NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
392832 | 1q71 | cing | 4-filtered-FRED | STAR | entry | full | 116 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1q71 # This FRED archive file contains, for PDB entry <1q71>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_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.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_1q71 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1q71 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2107.32 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 A . 1 1 stop_ save_ save_microcin_J25 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "microcin J25" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GGAGHVPEYFVGIGTPISFYG _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 GLY . 1 1 13 ILE . 1 1 14 GLY . 1 1 15 THR . 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 GLY 12 12 1 1 ILE 13 13 1 1 GLY 14 14 1 1 THR 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_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 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 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 2 GLY H . 2 . HN 1 1 1 1 2 1 1 3 ALA H . 3 . HN 1 1 2 1 1 1 1 2 GLY H . 2 . HN 1 1 2 1 2 1 1 18 SER HB2 . 18 . HB2 1 1 3 1 1 1 1 2 GLY H . 2 . HN 1 1 3 1 2 1 1 18 SER HB3 . 18 . HB1 1 1 4 1 1 1 1 2 GLY H . 2 . HN 1 1 4 1 2 1 1 19 PHE H . 19 . HN 1 1 5 1 1 1 1 2 GLY HA2 . 2 . HA2 1 1 5 1 2 1 1 3 ALA H . 3 . HN 1 1 6 1 1 1 1 2 GLY HA3 . 2 . HA1 1 1 6 1 2 1 1 3 ALA H . 3 . HN 1 1 7 1 1 1 1 3 ALA HA . 3 . HA 1 1 7 1 2 1 1 4 GLY H . 4 . HN 1 1 8 1 1 1 1 3 ALA HA . 3 . HA 1 1 8 1 2 1 1 19 PHE HB2 . 19 . HB2 1 1 9 1 1 1 1 3 ALA HA . 3 . HA 1 1 9 1 2 1 1 19 PHE QB . 19 . HB# 1 1 10 1 1 1 1 3 ALA HA . 3 . HA 1 1 10 1 2 1 1 19 PHE HB3 . 19 . HB1 1 1 11 1 1 1 1 3 ALA HA . 3 . HA 1 1 11 1 2 1 1 19 PHE QD . 19 . HD# 1 1 12 1 1 1 1 4 GLY H . 4 . HN 1 1 12 1 2 1 1 19 PHE HB2 . 19 . HB2 1 1 13 1 1 1 1 4 GLY H . 4 . HN 1 1 13 1 2 1 1 19 PHE QB . 19 . HB# 1 1 14 1 1 1 1 4 GLY H . 4 . HN 1 1 14 1 2 1 1 19 PHE HB3 . 19 . HB1 1 1 15 1 1 1 1 4 GLY HA2 . 4 . HA2 1 1 15 1 2 1 1 5 HIS H . 5 . HN 1 1 16 1 1 1 1 4 GLY HA2 . 4 . HA2 1 1 16 1 2 1 1 19 PHE HB2 . 19 . HB2 1 1 17 1 1 1 1 4 GLY HA2 . 4 . HA2 1 1 17 1 2 1 1 19 PHE HB3 . 19 . HB1 1 1 18 1 1 1 1 4 GLY HA3 . 4 . HA1 1 1 18 1 2 1 1 5 HIS H . 5 . HN 1 1 19 1 1 1 1 4 GLY HA3 . 4 . HA1 1 1 19 1 2 1 1 19 PHE HB2 . 19 . HB2 1 1 20 1 1 1 1 4 GLY HA3 . 4 . HA1 1 1 20 1 2 1 1 19 PHE HB3 . 19 . HB1 1 1 21 1 1 1 1 5 HIS H . 5 . HN 1 1 21 1 2 1 1 6 VAL H . 6 . HN 1 1 22 1 1 1 1 5 HIS HA . 5 . HA 1 1 22 1 2 1 1 19 PHE QD . 19 . HD# 1 1 23 1 1 1 1 5 HIS HB2 . 5 . HB2 1 1 23 1 2 1 1 6 VAL H . 6 . HN 1 1 24 1 1 1 1 5 HIS HB3 . 5 . HB1 1 1 24 1 2 1 1 6 VAL H . 6 . HN 1 1 25 1 1 1 1 6 VAL H . 6 . HN 1 1 25 1 2 1 1 19 PHE QB . 19 . HB# 1 1 26 1 1 1 1 6 VAL H . 6 . HN 1 1 26 1 2 1 1 19 PHE QD . 19 . HD# 1 1 27 1 1 1 1 6 VAL H . 6 . HN 1 1 27 1 2 1 1 20 TYR H . 20 . HN 1 1 28 1 1 1 1 6 VAL HA . 6 . HA 1 1 28 1 2 1 1 7 PRO HD2 . 7 . HD2 1 1 29 1 1 1 1 6 VAL HA . 6 . HA 1 1 29 1 2 1 1 7 PRO HD3 . 7 . HD1 1 1 30 1 1 1 1 6 VAL HB . 6 . HB 1 1 30 1 2 1 1 20 TYR H . 20 . HN 1 1 31 1 1 1 1 6 VAL HB . 6 . HB 1 1 31 1 2 1 1 20 TYR QE . 20 . HE# 1 1 32 1 1 1 1 6 VAL QG . 6 . HG* 1 1 32 1 2 1 1 20 TYR QE . 20 . HE# 1 1 33 1 1 1 1 7 PRO HA . 7 . HA 1 1 33 1 2 1 1 8 GLU H . 8 . HN 1 1 34 1 1 1 1 7 PRO HA . 7 . HA 1 1 34 1 2 1 1 19 PHE HA . 19 . HA 1 1 35 1 1 1 1 7 PRO HA . 7 . HA 1 1 35 1 2 1 1 19 PHE QD . 19 . HD# 1 1 36 1 1 1 1 7 PRO HB2 . 7 . HB2 1 1 36 1 2 1 1 19 PHE QD . 19 . HD# 1 1 37 1 1 1 1 7 PRO HD2 . 7 . HD2 1 1 37 1 2 1 1 19 PHE QD . 19 . HD# 1 1 38 1 1 1 1 7 PRO HG2 . 7 . HG2 1 1 38 1 2 1 1 19 PHE QD . 19 . HD# 1 1 39 1 1 1 1 8 GLU H . 8 . HN 1 1 39 1 2 1 1 9 TYR H . 9 . HN 1 1 40 1 1 1 1 8 GLU H . 8 . HN 1 1 40 1 2 1 1 19 PHE HA . 19 . HA 1 1 41 1 1 1 1 8 GLU H . 8 . HN 1 1 41 1 2 1 1 20 TYR H . 20 . HN 1 1 42 1 1 1 1 8 GLU HA . 8 . HA 1 1 42 1 2 1 1 20 TYR QD . 20 . HD# 1 1 43 1 1 1 1 8 GLU HA . 8 . HA 1 1 43 1 2 1 1 20 TYR QE . 20 . HE# 1 1 44 1 1 1 1 8 GLU HB2 . 8 . HB2 1 1 44 1 2 1 1 9 TYR H . 9 . HN 1 1 45 1 1 1 1 8 GLU HB2 . 8 . HB2 1 1 45 1 2 1 1 20 TYR QD . 20 . HD# 1 1 46 1 1 1 1 8 GLU HB3 . 8 . HB1 1 1 46 1 2 1 1 9 TYR H . 9 . HN 1 1 47 1 1 1 1 8 GLU HB3 . 8 . HB1 1 1 47 1 2 1 1 20 TYR QD . 20 . HD# 1 1 48 1 1 1 1 8 GLU QG . 8 . HG# 1 1 48 1 2 1 1 9 TYR H . 9 . HN 1 1 49 1 1 1 1 8 GLU QG . 8 . HG# 1 1 49 1 2 1 1 19 PHE HA . 19 . HA 1 1 50 1 1 1 1 8 GLU QG . 8 . HG# 1 1 50 1 2 1 1 20 TYR QD . 20 . HD# 1 1 51 1 1 1 1 8 GLU HG2 . 8 . HG2 1 1 51 1 2 1 1 19 PHE HA . 19 . HA 1 1 52 1 1 1 1 8 GLU HG2 . 8 . HG2 1 1 52 1 2 1 1 20 TYR QD . 20 . HD# 1 1 53 1 1 1 1 8 GLU HG3 . 8 . HG1 1 1 53 1 2 1 1 19 PHE HA . 19 . HA 1 1 54 1 1 1 1 8 GLU HG3 . 8 . HG1 1 1 54 1 2 1 1 20 TYR QD . 20 . HD# 1 1 55 1 1 1 1 9 TYR HA . 9 . HA 1 1 55 1 2 1 1 10 PHE H . 10 . HN 1 1 56 1 1 1 1 9 TYR HB2 . 9 . HB2 1 1 56 1 2 1 1 10 PHE H . 10 . HN 1 1 57 1 1 1 1 9 TYR HB3 . 9 . HB1 1 1 57 1 2 1 1 10 PHE H . 10 . HN 1 1 58 1 1 1 1 10 PHE HA . 10 . HA 1 1 58 1 2 1 1 11 VAL H . 11 . HN 1 1 59 1 1 1 1 10 PHE HA . 10 . HA 1 1 59 1 2 1 1 16 PRO HA . 16 . HA 1 1 60 1 1 1 1 10 PHE HA . 10 . HA 1 1 60 1 2 1 1 17 ILE H . 17 . HN 1 1 61 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 61 1 2 1 1 11 VAL H . 11 . HN 1 1 62 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 62 1 2 1 1 11 VAL H . 11 . HN 1 1 63 1 1 1 1 11 VAL HA . 11 . HA 1 1 63 1 2 1 1 12 GLY H . 12 . HN 1 1 64 1 1 1 1 11 VAL HB . 11 . HB 1 1 64 1 2 1 1 12 GLY H . 12 . HN 1 1 65 1 1 1 1 11 VAL QG . 11 . HG* 1 1 65 1 2 1 1 12 GLY H . 12 . HN 1 1 66 1 1 1 1 12 GLY H . 12 . HN 1 1 66 1 2 1 1 13 ILE H . 13 . HN 1 1 67 1 1 1 1 12 GLY QA . 12 . HA# 1 1 67 1 2 1 1 13 ILE H . 13 . HN 1 1 68 1 1 1 1 12 GLY HA2 . 12 . HA2 1 1 68 1 2 1 1 13 ILE H . 13 . HN 1 1 69 1 1 1 1 12 GLY HA3 . 12 . HA1 1 1 69 1 2 1 1 13 ILE H . 13 . HN 1 1 70 1 1 1 1 13 ILE H . 13 . HN 1 1 70 1 2 1 1 14 GLY H . 14 . HN 1 1 71 1 1 1 1 13 ILE HA . 13 . HA 1 1 71 1 2 1 1 14 GLY H . 14 . HN 1 1 72 1 1 1 1 13 ILE MG . 13 . HG2# 1 1 72 1 2 1 1 14 GLY H . 14 . HN 1 1 73 1 1 1 1 14 GLY H . 14 . HN 1 1 73 1 2 1 1 15 THR H . 15 . HN 1 1 74 1 1 1 1 15 THR HA . 15 . HA 1 1 74 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1 75 1 1 1 1 15 THR HA . 15 . HA 1 1 75 1 2 1 1 16 PRO HD3 . 16 . HD1 1 1 76 1 1 1 1 16 PRO HA . 16 . HA 1 1 76 1 2 1 1 17 ILE H . 17 . HN 1 1 77 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 77 1 2 1 1 19 PHE QE . 19 . HE# 1 1 78 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 78 1 2 1 1 17 ILE H . 17 . HN 1 1 79 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 79 1 2 1 1 19 PHE QE . 19 . HE# 1 1 80 1 1 1 1 16 PRO HG2 . 16 . HG2 1 1 80 1 2 1 1 19 PHE QE . 19 . HE# 1 1 81 1 1 1 1 16 PRO HG3 . 16 . HG1 1 1 81 1 2 1 1 19 PHE QE . 19 . HE# 1 1 82 1 1 1 1 17 ILE H . 17 . HN 1 1 82 1 2 1 1 18 SER H . 18 . HN 1 1 83 1 1 1 1 17 ILE HA . 17 . HA 1 1 83 1 2 1 1 18 SER H . 18 . HN 1 1 84 1 1 1 1 17 ILE QG . 17 . HG1# 1 1 84 1 2 1 1 18 SER H . 18 . HN 1 1 85 1 1 1 1 17 ILE MG . 17 . HG2# 1 1 85 1 2 1 1 18 SER H . 18 . HN 1 1 86 1 1 1 1 17 ILE MG . 17 . HG2# 1 1 86 1 2 1 1 19 PHE QE . 19 . HE# 1 1 87 1 1 1 1 18 SER HA . 18 . HA 1 1 87 1 2 1 1 19 PHE H . 19 . HN 1 1 88 1 1 1 1 18 SER HA . 18 . HA 1 1 88 1 2 1 1 19 PHE QD . 19 . HD# 1 1 89 1 1 1 1 18 SER HB2 . 18 . HB2 1 1 89 1 2 1 1 19 PHE H . 19 . HN 1 1 90 1 1 1 1 18 SER HB2 . 18 . HB2 1 1 90 1 2 1 1 19 PHE QD . 19 . HD# 1 1 91 1 1 1 1 18 SER HB3 . 18 . HB1 1 1 91 1 2 1 1 19 PHE H . 19 . HN 1 1 92 1 1 1 1 19 PHE HA . 19 . HA 1 1 92 1 2 1 1 20 TYR H . 20 . HN 1 1 93 1 1 1 1 19 PHE HB2 . 19 . HB2 1 1 93 1 2 1 1 20 TYR H . 20 . HN 1 1 94 1 1 1 1 19 PHE HB3 . 19 . HB1 1 1 94 1 2 1 1 20 TYR H . 20 . HN 1 1 95 1 1 1 1 19 PHE QD . 19 . HD# 1 1 95 1 2 1 1 20 TYR H . 20 . HN 1 1 96 1 1 1 1 20 TYR HA . 20 . HA 1 1 96 1 2 1 1 21 GLY H . 21 . HN 1 1 97 1 1 1 1 20 TYR HB2 . 20 . HB2 1 1 97 1 2 1 1 21 GLY H . 21 . HN 1 1 98 1 1 1 1 20 TYR HB3 . 20 . HB1 1 1 98 1 2 1 1 21 GLY H . 21 . HN 1 1 99 1 1 1 1 20 TYR QD . 20 . HD# 1 1 99 1 2 1 1 21 GLY H . 21 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.185 1.8 4.77 1 1 2 1 . . . . . 3.42 1.8 5.04 1 1 3 1 . . . . . 3.555 1.8 5.31 1 1 4 1 . . . . . 2.44 1.8 3.08 1 1 5 1 . . . . . 2.52 1.8 3.24 1 1 6 1 . . . . . 2.52 1.8 3.24 1 1 7 1 . . . . . 2.24 1.8 2.68 1 1 8 1 . . . . . 3.11 1.8 4.42 1 1 9 1 . . . . . 3.03 1.8 4.26 1 1 10 1 . . . . . 3.11 1.8 4.42 1 1 11 1 . . . . . 4.445 1.8 7.09 1 1 12 1 . . . . . 3.045 1.8 4.29 1 1 13 1 . . . . . 2.97 1.8 4.14 1 1 14 1 . . . . . 3.045 1.8 4.29 1 1 15 1 . . . . . 2.505 1.8 3.21 1 1 16 1 . . . . . 3.955 1.8 6.11 1 1 17 1 . . . . . 3.955 1.8 6.11 1 1 18 1 . . . . . 2.505 1.8 3.21 1 1 19 1 . . . . . 3.955 1.8 6.11 1 1 20 1 . . . . . 3.955 1.8 6.11 1 1 21 1 . . . . . 2.27 1.8 2.74 1 1 22 1 . . . . . 4.71 1.8 7.62 1 1 23 1 . . . . . 3.65 1.8 5.5 1 1 24 1 . . . . . 3.4 1.8 5.0 1 1 25 1 . . . . . 3.655 1.8 5.51 1 1 26 1 . . . . . 4.71 1.8 7.62 1 1 27 1 . . . . . 2.47 1.8 3.14 1 1 28 1 . . . . . 2.145 1.8 2.49 1 1 29 1 . . . . . 2.24 1.8 2.68 1 1 30 1 . . . . . 3.57 1.8 5.34 1 1 31 1 . . . . . 4.715 1.8 6.0 1 1 32 1 . . . . . 5.405 1.8 7.01 1 1 33 1 . . . . . 2.13 1.8 2.46 1 1 34 1 . . . . . 2.41 1.8 3.02 1 1 35 1 . . . . . 3.875 1.8 5.95 1 1 36 1 . . . . . 4.6 1.8 7.4 1 1 37 1 . . . . . 4.71 1.8 7.62 1 1 38 1 . . . . . 4.6 1.8 7.4 1 1 39 1 . . . . . 2.455 1.8 3.11 1 1 40 1 . . . . . 2.255 1.8 2.71 1 1 41 1 . . . . . 3.2 1.8 4.6 1 1 42 1 . . . . . 4.69 1.8 7.58 1 1 43 1 . . . . . 4.715 1.8 7.63 1 1 44 1 . . . . . 2.985 1.8 4.17 1 1 45 1 . . . . . 4.72 1.8 7.64 1 1 46 1 . . . . . 3.17 1.8 4.54 1 1 47 1 . . . . . 4.72 1.8 7.64 1 1 48 1 . . . . . 4.025 1.8 6.25 1 1 49 1 . . . . . 3.47 1.8 5.14 1 1 50 1 . . . . . 4.495 1.8 7.19 1 1 51 1 . . . . . 3.605 1.8 5.41 1 1 52 1 . . . . . 4.72 1.8 7.64 1 1 53 1 . . . . . 3.605 1.8 5.41 1 1 54 1 . . . . . 4.72 1.8 7.64 1 1 55 1 . . . . . 2.225 1.8 2.85 1 1 56 1 . . . . . 2.86 1.8 3.92 1 1 57 1 . . . . . 3.65 1.8 5.5 1 1 58 1 . . . . . 2.195 1.8 2.79 1 1 59 1 . . . . . 2.8 1.8 3.8 1 1 60 1 . . . . . 3.4 1.8 5.0 1 1 61 1 . . . . . 2.75 1.8 3.9 1 1 62 1 . . . . . 3.34 1.8 4.88 1 1 63 1 . . . . . 2.365 1.8 2.93 1 1 64 1 . . . . . 2.83 1.8 3.86 1 1 65 1 . . . . . 4.945 1.8 8.09 1 1 66 1 . . . . . 2.52 1.8 3.24 1 1 67 1 . . . . . 2.435 1.8 3.07 1 1 68 1 . . . . . 2.58 1.8 3.36 1 1 69 1 . . . . . 2.58 1.8 3.36 1 1 70 1 . . . . . 2.78 1.8 3.76 1 1 71 1 . . . . . 2.3 1.8 2.8 1 1 72 1 . . . . . 4.165 1.8 6.53 1 1 73 1 . . . . . 2.55 1.8 3.3 1 1 74 1 . . . . . 2.285 1.8 2.77 1 1 75 1 . . . . . 2.27 1.8 2.74 1 1 76 1 . . . . . 2.145 1.8 2.49 1 1 77 1 . . . . . 4.71 1.8 6.22 1 1 78 1 . . . . . 2.92 1.8 4.04 1 1 79 1 . . . . . 4.385 1.8 5.97 1 1 80 1 . . . . . 4.71 1.8 6.22 1 1 81 1 . . . . . 4.215 1.8 5.63 1 1 82 1 . . . . . 2.34 1.8 2.88 1 1 83 1 . . . . . 2.255 1.8 2.71 1 1 84 1 . . . . . 4.09 1.8 6.38 1 1 85 1 . . . . . 4.085 1.8 6.37 1 1 86 1 . . . . . 5.145 1.8 8.49 1 1 87 1 . . . . . 2.435 1.8 3.07 1 1 88 1 . . . . . 3.98 1.8 6.16 1 1 89 1 . . . . . 2.315 1.8 2.83 1 1 90 1 . . . . . 4.71 1.8 7.62 1 1 91 1 . . . . . 2.815 1.8 3.83 1 1 92 1 . . . . . 2.255 1.8 2.71 1 1 93 1 . . . . . 2.455 1.8 3.11 1 1 94 1 . . . . . 2.455 1.8 3.11 1 1 95 1 . . . . . 4.71 1.8 7.62 1 1 96 1 . . . . . 2.285 1.8 2.77 1 1 97 1 . . . . . 2.62 1.8 3.44 1 1 98 1 . . . . . 2.62 1.8 3.44 1 1 99 1 . . . . . 4.625 1.8 7.45 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 9 TYR C 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE C -179.99998 -20.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 2 . 1 1 8 GLU C 1 1 9 TYR N 1 1 9 TYR CA 1 1 9 TYR C -179.99998 -20.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 3 . 1 1 14 GLY C 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C -150.0 -89.99999 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 4 . 1 1 16 PRO C 1 1 17 ILE N 1 1 17 ILE CA 1 1 17 ILE C -150.0 -89.99999 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 5 . 1 1 17 ILE C 1 1 18 SER N 1 1 18 SER CA 1 1 18 SER C -179.99998 -20.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 6 . 1 1 18 SER C 1 1 19 PHE N 1 1 19 PHE CA 1 1 19 PHE C -150.0 -89.99999 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 7 . 1 1 19 PHE C 1 1 20 TYR N 1 1 20 TYR CA 1 1 20 TYR C -179.99998 -20.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 8 . 1 1 2 GLY C 1 1 3 ALA N 1 1 3 ALA CA 1 1 3 ALA C -150.0 -89.99999 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 9 . 1 1 5 HIS C 1 1 6 VAL N 1 1 6 VAL CA 1 1 6 VAL C -150.0 -89.99999 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 10 . 1 1 7 PRO C 1 1 8 GLU N 1 1 8 GLU CA 1 1 8 GLU C -150.0 -89.99999 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 11 . 1 1 10 PHE C 1 1 11 VAL N 1 1 11 VAL CA 1 1 11 VAL C -179.99998 -20.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 12 . 1 1 12 GLY C 1 1 13 ILE N 1 1 13 ILE CA 1 1 13 ILE C -179.99998 -20.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 13 . 1 1 18 SER N 1 1 18 SER CA 1 1 18 SER CB 1 1 18 SER OG 30.0 89.99999 . 18 . N . 18 . CA . 18 . CB . 18 . OG 1 1 14 . 1 1 5 HIS N 1 1 5 HIS CA 1 1 5 HIS CB 1 1 5 HIS CG -89.99999 -30.0 . 5 . N . 5 . CA . 5 . CB . 5 . CG 1 1 15 . 1 1 8 GLU N 1 1 8 GLU CA 1 1 8 GLU CB 1 1 8 GLU CG -89.99999 -30.0 . 8 . N . 8 . CA . 8 . CB . 8 . CG 1 1 16 . 1 1 9 TYR N 1 1 9 TYR CA 1 1 9 TYR CB 1 1 9 TYR CG -89.99999 -30.0 . 9 . N . 9 . CA . 9 . CB . 9 . CG 1 1 17 . 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE CB 1 1 10 PHE CG -89.99999 -30.0 . 10 . N . 10 . CA . 10 . CB . 10 . CG 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 -8.277 -3.593 1.275 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -8.655 -2.472 0.322 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H2 H -7.167 -1.069 -0.226 1.00 . A A . 1 GLY H2 1 1 1 4 1 1 1 GLY HA2 H -9.087 -1.664 0.893 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H -9.393 -2.841 -0.374 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N -7.522 -1.956 -0.431 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O -9.024 -4.555 1.433 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 GLY C C -5.278 -4.210 3.366 1.00 . A A . 2 GLY C 1 1 1 9 1 1 2 GLY CA C -6.675 -4.485 2.847 1.00 . A A . 2 GLY CA 1 1 1 10 1 1 2 GLY H H -6.565 -2.683 1.750 1.00 . A A . 2 GLY H 1 1 1 11 1 1 2 GLY HA2 H -7.359 -4.519 3.682 1.00 . A A . 2 GLY HA2 1 1 1 12 1 1 2 GLY HA3 H -6.680 -5.443 2.349 1.00 . A A . 2 GLY HA3 1 1 1 13 1 1 2 GLY N N -7.123 -3.468 1.915 1.00 . A A . 2 GLY N 1 1 1 14 1 1 2 GLY O O -4.933 -3.061 3.657 1.00 . A A . 2 GLY O 1 1 1 15 1 1 3 ALA C C -2.192 -6.123 3.218 1.00 . A A . 3 ALA C 1 1 1 16 1 1 3 ALA CA C -3.095 -5.130 3.936 1.00 . A A . 3 ALA CA 1 1 1 17 1 1 3 ALA CB C -3.032 -5.347 5.442 1.00 . A A . 3 ALA CB 1 1 1 18 1 1 3 ALA H H -4.794 -6.142 3.194 1.00 . A A . 3 ALA H 1 1 1 19 1 1 3 ALA HA H -2.756 -4.126 3.723 1.00 . A A . 3 ALA HA 1 1 1 20 1 1 3 ALA HB1 H -2.016 -5.574 5.730 1.00 . A A . 3 ALA HB1 1 1 1 21 1 1 3 ALA HB2 H -3.677 -6.167 5.716 1.00 . A A . 3 ALA HB2 1 1 1 22 1 1 3 ALA HB3 H -3.357 -4.449 5.948 1.00 . A A . 3 ALA HB3 1 1 1 23 1 1 3 ALA N N -4.467 -5.255 3.461 1.00 . A A . 3 ALA N 1 1 1 24 1 1 3 ALA O O -2.598 -7.246 2.937 1.00 . A A . 3 ALA O 1 1 1 25 1 1 4 GLY C C 1.212 -5.797 1.802 1.00 . A A . 4 GLY C 1 1 1 26 1 1 4 GLY CA C -0.038 -6.547 2.213 1.00 . A A . 4 GLY CA 1 1 1 27 1 1 4 GLY H H -0.710 -4.784 3.154 1.00 . A A . 4 GLY H 1 1 1 28 1 1 4 GLY HA2 H 0.239 -7.366 2.860 1.00 . A A . 4 GLY HA2 1 1 1 29 1 1 4 GLY HA3 H -0.515 -6.944 1.329 1.00 . A A . 4 GLY HA3 1 1 1 30 1 1 4 GLY N N -0.975 -5.694 2.911 1.00 . A A . 4 GLY N 1 1 1 31 1 1 4 GLY O O 1.854 -5.152 2.629 1.00 . A A . 4 GLY O 1 1 1 32 1 1 5 HIS C C 2.354 -4.167 -1.039 1.00 . A A . 5 HIS C 1 1 1 33 1 1 5 HIS CA C 2.742 -5.211 0.001 1.00 . A A . 5 HIS CA 1 1 1 34 1 1 5 HIS CB C 3.713 -6.220 -0.629 1.00 . A A . 5 HIS CB 1 1 1 35 1 1 5 HIS CD2 C 5.217 -7.547 1.018 1.00 . A A . 5 HIS CD2 1 1 1 36 1 1 5 HIS CE1 C 3.886 -9.254 1.363 1.00 . A A . 5 HIS CE1 1 1 1 37 1 1 5 HIS CG C 4.101 -7.350 0.277 1.00 . A A . 5 HIS CG 1 1 1 38 1 1 5 HIS H H 1.004 -6.418 -0.092 1.00 . A A . 5 HIS H 1 1 1 39 1 1 5 HIS HA H 3.236 -4.717 0.825 1.00 . A A . 5 HIS HA 1 1 1 40 1 1 5 HIS HB2 H 3.254 -6.646 -1.508 1.00 . A A . 5 HIS HB2 1 1 1 41 1 1 5 HIS HB3 H 4.617 -5.702 -0.919 1.00 . A A . 5 HIS HB3 1 1 1 42 1 1 5 HIS HD1 H 2.395 -8.602 0.103 1.00 . A A . 5 HIS HD1 1 1 1 43 1 1 5 HIS HD2 H 6.072 -6.888 1.075 1.00 . A A . 5 HIS HD2 1 1 1 44 1 1 5 HIS HE1 H 3.484 -10.187 1.729 1.00 . A A . 5 HIS HE1 1 1 1 45 1 1 5 HIS HE2 H 5.643 -9.071 2.396 1.00 . A A . 5 HIS HE2 1 1 1 46 1 1 5 HIS N N 1.560 -5.882 0.525 1.00 . A A . 5 HIS N 1 1 1 47 1 1 5 HIS ND1 N 3.291 -8.440 0.515 1.00 . A A . 5 HIS ND1 1 1 1 48 1 1 5 HIS NE2 N 5.058 -8.737 1.685 1.00 . A A . 5 HIS NE2 1 1 1 49 1 1 5 HIS O O 2.968 -3.105 -1.119 1.00 . A A . 5 HIS O 1 1 1 50 1 1 6 VAL C C -0.164 -2.609 -2.323 1.00 . A A . 6 VAL C 1 1 1 51 1 1 6 VAL CA C 0.888 -3.562 -2.880 1.00 . A A . 6 VAL CA 1 1 1 52 1 1 6 VAL CB C 0.296 -4.328 -4.086 1.00 . A A . 6 VAL CB 1 1 1 53 1 1 6 VAL CG1 C -0.127 -3.366 -5.188 1.00 . A A . 6 VAL CG1 1 1 1 54 1 1 6 VAL CG2 C 1.294 -5.346 -4.615 1.00 . A A . 6 VAL CG2 1 1 1 55 1 1 6 VAL H H 0.889 -5.348 -1.735 1.00 . A A . 6 VAL H 1 1 1 56 1 1 6 VAL HA H 1.739 -2.990 -3.222 1.00 . A A . 6 VAL HA 1 1 1 57 1 1 6 VAL HB H -0.581 -4.860 -3.751 1.00 . A A . 6 VAL HB 1 1 1 58 1 1 6 VAL HG11 H 0.645 -3.321 -5.941 1.00 . A A . 6 VAL HG11 1 1 1 59 1 1 6 VAL HG12 H -0.278 -2.383 -4.769 1.00 . A A . 6 VAL HG12 1 1 1 60 1 1 6 VAL HG13 H -1.046 -3.714 -5.635 1.00 . A A . 6 VAL HG13 1 1 1 61 1 1 6 VAL HG21 H 2.190 -4.838 -4.940 1.00 . A A . 6 VAL HG21 1 1 1 62 1 1 6 VAL HG22 H 0.859 -5.877 -5.450 1.00 . A A . 6 VAL HG22 1 1 1 63 1 1 6 VAL HG23 H 1.543 -6.047 -3.834 1.00 . A A . 6 VAL HG23 1 1 1 64 1 1 6 VAL N N 1.342 -4.477 -1.841 1.00 . A A . 6 VAL N 1 1 1 65 1 1 6 VAL O O -1.200 -3.045 -1.842 1.00 . A A . 6 VAL O 1 1 1 66 1 1 7 PRO C C -2.106 -0.158 -2.672 1.00 . A A . 7 PRO C 1 1 1 67 1 1 7 PRO CA C -0.818 -0.276 -1.856 1.00 . A A . 7 PRO CA 1 1 1 68 1 1 7 PRO CB C -0.005 1.016 -1.947 1.00 . A A . 7 PRO CB 1 1 1 69 1 1 7 PRO CD C 1.336 -0.705 -2.917 1.00 . A A . 7 PRO CD 1 1 1 70 1 1 7 PRO CG C 1.014 0.757 -3.003 1.00 . A A . 7 PRO CG 1 1 1 71 1 1 7 PRO HA H -1.072 -0.466 -0.822 1.00 . A A . 7 PRO HA 1 1 1 72 1 1 7 PRO HB2 H -0.656 1.835 -2.219 1.00 . A A . 7 PRO HB2 1 1 1 73 1 1 7 PRO HB3 H 0.460 1.220 -0.994 1.00 . A A . 7 PRO HB3 1 1 1 74 1 1 7 PRO HD2 H 1.551 -1.103 -3.899 1.00 . A A . 7 PRO HD2 1 1 1 75 1 1 7 PRO HD3 H 2.171 -0.871 -2.252 1.00 . A A . 7 PRO HD3 1 1 1 76 1 1 7 PRO HG2 H 0.604 0.996 -3.973 1.00 . A A . 7 PRO HG2 1 1 1 77 1 1 7 PRO HG3 H 1.898 1.348 -2.812 1.00 . A A . 7 PRO HG3 1 1 1 78 1 1 7 PRO N N 0.103 -1.299 -2.371 1.00 . A A . 7 PRO N 1 1 1 79 1 1 7 PRO O O -2.083 -0.211 -3.901 1.00 . A A . 7 PRO O 1 1 1 80 1 1 8 GLU C C -4.914 1.607 -2.803 1.00 . A A . 8 GLU C 1 1 1 81 1 1 8 GLU CA C -4.526 0.140 -2.618 1.00 . A A . 8 GLU CA 1 1 1 82 1 1 8 GLU CB C -5.611 -0.568 -1.803 1.00 . A A . 8 GLU CB 1 1 1 83 1 1 8 GLU CD C -6.964 -2.670 -1.406 1.00 . A A . 8 GLU CD 1 1 1 84 1 1 8 GLU CG C -5.788 -2.040 -2.140 1.00 . A A . 8 GLU CG 1 1 1 85 1 1 8 GLU H H -3.170 0.043 -0.993 1.00 . A A . 8 GLU H 1 1 1 86 1 1 8 GLU HA H -4.460 -0.326 -3.589 1.00 . A A . 8 GLU HA 1 1 1 87 1 1 8 GLU HB2 H -5.362 -0.493 -0.755 1.00 . A A . 8 GLU HB2 1 1 1 88 1 1 8 GLU HB3 H -6.552 -0.068 -1.974 1.00 . A A . 8 GLU HB3 1 1 1 89 1 1 8 GLU HG2 H -5.956 -2.135 -3.202 1.00 . A A . 8 GLU HG2 1 1 1 90 1 1 8 GLU HG3 H -4.887 -2.570 -1.868 1.00 . A A . 8 GLU HG3 1 1 1 91 1 1 8 GLU N N -3.225 0.006 -1.973 1.00 . A A . 8 GLU N 1 1 1 92 1 1 8 GLU O O -4.868 2.135 -3.911 1.00 . A A . 8 GLU O 1 1 1 93 1 1 8 GLU OE1 O -7.347 -3.808 -1.740 1.00 . A A . 8 GLU OE1 1 1 1 94 1 1 9 TYR C C -4.717 4.579 -1.146 1.00 . A A . 9 TYR C 1 1 1 95 1 1 9 TYR CA C -5.743 3.649 -1.779 1.00 . A A . 9 TYR CA 1 1 1 96 1 1 9 TYR CB C -7.096 3.847 -1.086 1.00 . A A . 9 TYR CB 1 1 1 97 1 1 9 TYR CD1 C -8.322 1.673 -1.515 1.00 . A A . 9 TYR CD1 1 1 1 98 1 1 9 TYR CD2 C -9.221 3.676 -2.441 1.00 . A A . 9 TYR CD2 1 1 1 99 1 1 9 TYR CE1 C -9.358 0.945 -2.067 1.00 . A A . 9 TYR CE1 1 1 1 100 1 1 9 TYR CE2 C -10.262 2.955 -2.996 1.00 . A A . 9 TYR CE2 1 1 1 101 1 1 9 TYR CG C -8.234 3.049 -1.691 1.00 . A A . 9 TYR CG 1 1 1 102 1 1 9 TYR CZ C -10.324 1.591 -2.806 1.00 . A A . 9 TYR CZ 1 1 1 103 1 1 9 TYR H H -5.355 1.781 -0.856 1.00 . A A . 9 TYR H 1 1 1 104 1 1 9 TYR HA H -5.848 3.912 -2.821 1.00 . A A . 9 TYR HA 1 1 1 105 1 1 9 TYR HB2 H -7.004 3.558 -0.053 1.00 . A A . 9 TYR HB2 1 1 1 106 1 1 9 TYR HB3 H -7.364 4.893 -1.135 1.00 . A A . 9 TYR HB3 1 1 1 107 1 1 9 TYR HD1 H -7.562 1.169 -0.934 1.00 . A A . 9 TYR HD1 1 1 1 108 1 1 9 TYR HD2 H -9.170 4.745 -2.588 1.00 . A A . 9 TYR HD2 1 1 1 109 1 1 9 TYR HE1 H -9.406 -0.122 -1.917 1.00 . A A . 9 TYR HE1 1 1 1 110 1 1 9 TYR HE2 H -11.020 3.461 -3.576 1.00 . A A . 9 TYR HE2 1 1 1 111 1 1 9 TYR HH H -11.821 1.413 -4.000 1.00 . A A . 9 TYR HH 1 1 1 112 1 1 9 TYR N N -5.322 2.255 -1.717 1.00 . A A . 9 TYR N 1 1 1 113 1 1 9 TYR O O -4.134 4.269 -0.103 1.00 . A A . 9 TYR O 1 1 1 114 1 1 9 TYR OH O -11.357 0.870 -3.357 1.00 . A A . 9 TYR OH 1 1 1 115 1 1 10 PHE C C -4.384 7.995 -0.935 1.00 . A A . 10 PHE C 1 1 1 116 1 1 10 PHE CA C -3.601 6.743 -1.304 1.00 . A A . 10 PHE CA 1 1 1 117 1 1 10 PHE CB C -2.565 7.118 -2.373 1.00 . A A . 10 PHE CB 1 1 1 118 1 1 10 PHE CD1 C -2.419 4.977 -3.701 1.00 . A A . 10 PHE CD1 1 1 1 119 1 1 10 PHE CD2 C -0.416 5.889 -2.784 1.00 . A A . 10 PHE CD2 1 1 1 120 1 1 10 PHE CE1 C -1.698 3.933 -4.248 1.00 . A A . 10 PHE CE1 1 1 1 121 1 1 10 PHE CE2 C 0.310 4.847 -3.325 1.00 . A A . 10 PHE CE2 1 1 1 122 1 1 10 PHE CG C -1.787 5.967 -2.961 1.00 . A A . 10 PHE CG 1 1 1 123 1 1 10 PHE CZ C -0.332 3.868 -4.059 1.00 . A A . 10 PHE CZ 1 1 1 124 1 1 10 PHE H H -5.046 5.906 -2.591 1.00 . A A . 10 PHE H 1 1 1 125 1 1 10 PHE HA H -3.097 6.363 -0.428 1.00 . A A . 10 PHE HA 1 1 1 126 1 1 10 PHE HB2 H -3.070 7.618 -3.183 1.00 . A A . 10 PHE HB2 1 1 1 127 1 1 10 PHE HB3 H -1.853 7.804 -1.936 1.00 . A A . 10 PHE HB3 1 1 1 128 1 1 10 PHE HD1 H -3.487 5.027 -3.848 1.00 . A A . 10 PHE HD1 1 1 1 129 1 1 10 PHE HD2 H 0.088 6.652 -2.209 1.00 . A A . 10 PHE HD2 1 1 1 130 1 1 10 PHE HE1 H -2.203 3.170 -4.820 1.00 . A A . 10 PHE HE1 1 1 1 131 1 1 10 PHE HE2 H 1.378 4.796 -3.177 1.00 . A A . 10 PHE HE2 1 1 1 132 1 1 10 PHE HZ H 0.234 3.054 -4.485 1.00 . A A . 10 PHE HZ 1 1 1 133 1 1 10 PHE N N -4.527 5.727 -1.781 1.00 . A A . 10 PHE N 1 1 1 134 1 1 10 PHE O O -5.403 8.296 -1.552 1.00 . A A . 10 PHE O 1 1 1 135 1 1 11 VAL C C -4.098 11.142 -0.342 1.00 . A A . 11 VAL C 1 1 1 136 1 1 11 VAL CA C -4.577 9.948 0.482 1.00 . A A . 11 VAL CA 1 1 1 137 1 1 11 VAL CB C -4.370 10.237 1.985 1.00 . A A . 11 VAL CB 1 1 1 138 1 1 11 VAL CG1 C -5.033 9.160 2.827 1.00 . A A . 11 VAL CG1 1 1 1 139 1 1 11 VAL CG2 C -2.890 10.348 2.323 1.00 . A A . 11 VAL CG2 1 1 1 140 1 1 11 VAL H H -3.087 8.436 0.513 1.00 . A A . 11 VAL H 1 1 1 141 1 1 11 VAL HA H -5.635 9.816 0.310 1.00 . A A . 11 VAL HA 1 1 1 142 1 1 11 VAL HB H -4.841 11.182 2.216 1.00 . A A . 11 VAL HB 1 1 1 143 1 1 11 VAL HG11 H -5.600 8.500 2.187 1.00 . A A . 11 VAL HG11 1 1 1 144 1 1 11 VAL HG12 H -5.696 9.622 3.544 1.00 . A A . 11 VAL HG12 1 1 1 145 1 1 11 VAL HG13 H -4.277 8.593 3.349 1.00 . A A . 11 VAL HG13 1 1 1 146 1 1 11 VAL HG21 H -2.773 10.485 3.388 1.00 . A A . 11 VAL HG21 1 1 1 147 1 1 11 VAL HG22 H -2.464 11.194 1.803 1.00 . A A . 11 VAL HG22 1 1 1 148 1 1 11 VAL HG23 H -2.382 9.445 2.018 1.00 . A A . 11 VAL HG23 1 1 1 149 1 1 11 VAL N N -3.908 8.723 0.061 1.00 . A A . 11 VAL N 1 1 1 150 1 1 11 VAL O O -3.432 10.970 -1.364 1.00 . A A . 11 VAL O 1 1 1 151 1 1 12 GLY C C -2.564 13.704 -0.784 1.00 . A A . 12 GLY C 1 1 1 152 1 1 12 GLY CA C -4.060 13.557 -0.601 1.00 . A A . 12 GLY CA 1 1 1 153 1 1 12 GLY H H -4.981 12.412 0.922 1.00 . A A . 12 GLY H 1 1 1 154 1 1 12 GLY HA2 H -4.520 13.548 -1.568 1.00 . A A . 12 GLY HA2 1 1 1 155 1 1 12 GLY HA3 H -4.427 14.410 -0.050 1.00 . A A . 12 GLY HA3 1 1 1 156 1 1 12 GLY N N -4.445 12.345 0.106 1.00 . A A . 12 GLY N 1 1 1 157 1 1 12 GLY O O -2.099 14.097 -1.849 1.00 . A A . 12 GLY O 1 1 1 158 1 1 13 ILE C C 0.290 12.225 -0.359 1.00 . A A . 13 ILE C 1 1 1 159 1 1 13 ILE CA C -0.355 13.495 0.200 1.00 . A A . 13 ILE CA 1 1 1 160 1 1 13 ILE CB C 0.243 13.820 1.587 1.00 . A A . 13 ILE CB 1 1 1 161 1 1 13 ILE CD1 C 0.281 13.080 4.030 1.00 . A A . 13 ILE CD1 1 1 1 162 1 1 13 ILE CG1 C -0.312 12.868 2.652 1.00 . A A . 13 ILE CG1 1 1 1 163 1 1 13 ILE CG2 C -0.046 15.270 1.956 1.00 . A A . 13 ILE CG2 1 1 1 164 1 1 13 ILE H H -2.243 13.083 1.071 1.00 . A A . 13 ILE H 1 1 1 165 1 1 13 ILE HA H -0.118 14.312 -0.465 1.00 . A A . 13 ILE HA 1 1 1 166 1 1 13 ILE HB H 1.314 13.698 1.527 1.00 . A A . 13 ILE HB 1 1 1 167 1 1 13 ILE HD11 H 0.282 14.134 4.263 1.00 . A A . 13 ILE HD11 1 1 1 168 1 1 13 ILE HD12 H 1.295 12.707 4.047 1.00 . A A . 13 ILE HD12 1 1 1 169 1 1 13 ILE HD13 H -0.310 12.550 4.762 1.00 . A A . 13 ILE HD13 1 1 1 170 1 1 13 ILE HG12 H -1.379 13.006 2.728 1.00 . A A . 13 ILE HG12 1 1 1 171 1 1 13 ILE HG13 H -0.105 11.849 2.356 1.00 . A A . 13 ILE HG13 1 1 1 172 1 1 13 ILE HG21 H 0.072 15.894 1.083 1.00 . A A . 13 ILE HG21 1 1 1 173 1 1 13 ILE HG22 H 0.645 15.589 2.722 1.00 . A A . 13 ILE HG22 1 1 1 174 1 1 13 ILE HG23 H -1.057 15.354 2.323 1.00 . A A . 13 ILE HG23 1 1 1 175 1 1 13 ILE N N -1.812 13.390 0.254 1.00 . A A . 13 ILE N 1 1 1 176 1 1 13 ILE O O 1.403 11.862 0.019 1.00 . A A . 13 ILE O 1 1 1 177 1 1 14 GLY C C 0.522 9.284 -0.951 1.00 . A A . 