NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
577948 | 2mmt | 19865 | cing | 4-filtered-FRED | STAR | entry | full | 114 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mmt # This FRED archive file contains, for PDB entry <2mmt>: # # - 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_2mmt _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mmt _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2253.45 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 $Microcin_J25_RGDF_mutant A . 1 1 stop_ save_ save_Microcin_J25_RGDF_mutant _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Microcin J25 RGDF mutant" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GGAGHVPEYFVRGDFPISFYG _Entity.Number_of_monomers 21 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 GLY . 1 1 2 GLY . 1 1 3 ALA . 1 1 4 GLY . 1 1 5 HIS . 1 1 6 VAL . 1 1 7 PRO . 1 1 8 GLU . 1 1 9 TYR . 1 1 10 PHE . 1 1 11 VAL . 1 1 12 ARG . 1 1 13 GLY . 1 1 14 ASP . 1 1 15 PHE . 1 1 16 PRO . 1 1 17 ILE . 1 1 18 SER . 1 1 19 PHE . 1 1 20 TYR . 1 1 21 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 GLY 2 2 1 1 ALA 3 3 1 1 GLY 4 4 1 1 HIS 5 5 1 1 VAL 6 6 1 1 PRO 7 7 1 1 GLU 8 8 1 1 TYR 9 9 1 1 PHE 10 10 1 1 VAL 11 11 1 1 ARG 12 12 1 1 GLY 13 13 1 1 ASP 14 14 1 1 PHE 15 15 1 1 PRO 16 16 1 1 ILE 17 17 1 1 SER 18 18 1 1 PHE 19 19 1 1 TYR 20 20 1 1 GLY 21 21 1 1 stop_ save_ save_DYANA/DIANA_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 . . . 1 1 8 1 . . . 1 1 9 1 . . . 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 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 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 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 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 GLY CA . 1 GLY CA 1 1 1 1 2 1 1 1 GLY H1 . 1 GLY H 1 1 2 1 1 1 1 1 GLY CA . 1 GLY CA 1 1 2 1 2 1 1 8 GLU CD . 8 GLU CD 1 1 3 1 1 1 1 1 GLY CA . 1 GLY CA 1 1 3 1 2 1 1 8 GLU OE1 . 8 GLU OE1 1 1 4 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 4 1 2 1 1 1 GLY HA2 . 1 GLY HA2 1 1 5 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 5 1 2 1 1 1 GLY HA3 . 1 GLY HA3 1 1 6 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 6 1 2 1 1 2 GLY H . 2 GLY H 1 1 7 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 7 1 2 1 1 8 GLU CD . 8 GLU CD 1 1 8 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 8 1 2 1 1 8 GLU QB . 8 GLU HB2 1 1 9 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 9 1 2 1 1 8 GLU QG . 8 GLU HG2 1 1 10 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 10 1 2 1 1 8 GLU OE1 . 8 GLU OE1 1 1 11 1 1 1 1 1 GLY H1 . 1 GLY H 1 1 11 1 2 1 1 18 SER QB . 18 SER HB2 1 1 12 1 1 1 1 1 GLY HA2 . 1 GLY HA2 1 1 12 1 2 1 1 2 GLY H . 2 GLY H 1 1 13 1 1 1 1 1 GLY N . 1 GLY N 1 1 13 1 2 1 1 8 GLU CD . 8 GLU CD 1 1 14 1 1 1 1 1 GLY N . 1 GLY N 1 1 14 1 2 1 1 8 GLU CG . 8 GLU CG 1 1 15 1 1 1 1 1 GLY N . 1 GLY N 1 1 15 1 2 1 1 8 GLU OE1 . 8 GLU OE1 1 1 16 1 1 1 1 2 GLY H . 2 GLY H 1 1 16 1 2 1 1 2 GLY HA2 . 2 GLY HA2 1 1 17 1 1 1 1 2 GLY H . 2 GLY H 1 1 17 1 2 1 1 2 GLY HA3 . 2 GLY HA3 1 1 18 1 1 1 1 2 GLY H . 2 GLY H 1 1 18 1 2 1 1 18 SER QB . 18 SER HB3 1 1 19 1 1 1 1 2 GLY H . 2 GLY H 1 1 19 1 2 1 1 19 PHE H . 19 PHE H 1 1 20 1 1 1 1 2 GLY HA2 . 2 GLY HA2 1 1 20 1 2 1 1 3 ALA H . 3 ALA H 1 1 21 1 1 1 1 2 GLY HA3 . 2 GLY HA3 1 1 21 1 2 1 1 3 ALA H . 3 ALA H 1 1 22 1 1 1 1 3 ALA H . 3 ALA H 1 1 22 1 2 1 1 3 ALA HA . 3 ALA HA 1 1 23 1 1 1 1 3 ALA HA . 3 ALA HA 1 1 23 1 2 1 1 4 GLY H . 4 GLY H 1 1 24 1 1 1 1 3 ALA MB . 3 ALA QB 1 1 24 1 2 1 1 4 GLY H . 4 GLY H 1 1 25 1 1 1 1 4 GLY H . 4 GLY H 1 1 25 1 2 1 1 4 GLY QA . 4 GLY HA2 1 1 26 1 1 1 1 4 GLY H . 4 GLY H 1 1 26 1 2 1 1 19 PHE QB . 19 PHE HB2 1 1 27 1 1 1 1 4 GLY QA . 4 GLY HA2 1 1 27 1 2 1 1 5 HIS H . 5 HIS H 1 1 28 1 1 1 1 4 GLY QA . 4 GLY HA3 1 1 28 1 2 1 1 19 PHE QB . 19 PHE HB2 1 1 29 1 1 1 1 5 HIS H . 5 HIS H 1 1 29 1 2 1 1 5 HIS HA . 5 HIS HA 1 1 30 1 1 1 1 5 HIS H . 5 HIS H 1 1 30 1 2 1 1 5 HIS HB2 . 5 HIS HB2 1 1 31 1 1 1 1 5 HIS H . 5 HIS H 1 1 31 1 2 1 1 5 HIS HB3 . 5 HIS HB3 1 1 32 1 1 1 1 5 HIS HA . 5 HIS HA 1 1 32 1 2 1 1 5 HIS HD2 . 5 HIS HD2 1 1 33 1 1 1 1 6 VAL H . 6 VAL H 1 1 33 1 2 1 1 6 VAL HB . 6 VAL HB 1 1 34 1 1 1 1 6 VAL H . 6 VAL H 1 1 34 1 2 1 1 19 PHE QB . 19 PHE HB2 1 1 35 1 1 1 1 6 VAL H . 6 VAL H 1 1 35 1 2 1 1 20 TYR H . 20 TYR H 1 1 36 1 1 1 1 6 VAL H . 6 VAL H 1 1 36 1 2 1 1 20 TYR QB . 20 TYR HB3 1 1 37 1 1 1 1 6 VAL HA . 6 VAL HA 1 1 37 1 2 1 1 7 PRO HD2 . 7 PRO HD2 1 1 38 1 1 1 1 6 VAL HA . 6 VAL HA 1 1 38 1 2 1 1 7 PRO HD3 . 7 PRO HD3 1 1 39 1 1 1 1 6 VAL HB . 6 VAL HB 1 1 39 1 2 1 1 20 TYR H . 20 TYR H 1 1 40 1 1 1 1 6 VAL QG . 6 VAL QG1 1 1 40 1 2 1 1 7 PRO QB . 7 PRO HB2 1 1 41 1 1 1 1 7 PRO HA . 7 PRO HA 1 1 41 1 2 1 1 8 GLU H . 8 GLU H 1 1 42 1 1 1 1 7 PRO HA . 7 PRO HA 1 1 42 1 2 1 1 19 PHE HA . 19 PHE HA 1 1 43 1 1 1 1 7 PRO HA . 7 PRO HA 1 1 43 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 44 1 1 1 1 7 PRO HA . 7 PRO HA 1 1 44 1 2 1 1 20 TYR H . 20 TYR H 1 1 45 1 1 1 1 7 PRO HG2 . 7 PRO HG2 1 1 45 1 2 1 1 10 PHE QE . 10 PHE QE 1 1 46 1 1 1 1 8 GLU H . 8 GLU H 1 1 46 1 2 1 1 8 GLU QB . 8 GLU HB2 1 1 47 1 1 1 1 8 GLU H . 8 GLU H 1 1 47 1 2 1 1 8 GLU QG . 8 GLU HG2 1 1 48 1 1 1 1 8 GLU H . 8 GLU H 1 1 48 1 2 1 1 9 TYR H . 9 TYR H 1 1 49 1 1 1 1 8 GLU H . 8 GLU H 1 1 49 1 2 1 1 19 PHE HA . 19 PHE HA 1 1 50 1 1 1 1 8 GLU HA . 8 GLU HA 1 1 50 1 2 1 1 8 GLU QB . 8 GLU HB2 1 1 51 1 1 1 1 8 GLU HA . 8 GLU HA 1 1 51 1 2 1 1 8 GLU QG . 8 GLU HG2 1 1 52 1 1 1 1 8 GLU HA . 8 GLU HA 1 1 52 1 2 1 1 9 TYR H . 9 TYR H 1 1 53 1 1 1 1 8 GLU HA . 8 GLU HA 1 1 53 1 2 1 1 20 TYR QD . 20 TYR QD 1 1 54 1 1 1 1 8 GLU HA . 8 GLU HA 1 1 54 1 2 1 1 20 TYR QE . 20 TYR QE 1 1 55 1 1 1 1 8 GLU QB . 8 GLU HB3 1 1 55 1 2 1 1 20 TYR QD . 20 TYR QD 1 1 56 1 1 1 1 8 GLU QG . 8 GLU HG2 1 1 56 1 2 1 1 19 PHE HA . 19 PHE HA 1 1 57 1 1 1 1 8 GLU QG . 8 GLU HG3 1 1 57 1 2 1 1 20 TYR QD . 20 TYR QD 1 1 58 1 1 1 1 9 TYR H . 9 TYR H 1 1 58 1 2 1 1 9 TYR HB2 . 9 TYR HB2 1 1 59 1 1 1 1 9 TYR H . 9 TYR H 1 1 59 1 2 1 1 9 TYR HB3 . 9 TYR HB3 1 1 60 1 1 1 1 9 TYR HA . 9 TYR HA 1 1 60 1 2 1 1 10 PHE H . 10 PHE H 1 1 61 1 1 1 1 9 TYR HB3 . 9 TYR HB3 1 1 61 1 2 1 1 10 PHE H . 10 PHE H 1 1 62 1 1 1 1 10 PHE H . 10 PHE H 1 1 62 1 2 1 1 10 PHE HA . 10 PHE HA 1 1 63 1 1 1 1 10 PHE H . 10 PHE H 1 1 63 1 2 1 1 10 PHE HB2 . 10 PHE HB2 1 1 64 1 1 1 1 10 PHE H . 10 PHE H 1 1 64 1 2 1 1 10 PHE HB3 . 10 PHE HB3 1 1 65 1 1 1 1 10 PHE HA . 10 PHE HA 1 1 65 1 2 1 1 11 VAL H . 11 VAL H 1 1 66 1 1 1 1 10 PHE HA . 10 PHE HA 1 1 66 1 2 1 1 16 PRO HA . 16 PRO HA 1 1 67 1 1 1 1 10 PHE HE2 . 10 PHE HE2 1 1 67 1 2 1 1 16 PRO HG3 . 16 PRO HG3 1 1 68 1 1 1 1 11 VAL H . 11 VAL H 1 1 68 1 2 1 1 11 VAL HB . 11 VAL HB 1 1 69 1 1 1 1 11 VAL HA . 11 VAL HA 1 1 69 1 2 1 1 12 ARG H . 12 ARG H 1 1 70 1 1 1 1 11 VAL HB . 11 VAL HB 1 1 70 1 2 1 1 12 ARG H . 12 ARG H 1 1 71 1 1 1 1 12 ARG H . 12 ARG H 1 1 71 1 2 1 1 12 ARG HA . 12 ARG HA 1 1 72 1 1 1 1 12 ARG H . 12 ARG H 1 1 72 1 2 1 1 12 ARG HB2 . 12 ARG HB2 1 1 73 1 1 1 1 12 ARG H . 12 ARG H 1 1 73 1 2 1 1 12 ARG HB3 . 12 ARG HB3 1 1 74 1 1 1 1 12 ARG H . 12 ARG H 1 1 74 1 2 1 1 12 ARG HG2 . 12 ARG HG2 1 1 75 1 1 1 1 12 ARG H . 12 ARG H 1 1 75 1 2 1 1 12 ARG HG3 . 12 ARG HG3 1 1 76 1 1 1 1 12 ARG HA . 12 ARG HA 1 1 76 1 2 1 1 12 ARG HB2 . 12 ARG HB2 1 1 77 1 1 1 1 12 ARG HA . 12 ARG HA 1 1 77 1 2 1 1 13 GLY H . 13 GLY H 1 1 78 1 1 1 1 13 GLY H . 13 GLY H 1 1 78 1 2 1 1 13 GLY HA2 . 13 GLY HA2 1 1 79 1 1 1 1 13 GLY HA2 . 13 GLY HA2 1 1 79 1 2 1 1 14 ASP H . 14 ASP H 1 1 80 1 1 1 1 13 GLY HA3 . 13 GLY HA3 1 1 80 1 2 1 1 14 ASP H . 14 ASP H 1 1 81 1 1 1 1 14 ASP H . 14 ASP H 1 1 81 1 2 1 1 14 ASP HA . 14 ASP HA 1 1 82 1 1 1 1 14 ASP H . 14 ASP H 1 1 82 1 2 1 1 14 ASP HB2 . 14 ASP HB2 1 1 83 1 1 1 1 14 ASP H . 14 ASP H 1 1 83 1 2 1 1 14 ASP HB3 . 14 ASP HB3 1 1 84 1 1 1 1 14 ASP HA . 14 ASP HA 1 1 84 1 2 1 1 14 ASP HB2 . 14 ASP HB2 1 1 85 1 1 1 1 14 ASP HA . 14 ASP HA 1 1 85 1 2 1 1 15 PHE H . 15 PHE H 1 1 86 1 1 1 1 14 ASP HB2 . 14 ASP HB2 1 1 86 1 2 1 1 15 PHE H . 15 PHE H 1 1 87 1 1 1 1 14 ASP HB3 . 14 ASP HB3 1 1 87 1 2 1 1 15 PHE H . 15 PHE H 1 1 88 1 1 1 1 15 PHE H . 15 PHE H 1 1 88 1 2 1 1 15 PHE HA . 15 PHE HA 1 1 89 1 1 1 1 15 PHE H . 15 PHE H 1 1 89 1 2 1 1 15 PHE HB2 . 15 PHE HB2 1 1 90 1 1 1 1 15 PHE H . 15 PHE H 1 1 90 1 2 1 1 15 PHE HB3 . 15 PHE HB3 1 1 91 1 1 1 1 15 PHE HA . 15 PHE HA 1 1 91 1 2 1 1 16 PRO HD2 . 16 PRO HD2 1 1 92 1 1 1 1 15 PHE HA . 15 PHE HA 1 1 92 1 2 1 1 16 PRO HD3 . 16 PRO HD3 1 1 93 1 1 1 1 16 PRO HA . 16 PRO HA 1 1 93 1 2 1 1 17 ILE H . 17 ILE H 1 1 94 1 1 1 1 16 PRO HB2 . 16 PRO HB2 1 1 94 1 2 1 1 17 ILE H . 17 ILE H 1 1 95 1 1 1 1 16 PRO HG2 . 16 PRO HG2 1 1 95 1 2 1 1 17 ILE H . 17 ILE H 1 1 96 1 1 1 1 17 ILE H . 17 ILE H 1 1 96 1 2 1 1 17 ILE HB . 17 ILE HB 1 1 97 1 1 1 1 17 ILE H . 17 ILE H 1 1 97 1 2 1 1 18 SER H . 18 SER H 1 1 98 1 1 1 1 18 SER H . 18 SER H 1 1 98 1 2 1 1 18 SER HA . 18 SER HA 1 1 99 1 1 1 1 18 SER H . 18 SER H 1 1 99 1 2 1 1 18 SER QB . 18 SER HB2 1 1 100 1 1 1 1 18 SER HA . 18 SER HA 1 1 100 1 2 1 1 18 SER QB . 18 SER HB2 1 1 101 1 1 1 1 18 SER HA . 18 SER HA 1 1 101 1 2 1 1 19 PHE H . 19 PHE H 1 1 102 1 1 1 1 18 SER HA . 18 SER HA 1 1 102 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 103 1 1 1 1 18 SER QB . 18 SER HB2 1 1 103 1 2 1 1 19 PHE H . 19 PHE H 1 1 104 1 1 1 1 19 PHE H . 19 PHE H 1 1 104 1 2 1 1 19 PHE QB . 19 PHE HB2 1 1 105 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 105 1 2 1 1 19 PHE QB . 19 PHE HB2 1 1 106 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 106 1 2 1 1 20 TYR H . 20 TYR H 1 1 107 1 1 1 1 19 PHE QB . 19 PHE HB2 1 1 107 1 2 1 1 20 TYR H . 20 TYR H 1 1 108 1 1 1 1 20 TYR H . 20 TYR H 1 1 108 1 2 1 1 20 TYR HA . 20 TYR HA 1 1 109 1 1 1 1 20 TYR H . 20 TYR H 1 1 109 1 2 1 1 20 TYR QB . 20 TYR HB2 1 1 110 1 1 1 1 20 TYR H . 20 TYR H 1 1 110 1 2 1 1 20 TYR QD . 20 TYR QD 1 1 111 1 1 1 1 20 TYR HA . 20 TYR HA 1 1 111 1 2 1 1 20 TYR QB . 20 TYR HB2 1 1 112 1 1 1 1 20 TYR HA . 20 TYR HA 1 1 112 1 2 1 1 21 GLY H . 21 GLY H 1 1 113 1 1 1 1 20 TYR QB . 20 TYR HB2 1 1 113 1 2 1 1 21 GLY H . 21 GLY H 1 1 114 1 1 1 1 21 GLY H . 21 GLY H 1 1 114 1 2 1 1 21 GLY HA3 . 21 GLY HA3 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.09 1 1 2 1 . . . . . . . 2.42 1 1 3 1 . . . . . . . 2.78 1 1 4 1 . . . . . . . 2.68 1 1 5 1 . . . . . . . 2.99 1 1 6 1 . . . . . . . 2.83 1 1 7 1 . . . . . . . 2.06 1 1 8 1 . . . . . . . 3.52 1 1 9 1 . . . . . . . 2.8 1 1 10 1 . . . . . . . 3.17 1 1 11 1 . . . . . . . 3.7 1 1 12 1 . . . . . . . 3.83 1 1 13 1 . . . . . . . 1.33 1 1 14 1 . . . . . . . 2.41 1 1 15 1 . . . . . . . 2.26 1 1 16 1 . . . . . . . 2.86 1 1 17 1 . . . . . . . 2.9 1 1 18 1 . . . . . . . 3.64 1 1 19 1 . . . . . . . 2.71 1 1 20 1 . . . . . . . 3.2 1 1 21 1 . . . . . . . 2.53 1 1 22 1 . . . . . . . 3.08 1 1 23 1 . . . . . . . 2.43 1 1 24 1 . . . . . . . 4.41 1 1 25 1 . . . . . . . 2.74 1 1 26 1 . . . . . . . 2.86 1 1 27 1 . . . . . . . 2.4 1 1 28 1 . . . . . . . 2.77 1 1 29 1 . . . . . . . 2.8 1 1 30 1 . . . . . . . 2.55 1 1 31 1 . . . . . . . 3.21 1 1 32 1 . . . . . . . 4.88 1 1 33 1 . . . . . . . 2.68 1 1 34 1 . . . . . . . 2.83 1 1 35 1 . . . . . . . 2.68 1 1 36 1 . . . . . . . 4.42 1 1 37 1 . . . . . . . 2.62 1 1 38 1 . . . . . . . 2.4 1 1 39 1 . . . . . . . 4.32 1 1 40 1 . . . . . . . 3.51 1 1 41 1 . . . . . . . 2.4 1 1 42 1 . . . . . . . 2.43 1 1 43 1 . . . . . . . 4.3 1 1 44 1 . . . . . . . 4.3 1 1 45 1 . . . . . . . 3.51 1 1 46 1 . . . . . . . 2.83 1 1 47 1 . . . . . . . 2.93 1 1 48 1 . . . . . . . 3.0 1 1 49 1 . . . . . . . 2.49 1 1 50 1 . . . . . . . 2.59 1 1 51 1 . . . . . . . 2.65 1 1 52 1 . . . . . . . 2.77 1 1 53 1 . . . . . . . 3.92 1 1 54 1 . . . . . . . 4.3 1 1 55 1 . . . . . . . 3.86 1 1 56 1 . . . . . . . 3.08 1 1 57 1 . . . . . . . 3.99 1 1 58 1 . . . . . . . 3.6 1 1 59 1 . . . . . . . 3.2 1 1 60 1 . . . . . . . 2.4 1 1 61 1 . . . . . . . 3.45 1 1 62 1 . . . . . . . 2.99 1 1 63 1 . . . . . . . 3.0 1 1 64 1 . . . . . . . 3.8 1 1 65 1 . . . . . . . 2.4 1 1 66 1 . . . . . . . 3.2 1 1 67 1 . . . . . . . 3.5 1 1 68 1 . . . . . . . 3.32 1 1 69 1 . . . . . . . 2.6 1 1 70 1 . . . . . . . 3.2 1 1 71 1 . . . . . . . 2.8 1 1 72 1 . . . . . . . 2.96 1 1 73 1 . . . . . . . 3.21 1 1 74 1 . . . . . . . 4.63 1 1 75 1 . . . . . . . 3.92 1 1 76 1 . . . . . . . 3.02 1 1 77 1 . . . . . . . 2.4 1 1 78 1 . . . . . . . 3.0 1 1 79 1 . . . . . . . 2.99 1 1 80 1 . . . . . . . 2.59 1 1 81 1 . . . . . . . 2.93 1 1 82 1 . . . . . . . 3.8 1 1 83 1 . . . . . . . 3.0 1 1 84 1 . . . . . . . 2.55 1 1 85 1 . . . . . . . 3.0 1 1 86 1 . . . . . . . 3.33 1 1 87 1 . . . . . . . 3.6 1 1 88 1 . . . . . . . 3.05 1 1 89 1 . . . . . . . 2.52 1 1 90 1 . . . . . . . 3.21 1 1 91 1 . . . . . . . 2.46 1 1 92 1 . . . . . . . 2.4 1 1 93 1 . . . . . . . 2.4 1 1 94 1 . . . . . . . 3.79 1 1 95 1 . . . . . . . 4.44 1 1 96 1 . . . . . . . 2.83 1 1 97 1 . . . . . . . 2.62 1 1 98 1 . . . . . . . 2.4 1 1 99 1 . . . . . . . 2.83 1 1 100 1 . . . . . . . 2.49 1 1 101 1 . . . . . . . 2.43 1 1 102 1 . . . . . . . 3.58 1 1 103 1 . . . . . . . 2.43 1 1 104 1 . . . . . . . 2.77 1 1 105 1 . . . . . . . 2.4 1 1 106 1 . . . . . . . 2.4 1 1 107 1 . . . . . . . 2.49 1 1 108 1 . . . . . . . 2.8 1 1 109 1 . . . . . . . 3.17 1 1 110 1 . . . . . . . 3.74 1 1 111 1 . . . . . . . 2.8 1 1 112 1 . . . . . . . 2.4 1 1 113 1 . . . . . . . 2.68 1 1 114 1 . . . . . . . 2.8 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 GLY C C 3.584 -1.167 -0.771 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 2.780 0.105 -0.656 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 1.220 -0.526 0.638 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H 2.090 0.188 -1.510 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H 3.479 0.954 -0.721 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N 1.995 0.108 0.578 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O 3.524 -1.818 -1.802 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 GLY C C 4.332 -3.989 0.362 1.00 . A A . 2 GLY C 1 1 1 9 1 1 2 GLY CA C 5.169 -2.742 0.217 1.00 . A A . 2 GLY CA 1 1 1 10 1 1 2 GLY H H 4.370 -0.985 1.122 1.00 . A A . 2 GLY H 1 1 1 11 1 1 2 GLY HA2 H 5.713 -2.787 -0.740 1.00 . A A . 2 GLY HA2 1 1 1 12 1 1 2 GLY HA3 H 5.916 -2.721 1.024 1.00 . A A . 2 GLY HA3 1 1 1 13 1 1 2 GLY N N 4.355 -1.529 0.280 1.00 . A A . 2 GLY N 1 1 1 14 1 1 2 GLY O O 3.132 -3.917 0.145 1.00 . A A . 2 GLY O 1 1 1 15 1 1 3 ALA C C 4.241 -6.806 2.345 1.00 . A A . 3 ALA C 1 1 1 16 1 1 3 ALA CA C 4.223 -6.391 0.890 1.00 . A A . 3 ALA CA 1 1 1 17 1 1 3 ALA CB C 4.860 -7.469 -0.027 1.00 . A A . 3 ALA CB 1 1 1 18 1 1 3 ALA H H 5.947 -5.157 0.891 1.00 . A A . 3 ALA H 1 1 1 19 1 1 3 ALA HA H 3.166 -6.293 0.597 1.00 . A A . 3 ALA HA 1 1 1 20 1 1 3 ALA HB1 H 4.852 -7.120 -1.071 1.00 . A A . 3 ALA HB1 1 1 1 21 1 1 3 ALA HB2 H 5.902 -7.658 0.272 1.00 . A A . 3 ALA HB2 1 1 1 22 1 1 3 ALA HB3 H 4.298 -8.415 0.033 1.00 . A A . 3 ALA HB3 1 1 1 23 1 1 3 ALA N N 4.960 -5.137 0.720 1.00 . A A . 3 ALA N 1 1 1 24 1 1 3 ALA O O 4.404 -7.981 2.633 1.00 . A A . 3 ALA O 1 1 1 25 1 1 4 GLY C C 2.786 -6.743 5.203 1.00 . A A . 4 GLY C 1 1 1 26 1 1 4 GLY CA C 4.101 -6.172 4.706 1.00 . A A . 4 GLY CA 1 1 1 27 1 1 4 GLY H H 3.940 -4.885 3.021 1.00 . A A . 4 GLY H 1 1 1 28 1 1 4 GLY HA2 H 4.890 -6.912 4.911 1.00 . A A . 4 GLY HA2 1 1 1 29 1 1 4 GLY HA3 H 4.367 -5.262 5.268 1.00 . A A . 4 GLY HA3 1 1 1 30 1 1 4 GLY N N 4.077 -5.843 3.282 1.00 . A A . 4 GLY N 1 1 1 31 1 1 4 GLY O O 2.138 -7.455 4.452 1.00 . A A . 4 GLY O 1 1 1 32 1 1 5 HIS C C 0.193 -6.037 7.431 1.00 . A A . 5 HIS C 1 1 1 33 1 1 5 HIS CA C 1.274 -7.074 7.142 1.00 . A A . 5 HIS CA 1 1 1 34 1 1 5 HIS CB C 1.710 -7.750 8.442 1.00 . A A . 5 HIS CB 1 1 1 35 1 1 5 HIS CD2 C 3.506 -9.348 7.469 1.00 . A A . 5 HIS CD2 1 1 1 36 1 1 5 HIS CE1 C 2.869 -11.192 8.468 1.00 . A A . 5 HIS CE1 1 1 1 37 1 1 5 HIS CG C 2.429 -9.046 8.231 1.00 . A A . 5 HIS CG 1 1 1 38 1 1 5 HIS H H 3.020 -5.885 7.001 1.00 . A A . 5 HIS H 1 1 1 39 1 1 5 HIS HA H 0.869 -7.821 6.476 1.00 . A A . 5 HIS HA 1 1 1 40 1 1 5 HIS HB2 H 2.372 -7.087 8.979 1.00 . A A . 5 HIS HB2 1 1 1 41 1 1 5 HIS HB3 H 0.837 -7.948 9.048 1.00 . A A . 5 HIS HB3 1 1 1 42 1 1 5 HIS HD1 H 1.302 -10.332 9.462 1.00 . A A . 5 HIS HD1 1 1 1 43 1 1 5 HIS HD2 H 4.064 -8.662 6.846 1.00 . A A . 5 HIS HD2 1 1 1 44 1 1 5 HIS HE1 H 2.818 -12.222 8.788 1.00 . A A . 5 HIS HE1 1 1 1 45 1 1 5 HIS N N 2.420 -6.459 6.481 1.00 . A A . 5 HIS N 1 1 1 46 1 1 5 HIS ND1 N 2.053 -10.224 8.843 1.00 . A A . 5 HIS ND1 1 1 1 47 1 1 5 HIS NE2 N 3.760 -10.687 7.634 1.00 . A A . 5 HIS NE2 1 1 1 48 1 1 5 HIS O O -0.973 -6.379 7.629 1.00 . A A . 5 HIS O 1 1 1 49 1 1 6 VAL C C -0.773 -2.862 6.742 1.00 . A A . 6 VAL C 1 1 1 50 1 1 6 VAL CA C -0.446 -3.705 7.956 1.00 . A A . 6 VAL CA 1 1 1 51 1 1 6 VAL CB C 0.200 -2.841 9.083 1.00 . A A . 6 VAL CB 1 1 1 52 1 1 6 VAL CG1 C -0.751 -1.726 9.599 1.00 . A A . 6 VAL CG1 1 1 1 53 1 1 6 VAL CG2 C 0.652 -3.745 10.265 1.00 . A A . 6 VAL CG2 1 1 1 54 1 1 6 VAL H H 1.433 -4.369 7.317 1.00 . A A . 6 VAL H 1 1 1 55 1 1 6 VAL HA H -1.343 -4.171 8.385 1.00 . A A . 6 VAL HA 1 1 1 56 1 1 6 VAL HB H 1.097 -2.344 8.676 1.00 . A A . 6 VAL HB 1 1 1 57 1 1 6 VAL HG11 H -0.227 -1.089 10.329 1.00 . A A . 6 VAL HG11 1 1 1 58 1 1 6 VAL HG12 H -1.092 -1.086 8.772 1.00 . A A . 6 VAL HG12 1 1 1 59 1 1 6 VAL HG13 H -1.626 -2.167 10.099 1.00 . A A . 6 VAL HG13 1 1 1 60 1 1 6 VAL HG21 H 1.387 -4.494 9.934 1.00 . A A . 6 VAL HG21 1 1 1 61 1 1 6 VAL HG22 H 1.119 -3.137 11.056 1.00 . A A . 6 VAL HG22 1 1 1 62 1 1 6 VAL HG23 H -0.213 -4.272 10.695 1.00 . A A . 6 VAL HG23 1 1 1 63 1 1 6 VAL N N 0.522 -4.719 7.522 1.00 . A A . 6 VAL N 1 1 1 64 1 1 6 VAL O O 0.177 -2.535 6.048 1.00 . A A . 6 VAL O 1 1 1 65 1 1 7 PRO C C -1.693 -0.369 5.177 1.00 . A A . 7 PRO C 1 1 1 66 1 1 7 PRO CA C -2.255 -1.770 5.156 1.00 . A A . 7 PRO CA 1 1 1 67 1 1 7 PRO CB C -3.795 -1.804 5.067 1.00 . A A . 7 PRO CB 1 1 1 68 1 1 7 PRO CD C -3.209 -2.823 7.192 1.00 . A A . 7 PRO CD 1 1 1 69 1 1 7 PRO CG C -4.231 -1.859 6.546 1.00 . A A . 7 PRO CG 1 1 1 70 1 1 7 PRO HA H -1.857 -2.343 4.313 1.00 . A A . 7 PRO HA 1 1 1 71 1 1 7 PRO HB2 H -4.226 -0.959 4.505 1.00 . A A . 7 PRO HB2 1 1 1 72 1 1 7 PRO HB3 H -4.086 -2.751 4.584 1.00 . A A . 7 PRO HB3 1 1 1 73 1 1 7 PRO HD2 H -3.130 -2.626 8.270 1.00 . A A . 7 PRO HD2 1 1 1 74 1 1 7 PRO HD3 H -3.485 -3.875 7.014 1.00 . A A . 7 PRO HD3 1 1 1 75 1 1 7 PRO HG2 H -4.109 -0.854 6.980 1.00 . A A . 7 PRO HG2 1 1 1 76 1 1 7 PRO HG3 H -5.272 -2.192 6.683 1.00 . A A . 7 PRO HG3 1 1 1 77 1 1 7 PRO N N -2.033 -2.484 6.404 1.00 . A A . 7 PRO N 1 1 1 78 1 1 7 PRO O O -1.611 0.217 6.244 1.00 . A A . 7 PRO O 1 1 1 79 1 1 8 GLU C C -1.930 2.511 3.839 1.00 . A A . 8 GLU C 1 1 1 80 1 1 8 GLU CA C -0.781 1.532 3.917 1.00 . A A . 8 GLU CA 1 1 1 81 1 1 8 GLU CB C 0.143 1.699 2.676 1.00 . A A . 8 GLU CB 1 1 1 82 1 1 8 GLU CD C 2.311 0.924 1.611 1.00 . A A . 8 GLU CD 1 1 1 83 1 1 8 GLU CG C 1.451 0.883 2.852 1.00 . A A . 8 GLU CG 1 1 1 84 1 1 8 GLU H H -1.398 -0.353 3.143 1.00 . A A . 8 GLU H 1 1 1 85 1 1 8 GLU HA H -0.186 1.762 4.818 1.00 . A A . 8 GLU HA 1 1 1 86 1 1 8 GLU HB2 H -0.381 1.371 1.764 1.00 . A A . 8 GLU HB2 1 1 1 87 1 1 8 GLU HB3 H 0.406 2.762 2.552 1.00 . A A . 8 GLU HB3 1 1 1 88 1 1 8 GLU HG2 H 2.032 1.297 3.690 1.00 . A A . 8 GLU HG2 1 1 1 89 1 1 8 GLU HG3 H 1.200 -0.159 3.098 1.00 . A A . 8 GLU HG3 1 1 1 90 1 1 8 GLU N N -1.302 0.166 3.995 1.00 . A A . 8 GLU N 1 1 1 91 1 1 8 GLU O O -1.869 3.540 4.495 1.00 . A A . 8 GLU O 1 1 1 92 1 1 8 GLU OE1 O 3.257 1.696 1.590 1.00 . A A . 8 GLU OE1 1 1 1 93 1 1 9 TYR C C -5.389 2.351 2.773 1.00 . A A . 9 TYR C 1 1 1 94 1 1 9 TYR CA C -4.103 3.135 2.886 1.00 . A A . 9 TYR CA 1 1 1 95 1 1 9 TYR CB C -3.843 4.006 1.629 1.00 . A A . 9 TYR CB 1 1 1 96 1 1 9 TYR CD1 C -4.416 2.388 -0.256 1.00 . A A . 9 TYR CD1 1 1 1 97 1 1 9 TYR CD2 C -2.101 2.994 0.071 1.00 . A A . 9 TYR CD2 1 1 1 98 1 1 9 TYR CE1 C -4.044 1.521 -1.289 1.00 . A A . 9 TYR CE1 1 1 1 99 1 1 9 TYR CE2 C -1.731 2.137 -0.968 1.00 . A A . 9 TYR CE2 1 1 1 100 1 1 9 TYR CG C -3.445 3.108 0.449 1.00 . A A . 9 TYR CG 1 1 1 101 1 1 9 TYR CZ C -2.696 1.387 -1.645 1.00 . A A . 9 TYR CZ 1 1 1 102 1 1 9 TYR H H -3.001 1.364 2.505 1.00 . A A . 9 TYR H 1 1 1 103 1 1 9 TYR HA H -4.218 3.783 3.771 1.00 . A A . 9 TYR HA 1 1 1 104 1 1 9 TYR HB2 H -4.728 4.601 1.355 1.00 . A A . 9 TYR HB2 1 1 1 105 1 1 9 TYR HB3 H -3.030 4.714 1.857 1.00 . A A . 9 TYR HB3 1 1 1 106 1 1 9 TYR HD1 H -5.465 2.496 -0.002 1.00 . A A . 9 TYR HD1 1 1 1 107 1 1 9 TYR HD2 H -1.336 3.567 0.585 1.00 . A A . 9 TYR HD2 1 1 1 108 1 1 9 TYR HE1 H -4.811 0.955 -1.809 1.00 . A A . 9 TYR HE1 1 1 1 109 1 1 9 TYR HE2 H -0.686 2.051 -1.251 1.00 . A A . 9 TYR HE2 1 1 1 110 1 1 9 TYR HH H -3.006 0.067 -3.100 1.00 . A A . 9 TYR HH 1 1 1 111 1 1 9 TYR N N -2.981 2.209 3.043 1.00 . A A . 9 TYR N 1 1 1 112 1 1 9 TYR O O -5.312 1.134 2.709 1.00 . A A . 9 TYR O 1 1 1 113 1 1 9 TYR OH O -2.292 0.516 -2.663 1.00 . A A . 9 TYR OH 1 1 1 114 1 1 10 PHE C C -8.722 2.952 1.637 1.00 . A A . 10 PHE C 1 1 1 115 1 1 10 PHE CA C -7.844 2.328 2.699 1.00 . A A . 10 PHE CA 1 1 1 116 1 1 10 PHE CB C -8.573 2.461 4.058 1.00 . A A . 10 PHE CB 1 1 1 117 1 1 10 PHE CD1 C -6.735 2.669 5.807 1.00 . A A . 10 PHE CD1 1 1 1 118 1 1 10 PHE CD2 C -7.907 0.564 5.619 1.00 . A A . 10 PHE CD2 1 1 1 119 1 1 10 PHE CE1 C -6.013 2.172 6.895 1.00 . A A . 10 PHE CE1 1 1 1 120 1 1 10 PHE CE2 C -7.214 0.079 6.732 1.00 . A A . 10 PHE CE2 1 1 1 121 1 1 10 PHE CG C -7.713 1.880 5.188 1.00 . A A . 10 PHE CG 1 1 1 122 1 1 10 PHE CZ C -6.279 0.889 7.381 1.00 . A A . 10 PHE CZ 1 1 1 123 1 1 10 PHE H H -6.590 4.029 2.822 1.00 . A A . 10 PHE H 1 1 1 124 1 1 10 PHE HA H -7.702 1.255 2.496 1.00 . A A . 10 PHE HA 1 1 1 125 1 1 10 PHE HB2 H -8.774 3.522 4.272 1.00 . A A . 10 PHE HB2 1 1 1 126 1 1 10 PHE HB3 H -9.546 1.943 4.013 1.00 . A A . 10 PHE HB3 1 1 1 127 1 1 10 PHE HD1 H -6.535 3.673 5.448 1.00 . A A . 10 PHE HD1 1 1 1 128 1 1 10 PHE HD2 H -8.599 -0.087 5.095 1.00 . A A . 10 PHE HD2 1 1 1 129 1 1 10 PHE HE1 H -5.248 2.783 7.364 1.00 . A A . 10 PHE HE1 1 1 1 130 1 1 10 PHE HE2 H -7.407 -0.926 7.093 1.00 . A A . 10 PHE HE2 1 1 1 131 1 1 10 PHE HZ H -5.760 0.525 8.263 1.00 . A A . 10 PHE HZ 1 1 1 132 1 1 10 PHE N N -6.563 3.030 2.757 1.00 . A A . 10 PHE N 1 1 1 133 1 1 10 PHE O O -8.747 4.172 1.583 1.00 . A A . 10 PHE O 1 1 1 134 1 1 11 VAL C C -11.813 2.537 0.297 1.00 . A A . 11 VAL C 1 1 1 135 1 1 11 VAL CA C -10.370 2.686 -0.171 1.00 . A A . 11 VAL CA 1 1 1 136 1 1 11 VAL CB C -10.209 1.990 -1.536 1.00 . A A . 11 VAL CB 1 1 1 137 1 1 11 VAL CG1 C -11.051 2.688 -2.593 1.00 . A A . 11 VAL CG1 1 1 1 138 1 1 11 VAL CG2 C -8.745 1.954 -1.946 1.00 . A A . 11 VAL CG2 1 1 1 139 1 1 11 VAL H H -9.342 1.175 0.896 1.00 . A A . 11 VAL H 1 1 1 140 1 1 11 VAL HA H -10.149 3.736 -0.298 1.00 . A A . 11 VAL HA 1 1 1 141 1 1 11 VAL HB H -10.561 0.973 -1.441 1.00 . A A . 11 VAL HB 1 1 1 142 1 1 11 VAL HG11 H -10.655 2.463 -3.573 1.00 . A A . 11 VAL HG11 1 1 1 143 1 1 11 VAL HG12 H -12.072 2.341 -2.528 1.00 . A A . 11 VAL HG12 1 1 1 144 1 1 11 VAL HG13 H -11.021 3.755 -2.430 1.00 . A A . 11 VAL HG13 1 1 1 145 1 1 11 VAL HG21 H -8.192 1.340 -1.250 1.00 . A A . 11 VAL HG21 1 1 1 146 1 1 11 VAL HG22 H -8.659 1.537 -2.939 1.00 . A A . 11 VAL HG22 1 1 1 147 1 1 11 VAL HG23 H -8.344 2.956 -1.940 1.00 . A A . 11 VAL HG23 1 1 1 148 1 1 11 VAL N N -9.439 2.147 0.813 1.00 . A A . 11 VAL N 1 1 1 149 1 1 11 VAL O O -12.099 1.786 1.229 1.00 . A A . 11 VAL O 1 1 1 150 1 1 12 ARG C C -14.778 1.929 -0.537 1.00 . A A . 12 ARG C 1 1 1 151 1 1 12 ARG CA C -14.133 3.206 -0.007 1.00 . A A . 12 ARG CA 1 1 1 152 1 1 12 ARG CB C -14.863 4.429 -0.566 1.00 . A A . 12 ARG CB 1 1 1 153 1 1 12 ARG CD C -14.831 6.906 -0.991 1.00 . A A . 12 ARG CD 1 1 1 154 1 1 12 ARG CG C -14.159 5.744 -0.276 1.00 . A A . 12 ARG CG 1 1 1 155 1 1 12 ARG CZ C -16.443 7.822 0.623 1.00 . A A . 12 ARG CZ 1 1 1 156 1 1 12 ARG H H -12.429 3.839 -1.091 1.00 . A A . 12 ARG H 1 1 1 157 1 1 12 ARG HA H -14.209 3.214 1.070 1.00 . A A . 12 ARG HA 1 1 1 158 1 1 12 ARG HB2 H -14.952 4.322 -1.637 1.00 . A A . 12 ARG HB2 1 1 1 159 1 1 12 ARG HB3 H -15.851 4.472 -0.133 1.00 . A A . 12 ARG HB3 1 1 1 160 1 1 12 ARG HD2 H -14.238 7.795 -0.842 1.00 . A A . 12 ARG HD2 1 1 1 161 1 1 12 ARG HD3 H -14.882 6.680 -2.046 1.00 . A A . 12 ARG HD3 1 1 1 162 1 1 12 ARG HE H -16.930 6.790 -1.013 1.00 . A A . 12 ARG HE 1 1 1 163 1 1 12 ARG HG2 H -14.183 5.929 0.788 1.00 . A A . 12 ARG HG2 1 1 1 164 1 1 12 ARG HG3 H -13.134 5.673 -0.607 1.00 . A A . 12 ARG HG3 1 1 1 165 1 1 12 ARG HH11 H -14.504 8.186 1.058 1.00 . A A . 12 ARG HH11 1 1 1 166 1 1 12 ARG HH12 H -15.651 8.826 2.188 1.00 . A A . 12 ARG HH12 1 1 1 167 1 1 12 ARG HH21 H -18.449 7.629 0.467 1.00 . A A . 12 ARG HH21 1 1 1 168 1 1 12 ARG HH22 H -17.895 8.508 1.851 1.00 . A A . 12 ARG HH22 1 1 1 169 1 1 12 ARG N N -12.718 3.258 -0.356 1.00 . A A . 12 ARG N 1 1 1 170 1 1 12 ARG NE N -16.182 7.148 -0.492 1.00 . A A . 12 ARG NE 1 1 1 171 1 1 12 ARG NH1 N -15.451 8.318 1.349 1.00 . A A . 12 ARG NH1 1 1 1 172 1 1 12 ARG NH2 N -17.699 8.001 1.012 1.00 . A A . 12 ARG NH2 1 1 1 173 1 1 12 ARG O O -15.969 1.904 -0.843 1.00 . A A . 12 ARG O 1 1 1 174 1 1 13 GLY C C -14.710 -1.405 -0.027 1.00 . A A . 13 GLY C 1 1 1 175 1 1 13 GLY CA C -14.491 -0.396 -1.137 1.00 . A A . 13 GLY CA 1 1 1 176 1 1 13 GLY H H -13.039 0.948 -0.384 1.00 . A A . 13 GLY H 1 1 1 177 1 1 13 GLY HA2 H -15.430 -0.221 -1.641 1.00 . A A . 13 GLY HA2 1 1 1 178 1 1 13 GLY HA3 H -13.785 -0.804 -1.845 1.00 . A A . 13 GLY HA3 1 1 1 179 1 1 13 GLY N N -13.981 0.870 -0.643 1.00 . A A . 13 GLY N 1 1 1 180 1 1 13 GLY O O -15.549 -1.201 0.850 1.00 . A A . 13 GLY O 1 1 1 181 1 1 14 ASP C C -12.777 -3.675 1.740 1.00 . A A . 14 ASP C 1 1 1 182 1 1 14 ASP CA C -14.071 -3.544 0.943 1.00 . A A . 14 ASP CA 1 1 1 183 1 1 14 ASP CB C -14.418 -4.881 0.285 1.00 . A A . 14 ASP CB 1 1 1 184 1 1 14 ASP CG C -14.490 -6.017 1.287 1.00 . A A . 14 ASP CG 1 1 1 185 1 1 14 ASP H H -13.304 -2.603 -0.792 1.00 . A A . 14 ASP H 1 1 1 186 1 1 14 ASP HA H -14.868 -3.268 1.617 1.00 . A A . 14 ASP HA 1 1 1 187 1 1 14 ASP HB2 H -15.377 -4.796 -0.205 1.00 . A A . 14 ASP HB2 1 1 1 188 1 1 14 ASP HB3 H -13.663 -5.120 -0.449 1.00 . A A . 14 ASP HB3 1 1 1 189 1 1 14 ASP N N -13.955 -2.498 -0.067 1.00 . A A . 14 ASP N 1 1 1 190 1 1 14 ASP O O -12.692 -3.227 2.883 1.00 . A A . 14 ASP O 1 1 1 191 1 1 14 ASP OD1 O -14.755 -5.743 2.476 1.00 . A A . 14 ASP OD1 1 1 1 192 1 1 14 ASP OD2 O -14.284 -7.179 0.881 1.00 . A A . 14 ASP OD2 1 1 1 193 1 1 15 PHE C C -9.377 -3.747 1.033 1.00 . A A . 15 PHE C 1 1 1 194 1 1 15 PHE CA C -10.482 -4.486 1.782 1.00 . A A . 15 PHE CA 1 1 1 195 1 1 15 PHE CB C -10.147 -5.977 1.867 1.00 . A A . 15 PHE CB 1 1 1 196 1 1 15 PHE CD1 C -10.786 -6.279 4.275 1.00 . A A . 15 PHE CD1 1 1 1 197 1 1 15 PHE CD2 C -11.687 -7.790 2.665 1.00 . A A . 15 PHE CD2 1 1 1 198 1 1 15 PHE CE1 C -11.467 -6.939 5.280 1.00 . A A . 15 PHE CE1 1 1 1 199 1 1 15 PHE CE2 C -12.370 -8.454 3.666 1.00 . A A . 15 PHE CE2 1 1 1 200 1 1 15 PHE CG C -10.888 -6.696 2.957 1.00 . A A . 15 PHE CG 1 1 1 201 1 1 15 PHE CZ C -12.259 -8.028 4.976 1.00 . A A . 15 PHE CZ 1 1 1 202 1 1 15 PHE H H -11.901 -4.629 0.217 1.00 . A A . 15 PHE H 1 1 1 203 1 1 15 PHE HA H -10.555 -4.084 2.781 1.00 . A A . 15 PHE HA 1 1 1 204 1 1 15 PHE HB2 H -10.398 -6.449 0.929 1.00 . A A . 15 PHE HB2 1 1 1 205 1 1 15 PHE HB3 H -9.090 -6.090 2.052 1.00 . A A . 15 PHE HB3 1 1 1 206 1 1 15 PHE HD1 H -10.166 -5.427 4.514 1.00 . A A . 15 PHE HD1 1 1 1 207 1 1 15 PHE HD2 H -11.774 -8.125 1.642 1.00 . A A . 15 PHE HD2 1 1 1 208 1 1 15 PHE HE1 H -11.378 -6.604 6.303 1.00 . A A . 15 PHE HE1 1 1 1 209 1 1 15 PHE HE2 H -12.989 -9.305 3.426 1.00 . A A . 15 PHE HE2 1 1 1 210 1 1 15 PHE HZ H -12.793 -8.545 5.760 1.00 . A A . 15 PHE HZ 1 1 1 211 1 1 15 PHE N N -11.772 -4.294 1.129 1.00 . A A . 15 PHE N 1 1 1 212 1 1 15 PHE O O -9.518 -3.388 -0.136 1.00 . A A . 15 PHE O 1 1 1 213 1 1 16 PRO C C -6.349 -3.621 0.156 1.00 . A A . 16 PRO C 1 1 1 214 1 1 16 PRO CA C -7.177 -2.663 0.978 1.00 . A A . 16 PRO CA 1 1 1 215 1 1 16 PRO CB C -6.397 -2.063 2.174 1.00 . A A . 16 PRO CB 1 1 1 216 1 1 16 PRO CD C -8.044 -3.574 3.119 1.00 . A A . 16 PRO CD 1 1 1 217 1 1 16 PRO CG C -6.580 -3.118 3.285 1.00 . A A . 16 PRO CG 1 1 1 218 1 1 16 PRO HA H -7.568 -1.860 0.331 1.00 . A A . 16 PRO HA 1 1 1 219 1 1 16 PRO HB2 H -5.339 -1.843 1.956 1.00 . A A . 16 PRO HB2 1 1 1 220 1 1 16 PRO HB3 H -6.891 -1.134 2.501 1.00 . A A . 16 PRO HB3 1 1 1 221 1 1 16 PRO HD2 H -8.149 -4.601 3.492 1.00 . A A . 16 PRO HD2 1 1 1 222 1 1 16 PRO HD3 H -8.707 -2.893 3.677 1.00 . A A . 16 PRO HD3 1 1 1 223 1 1 16 PRO HG2 H -5.897 -3.964 3.094 1.00 . A A . 16 PRO HG2 1 1 1 224 1 1 16 PRO HG3 H -6.407 -2.724 4.298 1.00 . A A . 16 PRO HG3 1 1 1 225 1 1 16 PRO N N -8.233 -3.385 1.684 1.00 . A A . 16 PRO N 1 1 1 226 1 1 16 PRO O O -6.632 -4.808 0.188 1.00 . A A . 16 PRO O 1 1 1 227 1 1 17 ILE C C -3.167 -4.176 -1.098 1.00 . A A . 17 ILE C 1 1 1 228 1 1 17 ILE CA C -4.597 -3.938 -1.545 1.00 . A A . 17 ILE CA 1 1 1 229 1 1 17 ILE CB C -4.621 -3.274 -2.956 1.00 . A A . 17 ILE CB 1 1 1 230 1 1 17 ILE CD1 C -7.057 -4.076 -3.540 1.00 . A A . 17 ILE CD1 1 1 1 231 1 1 17 ILE CG1 C -6.063 -2.890 -3.419 1.00 . A A . 17 ILE CG1 1 1 1 232 1 1 17 ILE CG2 C -3.881 -4.156 -4.003 1.00 . A A . 17 ILE CG2 1 1 1 233 1 1 17 ILE H H -5.124 -2.131 -0.551 1.00 . A A . 17 ILE H 1 1 1 234 1 1 17 ILE HA H -5.069 -4.927 -1.657 1.00 . A A . 17 ILE HA 1 1 1 235 1 1 17 ILE HB H -4.064 -2.324 -2.898 1.00 . A A . 17 ILE HB 1 1 1 236 1 1 17 ILE HD11 H -8.024 -3.706 -3.916 1.00 . A A . 17 ILE HD11 1 1 1 237 1 1 17 ILE HD12 H -6.689 -4.836 -4.245 1.00 . A A . 17 ILE HD12 1 1 1 238 1 1 17 ILE HD13 H -7.238 -4.550 -2.565 1.00 . A A . 17 ILE HD13 1 1 1 239 1 1 17 ILE HG12 H -6.494 -2.157 -2.716 1.00 . A A . 17 ILE HG12 1 1 1 240 1 1 17 ILE HG13 H -5.998 -2.396 -4.403 1.00 . A A . 17 ILE HG13 1 1 1 241 1 1 17 ILE HG21 H -4.312 -5.167 -4.052 1.00 . A A . 17 ILE HG21 1 1 1 242 1 1 17 ILE HG22 H -3.941 -3.700 -5.004 1.00 . A A . 17 ILE HG22 1 1 1 243 1 1 17 ILE HG23 H -2.816 -4.253 -3.741 1.00 . A A . 17 ILE HG23 1 1 1 244 1 1 17 ILE N N -5.342 -3.108 -0.595 1.00 . A A . 17 ILE N 1 1 1 245 1 1 17 ILE O O -2.788 -5.330 -0.971 1.00 . A A . 17 ILE O 1 1 1 246 1 1 18 SER C C -0.685 -3.158 0.899 1.00 . A A . 18 SER C 1 1 1 247 1 1 18 SER CA C -0.927 -3.300 -0.583 1.00 . A A . 18 SER CA 1 1 1 248 1 1 18 SER CB C -0.086 -2.261 -1.375 1.00 . A A . 18 SER CB 1 1 1 249 1 1 18 SER H H -2.709 -2.184 -0.919 1.00 . A A . 18 SER H 1 1 1 250 1 1 18 SER HA H -0.585 -4.302 -0.892 1.00 . A A . 18 SER HA 1 1 1 251 1 1 18 SER HB2 H 0.973 -2.559 -1.368 1.00 . A A . 18 SER HB2 1 1 1 252 1 1 18 SER HB3 H -0.419 -2.226 -2.425 1.00 . A A . 18 SER HB3 1 1 1 253 1 1 18 SER HG H -1.020 -0.589 -0.755 1.00 . A A . 18 SER HG 1 1 1 254 1 1 18 SER N N -2.352 -3.116 -0.879 1.00 . A A . 18 SER N 1 1 1 255 1 1 18 SER O O -1.637 -2.864 1.606 1.00 . A A . 18 SER O 1 1 1 256 1 1 18 SER OG O -0.145 -0.956 -0.776 1.00 . A A . 18 SER OG 1 1 1 257 1 1 19 PHE C C 2.125 -2.655 3.159 1.00 . A A . 19 PHE C 1 1 1 258 1 1 19 PHE CA C 0.817 -3.335 2.825 1.00 . A A . 19 PHE CA 1 1 1 259 1 1 19 PHE CB C 0.671 -4.774 3.386 1.00 . A A . 19 PHE CB 1 1 1 260 1 1 19 PHE CD1 C -1.797 -5.393 3.182 1.00 . A A . 19 PHE CD1 1 1 1 261 1 1 19 PHE CD2 C -0.237 -6.331 1.595 1.00 . A A . 19 PHE CD2 1 1 1 262 1 1 19 PHE CE1 C -2.848 -6.050 2.533 1.00 . A A . 19 PHE CE1 1 1 1 263 1 1 19 PHE CE2 C -1.279 -7.014 0.965 1.00 . A A . 19 PHE CE2 1 1 1 264 1 1 19 PHE CG C -0.487 -5.518 2.706 1.00 . A A . 19 PHE CG 1 1 1 265 1 1 19 PHE CZ C -2.589 -6.870 1.432 1.00 . A A . 19 PHE CZ 1 1 1 266 1 1 19 PHE H H 1.328 -3.627 0.791 1.00 . A A . 19 PHE H 1 1 1 267 1 1 19 PHE HA H 0.086 -2.679 3.308 1.00 . A A . 19 PHE HA 1 1 1 268 1 1 19 PHE HB2 H 1.598 -5.311 3.165 1.00 . A A . 19 PHE HB2 1 1 1 269 1 1 19 PHE HB3 H 0.520 -4.787 4.477 1.00 . A A . 19 PHE HB3 1 1 1 270 1 1 19 PHE HD1 H -2.005 -4.787 4.057 1.00 . A A . 19 PHE HD1 1 1 1 271 1 1 19 PHE HD2 H 0.772 -6.439 1.211 1.00 . A A . 19 PHE HD2 1 1 1 272 1 1 19 PHE HE1 H -3.867 -5.923 2.884 1.00 . A A . 19 PHE HE1 1 1 1 273 1 1 19 PHE HE2 H -1.072 -7.654 0.112 1.00 . A A . 19 PHE HE2 1 1 1 274 1 1 19 PHE HZ H -3.401 -7.396 0.939 1.00 . A A . 19 PHE HZ 1 1 1 275 1 1 19 PHE N N 0.565 -3.370 1.385 1.00 . A A . 19 PHE N 1 1 1 276 1 1 19 PHE O O 2.776 -2.164 2.253 1.00 . A A . 19 PHE O 1 1 1 277 1 1 20 TYR C C 4.936 -2.297 4.379 1.00 . A A . 20 TYR C 1 1 1 278 1 1 20 TYR CA C 3.624 -1.725 4.866 1.00 . A A . 20 TYR CA 1 1 1 279 1 1 20 TYR CB C 3.635 -1.503 6.415 1.00 . A A . 20 TYR CB 1 1 1 280 1 1 20 TYR CD1 C 2.905 0.916 6.525 1.00 . A A . 20 TYR CD1 1 1 1 281 1 1 20 TYR CD2 C 5.073 0.367 7.429 1.00 . A A . 20 TYR CD2 1 1 1 282 1 1 20 TYR CE1 C 3.124 2.265 6.813 1.00 . A A . 20 TYR CE1 1 1 1 283 1 1 20 TYR CE2 C 5.289 1.715 7.729 1.00 . A A . 20 TYR CE2 1 1 1 284 1 1 20 TYR CG C 3.891 -0.038 6.799 1.00 . A A . 20 TYR CG 1 1 1 285 1 1 20 TYR CZ C 4.317 2.673 7.415 1.00 . A A . 20 TYR CZ 1 1 1 286 1 1 20 TYR H H 1.975 -3.055 5.156 1.00 . A A . 20 TYR H 1 1 1 287 1 1 20 TYR HA H 3.502 -0.753 4.364 1.00 . A A . 20 TYR HA 1 1 1 288 1 1 20 TYR HB2 H 2.653 -1.720 6.858 1.00 . A A . 20 TYR HB2 1 1 1 289 1 1 20 TYR HB3 H 4.352 -2.187 6.895 1.00 . A A . 20 TYR HB3 1 1 1 290 1 1 20 TYR HD1 H 1.961 0.608 6.089 1.00 . A A . 20 TYR HD1 1 1 1 291 1 1 20 TYR HD2 H 5.831 -0.363 7.692 1.00 . A A . 20 TYR HD2 1 1 1 292 1 1 20 TYR HE1 H 2.364 3.000 6.569 1.00 . A A . 20 TYR HE1 1 1 1 293 1 1 20 TYR HE2 H 6.218 2.011 8.205 1.00 . A A . 20 TYR HE2 1 1 1 294 1 1 20 TYR HH H 5.341 4.230 8.113 1.00 . A A . 20 TYR HH 1 1 1 295 1 1 20 TYR N N 2.501 -2.576 4.457 1.00 . A A . 20 TYR N 1 1 1 296 1 1 20 TYR O O 4.929 -3.313 3.703 1.00 . A A . 20 TYR O 1 1 1 297 1 1 20 TYR OH O 4.515 4.030 7.688 1.00 . A A . 20 TYR OH 1 1 1 298 1 1 21 GLY C C 7.691 -1.923 2.908 1.00 . A A . 21 GLY C 1 1 1 299 1 1 21 GLY CA C 7.379 -2.241 4.345 1.00 . A A . 21 GLY CA 1 1 1 300 1 1 21 GLY H H 6.082 -0.795 5.200 1.00 . A A . 21 GLY H 1 1 1 301 1 1 21 GLY HA2 H 8.177 -1.816 4.975 1.00 . A A . 21 GLY HA2 1 1 1 302 1 1 21 GLY HA3 H 7.375 -3.330 4.511 1.00 . A A . 21 GLY HA3 1 1 1 303 1 1 21 GLY N N 6.087 -1.668 4.714 1.00 . A A . 21 GLY N 1 1 1 304 1 1 21 GLY O O 8.356 -2.756 2.234 1.00 . A A . 21 GLY O 1 1 1 305 1 1 21 GLY OXT O 7.283 -0.827 2.442 1.00 . A A . 21 GLY OXT 1 1 2 306 1 1 1 GLY C C 3.529 -1.102 -0.723 1.00 . A A . 1 GLY C 1 1 2 307 1 1 1 GLY CA C 2.711 0.160 -0.600 1.00 . A A . 1 GLY CA 1 1 2 308 1 1 1 GLY H1 H 1.169 -0.522 0.687 1.00 . A A . 1 GLY H1 1 1 2 309 1 1 1 GLY HA2 H 2.017 0.235 -1.451 1.00 . A A . 1 GLY HA2 1 1 2 310 1 1 1 GLY HA3 H 3.398 1.019 -0.660 1.00 . A A . 1 GLY HA3 1 1 2 311 1 1 1 GLY N N 1.923 0.138 0.631 1.00 . A A . 1 GLY N 1 1 2 312 1 1 1 GLY O O 3.454 -1.762 -1.748 1.00 . A A . 1 GLY O 1 1 2 313 1 1 2 GLY C C 4.298 -3.904 0.329 1.00 . A A . 2 GLY C 1 1 2 314 1 1 2 GLY CA C 5.144 -2.656 0.246 1.00 . A A . 2 GLY CA 1 1 2 315 1 1 2 GLY H H 4.359 -0.891 1.150 1.00 . A A . 2 GLY H 1 1 2 316 1 1 2 GLY HA2 H 5.714 -2.671 -0.695 1.00 . A A . 2 GLY HA2 1 1 2 317 1 1 2 GLY HA3 H 5.867 -2.661 1.077 1.00 . A A . 2 GLY HA3 1 1 2 318 1 1 2 GLY N N 4.327 -1.446 0.315 1.00 . A A . 2 GLY N 1 1 2 319 1 1 2 GLY O O 3.094 -3.815 0.146 1.00 . A A . 2 GLY O 1 1 2 320 1 1 3 ALA C C 4.238 -6.798 2.167 1.00 . A A . 3 ALA C 1 1 2 321 1 1 3 ALA CA C 4.175 -6.327 0.732 1.00 . A A . 3 ALA CA 1 1 2 322 1 1 3 ALA CB C 4.763 -7.374 -0.251 1.00 . A A . 3 ALA CB 1 1 2 323 1 1 3 ALA H H 5.917 -5.113 0.738 1.00 . A A . 3 ALA H 1 1 2 324 1 1 3 ALA HA H 3.109 -6.203 0.484 1.00 . A A . 3 ALA HA 1 1 2 325 1 1 3 ALA HB1 H 4.191 -8.314 -0.211 1.00 . A A . 3 ALA HB1 1 1 2 326 1 1 3 ALA HB2 H 4.722 -6.980 -1.278 1.00 . A A . 3 ALA HB2 1 1 2 327 1 1 3 ALA HB3 H 5.813 -7.587 0.003 1.00 . A A . 3 ALA HB3 1 1 2 328 1 1 3 ALA N N 4.925 -5.076 0.598 1.00 . A A . 3 ALA N 1 1 2 329 1 1 3 ALA O O 4.407 -7.985 2.403 1.00 . A A . 3 ALA O 1 1 2 330 1 1 4 GLY C C 2.848 -6.814 5.051 1.00 . A A . 4 GLY C 1 1 2 331 1 1 4 GLY CA C 4.164 -6.253 4.552 1.00 . A A . 4 GLY CA 1 1 2 332 1 1 4 GLY H H 3.956 -4.903 2.926 1.00 . A A . 4 GLY H 1 1 2 333 1 1 4 GLY HA2 H 4.938 -7.020 4.710 1.00 . A A . 4 GLY HA2 1 1 2 334 1 1 4 GLY HA3 H 4.468 -5.372 5.140 1.00 . A A . 4 GLY HA3 1 1 2 335 1 1 4 GLY N N 4.103 -5.871 3.143 1.00 . A A . 4 GLY N 1 1 2 336 1 1 4 GLY O O 2.190 -7.511 4.293 1.00 . A A . 4 GLY O 1 1 2 337 1 1 5 HIS C C 0.276 -6.171 7.337 1.00 . A A . 5 HIS C 1 1 2 338 1 1 5 HIS CA C 1.362 -7.187 6.998 1.00 . A A . 5 HIS CA 1 1 2 339 1 1 5 HIS CB C 1.830 -7.895 8.270 1.00 . A A . 5 HIS CB 1 1 2 340 1 1 5 HIS CD2 C 2.114 -10.372 7.555 1.00 . A A . 5 HIS CD2 1 1 2 341 1 1 5 HIS CE1 C 4.272 -10.559 7.899 1.00 . A A . 5 HIS CE1 1 1 2 342 1 1 5 HIS CG C 2.559 -9.177 8.008 1.00 . A A . 5 HIS CG 1 1 2 343 1 1 5 HIS H H 3.093 -5.976 6.857 1.00 . A A . 5 HIS H 1 1 2 344 1 1 5 HIS HA H 0.952 -7.920 6.319 1.00 . A A . 5 HIS HA 1 1 2 345 1 1 5 HIS HB2 H 2.495 -7.241 8.814 1.00 . A A . 5 HIS HB2 1 1 2 346 1 1 5 HIS HB3 H 0.971 -8.121 8.885 1.00 . A A . 5 HIS HB3 1 1 2 347 1 1 5 HIS HD1 H 4.524 -8.634 8.542 1.00 . A A . 5 HIS HD1 1 1 2 348 1 1 5 HIS HD2 H 1.096 -10.619 7.289 1.00 . A A . 5 HIS HD2 1 1 2 349 1 1 5 HIS HE1 H 5.271 -10.963 7.960 1.00 . A A . 5 HIS HE1 1 1 2 350 1 1 5 HIS N N 2.489 -6.542 6.333 1.00 . A A . 5 HIS N 1 1 2 351 1 1 5 HIS ND1 N 3.915 -9.327 8.215 1.00 . A A . 5 HIS ND1 1 1 2 352 1 1 5 HIS NE2 N 3.198 -11.214 7.496 1.00 . A A . 5 HIS NE2 1 1 2 353 1 1 5 HIS O O -0.880 -6.532 7.556 1.00 . A A . 5 HIS O 1 1 2 354 1 1 6 VAL C C -0.748 -2.995 6.738 1.00 . A A . 6 VAL C 1 1 2 355 1 1 6 VAL CA C -0.378 -3.858 7.926 1.00 . A A . 6 VAL CA 1 1 2 356 1 1 6 VAL CB C 0.293 -3.012 9.052 1.00 . A A . 6 VAL CB 1 1 2 357 1 1 6 VAL CG1 C -0.648 -1.913 9.618 1.00 . A A . 6 VAL CG1 1 1 2 358 1 1 6 VAL CG2 C 0.784 -3.935 10.203 1.00 . A A . 6 VAL CG2 1 1 2 359 1 1 6 VAL H H 1.491 -4.486 7.223 1.00 . A A . 6 VAL H 1 1 2 360 1 1 6 VAL HA H -1.259 -4.343 8.368 1.00 . A A . 6 VAL HA 1 1 2 361 1 1 6 VAL HB H 1.175 -2.501 8.631 1.00 . A A . 6 VAL HB 1 1 2 362 1 1 6 VAL HG11 H -1.504 -2.369 10.136 1.00 . A A . 6 VAL HG11 1 1 2 363 1 1 6 VAL HG12 H -0.106 -1.286 10.342 1.00 . A A . 6 VAL HG12 1 1 2 364 1 1 6 VAL HG13 H -1.018 -1.260 8.813 1.00 . A A . 6 VAL HG13 1 1 2 365 1 1 6 VAL HG21 H 1.515 -4.672 9.836 1.00 . A A . 6 VAL HG21 1 1 2 366 1 1 6 VAL HG22 H 1.268 -3.340 10.993 1.00 . A A . 6 VAL HG22 1 1 2 367 1 1 6 VAL HG23 H -0.066 -4.478 10.646 1.00 . A A . 6 VAL HG23 1 1 2 368 1 1 6 VAL N N 0.591 -4.851 7.446 1.00 . A A . 6 VAL N 1 1 2 369 1 1 6 VAL O O 0.177 -2.661 6.015 1.00 . A A . 6 VAL O 1 1 2 370 1 1 7 PRO C C -1.725 -0.458 5.271 1.00 . A A . 7 PRO C 1 1 2 371 1 1 7 PRO CA C -2.280 -1.861 5.230 1.00 . A A . 7 PRO CA 1 1 2 372 1 1 7 PRO CB C -3.821 -1.901 5.188 1.00 . A A . 7 PRO CB 1 1 2 373 1 1 7 PRO CD C -3.167 -2.965 7.270 1.00 . A A . 7 PRO CD 1 1 2 374 1 1 7 PRO CG C -4.211 -1.990 6.679 1.00 . A A . 7 PRO CG 1 1 2 375 1 1 7 PRO HA H -1.906 -2.409 4.359 1.00 . A A . 7 PRO HA 1 1 2 376 1 1 7 PRO HB2 H -4.274 -1.047 4.657 1.00 . A A . 7 PRO HB2 1 1 2 377 1 1 7 PRO HB3 H -4.120 -2.839 4.695 1.00 . A A . 7 PRO HB3 1 1 2 378 1 1 7 PRO HD2 H -3.054 -2.793 8.349 1.00 . A A . 7 PRO HD2 1 1 2 379 1 1 7 PRO HD3 H -3.448 -4.014 7.077 1.00 . A A . 7 PRO HD3 1 1 2 380 1 1 7 PRO HG2 H -4.078 -0.994 7.131 1.00 . A A . 7 PRO HG2 1 1 2 381 1 1 7 PRO HG3 H -5.247 -2.329 6.839 1.00 . A A . 7 PRO HG3 1 1 2 382 1 1 7 PRO N N -2.016 -2.607 6.453 1.00 . A A . 7 PRO N 1 1 2 383 1 1 7 PRO O O -1.633 0.109 6.348 1.00 . A A . 7 PRO O 1 1 2 384 1 1 8 GLU C C -2.006 2.447 4.012 1.00 . A A . 8 GLU C 1 1 2 385 1 1 8 GLU CA C -0.847 1.476 4.038 1.00 . A A . 8 GLU CA 1 1 2 386 1 1 8 GLU CB C 0.045 1.684 2.779 1.00 . A A . 8 GLU CB 1 1 2 387 1 1 8 GLU CD C 2.213 0.962 1.665 1.00 . A A . 8 GLU CD 1 1 2 388 1 1 8 GLU CG C 1.366 0.884 2.912 1.00 . A A . 8 GLU CG 1 1 2 389 1 1 8 GLU H H -1.453 -0.400 3.233 1.00 . A A . 8 GLU H 1 1 2 390 1 1 8 GLU HA H -0.236 1.688 4.932 1.00 . A A . 8 GLU HA 1 1 2 391 1 1 8 GLU HB2 H -0.492 1.365 1.871 1.00 . A A . 8 GLU HB2 1 1 2 392 1 1 8 GLU HB3 H 0.291 2.753 2.670 1.00 . A A . 8 GLU HB3 1 1 2 393 1 1 8 GLU HG2 H 1.954 1.290 3.749 1.00 . A A . 8 GLU HG2 1 1 2 394 1 1 8 GLU HG3 H 1.131 -0.166 3.140 1.00 . A A . 8 GLU HG3 1 1 2 395 1 1 8 GLU N N -1.352 0.104 4.095 1.00 . A A . 8 GLU N 1 1 2 396 1 1 8 GLU O O -1.929 3.469 4.675 1.00 . A A . 8 GLU O 1 1 2 397 1 1 8 GLU OE1 O 3.129 1.770 1.640 1.00 . A A . 8 GLU OE1 1 1 2 398 1 1 9 TYR C C -5.498 2.271 3.043 1.00 . A A . 9 TYR C 1 1 2 399 1 1 9 TYR CA C -4.216 3.063 3.145 1.00 . A A . 9 TYR CA 1 1 2 400 1 1 9 TYR CB C -3.992 3.964 1.902 1.00 . A A . 9 TYR CB 1 1 2 401 1 1 9 TYR CD1 C -4.598 2.377 0.001 1.00 . A A . 9 TYR CD1 1 1 2 402 1 1 9 TYR CD2 C -2.282 3.000 0.280 1.00 . A A . 9 TYR CD2 1 1 2 403 1 1 9 TYR CE1 C -4.245 1.535 -1.059 1.00 . A A . 9 TYR CE1 1 1 2 404 1 1 9 TYR CE2 C -1.930 2.169 -0.786 1.00 . A A . 9 TYR CE2 1 1 2 405 1 1 9 TYR CG C -3.616 3.093 0.694 1.00 . A A . 9 TYR CG 1 1 2 406 1 1 9 TYR CZ C -2.907 1.427 -1.456 1.00 . A A . 9 TYR CZ 1 1 2 407 1 1 9 TYR H H -3.116 1.304 2.705 1.00 . A A . 9 TYR H 1 1 2 408 1 1 9 TYR HA H -4.313 3.689 4.048 1.00 . A A . 9 TYR HA 1 1 2 409 1 1 9 TYR HB2 H -4.886 4.559 1.662 1.00 . A A . 9 TYR HB2 1 1 2 410 1 1 9 TYR HB3 H -3.178 4.672 2.126 1.00 . A A . 9 TYR HB3 1 1 2 411 1 1 9 TYR HD1 H -5.642 2.468 0.284 1.00 . A A . 9 TYR HD1 1 1 2 412 1 1 9 TYR HD2 H -1.510 3.570 0.786 1.00 . A A . 9 TYR HD2 1 1 2 413 1 1 9 TYR HE1 H -5.018 0.969 -1.568 1.00 . A A . 9 TYR HE1 1 1 2 414 1 1 9 TYR HE2 H -0.893 2.099 -1.096 1.00 . A A . 9 TYR HE2 1 1 2 415 1 1 9 TYR HH H -3.248 0.267 -3.031 1.00 . A A . 