . . . . . . . rr_2m7y 1 . 1 . 446 . 1 1 31 TYR N N 19.994 9.689 6.862 . . . 1.0 . . . . . . . . . . . . A . 31 TYR N . . . . . . . . . rr_2m7y 1 . 1 . 447 . 1 1 31 TYR O O 18.485 12.929 7.323 . . . 1.0 . . . . . . . . . . . . A . 31 TYR O . . . . . . . . . rr_2m7y 1 . 1 . 448 . 1 1 31 TYR OH O 14.312 13.889 3.539 . . . 1.0 . . . . . . . . . . . . A . 31 TYR OH . . . . . . . . . rr_2m7y 1 . 1 . 449 . 1 1 32 ARG C C 20.993 13.160 9.949 . . . 1.0 . . . . . . . . . . . . A . 32 ARG C . . . . . . . . . rr_2m7y 1 . 1 . 450 . 1 1 32 ARG CA C 19.642 12.457 9.806 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CA . . . . . . . . . rr_2m7y 1 . 1 . 451 . 1 1 32 ARG CB C 19.323 11.711 11.103 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CB . . . . . . . . . rr_2m7y 1 . 1 . 452 . 1 1 32 ARG CD C 17.474 10.577 12.389 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CD . . . . . . . . . rr_2m7y 1 . 1 . 453 . 1 1 32 ARG CG C 17.978 10.989 11.005 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CG . . . . . . . . . rr_2m7y 1 . 1 . 454 . 1 1 32 ARG CZ C 15.322 10.721 13.654 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CZ . . . . . . . . . rr_2m7y 1 . 1 . 455 . 1 1 32 ARG H H 20.144 10.686 8.831 . . . 1.0 . . . . . . . . . . . . A . 32 ARG H . . . . . . . . . rr_2m7y 1 . 1 . 456 . 1 1 32 ARG HA H 18.851 13.171 9.576 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HA . . . . . . . . . rr_2m7y 1 . 1 . 457 . 1 1 32 ARG HB2 H 20.113 10.990 11.316 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HB2 . . . . . . . . . rr_2m7y 1 . 1 . 458 . 1 1 32 ARG HB3 H 19.302 12.414 11.936 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HB3 . . . . . . . . . rr_2m7y 1 . 1 . 459 . 1 1 32 ARG HD2 H 17.576 9.499 12.517 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HD2 . . . . . . . . . rr_2m7y 1 . 1 . 460 . 1 1 32 ARG HD3 H 18.082 11.048 13.162 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HD3 . . . . . . . . . rr_2m7y 1 . 1 . 461 . 1 1 32 ARG HE H 15.617 11.458 11.794 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HE . . . . . . . . . rr_2m7y 1 . 1 . 462 . 1 1 32 ARG HG2 H 17.247 11.639 10.526 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HG2 . . . . . . . . . rr_2m7y 1 . 1 . 463 . 1 1 32 ARG HG3 H 18.081 10.106 10.374 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HG3 . . . . . . . . . rr_2m7y 1 . 1 . 464 . 1 1 32 ARG HH11 H 16.817 9.771 14.670 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH11 . . . . . . . . . rr_2m7y 1 . 1 . 465 . 1 1 32 ARG HH12 H 15.312 9.888 15.519 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH12 . . . . . . . . . rr_2m7y 1 . 1 . 466 . 1 1 32 ARG HH22 H 13.453 10.975 14.468 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH22 . . . . . . . . . rr_2m7y 1 . 1 . 467 . 1 1 32 ARG N N 19.663 11.549 8.672 . . . 1.0 . . . . . . . . . . . . A . 32 ARG N . . . . . . . . . rr_2m7y 1 . 1 . 468 . 1 1 32 ARG NE N 16.057 10.973 12.550 . . . 1.0 . . . . . . . . . . . . A . 32 ARG NE . . . . . . . . . rr_2m7y 1 . 1 . 469 . 1 1 32 ARG NH1 N 15.864 10.070 14.705 . . . 1.0 . . . . . . . . . . . . A . 32 ARG NH1 . . . . . . . . . rr_2m7y 1 . 1 . 470 . 1 1 32 ARG NH2 N 14.064 11.121 13.690 . . . 1.0 . . . . . . . . . . . . A . 32 ARG NH2 . . . . . . . . . rr_2m7y 1 . 1 . 471 . 1 1 32 ARG O O 21.976 12.756 9.329 . . . 1.0 . . . . . . . . . . . . A . 32 ARG O . . . . . . . . . rr_2m7y 1 . 1 . 472 . 1 1 33 ASN C C 21.905 16.134 11.937 . . . 1.0 . . . . . . . . . . . . A . 33 ASN C . . . . . . . . . rr_2m7y 1 . 1 . 473 . 1 1 33 ASN CA C 22.214 14.964 11.001 . . . 1.0 . . . . . . . . . . . . A . 33 ASN CA . . . . . . . . . rr_2m7y 1 . 1 . 474 . 1 1 33 ASN CB C 22.762 15.537 9.693 . . . 1.0 . . . . . . . . . . . . A . 33 ASN CB . . . . . . . . . rr_2m7y 1 . 1 . 475 . 1 1 33 ASN CG C 21.871 16.668 9.174 . . . 1.0 . . . . . . . . . . . . A . 33 ASN CG . . . . . . . . . rr_2m7y 1 . 1 . 476 . 1 1 33 ASN H H 20.196 14.523 11.270 . . . 1.0 . . . . . . . . . . . . A . 33 ASN H . . . . . . . . . rr_2m7y 1 . 1 . 477 . 1 1 33 ASN HA H 22.918 14.255 11.437 . . . 1.0 . . . . . . . . . . . . A . 33 ASN HA . . . . . . . . . rr_2m7y 1 . 1 . 478 . 1 1 33 ASN HB2 H 23.774 15.910 9.851 . . . 1.0 . . . . . . . . . . . . A . 33 ASN HB2 . . . . . . . . . rr_2m7y 1 . 1 . 479 . 1 1 33 ASN HB3 H 22.827 14.748 8.944 . . . 1.0 . . . . . . . . . . . . A . 33 ASN HB3 . . . . . . . . . rr_2m7y 1 . 1 . 480 . 1 1 33 ASN HD21 H 20.266 15.464 9.443 . . . 1.0 . . . . . . . . . . . . A . 33 ASN HD21 . . . . . . . . . rr_2m7y 1 . 1 . 481 . 1 1 33 ASN HD22 H 19.913 17.040 8.818 . . . 1.0 . . . . . . . . . . . . A . 33 ASN HD22 . . . . . . . . . rr_2m7y 1 . 1 . 482 . 1 1 33 ASN N N 20.999 14.201 10.769 . . . 1.0 . . . . . . . . . . . . A . 33 ASN N . . . . . . . . . rr_2m7y 1 . 1 . 483 . 1 1 33 ASN ND2 N 20.577 16.366 9.143 . . . 1.0 . . . . . . . . . . . . A . 33 ASN ND2 . . . . . . . . . rr_2m7y 1 . 1 . 484 . 1 1 33 ASN O O 22.296 17.268 11.669 . . . 1.0 . . . . . . . . . . . . A . 33 ASN O . . . . . . . . . rr_2m7y 1 . 1 . 485 . 1 1 33 ASN OD1 O 22.330 17.744 8.825 . . . 1.0 . . . . . . . . . . . . A . 33 ASN OD1 . . . . . . . . . rr_2m7y 1 . 1 . 486 . 1 1 34 GLY C C 22.069 17.610 14.462 . . . 1.0 . . . . . . . . . . . . A . 34 GLY C . . . . . . . . . rr_2m7y 1 . 1 . 487 . 1 1 34 GLY CA C 20.840 16.828 13.995 . . . 1.0 . . . . . . . . . . . . A . 34 GLY CA . . . . . . . . . rr_2m7y 1 . 1 . 488 . 1 1 34 GLY H H 20.891 14.892 13.228 . . . 1.0 . . . . . . . . . . . . A . 34 GLY H . . . . . . . . . rr_2m7y 1 . 1 . 489 . 1 1 34 GLY HA2 H 20.112 17.513 13.560 . . . 1.0 . . . . . . . . . . . . A . 34 GLY HA2 . . . . . . . . . rr_2m7y 1 . 1 . 490 . 1 1 34 GLY HA3 H 20.359 16.354 14.851 . . . 1.0 . . . . . . . . . . . . A . 34 GLY HA3 . . . . . . . . . rr_2m7y 1 . 1 . 491 . 1 1 34 GLY N N 21.205 15.817 13.017 . . . 1.0 . . . . . . . . . . . . A . 34 GLY N . . . . . . . . . rr_2m7y 1 . 1 . 492 . 1 1 34 GLY O O 21.992 18.815 14.692 . . . 1.0 . . . . . . . . . . . . A . 34 GLY O . . . . . . . . . rr_2m7y 1 . 1 . 493 . 1 1 35 PHE C C 25.466 17.469 13.908 . . . 1.0 . . . . . . . . . . . . A . 35 PHE C . . . . . . . . . rr_2m7y 1 . 1 . 494 . 1 1 35 PHE CA C 24.419 17.502 15.023 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CA . . . . . . . . . rr_2m7y 1 . 1 . 495 . 1 1 35 PHE CB C 24.929 16.682 16.210 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CB . . . . . . . . . rr_2m7y 1 . 1 . 496 . 1 1 35 PHE CD1 C 27.171 17.565 16.892 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CD1 . . . . . . . . . rr_2m7y 1 . 1 . 497 . 1 1 35 PHE CD2 C 25.323 18.051 18.269 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CD2 . . . . . . . . . rr_2m7y 1 . 1 . 498 . 1 1 35 PHE CE1 C 28.018 18.288 17.772 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CE1 . . . . . . . . . rr_2m7y 1 . 1 . 499 . 1 1 35 PHE CE2 C 26.170 18.774 19.150 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CE2 . . . . . . . . . rr_2m7y 1 . 1 . 500 . 1 1 35 PHE CG C 25.842 17.461 17.159 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CG . . . . . . . . . rr_2m7y 1 . 1 . 501 . 1 1 35 PHE CZ C 27.499 18.878 18.883 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CZ . . . . . . . . . rr_2m7y 1 . 1 . 502 . 1 1 35 PHE H H 23.229 15.910 14.399 . . . 1.0 . . . . . . . . . . . . A . 35 PHE H . . . . . . . . . rr_2m7y 1 . 1 . 503 . 1 1 35 PHE HA H 24.198 18.538 15.281 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HA . . . . . . . . . rr_2m7y 1 . 1 . 504 . 1 1 35 PHE HB2 H 24.075 16.304 16.772 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HB2 . . . . . . . . . rr_2m7y 1 . 1 . 505 . 1 1 35 PHE HB3 H 25.471 15.814 15.832 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HB3 . . . . . . . . . rr_2m7y 1 . 1 . 506 . 1 1 35 PHE HD1 H 27.587 17.092 16.002 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HD1 . . . . . . . . . rr_2m7y 1 . 1 . 507 . 1 1 35 PHE HD2 H 24.258 17.968 18.483 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HD2 . . . . . . . . . rr_2m7y 1 . 1 . 508 . 1 1 35 PHE HE1 H 29.084 18.371 17.559 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HE1 . . . . . . . . . rr_2m7y 1 . 1 . 509 . 1 1 35 PHE HE2 H 25.754 19.247 20.040 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HE2 . . . . . . . . . rr_2m7y 1 . 1 . 510 . 1 1 35 PHE HZ H 28.150 19.433 19.559 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HZ . . . . . . . . . rr_2m7y 1 . 1 . 511 . 1 1 35 PHE N N 23.175 16.891 14.588 . . . 1.0 . . . . . . . . . . . . A . 35 PHE N . . . . . . . . . rr_2m7y 1 . 1 . 512 . 1 1 35 PHE O O 26.635 17.772 14.140 . . . 1.0 . . . . . . . . . . . . A . 35 PHE O . . . . . . . . . rr_2m7y 1 . 1 . 513 . 1 1 36 TYR C C 27.286 16.546 11.978 . . . 1.0 . . . . . . . . . . . . A . 36 TYR C . . . . . . . . . rr_2m7y 1 . 1 . 514 . 1 1 36 TYR CA C 25.890 17.021 11.569 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CA . . . . . . . . . rr_2m7y 1 . 1 . 515 . 1 1 36 TYR CB C 25.990 18.445 11.018 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CB . . . . . . . . . rr_2m7y 1 . 1 . 516 . 1 1 36 TYR CD1 C 26.241 17.670 8.632 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CD1 . . . . . . . . . rr_2m7y 1 . 1 . 517 . 1 1 36 TYR CD2 C 27.614 19.476 9.388 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CD2 . . . . . . . . . rr_2m7y 1 . 1 . 518 . 1 1 36 TYR CE1 C 26.850 17.753 7.330 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CE1 . . . . . . . . . rr_2m7y 1 . 1 . 519 . 1 1 36 TYR CE2 C 28.222 19.559 8.086 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CE2 . . . . . . . . . rr_2m7y 1 . 1 . 520 . 1 1 36 TYR CG C 26.636 18.533 9.635 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CG . . . . . . . . . rr_2m7y 1 . 1 . 521 . 1 1 36 TYR CZ C 27.810 18.694 7.121 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CZ . . . . . . . . . rr_2m7y 1 . 1 . 522 . 1 1 36 TYR H H 24.056 16.852 12.541 . . . 1.0 . . . . . . . . . . . . A . 36 TYR H . . . . . . . . . rr_2m7y 1 . 1 . 523 . 1 1 36 TYR HA H 25.464 16.306 10.865 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HA . . . . . . . . . rr_2m7y 1 . 1 . 524 . 1 1 36 TYR HB2 H 24.990 18.875 10.969 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HB2 . . . . . . . . . rr_2m7y 1 . 1 . 525 . 1 1 36 TYR HB3 H 26.565 19.054 11.716 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HB3 . . . . . . . . . rr_2m7y 1 . 1 . 526 . 1 1 36 TYR HD1 H 25.469 16.926 8.827 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HD1 . . . . . . . . . rr_2m7y 1 . 1 . 527 . 1 1 36 TYR HD2 H 27.925 20.157 10.180 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HD2 . . . . . . . . . rr_2m7y 1 . 1 . 528 . 1 1 36 TYR HE1 H 26.547 17.078 6.529 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HE1 . . . . . . . . . rr_2m7y 1 . 1 . 529 . 1 1 36 TYR HE2 H 28.995 20.298 7.878 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HE2 . . . . . . . . . rr_2m7y 1 . 1 . 530 . 1 1 36 TYR HH H 28.501 19.730 5.628 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HH . . . . . . . . . rr_2m7y 1 . 1 . 531 . 1 1 36 TYR N N 25.008 17.098 12.721 . . . 1.0 . . . . . . . . . . . . A . 36 TYR N . . . . . . . . . rr_2m7y 1 . 1 . 532 . 1 1 36 TYR O O 28.288 17.140 11.582 . . . 