14 GLY C 1 1 1 178 1 1 14 GLY CA C 0.069 10.362 -1.921 1.00 . A A . 14 GLY CA 1 1 1 179 1 1 14 GLY H H -1.292 11.940 -1.540 1.00 . A A . 14 GLY H 1 1 1 180 1 1 14 GLY HA2 H -0.721 9.959 -2.538 1.00 . A A . 14 GLY HA2 1 1 1 181 1 1 14 GLY HA3 H 0.902 10.625 -2.559 1.00 . A A . 14 GLY HA3 1 1 1 182 1 1 14 GLY N N -0.420 11.574 -1.276 1.00 . A A . 14 GLY N 1 1 1 183 1 1 14 GLY O O 1.399 8.484 -1.273 1.00 . A A . 14 GLY O 1 1 1 184 1 1 15 THR C C -0.760 7.153 1.277 1.00 . A A . 15 THR C 1 1 1 185 1 1 15 THR CA C 0.288 8.260 1.225 1.00 . A A . 15 THR CA 1 1 1 186 1 1 15 THR CB C 0.431 8.904 2.616 1.00 . A A . 15 THR CB 1 1 1 187 1 1 15 THR CG2 C 1.032 7.926 3.616 1.00 . A A . 15 THR CG2 1 1 1 188 1 1 15 THR H H -0.765 9.909 0.435 1.00 . A A . 15 THR H 1 1 1 189 1 1 15 THR HA H 1.240 7.831 0.946 1.00 . A A . 15 THR HA 1 1 1 190 1 1 15 THR HB H -0.548 9.199 2.964 1.00 . A A . 15 THR HB 1 1 1 191 1 1 15 THR HG1 H 1.539 10.194 1.606 1.00 . A A . 15 THR HG1 1 1 1 192 1 1 15 THR HG21 H 2.108 7.943 3.535 1.00 . A A . 15 THR HG21 1 1 1 193 1 1 15 THR HG22 H 0.670 6.930 3.407 1.00 . A A . 15 THR HG22 1 1 1 194 1 1 15 THR HG23 H 0.741 8.211 4.617 1.00 . A A . 15 THR HG23 1 1 1 195 1 1 15 THR N N -0.070 9.252 0.229 1.00 . A A . 15 THR N 1 1 1 196 1 1 15 THR O O -1.935 7.415 1.534 1.00 . A A . 15 THR O 1 1 1 197 1 1 15 THR OG1 O 1.265 10.066 2.522 1.00 . A A . 15 THR OG1 1 1 1 198 1 1 16 PRO C C -1.563 4.267 2.438 1.00 . A A . 16 PRO C 1 1 1 199 1 1 16 PRO CA C -1.272 4.773 1.030 1.00 . A A . 16 PRO CA 1 1 1 200 1 1 16 PRO CB C -0.525 3.714 0.226 1.00 . A A . 16 PRO CB 1 1 1 201 1 1 16 PRO CD C 1.023 5.504 0.681 1.00 . A A . 16 PRO CD 1 1 1 202 1 1 16 PRO CG C 0.922 4.019 0.428 1.00 . A A . 16 PRO CG 1 1 1 203 1 1 16 PRO HA H -2.202 5.012 0.536 1.00 . A A . 16 PRO HA 1 1 1 204 1 1 16 PRO HB2 H -0.777 2.732 0.600 1.00 . A A . 16 PRO HB2 1 1 1 205 1 1 16 PRO HB3 H -0.804 3.789 -0.814 1.00 . A A . 16 PRO HB3 1 1 1 206 1 1 16 PRO HD2 H 1.690 5.699 1.507 1.00 . A A . 16 PRO HD2 1 1 1 207 1 1 16 PRO HD3 H 1.365 6.014 -0.207 1.00 . A A . 16 PRO HD3 1 1 1 208 1 1 16 PRO HG2 H 1.295 3.471 1.279 1.00 . A A . 16 PRO HG2 1 1 1 209 1 1 16 PRO HG3 H 1.476 3.755 -0.461 1.00 . A A . 16 PRO HG3 1 1 1 210 1 1 16 PRO N N -0.356 5.905 1.018 1.00 . A A . 16 PRO N 1 1 1 211 1 1 16 PRO O O -0.652 3.917 3.188 1.00 . A A . 16 PRO O 1 1 1 212 1 1 17 ILE C C -4.073 2.455 3.917 1.00 . A A . 17 ILE C 1 1 1 213 1 1 17 ILE CA C -3.248 3.726 4.097 1.00 . A A . 17 ILE CA 1 1 1 214 1 1 17 ILE CB C -4.047 4.790 4.893 1.00 . A A . 17 ILE CB 1 1 1 215 1 1 17 ILE CD1 C -4.036 7.242 5.605 1.00 . A A . 17 ILE CD1 1 1 1 216 1 1 17 ILE CG1 C -3.352 6.152 4.806 1.00 . A A . 17 ILE CG1 1 1 1 217 1 1 17 ILE CG2 C -4.187 4.372 6.356 1.00 . A A . 17 ILE CG2 1 1 1 218 1 1 17 ILE H H -3.522 4.488 2.140 1.00 . A A . 17 ILE H 1 1 1 219 1 1 17 ILE HA H -2.354 3.482 4.654 1.00 . A A . 17 ILE HA 1 1 1 220 1 1 17 ILE HB H -5.037 4.866 4.466 1.00 . A A . 17 ILE HB 1 1 1 221 1 1 17 ILE HD11 H -4.207 8.099 4.970 1.00 . A A . 17 ILE HD11 1 1 1 222 1 1 17 ILE HD12 H -3.407 7.529 6.434 1.00 . A A . 17 ILE HD12 1 1 1 223 1 1 17 ILE HD13 H -4.980 6.875 5.977 1.00 . A A . 17 ILE HD13 1 1 1 224 1 1 17 ILE HG12 H -2.341 6.057 5.175 1.00 . A A . 17 ILE HG12 1 1 1 225 1 1 17 ILE HG13 H -3.322 6.467 3.773 1.00 . A A . 17 ILE HG13 1 1 1 226 1 1 17 ILE HG21 H -3.242 4.504 6.858 1.00 . A A . 17 ILE HG21 1 1 1 227 1 1 17 ILE HG22 H -4.481 3.335 6.408 1.00 . A A . 17 ILE HG22 1 1 1 228 1 1 17 ILE HG23 H -4.938 4.984 6.835 1.00 . A A . 17 ILE HG23 1 1 1 229 1 1 17 ILE N N -2.838 4.212 2.786 1.00 . A A . 17 ILE N 1 1 1 230 1 1 17 ILE O O -5.073 2.218 4.594 1.00 . A A . 17 ILE O 1 1 1 231 1 1 18 SER C C -3.454 -0.344 1.594 1.00 . A A . 18 SER C 1 1 1 232 1 1 18 SER CA C -4.271 0.383 2.645 1.00 . A A . 18 SER CA 1 1 1 233 1 1 18 SER CB C -5.697 0.606 2.134 1.00 . A A . 18 SER CB 1 1 1 234 1 1 18 SER H H -2.825 1.903 2.472 1.00 . A A . 18 SER H 1 1 1 235 1 1 18 SER HA H -4.304 -0.219 3.541 1.00 . A A . 18 SER HA 1 1 1 236 1 1 18 SER HB2 H -6.086 -0.324 1.747 1.00 . A A . 18 SER HB2 1 1 1 237 1 1 18 SER HB3 H -6.318 0.943 2.948 1.00 . A A . 18 SER HB3 1 1 1 238 1 1 18 SER HG H -5.363 2.405 1.434 1.00 . A A . 18 SER HG 1 1 1 239 1 1 18 SER N N -3.627 1.643 2.972 1.00 . A A . 18 SER N 1 1 1 240 1 1 18 SER O O -2.839 0.287 0.733 1.00 . A A . 18 SER O 1 1 1 241 1 1 18 SER OG O -5.724 1.577 1.099 1.00 . A A . 18 SER OG 1 1 1 242 1 1 19 PHE C C -3.596 -3.579 0.176 1.00 . A A . 19 PHE C 1 1 1 243 1 1 19 PHE CA C -2.701 -2.467 0.709 1.00 . A A . 19 PHE CA 1 1 1 244 1 1 19 PHE CB C -1.442 -3.062 1.353 1.00 . A A . 19 PHE CB 1 1 1 245 1 1 19 PHE CD1 C -0.652 -1.342 3.013 1.00 . A A . 19 PHE CD1 1 1 1 246 1 1 19 PHE CD2 C 0.708 -1.789 1.107 1.00 . A A . 19 PHE CD2 1 1 1 247 1 1 19 PHE CE1 C 0.268 -0.412 3.455 1.00 . A A . 19 PHE CE1 1 1 1 248 1 1 19 PHE CE2 C 1.632 -0.861 1.545 1.00 . A A . 19 PHE CE2 1 1 1 249 1 1 19 PHE CG C -0.446 -2.041 1.833 1.00 . A A . 19 PHE CG 1 1 1 250 1 1 19 PHE CZ C 1.412 -0.171 2.720 1.00 . A A . 19 PHE CZ 1 1 1 251 1 1 19 PHE H H -3.960 -2.107 2.375 1.00 . A A . 19 PHE H 1 1 1 252 1 1 19 PHE HA H -2.411 -1.829 -0.113 1.00 . A A . 19 PHE HA 1 1 1 253 1 1 19 PHE HB2 H -1.737 -3.657 2.203 1.00 . A A . 19 PHE HB2 1 1 1 254 1 1 19 PHE HB3 H -0.948 -3.697 0.632 1.00 . A A . 19 PHE HB3 1 1 1 255 1 1 19 PHE HD1 H -1.546 -1.529 3.590 1.00 . A A . 19 PHE HD1 1 1 1 256 1 1 19 PHE HD2 H 0.881 -2.328 0.186 1.00 . A A . 19 PHE HD2 1 1 1 257 1 1 19 PHE HE1 H 0.093 0.127 4.376 1.00 . A A . 19 PHE HE1 1 1 1 258 1 1 19 PHE HE2 H 2.526 -0.676 0.969 1.00 . A A . 19 PHE HE2 1 1 1 259 1 1 19 PHE HZ H 2.134 0.556 3.064 1.00 . A A . 19 PHE HZ 1 1 1 260 1 1 19 PHE N N -3.446 -1.660 1.662 1.00 . A A . 19 PHE N 1 1 1 261 1 1 19 PHE O O -4.787 -3.591 0.455 1.00 . A A . 19 PHE O 1 1 1 262 1 1 20 TYR C C -3.225 -6.922 -0.735 1.00 . A A . 20 TYR C 1 1 1 263 1 1 20 TYR CA C -3.810 -5.590 -1.158 1.00 . A A . 20 TYR CA 1 1 1 264 1 1 20 TYR CB C -3.802 -5.500 -2.684 1.00 . A A . 20 TYR CB 1 1 1 265 1 1 20 TYR CD1 C -6.112 -6.498 -2.902 1.00 . A A . 20 TYR CD1 1 1 1 266 1 1 20 TYR CD2 C -4.438 -7.184 -4.453 1.00 . A A . 20 TYR CD2 1 1 1 267 1 1 20 TYR CE1 C -7.030 -7.328 -3.517 1.00 . A A . 20 TYR CE1 1 1 1 268 1 1 20 TYR CE2 C -5.349 -8.016 -5.075 1.00 . A A . 20 TYR CE2 1 1 1 269 1 1 20 TYR CG C -4.804 -6.411 -3.358 1.00 . A A . 20 TYR CG 1 1 1 270 1 1 20 TYR CZ C -6.643 -8.085 -4.602 1.00 . A A . 20 TYR CZ 1 1 1 271 1 1 20 TYR H H -2.070 -4.431 -0.796 1.00 . A A . 20 TYR H 1 1 1 272 1 1 20 TYR HA H -4.823 -5.513 -0.800 1.00 . A A . 20 TYR HA 1 1 1 273 1 1 20 TYR HB2 H -4.016 -4.489 -2.975 1.00 . A A . 20 TYR HB2 1 1 1 274 1 1 20 TYR HB3 H -2.820 -5.768 -3.042 1.00 . A A . 20 TYR HB3 1 1 1 275 1 1 20 TYR HD1 H -6.414 -5.903 -2.052 1.00 . A A . 20 TYR HD1 1 1 1 276 1 1 20 TYR HD2 H -3.424 -7.127 -4.821 1.00 . A A . 20 TYR HD2 1 1 1 277 1 1 20 TYR HE1 H -8.042 -7.383 -3.147 1.00 . A A . 20 TYR HE1 1 1 1 278 1 1 20 TYR HE2 H -5.045 -8.610 -5.925 1.00 . A A . 20 TYR HE2 1 1 1 279 1 1 20 TYR HH H -8.323 -9.017 -4.655 1.00 . A A . 20 TYR HH 1 1 1 280 1 1 20 TYR N N -3.032 -4.496 -0.591 1.00 . A A . 20 TYR N 1 1 1 281 1 1 20 TYR O O -3.864 -7.716 -0.047 1.00 . A A . 20 TYR O 1 1 1 282 1 1 20 TYR OH O -7.552 -8.914 -5.218 1.00 . A A . 20 TYR OH 1 1 1 283 1 1 21 GLY C C 0.190 -8.155 -0.998 1.00 . A A . 21 GLY C 1 1 1 284 1 1 21 GLY CA C -1.294 -8.357 -0.839 1.00 . A A . 21 GLY CA 1 1 1 285 1 1 21 GLY H H -1.559 -6.454 -1.702 1.00 . A A . 21 GLY H 1 1 1 286 1 1 21 GLY HA2 H -1.510 -8.641 0.181 1.00 . A A . 21 GLY HA2 1 1 1 287 1 1 21 GLY HA3 H -1.617 -9.143 -1.504 1.00 . A A . 21 GLY HA3 1 1 1 288 1 1 21 GLY N N -2.000 -7.140 -1.157 1.00 . A A . 21 GLY N 1 1 1 289 1 1 21 GLY O O 0.978 -8.978 -0.495 1.00 . A A . 21 GLY O 1 1 1 290 1 1 21 GLY OXT O 0.574 -7.124 -1.590 1.00 . A A . 21 GLY OXT 1 1 2 291 1 1 1 GLY C C -8.225 -3.422 1.403 1.00 . A A . 1 GLY C 1 1 2 292 1 1 1 GLY CA C -8.631 -2.408 0.348 1.00 . A A . 1 GLY CA 1 1 2 293 1 1 1 GLY H2 H -7.266 -0.962 -0.381 1.00 . A A . 1 GLY H2 1 1 2 294 1 1 1 GLY HA2 H -9.112 -1.574 0.836 1.00 . A A . 1 GLY HA2 1 1 2 295 1 1 1 GLY HA3 H -9.338 -2.873 -0.324 1.00 . A A . 1 GLY HA3 1 1 2 296 1 1 1 GLY N N -7.508 -1.909 -0.430 1.00 . A A . 1 GLY N 1 1 2 297 1 1 1 GLY O O -8.936 -4.396 1.640 1.00 . A A . 1 GLY O 1 1 2 298 1 1 2 GLY C C -5.227 -3.736 3.555 1.00 . A A . 2 GLY C 1 1 2 299 1 1 2 GLY CA C -6.615 -4.097 3.070 1.00 . A A . 2 GLY CA 1 1 2 300 1 1 2 GLY H H -6.563 -2.400 1.817 1.00 . A A . 2 GLY H 1 1 2 301 1 1 2 GLY HA2 H -7.298 -4.066 3.907 1.00 . A A . 2 GLY HA2 1 1 2 302 1 1 2 GLY HA3 H -6.597 -5.101 2.670 1.00 . A A . 2 GLY HA3 1 1 2 303 1 1 2 GLY N N -7.087 -3.190 2.042 1.00 . A A . 2 GLY N 1 1 2 304 1 1 2 GLY O O -4.921 -2.557 3.743 1.00 . A A . 2 GLY O 1 1 2 305 1 1 3 ALA C C -2.080 -5.545 3.532 1.00 . A A . 3 ALA C 1 1 2 306 1 1 3 ALA CA C -3.011 -4.527 4.176 1.00 . A A . 3 ALA CA 1 1 2 307 1 1 3 ALA CB C -2.926 -4.613 5.694 1.00 . A A . 3 ALA CB 1 1 2 308 1 1 3 ALA H H -4.679 -5.656 3.537 1.00 . A A . 3 ALA H 1 1 2 309 1 1 3 ALA HA H -2.709 -3.534 3.874 1.00 . A A . 3 ALA HA 1 1 2 310 1 1 3 ALA HB1 H -3.475 -5.477 6.036 1.00 . A A . 3 ALA HB1 1 1 2 311 1 1 3 ALA HB2 H -3.350 -3.720 6.129 1.00 . A A . 3 ALA HB2 1 1 2 312 1 1 3 ALA HB3 H -1.891 -4.703 5.991 1.00 . A A . 3 ALA HB3 1 1 2 313 1 1 3 ALA N N -4.380 -4.739 3.728 1.00 . A A . 3 ALA N 1 1 2 314 1 1 3 ALA O O -2.431 -6.714 3.402 1.00 . A A . 3 ALA O 1 1 2 315 1 1 4 GLY C C 1.252 -5.220 1.945 1.00 . A A . 4 GLY C 1 1 2 316 1 1 4 GLY CA C 0.046 -5.969 2.476 1.00 . A A . 4 GLY CA 1 1 2 317 1 1 4 GLY H H -0.688 -4.143 3.238 1.00 . A A . 4 GLY H 1 1 2 318 1 1 4 GLY HA2 H 0.379 -6.707 3.193 1.00 . A A . 4 GLY HA2 1 1 2 319 1 1 4 GLY HA3 H -0.441 -6.474 1.654 1.00 . A A . 4 GLY HA3 1 1 2 320 1 1 4 GLY N N -0.907 -5.089 3.117 1.00 . A A . 4 GLY N 1 1 2 321 1 1 4 GLY O O 1.902 -4.479 2.681 1.00 . A A . 4 GLY O 1 1 2 322 1 1 5 HIS C C 2.283 -3.879 -1.109 1.00 . A A . 5 HIS C 1 1 2 323 1 1 5 HIS CA C 2.714 -4.776 0.048 1.00 . A A . 5 HIS CA 1 1 2 324 1 1 5 HIS CB C 3.715 -5.818 -0.466 1.00 . A A . 5 HIS CB 1 1 2 325 1 1 5 HIS CD2 C 3.898 -8.284 0.300 1.00 . A A . 5 HIS CD2 1 1 2 326 1 1 5 HIS CE1 C 4.455 -7.938 2.387 1.00 . A A . 5 HIS CE1 1 1 2 327 1 1 5 HIS CG C 3.968 -6.946 0.484 1.00 . A A . 5 HIS CG 1 1 2 328 1 1 5 HIS H H 1.015 -6.045 0.133 1.00 . A A . 5 HIS H 1 1 2 329 1 1 5 HIS HA H 3.195 -4.167 0.798 1.00 . A A . 5 HIS HA 1 1 2 330 1 1 5 HIS HB2 H 3.341 -6.239 -1.387 1.00 . A A . 5 HIS HB2 1 1 2 331 1 1 5 HIS HB3 H 4.661 -5.329 -0.659 1.00 . A A . 5 HIS HB3 1 1 2 332 1 1 5 HIS HD1 H 4.441 -5.897 2.249 1.00 . A A . 5 HIS HD1 1 1 2 333 1 1 5 HIS HD2 H 3.647 -8.790 -0.622 1.00 . A A . 5 HIS HD2 1 1 2 334 1 1 5 HIS HE1 H 4.727 -8.101 3.419 1.00 . A A . 5 HIS HE1 1 1 2 335 1 1 5 HIS HE2 H 3.963 -9.805 1.729 1.00 . A A . 5 HIS HE2 1 1 2 336 1 1 5 HIS N N 1.565 -5.424 0.671 1.00 . A A . 5 HIS N 1 1 2 337 1 1 5 HIS ND1 N 4.320 -6.762 1.804 1.00 . A A . 5 HIS ND1 1 1 2 338 1 1 5 HIS NE2 N 4.203 -8.883 1.498 1.00 . A A . 5 HIS NE2 1 1 2 339 1 1 5 HIS O O 2.856 -2.813 -1.316 1.00 . A A . 5 HIS O 1 1 2 340 1 1 6 VAL C C -0.271 -2.559 -2.569 1.00 . A A . 6 VAL C 1 1 2 341 1 1 6 VAL CA C 0.807 -3.539 -3.013 1.00 . A A . 6 VAL CA 1 1 2 342 1 1 6 VAL CB C 0.243 -4.452 -4.124 1.00 . A A . 6 VAL CB 1 1 2 343 1 1 6 VAL CG1 C -0.126 -3.640 -5.357 1.00 . A A . 6 VAL CG1 1 1 2 344 1 1 6 VAL CG2 C 1.241 -5.544 -4.480 1.00 . A A . 6 VAL CG2 1 1 2 345 1 1 6 VAL H H 0.861 -5.182 -1.668 1.00 . A A . 6 VAL H 1 1 2 346 1 1 6 VAL HA H 1.644 -2.984 -3.415 1.00 . A A . 6 VAL HA 1 1 2 347 1 1 6 VAL HB H -0.653 -4.924 -3.751 1.00 . A A . 6 VAL HB 1 1 2 348 1 1 6 VAL HG11 H 0.726 -3.059 -5.675 1.00 . A A . 6 VAL HG11 1 1 2 349 1 1 6 VAL HG12 H -0.946 -2.977 -5.119 1.00 . A A . 6 VAL HG12 1 1 2 350 1 1 6 VAL HG13 H -0.425 -4.307 -6.152 1.00 . A A . 6 VAL HG13 1 1 2 351 1 1 6 VAL HG21 H 1.068 -5.873 -5.494 1.00 . A A . 6 VAL HG21 1 1 2 352 1 1 6 VAL HG22 H 1.119 -6.378 -3.805 1.00 . A A . 6 VAL HG22 1 1 2 353 1 1 6 VAL HG23 H 2.246 -5.155 -4.394 1.00 . A A . 6 VAL HG23 1 1 2 354 1 1 6 VAL N N 1.284 -4.317 -1.871 1.00 . A A . 6 VAL N 1 1 2 355 1 1 6 VAL O O -1.331 -2.967 -2.117 1.00 . A A . 6 VAL O 1 1 2 356 1 1 7 PRO C C -2.248 -0.177 -3.037 1.00 . A A . 7 PRO C 1 1 2 357 1 1 7 PRO CA C -0.932 -0.193 -2.258 1.00 . A A . 7 PRO CA 1 1 2 358 1 1 7 PRO CB C -0.155 1.100 -2.525 1.00 . A A . 7 PRO CB 1 1 2 359 1 1 7 PRO CD C 1.264 -0.695 -3.184 1.00 . A A . 7 PRO CD 1 1 2 360 1 1 7 PRO CG C 1.276 0.689 -2.611 1.00 . A A . 7 PRO CG 1 1 2 361 1 1 7 PRO HA H -1.150 -0.262 -1.204 1.00 . A A . 7 PRO HA 1 1 2 362 1 1 7 PRO HB2 H -0.492 1.540 -3.451 1.00 . A A . 7 PRO HB2 1 1 2 363 1 1 7 PRO HB3 H -0.315 1.793 -1.713 1.00 . A A . 7 PRO HB3 1 1 2 364 1 1 7 PRO HD2 H 1.265 -0.661 -4.263 1.00 . A A . 7 PRO HD2 1 1 2 365 1 1 7 PRO HD3 H 2.110 -1.263 -2.821 1.00 . A A . 7 PRO HD3 1 1 2 366 1 1 7 PRO HG2 H 1.814 1.360 -3.262 1.00 . A A . 7 PRO HG2 1 1 2 367 1 1 7 PRO HG3 H 1.717 0.683 -1.625 1.00 . A A . 7 PRO HG3 1 1 2 368 1 1 7 PRO N N 0.002 -1.253 -2.674 1.00 . A A . 7 PRO N 1 1 2 369 1 1 7 PRO O O -2.264 -0.314 -4.259 1.00 . A A . 7 PRO O 1 1 2 370 1 1 8 GLU C C -5.073 1.553 -3.110 1.00 . A A . 8 GLU C 1 1 2 371 1 1 8 GLU CA C -4.671 0.097 -2.900 1.00 . A A . 8 GLU CA 1 1 2 372 1 1 8 GLU CB C -5.713 -0.578 -2.001 1.00 . A A . 8 GLU CB 1 1 2 373 1 1 8 GLU CD C -6.803 -2.718 -1.221 1.00 . A A . 8 GLU CD 1 1 2 374 1 1 8 GLU CG C -5.655 -2.094 -1.995 1.00 . A A . 8 GLU CG 1 1 2 375 1 1 8 GLU H H -3.248 0.144 -1.339 1.00 . A A . 8 GLU H 1 1 2 376 1 1 8 GLU HA H -4.644 -0.406 -3.855 1.00 . A A . 8 GLU HA 1 1 2 377 1 1 8 GLU HB2 H -5.569 -0.234 -0.988 1.00 . A A . 8 GLU HB2 1 1 2 378 1 1 8 GLU HB3 H -6.698 -0.281 -2.332 1.00 . A A . 8 GLU HB3 1 1 2 379 1 1 8 GLU HG2 H -5.694 -2.448 -3.014 1.00 . A A . 8 GLU HG2 1 1 2 380 1 1 8 GLU HG3 H -4.725 -2.404 -1.542 1.00 . A A . 8 GLU HG3 1 1 2 381 1 1 8 GLU N N -3.342 0.021 -2.306 1.00 . A A . 8 GLU N 1 1 2 382 1 1 8 GLU O O -5.122 2.043 -4.235 1.00 . A A . 8 GLU O 1 1 2 383 1 1 8 GLU OE1 O -7.033 -3.936 -1.353 1.00 . A A . 8 GLU OE1 1 1 2 384 1 1 9 TYR C C -4.760 4.513 -1.340 1.00 . A A . 9 TYR C 1 1 2 385 1 1 9 TYR CA C -5.771 3.636 -2.061 1.00 . A A . 9 TYR CA 1 1 2 386 1 1 9 TYR CB C -7.158 3.837 -1.437 1.00 . A A . 9 TYR CB 1 1 2 387 1 1 9 TYR CD1 C -8.402 1.714 -2.032 1.00 . A A . 9 TYR CD1 1 1 2 388 1 1 9 TYR CD2 C -9.220 3.779 -2.893 1.00 . A A . 9 TYR CD2 1 1 2 389 1 1 9 TYR CE1 C -9.428 1.039 -2.664 1.00 . A A . 9 TYR CE1 1 1 2 390 1 1 9 TYR CE2 C -10.252 3.111 -3.526 1.00 . A A . 9 TYR CE2 1 1 2 391 1 1 9 TYR CG C -8.278 3.093 -2.137 1.00 . A A . 9 TYR CG 1 1 2 392 1 1 9 TYR CZ C -10.349 1.741 -3.409 1.00 . A A . 9 TYR CZ 1 1 2 393 1 1 9 TYR H H -5.314 1.789 -1.137 1.00 . A A . 9 TYR H 1 1 2 394 1 1 9 TYR HA H -5.809 3.930 -3.099 1.00 . A A . 9 TYR HA 1 1 2 395 1 1 9 TYR HB2 H -7.130 3.502 -0.413 1.00 . A A . 9 TYR HB2 1 1 2 396 1 1 9 TYR HB3 H -7.397 4.891 -1.455 1.00 . A A . 9 TYR HB3 1 1 2 397 1 1 9 TYR HD1 H -7.679 1.165 -1.447 1.00 . A A . 9 TYR HD1 1 1 2 398 1 1 9 TYR HD2 H -9.139 4.851 -2.986 1.00 . A A . 9 TYR HD2 1 1 2 399 1 1 9 TYR HE1 H -9.506 -0.035 -2.571 1.00 . A A . 9 TYR HE1 1 1 2 400 1 1 9 TYR HE2 H -10.973 3.662 -4.109 1.00 . A A . 9 TYR HE2 1 1 2 401 1 1 9 TYR HH H -11.170 0.977 -4.971 1.00 . A A . 9 TYR HH 1 1 2 402 1 1 9 TYR N N -5.368 2.238 -2.009 1.00 . A A . 9 TYR N 1 1 2 403 1 1 9 TYR O O -4.212 4.128 -0.304 1.00 . A A . 9 TYR O 1 1 2 404 1 1 9 TYR OH O -11.373 1.071 -4.037 1.00 . A A . 9 TYR OH 1 1 2 405 1 1 10 PHE C C -4.346 7.842 -0.758 1.00 . A A . 10 PHE C 1 1 2 406 1 1 10 PHE CA C -3.589 6.644 -1.312 1.00 . A A . 10 PHE CA 1 1 2 407 1 1 10 PHE CB C -2.571 7.134 -2.348 1.00 . A A . 10 PHE CB 1 1 2 408 1 1 10 PHE CD1 C -2.414 5.171 -3.923 1.00 . A A . 10 PHE CD1 1 1 2 409 1 1 10 PHE CD2 C -0.432 5.914 -2.830 1.00 . A A . 10 PHE CD2 1 1 2 410 1 1 10 PHE CE1 C -1.694 4.185 -4.567 1.00 . A A . 10 PHE CE1 1 1 2 411 1 1 10 PHE CE2 C 0.295 4.932 -3.473 1.00 . A A . 10 PHE CE2 1 1 2 412 1 1 10 PHE CG C -1.793 6.046 -3.043 1.00 . A A . 10 PHE CG 1 1 2 413 1 1 10 PHE CZ C -0.338 4.065 -4.343 1.00 . A A . 10 PHE CZ 1 1 2 414 1 1 10 PHE H H -5.003 5.938 -2.708 1.00 . A A . 10 PHE H 1 1 2 415 1 1 10 PHE HA H -3.067 6.153 -0.504 1.00 . A A . 10 PHE HA 1 1 2 416 1 1 10 PHE HB2 H -3.091 7.699 -3.103 1.00 . A A . 10 PHE HB2 1 1 2 417 1 1 10 PHE HB3 H -1.861 7.783 -1.855 1.00 . A A . 10 PHE HB3 1 1 2 418 1 1 10 PHE HD1 H -3.476 5.263 -4.099 1.00 . A A . 10 PHE HD1 1 1 2 419 1 1 10 PHE HD2 H 0.065 6.588 -2.147 1.00 . A A . 10 PHE HD2 1 1 2 420 1 1 10 PHE HE1 H -2.191 3.509 -5.247 1.00 . A A . 10 PHE HE1 1 1 2 421 1 1 10 PHE HE2 H 1.357 4.840 -3.297 1.00 . A A . 10 PHE HE2 1 1 2 422 1 1 10 PHE HZ H 0.228 3.297 -4.847 1.00 . A A . 10 PHE HZ 1 1 2 423 1 1 10 PHE N N -4.525 5.693 -1.890 1.00 . A A . 10 PHE N 1 1 2 424 1 1 10 PHE O O -5.396 8.215 -1.281 1.00 . A A . 10 PHE O 1 1 2 425 1 1 11 VAL C C -4.058 10.882 0.144 1.00 . A A . 11 VAL C 1 1 2 426 1 1 11 VAL CA C -4.435 9.609 0.901 1.00 . A A . 11 VAL CA 1 1 2 427 1 1 11 VAL CB C -4.049 9.760 2.391 1.00 . A A . 11 VAL CB 1 1 2 428 1 1 11 VAL CG1 C -4.563 8.581 3.199 1.00 . A A . 11 VAL CG1 1 1 2 429 1 1 11 VAL CG2 C -2.543 9.904 2.552 1.00 . A A . 11 VAL CG2 1 1 2 430 1 1 11 VAL H H -2.967 8.098 0.656 1.00 . A A . 11 VAL H 1 1 2 431 1 1 11 VAL HA H -5.507 9.476 0.842 1.00 . A A . 11 VAL HA 1 1 2 432 1 1 11 VAL HB H -4.517 10.656 2.770 1.00 . A A . 11 VAL HB 1 1 2 433 1 1 11 VAL HG11 H -5.641 8.542 3.135 1.00 . A A . 11 VAL HG11 1 1 2 434 1 1 11 VAL HG12 H -4.268 8.695 4.231 1.00 . A A . 11 VAL HG12 1 1 2 435 1 1 11 VAL HG13 H -4.147 7.665 2.805 1.00 . A A . 11 VAL HG13 1 1 2 436 1 1 11 VAL HG21 H -2.246 10.905 2.277 1.00 . A A . 11 VAL HG21 1 1 2 437 1 1 11 VAL HG22 H -2.043 9.190 1.916 1.00 . A A . 11 VAL HG22 1 1 2 438 1 1 11 VAL HG23 H -2.273 9.719 3.583 1.00 . A A . 11 VAL HG23 1 1 2 439 1 1 11 VAL N N -3.811 8.443 0.290 1.00 . A A . 11 VAL N 1 1 2 440 1 1 11 VAL O O -3.518 10.820 -0.960 1.00 . A A . 11 VAL O 1 1 2 441 1 1 12 GLY C C -2.578 13.498 -0.198 1.00 . A A . 12 GLY C 1 1 2 442 1 1 12 GLY CA C -4.046 13.310 0.119 1.00 . A A . 12 GLY CA 1 1 2 443 1 1 12 GLY H H -4.781 12.015 1.623 1.00 . A A . 12 GLY H 1 1 2 444 1 1 12 GLY HA2 H -4.601 13.380 -0.796 1.00 . A A . 12 GLY HA2 1 1 2 445 1 1 12 GLY HA3 H -4.365 14.103 0.779 1.00 . A A . 12 GLY HA3 1 1 2 446 1 1 12 GLY N N -4.347 12.033 0.746 1.00 . A A . 12 GLY N 1 1 2 447 1 1 12 GLY O O -2.224 14.000 -1.260 1.00 . A A . 12 GLY O 1 1 2 448 1 1 13 ILE C C 0.325 12.031 -0.183 1.00 . A A . 13 ILE C 1 1 2 449 1 1 13 ILE CA C -0.279 13.236 0.540 1.00 . A A . 13 ILE CA 1 1 2 450 1 1 13 ILE CB C 0.448 13.459 1.885 1.00 . A A . 13 ILE CB 1 1 2 451 1 1 13 ILE CD1 C 0.740 12.521 4.241 1.00 . A A . 13 ILE CD1 1 1 2 452 1 1 13 ILE CG1 C 0.015 12.412 2.915 1.00 . A A . 13 ILE CG1 1 1 2 453 1 1 13 ILE CG2 C 0.179 14.867 2.400 1.00 . A A . 13 ILE CG2 1 1 2 454 1 1 13 ILE H H -2.068 12.711 1.549 1.00 . A A . 13 ILE H 1 1 2 455 1 1 13 ILE HA H -0.117 14.112 -0.072 1.00 . A A . 13 ILE HA 1 1 2 456 1 1 13 ILE HB H 1.510 13.365 1.711 1.00 . A A . 13 ILE HB 1 1 2 457 1 1 13 ILE HD11 H 0.719 13.546 4.580 1.00 . A A . 13 ILE HD11 1 1 2 458 1 1 13 ILE HD12 H 1.765 12.204 4.119 1.00 . A A . 13 ILE HD12 1 1 2 459 1 1 13 ILE HD13 H 0.254 11.892 4.972 1.00 . A A . 13 ILE HD13 1 1 2 460 1 1 13 ILE HG12 H -1.041 12.521 3.109 1.00 . A A . 13 ILE HG12 1 1 2 461 1 1 13 ILE HG13 H 0.203 11.425 2.516 1.00 . A A . 13 ILE HG13 1 1 2 462 1 1 13 ILE HG21 H -0.886 15.027 2.466 1.00 . A A . 13 ILE HG21 1 1 2 463 1 1 13 ILE HG22 H 0.612 15.587 1.721 1.00 . A A . 13 ILE HG22 1 1 2 464 1 1 13 ILE HG23 H 0.623 14.982 3.378 1.00 . A A . 13 ILE HG23 1 1 2 465 1 1 13 ILE N N -1.723 13.100 0.726 1.00 . A A . 13 ILE N 1 1 2 466 1 1 13 ILE O O 1.468 11.654 0.066 1.00 . A A . 13 ILE O 1 1 2 467 1 1 14 GLY C C 0.544 9.164 -1.062 1.00 . A A . 14 GLY C 1 1 2 468 1 1 14 GLY CA C -0.005 10.315 -1.888 1.00 . A A . 14 GLY CA 1 1 2 469 1 1 14 GLY H H -1.346 11.830 -1.255 1.00 . A A . 14 GLY H 1 1 2 470 1 1 14 GLY HA2 H -0.840 9.952 -2.468 1.00 . A A . 14 GLY HA2 1 1 2 471 1 1 14 GLY HA3 H 0.765 10.651 -2.568 1.00 . A A . 14 GLY HA3 1 1 2 472 1 1 14 GLY N N -0.453 11.457 -1.098 1.00 . A A . 14 GLY N 1 1 2 473 1 1 14 GLY O O 1.426 8.436 -1.512 1.00 . A A . 14 GLY O 1 1 2 474 1 1 15 THR C C -0.564 6.797 1.041 1.00 . A A . 15 THR C 1 1 2 475 1 1 15 THR CA C 0.473 7.916 1.009 1.00 . A A . 15 THR CA 1 1 2 476 1 1 15 THR CB C 0.722 8.435 2.437 1.00 . A A . 15 THR CB 1 1 2 477 1 1 15 THR CG2 C 1.418 7.386 3.292 1.00 . A A . 15 THR CG2 1 1 2 478 1 1 15 THR H H -0.680 9.594 0.450 1.00 . A A . 15 THR H 1 1 2 479 1 1 15 THR HA H 1.401 7.529 0.616 1.00 . A A . 15 THR HA 1 1 2 480 1 1 15 THR HB H -0.230 8.675 2.889 1.00 . A A . 15 THR HB 1 1 2 481 1 1 15 THR HG1 H 1.724 9.834 1.462 1.00 . A A . 15 THR HG1 1 1 2 482 1 1 15 THR HG21 H 1.227 7.589 4.336 1.00 . A A . 15 THR HG21 1 1 2 483 1 1 15 THR HG22 H 2.482 7.420 3.109 1.00 . A A . 15 THR HG22 1 1 2 484 1 1 15 THR HG23 H 1.040 6.407 3.041 1.00 . A A . 15 THR HG23 1 1 2 485 1 1 15 THR N N 0.023 8.990 0.141 1.00 . A A . 15 THR N 1 1 2 486 1 1 15 THR O O -1.736 7.043 1.319 1.00 . A A . 15 THR O 1 1 2 487 1 1 15 THR OG1 O 1.526 9.619 2.383 1.00 . A A . 15 THR OG1 1 1 2 488 1 1 16 PRO C C -1.617 4.101 2.122 1.00 . A A . 16 PRO C 1 1 2 489 1 1 16 PRO CA C -1.065 4.409 0.734 1.00 . A A . 16 PRO CA 1 1 2 490 1 1 16 PRO CB C -0.193 3.254 0.234 1.00 . A A . 16 PRO CB 1 1 2 491 1 1 16 PRO CD C 1.222 5.175 0.381 1.00 . A A . 16 PRO CD 1 1 2 492 1 1 16 PRO CG C 1.211 3.678 0.505 1.00 . A A . 16 PRO CG 1 1 2 493 1 1 16 PRO HA H -1.887 4.565 0.049 1.00 . A A . 16 PRO HA 1 1 2 494 1 1 16 PRO HB2 H -0.444 2.352 0.775 1.00 . A A . 16 PRO HB2 1 1 2 495 1 1 16 PRO HB3 H -0.361 3.105 -0.822 1.00 . A A . 16 PRO HB3 1 1 2 496 1 1 16 PRO HD2 H 1.935 5.606 1.070 1.00 . A A . 16 PRO HD2 1 1 2 497 1 1 16 PRO HD3 H 1.451 5.469 -0.633 1.00 . A A . 16 PRO HD3 1 1 2 498 1 1 16 PRO HG2 H 1.497 3.383 1.504 1.00 . A A . 16 PRO HG2 1 1 2 499 1 1 16 PRO HG3 H 1.875 3.237 -0.222 1.00 . A A . 16 PRO HG3 1 1 2 500 1 1 16 PRO N N -0.154 5.556 0.742 1.00 . A A . 16 PRO N 1 1 2 501 1 1 16 PRO O O -0.860 3.916 3.075 1.00 . A A . 16 PRO O 1 1 2 502 1 1 17 ILE C C -4.344 2.432 3.399 1.00 . A A . 17 ILE C 1 1 2 503 1 1 17 ILE CA C -3.584 3.754 3.501 1.00 . A A . 17 ILE CA 1 1 2 504 1 1 17 ILE CB C -4.525 4.918 3.915 1.00 . A A . 17 ILE CB 1 1 2 505 1 1 17 ILE CD1 C -3.867 4.815 6.377 1.00 . A A . 17 ILE CD1 1 1 2 506 1 1 17 ILE CG1 C -4.995 4.765 5.367 1.00 . A A . 17 ILE CG1 1 1 2 507 1 1 17 ILE CG2 C -5.720 5.018 2.972 1.00 . A A . 17 ILE CG2 1 1 2 508 1 1 17 ILE H H -3.488 4.199 1.429 1.00 . A A . 17 ILE H 1 1 2 509 1 1 17 ILE HA H -2.814 3.650 4.244 1.00 . A A . 17 ILE HA 1 1 2 510 1 1 17 ILE HB H -3.967 5.837 3.828 1.00 . A A . 17 ILE HB 1 1 2 511 1 1 17 ILE HD11 H -3.333 3.876 6.368 1.00 . A A . 17 ILE HD11 1 1 2 512 1 1 17 ILE HD12 H -4.275 4.989 7.362 1.00 . A A . 17 ILE HD12 1 1 2 513 1 1 17 ILE HD13 H -3.190 5.616 6.121 1.00 . A A . 17 ILE HD13 1 1 2 514 1 1 17 ILE HG12 H -5.685 5.560 5.602 1.00 . A A . 17 ILE HG12 1 1 2 515 1 1 17 ILE HG13 H -5.497 3.814 5.477 1.00 . A A . 17 ILE HG13 1 1 2 516 1 1 17 ILE HG21 H -5.557 4.375 2.119 1.00 . A A . 17 ILE HG21 1 1 2 517 1 1 17 ILE HG22 H -5.831 6.038 2.638 1.00 . A A . 17 ILE HG22 1 1 2 518 1 1 17 ILE HG23 H -6.615 4.708 3.491 1.00 . A A . 17 ILE HG23 1 1 2 519 1 1 17 ILE N N -2.936 4.044 2.229 1.00 . A A . 17 ILE N 1 1 2 520 1 1 17 ILE O O -5.347 2.192 4.071 1.00 . A A . 17 ILE O 1 1 2 521 1 1 18 SER C C -3.565 -0.473 1.253 1.00 . A A . 18 SER C 1 1 2 522 1 1 18 SER CA C -4.392 0.255 2.298 1.00 . A A . 18 SER CA 1 1 2 523 1 1 18 SER CB C -5.847 0.365 1.829 1.00 . A A . 18 SER CB 1 1 2 524 1 1 18 SER H H -3.019 1.837 2.054 1.00 . A A . 18 SER H 1 1 2 525 1 1 18 SER HA H -4.357 -0.300 3.223 1.00 . A A . 18 SER HA 1 1 2 526 1 1 18 SER HB2 H -6.183 -0.599 1.477 1.00 . A A . 18 SER HB2 1 1 2 527 1 1 18 SER HB3 H -6.466 0.681 2.654 1.00 . A A . 18 SER HB3 1 1 2 528 1 1 18 SER HG H -5.872 2.194 1.129 1.00 . A A . 18 SER HG 1 1 2 529 1 1 18 SER N N -3.826 1.574 2.541 1.00 . A A . 18 SER N 1 1 2 530 1 1 18 SER O O -2.968 0.162 0.382 1.00 . A A . 18 SER O 1 1 2 531 1 1 18 SER OG O -5.975 1.303 0.771 1.00 . A A . 18 SER OG 1 1 2 532 1 1 19 PHE C C -3.546 -3.858 0.040 1.00 . A A . 19 PHE C 1 1 2 533 1 1 19 PHE CA C -2.764 -2.598 0.387 1.00 . A A . 19 PHE CA 1 1 2 534 1 1 19 PHE CB C -1.388 -2.994 0.937 1.00 . A A . 19 PHE CB 1 1 2 535 1 1 19 PHE CD1 C -0.856 -1.443 2.849 1.00 . A A . 19 PHE CD1 1 1 2 536 1 1 19 PHE CD2 C 0.409 -1.244 0.839 1.00 . A A . 19 PHE CD2 1 1 2 537 1 1 19 PHE CE1 C -0.128 -0.414 3.414 1.00 . A A . 19 PHE CE1 1 1 2 538 1 1 19 PHE CE2 C 1.140 -0.213 1.398 1.00 . A A . 19 PHE CE2 1 1 2 539 1 1 19 PHE CG C -0.596 -1.870 1.555 1.00 . A A . 19 PHE CG 1 1 2 540 1 1 19 PHE CZ C 0.870 0.202 2.688 1.00 . A A . 19 PHE CZ 1 1 2 541 1 1 19 PHE H H -4.018 -2.244 2.057 1.00 . A A . 19 PHE H 1 1 2 542 1 1 19 PHE HA H -2.630 -2.012 -0.512 1.00 . A A . 19 PHE HA 1 1 2 543 1 1 19 PHE HB2 H -1.523 -3.755 1.686 1.00 . A A . 19 PHE HB2 1 1 2 544 1 1 19 PHE HB3 H -0.800 -3.404 0.129 1.00 . A A . 19 PHE HB3 1 1 2 545 1 1 19 PHE HD1 H -1.637 -1.925 3.419 1.00 . A A . 19 PHE HD1 1 1 2 546 1 1 19 PHE HD2 H 0.620 -1.566 -0.170 1.00 . A A . 19 PHE HD2 1 1 2 547 1 1 19 PHE HE1 H -0.341 -0.091 4.423 1.00 . A A . 19 PHE HE1 1 1 2 548 1 1 19 PHE HE2 H 1.921 0.267 0.828 1.00 . A A . 19 PHE HE2 1 1 2 549 1 1 19 PHE HZ H 1.441 1.007 3.126 1.00 . A A . 19 PHE HZ 1 1 2 550 1 1 19 PHE N N -3.522 -1.793 1.338 1.00 . A A . 