9 TYR HH 1 1 2 416 1 1 9 TYR N N -3.083 2.143 3.252 1.00 . A A . 9 TYR N 1 1 2 417 1 1 9 TYR O O -5.413 1.055 2.959 1.00 . A A . 9 TYR O 1 1 2 418 1 1 9 TYR OH O -2.523 0.588 -2.508 1.00 . A A . 9 TYR OH 1 1 2 419 1 1 10 PHE C C -8.853 2.870 1.976 1.00 . A A . 10 PHE C 1 1 2 420 1 1 10 PHE CA C -7.952 2.228 3.008 1.00 . A A . 10 PHE CA 1 1 2 421 1 1 10 PHE CB C -8.657 2.323 4.383 1.00 . A A . 10 PHE CB 1 1 2 422 1 1 10 PHE CD1 C -6.785 2.502 6.099 1.00 . A A . 10 PHE CD1 1 1 2 423 1 1 10 PHE CD2 C -7.949 0.395 5.886 1.00 . A A . 10 PHE CD2 1 1 2 424 1 1 10 PHE CE1 C -6.036 1.985 7.159 1.00 . A A . 10 PHE CE1 1 1 2 425 1 1 10 PHE CE2 C -7.229 -0.111 6.973 1.00 . A A . 10 PHE CE2 1 1 2 426 1 1 10 PHE CG C -7.771 1.722 5.482 1.00 . A A . 10 PHE CG 1 1 2 427 1 1 10 PHE CZ C -6.284 0.689 7.621 1.00 . A A . 10 PHE CZ 1 1 2 428 1 1 10 PHE H H -6.711 3.938 3.144 1.00 . A A . 10 PHE H 1 1 2 429 1 1 10 PHE HA H -7.806 1.161 2.779 1.00 . A A . 10 PHE HA 1 1 2 430 1 1 10 PHE HB2 H -8.861 3.378 4.627 1.00 . A A . 10 PHE HB2 1 1 2 431 1 1 10 PHE HB3 H -9.626 1.799 4.344 1.00 . A A . 10 PHE HB3 1 1 2 432 1 1 10 PHE HD1 H -6.598 3.516 5.760 1.00 . A A . 10 PHE HD1 1 1 2 433 1 1 10 PHE HD2 H -8.649 -0.247 5.363 1.00 . A A . 10 PHE HD2 1 1 2 434 1 1 10 PHE HE1 H -5.265 2.589 7.626 1.00 . A A . 10 PHE HE1 1 1 2 435 1 1 10 PHE HE2 H -7.409 -1.125 7.315 1.00 . A A . 10 PHE HE2 1 1 2 436 1 1 10 PHE HZ H -5.744 0.307 8.481 1.00 . A A . 10 PHE HZ 1 1 2 437 1 1 10 PHE N N -6.677 2.940 3.060 1.00 . A A . 10 PHE N 1 1 2 438 1 1 10 PHE O O -8.899 4.090 1.958 1.00 . A A . 10 PHE O 1 1 2 439 1 1 11 VAL C C -11.956 2.453 0.682 1.00 . A A . 11 VAL C 1 1 2 440 1 1 11 VAL CA C -10.525 2.632 0.187 1.00 . A A . 11 VAL CA 1 1 2 441 1 1 11 VAL CB C -10.387 1.973 -1.198 1.00 . A A . 11 VAL CB 1 1 2 442 1 1 11 VAL CG1 C -11.259 2.687 -2.219 1.00 . A A . 11 VAL CG1 1 1 2 443 1 1 11 VAL CG2 C -8.931 1.965 -1.641 1.00 . A A . 11 VAL CG2 1 1 2 444 1 1 11 VAL H H -9.457 1.106 1.192 1.00 . A A . 11 VAL H 1 1 2 445 1 1 11 VAL HA H -10.320 3.687 0.082 1.00 . A A . 11 VAL HA 1 1 2 446 1 1 11 VAL HB H -10.723 0.949 -1.123 1.00 . A A . 11 VAL HB 1 1 2 447 1 1 11 VAL HG11 H -12.274 2.324 -2.141 1.00 . A A . 11 VAL HG11 1 1 2 448 1 1 11 VAL HG12 H -11.240 3.750 -2.029 1.00 . A A . 11 VAL HG12 1 1 2 449 1 1 11 VAL HG13 H -10.883 2.491 -3.213 1.00 . A A . 11 VAL HG13 1 1 2 450 1 1 11 VAL HG21 H -8.884 1.904 -2.718 1.00 . A A . 11 VAL HG21 1 1 2 451 1 1 11 VAL HG22 H -8.449 2.874 -1.310 1.00 . A A . 11 VAL HG22 1 1 2 452 1 1 11 VAL HG23 H -8.427 1.113 -1.209 1.00 . A A . 11 VAL HG23 1 1 2 453 1 1 11 VAL N N -9.568 2.078 1.137 1.00 . A A . 11 VAL N 1 1 2 454 1 1 11 VAL O O -12.214 1.674 1.599 1.00 . A A . 11 VAL O 1 1 2 455 1 1 12 ARG C C -14.932 1.834 -0.107 1.00 . A A . 12 ARG C 1 1 2 456 1 1 12 ARG CA C -14.289 3.103 0.446 1.00 . A A . 12 ARG CA 1 1 2 457 1 1 12 ARG CB C -15.045 4.333 -0.061 1.00 . A A . 12 ARG CB 1 1 2 458 1 1 12 ARG CD C -15.264 6.836 -0.038 1.00 . A A . 12 ARG CD 1 1 2 459 1 1 12 ARG CG C -14.650 5.622 0.641 1.00 . A A . 12 ARG CG 1 1 2 460 1 1 12 ARG CZ C -15.015 8.009 -2.185 1.00 . A A . 12 ARG CZ 1 1 2 461 1 1 12 ARG H H -12.616 3.784 -0.657 1.00 . A A . 12 ARG H 1 1 2 462 1 1 12 ARG HA H -14.342 3.078 1.524 1.00 . A A . 12 ARG HA 1 1 2 463 1 1 12 ARG HB2 H -14.851 4.450 -1.117 1.00 . A A . 12 ARG HB2 1 1 2 464 1 1 12 ARG HB3 H -16.103 4.177 0.088 1.00 . A A . 12 ARG HB3 1 1 2 465 1 1 12 ARG HD2 H -16.277 6.598 -0.325 1.00 . A A . 12 ARG HD2 1 1 2 466 1 1 12 ARG HD3 H -15.272 7.657 0.662 1.00 . A A . 12 ARG HD3 1 1 2 467 1 1 12 ARG HE H -13.597 6.908 -1.317 1.00 . A A . 12 ARG HE 1 1 2 468 1 1 12 ARG HG2 H -14.993 5.584 1.664 1.00 . A A . 12 ARG HG2 1 1 2 469 1 1 12 ARG HG3 H -13.574 5.715 0.623 1.00 . A A . 12 ARG HG3 1 1 2 470 1 1 12 ARG HH11 H -16.818 8.229 -1.300 1.00 . A A . 12 ARG HH11 1 1 2 471 1 1 12 ARG HH12 H -16.629 9.050 -2.813 1.00 . A A . 12 ARG HH12 1 1 2 472 1 1 12 ARG HH21 H -13.336 7.985 -3.310 1.00 . A A . 12 ARG HH21 1 1 2 473 1 1 12 ARG HH22 H -14.649 8.911 -3.956 1.00 . A A . 12 ARG HH22 1 1 2 474 1 1 12 ARG N N -12.884 3.180 0.068 1.00 . A A . 12 ARG N 1 1 2 475 1 1 12 ARG NE N -14.516 7.234 -1.228 1.00 . A A . 12 ARG NE 1 1 2 476 1 1 12 ARG NH1 N -16.256 8.466 -2.092 1.00 . A A . 12 ARG NH1 1 1 2 477 1 1 12 ARG NH2 N -14.272 8.328 -3.237 1.00 . A A . 12 ARG NH2 1 1 2 478 1 1 12 ARG O O -16.130 1.804 -0.386 1.00 . A A . 12 ARG O 1 1 2 479 1 1 13 GLY C C -14.816 -1.513 0.301 1.00 . A A . 13 GLY C 1 1 2 480 1 1 13 GLY CA C -14.634 -0.468 -0.783 1.00 . A A . 13 GLY CA 1 1 2 481 1 1 13 GLY H H -13.179 0.870 -0.024 1.00 . A A . 13 GLY H 1 1 2 482 1 1 13 GLY HA2 H -15.586 -0.290 -1.260 1.00 . A A . 13 GLY HA2 1 1 2 483 1 1 13 GLY HA3 H -13.940 -0.847 -1.518 1.00 . A A . 13 GLY HA3 1 1 2 484 1 1 13 GLY N N -14.126 0.788 -0.263 1.00 . A A . 13 GLY N 1 1 2 485 1 1 13 GLY O O -15.638 -1.345 1.202 1.00 . A A . 13 GLY O 1 1 2 486 1 1 14 ASP C C -12.819 -3.806 1.961 1.00 . A A . 14 ASP C 1 1 2 487 1 1 14 ASP CA C -14.131 -3.670 1.193 1.00 . A A . 14 ASP CA 1 1 2 488 1 1 14 ASP CB C -14.472 -4.992 0.504 1.00 . A A . 14 ASP CB 1 1 2 489 1 1 14 ASP CG C -14.504 -6.159 1.472 1.00 . A A . 14 ASP CG 1 1 2 490 1 1 14 ASP H H -13.413 -2.670 -0.529 1.00 . A A . 14 ASP H 1 1 2 491 1 1 14 ASP HA H -14.917 -3.425 1.891 1.00 . A A . 14 ASP HA 1 1 2 492 1 1 14 ASP HB2 H -15.444 -4.908 0.040 1.00 . A A . 14 ASP HB2 1 1 2 493 1 1 14 ASP HB3 H -13.732 -5.197 -0.255 1.00 . A A . 14 ASP HB3 1 1 2 494 1 1 14 ASP N N -14.050 -2.594 0.213 1.00 . A A . 14 ASP N 1 1 2 495 1 1 14 ASP O O -12.716 -3.388 3.114 1.00 . A A . 14 ASP O 1 1 2 496 1 1 14 ASP OD1 O -14.811 -5.934 2.661 1.00 . A A . 14 ASP OD1 1 1 2 497 1 1 14 ASP OD2 O -14.221 -7.296 1.041 1.00 . A A . 14 ASP OD2 1 1 2 498 1 1 15 PHE C C -9.434 -3.815 1.185 1.00 . A A . 15 PHE C 1 1 2 499 1 1 15 PHE CA C -10.514 -4.588 1.935 1.00 . A A . 15 PHE CA 1 1 2 500 1 1 15 PHE CB C -10.159 -6.076 1.972 1.00 . A A . 15 PHE CB 1 1 2 501 1 1 15 PHE CD1 C -10.820 -6.398 4.372 1.00 . A A . 15 PHE CD1 1 1 2 502 1 1 15 PHE CD2 C -11.585 -7.984 2.763 1.00 . A A . 15 PHE CD2 1 1 2 503 1 1 15 PHE CE1 C -11.471 -7.095 5.372 1.00 . A A . 15 PHE CE1 1 1 2 504 1 1 15 PHE CE2 C -12.239 -8.684 3.759 1.00 . A A . 15 PHE CE2 1 1 2 505 1 1 15 PHE CG C -10.869 -6.835 3.057 1.00 . A A . 15 PHE CG 1 1 2 506 1 1 15 PHE CZ C -12.182 -8.239 5.065 1.00 . A A . 15 PHE CZ 1 1 2 507 1 1 15 PHE H H -11.963 -4.707 0.395 1.00 . A A . 15 PHE H 1 1 2 508 1 1 15 PHE HA H -10.571 -4.215 2.946 1.00 . A A . 15 PHE HA 1 1 2 509 1 1 15 PHE HB2 H -10.423 -6.526 1.027 1.00 . A A . 15 PHE HB2 1 1 2 510 1 1 15 PHE HB3 H -9.097 -6.181 2.132 1.00 . A A . 15 PHE HB3 1 1 2 511 1 1 15 PHE HD1 H -10.265 -5.504 4.613 1.00 . A A . 15 PHE HD1 1 1 2 512 1 1 15 PHE HD2 H -11.630 -8.333 1.741 1.00 . A A . 15 PHE HD2 1 1 2 513 1 1 15 PHE HE1 H -11.426 -6.745 6.392 1.00 . A A . 15 PHE HE1 1 1 2 514 1 1 15 PHE HE2 H -12.794 -9.578 3.516 1.00 . A A . 15 PHE HE2 1 1 2 515 1 1 15 PHE HZ H -12.692 -8.785 5.845 1.00 . A A . 15 PHE HZ 1 1 2 516 1 1 15 PHE N N -11.819 -4.395 1.313 1.00 . A A . 15 PHE N 1 1 2 517 1 1 15 PHE O O -9.603 -3.426 0.028 1.00 . A A . 15 PHE O 1 1 2 518 1 1 16 PRO C C -6.434 -3.565 0.248 1.00 . A A . 16 PRO C 1 1 2 519 1 1 16 PRO CA C -7.261 -2.675 1.145 1.00 . A A . 16 PRO CA 1 1 2 520 1 1 16 PRO CB C -6.455 -2.126 2.348 1.00 . A A . 16 PRO CB 1 1 2 521 1 1 16 PRO CD C -8.077 -3.685 3.260 1.00 . A A . 16 PRO CD 1 1 2 522 1 1 16 PRO CG C -6.612 -3.230 3.416 1.00 . A A . 16 PRO CG 1 1 2 523 1 1 16 PRO HA H -7.687 -1.842 0.562 1.00 . A A . 16 PRO HA 1 1 2 524 1 1 16 PRO HB2 H -5.404 -1.895 2.113 1.00 . A A . 16 PRO HB2 1 1 2 525 1 1 16 PRO HB3 H -6.942 -1.213 2.729 1.00 . A A . 16 PRO HB3 1 1 2 526 1 1 16 PRO HD2 H -8.178 -4.721 3.608 1.00 . A A . 16 PRO HD2 1 1 2 527 1 1 16 PRO HD3 H -8.732 -3.020 3.846 1.00 . A A . 16 PRO HD3 1 1 2 528 1 1 16 PRO HG2 H -5.929 -4.062 3.177 1.00 . A A . 16 PRO HG2 1 1 2 529 1 1 16 PRO HG3 H -6.425 -2.879 4.443 1.00 . A A . 16 PRO HG3 1 1 2 530 1 1 16 PRO N N -8.288 -3.453 1.834 1.00 . A A . 16 PRO N 1 1 2 531 1 1 16 PRO O O -6.648 -4.767 0.268 1.00 . A A . 16 PRO O 1 1 2 532 1 1 17 ILE C C -3.371 -4.046 -1.069 1.00 . A A . 17 ILE C 1 1 2 533 1 1 17 ILE CA C -4.777 -3.755 -1.557 1.00 . A A . 17 ILE CA 1 1 2 534 1 1 17 ILE CB C -4.737 -3.037 -2.946 1.00 . A A . 17 ILE CB 1 1 2 535 1 1 17 ILE CD1 C -7.126 -1.951 -2.848 1.00 . A A . 17 ILE CD1 1 1 2 536 1 1 17 ILE CG1 C -6.143 -2.883 -3.609 1.00 . A A . 17 ILE CG1 1 1 2 537 1 1 17 ILE CG2 C -3.799 -3.805 -3.926 1.00 . A A . 17 ILE CG2 1 1 2 538 1 1 17 ILE H H -5.327 -1.996 -0.494 1.00 . A A . 17 ILE H 1 1 2 539 1 1 17 ILE HA H -5.281 -4.719 -1.744 1.00 . A A . 17 ILE HA 1 1 2 540 1 1 17 ILE HB H -4.319 -2.026 -2.821 1.00 . A A . 17 ILE HB 1 1 2 541 1 1 17 ILE HD11 H -7.506 -2.430 -1.937 1.00 . A A . 17 ILE HD11 1 1 2 542 1 1 17 ILE HD12 H -6.640 -0.999 -2.583 1.00 . A A . 17 ILE HD12 1 1 2 543 1 1 17 ILE HD13 H -7.997 -1.726 -3.485 1.00 . A A . 17 ILE HD13 1 1 2 544 1 1 17 ILE HG12 H -6.004 -2.442 -4.610 1.00 . A A . 17 ILE HG12 1 1 2 545 1 1 17 ILE HG13 H -6.608 -3.874 -3.742 1.00 . A A . 17 ILE HG13 1 1 2 546 1 1 17 ILE HG21 H -4.159 -4.836 -4.067 1.00 . A A . 17 ILE HG21 1 1 2 547 1 1 17 ILE HG22 H -3.770 -3.310 -4.909 1.00 . A A . 17 ILE HG22 1 1 2 548 1 1 17 ILE HG23 H -2.764 -3.844 -3.552 1.00 . A A . 17 ILE HG23 1 1 2 549 1 1 17 ILE N N -5.508 -2.980 -0.553 1.00 . A A . 17 ILE N 1 1 2 550 1 1 17 ILE O O -3.044 -5.210 -0.897 1.00 . A A . 17 ILE O 1 1 2 551 1 1 18 SER C C -0.816 -3.165 0.882 1.00 . A A . 18 SER C 1 1 2 552 1 1 18 SER CA C -1.092 -3.242 -0.600 1.00 . A A . 18 SER CA 1 1 2 553 1 1 18 SER CB C -0.236 -2.198 -1.370 1.00 . A A . 18 SER CB 1 1 2 554 1 1 18 SER H H -2.841 -2.069 -0.932 1.00 . A A . 18 SER H 1 1 2 555 1 1 18 SER HA H -0.784 -4.241 -0.953 1.00 . A A . 18 SER HA 1 1 2 556 1 1 18 SER HB2 H 0.814 -2.523 -1.408 1.00 . A A . 18 SER HB2 1 1 2 557 1 1 18 SER HB3 H -0.596 -2.107 -2.409 1.00 . A A . 18 SER HB3 1 1 2 558 1 1 18 SER HG H -1.102 -0.528 -0.650 1.00 . A A . 18 SER HG 1 1 2 559 1 1 18 SER N N -2.516 -3.012 -0.873 1.00 . A A . 18 SER N 1 1 2 560 1 1 18 SER O O -1.754 -2.912 1.623 1.00 . A A . 18 SER O 1 1 2 561 1 1 18 SER OG O -0.239 -0.919 -0.714 1.00 . A A . 18 SER OG 1 1 2 562 1 1 19 PHE C C 2.025 -2.683 3.089 1.00 . A A . 19 PHE C 1 1 2 563 1 1 19 PHE CA C 0.744 -3.415 2.758 1.00 . A A . 19 PHE CA 1 1 2 564 1 1 19 PHE CB C 0.698 -4.889 3.235 1.00 . A A . 19 PHE CB 1 1 2 565 1 1 19 PHE CD1 C -1.782 -5.475 3.182 1.00 . A A . 19 PHE CD1 1 1 2 566 1 1 19 PHE CD2 C -0.349 -6.383 1.460 1.00 . A A . 19 PHE CD2 1 1 2 567 1 1 19 PHE CE1 C -2.887 -6.090 2.584 1.00 . A A . 19 PHE CE1 1 1 2 568 1 1 19 PHE CE2 C -1.447 -7.022 0.878 1.00 . A A . 19 PHE CE2 1 1 2 569 1 1 19 PHE CG C -0.511 -5.602 2.612 1.00 . A A . 19 PHE CG 1 1 2 570 1 1 19 PHE CZ C -2.718 -6.871 1.437 1.00 . A A . 19 PHE CZ 1 1 2 571 1 1 19 PHE H H 1.200 -3.610 0.703 1.00 . A A . 19 PHE H 1 1 2 572 1 1 19 PHE HA H -0.009 -2.840 3.305 1.00 . A A . 19 PHE HA 1 1 2 573 1 1 19 PHE HB2 H 1.613 -5.386 2.895 1.00 . A A . 19 PHE HB2 1 1 2 574 1 1 19 PHE HB3 H 0.644 -4.974 4.333 1.00 . A A . 19 PHE HB3 1 1 2 575 1 1 19 PHE HD1 H -1.918 -4.896 4.090 1.00 . A A . 19 PHE HD1 1 1 2 576 1 1 19 PHE HD2 H 0.631 -6.496 1.007 1.00 . A A . 19 PHE HD2 1 1 2 577 1 1 19 PHE HE1 H -3.878 -5.962 3.011 1.00 . A A . 19 PHE HE1 1 1 2 578 1 1 19 PHE HE2 H -1.309 -7.633 -0.010 1.00 . A A . 19 PHE HE2 1 1 2 579 1 1 19 PHE HZ H -3.573 -7.361 0.980 1.00 . A A . 19 PHE HZ 1 1 2 580 1 1 19 PHE N N 0.450 -3.387 1.326 1.00 . A A . 19 PHE N 1 1 2 581 1 1 19 PHE O O 2.639 -2.142 2.185 1.00 . A A . 19 PHE O 1 1 2 582 1 1 20 TYR C C 4.833 -2.265 4.237 1.00 . A A . 20 TYR C 1 1 2 583 1 1 20 TYR CA C 3.525 -1.740 4.783 1.00 . A A . 20 TYR CA 1 1 2 584 1 1 20 TYR CB C 3.566 -1.561 6.333 1.00 . A A . 20 TYR CB 1 1 2 585 1 1 20 TYR CD1 C 3.132 0.922 6.563 1.00 . A A . 20 TYR CD1 1 1 2 586 1 1 20 TYR CD2 C 5.251 0.083 7.351 1.00 . A A . 20 TYR CD2 1 1 2 587 1 1 20 TYR CE1 C 3.517 2.224 6.891 1.00 . A A . 20 TYR CE1 1 1 2 588 1 1 20 TYR CE2 C 5.631 1.382 7.697 1.00 . A A . 20 TYR CE2 1 1 2 589 1 1 20 TYR CG C 4.006 -0.152 6.758 1.00 . A A . 20 TYR CG 1 1 2 590 1 1 20 TYR CZ C 4.774 2.461 7.460 1.00 . A A . 20 TYR CZ 1 1 2 591 1 1 20 TYR H H 1.928 -3.126 5.083 1.00 . A A . 20 TYR H 1 1 2 592 1 1 20 TYR HA H 3.354 -0.755 4.323 1.00 . A A . 20 TYR HA 1 1 2 593 1 1 20 TYR HB2 H 2.556 -1.660 6.754 1.00 . A A . 20 TYR HB2 1 1 2 594 1 1 20 TYR HB3 H 4.185 -2.348 6.788 1.00 . A A . 20 TYR HB3 1 1 2 595 1 1 20 TYR HD1 H 2.141 0.749 6.157 1.00 . A A . 20 TYR HD1 1 1 2 596 1 1 20 TYR HD2 H 5.927 -0.742 7.547 1.00 . A A . 20 TYR HD2 1 1 2 597 1 1 20 TYR HE1 H 2.832 3.046 6.700 1.00 . A A . 20 TYR HE1 1 1 2 598 1 1 20 TYR HE2 H 6.599 1.560 8.150 1.00 . A A . 20 TYR HE2 1 1 2 599 1 1 20 TYR HH H 4.560 4.435 7.595 1.00 . A A . 20 TYR HH 1 1 2 600 1 1 20 TYR N N 2.420 -2.616 4.382 1.00 . A A . 20 TYR N 1 1 2 601 1 1 20 TYR O O 4.830 -3.321 3.626 1.00 . A A . 20 TYR O 1 1 2 602 1 1 20 TYR OH O 5.192 3.753 7.794 1.00 . A A . 20 TYR OH 1 1 2 603 1 1 21 GLY C C 7.696 -1.257 2.767 1.00 . A A . 21 GLY C 1 1 2 604 1 1 21 GLY CA C 7.265 -2.027 3.985 1.00 . A A . 21 GLY CA 1 1 2 605 1 1 21 GLY H H 5.930 -0.653 4.887 1.00 . A A . 21 GLY H 1 1 2 606 1 1 21 GLY HA2 H 8.016 -1.880 4.777 1.00 . A A . 21 GLY HA2 1 1 2 607 1 1 21 GLY HA3 H 7.253 -3.100 3.740 1.00 . A A . 21 GLY HA3 1 1 2 608 1 1 21 GLY N N 5.961 -1.548 4.446 1.00 . A A . 21 GLY N 1 1 2 609 1 1 21 GLY O O 8.848 -1.474 2.302 1.00 . A A . 21 GLY O 1 1 2 610 1 1 21 GLY OXT O 6.891 -0.432 2.262 1.00 . A A . 21 GLY OXT 1 1 3 611 1 1 1 GLY C C 3.670 -1.400 -0.777 1.00 . A A . 1 GLY C 1 1 3 612 1 1 1 GLY CA C 2.901 -0.109 -0.615 1.00 . A A . 1 GLY CA 1 1 3 613 1 1 1 GLY H1 H 1.692 -0.940 0.912 1.00 . A A . 1 GLY H1 1 1 3 614 1 1 1 GLY HA2 H 2.165 0.010 -1.426 1.00 . A A . 1 GLY HA2 1 1 3 615 1 1 1 GLY HA3 H 3.634 0.708 -0.697 1.00 . A A . 1 GLY HA3 1 1 3 616 1 1 1 GLY N N 2.190 -0.108 0.662 1.00 . A A . 1 GLY N 1 1 3 617 1 1 1 GLY O O 3.554 -2.041 -1.809 1.00 . A A . 1 GLY O 1 1 3 618 1 1 2 GLY C C 4.378 -4.235 0.381 1.00 . A A . 2 GLY C 1 1 3 619 1 1 2 GLY CA C 5.246 -3.023 0.147 1.00 . A A . 2 GLY CA 1 1 3 620 1 1 2 GLY H H 4.531 -1.249 1.088 1.00 . A A . 2 GLY H 1 1 3 621 1 1 2 GLY HA2 H 5.716 -3.108 -0.845 1.00 . A A . 2 GLY HA2 1 1 3 622 1 1 2 GLY HA3 H 6.051 -3.011 0.896 1.00 . A A . 2 GLY HA3 1 1 3 623 1 1 2 GLY N N 4.472 -1.787 0.243 1.00 . A A . 2 GLY N 1 1 3 624 1 1 2 GLY O O 3.168 -4.124 0.257 1.00 . A A . 2 GLY O 1 1 3 625 1 1 3 ALA C C 4.246 -6.951 2.436 1.00 . A A . 3 ALA C 1 1 3 626 1 1 3 ALA CA C 4.231 -6.623 0.959 1.00 . A A . 3 ALA CA 1 1 3 627 1 1 3 ALA CB C 4.836 -7.770 0.106 1.00 . A A . 3 ALA CB 1 1 3 628 1 1 3 ALA H H 5.989 -5.447 0.814 1.00 . A A . 3 ALA H 1 1 3 629 1 1 3 ALA HA H 3.176 -6.520 0.660 1.00 . A A . 3 ALA HA 1 1 3 630 1 1 3 ALA HB1 H 5.875 -7.969 0.413 1.00 . A A . 3 ALA HB1 1 1 3 631 1 1 3 ALA HB2 H 4.249 -8.694 0.223 1.00 . A A . 3 ALA HB2 1 1 3 632 1 1 3 ALA HB3 H 4.834 -7.483 -0.958 1.00 . A A . 3 ALA HB3 1 1 3 633 1 1 3 ALA N N 4.993 -5.398 0.712 1.00 . A A . 3 ALA N 1 1 3 634 1 1 3 ALA O O 4.403 -8.108 2.793 1.00 . A A . 3 ALA O 1 1 3 635 1 1 4 GLY C C 2.779 -6.761 5.258 1.00 . A A . 4 GLY C 1 1 3 636 1 1 4 GLY CA C 4.092 -6.193 4.756 1.00 . A A . 4 GLY CA 1 1 3 637 1 1 4 GLY H H 3.954 -4.992 3.005 1.00 . A A . 4 GLY H 1 1 3 638 1 1 4 GLY HA2 H 4.890 -6.907 5.009 1.00 . A A . 4 GLY HA2 1 1 3 639 1 1 4 GLY HA3 H 4.329 -5.253 5.281 1.00 . A A . 4 GLY HA3 1 1 3 640 1 1 4 GLY N N 4.083 -5.937 3.317 1.00 . A A . 4 GLY N 1 1 3 641 1 1 4 GLY O O 2.128 -7.478 4.515 1.00 . A A . 4 GLY O 1 1 3 642 1 1 5 HIS C C 0.190 -6.024 7.478 1.00 . A A . 5 HIS C 1 1 3 643 1 1 5 HIS CA C 1.268 -7.067 7.199 1.00 . A A . 5 HIS CA 1 1 3 644 1 1 5 HIS CB C 1.701 -7.732 8.506 1.00 . A A . 5 HIS CB 1 1 3 645 1 1 5 HIS CD2 C 3.566 -9.322 7.656 1.00 . A A . 5 HIS CD2 1 1 3 646 1 1 5 HIS CE1 C 2.786 -11.199 8.477 1.00 . A A . 5 HIS CE1 1 1 3 647 1 1 5 HIS CG C 2.415 -9.034 8.308 1.00 . A A . 5 HIS CG 1 1 3 648 1 1 5 HIS H H 3.017 -5.885 7.048 1.00 . A A . 5 HIS H 1 1 3 649 1 1 5 HIS HA H 0.861 -7.820 6.540 1.00 . A A . 5 HIS HA 1 1 3 650 1 1 5 HIS HB2 H 2.365 -7.067 9.037 1.00 . A A . 5 HIS HB2 1 1 3 651 1 1 5 HIS HB3 H 0.827 -7.921 9.113 1.00 . A A . 5 HIS HB3 1 1 3 652 1 1 5 HIS HD1 H 1.132 -10.353 9.334 1.00 . A A . 5 HIS HD1 1 1 3 653 1 1 5 HIS HD2 H 4.203 -8.619 7.138 1.00 . A A . 5 HIS HD2 1 1 3 654 1 1 5 HIS HE1 H 2.679 -12.242 8.734 1.00 . A A . 5 HIS HE1 1 1 3 655 1 1 5 HIS N N 2.416 -6.463 6.533 1.00 . A A . 5 HIS N 1 1 3 656 1 1 5 HIS ND1 N 1.951 -10.231 8.810 1.00 . A A . 5 HIS ND1 1 1 3 657 1 1 5 HIS NE2 N 3.774 -10.674 7.776 1.00 . A A . 5 HIS NE2 1 1 3 658 1 1 5 HIS O O -0.975 -6.361 7.689 1.00 . A A . 5 HIS O 1 1 3 659 1 1 6 VAL C C -0.784 -2.864 6.749 1.00 . A A . 6 VAL C 1 1 3 660 1 1 6 VAL CA C -0.440 -3.684 7.973 1.00 . A A . 6 VAL CA 1 1 3 661 1 1 6 VAL CB C 0.222 -2.799 9.074 1.00 . A A . 6 VAL CB 1 1 3 662 1 1 6 VAL CG1 C -0.722 -1.674 9.579 1.00 . A A . 6 VAL CG1 1 1 3 663 1 1 6 VAL CG2 C 0.689 -3.679 10.268 1.00 . A A . 6 VAL CG2 1 1 3 664 1 1 6 VAL H H 1.430 -4.360 7.321 1.00 . A A . 6 VAL H 1 1 3 665 1 1 6 VAL HA H -1.330 -4.142 8.426 1.00 . A A . 6 VAL HA 1 1 3 666 1 1 6 VAL HB H 1.113 -2.311 8.645 1.00 . A A . 6 VAL HB 1 1 3 667 1 1 6 VAL HG11 H -0.190 -1.023 10.290 1.00 . A A . 6 VAL HG11 1 1 3 668 1 1 6 VAL HG12 H -1.074 -1.049 8.744 1.00 . A A . 6 VAL HG12 1 1 3 669 1 1 6 VAL HG13 H -1.592 -2.104 10.097 1.00 . A A . 6 VAL HG13 1 1 3 670 1 1 6 VAL HG21 H -0.171 -4.196 10.721 1.00 . A A . 6 VAL HG21 1 1 3 671 1 1 6 VAL HG22 H 1.418 -4.436 9.942 1.00 . A A . 6 VAL HG22 1 1 3 672 1 1 6 VAL HG23 H 1.167 -3.056 11.040 1.00 . A A . 6 VAL HG23 1 1 3 673 1 1 6 VAL N N 0.522 -4.706 7.545 1.00 . A A . 6 VAL N 1 1 3 674 1 1 6 VAL O O 0.156 -2.547 6.039 1.00 . A A . 6 VAL O 1 1 3 675 1 1 7 PRO C C -1.734 -0.392 5.172 1.00 . A A . 7 PRO C 1 1 3 676 1 1 7 PRO CA C -2.286 -1.797 5.165 1.00 . A A . 7 PRO CA 1 1 3 677 1 1 7 PRO CB C -3.826 -1.849 5.088 1.00 . A A . 7 PRO CB 1 1 3 678 1 1 7 PRO CD C -3.215 -2.827 7.225 1.00 . A A . 7 PRO CD 1 1 3 679 1 1 7 PRO CG C -4.252 -1.886 6.571 1.00 . A A . 7 PRO CG 1 1 3 680 1 1 7 PRO HA H -1.889 -2.378 4.326 1.00 . A A . 7 PRO HA 1 1 3 681 1 1 7 PRO HB2 H -4.268 -1.017 4.516 1.00 . A A . 7 PRO HB2 1 1 3 682 1 1 7 PRO HB3 H -4.111 -2.806 4.624 1.00 . A A . 7 PRO HB3 1 1 3 683 1 1 7 PRO HD2 H -3.126 -2.607 8.298 1.00 . A A . 7 PRO HD2 1 1 3 684 1 1 7 PRO HD3 H -3.485 -3.885 7.071 1.00 . A A . 7 PRO HD3 1 1 3 685 1 1 7 PRO HG2 H -4.139 -0.873 6.989 1.00 . A A . 7 PRO HG2 1 1 3 686 1 1 7 PRO HG3 H -5.288 -2.229 6.718 1.00 . A A . 7 PRO HG3 1 1 3 687 1 1 7 PRO N N -2.048 -2.495 6.420 1.00 . A A . 7 PRO N 1 1 3 688 1 1 7 PRO O O -1.693 0.222 6.226 1.00 . A A . 7 PRO O 1 1 3 689 1 1 8 GLU C C -1.962 2.456 3.845 1.00 . A A . 8 GLU C 1 1 3 690 1 1 8 GLU CA C -0.800 1.492 3.909 1.00 . A A . 8 GLU CA 1 1 3 691 1 1 8 GLU CB C 0.082 1.688 2.643 1.00 . A A . 8 GLU CB 1 1 3 692 1 1 8 GLU CD C 2.188 0.983 1.465 1.00 . A A . 8 GLU CD 1 1 3 693 1 1 8 GLU CG C 1.428 0.932 2.770 1.00 . A A . 8 GLU CG 1 1 3 694 1 1 8 GLU H H -1.368 -0.415 3.149 1.00 . A A . 8 GLU H 1 1 3 695 1 1 8 GLU HA H -0.184 1.726 4.794 1.00 . A A . 8 GLU HA 1 1 3 696 1 1 8 GLU HB2 H -0.457 1.329 1.751 1.00 . A A . 8 GLU HB2 1 1 3 697 1 1 8 GLU HB3 H 0.296 2.761 2.502 1.00 . A A . 8 GLU HB3 1 1 3 698 1 1 8 GLU HG2 H 2.046 1.404 3.548 1.00 . A A . 8 GLU HG2 1 1 3 699 1 1 8 GLU HG3 H 1.232 -0.105 3.080 1.00 . A A . 8 GLU HG3 1 1 3 700 1 1 8 GLU N N -1.305 0.122 3.994 1.00 . A A . 8 GLU N 1 1 3 701 1 1 8 GLU O O -1.924 3.467 4.529 1.00 . A A . 8 GLU O 1 1 3 702 1 1 8 GLU OE1 O 2.770 2.019 1.185 1.00 . A A . 8 GLU OE1 1 1 3 703 1 1 9 TYR C C -5.397 2.309 2.744 1.00 . A A . 9 TYR C 1 1 3 704 1 1 9 TYR CA C -4.106 3.087 2.832 1.00 . A A . 9 TYR CA 1 1 3 705 1 1 9 TYR CB C -3.837 3.913 1.546 1.00 . A A . 9 TYR CB 1 1 3 706 1 1 9 TYR CD1 C -4.438 2.244 -0.287 1.00 . A A . 9 TYR CD1 1 1 3 707 1 1 9 TYR CD2 C -2.120 2.859 -0.016 1.00 . A A . 9 TYR CD2 1 1 3 708 1 1 9 TYR CE1 C -4.086 1.371 -1.321 1.00 . A A . 9 TYR CE1 1 1 3 709 1 1 9 TYR CE2 C -1.768 1.992 -1.053 1.00 . A A . 9 TYR CE2 1 1 3 710 1 1 9 TYR CG C -3.456 2.982 0.383 1.00 . A A . 9 TYR CG 1 1 3 711 1 1 9 TYR CZ C -2.748 1.251 -1.718 1.00 . A A . 9 TYR CZ 1 1 3 712 1 1 9 TYR H H -2.995 1.319 2.472 1.00 . A A . 9 TYR H 1 1 3 713 1 1 9 TYR HA H -4.218 3.767 3.694 1.00 . A A . 9 TYR HA 1 1 3 714 1 1 9 TYR HB2 H -4.713 4.514 1.258 1.00 . A A . 9 TYR HB2 1 1 3 715 1 1 9 TYR HB3 H -3.012 4.613 1.751 1.00 . A A . 9 TYR HB3 1 1 3 716 1 1 9 TYR HD1 H -5.482 2.344 -0.007 1.00 . A A . 9 TYR HD1 1 1 3 717 1 1 9 TYR HD2 H -1.345 3.437 0.478 1.00 . A A . 9 TYR HD2 1 1 3 718 1 1 9 TYR HE1 H -4.859 0.788 -1.813 1.00 . A A . 9 TYR HE1 1 1 3 719 1 1 9 TYR HE2 H -0.727 1.895 -1.347 1.00 . A A . 9 TYR HE2 1 1 3 720 1 1 9 TYR HH H -3.096 0.127 -3.316 1.00 . A A . 9 TYR HH 1 1 3 721 1 1 9 TYR N N -2.991 2.159 3.018 1.00 . A A . 9 TYR N 1 1 3 722 1 1 9 TYR O O -5.331 1.090 2.727 1.00 . A A . 9 TYR O 1 1 3 723 1 1 9 TYR OH O -2.372 0.406 -2.767 1.00 . A A . 9 TYR OH 1 1 3 724 1 1 10 PHE C C -8.718 2.928 1.577 1.00 . A A . 10 PHE C 1 1 3 725 1 1 10 PHE CA C -7.849 2.309 2.650 1.00 . A A . 10 PHE CA 1 1 3 726 1 1 10 PHE CB C -8.572 2.471 4.010 1.00 . A A . 10 PHE CB 1 1 3 727 1 1 10 PHE CD1 C -6.728 2.713 5.746 1.00 . A A . 10 PHE CD1 1 1 3 728 1 1 10 PHE CD2 C -7.890 0.600 5.595 1.00 . A A . 10 PHE CD2 1 1 3 729 1 1 10 PHE CE1 C -5.995 2.236 6.836 1.00 . A A . 10 PHE CE1 1 1 3 730 1 1 10 PHE CE2 C -7.186 0.134 6.710 1.00 . A A . 10 PHE CE2 1 1 3 731 1 1 10 PHE CG C -7.705 1.912 5.144 1.00 . A A . 10 PHE CG 1 1 3 732 1 1 10 PHE CZ C -6.251 0.958 7.342 1.00 . A A . 10 PHE CZ 1 1 3 733 1 1 10 PHE H H -6.580 4.001 2.727 1.00 . A A . 10 PHE H 1 1 3 734 1 1 10 PHE HA H -7.719 1.232 2.465 1.00 . A A . 10 PHE HA 1 1 3 735 1 1 10 PHE HB2 H -8.770 3.538 4.205 1.00 . A A . 10 PHE HB2 1 1 3 736 1 1 10 PHE HB3 H -9.545 1.954 3.980 1.00 . A A . 10 PHE HB3 1 1 3 737 1 1 10 PHE HD1 H -6.535 3.714 5.373 1.00 . A A . 10 PHE HD1 1 1 3 738 1 1 10 PHE HD2 H -8.583 -0.061 5.085 1.00 . A A . 10 PHE HD2 1 1 3 739 1 1 10 PHE HE1 H -5.231 2.857 7.292 1.00 . A A . 10 PHE HE1 1 1 3 740 1 1 10 PHE HE2 H -7.371 -0.867 7.086 1.00 . A A . 10 PHE HE2 1 1 3 741 1 1 10 PHE HZ H -5.725 0.609 8.225 1.00 . A A . 10 PHE HZ 1 1 3 742 1 1 10 PHE N N -6.562 2.999 2.696 1.00 . A A . 10 PHE N 1 1 3 743 1 1 10 PHE O O -8.756 4.148 1.525 1.00 . A A . 10 PHE O 1 1 3 744 1 1 11 VAL C C -11.785 2.509 0.215 1.00 . A A . 11 VAL C 1 1 3 745 1 1 11 VAL CA C -10.340 2.653 -0.251 1.00 . A A . 11 VAL CA 1 1 3 746 1 1 11 VAL CB C -10.179 1.947 -1.611 1.00 . A A . 11 VAL CB 1 1 3 747 1 1 11 VAL CG1 C -11.018 2.638 -2.674 1.00 . A A . 11 VAL CG1 1 1 3 748 1 1 11 VAL CG2 C -8.714 1.907 -2.019 1.00 . A A . 11 VAL CG2 1 1 3 749 1 1 11 VAL H H -9.316 1.147 0.827 1.00 . A A . 11 VAL H 1 1 3 750 1 1 11 VAL HA H -10.118 3.701 -0.385 1.00 . A A . 11 VAL HA 1 1 3 751 1 1 11 VAL HB H -10.530 0.931 -1.510 1.00 . A A . 11 VAL HB 1 1 3 752 1 1 11 VAL HG11 H -12.039 2.293 -2.607 1.00 . A A . 11 VAL HG11 1 1 3 753 1 1 11 VAL HG12 H -10.987 3.707 -2.520 1.00 . A A . 11 VAL HG12 1 1 3 754 1 1 11 VAL HG13 H -10.624 2.404 -3.652 1.00 . A A . 11 VAL HG13 1 1 3 755 1 1 11 VAL HG21 H -8.638 1.984 -3.093 1.00 . A A . 11 VAL HG21 1 1 3 756 1 1 11 VAL HG22 H -8.189 2.734 -1.561 1.00 . A A . 11 VAL HG22 1 1 3 757 1 1 11 VAL HG23 H -8.274 0.977 -1.691 1.00 . A A . 11 VAL HG23 1 1 3 758 1 1 11 VAL N N -9.413 2.118 0.739 1.00 . A A . 11 VAL N 1 1 3 759 1 1 11 VAL O O -12.074 1.762 1.150 1.00 . A A . 11 VAL O 1 1 3 760 1 1 12 ARG C C -14.750 1.903 -0.622 1.00 . A A . 12 ARG C 1 1 3 761 1 1 12 ARG CA C -14.103 3.181 -0.096 1.00 . A A . 12 ARG CA 1 1 3 762 1 1 12 ARG CB C -14.829 4.403 -0.660 1.00 . A A . 12 ARG CB 1 1 3 763 1 1 12 ARG CD C -15.019 6.908 -0.727 1.00 . A A . 12 ARG CD 1 1 3 764 1 1 12 ARG CG C -14.419 5.712 -0.005 1.00 . A A . 12 ARG CG 1 1 3 765 1 1 12 ARG CZ C -16.805 7.703 0.764 1.00 . A A . 12 ARG CZ 1 1 3 766 1 1 12 ARG H H -12.396 3.805 -1.180 1.00 . A A . 12 ARG H 1 1 3 767 1 1 12 ARG HA H -14.181 3.192 0.981 1.00 . A A . 12 ARG HA 1 1 3 768 1 1 12 ARG HB2 H -14.621 4.475 -1.718 1.00 . A A . 12 ARG HB2 1 1 3 769 1 1 12 ARG HB3 H -15.892 4.272 -0.519 1.00 . A A . 12 ARG HB3 1 1 3 770 1 1 12 ARG HD2 H -14.453 7.790 -0.467 1.00 . A A . 12 ARG HD2 1 1 3 771 1 1 12 ARG HD3 H -14.954 6.739 -1.791 1.00 . A A . 12 ARG HD3 1 1 3 772 1 1 12 ARG HE H -17.102 6.813 -0.996 1.00 . A A . 12 ARG HE 1 1 3 773 1 1 12 ARG HG2 H -14.763 5.714 1.019 1.00 . A A . 12 ARG HG2 1 1 3 774 1 1 12 ARG HG3 H -13.343 5.792 -0.026 1.00 . A A . 12 ARG HG3 1 1 3 775 1 1 12 ARG HH11 H -14.928 8.013 1.445 1.00 . A A . 12 ARG HH11 1 1 3 776 1 1 12 ARG HH12 H -16.197 8.568 2.486 1.00 . A A . 12 ARG HH12 1 1 3 777 1 1 12 ARG HH21 H -18.780 7.541 0.366 1.00 . A A . 12 ARG HH21 1 1 3 778 1 1 12 ARG HH22 H -18.387 8.298 1.872 1.00 . A A . 12 ARG HH22 1 1 3 779 1 1 12 ARG N N -12.688 3.228 -0.443 1.00 . A A . 12 ARG N 1 1 3 780 1 1 12 ARG NE N -16.418 7.121 -0.365 1.00 . A A . 12 ARG NE 1 1 3 781 1 1 12 ARG NH1 N -15.903 8.129 1.637 1.00 . A A . 12 ARG NH1 1 1 3 782 1 1 12 ARG NH2 N -18.097 7.860 1.022 1.00 . A A . 12 ARG NH2 1 1 3 783 1 1 12 ARG O O -15.939 1.882 -0.938 1.00 . A A . 12 ARG O 1 1 3 784 1 1 13 GLY C C -14.698 -1.430 -0.090 1.00 . A A . 13 GLY C 1 1 3 785 1 1 13 GLY CA C -14.470 -0.427 -1.204 1.00 . A A . 13 GLY CA 1 1 3 786 1 1 13 GLY H H -13.017 0.915 -0.449 1.00 . A A . 13 GLY H 1 1 3 787 1 1 13 GLY HA2 H -15.406 -0.252 -1.714 1.00 . A A . 13 GLY HA2 1 1 3 788 1 1 13 GLY HA3 H -13.762 -0.842 -1.907 1.00 . A A . 13 GLY HA3 1 1 3 789 1 1 13 GLY N N -13.958 0.839 -0.715 1.00 . A A . 13 GLY N 1 1 3 790 1 1 13 GLY O O -15.543 -1.220 0.780 1.00 . A A . 13 GLY O 1 1 3 791 1 1 14 ASP C C -12.779 -3.693 1.702 1.00 . A A . 14 ASP C 1 1 3 792 1 1 14 ASP CA C -14.068 -3.563 0.897 1.00 . A A . 14 ASP CA 1 1 3 793 1 1 14 ASP CB C -14.414 -4.903 0.246 1.00 . A A . 14 ASP CB 1 1 3 794 1 1 14 ASP CG C -14.506 -6.030 1.255 1.00 . A A . 14 ASP CG 1 1 3 795 1 1 14 ASP H H -13.288 -2.633 -0.837 1.00 . A A . 14 ASP H 1 1 3 796 1 1 14 ASP HA H -14.868 -3.281 1.565 1.00 . A A . 14 ASP HA 1 1 3 797 1 1 14 ASP HB2 H -15.367 -4.816 -0.256 1.00 . A A . 14 ASP HB2 1 1 3 798 1 1 14 ASP HB3 H -13.652 -5.151 -0.478 1.00 . A A . 14 ASP HB3 1 1 3 799 1 1 14 ASP N N -13.944 -2.523 -0.118 1.00 . A A . 14 ASP N 1 1 3 800 1 1 14 ASP O O -12.703 -3.250 2.849 1.00 . A A . 14 ASP O 1 1 3 801 1 1 14 ASP OD1 O -14.862 -5.756 2.420 1.00 . A A . 14 ASP OD1 1 1 3 802 1 1 14 ASP OD2 O -14.221 -7.187 0.880 1.00 . A A . 14 ASP OD2 1 1 3 803 1 1 15 PHE C C -9.370 -3.771 1.002 1.00 . A A . 15 PHE C 1 1 3 804 1 1 15 PHE CA C -10.481 -4.495 1.756 1.00 . A A . 15 PHE CA 1 1 3 805 1 1 15 PHE CB C -10.154 -5.986 1.863 1.00 . A A . 15 PHE CB 1 1 3 806 1 1 15 PHE CD1 C -10.853 -6.212 4.262 1.00 . A A . 15 PHE CD1 1 1 3 807 1 1 15 PHE CD2 C -11.652 -7.820 2.693 1.00 . A A . 15 PHE CD2 1 1 3 808 1 1 15 PHE CE1 C -11.540 -6.855 5.275 1.00 . A A . 15 PHE CE1 1 1 3 809 1 1 15 PHE CE2 C -12.341 -8.466 3.701 1.00 . A A . 15 PHE CE2 1 1 3 810 1 1 15 PHE CG C -10.902 -6.687 2.961 1.00 . A A . 15 PHE CG 1 1 3 811 1 1 15 PHE CZ C -12.284 -7.984 4.994 1.00 . A A . 15 PHE CZ 1 1 3 812 1 1 15 PHE H H -11.889 -4.636 0.181 1.00 . A A . 15 PHE H 1 1 3 813 1 1 15 PHE HA H -10.555 -4.080 2.749 1.00 . A A . 15 PHE HA 1 1 3 814 1 1 15 PHE HB2 H -10.405 -6.469 0.930 1.00 . A A . 15 PHE HB2 1 1 3 815 1 1 15 PHE HB3 H -9.098 -6.103 2.051 1.00 . A A . 15 PHE HB3 1 1 3 816 1 1 15 PHE HD1 H -10.271 -5.329 4.483 1.00 . A A . 15 PHE HD1 1 1 3 817 1 1 15 PHE HD2 H -11.697 -8.199 1.682 1.00 . A A . 15 PHE HD2 1 1 3 818 1 1 15 PHE HE1 H -11.493 -6.474 6.285 1.00 . A A . 15 PHE HE1 1 1 3 819 1 1 15 PHE HE2 H -12.922 -9.349 3.479 1.00 . A A . 15 PHE HE2 1 1 3 820 1 1 15 PHE HZ H -12.822 -8.487 5.784 1.00 . A A . 15 PHE HZ 1 1 3 821 1 1 15 PHE N N -11.767 -4.304 1.095 1.00 . A A . 15 PHE N 1 1 3 822 1 1 15 PHE O O -9.504 -3.428 -0.173 1.00 . A A . 15 PHE O 1 1 3 823 1 1 16 PRO C C -6.333 -3.584 0.133 1.00 . A A . 16 PRO C 1 1 3 824 1 1 16 PRO CA C -7.183 -2.658 0.969 1.00 . A A . 16 PRO CA 1 1 3 825 1 1 16 PRO CB C -6.405 -2.065 2.170 1.00 . A A . 16 PRO CB 1 1 3 826 1 1 16 PRO CD C -8.055 -3.581 3.099 1.00 . A A . 16 PRO CD 1 1 3 827 1 1 16 PRO CG C -6.591 -3.128 3.273 1.00 . A A . 16 PRO CG 1 1 3 828 1 1 16 PRO HA H -7.588 -1.847 0.340 1.00 . A A . 16 PRO HA 1 1 3 829 1 1 16 PRO HB2 H -5.348 -1.843 1.952 1.00 . A A . 16 PRO HB2 1 1 3 830 1 1 16 PRO HB3 H -6.900 -1.139 2.504 1.00 . A A . 16 PRO HB3 1 1 3 831 1 1 16 PRO HD2 H -8.167 -4.604 3.481 1.00 . A A . 16 PRO HD2 1 1 3 832 1 1 16 PRO HD3 H -8.717 -2.893 3.649 1.00 . A A . 16 PRO HD3 1 1 3 833 1 1 16 PRO HG2 H -5.907 -3.971 3.077 1.00 . A A . 16 PRO HG2 1 1 3 834 1 1 16 PRO HG3 H -6.421 -2.740 4.289 1.00 . A A . 16 PRO HG3 1 1 3 835 1 1 16 PRO N N -8.233 -3.399 1.662 1.00 . A A . 16 PRO N 1 1 3 836 1 1 16 PRO O O -6.546 -4.785 0.193 1.00 . A A . 16 PRO O 1 1 3 837 1 1 17 ILE C C -3.237 -4.111 -1.081 1.00 . A A . 17 ILE C 1 1 3 838 1 1 17 ILE CA C -4.628 -3.838 -1.620 1.00 . A A . 17 ILE CA 1 1 3 839 1 1 17 ILE CB C -4.548 -3.161 -3.027 1.00 . A A . 17 ILE CB 1 1 3 840 1 1 17 ILE CD1 C -6.993 -2.207 -3.035 1.00 . A A . 17 ILE CD1 1 1 3 841 1 1 17 ILE CG1 C -5.927 -3.077 -3.754 1.00 . A A . 17 ILE CG1 1 1 3 842 1 1 17 ILE CG2 C -3.540 -3.918 -3.944 1.00 . A A . 17 ILE CG2 1 1 3 843 1 1 17 ILE H H -5.209 -2.042 -0.637 1.00 . A A . 17 ILE H 1 1 3 844 1 1 17 ILE HA H -5.122 -4.809 -1.788 1.00 . A A . 17 ILE HA 1 1 3 845 1 1 17 ILE HB H -4.171 -2.132 -2.911 1.00 . A A . 17 ILE HB 1 1 3 846 1 1 17 ILE HD11 H -7.846 -2.028 -3.709 1.00 . A A . 17 ILE HD11 1 1 3 847 1 1 17 ILE HD12 H -7.384 -2.714 -2.143 1.00 . A A . 17 ILE HD12 1 1 3 848 1 1 17 ILE HD13 H -6.572 -1.232 -2.745 1.00 . A A . 17 ILE HD13 1 1 3 849 1 1 17 ILE HG12 H -5.767 -2.623 -4.747 1.00 . A A . 17 ILE HG12 1 1 3 850 1 1 17 ILE HG13 H -6.332 -4.090 -3.910 1.00 . A A . 17 ILE HG13 1 1 3 851 1 1 17 ILE HG21 H -2.519 -3.898 -3.533 1.00 . A A . 17 ILE HG21 1 1 3 852 1 1 17 ILE HG22 H -3.850 -4.968 -4.059 1.00 . A A . 17 ILE HG22 1 1 3 853 1 1 17 ILE HG23 H -3.497 -3.457 -4.943 1.00 . A A . 17 ILE HG23 1 1 3 854 1 1 17 ILE N N -5.387 -3.028 -0.665 1.00 . A A . 17 ILE N 1 1 3 855 1 1 17 ILE O O -2.918 -5.268 -0.857 1.00 . A A . 17 ILE O 1 1 3 856 1 1 18 SER C C -0.728 -3.169 0.901 1.00 . A A . 18 SER C 1 1 3 857 1 1 18 SER CA C -0.973 -3.297 -0.582 1.00 . A A . 18 SER CA 1 1 3 858 1 1 18 SER CB C -0.145 -2.255 -1.380 1.00 . A A . 18 SER CB 1 1 3 859 1 1 18 SER H H -2.693 -2.125 -1.002 1.00 . A A . 18 SER H 1 1 3 860 1 1 18 SER HA H -0.643 -4.303 -0.893 1.00 . A A . 18 SER HA 1 1 3 861 1 1 18 SER HB2 H 0.932 -2.353 -1.177 1.00 . A A . 18 SER HB2 1 1 3 862 1 1 18 SER HB3 H -0.302 -2.423 -2.457 1.00 . A A . 18 SER HB3 1 1 3 863 1 1 18 SER HG H -0.512 -0.682 -0.183 1.00 . A A . 18 SER HG 1 1 3 864 1 1 18 SER N N -2.387 -3.073 -0.899 1.00 . A A . 18 SER N 1 1 3 865 1 1 18 SER O O -1.670 -2.846 1.608 1.00 . A A . 18 SER O 1 1 3 866 1 1 18 SER OG O -0.598 -0.921 -1.100 1.00 . A A . 18 SER OG 1 1 3 867 1 1 19 PHE C C 2.091 -2.696 3.139 1.00 . A A . 19 PHE C 1 1 3 868 1 1 19 PHE CA C 0.783 -3.383 2.821 1.00 . A A . 19 PHE CA 1 1 3 869 1 1 19 PHE CB C 0.661 -4.821 3.389 1.00 . A A . 19 PHE CB 1 1 3 870 1 1 19 PHE CD1 C -1.806 -5.443 3.193 1.00 . A A . 19 PHE CD1 1 1 3 871 1 1 19 PHE CD2 C -0.248 -6.390 1.609 1.00 . A A . 19 PHE CD2 1 1 3 872 1 1 19 PHE CE1 C -2.857 -6.105 2.552 1.00 . A A . 19 PHE CE1 1 1 3 873 1 1 19 PHE CE2 C -1.292 -7.077 0.985 1.00 . A A . 19 PHE CE2 1 1 3 874 1 1 19 PHE CG C -0.497 -5.570 2.716 1.00 . A A . 19 PHE CG 1 1 3 875 1 1 19 PHE CZ C -2.599 -6.933 1.456 1.00 . A A . 19 PHE CZ 1 1 3 876 1 1 19 PHE H H 1.268 -3.711 0.788 1.00 . A A . 19 PHE H 1 1 3 877 1 1 19 PHE HA H 0.050 -2.735 3.311 1.00 . A A . 19 PHE HA 1 1 3 878 1 1 19 PHE HB2 H 1.593 -5.349 3.163 1.00 . A A . 19 PHE HB2 1 1 3 879 1 1 19 PHE HB3 H 0.521 -4.829 4.481 1.00 . A A . 19 PHE HB3 1 1 3 880 1 1 19 PHE HD1 H -2.012 -4.829 4.063 1.00 . A A . 19 PHE HD1 1 1 3 881 1 1 19 PHE HD2 H 0.759 -6.498 1.223 1.00 . A A . 19 PHE HD2 1 1 3 882 1 1 19 PHE HE1 H -3.875 -5.978 2.905 1.00 . A A . 19 PHE HE1 1 1 3 883 1 1 19 PHE HE2 H -1.086 -7.720 0.136 1.00 . A A . 19 PHE HE2 1 1 3 884 1 1 19 PHE HZ H -3.412 -7.463 0.970 1.00 . A A . 19 PHE HZ 1 1 3 885 1 1 19 PHE N N 0.517 -3.423 1.383 1.00 . A A . 19 PHE N 1 1 3 886 1 1 19 PHE O O 2.758 -2.250 2.221 1.00 . A A . 19 PHE O 1 1 3 887 1 1 20 TYR C C 4.883 -2.290 4.357 1.00 . A A . 20 TYR C 1 1 3 888 1 1 20 TYR CA C 3.570 -1.696 4.820 1.00 . A A . 20 TYR CA 1 1 3 889 1 1 20 TYR CB C 3.561 -1.428 6.360 1.00 . A A . 20 TYR CB 1 1 3 890 1 1 20 TYR CD1 C 3.111 1.061 6.407 1.00 . A A . 20 TYR CD1 1 1 3 891 1 1 20 TYR CD2 C 5.181 0.288 7.372 1.00 . A A . 20 TYR CD2 1 1 3 892 1 1 20 TYR CE1 C 3.472 2.385 6.672 1.00 . A A . 20 TYR CE1 1 1 3 893 1 1 20 TYR CE2 C 5.539 1.611 7.649 1.00 . A A . 20 TYR CE2 1 1 3 894 1 1 20 TYR CG C 3.975 0.007 6.723 1.00 . A A . 20 TYR CG 1 1 3 895 1 1 20 TYR CZ C 4.695 2.666 7.294 1.00 . A A . 20 TYR CZ 1 1 3 896 1 1 20 TYR H H 1.915 -3.008 5.150 1.00 . A A . 20 TYR H 1 1 3 897 1 1 20 TYR HA H 3.448 -0.738 4.290 1.00 . A A . 20 TYR HA 1 1 3 898 1 1 20 TYR HB2 H 2.542 -1.513 6.764 1.00 . A A . 20 TYR HB2 1 1 3 899 1 1 20 TYR HB3 H 4.175 -2.180 6.879 1.00 . A A . 20 TYR HB3 1 1 3 900 1 1 20 TYR HD1 H 2.147 0.852 5.956 1.00 . A A . 20 TYR HD1 1 1 3 901 1 1 20 TYR HD2 H 5.846 -0.518 7.666 1.00 . A A . 20 TYR HD2 1 1 3 902 1 1 20 TYR HE1 H 2.796 3.186 6.391 1.00 . A A . 20 TYR HE1 1 1 3 903 1 1 20 TYR HE2 H 6.481 1.823 8.143 1.00 . A A . 20 TYR HE2 1 1 3 904 1 1 20 TYR HH H 4.464 4.643 7.296 1.00 . A A . 20 TYR HH 1 1 3 905 1 1 20 TYR N N 2.450 -2.560 4.436 1.00 . A A . 20 TYR N 1 1 3 906 1 1 20 TYR O O 4.871 -3.337 3.730 1.00 . A A . 20 TYR O 1 1 3 907 1 1 20 TYR OH O 5.089 3.980 7.567 1.00 . A A . 20 TYR OH 1 1 3 908 1 1 21 GLY C C 7.638 -1.955 2.850 1.00 . A A . 21 GLY C 1 1 3 909 1 1 21 GLY CA C 7.325 -2.236 4.295 1.00 . A A . 21 GLY CA 1 1 3 910 1 1 21 GLY H H 6.038 -0.749 5.090 1.00 . A A . 21 GLY H 1 1 3 911 1 1 21 GLY HA2 H 8.122 -1.799 4.918 1.00 . A A . 21 GLY HA2 1 1 3 912 1 1 21 GLY HA3 H 7.318 -3.320 4.486 1.00 . A A . 21 GLY HA3 1 1 3 913 1 1 21 GLY N N 6.036 -1.646 4.652 1.00 . A A . 21 GLY N 1 1 3 914 1 1 21 GLY O O 8.412 -2.738 2.235 1.00 . A A . 21 GLY O 1 1 3 915 1 1 21 GLY OXT O 7.121 -0.938 2.316 1.00 . A A . 21 GLY OXT 1 1 4 916 1 1 1 GLY C C 3.751 -1.331 -0.690 1.00 . A A . 1 GLY C 1 1 4 917 1 1 1 GLY CA C 3.018 -0.026 -0.496 1.00 . A A . 1 GLY CA 1 1 4 918 1 1 1 GLY H1 H 1.733 -0.880 0.953 1.00 . A A . 1 GLY H1 1 1 4 919 1 1 1 GLY HA2 H 2.304 0.140 -1.318 1.00 . A A . 1 GLY HA2 1 1 4 920 1 1 1 GLY HA3 H 3.774 0.774 -0.530 1.00 . A A . 1 GLY HA3 1 1 4 921 1 1 1 GLY N N 2.267 -0.057 0.757 1.00 . A A . 1 GLY N 1 1 4 922 1 1 1 GLY O O 3.604 -1.951 -1.733 1.00 . A A . 1 GLY O 1 1 4 923 1 1 2 GLY C C 4.381 -4.202 0.340 1.00 . A A . 2 GLY C 1 1 4 924 1 1 2 GLY CA C 5.294 -3.010 0.184 1.00 . A A . 2 GLY CA 1 1 4 925 1 1 2 GLY H H 4.640 -1.233 1.165 1.00 . A A . 2 GLY H 1 1 4 926 1 1 2 GLY HA2 H 5.788 -3.064 -0.799 1.00 . A A . 2 GLY HA2 1 1 4 927 1 1 2 GLY HA3 H 6.079 -3.057 0.955 1.00 . A A . 2 GLY HA3 1 1 4 928 1 1 2 GLY N N 4.555 -1.756 0.312 1.00 . A A . 2 GLY N 1 1 4 929 1 1 2 GLY O O 3.177 -4.045 0.211 1.00 . A A . 2 GLY O 1 1 4 930 1 1 3 ALA C C 4.180 -6.976 2.291 1.00 . A A . 3 ALA C 1 1 4 931 1 1 3 ALA CA C 4.135 -6.600 0.827 1.00 . A A . 3 ALA CA 1 1 4 932 1 1 3 ALA CB C 4.659 -7.741 -0.084 1.00 . A A . 3 ALA CB 1 1 4 933 1 1 3 ALA H H 5.943 -5.493 0.710 1.00 . A A . 3 ALA H 1 1 4 934 1 1 3 ALA HA H 3.076 -6.436 0.569 1.00 . A A . 3 ALA HA 1 1 4 935 1 1 3 ALA HB1 H 4.636 -7.415 -1.136 1.00 . A A . 3 ALA HB1 1 1 4 936 1 1 3 ALA HB2 H 5.697 -7.993 0.183 1.00 . A A . 3 ALA HB2 1 1 4 937 1 1 3 ALA HB3 H 4.037 -8.644 0.019 1.00 . A A . 3 ALA HB3 1 1 4 938 1 1 3 ALA N N 4.949 -5.403 0.614 1.00 . A A . 3 ALA N 1 1 4 939 1 1 3 ALA O O 4.322 -8.147 2.608 1.00 . A A . 3 ALA O 1 1 4 940 1 1 4 GLY C C 2.781 -6.833 5.134 1.00 . A A . 4 GLY C 1 1 4 941 1 1 4 GLY CA C 4.096 -6.273 4.631 1.00 . A A . 4 GLY CA 1 1 4 942 1 1 4 GLY H H 3.939 -5.028 2.919 1.00 . A A . 4 GLY H 1 1 4 943 1 1 4 GLY HA2 H 4.886 -7.009 4.851 1.00 . A A . 4 GLY HA2 1 1 4 944 1 1 4 GLY HA3 H 4.359 -5.349 5.172 1.00 . A A . 4 GLY HA3 1 1 4 945 1 1 4 GLY N N 4.060 -5.982 3.201 1.00 . A A . 4 GLY N 1 1 4 946 1 1 4 GLY O O 2.117 -7.531 4.383 1.00 . A A . 4 GLY O 1 1 4 947 1 1 5 HIS C C 0.216 -6.110 7.386 1.00 . A A . 5 HIS C 1 1 4 948 1 1 5 HIS CA C 1.281 -7.158 7.078 1.00 . A A . 5 HIS CA 1 1 4 949 1 1 5 HIS CB C 1.718 -7.851 8.369 1.00 . A A . 5 HIS CB 1 1 4 950 1 1 5 HIS CD2 C 2.280 -10.072 7.153 1.00 . A A . 5 HIS CD2 1 1 4 951 1 1 5 HIS CE1 C 3.817 -10.812 8.531 1.00 . A A . 5 HIS CE1 1 1 4 952 1 1 5 HIS CG C 2.417 -9.156 8.140 1.00 . A A . 5 HIS CG 1 1 4 953 1 1 5 HIS H H 3.038 -5.985 6.934 1.00 . A A . 5 HIS H 1 1 4 954 1 1 5 HIS HA H 0.862 -7.893 6.409 1.00 . A A . 5 HIS HA 1 1 4 955 1 1 5 HIS HB2 H 2.395 -7.203 8.906 1.00 . A A . 5 HIS HB2 1 1 4 956 1 1 5 HIS HB3 H 0.848 -8.042 8.980 1.00 . A A . 5 HIS HB3 1 1 4 957 1 1 5 HIS HD1 H 3.711 -9.212 9.802 1.00 . A A . 5 HIS HD1 1 1 4 958 1 1 5 HIS HD2 H 1.604 -10.014 6.312 1.00 . A A . 5 HIS HD2 1 1 4 959 1 1 5 HIS HE1 H 4.575 -11.429 8.989 1.00 . A A . 5 HIS HE1 1 1 4 960 1 1 5 HIS N N 2.430 -6.551 6.415 1.00 . A A . 5 HIS N 1 1 4 961 1 1 5 HIS ND1 N 3.386 -9.650 8.988 1.00 . A A . 5 HIS ND1 1 1 4 962 1 1 5 HIS NE2 N 3.161 -11.092 7.419 1.00 . A A . 5 HIS NE2 1 1 4 963 1 1 5 HIS O O -0.953 -6.439 7.589 1.00 . A A . 5 HIS O 1 1 4 964 1 1 6 VAL C C -0.740 -2.941 6.735 1.00 . A A . 6 VAL C 1 1 4 965 1 1 6 VAL CA C -0.390 -3.778 7.946 1.00 . A A . 6 VAL CA 1 1 4 966 1 1 6 VAL CB C 0.285 -2.912 9.055 1.00 . A A . 6 VAL CB 1 1 4 967 1 1 6 VAL CG1 C -0.650 -1.792 9.589 1.00 . A A . 6 VAL CG1 1 1 4 968 1 1 6 VAL CG2 C 0.761 -3.814 10.230 1.00 . A A . 6 VAL CG2 1 1 4 969 1 1 6 VAL H H 1.476 -4.456 7.282 1.00 . A A . 6 VAL H 1 1 4 970 1 1 6 VAL HA H -1.279 -4.240 8.400 1.00 . A A . 6 VAL HA 1 1 4 971 1 1 6 VAL HB H 1.173 -2.418 8.626 1.00 . A A . 6 VAL HB 1 1 4 972 1 1 6 VAL HG11 H -1.514 -2.229 10.113 1.00 . A A . 6 VAL HG11 1 1 4 973 1 1 6 VAL HG12 H -0.105 -1.154 10.303 1.00 . A A . 6 VAL HG12 1 1 4 974 1 1 6 VAL HG13 H -1.009 -1.154 8.767 1.00 . A A . 6 VAL HG13 1 1 4 975 1 1 6 VAL HG21 H 1.486 -4.567 9.884 1.00 . A A . 6 VAL HG21 1 1 4 976 1 1 6 VAL HG22 H 1.249 -3.203 11.006 1.00 . A A . 6 VAL HG22 1 1 4 977 1 1 6 VAL HG23 H -0.095 -4.337 10.683 1.00 . A A . 6 VAL HG23 1 1 4 978 1 1 6 VAL N N 0.563 -4.798 7.490 1.00 . A A . 6 VAL N 1 1 4 979 1 1 6 VAL O O 0.194 -2.630 6.014 1.00 . A A . 6 VAL O 1 1 4 980 1 1 7 PRO C C -1.694 -0.425 5.228 1.00 . A A . 7 PRO C 1 1 4 981 1 1 7 PRO CA C -2.250 -1.829 5.191 1.00 . A A . 7 PRO CA 1 1 4 982 1 1 7 PRO CB C -3.791 -1.868 5.133 1.00 . A A . 7 PRO CB 1 1 4 983 1 1 7 PRO CD C -3.164 -2.883 7.245 1.00 . A A . 7 PRO CD 1 1 4 984 1 1 7 PRO CG C -4.200 -1.921 6.620 1.00 . A A . 7 PRO CG 1 1 4 985 1 1 7 PRO HA H -1.864 -2.391 4.334 1.00 . A A . 7 PRO HA 1 1 4 986 1 1 7 PRO HB2 H -4.235 -1.026 4.577 1.00 . A A . 7 PRO HB2 1 1 4 987 1 1 7 PRO HB3 H -4.087 -2.817 4.658 1.00 . A A . 7 PRO HB3 1 1 4 988 1 1 7 PRO HD2 H -3.061 -2.681 8.320 1.00 . A A . 7 PRO HD2 1 1 4 989 1 1 7 PRO HD3 H -3.449 -3.935 7.079 1.00 . A A . 7 PRO HD3 1 1 4 990 1 1 7 PRO HG2 H -4.071 -0.916 7.051 1.00 . A A . 7 PRO HG2 1 1 4 991 1 1 7 PRO HG3 H -5.238 -2.254 6.775 1.00 . A A . 7 PRO HG3 1 1 4 992 1 1 7 PRO N N -2.004 -2.552 6.429 1.00 . A A . 7 PRO N 1 1 4 993 1 1 7 PRO O O -1.658 0.168 6.294 1.00 . A A . 7 PRO O 1 1 4 994 1 1 8 GLU C C -1.924 2.444 3.955 1.00 . A A . 8 GLU C 1 1 4 995 1 1 8 GLU CA C -0.758 1.483 4.006 1.00 . A A . 8 GLU CA 1 1 4 996 1 1 8 GLU CB C 0.140 1.697 2.755 1.00 . A A . 8 GLU CB 1 1 4 997 1 1 8 GLU CD C 2.268 1.001 1.604 1.00 . A A . 8 GLU CD 1 1 4 998 1 1 8 GLU CG C 1.472 0.916 2.885 1.00 . A A . 8 GLU CG 1 1 4 999 1 1 8 GLU H H -1.315 -0.412 3.207 1.00 . A A . 8 GLU H 1 1 4 1000 1 1 8 GLU HA H -0.152 1.702 4.902 1.00 . A A . 8 GLU HA 1 1 4 1001 1 1 8 GLU HB2 H -0.393 1.366 1.849 1.00 . A A . 8 GLU HB2 1 1 4 1002 1 1 8 GLU HB3 H 0.367 2.770 2.642 1.00 . A A . 8 GLU HB3 1 1 4 1003 1 1 8 GLU HG2 H 2.078 1.352 3.695 1.00 . A A . 8 GLU HG2 1 1 4 1004 1 1 8 GLU HG3 H 1.256 -0.129 3.153 1.00 . A A . 8 GLU HG3 1 1 4 1005 1 1 8 GLU N N -1.259 0.109 4.062 1.00 . A A . 8 GLU N 1 1 4 1006 1 1 8 GLU O O -1.869 3.464 4.624 1.00 . A A . 8 GLU O 1 1 4 1007 1 1 8 GLU OE1 O 2.884 2.032 1.382 1.00 . A A . 8 GLU OE1 1 1 4 1008 1 1 9 TYR C C -5.392 2.273 2.928 1.00 . A A . 9 TYR C 1 1 4 1009 1 1 9 TYR CA C -4.105 3.057 3.013 1.00 . A A . 9 TYR CA 1 1 4 1010 1 1 9 TYR CB C -3.864 3.907 1.737 1.00 . A A . 9 TYR CB 1 1 4 1011 1 1 9 TYR CD1 C -4.530 2.283 -0.115 1.00 . A A . 9 TYR CD1 1 1 4 1012 1 1 9 TYR CD2 C -2.199 2.868 0.113 1.00 . A A . 9 TYR CD2 1 1 4 1013 1 1 9 TYR CE1 C -4.213 1.429 -1.176 1.00 . A A . 9 TYR CE1 1 1 4 1014 1 1 9 TYR CE2 C -1.884 2.030 -0.960 1.00 . A A . 9 TYR CE2 1 1 4 1015 1 1 9 TYR CG C -3.524 2.997 0.547 1.00 . A A . 9 TYR CG 1 1 4 1016 1 1 9 TYR CZ C -2.888 1.310 -1.613 1.00 . A A . 9 TYR CZ 1 1 4 1017 1 1 9 TYR H H -2.994 1.295 2.619 1.00 . A A . 9 TYR H 1 1 4 1018 1 1 9 TYR HA H -4.206 3.720 3.888 1.00 . A A . 9 TYR HA 1 1 4 1019 1 1 9 TYR HB2 H -4.742 4.521 1.484 1.00 . A A . 9 TYR HB2 1 1 4 1020 1 1 9 TYR HB3 H -3.028 4.598 1.933 1.00 . A A . 