1.0 . . . . . . . . . . . . A . 36 TYR O . . . . . . . . . rr_2m7y 1 . 1 . 533 . 1 1 36 TYR OH O 28.384 18.772 5.890 . . . 1.0 . . . . . . . . . . . . A . 36 TYR OH . . . . . . . . . rr_2m7y 1 . 1 . 534 . 1 1 37 LEU C C 28.697 13.484 12.722 . . . 1.0 . . . . . . . . . . . . A . 37 LEU C . . . . . . . . . rr_2m7y 1 . 1 . 535 . 1 1 37 LEU CA C 28.563 14.920 13.233 . . . 1.0 . . . . . . . . . . . . A . 37 LEU CA . . . . . . . . . rr_2m7y 1 . 1 . 536 . 1 1 37 LEU CB C 28.673 15.044 14.754 . . . 1.0 . . . . . . . . . . . . A . 37 LEU CB . . . . . . . . . rr_2m7y 1 . 1 . 537 . 1 1 37 LEU CD1 C 31.094 15.594 15.195 . . . 1.0 . . . . . . . . . . . . A . 37 LEU CD1 . . . . . . . . . rr_2m7y 1 . 1 . 538 . 1 1 37 LEU CD2 C 29.470 17.427 14.532 . . . 1.0 . . . . . . . . . . . . A . 37 LEU CD2 . . . . . . . . . rr_2m7y 1 . 1 . 539 . 1 1 37 LEU CG C 29.652 16.100 15.271 . . . 1.0 . . . . . . . . . . . . A . 37 LEU CG . . . . . . . . . rr_2m7y 1 . 1 . 540 . 1 1 37 LEU H H 26.487 15.004 13.083 . . . 1.0 . . . . . . . . . . . . A . 37 LEU H . . . . . . . . . rr_2m7y 1 . 1 . 541 . 1 1 37 LEU HA H 29.368 15.516 12.802 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HA . . . . . . . . . rr_2m7y 1 . 1 . 542 . 1 1 37 LEU HB2 H 27.684 15.269 15.152 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 543 . 1 1 37 LEU HB3 H 28.967 14.075 15.157 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 544 . 1 1 37 LEU HD11 H 31.488 15.768 14.194 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HD11 . . . . . . . . . rr_2m7y 1 . 1 . 545 . 1 1 37 LEU HD12 H 31.705 16.128 15.923 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HD12 . . . . . . . . . rr_2m7y 1 . 1 . 546 . 1 1 37 LEU HD13 H 31.117 14.527 15.415 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HD13 . . . . . . . . . rr_2m7y 1 . 1 . 547 . 1 1 37 LEU HD21 H 28.744 17.298 13.729 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HD21 . . . . . . . . . rr_2m7y 1 . 1 . 548 . 1 1 37 LEU HD22 H 29.112 18.185 15.228 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HD22 . . . . . . . . . rr_2m7y 1 . 1 . 549 . 1 1 37 LEU HD23 H 30.425 17.742 14.110 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HD23 . . . . . . . . . rr_2m7y 1 . 1 . 550 . 1 1 37 LEU HG H 29.431 16.284 16.323 . . . 1.0 . . . . . . . . . . . . A . 37 LEU HG . . . . . . . . . rr_2m7y 1 . 1 . 551 . 1 1 37 LEU N N 27.307 15.481 12.766 . . . 1.0 . . . . . . . . . . . . A . 37 LEU N . . . . . . . . . rr_2m7y 1 . 1 . 552 . 1 1 37 LEU O O 29.468 12.696 13.268 . . . 1.0 . . . . . . . . . . . . A . 37 LEU O . . . . . . . . . rr_2m7y 1 . 1 . 553 . 1 1 38 LEU C C 27.286 10.870 12.043 . . . 1.0 . . . . . . . . . . . . A . 38 LEU C . . . . . . . . . rr_2m7y 1 . 1 . 554 . 1 1 38 LEU CA C 27.958 11.860 11.089 . . . 1.0 . . . . . . . . . . . . A . 38 LEU CA . . . . . . . . . rr_2m7y 1 . 1 . 555 . 1 1 38 LEU CB C 29.386 11.470 10.704 . . . 1.0 . . . . . . . . . . . . A . 38 LEU CB . . . . . . . . . rr_2m7y 1 . 1 . 556 . 1 1 38 LEU CD1 C 29.727 9.405 12.111 . . . 1.0 . . . . . . . . . . . . A . 38 LEU CD1 . . . . . . . . . rr_2m7y 1 . 1 . 557 . 1 1 38 LEU CD2 C 28.703 9.218 9.797 . . . 1.0 . . . . . . . . . . . . A . 38 LEU CD2 . . . . . . . . . rr_2m7y 1 . 1 . 558 . 1 1 38 LEU CG C 29.692 9.971 10.690 . . . 1.0 . . . . . . . . . . . . A . 38 LEU CG . . . . . . . . . rr_2m7y 1 . 1 . 559 . 1 1 38 LEU H H 27.310 13.834 11.242 . . . 1.0 . . . . . . . . . . . . A . 38 LEU H . . . . . . . . . rr_2m7y 1 . 1 . 560 . 1 1 38 LEU HA H 27.376 11.901 10.169 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HA . . . . . . . . . rr_2m7y 1 . 1 . 561 . 1 1 38 LEU HB2 H 29.597 11.873 9.713 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 562 . 1 1 38 LEU HB3 H 30.073 11.954 11.398 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 563 . 1 1 38 LEU HD11 H 30.737 9.070 12.344 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HD11 . . . . . . . . . rr_2m7y 1 . 1 . 564 . 1 1 38 LEU HD12 H 29.428 10.179 12.818 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HD12 . . . . . . . . . rr_2m7y 1 . 1 . 565 . 1 1 38 LEU HD13 H 29.039 8.563 12.183 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HD13 . . . . . . . . . rr_2m7y 1 . 1 . 566 . 1 1 38 LEU HD21 H 29.205 8.909 8.880 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HD21 . . . . . . . . . rr_2m7y 1 . 1 . 567 . 1 1 38 LEU HD22 H 28.335 8.338 10.324 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HD22 . . . . . . . . . rr_2m7y 1 . 1 . 568 . 1 1 38 LEU HD23 H 27.866 9.871 9.551 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HD23 . . . . . . . . . rr_2m7y 1 . 1 . 569 . 1 1 38 LEU HG H 30.684 9.829 10.262 . . . 1.0 . . . . . . . . . . . . A . 38 LEU HG . . . . . . . . . rr_2m7y 1 . 1 . 570 . 1 1 38 LEU N N 27.934 13.187 11.680 . . . 1.0 . . . . . . . . . . . . A . 38 LEU N . . . . . . . . . rr_2m7y 1 . 1 . 571 . 1 1 38 LEU O O 27.216 9.676 11.756 . . . 1.0 . . . . . . . . . . . . A . 38 LEU O . . . . . . . . . rr_2m7y 1 . 1 . 572 . 1 1 39 LYS C C 25.271 11.469 15.043 . . . 1.0 . . . . . . . . . . . . A . 39 LYS C . . . . . . . . . rr_2m7y 1 . 1 . 573 . 1 1 39 LYS CA C 26.147 10.581 14.157 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CA . . . . . . . . . rr_2m7y 1 . 1 . 574 . 1 1 39 LYS CB C 27.171 9.754 14.937 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CB . . . . . . . . . rr_2m7y 1 . 1 . 575 . 1 1 39 LYS CD C 28.402 11.744 15.876 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CD . . . . . . . . . rr_2m7y 1 . 1 . 576 . 1 1 39 LYS CE C 28.388 12.727 17.049 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CE . . . . . . . . . rr_2m7y 1 . 1 . 577 . 1 1 39 LYS CG C 27.607 10.480 16.211 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CG . . . . . . . . . rr_2m7y 1 . 1 . 578 . 1 1 39 LYS H H 26.871 12.375 13.385 . . . 1.0 . . . . . . . . . . . . A . 39 LYS H . . . . . . . . . rr_2m7y 1 . 1 . 579 . 1 1 39 LYS HA H 25.503 9.879 13.627 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HA . . . . . . . . . rr_2m7y 1 . 1 . 580 . 1 1 39 LYS HB2 H 26.742 8.785 15.194 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HB2 . . . . . . . . . rr_2m7y 1 . 1 . 581 . 1 1 39 LYS HB3 H 28.041 9.559 14.309 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HB3 . . . . . . . . . rr_2m7y 1 . 1 . 582 . 1 1 39 LYS HD2 H 29.430 11.477 15.633 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HD2 . . . . . . . . . rr_2m7y 1 . 1 . 583 . 1 1 39 LYS HD3 H 27.979 12.221 14.992 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HD3 . . . . . . . . . rr_2m7y 1 . 1 . 584 . 1 1 39 LYS HE2 H 29.305 13.315 17.049 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HE2 . . . . . . . . . rr_2m7y 1 . 1 . 585 . 1 1 39 LYS HE3 H 27.560 13.427 16.934 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HE3 . . . . . . . . . rr_2m7y 1 . 1 . 586 . 1 1 39 LYS HG2 H 26.730 10.743 16.801 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HG2 . . . . . . . . . rr_2m7y 1 . 1 . 587 . 1 1 39 LYS HG3 H 28.216 9.815 16.823 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HG3 . . . . . . . . . rr_2m7y 1 . 1 . 588 . 1 1 39 LYS HZ1 H 27.288 11.905 18.617 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HZ1 . . . . . . . . . rr_2m7y 1 . 1 . 589 . 1 1 39 LYS HZ3 H 28.739 12.475 19.087 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HZ3 . . . . . . . . . rr_2m7y 1 . 1 . 590 . 1 1 39 LYS N N 26.810 11.403 13.159 . . . 1.0 . . . . . . . . . . . . A . 39 LYS N . . . . . . . . . rr_2m7y 1 . 1 . 591 . 1 1 39 LYS NZ N 28.256 12.001 18.332 . . . 1.0 . . . . . . . . . . . . A . 39 LYS NZ . . . . . . . . . rr_2m7y 1 . 1 . 592 . 1 1 39 LYS O O 25.235 12.686 14.865 . . . 1.0 . . . . . . . . . . . . A . 39 LYS O . . . . . . . . . rr_2m7y 1 . 1 . 593 . 1 1 40 TYR C C 23.921 11.070 18.333 . . . 1.0 . . . . . . . . . . . . A . 40 TYR C . . . . . . . . . rr_2m7y 1 . 1 . 594 . 1 1 40 TYR CA C 23.715 11.543 16.893 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CA . . . . . . . . . rr_2m7y 1 . 1 . 595 . 1 1 40 TYR CB C 22.286 11.211 16.459 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CB . . . . . . . . . rr_2m7y 1 . 1 . 596 . 1 1 40 TYR CD1 C 22.259 10.542 14.028 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CD1 . . . . . . . . . rr_2m7y 1 . 1 . 597 . 1 1 40 TYR CD2 C 22.064 8.824 15.678 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CD2 . . . . . . . . . rr_2m7y 1 . 1 . 598 . 1 1 40 TYR CE1 C 22.179 9.551 12.986 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CE1 . . . . . . . . . rr_2m7y 1 . 1 . 599 . 1 1 40 TYR CE2 C 21.984 7.833 14.636 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CE2 . . . . . . . . . rr_2m7y 1 . 1 . 600 . 1 1 40 TYR CG C 22.200 10.158 15.352 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CG . . . . . . . . . rr_2m7y 1 . 1 . 601 . 1 1 40 TYR CZ C 22.045 8.245 13.342 . . . 1.0 . . . . . . . . . . . . A . 40 TYR CZ . . . . . . . . . rr_2m7y 1 . 1 . 602 . 1 1 40 TYR H H 24.623 9.837 16.117 . . . 1.0 . . . . . . . . . . . . A . 40 TYR H . . . . . . . . . rr_2m7y 1 . 1 . 603 . 1 1 40 TYR HA H 23.958 12.604 16.828 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HA . . . . . . . . . rr_2m7y 1 . 1 . 604 . 1 1 40 TYR HB2 H 21.727 10.858 17.326 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HB2 . . . . . . . . . rr_2m7y 1 . 1 . 605 . 1 1 40 TYR HB3 H 21.799 12.124 16.116 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HB3 . . . . . . . . . rr_2m7y 1 . 1 . 606 . 1 1 40 TYR HD1 H 22.367 11.596 13.771 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HD1 . . . . . . . . . rr_2m7y 1 . 1 . 607 . 1 1 40 TYR HD2 H 22.018 8.520 16.724 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HD2 . . . . . . . . . rr_2m7y 1 . 1 . 608 . 1 1 40 TYR HE1 H 22.224 9.841 11.937 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HE1 . . . . . . . . . rr_2m7y 1 . 1 . 609 . 1 1 40 TYR HE2 H 21.877 6.776 14.880 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HE2 . . . . . . . . . rr_2m7y 1 . 1 . 610 . 1 1 40 TYR HH H 21.403 7.648 11.607 . . . 1.0 . . . . . . . . . . . . A . 40 TYR HH . . . . . . . . . rr_2m7y 1 . 1 . 611 . 1 1 40 TYR N N 24.588 10.827 15.978 . . . 1.0 . . . . . . . . . . . . A . 40 TYR N . . . . . . . . . rr_2m7y 1 . 1 . 612 . 1 1 40 TYR O O 24.042 11.884 19.247 . . . 1.0 . . . . . . . . . . . . A . 40 TYR O . . . . . . . . . rr_2m7y 1 . 1 . 613 . 1 1 40 TYR OH O 21.969 7.309 12.358 . . . 1.0 . . . . . . . . . . . . A . 40 TYR OH . . . . . . . . . rr_2m7y 1 . 1 . 614 . 1 1 41 ASP C C 24.428 7.667 19.648 . . . 1.0 . . . . . . . . . . . . A . 41 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 615 . 1 1 41 ASP CA C 24.145 9.163 19.803 . . . 1.0 . . . . . . . . . . . . A . 41 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 616 . 1 1 41 ASP CB C 22.891 9.320 20.665 . . . 1.0 . . . . . . . . . . . . A . 41 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 617 . 1 1 41 ASP CG C 22.881 10.552 21.573 . . . 1.0 . . . . . . . . . . . . A . 41 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 618 . 1 1 41 ASP H H 23.857 9.099 17.741 . . . 1.0 . . . . . . . . . . . . A . 41 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 619 . 1 1 41 ASP HA H 24.985 9.702 20.242 . . . 