NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
520134 | 2lh8 | 17834 | cing | 4-filtered-FRED | STAR | entry | full | 5 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lh8 # This FRED archive file contains, for PDB entry <2lh8>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2lh8 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lh8 _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 12710.04 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $Major_prion_protein A . 1 1 2 . 2 $3__4_AMINO_2_METHYL_PYRIMIDIN_5_YLMETHYL__5__2_HYDROXY_ETHYL__4_METHYL_THIAZ B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 VIB 1 VIB 1 1 stop_ save_ save_Major_prion_protein _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Major prion protein" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code LGGYMLGSAMSRPMMHFGNDWEDRYYRENMNRYPNQVYYRPVDQYNNQNNFVHDCVNITIKQHTVTTTTKGENFTETDIKIMERVVEQMCTTQYQKESQAYYDG _Entity.Number_of_monomers 104 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 LEU . 1 1 2 GLY . 1 1 3 GLY . 1 1 4 TYR . 1 1 5 MET . 1 1 6 LEU . 1 1 7 GLY . 1 1 8 SER . 1 1 9 ALA . 1 1 10 MET . 1 1 11 SER . 1 1 12 ARG . 1 1 13 PRO . 1 1 14 MET . 1 1 15 MET . 1 1 16 HIS . 1 1 17 PHE . 1 1 18 GLY . 1 1 19 ASN . 1 1 20 ASP . 1 1 21 TRP . 1 1 22 GLU . 1 1 23 ASP . 1 1 24 ARG . 1 1 25 TYR . 1 1 26 TYR . 1 1 27 ARG . 1 1 28 GLU . 1 1 29 ASN . 1 1 30 MET . 1 1 31 ASN . 1 1 32 ARG . 1 1 33 TYR . 1 1 34 PRO . 1 1 35 ASN . 1 1 36 GLN . 1 1 37 VAL . 1 1 38 TYR . 1 1 39 TYR . 1 1 40 ARG . 1 1 41 PRO . 1 1 42 VAL . 1 1 43 ASP . 1 1 44 GLN . 1 1 45 TYR . 1 1 46 ASN . 1 1 47 ASN . 1 1 48 GLN . 1 1 49 ASN . 1 1 50 ASN . 1 1 51 PHE . 1 1 52 VAL . 1 1 53 HIS . 1 1 54 ASP . 1 1 55 CYS . 1 1 56 VAL . 1 1 57 ASN . 1 1 58 ILE . 1 1 59 THR . 1 1 60 ILE . 1 1 61 LYS . 1 1 62 GLN . 1 1 63 HIS . 1 1 64 THR . 1 1 65 VAL . 1 1 66 THR . 1 1 67 THR . 1 1 68 THR . 1 1 69 THR . 1 1 70 LYS . 1 1 71 GLY . 1 1 72 GLU . 1 1 73 ASN . 1 1 74 PHE . 1 1 75 THR . 1 1 76 GLU . 1 1 77 THR . 1 1 78 ASP . 1 1 79 ILE . 1 1 80 LYS . 1 1 81 ILE . 1 1 82 MET . 1 1 83 GLU . 1 1 84 ARG . 1 1 85 VAL . 1 1 86 VAL . 1 1 87 GLU . 1 1 88 GLN . 1 1 89 MET . 1 1 90 CYS . 1 1 91 THR . 1 1 92 THR . 1 1 93 GLN . 1 1 94 TYR . 1 1 95 GLN . 1 1 96 LYS . 1 1 97 GLU . 1 1 98 SER . 1 1 99 GLN . 1 1 100 ALA . 1 1 101 TYR . 1 1 102 TYR . 1 1 103 ASP . 1 1 104 GLY . 1 1 stop_ loop_ _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 LEU 1 1 1 1 GLY 2 2 1 1 GLY 3 3 1 1 TYR 4 4 1 1 MET 5 5 1 1 LEU 6 6 1 1 GLY 7 7 1 1 SER 8 8 1 1 ALA 9 9 1 1 MET 10 10 1 1 SER 11 11 1 1 ARG 12 12 1 1 PRO 13 13 1 1 MET 14 14 1 1 MET 15 15 1 1 HIS 16 16 1 1 PHE 17 17 1 1 GLY 18 18 1 1 ASN 19 19 1 1 ASP 20 20 1 1 TRP 21 21 1 1 GLU 22 22 1 1 ASP 23 23 1 1 ARG 24 24 1 1 TYR 25 25 1 1 TYR 26 26 1 1 ARG 27 27 1 1 GLU 28 28 1 1 ASN 29 29 1 1 MET 30 30 1 1 ASN 31 31 1 1 ARG 32 32 1 1 TYR 33 33 1 1 PRO 34 34 1 1 ASN 35 35 1 1 GLN 36 36 1 1 VAL 37 37 1 1 TYR 38 38 1 1 TYR 39 39 1 1 ARG 40 40 1 1 PRO 41 41 1 1 VAL 42 42 1 1 ASP 43 43 1 1 GLN 44 44 1 1 TYR 45 45 1 1 ASN 46 46 1 1 ASN 47 47 1 1 GLN 48 48 1 1 ASN 49 49 1 1 ASN 50 50 1 1 PHE 51 51 1 1 VAL 52 52 1 1 HIS 53 53 1 1 ASP 54 54 1 1 CYS 55 55 1 1 VAL 56 56 1 1 ASN 57 57 1 1 ILE 58 58 1 1 THR 59 59 1 1 ILE 60 60 1 1 LYS 61 61 1 1 GLN 62 62 1 1 HIS 63 63 1 1 THR 64 64 1 1 VAL 65 65 1 1 THR 66 66 1 1 THR 67 67 1 1 THR 68 68 1 1 THR 69 69 1 1 LYS 70 70 1 1 GLY 71 71 1 1 GLU 72 72 1 1 ASN 73 73 1 1 PHE 74 74 1 1 THR 75 75 1 1 GLU 76 76 1 1 THR 77 77 1 1 ASP 78 78 1 1 ILE 79 79 1 1 LYS 80 80 1 1 ILE 81 81 1 1 MET 82 82 1 1 GLU 83 83 1 1 ARG 84 84 1 1 VAL 85 85 1 1 VAL 86 86 1 1 GLU 87 87 1 1 GLN 88 88 1 1 MET 89 89 1 1 CYS 90 90 1 1 THR 91 91 1 1 THR 92 92 1 1 GLN 93 93 1 1 TYR 94 94 1 1 GLN 95 95 1 1 LYS 96 96 1 1 GLU 97 97 1 1 SER 98 98 1 1 GLN 99 99 1 1 ALA 100 100 1 1 TYR 101 101 1 1 TYR 102 102 1 1 ASP 103 103 1 1 GLY 104 104 1 1 stop_ save_ save_3__4_AMINO_2_METHYL_PYRIMIDIN_5_YLMETHYL__5__2_HYDROXY_ETHYL__4_METHYL_THIAZ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "3 4 AMINO 2 METHYL PYRIMIDIN 5 YLMETHYL 5 2 HYDROXY ETHYL 4 METHYL THIAZ" _Entity.Type non-polymer loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 VIB $VIB 1 2 stop_ save_ save_VIB _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID VIB _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 14 MET HA . 138 . HA 1 1 1 1 2 2 2 1 VIB H6AC . 1 . H 1 1 2 1 1 1 1 15 MET HA . 139 . HA 1 1 2 1 2 2 2 1 VIB H6AC . 1 . H 1 1 3 1 1 1 1 16 HIS QB . 140 . HB# 1 1 3 1 2 2 2 1 VIB HC2 . 1 . H8 1 1 4 1 1 1 1 18 GLY H . 142 . HN 1 1 4 1 2 2 2 1 VIB HO1 . 1 . H12 1 1 5 1 1 1 1 26 TYR QR . 150 . HD# 1 1 5 1 2 2 2 1 VIB H6AC . 1 . H 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.0 1.8 2.7 1 1 2 1 . . . . . 2.0 1.8 5.0 1 1 3 1 . . . . . 2.0 1.8 2.7 1 1 4 1 . . . . . 2.0 1.8 2.7 1 1 5 1 . . . . . 2.0 1.8 2.7 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.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.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _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.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 LEU C C 11.843 -10.971 -6.068 1.00 . A A . 35 LEU C 1 1 1 2 1 1 1 LEU CA C 11.436 -11.442 -4.675 1.00 . A A . 35 LEU CA 1 1 1 3 1 1 1 LEU CB C 11.549 -10.290 -3.654 1.00 . A A . 35 LEU CB 1 1 1 4 1 1 1 LEU CD1 C 11.277 -9.428 -1.311 1.00 . A A . 35 LEU CD1 1 1 1 5 1 1 1 LEU CD2 C 9.850 -11.322 -2.044 1.00 . A A . 35 LEU CD2 1 1 1 6 1 1 1 LEU CG C 11.225 -10.668 -2.195 1.00 . A A . 35 LEU CG 1 1 1 7 1 1 1 LEU H1 H 11.733 -13.092 -3.473 1.00 . A A . 35 LEU H1 1 1 1 8 1 1 1 LEU H2 H 13.133 -12.453 -4.050 1.00 . A A . 35 LEU H2 1 1 1 9 1 1 1 LEU H3 H 12.160 -13.339 -5.042 1.00 . A A . 35 LEU H3 1 1 1 10 1 1 1 LEU HA H 10.378 -11.696 -4.757 1.00 . A A . 35 LEU HA 1 1 1 11 1 1 1 LEU HB2 H 12.558 -9.876 -3.686 1.00 . A A . 35 LEU HB2 1 1 1 12 1 1 1 LEU HB3 H 10.861 -9.501 -3.965 1.00 . A A . 35 LEU HB3 1 1 1 13 1 1 1 LEU HD11 H 12.260 -8.960 -1.381 1.00 . A A . 35 LEU HD11 1 1 1 14 1 1 1 LEU HD12 H 11.112 -9.704 -0.269 1.00 . A A . 35 LEU HD12 1 1 1 15 1 1 1 LEU HD13 H 10.519 -8.705 -1.612 1.00 . A A . 35 LEU HD13 1 1 1 16 1 1 1 LEU HD21 H 9.662 -11.514 -0.985 1.00 . A A . 35 LEU HD21 1 1 1 17 1 1 1 LEU HD22 H 9.798 -12.274 -2.568 1.00 . A A . 35 LEU HD22 1 1 1 18 1 1 1 LEU HD23 H 9.071 -10.652 -2.411 1.00 . A A . 35 LEU HD23 1 1 1 19 1 1 1 LEU HG H 11.981 -11.372 -1.847 1.00 . A A . 35 LEU HG 1 1 1 20 1 1 1 LEU N N 12.172 -12.670 -4.281 1.00 . A A . 35 LEU N 1 1 1 21 1 1 1 LEU O O 10.963 -10.792 -6.891 1.00 . A A . 35 LEU O 1 1 1 22 1 1 2 GLY C C 14.474 -8.983 -7.426 1.00 . A A . 36 GLY C 1 1 1 23 1 1 2 GLY CA C 13.671 -10.272 -7.607 1.00 . A A . 36 GLY CA 1 1 1 24 1 1 2 GLY H H 13.824 -10.848 -5.590 1.00 . A A . 36 GLY H 1 1 1 25 1 1 2 GLY HA2 H 14.329 -11.027 -8.042 1.00 . A A . 36 GLY HA2 1 1 1 26 1 1 2 GLY HA3 H 12.865 -10.073 -8.315 1.00 . A A . 36 GLY HA3 1 1 1 27 1 1 2 GLY N N 13.137 -10.753 -6.322 1.00 . A A . 36 GLY N 1 1 1 28 1 1 2 GLY O O 15.651 -8.953 -7.745 1.00 . A A . 36 GLY O 1 1 1 29 1 1 3 GLY C C 13.526 -5.869 -5.640 1.00 . A A . 37 GLY C 1 1 1 30 1 1 3 GLY CA C 14.570 -6.826 -6.206 1.00 . A A . 37 GLY CA 1 1 1 31 1 1 3 GLY H H 12.953 -8.176 -6.391 1.00 . A A . 37 GLY H 1 1 1 32 1 1 3 GLY HA2 H 15.323 -7.028 -5.442 1.00 . A A . 37 GLY HA2 1 1 1 33 1 1 3 GLY HA3 H 15.061 -6.354 -7.059 1.00 . A A . 37 GLY HA3 1 1 1 34 1 1 3 GLY N N 13.928 -8.074 -6.615 1.00 . A A . 37 GLY N 1 1 1 35 1 1 3 GLY O O 13.027 -5.029 -6.382 1.00 . A A . 37 GLY O 1 1 1 36 1 1 4 TYR C C 12.201 -5.459 -2.281 1.00 . A A . 38 TYR C 1 1 1 37 1 1 4 TYR CA C 11.930 -5.452 -3.794 1.00 . A A . 38 TYR CA 1 1 1 38 1 1 4 TYR CB C 10.506 -5.971 -4.086 1.00 . A A . 38 TYR CB 1 1 1 39 1 1 4 TYR CD1 C 10.358 -7.030 -6.390 1.00 . A A . 38 TYR CD1 1 1 1 40 1 1 4 TYR CD2 C 9.376 -4.829 -6.058 1.00 . A A . 38 TYR CD2 1 1 1 41 1 1 4 TYR CE1 C 10.003 -6.981 -7.752 1.00 . A A . 38 TYR CE1 1 1 1 42 1 1 4 TYR CE2 C 9.005 -4.779 -7.417 1.00 . A A . 38 TYR CE2 1 1 1 43 1 1 4 TYR CG C 10.074 -5.940 -5.545 1.00 . A A . 38 TYR CG 1 1 1 44 1 1 4 TYR CZ C 9.333 -5.851 -8.272 1.00 . A A . 38 TYR CZ 1 1 1 45 1 1 4 TYR H H 13.436 -6.920 -3.916 1.00 . A A . 38 TYR H 1 1 1 46 1 1 4 TYR HA H 12.002 -4.428 -4.149 1.00 . A A . 38 TYR HA 1 1 1 47 1 1 4 TYR HB2 H 10.416 -6.990 -3.710 1.00 . A A . 38 TYR HB2 1 1 1 48 1 1 4 TYR HB3 H 9.804 -5.359 -3.517 1.00 . A A . 38 TYR HB3 1 1 1 49 1 1 4 TYR HD1 H 10.859 -7.897 -5.995 1.00 . A A . 38 TYR HD1 1 1 1 50 1 1 4 TYR HD2 H 9.118 -4.006 -5.407 1.00 . A A . 38 TYR HD2 1 1 1 51 1 1 4 TYR HE1 H 10.226 -7.811 -8.406 1.00 . A A . 38 TYR HE1 1 1 1 52 1 1 4 TYR HE2 H 8.480 -3.918 -7.806 1.00 . A A . 38 TYR HE2 1 1 1 53 1 1 4 TYR HH H 8.486 -5.055 -9.870 1.00 . A A . 38 TYR HH 1 1 1 54 1 1 4 TYR N N 12.957 -6.238 -4.485 1.00 . A A . 38 TYR N 1 1 1 55 1 1 4 TYR O O 12.706 -6.452 -1.756 1.00 . A A . 38 TYR O 1 1 1 56 1 1 4 TYR OH O 9.054 -5.799 -9.603 1.00 . A A . 38 TYR OH 1 1 1 57 1 1 5 MET C C 10.875 -3.456 0.481 1.00 . A A . 39 MET C 1 1 1 58 1 1 5 MET CA C 12.095 -4.068 -0.209 1.00 . A A . 39 MET CA 1 1 1 59 1 1 5 MET CB C 13.234 -3.038 -0.255 1.00 . A A . 39 MET CB 1 1 1 60 1 1 5 MET CE C 15.473 -1.382 2.863 1.00 . A A . 39 MET CE 1 1 1 61 1 1 5 MET CG C 13.753 -2.688 1.140 1.00 . A A . 39 MET CG 1 1 1 62 1 1 5 MET H H 11.359 -3.649 -2.120 1.00 . A A . 39 MET H 1 1 1 63 1 1 5 MET HA H 12.425 -4.952 0.337 1.00 . A A . 39 MET HA 1 1 1 64 1 1 5 MET HB2 H 14.059 -3.446 -0.840 1.00 . A A . 39 MET HB2 1 1 1 65 1 1 5 MET HB3 H 12.887 -2.124 -0.743 1.00 . A A . 39 MET HB3 1 1 1 66 1 1 5 MET HE1 H 16.324 -0.718 3.014 1.00 . A A . 39 MET HE1 1 1 1 67 1 1 5 MET HE2 H 15.662 -2.332 3.364 1.00 . A A . 39 MET HE2 1 1 1 68 1 1 5 MET HE3 H 14.579 -0.918 3.282 1.00 . A A . 39 MET HE3 1 1 1 69 1 1 5 MET HG2 H 12.979 -2.150 1.690 1.00 . A A . 39 MET HG2 1 1 1 70 1 1 5 MET HG3 H 13.989 -3.608 1.674 1.00 . A A . 39 MET HG3 1 1 1 71 1 1 5 MET N N 11.751 -4.418 -1.585 1.00 . A A . 39 MET N 1 1 1 72 1 1 5 MET O O 10.179 -2.634 -0.106 1.00 . A A . 39 MET O 1 1 1 73 1 1 5 MET SD S 15.242 -1.667 1.090 1.00 . A A . 39 MET SD 1 1 1 74 1 1 6 LEU C C 9.801 -2.111 3.149 1.00 . A A . 40 LEU C 1 1 1 75 1 1 6 LEU CA C 9.427 -3.440 2.469 1.00 . A A . 40 LEU CA 1 1 1 76 1 1 6 LEU CB C 8.931 -4.524 3.449 1.00 . A A . 40 LEU CB 1 1 1 77 1 1 6 LEU CD1 C 9.195 -6.127 5.343 1.00 . A A . 40 LEU CD1 1 1 1 78 1 1 6 LEU CD2 C 11.260 -5.329 4.263 1.00 . A A . 40 LEU CD2 1 1 1 79 1 1 6 LEU CG C 9.831 -4.925 4.641 1.00 . A A . 40 LEU CG 1 1 1 80 1 1 6 LEU H H 11.155 -4.611 2.107 1.00 . A A . 40 LEU H 1 1 1 81 1 1 6 LEU HA H 8.604 -3.240 1.793 1.00 . A A . 40 LEU HA 1 1 1 82 1 1 6 LEU HB2 H 7.981 -4.178 3.858 1.00 . A A . 40 LEU HB2 1 1 1 83 1 1 6 LEU HB3 H 8.719 -5.415 2.863 1.00 . A A . 40 LEU HB3 1 1 1 84 1 1 6 LEU HD11 H 8.176 -5.885 5.640 1.00 . A A . 40 LEU HD11 1 1 1 85 1 1 6 LEU HD12 H 9.773 -6.370 6.235 1.00 . A A . 40 LEU HD12 1 1 1 86 1 1 6 LEU HD13 H 9.190 -6.989 4.674 1.00 . A A . 40 LEU HD13 1 1 1 87 1 1 6 LEU HD21 H 11.810 -4.450 3.923 1.00 . A A . 40 LEU HD21 1 1 1 88 1 1 6 LEU HD22 H 11.249 -6.097 3.491 1.00 . A A . 40 LEU HD22 1 1 1 89 1 1 6 LEU HD23 H 11.781 -5.705 5.143 1.00 . A A . 40 LEU HD23 1 1 1 90 1 1 6 LEU HG H 9.867 -4.108 5.360 1.00 . A A . 40 LEU HG 1 1 1 91 1 1 6 LEU N N 10.530 -3.959 1.664 1.00 . A A . 40 LEU N 1 1 1 92 1 1 6 LEU O O 10.653 -2.094 4.030 1.00 . A A . 40 LEU O 1 1 1 93 1 1 7 GLY C C 8.967 0.308 4.960 1.00 . A A . 41 GLY C 1 1 1 94 1 1 7 GLY CA C 9.283 0.278 3.461 1.00 . A A . 41 GLY CA 1 1 1 95 1 1 7 GLY H H 8.406 -1.113 2.080 1.00 . A A . 41 GLY H 1 1 1 96 1 1 7 GLY HA2 H 10.310 0.614 3.307 1.00 . A A . 41 GLY HA2 1 1 1 97 1 1 7 GLY HA3 H 8.611 0.982 2.981 1.00 . A A . 41 GLY HA3 1 1 1 98 1 1 7 GLY N N 9.076 -1.036 2.836 1.00 . A A . 41 GLY N 1 1 1 99 1 1 7 GLY O O 9.734 0.846 5.753 1.00 . A A . 41 GLY O 1 1 1 100 1 1 8 SER C C 5.833 -0.504 6.708 1.00 . A A . 42 SER C 1 1 1 101 1 1 8 SER CA C 7.354 -0.730 6.680 1.00 . A A . 42 SER CA 1 1 1 102 1 1 8 SER CB C 8.055 -0.017 7.852 1.00 . A A . 42 SER CB 1 1 1 103 1 1 8 SER H H 7.393 -0.815 4.564 1.00 . A A . 42 SER H 1 1 1 104 1 1 8 SER HA H 7.502 -1.796 6.848 1.00 . A A . 42 SER HA 1 1 1 105 1 1 8 SER HB2 H 8.098 1.059 7.679 1.00 . A A . 42 SER HB2 1 1 1 106 1 1 8 SER HB3 H 7.521 -0.200 8.784 1.00 . A A . 42 SER HB3 1 1 1 107 1 1 8 SER HG H 9.870 -0.176 7.267 1.00 . A A . 42 SER HG 1 1 1 108 1 1 8 SER N N 7.906 -0.424 5.338 1.00 . A A . 42 SER N 1 1 1 109 1 1 8 SER O O 5.194 -0.408 5.657 1.00 . A A . 42 SER O 1 1 1 110 1 1 8 SER OG O 9.347 -0.552 8.003 1.00 . A A . 42 SER OG 1 1 1 111 1 1 9 ALA C C 3.449 1.082 7.985 1.00 . A A . 43 ALA C 1 1 1 112 1 1 9 ALA CA C 3.788 -0.418 8.076 1.00 . A A . 43 ALA CA 1 1 1 113 1 1 9 ALA CB C 3.368 -0.998 9.431 1.00 . A A . 43 ALA CB 1 1 1 114 1 1 9 ALA H H 5.780 -0.749 8.708 1.00 . A A . 43 ALA H 1 1 1 115 1 1 9 ALA HA H 3.229 -0.930 7.297 1.00 . A A . 43 ALA HA 1 1 1 116 1 1 9 ALA HB1 H 3.556 -2.071 9.455 1.00 . A A . 43 ALA HB1 1 1 1 117 1 1 9 ALA HB2 H 2.303 -0.821 9.588 1.00 . A A . 43 ALA HB2 1 1 1 118 1 1 9 ALA HB3 H 3.924 -0.510 10.234 1.00 . A A . 43 ALA HB3 1 1 1 119 1 1 9 ALA N N 5.212 -0.678 7.879 1.00 . A A . 43 ALA N 1 1 1 120 1 1 9 ALA O O 4.151 1.927 8.537 1.00 . A A . 43 ALA O 1 1 1 121 1 1 10 MET C C 1.417 3.197 8.931 1.00 . A A . 44 MET C 1 1 1 122 1 1 10 MET CA C 1.628 2.694 7.491 1.00 . A A . 44 MET CA 1 1 1 123 1 1 10 MET CB C 0.297 2.641 6.721 1.00 . A A . 44 MET CB 1 1 1 124 1 1 10 MET CE C -2.344 1.238 9.340 1.00 . A A . 44 MET CE 1 1 1 125 1 1 10 MET CG C -0.626 1.480 7.127 1.00 . A A . 44 MET CG 1 1 1 126 1 1 10 MET H H 1.738 0.613 7.042 1.00 . A A . 44 MET H 1 1 1 127 1 1 10 MET HA H 2.282 3.404 6.983 1.00 . A A . 44 MET HA 1 1 1 128 1 1 10 MET HB2 H -0.223 3.591 6.834 1.00 . A A . 44 MET HB2 1 1 1 129 1 1 10 MET HB3 H 0.526 2.520 5.664 1.00 . A A . 44 MET HB3 1 1 1 130 1 1 10 MET HE1 H -3.347 1.371 9.746 1.00 . A A . 44 MET HE1 1 1 1 131 1 1 10 MET HE2 H -1.628 1.768 9.964 1.00 . A A . 44 MET HE2 1 1 1 132 1 1 10 MET HE3 H -2.097 0.177 9.331 1.00 . A A . 44 MET HE3 1 1 1 133 1 1 10 MET HG2 H -0.732 0.839 6.253 1.00 . A A . 44 MET HG2 1 1 1 134 1 1 10 MET HG3 H -0.163 0.887 7.915 1.00 . A A . 44 MET HG3 1 1 1 135 1 1 10 MET N N 2.271 1.379 7.439 1.00 . A A . 44 MET N 1 1 1 136 1 1 10 MET O O 0.721 2.571 9.729 1.00 . A A . 44 MET O 1 1 1 137 1 1 10 MET SD S -2.298 1.905 7.658 1.00 . A A . 44 MET SD 1 1 1 138 1 1 11 SER C C 0.209 5.644 10.692 1.00 . A A . 45 SER C 1 1 1 139 1 1 11 SER CA C 1.650 5.124 10.490 1.00 . A A . 45 SER CA 1 1 1 140 1 1 11 SER CB C 2.693 6.240 10.642 1.00 . A A . 45 SER CB 1 1 1 141 1 1 11 SER H H 2.427 4.885 8.514 1.00 . A A . 45 SER H 1 1 1 142 1 1 11 SER HA H 1.842 4.407 11.289 1.00 . A A . 45 SER HA 1 1 1 143 1 1 11 SER HB2 H 3.692 5.813 10.546 1.00 . A A . 45 SER HB2 1 1 1 144 1 1 11 SER HB3 H 2.552 6.994 9.866 1.00 . A A . 45 SER HB3 1 1 1 145 1 1 11 SER HG H 1.780 7.394 11.893 1.00 . A A . 45 SER HG 1 1 1 146 1 1 11 SER N N 1.847 4.432 9.205 1.00 . A A . 45 SER N 1 1 1 147 1 1 11 SER O O -0.016 6.850 10.741 1.00 . A A . 45 SER O 1 1 1 148 1 1 11 SER OG O 2.571 6.838 11.914 1.00 . A A . 45 SER OG 1 1 1 149 1 1 12 ARG C C -2.760 6.262 10.244 1.00 . A A . 46 ARG C 1 1 1 150 1 1 12 ARG CA C -2.228 4.977 10.942 1.00 . A A . 46 ARG CA 1 1 1 151 1 1 12 ARG CB C -2.542 4.923 12.449 1.00 . A A . 46 ARG CB 1 1 1 152 1 1 12 ARG CD C -4.364 4.942 14.223 1.00 . A A . 46 ARG CD 1 1 1 153 1 1 12 ARG CG C -4.052 4.798 12.729 1.00 . A A . 46 ARG CG 1 1 1 154 1 1 12 ARG CZ C -3.765 3.718 16.317 1.00 . A A . 46 ARG CZ 1 1 1 155 1 1 12 ARG H H -0.469 3.771 10.616 1.00 . A A . 46 ARG H 1 1 1 156 1 1 12 ARG HA H -2.755 4.142 10.483 1.00 . A A . 46 ARG HA 1 1 1 157 1 1 12 ARG HB2 H -2.036 4.061 12.886 1.00 . A A . 46 ARG HB2 1 1 1 158 1 1 12 ARG HB3 H -2.149 5.823 12.927 1.00 . A A . 