19 PHE N 1 1 2 551 1 1 19 PHE O O -4.566 -4.140 0.658 1.00 . A A . 19 PHE O 1 1 2 552 1 1 20 TYR C C -3.187 -7.022 -0.587 1.00 . A A . 20 TYR C 1 1 2 553 1 1 20 TYR CA C -3.738 -5.838 -1.359 1.00 . A A . 20 TYR CA 1 1 2 554 1 1 20 TYR CB C -3.556 -6.092 -2.862 1.00 . A A . 20 TYR CB 1 1 2 555 1 1 20 TYR CD1 C -3.550 -3.900 -4.122 1.00 . A A . 20 TYR CD1 1 1 2 556 1 1 20 TYR CD2 C -5.485 -5.282 -4.278 1.00 . A A . 20 TYR CD2 1 1 2 557 1 1 20 TYR CE1 C -4.140 -2.972 -4.957 1.00 . A A . 20 TYR CE1 1 1 2 558 1 1 20 TYR CE2 C -6.082 -4.360 -5.115 1.00 . A A . 20 TYR CE2 1 1 2 559 1 1 20 TYR CG C -4.212 -5.069 -3.765 1.00 . A A . 20 TYR CG 1 1 2 560 1 1 20 TYR CZ C -5.405 -3.207 -5.452 1.00 . A A . 20 TYR CZ 1 1 2 561 1 1 20 TYR H H -2.242 -4.326 -1.398 1.00 . A A . 20 TYR H 1 1 2 562 1 1 20 TYR HA H -4.788 -5.736 -1.143 1.00 . A A . 20 TYR HA 1 1 2 563 1 1 20 TYR HB2 H -2.502 -6.098 -3.090 1.00 . A A . 20 TYR HB2 1 1 2 564 1 1 20 TYR HB3 H -3.972 -7.060 -3.104 1.00 . A A . 20 TYR HB3 1 1 2 565 1 1 20 TYR HD1 H -2.558 -3.720 -3.733 1.00 . A A . 20 TYR HD1 1 1 2 566 1 1 20 TYR HD2 H -6.013 -6.185 -4.010 1.00 . A A . 20 TYR HD2 1 1 2 567 1 1 20 TYR HE1 H -3.610 -2.069 -5.220 1.00 . A A . 20 TYR HE1 1 1 2 568 1 1 20 TYR HE2 H -7.072 -4.545 -5.504 1.00 . A A . 20 TYR HE2 1 1 2 569 1 1 20 TYR HH H -5.404 -1.535 -6.401 1.00 . A A . 20 TYR HH 1 1 2 570 1 1 20 TYR N N -3.071 -4.606 -0.944 1.00 . A A . 20 TYR N 1 1 2 571 1 1 20 TYR O O -3.920 -7.757 0.069 1.00 . A A . 20 TYR O 1 1 2 572 1 1 20 TYR OH O -5.996 -2.284 -6.284 1.00 . A A . 20 TYR OH 1 1 2 573 1 1 21 GLY C C 0.288 -8.134 -0.197 1.00 . A A . 21 GLY C 1 1 2 574 1 1 21 GLY CA C -1.202 -8.269 -0.013 1.00 . A A . 21 GLY CA 1 1 2 575 1 1 21 GLY H H -1.364 -6.566 -1.228 1.00 . A A . 21 GLY H 1 1 2 576 1 1 21 GLY HA2 H -1.438 -8.241 1.041 1.00 . A A . 21 GLY HA2 1 1 2 577 1 1 21 GLY HA3 H -1.526 -9.210 -0.430 1.00 . A A . 21 GLY HA3 1 1 2 578 1 1 21 GLY N N -1.882 -7.188 -0.684 1.00 . A A . 21 GLY N 1 1 2 579 1 1 21 GLY O O 0.698 -7.248 -0.987 1.00 . A A . 21 GLY O 1 1 2 580 1 1 21 GLY OXT O 1.050 -8.866 0.460 1.00 . A A . 21 GLY OXT 1 1 3 581 1 1 1 GLY C C -7.877 -3.201 2.029 1.00 . A A . 1 GLY C 1 1 3 582 1 1 1 GLY CA C -8.372 -2.586 0.730 1.00 . A A . 1 GLY CA 1 1 3 583 1 1 1 GLY H2 H -7.082 -1.080 -0.008 1.00 . A A . 1 GLY H2 1 1 3 584 1 1 1 GLY HA2 H -9.075 -1.801 0.966 1.00 . A A . 1 GLY HA2 1 1 3 585 1 1 1 GLY HA3 H -8.884 -3.347 0.159 1.00 . A A . 1 GLY HA3 1 1 3 586 1 1 1 GLY N N -7.312 -2.027 -0.089 1.00 . A A . 1 GLY N 1 1 3 587 1 1 1 GLY O O -8.468 -2.980 3.083 1.00 . A A . 1 GLY O 1 1 3 588 1 1 2 GLY C C -4.962 -4.003 3.600 1.00 . A A . 2 GLY C 1 1 3 589 1 1 2 GLY CA C -6.272 -4.616 3.146 1.00 . A A . 2 GLY CA 1 1 3 590 1 1 2 GLY H H -6.371 -4.122 1.088 1.00 . A A . 2 GLY H 1 1 3 591 1 1 2 GLY HA2 H -6.994 -4.524 3.944 1.00 . A A . 2 GLY HA2 1 1 3 592 1 1 2 GLY HA3 H -6.112 -5.663 2.937 1.00 . A A . 2 GLY HA3 1 1 3 593 1 1 2 GLY N N -6.806 -3.977 1.956 1.00 . A A . 2 GLY N 1 1 3 594 1 1 2 GLY O O -4.824 -2.781 3.642 1.00 . A A . 2 GLY O 1 1 3 595 1 1 3 ALA C C -1.580 -5.317 3.908 1.00 . A A . 3 ALA C 1 1 3 596 1 1 3 ALA CA C -2.691 -4.387 4.383 1.00 . A A . 3 ALA CA 1 1 3 597 1 1 3 ALA CB C -2.672 -4.266 5.901 1.00 . A A . 3 ALA CB 1 1 3 598 1 1 3 ALA H H -4.162 -5.816 3.866 1.00 . A A . 3 ALA H 1 1 3 599 1 1 3 ALA HA H -2.528 -3.406 3.965 1.00 . A A . 3 ALA HA 1 1 3 600 1 1 3 ALA HB1 H -2.837 -3.236 6.180 1.00 . A A . 3 ALA HB1 1 1 3 601 1 1 3 ALA HB2 H -1.714 -4.593 6.276 1.00 . A A . 3 ALA HB2 1 1 3 602 1 1 3 ALA HB3 H -3.454 -4.883 6.320 1.00 . A A . 3 ALA HB3 1 1 3 603 1 1 3 ALA N N -3.996 -4.852 3.930 1.00 . A A . 3 ALA N 1 1 3 604 1 1 3 ALA O O -0.717 -5.721 4.684 1.00 . A A . 3 ALA O 1 1 3 605 1 1 4 GLY C C 0.680 -5.808 1.709 1.00 . A A . 4 GLY C 1 1 3 606 1 1 4 GLY CA C -0.616 -6.529 2.046 1.00 . A A . 4 GLY CA 1 1 3 607 1 1 4 GLY H H -2.335 -5.300 2.061 1.00 . A A . 4 GLY H 1 1 3 608 1 1 4 GLY HA2 H -0.401 -7.320 2.748 1.00 . A A . 4 GLY HA2 1 1 3 609 1 1 4 GLY HA3 H -1.017 -6.964 1.143 1.00 . A A . 4 GLY HA3 1 1 3 610 1 1 4 GLY N N -1.617 -5.652 2.624 1.00 . A A . 4 GLY N 1 1 3 611 1 1 4 GLY O O 1.287 -5.168 2.566 1.00 . A A . 4 GLY O 1 1 3 612 1 1 5 HIS C C 2.131 -4.165 -0.956 1.00 . A A . 5 HIS C 1 1 3 613 1 1 5 HIS CA C 2.366 -5.308 0.033 1.00 . A A . 5 HIS CA 1 1 3 614 1 1 5 HIS CB C 3.299 -6.349 -0.594 1.00 . A A . 5 HIS CB 1 1 3 615 1 1 5 HIS CD2 C 4.812 -7.700 1.025 1.00 . A A . 5 HIS CD2 1 1 3 616 1 1 5 HIS CE1 C 3.404 -9.305 1.517 1.00 . A A . 5 HIS CE1 1 1 3 617 1 1 5 HIS CG C 3.670 -7.466 0.336 1.00 . A A . 5 HIS CG 1 1 3 618 1 1 5 HIS H H 0.605 -6.476 -0.184 1.00 . A A . 5 HIS H 1 1 3 619 1 1 5 HIS HA H 2.845 -4.903 0.912 1.00 . A A . 5 HIS HA 1 1 3 620 1 1 5 HIS HB2 H 2.816 -6.782 -1.456 1.00 . A A . 5 HIS HB2 1 1 3 621 1 1 5 HIS HB3 H 4.211 -5.860 -0.907 1.00 . A A . 5 HIS HB3 1 1 3 622 1 1 5 HIS HD1 H 1.885 -8.618 0.319 1.00 . A A . 5 HIS HD1 1 1 3 623 1 1 5 HIS HD2 H 5.706 -7.094 1.007 1.00 . A A . 5 HIS HD2 1 1 3 624 1 1 5 HIS HE1 H 2.970 -10.196 1.947 1.00 . A A . 5 HIS HE1 1 1 3 625 1 1 5 HIS HE2 H 5.212 -9.171 2.466 1.00 . A A . 5 HIS HE2 1 1 3 626 1 1 5 HIS N N 1.121 -5.931 0.463 1.00 . A A . 5 HIS N 1 1 3 627 1 1 5 HIS ND1 N 2.812 -8.493 0.668 1.00 . A A . 5 HIS ND1 1 1 3 628 1 1 5 HIS NE2 N 4.622 -8.850 1.753 1.00 . A A . 5 HIS NE2 1 1 3 629 1 1 5 HIS O O 2.740 -3.105 -0.834 1.00 . A A . 5 HIS O 1 1 3 630 1 1 6 VAL C C -0.160 -2.442 -2.480 1.00 . A A . 6 VAL C 1 1 3 631 1 1 6 VAL CA C 0.984 -3.343 -2.934 1.00 . A A . 6 VAL CA 1 1 3 632 1 1 6 VAL CB C 0.675 -3.946 -4.323 1.00 . A A . 6 VAL CB 1 1 3 633 1 1 6 VAL CG1 C 1.957 -4.408 -4.996 1.00 . A A . 6 VAL CG1 1 1 3 634 1 1 6 VAL CG2 C -0.305 -5.105 -4.211 1.00 . A A . 6 VAL CG2 1 1 3 635 1 1 6 VAL H H 0.801 -5.242 -1.998 1.00 . A A . 6 VAL H 1 1 3 636 1 1 6 VAL HA H 1.877 -2.738 -3.027 1.00 . A A . 6 VAL HA 1 1 3 637 1 1 6 VAL HB H 0.225 -3.179 -4.937 1.00 . A A . 6 VAL HB 1 1 3 638 1 1 6 VAL HG11 H 2.803 -3.932 -4.523 1.00 . A A . 6 VAL HG11 1 1 3 639 1 1 6 VAL HG12 H 1.932 -4.138 -6.043 1.00 . A A . 6 VAL HG12 1 1 3 640 1 1 6 VAL HG13 H 2.047 -5.480 -4.904 1.00 . A A . 6 VAL HG13 1 1 3 641 1 1 6 VAL HG21 H 0.212 -5.977 -3.834 1.00 . A A . 6 VAL HG21 1 1 3 642 1 1 6 VAL HG22 H -0.718 -5.324 -5.184 1.00 . A A . 6 VAL HG22 1 1 3 643 1 1 6 VAL HG23 H -1.103 -4.840 -3.532 1.00 . A A . 6 VAL HG23 1 1 3 644 1 1 6 VAL N N 1.262 -4.378 -1.938 1.00 . A A . 6 VAL N 1 1 3 645 1 1 6 VAL O O -1.246 -2.914 -2.183 1.00 . A A . 6 VAL O 1 1 3 646 1 1 7 PRO C C -2.194 -0.113 -2.762 1.00 . A A . 7 PRO C 1 1 3 647 1 1 7 PRO CA C -0.906 -0.142 -1.937 1.00 . A A . 7 PRO CA 1 1 3 648 1 1 7 PRO CB C -0.170 1.194 -2.063 1.00 . A A . 7 PRO CB 1 1 3 649 1 1 7 PRO CD C 1.384 -0.497 -2.704 1.00 . A A . 7 PRO CD 1 1 3 650 1 1 7 PRO CG C 1.277 0.843 -2.039 1.00 . A A . 7 PRO CG 1 1 3 651 1 1 7 PRO HA H -1.159 -0.305 -0.899 1.00 . A A . 7 PRO HA 1 1 3 652 1 1 7 PRO HB2 H -0.444 1.671 -2.993 1.00 . A A . 7 PRO HB2 1 1 3 653 1 1 7 PRO HB3 H -0.434 1.833 -1.234 1.00 . A A . 7 PRO HB3 1 1 3 654 1 1 7 PRO HD2 H 1.510 -0.381 -3.771 1.00 . A A . 7 PRO HD2 1 1 3 655 1 1 7 PRO HD3 H 2.200 -1.065 -2.284 1.00 . A A . 7 PRO HD3 1 1 3 656 1 1 7 PRO HG2 H 1.843 1.582 -2.587 1.00 . A A . 7 PRO HG2 1 1 3 657 1 1 7 PRO HG3 H 1.623 0.784 -1.018 1.00 . A A . 7 PRO HG3 1 1 3 658 1 1 7 PRO N N 0.090 -1.128 -2.395 1.00 . A A . 7 PRO N 1 1 3 659 1 1 7 PRO O O -2.170 -0.196 -3.988 1.00 . A A . 7 PRO O 1 1 3 660 1 1 8 GLU C C -5.058 1.543 -2.888 1.00 . A A . 8 GLU C 1 1 3 661 1 1 8 GLU CA C -4.633 0.093 -2.682 1.00 . A A . 8 GLU CA 1 1 3 662 1 1 8 GLU CB C -5.681 -0.610 -1.810 1.00 . A A . 8 GLU CB 1 1 3 663 1 1 8 GLU CD C -6.645 -2.786 -0.952 1.00 . A A . 8 GLU CD 1 1 3 664 1 1 8 GLU CG C -5.554 -2.120 -1.770 1.00 . A A . 8 GLU CG 1 1 3 665 1 1 8 GLU H H -3.253 0.100 -1.083 1.00 . A A . 8 GLU H 1 1 3 666 1 1 8 GLU HA H -4.578 -0.401 -3.640 1.00 . A A . 8 GLU HA 1 1 3 667 1 1 8 GLU HB2 H -5.594 -0.240 -0.800 1.00 . A A . 8 GLU HB2 1 1 3 668 1 1 8 GLU HB3 H -6.663 -0.365 -2.186 1.00 . A A . 8 GLU HB3 1 1 3 669 1 1 8 GLU HG2 H -5.602 -2.498 -2.780 1.00 . A A . 8 GLU HG2 1 1 3 670 1 1 8 GLU HG3 H -4.597 -2.374 -1.339 1.00 . A A . 8 GLU HG3 1 1 3 671 1 1 8 GLU N N -3.317 0.026 -2.058 1.00 . A A . 8 GLU N 1 1 3 672 1 1 8 GLU O O -5.088 2.044 -4.009 1.00 . A A . 8 GLU O 1 1 3 673 1 1 8 GLU OE1 O -6.862 -4.005 -1.108 1.00 . A A . 8 GLU OE1 1 1 3 674 1 1 9 TYR C C -4.755 4.511 -1.264 1.00 . A A . 9 TYR C 1 1 3 675 1 1 9 TYR CA C -5.828 3.598 -1.835 1.00 . A A . 9 TYR CA 1 1 3 676 1 1 9 TYR CB C -7.135 3.794 -1.056 1.00 . A A . 9 TYR CB 1 1 3 677 1 1 9 TYR CD1 C -8.379 1.627 -1.470 1.00 . A A . 9 TYR CD1 1 1 3 678 1 1 9 TYR CD2 C -9.362 3.657 -2.241 1.00 . A A . 9 TYR CD2 1 1 3 679 1 1 9 TYR CE1 C -9.455 0.914 -1.961 1.00 . A A . 9 TYR CE1 1 1 3 680 1 1 9 TYR CE2 C -10.443 2.950 -2.734 1.00 . A A . 9 TYR CE2 1 1 3 681 1 1 9 TYR CG C -8.311 3.009 -1.603 1.00 . A A . 9 TYR CG 1 1 3 682 1 1 9 TYR CZ C -10.483 1.578 -2.592 1.00 . A A . 9 TYR CZ 1 1 3 683 1 1 9 TYR H H -5.355 1.750 -0.921 1.00 . A A . 9 TYR H 1 1 3 684 1 1 9 TYR HA H -5.992 3.859 -2.869 1.00 . A A . 9 TYR HA 1 1 3 685 1 1 9 TYR HB2 H -6.983 3.487 -0.034 1.00 . A A . 9 TYR HB2 1 1 3 686 1 1 9 TYR HB3 H -7.400 4.841 -1.074 1.00 . A A . 9 TYR HB3 1 1 3 687 1 1 9 TYR HD1 H -7.572 1.108 -0.974 1.00 . A A . 9 TYR HD1 1 1 3 688 1 1 9 TYR HD2 H -9.327 4.730 -2.354 1.00 . A A . 9 TYR HD2 1 1 3 689 1 1 9 TYR HE1 H -9.485 -0.159 -1.849 1.00 . A A . 9 TYR HE1 1 1 3 690 1 1 9 TYR HE2 H -11.249 3.470 -3.228 1.00 . A A . 9 TYR HE2 1 1 3 691 1 1 9 TYR HH H -11.548 0.900 -4.042 1.00 . A A . 9 TYR HH 1 1 3 692 1 1 9 TYR N N -5.394 2.208 -1.789 1.00 . A A . 9 TYR N 1 1 3 693 1 1 9 TYR O O -4.050 4.143 -0.318 1.00 . A A . 9 TYR O 1 1 3 694 1 1 9 TYR OH O -11.555 0.870 -3.081 1.00 . A A . 9 TYR OH 1 1 3 695 1 1 10 PHE C C -4.335 7.977 -1.019 1.00 . A A . 10 PHE C 1 1 3 696 1 1 10 PHE CA C -3.652 6.670 -1.390 1.00 . A A . 10 PHE CA 1 1 3 697 1 1 10 PHE CB C -2.611 6.974 -2.475 1.00 . A A . 10 PHE CB 1 1 3 698 1 1 10 PHE CD1 C -2.737 4.981 -4.014 1.00 . A A . 10 PHE CD1 1 1 3 699 1 1 10 PHE CD2 C -0.669 5.449 -2.923 1.00 . A A . 10 PHE CD2 1 1 3 700 1 1 10 PHE CE1 C -2.164 3.891 -4.642 1.00 . A A . 10 PHE CE1 1 1 3 701 1 1 10 PHE CE2 C -0.091 4.360 -3.546 1.00 . A A . 10 PHE CE2 1 1 3 702 1 1 10 PHE CG C -1.996 5.772 -3.147 1.00 . A A . 10 PHE CG 1 1 3 703 1 1 10 PHE CZ C -0.840 3.581 -4.407 1.00 . A A . 10 PHE CZ 1 1 3 704 1 1 10 PHE H H -5.231 5.932 -2.581 1.00 . A A . 10 PHE H 1 1 3 705 1 1 10 PHE HA H -3.157 6.269 -0.519 1.00 . A A . 10 PHE HA 1 1 3 706 1 1 10 PHE HB2 H -3.076 7.573 -3.236 1.00 . A A . 10 PHE HB2 1 1 3 707 1 1 10 PHE HB3 H -1.809 7.544 -2.027 1.00 . A A . 10 PHE HB3 1 1 3 708 1 1 10 PHE HD1 H -3.774 5.222 -4.196 1.00 . A A . 10 PHE HD1 1 1 3 709 1 1 10 PHE HD2 H -0.082 6.056 -2.251 1.00 . A A . 10 PHE HD2 1 1 3 710 1 1 10 PHE HE1 H -2.753 3.283 -5.312 1.00 . A A . 10 PHE HE1 1 1 3 711 1 1 10 PHE HE2 H 0.944 4.118 -3.360 1.00 . A A . 10 PHE HE2 1 1 3 712 1 1 10 PHE HZ H -0.390 2.729 -4.896 1.00 . A A . 10 PHE HZ 1 1 3 713 1 1 10 PHE N N -4.636 5.699 -1.838 1.00 . A A . 10 PHE N 1 1 3 714 1 1 10 PHE O O -5.262 8.419 -1.695 1.00 . A A . 10 PHE O 1 1 3 715 1 1 11 VAL C C -3.800 10.975 -0.422 1.00 . A A . 11 VAL C 1 1 3 716 1 1 11 VAL CA C -4.366 9.884 0.481 1.00 . A A . 11 VAL CA 1 1 3 717 1 1 11 VAL CB C -3.987 10.175 1.958 1.00 . A A . 11 VAL CB 1 1 3 718 1 1 11 VAL CG1 C -4.616 11.472 2.449 1.00 . A A . 11 VAL CG1 1 1 3 719 1 1 11 VAL CG2 C -4.398 9.022 2.856 1.00 . A A . 11 VAL CG2 1 1 3 720 1 1 11 VAL H H -3.087 8.201 0.510 1.00 . A A . 11 VAL H 1 1 3 721 1 1 11 VAL HA H -5.443 9.866 0.393 1.00 . A A . 11 VAL HA 1 1 3 722 1 1 11 VAL HB H -2.913 10.280 2.018 1.00 . A A . 11 VAL HB 1 1 3 723 1 1 11 VAL HG11 H -5.661 11.305 2.666 1.00 . A A . 11 VAL HG11 1 1 3 724 1 1 11 VAL HG12 H -4.524 12.229 1.685 1.00 . A A . 11 VAL HG12 1 1 3 725 1 1 11 VAL HG13 H -4.111 11.801 3.345 1.00 . A A . 11 VAL HG13 1 1 3 726 1 1 11 VAL HG21 H -5.475 9.000 2.942 1.00 . A A . 11 VAL HG21 1 1 3 727 1 1 11 VAL HG22 H -3.963 9.154 3.834 1.00 . A A . 11 VAL HG22 1 1 3 728 1 1 11 VAL HG23 H -4.053 8.092 2.430 1.00 . A A . 11 VAL HG23 1 1 3 729 1 1 11 VAL N N -3.846 8.602 0.035 1.00 . A A . 11 VAL N 1 1 3 730 1 1 11 VAL O O -2.742 10.785 -1.022 1.00 . A A . 11 VAL O 1 1 3 731 1 1 12 GLY C C -2.625 13.617 -1.119 1.00 . A A . 12 GLY C 1 1 3 732 1 1 12 GLY CA C -4.064 13.201 -1.370 1.00 . A A . 12 GLY CA 1 1 3 733 1 1 12 GLY H H -5.346 12.179 -0.030 1.00 . A A . 12 GLY H 1 1 3 734 1 1 12 GLY HA2 H -4.156 12.902 -2.398 1.00 . A A . 12 GLY HA2 1 1 3 735 1 1 12 GLY HA3 H -4.707 14.050 -1.197 1.00 . A A . 12 GLY HA3 1 1 3 736 1 1 12 GLY N N -4.506 12.099 -0.525 1.00 . A A . 12 GLY N 1 1 3 737 1 1 12 GLY O O -1.938 14.072 -2.029 1.00 . A A . 12 GLY O 1 1 3 738 1 1 13 ILE C C 0.188 12.683 0.163 1.00 . A A . 13 ILE C 1 1 3 739 1 1 13 ILE CA C -0.802 13.808 0.483 1.00 . A A . 13 ILE CA 1 1 3 740 1 1 13 ILE CB C -0.697 14.173 1.980 1.00 . A A . 13 ILE CB 1 1 3 741 1 1 13 ILE CD1 C -1.096 13.275 4.339 1.00 . A A . 13 ILE CD1 1 1 3 742 1 1 13 ILE CG1 C -1.244 13.034 2.850 1.00 . A A . 13 ILE CG1 1 1 3 743 1 1 13 ILE CG2 C -1.440 15.473 2.259 1.00 . A A . 13 ILE CG2 1 1 3 744 1 1 13 ILE H H -2.765 13.076 0.788 1.00 . A A . 13 ILE H 1 1 3 745 1 1 13 ILE HA H -0.526 14.674 -0.095 1.00 . A A . 13 ILE HA 1 1 3 746 1 1 13 ILE HB H 0.345 14.328 2.216 1.00 . A A . 13 ILE HB 1 1 3 747 1 1 13 ILE HD11 H -1.545 12.456 4.881 1.00 . A A . 13 ILE HD11 1 1 3 748 1 1 13 ILE HD12 H -1.589 14.197 4.604 1.00 . A A . 13 ILE HD12 1 1 3 749 1 1 13 ILE HD13 H -0.047 13.342 4.589 1.00 . A A . 13 ILE HD13 1 1 3 750 1 1 13 ILE HG12 H -2.295 12.903 2.640 1.00 . A A . 13 ILE HG12 1 1 3 751 1 1 13 ILE HG13 H -0.717 12.122 2.608 1.00 . A A . 13 ILE HG13 1 1 3 752 1 1 13 ILE HG21 H -0.915 16.030 3.019 1.00 . A A . 13 ILE HG21 1 1 3 753 1 1 13 ILE HG22 H -2.441 15.248 2.602 1.00 . A A . 13 ILE HG22 1 1 3 754 1 1 13 ILE HG23 H -1.493 16.059 1.354 1.00 . A A . 13 ILE HG23 1 1 3 755 1 1 13 ILE N N -2.171 13.451 0.114 1.00 . A A . 13 ILE N 1 1 3 756 1 1 13 ILE O O 1.211 12.535 0.829 1.00 . A A . 13 ILE O 1 1 3 757 1 1 14 GLY C C 1.041 9.818 -0.212 1.00 . A A . 14 GLY C 1 1 3 758 1 1 14 GLY CA C 0.743 10.827 -1.307 1.00 . A A . 14 GLY CA 1 1 3 759 1 1 14 GLY H H -0.943 12.110 -1.372 1.00 . A A . 14 GLY H 1 1 3 760 1 1 14 GLY HA2 H 0.264 10.312 -2.127 1.00 . A A . 14 GLY HA2 1 1 3 761 1 1 14 GLY HA3 H 1.675 11.243 -1.660 1.00 . A A . 14 GLY HA3 1 1 3 762 1 1 14 GLY N N -0.120 11.917 -0.877 1.00 . A A . 14 GLY N 1 1 3 763 1 1 14 GLY O O 2.199 9.483 0.027 1.00 . A A . 14 GLY O 1 1 3 764 1 1 15 THR C C -0.783 7.205 1.418 1.00 . A A . 15 THR C 1 1 3 765 1 1 15 THR CA C 0.202 8.369 1.535 1.00 . A A . 15 THR CA 1 1 3 766 1 1 15 THR CB C 0.027 9.042 2.910 1.00 . A A . 15 THR CB 1 1 3 767 1 1 15 THR CG2 C 0.475 8.119 4.033 1.00 . A A . 15 THR CG2 1 1 3 768 1 1 15 THR H H -0.895 9.636 0.239 1.00 . A A . 15 THR H 1 1 3 769 1 1 15 THR HA H 1.211 7.988 1.469 1.00 . A A . 15 THR HA 1 1 3 770 1 1 15 THR HB H -1.019 9.275 3.050 1.00 . A A . 15 THR HB 1 1 3 771 1 1 15 THR HG1 H 1.287 10.359 2.141 1.00 . A A . 15 THR HG1 1 1 3 772 1 1 15 THR HG21 H 0.710 7.146 3.627 1.00 . A A . 15 THR HG21 1 1 3 773 1 1 15 THR HG22 H -0.319 8.024 4.759 1.00 . A A . 15 THR HG22 1 1 3 774 1 1 15 THR HG23 H 1.352 8.531 4.510 1.00 . A A . 15 THR HG23 1 1 3 775 1 1 15 THR N N 0.009 9.336 0.462 1.00 . A A . 15 THR N 1 1 3 776 1 1 15 THR O O -1.992 7.397 1.495 1.00 . A A . 15 THR O 1 1 3 777 1 1 15 THR OG1 O 0.787 10.257 2.958 1.00 . A A . 15 THR OG1 1 1 3 778 1 1 16 PRO C C -1.631 4.317 2.474 1.00 . A A . 16 PRO C 1 1 3 779 1 1 16 PRO CA C -1.112 4.780 1.115 1.00 . A A . 16 PRO CA 1 1 3 780 1 1 16 PRO CB C -0.164 3.724 0.523 1.00 . A A . 16 PRO CB 1 1 3 781 1 1 16 PRO CD C 1.145 5.648 1.127 1.00 . A A . 16 PRO CD 1 1 3 782 1 1 16 PRO CG C 1.129 4.429 0.248 1.00 . A A . 16 PRO CG 1 1 3 783 1 1 16 PRO HA H -1.944 4.940 0.445 1.00 . A A . 16 PRO HA 1 1 3 784 1 1 16 PRO HB2 H -0.027 2.925 1.236 1.00 . A A . 16 PRO HB2 1 1 3 785 1 1 16 PRO HB3 H -0.592 3.327 -0.386 1.00 . A A . 16 PRO HB3 1 1 3 786 1 1 16 PRO HD2 H 1.563 5.412 2.095 1.00 . A A . 16 PRO HD2 1 1 3 787 1 1 16 PRO HD3 H 1.695 6.449 0.658 1.00 . A A . 16 PRO HD3 1 1 3 788 1 1 16 PRO HG2 H 1.958 3.783 0.493 1.00 . A A . 16 PRO HG2 1 1 3 789 1 1 16 PRO HG3 H 1.173 4.719 -0.791 1.00 . A A . 16 PRO HG3 1 1 3 790 1 1 16 PRO N N -0.277 5.976 1.233 1.00 . A A . 16 PRO N 1 1 3 791 1 1 16 PRO O O -0.863 4.193 3.428 1.00 . A A . 16 PRO O 1 1 3 792 1 1 17 ILE C C -4.264 2.291 3.637 1.00 . A A . 17 ILE C 1 1 3 793 1 1 17 ILE CA C -3.530 3.611 3.822 1.00 . A A . 17 ILE CA 1 1 3 794 1 1 17 ILE CB C -4.498 4.662 4.436 1.00 . A A . 17 ILE CB 1 1 3 795 1 1 17 ILE CD1 C -5.449 5.684 2.264 1.00 . A A . 17 ILE CD1 1 1 3 796 1 1 17 ILE CG1 C -5.730 4.912 3.538 1.00 . A A . 17 ILE CG1 1 1 3 797 1 1 17 ILE CG2 C -3.761 5.965 4.716 1.00 . A A . 17 ILE CG2 1 1 3 798 1 1 17 ILE H H -3.501 4.175 1.773 1.00 . A A . 17 ILE H 1 1 3 799 1 1 17 ILE HA H -2.723 3.451 4.518 1.00 . A A . 17 ILE HA 1 1 3 800 1 1 17 ILE HB H -4.838 4.273 5.385 1.00 . A A . 17 ILE HB 1 1 3 801 1 1 17 ILE HD11 H -5.514 6.743 2.464 1.00 . A A . 17 ILE HD11 1 1 3 802 1 1 17 ILE HD12 H -6.178 5.415 1.513 1.00 . A A . 17 ILE HD12 1 1 3 803 1 1 17 ILE HD13 H -4.459 5.443 1.908 1.00 . A A . 17 ILE HD13 1 1 3 804 1 1 17 ILE HG12 H -6.153 3.961 3.255 1.00 . A A . 17 ILE HG12 1 1 3 805 1 1 17 ILE HG13 H -6.465 5.466 4.106 1.00 . A A . 17 ILE HG13 1 1 3 806 1 1 17 ILE HG21 H -3.431 5.978 5.744 1.00 . A A . 17 ILE HG21 1 1 3 807 1 1 17 ILE HG22 H -4.426 6.798 4.541 1.00 . A A . 17 ILE HG22 1 1 3 808 1 1 17 ILE HG23 H -2.906 6.043 4.061 1.00 . A A . 17 ILE HG23 1 1 3 809 1 1 17 ILE N N -2.932 4.061 2.564 1.00 . A A . 17 ILE N 1 1 3 810 1 1 17 ILE O O -5.274 2.021 4.283 1.00 . A A . 17 ILE O 1 1 3 811 1 1 18 SER C C -3.439 -0.524 1.387 1.00 . A A . 18 SER C 1 1 3 812 1 1 18 SER CA C -4.289 0.159 2.447 1.00 . A A . 18 SER CA 1 1 3 813 1 1 18 SER CB C -5.738 0.284 1.962 1.00 . A A . 18 SER CB 1 1 3 814 1 1 18 SER H H -2.916 1.753 2.284 1.00 . A A . 18 SER H 1 1 3 815 1 1 18 SER HA H -4.266 -0.433 3.351 1.00 . A A . 18 SER HA 1 1 3 816 1 1 18 SER HB2 H -6.065 -0.665 1.564 1.00 . A A . 18 SER HB2 1 1 3 817 1 1 18 SER HB3 H -6.371 0.563 2.792 1.00 . A A . 18 SER HB3 1 1 3 818 1 1 18 SER HG H -5.910 2.137 1.357 1.00 . A A . 18 SER HG 1 1 3 819 1 1 18 SER N N -3.727 1.470 2.750 1.00 . A A . 18 SER N 1 1 3 820 1 1 18 SER O O -2.790 0.151 0.590 1.00 . A A . 18 SER O 1 1 3 821 1 1 18 SER OG O -5.856 1.268 0.945 1.00 . A A . 18 SER OG 1 1 3 822 1 1 19 PHE C C -3.419 -3.876 0.018 1.00 . A A . 19 PHE C 1 1 3 823 1 1 19 PHE CA C -2.657 -2.613 0.406 1.00 . A A . 19 PHE CA 1 1 3 824 1 1 19 PHE CB C -1.274 -3.013 0.943 1.00 . A A . 19 PHE CB 1 1 3 825 1 1 19 PHE CD1 C -0.810 -1.514 2.921 1.00 . A A . 19 PHE CD1 1 1 3 826 1 1 19 PHE CD2 C 0.569 -1.305 0.989 1.00 . A A . 19 PHE CD2 1 1 3 827 1 1 19 PHE CE1 C -0.086 -0.519 3.549 1.00 . A A . 19 PHE CE1 1 1 3 828 1 1 19 PHE CE2 C 1.298 -0.312 1.613 1.00 . A A . 19 PHE CE2 1 1 3 829 1 1 19 PHE CG C -0.495 -1.917 1.631 1.00 . A A . 19 PHE CG 1 1 3 830 1 1 19 PHE CZ C 0.970 0.083 2.895 1.00 . A A . 19 PHE CZ 1 1 3 831 1 1 19 PHE H H -3.976 -2.340 2.047 1.00 . A A . 19 PHE H 1 1 3 832 1 1 19 PHE HA H -2.532 -1.997 -0.473 1.00 . A A . 19 PHE HA 1 1 3 833 1 1 19 PHE HB2 H -1.398 -3.821 1.641 1.00 . A A . 19 PHE HB2 1 1 3 834 1 1 19 PHE HB3 H -0.676 -3.365 0.115 1.00 . A A . 19 PHE HB3 1 1 3 835 1 1 19 PHE HD1 H -1.635 -1.982 3.435 1.00 . A A . 19 PHE HD1 1 1 3 836 1 1 19 PHE HD2 H 0.824 -1.609 -0.015 1.00 . A A . 19 PHE HD2 1 1 3 837 1 1 19 PHE HE1 H -0.346 -0.212 4.552 1.00 . A A . 19 PHE HE1 1 1 3 838 1 1 19 PHE HE2 H 2.125 0.154 1.099 1.00 . A A . 19 PHE HE2 1 1 3 839 1 1 19 PHE HZ H 1.539 0.859 3.384 1.00 . A A . 19 PHE HZ 1 1 3 840 1 1 19 PHE N N -3.436 -1.853 1.380 1.00 . A A . 19 PHE N 1 1 3 841 1 1 19 PHE O O -4.381 -4.247 0.678 1.00 . A A . 19 PHE O 1 1 3 842 1 1 20 TYR C C -2.966 -6.957 -0.830 1.00 . A A . 20 TYR C 1 1 3 843 1 1 20 TYR CA C -3.619 -5.758 -1.508 1.00 . A A . 20 TYR CA 1 1 3 844 1 1 20 TYR CB C -3.516 -5.904 -3.033 1.00 . A A . 20 TYR CB 1 1 3 845 1 1 20 TYR CD1 C -3.562 -3.644 -4.165 1.00 . A A . 20 TYR CD1 1 1 3 846 1 1 20 TYR CD2 C -5.533 -4.979 -4.241 1.00 . A A . 20 TYR CD2 1 1 3 847 1 1 20 TYR CE1 C -4.195 -2.656 -4.894 1.00 . A A . 20 TYR CE1 1 1 3 848 1 1 20 TYR CE2 C -6.175 -3.996 -4.970 1.00 . A A . 20 TYR CE2 1 1 3 849 1 1 20 TYR CG C -4.216 -4.820 -3.827 1.00 . A A . 20 TYR CG 1 1 3 850 1 1 20 TYR CZ C -5.502 -2.836 -5.294 1.00 . A A . 20 TYR CZ 1 1 3 851 1 1 20 TYR H H -2.193 -4.188 -1.516 1.00 . A A . 20 TYR H 1 1 3 852 1 1 20 TYR HA H -4.660 -5.720 -1.222 1.00 . A A . 20 TYR HA 1 1 3 853 1 1 20 TYR HB2 H -2.476 -5.891 -3.316 1.00 . A A . 20 TYR HB2 1 1 3 854 1 1 20 TYR HB3 H -3.946 -6.853 -3.322 1.00 . A A . 20 TYR HB3 1 1 3 855 1 1 20 TYR HD1 H -2.537 -3.503 -3.850 1.00 . A A . 20 TYR HD1 1 1 3 856 1 1 20 TYR HD2 H -6.057 -5.888 -3.986 1.00 . A A . 20 TYR HD2 1 1 3 857 1 1 20 TYR HE1 H -3.668 -1.748 -5.147 1.00 . A A . 20 TYR HE1 1 1 3 858 1 1 20 TYR HE2 H -7.199 -4.138 -5.282 1.00 . A A . 20 TYR HE2 1 1 3 859 1 1 20 TYR HH H -5.579 -1.071 -6.053 1.00 . A A . 20 TYR HH 1 1 3 860 1 1 20 TYR N N -2.981 -4.532 -1.041 1.00 . A A . 20 TYR N 1 1 3 861 1 1 20 TYR O O -3.027 -7.096 0.389 1.00 . A A . 20 TYR O 1 1 3 862 1 1 20 TYR OH O -6.138 -1.854 -6.016 1.00 . A A . 20 TYR OH 1 1 3 863 1 1 21 GLY C C -0.187 -8.618 -0.810 1.00 . A A . 21 GLY C 1 1 3 864 1 1 21 GLY CA C -1.634 -8.948 -1.094 1.00 . A A . 21 GLY CA 1 1 3 865 1 1 21 GLY H H -2.288 -7.617 -2.587 1.00 . A A . 21 GLY H 1 1 3 866 1 1 21 GLY HA2 H -2.117 -9.258 -0.176 1.00 . A A . 21 GLY HA2 1 1 3 867 1 1 21 GLY HA3 H -1.679 -9.754 -1.809 1.00 . A A . 21 GLY HA3 1 1 3 868 1 1 21 GLY N N -2.323 -7.797 -1.628 1.00 . A A . 21 GLY N 1 1 3 869 1 1 21 GLY O O 0.315 -7.628 -1.384 1.00 . A A . 21 GLY O 1 1 3 870 1 1 21 GLY OXT O 0.452 -9.320 -0.006 1.00 . A A . 21 GLY OXT 1 1 4 871 1 1 1 GLY C C -8.273 -3.482 1.718 1.00 . A A . 1 GLY C 1 1 4 872 1 1 1 GLY CA C -8.733 -2.469 0.686 1.00 . A A . 1 GLY CA 1 1 4 873 1 1 1 GLY H2 H -7.405 -1.044 -0.144 1.00 . A A . 1 GLY H2 1 1 4 874 1 1 1 GLY HA2 H -9.170 -1.625 1.199 1.00 . A A . 1 GLY HA2 1 1 4 875 1 1 1 GLY HA3 H -9.488 -2.926 0.063 1.00 . A A . 1 GLY HA3 1 1 4 876 1 1 1 GLY N N -7.654 -1.991 -0.164 1.00 . A A . 1 GLY N 1 1 4 877 1 1 1 GLY O O -8.994 -4.426 2.031 1.00 . A A . 1 GLY O 1 1 4 878 1 1 2 GLY C C -5.126 -3.842 3.636 1.00 . A A . 2 GLY C 1 1 4 879 1 1 2 GLY CA C -6.546 -4.192 3.248 1.00 . A A . 2 GLY CA 1 1 4 880 1 1 2 GLY H H -6.545 -2.516 1.966 1.00 . A A . 2 GLY H 1 1 4 881 1 1 2 GLY HA2 H -7.172 -4.151 4.126 1.00 . A A . 2 GLY HA2 1 1 4 882 1 1 2 GLY HA3 H -6.562 -5.196 2.850 1.00 . A A . 2 GLY HA3 1 1 4 883 1 1 2 GLY N N -7.075 -3.284 2.249 1.00 . A A . 2 GLY N 1 1 4 884 1 1 2 GLY O O -4.787 -2.663 3.766 1.00 . A A . 2 GLY O 1 1 4 885 1 1 3 ALA C C -2.013 -5.678 3.462 1.00 . A A . 3 ALA C 1 1 4 886 1 1 3 ALA CA C -2.894 -4.654 4.162 1.00 . A A . 3 ALA CA 1 1 4 887 1 1 3 ALA CB C -2.718 -4.742 5.671 1.00 . A A . 3 ALA CB 1 1 4 888 1 1 3 ALA H H -4.615 -5.772 3.659 1.00 . A A . 3 ALA H 1 1 4 889 1 1 3 ALA HA H -2.604 -3.663 3.843 1.00 . A A . 3 ALA HA 1 1 4 890 1 1 3 ALA HB1 H -2.227 -5.671 5.921 1.00 . A A . 3 ALA HB1 1 1 4 891 1 1 3 ALA HB2 H -3.686 -4.707 6.148 1.00 . A A . 3 ALA HB2 1 1 4 892 1 1 3 ALA HB3 H -2.117 -3.913 6.012 1.00 . A A . 3 ALA HB3 1 1 4 893 1 1 3 ALA N N -4.290 -4.856 3.799 1.00 . A A . 3 ALA N 1 1 4 894 1 1 3 ALA O O -2.389 -6.839 3.328 1.00 . A A . 3 ALA O 1 1 4 895 1 1 4 GLY C C 1.264 -5.377 1.762 1.00 . A A . 4 GLY C 1 1 4 896 1 1 4 GLY CA C 0.061 -6.118 2.308 1.00 . A A . 4 GLY CA 1 1 4 897 1 1 4 GLY H H -0.610 -4.296 3.132 1.00 . A A . 4 GLY H 1 1 4 898 1 1 4 GLY HA2 H 0.399 -6.882 2.994 1.00 . A A . 4 GLY HA2 1 1 4 899 1 1 4 GLY HA3 H -0.463 -6.588 1.490 1.00 . A A . 4 GLY HA3 1 1 4 900 1 1 4 GLY N N -0.851 -5.236 3.005 1.00 . A A . 4 GLY N 1 1 4 901 1 1 4 GLY O O 1.931 -4.646 2.491 1.00 . A A . 4 GLY O 1 1 4 902 1 1 5 HIS C C 2.238 -3.937 -1.234 1.00 . A A . 5 HIS C 1 1 4 903 1 1 5 HIS CA C 2.685 -4.924 -0.158 1.00 . A A . 5 HIS CA 1 1 4 904 1 1 5 HIS CB C 3.627 -5.964 -0.781 1.00 . A A . 5 HIS CB 1 1 4 905 1 1 5 HIS CD2 C 5.361 -7.050 0.812 1.00 . A A . 5 HIS CD2 1 1 4 906 1 1 5 HIS CE1 C 4.149 -8.738 1.507 1.00 . A A . 5 HIS CE1 1 1 4 907 1 1 5 HIS CG C 4.160 -6.970 0.193 1.00 . A A . 5 HIS CG 1 1 4 908 1 1 5 HIS H H 0.980 -6.176 -0.055 1.00 . A A . 5 HIS H 1 1 4 909 1 1 5 HIS HA H 3.224 -4.382 0.604 1.00 . A A . 5 HIS HA 1 1 4 910 1 1 5 HIS HB2 H 3.095 -6.502 -1.551 1.00 . A A . 5 HIS HB2 1 1 4 911 1 1 5 HIS HB3 H 4.469 -5.452 -1.226 1.00 . A A . 5 HIS HB3 1 1 4 912 1 1 5 HIS HD1 H 2.497 -8.280 0.372 1.00 . A A . 5 HIS HD1 1 1 4 913 1 1 5 HIS HD2 H 6.191 -6.369 0.690 1.00 . A A . 5 HIS HD2 1 1 4 914 1 1 5 HIS HE1 H 3.830 -9.631 2.024 1.00 . A A . 5 HIS HE1 1 1 4 915 1 1 5 HIS HE2 H 6.003 -8.386 2.297 1.00 . A A . 5 HIS HE2 1 1 4 916 1 1 5 HIS N N 1.549 -5.570 0.481 1.00 . A A . 5 HIS N 1 1 4 917 1 1 5 HIS ND1 N 3.427 -8.045 0.651 1.00 . A A . 5 HIS ND1 1 1 4 918 1 1 5 HIS NE2 N 5.329 -8.158 1.625 1.00 . A A . 5 HIS NE2 1 1 4 919 1 1 5 HIS O O 2.779 -2.837 -1.328 1.00 . A A . 5 HIS O 1 1 4 920 1 1 6 VAL C C -0.367 -2.572 -2.604 1.00 . A A . 6 VAL C 1 1 4 921 1 1 6 VAL CA C 0.774 -3.448 -3.108 1.00 . A A . 6 VAL CA 1 1 4 922 1 1 6 VAL CB C 0.329 -4.243 -4.358 1.00 . A A . 6 VAL CB 1 1 4 923 1 1 6 VAL CG1 C 1.542 -4.695 -5.155 1.00 . A A . 6 VAL CG1 1 1 4 924 1 1 6 VAL CG2 C -0.522 -5.443 -3.972 1.00 . A A . 6 VAL CG2 1 1 4 925 1 1 6 VAL H H 0.853 -5.215 -1.932 1.00 . A A . 