1.0 . . . . . . . . . . . . A . 41 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 620 . 1 1 41 ASP HB2 H 22.021 9.363 20.009 . . . 1.0 . . . . . . . . . . . . A . 41 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 621 . 1 1 41 ASP HB3 H 22.780 8.430 21.284 . . . 1.0 . . . . . . . . . . . . A . 41 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 622 . 1 1 41 ASP HD2 H 23.065 12.393 21.227 . . . 1.0 . . . . . . . . . . . . A . 41 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 623 . 1 1 41 ASP N N 23.956 9.755 18.490 . . . 1.0 . . . . . . . . . . . . A . 41 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 624 . 1 1 41 ASP O O 24.074 7.067 18.634 . . . 1.0 . . . . . . . . . . . . A . 41 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 625 . 1 1 41 ASP OD1 O 23.265 10.481 22.750 . . . 1.0 . . . . . . . . . . . . A . 41 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 626 . 1 1 41 ASP OD2 O 22.449 11.634 21.019 . . . 1.0 . . . . . . . . . . . . A . 41 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 627 . 1 1 42 GLU C C 26.366 5.369 21.795 . . . 1.0 . . . . . . . . . . . . A . 42 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 628 . 1 1 42 GLU CA C 25.396 5.694 20.658 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 629 . 1 1 42 GLU CB C 25.976 5.278 19.305 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 630 . 1 1 42 GLU CD C 27.907 5.782 17.763 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 631 . 1 1 42 GLU CG C 26.886 6.370 18.740 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 632 . 1 1 42 GLU H H 25.346 7.603 21.489 . . . 1.0 . . . . . . . . . . . . A . 42 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 633 . 1 1 42 GLU HA H 24.452 5.172 20.817 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 634 . 1 1 42 GLU HB2 H 26.540 4.351 19.417 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 635 . 1 1 42 GLU HB3 H 25.167 5.075 18.604 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 636 . 1 1 42 GLU HE2 H 29.283 5.978 19.034 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 637 . 1 1 42 GLU HG2 H 26.284 7.123 18.232 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 638 . 1 1 42 GLU HG3 H 27.406 6.874 19.555 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 639 . 1 1 42 GLU N N 25.062 7.108 20.668 . . . 1.0 . . . . . . . . . . . . A . 42 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 640 . 1 1 42 GLU O O 26.991 6.267 22.358 . . . 1.0 . . . . . . . . . . . . A . 42 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 641 . 1 1 42 GLU OE1 O 27.654 5.744 16.550 . . . 1.0 . . . . . . . . . . . . A . 42 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 642 . 1 1 42 GLU OE2 O 28.997 5.356 18.305 . . . 1.0 . . . . . . . . . . . . A . 42 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 643 . 1 1 43 GLU C C 27.637 2.134 23.004 . . . 1.0 . . . . . . . . . . . . A . 43 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 644 . 1 1 43 GLU CA C 27.348 3.629 23.158 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 645 . 1 1 43 GLU CB C 26.756 3.934 24.535 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 646 . 1 1 43 GLU CD C 24.804 3.196 25.952 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 647 . 1 1 43 GLU CG C 25.967 2.737 25.070 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 648 . 1 1 43 GLU H H 25.953 3.359 21.635 . . . 1.0 . . . . . . . . . . . . A . 43 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 649 . 1 1 43 GLU HA H 28.269 4.198 23.031 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 650 . 1 1 43 GLU HB2 H 27.555 4.188 25.231 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 651 . 1 1 43 GLU HB3 H 26.102 4.804 24.469 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 652 . 1 1 43 GLU HE2 H 23.035 3.837 25.890 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 653 . 1 1 43 GLU HG2 H 25.586 2.146 24.237 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 654 . 1 1 43 GLU HG3 H 26.629 2.088 25.644 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 655 . 1 1 43 GLU N N 26.464 4.083 22.098 . . . 1.0 . . . . . . . . . . . . A . 43 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 656 . 1 1 43 GLU O O 27.942 1.453 23.982 . . . 1.0 . . . . . . . . . . . . A . 43 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 657 . 1 1 43 GLU OE1 O 24.999 3.458 27.148 . . . 1.0 . . . . . . . . . . . . A . 43 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 658 . 1 1 43 GLU OE2 O 23.665 3.277 25.352 . . . 1.0 . . . . . . . . . . . . A . 43 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 659 . 1 1 44 TRP C C 28.612 0.191 20.196 . . . 1.0 . . . . . . . . . . . . A . 44 TRP C . . . . . . . . . rr_2m7y 1 . 1 . 660 . 1 1 44 TRP CA C 27.775 0.266 21.474 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CA . . . . . . . . . rr_2m7y 1 . 1 . 661 . 1 1 44 TRP CB C 26.461 -0.512 21.375 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CB . . . . . . . . . rr_2m7y 1 . 1 . 662 . 1 1 44 TRP CD1 C 27.752 -2.734 21.622 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CD1 . . . . . . . . . rr_2m7y 1 . 1 . 663 . 1 1 44 TRP CD2 C 25.613 -3.016 21.117 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CD2 . . . . . . . . . rr_2m7y 1 . 1 . 664 . 1 1 44 TRP CE2 C 26.182 -4.269 21.219 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CE2 . . . . . . . . . rr_2m7y 1 . 1 . 665 . 1 1 44 TRP CE3 C 24.252 -2.852 20.804 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CE3 . . . . . . . . . rr_2m7y 1 . 1 . 666 . 1 1 44 TRP CG C 26.636 -2.032 21.379 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CG . . . . . . . . . rr_2m7y 1 . 1 . 667 . 1 1 44 TRP CH2 C 24.107 -5.317 20.710 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CH2 . . . . . . . . . rr_2m7y 1 . 1 . 668 . 1 1 44 TRP CZ2 C 25.464 -5.455 21.023 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CZ2 . . . . . . . . . rr_2m7y 1 . 1 . 669 . 1 1 44 TRP CZ3 C 23.549 -4.047 20.611 . . . 1.0 . . . . . . . . . . . . A . 44 TRP CZ3 . . . . . . . . . rr_2m7y 1 . 1 . 670 . 1 1 44 TRP H H 27.280 2.228 20.979 . . . 1.0 . . . . . . . . . . . . A . 44 TRP H . . . . . . . . . rr_2m7y 1 . 1 . 671 . 1 1 44 TRP HA H 28.332 -0.158 22.310 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HA . . . . . . . . . rr_2m7y 1 . 1 . 672 . 1 1 44 TRP HB2 H 25.819 -0.229 22.209 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 673 . 1 1 44 TRP HB3 H 25.945 -0.218 20.461 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 674 . 1 1 44 TRP HD1 H 28.718 -2.287 21.858 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HD1 . . . . . . . . . rr_2m7y 1 . 1 . 675 . 1 1 44 TRP HE1 H 28.260 -4.881 21.689 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HE1 . . . . . . . . . rr_2m7y 1 . 1 . 676 . 1 1 44 TRP HE3 H 23.780 -1.874 20.717 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HE3 . . . . . . . . . rr_2m7y 1 . 1 . 677 . 1 1 44 TRP HH2 H 23.490 -6.200 20.545 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HH2 . . . . . . . . . rr_2m7y 1 . 1 . 678 . 1 1 44 TRP HZ2 H 25.937 -6.433 21.110 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HZ2 . . . . . . . . . rr_2m7y 1 . 1 . 679 . 1 1 44 TRP HZ3 H 22.489 -3.978 20.366 . . . 1.0 . . . . . . . . . . . . A . 44 TRP HZ3 . . . . . . . . . rr_2m7y 1 . 1 . 680 . 1 1 44 TRP N N 27.529 1.667 21.769 . . . 1.0 . . . . . . . . . . . . A . 44 TRP N . . . . . . . . . rr_2m7y 1 . 1 . 681 . 1 1 44 TRP NE1 N 27.524 -4.092 21.536 . . . 1.0 . . . . . . . . . . . . A . 44 TRP NE1 . . . . . . . . . rr_2m7y 1 . 1 . 682 . 1 1 44 TRP O O 28.097 0.406 19.099 . . . 1.0 . . . . . . . . . . . . A . 44 TRP O . . . . . . . . . rr_2m7y 1 . 1 . 683 . 1 1 45 TYR C C 30.182 -1.043 18.121 . . . 1.0 . . . . . . . . . . . . A . 45 TYR C . . . . . . . . . rr_2m7y 1 . 1 . 684 . 1 1 45 TYR CA C 30.801 -0.221 19.253 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CA . . . . . . . . . rr_2m7y 1 . 1 . 685 . 1 1 45 TYR CB C 32.037 -0.952 19.781 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CB . . . . . . . . . rr_2m7y 1 . 1 . 686 . 1 1 45 TYR CD1 C 33.078 1.161 20.681 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CD1 . . . . . . . . . rr_2m7y 1 . 1 . 687 . 1 1 45 TYR CD2 C 34.494 -0.420 19.581 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CD2 . . . . . . . . . rr_2m7y 1 . 1 . 688 . 1 1 45 TYR CE1 C 34.212 2.018 20.909 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CE1 . . . . . . . . . rr_2m7y 1 . 1 . 689 . 1 1 45 TYR CE2 C 35.628 0.437 19.809 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CE2 . . . . . . . . . rr_2m7y 1 . 1 . 690 . 1 1 45 TYR CG C 33.242 -0.041 20.022 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CG . . . . . . . . . rr_2m7y 1 . 1 . 691 . 1 1 45 TYR CZ C 35.431 1.614 20.461 . . . 1.0 . . . . . . . . . . . . A . 45 TYR CZ . . . . . . . . . rr_2m7y 1 . 1 . 692 . 1 1 45 TYR H H 30.298 -0.289 21.274 . . . 1.0 . . . . . . . . . . . . A . 45 TYR H . . . . . . . . . rr_2m7y 1 . 1 . 693 . 1 1 45 TYR HA H 31.006 0.786 18.891 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HA . . . . . . . . . rr_2m7y 1 . 1 . 694 . 1 1 45 TYR HB2 H 31.780 -1.452 20.714 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HB2 . . . . . . . . . rr_2m7y 1 . 1 . 695 . 1 1 45 TYR HB3 H 32.319 -1.728 19.070 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HB3 . . . . . . . . . rr_2m7y 1 . 1 . 696 . 1 1 45 TYR HD1 H 32.090 1.460 21.030 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HD1 . . . . . . . . . rr_2m7y 1 . 1 . 697 . 1 1 45 TYR HD2 H 34.624 -1.369 19.061 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HD2 . . . . . . . . . rr_2m7y 1 . 1 . 698 . 1 1 45 TYR HE1 H 34.097 2.970 21.428 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HE1 . . . . . . . . . rr_2m7y 1 . 1 . 699 . 1 1 45 TYR HE2 H 36.622 0.149 19.466 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HE2 . . . . . . . . . rr_2m7y 1 . 1 . 700 . 1 1 45 TYR HH H 37.347 1.945 20.436 . . . 1.0 . . . . . . . . . . . . A . 45 TYR HH . . . . . . . . . rr_2m7y 1 . 1 . 701 . 1 1 45 TYR N N 29.888 -0.115 20.379 . . . 1.0 . . . . . . . . . . . . A . 45 TYR N . . . . . . . . . rr_2m7y 1 . 1 . 702 . 1 1 45 TYR O O 29.100 -1.607 18.277 . . . 1.0 . . . . . . . . . . . . A . 45 TYR O . . . . . . . . . rr_2m7y 1 . 1 . 703 . 1 1 45 TYR OH O 36.503 2.424 20.676 . . . 1.0 . . . . . . . . . . . . A . 45 TYR OH . . . . . . . . . rr_2m7y 1 . 1 . 704 . 1 1 46 PRO C C 30.623 -3.335 16.025 . . . 1.0 . . . . . . . . . . . . A . 46 PRO C . . . . . . . . . rr_2m7y 1 . 1 . 705 . 1 1 46 PRO CA C 30.449 -1.829 15.817 . . . 1.0 . . . . . . . . . . . . A . 46 PRO CA . . . . . . . . . rr_2m7y 1 . 1 . 706 . 1 1 46 PRO CB C 31.264 -1.292 14.651 . . . 1.0 . . . . . . . . . . . . A . 46 PRO CB . . . . . . . . . rr_2m7y 1 . 1 . 707 . 1 1 46 PRO CD C 32.199 -0.430 16.753 . . . 1.0 . . . . . . . . . . . . A . 46 PRO CD . . . . . . . . . rr_2m7y 1 . 1 . 708 . 1 1 46 PRO CG C 32.472 -0.606 15.269 . . . 1.0 . . . . . . . . . . . . A . 46 PRO CG . . . . . . . . . rr_2m7y 1 . 1 . 709 . 1 1 46 PRO HA H 29.468 -1.683 15.682 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HA . . . . . . . . . rr_2m7y 1 . 1 . 710 . 