46 ARG HB3 1 1 1 159 1 1 12 ARG HD2 H -3.889 5.856 14.586 1.00 . A A . 46 ARG HD2 1 1 1 160 1 1 12 ARG HD3 H -5.445 5.048 14.338 1.00 . A A . 46 ARG HD3 1 1 1 161 1 1 12 ARG HE H -3.707 2.935 14.486 1.00 . A A . 46 ARG HE 1 1 1 162 1 1 12 ARG HG2 H -4.597 5.582 12.205 1.00 . A A . 46 ARG HG2 1 1 1 163 1 1 12 ARG HG3 H -4.416 3.836 12.366 1.00 . A A . 46 ARG HG3 1 1 1 164 1 1 12 ARG HH11 H -4.228 5.627 16.654 1.00 . A A . 46 ARG HH11 1 1 1 165 1 1 12 ARG HH12 H -3.846 4.700 18.075 1.00 . A A . 46 ARG HH12 1 1 1 166 1 1 12 ARG HH21 H -3.236 1.781 16.344 1.00 . A A . 46 ARG HH21 1 1 1 167 1 1 12 ARG HH22 H -3.308 2.565 17.891 1.00 . A A . 46 ARG HH22 1 1 1 168 1 1 12 ARG N N -0.776 4.732 10.745 1.00 . A A . 46 ARG N 1 1 1 169 1 1 12 ARG NE N -3.907 3.774 15.004 1.00 . A A . 46 ARG NE 1 1 1 170 1 1 12 ARG NH1 N -3.978 4.752 17.082 1.00 . A A . 46 ARG NH1 1 1 1 171 1 1 12 ARG NH2 N -3.410 2.604 16.893 1.00 . A A . 46 ARG NH2 1 1 1 172 1 1 12 ARG O O -3.191 7.190 10.921 1.00 . A A . 46 ARG O 1 1 1 173 1 1 13 PRO C C -4.126 8.482 8.422 1.00 . A A . 47 PRO C 1 1 1 174 1 1 13 PRO CA C -3.085 7.427 8.029 1.00 . A A . 47 PRO CA 1 1 1 175 1 1 13 PRO CB C -3.460 6.820 6.673 1.00 . A A . 47 PRO CB 1 1 1 176 1 1 13 PRO CD C -2.587 5.105 8.071 1.00 . A A . 47 PRO CD 1 1 1 177 1 1 13 PRO CG C -2.580 5.584 6.626 1.00 . A A . 47 PRO CG 1 1 1 178 1 1 13 PRO HA H -2.134 7.949 7.917 1.00 . A A . 47 PRO HA 1 1 1 179 1 1 13 PRO HB2 H -4.511 6.520 6.665 1.00 . A A . 47 PRO HB2 1 1 1 180 1 1 13 PRO HB3 H -3.245 7.494 5.847 1.00 . A A . 47 PRO HB3 1 1 1 181 1 1 13 PRO HD2 H -3.394 4.390 8.225 1.00 . A A . 47 PRO HD2 1 1 1 182 1 1 13 PRO HD3 H -1.627 4.649 8.304 1.00 . A A . 47 PRO HD3 1 1 1 183 1 1 13 PRO HG2 H -2.969 4.830 5.951 1.00 . A A . 47 PRO HG2 1 1 1 184 1 1 13 PRO HG3 H -1.570 5.870 6.344 1.00 . A A . 47 PRO HG3 1 1 1 185 1 1 13 PRO N N -2.848 6.267 8.898 1.00 . A A . 47 PRO N 1 1 1 186 1 1 13 PRO O O -3.960 9.624 8.016 1.00 . A A . 47 PRO O 1 1 1 187 1 1 14 MET C C -6.897 9.629 7.763 1.00 . A A . 48 MET C 1 1 1 188 1 1 14 MET CA C -6.485 8.926 9.087 1.00 . A A . 48 MET CA 1 1 1 189 1 1 14 MET CB C -6.319 9.843 10.311 1.00 . A A . 48 MET CB 1 1 1 190 1 1 14 MET CE C -8.884 12.367 12.348 1.00 . A A . 48 MET CE 1 1 1 191 1 1 14 MET CG C -7.641 10.436 10.811 1.00 . A A . 48 MET CG 1 1 1 192 1 1 14 MET H H -5.337 7.132 9.301 1.00 . A A . 48 MET H 1 1 1 193 1 1 14 MET HA H -7.308 8.265 9.329 1.00 . A A . 48 MET HA 1 1 1 194 1 1 14 MET HB2 H -5.898 9.251 11.126 1.00 . A A . 48 MET HB2 1 1 1 195 1 1 14 MET HB3 H -5.623 10.649 10.079 1.00 . A A . 48 MET HB3 1 1 1 196 1 1 14 MET HE1 H -9.802 11.839 12.090 1.00 . A A . 48 MET HE1 1 1 1 197 1 1 14 MET HE2 H -8.666 13.110 11.579 1.00 . A A . 48 MET HE2 1 1 1 198 1 1 14 MET HE3 H -9.008 12.870 13.307 1.00 . A A . 48 MET HE3 1 1 1 199 1 1 14 MET HG2 H -7.978 11.194 10.104 1.00 . A A . 48 MET HG2 1 1 1 200 1 1 14 MET HG3 H -8.397 9.652 10.858 1.00 . A A . 48 MET HG3 1 1 1 201 1 1 14 MET N N -5.282 8.077 8.964 1.00 . A A . 48 MET N 1 1 1 202 1 1 14 MET O O -7.362 10.765 7.754 1.00 . A A . 48 MET O 1 1 1 203 1 1 14 MET SD S -7.509 11.192 12.453 1.00 . A A . 48 MET SD 1 1 1 204 1 1 15 MET C C -8.286 9.255 4.811 1.00 . A A . 49 MET C 1 1 1 205 1 1 15 MET CA C -6.844 9.491 5.266 1.00 . A A . 49 MET CA 1 1 1 206 1 1 15 MET CB C -5.790 8.903 4.309 1.00 . A A . 49 MET CB 1 1 1 207 1 1 15 MET CE C -3.112 12.023 4.814 1.00 . A A . 49 MET CE 1 1 1 208 1 1 15 MET CG C -4.475 9.660 4.490 1.00 . A A . 49 MET CG 1 1 1 209 1 1 15 MET H H -6.263 8.041 6.720 1.00 . A A . 49 MET H 1 1 1 210 1 1 15 MET HA H -6.729 10.574 5.291 1.00 . A A . 49 MET HA 1 1 1 211 1 1 15 MET HB2 H -5.649 7.841 4.513 1.00 . A A . 49 MET HB2 1 1 1 212 1 1 15 MET HB3 H -6.087 9.018 3.267 1.00 . A A . 49 MET HB3 1 1 1 213 1 1 15 MET HE1 H -2.248 11.380 4.649 1.00 . A A . 49 MET HE1 1 1 1 214 1 1 15 MET HE2 H -3.342 12.051 5.881 1.00 . A A . 49 MET HE2 1 1 1 215 1 1 15 MET HE3 H -2.883 13.031 4.468 1.00 . A A . 49 MET HE3 1 1 1 216 1 1 15 MET HG2 H -4.216 9.664 5.547 1.00 . A A . 49 MET HG2 1 1 1 217 1 1 15 MET HG3 H -3.687 9.139 3.947 1.00 . A A . 49 MET HG3 1 1 1 218 1 1 15 MET N N -6.611 8.977 6.626 1.00 . A A . 49 MET N 1 1 1 219 1 1 15 MET O O -9.175 9.248 5.642 1.00 . A A . 49 MET O 1 1 1 220 1 1 15 MET SD S -4.537 11.375 3.902 1.00 . A A . 49 MET SD 1 1 1 221 1 1 16 HIS C C -10.070 8.828 1.580 1.00 . A A . 50 HIS C 1 1 1 222 1 1 16 HIS CA C -9.969 9.327 3.017 1.00 . A A . 50 HIS CA 1 1 1 223 1 1 16 HIS CB C -10.512 10.757 3.130 1.00 . A A . 50 HIS CB 1 1 1 224 1 1 16 HIS CD2 C -10.452 12.173 0.997 1.00 . A A . 50 HIS CD2 1 1 1 225 1 1 16 HIS CE1 C -8.486 13.170 1.277 1.00 . A A . 50 HIS CE1 1 1 1 226 1 1 16 HIS CG C -9.912 11.753 2.180 1.00 . A A . 50 HIS CG 1 1 1 227 1 1 16 HIS H H -7.850 9.376 2.823 1.00 . A A . 50 HIS H 1 1 1 228 1 1 16 HIS HA H -10.576 8.671 3.648 1.00 . A A . 50 HIS HA 1 1 1 229 1 1 16 HIS HB2 H -11.587 10.737 2.984 1.00 . A A . 50 HIS HB2 1 1 1 230 1 1 16 HIS HB3 H -10.301 11.115 4.133 1.00 . A A . 50 HIS HB3 1 1 1 231 1 1 16 HIS HD1 H -8.102 12.297 3.169 1.00 . A A . 50 HIS HD1 1 1 1 232 1 1 16 HIS HD2 H -11.400 11.857 0.571 1.00 . A A . 50 HIS HD2 1 1 1 233 1 1 16 HIS HE1 H -7.601 13.777 1.108 1.00 . A A . 50 HIS HE1 1 1 1 234 1 1 16 HIS HE2 H -9.649 13.513 -0.460 1.00 . A A . 50 HIS HE2 1 1 1 235 1 1 16 HIS N N -8.588 9.326 3.511 1.00 . A A . 50 HIS N 1 1 1 236 1 1 16 HIS ND1 N -8.702 12.393 2.357 1.00 . A A . 50 HIS ND1 1 1 1 237 1 1 16 HIS NE2 N -9.543 13.055 0.441 1.00 . A A . 50 HIS NE2 1 1 1 238 1 1 16 HIS O O -9.113 8.981 0.824 1.00 . A A . 50 HIS O 1 1 1 239 1 1 17 PHE C C -12.569 9.130 -0.902 1.00 . A A . 51 PHE C 1 1 1 240 1 1 17 PHE CA C -11.635 8.132 -0.200 1.00 . A A . 51 PHE CA 1 1 1 241 1 1 17 PHE CB C -12.254 6.723 -0.129 1.00 . A A . 51 PHE CB 1 1 1 242 1 1 17 PHE CD1 C -11.692 5.674 2.116 1.00 . A A . 51 PHE CD1 1 1 1 243 1 1 17 PHE CD2 C -10.454 4.961 0.148 1.00 . A A . 51 PHE CD2 1 1 1 244 1 1 17 PHE CE1 C -10.913 4.822 2.917 1.00 . A A . 51 PHE CE1 1 1 1 245 1 1 17 PHE CE2 C -9.673 4.116 0.952 1.00 . A A . 51 PHE CE2 1 1 1 246 1 1 17 PHE CG C -11.457 5.755 0.728 1.00 . A A . 51 PHE CG 1 1 1 247 1 1 17 PHE CZ C -9.902 4.042 2.333 1.00 . A A . 51 PHE CZ 1 1 1 248 1 1 17 PHE H H -12.013 8.442 1.867 1.00 . A A . 51 PHE H 1 1 1 249 1 1 17 PHE HA H -10.726 8.064 -0.800 1.00 . A A . 51 PHE HA 1 1 1 250 1 1 17 PHE HB2 H -13.266 6.786 0.274 1.00 . A A . 51 PHE HB2 1 1 1 251 1 1 17 PHE HB3 H -12.333 6.322 -1.141 1.00 . A A . 51 PHE HB3 1 1 1 252 1 1 17 PHE HD1 H -12.497 6.238 2.563 1.00 . A A . 51 PHE HD1 1 1 1 253 1 1 17 PHE HD2 H -10.316 4.964 -0.923 1.00 . A A . 51 PHE HD2 1 1 1 254 1 1 17 PHE HE1 H -11.135 4.722 3.970 1.00 . A A . 51 PHE HE1 1 1 1 255 1 1 17 PHE HE2 H -8.928 3.485 0.501 1.00 . A A . 51 PHE HE2 1 1 1 256 1 1 17 PHE HZ H -9.332 3.343 2.927 1.00 . A A . 51 PHE HZ 1 1 1 257 1 1 17 PHE N N -11.306 8.568 1.161 1.00 . A A . 51 PHE N 1 1 1 258 1 1 17 PHE O O -12.236 9.607 -1.981 1.00 . A A . 51 PHE O 1 1 1 259 1 1 18 GLY C C -15.917 9.553 -0.885 1.00 . A A . 52 GLY C 1 1 1 260 1 1 18 GLY CA C -14.667 10.430 -0.712 1.00 . A A . 52 GLY CA 1 1 1 261 1 1 18 GLY H H -13.652 9.330 0.783 1.00 . A A . 52 GLY H 1 1 1 262 1 1 18 GLY HA2 H -14.931 11.245 -0.038 1.00 . A A . 52 GLY HA2 1 1 1 263 1 1 18 GLY HA3 H -14.410 10.850 -1.685 1.00 . A A . 52 GLY HA3 1 1 1 264 1 1 18 GLY N N -13.527 9.688 -0.149 1.00 . A A . 52 GLY N 1 1 1 265 1 1 18 GLY O O -16.921 10.013 -1.412 1.00 . A A . 52 GLY O 1 1 1 266 1 1 19 ASN C C -17.027 6.678 0.934 1.00 . A A . 53 ASN C 1 1 1 267 1 1 19 ASN CA C -16.868 7.281 -0.469 1.00 . A A . 53 ASN CA 1 1 1 268 1 1 19 ASN CB C -16.401 6.214 -1.487 1.00 . A A . 53 ASN CB 1 1 1 269 1 1 19 ASN CG C -16.265 6.719 -2.916 1.00 . A A . 53 ASN CG 1 1 1 270 1 1 19 ASN H H -14.981 8.022 0.019 1.00 . A A . 53 ASN H 1 1 1 271 1 1 19 ASN HA H -17.822 7.708 -0.788 1.00 . A A . 53 ASN HA 1 1 1 272 1 1 19 ASN HB2 H -15.431 5.816 -1.191 1.00 . A A . 53 ASN HB2 1 1 1 273 1 1 19 ASN HB3 H -17.109 5.386 -1.472 1.00 . A A . 53 ASN HB3 1 1 1 274 1 1 19 ASN HD21 H -17.365 5.218 -3.644 1.00 . A A . 53 ASN HD21 1 1 1 275 1 1 19 ASN HD22 H -16.725 6.390 -4.790 1.00 . A A . 53 ASN HD22 1 1 1 276 1 1 19 ASN N N -15.854 8.319 -0.374 1.00 . A A . 53 ASN N 1 1 1 277 1 1 19 ASN ND2 N -16.935 6.098 -3.856 1.00 . A A . 53 ASN ND2 1 1 1 278 1 1 19 ASN O O -16.115 6.010 1.422 1.00 . A A . 53 ASN O 1 1 1 279 1 1 19 ASN OD1 O -15.494 7.611 -3.230 1.00 . A A . 53 ASN OD1 1 1 1 280 1 1 20 ASP C C -18.296 5.229 3.391 1.00 . A A . 54 ASP C 1 1 1 281 1 1 20 ASP CA C -18.270 6.737 3.079 1.00 . A A . 54 ASP CA 1 1 1 282 1 1 20 ASP CB C -19.551 7.424 3.574 1.00 . A A . 54 ASP CB 1 1 1 283 1 1 20 ASP CG C -19.578 8.900 3.162 1.00 . A A . 54 ASP CG 1 1 1 284 1 1 20 ASP H H -18.720 7.747 1.275 1.00 . A A . 54 ASP H 1 1 1 285 1 1 20 ASP HA H -17.447 7.186 3.629 1.00 . A A . 54 ASP HA 1 1 1 286 1 1 20 ASP HB2 H -20.420 6.914 3.151 1.00 . A A . 54 ASP HB2 1 1 1 287 1 1 20 ASP HB3 H -19.606 7.344 4.661 1.00 . A A . 54 ASP HB3 1 1 1 288 1 1 20 ASP N N -18.096 7.028 1.645 1.00 . A A . 54 ASP N 1 1 1 289 1 1 20 ASP O O -17.701 4.762 4.360 1.00 . A A . 54 ASP O 1 1 1 290 1 1 20 ASP OD1 O -18.861 9.684 3.822 1.00 . A A . 54 ASP OD1 1 1 1 291 1 1 20 ASP OD2 O -19.934 9.110 1.979 1.00 . A A . 54 ASP OD2 1 1 1 292 1 1 21 TRP C C -17.220 2.446 2.535 1.00 . A A . 55 TRP C 1 1 1 293 1 1 21 TRP CA C -18.675 2.961 2.508 1.00 . A A . 55 TRP CA 1 1 1 294 1 1 21 TRP CB C -19.485 2.338 1.361 1.00 . A A . 55 TRP CB 1 1 1 295 1 1 21 TRP CD1 C -19.292 -0.193 1.385 1.00 . A A . 55 TRP CD1 1 1 1 296 1 1 21 TRP CD2 C -21.239 0.532 2.240 1.00 . A A . 55 TRP CD2 1 1 1 297 1 1 21 TRP CE2 C -21.249 -0.892 2.335 1.00 . A A . 55 TRP CE2 1 1 1 298 1 1 21 TRP CE3 C -22.373 1.214 2.738 1.00 . A A . 55 TRP CE3 1 1 1 299 1 1 21 TRP CG C -19.976 0.948 1.630 1.00 . A A . 55 TRP CG 1 1 1 300 1 1 21 TRP CH2 C -23.434 -0.893 3.379 1.00 . A A . 55 TRP CH2 1 1 1 301 1 1 21 TRP CZ2 C -22.323 -1.603 2.893 1.00 . A A . 55 TRP CZ2 1 1 1 302 1 1 21 TRP CZ3 C -23.457 0.511 3.301 1.00 . A A . 55 TRP CZ3 1 1 1 303 1 1 21 TRP H H -19.194 4.851 1.629 1.00 . A A . 55 TRP H 1 1 1 304 1 1 21 TRP HA H -19.132 2.644 3.446 1.00 . A A . 55 TRP HA 1 1 1 305 1 1 21 TRP HB2 H -20.367 2.954 1.176 1.00 . A A . 55 TRP HB2 1 1 1 306 1 1 21 TRP HB3 H -18.888 2.343 0.447 1.00 . A A . 55 TRP HB3 1 1 1 307 1 1 21 TRP HD1 H -18.296 -0.238 0.959 1.00 . A A . 55 TRP HD1 1 1 1 308 1 1 21 TRP HE1 H -19.711 -2.232 1.735 1.00 . A A . 55 TRP HE1 1 1 1 309 1 1 21 TRP HE3 H -22.401 2.292 2.685 1.00 . A A . 55 TRP HE3 1 1 1 310 1 1 21 TRP HH2 H -24.270 -1.425 3.813 1.00 . A A . 55 TRP HH2 1 1 1 311 1 1 21 TRP HZ2 H -22.291 -2.680 2.949 1.00 . A A . 55 TRP HZ2 1 1 1 312 1 1 21 TRP HZ3 H -24.314 1.055 3.675 1.00 . A A . 55 TRP HZ3 1 1 1 313 1 1 21 TRP N N -18.773 4.422 2.438 1.00 . A A . 55 TRP N 1 1 1 314 1 1 21 TRP NE1 N -20.042 -1.280 1.793 1.00 . A A . 55 TRP NE1 1 1 1 315 1 1 21 TRP O O -16.941 1.468 3.222 1.00 . A A . 55 TRP O 1 1 1 316 1 1 22 GLU C C -14.100 3.424 3.150 1.00 . A A . 56 GLU C 1 1 1 317 1 1 22 GLU CA C -14.832 2.833 1.932 1.00 . A A . 56 GLU CA 1 1 1 318 1 1 22 GLU CB C -14.139 3.325 0.644 1.00 . A A . 56 GLU CB 1 1 1 319 1 1 22 GLU CD C -14.041 3.218 -1.938 1.00 . A A . 56 GLU CD 1 1 1 320 1 1 22 GLU CG C -14.733 2.731 -0.647 1.00 . A A . 56 GLU CG 1 1 1 321 1 1 22 GLU H H -16.532 4.055 1.520 1.00 . A A . 56 GLU H 1 1 1 322 1 1 22 GLU HA H -14.713 1.750 1.985 1.00 . A A . 56 GLU HA 1 1 1 323 1 1 22 GLU HB2 H -14.198 4.411 0.596 1.00 . A A . 56 GLU HB2 1 1 1 324 1 1 22 GLU HB3 H -13.087 3.044 0.704 1.00 . A A . 56 GLU HB3 1 1 1 325 1 1 22 GLU HG2 H -14.671 1.642 -0.592 1.00 . A A . 56 GLU HG2 1 1 1 326 1 1 22 GLU HG3 H -15.791 3.003 -0.698 1.00 . A A . 56 GLU HG3 1 1 1 327 1 1 22 GLU N N -16.270 3.163 1.919 1.00 . A A . 56 GLU N 1 1 1 328 1 1 22 GLU O O -13.252 2.746 3.732 1.00 . A A . 56 GLU O 1 1 1 329 1 1 22 GLU OE1 O -12.851 3.611 -1.892 1.00 . A A . 56 GLU OE1 1 1 1 330 1 1 22 GLU OE2 O -14.717 3.196 -2.995 1.00 . A A . 56 GLU OE2 1 1 1 331 1 1 23 ASP C C -14.379 4.083 6.056 1.00 . A A . 57 ASP C 1 1 1 332 1 1 23 ASP CA C -14.139 5.123 4.965 1.00 . A A . 57 ASP CA 1 1 1 333 1 1 23 ASP CB C -14.919 6.422 5.266 1.00 . A A . 57 ASP CB 1 1 1 334 1 1 23 ASP CG C -15.590 6.476 6.667 1.00 . A A . 57 ASP CG 1 1 1 335 1 1 23 ASP H H -15.294 5.052 3.160 1.00 . A A . 57 ASP H 1 1 1 336 1 1 23 ASP HA H -13.075 5.347 4.966 1.00 . A A . 57 ASP HA 1 1 1 337 1 1 23 ASP HB2 H -14.234 7.253 5.137 1.00 . A A . 57 ASP HB2 1 1 1 338 1 1 23 ASP HB3 H -15.674 6.574 4.501 1.00 . A A . 57 ASP HB3 1 1 1 339 1 1 23 ASP N N -14.525 4.597 3.643 1.00 . A A . 57 ASP N 1 1 1 340 1 1 23 ASP O O -13.451 3.645 6.752 1.00 . A A . 57 ASP O 1 1 1 341 1 1 23 ASP OD1 O -14.876 6.343 7.688 1.00 . A A . 57 ASP OD1 1 1 1 342 1 1 23 ASP OD2 O -16.834 6.508 6.727 1.00 . A A . 57 ASP OD2 1 1 1 343 1 1 24 ARG C C -15.282 1.352 6.929 1.00 . A A . 58 ARG C 1 1 1 344 1 1 24 ARG CA C -16.054 2.648 7.093 1.00 . A A . 58 ARG CA 1 1 1 345 1 1 24 ARG CB C -17.561 2.431 6.971 1.00 . A A . 58 ARG CB 1 1 1 346 1 1 24 ARG CD C -19.422 1.027 7.957 1.00 . A A . 58 ARG CD 1 1 1 347 1 1 24 ARG CG C -18.009 1.559 8.144 1.00 . A A . 58 ARG CG 1 1 1 348 1 1 24 ARG CZ C -20.135 0.409 10.266 1.00 . A A . 58 ARG CZ 1 1 1 349 1 1 24 ARG H H -16.332 4.084 5.535 1.00 . A A . 58 ARG H 1 1 1 350 1 1 24 ARG HA H -15.816 3.058 8.074 1.00 . A A . 58 ARG HA 1 1 1 351 1 1 24 ARG HB2 H -18.080 3.392 7.008 1.00 . A A . 58 ARG HB2 1 1 1 352 1 1 24 ARG HB3 H -17.787 1.941 6.021 1.00 . A A . 58 ARG HB3 1 1 1 353 1 1 24 ARG HD2 H -20.135 1.851 7.914 1.00 . A A . 58 ARG HD2 1 1 1 354 1 1 24 ARG HD3 H -19.465 0.476 7.015 1.00 . A A . 58 ARG HD3 1 1 1 355 1 1 24 ARG HE H -19.297 -0.832 8.955 1.00 . A A . 58 ARG HE 1 1 1 356 1 1 24 ARG HG2 H -17.353 0.695 8.245 1.00 . A A . 58 ARG HG2 1 1 1 357 1 1 24 ARG HG3 H -17.948 2.144 9.063 1.00 . A A . 58 ARG HG3 1 1 1 358 1 1 24 ARG HH11 H -20.495 2.306 9.844 1.00 . A A . 58 ARG HH11 1 1 1 359 1 1 24 ARG HH12 H -20.865 1.818 11.487 1.00 . A A . 58 ARG HH12 1 1 1 360 1 1 24 ARG HH21 H -19.632 -1.358 10.994 1.00 . A A . 58 ARG HH21 1 1 1 361 1 1 24 ARG HH22 H -20.344 -0.267 12.153 1.00 . A A . 58 ARG HH22 1 1 1 362 1 1 24 ARG N N -15.626 3.608 6.101 1.00 . A A . 58 ARG N 1 1 1 363 1 1 24 ARG NE N -19.717 0.101 9.058 1.00 . A A . 58 ARG NE 1 1 1 364 1 1 24 ARG NH1 N -20.502 1.622 10.579 1.00 . A A . 58 ARG NH1 1 1 1 365 1 1 24 ARG NH2 N -20.139 -0.483 11.205 1.00 . A A . 58 ARG NH2 1 1 1 366 1 1 24 ARG O O -14.714 0.882 7.913 1.00 . A A . 58 ARG O 1 1 1 367 1 1 25 TYR C C -13.011 -0.390 5.817 1.00 . A A . 59 TYR C 1 1 1 368 1 1 25 TYR CA C -14.500 -0.444 5.481 1.00 . A A . 59 TYR CA 1 1 1 369 1 1 25 TYR CB C -14.745 -1.003 4.072 1.00 . A A . 59 TYR CB 1 1 1 370 1 1 25 TYR CD1 C -16.597 -2.560 4.796 1.00 . A A . 59 TYR CD1 1 1 1 371 1 1 25 TYR CD2 C -14.697 -3.490 3.578 1.00 . A A . 59 TYR CD2 1 1 1 372 1 1 25 TYR CE1 C -17.130 -3.852 4.957 1.00 . A A . 59 TYR CE1 1 1 1 373 1 1 25 TYR CE2 C -15.242 -4.779 3.716 1.00 . A A . 59 TYR CE2 1 1 1 374 1 1 25 TYR CG C -15.372 -2.380 4.120 1.00 . A A . 59 TYR CG 1 1 1 375 1 1 25 TYR CZ C -16.452 -4.964 4.416 1.00 . A A . 59 TYR CZ 1 1 1 376 1 1 25 TYR H H -15.667 1.277 4.933 1.00 . A A . 59 TYR H 1 1 1 377 1 1 25 TYR HA H -14.925 -1.148 6.195 1.00 . A A . 59 TYR HA 1 1 1 378 1 1 25 TYR HB2 H -15.404 -0.353 3.507 1.00 . A A . 59 TYR HB2 1 1 1 379 1 1 25 TYR HB3 H -13.804 -1.048 3.524 1.00 . A A . 59 TYR HB3 1 1 1 380 1 1 25 TYR HD1 H -17.107 -1.711 5.234 1.00 . A A . 59 TYR HD1 1 1 1 381 1 1 25 TYR HD2 H -13.737 -3.375 3.091 1.00 . A A . 59 TYR HD2 1 1 1 382 1 1 25 TYR HE1 H -18.042 -4.000 5.517 1.00 . A A . 59 TYR HE1 1 1 1 383 1 1 25 TYR HE2 H -14.695 -5.630 3.329 1.00 . A A . 59 TYR HE2 1 1 1 384 1 1 25 TYR HH H -16.329 -6.863 4.237 1.00 . A A . 