NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
585717 | 2mie | 19675 | cing | 4-filtered-FRED | STAR | entry | full | 65 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mie # This FRED archive file contains, for PDB entry <2mie>: # # - 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_2mie _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mie _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1247.31 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 $CLAVATA3_ESR__CLE__related_protein_44 A . 1 1 stop_ save_ save_CLAVATA3_ESR__CLE__related_protein_44 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "CLAVATA3 ESR CLE related protein 44" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HEVPSGPNPISN _Entity.Number_of_monomers 12 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 HIS . 1 1 2 GLU . 1 1 3 VAL . 1 1 4 PRO . 1 1 5 SER . 1 1 6 GLY . 1 1 7 PRO . 1 1 8 ASN . 1 1 9 PRO . 1 1 10 ILE . 1 1 11 SER . 1 1 12 ASN . 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 HIS 1 1 1 1 GLU 2 2 1 1 VAL 3 3 1 1 PRO 4 4 1 1 SER 5 5 1 1 GLY 6 6 1 1 PRO 7 7 1 1 ASN 8 8 1 1 PRO 9 9 1 1 ILE 10 10 1 1 SER 11 11 1 1 ASN 12 12 1 1 stop_ 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 6 1 . . . 1 1 7 1 2 . OR 1 1 7 2 . 3 . 1 1 7 3 . . . 1 1 8 1 . . . 1 1 9 1 2 . OR 1 1 9 2 . 3 . 1 1 9 3 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 2 . OR 1 1 18 2 . 3 . 1 1 18 3 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 2 . OR 1 1 24 2 . 3 . 1 1 24 3 . . . 1 1 25 1 2 . OR 1 1 25 2 . 3 . 1 1 25 3 . 4 . 1 1 25 4 . . . 1 1 26 1 2 . OR 1 1 26 2 . 3 . 1 1 26 3 . . . 1 1 27 1 . . . 1 1 28 1 2 . OR 1 1 28 2 . 3 . 1 1 28 3 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 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 1 HIS H1 . 1 . HT1 1 1 1 1 2 1 1 1 HIS HB2 . 1 . HB2 1 1 2 1 1 1 1 1 HIS H1 . 1 . HT1 1 1 2 1 2 1 1 1 HIS HB3 . 1 . HB1 1 1 3 1 1 1 1 1 HIS H1 . 1 . HT1 1 1 3 1 2 1 1 9 PRO QG . 9 . HG1 1 1 4 1 1 1 1 2 GLU H . 2 . HN 1 1 4 1 2 1 1 2 GLU HB2 . 2 . HB2 1 1 5 1 1 1 1 2 GLU H . 2 . HN 1 1 5 1 2 1 1 2 GLU HB3 . 2 . HB1 1 1 6 1 1 1 1 2 GLU H . 2 . HN 1 1 6 1 2 1 1 4 PRO HB3 . 4 . HB2 1 1 6 1 2 1 1 9 PRO HB3 . 9 . HB1 1 1 7 2 1 1 1 2 GLU HA . 2 . HA 1 1 7 2 2 1 1 2 GLU HB3 . 2 . HB1 1 1 7 3 1 1 1 5 SER HA . 5 . HA 1 1 7 3 2 1 1 9 PRO QG . 9 . HG2 1 1 8 1 1 1 1 2 GLU HA . 2 . HA 1 1 8 1 1 1 1 3 VAL HA . 3 . HA 1 1 8 1 2 1 1 3 VAL H . 3 . HN 1 1 9 2 1 1 1 2 GLU HA . 2 . HA 1 1 9 2 1 1 1 3 VAL HA . 3 . HA 1 1 9 2 2 1 1 3 VAL H . 3 . HN 1 1 9 3 1 1 1 7 PRO HA . 7 . HA 1 1 9 3 2 1 1 8 ASN H . 8 . HN 1 1 10 1 1 1 1 2 GLU HB2 . 2 . HB2 1 1 10 1 2 1 1 2 GLU QG . 2 . HG1 1 1 11 1 1 1 1 2 GLU HB2 . 2 . HB2 1 1 11 1 1 1 1 3 VAL HB . 3 . HB 1 1 11 1 2 1 1 2 GLU QG . 2 . HG2 1 1 12 1 1 1 1 2 GLU QG . 2 . HG2 1 1 12 1 2 1 1 3 VAL HB . 3 . HB 1 1 13 1 1 1 1 2 GLU QG . 2 . HG1 1 1 13 1 2 1 1 4 PRO HG3 . 4 . HG2 1 1 14 1 1 1 1 3 VAL H . 3 . HN 1 1 14 1 2 1 1 3 VAL HB . 3 . HB 1 1 15 1 1 1 1 3 VAL H . 3 . HN 1 1 15 1 2 1 1 4 PRO HA . 4 . HA 1 1 16 1 1 1 1 3 VAL H . 3 . HN 1 1 16 1 2 1 1 4 PRO HG2 . 4 . HG1 1 1 17 1 1 1 1 3 VAL H . 3 . HN 1 1 17 1 2 1 1 4 PRO HG3 . 4 . HG2 1 1 18 2 1 1 1 3 VAL HA . 3 . HA 1 1 18 2 1 1 1 9 PRO HA . 9 . HA 1 1 18 2 1 1 1 11 SER HA . 11 . HA 1 1 18 2 2 1 1 10 ILE H . 10 . HN 1 1 18 3 1 1 1 4 PRO HA . 4 . HA 1 1 18 3 2 1 1 6 GLY H . 6 . HN 1 1 19 1 1 1 1 3 VAL HA . 3 . HA 1 1 19 1 1 1 1 5 SER HA . 5 . HA 1 1 19 1 2 1 1 5 SER H . 5 . HN 1 1 20 1 1 1 1 3 VAL HA . 3 . HA 1 1 20 1 1 1 1 9 PRO HA . 9 . HA 1 1 20 1 2 1 1 9 PRO HB2 . 9 . HB2 1 1 21 1 1 1 1 3 VAL HA . 3 . HA 1 1 21 1 1 1 1 9 PRO HA . 9 . HA 1 1 21 1 1 1 1 11 SER HA . 11 . HA 1 1 21 1 2 1 1 10 ILE H . 10 . HN 1 1 22 1 1 1 1 3 VAL HB . 3 . HB 1 1 22 1 2 1 1 3 VAL MG1 . 3 . HG11 1 1 23 1 1 1 1 3 VAL HB . 3 . HB 1 1 23 1 2 1 1 3 VAL MG2 . 3 . HG21 1 1 24 2 1 1 1 4 PRO HA . 4 . HA 1 1 24 2 2 1 1 4 PRO HB3 . 4 . HB2 1 1 24 3 1 1 1 7 PRO HA . 7 . HA 1 1 24 3 2 1 1 7 PRO HB2 . 7 . HB2 1 1 25 2 1 1 1 4 PRO HA . 4 . HA 1 1 25 2 2 1 1 4 PRO HB3 . 4 . HB2 1 1 25 3 1 1 1 7 PRO HA . 7 . HA 1 1 25 3 2 1 1 7 PRO HB2 . 7 . HB2 1 1 25 4 1 1 1 9 PRO HA . 9 . HA 1 1 25 4 2 1 1 9 PRO HB3 . 9 . HB1 1 1 26 2 1 1 1 4 PRO HB3 . 4 . HB2 1 1 26 2 2 1 1 4 PRO HG2 . 4 . HG1 1 1 26 3 1 1 1 9 PRO HB3 . 9 . HB1 1 1 26 3 2 1 1 9 PRO QG . 9 . HG2 1 1 27 1 1 1 1 4 PRO HB3 . 4 . HB2 1 1 27 1 2 1 1 4 PRO HG3 . 4 . HG2 1 1 28 2 1 1 1 4 PRO HB3 . 4 . HB2 1 1 28 2 2 1 1 4 PRO HG3 . 4 . HG2 1 1 28 3 1 1 1 7 PRO HB2 . 7 . HB2 1 1 28 3 2 1 1 7 PRO HG3 . 7 . HG1 1 1 29 1 1 1 1 4 PRO QD . 4 . HD2 1 1 29 1 2 1 1 4 PRO HG2 . 4 . HG1 1 1 30 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 30 1 2 1 1 6 GLY HA2 . 6 . HA2 1 1 31 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 31 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 32 1 1 1 1 4 PRO HD3 . 4 . HD1 1 1 32 1 2 1 1 7 PRO HG2 . 7 . HG2 1 1 33 1 1 1 1 4 PRO HG2 . 4 . HG1 1 1 33 1 2 1 1 6 GLY H . 6 . HN 1 1 34 1 1 1 1 4 PRO HG2 . 4 . HG1 1 1 34 1 2 1 1 7 PRO HD2 . 7 . HD2 1 1 35 1 1 1 1 5 SER H . 5 . HN 1 1 35 1 2 1 1 5 SER HA . 5 . HA 1 1 36 1 1 1 1 5 SER H . 5 . HN 1 1 36 1 2 1 1 5 SER HB2 . 5 . HB2 1 1 36 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 37 1 1 1 1 5 SER H . 5 . HN 1 1 37 1 2 1 1 9 PRO HB2 . 9 . HB2 1 1 38 1 1 1 1 5 SER H . 5 . HN 1 1 38 1 2 1 1 9 PRO QG . 9 . HG2 1 1 39 1 1 1 1 5 SER HA . 5 . HA 1 1 39 1 2 1 1 5 SER HB2 . 5 . HB2 1 1 39 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 40 1 1 1 1 5 SER HA . 5 . HA 1 1 40 1 2 1 1 6 GLY H . 6 . HN 1 1 41 1 1 1 1 5 SER HA . 5 . HA 1 1 41 1 2 1 1 6 GLY H . 6 . HN 1 1 41 1 2 1 1 10 ILE H . 10 . HN 1 1 42 1 1 1 1 5 SER HA . 5 . HA 1 1 42 1 1 1 1 9 PRO HA . 9 . HA 1 1 42 1 2 1 1 10 ILE H . 10 . HN 1 1 43 1 1 1 1 5 SER HA . 5 . HA 1 1 43 1 2 1 1 11 SER H . 11 . HN 1 1 44 1 1 1 1 5 SER HA . 5 . HA 1 1 44 1 2 1 1 11 SER HB2 . 11 . HB2 1 1 45 1 1 1 1 6 GLY H . 6 . HN 1 1 45 1 2 1 1 6 GLY QA . 6 . HA2 1 1 46 1 1 1 1 6 GLY H . 6 . HN 1 1 46 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 47 1 1 1 1 6 GLY H . 6 . HN 1 1 47 1 1 1 1 10 ILE H . 10 . HN 1 1 47 1 2 1 1 9 PRO HB3 . 9 . HB1 1 1 48 1 1 1 1 6 GLY QA . 6 . HA2 1 1 48 1 2 1 1 10 ILE H . 10 . HN 1 1 49 1 1 1 1 7 PRO HA . 7 . HA 1 1 49 1 2 1 1 8 ASN H . 8 . HN 1 1 50 1 1 1 1 7 PRO HB2 . 7 . HB2 1 1 50 1 2 1 1 8 ASN H . 8 . HN 1 1 51 1 1 1 1 8 ASN H . 8 . HN 1 1 51 1 2 1 1 8 ASN HA . 8 . HA 1 1 52 1 1 1 1 8 ASN H . 8 . HN 1 1 52 1 2 1 1 8 ASN QB . 8 . HB1 1 1 53 1 1 1 1 8 ASN H . 8 . HN 1 1 53 1 2 1 1 8 ASN QB . 8 . HB2 1 1 53 1 2 1 1 12 ASN QB . 12 . HB2 1 1 54 1 1 1 1 8 ASN HA . 8 . HA 1 1 54 1 2 1 1 8 ASN QB . 8 . HB1 1 1 55 1 1 1 1 8 ASN HA . 8 . HA 1 1 55 1 2 1 1 8 ASN QB . 8 . HB2 1 1 55 1 2 1 1 12 ASN QB . 12 . HB2 1 1 56 1 1 1 1 8 ASN QB . 8 . HB1 1 1 56 1 2 1 1 12 ASN QB . 12 . HB2 1 1 57 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1 57 1 2 1 1 9 PRO QG . 9 . HG1 1 1 58 1 1 1 1 9 PRO HD2 . 9 . HD2 1 1 58 1 2 1 1 9 PRO QG . 9 . HG1 1 1 59 1 1 1 1 10 ILE H . 10 . HN 1 1 59 1 2 1 1 10 ILE HB . 10 . HB 1 1 60 1 1 1 1 10 ILE H . 10 . HN 1 1 60 1 2 1 1 10 ILE HG12 . 10 . HG12 1 1 61 1 1 1 1 10 ILE H . 10 . HN 1 1 61 1 2 1 1 10 ILE HG13 . 10 . HG11 1 1 62 1 1 1 1 10 ILE HA . 10 . HA 1 1 62 1 2 1 1 11 SER H . 11 . HN 1 1 63 1 1 1 1 10 ILE HB . 10 . HB 1 1 63 1 2 1 1 10 ILE MG . 10 . HG21 1 1 64 1 1 1 1 10 ILE MD . 10 . HD11 1 1 64 1 2 1 1 10 ILE HG13 . 10 . HG11 1 1 65 1 1 1 1 12 ASN HA . 12 . HA 1 1 65 1 2 1 1 12 ASN QB . 12 . HB2 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 . . . . . 3.29 1.937 4.643 1 1 2 1 . . . . . 4.568 1.96 7.176 1 1 3 1 . . . . . 3.852 1.997 5.707 1 1 4 1 . . . . . 3.013 1.878 4.148 1 1 5 1 . . . . . 2.59 1.751 3.429 1 1 6 1 . . . . . 4.385 1.981 6.789 1 1 7 2 . . . . . 3.064 1.89 4.238 1 1 7 3 . . . . . 3.064 1.89 4.238 1 1 8 1 . . . . . 1.853 1.8 6.0 1 1 9 2 . . . . . 2.548 1.737 3.359 1 1 9 3 . . . . . 2.548 1.737 3.359 1 1 10 1 . . . . . 2.387 1.675 3.099 1 1 11 1 . . . . . 2.522 1.727 3.317 1 1 12 1 . . . . . 2.305 1.641 2.969 1 1 13 1 . . . . . 3.287 1.8 6.0 1 1 14 1 . . . . . 2.397 1.679 3.115 1 1 15 1 . . . . . 1.987 1.8 6.0 1 1 16 1 . . . . . 2.652 1.8 6.0 1 1 17 1 . . . . . 2.521 1.726 3.316 1 1 18 2 . . . . . 2.753 1.805 3.701 1 1 18 3 . . . . . 2.753 1.805 3.701 1 1 19 1 . . . . . 3.037 1.884 4.19 1 1 20 1 . . . . . 2.871 1.841 3.901 1 1 21 1 . . . . . 1.997 1.8 6.0 1 1 22 1 . . . . . 3.501 1.969 5.033 1 1 23 1 . . . . . 2.312 1.644 2.98 1 1 24 2 . . . . . 2.449 1.699 3.199 1 1 24 3 . . . . . 2.449 1.699 3.199 1 1 25 2 . . . . . 3.492 1.967 5.017 1 1 25 3 . . . . . 3.492 1.967 5.017 1 1 25 4 . . . . . 3.492 1.967 5.017 1 1 26 2 . . . . . 2.101 1.549 2.653 1 1 26 3 . . . . . 2.101 1.549 2.653 1 1 27 1 . . . . . 1.797 1.393 2.201 1 1 28 2 . . . . . 1.745 1.364 2.126 1 1 28 3 . . . . . 1.745 1.364 2.126 1 1 29 1 . . . . . 2.073 1.536 2.61 1 1 30 1 . . . . . 2.323 1.8 6.0 1 1 31 1 . . . . . 2.336 1.8 6.0 1 1 32 1 . . . . . 2.927 1.8 6.0 1 1 33 1 . . . . . 3.067 1.891 4.243 1 1 34 1 . . . . . 2.283 1.631 2.935 1 1 35 1 . . . . . 1.904 1.451 2.357 1 1 36 1 . . . . . 3.003 1.876 4.13 1 1 37 1 . . . . . 2.926 1.856 3.996 1 1 38 1 . . . . . 2.63 1.911 3.495 1 1 39 1 . . . . . 2.515 1.724 3.306 1 1 40 1 . . . . . 3.263 1.932 4.594 1 1 41 1 . . . . . 1.962 1.481 2.443 1 1 42 1 . . . . . 2.841 1.832 3.85 1 1 43 1 . . . . . 3.009 1.877 4.141 1 1 44 1 . . . . . 3.128 1.905 4.351 1 1 45 1 . . . . . 3.853 1.997 5.709 1 1 46 1 . . . . . 2.342 1.656 3.028 1 1 47 1 . . . . . 3.498 1.968 5.028 1 1 48 1 . . . . . 3.835 1.8 6.0 1 1 49 1 . . . . . 3.038 1.884 4.192 1 1 50 1 . . . . . 3.02 1.88 4.16 1 1 51 1 . . . . . 2.87 1.84 3.9 1 1 52 1 . . . . . 2.545 1.736 3.354 1 1 53 1 . . . . . 3.035 1.883 4.187 1 1 54 1 . . . . . 4.748 1.93 7.566 1 1 55 1 . . . . . 2.747 1.804 3.69 1 1 56 1 . . . . . 1.868 1.432 2.304 1 1 57 1 . . . . . . 1.897 2.497 1 1 58 1 . . . . . 3.349 1.947 4.751 1 1 59 1 . . . . . 2.289 1.634 2.944 1 1 60 1 . . . . . 3.628 1.983 5.273 1 1 61 1 . . . . . 3.203 1.921 4.485 1 1 62 1 . . . . . 2.287 1.8 6.0 1 1 63 1 . . . . . 2.31 1.643 2.977 1 1 64 1 . . . . . 2.082 1.54 2.624 1 1 65 1 . . . . . 3.103 1.899 4.307 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 HIS C C -4.650 -0.835 -3.723 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C -4.271 -2.300 -3.595 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C -2.748 -2.419 -3.445 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C -2.572 -4.823 -2.470 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C -0.999 -5.584 -3.789 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C -2.242 -3.826 -3.326 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H -4.511 -4.048 -4.706 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H -4.308 -2.657 -5.646 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H -5.781 -2.944 -4.870 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H -4.753 -2.712 -2.724 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H -2.277 -1.974 -4.307 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H -2.441 -1.880 -2.560 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H -0.802 -3.856 -4.869 1.00 . A A . 1 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H -3.319 -4.777 -1.691 1.00 . A A . 1 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H -0.269 -6.231 -4.249 1.00 . A A . 1 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H -1.918 -6.817 -2.440 1.00 . A A . 1 HIS HE2 1 1 1 17 1 1 1 HIS N N -4.748 -3.039 -4.786 1.00 . A A . 1 HIS N 1 1 1 18 1 1 1 HIS ND1 N -1.254 -4.338 -4.138 1.00 . A A . 1 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N -1.785 -5.903 -2.779 1.00 . A A . 1 HIS NE2 1 1 1 20 1 1 1 HIS O O -4.301 -0.183 -4.708 1.00 . A A . 1 HIS O 1 1 1 21 1 1 2 GLU C C -4.822 1.993 -2.100 1.00 . A A . 2 GLU C 1 1 1 22 1 1 2 GLU CA C -5.820 1.067 -2.797 1.00 . A A . 2 GLU CA 1 1 1 23 1 1 2 GLU CB C -7.220 1.223 -2.198 1.00 . A A . 2 GLU CB 1 1 1 24 1 1 2 GLU CD C -8.126 2.780 -3.966 1.00 . A A . 2 GLU CD 1 1 1 25 1 1 2 GLU CG C -7.852 2.575 -2.490 1.00 . A A . 2 GLU CG 1 1 1 26 1 1 2 GLU H H -5.619 -0.872 -1.968 1.00 . A A . 2 GLU H 1 1 1 27 1 1 2 GLU HA H -5.862 1.343 -3.840 1.00 . A A . 2 GLU HA 1 1 1 28 1 1 2 GLU HB2 H -7.861 0.455 -2.604 1.00 . A A . 2 GLU HB2 1 1 1 29 1 1 2 GLU HB3 H -7.159 1.102 -1.129 1.00 . A A . 2 GLU HB3 1 1 1 30 1 1 2 GLU HG2 H -8.785 2.645 -1.952 1.00 . A A . 2 GLU HG2 1 1 1 31 1 1 2 GLU HG3 H -7.181 3.351 -2.150 1.00 . A A . 2 GLU HG3 1 1 1 32 1 1 2 GLU N N -5.375 -0.315 -2.739 1.00 . A A . 2 GLU N 1 1 1 33 1 1 2 GLU O O -3.852 2.432 -2.716 1.00 . A A . 2 GLU O 1 1 1 34 1 1 2 GLU OE1 O -7.177 3.069 -4.727 1.00 . A A . 2 GLU OE1 1 1 1 35 1 1 2 GLU OE2 O -9.296 2.644 -4.378 1.00 . A A . 2 GLU OE2 1 1 1 36 1 1 3 VAL C C -4.047 2.794 1.421 1.00 . A A . 3 VAL C 1 1 1 37 1 1 3 VAL CA C -4.144 3.157 -0.084 1.00 . A A . 3 VAL CA 1 1 1 38 1 1 3 VAL CB C -4.615 4.621 -0.281 1.00 . A A . 3 VAL CB 1 1 1 39 1 1 3 VAL CG1 C -5.967 4.870 0.375 1.00 . A A . 3 VAL CG1 1 1 1 40 1 1 3 VAL CG2 C -3.569 5.618 0.203 1.00 . A A . 3 VAL CG2 1 1 1 41 1 1 3 VAL H H -5.807 1.881 -0.356 1.00 . A A . 3 VAL H 1 1 1 42 1 1 3 VAL HA H -3.161 3.064 -0.519 1.00 . A A . 3 VAL HA 1 1 1 43 1 1 3 VAL HB H -4.745 4.769 -1.342 1.00 . A A . 3 VAL HB 1 1 1 44 1 1 3 VAL HG11 H -6.704 4.211 -0.059 1.00 . A A . 3 VAL HG11 1 1 1 45 1 1 3 VAL HG12 H -6.263 5.895 0.215 1.00 . A A . 3 VAL HG12 1 1 1 46 1 1 3 VAL HG13 H -5.894 4.678 1.435 1.00 . A A . 3 VAL HG13 1 1 1 47 1 1 3 VAL HG21 H -3.941 6.623 0.066 1.00 . A A . 3 VAL HG21 1 1 1 48 1 1 3 VAL HG22 H -2.659 5.491 -0.365 1.00 . A A . 3 VAL HG22 1 1 1 49 1 1 3 VAL HG23 H -3.368 5.448 1.250 1.00 . A A . 3 VAL HG23 1 1 1 50 1 1 3 VAL N N -5.032 2.265 -0.815 1.00 . A A . 3 VAL N 1 1 1 51 1 1 3 VAL O O -4.182 3.651 2.296 1.00 . A A . 3 VAL O 1 1 1 52 1 1 4 PRO C C -2.212 1.219 3.651 1.00 . A A . 4 PRO C 1 1 1 53 1 1 4 PRO CA C -3.649 1.095 3.150 1.00 . A A . 4 PRO CA 1 1 1 54 1 1 4 PRO CB C -4.080 -0.378 3.125 1.00 . A A . 4 PRO CB 1 1 1 55 1 1 4 PRO CD C -3.638 0.370 0.867 1.00 . A A . 4 PRO CD 1 1 1 56 1 1 4 PRO CG C -4.227 -0.750 1.680 1.00 . A A . 4 PRO CG 1 1 1 57 1 1 4 PRO HA H -4.305 1.654 3.800 1.00 . A A . 4 PRO HA 1 1 1 58 1 1 4 PRO HB2 H -3.326 -0.981 3.608 1.00 . A A . 4 PRO HB2 1 1 1 59 1 1 4 PRO HB3 H -5.017 -0.485 3.649 1.00 . A A . 4 PRO HB3 1 1 1 60 1 1 4 PRO HD2 H -2.597 0.180 0.650 1.00 . A A . 4 PRO HD2 1 1 1 61 1 1 4 PRO HD3 H -4.200 0.516 -0.044 1.00 . A A . 4 PRO HD3 1 1 1 62 1 1 4 PRO HG2 H -3.694 -1.668 1.486 1.00 . A A . 4 PRO HG2 1 1 1 63 1 1 4 PRO HG3 H -5.274 -0.870 1.446 1.00 . A A . 4 PRO HG3 1 1 1 64 1 1 4 PRO N N -3.788 1.515 1.762 1.00 . A A . 4 PRO N 1 1 1 65 1 1 4 PRO O O -1.912 0.922 4.809 1.00 . A A . 4 PRO O 1 1 1 66 1 1 5 SER C C 0.708 0.618 3.674 1.00 . A A . 5 SER C 1 1 1 67 1 1 5 SER CA C 0.099 1.842 3.005 1.00 . A A . 5 SER CA 1 1 1 68 1 1 5 SER CB C 0.360 3.113 3.829 1.00 . A A . 5 SER CB 1 1 1 69 1 1 5 SER H H -1.677 1.928 1.863 1.00 . A A . 5 SER H 1 1 1 70 1 1 5 SER HA H 0.574 1.954 2.044 1.00 . A A . 5 SER HA 1 1 1 71 1 1 5 SER HB2 H 1.400 3.145 4.115 1.00 . A A . 5 SER HB2 1 1 1 72 1 1 5 SER HB3 H 0.130 3.980 3.226 1.00 . A A . 5 SER HB3 1 1 1 73 1 1 5 SER HG H -0.921 2.320 5.092 1.00 . A A . 5 SER HG 1 1 1 74 1 1 5 SER N N -1.336 1.675 2.747 1.00 . A A . 5 SER N 1 1 1 75 1 1 5 SER O O 1.517 0.731 4.589 1.00 . A A . 5 SER O 1 1 1 76 1 1 5 SER OG O -0.434 3.153 5.007 1.00 . A A . 5 SER OG 1 1 1 77 1 1 6 GLY C C 1.176 -2.831 2.754 1.00 . A A . 6 GLY C 1 1 1 78 1 1 6 GLY CA C 0.797 -1.784 3.782 1.00 . A A . 6 GLY CA 1 1 1 79 1 1 6 GLY H H -0.247 -0.570 2.400 1.00 . A A . 6 GLY H 1 1 1 80 1 1 6 GLY HA2 H 1.661 -1.568 4.390 1.00 . A A . 6 GLY HA2 1 1 1 81 1 1 6 GLY HA3 H 0.016 -2.179 4.412 1.00 . A A . 6 GLY HA3 1 1 1 82 1 1 6 GLY N N 0.335 -0.550 3.181 1.00 . A A . 