9 TYR HB3 1 1 4 1021 1 1 9 TYR HD1 H -5.566 2.388 0.193 1.00 . A A . 9 TYR HD1 1 1 4 1022 1 1 9 TYR HD2 H -1.404 3.418 0.607 1.00 . A A . 9 TYR HD2 1 1 4 1023 1 1 9 TYR HE1 H -5.002 0.861 -1.659 1.00 . A A . 9 TYR HE1 1 1 4 1024 1 1 9 TYR HE2 H -0.854 1.940 -1.290 1.00 . A A . 9 TYR HE2 1 1 4 1025 1 1 9 TYR HH H -3.274 0.326 -3.284 1.00 . A A . 9 TYR HH 1 1 4 1026 1 1 9 TYR N N -2.977 2.137 3.162 1.00 . A A . 9 TYR N 1 1 4 1027 1 1 9 TYR O O -5.320 1.054 2.891 1.00 . A A . 9 TYR O 1 1 4 1028 1 1 9 TYR OH O -2.549 0.486 -2.690 1.00 . A A . 9 TYR OH 1 1 4 1029 1 1 10 PHE C C -8.723 2.895 1.786 1.00 . A A . 10 PHE C 1 1 4 1030 1 1 10 PHE CA C -7.846 2.261 2.844 1.00 . A A . 10 PHE CA 1 1 4 1031 1 1 10 PHE CB C -8.570 2.390 4.207 1.00 . A A . 10 PHE CB 1 1 4 1032 1 1 10 PHE CD1 C -6.721 2.569 5.947 1.00 . A A . 10 PHE CD1 1 1 4 1033 1 1 10 PHE CD2 C -7.912 0.474 5.751 1.00 . A A . 10 PHE CD2 1 1 4 1034 1 1 10 PHE CE1 C -5.996 2.057 7.028 1.00 . A A . 10 PHE CE1 1 1 4 1035 1 1 10 PHE CE2 C -7.215 -0.025 6.855 1.00 . A A . 10 PHE CE2 1 1 4 1036 1 1 10 PHE CG C -7.709 1.794 5.329 1.00 . A A . 10 PHE CG 1 1 4 1037 1 1 10 PHE CZ C -6.269 0.773 7.505 1.00 . A A . 10 PHE CZ 1 1 4 1038 1 1 10 PHE H H -6.586 3.959 2.952 1.00 . A A . 10 PHE H 1 1 4 1039 1 1 10 PHE HA H -7.710 1.188 2.636 1.00 . A A . 10 PHE HA 1 1 4 1040 1 1 10 PHE HB2 H -8.761 3.452 4.430 1.00 . A A . 10 PHE HB2 1 1 4 1041 1 1 10 PHE HB3 H -9.546 1.878 4.162 1.00 . A A . 10 PHE HB3 1 1 4 1042 1 1 10 PHE HD1 H -6.513 3.574 5.595 1.00 . A A . 10 PHE HD1 1 1 4 1043 1 1 10 PHE HD2 H -8.614 -0.166 5.226 1.00 . A A . 10 PHE HD2 1 1 4 1044 1 1 10 PHE HE1 H -5.224 2.659 7.498 1.00 . A A . 10 PHE HE1 1 1 4 1045 1 1 10 PHE HE2 H -7.413 -1.032 7.209 1.00 . A A . 10 PHE HE2 1 1 4 1046 1 1 10 PHE HZ H -5.749 0.397 8.381 1.00 . A A . 10 PHE HZ 1 1 4 1047 1 1 10 PHE N N -6.563 2.958 2.900 1.00 . A A . 10 PHE N 1 1 4 1048 1 1 10 PHE O O -8.754 4.115 1.746 1.00 . A A . 10 PHE O 1 1 4 1049 1 1 11 VAL C C -11.809 2.493 0.447 1.00 . A A . 11 VAL C 1 1 4 1050 1 1 11 VAL CA C -10.368 2.644 -0.026 1.00 . A A . 11 VAL CA 1 1 4 1051 1 1 11 VAL CB C -10.214 1.958 -1.396 1.00 . A A . 11 VAL CB 1 1 4 1052 1 1 11 VAL CG1 C -11.060 2.663 -2.445 1.00 . A A . 11 VAL CG1 1 1 4 1053 1 1 11 VAL CG2 C -8.751 1.925 -1.814 1.00 . A A . 11 VAL CG2 1 1 4 1054 1 1 11 VAL H H -9.337 1.124 1.026 1.00 . A A . 11 VAL H 1 1 4 1055 1 1 11 VAL HA H -10.147 3.695 -0.146 1.00 . A A . 11 VAL HA 1 1 4 1056 1 1 11 VAL HB H -10.564 0.940 -1.308 1.00 . A A . 11 VAL HB 1 1 4 1057 1 1 11 VAL HG11 H -10.669 2.446 -3.428 1.00 . A A . 11 VAL HG11 1 1 4 1058 1 1 11 VAL HG12 H -12.081 2.317 -2.377 1.00 . A A . 11 VAL HG12 1 1 4 1059 1 1 11 VAL HG13 H -11.030 3.729 -2.274 1.00 . A A . 11 VAL HG13 1 1 4 1060 1 1 11 VAL HG21 H -8.671 1.513 -2.809 1.00 . A A . 11 VAL HG21 1 1 4 1061 1 1 11 VAL HG22 H -8.351 2.928 -1.806 1.00 . A A . 11 VAL HG22 1 1 4 1062 1 1 11 VAL HG23 H -8.193 1.310 -1.123 1.00 . A A . 11 VAL HG23 1 1 4 1063 1 1 11 VAL N N -9.434 2.096 0.950 1.00 . A A . 11 VAL N 1 1 4 1064 1 1 11 VAL O O -12.093 1.733 1.373 1.00 . A A . 11 VAL O 1 1 4 1065 1 1 12 ARG C C -14.780 1.900 -0.384 1.00 . A A . 12 ARG C 1 1 4 1066 1 1 12 ARG CA C -14.129 3.169 0.160 1.00 . A A . 12 ARG CA 1 1 4 1067 1 1 12 ARG CB C -14.859 4.401 -0.380 1.00 . A A . 12 ARG CB 1 1 4 1068 1 1 12 ARG CD C -14.949 6.909 -0.513 1.00 . A A . 12 ARG CD 1 1 4 1069 1 1 12 ARG CG C -14.373 5.709 0.223 1.00 . A A . 12 ARG CG 1 1 4 1070 1 1 12 ARG CZ C -17.077 8.137 -0.606 1.00 . A A . 12 ARG CZ 1 1 4 1071 1 1 12 ARG H H -12.429 3.809 -0.926 1.00 . A A . 12 ARG H 1 1 4 1072 1 1 12 ARG HA H -14.201 3.162 1.237 1.00 . A A . 12 ARG HA 1 1 4 1073 1 1 12 ARG HB2 H -14.718 4.449 -1.450 1.00 . A A . 12 ARG HB2 1 1 4 1074 1 1 12 ARG HB3 H -15.913 4.301 -0.168 1.00 . A A . 12 ARG HB3 1 1 4 1075 1 1 12 ARG HD2 H -14.267 7.739 -0.409 1.00 . A A . 12 ARG HD2 1 1 4 1076 1 1 12 ARG HD3 H -15.054 6.657 -1.557 1.00 . A A . 12 ARG HD3 1 1 4 1077 1 1 12 ARG HE H -16.529 6.918 0.874 1.00 . A A . 12 ARG HE 1 1 4 1078 1 1 12 ARG HG2 H -14.680 5.754 1.257 1.00 . A A . 12 ARG HG2 1 1 4 1079 1 1 12 ARG HG3 H -13.296 5.744 0.163 1.00 . A A . 12 ARG HG3 1 1 4 1080 1 1 12 ARG HH11 H -15.851 8.438 -2.184 1.00 . A A . 12 ARG HH11 1 1 4 1081 1 1 12 ARG HH12 H -17.354 9.298 -2.237 1.00 . A A . 12 ARG HH12 1 1 4 1082 1 1 12 ARG HH21 H -18.511 8.045 0.815 1.00 . A A . 12 ARG HH21 1 1 4 1083 1 1 12 ARG HH22 H -18.866 9.074 -0.531 1.00 . A A . 12 ARG HH22 1 1 4 1084 1 1 12 ARG N N -12.716 3.221 -0.196 1.00 . A A . 12 ARG N 1 1 4 1085 1 1 12 ARG NE N -16.254 7.299 0.015 1.00 . A A . 12 ARG NE 1 1 4 1086 1 1 12 ARG NH1 N -16.732 8.668 -1.771 1.00 . A A . 12 ARG NH1 1 1 4 1087 1 1 12 ARG NH2 N -18.248 8.444 -0.063 1.00 . A A . 12 ARG NH2 1 1 4 1088 1 1 12 ARG O O -15.973 1.881 -0.682 1.00 . A A . 12 ARG O 1 1 4 1089 1 1 13 GLY C C -14.712 -1.442 0.076 1.00 . A A . 13 GLY C 1 1 4 1090 1 1 13 GLY CA C -14.501 -0.416 -1.020 1.00 . A A . 13 GLY CA 1 1 4 1091 1 1 13 GLY H H -13.042 0.915 -0.258 1.00 . A A . 13 GLY H 1 1 4 1092 1 1 13 GLY HA2 H -15.444 -0.233 -1.513 1.00 . A A . 13 GLY HA2 1 1 4 1093 1 1 13 GLY HA3 H -13.801 -0.814 -1.740 1.00 . A A . 13 GLY HA3 1 1 4 1094 1 1 13 GLY N N -13.986 0.842 -0.511 1.00 . A A . 13 GLY N 1 1 4 1095 1 1 13 GLY O O -15.547 -1.253 0.961 1.00 . A A . 13 GLY O 1 1 4 1096 1 1 14 ASP C C -12.763 -3.730 1.802 1.00 . A A . 14 ASP C 1 1 4 1097 1 1 14 ASP CA C -14.061 -3.592 1.013 1.00 . A A . 14 ASP CA 1 1 4 1098 1 1 14 ASP CB C -14.407 -4.920 0.338 1.00 . A A . 14 ASP CB 1 1 4 1099 1 1 14 ASP CG C -14.459 -6.073 1.322 1.00 . A A . 14 ASP CG 1 1 4 1100 1 1 14 ASP H H -13.306 -2.624 -0.712 1.00 . A A . 14 ASP H 1 1 4 1101 1 1 14 ASP HA H -14.856 -3.328 1.694 1.00 . A A . 14 ASP HA 1 1 4 1102 1 1 14 ASP HB2 H -15.372 -4.834 -0.139 1.00 . A A . 14 ASP HB2 1 1 4 1103 1 1 14 ASP HB3 H -13.659 -5.142 -0.410 1.00 . A A . 14 ASP HB3 1 1 4 1104 1 1 14 ASP N N -13.954 -2.531 0.017 1.00 . A A . 14 ASP N 1 1 4 1105 1 1 14 ASP O O -12.676 -3.304 2.954 1.00 . A A . 14 ASP O 1 1 4 1106 1 1 14 ASP OD1 O -14.959 -5.869 2.447 1.00 . A A . 14 ASP OD1 1 1 4 1107 1 1 14 ASP OD2 O -14.000 -7.178 0.966 1.00 . A A . 14 ASP OD2 1 1 4 1108 1 1 15 PHE C C -9.364 -3.778 1.072 1.00 . A A . 15 PHE C 1 1 4 1109 1 1 15 PHE CA C -10.463 -4.527 1.819 1.00 . A A . 15 PHE CA 1 1 4 1110 1 1 15 PHE CB C -10.125 -6.017 1.887 1.00 . A A . 15 PHE CB 1 1 4 1111 1 1 15 PHE CD1 C -10.808 -6.302 4.284 1.00 . A A . 15 PHE CD1 1 1 4 1112 1 1 15 PHE CD2 C -11.597 -7.886 2.686 1.00 . A A . 15 PHE CD2 1 1 4 1113 1 1 15 PHE CE1 C -11.482 -6.974 5.287 1.00 . A A . 15 PHE CE1 1 1 4 1114 1 1 15 PHE CE2 C -12.274 -8.561 3.684 1.00 . A A . 15 PHE CE2 1 1 4 1115 1 1 15 PHE CG C -10.858 -6.750 2.974 1.00 . A A . 15 PHE CG 1 1 4 1116 1 1 15 PHE CZ C -12.215 -8.105 4.987 1.00 . A A . 15 PHE CZ 1 1 4 1117 1 1 15 PHE H H -11.887 -4.648 0.257 1.00 . A A . 15 PHE H 1 1 4 1118 1 1 15 PHE HA H -10.531 -4.136 2.822 1.00 . A A . 15 PHE HA 1 1 4 1119 1 1 15 PHE HB2 H -10.380 -6.480 0.946 1.00 . A A . 15 PHE HB2 1 1 4 1120 1 1 15 PHE HB3 H -9.066 -6.131 2.064 1.00 . A A . 15 PHE HB3 1 1 4 1121 1 1 15 PHE HD1 H -10.235 -5.417 4.521 1.00 . A A . 15 PHE HD1 1 1 4 1122 1 1 15 PHE HD2 H -11.643 -8.244 1.668 1.00 . A A . 15 PHE HD2 1 1 4 1123 1 1 15 PHE HE1 H -11.434 -6.614 6.305 1.00 . A A . 15 PHE HE1 1 1 4 1124 1 1 15 PHE HE2 H -12.846 -9.445 3.447 1.00 . A A . 15 PHE HE2 1 1 4 1125 1 1 15 PHE HZ H -12.743 -8.631 5.768 1.00 . A A . 15 PHE HZ 1 1 4 1126 1 1 15 PHE N N -11.757 -4.330 1.175 1.00 . A A . 15 PHE N 1 1 4 1127 1 1 15 PHE O O -9.512 -3.405 -0.092 1.00 . A A . 15 PHE O 1 1 4 1128 1 1 16 PRO C C -6.343 -3.524 0.173 1.00 . A A . 16 PRO C 1 1 4 1129 1 1 16 PRO CA C -7.192 -2.638 1.052 1.00 . A A . 16 PRO CA 1 1 4 1130 1 1 16 PRO CB C -6.405 -2.076 2.262 1.00 . A A . 16 PRO CB 1 1 4 1131 1 1 16 PRO CD C -8.033 -3.631 3.164 1.00 . A A . 16 PRO CD 1 1 4 1132 1 1 16 PRO CG C -6.571 -3.172 3.336 1.00 . A A . 16 PRO CG 1 1 4 1133 1 1 16 PRO HA H -7.614 -1.810 0.457 1.00 . A A . 16 PRO HA 1 1 4 1134 1 1 16 PRO HB2 H -5.351 -1.842 2.040 1.00 . A A . 16 PRO HB2 1 1 4 1135 1 1 16 PRO HB3 H -6.901 -1.164 2.631 1.00 . A A . 16 PRO HB3 1 1 4 1136 1 1 16 PRO HD2 H -8.135 -4.664 3.521 1.00 . A A . 16 PRO HD2 1 1 4 1137 1 1 16 PRO HD3 H -8.695 -2.960 3.737 1.00 . A A . 16 PRO HD3 1 1 4 1138 1 1 16 PRO HG2 H -5.883 -4.004 3.109 1.00 . A A . 16 PRO HG2 1 1 4 1139 1 1 16 PRO HG3 H -6.396 -2.813 4.362 1.00 . A A . 16 PRO HG3 1 1 4 1140 1 1 16 PRO N N -8.226 -3.413 1.734 1.00 . A A . 16 PRO N 1 1 4 1141 1 1 16 PRO O O -6.533 -4.730 0.202 1.00 . A A . 16 PRO O 1 1 4 1142 1 1 17 ILE C C -3.274 -3.962 -1.123 1.00 . A A . 17 ILE C 1 1 4 1143 1 1 17 ILE CA C -4.677 -3.688 -1.626 1.00 . A A . 17 ILE CA 1 1 4 1144 1 1 17 ILE CB C -4.639 -2.957 -3.007 1.00 . A A . 17 ILE CB 1 1 4 1145 1 1 17 ILE CD1 C -7.119 -2.102 -2.933 1.00 . A A . 17 ILE CD1 1 1 4 1146 1 1 17 ILE CG1 C -6.031 -2.890 -3.711 1.00 . A A . 17 ILE CG1 1 1 4 1147 1 1 17 ILE CG2 C -3.621 -3.645 -3.967 1.00 . A A . 17 ILE CG2 1 1 4 1148 1 1 17 ILE H H -5.266 -1.936 -0.569 1.00 . A A . 17 ILE H 1 1 4 1149 1 1 17 ILE HA H -5.164 -4.658 -1.822 1.00 . A A . 17 ILE HA 1 1 4 1150 1 1 17 ILE HB H -4.294 -1.922 -2.855 1.00 . A A . 17 ILE HB 1 1 4 1151 1 1 17 ILE HD11 H -7.471 -2.669 -2.062 1.00 . A A . 17 ILE HD11 1 1 4 1152 1 1 17 ILE HD12 H -6.734 -1.125 -2.602 1.00 . A A . 17 ILE HD12 1 1 4 1153 1 1 17 ILE HD13 H -7.991 -1.927 -3.584 1.00 . A A . 17 ILE HD13 1 1 4 1154 1 1 17 ILE HG12 H -5.903 -2.382 -4.682 1.00 . A A . 17 ILE HG12 1 1 4 1155 1 1 17 ILE HG13 H -6.399 -3.909 -3.913 1.00 . A A . 17 ILE HG13 1 1 4 1156 1 1 17 ILE HG21 H -3.613 -3.148 -4.950 1.00 . A A . 17 ILE HG21 1 1 4 1157 1 1 17 ILE HG22 H -2.595 -3.600 -3.573 1.00 . A A . 17 ILE HG22 1 1 4 1158 1 1 17 ILE HG23 H -3.894 -4.701 -4.114 1.00 . A A . 17 ILE HG23 1 1 4 1159 1 1 17 ILE N N -5.427 -2.924 -0.627 1.00 . A A . 17 ILE N 1 1 4 1160 1 1 17 ILE O O -2.938 -5.121 -0.944 1.00 . A A . 17 ILE O 1 1 4 1161 1 1 18 SER C C -0.760 -3.132 0.856 1.00 . A A . 18 SER C 1 1 4 1162 1 1 18 SER CA C -1.011 -3.147 -0.632 1.00 . A A . 18 SER CA 1 1 4 1163 1 1 18 SER CB C -0.196 -2.038 -1.351 1.00 . A A . 18 SER CB 1 1 4 1164 1 1 18 SER H H -2.747 -1.973 -0.991 1.00 . A A . 18 SER H 1 1 4 1165 1 1 18 SER HA H -0.669 -4.121 -1.023 1.00 . A A . 18 SER HA 1 1 4 1166 1 1 18 SER HB2 H 0.884 -2.151 -1.171 1.00 . A A . 18 SER HB2 1 1 4 1167 1 1 18 SER HB3 H -0.368 -2.116 -2.438 1.00 . A A . 18 SER HB3 1 1 4 1168 1 1 18 SER HG H -0.538 -0.576 -0.018 1.00 . A A . 18 SER HG 1 1 4 1169 1 1 18 SER N N -2.430 -2.921 -0.924 1.00 . A A . 18 SER N 1 1 4 1170 1 1 18 SER O O -1.698 -2.871 1.593 1.00 . A A . 18 SER O 1 1 4 1171 1 1 18 SER OG O -0.646 -0.735 -0.949 1.00 . A A . 18 SER OG 1 1 4 1172 1 1 19 PHE C C 2.078 -2.782 3.073 1.00 . A A . 19 PHE C 1 1 4 1173 1 1 19 PHE CA C 0.779 -3.477 2.738 1.00 . A A . 19 PHE CA 1 1 4 1174 1 1 19 PHE CB C 0.703 -4.957 3.190 1.00 . A A . 19 PHE CB 1 1 4 1175 1 1 19 PHE CD1 C -1.795 -5.460 3.236 1.00 . A A . 19 PHE CD1 1 1 4 1176 1 1 19 PHE CD2 C -0.475 -6.348 1.414 1.00 . A A . 19 PHE CD2 1 1 4 1177 1 1 19 PHE CE1 C -2.947 -6.021 2.672 1.00 . A A . 19 PHE CE1 1 1 4 1178 1 1 19 PHE CE2 C -1.619 -6.934 0.867 1.00 . A A . 19 PHE CE2 1 1 4 1179 1 1 19 PHE CG C -0.556 -5.608 2.600 1.00 . A A . 19 PHE CG 1 1 4 1180 1 1 19 PHE CZ C -2.858 -6.762 1.489 1.00 . A A . 19 PHE CZ 1 1 4 1181 1 1 19 PHE H H 1.239 -3.655 0.681 1.00 . A A . 19 PHE H 1 1 4 1182 1 1 19 PHE HA H 0.035 -2.898 3.294 1.00 . A A . 19 PHE HA 1 1 4 1183 1 1 19 PHE HB2 H 1.585 -5.485 2.807 1.00 . A A . 19 PHE HB2 1 1 4 1184 1 1 19 PHE HB3 H 0.686 -5.055 4.288 1.00 . A A . 19 PHE HB3 1 1 4 1185 1 1 19 PHE HD1 H -1.868 -4.909 4.168 1.00 . A A . 19 PHE HD1 1 1 4 1186 1 1 19 PHE HD2 H 0.479 -6.471 0.908 1.00 . A A . 19 PHE HD2 1 1 4 1187 1 1 19 PHE HE1 H -3.910 -5.881 3.153 1.00 . A A . 19 PHE HE1 1 1 4 1188 1 1 19 PHE HE2 H -1.544 -7.520 -0.045 1.00 . A A . 19 PHE HE2 1 1 4 1189 1 1 19 PHE HZ H -3.751 -7.203 1.054 1.00 . A A . 19 PHE HZ 1 1 4 1190 1 1 19 PHE N N 0.491 -3.416 1.304 1.00 . A A . 19 PHE N 1 1 4 1191 1 1 19 PHE O O 2.720 -2.275 2.169 1.00 . A A . 19 PHE O 1 1 4 1192 1 1 20 TYR C C 4.886 -2.382 4.182 1.00 . A A . 20 TYR C 1 1 4 1193 1 1 20 TYR CA C 3.591 -1.856 4.758 1.00 . A A . 20 TYR CA 1 1 4 1194 1 1 20 TYR CB C 3.672 -1.676 6.308 1.00 . A A . 20 TYR CB 1 1 4 1195 1 1 20 TYR CD1 C 3.050 0.769 6.494 1.00 . A A . 20 TYR CD1 1 1 4 1196 1 1 20 TYR CD2 C 5.225 0.109 7.299 1.00 . A A . 20 TYR CD2 1 1 4 1197 1 1 20 TYR CE1 C 3.335 2.104 6.796 1.00 . A A . 20 TYR CE1 1 1 4 1198 1 1 20 TYR CE2 C 5.507 1.441 7.615 1.00 . A A . 20 TYR CE2 1 1 4 1199 1 1 20 TYR CG C 4.002 -0.232 6.712 1.00 . A A . 20 TYR CG 1 1 4 1200 1 1 20 TYR CZ C 4.571 2.446 7.357 1.00 . A A . 20 TYR CZ 1 1 4 1201 1 1 20 TYR H H 1.947 -3.194 5.073 1.00 . A A . 20 TYR H 1 1 4 1202 1 1 20 TYR HA H 3.422 -0.869 4.301 1.00 . A A . 20 TYR HA 1 1 4 1203 1 1 20 TYR HB2 H 2.695 -1.863 6.775 1.00 . A A . 20 TYR HB2 1 1 4 1204 1 1 20 TYR HB3 H 4.378 -2.402 6.740 1.00 . A A . 20 TYR HB3 1 1 4 1205 1 1 20 TYR HD1 H 2.076 0.512 6.088 1.00 . A A . 20 TYR HD1 1 1 4 1206 1 1 20 TYR HD2 H 5.962 -0.658 7.513 1.00 . A A . 20 TYR HD2 1 1 4 1207 1 1 20 TYR HE1 H 2.589 2.866 6.592 1.00 . A A . 20 TYR HE1 1 1 4 1208 1 1 20 TYR HE2 H 6.460 1.700 8.063 1.00 . A A . 20 TYR HE2 1 1 4 1209 1 1 20 TYR HH H 4.209 4.400 7.450 1.00 . A A . 20 TYR HH 1 1 4 1210 1 1 20 TYR N N 2.465 -2.711 4.368 1.00 . A A . 20 TYR N 1 1 4 1211 1 1 20 TYR O O 4.867 -3.414 3.531 1.00 . A A . 20 TYR O 1 1 4 1212 1 1 20 TYR OH O 4.890 3.772 7.665 1.00 . A A . 20 TYR OH 1 1 4 1213 1 1 21 GLY C C 7.634 -1.432 2.610 1.00 . A A . 21 GLY C 1 1 4 1214 1 1 21 GLY CA C 7.311 -2.146 3.894 1.00 . A A . 21 GLY CA 1 1 4 1215 1 1 21 GLY H H 6.003 -0.808 4.893 1.00 . A A . 21 GLY H 1 1 4 1216 1 1 21 GLY HA2 H 8.109 -1.932 4.624 1.00 . A A . 21 GLY HA2 1 1 4 1217 1 1 21 GLY HA3 H 7.314 -3.231 3.713 1.00 . A A . 21 GLY HA3 1 1 4 1218 1 1 21 GLY N N 6.023 -1.683 4.410 1.00 . A A . 21 GLY N 1 1 4 1219 1 1 21 GLY O O 8.758 -1.640 2.079 1.00 . A A . 21 GLY O 1 1 4 1220 1 1 21 GLY OXT O 6.767 -0.659 2.119 1.00 . A A . 21 GLY OXT 1 1 5 1221 1 1 1 GLY C C 3.430 -0.888 -0.831 1.00 . A A . 1 GLY C 1 1 5 1222 1 1 1 GLY CA C 2.641 0.381 -0.624 1.00 . A A . 1 GLY CA 1 1 5 1223 1 1 1 GLY H1 H 1.179 -0.374 0.712 1.00 . A A . 1 GLY H1 1 1 5 1224 1 1 1 GLY HA2 H 1.916 0.508 -1.443 1.00 . A A . 1 GLY HA2 1 1 5 1225 1 1 1 GLY HA3 H 3.345 1.226 -0.672 1.00 . A A . 1 GLY HA3 1 1 5 1226 1 1 1 GLY N N 1.897 0.320 0.633 1.00 . A A . 1 GLY N 1 1 5 1227 1 1 1 GLY O O 3.328 -1.487 -1.890 1.00 . A A . 1 GLY O 1 1 5 1228 1 1 2 GLY C C 4.159 -3.758 0.154 1.00 . A A . 2 GLY C 1 1 5 1229 1 1 2 GLY CA C 5.024 -2.526 0.028 1.00 . A A . 2 GLY CA 1 1 5 1230 1 1 2 GLY H H 4.283 -0.803 1.041 1.00 . A A . 2 GLY H 1 1 5 1231 1 1 2 GLY HA2 H 5.525 -2.544 -0.953 1.00 . A A . 2 GLY HA2 1 1 5 1232 1 1 2 GLY HA3 H 5.808 -2.543 0.801 1.00 . A A . 2 GLY HA3 1 1 5 1233 1 1 2 GLY N N 4.234 -1.306 0.174 1.00 . A A . 2 GLY N 1 1 5 1234 1 1 2 GLY O O 2.968 -3.664 -0.099 1.00 . A A . 2 GLY O 1 1 5 1235 1 1 3 ALA C C 4.090 -6.651 2.108 1.00 . A A . 3 ALA C 1 1 5 1236 1 1 3 ALA CA C 3.974 -6.153 0.684 1.00 . A A . 3 ALA CA 1 1 5 1237 1 1 3 ALA CB C 4.488 -7.193 -0.344 1.00 . A A . 3 ALA CB 1 1 5 1238 1 1 3 ALA H H 5.732 -4.965 0.720 1.00 . A A . 3 ALA H 1 1 5 1239 1 1 3 ALA HA H 2.900 -6.003 0.490 1.00 . A A . 3 ALA HA 1 1 5 1240 1 1 3 ALA HB1 H 3.900 -8.123 -0.291 1.00 . A A . 3 ALA HB1 1 1 5 1241 1 1 3 ALA HB2 H 4.404 -6.781 -1.362 1.00 . A A . 3 ALA HB2 1 1 5 1242 1 1 3 ALA HB3 H 5.544 -7.428 -0.144 1.00 . A A . 3 ALA HB3 1 1 5 1243 1 1 3 ALA N N 4.748 -4.919 0.532 1.00 . A A . 3 ALA N 1 1 5 1244 1 1 3 ALA O O 4.246 -7.844 2.316 1.00 . A A . 3 ALA O 1 1 5 1245 1 1 4 GLY C C 2.792 -6.706 5.017 1.00 . A A . 4 GLY C 1 1 5 1246 1 1 4 GLY CA C 4.106 -6.152 4.502 1.00 . A A . 4 GLY CA 1 1 5 1247 1 1 4 GLY H H 3.880 -4.764 2.911 1.00 . A A . 4 GLY H 1 1 5 1248 1 1 4 GLY HA2 H 4.874 -6.933 4.619 1.00 . A A . 4 GLY HA2 1 1 5 1249 1 1 4 GLY HA3 H 4.437 -5.291 5.104 1.00 . A A . 4 GLY HA3 1 1 5 1250 1 1 4 GLY N N 4.013 -5.739 3.105 1.00 . A A . 4 GLY N 1 1 5 1251 1 1 4 GLY O O 2.120 -7.392 4.264 1.00 . A A . 4 GLY O 1 1 5 1252 1 1 5 HIS C C 0.244 -6.052 7.316 1.00 . A A . 5 HIS C 1 1 5 1253 1 1 5 HIS CA C 1.322 -7.077 6.976 1.00 . A A . 5 HIS CA 1 1 5 1254 1 1 5 HIS CB C 1.789 -7.784 8.248 1.00 . A A . 5 HIS CB 1 1 5 1255 1 1 5 HIS CD2 C 3.549 -9.356 7.172 1.00 . A A . 5 HIS CD2 1 1 5 1256 1 1 5 HIS CE1 C 2.974 -11.218 8.177 1.00 . A A . 5 HIS CE1 1 1 5 1257 1 1 5 HIS CG C 2.507 -9.073 7.988 1.00 . A A . 5 HIS CG 1 1 5 1258 1 1 5 HIS H H 3.060 -5.877 6.827 1.00 . A A . 5 HIS H 1 1 5 1259 1 1 5 HIS HA H 0.905 -7.808 6.300 1.00 . A A . 5 HIS HA 1 1 5 1260 1 1 5 HIS HB2 H 2.461 -7.134 8.788 1.00 . A A . 5 HIS HB2 1 1 5 1261 1 1 5 HIS HB3 H 0.931 -8.001 8.868 1.00 . A A . 5 HIS HB3 1 1 5 1262 1 1 5 HIS HD1 H 1.449 -10.382 9.255 1.00 . A A . 5 HIS HD1 1 1 5 1263 1 1 5 HIS HD2 H 4.072 -8.659 6.532 1.00 . A A . 5 HIS HD2 1 1 5 1264 1 1 5 HIS HE1 H 2.945 -12.252 8.487 1.00 . A A . 5 HIS HE1 1 1 5 1265 1 1 5 HIS N N 2.450 -6.440 6.306 1.00 . A A . 5 HIS N 1 1 5 1266 1 1 5 HIS ND1 N 2.169 -10.260 8.602 1.00 . A A . 5 HIS ND1 1 1 5 1267 1 1 5 HIS NE2 N 3.820 -10.695 7.308 1.00 . A A . 5 HIS NE2 1 1 5 1268 1 1 5 HIS O O -0.915 -6.405 7.539 1.00 . A A . 5 HIS O 1 1 5 1269 1 1 6 VAL C C -0.742 -2.878 6.705 1.00 . A A . 6 VAL C 1 1 5 1270 1 1 6 VAL CA C -0.379 -3.730 7.901 1.00 . A A . 6 VAL CA 1 1 5 1271 1 1 6 VAL CB C 0.309 -2.878 9.011 1.00 . A A . 6 VAL CB 1 1 5 1272 1 1 6 VAL CG1 C -0.620 -1.767 9.573 1.00 . A A . 6 VAL CG1 1 1 5 1273 1 1 6 VAL CG2 C 0.803 -3.792 10.167 1.00 . A A . 6 VAL CG2 1 1 5 1274 1 1 6 VAL H H 1.476 -4.378 7.191 1.00 . A A . 6 VAL H 1 1 5 1275 1 1 6 VAL HA H -1.260 -4.204 8.354 1.00 . A A . 6 VAL HA 1 1 5 1276 1 1 6 VAL HB H 1.191 -2.376 8.578 1.00 . A A . 6 VAL HB 1 1 5 1277 1 1 6 VAL HG11 H -1.477 -2.211 10.099 1.00 . A A . 6 VAL HG11 1 1 5 1278 1 1 6 VAL HG12 H -0.069 -1.138 10.290 1.00 . A A . 6 VAL HG12 1 1 5 1279 1 1 6 VAL HG13 H -0.989 -1.117 8.765 1.00 . A A . 6 VAL HG13 1 1 5 1280 1 1 6 VAL HG21 H 1.300 -3.193 10.946 1.00 . A A . 6 VAL HG21 1 1 5 1281 1 1 6 VAL HG22 H -0.046 -4.323 10.624 1.00 . A A . 6 VAL HG22 1 1 5 1282 1 1 6 VAL HG23 H 1.525 -4.539 9.802 1.00 . A A . 6 VAL HG23 1 1 5 1283 1 1 6 VAL N N 0.575 -4.736 7.421 1.00 . A A . 6 VAL N 1 1 5 1284 1 1 6 VAL O O 0.183 -2.562 5.974 1.00 . A A . 6 VAL O 1 1 5 1285 1 1 7 PRO C C -1.738 -0.326 5.255 1.00 . A A . 7 PRO C 1 1 5 1286 1 1 7 PRO CA C -2.266 -1.739 5.197 1.00 . A A . 7 PRO CA 1 1 5 1287 1 1 7 PRO CB C -3.805 -1.810 5.135 1.00 . A A . 7 PRO CB 1 1 5 1288 1 1 7 PRO CD C -3.159 -2.830 7.242 1.00 . A A . 7 PRO CD 1 1 5 1289 1 1 7 PRO CG C -4.217 -1.888 6.621 1.00 . A A . 7 PRO CG 1 1 5 1290 1 1 7 PRO HA H -1.867 -2.272 4.328 1.00 . A A . 7 PRO HA 1 1 5 1291 1 1 7 PRO HB2 H -4.266 -0.974 4.586 1.00 . A A . 7 PRO HB2 1 1 5 1292 1 1 7 PRO HB3 H -4.072 -2.762 4.649 1.00 . A A . 7 PRO HB3 1 1 5 1293 1 1 7 PRO HD2 H -3.049 -2.628 8.316 1.00 . A A . 7 PRO HD2 1 1 5 1294 1 1 7 PRO HD3 H -3.425 -3.886 7.076 1.00 . A A . 7 PRO HD3 1 1 5 1295 1 1 7 PRO HG2 H -4.123 -0.882 7.063 1.00 . A A . 7 PRO HG2 1 1 5 1296 1 1 7 PRO HG3 H -5.243 -2.258 6.767 1.00 . A A . 7 PRO HG3 1 1 5 1297 1 1 7 PRO N N -2.008 -2.480 6.421 1.00 . A A . 7 PRO N 1 1 5 1298 1 1 7 PRO O O -1.669 0.235 6.336 1.00 . A A . 7 PRO O 1 1 5 1299 1 1 8 GLU C C -2.057 2.579 4.033 1.00 . A A . 8 GLU C 1 1 5 1300 1 1 8 GLU CA C -0.880 1.629 4.046 1.00 . A A . 8 GLU CA 1 1 5 1301 1 1 8 GLU CB C 0.011 1.857 2.791 1.00 . A A . 8 GLU CB 1 1 5 1302 1 1 8 GLU CD C 2.165 1.168 1.654 1.00 . A A . 8 GLU CD 1 1 5 1303 1 1 8 GLU CG C 1.337 1.061 2.912 1.00 . A A . 8 GLU CG 1 1 5 1304 1 1 8 GLU H H -1.445 -0.251 3.221 1.00 . A A . 8 GLU H 1 1 5 1305 1 1 8 GLU HA H -0.272 1.840 4.942 1.00 . A A . 8 GLU HA 1 1 5 1306 1 1 8 GLU HB2 H -0.527 1.550 1.880 1.00 . A A . 8 GLU HB2 1 1 5 1307 1 1 8 GLU HB3 H 0.250 2.930 2.697 1.00 . A A . 8 GLU HB3 1 1 5 1308 1 1 8 GLU HG2 H 1.929 1.459 3.750 1.00 . A A . 8 GLU HG2 1 1 5 1309 1 1 8 GLU HG3 H 1.113 0.005 3.126 1.00 . A A . 8 GLU HG3 1 1 5 1310 1 1 8 GLU N N -1.363 0.248 4.087 1.00 . A A . 8 GLU N 1 1 5 1311 1 1 8 GLU O O -1.987 3.606 4.691 1.00 . A A . 8 GLU O 1 1 5 1312 1 1 8 GLU OE1 O 3.040 2.020 1.608 1.00 . A A . 8 GLU OE1 1 1 5 1313 1 1 9 TYR C C -5.560 2.324 3.104 1.00 . A A . 9 TYR C 1 1 5 1314 1 1 9 TYR CA C -4.298 3.147 3.211 1.00 . A A . 9 TYR CA 1 1 5 1315 1 1 9 TYR CB C -4.111 4.054 1.966 1.00 . A A . 9 TYR CB 1 1 5 1316 1 1 9 TYR CD1 C -4.879 2.506 0.092 1.00 . A A . 9 TYR CD1 1 1 5 1317 1 1 9 TYR CD2 C -2.532 3.050 0.235 1.00 . A A . 9 TYR CD2 1 1 5 1318 1 1 9 TYR CE1 C -4.613 1.648 -0.979 1.00 . A A . 9 TYR CE1 1 1 5 1319 1 1 9 TYR CE2 C -2.270 2.220 -0.858 1.00 . A A . 9 TYR CE2 1 1 5 1320 1 1 9 TYR CG C -3.834 3.183 0.731 1.00 . A A . 9 TYR CG 1 1 5 1321 1 1 9 TYR CZ C -3.308 1.494 -1.456 1.00 . A A . 9 TYR CZ 1 1 5 1322 1 1 9 TYR H H -3.165 1.416 2.745 1.00 . A A . 9 TYR H 1 1 5 1323 1 1 9 TYR HA H -4.398 3.765 4.119 1.00 . A A . 9 TYR HA 1 1 5 1324 1 1 9 TYR HB2 H -4.999 4.678 1.782 1.00 . A A . 9 TYR HB2 1 1 5 1325 1 1 9 TYR HB3 H -3.265 4.735 2.153 1.00 . A A . 9 TYR HB3 1 1 5 1326 1 1 9 TYR HD1 H -5.903 2.640 0.424 1.00 . A A . 9 TYR HD1 1 1 5 1327 1 1 9 TYR HD2 H -1.713 3.591 0.698 1.00 . A A . 9 TYR HD2 1 1 5 1328 1 1 9 TYR HE1 H -5.423 1.098 -1.447 1.00 . A A . 9 TYR HE1 1 1 5 1329 1 1 9 TYR HE2 H -1.254 2.144 -1.233 1.00 . A A . 9 TYR HE2 1 1 5 1330 1 1 9 TYR HH H -2.168 0.613 -2.826 1.00 . A A . 9 TYR HH 1 1 5 1331 1 1 9 TYR N N -3.141 2.254 3.292 1.00 . A A . 9 TYR N 1 1 5 1332 1 1 9 TYR O O -5.437 1.113 3.015 1.00 . A A . 9 TYR O 1 1 5 1333 1 1 9 TYR OH O -3.067 0.617 -2.519 1.00 . A A . 9 TYR OH 1 1 5 1334 1 1 10 PHE C C -8.885 2.818 1.889 1.00 . A A . 10 PHE C 1 1 5 1335 1 1 10 PHE CA C -8.007 2.206 2.961 1.00 . A A . 10 PHE CA 1 1 5 1336 1 1 10 PHE CB C -8.800 2.202 4.289 1.00 . A A . 10 PHE CB 1 1 5 1337 1 1 10 PHE CD1 C -7.091 2.051 6.171 1.00 . A A . 10 PHE CD1 1 1 5 1338 1 1 10 PHE CD2 C -8.283 0.047 5.534 1.00 . A A . 10 PHE CD2 1 1 5 1339 1 1 10 PHE CE1 C -6.484 1.355 7.221 1.00 . A A . 10 PHE CE1 1 1 5 1340 1 1 10 PHE CE2 C -7.683 -0.649 6.586 1.00 . A A . 10 PHE CE2 1 1 5 1341 1 1 10 PHE CG C -8.034 1.413 5.358 1.00 . A A . 10 PHE CG 1 1 5 1342 1 1 10 PHE CZ C -6.811 0.017 7.453 1.00 . A A . 10 PHE CZ 1 1 5 1343 1 1 10 PHE H H -6.831 3.950 3.216 1.00 . A A . 10 PHE H 1 1 5 1344 1 1 10 PHE HA H -7.798 1.159 2.698 1.00 . A A . 10 PHE HA 1 1 5 1345 1 1 10 PHE HB2 H -8.963 3.237 4.628 1.00 . A A . 10 PHE HB2 1 1 5 1346 1 1 10 PHE HB3 H -9.790 1.743 4.135 1.00 . A A . 10 PHE HB3 1 1 5 1347 1 1 10 PHE HD1 H -6.830 3.089 5.994 1.00 . A A . 10 PHE HD1 1 1 5 1348 1 1 10 PHE HD2 H -8.947 -0.479 4.855 1.00 . A A . 10 PHE HD2 1 1 5 1349 1 1 10 PHE HE1 H -5.760 1.855 7.857 1.00 . A A . 10 PHE HE1 1 1 5 1350 1 1 10 PHE HE2 H -7.896 -1.703 6.732 1.00 . A A . 10 PHE HE2 1 1 5 1351 1 1 10 PHE HZ H -6.389 -0.505 8.306 1.00 . A A . 10 PHE HZ 1 1 5 1352 1 1 10 PHE N N -6.760 2.956 3.106 1.00 . A A . 10 PHE N 1 1 5 1353 1 1 10 PHE O O -8.877 4.032 1.763 1.00 . A A . 10 PHE O 1 1 5 1354 1 1 11 VAL C C -12.007 2.340 0.573 1.00 . A A . 11 VAL C 1 1 5 1355 1 1 11 VAL CA C -10.559 2.454 0.108 1.00 . A A . 11 VAL CA 1 1 5 1356 1 1 11 VAL CB C -10.390 1.669 -1.206 1.00 . A A . 11 VAL CB 1 1 5 1357 1 1 11 VAL CG1 C -11.220 2.299 -2.315 1.00 . A A . 11 VAL CG1 1 1 5 1358 1 1 11 VAL CG2 C -8.922 1.601 -1.600 1.00 . A A . 11 VAL CG2 1 1 5 1359 1 1 11 VAL H H -9.545 1.014 1.281 1.00 . A A . 11 VAL H 1 1 5 1360 1 1 11 VAL HA H -10.335 3.493 -0.086 1.00 . A A . 11 VAL HA 1 1 5 1361 1 1 11 VAL HB H -10.746 0.662 -1.048 1.00 . A A . 11 VAL HB 1 1 5 1362 1 1 11 VAL HG11 H -10.816 2.010 -3.274 1.00 . A A . 11 VAL HG11 1 1 5 1363 1 1 11 VAL HG12 H -12.242 1.959 -2.236 1.00 . A A . 11 VAL HG12 1 1 5 1364 1 1 11 VAL HG13 H -11.189 3.374 -2.221 1.00 . A A . 11 VAL HG13 1 1 5 1365 1 1 11 VAL HG21 H -8.821 1.840 -2.648 1.00 . A A . 11 VAL HG21 1 1 5 1366 1 1 11 VAL HG22 H -8.358 2.311 -1.013 1.00 . A A . 11 VAL HG22 1 1 5 1367 1 1 11 VAL HG23 H -8.546 0.606 -1.419 1.00 . A A . 11 VAL HG23 1 1 5 1368 1 1 11 VAL N N -9.639 1.978 1.134 1.00 . A A . 11 VAL N 1 1 5 1369 1 1 11 VAL O O -12.303 1.653 1.551 1.00 . A A . 11 VAL O 1 1 5 1370 1 1 12 ARG C C -14.969 1.688 -0.253 1.00 . A A . 12 ARG C 1 1 5 1371 1 1 12 ARG CA C -14.322 2.992 0.206 1.00 . A A . 12 ARG CA 1 1 5 1372 1 1 12 ARG CB C -15.043 4.182 -0.430 1.00 . A A . 12 ARG CB 1 1 5 1373 1 1 12 ARG CD C -15.314 6.677 -0.575 1.00 . A A . 12 ARG CD 1 1 5 1374 1 1 12 ARG CG C -14.584 5.529 0.105 1.00 . A A . 12 ARG CG 1 1 5 1375 1 1 12 ARG CZ C -13.534 8.054 -1.565 1.00 . A A . 12 ARG CZ 1 1 5 1376 1 1 12 ARG H H -12.608 3.547 -0.903 1.00 . A A . 12 ARG H 1 1 5 1377 1 1 12 ARG HA H -14.407 3.064 1.280 1.00 . A A . 12 ARG HA 1 1 5 1378 1 1 12 ARG HB2 H -14.869 4.165 -1.496 1.00 . A A . 12 ARG HB2 1 1 5 1379 1 1 12 ARG HB3 H -16.102 4.088 -0.245 1.00 . A A . 12 ARG HB3 1 1 5 1380 1 1 12 ARG HD2 H -15.587 6.371 -1.574 1.00 . A A . 12 ARG HD2 1 1 5 1381 1 1 12 ARG HD3 H -16.206 6.902 -0.011 1.00 . A A . 12 ARG HD3 1 1 5 1382 1 1 12 ARG HE H -14.653 8.589 -0.004 1.00 . A A . 12 ARG HE 1 1 5 1383 1 1 12 ARG HG2 H -14.781 5.570 1.166 1.00 . A A . 12 ARG HG2 1 1 5 1384 1 1 12 ARG HG3 H -13.524 5.633 -0.071 1.00 . A A . 12 ARG HG3 1 1 5 1385 1 1 12 ARG HH11 H -13.820 6.264 -2.458 1.00 . A A . 12 ARG HH11 1 1 5 1386 1 1 12 ARG HH12 H -12.569 7.245 -3.146 1.00 . A A . 12 ARG HH12 1 1 5 1387 1 1 12 ARG HH21 H -13.008 9.889 -0.901 1.00 . A A . 12 ARG HH21 1 1 5 1388 1 1 12 ARG HH22 H -12.107 9.306 -2.259 1.00 . A A . 12 ARG HH22 1 1 5 1389 1 1 12 ARG N N -12.905 3.017 -0.134 1.00 . A A . 12 ARG N 1 1 5 1390 1 1 12 ARG NE N -14.488 7.878 -0.658 1.00 . A A . 12 ARG NE 1 1 5 1391 1 1 12 ARG NH1 N -13.287 7.110 -2.463 1.00 . A A . 12 ARG NH1 1 1 5 1392 1 1 12 ARG NH2 N -12.825 9.175 -1.576 1.00 . A A . 12 ARG NH2 1 1 5 1393 1 1 12 ARG O O -16.175 1.631 -0.488 1.00 . A A . 12 ARG O 1 1 5 1394 1 1 13 GLY C C -14.818 -1.623 0.341 1.00 . A A . 13 GLY C 1 1 5 1395 1 1 13 GLY CA C -14.667 -0.646 -0.808 1.00 . A A . 13 GLY CA 1 1 5 1396 1 1 13 GLY H H -13.203 0.748 -0.176 1.00 . A A . 13 GLY H 1 1 5 1397 1 1 13 GLY HA2 H -15.630 -0.502 -1.274 1.00 . A A . 13 GLY HA2 1 1 5 1398 1 1 13 GLY HA3 H -13.986 -1.065 -1.534 1.00 . A A . 13 GLY HA3 1 1 5 1399 1 1 13 GLY N N -14.157 0.643 -0.377 1.00 . A A . 13 GLY N 1 1 5 1400 1 1 13 GLY O O -15.618 -1.402 1.251 1.00 . A A . 13 GLY O 1 1 5 1401 1 1 14 ASP C C -12.771 -3.809 2.085 1.00 . A A . 14 ASP C 1 1 5 1402 1 1 14 ASP CA C -14.103 -3.721 1.345 1.00 . A A . 14 ASP CA 1 1 5 1403 1 1 14 ASP CB C -14.458 -5.082 0.746 1.00 . A A . 14 ASP CB 1 1 5 1404 1 1 14 ASP CG C -14.451 -6.190 1.781 1.00 . A A . 14 ASP CG 1 1 5 1405 1 1 14 ASP H H -13.432 -2.825 -0.452 1.00 . A A . 14 ASP H 1 1 5 1406 1 1 14 ASP HA H -14.872 -3.435 2.047 1.00 . A A . 14 ASP HA 1 1 5 1407 1 1 14 ASP HB2 H -15.446 -5.030 0.310 1.00 . A A . 14 ASP HB2 1 1 5 1408 1 1 14 ASP HB3 H -13.742 -5.328 -0.024 1.00 . A A . 14 ASP HB3 1 1 5 1409 1 1 14 ASP N N -14.050 -2.706 0.299 1.00 . A A . 14 ASP N 1 1 5 1410 1 1 14 ASP O O -12.638 -3.317 3.206 1.00 . A A . 14 ASP O 1 1 5 1411 1 1 14 ASP OD1 O -14.828 -5.922 2.941 1.00 . A A . 14 ASP OD1 1 1 5 1412 1 1 14 ASP OD2 O -14.068 -7.326 1.431 1.00 . A A . 14 ASP OD2 1 1 5 1413 1 1 15 PHE C C -9.422 -3.798 1.272 1.00 . A A . 15 PHE C 1 1 5 1414 1 1 15 PHE CA C -10.468 -4.593 2.049 1.00 . A A . 15 PHE CA 1 1 5 1415 1 1 15 PHE CB C -10.073 -6.071 2.091 1.00 . A A . 15 PHE CB 1 1 5 1416 1 1 15 PHE CD1 C -10.665 -6.405 4.506 1.00 . A A . 15 PHE CD1 1 1 5 1417 1 1 15 PHE CD2 C -11.453 -7.998 2.916 1.00 . A A . 15 PHE CD2 1 1 5 1418 1 1 15 PHE CE1 C -11.282 -7.109 5.523 1.00 . A A . 15 PHE CE1 1 1 5 1419 1 1 15 PHE CE2 C -12.072 -8.706 3.929 1.00 . A A . 15 PHE CE2 1 1 5 1420 1 1 15 PHE CG C -10.744 -6.840 3.193 1.00 . A A . 15 PHE CG 1 1 5 1421 1 1 15 PHE CZ C -11.985 -8.262 5.234 1.00 . A A . 15 PHE CZ 1 1 5 1422 1 1 15 PHE H H -11.956 -4.810 0.558 1.00 . A A . 15 PHE H 1 1 5 1423 1 1 15 PHE HA H -10.515 -4.214 3.057 1.00 . A A . 15 PHE HA 1 1 5 1424 1 1 15 PHE HB2 H -10.341 -6.535 1.153 1.00 . A A . 15 PHE HB2 1 1 5 1425 1 1 15 PHE HB3 H -9.006 -6.147 2.233 1.00 . A A . 15 PHE HB3 1 1 5 1426 1 1 15 PHE HD1 H -10.115 -5.503 4.734 1.00 . A A . 15 PHE HD1 1 1 5 1427 1 1 15 PHE HD2 H -11.521 -8.347 1.896 1.00 . A A . 15 PHE HD2 1 1 5 1428 1 1 15 PHE HE1 H -11.212 -6.759 6.542 1.00 . A A . 15 PHE HE1 1 1 5 1429 1 1 15 PHE HE2 H -12.621 -9.607 3.700 1.00 . A A . 15 PHE HE2 1 1 5 1430 1 1 15 PHE HZ H -12.468 -8.814 6.026 1.00 . A A . 15 PHE HZ 1 1 5 1431 1 1 15 PHE N N -11.788 -4.439 1.450 1.00 . A A . 15 PHE N 1 1 5 1432 1 1 15 PHE O O -9.622 -3.425 0.116 1.00 . A A . 15 PHE O 1 1 5 1433 1 1 16 PRO C C -6.453 -3.461 0.278 1.00 . A A . 16 PRO C 1 1 5 1434 1 1 16 PRO CA C -7.288 -2.594 1.188 1.00 . A A . 16 PRO CA 1 1 5 1435 1 1 16 PRO CB C -6.471 -2.025 2.374 1.00 . A A . 16 PRO CB 1 1 5 1436 1 1 16 PRO CD C -8.032 -3.623 3.319 1.00 . A A . 16 PRO CD 1 1 5 1437 1 1 16 PRO CG C -6.578 -3.129 3.446 1.00 . A A . 16 PRO CG 1 1 5 1438 1 1 16 PRO HA H -7.749 -1.773 0.614 1.00 . A A . 16 PRO HA 1 1 5 1439 1 1 16 PRO HB2 H -5.432 -1.765 2.116 1.00 . A A . 16 PRO HB2 1 1 5 1440 1 1 16 PRO HB3 H -6.974 -1.128 2.767 1.00 . A A . 16 PRO HB3 1 1 5 1441 1 1 16 PRO HD2 H -8.092 -4.659 3.675 1.00 . A A . 16 PRO HD2 1 1 5 1442 1 1 16 PRO HD3 H -8.693 -2.976 3.919 1.00 . A A . 16 PRO HD3 1 1 5 1443 1 1 16 PRO HG2 H -5.879 -3.944 3.194 1.00 . A A . 16 PRO HG2 1 1 5 1444 1 1 16 PRO HG3 H -6.383 -2.772 4.468 1.00 . A A . 16 PRO HG3 1 1 5 1445 1 1 16 PRO N N -8.277 -3.400 1.898 1.00 . A A . 16 PRO N 1 1 5 1446 1 1 16 PRO O O -6.618 -4.670 0.316 1.00 . A A . 16 PRO O 1 1 5 1447 1 1 17 ILE C C -3.412 -3.841 -1.082 1.00 . A A . 17 ILE C 1 1 5 1448 1 1 17 ILE CA C -4.831 -3.608 -1.561 1.00 . A A . 17 ILE CA 1 1 5 1449 1 1 17 ILE CB C -4.831 -2.909 -2.959 1.00 . A A . 17 ILE CB 1 1 5 1450 1 1 17 ILE CD1 C -7.254 -1.912 -2.849 1.00 . A A . 17 ILE CD1 1 1 5 1451 1 1 17 ILE CG1 C -6.250 -2.823 -3.605 1.00 . A A . 17 ILE CG1 1 1 5 1452 1 1 17 ILE CG2 C -3.876 -3.658 -3.937 1.00 . A A . 17 ILE CG2 1 1 5 1453 1 1 17 ILE H H -5.432 -1.859 -0.512 1.00 . A A . 17 ILE H 1 1 5 1454 1 1 17 ILE HA H -5.300 -4.592 -1.729 1.00 . A A . 17 ILE HA 1 1 5 1455 1 1 17 ILE HB H -4.450 -1.879 -2.858 1.00 . A A . 17 ILE HB 1 1 5 1456 1 1 17 ILE HD11 H -7.598 -2.380 -1.917 1.00 . A A . 17 ILE HD11 1 1 5 1457 1 1 17 ILE HD12 H -6.794 -0.938 -2.618 1.00 . A A . 17 ILE HD12 1 1 5 1458 1 1 17 ILE HD13 H -8.145 -1.733 -3.472 1.00 . A A . 17 ILE HD13 1 1 5 1459 1 1 17 ILE HG12 H -6.142 -2.398 -4.618 1.00 . A A . 17 ILE HG12 1 1 5 1460 1 1 17 ILE HG13 H -6.680 -3.832 -3.711 1.00 . A A . 17 ILE HG13 1 1 5 1461 1 1 17 ILE HG21 H -4.198 -4.705 -4.056 1.00 . A A . 17 ILE HG21 1 1 5 1462 1 1 17 ILE HG22 H -3.878 -3.180 -4.929 1.00 . A A . 17 ILE HG22 1 1 5 1463 1 1 17 ILE HG23 H -2.836 -3.652 -3.576 1.00 . A A . 17 ILE HG23 1 1 5 1464 1 1 17 ILE N N -5.574 -2.849 -0.555 1.00 . A A . 17 ILE N 1 1 5 1465 1 1 17 ILE O O -3.039 -4.988 -0.895 1.00 . A A . 17 ILE O 1 1 5 1466 1 1 18 SER C C -0.879 -3.039 0.825 1.00 . A A . 18 SER C 1 1 5 1467 1 1 18 SER CA C -1.161 -2.959 -0.656 1.00 . A A . 18 SER CA 1 1 5 1468 1 1 18 SER CB C -0.363 -1.781 -1.282 1.00 . A A . 18 SER CB 1 1 5 1469 1 1 18 SER H H -2.951 -1.844 -0.982 1.00 . A A . 18 SER H 1 1 5 1470 1 1 18 SER HA H -0.809 -3.890 -1.133 1.00 . A A . 18 SER HA 1 1 5 1471 1 1 18 SER HB2 H 0.699 -2.052 -1.375 1.00 . A A . 18 SER HB2 1 1 5 1472 1 1 18 SER HB3 H -0.739 -1.564 -2.296 1.00 . A A . 18 SER HB3 1 1 5 1473 1 1 18 SER HG H -1.298 -0.298 -0.290 1.00 . A A . 18 SER HG 1 1 5 1474 1 1 18 SER N N -2.594 -2.775 -0.911 1.00 . A A . 18 SER N 1 1 5 1475 1 1 18 SER O O -1.815 -2.900 1.596 1.00 . A A . 18 SER O 1 1 5 1476 1 1 18 SER OG O -0.416 -0.611 -0.449 1.00 . A A . 18 SER OG 1 1 5 1477 1 1 19 PHE C C 2.006 -2.618 2.974 1.00 . A A . 19 PHE C 1 1 5 1478 1 1 19 PHE CA C 0.733 -3.364 2.648 1.00 . A A . 19 PHE CA 1 1 5 1479 1 1 19 PHE CB C 0.716 -4.859 3.051 1.00 . A A . 19 PHE CB 1 1 5 1480 1 1 19 PHE CD1 C -1.763 -5.358 3.328 1.00 . A A . 19 PHE CD1 1 1 5 1481 1 1 19 PHE CD2 C -0.631 -6.224 1.375 1.00 . A A . 19 PHE CD2 1 1 5 1482 1 1 19 PHE CE1 C -2.969 -5.895 2.868 1.00 . A A . 19 PHE CE1 1 1 5 1483 1 1 19 PHE CE2 C -1.829 -6.793 0.932 1.00 . A A . 19 PHE CE2 1 1 5 1484 1 1 19 PHE CG C -0.594 -5.500 2.573 1.00 . A A . 19 PHE CG 1 1 5 1485 1 1 19 PHE CZ C -3.003 -6.613 1.669 1.00 . A A . 19 PHE CZ 1 1 5 1486 1 1 19 PHE H H 1.143 -3.405 0.574 1.00 . A A . 19 PHE H 1 1 5 1487 1 1 19 PHE HA H -0.015 -2.838 3.247 1.00 . A A . 19 PHE HA 1 1 5 1488 1 1 19 PHE HB2 H 1.560 -5.367 2.570 1.00 . A A . 19 PHE HB2 1 1 5 1489 1 1 19 PHE HB3 H 0.802 -4.991 4.140 1.00 . A A . 19 PHE HB3 1 1 5 1490 1 1 19 PHE HD1 H -1.740 -4.826 4.275 1.00 . A A . 19 PHE HD1 1 1 5 1491 1 1 19 PHE HD2 H 0.267 -6.348 0.779 1.00 . A A . 19 PHE HD2 1 1 5 1492 1 1 19 PHE HE1 H -3.880 -5.757 3.443 1.00 . A A . 19 PHE HE1 1 1 5 1493 1 1 19 PHE HE2 H -1.846 -7.371 0.013 1.00 . A A . 19 PHE HE2 1 1 5 1494 1 1 19 PHE HZ H -3.939 -7.030 1.309 1.00 . A A . 19 PHE HZ 1 1 5 1495 1 1 19 PHE N N 0.399 -3.259 1.228 1.00 . A A . 19 PHE N 1 1 5 1496 1 1 19 PHE O O 2.596 -2.046 2.072 1.00 . A A . 19 PHE O 1 1 5 1497 1 1 20 TYR C C 4.835 -2.129 4.125 1.00 . A A . 20 TYR C 1 1 5 1498 1 1 20 TYR CA C 3.500 -1.656 4.655 1.00 . A A . 20 TYR CA 1 1 5 1499 1 1 20 TYR CB C 3.548 -1.477 6.204 1.00 . A A . 20 TYR CB 1 1 5 1500 1 1 20 TYR CD1 C 3.086 0.994 6.500 1.00 . A A . 20 TYR CD1 1 1 5 1501 1 1 20 TYR CD2 C 5.283 0.188 7.094 1.00 . A A . 20 TYR CD2 1 1 5 1502 1 1 20 TYR CE1 C 3.469 2.299 6.823 1.00 . A A . 20 TYR CE1 1 1 5 1503 1 1 20 TYR CE2 C 5.664 1.491 7.427 1.00 . A A . 20 TYR CE2 1 1 5 1504 1 1 20 TYR CG C 3.995 -0.065 6.609 1.00 . A A . 20 TYR CG 1 1 5 1505 1 1 20 TYR CZ C 4.765 2.554 7.288 1.00 . A A . 20 TYR CZ 1 1 5 1506 1 1 20 TYR H H 1.957 -3.101 4.966 1.00 . A A . 20 TYR H 1 1 5 1507 1 1 20 TYR HA H 3.290 -0.677 4.200 1.00 . A A . 20 TYR HA 1 1 5 1508 1 1 20 TYR HB2 H 2.542 -1.586 6.632 1.00 . A A . 20 TYR HB2 1 1 5 1509 1 1 20 TYR HB3 H 4.179 -2.256 6.659 1.00 . A A . 20 TYR HB3 1 1 5 1510 1 1 20 TYR HD1 H 2.071 0.806 6.165 1.00 . A A . 20 TYR HD1 1 1 5 1511 1 1 20 TYR HD2 H 5.992 -0.624 7.211 1.00 . A A . 20 TYR HD2 1 1 5 1512 1 1 20 TYR HE1 H 2.752 3.106 6.708 1.00 . A A . 20 TYR HE1 1 1 5 1513 1 1 20 TYR HE2 H 6.666 1.685 7.796 1.00 . A A . 20 TYR HE2 1 1 5 1514 1 1 20 TYR HH H 4.513 4.516 7.497 1.00 . A A . 20 TYR HH 1 1 5 1515 1 1 20 TYR N N 2.423 -2.568 4.261 1.00 . A A . 20 TYR N 1 1 5 1516 1 1 20 TYR O O 4.919 -3.248 3.647 1.00 . A A . 20 TYR O 1 1 5 1517 1 1 20 TYR OH O 5.180 3.849 7.616 1.00 . A A . 20 TYR OH 1 1 5 1518 1 1 21 GLY C C 8.276 -0.721 4.032 1.00 . A A . 21 GLY C 1 1 5 1519 1 1 21 GLY CA C 7.225 -1.778 3.817 1.00 . A A . 21 GLY CA 1 1 5 1520 1 1 21 GLY H H 5.807 -0.359 4.537 1.00 . A A . 21 GLY H 1 1 5 1521 1 1 21 GLY HA2 H 7.478 -2.671 4.413 1.00 . A A . 21 GLY HA2 1 1 5 1522 1 1 21 GLY HA3 H 7.232 -2.055 2.753 1.00 . A A . 21 GLY HA3 1 1 5 1523 1 1 21 GLY N N 5.901 -1.300 4.206 1.00 . A A . 21 GLY N 1 1 5 1524 1 1 21 GLY O O 9.405 -1.070 4.472 1.00 . A A . 21 GLY O 1 1 5 1525 1 1 21 GLY OXT O 7.977 0.470 3.748 1.00 . A A . 21 GLY OXT 1 1 6 1526 1 1 1 GLY C C 3.510 -1.140 -0.776 1.00 . A A . 1 GLY C 1 1 6 1527 1 1 1 GLY CA C 2.726 0.142 -0.628 1.00 . A A . 1 GLY CA 1 1 6 1528 1 1 1 GLY H1 H 1.173 -0.503 0.667 1.00 . A A . 1 GLY H1 1 1 6 1529 1 1 1 GLY HA2 H 2.033 0.255 -1.477 1.00 . A A . 1 GLY HA2 1 1 6 1530 1 1 1 GLY HA3 H 3.439 0.980 -0.680 1.00 . A A . 1 GLY HA3 1 1 6 1531 1 1 1 GLY N N 1.949 0.129 0.610 1.00 . A A . 1 GLY N 1 1 6 1532 1 1 1 GLY O O 3.410 -1.782 -1.810 1.00 . A A . 1 GLY O 1 1 6 1533 1 1 2 GLY C C 4.240 -3.979 0.300 1.00 . A A . 2 GLY C 1 1 6 1534 1 1 2 GLY CA C 5.100 -2.747 0.149 1.00 . A A . 2 GLY CA 1 1 6 1535 1 1 2 GLY H H 4.355 -0.988 1.095 1.00 . A A . 2 GLY H 1 1 6 1536 1 1 2 GLY HA2 H 5.615 -2.791 -0.824 1.00 . A A . 2 GLY HA2 1 1 6 1537 1 1 2 GLY HA3 H 5.873 -2.743 0.933 1.00 . A A . 2 GLY HA3 1 1 6 1538 1 1 2 GLY N N 4.307 -1.523 0.248 1.00 . A A . 2 GLY N 1 1 6 1539 1 1 2 GLY O O 3.044 -3.890 0.071 1.00 . A A . 2 GLY O 1 1 6 1540 1 1 3 ALA C C 4.161 -6.813 2.299 1.00 . A A . 3 ALA C 1 1 6 1541 1 1 3 ALA CA C 4.077 -6.370 0.856 1.00 . A A . 3 ALA CA 1 1 6 1542 1 1 3 ALA CB C 4.625 -7.444 -0.118 1.00 . A A . 3 ALA CB 1 1 6 1543 1 1 3 ALA H H 5.829 -5.172 0.846 1.00 . A A . 3 ALA H 1 1 6 1544 1 1 3 ALA HA H 3.007 -6.238 0.630 1.00 . A A . 3 ALA HA 1 1 6 1545 1 1 3 ALA HB1 H 4.567 -7.073 -1.153 1.00 . A A . 3 ALA HB1 1 1 6 1546 1 1 3 ALA HB2 H 5.677 -7.663 0.119 1.00 . A A . 3 ALA HB2 1 1 6 1547 1 1 3 ALA HB3 H 4.042 -8.376 -0.045 1.00 . A A . 3 ALA HB3 1 1 6 1548 1 1 3 ALA N N 4.842 -5.134 0.675 1.00 . A A . 3 ALA N 1 1 6 1549 1 1 3 ALA O O 4.316 -7.996 2.557 1.00 . A A . 3 ALA O 1 1 6 1550 1 1 4 GLY C C 2.800 -6.767 5.182 1.00 . A A . 4 GLY C 1 1 6 1551 1 1 4 GLY CA C 4.120 -6.223 4.672 1.00 . A A . 4 GLY CA 1 1 6 1552 1 1 4 GLY H H 3.925 -4.899 3.022 1.00 . A A . 4 GLY H 1 1 6 1553 1 1 4 GLY HA2 H 4.891 -6.991 4.839 1.00 . A A . 4 GLY HA2 1 1 6 1554 1 1 4 GLY HA3 H 4.431 -5.333 5.244 1.00 . A A . 4 GLY HA3 1 1 6 1555 1 1 4 GLY N N 4.057 -5.864 3.258 1.00 . A A . 4 GLY N 1 1 6 1556 1 1 4 GLY O O 2.140 -7.477 4.439 1.00 . A A . 4 GLY O 1 1 6 1557 1 1 5 HIS C C 0.222 -6.036 7.428 1.00 . A A . 5 HIS C 1 1 6 1558 1 1 5 HIS CA C 1.297 -7.076 7.127 1.00 . A A . 5 HIS CA 1 1 6 1559 1 1 5 HIS CB C 1.744 -7.754 8.423 1.00 . A A . 5 HIS CB 1 1 6 1560 1 1 5 HIS CD2 C 2.115 -10.318 8.544 1.00 . A A . 5 HIS CD2 1 1 6 1561 1 1 5 HIS CE1 C 4.053 -10.410 7.524 1.00 . A A . 5 HIS CE1 1 1 6 1562 1 1 5 HIS CG C 2.456 -9.053 8.205 1.00 . A A . 5 HIS CG 1 1 6 1563 1 1 5 HIS H H 3.044 -5.891 6.970 1.00 . A A . 5 HIS H 1 1 6 1564 1 1 5 HIS HA H 0.884 -7.822 6.465 1.00 . A A . 5 HIS HA 1 1 6 1565 1 1 5 HIS HB2 H 2.414 -7.094 8.954 1.00 . A A . 5 HIS HB2 1 1 6 1566 1 1 5 HIS HB3 H 0.877 -7.949 9.037 1.00 . A A . 5 HIS HB3 1 1 6 1567 1 1 5 HIS HD1 H 4.188 -8.394 7.202 1.00 . A A . 5 HIS HD1 1 1 6 1568 1 1 5 HIS HD2 H 1.216 -10.624 9.061 1.00 . A A . 5 HIS HD2 1 1 6 1569 1 1 5 HIS HE1 H 4.966 -10.783 7.084 1.00 . A A . 5 HIS HE1 1 1 6 1570 1 1 5 HIS N N 2.439 -6.464 6.456 1.00 . A A . 5 HIS N 1 1 6 1571 1 1 5 HIS ND1 N 3.676 -9.145 7.568 1.00 . A A . 5 HIS ND1 1 1 6 1572 1 1 5 HIS NE2 N 3.123 -11.143 8.110 1.00 . A A . 5 HIS NE2 1 1 6 1573 1 1 5 HIS O O -0.943 -6.375 7.637 1.00 . A A . 5 HIS O 1 1 6 1574 1 1 6 VAL C C -0.741 -2.864 6.759 1.00 . A A . 6 VAL C 1 1 6 1575 1 1 6 VAL CA C -0.394 -3.701 7.971 1.00 . A A . 6 VAL CA 1 1 6 1576 1 1 6 VAL CB C 0.286 -2.836 9.077 1.00 . A A . 6 VAL CB 1 1 6 1577 1 1 6 VAL CG1 C -0.644 -1.712 9.613 1.00 . A A . 6 VAL CG1 1 1 6 1578 1 1 6 VAL CG2 C 0.762 -3.737 10.252 1.00 . A A . 6 VAL CG2 1 1 6 1579 1 1 6 VAL H H 1.470 -4.375 7.299 1.00 . A A . 6 VAL H 1 1 6 1580 1 1 6 VAL HA H -1.283 -4.162 8.424 1.00 . A A . 6 VAL HA 1 1 6 1581 1 1 6 VAL HB H 1.174 -2.344 8.645 1.00 . A A . 6 VAL HB 1 1 6 1582 1 1 6 VAL HG11 H -1.508 -2.145 10.138 1.00 . A A . 6 VAL HG11 1 1 6 1583 1 1 6 VAL HG12 H -0.096 -1.075 10.325 1.00 . A A . 6 VAL HG12 1 1 6 1584 1 1 6 VAL HG13 H -1.002 -1.073 8.791 1.00 . A A . 6 VAL HG13 1 1 6 1585 1 1 6 VAL HG21 H 1.252 -3.127 11.028 1.00 . A A . 6 VAL HG21 1 1 6 1586 1 1 6 VAL HG22 H -0.095 -4.258 10.707 1.00 . A A . 6 VAL HG22 1 1 6 1587 1 1 6 VAL HG23 H 1.485 -4.492 9.906 1.00 . A A . 6 VAL HG23 1 1 6 1588 1 1 6 VAL N N 0.560 -4.720 7.518 1.00 . A A . 6 VAL N 1 1 6 1589 1 1 6 VAL O O 0.193 -2.563 6.033 1.00 . A A . 6 VAL O 1 1 6 1590 1 1 7 PRO C C -1.694 -0.341 5.242 1.00 . A A . 7 PRO C 1 1 6 1591 1 1 7 PRO CA C -2.248 -1.745 5.218 1.00 . A A . 7 PRO CA 1 1 6 1592 1 1 7 PRO CB C -3.788 -1.793 5.153 1.00 . A A . 7 PRO CB 1 1 6 1593 1 1 7 PRO CD C -3.163 -2.792 7.275 1.00 . A A . 7 PRO CD 1 1 6 1594 1 1 7 PRO CG C -4.206 -1.844 6.638 1.00 . A A . 7 PRO CG 1 1 6 1595 1 1 7 PRO HA H -1.856 -2.306 4.363 1.00 . A A . 7 PRO HA 1 1 6 1596 1 1 7 PRO HB2 H -4.235 -0.957 4.590 1.00 . A A . 7 PRO HB2 1 1 6 1597 1 1 7 PRO HB3 H -4.073 -2.748 4.682 1.00 . A A . 7 PRO HB3 1 1 6 1598 1 1 7 PRO HD2 H -3.062 -2.579 8.348 1.00 . A A . 7 PRO HD2 1 1 6 1599 1 1 7 PRO HD3 H -3.442 -3.847 7.119 1.00 . A A . 7 PRO HD3 1 1 6 1600 1 1 7 PRO HG2 H -4.099 -0.834 7.067 1.00 . A A . 7 PRO HG2 1 1 6 1601 1 1 7 PRO HG3 H -5.239 -2.197 6.783 1.00 . A A . 7 PRO HG3 1 1 6 1602 1 1 7 PRO N N -2.003 -2.465 6.458 1.00 . A A . 7 PRO N 1 1 6 1603 1 1 7 PRO O O -1.604 0.243 6.310 1.00 . A A . 7 PRO O 1 1 6 1604 1 1 8 GLU C C -1.947 2.546 3.908 1.00 . A A . 8 GLU C 1 1 6 1605 1 1 8 GLU CA C -0.798 1.564 3.978 1.00 . A A . 8 GLU CA 1 1 6 1606 1 1 8 GLU CB C 0.119 1.723 2.730 1.00 . A A . 8 GLU CB 1 1 6 1607 1 1 8 GLU CD C 2.272 0.932 1.652 1.00 . A A . 8 GLU CD 1 1 6 1608 1 1 8 GLU CG C 1.412 0.882 2.893 1.00 . A A . 8 GLU CG 1 1 6 1609 1 1 8 GLU H H -1.424 -0.320 3.205 1.00 . A A . 8 GLU H 1 1 6 1610 1 1 8 GLU HA H -0.197 1.793 4.874 1.00 . A A . 8 GLU HA 1 1 6 1611 1 1 8 GLU HB2 H -0.418 1.408 1.821 1.00 . A A . 8 GLU HB2 1 1 6 1612 1 1 8 GLU HB3 H 0.399 2.782 2.611 1.00 . A A . 8 GLU HB3 1 1 6 1613 1 1 8 GLU HG2 H 1.996 1.276 3.739 1.00 . A A . 8 GLU HG2 1 1 6 1614 1 1 8 GLU HG3 H 1.143 -0.160 3.121 1.00 . A A . 8 GLU HG3 1 1 6 1615 1 1 8 GLU N N -1.319 0.199 4.057 1.00 . A A . 8 GLU N 1 1 6 1616 1 1 8 GLU O O -1.878 3.579 4.557 1.00 . A A . 8 GLU O 1 1 6 1617 1 1 8 GLU OE1 O 3.223 1.697 1.637 1.00 . A A . 8 GLU OE1 1 1 6 1618 1 1 9 TYR C C -5.409 2.363 2.840 1.00 . A A . 