59 TYR HH 1 1 1 385 1 1 25 TYR N N -15.192 0.822 5.706 1.00 . A A . 59 TYR N 1 1 1 386 1 1 25 TYR O O -12.501 -1.369 6.362 1.00 . A A . 59 TYR O 1 1 1 387 1 1 25 TYR OH O -16.936 -6.217 4.605 1.00 . A A . 59 TYR OH 1 1 1 388 1 1 26 TYR C C -11.096 0.792 7.880 1.00 . A A . 60 TYR C 1 1 1 389 1 1 26 TYR CA C -11.075 0.991 6.356 1.00 . A A . 60 TYR CA 1 1 1 390 1 1 26 TYR CB C -10.493 2.351 5.938 1.00 . A A . 60 TYR CB 1 1 1 391 1 1 26 TYR CD1 C -8.187 1.595 6.775 1.00 . A A . 60 TYR CD1 1 1 1 392 1 1 26 TYR CD2 C -8.372 3.619 5.464 1.00 . A A . 60 TYR CD2 1 1 1 393 1 1 26 TYR CE1 C -6.820 1.828 6.978 1.00 . A A . 60 TYR CE1 1 1 1 394 1 1 26 TYR CE2 C -7.001 3.860 5.643 1.00 . A A . 60 TYR CE2 1 1 1 395 1 1 26 TYR CG C -8.986 2.509 6.062 1.00 . A A . 60 TYR CG 1 1 1 396 1 1 26 TYR CZ C -6.234 2.970 6.417 1.00 . A A . 60 TYR CZ 1 1 1 397 1 1 26 TYR H H -12.852 1.580 5.313 1.00 . A A . 60 TYR H 1 1 1 398 1 1 26 TYR HA H -10.436 0.221 5.950 1.00 . A A . 60 TYR HA 1 1 1 399 1 1 26 TYR HB2 H -10.755 2.528 4.895 1.00 . A A . 60 TYR HB2 1 1 1 400 1 1 26 TYR HB3 H -10.961 3.141 6.527 1.00 . A A . 60 TYR HB3 1 1 1 401 1 1 26 TYR HD1 H -8.613 0.694 7.158 1.00 . A A . 60 TYR HD1 1 1 1 402 1 1 26 TYR HD2 H -8.973 4.327 4.915 1.00 . A A . 60 TYR HD2 1 1 1 403 1 1 26 TYR HE1 H -6.218 1.132 7.540 1.00 . A A . 60 TYR HE1 1 1 1 404 1 1 26 TYR HE2 H -6.556 4.743 5.215 1.00 . A A . 60 TYR HE2 1 1 1 405 1 1 26 TYR HH H -4.626 3.921 6.060 1.00 . A A . 60 TYR HH 1 1 1 406 1 1 26 TYR N N -12.387 0.791 5.760 1.00 . A A . 60 TYR N 1 1 1 407 1 1 26 TYR O O -10.433 -0.116 8.393 1.00 . A A . 60 TYR O 1 1 1 408 1 1 26 TYR OH O -4.933 3.233 6.649 1.00 . A A . 60 TYR OH 1 1 1 409 1 1 27 ARG C C -12.491 0.073 10.582 1.00 . A A . 61 ARG C 1 1 1 410 1 1 27 ARG CA C -11.972 1.436 10.091 1.00 . A A . 61 ARG CA 1 1 1 411 1 1 27 ARG CB C -12.772 2.617 10.658 1.00 . A A . 61 ARG CB 1 1 1 412 1 1 27 ARG CD C -13.141 4.014 12.766 1.00 . A A . 61 ARG CD 1 1 1 413 1 1 27 ARG CG C -12.729 2.654 12.195 1.00 . A A . 61 ARG CG 1 1 1 414 1 1 27 ARG CZ C -15.289 5.271 12.991 1.00 . A A . 61 ARG CZ 1 1 1 415 1 1 27 ARG H H -12.502 2.227 8.139 1.00 . A A . 61 ARG H 1 1 1 416 1 1 27 ARG HA H -10.954 1.497 10.473 1.00 . A A . 61 ARG HA 1 1 1 417 1 1 27 ARG HB2 H -12.337 3.541 10.271 1.00 . A A . 61 ARG HB2 1 1 1 418 1 1 27 ARG HB3 H -13.807 2.552 10.318 1.00 . A A . 61 ARG HB3 1 1 1 419 1 1 27 ARG HD2 H -13.046 3.960 13.852 1.00 . A A . 61 ARG HD2 1 1 1 420 1 1 27 ARG HD3 H -12.453 4.775 12.391 1.00 . A A . 61 ARG HD3 1 1 1 421 1 1 27 ARG HE H -14.885 3.957 11.552 1.00 . A A . 61 ARG HE 1 1 1 422 1 1 27 ARG HG2 H -13.387 1.884 12.600 1.00 . A A . 61 ARG HG2 1 1 1 423 1 1 27 ARG HG3 H -11.711 2.445 12.530 1.00 . A A . 61 ARG HG3 1 1 1 424 1 1 27 ARG HH11 H -13.965 5.760 14.388 1.00 . A A . 61 ARG HH11 1 1 1 425 1 1 27 ARG HH12 H -15.484 6.612 14.476 1.00 . A A . 61 ARG HH12 1 1 1 426 1 1 27 ARG HH21 H -16.741 5.169 11.625 1.00 . A A . 61 ARG HH21 1 1 1 427 1 1 27 ARG HH22 H -17.032 6.259 12.938 1.00 . A A . 61 ARG HH22 1 1 1 428 1 1 27 ARG N N -11.899 1.562 8.622 1.00 . A A . 61 ARG N 1 1 1 429 1 1 27 ARG NE N -14.521 4.379 12.393 1.00 . A A . 61 ARG NE 1 1 1 430 1 1 27 ARG NH1 N -14.898 5.914 14.057 1.00 . A A . 61 ARG NH1 1 1 1 431 1 1 27 ARG NH2 N -16.476 5.535 12.526 1.00 . A A . 61 ARG NH2 1 1 1 432 1 1 27 ARG O O -12.187 -0.300 11.711 1.00 . A A . 61 ARG O 1 1 1 433 1 1 28 GLU C C -13.007 -3.197 9.650 1.00 . A A . 62 GLU C 1 1 1 434 1 1 28 GLU CA C -13.832 -1.956 10.060 1.00 . A A . 62 GLU CA 1 1 1 435 1 1 28 GLU CB C -15.237 -1.917 9.427 1.00 . A A . 62 GLU CB 1 1 1 436 1 1 28 GLU CD C -17.675 -2.590 9.682 1.00 . A A . 62 GLU CD 1 1 1 437 1 1 28 GLU CG C -16.208 -3.003 9.908 1.00 . A A . 62 GLU CG 1 1 1 438 1 1 28 GLU H H -13.467 -0.234 8.865 1.00 . A A . 62 GLU H 1 1 1 439 1 1 28 GLU HA H -13.963 -2.020 11.141 1.00 . A A . 62 GLU HA 1 1 1 440 1 1 28 GLU HB2 H -15.680 -0.953 9.684 1.00 . A A . 62 GLU HB2 1 1 1 441 1 1 28 GLU HB3 H -15.148 -1.968 8.341 1.00 . A A . 62 GLU HB3 1 1 1 442 1 1 28 GLU HG2 H -15.998 -3.937 9.384 1.00 . A A . 62 GLU HG2 1 1 1 443 1 1 28 GLU HG3 H -16.046 -3.166 10.976 1.00 . A A . 62 GLU HG3 1 1 1 444 1 1 28 GLU N N -13.186 -0.679 9.733 1.00 . A A . 62 GLU N 1 1 1 445 1 1 28 GLU O O -13.111 -4.224 10.316 1.00 . A A . 62 GLU O 1 1 1 446 1 1 28 GLU OE1 O -17.990 -2.008 8.620 1.00 . A A . 62 GLU OE1 1 1 1 447 1 1 28 GLU OE2 O -18.400 -2.462 10.696 1.00 . A A . 62 GLU OE2 1 1 1 448 1 1 29 ASN C C -9.700 -3.968 8.267 1.00 . A A . 63 ASN C 1 1 1 449 1 1 29 ASN CA C -11.225 -4.188 8.229 1.00 . A A . 63 ASN CA 1 1 1 450 1 1 29 ASN CB C -11.691 -4.567 6.809 1.00 . A A . 63 ASN CB 1 1 1 451 1 1 29 ASN CG C -13.143 -4.998 6.775 1.00 . A A . 63 ASN CG 1 1 1 452 1 1 29 ASN H H -12.008 -2.192 8.213 1.00 . A A . 63 ASN H 1 1 1 453 1 1 29 ASN HA H -11.411 -5.058 8.861 1.00 . A A . 63 ASN HA 1 1 1 454 1 1 29 ASN HB2 H -11.540 -3.736 6.121 1.00 . A A . 63 ASN HB2 1 1 1 455 1 1 29 ASN HB3 H -11.103 -5.405 6.436 1.00 . A A . 63 ASN HB3 1 1 1 456 1 1 29 ASN HD21 H -13.692 -3.140 6.308 1.00 . A A . 63 ASN HD21 1 1 1 457 1 1 29 ASN HD22 H -14.988 -4.310 6.500 1.00 . A A . 63 ASN HD22 1 1 1 458 1 1 29 ASN N N -12.022 -3.056 8.745 1.00 . A A . 63 ASN N 1 1 1 459 1 1 29 ASN ND2 N -14.026 -4.041 6.612 1.00 . A A . 63 ASN ND2 1 1 1 460 1 1 29 ASN O O -8.942 -4.906 8.011 1.00 . A A . 63 ASN O 1 1 1 461 1 1 29 ASN OD1 O -13.479 -6.127 7.110 1.00 . A A . 63 ASN OD1 1 1 1 462 1 1 30 MET C C -6.973 -3.555 9.747 1.00 . A A . 64 MET C 1 1 1 463 1 1 30 MET CA C -7.761 -2.539 8.897 1.00 . A A . 64 MET CA 1 1 1 464 1 1 30 MET CB C -7.540 -1.122 9.441 1.00 . A A . 64 MET CB 1 1 1 465 1 1 30 MET CE C -6.664 0.259 12.780 1.00 . A A . 64 MET CE 1 1 1 466 1 1 30 MET CG C -8.228 -0.830 10.782 1.00 . A A . 64 MET CG 1 1 1 467 1 1 30 MET H H -9.858 -2.052 8.881 1.00 . A A . 64 MET H 1 1 1 468 1 1 30 MET HA H -7.324 -2.569 7.901 1.00 . A A . 64 MET HA 1 1 1 469 1 1 30 MET HB2 H -6.471 -0.924 9.527 1.00 . A A . 64 MET HB2 1 1 1 470 1 1 30 MET HB3 H -7.928 -0.429 8.712 1.00 . A A . 64 MET HB3 1 1 1 471 1 1 30 MET HE1 H -6.111 0.721 11.962 1.00 . A A . 64 MET HE1 1 1 1 472 1 1 30 MET HE2 H -6.009 0.119 13.638 1.00 . A A . 64 MET HE2 1 1 1 473 1 1 30 MET HE3 H -7.504 0.895 13.061 1.00 . A A . 64 MET HE3 1 1 1 474 1 1 30 MET HG2 H -8.395 0.246 10.842 1.00 . A A . 64 MET HG2 1 1 1 475 1 1 30 MET HG3 H -9.211 -1.301 10.802 1.00 . A A . 64 MET HG3 1 1 1 476 1 1 30 MET N N -9.204 -2.813 8.728 1.00 . A A . 64 MET N 1 1 1 477 1 1 30 MET O O -5.761 -3.681 9.591 1.00 . A A . 64 MET O 1 1 1 478 1 1 30 MET SD S -7.295 -1.349 12.250 1.00 . A A . 64 MET SD 1 1 1 479 1 1 31 ASN C C -6.625 -6.617 10.535 1.00 . A A . 65 ASN C 1 1 1 480 1 1 31 ASN CA C -7.058 -5.410 11.395 1.00 . A A . 65 ASN CA 1 1 1 481 1 1 31 ASN CB C -8.095 -5.864 12.442 1.00 . A A . 65 ASN CB 1 1 1 482 1 1 31 ASN CG C -8.825 -4.716 13.118 1.00 . A A . 65 ASN CG 1 1 1 483 1 1 31 ASN H H -8.630 -4.121 10.738 1.00 . A A . 65 ASN H 1 1 1 484 1 1 31 ASN HA H -6.171 -5.024 11.901 1.00 . A A . 65 ASN HA 1 1 1 485 1 1 31 ASN HB2 H -8.854 -6.473 11.949 1.00 . A A . 65 ASN HB2 1 1 1 486 1 1 31 ASN HB3 H -7.603 -6.483 13.190 1.00 . A A . 65 ASN HB3 1 1 1 487 1 1 31 ASN HD21 H -7.827 -4.906 14.865 1.00 . A A . 65 ASN HD21 1 1 1 488 1 1 31 ASN HD22 H -9.038 -3.622 14.722 1.00 . A A . 65 ASN HD22 1 1 1 489 1 1 31 ASN N N -7.646 -4.331 10.596 1.00 . A A . 65 ASN N 1 1 1 490 1 1 31 ASN ND2 N -8.509 -4.391 14.348 1.00 . A A . 65 ASN ND2 1 1 1 491 1 1 31 ASN O O -5.777 -7.411 10.945 1.00 . A A . 65 ASN O 1 1 1 492 1 1 31 ASN OD1 O -9.664 -4.064 12.529 1.00 . A A . 65 ASN OD1 1 1 1 493 1 1 32 ARG C C -6.263 -7.351 7.195 1.00 . A A . 66 ARG C 1 1 1 494 1 1 32 ARG CA C -7.101 -7.843 8.381 1.00 . A A . 66 ARG CA 1 1 1 495 1 1 32 ARG CB C -8.500 -8.241 7.868 1.00 . A A . 66 ARG CB 1 1 1 496 1 1 32 ARG CD C -10.864 -8.817 8.544 1.00 . A A . 66 ARG CD 1 1 1 497 1 1 32 ARG CG C -9.376 -8.980 8.894 1.00 . A A . 66 ARG CG 1 1 1 498 1 1 32 ARG CZ C -12.804 -10.349 8.546 1.00 . A A . 66 ARG CZ 1 1 1 499 1 1 32 ARG H H -7.987 -6.082 9.167 1.00 . A A . 66 ARG H 1 1 1 500 1 1 32 ARG HA H -6.598 -8.711 8.806 1.00 . A A . 66 ARG HA 1 1 1 501 1 1 32 ARG HB2 H -9.026 -7.347 7.535 1.00 . A A . 66 ARG HB2 1 1 1 502 1 1 32 ARG HB3 H -8.387 -8.874 6.992 1.00 . A A . 66 ARG HB3 1 1 1 503 1 1 32 ARG HD2 H -11.231 -7.864 8.930 1.00 . A A . 66 ARG HD2 1 1 1 504 1 1 32 ARG HD3 H -10.965 -8.805 7.456 1.00 . A A . 66 ARG HD3 1 1 1 505 1 1 32 ARG HE H -11.182 -10.604 9.633 1.00 . A A . 66 ARG HE 1 1 1 506 1 1 32 ARG HG2 H -9.100 -10.036 8.879 1.00 . A A . 66 ARG HG2 1 1 1 507 1 1 32 ARG HG3 H -9.212 -8.593 9.900 1.00 . A A . 66 ARG HG3 1 1 1 508 1 1 32 ARG HH11 H -13.089 -8.777 7.353 1.00 . A A . 66 ARG HH11 1 1 1 509 1 1 32 ARG HH12 H -14.254 -10.040 7.190 1.00 . A A . 66 ARG HH12 1 1 1 510 1 1 32 ARG HH21 H -12.746 -12.120 9.459 1.00 . A A . 66 ARG HH21 1 1 1 511 1 1 32 ARG HH22 H -14.132 -11.826 8.460 1.00 . A A . 66 ARG HH22 1 1 1 512 1 1 32 ARG N N -7.288 -6.787 9.385 1.00 . A A . 66 ARG N 1 1 1 513 1 1 32 ARG NE N -11.672 -9.927 9.084 1.00 . A A . 66 ARG NE 1 1 1 514 1 1 32 ARG NH1 N -13.488 -9.641 7.692 1.00 . A A . 66 ARG NH1 1 1 1 515 1 1 32 ARG NH2 N -13.312 -11.490 8.925 1.00 . A A . 66 ARG NH2 1 1 1 516 1 1 32 ARG O O -5.483 -8.120 6.627 1.00 . A A . 66 ARG O 1 1 1 517 1 1 33 TYR C C -4.368 -5.431 5.523 1.00 . A A . 67 TYR C 1 1 1 518 1 1 33 TYR CA C -5.918 -5.512 5.578 1.00 . A A . 67 TYR CA 1 1 1 519 1 1 33 TYR CB C -6.618 -4.164 5.290 1.00 . A A . 67 TYR CB 1 1 1 520 1 1 33 TYR CD1 C -5.125 -2.433 6.411 1.00 . A A . 67 TYR CD1 1 1 1 521 1 1 33 TYR CD2 C -5.642 -2.180 4.051 1.00 . A A . 67 TYR CD2 1 1 1 522 1 1 33 TYR CE1 C -4.401 -1.228 6.384 1.00 . A A . 67 TYR CE1 1 1 1 523 1 1 33 TYR CE2 C -4.872 -1.005 4.002 1.00 . A A . 67 TYR CE2 1 1 1 524 1 1 33 TYR CG C -5.757 -2.910 5.248 1.00 . A A . 67 TYR CG 1 1 1 525 1 1 33 TYR CZ C -4.251 -0.528 5.170 1.00 . A A . 67 TYR CZ 1 1 1 526 1 1 33 TYR H H -7.176 -5.569 7.294 1.00 . A A . 67 TYR H 1 1 1 527 1 1 33 TYR HA H -6.249 -6.198 4.799 1.00 . A A . 67 TYR HA 1 1 1 528 1 1 33 TYR HB2 H -7.123 -4.263 4.328 1.00 . A A . 67 TYR HB2 1 1 1 529 1 1 33 TYR HB3 H -7.413 -3.995 6.016 1.00 . A A . 67 TYR HB3 1 1 1 530 1 1 33 TYR HD1 H -5.196 -2.999 7.327 1.00 . A A . 67 TYR HD1 1 1 1 531 1 1 33 TYR HD2 H -6.176 -2.501 3.172 1.00 . A A . 67 TYR HD2 1 1 1 532 1 1 33 TYR HE1 H -3.944 -0.853 7.285 1.00 . A A . 67 TYR HE1 1 1 1 533 1 1 33 TYR HE2 H -4.783 -0.439 3.086 1.00 . A A . 67 TYR HE2 1 1 1 534 1 1 33 TYR HH H -3.241 0.906 5.991 1.00 . A A . 67 TYR HH 1 1 1 535 1 1 33 TYR N N -6.445 -6.084 6.818 1.00 . A A . 67 TYR N 1 1 1 536 1 1 33 TYR O O -3.693 -5.196 6.533 1.00 . A A . 67 TYR O 1 1 1 537 1 1 33 TYR OH O -3.491 0.591 5.118 1.00 . A A . 67 TYR OH 1 1 1 538 1 1 34 PRO C C -1.849 -3.936 4.237 1.00 . A A . 68 PRO C 1 1 1 539 1 1 34 PRO CA C -2.321 -5.398 4.119 1.00 . A A . 68 PRO CA 1 1 1 540 1 1 34 PRO CB C -2.049 -6.022 2.751 1.00 . A A . 68 PRO CB 1 1 1 541 1 1 34 PRO CD C -4.385 -6.082 3.125 1.00 . A A . 68 PRO CD 1 1 1 542 1 1 34 PRO CG C -3.365 -5.891 2.004 1.00 . A A . 68 PRO CG 1 1 1 543 1 1 34 PRO HA H -1.789 -5.981 4.870 1.00 . A A . 68 PRO HA 1 1 1 544 1 1 34 PRO HB2 H -1.219 -5.553 2.221 1.00 . A A . 68 PRO HB2 1 1 1 545 1 1 34 PRO HB3 H -1.871 -7.081 2.900 1.00 . A A . 68 PRO HB3 1 1 1 546 1 1 34 PRO HD2 H -5.313 -5.559 2.909 1.00 . A A . 68 PRO HD2 1 1 1 547 1 1 34 PRO HD3 H -4.591 -7.146 3.253 1.00 . A A . 68 PRO HD3 1 1 1 548 1 1 34 PRO HG2 H -3.441 -4.891 1.577 1.00 . A A . 68 PRO HG2 1 1 1 549 1 1 34 PRO HG3 H -3.467 -6.657 1.235 1.00 . A A . 68 PRO HG3 1 1 1 550 1 1 34 PRO N N -3.758 -5.568 4.331 1.00 . A A . 68 PRO N 1 1 1 551 1 1 34 PRO O O -1.699 -3.219 3.255 1.00 . A A . 68 PRO O 1 1 1 552 1 1 35 ASN C C 0.453 -1.754 5.523 1.00 . A A . 69 ASN C 1 1 1 553 1 1 35 ASN CA C -0.997 -2.226 5.817 1.00 . A A . 69 ASN CA 1 1 1 554 1 1 35 ASN CB C -1.365 -2.106 7.311 1.00 . A A . 69 ASN CB 1 1 1 555 1 1 35 ASN CG C -0.302 -2.563 8.300 1.00 . A A . 69 ASN CG 1 1 1 556 1 1 35 ASN H H -1.603 -4.225 6.175 1.00 . A A . 69 ASN H 1 1 1 557 1 1 35 ASN HA H -1.647 -1.554 5.251 1.00 . A A . 69 ASN HA 1 1 1 558 1 1 35 ASN HB2 H -1.566 -1.062 7.520 1.00 . A A . 69 ASN HB2 1 1 1 559 1 1 35 ASN HB3 H -2.279 -2.664 7.515 1.00 . A A . 69 ASN HB3 1 1 1 560 1 1 35 ASN HD21 H 0.384 -4.028 7.113 1.00 . A A . 69 ASN HD21 1 1 1 561 1 1 35 ASN HD22 H 1.155 -3.813 8.696 1.00 . A A . 69 ASN HD22 1 1 1 562 1 1 35 ASN N N -1.343 -3.600 5.424 1.00 . A A . 69 ASN N 1 1 1 563 1 1 35 ASN ND2 N 0.446 -3.607 8.015 1.00 . A A . 69 ASN ND2 1 1 1 564 1 1 35 ASN O O 0.987 -0.922 6.251 1.00 . A A . 69 ASN O 1 1 1 565 1 1 35 ASN OD1 O -0.116 -1.980 9.349 1.00 . A A . 69 ASN OD1 1 1 1 566 1 1 36 GLN C C 2.981 -2.417 2.963 1.00 . A A . 70 GLN C 1 1 1 567 1 1 36 GLN CA C 2.629 -2.193 4.431 1.00 . A A . 70 GLN CA 1 1 1 568 1 1 36 GLN CB C 3.464 -3.090 5.366 1.00 . A A . 70 GLN CB 1 1 1 569 1 1 36 GLN CD C 3.939 -5.516 6.097 1.00 . A A . 70 GLN CD 1 1 1 570 1 1 36 GLN CG C 3.401 -4.584 5.015 1.00 . A A . 70 GLN CG 1 1 1 571 1 1 36 GLN H H 0.707 -3.015 3.973 1.00 . A A . 70 GLN H 1 1 1 572 1 1 36 GLN HA H 2.861 -1.151 4.662 1.00 . A A . 70 GLN HA 1 1 1 573 1 1 36 GLN HB2 H 4.509 -2.788 5.317 1.00 . A A . 70 GLN HB2 1 1 1 574 1 1 36 GLN HB3 H 3.109 -2.945 6.386 1.00 . A A . 70 GLN HB3 1 1 1 575 1 1 36 GLN HE21 H 4.901 -4.087 7.164 1.00 . A A . 70 GLN HE21 1 1 1 576 1 1 36 GLN HE22 H 4.947 -5.726 7.796 1.00 . A A . 70 GLN HE22 1 1 1 577 1 1 36 GLN HG2 H 2.363 -4.860 4.832 1.00 . A A . 70 GLN HG2 1 1 1 578 1 1 36 GLN HG3 H 3.973 -4.759 4.104 1.00 . A A . 70 GLN HG3 1 1 1 579 1 1 36 GLN N N 1.191 -2.438 4.649 1.00 . A A . 70 GLN N 1 1 1 580 1 1 36 GLN NE2 N 4.627 -5.053 7.119 1.00 . A A . 70 GLN NE2 1 1 1 581 1 1 36 GLN O O 2.291 -3.185 2.291 1.00 . A A . 70 GLN O 1 1 1 582 1 1 36 GLN OE1 O 3.602 -6.687 6.100 1.00 . A A . 70 GLN OE1 1 1 1 583 1 1 37 VAL C C 5.752 -2.190 0.683 1.00 . A A . 71 VAL C 1 1 1 584 1 1 37 VAL CA C 4.345 -1.713 1.035 1.00 . A A . 71 VAL CA 1 1 1 585 1 1 37 VAL CB C 4.071 -0.273 0.543 1.00 . A A . 71 VAL CB 1 1 1 586 1 1 37 VAL CG1 C 2.703 0.219 1.039 1.00 . A A . 71 VAL CG1 1 1 1 587 1 1 37 VAL CG2 C 5.111 0.767 0.977 1.00 . A A . 71 VAL CG2 1 1 1 588 1 1 37 VAL H H 4.642 -1.262 3.099 1.00 . A A . 71 VAL H 1 1 1 589 1 1 37 VAL HA H 3.653 -2.350 0.491 1.00 . A A . 71 VAL HA 1 1 1 590 1 1 37 VAL HB H 4.046 -0.299 -0.545 1.00 . A A . 71 VAL HB 1 1 1 591 1 1 37 VAL HG11 H 2.376 1.044 0.407 1.00 . A A . 71 VAL HG11 1 1 1 592 1 1 37 VAL HG12 H 2.765 0.560 2.073 1.00 . A A . 71 VAL HG12 1 1 1 593 1 1 37 VAL HG13 H 1.969 -0.582 0.982 1.00 . A A . 71 VAL HG13 1 1 1 594 1 1 37 VAL HG21 H 4.784 1.762 0.671 1.00 . A A . 71 VAL HG21 1 1 1 595 1 1 37 VAL HG22 H 6.066 0.564 0.494 1.00 . A A . 71 VAL HG22 1 1 1 596 1 1 37 VAL HG23 H 5.245 0.751 2.058 1.00 . A A . 71 VAL HG23 1 1 1 597 1 1 37 VAL N N 4.082 -1.837 2.482 1.00 . A A . 71 VAL N 1 1 1 598 1 1 37 VAL O O 6.684 -1.942 1.442 1.00 . A A . 71 VAL O 1 1 1 599 1 1 38 TYR C C 7.463 -2.728 -2.262 1.00 . A A . 72 TYR C 1 1 1 600 1 1 38 TYR CA C 7.157 -3.443 -0.943 1.00 . A A . 72 TYR CA 1 1 1 601 1 1 38 TYR CB C 7.073 -4.960 -1.211 1.00 . A A . 72 TYR CB 1 1 1 602 1 1 38 TYR CD1 C 6.252 -6.038 0.930 1.00 . A A . 72 TYR CD1 1 1 1 603 1 1 38 TYR CD2 C 8.415 -6.714 0.035 1.00 . A A . 72 TYR CD2 1 1 1 604 1 1 38 TYR CE1 C 6.370 -6.993 1.958 1.00 . A A . 72 TYR CE1 1 1 1 605 1 1 38 TYR CE2 C 8.537 -7.674 1.058 1.00 . A A . 72 TYR CE2 1 1 1 606 1 1 38 TYR CG C 7.267 -5.898 -0.034 1.00 . A A . 72 TYR CG 1 1 1 607 1 1 38 TYR CZ C 7.513 -7.819 2.017 1.00 . A A . 72 TYR CZ 1 1 1 608 1 1 38 TYR H H 5.077 -3.065 -1.010 1.00 . A A . 72 TYR H 1 1 1 609 1 1 38 TYR HA H 7.957 -3.255 -0.239 1.00 . A A . 72 TYR HA 1 1 1 610 1 1 38 TYR HB2 H 6.106 -5.186 -1.659 1.00 . A A . 