6 GLY N 1 1 1 83 1 1 6 GLY O O 2.362 -3.046 2.511 1.00 . A A . 6 GLY O 1 1 1 84 1 1 7 PRO C C 0.965 -3.965 -0.194 1.00 . A A . 7 PRO C 1 1 1 85 1 1 7 PRO CA C 0.433 -4.539 1.118 1.00 . A A . 7 PRO CA 1 1 1 86 1 1 7 PRO CB C -0.942 -5.162 0.899 1.00 . A A . 7 PRO CB 1 1 1 87 1 1 7 PRO CD C -1.254 -3.330 2.404 1.00 . A A . 7 PRO CD 1 1 1 88 1 1 7 PRO CG C -1.911 -4.101 1.294 1.00 . A A . 7 PRO CG 1 1 1 89 1 1 7 PRO HA H 1.118 -5.291 1.478 1.00 . A A . 7 PRO HA 1 1 1 90 1 1 7 PRO HB2 H -1.047 -5.427 -0.141 1.00 . A A . 7 PRO HB2 1 1 1 91 1 1 7 PRO HB3 H -1.045 -6.043 1.515 1.00 . A A . 7 PRO HB3 1 1 1 92 1 1 7 PRO HD2 H -1.531 -2.288 2.354 1.00 . A A . 7 PRO HD2 1 1 1 93 1 1 7 PRO HD3 H -1.521 -3.748 3.362 1.00 . A A . 7 PRO HD3 1 1 1 94 1 1 7 PRO HG2 H -2.107 -3.453 0.453 1.00 . A A . 7 PRO HG2 1 1 1 95 1 1 7 PRO HG3 H -2.828 -4.553 1.643 1.00 . A A . 7 PRO HG3 1 1 1 96 1 1 7 PRO N N 0.185 -3.504 2.137 1.00 . A A . 7 PRO N 1 1 1 97 1 1 7 PRO O O 0.289 -4.007 -1.223 1.00 . A A . 7 PRO O 1 1 1 98 1 1 8 ASN C C 1.969 -2.053 -2.211 1.00 . A A . 8 ASN C 1 1 1 99 1 1 8 ASN CA C 2.888 -2.792 -1.236 1.00 . A A . 8 ASN CA 1 1 1 100 1 1 8 ASN CB C 3.780 -3.796 -1.989 1.00 . A A . 8 ASN CB 1 1 1 101 1 1 8 ASN CG C 3.094 -5.112 -2.313 1.00 . A A . 8 ASN CG 1 1 1 102 1 1 8 ASN H H 2.635 -3.467 0.754 1.00 . A A . 8 ASN H 1 1 1 103 1 1 8 ASN HA H 3.537 -2.050 -0.793 1.00 . A A . 8 ASN HA 1 1 1 104 1 1 8 ASN HB2 H 4.094 -3.349 -2.919 1.00 . A A . 8 ASN HB2 1 1 1 105 1 1 8 ASN HB3 H 4.653 -4.002 -1.387 1.00 . A A . 8 ASN HB3 1 1 1 106 1 1 8 ASN HD21 H 2.498 -4.404 -4.067 1.00 . A A . 8 ASN HD21 1 1 1 107 1 1 8 ASN HD22 H 2.035 -6.032 -3.714 1.00 . A A . 8 ASN HD22 1 1 1 108 1 1 8 ASN N N 2.181 -3.430 -0.115 1.00 . A A . 8 ASN N 1 1 1 109 1 1 8 ASN ND2 N 2.480 -5.191 -3.480 1.00 . A A . 8 ASN ND2 1 1 1 110 1 1 8 ASN O O 1.905 -2.389 -3.392 1.00 . A A . 8 ASN O 1 1 1 111 1 1 8 ASN OD1 O 3.128 -6.056 -1.522 1.00 . A A . 8 ASN OD1 1 1 1 112 1 1 9 PRO C C 1.381 0.917 -3.198 1.00 . A A . 9 PRO C 1 1 1 113 1 1 9 PRO CA C 0.471 -0.151 -2.606 1.00 . A A . 9 PRO CA 1 1 1 114 1 1 9 PRO CB C -0.572 0.475 -1.662 1.00 . A A . 9 PRO CB 1 1 1 115 1 1 9 PRO CD C 1.107 -0.627 -0.338 1.00 . A A . 9 PRO CD 1 1 1 116 1 1 9 PRO CG C -0.297 -0.097 -0.302 1.00 . A A . 9 PRO CG 1 1 1 117 1 1 9 PRO HA H -0.020 -0.699 -3.398 1.00 . A A . 9 PRO HA 1 1 1 118 1 1 9 PRO HB2 H -0.459 1.549 -1.666 1.00 . A A . 9 PRO HB2 1 1 1 119 1 1 9 PRO HB3 H -1.564 0.216 -2.002 1.00 . A A . 9 PRO HB3 1 1 1 120 1 1 9 PRO HD2 H 1.815 0.147 -0.082 1.00 . A A . 9 PRO HD2 1 1 1 121 1 1 9 PRO HD3 H 1.211 -1.478 0.320 1.00 . A A . 9 PRO HD3 1 1 1 122 1 1 9 PRO HG2 H -0.384 0.677 0.446 1.00 . A A . 9 PRO HG2 1 1 1 123 1 1 9 PRO HG3 H -0.993 -0.898 -0.094 1.00 . A A . 9 PRO HG3 1 1 1 124 1 1 9 PRO N N 1.244 -1.026 -1.738 1.00 . A A . 9 PRO N 1 1 1 125 1 1 9 PRO O O 1.586 0.989 -4.409 1.00 . A A . 9 PRO O 1 1 1 126 1 1 10 ILE C C 4.123 2.526 -1.665 1.00 . A A . 10 ILE C 1 1 1 127 1 1 10 ILE CA C 2.984 2.673 -2.662 1.00 . A A . 10 ILE CA 1 1 1 128 1 1 10 ILE CB C 2.471 4.133 -2.660 1.00 . A A . 10 ILE CB 1 1 1 129 1 1 10 ILE CD1 C 0.796 5.712 -3.752 1.00 . A A . 10 ILE CD1 1 1 1 130 1 1 10 ILE CG1 C 1.384 4.319 -3.722 1.00 . A A . 10 ILE CG1 1 1 1 131 1 1 10 ILE CG2 C 3.620 5.106 -2.900 1.00 . A A . 10 ILE CG2 1 1 1 132 1 1 10 ILE H H 1.638 1.680 -1.380 1.00 . A A . 10 ILE H 1 1 1 133 1 1 10 ILE HA H 3.344 2.431 -3.652 1.00 . A A . 10 ILE HA 1 1 1 134 1 1 10 ILE HB H 2.053 4.342 -1.687 1.00 . A A . 10 ILE HB 1 1 1 135 1 1 10 ILE HD11 H 1.575 6.426 -3.972 1.00 . A A . 10 ILE HD11 1 1 1 136 1 1 10 ILE HD12 H 0.358 5.940 -2.791 1.00 . A A . 10 ILE HD12 1 1 1 137 1 1 10 ILE HD13 H 0.035 5.764 -4.516 1.00 . A A . 10 ILE HD13 1 1 1 138 1 1 10 ILE HG12 H 1.803 4.116 -4.696 1.00 . A A . 10 ILE HG12 1 1 1 139 1 1 10 ILE HG13 H 0.581 3.621 -3.530 1.00 . A A . 10 ILE HG13 1 1 1 140 1 1 10 ILE HG21 H 4.071 4.901 -3.861 1.00 . A A . 10 ILE HG21 1 1 1 141 1 1 10 ILE HG22 H 4.362 4.987 -2.123 1.00 . A A . 10 ILE HG22 1 1 1 142 1 1 10 ILE HG23 H 3.244 6.117 -2.888 1.00 . A A . 10 ILE HG23 1 1 1 143 1 1 10 ILE N N 1.939 1.726 -2.311 1.00 . A A . 10 ILE N 1 1 1 144 1 1 10 ILE O O 5.301 2.571 -2.022 1.00 . A A . 10 ILE O 1 1 1 145 1 1 11 SER C C 5.270 0.676 0.557 1.00 . A A . 11 SER C 1 1 1 146 1 1 11 SER CA C 4.698 2.089 0.657 1.00 . A A . 11 SER CA 1 1 1 147 1 1 11 SER CB C 3.987 2.272 1.995 1.00 . A A . 11 SER CB 1 1 1 148 1 1 11 SER H H 2.798 2.372 -0.188 1.00 . A A . 11 SER H 1 1 1 149 1 1 11 SER HA H 5.498 2.808 0.574 1.00 . A A . 11 SER HA 1 1 1 150 1 1 11 SER HB2 H 3.495 1.350 2.270 1.00 . A A . 11 SER HB2 1 1 1 151 1 1 11 SER HB3 H 4.709 2.538 2.752 1.00 . A A . 11 SER HB3 1 1 1 152 1 1 11 SER HG H 3.419 4.143 2.153 1.00 . A A . 11 SER HG 1 1 1 153 1 1 11 SER N N 3.748 2.331 -0.411 1.00 . A A . 11 SER N 1 1 1 154 1 1 11 SER O O 4.683 -0.279 1.069 1.00 . A A . 11 SER O 1 1 1 155 1 1 11 SER OG O 3.016 3.303 1.904 1.00 . A A . 11 SER OG 1 1 1 156 1 1 12 ASN C C 8.563 -0.524 -0.457 1.00 . A A . 12 ASN C 1 1 1 157 1 1 12 ASN CA C 7.075 -0.741 -0.245 1.00 . A A . 12 ASN CA 1 1 1 158 1 1 12 ASN CB C 6.503 -1.574 -1.396 1.00 . A A . 12 ASN CB 1 1 1 159 1 1 12 ASN CG C 7.219 -2.902 -1.555 1.00 . A A . 12 ASN CG 1 1 1 160 1 1 12 ASN H H 6.785 1.332 -0.570 1.00 . A A . 12 ASN H 1 1 1 161 1 1 12 ASN HA H 6.932 -1.275 0.683 1.00 . A A . 12 ASN HA 1 1 1 162 1 1 12 ASN HB2 H 5.459 -1.775 -1.205 1.00 . A A . 12 ASN HB2 1 1 1 163 1 1 12 ASN HB3 H 6.599 -1.019 -2.317 1.00 . A A . 12 ASN HB3 1 1 1 164 1 1 12 ASN HD21 H 8.481 -2.102 -2.858 1.00 . A A . 12 ASN HD21 1 1 1 165 1 1 12 ASN HD22 H 8.718 -3.779 -2.514 1.00 . A A . 12 ASN HD22 1 1 1 166 1 1 12 ASN N N 6.396 0.543 -0.128 1.00 . A A . 12 ASN N 1 1 1 167 1 1 12 ASN ND2 N 8.241 -2.931 -2.393 1.00 . A A . 12 ASN ND2 1 1 1 168 1 1 12 ASN O O 9.326 -0.656 0.518 1.00 . A A . 12 ASN O 1 1 1 169 1 1 12 ASN OXT O 8.960 -0.194 -1.595 1.00 . A A . 12 ASN OXT 1 1 1 170 1 1 12 ASN OD1 O 6.854 -3.894 -0.927 1.00 . A A . 12 ASN OD1 1 1 2 171 1 1 1 HIS C C -7.786 -1.608 -1.258 1.00 . A A . 1 HIS C 1 1 2 172 1 1 1 HIS CA C -7.601 -2.949 -0.558 1.00 . A A . 1 HIS CA 1 1 2 173 1 1 1 HIS CB C -7.626 -2.759 0.964 1.00 . A A . 1 HIS CB 1 1 2 174 1 1 1 HIS CD2 C -9.445 -1.031 1.646 1.00 . A A . 1 HIS CD2 1 1 2 175 1 1 1 HIS CE1 C -10.968 -2.433 2.357 1.00 . A A . 1 HIS CE1 1 1 2 176 1 1 1 HIS CG C -8.947 -2.281 1.497 1.00 . A A . 1 HIS CG 1 1 2 177 1 1 1 HIS H1 H -5.524 -2.983 -0.723 1.00 . A A . 1 HIS H1 1 1 2 178 1 1 1 HIS H2 H -6.330 -3.716 -2.015 1.00 . A A . 1 HIS H2 1 1 2 179 1 1 1 HIS H3 H -6.223 -4.509 -0.528 1.00 . A A . 1 HIS H3 1 1 2 180 1 1 1 HIS HA H -8.412 -3.600 -0.845 1.00 . A A . 1 HIS HA 1 1 2 181 1 1 1 HIS HB2 H -7.400 -3.701 1.441 1.00 . A A . 1 HIS HB2 1 1 2 182 1 1 1 HIS HB3 H -6.874 -2.034 1.241 1.00 . A A . 1 HIS HB3 1 1 2 183 1 1 1 HIS HD1 H -9.867 -4.117 1.984 1.00 . A A . 1 HIS HD1 1 1 2 184 1 1 1 HIS HD2 H -8.946 -0.107 1.388 1.00 . A A . 1 HIS HD2 1 1 2 185 1 1 1 HIS HE1 H -11.884 -2.836 2.765 1.00 . A A . 1 HIS HE1 1 1 2 186 1 1 1 HIS HE2 H -11.270 -0.409 2.487 1.00 . A A . 1 HIS HE2 1 1 2 187 1 1 1 HIS N N -6.333 -3.581 -0.984 1.00 . A A . 1 HIS N 1 1 2 188 1 1 1 HIS ND1 N -9.928 -3.136 1.954 1.00 . A A . 1 HIS ND1 1 1 2 189 1 1 1 HIS NE2 N -10.702 -1.155 2.181 1.00 . A A . 1 HIS NE2 1 1 2 190 1 1 1 HIS O O -8.819 -1.367 -1.883 1.00 . A A . 1 HIS O 1 1 2 191 1 1 2 GLU C C -5.468 1.241 -1.761 1.00 . A A . 2 GLU C 1 1 2 192 1 1 2 GLU CA C -6.841 0.569 -1.793 1.00 . A A . 2 GLU CA 1 1 2 193 1 1 2 GLU CB C -7.889 1.467 -1.127 1.00 . A A . 2 GLU CB 1 1 2 194 1 1 2 GLU CD C -8.889 2.537 -3.179 1.00 . A A . 2 GLU CD 1 1 2 195 1 1 2 GLU CG C -8.146 2.761 -1.877 1.00 . A A . 2 GLU CG 1 1 2 196 1 1 2 GLU H H -5.989 -0.978 -0.629 1.00 . A A . 2 GLU H 1 1 2 197 1 1 2 GLU HA H -7.122 0.412 -2.823 1.00 . A A . 2 GLU HA 1 1 2 198 1 1 2 GLU HB2 H -8.819 0.924 -1.061 1.00 . A A . 2 GLU HB2 1 1 2 199 1 1 2 GLU HB3 H -7.556 1.712 -0.132 1.00 . A A . 2 GLU HB3 1 1 2 200 1 1 2 GLU HG2 H -8.734 3.411 -1.248 1.00 . A A . 2 GLU HG2 1 1 2 201 1 1 2 GLU HG3 H -7.198 3.231 -2.095 1.00 . A A . 2 GLU HG3 1 1 2 202 1 1 2 GLU N N -6.789 -0.736 -1.146 1.00 . A A . 2 GLU N 1 1 2 203 1 1 2 GLU O O -4.671 1.084 -2.683 1.00 . A A . 2 GLU O 1 1 2 204 1 1 2 GLU OE1 O -8.258 2.082 -4.158 1.00 . A A . 2 GLU OE1 1 1 2 205 1 1 2 GLU OE2 O -10.106 2.821 -3.234 1.00 . A A . 2 GLU OE2 1 1 2 206 1 1 3 VAL C C -3.551 2.800 0.969 1.00 . A A . 3 VAL C 1 1 2 207 1 1 3 VAL CA C -3.905 2.635 -0.526 1.00 . A A . 3 VAL CA 1 1 2 208 1 1 3 VAL CB C -3.930 3.997 -1.262 1.00 . A A . 3 VAL CB 1 1 2 209 1 1 3 VAL CG1 C -4.929 4.963 -0.635 1.00 . A A . 3 VAL CG1 1 1 2 210 1 1 3 VAL CG2 C -2.539 4.610 -1.345 1.00 . A A . 3 VAL CG2 1 1 2 211 1 1 3 VAL H H -5.865 2.081 0.008 1.00 . A A . 3 VAL H 1 1 2 212 1 1 3 VAL HA H -3.152 2.015 -0.992 1.00 . A A . 3 VAL HA 1 1 2 213 1 1 3 VAL HB H -4.268 3.802 -2.268 1.00 . A A . 3 VAL HB 1 1 2 214 1 1 3 VAL HG11 H -4.661 5.140 0.396 1.00 . A A . 3 VAL HG11 1 1 2 215 1 1 3 VAL HG12 H -5.919 4.535 -0.680 1.00 . A A . 3 VAL HG12 1 1 2 216 1 1 3 VAL HG13 H -4.915 5.897 -1.177 1.00 . A A . 3 VAL HG13 1 1 2 217 1 1 3 VAL HG21 H -2.167 4.795 -0.348 1.00 . A A . 3 VAL HG21 1 1 2 218 1 1 3 VAL HG22 H -2.588 5.541 -1.888 1.00 . A A . 3 VAL HG22 1 1 2 219 1 1 3 VAL HG23 H -1.874 3.929 -1.856 1.00 . A A . 3 VAL HG23 1 1 2 220 1 1 3 VAL N N -5.187 1.970 -0.686 1.00 . A A . 3 VAL N 1 1 2 221 1 1 3 VAL O O -3.244 3.892 1.447 1.00 . A A . 3 VAL O 1 1 2 222 1 1 4 PRO C C -1.888 1.644 3.569 1.00 . A A . 4 PRO C 1 1 2 223 1 1 4 PRO CA C -3.358 1.715 3.175 1.00 . A A . 4 PRO CA 1 1 2 224 1 1 4 PRO CB C -4.101 0.455 3.646 1.00 . A A . 4 PRO CB 1 1 2 225 1 1 4 PRO CD C -3.721 0.314 1.260 1.00 . A A . 4 PRO CD 1 1 2 226 1 1 4 PRO CG C -4.415 -0.345 2.415 1.00 . A A . 4 PRO CG 1 1 2 227 1 1 4 PRO HA H -3.809 2.588 3.619 1.00 . A A . 4 PRO HA 1 1 2 228 1 1 4 PRO HB2 H -3.468 -0.103 4.322 1.00 . A A . 4 PRO HB2 1 1 2 229 1 1 4 PRO HB3 H -5.005 0.744 4.158 1.00 . A A . 4 PRO HB3 1 1 2 230 1 1 4 PRO HD2 H -2.767 -0.155 1.071 1.00 . A A . 4 PRO HD2 1 1 2 231 1 1 4 PRO HD3 H -4.342 0.282 0.376 1.00 . A A . 4 PRO HD3 1 1 2 232 1 1 4 PRO HG2 H -4.051 -1.357 2.533 1.00 . A A . 4 PRO HG2 1 1 2 233 1 1 4 PRO HG3 H -5.484 -0.346 2.254 1.00 . A A . 4 PRO HG3 1 1 2 234 1 1 4 PRO N N -3.550 1.689 1.729 1.00 . A A . 4 PRO N 1 1 2 235 1 1 4 PRO O O -1.552 1.507 4.747 1.00 . A A . 4 PRO O 1 1 2 236 1 1 5 SER C C 0.797 0.299 3.399 1.00 . A A . 5 SER C 1 1 2 237 1 1 5 SER CA C 0.425 1.631 2.746 1.00 . A A . 5 SER CA 1 1 2 238 1 1 5 SER CB C 0.947 2.806 3.579 1.00 . A A . 5 SER CB 1 1 2 239 1 1 5 SER H H -1.370 1.910 1.665 1.00 . A A . 5 SER H 1 1 2 240 1 1 5 SER HA H 0.880 1.670 1.767 1.00 . A A . 5 SER HA 1 1 2 241 1 1 5 SER HB2 H 0.539 2.748 4.578 1.00 . A A . 5 SER HB2 1 1 2 242 1 1 5 SER HB3 H 2.024 2.762 3.626 1.00 . A A . 5 SER HB3 1 1 2 243 1 1 5 SER HG H -0.150 4.431 3.522 1.00 . A A . 5 SER HG 1 1 2 244 1 1 5 SER N N -1.020 1.740 2.562 1.00 . A A . 5 SER N 1 1 2 245 1 1 5 SER O O 1.804 0.189 4.093 1.00 . A A . 5 SER O 1 1 2 246 1 1 5 SER OG O 0.564 4.043 2.999 1.00 . A A . 5 SER OG 1 1 2 247 1 1 6 GLY C C 0.887 -2.977 2.790 1.00 . A A . 6 GLY C 1 1 2 248 1 1 6 GLY CA C 0.214 -2.013 3.747 1.00 . A A . 6 GLY CA 1 1 2 249 1 1 6 GLY H H -0.788 -0.579 2.568 1.00 . A A . 6 GLY H 1 1 2 250 1 1 6 GLY HA2 H 0.845 -1.887 4.615 1.00 . A A . 6 GLY HA2 1 1 2 251 1 1 6 GLY HA3 H -0.729 -2.427 4.060 1.00 . A A . 6 GLY HA3 1 1 2 252 1 1 6 GLY N N -0.018 -0.715 3.153 1.00 . A A . 6 GLY N 1 1 2 253 1 1 6 GLY O O 2.113 -2.976 2.682 1.00 . A A . 6 GLY O 1 1 2 254 1 1 7 PRO C C 1.234 -4.153 -0.146 1.00 . A A . 7 PRO C 1 1 2 255 1 1 7 PRO CA C 0.630 -4.796 1.108 1.00 . A A . 7 PRO CA 1 1 2 256 1 1 7 PRO CB C -0.596 -5.629 0.720 1.00 . A A . 7 PRO CB 1 1 2 257 1 1 7 PRO CD C -1.362 -3.902 2.191 1.00 . A A . 7 PRO CD 1 1 2 258 1 1 7 PRO CG C -1.647 -5.301 1.726 1.00 . A A . 7 PRO CG 1 1 2 259 1 1 7 PRO HA H 1.368 -5.436 1.565 1.00 . A A . 7 PRO HA 1 1 2 260 1 1 7 PRO HB2 H -0.907 -5.355 -0.276 1.00 . A A . 7 PRO HB2 1 1 2 261 1 1 7 PRO HB3 H -0.341 -6.678 0.746 1.00 . A A . 7 PRO HB3 1 1 2 262 1 1 7 PRO HD2 H -1.852 -3.178 1.553 1.00 . A A . 7 PRO HD2 1 1 2 263 1 1 7 PRO HD3 H -1.678 -3.778 3.215 1.00 . A A . 7 PRO HD3 1 1 2 264 1 1 7 PRO HG2 H -2.623 -5.351 1.268 1.00 . A A . 7 PRO HG2 1 1 2 265 1 1 7 PRO HG3 H -1.586 -5.990 2.555 1.00 . A A . 7 PRO HG3 1 1 2 266 1 1 7 PRO N N 0.104 -3.813 2.077 1.00 . A A . 7 PRO N 1 1 2 267 1 1 7 PRO O O 0.826 -4.453 -1.271 1.00 . A A . 7 PRO O 1 1 2 268 1 1 8 ASN C C 1.968 -1.918 -2.002 1.00 . A A . 8 ASN C 1 1 2 269 1 1 8 ASN CA C 2.923 -2.583 -1.002 1.00 . A A . 8 ASN CA 1 1 2 270 1 1 8 ASN CB C 3.876 -3.554 -1.717 1.00 . A A . 8 ASN CB 1 1 2 271 1 1 8 ASN CG C 4.812 -2.863 -2.699 1.00 . A A . 8 ASN CG 1 1 2 272 1 1 8 ASN H H 2.443 -3.080 1.003 1.00 . A A . 8 ASN H 1 1 2 273 1 1 8 ASN HA H 3.513 -1.807 -0.539 1.00 . A A . 8 ASN HA 1 1 2 274 1 1 8 ASN HB2 H 4.482 -4.054 -0.975 1.00 . A A . 8 ASN HB2 1 1 2 275 1 1 8 ASN HB3 H 3.294 -4.286 -2.255 1.00 . A A . 8 ASN HB3 1 1 2 276 1 1 8 ASN HD21 H 6.163 -2.608 -1.271 1.00 . A A . 8 ASN HD21 1 1 2 277 1 1 8 ASN HD22 H 6.587 -1.988 -2.825 1.00 . A A . 8 ASN HD22 1 1 2 278 1 1 8 ASN N N 2.202 -3.276 0.072 1.00 . A A . 8 ASN N 1 1 2 279 1 1 8 ASN ND2 N 5.969 -2.449 -2.218 1.00 . A A . 8 ASN ND2 1 1 2 280 1 1 8 ASN O O 1.918 -2.290 -3.175 1.00 . A A . 8 ASN O 1 1 2 281 1 1 8 ASN OD1 O 4.505 -2.711 -3.880 1.00 . A A . 8 ASN OD1 1 1 2 282 1 1 9 PRO C C 1.148 1.089 -2.906 1.00 . A A . 9 PRO C 1 1 2 283 1 1 9 PRO CA C 0.353 -0.117 -2.421 1.00 . A A . 9 PRO CA 1 1 2 284 1 1 9 PRO CB C -0.814 0.328 -1.525 1.00 . A A . 9 PRO CB 1 1 2 285 1 1 9 PRO CD C 0.932 -0.596 -0.148 1.00 . A A . 9 PRO CD 1 1 2 286 1 1 9 PRO CG C -0.522 -0.221 -0.160 1.00 . A A . 9 PRO CG 1 1 2 287 1 1 9 PRO HA H -0.019 -0.673 -3.269 1.00 . A A . 9 PRO HA 1 1 2 288 1 1 9 PRO HB2 H -0.862 1.407 -1.509 1.00 . A A . 9 PRO HB2 1 1 2 289 1 1 9 PRO HB3 H -1.740 -0.069 -1.917 1.00 . A A . 9 PRO HB3 1 1 2 290 1 1 9 PRO HD2 H 1.540 0.245 0.149 1.00 . A A . 9 PRO HD2 1 1 2 291 1 1 9 PRO HD3 H 1.104 -1.444 0.500 1.00 . A A . 9 PRO HD3 1 1 2 292 1 1 9 PRO HG2 H -0.717 0.534 0.586 1.00 . A A . 9 PRO HG2 1 1 2 293 1 1 9 PRO HG3 H -1.135 -1.093 0.022 1.00 . A A . 9 PRO HG3 1 1 2 294 1 1 9 PRO N N 1.163 -0.946 -1.543 1.00 . A A . 9 PRO N 1 1 2 295 1 1 9 PRO O O 1.391 1.254 -4.099 1.00 . A A . 9 PRO O 1 1 2 296 1 1 10 ILE C C 3.760 2.931 -1.570 1.00 . A A . 10 ILE C 1 1 2 297 1 1 10 ILE CA C 2.401 3.067 -2.261 1.00 . A A . 10 ILE CA 1 1 2 298 1 1 10 ILE CB C 1.704 4.379 -1.827 1.00 . A A . 10 ILE CB 1 1 2 299 1 1 10 ILE CD1 C 1.853 6.921 -1.953 1.00 . A A . 10 ILE CD1 1 1 2 300 1 1 10 ILE CG1 C 2.520 5.599 -2.264 1.00 . A A . 10 ILE CG1 1 1 2 301 1 1 10 ILE CG2 C 1.472 4.394 -0.321 1.00 . A A . 10 ILE CG2 1 1 2 302 1 1 10 ILE H H 1.295 1.757 -1.032 1.00 . A A . 10 ILE H 1 1 2 303 1 1 10 ILE HA H 2.551 3.098 -3.330 1.00 . A A . 10 ILE HA 1 1 2 304 1 1 10 ILE HB H 0.739 4.412 -2.307 1.00 . A A . 10 ILE HB 1 1 2 305 1 1 10 ILE HD11 H 1.672 6.990 -0.891 1.00 . A A . 10 ILE HD11 1 1 2 306 1 1 10 ILE HD12 H 0.915 6.983 -2.484 1.00 . A A . 10 ILE HD12 1 1 2 307 1 1 10 ILE HD13 H 2.497 7.730 -2.263 1.00 . A A . 10 ILE HD13 1 1 2 308 1 1 10 ILE HG12 H 3.474 5.585 -1.758 1.00 . A A . 10 ILE HG12 1 1 2 309 1 1 10 ILE HG13 H 2.684 5.552 -3.331 1.00 . A A . 10 ILE HG13 1 1 2 310 1 1 10 ILE HG21 H 2.422 4.321 0.188 1.00 . A A . 10 ILE HG21 1 1 2 311 1 1 10 ILE HG22 H 0.851 3.554 -0.045 1.00 . A A . 10 ILE HG22 1 1 2 312 1 1 10 ILE HG23 H 0.982 5.313 -0.040 1.00 . A A . 10 ILE HG23 1 1 2 313 1 1 10 ILE N N 1.567 1.918 -1.958 1.00 . A A . 10 ILE N 1 1 2 314 1 1 10 ILE O O 4.750 3.540 -1.981 1.00 . A A . 10 ILE O 1 1 2 315 1 1 11 SER C C 4.916 0.558 0.997 1.00 . A A . 11 SER C 1 1 2 316 1 1 11 SER CA C 5.020 1.880 0.239 1.00 . A A . 