6 VAL H 1 1 4 926 1 1 6 VAL HA H 1.593 -2.804 -3.398 1.00 . A A . 6 VAL HA 1 1 4 927 1 1 6 VAL HB H -0.265 -3.591 -4.984 1.00 . A A . 6 VAL HB 1 1 4 928 1 1 6 VAL HG11 H 1.216 -5.152 -6.078 1.00 . A A . 6 VAL HG11 1 1 4 929 1 1 6 VAL HG12 H 2.104 -5.413 -4.577 1.00 . A A . 6 VAL HG12 1 1 4 930 1 1 6 VAL HG13 H 2.166 -3.842 -5.376 1.00 . A A . 6 VAL HG13 1 1 4 931 1 1 6 VAL HG21 H -0.427 -6.210 -4.726 1.00 . A A . 6 VAL HG21 1 1 4 932 1 1 6 VAL HG22 H -1.556 -5.141 -3.893 1.00 . A A . 6 VAL HG22 1 1 4 933 1 1 6 VAL HG23 H -0.187 -5.830 -3.020 1.00 . A A . 6 VAL HG23 1 1 4 934 1 1 6 VAL N N 1.260 -4.326 -2.047 1.00 . A A . 6 VAL N 1 1 4 935 1 1 6 VAL O O -1.402 -3.071 -2.184 1.00 . A A . 6 VAL O 1 1 4 936 1 1 7 PRO C C -2.465 -0.256 -2.920 1.00 . A A . 7 PRO C 1 1 4 937 1 1 7 PRO CA C -1.158 -0.275 -2.125 1.00 . A A . 7 PRO CA 1 1 4 938 1 1 7 PRO CB C -0.444 1.073 -2.266 1.00 . A A . 7 PRO CB 1 1 4 939 1 1 7 PRO CD C 1.063 -0.590 -3.070 1.00 . A A . 7 PRO CD 1 1 4 940 1 1 7 PRO CG C 1.004 0.743 -2.385 1.00 . A A . 7 PRO CG 1 1 4 941 1 1 7 PRO HA H -1.386 -0.446 -1.084 1.00 . A A . 7 PRO HA 1 1 4 942 1 1 7 PRO HB2 H -0.805 1.583 -3.146 1.00 . A A . 7 PRO HB2 1 1 4 943 1 1 7 PRO HB3 H -0.637 1.677 -1.391 1.00 . A A . 7 PRO HB3 1 1 4 944 1 1 7 PRO HD2 H 1.062 -0.465 -4.143 1.00 . A A . 7 PRO HD2 1 1 4 945 1 1 7 PRO HD3 H 1.936 -1.141 -2.751 1.00 . A A . 7 PRO HD3 1 1 4 946 1 1 7 PRO HG2 H 1.505 1.493 -2.979 1.00 . A A . 7 PRO HG2 1 1 4 947 1 1 7 PRO HG3 H 1.450 0.680 -1.403 1.00 . A A . 7 PRO HG3 1 1 4 948 1 1 7 PRO N N -0.168 -1.249 -2.613 1.00 . A A . 7 PRO N 1 1 4 949 1 1 7 PRO O O -2.465 -0.332 -4.147 1.00 . A A . 7 PRO O 1 1 4 950 1 1 8 GLU C C -5.292 1.384 -3.056 1.00 . A A . 8 GLU C 1 1 4 951 1 1 8 GLU CA C -4.899 -0.064 -2.793 1.00 . A A . 8 GLU CA 1 1 4 952 1 1 8 GLU CB C -5.945 -0.706 -1.876 1.00 . A A . 8 GLU CB 1 1 4 953 1 1 8 GLU CD C -6.996 -2.818 -0.974 1.00 . A A . 8 GLU CD 1 1 4 954 1 1 8 GLU CG C -5.888 -2.219 -1.820 1.00 . A A . 8 GLU CG 1 1 4 955 1 1 8 GLU H H -3.489 -0.055 -1.219 1.00 . A A . 8 GLU H 1 1 4 956 1 1 8 GLU HA H -4.872 -0.600 -3.731 1.00 . A A . 8 GLU HA 1 1 4 957 1 1 8 GLU HB2 H -5.803 -0.328 -0.873 1.00 . A A . 8 GLU HB2 1 1 4 958 1 1 8 GLU HB3 H -6.928 -0.418 -2.220 1.00 . A A . 8 GLU HB3 1 1 4 959 1 1 8 GLU HG2 H -5.974 -2.608 -2.824 1.00 . A A . 8 GLU HG2 1 1 4 960 1 1 8 GLU HG3 H -4.936 -2.515 -1.402 1.00 . A A . 8 GLU HG3 1 1 4 961 1 1 8 GLU N N -3.573 -0.130 -2.193 1.00 . A A . 8 GLU N 1 1 4 962 1 1 8 GLU O O -5.324 1.838 -4.197 1.00 . A A . 8 GLU O 1 1 4 963 1 1 8 GLU OE1 O -7.238 -4.037 -1.067 1.00 . A A . 8 GLU OE1 1 1 4 964 1 1 9 TYR C C -4.922 4.398 -1.471 1.00 . A A . 9 TYR C 1 1 4 965 1 1 9 TYR CA C -5.985 3.505 -2.087 1.00 . A A . 9 TYR CA 1 1 4 966 1 1 9 TYR CB C -7.329 3.758 -1.394 1.00 . A A . 9 TYR CB 1 1 4 967 1 1 9 TYR CD1 C -8.602 1.585 -1.648 1.00 . A A . 9 TYR CD1 1 1 4 968 1 1 9 TYR CD2 C -9.454 3.525 -2.739 1.00 . A A . 9 TYR CD2 1 1 4 969 1 1 9 TYR CE1 C -9.657 0.841 -2.138 1.00 . A A . 9 TYR CE1 1 1 4 970 1 1 9 TYR CE2 C -10.514 2.787 -3.233 1.00 . A A . 9 TYR CE2 1 1 4 971 1 1 9 TYR CG C -8.480 2.939 -1.941 1.00 . A A . 9 TYR CG 1 1 4 972 1 1 9 TYR CZ C -10.609 1.445 -2.931 1.00 . A A . 9 TYR CZ 1 1 4 973 1 1 9 TYR H H -5.547 1.688 -1.095 1.00 . A A . 9 TYR H 1 1 4 974 1 1 9 TYR HA H -6.077 3.746 -3.135 1.00 . A A . 9 TYR HA 1 1 4 975 1 1 9 TYR HB2 H -7.229 3.531 -0.346 1.00 . A A . 9 TYR HB2 1 1 4 976 1 1 9 TYR HB3 H -7.585 4.803 -1.504 1.00 . A A . 9 TYR HB3 1 1 4 977 1 1 9 TYR HD1 H -7.856 1.114 -1.026 1.00 . A A . 9 TYR HD1 1 1 4 978 1 1 9 TYR HD2 H -9.375 4.577 -2.977 1.00 . A A . 9 TYR HD2 1 1 4 979 1 1 9 TYR HE1 H -9.732 -0.210 -1.902 1.00 . A A . 9 TYR HE1 1 1 4 980 1 1 9 TYR HE2 H -11.260 3.261 -3.853 1.00 . A A . 9 TYR HE2 1 1 4 981 1 1 9 TYR HH H -11.607 0.667 -4.377 1.00 . A A . 9 TYR HH 1 1 4 982 1 1 9 TYR N N -5.592 2.107 -1.982 1.00 . A A . 9 TYR N 1 1 4 983 1 1 9 TYR O O -4.352 4.073 -0.423 1.00 . A A . 9 TYR O 1 1 4 984 1 1 9 TYR OH O -11.661 0.706 -3.419 1.00 . A A . 9 TYR OH 1 1 4 985 1 1 10 PHE C C -4.350 7.745 -1.174 1.00 . A A . 10 PHE C 1 1 4 986 1 1 10 PHE CA C -3.671 6.469 -1.643 1.00 . A A . 10 PHE CA 1 1 4 987 1 1 10 PHE CB C -2.658 6.831 -2.735 1.00 . A A . 10 PHE CB 1 1 4 988 1 1 10 PHE CD1 C -2.687 4.786 -4.212 1.00 . A A . 10 PHE CD1 1 1 4 989 1 1 10 PHE CD2 C -0.619 5.454 -3.233 1.00 . A A . 10 PHE CD2 1 1 4 990 1 1 10 PHE CE1 C -2.055 3.727 -4.834 1.00 . A A . 10 PHE CE1 1 1 4 991 1 1 10 PHE CE2 C 0.020 4.400 -3.855 1.00 . A A . 10 PHE CE2 1 1 4 992 1 1 10 PHE CG C -1.979 5.661 -3.401 1.00 . A A . 10 PHE CG 1 1 4 993 1 1 10 PHE CZ C -0.700 3.535 -4.656 1.00 . A A . 10 PHE CZ 1 1 4 994 1 1 10 PHE H H -5.156 5.718 -2.941 1.00 . A A . 10 PHE H 1 1 4 995 1 1 10 PHE HA H -3.152 6.020 -0.811 1.00 . A A . 10 PHE HA 1 1 4 996 1 1 10 PHE HB2 H -3.162 7.396 -3.498 1.00 . A A . 10 PHE HB2 1 1 4 997 1 1 10 PHE HB3 H -1.888 7.450 -2.297 1.00 . A A . 10 PHE HB3 1 1 4 998 1 1 10 PHE HD1 H -3.747 4.937 -4.352 1.00 . A A . 10 PHE HD1 1 1 4 999 1 1 10 PHE HD2 H -0.054 6.127 -2.603 1.00 . A A . 10 PHE HD2 1 1 4 1000 1 1 10 PHE HE1 H -2.619 3.053 -5.460 1.00 . A A . 10 PHE HE1 1 1 4 1001 1 1 10 PHE HE2 H 1.080 4.251 -3.715 1.00 . A A . 10 PHE HE2 1 1 4 1002 1 1 10 PHE HZ H -0.203 2.709 -5.143 1.00 . A A . 10 PHE HZ 1 1 4 1003 1 1 10 PHE N N -4.663 5.519 -2.121 1.00 . A A . 10 PHE N 1 1 4 1004 1 1 10 PHE O O -5.326 8.199 -1.770 1.00 . A A . 10 PHE O 1 1 4 1005 1 1 11 VAL C C -3.697 10.735 -0.344 1.00 . A A . 11 VAL C 1 1 4 1006 1 1 11 VAL CA C -4.319 9.571 0.419 1.00 . A A . 11 VAL CA 1 1 4 1007 1 1 11 VAL CB C -4.003 9.703 1.928 1.00 . A A . 11 VAL CB 1 1 4 1008 1 1 11 VAL CG1 C -4.616 10.967 2.516 1.00 . A A . 11 VAL CG1 1 1 4 1009 1 1 11 VAL CG2 C -4.494 8.481 2.683 1.00 . A A . 11 VAL CG2 1 1 4 1010 1 1 11 VAL H H -3.011 7.919 0.282 1.00 . A A . 11 VAL H 1 1 4 1011 1 1 11 VAL HA H -5.391 9.586 0.282 1.00 . A A . 11 VAL HA 1 1 4 1012 1 1 11 VAL HB H -2.931 9.763 2.046 1.00 . A A . 11 VAL HB 1 1 4 1013 1 1 11 VAL HG11 H -4.537 11.772 1.801 1.00 . A A . 11 VAL HG11 1 1 4 1014 1 1 11 VAL HG12 H -4.087 11.237 3.420 1.00 . A A . 11 VAL HG12 1 1 4 1015 1 1 11 VAL HG13 H -5.656 10.789 2.747 1.00 . A A . 11 VAL HG13 1 1 4 1016 1 1 11 VAL HG21 H -3.853 8.300 3.533 1.00 . A A . 11 VAL HG21 1 1 4 1017 1 1 11 VAL HG22 H -4.474 7.621 2.028 1.00 . A A . 11 VAL HG22 1 1 4 1018 1 1 11 VAL HG23 H -5.505 8.649 3.024 1.00 . A A . 11 VAL HG23 1 1 4 1019 1 1 11 VAL N N -3.807 8.327 -0.127 1.00 . A A . 11 VAL N 1 1 4 1020 1 1 11 VAL O O -2.584 10.614 -0.855 1.00 . A A . 11 VAL O 1 1 4 1021 1 1 12 GLY C C -2.563 13.484 -0.680 1.00 . A A . 12 GLY C 1 1 4 1022 1 1 12 GLY CA C -3.936 13.021 -1.139 1.00 . A A . 12 GLY CA 1 1 4 1023 1 1 12 GLY H H -5.305 11.873 -0.007 1.00 . A A . 12 GLY H 1 1 4 1024 1 1 12 GLY HA2 H -3.882 12.788 -2.187 1.00 . A A . 12 GLY HA2 1 1 4 1025 1 1 12 GLY HA3 H -4.639 13.830 -1.000 1.00 . A A . 12 GLY HA3 1 1 4 1026 1 1 12 GLY N N -4.422 11.850 -0.427 1.00 . A A . 12 GLY N 1 1 4 1027 1 1 12 GLY O O -1.837 14.125 -1.431 1.00 . A A . 12 GLY O 1 1 4 1028 1 1 13 ILE C C 0.188 12.554 0.671 1.00 . A A . 13 ILE C 1 1 4 1029 1 1 13 ILE CA C -0.913 13.530 1.114 1.00 . A A . 13 ILE CA 1 1 4 1030 1 1 13 ILE CB C -0.967 13.596 2.660 1.00 . A A . 13 ILE CB 1 1 4 1031 1 1 13 ILE CD1 C -2.495 14.170 4.623 1.00 . A A . 13 ILE CD1 1 1 4 1032 1 1 13 ILE CG1 C -2.310 14.177 3.121 1.00 . A A . 13 ILE CG1 1 1 4 1033 1 1 13 ILE CG2 C 0.179 14.445 3.200 1.00 . A A . 13 ILE CG2 1 1 4 1034 1 1 13 ILE H H -2.830 12.632 1.098 1.00 . A A . 13 ILE H 1 1 4 1035 1 1 13 ILE HA H -0.670 14.513 0.740 1.00 . A A . 13 ILE HA 1 1 4 1036 1 1 13 ILE HB H -0.861 12.595 3.048 1.00 . A A . 13 ILE HB 1 1 4 1037 1 1 13 ILE HD11 H -2.131 15.101 5.035 1.00 . A A . 13 ILE HD11 1 1 4 1038 1 1 13 ILE HD12 H -1.942 13.347 5.051 1.00 . A A . 13 ILE HD12 1 1 4 1039 1 1 13 ILE HD13 H -3.544 14.060 4.856 1.00 . A A . 13 ILE HD13 1 1 4 1040 1 1 13 ILE HG12 H -2.386 15.199 2.783 1.00 . A A . 13 ILE HG12 1 1 4 1041 1 1 13 ILE HG13 H -3.112 13.599 2.684 1.00 . A A . 13 ILE HG13 1 1 4 1042 1 1 13 ILE HG21 H 0.600 15.034 2.400 1.00 . A A . 13 ILE HG21 1 1 4 1043 1 1 13 ILE HG22 H 0.941 13.800 3.611 1.00 . A A . 13 ILE HG22 1 1 4 1044 1 1 13 ILE HG23 H -0.191 15.101 3.974 1.00 . A A . 13 ILE HG23 1 1 4 1045 1 1 13 ILE N N -2.208 13.151 0.554 1.00 . A A . 13 ILE N 1 1 4 1046 1 1 13 ILE O O 1.149 12.304 1.399 1.00 . A A . 13 ILE O 1 1 4 1047 1 1 14 GLY C C 1.355 9.927 -0.212 1.00 . A A . 14 GLY C 1 1 4 1048 1 1 14 GLY CA C 1.011 11.104 -1.110 1.00 . A A . 14 GLY CA 1 1 4 1049 1 1 14 GLY H H -0.743 12.290 -1.068 1.00 . A A . 14 GLY H 1 1 4 1050 1 1 14 GLY HA2 H 0.617 10.721 -2.038 1.00 . A A . 14 GLY HA2 1 1 4 1051 1 1 14 GLY HA3 H 1.918 11.651 -1.325 1.00 . A A . 14 GLY HA3 1 1 4 1052 1 1 14 GLY N N 0.038 12.027 -0.540 1.00 . A A . 14 GLY N 1 1 4 1053 1 1 14 GLY O O 2.529 9.612 -0.025 1.00 . A A . 14 GLY O 1 1 4 1054 1 1 15 THR C C -0.561 7.126 1.164 1.00 . A A . 15 THR C 1 1 4 1055 1 1 15 THR CA C 0.593 8.131 1.217 1.00 . A A . 15 THR CA 1 1 4 1056 1 1 15 THR CB C 0.842 8.591 2.675 1.00 . A A . 15 THR CB 1 1 4 1057 1 1 15 THR CG2 C -0.328 9.407 3.213 1.00 . A A . 15 THR CG2 1 1 4 1058 1 1 15 THR H H -0.573 9.553 0.165 1.00 . A A . 15 THR H 1 1 4 1059 1 1 15 THR HA H 1.490 7.640 0.865 1.00 . A A . 15 THR HA 1 1 4 1060 1 1 15 THR HB H 1.724 9.216 2.687 1.00 . A A . 15 THR HB 1 1 4 1061 1 1 15 THR HG1 H 1.897 7.583 4.000 1.00 . A A . 15 THR HG1 1 1 4 1062 1 1 15 THR HG21 H -0.194 10.445 2.951 1.00 . A A . 15 THR HG21 1 1 4 1063 1 1 15 THR HG22 H -0.372 9.309 4.288 1.00 . A A . 15 THR HG22 1 1 4 1064 1 1 15 THR HG23 H -1.249 9.042 2.783 1.00 . A A . 15 THR HG23 1 1 4 1065 1 1 15 THR N N 0.347 9.270 0.344 1.00 . A A . 15 THR N 1 1 4 1066 1 1 15 THR O O -1.727 7.495 1.293 1.00 . A A . 15 THR O 1 1 4 1067 1 1 15 THR OG1 O 1.072 7.462 3.525 1.00 . A A . 15 THR OG1 1 1 4 1068 1 1 16 PRO C C -1.629 4.230 2.251 1.00 . A A . 16 PRO C 1 1 4 1069 1 1 16 PRO CA C -1.257 4.784 0.875 1.00 . A A . 16 PRO CA 1 1 4 1070 1 1 16 PRO CB C -0.561 3.718 0.035 1.00 . A A . 16 PRO CB 1 1 4 1071 1 1 16 PRO CD C 1.111 5.310 0.762 1.00 . A A . 16 PRO CD 1 1 4 1072 1 1 16 PRO CG C 0.896 3.877 0.333 1.00 . A A . 16 PRO CG 1 1 4 1073 1 1 16 PRO HA H -2.149 5.121 0.369 1.00 . A A . 16 PRO HA 1 1 4 1074 1 1 16 PRO HB2 H -0.920 2.741 0.322 1.00 . A A . 16 PRO HB2 1 1 4 1075 1 1 16 PRO HB3 H -0.767 3.890 -1.011 1.00 . A A . 16 PRO HB3 1 1 4 1076 1 1 16 PRO HD2 H 1.667 5.346 1.687 1.00 . A A . 16 PRO HD2 1 1 4 1077 1 1 16 PRO HD3 H 1.632 5.858 -0.009 1.00 . A A . 16 PRO HD3 1 1 4 1078 1 1 16 PRO HG2 H 1.178 3.205 1.130 1.00 . A A . 16 PRO HG2 1 1 4 1079 1 1 16 PRO HG3 H 1.474 3.663 -0.554 1.00 . A A . 16 PRO HG3 1 1 4 1080 1 1 16 PRO N N -0.252 5.838 0.951 1.00 . A A . 16 PRO N 1 1 4 1081 1 1 16 PRO O O -0.759 3.896 3.052 1.00 . A A . 16 PRO O 1 1 4 1082 1 1 17 ILE C C -4.149 2.296 3.610 1.00 . A A . 17 ILE C 1 1 4 1083 1 1 17 ILE CA C -3.393 3.603 3.798 1.00 . A A . 17 ILE CA 1 1 4 1084 1 1 17 ILE CB C -4.294 4.612 4.543 1.00 . A A . 17 ILE CB 1 1 4 1085 1 1 17 ILE CD1 C -6.493 5.898 4.368 1.00 . A A . 17 ILE CD1 1 1 4 1086 1 1 17 ILE CG1 C -5.459 5.055 3.650 1.00 . A A . 17 ILE CG1 1 1 4 1087 1 1 17 ILE CG2 C -3.477 5.811 5.003 1.00 . A A . 17 ILE CG2 1 1 4 1088 1 1 17 ILE H H -3.578 4.397 1.842 1.00 . A A . 17 ILE H 1 1 4 1089 1 1 17 ILE HA H -2.523 3.408 4.408 1.00 . A A . 17 ILE HA 1 1 4 1090 1 1 17 ILE HB H -4.690 4.124 5.421 1.00 . A A . 17 ILE HB 1 1 4 1091 1 1 17 ILE HD11 H -7.023 6.507 3.650 1.00 . A A . 17 ILE HD11 1 1 4 1092 1 1 17 ILE HD12 H -6.001 6.534 5.087 1.00 . A A . 17 ILE HD12 1 1 4 1093 1 1 17 ILE HD13 H -7.193 5.252 4.877 1.00 . A A . 17 ILE HD13 1 1 4 1094 1 1 17 ILE HG12 H -5.072 5.638 2.828 1.00 . A A . 17 ILE HG12 1 1 4 1095 1 1 17 ILE HG13 H -5.957 4.178 3.260 1.00 . A A . 17 ILE HG13 1 1 4 1096 1 1 17 ILE HG21 H -3.755 6.071 6.014 1.00 . A A . 17 ILE HG21 1 1 4 1097 1 1 17 ILE HG22 H -3.670 6.650 4.351 1.00 . A A . 17 ILE HG22 1 1 4 1098 1 1 17 ILE HG23 H -2.426 5.566 4.971 1.00 . A A . 17 ILE HG23 1 1 4 1099 1 1 17 ILE N N -2.925 4.124 2.518 1.00 . A A . 17 ILE N 1 1 4 1100 1 1 17 ILE O O -5.119 2.011 4.311 1.00 . A A . 17 ILE O 1 1 4 1101 1 1 18 SER C C -3.487 -0.503 1.286 1.00 . A A . 18 SER C 1 1 4 1102 1 1 18 SER CA C -4.291 0.217 2.355 1.00 . A A . 18 SER CA 1 1 4 1103 1 1 18 SER CB C -5.737 0.398 1.883 1.00 . A A . 18 SER CB 1 1 4 1104 1 1 18 SER H H -2.901 1.796 2.148 1.00 . A A . 18 SER H 1 1 4 1105 1 1 18 SER HA H -4.284 -0.376 3.258 1.00 . A A . 18 SER HA 1 1 4 1106 1 1 18 SER HB2 H -6.113 -0.544 1.515 1.00 . A A . 18 SER HB2 1 1 4 1107 1 1 18 SER HB3 H -6.344 0.726 2.712 1.00 . A A . 18 SER HB3 1 1 4 1108 1 1 18 SER HG H -5.489 2.205 1.167 1.00 . A A . 18 SER HG 1 1 4 1109 1 1 18 SER N N -3.683 1.505 2.659 1.00 . A A . 18 SER N 1 1 4 1110 1 1 18 SER O O -2.886 0.136 0.424 1.00 . A A . 18 SER O 1 1 4 1111 1 1 18 SER OG O -5.821 1.359 0.843 1.00 . A A . 18 SER OG 1 1 4 1112 1 1 19 PHE C C -3.572 -3.882 0.044 1.00 . A A . 19 PHE C 1 1 4 1113 1 1 19 PHE CA C -2.752 -2.641 0.376 1.00 . A A . 19 PHE CA 1 1 4 1114 1 1 19 PHE CB C -1.377 -3.067 0.901 1.00 . A A . 19 PHE CB 1 1 4 1115 1 1 19 PHE CD1 C -0.800 -1.581 2.852 1.00 . A A . 19 PHE CD1 1 1 4 1116 1 1 19 PHE CD2 C 0.435 -1.329 0.827 1.00 . A A . 19 PHE CD2 1 1 4 1117 1 1 19 PHE CE1 C -0.054 -0.574 3.435 1.00 . A A . 19 PHE CE1 1 1 4 1118 1 1 19 PHE CE2 C 1.183 -0.322 1.406 1.00 . A A . 19 PHE CE2 1 1 4 1119 1 1 19 PHE CG C -0.564 -1.970 1.541 1.00 . A A . 19 PHE CG 1 1 4 1120 1 1 19 PHE CZ C 0.937 0.056 2.711 1.00 . A A . 19 PHE CZ 1 1 4 1121 1 1 19 PHE H H -3.983 -2.275 2.063 1.00 . A A . 19 PHE H 1 1 4 1122 1 1 19 PHE HA H -2.625 -2.054 -0.523 1.00 . A A . 19 PHE HA 1 1 4 1123 1 1 19 PHE HB2 H -1.513 -3.846 1.634 1.00 . A A . 19 PHE HB2 1 1 4 1124 1 1 19 PHE HB3 H -0.801 -3.465 0.078 1.00 . A A . 19 PHE HB3 1 1 4 1125 1 1 19 PHE HD1 H -1.576 -2.073 3.419 1.00 . A A . 19 PHE HD1 1 1 4 1126 1 1 19 PHE HD2 H 0.628 -1.623 -0.194 1.00 . A A . 19 PHE HD2 1 1 4 1127 1 1 19 PHE HE1 H -0.249 -0.280 4.456 1.00 . A A . 19 PHE HE1 1 1 4 1128 1 1 19 PHE HE2 H 1.959 0.170 0.837 1.00 . A A . 19 PHE HE2 1 1 4 1129 1 1 19 PHE HZ H 1.521 0.843 3.164 1.00 . A A . 19 PHE HZ 1 1 4 1130 1 1 19 PHE N N -3.479 -1.826 1.346 1.00 . A A . 19 PHE N 1 1 4 1131 1 1 19 PHE O O -4.590 -4.132 0.681 1.00 . A A . 19 PHE O 1 1 4 1132 1 1 20 TYR C C -3.247 -7.072 -0.628 1.00 . A A . 20 TYR C 1 1 4 1133 1 1 20 TYR CA C -3.848 -5.868 -1.331 1.00 . A A . 20 TYR CA 1 1 4 1134 1 1 20 TYR CB C -3.788 -6.101 -2.848 1.00 . A A . 20 TYR CB 1 1 4 1135 1 1 20 TYR CD1 C -3.783 -3.888 -4.070 1.00 . A A . 20 TYR CD1 1 1 4 1136 1 1 20 TYR CD2 C -5.776 -5.194 -4.114 1.00 . A A . 20 TYR CD2 1 1 4 1137 1 1 20 TYR CE1 C -4.392 -2.924 -4.849 1.00 . A A . 20 TYR CE1 1 1 4 1138 1 1 20 TYR CE2 C -6.394 -4.233 -4.891 1.00 . A A . 20 TYR CE2 1 1 4 1139 1 1 20 TYR CG C -4.462 -5.038 -3.690 1.00 . A A . 20 TYR CG 1 1 4 1140 1 1 20 TYR CZ C -5.698 -3.100 -5.256 1.00 . A A . 20 TYR CZ 1 1 4 1141 1 1 20 TYR H H -2.302 -4.404 -1.414 1.00 . A A . 20 TYR H 1 1 4 1142 1 1 20 TYR HA H -4.876 -5.763 -1.029 1.00 . A A . 20 TYR HA 1 1 4 1143 1 1 20 TYR HB2 H -2.754 -6.147 -3.151 1.00 . A A . 20 TYR HB2 1 1 4 1144 1 1 20 TYR HB3 H -4.258 -7.047 -3.071 1.00 . A A . 20 TYR HB3 1 1 4 1145 1 1 20 TYR HD1 H -2.761 -3.752 -3.749 1.00 . A A . 20 TYR HD1 1 1 4 1146 1 1 20 TYR HD2 H -6.317 -6.083 -3.827 1.00 . A A . 20 TYR HD2 1 1 4 1147 1 1 20 TYR HE1 H -3.848 -2.035 -5.133 1.00 . A A . 20 TYR HE1 1 1 4 1148 1 1 20 TYR HE2 H -7.416 -4.371 -5.210 1.00 . A A . 20 TYR HE2 1 1 4 1149 1 1 20 TYR HH H -5.707 -1.398 -6.152 1.00 . A A . 20 TYR HH 1 1 4 1150 1 1 20 TYR N N -3.133 -4.653 -0.942 1.00 . A A . 20 TYR N 1 1 4 1151 1 1 20 TYR O O -3.929 -7.811 0.078 1.00 . A A . 20 TYR O 1 1 4 1152 1 1 20 TYR OH O -6.309 -2.139 -6.028 1.00 . A A . 20 TYR OH 1 1 4 1153 1 1 21 GLY C C 0.246 -8.172 -0.509 1.00 . A A . 21 GLY C 1 1 4 1154 1 1 21 GLY CA C -1.229 -8.342 -0.253 1.00 . A A . 21 GLY CA 1 1 4 1155 1 1 21 GLY H H -1.483 -6.618 -1.418 1.00 . A A . 21 GLY H 1 1 4 1156 1 1 21 GLY HA2 H -1.410 -8.362 0.812 1.00 . A A . 21 GLY HA2 1 1 4 1157 1 1 21 GLY HA3 H -1.560 -9.271 -0.692 1.00 . A A . 21 GLY HA3 1 1 4 1158 1 1 21 GLY N N -1.958 -7.247 -0.841 1.00 . A A . 21 GLY N 1 1 4 1159 1 1 21 GLY O O 1.060 -8.898 0.089 1.00 . A A . 21 GLY O 1 1 4 1160 1 1 21 GLY OXT O 0.597 -7.258 -1.290 1.00 . A A . 21 GLY OXT 1 1 5 1161 1 1 1 GLY C C -8.088 -2.422 2.163 1.00 . A A . 1 GLY C 1 1 5 1162 1 1 1 GLY CA C -8.434 -2.137 0.713 1.00 . A A . 1 GLY CA 1 1 5 1163 1 1 1 GLY H2 H -7.123 -0.741 -0.192 1.00 . A A . 1 GLY H2 1 1 5 1164 1 1 1 GLY HA2 H -9.190 -1.368 0.683 1.00 . A A . 1 GLY HA2 1 1 5 1165 1 1 1 GLY HA3 H -8.834 -3.036 0.268 1.00 . A A . 1 GLY HA3 1 1 5 1166 1 1 1 GLY N N -7.295 -1.699 -0.074 1.00 . A A . 1 GLY N 1 1 5 1167 1 1 1 GLY O O -8.824 -2.029 3.065 1.00 . A A . 1 GLY O 1 1 5 1168 1 1 2 GLY C C -5.082 -3.482 3.913 1.00 . A A . 2 GLY C 1 1 5 1169 1 1 2 GLY CA C -6.583 -3.443 3.746 1.00 . A A . 2 GLY CA 1 1 5 1170 1 1 2 GLY H H -6.432 -3.412 1.632 1.00 . A A . 2 GLY H 1 1 5 1171 1 1 2 GLY HA2 H -6.990 -2.706 4.419 1.00 . A A . 2 GLY HA2 1 1 5 1172 1 1 2 GLY HA3 H -6.987 -4.412 4.000 1.00 . A A . 2 GLY HA3 1 1 5 1173 1 1 2 GLY N N -6.981 -3.113 2.391 1.00 . A A . 2 GLY N 1 1 5 1174 1 1 2 GLY O O -4.405 -2.473 3.722 1.00 . A A . 2 GLY O 1 1 5 1175 1 1 3 ALA C C -2.581 -5.844 3.478 1.00 . A A . 3 ALA C 1 1 5 1176 1 1 3 ALA CA C -3.128 -4.815 4.455 1.00 . A A . 3 ALA CA 1 1 5 1177 1 1 3 ALA CB C -2.826 -5.227 5.889 1.00 . A A . 3 ALA CB 1 1 5 1178 1 1 3 ALA H H -5.152 -5.412 4.396 1.00 . A A . 3 ALA H 1 1 5 1179 1 1 3 ALA HA H -2.649 -3.864 4.266 1.00 . A A . 3 ALA HA 1 1 5 1180 1 1 3 ALA HB1 H -3.691 -5.039 6.507 1.00 . A A . 3 ALA HB1 1 1 5 1181 1 1 3 ALA HB2 H -1.988 -4.653 6.258 1.00 . A A . 3 ALA HB2 1 1 5 1182 1 1 3 ALA HB3 H -2.585 -6.278 5.918 1.00 . A A . 3 ALA HB3 1 1 5 1183 1 1 3 ALA N N -4.559 -4.644 4.267 1.00 . A A . 3 ALA N 1 1 5 1184 1 1 3 ALA O O -3.259 -6.814 3.145 1.00 . A A . 3 ALA O 1 1 5 1185 1 1 4 GLY C C 0.660 -6.081 1.711 1.00 . A A . 4 GLY C 1 1 5 1186 1 1 4 GLY CA C -0.738 -6.529 2.079 1.00 . A A . 4 GLY CA 1 1 5 1187 1 1 4 GLY H H -0.871 -4.827 3.318 1.00 . A A . 4 GLY H 1 1 5 1188 1 1 4 GLY HA2 H -0.687 -7.513 2.523 1.00 . A A . 4 GLY HA2 1 1 5 1189 1 1 4 GLY HA3 H -1.339 -6.575 1.184 1.00 . A A . 4 GLY HA3 1 1 5 1190 1 1 4 GLY N N -1.359 -5.621 3.019 1.00 . A A . 4 GLY N 1 1 5 1191 1 1 4 GLY O O 1.461 -5.755 2.589 1.00 . A A . 4 GLY O 1 1 5 1192 1 1 5 HIS C C 2.167 -4.469 -1.009 1.00 . A A . 5 HIS C 1 1 5 1193 1 1 5 HIS CA C 2.288 -5.631 -0.032 1.00 . A A . 5 HIS CA 1 1 5 1194 1 1 5 HIS CB C 3.062 -6.778 -0.703 1.00 . A A . 5 HIS CB 1 1 5 1195 1 1 5 HIS CD2 C 2.588 -9.318 -0.627 1.00 . A A . 5 HIS CD2 1 1 5 1196 1 1 5 HIS CE1 C 2.698 -9.619 1.533 1.00 . A A . 5 HIS CE1 1 1 5 1197 1 1 5 HIS CG C 2.868 -8.122 -0.069 1.00 . A A . 5 HIS CG 1 1 5 1198 1 1 5 HIS H H 0.287 -6.328 -0.241 1.00 . A A . 5 HIS H 1 1 5 1199 1 1 5 HIS HA H 2.840 -5.297 0.835 1.00 . A A . 5 HIS HA 1 1 5 1200 1 1 5 HIS HB2 H 2.747 -6.855 -1.732 1.00 . A A . 5 HIS HB2 1 1 5 1201 1 1 5 HIS HB3 H 4.118 -6.548 -0.675 1.00 . A A . 5 HIS HB3 1 1 5 1202 1 1 5 HIS HD1 H 3.103 -7.660 1.972 1.00 . A A . 5 HIS HD1 1 1 5 1203 1 1 5 HIS HD2 H 2.471 -9.516 -1.683 1.00 . A A . 5 HIS HD2 1 1 5 1204 1 1 5 HIS HE1 H 2.682 -10.079 2.510 1.00 . A A . 5 HIS HE1 1 1 5 1205 1 1 5 HIS HE2 H 1.933 -11.057 0.311 1.00 . A A . 5 HIS HE2 1 1 5 1206 1 1 5 HIS N N 0.966 -6.057 0.421 1.00 . A A . 5 HIS N 1 1 5 1207 1 1 5 HIS ND1 N 2.933 -8.343 1.288 1.00 . A A . 5 HIS ND1 1 1 5 1208 1 1 5 HIS NE2 N 2.479 -10.239 0.386 1.00 . A A . 5 HIS NE2 1 1 5 1209 1 1 5 HIS O O 2.855 -3.461 -0.876 1.00 . A A . 5 HIS O 1 1 5 1210 1 1 6 VAL C C -0.017 -2.615 -2.532 1.00 . A A . 6 VAL C 1 1 5 1211 1 1 6 VAL CA C 1.078 -3.578 -2.992 1.00 . A A . 6 VAL CA 1 1 5 1212 1 1 6 VAL CB C 0.704 -4.186 -4.363 1.00 . A A . 6 VAL CB 1 1 5 1213 1 1 6 VAL CG1 C 0.591 -3.107 -5.431 1.00 . A A . 6 VAL CG1 1 1 5 1214 1 1 6 VAL CG2 C 1.724 -5.239 -4.771 1.00 . A A . 6 VAL CG2 1 1 5 1215 1 1 6 VAL H H 0.761 -5.444 -2.046 1.00 . A A . 6 VAL H 1 1 5 1216 1 1 6 VAL HA H 2.003 -3.030 -3.102 1.00 . A A . 6 VAL HA 1 1 5 1217 1 1 6 VAL HB H -0.257 -4.669 -4.268 1.00 . A A . 6 VAL HB 1 1 5 1218 1 1 6 VAL HG11 H 0.657 -2.134 -4.968 1.00 . A A . 6 VAL HG11 1 1 5 1219 1 1 6 VAL HG12 H -0.359 -3.201 -5.939 1.00 . A A . 6 VAL HG12 1 1 5 1220 1 1 6 VAL HG13 H 1.394 -3.222 -6.145 1.00 . A A . 6 VAL HG13 1 1 5 1221 1 1 6 VAL HG21 H 1.629 -5.443 -5.827 1.00 . A A . 6 VAL HG21 1 1 5 1222 1 1 6 VAL HG22 H 1.550 -6.146 -4.212 1.00 . A A . 6 VAL HG22 1 1 5 1223 1 1 6 VAL HG23 H 2.720 -4.875 -4.564 1.00 . A A . 6 VAL HG23 1 1 5 1224 1 1 6 VAL N N 1.288 -4.617 -1.993 1.00 . A A . 6 VAL N 1 1 5 1225 1 1 6 VAL O O -1.087 -3.049 -2.113 1.00 . A A . 6 VAL O 1 1 5 1226 1 1 7 PRO C C -2.013 -0.270 -2.937 1.00 . A A . 7 PRO C 1 1 5 1227 1 1 7 PRO CA C -0.704 -0.267 -2.150 1.00 . A A . 7 PRO CA 1 1 5 1228 1 1 7 PRO CB C 0.051 1.048 -2.384 1.00 . A A . 7 PRO CB 1 1 5 1229 1 1 7 PRO CD C 1.518 -0.711 -3.043 1.00 . A A . 7 PRO CD 1 1 5 1230 1 1 7 PRO CG C 1.141 0.709 -3.340 1.00 . A A . 7 PRO CG 1 1 5 1231 1 1 7 PRO HA H -0.929 -0.364 -1.097 1.00 . A A . 7 PRO HA 1 1 5 1232 1 1 7 PRO HB2 H -0.623 1.783 -2.798 1.00 . A A . 7 PRO HB2 1 1 5 1233 1 1 7 PRO HB3 H 0.450 1.406 -1.445 1.00 . A A . 7 PRO HB3 1 1 5 1234 1 1 7 PRO HD2 H 1.871 -1.204 -3.936 1.00 . A A . 7 PRO HD2 1 1 5 1235 1 1 7 PRO HD3 H 2.267 -0.750 -2.266 1.00 . A A . 7 PRO HD3 1 1 5 1236 1 1 7 PRO HG2 H 0.780 0.797 -4.354 1.00 . A A . 7 PRO HG2 1 1 5 1237 1 1 7 PRO HG3 H 1.986 1.363 -3.183 1.00 . A A . 7 PRO HG3 1 1 5 1238 1 1 7 PRO N N 0.251 -1.300 -2.582 1.00 . A A . 7 PRO N 1 1 5 1239 1 1 7 PRO O O -2.022 -0.415 -4.160 1.00 . A A . 7 PRO O 1 1 5 1240 1 1 8 GLU C C -4.811 1.357 -3.227 1.00 . A A . 8 GLU C 1 1 5 1241 1 1 8 GLU CA C -4.442 -0.067 -2.821 1.00 . A A . 8 GLU CA 1 1 5 1242 1 1 8 GLU CB C -5.500 -0.592 -1.848 1.00 . A A . 8 GLU CB 1 1 5 1243 1 1 8 GLU CD C -6.480 -2.581 -0.635 1.00 . A A . 8 GLU CD 1 1 5 1244 1 1 8 GLU CG C -5.313 -2.041 -1.444 1.00 . A A . 8 GLU CG 1 1 5 1245 1 1 8 GLU H H -3.033 0.012 -1.244 1.00 . A A . 8 GLU H 1 1 5 1246 1 1 8 GLU HA H -4.426 -0.692 -3.701 1.00 . A A . 8 GLU HA 1 1 5 1247 1 1 8 GLU HB2 H -5.475 0.011 -0.953 1.00 . A A . 8 GLU HB2 1 1 5 1248 1 1 8 GLU HB3 H -6.472 -0.493 -2.308 1.00 . A A . 8 GLU HB3 1 1 5 1249 1 1 8 GLU HG2 H -5.207 -2.638 -2.337 1.00 . A A . 8 GLU HG2 1 1 5 1250 1 1 8 GLU HG3 H -4.414 -2.121 -0.851 1.00 . A A . 8 GLU HG3 1 1 5 1251 1 1 8 GLU N N -3.118 -0.101 -2.216 1.00 . A A . 8 GLU N 1 1 5 1252 1 1 8 GLU O O -4.818 1.697 -4.406 1.00 . A A . 8 GLU O 1 1 5 1253 1 1 8 GLU OE1 O -6.620 -3.814 -0.521 1.00 . A A . 8 GLU OE1 1 1 5 1254 1 1 9 TYR C C -4.629 4.527 -1.706 1.00 . A A . 9 TYR C 1 1 5 1255 1 1 9 TYR CA C -5.512 3.563 -2.488 1.00 . A A . 9 TYR CA 1 1 5 1256 1 1 9 TYR CB C -6.981 3.808 -2.119 1.00 . A A . 9 TYR CB 1 1 5 1257 1 1 9 TYR CD1 C -8.168 1.655 -2.734 1.00 . A A . 9 TYR CD1 1 1 5 1258 1 1 9 TYR CD2 C -8.739 3.640 -3.925 1.00 . A A . 9 TYR CD2 1 1 5 1259 1 1 9 TYR CE1 C -9.083 0.938 -3.481 1.00 . A A . 9 TYR CE1 1 1 5 1260 1 1 9 TYR CE2 C -9.659 2.928 -4.674 1.00 . A A . 9 TYR CE2 1 1 5 1261 1 1 9 TYR CG C -7.978 3.017 -2.945 1.00 . A A . 9 TYR CG 1 1 5 1262 1 1 9 TYR CZ C -9.825 1.579 -4.449 1.00 . A A . 9 TYR CZ 1 1 5 1263 1 1 9 TYR H H -5.113 1.850 -1.309 1.00 . A A . 9 TYR H 1 1 5 1264 1 1 9 TYR HA H -5.381 3.752 -3.543 1.00 . A A . 9 TYR HA 1 1 5 1265 1 1 9 TYR HB2 H -7.128 3.544 -1.085 1.00 . A A . 9 TYR HB2 1 1 5 1266 1 1 9 TYR HB3 H -7.203 4.857 -2.250 1.00 . A A . 9 TYR HB3 1 1 5 1267 1 1 9 TYR HD1 H -7.586 1.156 -1.975 1.00 . A A . 9 TYR HD1 1 1 5 1268 1 1 9 TYR HD2 H -8.606 4.696 -4.101 1.00 . A A . 9 TYR HD2 1 1 5 1269 1 1 9 TYR HE1 H -9.213 -0.120 -3.304 1.00 . A A . 9 TYR HE1 1 1 5 1270 1 1 9 TYR HE2 H -10.240 3.432 -5.432 1.00 . A A . 9 TYR HE2 1 1 5 1271 1 1 9 TYR HH H -10.853 1.289 -6.047 1.00 . A A . 9 TYR HH 1 1 5 1272 1 1 9 TYR N N -5.129 2.182 -2.235 1.00 . A A . 9 TYR N 1 1 5 1273 1 1 9 TYR O O -4.247 4.256 -0.563 1.00 . A A . 9 TYR O 1 1 5 1274 1 1 9 TYR OH O -10.739 0.869 -5.192 1.00 . A A . 9 TYR OH 1 1 5 1275 1 1 10 PHE C C -4.391 7.847 -1.286 1.00 . A A . 10 PHE C 1 1 5 1276 1 1 10 PHE CA C -3.508 6.687 -1.716 1.00 . A A . 10 PHE CA 1 1 5 1277 1 1 10 PHE CB C -2.439 7.217 -2.682 1.00 . A A . 10 PHE CB 1 1 5 1278 1 1 10 PHE CD1 C -1.937 5.079 -3.930 1.00 . A A . 10 PHE CD1 1 1 5 1279 1 1 10 PHE CD2 C -0.118 6.324 -3.020 1.00 . A A . 10 PHE CD2 1 1 5 1280 1 1 10 PHE CE1 C -1.051 4.144 -4.428 1.00 . A A . 10 PHE CE1 1 1 5 1281 1 1 10 PHE CE2 C 0.772 5.389 -3.515 1.00 . A A . 10 PHE CE2 1 1 5 1282 1 1 10 PHE CG C -1.482 6.181 -3.220 1.00 . A A . 10 PHE CG 1 1 5 1283 1 1 10 PHE CZ C 0.305 4.298 -4.219 1.00 . A A . 10 PHE CZ 1 1 5 1284 1 1 10 PHE H H -4.680 5.804 -3.231 1.00 . A A . 10 PHE H 1 1 5 1285 1 1 10 PHE HA H -3.028 6.266 -0.847 1.00 . A A . 10 PHE HA 1 1 5 1286 1 1 10 PHE HB2 H -2.930 7.676 -3.520 1.00 . A A . 10 PHE HB2 1 1 5 1287 1 1 10 PHE HB3 H -1.854 7.968 -2.169 1.00 . A A . 10 PHE HB3 1 1 5 1288 1 1 10 PHE HD1 H -2.997 4.957 -4.095 1.00 . A A . 10 PHE HD1 1 1 5 1289 1 1 10 PHE HD2 H 0.249 7.176 -2.469 1.00 . A A . 10 PHE HD2 1 1 5 1290 1 1 10 PHE HE1 H -1.420 3.291 -4.979 1.00 . A A . 10 PHE HE1 1 1 5 1291 1 1 10 PHE HE2 H 1.831 5.513 -3.349 1.00 . A A . 10 PHE HE2 1 1 5 1292 1 1 10 PHE HZ H 0.998 3.568 -4.608 1.00 . A A . 10 PHE HZ 1 1 5 1293 1 1 10 PHE N N -4.326 5.655 -2.331 1.00 . A A . 10 PHE N 1 1 5 1294 1 1 10 PHE O O -5.400 8.135 -1.930 1.00 . A A . 