1 1 46 PRO HB2 H 31.570 -2.098 13.985 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HB2 . . . . . . . . . rr_2m7y 1 . 1 . 711 . 1 1 46 PRO HB3 H 30.679 -0.591 14.056 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HB3 . . . . . . . . . rr_2m7y 1 . 1 . 712 . 1 1 46 PRO HD2 H 32.985 -0.884 17.357 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HD2 . . . . . . . . . rr_2m7y 1 . 1 . 713 . 1 1 46 PRO HD3 H 32.158 0.625 17.026 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HD3 . . . . . . . . . rr_2m7y 1 . 1 . 714 . 1 1 46 PRO HG2 H 33.370 -1.204 15.114 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HG2 . . . . . . . . . rr_2m7y 1 . 1 . 715 . 1 1 46 PRO HG3 H 32.646 0.360 14.795 . . . 1.0 . . . . . . . . . . . . A . 46 PRO HG3 . . . . . . . . . rr_2m7y 1 . 1 . 716 . 1 1 46 PRO N N 30.914 -1.085 16.975 . . . 1.0 . . . . . . . . . . . . A . 46 PRO N . . . . . . . . . rr_2m7y 1 . 1 . 717 . 1 1 46 PRO O O 31.570 -3.769 16.679 . . . 1.0 . . . . . . . . . . . . A . 46 PRO O . . . . . . . . . rr_2m7y 1 . 1 . 718 . 1 1 47 GLU C C 28.427 -6.146 15.060 . . . 1.0 . . . . . . . . . . . . A . 47 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 719 . 1 1 47 GLU CA C 29.734 -5.538 15.572 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 720 . 1 1 47 GLU CB C 30.010 -5.966 17.015 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 721 . 1 1 47 GLU CD C 28.809 -5.641 19.208 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 722 . 1 1 47 GLU CG C 29.450 -4.944 18.007 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 723 . 1 1 47 GLU H H 28.927 -3.729 14.927 . . . 1.0 . . . . . . . . . . . . A . 47 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 724 . 1 1 47 GLU HA H 30.563 -5.856 14.940 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 725 . 1 1 47 GLU HB2 H 29.561 -6.941 17.201 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 726 . 1 1 47 GLU HB3 H 31.084 -6.074 17.167 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 727 . 1 1 47 GLU HE2 H 30.276 -5.750 20.383 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 728 . 1 1 47 GLU HG2 H 30.250 -4.286 18.347 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 729 . 1 1 47 GLU HG3 H 28.711 -4.316 17.509 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 730 . 1 1 47 GLU N N 29.694 -4.090 15.457 . . . 1.0 . . . . . . . . . . . . A . 47 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 731 . 1 1 47 GLU O O 27.583 -5.441 14.509 . . . 1.0 . . . . . . . . . . . . A . 47 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 732 . 1 1 47 GLU OE1 O 27.841 -6.398 19.042 . . . 1.0 . . . . . . . . . . . . A . 47 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 733 . 1 1 47 GLU OE2 O 29.351 -5.372 20.348 . . . 1.0 . . . . . . . . . . . . A . 47 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 734 . 1 1 48 GLU C C 26.055 -7.174 14.323 . . . 1.0 . . . . . . . . . . . . A . 48 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 735 . 1 1 48 GLU CA C 27.110 -8.162 14.827 . . . 1.0 . . . . . . . . . . . . A . 48 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 736 . 1 1 48 GLU CB C 26.551 -9.034 15.953 . . . 1.0 . . . . . . . . . . . . A . 48 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 737 . 1 1 48 GLU CD C 27.719 -10.356 17.755 . . . 1.0 . . . . . . . . . . . . A . 48 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 738 . 1 1 48 GLU CG C 27.484 -10.209 16.250 . . . 1.0 . . . . . . . . . . . . A . 48 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 739 . 1 1 48 GLU H H 28.990 -8.016 15.710 . . . 1.0 . . . . . . . . . . . . A . 48 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 740 . 1 1 48 GLU HA H 27.438 -8.802 14.008 . . . 1.0 . . . . . . . . . . . . A . 48 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 741 . 1 1 48 GLU HB2 H 26.420 -8.433 16.852 . . . 1.0 . . . . . . . . . . . . A . 48 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 742 . 1 1 48 GLU HB3 H 25.566 -9.408 15.673 . . . 1.0 . . . . . . . . . . . . A . 48 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 743 . 1 1 48 GLU HE2 H 26.950 -10.037 19.444 . . . 1.0 . . . . . . . . . . . . A . 48 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 744 . 1 1 48 GLU HG2 H 27.054 -11.129 15.854 . . . 1.0 . . . . . . . . . . . . A . 48 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 745 . 1 1 48 GLU HG3 H 28.437 -10.059 15.742 . . . 1.0 . . . . . . . . . . . . A . 48 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 746 . 1 1 48 GLU N N 28.300 -7.450 15.261 . . . 1.0 . . . . . . . . . . . . A . 48 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 747 . 1 1 48 GLU O O 25.185 -6.749 15.082 . . . 1.0 . . . . . . . . . . . . A . 48 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 748 . 1 1 48 GLU OE1 O 28.848 -10.639 18.181 . . . 1.0 . . . . . . . . . . . . A . 48 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 749 . 1 1 48 GLU OE2 O 26.677 -10.163 18.491 . . . 1.0 . . . . . . . . . . . . A . 48 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 750 . 1 1 49 LEU C C 23.832 -6.522 12.439 . . . 1.0 . . . . . . . . . . . . A . 49 LEU C . . . . . . . . . rr_2m7y 1 . 1 . 751 . 1 1 49 LEU CA C 25.233 -5.909 12.433 . . . 1.0 . . . . . . . . . . . . A . 49 LEU CA . . . . . . . . . rr_2m7y 1 . 1 . 752 . 1 1 49 LEU CB C 25.720 -5.501 11.041 . . . 1.0 . . . . . . . . . . . . A . 49 LEU CB . . . . . . . . . rr_2m7y 1 . 1 . 753 . 1 1 49 LEU CD1 C 26.396 -3.192 10.286 . . . 1.0 . . . . . . . . . . . . A . 49 LEU CD1 . . . . . . . . . rr_2m7y 1 . 1 . 754 . 1 1 49 LEU CD2 C 24.359 -4.319 9.278 . . . 1.0 . . . . . . . . . . . . A . 49 LEU CD2 . . . . . . . . . rr_2m7y 1 . 1 . 755 . 1 1 49 LEU CG C 25.226 -4.148 10.527 . . . 1.0 . . . . . . . . . . . . A . 49 LEU CG . . . . . . . . . rr_2m7y 1 . 1 . 756 . 1 1 49 LEU H H 26.877 -7.188 12.436 . . . 1.0 . . . . . . . . . . . . A . 49 LEU H . . . . . . . . . rr_2m7y 1 . 1 . 757 . 1 1 49 LEU HA H 25.219 -5.008 13.046 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HA . . . . . . . . . rr_2m7y 1 . 1 . 758 . 1 1 49 LEU HB2 H 26.810 -5.489 11.048 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 759 . 1 1 49 LEU HB3 H 25.415 -6.270 10.331 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 760 . 1 1 49 LEU HD11 H 26.142 -2.203 10.667 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HD11 . . . . . . . . . rr_2m7y 1 . 1 . 761 . 1 1 49 LEU HD12 H 27.281 -3.563 10.804 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HD12 . . . . . . . . . rr_2m7y 1 . 1 . 762 . 1 1 49 LEU HD13 H 26.600 -3.129 9.217 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HD13 . . . . . . . . . rr_2m7y 1 . 1 . 763 . 1 1 49 LEU HD21 H 23.620 -3.519 9.236 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HD21 . . . . . . . . . rr_2m7y 1 . 1 . 764 . 1 1 49 LEU HD22 H 24.990 -4.276 8.390 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HD22 . . . . . . . . . rr_2m7y 1 . 1 . 765 . 1 1 49 LEU HD23 H 23.851 -5.282 9.317 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HD23 . . . . . . . . . rr_2m7y 1 . 1 . 766 . 1 1 49 LEU HG H 24.597 -3.699 11.296 . . . 1.0 . . . . . . . . . . . . A . 49 LEU HG . . . . . . . . . rr_2m7y 1 . 1 . 767 . 1 1 49 LEU N N 26.167 -6.838 13.047 . . . 1.0 . . . . . . . . . . . . A . 49 LEU N . . . . . . . . . rr_2m7y 1 . 1 . 768 . 1 1 49 LEU O O 23.629 -7.612 12.972 . . . 1.0 . . . . . . . . . . . . A . 49 LEU O . . . . . . . . . rr_2m7y 1 . 1 . 769 . 1 1 50 LEU C C 21.451 -7.506 10.895 . . . 1.0 . . . . . . . . . . . . A . 50 LEU C . . . . . . . . . rr_2m7y 1 . 1 . 770 . 1 1 50 LEU CA C 21.523 -6.253 11.771 . . . 1.0 . . . . . . . . . . . . A . 50 LEU CA . . . . . . . . . rr_2m7y 1 . 1 . 771 . 1 1 50 LEU CB C 20.605 -5.122 11.303 . . . 1.0 . . . . . . . . . . . . A . 50 LEU CB . . . . . . . . . rr_2m7y 1 . 1 . 772 . 1 1 50 LEU CD1 C 20.241 -5.154 8.807 . . . 1.0 . . . . . . . . . . . . A . 50 LEU CD1 . . . . . . . . . rr_2m7y 1 . 1 . 773 . 1 1 50 LEU CD2 C 20.707 -2.964 10.001 . . . 1.0 . . . . . . . . . . . . A . 50 LEU CD2 . . . . . . . . . rr_2m7y 1 . 1 . 774 . 1 1 50 LEU CG C 20.969 -4.471 9.967 . . . 1.0 . . . . . . . . . . . . A . 50 LEU CG . . . . . . . . . rr_2m7y 1 . 1 . 775 . 1 1 50 LEU H H 23.073 -4.909 11.410 . . . 1.0 . . . . . . . . . . . . A . 50 LEU H . . . . . . . . . rr_2m7y 1 . 1 . 776 . 1 1 50 LEU HA H 21.215 -6.520 12.782 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HA . . . . . . . . . rr_2m7y 1 . 1 . 777 . 1 1 50 LEU HB2 H 19.589 -5.512 11.229 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 778 . 1 1 50 LEU HB3 H 20.594 -4.348 12.070 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 779 . 1 1 50 LEU HD11 H 20.931 -5.813 8.282 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HD11 . . . . . . . . . rr_2m7y 1 . 1 . 780 . 1 1 50 LEU HD12 H 19.406 -5.737 9.196 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HD12 . . . . . . . . . rr_2m7y 1 . 1 . 781 . 1 1 50 LEU HD13 H 19.866 -4.397 8.118 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HD13 . . . . . . . . . rr_2m7y 1 . 1 . 782 . 1 1 50 LEU HD21 H 21.233 -2.523 10.848 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HD21 . . . . . . . . . rr_2m7y 1 . 1 . 783 . 1 1 50 LEU HD22 H 21.064 -2.512 9.076 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HD22 . . . . . . . . . rr_2m7y 1 . 1 . 784 . 1 1 50 LEU HD23 H 19.637 -2.784 10.104 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HD23 . . . . . . . . . rr_2m7y 1 . 1 . 785 . 1 1 50 LEU HG H 22.038 -4.608 9.801 . . . 1.0 . . . . . . . . . . . . A . 50 LEU HG . . . . . . . . . rr_2m7y 1 . 1 . 786 . 1 1 50 LEU N N 22.900 -5.794 11.841 . . . 1.0 . . . . . . . . . . . . A . 50 LEU N . . . . . . . . . rr_2m7y 1 . 1 . 787 . 1 1 50 LEU O O 20.991 -7.446 9.756 . . . 1.0 . . . . . . . . . . . . A . 50 LEU O . . . . . . . . . rr_2m7y 1 . 1 . 788 . 1 1 51 THR C C 22.783 -9.786 9.495 . . . 1.0 . . . . . . . . . . . . A . 51 THR C . . . . . . . . . rr_2m7y 1 . 1 . 789 . 1 1 51 THR CA C 21.906 -9.876 10.746 . . . 1.0 . . . . . . . . . . . . A . 51 THR CA . . . . . . . . . rr_2m7y 1 . 1 . 790 . 1 1 51 THR CB C 20.452 -10.242 10.444 . . . 1.0 . . . . . . . . . . . . A . 51 THR CB . . . . . . . . . rr_2m7y 1 . 1 . 791 . 1 1 51 THR CG2 C 20.269 -11.734 10.162 . . . 1.0 . . . . . . . . . . . . A . 51 THR CG2 . . . . . . . . . rr_2m7y 1 . 1 . 792 . 1 1 51 THR H H 22.285 -8.652 12.388 . . . 1.0 . . . . . . . . . . . . A . 51 THR H . . . . . . . . . rr_2m7y 1 . 1 . 793 . 1 1 51 THR HA H 22.346 -10.637 11.391 . . . 1.0 . . . . . . . . . . . . A . 51 THR HA . . . . . . . . . rr_2m7y 1 . 1 . 794 . 1 1 51 THR HB H 20.062 -9.640 9.624 . . . 1.0 . . . . . . . . . . . . A . 51 THR HB . . . . . . . . . rr_2m7y 1 . 1 . 795 . 1 1 51 THR HG1 H 18.909 -9.569 11.527 . . . 1.0 . . . . . . . . . . . . A . 51 THR HG1 . . . . . . . . . rr_2m7y 1 . 1 . 796 . 1 1 51 THR HG21 H 19.451 -11.873 9.456 . . . 1.0 . . . . . . . . . . . . A . 51 THR HG21 . . . . . . . . . rr_2m7y 1 . 1 . 797 . 1 1 51 THR HG22 H 21.188 -12.139 9.737 . . . 1.0 . . . . . . . . . . . . A . 51 THR HG22 . . . . . . . . . rr_2m7y 1 . 1 . 798 . 1 1 51 THR HG23 H 20.039 -12.254 11.092 . . . 1.0 . . . . . . . . . . . . A . 51 THR HG23 . . . . . . . . . rr_2m7y 1 . 