11 SER CA 1 1 2 317 1 1 11 SER CB C 5.251 3.020 1.239 1.00 . A A . 11 SER CB 1 1 2 318 1 1 11 SER H H 2.989 1.646 -0.255 1.00 . A A . 11 SER H 1 1 2 319 1 1 11 SER HA H 5.849 1.834 -0.451 1.00 . A A . 11 SER HA 1 1 2 320 1 1 11 SER HB2 H 4.461 3.015 1.974 1.00 . A A . 11 SER HB2 1 1 2 321 1 1 11 SER HB3 H 6.201 2.876 1.734 1.00 . A A . 11 SER HB3 1 1 2 322 1 1 11 SER HG H 5.326 4.152 -0.362 1.00 . A A . 11 SER HG 1 1 2 323 1 1 11 SER N N 3.799 2.114 -0.522 1.00 . A A . 11 SER N 1 1 2 324 1 1 11 SER O O 3.818 0.155 1.388 1.00 . A A . 11 SER O 1 1 2 325 1 1 11 SER OG O 5.260 4.283 0.593 1.00 . A A . 11 SER OG 1 1 2 326 1 1 12 ASN C C 7.562 -1.694 2.273 1.00 . A A . 12 ASN C 1 1 2 327 1 1 12 ASN CA C 6.113 -1.306 2.027 1.00 . A A . 12 ASN CA 1 1 2 328 1 1 12 ASN CB C 5.360 -2.493 1.415 1.00 . A A . 12 ASN CB 1 1 2 329 1 1 12 ASN CG C 5.337 -3.693 2.344 1.00 . A A . 12 ASN CG 1 1 2 330 1 1 12 ASN H H 6.868 0.195 0.735 1.00 . A A . 12 ASN H 1 1 2 331 1 1 12 ASN HA H 5.658 -1.057 2.975 1.00 . A A . 12 ASN HA 1 1 2 332 1 1 12 ASN HB2 H 4.343 -2.199 1.213 1.00 . A A . 12 ASN HB2 1 1 2 333 1 1 12 ASN HB3 H 5.837 -2.783 0.489 1.00 . A A . 12 ASN HB3 1 1 2 334 1 1 12 ASN HD21 H 5.405 -4.936 0.798 1.00 . A A . 12 ASN HD21 1 1 2 335 1 1 12 ASN HD22 H 5.346 -5.677 2.359 1.00 . A A . 12 ASN HD22 1 1 2 336 1 1 12 ASN N N 6.046 -0.115 1.182 1.00 . A A . 12 ASN N 1 1 2 337 1 1 12 ASN ND2 N 5.366 -4.888 1.777 1.00 . A A . 12 ASN ND2 1 1 2 338 1 1 12 ASN O O 8.149 -1.203 3.259 1.00 . A A . 12 ASN O 1 1 2 339 1 1 12 ASN OXT O 8.117 -2.471 1.472 1.00 . A A . 12 ASN OXT 1 1 2 340 1 1 12 ASN OD1 O 5.304 -3.547 3.567 1.00 . A A . 12 ASN OD1 1 1 3 341 1 1 1 HIS C C -7.511 -0.849 0.230 1.00 . A A . 1 HIS C 1 1 3 342 1 1 1 HIS CA C -8.565 -0.463 1.258 1.00 . A A . 1 HIS CA 1 1 3 343 1 1 1 HIS CB C -9.723 0.260 0.557 1.00 . A A . 1 HIS CB 1 1 3 344 1 1 1 HIS CD2 C -11.424 0.221 2.521 1.00 . A A . 1 HIS CD2 1 1 3 345 1 1 1 HIS CE1 C -13.212 -0.321 1.379 1.00 . A A . 1 HIS CE1 1 1 3 346 1 1 1 HIS CG C -11.053 0.086 1.226 1.00 . A A . 1 HIS CG 1 1 3 347 1 1 1 HIS H1 H -7.235 -0.160 2.831 1.00 . A A . 1 HIS H1 1 1 3 348 1 1 1 HIS H2 H -8.703 0.659 3.014 1.00 . A A . 1 HIS H2 1 1 3 349 1 1 1 HIS H3 H -7.549 1.231 1.923 1.00 . A A . 1 HIS H3 1 1 3 350 1 1 1 HIS HA H -8.943 -1.365 1.714 1.00 . A A . 1 HIS HA 1 1 3 351 1 1 1 HIS HB2 H -9.508 1.317 0.523 1.00 . A A . 1 HIS HB2 1 1 3 352 1 1 1 HIS HB3 H -9.808 -0.113 -0.452 1.00 . A A . 1 HIS HB3 1 1 3 353 1 1 1 HIS HD1 H -12.261 -0.421 -0.428 1.00 . A A . 1 HIS HD1 1 1 3 354 1 1 1 HIS HD2 H -10.780 0.482 3.348 1.00 . A A . 1 HIS HD2 1 1 3 355 1 1 1 HIS HE1 H -14.232 -0.567 1.122 1.00 . A A . 1 HIS HE1 1 1 3 356 1 1 1 HIS HE2 H -13.319 0.008 3.399 1.00 . A A . 1 HIS HE2 1 1 3 357 1 1 1 HIS N N -7.974 0.376 2.329 1.00 . A A . 1 HIS N 1 1 3 358 1 1 1 HIS ND1 N -12.199 -0.255 0.538 1.00 . A A . 1 HIS ND1 1 1 3 359 1 1 1 HIS NE2 N -12.768 -0.037 2.586 1.00 . A A . 1 HIS NE2 1 1 3 360 1 1 1 HIS O O -6.948 -1.940 0.287 1.00 . A A . 1 HIS O 1 1 3 361 1 1 2 GLU C C -4.939 0.394 -1.536 1.00 . A A . 2 GLU C 1 1 3 362 1 1 2 GLU CA C -6.313 -0.220 -1.788 1.00 . A A . 2 GLU CA 1 1 3 363 1 1 2 GLU CB C -6.900 0.309 -3.096 1.00 . A A . 2 GLU CB 1 1 3 364 1 1 2 GLU CD C -7.928 2.269 -4.308 1.00 . A A . 2 GLU CD 1 1 3 365 1 1 2 GLU CG C -7.243 1.789 -3.050 1.00 . A A . 2 GLU CG 1 1 3 366 1 1 2 GLU H H -7.644 0.949 -0.633 1.00 . A A . 2 GLU H 1 1 3 367 1 1 2 GLU HA H -6.205 -1.291 -1.862 1.00 . A A . 2 GLU HA 1 1 3 368 1 1 2 GLU HB2 H -6.185 0.152 -3.889 1.00 . A A . 2 GLU HB2 1 1 3 369 1 1 2 GLU HB3 H -7.801 -0.241 -3.322 1.00 . A A . 2 GLU HB3 1 1 3 370 1 1 2 GLU HG2 H -7.901 1.966 -2.212 1.00 . A A . 2 GLU HG2 1 1 3 371 1 1 2 GLU HG3 H -6.332 2.353 -2.916 1.00 . A A . 2 GLU HG3 1 1 3 372 1 1 2 GLU N N -7.227 0.061 -0.690 1.00 . A A . 2 GLU N 1 1 3 373 1 1 2 GLU O O -3.924 -0.122 -1.999 1.00 . A A . 2 GLU O 1 1 3 374 1 1 2 GLU OE1 O -7.226 2.563 -5.298 1.00 . A A . 2 GLU OE1 1 1 3 375 1 1 2 GLU OE2 O -9.172 2.347 -4.319 1.00 . A A . 2 GLU OE2 1 1 3 376 1 1 3 VAL C C -3.547 2.570 0.970 1.00 . A A . 3 VAL C 1 1 3 377 1 1 3 VAL CA C -3.669 2.196 -0.518 1.00 . A A . 3 VAL CA 1 1 3 378 1 1 3 VAL CB C -3.569 3.444 -1.435 1.00 . A A . 3 VAL CB 1 1 3 379 1 1 3 VAL CG1 C -4.723 4.410 -1.200 1.00 . A A . 3 VAL CG1 1 1 3 380 1 1 3 VAL CG2 C -2.224 4.144 -1.275 1.00 . A A . 3 VAL CG2 1 1 3 381 1 1 3 VAL H H -5.736 1.806 -0.374 1.00 . A A . 3 VAL H 1 1 3 382 1 1 3 VAL HA H -2.854 1.532 -0.770 1.00 . A A . 3 VAL HA 1 1 3 383 1 1 3 VAL HB H -3.643 3.100 -2.453 1.00 . A A . 3 VAL HB 1 1 3 384 1 1 3 VAL HG11 H -4.714 4.738 -0.171 1.00 . A A . 3 VAL HG11 1 1 3 385 1 1 3 VAL HG12 H -5.657 3.913 -1.412 1.00 . A A . 3 VAL HG12 1 1 3 386 1 1 3 VAL HG13 H -4.614 5.265 -1.851 1.00 . A A . 3 VAL HG13 1 1 3 387 1 1 3 VAL HG21 H -2.195 5.016 -1.910 1.00 . A A . 3 VAL HG21 1 1 3 388 1 1 3 VAL HG22 H -1.431 3.468 -1.557 1.00 . A A . 3 VAL HG22 1 1 3 389 1 1 3 VAL HG23 H -2.093 4.442 -0.246 1.00 . A A . 3 VAL HG23 1 1 3 390 1 1 3 VAL N N -4.908 1.480 -0.776 1.00 . A A . 3 VAL N 1 1 3 391 1 1 3 VAL O O -3.490 3.740 1.347 1.00 . A A . 3 VAL O 1 1 3 392 1 1 4 PRO C C -1.977 1.669 3.790 1.00 . A A . 4 PRO C 1 1 3 393 1 1 4 PRO CA C -3.414 1.751 3.289 1.00 . A A . 4 PRO CA 1 1 3 394 1 1 4 PRO CB C -4.240 0.569 3.830 1.00 . A A . 4 PRO CB 1 1 3 395 1 1 4 PRO CD C -3.576 0.135 1.553 1.00 . A A . 4 PRO CD 1 1 3 396 1 1 4 PRO CG C -4.472 -0.344 2.656 1.00 . A A . 4 PRO CG 1 1 3 397 1 1 4 PRO HA H -3.860 2.683 3.599 1.00 . A A . 4 PRO HA 1 1 3 398 1 1 4 PRO HB2 H -3.685 0.070 4.610 1.00 . A A . 4 PRO HB2 1 1 3 399 1 1 4 PRO HB3 H -5.174 0.934 4.227 1.00 . A A . 4 PRO HB3 1 1 3 400 1 1 4 PRO HD2 H -2.603 -0.330 1.620 1.00 . A A . 4 PRO HD2 1 1 3 401 1 1 4 PRO HD3 H -4.024 -0.038 0.587 1.00 . A A . 4 PRO HD3 1 1 3 402 1 1 4 PRO HG2 H -4.227 -1.362 2.923 1.00 . A A . 4 PRO HG2 1 1 3 403 1 1 4 PRO HG3 H -5.506 -0.275 2.345 1.00 . A A . 4 PRO HG3 1 1 3 404 1 1 4 PRO N N -3.504 1.559 1.851 1.00 . A A . 4 PRO N 1 1 3 405 1 1 4 PRO O O -1.731 1.428 4.971 1.00 . A A . 4 PRO O 1 1 3 406 1 1 5 SER C C 0.679 0.381 3.810 1.00 . A A . 5 SER C 1 1 3 407 1 1 5 SER CA C 0.392 1.718 3.145 1.00 . A A . 5 SER CA 1 1 3 408 1 1 5 SER CB C 0.899 2.873 4.011 1.00 . A A . 5 SER CB 1 1 3 409 1 1 5 SER H H -1.311 2.142 1.967 1.00 . A A . 5 SER H 1 1 3 410 1 1 5 SER HA H 0.909 1.738 2.199 1.00 . A A . 5 SER HA 1 1 3 411 1 1 5 SER HB2 H 0.286 2.951 4.896 1.00 . A A . 5 SER HB2 1 1 3 412 1 1 5 SER HB3 H 1.923 2.683 4.296 1.00 . A A . 5 SER HB3 1 1 3 413 1 1 5 SER HG H 1.620 4.630 3.528 1.00 . A A . 5 SER HG 1 1 3 414 1 1 5 SER N N -1.034 1.867 2.864 1.00 . A A . 5 SER N 1 1 3 415 1 1 5 SER O O 1.310 0.317 4.860 1.00 . A A . 5 SER O 1 1 3 416 1 1 5 SER OG O 0.840 4.101 3.305 1.00 . A A . 5 SER OG 1 1 3 417 1 1 6 GLY C C 0.832 -3.029 2.741 1.00 . A A . 6 GLY C 1 1 3 418 1 1 6 GLY CA C 0.383 -2.001 3.756 1.00 . A A . 6 GLY CA 1 1 3 419 1 1 6 GLY H H -0.242 -0.579 2.328 1.00 . A A . 6 GLY H 1 1 3 420 1 1 6 GLY HA2 H 1.125 -1.940 4.535 1.00 . A A . 6 GLY HA2 1 1 3 421 1 1 6 GLY HA3 H -0.552 -2.316 4.183 1.00 . A A . 6 GLY HA3 1 1 3 422 1 1 6 GLY N N 0.213 -0.686 3.185 1.00 . A A . 6 GLY N 1 1 3 423 1 1 6 GLY O O 2.024 -3.317 2.647 1.00 . A A . 6 GLY O 1 1 3 424 1 1 7 PRO C C 0.892 -3.953 -0.292 1.00 . A A . 7 PRO C 1 1 3 425 1 1 7 PRO CA C 0.226 -4.592 0.922 1.00 . A A . 7 PRO CA 1 1 3 426 1 1 7 PRO CB C -1.136 -5.178 0.528 1.00 . A A . 7 PRO CB 1 1 3 427 1 1 7 PRO CD C -1.544 -3.352 2.013 1.00 . A A . 7 PRO CD 1 1 3 428 1 1 7 PRO CG C -2.109 -4.653 1.533 1.00 . A A . 7 PRO CG 1 1 3 429 1 1 7 PRO HA H 0.862 -5.376 1.310 1.00 . A A . 7 PRO HA 1 1 3 430 1 1 7 PRO HB2 H -1.384 -4.849 -0.469 1.00 . A A . 7 PRO HB2 1 1 3 431 1 1 7 PRO HB3 H -1.086 -6.256 0.553 1.00 . A A . 7 PRO HB3 1 1 3 432 1 1 7 PRO HD2 H -1.828 -2.545 1.352 1.00 . A A . 7 PRO HD2 1 1 3 433 1 1 7 PRO HD3 H -1.864 -3.146 3.024 1.00 . A A . 7 PRO HD3 1 1 3 434 1 1 7 PRO HG2 H -3.070 -4.495 1.068 1.00 . A A . 7 PRO HG2 1 1 3 435 1 1 7 PRO HG3 H -2.198 -5.349 2.355 1.00 . A A . 7 PRO HG3 1 1 3 436 1 1 7 PRO N N -0.099 -3.601 1.955 1.00 . A A . 7 PRO N 1 1 3 437 1 1 7 PRO O O 0.400 -4.062 -1.415 1.00 . A A . 7 PRO O 1 1 3 438 1 1 8 ASN C C 1.918 -1.820 -2.061 1.00 . A A . 8 ASN C 1 1 3 439 1 1 8 ASN CA C 2.789 -2.538 -1.027 1.00 . A A . 8 ASN CA 1 1 3 440 1 1 8 ASN CB C 3.833 -3.429 -1.728 1.00 . A A . 8 ASN CB 1 1 3 441 1 1 8 ASN CG C 3.280 -4.742 -2.259 1.00 . A A . 8 ASN CG 1 1 3 442 1 1 8 ASN H H 2.334 -3.289 0.900 1.00 . A A . 8 ASN H 1 1 3 443 1 1 8 ASN HA H 3.326 -1.775 -0.481 1.00 . A A . 8 ASN HA 1 1 3 444 1 1 8 ASN HB2 H 4.245 -2.883 -2.563 1.00 . A A . 8 ASN HB2 1 1 3 445 1 1 8 ASN HB3 H 4.629 -3.649 -1.031 1.00 . A A . 8 ASN HB3 1 1 3 446 1 1 8 ASN HD21 H 3.740 -5.656 -0.558 1.00 . A A . 8 ASN HD21 1 1 3 447 1 1 8 ASN HD22 H 3.001 -6.646 -1.768 1.00 . A A . 8 ASN HD22 1 1 3 448 1 1 8 ASN N N 2.012 -3.283 -0.027 1.00 . A A . 8 ASN N 1 1 3 449 1 1 8 ASN ND2 N 3.345 -5.785 -1.446 1.00 . A A . 8 ASN ND2 1 1 3 450 1 1 8 ASN O O 2.018 -2.088 -3.258 1.00 . A A . 8 ASN O 1 1 3 451 1 1 8 ASN OD1 O 2.810 -4.821 -3.395 1.00 . A A . 8 ASN OD1 1 1 3 452 1 1 9 PRO C C 1.185 1.023 -3.131 1.00 . A A . 9 PRO C 1 1 3 453 1 1 9 PRO CA C 0.290 -0.053 -2.540 1.00 . A A . 9 PRO CA 1 1 3 454 1 1 9 PRO CB C -0.804 0.574 -1.668 1.00 . A A . 9 PRO CB 1 1 3 455 1 1 9 PRO CD C 0.775 -0.549 -0.225 1.00 . A A . 9 PRO CD 1 1 3 456 1 1 9 PRO CG C -0.607 0.041 -0.282 1.00 . A A . 9 PRO CG 1 1 3 457 1 1 9 PRO HA H -0.153 -0.636 -3.335 1.00 . A A . 9 PRO HA 1 1 3 458 1 1 9 PRO HB2 H -0.705 1.648 -1.689 1.00 . A A . 9 PRO HB2 1 1 3 459 1 1 9 PRO HB3 H -1.774 0.296 -2.058 1.00 . A A . 9 PRO HB3 1 1 3 460 1 1 9 PRO HD2 H 1.481 0.178 0.147 1.00 . A A . 9 PRO HD2 1 1 3 461 1 1 9 PRO HD3 H 0.781 -1.435 0.392 1.00 . A A . 9 PRO HD3 1 1 3 462 1 1 9 PRO HG2 H -0.693 0.847 0.430 1.00 . A A . 9 PRO HG2 1 1 3 463 1 1 9 PRO HG3 H -1.350 -0.716 -0.074 1.00 . A A . 9 PRO HG3 1 1 3 464 1 1 9 PRO N N 1.058 -0.883 -1.623 1.00 . A A . 9 PRO N 1 1 3 465 1 1 9 PRO O O 1.294 1.171 -4.348 1.00 . A A . 9 PRO O 1 1 3 466 1 1 10 ILE C C 4.057 2.590 -1.731 1.00 . A A . 10 ILE C 1 1 3 467 1 1 10 ILE CA C 2.845 2.734 -2.638 1.00 . A A . 10 ILE CA 1 1 3 468 1 1 10 ILE CB C 2.326 4.188 -2.572 1.00 . A A . 10 ILE CB 1 1 3 469 1 1 10 ILE CD1 C 0.536 5.772 -3.456 1.00 . A A . 10 ILE CD1 1 1 3 470 1 1 10 ILE CG1 C 1.113 4.374 -3.486 1.00 . A A . 10 ILE CG1 1 1 3 471 1 1 10 ILE CG2 C 3.432 5.161 -2.959 1.00 . A A . 10 ILE CG2 1 1 3 472 1 1 10 ILE H H 1.644 1.634 -1.286 1.00 . A A . 10 ILE H 1 1 3 473 1 1 10 ILE HA H 3.141 2.518 -3.655 1.00 . A A . 10 ILE HA 1 1 3 474 1 1 10 ILE HB H 2.038 4.399 -1.554 1.00 . A A . 10 ILE HB 1 1 3 475 1 1 10 ILE HD11 H -0.279 5.841 -4.159 1.00 . A A . 10 ILE HD11 1 1 3 476 1 1 10 ILE HD12 H 1.305 6.482 -3.725 1.00 . A A . 10 ILE HD12 1 1 3 477 1 1 10 ILE HD13 H 0.175 5.990 -2.462 1.00 . A A . 10 ILE HD13 1 1 3 478 1 1 10 ILE HG12 H 1.402 4.157 -4.504 1.00 . A A . 10 ILE HG12 1 1 3 479 1 1 10 ILE HG13 H 0.335 3.687 -3.186 1.00 . A A . 10 ILE HG13 1 1 3 480 1 1 10 ILE HG21 H 4.259 5.057 -2.274 1.00 . A A . 10 ILE HG21 1 1 3 481 1 1 10 ILE HG22 H 3.053 6.171 -2.916 1.00 . A A . 10 ILE HG22 1 1 3 482 1 1 10 ILE HG23 H 3.766 4.944 -3.963 1.00 . A A . 10 ILE HG23 1 1 3 483 1 1 10 ILE N N 1.839 1.760 -2.244 1.00 . A A . 10 ILE N 1 1 3 484 1 1 10 ILE O O 5.188 2.475 -2.198 1.00 . A A . 10 ILE O 1 1 3 485 1 1 11 SER C C 5.346 0.926 0.508 1.00 . A A . 11 SER C 1 1 3 486 1 1 11 SER CA C 4.854 2.373 0.553 1.00 . A A . 11 SER CA 1 1 3 487 1 1 11 SER CB C 4.323 2.709 1.947 1.00 . A A . 11 SER CB 1 1 3 488 1 1 11 SER H H 2.890 2.745 -0.118 1.00 . A A . 11 SER H 1 1 3 489 1 1 11 SER HA H 5.675 3.033 0.317 1.00 . A A . 11 SER HA 1 1 3 490 1 1 11 SER HB2 H 3.611 1.956 2.250 1.00 . A A . 11 SER HB2 1 1 3 491 1 1 11 SER HB3 H 5.146 2.732 2.648 1.00 . A A . 11 SER HB3 1 1 3 492 1 1 11 SER HG H 4.208 4.601 1.435 1.00 . A A . 11 SER HG 1 1 3 493 1 1 11 SER N N 3.805 2.584 -0.429 1.00 . A A . 11 SER N 1 1 3 494 1 1 11 SER O O 4.734 0.032 1.095 1.00 . A A . 11 SER O 1 1 3 495 1 1 11 SER OG O 3.682 3.975 1.952 1.00 . A A . 11 SER OG 1 1 3 496 1 1 12 ASN C C 8.543 -0.510 -0.194 1.00 . A A . 12 ASN C 1 1 3 497 1 1 12 ASN CA C 7.032 -0.622 -0.316 1.00 . A A . 12 ASN CA 1 1 3 498 1 1 12 ASN CB C 6.648 -1.311 -1.630 1.00 . A A . 12 ASN CB 1 1 3 499 1 1 12 ASN CG C 7.419 -2.597 -1.866 1.00 . A A . 12 ASN CG 1 1 3 500 1 1 12 ASN H H 6.831 1.443 -0.720 1.00 . A A . 12 ASN H 1 1 3 501 1 1 12 ASN HA H 6.664 -1.212 0.511 1.00 . A A . 12 ASN HA 1 1 3 502 1 1 12 ASN HB2 H 5.593 -1.552 -1.606 1.00 . A A . 12 ASN HB2 1 1 3 503 1 1 12 ASN HB3 H 6.840 -0.639 -2.454 1.00 . A A . 12 ASN HB3 1 1 3 504 1 1 12 ASN HD21 H 8.760 -1.629 -2.962 1.00 . A A . 12 ASN HD21 1 1 3 505 1 1 12 ASN HD22 H 9.026 -3.327 -2.774 1.00 . A A . 12 ASN HD22 1 1 3 506 1 1 12 ASN N N 6.427 0.699 -0.222 1.00 . A A . 12 ASN N 1 1 3 507 1 1 12 ASN ND2 N 8.511 -2.510 -2.608 1.00 . A A . 12 ASN ND2 1 1 3 508 1 1 12 ASN O O 9.186 -0.001 -1.135 1.00 . A A . 12 ASN O 1 1 3 509 1 1 12 ASN OXT O 9.085 -0.908 0.855 1.00 . A A . 12 ASN OXT 1 1 3 510 1 1 12 ASN OD1 O 7.028 -3.665 -1.395 1.00 . A A . 12 ASN OD1 1 1 4 511 1 1 1 HIS C C -7.103 -3.124 -1.585 1.00 . A A . 1 HIS C 1 1 4 512 1 1 1 HIS CA C -7.013 -4.569 -1.105 1.00 . A A . 1 HIS CA 1 1 4 513 1 1 1 HIS CB C -8.017 -4.803 0.032 1.00 . A A . 1 HIS CB 1 1 4 514 1 1 1 HIS CD2 C -8.768 -7.250 -0.390 1.00 . A A . 1 HIS CD2 1 1 4 515 1 1 1 HIS CE1 C -8.246 -8.091 1.565 1.00 . A A . 1 HIS CE1 1 1 4 516 1 1 1 HIS CG C -8.243 -6.249 0.356 1.00 . A A . 1 HIS CG 1 1 4 517 1 1 1 HIS H1 H -5.574 -5.897 -0.380 1.00 . A A . 1 HIS H1 1 1 4 518 1 1 1 HIS H2 H -5.355 -4.303 0.130 1.00 . A A . 1 HIS H2 1 1 4 519 1 1 1 HIS H3 H -4.967 -4.742 -1.453 1.00 . A A . 1 HIS H3 1 1 4 520 1 1 1 HIS HA H -7.266 -5.216 -1.930 1.00 . A A . 1 HIS HA 1 1 4 521 1 1 1 HIS HB2 H -7.657 -4.317 0.925 1.00 . A A . 1 HIS HB2 1 1 4 522 1 1 1 HIS HB3 H -8.968 -4.371 -0.246 1.00 . A A . 1 HIS HB3 1 1 4 523 1 1 1 HIS HD1 H -7.534 -6.337 2.343 1.00 . A A . 1 HIS HD1 1 1 4 524 1 1 1 HIS HD2 H -9.128 -7.171 -1.404 1.00 . A A . 1 HIS HD2 1 1 4 525 1 1 1 HIS HE1 H -8.110 -8.784 2.383 1.00 . A A . 1 HIS HE1 1 1 4 526 1 1 1 HIS HE2 H -8.986 -9.287 0.073 1.00 . A A . 1 HIS HE2 1 1 4 527 1 1 1 HIS N N -5.633 -4.900 -0.671 1.00 . A A . 1 HIS N 1 1 4 528 1 1 1 HIS ND1 N -7.927 -6.810 1.577 1.00 . A A . 1 HIS ND1 1 1 4 529 1 1 1 HIS NE2 N -8.758 -8.381 0.385 1.00 . A A . 1 HIS NE2 1 1 4 530 1 1 1 HIS O O -7.507 -2.865 -2.719 1.00 . A A . 1 HIS O 1 1 4 531 1 1 2 GLU C C -5.380 -0.157 -0.992 1.00 . A A . 2 GLU C 1 1 4 532 1 1 2 GLU CA C -6.779 -0.773 -1.079 1.00 . A A . 2 GLU CA 1 1 4 533 1 1 2 GLU CB C -7.766 -0.044 -0.159 1.00 . A A . 2 GLU CB 1 1 4 534 1 1 2 GLU CD C -9.210 1.992 0.224 1.00 . A A . 2 GLU CD 1 1 4 535 1 1 2 GLU CG C -8.225 1.306 -0.695 1.00 . A A . 2 GLU CG 1 1 4 536 1 1 2 GLU H H -6.399 -2.441 0.158 1.00 . A A . 2 GLU H 1 1 4 537 1 1 2 GLU HA H -7.128 -0.699 -2.100 1.00 . A A . 2 GLU HA 1 1 4 538 1 1 2 GLU HB2 H -8.638 -0.667 -0.021 1.00 . A A . 2 GLU HB2 1 1 4 539 1 1 2 GLU HB3 H -7.294 0.116 0.801 1.00 . A A . 2 GLU HB3 1 1 4 540 1 1 2 GLU HG2 H -7.361 1.951 -0.817 1.00 . A A . 2 GLU HG2 1 1 4 541 1 1 2 GLU HG3 H -8.696 1.155 -1.655 1.00 . A A . 2 GLU HG3 1 1 4 542 1 1 2 GLU N N -6.725 -2.183 -0.729 1.00 . A A . 2 GLU N 1 1 4 543 1 1 2 GLU O O -4.399 -0.769 -1.420 1.00 . A A . 2 GLU O 1 1 4 544 1 1 2 GLU OE1 O -8.774 2.603 1.220 1.00 . A A . 2 GLU OE1 1 1 4 545 1 1 2 GLU OE2 O -10.426 1.912 -0.038 1.00 . A A . 2 GLU OE2 1 1 4 546 1 1 3 VAL C C -3.776 2.394 0.975 1.00 . A A . 3 VAL C 1 1 4 547 1 1 3 VAL CA C -4.039 1.800 -0.418 1.00 . A A . 3 VAL CA 1 1 4 548 1 1 3 VAL CB C -4.088 2.938 -1.471 1.00 . A A . 3 VAL CB 1 1 4 549 1 1 3 VAL CG1 C -2.740 3.635 -1.599 1.00 . A A . 