10 PHE O 1 1 5 1295 1 1 11 VAL C C -4.229 10.950 -0.327 1.00 . A A . 11 VAL C 1 1 5 1296 1 1 11 VAL CA C -4.766 9.655 0.270 1.00 . A A . 11 VAL CA 1 1 5 1297 1 1 11 VAL CB C -4.762 9.751 1.812 1.00 . A A . 11 VAL CB 1 1 5 1298 1 1 11 VAL CG1 C -5.428 8.528 2.420 1.00 . A A . 11 VAL CG1 1 1 5 1299 1 1 11 VAL CG2 C -3.347 9.918 2.349 1.00 . A A . 11 VAL CG2 1 1 5 1300 1 1 11 VAL H H -3.183 8.245 0.245 1.00 . A A . 11 VAL H 1 1 5 1301 1 1 11 VAL HA H -5.791 9.527 -0.054 1.00 . A A . 11 VAL HA 1 1 5 1302 1 1 11 VAL HB H -5.335 10.621 2.097 1.00 . A A . 11 VAL HB 1 1 5 1303 1 1 11 VAL HG11 H -6.019 8.028 1.666 1.00 . A A . 11 VAL HG11 1 1 5 1304 1 1 11 VAL HG12 H -6.069 8.835 3.234 1.00 . A A . 11 VAL HG12 1 1 5 1305 1 1 11 VAL HG13 H -4.672 7.853 2.792 1.00 . A A . 11 VAL HG13 1 1 5 1306 1 1 11 VAL HG21 H -2.656 9.381 1.717 1.00 . A A . 11 VAL HG21 1 1 5 1307 1 1 11 VAL HG22 H -3.294 9.527 3.354 1.00 . A A . 11 VAL HG22 1 1 5 1308 1 1 11 VAL HG23 H -3.086 10.966 2.357 1.00 . A A . 11 VAL HG23 1 1 5 1309 1 1 11 VAL N N -4.007 8.515 -0.218 1.00 . A A . 11 VAL N 1 1 5 1310 1 1 11 VAL O O -3.266 10.933 -1.095 1.00 . A A . 11 VAL O 1 1 5 1311 1 1 12 GLY C C -3.025 13.729 -0.123 1.00 . A A . 12 GLY C 1 1 5 1312 1 1 12 GLY CA C -4.451 13.361 -0.481 1.00 . A A . 12 GLY CA 1 1 5 1313 1 1 12 GLY H H -5.623 12.003 0.639 1.00 . A A . 12 GLY H 1 1 5 1314 1 1 12 GLY HA2 H -4.541 13.352 -1.553 1.00 . A A . 12 GLY HA2 1 1 5 1315 1 1 12 GLY HA3 H -5.114 14.116 -0.083 1.00 . A A . 12 GLY HA3 1 1 5 1316 1 1 12 GLY N N -4.861 12.064 0.029 1.00 . A A . 12 GLY N 1 1 5 1317 1 1 12 GLY O O -2.383 14.504 -0.828 1.00 . A A . 12 GLY O 1 1 5 1318 1 1 13 ILE C C -0.152 12.556 0.707 1.00 . A A . 13 ILE C 1 1 5 1319 1 1 13 ILE CA C -1.166 13.458 1.425 1.00 . A A . 13 ILE CA 1 1 5 1320 1 1 13 ILE CB C -1.038 13.282 2.962 1.00 . A A . 13 ILE CB 1 1 5 1321 1 1 13 ILE CD1 C -2.477 15.335 3.485 1.00 . A A . 13 ILE CD1 1 1 5 1322 1 1 13 ILE CG1 C -2.276 13.842 3.676 1.00 . A A . 13 ILE CG1 1 1 5 1323 1 1 13 ILE CG2 C 0.219 13.972 3.485 1.00 . A A . 13 ILE CG2 1 1 5 1324 1 1 13 ILE H H -3.089 12.568 1.490 1.00 . A A . 13 ILE H 1 1 5 1325 1 1 13 ILE HA H -0.947 14.484 1.179 1.00 . A A . 13 ILE HA 1 1 5 1326 1 1 13 ILE HB H -0.955 12.227 3.176 1.00 . A A . 13 ILE HB 1 1 5 1327 1 1 13 ILE HD11 H -3.520 15.577 3.617 1.00 . A A . 13 ILE HD11 1 1 5 1328 1 1 13 ILE HD12 H -2.165 15.614 2.488 1.00 . A A . 13 ILE HD12 1 1 5 1329 1 1 13 ILE HD13 H -1.886 15.872 4.211 1.00 . A A . 13 ILE HD13 1 1 5 1330 1 1 13 ILE HG12 H -3.156 13.343 3.299 1.00 . A A . 13 ILE HG12 1 1 5 1331 1 1 13 ILE HG13 H -2.187 13.653 4.735 1.00 . A A . 13 ILE HG13 1 1 5 1332 1 1 13 ILE HG21 H 1.041 13.780 2.812 1.00 . A A . 13 ILE HG21 1 1 5 1333 1 1 13 ILE HG22 H 0.459 13.587 4.465 1.00 . A A . 13 ILE HG22 1 1 5 1334 1 1 13 ILE HG23 H 0.046 15.036 3.549 1.00 . A A . 13 ILE HG23 1 1 5 1335 1 1 13 ILE N N -2.528 13.177 0.973 1.00 . A A . 13 ILE N 1 1 5 1336 1 1 13 ILE O O 0.890 12.205 1.261 1.00 . A A . 13 ILE O 1 1 5 1337 1 1 14 GLY C C 0.935 10.149 -0.633 1.00 . A A . 14 GLY C 1 1 5 1338 1 1 14 GLY CA C 0.394 11.368 -1.359 1.00 . A A . 14 GLY CA 1 1 5 1339 1 1 14 GLY H H -1.314 12.539 -0.912 1.00 . A A . 14 GLY H 1 1 5 1340 1 1 14 GLY HA2 H -0.166 11.034 -2.219 1.00 . A A . 14 GLY HA2 1 1 5 1341 1 1 14 GLY HA3 H 1.226 11.965 -1.700 1.00 . A A . 14 GLY HA3 1 1 5 1342 1 1 14 GLY N N -0.473 12.207 -0.536 1.00 . A A . 14 GLY N 1 1 5 1343 1 1 14 GLY O O 2.116 9.828 -0.748 1.00 . A A . 14 GLY O 1 1 5 1344 1 1 15 THR C C -0.598 7.243 0.895 1.00 . A A . 15 THR C 1 1 5 1345 1 1 15 THR CA C 0.497 8.302 0.872 1.00 . A A . 15 THR CA 1 1 5 1346 1 1 15 THR CB C 0.878 8.679 2.317 1.00 . A A . 15 THR CB 1 1 5 1347 1 1 15 THR CG2 C 2.381 8.887 2.452 1.00 . A A . 15 THR CG2 1 1 5 1348 1 1 15 THR H H -0.847 9.780 0.185 1.00 . A A . 15 THR H 1 1 5 1349 1 1 15 THR HA H 1.371 7.890 0.388 1.00 . A A . 15 THR HA 1 1 5 1350 1 1 15 THR HB H 0.586 7.871 2.972 1.00 . A A . 15 THR HB 1 1 5 1351 1 1 15 THR HG1 H 0.610 10.636 2.297 1.00 . A A . 15 THR HG1 1 1 5 1352 1 1 15 THR HG21 H 2.586 9.472 3.336 1.00 . A A . 15 THR HG21 1 1 5 1353 1 1 15 THR HG22 H 2.751 9.410 1.580 1.00 . A A . 15 THR HG22 1 1 5 1354 1 1 15 THR HG23 H 2.872 7.929 2.532 1.00 . A A . 15 THR HG23 1 1 5 1355 1 1 15 THR N N 0.081 9.475 0.121 1.00 . A A . 15 THR N 1 1 5 1356 1 1 15 THR O O -1.772 7.554 1.102 1.00 . A A . 15 THR O 1 1 5 1357 1 1 15 THR OG1 O 0.186 9.872 2.710 1.00 . A A . 15 THR OG1 1 1 5 1358 1 1 16 PRO C C -1.454 4.343 2.070 1.00 . A A . 16 PRO C 1 1 5 1359 1 1 16 PRO CA C -1.184 4.877 0.669 1.00 . A A . 16 PRO CA 1 1 5 1360 1 1 16 PRO CB C -0.483 3.824 -0.186 1.00 . A A . 16 PRO CB 1 1 5 1361 1 1 16 PRO CD C 1.141 5.518 0.402 1.00 . A A . 16 PRO CD 1 1 5 1362 1 1 16 PRO CG C 0.977 4.066 0.018 1.00 . A A . 16 PRO CG 1 1 5 1363 1 1 16 PRO HA H -2.116 5.159 0.204 1.00 . A A . 16 PRO HA 1 1 5 1364 1 1 16 PRO HB2 H -0.771 2.839 0.149 1.00 . A A . 16 PRO HB2 1 1 5 1365 1 1 16 PRO HB3 H -0.764 3.955 -1.219 1.00 . A A . 16 PRO HB3 1 1 5 1366 1 1 16 PRO HD2 H 1.754 5.606 1.288 1.00 . A A . 16 PRO HD2 1 1 5 1367 1 1 16 PRO HD3 H 1.579 6.074 -0.413 1.00 . A A . 16 PRO HD3 1 1 5 1368 1 1 16 PRO HG2 H 1.344 3.430 0.810 1.00 . A A . 16 PRO HG2 1 1 5 1369 1 1 16 PRO HG3 H 1.511 3.861 -0.899 1.00 . A A . 16 PRO HG3 1 1 5 1370 1 1 16 PRO N N -0.233 5.977 0.671 1.00 . A A . 16 PRO N 1 1 5 1371 1 1 16 PRO O O -0.529 3.994 2.803 1.00 . A A . 16 PRO O 1 1 5 1372 1 1 17 ILE C C -3.910 2.471 3.551 1.00 . A A . 17 ILE C 1 1 5 1373 1 1 17 ILE CA C -3.108 3.754 3.741 1.00 . A A . 17 ILE CA 1 1 5 1374 1 1 17 ILE CB C -3.914 4.794 4.562 1.00 . A A . 17 ILE CB 1 1 5 1375 1 1 17 ILE CD1 C -3.910 7.225 5.341 1.00 . A A . 17 ILE CD1 1 1 5 1376 1 1 17 ILE CG1 C -3.228 6.164 4.503 1.00 . A A . 17 ILE CG1 1 1 5 1377 1 1 17 ILE CG2 C -4.047 4.342 6.014 1.00 . A A . 17 ILE CG2 1 1 5 1378 1 1 17 ILE H H -3.418 4.544 1.803 1.00 . A A . 17 ILE H 1 1 5 1379 1 1 17 ILE HA H -2.200 3.519 4.282 1.00 . A A . 17 ILE HA 1 1 5 1380 1 1 17 ILE HB H -4.903 4.871 4.137 1.00 . A A . 17 ILE HB 1 1 5 1381 1 1 17 ILE HD11 H -4.272 8.014 4.699 1.00 . A A . 17 ILE HD11 1 1 5 1382 1 1 17 ILE HD12 H -3.204 7.633 6.049 1.00 . A A . 17 ILE HD12 1 1 5 1383 1 1 17 ILE HD13 H -4.739 6.785 5.875 1.00 . A A . 17 ILE HD13 1 1 5 1384 1 1 17 ILE HG12 H -2.213 6.065 4.857 1.00 . A A . 17 ILE HG12 1 1 5 1385 1 1 17 ILE HG13 H -3.215 6.508 3.479 1.00 . A A . 17 ILE HG13 1 1 5 1386 1 1 17 ILE HG21 H -3.195 4.689 6.578 1.00 . A A . 17 ILE HG21 1 1 5 1387 1 1 17 ILE HG22 H -4.089 3.263 6.053 1.00 . A A . 17 ILE HG22 1 1 5 1388 1 1 17 ILE HG23 H -4.952 4.752 6.438 1.00 . A A . 17 ILE HG23 1 1 5 1389 1 1 17 ILE N N -2.722 4.266 2.433 1.00 . A A . 17 ILE N 1 1 5 1390 1 1 17 ILE O O -4.900 2.211 4.230 1.00 . A A . 17 ILE O 1 1 5 1391 1 1 18 SER C C -3.210 -0.360 1.293 1.00 . A A . 18 SER C 1 1 5 1392 1 1 18 SER CA C -4.080 0.408 2.273 1.00 . A A . 18 SER CA 1 1 5 1393 1 1 18 SER CB C -5.474 0.620 1.682 1.00 . A A . 18 SER CB 1 1 5 1394 1 1 18 SER H H -2.658 1.951 2.098 1.00 . A A . 18 SER H 1 1 5 1395 1 1 18 SER HA H -4.167 -0.165 3.184 1.00 . A A . 18 SER HA 1 1 5 1396 1 1 18 SER HB2 H -5.837 -0.317 1.287 1.00 . A A . 18 SER HB2 1 1 5 1397 1 1 18 SER HB3 H -6.140 0.964 2.456 1.00 . A A . 18 SER HB3 1 1 5 1398 1 1 18 SER HG H -5.163 2.426 0.984 1.00 . A A . 18 SER HG 1 1 5 1399 1 1 18 SER N N -3.453 1.675 2.600 1.00 . A A . 18 SER N 1 1 5 1400 1 1 18 SER O O -2.557 0.237 0.435 1.00 . A A . 18 SER O 1 1 5 1401 1 1 18 SER OG O -5.451 1.577 0.632 1.00 . A A . 18 SER OG 1 1 5 1402 1 1 19 PHE C C -3.115 -3.875 0.396 1.00 . A A . 19 PHE C 1 1 5 1403 1 1 19 PHE CA C -2.395 -2.544 0.579 1.00 . A A . 19 PHE CA 1 1 5 1404 1 1 19 PHE CB C -1.005 -2.820 1.181 1.00 . A A . 19 PHE CB 1 1 5 1405 1 1 19 PHE CD1 C -0.485 -1.029 2.871 1.00 . A A . 19 PHE CD1 1 1 5 1406 1 1 19 PHE CD2 C 0.727 -1.036 0.819 1.00 . A A . 19 PHE CD2 1 1 5 1407 1 1 19 PHE CE1 C 0.220 0.083 3.290 1.00 . A A . 19 PHE CE1 1 1 5 1408 1 1 19 PHE CE2 C 1.436 0.075 1.231 1.00 . A A . 19 PHE CE2 1 1 5 1409 1 1 19 PHE CG C -0.243 -1.600 1.631 1.00 . A A . 19 PHE CG 1 1 5 1410 1 1 19 PHE CZ C 1.182 0.636 2.468 1.00 . A A . 19 PHE CZ 1 1 5 1411 1 1 19 PHE H H -3.732 -2.079 2.151 1.00 . A A . 19 PHE H 1 1 5 1412 1 1 19 PHE HA H -2.283 -2.064 -0.383 1.00 . A A . 19 PHE HA 1 1 5 1413 1 1 19 PHE HB2 H -1.123 -3.466 2.033 1.00 . A A . 19 PHE HB2 1 1 5 1414 1 1 19 PHE HB3 H -0.406 -3.330 0.443 1.00 . A A . 19 PHE HB3 1 1 5 1415 1 1 19 PHE HD1 H -1.238 -1.461 3.516 1.00 . A A . 19 PHE HD1 1 1 5 1416 1 1 19 PHE HD2 H 0.923 -1.471 -0.150 1.00 . A A . 19 PHE HD2 1 1 5 1417 1 1 19 PHE HE1 H 0.018 0.520 4.256 1.00 . A A . 19 PHE HE1 1 1 5 1418 1 1 19 PHE HE2 H 2.190 0.504 0.589 1.00 . A A . 19 PHE HE2 1 1 5 1419 1 1 19 PHE HZ H 1.736 1.505 2.791 1.00 . A A . 19 PHE HZ 1 1 5 1420 1 1 19 PHE N N -3.192 -1.673 1.436 1.00 . A A . 19 PHE N 1 1 5 1421 1 1 19 PHE O O -4.127 -4.132 1.049 1.00 . A A . 19 PHE O 1 1 5 1422 1 1 20 TYR C C -2.096 -7.021 -1.193 1.00 . A A . 20 TYR C 1 1 5 1423 1 1 20 TYR CA C -3.150 -6.041 -0.718 1.00 . A A . 20 TYR CA 1 1 5 1424 1 1 20 TYR CB C -4.313 -6.007 -1.726 1.00 . A A . 20 TYR CB 1 1 5 1425 1 1 20 TYR CD1 C -2.846 -5.304 -3.685 1.00 . A A . 20 TYR CD1 1 1 5 1426 1 1 20 TYR CD2 C -5.052 -4.424 -3.553 1.00 . A A . 20 TYR CD2 1 1 5 1427 1 1 20 TYR CE1 C -2.631 -4.596 -4.851 1.00 . A A . 20 TYR CE1 1 1 5 1428 1 1 20 TYR CE2 C -4.844 -3.713 -4.719 1.00 . A A . 20 TYR CE2 1 1 5 1429 1 1 20 TYR CG C -4.060 -5.230 -3.011 1.00 . A A . 20 TYR CG 1 1 5 1430 1 1 20 TYR CZ C -3.632 -3.802 -5.363 1.00 . A A . 20 TYR CZ 1 1 5 1431 1 1 20 TYR H H -1.759 -4.455 -0.944 1.00 . A A . 20 TYR H 1 1 5 1432 1 1 20 TYR HA H -3.533 -6.398 0.228 1.00 . A A . 20 TYR HA 1 1 5 1433 1 1 20 TYR HB2 H -4.544 -7.022 -2.010 1.00 . A A . 20 TYR HB2 1 1 5 1434 1 1 20 TYR HB3 H -5.173 -5.583 -1.244 1.00 . A A . 20 TYR HB3 1 1 5 1435 1 1 20 TYR HD1 H -2.061 -5.929 -3.284 1.00 . A A . 20 TYR HD1 1 1 5 1436 1 1 20 TYR HD2 H -6.003 -4.352 -3.045 1.00 . A A . 20 TYR HD2 1 1 5 1437 1 1 20 TYR HE1 H -1.679 -4.666 -5.357 1.00 . A A . 20 TYR HE1 1 1 5 1438 1 1 20 TYR HE2 H -5.631 -3.091 -5.122 1.00 . A A . 20 TYR HE2 1 1 5 1439 1 1 20 TYR HH H -3.122 -2.204 -6.300 1.00 . A A . 20 TYR HH 1 1 5 1440 1 1 20 TYR N N -2.576 -4.720 -0.468 1.00 . A A . 20 TYR N 1 1 5 1441 1 1 20 TYR O O -0.961 -6.639 -1.512 1.00 . A A . 20 TYR O 1 1 5 1442 1 1 20 TYR OH O -3.417 -3.093 -6.521 1.00 . A A . 20 TYR OH 1 1 5 1443 1 1 21 GLY C C -0.604 -9.737 -0.595 1.00 . A A . 21 GLY C 1 1 5 1444 1 1 21 GLY CA C -1.607 -9.347 -1.664 1.00 . A A . 21 GLY CA 1 1 5 1445 1 1 21 GLY H H -3.410 -8.492 -0.961 1.00 . A A . 21 GLY H 1 1 5 1446 1 1 21 GLY HA2 H -2.200 -10.212 -1.917 1.00 . A A . 21 GLY HA2 1 1 5 1447 1 1 21 GLY HA3 H -1.071 -9.020 -2.543 1.00 . A A . 21 GLY HA3 1 1 5 1448 1 1 21 GLY N N -2.493 -8.281 -1.233 1.00 . A A . 21 GLY N 1 1 5 1449 1 1 21 GLY O O -0.075 -10.865 -0.652 1.00 . A A . 21 GLY O 1 1 5 1450 1 1 21 GLY OXT O -0.326 -8.907 0.295 1.00 . A A . 21 GLY OXT 1 1 6 1451 1 1 1 GLY C C -8.272 -3.096 1.749 1.00 . A A . 1 GLY C 1 1 6 1452 1 1 1 GLY CA C -8.704 -2.178 0.620 1.00 . A A . 1 GLY CA 1 1 6 1453 1 1 1 GLY H2 H -7.346 -0.872 -0.349 1.00 . A A . 1 GLY H2 1 1 6 1454 1 1 1 GLY HA2 H -9.122 -1.279 1.045 1.00 . A A . 1 GLY HA2 1 1 6 1455 1 1 1 GLY HA3 H -9.468 -2.677 0.040 1.00 . A A . 1 GLY HA3 1 1 6 1456 1 1 1 GLY N N -7.611 -1.812 -0.267 1.00 . A A . 1 GLY N 1 1 6 1457 1 1 1 GLY O O -9.011 -3.996 2.139 1.00 . A A . 1 GLY O 1 1 6 1458 1 1 2 GLY C C -5.144 -3.338 3.712 1.00 . A A . 2 GLY C 1 1 6 1459 1 1 2 GLY CA C -6.576 -3.680 3.362 1.00 . A A . 2 GLY CA 1 1 6 1460 1 1 2 GLY H H -6.534 -2.132 1.930 1.00 . A A . 2 GLY H 1 1 6 1461 1 1 2 GLY HA2 H -7.197 -3.527 4.234 1.00 . A A . 2 GLY HA2 1 1 6 1462 1 1 2 GLY HA3 H -6.627 -4.719 3.072 1.00 . A A . 2 GLY HA3 1 1 6 1463 1 1 2 GLY N N -7.079 -2.863 2.277 1.00 . A A . 2 GLY N 1 1 6 1464 1 1 2 GLY O O -4.770 -2.163 3.733 1.00 . A A . 2 GLY O 1 1 6 1465 1 1 3 ALA C C -2.094 -5.264 3.656 1.00 . A A . 3 ALA C 1 1 6 1466 1 1 3 ALA CA C -2.934 -4.169 4.295 1.00 . A A . 3 ALA CA 1 1 6 1467 1 1 3 ALA CB C -2.741 -4.160 5.804 1.00 . A A . 3 ALA CB 1 1 6 1468 1 1 3 ALA H H -4.690 -5.271 3.905 1.00 . A A . 3 ALA H 1 1 6 1469 1 1 3 ALA HA H -2.620 -3.211 3.905 1.00 . A A . 3 ALA HA 1 1 6 1470 1 1 3 ALA HB1 H -2.193 -5.042 6.103 1.00 . A A . 3 ALA HB1 1 1 6 1471 1 1 3 ALA HB2 H -3.705 -4.153 6.290 1.00 . A A . 3 ALA HB2 1 1 6 1472 1 1 3 ALA HB3 H -2.187 -3.278 6.092 1.00 . A A . 3 ALA HB3 1 1 6 1473 1 1 3 ALA N N -4.336 -4.357 3.961 1.00 . A A . 3 ALA N 1 1 6 1474 1 1 3 ALA O O -2.515 -6.416 3.599 1.00 . A A . 3 ALA O 1 1 6 1475 1 1 4 GLY C C 1.167 -5.218 1.898 1.00 . A A . 4 GLY C 1 1 6 1476 1 1 4 GLY CA C -0.057 -5.861 2.518 1.00 . A A . 4 GLY CA 1 1 6 1477 1 1 4 GLY H H -0.641 -3.961 3.227 1.00 . A A . 4 GLY H 1 1 6 1478 1 1 4 GLY HA2 H 0.262 -6.587 3.251 1.00 . A A . 4 GLY HA2 1 1 6 1479 1 1 4 GLY HA3 H -0.615 -6.367 1.745 1.00 . A A . 4 GLY HA3 1 1 6 1480 1 1 4 GLY N N -0.921 -4.897 3.162 1.00 . A A . 4 GLY N 1 1 6 1481 1 1 4 GLY O O 1.845 -4.418 2.539 1.00 . A A . 4 GLY O 1 1 6 1482 1 1 5 HIS C C 2.214 -4.109 -1.170 1.00 . A A . 5 HIS C 1 1 6 1483 1 1 5 HIS CA C 2.625 -5.063 -0.051 1.00 . A A . 5 HIS CA 1 1 6 1484 1 1 5 HIS CB C 3.444 -6.212 -0.659 1.00 . A A . 5 HIS CB 1 1 6 1485 1 1 5 HIS CD2 C 3.756 -7.357 1.657 1.00 . A A . 5 HIS CD2 1 1 6 1486 1 1 5 HIS CE1 C 4.522 -9.282 0.955 1.00 . A A . 5 HIS CE1 1 1 6 1487 1 1 5 HIS CG C 3.811 -7.302 0.305 1.00 . A A . 5 HIS CG 1 1 6 1488 1 1 5 HIS H H 0.886 -6.245 0.201 1.00 . A A . 5 HIS H 1 1 6 1489 1 1 5 HIS HA H 3.239 -4.529 0.658 1.00 . A A . 5 HIS HA 1 1 6 1490 1 1 5 HIS HB2 H 2.874 -6.661 -1.458 1.00 . A A . 5 HIS HB2 1 1 6 1491 1 1 5 HIS HB3 H 4.360 -5.809 -1.067 1.00 . A A . 5 HIS HB3 1 1 6 1492 1 1 5 HIS HD1 H 4.434 -8.806 -1.031 1.00 . A A . 5 HIS HD1 1 1 6 1493 1 1 5 HIS HD2 H 3.421 -6.568 2.316 1.00 . A A . 5 HIS HD2 1 1 6 1494 1 1 5 HIS HE1 H 4.905 -10.292 0.936 1.00 . A A . 5 HIS HE1 1 1 6 1495 1 1 5 HIS HE2 H 4.036 -9.003 2.916 1.00 . A A . 5 HIS HE2 1 1 6 1496 1 1 5 HIS N N 1.461 -5.584 0.657 1.00 . A A . 5 HIS N 1 1 6 1497 1 1 5 HIS ND1 N 4.298 -8.525 -0.103 1.00 . A A . 5 HIS ND1 1 1 6 1498 1 1 5 HIS NE2 N 4.202 -8.600 2.039 1.00 . A A . 5 HIS NE2 1 1 6 1499 1 1 5 HIS O O 2.781 -3.027 -1.309 1.00 . A A . 5 HIS O 1 1 6 1500 1 1 6 VAL C C -0.344 -2.761 -2.657 1.00 . A A . 6 VAL C 1 1 6 1501 1 1 6 VAL CA C 0.780 -3.693 -3.090 1.00 . A A . 6 VAL CA 1 1 6 1502 1 1 6 VAL CB C 0.330 -4.549 -4.295 1.00 . A A . 6 VAL CB 1 1 6 1503 1 1 6 VAL CG1 C 1.540 -5.081 -5.048 1.00 . A A . 6 VAL CG1 1 1 6 1504 1 1 6 VAL CG2 C -0.556 -5.702 -3.848 1.00 . A A . 6 VAL CG2 1 1 6 1505 1 1 6 VAL H H 0.820 -5.397 -1.825 1.00 . A A . 6 VAL H 1 1 6 1506 1 1 6 VAL HA H 1.618 -3.086 -3.409 1.00 . A A . 6 VAL HA 1 1 6 1507 1 1 6 VAL HB H -0.237 -3.923 -4.968 1.00 . A A . 6 VAL HB 1 1 6 1508 1 1 6 VAL HG11 H 2.440 -4.659 -4.626 1.00 . A A . 6 VAL HG11 1 1 6 1509 1 1 6 VAL HG12 H 1.466 -4.808 -6.090 1.00 . A A . 6 VAL HG12 1 1 6 1510 1 1 6 VAL HG13 H 1.574 -6.158 -4.960 1.00 . A A . 6 VAL HG13 1 1 6 1511 1 1 6 VAL HG21 H -0.165 -6.122 -2.933 1.00 . A A . 6 VAL HG21 1 1 6 1512 1 1 6 VAL HG22 H -0.574 -6.462 -4.614 1.00 . A A . 6 VAL HG22 1 1 6 1513 1 1 6 VAL HG23 H -1.559 -5.339 -3.676 1.00 . A A . 6 VAL HG23 1 1 6 1514 1 1 6 VAL N N 1.238 -4.520 -1.978 1.00 . A A . 6 VAL N 1 1 6 1515 1 1 6 VAL O O -1.379 -3.207 -2.178 1.00 . A A . 6 VAL O 1 1 6 1516 1 1 7 PRO C C -2.411 -0.450 -3.191 1.00 . A A . 7 PRO C 1 1 6 1517 1 1 7 PRO CA C -1.100 -0.416 -2.405 1.00 . A A . 7 PRO CA 1 1 6 1518 1 1 7 PRO CB C -0.368 0.901 -2.683 1.00 . A A . 7 PRO CB 1 1 6 1519 1 1 7 PRO CD C 1.103 -0.856 -3.340 1.00 . A A . 7 PRO CD 1 1 6 1520 1 1 7 PRO CG C 1.072 0.540 -2.796 1.00 . A A . 7 PRO CG 1 1 6 1521 1 1 7 PRO HA H -1.324 -0.480 -1.350 1.00 . A A . 7 PRO HA 1 1 6 1522 1 1 7 PRO HB2 H -0.739 1.332 -3.603 1.00 . A A . 7 PRO HB2 1 1 6 1523 1 1 7 PRO HB3 H -0.539 1.588 -1.868 1.00 . A A . 7 PRO HB3 1 1 6 1524 1 1 7 PRO HD2 H 1.087 -0.844 -4.420 1.00 . A A . 7 PRO HD2 1 1 6 1525 1 1 7 PRO HD3 H 1.973 -1.383 -2.978 1.00 . A A . 7 PRO HD3 1 1 6 1526 1 1 7 PRO HG2 H 1.570 1.219 -3.474 1.00 . A A . 7 PRO HG2 1 1 6 1527 1 1 7 PRO HG3 H 1.537 0.573 -1.822 1.00 . A A . 7 PRO HG3 1 1 6 1528 1 1 7 PRO N N -0.130 -1.447 -2.802 1.00 . A A . 7 PRO N 1 1 6 1529 1 1 7 PRO O O -2.419 -0.617 -4.409 1.00 . A A . 7 PRO O 1 1 6 1530 1 1 8 GLU C C -5.188 1.226 -3.444 1.00 . A A . 8 GLU C 1 1 6 1531 1 1 8 GLU CA C -4.838 -0.210 -3.076 1.00 . A A . 8 GLU CA 1 1 6 1532 1 1 8 GLU CB C -5.898 -0.744 -2.108 1.00 . A A . 8 GLU CB 1 1 6 1533 1 1 8 GLU CD C -6.963 -2.732 -0.979 1.00 . A A . 8 GLU CD 1 1 6 1534 1 1 8 GLU CG C -5.841 -2.241 -1.875 1.00 . A A . 8 GLU CG 1 1 6 1535 1 1 8 GLU H H -3.425 -0.096 -1.509 1.00 . A A . 8 GLU H 1 1 6 1536 1 1 8 GLU HA H -4.826 -0.816 -3.969 1.00 . A A . 8 GLU HA 1 1 6 1537 1 1 8 GLU HB2 H -5.773 -0.253 -1.155 1.00 . A A . 8 GLU HB2 1 1 6 1538 1 1 8 GLU HB3 H -6.874 -0.502 -2.499 1.00 . A A . 8 GLU HB3 1 1 6 1539 1 1 8 GLU HG2 H -5.914 -2.745 -2.827 1.00 . A A . 8 GLU HG2 1 1 6 1540 1 1 8 GLU HG3 H -4.896 -2.485 -1.410 1.00 . A A . 8 GLU HG3 1 1 6 1541 1 1 8 GLU N N -3.513 -0.250 -2.474 1.00 . A A . 8 GLU N 1 1 6 1542 1 1 8 GLU O O -5.267 1.584 -4.616 1.00 . A A . 8 GLU O 1 1 6 1543 1 1 8 GLU OE1 O -7.221 -3.950 -0.944 1.00 . A A . 8 GLU OE1 1 1 6 1544 1 1 9 TYR C C -4.797 4.321 -1.782 1.00 . A A . 9 TYR C 1 1 6 1545 1 1 9 TYR CA C -5.730 3.447 -2.606 1.00 . A A . 9 TYR CA 1 1 6 1546 1 1 9 TYR CB C -7.184 3.731 -2.209 1.00 . A A . 9 TYR CB 1 1 6 1547 1 1 9 TYR CD1 C -8.481 1.643 -2.816 1.00 . A A . 9 TYR CD1 1 1 6 1548 1 1 9 TYR CD2 C -8.935 3.647 -4.026 1.00 . A A . 9 TYR CD2 1 1 6 1549 1 1 9 TYR CE1 C -9.427 0.971 -3.565 1.00 . A A . 9 TYR CE1 1 1 6 1550 1 1 9 TYR CE2 C -9.884 2.981 -4.779 1.00 . A A . 9 TYR CE2 1 1 6 1551 1 1 9 TYR CG C -8.216 2.991 -3.035 1.00 . A A . 9 TYR CG 1 1 6 1552 1 1 9 TYR CZ C -10.125 1.644 -4.545 1.00 . A A . 9 TYR CZ 1 1 6 1553 1 1 9 TYR H H -5.312 1.694 -1.503 1.00 . A A . 9 TYR H 1 1 6 1554 1 1 9 TYR HA H -5.597 3.683 -3.651 1.00 . A A . 9 TYR HA 1 1 6 1555 1 1 9 TYR HB2 H -7.324 3.452 -1.178 1.00 . A A . 9 TYR HB2 1 1 6 1556 1 1 9 TYR HB3 H -7.374 4.790 -2.314 1.00 . A A . 9 TYR HB3 1 1 6 1557 1 1 9 TYR HD1 H -7.932 1.119 -2.048 1.00 . A A . 9 TYR HD1 1 1 6 1558 1 1 9 TYR HD2 H -8.742 4.694 -4.210 1.00 . A A . 9 TYR HD2 1 1 6 1559 1 1 9 TYR HE1 H -9.616 -0.076 -3.382 1.00 . A A . 9 TYR HE1 1 1 6 1560 1 1 9 TYR HE2 H -10.432 3.509 -5.545 1.00 . A A . 9 TYR HE2 1 1 6 1561 1 1 9 TYR HH H -10.629 0.386 -5.908 1.00 . A A . 9 TYR HH 1 1 6 1562 1 1 9 TYR N N -5.393 2.044 -2.418 1.00 . A A . 9 TYR N 1 1 6 1563 1 1 9 TYR O O -4.418 3.964 -0.661 1.00 . A A . 9 TYR O 1 1 6 1564 1 1 9 TYR OH O -11.069 0.978 -5.291 1.00 . A A . 9 TYR OH 1 1 6 1565 1 1 10 PHE C C -4.344 7.498 -0.996 1.00 . A A . 10 PHE C 1 1 6 1566 1 1 10 PHE CA C -3.542 6.393 -1.664 1.00 . A A . 10 PHE CA 1 1 6 1567 1 1 10 PHE CB C -2.537 7.018 -2.639 1.00 . A A . 10 PHE CB 1 1 6 1568 1 1 10 PHE CD1 C -2.053 4.961 -4.019 1.00 . A A . 10 PHE CD1 1 1 6 1569 1 1 10 PHE CD2 C -0.217 6.215 -3.160 1.00 . A A . 10 PHE CD2 1 1 6 1570 1 1 10 PHE CE1 C -1.175 4.074 -4.610 1.00 . A A . 10 PHE CE1 1 1 6 1571 1 1 10 PHE CE2 C 0.666 5.331 -3.749 1.00 . A A . 10 PHE CE2 1 1 6 1572 1 1 10 PHE CG C -1.586 6.043 -3.286 1.00 . A A . 10 PHE CG 1 1 6 1573 1 1 10 PHE CZ C 0.187 4.259 -4.475 1.00 . A A . 10 PHE CZ 1 1 6 1574 1 1 10 PHE H H -4.769 5.685 -3.230 1.00 . A A . 10 PHE H 1 1 6 1575 1 1 10 PHE HA H -3.002 5.846 -0.906 1.00 . A A . 10 PHE HA 1 1 6 1576 1 1 10 PHE HB2 H -3.079 7.520 -3.419 1.00 . A A . 10 PHE HB2 1 1 6 1577 1 1 10 PHE HB3 H -1.946 7.747 -2.103 1.00 . A A . 10 PHE HB3 1 1 6 1578 1 1 10 PHE HD1 H -3.117 4.814 -4.125 1.00 . A A . 10 PHE HD1 1 1 6 1579 1 1 10 PHE HD2 H 0.161 7.053 -2.592 1.00 . A A . 10 PHE HD2 1 1 6 1580 1 1 10 PHE HE1 H -1.553 3.236 -5.177 1.00 . A A . 10 PHE HE1 1 1 6 1581 1 1 10 PHE HE2 H 1.730 5.478 -3.642 1.00 . A A . 10 PHE HE2 1 1 6 1582 1 1 10 PHE HZ H 0.875 3.567 -4.936 1.00 . A A . 10 PHE HZ 1 1 6 1583 1 1 10 PHE N N -4.430 5.461 -2.340 1.00 . A A . 10 PHE N 1 1 6 1584 1 1 10 PHE O O -5.413 7.879 -1.470 1.00 . A A . 10 PHE O 1 1 6 1585 1 1 11 VAL C C -3.982 10.433 0.252 1.00 . A A . 11 VAL C 1 1 6 1586 1 1 11 VAL CA C -4.445 9.091 0.824 1.00 . A A . 11 VAL CA 1 1 6 1587 1 1 11 VAL CB C -4.136 9.007 2.343 1.00 . A A . 11 VAL CB 1 1 6 1588 1 1 11 VAL CG1 C -2.700 9.410 2.645 1.00 . A A . 11 VAL CG1 1 1 6 1589 1 1 11 VAL CG2 C -5.117 9.845 3.153 1.00 . A A . 11 VAL CG2 1 1 6 1590 1 1 11 VAL H H -2.941 7.673 0.398 1.00 . A A . 11 VAL H 1 1 6 1591 1 1 11 VAL HA H -5.513 9.003 0.686 1.00 . A A . 11 VAL HA 1 1 6 1592 1 1 11 VAL HB H -4.255 7.978 2.645 1.00 . A A . 11 VAL HB 1 1 6 1593 1 1 11 VAL HG11 H -2.698 10.302 3.254 1.00 . A A . 11 VAL HG11 1 1 6 1594 1 1 11 VAL HG12 H -2.180 9.605 1.719 1.00 . A A . 11 VAL HG12 1 1 6 1595 1 1 11 VAL HG13 H -2.206 8.610 3.175 1.00 . A A . 11 VAL HG13 1 1 6 1596 1 1 11 VAL HG21 H -4.966 9.658 4.206 1.00 . A A . 11 VAL HG21 1 1 6 1597 1 1 11 VAL HG22 H -6.128 9.577 2.881 1.00 . A A . 11 VAL HG22 1 1 6 1598 1 1 11 VAL HG23 H -4.953 10.891 2.945 1.00 . A A . 11 VAL HG23 1 1 6 1599 1 1 11 VAL N N -3.808 8.015 0.091 1.00 . A A . 11 VAL N 1 1 6 1600 1 1 11 VAL O O -3.011 10.483 -0.506 1.00 . A A . 11 VAL O 1 1 6 1601 1 1 12 GLY C C -2.922 13.252 0.401 1.00 . A A . 12 GLY C 1 1 6 1602 1 1 12 GLY CA C -4.352 12.831 0.109 1.00 . A A . 12 GLY CA 1 1 6 1603 1 1 12 GLY H H -5.454 11.388 1.198 1.00 . A A . 12 GLY H 1 1 6 1604 1 1 12 GLY HA2 H -4.498 12.844 -0.957 1.00 . A A . 12 GLY HA2 1 1 6 1605 1 1 12 GLY HA3 H -5.024 13.546 0.559 1.00 . A A . 12 GLY HA3 1 1 6 1606 1 1 12 GLY N N -4.687 11.503 0.602 1.00 . A A . 12 GLY N 1 1 6 1607 1 1 12 GLY O O -2.368 14.098 -0.295 1.00 . A A . 12 GLY O 1 1 6 1608 1 1 13 ILE C C 0.065 12.220 0.955 1.00 . A A . 13 ILE C 1 1 6 1609 1 1 13 ILE CA C -0.952 12.991 1.812 1.00 . A A . 13 ILE CA 1 1 6 1610 1 1 13 ILE CB C -0.707 12.694 3.312 1.00 . A A . 13 ILE CB 1 1 6 1611 1 1 13 ILE CD1 C -1.837 12.689 5.601 1.00 . A A . 13 ILE CD1 1 1 6 1612 1 1 13 ILE CG1 C -1.948 13.056 4.136 1.00 . A A . 13 ILE CG1 1 1 6 1613 1 1 13 ILE CG2 C 0.502 13.475 3.820 1.00 . A A . 13 ILE CG2 1 1 6 1614 1 1 13 ILE H H -2.820 11.999 1.941 1.00 . A A . 13 ILE H 1 1 6 1615 1 1 13 ILE HA H -0.809 14.047 1.647 1.00 . A A . 13 ILE HA 1 1 6 1616 1 1 13 ILE HB H -0.501 11.640 3.423 1.00 . A A . 13 ILE HB 1 1 6 1617 1 1 13 ILE HD11 H -0.797 12.680 5.892 1.00 . A A . 13 ILE HD11 1 1 6 1618 1 1 13 ILE HD12 H -2.263 11.709 5.759 1.00 . A A . 13 ILE HD12 1 1 6 1619 1 1 13 ILE HD13 H -2.372 13.414 6.196 1.00 . A A . 13 ILE HD13 1 1 6 1620 1 1 13 ILE HG12 H -2.114 14.122 4.076 1.00 . A A . 13 ILE HG12 1 1 6 1621 1 1 13 ILE HG13 H -2.805 12.540 3.728 1.00 . A A . 13 ILE HG13 1 1 6 1622 1 1 13 ILE HG21 H 1.328 13.342 3.139 1.00 . A A . 13 ILE HG21 1 1 6 1623 1 1 13 ILE HG22 H 0.779 13.112 4.799 1.00 . A A . 13 ILE HG22 1 1 6 1624 1 1 13 ILE HG23 H 0.253 14.523 3.883 1.00 . A A . 13 ILE HG23 1 1 6 1625 1 1 13 ILE N N -2.327 12.665 1.429 1.00 . A A . 13 ILE N 1 1 6 1626 1 1 13 ILE O O 1.147 11.865 1.423 1.00 . A A . 13 ILE O 1 1 6 1627 1 1 14 GLY C C 1.177 10.006 -0.696 1.00 . A A . 14 GLY C 1 1 6 1628 1 1 14 GLY CA C 0.568 11.286 -1.247 1.00 . A A . 14 GLY CA 1 1 6 1629 1 1 14 GLY H H -1.170 12.314 -0.605 1.00 . A A . 14 GLY H 1 1 6 1630 1 1 14 GLY HA2 H -0.009 11.038 -2.125 1.00 . A A . 14 GLY HA2 1 1 6 1631 1 1 14 GLY HA3 H 1.368 11.950 -1.538 1.00 . A A . 14 GLY HA3 1 1 6 1632 1 1 14 GLY N N -0.297 11.986 -0.304 1.00 . A A . 14 GLY N 1 1 6 1633 1 1 14 GLY O O 2.362 9.744 -0.894 1.00 . A A . 14 GLY O 1 1 6 1634 1 1 15 THR C C -0.238 6.909 0.592 1.00 . A A . 15 THR C 1 1 6 1635 1 1 15 THR CA C 0.858 7.968 0.582 1.00 . A A . 15 THR CA 1 1 6 1636 1 1 15 THR CB C 1.364 8.198 2.023 1.00 . A A . 15 THR CB 1 1 6 1637 1 1 15 THR CG2 C 2.869 8.419 2.048 1.00 . A A . 15 THR CG2 1 1 6 1638 1 1 15 THR H H -0.558 9.472 0.132 1.00 . A A . 15 THR H 1 1 6 1639 1 1 15 THR HA H 1.685 7.615 -0.016 1.00 . A A . 15 THR HA 1 1 6 1640 1 1 15 THR HB H 1.135 7.320 2.609 1.00 . A A . 15 THR HB 1 1 6 1641 1 1 15 THR HG1 H 1.056 10.141 2.215 1.00 . A A . 15 THR HG1 1 1 6 1642 1 1 15 THR HG21 H 3.264 8.099 3.001 1.00 . A A . 15 THR HG21 1 1 6 1643 1 1 15 THR HG22 H 3.083 9.467 1.903 1.00 . A A . 15 THR HG22 1 1 6 1644 1 1 15 THR HG23 H 3.332 7.846 1.257 1.00 . A A . 15 THR HG23 1 1 6 1645 1 1 15 THR N N 0.377 9.213 -0.001 1.00 . A A . 15 THR N 1 1 6 1646 1 1 15 THR O O -1.400 7.212 0.843 1.00 . A A . 15 THR O 1 1 6 1647 1 1 15 THR OG1 O 0.697 9.328 2.599 1.00 . A A . 15 THR OG1 1 1 6 1648 1 1 16 PRO C C -1.426 4.271 1.677 1.00 . A A . 16 PRO C 1 1 6 1649 1 1 16 PRO CA C -0.859 4.550 0.289 1.00 . A A . 16 PRO CA 1 1 6 1650 1 1 16 PRO CB C -0.046 3.352 -0.211 1.00 . A A . 16 PRO CB 1 1 6 1651 1 1 16 PRO CD C 1.475 5.188 -0.014 1.00 . A A . 16 PRO CD 1 1 6 1652 1 1 16 PRO CG C 1.374 3.692 0.091 1.00 . A A . 16 PRO CG 1 1 6 1653 1 1 16 PRO HA H -1.670 4.752 -0.397 1.00 . A A . 16 PRO HA 1 1 6 1654 1 1 16 PRO HB2 H -0.357 2.459 0.313 1.00 . A A . 16 PRO HB2 1 1 6 1655 1 1 16 PRO HB3 H -0.204 3.224 -1.271 1.00 . A A . 16 PRO HB3 1 1 6 1656 1 1 16 PRO HD2 H 2.189 5.569 0.701 1.00 . A A . 16 PRO HD2 1 1 6 1657 1 1 16 PRO HD3 H 1.752 5.479 -1.016 1.00 . A A . 16 PRO HD3 1 1 6 1658 1 1 16 PRO HG2 H 1.624 3.369 1.090 1.00 . A A . 16 PRO HG2 1 1 6 1659 1 1 16 PRO HG3 H 2.025 3.222 -0.632 1.00 . A A . 16 PRO HG3 1 1 6 1660 1 1 16 PRO N N 0.112 5.644 0.308 1.00 . A A . 16 PRO N 1 1 6 1661 1 1 16 PRO O O -0.679 4.063 2.631 1.00 . A A . 16 PRO O 1 1 6 1662 1 1 17 ILE C C -4.191 2.720 3.010 1.00 . A A . 