72 TYR HB2 1 1 1 611 1 1 38 TYR HB3 H 7.828 -5.211 -1.958 1.00 . A A . 72 TYR HB3 1 1 1 612 1 1 38 TYR HD1 H 5.372 -5.417 0.868 1.00 . A A . 72 TYR HD1 1 1 1 613 1 1 38 TYR HD2 H 9.199 -6.612 -0.703 1.00 . A A . 72 TYR HD2 1 1 1 614 1 1 38 TYR HE1 H 5.584 -7.099 2.688 1.00 . A A . 72 TYR HE1 1 1 1 615 1 1 38 TYR HE2 H 9.410 -8.305 1.122 1.00 . A A . 72 TYR HE2 1 1 1 616 1 1 38 TYR HH H 6.895 -8.748 3.601 1.00 . A A . 72 TYR HH 1 1 1 617 1 1 38 TYR N N 5.883 -2.936 -0.418 1.00 . A A . 72 TYR N 1 1 1 618 1 1 38 TYR O O 6.653 -2.822 -3.174 1.00 . A A . 72 TYR O 1 1 1 619 1 1 38 TYR OH O 7.634 -8.755 2.993 1.00 . A A . 72 TYR OH 1 1 1 620 1 1 39 TYR C C 10.464 -1.928 -4.136 1.00 . A A . 73 TYR C 1 1 1 621 1 1 39 TYR CA C 9.084 -1.476 -3.663 1.00 . A A . 73 TYR CA 1 1 1 622 1 1 39 TYR CB C 9.121 0.036 -3.406 1.00 . A A . 73 TYR CB 1 1 1 623 1 1 39 TYR CD1 C 11.189 0.620 -2.050 1.00 . A A . 73 TYR CD1 1 1 1 624 1 1 39 TYR CD2 C 8.995 0.827 -1.010 1.00 . A A . 73 TYR CD2 1 1 1 625 1 1 39 TYR CE1 C 11.798 1.122 -0.887 1.00 . A A . 73 TYR CE1 1 1 1 626 1 1 39 TYR CE2 C 9.604 1.319 0.159 1.00 . A A . 73 TYR CE2 1 1 1 627 1 1 39 TYR CG C 9.789 0.485 -2.121 1.00 . A A . 73 TYR CG 1 1 1 628 1 1 39 TYR CZ C 11.004 1.478 0.220 1.00 . A A . 73 TYR CZ 1 1 1 629 1 1 39 TYR H H 9.300 -2.141 -1.654 1.00 . A A . 73 TYR H 1 1 1 630 1 1 39 TYR HA H 8.376 -1.662 -4.471 1.00 . A A . 73 TYR HA 1 1 1 631 1 1 39 TYR HB2 H 9.626 0.507 -4.243 1.00 . A A . 73 TYR HB2 1 1 1 632 1 1 39 TYR HB3 H 8.114 0.430 -3.417 1.00 . A A . 73 TYR HB3 1 1 1 633 1 1 39 TYR HD1 H 11.807 0.368 -2.893 1.00 . A A . 73 TYR HD1 1 1 1 634 1 1 39 TYR HD2 H 7.920 0.748 -1.068 1.00 . A A . 73 TYR HD2 1 1 1 635 1 1 39 TYR HE1 H 12.870 1.263 -0.840 1.00 . A A . 73 TYR HE1 1 1 1 636 1 1 39 TYR HE2 H 9.014 1.640 0.998 1.00 . A A . 73 TYR HE2 1 1 1 637 1 1 39 TYR HH H 12.472 2.354 1.138 1.00 . A A . 73 TYR HH 1 1 1 638 1 1 39 TYR N N 8.664 -2.187 -2.447 1.00 . A A . 73 TYR N 1 1 1 639 1 1 39 TYR O O 11.282 -2.381 -3.343 1.00 . A A . 73 TYR O 1 1 1 640 1 1 39 TYR OH O 11.566 2.010 1.331 1.00 . A A . 73 TYR OH 1 1 1 641 1 1 40 ARG C C 12.806 -0.472 -5.428 1.00 . A A . 74 ARG C 1 1 1 642 1 1 40 ARG CA C 12.144 -1.770 -5.919 1.00 . A A . 74 ARG CA 1 1 1 643 1 1 40 ARG CB C 12.088 -1.850 -7.452 1.00 . A A . 74 ARG CB 1 1 1 644 1 1 40 ARG CD C 13.301 -2.566 -9.563 1.00 . A A . 74 ARG CD 1 1 1 645 1 1 40 ARG CG C 13.450 -2.136 -8.101 1.00 . A A . 74 ARG CG 1 1 1 646 1 1 40 ARG CZ C 12.499 -4.580 -10.791 1.00 . A A . 74 ARG CZ 1 1 1 647 1 1 40 ARG H H 10.084 -1.266 -5.982 1.00 . A A . 74 ARG H 1 1 1 648 1 1 40 ARG HA H 12.689 -2.622 -5.515 1.00 . A A . 74 ARG HA 1 1 1 649 1 1 40 ARG HB2 H 11.394 -2.650 -7.713 1.00 . A A . 74 ARG HB2 1 1 1 650 1 1 40 ARG HB3 H 11.689 -0.915 -7.853 1.00 . A A . 74 ARG HB3 1 1 1 651 1 1 40 ARG HD2 H 12.745 -1.800 -10.100 1.00 . A A . 74 ARG HD2 1 1 1 652 1 1 40 ARG HD3 H 14.298 -2.642 -9.999 1.00 . A A . 74 ARG HD3 1 1 1 653 1 1 40 ARG HE H 12.152 -4.214 -8.855 1.00 . A A . 74 ARG HE 1 1 1 654 1 1 40 ARG HG2 H 14.068 -1.238 -8.054 1.00 . A A . 74 ARG HG2 1 1 1 655 1 1 40 ARG HG3 H 13.955 -2.939 -7.568 1.00 . A A . 74 ARG HG3 1 1 1 656 1 1 40 ARG HH11 H 13.774 -3.473 -11.858 1.00 . A A . 74 ARG HH11 1 1 1 657 1 1 40 ARG HH12 H 13.074 -4.817 -12.709 1.00 . A A . 74 ARG HH12 1 1 1 658 1 1 40 ARG HH21 H 11.009 -5.731 -10.121 1.00 . A A . 74 ARG HH21 1 1 1 659 1 1 40 ARG HH22 H 11.571 -6.081 -11.712 1.00 . A A . 74 ARG HH22 1 1 1 660 1 1 40 ARG N N 10.753 -1.786 -5.432 1.00 . A A . 74 ARG N 1 1 1 661 1 1 40 ARG NE N 12.598 -3.861 -9.689 1.00 . A A . 74 ARG NE 1 1 1 662 1 1 40 ARG NH1 N 13.156 -4.271 -11.875 1.00 . A A . 74 ARG NH1 1 1 1 663 1 1 40 ARG NH2 N 11.717 -5.622 -10.835 1.00 . A A . 74 ARG NH2 1 1 1 664 1 1 40 ARG O O 12.066 0.491 -5.266 1.00 . A A . 74 ARG O 1 1 1 665 1 1 41 PRO C C 14.536 1.917 -5.993 1.00 . A A . 75 PRO C 1 1 1 666 1 1 41 PRO CA C 14.734 0.900 -4.849 1.00 . A A . 75 PRO CA 1 1 1 667 1 1 41 PRO CB C 16.200 0.602 -4.518 1.00 . A A . 75 PRO CB 1 1 1 668 1 1 41 PRO CD C 15.099 -1.460 -5.060 1.00 . A A . 75 PRO CD 1 1 1 669 1 1 41 PRO CG C 16.455 -0.765 -5.156 1.00 . A A . 75 PRO CG 1 1 1 670 1 1 41 PRO HA H 14.265 1.313 -3.954 1.00 . A A . 75 PRO HA 1 1 1 671 1 1 41 PRO HB2 H 16.878 1.366 -4.896 1.00 . A A . 75 PRO HB2 1 1 1 672 1 1 41 PRO HB3 H 16.312 0.516 -3.436 1.00 . A A . 75 PRO HB3 1 1 1 673 1 1 41 PRO HD2 H 14.998 -2.190 -5.857 1.00 . A A . 75 PRO HD2 1 1 1 674 1 1 41 PRO HD3 H 15.006 -1.948 -4.089 1.00 . A A . 75 PRO HD3 1 1 1 675 1 1 41 PRO HG2 H 16.718 -0.644 -6.207 1.00 . A A . 75 PRO HG2 1 1 1 676 1 1 41 PRO HG3 H 17.234 -1.318 -4.631 1.00 . A A . 75 PRO HG3 1 1 1 677 1 1 41 PRO N N 14.118 -0.393 -5.151 1.00 . A A . 75 PRO N 1 1 1 678 1 1 41 PRO O O 14.227 1.555 -7.133 1.00 . A A . 75 PRO O 1 1 1 679 1 1 42 VAL C C 15.271 4.688 -7.486 1.00 . A A . 76 VAL C 1 1 1 680 1 1 42 VAL CA C 14.152 4.333 -6.502 1.00 . A A . 76 VAL CA 1 1 1 681 1 1 42 VAL CB C 13.801 5.594 -5.689 1.00 . A A . 76 VAL CB 1 1 1 682 1 1 42 VAL CG1 C 12.521 5.406 -4.867 1.00 . A A . 76 VAL CG1 1 1 1 683 1 1 42 VAL CG2 C 14.938 6.000 -4.748 1.00 . A A . 76 VAL CG2 1 1 1 684 1 1 42 VAL H H 14.669 3.413 -4.646 1.00 . A A . 76 VAL H 1 1 1 685 1 1 42 VAL HA H 13.286 4.076 -7.108 1.00 . A A . 76 VAL HA 1 1 1 686 1 1 42 VAL HB H 13.619 6.416 -6.382 1.00 . A A . 76 VAL HB 1 1 1 687 1 1 42 VAL HG11 H 12.664 4.656 -4.089 1.00 . A A . 76 VAL HG11 1 1 1 688 1 1 42 VAL HG12 H 11.710 5.094 -5.519 1.00 . A A . 76 VAL HG12 1 1 1 689 1 1 42 VAL HG13 H 12.248 6.357 -4.407 1.00 . A A . 76 VAL HG13 1 1 1 690 1 1 42 VAL HG21 H 15.868 6.122 -5.302 1.00 . A A . 76 VAL HG21 1 1 1 691 1 1 42 VAL HG22 H 15.084 5.268 -3.954 1.00 . A A . 76 VAL HG22 1 1 1 692 1 1 42 VAL HG23 H 14.698 6.957 -4.304 1.00 . A A . 76 VAL HG23 1 1 1 693 1 1 42 VAL N N 14.470 3.196 -5.611 1.00 . A A . 76 VAL N 1 1 1 694 1 1 42 VAL O O 15.025 5.432 -8.428 1.00 . A A . 76 VAL O 1 1 1 695 1 1 43 ASP C C 17.620 4.207 -9.540 1.00 . A A . 77 ASP C 1 1 1 696 1 1 43 ASP CA C 17.712 4.378 -8.015 1.00 . A A . 77 ASP CA 1 1 1 697 1 1 43 ASP CB C 18.788 3.435 -7.436 1.00 . A A . 77 ASP CB 1 1 1 698 1 1 43 ASP CG C 18.519 1.945 -7.726 1.00 . A A . 77 ASP CG 1 1 1 699 1 1 43 ASP H H 16.512 3.387 -6.602 1.00 . A A . 77 ASP H 1 1 1 700 1 1 43 ASP HA H 18.008 5.409 -7.821 1.00 . A A . 77 ASP HA 1 1 1 701 1 1 43 ASP HB2 H 19.757 3.719 -7.849 1.00 . A A . 77 ASP HB2 1 1 1 702 1 1 43 ASP HB3 H 18.838 3.580 -6.354 1.00 . A A . 77 ASP HB3 1 1 1 703 1 1 43 ASP N N 16.461 4.122 -7.291 1.00 . A A . 77 ASP N 1 1 1 704 1 1 43 ASP O O 18.193 4.983 -10.298 1.00 . A A . 77 ASP O 1 1 1 705 1 1 43 ASP OD1 O 17.405 1.472 -7.398 1.00 . A A . 77 ASP OD1 1 1 1 706 1 1 43 ASP OD2 O 19.315 1.315 -8.454 1.00 . A A . 77 ASP OD2 1 1 1 707 1 1 44 GLN C C 15.477 3.871 -12.042 1.00 . A A . 78 GLN C 1 1 1 708 1 1 44 GLN CA C 16.586 2.988 -11.430 1.00 . A A . 78 GLN CA 1 1 1 709 1 1 44 GLN CB C 16.255 1.497 -11.647 1.00 . A A . 78 GLN CB 1 1 1 710 1 1 44 GLN CD C 16.812 -0.923 -11.028 1.00 . A A . 78 GLN CD 1 1 1 711 1 1 44 GLN CG C 17.227 0.540 -10.947 1.00 . A A . 78 GLN CG 1 1 1 712 1 1 44 GLN H H 16.427 2.620 -9.309 1.00 . A A . 78 GLN H 1 1 1 713 1 1 44 GLN HA H 17.512 3.217 -11.961 1.00 . A A . 78 GLN HA 1 1 1 714 1 1 44 GLN HB2 H 15.249 1.302 -11.277 1.00 . A A . 78 GLN HB2 1 1 1 715 1 1 44 GLN HB3 H 16.278 1.288 -12.718 1.00 . A A . 78 GLN HB3 1 1 1 716 1 1 44 GLN HE21 H 17.133 -1.113 -9.087 1.00 . A A . 78 GLN HE21 1 1 1 717 1 1 44 GLN HE22 H 16.772 -2.591 -9.996 1.00 . A A . 78 GLN HE22 1 1 1 718 1 1 44 GLN HG2 H 18.235 0.663 -11.344 1.00 . A A . 78 GLN HG2 1 1 1 719 1 1 44 GLN HG3 H 17.255 0.791 -9.892 1.00 . A A . 78 GLN HG3 1 1 1 720 1 1 44 GLN N N 16.802 3.258 -10.000 1.00 . A A . 78 GLN N 1 1 1 721 1 1 44 GLN NE2 N 16.770 -1.598 -9.902 1.00 . A A . 78 GLN NE2 1 1 1 722 1 1 44 GLN O O 15.005 3.593 -13.147 1.00 . A A . 78 GLN O 1 1 1 723 1 1 44 GLN OE1 O 16.410 -1.478 -12.043 1.00 . A A . 78 GLN OE1 1 1 1 724 1 1 45 TYR C C 13.739 7.003 -11.412 1.00 . A A . 79 TYR C 1 1 1 725 1 1 45 TYR CA C 13.649 5.477 -11.554 1.00 . A A . 79 TYR CA 1 1 1 726 1 1 45 TYR CB C 12.536 4.885 -10.665 1.00 . A A . 79 TYR CB 1 1 1 727 1 1 45 TYR CD1 C 12.580 2.354 -10.713 1.00 . A A . 79 TYR CD1 1 1 1 728 1 1 45 TYR CD2 C 10.895 3.532 -12.031 1.00 . A A . 79 TYR CD2 1 1 1 729 1 1 45 TYR CE1 C 12.066 1.122 -11.159 1.00 . A A . 79 TYR CE1 1 1 1 730 1 1 45 TYR CE2 C 10.375 2.301 -12.472 1.00 . A A . 79 TYR CE2 1 1 1 731 1 1 45 TYR CG C 11.997 3.558 -11.152 1.00 . A A . 79 TYR CG 1 1 1 732 1 1 45 TYR CZ C 10.961 1.095 -12.038 1.00 . A A . 79 TYR CZ 1 1 1 733 1 1 45 TYR H H 15.367 5.026 -10.383 1.00 . A A . 79 TYR H 1 1 1 734 1 1 45 TYR HA H 13.375 5.286 -12.590 1.00 . A A . 79 TYR HA 1 1 1 735 1 1 45 TYR HB2 H 12.896 4.772 -9.643 1.00 . A A . 79 TYR HB2 1 1 1 736 1 1 45 TYR HB3 H 11.692 5.573 -10.621 1.00 . A A . 79 TYR HB3 1 1 1 737 1 1 45 TYR HD1 H 13.424 2.380 -10.033 1.00 . A A . 79 TYR HD1 1 1 1 738 1 1 45 TYR HD2 H 10.448 4.456 -12.365 1.00 . A A . 79 TYR HD2 1 1 1 739 1 1 45 TYR HE1 H 12.531 0.211 -10.832 1.00 . A A . 79 TYR HE1 1 1 1 740 1 1 45 TYR HE2 H 9.537 2.265 -13.150 1.00 . A A . 79 TYR HE2 1 1 1 741 1 1 45 TYR HH H 10.915 -0.836 -12.109 1.00 . A A . 79 TYR HH 1 1 1 742 1 1 45 TYR N N 14.916 4.805 -11.269 1.00 . A A . 79 TYR N 1 1 1 743 1 1 45 TYR O O 14.769 7.585 -11.105 1.00 . A A . 79 TYR O 1 1 1 744 1 1 45 TYR OH O 10.443 -0.086 -12.464 1.00 . A A . 79 TYR OH 1 1 1 745 1 1 46 ASN C C 11.085 9.604 -11.842 1.00 . A A . 80 ASN C 1 1 1 746 1 1 46 ASN CA C 12.543 9.108 -11.993 1.00 . A A . 80 ASN CA 1 1 1 747 1 1 46 ASN CB C 13.117 9.476 -13.379 1.00 . A A . 80 ASN CB 1 1 1 748 1 1 46 ASN CG C 12.337 8.863 -14.535 1.00 . A A . 80 ASN CG 1 1 1 749 1 1 46 ASN H H 11.898 7.095 -12.181 1.00 . A A . 80 ASN H 1 1 1 750 1 1 46 ASN HA H 13.137 9.598 -11.216 1.00 . A A . 80 ASN HA 1 1 1 751 1 1 46 ASN HB2 H 13.103 10.561 -13.490 1.00 . A A . 80 ASN HB2 1 1 1 752 1 1 46 ASN HB3 H 14.156 9.153 -13.438 1.00 . A A . 80 ASN HB3 1 1 1 753 1 1 46 ASN HD21 H 13.254 7.087 -14.378 1.00 . A A . 80 ASN HD21 1 1 1 754 1 1 46 ASN HD22 H 11.996 7.247 -15.604 1.00 . A A . 80 ASN HD22 1 1 1 755 1 1 46 ASN N N 12.659 7.655 -11.839 1.00 . A A . 80 ASN N 1 1 1 756 1 1 46 ASN ND2 N 12.491 7.587 -14.801 1.00 . A A . 80 ASN ND2 1 1 1 757 1 1 46 ASN O O 10.779 10.747 -12.163 1.00 . A A . 80 ASN O 1 1 1 758 1 1 46 ASN OD1 O 11.451 9.453 -15.123 1.00 . A A . 80 ASN OD1 1 1 1 759 1 1 47 ASN C C 7.952 7.927 -10.759 1.00 . A A . 81 ASN C 1 1 1 760 1 1 47 ASN CA C 8.706 8.929 -11.640 1.00 . A A . 81 ASN CA 1 1 1 761 1 1 47 ASN CB C 8.224 8.783 -13.097 1.00 . A A . 81 ASN CB 1 1 1 762 1 1 47 ASN CG C 8.166 10.107 -13.831 1.00 . A A . 81 ASN CG 1 1 1 763 1 1 47 ASN H H 10.451 7.802 -11.206 1.00 . A A . 81 ASN H 1 1 1 764 1 1 47 ASN HA H 8.492 9.939 -11.280 1.00 . A A . 81 ASN HA 1 1 1 765 1 1 47 ASN HB2 H 8.840 8.065 -13.636 1.00 . A A . 81 ASN HB2 1 1 1 766 1 1 47 ASN HB3 H 7.201 8.409 -13.095 1.00 . A A . 81 ASN HB3 1 1 1 767 1 1 47 ASN HD21 H 9.657 9.676 -15.094 1.00 . A A . 81 ASN HD21 1 1 1 768 1 1 47 ASN HD22 H 8.714 11.086 -15.427 1.00 . A A . 81 ASN HD22 1 1 1 769 1 1 47 ASN N N 10.146 8.688 -11.576 1.00 . A A . 81 ASN N 1 1 1 770 1 1 47 ASN ND2 N 8.791 10.195 -14.979 1.00 . A A . 81 ASN ND2 1 1 1 771 1 1 47 ASN O O 8.115 6.714 -10.909 1.00 . A A . 81 ASN O 1 1 1 772 1 1 47 ASN OD1 O 7.272 10.894 -13.578 1.00 . A A . 81 ASN OD1 1 1 1 773 1 1 48 GLN C C 5.199 6.661 -9.692 1.00 . A A . 82 GLN C 1 1 1 774 1 1 48 GLN CA C 6.198 7.648 -9.053 1.00 . A A . 82 GLN CA 1 1 1 775 1 1 48 GLN CB C 5.544 8.614 -8.047 1.00 . A A . 82 GLN CB 1 1 1 776 1 1 48 GLN CD C 4.128 10.742 -7.851 1.00 . A A . 82 GLN CD 1 1 1 777 1 1 48 GLN CG C 4.441 9.494 -8.661 1.00 . A A . 82 GLN CG 1 1 1 778 1 1 48 GLN H H 6.884 9.440 -9.971 1.00 . A A . 82 GLN H 1 1 1 779 1 1 48 GLN HA H 6.910 7.042 -8.488 1.00 . A A . 82 GLN HA 1 1 1 780 1 1 48 GLN HB2 H 5.117 8.041 -7.224 1.00 . A A . 82 GLN HB2 1 1 1 781 1 1 48 GLN HB3 H 6.328 9.251 -7.634 1.00 . A A . 82 GLN HB3 1 1 1 782 1 1 48 GLN HE21 H 2.145 10.367 -7.845 1.00 . A A . 82 GLN HE21 1 1 1 783 1 1 48 GLN HE22 H 2.705 11.863 -7.076 1.00 . A A . 82 GLN HE22 1 1 1 784 1 1 48 GLN HG2 H 4.718 9.821 -9.663 1.00 . A A . 82 GLN HG2 1 1 1 785 1 1 48 GLN HG3 H 3.540 8.891 -8.724 1.00 . A A . 82 GLN HG3 1 1 1 786 1 1 48 GLN N N 6.964 8.434 -10.020 1.00 . A A . 82 GLN N 1 1 1 787 1 1 48 GLN NE2 N 2.872 11.012 -7.582 1.00 . A A . 82 GLN NE2 1 1 1 788 1 1 48 GLN O O 5.324 5.469 -9.459 1.00 . A A . 82 GLN O 1 1 1 789 1 1 48 GLN OE1 O 4.988 11.547 -7.551 1.00 . A A . 82 GLN OE1 1 1 1 790 1 1 49 ASN C C 3.362 4.860 -11.410 1.00 . A A . 83 ASN C 1 1 1 791 1 1 49 ASN CA C 3.074 6.292 -10.900 1.00 . A A . 83 ASN CA 1 1 1 792 1 1 49 ASN CB C 2.214 7.072 -11.918 1.00 . A A . 83 ASN CB 1 1 1 793 1 1 49 ASN CG C 1.735 8.429 -11.418 1.00 . A A . 83 ASN CG 1 1 1 794 1 1 49 ASN H H 4.226 8.080 -10.724 1.00 . A A . 83 ASN H 1 1 1 795 1 1 49 ASN HA H 2.485 6.179 -9.986 1.00 . A A . 83 ASN HA 1 1 1 796 1 1 49 ASN HB2 H 2.780 7.210 -12.839 1.00 . A A . 83 ASN HB2 1 1 1 797 1 1 49 ASN HB3 H 1.326 6.485 -12.155 1.00 . A A . 83 ASN HB3 1 1 1 798 1 1 49 ASN HD21 H 1.750 9.250 -13.268 1.00 . A A . 83 ASN HD21 1 1 1 799 1 1 49 ASN HD22 H 1.382 10.304 -11.906 1.00 . A A . 83 ASN HD22 1 1 1 800 1 1 49 ASN N N 4.283 7.084 -10.576 1.00 . A A . 83 ASN N 1 1 1 801 1 1 49 ASN ND2 N 1.646 9.409 -12.284 1.00 . A A . 83 ASN ND2 1 1 1 802 1 1 49 ASN O O 2.755 3.893 -10.953 1.00 . A A . 83 ASN O 1 1 1 803 1 1 49 ASN OD1 O 1.639 8.691 -10.235 1.00 . A A . 83 ASN OD1 1 1 1 804 1 1 50 ASN C C 5.455 2.494 -11.786 1.00 . A A . 84 ASN C 1 1 1 805 1 1 50 ASN CA C 4.785 3.411 -12.828 1.00 . A A . 84 ASN CA 1 1 1 806 1 1 50 ASN CB C 5.723 3.687 -14.016 1.00 . A A . 84 ASN CB 1 1 1 807 1 1 50 ASN CG C 4.997 4.408 -15.136 1.00 . A A . 84 ASN CG 1 1 1 808 1 1 50 ASN H H 4.867 5.534 -12.555 1.00 . A A . 84 ASN H 1 1 1 809 1 1 50 ASN HA H 3.901 2.885 -13.196 1.00 . A A . 84 ASN HA 1 1 1 810 1 1 50 ASN HB2 H 6.583 4.271 -13.689 1.00 . A A . 84 ASN HB2 1 1 1 811 1 1 50 ASN HB3 H 6.086 2.739 -14.414 1.00 . A A . 84 ASN HB3 1 1 1 812 1 1 50 ASN HD21 H 6.121 6.086 -14.973 1.00 . A A . 84 ASN HD21 1 1 1 813 1 1 50 ASN HD22 H 4.790 6.095 -16.125 1.00 . A A . 84 ASN HD22 1 1 1 814 1 1 50 ASN N N 4.375 4.705 -12.268 1.00 . A A . 84 ASN N 1 1 1 815 1 1 50 ASN ND2 N 5.311 5.660 -15.383 1.00 . A A . 84 ASN ND2 1 1 1 816 1 1 50 ASN O O 5.006 1.370 -11.568 1.00 . A A . 84 ASN O 1 1 1 817 1 1 50 ASN OD1 O 4.027 3.920 -15.682 1.00 . A A . 84 ASN OD1 1 1 1 818 1 1 51 PHE C C 6.010 1.970 -8.817 1.00 . A A . 85 PHE C 1 1 1 819 1 1 51 PHE CA C 7.041 2.388 -9.874 1.00 . A A . 85 PHE CA 1 1 1 820 1 1 51 PHE CB C 8.026 3.412 -9.293 1.00 . A A . 85 PHE CB 1 1 1 821 1 1 51 PHE CD1 C 8.015 3.099 -6.762 1.00 . A A . 85 PHE CD1 1 1 1 822 1 1 51 PHE CD2 C 10.082 2.775 -8.005 1.00 . A A . 85 PHE CD2 1 1 1 823 1 1 51 PHE CE1 C 8.704 2.910 -5.552 1.00 . A A . 85 PHE CE1 1 1 1 824 1 1 51 PHE CE2 C 10.773 2.622 -6.799 1.00 . A A . 85 PHE CE2 1 1 1 825 1 1 51 PHE CG C 8.706 3.043 -7.993 1.00 . A A . 85 PHE CG 1 1 1 826 1 1 51 PHE CZ C 10.093 2.708 -5.574 1.00 . A A . 85 PHE CZ 1 1 1 827 1 1 51 PHE H H 6.641 4.009 -11.180 1.00 . A A . 85 PHE H 1 1 1 828 1 1 51 PHE HA H 7.586 1.499 -10.193 1.00 . A A . 85 PHE HA 1 1 1 829 1 1 51 PHE HB2 H 8.787 3.617 -10.046 1.00 . A A . 85 PHE HB2 1 1 1 830 1 1 51 PHE HB3 H 7.511 4.355 -9.117 1.00 . A A . 85 PHE HB3 1 1 1 831 1 1 51 PHE HD1 H 6.968 3.349 -6.729 1.00 . A A . 85 PHE HD1 1 1 1 832 1 1 51 PHE HD2 H 10.622 2.734 -8.937 1.00 . A A . 85 PHE HD2 1 1 1 833 1 1 51 PHE HE1 H 8.184 2.982 -4.607 1.00 . A A . 85 PHE HE1 1 1 1 834 1 1 51 PHE HE2 H 11.836 2.442 -6.813 1.00 . A A . 85 PHE HE2 1 1 1 835 1 1 51 PHE HZ H 10.644 2.606 -4.647 1.00 . A A . 