3 VAL CG1 1 1 4 550 1 1 3 VAL CG2 C -4.537 2.413 -2.827 1.00 . A A . 3 VAL CG2 1 1 4 551 1 1 3 VAL H H -6.063 1.411 0.044 1.00 . A A . 3 VAL H 1 1 4 552 1 1 3 VAL HA H -3.231 1.128 -0.674 1.00 . A A . 3 VAL HA 1 1 4 553 1 1 3 VAL HB H -4.817 3.665 -1.138 1.00 . A A . 3 VAL HB 1 1 4 554 1 1 3 VAL HG11 H -2.452 4.043 -0.641 1.00 . A A . 3 VAL HG11 1 1 4 555 1 1 3 VAL HG12 H -2.814 4.433 -2.322 1.00 . A A . 3 VAL HG12 1 1 4 556 1 1 3 VAL HG13 H -1.997 2.922 -1.924 1.00 . A A . 3 VAL HG13 1 1 4 557 1 1 3 VAL HG21 H -5.523 1.982 -2.739 1.00 . A A . 3 VAL HG21 1 1 4 558 1 1 3 VAL HG22 H -3.844 1.658 -3.168 1.00 . A A . 3 VAL HG22 1 1 4 559 1 1 3 VAL HG23 H -4.562 3.226 -3.537 1.00 . A A . 3 VAL HG23 1 1 4 560 1 1 3 VAL N N -5.283 1.039 -0.420 1.00 . A A . 3 VAL N 1 1 4 561 1 1 3 VAL O O -3.730 3.610 1.153 1.00 . A A . 3 VAL O 1 1 4 562 1 1 4 PRO C C -1.908 1.865 3.748 1.00 . A A . 4 PRO C 1 1 4 563 1 1 4 PRO CA C -3.386 1.953 3.370 1.00 . A A . 4 PRO CA 1 1 4 564 1 1 4 PRO CB C -4.204 0.921 4.163 1.00 . A A . 4 PRO CB 1 1 4 565 1 1 4 PRO CD C -3.721 0.086 1.946 1.00 . A A . 4 PRO CD 1 1 4 566 1 1 4 PRO CG C -4.492 -0.205 3.203 1.00 . A A . 4 PRO CG 1 1 4 567 1 1 4 PRO HA H -3.758 2.947 3.563 1.00 . A A . 4 PRO HA 1 1 4 568 1 1 4 PRO HB2 H -3.627 0.578 5.008 1.00 . A A . 4 PRO HB2 1 1 4 569 1 1 4 PRO HB3 H -5.118 1.378 4.510 1.00 . A A . 4 PRO HB3 1 1 4 570 1 1 4 PRO HD2 H -2.745 -0.373 1.980 1.00 . A A . 4 PRO HD2 1 1 4 571 1 1 4 PRO HD3 H -4.271 -0.238 1.073 1.00 . A A . 4 PRO HD3 1 1 4 572 1 1 4 PRO HG2 H -4.170 -1.143 3.629 1.00 . A A . 4 PRO HG2 1 1 4 573 1 1 4 PRO HG3 H -5.553 -0.232 2.989 1.00 . A A . 4 PRO HG3 1 1 4 574 1 1 4 PRO N N -3.625 1.537 1.998 1.00 . A A . 4 PRO N 1 1 4 575 1 1 4 PRO O O -1.565 1.662 4.914 1.00 . A A . 4 PRO O 1 1 4 576 1 1 5 SER C C 0.728 0.530 3.578 1.00 . A A . 5 SER C 1 1 4 577 1 1 5 SER CA C 0.396 1.857 2.909 1.00 . A A . 5 SER CA 1 1 4 578 1 1 5 SER CB C 0.978 3.027 3.708 1.00 . A A . 5 SER CB 1 1 4 579 1 1 5 SER H H -1.396 2.260 1.859 1.00 . A A . 5 SER H 1 1 4 580 1 1 5 SER HA H 0.836 1.856 1.924 1.00 . A A . 5 SER HA 1 1 4 581 1 1 5 SER HB2 H 0.474 3.095 4.661 1.00 . A A . 5 SER HB2 1 1 4 582 1 1 5 SER HB3 H 2.032 2.859 3.868 1.00 . A A . 5 SER HB3 1 1 4 583 1 1 5 SER HG H 1.219 4.966 3.523 1.00 . A A . 5 SER HG 1 1 4 584 1 1 5 SER N N -1.048 2.016 2.741 1.00 . A A . 5 SER N 1 1 4 585 1 1 5 SER O O 1.541 0.468 4.499 1.00 . A A . 5 SER O 1 1 4 586 1 1 5 SER OG O 0.808 4.253 3.013 1.00 . A A . 5 SER OG 1 1 4 587 1 1 6 GLY C C 0.747 -2.863 2.655 1.00 . A A . 6 GLY C 1 1 4 588 1 1 6 GLY CA C 0.297 -1.838 3.675 1.00 . A A . 6 GLY CA 1 1 4 589 1 1 6 GLY H H -0.513 -0.417 2.341 1.00 . A A . 6 GLY H 1 1 4 590 1 1 6 GLY HA2 H 1.049 -1.761 4.445 1.00 . A A . 6 GLY HA2 1 1 4 591 1 1 6 GLY HA3 H -0.628 -2.168 4.119 1.00 . A A . 6 GLY HA3 1 1 4 592 1 1 6 GLY N N 0.094 -0.528 3.098 1.00 . A A . 6 GLY N 1 1 4 593 1 1 6 GLY O O 1.943 -3.112 2.522 1.00 . A A . 6 GLY O 1 1 4 594 1 1 7 PRO C C 0.809 -3.875 -0.334 1.00 . A A . 7 PRO C 1 1 4 595 1 1 7 PRO CA C 0.113 -4.478 0.885 1.00 . A A . 7 PRO CA 1 1 4 596 1 1 7 PRO CB C -1.259 -5.019 0.492 1.00 . A A . 7 PRO CB 1 1 4 597 1 1 7 PRO CD C -1.651 -3.265 2.054 1.00 . A A . 7 PRO CD 1 1 4 598 1 1 7 PRO CG C -2.211 -3.925 0.828 1.00 . A A . 7 PRO CG 1 1 4 599 1 1 7 PRO HA H 0.717 -5.278 1.284 1.00 . A A . 7 PRO HA 1 1 4 600 1 1 7 PRO HB2 H -1.262 -5.238 -0.564 1.00 . A A . 7 PRO HB2 1 1 4 601 1 1 7 PRO HB3 H -1.472 -5.916 1.054 1.00 . A A . 7 PRO HB3 1 1 4 602 1 1 7 PRO HD2 H -1.891 -2.212 2.062 1.00 . A A . 7 PRO HD2 1 1 4 603 1 1 7 PRO HD3 H -2.026 -3.745 2.946 1.00 . A A . 7 PRO HD3 1 1 4 604 1 1 7 PRO HG2 H -2.263 -3.221 0.011 1.00 . A A . 7 PRO HG2 1 1 4 605 1 1 7 PRO HG3 H -3.187 -4.337 1.036 1.00 . A A . 7 PRO HG3 1 1 4 606 1 1 7 PRO N N -0.198 -3.476 1.919 1.00 . A A . 7 PRO N 1 1 4 607 1 1 7 PRO O O 0.250 -3.845 -1.432 1.00 . A A . 7 PRO O 1 1 4 608 1 1 8 ASN C C 2.094 -1.859 -2.099 1.00 . A A . 8 ASN C 1 1 4 609 1 1 8 ASN CA C 2.875 -2.740 -1.110 1.00 . A A . 8 ASN CA 1 1 4 610 1 1 8 ASN CB C 3.746 -3.771 -1.860 1.00 . A A . 8 ASN CB 1 1 4 611 1 1 8 ASN CG C 2.963 -4.876 -2.556 1.00 . A A . 8 ASN CG 1 1 4 612 1 1 8 ASN H H 2.382 -3.491 0.810 1.00 . A A . 8 ASN H 1 1 4 613 1 1 8 ASN HA H 3.542 -2.089 -0.563 1.00 . A A . 8 ASN HA 1 1 4 614 1 1 8 ASN HB2 H 4.320 -3.252 -2.611 1.00 . A A . 8 ASN HB2 1 1 4 615 1 1 8 ASN HB3 H 4.426 -4.226 -1.156 1.00 . A A . 8 ASN HB3 1 1 4 616 1 1 8 ASN HD21 H 3.021 -3.874 -4.265 1.00 . A A . 8 ASN HD21 1 1 4 617 1 1 8 ASN HD22 H 2.196 -5.393 -4.311 1.00 . A A . 8 ASN HD22 1 1 4 618 1 1 8 ASN N N 2.027 -3.395 -0.101 1.00 . A A . 8 ASN N 1 1 4 619 1 1 8 ASN ND2 N 2.701 -4.698 -3.839 1.00 . A A . 8 ASN ND2 1 1 4 620 1 1 8 ASN O O 2.210 -2.027 -3.310 1.00 . A A . 8 ASN O 1 1 4 621 1 1 8 ASN OD1 O 2.626 -5.896 -1.952 1.00 . A A . 8 ASN OD1 1 1 4 622 1 1 9 PRO C C 1.470 1.151 -2.976 1.00 . A A . 9 PRO C 1 1 4 623 1 1 9 PRO CA C 0.567 0.035 -2.466 1.00 . A A . 9 PRO CA 1 1 4 624 1 1 9 PRO CB C -0.534 0.597 -1.549 1.00 . A A . 9 PRO CB 1 1 4 625 1 1 9 PRO CD C 1.069 -0.575 -0.196 1.00 . A A . 9 PRO CD 1 1 4 626 1 1 9 PRO CG C -0.347 -0.072 -0.222 1.00 . A A . 9 PRO CG 1 1 4 627 1 1 9 PRO HA H 0.120 -0.480 -3.305 1.00 . A A . 9 PRO HA 1 1 4 628 1 1 9 PRO HB2 H -0.419 1.668 -1.468 1.00 . A A . 9 PRO HB2 1 1 4 629 1 1 9 PRO HB3 H -1.502 0.370 -1.970 1.00 . A A . 9 PRO HB3 1 1 4 630 1 1 9 PRO HD2 H 1.741 0.194 0.158 1.00 . A A . 9 PRO HD2 1 1 4 631 1 1 9 PRO HD3 H 1.147 -1.463 0.413 1.00 . A A . 9 PRO HD3 1 1 4 632 1 1 9 PRO HG2 H -0.504 0.641 0.573 1.00 . A A . 9 PRO HG2 1 1 4 633 1 1 9 PRO HG3 H -1.038 -0.897 -0.127 1.00 . A A . 9 PRO HG3 1 1 4 634 1 1 9 PRO N N 1.307 -0.880 -1.604 1.00 . A A . 9 PRO N 1 1 4 635 1 1 9 PRO O O 1.807 1.207 -4.159 1.00 . A A . 9 PRO O 1 1 4 636 1 1 10 ILE C C 3.976 3.006 -1.361 1.00 . A A . 10 ILE C 1 1 4 637 1 1 10 ILE CA C 2.849 3.067 -2.391 1.00 . A A . 10 ILE CA 1 1 4 638 1 1 10 ILE CB C 2.211 4.481 -2.416 1.00 . A A . 10 ILE CB 1 1 4 639 1 1 10 ILE CD1 C 0.155 5.783 -3.199 1.00 . A A . 10 ILE CD1 1 1 4 640 1 1 10 ILE CG1 C 0.866 4.447 -3.152 1.00 . A A . 10 ILE CG1 1 1 4 641 1 1 10 ILE CG2 C 3.146 5.478 -3.095 1.00 . A A . 10 ILE CG2 1 1 4 642 1 1 10 ILE H H 1.510 1.984 -1.155 1.00 . A A . 10 ILE H 1 1 4 643 1 1 10 ILE HA H 3.255 2.852 -3.371 1.00 . A A . 10 ILE HA 1 1 4 644 1 1 10 ILE HB H 2.054 4.804 -1.399 1.00 . A A . 10 ILE HB 1 1 4 645 1 1 10 ILE HD11 H 0.791 6.513 -3.676 1.00 . A A . 10 ILE HD11 1 1 4 646 1 1 10 ILE HD12 H -0.074 6.105 -2.194 1.00 . A A . 10 ILE HD12 1 1 4 647 1 1 10 ILE HD13 H -0.761 5.682 -3.761 1.00 . A A . 10 ILE HD13 1 1 4 648 1 1 10 ILE HG12 H 1.031 4.128 -4.171 1.00 . A A . 10 ILE HG12 1 1 4 649 1 1 10 ILE HG13 H 0.214 3.740 -2.661 1.00 . A A . 10 ILE HG13 1 1 4 650 1 1 10 ILE HG21 H 2.686 6.455 -3.102 1.00 . A A . 10 ILE HG21 1 1 4 651 1 1 10 ILE HG22 H 3.333 5.160 -4.111 1.00 . A A . 10 ILE HG22 1 1 4 652 1 1 10 ILE HG23 H 4.080 5.522 -2.555 1.00 . A A . 10 ILE HG23 1 1 4 653 1 1 10 ILE N N 1.876 2.031 -2.069 1.00 . A A . 10 ILE N 1 1 4 654 1 1 10 ILE O O 4.727 3.958 -1.153 1.00 . A A . 10 ILE O 1 1 4 655 1 1 11 SER C C 5.307 0.115 0.454 1.00 . A A . 11 SER C 1 1 4 656 1 1 11 SER CA C 5.076 1.616 0.306 1.00 . A A . 11 SER CA 1 1 4 657 1 1 11 SER CB C 4.621 2.227 1.638 1.00 . A A . 11 SER CB 1 1 4 658 1 1 11 SER H H 3.467 1.125 -0.956 1.00 . A A . 11 SER H 1 1 4 659 1 1 11 SER HA H 5.996 2.085 -0.006 1.00 . A A . 11 SER HA 1 1 4 660 1 1 11 SER HB2 H 4.437 3.281 1.501 1.00 . A A . 11 SER HB2 1 1 4 661 1 1 11 SER HB3 H 3.711 1.743 1.959 1.00 . A A . 11 SER HB3 1 1 4 662 1 1 11 SER HG H 6.356 2.642 2.459 1.00 . A A . 11 SER HG 1 1 4 663 1 1 11 SER N N 4.078 1.851 -0.719 1.00 . A A . 11 SER N 1 1 4 664 1 1 11 SER O O 4.381 -0.635 0.769 1.00 . A A . 11 SER O 1 1 4 665 1 1 11 SER OG O 5.604 2.066 2.647 1.00 . A A . 11 SER OG 1 1 4 666 1 1 12 ASN C C 8.286 -1.881 0.835 1.00 . A A . 12 ASN C 1 1 4 667 1 1 12 ASN CA C 6.884 -1.724 0.274 1.00 . A A . 12 ASN CA 1 1 4 668 1 1 12 ASN CB C 6.787 -2.392 -1.103 1.00 . A A . 12 ASN CB 1 1 4 669 1 1 12 ASN CG C 7.700 -1.765 -2.142 1.00 . A A . 12 ASN CG 1 1 4 670 1 1 12 ASN H H 7.229 0.337 -0.027 1.00 . A A . 12 ASN H 1 1 4 671 1 1 12 ASN HA H 6.188 -2.203 0.947 1.00 . A A . 12 ASN HA 1 1 4 672 1 1 12 ASN HB2 H 7.053 -3.433 -1.005 1.00 . A A . 12 ASN HB2 1 1 4 673 1 1 12 ASN HB3 H 5.768 -2.322 -1.456 1.00 . A A . 12 ASN HB3 1 1 4 674 1 1 12 ASN HD21 H 9.135 -3.072 -1.721 1.00 . A A . 12 ASN HD21 1 1 4 675 1 1 12 ASN HD22 H 9.510 -1.910 -2.946 1.00 . A A . 12 ASN HD22 1 1 4 676 1 1 12 ASN N N 6.532 -0.314 0.202 1.00 . A A . 12 ASN N 1 1 4 677 1 1 12 ASN ND2 N 8.901 -2.303 -2.285 1.00 . A A . 12 ASN ND2 1 1 4 678 1 1 12 ASN O O 9.136 -1.011 0.552 1.00 . A A . 12 ASN O 1 1 4 679 1 1 12 ASN OXT O 8.533 -2.872 1.549 1.00 . A A . 12 ASN OXT 1 1 4 680 1 1 12 ASN OD1 O 7.319 -0.814 -2.825 1.00 . A A . 12 ASN OD1 1 1 5 681 1 1 1 HIS C C -6.382 -1.750 -3.058 1.00 . A A . 1 HIS C 1 1 5 682 1 1 1 HIS CA C -6.451 -3.207 -2.605 1.00 . A A . 1 HIS CA 1 1 5 683 1 1 1 HIS CB C -7.618 -3.418 -1.630 1.00 . A A . 1 HIS CB 1 1 5 684 1 1 1 HIS CD2 C -9.719 -1.980 -2.156 1.00 . A A . 1 HIS CD2 1 1 5 685 1 1 1 HIS CE1 C -10.865 -3.479 -3.269 1.00 . A A . 1 HIS CE1 1 1 5 686 1 1 1 HIS CG C -8.972 -3.109 -2.205 1.00 . A A . 1 HIS CG 1 1 5 687 1 1 1 HIS H1 H -4.993 -3.071 -1.122 1.00 . A A . 1 HIS H1 1 1 5 688 1 1 1 HIS H2 H -4.389 -3.479 -2.645 1.00 . A A . 1 HIS H2 1 1 5 689 1 1 1 HIS H3 H -5.214 -4.633 -1.729 1.00 . A A . 1 HIS H3 1 1 5 690 1 1 1 HIS HA H -6.610 -3.824 -3.477 1.00 . A A . 1 HIS HA 1 1 5 691 1 1 1 HIS HB2 H -7.626 -4.449 -1.315 1.00 . A A . 1 HIS HB2 1 1 5 692 1 1 1 HIS HB3 H -7.472 -2.789 -0.769 1.00 . A A . 1 HIS HB3 1 1 5 693 1 1 1 HIS HD1 H -9.449 -4.952 -3.123 1.00 . A A . 1 HIS HD1 1 1 5 694 1 1 1 HIS HD2 H -9.445 -1.049 -1.682 1.00 . A A . 1 HIS HD2 1 1 5 695 1 1 1 HIS HE1 H -11.650 -3.963 -3.830 1.00 . A A . 1 HIS HE1 1 1 5 696 1 1 1 HIS HE2 H -11.589 -1.580 -3.019 1.00 . A A . 1 HIS HE2 1 1 5 697 1 1 1 HIS N N -5.176 -3.625 -1.981 1.00 . A A . 1 HIS N 1 1 5 698 1 1 1 HIS ND1 N -9.721 -4.029 -2.909 1.00 . A A . 1 HIS ND1 1 1 5 699 1 1 1 HIS NE2 N -10.887 -2.239 -2.824 1.00 . A A . 1 HIS NE2 1 1 5 700 1 1 1 HIS O O -6.273 -1.477 -4.251 1.00 . A A . 1 HIS O 1 1 5 701 1 1 2 GLU C C -5.063 1.233 -2.156 1.00 . A A . 2 GLU C 1 1 5 702 1 1 2 GLU CA C -6.420 0.603 -2.474 1.00 . A A . 2 GLU CA 1 1 5 703 1 1 2 GLU CB C -7.554 1.365 -1.776 1.00 . A A . 2 GLU CB 1 1 5 704 1 1 2 GLU CD C -8.076 2.902 -3.712 1.00 . A A . 2 GLU CD 1 1 5 705 1 1 2 GLU CG C -7.709 2.803 -2.247 1.00 . A A . 2 GLU CG 1 1 5 706 1 1 2 GLU H H -6.500 -1.068 -1.170 1.00 . A A . 2 GLU H 1 1 5 707 1 1 2 GLU HA H -6.575 0.662 -3.541 1.00 . A A . 2 GLU HA 1 1 5 708 1 1 2 GLU HB2 H -8.484 0.850 -1.961 1.00 . A A . 2 GLU HB2 1 1 5 709 1 1 2 GLU HB3 H -7.365 1.375 -0.714 1.00 . A A . 2 GLU HB3 1 1 5 710 1 1 2 GLU HG2 H -8.482 3.278 -1.664 1.00 . A A . 2 GLU HG2 1 1 5 711 1 1 2 GLU HG3 H -6.772 3.319 -2.090 1.00 . A A . 2 GLU HG3 1 1 5 712 1 1 2 GLU N N -6.440 -0.811 -2.116 1.00 . A A . 2 GLU N 1 1 5 713 1 1 2 GLU O O -4.144 1.164 -2.973 1.00 . A A . 2 GLU O 1 1 5 714 1 1 2 GLU OE1 O -9.241 2.620 -4.061 1.00 . A A . 2 GLU OE1 1 1 5 715 1 1 2 GLU OE2 O -7.204 3.274 -4.522 1.00 . A A . 2 GLU OE2 1 1 5 716 1 1 3 VAL C C -3.517 2.588 0.941 1.00 . A A . 3 VAL C 1 1 5 717 1 1 3 VAL CA C -3.672 2.467 -0.594 1.00 . A A . 3 VAL CA 1 1 5 718 1 1 3 VAL CB C -3.572 3.850 -1.287 1.00 . A A . 3 VAL CB 1 1 5 719 1 1 3 VAL CG1 C -4.601 4.841 -0.749 1.00 . A A . 3 VAL CG1 1 1 5 720 1 1 3 VAL CG2 C -2.160 4.414 -1.200 1.00 . A A . 3 VAL CG2 1 1 5 721 1 1 3 VAL H H -5.678 1.857 -0.353 1.00 . A A . 3 VAL H 1 1 5 722 1 1 3 VAL HA H -2.868 1.852 -0.970 1.00 . A A . 3 VAL HA 1 1 5 723 1 1 3 VAL HB H -3.803 3.692 -2.328 1.00 . A A . 3 VAL HB 1 1 5 724 1 1 3 VAL HG11 H -5.594 4.443 -0.893 1.00 . A A . 3 VAL HG11 1 1 5 725 1 1 3 VAL HG12 H -4.507 5.778 -1.278 1.00 . A A . 3 VAL HG12 1 1 5 726 1 1 3 VAL HG13 H -4.426 5.002 0.304 1.00 . A A . 3 VAL HG13 1 1 5 727 1 1 3 VAL HG21 H -1.873 4.506 -0.162 1.00 . A A . 3 VAL HG21 1 1 5 728 1 1 3 VAL HG22 H -2.132 5.386 -1.668 1.00 . A A . 3 VAL HG22 1 1 5 729 1 1 3 VAL HG23 H -1.475 3.751 -1.706 1.00 . A A . 3 VAL HG23 1 1 5 730 1 1 3 VAL N N -4.924 1.827 -0.972 1.00 . A A . 3 VAL N 1 1 5 731 1 1 3 VAL O O -3.284 3.669 1.484 1.00 . A A . 3 VAL O 1 1 5 732 1 1 4 PRO C C -2.063 1.548 3.629 1.00 . A A . 4 PRO C 1 1 5 733 1 1 4 PRO CA C -3.507 1.464 3.140 1.00 . A A . 4 PRO CA 1 1 5 734 1 1 4 PRO CB C -4.129 0.120 3.553 1.00 . A A . 4 PRO CB 1 1 5 735 1 1 4 PRO CD C -3.805 0.101 1.174 1.00 . A A . 4 PRO CD 1 1 5 736 1 1 4 PRO CG C -4.581 -0.534 2.288 1.00 . A A . 4 PRO CG 1 1 5 737 1 1 4 PRO HA H -4.076 2.275 3.571 1.00 . A A . 4 PRO HA 1 1 5 738 1 1 4 PRO HB2 H -3.387 -0.477 4.059 1.00 . A A . 4 PRO HB2 1 1 5 739 1 1 4 PRO HB3 H -4.961 0.299 4.215 1.00 . A A . 4 PRO HB3 1 1 5 740 1 1 4 PRO HD2 H -2.862 -0.406 1.029 1.00 . A A . 4 PRO HD2 1 1 5 741 1 1 4 PRO HD3 H -4.382 0.107 0.262 1.00 . A A . 4 PRO HD3 1 1 5 742 1 1 4 PRO HG2 H -4.377 -1.595 2.330 1.00 . A A . 4 PRO HG2 1 1 5 743 1 1 4 PRO HG3 H -5.637 -0.361 2.153 1.00 . A A . 4 PRO HG3 1 1 5 744 1 1 4 PRO N N -3.603 1.460 1.677 1.00 . A A . 4 PRO N 1 1 5 745 1 1 4 PRO O O -1.792 1.432 4.826 1.00 . A A . 4 PRO O 1 1 5 746 1 1 5 SER C C 0.798 0.535 3.606 1.00 . A A . 5 SER C 1 1 5 747 1 1 5 SER CA C 0.288 1.828 2.967 1.00 . A A . 5 SER CA 1 1 5 748 1 1 5 SER CB C 0.584 3.037 3.866 1.00 . A A . 5 SER CB 1 1 5 749 1 1 5 SER H H -1.447 1.851 1.759 1.00 . A A . 5 SER H 1 1 5 750 1 1 5 SER HA H 0.794 1.960 2.021 1.00 . A A . 5 SER HA 1 1 5 751 1 1 5 SER HB2 H 0.166 3.926 3.419 1.00 . A A . 5 SER HB2 1 1 5 752 1 1 5 SER HB3 H 0.137 2.879 4.836 1.00 . A A . 5 SER HB3 1 1 5 753 1 1 5 SER HG H 2.362 2.434 4.428 1.00 . A A . 5 SER HG 1 1 5 754 1 1 5 SER N N -1.145 1.743 2.683 1.00 . A A . 5 SER N 1 1 5 755 1 1 5 SER O O 1.799 0.527 4.322 1.00 . A A . 5 SER O 1 1 5 756 1 1 5 SER OG O 1.978 3.229 4.033 1.00 . A A . 5 SER OG 1 1 5 757 1 1 6 GLY C C 1.023 -2.789 2.821 1.00 . A A . 6 GLY C 1 1 5 758 1 1 6 GLY CA C 0.487 -1.843 3.875 1.00 . A A . 6 GLY CA 1 1 5 759 1 1 6 GLY H H -0.661 -0.491 2.724 1.00 . A A . 6 GLY H 1 1 5 760 1 1 6 GLY HA2 H 1.246 -1.688 4.626 1.00 . A A . 6 GLY HA2 1 1 5 761 1 1 6 GLY HA3 H -0.380 -2.290 4.338 1.00 . A A . 6 GLY HA3 1 1 5 762 1 1 6 GLY N N 0.110 -0.559 3.318 1.00 . A A . 6 GLY N 1 1 5 763 1 1 6 GLY O O 2.227 -2.813 2.568 1.00 . A A . 6 GLY O 1 1 5 764 1 1 7 PRO C C 0.978 -3.880 -0.158 1.00 . A A . 7 PRO C 1 1 5 765 1 1 7 PRO CA C 0.539 -4.545 1.148 1.00 . A A . 7 PRO CA 1 1 5 766 1 1 7 PRO CB C -0.730 -5.366 0.923 1.00 . A A . 7 PRO CB 1 1 5 767 1 1 7 PRO CD C -1.311 -3.600 2.428 1.00 . A A . 7 PRO CD 1 1 5 768 1 1 7 PRO CG C -1.847 -4.468 1.325 1.00 . A A . 7 PRO CG 1 1 5 769 1 1 7 PRO HA H 1.328 -5.191 1.501 1.00 . A A . 7 PRO HA 1 1 5 770 1 1 7 PRO HB2 H -0.797 -5.638 -0.118 1.00 . A A . 7 PRO HB2 1 1 5 771 1 1 7 PRO HB3 H -0.701 -6.256 1.533 1.00 . A A . 7 PRO HB3 1 1 5 772 1 1 7 PRO HD2 H -1.729 -2.607 2.362 1.00 . A A . 7 PRO HD2 1 1 5 773 1 1 7 PRO HD3 H -1.529 -4.039 3.390 1.00 . A A . 7 PRO HD3 1 1 5 774 1 1 7 PRO HG2 H -2.151 -3.863 0.486 1.00 . A A . 7 PRO HG2 1 1 5 775 1 1 7 PRO HG3 H -2.677 -5.056 1.683 1.00 . A A . 7 PRO HG3 1 1 5 776 1 1 7 PRO N N 0.143 -3.577 2.180 1.00 . A A . 7 PRO N 1 1 5 777 1 1 7 PRO O O 0.219 -3.834 -1.130 1.00 . A A . 7 PRO O 1 1 5 778 1 1 8 ASN C C 1.871 -1.869 -2.153 1.00 . A A . 8 ASN C 1 1 5 779 1 1 8 ASN CA C 2.844 -2.688 -1.291 1.00 . A A . 8 ASN CA 1 1 5 780 1 1 8 ASN CB C 3.627 -3.690 -2.164 1.00 . A A . 8 ASN CB 1 1 5 781 1 1 8 ASN CG C 2.816 -4.898 -2.611 1.00 . A A . 8 ASN CG 1 1 5 782 1 1 8 ASN H H 2.723 -3.435 0.689 1.00 . A A . 