17 ILE C 1 1 6 1663 1 1 17 ILE CA C -3.398 4.028 3.068 1.00 . A A . 17 ILE CA 1 1 6 1664 1 1 17 ILE CB C -4.302 5.226 3.463 1.00 . A A . 17 ILE CB 1 1 6 1665 1 1 17 ILE CD1 C -3.648 5.158 5.928 1.00 . A A . 17 ILE CD1 1 1 6 1666 1 1 17 ILE CG1 C -4.775 5.115 4.917 1.00 . A A . 17 ILE CG1 1 1 6 1667 1 1 17 ILE CG2 C -5.491 5.352 2.517 1.00 . A A . 17 ILE CG2 1 1 6 1668 1 1 17 ILE H H -3.297 4.448 0.994 1.00 . A A . 17 ILE H 1 1 6 1669 1 1 17 ILE HA H -2.623 3.921 3.810 1.00 . A A . 17 ILE HA 1 1 6 1670 1 1 17 ILE HB H -3.712 6.127 3.361 1.00 . A A . 17 ILE HB 1 1 6 1671 1 1 17 ILE HD11 H -2.873 5.822 5.573 1.00 . A A . 17 ILE HD11 1 1 6 1672 1 1 17 ILE HD12 H -3.241 4.166 6.057 1.00 . A A . 17 ILE HD12 1 1 6 1673 1 1 17 ILE HD13 H -4.025 5.519 6.873 1.00 . A A . 17 ILE HD13 1 1 6 1674 1 1 17 ILE HG12 H -5.446 5.932 5.135 1.00 . A A . 17 ILE HG12 1 1 6 1675 1 1 17 ILE HG13 H -5.301 4.180 5.046 1.00 . A A . 17 ILE HG13 1 1 6 1676 1 1 17 ILE HG21 H -5.136 5.556 1.518 1.00 . A A . 17 ILE HG21 1 1 6 1677 1 1 17 ILE HG22 H -6.129 6.158 2.844 1.00 . A A . 17 ILE HG22 1 1 6 1678 1 1 17 ILE HG23 H -6.049 4.427 2.519 1.00 . A A . 17 ILE HG23 1 1 6 1679 1 1 17 ILE N N -2.747 4.274 1.788 1.00 . A A . 17 ILE N 1 1 6 1680 1 1 17 ILE O O -5.214 2.542 3.672 1.00 . A A . 17 ILE O 1 1 6 1681 1 1 18 SER C C -3.477 -0.330 1.036 1.00 . A A . 18 SER C 1 1 6 1682 1 1 18 SER CA C -4.290 0.491 2.025 1.00 . A A . 18 SER CA 1 1 6 1683 1 1 18 SER CB C -5.733 0.622 1.526 1.00 . A A . 18 SER CB 1 1 6 1684 1 1 18 SER H H -2.858 2.012 1.723 1.00 . A A . 18 SER H 1 1 6 1685 1 1 18 SER HA H -4.291 -0.011 2.982 1.00 . A A . 18 SER HA 1 1 6 1686 1 1 18 SER HB2 H -6.107 -0.353 1.255 1.00 . A A . 18 SER HB2 1 1 6 1687 1 1 18 SER HB3 H -6.346 1.036 2.311 1.00 . A A . 18 SER HB3 1 1 6 1688 1 1 18 SER HG H -5.494 2.351 0.632 1.00 . A A . 18 SER HG 1 1 6 1689 1 1 18 SER N N -3.682 1.802 2.207 1.00 . A A . 18 SER N 1 1 6 1690 1 1 18 SER O O -2.865 0.225 0.125 1.00 . A A . 18 SER O 1 1 6 1691 1 1 18 SER OG O -5.806 1.469 0.390 1.00 . A A . 18 SER OG 1 1 6 1692 1 1 19 PHE C C -3.552 -3.821 0.130 1.00 . A A . 19 PHE C 1 1 6 1693 1 1 19 PHE CA C -2.743 -2.544 0.330 1.00 . A A . 19 PHE CA 1 1 6 1694 1 1 19 PHE CB C -1.363 -2.907 0.891 1.00 . A A . 19 PHE CB 1 1 6 1695 1 1 19 PHE CD1 C -0.799 -1.237 2.688 1.00 . A A . 19 PHE CD1 1 1 6 1696 1 1 19 PHE CD2 C 0.445 -1.180 0.656 1.00 . A A . 19 PHE CD2 1 1 6 1697 1 1 19 PHE CE1 C -0.058 -0.178 3.176 1.00 . A A . 19 PHE CE1 1 1 6 1698 1 1 19 PHE CE2 C 1.189 -0.121 1.137 1.00 . A A . 19 PHE CE2 1 1 6 1699 1 1 19 PHE CG C -0.556 -1.749 1.423 1.00 . A A . 19 PHE CG 1 1 6 1700 1 1 19 PHE CZ C 0.937 0.382 2.399 1.00 . A A . 19 PHE CZ 1 1 6 1701 1 1 19 PHE H H -3.990 -2.023 1.964 1.00 . A A . 19 PHE H 1 1 6 1702 1 1 19 PHE HA H -2.624 -2.051 -0.624 1.00 . A A . 19 PHE HA 1 1 6 1703 1 1 19 PHE HB2 H -1.491 -3.616 1.690 1.00 . A A . 19 PHE HB2 1 1 6 1704 1 1 19 PHE HB3 H -0.786 -3.375 0.105 1.00 . A A . 19 PHE HB3 1 1 6 1705 1 1 19 PHE HD1 H -1.577 -1.672 3.297 1.00 . A A . 19 PHE HD1 1 1 6 1706 1 1 19 PHE HD2 H 0.645 -1.572 -0.331 1.00 . A A . 19 PHE HD2 1 1 6 1707 1 1 19 PHE HE1 H -0.257 0.214 4.163 1.00 . A A . 19 PHE HE1 1 1 6 1708 1 1 19 PHE HE2 H 1.968 0.315 0.528 1.00 . A A . 19 PHE HE2 1 1 6 1709 1 1 19 PHE HZ H 1.518 1.211 2.777 1.00 . A A . 19 PHE HZ 1 1 6 1710 1 1 19 PHE N N -3.477 -1.643 1.216 1.00 . A A . 19 PHE N 1 1 6 1711 1 1 19 PHE O O -4.567 -4.015 0.795 1.00 . A A . 19 PHE O 1 1 6 1712 1 1 20 TYR C C -3.201 -7.072 -0.234 1.00 . A A . 20 TYR C 1 1 6 1713 1 1 20 TYR CA C -3.818 -5.939 -1.037 1.00 . A A . 20 TYR CA 1 1 6 1714 1 1 20 TYR CB C -3.783 -6.310 -2.527 1.00 . A A . 20 TYR CB 1 1 6 1715 1 1 20 TYR CD1 C -3.797 -4.214 -3.942 1.00 . A A . 20 TYR CD1 1 1 6 1716 1 1 20 TYR CD2 C -5.789 -5.519 -3.841 1.00 . A A . 20 TYR CD2 1 1 6 1717 1 1 20 TYR CE1 C -4.419 -3.322 -4.794 1.00 . A A . 20 TYR CE1 1 1 6 1718 1 1 20 TYR CE2 C -6.419 -4.630 -4.691 1.00 . A A . 20 TYR CE2 1 1 6 1719 1 1 20 TYR CG C -4.470 -5.326 -3.451 1.00 . A A . 20 TYR CG 1 1 6 1720 1 1 20 TYR CZ C -5.730 -3.535 -5.165 1.00 . A A . 20 TYR CZ 1 1 6 1721 1 1 20 TYR H H -2.285 -4.477 -1.277 1.00 . A A . 20 TYR H 1 1 6 1722 1 1 20 TYR HA H -4.842 -5.812 -0.729 1.00 . A A . 20 TYR HA 1 1 6 1723 1 1 20 TYR HB2 H -2.753 -6.385 -2.841 1.00 . A A . 20 TYR HB2 1 1 6 1724 1 1 20 TYR HB3 H -4.259 -7.271 -2.655 1.00 . A A . 20 TYR HB3 1 1 6 1725 1 1 20 TYR HD1 H -2.770 -4.049 -3.649 1.00 . A A . 20 TYR HD1 1 1 6 1726 1 1 20 TYR HD2 H -6.326 -6.377 -3.467 1.00 . A A . 20 TYR HD2 1 1 6 1727 1 1 20 TYR HE1 H -3.880 -2.463 -5.165 1.00 . A A . 20 TYR HE1 1 1 6 1728 1 1 20 TYR HE2 H -7.446 -4.796 -4.982 1.00 . A A . 20 TYR HE2 1 1 6 1729 1 1 20 TYR HH H -5.732 -1.960 -6.267 1.00 . A A . 20 TYR HH 1 1 6 1730 1 1 20 TYR N N -3.110 -4.684 -0.777 1.00 . A A . 20 TYR N 1 1 6 1731 1 1 20 TYR O O -3.868 -7.728 0.564 1.00 . A A . 20 TYR O 1 1 6 1732 1 1 20 TYR OH O -6.354 -2.646 -6.011 1.00 . A A . 20 TYR OH 1 1 6 1733 1 1 21 GLY C C 0.273 -8.255 -0.151 1.00 . A A . 21 GLY C 1 1 6 1734 1 1 21 GLY CA C -1.187 -8.331 0.211 1.00 . A A . 21 GLY CA 1 1 6 1735 1 1 21 GLY H H -1.455 -6.730 -1.119 1.00 . A A . 21 GLY H 1 1 6 1736 1 1 21 GLY HA2 H -1.299 -8.213 1.280 1.00 . A A . 21 GLY HA2 1 1 6 1737 1 1 21 GLY HA3 H -1.576 -9.294 -0.086 1.00 . A A . 21 GLY HA3 1 1 6 1738 1 1 21 GLY N N -1.920 -7.288 -0.466 1.00 . A A . 21 GLY N 1 1 6 1739 1 1 21 GLY O O 0.603 -7.448 -1.051 1.00 . A A . 21 GLY O 1 1 6 1740 1 1 21 GLY OXT O 1.099 -8.948 0.475 1.00 . A A . 21 GLY OXT 1 1 7 1741 1 1 1 GLY C C -8.260 -3.435 1.730 1.00 . A A . 1 GLY C 1 1 7 1742 1 1 1 GLY CA C -8.704 -2.398 0.713 1.00 . A A . 1 GLY CA 1 1 7 1743 1 1 1 GLY H2 H -7.358 -0.993 -0.124 1.00 . A A . 1 GLY H2 1 1 7 1744 1 1 1 GLY HA2 H -9.116 -1.550 1.241 1.00 . A A . 1 GLY HA2 1 1 7 1745 1 1 1 GLY HA3 H -9.477 -2.828 0.093 1.00 . A A . 1 GLY HA3 1 1 7 1746 1 1 1 GLY N N -7.624 -1.936 -0.143 1.00 . A A . 1 GLY N 1 1 7 1747 1 1 1 GLY O O -8.997 -4.369 2.031 1.00 . A A . 1 GLY O 1 1 7 1748 1 1 2 GLY C C -5.120 -3.865 3.645 1.00 . A A . 2 GLY C 1 1 7 1749 1 1 2 GLY CA C -6.540 -4.196 3.242 1.00 . A A . 2 GLY CA 1 1 7 1750 1 1 2 GLY H H -6.515 -2.501 1.986 1.00 . A A . 2 GLY H 1 1 7 1751 1 1 2 GLY HA2 H -7.171 -4.167 4.119 1.00 . A A . 2 GLY HA2 1 1 7 1752 1 1 2 GLY HA3 H -6.563 -5.193 2.826 1.00 . A A . 2 GLY HA3 1 1 7 1753 1 1 2 GLY N N -7.057 -3.264 2.259 1.00 . A A . 2 GLY N 1 1 7 1754 1 1 2 GLY O O -4.772 -2.692 3.798 1.00 . A A . 2 GLY O 1 1 7 1755 1 1 3 ALA C C -2.021 -5.728 3.461 1.00 . A A . 3 ALA C 1 1 7 1756 1 1 3 ALA CA C -2.897 -4.705 4.168 1.00 . A A . 3 ALA CA 1 1 7 1757 1 1 3 ALA CB C -2.731 -4.816 5.677 1.00 . A A . 3 ALA CB 1 1 7 1758 1 1 3 ALA H H -4.624 -5.799 3.637 1.00 . A A . 3 ALA H 1 1 7 1759 1 1 3 ALA HA H -2.597 -3.712 3.865 1.00 . A A . 3 ALA HA 1 1 7 1760 1 1 3 ALA HB1 H -2.981 -3.871 6.136 1.00 . A A . 3 ALA HB1 1 1 7 1761 1 1 3 ALA HB2 H -1.706 -5.068 5.910 1.00 . A A . 3 ALA HB2 1 1 7 1762 1 1 3 ALA HB3 H -3.387 -5.585 6.057 1.00 . A A . 3 ALA HB3 1 1 7 1763 1 1 3 ALA N N -4.292 -4.890 3.795 1.00 . A A . 3 ALA N 1 1 7 1764 1 1 3 ALA O O -2.404 -6.886 3.316 1.00 . A A . 3 ALA O 1 1 7 1765 1 1 4 GLY C C 1.259 -5.427 1.766 1.00 . A A . 4 GLY C 1 1 7 1766 1 1 4 GLY CA C 0.052 -6.168 2.308 1.00 . A A . 4 GLY CA 1 1 7 1767 1 1 4 GLY H H -0.610 -4.350 3.148 1.00 . A A . 4 GLY H 1 1 7 1768 1 1 4 GLY HA2 H 0.389 -6.939 2.986 1.00 . A A . 4 GLY HA2 1 1 7 1769 1 1 4 GLY HA3 H -0.473 -6.631 1.485 1.00 . A A . 4 GLY HA3 1 1 7 1770 1 1 4 GLY N N -0.855 -5.288 3.010 1.00 . A A . 4 GLY N 1 1 7 1771 1 1 4 GLY O O 1.923 -4.698 2.499 1.00 . A A . 4 GLY O 1 1 7 1772 1 1 5 HIS C C 2.241 -3.980 -1.222 1.00 . A A . 5 HIS C 1 1 7 1773 1 1 5 HIS CA C 2.686 -4.971 -0.149 1.00 . A A . 5 HIS CA 1 1 7 1774 1 1 5 HIS CB C 3.627 -6.009 -0.774 1.00 . A A . 5 HIS CB 1 1 7 1775 1 1 5 HIS CD2 C 5.355 -7.105 0.821 1.00 . A A . 5 HIS CD2 1 1 7 1776 1 1 5 HIS CE1 C 4.138 -8.796 1.502 1.00 . A A . 5 HIS CE1 1 1 7 1777 1 1 5 HIS CG C 4.156 -7.021 0.198 1.00 . A A . 5 HIS CG 1 1 7 1778 1 1 5 HIS H H 0.979 -6.222 -0.053 1.00 . A A . 5 HIS H 1 1 7 1779 1 1 5 HIS HA H 3.223 -4.432 0.616 1.00 . A A . 5 HIS HA 1 1 7 1780 1 1 5 HIS HB2 H 3.097 -6.542 -1.548 1.00 . A A . 5 HIS HB2 1 1 7 1781 1 1 5 HIS HB3 H 4.472 -5.497 -1.213 1.00 . A A . 5 HIS HB3 1 1 7 1782 1 1 5 HIS HD1 H 2.491 -8.330 0.364 1.00 . A A . 5 HIS HD1 1 1 7 1783 1 1 5 HIS HD2 H 6.186 -6.424 0.705 1.00 . A A . 5 HIS HD2 1 1 7 1784 1 1 5 HIS HE1 H 3.815 -9.692 2.014 1.00 . A A . 5 HIS HE1 1 1 7 1785 1 1 5 HIS HE2 H 5.990 -8.452 2.300 1.00 . A A . 5 HIS HE2 1 1 7 1786 1 1 5 HIS N N 1.546 -5.618 0.485 1.00 . A A . 5 HIS N 1 1 7 1787 1 1 5 HIS ND1 N 3.420 -8.098 0.647 1.00 . A A . 5 HIS ND1 1 1 7 1788 1 1 5 HIS NE2 N 5.317 -8.218 1.627 1.00 . A A . 5 HIS NE2 1 1 7 1789 1 1 5 HIS O O 2.783 -2.881 -1.314 1.00 . A A . 5 HIS O 1 1 7 1790 1 1 6 VAL C C -0.361 -2.608 -2.591 1.00 . A A . 6 VAL C 1 1 7 1791 1 1 6 VAL CA C 0.776 -3.486 -3.096 1.00 . A A . 6 VAL CA 1 1 7 1792 1 1 6 VAL CB C 0.331 -4.277 -4.348 1.00 . A A . 6 VAL CB 1 1 7 1793 1 1 6 VAL CG1 C 1.543 -4.738 -5.141 1.00 . A A . 6 VAL CG1 1 1 7 1794 1 1 6 VAL CG2 C -0.529 -5.473 -3.962 1.00 . A A . 6 VAL CG2 1 1 7 1795 1 1 6 VAL H H 0.855 -5.256 -1.924 1.00 . A A . 6 VAL H 1 1 7 1796 1 1 6 VAL HA H 1.598 -2.841 -3.384 1.00 . A A . 6 VAL HA 1 1 7 1797 1 1 6 VAL HB H -0.257 -3.623 -4.974 1.00 . A A . 6 VAL HB 1 1 7 1798 1 1 6 VAL HG11 H 1.296 -5.637 -5.687 1.00 . A A . 6 VAL HG11 1 1 7 1799 1 1 6 VAL HG12 H 2.361 -4.939 -4.465 1.00 . A A . 6 VAL HG12 1 1 7 1800 1 1 6 VAL HG13 H 1.834 -3.964 -5.837 1.00 . A A . 6 VAL HG13 1 1 7 1801 1 1 6 VAL HG21 H -1.553 -5.155 -3.841 1.00 . A A . 6 VAL HG21 1 1 7 1802 1 1 6 VAL HG22 H -0.169 -5.890 -3.033 1.00 . A A . 6 VAL HG22 1 1 7 1803 1 1 6 VAL HG23 H -0.473 -6.222 -4.739 1.00 . A A . 6 VAL HG23 1 1 7 1804 1 1 6 VAL N N 1.263 -4.366 -2.036 1.00 . A A . 6 VAL N 1 1 7 1805 1 1 6 VAL O O -1.401 -3.107 -2.179 1.00 . A A . 6 VAL O 1 1 7 1806 1 1 7 PRO C C -2.443 -0.274 -2.909 1.00 . A A . 7 PRO C 1 1 7 1807 1 1 7 PRO CA C -1.145 -0.312 -2.101 1.00 . A A . 7 PRO CA 1 1 7 1808 1 1 7 PRO CB C -0.420 1.033 -2.213 1.00 . A A . 7 PRO CB 1 1 7 1809 1 1 7 PRO CD C 1.079 -0.628 -3.036 1.00 . A A . 7 PRO CD 1 1 7 1810 1 1 7 PRO CG C 1.026 0.695 -2.336 1.00 . A A . 7 PRO CG 1 1 7 1811 1 1 7 PRO HA H -1.387 -0.496 -1.064 1.00 . A A . 7 PRO HA 1 1 7 1812 1 1 7 PRO HB2 H -0.776 1.561 -3.086 1.00 . A A . 7 PRO HB2 1 1 7 1813 1 1 7 PRO HB3 H -0.612 1.622 -1.329 1.00 . A A . 7 PRO HB3 1 1 7 1814 1 1 7 PRO HD2 H 1.079 -0.493 -4.109 1.00 . A A . 7 PRO HD2 1 1 7 1815 1 1 7 PRO HD3 H 1.947 -1.188 -2.725 1.00 . A A . 7 PRO HD3 1 1 7 1816 1 1 7 PRO HG2 H 1.532 1.449 -2.919 1.00 . A A . 7 PRO HG2 1 1 7 1817 1 1 7 PRO HG3 H 1.469 0.616 -1.354 1.00 . A A . 7 PRO HG3 1 1 7 1818 1 1 7 PRO N N -0.157 -1.286 -2.590 1.00 . A A . 7 PRO N 1 1 7 1819 1 1 7 PRO O O -2.431 -0.348 -4.137 1.00 . A A . 7 PRO O 1 1 7 1820 1 1 8 GLU C C -5.250 1.405 -3.073 1.00 . A A . 8 GLU C 1 1 7 1821 1 1 8 GLU CA C -4.875 -0.050 -2.808 1.00 . A A . 8 GLU CA 1 1 7 1822 1 1 8 GLU CB C -5.936 -0.678 -1.900 1.00 . A A . 8 GLU CB 1 1 7 1823 1 1 8 GLU CD C -6.985 -2.774 -0.958 1.00 . A A . 8 GLU CD 1 1 7 1824 1 1 8 GLU CG C -5.872 -2.189 -1.810 1.00 . A A . 8 GLU CG 1 1 7 1825 1 1 8 GLU H H -3.482 -0.061 -1.219 1.00 . A A . 8 GLU H 1 1 7 1826 1 1 8 GLU HA H -4.846 -0.585 -3.745 1.00 . A A . 8 GLU HA 1 1 7 1827 1 1 8 GLU HB2 H -5.818 -0.278 -0.904 1.00 . A A . 8 GLU HB2 1 1 7 1828 1 1 8 GLU HB3 H -6.914 -0.403 -2.271 1.00 . A A . 8 GLU HB3 1 1 7 1829 1 1 8 GLU HG2 H -5.950 -2.601 -2.806 1.00 . A A . 8 GLU HG2 1 1 7 1830 1 1 8 GLU HG3 H -4.923 -2.471 -1.379 1.00 . A A . 8 GLU HG3 1 1 7 1831 1 1 8 GLU N N -3.557 -0.132 -2.195 1.00 . A A . 8 GLU N 1 1 7 1832 1 1 8 GLU O O -5.296 1.850 -4.216 1.00 . A A . 8 GLU O 1 1 7 1833 1 1 8 GLU OE1 O -7.245 -3.988 -1.051 1.00 . A A . 8 GLU OE1 1 1 7 1834 1 1 9 TYR C C -4.860 4.424 -1.437 1.00 . A A . 9 TYR C 1 1 7 1835 1 1 9 TYR CA C -5.900 3.539 -2.106 1.00 . A A . 9 TYR CA 1 1 7 1836 1 1 9 TYR CB C -7.273 3.795 -1.473 1.00 . A A . 9 TYR CB 1 1 7 1837 1 1 9 TYR CD1 C -8.574 1.674 -1.942 1.00 . A A . 9 TYR CD1 1 1 7 1838 1 1 9 TYR CD2 C -9.335 3.706 -2.927 1.00 . A A . 9 TYR CD2 1 1 7 1839 1 1 9 TYR CE1 C -9.616 0.989 -2.534 1.00 . A A . 9 TYR CE1 1 1 7 1840 1 1 9 TYR CE2 C -10.383 3.028 -3.522 1.00 . A A . 9 TYR CE2 1 1 7 1841 1 1 9 TYR CG C -8.414 3.042 -2.128 1.00 . A A . 9 TYR CG 1 1 7 1842 1 1 9 TYR CZ C -10.519 1.670 -3.324 1.00 . A A . 9 TYR CZ 1 1 7 1843 1 1 9 TYR H H -5.472 1.722 -1.110 1.00 . A A . 9 TYR H 1 1 7 1844 1 1 9 TYR HA H -5.946 3.791 -3.154 1.00 . A A . 9 TYR HA 1 1 7 1845 1 1 9 TYR HB2 H -7.239 3.503 -0.435 1.00 . A A . 9 TYR HB2 1 1 7 1846 1 1 9 TYR HB3 H -7.495 4.850 -1.535 1.00 . A A . 9 TYR HB3 1 1 7 1847 1 1 9 TYR HD1 H -7.866 1.143 -1.322 1.00 . A A . 9 TYR HD1 1 1 7 1848 1 1 9 TYR HD2 H -9.227 4.769 -3.083 1.00 . A A . 9 TYR HD2 1 1 7 1849 1 1 9 TYR HE1 H -9.723 -0.074 -2.379 1.00 . A A . 9 TYR HE1 1 1 7 1850 1 1 9 TYR HE2 H -11.090 3.561 -4.140 1.00 . A A . 9 TYR HE2 1 1 7 1851 1 1 9 TYR HH H -11.292 0.696 -4.788 1.00 . A A . 9 TYR HH 1 1 7 1852 1 1 9 TYR N N -5.523 2.137 -1.999 1.00 . A A . 9 TYR N 1 1 7 1853 1 1 9 TYR O O -4.301 4.069 -0.393 1.00 . A A . 9 TYR O 1 1 7 1854 1 1 9 TYR OH O -11.558 0.992 -3.914 1.00 . A A . 9 TYR OH 1 1 7 1855 1 1 10 PHE C C -4.331 7.799 -1.072 1.00 . A A . 10 PHE C 1 1 7 1856 1 1 10 PHE CA C -3.637 6.521 -1.518 1.00 . A A . 10 PHE CA 1 1 7 1857 1 1 10 PHE CB C -2.581 6.895 -2.569 1.00 . A A . 10 PHE CB 1 1 7 1858 1 1 10 PHE CD1 C -2.530 4.839 -4.028 1.00 . A A . 10 PHE CD1 1 1 7 1859 1 1 10 PHE CD2 C -0.503 5.558 -2.999 1.00 . A A . 10 PHE CD2 1 1 7 1860 1 1 10 PHE CE1 C -1.859 3.790 -4.625 1.00 . A A . 10 PHE CE1 1 1 7 1861 1 1 10 PHE CE2 C 0.173 4.508 -3.591 1.00 . A A . 10 PHE CE2 1 1 7 1862 1 1 10 PHE CG C -1.860 5.737 -3.208 1.00 . A A . 10 PHE CG 1 1 7 1863 1 1 10 PHE CZ C -0.505 3.624 -4.407 1.00 . A A . 10 PHE CZ 1 1 7 1864 1 1 10 PHE H H -5.092 5.795 -2.864 1.00 . A A . 10 PHE H 1 1 7 1865 1 1 10 PHE HA H -3.150 6.069 -0.669 1.00 . A A . 10 PHE HA 1 1 7 1866 1 1 10 PHE HB2 H -3.060 7.455 -3.352 1.00 . A A . 10 PHE HB2 1 1 7 1867 1 1 10 PHE HB3 H -1.837 7.524 -2.097 1.00 . A A . 10 PHE HB3 1 1 7 1868 1 1 10 PHE HD1 H -3.588 4.968 -4.200 1.00 . A A . 10 PHE HD1 1 1 7 1869 1 1 10 PHE HD2 H 0.031 6.248 -2.362 1.00 . A A . 10 PHE HD2 1 1 7 1870 1 1 10 PHE HE1 H -2.392 3.099 -5.261 1.00 . A A . 10 PHE HE1 1 1 7 1871 1 1 10 PHE HE2 H 1.232 4.380 -3.418 1.00 . A A . 10 PHE HE2 1 1 7 1872 1 1 10 PHE HZ H 0.021 2.804 -4.872 1.00 . A A . 10 PHE HZ 1 1 7 1873 1 1 10 PHE N N -4.607 5.574 -2.042 1.00 . A A . 10 PHE N 1 1 7 1874 1 1 10 PHE O O -5.296 8.245 -1.691 1.00 . A A . 10 PHE O 1 1 7 1875 1 1 11 VAL C C -3.739 10.794 -0.303 1.00 . A A . 11 VAL C 1 1 7 1876 1 1 11 VAL CA C -4.333 9.645 0.502 1.00 . A A . 11 VAL CA 1 1 7 1877 1 1 11 VAL CB C -3.988 9.829 2.002 1.00 . A A . 11 VAL CB 1 1 7 1878 1 1 11 VAL CG1 C -4.627 11.089 2.569 1.00 . A A . 11 VAL CG1 1 1 7 1879 1 1 11 VAL CG2 C -4.420 8.615 2.804 1.00 . A A . 11 VAL CG2 1 1 7 1880 1 1 11 VAL H H -3.018 7.994 0.407 1.00 . A A . 11 VAL H 1 1 7 1881 1 1 11 VAL HA H -5.407 9.641 0.386 1.00 . A A . 11 VAL HA 1 1 7 1882 1 1 11 VAL HB H -2.916 9.928 2.092 1.00 . A A . 11 VAL HB 1 1 7 1883 1 1 11 VAL HG11 H -4.637 11.035 3.647 1.00 . A A . 11 VAL HG11 1 1 7 1884 1 1 11 VAL HG12 H -5.642 11.173 2.205 1.00 . A A . 11 VAL HG12 1 1 7 1885 1 1 11 VAL HG13 H -4.060 11.954 2.256 1.00 . A A . 11 VAL HG13 1 1 7 1886 1 1 11 VAL HG21 H -3.568 7.972 2.970 1.00 . A A . 11 VAL HG21 1 1 7 1887 1 1 11 VAL HG22 H -5.179 8.075 2.259 1.00 . A A . 11 VAL HG22 1 1 7 1888 1 1 11 VAL HG23 H -4.819 8.937 3.756 1.00 . A A . 11 VAL HG23 1 1 7 1889 1 1 11 VAL N N -3.810 8.394 -0.018 1.00 . A A . 11 VAL N 1 1 7 1890 1 1 11 VAL O O -2.643 10.659 -0.850 1.00 . A A . 11 VAL O 1 1 7 1891 1 1 12 GLY C C -2.606 13.532 -0.701 1.00 . A A . 12 GLY C 1 1 7 1892 1 1 12 GLY CA C -3.988 13.066 -1.126 1.00 . A A . 12 GLY CA 1 1 7 1893 1 1 12 GLY H H -5.326 11.948 0.074 1.00 . A A . 12 GLY H 1 1 7 1894 1 1 12 GLY HA2 H -3.955 12.810 -2.171 1.00 . A A . 12 GLY HA2 1 1 7 1895 1 1 12 GLY HA3 H -4.687 13.877 -0.988 1.00 . A A . 12 GLY HA3 1 1 7 1896 1 1 12 GLY N N -4.459 11.910 -0.379 1.00 . A A . 12 GLY N 1 1 7 1897 1 1 12 GLY O O -1.897 14.170 -1.472 1.00 . A A . 12 GLY O 1 1 7 1898 1 1 13 ILE C C 0.173 12.598 0.611 1.00 . A A . 13 ILE C 1 1 7 1899 1 1 13 ILE CA C -0.915 13.588 1.056 1.00 . A A . 13 ILE CA 1 1 7 1900 1 1 13 ILE CB C -0.943 13.679 2.602 1.00 . A A . 13 ILE CB 1 1 7 1901 1 1 13 ILE CD1 C -2.432 14.290 4.583 1.00 . A A . 13 ILE CD1 1 1 7 1902 1 1 13 ILE CG1 C -2.274 14.271 3.077 1.00 . A A . 13 ILE CG1 1 1 7 1903 1 1 13 ILE CG2 C 0.217 14.533 3.108 1.00 . A A . 13 ILE CG2 1 1 7 1904 1 1 13 ILE H H -2.832 12.689 1.087 1.00 . A A . 13 ILE H 1 1 7 1905 1 1 13 ILE HA H -0.675 14.563 0.662 1.00 . A A . 13 ILE HA 1 1 7 1906 1 1 13 ILE HB H -0.831 12.684 3.005 1.00 . A A . 13 ILE HB 1 1 7 1907 1 1 13 ILE HD11 H -1.760 15.023 5.006 1.00 . A A . 13 ILE HD11 1 1 7 1908 1 1 13 ILE HD12 H -2.198 13.314 4.981 1.00 . A A . 13 ILE HD12 1 1 7 1909 1 1 13 ILE HD13 H -3.450 14.547 4.835 1.00 . A A . 13 ILE HD13 1 1 7 1910 1 1 13 ILE HG12 H -2.353 15.289 2.725 1.00 . A A . 13 ILE HG12 1 1 7 1911 1 1 13 ILE HG13 H -3.085 13.689 2.664 1.00 . A A . 13 ILE HG13 1 1 7 1912 1 1 13 ILE HG21 H 0.002 15.576 2.926 1.00 . A A . 13 ILE HG21 1 1 7 1913 1 1 13 ILE HG22 H 1.121 14.256 2.588 1.00 . A A . 13 ILE HG22 1 1 7 1914 1 1 13 ILE HG23 H 0.347 14.372 4.167 1.00 . A A . 13 ILE HG23 1 1 7 1915 1 1 13 ILE N N -2.223 13.205 0.527 1.00 . A A . 13 ILE N 1 1 7 1916 1 1 13 ILE O O 1.150 12.365 1.319 1.00 . A A . 13 ILE O 1 1 7 1917 1 1 14 GLY C C 1.316 9.949 -0.240 1.00 . A A . 14 GLY C 1 1 7 1918 1 1 14 GLY CA C 0.951 11.106 -1.155 1.00 . A A . 14 GLY CA 1 1 7 1919 1 1 14 GLY H H -0.802 12.295 -1.099 1.00 . A A . 14 GLY H 1 1 7 1920 1 1 14 GLY HA2 H 0.534 10.704 -2.066 1.00 . A A . 14 GLY HA2 1 1 7 1921 1 1 14 GLY HA3 H 1.853 11.648 -1.403 1.00 . A A . 14 GLY HA3 1 1 7 1922 1 1 14 GLY N N -0.007 12.045 -0.583 1.00 . A A . 14 GLY N 1 1 7 1923 1 1 14 GLY O O 2.496 9.665 -0.042 1.00 . A A . 14 GLY O 1 1 7 1924 1 1 15 THR C C -0.540 7.113 1.145 1.00 . A A . 15 THR C 1 1 7 1925 1 1 15 THR CA C 0.589 8.147 1.200 1.00 . A A . 15 THR CA 1 1 7 1926 1 1 15 THR CB C 0.813 8.626 2.657 1.00 . A A . 15 THR CB 1 1 7 1927 1 1 15 THR CG2 C -0.381 9.416 3.178 1.00 . A A . 15 THR CG2 1 1 7 1928 1 1 15 THR H H -0.606 9.529 0.126 1.00 . A A . 15 THR H 1 1 7 1929 1 1 15 THR HA H 1.500 7.677 0.861 1.00 . A A . 15 THR HA 1 1 7 1930 1 1 15 THR HB H 1.681 9.272 2.670 1.00 . A A . 15 THR HB 1 1 7 1931 1 1 15 THR HG1 H 1.867 7.669 4.021 1.00 . A A . 15 THR HG1 1 1 7 1932 1 1 15 THR HG21 H -1.237 9.230 2.549 1.00 . A A . 15 THR HG21 1 1 7 1933 1 1 15 THR HG22 H -0.147 10.472 3.165 1.00 . A A . 15 THR HG22 1 1 7 1934 1 1 15 THR HG23 H -0.602 9.110 4.190 1.00 . A A . 15 THR HG23 1 1 7 1935 1 1 15 THR N N 0.321 9.272 0.315 1.00 . A A . 15 THR N 1 1 7 1936 1 1 15 THR O O -1.715 7.451 1.264 1.00 . A A . 15 THR O 1 1 7 1937 1 1 15 THR OG1 O 1.064 7.511 3.518 1.00 . A A . 15 THR OG1 1 1 7 1938 1 1 16 PRO C C -1.643 4.279 2.239 1.00 . A A . 16 PRO C 1 1 7 1939 1 1 16 PRO CA C -1.173 4.748 0.863 1.00 . A A . 16 PRO CA 1 1 7 1940 1 1 16 PRO CB C -0.401 3.639 0.154 1.00 . A A . 16 PRO CB 1 1 7 1941 1 1 16 PRO CD C 1.187 5.341 0.768 1.00 . A A . 16 PRO CD 1 1 7 1942 1 1 16 PRO CG C 1.025 3.859 0.538 1.00 . A A . 16 PRO CG 1 1 7 1943 1 1 16 PRO HA H -2.030 5.030 0.268 1.00 . A A . 16 PRO HA 1 1 7 1944 1 1 16 PRO HB2 H -0.757 2.677 0.491 1.00 . A A . 16 PRO HB2 1 1 7 1945 1 1 16 PRO HB3 H -0.538 3.728 -0.914 1.00 . A A . 16 PRO HB3 1 1 7 1946 1 1 16 PRO HD2 H 1.773 5.521 1.658 1.00 . A A . 16 PRO HD2 1 1 7 1947 1 1 16 PRO HD3 H 1.653 5.806 -0.089 1.00 . A A . 16 PRO HD3 1 1 7 1948 1 1 16 PRO HG2 H 1.246 3.315 1.444 1.00 . A A . 16 PRO HG2 1 1 7 1949 1 1 16 PRO HG3 H 1.673 3.532 -0.263 1.00 . A A . 16 PRO HG3 1 1 7 1950 1 1 16 PRO N N -0.193 5.832 0.942 1.00 . A A . 16 PRO N 1 1 7 1951 1 1 16 PRO O O -0.836 4.079 3.146 1.00 . A A . 16 PRO O 1 1 7 1952 1 1 17 ILE C C -4.234 2.320 3.515 1.00 . A A . 17 ILE C 1 1 7 1953 1 1 17 ILE CA C -3.508 3.648 3.663 1.00 . A A . 17 ILE CA 1 1 7 1954 1 1 17 ILE CB C -4.461 4.701 4.279 1.00 . A A . 17 ILE CB 1 1 7 1955 1 1 17 ILE CD1 C -6.442 4.510 2.648 1.00 . A A . 17 ILE CD1 1 1 7 1956 1 1 17 ILE CG1 C -5.327 5.377 3.201 1.00 . A A . 17 ILE CG1 1 1 7 1957 1 1 17 ILE CG2 C -3.664 5.744 5.050 1.00 . A A . 17 ILE CG2 1 1 7 1958 1 1 17 ILE H H -3.549 4.268 1.634 1.00 . A A . 17 ILE H 1 1 7 1959 1 1 17 ILE HA H -2.684 3.504 4.341 1.00 . A A . 17 ILE HA 1 1 7 1960 1 1 17 ILE HB H -5.107 4.195 4.981 1.00 . A A . 17 ILE HB 1 1 7 1961 1 1 17 ILE HD11 H -6.289 4.359 1.591 1.00 . A A . 17 ILE HD11 1 1 7 1962 1 1 17 ILE HD12 H -7.392 4.998 2.810 1.00 . A A . 17 ILE HD12 1 1 7 1963 1 1 17 ILE HD13 H -6.439 3.555 3.153 1.00 . A A . 17 ILE HD13 1 1 7 1964 1 1 17 ILE HG12 H -5.781 6.262 3.621 1.00 . A A . 17 ILE HG12 1 1 7 1965 1 1 17 ILE HG13 H -4.694 5.666 2.375 1.00 . A A . 17 ILE HG13 1 1 7 1966 1 1 17 ILE HG21 H -2.610 5.590 4.878 1.00 . A A . 17 ILE HG21 1 1 7 1967 1 1 17 ILE HG22 H -3.875 5.649 6.105 1.00 . A A . 17 ILE HG22 1 1 7 1968 1 1 17 ILE HG23 H -3.944 6.732 4.714 1.00 . A A . 17 ILE HG23 1 1 7 1969 1 1 17 ILE N N -2.948 4.098 2.391 1.00 . A A . 17 ILE N 1 1 7 1970 1 1 17 ILE O O -5.222 2.053 4.198 1.00 . A A . 17 ILE O 1 1 7 1971 1 1 18 SER C C -3.492 -0.541 1.292 1.00 . A A . 18 SER C 1 1 7 1972 1 1 18 SER CA C -4.302 0.181 2.355 1.00 . A A . 18 SER CA 1 1 7 1973 1 1 18 SER CB C -5.759 0.310 1.899 1.00 . A A . 18 SER CB 1 1 7 1974 1 1 18 SER H H -2.931 1.772 2.120 1.00 . A A . 18 SER H 1 1 7 1975 1 1 18 SER HA H -4.266 -0.390 3.272 1.00 . A A . 18 SER HA 1 1 7 1976 1 1 18 SER HB2 H -6.113 -0.650 1.554 1.00 . A A . 18 SER HB2 1 1 7 1977 1 1 18 SER HB3 H -6.365 0.640 2.728 1.00 . A A . 18 SER HB3 1 1 7 1978 1 1 18 SER HG H -5.672 2.128 1.173 1.00 . A A . 18 SER HG 1 1 7 1979 1 1 18 SER N N -3.726 1.493 2.618 1.00 . A A . 18 SER N 1 1 7 1980 1 1 18 SER O O -2.895 0.097 0.427 1.00 . A A . 18 SER O 1 1 7 1981 1 1 18 SER OG O -5.883 1.249 0.839 1.00 . A A . 18 SER OG 1 1 7 1982 1 1 19 PHE C C -3.571 -3.916 0.052 1.00 . A A . 19 PHE C 1 1 7 1983 1 1 19 PHE CA C -2.748 -2.678 0.389 1.00 . A A . 19 PHE CA 1 1 7 1984 1 1 19 PHE CB C -1.374 -3.109 0.921 1.00 . A A . 19 PHE CB 1 1 7 1985 1 1 19 PHE CD1 C -0.806 -1.614 2.867 1.00 . A A . 19 PHE CD1 1 1 7 1986 1 1 19 PHE CD2 C 0.449 -1.382 0.853 1.00 . A A . 19 PHE CD2 1 1 7 1987 1 1 19 PHE CE1 C -0.060 -0.610 3.450 1.00 . A A . 19 PHE CE1 1 1 7 1988 1 1 19 PHE CE2 C 1.198 -0.377 1.432 1.00 . A A . 19 PHE CE2 1 1 7 1989 1 1 19 PHE CG C -0.562 -2.012 1.560 1.00 . A A . 19 PHE CG 1 1 7 1990 1 1 19 PHE CZ C 0.943 0.010 2.733 1.00 . A A . 19 PHE CZ 1 1 7 1991 1 1 19 PHE H H -3.979 -2.315 2.074 1.00 . A A . 19 PHE H 1 1 7 1992 1 1 19 PHE HA H -2.615 -2.091 -0.509 1.00 . A A . 19 PHE HA 1 1 7 1993 1 1 19 PHE HB2 H -1.515 -3.886 1.653 1.00 . A A . 19 PHE HB2 1 1 7 1994 1 1 19 PHE HB3 H -0.797 -3.508 0.098 1.00 . A A . 19 PHE HB3 1 1 7 1995 1 1 19 PHE HD1 H -1.590 -2.098 3.430 1.00 . A A . 19 PHE HD1 1 1 7 1996 1 1 19 PHE HD2 H 0.649 -1.684 -0.166 1.00 . A A . 19 PHE HD2 1 1 7 1997 1 1 19 PHE HE1 H -0.261 -0.308 4.468 1.00 . A A . 19 PHE HE1 1 1 7 1998 1 1 19 PHE HE2 H 1.981 0.107 0.868 1.00 . A A . 19 PHE HE2 1 1 7 1999 1 1 19 PHE HZ H 1.528 0.796 3.188 1.00 . A A . 19 PHE HZ 1 1 7 2000 1 1 19 PHE N N -3.478 -1.865 1.356 1.00 . A A . 19 PHE N 1 1 7 2001 1 1 19 PHE O O -4.592 -4.163 0.685 1.00 . A A . 19 PHE O 1 1 7 2002 1 1 20 TYR C C -3.248 -7.110 -0.632 1.00 . A A . 20 TYR C 1 1 7 2003 1 1 20 TYR CA C -3.849 -5.900 -1.325 1.00 . A A . 20 TYR CA 1 1 7 2004 1 1 20 TYR CB C -3.798 -6.122 -2.843 1.00 . A A . 20 TYR CB 1 1 7 2005 1 1 20 TYR CD1 C -3.797 -3.906 -4.061 1.00 . A A . 20 TYR CD1 1 1 7 2006 1 1 20 TYR CD2 C -5.796 -5.205 -4.088 1.00 . A A . 20 TYR CD2 1 1 7 2007 1 1 20 TYR CE1 C -4.410 -2.939 -4.833 1.00 . A A . 20 TYR CE1 1 1 7 2008 1 1 20 TYR CE2 C -6.415 -4.243 -4.862 1.00 . A A . 20 TYR CE2 1 1 7 2009 1 1 20 TYR CG C -4.479 -5.053 -3.671 1.00 . A A . 20 TYR CG 1 1 7 2010 1 1 20 TYR CZ C -5.719 -3.111 -5.231 1.00 . A A . 20 TYR CZ 1 1 7 2011 1 1 20 TYR H H -2.296 -4.443 -1.402 1.00 . A A . 20 TYR H 1 1 7 2012 1 1 20 TYR HA H -4.876 -5.794 -1.016 1.00 . A A . 20 TYR HA 1 1 7 2013 1 1 20 TYR HB2 H -2.765 -6.164 -3.152 1.00 . A A . 20 TYR HB2 1 1 7 2014 1 1 20 TYR HB3 H -4.270 -7.067 -3.070 1.00 . A A . 20 TYR HB3 1 1 7 2015 1 1 20 TYR HD1 H -2.771 -3.775 -3.748 1.00 . A A . 20 TYR HD1 1 1 7 2016 1 1 20 TYR HD2 H -6.340 -6.091 -3.794 1.00 . A A . 20 TYR HD2 1 1 7 2017 1 1 20 TYR HE1 H -3.865 -2.053 -5.121 1.00 . A A . 20 TYR HE1 1 1 7 2018 1 1 20 TYR HE2 H -7.440 -4.380 -5.175 1.00 . A A . 20 TYR HE2 1 1 7 2019 1 1 20 TYR HH H -5.732 -1.407 -6.120 1.00 . A A . 20 TYR HH 1 1 7 2020 1 1 20 TYR N N -3.130 -4.688 -0.933 1.00 . A A . 20 TYR N 1 1 7 2021 1 1 20 TYR O O -3.930 -7.852 0.071 1.00 . A A . 20 TYR O 1 1 7 2022 1 1 20 TYR OH O -6.332 -2.150 -5.999 1.00 . A A . 20 TYR OH 1 1 7 2023 1 1 21 GLY C C 0.243 -8.214 -0.522 1.00 . A A . 21 GLY C 1 1 7 2024 1 1 21 GLY CA C -1.232 -8.387 -0.271 1.00 . A A . 21 GLY CA 1 1 7 2025 1 1 21 GLY H H -1.486 -6.654 -1.425 1.00 . A A . 21 GLY H 1 1 7 2026 1 1 21 GLY HA2 H -1.415 -8.416 0.793 1.00 . A A . 21 GLY HA2 1 1 7 2027 1 1 21 GLY HA3 H -1.562 -9.311 -0.721 1.00 . A A . 21 GLY HA3 1 1 7 2028 1 1 21 GLY N N -1.960 -7.286 -0.850 1.00 . A A . 21 GLY N 1 1 7 2029 1 1 21 GLY O O 1.056 -8.946 0.070 1.00 . A A . 