9 TYR C 1 1 6 1619 1 1 9 TYR CA C -4.134 3.159 2.979 1.00 . A A . 9 TYR CA 1 1 6 1620 1 1 9 TYR CB C -3.880 4.037 1.725 1.00 . A A . 9 TYR CB 1 1 6 1621 1 1 9 TYR CD1 C -4.505 2.442 -0.166 1.00 . A A . 9 TYR CD1 1 1 6 1622 1 1 9 TYR CD2 C -2.176 3.000 0.142 1.00 . A A . 9 TYR CD2 1 1 6 1623 1 1 9 TYR CE1 C -4.162 1.572 -1.205 1.00 . A A . 9 TYR CE1 1 1 6 1624 1 1 9 TYR CE2 C -1.833 2.142 -0.906 1.00 . A A . 9 TYR CE2 1 1 6 1625 1 1 9 TYR CG C -3.512 3.139 0.534 1.00 . A A . 9 TYR CG 1 1 6 1626 1 1 9 TYR CZ C -2.820 1.417 -1.579 1.00 . A A . 9 TYR CZ 1 1 6 1627 1 1 9 TYR H H -3.028 1.392 2.589 1.00 . A A . 9 TYR H 1 1 6 1628 1 1 9 TYR HA H -4.256 3.797 3.870 1.00 . A A . 9 TYR HA 1 1 6 1629 1 1 9 TYR HB2 H -4.761 4.645 1.469 1.00 . A A . 9 TYR HB2 1 1 6 1630 1 1 9 TYR HB3 H -3.053 4.732 1.945 1.00 . A A . 9 TYR HB3 1 1 6 1631 1 1 9 TYR HD1 H -5.550 2.573 0.096 1.00 . A A . 9 TYR HD1 1 1 6 1632 1 1 9 TYR HD2 H -1.395 3.555 0.651 1.00 . A A . 9 TYR HD2 1 1 6 1633 1 1 9 TYR HE1 H -4.943 1.019 -1.716 1.00 . A A . 9 TYR HE1 1 1 6 1634 1 1 9 TYR HE2 H -0.793 2.036 -1.199 1.00 . A A . 9 TYR HE2 1 1 6 1635 1 1 9 TYR HH H -3.172 0.246 -3.143 1.00 . A A . 9 TYR HH 1 1 6 1636 1 1 9 TYR N N -3.006 2.239 3.124 1.00 . A A . 9 TYR N 1 1 6 1637 1 1 9 TYR O O -5.310 1.148 2.765 1.00 . A A . 9 TYR O 1 1 6 1638 1 1 9 TYR OH O -2.446 0.549 -2.610 1.00 . A A . 9 TYR OH 1 1 6 1639 1 1 10 PHE C C -8.695 2.904 1.544 1.00 . A A . 10 PHE C 1 1 6 1640 1 1 10 PHE CA C -7.853 2.296 2.646 1.00 . A A . 10 PHE CA 1 1 6 1641 1 1 10 PHE CB C -8.673 2.334 3.957 1.00 . A A . 10 PHE CB 1 1 6 1642 1 1 10 PHE CD1 C -7.008 2.189 5.879 1.00 . A A . 10 PHE CD1 1 1 6 1643 1 1 10 PHE CD2 C -8.224 0.195 5.255 1.00 . A A . 10 PHE CD2 1 1 6 1644 1 1 10 PHE CE1 C -6.441 1.506 6.957 1.00 . A A . 10 PHE CE1 1 1 6 1645 1 1 10 PHE CE2 C -7.662 -0.489 6.338 1.00 . A A . 10 PHE CE2 1 1 6 1646 1 1 10 PHE CG C -7.946 1.552 5.058 1.00 . A A . 10 PHE CG 1 1 6 1647 1 1 10 PHE CZ C -6.803 0.180 7.213 1.00 . A A . 10 PHE CZ 1 1 6 1648 1 1 10 PHE H H -6.645 4.018 2.897 1.00 . A A . 10 PHE H 1 1 6 1649 1 1 10 PHE HA H -7.660 1.240 2.409 1.00 . A A . 10 PHE HA 1 1 6 1650 1 1 10 PHE HB2 H -8.823 3.379 4.272 1.00 . A A . 10 PHE HB2 1 1 6 1651 1 1 10 PHE HB3 H -9.669 1.891 3.791 1.00 . A A . 10 PHE HB3 1 1 6 1652 1 1 10 PHE HD1 H -6.721 3.217 5.683 1.00 . A A . 10 PHE HD1 1 1 6 1653 1 1 10 PHE HD2 H -8.881 -0.333 4.572 1.00 . A A . 10 PHE HD2 1 1 6 1654 1 1 10 PHE HE1 H -5.721 2.005 7.600 1.00 . A A . 10 PHE HE1 1 1 6 1655 1 1 10 PHE HE2 H -7.897 -1.536 6.498 1.00 . A A . 10 PHE HE2 1 1 6 1656 1 1 10 PHE HZ H -6.417 -0.328 8.091 1.00 . A A . 10 PHE HZ 1 1 6 1657 1 1 10 PHE N N -6.594 3.022 2.802 1.00 . A A . 10 PHE N 1 1 6 1658 1 1 10 PHE O O -8.662 4.115 1.396 1.00 . A A . 10 PHE O 1 1 6 1659 1 1 11 VAL C C -11.799 2.459 0.184 1.00 . A A . 11 VAL C 1 1 6 1660 1 1 11 VAL CA C -10.343 2.535 -0.261 1.00 . A A . 11 VAL CA 1 1 6 1661 1 1 11 VAL CB C -10.169 1.719 -1.556 1.00 . A A . 11 VAL CB 1 1 6 1662 1 1 11 VAL CG1 C -10.970 2.341 -2.690 1.00 . A A . 11 VAL CG1 1 1 6 1663 1 1 11 VAL CG2 C -8.697 1.614 -1.926 1.00 . A A . 11 VAL CG2 1 1 6 1664 1 1 11 VAL H H -9.375 1.100 0.958 1.00 . A A . 11 VAL H 1 1 6 1665 1 1 11 VAL HA H -10.094 3.565 -0.473 1.00 . A A . 11 VAL HA 1 1 6 1666 1 1 11 VAL HB H -10.547 0.722 -1.382 1.00 . A A . 11 VAL HB 1 1 6 1667 1 1 11 VAL HG11 H -12.000 2.022 -2.619 1.00 . A A . 11 VAL HG11 1 1 6 1668 1 1 11 VAL HG12 H -10.919 3.417 -2.619 1.00 . A A . 11 VAL HG12 1 1 6 1669 1 1 11 VAL HG13 H -10.559 2.022 -3.637 1.00 . A A . 11 VAL HG13 1 1 6 1670 1 1 11 VAL HG21 H -8.339 0.623 -1.695 1.00 . A A . 11 VAL HG21 1 1 6 1671 1 1 11 VAL HG22 H -8.577 1.803 -2.983 1.00 . A A . 11 VAL HG22 1 1 6 1672 1 1 11 VAL HG23 H -8.132 2.343 -1.364 1.00 . A A . 11 VAL HG23 1 1 6 1673 1 1 11 VAL N N -9.447 2.063 0.789 1.00 . A A . 11 VAL N 1 1 6 1674 1 1 11 VAL O O -12.123 1.799 1.171 1.00 . A A . 11 VAL O 1 1 6 1675 1 1 12 ARG C C -14.759 1.845 -0.667 1.00 . A A . 12 ARG C 1 1 6 1676 1 1 12 ARG CA C -14.095 3.148 -0.233 1.00 . A A . 12 ARG CA 1 1 6 1677 1 1 12 ARG CB C -14.783 4.334 -0.911 1.00 . A A . 12 ARG CB 1 1 6 1678 1 1 12 ARG CD C -14.834 6.814 -1.314 1.00 . A A . 12 ARG CD 1 1 6 1679 1 1 12 ARG CG C -14.197 5.682 -0.523 1.00 . A A . 12 ARG CG 1 1 6 1680 1 1 12 ARG CZ C -16.025 8.109 0.404 1.00 . A A . 12 ARG CZ 1 1 6 1681 1 1 12 ARG H H -12.353 3.645 -1.327 1.00 . A A . 12 ARG H 1 1 6 1682 1 1 12 ARG HA H -14.195 3.250 0.837 1.00 . A A . 12 ARG HA 1 1 6 1683 1 1 12 ARG HB2 H -14.695 4.223 -1.982 1.00 . A A . 12 ARG HB2 1 1 6 1684 1 1 12 ARG HB3 H -15.829 4.330 -0.642 1.00 . A A . 12 ARG HB3 1 1 6 1685 1 1 12 ARG HD2 H -14.119 7.619 -1.403 1.00 . A A . 12 ARG HD2 1 1 6 1686 1 1 12 ARG HD3 H -15.089 6.449 -2.297 1.00 . A A . 12 ARG HD3 1 1 6 1687 1 1 12 ARG HE H -16.904 7.064 -1.050 1.00 . A A . 12 ARG HE 1 1 6 1688 1 1 12 ARG HG2 H -14.371 5.850 0.529 1.00 . A A . 12 ARG HG2 1 1 6 1689 1 1 12 ARG HG3 H -13.135 5.671 -0.718 1.00 . A A . 12 ARG HG3 1 1 6 1690 1 1 12 ARG HH11 H -14.011 8.160 0.546 1.00 . A A . 12 ARG HH11 1 1 6 1691 1 1 12 ARG HH12 H -14.863 9.068 1.750 1.00 . A A . 12 ARG HH12 1 1 6 1692 1 1 12 ARG HH21 H -18.037 8.256 0.530 1.00 . A A . 12 ARG HH21 1 1 6 1693 1 1 12 ARG HH22 H -17.153 9.121 1.741 1.00 . A A . 12 ARG HH22 1 1 6 1694 1 1 12 ARG N N -12.673 3.138 -0.552 1.00 . A A . 12 ARG N 1 1 6 1695 1 1 12 ARG NE N -16.040 7.322 -0.667 1.00 . A A . 12 ARG NE 1 1 6 1696 1 1 12 ARG NH1 N -14.871 8.475 0.945 1.00 . A A . 12 ARG NH1 1 1 6 1697 1 1 12 ARG NH2 N -17.166 8.530 0.935 1.00 . A A . 12 ARG NH2 1 1 6 1698 1 1 12 ARG O O -15.958 1.808 -0.941 1.00 . A A . 12 ARG O 1 1 6 1699 1 1 13 GLY C C -14.703 -1.449 0.044 1.00 . A A . 13 GLY C 1 1 6 1700 1 1 13 GLY CA C -14.498 -0.514 -1.131 1.00 . A A . 13 GLY CA 1 1 6 1701 1 1 13 GLY H H -13.021 0.865 -0.499 1.00 . A A . 13 GLY H 1 1 6 1702 1 1 13 GLY HA2 H -15.445 -0.364 -1.628 1.00 . A A . 13 GLY HA2 1 1 6 1703 1 1 13 GLY HA3 H -13.808 -0.972 -1.825 1.00 . A A . 13 GLY HA3 1 1 6 1704 1 1 13 GLY N N -13.970 0.776 -0.729 1.00 . A A . 13 GLY N 1 1 6 1705 1 1 13 GLY O O -15.518 -1.179 0.926 1.00 . A A . 13 GLY O 1 1 6 1706 1 1 14 ASP C C -12.755 -3.633 1.904 1.00 . A A . 14 ASP C 1 1 6 1707 1 1 14 ASP CA C -14.067 -3.531 1.132 1.00 . A A . 14 ASP CA 1 1 6 1708 1 1 14 ASP CB C -14.449 -4.901 0.569 1.00 . A A . 14 ASP CB 1 1 6 1709 1 1 14 ASP CG C -14.506 -5.972 1.640 1.00 . A A . 14 ASP CG 1 1 6 1710 1 1 14 ASP H H -13.331 -2.712 -0.676 1.00 . A A . 14 ASP H 1 1 6 1711 1 1 14 ASP HA H -14.843 -3.201 1.807 1.00 . A A . 14 ASP HA 1 1 6 1712 1 1 14 ASP HB2 H -15.421 -4.833 0.103 1.00 . A A . 14 ASP HB2 1 1 6 1713 1 1 14 ASP HB3 H -13.719 -5.195 -0.171 1.00 . A A . 14 ASP HB3 1 1 6 1714 1 1 14 ASP N N -13.963 -2.552 0.056 1.00 . A A . 14 ASP N 1 1 6 1715 1 1 14 ASP O O -12.635 -3.115 3.014 1.00 . A A . 14 ASP O 1 1 6 1716 1 1 14 ASP OD1 O -14.708 -5.621 2.821 1.00 . A A . 14 ASP OD1 1 1 6 1717 1 1 14 ASP OD2 O -14.348 -7.162 1.297 1.00 . A A . 14 ASP OD2 1 1 6 1718 1 1 15 PHE C C -9.388 -3.739 1.161 1.00 . A A . 15 PHE C 1 1 6 1719 1 1 15 PHE CA C -10.472 -4.475 1.941 1.00 . A A . 15 PHE CA 1 1 6 1720 1 1 15 PHE CB C -10.123 -5.962 2.043 1.00 . A A . 15 PHE CB 1 1 6 1721 1 1 15 PHE CD1 C -10.580 -6.347 4.481 1.00 . A A . 15 PHE CD1 1 1 6 1722 1 1 15 PHE CD2 C -11.767 -7.660 2.884 1.00 . A A . 15 PHE CD2 1 1 6 1723 1 1 15 PHE CE1 C -11.236 -6.996 5.509 1.00 . A A . 15 PHE CE1 1 1 6 1724 1 1 15 PHE CE2 C -12.427 -8.313 3.908 1.00 . A A . 15 PHE CE2 1 1 6 1725 1 1 15 PHE CG C -10.838 -6.670 3.158 1.00 . A A . 15 PHE CG 1 1 6 1726 1 1 15 PHE CZ C -12.160 -7.982 5.222 1.00 . A A . 15 PHE CZ 1 1 6 1727 1 1 15 PHE H H -11.932 -4.694 0.423 1.00 . A A . 15 PHE H 1 1 6 1728 1 1 15 PHE HA H -10.530 -4.059 2.935 1.00 . A A . 15 PHE HA 1 1 6 1729 1 1 15 PHE HB2 H -10.386 -6.450 1.118 1.00 . A A . 15 PHE HB2 1 1 6 1730 1 1 15 PHE HB3 H -9.061 -6.063 2.210 1.00 . A A . 15 PHE HB3 1 1 6 1731 1 1 15 PHE HD1 H -9.856 -5.576 4.706 1.00 . A A . 15 PHE HD1 1 1 6 1732 1 1 15 PHE HD2 H -11.977 -7.921 1.857 1.00 . A A . 15 PHE HD2 1 1 6 1733 1 1 15 PHE HE1 H -11.025 -6.735 6.535 1.00 . A A . 15 PHE HE1 1 1 6 1734 1 1 15 PHE HE2 H -13.149 -9.083 3.681 1.00 . A A . 15 PHE HE2 1 1 6 1735 1 1 15 PHE HZ H -12.675 -8.490 6.024 1.00 . A A . 15 PHE HZ 1 1 6 1736 1 1 15 PHE N N -11.775 -4.304 1.309 1.00 . A A . 15 PHE N 1 1 6 1737 1 1 15 PHE O O -9.554 -3.398 -0.011 1.00 . A A . 15 PHE O 1 1 6 1738 1 1 16 PRO C C -6.387 -3.515 0.198 1.00 . A A . 16 PRO C 1 1 6 1739 1 1 16 PRO CA C -7.222 -2.594 1.055 1.00 . A A . 16 PRO CA 1 1 6 1740 1 1 16 PRO CB C -6.422 -1.979 2.228 1.00 . A A . 16 PRO CB 1 1 6 1741 1 1 16 PRO CD C -8.002 -3.538 3.211 1.00 . A A . 16 PRO CD 1 1 6 1742 1 1 16 PRO CG C -6.550 -3.037 3.343 1.00 . A A . 16 PRO CG 1 1 6 1743 1 1 16 PRO HA H -7.656 -1.792 0.434 1.00 . A A . 16 PRO HA 1 1 6 1744 1 1 16 PRO HB2 H -5.377 -1.735 1.979 1.00 . A A . 16 PRO HB2 1 1 6 1745 1 1 16 PRO HB3 H -6.928 -1.066 2.575 1.00 . A A . 16 PRO HB3 1 1 6 1746 1 1 16 PRO HD2 H -8.054 -4.569 3.580 1.00 . A A . 16 PRO HD2 1 1 6 1747 1 1 16 PRO HD3 H -8.673 -2.886 3.794 1.00 . A A . 16 PRO HD3 1 1 6 1748 1 1 16 PRO HG2 H -5.844 -3.860 3.139 1.00 . A A . 16 PRO HG2 1 1 6 1749 1 1 16 PRO HG3 H -6.371 -2.634 4.352 1.00 . A A . 16 PRO HG3 1 1 6 1750 1 1 16 PRO N N -8.237 -3.350 1.784 1.00 . A A . 16 PRO N 1 1 6 1751 1 1 16 PRO O O -6.585 -4.717 0.269 1.00 . A A . 16 PRO O 1 1 6 1752 1 1 17 ILE C C -3.345 -4.063 -1.090 1.00 . A A . 17 ILE C 1 1 6 1753 1 1 17 ILE CA C -4.737 -3.757 -1.609 1.00 . A A . 17 ILE CA 1 1 6 1754 1 1 17 ILE CB C -4.661 -3.058 -3.006 1.00 . A A . 17 ILE CB 1 1 6 1755 1 1 17 ILE CD1 C -7.089 -2.072 -2.970 1.00 . A A . 17 ILE CD1 1 1 6 1756 1 1 17 ILE CG1 C -6.046 -2.945 -3.718 1.00 . A A . 17 ILE CG1 1 1 6 1757 1 1 17 ILE CG2 C -3.672 -3.813 -3.945 1.00 . A A . 17 ILE CG2 1 1 6 1758 1 1 17 ILE H H -5.302 -1.965 -0.608 1.00 . A A . 17 ILE H 1 1 6 1759 1 1 17 ILE HA H -5.257 -4.712 -1.792 1.00 . A A . 17 ILE HA 1 1 6 1760 1 1 17 ILE HB H -4.271 -2.036 -2.875 1.00 . A A . 17 ILE HB 1 1 6 1761 1 1 17 ILE HD11 H -7.950 -1.871 -3.628 1.00 . A A . 17 ILE HD11 1 1 6 1762 1 1 17 ILE HD12 H -7.472 -2.584 -2.078 1.00 . A A . 17 ILE HD12 1 1 6 1763 1 1 17 ILE HD13 H -6.646 -1.108 -2.676 1.00 . A A . 17 ILE HD13 1 1 6 1764 1 1 17 ILE HG12 H -5.893 -2.478 -4.705 1.00 . A A . 17 ILE HG12 1 1 6 1765 1 1 17 ILE HG13 H -6.467 -3.950 -3.886 1.00 . A A . 17 ILE HG13 1 1 6 1766 1 1 17 ILE HG21 H -3.993 -4.858 -4.076 1.00 . A A . 17 ILE HG21 1 1 6 1767 1 1 17 ILE HG22 H -3.633 -3.336 -4.937 1.00 . A A . 17 ILE HG22 1 1 6 1768 1 1 17 ILE HG23 H -2.647 -3.810 -3.544 1.00 . A A . 17 ILE HG23 1 1 6 1769 1 1 17 ILE N N -5.472 -2.952 -0.631 1.00 . A A . 17 ILE N 1 1 6 1770 1 1 17 ILE O O -3.034 -5.229 -0.901 1.00 . A A . 17 ILE O 1 1 6 1771 1 1 18 SER C C -0.799 -3.190 0.880 1.00 . A A . 18 SER C 1 1 6 1772 1 1 18 SER CA C -1.067 -3.277 -0.602 1.00 . A A . 18 SER CA 1 1 6 1773 1 1 18 SER CB C -0.198 -2.247 -1.376 1.00 . A A . 18 SER CB 1 1 6 1774 1 1 18 SER H H -2.800 -2.091 -0.961 1.00 . A A . 18 SER H 1 1 6 1775 1 1 18 SER HA H -0.764 -4.281 -0.947 1.00 . A A . 18 SER HA 1 1 6 1776 1 1 18 SER HB2 H 0.848 -2.590 -1.395 1.00 . A A . 18 SER HB2 1 1 6 1777 1 1 18 SER HB3 H -0.541 -2.167 -2.421 1.00 . A A . 18 SER HB3 1 1 6 1778 1 1 18 SER HG H -1.060 -0.560 -0.689 1.00 . A A . 18 SER HG 1 1 6 1779 1 1 18 SER N N -2.485 -3.036 -0.890 1.00 . A A . 18 SER N 1 1 6 1780 1 1 18 SER O O -1.731 -2.900 1.614 1.00 . A A . 18 SER O 1 1 6 1781 1 1 18 SER OG O -0.199 -0.959 -0.739 1.00 . A A . 18 SER OG 1 1 6 1782 1 1 19 PHE C C 2.044 -2.734 3.072 1.00 . A A . 19 PHE C 1 1 6 1783 1 1 19 PHE CA C 0.757 -3.464 2.759 1.00 . A A . 19 PHE CA 1 1 6 1784 1 1 19 PHE CB C 0.695 -4.936 3.242 1.00 . A A . 19 PHE CB 1 1 6 1785 1 1 19 PHE CD1 C -1.809 -5.412 3.243 1.00 . A A . 19 PHE CD1 1 1 6 1786 1 1 19 PHE CD2 C -0.448 -6.433 1.526 1.00 . A A . 19 PHE CD2 1 1 6 1787 1 1 19 PHE CE1 C -2.952 -5.983 2.675 1.00 . A A . 19 PHE CE1 1 1 6 1788 1 1 19 PHE CE2 C -1.586 -7.026 0.972 1.00 . A A . 19 PHE CE2 1 1 6 1789 1 1 19 PHE CG C -0.553 -5.614 2.657 1.00 . A A . 19 PHE CG 1 1 6 1790 1 1 19 PHE CZ C -2.842 -6.794 1.543 1.00 . A A . 19 PHE CZ 1 1 6 1791 1 1 19 PHE H H 1.201 -3.699 0.704 1.00 . A A . 19 PHE H 1 1 6 1792 1 1 19 PHE HA H 0.011 -2.884 3.305 1.00 . A A . 19 PHE HA 1 1 6 1793 1 1 19 PHE HB2 H 1.588 -5.457 2.876 1.00 . A A . 19 PHE HB2 1 1 6 1794 1 1 19 PHE HB3 H 0.668 -5.015 4.340 1.00 . A A . 19 PHE HB3 1 1 6 1795 1 1 19 PHE HD1 H -1.900 -4.808 4.141 1.00 . A A . 19 PHE HD1 1 1 6 1796 1 1 19 PHE HD2 H 0.518 -6.612 1.065 1.00 . A A . 19 PHE HD2 1 1 6 1797 1 1 19 PHE HE1 H -3.928 -5.796 3.114 1.00 . A A . 19 PHE HE1 1 1 6 1798 1 1 19 PHE HE2 H -1.494 -7.666 0.099 1.00 . A A . 19 PHE HE2 1 1 6 1799 1 1 19 PHE HZ H -3.728 -7.244 1.104 1.00 . A A . 19 PHE HZ 1 1 6 1800 1 1 19 PHE N N 0.458 -3.445 1.327 1.00 . A A . 19 PHE N 1 1 6 1801 1 1 19 PHE O O 2.645 -2.191 2.160 1.00 . A A . 19 PHE O 1 1 6 1802 1 1 20 TYR C C 4.877 -2.236 4.187 1.00 . A A . 20 TYR C 1 1 6 1803 1 1 20 TYR CA C 3.550 -1.763 4.736 1.00 . A A . 20 TYR CA 1 1 6 1804 1 1 20 TYR CB C 3.620 -1.572 6.284 1.00 . A A . 20 TYR CB 1 1 6 1805 1 1 20 TYR CD1 C 3.094 0.893 6.530 1.00 . A A . 20 TYR CD1 1 1 6 1806 1 1 20 TYR CD2 C 5.297 0.150 7.178 1.00 . A A . 20 TYR CD2 1 1 6 1807 1 1 20 TYR CE1 C 3.441 2.211 6.837 1.00 . A A . 20 TYR CE1 1 1 6 1808 1 1 20 TYR CE2 C 5.643 1.468 7.493 1.00 . A A . 20 TYR CE2 1 1 6 1809 1 1 20 TYR CG C 4.026 -0.143 6.674 1.00 . A A . 20 TYR CG 1 1 6 1810 1 1 20 TYR CZ C 4.722 2.505 7.321 1.00 . A A . 20 TYR CZ 1 1 6 1811 1 1 20 TYR H H 1.986 -3.184 5.070 1.00 . A A . 20 TYR H 1 1 6 1812 1 1 20 TYR HA H 3.339 -0.788 4.271 1.00 . A A . 20 TYR HA 1 1 6 1813 1 1 20 TYR HB2 H 2.626 -1.710 6.731 1.00 . A A . 20 TYR HB2 1 1 6 1814 1 1 20 TYR HB3 H 4.283 -2.327 6.735 1.00 . A A . 20 TYR HB3 1 1 6 1815 1 1 20 TYR HD1 H 2.090 0.674 6.180 1.00 . A A . 20 TYR HD1 1 1 6 1816 1 1 20 TYR HD2 H 6.022 -0.643 7.325 1.00 . A A . 20 TYR HD2 1 1 6 1817 1 1 20 TYR HE1 H 2.707 2.999 6.697 1.00 . A A . 20 TYR HE1 1 1 6 1818 1 1 20 TYR HE2 H 6.634 1.690 7.875 1.00 . A A . 20 TYR HE2 1 1 6 1819 1 1 20 TYR HH H 4.415 4.464 7.503 1.00 . A A . 20 TYR HH 1 1 6 1820 1 1 20 TYR N N 2.462 -2.670 4.358 1.00 . A A . 20 TYR N 1 1 6 1821 1 1 20 TYR O O 4.944 -3.340 3.673 1.00 . A A . 20 TYR O 1 1 6 1822 1 1 20 TYR OH O 5.099 3.816 7.636 1.00 . A A . 20 TYR OH 1 1 6 1823 1 1 21 GLY C C 8.361 -1.007 4.391 1.00 . A A . 21 GLY C 1 1 6 1824 1 1 21 GLY CA C 7.264 -1.876 3.844 1.00 . A A . 21 GLY CA 1 1 6 1825 1 1 21 GLY H H 5.867 -0.487 4.646 1.00 . A A . 21 GLY H 1 1 6 1826 1 1 21 GLY HA2 H 7.461 -2.903 4.192 1.00 . A A . 21 GLY HA2 1 1 6 1827 1 1 21 GLY HA3 H 7.314 -1.855 2.745 1.00 . A A . 21 GLY HA3 1 1 6 1828 1 1 21 GLY N N 5.951 -1.419 4.289 1.00 . A A . 21 GLY N 1 1 6 1829 1 1 21 GLY O O 9.483 -1.041 3.819 1.00 . A A . 21 GLY O 1 1 6 1830 1 1 21 GLY OXT O 8.110 -0.295 5.401 1.00 . A A . 21 GLY OXT 1 1 7 1831 1 1 1 GLY C C 3.633 -1.271 -0.781 1.00 . A A . 1 GLY C 1 1 7 1832 1 1 1 GLY CA C 2.834 -0.001 -0.619 1.00 . A A . 1 GLY CA 1 1 7 1833 1 1 1 GLY H1 H 1.607 -0.819 0.902 1.00 . A A . 1 GLY H1 1 1 7 1834 1 1 1 GLY HA2 H 2.067 0.090 -1.404 1.00 . A A . 1 GLY HA2 1 1 7 1835 1 1 1 GLY HA3 H 3.552 0.827 -0.748 1.00 . A A . 1 GLY HA3 1 1 7 1836 1 1 1 GLY N N 2.142 -0.004 0.667 1.00 . A A . 1 GLY N 1 1 7 1837 1 1 1 GLY O O 3.539 -1.910 -1.818 1.00 . A A . 1 GLY O 1 1 7 1838 1 1 2 GLY C C 4.412 -4.096 0.333 1.00 . A A . 2 GLY C 1 1 7 1839 1 1 2 GLY CA C 5.248 -2.853 0.145 1.00 . A A . 2 GLY CA 1 1 7 1840 1 1 2 GLY H H 4.486 -1.101 1.087 1.00 . A A . 2 GLY H 1 1 7 1841 1 1 2 GLY HA2 H 5.744 -2.900 -0.837 1.00 . A A . 2 GLY HA2 1 1 7 1842 1 1 2 GLY HA3 H 6.037 -2.830 0.913 1.00 . A A . 2 GLY HA3 1 1 7 1843 1 1 2 GLY N N 4.439 -1.639 0.242 1.00 . A A . 2 GLY N 1 1 7 1844 1 1 2 GLY O O 3.197 -4.011 0.249 1.00 . A A . 2 GLY O 1 1 7 1845 1 1 3 ALA C C 4.333 -6.887 2.241 1.00 . A A . 3 ALA C 1 1 7 1846 1 1 3 ALA CA C 4.338 -6.517 0.773 1.00 . A A . 3 ALA CA 1 1 7 1847 1 1 3 ALA CB C 5.002 -7.617 -0.095 1.00 . A A . 3 ALA CB 1 1 7 1848 1 1 3 ALA H H 6.063 -5.281 0.663 1.00 . A A . 3 ALA H 1 1 7 1849 1 1 3 ALA HA H 3.294 -6.444 0.430 1.00 . A A . 3 ALA HA 1 1 7 1850 1 1 3 ALA HB1 H 6.040 -7.791 0.230 1.00 . A A . 3 ALA HB1 1 1 7 1851 1 1 3 ALA HB2 H 4.442 -8.562 -0.017 1.00 . A A . 3 ALA HB2 1 1 7 1852 1 1 3 ALA HB3 H 5.011 -7.298 -1.149 1.00 . A A . 3 ALA HB3 1 1 7 1853 1 1 3 ALA N N 5.064 -5.259 0.583 1.00 . A A . 3 ALA N 1 1 7 1854 1 1 3 ALA O O 4.589 -8.034 2.573 1.00 . A A . 3 ALA O 1 1 7 1855 1 1 4 GLY C C 2.793 -6.791 5.101 1.00 . A A . 4 GLY C 1 1 7 1856 1 1 4 GLY CA C 4.084 -6.196 4.578 1.00 . A A . 4 GLY CA 1 1 7 1857 1 1 4 GLY H H 3.822 -4.987 2.844 1.00 . A A . 4 GLY H 1 1 7 1858 1 1 4 GLY HA2 H 4.900 -6.897 4.816 1.00 . A A . 4 GLY HA2 1 1 7 1859 1 1 4 GLY HA3 H 4.310 -5.257 5.109 1.00 . A A . 4 GLY HA3 1 1 7 1860 1 1 4 GLY N N 4.047 -5.918 3.142 1.00 . A A . 4 GLY N 1 1 7 1861 1 1 4 GLY O O 2.131 -7.495 4.353 1.00 . A A . 4 GLY O 1 1 7 1862 1 1 5 HIS C C 0.249 -6.087 7.377 1.00 . A A . 5 HIS C 1 1 7 1863 1 1 5 HIS CA C 1.313 -7.133 7.060 1.00 . A A . 5 HIS CA 1 1 7 1864 1 1 5 HIS CB C 1.759 -7.830 8.346 1.00 . A A . 5 HIS CB 1 1 7 1865 1 1 5 HIS CD2 C 2.418 -9.982 7.056 1.00 . A A . 5 HIS CD2 1 1 7 1866 1 1 5 HIS CE1 C 3.785 -10.839 8.541 1.00 . A A . 5 HIS CE1 1 1 7 1867 1 1 5 HIS CG C 2.460 -9.133 8.110 1.00 . A A . 5 HIS CG 1 1 7 1868 1 1 5 HIS H H 3.069 -5.961 6.908 1.00 . A A . 5 HIS H 1 1 7 1869 1 1 5 HIS HA H 0.890 -7.868 6.392 1.00 . A A . 5 HIS HA 1 1 7 1870 1 1 5 HIS HB2 H 2.437 -7.182 8.882 1.00 . A A . 5 HIS HB2 1 1 7 1871 1 1 5 HIS HB3 H 0.893 -8.025 8.962 1.00 . A A . 5 HIS HB3 1 1 7 1872 1 1 5 HIS HD1 H 3.564 -9.321 9.894 1.00 . A A . 5 HIS HD1 1 1 7 1873 1 1 5 HIS HD2 H 1.839 -9.855 6.152 1.00 . A A . 5 HIS HD2 1 1 7 1874 1 1 5 HIS HE1 H 4.480 -11.500 9.036 1.00 . A A . 5 HIS HE1 1 1 7 1875 1 1 5 HIS N N 2.457 -6.524 6.391 1.00 . A A . 5 HIS N 1 1 7 1876 1 1 5 HIS ND1 N 3.324 -9.699 9.023 1.00 . A A . 5 HIS ND1 1 1 7 1877 1 1 5 HIS NE2 N 3.250 -11.034 7.348 1.00 . A A . 5 HIS NE2 1 1 7 1878 1 1 5 HIS O O -0.918 -6.418 7.589 1.00 . A A . 5 HIS O 1 1 7 1879 1 1 6 VAL C C -0.686 -2.867 6.797 1.00 . A A . 6 VAL C 1 1 7 1880 1 1 6 VAL CA C -0.347 -3.757 7.974 1.00 . A A . 6 VAL CA 1 1 7 1881 1 1 6 VAL CB C 0.331 -2.934 9.111 1.00 . A A . 6 VAL CB 1 1 7 1882 1 1 6 VAL CG1 C -0.598 -1.815 9.657 1.00 . A A . 6 VAL CG1 1 1 7 1883 1 1 6 VAL CG2 C 0.776 -3.875 10.267 1.00 . A A . 6 VAL CG2 1 1 7 1884 1 1 6 VAL H H 1.506 -4.430 7.266 1.00 . A A . 6 VAL H 1 1 7 1885 1 1 6 VAL HA H -1.240 -4.219 8.416 1.00 . A A . 6 VAL HA 1 1 7 1886 1 1 6 VAL HB H 1.232 -2.444 8.704 1.00 . A A . 6 VAL HB 1 1 7 1887 1 1 6 VAL HG11 H -0.057 -1.211 10.402 1.00 . A A . 6 VAL HG11 1 1 7 1888 1 1 6 VAL HG12 H -0.931 -1.142 8.851 1.00 . A A . 6 VAL HG12 1 1 7 1889 1 1 6 VAL HG13 H -1.483 -2.251 10.146 1.00 . A A . 6 VAL HG13 1 1 7 1890 1 1 6 VAL HG21 H 1.488 -4.635 9.909 1.00 . A A . 6 VAL HG21 1 1 7 1891 1 1 6 VAL HG22 H 1.270 -3.294 11.061 1.00 . A A . 6 VAL HG22 1 1 7 1892 1 1 6 VAL HG23 H -0.093 -4.391 10.701 1.00 . A A . 6 VAL HG23 1 1 7 1893 1 1 6 VAL N N 0.595 -4.774 7.486 1.00 . A A . 6 VAL N 1 1 7 1894 1 1 6 VAL O O 0.260 -2.478 6.132 1.00 . A A . 6 VAL O 1 1 7 1895 1 1 7 PRO C C -1.641 -0.390 5.239 1.00 . A A . 7 PRO C 1 1 7 1896 1 1 7 PRO CA C -2.187 -1.797 5.219 1.00 . A A . 7 PRO CA 1 1 7 1897 1 1 7 PRO CB C -3.725 -1.858 5.127 1.00 . A A . 7 PRO CB 1 1 7 1898 1 1 7 PRO CD C -3.122 -2.884 7.246 1.00 . A A . 7 PRO CD 1 1 7 1899 1 1 7 PRO CG C -4.168 -1.944 6.603 1.00 . A A . 7 PRO CG 1 1 7 1900 1 1 7 PRO HA H -1.778 -2.371 4.382 1.00 . A A . 7 PRO HA 1 1 7 1901 1 1 7 PRO HB2 H -4.172 -1.015 4.576 1.00 . A A . 7 PRO HB2 1 1 7 1902 1 1 7 PRO HB3 H -3.996 -2.804 4.631 1.00 . A A . 7 PRO HB3 1 1 7 1903 1 1 7 PRO HD2 H -3.050 -2.685 8.325 1.00 . A A . 7 PRO HD2 1 1 7 1904 1 1 7 PRO HD3 H -3.375 -3.942 7.064 1.00 . A A . 7 PRO HD3 1 1 7 1905 1 1 7 PRO HG2 H -4.088 -0.939 7.052 1.00 . A A . 7 PRO HG2 1 1 7 1906 1 1 7 PRO HG3 H -5.197 -2.320 6.725 1.00 . A A . 7 PRO HG3 1 1 7 1907 1 1 7 PRO N N -1.952 -2.513 6.463 1.00 . A A . 7 PRO N 1 1 7 1908 1 1 7 PRO O O -1.531 0.187 6.308 1.00 . A A . 7 PRO O 1 1 7 1909 1 1 8 GLU C C -1.956 2.497 3.943 1.00 . A A . 8 GLU C 1 1 7 1910 1 1 8 GLU CA C -0.790 1.534 3.974 1.00 . A A . 8 GLU CA 1 1 7 1911 1 1 8 GLU CB C 0.077 1.740 2.699 1.00 . A A . 8 GLU CB 1 1 7 1912 1 1 8 GLU CD C 2.178 1.062 1.499 1.00 . A A . 8 GLU CD 1 1 7 1913 1 1 8 GLU CG C 1.431 0.995 2.814 1.00 . A A . 8 GLU CG 1 1 7 1914 1 1 8 GLU H H -1.416 -0.350 3.197 1.00 . A A . 8 GLU H 1 1 7 1915 1 1 8 GLU HA H -0.158 1.763 4.849 1.00 . A A . 8 GLU HA 1 1 7 1916 1 1 8 GLU HB2 H -0.469 1.385 1.810 1.00 . A A . 8 GLU HB2 1 1 7 1917 1 1 8 GLU HB3 H 0.284 2.815 2.567 1.00 . A A . 8 GLU HB3 1 1 7 1918 1 1 8 GLU HG2 H 2.066 1.472 3.577 1.00 . A A . 8 GLU HG2 1 1 7 1919 1 1 8 GLU HG3 H 1.237 -0.037 3.143 1.00 . A A . 8 GLU HG3 1 1 7 1920 1 1 8 GLU N N -1.294 0.161 4.051 1.00 . A A . 8 GLU N 1 1 7 1921 1 1 8 GLU O O -1.931 3.475 4.673 1.00 . A A . 8 GLU O 1 1 7 1922 1 1 8 GLU OE1 O 2.786 2.087 1.238 1.00 . A A . 8 GLU OE1 1 1 7 1923 1 1 9 TYR C C -5.381 2.338 2.818 1.00 . A A . 9 TYR C 1 1 7 1924 1 1 9 TYR CA C -4.114 3.143 2.970 1.00 . A A . 9 TYR CA 1 1 7 1925 1 1 9 TYR CB C -3.885 4.048 1.731 1.00 . A A . 9 TYR CB 1 1 7 1926 1 1 9 TYR CD1 C -4.464 2.507 -0.218 1.00 . A A . 9 TYR CD1 1 1 7 1927 1 1 9 TYR CD2 C -2.145 3.065 0.150 1.00 . A A . 9 TYR CD2 1 1 7 1928 1 1 9 TYR CE1 C -4.096 1.677 -1.281 1.00 . A A . 9 TYR CE1 1 1 7 1929 1 1 9 TYR CE2 C -1.776 2.232 -0.909 1.00 . A A . 9 TYR CE2 1 1 7 1930 1 1 9 TYR CG C -3.489 3.187 0.521 1.00 . A A . 9 TYR CG 1 1 7 1931 1 1 9 TYR CZ C -2.747 1.533 -1.631 1.00 . A A . 9 TYR CZ 1 1 7 1932 1 1 9 TYR H H -2.970 1.419 2.509 1.00 . A A . 9 TYR H 1 1 7 1933 1 1 9 TYR HA H -4.237 3.767 3.870 1.00 . A A . 9 TYR HA 1 1 7 1934 1 1 9 TYR HB2 H -4.789 4.630 1.493 1.00 . A A . 9 TYR HB2 1 1 7 1935 1 1 9 TYR HB3 H -3.080 4.764 1.961 1.00 . A A . 9 TYR HB3 1 1 7 1936 1 1 9 TYR HD1 H -5.515 2.620 0.033 1.00 . A A . 9 TYR HD1 1 1 7 1937 1 1 9 TYR HD2 H -1.378 3.616 0.684 1.00 . A A . 9 TYR HD2 1 1 7 1938 1 1 9 TYR HE1 H -4.868 1.148 -1.831 1.00 . A A . 9 TYR HE1 1 1 7 1939 1 1 9 TYR HE2 H -0.729 2.127 -1.175 1.00 . A A . 9 TYR HE2 1 1 7 1940 1 1 9 TYR HH H -3.066 0.282 -3.145 1.00 . A A . 9 TYR HH 1 1 7 1941 1 1 9 TYR N N -2.979 2.229 3.099 1.00 . A A . 9 TYR N 1 1 7 1942 1 1 9 TYR O O -5.270 1.141 2.604 1.00 . A A . 9 TYR O 1 1 7 1943 1 1 9 TYR OH O -2.350 0.707 -2.688 1.00 . A A . 9 TYR OH 1 1 7 1944 1 1 10 PHE C C -8.680 2.880 1.694 1.00 . A A . 10 PHE C 1 1 7 1945 1 1 10 PHE CA C -7.834 2.258 2.783 1.00 . A A . 10 PHE CA 1 1 7 1946 1 1 10 PHE CB C -8.647 2.290 4.101 1.00 . A A . 10 PHE CB 1 1 7 1947 1 1 10 PHE CD1 C -7.005 2.036 6.034 1.00 . A A . 10 PHE CD1 1 1 7 1948 1 1 10 PHE CD2 C -8.245 0.091 5.311 1.00 . A A . 10 PHE CD2 1 1 7 1949 1 1 10 PHE CE1 C -6.457 1.293 7.085 1.00 . A A . 10 PHE CE1 1 1 7 1950 1 1 10 PHE CE2 C -7.700 -0.652 6.359 1.00 . A A . 10 PHE CE2 1 1 7 1951 1 1 10 PHE CG C -7.943 1.452 5.177 1.00 . A A . 10 PHE CG 1 1 7 1952 1 1 10 PHE CZ C -6.836 -0.038 7.272 1.00 . A A . 10 PHE CZ 1 1 7 1953 1 1 10 PHE H H -6.620 3.964 3.110 1.00 . A A . 10 PHE H 1 1 7 1954 1 1 10 PHE HA H -7.649 1.200 2.544 1.00 . A A . 10 PHE HA 1 1 7 1955 1 1 10 PHE HB2 H -8.765 3.331 4.444 1.00 . A A . 10 PHE HB2 1 1 7 1956 1 1 10 PHE HB3 H -9.658 1.883 3.931 1.00 . A A . 10 PHE HB3 1 1 7 1957 1 1 10 PHE HD1 H -6.701 3.067 5.889 1.00 . A A . 10 PHE HD1 1 1 7 1958 1 1 10 PHE HD2 H -8.909 -0.392 4.600 1.00 . A A . 10 PHE HD2 1 1 7 1959 1 1 10 PHE HE1 H -5.739 1.752 7.757 1.00 . A A . 10 PHE HE1 1 1 7 1960 1 1 10 PHE HE2 H -7.947 -1.703 6.467 1.00 . A A . 10 PHE HE2 1 1 7 1961 1 1 10 PHE HZ H -6.460 -0.595 8.124 1.00 . A A . 10 PHE HZ 1 1 7 1962 1 1 10 PHE N N -6.571 2.980 2.925 1.00 . A A . 10 PHE N 1 1 7 1963 1 1 10 PHE O O -8.641 4.093 1.553 1.00 . A A . 10 PHE O 1 1 7 1964 1 1 11 VAL C C -11.793 2.451 0.346 1.00 . A A . 11 VAL C 1 1 7 1965 1 1 11 VAL CA C -10.338 2.529 -0.103 1.00 . A A . 11 VAL CA 1 1 7 1966 1 1 11 VAL CB C -10.170 1.724 -1.405 1.00 . A A . 11 VAL CB 1 1 7 1967 1 1 11 VAL CG1 C -10.975 2.354 -2.531 1.00 . A A . 11 VAL CG1 1 1 7 1968 1 1 11 VAL CG2 C -8.700 1.622 -1.782 1.00 . A A . 11 VAL CG2 1 1 7 1969 1 1 11 VAL H H -9.368 1.084 1.101 1.00 . A A . 11 VAL H 1 1 7 1970 1 1 11 VAL HA H -10.090 3.561 -0.308 1.00 . A A . 11 VAL HA 1 1 7 1971 1 1 11 VAL HB H -10.547 0.726 -1.238 1.00 . A A . 11 VAL HB 1 1 7 1972 1 1 11 VAL HG11 H -10.566 2.045 -3.482 1.00 . A A . 11 VAL HG11 1 1 7 1973 1 1 11 VAL HG12 H -12.005 2.037 -2.460 1.00 . A A . 11 VAL HG12 1 1 7 1974 1 1 11 VAL HG13 H -10.923 3.430 -2.452 1.00 . A A . 11 VAL HG13 1 1 7 1975 1 1 11 VAL HG21 H -8.263 2.610 -1.794 1.00 . A A . 11 VAL HG21 1 1 7 1976 1 1 11 VAL HG22 H -8.183 1.010 -1.057 1.00 . A A . 11 VAL HG22 1 1 7 1977 1 1 11 VAL HG23 H -8.608 1.175 -2.760 1.00 . A A . 11 VAL HG23 1 1 7 1978 1 1 11 VAL N N -9.440 2.048 0.939 1.00 . A A . 11 VAL N 1 1 7 1979 1 1 11 VAL O O -12.115 1.782 1.328 1.00 . A A . 11 VAL O 1 1 7 1980 1 1 12 ARG C C -14.758 1.850 -0.505 1.00 . A A . 12 ARG C 1 1 7 1981 1 1 12 ARG CA C -14.090 3.146 -0.057 1.00 . A A . 12 ARG CA 1 1 7 1982 1 1 12 ARG CB C -14.779 4.342 -0.718 1.00 . A A . 12 ARG CB 1 1 7 1983 1 1 12 ARG CD C -14.960 6.839 -0.936 1.00 . A A . 12 ARG CD 1 1 7 1984 1 1 12 ARG CG C -14.299 5.686 -0.196 1.00 . A A . 12 ARG CG 1 1 7 1985 1 1 12 ARG CZ C -16.678 8.528 -0.446 1.00 . A A . 12 ARG CZ 1 1 7 1986 1 1 12 ARG H H -12.351 3.652 -1.152 1.00 . A A . 12 ARG H 1 1 7 1987 1 1 12 ARG HA H -14.186 3.235 1.015 1.00 . A A . 12 ARG HA 1 1 7 1988 1 1 12 ARG HB2 H -14.593 4.307 -1.782 1.00 . A A . 12 ARG HB2 1 1 7 1989 1 1 12 ARG HB3 H -15.842 4.271 -0.544 1.00 . A A . 12 ARG HB3 1 1 7 1990 1 1 12 ARG HD2 H -14.248 7.646 -1.026 1.00 . A A . 12 ARG HD2 1 1 7 1991 1 1 12 ARG HD3 H -15.247 6.500 -1.920 1.00 . A A . 12 ARG HD3 1 1 7 1992 1 1 12 ARG HE H -16.563 6.734 0.420 1.00 . A A . 12 ARG HE 1 1 7 1993 1 1 12 ARG HG2 H -14.540 5.761 0.854 1.00 . A A . 12 ARG HG2 1 1 7 1994 1 1 12 ARG HG3 H -13.229 5.752 -0.328 1.00 . A A . 12 ARG HG3 1 1 7 1995 1 1 12 ARG HH11 H -15.322 9.074 -1.839 1.00 . A A . 12 ARG HH11 1 1 7 1996 1 1 12 ARG HH12 H -16.539 10.256 -1.485 1.00 . A A . 12 ARG HH12 1 1 7 1997 1 1 12 ARG HH21 H -18.171 8.281 0.895 1.00 . A A . 12 ARG HH21 1 1 7 1998 1 1 12 ARG HH22 H -18.158 9.804 0.071 1.00 . A A . 12 ARG HH22 1 1 7 1999 1 1 12 ARG N N -12.669 3.138 -0.381 1.00 . A A . 12 ARG N 1 1 7 2000 1 1 12 ARG NE N -16.145 7.329 -0.237 1.00 . A A . 12 ARG NE 1 1 7 2001 1 1 12 ARG NH1 N -16.135 9.354 -1.329 1.00 . A A . 12 ARG NH1 1 1 7 2002 1 1 12 ARG NH2 N -17.758 8.902 0.229 1.00 . A A . 12 ARG NH2 1 1 7 2003 1 1 12 ARG O O -15.960 1.816 -0.766 1.00 . A A . 12 ARG O 1 1 7 2004 1 1 13 GLY C C -14.692 -1.455 0.151 1.00 . A A . 13 GLY C 1 1 7 2005 1 1 13 GLY CA C -14.500 -0.501 -1.011 1.00 . A A . 13 GLY CA 1 1 7 2006 1 1 13 GLY H H -13.017 0.869 -0.373 1.00 . A A . 13 GLY H 1 1 7 2007 1 1 13 GLY HA2 H -15.452 -0.344 -1.496 1.00 . A A . 13 GLY HA2 1 1 7 2008 1 1 13 GLY HA3 H -13.817 -0.947 -1.719 1.00 . A A . 13 GLY HA3 1 1 7 2009 1 1 13 GLY N N -13.968 0.783 -0.594 1.00 . A A . 13 GLY N 1 1 7 2010 1 1 13 GLY O O -15.501 -1.201 1.044 1.00 . A A . 13 GLY O 1 1 7 2011 1 1 14 ASP C C -12.723 -3.660 1.961 1.00 . A A . 14 ASP C 1 1 7 2012 1 1 14 ASP CA C -14.041 -3.552 1.201 1.00 . A A . 14 ASP CA 1 1 7 2013 1 1 14 ASP CB C -14.422 -4.914 0.619 1.00 . A A . 14 ASP CB 1 1 7 2014 1 1 14 ASP CG C -14.460 -6.003 1.673 1.00 . A A . 14 ASP CG 1 1 7 2015 1 1 14 ASP H H -13.322 -2.702 -0.600 1.00 . A A . 14 ASP H 1 1 7 2016 1 1 14 ASP HA H -14.813 -3.235 1.887 1.00 . A A . 14 ASP HA 1 1 7 2017 1 1 14 ASP HB2 H -15.401 -4.844 0.166 1.00 . A A . 14 ASP HB2 1 1 7 2018 1 1 14 ASP HB3 H -13.700 -5.191 -0.134 1.00 . A A . 14 ASP HB3 1 1 7 2019 1 1 14 ASP N N -13.949 -2.556 0.140 1.00 . A A . 14 ASP N 1 1 7 2020 1 1 14 ASP O O -12.595 -3.158 3.078 1.00 . A A . 14 ASP O 1 1 7 2021 1 1 14 ASP OD1 O -14.788 -5.692 2.836 1.00 . A A . 14 ASP OD1 1 1 7 2022 1 1 14 ASP OD2 O -14.159 -7.168 1.334 1.00 . A A . 14 ASP OD2 1 1 7 2023 1 1 15 PHE C C -9.362 -3.740 1.193 1.00 . A A . 15 PHE C 1 1 7 2024 1 1 15 PHE CA C -10.437 -4.496 1.969 1.00 . A A . 15 PHE CA 1 1 7 2025 1 1 15 PHE CB C -10.080 -5.982 2.041 1.00 . A A . 15 PHE CB 1 1 7 2026 1 1 15 PHE CD1 C -10.709 -6.260 4.455 1.00 . A A . 15 PHE CD1 1 1 7 2027 1 1 15 PHE CD2 C -11.520 -7.857 2.881 1.00 . A A . 15 PHE CD2 1 1 7 2028 1 1 15 PHE CE1 C -11.356 -6.931 5.475 1.00 . A A . 15 PHE CE1 1 1 7 2029 1 1 15 PHE CE2 C -12.169 -8.532 3.897 1.00 . A A . 15 PHE CE2 1 1 7 2030 1 1 15 PHE CG C -10.784 -6.714 3.148 1.00 . A A . 15 PHE CG 1 1 7 2031 1 1 15 PHE CZ C -12.086 -8.070 5.196 1.00 . A A . 15 PHE CZ 1 1 7 2032 1 1 15 PHE H H -11.908 -4.698 0.459 1.00 . A A . 15 PHE H 1 1 7 2033 1 1 15 PHE HA H -10.489 -4.097 2.970 1.00 . A A . 15 PHE HA 1 1 7 2034 1 1 15 PHE HB2 H -10.347 -6.455 1.109 1.00 . A A . 15 PHE HB2 1 1 7 2035 1 1 15 PHE HB3 H -9.017 -6.082 2.199 1.00 . A A . 15 PHE HB3 1 1 7 2036 1 1 15 PHE HD1 H -10.137 -5.369 4.674 1.00 . A A . 15 PHE HD1 1 1 7 2037 1 1 15 PHE HD2 H -11.585 -8.221 1.866 1.00 . A A . 15 PHE HD2 1 1 7 2038 1 1 15 PHE HE1 H -11.288 -6.566 6.489 1.00 . A A . 15 PHE HE1 1 1 7 2039 1 1 15 PHE HE2 H -12.740 -9.422 3.677 1.00 . A A . 15 PHE HE2 1 1 7 2040 1 1 15 PHE HZ H -12.593 -8.595 5.992 1.00 . A A . 15 PHE HZ 1 1 7 2041 1 1 15 PHE N N -11.745 -4.320 1.349 1.00 . A A . 15 PHE N 1 1 7 2042 1 1 15 PHE O O -9.538 -3.379 0.029 1.00 . A A . 15 PHE O 1 1 7 2043 1 1 16 PRO C C -6.389 -3.511 0.197 1.00 . A A . 16 PRO C 1 1 7 2044 1 1 16 PRO CA C -7.190 -2.601 1.098 1.00 . A A . 16 PRO CA 1 1 7 2045 1 1 16 PRO CB C -6.369 -2.037 2.287 1.00 . A A . 16 PRO CB 1 1 7 2046 1 1 16 PRO CD C -7.982 -3.568 3.246 1.00 . A A . 16 PRO CD 1 1 7 2047 1 1 16 PRO CG C -6.513 -3.120 3.376 1.00 . A A . 16 PRO CG 1 1 7 2048 1 1 16 PRO HA H -7.621 -1.778 0.503 1.00 . A A . 16 PRO HA 1 1 7 2049 1 1 16 PRO HB2 H -5.319 -1.808 2.049 1.00 . A A . 16 PRO HB2 1 1 7 2050 1 1 16 PRO HB3 H -6.853 -1.120 2.661 1.00 . A A . 16 PRO HB3 1 1 7 2051 1 1 16 PRO HD2 H -8.079 -4.598 3.613 1.00 . A A . 16 PRO HD2 1 1 7 2052 1 1 16 PRO HD3 H -8.627 -2.892 3.830 1.00 . A A . 16 PRO HD3 1 1 7 2053 1 1 16 PRO HG2 H -5.837 -3.960 3.141 1.00 . A A . 16 PRO HG2 1 1 7 2054 1 1 16 PRO HG3 H -6.313 -2.754 4.394 1.00 . A A . 16 PRO HG3 1 1 7 2055 1 1 16 PRO N N -8.209 -3.362 1.820 1.00 . A A . 16 PRO N 1 1 7 2056 1 1 16 PRO O O -6.712 -4.688 0.138 1.00 . A A . 16 PRO O 1 1 7 2057 1 1 17 ILE C C -3.219 -4.051 -1.031 1.00 . A A . 17 ILE C 1 1 7 2058 1 1 17 ILE CA C -4.632 -3.774 -1.506 1.00 . A A . 17 ILE CA 1 1 7 2059 1 1 17 ILE CB C -4.627 -3.095 -2.915 1.00 . A A . 17 ILE CB 1 1 7 2060 1 1 17 ILE CD1 C -6.590 -1.377 -3.085 1.00 . A A . 17 ILE CD1 1 1 7 2061 1 1 17 ILE CG1 C -6.074 -2.802 -3.436 1.00 . A A . 17 ILE CG1 1 1 7 2062 1 1 17 ILE CG2 C -3.854 -3.990 -3.931 1.00 . A A . 17 ILE CG2 1 1 7 2063 1 1 17 ILE H H -5.095 -2.021 -0.397 1.00 . A A . 17 ILE H 1 1 7 2064 1 1 17 ILE HA H -5.118 -4.753 -1.655 1.00 . A A . 17 ILE HA 1 1 7 2065 1 1 17 ILE HB H -4.084 -2.138 -2.860 1.00 . A A . 17 ILE HB 1 1 7 2066 1 1 17 ILE HD11 H -5.928 -0.613 -3.525 1.00 . A A . 17 ILE HD11 1 1 7 2067 1 1 17 ILE HD12 H -7.600 -1.234 -3.501 1.00 . A A . 17 ILE HD12 1 1 7 2068 1 1 17 ILE HD13 H -6.645 -1.212 -2.000 1.00 . A A . 17 ILE HD13 1 1 7 2069 1 1 17 ILE HG12 H -6.095 -2.870 -4.537 1.00 . A A . 17 ILE HG12 1 1 7 2070 1 1 17 ILE HG13 H -6.779 -3.557 -3.050 1.00 . A A . 17 ILE HG13 1 1 7 2071 1 1 17 ILE HG21 H -4.367 -4.957 -4.055 1.00 . A A . 17 ILE HG21 1 1 7 2072 1 1 17 ILE HG22 H -3.794 -3.499 -4.916 1.00 . A A . 17 ILE HG22 1 1 7 2073 1 1 17 ILE HG23 H -2.822 -4.180 -3.597 1.00 . A A . 17 ILE HG23 1 1 7 2074 1 1 17 ILE N N -5.364 -2.979 -0.517 1.00 . A A . 17 ILE N 1 1 7 2075 1 1 17 ILE O O -2.888 -5.210 -0.836 1.00 . A A . 17 ILE O 1 1 7 2076 1 1 18 SER C C -0.699 -3.059 0.913 1.00 . A A . 18 SER C 1 1 7 2077 1 1 18 SER CA C -0.949 -3.242 -0.565 1.00 . A A . 18 SER CA 1 1 7 2078 1 1 18 SER CB C -0.138 -2.223 -1.407 1.00 . A A . 18 SER CB 1 1 7 2079 1 1 18 SER H H -2.670 -2.063 -0.945 1.00 . A A . 18 SER H 1 1 7 2080 1 1 18 SER HA H -0.623 -4.260 -0.840 1.00 . A A . 18 SER HA 1 1 7 2081 1 1 18 SER HB2 H 0.936 -2.306 -1.186 1.00 . A A . 18 SER HB2 1 1 7 2082 1 1 18 SER HB3 H -0.283 -2.429 -2.479 1.00 . A A . 18 SER HB3 1 1 7 2083 1 1 18 SER HG H -0.526 -0.598 -0.287 1.00 . A A . 18 SER HG 1 1 7 2084 1 1 18 SER N N -2.364 -3.014 -0.865 1.00 . A A . 18 SER N 1 1 7 2085 1 1 18 SER O O -1.639 -2.706 1.608 1.00 . A A . 18 SER O 1 1 7 2086 1 1 18 SER OG O -0.615 -0.885 -1.190 1.00 . A A . 18 SER OG 1 1 7 2087 1 1 19 PHE C C 2.138 -2.575 3.154 1.00 . A A . 19 PHE C 1 1 7 2088 1 1 19 PHE CA C 0.798 -3.198 2.841 1.00 . A A . 19 PHE CA 1 1 7 2089 1 1 19 PHE CB C 0.568 -4.579 3.518 1.00 . A A . 19 PHE CB 1 1 7 2090 1 1 19 PHE CD1 C 0.069 -6.297 1.718 1.00 . A A . 19 PHE CD1 1 1 7 2091 1 1 19 PHE CD2 C -1.789 -5.404 2.973 1.00 . A A . 19 PHE CD2 1 1 7 2092 1 1 19 PHE CE1 C -0.806 -7.098 0.980 1.00 . A A . 19 PHE CE1 1 1 7 2093 1 1 19 PHE CE2 C -2.670 -6.196 2.229 1.00 . A A . 19 PHE CE2 1 1 7 2094 1 1 19 PHE CG C -0.415 -5.446 2.719 1.00 . A A . 19 PHE CG 1 1 7 2095 1 1 19 PHE CZ C -2.178 -7.053 1.239 1.00 . A A . 19 PHE CZ 1 1 7 2096 1 1 19 PHE H H 1.299 -3.611 0.825 1.00 . A A . 19 PHE H 1 1 7 2097 1 1 19 PHE HA H 0.121 -2.448 3.263 1.00 . A A . 19 PHE HA 1 1 7 2098 1 1 19 PHE HB2 H 1.528 -5.102 3.553 1.00 . A A . 19 PHE HB2 1 1 7 2099 1 1 19 PHE HB3 H 0.212 -4.481 4.555 1.00 . A A . 19 PHE HB3 1 1 7 2100 1 1 19 PHE HD1 H 1.131 -6.339 1.507 1.00 . A A . 19 PHE HD1 1 1 7 2101 1 1 19 PHE HD2 H -2.182 -4.755 3.749 1.00 . A A . 19 PHE HD2 1 1 7 2102 1 1 19 PHE HE1 H -0.419 -7.755 0.206 1.00 . A A . 19 PHE HE1 1 1 7 2103 1 1 19 PHE HE2 H -3.738 -6.148 2.419 1.00 . A A . 19 PHE HE2 1 1 7 2104 1 1 19 PHE HZ H -2.859 -7.680 0.672 1.00 . A A . 19 PHE HZ 1 1 7 2105 1 1 19 PHE N N 0.545 -3.300 1.406 1.00 . A A . 19 PHE N 1 1 7 2106 1 1 19 PHE O O 2.813 -2.139 2.237 1.00 . A A . 19 PHE O 1 1 7 2107 1 1 20 TYR C C 4.955 -2.336 4.339 1.00 . A A . 20 TYR C 1 1 7 2108 1 1 20 TYR CA C 3.681 -1.691 4.843 1.00 . A A . 20 TYR CA 1 1 7 2109 1 1 20 TYR CB C 3.713 -1.461 6.391 1.00 . A A . 20 TYR CB 1 1 7 2110 1 1 20 TYR CD1 C 3.087 0.991 6.456 1.00 . A A . 20 TYR CD1 1 1 7 2111 1 1 20 TYR CD2 C 5.202 0.355 7.429 1.00 . A A . 20 TYR CD2 1 1 7 2112 1 1 20 TYR CE1 C 3.346 2.332 6.752 1.00 . A A . 20 TYR CE1 1 1 7 2113 1 1 20 TYR CE2 C 5.457 1.694 7.736 1.00 . A A . 20 TYR CE2 1 1 7 2114 1 1 20 TYR CG C 4.021 -0.004 6.769 1.00 . A A . 20 TYR CG 1 1 7 2115 1 1 20 TYR CZ C 4.536 2.690 7.398 1.00 . A A . 20 TYR CZ 1 1 7 2116 1 1 20 TYR H H 1.962 -2.927 5.160 1.00 . A A . 20 TYR H 1 1 7 2117 1 1 20 TYR HA H 3.596 -0.715 4.338 1.00 . A A . 20 TYR HA 1 1 7 2118 1 1 20 TYR HB2 H 2.726 -1.629 6.845 1.00 . A A . 20 TYR HB2 1 1 7 2119 1 1 20 TYR HB3 H 4.405 -2.169 6.874 1.00 . A A . 20 TYR HB3 1 1 7 2120 1 1 20 TYR HD1 H 2.148 0.721 5.983 1.00 . A A . 20 TYR HD1 1 1 7 2121 1 1 20 TYR HD2 H 5.926 -0.404 7.709 1.00 . A A . 20 TYR HD2 1 1 7 2122 1 1 20 TYR HE1 H 2.616 3.087 6.477 1.00 . A A . 20 TYR HE1 1 1 7 2123 1 1 20 TYR HE2 H 6.378 1.967 8.242 1.00 . A A . 20 TYR HE2 1 1 7 2124 1 1 20 TYR HH H 4.136 4.638 7.486 1.00 . A A . 20 TYR HH 1 1 7 2125 1 1 20 TYR N N 2.514 -2.488 4.451 1.00 . A A . 20 TYR N 1 1 7 2126 1 1 20 TYR O O 4.879 -3.317 3.617 1.00 . A A . 20 TYR O 1 1 7 2127 1 1 20 TYR OH O 4.824 4.023 7.714 1.00 . A A . 20 TYR OH 1 1 7 2128 1 1 21 GLY C C 7.706 -2.054 2.878 1.00 . A A . 21 GLY C 1 1 7 2129 1 1 21 GLY CA C 7.393 -2.436 4.295 1.00 . A A . 21 GLY CA 1 1 7 2130 1 1 21 GLY H H 6.195 -0.956 5.239 1.00 . A A . 21 GLY H 1 1 7 2131 1 1 21 GLY HA2 H 8.225 -2.107 4.940 1.00 . A A . 21 GLY HA2 1 1 7 2132 1 1 21 GLY HA3 H 7.326 -3.533 4.367 1.00 . A A . 21 GLY HA3 1 1 7 2133 1 1 21 GLY N N 6.143 -1.803 4.707 1.00 . A A . 21 GLY N 1 1 7 2134 1 1 21 GLY O O 7.978 -2.924 2.052 1.00 . A A . 21 GLY O 1 1 7 2135 1 1 21 GLY OXT O 7.690 -0.871 2.542 1.00 . A A . 21 GLY OXT 1 1 8 2136 1 1 1 GLY C C 3.725 -1.330 -0.773 1.00 . A A . 1 GLY C 1 1 8 2137 1 1 1 GLY CA C 2.998 -0.024 -0.566 1.00 . A A . 1 GLY CA 1 1 8 2138 1 1 1 GLY H1 H 1.771 -0.886 0.927 1.00 . A A . 1 GLY H1 1 1 8 2139 1 1 1 GLY HA2 H 2.270 0.139 -1.375 1.00 . A A . 1 GLY HA2 1 1 8 2140 1 1 1 GLY HA3 H 3.754 0.775 -0.613 1.00 . A A . 1 GLY HA3 1 1 8 2141 1 1 1 GLY N N 2.267 -0.047 0.698 1.00 . A A . 1 GLY N 1 1 8 2142 1 1 1 GLY O O 3.579 -1.937 -1.823 1.00 . A A . 1 GLY O 1 1 8 2143 1 1 2 GLY C C 4.357 -4.208 0.321 1.00 . A A . 2 GLY C 1 1 8 2144 1 1 2 GLY CA C 5.260 -3.019 0.096 1.00 . A A . 2 GLY CA 1 1 8 2145 1 1 2 GLY H H 4.602 -1.251 1.087 1.00 . A A . 2 GLY H 1 1 8 2146 1 1 2 GLY HA2 H 5.705 -3.098 -0.908 1.00 . A A . 2 GLY HA2 1 1 8 2147 1 1 2 GLY HA3 H 6.084 -3.035 0.826 1.00 . A A . 2 GLY HA3 1 1 8 2148 1 1 2 GLY N N 4.523 -1.765 0.229 1.00 . A A . 2 GLY N 1 1 8 2149 1 1 2 GLY O O 3.157 -4.068 0.146 1.00 . A A . 2 GLY O 1 1 8 2150 1 1 3 ALA C C 4.149 -6.949 2.390 1.00 . A A . 3 ALA C 1 1 8 2151 1 1 3 ALA CA C 4.119 -6.581 0.923 1.00 . A A . 3 ALA CA 1 1 8 2152 1 1 3 ALA CB C 4.664 -7.725 0.027 1.00 . A A . 3 ALA CB 1 1 8 2153 1 1 3 ALA H H 5.916 -5.459 0.834 1.00 . A A . 3 ALA H 1 1 8 2154 1 1 3 ALA HA H 3.062 -6.426 0.656 1.00 . A A . 3 ALA HA 1 1 8 2155 1 1 3 ALA HB1 H 4.649 -7.409 -1.027 1.00 . A A . 3 ALA HB1 1 1 8 2156 1 1 3 ALA HB2 H 5.701 -7.968 0.306 1.00 . A A . 3 ALA HB2 1 1 8 2157 1 1 3 ALA HB3 H 4.049 -8.633 0.131 1.00 . A A . 3 ALA HB3 1 1 8 2158 1 1 3 ALA N N 4.926 -5.381 0.695 1.00 . A A . 3 ALA N 1 1 8 2159 1 1 3 ALA O O 4.276 -8.120 2.712 1.00 . A A . 3 ALA O 1 1 8 2160 1 1 4 GLY C C 2.716 -6.770 5.230 1.00 . A A . 4 GLY C 1 1 8 2161 1 1 4 GLY CA C 4.047 -6.244 4.729 1.00 . A A . 4 GLY CA 1 1 8 2162 1 1 4 GLY H H 3.928 -4.997 3.010 1.00 . A A . 4 GLY H 1 1 8 2163 1 1 4 GLY HA2 H 4.815 -6.999 4.957 1.00 . A A . 4 GLY HA2 1 1 8 2164 1 1 4 GLY HA3 H 4.332 -5.328 5.271 1.00 . A A . 4 GLY HA3 1 1 8 2165 1 1 4 GLY N N 4.032 -5.953 3.297 1.00 . A A . 4 GLY N 1 1 8 2166 1 1 4 GLY O O 2.045 -7.468 4.485 1.00 . A A . 4 GLY O 1 1 8 2167 1 1 5 HIS C C 0.145 -5.986 7.457 1.00 . A A . 5 HIS C 1 1 8 2168 1 1 5 HIS CA C 1.206 -7.046 7.176 1.00 . A A . 5 HIS CA 1 1 8 2169 1 1 5 HIS CB C 1.635 -7.714 8.484 1.00 . A A . 5 HIS CB 1 1 8 2170 1 1 5 HIS CD2 C 1.834 -10.265 8.064 1.00 . A A . 5 HIS CD2 1 1 8 2171 1 1 5 HIS CE1 C 4.020 -10.428 8.107 1.00 . A A . 5 HIS CE1 1 1 8 2172 1 1 5 HIS CG C 2.330 -9.026 8.286 1.00 . A A . 5 HIS CG 1 1 8 2173 1 1 5 HIS H H 2.974 -5.894 7.015 1.00 . A A . 5 HIS H 1 1 8 2174 1 1 5 HIS HA H 0.785 -7.794 6.522 1.00 . A A . 5 HIS HA 1 1 8 2175 1 1 5 HIS HB2 H 2.311 -7.057 9.010 1.00 . A A . 5 HIS HB2 1 1 8 2176 1 1 5 HIS HB3 H 0.761 -7.888 9.095 1.00 . A A . 5 HIS HB3 1 1 8 2177 1 1 5 HIS HD1 H 4.346 -8.437 8.451 1.00 . A A . 5 HIS HD1 1 1 8 2178 1 1 5 HIS HD2 H 0.790 -10.534 7.985 1.00 . A A . 5 HIS HD2 1 1 8 2179 1 1 5 HIS HE1 H 5.021 -10.830 8.072 1.00 . A A . 5 HIS HE1 1 1 8 2180 1 1 5 HIS N N 2.360 -6.461 6.504 1.00 . A A . 5 HIS N 1 1 8 2181 1 1 5 HIS ND1 N 3.702 -9.161 8.309 1.00 . A A . 5 HIS ND1 1 1 8 2182 1 1 5 HIS NE2 N 2.905 -11.119 7.956 1.00 . A A . 5 HIS NE2 1 1 8 2183 1 1 5 HIS O O -1.025 -6.305 7.671 1.00 . A A . 5 HIS O 1 1 8 2184 1 1 6 VAL C C -0.755 -2.800 6.749 1.00 . A A . 6 VAL C 1 1 8 2185 1 1 6 VAL CA C -0.431 -3.635 7.968 1.00 . A A . 6 VAL CA 1 1 8 2186 1 1 6 VAL CB C 0.259 -2.773 9.070 1.00 . A A . 6 VAL CB 1 1 8 2187 1 1 6 VAL CG1 C -0.657 -1.631 9.591 1.00 . A A . 6 VAL CG1 1 1 8 2188 1 1 6 VAL CG2 C 0.713 -3.673 10.255 1.00 . A A . 6 VAL CG2 1 1 8 2189 1 1 6 VAL H H 1.419 -4.346 7.299 1.00 . A A . 6 VAL H 1 1 8 2190 1 1 6 VAL HA H -1.331 -4.077 8.419 1.00 . A A . 6 VAL HA 1 1 8 2191 1 1 6 VAL HB H 1.158 -2.301 8.639 1.00 . A A . 6 VAL HB 1 1 8 2192 1 1 6 VAL HG11 H -1.534 -2.047 10.109 1.00 . A A . 6 VAL HG11 1 1 8 2193 1 1 6 VAL HG12 H -0.107 -0.999 10.305 1.00 . A A . 6 VAL HG12 1 1 8 2194 1 1 6 VAL HG13 H -0.997 -0.992 8.761 1.00 . A A . 6 VAL HG13 1 1 8 2195 1 1 6 VAL HG21 H 1.424 -4.442 9.917 1.00 . A A . 6 VAL HG21 1 1 8 2196 1 1 6 VAL HG22 H 1.210 -3.066 11.028 1.00 . A A . 6 VAL HG22 1 1 8 2197 1 1 6 VAL HG23 H -0.155 -4.175 10.708 1.00 . A A . 6 VAL HG23 1 1 8 2198 1 1 6 VAL N N 0.504 -4.675 7.525 1.00 . A A . 6 VAL N 1 1 8 2199 1 1 6 VAL O O 0.191 -2.506 6.037 1.00 . A A . 6 VAL O 1 1 8 2200 1 1 7 PRO C C -1.678 -0.286 5.196 1.00 . A A . 7 PRO C 1 1 8 2201 1 1 7 PRO CA C -2.233 -1.690 5.176 1.00 . A A . 7 PRO CA 1 1 8 2202 1 1 7 PRO CB C -3.772 -1.734 5.087 1.00 . A A . 7 PRO CB 1 1 8 2203 1 1 7 PRO CD C -3.182 -2.707 7.233 1.00 . A A . 7 PRO CD 1 1 8 2204 1 1 7 PRO CG C -4.212 -1.766 6.566 1.00 . A A . 7 PRO CG 1 1 8 2205 1 1 7 PRO HA H -1.826 -2.264 4.337 1.00 . A A . 7 PRO HA 1 1 8 2206 1 1 7 PRO HB2 H -4.209 -0.904 4.506 1.00 . A A . 7 PRO HB2 1 1 8 2207 1 1 7 PRO HB3 H -4.052 -2.693 4.623 1.00 . A A . 7 PRO HB3 1 1 8 2208 1 1 7 PRO HD2 H -3.091 -2.476 8.304 1.00 . A A . 7 PRO HD2 1 1 8 2209 1 1 7 PRO HD3 H -3.463 -3.764 7.092 1.00 . A A . 7 PRO HD3 1 1 8 2210 1 1 7 PRO HG2 H -4.112 -0.750 6.982 1.00 . A A . 7 PRO HG2 1 1 8 2211 1 1 7 PRO HG3 H -5.246 -2.119 6.700 1.00 . A A . 7 PRO HG3 1 1 8 2212 1 1 7 PRO N N -2.010 -2.397 6.427 1.00 . A A . 7 PRO N 1 1 8 2213 1 1 7 PRO O O -1.622 0.314 6.257 1.00 . A A . 7 PRO O 1 1 8 2214 1 1 8 GLU C C -1.921 2.572 3.872 1.00 . A A . 8 GLU C 1 1 8 2215 1 1 8 GLU CA C -0.758 1.606 3.935 1.00 . A A . 