8 ASN H 1 1 5 783 1 1 8 ASN HA H 3.558 -1.995 -0.873 1.00 . A A . 8 ASN HA 1 1 5 784 1 1 8 ASN HB2 H 3.973 -3.179 -3.049 1.00 . A A . 8 ASN HB2 1 1 5 785 1 1 8 ASN HB3 H 4.484 -4.041 -1.608 1.00 . A A . 8 ASN HB3 1 1 5 786 1 1 8 ASN HD21 H 3.421 -5.931 -1.026 1.00 . A A . 8 ASN HD21 1 1 5 787 1 1 8 ASN HD22 H 2.357 -6.764 -2.105 1.00 . A A . 8 ASN HD22 1 1 5 788 1 1 8 ASN N N 2.209 -3.362 -0.144 1.00 . A A . 8 ASN N 1 1 5 789 1 1 8 ASN ND2 N 2.869 -5.971 -1.836 1.00 . A A . 8 ASN ND2 1 1 5 790 1 1 8 ASN O O 1.739 -2.112 -3.349 1.00 . A A . 8 ASN O 1 1 5 791 1 1 8 ASN OD1 O 2.162 -4.873 -3.652 1.00 . A A . 8 ASN OD1 1 1 5 792 1 1 9 PRO C C 1.102 1.244 -2.806 1.00 . A A . 9 PRO C 1 1 5 793 1 1 9 PRO CA C 0.317 0.033 -2.313 1.00 . A A . 9 PRO CA 1 1 5 794 1 1 9 PRO CB C -0.738 0.460 -1.278 1.00 . A A . 9 PRO CB 1 1 5 795 1 1 9 PRO CD C 1.122 -0.574 -0.138 1.00 . A A . 9 PRO CD 1 1 5 796 1 1 9 PRO CG C -0.308 -0.144 0.031 1.00 . A A . 9 PRO CG 1 1 5 797 1 1 9 PRO HA H -0.161 -0.459 -3.147 1.00 . A A . 9 PRO HA 1 1 5 798 1 1 9 PRO HB2 H -0.766 1.538 -1.219 1.00 . A A . 9 PRO HB2 1 1 5 799 1 1 9 PRO HB3 H -1.707 0.090 -1.579 1.00 . A A . 9 PRO HB3 1 1 5 800 1 1 9 PRO HD2 H 1.796 0.232 0.115 1.00 . A A . 9 PRO HD2 1 1 5 801 1 1 9 PRO HD3 H 1.331 -1.452 0.455 1.00 . A A . 9 PRO HD3 1 1 5 802 1 1 9 PRO HG2 H -0.385 0.593 0.815 1.00 . A A . 9 PRO HG2 1 1 5 803 1 1 9 PRO HG3 H -0.929 -0.997 0.259 1.00 . A A . 9 PRO HG3 1 1 5 804 1 1 9 PRO N N 1.174 -0.878 -1.564 1.00 . A A . 9 PRO N 1 1 5 805 1 1 9 PRO O O 1.272 1.454 -4.007 1.00 . A A . 9 PRO O 1 1 5 806 1 1 10 ILE C C 3.771 2.898 -1.380 1.00 . A A . 10 ILE C 1 1 5 807 1 1 10 ILE CA C 2.472 3.135 -2.148 1.00 . A A . 10 ILE CA 1 1 5 808 1 1 10 ILE CB C 1.827 4.485 -1.749 1.00 . A A . 10 ILE CB 1 1 5 809 1 1 10 ILE CD1 C 2.011 7.012 -2.032 1.00 . A A . 10 ILE CD1 1 1 5 810 1 1 10 ILE CG1 C 2.631 5.660 -2.313 1.00 . A A . 10 ILE CG1 1 1 5 811 1 1 10 ILE CG2 C 1.698 4.594 -0.234 1.00 . A A . 10 ILE CG2 1 1 5 812 1 1 10 ILE H H 1.319 1.873 -0.926 1.00 . A A . 10 ILE H 1 1 5 813 1 1 10 ILE HA H 2.677 3.139 -3.209 1.00 . A A . 10 ILE HA 1 1 5 814 1 1 10 ILE HB H 0.831 4.511 -2.166 1.00 . A A . 10 ILE HB 1 1 5 815 1 1 10 ILE HD11 H 1.021 7.051 -2.463 1.00 . A A . 10 ILE HD11 1 1 5 816 1 1 10 ILE HD12 H 2.625 7.786 -2.469 1.00 . A A . 10 ILE HD12 1 1 5 817 1 1 10 ILE HD13 H 1.945 7.163 -0.966 1.00 . A A . 10 ILE HD13 1 1 5 818 1 1 10 ILE HG12 H 3.617 5.650 -1.876 1.00 . A A . 10 ILE HG12 1 1 5 819 1 1 10 ILE HG13 H 2.716 5.549 -3.384 1.00 . A A . 10 ILE HG13 1 1 5 820 1 1 10 ILE HG21 H 2.675 4.504 0.217 1.00 . A A . 10 ILE HG21 1 1 5 821 1 1 10 ILE HG22 H 1.058 3.804 0.132 1.00 . A A . 10 ILE HG22 1 1 5 822 1 1 10 ILE HG23 H 1.270 5.552 0.023 1.00 . A A . 10 ILE HG23 1 1 5 823 1 1 10 ILE N N 1.579 2.034 -1.857 1.00 . A A . 10 ILE N 1 1 5 824 1 1 10 ILE O O 4.651 3.753 -1.293 1.00 . A A . 10 ILE O 1 1 5 825 1 1 11 SER C C 5.667 0.070 -0.507 1.00 . A A . 11 SER C 1 1 5 826 1 1 11 SER CA C 4.968 1.314 0.030 1.00 . A A . 11 SER CA 1 1 5 827 1 1 11 SER CB C 4.423 1.039 1.431 1.00 . A A . 11 SER CB 1 1 5 828 1 1 11 SER H H 3.197 1.019 -1.062 1.00 . A A . 11 SER H 1 1 5 829 1 1 11 SER HA H 5.671 2.132 0.070 1.00 . A A . 11 SER HA 1 1 5 830 1 1 11 SER HB2 H 3.951 0.069 1.448 1.00 . A A . 11 SER HB2 1 1 5 831 1 1 11 SER HB3 H 5.234 1.059 2.143 1.00 . A A . 11 SER HB3 1 1 5 832 1 1 11 SER HG H 3.821 2.558 2.519 1.00 . A A . 11 SER HG 1 1 5 833 1 1 11 SER N N 3.874 1.689 -0.846 1.00 . A A . 11 SER N 1 1 5 834 1 1 11 SER O O 5.400 -1.045 -0.060 1.00 . A A . 11 SER O 1 1 5 835 1 1 11 SER OG O 3.465 2.019 1.802 1.00 . A A . 11 SER OG 1 1 5 836 1 1 12 ASN C C 8.552 -0.329 -2.732 1.00 . A A . 12 ASN C 1 1 5 837 1 1 12 ASN CA C 7.277 -0.837 -2.076 1.00 . A A . 12 ASN CA 1 1 5 838 1 1 12 ASN CB C 6.405 -1.631 -3.072 1.00 . A A . 12 ASN CB 1 1 5 839 1 1 12 ASN CG C 5.517 -0.772 -3.970 1.00 . A A . 12 ASN CG 1 1 5 840 1 1 12 ASN H H 6.697 1.178 -1.807 1.00 . A A . 12 ASN H 1 1 5 841 1 1 12 ASN HA H 7.560 -1.499 -1.270 1.00 . A A . 12 ASN HA 1 1 5 842 1 1 12 ASN HB2 H 7.052 -2.213 -3.709 1.00 . A A . 12 ASN HB2 1 1 5 843 1 1 12 ASN HB3 H 5.769 -2.306 -2.514 1.00 . A A . 12 ASN HB3 1 1 5 844 1 1 12 ASN HD21 H 6.938 0.603 -4.166 1.00 . A A . 12 ASN HD21 1 1 5 845 1 1 12 ASN HD22 H 5.453 0.927 -4.999 1.00 . A A . 12 ASN HD22 1 1 5 846 1 1 12 ASN N N 6.536 0.264 -1.482 1.00 . A A . 12 ASN N 1 1 5 847 1 1 12 ASN ND2 N 6.016 0.366 -4.424 1.00 . A A . 12 ASN ND2 1 1 5 848 1 1 12 ASN O O 9.566 -0.201 -2.019 1.00 . A A . 12 ASN O 1 1 5 849 1 1 12 ASN OXT O 8.537 -0.036 -3.940 1.00 . A A . 12 ASN OXT 1 1 5 850 1 1 12 ASN OD1 O 4.391 -1.158 -4.284 1.00 . A A . 12 ASN OD1 1 1 6 851 1 1 1 HIS C C -7.062 -2.768 -1.443 1.00 . A A . 1 HIS C 1 1 6 852 1 1 1 HIS CA C -6.773 -4.047 -0.666 1.00 . A A . 1 HIS CA 1 1 6 853 1 1 1 HIS CB C -6.862 -5.268 -1.594 1.00 . A A . 1 HIS CB 1 1 6 854 1 1 1 HIS CD2 C -4.521 -5.897 -2.525 1.00 . A A . 1 HIS CD2 1 1 6 855 1 1 1 HIS CE1 C -4.774 -5.151 -4.569 1.00 . A A . 1 HIS CE1 1 1 6 856 1 1 1 HIS CG C -5.763 -5.365 -2.612 1.00 . A A . 1 HIS CG 1 1 6 857 1 1 1 HIS H1 H -7.530 -5.035 1.000 1.00 . A A . 1 HIS H1 1 1 6 858 1 1 1 HIS H2 H -8.707 -4.263 0.066 1.00 . A A . 1 HIS H2 1 1 6 859 1 1 1 HIS H3 H -7.693 -3.356 1.067 1.00 . A A . 1 HIS H3 1 1 6 860 1 1 1 HIS HA H -5.778 -3.986 -0.248 1.00 . A A . 1 HIS HA 1 1 6 861 1 1 1 HIS HB2 H -6.833 -6.165 -0.996 1.00 . A A . 1 HIS HB2 1 1 6 862 1 1 1 HIS HB3 H -7.800 -5.232 -2.126 1.00 . A A . 1 HIS HB3 1 1 6 863 1 1 1 HIS HD1 H -6.683 -4.467 -4.286 1.00 . A A . 1 HIS HD1 1 1 6 864 1 1 1 HIS HD2 H -4.081 -6.355 -1.653 1.00 . A A . 1 HIS HD2 1 1 6 865 1 1 1 HIS HE1 H -4.587 -4.902 -5.602 1.00 . A A . 1 HIS HE1 1 1 6 866 1 1 1 HIS HE2 H -3.112 -6.220 -4.045 1.00 . A A . 1 HIS HE2 1 1 6 867 1 1 1 HIS N N -7.741 -4.184 0.444 1.00 . A A . 1 HIS N 1 1 6 868 1 1 1 HIS ND1 N -5.889 -4.905 -3.905 1.00 . A A . 1 HIS ND1 1 1 6 869 1 1 1 HIS NE2 N -3.928 -5.752 -3.755 1.00 . A A . 1 HIS NE2 1 1 6 870 1 1 1 HIS O O -7.551 -2.811 -2.574 1.00 . A A . 1 HIS O 1 1 6 871 1 1 2 GLU C C -5.685 0.436 -1.540 1.00 . A A . 2 GLU C 1 1 6 872 1 1 2 GLU CA C -6.996 -0.346 -1.476 1.00 . A A . 2 GLU CA 1 1 6 873 1 1 2 GLU CB C -8.083 0.463 -0.755 1.00 . A A . 2 GLU CB 1 1 6 874 1 1 2 GLU CD C -9.002 1.565 -2.834 1.00 . A A . 2 GLU CD 1 1 6 875 1 1 2 GLU CG C -8.447 1.774 -1.442 1.00 . A A . 2 GLU CG 1 1 6 876 1 1 2 GLU H H -6.441 -1.649 0.095 1.00 . A A . 2 GLU H 1 1 6 877 1 1 2 GLU HA H -7.324 -0.545 -2.485 1.00 . A A . 2 GLU HA 1 1 6 878 1 1 2 GLU HB2 H -8.976 -0.141 -0.689 1.00 . A A . 2 GLU HB2 1 1 6 879 1 1 2 GLU HB3 H -7.742 0.687 0.244 1.00 . A A . 2 GLU HB3 1 1 6 880 1 1 2 GLU HG2 H -9.189 2.283 -0.846 1.00 . A A . 2 GLU HG2 1 1 6 881 1 1 2 GLU HG3 H -7.558 2.388 -1.510 1.00 . A A . 2 GLU HG3 1 1 6 882 1 1 2 GLU N N -6.789 -1.628 -0.824 1.00 . A A . 2 GLU N 1 1 6 883 1 1 2 GLU O O -4.843 0.160 -2.394 1.00 . A A . 2 GLU O 1 1 6 884 1 1 2 GLU OE1 O -10.205 1.273 -2.963 1.00 . A A . 2 GLU OE1 1 1 6 885 1 1 2 GLU OE2 O -8.237 1.702 -3.811 1.00 . A A . 2 GLU OE2 1 1 6 886 1 1 3 VAL C C -3.924 2.548 0.866 1.00 . A A . 3 VAL C 1 1 6 887 1 1 3 VAL CA C -4.285 2.196 -0.585 1.00 . A A . 3 VAL CA 1 1 6 888 1 1 3 VAL CB C -4.444 3.511 -1.401 1.00 . A A . 3 VAL CB 1 1 6 889 1 1 3 VAL CG1 C -3.115 4.246 -1.512 1.00 . A A . 3 VAL CG1 1 1 6 890 1 1 3 VAL CG2 C -5.006 3.250 -2.790 1.00 . A A . 3 VAL CG2 1 1 6 891 1 1 3 VAL H H -6.187 1.530 0.065 1.00 . A A . 3 VAL H 1 1 6 892 1 1 3 VAL HA H -3.478 1.619 -1.017 1.00 . A A . 3 VAL HA 1 1 6 893 1 1 3 VAL HB H -5.141 4.148 -0.874 1.00 . A A . 3 VAL HB 1 1 6 894 1 1 3 VAL HG11 H -3.252 5.151 -2.085 1.00 . A A . 3 VAL HG11 1 1 6 895 1 1 3 VAL HG12 H -2.395 3.612 -2.008 1.00 . A A . 3 VAL HG12 1 1 6 896 1 1 3 VAL HG13 H -2.758 4.495 -0.525 1.00 . A A . 3 VAL HG13 1 1 6 897 1 1 3 VAL HG21 H -5.994 2.822 -2.707 1.00 . A A . 3 VAL HG21 1 1 6 898 1 1 3 VAL HG22 H -4.360 2.563 -3.314 1.00 . A A . 3 VAL HG22 1 1 6 899 1 1 3 VAL HG23 H -5.062 4.179 -3.337 1.00 . A A . 3 VAL HG23 1 1 6 900 1 1 3 VAL N N -5.497 1.380 -0.618 1.00 . A A . 3 VAL N 1 1 6 901 1 1 3 VAL O O -3.891 3.717 1.244 1.00 . A A . 3 VAL O 1 1 6 902 1 1 4 PRO C C -1.816 1.870 3.331 1.00 . A A . 4 PRO C 1 1 6 903 1 1 4 PRO CA C -3.324 1.756 3.116 1.00 . A A . 4 PRO CA 1 1 6 904 1 1 4 PRO CB C -3.867 0.493 3.805 1.00 . A A . 4 PRO CB 1 1 6 905 1 1 4 PRO CD C -3.724 0.110 1.425 1.00 . A A . 4 PRO CD 1 1 6 906 1 1 4 PRO CG C -4.283 -0.443 2.704 1.00 . A A . 4 PRO CG 1 1 6 907 1 1 4 PRO HA H -3.814 2.629 3.517 1.00 . A A . 4 PRO HA 1 1 6 908 1 1 4 PRO HB2 H -3.093 0.055 4.416 1.00 . A A . 4 PRO HB2 1 1 6 909 1 1 4 PRO HB3 H -4.710 0.757 4.425 1.00 . A A . 4 PRO HB3 1 1 6 910 1 1 4 PRO HD2 H -2.740 -0.290 1.235 1.00 . A A . 4 PRO HD2 1 1 6 911 1 1 4 PRO HD3 H -4.387 -0.092 0.597 1.00 . A A . 4 PRO HD3 1 1 6 912 1 1 4 PRO HG2 H -3.884 -1.429 2.891 1.00 . A A . 4 PRO HG2 1 1 6 913 1 1 4 PRO HG3 H -5.360 -0.477 2.653 1.00 . A A . 4 PRO HG3 1 1 6 914 1 1 4 PRO N N -3.667 1.540 1.717 1.00 . A A . 4 PRO N 1 1 6 915 1 1 4 PRO O O -1.348 2.017 4.458 1.00 . A A . 4 PRO O 1 1 6 916 1 1 5 SER C C 0.936 0.624 3.077 1.00 . A A . 5 SER C 1 1 6 917 1 1 5 SER CA C 0.399 1.804 2.266 1.00 . A A . 5 SER CA 1 1 6 918 1 1 5 SER CB C 0.908 3.128 2.843 1.00 . A A . 5 SER CB 1 1 6 919 1 1 5 SER H H -1.515 1.740 1.361 1.00 . A A . 5 SER H 1 1 6 920 1 1 5 SER HA H 0.756 1.709 1.248 1.00 . A A . 5 SER HA 1 1 6 921 1 1 5 SER HB2 H 0.564 3.232 3.862 1.00 . A A . 5 SER HB2 1 1 6 922 1 1 5 SER HB3 H 1.987 3.133 2.825 1.00 . A A . 5 SER HB3 1 1 6 923 1 1 5 SER HG H -0.425 4.509 2.433 1.00 . A A . 5 SER HG 1 1 6 924 1 1 5 SER N N -1.066 1.792 2.228 1.00 . A A . 5 SER N 1 1 6 925 1 1 5 SER O O 2.076 0.636 3.533 1.00 . A A . 5 SER O 1 1 6 926 1 1 5 SER OG O 0.432 4.227 2.085 1.00 . A A . 5 SER OG 1 1 6 927 1 1 6 GLY C C 1.309 -2.534 3.143 1.00 . A A . 6 GLY C 1 1 6 928 1 1 6 GLY CA C 0.502 -1.569 3.983 1.00 . A A . 6 GLY CA 1 1 6 929 1 1 6 GLY H H -0.792 -0.346 2.854 1.00 . A A . 6 GLY H 1 1 6 930 1 1 6 GLY HA2 H 1.097 -1.262 4.831 1.00 . A A . 6 GLY HA2 1 1 6 931 1 1 6 GLY HA3 H -0.383 -2.073 4.341 1.00 . A A . 6 GLY HA3 1 1 6 932 1 1 6 GLY N N 0.105 -0.396 3.237 1.00 . A A . 6 GLY N 1 1 6 933 1 1 6 GLY O O 2.535 -2.554 3.229 1.00 . A A . 6 GLY O 1 1 6 934 1 1 7 PRO C C 2.122 -3.668 0.330 1.00 . A A . 7 PRO C 1 1 6 935 1 1 7 PRO CA C 1.323 -4.326 1.460 1.00 . A A . 7 PRO CA 1 1 6 936 1 1 7 PRO CB C 0.185 -5.186 0.901 1.00 . A A . 7 PRO CB 1 1 6 937 1 1 7 PRO CD C -0.826 -3.448 2.210 1.00 . A A . 7 PRO CD 1 1 6 938 1 1 7 PRO CG C -1.041 -4.345 1.022 1.00 . A A . 7 PRO CG 1 1 6 939 1 1 7 PRO HA H 1.990 -4.952 2.037 1.00 . A A . 7 PRO HA 1 1 6 940 1 1 7 PRO HB2 H 0.392 -5.434 -0.129 1.00 . A A . 7 PRO HB2 1 1 6 941 1 1 7 PRO HB3 H 0.097 -6.093 1.482 1.00 . A A . 7 PRO HB3 1 1 6 942 1 1 7 PRO HD2 H -1.259 -2.475 2.030 1.00 . A A . 7 PRO HD2 1 1 6 943 1 1 7 PRO HD3 H -1.252 -3.893 3.096 1.00 . A A . 7 PRO HD3 1 1 6 944 1 1 7 PRO HG2 H -1.170 -3.756 0.127 1.00 . A A . 7 PRO HG2 1 1 6 945 1 1 7 PRO HG3 H -1.903 -4.976 1.182 1.00 . A A . 7 PRO HG3 1 1 6 946 1 1 7 PRO N N 0.642 -3.360 2.323 1.00 . A A . 7 PRO N 1 1 6 947 1 1 7 PRO O O 3.331 -3.471 0.449 1.00 . A A . 7 PRO O 1 1 6 948 1 1 8 ASN C C 1.859 -1.318 -2.261 1.00 . A A . 8 ASN C 1 1 6 949 1 1 8 ASN CA C 2.127 -2.803 -1.947 1.00 . A A . 8 ASN CA 1 1 6 950 1 1 8 ASN CB C 1.806 -3.685 -3.162 1.00 . A A . 8 ASN CB 1 1 6 951 1 1 8 ASN CG C 2.005 -2.983 -4.496 1.00 . A A . 8 ASN CG 1 1 6 952 1 1 8 ASN H H 0.477 -3.434 -0.773 1.00 . A A . 8 ASN H 1 1 6 953 1 1 8 ASN HA H 3.183 -2.898 -1.749 1.00 . A A . 8 ASN HA 1 1 6 954 1 1 8 ASN HB2 H 2.462 -4.544 -3.142 1.00 . A A . 8 ASN HB2 1 1 6 955 1 1 8 ASN HB3 H 0.782 -4.019 -3.098 1.00 . A A . 8 ASN HB3 1 1 6 956 1 1 8 ASN HD21 H 3.887 -3.609 -4.589 1.00 . A A . 8 ASN HD21 1 1 6 957 1 1 8 ASN HD22 H 3.346 -2.644 -5.918 1.00 . A A . 8 ASN HD22 1 1 6 958 1 1 8 ASN N N 1.446 -3.316 -0.758 1.00 . A A . 8 ASN N 1 1 6 959 1 1 8 ASN ND2 N 3.198 -3.091 -5.056 1.00 . A A . 8 ASN ND2 1 1 6 960 1 1 8 ASN O O 2.833 -0.582 -2.416 1.00 . A A . 8 ASN O 1 1 6 961 1 1 8 ASN OD1 O 1.082 -2.360 -5.024 1.00 . A A . 8 ASN OD1 1 1 6 962 1 1 9 PRO C C 1.286 1.545 -2.749 1.00 . A A . 9 PRO C 1 1 6 963 1 1 9 PRO CA C 0.194 0.481 -2.861 1.00 . A A . 9 PRO CA 1 1 6 964 1 1 9 PRO CB C -1.023 0.861 -2.006 1.00 . A A . 9 PRO CB 1 1 6 965 1 1 9 PRO CD C -0.637 -1.528 -1.881 1.00 . A A . 9 PRO CD 1 1 6 966 1 1 9 PRO CG C -1.463 -0.399 -1.318 1.00 . A A . 9 PRO CG 1 1 6 967 1 1 9 PRO HA H -0.112 0.408 -3.893 1.00 . A A . 9 PRO HA 1 1 6 968 1 1 9 PRO HB2 H -0.737 1.617 -1.291 1.00 . A A . 9 PRO HB2 1 1 6 969 1 1 9 PRO HB3 H -1.803 1.248 -2.645 1.00 . A A . 9 PRO HB3 1 1 6 970 1 1 9 PRO HD2 H -0.416 -2.246 -1.112 1.00 . A A . 9 PRO HD2 1 1 6 971 1 1 9 PRO HD3 H -1.149 -1.998 -2.707 1.00 . A A . 9 PRO HD3 1 1 6 972 1 1 9 PRO HG2 H -1.290 -0.311 -0.256 1.00 . A A . 9 PRO HG2 1 1 6 973 1 1 9 PRO HG3 H -2.512 -0.573 -1.510 1.00 . A A . 9 PRO HG3 1 1 6 974 1 1 9 PRO N N 0.573 -0.845 -2.331 1.00 . A A . 9 PRO N 1 1 6 975 1 1 9 PRO O O 1.848 1.976 -3.753 1.00 . A A . 9 PRO O 1 1 6 976 1 1 10 ILE C C 3.603 2.244 -0.230 1.00 . A A . 10 ILE C 1 1 6 977 1 1 10 ILE CA C 2.696 2.865 -1.287 1.00 . A A . 10 ILE CA 1 1 6 978 1 1 10 ILE CB C 2.230 4.267 -0.825 1.00 . A A . 10 ILE CB 1 1 6 979 1 1 10 ILE CD1 C 0.509 6.100 -1.257 1.00 . A A . 10 ILE CD1 1 1 6 980 1 1 10 ILE CG1 C 1.073 4.767 -1.700 1.00 . A A . 10 ILE CG1 1 1 6 981 1 1 10 ILE CG2 C 3.393 5.253 -0.881 1.00 . A A . 10 ILE CG2 1 1 6 982 1 1 10 ILE H H 1.044 1.658 -0.775 1.00 . A A . 10 ILE H 1 1 6 983 1 1 10 ILE HA H 3.250 2.969 -2.209 1.00 . A A . 10 ILE HA 1 1 6 984 1 1 10 ILE HB H 1.898 4.194 0.199 1.00 . A A . 10 ILE HB 1 1 6 985 1 1 10 ILE HD11 H 1.284 6.851 -1.298 1.00 . A A . 10 ILE HD11 1 1 6 986 1 1 10 ILE HD12 H 0.142 6.017 -0.245 1.00 . A A . 10 ILE HD12 1 1 6 987 1 1 10 ILE HD13 H -0.300 6.383 -1.913 1.00 . A A . 10 ILE HD13 1 1 6 988 1 1 10 ILE HG12 H 1.420 4.876 -2.716 1.00 . A A . 10 ILE HG12 1 1 6 989 1 1 10 ILE HG13 H 0.273 4.041 -1.674 1.00 . A A . 10 ILE HG13 1 1 6 990 1 1 10 ILE HG21 H 4.185 4.912 -0.230 1.00 . A A . 10 ILE HG21 1 1 6 991 1 1 10 ILE HG22 H 3.055 6.226 -0.558 1.00 . A A . 10 ILE HG22 1 1 6 992 1 1 10 ILE HG23 H 3.763 5.318 -1.894 1.00 . A A . 10 ILE HG23 1 1 6 993 1 1 10 ILE N N 1.582 1.964 -1.528 1.00 . A A . 10 ILE N 1 1 6 994 1 1 10 ILE O O 3.823 2.804 0.841 1.00 . A A . 10 ILE O 1 1 6 995 1 1 11 SER C C 5.867 -0.638 -0.341 1.00 . A A . 11 SER C 1 1 6 996 1 1 11 SER CA C 4.912 0.300 0.400 1.00 . A A . 11 SER CA 1 1 6 997 1 1 11 SER CB C 4.018 -0.496 1.351 1.00 . A A . 11 SER CB 1 1 6 998 1 1 11 SER H H 3.862 0.653 -1.400 1.00 . A A . 11 SER H 1 1 6 999 1 1 11 SER HA H 5.492 1.007 0.973 1.00 . A A . 11 SER HA 1 1 6 1000 1 1 11 SER HB2 H 3.330 0.178 1.839 1.00 . A A . 11 SER HB2 1 1 6 1001 1 1 11 SER HB3 H 3.459 -1.227 0.785 1.00 . A A . 11 SER HB3 1 1 6 1002 1 1 11 SER HG H 4.191 -1.789 2.811 1.00 . A A . 11 SER HG 1 1 6 1003 1 1 11 SER N N 4.082 1.047 -0.529 1.00 . A A . 11 SER N 1 1 6 1004 1 1 11 SER O O 7.031 -0.777 0.037 1.00 . A A . 11 SER O 1 1 6 1005 1 1 11 SER OG O 4.770 -1.169 2.344 1.00 . A A . 11 SER OG 1 1 6 1006 1 1 12 ASN C C 6.513 -1.620 -3.525 1.00 . A A . 12 ASN C 1 1 6 1007 1 1 12 ASN CA C 6.208 -2.207 -2.158 1.00 . A A . 12 ASN CA 1 1 6 1008 1 1 12 ASN CB C 5.522 -3.573 -2.303 1.00 . A A . 12 ASN CB 1 1 6 1009 1 1 12 ASN CG C 6.409 -4.591 -2.996 1.00 . A A . 12 ASN CG 1 1 6 1010 1 1 12 ASN H H 4.454 -1.126 -1.673 1.00 . A A . 12 ASN H 1 1 6 1011 1 1 12 ASN HA H 7.137 -2.336 -1.620 1.00 . A A . 12 ASN HA 1 1 6 1012 1 1 12 ASN HB2 H 5.274 -3.950 -1.322 1.00 . A A . 12 ASN HB2 1 1 6 1013 1 1 12 ASN HB3 H 4.613 -3.461 -2.882 1.00 . A A . 12 ASN HB3 1 1 6 1014 1 1 12 ASN HD21 H 7.146 -5.176 -1.245 1.00 . A A . 12 ASN HD21 1 1 6 1015 1 1 12 ASN HD22 H 7.783 -5.981 -2.638 1.00 . A A . 