21 GLY O 1 1 7 2030 1 1 21 GLY OXT O 0.597 -7.294 -1.295 1.00 . A A . 21 GLY OXT 1 1 8 2031 1 1 1 GLY C C -8.268 -3.357 1.317 1.00 . A A . 1 GLY C 1 1 8 2032 1 1 1 GLY CA C -8.659 -2.398 0.207 1.00 . A A . 1 GLY CA 1 1 8 2033 1 1 1 GLY H2 H -7.299 -0.954 -0.534 1.00 . A A . 1 GLY H2 1 1 8 2034 1 1 1 GLY HA2 H -9.173 -1.555 0.643 1.00 . A A . 1 GLY HA2 1 1 8 2035 1 1 1 GLY HA3 H -9.333 -2.904 -0.468 1.00 . A A . 1 GLY HA3 1 1 8 2036 1 1 1 GLY N N -7.519 -1.908 -0.552 1.00 . A A . 1 GLY N 1 1 8 2037 1 1 1 GLY O O -8.975 -4.328 1.580 1.00 . A A . 1 GLY O 1 1 8 2038 1 1 2 GLY C C -5.312 -3.554 3.533 1.00 . A A . 2 GLY C 1 1 8 2039 1 1 2 GLY CA C -6.696 -3.936 3.053 1.00 . A A . 2 GLY CA 1 1 8 2040 1 1 2 GLY H H -6.630 -2.296 1.727 1.00 . A A . 2 GLY H 1 1 8 2041 1 1 2 GLY HA2 H -7.389 -3.856 3.878 1.00 . A A . 2 GLY HA2 1 1 8 2042 1 1 2 GLY HA3 H -6.678 -4.957 2.707 1.00 . A A . 2 GLY HA3 1 1 8 2043 1 1 2 GLY N N -7.151 -3.081 1.974 1.00 . A A . 2 GLY N 1 1 8 2044 1 1 2 GLY O O -5.008 -2.370 3.683 1.00 . A A . 2 GLY O 1 1 8 2045 1 1 3 ALA C C -2.172 -5.354 3.568 1.00 . A A . 3 ALA C 1 1 8 2046 1 1 3 ALA CA C -3.101 -4.327 4.197 1.00 . A A . 3 ALA CA 1 1 8 2047 1 1 3 ALA CB C -3.021 -4.391 5.716 1.00 . A A . 3 ALA CB 1 1 8 2048 1 1 3 ALA H H -4.765 -5.473 3.585 1.00 . A A . 3 ALA H 1 1 8 2049 1 1 3 ALA HA H -2.800 -3.338 3.881 1.00 . A A . 3 ALA HA 1 1 8 2050 1 1 3 ALA HB1 H -2.033 -4.097 6.038 1.00 . A A . 3 ALA HB1 1 1 8 2051 1 1 3 ALA HB2 H -3.220 -5.401 6.045 1.00 . A A . 3 ALA HB2 1 1 8 2052 1 1 3 ALA HB3 H -3.753 -3.722 6.144 1.00 . A A . 3 ALA HB3 1 1 8 2053 1 1 3 ALA N N -4.467 -4.551 3.749 1.00 . A A . 3 ALA N 1 1 8 2054 1 1 3 ALA O O -2.539 -6.517 3.426 1.00 . A A . 3 ALA O 1 1 8 2055 1 1 4 GLY C C 1.186 -5.105 2.017 1.00 . A A . 4 GLY C 1 1 8 2056 1 1 4 GLY CA C -0.038 -5.821 2.555 1.00 . A A . 4 GLY CA 1 1 8 2057 1 1 4 GLY H H -0.742 -3.980 3.309 1.00 . A A . 4 GLY H 1 1 8 2058 1 1 4 GLY HA2 H 0.279 -6.553 3.283 1.00 . A A . 4 GLY HA2 1 1 8 2059 1 1 4 GLY HA3 H -0.531 -6.332 1.741 1.00 . A A . 4 GLY HA3 1 1 8 2060 1 1 4 GLY N N -0.981 -4.920 3.180 1.00 . A A . 4 GLY N 1 1 8 2061 1 1 4 GLY O O 1.796 -4.298 2.715 1.00 . A A . 4 GLY O 1 1 8 2062 1 1 5 HIS C C 2.334 -3.874 -0.977 1.00 . A A . 5 HIS C 1 1 8 2063 1 1 5 HIS CA C 2.730 -4.830 0.146 1.00 . A A . 5 HIS CA 1 1 8 2064 1 1 5 HIS CB C 3.630 -5.929 -0.442 1.00 . A A . 5 HIS CB 1 1 8 2065 1 1 5 HIS CD2 C 3.855 -7.134 1.854 1.00 . A A . 5 HIS CD2 1 1 8 2066 1 1 5 HIS CE1 C 4.706 -9.019 1.137 1.00 . A A . 5 HIS CE1 1 1 8 2067 1 1 5 HIS CG C 3.976 -7.039 0.509 1.00 . A A . 5 HIS CG 1 1 8 2068 1 1 5 HIS H H 1.033 -6.091 0.279 1.00 . A A . 5 HIS H 1 1 8 2069 1 1 5 HIS HA H 3.282 -4.285 0.896 1.00 . A A . 5 HIS HA 1 1 8 2070 1 1 5 HIS HB2 H 3.133 -6.371 -1.292 1.00 . A A . 5 HIS HB2 1 1 8 2071 1 1 5 HIS HB3 H 4.555 -5.479 -0.775 1.00 . A A . 5 HIS HB3 1 1 8 2072 1 1 5 HIS HD1 H 4.705 -8.484 -0.836 1.00 . A A . 5 HIS HD1 1 1 8 2073 1 1 5 HIS HD2 H 3.466 -6.373 2.518 1.00 . A A . 5 HIS HD2 1 1 8 2074 1 1 5 HIS HE1 H 5.114 -10.017 1.109 1.00 . A A . 5 HIS HE1 1 1 8 2075 1 1 5 HIS HE2 H 4.113 -8.811 3.078 1.00 . A A . 5 HIS HE2 1 1 8 2076 1 1 5 HIS N N 1.556 -5.420 0.780 1.00 . A A . 5 HIS N 1 1 8 2077 1 1 5 HIS ND1 N 4.516 -8.234 0.093 1.00 . A A . 5 HIS ND1 1 1 8 2078 1 1 5 HIS NE2 N 4.314 -8.376 2.222 1.00 . A A . 5 HIS NE2 1 1 8 2079 1 1 5 HIS O O 2.907 -2.797 -1.110 1.00 . A A . 5 HIS O 1 1 8 2080 1 1 6 VAL C C -0.175 -2.512 -2.494 1.00 . A A . 6 VAL C 1 1 8 2081 1 1 6 VAL CA C 0.933 -3.464 -2.923 1.00 . A A . 6 VAL CA 1 1 8 2082 1 1 6 VAL CB C 0.428 -4.338 -4.093 1.00 . A A . 6 VAL CB 1 1 8 2083 1 1 6 VAL CG1 C 0.082 -3.479 -5.302 1.00 . A A . 6 VAL CG1 1 1 8 2084 1 1 6 VAL CG2 C 1.463 -5.391 -4.460 1.00 . A A . 6 VAL CG2 1 1 8 2085 1 1 6 VAL H H 0.957 -5.166 -1.655 1.00 . A A . 6 VAL H 1 1 8 2086 1 1 6 VAL HA H 1.779 -2.887 -3.268 1.00 . A A . 6 VAL HA 1 1 8 2087 1 1 6 VAL HB H -0.471 -4.845 -3.773 1.00 . A A . 6 VAL HB 1 1 8 2088 1 1 6 VAL HG11 H -0.205 -4.116 -6.126 1.00 . A A . 6 VAL HG11 1 1 8 2089 1 1 6 VAL HG12 H 0.944 -2.891 -5.584 1.00 . A A . 6 VAL HG12 1 1 8 2090 1 1 6 VAL HG13 H -0.737 -2.821 -5.054 1.00 . A A . 6 VAL HG13 1 1 8 2091 1 1 6 VAL HG21 H 0.963 -6.313 -4.716 1.00 . A A . 6 VAL HG21 1 1 8 2092 1 1 6 VAL HG22 H 2.119 -5.557 -3.620 1.00 . A A . 6 VAL HG22 1 1 8 2093 1 1 6 VAL HG23 H 2.041 -5.048 -5.306 1.00 . A A . 6 VAL HG23 1 1 8 2094 1 1 6 VAL N N 1.372 -4.286 -1.799 1.00 . A A . 6 VAL N 1 1 8 2095 1 1 6 VAL O O -1.227 -2.946 -2.047 1.00 . A A . 6 VAL O 1 1 8 2096 1 1 7 PRO C C -2.197 -0.170 -3.037 1.00 . A A . 7 PRO C 1 1 8 2097 1 1 7 PRO CA C -0.909 -0.167 -2.214 1.00 . A A . 7 PRO CA 1 1 8 2098 1 1 7 PRO CB C -0.148 1.145 -2.434 1.00 . A A . 7 PRO CB 1 1 8 2099 1 1 7 PRO CD C 1.311 -0.610 -3.121 1.00 . A A . 7 PRO CD 1 1 8 2100 1 1 7 PRO CG C 0.931 0.811 -3.403 1.00 . A A . 7 PRO CG 1 1 8 2101 1 1 7 PRO HA H -1.163 -0.256 -1.167 1.00 . A A . 7 PRO HA 1 1 8 2102 1 1 7 PRO HB2 H -0.821 1.890 -2.833 1.00 . A A . 7 PRO HB2 1 1 8 2103 1 1 7 PRO HB3 H 0.260 1.488 -1.495 1.00 . A A . 7 PRO HB3 1 1 8 2104 1 1 7 PRO HD2 H 1.628 -1.105 -4.028 1.00 . A A . 7 PRO HD2 1 1 8 2105 1 1 7 PRO HD3 H 2.090 -0.652 -2.374 1.00 . A A . 7 PRO HD3 1 1 8 2106 1 1 7 PRO HG2 H 0.559 0.907 -4.413 1.00 . A A . 7 PRO HG2 1 1 8 2107 1 1 7 PRO HG3 H 1.777 1.464 -3.252 1.00 . A A . 7 PRO HG3 1 1 8 2108 1 1 7 PRO N N 0.062 -1.198 -2.609 1.00 . A A . 7 PRO N 1 1 8 2109 1 1 7 PRO O O -2.172 -0.308 -4.259 1.00 . A A . 7 PRO O 1 1 8 2110 1 1 8 GLU C C -5.038 1.504 -3.243 1.00 . A A . 8 GLU C 1 1 8 2111 1 1 8 GLU CA C -4.629 0.058 -2.983 1.00 . A A . 8 GLU CA 1 1 8 2112 1 1 8 GLU CB C -5.693 -0.604 -2.103 1.00 . A A . 8 GLU CB 1 1 8 2113 1 1 8 GLU CD C -6.770 -2.733 -1.280 1.00 . A A . 8 GLU CD 1 1 8 2114 1 1 8 GLU CG C -5.607 -2.118 -2.039 1.00 . A A . 8 GLU CG 1 1 8 2115 1 1 8 GLU H H -3.260 0.129 -1.375 1.00 . A A . 8 GLU H 1 1 8 2116 1 1 8 GLU HA H -4.566 -0.467 -3.924 1.00 . A A . 8 GLU HA 1 1 8 2117 1 1 8 GLU HB2 H -5.595 -0.222 -1.099 1.00 . A A . 8 GLU HB2 1 1 8 2118 1 1 8 GLU HB3 H -6.668 -0.337 -2.483 1.00 . A A . 8 GLU HB3 1 1 8 2119 1 1 8 GLU HG2 H -5.607 -2.509 -3.045 1.00 . A A . 8 GLU HG2 1 1 8 2120 1 1 8 GLU HG3 H -4.688 -2.394 -1.544 1.00 . A A . 8 GLU HG3 1 1 8 2121 1 1 8 GLU N N -3.320 0.008 -2.345 1.00 . A A . 8 GLU N 1 1 8 2122 1 1 8 GLU O O -5.064 1.963 -4.382 1.00 . A A . 8 GLU O 1 1 8 2123 1 1 8 GLU OE1 O -6.970 -3.960 -1.369 1.00 . A A . 8 GLU OE1 1 1 8 2124 1 1 9 TYR C C -4.816 4.514 -1.523 1.00 . A A . 9 TYR C 1 1 8 2125 1 1 9 TYR CA C -5.784 3.606 -2.269 1.00 . A A . 9 TYR CA 1 1 8 2126 1 1 9 TYR CB C -7.198 3.801 -1.703 1.00 . A A . 9 TYR CB 1 1 8 2127 1 1 9 TYR CD1 C -8.392 1.619 -2.169 1.00 . A A . 9 TYR CD1 1 1 8 2128 1 1 9 TYR CD2 C -9.164 3.585 -3.272 1.00 . A A . 9 TYR CD2 1 1 8 2129 1 1 9 TYR CE1 C -9.370 0.875 -2.800 1.00 . A A . 9 TYR CE1 1 1 8 2130 1 1 9 TYR CE2 C -10.146 2.848 -3.906 1.00 . A A . 9 TYR CE2 1 1 8 2131 1 1 9 TYR CG C -8.271 2.986 -2.394 1.00 . A A . 9 TYR CG 1 1 8 2132 1 1 9 TYR CZ C -10.245 1.494 -3.667 1.00 . A A . 9 TYR CZ 1 1 8 2133 1 1 9 TYR H H -5.331 1.789 -1.284 1.00 . A A . 9 TYR H 1 1 8 2134 1 1 9 TYR HA H -5.783 3.878 -3.314 1.00 . A A . 9 TYR HA 1 1 8 2135 1 1 9 TYR HB2 H -7.197 3.526 -0.660 1.00 . A A . 9 TYR HB2 1 1 8 2136 1 1 9 TYR HB3 H -7.467 4.845 -1.791 1.00 . A A . 9 TYR HB3 1 1 8 2137 1 1 9 TYR HD1 H -7.704 1.136 -1.491 1.00 . A A . 9 TYR HD1 1 1 8 2138 1 1 9 TYR HD2 H -9.084 4.645 -3.458 1.00 . A A . 9 TYR HD2 1 1 8 2139 1 1 9 TYR HE1 H -9.447 -0.185 -2.612 1.00 . A A . 9 TYR HE1 1 1 8 2140 1 1 9 TYR HE2 H -10.832 3.334 -4.585 1.00 . A A . 9 TYR HE2 1 1 8 2141 1 1 9 TYR HH H -11.012 0.677 -5.229 1.00 . A A . 9 TYR HH 1 1 8 2142 1 1 9 TYR N N -5.366 2.215 -2.168 1.00 . A A . 9 TYR N 1 1 8 2143 1 1 9 TYR O O -4.313 4.158 -0.452 1.00 . A A . 9 TYR O 1 1 8 2144 1 1 9 TYR OH O -11.221 0.757 -4.294 1.00 . A A . 9 TYR OH 1 1 8 2145 1 1 10 PHE C C -4.480 7.864 -1.030 1.00 . A A . 10 PHE C 1 1 8 2146 1 1 10 PHE CA C -3.674 6.658 -1.485 1.00 . A A . 10 PHE CA 1 1 8 2147 1 1 10 PHE CB C -2.595 7.118 -2.470 1.00 . A A . 10 PHE CB 1 1 8 2148 1 1 10 PHE CD1 C -2.683 5.460 -4.367 1.00 . A A . 10 PHE CD1 1 1 8 2149 1 1 10 PHE CD2 C -0.716 5.545 -3.021 1.00 . A A . 10 PHE CD2 1 1 8 2150 1 1 10 PHE CE1 C -2.123 4.453 -5.130 1.00 . A A . 10 PHE CE1 1 1 8 2151 1 1 10 PHE CE2 C -0.152 4.538 -3.779 1.00 . A A . 10 PHE CE2 1 1 8 2152 1 1 10 PHE CG C -1.987 6.018 -3.303 1.00 . A A . 10 PHE CG 1 1 8 2153 1 1 10 PHE CZ C -0.855 3.992 -4.836 1.00 . A A . 10 PHE CZ 1 1 8 2154 1 1 10 PHE H H -5.011 5.906 -2.935 1.00 . A A . 10 PHE H 1 1 8 2155 1 1 10 PHE HA H -3.205 6.199 -0.626 1.00 . A A . 10 PHE HA 1 1 8 2156 1 1 10 PHE HB2 H -3.027 7.843 -3.136 1.00 . A A . 10 PHE HB2 1 1 8 2157 1 1 10 PHE HB3 H -1.798 7.589 -1.913 1.00 . A A . 10 PHE HB3 1 1 8 2158 1 1 10 PHE HD1 H -3.675 5.820 -4.597 1.00 . A A . 10 PHE HD1 1 1 8 2159 1 1 10 PHE HD2 H -0.164 5.970 -2.197 1.00 . A A . 10 PHE HD2 1 1 8 2160 1 1 10 PHE HE1 H -2.676 4.028 -5.954 1.00 . A A . 10 PHE HE1 1 1 8 2161 1 1 10 PHE HE2 H 0.840 4.179 -3.548 1.00 . A A . 10 PHE HE2 1 1 8 2162 1 1 10 PHE HZ H -0.415 3.206 -5.430 1.00 . A A . 10 PHE HZ 1 1 8 2163 1 1 10 PHE N N -4.569 5.683 -2.090 1.00 . A A . 10 PHE N 1 1 8 2164 1 1 10 PHE O O -5.359 8.335 -1.750 1.00 . A A . 10 PHE O 1 1 8 2165 1 1 11 VAL C C -3.943 10.386 1.541 1.00 . A A . 11 VAL C 1 1 8 2166 1 1 11 VAL CA C -4.886 9.516 0.713 1.00 . A A . 11 VAL CA 1 1 8 2167 1 1 11 VAL CB C -6.077 9.103 1.618 1.00 . A A . 11 VAL CB 1 1 8 2168 1 1 11 VAL CG1 C -6.849 10.326 2.096 1.00 . A A . 11 VAL CG1 1 1 8 2169 1 1 11 VAL CG2 C -7.017 8.136 0.911 1.00 . A A . 11 VAL CG2 1 1 8 2170 1 1 11 VAL H H -3.462 7.941 0.682 1.00 . A A . 11 VAL H 1 1 8 2171 1 1 11 VAL HA H -5.271 10.101 -0.111 1.00 . A A . 11 VAL HA 1 1 8 2172 1 1 11 VAL HB H -5.675 8.607 2.487 1.00 . A A . 11 VAL HB 1 1 8 2173 1 1 11 VAL HG11 H -6.241 11.209 1.960 1.00 . A A . 11 VAL HG11 1 1 8 2174 1 1 11 VAL HG12 H -7.091 10.213 3.143 1.00 . A A . 11 VAL HG12 1 1 8 2175 1 1 11 VAL HG13 H -7.759 10.424 1.524 1.00 . A A . 11 VAL HG13 1 1 8 2176 1 1 11 VAL HG21 H -6.505 7.683 0.075 1.00 . A A . 11 VAL HG21 1 1 8 2177 1 1 11 VAL HG22 H -7.884 8.672 0.554 1.00 . A A . 11 VAL HG22 1 1 8 2178 1 1 11 VAL HG23 H -7.328 7.366 1.603 1.00 . A A . 11 VAL HG23 1 1 8 2179 1 1 11 VAL N N -4.181 8.362 0.160 1.00 . A A . 11 VAL N 1 1 8 2180 1 1 11 VAL O O -3.131 9.881 2.313 1.00 . A A . 11 VAL O 1 1 8 2181 1 1 12 GLY C C -2.289 13.366 1.201 1.00 . A A . 12 GLY C 1 1 8 2182 1 1 12 GLY CA C -3.256 12.642 2.099 1.00 . A A . 12 GLY CA 1 1 8 2183 1 1 12 GLY H H -4.733 12.020 0.742 1.00 . A A . 12 GLY H 1 1 8 2184 1 1 12 GLY HA2 H -3.897 13.363 2.571 1.00 . A A . 12 GLY HA2 1 1 8 2185 1 1 12 GLY HA3 H -2.699 12.115 2.859 1.00 . A A . 12 GLY HA3 1 1 8 2186 1 1 12 GLY N N -4.070 11.693 1.371 1.00 . A A . 12 GLY N 1 1 8 2187 1 1 12 GLY O O -2.425 14.560 0.954 1.00 . A A . 12 GLY O 1 1 8 2188 1 1 13 ILE C C 0.278 11.997 -1.025 1.00 . A A . 13 ILE C 1 1 8 2189 1 1 13 ILE CA C -0.292 13.134 -0.189 1.00 . A A . 13 ILE CA 1 1 8 2190 1 1 13 ILE CB C 0.872 13.813 0.579 1.00 . A A . 13 ILE CB 1 1 8 2191 1 1 13 ILE CD1 C 2.434 13.554 2.583 1.00 . A A . 13 ILE CD1 1 1 8 2192 1 1 13 ILE CG1 C 1.241 13.004 1.830 1.00 . A A . 13 ILE CG1 1 1 8 2193 1 1 13 ILE CG2 C 0.526 15.253 0.942 1.00 . A A . 13 ILE CG2 1 1 8 2194 1 1 13 ILE H H -1.318 11.672 0.954 1.00 . A A . 13 ILE H 1 1 8 2195 1 1 13 ILE HA H -0.745 13.863 -0.846 1.00 . A A . 13 ILE HA 1 1 8 2196 1 1 13 ILE HB H 1.728 13.840 -0.079 1.00 . A A . 13 ILE HB 1 1 8 2197 1 1 13 ILE HD11 H 3.345 13.208 2.119 1.00 . A A . 13 ILE HD11 1 1 8 2198 1 1 13 ILE HD12 H 2.399 13.213 3.608 1.00 . A A . 13 ILE HD12 1 1 8 2199 1 1 13 ILE HD13 H 2.407 14.633 2.562 1.00 . A A . 13 ILE HD13 1 1 8 2200 1 1 13 ILE HG12 H 0.399 12.995 2.505 1.00 . A A . 13 ILE HG12 1 1 8 2201 1 1 13 ILE HG13 H 1.471 11.990 1.536 1.00 . A A . 13 ILE HG13 1 1 8 2202 1 1 13 ILE HG21 H -0.498 15.302 1.279 1.00 . A A . 13 ILE HG21 1 1 8 2203 1 1 13 ILE HG22 H 0.652 15.883 0.074 1.00 . A A . 13 ILE HG22 1 1 8 2204 1 1 13 ILE HG23 H 1.182 15.591 1.732 1.00 . A A . 13 ILE HG23 1 1 8 2205 1 1 13 ILE N N -1.329 12.617 0.708 1.00 . A A . 13 ILE N 1 1 8 2206 1 1 13 ILE O O 1.490 11.843 -1.144 1.00 . A A . 13 ILE O 1 1 8 2207 1 1 14 GLY C C 0.324 8.935 -1.489 1.00 . A A . 14 GLY C 1 1 8 2208 1 1 14 GLY CA C -0.186 10.053 -2.372 1.00 . A A . 14 GLY CA 1 1 8 2209 1 1 14 GLY H H -1.565 11.353 -1.434 1.00 . A A . 14 GLY H 1 1 8 2210 1 1 14 GLY HA2 H -1.022 9.694 -2.956 1.00 . A A . 14 GLY HA2 1 1 8 2211 1 1 14 GLY HA3 H 0.605 10.364 -3.039 1.00 . A A . 14 GLY HA3 1 1 8 2212 1 1 14 GLY N N -0.613 11.189 -1.579 1.00 . A A . 14 GLY N 1 1 8 2213 1 1 14 GLY O O 1.025 8.033 -1.941 1.00 . A A . 14 GLY O 1 1 8 2214 1 1 15 THR C C -0.660 6.887 0.822 1.00 . A A . 15 THR C 1 1 8 2215 1 1 15 THR CA C 0.353 8.024 0.762 1.00 . A A . 15 THR CA 1 1 8 2216 1 1 15 THR CB C 0.478 8.687 2.143 1.00 . A A . 15 THR CB 1 1 8 2217 1 1 15 THR CG2 C 1.901 9.164 2.389 1.00 . A A . 15 THR CG2 1 1 8 2218 1 1 15 THR H H -0.601 9.756 0.068 1.00 . A A . 15 THR H 1 1 8 2219 1 1 15 THR HA H 1.317 7.630 0.480 1.00 . A A . 15 THR HA 1 1 8 2220 1 1 15 THR HB H 0.219 7.962 2.902 1.00 . A A . 15 THR HB 1 1 8 2221 1 1 15 THR HG1 H -1.277 9.499 2.577 1.00 . A A . 15 THR HG1 1 1 8 2222 1 1 15 THR HG21 H 2.481 9.048 1.485 1.00 . A A . 15 THR HG21 1 1 8 2223 1 1 15 THR HG22 H 2.346 8.581 3.182 1.00 . A A . 15 THR HG22 1 1 8 2224 1 1 15 THR HG23 H 1.888 10.207 2.674 1.00 . A A . 15 THR HG23 1 1 8 2225 1 1 15 THR N N -0.044 9.009 -0.221 1.00 . A A . 15 THR N 1 1 8 2226 1 1 15 THR O O -1.857 7.121 0.996 1.00 . A A . 15 THR O 1 1 8 2227 1 1 15 THR OG1 O -0.428 9.800 2.223 1.00 . A A . 15 THR OG1 1 1 8 2228 1 1 16 PRO C C -1.684 4.228 2.062 1.00 . A A . 16 PRO C 1 1 8 2229 1 1 16 PRO CA C -1.066 4.464 0.688 1.00 . A A . 16 PRO CA 1 1 8 2230 1 1 16 PRO CB C -0.129 3.303 0.327 1.00 . A A . 16 PRO CB 1 1 8 2231 1 1 16 PRO CD C 1.208 5.279 0.436 1.00 . A A . 16 PRO CD 1 1 8 2232 1 1 16 PRO CG C 1.103 3.938 -0.224 1.00 . A A . 16 PRO CG 1 1 8 2233 1 1 16 PRO HA H -1.851 4.538 -0.049 1.00 . A A . 16 PRO HA 1 1 8 2234 1 1 16 PRO HB2 H 0.089 2.728 1.215 1.00 . A A . 16 PRO HB2 1 1 8 2235 1 1 16 PRO HB3 H -0.607 2.669 -0.407 1.00 . A A . 16 PRO HB3 1 1 8 2236 1 1 16 PRO HD2 H 1.745 5.201 1.371 1.00 . A A . 16 PRO HD2 1 1 8 2237 1 1 16 PRO HD3 H 1.689 5.990 -0.220 1.00 . A A . 16 PRO HD3 1 1 8 2238 1 1 16 PRO HG2 H 1.966 3.333 0.015 1.00 . A A . 16 PRO HG2 1 1 8 2239 1 1 16 PRO HG3 H 1.009 4.054 -1.293 1.00 . A A . 16 PRO HG3 1 1 8 2240 1 1 16 PRO N N -0.197 5.641 0.664 1.00 . A A . 16 PRO N 1 1 8 2241 1 1 16 PRO O O -0.975 4.127 3.061 1.00 . A A . 16 PRO O 1 1 8 2242 1 1 17 ILE C C -4.467 2.568 3.259 1.00 . A A . 17 ILE C 1 1 8 2243 1 1 17 ILE CA C -3.711 3.892 3.350 1.00 . A A . 17 ILE CA 1 1 8 2244 1 1 17 ILE CB C -4.669 5.070 3.681 1.00 . A A . 17 ILE CB 1 1 8 2245 1 1 17 ILE CD1 C -4.123 5.065 6.173 1.00 . A A . 17 ILE CD1 1 1 8 2246 1 1 17 ILE CG1 C -5.203 4.969 5.114 1.00 . A A . 17 ILE CG1 1 1 8 2247 1 1 17 ILE CG2 C -5.818 5.133 2.682 1.00 . A A . 17 ILE CG2 1 1 8 2248 1 1 17 ILE H H -3.517 4.212 1.266 1.00 . A A . 17 ILE H 1 1 8 2249 1 1 17 ILE HA H -2.975 3.813 4.134 1.00 . A A . 17 ILE HA 1 1 8 2250 1 1 17 ILE HB H -4.105 5.986 3.585 1.00 . A A . 17 ILE HB 1 1 8 2251 1 1 17 ILE HD11 H -4.578 5.080 7.151 1.00 . A A . 17 ILE HD11 1 1 8 2252 1 1 17 ILE HD12 H -3.555 5.972 6.025 1.00 . A A . 17 ILE HD12 1 1 8 2253 1 1 17 ILE HD13 H -3.466 4.211 6.094 1.00 . A A . 17 ILE HD13 1 1 8 2254 1 1 17 ILE HG12 H -5.906 5.769 5.288 1.00 . A A . 17 ILE HG12 1 1 8 2255 1 1 17 ILE HG13 H -5.705 4.020 5.237 1.00 . A A . 17 ILE HG13 1 1 8 2256 1 1 17 ILE HG21 H -5.902 6.137 2.292 1.00 . A A . 17 ILE HG21 1 1 8 2257 1 1 17 ILE HG22 H -6.739 4.862 3.176 1.00 . A A . 17 ILE HG22 1 1 8 2258 1 1 17 ILE HG23 H -5.629 4.445 1.872 1.00 . A A . 17 ILE HG23 1 1 8 2259 1 1 17 ILE N N -3.004 4.131 2.101 1.00 . A A . 17 ILE N 1 1 8 2260 1 1 17 ILE O O -5.489 2.341 3.903 1.00 . A A . 17 ILE O 1 1 8 2261 1 1 18 SER C C -3.600 -0.376 1.197 1.00 . A A . 18 SER C 1 1 8 2262 1 1 18 SER CA C -4.469 0.366 2.202 1.00 . A A . 18 SER CA 1 1 8 2263 1 1 18 SER CB C -5.907 0.457 1.682 1.00 . A A . 18 SER CB 1 1 8 2264 1 1 18 SER H H -3.095 1.949 1.971 1.00 . A A . 18 SER H 1 1 8 2265 1 1 18 SER HA H -4.460 -0.172 3.139 1.00 . A A . 18 SER HA 1 1 8 2266 1 1 18 SER HB2 H -6.225 -0.516 1.337 1.00 . A A . 18 SER HB2 1 1 8 2267 1 1 18 SER HB3 H -6.556 0.782 2.481 1.00 . A A . 18 SER HB3 1 1 8 2268 1 1 18 SER HG H -5.894 2.272 0.949 1.00 . A A . 18 SER HG 1 1 8 2269 1 1 18 SER N N -3.916 1.692 2.436 1.00 . A A . 18 SER N 1 1 8 2270 1 1 18 SER O O -2.978 0.248 0.339 1.00 . A A . 18 SER O 1 1 8 2271 1 1 18 SER OG O -6.007 1.377 0.607 1.00 . A A . 18 SER OG 1 1 8 2272 1 1 19 PHE C C -3.498 -3.806 0.071 1.00 . A A . 19 PHE C 1 1 8 2273 1 1 19 PHE CA C -2.757 -2.513 0.391 1.00 . A A . 19 PHE CA 1 1 8 2274 1 1 19 PHE CB C -1.382 -2.858 0.979 1.00 . A A . 19 PHE CB 1 1 8 2275 1 1 19 PHE CD1 C -0.930 -1.245 2.861 1.00 . A A . 19 PHE CD1 1 1 8 2276 1 1 19 PHE CD2 C 0.402 -1.092 0.888 1.00 . A A . 19 PHE CD2 1 1 8 2277 1 1 19 PHE CE1 C -0.227 -0.195 3.420 1.00 . A A . 19 PHE CE1 1 1 8 2278 1 1 19 PHE CE2 C 1.109 -0.043 1.443 1.00 . A A . 19 PHE CE2 1 1 8 2279 1 1 19 PHE CG C -0.627 -1.703 1.587 1.00 . A A . 19 PHE CG 1 1 8 2280 1 1 19 PHE CZ C 0.794 0.407 2.710 1.00 . A A . 19 PHE CZ 1 1 8 2281 1 1 19 PHE H H -4.071 -2.141 2.014 1.00 . A A . 19 PHE H 1 1 8 2282 1 1 19 PHE HA H -2.620 -1.951 -0.523 1.00 . A A . 19 PHE HA 1 1 8 2283 1 1 19 PHE HB2 H -1.513 -3.604 1.742 1.00 . A A . 19 PHE HB2 1 1 8 2284 1 1 19 PHE HB3 H -0.767 -3.272 0.193 1.00 . A A . 19 PHE HB3 1 1 8 2285 1 1 19 PHE HD1 H -1.727 -1.714 3.416 1.00 . A A . 19 PHE HD1 1 1 8 2286 1 1 19 PHE HD2 H 0.646 -1.439 -0.105 1.00 . A A . 19 PHE HD2 1 1 8 2287 1 1 19 PHE HE1 H -0.477 0.156 4.411 1.00 . A A . 19 PHE HE1 1 1 8 2288 1 1 19 PHE HE2 H 1.908 0.423 0.887 1.00 . A A . 19 PHE HE2 1 1 8 2289 1 1 19 PHE HZ H 1.345 1.227 3.146 1.00 . A A . 19 PHE HZ 1 1 8 2290 1 1 19 PHE N N -3.553 -1.697 1.304 1.00 . A A . 19 PHE N 1 1 8 2291 1 1 19 PHE O O -4.531 -4.088 0.671 1.00 . A A . 19 PHE O 1 1 8 2292 1 1 20 TYR C C -3.009 -6.996 -0.456 1.00 . A A . 20 TYR C 1 1 8 2293 1 1 20 TYR CA C -3.600 -5.845 -1.256 1.00 . A A . 20 TYR CA 1 1 8 2294 1 1 20 TYR CB C -3.409 -6.133 -2.753 1.00 . A A . 20 TYR CB 1 1 8 2295 1 1 20 TYR CD1 C -3.375 -3.962 -4.048 1.00 . A A . 20 TYR CD1 1 1 8 2296 1 1 20 TYR CD2 C -5.316 -5.336 -4.205 1.00 . A A . 20 TYR CD2 1 1 8 2297 1 1 20 TYR CE1 C -3.950 -3.042 -4.903 1.00 . A A . 20 TYR CE1 1 1 8 2298 1 1 20 TYR CE2 C -5.899 -4.420 -5.062 1.00 . A A . 20 TYR CE2 1 1 8 2299 1 1 20 TYR CG C -4.045 -5.122 -3.685 1.00 . A A . 20 TYR CG 1 1 8 2300 1 1 20 TYR CZ C -5.211 -3.276 -5.406 1.00 . A A . 20 TYR CZ 1 1 8 2301 1 1 20 TYR H H -2.140 -4.299 -1.312 1.00 . A A . 20 TYR H 1 1 8 2302 1 1 20 TYR HA H -4.653 -5.776 -1.041 1.00 . A A . 20 TYR HA 1 1 8 2303 1 1 20 TYR HB2 H -2.352 -6.155 -2.972 1.00 . A A . 20 TYR HB2 1 1 8 2304 1 1 20 TYR HB3 H -3.834 -7.100 -2.979 1.00 . A A . 20 TYR HB3 1 1 8 2305 1 1 20 TYR HD1 H -2.387 -3.780 -3.652 1.00 . A A . 20 TYR HD1 1 1 8 2306 1 1 20 TYR HD2 H -5.850 -6.232 -3.933 1.00 . A A . 20 TYR HD2 1 1 8 2307 1 1 20 TYR HE1 H -3.412 -2.146 -5.172 1.00 . A A . 20 TYR HE1 1 1 8 2308 1 1 20 TYR HE2 H -6.887 -4.602 -5.455 1.00 . A A . 20 TYR HE2 1 1 8 2309 1 1 20 TYR HH H -5.202 -1.606 -6.362 1.00 . A A . 20 TYR HH 1 1 8 2310 1 1 20 TYR N N -2.974 -4.581 -0.871 1.00 . A A . 20 TYR N 1 1 8 2311 1 1 20 TYR O O -3.711 -7.707 0.259 1.00 . A A . 20 TYR O 1 1 8 2312 1 1 20 TYR OH O -5.788 -2.361 -6.256 1.00 . A A . 20 TYR OH 1 1 8 2313 1 1 21 GLY C C 0.488 -8.082 -0.177 1.00 . A A . 21 GLY C 1 1 8 2314 1 1 21 GLY CA C -0.991 -8.212 0.085 1.00 . A A . 21 GLY CA 1 1 8 2315 1 1 21 GLY H H -1.216 -6.561 -1.190 1.00 . A A . 21 GLY H 1 1 8 2316 1 1 21 GLY HA2 H -1.177 -8.138 1.147 1.00 . A A . 21 GLY HA2 1 1 8 2317 1 1 21 GLY HA3 H -1.331 -9.172 -0.273 1.00 . A A . 21 GLY HA3 1 1 8 2318 1 1 21 GLY N N -1.707 -7.163 -0.599 1.00 . A A . 21 GLY N 1 1 8 2319 1 1 21 GLY O O 0.847 -7.242 -1.035 1.00 . A A . 21 GLY O 1 1 8 2320 1 1 21 GLY OXT O 1.290 -8.763 0.488 1.00 . A A . 21 GLY OXT 1 1 9 2321 1 1 1 GLY C C -7.932 -3.448 1.352 1.00 . A A . 1 GLY C 1 1 9 2322 1 1 1 GLY CA C -8.361 -2.475 0.268 1.00 . A A . 1 GLY CA 1 1 9 2323 1 1 1 GLY H2 H -7.034 -1.018 -0.507 1.00 . A A . 1 GLY H2 1 1 9 2324 1 1 1 GLY HA2 H -8.863 -1.639 0.733 1.00 . A A . 1 GLY HA2 1 1 9 2325 1 1 1 GLY HA3 H -9.056 -2.975 -0.391 1.00 . A A . 1 GLY HA3 1 1 9 2326 1 1 1 GLY N N -7.246 -1.974 -0.518 1.00 . A A . 1 GLY N 1 1 9 2327 1 1 1 GLY O O -8.590 -4.459 1.583 1.00 . A A . 1 GLY O 1 1 9 2328 1 1 2 GLY C C -5.025 -3.488 3.641 1.00 . A A . 2 GLY C 1 1 9 2329 1 1 2 GLY CA C -6.331 -3.998 3.074 1.00 . A A . 2 GLY CA 1 1 9 2330 1 1 2 GLY H H -6.346 -2.321 1.793 1.00 . A A . 2 GLY H 1 1 9 2331 1 1 2 GLY HA2 H -7.066 -4.042 3.866 1.00 . A A . 2 GLY HA2 1 1 9 2332 1 1 2 GLY HA3 H -6.179 -4.991 2.678 1.00 . A A . 2 GLY HA3 1 1 9 2333 1 1 2 GLY N N -6.829 -3.139 2.018 1.00 . A A . 2 GLY N 1 1 9 2334 1 1 2 GLY O O -4.834 -2.277 3.764 1.00 . A A . 2 GLY O 1 1 9 2335 1 1 3 ALA C C -1.739 -5.015 4.103 1.00 . A A . 3 ALA C 1 1 9 2336 1 1 3 ALA CA C -2.817 -4.020 4.512 1.00 . A A . 3 ALA CA 1 1 9 2337 1 1 3 ALA CB C -2.896 -3.908 6.029 1.00 . A A . 3 ALA CB 1 1 9 2338 1 1 3 ALA H H -4.317 -5.349 3.827 1.00 . A A . 3 ALA H 1 1 9 2339 1 1 3 ALA HA H -2.564 -3.048 4.116 1.00 . A A . 3 ALA HA 1 1 9 2340 1 1 3 ALA HB1 H -2.775 -2.875 6.321 1.00 . A A . 3 ALA HB1 1 1 9 2341 1 1 3 ALA HB2 H -2.114 -4.503 6.475 1.00 . A A . 3 ALA HB2 1 1 9 2342 1 1 3 ALA HB3 H -3.858 -4.266 6.367 1.00 . A A . 3 ALA HB3 1 1 9 2343 1 1 3 ALA N N -4.115 -4.398 3.965 1.00 . A A . 3 ALA N 1 1 9 2344 1 1 3 ALA O O -0.936 -5.456 4.924 1.00 . A A . 3 ALA O 1 1 9 2345 1 1 4 GLY C C 0.578 -5.643 1.990 1.00 . A A . 4 GLY C 1 1 9 2346 1 1 4 GLY CA C -0.757 -6.297 2.302 1.00 . A A . 4 GLY CA 1 1 9 2347 1 1 4 GLY H H -2.403 -4.977 2.224 1.00 . A A . 4 GLY H 1 1 9 2348 1 1 4 GLY HA2 H -0.599 -7.079 3.030 1.00 . A A . 4 GLY HA2 1 1 9 2349 1 1 4 GLY HA3 H -1.148 -6.738 1.397 1.00 . A A . 4 GLY HA3 1 1 9 2350 1 1 4 GLY N N -1.733 -5.361 2.825 1.00 . A A . 4 GLY N 1 1 9 2351 1 1 4 GLY O O 1.177 -4.993 2.846 1.00 . A A . 4 GLY O 1 1 9 2352 1 1 5 HIS C C 2.207 -4.222 -0.717 1.00 . A A . 5 HIS C 1 1 9 2353 1 1 5 HIS CA C 2.356 -5.278 0.376 1.00 . A A . 5 HIS CA 1 1 9 2354 1 1 5 HIS CB C 3.300 -6.386 -0.107 1.00 . A A . 5 HIS CB 1 1 9 2355 1 1 5 HIS CD2 C 3.081 -8.925 0.356 1.00 . A A . 5 HIS CD2 1 1 9 2356 1 1 5 HIS CE1 C 3.208 -8.873 2.537 1.00 . A A . 5 HIS CE1 1 1 9 2357 1 1 5 HIS CG C 3.241 -7.634 0.721 1.00 . A A . 5 HIS CG 1 1 9 2358 1 1 5 HIS H H 0.559 -6.393 0.129 1.00 . A A . 5 HIS H 1 1 9 2359 1 1 5 HIS HA H 2.789 -4.812 1.248 1.00 . A A . 5 HIS HA 1 1 9 2360 1 1 5 HIS HB2 H 3.044 -6.650 -1.122 1.00 . A A . 5 HIS HB2 1 1 9 2361 1 1 5 HIS HB3 H 4.317 -6.018 -0.083 1.00 . A A . 5 HIS HB3 1 1 9 2362 1 1 5 HIS HD1 H 3.418 -6.841 2.665 1.00 . A A . 5 HIS HD1 1 1 9 2363 1 1 5 HIS HD2 H 2.989 -9.296 -0.654 1.00 . A A . 5 HIS HD2 1 1 9 2364 1 1 5 HIS HE1 H 3.232 -9.175 3.574 1.00 . A A . 5 HIS HE1 1 1 9 2365 1 1 5 HIS HE2 H 2.636 -10.566 1.562 1.00 . A A . 5 HIS HE2 1 1 9 2366 1 1 5 HIS N N 1.067 -5.837 0.772 1.00 . A A . 5 HIS N 1 1 9 2367 1 1 5 HIS ND1 N 3.319 -7.633 2.095 1.00 . A A . 5 HIS ND1 1 1 9 2368 1 1 5 HIS NE2 N 3.060 -9.681 1.503 1.00 . A A . 5 HIS NE2 1 1 9 2369 1 1 5 HIS O O 2.849 -3.176 -0.662 1.00 . A A . 5 HIS O 1 1 9 2370 1 1 6 VAL C C 0.039 -2.578 -2.482 1.00 . A A . 6 VAL C 1 1 9 2371 1 1 6 VAL CA C 1.171 -3.553 -2.809 1.00 . A A . 6 VAL CA 1 1 9 2372 1 1 6 VAL CB C 0.903 -4.290 -4.147 1.00 . A A . 6 VAL CB 1 1 9 2373 1 1 6 VAL CG1 C -0.157 -5.368 -3.980 1.00 . A A . 6 VAL CG1 1 1 9 2374 1 1 6 VAL CG2 C 0.505 -3.310 -5.243 1.00 . A A . 6 VAL CG2 1 1 9 2375 1 1 6 VAL H H 0.884 -5.347 -1.712 1.00 . A A . 6 VAL H 1 1 9 2376 1 1 6 VAL HA H 2.086 -2.986 -2.919 1.00 . A A . 6 VAL HA 1 1 9 2377 1 1 6 VAL HB H 1.821 -4.774 -4.450 1.00 . A A . 6 VAL HB 1 1 9 2378 1 1 6 VAL HG11 H -1.026 -5.111 -4.568 1.00 . A A . 6 VAL HG11 1 1 9 2379 1 1 6 VAL HG12 H -0.435 -5.441 -2.939 1.00 . A A . 6 VAL HG12 1 1 9 2380 1 1 6 VAL HG13 H 0.237 -6.315 -4.316 1.00 . A A . 6 VAL HG13 1 1 9 2381 1 1 6 VAL HG21 H 0.131 -2.401 -4.795 1.00 . A A . 6 VAL HG21 1 1 9 2382 1 1 6 VAL HG22 H -0.266 -3.752 -5.859 1.00 . A A . 6 VAL HG22 1 1 9 2383 1 1 6 VAL HG23 H 1.367 -3.083 -5.854 1.00 . A A . 6 VAL HG23 1 1 9 2384 1 1 6 VAL N N 1.372 -4.497 -1.712 1.00 . A A . 6 VAL N 1 1 9 2385 1 1 6 VAL O O -1.066 -2.989 -2.149 1.00 . A A . 6 VAL O 1 1 9 2386 1 1 7 PRO C C -1.942 -0.266 -3.038 1.00 . A A . 7 PRO C 1 1 9 2387 1 1 7 PRO CA C -0.650 -0.208 -2.222 1.00 . A A . 7 PRO CA 1 1 9 2388 1 1 7 PRO CB C 0.111 1.081 -2.548 1.00 . A A . 7 PRO CB 1 1 9 2389 1 1 7 PRO CD C 1.640 -0.710 -2.896 1.00 . A A . 7 PRO CD 1 1 9 2390 1 1 7 PRO CG C 1.547 0.714 -2.435 1.00 . A A . 7 PRO CG 1 1 9 2391 1 1 7 PRO HA H -0.899 -0.213 -1.172 1.00 . A A . 7 PRO HA 1 1 9 2392 1 1 7 PRO HB2 H -0.137 1.405 -3.549 1.00 . A A . 7 PRO HB2 1 1 9 2393 1 1 7 PRO HB3 H -0.157 1.849 -1.839 1.00 . A A . 7 PRO HB3 1 1 9 2394 1 1 7 PRO HD2 H 1.803 -0.751 -3.963 1.00 . A A . 7 PRO HD2 1 1 9 2395 1 1 7 PRO HD3 H 2.431 -1.227 -2.372 1.00 . A A . 7 PRO HD3 1 1 9 2396 1 1 7 PRO HG2 H 2.142 1.355 -3.068 1.00 . A A . 7 PRO HG2 1 1 9 2397 1 1 7 PRO HG3 H 1.869 0.797 -1.406 1.00 . A A . 7 PRO HG3 1 1 9 2398 1 1 7 PRO N N 0.323 -1.268 -2.543 1.00 . A A . 7 PRO N 1 1 9 2399 1 1 7 PRO O O -1.924 -0.500 -4.246 1.00 . A A . 