8 GLU CA 1 1 8 2216 1 1 8 GLU CB C 0.131 1.789 2.673 1.00 . A A . 8 GLU CB 1 1 8 2217 1 1 8 GLU CD C 2.228 1.042 1.503 1.00 . A A . 8 GLU CD 1 1 8 2218 1 1 8 GLU CG C 1.449 0.981 2.796 1.00 . A A . 8 GLU CG 1 1 8 2219 1 1 8 GLU H H -1.343 -0.293 3.169 1.00 . A A . 8 GLU H 1 1 8 2220 1 1 8 GLU HA H -0.143 1.836 4.822 1.00 . A A . 8 GLU HA 1 1 8 2221 1 1 8 GLU HB2 H -0.418 1.454 1.778 1.00 . A A . 8 GLU HB2 1 1 8 2222 1 1 8 GLU HB3 H 0.376 2.856 2.542 1.00 . A A . 8 GLU HB3 1 1 8 2223 1 1 8 GLU HG2 H 2.070 1.412 3.597 1.00 . A A . 8 GLU HG2 1 1 8 2224 1 1 8 GLU HG3 H 1.220 -0.059 3.072 1.00 . A A . 8 GLU HG3 1 1 8 2225 1 1 8 GLU N N -1.266 0.237 4.017 1.00 . A A . 8 GLU N 1 1 8 2226 1 1 8 GLU O O -1.858 3.604 4.520 1.00 . A A . 8 GLU O 1 1 8 2227 1 1 8 GLU OE1 O 2.794 2.090 1.231 1.00 . A A . 8 GLU OE1 1 1 8 2228 1 1 9 TYR C C -5.389 2.373 2.850 1.00 . A A . 9 TYR C 1 1 8 2229 1 1 9 TYR CA C -4.110 3.170 2.932 1.00 . A A . 9 TYR CA 1 1 8 2230 1 1 9 TYR CB C -3.879 3.985 1.630 1.00 . A A . 9 TYR CB 1 1 8 2231 1 1 9 TYR CD1 C -4.598 2.311 -0.156 1.00 . A A . 9 TYR CD1 1 1 8 2232 1 1 9 TYR CD2 C -2.258 2.873 0.008 1.00 . A A . 9 TYR CD2 1 1 8 2233 1 1 9 TYR CE1 C -4.304 1.389 -1.166 1.00 . A A . 9 TYR CE1 1 1 8 2234 1 1 9 TYR CE2 C -1.966 1.973 -1.020 1.00 . A A . 9 TYR CE2 1 1 8 2235 1 1 9 TYR CG C -3.572 3.033 0.463 1.00 . A A . 9 TYR CG 1 1 8 2236 1 1 9 TYR CZ C -2.988 1.210 -1.600 1.00 . A A . 9 TYR CZ 1 1 8 2237 1 1 9 TYR H H -3.003 1.402 2.563 1.00 . A A . 9 TYR H 1 1 8 2238 1 1 9 TYR HA H -4.212 3.852 3.793 1.00 . A A . 9 TYR HA 1 1 8 2239 1 1 9 TYR HB2 H -4.753 4.603 1.377 1.00 . A A . 9 TYR HB2 1 1 8 2240 1 1 9 TYR HB3 H -3.031 4.668 1.795 1.00 . A A . 9 TYR HB3 1 1 8 2241 1 1 9 TYR HD1 H -5.630 2.459 0.144 1.00 . A A . 9 TYR HD1 1 1 8 2242 1 1 9 TYR HD2 H -1.451 3.447 0.452 1.00 . A A . 9 TYR HD2 1 1 8 2243 1 1 9 TYR HE1 H -5.102 0.808 -1.619 1.00 . A A . 9 TYR HE1 1 1 8 2244 1 1 9 TYR HE2 H -0.940 1.875 -1.363 1.00 . A A . 9 TYR HE2 1 1 8 2245 1 1 9 TYR HH H -1.793 0.143 -2.777 1.00 . A A . 9 TYR HH 1 1 8 2246 1 1 9 TYR N N -2.980 2.254 3.092 1.00 . A A . 9 TYR N 1 1 8 2247 1 1 9 TYR O O -5.299 1.155 2.835 1.00 . A A . 9 TYR O 1 1 8 2248 1 1 9 TYR OH O -2.718 0.277 -2.606 1.00 . A A . 9 TYR OH 1 1 8 2249 1 1 10 PHE C C -8.672 2.918 1.543 1.00 . A A . 10 PHE C 1 1 8 2250 1 1 10 PHE CA C -7.834 2.321 2.653 1.00 . A A . 10 PHE CA 1 1 8 2251 1 1 10 PHE CB C -8.648 2.385 3.967 1.00 . A A . 10 PHE CB 1 1 8 2252 1 1 10 PHE CD1 C -6.988 2.223 5.892 1.00 . A A . 10 PHE CD1 1 1 8 2253 1 1 10 PHE CD2 C -8.227 0.243 5.267 1.00 . A A . 10 PHE CD2 1 1 8 2254 1 1 10 PHE CE1 C -6.430 1.533 6.972 1.00 . A A . 10 PHE CE1 1 1 8 2255 1 1 10 PHE CE2 C -7.674 -0.448 6.350 1.00 . A A . 10 PHE CE2 1 1 8 2256 1 1 10 PHE CG C -7.932 1.596 5.070 1.00 . A A . 10 PHE CG 1 1 8 2257 1 1 10 PHE CZ C -6.807 0.210 7.226 1.00 . A A . 10 PHE CZ 1 1 8 2258 1 1 10 PHE H H -6.611 4.040 2.847 1.00 . A A . 10 PHE H 1 1 8 2259 1 1 10 PHE HA H -7.649 1.260 2.431 1.00 . A A . 10 PHE HA 1 1 8 2260 1 1 10 PHE HB2 H -8.778 3.435 4.274 1.00 . A A . 10 PHE HB2 1 1 8 2261 1 1 10 PHE HB3 H -9.652 1.958 3.808 1.00 . A A . 10 PHE HB3 1 1 8 2262 1 1 10 PHE HD1 H -6.689 3.248 5.697 1.00 . A A . 10 PHE HD1 1 1 8 2263 1 1 10 PHE HD2 H -8.891 -0.277 4.583 1.00 . A A . 10 PHE HD2 1 1 8 2264 1 1 10 PHE HE1 H -5.707 2.024 7.616 1.00 . A A . 10 PHE HE1 1 1 8 2265 1 1 10 PHE HE2 H -7.921 -1.493 6.510 1.00 . A A . 10 PHE HE2 1 1 8 2266 1 1 10 PHE HZ H -6.425 -0.303 8.103 1.00 . A A . 10 PHE HZ 1 1 8 2267 1 1 10 PHE N N -6.569 3.040 2.791 1.00 . A A . 10 PHE N 1 1 8 2268 1 1 10 PHE O O -8.639 4.128 1.380 1.00 . A A . 10 PHE O 1 1 8 2269 1 1 11 VAL C C -11.771 2.472 0.178 1.00 . A A . 11 VAL C 1 1 8 2270 1 1 11 VAL CA C -10.313 2.532 -0.265 1.00 . A A . 11 VAL CA 1 1 8 2271 1 1 11 VAL CB C -10.142 1.695 -1.547 1.00 . A A . 11 VAL CB 1 1 8 2272 1 1 11 VAL CG1 C -10.937 2.304 -2.692 1.00 . A A . 11 VAL CG1 1 1 8 2273 1 1 11 VAL CG2 C -8.671 1.575 -1.912 1.00 . A A . 11 VAL CG2 1 1 8 2274 1 1 11 VAL H H -9.357 1.110 0.977 1.00 . A A . 11 VAL H 1 1 8 2275 1 1 11 VAL HA H -10.057 3.557 -0.492 1.00 . A A . 11 VAL HA 1 1 8 2276 1 1 11 VAL HB H -10.527 0.703 -1.359 1.00 . A A . 11 VAL HB 1 1 8 2277 1 1 11 VAL HG11 H -10.879 3.381 -2.636 1.00 . A A . 11 VAL HG11 1 1 8 2278 1 1 11 VAL HG12 H -10.527 1.968 -3.633 1.00 . A A . 11 VAL HG12 1 1 8 2279 1 1 11 VAL HG13 H -11.969 1.995 -2.618 1.00 . A A . 11 VAL HG13 1 1 8 2280 1 1 11 VAL HG21 H -8.348 0.554 -1.771 1.00 . A A . 11 VAL HG21 1 1 8 2281 1 1 11 VAL HG22 H -8.532 1.857 -2.946 1.00 . A A . 11 VAL HG22 1 1 8 2282 1 1 11 VAL HG23 H -8.088 2.228 -1.280 1.00 . A A . 11 VAL HG23 1 1 8 2283 1 1 11 VAL N N -9.423 2.070 0.794 1.00 . A A . 11 VAL N 1 1 8 2284 1 1 11 VAL O O -12.102 1.828 1.174 1.00 . A A . 11 VAL O 1 1 8 2285 1 1 12 ARG C C -14.735 1.871 -0.678 1.00 . A A . 12 ARG C 1 1 8 2286 1 1 12 ARG CA C -14.061 3.172 -0.253 1.00 . A A . 12 ARG CA 1 1 8 2287 1 1 12 ARG CB C -14.738 4.358 -0.943 1.00 . A A . 12 ARG CB 1 1 8 2288 1 1 12 ARG CD C -15.012 6.851 -1.107 1.00 . A A . 12 ARG CD 1 1 8 2289 1 1 12 ARG CG C -14.342 5.707 -0.363 1.00 . A A . 12 ARG CG 1 1 8 2290 1 1 12 ARG CZ C -16.337 7.902 0.677 1.00 . A A . 12 ARG CZ 1 1 8 2291 1 1 12 ARG H H -12.313 3.642 -1.350 1.00 . A A . 12 ARG H 1 1 8 2292 1 1 12 ARG HA H -14.162 3.283 0.816 1.00 . A A . 12 ARG HA 1 1 8 2293 1 1 12 ARG HB2 H -14.473 4.350 -1.990 1.00 . A A . 12 ARG HB2 1 1 8 2294 1 1 12 ARG HB3 H -15.808 4.251 -0.849 1.00 . A A . 12 ARG HB3 1 1 8 2295 1 1 12 ARG HD2 H -14.341 7.697 -1.119 1.00 . A A . 12 ARG HD2 1 1 8 2296 1 1 12 ARG HD3 H -15.211 6.536 -2.121 1.00 . A A . 12 ARG HD3 1 1 8 2297 1 1 12 ARG HE H -17.100 7.024 -0.943 1.00 . A A . 12 ARG HE 1 1 8 2298 1 1 12 ARG HG2 H -14.639 5.744 0.674 1.00 . A A . 12 ARG HG2 1 1 8 2299 1 1 12 ARG HG3 H -13.270 5.819 -0.437 1.00 . A A . 12 ARG HG3 1 1 8 2300 1 1 12 ARG HH11 H -14.336 7.977 0.947 1.00 . A A . 12 ARG HH11 1 1 8 2301 1 1 12 ARG HH12 H -15.282 8.714 2.198 1.00 . A A . 12 ARG HH12 1 1 8 2302 1 1 12 ARG HH21 H -18.356 7.991 0.697 1.00 . A A . 12 ARG HH21 1 1 8 2303 1 1 12 ARG HH22 H -17.569 8.721 2.055 1.00 . A A . 12 ARG HH22 1 1 8 2304 1 1 12 ARG N N -12.638 3.148 -0.569 1.00 . A A . 12 ARG N 1 1 8 2305 1 1 12 ARG NE N -16.268 7.252 -0.479 1.00 . A A . 12 ARG NE 1 1 8 2306 1 1 12 ARG NH1 N -15.227 8.223 1.328 1.00 . A A . 12 ARG NH1 1 1 8 2307 1 1 12 ARG NH2 N -17.518 8.232 1.185 1.00 . A A . 12 ARG NH2 1 1 8 2308 1 1 12 ARG O O -15.938 1.838 -0.935 1.00 . A A . 12 ARG O 1 1 8 2309 1 1 13 GLY C C -14.687 -1.420 0.033 1.00 . A A . 13 GLY C 1 1 8 2310 1 1 13 GLY CA C -14.488 -0.488 -1.147 1.00 . A A . 13 GLY CA 1 1 8 2311 1 1 13 GLY H H -12.998 0.886 -0.535 1.00 . A A . 13 GLY H 1 1 8 2312 1 1 13 GLY HA2 H -15.438 -0.335 -1.635 1.00 . A A . 13 GLY HA2 1 1 8 2313 1 1 13 GLY HA3 H -13.806 -0.951 -1.845 1.00 . A A . 13 GLY HA3 1 1 8 2314 1 1 13 GLY N N -13.950 0.800 -0.751 1.00 . A A . 13 GLY N 1 1 8 2315 1 1 13 GLY O O -15.498 -1.147 0.918 1.00 . A A . 13 GLY O 1 1 8 2316 1 1 14 ASP C C -12.732 -3.595 1.892 1.00 . A A . 14 ASP C 1 1 8 2317 1 1 14 ASP CA C -14.046 -3.499 1.124 1.00 . A A . 14 ASP CA 1 1 8 2318 1 1 14 ASP CB C -14.427 -4.871 0.566 1.00 . A A . 14 ASP CB 1 1 8 2319 1 1 14 ASP CG C -14.454 -5.944 1.637 1.00 . A A . 14 ASP CG 1 1 8 2320 1 1 14 ASP H H -13.318 -2.684 -0.690 1.00 . A A . 14 ASP H 1 1 8 2321 1 1 14 ASP HA H -14.820 -3.168 1.800 1.00 . A A . 14 ASP HA 1 1 8 2322 1 1 14 ASP HB2 H -15.408 -4.811 0.118 1.00 . A A . 14 ASP HB2 1 1 8 2323 1 1 14 ASP HB3 H -13.708 -5.158 -0.188 1.00 . A A . 14 ASP HB3 1 1 8 2324 1 1 14 ASP N N -13.947 -2.523 0.045 1.00 . A A . 14 ASP N 1 1 8 2325 1 1 14 ASP O O -12.606 -3.065 2.996 1.00 . A A . 14 ASP O 1 1 8 2326 1 1 14 ASP OD1 O -14.817 -5.624 2.788 1.00 . A A . 14 ASP OD1 1 1 8 2327 1 1 14 ASP OD2 O -14.113 -7.103 1.323 1.00 . A A . 14 ASP OD2 1 1 8 2328 1 1 15 PHE C C -9.369 -3.705 1.145 1.00 . A A . 15 PHE C 1 1 8 2329 1 1 15 PHE CA C -10.450 -4.442 1.930 1.00 . A A . 15 PHE CA 1 1 8 2330 1 1 15 PHE CB C -10.098 -5.927 2.034 1.00 . A A . 15 PHE CB 1 1 8 2331 1 1 15 PHE CD1 C -10.652 -6.219 4.464 1.00 . A A . 15 PHE CD1 1 1 8 2332 1 1 15 PHE CD2 C -11.634 -7.717 2.890 1.00 . A A . 15 PHE CD2 1 1 8 2333 1 1 15 PHE CE1 C -11.305 -6.869 5.494 1.00 . A A . 15 PHE CE1 1 1 8 2334 1 1 15 PHE CE2 C -12.290 -8.371 3.917 1.00 . A A . 15 PHE CE2 1 1 8 2335 1 1 15 PHE CG C -10.809 -6.635 3.152 1.00 . A A . 15 PHE CG 1 1 8 2336 1 1 15 PHE CZ C -12.126 -7.946 5.220 1.00 . A A . 15 PHE CZ 1 1 8 2337 1 1 15 PHE H H -11.916 -4.674 0.420 1.00 . A A . 15 PHE H 1 1 8 2338 1 1 15 PHE HA H -10.506 -4.024 2.923 1.00 . A A . 15 PHE HA 1 1 8 2339 1 1 15 PHE HB2 H -10.362 -6.419 1.110 1.00 . A A . 15 PHE HB2 1 1 8 2340 1 1 15 PHE HB3 H -9.035 -6.027 2.199 1.00 . A A . 15 PHE HB3 1 1 8 2341 1 1 15 PHE HD1 H -10.011 -5.377 4.680 1.00 . A A . 15 PHE HD1 1 1 8 2342 1 1 15 PHE HD2 H -11.764 -8.050 1.870 1.00 . A A . 15 PHE HD2 1 1 8 2343 1 1 15 PHE HE1 H -11.175 -6.534 6.513 1.00 . A A . 15 PHE HE1 1 1 8 2344 1 1 15 PHE HE2 H -12.931 -9.212 3.698 1.00 . A A . 15 PHE HE2 1 1 8 2345 1 1 15 PHE HZ H -12.636 -8.455 6.023 1.00 . A A . 15 PHE HZ 1 1 8 2346 1 1 15 PHE N N -11.755 -4.275 1.301 1.00 . A A . 15 PHE N 1 1 8 2347 1 1 15 PHE O O -9.537 -3.369 -0.027 1.00 . A A . 15 PHE O 1 1 8 2348 1 1 16 PRO C C -6.377 -3.439 0.175 1.00 . A A . 16 PRO C 1 1 8 2349 1 1 16 PRO CA C -7.210 -2.542 1.058 1.00 . A A . 16 PRO CA 1 1 8 2350 1 1 16 PRO CB C -6.411 -1.946 2.245 1.00 . A A . 16 PRO CB 1 1 8 2351 1 1 16 PRO CD C -8.001 -3.503 3.207 1.00 . A A . 16 PRO CD 1 1 8 2352 1 1 16 PRO CG C -6.543 -3.020 3.344 1.00 . A A . 16 PRO CG 1 1 8 2353 1 1 16 PRO HA H -7.647 -1.734 0.448 1.00 . A A . 16 PRO HA 1 1 8 2354 1 1 16 PRO HB2 H -5.364 -1.697 2.012 1.00 . A A . 16 PRO HB2 1 1 8 2355 1 1 16 PRO HB3 H -6.919 -1.039 2.606 1.00 . A A . 16 PRO HB3 1 1 8 2356 1 1 16 PRO HD2 H -8.070 -4.531 3.583 1.00 . A A . 16 PRO HD2 1 1 8 2357 1 1 16 PRO HD3 H -8.664 -2.837 3.783 1.00 . A A . 16 PRO HD3 1 1 8 2358 1 1 16 PRO HG2 H -5.847 -3.848 3.124 1.00 . A A . 16 PRO HG2 1 1 8 2359 1 1 16 PRO HG3 H -6.360 -2.636 4.359 1.00 . A A . 16 PRO HG3 1 1 8 2360 1 1 16 PRO N N -8.223 -3.313 1.777 1.00 . A A . 16 PRO N 1 1 8 2361 1 1 16 PRO O O -6.644 -4.630 0.141 1.00 . A A . 16 PRO O 1 1 8 2362 1 1 17 ILE C C -3.244 -3.922 -1.132 1.00 . A A . 17 ILE C 1 1 8 2363 1 1 17 ILE CA C -4.661 -3.623 -1.579 1.00 . A A . 17 ILE CA 1 1 8 2364 1 1 17 ILE CB C -4.693 -2.842 -2.930 1.00 . A A . 17 ILE CB 1 1 8 2365 1 1 17 ILE CD1 C -6.308 -1.668 -4.607 1.00 . A A . 17 ILE CD1 1 1 8 2366 1 1 17 ILE CG1 C -6.170 -2.594 -3.369 1.00 . A A . 17 ILE CG1 1 1 8 2367 1 1 17 ILE CG2 C -3.875 -3.595 -4.020 1.00 . A A . 17 ILE CG2 1 1 8 2368 1 1 17 ILE H H -5.174 -1.892 -0.455 1.00 . A A . 17 ILE H 1 1 8 2369 1 1 17 ILE HA H -5.163 -4.584 -1.783 1.00 . A A . 17 ILE HA 1 1 8 2370 1 1 17 ILE HB H -4.224 -1.857 -2.781 1.00 . A A . 17 ILE HB 1 1 8 2371 1 1 17 ILE HD11 H -5.762 -0.725 -4.446 1.00 . A A . 17 ILE HD11 1 1 8 2372 1 1 17 ILE HD12 H -5.927 -2.151 -5.519 1.00 . A A . 17 ILE HD12 1 1 8 2373 1 1 17 ILE HD13 H -7.371 -1.429 -4.775 1.00 . A A . 17 ILE HD13 1 1 8 2374 1 1 17 ILE HG12 H -6.663 -3.557 -3.577 1.00 . A A . 17 ILE HG12 1 1 8 2375 1 1 17 ILE HG13 H -6.720 -2.107 -2.546 1.00 . A A . 17 ILE HG13 1 1 8 2376 1 1 17 ILE HG21 H -3.812 -3.008 -4.948 1.00 . A A . 17 ILE HG21 1 1 8 2377 1 1 17 ILE HG22 H -2.843 -3.777 -3.685 1.00 . A A . 17 ILE HG22 1 1 8 2378 1 1 17 ILE HG23 H -4.344 -4.564 -4.247 1.00 . A A . 17 ILE HG23 1 1 8 2379 1 1 17 ILE N N -5.389 -2.866 -0.557 1.00 . A A . 17 ILE N 1 1 8 2380 1 1 17 ILE O O -2.914 -5.089 -0.997 1.00 . A A . 17 ILE O 1 1 8 2381 1 1 18 SER C C -0.719 -3.079 0.853 1.00 . A A . 18 SER C 1 1 8 2382 1 1 18 SER CA C -0.967 -3.149 -0.635 1.00 . A A . 18 SER CA 1 1 8 2383 1 1 18 SER CB C -0.133 -2.089 -1.399 1.00 . A A . 18 SER CB 1 1 8 2384 1 1 18 SER H H -2.684 -1.944 -0.957 1.00 . A A . 18 SER H 1 1 8 2385 1 1 18 SER HA H -0.640 -4.143 -0.983 1.00 . A A . 18 SER HA 1 1 8 2386 1 1 18 SER HB2 H 0.942 -2.216 -1.199 1.00 . A A . 18 SER HB2 1 1 8 2387 1 1 18 SER HB3 H -0.297 -2.213 -2.480 1.00 . A A . 18 SER HB3 1 1 8 2388 1 1 18 SER HG H -0.454 -0.562 -0.134 1.00 . A A . 18 SER HG 1 1 8 2389 1 1 18 SER N N -2.382 -2.898 -0.921 1.00 . A A . 18 SER N 1 1 8 2390 1 1 18 SER O O -1.652 -2.759 1.574 1.00 . A A . 18 SER O 1 1 8 2391 1 1 18 SER OG O -0.563 -0.760 -1.058 1.00 . A A . 18 SER OG 1 1 8 2392 1 1 19 PHE C C 2.104 -2.720 3.081 1.00 . A A . 19 PHE C 1 1 8 2393 1 1 19 PHE CA C 0.793 -3.395 2.756 1.00 . A A . 19 PHE CA 1 1 8 2394 1 1 19 PHE CB C 0.668 -4.851 3.272 1.00 . A A . 19 PHE CB 1 1 8 2395 1 1 19 PHE CD1 C -1.836 -5.334 3.184 1.00 . A A . 19 PHE CD1 1 1 8 2396 1 1 19 PHE CD2 C -0.414 -6.316 1.495 1.00 . A A . 19 PHE CD2 1 1 8 2397 1 1 19 PHE CE1 C -2.956 -5.908 2.572 1.00 . A A . 19 PHE CE1 1 1 8 2398 1 1 19 PHE CE2 C -1.527 -6.913 0.898 1.00 . A A . 19 PHE CE2 1 1 8 2399 1 1 19 PHE CG C -0.560 -5.520 2.636 1.00 . A A . 19 PHE CG 1 1 8 2400 1 1 19 PHE CZ C -2.802 -6.702 1.432 1.00 . A A . 19 PHE CZ 1 1 8 2401 1 1 19 PHE H H 1.264 -3.665 0.710 1.00 . A A . 19 PHE H 1 1 8 2402 1 1 19 PHE HA H 0.062 -2.768 3.276 1.00 . A A . 19 PHE HA 1 1 8 2403 1 1 19 PHE HB2 H 1.565 -5.401 2.964 1.00 . A A . 19 PHE HB2 1 1 8 2404 1 1 19 PHE HB3 H 0.591 -4.900 4.371 1.00 . A A . 19 PHE HB3 1 1 8 2405 1 1 19 PHE HD1 H -1.962 -4.742 4.085 1.00 . A A . 19 PHE HD1 1 1 8 2406 1 1 19 PHE HD2 H 0.568 -6.476 1.059 1.00 . A A . 19 PHE HD2 1 1 8 2407 1 1 19 PHE HE1 H -3.947 -5.737 2.982 1.00 . A A . 19 PHE HE1 1 1 8 2408 1 1 19 PHE HE2 H -1.402 -7.538 0.018 1.00 . A A . 19 PHE HE2 1 1 8 2409 1 1 19 PHE HZ H -3.670 -7.156 0.961 1.00 . A A . 19 PHE HZ 1 1 8 2410 1 1 19 PHE N N 0.521 -3.382 1.319 1.00 . A A . 19 PHE N 1 1 8 2411 1 1 19 PHE O O 2.775 -2.275 2.165 1.00 . A A . 19 PHE O 1 1 8 2412 1 1 20 TYR C C 4.898 -2.287 4.227 1.00 . A A . 20 TYR C 1 1 8 2413 1 1 20 TYR CA C 3.592 -1.732 4.748 1.00 . A A . 20 TYR CA 1 1 8 2414 1 1 20 TYR CB C 3.659 -1.497 6.290 1.00 . A A . 20 TYR CB 1 1 8 2415 1 1 20 TYR CD1 C 3.120 0.971 6.429 1.00 . A A . 20 TYR CD1 1 1 8 2416 1 1 20 TYR CD2 C 5.309 0.265 7.158 1.00 . A A . 20 TYR CD2 1 1 8 2417 1 1 20 TYR CE1 C 3.450 2.301 6.704 1.00 . A A . 20 TYR CE1 1 1 8 2418 1 1 20 TYR CE2 C 5.637 1.593 7.442 1.00 . A A . 20 TYR CE2 1 1 8 2419 1 1 20 TYR CG C 4.051 -0.053 6.636 1.00 . A A . 20 TYR CG 1 1 8 2420 1 1 20 TYR CZ C 4.714 2.619 7.215 1.00 . A A . 20 TYR CZ 1 1 8 2421 1 1 20 TYR H H 1.927 -3.038 5.096 1.00 . A A . 20 TYR H 1 1 8 2422 1 1 20 TYR HA H 3.429 -0.764 4.250 1.00 . A A . 20 TYR HA 1 1 8 2423 1 1 20 TYR HB2 H 2.668 -1.627 6.748 1.00 . A A . 20 TYR HB2 1 1 8 2424 1 1 20 TYR HB3 H 4.328 -2.231 6.763 1.00 . A A . 20 TYR HB3 1 1 8 2425 1 1 20 TYR HD1 H 2.129 0.736 6.053 1.00 . A A . 20 TYR HD1 1 1 8 2426 1 1 20 TYR HD2 H 6.037 -0.518 7.345 1.00 . A A . 20 TYR HD2 1 1 8 2427 1 1 20 TYR HE1 H 2.716 3.080 6.518 1.00 . A A . 20 TYR HE1 1 1 8 2428 1 1 20 TYR HE2 H 6.616 1.835 7.843 1.00 . A A . 20 TYR HE2 1 1 8 2429 1 1 20 TYR HH H 4.388 4.578 7.338 1.00 . A A . 20 TYR HH 1 1 8 2430 1 1 20 TYR N N 2.468 -2.597 4.378 1.00 . A A . 20 TYR N 1 1 8 2431 1 1 20 TYR O O 4.914 -3.403 3.733 1.00 . A A . 20 TYR O 1 1 8 2432 1 1 20 TYR OH O 5.073 3.940 7.503 1.00 . A A . 20 TYR OH 1 1 8 2433 1 1 21 GLY C C 8.399 -1.046 4.015 1.00 . A A . 21 GLY C 1 1 8 2434 1 1 21 GLY CA C 7.308 -2.082 3.940 1.00 . A A . 21 GLY CA 1 1 8 2435 1 1 21 GLY H H 5.982 -0.598 4.697 1.00 . A A . 21 GLY H 1 1 8 2436 1 1 21 GLY HA2 H 7.571 -2.907 4.621 1.00 . A A . 21 GLY HA2 1 1 8 2437 1 1 21 GLY HA3 H 7.258 -2.478 2.914 1.00 . A A . 21 GLY HA3 1 1 8 2438 1 1 21 GLY N N 6.014 -1.530 4.331 1.00 . A A . 21 GLY N 1 1 8 2439 1 1 21 GLY O O 9.382 -1.147 3.232 1.00 . A A . 21 GLY O 1 1 8 2440 1 1 21 GLY OXT O 8.282 -0.128 4.871 1.00 . A A . 21 GLY OXT 1 1 9 2441 1 1 1 GLY C C 3.683 -1.162 -0.681 1.00 . A A . 1 GLY C 1 1 9 2442 1 1 1 GLY CA C 2.890 0.117 -0.564 1.00 . A A . 1 GLY CA 1 1 9 2443 1 1 1 GLY H1 H 1.363 -0.552 0.748 1.00 . A A . 1 GLY H1 1 1 9 2444 1 1 1 GLY HA2 H 2.200 0.211 -1.417 1.00 . A A . 1 GLY HA2 1 1 9 2445 1 1 1 GLY HA3 H 3.599 0.958 -0.625 1.00 . A A . 1 GLY HA3 1 1 9 2446 1 1 1 GLY N N 2.105 0.117 0.670 1.00 . A A . 1 GLY N 1 1 9 2447 1 1 1 GLY O O 3.607 -1.816 -1.710 1.00 . A A . 1 GLY O 1 1 9 2448 1 1 2 GLY C C 4.359 -3.985 0.384 1.00 . A A . 2 GLY C 1 1 9 2449 1 1 2 GLY CA C 5.244 -2.764 0.300 1.00 . A A . 2 GLY CA 1 1 9 2450 1 1 2 GLY H H 4.494 -0.983 1.204 1.00 . A A . 2 GLY H 1 1 9 2451 1 1 2 GLY HA2 H 5.817 -2.802 -0.639 1.00 . A A . 2 GLY HA2 1 1 9 2452 1 1 2 GLY HA3 H 5.965 -2.788 1.133 1.00 . A A . 2 GLY HA3 1 1 9 2453 1 1 2 GLY N N 4.460 -1.531 0.364 1.00 . A A . 2 GLY N 1 1 9 2454 1 1 2 GLY O O 3.160 -3.860 0.191 1.00 . A A . 2 GLY O 1 1 9 2455 1 1 3 ALA C C 4.198 -6.866 2.244 1.00 . A A . 3 ALA C 1 1 9 2456 1 1 3 ALA CA C 4.154 -6.400 0.805 1.00 . A A . 3 ALA CA 1 1 9 2457 1 1 3 ALA CB C 4.707 -7.469 -0.172 1.00 . A A . 3 ALA CB 1 1 9 2458 1 1 3 ALA H H 5.934 -5.239 0.814 1.00 . A A . 3 ALA H 1 1 9 2459 1 1 3 ALA HA H 3.093 -6.247 0.554 1.00 . A A . 3 ALA HA 1 1 9 2460 1 1 3 ALA HB1 H 4.104 -8.390 -0.127 1.00 . A A . 3 ALA HB1 1 1 9 2461 1 1 3 ALA HB2 H 4.681 -7.082 -1.203 1.00 . A A . 3 ALA HB2 1 1 9 2462 1 1 3 ALA HB3 H 5.748 -7.714 0.087 1.00 . A A . 3 ALA HB3 1 1 9 2463 1 1 3 ALA N N 4.944 -5.174 0.667 1.00 . A A . 3 ALA N 1 1 9 2464 1 1 3 ALA O O 4.325 -8.056 2.488 1.00 . A A . 3 ALA O 1 1 9 2465 1 1 4 GLY C C 2.792 -6.831 5.109 1.00 . A A . 4 GLY C 1 1 9 2466 1 1 4 GLY CA C 4.129 -6.306 4.624 1.00 . A A . 4 GLY CA 1 1 9 2467 1 1 4 GLY H H 3.981 -4.958 2.990 1.00 . A A . 4 GLY H 1 1 9 2468 1 1 4 GLY HA2 H 4.881 -7.093 4.789 1.00 . A A . 4 GLY HA2 1 1 9 2469 1 1 4 GLY HA3 H 4.451 -5.432 5.212 1.00 . A A . 4 GLY HA3 1 1 9 2470 1 1 4 GLY N N 4.092 -5.929 3.214 1.00 . A A . 4 GLY N 1 1 9 2471 1 1 4 GLY O O 2.126 -7.515 4.350 1.00 . A A . 4 GLY O 1 1 9 2472 1 1 5 HIS C C 0.208 -6.113 7.359 1.00 . A A . 5 HIS C 1 1 9 2473 1 1 5 HIS CA C 1.276 -7.156 7.042 1.00 . A A . 5 HIS CA 1 1 9 2474 1 1 5 HIS CB C 1.715 -7.861 8.326 1.00 . A A . 5 HIS CB 1 1 9 2475 1 1 5 HIS CD2 C 2.047 -10.433 8.354 1.00 . A A . 5 HIS CD2 1 1 9 2476 1 1 5 HIS CE1 C 4.029 -10.510 7.420 1.00 . A A . 5 HIS CE1 1 1 9 2477 1 1 5 HIS CG C 2.420 -9.160 8.085 1.00 . A A . 5 HIS CG 1 1 9 2478 1 1 5 HIS H H 3.034 -5.983 6.911 1.00 . A A . 5 HIS H 1 1 9 2479 1 1 5 HIS HA H 0.859 -7.886 6.365 1.00 . A A . 5 HIS HA 1 1 9 2480 1 1 5 HIS HB2 H 2.387 -7.215 8.872 1.00 . A A . 5 HIS HB2 1 1 9 2481 1 1 5 HIS HB3 H 0.844 -8.062 8.933 1.00 . A A . 5 HIS HB3 1 1 9 2482 1 1 5 HIS HD1 H 4.204 -8.485 7.190 1.00 . A A . 5 HIS HD1 1 1 9 2483 1 1 5 HIS HD2 H 1.121 -10.746 8.816 1.00 . A A . 5 HIS HD2 1 1 9 2484 1 1 5 HIS HE1 H 4.956 -10.877 7.006 1.00 . A A . 5 HIS HE1 1 1 9 2485 1 1 5 HIS N N 2.424 -6.540 6.385 1.00 . A A . 5 HIS N 1 1 9 2486 1 1 5 HIS ND1 N 3.666 -9.242 7.501 1.00 . A A . 5 HIS ND1 1 1 9 2487 1 1 5 HIS NE2 N 3.064 -11.253 7.931 1.00 . A A . 5 HIS NE2 1 1 9 2488 1 1 5 HIS O O -0.961 -6.446 7.553 1.00 . A A . 5 HIS O 1 1 9 2489 1 1 6 VAL C C -0.711 -2.910 6.757 1.00 . A A . 6 VAL C 1 1 9 2490 1 1 6 VAL CA C -0.388 -3.784 7.950 1.00 . A A . 6 VAL CA 1 1 9 2491 1 1 6 VAL CB C 0.292 -2.960 9.088 1.00 . A A . 6 VAL CB 1 1 9 2492 1 1 6 VAL CG1 C -0.624 -1.835 9.643 1.00 . A A . 6 VAL CG1 1 1 9 2493 1 1 6 VAL CG2 C 0.739 -3.900 10.244 1.00 . A A . 6 VAL CG2 1 1 9 2494 1 1 6 VAL H H 1.472 -4.462 7.277 1.00 . A A . 6 VAL H 1 1 9 2495 1 1 6 VAL HA H -1.289 -4.244 8.379 1.00 . A A . 6 VAL HA 1 1 9 2496 1 1 6 VAL HB H 1.194 -2.473 8.681 1.00 . A A . 6 VAL HB 1 1 9 2497 1 1 6 VAL HG11 H -0.073 -1.226 10.377 1.00 . A A . 6 VAL HG11 1 1 9 2498 1 1 6 VAL HG12 H -0.962 -1.168 8.834 1.00 . A A . 6 VAL HG12 1 1 9 2499 1 1 6 VAL HG13 H -1.501 -2.265 10.148 1.00 . A A . 6 VAL HG13 1 1 9 2500 1 1 6 VAL HG21 H 1.229 -3.321 11.041 1.00 . A A . 6 VAL HG21 1 1 9 2501 1 1 6 VAL HG22 H -0.132 -4.418 10.674 1.00 . A A . 6 VAL HG22 1 1 9 2502 1 1 6 VAL HG23 H 1.452 -4.658 9.886 1.00 . A A . 6 VAL HG23 1 1 9 2503 1 1 6 VAL N N 0.558 -4.803 7.481 1.00 . A A . 6 VAL N 1 1 9 2504 1 1 6 VAL O O 0.235 -2.604 6.049 1.00 . A A . 6 VAL O 1 1 9 2505 1 1 7 PRO C C -1.611 -0.351 5.255 1.00 . A A . 7 PRO C 1 1 9 2506 1 1 7 PRO CA C -2.188 -1.746 5.220 1.00 . A A . 7 PRO CA 1 1 9 2507 1 1 7 PRO CB C -3.728 -1.761 5.148 1.00 . A A . 7 PRO CB 1 1 9 2508 1 1 7 PRO CD C -3.135 -2.809 7.254 1.00 . A A . 7 PRO CD 1 1 9 2509 1 1 7 PRO CG C -4.153 -1.827 6.631 1.00 . A A . 7 PRO CG 1 1 9 2510 1 1 7 PRO HA H -1.808 -2.309 4.362 1.00 . A A . 7 PRO HA 1 1 9 2511 1 1 7 PRO HB2 H -4.156 -0.908 4.597 1.00 . A A . 7 PRO HB2 1 1 9 2512 1 1 7 PRO HB3 H -4.028 -2.702 4.660 1.00 . A A . 7 PRO HB3 1 1 9 2513 1 1 7 PRO HD2 H -3.036 -2.622 8.332 1.00 . A A . 7 PRO HD2 1 1 9 2514 1 1 7 PRO HD3 H -3.433 -3.854 7.073 1.00 . A A . 7 PRO HD3 1 1 9 2515 1 1 7 PRO HG2 H -4.023 -0.827 7.077 1.00 . A A . 7 PRO HG2 1 1 9 2516 1 1 7 PRO HG3 H -5.194 -2.158 6.769 1.00 . A A . 7 PRO HG3 1 1 9 2517 1 1 7 PRO N N -1.964 -2.486 6.452 1.00 . A A . 7 PRO N 1 1 9 2518 1 1 7 PRO O O -1.516 0.223 6.328 1.00 . A A . 7 PRO O 1 1 9 2519 1 1 8 GLU C C -1.857 2.540 3.953 1.00 . A A . 8 GLU C 1 1 9 2520 1 1 8 GLU CA C -0.705 1.560 4.006 1.00 . A A . 8 GLU CA 1 1 9 2521 1 1 8 GLU CB C 0.208 1.737 2.759 1.00 . A A . 8 GLU CB 1 1 9 2522 1 1 8 GLU CD C 2.377 0.977 1.680 1.00 . A A . 8 GLU CD 1 1 9 2523 1 1 8 GLU CG C 1.520 0.924 2.923 1.00 . A A . 8 GLU CG 1 1 9 2524 1 1 8 GLU H H -1.329 -0.318 3.220 1.00 . A A . 8 GLU H 1 1 9 2525 1 1 8 GLU HA H -0.101 1.780 4.902 1.00 . A A . 8 GLU HA 1 1 9 2526 1 1 8 GLU HB2 H -0.323 1.412 1.849 1.00 . A A . 8 GLU HB2 1 1 9 2527 1 1 8 GLU HB3 H 0.468 2.802 2.638 1.00 . A A . 8 GLU HB3 1 1 9 2528 1 1 8 GLU HG2 H 2.100 1.335 3.763 1.00 . A A . 8 GLU HG2 1 1 9 2529 1 1 8 GLU HG3 H 1.272 -0.119 3.164 1.00 . A A . 8 GLU HG3 1 1 9 2530 1 1 8 GLU N N -1.225 0.194 4.075 1.00 . A A . 8 GLU N 1 1 9 2531 1 1 8 GLU O O -1.772 3.575 4.595 1.00 . A A . 8 GLU O 1 1 9 2532 1 1 8 GLU OE1 O 3.281 1.797 1.636 1.00 . A A . 8 GLU OE1 1 1 9 2533 1 1 9 TYR C C -5.348 2.373 2.964 1.00 . A A . 9 TYR C 1 1 9 2534 1 1 9 TYR CA C -4.064 3.159 3.075 1.00 . A A . 9 TYR CA 1 1 9 2535 1 1 9 TYR CB C -3.832 4.038 1.818 1.00 . A A . 9 TYR CB 1 1 9 2536 1 1 9 TYR CD1 C -4.540 2.453 -0.050 1.00 . A A . 9 TYR CD1 1 1 9 2537 1 1 9 TYR CD2 C -2.199 3.001 0.159 1.00 . A A . 9 TYR CD2 1 1 9 2538 1 1 9 TYR CE1 C -4.240 1.584 -1.103 1.00 . A A . 9 TYR CE1 1 1 9 2539 1 1 9 TYR CE2 C -1.902 2.157 -0.915 1.00 . A A . 9 TYR CE2 1 1 9 2540 1 1 9 TYR CG C -3.516 3.143 0.609 1.00 . A A . 9 TYR CG 1 1 9 2541 1 1 9 TYR CZ C -2.922 1.428 -1.540 1.00 . A A . 9 TYR CZ 1 1 9 2542 1 1 9 TYR H H -2.974 1.388 2.660 1.00 . A A . 9 TYR H 1 1 9 2543 1 1 9 TYR HA H -4.163 3.797 3.970 1.00 . A A . 9 TYR HA 1 1 9 2544 1 1 9 TYR HB2 H -4.710 4.662 1.592 1.00 . A A . 9 TYR HB2 1 1 9 2545 1 1 9 TYR HB3 H -2.988 4.717 2.018 1.00 . A A . 9 TYR HB3 1 1 9 2546 1 1 9 TYR HD1 H -5.574 2.587 0.252 1.00 . A A . 9 TYR HD1 1 1 9 2547 1 1 9 TYR HD2 H -1.394 3.546 0.642 1.00 . A A . 9 TYR HD2 1 1 9 2548 1 1 9 TYR HE1 H -5.035 1.026 -1.588 1.00 . A A . 9 TYR HE1 1 1 9 2549 1 1 9 TYR HE2 H -0.874 2.074 -1.255 1.00 . A A . 9 TYR HE2 1 1 9 2550 1 1 9 TYR HH H -1.743 0.548 -2.879 1.00 . A A . 9 TYR HH 1 1 9 2551 1 1 9 TYR N N -2.936 2.234 3.195 1.00 . A A . 9 TYR N 1 1 9 2552 1 1 9 TYR O O -5.262 1.157 2.884 1.00 . A A . 9 TYR O 1 1 9 2553 1 1 9 TYR OH O -2.649 0.545 -2.591 1.00 . A A . 9 TYR OH 1 1 9 2554 1 1 10 PHE C C -8.656 2.952 1.740 1.00 . A A . 10 PHE C 1 1 9 2555 1 1 10 PHE CA C -7.799 2.331 2.824 1.00 . A A . 10 PHE CA 1 1 9 2556 1 1 10 PHE CB C -8.593 2.381 4.150 1.00 . A A . 10 PHE CB 1 1 9 2557 1 1 10 PHE CD1 C -6.899 2.229 6.046 1.00 . A A . 10 PHE CD1 1 1 9 2558 1 1 10 PHE CD2 C -8.133 0.240 5.440 1.00 . A A . 10 PHE CD2 1 1 9 2559 1 1 10 PHE CE1 C -6.316 1.542 7.114 1.00 . A A . 10 PHE CE1 1 1 9 2560 1 1 10 PHE CE2 C -7.557 -0.447 6.514 1.00 . A A . 10 PHE CE2 1 1 9 2561 1 1 10 PHE CG C -7.852 1.596 5.240 1.00 . A A . 10 PHE CG 1 1 9 2562 1 1 10 PHE CZ C -6.677 0.217 7.373 1.00 . A A . 10 PHE CZ 1 1 9 2563 1 1 10 PHE H H -6.567 4.040 3.054 1.00 . A A . 10 PHE H 1 1 9 2564 1 1 10 PHE HA H -7.624 1.272 2.584 1.00 . A A . 10 PHE HA 1 1 9 2565 1 1 10 PHE HB2 H -8.728 3.428 4.465 1.00 . A A . 10 PHE HB2 1 1 9 2566 1 1 10 PHE HB3 H -9.596 1.945 4.006 1.00 . A A . 10 PHE HB3 1 1 9 2567 1 1 10 PHE HD1 H -6.612 3.257 5.848 1.00 . A A . 10 PHE HD1 1 1 9 2568 1 1 10 PHE HD2 H -8.802 -0.285 4.766 1.00 . A A . 10 PHE HD2 1 1 9 2569 1 1 10 PHE HE1 H -5.585 2.038 7.746 1.00 . A A . 10 PHE HE1 1 1 9 2570 1 1 10 PHE HE2 H -7.797 -1.492 6.679 1.00 . A A . 10 PHE HE2 1 1 9 2571 1 1 10 PHE HZ H -6.274 -0.296 8.242 1.00 . A A . 10 PHE HZ 1 1 9 2572 1 1 10 PHE N N -6.528 3.043 2.956 1.00 . A A . 10 PHE N 1 1 9 2573 1 1 10 PHE O O -8.620 4.164 1.604 1.00 . A A . 10 PHE O 1 1 9 2574 1 1 11 VAL C C -11.780 2.528 0.401 1.00 . A A . 11 VAL C 1 1 9 2575 1 1 11 VAL CA C -10.326 2.611 -0.049 1.00 . A A . 11 VAL CA 1 1 9 2576 1 1 11 VAL CB C -10.159 1.816 -1.358 1.00 . A A . 11 VAL CB 1 1 9 2577 1 1 11 VAL CG1 C -10.964 2.455 -2.478 1.00 . A A . 11 VAL CG1 1 1 9 2578 1 1 11 VAL CG2 C -8.689 1.717 -1.736 1.00 . A A . 11 VAL CG2 1 1 9 2579 1 1 11 VAL H H -9.352 1.158 1.141 1.00 . A A . 11 VAL H 1 1 9 2580 1 1 11 VAL HA H -10.078 3.644 -0.247 1.00 . A A . 11 VAL HA 1 1 9 2581 1 1 11 VAL HB H -10.536 0.816 -1.198 1.00 . A A . 11 VAL HB 1 1 9 2582 1 1 11 VAL HG11 H -11.995 2.139 -2.406 1.00 . A A . 11 VAL HG11 1 1 9 2583 1 1 11 VAL HG12 H -10.910 3.530 -2.394 1.00 . A A . 11 VAL HG12 1 1 9 2584 1 1 11 VAL HG13 H -10.561 2.147 -3.432 1.00 . A A . 11 VAL HG13 1 1 9 2585 1 1 11 VAL HG21 H -8.271 0.812 -1.320 1.00 . A A . 11 VAL HG21 1 1 9 2586 1 1 11 VAL HG22 H -8.594 1.694 -2.812 1.00 . A A . 11 VAL HG22 1 1 9 2587 1 1 11 VAL HG23 H -8.158 2.572 -1.346 1.00 . A A . 11 VAL HG23 1 1 9 2588 1 1 11 VAL N N -9.426 2.123 0.988 1.00 . A A . 11 VAL N 1 1 9 2589 1 1 11 VAL O O -12.101 1.852 1.378 1.00 . A A . 11 VAL O 1 1 9 2590 1 1 12 ARG C C -14.746 1.935 -0.454 1.00 . A A . 12 ARG C 1 1 9 2591 1 1 12 ARG CA C -14.078 3.227 0.006 1.00 . A A . 12 ARG CA 1 1 9 2592 1 1 12 ARG CB C -14.767 4.429 -0.642 1.00 . A A . 12 ARG CB 1 1 9 2593 1 1 12 ARG CD C -14.981 6.928 -0.794 1.00 . A A . 12 ARG CD 1 1 9 2594 1 1 12 ARG CG C -14.345 5.764 -0.050 1.00 . A A . 12 ARG CG 1 1 9 2595 1 1 12 ARG CZ C -16.989 8.335 -0.621 1.00 . A A . 12 ARG CZ 1 1 9 2596 1 1 12 ARG H H -12.341 3.742 -1.087 1.00 . A A . 12 ARG H 1 1 9 2597 1 1 12 ARG HA H -14.172 3.304 1.079 1.00 . A A . 12 ARG HA 1 1 9 2598 1 1 12 ARG HB2 H -14.533 4.438 -1.696 1.00 . A A . 12 ARG HB2 1 1 9 2599 1 1 12 ARG HB3 H -15.834 4.326 -0.519 1.00 . A A . 12 ARG HB3 1 1 9 2600 1 1 12 ARG HD2 H -14.247 7.714 -0.900 1.00 . A A . 12 ARG HD2 1 1 9 2601 1 1 12 ARG HD3 H -15.287 6.589 -1.772 1.00 . A A . 12 ARG HD3 1 1 9 2602 1 1 12 ARG HE H -16.303 7.146 0.826 1.00 . A A . 12 ARG HE 1 1 9 2603 1 1 12 ARG HG2 H -14.653 5.802 0.985 1.00 . A A . 12 ARG HG2 1 1 9 2604 1 1 12 ARG HG3 H -13.271 5.852 -0.112 1.00 . A A . 12 ARG HG3 1 1 9 2605 1 1 12 ARG HH11 H -16.021 8.449 -2.390 1.00 . A A . 12 ARG HH11 1 1 9 2606 1 1 12 ARG HH12 H -17.439 9.436 -2.255 1.00 . A A . 12 ARG HH12 1 1 9 2607 1 1 12 ARG HH21 H -18.171 8.440 1.016 1.00 . A A . 12 ARG HH21 1 1 9 2608 1 1 12 ARG HH22 H -18.661 9.431 -0.317 1.00 . A A . 12 ARG HH22 1 1 9 2609 1 1 12 ARG N N -12.657 3.221 -0.319 1.00 . A A . 12 ARG N 1 1 9 2610 1 1 12 ARG NE N -16.144 7.459 -0.089 1.00 . A A . 12 ARG NE 1 1 9 2611 1 1 12 ARG NH1 N -16.801 8.777 -1.857 1.00 . A A . 12 ARG NH1 1 1 9 2612 1 1 12 ARG NH2 N -18.026 8.771 0.084 1.00 . A A . 12 ARG NH2 1 1 9 2613 1 1 12 ARG O O -15.950 1.902 -0.708 1.00 . A A . 12 ARG O 1 1 9 2614 1 1 13 GLY C C -14.678 -1.375 0.160 1.00 . A A . 13 GLY C 1 1 9 2615 1 1 13 GLY CA C -14.488 -0.409 -0.992 1.00 . A A . 13 GLY CA 1 1 9 2616 1 1 13 GLY H H -13.003 0.955 -0.346 1.00 . A A . 13 GLY H 1 1 9 2617 1 1 13 GLY HA2 H -15.441 -0.246 -1.473 1.00 . A A . 13 GLY HA2 1 1 9 2618 1 1 13 GLY HA3 H -13.806 -0.848 -1.705 1.00 . A A . 13 GLY HA3 1 1 9 2619 1 1 13 GLY N N -13.956 0.871 -0.561 1.00 . A A . 13 GLY N 1 1 9 2620 1 1 13 GLY O O -15.491 -1.135 1.054 1.00 . A A . 13 GLY O 1 1 9 2621 1 1 14 ASP C C -12.703 -3.588 1.953 1.00 . A A . 14 ASP C 1 1 9 2622 1 1 14 ASP CA C -14.020 -3.479 1.191 1.00 . A A . 14 ASP CA 1 1 9 2623 1 1 14 ASP CB C -14.392 -4.837 0.595 1.00 . A A . 14 ASP CB 1 1 9 2624 1 1 14 ASP CG C -14.384 -5.946 1.629 1.00 . A A . 14 ASP CG 1 1 9 2625 1 1 14 ASP H H -13.300 -2.607 -0.599 1.00 . A A . 14 ASP H 1 1 9 2626 1 1 14 ASP HA H -14.794 -3.173 1.878 1.00 . A A . 14 ASP HA 1 1 9 2627 1 1 14 ASP HB2 H -15.383 -4.776 0.168 1.00 . A A . 14 ASP HB2 1 1 9 2628 1 1 14 ASP HB3 H -13.685 -5.088 -0.182 1.00 . A A . 14 ASP HB3 1 1 9 2629 1 1 14 ASP N N -13.929 -2.472 0.140 1.00 . A A . 14 ASP N 1 1 9 2630 1 1 14 ASP O O -12.580 -3.096 3.075 1.00 . A A . 14 ASP O 1 1 9 2631 1 1 14 ASP OD1 O -14.808 -5.690 2.776 1.00 . A A . 14 ASP OD1 1 1 9 2632 1 1 14 ASP OD2 O -13.955 -7.069 1.291 1.00 . A A . 14 ASP OD2 1 1 9 2633 1 1 15 PHE C C -9.337 -3.657 1.186 1.00 . A A . 15 PHE C 1 1 9 2634 1 1 15 PHE CA C -10.413 -4.414 1.959 1.00 . A A . 15 PHE CA 1 1 9 2635 1 1 15 PHE CB C -10.055 -5.900 2.031 1.00 . A A . 15 PHE CB 1 1 9 2636 1 1 15 PHE CD1 C -10.672 -6.188 4.446 1.00 . A A . 15 PHE CD1 1 1 9 2637 1 1 15 PHE CD2 C -11.509 -7.766 2.866 1.00 . A A . 15 PHE CD2 1 1 9 2638 1 1 15 PHE CE1 C -11.319 -6.862 5.465 1.00 . A A . 15 PHE CE1 1 1 9 2639 1 1 15 PHE CE2 C -12.159 -8.443 3.882 1.00 . A A . 15 PHE CE2 1 1 9 2640 1 1 15 PHE CG C -10.759 -6.633 3.137 1.00 . A A . 15 PHE CG 1 1 9 2641 1 1 15 PHE CZ C -12.064 -7.990 5.183 1.00 . A A . 15 PHE CZ 1 1 9 2642 1 1 15 PHE H H -11.879 -4.608 0.444 1.00 . A A . 15 PHE H 1 1 9 2643 1 1 15 PHE HA H -10.467 -4.016 2.960 1.00 . A A . 15 PHE HA 1 1 9 2644 1 1 15 PHE HB2 H -10.321 -6.372 1.098 1.00 . A A . 15 PHE HB2 1 1 9 2645 1 1 15 PHE HB3 H -8.992 -5.999 2.190 1.00 . A A . 15 PHE HB3 1 1 9 2646 1 1 15 PHE HD1 H -10.091 -5.306 4.669 1.00 . A A . 15 PHE HD1 1 1 9 2647 1 1 15 PHE HD2 H -11.584 -8.122 1.848 1.00 . A A . 15 PHE HD2 1 1 9 2648 1 1 15 PHE HE1 H -11.243 -6.505 6.482 1.00 . A A . 15 PHE HE1 1 1 9 2649 1 1 15 PHE HE2 H -12.740 -9.325 3.657 1.00 . A A . 15 PHE HE2 1 1 9 2650 1 1 15 PHE HZ H -12.569 -8.518 5.977 1.00 . A A . 15 PHE HZ 1 1 9 2651 1 1 15 PHE N N -11.720 -4.238 1.337 1.00 . A A . 15 PHE N 1 1 9 2652 1 1 15 PHE O O -9.511 -3.296 0.021 1.00 . A A . 15 PHE O 1 1 9 2653 1 1 16 PRO C C -6.341 -3.457 0.237 1.00 . A A . 16 PRO C 1 1 9 2654 1 1 16 PRO CA C -7.160 -2.532 1.104 1.00 . A A . 16 PRO CA 1 1 9 2655 1 1 16 PRO CB C -6.355 -1.948 2.292 1.00 . A A . 16 PRO CB 1 1 9 2656 1 1 16 PRO CD C -7.973 -3.480 3.249 1.00 . A A . 16 PRO CD 1 1 9 2657 1 1 16 PRO CG C -6.511 -3.017 3.393 1.00 . A A . 16 PRO CG 1 1 9 2658 1 1 16 PRO HA H -7.581 -1.720 0.487 1.00 . A A . 16 PRO HA 1 1 9 2659 1 1 16 PRO HB2 H -5.304 -1.719 2.054 1.00 . A A . 16 PRO HB2 1 1 9 2660 1 1 16 PRO HB3 H -6.848 -1.029 2.645 1.00 . A A . 16 PRO HB3 1 1 9 2661 1 1 16 PRO HD2 H -8.062 -4.508 3.621 1.00 . A A . 16 PRO HD2 1 1 9 2662 1 1 16 PRO HD3 H -8.629 -2.807 3.824 1.00 . A A . 16 PRO HD3 1 1 9 2663 1 1 16 PRO HG2 H -5.824 -3.853 3.181 1.00 . A A . 16 PRO HG2 1 1 9 2664 1 1 16 PRO HG3 H -6.328 -2.631 4.408 1.00 . A A . 16 PRO HG3 1 1 9 2665 1 1 16 PRO N N -8.188 -3.282 1.820 1.00 . A A . 16 PRO N 1 1 9 2666 1 1 16 PRO O O -6.600 -4.650 0.252 1.00 . A A . 16 PRO O 1 1 9 2667 1 1 17 ILE C C -3.210 -3.959 -1.100 1.00 . A A . 17 ILE C 1 1 9 2668 1 1 17 ILE CA C -4.642 -3.703 -1.525 1.00 . A A . 17 ILE CA 1 1 9 2669 1 1 17 ILE CB C -4.684 -2.989 -2.911 1.00 . A A . 17 ILE CB 1 1 9 2670 1 1 17 ILE CD1 C -7.147 -3.739 -3.449 1.00 . A A . 17 ILE CD1 1 1 9 2671 1 1 17 ILE CG1 C -6.129 -2.573 -3.331 1.00 . A A . 17 ILE CG1 1 1 9 2672 1 1 17 ILE CG2 C -3.977 -3.847 -4.000 1.00 . A A . 17 ILE CG2 1 1 9 2673 1 1 17 ILE H H -5.165 -1.929 -0.472 1.00 . A A . 17 ILE H 1 1 9 2674 1 1 17 ILE HA H -5.117 -4.686 -1.664 1.00 . A A . 17 ILE HA 1 1 9 2675 1 1 17 ILE HB H -4.114 -2.047 -2.836 1.00 . A A . 17 ILE HB 1 1 9 2676 1 1 17 ILE HD11 H -8.116 -3.346 -3.797 1.00 . A A . 17 ILE HD11 1 1 9 2677 1 1 17 ILE HD12 H -6.808 -4.494 -4.173 1.00 . A A . 17 ILE HD12 1 1 9 2678 1 1 17 ILE HD13 H -7.315 -4.225 -2.476 1.00 . A A . 17 ILE HD13 1 1 9 2679 1 1 17 ILE HG12 H -6.531 -1.846 -2.606 1.00 . A A . 17 ILE HG12 1 1 9 2680 1 1 17 ILE HG13 H -6.078 -2.061 -4.307 1.00 . A A . 17 ILE HG13 1 1 9 2681 1 1 17 ILE HG21 H -4.043 -3.354 -4.983 1.00 . A A . 17 ILE HG21 1 1 9 2682 1 1 17 ILE HG22 H -2.911 -3.975 -3.758 1.00 . A A . 17 ILE HG22 1 1 9 2683 1 1 17 ILE HG23 H -4.429 -4.847 -4.079 1.00 . A A . 17 ILE HG23 1 1 9 2684 1 1 17 ILE N N -5.370 -2.908 -0.533 1.00 . A A . 17 ILE N 1 1 9 2685 1 1 17 ILE O O -2.834 -5.118 -1.010 1.00 . A A . 17 ILE O 1 1 9 2686 1 1 18 SER C C -0.708 -3.100 0.900 1.00 . A A . 18 SER C 1 1 9 2687 1 1 18 SER CA C -0.961 -3.112 -0.588 1.00 . A A . 18 SER CA 1 1 9 2688 1 1 18 SER CB C -0.132 -1.996 -1.282 1.00 . A A . 18 SER CB 1 1 9 2689 1 1 18 SER H H -2.739 -1.974 -0.868 1.00 . A A . 18 SER H 1 1 9 2690 1 1 18 SER HA H -0.621 -4.081 -0.992 1.00 . A A . 18 SER HA 1 1 9 2691 1 1 18 SER HB2 H 0.926 -2.295 -1.342 1.00 . A A . 18 SER HB2 1 1 9 2692 1 1 18 SER HB3 H -0.494 -1.838 -2.311 1.00 . A A . 18 SER HB3 1 1 9 2693 1 1 18 SER HG H -1.037 -0.420 -0.412 1.00 . A A . 18 SER HG 1 1 9 2694 1 1 18 SER N N -2.388 -2.909 -0.861 1.00 . A A . 18 SER N 1 1 9 2695 1 1 18 SER O O -1.658 -2.886 1.638 1.00 . A A . 18 SER O 1 1 9 2696 1 1 18 SER OG O -0.162 -0.769 -0.533 1.00 . A A . 18 SER OG 1 1 9 2697 1 1 19 PHE C C 2.122 -2.689 3.134 1.00 . A A . 19 PHE C 1 1 9 2698 1 1 19 PHE CA C 0.832 -3.393 2.785 1.00 . A A . 19 PHE CA 1 1 9 2699 1 1 19 PHE CB C 0.750 -4.875 3.237 1.00 . A A . 19 PHE CB 1 1 9 2700 1 1 19 PHE CD1 C -1.751 -5.371 3.258 1.00 . A A . 19 PHE CD1 1 1 9 2701 1 1 19 PHE CD2 C -0.411 -6.280 1.461 1.00 . A A . 19 PHE CD2 1 1 9 2702 1 1 19 PHE CE1 C -2.898 -5.920 2.678 1.00 . A A . 19 PHE CE1 1 1 9 2703 1 1 19 PHE CE2 C -1.554 -6.858 0.899 1.00 . A A . 19 PHE CE2 1 1 9 2704 1 1 19 PHE CG C -0.505 -5.528 2.640 1.00 . A A . 19 PHE CG 1 1 9 2705 1 1 19 PHE CZ C -2.801 -6.666 1.500 1.00 . A A . 19 PHE CZ 1 1 9 2706 1 1 19 PHE H H 1.311 -3.527 0.727 1.00 . A A . 19 PHE H 1 1 9 2707 1 1 19 PHE HA H 0.085 -2.813 3.336 1.00 . A A . 19 PHE HA 1 1 9 2708 1 1 19 PHE HB2 H 1.634 -5.401 2.859 1.00 . A A . 19 PHE HB2 1 1 9 2709 1 1 19 PHE HB3 H 0.724 -4.975 4.334 1.00 . A A . 19 PHE HB3 1 1 9 2710 1 1 19 PHE HD1 H -1.831 -4.820 4.191 1.00 . A A . 19 PHE HD1 1 1 9 2711 1 1 19 PHE HD2 H 0.548 -6.419 0.972 1.00 . A A . 19 PHE HD2 1 1 9 2712 1 1 19 PHE HE1 H -3.869 -5.769 3.144 1.00 . A A . 19 PHE HE1 1 1 9 2713 1 1 19 PHE HE2 H -1.469 -7.453 -0.006 1.00 . A A . 19 PHE HE2 1 1 9 2714 1 1 19 PHE HZ H -3.692 -7.098 1.051 1.00 . A A . 19 PHE HZ 1 1 9 2715 1 1 19 PHE N N 0.552 -3.331 1.350 1.00 . A A . 19 PHE N 1 1 9 2716 1 1 19 PHE O O 2.760 -2.158 2.240 1.00 . A A . 19 PHE O 1 1 9 2717 1 1 20 TYR C C 4.923 -2.358 4.318 1.00 . A A . 20 TYR C 1 1 9 2718 1 1 20 TYR CA C 3.626 -1.788 4.845 1.00 . A A . 20 TYR CA 1 1 9 2719 1 1 20 TYR CB C 3.659 -1.599 6.395 1.00 . A A . 20 TYR CB 1 1 9 2720 1 1 20 TYR CD1 C 3.143 0.872 6.573 1.00 . A A . 20 TYR CD1 1 1 9 2721 1 1 20 TYR CD2 C 5.267 0.112 7.426 1.00 . A A . 20 TYR CD2 1 1 9 2722 1 1 20 TYR CE1 C 3.486 2.190 6.885 1.00 . A A . 20 TYR CE1 1 1 9 2723 1 1 20 TYR CE2 C 5.605 1.428 7.754 1.00 . A A . 20 TYR CE2 1 1 9 2724 1 1 20 TYR CG C 4.044 -0.171 6.808 1.00 . A A . 20 TYR CG 1 1 9 2725 1 1 20 TYR CZ C 4.719 2.477 7.475 1.00 . A A . 20 TYR CZ 1 1 9 2726 1 1 20 TYR H H 1.989 -3.135 5.129 1.00 . A A . 20 TYR H 1 1 9 2727 1 1 20 TYR HA H 3.491 -0.803 4.375 1.00 . A A . 20 TYR HA 1 1 9 2728 1 1 20 TYR HB2 H 2.654 -1.729 6.821 1.00 . A A . 20 TYR HB2 1 1 9 2729 1 1 20 TYR HB3 H 4.305 -2.360 6.859 1.00 . A A . 20 TYR HB3 1 1 9 2730 1 1 20 TYR HD1 H 2.167 0.662 6.149 1.00 . A A . 20 TYR HD1 1 1 9 2731 1 1 20 TYR HD2 H 5.961 -0.690 7.655 1.00 . A A . 20 TYR HD2 1 1 9 2732 1 1 20 TYR HE1 H 2.792 2.996 6.669 1.00 . A A . 20 TYR HE1 1 1 9 2733 1 1 20 TYR HE2 H 6.562 1.628 8.226 1.00 . A A . 20 TYR HE2 1 1 9 2734 1 1 20 TYR HH H 5.893 3.922 8.178 1.00 . A A . 20 TYR HH 1 1 9 2735 1 1 20 TYR N N 2.503 -2.636 4.432 1.00 . A A . 20 TYR N 1 1 9 2736 1 1 20 TYR O O 4.892 -3.393 3.673 1.00 . A A . 20 TYR O 1 1 9 2737 1 1 20 TYR OH O 5.041 3.804 7.774 1.00 . A A . 20 TYR OH 1 1 9 2738 1 1 21 GLY C C 7.838 -1.461 2.925 1.00 . A A . 21 GLY C 1 1 9 2739 1 1 21 GLY CA C 7.368 -2.222 4.132 1.00 . A A . 21 GLY CA 1 1 9 2740 1 1 21 GLY H H 6.070 -0.818 5.048 1.00 . A A . 21 GLY H 1 1 9 2741 1 1 21 GLY HA2 H 8.122 -2.104 4.928 1.00 . A A . 21 GLY HA2 1 1 9 2742 1 1 21 GLY HA3 H 7.321 -3.290 3.876 1.00 . A A . 21 GLY HA3 1 1 9 2743 1 1 21 GLY N N 6.076 -1.700 4.579 1.00 . A A . 21 GLY N 1 1 9 2744 1 1 21 GLY O O 9.005 -1.685 2.506 1.00 . A A . 21 GLY O 1 1 9 2745 1 1 21 GLY OXT O 7.047 -0.641 2.386 1.00 . A A . 21 GLY OXT 1 1 10 2746 1 1 1 GLY C C 3.559 -1.112 -0.767 1.00 . A A . 1 GLY C 1 1 10 2747 1 1 1 GLY CA C 2.780 0.173 -0.625 1.00 . A A . 1 GLY CA 1 1 10 2748 1 1 1 GLY H1 H 1.251 -0.510 0.674 1.00 . A A . 1 GLY H1 1 1 10 2749 1 1 1 GLY HA2 H 2.083 0.283 -1.470 1.00 . A A . 1 GLY HA2 1 1 10 2750 1 1 1 GLY HA3 H 3.496 1.008 -0.677 1.00 . A A . 1 GLY HA3 1 1 10 2751 1 1 1 GLY N N 1.996 0.157 0.608 1.00 . A A . 1 GLY N 1 1 10 2752 1 1 1 GLY O O 3.468 -1.752 -1.804 1.00 . A A . 1 GLY O 1 1 10 2753 1 1 2 GLY C C 4.238 -3.948 0.310 1.00 . A A . 2 GLY C 1 1 10 2754 1 1 2 GLY CA C 5.122 -2.730 0.180 1.00 . A A . 2 GLY CA 1 1 10 2755 1 1 2 GLY H H 4.384 -0.961 1.113 1.00 . A A . 2 GLY H 1 1 10 2756 1 1 2 GLY HA2 H 5.658 -2.779 -0.780 1.00 . A A . 2 GLY HA2 1 1 10 2757 1 1 2 GLY HA3 H 5.877 -2.737 0.982 1.00 . A A . 2 GLY HA3 1 1 10 2758 1 1 2 GLY N N 4.343 -1.497 0.266 1.00 . A A . 2 GLY N 1 1 10 2759 1 1 2 GLY O O 3.047 -3.841 0.063 1.00 . A A . 2 GLY O 1 1 10 2760 1 1 3 ALA C C 4.106 -6.783 2.307 1.00 . A A . 3 ALA C 1 1 10 2761 1 1 3 ALA CA C 4.022 -6.335 0.865 1.00 . A A . 3 ALA CA 1 1 10 2762 1 1 3 ALA CB C 4.539 -7.416 -0.117 1.00 . A A . 3 ALA CB 1 1 10 2763 1 1 3 ALA H H 5.799 -5.170 0.870 1.00 . A A . 3 ALA H 1 1 10 2764 1 1 3 ALA HA H 2.954 -6.182 0.645 1.00 . A A . 3 ALA HA 1 1 10 2765 1 1 3 ALA HB1 H 4.481 -7.040 -1.151 1.00 . A A . 3 ALA HB1 1 1 10 2766 1 1 3 ALA HB2 H 5.588 -7.655 0.113 1.00 . A A . 3 ALA HB2 1 1 10 2767 1 1 3 ALA HB3 H 3.938 -8.335 -0.042 1.00 . A A . 3 ALA HB3 1 1 10 2768 1 1 3 ALA N N 4.814 -5.115 0.689 1.00 . A A . 3 ALA N 1 1 10 2769 1 1 3 ALA O O 4.246 -7.968 2.564 1.00 . A A . 3 ALA O 1 1 10 2770 1 1 4 GLY C C 2.754 -6.724 5.188 1.00 . A A . 4 GLY C 1 1 10 2771 1 1 4 GLY CA C 4.080 -6.193 4.681 1.00 . A A . 4 GLY CA 1 1 10 2772 1 1 4 GLY H H 3.896 -4.865 3.034 1.00 . A A . 4 GLY H 1 1 10 2773 1 1 4 GLY HA2 H 4.842 -6.972 4.844 1.00 . A A . 4 GLY HA2 1 1 10 2774 1 1 4 GLY HA3 H 4.403 -5.309 5.253 1.00 . A A . 4 GLY HA3 1 1 10 2775 1 1 4 GLY N N 4.018 -5.833 3.267 1.00 . A A . 4 GLY N 1 1 10 2776 1 1 4 GLY O O 2.095 -7.439 4.448 1.00 . A A . 4 GLY O 1 1 10 2777 1 1 5 HIS C C 0.164 -5.966 7.416 1.00 . A A . 5 HIS C 1 1 10 2778 1 1 5 HIS CA C 1.238 -7.009 7.125 1.00 . A A . 5 HIS CA 1 1 10 2779 1 1 5 HIS CB C 1.679 -7.681 8.426 1.00 . A A . 5 HIS CB 1 1 10 2780 1 1 5 HIS CD2 C 2.176 -9.974 7.320 1.00 . A A . 5 HIS CD2 1 1 10 2781 1 1 5 HIS CE1 C 3.874 -10.572 8.572 1.00 . A A . 5 HIS CE1 1 1 10 2782 1 1 5 HIS CG C 2.389 -8.983 8.218 1.00 . A A . 5 HIS CG 1 1 10 2783 1 1 5 HIS H H 2.991 -5.832 6.968 1.00 . A A . 5 HIS H 1 1 10 2784 1 1 5 HIS HA H 0.826 -7.758 6.466 1.00 . A A . 5 HIS HA 1 1 10 2785 1 1 5 HIS HB2 H 2.349 -7.020 8.956 1.00 . A A . 5 HIS HB2 1 1 10 2786 1 1 5 HIS HB3 H 0.809 -7.871 9.039 1.00 . A A . 5 HIS HB3 1 1 10 2787 1 1 5 HIS HD1 H 3.855 -8.884 9.728 1.00 . A A . 5 HIS HD1 1 1 10 2788 1 1 5 HIS HD2 H 1.412 -9.994 6.556 1.00 . A A . 5 HIS HD2 1 1 10 2789 1 1 5 HIS HE1 H 4.696 -11.136 8.987 1.00 . A A . 5 HIS HE1 1 1 10 2790 1 1 5 HIS N N 2.383 -6.404 6.455 1.00 . A A . 5 HIS N 1 1 10 2791 1 1 5 HIS ND1 N 3.459 -9.389 8.988 1.00 . A A . 5 HIS ND1 1 1 10 2792 1 1 5 HIS NE2 N 3.112 -10.950 7.561 1.00 . A A . 5 HIS NE2 1 1 10 2793 1 1 5 HIS O O -1.002 -6.301 7.621 1.00 . A A . 5 HIS O 1 1 10 2794 1 1 6 VAL C C -0.785 -2.805 6.719 1.00 . A A . 6 VAL C 1 1 10 2795 1 1 6 VAL CA C -0.447 -3.628 7.943 1.00 . A A . 6 VAL CA 1 1 10 2796 1 1 6 VAL CB C 0.226 -2.750 9.044 1.00 . A A . 6 VAL CB 1 1 10 2797 1 1 6 VAL CG1 C -0.709 -1.622 9.561 1.00 . A A . 6 VAL CG1 1 1 10 2798 1 1 6 VAL CG2 C 0.695 -3.638 10.232 1.00 . A A . 6 VAL CG2 1 1 10 2799 1 1 6 VAL H H 1.420 -4.310 7.292 1.00 . A A . 6 VAL H 1 1 10 2800 1 1 6 VAL HA H -1.337 -4.085 8.395 1.00 . A A . 6 VAL HA 1 1 10 2801 1 1 6 VAL HB H 1.116 -2.264 8.614 1.00 . A A . 6 VAL HB 1 1 10 2802 1 1 6 VAL HG11 H -0.168 -0.977 10.272 1.00 . A A . 6 VAL HG11 1 1 10 2803 1 1 6 VAL HG12 H -1.061 -0.992 8.730 1.00 . A A . 6 VAL HG12 1 1 10 2804 1 1 6 VAL HG13 H -1.577 -2.050 10.083 1.00 . A A . 6 VAL HG13 1 1 10 2805 1 1 6 VAL HG21 H -0.164 -4.154 10.687 1.00 . A A . 6 VAL HG21 1 1 10 2806 1 1 6 VAL HG22 H 1.419 -4.397 9.898 1.00 . A A . 6 VAL HG22 1 1 10 2807 1 1 6 VAL HG23 H 1.181 -3.021 11.004 1.00 . A A . 6 VAL HG23 1 1 10 2808 1 1 6 VAL N N 0.507 -4.652 7.504 1.00 . A A . 6 VAL N 1 1 10 2809 1 1 6 VAL O O 0.155 -2.505 6.000 1.00 . A A . 6 VAL O 1 1 10 2810 1 1 7 PRO C C -1.740 -0.304 5.168 1.00 . A A . 7 PRO C 1 1 10 2811 1 1 7 PRO CA C -2.280 -1.713 5.148 1.00 . A A . 