12 ASN HD22 1 1 6 1016 1 1 12 ASN N N 5.381 -1.283 -1.393 1.00 . A A . 12 ASN N 1 1 6 1017 1 1 12 ASN ND2 N 7.189 -5.325 -2.216 1.00 . A A . 12 ASN ND2 1 1 6 1018 1 1 12 ASN O O 5.673 -1.758 -4.433 1.00 . A A . 12 ASN O 1 1 6 1019 1 1 12 ASN OXT O 7.584 -0.997 -3.681 1.00 . A A . 12 ASN OXT 1 1 6 1020 1 1 12 ASN OD1 O 6.386 -4.729 -4.219 1.00 . A A . 12 ASN OD1 1 1 7 1021 1 1 1 HIS C C -6.003 -3.110 -1.351 1.00 . A A . 1 HIS C 1 1 7 1022 1 1 1 HIS CA C -6.102 -4.256 -0.357 1.00 . A A . 1 HIS CA 1 1 7 1023 1 1 1 HIS CB C -7.508 -4.292 0.252 1.00 . A A . 1 HIS CB 1 1 7 1024 1 1 1 HIS CD2 C -7.899 -6.834 0.587 1.00 . A A . 1 HIS CD2 1 1 7 1025 1 1 1 HIS CE1 C -8.353 -6.805 2.728 1.00 . A A . 1 HIS CE1 1 1 7 1026 1 1 1 HIS CG C -7.814 -5.549 1.004 1.00 . A A . 1 HIS CG 1 1 7 1027 1 1 1 HIS H1 H -5.252 -3.278 1.273 1.00 . A A . 1 HIS H1 1 1 7 1028 1 1 1 HIS H2 H -4.131 -4.037 0.262 1.00 . A A . 1 HIS H2 1 1 7 1029 1 1 1 HIS H3 H -5.078 -4.960 1.314 1.00 . A A . 1 HIS H3 1 1 7 1030 1 1 1 HIS HA H -5.925 -5.180 -0.883 1.00 . A A . 1 HIS HA 1 1 7 1031 1 1 1 HIS HB2 H -7.615 -3.466 0.936 1.00 . A A . 1 HIS HB2 1 1 7 1032 1 1 1 HIS HB3 H -8.236 -4.193 -0.540 1.00 . A A . 1 HIS HB3 1 1 7 1033 1 1 1 HIS HD1 H -8.139 -4.782 2.940 1.00 . A A . 1 HIS HD1 1 1 7 1034 1 1 1 HIS HD2 H -7.730 -7.193 -0.418 1.00 . A A . 1 HIS HD2 1 1 7 1035 1 1 1 HIS HE1 H -8.608 -7.119 3.728 1.00 . A A . 1 HIS HE1 1 1 7 1036 1 1 1 HIS HE2 H -8.518 -8.535 1.649 1.00 . A A . 1 HIS HE2 1 1 7 1037 1 1 1 HIS N N -5.072 -4.123 0.697 1.00 . A A . 1 HIS N 1 1 7 1038 1 1 1 HIS ND1 N -8.105 -5.568 2.349 1.00 . A A . 1 HIS ND1 1 1 7 1039 1 1 1 HIS NE2 N -8.237 -7.594 1.678 1.00 . A A . 1 HIS NE2 1 1 7 1040 1 1 1 HIS O O -5.556 -3.301 -2.480 1.00 . A A . 1 HIS O 1 1 7 1041 1 1 2 GLU C C -5.111 0.064 -1.595 1.00 . A A . 2 GLU C 1 1 7 1042 1 1 2 GLU CA C -6.382 -0.764 -1.814 1.00 . A A . 2 GLU CA 1 1 7 1043 1 1 2 GLU CB C -7.644 0.082 -1.603 1.00 . A A . 2 GLU CB 1 1 7 1044 1 1 2 GLU CD C -7.886 0.904 -3.981 1.00 . A A . 2 GLU CD 1 1 7 1045 1 1 2 GLU CG C -7.756 1.286 -2.521 1.00 . A A . 2 GLU CG 1 1 7 1046 1 1 2 GLU H H -6.731 -1.811 -0.012 1.00 . A A . 2 GLU H 1 1 7 1047 1 1 2 GLU HA H -6.377 -1.133 -2.829 1.00 . A A . 2 GLU HA 1 1 7 1048 1 1 2 GLU HB2 H -8.509 -0.544 -1.769 1.00 . A A . 2 GLU HB2 1 1 7 1049 1 1 2 GLU HB3 H -7.660 0.431 -0.584 1.00 . A A . 2 GLU HB3 1 1 7 1050 1 1 2 GLU HG2 H -8.624 1.854 -2.232 1.00 . A A . 2 GLU HG2 1 1 7 1051 1 1 2 GLU HG3 H -6.874 1.896 -2.399 1.00 . A A . 2 GLU HG3 1 1 7 1052 1 1 2 GLU N N -6.405 -1.918 -0.932 1.00 . A A . 2 GLU N 1 1 7 1053 1 1 2 GLU O O -4.047 -0.273 -2.119 1.00 . A A . 2 GLU O 1 1 7 1054 1 1 2 GLU OE1 O -6.870 0.519 -4.595 1.00 . A A . 2 GLU OE1 1 1 7 1055 1 1 2 GLU OE2 O -9.004 0.991 -4.526 1.00 . A A . 2 GLU OE2 1 1 7 1056 1 1 3 VAL C C -4.032 2.364 0.966 1.00 . A A . 3 VAL C 1 1 7 1057 1 1 3 VAL CA C -4.075 1.995 -0.521 1.00 . A A . 3 VAL CA 1 1 7 1058 1 1 3 VAL CB C -4.130 3.284 -1.388 1.00 . A A . 3 VAL CB 1 1 7 1059 1 1 3 VAL CG1 C -2.904 4.158 -1.157 1.00 . A A . 3 VAL CG1 1 1 7 1060 1 1 3 VAL CG2 C -4.248 2.945 -2.865 1.00 . A A . 3 VAL CG2 1 1 7 1061 1 1 3 VAL H H -6.065 1.293 -0.335 1.00 . A A . 3 VAL H 1 1 7 1062 1 1 3 VAL HA H -3.173 1.456 -0.769 1.00 . A A . 3 VAL HA 1 1 7 1063 1 1 3 VAL HB H -5.006 3.848 -1.101 1.00 . A A . 3 VAL HB 1 1 7 1064 1 1 3 VAL HG11 H -2.871 4.464 -0.122 1.00 . A A . 3 VAL HG11 1 1 7 1065 1 1 3 VAL HG12 H -2.961 5.032 -1.789 1.00 . A A . 3 VAL HG12 1 1 7 1066 1 1 3 VAL HG13 H -2.012 3.598 -1.396 1.00 . A A . 3 VAL HG13 1 1 7 1067 1 1 3 VAL HG21 H -4.283 3.856 -3.442 1.00 . A A . 3 VAL HG21 1 1 7 1068 1 1 3 VAL HG22 H -5.150 2.377 -3.035 1.00 . A A . 3 VAL HG22 1 1 7 1069 1 1 3 VAL HG23 H -3.394 2.360 -3.169 1.00 . A A . 3 VAL HG23 1 1 7 1070 1 1 3 VAL N N -5.210 1.113 -0.785 1.00 . A A . 3 VAL N 1 1 7 1071 1 1 3 VAL O O -4.254 3.510 1.351 1.00 . A A . 3 VAL O 1 1 7 1072 1 1 4 PRO C C -2.315 1.696 3.810 1.00 . A A . 4 PRO C 1 1 7 1073 1 1 4 PRO CA C -3.739 1.547 3.274 1.00 . A A . 4 PRO CA 1 1 7 1074 1 1 4 PRO CB C -4.365 0.229 3.770 1.00 . A A . 4 PRO CB 1 1 7 1075 1 1 4 PRO CD C -3.565 -0.029 1.512 1.00 . A A . 4 PRO CD 1 1 7 1076 1 1 4 PRO CG C -4.396 -0.686 2.573 1.00 . A A . 4 PRO CG 1 1 7 1077 1 1 4 PRO HA H -4.340 2.382 3.594 1.00 . A A . 4 PRO HA 1 1 7 1078 1 1 4 PRO HB2 H -3.758 -0.182 4.562 1.00 . A A . 4 PRO HB2 1 1 7 1079 1 1 4 PRO HB3 H -5.361 0.419 4.137 1.00 . A A . 4 PRO HB3 1 1 7 1080 1 1 4 PRO HD2 H -2.525 -0.304 1.611 1.00 . A A . 4 PRO HD2 1 1 7 1081 1 1 4 PRO HD3 H -3.938 -0.265 0.527 1.00 . A A . 4 PRO HD3 1 1 7 1082 1 1 4 PRO HG2 H -3.983 -1.648 2.831 1.00 . A A . 4 PRO HG2 1 1 7 1083 1 1 4 PRO HG3 H -5.415 -0.791 2.228 1.00 . A A . 4 PRO HG3 1 1 7 1084 1 1 4 PRO N N -3.776 1.372 1.833 1.00 . A A . 4 PRO N 1 1 7 1085 1 1 4 PRO O O -2.069 1.536 5.007 1.00 . A A . 4 PRO O 1 1 7 1086 1 1 5 SER C C 0.529 0.830 3.875 1.00 . A A . 5 SER C 1 1 7 1087 1 1 5 SER CA C 0.031 2.117 3.225 1.00 . A A . 5 SER CA 1 1 7 1088 1 1 5 SER CB C 0.273 3.327 4.141 1.00 . A A . 5 SER CB 1 1 7 1089 1 1 5 SER H H -1.676 2.179 1.981 1.00 . A A . 5 SER H 1 1 7 1090 1 1 5 SER HA H 0.567 2.259 2.300 1.00 . A A . 5 SER HA 1 1 7 1091 1 1 5 SER HB2 H -0.207 4.195 3.719 1.00 . A A . 5 SER HB2 1 1 7 1092 1 1 5 SER HB3 H -0.147 3.125 5.116 1.00 . A A . 5 SER HB3 1 1 7 1093 1 1 5 SER HG H 2.071 2.892 4.798 1.00 . A A . 5 SER HG 1 1 7 1094 1 1 5 SER N N -1.388 2.003 2.900 1.00 . A A . 5 SER N 1 1 7 1095 1 1 5 SER O O 1.181 0.851 4.916 1.00 . A A . 5 SER O 1 1 7 1096 1 1 5 SER OG O 1.657 3.605 4.291 1.00 . A A . 5 SER OG 1 1 7 1097 1 1 6 GLY C C 1.221 -2.522 2.844 1.00 . A A . 6 GLY C 1 1 7 1098 1 1 6 GLY CA C 0.546 -1.576 3.820 1.00 . A A . 6 GLY CA 1 1 7 1099 1 1 6 GLY H H -0.219 -0.239 2.371 1.00 . A A . 6 GLY H 1 1 7 1100 1 1 6 GLY HA2 H 1.208 -1.417 4.658 1.00 . A A . 6 GLY HA2 1 1 7 1101 1 1 6 GLY HA3 H -0.362 -2.033 4.178 1.00 . A A . 6 GLY HA3 1 1 7 1102 1 1 6 GLY N N 0.221 -0.290 3.240 1.00 . A A . 6 GLY N 1 1 7 1103 1 1 6 GLY O O 2.433 -2.437 2.650 1.00 . A A . 6 GLY O 1 1 7 1104 1 1 7 PRO C C 1.926 -3.943 0.251 1.00 . A A . 7 PRO C 1 1 7 1105 1 1 7 PRO CA C 0.999 -4.479 1.340 1.00 . A A . 7 PRO CA 1 1 7 1106 1 1 7 PRO CB C -0.242 -5.129 0.723 1.00 . A A . 7 PRO CB 1 1 7 1107 1 1 7 PRO CD C -1.020 -3.496 2.288 1.00 . A A . 7 PRO CD 1 1 7 1108 1 1 7 PRO CG C -1.342 -4.834 1.681 1.00 . A A . 7 PRO CG 1 1 7 1109 1 1 7 PRO HA H 1.535 -5.216 1.922 1.00 . A A . 7 PRO HA 1 1 7 1110 1 1 7 PRO HB2 H -0.435 -4.694 -0.247 1.00 . A A . 7 PRO HB2 1 1 7 1111 1 1 7 PRO HB3 H -0.084 -6.193 0.621 1.00 . A A . 7 PRO HB3 1 1 7 1112 1 1 7 PRO HD2 H -1.477 -2.703 1.716 1.00 . A A . 7 PRO HD2 1 1 7 1113 1 1 7 PRO HD3 H -1.351 -3.462 3.315 1.00 . A A . 7 PRO HD3 1 1 7 1114 1 1 7 PRO HG2 H -2.285 -4.789 1.155 1.00 . A A . 7 PRO HG2 1 1 7 1115 1 1 7 PRO HG3 H -1.376 -5.594 2.446 1.00 . A A . 7 PRO HG3 1 1 7 1116 1 1 7 PRO N N 0.451 -3.426 2.206 1.00 . A A . 7 PRO N 1 1 7 1117 1 1 7 PRO O O 3.145 -4.095 0.336 1.00 . A A . 7 PRO O 1 1 7 1118 1 1 8 ASN C C 1.413 -1.626 -2.603 1.00 . A A . 8 ASN C 1 1 7 1119 1 1 8 ASN CA C 2.155 -2.731 -1.838 1.00 . A A . 8 ASN CA 1 1 7 1120 1 1 8 ASN CB C 2.619 -3.823 -2.814 1.00 . A A . 8 ASN CB 1 1 7 1121 1 1 8 ASN CG C 1.478 -4.590 -3.473 1.00 . A A . 8 ASN CG 1 1 7 1122 1 1 8 ASN H H 0.382 -3.259 -0.815 1.00 . A A . 8 ASN H 1 1 7 1123 1 1 8 ASN HA H 3.028 -2.294 -1.380 1.00 . A A . 8 ASN HA 1 1 7 1124 1 1 8 ASN HB2 H 3.208 -3.367 -3.594 1.00 . A A . 8 ASN HB2 1 1 7 1125 1 1 8 ASN HB3 H 3.237 -4.522 -2.274 1.00 . A A . 8 ASN HB3 1 1 7 1126 1 1 8 ASN HD21 H 2.610 -4.944 -5.068 1.00 . A A . 8 ASN HD21 1 1 7 1127 1 1 8 ASN HD22 H 1.004 -5.584 -5.125 1.00 . A A . 8 ASN HD22 1 1 7 1128 1 1 8 ASN N N 1.355 -3.314 -0.769 1.00 . A A . 8 ASN N 1 1 7 1129 1 1 8 ASN ND2 N 1.722 -5.090 -4.674 1.00 . A A . 8 ASN ND2 1 1 7 1130 1 1 8 ASN O O 1.303 -1.681 -3.826 1.00 . A A . 8 ASN O 1 1 7 1131 1 1 8 ASN OD1 O 0.394 -4.743 -2.907 1.00 . A A . 8 ASN OD1 1 1 7 1132 1 1 9 PRO C C 1.445 1.540 -2.964 1.00 . A A . 9 PRO C 1 1 7 1133 1 1 9 PRO CA C 0.335 0.576 -2.569 1.00 . A A . 9 PRO CA 1 1 7 1134 1 1 9 PRO CB C -0.576 1.208 -1.505 1.00 . A A . 9 PRO CB 1 1 7 1135 1 1 9 PRO CD C 0.784 -0.480 -0.453 1.00 . A A . 9 PRO CD 1 1 7 1136 1 1 9 PRO CG C -0.464 0.340 -0.288 1.00 . A A . 9 PRO CG 1 1 7 1137 1 1 9 PRO HA H -0.240 0.307 -3.442 1.00 . A A . 9 PRO HA 1 1 7 1138 1 1 9 PRO HB2 H -0.240 2.214 -1.299 1.00 . A A . 9 PRO HB2 1 1 7 1139 1 1 9 PRO HB3 H -1.590 1.235 -1.873 1.00 . A A . 9 PRO HB3 1 1 7 1140 1 1 9 PRO HD2 H 1.637 0.037 -0.038 1.00 . A A . 9 PRO HD2 1 1 7 1141 1 1 9 PRO HD3 H 0.665 -1.451 0.006 1.00 . A A . 9 PRO HD3 1 1 7 1142 1 1 9 PRO HG2 H -0.390 0.956 0.596 1.00 . A A . 9 PRO HG2 1 1 7 1143 1 1 9 PRO HG3 H -1.327 -0.306 -0.221 1.00 . A A . 9 PRO HG3 1 1 7 1144 1 1 9 PRO N N 0.893 -0.597 -1.907 1.00 . A A . 9 PRO N 1 1 7 1145 1 1 9 PRO O O 1.699 1.774 -4.147 1.00 . A A . 9 PRO O 1 1 7 1146 1 1 10 ILE C C 4.462 2.275 -1.399 1.00 . A A . 10 ILE C 1 1 7 1147 1 1 10 ILE CA C 3.291 2.899 -2.158 1.00 . A A . 10 ILE CA 1 1 7 1148 1 1 10 ILE CB C 3.053 4.352 -1.681 1.00 . A A . 10 ILE CB 1 1 7 1149 1 1 10 ILE CD1 C 4.053 6.699 -1.662 1.00 . A A . 10 ILE CD1 1 1 7 1150 1 1 10 ILE CG1 C 4.230 5.253 -2.069 1.00 . A A . 10 ILE CG1 1 1 7 1151 1 1 10 ILE CG2 C 2.819 4.389 -0.175 1.00 . A A . 10 ILE CG2 1 1 7 1152 1 1 10 ILE H H 1.769 1.963 -1.047 1.00 . A A . 10 ILE H 1 1 7 1153 1 1 10 ILE HA H 3.518 2.911 -3.215 1.00 . A A . 10 ILE HA 1 1 7 1154 1 1 10 ILE HB H 2.159 4.713 -2.163 1.00 . A A . 10 ILE HB 1 1 7 1155 1 1 10 ILE HD11 H 4.919 7.268 -1.967 1.00 . A A . 10 ILE HD11 1 1 7 1156 1 1 10 ILE HD12 H 3.943 6.759 -0.589 1.00 . A A . 10 ILE HD12 1 1 7 1157 1 1 10 ILE HD13 H 3.171 7.101 -2.137 1.00 . A A . 10 ILE HD13 1 1 7 1158 1 1 10 ILE HG12 H 5.127 4.885 -1.597 1.00 . A A . 10 ILE HG12 1 1 7 1159 1 1 10 ILE HG13 H 4.357 5.223 -3.142 1.00 . A A . 10 ILE HG13 1 1 7 1160 1 1 10 ILE HG21 H 3.684 3.988 0.334 1.00 . A A . 10 ILE HG21 1 1 7 1161 1 1 10 ILE HG22 H 1.950 3.797 0.070 1.00 . A A . 10 ILE HG22 1 1 7 1162 1 1 10 ILE HG23 H 2.659 5.410 0.139 1.00 . A A . 10 ILE HG23 1 1 7 1163 1 1 10 ILE N N 2.105 2.089 -1.957 1.00 . A A . 10 ILE N 1 1 7 1164 1 1 10 ILE O O 5.616 2.659 -1.563 1.00 . A A . 10 ILE O 1 1 7 1165 1 1 11 SER C C 5.581 -0.700 -0.368 1.00 . A A . 11 SER C 1 1 7 1166 1 1 11 SER CA C 5.130 0.621 0.256 1.00 . A A . 11 SER CA 1 1 7 1167 1 1 11 SER CB C 4.533 0.391 1.647 1.00 . A A . 11 SER CB 1 1 7 1168 1 1 11 SER H H 3.218 0.976 -0.543 1.00 . A A . 11 SER H 1 1 7 1169 1 1 11 SER HA H 5.983 1.275 0.342 1.00 . A A . 11 SER HA 1 1 7 1170 1 1 11 SER HB2 H 5.124 -0.344 2.173 1.00 . A A . 11 SER HB2 1 1 7 1171 1 1 11 SER HB3 H 4.538 1.319 2.197 1.00 . A A . 11 SER HB3 1 1 7 1172 1 1 11 SER HG H 3.137 -0.961 1.952 1.00 . A A . 11 SER HG 1 1 7 1173 1 1 11 SER N N 4.144 1.281 -0.581 1.00 . A A . 11 SER N 1 1 7 1174 1 1 11 SER O O 5.316 -1.780 0.166 1.00 . A A . 11 SER O 1 1 7 1175 1 1 11 SER OG O 3.195 -0.079 1.551 1.00 . A A . 11 SER OG 1 1 7 1176 1 1 12 ASN C C 7.983 -1.395 -3.031 1.00 . A A . 12 ASN C 1 1 7 1177 1 1 12 ASN CA C 6.766 -1.774 -2.204 1.00 . A A . 12 ASN CA 1 1 7 1178 1 1 12 ASN CB C 5.689 -2.399 -3.098 1.00 . A A . 12 ASN CB 1 1 7 1179 1 1 12 ASN CG C 6.221 -3.546 -3.940 1.00 . A A . 12 ASN CG 1 1 7 1180 1 1 12 ASN H H 6.426 0.288 -1.885 1.00 . A A . 12 ASN H 1 1 7 1181 1 1 12 ASN HA H 7.065 -2.496 -1.460 1.00 . A A . 12 ASN HA 1 1 7 1182 1 1 12 ASN HB2 H 4.887 -2.780 -2.477 1.00 . A A . 12 ASN HB2 1 1 7 1183 1 1 12 ASN HB3 H 5.297 -1.642 -3.761 1.00 . A A . 12 ASN HB3 1 1 7 1184 1 1 12 ASN HD21 H 5.856 -4.830 -2.470 1.00 . A A . 12 ASN HD21 1 1 7 1185 1 1 12 ASN HD22 H 6.538 -5.506 -3.908 1.00 . A A . 12 ASN HD22 1 1 7 1186 1 1 12 ASN N N 6.254 -0.602 -1.504 1.00 . A A . 12 ASN N 1 1 7 1187 1 1 12 ASN ND2 N 6.205 -4.747 -3.383 1.00 . A A . 12 ASN ND2 1 1 7 1188 1 1 12 ASN O O 9.095 -1.848 -2.693 1.00 . A A . 12 ASN O 1 1 7 1189 1 1 12 ASN OXT O 7.831 -0.615 -3.994 1.00 . A A . 12 ASN OXT 1 1 7 1190 1 1 12 ASN OD1 O 6.648 -3.356 -5.077 1.00 . A A . 12 ASN OD1 1 1 8 1191 1 1 1 HIS C C -6.571 -2.150 0.763 1.00 . A A . 1 HIS C 1 1 8 1192 1 1 1 HIS CA C -7.388 -2.652 1.948 1.00 . A A . 1 HIS CA 1 1 8 1193 1 1 1 HIS CB C -7.806 -1.486 2.855 1.00 . A A . 1 HIS CB 1 1 8 1194 1 1 1 HIS CD2 C -8.710 -2.377 5.118 1.00 . A A . 1 HIS CD2 1 1 8 1195 1 1 1 HIS CE1 C -10.847 -2.095 4.748 1.00 . A A . 1 HIS CE1 1 1 8 1196 1 1 1 HIS CG C -8.840 -1.852 3.878 1.00 . A A . 1 HIS CG 1 1 8 1197 1 1 1 HIS H1 H -5.727 -3.254 3.052 1.00 . A A . 1 HIS H1 1 1 8 1198 1 1 1 HIS H2 H -6.386 -4.471 2.084 1.00 . A A . 1 HIS H2 1 1 8 1199 1 1 1 HIS H3 H -7.165 -4.016 3.510 1.00 . A A . 1 HIS H3 1 1 8 1200 1 1 1 HIS HA H -8.277 -3.133 1.565 1.00 . A A . 1 HIS HA 1 1 8 1201 1 1 1 HIS HB2 H -6.941 -1.122 3.383 1.00 . A A . 1 HIS HB2 1 1 8 1202 1 1 1 HIS HB3 H -8.208 -0.692 2.245 1.00 . A A . 1 HIS HB3 1 1 8 1203 1 1 1 HIS HD1 H -10.618 -1.327 2.862 1.00 . A A . 1 HIS HD1 1 1 8 1204 1 1 1 HIS HD2 H -7.784 -2.634 5.609 1.00 . A A . 1 HIS HD2 1 1 8 1205 1 1 1 HIS HE1 H -11.920 -2.090 4.874 1.00 . A A . 1 HIS HE1 1 1 8 1206 1 1 1 HIS HE2 H -10.178 -2.748 6.573 1.00 . A A . 1 HIS HE2 1 1 8 1207 1 1 1 HIS N N -6.615 -3.666 2.703 1.00 . A A . 1 HIS N 1 1 8 1208 1 1 1 HIS ND1 N -10.194 -1.688 3.676 1.00 . A A . 1 HIS ND1 1 1 8 1209 1 1 1 HIS NE2 N -9.970 -2.518 5.636 1.00 . A A . 1 HIS NE2 1 1 8 1210 1 1 1 HIS O O -5.389 -2.481 0.653 1.00 . A A . 1 HIS O 1 1 8 1211 1 1 2 GLU C C -5.300 -0.129 -1.227 1.00 . A A . 2 GLU C 1 1 8 1212 1 1 2 GLU CA C -6.538 -1.022 -1.388 1.00 . A A . 2 GLU CA 1 1 8 1213 1 1 2 GLU CB C -7.541 -0.377 -2.351 1.00 . A A . 2 GLU CB 1 1 8 1214 1 1 2 GLU CD C -9.030 1.586 -2.864 1.00 . A A . 2 GLU CD 1 1 8 1215 1 1 2 GLU CG C -8.237 0.856 -1.802 1.00 . A A . 2 GLU CG 1 1 8 1216 1 1 2 GLU H H -8.072 -1.008 0.084 1.00 . A A . 2 GLU H 1 1 8 1217 1 1 2 GLU HA H -6.212 -1.954 -1.825 1.00 . A A . 2 GLU HA 1 1 8 1218 1 1 2 GLU HB2 H -7.020 -0.093 -3.253 1.00 . A A . 2 GLU HB2 1 1 8 1219 1 1 2 GLU HB3 H -8.297 -1.106 -2.601 1.00 . A A . 2 GLU HB3 1 1 8 1220 1 1 2 GLU HG2 H -8.909 0.557 -1.013 1.00 . A A . 2 GLU HG2 1 1 8 1221 1 1 2 GLU HG3 H -7.491 1.527 -1.406 1.00 . A A . 2 GLU HG3 1 1 8 1222 1 1 2 GLU N N -7.176 -1.362 -0.117 1.00 . A A . 2 GLU N 1 1 8 1223 1 1 2 GLU O O -4.241 -0.436 -1.781 1.00 . A A . 2 GLU O 1 1 8 1224 1 1 2 GLU OE1 O -10.213 1.243 -3.066 1.00 . A A . 2 GLU OE1 1 1 8 1225 1 1 2 GLU OE2 O -8.487 2.519 -3.490 1.00 . A A . 2 GLU OE2 1 1 8 1226 1 1 3 VAL C C -4.082 2.452 1.031 1.00 . A A . 3 VAL C 1 1 8 1227 1 1 3 VAL CA C -4.345 1.943 -0.403 1.00 . A A . 3 VAL CA 1 1 8 1228 1 1 3 VAL CB C -4.680 3.111 -1.367 1.00 . A A . 3 VAL CB 1 1 8 1229 1 1 3 VAL CG1 C -5.923 3.878 -0.928 1.00 . A A . 3 VAL CG1 1 1 8 1230 1 1 3 VAL CG2 C -3.491 4.043 -1.540 1.00 . A A . 3 VAL CG2 1 1 8 1231 1 1 3 VAL H H -6.202 1.060 0.111 1.00 . A A . 3 VAL H 1 1 8 1232 1 1 3 VAL HA H -3.443 1.468 -0.763 1.00 . A A . 3 VAL HA 1 1 8 1233 1 1 3 VAL HB H -4.898 2.674 -2.329 1.00 . A A . 3 VAL HB 1 1 8 1234 1 1 3 VAL HG11 H -5.743 4.332 0.035 1.00 . A A . 3 VAL HG11 1 1 8 1235 1 1 3 VAL HG12 H -6.757 3.199 -0.854 1.00 . A A . 3 VAL HG12 1 1 8 1236 1 1 3 VAL HG13 H -6.146 4.646 -1.652 1.00 . A A . 3 VAL HG13 1 1 8 1237 1 1 3 VAL HG21 H -3.756 4.844 -2.213 1.00 . A A . 3 VAL HG21 1 1 8 1238 1 1 3 VAL HG22 H -2.657 3.491 -1.948 1.00 . A A . 3 VAL HG22 1 1 8 1239 1 1 3 VAL HG23 H -3.216 4.455 -0.580 1.00 . A A . 3 VAL HG23 1 1 8 1240 1 1 3 VAL N N -5.408 0.944 -0.451 1.00 . A A . 3 VAL N 1 1 8 1241 1 1 3 VAL O O -4.172 3.644 1.326 1.00 . A A . 3 VAL O 1 1 8 1242 1 1 4 PRO C C -1.971 1.915 3.648 1.00 . A A . 4 PRO C 1 1 8 1243 1 1 4 PRO CA C -3.468 1.872 3.343 1.00 . A A . 4 PRO CA 1 1 8 1244 1 1 4 PRO CB C -4.122 0.690 4.069 1.00 . A A . 