1 . 799 . 1 1 51 THR N N 21.912 -8.611 11.461 . . . 1.0 . . . . . . . . . . . . A . 51 THR N . . . . . . . . . rr_2m7y 1 . 1 . 800 . 1 1 51 THR O O 22.686 -10.628 8.604 . . . 1.0 . . . . . . . . . . . . A . 51 THR O . . . . . . . . . rr_2m7y 1 . 1 . 801 . 1 1 51 THR OG1 O 19.778 -10.038 11.683 . . . 1.0 . . . . . . . . . . . . A . 51 THR OG1 . . . . . . . . . rr_2m7y 1 . 1 . 802 . 1 1 52 ASP C C 25.956 -8.766 8.795 . . . 1.0 . . . . . . . . . . . . A . 52 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 803 . 1 1 52 ASP CA C 24.511 -8.547 8.343 . . . 1.0 . . . . . . . . . . . . A . 52 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 804 . 1 1 52 ASP CB C 24.394 -7.119 7.807 . . . 1.0 . . . . . . . . . . . . A . 52 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 805 . 1 1 52 ASP CG C 24.639 -6.970 6.304 . . . 1.0 . . . . . . . . . . . . A . 52 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 806 . 1 1 52 ASP H H 23.690 -8.078 10.199 . . . 1.0 . . . . . . . . . . . . A . 52 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 807 . 1 1 52 ASP HA H 24.196 -9.269 7.589 . . . 1.0 . . . . . . . . . . . . A . 52 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 808 . 1 1 52 ASP HB2 H 23.397 -6.742 8.036 . . . 1.0 . . . . . . . . . . . . A . 52 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 809 . 1 1 52 ASP HB3 H 25.104 -6.488 8.341 . . . 1.0 . . . . . . . . . . . . A . 52 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 810 . 1 1 52 ASP HD2 H 25.793 -7.791 5.063 . . . 1.0 . . . . . . . . . . . . A . 52 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 811 . 1 1 52 ASP N N 23.618 -8.758 9.470 . . . 1.0 . . . . . . . . . . . . A . 52 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 812 . 1 1 52 ASP O O 26.873 -8.771 7.975 . . . 1.0 . . . . . . . . . . . . A . 52 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 813 . 1 1 52 ASP OD1 O 24.426 -5.894 5.726 . . . 1.0 . . . . . . . . . . . . A . 52 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 814 . 1 1 52 ASP OD2 O 25.074 -8.032 5.715 . . . 1.0 . . . . . . . . . . . . A . 52 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 815 . 1 1 53 GLY C C 28.485 -8.302 9.963 . . . 1.0 . . . . . . . . . . . . A . 53 GLY C . . . . . . . . . rr_2m7y 1 . 1 . 816 . 1 1 53 GLY CA C 27.433 -9.158 10.670 . . . 1.0 . . . . . . . . . . . . A . 53 GLY CA . . . . . . . . . rr_2m7y 1 . 1 . 817 . 1 1 53 GLY H H 25.364 -8.934 10.759 . . . 1.0 . . . . . . . . . . . . A . 53 GLY H . . . . . . . . . rr_2m7y 1 . 1 . 818 . 1 1 53 GLY HA2 H 27.417 -8.917 11.733 . . . 1.0 . . . . . . . . . . . . A . 53 GLY HA2 . . . . . . . . . rr_2m7y 1 . 1 . 819 . 1 1 53 GLY HA3 H 27.700 -10.212 10.586 . . . 1.0 . . . . . . . . . . . . A . 53 GLY HA3 . . . . . . . . . rr_2m7y 1 . 1 . 820 . 1 1 53 GLY N N 26.115 -8.940 10.099 . . . 1.0 . . . . . . . . . . . . A . 53 GLY N . . . . . . . . . rr_2m7y 1 . 1 . 821 . 1 1 53 GLY O O 29.649 -8.691 9.873 . . . 1.0 . . . . . . . . . . . . A . 53 GLY O . . . . . . . . . rr_2m7y 1 . 1 . 822 . 1 1 54 GLU C C 29.908 -5.598 9.767 . . . 1.0 . . . . . . . . . . . . A . 54 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 823 . 1 1 54 GLU CA C 28.927 -6.238 8.782 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 824 . 1 1 54 GLU CB C 28.133 -5.170 8.027 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 825 . 1 1 54 GLU CD C 28.103 -2.776 7.236 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 826 . 1 1 54 GLU CG C 28.872 -3.830 8.034 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 827 . 1 1 54 GLU H H 27.091 -6.844 9.556 . . . 1.0 . . . . . . . . . . . . A . 54 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 828 . 1 1 54 GLU HA H 29.471 -6.852 8.065 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 829 . 1 1 54 GLU HB2 H 27.968 -5.493 6.999 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 830 . 1 1 54 GLU HB3 H 27.151 -5.050 8.485 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 831 . 1 1 54 GLU HE2 H 27.426 -1.371 8.291 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 832 . 1 1 54 GLU HG2 H 29.004 -3.489 9.061 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 833 . 1 1 54 GLU HG3 H 29.868 -3.958 7.610 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 834 . 1 1 54 GLU N N 28.038 -7.152 9.479 . . . 1.0 . . . . . . . . . . . . A . 54 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 835 . 1 1 54 GLU O O 30.867 -4.945 9.357 . . . 1.0 . . . . . . . . . . . . A . 54 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 836 . 1 1 54 GLU OE1 O 27.451 -3.109 6.235 . . . 1.0 . . . . . . . . . . . . A . 54 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 837 . 1 1 54 GLU OE2 O 28.198 -1.572 7.689 . . . 1.0 . . . . . . . . . . . . A . 54 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 838 . 1 1 55 ASP C C 30.129 -3.786 12.308 . . . 1.0 . . . . . . . . . . . . A . 55 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 839 . 1 1 55 ASP CA C 30.481 -5.260 12.092 . . . 1.0 . . . . . . . . . . . . A . 55 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 840 . 1 1 55 ASP CB C 31.959 -5.341 11.704 . . . 1.0 . . . . . . . . . . . . A . 55 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 841 . 1 1 55 ASP CG C 32.934 -5.394 12.881 . . . 1.0 . . . . . . . . . . . . A . 55 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 842 . 1 1 55 ASP H H 28.853 -6.340 11.371 . . . 1.0 . . . . . . . . . . . . A . 55 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 843 . 1 1 55 ASP HA H 30.280 -5.870 12.973 . . . 1.0 . . . . . . . . . . . . A . 55 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 844 . 1 1 55 ASP HB2 H 32.109 -6.226 11.086 . . . 1.0 . . . . . . . . . . . . A . 55 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 845 . 1 1 55 ASP HB3 H 32.204 -4.477 11.087 . . . 1.0 . . . . . . . . . . . . A . 55 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 846 . 1 1 55 ASP HD2 H 33.245 -6.116 14.592 . . . 1.0 . . . . . . . . . . . . A . 55 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 847 . 1 1 55 ASP N N 29.634 -5.808 11.046 . . . 1.0 . . . . . . . . . . . . A . 55 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 848 . 1 1 55 ASP O O 30.896 -2.900 11.934 . . . 1.0 . . . . . . . . . . . . A . 55 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 849 . 1 1 55 ASP OD1 O 34.021 -4.798 12.837 . . . 1.0 . . . . . . . . . . . . A . 55 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 850 . 1 1 55 ASP OD2 O 32.535 -6.094 13.889 . . . 1.0 . . . . . . . . . . . . A . 55 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 851 . 1 1 56 ASP C C 27.095 -2.277 13.770 . . . 1.0 . . . . . . . . . . . . A . 56 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 852 . 1 1 56 ASP CA C 28.505 -2.220 13.178 . . . 1.0 . . . . . . . . . . . . A . 56 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 853 . 1 1 56 ASP CB C 28.446 -1.391 11.894 . . . 1.0 . . . . . . . . . . . . A . 56 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 854 . 1 1 56 ASP CG C 29.487 -0.274 11.796 . . . 1.0 . . . . . . . . . . . . A . 56 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 855 . 1 1 56 ASP H H 28.350 -4.297 13.209 . . . 1.0 . . . . . . . . . . . . A . 56 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 856 . 1 1 56 ASP HA H 29.232 -1.801 13.874 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 857 . 1 1 56 ASP HB2 H 28.571 -2.060 11.042 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 858 . 1 1 56 ASP HB3 H 27.452 -0.950 11.809 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 859 . 1 1 56 ASP HD2 H 30.492 -1.515 10.797 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 860 . 1 1 56 ASP N N 28.968 -3.570 12.909 . . . 1.0 . . . . . . . . . . . . A . 56 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 861 . 1 1 56 ASP O O 26.108 -2.171 13.043 . . . 1.0 . . . . . . . . . . . . A . 56 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 862 . 1 1 56 ASP OD1 O 29.314 0.812 12.369 . . . 1.0 . . . . . . . . . . . . A . 56 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 863 . 1 1 56 ASP OD2 O 30.525 -0.558 11.085 . . . 1.0 . . . . . . . . . . . . A . 56 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 864 . 1 1 57 VAL C C 25.579 -1.250 16.614 . . . 1.0 . . . . . . . . . . . . A . 57 VAL C . . . . . . . . . rr_2m7y 1 . 1 . 865 . 1 1 57 VAL CA C 25.772 -2.518 15.780 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CA . . . . . . . . . rr_2m7y 1 . 1 . 866 . 1 1 57 VAL CB C 25.705 -3.798 16.615 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CB . . . . . . . . . rr_2m7y 1 . 1 . 867 . 1 1 57 VAL CG1 C 26.463 -3.633 17.934 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CG1 . . . . . . . . . rr_2m7y 1 . 1 . 868 . 1 1 57 VAL CG2 C 24.254 -4.215 16.865 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CG2 . . . . . . . . . rr_2m7y 1 . 1 . 869 . 1 1 57 VAL H H 27.852 -2.531 15.667 . . . 1.0 . . . . . . . . . . . . A . 57 VAL H . . . . . . . . . rr_2m7y 1 . 1 . 870 . 1 1 57 VAL HA H 24.986 -2.565 15.026 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HA . . . . . . . . . rr_2m7y 1 . 1 . 871 . 1 1 57 VAL HB H 26.189 -4.594 16.048 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HB . . . . . . . . . rr_2m7y 1 . 1 . 872 . 1 1 57 VAL HG11 H 26.877 -4.594 18.237 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG11 . . . . . . . . . rr_2m7y 1 . 1 . 873 . 1 1 57 VAL HG12 H 27.272 -2.914 17.800 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG12 . . . . . . . . . rr_2m7y 1 . 1 . 874 . 1 1 57 VAL HG13 H 25.780 -3.273 18.703 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG13 . . . . . . . . . rr_2m7y 1 . 1 . 875 . 1 1 57 VAL HG21 H 23.898 -4.813 16.026 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG21 . . . . . . . . . rr_2m7y 1 . 1 . 876 . 1 1 57 VAL HG22 H 24.198 -4.803 17.780 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG22 . . . . . . . . . rr_2m7y 1 . 1 . 877 . 1 1 57 VAL HG23 H 23.633 -3.325 16.966 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG23 . . . . . . . . . rr_2m7y 1 . 1 . 878 . 1 1 57 VAL N N 27.045 -2.445 15.083 . . . 1.0 . . . . . . . . . . . . A . 57 VAL N . . . . . . . . . rr_2m7y 1 . 1 . 879 . 1 1 57 VAL O O 25.319 -1.325 17.814 . . . 1.0 . . . . . . . . . . . . A . 57 VAL O . . . . . . . . . rr_2m7y 1 . 1 . 880 . 1 1 58 PHE C C 24.322 1.171 17.514 . . . 1.0 . . . . . . . . . . . . A . 58 PHE C . . . . . . . . . rr_2m7y 1 . 1 . 881 . 1 1 58 PHE CA C 25.556 1.169 16.609 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CA . . . . . . . . . rr_2m7y 1 . 1 . 882 . 1 1 58 PHE CB C 25.372 2.220 15.513 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CB . . . . . . . . . rr_2m7y 1 . 1 . 883 . 1 1 58 PHE CD1 C 24.529 1.152 13.411 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CD1 . . . . . . . . . rr_2m7y 1 . 1 . 884 . 1 1 58 PHE CD2 C 22.993 2.344 14.741 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CD2 . . . . . . . . . rr_2m7y 1 . 1 . 885 . 1 1 58 PHE CE1 C 23.494 0.849 12.487 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CE1 . . . . . . . . . rr_2m7y 1 . 1 . 886 . 