7 PRO CA 1 1 10 2812 1 1 7 PRO CB C -3.818 -1.772 5.068 1.00 . A A . 7 PRO CB 1 1 10 2813 1 1 7 PRO CD C -3.211 -2.738 7.211 1.00 . A A . 7 PRO CD 1 1 10 2814 1 1 7 PRO CG C -4.252 -1.805 6.549 1.00 . A A . 7 PRO CG 1 1 10 2815 1 1 7 PRO HA H -1.871 -2.278 4.303 1.00 . A A . 7 PRO HA 1 1 10 2816 1 1 7 PRO HB2 H -4.265 -0.947 4.490 1.00 . A A . 7 PRO HB2 1 1 10 2817 1 1 7 PRO HB3 H -4.088 -2.735 4.604 1.00 . A A . 7 PRO HB3 1 1 10 2818 1 1 7 PRO HD2 H -3.120 -2.509 8.282 1.00 . A A . 7 PRO HD2 1 1 10 2819 1 1 7 PRO HD3 H -3.480 -3.797 7.069 1.00 . A A . 7 PRO HD3 1 1 10 2820 1 1 7 PRO HG2 H -4.156 -0.787 6.964 1.00 . A A . 7 PRO HG2 1 1 10 2821 1 1 7 PRO HG3 H -5.283 -2.163 6.690 1.00 . A A . 7 PRO HG3 1 1 10 2822 1 1 7 PRO N N -2.046 -2.416 6.400 1.00 . A A . 7 PRO N 1 1 10 2823 1 1 7 PRO O O -1.680 0.289 6.232 1.00 . A A . 7 PRO O 1 1 10 2824 1 1 8 GLU C C -2.007 2.564 3.826 1.00 . A A . 8 GLU C 1 1 10 2825 1 1 8 GLU CA C -0.844 1.601 3.907 1.00 . A A . 8 GLU CA 1 1 10 2826 1 1 8 GLU CB C 0.085 1.769 2.670 1.00 . A A . 8 GLU CB 1 1 10 2827 1 1 8 GLU CD C 2.263 1.010 1.625 1.00 . A A . 8 GLU CD 1 1 10 2828 1 1 8 GLU CG C 1.392 0.953 2.857 1.00 . A A . 8 GLU CG 1 1 10 2829 1 1 8 GLU H H -1.422 -0.297 3.136 1.00 . A A . 8 GLU H 1 1 10 2830 1 1 8 GLU HA H -0.256 1.841 4.810 1.00 . A A . 8 GLU HA 1 1 10 2831 1 1 8 GLU HB2 H -0.433 1.441 1.753 1.00 . A A . 8 GLU HB2 1 1 10 2832 1 1 8 GLU HB3 H 0.345 2.833 2.549 1.00 . A A . 8 GLU HB3 1 1 10 2833 1 1 8 GLU HG2 H 1.964 1.364 3.702 1.00 . A A . 8 GLU HG2 1 1 10 2834 1 1 8 GLU HG3 H 1.141 -0.092 3.094 1.00 . A A . 8 GLU HG3 1 1 10 2835 1 1 8 GLU N N -1.344 0.229 3.987 1.00 . A A . 8 GLU N 1 1 10 2836 1 1 8 GLU O O -1.944 3.611 4.452 1.00 . A A . 8 GLU O 1 1 10 2837 1 1 8 GLU OE1 O 3.170 1.827 1.595 1.00 . A A . 8 GLU OE1 1 1 10 2838 1 1 9 TYR C C -5.490 2.315 2.853 1.00 . A A . 9 TYR C 1 1 10 2839 1 1 9 TYR CA C -4.218 3.126 2.923 1.00 . A A . 9 TYR CA 1 1 10 2840 1 1 9 TYR CB C -4.020 3.962 1.631 1.00 . A A . 9 TYR CB 1 1 10 2841 1 1 9 TYR CD1 C -4.772 2.323 -0.175 1.00 . A A . 9 TYR CD1 1 1 10 2842 1 1 9 TYR CD2 C -2.427 2.877 -0.034 1.00 . A A . 9 TYR CD2 1 1 10 2843 1 1 9 TYR CE1 C -4.498 1.435 -1.221 1.00 . A A . 9 TYR CE1 1 1 10 2844 1 1 9 TYR CE2 C -2.158 2.021 -1.106 1.00 . A A . 9 TYR CE2 1 1 10 2845 1 1 9 TYR CG C -3.734 3.031 0.442 1.00 . A A . 9 TYR CG 1 1 10 2846 1 1 9 TYR CZ C -3.192 1.281 -1.694 1.00 . A A . 9 TYR CZ 1 1 10 2847 1 1 9 TYR H H -3.091 1.371 2.544 1.00 . A A . 9 TYR H 1 1 10 2848 1 1 9 TYR HA H -4.318 3.795 3.794 1.00 . A A . 9 TYR HA 1 1 10 2849 1 1 9 TYR HB2 H -4.905 4.576 1.406 1.00 . A A . 9 TYR HB2 1 1 10 2850 1 1 9 TYR HB3 H -3.175 4.651 1.789 1.00 . A A . 9 TYR HB3 1 1 10 2851 1 1 9 TYR HD1 H -5.798 2.456 0.153 1.00 . A A . 9 TYR HD1 1 1 10 2852 1 1 9 TYR HD2 H -1.610 3.422 0.426 1.00 . A A . 9 TYR HD2 1 1 10 2853 1 1 9 TYR HE1 H -5.303 0.863 -1.671 1.00 . A A . 9 TYR HE1 1 1 10 2854 1 1 9 TYR HE2 H -1.140 1.938 -1.473 1.00 . A A . 9 TYR HE2 1 1 10 2855 1 1 9 TYR HH H -2.032 0.332 -3.003 1.00 . A A . 9 TYR HH 1 1 10 2856 1 1 9 TYR N N -3.073 2.227 3.063 1.00 . A A . 9 TYR N 1 1 10 2857 1 1 9 TYR O O -5.384 1.099 2.813 1.00 . A A . 9 TYR O 1 1 10 2858 1 1 9 TYR OH O -2.945 0.392 -2.745 1.00 . A A . 9 TYR OH 1 1 10 2859 1 1 10 PHE C C -8.796 2.817 1.610 1.00 . A A . 10 PHE C 1 1 10 2860 1 1 10 PHE CA C -7.938 2.231 2.711 1.00 . A A . 10 PHE CA 1 1 10 2861 1 1 10 PHE CB C -8.740 2.291 4.032 1.00 . A A . 10 PHE CB 1 1 10 2862 1 1 10 PHE CD1 C -7.061 2.163 5.943 1.00 . A A . 10 PHE CD1 1 1 10 2863 1 1 10 PHE CD2 C -8.275 0.162 5.340 1.00 . A A . 10 PHE CD2 1 1 10 2864 1 1 10 PHE CE1 C -6.481 1.486 7.020 1.00 . A A . 10 PHE CE1 1 1 10 2865 1 1 10 PHE CE2 C -7.702 -0.515 6.419 1.00 . A A . 10 PHE CE2 1 1 10 2866 1 1 10 PHE CG C -8.002 1.520 5.133 1.00 . A A . 10 PHE CG 1 1 10 2867 1 1 10 PHE CZ C -6.834 0.160 7.283 1.00 . A A . 10 PHE CZ 1 1 10 2868 1 1 10 PHE H H -6.736 3.963 2.904 1.00 . A A . 10 PHE H 1 1 10 2869 1 1 10 PHE HA H -7.745 1.171 2.491 1.00 . A A . 10 PHE HA 1 1 10 2870 1 1 10 PHE HB2 H -8.881 3.341 4.335 1.00 . A A . 10 PHE HB2 1 1 10 2871 1 1 10 PHE HB3 H -9.741 1.851 3.886 1.00 . A A . 10 PHE HB3 1 1 10 2872 1 1 10 PHE HD1 H -6.779 3.192 5.741 1.00 . A A . 10 PHE HD1 1 1 10 2873 1 1 10 PHE HD2 H -8.938 -0.370 4.665 1.00 . A A . 10 PHE HD2 1 1 10 2874 1 1 10 PHE HE1 H -5.759 1.991 7.654 1.00 . A A . 10 PHE HE1 1 1 10 2875 1 1 10 PHE HE2 H -7.934 -1.562 6.588 1.00 . A A . 10 PHE HE2 1 1 10 2876 1 1 10 PHE HZ H -6.433 -0.346 8.155 1.00 . A A . 10 PHE HZ 1 1 10 2877 1 1 10 PHE N N -6.680 2.965 2.832 1.00 . A A . 10 PHE N 1 1 10 2878 1 1 10 PHE O O -8.775 4.027 1.448 1.00 . A A . 10 PHE O 1 1 10 2879 1 1 11 VAL C C -11.904 2.328 0.264 1.00 . A A . 11 VAL C 1 1 10 2880 1 1 11 VAL CA C -10.449 2.416 -0.182 1.00 . A A . 11 VAL CA 1 1 10 2881 1 1 11 VAL CB C -10.268 1.590 -1.470 1.00 . A A . 11 VAL CB 1 1 10 2882 1 1 11 VAL CG1 C -11.079 2.190 -2.608 1.00 . A A . 11 VAL CG1 1 1 10 2883 1 1 11 VAL CG2 C -8.796 1.500 -1.842 1.00 . A A . 11 VAL CG2 1 1 10 2884 1 1 11 VAL H H -9.464 1.003 1.048 1.00 . A A . 11 VAL H 1 1 10 2885 1 1 11 VAL HA H -10.212 3.446 -0.405 1.00 . A A . 11 VAL HA 1 1 10 2886 1 1 11 VAL HB H -10.633 0.590 -1.286 1.00 . A A . 11 VAL HB 1 1 10 2887 1 1 11 VAL HG11 H -11.040 3.268 -2.548 1.00 . A A . 11 VAL HG11 1 1 10 2888 1 1 11 VAL HG12 H -10.668 1.866 -3.553 1.00 . A A . 11 VAL HG12 1 1 10 2889 1 1 11 VAL HG13 H -12.105 1.863 -2.530 1.00 . A A . 11 VAL HG13 1 1 10 2890 1 1 11 VAL HG21 H -8.341 2.475 -1.747 1.00 . A A . 11 VAL HG21 1 1 10 2891 1 1 11 VAL HG22 H -8.298 0.805 -1.181 1.00 . A A . 11 VAL HG22 1 1 10 2892 1 1 11 VAL HG23 H -8.702 1.156 -2.861 1.00 . A A . 11 VAL HG23 1 1 10 2893 1 1 11 VAL N N -9.548 1.963 0.870 1.00 . A A . 11 VAL N 1 1 10 2894 1 1 11 VAL O O -12.221 1.670 1.255 1.00 . A A . 11 VAL O 1 1 10 2895 1 1 12 ARG C C -14.862 1.686 -0.591 1.00 . A A . 12 ARG C 1 1 10 2896 1 1 12 ARG CA C -14.207 2.993 -0.153 1.00 . A A . 12 ARG CA 1 1 10 2897 1 1 12 ARG CB C -14.905 4.176 -0.827 1.00 . A A . 12 ARG CB 1 1 10 2898 1 1 12 ARG CD C -15.125 6.670 -1.048 1.00 . A A . 12 ARG CD 1 1 10 2899 1 1 12 ARG CG C -14.477 5.528 -0.280 1.00 . A A . 12 ARG CG 1 1 10 2900 1 1 12 ARG CZ C -14.908 8.550 0.521 1.00 . A A . 12 ARG CZ 1 1 10 2901 1 1 12 ARG H H -12.471 3.502 -1.252 1.00 . A A . 12 ARG H 1 1 10 2902 1 1 12 ARG HA H -14.306 3.091 0.918 1.00 . A A . 12 ARG HA 1 1 10 2903 1 1 12 ARG HB2 H -14.686 4.154 -1.884 1.00 . A A . 12 ARG HB2 1 1 10 2904 1 1 12 ARG HB3 H -15.971 4.077 -0.687 1.00 . A A . 12 ARG HB3 1 1 10 2905 1 1 12 ARG HD2 H -14.383 7.121 -1.690 1.00 . A A . 12 ARG HD2 1 1 10 2906 1 1 12 ARG HD3 H -15.927 6.271 -1.650 1.00 . A A . 12 ARG HD3 1 1 10 2907 1 1 12 ARG HE H -16.637 7.741 -0.057 1.00 . A A . 12 ARG HE 1 1 10 2908 1 1 12 ARG HG2 H -14.769 5.596 0.757 1.00 . A A . 12 ARG HG2 1 1 10 2909 1 1 12 ARG HG3 H -13.404 5.615 -0.361 1.00 . A A . 12 ARG HG3 1 1 10 2910 1 1 12 ARG HH11 H -13.160 7.831 -0.190 1.00 . A A . 12 ARG HH11 1 1 10 2911 1 1 12 ARG HH12 H -13.021 9.156 0.917 1.00 . A A . 12 ARG HH12 1 1 10 2912 1 1 12 ARG HH21 H -16.468 9.487 1.402 1.00 . A A . 12 ARG HH21 1 1 10 2913 1 1 12 ARG HH22 H -14.904 10.097 1.823 1.00 . A A . 12 ARG HH22 1 1 10 2914 1 1 12 ARG N N -12.785 2.995 -0.474 1.00 . A A . 12 ARG N 1 1 10 2915 1 1 12 ARG NE N -15.664 7.693 -0.155 1.00 . A A . 12 ARG NE 1 1 10 2916 1 1 12 ARG NH1 N -13.588 8.509 0.407 1.00 . A A . 12 ARG NH1 1 1 10 2917 1 1 12 ARG NH2 N -15.473 9.452 1.314 1.00 . A A . 12 ARG NH2 1 1 10 2918 1 1 12 ARG O O -16.065 1.636 -0.844 1.00 . A A . 12 ARG O 1 1 10 2919 1 1 13 GLY C C -14.758 -1.611 0.082 1.00 . A A . 13 GLY C 1 1 10 2920 1 1 13 GLY CA C -14.578 -0.663 -1.087 1.00 . A A . 13 GLY CA 1 1 10 2921 1 1 13 GLY H H -13.108 0.728 -0.465 1.00 . A A . 13 GLY H 1 1 10 2922 1 1 13 GLY HA2 H -15.533 -0.520 -1.571 1.00 . A A . 13 GLY HA2 1 1 10 2923 1 1 13 GLY HA3 H -13.891 -1.107 -1.793 1.00 . A A . 13 GLY HA3 1 1 10 2924 1 1 13 GLY N N -14.060 0.629 -0.679 1.00 . A A . 13 GLY N 1 1 10 2925 1 1 13 GLY O O -15.572 -1.364 0.971 1.00 . A A . 13 GLY O 1 1 10 2926 1 1 14 ASP C C -12.759 -3.770 1.914 1.00 . A A . 14 ASP C 1 1 10 2927 1 1 14 ASP CA C -14.076 -3.690 1.149 1.00 . A A . 14 ASP CA 1 1 10 2928 1 1 14 ASP CB C -14.433 -5.062 0.577 1.00 . A A . 14 ASP CB 1 1 10 2929 1 1 14 ASP CG C -14.421 -6.151 1.632 1.00 . A A . 14 ASP CG 1 1 10 2930 1 1 14 ASP H H -13.366 -2.842 -0.656 1.00 . A A . 14 ASP H 1 1 10 2931 1 1 14 ASP HA H -14.855 -3.381 1.830 1.00 . A A . 14 ASP HA 1 1 10 2932 1 1 14 ASP HB2 H -15.421 -5.019 0.143 1.00 . A A . 14 ASP HB2 1 1 10 2933 1 1 14 ASP HB3 H -13.718 -5.322 -0.191 1.00 . A A . 14 ASP HB3 1 1 10 2934 1 1 14 ASP N N -13.997 -2.700 0.081 1.00 . A A . 14 ASP N 1 1 10 2935 1 1 14 ASP O O -12.643 -3.259 3.028 1.00 . A A . 14 ASP O 1 1 10 2936 1 1 14 ASP OD1 O -14.758 -5.852 2.797 1.00 . A A . 14 ASP OD1 1 1 10 2937 1 1 14 ASP OD2 O -14.075 -7.302 1.293 1.00 . A A . 14 ASP OD2 1 1 10 2938 1 1 15 PHE C C -9.393 -3.802 1.154 1.00 . A A . 15 PHE C 1 1 10 2939 1 1 15 PHE CA C -10.459 -4.567 1.934 1.00 . A A . 15 PHE CA 1 1 10 2940 1 1 15 PHE CB C -10.079 -6.046 2.023 1.00 . A A . 15 PHE CB 1 1 10 2941 1 1 15 PHE CD1 C -10.730 -6.297 4.433 1.00 . A A . 15 PHE CD1 1 1 10 2942 1 1 15 PHE CD2 C -11.472 -7.948 2.882 1.00 . A A . 15 PHE CD2 1 1 10 2943 1 1 15 PHE CE1 C -11.369 -6.967 5.459 1.00 . A A . 15 PHE CE1 1 1 10 2944 1 1 15 PHE CE2 C -12.114 -8.623 3.903 1.00 . A A . 15 PHE CE2 1 1 10 2945 1 1 15 PHE CG C -10.774 -6.778 3.135 1.00 . A A . 15 PHE CG 1 1 10 2946 1 1 15 PHE CZ C -12.061 -8.133 5.193 1.00 . A A . 15 PHE CZ 1 1 10 2947 1 1 15 PHE H H -11.921 -4.804 0.421 1.00 . A A . 15 PHE H 1 1 10 2948 1 1 15 PHE HA H -10.520 -4.159 2.931 1.00 . A A . 15 PHE HA 1 1 10 2949 1 1 15 PHE HB2 H -10.336 -6.533 1.094 1.00 . A A . 15 PHE HB2 1 1 10 2950 1 1 15 PHE HB3 H -9.015 -6.128 2.185 1.00 . A A . 15 PHE HB3 1 1 10 2951 1 1 15 PHE HD1 H -10.188 -5.385 4.642 1.00 . A A . 15 PHE HD1 1 1 10 2952 1 1 15 PHE HD2 H -11.513 -8.333 1.873 1.00 . A A . 15 PHE HD2 1 1 10 2953 1 1 15 PHE HE1 H -11.326 -6.581 6.466 1.00 . A A . 15 PHE HE1 1 1 10 2954 1 1 15 PHE HE2 H -12.654 -9.534 3.693 1.00 . A A . 15 PHE HE2 1 1 10 2955 1 1 15 PHE HZ H -12.562 -8.658 5.993 1.00 . A A . 15 PHE HZ 1 1 10 2956 1 1 15 PHE N N -11.768 -4.417 1.309 1.00 . A A . 15 PHE N 1 1 10 2957 1 1 15 PHE O O -9.571 -3.458 -0.015 1.00 . A A . 15 PHE O 1 1 10 2958 1 1 16 PRO C C -6.425 -3.496 0.185 1.00 . A A . 16 PRO C 1 1 10 2959 1 1 16 PRO CA C -7.252 -2.611 1.084 1.00 . A A . 16 PRO CA 1 1 10 2960 1 1 16 PRO CB C -6.447 -2.031 2.274 1.00 . A A . 16 PRO CB 1 1 10 2961 1 1 16 PRO CD C -8.042 -3.588 3.225 1.00 . A A . 16 PRO CD 1 1 10 2962 1 1 16 PRO CG C -6.583 -3.113 3.364 1.00 . A A . 16 PRO CG 1 1 10 2963 1 1 16 PRO HA H -7.698 -1.796 0.487 1.00 . A A . 16 PRO HA 1 1 10 2964 1 1 16 PRO HB2 H -5.400 -1.789 2.035 1.00 . A A . 16 PRO HB2 1 1 10 2965 1 1 16 PRO HB3 H -6.946 -1.121 2.642 1.00 . A A . 16 PRO HB3 1 1 10 2966 1 1 16 PRO HD2 H -8.121 -4.614 3.609 1.00 . A A . 16 PRO HD2 1 1 10 2967 1 1 16 PRO HD3 H -8.704 -2.915 3.794 1.00 . A A . 16 PRO HD3 1 1 10 2968 1 1 16 PRO HG2 H -5.893 -3.944 3.139 1.00 . A A . 16 PRO HG2 1 1 10 2969 1 1 16 PRO HG3 H -6.399 -2.740 4.384 1.00 . A A . 16 PRO HG3 1 1 10 2970 1 1 16 PRO N N -8.257 -3.397 1.794 1.00 . A A . 16 PRO N 1 1 10 2971 1 1 16 PRO O O -6.662 -4.693 0.164 1.00 . A A . 16 PRO O 1 1 10 2972 1 1 17 ILE C C -3.328 -3.956 -1.156 1.00 . A A . 17 ILE C 1 1 10 2973 1 1 17 ILE CA C -4.743 -3.646 -1.604 1.00 . A A . 17 ILE CA 1 1 10 2974 1 1 17 ILE CB C -4.754 -2.844 -2.943 1.00 . A A . 17 ILE CB 1 1 10 2975 1 1 17 ILE CD1 C -6.329 -1.602 -4.609 1.00 . A A . 17 ILE CD1 1 1 10 2976 1 1 17 ILE CG1 C -6.222 -2.548 -3.382 1.00 . A A . 17 ILE CG1 1 1 10 2977 1 1 17 ILE CG2 C -3.956 -3.603 -4.046 1.00 . A A . 17 ILE CG2 1 1 10 2978 1 1 17 ILE H H -5.282 -1.922 -0.474 1.00 . A A . 17 ILE H 1 1 10 2979 1 1 17 ILE HA H -5.253 -4.597 -1.830 1.00 . A A . 17 ILE HA 1 1 10 2980 1 1 17 ILE HB H -4.259 -1.875 -2.772 1.00 . A A . 17 ILE HB 1 1 10 2981 1 1 17 ILE HD11 H -5.752 -0.681 -4.432 1.00 . A A . 17 ILE HD11 1 1 10 2982 1 1 17 ILE HD12 H -5.961 -2.085 -5.526 1.00 . A A . 17 ILE HD12 1 1 10 2983 1 1 17 ILE HD13 H -7.382 -1.325 -4.776 1.00 . A A . 17 ILE HD13 1 1 10 2984 1 1 17 ILE HG12 H -6.742 -3.493 -3.606 1.00 . A A . 17 ILE HG12 1 1 10 2985 1 1 17 ILE HG13 H -6.761 -2.055 -2.556 1.00 . A A . 17 ILE HG13 1 1 10 2986 1 1 17 ILE HG21 H -3.869 -3.003 -4.963 1.00 . A A . 17 ILE HG21 1 1 10 2987 1 1 17 ILE HG22 H -2.931 -3.822 -3.710 1.00 . A A . 17 ILE HG22 1 1 10 2988 1 1 17 ILE HG23 H -4.450 -4.555 -4.295 1.00 . A A . 17 ILE HG23 1 1 10 2989 1 1 17 ILE N N -5.471 -2.902 -0.573 1.00 . A A . 17 ILE N 1 1 10 2990 1 1 17 ILE O O -2.983 -5.125 -1.082 1.00 . A A . 17 ILE O 1 1 10 2991 1 1 18 SER C C -0.800 -3.138 0.867 1.00 . A A . 18 SER C 1 1 10 2992 1 1 18 SER CA C -1.065 -3.159 -0.618 1.00 . A A . 18 SER CA 1 1 10 2993 1 1 18 SER CB C -0.224 -2.068 -1.336 1.00 . A A . 18 SER CB 1 1 10 2994 1 1 18 SER H H -2.824 -1.989 -0.865 1.00 . A A . 18 SER H 1 1 10 2995 1 1 18 SER HA H -0.740 -4.137 -1.014 1.00 . A A . 18 SER HA 1 1 10 2996 1 1 18 SER HB2 H 0.823 -2.402 -1.398 1.00 . A A . 18 SER HB2 1 1 10 2997 1 1 18 SER HB3 H -0.590 -1.923 -2.366 1.00 . A A . 18 SER HB3 1 1 10 2998 1 1 18 SER HG H -1.096 -0.456 -0.491 1.00 . A A . 18 SER HG 1 1 10 2999 1 1 18 SER N N -2.489 -2.929 -0.883 1.00 . A A . 18 SER N 1 1 10 3000 1 1 18 SER O O -1.740 -2.910 1.613 1.00 . A A . 18 SER O 1 1 10 3001 1 1 18 SER OG O -0.229 -0.826 -0.611 1.00 . A A . 18 SER OG 1 1 10 3002 1 1 19 PHE C C 2.046 -2.699 3.056 1.00 . A A . 19 PHE C 1 1 10 3003 1 1 19 PHE CA C 0.766 -3.433 2.732 1.00 . A A . 19 PHE CA 1 1 10 3004 1 1 19 PHE CB C 0.706 -4.914 3.181 1.00 . A A . 19 PHE CB 1 1 10 3005 1 1 19 PHE CD1 C -1.796 -5.367 3.339 1.00 . A A . 19 PHE CD1 1 1 10 3006 1 1 19 PHE CD2 C -0.581 -6.280 1.458 1.00 . A A . 19 PHE CD2 1 1 10 3007 1 1 19 PHE CE1 C -2.988 -5.873 2.812 1.00 . A A . 19 PHE CE1 1 1 10 3008 1 1 19 PHE CE2 C -1.769 -6.809 0.944 1.00 . A A . 19 PHE CE2 1 1 10 3009 1 1 19 PHE CG C -0.590 -5.541 2.648 1.00 . A A . 19 PHE CG 1 1 10 3010 1 1 19 PHE CZ C -2.978 -6.589 1.612 1.00 . A A . 19 PHE CZ 1 1 10 3011 1 1 19 PHE H H 1.212 -3.581 0.669 1.00 . A A . 19 PHE H 1 1 10 3012 1 1 19 PHE HA H 0.019 -2.869 3.294 1.00 . A A . 19 PHE HA 1 1 10 3013 1 1 19 PHE HB2 H 1.565 -5.448 2.757 1.00 . A A . 19 PHE HB2 1 1 10 3014 1 1 19 PHE HB3 H 0.736 -5.016 4.277 1.00 . A A . 19 PHE HB3 1 1 10 3015 1 1 19 PHE HD1 H -1.810 -4.835 4.285 1.00 . A A . 19 PHE HD1 1 1 10 3016 1 1 19 PHE HD2 H 0.348 -6.445 0.921 1.00 . A A . 19 PHE HD2 1 1 10 3017 1 1 19 PHE HE1 H -3.925 -5.710 3.336 1.00 . A A . 19 PHE HE1 1 1 10 3018 1 1 19 PHE HE2 H -1.752 -7.389 0.026 1.00 . A A . 19 PHE HE2 1 1 10 3019 1 1 19 PHE HZ H -3.905 -6.975 1.197 1.00 . A A . 19 PHE HZ 1 1 10 3020 1 1 19 PHE N N 0.464 -3.375 1.303 1.00 . A A . 19 PHE N 1 1 10 3021 1 1 19 PHE O O 2.652 -2.150 2.152 1.00 . A A . 19 PHE O 1 1 10 3022 1 1 20 TYR C C 4.858 -2.182 4.177 1.00 . A A . 20 TYR C 1 1 10 3023 1 1 20 TYR CA C 3.530 -1.719 4.731 1.00 . A A . 20 TYR CA 1 1 10 3024 1 1 20 TYR CB C 3.592 -1.527 6.278 1.00 . A A . 20 TYR CB 1 1 10 3025 1 1 20 TYR CD1 C 3.072 0.939 6.506 1.00 . A A . 20 TYR CD1 1 1 10 3026 1 1 20 TYR CD2 C 5.268 0.195 7.177 1.00 . A A . 20 TYR CD2 1 1 10 3027 1 1 20 TYR CE1 C 3.420 2.259 6.804 1.00 . A A . 20 TYR CE1 1 1 10 3028 1 1 20 TYR CE2 C 5.615 1.514 7.481 1.00 . A A . 20 TYR CE2 1 1 10 3029 1 1 20 TYR CG C 3.999 -0.097 6.665 1.00 . A A . 20 TYR CG 1 1 10 3030 1 1 20 TYR CZ C 4.699 2.553 7.292 1.00 . A A . 20 TYR CZ 1 1 10 3031 1 1 20 TYR H H 1.970 -3.148 5.056 1.00 . A A . 20 TYR H 1 1 10 3032 1 1 20 TYR HA H 3.309 -0.744 4.270 1.00 . A A . 20 TYR HA 1 1 10 3033 1 1 20 TYR HB2 H 2.595 -1.661 6.722 1.00 . A A . 20 TYR HB2 1 1 10 3034 1 1 20 TYR HB3 H 4.253 -2.284 6.730 1.00 . A A . 20 TYR HB3 1 1 10 3035 1 1 20 TYR HD1 H 2.070 0.719 6.151 1.00 . A A . 20 TYR HD1 1 1 10 3036 1 1 20 TYR HD2 H 5.988 -0.600 7.340 1.00 . A A . 20 TYR HD2 1 1 10 3037 1 1 20 TYR HE1 H 2.689 3.046 6.652 1.00 . A A . 20 TYR HE1 1 1 10 3038 1 1 20 TYR HE2 H 6.604 1.739 7.867 1.00 . A A . 20 TYR HE2 1 1 10 3039 1 1 20 TYR HH H 4.400 4.514 7.445 1.00 . A A . 20 TYR HH 1 1 10 3040 1 1 20 TYR N N 2.450 -2.632 4.346 1.00 . A A . 20 TYR N 1 1 10 3041 1 1 20 TYR O O 4.930 -3.291 3.671 1.00 . A A . 20 TYR O 1 1 10 3042 1 1 20 TYR OH O 5.078 3.865 7.595 1.00 . A A . 20 TYR OH 1 1 10 3043 1 1 21 GLY C C 8.337 -1.020 4.480 1.00 . A A . 21 GLY C 1 1 10 3044 1 1 21 GLY CA C 7.235 -1.775 3.785 1.00 . A A . 21 GLY CA 1 1 10 3045 1 1 21 GLY H H 5.828 -0.418 4.616 1.00 . A A . 21 GLY H 1 1 10 3046 1 1 21 GLY HA2 H 7.403 -2.847 3.977 1.00 . A A . 21 GLY HA2 1 1 10 3047 1 1 21 GLY HA3 H 7.306 -1.592 2.702 1.00 . A A . 21 GLY HA3 1 1 10 3048 1 1 21 GLY N N 5.922 -1.350 4.262 1.00 . A A . 21 GLY N 1 1 10 3049 1 1 21 GLY O O 9.505 -1.106 4.013 1.00 . A A . 21 GLY O 1 1 10 3050 1 1 21 GLY OXT O 8.046 -0.341 5.502 1.00 . A A . 21 GLY OXT 1 1 11 3051 1 1 1 GLY C C 3.662 -1.303 -0.721 1.00 . A A . 1 GLY C 1 1 11 3052 1 1 1 GLY CA C 2.887 -0.012 -0.609 1.00 . A A . 1 GLY CA 1 1 11 3053 1 1 1 GLY H1 H 1.250 -0.615 0.605 1.00 . A A . 1 GLY H1 1 1 11 3054 1 1 1 GLY HA2 H 2.242 0.107 -1.493 1.00 . A A . 1 GLY HA2 1 1 11 3055 1 1 1 GLY HA3 H 3.610 0.818 -0.627 1.00 . A A . 1 GLY HA3 1 1 11 3056 1 1 1 GLY N N 2.051 -0.012 0.591 1.00 . A A . 1 GLY N 1 1 11 3057 1 1 1 GLY O O 3.568 -1.967 -1.742 1.00 . A A . 1 GLY O 1 1 11 3058 1 1 2 GLY C C 4.339 -4.125 0.371 1.00 . A A . 2 GLY C 1 1 11 3059 1 1 2 GLY CA C 5.224 -2.906 0.257 1.00 . A A . 2 GLY CA 1 1 11 3060 1 1 2 GLY H H 4.490 -1.115 1.154 1.00 . A A . 2 GLY H 1 1 11 3061 1 1 2 GLY HA2 H 5.778 -2.956 -0.693 1.00 . A A . 2 GLY HA2 1 1 11 3062 1 1 2 GLY HA3 H 5.960 -2.918 1.075 1.00 . A A . 2 GLY HA3 1 1 11 3063 1 1 2 GLY N N 4.445 -1.670 0.320 1.00 . A A . 2 GLY N 1 1 11 3064 1 1 2 GLY O O 3.145 -4.008 0.148 1.00 . A A . 2 GLY O 1 1 11 3065 1 1 3 ALA C C 4.194 -6.968 2.318 1.00 . A A . 3 ALA C 1 1 11 3066 1 1 3 ALA CA C 4.127 -6.523 0.875 1.00 . A A . 3 ALA CA 1 1 11 3067 1 1 3 ALA CB C 4.664 -7.607 -0.095 1.00 . A A . 3 ALA CB 1 1 11 3068 1 1 3 ALA H H 5.907 -5.366 0.874 1.00 . A A . 3 ALA H 1 1 11 3069 1 1 3 ALA HA H 3.062 -6.367 0.642 1.00 . A A . 3 ALA HA 1 1 11 3070 1 1 3 ALA HB1 H 4.621 -7.232 -1.130 1.00 . A A . 3 ALA HB1 1 1 11 3071 1 1 3 ALA HB2 H 5.710 -7.849 0.148 1.00 . A A . 3 ALA HB2 1 1 11 3072 1 1 3 ALA HB3 H 4.063 -8.527 -0.028 1.00 . A A . 3 ALA HB3 1 1 11 3073 1 1 3 ALA N N 4.920 -5.303 0.709 1.00 . A A . 3 ALA N 1 1 11 3074 1 1 3 ALA O O 4.330 -8.153 2.578 1.00 . A A . 3 ALA O 1 1 11 3075 1 1 4 GLY C C 2.829 -6.877 5.208 1.00 . A A . 4 GLY C 1 1 11 3076 1 1 4 GLY CA C 4.160 -6.369 4.690 1.00 . A A . 4 GLY CA 1 1 11 3077 1 1 4 GLY H H 3.978 -5.049 3.038 1.00 . A A . 4 GLY H 1 1 11 3078 1 1 4 GLY HA2 H 4.909 -7.159 4.858 1.00 . A A . 4 GLY HA2 1 1 11 3079 1 1 4 GLY HA3 H 4.501 -5.487 5.255 1.00 . A A . 4 GLY HA3 1 1 11 3080 1 1 4 GLY N N 4.099 -6.016 3.275 1.00 . A A . 4 GLY N 1 1 11 3081 1 1 4 GLY O O 2.160 -7.596 4.481 1.00 . A A . 4 GLY O 1 1 11 3082 1 1 5 HIS C C 0.267 -6.098 7.475 1.00 . A A . 5 HIS C 1 1 11 3083 1 1 5 HIS CA C 1.338 -7.141 7.169 1.00 . A A . 5 HIS CA 1 1 11 3084 1 1 5 HIS CB C 1.805 -7.804 8.465 1.00 . A A . 5 HIS CB 1 1 11 3085 1 1 5 HIS CD2 C 2.035 -10.370 8.162 1.00 . A A . 5 HIS CD2 1 1 11 3086 1 1 5 HIS CE1 C 4.213 -10.471 7.926 1.00 . A A . 5 HIS CE1 1 1 11 3087 1 1 5 HIS CG C 2.513 -9.106 8.250 1.00 . A A . 5 HIS CG 1 1 11 3088 1 1 5 HIS H H 3.082 -5.957 6.971 1.00 . A A . 5 HIS H 1 1 11 3089 1 1 5 HIS HA H 0.914 -7.894 6.522 1.00 . A A . 5 HIS HA 1 1 11 3090 1 1 5 HIS HB2 H 2.484 -7.139 8.978 1.00 . A A . 5 HIS HB2 1 1 11 3091 1 1 5 HIS HB3 H 0.948 -7.992 9.096 1.00 . A A . 5 HIS HB3 1 1 11 3092 1 1 5 HIS HD1 H 4.513 -8.456 8.115 1.00 . A A . 5 HIS HD1 1 1 11 3093 1 1 5 HIS HD2 H 1.000 -10.671 8.235 1.00 . A A . 5 HIS HD2 1 1 11 3094 1 1 5 HIS HE1 H 5.214 -10.848 7.782 1.00 . A A . 5 HIS HE1 1 1 11 3095 1 1 5 HIS N N 2.468 -6.536 6.473 1.00 . A A . 5 HIS N 1 1 11 3096 1 1 5 HIS ND1 N 3.880 -9.204 8.099 1.00 . A A . 5 HIS ND1 1 1 11 3097 1 1 5 HIS NE2 N 3.111 -11.199 7.960 1.00 . A A . 5 HIS NE2 1 1 11 3098 1 1 5 HIS O O -0.893 -6.435 7.712 1.00 . A A . 5 HIS O 1 1 11 3099 1 1 6 VAL C C -0.708 -2.943 6.746 1.00 . A A . 6 VAL C 1 1 11 3100 1 1 6 VAL CA C -0.357 -3.756 7.973 1.00 . A A . 6 VAL CA 1 1 11 3101 1 1 6 VAL CB C 0.316 -2.868 9.064 1.00 . A A . 6 VAL CB 1 1 11 3102 1 1 6 VAL CG1 C -0.623 -1.744 9.582 1.00 . A A . 6 VAL CG1 1 1 11 3103 1 1 6 VAL CG2 C 0.801 -3.743 10.254 1.00 . A A . 6 VAL CG2 1 1 11 3104 1 1 6 VAL H H 1.507 -4.436 7.307 1.00 . A A . 6 VAL H 1 1 11 3105 1 1 6 VAL HA H -1.244 -4.210 8.435 1.00 . A A . 6 VAL HA 1 1 11 3106 1 1 6 VAL HB H 1.200 -2.379 8.621 1.00 . A A . 6 VAL HB 1 1 11 3107 1 1 6 VAL HG11 H -0.082 -1.090 10.284 1.00 . A A . 6 VAL HG11 1 1 11 3108 1 1 6 VAL HG12 H -0.986 -1.124 8.749 1.00 . A A . 6 VAL HG12 1 1 11 3109 1 1 6 VAL HG13 H -1.485 -2.175 10.114 1.00 . A A . 6 VAL HG13 1 1 11 3110 1 1 6 VAL HG21 H -0.051 -4.265 10.717 1.00 . A A . 6 VAL HG21 1 1 11 3111 1 1 6 VAL HG22 H 1.529 -4.497 9.917 1.00 . A A . 6 VAL HG22 1 1 11 3112 1 1 6 VAL HG23 H 1.287 -3.118 11.019 1.00 . A A . 6 VAL HG23 1 1 11 3113 1 1 6 VAL N N 0.600 -4.780 7.538 1.00 . A A . 6 VAL N 1 1 11 3114 1 1 6 VAL O O 0.227 -2.641 6.022 1.00 . A A . 6 VAL O 1 1 11 3115 1 1 7 PRO C C -1.662 -0.464 5.190 1.00 . A A . 7 PRO C 1 1 11 3116 1 1 7 PRO CA C -2.221 -1.866 5.179 1.00 . A A . 7 PRO CA 1 1 11 3117 1 1 7 PRO CB C -3.762 -1.904 5.123 1.00 . A A . 7 PRO CB 1 1 11 3118 1 1 7 PRO CD C -3.133 -2.882 7.252 1.00 . A A . 7 PRO CD 1 1 11 3119 1 1 7 PRO CG C -4.167 -1.928 6.611 1.00 . A A . 7 PRO CG 1 1 11 3120 1 1 7 PRO HA H -1.836 -2.443 4.332 1.00 . A A . 7 PRO HA 1 1 11 3121 1 1 7 PRO HB2 H -4.204 -1.070 4.553 1.00 . A A . 7 PRO HB2 1 1 11 3122 1 1 7 PRO HB3 H -4.062 -2.861 4.665 1.00 . A A . 7 PRO HB3 1 1 11 3123 1 1 7 PRO HD2 H -3.028 -2.662 8.323 1.00 . A A . 7 PRO HD2 1 1 11 3124 1 1 7 PRO HD3 H -3.420 -3.935 7.103 1.00 . A A . 7 PRO HD3 1 1 11 3125 1 1 7 PRO HG2 H -4.032 -0.915 7.023 1.00 . A A . 7 PRO HG2 1 1 11 3126 1 1 7 PRO HG3 H -5.206 -2.252 6.776 1.00 . A A . 7 PRO HG3 1 1 11 3127 1 1 7 PRO N N -1.974 -2.565 6.430 1.00 . A A . 7 PRO N 1 1 11 3128 1 1 7 PRO O O -1.572 0.128 6.254 1.00 . A A . 7 PRO O 1 1 11 3129 1 1 8 GLU C C -1.888 2.422 3.844 1.00 . A A . 8 GLU C 1 1 11 3130 1 1 8 GLU CA C -0.750 1.429 3.922 1.00 . A A . 8 GLU CA 1 1 11 3131 1 1 8 GLU CB C 0.183 1.575 2.685 1.00 . A A . 8 GLU CB 1 1 11 3132 1 1 8 GLU CD C 2.363 0.761 1.660 1.00 . A A . 8 GLU CD 1 1 11 3133 1 1 8 GLU CG C 1.464 0.720 2.872 1.00 . A A . 8 GLU CG 1 1 11 3134 1 1 8 GLU H H -1.388 -0.453 3.155 1.00 . A A . 8 GLU H 1 1 11 3135 1 1 8 GLU HA H -0.153 1.657 4.822 1.00 . A A . 8 GLU HA 1 1 11 3136 1 1 8 GLU HB2 H -0.347 1.263 1.771 1.00 . A A . 8 GLU HB2 1 1 11 3137 1 1 8 GLU HB3 H 0.477 2.631 2.565 1.00 . A A . 8 GLU HB3 1 1 11 3138 1 1 8 GLU HG2 H 2.026 1.101 3.738 1.00 . A A . 8 GLU HG2 1 1 11 3139 1 1 8 GLU HG3 H 1.182 -0.321 3.085 1.00 . A A . 8 GLU HG3 1 1 11 3140 1 1 8 GLU N N -1.280 0.068 4.004 1.00 . A A . 8 GLU N 1 1 11 3141 1 1 8 GLU O O -1.785 3.475 4.454 1.00 . A A . 8 GLU O 1 1 11 3142 1 1 8 GLU OE1 O 3.341 1.491 1.692 1.00 . A A . 8 GLU OE1 1 1 11 3143 1 1 9 TYR C C -5.386 2.278 2.875 1.00 . A A . 9 TYR C 1 1 11 3144 1 1 9 TYR CA C -4.089 3.046 2.961 1.00 . A A . 9 TYR CA 1 1 11 3145 1 1 9 TYR CB C -3.844 3.903 1.691 1.00 . A A . 9 TYR CB 1 1 11 3146 1 1 9 TYR CD1 C -4.447 2.260 -0.165 1.00 . A A . 9 TYR CD1 1 1 11 3147 1 1 9 TYR CD2 C -2.133 2.888 0.106 1.00 . A A . 9 TYR CD2 1 1 11 3148 1 1 9 TYR CE1 C -4.094 1.403 -1.212 1.00 . A A . 9 TYR CE1 1 1 11 3149 1 1 9 TYR CE2 C -1.783 2.056 -0.960 1.00 . A A . 9 TYR CE2 1 1 11 3150 1 1 9 TYR CG C -3.467 2.995 0.512 1.00 . A A . 9 TYR CG 1 1 11 3151 1 1 9 TYR CZ C -2.758 1.306 -1.622 1.00 . A A . 9 TYR CZ 1 1 11 3152 1 1 9 TYR H H -3.028 1.248 2.591 1.00 . A A . 9 TYR H 1 1 11 3153 1 1 9 TYR HA H -4.178 3.700 3.844 1.00 . A A . 9 TYR HA 1 1 11 3154 1 1 9 TYR HB2 H -4.729 4.500 1.425 1.00 . A A . 9 TYR HB2 1 1 11 3155 1 1 9 TYR HB3 H -3.025 4.609 1.901 1.00 . A A . 9 TYR HB3 1 1 11 3156 1 1 9 TYR HD1 H -5.490 2.349 0.121 1.00 . A A . 9 TYR HD1 1 1 11 3157 1 1 9 TYR HD2 H -1.357 3.451 0.615 1.00 . A A . 9 TYR HD2 1 1 11 3158 1 1 9 TYR HE1 H -4.864 0.816 -1.704 1.00 . A A . 9 TYR HE1 1 1 11 3159 1 1 9 TYR HE2 H -0.747 1.997 -1.275 1.00 . A A . 9 TYR HE2 1 1 11 3160 1 1 9 TYR HH H -3.103 0.212 -3.240 1.00 . A A . 9 TYR HH 1 1 11 3161 1 1 9 TYR N N -2.974 2.109 3.101 1.00 . A A . 9 TYR N 1 1 11 3162 1 1 9 TYR O O -5.326 1.060 2.825 1.00 . A A . 9 TYR O 1 1 11 3163 1 1 9 TYR OH O -2.381 0.475 -2.681 1.00 . A A . 9 TYR OH 1 1 11 3164 1 1 10 PHE C C -8.716 2.935 1.757 1.00 . A A . 10 PHE C 1 1 11 3165 1 1 10 PHE CA C -7.840 2.289 2.810 1.00 . A A . 10 PHE CA 1 1 11 3166 1 1 10 PHE CB C -8.556 2.419 4.176 1.00 . A A . 10 PHE CB 1 1 11 3167 1 1 10 PHE CD1 C -6.708 2.566 5.918 1.00 . A A . 10 PHE CD1 1 1 11 3168 1 1 10 PHE CD2 C -7.906 0.480 5.691 1.00 . A A . 10 PHE CD2 1 1 11 3169 1 1 10 PHE CE1 C -5.989 2.037 6.994 1.00 . A A . 10 PHE CE1 1 1 11 3170 1 1 10 PHE CE2 C -7.213 -0.039 6.788 1.00 . A A . 10 PHE CE2 1 1 11 3171 1 1 10 PHE CG C -7.698 1.804 5.288 1.00 . A A . 10 PHE CG 1 1 11 3172 1 1 10 PHE CZ C -6.268 0.748 7.453 1.00 . A A . 10 PHE CZ 1 1 11 3173 1 1 10 PHE H H -6.564 3.973 2.926 1.00 . A A . 10 PHE H 1 1 11 3174 1 1 10 PHE HA H -7.714 1.216 2.598 1.00 . A A . 10 PHE HA 1 1 11 3175 1 1 10 PHE HB2 H -8.734 3.482 4.406 1.00 . A A . 10 PHE HB2 1 1 11 3176 1 1 10 PHE HB3 H -9.538 1.920 4.132 1.00 . A A . 10 PHE HB3 1 1 11 3177 1 1 10 PHE HD1 H -6.494 3.574 5.578 1.00 . A A . 10 PHE HD1 1 1 11 3178 1 1 10 PHE HD2 H -8.610 -0.150 5.156 1.00 . A A . 10 PHE HD2 1 1 11 3179 1 1 10 PHE HE1 H -5.217 2.630 7.475 1.00 . A A . 10 PHE HE1 1 1 11 3180 1 1 10 PHE HE2 H -7.413 -1.051 7.124 1.00 . A A . 10 PHE HE2 1 1 11 3181 1 1 10 PHE HZ H -5.754 0.358 8.326 1.00 . A A . 10 PHE HZ 1 1 11 3182 1 1 10 PHE N N -6.550 2.973 2.864 1.00 . A A . 10 PHE N 1 1 11 3183 1 1 10 PHE O O -8.745 4.155 1.728 1.00 . A A . 10 PHE O 1 1 11 3184 1 1 11 VAL C C -11.802 2.550 0.414 1.00 . A A . 11 VAL C 1 1 11 3185 1 1 11 VAL CA C -10.360 2.702 -0.058 1.00 . A A . 11 VAL CA 1 1 11 3186 1 1 11 VAL CB C -10.208 2.027 -1.434 1.00 . A A . 11 VAL CB 1 1 11 3187 1 1 11 VAL CG1 C -11.053 2.743 -2.477 1.00 . A A . 11 VAL CG1 1 1 11 3188 1 1 11 VAL CG2 C -8.746 1.992 -1.852 1.00 . A A . 11 VAL CG2 1 1 11 3189 1 1 11 VAL H H -9.331 1.172 0.980 1.00 . A A . 11 VAL H 1 1 11 3190 1 1 11 VAL HA H -10.137 3.753 -0.170 1.00 . A A . 11 VAL HA 1 1 11 3191 1 1 11 VAL HB H -10.562 1.009 -1.354 1.00 . A A . 11 VAL HB 1 1 11 3192 1 1 11 VAL HG11 H -10.662 2.533 -3.462 1.00 . A A . 11 VAL HG11 1 1 11 3193 1 1 11 VAL HG12 H -12.074 2.399 -2.412 1.00 . A A . 11 VAL HG12 1 1 11 3194 1 1 11 VAL HG13 H -11.019 3.808 -2.297 1.00 . A A . 11 VAL HG13 1 1 11 3195 1 1 11 VAL HG21 H -8.674 1.668 -2.880 1.00 . A A . 11 VAL HG21 1 1 11 3196 1 1 11 VAL HG22 H -8.320 2.981 -1.756 1.00 . A A . 11 VAL HG22 1 1 11 3197 1 1 11 VAL HG23 H -8.206 1.305 -1.218 1.00 . A A . 11 VAL HG23 1 1 11 3198 1 1 11 VAL N N -9.427 2.145 0.913 1.00 . A A . 11 VAL N 1 1 11 3199 1 1 11 VAL O O -12.086 1.785 1.336 1.00 . A A . 11 VAL O 1 1 11 3200 1 1 12 ARG C C -14.771 1.962 -0.412 1.00 . A A . 12 ARG C 1 1 11 3201 1 1 12 ARG CA C -14.121 3.231 0.132 1.00 . A A . 12 ARG CA 1 1 11 3202 1 1 12 ARG CB C -14.851 4.463 -0.408 1.00 . A A . 12 ARG CB 1 1 11 3203 1 1 12 ARG CD C -15.144 6.958 -0.346 1.00 . A A . 12 ARG CD 1 1 11 3204 1 1 12 ARG CG C -14.455 5.757 0.284 1.00 . A A . 12 ARG CG 1 1 11 3205 1 1 12 ARG CZ C -17.405 7.916 -0.454 1.00 . A A . 12 ARG CZ 1 1 11 3206 1 1 12 ARG H H -12.420 3.875 -0.950 1.00 . A A . 12 ARG H 1 1 11 3207 1 1 12 ARG HA H -14.192 3.225 1.209 1.00 . A A . 12 ARG HA 1 1 11 3208 1 1 12 ARG HB2 H -14.634 4.563 -1.461 1.00 . A A . 12 ARG HB2 1 1 11 3209 1 1 12 ARG HB3 H -15.913 4.321 -0.279 1.00 . A A . 12 ARG HB3 1 1 11 3210 1 1 12 ARG HD2 H -14.784 7.855 0.136 1.00 . A A . 12 ARG HD2 1 1 11 3211 1 1 12 ARG HD3 H -14.895 6.989 -1.396 1.00 . A A . 12 ARG HD3 1 1 11 3212 1 1 12 ARG HE H -16.985 6.045 0.094 1.00 . A A . 12 ARG HE 1 1 11 3213 1 1 12 ARG HG2 H -14.737 5.699 1.325 1.00 . A A . 12 ARG HG2 1 1 11 3214 1 1 12 ARG HG3 H -13.386 5.884 0.205 1.00 . A A . 12 ARG HG3 1 1 11 3215 1 1 12 ARG HH11 H -15.919 9.182 -0.975 1.00 . A A . 12 ARG HH11 1 1 11 3216 1 1 12 ARG HH12 H -17.519 9.845 -1.048 1.00 . A A . 12 ARG HH12 1 1 11 3217 1 1 12 ARG HH21 H -19.095 6.906 0.003 1.00 . A A . 12 ARG HH21 1 1 11 3218 1 1 12 ARG HH22 H -19.324 8.550 -0.490 1.00 . A A . 12 ARG HH22 1 1 11 3219 1 1 12 ARG N N -12.708 3.284 -0.224 1.00 . A A . 12 ARG N 1 1 11 3220 1 1 12 ARG NE N -16.596 6.893 -0.203 1.00 . A A . 12 ARG NE 1 1 11 3221 1 1 12 ARG NH1 N -16.907 9.076 -0.858 1.00 . A A . 12 ARG NH1 1 1 11 3222 1 1 12 ARG NH2 N -18.716 7.779 -0.301 1.00 . A A . 12 ARG NH2 1 1 11 3223 1 1 12 ARG O O -15.964 1.944 -0.714 1.00 . A A . 12 ARG O 1 1 11 3224 1 1 13 GLY C C -14.712 -1.378 0.057 1.00 . A A . 13 GLY C 1 1 11 3225 1 1 13 GLY CA C -14.494 -0.356 -1.041 1.00 . A A . 13 GLY CA 1 1 11 3226 1 1 13 GLY H H -13.035 0.975 -0.277 1.00 . A A . 13 GLY H 1 1 11 3227 1 1 13 GLY HA2 H -15.434 -0.172 -1.539 1.00 . A A . 13 GLY HA2 1 1 11 3228 1 1 13 GLY HA3 H -13.791 -0.757 -1.757 1.00 . A A . 13 GLY HA3 1 1 11 3229 1 1 13 GLY N N -13.978 0.902 -0.534 1.00 . A A . 13 GLY N 1 1 11 3230 1 1 13 GLY O O -15.551 -1.186 0.936 1.00 . A A . 13 GLY O 1 1 11 3231 1 1 14 ASP C C -12.776 -3.665 1.799 1.00 . A A . 14 ASP C 1 1 11 3232 1 1 14 ASP CA C -14.069 -3.527 1.003 1.00 . A A . 14 ASP CA 1 1 11 3233 1 1 14 ASP CB C -14.413 -4.856 0.330 1.00 . A A . 14 ASP CB 1 1 11 3234 1 1 14 ASP CG C -14.499 -6.001 1.320 1.00 . A A . 14 ASP CG 1 1 11 3235 1 1 14 ASP H H -13.303 -2.565 -0.721 1.00 . A A . 14 ASP H 1 1 11 3236 1 1 14 ASP HA H -14.867 -3.259 1.679 1.00 . A A . 14 ASP HA 1 1 11 3237 1 1 14 ASP HB2 H -15.368 -4.764 -0.168 1.00 . A A . 14 ASP HB2 1 1 11 3238 1 1 14 ASP HB3 H -13.652 -5.091 -0.399 1.00 . A A . 14 ASP HB3 1 1 11 3239 1 1 14 ASP N N -13.955 -2.469 0.005 1.00 . A A . 14 ASP N 1 1 11 3240 1 1 14 ASP O O -12.695 -3.239 2.952 1.00 . A A . 14 ASP O 1 1 11 3241 1 1 14 ASP OD1 O -14.976 -5.772 2.451 1.00 . A A . 14 ASP OD1 1 1 11 3242 1 1 14 ASP OD2 O -14.087 -7.126 0.965 1.00 . A A . 14 ASP OD2 1 1 11 3243 1 1 15 PHE C C -9.367 -3.736 1.070 1.00 . A A . 15 PHE C 1 1 11 3244 1 1 15 PHE CA C -10.475 -4.460 1.829 1.00 . A A . 15 PHE CA 1 1 11 3245 1 1 15 PHE CB C -10.151 -5.952 1.926 1.00 . A A . 15 PHE CB 1 1 11 3246 1 1 15 PHE CD1 C -10.862 -6.170 4.322 1.00 . A A . 15 PHE CD1 1 1 11 3247 1 1 15 PHE CD2 C -11.622 -7.805 2.763 1.00 . A A . 15 PHE CD2 1 1 11 3248 1 1 15 PHE CE1 C -11.543 -6.816 5.336 1.00 . A A . 15 PHE CE1 1 1 11 3249 1 1 15 PHE CE2 C -12.305 -8.456 3.772 1.00 . A A . 15 PHE CE2 1 1 11 3250 1 1 15 PHE CG C -10.893 -6.657 3.025 1.00 . A A . 15 PHE CG 1 1 11 3251 1 1 15 PHE CZ C -12.267 -7.960 5.061 1.00 . A A . 15 PHE CZ 1 1 11 3252 1 1 15 PHE H H -11.890 -4.581 0.258 1.00 . A A . 15 PHE H 1 1 11 3253 1 1 15 PHE HA H -10.542 -4.049 2.824 1.00 . A A . 15 PHE HA 1 1 11 3254 1 1 15 PHE HB2 H -10.409 -6.431 0.993 1.00 . A A . 15 PHE HB2 1 1 11 3255 1 1 15 PHE HB3 H -9.094 -6.072 2.107 1.00 . A A . 15 PHE HB3 1 1 11 3256 1 1 15 PHE HD1 H -10.297 -5.275 4.539 1.00 . A A . 15 PHE HD1 1 1 11 3257 1 1 15 PHE HD2 H -11.653 -8.194 1.754 1.00 . A A . 15 PHE HD2 1 1 11 3258 1 1 15 PHE HE1 H -11.511 -6.426 6.343 1.00 . A A . 15 PHE HE1 1 1 11 3259 1 1 15 PHE HE2 H -12.870 -9.350 3.553 1.00 . A A . 15 PHE HE2 1 1 11 3260 1 1 15 PHE HZ H -12.799 -8.467 5.851 1.00 . A A . 15 PHE HZ 1 1 11 3261 1 1 15 PHE N N -11.765 -4.264 1.177 1.00 . A A . 15 PHE N 1 1 11 3262 1 1 15 PHE O O -9.509 -3.383 -0.101 1.00 . A A . 15 PHE O 1 1 11 3263 1 1 16 PRO C C -6.361 -3.566 0.161 1.00 . A A . 16 PRO C 1 1 11 3264 1 1 16 PRO CA C -7.175 -2.639 1.030 1.00 . A A . 16 PRO CA 1 1 11 3265 1 1 16 PRO CB C -6.376 -2.071 2.230 1.00 . A A . 16 PRO CB 1 1 11 3266 1 1 16 PRO CD C -8.041 -3.565 3.163 1.00 . A A . 16 PRO CD 1 1 11 3267 1 1 16 PRO CG C -6.567 -3.140 3.326 1.00 . A A . 16 PRO CG 1 1 11 3268 1 1 16 PRO HA H -7.578 -1.816 0.416 1.00 . A A . 16 PRO HA 1 1 11 3269 1 1 16 PRO HB2 H -5.317 -1.860 2.011 1.00 . A A . 16 PRO HB2 1 1 11 3270 1 1 16 PRO HB3 H -6.856 -1.141 2.577 1.00 . A A . 16 PRO HB3 1 1 11 3271 1 1 16 PRO HD2 H -8.172 -4.587 3.541 1.00 . A A . 16 PRO HD2 1 1 11 3272 1 1 16 PRO HD3 H -8.687 -2.866 3.718 1.00 . A A . 16 PRO HD3 1 1 11 3273 1 1 16 PRO HG2 H -5.901 -3.994 3.116 1.00 . A A . 16 PRO HG2 1 1 11 3274 1 1 16 PRO HG3 H -6.379 -2.767 4.345 1.00 . A A . 16 PRO HG3 1 1 11 3275 1 1 16 PRO N N -8.226 -3.375 1.727 1.00 . A A . 16 PRO N 1 1 11 3276 1 1 16 PRO O O -6.649 -4.753 0.142 1.00 . A A . 16 PRO O 1 1 11 3277 1 1 17 ILE C C -3.240 -4.144 -1.113 1.00 . A A . 17 ILE C 1 1 11 3278 1 1 17 ILE CA C -4.642 -3.809 -1.580 1.00 . A A . 17 ILE CA 1 1 11 3279 1 1 17 ILE CB C -4.613 -3.035 -2.935 1.00 . A A . 17 ILE CB 1 1 11 3280 1 1 17 ILE CD1 C -6.143 -1.809 -4.655 1.00 . A A . 17 ILE CD1 1 1 11 3281 1 1 17 ILE CG1 C -6.068 -2.729 -3.406 1.00 . A A . 17 ILE CG1 1 1 11 3282 1 1 17 ILE CG2 C -3.807 -3.826 -4.006 1.00 . A A . 17 ILE CG2 1 1 11 3283 1 1 17 ILE H H -5.134 -2.051 -0.484 1.00 . A A . 17 ILE H 1 1 11 3284 1 1 17 ILE HA H -5.169 -4.755 -1.789 1.00 . A A . 17 ILE HA 1 1 11 3285 1 1 17 ILE HB H -4.102 -2.072 -2.776 1.00 . A A . 17 ILE HB 1 1 11 3286 1 1 17 ILE HD11 H -7.189 -1.523 -4.848 1.00 . A A . 17 ILE HD11 1 1 11 3287 1 1 17 ILE HD12 H -5.558 -0.890 -4.490 1.00 . A A . 17 ILE HD12 1 1 11 3288 1 1 17 ILE HD13 H -5.766 -2.317 -5.555 1.00 . A A . 17 ILE HD13 1 1 11 3289 1 1 17 ILE HG12 H -6.599 -3.671 -3.619 1.00 . A A . 17 ILE HG12 1 1 11 3290 1 1 17 ILE HG13 H -6.610 -2.214 -2.596 1.00 . A A . 17 ILE HG13 1 1 11 3291 1 1 17 ILE HG21 H -4.311 -4.776 -4.240 1.00 . A A . 17 ILE HG21 1 1 11 3292 1 1 17 ILE HG22 H -3.700 -3.246 -4.934 1.00 . A A . 17 ILE HG22 1 1 11 3293 1 1 17 ILE HG23 H -2.790 -4.050 -3.650 1.00 . A A . 17 ILE HG23 1 1 11 3294 1 1 17 ILE N N -5.362 -3.023 -0.576 1.00 . A A . 17 ILE N 1 1 11 3295 1 1 17 ILE O O -2.926 -5.321 -1.023 1.00 . A A . 17 ILE O 1 1 11 3296 1 1 18 SER C C -0.687 -3.243 0.906 1.00 . A A . 18 SER C 1 1 11 3297 1 1 18 SER CA C -0.963 -3.396 -0.569 1.00 . A A . 18 SER CA 1 1 11 3298 1 1 18 SER CB C -0.156 -2.388 -1.422 1.00 . A A . 18 SER CB 1 1 11 3299 1 1 18 SER H H -2.675 -2.179 -0.842 1.00 . A A . 18 SER H 1 1 11 3300 1 1 18 SER HA H -0.658 -4.414 -0.864 1.00 . A A . 18 SER HA 1 1 11 3301 1 1 18 SER HB2 H 0.926 -2.520 -1.264 1.00 . A A . 18 SER HB2 1 1 11 3302 1 1 18 SER HB3 H -0.381 -2.574 -2.487 1.00 . A A . 18 SER HB3 1 1 11 3303 1 1 18 SER HG H -0.173 -0.395 -1.603 1.00 . A A . 18 SER HG 1 1 11 3304 1 1 18 SER N N -2.379 -3.136 -0.842 1.00 . A A . 18 SER N 1 1 11 3305 1 1 18 SER O O -1.612 -2.902 1.627 1.00 . A A . 18 SER O 1 1 11 3306 1 1 18 SER OG O -0.576 -1.063 -1.059 1.00 . A A . 18 SER OG 1 1 11 3307 1 1 19 PHE C C 2.146 -2.818 3.115 1.00 . A A . 19 PHE C 1 1 11 3308 1 1 19 PHE CA C 0.846 -3.523 2.800 1.00 . A A . 19 PHE CA 1 1 11 3309 1 1 19 PHE CB C 0.758 -4.992 3.286 1.00 . A A . 19 PHE CB 1 1 11 3310 1 1 19 PHE CD1 C -1.742 -5.475 3.377 1.00 . A A . 19 PHE CD1 1 1 11 3311 1 1 19 PHE CD2 C -0.460 -6.388 1.542 1.00 . A A . 19 PHE CD2 1 1 11 3312 1 1 19 PHE CE1 C -2.912 -6.003 2.820 1.00 . A A . 19 PHE CE1 1 1 11 3313 1 1 19 PHE CE2 C -1.623 -6.944 1.002 1.00 . A A . 19 PHE CE2 1 1 11 3314 1 1 19 PHE CG C -0.515 -5.638 2.723 1.00 . A A . 19 PHE CG 1 1 11 3315 1 1 19 PHE CZ C -2.853 -6.737 1.632 1.00 . A A . 19 PHE CZ 1 1 11 3316 1 1 19 PHE H H 1.303 -3.798 0.755 1.00 . A A . 19 PHE H 1 1 11 3317 1 1 19 PHE HA H 0.102 -2.931 3.338 1.00 . A A . 19 PHE HA 1 1 11 3318 1 1 19 PHE HB2 H 1.627 -5.544 2.906 1.00 . A A . 19 PHE HB2 1 1 11 3319 1 1 19 PHE HB3 H 0.752 -5.068 4.385 1.00 . A A . 19 PHE HB3 1 1 11 3320 1 1 19 PHE HD1 H -1.792 -4.936 4.318 1.00 . A A . 19 PHE HD1 1 1 11 3321 1 1 19 PHE HD2 H 0.486 -6.542 1.032 1.00 . A A . 19 PHE HD2 1 1 11 3322 1 1 19 PHE HE1 H -3.867 -5.844 3.312 1.00 . A A . 19 PHE HE1 1 1 11 3323 1 1 19 PHE HE2 H -1.569 -7.534 0.091 1.00 . A A . 19 PHE HE2 1 1 11 3324 1 1 19 PHE HZ H -3.761 -7.147 1.199 1.00 . A A . 19 PHE HZ 1 1 11 3325 1 1 19 PHE N N 0.562 -3.512 1.366 1.00 . A A . 19 PHE N 1 1 11 3326 1 1 19 PHE O O 2.772 -2.307 2.202 1.00 . A A . 19 PHE O 1 1 11 3327 1 1 20 TYR C C 4.961 -2.395 4.212 1.00 . A A . 20 TYR C 1 1 11 3328 1 1 20 TYR CA C 3.662 -1.869 4.780 1.00 . A A . 20 TYR CA 1 1 11 3329 1 1 20 TYR CB C 3.753 -1.666 6.325 1.00 . A A . 20 TYR CB 1 1 11 3330 1 1 20 TYR CD1 C 3.120 0.778 6.524 1.00 . A A . 20 TYR CD1 1 1 11 3331 1 1 20 TYR CD2 C 5.342 0.139 7.215 1.00 . A A . 20 TYR CD2 1 1 11 3332 1 1 20 TYR CE1 C 3.411 2.117 6.799 1.00 . A A . 20 TYR CE1 1 1 11 3333 1 1 20 TYR CE2 C 5.633 1.477 7.497 1.00 . A A . 20 TYR CE2 1 1 11 3334 1 1 20 TYR CG C 4.091 -0.214 6.698 1.00 . A A . 20 TYR CG 1 1 11 3335 1 1 20 TYR CZ C 4.675 2.473 7.284 1.00 . A A . 20 TYR CZ 1 1 11 3336 1 1 20 TYR H H 2.037 -3.217 5.119 1.00 . A A . 20 TYR H 1 1 11 3337 1 1 20 TYR HA H 3.478 -0.890 4.312 1.00 . A A . 20 TYR HA 1 1 11 3338 1 1 20 TYR HB2 H 2.779 -1.843 6.801 1.00 . A A . 20 TYR HB2 1 1 11 3339 1 1 20 TYR HB3 H 4.462 -2.384 6.764 1.00 . A A . 20 TYR HB3 1 1 11 3340 1 1 20 TYR HD1 H 2.127 0.510 6.175 1.00 . A A . 20 TYR HD1 1 1 11 3341 1 1 20 TYR HD2 H 6.092 -0.622 7.399 1.00 . A A . 20 TYR HD2 1 1 11 3342 1 1 20 TYR HE1 H 2.648 2.871 6.633 1.00 . A A . 20 TYR HE1 1 1 11 3343 1 1 20 TYR HE2 H 6.609 1.748 7.885 1.00 . A A . 20 TYR HE2 1 1 11 3344 1 1 20 TYR HH H 4.301 4.424 7.388 1.00 . A A . 20 TYR HH 1 1 11 3345 1 1 20 TYR N N 2.544 -2.738 4.405 1.00 . A A . 20 TYR N 1 1 11 3346 1 1 20 TYR O O 4.966 -3.483 3.659 1.00 . A A . 20 TYR O 1 1 11 3347 1 1 20 TYR OH O 5.001 3.805 7.561 1.00 . A A . 20 TYR OH 1 1 11 3348 1 1 21 GLY C C 8.496 -1.579 4.672 1.00 . A A . 21 GLY C 1 1 11 3349 1 1 21 GLY CA C 7.363 -2.121 3.842 1.00 . A A . 21 GLY CA 1 1 11 3350 1 1 21 GLY H H 6.041 -0.725 4.747 1.00 . A A . 21 GLY H 1 1 11 3351 1 1 21 GLY HA2 H 7.426 -3.220 3.884 1.00 . A A . 21 GLY HA2 1 1 11 3352 1 1 21 GLY HA3 H 7.490 -1.801 2.796 1.00 . A A . 21 GLY HA3 1 1 11 3353 1 1 21 GLY N N 6.077 -1.640 4.341 1.00 . A A . 21 GLY N 1 1 11 3354 1 1 21 GLY O O 9.633 -1.475 4.138 1.00 . A A . 21 GLY O 1 1 11 3355 1 1 21 GLY OXT O 8.260 -1.264 5.869 1.00 . A A . 21 GLY OXT 1 1 12 3356 1 1 1 GLY C C 3.553 -1.216 -0.749 1.00 . A A . 1 GLY C 1 1 12 3357 1 1 1 GLY CA C 2.765 0.069 -0.647 1.00 . A A . 1 GLY CA 1 1 12 3358 1 1 1 GLY H1 H 1.168 -0.554 0.610 1.00 . A A . 1 GLY H1 1 1 12 3359 1 1 1 GLY HA2 H 2.111 0.173 -1.526 1.00 . A A . 1 GLY HA2 1 1 12 3360 1 1 1 GLY HA3 H 3.481 0.905 -0.684 1.00 . A A . 1 GLY HA3 1 1 12 3361 1 1 1 GLY N N 1.944 0.080 0.564 1.00 . A A . 1 GLY N 1 1 12 3362 1 1 1 GLY O O 3.462 -1.893 -1.761 1.00 . A A . 1 GLY O 1 1 12 3363 1 1 2 GLY C C 4.297 -4.024 0.377 1.00 . A A . 2 GLY C 1 1 12 3364 1 1 2 GLY CA C 5.148 -2.784 0.232 1.00 . A A . 2 GLY CA 1 1 12 3365 1 1 2 GLY H H 4.385 -1.000 1.121 1.00 . A A . 2 GLY H 1 1 12 3366 1 1 2 GLY HA2 H 5.696 -2.837 -0.722 1.00 . A A . 2 GLY HA2 1 1 12 3367 1 1 2 GLY HA3 H 5.892 -2.771 1.042 1.00 . A A . 2 GLY HA3 1 1 12 3368 1 1 2 GLY N N 4.346 -1.563 0.290 1.00 . A A . 2 GLY N 1 1 12 3369 1 1 2 GLY O O 3.091 -3.935 0.214 1.00 . A A . 2 GLY O 1 1 12 3370 1 1 3 ALA C C 4.213 -6.832 2.328 1.00 . A A . 3 ALA C 1 1 12 3371 1 1 3 ALA CA C 4.179 -6.433 0.869 1.00 . A A . 3 ALA CA 1 1 12 3372 1 1 3 ALA CB C 4.789 -7.526 -0.046 1.00 . A A . 3 ALA CB 1 1 12 3373 1 1 3 ALA H H 5.919 -5.219 0.805 1.00 . A A . 3 ALA H 1 1 12 3374 1 1 3 ALA HA H 3.119 -6.333 0.586 1.00 . A A . 3 ALA HA 1 1 12 3375 1 1 3 ALA HB1 H 4.213 -8.461 0.032 1.00 . A A . 3 ALA HB1 1 1 12 3376 1 1 3 ALA HB2 H 4.775 -7.190 -1.095 1.00 . A A . 3 ALA HB2 1 1 12 3377 1 1 3 ALA HB3 H 5.833 -7.726 0.244 1.00 . A A . 3 ALA HB3 1 1 12 3378 1 1 3 ALA N N 4.925 -5.187 0.679 1.00 . A A . 3 ALA N 1 1 12 3379 1 1 3 ALA O O 4.353 -8.008 2.625 1.00 . A A . 3 ALA O 1 1 12 3380 1 1 4 GLY C C 2.815 -6.733 5.203 1.00 . A A . 4 GLY C 1 1 12 3381 1 1 4 GLY CA C 4.129 -6.180 4.684 1.00 . A A . 4 GLY CA 1 1 12 3382 1 1 4 GLY H H 3.966 -4.898 2.997 1.00 . A A . 4 GLY H 1 1 12 3383 1 1 4 GLY HA2 H 4.910 -6.932 4.879 1.00 . A A . 4 GLY HA2 1 1 12 3384 1 1 4 GLY HA3 H 4.420 -5.273 5.238 1.00 . A A . 4 GLY HA3 1 1 12 3385 1 1 4 GLY N N 4.087 -5.858 3.259 1.00 . A A . 4 GLY N 1 1 12 3386 1 1 4 GLY O O 2.155 -7.454 4.472 1.00 . A A . 4 GLY O 1 1 12 3387 1 1 5 HIS C C 0.253 -6.015 7.474 1.00 . A A . 5 HIS C 1 1 12 3388 1 1 5 HIS CA C 1.339 -7.044 7.172 1.00 . A A . 5 HIS CA 1 1 12 3389 1 1 5 HIS CB C 1.811 -7.700 8.469 1.00 . A A . 5 HIS CB 1 1 12 3390 1 1 5 HIS CD2 C 2.247 -10.055 7.472 1.00 . A A . 5 HIS CD2 1 1 12 3391 1 1 5 HIS CE1 C 4.128 -10.498 8.507 1.00 . A A . 5 HIS CE1 1 1 12 3392 1 1 5 HIS CG C 2.541 -8.991 8.255 1.00 . A A . 5 HIS CG 1 1 12 3393 1 1 5 HIS H H 3.070 -5.841 6.980 1.00 . A A . 5 HIS H 1 1 12 3394 1 1 5 HIS HA H 0.928 -7.802 6.523 1.00 . A A . 5 HIS HA 1 1 12 3395 1 1 5 HIS HB2 H 2.478 -7.025 8.985 1.00 . A A . 5 HIS HB2 1 1 12 3396 1 1 5 HIS HB3 H 0.955 -7.902 9.096 1.00 . A A . 5 HIS HB3 1 1 12 3397 1 1 5 HIS HD1 H 4.199 -8.727 9.528 1.00 . A A . 5 HIS HD1 1 1 12 3398 1 1 5 HIS HD2 H 1.385 -10.159 6.828 1.00 . A A . 5 HIS HD2 1 1 12 3399 1 1 5 HIS HE1 H 5.024 -11.001 8.840 1.00 . A A . 5 HIS HE1 1 1 12 3400 1 1 5 HIS N N 2.463 -6.423 6.479 1.00 . A A . 