4 PRO CB 1 1 8 1245 1 1 4 PRO CD C -3.623 0.104 1.767 1.00 . A A . 4 PRO CD 1 1 8 1246 1 1 4 PRO CG C -4.209 -0.419 3.051 1.00 . A A . 4 PRO CG 1 1 8 1247 1 1 4 PRO HA H -3.937 2.797 3.642 1.00 . A A . 4 PRO HA 1 1 8 1248 1 1 4 PRO HB2 H -3.512 0.404 4.911 1.00 . A A . 4 PRO HB2 1 1 8 1249 1 1 4 PRO HB3 H -5.105 0.978 4.414 1.00 . A A . 4 PRO HB3 1 1 8 1250 1 1 4 PRO HD2 H -2.590 -0.196 1.669 1.00 . A A . 4 PRO HD2 1 1 8 1251 1 1 4 PRO HD3 H -4.203 -0.225 0.919 1.00 . A A . 4 PRO HD3 1 1 8 1252 1 1 4 PRO HG2 H -3.650 -1.277 3.393 1.00 . A A . 4 PRO HG2 1 1 8 1253 1 1 4 PRO HG3 H -5.243 -0.683 2.897 1.00 . A A . 4 PRO HG3 1 1 8 1254 1 1 4 PRO N N -3.739 1.542 1.955 1.00 . A A . 4 PRO N 1 1 8 1255 1 1 4 PRO O O -1.566 1.913 4.811 1.00 . A A . 4 PRO O 1 1 8 1256 1 1 5 SER C C 0.666 0.518 3.354 1.00 . A A . 5 SER C 1 1 8 1257 1 1 5 SER CA C 0.291 1.849 2.696 1.00 . A A . 5 SER CA 1 1 8 1258 1 1 5 SER CB C 0.865 3.038 3.482 1.00 . A A . 5 SER CB 1 1 8 1259 1 1 5 SER H H -1.559 2.100 1.700 1.00 . A A . 5 SER H 1 1 8 1260 1 1 5 SER HA H 0.697 1.859 1.694 1.00 . A A . 5 SER HA 1 1 8 1261 1 1 5 SER HB2 H 0.534 3.958 3.026 1.00 . A A . 5 SER HB2 1 1 8 1262 1 1 5 SER HB3 H 0.508 2.995 4.500 1.00 . A A . 5 SER HB3 1 1 8 1263 1 1 5 SER HG H 2.587 2.271 4.021 1.00 . A A . 5 SER HG 1 1 8 1264 1 1 5 SER N N -1.162 1.960 2.586 1.00 . A A . 5 SER N 1 1 8 1265 1 1 5 SER O O 1.684 0.404 4.040 1.00 . A A . 5 SER O 1 1 8 1266 1 1 5 SER OG O 2.283 3.021 3.493 1.00 . A A . 5 SER OG 1 1 8 1267 1 1 6 GLY C C 0.816 -2.754 2.895 1.00 . A A . 6 GLY C 1 1 8 1268 1 1 6 GLY CA C 0.022 -1.780 3.744 1.00 . A A . 6 GLY CA 1 1 8 1269 1 1 6 GLY H H -0.906 -0.354 2.495 1.00 . A A . 6 GLY H 1 1 8 1270 1 1 6 GLY HA2 H 0.541 -1.632 4.679 1.00 . A A . 6 GLY HA2 1 1 8 1271 1 1 6 GLY HA3 H -0.948 -2.204 3.948 1.00 . A A . 6 GLY HA3 1 1 8 1272 1 1 6 GLY N N -0.161 -0.491 3.111 1.00 . A A . 6 GLY N 1 1 8 1273 1 1 6 GLY O O 2.044 -2.735 2.936 1.00 . A A . 6 GLY O 1 1 8 1274 1 1 7 PRO C C 1.853 -4.093 0.358 1.00 . A A . 7 PRO C 1 1 8 1275 1 1 7 PRO CA C 0.806 -4.659 1.315 1.00 . A A . 7 PRO CA 1 1 8 1276 1 1 7 PRO CB C -0.336 -5.328 0.541 1.00 . A A . 7 PRO CB 1 1 8 1277 1 1 7 PRO CD C -1.321 -3.626 1.905 1.00 . A A . 7 PRO CD 1 1 8 1278 1 1 7 PRO CG C -1.573 -4.975 1.292 1.00 . A A . 7 PRO CG 1 1 8 1279 1 1 7 PRO HA H 1.277 -5.384 1.962 1.00 . A A . 7 PRO HA 1 1 8 1280 1 1 7 PRO HB2 H -0.363 -4.946 -0.467 1.00 . A A . 7 PRO HB2 1 1 8 1281 1 1 7 PRO HB3 H -0.182 -6.398 0.520 1.00 . A A . 7 PRO HB3 1 1 8 1282 1 1 7 PRO HD2 H -1.627 -2.840 1.230 1.00 . A A . 7 PRO HD2 1 1 8 1283 1 1 7 PRO HD3 H -1.839 -3.538 2.848 1.00 . A A . 7 PRO HD3 1 1 8 1284 1 1 7 PRO HG2 H -2.412 -4.926 0.613 1.00 . A A . 7 PRO HG2 1 1 8 1285 1 1 7 PRO HG3 H -1.755 -5.708 2.063 1.00 . A A . 7 PRO HG3 1 1 8 1286 1 1 7 PRO N N 0.139 -3.611 2.101 1.00 . A A . 7 PRO N 1 1 8 1287 1 1 7 PRO O O 3.050 -4.222 0.600 1.00 . A A . 7 PRO O 1 1 8 1288 1 1 8 ASN C C 1.618 -1.670 -2.425 1.00 . A A . 8 ASN C 1 1 8 1289 1 1 8 ASN CA C 2.311 -2.796 -1.648 1.00 . A A . 8 ASN CA 1 1 8 1290 1 1 8 ASN CB C 2.934 -3.810 -2.616 1.00 . A A . 8 ASN CB 1 1 8 1291 1 1 8 ASN CG C 1.908 -4.643 -3.372 1.00 . A A . 8 ASN CG 1 1 8 1292 1 1 8 ASN H H 0.442 -3.465 -0.914 1.00 . A A . 8 ASN H 1 1 8 1293 1 1 8 ASN HA H 3.100 -2.358 -1.058 1.00 . A A . 8 ASN HA 1 1 8 1294 1 1 8 ASN HB2 H 3.541 -3.282 -3.336 1.00 . A A . 8 ASN HB2 1 1 8 1295 1 1 8 ASN HB3 H 3.562 -4.478 -2.047 1.00 . A A . 8 ASN HB3 1 1 8 1296 1 1 8 ASN HD21 H 2.003 -6.066 -1.989 1.00 . A A . 8 ASN HD21 1 1 8 1297 1 1 8 ASN HD22 H 0.920 -6.364 -3.304 1.00 . A A . 8 ASN HD22 1 1 8 1298 1 1 8 ASN N N 1.403 -3.466 -0.723 1.00 . A A . 8 ASN N 1 1 8 1299 1 1 8 ASN ND2 N 1.575 -5.805 -2.834 1.00 . A A . 8 ASN ND2 1 1 8 1300 1 1 8 ASN O O 1.675 -1.627 -3.654 1.00 . A A . 8 ASN O 1 1 8 1301 1 1 8 ASN OD1 O 1.432 -4.255 -4.440 1.00 . A A . 8 ASN OD1 1 1 8 1302 1 1 9 PRO C C 1.367 1.443 -2.826 1.00 . A A . 9 PRO C 1 1 8 1303 1 1 9 PRO CA C 0.330 0.422 -2.381 1.00 . A A . 9 PRO CA 1 1 8 1304 1 1 9 PRO CB C -0.583 1.013 -1.294 1.00 . A A . 9 PRO CB 1 1 8 1305 1 1 9 PRO CD C 0.752 -0.682 -0.281 1.00 . A A . 9 PRO CD 1 1 8 1306 1 1 9 PRO CG C -0.568 0.019 -0.180 1.00 . A A . 9 PRO CG 1 1 8 1307 1 1 9 PRO HA H -0.261 0.118 -3.230 1.00 . A A . 9 PRO HA 1 1 8 1308 1 1 9 PRO HB2 H -0.190 1.967 -0.975 1.00 . A A . 9 PRO HB2 1 1 8 1309 1 1 9 PRO HB3 H -1.579 1.146 -1.690 1.00 . A A . 9 PRO HB3 1 1 8 1310 1 1 9 PRO HD2 H 1.526 -0.110 0.210 1.00 . A A . 9 PRO HD2 1 1 8 1311 1 1 9 PRO HD3 H 0.689 -1.678 0.131 1.00 . A A . 9 PRO HD3 1 1 8 1312 1 1 9 PRO HG2 H -0.654 0.526 0.769 1.00 . A A . 9 PRO HG2 1 1 8 1313 1 1 9 PRO HG3 H -1.378 -0.686 -0.306 1.00 . A A . 9 PRO HG3 1 1 8 1314 1 1 9 PRO N N 0.960 -0.723 -1.730 1.00 . A A . 9 PRO N 1 1 8 1315 1 1 9 PRO O O 1.514 1.717 -4.018 1.00 . A A . 9 PRO O 1 1 8 1316 1 1 10 ILE C C 4.484 2.561 -1.577 1.00 . A A . 10 ILE C 1 1 8 1317 1 1 10 ILE CA C 3.131 2.966 -2.172 1.00 . A A . 10 ILE CA 1 1 8 1318 1 1 10 ILE CB C 2.726 4.370 -1.668 1.00 . A A . 10 ILE CB 1 1 8 1319 1 1 10 ILE CD1 C 3.738 5.620 -3.645 1.00 . A A . 10 ILE CD1 1 1 8 1320 1 1 10 ILE CG1 C 3.718 5.435 -2.143 1.00 . A A . 10 ILE CG1 1 1 8 1321 1 1 10 ILE CG2 C 2.602 4.396 -0.151 1.00 . A A . 10 ILE CG2 1 1 8 1322 1 1 10 ILE H H 1.907 1.775 -0.931 1.00 . A A . 10 ILE H 1 1 8 1323 1 1 10 ILE HA H 3.226 3.011 -3.247 1.00 . A A . 10 ILE HA 1 1 8 1324 1 1 10 ILE HB H 1.755 4.591 -2.076 1.00 . A A . 10 ILE HB 1 1 8 1325 1 1 10 ILE HD11 H 4.437 6.401 -3.900 1.00 . A A . 10 ILE HD11 1 1 8 1326 1 1 10 ILE HD12 H 2.751 5.895 -3.987 1.00 . A A . 10 ILE HD12 1 1 8 1327 1 1 10 ILE HD13 H 4.040 4.698 -4.118 1.00 . A A . 10 ILE HD13 1 1 8 1328 1 1 10 ILE HG12 H 3.459 6.383 -1.696 1.00 . A A . 10 ILE HG12 1 1 8 1329 1 1 10 ILE HG13 H 4.712 5.154 -1.829 1.00 . A A . 10 ILE HG13 1 1 8 1330 1 1 10 ILE HG21 H 3.557 4.155 0.292 1.00 . A A . 10 ILE HG21 1 1 8 1331 1 1 10 ILE HG22 H 1.866 3.671 0.164 1.00 . A A . 10 ILE HG22 1 1 8 1332 1 1 10 ILE HG23 H 2.296 5.382 0.169 1.00 . A A . 10 ILE HG23 1 1 8 1333 1 1 10 ILE N N 2.095 1.997 -1.864 1.00 . A A . 10 ILE N 1 1 8 1334 1 1 10 ILE O O 5.529 2.831 -2.165 1.00 . A A . 10 ILE O 1 1 8 1335 1 1 11 SER C C 5.938 0.078 0.391 1.00 . A A . 11 SER C 1 1 8 1336 1 1 11 SER CA C 5.699 1.584 0.281 1.00 . A A . 11 SER CA 1 1 8 1337 1 1 11 SER CB C 5.661 2.216 1.674 1.00 . A A . 11 SER CB 1 1 8 1338 1 1 11 SER H H 3.613 1.602 -0.054 1.00 . A A . 11 SER H 1 1 8 1339 1 1 11 SER HA H 6.513 2.022 -0.274 1.00 . A A . 11 SER HA 1 1 8 1340 1 1 11 SER HB2 H 4.873 1.759 2.254 1.00 . A A . 11 SER HB2 1 1 8 1341 1 1 11 SER HB3 H 6.609 2.058 2.165 1.00 . A A . 11 SER HB3 1 1 8 1342 1 1 11 SER HG H 5.919 3.978 0.851 1.00 . A A . 11 SER HG 1 1 8 1343 1 1 11 SER N N 4.465 1.891 -0.430 1.00 . A A . 11 SER N 1 1 8 1344 1 1 11 SER O O 5.644 -0.532 1.421 1.00 . A A . 11 SER O 1 1 8 1345 1 1 11 SER OG O 5.416 3.611 1.590 1.00 . A A . 11 SER OG 1 1 8 1346 1 1 12 ASN C C 7.402 -2.264 -2.085 1.00 . A A . 12 ASN C 1 1 8 1347 1 1 12 ASN CA C 6.896 -1.902 -0.700 1.00 . A A . 12 ASN CA 1 1 8 1348 1 1 12 ASN CB C 5.786 -2.878 -0.293 1.00 . A A . 12 ASN CB 1 1 8 1349 1 1 12 ASN CG C 6.311 -4.295 -0.133 1.00 . A A . 12 ASN CG 1 1 8 1350 1 1 12 ASN H H 6.534 0.018 -1.513 1.00 . A A . 12 ASN H 1 1 8 1351 1 1 12 ASN HA H 7.715 -1.989 0.000 1.00 . A A . 12 ASN HA 1 1 8 1352 1 1 12 ASN HB2 H 5.357 -2.561 0.646 1.00 . A A . 12 ASN HB2 1 1 8 1353 1 1 12 ASN HB3 H 5.018 -2.885 -1.055 1.00 . A A . 12 ASN HB3 1 1 8 1354 1 1 12 ASN HD21 H 4.526 -5.041 -0.570 1.00 . A A . 12 ASN HD21 1 1 8 1355 1 1 12 ASN HD22 H 5.766 -6.200 -0.248 1.00 . A A . 12 ASN HD22 1 1 8 1356 1 1 12 ASN N N 6.449 -0.508 -0.688 1.00 . A A . 12 ASN N 1 1 8 1357 1 1 12 ASN ND2 N 5.449 -5.277 -0.336 1.00 . A A . 12 ASN ND2 1 1 8 1358 1 1 12 ASN O O 6.587 -2.699 -2.927 1.00 . A A . 12 ASN O 1 1 8 1359 1 1 12 ASN OXT O 8.606 -2.071 -2.343 1.00 . A A . 12 ASN OXT 1 1 8 1360 1 1 12 ASN OD1 O 7.482 -4.504 0.185 1.00 . A A . 12 ASN OD1 1 1 9 1361 1 1 1 HIS C C -5.576 -0.814 -4.202 1.00 . A A . 1 HIS C 1 1 9 1362 1 1 1 HIS CA C -4.979 -2.214 -4.296 1.00 . A A . 1 HIS CA 1 1 9 1363 1 1 1 HIS CB C -5.922 -3.238 -3.649 1.00 . A A . 1 HIS CB 1 1 9 1364 1 1 1 HIS CD2 C -5.276 -5.405 -4.923 1.00 . A A . 1 HIS CD2 1 1 9 1365 1 1 1 HIS CE1 C -4.825 -6.670 -3.196 1.00 . A A . 1 HIS CE1 1 1 9 1366 1 1 1 HIS CG C -5.476 -4.659 -3.811 1.00 . A A . 1 HIS CG 1 1 9 1367 1 1 1 HIS H1 H -3.712 -2.009 -2.655 1.00 . A A . 1 HIS H1 1 1 9 1368 1 1 1 HIS H2 H -3.015 -1.554 -4.120 1.00 . A A . 1 HIS H2 1 1 9 1369 1 1 1 HIS H3 H -3.215 -3.190 -3.756 1.00 . A A . 1 HIS H3 1 1 9 1370 1 1 1 HIS HA H -4.856 -2.463 -5.340 1.00 . A A . 1 HIS HA 1 1 9 1371 1 1 1 HIS HB2 H -5.992 -3.034 -2.593 1.00 . A A . 1 HIS HB2 1 1 9 1372 1 1 1 HIS HB3 H -6.901 -3.145 -4.094 1.00 . A A . 1 HIS HB3 1 1 9 1373 1 1 1 HIS HD1 H -5.256 -5.240 -1.793 1.00 . A A . 1 HIS HD1 1 1 9 1374 1 1 1 HIS HD2 H -5.405 -5.077 -5.944 1.00 . A A . 1 HIS HD2 1 1 9 1375 1 1 1 HIS HE1 H -4.541 -7.517 -2.587 1.00 . A A . 1 HIS HE1 1 1 9 1376 1 1 1 HIS HE2 H -4.842 -7.451 -5.087 1.00 . A A . 1 HIS HE2 1 1 9 1377 1 1 1 HIS N N -3.640 -2.247 -3.661 1.00 . A A . 1 HIS N 1 1 9 1378 1 1 1 HIS ND1 N -5.186 -5.484 -2.746 1.00 . A A . 1 HIS ND1 1 1 9 1379 1 1 1 HIS NE2 N -4.872 -6.650 -4.514 1.00 . A A . 1 HIS NE2 1 1 9 1380 1 1 1 HIS O O -5.805 -0.169 -5.222 1.00 . A A . 1 HIS O 1 1 9 1381 1 1 2 GLU C C -5.232 1.944 -2.284 1.00 . A A . 2 GLU C 1 1 9 1382 1 1 2 GLU CA C -6.334 1.013 -2.799 1.00 . A A . 2 GLU CA 1 1 9 1383 1 1 2 GLU CB C -7.537 1.022 -1.851 1.00 . A A . 2 GLU CB 1 1 9 1384 1 1 2 GLU CD C -9.006 2.746 -2.969 1.00 . A A . 2 GLU CD 1 1 9 1385 1 1 2 GLU CG C -8.214 2.379 -1.734 1.00 . A A . 2 GLU CG 1 1 9 1386 1 1 2 GLU H H -5.668 -0.906 -2.198 1.00 . A A . 2 GLU H 1 1 9 1387 1 1 2 GLU HA H -6.654 1.370 -3.767 1.00 . A A . 2 GLU HA 1 1 9 1388 1 1 2 GLU HB2 H -8.267 0.312 -2.212 1.00 . A A . 2 GLU HB2 1 1 9 1389 1 1 2 GLU HB3 H -7.209 0.719 -0.870 1.00 . A A . 2 GLU HB3 1 1 9 1390 1 1 2 GLU HG2 H -8.884 2.362 -0.887 1.00 . A A . 2 GLU HG2 1 1 9 1391 1 1 2 GLU HG3 H -7.453 3.131 -1.575 1.00 . A A . 2 GLU HG3 1 1 9 1392 1 1 2 GLU N N -5.823 -0.340 -2.983 1.00 . A A . 2 GLU N 1 1 9 1393 1 1 2 GLU O O -4.426 2.444 -3.072 1.00 . A A . 2 GLU O 1 1 9 1394 1 1 2 GLU OE1 O -8.388 3.134 -3.980 1.00 . A A . 2 GLU OE1 1 1 9 1395 1 1 2 GLU OE2 O -10.251 2.651 -2.936 1.00 . A A . 2 GLU OE2 1 1 9 1396 1 1 3 VAL C C -3.967 2.834 1.131 1.00 . A A . 3 VAL C 1 1 9 1397 1 1 3 VAL CA C -4.155 3.033 -0.399 1.00 . A A . 3 VAL CA 1 1 9 1398 1 1 3 VAL CB C -4.521 4.500 -0.722 1.00 . A A . 3 VAL CB 1 1 9 1399 1 1 3 VAL CG1 C -5.747 4.961 0.057 1.00 . A A . 3 VAL CG1 1 1 9 1400 1 1 3 VAL CG2 C -3.337 5.434 -0.508 1.00 . A A . 3 VAL CG2 1 1 9 1401 1 1 3 VAL H H -5.833 1.750 -0.378 1.00 . A A . 3 VAL H 1 1 9 1402 1 1 3 VAL HA H -3.220 2.810 -0.889 1.00 . A A . 3 VAL HA 1 1 9 1403 1 1 3 VAL HB H -4.784 4.530 -1.768 1.00 . A A . 3 VAL HB 1 1 9 1404 1 1 3 VAL HG11 H -6.598 4.355 -0.215 1.00 . A A . 3 VAL HG11 1 1 9 1405 1 1 3 VAL HG12 H -5.954 5.996 -0.175 1.00 . A A . 3 VAL HG12 1 1 9 1406 1 1 3 VAL HG13 H -5.559 4.861 1.116 1.00 . A A . 3 VAL HG13 1 1 9 1407 1 1 3 VAL HG21 H -3.007 5.364 0.518 1.00 . A A . 3 VAL HG21 1 1 9 1408 1 1 3 VAL HG22 H -3.634 6.449 -0.722 1.00 . A A . 3 VAL HG22 1 1 9 1409 1 1 3 VAL HG23 H -2.529 5.149 -1.165 1.00 . A A . 3 VAL HG23 1 1 9 1410 1 1 3 VAL N N -5.169 2.158 -0.967 1.00 . A A . 3 VAL N 1 1 9 1411 1 1 3 VAL O O -3.887 3.800 1.890 1.00 . A A . 3 VAL O 1 1 9 1412 1 1 4 PRO C C -2.186 1.469 3.460 1.00 . A A . 4 PRO C 1 1 9 1413 1 1 4 PRO CA C -3.651 1.333 3.048 1.00 . A A . 4 PRO CA 1 1 9 1414 1 1 4 PRO CB C -4.127 -0.112 3.243 1.00 . A A . 4 PRO CB 1 1 9 1415 1 1 4 PRO CD C -3.889 0.326 0.872 1.00 . A A . 4 PRO CD 1 1 9 1416 1 1 4 PRO CG C -4.430 -0.654 1.879 1.00 . A A . 4 PRO CG 1 1 9 1417 1 1 4 PRO HA H -4.254 1.998 3.649 1.00 . A A . 4 PRO HA 1 1 9 1418 1 1 4 PRO HB2 H -3.348 -0.682 3.724 1.00 . A A . 4 PRO HB2 1 1 9 1419 1 1 4 PRO HB3 H -5.010 -0.117 3.864 1.00 . A A . 4 PRO HB3 1 1 9 1420 1 1 4 PRO HD2 H -2.901 0.034 0.553 1.00 . A A . 4 PRO HD2 1 1 9 1421 1 1 4 PRO HD3 H -4.554 0.404 0.025 1.00 . A A . 4 PRO HD3 1 1 9 1422 1 1 4 PRO HG2 H -3.948 -1.613 1.756 1.00 . A A . 4 PRO HG2 1 1 9 1423 1 1 4 PRO HG3 H -5.498 -0.757 1.764 1.00 . A A . 4 PRO HG3 1 1 9 1424 1 1 4 PRO N N -3.847 1.583 1.622 1.00 . A A . 4 PRO N 1 1 9 1425 1 1 4 PRO O O -1.852 1.407 4.644 1.00 . A A . 4 PRO O 1 1 9 1426 1 1 5 SER C C 0.715 0.559 3.365 1.00 . A A . 5 SER C 1 1 9 1427 1 1 5 SER CA C 0.123 1.778 2.653 1.00 . A A . 5 SER CA 1 1 9 1428 1 1 5 SER CB C 0.437 3.061 3.428 1.00 . A A . 5 SER CB 1 1 9 1429 1 1 5 SER H H -1.678 1.713 1.549 1.00 . A A . 5 SER H 1 1 9 1430 1 1 5 SER HA H 0.575 1.850 1.674 1.00 . A A . 5 SER HA 1 1 9 1431 1 1 5 SER HB2 H -0.060 3.033 4.386 1.00 . A A . 5 SER HB2 1 1 9 1432 1 1 5 SER HB3 H 1.504 3.138 3.577 1.00 . A A . 5 SER HB3 1 1 9 1433 1 1 5 SER HG H 0.731 4.812 2.594 1.00 . A A . 5 SER HG 1 1 9 1434 1 1 5 SER N N -1.322 1.646 2.456 1.00 . A A . 5 SER N 1 1 9 1435 1 1 5 SER O O 1.793 0.634 3.952 1.00 . A A . 5 SER O 1 1 9 1436 1 1 5 SER OG O -0.010 4.202 2.714 1.00 . A A . 5 SER OG 1 1 9 1437 1 1 6 GLY C C 1.301 -2.662 3.072 1.00 . A A . 6 GLY C 1 1 9 1438 1 1 6 GLY CA C 0.457 -1.768 3.958 1.00 . A A . 6 GLY CA 1 1 9 1439 1 1 6 GLY H H -0.819 -0.574 2.773 1.00 . A A . 6 GLY H 1 1 9 1440 1 1 6 GLY HA2 H 1.040 -1.485 4.823 1.00 . A A . 6 GLY HA2 1 1 9 1441 1 1 6 GLY HA3 H -0.409 -2.321 4.288 1.00 . A A . 6 GLY HA3 1 1 9 1442 1 1 6 GLY N N 0.013 -0.565 3.285 1.00 . A A . 6 GLY N 1 1 9 1443 1 1 6 GLY O O 2.524 -2.521 3.040 1.00 . A A . 6 GLY O 1 1 9 1444 1 1 7 PRO C C 2.282 -3.929 0.445 1.00 . A A . 7 PRO C 1 1 9 1445 1 1 7 PRO CA C 1.374 -4.572 1.496 1.00 . A A . 7 PRO CA 1 1 9 1446 1 1 7 PRO CB C 0.248 -5.373 0.826 1.00 . A A . 7 PRO CB 1 1 9 1447 1 1 7 PRO CD C -0.793 -3.756 2.247 1.00 . A A . 7 PRO CD 1 1 9 1448 1 1 7 PRO CG C -0.980 -4.540 0.982 1.00 . A A . 7 PRO CG 1 1 9 1449 1 1 7 PRO HA H 1.966 -5.237 2.107 1.00 . A A . 7 PRO HA 1 1 9 1450 1 1 7 PRO HB2 H 0.486 -5.528 -0.217 1.00 . A A . 7 PRO HB2 1 1 9 1451 1 1 7 PRO HB3 H 0.140 -6.327 1.319 1.00 . A A . 7 PRO HB3 1 1 9 1452 1 1 7 PRO HD2 H -1.289 -2.798 2.177 1.00 . A A . 7 PRO HD2 1 1 9 1453 1 1 7 PRO HD3 H -1.163 -4.312 3.095 1.00 . A A . 7 PRO HD3 1 1 9 1454 1 1 7 PRO HG2 H -1.078 -3.871 0.139 1.00 . A A . 7 PRO HG2 1 1 9 1455 1 1 7 PRO HG3 H -1.848 -5.176 1.060 1.00 . A A . 7 PRO HG3 1 1 9 1456 1 1 7 PRO N N 0.666 -3.587 2.326 1.00 . A A . 7 PRO N 1 1 9 1457 1 1 7 PRO O O 3.496 -3.843 0.636 1.00 . A A . 7 PRO O 1 1 9 1458 1 1 8 ASN C C 1.652 -1.735 -2.443 1.00 . A A . 8 ASN C 1 1 9 1459 1 1 8 ASN CA C 2.460 -2.811 -1.704 1.00 . A A . 8 ASN CA 1 1 9 1460 1 1 8 ASN CB C 2.981 -3.844 -2.708 1.00 . A A . 8 ASN CB 1 1 9 1461 1 1 8 ASN CG C 1.905 -4.804 -3.193 1.00 . A A . 8 ASN CG 1 1 9 1462 1 1 8 ASN H H 0.735 -3.609 -0.781 1.00 . A A . 8 ASN H 1 1 9 1463 1 1 8 ASN HA H 3.307 -2.336 -1.234 1.00 . A A . 8 ASN HA 1 1 9 1464 1 1 8 ASN HB2 H 3.383 -3.327 -3.566 1.00 . A A . 8 ASN HB2 1 1 9 1465 1 1 8 ASN HB3 H 3.765 -4.413 -2.241 1.00 . A A . 8 ASN HB3 1 1 9 1466 1 1 8 ASN HD21 H 2.371 -6.092 -1.753 1.00 . A A . 8 ASN HD21 1 1 9 1467 1 1 8 ASN HD22 H 1.093 -6.575 -2.812 1.00 . A A . 8 ASN HD22 1 1 9 1468 1 1 8 ASN N N 1.695 -3.477 -0.657 1.00 . A A . 8 ASN N 1 1 9 1469 1 1 8 ASN ND2 N 1.775 -5.936 -2.519 1.00 . A A . 8 ASN ND2 1 1 9 1470 1 1 8 ASN O O 1.671 -1.688 -3.669 1.00 . A A . 8 ASN O 1 1 9 1471 1 1 8 ASN OD1 O 1.206 -4.537 -4.170 1.00 . A A . 8 ASN OD1 1 1 9 1472 1 1 9 PRO C C 1.171 1.381 -2.745 1.00 . A A . 9 PRO C 1 1 9 1473 1 1 9 PRO CA C 0.214 0.255 -2.368 1.00 . A A . 9 PRO CA 1 1 9 1474 1 1 9 PRO CB C -0.782 0.718 -1.291 1.00 . A A . 9 PRO CB 1 1 9 1475 1 1 9 PRO CD C 0.745 -0.816 -0.281 1.00 . A A . 