1 1 58 PHE CE2 C 21.958 2.041 13.817 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CE2 . . . . . . . . . rr_2m7y 1 . 1 . 887 . 1 1 58 PHE CG C 24.257 1.893 14.518 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CG . . . . . . . . . rr_2m7y 1 . 1 . 888 . 1 1 58 PHE CZ C 22.230 1.299 12.710 . . . 1.0 . . . . . . . . . . . . A . 58 PHE CZ . . . . . . . . . rr_2m7y 1 . 1 . 889 . 1 1 58 PHE H H 25.924 -0.061 14.969 . . . 1.0 . . . . . . . . . . . . A . 58 PHE H . . . . . . . . . rr_2m7y 1 . 1 . 890 . 1 1 58 PHE HA H 26.448 1.331 17.214 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HA . . . . . . . . . rr_2m7y 1 . 1 . 891 . 1 1 58 PHE HB2 H 25.159 3.183 15.979 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HB2 . . . . . . . . . rr_2m7y 1 . 1 . 892 . 1 1 58 PHE HB3 H 26.310 2.331 14.969 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HB3 . . . . . . . . . rr_2m7y 1 . 1 . 893 . 1 1 58 PHE HD1 H 25.542 0.791 13.232 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HD1 . . . . . . . . . rr_2m7y 1 . 1 . 894 . 1 1 58 PHE HD2 H 22.775 2.938 15.628 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HD2 . . . . . . . . . rr_2m7y 1 . 1 . 895 . 1 1 58 PHE HE1 H 23.712 0.254 11.600 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HE1 . . . . . . . . . rr_2m7y 1 . 1 . 896 . 1 1 58 PHE HE2 H 20.945 2.402 13.996 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HE2 . . . . . . . . . rr_2m7y 1 . 1 . 897 . 1 1 58 PHE HZ H 21.436 1.066 12.001 . . . 1.0 . . . . . . . . . . . . A . 58 PHE HZ . . . . . . . . . rr_2m7y 1 . 1 . 898 . 1 1 58 PHE N N 25.713 -0.114 15.945 . . . 1.0 . . . . . . . . . . . . A . 58 PHE N . . . . . . . . . rr_2m7y 1 . 1 . 899 . 1 1 58 PHE O O 23.192 1.162 17.028 . . . 1.0 . . . . . . . . . . . . A . 58 PHE O . . . . . . . . . rr_2m7y 1 . 1 . 900 . 1 1 59 ASP C C 22.649 2.439 19.596 . . . 1.0 . . . . . . . . . . . . A . 59 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 901 . 1 1 59 ASP CA C 23.506 1.186 19.790 . . . 1.0 . . . . . . . . . . . . A . 59 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 902 . 1 1 59 ASP CB C 24.058 1.208 21.217 . . . 1.0 . . . . . . . . . . . . A . 59 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 903 . 1 1 59 ASP CG C 23.360 2.185 22.165 . . . 1.0 . . . . . . . . . . . . A . 59 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 904 . 1 1 59 ASP H H 25.503 1.190 19.200 . . . 1.0 . . . . . . . . . . . . A . 59 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 905 . 1 1 59 ASP HA H 22.949 0.267 19.606 . . . 1.0 . . . . . . . . . . . . A . 59 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 906 . 1 1 59 ASP HB2 H 23.983 0.203 21.635 . . . 1.0 . . . . . . . . . . . . A . 59 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 907 . 1 1 59 ASP HB3 H 25.118 1.458 21.177 . . . 1.0 . . . . . . . . . . . . A . 59 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 908 . 1 1 59 ASP HD2 H 21.710 1.419 22.651 . . . 1.0 . . . . . . . . . . . . A . 59 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 909 . 1 1 59 ASP N N 24.581 1.183 18.813 . . . 1.0 . . . . . . . . . . . . A . 59 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 910 . 1 1 59 ASP O O 23.169 3.553 19.575 . . . 1.0 . . . . . . . . . . . . A . 59 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 911 . 1 1 59 ASP OD1 O 24.015 2.917 22.922 . . . 1.0 . . . . . . . . . . . . A . 59 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 912 . 1 1 59 ASP OD2 O 22.072 2.175 22.107 . . . 1.0 . . . . . . . . . . . . A . 59 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 913 . 1 1 60 PRO C C 20.148 4.060 20.571 . . . 1.0 . . . . . . . . . . . . A . 60 PRO C . . . . . . . . . rr_2m7y 1 . 1 . 914 . 1 1 60 PRO CA C 20.383 3.304 19.262 . . . 1.0 . . . . . . . . . . . . A . 60 PRO CA . . . . . . . . . rr_2m7y 1 . 1 . 915 . 1 1 60 PRO CB C 19.122 2.656 18.716 . . . 1.0 . . . . . . . . . . . . A . 60 PRO CB . . . . . . . . . rr_2m7y 1 . 1 . 916 . 1 1 60 PRO CD C 20.665 0.901 19.473 . . . 1.0 . . . . . . . . . . . . A . 60 PRO CD . . . . . . . . . rr_2m7y 1 . 1 . 917 . 1 1 60 PRO CG C 19.230 1.179 19.058 . . . 1.0 . . . . . . . . . . . . A . 60 PRO CG . . . . . . . . . rr_2m7y 1 . 1 . 918 . 1 1 60 PRO HA H 20.762 3.975 18.623 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HA . . . . . . . . . rr_2m7y 1 . 1 . 919 . 1 1 60 PRO HB2 H 18.231 3.097 19.163 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HB2 . . . . . . . . . rr_2m7y 1 . 1 . 920 . 1 1 60 PRO HB3 H 19.042 2.802 17.638 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HB3 . . . . . . . . . rr_2m7y 1 . 1 . 921 . 1 1 60 PRO HD2 H 20.711 0.450 20.465 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HD2 . . . . . . . . . rr_2m7y 1 . 1 . 922 . 1 1 60 PRO HD3 H 21.149 0.207 18.785 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HD3 . . . . . . . . . rr_2m7y 1 . 1 . 923 . 1 1 60 PRO HG2 H 18.543 0.923 19.865 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HG2 . . . . . . . . . rr_2m7y 1 . 1 . 924 . 1 1 60 PRO HG3 H 18.955 0.567 18.199 . . . 1.0 . . . . . . . . . . . . A . 60 PRO HG3 . . . . . . . . . rr_2m7y 1 . 1 . 925 . 1 1 60 PRO N N 21.317 2.208 19.454 . . . 1.0 . . . . . . . . . . . . A . 60 PRO N . . . . . . . . . rr_2m7y 1 . 1 . 926 . 1 1 60 PRO O O 19.009 4.206 21.012 . . . 1.0 . . . . . . . . . . . . A . 60 PRO O . . . . . . . . . rr_2m7y 1 . 1 . 927 . 1 1 61 ASP C C 20.663 6.675 22.129 . . . 1.0 . . . . . . . . . . . . A . 61 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 928 . 1 1 61 ASP CA C 21.172 5.259 22.406 . . . 1.0 . . . . . . . . . . . . A . 61 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 929 . 1 1 61 ASP CB C 22.550 5.371 23.060 . . . 1.0 . . . . . . . . . . . . A . 61 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 930 . 1 1 61 ASP CG C 23.000 6.798 23.380 . . . 1.0 . . . . . . . . . . . . A . 61 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 931 . 1 1 61 ASP H H 22.167 4.398 20.791 . . . 1.0 . . . . . . . . . . . . A . 61 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 932 . 1 1 61 ASP HA H 20.491 4.687 23.037 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 933 . 1 1 61 ASP HB2 H 22.546 4.791 23.983 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 934 . 1 1 61 ASP HB3 H 23.287 4.913 22.400 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 935 . 1 1 61 ASP HD2 H 22.669 7.926 24.851 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 936 . 1 1 61 ASP N N 21.244 4.521 21.156 . . . 1.0 . . . . . . . . . . . . A . 61 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 937 . 1 1 61 ASP O O 20.950 7.247 21.078 . . . 1.0 . . . . . . . . . . . . A . 61 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 938 . 1 1 61 ASP OD1 O 24.081 7.236 22.960 . . . 1.0 . . . . . . . . . . . . A . 61 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 939 . 1 1 61 ASP OD2 O 22.177 7.478 24.105 . . . 1.0 . . . . . . . . . . . . A . 61 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 940 . 1 1 62 LEU C C 18.909 8.762 21.520 . . . 1.0 . . . . . . . . . . . . A . 62 LEU C . . . . . . . . . rr_2m7y 1 . 1 . 941 . 1 1 62 LEU CA C 19.366 8.538 22.963 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CA . . . . . . . . . rr_2m7y 1 . 1 . 942 . 1 1 62 LEU CB C 20.371 9.580 23.458 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CB . . . . . . . . . rr_2m7y 1 . 1 . 943 . 1 1 62 LEU CD1 C 18.629 11.316 22.898 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CD1 . . . . . . . . . rr_2m7y 1 . 1 . 944 . 1 1 62 LEU CD2 C 20.849 12.016 23.907 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CD2 . . . . . . . . . rr_2m7y 1 . 1 . 945 . 1 1 62 LEU CG C 20.126 11.019 22.998 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CG . . . . . . . . . rr_2m7y 1 . 1 . 946 . 1 1 62 LEU H H 19.689 6.728 23.941 . . . 1.0 . . . . . . . . . . . . A . 62 LEU H . . . . . . . . . rr_2m7y 1 . 1 . 947 . 1 1 62 LEU HA H 18.494 8.596 23.614 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HA . . . . . . . . . rr_2m7y 1 . 1 . 948 . 1 1 62 LEU HB2 H 20.374 9.564 24.548 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 949 . 1 1 62 LEU HB3 H 21.366 9.280 23.132 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 950 . 1 1 62 LEU HD11 H 18.068 10.527 23.399 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD11 . . . . . . . . . rr_2m7y 1 . 1 . 951 . 1 1 62 LEU HD12 H 18.415 12.273 23.375 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD12 . . . . . . . . . rr_2m7y 1 . 1 . 952 . 1 1 62 LEU HD13 H 18.336 11.359 21.849 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD13 . . . . . . . . . rr_2m7y 1 . 1 . 953 . 1 1 62 LEU HD21 H 20.120 12.686 24.362 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD21 . . . . . . . . . rr_2m7y 1 . 1 . 954 . 1 1 62 LEU HD22 H 21.382 11.474 24.688 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD22 . . . . . . . . . rr_2m7y 1 . 1 . 955 . 1 1 62 LEU HD23 H 21.559 12.596 23.318 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD23 . . . . . . . . . rr_2m7y 1 . 1 . 956 . 1 1 62 LEU HG H 20.544 11.134 21.998 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HG . . . . . . . . . rr_2m7y 1 . 1 . 957 . 1 1 62 LEU N N 19.917 7.200 23.090 . . . 1.0 . . . . . . . . . . . . A . 62 LEU N . . . . . . . . . rr_2m7y 1 . 1 . 958 . 1 1 62 LEU O O 19.363 9.694 20.858 . . . 1.0 . . . . . . . . . . . . A . 62 LEU O . . . . . . . . . rr_2m7y 1 . 1 . 959 . 1 1 63 ASP C C 16.650 6.739 19.421 . . . 1.0 . . . . . . . . . . . . A . 63 ASP C . . . . . . . . . rr_2m7y 1 . 1 . 960 . 1 1 63 ASP CA C 17.491 7.982 19.722 . . . 1.0 . . . . . . . . . . . . A . 63 ASP CA . . . . . . . . . rr_2m7y 1 . 1 . 961 . 1 1 63 ASP CB C 18.624 8.045 18.696 . . . 1.0 . . . . . . . . . . . . A . 63 ASP CB . . . . . . . . . rr_2m7y 1 . 1 . 962 . 1 1 63 ASP CG C 18.879 9.431 18.100 . . . 1.0 . . . . . . . . . . . . A . 63 ASP CG . . . . . . . . . rr_2m7y 1 . 1 . 963 . 1 1 63 ASP H H 17.651 7.136 21.619 . . . 1.0 . . . . . . . . . . . . A . 63 ASP H . . . . . . . . . rr_2m7y 1 . 1 . 964 . 1 1 63 ASP HA H 16.902 8.899 19.704 . . . 1.0 . . . . . . . . . . . . A . 63 ASP HA . . . . . . . . . rr_2m7y 1 . 1 . 965 . 1 1 63 ASP HB2 H 19.542 7.695 19.168 . . . 1.0 . . . . . . . . . . . . A . 63 ASP HB2 . . . . . . . . . rr_2m7y 1 . 1 . 966 . 1 1 63 ASP HB3 H 18.399 7.353 17.884 . . . 1.0 . . . . . . . . . . . . A . 63 ASP HB3 . . . . . . . . . rr_2m7y 1 . 1 . 967 . 1 1 63 ASP HD2 H 19.856 9.122 16.519 . . . 1.0 . . . . . . . . . . . . A . 63 ASP HD2 . . . . . . . . . rr_2m7y 1 . 1 . 968 . 1 1 63 ASP N N 18.015 7.891 21.074 . . . 1.0 . . . . . . . . . . . . A . 63 ASP N . . . . . . . . . rr_2m7y 1 . 1 . 969 . 1 1 63 ASP O O 17.145 5.778 18.835 . . . 1.0 . . . . . . . . . . . . A . 63 ASP O . . . . . . . . . rr_2m7y 1 . 1 . 970 . 1 1 63 ASP OD1 O 18.076 10.360 18.275 . . . 1.0 . . . . . . . . . . . . A . 63 ASP OD1 . . . . . . . . . rr_2m7y 1 . 1 . 971 . 1 1 63 ASP OD2 O 19.971 9.540 17.420 . . . 1.0 . . . . . . . . . . . . A . 63 ASP OD2 . . . . . . . . . rr_2m7y 1 . 1 . 972 . 1 1 64 MET C C 13.059 6.197 19.353 . . . 1.0 . . . . . . . . . . . . A . 64 MET C . . . . . . . . . rr_2m7y 1 . 1 . 973 . 1 1 64 MET CA C 14.479 5.692 19.619 . . . 1.0 . . . . . . . . . . . . A . 64 MET CA . . . . . . . . . rr_2m7y 1 . 