85 PHE HZ 1 1 1 836 1 1 51 PHE N N 6.411 3.037 -11.028 1.00 . A A . 85 PHE N 1 1 1 837 1 1 51 PHE O O 6.040 0.862 -8.282 1.00 . A A . 85 PHE O 1 1 1 838 1 1 52 VAL C C 3.032 1.636 -7.914 1.00 . A A . 86 VAL C 1 1 1 839 1 1 52 VAL CA C 4.028 2.718 -7.521 1.00 . A A . 86 VAL CA 1 1 1 840 1 1 52 VAL CB C 3.345 4.071 -7.272 1.00 . A A . 86 VAL CB 1 1 1 841 1 1 52 VAL CG1 C 2.040 3.929 -6.489 1.00 . A A . 86 VAL CG1 1 1 1 842 1 1 52 VAL CG2 C 4.302 4.980 -6.488 1.00 . A A . 86 VAL CG2 1 1 1 843 1 1 52 VAL H H 5.136 3.766 -9.003 1.00 . A A . 86 VAL H 1 1 1 844 1 1 52 VAL HA H 4.491 2.400 -6.589 1.00 . A A . 86 VAL HA 1 1 1 845 1 1 52 VAL HB H 3.112 4.544 -8.225 1.00 . A A . 86 VAL HB 1 1 1 846 1 1 52 VAL HG11 H 1.238 3.632 -7.167 1.00 . A A . 86 VAL HG11 1 1 1 847 1 1 52 VAL HG12 H 1.771 4.885 -6.042 1.00 . A A . 86 VAL HG12 1 1 1 848 1 1 52 VAL HG13 H 2.133 3.174 -5.715 1.00 . A A . 86 VAL HG13 1 1 1 849 1 1 52 VAL HG21 H 4.441 4.603 -5.480 1.00 . A A . 86 VAL HG21 1 1 1 850 1 1 52 VAL HG22 H 3.889 5.986 -6.448 1.00 . A A . 86 VAL HG22 1 1 1 851 1 1 52 VAL HG23 H 5.275 5.037 -6.972 1.00 . A A . 86 VAL HG23 1 1 1 852 1 1 52 VAL N N 5.073 2.870 -8.530 1.00 . A A . 86 VAL N 1 1 1 853 1 1 52 VAL O O 2.726 0.803 -7.064 1.00 . A A . 86 VAL O 1 1 1 854 1 1 53 HIS C C 2.655 -1.005 -9.444 1.00 . A A . 87 HIS C 1 1 1 855 1 1 53 HIS CA C 1.982 0.342 -9.736 1.00 . A A . 87 HIS CA 1 1 1 856 1 1 53 HIS CB C 1.738 0.528 -11.238 1.00 . A A . 87 HIS CB 1 1 1 857 1 1 53 HIS CD2 C -0.573 -0.552 -11.395 1.00 . A A . 87 HIS CD2 1 1 1 858 1 1 53 HIS CE1 C -0.172 -2.119 -12.913 1.00 . A A . 87 HIS CE1 1 1 1 859 1 1 53 HIS CG C 0.738 -0.464 -11.772 1.00 . A A . 87 HIS CG 1 1 1 860 1 1 53 HIS H H 3.041 2.205 -9.859 1.00 . A A . 87 HIS H 1 1 1 861 1 1 53 HIS HA H 1.015 0.333 -9.236 1.00 . A A . 87 HIS HA 1 1 1 862 1 1 53 HIS HB2 H 1.356 1.535 -11.421 1.00 . A A . 87 HIS HB2 1 1 1 863 1 1 53 HIS HB3 H 2.677 0.420 -11.781 1.00 . A A . 87 HIS HB3 1 1 1 864 1 1 53 HIS HD1 H 1.892 -1.635 -13.133 1.00 . A A . 87 HIS HD1 1 1 1 865 1 1 53 HIS HD2 H -1.077 0.078 -10.665 1.00 . A A . 87 HIS HD2 1 1 1 866 1 1 53 HIS HE1 H -0.316 -2.932 -13.620 1.00 . A A . 87 HIS HE1 1 1 1 867 1 1 53 HIS HE2 H -2.097 -1.903 -12.029 1.00 . A A . 87 HIS HE2 1 1 1 868 1 1 53 HIS N N 2.742 1.480 -9.212 1.00 . A A . 87 HIS N 1 1 1 869 1 1 53 HIS ND1 N 0.987 -1.454 -12.704 1.00 . A A . 87 HIS ND1 1 1 1 870 1 1 53 HIS NE2 N -1.129 -1.595 -12.112 1.00 . A A . 87 HIS NE2 1 1 1 871 1 1 53 HIS O O 2.006 -1.910 -8.923 1.00 . A A . 87 HIS O 1 1 1 872 1 1 54 ASP C C 4.758 -2.522 -7.747 1.00 . A A . 88 ASP C 1 1 1 873 1 1 54 ASP CA C 4.714 -2.325 -9.270 1.00 . A A . 88 ASP CA 1 1 1 874 1 1 54 ASP CB C 6.137 -2.292 -9.850 1.00 . A A . 88 ASP CB 1 1 1 875 1 1 54 ASP CG C 6.226 -2.852 -11.276 1.00 . A A . 88 ASP CG 1 1 1 876 1 1 54 ASP H H 4.465 -0.356 -10.095 1.00 . A A . 88 ASP H 1 1 1 877 1 1 54 ASP HA H 4.209 -3.201 -9.677 1.00 . A A . 88 ASP HA 1 1 1 878 1 1 54 ASP HB2 H 6.542 -1.280 -9.815 1.00 . A A . 88 ASP HB2 1 1 1 879 1 1 54 ASP HB3 H 6.769 -2.919 -9.219 1.00 . A A . 88 ASP HB3 1 1 1 880 1 1 54 ASP N N 3.965 -1.121 -9.657 1.00 . A A . 88 ASP N 1 1 1 881 1 1 54 ASP O O 4.572 -3.641 -7.270 1.00 . A A . 88 ASP O 1 1 1 882 1 1 54 ASP OD1 O 5.159 -2.922 -11.935 1.00 . A A . 88 ASP OD1 1 1 1 883 1 1 54 ASP OD2 O 7.237 -3.565 -11.484 1.00 . A A . 88 ASP OD2 1 1 1 884 1 1 55 CYS C C 3.617 -1.947 -4.863 1.00 . A A . 89 CYS C 1 1 1 885 1 1 55 CYS CA C 4.923 -1.451 -5.520 1.00 . A A . 89 CYS CA 1 1 1 886 1 1 55 CYS CB C 5.284 -0.037 -5.048 1.00 . A A . 89 CYS CB 1 1 1 887 1 1 55 CYS H H 5.036 -0.550 -7.454 1.00 . A A . 89 CYS H 1 1 1 888 1 1 55 CYS HA H 5.718 -2.131 -5.228 1.00 . A A . 89 CYS HA 1 1 1 889 1 1 55 CYS HB2 H 6.188 0.308 -5.555 1.00 . A A . 89 CYS HB2 1 1 1 890 1 1 55 CYS HB3 H 4.468 0.645 -5.281 1.00 . A A . 89 CYS HB3 1 1 1 891 1 1 55 CYS HG H 5.382 -1.364 -3.100 1.00 . A A . 89 CYS HG 1 1 1 892 1 1 55 CYS N N 4.874 -1.434 -6.981 1.00 . A A . 89 CYS N 1 1 1 893 1 1 55 CYS O O 3.646 -2.830 -3.996 1.00 . A A . 89 CYS O 1 1 1 894 1 1 55 CYS SG S 5.555 -0.042 -3.257 1.00 . A A . 89 CYS SG 1 1 1 895 1 1 56 VAL C C 0.906 -3.352 -5.289 1.00 . A A . 90 VAL C 1 1 1 896 1 1 56 VAL CA C 1.144 -1.906 -4.856 1.00 . A A . 90 VAL CA 1 1 1 897 1 1 56 VAL CB C -0.002 -0.953 -5.277 1.00 . A A . 90 VAL CB 1 1 1 898 1 1 56 VAL CG1 C -0.217 -0.824 -6.785 1.00 . A A . 90 VAL CG1 1 1 1 899 1 1 56 VAL CG2 C -1.357 -1.366 -4.702 1.00 . A A . 90 VAL CG2 1 1 1 900 1 1 56 VAL H H 2.503 -0.718 -6.031 1.00 . A A . 90 VAL H 1 1 1 901 1 1 56 VAL HA H 1.164 -1.916 -3.769 1.00 . A A . 90 VAL HA 1 1 1 902 1 1 56 VAL HB H 0.239 0.037 -4.887 1.00 . A A . 90 VAL HB 1 1 1 903 1 1 56 VAL HG11 H -0.548 -1.767 -7.220 1.00 . A A . 90 VAL HG11 1 1 1 904 1 1 56 VAL HG12 H 0.704 -0.516 -7.256 1.00 . A A . 90 VAL HG12 1 1 1 905 1 1 56 VAL HG13 H -0.974 -0.062 -6.981 1.00 . A A . 90 VAL HG13 1 1 1 906 1 1 56 VAL HG21 H -1.737 -2.234 -5.236 1.00 . A A . 90 VAL HG21 1 1 1 907 1 1 56 VAL HG22 H -2.065 -0.545 -4.826 1.00 . A A . 90 VAL HG22 1 1 1 908 1 1 56 VAL HG23 H -1.283 -1.604 -3.647 1.00 . A A . 90 VAL HG23 1 1 1 909 1 1 56 VAL N N 2.463 -1.427 -5.303 1.00 . A A . 90 VAL N 1 1 1 910 1 1 56 VAL O O 0.629 -4.192 -4.430 1.00 . A A . 90 VAL O 1 1 1 911 1 1 57 ASN C C 1.975 -6.091 -6.164 1.00 . A A . 91 ASN C 1 1 1 912 1 1 57 ASN CA C 1.217 -5.072 -7.027 1.00 . A A . 91 ASN CA 1 1 1 913 1 1 57 ASN CB C 1.720 -5.135 -8.481 1.00 . A A . 91 ASN CB 1 1 1 914 1 1 57 ASN CG C 0.771 -4.546 -9.505 1.00 . A A . 91 ASN CG 1 1 1 915 1 1 57 ASN H H 1.595 -2.973 -7.157 1.00 . A A . 91 ASN H 1 1 1 916 1 1 57 ASN HA H 0.165 -5.368 -7.008 1.00 . A A . 91 ASN HA 1 1 1 917 1 1 57 ASN HB2 H 2.675 -4.625 -8.560 1.00 . A A . 91 ASN HB2 1 1 1 918 1 1 57 ASN HB3 H 1.873 -6.177 -8.757 1.00 . A A . 91 ASN HB3 1 1 1 919 1 1 57 ASN HD21 H 2.218 -4.449 -10.901 1.00 . A A . 91 ASN HD21 1 1 1 920 1 1 57 ASN HD22 H 0.566 -4.033 -11.371 1.00 . A A . 91 ASN HD22 1 1 1 921 1 1 57 ASN N N 1.314 -3.707 -6.514 1.00 . A A . 91 ASN N 1 1 1 922 1 1 57 ASN ND2 N 1.227 -4.412 -10.728 1.00 . A A . 91 ASN ND2 1 1 1 923 1 1 57 ASN O O 1.385 -7.103 -5.786 1.00 . A A . 91 ASN O 1 1 1 924 1 1 57 ASN OD1 O -0.424 -4.435 -9.315 1.00 . A A . 91 ASN OD1 1 1 1 925 1 1 58 ILE C C 3.552 -7.013 -3.640 1.00 . A A . 92 ILE C 1 1 1 926 1 1 58 ILE CA C 4.034 -6.881 -5.093 1.00 . A A . 92 ILE CA 1 1 1 927 1 1 58 ILE CB C 5.567 -6.673 -5.204 1.00 . A A . 92 ILE CB 1 1 1 928 1 1 58 ILE CD1 C 6.129 -9.187 -4.943 1.00 . A A . 92 ILE CD1 1 1 1 929 1 1 58 ILE CG1 C 6.394 -7.754 -4.466 1.00 . A A . 92 ILE CG1 1 1 1 930 1 1 58 ILE CG2 C 6.023 -5.303 -4.695 1.00 . A A . 92 ILE CG2 1 1 1 931 1 1 58 ILE H H 3.723 -5.035 -6.193 1.00 . A A . 92 ILE H 1 1 1 932 1 1 58 ILE HA H 3.823 -7.841 -5.560 1.00 . A A . 92 ILE HA 1 1 1 933 1 1 58 ILE HB H 5.835 -6.730 -6.260 1.00 . A A . 92 ILE HB 1 1 1 934 1 1 58 ILE HD11 H 6.264 -9.249 -6.023 1.00 . A A . 92 ILE HD11 1 1 1 935 1 1 58 ILE HD12 H 5.115 -9.493 -4.689 1.00 . A A . 92 ILE HD12 1 1 1 936 1 1 58 ILE HD13 H 6.830 -9.863 -4.455 1.00 . A A . 92 ILE HD13 1 1 1 937 1 1 58 ILE HG12 H 7.453 -7.550 -4.629 1.00 . A A . 92 ILE HG12 1 1 1 938 1 1 58 ILE HG13 H 6.208 -7.695 -3.392 1.00 . A A . 92 ILE HG13 1 1 1 939 1 1 58 ILE HG21 H 5.824 -4.541 -5.439 1.00 . A A . 92 ILE HG21 1 1 1 940 1 1 58 ILE HG22 H 7.094 -5.292 -4.501 1.00 . A A . 92 ILE HG22 1 1 1 941 1 1 58 ILE HG23 H 5.498 -5.028 -3.786 1.00 . A A . 92 ILE HG23 1 1 1 942 1 1 58 ILE N N 3.264 -5.880 -5.854 1.00 . A A . 92 ILE N 1 1 1 943 1 1 58 ILE O O 3.425 -8.145 -3.159 1.00 . A A . 92 ILE O 1 1 1 944 1 1 59 THR C C 1.268 -6.675 -1.546 1.00 . A A . 93 THR C 1 1 1 945 1 1 59 THR CA C 2.645 -6.026 -1.596 1.00 . A A . 93 THR CA 1 1 1 946 1 1 59 THR CB C 2.658 -4.699 -0.819 1.00 . A A . 93 THR CB 1 1 1 947 1 1 59 THR CG2 C 1.354 -3.907 -0.778 1.00 . A A . 93 THR CG2 1 1 1 948 1 1 59 THR H H 3.211 -5.007 -3.427 1.00 . A A . 93 THR H 1 1 1 949 1 1 59 THR HA H 3.322 -6.697 -1.067 1.00 . A A . 93 THR HA 1 1 1 950 1 1 59 THR HB H 3.448 -4.059 -1.213 1.00 . A A . 93 THR HB 1 1 1 951 1 1 59 THR HG1 H 2.637 -4.273 1.074 1.00 . A A . 93 THR HG1 1 1 1 952 1 1 59 THR HG21 H 1.516 -2.954 -0.277 1.00 . A A . 93 THR HG21 1 1 1 953 1 1 59 THR HG22 H 0.583 -4.452 -0.231 1.00 . A A . 93 THR HG22 1 1 1 954 1 1 59 THR HG23 H 1.016 -3.715 -1.795 1.00 . A A . 93 THR HG23 1 1 1 955 1 1 59 THR N N 3.154 -5.916 -2.974 1.00 . A A . 93 THR N 1 1 1 956 1 1 59 THR O O 1.079 -7.614 -0.773 1.00 . A A . 93 THR O 1 1 1 957 1 1 59 THR OG1 O 2.950 -5.015 0.520 1.00 . A A . 93 THR OG1 1 1 1 958 1 1 60 ILE C C -0.815 -8.406 -2.896 1.00 . A A . 94 ILE C 1 1 1 959 1 1 60 ILE CA C -0.972 -6.929 -2.538 1.00 . A A . 94 ILE CA 1 1 1 960 1 1 60 ILE CB C -1.908 -6.159 -3.505 1.00 . A A . 94 ILE CB 1 1 1 961 1 1 60 ILE CD1 C -3.330 -3.981 -3.631 1.00 . A A . 94 ILE CD1 1 1 1 962 1 1 60 ILE CG1 C -2.270 -4.791 -2.871 1.00 . A A . 94 ILE CG1 1 1 1 963 1 1 60 ILE CG2 C -3.182 -6.968 -3.820 1.00 . A A . 94 ILE CG2 1 1 1 964 1 1 60 ILE H H 0.572 -5.555 -3.105 1.00 . A A . 94 ILE H 1 1 1 965 1 1 60 ILE HA H -1.428 -6.899 -1.548 1.00 . A A . 94 ILE HA 1 1 1 966 1 1 60 ILE HB H -1.383 -5.989 -4.447 1.00 . A A . 94 ILE HB 1 1 1 967 1 1 60 ILE HD11 H -3.081 -3.945 -4.691 1.00 . A A . 94 ILE HD11 1 1 1 968 1 1 60 ILE HD12 H -3.370 -2.968 -3.231 1.00 . A A . 94 ILE HD12 1 1 1 969 1 1 60 ILE HD13 H -4.314 -4.432 -3.512 1.00 . A A . 94 ILE HD13 1 1 1 970 1 1 60 ILE HG12 H -2.632 -4.944 -1.855 1.00 . A A . 94 ILE HG12 1 1 1 971 1 1 60 ILE HG13 H -1.370 -4.181 -2.804 1.00 . A A . 94 ILE HG13 1 1 1 972 1 1 60 ILE HG21 H -3.789 -6.440 -4.558 1.00 . A A . 94 ILE HG21 1 1 1 973 1 1 60 ILE HG22 H -3.773 -7.107 -2.918 1.00 . A A . 94 ILE HG22 1 1 1 974 1 1 60 ILE HG23 H -2.945 -7.938 -4.254 1.00 . A A . 94 ILE HG23 1 1 1 975 1 1 60 ILE N N 0.351 -6.304 -2.451 1.00 . A A . 94 ILE N 1 1 1 976 1 1 60 ILE O O -1.270 -9.246 -2.124 1.00 . A A . 94 ILE O 1 1 1 977 1 1 61 LYS C C 0.729 -11.048 -3.161 1.00 . A A . 95 LYS C 1 1 1 978 1 1 61 LYS CA C 0.247 -10.151 -4.297 1.00 . A A . 95 LYS CA 1 1 1 979 1 1 61 LYS CB C 1.248 -10.182 -5.461 1.00 . A A . 95 LYS CB 1 1 1 980 1 1 61 LYS CD C 0.194 -12.180 -6.627 1.00 . A A . 95 LYS CD 1 1 1 981 1 1 61 LYS CE C 0.448 -13.316 -7.625 1.00 . A A . 95 LYS CE 1 1 1 982 1 1 61 LYS CG C 1.488 -11.582 -6.047 1.00 . A A . 95 LYS CG 1 1 1 983 1 1 61 LYS H H 0.430 -8.012 -4.445 1.00 . A A . 95 LYS H 1 1 1 984 1 1 61 LYS HA H -0.711 -10.559 -4.624 1.00 . A A . 95 LYS HA 1 1 1 985 1 1 61 LYS HB2 H 0.878 -9.541 -6.261 1.00 . A A . 95 LYS HB2 1 1 1 986 1 1 61 LYS HB3 H 2.204 -9.778 -5.121 1.00 . A A . 95 LYS HB3 1 1 1 987 1 1 61 LYS HD2 H -0.412 -12.570 -5.805 1.00 . A A . 95 LYS HD2 1 1 1 988 1 1 61 LYS HD3 H -0.384 -11.398 -7.123 1.00 . A A . 95 LYS HD3 1 1 1 989 1 1 61 LYS HE2 H 1.018 -14.107 -7.128 1.00 . A A . 95 LYS HE2 1 1 1 990 1 1 61 LYS HE3 H -0.523 -13.735 -7.910 1.00 . A A . 95 LYS HE3 1 1 1 991 1 1 61 LYS HG2 H 2.240 -11.482 -6.829 1.00 . A A . 95 LYS HG2 1 1 1 992 1 1 61 LYS HG3 H 1.889 -12.251 -5.284 1.00 . A A . 95 LYS HG3 1 1 1 993 1 1 61 LYS HZ1 H 1.207 -13.560 -9.539 1.00 . A A . 95 LYS HZ1 1 1 1 994 1 1 61 LYS HZ2 H 2.098 -12.542 -8.601 1.00 . A A . 95 LYS HZ2 1 1 1 995 1 1 61 LYS HZ3 H 0.671 -12.038 -9.234 1.00 . A A . 95 LYS HZ3 1 1 1 996 1 1 61 LYS N N 0.018 -8.756 -3.885 1.00 . A A . 95 LYS N 1 1 1 997 1 1 61 LYS NZ N 1.158 -12.833 -8.837 1.00 . A A . 95 LYS NZ 1 1 1 998 1 1 61 LYS O O 0.193 -12.136 -2.991 1.00 . A A . 95 LYS O 1 1 1 999 1 1 62 GLN C C 1.372 -11.441 -0.137 1.00 . A A . 96 GLN C 1 1 1 1000 1 1 62 GLN CA C 2.312 -11.455 -1.346 1.00 . A A . 96 GLN CA 1 1 1 1001 1 1 62 GLN CB C 3.711 -10.944 -0.961 1.00 . A A . 96 GLN CB 1 1 1 1002 1 1 62 GLN CD C 5.129 -12.809 -2.026 1.00 . A A . 96 GLN CD 1 1 1 1003 1 1 62 GLN CG C 4.779 -11.320 -2.004 1.00 . A A . 96 GLN CG 1 1 1 1004 1 1 62 GLN H H 2.191 -9.741 -2.647 1.00 . A A . 96 GLN H 1 1 1 1005 1 1 62 GLN HA H 2.390 -12.497 -1.663 1.00 . A A . 96 GLN HA 1 1 1 1006 1 1 62 GLN HB2 H 3.682 -9.858 -0.856 1.00 . A A . 96 GLN HB2 1 1 1 1007 1 1 62 GLN HB3 H 4.000 -11.364 0.004 1.00 . A A . 96 GLN HB3 1 1 1 1008 1 1 62 GLN HE21 H 6.251 -12.655 -3.698 1.00 . A A . 96 GLN HE21 1 1 1 1009 1 1 62 GLN HE22 H 6.074 -14.254 -2.948 1.00 . A A . 96 GLN HE22 1 1 1 1010 1 1 62 GLN HG2 H 4.436 -11.026 -2.995 1.00 . A A . 96 GLN HG2 1 1 1 1011 1 1 62 GLN HG3 H 5.690 -10.763 -1.787 1.00 . A A . 96 GLN HG3 1 1 1 1012 1 1 62 GLN N N 1.777 -10.645 -2.443 1.00 . A A . 96 GLN N 1 1 1 1013 1 1 62 GLN NE2 N 5.914 -13.261 -2.978 1.00 . A A . 96 GLN NE2 1 1 1 1014 1 1 62 GLN O O 0.979 -12.492 0.360 1.00 . A A . 96 GLN O 1 1 1 1015 1 1 62 GLN OE1 O 4.709 -13.608 -1.213 1.00 . A A . 96 GLN OE1 1 1 1 1016 1 1 63 HIS C C -1.276 -10.599 1.463 1.00 . A A . 97 HIS C 1 1 1 1017 1 1 63 HIS CA C 0.178 -10.110 1.540 1.00 . A A . 97 HIS CA 1 1 1 1018 1 1 63 HIS CB C 0.295 -8.650 2.002 1.00 . A A . 97 HIS CB 1 1 1 1019 1 1 63 HIS CD2 C -0.579 -8.986 4.422 1.00 . A A . 97 HIS CD2 1 1 1 1020 1 1 63 HIS CE1 C 0.817 -7.652 5.498 1.00 . A A . 97 HIS CE1 1 1 1 1021 1 1 63 HIS CG C 0.273 -8.434 3.501 1.00 . A A . 97 HIS CG 1 1 1 1022 1 1 63 HIS H H 1.158 -9.424 -0.239 1.00 . A A . 97 HIS H 1 1 1 1023 1 1 63 HIS HA H 0.679 -10.740 2.278 1.00 . A A . 97 HIS HA 1 1 1 1024 1 1 63 HIS HB2 H 1.251 -8.255 1.654 1.00 . A A . 97 HIS HB2 1 1 1 1025 1 1 63 HIS HB3 H -0.481 -8.061 1.514 1.00 . A A . 97 HIS HB3 1 1 1 1026 1 1 63 HIS HD1 H 1.908 -7.086 3.776 1.00 . A A . 97 HIS HD1 1 1 1 1027 1 1 63 HIS HD2 H -1.385 -9.682 4.230 1.00 . A A . 97 HIS HD2 1 1 1 1028 1 1 63 HIS HE1 H 1.355 -7.155 6.299 1.00 . A A . 97 HIS HE1 1 1 1 1029 1 1 63 HIS HE2 H -0.664 -8.742 6.543 1.00 . A A . 97 HIS HE2 1 1 1 1030 1 1 63 HIS N N 0.904 -10.261 0.278 1.00 . A A . 97 HIS N 1 1 1 1031 1 1 63 HIS ND1 N 1.132 -7.595 4.188 1.00 . A A . 97 HIS ND1 1 1 1 1032 1 1 63 HIS NE2 N -0.226 -8.489 5.661 1.00 . A A . 97 HIS NE2 1 1 1 1033 1 1 63 HIS O O -1.769 -11.102 2.469 1.00 . A A . 97 HIS O 1 1 1 1034 1 1 64 THR C C -3.108 -12.734 0.271 1.00 . A A . 98 THR C 1 1 1 1035 1 1 64 THR CA C -3.241 -11.223 0.105 1.00 . A A . 98 THR CA 1 1 1 1036 1 1 64 THR CB C -3.916 -10.920 -1.240 1.00 . A A . 98 THR CB 1 1 1 1037 1 1 64 THR CG2 C -4.399 -9.472 -1.309 1.00 . A A . 98 THR CG2 1 1 1 1038 1 1 64 THR H H -1.484 -10.139 -0.504 1.00 . A A . 98 THR H 1 1 1 1039 1 1 64 THR HA H -3.931 -10.881 0.873 1.00 . A A . 98 THR HA 1 1 1 1040 1 1 64 THR HB H -4.783 -11.569 -1.349 1.00 . A A . 98 THR HB 1 1 1 1041 1 1 64 THR HG1 H -2.418 -10.420 -2.343 1.00 . A A . 98 THR HG1 1 1 1 1042 1 1 64 THR HG21 H -3.582 -8.776 -1.123 1.00 . A A . 98 THR HG21 1 1 1 1043 1 1 64 THR HG22 H -5.175 -9.313 -0.560 1.00 . A A . 98 THR HG22 1 1 1 1044 1 1 64 THR HG23 H -4.828 -9.280 -2.293 1.00 . A A . 98 THR HG23 1 1 1 1045 1 1 64 THR N N -1.940 -10.546 0.303 1.00 . A A . 98 THR N 1 1 1 1046 1 1 64 THR O O -3.700 -13.263 1.201 1.00 . A A . 98 THR O 1 1 1 1047 1 1 64 THR OG1 O -3.035 -11.172 -2.306 1.00 . A A . 98 THR OG1 1 1 1 1048 1 1 65 VAL C C -1.459 -15.078 1.354 1.00 . A A . 99 VAL C 1 1 1 1049 1 1 65 VAL CA C -1.769 -14.778 -0.123 1.00 . A A . 99 VAL CA 1 1 1 1050 1 1 65 VAL CB C -0.624 -15.236 -1.051 1.00 . A A . 99 VAL CB 1 1 1 1051 1 1 65 VAL CG1 C -0.211 -16.691 -0.799 1.00 . A A . 99 VAL CG1 1 1 1 1052 1 1 65 VAL CG2 C -1.031 -15.137 -2.529 1.00 . A A . 99 VAL CG2 1 1 1 1053 1 1 65 VAL H H -1.593 -12.851 -1.066 1.00 . A A . 99 VAL H 1 1 1 1054 1 1 65 VAL HA H -2.652 -15.365 -0.376 1.00 . A A . 99 VAL HA 1 1 1 1055 1 1 65 VAL HB H 0.246 -14.602 -0.891 1.00 . A A . 99 VAL HB 1 1 1 1056 1 1 65 VAL HG11 H 0.556 -16.987 -1.514 1.00 . A A . 99 VAL HG11 1 1 1 1057 1 1 65 VAL HG12 H -1.075 -17.349 -0.905 1.00 . A A . 99 VAL HG12 1 1 1 1058 1 1 65 VAL HG13 H 0.200 -16.801 0.204 1.00 . A A . 99 VAL HG13 1 1 1 1059 1 1 65 VAL HG21 H -0.163 -15.330 -3.158 1.00 . A A . 