5 HIS N 1 1 12 3401 1 1 5 HIS ND1 N 3.725 -9.300 8.892 1.00 . A A . 5 HIS ND1 1 1 12 3402 1 1 5 HIS NE2 N 3.249 -10.978 7.646 1.00 . A A . 5 HIS NE2 1 1 12 3403 1 1 5 HIS O O -0.904 -6.368 7.702 1.00 . A A . 5 HIS O 1 1 12 3404 1 1 6 VAL C C -0.753 -2.847 6.778 1.00 . A A . 6 VAL C 1 1 12 3405 1 1 6 VAL CA C -0.401 -3.684 7.989 1.00 . A A . 6 VAL CA 1 1 12 3406 1 1 6 VAL CB C 0.260 -2.813 9.102 1.00 . A A . 6 VAL CB 1 1 12 3407 1 1 6 VAL CG1 C -0.689 -1.702 9.629 1.00 . A A . 6 VAL CG1 1 1 12 3408 1 1 6 VAL CG2 C 0.734 -3.710 10.281 1.00 . A A . 6 VAL CG2 1 1 12 3409 1 1 6 VAL H H 1.472 -4.336 7.315 1.00 . A A . 6 VAL H 1 1 12 3410 1 1 6 VAL HA H -1.288 -4.153 8.435 1.00 . A A . 6 VAL HA 1 1 12 3411 1 1 6 VAL HB H 1.147 -2.313 8.680 1.00 . A A . 6 VAL HB 1 1 12 3412 1 1 6 VAL HG11 H -1.555 -2.145 10.143 1.00 . A A . 6 VAL HG11 1 1 12 3413 1 1 6 VAL HG12 H -0.157 -1.060 10.349 1.00 . A A . 6 VAL HG12 1 1 12 3414 1 1 6 VAL HG13 H -1.044 -1.066 8.804 1.00 . A A . 6 VAL HG13 1 1 12 3415 1 1 6 VAL HG21 H 1.468 -4.456 9.939 1.00 . A A . 6 VAL HG21 1 1 12 3416 1 1 6 VAL HG22 H 1.211 -3.097 11.062 1.00 . A A . 6 VAL HG22 1 1 12 3417 1 1 6 VAL HG23 H -0.121 -4.240 10.727 1.00 . A A . 6 VAL HG23 1 1 12 3418 1 1 6 VAL N N 0.569 -4.692 7.543 1.00 . A A . 6 VAL N 1 1 12 3419 1 1 6 VAL O O 0.185 -2.516 6.069 1.00 . A A . 6 VAL O 1 1 12 3420 1 1 7 PRO C C -1.724 -0.366 5.211 1.00 . A A . 7 PRO C 1 1 12 3421 1 1 7 PRO CA C -2.268 -1.774 5.209 1.00 . A A . 7 PRO CA 1 1 12 3422 1 1 7 PRO CB C -3.807 -1.838 5.134 1.00 . A A . 7 PRO CB 1 1 12 3423 1 1 7 PRO CD C -3.182 -2.826 7.263 1.00 . A A . 7 PRO CD 1 1 12 3424 1 1 7 PRO CG C -4.235 -1.897 6.616 1.00 . A A . 7 PRO CG 1 1 12 3425 1 1 7 PRO HA H -1.868 -2.348 4.368 1.00 . A A . 7 PRO HA 1 1 12 3426 1 1 7 PRO HB2 H -4.258 -1.005 4.570 1.00 . A A . 7 PRO HB2 1 1 12 3427 1 1 7 PRO HB3 H -4.083 -2.794 4.659 1.00 . A A . 7 PRO HB3 1 1 12 3428 1 1 7 PRO HD2 H -3.092 -2.609 8.336 1.00 . A A . 7 PRO HD2 1 1 12 3429 1 1 7 PRO HD3 H -3.440 -3.885 7.106 1.00 . A A . 7 PRO HD3 1 1 12 3430 1 1 7 PRO HG2 H -4.150 -0.885 7.045 1.00 . A A . 7 PRO HG2 1 1 12 3431 1 1 7 PRO HG3 H -5.263 -2.268 6.752 1.00 . A A . 7 PRO HG3 1 1 12 3432 1 1 7 PRO N N -2.020 -2.478 6.458 1.00 . A A . 7 PRO N 1 1 12 3433 1 1 7 PRO O O -1.625 0.228 6.272 1.00 . A A . 7 PRO O 1 1 12 3434 1 1 8 GLU C C -2.006 2.507 3.851 1.00 . A A . 8 GLU C 1 1 12 3435 1 1 8 GLU CA C -0.852 1.532 3.917 1.00 . A A . 8 GLU CA 1 1 12 3436 1 1 8 GLU CB C 0.056 1.687 2.662 1.00 . A A . 8 GLU CB 1 1 12 3437 1 1 8 GLU CD C 2.234 0.904 1.600 1.00 . A A . 8 GLU CD 1 1 12 3438 1 1 8 GLU CG C 1.361 0.865 2.831 1.00 . A A . 8 GLU CG 1 1 12 3439 1 1 8 GLU H H -1.482 -0.360 3.171 1.00 . A A . 8 GLU H 1 1 12 3440 1 1 8 GLU HA H -0.242 1.772 4.805 1.00 . A A . 8 GLU HA 1 1 12 3441 1 1 8 GLU HB2 H -0.482 1.352 1.761 1.00 . A A . 8 GLU HB2 1 1 12 3442 1 1 8 GLU HB3 H 0.324 2.748 2.527 1.00 . A A . 8 GLU HB3 1 1 12 3443 1 1 8 GLU HG2 H 1.934 1.271 3.678 1.00 . A A . 8 GLU HG2 1 1 12 3444 1 1 8 GLU HG3 H 1.104 -0.177 3.068 1.00 . A A . 8 GLU HG3 1 1 12 3445 1 1 8 GLU N N -1.366 0.165 4.016 1.00 . A A . 8 GLU N 1 1 12 3446 1 1 8 GLU O O -1.932 3.545 4.490 1.00 . A A . 8 GLU O 1 1 12 3447 1 1 8 GLU OE1 O 3.177 1.681 1.590 1.00 . A A . 8 GLU OE1 1 1 12 3448 1 1 9 TYR C C -5.482 2.311 2.821 1.00 . A A . 9 TYR C 1 1 12 3449 1 1 9 TYR CA C -4.209 3.110 2.954 1.00 . A A . 9 TYR CA 1 1 12 3450 1 1 9 TYR CB C -3.978 3.995 1.701 1.00 . A A . 9 TYR CB 1 1 12 3451 1 1 9 TYR CD1 C -4.553 2.394 -0.201 1.00 . A A . 9 TYR CD1 1 1 12 3452 1 1 9 TYR CD2 C -2.241 3.004 0.128 1.00 . A A . 9 TYR CD2 1 1 12 3453 1 1 9 TYR CE1 C -4.182 1.545 -1.249 1.00 . A A . 9 TYR CE1 1 1 12 3454 1 1 9 TYR CE2 C -1.871 2.172 -0.931 1.00 . A A . 9 TYR CE2 1 1 12 3455 1 1 9 TYR CG C -3.583 3.110 0.510 1.00 . A A . 9 TYR CG 1 1 12 3456 1 1 9 TYR CZ C -2.836 1.434 -1.622 1.00 . A A . 9 TYR CZ 1 1 12 3457 1 1 9 TYR H H -3.104 1.345 2.553 1.00 . A A . 9 TYR H 1 1 12 3458 1 1 9 TYR HA H -4.325 3.742 3.850 1.00 . A A . 9 TYR HA 1 1 12 3459 1 1 9 TYR HB2 H -4.876 4.579 1.448 1.00 . A A . 9 TYR HB2 1 1 12 3460 1 1 9 TYR HB3 H -3.171 4.711 1.922 1.00 . A A . 9 TYR HB3 1 1 12 3461 1 1 9 TYR HD1 H -5.602 2.491 0.060 1.00 . A A . 9 TYR HD1 1 1 12 3462 1 1 9 TYR HD2 H -1.475 3.566 0.651 1.00 . A A . 9 TYR HD2 1 1 12 3463 1 1 9 TYR HE1 H -4.946 0.975 -1.768 1.00 . A A . 9 TYR HE1 1 1 12 3464 1 1 9 TYR HE2 H -0.828 2.100 -1.219 1.00 . A A . 9 TYR HE2 1 1 12 3465 1 1 9 TYR HH H -3.153 0.304 -3.224 1.00 . A A . 9 TYR HH 1 1 12 3466 1 1 9 TYR N N -3.075 2.193 3.085 1.00 . A A . 9 TYR N 1 1 12 3467 1 1 9 TYR O O -5.381 1.101 2.695 1.00 . A A . 9 TYR O 1 1 12 3468 1 1 9 TYR OH O -2.438 0.601 -2.672 1.00 . A A . 9 TYR OH 1 1 12 3469 1 1 10 PHE C C -8.778 2.870 1.608 1.00 . A A . 10 PHE C 1 1 12 3470 1 1 10 PHE CA C -7.933 2.250 2.701 1.00 . A A . 10 PHE CA 1 1 12 3471 1 1 10 PHE CB C -8.742 2.287 4.018 1.00 . A A . 10 PHE CB 1 1 12 3472 1 1 10 PHE CD1 C -7.080 2.072 5.936 1.00 . A A . 10 PHE CD1 1 1 12 3473 1 1 10 PHE CD2 C -8.326 0.113 5.267 1.00 . A A . 10 PHE CD2 1 1 12 3474 1 1 10 PHE CE1 C -6.522 1.354 6.998 1.00 . A A . 10 PHE CE1 1 1 12 3475 1 1 10 PHE CE2 C -7.772 -0.607 6.329 1.00 . A A . 10 PHE CE2 1 1 12 3476 1 1 10 PHE CG C -8.027 1.470 5.101 1.00 . A A . 10 PHE CG 1 1 12 3477 1 1 10 PHE CZ C -6.903 0.028 7.220 1.00 . A A . 10 PHE CZ 1 1 12 3478 1 1 10 PHE H H -6.715 3.960 2.976 1.00 . A A . 10 PHE H 1 1 12 3479 1 1 10 PHE HA H -7.750 1.192 2.463 1.00 . A A . 10 PHE HA 1 1 12 3480 1 1 10 PHE HB2 H -8.868 3.330 4.350 1.00 . A A . 10 PHE HB2 1 1 12 3481 1 1 10 PHE HB3 H -9.748 1.868 3.854 1.00 . A A . 10 PHE HB3 1 1 12 3482 1 1 10 PHE HD1 H -6.777 3.100 5.765 1.00 . A A . 10 PHE HD1 1 1 12 3483 1 1 10 PHE HD2 H -8.995 -0.386 4.573 1.00 . A A . 10 PHE HD2 1 1 12 3484 1 1 10 PHE HE1 H -5.797 1.827 7.653 1.00 . A A . 10 PHE HE1 1 1 12 3485 1 1 10 PHE HE2 H -8.019 -1.655 6.462 1.00 . A A . 10 PHE HE2 1 1 12 3486 1 1 10 PHE HZ H -6.523 -0.507 8.085 1.00 . A A . 10 PHE HZ 1 1 12 3487 1 1 10 PHE N N -6.669 2.968 2.846 1.00 . A A . 10 PHE N 1 1 12 3488 1 1 10 PHE O O -8.754 4.083 1.478 1.00 . A A . 10 PHE O 1 1 12 3489 1 1 11 VAL C C -11.880 2.419 0.238 1.00 . A A . 11 VAL C 1 1 12 3490 1 1 11 VAL CA C -10.424 2.517 -0.203 1.00 . A A . 11 VAL CA 1 1 12 3491 1 1 11 VAL CB C -10.240 1.725 -1.511 1.00 . A A . 11 VAL CB 1 1 12 3492 1 1 11 VAL CG1 C -11.044 2.358 -2.636 1.00 . A A . 11 VAL CG1 1 1 12 3493 1 1 11 VAL CG2 C -8.766 1.641 -1.880 1.00 . A A . 11 VAL CG2 1 1 12 3494 1 1 11 VAL H H -9.444 1.071 0.993 1.00 . A A . 11 VAL H 1 1 12 3495 1 1 11 VAL HA H -10.185 3.553 -0.397 1.00 . A A . 11 VAL HA 1 1 12 3496 1 1 11 VAL HB H -10.608 0.721 -1.355 1.00 . A A . 11 VAL HB 1 1 12 3497 1 1 11 VAL HG11 H -10.627 2.061 -3.587 1.00 . A A . 11 VAL HG11 1 1 12 3498 1 1 11 VAL HG12 H -12.071 2.029 -2.574 1.00 . A A . 11 VAL HG12 1 1 12 3499 1 1 11 VAL HG13 H -11.004 3.433 -2.546 1.00 . A A . 11 VAL HG13 1 1 12 3500 1 1 11 VAL HG21 H -8.336 2.631 -1.868 1.00 . A A . 11 VAL HG21 1 1 12 3501 1 1 11 VAL HG22 H -8.251 1.016 -1.165 1.00 . A A . 11 VAL HG22 1 1 12 3502 1 1 11 VAL HG23 H -8.666 1.216 -2.868 1.00 . A A . 11 VAL HG23 1 1 12 3503 1 1 11 VAL N N -9.525 2.036 0.840 1.00 . A A . 11 VAL N 1 1 12 3504 1 1 11 VAL O O -12.200 1.738 1.212 1.00 . A A . 11 VAL O 1 1 12 3505 1 1 12 ARG C C -14.832 1.790 -0.628 1.00 . A A . 12 ARG C 1 1 12 3506 1 1 12 ARG CA C -14.182 3.093 -0.171 1.00 . A A . 12 ARG CA 1 1 12 3507 1 1 12 ARG CB C -14.881 4.283 -0.831 1.00 . A A . 12 ARG CB 1 1 12 3508 1 1 12 ARG CD C -14.894 6.757 -1.273 1.00 . A A . 12 ARG CD 1 1 12 3509 1 1 12 ARG CG C -14.265 5.626 -0.474 1.00 . A A . 12 ARG CG 1 1 12 3510 1 1 12 ARG CZ C -15.575 8.358 0.464 1.00 . A A . 12 ARG CZ 1 1 12 3511 1 1 12 ARG H H -12.443 3.627 -1.253 1.00 . A A . 12 ARG H 1 1 12 3512 1 1 12 ARG HA H -14.285 3.176 0.901 1.00 . A A . 12 ARG HA 1 1 12 3513 1 1 12 ARG HB2 H -14.833 4.164 -1.904 1.00 . A A . 12 ARG HB2 1 1 12 3514 1 1 12 ARG HB3 H -15.916 4.293 -0.524 1.00 . A A . 12 ARG HB3 1 1 12 3515 1 1 12 ARG HD2 H -14.115 7.439 -1.580 1.00 . A A . 12 ARG HD2 1 1 12 3516 1 1 12 ARG HD3 H -15.372 6.340 -2.147 1.00 . A A . 12 ARG HD3 1 1 12 3517 1 1 12 ARG HE H -16.831 7.330 -0.695 1.00 . A A . 12 ARG HE 1 1 12 3518 1 1 12 ARG HG2 H -14.420 5.814 0.578 1.00 . A A . 12 ARG HG2 1 1 12 3519 1 1 12 ARG HG3 H -13.207 5.593 -0.684 1.00 . A A . 12 ARG HG3 1 1 12 3520 1 1 12 ARG HH11 H -13.579 8.124 0.258 1.00 . A A . 12 ARG HH11 1 1 12 3521 1 1 12 ARG HH12 H -14.072 9.250 1.479 1.00 . A A . 12 ARG HH12 1 1 12 3522 1 1 12 ARG HH21 H -17.494 8.810 0.909 1.00 . A A . 12 ARG HH21 1 1 12 3523 1 1 12 ARG HH22 H -16.299 9.639 1.849 1.00 . A A . 12 ARG HH22 1 1 12 3524 1 1 12 ARG N N -12.759 3.103 -0.487 1.00 . A A . 12 ARG N 1 1 12 3525 1 1 12 ARG NE N -15.886 7.492 -0.494 1.00 . A A . 12 ARG NE 1 1 12 3526 1 1 12 ARG NH1 N -14.304 8.597 0.758 1.00 . A A . 12 ARG NH1 1 1 12 3527 1 1 12 ARG NH2 N -16.535 8.988 1.129 1.00 . A A . 12 ARG NH2 1 1 12 3528 1 1 12 ARG O O -16.031 1.744 -0.898 1.00 . A A . 12 ARG O 1 1 12 3529 1 1 13 GLY C C -14.740 -1.513 0.022 1.00 . A A . 13 GLY C 1 1 12 3530 1 1 13 GLY CA C -14.544 -0.556 -1.138 1.00 . A A . 13 GLY CA 1 1 12 3531 1 1 13 GLY H H -13.082 0.829 -0.485 1.00 . A A . 13 GLY H 1 1 12 3532 1 1 13 GLY HA2 H -15.492 -0.408 -1.633 1.00 . A A . 13 GLY HA2 1 1 12 3533 1 1 13 GLY HA3 H -13.849 -0.995 -1.838 1.00 . A A . 13 GLY HA3 1 1 12 3534 1 1 13 GLY N N -14.030 0.733 -0.713 1.00 . A A . 13 GLY N 1 1 12 3535 1 1 13 GLY O O -15.566 -1.271 0.902 1.00 . A A . 13 GLY O 1 1 12 3536 1 1 14 ASP C C -12.767 -3.692 1.859 1.00 . A A . 14 ASP C 1 1 12 3537 1 1 14 ASP CA C -14.076 -3.601 1.081 1.00 . A A . 14 ASP CA 1 1 12 3538 1 1 14 ASP CB C -14.431 -4.968 0.493 1.00 . A A . 14 ASP CB 1 1 12 3539 1 1 14 ASP CG C -14.447 -6.062 1.542 1.00 . A A . 14 ASP CG 1 1 12 3540 1 1 14 ASP H H -13.341 -2.740 -0.709 1.00 . A A . 14 ASP H 1 1 12 3541 1 1 14 ASP HA H -14.861 -3.295 1.756 1.00 . A A . 14 ASP HA 1 1 12 3542 1 1 14 ASP HB2 H -15.410 -4.914 0.041 1.00 . A A . 14 ASP HB2 1 1 12 3543 1 1 14 ASP HB3 H -13.704 -5.228 -0.262 1.00 . A A . 14 ASP HB3 1 1 12 3544 1 1 14 ASP N N -13.981 -2.603 0.021 1.00 . A A . 14 ASP N 1 1 12 3545 1 1 14 ASP O O -12.662 -3.189 2.978 1.00 . A A . 14 ASP O 1 1 12 3546 1 1 14 ASP OD1 O -14.951 -5.809 2.657 1.00 . A A . 14 ASP OD1 1 1 12 3547 1 1 14 ASP OD2 O -13.956 -7.172 1.249 1.00 . A A . 14 ASP OD2 1 1 12 3548 1 1 15 PHE C C -9.389 -3.753 1.121 1.00 . A A . 15 PHE C 1 1 12 3549 1 1 15 PHE CA C -10.471 -4.498 1.898 1.00 . A A . 15 PHE CA 1 1 12 3550 1 1 15 PHE CB C -10.109 -5.981 2.004 1.00 . A A . 15 PHE CB 1 1 12 3551 1 1 15 PHE CD1 C -10.753 -6.220 4.417 1.00 . A A . 15 PHE CD1 1 1 12 3552 1 1 15 PHE CD2 C -11.562 -7.838 2.863 1.00 . A A . 15 PHE CD2 1 1 12 3553 1 1 15 PHE CE1 C -11.408 -6.875 5.443 1.00 . A A . 15 PHE CE1 1 1 12 3554 1 1 15 PHE CE2 C -12.219 -8.497 3.885 1.00 . A A . 15 PHE CE2 1 1 12 3555 1 1 15 PHE CG C -10.822 -6.694 3.117 1.00 . A A . 15 PHE CG 1 1 12 3556 1 1 15 PHE CZ C -12.142 -8.014 5.177 1.00 . A A . 15 PHE CZ 1 1 12 3557 1 1 15 PHE H H -11.917 -4.718 0.368 1.00 . A A . 15 PHE H 1 1 12 3558 1 1 15 PHE HA H -10.536 -4.081 2.891 1.00 . A A . 15 PHE HA 1 1 12 3559 1 1 15 PHE HB2 H -10.365 -6.473 1.078 1.00 . A A . 15 PHE HB2 1 1 12 3560 1 1 15 PHE HB3 H -9.047 -6.074 2.175 1.00 . A A . 15 PHE HB3 1 1 12 3561 1 1 15 PHE HD1 H -10.180 -5.329 4.627 1.00 . A A . 15 PHE HD1 1 1 12 3562 1 1 15 PHE HD2 H -11.622 -8.217 1.852 1.00 . A A . 15 PHE HD2 1 1 12 3563 1 1 15 PHE HE1 H -11.347 -6.495 6.452 1.00 . A A . 15 PHE HE1 1 1 12 3564 1 1 15 PHE HE2 H -12.792 -9.387 3.673 1.00 . A A . 15 PHE HE2 1 1 12 3565 1 1 15 PHE HZ H -12.654 -8.527 5.977 1.00 . A A . 15 PHE HZ 1 1 12 3566 1 1 15 PHE N N -11.772 -4.339 1.260 1.00 . A A . 15 PHE N 1 1 12 3567 1 1 15 PHE O O -9.554 -3.414 -0.051 1.00 . A A . 15 PHE O 1 1 12 3568 1 1 16 PRO C C -6.393 -3.533 0.184 1.00 . A A . 16 PRO C 1 1 12 3569 1 1 16 PRO CA C -7.219 -2.614 1.051 1.00 . A A . 16 PRO CA 1 1 12 3570 1 1 16 PRO CB C -6.423 -2.022 2.241 1.00 . A A . 16 PRO CB 1 1 12 3571 1 1 16 PRO CD C -8.041 -3.550 3.197 1.00 . A A . 16 PRO CD 1 1 12 3572 1 1 16 PRO CG C -6.577 -3.089 3.344 1.00 . A A . 16 PRO CG 1 1 12 3573 1 1 16 PRO HA H -7.642 -1.804 0.433 1.00 . A A . 16 PRO HA 1 1 12 3574 1 1 16 PRO HB2 H -5.371 -1.788 2.012 1.00 . A A . 16 PRO HB2 1 1 12 3575 1 1 16 PRO HB3 H -6.922 -1.106 2.592 1.00 . A A . 16 PRO HB3 1 1 12 3576 1 1 16 PRO HD2 H -8.133 -4.573 3.581 1.00 . A A . 16 PRO HD2 1 1 12 3577 1 1 16 PRO HD3 H -8.699 -2.871 3.761 1.00 . A A . 16 PRO HD3 1 1 12 3578 1 1 16 PRO HG2 H -5.891 -3.927 3.133 1.00 . A A . 16 PRO HG2 1 1 12 3579 1 1 16 PRO HG3 H -6.394 -2.703 4.358 1.00 . A A . 16 PRO HG3 1 1 12 3580 1 1 16 PRO N N -8.247 -3.367 1.763 1.00 . A A . 16 PRO N 1 1 12 3581 1 1 16 PRO O O -6.662 -4.724 0.168 1.00 . A A . 16 PRO O 1 1 12 3582 1 1 17 ILE C C -3.272 -4.086 -1.084 1.00 . A A . 17 ILE C 1 1 12 3583 1 1 17 ILE CA C -4.671 -3.755 -1.559 1.00 . A A . 17 ILE CA 1 1 12 3584 1 1 17 ILE CB C -4.635 -2.970 -2.908 1.00 . A A . 17 ILE CB 1 1 12 3585 1 1 17 ILE CD1 C -6.155 -1.721 -4.620 1.00 . A A . 17 ILE CD1 1 1 12 3586 1 1 17 ILE CG1 C -6.088 -2.667 -3.390 1.00 . A A . 17 ILE CG1 1 1 12 3587 1 1 17 ILE CG2 C -3.816 -3.750 -3.978 1.00 . A A . 17 ILE CG2 1 1 12 3588 1 1 17 ILE H H -5.190 -2.001 -0.468 1.00 . A A . 17 ILE H 1 1 12 3589 1 1 17 ILE HA H -5.193 -4.703 -1.775 1.00 . A A . 17 ILE HA 1 1 12 3590 1 1 17 ILE HB H -4.129 -2.006 -2.739 1.00 . A A . 17 ILE HB 1 1 12 3591 1 1 17 ILE HD11 H -5.586 -0.799 -4.427 1.00 . A A . 17 ILE HD11 1 1 12 3592 1 1 17 ILE HD12 H -5.758 -2.205 -5.525 1.00 . A A . 17 ILE HD12 1 1 12 3593 1 1 17 ILE HD13 H -7.203 -1.446 -4.821 1.00 . A A . 17 ILE HD13 1 1 12 3594 1 1 17 ILE HG12 H -6.607 -3.609 -3.628 1.00 . A A . 17 ILE HG12 1 1 12 3595 1 1 17 ILE HG13 H -6.646 -2.172 -2.578 1.00 . A A . 17 ILE HG13 1 1 12 3596 1 1 17 ILE HG21 H -2.800 -3.969 -3.618 1.00 . A A . 17 ILE HG21 1 1 12 3597 1 1 17 ILE HG22 H -4.313 -4.702 -4.220 1.00 . A A . 17 ILE HG22 1 1 12 3598 1 1 17 ILE HG23 H -3.707 -3.164 -4.902 1.00 . A A . 17 ILE HG23 1 1 12 3599 1 1 17 ILE N N -5.403 -2.977 -0.556 1.00 . A A . 17 ILE N 1 1 12 3600 1 1 17 ILE O O -2.946 -5.261 -1.010 1.00 . A A . 17 ILE O 1 1 12 3601 1 1 18 SER C C -0.725 -3.118 0.950 1.00 . A A . 18 SER C 1 1 12 3602 1 1 18 SER CA C -1.007 -3.315 -0.518 1.00 . A A . 18 SER CA 1 1 12 3603 1 1 18 SER CB C -0.220 -2.316 -1.402 1.00 . A A . 18 SER CB 1 1 12 3604 1 1 18 SER H H -2.733 -2.119 -0.780 1.00 . A A . 18 SER H 1 1 12 3605 1 1 18 SER HA H -0.695 -4.338 -0.788 1.00 . A A . 18 SER HA 1 1 12 3606 1 1 18 SER HB2 H 0.865 -2.418 -1.248 1.00 . A A . 18 SER HB2 1 1 12 3607 1 1 18 SER HB3 H -0.447 -2.532 -2.460 1.00 . A A . 18 SER HB3 1 1 12 3608 1 1 18 SER HG H -0.286 -0.329 -1.634 1.00 . A A . 18 SER HG 1 1 12 3609 1 1 18 SER N N -2.425 -3.072 -0.791 1.00 . A A . 18 SER N 1 1 12 3610 1 1 18 SER O O -1.651 -2.769 1.665 1.00 . A A . 18 SER O 1 1 12 3611 1 1 18 SER OG O -0.666 -0.992 -1.069 1.00 . A A . 18 SER OG 1 1 12 3612 1 1 19 PHE C C 2.108 -2.628 3.169 1.00 . A A . 19 PHE C 1 1 12 3613 1 1 19 PHE CA C 0.805 -3.325 2.852 1.00 . A A . 19 PHE CA 1 1 12 3614 1 1 19 PHE CB C 0.691 -4.772 3.397 1.00 . A A . 19 PHE CB 1 1 12 3615 1 1 19 PHE CD1 C -1.786 -5.374 3.263 1.00 . A A . 19 PHE CD1 1 1 12 3616 1 1 19 PHE CD2 C -0.285 -6.291 1.608 1.00 . A A . 19 PHE CD2 1 1 12 3617 1 1 19 PHE CE1 C -2.864 -5.992 2.624 1.00 . A A . 19 PHE CE1 1 1 12 3618 1 1 19 PHE CE2 C -1.357 -6.934 0.984 1.00 . A A . 19 PHE CE2 1 1 12 3619 1 1 19 PHE CG C -0.493 -5.498 2.743 1.00 . A A . 19 PHE CG 1 1 12 3620 1 1 19 PHE CZ C -2.651 -6.778 1.488 1.00 . A A . 19 PHE CZ 1 1 12 3621 1 1 19 PHE H H 1.273 -3.644 0.812 1.00 . A A . 19 PHE H 1 1 12 3622 1 1 19 PHE HA H 0.071 -2.691 3.356 1.00 . A A . 19 PHE HA 1 1 12 3623 1 1 19 PHE HB2 H 1.610 -5.306 3.133 1.00 . A A . 19 PHE HB2 1 1 12 3624 1 1 19 PHE HB3 H 0.581 -4.800 4.493 1.00 . A A . 19 PHE HB3 1 1 12 3625 1 1 19 PHE HD1 H -1.957 -4.796 4.165 1.00 . A A . 19 PHE HD1 1 1 12 3626 1 1 19 PHE HD2 H 0.712 -6.412 1.198 1.00 . A A . 19 PHE HD2 1 1 12 3627 1 1 19 PHE HE1 H -3.871 -5.863 3.010 1.00 . A A . 19 PHE HE1 1 1 12 3628 1 1 19 PHE HE2 H -1.183 -7.551 0.108 1.00 . A A . 19 PHE HE2 1 1 12 3629 1 1 19 PHE HZ H -3.486 -7.268 0.998 1.00 . A A . 19 PHE HZ 1 1 12 3630 1 1 19 PHE N N 0.529 -3.354 1.416 1.00 . A A . 19 PHE N 1 1 12 3631 1 1 19 PHE O O 2.752 -2.145 2.254 1.00 . A A . 19 PHE O 1 1 12 3632 1 1 20 TYR C C 4.909 -2.207 4.354 1.00 . A A . 20 TYR C 1 1 12 3633 1 1 20 TYR CA C 3.595 -1.647 4.851 1.00 . A A . 20 TYR CA 1 1 12 3634 1 1 20 TYR CB C 3.616 -1.405 6.394 1.00 . A A . 20 TYR CB 1 1 12 3635 1 1 20 TYR CD1 C 3.021 1.054 6.504 1.00 . A A . 20 TYR CD1 1 1 12 3636 1 1 20 TYR CD2 C 5.175 0.390 7.362 1.00 . A A . 20 TYR CD2 1 1 12 3637 1 1 20 TYR CE1 C 3.323 2.391 6.773 1.00 . A A . 20 TYR CE1 1 1 12 3638 1 1 20 TYR CE2 C 5.474 1.727 7.645 1.00 . A A . 20 TYR CE2 1 1 12 3639 1 1 20 TYR CG C 3.959 0.048 6.763 1.00 . A A . 20 TYR CG 1 1 12 3640 1 1 20 TYR CZ C 4.551 2.736 7.341 1.00 . A A . 20 TYR CZ 1 1 12 3641 1 1 20 TYR H H 1.965 -2.992 5.175 1.00 . A A . 20 TYR H 1 1 12 3642 1 1 20 TYR HA H 3.445 -0.680 4.345 1.00 . A A . 20 TYR HA 1 1 12 3643 1 1 20 TYR HB2 H 2.616 -1.554 6.826 1.00 . A A . 20 TYR HB2 1 1 12 3644 1 1 20 TYR HB3 H 4.287 -2.126 6.886 1.00 . A A . 20 TYR HB3 1 1 12 3645 1 1 20 TYR HD1 H 2.049 0.797 6.095 1.00 . A A . 20 TYR HD1 1 1 12 3646 1 1 20 TYR HD2 H 5.897 -0.381 7.612 1.00 . A A . 20 TYR HD2 1 1 12 3647 1 1 20 TYR HE1 H 2.600 3.166 6.539 1.00 . A A . 20 TYR HE1 1 1 12 3648 1 1 20 TYR HE2 H 6.427 1.972 8.101 1.00 . A A . 20 TYR HE2 1 1 12 3649 1 1 20 TYR HH H 5.683 4.241 7.986 1.00 . A A . 20 TYR HH 1 1 12 3650 1 1 20 TYR N N 2.483 -2.521 4.464 1.00 . A A . 20 TYR N 1 1 12 3651 1 1 20 TYR O O 4.909 -3.263 3.742 1.00 . A A . 20 TYR O 1 1 12 3652 1 1 20 TYR OH O 4.831 4.083 7.595 1.00 . A A . 20 TYR OH 1 1 12 3653 1 1 21 GLY C C 7.635 -1.658 2.774 1.00 . A A . 21 GLY C 1 1 12 3654 1 1 21 GLY CA C 7.344 -2.052 4.197 1.00 . A A . 21 GLY CA 1 1 12 3655 1 1 21 GLY H H 6.027 -0.619 5.041 1.00 . A A . 21 GLY H 1 1 12 3656 1 1 21 GLY HA2 H 8.137 -1.639 4.842 1.00 . A A . 21 GLY HA2 1 1 12 3657 1 1 21 GLY HA3 H 7.369 -3.147 4.308 1.00 . A A . 21 GLY HA3 1 1 12 3658 1 1 21 GLY N N 6.047 -1.518 4.605 1.00 . A A . 21 GLY N 1 1 12 3659 1 1 21 GLY O O 7.069 -0.631 2.312 1.00 . A A . 21 GLY O 1 1 12 3660 1 1 21 GLY OXT O 8.439 -2.362 2.105 1.00 . A A . 21 GLY OXT 1 1 13 3661 1 1 1 GLY C C 3.578 -1.249 -0.781 1.00 . A A . 1 GLY C 1 1 13 3662 1 1 1 GLY CA C 2.810 0.045 -0.653 1.00 . A A . 1 GLY CA 1 1 13 3663 1 1 1 GLY H1 H 1.212 -0.571 0.606 1.00 . A A . 1 GLY H1 1 1 13 3664 1 1 1 GLY HA2 H 2.149 0.170 -1.524 1.00 . A A . 1 GLY HA2 1 1 13 3665 1 1 1 GLY HA3 H 3.538 0.871 -0.687 1.00 . A A . 1 GLY HA3 1 1 13 3666 1 1 1 GLY N N 1.997 0.053 0.563 1.00 . A A . 1 GLY N 1 1 13 3667 1 1 1 GLY O O 3.467 -1.911 -1.801 1.00 . A A . 1 GLY O 1 1 13 3668 1 1 2 GLY C C 4.307 -4.082 0.315 1.00 . A A . 2 GLY C 1 1 13 3669 1 1 2 GLY CA C 5.165 -2.848 0.162 1.00 . A A . 2 GLY CA 1 1 13 3670 1 1 2 GLY H H 4.429 -1.070 1.084 1.00 . A A . 2 GLY H 1 1 13 3671 1 1 2 GLY HA2 H 5.692 -2.898 -0.803 1.00 . A A . 2 GLY HA2 1 1 13 3672 1 1 2 GLY HA3 H 5.926 -2.846 0.956 1.00 . A A . 2 GLY HA3 1 1 13 3673 1 1 2 GLY N N 4.376 -1.620 0.246 1.00 . A A . 2 GLY N 1 1 13 3674 1 1 2 GLY O O 3.100 -3.984 0.167 1.00 . A A . 2 GLY O 1 1 13 3675 1 1 3 ALA C C 4.224 -6.896 2.257 1.00 . A A . 3 ALA C 1 1 13 3676 1 1 3 ALA CA C 4.179 -6.492 0.799 1.00 . A A . 3 ALA CA 1 1 13 3677 1 1 3 ALA CB C 4.777 -7.587 -0.123 1.00 . A A . 3 ALA CB 1 1 13 3678 1 1 3 ALA H H 5.926 -5.290 0.722 1.00 . A A . 3 ALA H 1 1 13 3679 1 1 3 ALA HA H 3.118 -6.384 0.525 1.00 . A A . 3 ALA HA 1 1 13 3680 1 1 3 ALA HB1 H 5.821 -7.794 0.157 1.00 . A A . 3 ALA HB1 1 1 13 3681 1 1 3 ALA HB2 H 4.196 -8.519 -0.043 1.00 . A A . 3 ALA HB2 1 1 13 3682 1 1 3 ALA HB3 H 4.755 -7.247 -1.171 1.00 . A A . 3 ALA HB3 1 1 13 3683 1 1 3 ALA N N 4.931 -5.250 0.608 1.00 . A A . 3 ALA N 1 1 13 3684 1 1 3 ALA O O 4.369 -8.072 2.550 1.00 . A A . 3 ALA O 1 1 13 3685 1 1 4 GLY C C 2.840 -6.810 5.137 1.00 . A A . 4 GLY C 1 1 13 3686 1 1 4 GLY CA C 4.151 -6.251 4.615 1.00 . A A . 4 GLY CA 1 1 13 3687 1 1 4 GLY H H 3.976 -4.964 2.932 1.00 . A A . 4 GLY H 1 1 13 3688 1 1 4 GLY HA2 H 4.935 -7.000 4.805 1.00 . A A . 4 GLY HA2 1 1 13 3689 1 1 4 GLY HA3 H 4.439 -5.345 5.172 1.00 . A A . 4 GLY HA3 1 1 13 3690 1 1 4 GLY N N 4.100 -5.925 3.191 1.00 . A A . 4 GLY N 1 1 13 3691 1 1 4 GLY O O 2.174 -7.519 4.400 1.00 . A A . 4 GLY O 1 1 13 3692 1 1 5 HIS C C 0.294 -6.105 7.425 1.00 . A A . 5 HIS C 1 1 13 3693 1 1 5 HIS CA C 1.371 -7.137 7.107 1.00 . A A . 5 HIS CA 1 1 13 3694 1 1 5 HIS CB C 1.843 -7.813 8.395 1.00 . A A . 5 HIS CB 1 1 13 3695 1 1 5 HIS CD2 C 3.729 -9.369 7.530 1.00 . A A . 5 HIS CD2 1 1 13 3696 1 1 5 HIS CE1 C 2.929 -11.277 8.257 1.00 . A A . 5 HIS CE1 1 1 13 3697 1 1 5 HIS CG C 2.562 -9.106 8.164 1.00 . A A . 5 HIS CG 1 1 13 3698 1 1 5 HIS H H 3.108 -5.940 6.924 1.00 . A A . 5 HIS H 1 1 13 3699 1 1 5 HIS HA H 0.953 -7.885 6.451 1.00 . A A . 5 HIS HA 1 1 13 3700 1 1 5 HIS HB2 H 2.516 -7.148 8.916 1.00 . A A . 5 HIS HB2 1 1 13 3701 1 1 5 HIS HB3 H 0.987 -8.016 9.022 1.00 . A A . 5 HIS HB3 1 1 13 3702 1 1 5 HIS HD1 H 1.254 -10.464 9.104 1.00 . A A . 5 HIS HD1 1 1 13 3703 1 1 5 HIS HD2 H 4.379 -8.647 7.056 1.00 . A A . 5 HIS HD2 1 1 13 3704 1 1 5 HIS HE1 H 2.816 -12.329 8.469 1.00 . A A . 5 HIS HE1 1 1 13 3705 1 1 5 HIS N N 2.498 -6.516 6.419 1.00 . A A . 5 HIS N 1 1 13 3706 1 1 5 HIS ND1 N 2.086 -10.322 8.606 1.00 . A A . 5 HIS ND1 1 1 13 3707 1 1 5 HIS NE2 N 3.935 -10.725 7.602 1.00 . A A . 5 HIS NE2 1 1 13 3708 1 1 5 HIS O O -0.865 -6.453 7.656 1.00 . A A . 5 HIS O 1 1 13 3709 1 1 6 VAL C C -0.675 -2.911 6.780 1.00 . A A . 6 VAL C 1 1 13 3710 1 1 6 VAL CA C -0.331 -3.772 7.976 1.00 . A A . 6 VAL CA 1 1 13 3711 1 1 6 VAL CB C 0.351 -2.932 9.100 1.00 . A A . 6 VAL CB 1 1 13 3712 1 1 6 VAL CG1 C -0.574 -1.813 9.653 1.00 . A A . 6 VAL CG1 1 1 13 3713 1 1 6 VAL CG2 C 0.817 -3.857 10.259 1.00 . A A . 6 VAL CG2 1 1 13 3714 1 1 6 VAL H H 1.525 -4.433 7.273 1.00 . A A . 6 VAL H 1 1 13 3715 1 1 6 VAL HA H -1.224 -4.237 8.417 1.00 . A A . 6 VAL HA 1 1 13 3716 1 1 6 VAL HB H 1.244 -2.441 8.679 1.00 . A A . 6 VAL HB 1 1 13 3717 1 1 6 VAL HG11 H -0.026 -1.193 10.379 1.00 . A A . 6 VAL HG11 1 1 13 3718 1 1 6 VAL HG12 H -0.925 -1.158 8.841 1.00 . A A . 6 VAL HG12 1 1 13 3719 1 1 6 VAL HG13 H -1.444 -2.250 10.167 1.00 . A A . 6 VAL HG13 1 1 13 3720 1 1 6 VAL HG21 H -0.044 -4.382 10.701 1.00 . A A . 6 VAL HG21 1 1 13 3721 1 1 6 VAL HG22 H 1.536 -4.609 9.900 1.00 . A A . 6 VAL HG22 1 1 13 3722 1 1 6 VAL HG23 H 1.309 -3.266 11.048 1.00 . A A . 6 VAL HG23 1 1 13 3723 1 1 6 VAL N N 0.622 -4.786 7.506 1.00 . A A . 6 VAL N 1 1 13 3724 1 1 6 VAL O O 0.261 -2.592 6.065 1.00 . A A . 6 VAL O 1 1 13 3725 1 1 7 PRO C C -1.616 -0.389 5.245 1.00 . A A . 7 PRO C 1 1 13 3726 1 1 7 PRO CA C -2.180 -1.790 5.239 1.00 . A A . 7 PRO CA 1 1 13 3727 1 1 7 PRO CB C -3.720 -1.829 5.176 1.00 . A A . 7 PRO CB 1 1 13 3728 1 1 7 PRO CD C -3.098 -2.842 7.290 1.00 . A A . 7 PRO CD 1 1 13 3729 1 1 7 PRO CG C -4.136 -1.884 6.661 1.00 . A A . 7 PRO CG 1 1 13 3730 1 1 7 PRO HA H -1.796 -2.361 4.388 1.00 . A A . 7 PRO HA 1 1 13 3731 1 1 7 PRO HB2 H -4.162 -0.988 4.617 1.00 . A A . 7 PRO HB2 1 1 13 3732 1 1 7 PRO HB3 H -4.010 -2.780 4.702 1.00 . A A . 7 PRO HB3 1 1 13 3733 1 1 7 PRO HD2 H -2.995 -2.640 8.365 1.00 . A A . 7 PRO HD2 1 1 13 3734 1 1 7 PRO HD3 H -3.380 -3.894 7.123 1.00 . A A . 7 PRO HD3 1 1 13 3735 1 1 7 PRO HG2 H -4.020 -0.877 7.094 1.00 . A A . 7 PRO HG2 1 1 13 3736 1 1 7 PRO HG3 H -5.172 -2.230 6.807 1.00 . A A . 7 PRO HG3 1 1 13 3737 1 1 7 PRO N N -1.937 -2.510 6.478 1.00 . A A . 7 PRO N 1 1 13 3738 1 1 7 PRO O O -1.479 0.188 6.312 1.00 . A A . 7 PRO O 1 1 13 3739 1 1 8 GLU C C -1.904 2.500 3.893 1.00 . A A . 8 GLU C 1 1 13 3740 1 1 8 GLU CA C -0.758 1.515 3.948 1.00 . A A . 8 GLU CA 1 1 13 3741 1 1 8 GLU CB C 0.143 1.663 2.687 1.00 . A A . 8 GLU CB 1 1 13 3742 1 1 8 GLU CD C 2.304 0.863 1.605 1.00 . A A . 8 GLU CD 1 1 13 3743 1 1 8 GLU CG C 1.437 0.823 2.841 1.00 . A A . 8 GLU CG 1 1 13 3744 1 1 8 GLU H H -1.428 -0.362 3.199 1.00 . A A . 8 GLU H 1 1 13 3745 1 1 8 GLU HA H -0.140 1.747 4.833 1.00 . A A . 8 GLU HA 1 1 13 3746 1 1 8 GLU HB2 H -0.406 1.340 1.788 1.00 . A A . 8 GLU HB2 1 1 13 3747 1 1 8 GLU HB3 H 0.423 2.721 2.554 1.00 . A A . 8 GLU HB3 1 1 13 3748 1 1 8 GLU HG2 H 2.021 1.216 3.687 1.00 . A A . 8 GLU HG2 1 1 13 3749 1 1 8 GLU HG3 H 1.169 -0.217 3.072 1.00 . A A . 8 GLU HG3 1 1 13 3750 1 1 8 GLU N N -1.284 0.153 4.048 1.00 . A A . 8 GLU N 1 1 13 3751 1 1 8 GLU O O -1.825 3.528 4.548 1.00 . A A . 8 GLU O 1 1 13 3752 1 1 8 GLU OE1 O 3.256 1.628 1.597 1.00 . A A . 8 GLU OE1 1 1 13 3753 1 1 9 TYR C C -5.380 2.339 2.857 1.00 . A A . 9 TYR C 1 1 13 3754 1 1 9 TYR CA C -4.102 3.131 3.001 1.00 . A A . 9 TYR CA 1 1 13 3755 1 1 9 TYR CB C -3.865 4.033 1.762 1.00 . A A . 9 TYR CB 1 1 13 3756 1 1 9 TYR CD1 C -4.455 2.472 -0.167 1.00 . A A . 9 TYR CD1 1 1 13 3757 1 1 9 TYR CD2 C -2.135 3.043 0.180 1.00 . A A . 9 TYR CD2 1 1 13 3758 1 1 9 TYR CE1 C -4.091 1.636 -1.227 1.00 . A A . 9 TYR CE1 1 1 13 3759 1 1 9 TYR CE2 C -1.773 2.219 -0.888 1.00 . A A . 9 TYR CE2 1 1 13 3760 1 1 9 TYR CG C -3.477 3.162 0.558 1.00 . A A . 9 TYR CG 1 1 13 3761 1 1 9 TYR CZ C -2.746 1.506 -1.594 1.00 . A A . 9 TYR CZ 1 1 13 3762 1 1 9 TYR H H -3.008 1.365 2.575 1.00 . A A . 9 TYR H 1 1 13 3763 1 1 9 TYR HA H -4.216 3.750 3.907 1.00 . A A . 9 TYR HA 1 1 13 3764 1 1 9 TYR HB2 H -4.759 4.628 1.519 1.00 . A A . 9 TYR HB2 1 1 13 3765 1 1 9 TYR HB3 H -3.052 4.740 1.993 1.00 . A A . 9 TYR HB3 1 1 13 3766 1 1 9 TYR HD1 H -5.503 2.581 0.090 1.00 . A A . 9 TYR HD1 1 1 13 3767 1 1 9 TYR HD2 H -1.364 3.588 0.714 1.00 . A A . 9 TYR HD2 1 1 13 3768 1 1 9 TYR HE1 H -4.862 1.089 -1.761 1.00 . A A . 9 TYR HE1 1 1 13 3769 1 1 9 TYR HE2 H -0.729 2.134 -1.171 1.00 . A A . 9 TYR HE2 1 1 13 3770 1 1 9 TYR HH H -3.073 0.371 -3.192 1.00 . A A . 9 TYR HH 1 1 13 3771 1 1 9 TYR N N -2.974 2.205 3.120 1.00 . A A . 9 TYR N 1 1 13 3772 1 1 9 TYR O O -5.283 1.131 2.713 1.00 . A A . 9 TYR O 1 1 13 3773 1 1 9 TYR OH O -2.354 0.680 -2.652 1.00 . A A . 9 TYR OH 1 1 13 3774 1 1 10 PHE C C -8.684 2.906 1.669 1.00 . A A . 10 PHE C 1 1 13 3775 1 1 10 PHE CA C -7.832 2.284 2.755 1.00 . A A . 10 PHE CA 1 1 13 3776 1 1 10 PHE CB C -8.631 2.329 4.079 1.00 . A A . 10 PHE CB 1 1 13 3777 1 1 10 PHE CD1 C -6.954 2.177 5.989 1.00 . A A . 10 PHE CD1 1 1 13 3778 1 1 10 PHE CD2 C -8.158 0.181 5.352 1.00 . A A . 10 PHE CD2 1 1 13 3779 1 1 10 PHE CE1 C -6.372 1.485 7.055 1.00 . A A . 10 PHE CE1 1 1 13 3780 1 1 10 PHE CE2 C -7.581 -0.512 6.419 1.00 . A A . 10 PHE CE2 1 1 13 3781 1 1 10 PHE CG C -7.891 1.542 5.168 1.00 . A A . 10 PHE CG 1 1 13 3782 1 1 10 PHE CZ C -6.719 0.153 7.295 1.00 . A A . 10 PHE CZ 1 1 13 3783 1 1 10 PHE H H -6.607 3.989 3.033 1.00 . A A . 10 PHE H 1 1 13 3784 1 1 10 PHE HA H -7.656 1.226 2.519 1.00 . A A . 10 PHE HA 1 1 13 3785 1 1 10 PHE HB2 H -8.772 3.374 4.395 1.00 . A A . 10 PHE HB2 1 1 13 3786 1 1 10 PHE HB3 H -9.631 1.891 3.929 1.00 . A A . 10 PHE HB3 1 1 13 3787 1 1 10 PHE HD1 H -6.677 3.210 5.806 1.00 . A A . 10 PHE HD1 1 1 13 3788 1 1 10 PHE HD2 H -8.818 -0.342 4.669 1.00 . A A . 10 PHE HD2 1 1 13 3789 1 1 10 PHE HE1 H -5.653 1.983 7.699 1.00 . A A . 10 PHE HE1 1 1 13 3790 1 1 10 PHE HE2 H -7.805 -1.563 6.569 1.00 . A A . 10 PHE HE2 1 1 13 3791 1 1 10 PHE HZ H -6.318 -0.364 8.161 1.00 . A A . 10 PHE HZ 1 1 13 3792 1 1 10 PHE N N -6.565 2.998 2.894 1.00 . A A . 10 PHE N 1 1 13 3793 1 1 10 PHE O O -8.658 4.119 1.544 1.00 . A A . 10 PHE O 1 1 13 3794 1 1 11 VAL C C -11.791 2.471 0.309 1.00 . A A . 11 VAL C 1 1 13 3795 1 1 11 VAL CA C -10.336 2.569 -0.135 1.00 . A A . 11 VAL CA 1 1 13 3796 1 1 11 VAL CB C -10.159 1.788 -1.450 1.00 . A A . 11 VAL CB 1 1 13 3797 1 1 11 VAL CG1 C -10.963 2.433 -2.568 1.00 . A A . 11 VAL CG1 1 1 13 3798 1 1 11 VAL CG2 C -8.686 1.700 -1.823 1.00 . A A . 11 VAL CG2 1 1 13 3799 1 1 11 VAL H H -9.356 1.111 1.046 1.00 . A A . 11 VAL H 1 1 13 3800 1 1 11 VAL HA H -10.096 3.606 -0.321 1.00 . A A . 11 VAL HA 1 1 13 3801 1 1 11 VAL HB H -10.531 0.784 -1.302 1.00 . A A . 11 VAL HB 1 1 13 3802 1 1 11 VAL HG11 H -10.547 2.145 -3.523 1.00 . A A . 11 VAL HG11 1 1 13 3803 1 1 11 VAL HG12 H -11.990 2.107 -2.508 1.00 . A A . 11 VAL HG12 1 1 13 3804 1 1 11 VAL HG13 H -10.920 3.508 -2.467 1.00 . A A . 11 VAL HG13 1 1 13 3805 1 1 11 VAL HG21 H -8.592 1.317 -2.828 1.00 . A A . 11 VAL HG21 1 1 13 3806 1 1 11 VAL HG22 H -8.242 2.684 -1.770 1.00 . A A . 11 VAL HG22 1 1 13 3807 1 1 11 VAL HG23 H -8.179 1.039 -1.136 1.00 . A A . 11 VAL HG23 1 1 13 3808 1 1 11 VAL N N -9.436 2.077 0.901 1.00 . A A . 11 VAL N 1 1 13 3809 1 1 11 VAL O O -12.109 1.786 1.282 1.00 . A A . 11 VAL O 1 1 13 3810 1 1 12 ARG C C -14.747 1.852 -0.551 1.00 . A A . 12 ARG C 1 1 13 3811 1 1 12 ARG CA C -14.094 3.151 -0.089 1.00 . A A . 12 ARG CA 1 1 13 3812 1 1 12 ARG CB C -14.792 4.346 -0.742 1.00 . A A . 12 ARG CB 1 1 13 3813 1 1 12 ARG CD C -15.194 6.827 -0.762 1.00 . A A . 12 ARG CD 1 1 13 3814 1 1 12 ARG CG C -14.496 5.672 -0.060 1.00 . A A . 12 ARG CG 1 1 13 3815 1 1 12 ARG CZ C -17.009 8.423 -0.316 1.00 . A A . 12 ARG CZ 1 1 13 3816 1 1 12 ARG H H -12.357 3.688 -1.174 1.00 . A A . 12 ARG H 1 1 13 3817 1 1 12 ARG HA H -14.193 3.229 0.983 1.00 . A A . 12 ARG HA 1 1 13 3818 1 1 12 ARG HB2 H -14.473 4.416 -1.771 1.00 . A A . 12 ARG HB2 1 1 13 3819 1 1 12 ARG HB3 H -15.859 4.182 -0.714 1.00 . A A . 12 ARG HB3 1 1 13 3820 1 1 12 ARG HD2 H -14.483 7.627 -0.901 1.00 . A A . 12 ARG HD2 1 1 13 3821 1 1 12 ARG HD3 H -15.545 6.486 -1.724 1.00 . A A . 12 ARG HD3 1 1 13 3822 1 1 12 ARG HE H -16.595 6.826 0.805 1.00 . A A . 12 ARG HE 1 1 13 3823 1 1 12 ARG HG2 H -14.841 5.625 0.962 1.00 . A A . 12 ARG HG2 1 1 13 3824 1 1 12 ARG HG3 H -13.430 5.843 -0.075 1.00 . A A . 12 ARG HG3 1 1 13 3825 1 1 12 ARG HH11 H -15.903 8.830 -1.957 1.00 . A A . 12 ARG HH11 1 1 13 3826 1 1 12 ARG HH12 H -17.186 9.947 -1.631 1.00 . A A . 12 ARG HH12 1 1 13 3827 1 1 12 ARG HH21 H -18.288 8.290 1.244 1.00 . A A . 12 ARG HH21 1 1 13 3828 1 1 12 ARG HH22 H -18.542 9.640 0.190 1.00 . A A . 12 ARG HH22 1 1 13 3829 1 1 12 ARG N N -12.671 3.160 -0.410 1.00 . A A . 12 ARG N 1 1 13 3830 1 1 12 ARG NE N -16.329 7.329 0.008 1.00 . A A . 12 ARG NE 1 1 13 3831 1 1 12 ARG NH1 N -16.671 9.125 -1.389 1.00 . A A . 12 ARG NH1 1 1 13 3832 1 1 12 ARG NH2 N -18.030 8.817 0.434 1.00 . A A . 12 ARG NH2 1 1 13 3833 1 1 12 ARG O O -15.948 1.809 -0.815 1.00 . A A . 12 ARG O 1 1 13 3834 1 1 13 GLY C C -14.654 -1.456 0.078 1.00 . A A . 13 GLY C 1 1 13 3835 1 1 13 GLY CA C -14.464 -0.491 -1.076 1.00 . A A . 13 GLY CA 1 1 13 3836 1 1 13 GLY H H -12.997 0.888 -0.422 1.00 . A A . 13 GLY H 1 1 13 3837 1 1 13 GLY HA2 H -15.415 -0.339 -1.564 1.00 . A A . 13 GLY HA2 1 1 13 3838 1 1 13 GLY HA3 H -13.773 -0.926 -1.783 1.00 . A A . 13 GLY HA3 1 1 13 3839 1 1 13 GLY N N -13.947 0.794 -0.646 1.00 . A A . 13 GLY N 1 1 13 3840 1 1 13 GLY O O -15.474 -1.219 0.965 1.00 . A A . 13 GLY O 1 1 13 3841 1 1 14 ASP C C -12.672 -3.644 1.893 1.00 . A A . 14 ASP C 1 1 13 3842 1 1 14 ASP CA C -13.983 -3.550 1.120 1.00 . A A . 14 ASP CA 1 1 13 3843 1 1 14 ASP CB C -14.339 -4.914 0.526 1.00 . A A . 14 ASP CB 1 1 13 3844 1 1 14 ASP CG C -14.355 -6.014 1.569 1.00 . A A . 14 ASP CG 1 1 13 3845 1 1 14 ASP H H -13.259 -2.678 -0.668 1.00 . A A . 14 ASP H 1 1 13 3846 1 1 14 ASP HA H -14.766 -3.250 1.800 1.00 . A A . 14 ASP HA 1 1 13 3847 1 1 14 ASP HB2 H -15.318 -4.858 0.074 1.00 . A A . 14 ASP HB2 1 1 13 3848 1 1 14 ASP HB3 H -13.611 -5.170 -0.230 1.00 . A A . 14 ASP HB3 1 1 13 3849 1 1 14 ASP N N -13.895 -2.546 0.067 1.00 . A A . 14 ASP N 1 1 13 3850 1 1 14 ASP O O -12.562 -3.147 3.014 1.00 . A A . 14 ASP O 1 1 13 3851 1 1 14 ASP OD1 O -14.782 -5.743 2.711 1.00 . A A . 14 ASP OD1 1 1 13 3852 1 1 14 ASP OD2 O -13.941 -7.146 1.243 1.00 . A A . 14 ASP OD2 1 1 13 3853 1 1 15 PHE C C -9.295 -3.705 1.136 1.00 . A A . 15 PHE C 1 1 13 3854 1 1 15 PHE CA C -10.374 -4.447 1.918 1.00 . A A . 15 PHE CA 1 1 13 3855 1 1 15 PHE CB C -10.014 -5.931 2.023 1.00 . A A . 15 PHE CB 1 1 13 3856 1 1 15 PHE CD1 C -10.650 -6.165 4.439 1.00 . A A . 15 PHE CD1 1 1 13 3857 1 1 15 PHE CD2 C -11.461 -7.787 2.892 1.00 . A A . 15 PHE CD2 1 1 13 3858 1 1 15 PHE CE1 C -11.300 -6.818 5.469 1.00 . A A . 15 PHE CE1 1 1 13 3859 1 1 15 PHE CE2 C -12.114 -8.445 3.918 1.00 . A A . 15 PHE CE2 1 1 13 3860 1 1 15 PHE CG C -10.722 -6.642 3.140 1.00 . A A . 15 PHE CG 1 1 13 3861 1 1 15 PHE CZ C -12.034 -7.958 5.208 1.00 . A A . 15 PHE CZ 1 1 13 3862 1 1 15 PHE H H -11.826 -4.660 0.393 1.00 . A A . 15 PHE H 1 1 13 3863 1 1 15 PHE HA H -10.433 -4.029 2.911 1.00 . A A . 15 PHE HA 1 1 13 3864 1 1 15 PHE HB2 H -10.276 -6.423 1.099 1.00 . A A . 15 PHE HB2 1 1 13 3865 1 1 15 PHE HB3 H -8.952 -6.025 2.188 1.00 . A A . 15 PHE HB3 1 1 13 3866 1 1 15 PHE HD1 H -10.077 -5.272 4.645 1.00 . A A . 15 PHE HD1 1 1 13 3867 1 1 15 PHE HD2 H -11.525 -8.169 1.882 1.00 . A A . 15 PHE HD2 1 1 13 3868 1 1 15 PHE HE1 H -11.236 -6.435 6.477 1.00 . A A . 15 PHE HE1 1 1 13 3869 1 1 15 PHE HE2 H -12.687 -9.336 3.710 1.00 . A A . 15 PHE HE2 1 1 13 3870 1 1 15 PHE HZ H -12.542 -8.470 6.011 1.00 . A A . 15 PHE HZ 1 1 13 3871 1 1 15 PHE N N -11.678 -4.286 1.287 1.00 . A A . 15 PHE N 1 1 13 3872 1 1 15 PHE O O -9.464 -3.366 -0.036 1.00 . A A . 15 PHE O 1 1 13 3873 1 1 16 PRO C C -6.306 -3.472 0.183 1.00 . A A . 16 PRO C 1 1 13 3874 1 1 16 PRO CA C -7.129 -2.561 1.060 1.00 . A A . 16 PRO CA 1 1 13 3875 1 1 16 PRO CB C -6.320 -1.974 2.244 1.00 . A A . 16 PRO CB 1 1 13 3876 1 1 16 PRO CD C -7.941 -3.499 3.207 1.00 . A A . 16 PRO CD 1 1 13 3877 1 1 16 PRO CG C -6.477 -3.037 3.350 1.00 . A A . 16 PRO CG 1 1 13 3878 1 1 16 PRO HA H -7.561 -1.745 0.456 1.00 . A A . 16 PRO HA 1 1 13 3879 1 1 16 PRO HB2 H -5.269 -1.749 2.001 1.00 . A A . 16 PRO HB2 1 1 13 3880 1 1 16 PRO HB3 H -6.809 -1.053 2.596 1.00 . A A . 16 PRO HB3 1 1 13 3881 1 1 16 PRO HD2 H -8.034 -4.522 3.591 1.00 . A A . 16 PRO HD2 1 1 13 3882 1 1 16 PRO HD3 H -8.597 -2.819 3.773 1.00 . A A . 16 PRO HD3 1 1 13 3883 1 1 16 PRO HG2 H -5.790 -3.875 3.142 1.00 . A A . 16 PRO HG2 1 1 13 3884 1 1 16 PRO HG3 H -6.296 -2.648 4.363 1.00 . A A . 16 PRO HG3 1 1 13 3885 1 1 16 PRO N N -8.152 -3.317 1.774 1.00 . A A . 16 PRO N 1 1 13 3886 1 1 16 PRO O O -6.517 -4.674 0.220 1.00 . A A . 16 PRO O 1 1 13 3887 1 1 17 ILE C C -3.283 -4.042 -1.117 1.00 . A A . 17 ILE C 1 1 13 3888 1 1 17 ILE CA C -4.663 -3.685 -1.630 1.00 . A A . 17 ILE CA 1 1 13 3889 1 1 17 ILE CB C -4.561 -2.932 -2.996 1.00 . A A . 17 ILE CB 1 1 13 3890 1 1 17 ILE CD1 C -6.975 -1.896 -2.930 1.00 . A A . 17 ILE CD1 1 1 13 3891 1 1 17 ILE CG1 C -5.939 -2.751 -3.708 1.00 . A A . 17 ILE CG1 1 1 13 3892 1 1 17 ILE CG2 C -3.592 -3.677 -3.963 1.00 . A A . 17 ILE CG2 1 1 13 3893 1 1 17 ILE H H -5.201 -1.914 -0.575 1.00 . A A . 17 ILE H 1 1 13 3894 1 1 17 ILE HA H -5.201 -4.623 -1.848 1.00 . A A . 17 ILE HA 1 1 13 3895 1 1 17 ILE HB H -4.138 -1.930 -2.821 1.00 . A A . 17 ILE HB 1 1 13 3896 1 1 17 ILE HD11 H -7.373 -2.445 -2.066 1.00 . A A . 17 ILE HD11 1 1 13 3897 1 1 17 ILE HD12 H -6.522 -0.953 -2.587 1.00 . A A . 17 ILE HD12 1 1 13 3898 1 1 17 ILE HD13 H -7.828 -1.651 -3.582 1.00 . A A . 17 ILE HD13 1 1 13 3899 1 1 17 ILE HG12 H -5.764 -2.240 -4.670 1.00 . A A . 17 ILE HG12 1 1 13 3900 1 1 17 ILE HG13 H -6.381 -3.737 -3.927 1.00 . A A . 17 ILE HG13 1 1 13 3901 1 1 17 ILE HG21 H -3.946 -4.704 -4.139 1.00 . A A . 17 ILE HG21 1 1 13 3902 1 1 17 ILE HG22 H -3.532 -3.160 -4.934 1.00 . A A . 17 ILE HG22 1 1 13 3903 1 1 17 ILE HG23 H -2.570 -3.725 -3.558 1.00 . A A . 17 ILE HG23 1 1 13 3904 1 1 17 ILE N N -5.384 -2.898 -0.628 1.00 . A A . 17 ILE N 1 1 13 3905 1 1 17 ILE O O -2.985 -5.221 -1.009 1.00 . A A . 17 ILE O 1 1 13 3906 1 1 18 SER C C -0.715 -3.126 0.916 1.00 . A A . 18 SER C 1 1 13 3907 1 1 18 SER CA C -1.005 -3.302 -0.554 1.00 . A A . 18 SER CA 1 1 13 3908 1 1 18 SER CB C -0.200 -2.302 -1.421 1.00 . A A . 18 SER CB 1 1 13 3909 1 1 18 SER H H -2.712 -2.080 -0.848 1.00 . A A . 18 SER H 1 1 13 3910 1 1 18 SER HA H -0.706 -4.324 -0.838 1.00 . A A . 18 SER HA 1 1 13 3911 1 1 18 SER HB2 H 0.883 -2.415 -1.261 1.00 . A A . 18 SER HB2 1 1 13 3912 1 1 18 SER HB3 H -0.419 -2.503 -2.483 1.00 . A A . 18 SER HB3 1 1 13 3913 1 1 18 SER HG H -0.246 -0.311 -1.629 1.00 . A A . 18 SER HG 1 1 13 3914 1 1 18 SER N N -2.419 -3.038 -0.835 1.00 . A A . 18 SER N 1 1 13 3915 1 1 18 SER O O -1.635 -2.773 1.639 1.00 . A A . 18 SER O 1 1 13 3916 1 1 18 SER OG O -0.636 -0.977 -1.074 1.00 . A A . 18 SER OG 1 1 13 3917 1 1 19 PHE C C 2.136 -2.686 3.124 1.00 . A A . 19 PHE C 1 1 13 3918 1 1 19 PHE CA C 0.825 -3.367 2.808 1.00 . A A . 19 PHE CA 1 1 13 3919 1 1 19 PHE CB C 0.698 -4.816 3.347 1.00 . A A . 19 PHE CB 1 1 13 3920 1 1 19 PHE CD1 C -1.784 -5.388 3.187 1.00 . A A . 19 PHE CD1 1 1 13 3921 1 1 19 PHE CD2 C -0.275 -6.337 1.556 1.00 . A A . 19 PHE CD2 1 1 13 3922 1 1 19 PHE CE1 C -2.862 -6.002 2.543 1.00 . A A . 19 PHE CE1 1 1 13 3923 1 1 19 PHE CE2 C -1.348 -6.974 0.927 1.00 . A A . 19 PHE CE2 1 1 13 3924 1 1 19 PHE CG C -0.487 -5.532 2.683 1.00 . A A . 19 PHE CG 1 1 13 3925 1 1 19 PHE CZ C -2.644 -6.803 1.417 1.00 . A A . 19 PHE CZ 1 1 13 3926 1 1 19 PHE H H 1.275 -3.681 0.765 1.00 . A A . 19 PHE H 1 1 13 3927 1 1 19 PHE HA H 0.100 -2.727 3.319 1.00 . A A . 19 PHE HA 1 1 13 3928 1 1 19 PHE HB2 H 1.616 -5.354 3.089 1.00 . A A . 19 PHE HB2 1 1 13 3929 1 1 19 PHE HB3 H 0.579 -4.847 4.442 1.00 . A A . 19 PHE HB3 1 1 13 3930 1 1 19 PHE HD1 H -1.960 -4.797 4.079 1.00 . A A . 19 PHE HD1 1 1 13 3931 1 1 19 PHE HD2 H 0.725 -6.471 1.159 1.00 . A A . 19 PHE HD2 1 1 13 3932 1 1 19 PHE HE1 H -3.872 -5.860 2.917 1.00 . A A . 19 PHE HE1 1 1 13 3933 1 1 19 PHE HE2 H -1.171 -7.600 0.058 1.00 . A A . 19 PHE HE2 1 1 13 3934 1 1 19 PHE HZ H -3.479 -7.290 0.925 1.00 . A A . 19 PHE HZ 1 1 13 3935 1 1 19 PHE N N 0.538 -3.385 1.374 1.00 . A A . 19 PHE N 1 1 13 3936 1 1 19 PHE O O 2.777 -2.196 2.211 1.00 . A A . 19 PHE O 1 1 13 3937 1 1 20 TYR C C 4.955 -2.311 4.307 1.00 . A A . 20 TYR C 1 1 13 3938 1 1 20 TYR CA C 3.647 -1.743 4.811 1.00 . A A . 20 TYR CA 1 1 13 3939 1 1 20 TYR CB C 3.673 -1.522 6.358 1.00 . A A . 20 TYR CB 1 1 13 3940 1 1 20 TYR CD1 C 3.098 0.940 6.504 1.00 . A A . 20 TYR CD1 1 1 13 3941 1 1 20 TYR CD2 C 5.246 0.247 7.353 1.00 . A A . 20 TYR CD2 1 1 13 3942 1 1 20 TYR CE1 C 3.406 2.273 6.789 1.00 . A A . 20 TYR CE1 1 1 13 3943 1 1 20 TYR CE2 C 5.551 1.578 7.651 1.00 . A A . 20 TYR CE2 1 1 13 3944 1 1 20 TYR CG C 4.026 -0.077 6.748 1.00 . A A . 20 TYR CG 1 1 13 3945 1 1 20 TYR CZ C 4.641 2.599 7.363 1.00 . A A . 20 TYR CZ 1 1 13 3946 1 1 20 TYR H H 2.009 -3.082 5.126 1.00 . A A . 20 TYR H 1 1 13 3947 1 1 20 TYR HA H 3.506 -0.768 4.318 1.00 . A A . 20 TYR HA 1 1 13 3948 1 1 20 TYR HB2 H 2.673 -1.668 6.790 1.00 . A A . 20 TYR HB2 1 1 13 3949 1 1 20 TYR HB3 H 4.338 -2.255 6.839 1.00 . A A . 20 TYR HB3 1 1 13 3950 1 1 20 TYR HD1 H 2.124 0.696 6.092 1.00 . A A . 20 TYR HD1 1 1 13 3951 1 1 20 TYR HD2 H 5.961 -0.533 7.594 1.00 . A A . 20 TYR HD2 1 1 13 3952 1 1 20 TYR HE1 H 2.680 3.047 6.562 1.00 . A A . 20 TYR HE1 1 1 13 3953 1 1 20 TYR HE2 H 6.503 1.824 8.110 1.00 . A A . 20 TYR HE2 1 1 13 3954 1 1 20 TYR HH H 4.314 4.560 7.429 1.00 . A A . 20 TYR HH 1 1 13 3955 1 1 20 TYR N N 2.525 -2.602 4.418 1.00 . A A . 20 TYR N 1 1 13 3956 1 1 20 TYR O O 4.943 -3.352 3.670 1.00 . A A . 20 TYR O 1 1 13 3957 1 1 20 TYR OH O 4.983 3.923 7.655 1.00 . A A . 20 TYR OH 1 1 13 3958 1 1 21 GLY C C 7.683 -1.852 2.748 1.00 . A A . 21 GLY C 1 1 13 3959 1 1 21 GLY CA C 7.393 -2.204 4.182 1.00 . A A . 21 GLY CA 1 1 13 3960 1 1 21 GLY H H 6.096 -0.757 5.034 1.00 . A A . 21 GLY H 1 1 13 3961 1 1 21 GLY HA2 H 8.192 -1.783 4.814 1.00 . A A . 21 GLY HA2 1 1 13 3962 1 1 21 GLY HA3 H 7.403 -3.296 4.326 1.00 . A A . 21 GLY HA3 1 1 13 3963 1 1 21 GLY N N 6.102 -1.648 4.581 1.00 . A A . 21 GLY N 1 1 13 3964 1 1 21 GLY O O 7.172 -0.800 2.279 1.00 . A A . 21 GLY O 1 1 13 3965 1 1 21 GLY OXT O 8.432 -2.613 2.077 1.00 . A A . 21 GLY OXT 1 1 14 3966 1 1 1 GLY C C 3.644 -1.260 -0.738 1.00 . A A . 1 GLY C 1 1 14 3967 1 1 1 GLY CA C 2.881 0.038 -0.624 1.00 . A A . 1 GLY CA 1 1 14 3968 1 1 1 GLY H1 H 1.283 -0.579 0.635 1.00 . A A . 1 GLY H1 1 1 14 3969 1 1 1 GLY HA2 H 2.224 0.160 -1.498 1.00 . A A . 1 GLY HA2 1 1 14 3970 1 1 1 GLY HA3 H 3.613 0.860 -0.656 1.00 . A A . 1 GLY HA3 1 1 14 3971 1 1 1 GLY N N 2.059 0.053 0.588 1.00 . A A . 1 GLY N 1 1 14 3972 1 1 1 GLY O O 3.548 -1.921 -1.760 1.00 . A A . 1 GLY O 1 1 14 3973 1 1 2 GLY C C 4.324 -4.095 0.373 1.00 . A A . 2 GLY C 1 1 14 3974 1 1 2 GLY CA C 5.200 -2.872 0.235 1.00 . A A . 2 GLY CA 1 1 14 3975 1 1 2 GLY H H 4.467 -1.085 1.140 1.00 . A A . 2 GLY H 1 1 14 3976 1 1 2 GLY HA2 H 5.745 -2.930 -0.720 1.00 . A A . 2 GLY HA2 1 1 14 3977 1 1 2 GLY HA3 H 5.945 -2.878 1.044 1.00 . A A . 2 GLY HA3 1 1 14 3978 1 1 2 GLY N N 4.423 -1.636 0.302 1.00 . A A . 2 GLY N 1 1 14 3979 1 1 2 GLY O O 3.123 -3.983 0.186 1.00 . A A . 2 GLY O 1 1 14 3980 1 1 3 ALA C C 4.179 -6.912 2.332 1.00 . A A . 3 ALA C 1 1 14 3981 1 1 3 ALA CA C 4.147 -6.497 0.878 1.00 . A A . 3 ALA CA 1 1 14 3982 1 1 3 ALA CB C 4.728 -7.595 -0.051 1.00 . A A . 3 ALA CB 1 1 14 3983 1 1 3 ALA H H 5.913 -5.321 0.839 1.00 . A A . 3 ALA H 1 1 14 3984 1 1 3 ALA HA H 3.088 -6.370 0.605 1.00 . A A . 3 ALA HA 1 1 14 3985 1 1 3 ALA HB1 H 4.716 -7.248 -1.096 1.00 . A A . 3 ALA HB1 1 1 14 3986 1 1 3 ALA HB2 H 5.768 -7.821 0.232 1.00 . A A . 3 ALA HB2 1 1 14 3987 1 1 3 ALA HB3 H 4.132 -8.518 0.021 1.00 . A A . 3 ALA HB3 1 1 14 3988 1 1 3 ALA N N 4.922 -5.268 0.697 1.00 . A A . 