1 . 974 . 1 1 64 MET CB C 14.476 4.783 20.849 . . . 1.0 . . . . . . . . . . . . A . 64 MET CB . . . . . . . . . rr_2m7y 1 . 1 . 975 . 1 1 64 MET CE C 15.712 1.206 21.524 . . . 1.0 . . . . . . . . . . . . A . 64 MET CE . . . . . . . . . rr_2m7y 1 . 1 . 976 . 1 1 64 MET CG C 14.343 3.313 20.445 . . . 1.0 . . . . . . . . . . . . A . 64 MET CG . . . . . . . . . rr_2m7y 1 . 1 . 977 . 1 1 64 MET H H 14.999 7.586 20.313 . . . 1.0 . . . . . . . . . . . . A . 64 MET H . . . . . . . . . rr_2m7y 1 . 1 . 978 . 1 1 64 MET HA H 14.857 5.169 18.740 . . . 1.0 . . . . . . . . . . . . A . 64 MET HA . . . . . . . . . rr_2m7y 1 . 1 . 979 . 1 1 64 MET HB2 H 15.397 4.926 21.414 . . . 1.0 . . . . . . . . . . . . A . 64 MET HB2 . . . . . . . . . rr_2m7y 1 . 1 . 980 . 1 1 64 MET HB3 H 13.652 5.059 21.508 . . . 1.0 . . . . . . . . . . . . A . 64 MET HB3 . . . . . . . . . rr_2m7y 1 . 1 . 981 . 1 1 64 MET HE1 H 15.100 1.548 22.359 . . . 1.0 . . . . . . . . . . . . A . 64 MET HE1 . . . . . . . . . rr_2m7y 1 . 1 . 982 . 1 1 64 MET HE2 H 15.209 0.382 21.017 . . . 1.0 . . . . . . . . . . . . A . 64 MET HE2 . . . . . . . . . rr_2m7y 1 . 1 . 983 . 1 1 64 MET HE3 H 16.679 0.867 21.897 . . . 1.0 . . . . . . . . . . . . A . 64 MET HE3 . . . . . . . . . rr_2m7y 1 . 1 . 984 . 1 1 64 MET HG2 H 13.713 2.786 21.161 . . . 1.0 . . . . . . . . . . . . A . 64 MET HG2 . . . . . . . . . rr_2m7y 1 . 1 . 985 . 1 1 64 MET HG3 H 13.854 3.238 19.474 . . . 1.0 . . . . . . . . . . . . A . 64 MET HG3 . . . . . . . . . rr_2m7y 1 . 1 . 986 . 1 1 64 MET N N 15.393 6.800 19.836 . . . 1.0 . . . . . . . . . . . . A . 64 MET N . . . . . . . . . rr_2m7y 1 . 1 . 987 . 1 1 64 MET O O 12.873 7.322 18.892 . . . 1.0 . . . . . . . . . . . . A . 64 MET O . . . . . . . . . rr_2m7y 1 . 1 . 988 . 1 1 64 MET SD S 15.956 2.551 20.375 . . . 1.0 . . . . . . . . . . . . A . 64 MET SD . . . . . . . . . rr_2m7y 1 . 1 . 989 . 1 1 65 GLU C C 10.131 6.354 20.711 . . . 1.0 . . . . . . . . . . . . A . 65 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 990 . 1 1 65 GLU CA C 10.698 5.686 19.457 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 991 . 1 1 65 GLU CB C 9.877 4.452 19.075 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 992 . 1 1 65 GLU CD C 8.450 4.905 17.046 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 993 . 1 1 65 GLU CG C 9.767 4.316 17.555 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 994 . 1 1 65 GLU H H 12.255 4.428 20.032 . . . 1.0 . . . . . . . . . . . . A . 65 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 995 . 1 1 65 GLU HA H 10.689 6.391 18.626 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 996 . 1 1 65 GLU HB2 H 10.343 3.558 19.490 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 997 . 1 1 65 GLU HB3 H 8.881 4.524 19.510 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 998 . 1 1 65 GLU HE2 H 6.787 4.162 17.525 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 999 . 1 1 65 GLU HG2 H 10.605 4.825 17.079 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 1000 . 1 1 65 GLU HG3 H 9.832 3.265 17.274 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 1001 . 1 1 65 GLU N N 12.095 5.341 19.657 . . . 1.0 . . . . . . . . . . . . A . 65 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 1002 . 1 1 65 GLU O O 8.973 6.138 21.064 . . . 1.0 . . . . . . . . . . . . A . 65 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 1003 . 1 1 65 GLU OE1 O 8.348 6.127 16.858 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 1004 . 1 1 65 GLU OE2 O 7.510 4.045 16.844 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 1005 . 1 1 66 VAL C C 11.814 8.409 23.257 . . . 1.0 . . . . . . . . . . . . A . 66 VAL C . . . . . . . . . rr_2m7y 1 . 1 . 1006 . 1 1 66 VAL CA C 10.572 7.852 22.558 . . . 1.0 . . . . . . . . . . . . A . 66 VAL CA . . . . . . . . . rr_2m7y 1 . 1 . 1007 . 1 1 66 VAL CB C 9.749 6.923 23.453 . . . 1.0 . . . . . . . . . . . . A . 66 VAL CB . . . . . . . . . rr_2m7y 1 . 1 . 1008 . 1 1 66 VAL CG1 C 10.261 5.484 23.367 . . . 1.0 . . . . . . . . . . . . A . 66 VAL CG1 . . . . . . . . . rr_2m7y 1 . 1 . 1009 . 1 1 66 VAL CG2 C 9.744 7.418 24.900 . . . 1.0 . . . . . . . . . . . . A . 66 VAL CG2 . . . . . . . . . rr_2m7y 1 . 1 . 1010 . 1 1 66 VAL H H 11.915 7.321 21.057 . . . 1.0 . . . . . . . . . . . . A . 66 VAL H . . . . . . . . . rr_2m7y 1 . 1 . 1011 . 1 1 66 VAL HA H 9.935 8.684 22.259 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HA . . . . . . . . . rr_2m7y 1 . 1 . 1012 . 1 1 66 VAL HB H 8.721 6.935 23.091 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HB . . . . . . . . . rr_2m7y 1 . 1 . 1013 . 1 1 66 VAL HG11 H 10.331 5.063 24.370 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HG11 . . . . . . . . . rr_2m7y 1 . 1 . 1014 . 1 1 66 VAL HG12 H 9.571 4.888 22.770 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HG12 . . . . . . . . . rr_2m7y 1 . 1 . 1015 . 1 1 66 VAL HG13 H 11.246 5.476 22.900 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HG13 . . . . . . . . . rr_2m7y 1 . 1 . 1016 . 1 1 66 VAL HG21 H 9.402 8.453 24.929 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HG21 . . . . . . . . . rr_2m7y 1 . 1 . 1017 . 1 1 66 VAL HG22 H 9.074 6.797 25.494 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HG22 . . . . . . . . . rr_2m7y 1 . 1 . 1018 . 1 1 66 VAL HG23 H 10.753 7.358 25.308 . . . 1.0 . . . . . . . . . . . . A . 66 VAL HG23 . . . . . . . . . rr_2m7y 1 . 1 . 1019 . 1 1 66 VAL N N 10.974 7.151 21.350 . . . 1.0 . . . . . . . . . . . . A . 66 VAL N . . . . . . . . . rr_2m7y 1 . 1 . 1020 . 1 1 66 VAL O O 11.745 9.438 23.927 . . . 1.0 . . . . . . . . . . . . A . 66 VAL O . . . . . . . . . rr_2m7y 1 . 1 . 1021 . 1 1 67 VAL C C 14.873 9.123 22.765 . . . 1.0 . . . . . . . . . . . . A . 67 VAL C . . . . . . . . . rr_2m7y 1 . 1 . 1022 . 1 1 67 VAL CA C 14.177 8.115 23.682 . . . 1.0 . . . . . . . . . . . . A . 67 VAL CA . . . . . . . . . rr_2m7y 1 . 1 . 1023 . 1 1 67 VAL CB C 15.039 6.888 23.984 . . . 1.0 . . . . . . . . . . . . A . 67 VAL CB . . . . . . . . . rr_2m7y 1 . 1 . 1024 . 1 1 67 VAL CG1 C 16.458 7.299 24.382 . . . 1.0 . . . . . . . . . . . . A . 67 VAL CG1 . . . . . . . . . rr_2m7y 1 . 1 . 1025 . 1 1 67 VAL CG2 C 14.395 6.020 25.068 . . . 1.0 . . . . . . . . . . . . A . 67 VAL CG2 . . . . . . . . . rr_2m7y 1 . 1 . 1026 . 1 1 67 VAL H H 12.969 6.868 22.530 . . . 1.0 . . . . . . . . . . . . A . 67 VAL H . . . . . . . . . rr_2m7y 1 . 1 . 1027 . 1 1 67 VAL HA H 13.942 8.604 24.627 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HA . . . . . . . . . rr_2m7y 1 . 1 . 1028 . 1 1 67 VAL HB H 15.105 6.292 23.074 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HB . . . . . . . . . rr_2m7y 1 . 1 . 1029 . 1 1 67 VAL HG11 H 16.468 8.354 24.654 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HG11 . . . . . . . . . rr_2m7y 1 . 1 . 1030 . 1 1 67 VAL HG12 H 16.784 6.701 25.234 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HG12 . . . . . . . . . rr_2m7y 1 . 1 . 1031 . 1 1 67 VAL HG13 H 17.133 7.133 23.542 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HG13 . . . . . . . . . rr_2m7y 1 . 1 . 1032 . 1 1 67 VAL HG21 H 14.031 6.656 25.874 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HG21 . . . . . . . . . rr_2m7y 1 . 1 . 1033 . 1 1 67 VAL HG22 H 13.562 5.463 24.640 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HG22 . . . . . . . . . rr_2m7y 1 . 1 . 1034 . 1 1 67 VAL HG23 H 15.135 5.322 25.461 . . . 1.0 . . . . . . . . . . . . A . 67 VAL HG23 . . . . . . . . . rr_2m7y 1 . 1 . 1035 . 1 1 67 VAL N N 12.921 7.704 23.077 . . . 1.0 . . . . . . . . . . . . A . 67 VAL N . . . . . . . . . rr_2m7y 1 . 1 . 1036 . 1 1 67 VAL O O 16.064 8.994 22.486 . . . 1.0 . . . . . . . . . . . . A . 67 VAL O . . . . . . . . . rr_2m7y 1 . 1 . 1037 . 1 1 68 PHE C C 14.472 12.522 22.069 . . . 1.0 . . . . . . . . . . . . A . 68 PHE C . . . . . . . . . rr_2m7y 1 . 1 . 1038 . 1 1 68 PHE CA C 14.629 11.134 21.444 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CA . . . . . . . . . rr_2m7y 1 . 1 . 1039 . 1 1 68 PHE CB C 13.817 11.076 20.149 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CB . . . . . . . . . rr_2m7y 1 . 1 . 1040 . 1 1 68 PHE CD1 C 15.492 12.256 18.709 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CD1 . . . . . . . . . rr_2m7y 1 . 1 . 1041 . 1 1 68 PHE CD2 C 13.254 12.985 18.629 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CD2 . . . . . . . . . rr_2m7y 1 . 1 . 1042 . 1 1 68 PHE CE1 C 15.850 13.249 17.759 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CE1 . . . . . . . . . rr_2m7y 1 . 1 . 1043 . 1 1 68 PHE CE2 C 13.611 13.978 17.678 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CE2 . . . . . . . . . rr_2m7y 1 . 1 . 1044 . 1 1 68 PHE CG C 14.202 12.145 19.124 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CG . . . . . . . . . rr_2m7y 1 . 1 . 1045 . 1 1 68 PHE CZ C 14.901 14.088 17.263 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CZ . . . . . . . . . rr_2m7y 1 . 1 . 1046 . 1 1 68 PHE H H 13.133 10.203 22.555 . . . 1.0 . . . . . . . . . . . . A . 68 PHE H . . . . . . . . . rr_2m7y 1 . 1 . 1047 . 1 1 68 PHE HA H 15.688 10.922 21.297 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HA . . . . . . . . . rr_2m7y 1 . 1 . 1048 . 1 1 68 PHE HB2 H 13.944 10.092 19.697 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HB2 . . . . . . . . . rr_2m7y 1 . 1 . 1049 . 1 1 68 PHE HB3 H 12.759 11.183 20.390 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HB3 . . . . . . . . . rr_2m7y 1 . 1 . 1050 . 1 1 68 PHE HD1 H 16.252 11.583 19.106 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HD1 . . . . . . . . . rr_2m7y 1 . 1 . 1051 . 1 1 68 PHE HD2 H 12.220 12.896 18.962 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HD2 . . . . . . . . . rr_2m7y 1 . 1 . 1052 . 1 1 68 PHE HE1 H 16.884 13.338 17.426 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HE1 . . . . . . . . . rr_2m7y 1 . 1 . 1053 . 1 1 68 PHE HE2 H 12.851 14.651 17.281 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HE2 . . . . . . . . . rr_2m7y 1 . 1 . 1054 . 1 1 68 PHE HZ H 15.176 14.850 16.533 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HZ . . . . . . . . . rr_2m7y 1 . 1 . 1055 . 1 1 68 PHE N N 14.101 10.105 22.323 . . . 1.0 . . . . . . . . . . . . A . 68 PHE N . . . . . . . . . rr_2m7y 1 . 1 . 1056 . 1 1 68 PHE O O 14.248 13.503 21.362 . . . 1.0 . . . . . . . . . . . . A . 68 PHE O . . . . . . . . . rr_2m7y 1 . 1 . 1057 . 1 1 69 GLU C C 14.430 13.547 25.622 . . . 1.0 . . . . . . . . . . . . A . 69 GLU C . . . . . . . . . rr_2m7y 1 . 1 . 1058 . 1 1 69 GLU CA C 14.468 13.811 24.115 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CA . . . . . . . . . rr_2m7y 1 . 1 . 1059 . 1 1 69 GLU CB C 13.229 14.586 23.663 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CB . . . . . . . . . rr_2m7y 1 . 1 . 1060 . 1 1 69 GLU CD C 14.067 16.860 24.360 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CD . . . . . . . . . rr_2m7y 1 . 1 . 1061 . 1 1 69 GLU CG C 13.604 15.991 23.189 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CG . . . . . . . . . rr_2m7y 1 . 1 . 1062 . 1 1 69 GLU H H 14.776 11.757 23.955 . . . 1.0 . . . . . . . . . . . . A . 69 GLU H . . . . . . . . . rr_2m7y 1 . 1 . 1063 . 