99 VAL HG21 1 1 1 1060 1 1 65 VAL HG22 H -1.403 -14.140 -2.761 1.00 . A A . 99 VAL HG22 1 1 1 1061 1 1 65 VAL HG23 H -1.813 -15.861 -2.755 1.00 . A A . 99 VAL HG23 1 1 1 1062 1 1 65 VAL N N -2.094 -13.355 -0.344 1.00 . A A . 99 VAL N 1 1 1 1063 1 1 65 VAL O O -2.092 -15.962 1.924 1.00 . A A . 99 VAL O 1 1 1 1064 1 1 66 THR C C -1.565 -14.293 4.376 1.00 . A A . 100 THR C 1 1 1 1065 1 1 66 THR CA C -0.334 -14.377 3.466 1.00 . A A . 100 THR CA 1 1 1 1066 1 1 66 THR CB C 0.643 -13.272 3.917 1.00 . A A . 100 THR CB 1 1 1 1067 1 1 66 THR CG2 C 1.148 -13.406 5.355 1.00 . A A . 100 THR CG2 1 1 1 1068 1 1 66 THR H H -0.127 -13.560 1.487 1.00 . A A . 100 THR H 1 1 1 1069 1 1 66 THR HA H 0.123 -15.350 3.642 1.00 . A A . 100 THR HA 1 1 1 1070 1 1 66 THR HB H 0.145 -12.308 3.824 1.00 . A A . 100 THR HB 1 1 1 1071 1 1 66 THR HG1 H 2.173 -14.123 3.091 1.00 . A A . 100 THR HG1 1 1 1 1072 1 1 66 THR HG21 H 0.330 -13.244 6.056 1.00 . A A . 100 THR HG21 1 1 1 1073 1 1 66 THR HG22 H 1.913 -12.654 5.546 1.00 . A A . 100 THR HG22 1 1 1 1074 1 1 66 THR HG23 H 1.566 -14.400 5.515 1.00 . A A . 100 THR HG23 1 1 1 1075 1 1 66 THR N N -0.642 -14.252 2.024 1.00 . A A . 100 THR N 1 1 1 1076 1 1 66 THR O O -1.557 -14.876 5.458 1.00 . A A . 100 THR O 1 1 1 1077 1 1 66 THR OG1 O 1.800 -13.238 3.119 1.00 . A A . 100 THR OG1 1 1 1 1078 1 1 67 THR C C -4.859 -14.061 4.658 1.00 . A A . 101 THR C 1 1 1 1079 1 1 67 THR CA C -3.667 -13.147 4.948 1.00 . A A . 101 THR CA 1 1 1 1080 1 1 67 THR CB C -4.018 -11.647 4.945 1.00 . A A . 101 THR CB 1 1 1 1081 1 1 67 THR CG2 C -4.868 -11.155 3.779 1.00 . A A . 101 THR CG2 1 1 1 1082 1 1 67 THR H H -2.486 -12.955 3.158 1.00 . A A . 101 THR H 1 1 1 1083 1 1 67 THR HA H -3.363 -13.372 5.969 1.00 . A A . 101 THR HA 1 1 1 1084 1 1 67 THR HB H -3.078 -11.095 4.917 1.00 . A A . 101 THR HB 1 1 1 1085 1 1 67 THR HG1 H -5.220 -10.526 5.972 1.00 . A A . 101 THR HG1 1 1 1 1086 1 1 67 THR HG21 H -5.870 -11.573 3.824 1.00 . A A . 101 THR HG21 1 1 1 1087 1 1 67 THR HG22 H -4.409 -11.467 2.850 1.00 . A A . 101 THR HG22 1 1 1 1088 1 1 67 THR HG23 H -4.932 -10.067 3.797 1.00 . A A . 101 THR HG23 1 1 1 1089 1 1 67 THR N N -2.531 -13.428 4.055 1.00 . A A . 101 THR N 1 1 1 1090 1 1 67 THR O O -5.387 -14.662 5.591 1.00 . A A . 101 THR O 1 1 1 1091 1 1 67 THR OG1 O -4.653 -11.290 6.147 1.00 . A A . 101 THR OG1 1 1 1 1092 1 1 68 THR C C -5.805 -16.793 3.668 1.00 . A A . 102 THR C 1 1 1 1093 1 1 68 THR CA C -6.073 -15.444 2.998 1.00 . A A . 102 THR CA 1 1 1 1094 1 1 68 THR CB C -6.093 -15.595 1.470 1.00 . A A . 102 THR CB 1 1 1 1095 1 1 68 THR CG2 C -7.107 -16.617 0.962 1.00 . A A . 102 THR CG2 1 1 1 1096 1 1 68 THR H H -4.597 -13.952 2.643 1.00 . A A . 102 THR H 1 1 1 1097 1 1 68 THR HA H -7.059 -15.109 3.312 1.00 . A A . 102 THR HA 1 1 1 1098 1 1 68 THR HB H -5.100 -15.889 1.127 1.00 . A A . 102 THR HB 1 1 1 1099 1 1 68 THR HG1 H -6.621 -14.544 -0.051 1.00 . A A . 102 THR HG1 1 1 1 1100 1 1 68 THR HG21 H -8.099 -16.382 1.350 1.00 . A A . 102 THR HG21 1 1 1 1101 1 1 68 THR HG22 H -6.827 -17.618 1.290 1.00 . A A . 102 THR HG22 1 1 1 1102 1 1 68 THR HG23 H -7.135 -16.608 -0.128 1.00 . A A . 102 THR HG23 1 1 1 1103 1 1 68 THR N N -5.084 -14.429 3.394 1.00 . A A . 102 THR N 1 1 1 1104 1 1 68 THR O O -6.673 -17.315 4.361 1.00 . A A . 102 THR O 1 1 1 1105 1 1 68 THR OG1 O -6.423 -14.364 0.869 1.00 . A A . 102 THR OG1 1 1 1 1106 1 1 69 THR C C -4.106 -18.365 5.950 1.00 . A A . 103 THR C 1 1 1 1107 1 1 69 THR CA C -4.163 -18.480 4.420 1.00 . A A . 103 THR CA 1 1 1 1108 1 1 69 THR CB C -2.831 -19.035 3.904 1.00 . A A . 103 THR CB 1 1 1 1109 1 1 69 THR CG2 C -2.884 -19.353 2.408 1.00 . A A . 103 THR CG2 1 1 1 1110 1 1 69 THR H H -3.812 -16.729 3.229 1.00 . A A . 103 THR H 1 1 1 1111 1 1 69 THR HA H -4.927 -19.231 4.213 1.00 . A A . 103 THR HA 1 1 1 1112 1 1 69 THR HB H -2.593 -19.953 4.441 1.00 . A A . 103 THR HB 1 1 1 1113 1 1 69 THR HG1 H -1.033 -18.419 3.619 1.00 . A A . 103 THR HG1 1 1 1 1114 1 1 69 THR HG21 H -3.705 -20.042 2.210 1.00 . A A . 103 THR HG21 1 1 1 1115 1 1 69 THR HG22 H -1.950 -19.817 2.096 1.00 . A A . 103 THR HG22 1 1 1 1116 1 1 69 THR HG23 H -3.040 -18.443 1.828 1.00 . A A . 103 THR HG23 1 1 1 1117 1 1 69 THR N N -4.543 -17.238 3.716 1.00 . A A . 103 THR N 1 1 1 1118 1 1 69 THR O O -4.052 -19.391 6.626 1.00 . A A . 103 THR O 1 1 1 1119 1 1 69 THR OG1 O -1.797 -18.103 4.103 1.00 . A A . 103 THR OG1 1 1 1 1120 1 1 70 LYS C C -6.042 -16.984 8.267 1.00 . A A . 104 LYS C 1 1 1 1121 1 1 70 LYS CA C -4.536 -16.927 7.945 1.00 . A A . 104 LYS CA 1 1 1 1122 1 1 70 LYS CB C -3.881 -15.593 8.369 1.00 . A A . 104 LYS CB 1 1 1 1123 1 1 70 LYS CD C -3.435 -13.921 10.238 1.00 . A A . 104 LYS CD 1 1 1 1124 1 1 70 LYS CE C -4.094 -13.363 11.505 1.00 . A A . 104 LYS CE 1 1 1 1125 1 1 70 LYS CG C -4.234 -15.148 9.795 1.00 . A A . 104 LYS CG 1 1 1 1126 1 1 70 LYS H H -4.334 -16.364 5.891 1.00 . A A . 104 LYS H 1 1 1 1127 1 1 70 LYS HA H -4.082 -17.731 8.526 1.00 . A A . 104 LYS HA 1 1 1 1128 1 1 70 LYS HB2 H -2.799 -15.697 8.280 1.00 . A A . 104 LYS HB2 1 1 1 1129 1 1 70 LYS HB3 H -4.195 -14.799 7.697 1.00 . A A . 104 LYS HB3 1 1 1 1130 1 1 70 LYS HD2 H -2.403 -14.221 10.432 1.00 . A A . 104 LYS HD2 1 1 1 1131 1 1 70 LYS HD3 H -3.456 -13.164 9.451 1.00 . A A . 104 LYS HD3 1 1 1 1132 1 1 70 LYS HE2 H -5.059 -12.932 11.220 1.00 . A A . 104 LYS HE2 1 1 1 1133 1 1 70 LYS HE3 H -4.293 -14.192 12.193 1.00 . A A . 104 LYS HE3 1 1 1 1134 1 1 70 LYS HG2 H -5.293 -14.887 9.826 1.00 . A A . 104 LYS HG2 1 1 1 1135 1 1 70 LYS HG3 H -4.046 -15.967 10.491 1.00 . A A . 104 LYS HG3 1 1 1 1136 1 1 70 LYS HZ1 H -2.434 -12.778 12.577 1.00 . A A . 104 LYS HZ1 1 1 1 1137 1 1 70 LYS HZ2 H -3.772 -11.874 12.894 1.00 . A A . 104 LYS HZ2 1 1 1 1138 1 1 70 LYS HZ3 H -2.950 -11.649 11.490 1.00 . A A . 104 LYS HZ3 1 1 1 1139 1 1 70 LYS N N -4.248 -17.157 6.516 1.00 . A A . 104 LYS N 1 1 1 1140 1 1 70 LYS NZ N -3.248 -12.341 12.165 1.00 . A A . 104 LYS NZ 1 1 1 1141 1 1 70 LYS O O -6.390 -17.145 9.435 1.00 . A A . 104 LYS O 1 1 1 1142 1 1 71 GLY C C -9.160 -15.762 6.745 1.00 . A A . 105 GLY C 1 1 1 1143 1 1 71 GLY CA C -8.381 -16.889 7.432 1.00 . A A . 105 GLY CA 1 1 1 1144 1 1 71 GLY H H -6.562 -16.766 6.329 1.00 . A A . 105 GLY H 1 1 1 1145 1 1 71 GLY HA2 H -8.736 -17.831 7.016 1.00 . A A . 105 GLY HA2 1 1 1 1146 1 1 71 GLY HA3 H -8.645 -16.864 8.490 1.00 . A A . 105 GLY HA3 1 1 1 1147 1 1 71 GLY N N -6.921 -16.833 7.273 1.00 . A A . 105 GLY N 1 1 1 1148 1 1 71 GLY O O -10.328 -15.573 7.071 1.00 . A A . 105 GLY O 1 1 1 1149 1 1 72 GLU C C -9.833 -14.138 3.978 1.00 . A A . 106 GLU C 1 1 1 1150 1 1 72 GLU CA C -9.140 -13.764 5.299 1.00 . A A . 106 GLU CA 1 1 1 1151 1 1 72 GLU CB C -8.107 -12.645 5.048 1.00 . A A . 106 GLU CB 1 1 1 1152 1 1 72 GLU CD C -9.720 -10.865 5.752 1.00 . A A . 106 GLU CD 1 1 1 1153 1 1 72 GLU CG C -8.313 -11.429 5.948 1.00 . A A . 106 GLU CG 1 1 1 1154 1 1 72 GLU H H -7.521 -15.074 5.770 1.00 . A A . 106 GLU H 1 1 1 1155 1 1 72 GLU HA H -9.929 -13.391 5.951 1.00 . A A . 106 GLU HA 1 1 1 1156 1 1 72 GLU HB2 H -7.110 -13.009 5.235 1.00 . A A . 106 GLU HB2 1 1 1 1157 1 1 72 GLU HB3 H -8.136 -12.323 4.006 1.00 . A A . 106 GLU HB3 1 1 1 1158 1 1 72 GLU HG2 H -8.160 -11.724 6.990 1.00 . A A . 106 GLU HG2 1 1 1 1159 1 1 72 GLU HG3 H -7.564 -10.673 5.699 1.00 . A A . 106 GLU HG3 1 1 1 1160 1 1 72 GLU N N -8.493 -14.895 5.978 1.00 . A A . 106 GLU N 1 1 1 1161 1 1 72 GLU O O -9.471 -15.116 3.324 1.00 . A A . 106 GLU O 1 1 1 1162 1 1 72 GLU OE1 O -10.047 -10.588 4.582 1.00 . A A . 106 GLU OE1 1 1 1 1163 1 1 72 GLU OE2 O -10.536 -11.129 6.660 1.00 . A A . 106 GLU OE2 1 1 1 1164 1 1 73 ASN C C -11.469 -11.748 1.719 1.00 . A A . 107 ASN C 1 1 1 1165 1 1 73 ASN CA C -11.171 -13.203 2.114 1.00 . A A . 107 ASN CA 1 1 1 1166 1 1 73 ASN CB C -12.402 -14.122 1.991 1.00 . A A . 107 ASN CB 1 1 1 1167 1 1 73 ASN CG C -12.947 -14.163 0.572 1.00 . A A . 107 ASN CG 1 1 1 1168 1 1 73 ASN H H -10.771 -12.349 4.009 1.00 . A A . 107 ASN H 1 1 1 1169 1 1 73 ASN HA H -10.400 -13.585 1.441 1.00 . A A . 107 ASN HA 1 1 1 1170 1 1 73 ASN HB2 H -12.118 -15.136 2.271 1.00 . A A . 107 ASN HB2 1 1 1 1171 1 1 73 ASN HB3 H -13.186 -13.782 2.666 1.00 . A A . 107 ASN HB3 1 1 1 1172 1 1 73 ASN HD21 H -13.694 -12.324 0.744 1.00 . A A . 107 ASN HD21 1 1 1 1173 1 1 73 ASN HD22 H -13.805 -13.085 -0.834 1.00 . A A . 107 ASN HD22 1 1 1 1174 1 1 73 ASN N N -10.661 -13.217 3.481 1.00 . A A . 107 ASN N 1 1 1 1175 1 1 73 ASN ND2 N -13.672 -13.152 0.158 1.00 . A A . 107 ASN ND2 1 1 1 1176 1 1 73 ASN O O -12.581 -11.253 1.919 1.00 . A A . 107 ASN O 1 1 1 1177 1 1 73 ASN OD1 O -12.643 -15.048 -0.208 1.00 . A A . 107 ASN OD1 1 1 1 1178 1 1 74 PHE C C -11.776 -9.703 -0.484 1.00 . A A . 108 PHE C 1 1 1 1179 1 1 74 PHE CA C -10.634 -9.752 0.549 1.00 . A A . 108 PHE CA 1 1 1 1180 1 1 74 PHE CB C -9.292 -9.294 -0.055 1.00 . A A . 108 PHE CB 1 1 1 1181 1 1 74 PHE CD1 C -9.096 -9.974 -2.491 1.00 . A A . 108 PHE CD1 1 1 1 1182 1 1 74 PHE CD2 C -7.891 -11.277 -0.826 1.00 . A A . 108 PHE CD2 1 1 1 1183 1 1 74 PHE CE1 C -8.629 -10.831 -3.503 1.00 . A A . 108 PHE CE1 1 1 1 1184 1 1 74 PHE CE2 C -7.432 -12.140 -1.838 1.00 . A A . 108 PHE CE2 1 1 1 1185 1 1 74 PHE CG C -8.735 -10.195 -1.148 1.00 . A A . 108 PHE CG 1 1 1 1186 1 1 74 PHE CZ C -7.802 -11.919 -3.176 1.00 . A A . 108 PHE CZ 1 1 1 1187 1 1 74 PHE H H -9.616 -11.575 0.949 1.00 . A A . 108 PHE H 1 1 1 1188 1 1 74 PHE HA H -10.897 -9.069 1.359 1.00 . A A . 108 PHE HA 1 1 1 1189 1 1 74 PHE HB2 H -9.416 -8.290 -0.464 1.00 . A A . 108 PHE HB2 1 1 1 1190 1 1 74 PHE HB3 H -8.556 -9.221 0.747 1.00 . A A . 108 PHE HB3 1 1 1 1191 1 1 74 PHE HD1 H -9.768 -9.165 -2.742 1.00 . A A . 108 PHE HD1 1 1 1 1192 1 1 74 PHE HD2 H -7.619 -11.465 0.203 1.00 . A A . 108 PHE HD2 1 1 1 1193 1 1 74 PHE HE1 H -8.937 -10.668 -4.527 1.00 . A A . 108 PHE HE1 1 1 1 1194 1 1 74 PHE HE2 H -6.813 -12.987 -1.586 1.00 . A A . 108 PHE HE2 1 1 1 1195 1 1 74 PHE HZ H -7.472 -12.595 -3.952 1.00 . A A . 108 PHE HZ 1 1 1 1196 1 1 74 PHE N N -10.477 -11.087 1.122 1.00 . A A . 108 PHE N 1 1 1 1197 1 1 74 PHE O O -12.011 -10.655 -1.231 1.00 . A A . 108 PHE O 1 1 1 1198 1 1 75 THR C C -12.888 -7.011 -2.499 1.00 . A A . 109 THR C 1 1 1 1199 1 1 75 THR CA C -13.368 -8.197 -1.663 1.00 . A A . 109 THR CA 1 1 1 1200 1 1 75 THR CB C -14.725 -7.874 -1.012 1.00 . A A . 109 THR CB 1 1 1 1201 1 1 75 THR CG2 C -15.204 -8.947 -0.034 1.00 . A A . 109 THR CG2 1 1 1 1202 1 1 75 THR H H -12.182 -7.804 0.054 1.00 . A A . 109 THR H 1 1 1 1203 1 1 75 THR HA H -13.503 -9.044 -2.334 1.00 . A A . 109 THR HA 1 1 1 1204 1 1 75 THR HB H -15.467 -7.783 -1.806 1.00 . A A . 109 THR HB 1 1 1 1205 1 1 75 THR HG1 H -14.102 -6.781 0.478 1.00 . A A . 109 THR HG1 1 1 1 1206 1 1 75 THR HG21 H -16.222 -8.721 0.280 1.00 . A A . 109 THR HG21 1 1 1 1207 1 1 75 THR HG22 H -14.561 -8.972 0.848 1.00 . A A . 109 THR HG22 1 1 1 1208 1 1 75 THR HG23 H -15.183 -9.922 -0.518 1.00 . A A . 109 THR HG23 1 1 1 1209 1 1 75 THR N N -12.367 -8.523 -0.638 1.00 . A A . 109 THR N 1 1 1 1210 1 1 75 THR O O -11.910 -6.365 -2.133 1.00 . A A . 109 THR O 1 1 1 1211 1 1 75 THR OG1 O -14.681 -6.650 -0.315 1.00 . A A . 109 THR OG1 1 1 1 1212 1 1 76 GLU C C -13.394 -4.130 -3.325 1.00 . A A . 110 GLU C 1 1 1 1213 1 1 76 GLU CA C -13.365 -5.355 -4.258 1.00 . A A . 110 GLU CA 1 1 1 1214 1 1 76 GLU CB C -14.389 -5.161 -5.387 1.00 . A A . 110 GLU CB 1 1 1 1215 1 1 76 GLU CD C -12.869 -6.030 -7.235 1.00 . A A . 110 GLU CD 1 1 1 1216 1 1 76 GLU CG C -14.227 -6.173 -6.534 1.00 . A A . 110 GLU CG 1 1 1 1217 1 1 76 GLU H H -14.381 -7.197 -3.866 1.00 . A A . 110 GLU H 1 1 1 1218 1 1 76 GLU HA H -12.369 -5.385 -4.703 1.00 . A A . 110 GLU HA 1 1 1 1219 1 1 76 GLU HB2 H -15.395 -5.252 -4.974 1.00 . A A . 110 GLU HB2 1 1 1 1220 1 1 76 GLU HB3 H -14.288 -4.152 -5.790 1.00 . A A . 110 GLU HB3 1 1 1 1221 1 1 76 GLU HG2 H -14.364 -7.181 -6.141 1.00 . A A . 110 GLU HG2 1 1 1 1222 1 1 76 GLU HG3 H -15.020 -5.992 -7.264 1.00 . A A . 110 GLU HG3 1 1 1 1223 1 1 76 GLU N N -13.619 -6.622 -3.548 1.00 . A A . 110 GLU N 1 1 1 1224 1 1 76 GLU O O -12.617 -3.198 -3.518 1.00 . A A . 110 GLU O 1 1 1 1225 1 1 76 GLU OE1 O -12.479 -4.898 -7.522 1.00 . A A . 110 GLU OE1 1 1 1 1226 1 1 76 GLU OE2 O -12.193 -7.098 -7.375 1.00 . A A . 110 GLU OE2 1 1 1 1227 1 1 77 THR C C -12.843 -3.090 -0.464 1.00 . A A . 111 THR C 1 1 1 1228 1 1 77 THR CA C -14.179 -3.128 -1.204 1.00 . A A . 111 THR CA 1 1 1 1229 1 1 77 THR CB C -15.308 -3.349 -0.183 1.00 . A A . 111 THR CB 1 1 1 1230 1 1 77 THR CG2 C -15.589 -2.092 0.637 1.00 . A A . 111 THR CG2 1 1 1 1231 1 1 77 THR H H -14.752 -4.986 -2.080 1.00 . A A . 111 THR H 1 1 1 1232 1 1 77 THR HA H -14.327 -2.159 -1.679 1.00 . A A . 111 THR HA 1 1 1 1233 1 1 77 THR HB H -15.039 -4.164 0.489 1.00 . A A . 111 THR HB 1 1 1 1234 1 1 77 THR HG1 H -17.047 -4.157 -0.180 1.00 . A A . 111 THR HG1 1 1 1 1235 1 1 77 THR HG21 H -16.359 -2.306 1.379 1.00 . A A . 111 THR HG21 1 1 1 1236 1 1 77 THR HG22 H -15.929 -1.289 -0.017 1.00 . A A . 111 THR HG22 1 1 1 1237 1 1 77 THR HG23 H -14.683 -1.774 1.150 1.00 . A A . 111 THR HG23 1 1 1 1238 1 1 77 THR N N -14.181 -4.168 -2.243 1.00 . A A . 111 THR N 1 1 1 1239 1 1 77 THR O O -12.195 -2.047 -0.437 1.00 . A A . 111 THR O 1 1 1 1240 1 1 77 THR OG1 O -16.520 -3.680 -0.824 1.00 . A A . 111 THR OG1 1 1 1 1241 1 1 78 ASP C C -9.899 -4.012 -0.228 1.00 . A A . 112 ASP C 1 1 1 1242 1 1 78 ASP CA C -11.063 -4.364 0.701 1.00 . A A . 112 ASP CA 1 1 1 1243 1 1 78 ASP CB C -10.864 -5.781 1.252 1.00 . A A . 112 ASP CB 1 1 1 1244 1 1 78 ASP CG C -12.005 -6.184 2.178 1.00 . A A . 112 ASP CG 1 1 1 1245 1 1 78 ASP H H -12.926 -5.075 -0.066 1.00 . A A . 112 ASP H 1 1 1 1246 1 1 78 ASP HA H -11.041 -3.683 1.550 1.00 . A A . 112 ASP HA 1 1 1 1247 1 1 78 ASP HB2 H -10.794 -6.487 0.425 1.00 . A A . 112 ASP HB2 1 1 1 1248 1 1 78 ASP HB3 H -9.924 -5.821 1.806 1.00 . A A . 112 ASP HB3 1 1 1 1249 1 1 78 ASP N N -12.362 -4.239 0.025 1.00 . A A . 112 ASP N 1 1 1 1250 1 1 78 ASP O O -9.048 -3.209 0.145 1.00 . A A . 112 ASP O 1 1 1 1251 1 1 78 ASP OD1 O -12.065 -5.616 3.286 1.00 . A A . 112 ASP OD1 1 1 1 1252 1 1 78 ASP OD2 O -12.959 -6.779 1.618 1.00 . A A . 112 ASP OD2 1 1 1 1253 1 1 79 ILE C C -8.956 -2.584 -2.723 1.00 . A A . 113 ILE C 1 1 1 1254 1 1 79 ILE CA C -8.986 -4.098 -2.534 1.00 . A A . 113 ILE CA 1 1 1 1255 1 1 79 ILE CB C -9.296 -4.814 -3.869 1.00 . A A . 113 ILE CB 1 1 1 1256 1 1 79 ILE CD1 C -9.802 -7.142 -4.823 1.00 . A A . 113 ILE CD1 1 1 1 1257 1 1 79 ILE CG1 C -9.044 -6.335 -3.758 1.00 . A A . 113 ILE CG1 1 1 1 1258 1 1 79 ILE CG2 C -8.423 -4.248 -5.010 1.00 . A A . 113 ILE CG2 1 1 1 1259 1 1 79 ILE H H -10.716 -5.076 -1.736 1.00 . A A . 113 ILE H 1 1 1 1260 1 1 79 ILE HA H -7.990 -4.401 -2.212 1.00 . A A . 113 ILE HA 1 1 1 1261 1 1 79 ILE HB H -10.342 -4.639 -4.116 1.00 . A A . 113 ILE HB 1 1 1 1262 1 1 79 ILE HD11 H -9.359 -8.132 -4.915 1.00 . A A . 113 ILE HD11 1 1 1 1263 1 1 79 ILE HD12 H -9.764 -6.653 -5.795 1.00 . A A . 113 ILE HD12 1 1 1 1264 1 1 79 ILE HD13 H -10.845 -7.249 -4.532 1.00 . A A . 113 ILE HD13 1 1 1 1265 1 1 79 ILE HG12 H -7.975 -6.529 -3.854 1.00 . A A . 113 ILE HG12 1 1 1 1266 1 1 79 ILE HG13 H -9.354 -6.701 -2.780 1.00 . A A . 113 ILE HG13 1 1 1 1267 1 1 79 ILE HG21 H -8.581 -4.806 -5.932 1.00 . A A . 113 ILE HG21 1 1 1 1268 1 1 79 ILE HG22 H -7.367 -4.292 -4.743 1.00 . A A . 113 ILE HG22 1 1 1 1269 1 1 79 ILE HG23 H -8.689 -3.212 -5.226 1.00 . A A . 113 ILE HG23 1 1 1 1270 1 1 79 ILE N N -9.940 -4.470 -1.484 1.00 . A A . 113 ILE N 1 1 1 1271 1 1 79 ILE O O -7.871 -2.018 -2.697 1.00 . A A . 113 ILE O 1 1 1 1272 1 1 80 LYS C C -9.596 0.305 -1.693 1.00 . A A . 114 LYS C 1 1 1 1273 1 1 80 LYS CA C -10.157 -0.440 -2.905 1.00 . A A . 114 LYS CA 1 1 1 1274 1 1 80 LYS CB C -11.591 -0.011 -3.243 1.00 . A A . 114 LYS CB 1 1 1 1275 1 1 80 LYS CD C -13.383 -0.310 -5.018 1.00 . A A . 