3 ALA N 1 1 14 3989 1 1 3 ALA O O 4.284 -8.096 2.616 1.00 . A A . 3 ALA O 1 1 14 3990 1 1 4 GLY C C 2.782 -6.806 5.200 1.00 . A A . 4 GLY C 1 1 14 3991 1 1 4 GLY CA C 4.115 -6.286 4.695 1.00 . A A . 4 GLY CA 1 1 14 3992 1 1 4 GLY H H 3.998 -4.978 3.024 1.00 . A A . 4 GLY H 1 1 14 3993 1 1 4 GLY HA2 H 4.871 -7.065 4.883 1.00 . A A . 4 GLY HA2 1 1 14 3994 1 1 4 GLY HA3 H 4.433 -5.397 5.262 1.00 . A A . 4 GLY HA3 1 1 14 3995 1 1 4 GLY N N 4.087 -5.945 3.275 1.00 . A A . 4 GLY N 1 1 14 3996 1 1 4 GLY O O 2.109 -7.504 4.458 1.00 . A A . 4 GLY O 1 1 14 3997 1 1 5 HIS C C 0.218 -6.058 7.459 1.00 . A A . 5 HIS C 1 1 14 3998 1 1 5 HIS CA C 1.290 -7.100 7.158 1.00 . A A . 5 HIS CA 1 1 14 3999 1 1 5 HIS CB C 1.746 -7.769 8.455 1.00 . A A . 5 HIS CB 1 1 14 4000 1 1 5 HIS CD2 C 1.981 -10.333 8.139 1.00 . A A . 5 HIS CD2 1 1 14 4001 1 1 5 HIS CE1 C 4.161 -10.432 7.929 1.00 . A A . 5 HIS CE1 1 1 14 4002 1 1 5 HIS CG C 2.457 -9.070 8.240 1.00 . A A . 5 HIS CG 1 1 14 4003 1 1 5 HIS H H 3.042 -5.925 6.981 1.00 . A A . 5 HIS H 1 1 14 4004 1 1 5 HIS HA H 0.872 -7.850 6.504 1.00 . A A . 5 HIS HA 1 1 14 4005 1 1 5 HIS HB2 H 2.420 -7.106 8.977 1.00 . A A . 5 HIS HB2 1 1 14 4006 1 1 5 HIS HB3 H 0.883 -7.960 9.076 1.00 . A A . 5 HIS HB3 1 1 14 4007 1 1 5 HIS HD1 H 4.457 -8.418 8.133 1.00 . A A . 5 HIS HD1 1 1 14 4008 1 1 5 HIS HD2 H 0.944 -10.635 8.199 1.00 . A A . 5 HIS HD2 1 1 14 4009 1 1 5 HIS HE1 H 5.164 -10.808 7.794 1.00 . A A . 5 HIS HE1 1 1 14 4010 1 1 5 HIS N N 2.427 -6.494 6.474 1.00 . A A . 5 HIS N 1 1 14 4011 1 1 5 HIS ND1 N 3.826 -9.166 8.105 1.00 . A A . 5 HIS ND1 1 1 14 4012 1 1 5 HIS NE2 N 3.059 -11.161 7.946 1.00 . A A . 5 HIS NE2 1 1 14 4013 1 1 5 HIS O O -0.946 -6.394 7.675 1.00 . A A . 5 HIS O 1 1 14 4014 1 1 6 VAL C C -0.723 -2.872 6.770 1.00 . A A . 6 VAL C 1 1 14 4015 1 1 6 VAL CA C -0.396 -3.717 7.982 1.00 . A A . 6 VAL CA 1 1 14 4016 1 1 6 VAL CB C 0.278 -2.864 9.101 1.00 . A A . 6 VAL CB 1 1 14 4017 1 1 6 VAL CG1 C -0.648 -1.734 9.629 1.00 . A A . 6 VAL CG1 1 1 14 4018 1 1 6 VAL CG2 C 0.728 -3.775 10.278 1.00 . A A . 6 VAL CG2 1 1 14 4019 1 1 6 VAL H H 1.468 -4.400 7.316 1.00 . A A . 6 VAL H 1 1 14 4020 1 1 6 VAL HA H -1.296 -4.172 8.420 1.00 . A A . 6 VAL HA 1 1 14 4021 1 1 6 VAL HB H 1.178 -2.382 8.683 1.00 . A A . 6 VAL HB 1 1 14 4022 1 1 6 VAL HG11 H -0.988 -1.088 8.804 1.00 . A A . 6 VAL HG11 1 1 14 4023 1 1 6 VAL HG12 H -1.525 -2.160 10.139 1.00 . A A . 6 VAL HG12 1 1 14 4024 1 1 6 VAL HG13 H -0.104 -1.106 10.352 1.00 . A A . 6 VAL HG13 1 1 14 4025 1 1 6 VAL HG21 H 1.214 -3.174 11.063 1.00 . A A . 6 VAL HG21 1 1 14 4026 1 1 6 VAL HG22 H -0.140 -4.289 10.718 1.00 . A A . 6 VAL HG22 1 1 14 4027 1 1 6 VAL HG23 H 1.448 -4.536 9.938 1.00 . A A . 6 VAL HG23 1 1 14 4028 1 1 6 VAL N N 0.557 -4.742 7.537 1.00 . A A . 6 VAL N 1 1 14 4029 1 1 6 VAL O O 0.223 -2.569 6.061 1.00 . A A . 6 VAL O 1 1 14 4030 1 1 7 PRO C C -1.629 -0.353 5.219 1.00 . A A . 7 PRO C 1 1 14 4031 1 1 7 PRO CA C -2.203 -1.749 5.203 1.00 . A A . 7 PRO CA 1 1 14 4032 1 1 7 PRO CB C -3.743 -1.776 5.124 1.00 . A A . 7 PRO CB 1 1 14 4033 1 1 7 PRO CD C -3.151 -2.783 7.251 1.00 . A A . 7 PRO CD 1 1 14 4034 1 1 7 PRO CG C -4.175 -1.821 6.605 1.00 . A A . 7 PRO CG 1 1 14 4035 1 1 7 PRO HA H -1.812 -2.325 4.357 1.00 . A A . 7 PRO HA 1 1 14 4036 1 1 7 PRO HB2 H -4.171 -0.932 4.558 1.00 . A A . 7 PRO HB2 1 1 14 4037 1 1 7 PRO HB3 H -4.039 -2.725 4.650 1.00 . A A . 7 PRO HB3 1 1 14 4038 1 1 7 PRO HD2 H -3.058 -2.573 8.326 1.00 . A A . 7 PRO HD2 1 1 14 4039 1 1 7 PRO HD3 H -3.440 -3.834 7.089 1.00 . A A . 7 PRO HD3 1 1 14 4040 1 1 7 PRO HG2 H -4.057 -0.812 7.034 1.00 . A A . 7 PRO HG2 1 1 14 4041 1 1 7 PRO HG3 H -5.214 -2.158 6.741 1.00 . A A . 7 PRO HG3 1 1 14 4042 1 1 7 PRO N N -1.979 -2.466 6.449 1.00 . A A . 7 PRO N 1 1 14 4043 1 1 7 PRO O O -1.515 0.227 6.286 1.00 . A A . 7 PRO O 1 1 14 4044 1 1 8 GLU C C -1.860 2.540 3.888 1.00 . A A . 8 GLU C 1 1 14 4045 1 1 8 GLU CA C -0.725 1.542 3.943 1.00 . A A . 8 GLU CA 1 1 14 4046 1 1 8 GLU CB C 0.186 1.692 2.690 1.00 . A A . 8 GLU CB 1 1 14 4047 1 1 8 GLU CD C 2.350 0.880 1.621 1.00 . A A . 8 GLU CD 1 1 14 4048 1 1 8 GLU CG C 1.475 0.845 2.851 1.00 . A A . 8 GLU CG 1 1 14 4049 1 1 8 GLU H H -1.389 -0.331 3.178 1.00 . A A . 8 GLU H 1 1 14 4050 1 1 8 GLU HA H -0.112 1.761 4.834 1.00 . A A . 8 GLU HA 1 1 14 4051 1 1 8 GLU HB2 H -0.357 1.375 1.785 1.00 . A A . 8 GLU HB2 1 1 14 4052 1 1 8 GLU HB3 H 0.473 2.749 2.563 1.00 . A A . 8 GLU HB3 1 1 14 4053 1 1 8 GLU HG2 H 2.056 1.235 3.701 1.00 . A A . 8 GLU HG2 1 1 14 4054 1 1 8 GLU HG3 H 1.201 -0.195 3.081 1.00 . A A . 8 GLU HG3 1 1 14 4055 1 1 8 GLU N N -1.263 0.184 4.029 1.00 . A A . 8 GLU N 1 1 14 4056 1 1 8 GLU O O -1.765 3.572 4.534 1.00 . A A . 8 GLU O 1 1 14 4057 1 1 8 GLU OE1 O 3.291 1.658 1.609 1.00 . A A . 8 GLU OE1 1 1 14 4058 1 1 9 TYR C C -5.343 2.415 2.861 1.00 . A A . 9 TYR C 1 1 14 4059 1 1 9 TYR CA C -4.055 3.190 3.004 1.00 . A A . 9 TYR CA 1 1 14 4060 1 1 9 TYR CB C -3.801 4.085 1.762 1.00 . A A . 9 TYR CB 1 1 14 4061 1 1 9 TYR CD1 C -4.406 2.499 -0.142 1.00 . A A . 9 TYR CD1 1 1 14 4062 1 1 9 TYR CD2 C -2.086 3.090 0.166 1.00 . A A . 9 TYR CD2 1 1 14 4063 1 1 9 TYR CE1 C -4.051 1.642 -1.188 1.00 . A A . 9 TYR CE1 1 1 14 4064 1 1 9 TYR CE2 C -1.733 2.254 -0.897 1.00 . A A . 9 TYR CE2 1 1 14 4065 1 1 9 TYR CG C -3.423 3.204 0.562 1.00 . A A . 9 TYR CG 1 1 14 4066 1 1 9 TYR CZ C -2.708 1.512 -1.568 1.00 . A A . 9 TYR CZ 1 1 14 4067 1 1 9 TYR H H -2.986 1.407 2.587 1.00 . A A . 9 TYR H 1 1 14 4068 1 1 9 TYR HA H -4.162 3.813 3.907 1.00 . A A . 9 TYR HA 1 1 14 4069 1 1 9 TYR HB2 H -4.683 4.693 1.511 1.00 . A A . 9 TYR HB2 1 1 14 4070 1 1 9 TYR HB3 H -2.978 4.780 1.994 1.00 . A A . 9 TYR HB3 1 1 14 4071 1 1 9 TYR HD1 H -5.452 2.613 0.122 1.00 . A A . 9 TYR HD1 1 1 14 4072 1 1 9 TYR HD2 H -1.310 3.647 0.681 1.00 . A A . 9 TYR HD2 1 1 14 4073 1 1 9 TYR HE1 H -4.826 1.079 -1.700 1.00 . A A . 9 TYR HE1 1 1 14 4074 1 1 9 TYR HE2 H -0.694 2.182 -1.201 1.00 . A A . 9 TYR HE2 1 1 14 4075 1 1 9 TYR HH H -3.044 0.218 -3.041 1.00 . A A . 9 TYR HH 1 1 14 4076 1 1 9 TYR N N -2.939 2.250 3.125 1.00 . A A . 9 TYR N 1 1 14 4077 1 1 9 TYR O O -5.263 1.201 2.750 1.00 . A A . 9 TYR O 1 1 14 4078 1 1 9 TYR OH O -2.323 0.659 -2.607 1.00 . A A . 9 TYR OH 1 1 14 4079 1 1 10 PHE C C -8.627 3.022 1.614 1.00 . A A . 10 PHE C 1 1 14 4080 1 1 10 PHE CA C -7.793 2.393 2.710 1.00 . A A . 10 PHE CA 1 1 14 4081 1 1 10 PHE CB C -8.602 2.445 4.027 1.00 . A A . 10 PHE CB 1 1 14 4082 1 1 10 PHE CD1 C -6.941 2.261 5.949 1.00 . A A . 10 PHE CD1 1 1 14 4083 1 1 10 PHE CD2 C -8.172 0.287 5.296 1.00 . A A . 10 PHE CD2 1 1 14 4084 1 1 10 PHE CE1 C -6.377 1.557 7.016 1.00 . A A . 10 PHE CE1 1 1 14 4085 1 1 10 PHE CE2 C -7.613 -0.419 6.365 1.00 . A A . 10 PHE CE2 1 1 14 4086 1 1 10 PHE CG C -7.883 1.644 5.118 1.00 . A A . 10 PHE CG 1 1 14 4087 1 1 10 PHE CZ C -6.745 0.229 7.248 1.00 . A A . 10 PHE CZ 1 1 14 4088 1 1 10 PHE H H -6.549 4.085 2.981 1.00 . A A . 10 PHE H 1 1 14 4089 1 1 10 PHE HA H -7.624 1.332 2.474 1.00 . A A . 10 PHE HA 1 1 14 4090 1 1 10 PHE HB2 H -8.729 3.492 4.345 1.00 . A A . 10 PHE HB2 1 1 14 4091 1 1 10 PHE HB3 H -9.607 2.023 3.867 1.00 . A A . 10 PHE HB3 1 1 14 4092 1 1 10 PHE HD1 H -6.648 3.291 5.771 1.00 . A A . 10 PHE HD1 1 1 14 4093 1 1 10 PHE HD2 H -8.837 -0.224 4.608 1.00 . A A . 10 PHE HD2 1 1 14 4094 1 1 10 PHE HE1 H -5.655 2.041 7.666 1.00 . A A . 10 PHE HE1 1 1 14 4095 1 1 10 PHE HE2 H -7.855 -1.467 6.509 1.00 . A A . 10 PHE HE2 1 1 14 4096 1 1 10 PHE HZ H -6.357 -0.298 8.114 1.00 . A A . 10 PHE HZ 1 1 14 4097 1 1 10 PHE N N -6.518 3.092 2.862 1.00 . A A . 10 PHE N 1 1 14 4098 1 1 10 PHE O O -8.583 4.234 1.481 1.00 . A A . 10 PHE O 1 1 14 4099 1 1 11 VAL C C -11.732 2.621 0.239 1.00 . A A . 11 VAL C 1 1 14 4100 1 1 11 VAL CA C -10.274 2.694 -0.200 1.00 . A A . 11 VAL CA 1 1 14 4101 1 1 11 VAL CB C -10.101 1.896 -1.506 1.00 . A A . 11 VAL CB 1 1 14 4102 1 1 11 VAL CG1 C -10.894 2.540 -2.633 1.00 . A A . 11 VAL CG1 1 1 14 4103 1 1 11 VAL CG2 C -8.629 1.788 -1.873 1.00 . A A . 11 VAL CG2 1 1 14 4104 1 1 11 VAL H H -9.321 1.234 1.000 1.00 . A A . 11 VAL H 1 1 14 4105 1 1 11 VAL HA H -10.017 3.725 -0.395 1.00 . A A . 11 VAL HA 1 1 14 4106 1 1 11 VAL HB H -10.486 0.899 -1.349 1.00 . A A . 11 VAL HB 1 1 14 4107 1 1 11 VAL HG11 H -10.482 2.234 -3.584 1.00 . A A . 11 VAL HG11 1 1 14 4108 1 1 11 VAL HG12 H -11.927 2.229 -2.571 1.00 . A A . 11 VAL HG12 1 1 14 4109 1 1 11 VAL HG13 H -10.835 3.615 -2.546 1.00 . A A . 11 VAL HG13 1 1 14 4110 1 1 11 VAL HG21 H -8.191 0.946 -1.358 1.00 . A A . 11 VAL HG21 1 1 14 4111 1 1 11 VAL HG22 H -8.533 1.646 -2.940 1.00 . A A . 11 VAL HG22 1 1 14 4112 1 1 11 VAL HG23 H -8.118 2.693 -1.584 1.00 . A A . 11 VAL HG23 1 1 14 4113 1 1 11 VAL N N -9.385 2.199 0.846 1.00 . A A . 11 VAL N 1 1 14 4114 1 1 11 VAL O O -12.065 1.947 1.214 1.00 . A A . 11 VAL O 1 1 14 4115 1 1 12 ARG C C -14.695 2.045 -0.639 1.00 . A A . 12 ARG C 1 1 14 4116 1 1 12 ARG CA C -14.022 3.334 -0.175 1.00 . A A . 12 ARG CA 1 1 14 4117 1 1 12 ARG CB C -14.697 4.539 -0.831 1.00 . A A . 12 ARG CB 1 1 14 4118 1 1 12 ARG CD C -14.901 7.040 -0.981 1.00 . A A . 12 ARG CD 1 1 14 4119 1 1 12 ARG CG C -14.289 5.872 -0.224 1.00 . A A . 12 ARG CG 1 1 14 4120 1 1 12 ARG CZ C -16.825 7.722 0.390 1.00 . A A . 12 ARG CZ 1 1 14 4121 1 1 12 ARG H H -12.272 3.836 -1.255 1.00 . A A . 12 ARG H 1 1 14 4122 1 1 12 ARG HA H -14.124 3.414 0.897 1.00 . A A . 12 ARG HA 1 1 14 4123 1 1 12 ARG HB2 H -14.442 4.554 -1.880 1.00 . A A . 12 ARG HB2 1 1 14 4124 1 1 12 ARG HB3 H -15.767 4.436 -0.731 1.00 . A A . 12 ARG HB3 1 1 14 4125 1 1 12 ARG HD2 H -14.113 7.579 -1.484 1.00 . A A . 12 ARG HD2 1 1 14 4126 1 1 12 ARG HD3 H -15.596 6.653 -1.712 1.00 . A A . 12 ARG HD3 1 1 14 4127 1 1 12 ARG HE H -15.156 8.789 0.156 1.00 . A A . 12 ARG HE 1 1 14 4128 1 1 12 ARG HG2 H -14.624 5.907 0.802 1.00 . A A . 12 ARG HG2 1 1 14 4129 1 1 12 ARG HG3 H -13.213 5.957 -0.256 1.00 . A A . 12 ARG HG3 1 1 14 4130 1 1 12 ARG HH11 H -17.029 5.937 -0.533 1.00 . A A . 12 ARG HH11 1 1 14 4131 1 1 12 ARG HH12 H -18.378 6.430 0.437 1.00 . A A . 12 ARG HH12 1 1 14 4132 1 1 12 ARG HH21 H -16.924 9.449 1.436 1.00 . A A . 12 ARG HH21 1 1 14 4133 1 1 12 ARG HH22 H -18.317 8.428 1.556 1.00 . A A . 12 ARG HH22 1 1 14 4134 1 1 12 ARG N N -12.598 3.319 -0.489 1.00 . A A . 12 ARG N 1 1 14 4135 1 1 12 ARG NE N -15.609 7.957 -0.092 1.00 . A A . 12 ARG NE 1 1 14 4136 1 1 12 ARG NH1 N -17.463 6.605 0.071 1.00 . A A . 12 ARG NH1 1 1 14 4137 1 1 12 ARG NH2 N -17.403 8.606 1.194 1.00 . A A . 12 ARG NH2 1 1 14 4138 1 1 12 ARG O O -15.894 2.022 -0.909 1.00 . A A . 12 ARG O 1 1 14 4139 1 1 13 GLY C C -14.662 -1.263 -0.006 1.00 . A A . 13 GLY C 1 1 14 4140 1 1 13 GLY CA C -14.449 -0.303 -1.160 1.00 . A A . 13 GLY CA 1 1 14 4141 1 1 13 GLY H H -12.962 1.052 -0.499 1.00 . A A . 13 GLY H 1 1 14 4142 1 1 13 GLY HA2 H -15.395 -0.135 -1.653 1.00 . A A . 13 GLY HA2 1 1 14 4143 1 1 13 GLY HA3 H -13.762 -0.751 -1.863 1.00 . A A . 13 GLY HA3 1 1 14 4144 1 1 13 GLY N N -13.912 0.974 -0.728 1.00 . A A . 13 GLY N 1 1 14 4145 1 1 13 GLY O O -15.484 -1.012 0.876 1.00 . A A . 13 GLY O 1 1 14 4146 1 1 14 ASP C C -12.726 -3.481 1.824 1.00 . A A . 14 ASP C 1 1 14 4147 1 1 14 ASP CA C -14.032 -3.366 1.043 1.00 . A A . 14 ASP CA 1 1 14 4148 1 1 14 ASP CB C -14.406 -4.725 0.448 1.00 . A A . 14 ASP CB 1 1 14 4149 1 1 14 ASP CG C -14.441 -5.824 1.492 1.00 . A A . 14 ASP CG 1 1 14 4150 1 1 14 ASP H H -13.282 -2.508 -0.741 1.00 . A A . 14 ASP H 1 1 14 4151 1 1 14 ASP HA H -14.813 -3.052 1.718 1.00 . A A . 14 ASP HA 1 1 14 4152 1 1 14 ASP HB2 H -15.383 -4.655 -0.006 1.00 . A A . 14 ASP HB2 1 1 14 4153 1 1 14 ASP HB3 H -13.680 -4.992 -0.306 1.00 . A A . 14 ASP HB3 1 1 14 4154 1 1 14 ASP N N -13.920 -2.365 -0.011 1.00 . A A . 14 ASP N 1 1 14 4155 1 1 14 ASP O O -12.617 -2.988 2.947 1.00 . A A . 14 ASP O 1 1 14 4156 1 1 14 ASP OD1 O -14.866 -5.546 2.633 1.00 . A A . 14 ASP OD1 1 1 14 4157 1 1 14 ASP OD2 O -14.043 -6.962 1.167 1.00 . A A . 14 ASP OD2 1 1 14 4158 1 1 15 PHE C C -9.347 -3.585 1.090 1.00 . A A . 15 PHE C 1 1 14 4159 1 1 15 PHE CA C -10.441 -4.317 1.862 1.00 . A A . 15 PHE CA 1 1 14 4160 1 1 15 PHE CB C -10.101 -5.806 1.961 1.00 . A A . 15 PHE CB 1 1 14 4161 1 1 15 PHE CD1 C -10.737 -6.060 4.375 1.00 . A A . 15 PHE CD1 1 1 14 4162 1 1 15 PHE CD2 C -11.601 -7.632 2.804 1.00 . A A . 15 PHE CD2 1 1 14 4163 1 1 15 PHE CE1 C -11.403 -6.711 5.397 1.00 . A A . 15 PHE CE1 1 1 14 4164 1 1 15 PHE CE2 C -12.270 -8.286 3.821 1.00 . A A . 15 PHE CE2 1 1 14 4165 1 1 15 PHE CG C -10.827 -6.514 3.069 1.00 . A A . 15 PHE CG 1 1 14 4166 1 1 15 PHE CZ C -12.172 -7.824 5.119 1.00 . A A . 15 PHE CZ 1 1 14 4167 1 1 15 PHE H H -11.887 -4.506 0.327 1.00 . A A . 15 PHE H 1 1 14 4168 1 1 15 PHE HA H -10.502 -3.903 2.857 1.00 . A A . 15 PHE HA 1 1 14 4169 1 1 15 PHE HB2 H -10.361 -6.290 1.032 1.00 . A A . 15 PHE HB2 1 1 14 4170 1 1 15 PHE HB3 H -9.041 -5.915 2.135 1.00 . A A . 15 PHE HB3 1 1 14 4171 1 1 15 PHE HD1 H -10.137 -5.189 4.594 1.00 . A A . 15 PHE HD1 1 1 14 4172 1 1 15 PHE HD2 H -11.679 -7.995 1.789 1.00 . A A . 15 PHE HD2 1 1 14 4173 1 1 15 PHE HE1 H -11.325 -6.347 6.410 1.00 . A A . 15 PHE HE1 1 1 14 4174 1 1 15 PHE HE2 H -12.871 -9.157 3.601 1.00 . A A . 15 PHE HE2 1 1 14 4175 1 1 15 PHE HZ H -12.694 -8.334 5.915 1.00 . A A . 15 PHE HZ 1 1 14 4176 1 1 15 PHE N N -11.739 -4.136 1.223 1.00 . A A . 15 PHE N 1 1 14 4177 1 1 15 PHE O O -9.504 -3.238 -0.080 1.00 . A A . 15 PHE O 1 1 14 4178 1 1 16 PRO C C -6.334 -3.480 0.177 1.00 . A A . 16 PRO C 1 1 14 4179 1 1 16 PRO CA C -7.145 -2.511 1.004 1.00 . A A . 16 PRO CA 1 1 14 4180 1 1 16 PRO CB C -6.346 -1.910 2.187 1.00 . A A . 16 PRO CB 1 1 14 4181 1 1 16 PRO CD C -7.994 -3.399 3.162 1.00 . A A . 16 PRO CD 1 1 14 4182 1 1 16 PRO CG C -6.525 -2.953 3.309 1.00 . A A . 16 PRO CG 1 1 14 4183 1 1 16 PRO HA H -7.540 -1.709 0.359 1.00 . A A . 16 PRO HA 1 1 14 4184 1 1 16 PRO HB2 H -5.290 -1.698 1.956 1.00 . A A . 16 PRO HB2 1 1 14 4185 1 1 16 PRO HB3 H -6.832 -0.978 2.514 1.00 . A A . 16 PRO HB3 1 1 14 4186 1 1 16 PRO HD2 H -8.102 -4.420 3.548 1.00 . A A . 16 PRO HD2 1 1 14 4187 1 1 16 PRO HD3 H -8.647 -2.709 3.721 1.00 . A A . 16 PRO HD3 1 1 14 4188 1 1 16 PRO HG2 H -5.848 -3.804 3.119 1.00 . A A . 16 PRO HG2 1 1 14 4189 1 1 16 PRO HG3 H -6.342 -2.549 4.317 1.00 . A A . 16 PRO HG3 1 1 14 4190 1 1 16 PRO N N -8.196 -3.222 1.727 1.00 . A A . 16 PRO N 1 1 14 4191 1 1 16 PRO O O -6.627 -4.665 0.216 1.00 . A A . 16 PRO O 1 1 14 4192 1 1 17 ILE C C -3.186 -4.100 -1.084 1.00 . A A . 17 ILE C 1 1 14 4193 1 1 17 ILE CA C -4.605 -3.822 -1.538 1.00 . A A . 17 ILE CA 1 1 14 4194 1 1 17 ILE CB C -4.599 -3.146 -2.943 1.00 . A A . 17 ILE CB 1 1 14 4195 1 1 17 ILE CD1 C -7.052 -3.882 -3.545 1.00 . A A . 17 ILE CD1 1 1 14 4196 1 1 17 ILE CG1 C -6.027 -2.723 -3.414 1.00 . A A . 17 ILE CG1 1 1 14 4197 1 1 17 ILE CG2 C -3.873 -4.039 -3.991 1.00 . A A . 17 ILE CG2 1 1 14 4198 1 1 17 ILE H H -5.103 -2.004 -0.547 1.00 . A A . 17 ILE H 1 1 14 4199 1 1 17 ILE HA H -5.102 -4.797 -1.659 1.00 . A A . 17 ILE HA 1 1 14 4200 1 1 17 ILE HB H -4.018 -2.211 -2.872 1.00 . A A . 17 ILE HB 1 1 14 4201 1 1 17 ILE HD11 H -8.005 -3.487 -3.930 1.00 . A A . 17 ILE HD11 1 1 14 4202 1 1 17 ILE HD12 H -6.696 -4.652 -4.245 1.00 . A A . 17 ILE HD12 1 1 14 4203 1 1 17 ILE HD13 H -7.254 -4.350 -2.570 1.00 . A A . 17 ILE HD13 1 1 14 4204 1 1 17 ILE HG12 H -6.442 -1.980 -2.713 1.00 . A A . 17 ILE HG12 1 1 14 4205 1 1 17 ILE HG13 H -5.941 -2.229 -4.397 1.00 . A A . 17 ILE HG13 1 1 14 4206 1 1 17 ILE HG21 H -3.914 -3.575 -4.988 1.00 . A A . 17 ILE HG21 1 1 14 4207 1 1 17 ILE HG22 H -2.812 -4.164 -3.721 1.00 . A A . 17 ILE HG22 1 1 14 4208 1 1 17 ILE HG23 H -4.328 -5.038 -4.050 1.00 . A A . 17 ILE HG23 1 1 14 4209 1 1 17 ILE N N -5.332 -2.978 -0.585 1.00 . A A . 17 ILE N 1 1 14 4210 1 1 17 ILE O O -2.832 -5.264 -0.981 1.00 . A A . 17 ILE O 1 1 14 4211 1 1 18 SER C C -0.665 -3.124 0.919 1.00 . A A . 18 SER C 1 1 14 4212 1 1 18 SER CA C -0.931 -3.280 -0.558 1.00 . A A . 18 SER CA 1 1 14 4213 1 1 18 SER CB C -0.147 -2.245 -1.400 1.00 . A A . 18 SER CB 1 1 14 4214 1 1 18 SER H H -2.675 -2.114 -0.856 1.00 . A A . 18 SER H 1 1 14 4215 1 1 18 SER HA H -0.597 -4.287 -0.859 1.00 . A A . 18 SER HA 1 1 14 4216 1 1 18 SER HB2 H 0.938 -2.353 -1.251 1.00 . A A . 18 SER HB2 1 1 14 4217 1 1 18 SER HB3 H -0.374 -2.417 -2.466 1.00 . A A . 18 SER HB3 1 1 14 4218 1 1 18 SER HG H -0.204 -0.250 -1.543 1.00 . A A . 18 SER HG 1 1 14 4219 1 1 18 SER N N -2.352 -3.062 -0.838 1.00 . A A . 18 SER N 1 1 14 4220 1 1 18 SER O O -1.601 -2.801 1.635 1.00 . A A . 18 SER O 1 1 14 4221 1 1 18 SER OG O -0.591 -0.935 -1.009 1.00 . A A . 18 SER OG 1 1 14 4222 1 1 19 PHE C C 2.157 -2.678 3.164 1.00 . A A . 19 PHE C 1 1 14 4223 1 1 19 PHE CA C 0.853 -3.364 2.827 1.00 . A A . 19 PHE CA 1 1 14 4224 1 1 19 PHE CB C 0.737 -4.822 3.343 1.00 . A A . 19 PHE CB 1 1 14 4225 1 1 19 PHE CD1 C -1.755 -5.365 3.302 1.00 . A A . 19 PHE CD1 1 1 14 4226 1 1 19 PHE CD2 C -0.347 -6.283 1.567 1.00 . A A . 19 PHE CD2 1 1 14 4227 1 1 19 PHE CE1 C -2.873 -5.953 2.704 1.00 . A A . 19 PHE CE1 1 1 14 4228 1 1 19 PHE CE2 C -1.458 -6.902 0.988 1.00 . A A . 19 PHE CE2 1 1 14 4229 1 1 19 PHE CG C -0.489 -5.508 2.725 1.00 . A A . 19 PHE CG 1 1 14 4230 1 1 19 PHE CZ C -2.725 -6.729 1.551 1.00 . A A . 19 PHE CZ 1 1 14 4231 1 1 19 PHE H H 1.335 -3.636 0.785 1.00 . A A . 19 PHE H 1 1 14 4232 1 1 19 PHE HA H 0.115 -2.743 3.342 1.00 . A A . 19 PHE HA 1 1 14 4233 1 1 19 PHE HB2 H 1.633 -5.367 3.028 1.00 . A A . 19 PHE HB2 1 1 14 4234 1 1 19 PHE HB3 H 0.671 -4.874 4.441 1.00 . A A . 19 PHE HB3 1 1 14 4235 1 1 19 PHE HD1 H -1.875 -4.795 4.218 1.00 . A A . 19 PHE HD1 1 1 14 4236 1 1 19 PHE HD2 H 0.627 -6.409 1.106 1.00 . A A . 19 PHE HD2 1 1 14 4237 1 1 19 PHE HE1 H -3.859 -5.810 3.136 1.00 . A A . 19 PHE HE1 1 1 14 4238 1 1 19 PHE HE2 H -1.335 -7.514 0.099 1.00 . A A . 19 PHE HE2 1 1 14 4239 1 1 19 PHE HZ H -3.590 -7.196 1.092 1.00 . A A . 19 PHE HZ 1 1 14 4240 1 1 19 PHE N N 0.585 -3.366 1.390 1.00 . A A . 19 PHE N 1 1 14 4241 1 1 19 PHE O O 2.818 -2.200 2.258 1.00 . A A . 19 PHE O 1 1 14 4242 1 1 20 TYR C C 4.950 -2.305 4.393 1.00 . A A . 20 TYR C 1 1 14 4243 1 1 20 TYR CA C 3.637 -1.721 4.866 1.00 . A A . 20 TYR CA 1 1 14 4244 1 1 20 TYR CB C 3.633 -1.483 6.410 1.00 . A A . 20 TYR CB 1 1 14 4245 1 1 20 TYR CD1 C 3.184 1.006 6.538 1.00 . A A . 20 TYR CD1 1 1 14 4246 1 1 20 TYR CD2 C 5.286 0.207 7.410 1.00 . A A . 20 TYR CD2 1 1 14 4247 1 1 20 TYR CE1 C 3.557 2.322 6.821 1.00 . A A . 20 TYR CE1 1 1 14 4248 1 1 20 TYR CE2 C 5.656 1.523 7.707 1.00 . A A . 20 TYR CE2 1 1 14 4249 1 1 20 TYR CG C 4.057 -0.057 6.796 1.00 . A A . 20 TYR CG 1 1 14 4250 1 1 20 TYR CZ C 4.802 2.587 7.405 1.00 . A A . 20 TYR CZ 1 1 14 4251 1 1 20 TYR H H 1.986 -3.044 5.169 1.00 . A A . 20 TYR H 1 1 14 4252 1 1 20 TYR HA H 3.510 -0.751 4.361 1.00 . A A . 20 TYR HA 1 1 14 4253 1 1 20 TYR HB2 H 2.614 -1.572 6.812 1.00 . A A . 20 TYR HB2 1 1 14 4254 1 1 20 TYR HB3 H 4.244 -2.248 6.915 1.00 . A A . 20 TYR HB3 1 1 14 4255 1 1 20 TYR HD1 H 2.203 0.810 6.118 1.00 . A A . 20 TYR HD1 1 1 14 4256 1 1 20 TYR HD2 H 5.960 -0.606 7.659 1.00 . A A . 20 TYR HD2 1 1 14 4257 1 1 20 TYR HE1 H 2.873 3.131 6.584 1.00 . A A . 20 TYR HE1 1 1 14 4258 1 1 20 TYR HE2 H 6.614 1.722 8.174 1.00 . A A . 20 TYR HE2 1 1 14 4259 1 1 20 TYR HH H 4.576 4.563 7.454 1.00 . A A . 20 TYR HH 1 1 14 4260 1 1 20 TYR N N 2.518 -2.578 4.464 1.00 . A A . 20 TYR N 1 1 14 4261 1 1 20 TYR O O 4.942 -3.372 3.801 1.00 . A A . 20 TYR O 1 1 14 4262 1 1 20 TYR OH O 5.207 3.894 7.694 1.00 . A A . 20 TYR OH 1 1 14 4263 1 1 21 GLY C C 7.697 -1.868 2.834 1.00 . A A . 21 GLY C 1 1 14 4264 1 1 21 GLY CA C 7.389 -2.196 4.271 1.00 . A A . 21 GLY CA 1 1 14 4265 1 1 21 GLY H H 6.085 -0.719 5.058 1.00 . A A . 21 GLY H 1 1 14 4266 1 1 21 GLY HA2 H 8.180 -1.767 4.906 1.00 . A A . 21 GLY HA2 1 1 14 4267 1 1 21 GLY HA3 H 7.395 -3.286 4.433 1.00 . A A . 21 GLY HA3 1 1 14 4268 1 1 21 GLY N N 6.095 -1.628 4.644 1.00 . A A . 21 GLY N 1 1 14 4269 1 1 21 GLY O O 7.198 -0.821 2.343 1.00 . A A . 21 GLY O 1 1 14 4270 1 1 21 GLY OXT O 8.449 -2.645 2.184 1.00 . A A . 21 GLY OXT 1 1 15 4271 1 1 1 GLY C C 3.784 -1.374 -0.800 1.00 . A A . 1 GLY C 1 1 15 4272 1 1 1 GLY CA C 3.068 -0.066 -0.566 1.00 . A A . 1 GLY CA 1 1 15 4273 1 1 1 GLY H1 H 1.939 -0.993 0.967 1.00 . A A . 1 GLY H1 1 1 15 4274 1 1 1 GLY HA2 H 2.354 0.127 -1.380 1.00 . A A . 1 GLY HA2 1 1 15 4275 1 1 1 GLY HA3 H 3.831 0.730 -0.571 1.00 . A A . 1 GLY HA3 1 1 15 4276 1 1 1 GLY N N 2.331 -0.113 0.693 1.00 . A A . 1 GLY N 1 1 15 4277 1 1 1 GLY O O 3.620 -1.967 -1.855 1.00 . A A . 1 GLY O 1 1 15 4278 1 1 2 GLY C C 4.378 -4.266 0.258 1.00 . A A . 2 GLY C 1 1 15 4279 1 1 2 GLY CA C 5.304 -3.095 0.041 1.00 . A A . 2 GLY CA 1 1 15 4280 1 1 2 GLY H H 4.684 -1.322 1.050 1.00 . A A . 2 GLY H 1 1 15 4281 1 1 2 GLY HA2 H 5.743 -3.170 -0.965 1.00 . A A . 2 GLY HA2 1 1 15 4282 1 1 2 GLY HA3 H 6.126 -3.147 0.773 1.00 . A A . 2 GLY HA3 1 1 15 4283 1 1 2 GLY N N 4.589 -1.828 0.190 1.00 . A A . 2 GLY N 1 1 15 4284 1 1 2 GLY O O 3.174 -4.080 0.176 1.00 . A A . 2 GLY O 1 1 15 4285 1 1 3 ALA C C 4.161 -7.000 2.255 1.00 . A A . 3 ALA C 1 1 15 4286 1 1 3 ALA CA C 4.103 -6.654 0.784 1.00 . A A . 3 ALA CA 1 1 15 4287 1 1 3 ALA CB C 4.602 -7.825 -0.105 1.00 . A A . 3 ALA CB 1 1 15 4288 1 1 3 ALA H H 5.926 -5.591 0.589 1.00 . A A . 3 ALA H 1 1 15 4289 1 1 3 ALA HA H 3.045 -6.471 0.536 1.00 . A A . 3 ALA HA 1 1 15 4290 1 1 3 ALA HB1 H 5.639 -8.095 0.150 1.00 . A A . 3 ALA HB1 1 1 15 4291 1 1 3 ALA HB2 H 3.965 -8.713 0.028 1.00 . A A . 3 ALA HB2 1 1 15 4292 1 1 3 ALA HB3 H 4.570 -7.524 -1.164 1.00 . A A . 3 ALA HB3 1 1 15 4293 1 1 3 ALA N N 4.932 -5.475 0.529 1.00 . A A . 3 ALA N 1 1 15 4294 1 1 3 ALA O O 4.283 -8.168 2.592 1.00 . A A . 3 ALA O 1 1 15 4295 1 1 4 GLY C C 2.813 -6.831 5.110 1.00 . A A . 4 GLY C 1 1 15 4296 1 1 4 GLY CA C 4.117 -6.264 4.585 1.00 . A A . 4 GLY CA 1 1 15 4297 1 1 4 GLY H H 3.979 -5.036 2.855 1.00 . A A . 4 GLY H 1 1 15 4298 1 1 4 GLY HA2 H 4.916 -6.989 4.808 1.00 . A A . 4 GLY HA2 1 1 15 4299 1 1 4 GLY HA3 H 4.374 -5.333 5.115 1.00 . A A . 4 GLY HA3 1 1 15 4300 1 1 4 GLY N N 4.075 -5.990 3.150 1.00 . A A . 4 GLY N 1 1 15 4301 1 1 4 GLY O O 2.132 -7.525 4.372 1.00 . A A . 4 GLY O 1 1 15 4302 1 1 5 HIS C C 0.297 -6.135 7.424 1.00 . A A . 5 HIS C 1 1 15 4303 1 1 5 HIS CA C 1.366 -7.173 7.095 1.00 . A A . 5 HIS CA 1 1 15 4304 1 1 5 HIS CB C 1.842 -7.856 8.377 1.00 . A A . 5 HIS CB 1 1 15 4305 1 1 5 HIS CD2 C 2.546 -9.980 7.065 1.00 . A A . 5 HIS CD2 1 1 15 4306 1 1 5 HIS CE1 C 3.865 -10.867 8.575 1.00 . A A . 5 HIS CE1 1 1 15 4307 1 1 5 HIS CG C 2.552 -9.153 8.137 1.00 . A A . 5 HIS CG 1 1 15 4308 1 1 5 HIS H H 3.109 -5.986 6.904 1.00 . A A . 5 HIS H 1 1 15 4309 1 1 5 HIS HA H 0.939 -7.916 6.438 1.00 . A A . 5 HIS HA 1 1 15 4310 1 1 5 HIS HB2 H 2.523 -7.198 8.897 1.00 . A A . 5 HIS HB2 1 1 15 4311 1 1 5 HIS HB3 H 0.989 -8.056 9.009 1.00 . A A . 5 HIS HB3 1 1 15 4312 1 1 5 HIS HD1 H 3.598 -9.377 9.951 1.00 . A A . 5 HIS HD1 1 1 15 4313 1 1 5 HIS HD2 H 1.995 -9.836 6.146 1.00 . A A . 5 HIS HD2 1 1 15 4314 1 1 5 HIS HE1 H 4.544 -11.538 9.079 1.00 . A A . 5 HIS HE1 1 1 15 4315 1 1 5 HIS N N 2.492 -6.557 6.401 1.00 . A A . 5 HIS N 1 1 15 4316 1 1 5 HIS ND1 N 3.387 -9.738 9.065 1.00 . A A . 5 HIS ND1 1 1 15 4317 1 1 5 HIS NE2 N 3.369 -11.038 7.362 1.00 . A A . 5 HIS NE2 1 1 15 4318 1 1 5 HIS O O -0.860 -6.477 7.667 1.00 . A A . 5 HIS O 1 1 15 4319 1 1 6 VAL C C -0.657 -2.939 6.774 1.00 . A A . 6 VAL C 1 1 15 4320 1 1 6 VAL CA C -0.314 -3.799 7.970 1.00 . A A . 6 VAL CA 1 1 15 4321 1 1 6 VAL CB C 0.377 -2.960 9.090 1.00 . A A . 6 VAL CB 1 1 15 4322 1 1 6 VAL CG1 C -0.542 -1.838 9.646 1.00 . A A . 6 VAL CG1 1 1 15 4323 1 1 6 VAL CG2 C 0.846 -3.886 10.248 1.00 . A A . 6 VAL CG2 1 1 15 4324 1 1 6 VAL H H 1.534 -4.470 7.255 1.00 . A A . 6 VAL H 1 1 15 4325 1 1 6 VAL HA H -1.208 -4.256 8.416 1.00 . A A . 6 VAL HA 1 1 15 4326 1 1 6 VAL HB H 1.270 -2.473 8.663 1.00 . A A . 6 VAL HB 1 1 15 4327 1 1 6 VAL HG11 H -0.894 -1.181 8.835 1.00 . A A . 6 VAL HG11 1 1 15 4328 1 1 6 VAL HG12 H -1.411 -2.271 10.163 1.00 . A A . 6 VAL HG12 1 1 15 4329 1 1 6 VAL HG13 H 0.012 -1.219 10.369 1.00 . A A . 6 VAL HG13 1 1 15 4330 1 1 6 VAL HG21 H -0.015 -4.407 10.695 1.00 . A A . 6 VAL HG21 1 1 15 4331 1 1 6 VAL HG22 H 1.561 -4.641 9.886 1.00 . A A . 6 VAL HG22 1 1 15 4332 1 1 6 VAL HG23 H 1.344 -3.296 11.033 1.00 . A A . 6 VAL HG23 1 1 15 4333 1 1 6 VAL N N 0.631 -4.817 7.498 1.00 . A A . 6 VAL N 1 1 15 4334 1 1 6 VAL O O 0.279 -2.627 6.055 1.00 . A A . 6 VAL O 1 1 15 4335 1 1 7 PRO C C -1.595 -0.398 5.270 1.00 . A A . 7 PRO C 1 1 15 4336 1 1 7 PRO CA C -2.157 -1.800 5.241 1.00 . A A . 7 PRO CA 1 1 15 4337 1 1 7 PRO CB C -3.697 -1.838 5.177 1.00 . A A . 7 PRO CB 1 1 15 4338 1 1 7 PRO CD C -3.079 -2.859 7.287 1.00 . A A . 7 PRO CD 1 1 15 4339 1 1 7 PRO CG C -4.116 -1.897 6.661 1.00 . A A . 7 PRO CG 1 1 15 4340 1 1 7 PRO HA H -1.770 -2.362 4.385 1.00 . A A . 7 PRO HA 1 1 15 4341 1 1 7 PRO HB2 H -4.136 -0.992 4.622 1.00 . A A . 7 PRO HB2 1 1 15 4342 1 1 7 PRO HB3 H -3.991 -2.785 4.697 1.00 . A A . 7 PRO HB3 1 1 15 4343 1 1 7 PRO HD2 H -2.973 -2.655 8.361 1.00 . A A . 7 PRO HD2 1 1 15 4344 1 1 7 PRO HD3 H -3.365 -3.910 7.121 1.00 . A A . 7 PRO HD3 1 1 15 4345 1 1 7 PRO HG2 H -3.998 -0.892 7.097 1.00 . A A . 7 PRO HG2 1 1 15 4346 1 1 7 PRO HG3 H -5.153 -2.240 6.805 1.00 . A A . 7 PRO HG3 1 1 15 4347 1 1 7 PRO N N -1.917 -2.530 6.474 1.00 . A A . 7 PRO N 1 1 15 4348 1 1 7 PRO O O -1.476 0.170 6.344 1.00 . A A . 7 PRO O 1 1 15 4349 1 1 8 GLU C C -1.887 2.501 4.014 1.00 . A A . 8 GLU C 1 1 15 4350 1 1 8 GLU CA C -0.731 1.525 4.014 1.00 . A A . 8 GLU CA 1 1 15 4351 1 1 8 GLU CB C 0.107 1.737 2.720 1.00 . A A . 8 GLU CB 1 1 15 4352 1 1 8 GLU CD C 2.155 1.004 1.439 1.00 . A A . 8 GLU CD 1 1 15 4353 1 1 8 GLU CG C 1.418 0.910 2.756 1.00 . A A . 8 GLU CG 1 1 15 4354 1 1 8 GLU H H -1.374 -0.348 3.230 1.00 . A A . 8 GLU H 1 1 15 4355 1 1 8 GLU HA H -0.078 1.732 4.879 1.00 . A A . 8 GLU HA 1 1 15 4356 1 1 8 GLU HB2 H -0.486 1.435 1.843 1.00 . A A . 8 GLU HB2 1 1 15 4357 1 1 8 GLU HB3 H 0.359 2.805 2.610 1.00 . A A . 8 GLU HB3 1 1 15 4358 1 1 8 GLU HG2 H 2.079 1.307 3.541 1.00 . A A . 8 GLU HG2 1 1 15 4359 1 1 8 GLU HG3 H 1.185 -0.135 3.010 1.00 . A A . 8 GLU HG3 1 1 15 4360 1 1 8 GLU N N -1.246 0.157 4.086 1.00 . A A . 8 GLU N 1 1 15 4361 1 1 8 GLU O O -1.808 3.504 4.706 1.00 . A A . 8 GLU O 1 1 15 4362 1 1 8 GLU OE1 O 2.570 2.099 1.095 1.00 . A A . 8 GLU OE1 1 1 15 4363 1 1 9 TYR C C -5.366 2.376 3.023 1.00 . A A . 9 TYR C 1 1 15 4364 1 1 9 TYR CA C -4.080 3.159 3.122 1.00 . A A . 9 TYR CA 1 1 15 4365 1 1 9 TYR CB C -3.847 4.015 1.848 1.00 . A A . 9 TYR CB 1 1 15 4366 1 1 9 TYR CD1 C -4.575 2.393 0.018 1.00 . A A . 9 TYR CD1 1 1 15 4367 1 1 9 TYR CD2 C -2.235 2.955 0.183 1.00 . A A . 9 TYR CD2 1 1 15 4368 1 1 9 TYR CE1 C -4.284 1.488 -1.007 1.00 . A A . 9 TYR CE1 1 1 15 4369 1 1 9 TYR CE2 C -1.945 2.064 -0.855 1.00 . A A . 9 TYR CE2 1 1 15 4370 1 1 9 TYR CG C -3.546 3.100 0.650 1.00 . A A . 9 TYR CG 1 1 15 4371 1 1 9 TYR CZ C -2.967 1.309 -1.440 1.00 . A A . 9 TYR CZ 1 1 15 4372 1 1 9 TYR H H -2.997 1.393 2.679 1.00 . A A . 9 TYR H 1 1 15 4373 1 1 9 TYR HA H -4.170 3.809 4.008 1.00 . A A . 9 TYR HA 1 1 15 4374 1 1 9 TYR HB2 H -4.719 4.646 1.616 1.00 . A A . 9 TYR HB2 1 1 15 4375 1 1 9 TYR HB3 H -2.996 4.688 2.033 1.00 . A A . 9 TYR HB3 1 1 15 4376 1 1 9 TYR HD1 H -5.607 2.542 0.319 1.00 . A A . 9 TYR HD1 1 1 15 4377 1 1 9 TYR HD2 H -1.430 3.532 0.624 1.00 . A A . 9 TYR HD2 1 1 15 4378 1 1 9 TYR HE1 H -5.083 0.918 -1.470 1.00 . A A . 9 TYR HE1 1 1 15 4379 1 1 9 TYR HE2 H -0.919 1.968 -1.198 1.00 . A A . 9 TYR HE2 1 1 15 4380 1 1 9 TYR HH H -1.775 0.257 -2.635 1.00 . A A . 9 TYR HH 1 1 15 4381 1 1 9 TYR N N -2.960 2.224 3.238 1.00 . A A . 9 TYR N 1 1 15 4382 1 1 9 TYR O O -5.285 1.158 2.982 1.00 . A A . 9 TYR O 1 1 15 4383 1 1 9 TYR OH O -2.700 0.382 -2.453 1.00 . A A . 9 TYR OH 1 1 15 4384 1 1 10 PHE C C -8.660 2.973 1.752 1.00 . A A . 10 PHE C 1 1 15 4385 1 1 10 PHE CA C -7.811 2.342 2.835 1.00 . A A . 10 PHE CA 1 1 15 4386 1 1 10 PHE CB C -8.606 2.370 4.161 1.00 . A A . 10 PHE CB 1 1 15 4387 1 1 10 PHE CD1 C -6.912 2.172 6.052 1.00 . A A . 10 PHE CD1 1 1 15 4388 1 1 10 PHE CD2 C -8.153 0.201 5.406 1.00 . A A . 10 PHE CD2 1 1 15 4389 1 1 10 PHE CE1 C -6.329 1.461 7.103 1.00 . A A . 10 PHE CE1 1 1 15 4390 1 1 10 PHE CE2 C -7.574 -0.511 6.460 1.00 . A A . 10 PHE CE2 1 1 15 4391 1 1 10 PHE CG C -7.868 1.560 5.233 1.00 . A A . 10 PHE CG 1 1 15 4392 1 1 10 PHE CZ C -6.694 0.131 7.333 1.00 . A A . 10 PHE CZ 1 1 15 4393 1 1 10 PHE H H -6.577 4.047 3.058 1.00 . A A . 10 PHE H 1 1 15 4394 1 1 10 PHE HA H -7.633 1.287 2.581 1.00 . A A . 10 PHE HA 1 1 15 4395 1 1 10 PHE HB2 H -8.738 3.411 4.493 1.00 . A A . 10 PHE HB2 1 1 15 4396 1 1 10 PHE HB3 H -9.610 1.942 4.006 1.00 . A A . 10 PHE HB3 1 1 15 4397 1 1 10 PHE HD1 H -6.624 3.203 5.876 1.00 . A A . 10 PHE HD1 1 1 15 4398 1 1 10 PHE HD2 H -8.829 -0.305 4.725 1.00 . A A . 10 PHE HD2 1 1 15 4399 1 1 10 PHE HE1 H -5.596 1.940 7.743 1.00 . A A . 10 PHE HE1 1 1 15 4400 1 1 10 PHE HE2 H -7.812 -1.561 6.601 1.00 . A A . 10 PHE HE2 1 1 15 4401 1 1 10 PHE HZ H -6.292 -0.400 8.190 1.00 . A A . 10 PHE HZ 1 1 15 4402 1 1 10 PHE N N -6.542 3.050 2.980 1.00 . A A . 10 PHE N 1 1 15 4403 1 1 10 PHE O O -8.634 4.187 1.634 1.00 . A A . 10 PHE O 1 1 15 4404 1 1 11 VAL C C -11.767 2.566 0.401 1.00 . A A . 11 VAL C 1 1 15 4405 1 1 11 VAL CA C -10.315 2.649 -0.054 1.00 . A A . 11 VAL CA 1 1 15 4406 1 1 11 VAL CB C -10.155 1.863 -1.369 1.00 . A A . 11 VAL CB 1 1 15 4407 1 1 11 VAL CG1 C -10.964 2.512 -2.481 1.00 . A A . 11 VAL CG1 1 1 15 4408 1 1 11 VAL CG2 C -8.686 1.763 -1.754 1.00 . A A . 11 VAL CG2 1 1 15 4409 1 1 11 VAL H H -9.341 1.183 1.123 1.00 . A A . 11 VAL H 1 1 15 4410 1 1 11 VAL HA H -10.065 3.682 -0.245 1.00 . A A . 11 VAL HA 1 1 15 4411 1 1 11 VAL HB H -10.533 0.863 -1.215 1.00 . A A . 11 VAL HB 1 1 15 4412 1 1 11 VAL HG11 H -10.560 2.217 -3.439 1.00 . A A . 11 VAL HG11 1 1 15 4413 1 1 11 VAL HG12 H -11.994 2.195 -2.410 1.00 . A A . 11 VAL HG12 1 1 15 4414 1 1 11 VAL HG13 H -10.910 3.586 -2.385 1.00 . A A . 11 VAL HG13 1 1 15 4415 1 1 11 VAL HG21 H -8.576 1.975 -2.807 1.00 . A A . 11 VAL HG21 1 1 15 4416 1 1 11 VAL HG22 H -8.114 2.478 -1.182 1.00 . A A . 11 VAL HG22 1 1 15 4417 1 1 11 VAL HG23 H -8.326 0.766 -1.548 1.00 . A A . 11 VAL HG23 1 1 15 4418 1 1 11 VAL N N -9.412 2.150 0.976 1.00 . A A . 11 VAL N 1 1 15 4419 1 1 11 VAL O O -12.085 1.885 1.376 1.00 . A A . 11 VAL O 1 1 15 4420 1 1 12 ARG C C -14.736 1.978 -0.438 1.00 . A A . 12 ARG C 1 1 15 4421 1 1 12 ARG CA C -14.065 3.270 0.019 1.00 . A A . 12 ARG CA 1 1 15 4422 1 1 12 ARG CB C -14.756 4.472 -0.627 1.00 . A A . 12 ARG CB 1 1 15 4423 1 1 12 ARG CD C -15.081 6.964 -0.683 1.00 . A A . 12 ARG CD 1 1 15 4424 1 1 12 ARG CG C -14.405 5.800 0.025 1.00 . A A . 12 ARG CG 1 1 15 4425 1 1 12 ARG CZ C -17.345 7.896 -0.902 1.00 . A A . 12 ARG CZ 1 1 15 4426 1 1 12 ARG H H -12.331 3.787 -1.079 1.00 . A A . 12 ARG H 1 1 15 4427 1 1 12 ARG HA H -14.156 3.348 1.092 1.00 . A A . 12 ARG HA 1 1 15 4428 1 1 12 ARG HB2 H -14.470 4.521 -1.668 1.00 . A A . 12 ARG HB2 1 1 15 4429 1 1 12 ARG HB3 H -15.825 4.335 -0.563 1.00 . A A . 12 ARG HB3 1 1 15 4430 1 1 12 ARG HD2 H -14.750 7.885 -0.228 1.00 . A A . 12 ARG HD2 1 1 15 4431 1 1 12 ARG HD3 H -14.790 6.952 -1.723 1.00 . A A . 12 ARG HD3 1 1 15 4432 1 1 12 ARG HE H -16.929 6.043 -0.293 1.00 . A A . 12 ARG HE 1 1 15 4433 1 1 12 ARG HG2 H -14.731 5.781 1.054 1.00 . A A . 12 ARG HG2 1 1 15 4434 1 1 12 ARG HG3 H -13.335 5.937 -0.014 1.00 . A A . 12 ARG HG3 1 1 15 4435 1 1 12 ARG HH11 H -15.852 9.164 -1.395 1.00 . A A . 12 ARG HH11 1 1 15 4436 1 1 12 ARG HH12 H -17.453 9.809 -1.545 1.00 . A A . 12 ARG HH12 1 1 15 4437 1 1 12 ARG HH21 H -19.042 6.880 -0.486 1.00 . A A . 12 ARG HH21 1 1 15 4438 1 1 12 ARG HH22 H -19.267 8.510 -1.027 1.00 . A A . 12 ARG HH22 1 1 15 4439 1 1 12 ARG N N -12.645 3.264 -0.312 1.00 . A A . 12 ARG N 1 1 15 4440 1 1 12 ARG NE N -16.536 6.888 -0.596 1.00 . A A . 12 ARG NE 1 1 15 4441 1 1 12 ARG NH1 N -16.842 9.052 -1.314 1.00 . A A . 12 ARG NH1 1 1 15 4442 1 1 12 ARG NH2 N -18.659 7.750 -0.796 1.00 . A A . 12 ARG NH2 1 1 15 4443 1 1 12 ARG O O -15.939 1.947 -0.693 1.00 . A A . 12 ARG O 1 1 15 4444 1 1 13 GLY C C -14.673 -1.331 0.188 1.00 . A A . 13 GLY C 1 1 15 4445 1 1 13 GLY CA C -14.482 -0.368 -0.967 1.00 . A A . 13 GLY CA 1 1 15 4446 1 1 13 GLY H H -12.995 0.995 -0.324 1.00 . A A . 13 GLY H 1 1 15 4447 1 1 13 GLY HA2 H -15.435 -0.205 -1.448 1.00 . A A . 13 GLY HA2 1 1 15 4448 1 1 13 GLY HA3 H -13.802 -0.810 -1.680 1.00 . A A . 13 GLY HA3 1 1 15 4449 1 1 13 GLY N N -13.948 0.912 -0.540 1.00 . A A . 13 GLY N 1 1 15 4450 1 1 13 GLY O O -15.482 -1.085 1.083 1.00 . A A . 13 GLY O 1 1 15 4451 1 1 14 ASP C C -12.703 -3.547 1.981 1.00 . A A . 14 ASP C 1 1 15 4452 1 1 14 ASP CA C -14.020 -3.436 1.221 1.00 . A A . 14 ASP CA 1 1 15 4453 1 1 14 ASP CB C -14.398 -4.794 0.628 1.00 . A A . 14 ASP CB 1 1 15 4454 1 1 14 ASP CG C -14.447 -5.889 1.675 1.00 . A A . 14 ASP CG 1 1 15 4455 1 1 14 ASP H H -13.302 -2.571 -0.574 1.00 . A A . 14 ASP H 1 1 15 4456 1 1 14 ASP HA H -14.793 -3.126 1.908 1.00 . A A . 14 ASP HA 1 1 15 4457 1 1 14 ASP HB2 H -15.372 -4.720 0.167 1.00 . A A . 14 ASP HB2 1 1 15 4458 1 1 14 ASP HB3 H -13.670 -5.068 -0.120 1.00 . A A . 14 ASP HB3 1 1 15 4459 1 1 14 ASP N N -13.929 -2.431 0.167 1.00 . A A . 14 ASP N 1 1 15 4460 1 1 14 ASP O O -12.577 -3.054 3.102 1.00 . A A . 14 ASP O 1 1 15 4461 1 1 14 ASP OD1 O -14.877 -5.603 2.812 1.00 . A A . 14 ASP OD1 1 1 15 4462 1 1 14 ASP OD2 O -14.055 -7.032 1.358 1.00 . A A . 14 ASP OD2 1 1 15 4463 1 1 15 PHE C C -9.335 -3.641 1.195 1.00 . A A . 15 PHE C 1 1 15 4464 1 1 15 PHE CA C -10.415 -4.378 1.983 1.00 . A A . 15 PHE CA 1 1 15 4465 1 1 15 PHE CB C -10.069 -5.865 2.074 1.00 . A A . 15 PHE CB 1 1 15 4466 1 1 15 PHE CD1 C -10.657 -6.130 4.499 1.00 . A A . 15 PHE CD1 1 1 15 4467 1 1 15 PHE CD2 C -11.556 -7.693 2.938 1.00 . A A . 15 PHE CD2 1 1 15 4468 1 1 15 PHE CE1 C -11.305 -6.783 5.531 1.00 . A A . 15 PHE CE1 1 1 15 4469 1 1 15 PHE CE2 C -12.207 -8.349 3.966 1.00 . A A . 15 PHE CE2 1 1 15 4470 1 1 15 PHE CG C -10.775 -6.577 3.193 1.00 . A A . 15 PHE CG 1 1 15 4471 1 1 15 PHE CZ C -12.080 -7.894 5.264 1.00 . A A . 15 PHE CZ 1 1 15 4472 1 1 15 PHE H H -11.884 -4.570 0.470 1.00 . A A . 15 PHE H 1 1 15 4473 1 1 15 PHE HA H -10.461 -3.966 2.979 1.00 . A A . 15 PHE HA 1 1 15 4474 1 1 15 PHE HB2 H -10.343 -6.349 1.149 1.00 . A A . 15 PHE HB2 1 1 15 4475 1 1 15 PHE HB3 H -9.006 -5.971 2.230 1.00 . A A . 15 PHE HB3 1 1 15 4476 1 1 15 PHE HD1 H -10.050 -5.261 4.710 1.00 . A A . 15 PHE HD1 1 1 15 4477 1 1 15 PHE HD2 H -11.655 -8.050 1.924 1.00 . A A . 15 PHE HD2 1 1 15 4478 1 1 15 PHE HE1 H -11.204 -6.424 6.545 1.00 . A A . 15 PHE HE1 1 1 15 4479 1 1 15 PHE HE2 H -12.812 -9.218 3.755 1.00 . A A . 15 PHE HE2 1 1 15 4480 1 1 15 PHE HZ H -12.588 -8.405 6.069 1.00 . A A . 15 PHE HZ 1 1 15 4481 1 1 15 PHE N N -11.723 -4.199 1.364 1.00 . A A . 15 PHE N 1 1 15 4482 1 1 15 PHE O O -9.510 -3.295 0.027 1.00 . A A . 15 PHE O 1 1 15 4483 1 1 16 PRO C C -6.340 -3.389 0.212 1.00 . A A . 16 PRO C 1 1 15 4484 1 1 16 PRO CA C -7.167 -2.495 1.104 1.00 . A A . 16 PRO CA 1 1 15 4485 1 1 16 PRO CB C -6.359 -1.912 2.291 1.00 . A A . 16 PRO CB 1 1 15 4486 1 1 16 PRO CD C -7.954 -3.462 3.250 1.00 . A A . 16 PRO CD 1 1 15 4487 1 1 16 PRO CG C -6.492 -2.993 3.382 1.00 . A A . 16 PRO CG 1 1 15 4488 1 1 16 PRO HA H -7.604 -1.681 0.503 1.00 . A A . 16 PRO HA 1 1 15 4489 1 1 16 PRO HB2 H -5.313 -1.665 2.051 1.00 . A A . 16 PRO HB2 1 1 15 4490 1 1 16 PRO HB3 H -6.861 -1.004 2.659 1.00 . A A . 16 PRO HB3 1 1 15 4491 1 1 16 PRO HD2 H -8.039 -4.491 3.619 1.00 . A A . 16 PRO HD2 1 1 15 4492 1 1 16 PRO HD3 H -8.606 -2.793 3.834 1.00 . A A . 16 PRO HD3 1 1 15 4493 1 1 16 PRO HG2 H -5.802 -3.822 3.149 1.00 . A A . 16 PRO HG2 1 1 15 4494 1 1 16 PRO HG3 H -6.295 -2.617 4.397 1.00 . A A . 16 PRO HG3 1 1 15 4495 1 1 16 PRO N N -8.182 -3.262 1.822 1.00 . A A . 16 PRO N 1 1 15 4496 1 1 16 PRO O O -6.603 -4.580 0.175 1.00 . A A . 16 PRO O 1 1 15 4497 1 1 17 ILE C C -3.211 -3.869 -1.094 1.00 . A A . 17 ILE C 1 1 15 4498 1 1 17 ILE CA C -4.627 -3.570 -1.543 1.00 . A A . 17 ILE CA 1 1 15 4499 1 1 17 ILE CB C -4.646 -2.793 -2.897 1.00 . A A . 17 ILE CB 1 1 15 4500 1 1 17 ILE CD1 C -6.245 -1.627 -4.596 1.00 . A A . 17 ILE CD1 1 1 15 4501 1 1 17 ILE CG1 C -6.119 -2.536 -3.343 1.00 . A A . 17 ILE CG1 1 1 15 4502 1 1 17 ILE CG2 C -3.831 -3.557 -3.982 1.00 . A A . 17 ILE CG2 1 1 15 4503 1 1 17 ILE H H -5.147 -1.838 -0.424 1.00 . A A . 17 ILE H 1 1 15 4504 1 1 17 ILE HA H -5.125 -4.533 -1.745 1.00 . A A . 17 ILE HA 1 1 15 4505 1 1 17 ILE HB H -4.167 -1.813 -2.748 1.00 . A A . 17 ILE HB 1 1 15 4506 1 1 17 ILE HD11 H -7.303 -1.374 -4.769 1.00 . A A . 17 ILE HD11 1 1 15 4507 1 1 17 ILE HD12 H -5.684 -0.691 -4.450 1.00 . A A . 17 ILE HD12 1 1 15 4508 1 1 17 ILE HD13 H -5.871 -2.130 -5.500 1.00 . A A . 17 ILE HD13 1 1 15 4509 1 1 17 ILE HG12 H -6.622 -3.496 -3.540 1.00 . A A . 17 ILE HG12 1 1 15 4510 1 1 17 ILE HG13 H -6.662 -2.032 -2.527 1.00 . A A . 17 ILE HG13 1 1 15 4511 1 1 17 ILE HG21 H -4.310 -4.522 -4.209 1.00 . A A . 17 ILE HG21 1 1 15 4512 1 1 17 ILE HG22 H -3.755 -2.974 -4.912 1.00 . A A . 17 ILE HG22 1 1 15 4513 1 1 17 ILE HG23 H -2.803 -3.750 -3.641 1.00 . A A . 17 ILE HG23 1 1 15 4514 1 1 17 ILE N N -5.358 -2.813 -0.525 1.00 . A A . 17 ILE N 1 1 15 4515 1 1 17 ILE O O -2.881 -5.038 -0.975 1.00 . A A . 17 ILE O 1 1 15 4516 1 1 18 SER C C -0.676 -3.063 0.894 1.00 . A A . 18 SER C 1 1 15 4517 1 1 18 SER CA C -0.936 -3.096 -0.593 1.00 . A A . 18 SER CA 1 1 15 4518 1 1 18 SER CB C -0.106 -2.015 -1.337 1.00 . A A . 18 SER CB 1 1 15 4519 1 1 18 SER H H -2.659 -1.892 -0.891 1.00 . A A . 18 SER H 1 1 15 4520 1 1 18 SER HA H -0.618 -4.082 -0.971 1.00 . A A . 18 SER HA 1 1 15 4521 1 1 18 SER HB2 H 0.974 -2.153 -1.176 1.00 . A A . 18 SER HB2 1 1 15 4522 1 1 18 SER HB3 H -0.301 -2.102 -2.416 1.00 . A A . 18 SER HB3 1 1 15 4523 1 1 18 SER HG H -0.377 -0.529 -0.013 1.00 . A A . 18 SER HG 1 1 15 4524 1 1 18 SER N N -2.353 -2.845 -0.868 1.00 . A A . 18 SER N 1 1 15 4525 1 1 18 SER O O -1.607 -2.773 1.630 1.00 . A A . 18 SER O 1 1 15 4526 1 1 18 SER OG O -0.512 -0.695 -0.940 1.00 . A A . 18 SER OG 1 1 15 4527 1 1 19 PHE C C 2.168 -2.740 3.107 1.00 . A A . 19 PHE C 1 1 15 4528 1 1 19 PHE CA C 0.854 -3.408 2.777 1.00 . A A . 19 PHE CA 1 1 15 4529 1 1 19 PHE CB C 0.737 -4.877 3.257 1.00 . A A . 19 PHE CB 1 1 15 4530 1 1 19 PHE CD1 C -1.762 -5.380 3.297 1.00 . A A . 19 PHE CD1 1 1 15 4531 1 1 19 PHE CD2 C -0.443 -6.235 1.461 1.00 . A A . 19 PHE CD2 1 1 15 4532 1 1 19 PHE CE1 C -2.915 -5.923 2.719 1.00 . A A . 19 PHE CE1 1 1 15 4533 1 1 19 PHE CE2 C -1.587 -6.807 0.900 1.00 . A A . 19 PHE CE2 1 1 15 4534 1 1 19 PHE CG C -0.524 -5.515 2.659 1.00 . A A . 19 PHE CG 1 1 15 4535 1 1 19 PHE CZ C -2.827 -6.641 1.521 1.00 . A A . 19 PHE CZ 1 1 15 4536 1 1 19 PHE H H 1.310 -3.626 0.723 1.00 . A A . 19 PHE H 1 1 15 4537 1 1 19 PHE HA H 0.127 -2.797 3.321 1.00 . A A . 19 PHE HA 1 1 15 4538 1 1 19 PHE HB2 H 1.610 -5.431 2.894 1.00 . A A . 19 PHE HB2 1 1 15 4539 1 1 19 PHE HB3 H 0.709 -4.953 4.356 1.00 . A A . 19 PHE HB3 1 1 15 4540 1 1 19 PHE HD1 H -1.835 -4.852 4.242 1.00 . A A . 19 PHE HD1 1 1 15 4541 1 1 19 PHE HD2 H 0.511 -6.353 0.955 1.00 . A A . 19 PHE HD2 1 1 15 4542 1 1 19 PHE HE1 H -3.879 -5.790 3.200 1.00 . A A . 19 PHE HE1 1 1 15 4543 1 1 19 PHE HE2 H -1.511 -7.378 -0.022 1.00 . A A . 19 PHE HE2 1 1 15 4544 1 1 19 PHE HZ H -3.719 -7.068 1.075 1.00 . A A . 19 PHE HZ 1 1 15 4545 1 1 19 PHE N N 0.570 -3.364 1.344 1.00 . A A . 19 PHE N 1 1 15 4546 1 1 19 PHE O O 2.840 -2.287 2.196 1.00 . A A . 19 PHE O 1 1 15 4547 1 1 20 TYR C C 4.959 -2.374 4.279 1.00 . A A . 20 TYR C 1 1 15 4548 1 1 20 TYR CA C 3.664 -1.786 4.795 1.00 . A A . 20 TYR CA 1 1 15 4549 1 1 20 TYR CB C 3.692 -1.546 6.340 1.00 . A A . 20 TYR CB 1 1 15 4550 1 1 20 TYR CD1 C 3.145 0.925 6.399 1.00 . A A . 20 TYR CD1 1 1 15 4551 1 1 20 TYR CD2 C 5.245 0.226 7.357 1.00 . A A . 20 TYR CD2 1 1 15 4552 1 1 20 TYR CE1 C 3.462 2.258 6.667 1.00 . A A . 20 TYR CE1 1 1 15 4553 1 1 20 TYR CE2 C 5.559 1.559 7.638 1.00 . A A . 20 TYR CE2 1 1 15 4554 1 1 20 TYR CG C 4.049 -0.098 6.708 1.00 . A A . 20 TYR CG 1 1 15 4555 1 1 20 TYR CZ C 4.672 2.584 7.285 1.00 . A A . 20 TYR CZ 1 1 15 4556 1 1 20 TYR H H 1.989 -3.081 5.114 1.00 . A A . 20 TYR H 1 1 15 4557 1 1 20 TYR HA H 3.533 -0.816 4.292 1.00 . A A . 20 TYR HA 1 1 15 4558 1 1 20 TYR HB2 H 2.692 -1.681 6.775 1.00 . A A . 20 TYR HB2 1 1 15 4559 1 1 20 TYR HB3 H 4.355 -2.278 6.826 1.00 . A A . 20 TYR HB3 1 1 15 4560 1 1 20 TYR HD1 H 2.187 0.684 5.952 1.00 . A A . 20 TYR HD1 1 1 15 4561 1 1 20 TYR HD2 H 5.938 -0.556 7.647 1.00 . A A . 20 TYR HD2 1 1 15 4562 1 1 20 TYR HE1 H 2.767 3.045 6.395 1.00 . A A . 20 TYR HE1 1 1 15 4563 1 1 20 TYR HE2 H 6.497 1.790 8.133 1.00 . A A . 20 TYR HE2 1 1 15 4564 1 1 20 TYR HH H 5.811 4.073 7.954 1.00 . A A . 20 TYR HH 1 1 15 4565 1 1 20 TYR N N 2.531 -2.631 4.406 1.00 . A A . 20 TYR N 1 1 15 4566 1 1 20 TYR O O 4.922 -3.383 3.593 1.00 . A A . 20 TYR O 1 1 15 4567 1 1 20 TYR OH O 4.971 3.927 7.534 1.00 . A A . 20 TYR OH 1 1 15 4568 1 1 21 GLY C C 7.753 -1.712 2.798 1.00 . A A . 21 GLY C 1 1 15 4569 1 1 21 GLY CA C 7.400 -2.304 4.133 1.00 . A A . 21 GLY CA 1 1 15 4570 1 1 21 GLY H H 6.138 -0.898 5.094 1.00 . A A . 21 GLY H 1 1 15 4571 1 1 21 GLY HA2 H 8.198 -2.053 4.850 1.00 . A A . 21 GLY HA2 1 1 15 4572 1 1 21 GLY HA3 H 7.368 -3.401 4.044 1.00 . A A . 21 GLY HA3 1 1 15 4573 1 1 21 GLY N N 6.123 -1.761 4.592 1.00 . A A . 21 GLY N 1 1 15 4574 1 1 21 GLY O O 8.898 -1.956 2.332 1.00 . A A . 21 GLY O 1 1 15 4575 1 1 21 GLY OXT O 6.896 -1.005 2.205 1.00 . A A . 21 GLY OXT 1 1 stop_ save_
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