1 1 69 GLU HA H 15.360 14.384 23.862 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HA . . . . . . . . . rr_2m7y 1 . 1 . 1064 . 1 1 69 GLU HB2 H 12.732 14.047 22.857 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HB2 . . . . . . . . . rr_2m7y 1 . 1 . 1065 . 1 1 69 GLU HB3 H 12.518 14.654 24.486 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HB3 . . . . . . . . . rr_2m7y 1 . 1 . 1066 . 1 1 69 GLU HE2 H 15.124 18.337 24.858 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HE2 . . . . . . . . . rr_2m7y 1 . 1 . 1067 . 1 1 69 GLU HG2 H 14.397 15.928 22.443 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HG2 . . . . . . . . . rr_2m7y 1 . 1 . 1068 . 1 1 69 GLU HG3 H 12.746 16.456 22.703 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HG3 . . . . . . . . . rr_2m7y 1 . 1 . 1069 . 1 1 69 GLU N N 14.594 12.560 23.388 . . . 1.0 . . . . . . . . . . . . A . 69 GLU N . . . . . . . . . rr_2m7y 1 . 1 . 1070 . 1 1 69 GLU O O 14.909 14.361 26.411 . . . 1.0 . . . . . . . . . . . . A . 69 GLU O . . . . . . . . . rr_2m7y 1 . 1 . 1071 . 1 1 69 GLU OE1 O 13.626 16.651 25.500 . . . 1.0 . . . . . . . . . . . . A . 69 GLU OE1 . . . . . . . . . rr_2m7y 1 . 1 . 1072 . 1 1 69 GLU OE2 O 14.917 17.781 24.053 . . . 1.0 . . . . . . . . . . . . A . 69 GLU OE2 . . . . . . . . . rr_2m7y 1 . 1 . 1073 . 1 1 70 THR C C 15.124 11.642 27.929 . . . 1.0 . . . . . . . . . . . . A . 70 THR C . . . . . . . . . rr_2m7y 1 . 1 . 1074 . 1 1 70 THR CA C 13.751 12.025 27.375 . . . 1.0 . . . . . . . . . . . . A . 70 THR CA . . . . . . . . . rr_2m7y 1 . 1 . 1075 . 1 1 70 THR CB C 12.717 10.902 27.481 . . . 1.0 . . . . . . . . . . . . A . 70 THR CB . . . . . . . . . rr_2m7y 1 . 1 . 1076 . 1 1 70 THR CG2 C 12.732 10.220 28.851 . . . 1.0 . . . . . . . . . . . . A . 70 THR CG2 . . . . . . . . . rr_2m7y 1 . 1 . 1077 . 1 1 70 THR H H 13.471 11.750 25.329 . . . 1.0 . . . . . . . . . . . . A . 70 THR H . . . . . . . . . rr_2m7y 1 . 1 . 1078 . 1 1 70 THR HA H 13.407 12.890 27.941 . . . 1.0 . . . . . . . . . . . . A . 70 THR HA . . . . . . . . . rr_2m7y 1 . 1 . 1079 . 1 1 70 THR HB H 12.851 10.173 26.682 . . . 1.0 . . . . . . . . . . . . A . 70 THR HB . . . . . . . . . rr_2m7y 1 . 1 . 1080 . 1 1 70 THR HG1 H 11.487 12.305 26.757 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG1 . . . . . . . . . rr_2m7y 1 . 1 . 1081 . 1 1 70 THR HG21 H 13.314 9.300 28.792 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG21 . . . . . . . . . rr_2m7y 1 . 1 . 1082 . 1 1 70 THR HG22 H 13.183 10.888 29.584 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG22 . . . . . . . . . rr_2m7y 1 . 1 . 1083 . 1 1 70 THR HG23 H 11.711 9.986 29.151 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG23 . . . . . . . . . rr_2m7y 1 . 1 . 1084 . 1 1 70 THR N N 13.857 12.406 25.977 . . . 1.0 . . . . . . . . . . . . A . 70 THR N . . . . . . . . . rr_2m7y 1 . 1 . 1085 . 1 1 70 THR O O 15.886 12.505 28.361 . . . 1.0 . . . . . . . . . . . . A . 70 THR O . . . . . . . . . rr_2m7y 1 . 1 . 1086 . 1 1 70 THR OG1 O 11.464 11.579 27.444 . . . 1.0 . . . . . . . . . . . . A . 70 THR OG1 . . . . . . . . . rr_2m7y 1 . 1 . 1087 . 1 1 71 GLN C C 17.016 8.518 27.700 . . . 1.0 . . . . . . . . . . . . A . 71 GLN C . . . . . . . . . rr_2m7y 1 . 1 . 1088 . 1 1 71 GLN CA C 16.666 9.837 28.393 . . . 1.0 . . . . . . . . . . . . A . 71 GLN CA . . . . . . . . . rr_2m7y 1 . 1 . 1089 . 1 1 71 GLN CB C 16.634 9.666 29.913 . . . 1.0 . . . . . . . . . . . . A . 71 GLN CB . . . . . . . . . rr_2m7y 1 . 1 . 1090 . 1 1 71 GLN CD C 16.857 7.208 30.433 . . . 1.0 . . . . . . . . . . . . A . 71 GLN CD . . . . . . . . . rr_2m7y 1 . 1 . 1091 . 1 1 71 GLN CG C 17.584 8.553 30.360 . . . 1.0 . . . . . . . . . . . . A . 71 GLN CG . . . . . . . . . rr_2m7y 1 . 1 . 1092 . 1 1 71 GLN H H 14.772 9.650 27.546 . . . 1.0 . . . . . . . . . . . . A . 71 GLN H . . . . . . . . . rr_2m7y 1 . 1 . 1093 . 1 1 71 GLN HA H 17.404 10.597 28.135 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HA . . . . . . . . . rr_2m7y 1 . 1 . 1094 . 1 1 71 GLN HB2 H 16.914 10.603 30.394 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HB2 . . . . . . . . . rr_2m7y 1 . 1 . 1095 . 1 1 71 GLN HB3 H 15.619 9.433 30.234 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HB3 . . . . . . . . . rr_2m7y 1 . 1 . 1096 . 1 1 71 GLN HE21 H 18.624 6.332 30.892 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HE21 . . . . . . . . . rr_2m7y 1 . 1 . 1097 . 1 1 71 GLN HE22 H 17.266 5.261 30.808 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HE22 . . . . . . . . . rr_2m7y 1 . 1 . 1098 . 1 1 71 GLN HG2 H 18.419 8.482 29.663 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HG2 . . . . . . . . . rr_2m7y 1 . 1 . 1099 . 1 1 71 GLN HG3 H 18.003 8.798 31.336 . . . 1.0 . . . . . . . . . . . . A . 71 GLN HG3 . . . . . . . . . rr_2m7y 1 . 1 . 1100 . 1 1 71 GLN N N 15.398 10.346 27.899 . . . 1.0 . . . . . . . . . . . . A . 71 GLN N . . . . . . . . . rr_2m7y 1 . 1 . 1101 . 1 1 71 GLN NE2 N 17.648 6.183 30.736 . . . 1.0 . . . . . . . . . . . . A . 71 GLN NE2 . . . . . . . . . rr_2m7y 1 . 1 . 1102 . 1 1 71 GLN O O 16.184 7.615 27.621 . . . 1.0 . . . . . . . . . . . . A . 71 GLN O . . . . . . . . . rr_2m7y 1 . 1 . 1103 . 1 1 71 GLN OE1 O 15.659 7.109 30.228 . . . 1.0 . . . . . . . . . . . . A . 71 GLN OE1 . . . . . . . . . rr_2m7y 1 . 1 . 1104 . 2 2 1 ZN ZN Zn 11.512 2.043 5.499 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . rr_2m7y 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID rr_2m7y _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 2m7y.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 rr_2m7y 1 1 2m7y.mr . . XPLOR/CNS 2 'dihedral angle' 'Not applicable' 'Not applicable' 20 rr_2m7y 1 1 2m7y.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 rr_2m7y 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Entry_ID rr_2m7y _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 2 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . rr_2m7y 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 '! I13' 1 1 1 7 rr_2m7y 1 2 '! C14' 4 1 4 7 rr_2m7y 1 3 '! A15' 7 1 7 7 rr_2m7y 1 4 '! H16' 10 1 10 7 rr_2m7y 1 5 '! S17' 13 1 13 7 rr_2m7y 1 6 '! M18' 16 1 16 7 rr_2m7y 1 7 '! T19' 19 1 19 7 rr_2m7y 1 8 '! F20' 22 1 22 7 rr_2m7y 1 9 '! E21' 25 1 25 7 rr_2m7y 1 10 '! E22' 28 1 28 7 rr_2m7y 1 11 '! C23' 31 1 31 7 rr_2m7y 1 12 ; ! P24 assign (resid 23 and name C) (resid 24 and name N) (resid 24 and name CA) (resid 24 and name C) 1 -61.00 14.00 2 ! K25 ; 34 1 37 7 rr_2m7y 1 13 '! C26' 40 1 40 7 rr_2m7y 1 14 '! S27' 43 1 43 7 rr_2m7y 1 15 '! A28' 46 1 46 7 rr_2m7y 1 16 '! L29' 49 1 49 7 rr_2m7y 1 17 '! W44' 52 1 52 7 rr_2m7y 1 18 '! Y45' 55 1 55 7 rr_2m7y 1 19 ; ! P46 assign (resid 45 and name C) (resid 46 and name N) (resid 46 and name CA) (resid 46 and name C) 1 -66.00 12.00 2 ! F58 ; 58 1 61 7 rr_2m7y 1 20 '! D59' 64 1 64 7 rr_2m7y 1 stop_ loop_ _TA_constraint_conv_err.ID _TA_constraint_conv_err.Parse_file_ID _TA_constraint_conv_err.Parse_file_constraint_ID _TA_constraint_conv_err.Conv_error_type _TA_constraint_conv_err.Conv_error_note _TA_constraint_conv_err.Entry_ID _TA_constraint_conv_err.Torsion_angle_constraint_list_ID 1 2 1 1 "Not handling restraint 1, resonance(s) ' .12.C' (nmrStar names),' .13.N' (nmrStar names),' .13.CA' (nmrStar names),' .13.C' (nmrStar names) not linked" rr_2m7y 1 2 2 2 1 "Not handling restraint 2, resonance(s) ' .13.C' (nmrStar names),' .14.N' (nmrStar names),' .14.CA' (nmrStar names),' .14.C' (nmrStar names) not linked" rr_2m7y 1 3 2 3 1 "Not handling restraint 3, resonance(s) ' .14.C' (nmrStar names),' .15.N' (nmrStar names),' .15.CA' (nmrStar names),' .15.C' (nmrStar names) not linked" rr_2m7y 1 4 2 4 1 "Not handling restraint 4, resonance(s) ' .15.C' (nmrStar names),' .16.N' (nmrStar names),' .16.CA' (nmrStar names),' .16.C' (nmrStar names) not linked" rr_2m7y 1 5 2 5 1 "Not handling restraint 5, resonance(s) ' .16.C' (nmrStar names),' .17.N' (nmrStar names),' .17.CA' (nmrStar names),' .17.C' (nmrStar names) not linked" rr_2m7y 1 6 2 6 1 "Not handling restraint 6, resonance(s) ' .17.C' (nmrStar names),' .18.N' (nmrStar names),' .18.CA' (nmrStar names),' .18.C' (nmrStar names) not linked" rr_2m7y 1 7 2 7 1 "Not handling restraint 7, resonance(s) ' .18.C' (nmrStar names),' .19.N' (nmrStar names),' .19.CA' (nmrStar names),' .19.C' (nmrStar names) not linked" rr_2m7y 1 8 2 8 1 "Not handling restraint 8, resonance(s) ' .19.C' (nmrStar names),' .20.N' (nmrStar names),' .20.CA' (nmrStar names),' .20.C' (nmrStar names) not linked" rr_2m7y 1 9 2 9 1 "Not handling restraint 9, resonance(s) ' .20.C' (nmrStar names),' .21.N' (nmrStar names),' .21.CA' (nmrStar names),' .21.C' (nmrStar names) not linked" rr_2m7y 1 10 2 10 1 "Not handling restraint 10, resonance(s) ' .21.C' (nmrStar names),' .22.N' (nmrStar names),' .22.CA' (nmrStar names),' .22.C' (nmrStar names) not linked" rr_2m7y 1 11 2 11 1 "Not handling restraint 11, resonance(s) ' .22.C' (nmrStar names),' .23.N' (nmrStar names),' .23.CA' (nmrStar names),' .23.C' (nmrStar names) not linked" rr_2m7y 1 12 2 12 1 "Not handling restraint 12, resonance(s) ' .24.C' (nmrStar names),' .25.N' (nmrStar names),' .25.CA' (nmrStar names),' .25.C' (nmrStar names) not linked" rr_2m7y 1 13 2 13 1 "Not handling restraint 13, resonance(s) ' .25.C' (nmrStar names),' .26.N' (nmrStar names),' .26.CA' (nmrStar names),' .26.C' (nmrStar names) not linked" rr_2m7y 1 14 2 14 1 "Not handling restraint 14, resonance(s) ' .26.C' (nmrStar names),' .27.N' (nmrStar names),' .27.CA' (nmrStar names),' .27.C' (nmrStar names) not linked" rr_2m7y 1 15 2 15 1 "Not handling restraint 15, resonance(s) ' .27.C' (nmrStar names),' .28.N' (nmrStar names),' .28.CA' (nmrStar names),' .28.C' (nmrStar names) not linked" rr_2m7y 1 16 2 16 1 "Not handling restraint 16, resonance(s) ' .28.C' (nmrStar names),' .29.N' (nmrStar names),' .29.CA' (nmrStar names),' .29.C' (nmrStar names) not linked" rr_2m7y 1 17 2 17 1 "Not handling restraint 17, resonance(s) ' .43.C' (nmrStar names),' .44.N' (nmrStar names),' .44.CA' (nmrStar names),' .44.C' (nmrStar names) not linked" rr_2m7y 1 18 2 18 1 "Not handling restraint 18, resonance(s) ' .44.C' (nmrStar names),' .45.N' (nmrStar names),' .45.CA' (nmrStar names),' .45.C' (nmrStar names) not linked" rr_2m7y 1 19 2 19 1 "Not handling restraint 19, resonance(s) ' .57.C' (nmrStar names),' .58.N' (nmrStar names),' .58.CA' (nmrStar names),' .58.C' (nmrStar names) not linked" rr_2m7y 1 20 2 20 1 "Not handling restraint 20, resonance(s) ' .58.C' (nmrStar names),' .59.N' (nmrStar names),' .59.CA' (nmrStar names),' .59.C' (nmrStar names) not linked" rr_2m7y 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_2m7y _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 VIRAL PROTEIN 02-MAY-13 2M7Y *TITLE THE MENGOVIRUS LEADER PROTEIN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: LEADER PEPTIDE; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: MENGO VIRUS; *SOURCE 3 ORGANISM_TAXID: 12107; *SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; *SOURCE 6 EXPRESSION_SYSTEM_VECTOR: PET41B *KEYWDS CARDIOVIRUS, VIRAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 1 *AUTHOR C.C.CORNILESCU, F.W.PORTER, K.Q.ZHAO, V.DAVIS, A.C.PALMENBERG, *AUTHOR 2 J.L.MARKLEY *REVDAT 1 23-OCT-13 2M7Y 0' save_