114 LYS CD 1 1 1 1276 1 1 80 LYS CE C -13.607 -0.493 -6.521 1.00 . A A . 114 LYS CE 1 1 1 1277 1 1 80 LYS CG C -11.881 -0.339 -4.714 1.00 . A A . 114 LYS CG 1 1 1 1278 1 1 80 LYS H H -10.977 -2.425 -2.777 1.00 . A A . 114 LYS H 1 1 1 1279 1 1 80 LYS HA H -9.510 -0.155 -3.738 1.00 . A A . 114 LYS HA 1 1 1 1280 1 1 80 LYS HB2 H -12.297 -0.525 -2.591 1.00 . A A . 114 LYS HB2 1 1 1 1281 1 1 80 LYS HB3 H -11.702 1.066 -3.098 1.00 . A A . 114 LYS HB3 1 1 1 1282 1 1 80 LYS HD2 H -13.868 -1.131 -4.488 1.00 . A A . 114 LYS HD2 1 1 1 1283 1 1 80 LYS HD3 H -13.821 0.630 -4.675 1.00 . A A . 114 LYS HD3 1 1 1 1284 1 1 80 LYS HE2 H -13.049 -1.378 -6.854 1.00 . A A . 114 LYS HE2 1 1 1 1285 1 1 80 LYS HE3 H -14.670 -0.679 -6.699 1.00 . A A . 114 LYS HE3 1 1 1 1286 1 1 80 LYS HG2 H -11.353 0.388 -5.333 1.00 . A A . 114 LYS HG2 1 1 1 1287 1 1 80 LYS HG3 H -11.501 -1.330 -4.969 1.00 . A A . 114 LYS HG3 1 1 1 1288 1 1 80 LYS HZ1 H -12.179 0.872 -7.063 1.00 . A A . 114 LYS HZ1 1 1 1 1289 1 1 80 LYS HZ2 H -13.685 1.517 -6.942 1.00 . A A . 114 LYS HZ2 1 1 1 1290 1 1 80 LYS HZ3 H -13.276 0.583 -8.254 1.00 . A A . 114 LYS HZ3 1 1 1 1291 1 1 80 LYS N N -10.104 -1.903 -2.767 1.00 . A A . 114 LYS N 1 1 1 1292 1 1 80 LYS NZ N -13.160 0.712 -7.259 1.00 . A A . 114 LYS NZ 1 1 1 1293 1 1 80 LYS O O -8.790 1.213 -1.903 1.00 . A A . 114 LYS O 1 1 1 1294 1 1 81 ILE C C -7.571 0.145 0.589 1.00 . A A . 115 ILE C 1 1 1 1295 1 1 81 ILE CA C -9.084 0.379 0.711 1.00 . A A . 115 ILE CA 1 1 1 1296 1 1 81 ILE CB C -9.640 -0.033 2.114 1.00 . A A . 115 ILE CB 1 1 1 1297 1 1 81 ILE CD1 C -9.128 -1.340 4.338 1.00 . A A . 115 ILE CD1 1 1 1 1298 1 1 81 ILE CG1 C -8.763 -1.060 2.880 1.00 . A A . 115 ILE CG1 1 1 1 1299 1 1 81 ILE CG2 C -11.099 -0.507 2.060 1.00 . A A . 115 ILE CG2 1 1 1 1300 1 1 81 ILE H H -10.434 -0.965 -0.345 1.00 . A A . 115 ILE H 1 1 1 1301 1 1 81 ILE HA H -9.232 1.451 0.647 1.00 . A A . 115 ILE HA 1 1 1 1302 1 1 81 ILE HB H -9.635 0.879 2.713 1.00 . A A . 115 ILE HB 1 1 1 1303 1 1 81 ILE HD11 H -8.610 -2.237 4.670 1.00 . A A . 115 ILE HD11 1 1 1 1304 1 1 81 ILE HD12 H -10.197 -1.501 4.463 1.00 . A A . 115 ILE HD12 1 1 1 1305 1 1 81 ILE HD13 H -8.785 -0.507 4.947 1.00 . A A . 115 ILE HD13 1 1 1 1306 1 1 81 ILE HG12 H -8.769 -2.006 2.345 1.00 . A A . 115 ILE HG12 1 1 1 1307 1 1 81 ILE HG13 H -7.740 -0.689 2.921 1.00 . A A . 115 ILE HG13 1 1 1 1308 1 1 81 ILE HG21 H -11.546 -0.484 3.050 1.00 . A A . 115 ILE HG21 1 1 1 1309 1 1 81 ILE HG22 H -11.127 -1.528 1.692 1.00 . A A . 115 ILE HG22 1 1 1 1310 1 1 81 ILE HG23 H -11.693 0.133 1.407 1.00 . A A . 115 ILE HG23 1 1 1 1311 1 1 81 ILE N N -9.794 -0.185 -0.459 1.00 . A A . 115 ILE N 1 1 1 1312 1 1 81 ILE O O -6.774 1.046 0.853 1.00 . A A . 115 ILE O 1 1 1 1313 1 1 82 MET C C -5.041 -0.699 -0.891 1.00 . A A . 116 MET C 1 1 1 1314 1 1 82 MET CA C -5.785 -1.515 0.152 1.00 . A A . 116 MET CA 1 1 1 1315 1 1 82 MET CB C -5.710 -3.000 -0.224 1.00 . A A . 116 MET CB 1 1 1 1316 1 1 82 MET CE C -5.457 -5.934 -0.977 1.00 . A A . 116 MET CE 1 1 1 1317 1 1 82 MET CG C -6.155 -3.928 0.904 1.00 . A A . 116 MET CG 1 1 1 1318 1 1 82 MET H H -7.903 -1.765 0.026 1.00 . A A . 116 MET H 1 1 1 1319 1 1 82 MET HA H -5.293 -1.357 1.109 1.00 . A A . 116 MET HA 1 1 1 1320 1 1 82 MET HB2 H -6.330 -3.183 -1.097 1.00 . A A . 116 MET HB2 1 1 1 1321 1 1 82 MET HB3 H -4.677 -3.244 -0.477 1.00 . A A . 116 MET HB3 1 1 1 1322 1 1 82 MET HE1 H -5.572 -6.963 -1.308 1.00 . A A . 116 MET HE1 1 1 1 1323 1 1 82 MET HE2 H -4.424 -5.750 -0.689 1.00 . A A . 116 MET HE2 1 1 1 1324 1 1 82 MET HE3 H -5.731 -5.273 -1.799 1.00 . A A . 116 MET HE3 1 1 1 1325 1 1 82 MET HG2 H -5.363 -3.925 1.646 1.00 . A A . 116 MET HG2 1 1 1 1326 1 1 82 MET HG3 H -7.035 -3.514 1.389 1.00 . A A . 116 MET HG3 1 1 1 1327 1 1 82 MET N N -7.177 -1.082 0.236 1.00 . A A . 116 MET N 1 1 1 1328 1 1 82 MET O O -4.123 0.027 -0.539 1.00 . A A . 116 MET O 1 1 1 1329 1 1 82 MET SD S -6.551 -5.644 0.436 1.00 . A A . 116 MET SD 1 1 1 1330 1 1 83 GLU C C -4.852 1.475 -3.014 1.00 . A A . 117 GLU C 1 1 1 1331 1 1 83 GLU CA C -5.005 -0.019 -3.287 1.00 . A A . 117 GLU CA 1 1 1 1332 1 1 83 GLU CB C -5.919 -0.319 -4.485 1.00 . A A . 117 GLU CB 1 1 1 1333 1 1 83 GLU CD C -6.237 -0.252 -6.980 1.00 . A A . 117 GLU CD 1 1 1 1334 1 1 83 GLU CG C -5.415 0.282 -5.800 1.00 . A A . 117 GLU CG 1 1 1 1335 1 1 83 GLU H H -6.362 -1.279 -2.286 1.00 . A A . 117 GLU H 1 1 1 1336 1 1 83 GLU HA H -4.014 -0.406 -3.519 1.00 . A A . 117 GLU HA 1 1 1 1337 1 1 83 GLU HB2 H -5.972 -1.403 -4.605 1.00 . A A . 117 GLU HB2 1 1 1 1338 1 1 83 GLU HB3 H -6.922 0.057 -4.280 1.00 . A A . 117 GLU HB3 1 1 1 1339 1 1 83 GLU HG2 H -5.496 1.370 -5.753 1.00 . A A . 117 GLU HG2 1 1 1 1340 1 1 83 GLU HG3 H -4.362 0.022 -5.929 1.00 . A A . 117 GLU HG3 1 1 1 1341 1 1 83 GLU N N -5.521 -0.731 -2.128 1.00 . A A . 117 GLU N 1 1 1 1342 1 1 83 GLU O O -3.726 1.952 -3.102 1.00 . A A . 117 GLU O 1 1 1 1343 1 1 83 GLU OE1 O -7.372 0.241 -7.169 1.00 . A A . 117 GLU OE1 1 1 1 1344 1 1 83 GLU OE2 O -5.747 -1.212 -7.625 1.00 . A A . 117 GLU OE2 1 1 1 1345 1 1 84 ARG C C -4.553 3.837 -1.059 1.00 . A A . 118 ARG C 1 1 1 1346 1 1 84 ARG CA C -5.716 3.554 -2.004 1.00 . A A . 118 ARG CA 1 1 1 1347 1 1 84 ARG CB C -7.016 4.068 -1.356 1.00 . A A . 118 ARG CB 1 1 1 1348 1 1 84 ARG CD C -7.991 5.435 -3.170 1.00 . A A . 118 ARG CD 1 1 1 1349 1 1 84 ARG CG C -7.312 5.501 -1.799 1.00 . A A . 118 ARG CG 1 1 1 1350 1 1 84 ARG CZ C -8.384 6.955 -5.078 1.00 . A A . 118 ARG CZ 1 1 1 1351 1 1 84 ARG H H -6.723 1.652 -2.232 1.00 . A A . 118 ARG H 1 1 1 1352 1 1 84 ARG HA H -5.499 4.108 -2.920 1.00 . A A . 118 ARG HA 1 1 1 1353 1 1 84 ARG HB2 H -7.860 3.440 -1.628 1.00 . A A . 118 ARG HB2 1 1 1 1354 1 1 84 ARG HB3 H -6.927 4.048 -0.270 1.00 . A A . 118 ARG HB3 1 1 1 1355 1 1 84 ARG HD2 H -7.593 4.588 -3.735 1.00 . A A . 118 ARG HD2 1 1 1 1356 1 1 84 ARG HD3 H -9.059 5.267 -3.014 1.00 . A A . 118 ARG HD3 1 1 1 1357 1 1 84 ARG HE H -6.947 7.197 -3.721 1.00 . A A . 118 ARG HE 1 1 1 1358 1 1 84 ARG HG2 H -7.983 5.982 -1.086 1.00 . A A . 118 ARG HG2 1 1 1 1359 1 1 84 ARG HG3 H -6.383 6.071 -1.847 1.00 . A A . 118 ARG HG3 1 1 1 1360 1 1 84 ARG HH11 H -9.715 5.480 -4.953 1.00 . A A . 118 ARG HH11 1 1 1 1361 1 1 84 ARG HH12 H -9.872 6.497 -6.357 1.00 . A A . 118 ARG HH12 1 1 1 1362 1 1 84 ARG HH21 H -7.103 8.399 -5.572 1.00 . A A . 118 ARG HH21 1 1 1 1363 1 1 84 ARG HH22 H -8.400 8.127 -6.692 1.00 . A A . 118 ARG HH22 1 1 1 1364 1 1 84 ARG N N -5.837 2.132 -2.375 1.00 . A A . 118 ARG N 1 1 1 1365 1 1 84 ARG NE N -7.760 6.653 -3.957 1.00 . A A . 118 ARG NE 1 1 1 1366 1 1 84 ARG NH1 N -9.409 6.268 -5.501 1.00 . A A . 118 ARG NH1 1 1 1 1367 1 1 84 ARG NH2 N -7.976 7.957 -5.801 1.00 . A A . 118 ARG NH2 1 1 1 1368 1 1 84 ARG O O -3.828 4.815 -1.237 1.00 . A A . 118 ARG O 1 1 1 1369 1 1 85 VAL C C -2.211 2.942 0.895 1.00 . A A . 119 VAL C 1 1 1 1370 1 1 85 VAL CA C -3.613 3.462 1.172 1.00 . A A . 119 VAL CA 1 1 1 1371 1 1 85 VAL CB C -4.108 2.891 2.504 1.00 . A A . 119 VAL CB 1 1 1 1372 1 1 85 VAL CG1 C -3.223 3.413 3.642 1.00 . A A . 119 VAL CG1 1 1 1 1373 1 1 85 VAL CG2 C -5.543 3.317 2.827 1.00 . A A . 119 VAL CG2 1 1 1 1374 1 1 85 VAL H H -5.173 2.354 0.164 1.00 . A A . 119 VAL H 1 1 1 1375 1 1 85 VAL HA H -3.556 4.546 1.264 1.00 . A A . 119 VAL HA 1 1 1 1376 1 1 85 VAL HB H -4.062 1.802 2.474 1.00 . A A . 119 VAL HB 1 1 1 1377 1 1 85 VAL HG11 H -2.205 3.039 3.541 1.00 . A A . 119 VAL HG11 1 1 1 1378 1 1 85 VAL HG12 H -3.607 3.049 4.584 1.00 . A A . 119 VAL HG12 1 1 1 1379 1 1 85 VAL HG13 H -3.213 4.503 3.636 1.00 . A A . 119 VAL HG13 1 1 1 1380 1 1 85 VAL HG21 H -6.211 3.133 1.991 1.00 . A A . 119 VAL HG21 1 1 1 1381 1 1 85 VAL HG22 H -5.588 4.377 3.070 1.00 . A A . 119 VAL HG22 1 1 1 1382 1 1 85 VAL HG23 H -5.899 2.704 3.651 1.00 . A A . 119 VAL HG23 1 1 1 1383 1 1 85 VAL N N -4.517 3.124 0.065 1.00 . A A . 119 VAL N 1 1 1 1384 1 1 85 VAL O O -1.234 3.623 1.200 1.00 . A A . 119 VAL O 1 1 1 1385 1 1 86 VAL C C -0.344 2.196 -1.365 1.00 . A A . 120 VAL C 1 1 1 1386 1 1 86 VAL CA C -0.877 1.247 -0.295 1.00 . A A . 120 VAL CA 1 1 1 1387 1 1 86 VAL CB C -1.061 -0.194 -0.799 1.00 . A A . 120 VAL CB 1 1 1 1388 1 1 86 VAL CG1 C 0.154 -0.706 -1.563 1.00 . A A . 120 VAL CG1 1 1 1 1389 1 1 86 VAL CG2 C -1.302 -1.158 0.378 1.00 . A A . 120 VAL CG2 1 1 1 1390 1 1 86 VAL H H -2.979 1.303 0.001 1.00 . A A . 120 VAL H 1 1 1 1391 1 1 86 VAL HA H -0.134 1.222 0.501 1.00 . A A . 120 VAL HA 1 1 1 1392 1 1 86 VAL HB H -1.901 -0.237 -1.487 1.00 . A A . 120 VAL HB 1 1 1 1393 1 1 86 VAL HG11 H -0.010 -1.746 -1.824 1.00 . A A . 120 VAL HG11 1 1 1 1394 1 1 86 VAL HG12 H 1.059 -0.613 -0.974 1.00 . A A . 120 VAL HG12 1 1 1 1395 1 1 86 VAL HG13 H 0.270 -0.133 -2.479 1.00 . A A . 120 VAL HG13 1 1 1 1396 1 1 86 VAL HG21 H -0.427 -1.198 1.026 1.00 . A A . 120 VAL HG21 1 1 1 1397 1 1 86 VAL HG22 H -1.520 -2.157 0.002 1.00 . A A . 120 VAL HG22 1 1 1 1398 1 1 86 VAL HG23 H -2.156 -0.829 0.970 1.00 . A A . 120 VAL HG23 1 1 1 1399 1 1 86 VAL N N -2.116 1.776 0.260 1.00 . A A . 120 VAL N 1 1 1 1400 1 1 86 VAL O O 0.706 2.751 -1.108 1.00 . A A . 120 VAL O 1 1 1 1401 1 1 87 GLU C C -0.184 4.930 -2.803 1.00 . A A . 121 GLU C 1 1 1 1402 1 1 87 GLU CA C -0.666 3.595 -3.396 1.00 . A A . 121 GLU CA 1 1 1 1403 1 1 87 GLU CB C -1.793 3.841 -4.417 1.00 . A A . 121 GLU CB 1 1 1 1404 1 1 87 GLU CD C -2.463 4.972 -6.587 1.00 . A A . 121 GLU CD 1 1 1 1405 1 1 87 GLU CG C -1.435 4.911 -5.455 1.00 . A A . 121 GLU CG 1 1 1 1406 1 1 87 GLU H H -2.040 2.223 -2.499 1.00 . A A . 121 GLU H 1 1 1 1407 1 1 87 GLU HA H 0.177 3.167 -3.937 1.00 . A A . 121 GLU HA 1 1 1 1408 1 1 87 GLU HB2 H -1.997 2.902 -4.934 1.00 . A A . 121 GLU HB2 1 1 1 1409 1 1 87 GLU HB3 H -2.692 4.166 -3.893 1.00 . A A . 121 GLU HB3 1 1 1 1410 1 1 87 GLU HG2 H -1.369 5.886 -4.966 1.00 . A A . 121 GLU HG2 1 1 1 1411 1 1 87 GLU HG3 H -0.457 4.681 -5.868 1.00 . A A . 121 GLU HG3 1 1 1 1412 1 1 87 GLU N N -1.110 2.618 -2.378 1.00 . A A . 121 GLU N 1 1 1 1413 1 1 87 GLU O O 0.915 5.394 -3.132 1.00 . A A . 121 GLU O 1 1 1 1414 1 1 87 GLU OE1 O -2.236 4.256 -7.589 1.00 . A A . 121 GLU OE1 1 1 1 1415 1 1 87 GLU OE2 O -3.370 5.833 -6.496 1.00 . A A . 121 GLU OE2 1 1 1 1416 1 1 88 GLN C C 0.848 6.408 -0.348 1.00 . A A . 122 GLN C 1 1 1 1417 1 1 88 GLN CA C -0.494 6.646 -1.056 1.00 . A A . 122 GLN CA 1 1 1 1418 1 1 88 GLN CB C -1.606 7.012 -0.056 1.00 . A A . 122 GLN CB 1 1 1 1419 1 1 88 GLN CD C -0.924 9.464 0.217 1.00 . A A . 122 GLN CD 1 1 1 1420 1 1 88 GLN CG C -1.243 8.147 0.919 1.00 . A A . 122 GLN CG 1 1 1 1421 1 1 88 GLN H H -1.825 5.063 -1.626 1.00 . A A . 122 GLN H 1 1 1 1422 1 1 88 GLN HA H -0.361 7.479 -1.749 1.00 . A A . 122 GLN HA 1 1 1 1423 1 1 88 GLN HB2 H -2.498 7.299 -0.616 1.00 . A A . 122 GLN HB2 1 1 1 1424 1 1 88 GLN HB3 H -1.857 6.131 0.534 1.00 . A A . 122 GLN HB3 1 1 1 1425 1 1 88 GLN HE21 H 0.953 9.655 1.012 1.00 . A A . 122 GLN HE21 1 1 1 1426 1 1 88 GLN HE22 H 0.378 10.922 -0.049 1.00 . A A . 122 GLN HE22 1 1 1 1427 1 1 88 GLN HG2 H -2.093 8.319 1.578 1.00 . A A . 122 GLN HG2 1 1 1 1428 1 1 88 GLN HG3 H -0.402 7.844 1.542 1.00 . A A . 122 GLN HG3 1 1 1 1429 1 1 88 GLN N N -0.916 5.472 -1.823 1.00 . A A . 122 GLN N 1 1 1 1430 1 1 88 GLN NE2 N 0.217 10.071 0.459 1.00 . A A . 122 GLN NE2 1 1 1 1431 1 1 88 GLN O O 1.754 7.239 -0.444 1.00 . A A . 122 GLN O 1 1 1 1432 1 1 88 GLN OE1 O -1.730 10.004 -0.517 1.00 . A A . 122 GLN OE1 1 1 1 1433 1 1 89 MET C C 3.382 4.614 0.027 1.00 . A A . 123 MET C 1 1 1 1434 1 1 89 MET CA C 2.245 4.886 1.014 1.00 . A A . 123 MET CA 1 1 1 1435 1 1 89 MET CB C 2.009 3.652 1.895 1.00 . A A . 123 MET CB 1 1 1 1436 1 1 89 MET CE C 1.137 6.216 4.808 1.00 . A A . 123 MET CE 1 1 1 1437 1 1 89 MET CG C 1.232 3.992 3.165 1.00 . A A . 123 MET CG 1 1 1 1438 1 1 89 MET H H 0.237 4.606 0.335 1.00 . A A . 123 MET H 1 1 1 1439 1 1 89 MET HA H 2.574 5.705 1.654 1.00 . A A . 123 MET HA 1 1 1 1440 1 1 89 MET HB2 H 1.448 2.909 1.334 1.00 . A A . 123 MET HB2 1 1 1 1441 1 1 89 MET HB3 H 2.967 3.215 2.182 1.00 . A A . 123 MET HB3 1 1 1 1442 1 1 89 MET HE1 H 0.153 5.843 5.079 1.00 . A A . 123 MET HE1 1 1 1 1443 1 1 89 MET HE2 H 1.051 6.850 3.925 1.00 . A A . 123 MET HE2 1 1 1 1444 1 1 89 MET HE3 H 1.552 6.797 5.632 1.00 . A A . 123 MET HE3 1 1 1 1445 1 1 89 MET HG2 H 0.380 4.620 2.905 1.00 . A A . 123 MET HG2 1 1 1 1446 1 1 89 MET HG3 H 0.841 3.062 3.574 1.00 . A A . 123 MET HG3 1 1 1 1447 1 1 89 MET N N 1.000 5.279 0.348 1.00 . A A . 123 MET N 1 1 1 1448 1 1 89 MET O O 4.465 5.136 0.235 1.00 . A A . 123 MET O 1 1 1 1449 1 1 89 MET SD S 2.221 4.816 4.446 1.00 . A A . 123 MET SD 1 1 1 1450 1 1 90 CYS C C 4.660 5.031 -2.730 1.00 . A A . 124 CYS C 1 1 1 1451 1 1 90 CYS CA C 4.104 3.713 -2.171 1.00 . A A . 124 CYS CA 1 1 1 1452 1 1 90 CYS CB C 3.415 2.928 -3.297 1.00 . A A . 124 CYS CB 1 1 1 1453 1 1 90 CYS H H 2.201 3.588 -1.241 1.00 . A A . 124 CYS H 1 1 1 1454 1 1 90 CYS HA H 4.939 3.128 -1.782 1.00 . A A . 124 CYS HA 1 1 1 1455 1 1 90 CYS HB2 H 2.598 3.534 -3.685 1.00 . A A . 124 CYS HB2 1 1 1 1456 1 1 90 CYS HB3 H 4.138 2.747 -4.093 1.00 . A A . 124 CYS HB3 1 1 1 1457 1 1 90 CYS HG H 2.335 0.907 -3.955 1.00 . A A . 124 CYS HG 1 1 1 1458 1 1 90 CYS N N 3.134 3.959 -1.106 1.00 . A A . 124 CYS N 1 1 1 1459 1 1 90 CYS O O 5.872 5.223 -2.761 1.00 . A A . 124 CYS O 1 1 1 1460 1 1 90 CYS SG S 2.737 1.336 -2.753 1.00 . A A . 124 CYS SG 1 1 1 1461 1 1 91 THR C C 4.856 8.152 -2.424 1.00 . A A . 125 THR C 1 1 1 1462 1 1 91 THR CA C 4.135 7.334 -3.505 1.00 . A A . 125 THR CA 1 1 1 1463 1 1 91 THR CB C 2.871 8.077 -3.974 1.00 . A A . 125 THR CB 1 1 1 1464 1 1 91 THR CG2 C 3.172 9.459 -4.544 1.00 . A A . 125 THR CG2 1 1 1 1465 1 1 91 THR H H 2.788 5.747 -3.000 1.00 . A A . 125 THR H 1 1 1 1466 1 1 91 THR HA H 4.811 7.244 -4.356 1.00 . A A . 125 THR HA 1 1 1 1467 1 1 91 THR HB H 2.171 8.175 -3.145 1.00 . A A . 125 THR HB 1 1 1 1468 1 1 91 THR HG1 H 1.523 6.838 -4.623 1.00 . A A . 125 THR HG1 1 1 1 1469 1 1 91 THR HG21 H 3.519 10.126 -3.756 1.00 . A A . 125 THR HG21 1 1 1 1470 1 1 91 THR HG22 H 2.264 9.877 -4.979 1.00 . A A . 125 THR HG22 1 1 1 1471 1 1 91 THR HG23 H 3.939 9.384 -5.314 1.00 . A A . 125 THR HG23 1 1 1 1472 1 1 91 THR N N 3.775 5.985 -3.037 1.00 . A A . 125 THR N 1 1 1 1473 1 1 91 THR O O 5.848 8.817 -2.705 1.00 . A A . 125 THR O 1 1 1 1474 1 1 91 THR OG1 O 2.243 7.356 -5.009 1.00 . A A . 125 THR OG1 1 1 1 1475 1 1 92 THR C C 6.498 8.103 0.298 1.00 . A A . 126 THR C 1 1 1 1476 1 1 92 THR CA C 5.115 8.687 -0.018 1.00 . A A . 126 THR CA 1 1 1 1477 1 1 92 THR CB C 4.233 8.592 1.237 1.00 . A A . 126 THR CB 1 1 1 1478 1 1 92 THR CG2 C 4.810 9.331 2.442 1.00 . A A . 126 THR CG2 1 1 1 1479 1 1 92 THR H H 3.662 7.412 -0.976 1.00 . A A . 126 THR H 1 1 1 1480 1 1 92 THR HA H 5.252 9.741 -0.265 1.00 . A A . 126 THR HA 1 1 1 1481 1 1 92 THR HB H 4.100 7.542 1.500 1.00 . A A . 126 THR HB 1 1 1 1482 1 1 92 THR HG1 H 2.574 8.612 0.270 1.00 . A A . 126 THR HG1 1 1 1 1483 1 1 92 THR HG21 H 5.055 10.356 2.162 1.00 . A A . 126 THR HG21 1 1 1 1484 1 1 92 THR HG22 H 5.711 8.828 2.792 1.00 . A A . 126 THR HG22 1 1 1 1485 1 1 92 THR HG23 H 4.079 9.342 3.249 1.00 . A A . 126 THR HG23 1 1 1 1486 1 1 92 THR N N 4.461 8.007 -1.156 1.00 . A A . 126 THR N 1 1 1 1487 1 1 92 THR O O 7.422 8.833 0.649 1.00 . A A . 126 THR O 1 1 1 1488 1 1 92 THR OG1 O 2.960 9.144 0.988 1.00 . A A . 126 THR OG1 1 1 1 1489 1 1 93 GLN C C 8.853 6.517 -0.899 1.00 . A A . 127 GLN C 1 1 1 1490 1 1 93 GLN CA C 7.959 6.119 0.277 1.00 . A A . 127 GLN CA 1 1 1 1491 1 1 93 GLN CB C 7.788 4.593 0.371 1.00 . A A . 127 GLN CB 1 1 1 1492 1 1 93 GLN CD C 8.000 4.277 2.915 1.00 . A A . 127 GLN CD 1 1 1 1493 1 1 93 GLN CG C 7.125 4.122 1.679 1.00 . A A . 127 GLN CG 1 1 1 1494 1 1 93 GLN H H 5.867 6.223 -0.107 1.00 . A A . 127 GLN H 1 1 1 1495 1 1 93 GLN HA H 8.469 6.462 1.177 1.00 . A A . 127 GLN HA 1 1 1 1496 1 1 93 GLN HB2 H 7.182 4.252 -0.470 1.00 . A A . 