9 PRO CD 1 1 9 1476 1 1 9 PRO CG C -0.639 -0.259 -0.167 1.00 . A A . 9 PRO CG 1 1 9 1477 1 1 9 PRO HA H -0.320 -0.076 -3.247 1.00 . A A . 9 PRO HA 1 1 9 1478 1 1 9 PRO HB2 H -0.529 1.719 -0.973 1.00 . A A . 9 PRO HB2 1 1 9 1479 1 1 9 PRO HB3 H -1.783 0.707 -1.695 1.00 . A A . 9 PRO HB3 1 1 9 1480 1 1 9 PRO HD2 H 1.460 -0.160 0.194 1.00 . A A . 9 PRO HD2 1 1 9 1481 1 1 9 PRO HD3 H 0.795 -1.809 0.138 1.00 . A A . 9 PRO HD3 1 1 9 1482 1 1 9 PRO HG2 H -0.763 0.245 0.779 1.00 . A A . 9 PRO HG2 1 1 9 1483 1 1 9 PRO HG3 H -1.369 -1.050 -0.272 1.00 . A A . 9 PRO HG3 1 1 9 1484 1 1 9 PRO N N 0.933 -0.844 -1.730 1.00 . A A . 9 PRO N 1 1 9 1485 1 1 9 PRO O O 1.443 1.622 -3.921 1.00 . A A . 9 PRO O 1 1 9 1486 1 1 10 ILE C C 4.033 2.491 -1.332 1.00 . A A . 10 ILE C 1 1 9 1487 1 1 10 ILE CA C 2.736 3.045 -1.918 1.00 . A A . 10 ILE CA 1 1 9 1488 1 1 10 ILE CB C 2.373 4.386 -1.235 1.00 . A A . 10 ILE CB 1 1 9 1489 1 1 10 ILE CD1 C 0.498 6.097 -0.962 1.00 . A A . 10 ILE CD1 1 1 9 1490 1 1 10 ILE CG1 C 0.962 4.825 -1.641 1.00 . A A . 10 ILE CG1 1 1 9 1491 1 1 10 ILE CG2 C 3.385 5.469 -1.599 1.00 . A A . 10 ILE CG2 1 1 9 1492 1 1 10 ILE H H 1.344 1.897 -0.829 1.00 . A A . 10 ILE H 1 1 9 1493 1 1 10 ILE HA H 2.864 3.211 -2.979 1.00 . A A . 10 ILE HA 1 1 9 1494 1 1 10 ILE HB H 2.405 4.242 -0.166 1.00 . A A . 10 ILE HB 1 1 9 1495 1 1 10 ILE HD11 H 1.169 6.905 -1.217 1.00 . A A . 10 ILE HD11 1 1 9 1496 1 1 10 ILE HD12 H 0.496 5.954 0.107 1.00 . A A . 10 ILE HD12 1 1 9 1497 1 1 10 ILE HD13 H -0.499 6.340 -1.296 1.00 . A A . 10 ILE HD13 1 1 9 1498 1 1 10 ILE HG12 H 0.937 4.992 -2.707 1.00 . A A . 10 ILE HG12 1 1 9 1499 1 1 10 ILE HG13 H 0.264 4.041 -1.388 1.00 . A A . 10 ILE HG13 1 1 9 1500 1 1 10 ILE HG21 H 4.367 5.168 -1.266 1.00 . A A . 10 ILE HG21 1 1 9 1501 1 1 10 ILE HG22 H 3.110 6.395 -1.117 1.00 . A A . 10 ILE HG22 1 1 9 1502 1 1 10 ILE HG23 H 3.393 5.608 -2.669 1.00 . A A . 10 ILE HG23 1 1 9 1503 1 1 10 ILE N N 1.686 2.058 -1.730 1.00 . A A . 10 ILE N 1 1 9 1504 1 1 10 ILE O O 5.123 3.019 -1.550 1.00 . A A . 10 ILE O 1 1 9 1505 1 1 11 SER C C 5.521 -0.444 -0.725 1.00 . A A . 11 SER C 1 1 9 1506 1 1 11 SER CA C 5.010 0.757 0.069 1.00 . A A . 11 SER CA 1 1 9 1507 1 1 11 SER CB C 4.580 0.336 1.475 1.00 . A A . 11 SER CB 1 1 9 1508 1 1 11 SER H H 3.008 0.986 -0.523 1.00 . A A . 11 SER H 1 1 9 1509 1 1 11 SER HA H 5.801 1.485 0.148 1.00 . A A . 11 SER HA 1 1 9 1510 1 1 11 SER HB2 H 5.286 -0.383 1.864 1.00 . A A . 11 SER HB2 1 1 9 1511 1 1 11 SER HB3 H 4.557 1.203 2.119 1.00 . A A . 11 SER HB3 1 1 9 1512 1 1 11 SER HG H 3.256 -0.969 2.106 1.00 . A A . 11 SER HG 1 1 9 1513 1 1 11 SER N N 3.892 1.391 -0.603 1.00 . A A . 11 SER N 1 1 9 1514 1 1 11 SER O O 5.305 -1.599 -0.349 1.00 . A A . 11 SER O 1 1 9 1515 1 1 11 SER OG O 3.290 -0.255 1.454 1.00 . A A . 11 SER OG 1 1 9 1516 1 1 12 ASN C C 7.905 -0.611 -3.511 1.00 . A A . 12 ASN C 1 1 9 1517 1 1 12 ASN CA C 6.788 -1.200 -2.655 1.00 . A A . 12 ASN CA 1 1 9 1518 1 1 12 ASN CB C 5.741 -1.922 -3.531 1.00 . A A . 12 ASN CB 1 1 9 1519 1 1 12 ASN CG C 4.907 -0.995 -4.406 1.00 . A A . 12 ASN CG 1 1 9 1520 1 1 12 ASN H H 6.273 0.776 -2.113 1.00 . A A . 12 ASN H 1 1 9 1521 1 1 12 ASN HA H 7.229 -1.921 -1.981 1.00 . A A . 12 ASN HA 1 1 9 1522 1 1 12 ASN HB2 H 6.253 -2.617 -4.178 1.00 . A A . 12 ASN HB2 1 1 9 1523 1 1 12 ASN HB3 H 5.069 -2.477 -2.885 1.00 . A A . 12 ASN HB3 1 1 9 1524 1 1 12 ASN HD21 H 4.850 -2.379 -5.825 1.00 . A A . 12 ASN HD21 1 1 9 1525 1 1 12 ASN HD22 H 4.025 -0.900 -6.179 1.00 . A A . 12 ASN HD22 1 1 9 1526 1 1 12 ASN N N 6.184 -0.162 -1.835 1.00 . A A . 12 ASN N 1 1 9 1527 1 1 12 ASN ND2 N 4.557 -1.472 -5.587 1.00 . A A . 12 ASN ND2 1 1 9 1528 1 1 12 ASN O O 7.671 -0.311 -4.699 1.00 . A A . 12 ASN O 1 1 9 1529 1 1 12 ASN OXT O 9.015 -0.425 -2.972 1.00 . A A . 12 ASN OXT 1 1 9 1530 1 1 12 ASN OD1 O 4.584 0.134 -4.033 1.00 . A A . 12 ASN OD1 1 1 10 1531 1 1 1 HIS C C -4.521 0.306 -4.159 1.00 . A A . 1 HIS C 1 1 10 1532 1 1 1 HIS CA C -3.810 -1.006 -4.462 1.00 . A A . 1 HIS CA 1 1 10 1533 1 1 1 HIS CB C -2.595 -0.721 -5.364 1.00 . A A . 1 HIS CB 1 1 10 1534 1 1 1 HIS CD2 C -1.709 -2.500 -7.033 1.00 . A A . 1 HIS CD2 1 1 10 1535 1 1 1 HIS CE1 C -0.513 -3.694 -5.641 1.00 . A A . 1 HIS CE1 1 1 10 1536 1 1 1 HIS CG C -1.833 -1.935 -5.807 1.00 . A A . 1 HIS CG 1 1 10 1537 1 1 1 HIS H1 H -5.573 -2.108 -4.487 1.00 . A A . 1 HIS H1 1 1 10 1538 1 1 1 HIS H2 H -4.300 -2.850 -5.306 1.00 . A A . 1 HIS H2 1 1 10 1539 1 1 1 HIS H3 H -5.105 -1.540 -6.006 1.00 . A A . 1 HIS H3 1 1 10 1540 1 1 1 HIS HA H -3.471 -1.446 -3.537 1.00 . A A . 1 HIS HA 1 1 10 1541 1 1 1 HIS HB2 H -2.935 -0.210 -6.252 1.00 . A A . 1 HIS HB2 1 1 10 1542 1 1 1 HIS HB3 H -1.911 -0.076 -4.831 1.00 . A A . 1 HIS HB3 1 1 10 1543 1 1 1 HIS HD1 H -0.951 -2.564 -3.991 1.00 . A A . 1 HIS HD1 1 1 10 1544 1 1 1 HIS HD2 H -2.169 -2.154 -7.947 1.00 . A A . 1 HIS HD2 1 1 10 1545 1 1 1 HIS HE1 H 0.139 -4.454 -5.238 1.00 . A A . 1 HIS HE1 1 1 10 1546 1 1 1 HIS HE2 H -0.715 -4.262 -7.600 1.00 . A A . 1 HIS HE2 1 1 10 1547 1 1 1 HIS N N -4.757 -1.943 -5.110 1.00 . A A . 1 HIS N 1 1 10 1548 1 1 1 HIS ND1 N -1.069 -2.709 -4.957 1.00 . A A . 1 HIS ND1 1 1 10 1549 1 1 1 HIS NE2 N -0.886 -3.589 -6.901 1.00 . A A . 1 HIS NE2 1 1 10 1550 1 1 1 HIS O O -4.272 1.318 -4.817 1.00 . A A . 1 HIS O 1 1 10 1551 1 1 2 GLU C C -5.410 2.511 -2.108 1.00 . A A . 2 GLU C 1 1 10 1552 1 1 2 GLU CA C -6.220 1.467 -2.875 1.00 . A A . 2 GLU CA 1 1 10 1553 1 1 2 GLU CB C -7.482 1.088 -2.093 1.00 . A A . 2 GLU CB 1 1 10 1554 1 1 2 GLU CD C -9.074 2.677 -3.247 1.00 . A A . 2 GLU CD 1 1 10 1555 1 1 2 GLU CG C -8.464 2.239 -1.932 1.00 . A A . 2 GLU CG 1 1 10 1556 1 1 2 GLU H H -5.530 -0.525 -2.638 1.00 . A A . 2 GLU H 1 1 10 1557 1 1 2 GLU HA H -6.519 1.898 -3.819 1.00 . A A . 2 GLU HA 1 1 10 1558 1 1 2 GLU HB2 H -7.983 0.284 -2.612 1.00 . A A . 2 GLU HB2 1 1 10 1559 1 1 2 GLU HB3 H -7.194 0.746 -1.111 1.00 . A A . 2 GLU HB3 1 1 10 1560 1 1 2 GLU HG2 H -9.257 1.929 -1.270 1.00 . A A . 2 GLU HG2 1 1 10 1561 1 1 2 GLU HG3 H -7.941 3.080 -1.496 1.00 . A A . 2 GLU HG3 1 1 10 1562 1 1 2 GLU N N -5.413 0.292 -3.173 1.00 . A A . 2 GLU N 1 1 10 1563 1 1 2 GLU O O -4.793 3.387 -2.716 1.00 . A A . 2 GLU O 1 1 10 1564 1 1 2 GLU OE1 O -10.118 2.121 -3.645 1.00 . A A . 2 GLU OE1 1 1 10 1565 1 1 2 GLU OE2 O -8.512 3.583 -3.894 1.00 . A A . 2 GLU OE2 1 1 10 1566 1 1 3 VAL C C -4.435 2.876 1.486 1.00 . A A . 3 VAL C 1 1 10 1567 1 1 3 VAL CA C -4.644 3.366 0.029 1.00 . A A . 3 VAL CA 1 1 10 1568 1 1 3 VAL CB C -5.370 4.733 0.002 1.00 . A A . 3 VAL CB 1 1 10 1569 1 1 3 VAL CG1 C -6.677 4.697 0.789 1.00 . A A . 3 VAL CG1 1 1 10 1570 1 1 3 VAL CG2 C -4.464 5.860 0.479 1.00 . A A . 3 VAL CG2 1 1 10 1571 1 1 3 VAL H H -5.922 1.727 -0.340 1.00 . A A . 3 VAL H 1 1 10 1572 1 1 3 VAL HA H -3.677 3.495 -0.432 1.00 . A A . 3 VAL HA 1 1 10 1573 1 1 3 VAL HB H -5.628 4.927 -1.026 1.00 . A A . 3 VAL HB 1 1 10 1574 1 1 3 VAL HG11 H -7.143 5.671 0.755 1.00 . A A . 3 VAL HG11 1 1 10 1575 1 1 3 VAL HG12 H -6.472 4.432 1.815 1.00 . A A . 3 VAL HG12 1 1 10 1576 1 1 3 VAL HG13 H -7.339 3.965 0.353 1.00 . A A . 3 VAL HG13 1 1 10 1577 1 1 3 VAL HG21 H -4.143 5.660 1.492 1.00 . A A . 3 VAL HG21 1 1 10 1578 1 1 3 VAL HG22 H -5.005 6.794 0.451 1.00 . A A . 3 VAL HG22 1 1 10 1579 1 1 3 VAL HG23 H -3.600 5.925 -0.165 1.00 . A A . 3 VAL HG23 1 1 10 1580 1 1 3 VAL N N -5.397 2.418 -0.780 1.00 . A A . 3 VAL N 1 1 10 1581 1 1 3 VAL O O -4.579 3.642 2.438 1.00 . A A . 3 VAL O 1 1 10 1582 1 1 4 PRO C C -2.449 1.234 3.552 1.00 . A A . 4 PRO C 1 1 10 1583 1 1 4 PRO CA C -3.879 1.071 3.046 1.00 . A A . 4 PRO CA 1 1 10 1584 1 1 4 PRO CB C -4.225 -0.411 2.887 1.00 . A A . 4 PRO CB 1 1 10 1585 1 1 4 PRO CD C -3.756 0.569 0.708 1.00 . A A . 4 PRO CD 1 1 10 1586 1 1 4 PRO CG C -4.128 -0.711 1.419 1.00 . A A . 4 PRO CG 1 1 10 1587 1 1 4 PRO HA H -4.561 1.530 3.745 1.00 . A A . 4 PRO HA 1 1 10 1588 1 1 4 PRO HB2 H -3.523 -1.005 3.455 1.00 . A A . 4 PRO HB2 1 1 10 1589 1 1 4 PRO HB3 H -5.225 -0.587 3.252 1.00 . A A . 4 PRO HB3 1 1 10 1590 1 1 4 PRO HD2 H -2.705 0.568 0.459 1.00 . A A . 4 PRO HD2 1 1 10 1591 1 1 4 PRO HD3 H -4.358 0.701 -0.179 1.00 . A A . 4 PRO HD3 1 1 10 1592 1 1 4 PRO HG2 H -3.369 -1.460 1.252 1.00 . A A . 4 PRO HG2 1 1 10 1593 1 1 4 PRO HG3 H -5.084 -1.067 1.066 1.00 . A A . 4 PRO HG3 1 1 10 1594 1 1 4 PRO N N -4.055 1.599 1.704 1.00 . A A . 4 PRO N 1 1 10 1595 1 1 4 PRO O O -2.151 0.964 4.712 1.00 . A A . 4 PRO O 1 1 10 1596 1 1 5 SER C C 0.467 0.681 3.622 1.00 . A A . 5 SER C 1 1 10 1597 1 1 5 SER CA C -0.148 1.889 2.923 1.00 . A A . 5 SER CA 1 1 10 1598 1 1 5 SER CB C 0.086 3.179 3.726 1.00 . A A . 5 SER CB 1 1 10 1599 1 1 5 SER H H -1.917 1.948 1.767 1.00 . A A . 5 SER H 1 1 10 1600 1 1 5 SER HA H 0.339 1.992 1.967 1.00 . A A . 5 SER HA 1 1 10 1601 1 1 5 SER HB2 H 1.073 3.152 4.163 1.00 . A A . 5 SER HB2 1 1 10 1602 1 1 5 SER HB3 H 0.014 4.027 3.062 1.00 . A A . 5 SER HB3 1 1 10 1603 1 1 5 SER HG H -1.249 2.473 4.987 1.00 . A A . 5 SER HG 1 1 10 1604 1 1 5 SER N N -1.576 1.702 2.650 1.00 . A A . 5 SER N 1 1 10 1605 1 1 5 SER O O 1.288 0.821 4.526 1.00 . A A . 5 SER O 1 1 10 1606 1 1 5 SER OG O -0.866 3.336 4.770 1.00 . A A . 5 SER OG 1 1 10 1607 1 1 6 GLY C C 1.286 -2.647 2.872 1.00 . A A . 6 GLY C 1 1 10 1608 1 1 6 GLY CA C 0.528 -1.722 3.806 1.00 . A A . 6 GLY CA 1 1 10 1609 1 1 6 GLY H H -0.496 -0.544 2.381 1.00 . A A . 6 GLY H 1 1 10 1610 1 1 6 GLY HA2 H 1.169 -1.462 4.633 1.00 . A A . 6 GLY HA2 1 1 10 1611 1 1 6 GLY HA3 H -0.336 -2.245 4.190 1.00 . A A . 6 GLY HA3 1 1 10 1612 1 1 6 GLY N N 0.087 -0.503 3.164 1.00 . A A . 6 GLY N 1 1 10 1613 1 1 6 GLY O O 2.475 -2.434 2.629 1.00 . A A . 6 GLY O 1 1 10 1614 1 1 7 PRO C C 2.165 -4.197 0.422 1.00 . A A . 7 PRO C 1 1 10 1615 1 1 7 PRO CA C 1.227 -4.729 1.502 1.00 . A A . 7 PRO CA 1 1 10 1616 1 1 7 PRO CB C 0.035 -5.461 0.865 1.00 . A A . 7 PRO CB 1 1 10 1617 1 1 7 PRO CD C -0.842 -3.882 2.432 1.00 . A A . 7 PRO CD 1 1 10 1618 1 1 7 PRO CG C -1.162 -4.622 1.170 1.00 . A A . 7 PRO CG 1 1 10 1619 1 1 7 PRO HA H 1.774 -5.420 2.125 1.00 . A A . 7 PRO HA 1 1 10 1620 1 1 7 PRO HB2 H 0.193 -5.546 -0.200 1.00 . A A . 7 PRO HB2 1 1 10 1621 1 1 7 PRO HB3 H -0.056 -6.446 1.298 1.00 . A A . 7 PRO HB3 1 1 10 1622 1 1 7 PRO HD2 H -1.372 -2.941 2.466 1.00 . A A . 7 PRO HD2 1 1 10 1623 1 1 7 PRO HD3 H -1.076 -4.485 3.296 1.00 . A A . 7 PRO HD3 1 1 10 1624 1 1 7 PRO HG2 H -1.338 -3.927 0.363 1.00 . A A . 7 PRO HG2 1 1 10 1625 1 1 7 PRO HG3 H -2.025 -5.254 1.315 1.00 . A A . 7 PRO HG3 1 1 10 1626 1 1 7 PRO N N 0.604 -3.670 2.316 1.00 . A A . 7 PRO N 1 1 10 1627 1 1 7 PRO O O 3.382 -4.307 0.544 1.00 . A A . 7 PRO O 1 1 10 1628 1 1 8 ASN C C 1.654 -1.970 -2.479 1.00 . A A . 8 ASN C 1 1 10 1629 1 1 8 ASN CA C 2.421 -3.033 -1.687 1.00 . A A . 8 ASN CA 1 1 10 1630 1 1 8 ASN CB C 2.955 -4.128 -2.622 1.00 . A A . 8 ASN CB 1 1 10 1631 1 1 8 ASN CG C 1.861 -4.925 -3.323 1.00 . A A . 8 ASN CG 1 1 10 1632 1 1 8 ASN H H 0.632 -3.610 -0.716 1.00 . A A . 8 ASN H 1 1 10 1633 1 1 8 ASN HA H 3.260 -2.552 -1.209 1.00 . A A . 8 ASN HA 1 1 10 1634 1 1 8 ASN HB2 H 3.574 -3.671 -3.380 1.00 . A A . 8 ASN HB2 1 1 10 1635 1 1 8 ASN HB3 H 3.558 -4.809 -2.041 1.00 . A A . 8 ASN HB3 1 1 10 1636 1 1 8 ASN HD21 H 3.096 -5.337 -4.822 1.00 . A A . 8 ASN HD21 1 1 10 1637 1 1 8 ASN HD22 H 1.502 -5.992 -4.956 1.00 . A A . 8 ASN HD22 1 1 10 1638 1 1 8 ASN N N 1.606 -3.622 -0.633 1.00 . A A . 8 ASN N 1 1 10 1639 1 1 8 ASN ND2 N 2.184 -5.472 -4.484 1.00 . A A . 8 ASN ND2 1 1 10 1640 1 1 8 ASN O O 1.552 -2.046 -3.702 1.00 . A A . 8 ASN O 1 1 10 1641 1 1 8 ASN OD1 O 0.742 -5.056 -2.826 1.00 . A A . 8 ASN OD1 1 1 10 1642 1 1 9 PRO C C 1.442 1.190 -2.951 1.00 . A A . 9 PRO C 1 1 10 1643 1 1 9 PRO CA C 0.432 0.156 -2.468 1.00 . A A . 9 PRO CA 1 1 10 1644 1 1 9 PRO CB C -0.478 0.750 -1.377 1.00 . A A . 9 PRO CB 1 1 10 1645 1 1 9 PRO CD C 1.050 -0.786 -0.348 1.00 . A A . 9 PRO CD 1 1 10 1646 1 1 9 PRO CG C -0.273 -0.105 -0.163 1.00 . A A . 9 PRO CG 1 1 10 1647 1 1 9 PRO HA H -0.166 -0.184 -3.301 1.00 . A A . 9 PRO HA 1 1 10 1648 1 1 9 PRO HB2 H -0.191 1.773 -1.189 1.00 . A A . 9 PRO HB2 1 1 10 1649 1 1 9 PRO HB3 H -1.504 0.717 -1.710 1.00 . A A . 9 PRO HB3 1 1 10 1650 1 1 9 PRO HD2 H 1.856 -0.157 0.000 1.00 . A A . 9 PRO HD2 1 1 10 1651 1 1 9 PRO HD3 H 1.064 -1.743 0.152 1.00 . A A . 9 PRO HD3 1 1 10 1652 1 1 9 PRO HG2 H -0.255 0.513 0.722 1.00 . A A . 9 PRO HG2 1 1 10 1653 1 1 9 PRO HG3 H -1.063 -0.838 -0.092 1.00 . A A . 9 PRO HG3 1 1 10 1654 1 1 9 PRO N N 1.099 -0.952 -1.800 1.00 . A A . 9 PRO N 1 1 10 1655 1 1 9 PRO O O 1.666 1.340 -4.152 1.00 . A A . 9 PRO O 1 1 10 1656 1 1 10 ILE C C 4.441 2.453 -1.773 1.00 . A A . 10 ILE C 1 1 10 1657 1 1 10 ILE CA C 3.081 2.872 -2.328 1.00 . A A . 10 ILE CA 1 1 10 1658 1 1 10 ILE CB C 2.702 4.256 -1.761 1.00 . A A . 10 ILE CB 1 1 10 1659 1 1 10 ILE CD1 C 0.813 5.961 -1.655 1.00 . A A . 10 ILE CD1 1 1 10 1660 1 1 10 ILE CG1 C 1.321 4.676 -2.269 1.00 . A A . 10 ILE CG1 1 1 10 1661 1 1 10 ILE CG2 C 3.749 5.294 -2.138 1.00 . A A . 10 ILE CG2 1 1 10 1662 1 1 10 ILE H H 1.837 1.723 -1.069 1.00 . A A . 10 ILE H 1 1 10 1663 1 1 10 ILE HA H 3.148 2.948 -3.403 1.00 . A A . 10 ILE HA 1 1 10 1664 1 1 10 ILE HB H 2.674 4.186 -0.686 1.00 . A A . 10 ILE HB 1 1 10 1665 1 1 10 ILE HD11 H -0.151 6.205 -2.077 1.00 . A A . 10 ILE HD11 1 1 10 1666 1 1 10 ILE HD12 H 1.510 6.760 -1.862 1.00 . A A . 10 ILE HD12 1 1 10 1667 1 1 10 ILE HD13 H 0.715 5.836 -0.588 1.00 . A A . 10 ILE HD13 1 1 10 1668 1 1 10 ILE HG12 H 1.365 4.817 -3.338 1.00 . A A . 10 ILE HG12 1 1 10 1669 1 1 10 ILE HG13 H 0.610 3.896 -2.042 1.00 . A A . 10 ILE HG13 1 1 10 1670 1 1 10 ILE HG21 H 4.707 5.001 -1.735 1.00 . A A . 10 ILE HG21 1 1 10 1671 1 1 10 ILE HG22 H 3.466 6.254 -1.732 1.00 . A A . 10 ILE HG22 1 1 10 1672 1 1 10 ILE HG23 H 3.817 5.362 -3.213 1.00 . A A . 10 ILE HG23 1 1 10 1673 1 1 10 ILE N N 2.071 1.878 -2.007 1.00 . A A . 10 ILE N 1 1 10 1674 1 1 10 ILE O O 5.464 2.585 -2.444 1.00 . A A . 10 ILE O 1 1 10 1675 1 1 11 SER C C 6.464 0.537 -0.685 1.00 . A A . 11 SER C 1 1 10 1676 1 1 11 SER CA C 5.656 1.537 0.145 1.00 . A A . 11 SER CA 1 1 10 1677 1 1 11 SER CB C 5.312 0.936 1.513 1.00 . A A . 11 SER CB 1 1 10 1678 1 1 11 SER H H 3.577 1.842 -0.078 1.00 . A A . 11 SER H 1 1 10 1679 1 1 11 SER HA H 6.253 2.424 0.295 1.00 . A A . 11 SER HA 1 1 10 1680 1 1 11 SER HB2 H 4.688 1.626 2.061 1.00 . A A . 11 SER HB2 1 1 10 1681 1 1 11 SER HB3 H 4.779 0.008 1.370 1.00 . A A . 11 SER HB3 1 1 10 1682 1 1 11 SER HG H 6.229 0.435 3.174 1.00 . A A . 11 SER HG 1 1 10 1683 1 1 11 SER N N 4.433 1.938 -0.544 1.00 . A A . 11 SER N 1 1 10 1684 1 1 11 SER O O 7.638 0.773 -0.982 1.00 . A A . 11 SER O 1 1 10 1685 1 1 11 SER OG O 6.481 0.679 2.273 1.00 . A A . 11 SER OG 1 1 10 1686 1 1 12 ASN C C 6.130 -1.427 -3.328 1.00 . A A . 12 ASN C 1 1 10 1687 1 1 12 ASN CA C 6.511 -1.579 -1.865 1.00 . A A . 12 ASN CA 1 1 10 1688 1 1 12 ASN CB C 6.182 -2.994 -1.366 1.00 . A A . 12 ASN CB 1 1 10 1689 1 1 12 ASN CG C 6.762 -3.274 0.008 1.00 . A A . 12 ASN CG 1 1 10 1690 1 1 12 ASN H H 4.904 -0.702 -0.811 1.00 . A A . 12 ASN H 1 1 10 1691 1 1 12 ASN HA H 7.575 -1.413 -1.768 1.00 . A A . 12 ASN HA 1 1 10 1692 1 1 12 ASN HB2 H 5.108 -3.120 -1.319 1.00 . A A . 12 ASN HB2 1 1 10 1693 1 1 12 ASN HB3 H 6.589 -3.713 -2.061 1.00 . A A . 12 ASN HB3 1 1 10 1694 1 1 12 ASN HD21 H 5.245 -4.487 0.439 1.00 . A A . 12 ASN HD21 1 1 10 1695 1 1 12 ASN HD22 H 6.440 -4.299 1.677 1.00 . A A . 12 ASN HD22 1 1 10 1696 1 1 12 ASN N N 5.837 -0.567 -1.063 1.00 . A A . 12 ASN N 1 1 10 1697 1 1 12 ASN ND2 N 6.083 -4.100 0.785 1.00 . A A . 12 ASN ND2 1 1 10 1698 1 1 12 ASN O O 6.904 -0.801 -4.080 1.00 . A A . 12 ASN O 1 1 10 1699 1 1 12 ASN OXT O 5.051 -1.911 -3.719 1.00 . A A . 12 ASN OXT 1 1 10 1700 1 1 12 ASN OD1 O 7.816 -2.747 0.372 1.00 . A A . 12 ASN OD1 1 1 stop_ save_
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