127 GLN HB2 1 1 1 1497 1 1 93 GLN HB3 H 8.768 4.122 0.290 1.00 . A A . 127 GLN HB3 1 1 1 1498 1 1 93 GLN HE21 H 7.405 6.174 3.277 1.00 . A A . 127 GLN HE21 1 1 1 1499 1 1 93 GLN HE22 H 8.461 5.378 4.460 1.00 . A A . 127 GLN HE22 1 1 1 1500 1 1 93 GLN HG2 H 6.202 4.667 1.856 1.00 . A A . 127 GLN HG2 1 1 1 1501 1 1 93 GLN HG3 H 6.874 3.068 1.575 1.00 . A A . 127 GLN HG3 1 1 1 1502 1 1 93 GLN N N 6.661 6.783 0.181 1.00 . A A . 127 GLN N 1 1 1 1503 1 1 93 GLN NE2 N 7.918 5.384 3.618 1.00 . A A . 127 GLN NE2 1 1 1 1504 1 1 93 GLN O O 9.933 7.024 -0.631 1.00 . A A . 127 GLN O 1 1 1 1505 1 1 93 GLN OE1 O 8.532 3.322 3.443 1.00 . A A . 127 GLN OE1 1 1 1 1506 1 1 94 TYR C C 9.533 8.625 -2.950 1.00 . A A . 128 TYR C 1 1 1 1507 1 1 94 TYR CA C 9.023 7.214 -3.258 1.00 . A A . 128 TYR CA 1 1 1 1508 1 1 94 TYR CB C 8.172 7.227 -4.539 1.00 . A A . 128 TYR CB 1 1 1 1509 1 1 94 TYR CD1 C 9.454 8.724 -6.167 1.00 . A A . 128 TYR CD1 1 1 1 1510 1 1 94 TYR CD2 C 9.422 6.322 -6.533 1.00 . A A . 128 TYR CD2 1 1 1 1511 1 1 94 TYR CE1 C 10.349 8.870 -7.246 1.00 . A A . 128 TYR CE1 1 1 1 1512 1 1 94 TYR CE2 C 10.321 6.457 -7.603 1.00 . A A . 128 TYR CE2 1 1 1 1513 1 1 94 TYR CG C 9.005 7.440 -5.793 1.00 . A A . 128 TYR CG 1 1 1 1514 1 1 94 TYR CZ C 10.806 7.735 -7.945 1.00 . A A . 128 TYR CZ 1 1 1 1515 1 1 94 TYR H H 7.383 6.240 -2.284 1.00 . A A . 128 TYR H 1 1 1 1516 1 1 94 TYR HA H 9.901 6.594 -3.449 1.00 . A A . 128 TYR HA 1 1 1 1517 1 1 94 TYR HB2 H 7.647 6.275 -4.625 1.00 . A A . 128 TYR HB2 1 1 1 1518 1 1 94 TYR HB3 H 7.424 8.015 -4.482 1.00 . A A . 128 TYR HB3 1 1 1 1519 1 1 94 TYR HD1 H 9.177 9.592 -5.586 1.00 . A A . 128 TYR HD1 1 1 1 1520 1 1 94 TYR HD2 H 9.102 5.344 -6.229 1.00 . A A . 128 TYR HD2 1 1 1 1521 1 1 94 TYR HE1 H 10.768 9.838 -7.485 1.00 . A A . 128 TYR HE1 1 1 1 1522 1 1 94 TYR HE2 H 10.665 5.584 -8.134 1.00 . A A . 128 TYR HE2 1 1 1 1523 1 1 94 TYR HH H 12.319 7.093 -8.954 1.00 . A A . 128 TYR HH 1 1 1 1524 1 1 94 TYR N N 8.307 6.623 -2.121 1.00 . A A . 128 TYR N 1 1 1 1525 1 1 94 TYR O O 10.715 8.869 -3.129 1.00 . A A . 128 TYR O 1 1 1 1526 1 1 94 TYR OH O 11.747 7.864 -8.912 1.00 . A A . 128 TYR OH 1 1 1 1527 1 1 95 GLN C C 10.383 10.839 -1.021 1.00 . A A . 129 GLN C 1 1 1 1528 1 1 95 GLN CA C 9.167 10.850 -1.965 1.00 . A A . 129 GLN CA 1 1 1 1529 1 1 95 GLN CB C 7.990 11.616 -1.339 1.00 . A A . 129 GLN CB 1 1 1 1530 1 1 95 GLN CD C 7.179 13.873 -0.446 1.00 . A A . 129 GLN CD 1 1 1 1531 1 1 95 GLN CG C 8.314 13.102 -1.116 1.00 . A A . 129 GLN CG 1 1 1 1532 1 1 95 GLN H H 7.749 9.256 -2.224 1.00 . A A . 129 GLN H 1 1 1 1533 1 1 95 GLN HA H 9.472 11.372 -2.874 1.00 . A A . 129 GLN HA 1 1 1 1534 1 1 95 GLN HB2 H 7.124 11.541 -1.999 1.00 . A A . 129 GLN HB2 1 1 1 1535 1 1 95 GLN HB3 H 7.734 11.166 -0.380 1.00 . A A . 129 GLN HB3 1 1 1 1536 1 1 95 GLN HE21 H 8.260 15.577 -0.367 1.00 . A A . 129 GLN HE21 1 1 1 1537 1 1 95 GLN HE22 H 6.625 15.614 0.302 1.00 . A A . 129 GLN HE22 1 1 1 1538 1 1 95 GLN HG2 H 9.199 13.197 -0.486 1.00 . A A . 129 GLN HG2 1 1 1 1539 1 1 95 GLN HG3 H 8.532 13.569 -2.077 1.00 . A A . 129 GLN HG3 1 1 1 1540 1 1 95 GLN N N 8.724 9.502 -2.343 1.00 . A A . 129 GLN N 1 1 1 1541 1 1 95 GLN NE2 N 7.379 15.140 -0.158 1.00 . A A . 129 GLN NE2 1 1 1 1542 1 1 95 GLN O O 11.364 11.533 -1.283 1.00 . A A . 129 GLN O 1 1 1 1543 1 1 95 GLN OE1 O 6.116 13.364 -0.129 1.00 . A A . 129 GLN OE1 1 1 1 1544 1 1 96 LYS C C 12.681 9.272 0.462 1.00 . A A . 130 LYS C 1 1 1 1545 1 1 96 LYS CA C 11.432 9.946 1.036 1.00 . A A . 130 LYS CA 1 1 1 1546 1 1 96 LYS CB C 10.921 9.206 2.282 1.00 . A A . 130 LYS CB 1 1 1 1547 1 1 96 LYS CD C 11.483 8.427 4.625 1.00 . A A . 130 LYS CD 1 1 1 1548 1 1 96 LYS CE C 12.641 8.327 5.623 1.00 . A A . 130 LYS CE 1 1 1 1549 1 1 96 LYS CG C 11.994 9.151 3.379 1.00 . A A . 130 LYS CG 1 1 1 1550 1 1 96 LYS H H 9.523 9.449 0.167 1.00 . A A . 130 LYS H 1 1 1 1551 1 1 96 LYS HA H 11.738 10.955 1.320 1.00 . A A . 130 LYS HA 1 1 1 1552 1 1 96 LYS HB2 H 10.043 9.728 2.667 1.00 . A A . 130 LYS HB2 1 1 1 1553 1 1 96 LYS HB3 H 10.631 8.190 2.007 1.00 . A A . 130 LYS HB3 1 1 1 1554 1 1 96 LYS HD2 H 10.655 8.992 5.058 1.00 . A A . 130 LYS HD2 1 1 1 1555 1 1 96 LYS HD3 H 11.144 7.427 4.345 1.00 . A A . 130 LYS HD3 1 1 1 1556 1 1 96 LYS HE2 H 13.478 7.817 5.132 1.00 . A A . 130 LYS HE2 1 1 1 1557 1 1 96 LYS HE3 H 12.970 9.341 5.874 1.00 . A A . 130 LYS HE3 1 1 1 1558 1 1 96 LYS HG2 H 12.870 8.615 3.009 1.00 . A A . 130 LYS HG2 1 1 1 1559 1 1 96 LYS HG3 H 12.290 10.167 3.647 1.00 . A A . 130 LYS HG3 1 1 1 1560 1 1 96 LYS HZ1 H 12.112 6.611 6.620 1.00 . A A . 130 LYS HZ1 1 1 1 1561 1 1 96 LYS HZ2 H 11.390 7.971 7.222 1.00 . A A . 130 LYS HZ2 1 1 1 1562 1 1 96 LYS HZ3 H 12.978 7.661 7.540 1.00 . A A . 130 LYS HZ3 1 1 1 1563 1 1 96 LYS N N 10.340 10.039 0.053 1.00 . A A . 130 LYS N 1 1 1 1564 1 1 96 LYS NZ N 12.246 7.590 6.844 1.00 . A A . 130 LYS NZ 1 1 1 1565 1 1 96 LYS O O 13.777 9.803 0.605 1.00 . A A . 130 LYS O 1 1 1 1566 1 1 97 GLU C C 14.249 8.146 -1.973 1.00 . A A . 131 GLU C 1 1 1 1567 1 1 97 GLU CA C 13.600 7.371 -0.814 1.00 . A A . 131 GLU CA 1 1 1 1568 1 1 97 GLU CB C 13.061 6.022 -1.322 1.00 . A A . 131 GLU CB 1 1 1 1569 1 1 97 GLU CD C 13.527 4.491 0.695 1.00 . A A . 131 GLU CD 1 1 1 1570 1 1 97 GLU CG C 12.476 5.089 -0.248 1.00 . A A . 131 GLU CG 1 1 1 1571 1 1 97 GLU H H 11.570 7.767 -0.293 1.00 . A A . 131 GLU H 1 1 1 1572 1 1 97 GLU HA H 14.374 7.179 -0.067 1.00 . A A . 131 GLU HA 1 1 1 1573 1 1 97 GLU HB2 H 12.270 6.229 -2.043 1.00 . A A . 131 GLU HB2 1 1 1 1574 1 1 97 GLU HB3 H 13.858 5.492 -1.844 1.00 . A A . 131 GLU HB3 1 1 1 1575 1 1 97 GLU HG2 H 11.737 5.621 0.350 1.00 . A A . 131 GLU HG2 1 1 1 1576 1 1 97 GLU HG3 H 11.945 4.284 -0.762 1.00 . A A . 131 GLU HG3 1 1 1 1577 1 1 97 GLU N N 12.509 8.138 -0.207 1.00 . A A . 131 GLU N 1 1 1 1578 1 1 97 GLU O O 15.464 8.134 -2.102 1.00 . A A . 131 GLU O 1 1 1 1579 1 1 97 GLU OE1 O 13.722 5.128 1.756 1.00 . A A . 131 GLU OE1 1 1 1 1580 1 1 97 GLU OE2 O 13.727 3.257 0.582 1.00 . A A . 131 GLU OE2 1 1 1 1581 1 1 98 SER C C 14.691 10.995 -3.333 1.00 . A A . 132 SER C 1 1 1 1582 1 1 98 SER CA C 13.950 9.765 -3.852 1.00 . A A . 132 SER CA 1 1 1 1583 1 1 98 SER CB C 12.760 10.202 -4.717 1.00 . A A . 132 SER CB 1 1 1 1584 1 1 98 SER H H 12.470 8.860 -2.605 1.00 . A A . 132 SER H 1 1 1 1585 1 1 98 SER HA H 14.640 9.203 -4.481 1.00 . A A . 132 SER HA 1 1 1 1586 1 1 98 SER HB2 H 12.235 9.307 -5.053 1.00 . A A . 132 SER HB2 1 1 1 1587 1 1 98 SER HB3 H 12.079 10.804 -4.112 1.00 . A A . 132 SER HB3 1 1 1 1588 1 1 98 SER HG H 13.634 11.717 -5.595 1.00 . A A . 132 SER HG 1 1 1 1589 1 1 98 SER N N 13.471 8.899 -2.760 1.00 . A A . 132 SER N 1 1 1 1590 1 1 98 SER O O 15.660 11.421 -3.955 1.00 . A A . 132 SER O 1 1 1 1591 1 1 98 SER OG O 13.128 10.943 -5.864 1.00 . A A . 132 SER OG 1 1 1 1592 1 1 99 GLN C C 16.387 12.001 -0.997 1.00 . A A . 133 GLN C 1 1 1 1593 1 1 99 GLN CA C 15.053 12.579 -1.495 1.00 . A A . 133 GLN CA 1 1 1 1594 1 1 99 GLN CB C 14.228 13.163 -0.337 1.00 . A A . 133 GLN CB 1 1 1 1595 1 1 99 GLN CD C 14.319 14.702 1.660 1.00 . A A . 133 GLN CD 1 1 1 1596 1 1 99 GLN CG C 14.881 14.411 0.275 1.00 . A A . 133 GLN CG 1 1 1 1597 1 1 99 GLN H H 13.433 11.208 -1.749 1.00 . A A . 133 GLN H 1 1 1 1598 1 1 99 GLN HA H 15.285 13.383 -2.196 1.00 . A A . 133 GLN HA 1 1 1 1599 1 1 99 GLN HB2 H 13.236 13.439 -0.698 1.00 . A A . 133 GLN HB2 1 1 1 1600 1 1 99 GLN HB3 H 14.112 12.403 0.436 1.00 . A A . 133 GLN HB3 1 1 1 1601 1 1 99 GLN HE21 H 16.032 14.148 2.571 1.00 . A A . 133 GLN HE21 1 1 1 1602 1 1 99 GLN HE22 H 14.699 14.666 3.602 1.00 . A A . 133 GLN HE22 1 1 1 1603 1 1 99 GLN HG2 H 15.959 14.272 0.360 1.00 . A A . 133 GLN HG2 1 1 1 1604 1 1 99 GLN HG3 H 14.705 15.271 -0.372 1.00 . A A . 133 GLN HG3 1 1 1 1605 1 1 99 GLN N N 14.270 11.560 -2.195 1.00 . A A . 133 GLN N 1 1 1 1606 1 1 99 GLN NE2 N 15.070 14.429 2.705 1.00 . A A . 133 GLN NE2 1 1 1 1607 1 1 99 GLN O O 17.423 12.575 -1.296 1.00 . A A . 133 GLN O 1 1 1 1608 1 1 99 GLN OE1 O 13.169 15.074 1.840 1.00 . A A . 133 GLN OE1 1 1 1 1609 1 1 100 ALA C C 18.556 9.754 -1.076 1.00 . A A . 134 ALA C 1 1 1 1610 1 1 100 ALA CA C 17.614 10.154 0.078 1.00 . A A . 134 ALA CA 1 1 1 1611 1 1 100 ALA CB C 17.223 8.942 0.931 1.00 . A A . 134 ALA CB 1 1 1 1612 1 1 100 ALA H H 15.502 10.367 -0.176 1.00 . A A . 134 ALA H 1 1 1 1613 1 1 100 ALA HA H 18.171 10.848 0.711 1.00 . A A . 134 ALA HA 1 1 1 1614 1 1 100 ALA HB1 H 18.129 8.461 1.306 1.00 . A A . 134 ALA HB1 1 1 1 1615 1 1 100 ALA HB2 H 16.661 8.224 0.333 1.00 . A A . 134 ALA HB2 1 1 1 1616 1 1 100 ALA HB3 H 16.617 9.265 1.777 1.00 . A A . 134 ALA HB3 1 1 1 1617 1 1 100 ALA N N 16.386 10.816 -0.376 1.00 . A A . 134 ALA N 1 1 1 1618 1 1 100 ALA O O 19.741 10.044 -1.016 1.00 . A A . 134 ALA O 1 1 1 1619 1 1 101 TYR C C 19.434 10.236 -4.060 1.00 . A A . 135 TYR C 1 1 1 1620 1 1 101 TYR CA C 18.778 8.993 -3.425 1.00 . A A . 135 TYR CA 1 1 1 1621 1 1 101 TYR CB C 17.838 8.290 -4.417 1.00 . A A . 135 TYR CB 1 1 1 1622 1 1 101 TYR CD1 C 19.488 7.035 -5.868 1.00 . A A . 135 TYR CD1 1 1 1 1623 1 1 101 TYR CD2 C 18.091 8.752 -6.895 1.00 . A A . 135 TYR CD2 1 1 1 1624 1 1 101 TYR CE1 C 20.162 6.848 -7.090 1.00 . A A . 135 TYR CE1 1 1 1 1625 1 1 101 TYR CE2 C 18.760 8.565 -8.120 1.00 . A A . 135 TYR CE2 1 1 1 1626 1 1 101 TYR CG C 18.464 7.996 -5.766 1.00 . A A . 135 TYR CG 1 1 1 1627 1 1 101 TYR CZ C 19.806 7.624 -8.214 1.00 . A A . 135 TYR CZ 1 1 1 1628 1 1 101 TYR H H 17.032 9.049 -2.193 1.00 . A A . 135 TYR H 1 1 1 1629 1 1 101 TYR HA H 19.590 8.310 -3.170 1.00 . A A . 135 TYR HA 1 1 1 1630 1 1 101 TYR HB2 H 17.508 7.350 -3.975 1.00 . A A . 135 TYR HB2 1 1 1 1631 1 1 101 TYR HB3 H 16.957 8.915 -4.567 1.00 . A A . 135 TYR HB3 1 1 1 1632 1 1 101 TYR HD1 H 19.798 6.486 -4.989 1.00 . A A . 135 TYR HD1 1 1 1 1633 1 1 101 TYR HD2 H 17.327 9.511 -6.810 1.00 . A A . 135 TYR HD2 1 1 1 1634 1 1 101 TYR HE1 H 20.974 6.142 -7.152 1.00 . A A . 135 TYR HE1 1 1 1 1635 1 1 101 TYR HE2 H 18.504 9.156 -8.984 1.00 . A A . 135 TYR HE2 1 1 1 1636 1 1 101 TYR HH H 21.129 6.779 -9.319 1.00 . A A . 135 TYR HH 1 1 1 1637 1 1 101 TYR N N 18.016 9.285 -2.204 1.00 . A A . 135 TYR N 1 1 1 1638 1 1 101 TYR O O 20.449 10.118 -4.742 1.00 . A A . 135 TYR O 1 1 1 1639 1 1 101 TYR OH O 20.479 7.477 -9.385 1.00 . A A . 135 TYR OH 1 1 1 1640 1 1 102 TYR C C 20.529 13.168 -3.154 1.00 . A A . 136 TYR C 1 1 1 1641 1 1 102 TYR CA C 19.486 12.703 -4.197 1.00 . A A . 136 TYR CA 1 1 1 1642 1 1 102 TYR CB C 18.358 13.734 -4.374 1.00 . A A . 136 TYR CB 1 1 1 1643 1 1 102 TYR CD1 C 19.186 16.038 -3.738 1.00 . A A . 136 TYR CD1 1 1 1 1644 1 1 102 TYR CD2 C 18.869 15.518 -6.101 1.00 . A A . 136 TYR CD2 1 1 1 1645 1 1 102 TYR CE1 C 19.638 17.327 -4.078 1.00 . A A . 136 TYR CE1 1 1 1 1646 1 1 102 TYR CE2 C 19.317 16.807 -6.447 1.00 . A A . 136 TYR CE2 1 1 1 1647 1 1 102 TYR CG C 18.810 15.131 -4.748 1.00 . A A . 136 TYR CG 1 1 1 1648 1 1 102 TYR CZ C 19.709 17.711 -5.433 1.00 . A A . 136 TYR CZ 1 1 1 1649 1 1 102 TYR H H 18.015 11.452 -3.298 1.00 . A A . 136 TYR H 1 1 1 1650 1 1 102 TYR HA H 20.009 12.598 -5.148 1.00 . A A . 136 TYR HA 1 1 1 1651 1 1 102 TYR HB2 H 17.675 13.370 -5.143 1.00 . A A . 136 TYR HB2 1 1 1 1652 1 1 102 TYR HB3 H 17.787 13.803 -3.450 1.00 . A A . 136 TYR HB3 1 1 1 1653 1 1 102 TYR HD1 H 19.182 15.723 -2.701 1.00 . A A . 136 TYR HD1 1 1 1 1654 1 1 102 TYR HD2 H 18.593 14.810 -6.870 1.00 . A A . 136 TYR HD2 1 1 1 1655 1 1 102 TYR HE1 H 19.971 18.005 -3.308 1.00 . A A . 136 TYR HE1 1 1 1 1656 1 1 102 TYR HE2 H 19.379 17.093 -7.483 1.00 . A A . 136 TYR HE2 1 1 1 1657 1 1 102 TYR HH H 20.226 19.044 -6.715 1.00 . A A . 136 TYR HH 1 1 1 1658 1 1 102 TYR N N 18.861 11.424 -3.848 1.00 . A A . 136 TYR N 1 1 1 1659 1 1 102 TYR O O 21.482 13.853 -3.519 1.00 . A A . 136 TYR O 1 1 1 1660 1 1 102 TYR OH O 20.159 18.949 -5.767 1.00 . A A . 136 TYR OH 1 1 1 1661 1 1 103 ASP C C 22.460 12.482 -0.594 1.00 . A A . 137 ASP C 1 1 1 1662 1 1 103 ASP CA C 21.137 13.279 -0.723 1.00 . A A . 137 ASP CA 1 1 1 1663 1 1 103 ASP CB C 20.265 13.141 0.547 1.00 . A A . 137 ASP CB 1 1 1 1664 1 1 103 ASP CG C 20.646 14.068 1.710 1.00 . A A . 137 ASP CG 1 1 1 1665 1 1 103 ASP H H 19.491 12.313 -1.654 1.00 . A A . 137 ASP H 1 1 1 1666 1 1 103 ASP HA H 21.395 14.331 -0.853 1.00 . A A . 137 ASP HA 1 1 1 1667 1 1 103 ASP HB2 H 19.234 13.387 0.295 1.00 . A A . 137 ASP HB2 1 1 1 1668 1 1 103 ASP HB3 H 20.277 12.102 0.880 1.00 . A A . 137 ASP HB3 1 1 1 1669 1 1 103 ASP N N 20.314 12.856 -1.871 1.00 . A A . 137 ASP N 1 1 1 1670 1 1 103 ASP O O 23.519 13.093 -0.427 1.00 . A A . 137 ASP O 1 1 1 1671 1 1 103 ASP OD1 O 20.593 15.295 1.457 1.00 . A A . 137 ASP OD1 1 1 1 1672 1 1 103 ASP OD2 O 20.406 13.624 2.859 1.00 . A A . 137 ASP OD2 1 1 1 1673 1 1 104 GLY C C 23.384 8.850 -0.289 1.00 . A A . 138 GLY C 1 1 1 1674 1 1 104 GLY CA C 23.587 10.249 -0.880 1.00 . A A . 138 GLY CA 1 1 1 1675 1 1 104 GLY H H 21.506 10.724 -0.901 1.00 . A A . 138 GLY H 1 1 1 1676 1 1 104 GLY HA2 H 23.848 10.109 -1.927 1.00 . A A . 138 GLY HA2 1 1 1 1677 1 1 104 GLY HA3 H 24.436 10.697 -0.372 1.00 . A A . 138 GLY HA3 1 1 1 1678 1 1 104 GLY N N 22.420 11.154 -0.805 1.00 . A A . 138 GLY N 1 1 1 1679 1 1 104 GLY O O 24.099 7.947 -0.780 1.00 . A A . 138 GLY O 1 1 1 1680 1 1 104 GLY OXT O 22.760 8.743 0.789 1.00 . A A . 138 GLY OXT 1 1 1 1681 2 2 1 VIB C2 C -11.657 10.250 6.774 1.00 . B A . 1 VIB C2 1 1 1 1682 2 2 1 VIB C2A C -8.388 6.112 8.154 1.00 . B A . 1 VIB C2A 1 1 1 1683 2 2 1 VIB C4 C -13.730 9.511 6.170 1.00 . B A . 1 VIB C4 1 1 1 1684 2 2 1 VIB C4A C -10.299 7.285 8.723 1.00 . B A . 1 VIB C4A 1 1 1 1685 2 2 1 VIB C5 C -13.633 10.606 5.355 1.00 . B A . 1 VIB C5 1 1 1 1686 2 2 1 VIB C5A C -10.718 7.310 7.390 1.00 . B A . 1 VIB C5A 1 1 1 1687 2 2 1 VIB C6 C -14.256 10.583 3.969 1.00 . B A . 1 VIB C6 1 1 1 1688 2 2 1 VIB C6A C -9.867 6.692 6.472 1.00 . B A . 1 VIB C6A 1 1 1 1689 2 2 1 VIB C7 C -15.671 11.183 3.971 1.00 . B A . 1 VIB C7 1 1 1 1690 2 2 1 VIB C7A C -12.128 7.737 6.975 1.00 . B A . 1 VIB C7A 1 1 1 1691 2 2 1 VIB CM2 C -7.150 5.345 8.587 1.00 . B A . 1 VIB CM2 1 1 1 1692 2 2 1 VIB CM4 C -15.034 9.452 6.915 1.00 . B A . 1 VIB CM4 1 1 1 1693 2 2 1 VIB H4A1 H -10.514 8.115 10.530 1.00 . B A . 1 VIB H4A1 1 1 1 1694 2 2 1 VIB H4A2 H -11.706 8.558 9.351 1.00 . B A . 1 VIB H4A2 1 1 1 1695 2 2 1 VIB H6AC H -10.114 6.628 5.413 1.00 . B A . 1 VIB H6AC 1 1 1 1696 2 2 1 VIB H7A1 H -12.811 7.344 7.723 1.00 . B A . 1 VIB H7A1 1 1 1 1697 2 2 1 VIB H7A2 H -12.338 7.205 6.046 1.00 . B A . 1 VIB H7A2 1 1 1 1698 2 2 1 VIB HC2 H -10.672 10.239 7.213 1.00 . B A . 1 VIB HC2 1 1 1 1699 2 2 1 VIB HC61 H -13.658 11.136 3.246 1.00 . B A . 1 VIB HC61 1 1 1 1700 2 2 1 VIB HC62 H -14.319 9.553 3.604 1.00 . B A . 1 VIB HC62 1 1 1 1701 2 2 1 VIB HC71 H -16.167 10.950 3.022 1.00 . B A . 1 VIB HC71 1 1 1 1702 2 2 1 VIB HC72 H -16.277 10.759 4.776 1.00 . B A . 1 VIB HC72 1 1 1 1703 2 2 1 VIB HM21 H -6.380 5.376 7.815 1.00 . B A . 1 VIB HM21 1 1 1 1704 2 2 1 VIB HM22 H -6.724 5.761 9.501 1.00 . B A . 1 VIB HM22 1 1 1 1705 2 2 1 VIB HM23 H -7.405 4.300 8.778 1.00 . B A . 1 VIB HM23 1 1 1 1706 2 2 1 VIB HM41 H -14.951 8.882 7.840 1.00 . B A . 1 VIB HM41 1 1 1 1707 2 2 1 VIB HM42 H -15.348 10.461 7.195 1.00 . B A . 1 VIB HM42 1 1 1 1708 2 2 1 VIB HM43 H -15.831 9.040 6.295 1.00 . B A . 1 VIB HM43 1 1 1 1709 2 2 1 VIB HO1 H -16.478 12.954 4.116 1.00 . B A . 1 VIB HO1 1 1 1 1710 2 2 1 VIB N1A N -8.682 6.156 6.837 1.00 . B A . 1 VIB N1A 1 1 1 1711 2 2 1 VIB N3 N -12.497 9.155 6.734 1.00 . B A . 1 VIB N3 1 1 1 1712 2 2 1 VIB N3A N -9.162 6.666 9.113 1.00 . B A . 1 VIB N3A 1 1 1 1713 2 2 1 VIB N4A N -11.036 7.878 9.697 1.00 . B A . 1 VIB N4A 1 1 1 1714 2 2 1 VIB O1 O -15.568 12.601 4.109 1.00 . B A . 1 VIB O1 1 1 1 1715 2 2 1 VIB S1 S -12.241 11.511 5.753 1.00 . B A . 1 VIB S1 1 1 stop_ save_
Contact the webmaster for help, if required. Monday, June 3, 2024 11:50:10 AM GMT (wattos1)