7 PRO O 1 1 9 2400 1 1 8 GLU C C -4.806 1.415 -3.297 1.00 . A A . 8 GLU C 1 1 9 2401 1 1 8 GLU CA C -4.373 -0.013 -2.988 1.00 . A A . 8 GLU CA 1 1 9 2402 1 1 8 GLU CB C -5.423 -0.664 -2.083 1.00 . A A . 8 GLU CB 1 1 9 2403 1 1 8 GLU CD C -6.506 -2.795 -1.261 1.00 . A A . 8 GLU CD 1 1 9 2404 1 1 8 GLU CG C -5.365 -2.177 -2.049 1.00 . A A . 8 GLU CG 1 1 9 2405 1 1 8 GLU H H -2.993 0.175 -1.398 1.00 . A A . 8 GLU H 1 1 9 2406 1 1 8 GLU HA H -4.306 -0.568 -3.911 1.00 . A A . 8 GLU HA 1 1 9 2407 1 1 8 GLU HB2 H -5.285 -0.301 -1.076 1.00 . A A . 8 GLU HB2 1 1 9 2408 1 1 8 GLU HB3 H -6.405 -0.372 -2.427 1.00 . A A . 8 GLU HB3 1 1 9 2409 1 1 8 GLU HG2 H -5.409 -2.549 -3.063 1.00 . A A . 8 GLU HG2 1 1 9 2410 1 1 8 GLU HG3 H -4.431 -2.478 -1.597 1.00 . A A . 8 GLU HG3 1 1 9 2411 1 1 8 GLU N N -3.061 -0.024 -2.357 1.00 . A A . 8 GLU N 1 1 9 2412 1 1 8 GLU O O -4.828 1.837 -4.450 1.00 . A A . 8 GLU O 1 1 9 2413 1 1 8 GLU OE1 O -6.698 -4.024 -1.338 1.00 . A A . 8 GLU OE1 1 1 9 2414 1 1 9 TYR C C -4.692 4.493 -1.669 1.00 . A A . 9 TYR C 1 1 9 2415 1 1 9 TYR CA C -5.610 3.531 -2.410 1.00 . A A . 9 TYR CA 1 1 9 2416 1 1 9 TYR CB C -7.047 3.709 -1.904 1.00 . A A . 9 TYR CB 1 1 9 2417 1 1 9 TYR CD1 C -8.184 1.490 -2.337 1.00 . A A . 9 TYR CD1 1 1 9 2418 1 1 9 TYR CD2 C -8.936 3.398 -3.551 1.00 . A A . 9 TYR CD2 1 1 9 2419 1 1 9 TYR CE1 C -9.125 0.707 -2.979 1.00 . A A . 9 TYR CE1 1 1 9 2420 1 1 9 TYR CE2 C -9.880 2.622 -4.195 1.00 . A A . 9 TYR CE2 1 1 9 2421 1 1 9 TYR CG C -8.072 2.848 -2.614 1.00 . A A . 9 TYR CG 1 1 9 2422 1 1 9 TYR CZ C -9.969 1.277 -3.907 1.00 . A A . 9 TYR CZ 1 1 9 2423 1 1 9 TYR H H -5.136 1.761 -1.351 1.00 . A A . 9 TYR H 1 1 9 2424 1 1 9 TYR HA H -5.581 3.767 -3.463 1.00 . A A . 9 TYR HA 1 1 9 2425 1 1 9 TYR HB2 H -7.079 3.464 -0.855 1.00 . A A . 9 TYR HB2 1 1 9 2426 1 1 9 TYR HB3 H -7.336 4.741 -2.032 1.00 . A A . 9 TYR HB3 1 1 9 2427 1 1 9 TYR HD1 H -7.521 1.045 -1.611 1.00 . A A . 9 TYR HD1 1 1 9 2428 1 1 9 TYR HD2 H -8.863 4.452 -3.778 1.00 . A A . 9 TYR HD2 1 1 9 2429 1 1 9 TYR HE1 H -9.193 -0.347 -2.752 1.00 . A A . 9 TYR HE1 1 1 9 2430 1 1 9 TYR HE2 H -10.544 3.068 -4.921 1.00 . A A . 9 TYR HE2 1 1 9 2431 1 1 9 TYR HH H -10.587 0.265 -5.420 1.00 . A A . 9 TYR HH 1 1 9 2432 1 1 9 TYR N N -5.164 2.154 -2.251 1.00 . A A . 9 TYR N 1 1 9 2433 1 1 9 TYR O O -4.237 4.209 -0.556 1.00 . A A . 9 TYR O 1 1 9 2434 1 1 9 TYR OH O -10.907 0.498 -4.545 1.00 . A A . 9 TYR OH 1 1 9 2435 1 1 10 PHE C C -4.467 7.844 -1.306 1.00 . A A . 10 PHE C 1 1 9 2436 1 1 10 PHE CA C -3.596 6.665 -1.717 1.00 . A A . 10 PHE CA 1 1 9 2437 1 1 10 PHE CB C -2.537 7.144 -2.720 1.00 . A A . 10 PHE CB 1 1 9 2438 1 1 10 PHE CD1 C -2.384 5.233 -4.360 1.00 . A A . 10 PHE CD1 1 1 9 2439 1 1 10 PHE CD2 C -0.436 5.823 -3.118 1.00 . A A . 10 PHE CD2 1 1 9 2440 1 1 10 PHE CE1 C -1.677 4.230 -4.996 1.00 . A A . 10 PHE CE1 1 1 9 2441 1 1 10 PHE CE2 C 0.274 4.821 -3.750 1.00 . A A . 10 PHE CE2 1 1 9 2442 1 1 10 PHE CG C -1.771 6.042 -3.413 1.00 . A A . 10 PHE CG 1 1 9 2443 1 1 10 PHE CZ C -0.348 4.023 -4.690 1.00 . A A . 10 PHE CZ 1 1 9 2444 1 1 10 PHE H H -4.851 5.789 -3.168 1.00 . A A . 10 PHE H 1 1 9 2445 1 1 10 PHE HA H -3.109 6.259 -0.843 1.00 . A A . 10 PHE HA 1 1 9 2446 1 1 10 PHE HB2 H -3.021 7.737 -3.477 1.00 . A A . 10 PHE HB2 1 1 9 2447 1 1 10 PHE HB3 H -1.821 7.763 -2.199 1.00 . A A . 10 PHE HB3 1 1 9 2448 1 1 10 PHE HD1 H -3.424 5.392 -4.601 1.00 . A A . 10 PHE HD1 1 1 9 2449 1 1 10 PHE HD2 H 0.052 6.447 -2.384 1.00 . A A . 10 PHE HD2 1 1 9 2450 1 1 10 PHE HE1 H -2.167 3.606 -5.731 1.00 . A A . 10 PHE HE1 1 1 9 2451 1 1 10 PHE HE2 H 1.314 4.662 -3.510 1.00 . A A . 10 PHE HE2 1 1 9 2452 1 1 10 PHE HZ H 0.206 3.239 -5.185 1.00 . A A . 10 PHE HZ 1 1 9 2453 1 1 10 PHE N N -4.441 5.631 -2.293 1.00 . A A . 10 PHE N 1 1 9 2454 1 1 10 PHE O O -5.462 8.137 -1.967 1.00 . A A . 10 PHE O 1 1 9 2455 1 1 11 VAL C C -4.096 10.474 1.275 1.00 . A A . 11 VAL C 1 1 9 2456 1 1 11 VAL CA C -4.880 9.652 0.251 1.00 . A A . 11 VAL CA 1 1 9 2457 1 1 11 VAL CB C -6.235 9.199 0.855 1.00 . A A . 11 VAL CB 1 1 9 2458 1 1 11 VAL CG1 C -6.030 8.355 2.103 1.00 . A A . 11 VAL CG1 1 1 9 2459 1 1 11 VAL CG2 C -7.137 10.390 1.150 1.00 . A A . 11 VAL CG2 1 1 9 2460 1 1 11 VAL H H -3.300 8.233 0.270 1.00 . A A . 11 VAL H 1 1 9 2461 1 1 11 VAL HA H -5.090 10.281 -0.603 1.00 . A A . 11 VAL HA 1 1 9 2462 1 1 11 VAL HB H -6.730 8.585 0.120 1.00 . A A . 11 VAL HB 1 1 9 2463 1 1 11 VAL HG11 H -4.988 8.374 2.385 1.00 . A A . 11 VAL HG11 1 1 9 2464 1 1 11 VAL HG12 H -6.329 7.336 1.901 1.00 . A A . 11 VAL HG12 1 1 9 2465 1 1 11 VAL HG13 H -6.629 8.752 2.909 1.00 . A A . 11 VAL HG13 1 1 9 2466 1 1 11 VAL HG21 H -6.797 10.887 2.047 1.00 . A A . 11 VAL HG21 1 1 9 2467 1 1 11 VAL HG22 H -8.152 10.047 1.294 1.00 . A A . 11 VAL HG22 1 1 9 2468 1 1 11 VAL HG23 H -7.106 11.080 0.321 1.00 . A A . 11 VAL HG23 1 1 9 2469 1 1 11 VAL N N -4.104 8.514 -0.225 1.00 . A A . 11 VAL N 1 1 9 2470 1 1 11 VAL O O -3.235 9.954 1.985 1.00 . A A . 11 VAL O 1 1 9 2471 1 1 12 GLY C C -2.679 13.488 1.539 1.00 . A A . 12 GLY C 1 1 9 2472 1 1 12 GLY CA C -3.738 12.675 2.234 1.00 . A A . 12 GLY CA 1 1 9 2473 1 1 12 GLY H H -5.078 12.106 0.715 1.00 . A A . 12 GLY H 1 1 9 2474 1 1 12 GLY HA2 H -4.469 13.341 2.653 1.00 . A A . 12 GLY HA2 1 1 9 2475 1 1 12 GLY HA3 H -3.280 12.107 3.029 1.00 . A A . 12 GLY HA3 1 1 9 2476 1 1 12 GLY N N -4.398 11.763 1.321 1.00 . A A . 12 GLY N 1 1 9 2477 1 1 12 GLY O O -2.771 14.708 1.452 1.00 . A A . 12 GLY O 1 1 9 2478 1 1 13 ILE C C 0.040 12.366 -0.640 1.00 . A A . 13 ILE C 1 1 9 2479 1 1 13 ILE CA C -0.574 13.391 0.303 1.00 . A A . 13 ILE CA 1 1 9 2480 1 1 13 ILE CB C 0.535 13.921 1.251 1.00 . A A . 13 ILE CB 1 1 9 2481 1 1 13 ILE CD1 C 1.917 13.339 3.316 1.00 . A A . 13 ILE CD1 1 1 9 2482 1 1 13 ILE CG1 C 0.775 12.941 2.406 1.00 . A A . 13 ILE CG1 1 1 9 2483 1 1 13 ILE CG2 C 0.193 15.310 1.773 1.00 . A A . 13 ILE CG2 1 1 9 2484 1 1 13 ILE H H -1.722 11.816 1.135 1.00 . A A . 13 ILE H 1 1 9 2485 1 1 13 ILE HA H -0.957 14.219 -0.277 1.00 . A A . 13 ILE HA 1 1 9 2486 1 1 13 ILE HB H 1.446 14.005 0.675 1.00 . A A . 13 ILE HB 1 1 9 2487 1 1 13 ILE HD11 H 1.658 14.243 3.847 1.00 . A A . 13 ILE HD11 1 1 9 2488 1 1 13 ILE HD12 H 2.805 13.509 2.727 1.00 . A A . 13 ILE HD12 1 1 9 2489 1 1 13 ILE HD13 H 2.104 12.547 4.027 1.00 . A A . 13 ILE HD13 1 1 9 2490 1 1 13 ILE HG12 H -0.120 12.880 3.007 1.00 . A A . 13 ILE HG12 1 1 9 2491 1 1 13 ILE HG13 H 0.997 11.966 2.000 1.00 . A A . 13 ILE HG13 1 1 9 2492 1 1 13 ILE HG21 H -0.849 15.342 2.057 1.00 . A A . 13 ILE HG21 1 1 9 2493 1 1 13 ILE HG22 H 0.376 16.042 1.000 1.00 . A A . 13 ILE HG22 1 1 9 2494 1 1 13 ILE HG23 H 0.807 15.534 2.633 1.00 . A A . 13 ILE HG23 1 1 9 2495 1 1 13 ILE N N -1.692 12.787 1.028 1.00 . A A . 13 ILE N 1 1 9 2496 1 1 13 ILE O O 1.257 12.257 -0.757 1.00 . A A . 13 ILE O 1 1 9 2497 1 1 14 GLY C C 0.187 9.374 -1.477 1.00 . A A . 14 GLY C 1 1 9 2498 1 1 14 GLY CA C -0.364 10.576 -2.216 1.00 . A A . 14 GLY CA 1 1 9 2499 1 1 14 GLY H H -1.781 11.733 -1.155 1.00 . A A . 14 GLY H 1 1 9 2500 1 1 14 GLY HA2 H -1.191 10.262 -2.835 1.00 . A A . 14 GLY HA2 1 1 9 2501 1 1 14 GLY HA3 H 0.411 10.988 -2.844 1.00 . A A . 14 GLY HA3 1 1 9 2502 1 1 14 GLY N N -0.824 11.604 -1.299 1.00 . A A . 14 GLY N 1 1 9 2503 1 1 14 GLY O O 0.835 8.511 -2.064 1.00 . A A . 14 GLY O 1 1 9 2504 1 1 15 THR C C -0.652 7.113 0.697 1.00 . A A . 15 THR C 1 1 9 2505 1 1 15 THR CA C 0.374 8.238 0.662 1.00 . A A . 15 THR CA 1 1 9 2506 1 1 15 THR CB C 0.625 8.749 2.090 1.00 . A A . 15 THR CB 1 1 9 2507 1 1 15 THR CG2 C 2.011 9.365 2.211 1.00 . A A . 15 THR CG2 1 1 9 2508 1 1 15 THR H H -0.600 10.046 0.222 1.00 . A A . 15 THR H 1 1 9 2509 1 1 15 THR HA H 1.305 7.863 0.262 1.00 . A A . 15 THR HA 1 1 9 2510 1 1 15 THR HB H 0.555 7.914 2.773 1.00 . A A . 15 THR HB 1 1 9 2511 1 1 15 THR HG1 H -1.214 9.277 2.598 1.00 . A A . 15 THR HG1 1 1 9 2512 1 1 15 THR HG21 H 2.604 8.785 2.904 1.00 . A A . 15 THR HG21 1 1 9 2513 1 1 15 THR HG22 H 1.923 10.379 2.573 1.00 . A A . 15 THR HG22 1 1 9 2514 1 1 15 THR HG23 H 2.489 9.369 1.243 1.00 . A A . 15 THR HG23 1 1 9 2515 1 1 15 THR N N -0.080 9.325 -0.182 1.00 . A A . 15 THR N 1 1 9 2516 1 1 15 THR O O -1.838 7.355 0.928 1.00 . A A . 15 THR O 1 1 9 2517 1 1 15 THR OG1 O -0.374 9.722 2.434 1.00 . A A . 15 THR OG1 1 1 9 2518 1 1 16 PRO C C -1.529 4.326 1.881 1.00 . A A . 16 PRO C 1 1 9 2519 1 1 16 PRO CA C -1.112 4.717 0.469 1.00 . A A . 16 PRO CA 1 1 9 2520 1 1 16 PRO CB C -0.276 3.610 -0.166 1.00 . A A . 16 PRO CB 1 1 9 2521 1 1 16 PRO CD C 1.178 5.494 0.166 1.00 . A A . 16 PRO CD 1 1 9 2522 1 1 16 PRO CG C 1.140 3.990 0.102 1.00 . A A . 16 PRO CG 1 1 9 2523 1 1 16 PRO HA H -1.994 4.897 -0.130 1.00 . A A . 16 PRO HA 1 1 9 2524 1 1 16 PRO HB2 H -0.525 2.663 0.290 1.00 . A A . 16 PRO HB2 1 1 9 2525 1 1 16 PRO HB3 H -0.480 3.569 -1.226 1.00 . A A . 16 PRO HB3 1 1 9 2526 1 1 16 PRO HD2 H 1.839 5.820 0.957 1.00 . A A . 16 PRO HD2 1 1 9 2527 1 1 16 PRO HD3 H 1.494 5.902 -0.781 1.00 . A A . 16 PRO HD3 1 1 9 2528 1 1 16 PRO HG2 H 1.460 3.567 1.043 1.00 . A A . 16 PRO HG2 1 1 9 2529 1 1 16 PRO HG3 H 1.773 3.634 -0.700 1.00 . A A . 16 PRO HG3 1 1 9 2530 1 1 16 PRO N N -0.217 5.869 0.461 1.00 . A A . 16 PRO N 1 1 9 2531 1 1 16 PRO O O -0.690 4.037 2.732 1.00 . A A . 16 PRO O 1 1 9 2532 1 1 17 ILE C C -4.127 2.637 3.308 1.00 . A A . 17 ILE C 1 1 9 2533 1 1 17 ILE CA C -3.356 3.946 3.431 1.00 . A A . 17 ILE CA 1 1 9 2534 1 1 17 ILE CB C -4.263 5.062 4.017 1.00 . A A . 17 ILE CB 1 1 9 2535 1 1 17 ILE CD1 C -2.306 6.613 4.591 1.00 . A A . 17 ILE CD1 1 1 9 2536 1 1 17 ILE CG1 C -3.610 6.440 3.837 1.00 . A A . 17 ILE CG1 1 1 9 2537 1 1 17 ILE CG2 C -4.545 4.813 5.496 1.00 . A A . 17 ILE CG2 1 1 9 2538 1 1 17 ILE H H -3.452 4.543 1.399 1.00 . A A . 17 ILE H 1 1 9 2539 1 1 17 ILE HA H -2.517 3.796 4.094 1.00 . A A . 17 ILE HA 1 1 9 2540 1 1 17 ILE HB H -5.204 5.045 3.488 1.00 . A A . 17 ILE HB 1 1 9 2541 1 1 17 ILE HD11 H -2.472 6.430 5.643 1.00 . A A . 17 ILE HD11 1 1 9 2542 1 1 17 ILE HD12 H -1.940 7.619 4.453 1.00 . A A . 17 ILE HD12 1 1 9 2543 1 1 17 ILE HD13 H -1.578 5.910 4.216 1.00 . A A . 17 ILE HD13 1 1 9 2544 1 1 17 ILE HG12 H -3.406 6.598 2.788 1.00 . A A . 17 ILE HG12 1 1 9 2545 1 1 17 ILE HG13 H -4.295 7.202 4.181 1.00 . A A . 17 ILE HG13 1 1 9 2546 1 1 17 ILE HG21 H -5.020 3.851 5.615 1.00 . A A . 17 ILE HG21 1 1 9 2547 1 1 17 ILE HG22 H -5.196 5.587 5.873 1.00 . A A . 17 ILE HG22 1 1 9 2548 1 1 17 ILE HG23 H -3.616 4.825 6.046 1.00 . A A . 17 ILE HG23 1 1 9 2549 1 1 17 ILE N N -2.828 4.312 2.121 1.00 . A A . 17 ILE N 1 1 9 2550 1 1 17 ILE O O -5.161 2.424 3.939 1.00 . A A . 17 ILE O 1 1 9 2551 1 1 18 SER C C -3.338 -0.299 1.199 1.00 . A A . 18 SER C 1 1 9 2552 1 1 18 SER CA C -4.184 0.456 2.210 1.00 . A A . 18 SER CA 1 1 9 2553 1 1 18 SER CB C -5.616 0.592 1.684 1.00 . A A . 18 SER CB 1 1 9 2554 1 1 18 SER H H -2.772 2.008 1.998 1.00 . A A . 18 SER H 1 1 9 2555 1 1 18 SER HA H -4.197 -0.094 3.139 1.00 . A A . 18 SER HA 1 1 9 2556 1 1 18 SER HB2 H -5.970 -0.375 1.359 1.00 . A A . 18 SER HB2 1 1 9 2557 1 1 18 SER HB3 H -6.252 0.961 2.473 1.00 . A A . 18 SER HB3 1 1 9 2558 1 1 18 SER HG H -5.463 2.380 0.892 1.00 . A A . 18 SER HG 1 1 9 2559 1 1 18 SER N N -3.596 1.762 2.467 1.00 . A A . 18 SER N 1 1 9 2560 1 1 18 SER O O -2.724 0.311 0.323 1.00 . A A . 18 SER O 1 1 9 2561 1 1 18 SER OG O -5.677 1.491 0.586 1.00 . A A . 18 SER OG 1 1 9 2562 1 1 19 PHE C C -3.324 -3.724 0.105 1.00 . A A . 19 PHE C 1 1 9 2563 1 1 19 PHE CA C -2.537 -2.456 0.406 1.00 . A A . 19 PHE CA 1 1 9 2564 1 1 19 PHE CB C -1.166 -2.836 0.981 1.00 . A A . 19 PHE CB 1 1 9 2565 1 1 19 PHE CD1 C -0.689 -1.298 2.917 1.00 . A A . 19 PHE CD1 1 1 9 2566 1 1 19 PHE CD2 C 0.613 -1.065 0.936 1.00 . A A . 19 PHE CD2 1 1 9 2567 1 1 19 PHE CE1 C 0.018 -0.268 3.508 1.00 . A A . 19 PHE CE1 1 1 9 2568 1 1 19 PHE CE2 C 1.325 -0.036 1.520 1.00 . A A . 19 PHE CE2 1 1 9 2569 1 1 19 PHE CG C -0.403 -1.706 1.624 1.00 . A A . 19 PHE CG 1 1 9 2570 1 1 19 PHE CZ C 1.028 0.364 2.807 1.00 . A A . 19 PHE CZ 1 1 9 2571 1 1 19 PHE H H -3.820 -2.041 2.045 1.00 . A A . 19 PHE H 1 1 9 2572 1 1 19 PHE HA H -2.397 -1.904 -0.512 1.00 . A A . 19 PHE HA 1 1 9 2573 1 1 19 PHE HB2 H -1.303 -3.608 1.718 1.00 . A A . 19 PHE HB2 1 1 9 2574 1 1 19 PHE HB3 H -0.556 -3.229 0.181 1.00 . A A . 19 PHE HB3 1 1 9 2575 1 1 19 PHE HD1 H -1.478 -1.791 3.467 1.00 . A A . 19 PHE HD1 1 1 9 2576 1 1 19 PHE HD2 H 0.846 -1.373 -0.074 1.00 . A A . 19 PHE HD2 1 1 9 2577 1 1 19 PHE HE1 H -0.218 0.042 4.515 1.00 . A A . 19 PHE HE1 1 1 9 2578 1 1 19 PHE HE2 H 2.115 0.455 0.970 1.00 . A A . 19 PHE HE2 1 1 9 2579 1 1 19 PHE HZ H 1.582 1.168 3.266 1.00 . A A . 19 PHE HZ 1 1 9 2580 1 1 19 PHE N N -3.305 -1.616 1.321 1.00 . A A . 19 PHE N 1 1 9 2581 1 1 19 PHE O O -4.305 -4.013 0.778 1.00 . A A . 19 PHE O 1 1 9 2582 1 1 20 TYR C C -3.069 -6.864 -0.409 1.00 . A A . 20 TYR C 1 1 9 2583 1 1 20 TYR CA C -3.565 -5.712 -1.276 1.00 . A A . 20 TYR CA 1 1 9 2584 1 1 20 TYR CB C -3.344 -6.045 -2.759 1.00 . A A . 20 TYR CB 1 1 9 2585 1 1 20 TYR CD1 C -3.332 -3.927 -4.142 1.00 . A A . 20 TYR CD1 1 1 9 2586 1 1 20 TYR CD2 C -5.257 -5.329 -4.244 1.00 . A A . 20 TYR CD2 1 1 9 2587 1 1 20 TYR CE1 C -3.918 -3.049 -5.034 1.00 . A A . 20 TYR CE1 1 1 9 2588 1 1 20 TYR CE2 C -5.851 -4.455 -5.136 1.00 . A A . 20 TYR CE2 1 1 9 2589 1 1 20 TYR CG C -3.990 -5.081 -3.732 1.00 . A A . 20 TYR CG 1 1 9 2590 1 1 20 TYR CZ C -5.177 -3.317 -5.527 1.00 . A A . 20 TYR CZ 1 1 9 2591 1 1 20 TYR H H -2.092 -4.188 -1.390 1.00 . A A . 20 TYR H 1 1 9 2592 1 1 20 TYR HA H -4.623 -5.580 -1.099 1.00 . A A . 20 TYR HA 1 1 9 2593 1 1 20 TYR HB2 H -2.284 -6.050 -2.961 1.00 . A A . 20 TYR HB2 1 1 9 2594 1 1 20 TYR HB3 H -3.744 -7.030 -2.958 1.00 . A A . 20 TYR HB3 1 1 9 2595 1 1 20 TYR HD1 H -2.346 -3.718 -3.753 1.00 . A A . 20 TYR HD1 1 1 9 2596 1 1 20 TYR HD2 H -5.782 -6.220 -3.935 1.00 . A A . 20 TYR HD2 1 1 9 2597 1 1 20 TYR HE1 H -3.390 -2.159 -5.340 1.00 . A A . 20 TYR HE1 1 1 9 2598 1 1 20 TYR HE2 H -6.836 -4.666 -5.523 1.00 . A A . 20 TYR HE2 1 1 9 2599 1 1 20 TYR HH H -5.173 -1.704 -6.570 1.00 . A A . 20 TYR HH 1 1 9 2600 1 1 20 TYR N N -2.893 -4.472 -0.896 1.00 . A A . 20 TYR N 1 1 9 2601 1 1 20 TYR O O -3.277 -6.874 0.803 1.00 . A A . 20 TYR O 1 1 9 2602 1 1 20 TYR OH O -5.764 -2.447 -6.415 1.00 . A A . 20 TYR OH 1 1 9 2603 1 1 21 GLY C C -0.370 -8.787 -0.093 1.00 . A A . 21 GLY C 1 1 9 2604 1 1 21 GLY CA C -1.856 -8.949 -0.319 1.00 . A A . 21 GLY CA 1 1 9 2605 1 1 21 GLY H H -2.247 -7.746 -2.000 1.00 . A A . 21 GLY H 1 1 9 2606 1 1 21 GLY HA2 H -2.353 -9.032 0.637 1.00 . A A . 21 GLY HA2 1 1 9 2607 1 1 21 GLY HA3 H -2.029 -9.849 -0.888 1.00 . A A . 21 GLY HA3 1 1 9 2608 1 1 21 GLY N N -2.397 -7.819 -1.037 1.00 . A A . 21 GLY N 1 1 9 2609 1 1 21 GLY O O 0.223 -7.868 -0.709 1.00 . A A . 21 GLY O 1 1 9 2610 1 1 21 GLY OXT O 0.209 -9.557 0.696 1.00 . A A . 21 GLY OXT 1 1 10 2611 1 1 1 GLY C C -8.206 -3.645 1.507 1.00 . A A . 1 GLY C 1 1 10 2612 1 1 1 GLY CA C -8.670 -2.633 0.473 1.00 . A A . 1 GLY CA 1 1 10 2613 1 1 1 GLY H2 H -7.363 -1.128 -0.234 1.00 . A A . 1 GLY H2 1 1 10 2614 1 1 1 GLY HA2 H -9.176 -1.826 0.982 1.00 . A A . 1 GLY HA2 1 1 10 2615 1 1 1 GLY HA3 H -9.370 -3.115 -0.195 1.00 . A A . 1 GLY HA3 1 1 10 2616 1 1 1 GLY N N -7.582 -2.077 -0.314 1.00 . A A . 1 GLY N 1 1 10 2617 1 1 1 GLY O O -8.877 -4.647 1.742 1.00 . A A . 1 GLY O 1 1 10 2618 1 1 2 GLY C C -5.146 -3.908 3.572 1.00 . A A . 2 GLY C 1 1 10 2619 1 1 2 GLY CA C -6.546 -4.286 3.134 1.00 . A A . 2 GLY CA 1 1 10 2620 1 1 2 GLY H H -6.574 -2.570 1.905 1.00 . A A . 2 GLY H 1 1 10 2621 1 1 2 GLY HA2 H -7.199 -4.267 3.995 1.00 . A A . 2 GLY HA2 1 1 10 2622 1 1 2 GLY HA3 H -6.528 -5.287 2.730 1.00 . A A . 2 GLY HA3 1 1 10 2623 1 1 2 GLY N N -7.067 -3.381 2.128 1.00 . A A . 2 GLY N 1 1 10 2624 1 1 2 GLY O O -4.846 -2.728 3.758 1.00 . A A . 2 GLY O 1 1 10 2625 1 1 3 ALA C C -1.986 -5.686 3.425 1.00 . A A . 3 ALA C 1 1 10 2626 1 1 3 ALA CA C -2.900 -4.680 4.110 1.00 . A A . 3 ALA CA 1 1 10 2627 1 1 3 ALA CB C -2.761 -4.777 5.623 1.00 . A A . 3 ALA CB 1 1 10 2628 1 1 3 ALA H H -4.576 -5.821 3.523 1.00 . A A . 3 ALA H 1 1 10 2629 1 1 3 ALA HA H -2.619 -3.681 3.806 1.00 . A A . 3 ALA HA 1 1 10 2630 1 1 3 ALA HB1 H -2.088 -5.584 5.872 1.00 . A A . 3 ALA HB1 1 1 10 2631 1 1 3 ALA HB2 H -3.729 -4.966 6.062 1.00 . A A . 3 ALA HB2 1 1 10 2632 1 1 3 ALA HB3 H -2.366 -3.847 6.009 1.00 . A A . 3 ALA HB3 1 1 10 2633 1 1 3 ALA N N -4.281 -4.904 3.710 1.00 . A A . 3 ALA N 1 1 10 2634 1 1 3 ALA O O -2.342 -6.852 3.281 1.00 . A A . 3 ALA O 1 1 10 2635 1 1 4 GLY C C 1.298 -5.341 1.745 1.00 . A A . 4 GLY C 1 1 10 2636 1 1 4 GLY CA C 0.114 -6.098 2.314 1.00 . A A . 4 GLY CA 1 1 10 2637 1 1 4 GLY H H -0.593 -4.283 3.128 1.00 . A A . 4 GLY H 1 1 10 2638 1 1 4 GLY HA2 H 0.474 -6.837 3.012 1.00 . A A . 4 GLY HA2 1 1 10 2639 1 1 4 GLY HA3 H -0.400 -6.599 1.505 1.00 . A A . 4 GLY HA3 1 1 10 2640 1 1 4 GLY N N -0.821 -5.227 2.993 1.00 . A A . 4 GLY N 1 1 10 2641 1 1 4 GLY O O 1.964 -4.595 2.461 1.00 . A A . 4 GLY O 1 1 10 2642 1 1 5 HIS C C 2.238 -3.935 -1.284 1.00 . A A . 5 HIS C 1 1 10 2643 1 1 5 HIS CA C 2.705 -4.894 -0.194 1.00 . A A . 5 HIS CA 1 1 10 2644 1 1 5 HIS CB C 3.655 -5.931 -0.810 1.00 . A A . 5 HIS CB 1 1 10 2645 1 1 5 HIS CD2 C 3.773 -8.453 -0.234 1.00 . A A . 5 HIS CD2 1 1 10 2646 1 1 5 HIS CE1 C 4.370 -8.284 1.863 1.00 . A A . 5 HIS CE1 1 1 10 2647 1 1 5 HIS CG C 3.887 -7.137 0.049 1.00 . A A . 5 HIS CG 1 1 10 2648 1 1 5 HIS H H 1.016 -6.176 -0.059 1.00 . A A . 5 HIS H 1 1 10 2649 1 1 5 HIS HA H 3.241 -4.332 0.557 1.00 . A A . 5 HIS HA 1 1 10 2650 1 1 5 HIS HB2 H 3.243 -6.270 -1.748 1.00 . A A . 5 HIS HB2 1 1 10 2651 1 1 5 HIS HB3 H 4.611 -5.464 -0.993 1.00 . A A . 5 HIS HB3 1 1 10 2652 1 1 5 HIS HD1 H 4.416 -6.238 1.879 1.00 . A A . 5 HIS HD1 1 1 10 2653 1 1 5 HIS HD2 H 3.496 -8.880 -1.188 1.00 . A A . 5 HIS HD2 1 1 10 2654 1 1 5 HIS HE1 H 4.649 -8.533 2.876 1.00 . A A . 5 HIS HE1 1 1 10 2655 1 1 5 HIS HE2 H 3.795 -10.076 1.078 1.00 . A A . 5 HIS HE2 1 1 10 2656 1 1 5 HIS N N 1.577 -5.547 0.463 1.00 . A A . 5 HIS N 1 1 10 2657 1 1 5 HIS ND1 N 4.265 -7.064 1.372 1.00 . A A . 5 HIS ND1 1 1 10 2658 1 1 5 HIS NE2 N 4.076 -9.151 0.910 1.00 . A A . 5 HIS NE2 1 1 10 2659 1 1 5 HIS O O 2.794 -2.851 -1.439 1.00 . A A . 5 HIS O 1 1 10 2660 1 1 6 VAL C C -0.369 -2.567 -2.610 1.00 . A A . 6 VAL C 1 1 10 2661 1 1 6 VAL CA C 0.717 -3.498 -3.132 1.00 . A A . 6 VAL CA 1 1 10 2662 1 1 6 VAL CB C 0.152 -4.348 -4.290 1.00 . A A . 6 VAL CB 1 1 10 2663 1 1 6 VAL CG1 C -0.255 -3.464 -5.461 1.00 . A A . 6 VAL CG1 1 1 10 2664 1 1 6 VAL CG2 C 1.164 -5.394 -4.734 1.00 . A A . 6 VAL CG2 1 1 10 2665 1 1 6 VAL H H 0.819 -5.218 -1.892 1.00 . A A . 6 VAL H 1 1 10 2666 1 1 6 VAL HA H 1.538 -2.905 -3.511 1.00 . A A . 6 VAL HA 1 1 10 2667 1 1 6 VAL HB H -0.730 -4.860 -3.934 1.00 . A A . 6 VAL HB 1 1 10 2668 1 1 6 VAL HG11 H -1.318 -3.271 -5.415 1.00 . A A . 6 VAL HG11 1 1 10 2669 1 1 6 VAL HG12 H -0.021 -3.965 -6.389 1.00 . A A . 6 VAL HG12 1 1 10 2670 1 1 6 VAL HG13 H 0.282 -2.529 -5.411 1.00 . A A . 6 VAL HG13 1 1 10 2671 1 1 6 VAL HG21 H 0.711 -6.044 -5.468 1.00 . A A . 6 VAL HG21 1 1 10 2672 1 1 6 VAL HG22 H 1.476 -5.977 -3.881 1.00 . A A . 6 VAL HG22 1 1 10 2673 1 1 6 VAL HG23 H 2.022 -4.903 -5.168 1.00 . A A . 6 VAL HG23 1 1 10 2674 1 1 6 VAL N N 1.227 -4.338 -2.051 1.00 . A A . 6 VAL N 1 1 10 2675 1 1 6 VAL O O -1.408 -3.025 -2.160 1.00 . A A . 6 VAL O 1 1 10 2676 1 1 7 PRO C C -2.398 -0.191 -2.925 1.00 . A A . 7 PRO C 1 1 10 2677 1 1 7 PRO CA C -1.079 -0.244 -2.148 1.00 . A A . 7 PRO CA 1 1 10 2678 1 1 7 PRO CB C -0.318 1.075 -2.304 1.00 . A A . 7 PRO CB 1 1 10 2679 1 1 7 PRO CD C 1.110 -0.637 -3.151 1.00 . A A . 7 PRO CD 1 1 10 2680 1 1 7 PRO CG C 0.732 0.804 -3.325 1.00 . A A . 7 PRO CG 1 1 10 2681 1 1 7 PRO HA H -1.297 -0.404 -1.104 1.00 . A A . 7 PRO HA 1 1 10 2682 1 1 7 PRO HB2 H -0.998 1.847 -2.634 1.00 . A A . 7 PRO HB2 1 1 10 2683 1 1 7 PRO HB3 H 0.117 1.354 -1.356 1.00 . A A . 7 PRO HB3 1 1 10 2684 1 1 7 PRO HD2 H 1.396 -1.069 -4.100 1.00 . A A . 7 PRO HD2 1 1 10 2685 1 1 7 PRO HD3 H 1.910 -0.734 -2.433 1.00 . A A . 7 PRO HD3 1 1 10 2686 1 1 7 PRO HG2 H 0.333 0.971 -4.314 1.00 . A A . 7 PRO HG2 1 1 10 2687 1 1 7 PRO HG3 H 1.587 1.440 -3.149 1.00 . A A . 7 PRO HG3 1 1 10 2688 1 1 7 PRO N N -0.128 -1.251 -2.645 1.00 . A A . 7 PRO N 1 1 10 2689 1 1 7 PRO O O -2.420 -0.288 -4.151 1.00 . A A . 7 PRO O 1 1 10 2690 1 1 8 GLU C C -5.244 1.534 -2.929 1.00 . A A . 8 GLU C 1 1 10 2691 1 1 8 GLU CA C -4.825 0.074 -2.768 1.00 . A A . 8 GLU CA 1 1 10 2692 1 1 8 GLU CB C -5.856 -0.647 -1.892 1.00 . A A . 8 GLU CB 1 1 10 2693 1 1 8 GLU CD C -6.876 -2.839 -1.148 1.00 . A A . 8 GLU CD 1 1 10 2694 1 1 8 GLU CG C -5.762 -2.161 -1.929 1.00 . A A . 8 GLU CG 1 1 10 2695 1 1 8 GLU H H -3.394 0.064 -1.213 1.00 . A A . 8 GLU H 1 1 10 2696 1 1 8 GLU HA H -4.798 -0.394 -3.742 1.00 . A A . 8 GLU HA 1 1 10 2697 1 1 8 GLU HB2 H -5.722 -0.329 -0.870 1.00 . A A . 8 GLU HB2 1 1 10 2698 1 1 8 GLU HB3 H -6.846 -0.363 -2.218 1.00 . A A . 8 GLU HB3 1 1 10 2699 1 1 8 GLU HG2 H -5.816 -2.488 -2.957 1.00 . A A . 8 GLU HG2 1 1 10 2700 1 1 8 GLU HG3 H -4.814 -2.460 -1.508 1.00 . A A . 8 GLU HG3 1 1 10 2701 1 1 8 GLU N N -3.492 -0.018 -2.185 1.00 . A A . 8 GLU N 1 1 10 2702 1 1 8 GLU O O -5.265 2.070 -4.032 1.00 . A A . 8 GLU O 1 1 10 2703 1 1 8 GLU OE1 O -7.079 -4.057 -1.317 1.00 . A A . 8 GLU OE1 1 1 10 2704 1 1 9 TYR C C -4.909 4.459 -1.278 1.00 . A A . 9 TYR C 1 1 10 2705 1 1 9 TYR CA C -6.012 3.562 -1.819 1.00 . A A . 9 TYR CA 1 1 10 2706 1 1 9 TYR CB C -7.285 3.759 -0.986 1.00 . A A . 9 TYR CB 1 1 10 2707 1 1 9 TYR CD1 C -8.546 1.596 -1.365 1.00 . A A . 9 TYR CD1 1 1 10 2708 1 1 9 TYR CD2 C -9.565 3.633 -2.065 1.00 . A A . 9 TYR CD2 1 1 10 2709 1 1 9 TYR CE1 C -9.643 0.887 -1.816 1.00 . A A . 9 TYR CE1 1 1 10 2710 1 1 9 TYR CE2 C -10.665 2.931 -2.518 1.00 . A A . 9 TYR CE2 1 1 10 2711 1 1 9 TYR CG C -8.486 2.979 -1.481 1.00 . A A . 9 TYR CG 1 1 10 2712 1 1 9 TYR CZ C -10.698 1.559 -2.392 1.00 . A A . 9 TYR CZ 1 1 10 2713 1 1 9 TYR H H -5.552 1.685 -0.957 1.00 . A A . 9 TYR H 1 1 10 2714 1 1 9 TYR HA H -6.215 3.840 -2.842 1.00 . A A . 9 TYR HA 1 1 10 2715 1 1 9 TYR HB2 H -7.087 3.451 0.028 1.00 . A A . 9 TYR HB2 1 1 10 2716 1 1 9 TYR HB3 H -7.545 4.807 -0.992 1.00 . A A . 9 TYR HB3 1 1 10 2717 1 1 9 TYR HD1 H -7.717 1.071 -0.913 1.00 . A A . 9 TYR HD1 1 1 10 2718 1 1 9 TYR HD2 H -9.536 4.708 -2.164 1.00 . A A . 9 TYR HD2 1 1 10 2719 1 1 9 TYR HE1 H -9.669 -0.188 -1.716 1.00 . A A . 9 TYR HE1 1 1 10 2720 1 1 9 TYR HE2 H -11.493 3.458 -2.970 1.00 . A A . 9 TYR HE2 1 1 10 2721 1 1 9 TYR HH H -12.083 1.218 -3.681 1.00 . A A . 9 TYR HH 1 1 10 2722 1 1 9 TYR N N -5.585 2.168 -1.811 1.00 . A A . 9 TYR N 1 1 10 2723 1 1 9 TYR O O -4.202 4.089 -0.336 1.00 . A A . 9 TYR O 1 1 10 2724 1 1 9 TYR OH O -11.792 0.856 -2.841 1.00 . A A . 9 TYR OH 1 1 10 2725 1 1 10 PHE C C -4.415 7.894 -1.012 1.00 . A A . 10 PHE C 1 1 10 2726 1 1 10 PHE CA C -3.763 6.592 -1.452 1.00 . A A . 10 PHE CA 1 1 10 2727 1 1 10 PHE CB C -2.780 6.916 -2.586 1.00 . A A . 10 PHE CB 1 1 10 2728 1 1 10 PHE CD1 C -2.973 4.941 -4.139 1.00 . A A . 10 PHE CD1 1 1 10 2729 1 1 10 PHE CD2 C -0.853 5.411 -3.154 1.00 . A A . 10 PHE CD2 1 1 10 2730 1 1 10 PHE CE1 C -2.429 3.864 -4.809 1.00 . A A . 10 PHE CE1 1 1 10 2731 1 1 10 PHE CE2 C -0.302 4.338 -3.825 1.00 . A A . 10 PHE CE2 1 1 10 2732 1 1 10 PHE CG C -2.195 5.724 -3.300 1.00 . A A . 10 PHE CG 1 1 10 2733 1 1 10 PHE CZ C -1.091 3.564 -4.653 1.00 . A A . 10 PHE CZ 1 1 10 2734 1 1 10 PHE H H -5.375 5.869 -2.608 1.00 . A A . 10 PHE H 1 1 10 2735 1 1 10 PHE HA H -3.221 6.168 -0.621 1.00 . A A . 10 PHE HA 1 1 10 2736 1 1 10 PHE HB2 H -3.285 7.520 -3.317 1.00 . A A . 10 PHE HB2 1 1 10 2737 1 1 10 PHE HB3 H -1.959 7.486 -2.174 1.00 . A A . 10 PHE HB3 1 1 10 2738 1 1 10 PHE HD1 H -4.021 5.176 -4.261 1.00 . A A . 10 PHE HD1 1 1 10 2739 1 1 10 PHE HD2 H -0.237 6.013 -2.503 1.00 . A A . 10 PHE HD2 1 1 10 2740 1 1 10 PHE HE1 H -3.047 3.261 -5.456 1.00 . A A . 10 PHE HE1 1 1 10 2741 1 1 10 PHE HE2 H 0.745 4.104 -3.703 1.00 . A A . 10 PHE HE2 1 1 10 2742 1 1 10 PHE HZ H -0.661 2.723 -5.180 1.00 . A A . 10 PHE HZ 1 1 10 2743 1 1 10 PHE N N -4.774 5.635 -1.870 1.00 . A A . 10 PHE N 1 1 10 2744 1 1 10 PHE O O -5.389 8.347 -1.611 1.00 . A A . 10 PHE O 1 1 10 2745 1 1 11 VAL C C -3.718 10.895 -0.315 1.00 . A A . 11 VAL C 1 1 10 2746 1 1 11 VAL CA C -4.333 9.775 0.518 1.00 . A A . 11 VAL CA 1 1 10 2747 1 1 11 VAL CB C -3.975 9.978 2.010 1.00 . A A . 11 VAL CB 1 1 10 2748 1 1 11 VAL CG1 C -4.601 11.251 2.562 1.00 . A A . 11 VAL CG1 1 1 10 2749 1 1 11 VAL CG2 C -4.413 8.781 2.833 1.00 . A A . 11 VAL CG2 1 1 10 2750 1 1 11 VAL H H -3.055 8.096 0.423 1.00 . A A . 11 VAL H 1 1 10 2751 1 1 11 VAL HA H -5.409 9.799 0.408 1.00 . A A . 11 VAL HA 1 1 10 2752 1 1 11 VAL HB H -2.902 10.068 2.092 1.00 . A A . 11 VAL HB 1 1 10 2753 1 1 11 VAL HG11 H -3.839 12.007 2.674 1.00 . A A . 11 VAL HG11 1 1 10 2754 1 1 11 VAL HG12 H -5.048 11.044 3.524 1.00 . A A . 11 VAL HG12 1 1 10 2755 1 1 11 VAL HG13 H -5.361 11.604 1.880 1.00 . A A . 11 VAL HG13 1 1 10 2756 1 1 11 VAL HG21 H -5.393 8.965 3.245 1.00 . A A . 11 VAL HG21 1 1 10 2757 1 1 11 VAL HG22 H -3.710 8.618 3.637 1.00 . A A . 11 VAL HG22 1 1 10 2758 1 1 11 VAL HG23 H -4.445 7.904 2.203 1.00 . A A . 11 VAL HG23 1 1 10 2759 1 1 11 VAL N N -3.849 8.503 0.012 1.00 . A A . 11 VAL N 1 1 10 2760 1 1 11 VAL O O -2.643 10.714 -0.891 1.00 . A A . 11 VAL O 1 1 10 2761 1 1 12 GLY C C -2.491 13.569 -0.825 1.00 . A A . 12 GLY C 1 1 10 2762 1 1 12 GLY CA C -3.914 13.167 -1.162 1.00 . A A . 12 GLY CA 1 1 10 2763 1 1 12 GLY H H -5.255 12.106 0.085 1.00 . A A . 12 GLY H 1 1 10 2764 1 1 12 GLY HA2 H -3.957 12.908 -2.204 1.00 . A A . 12 GLY HA2 1 1 10 2765 1 1 12 GLY HA3 H -4.565 14.011 -0.988 1.00 . A A . 12 GLY HA3 1 1 10 2766 1 1 12 GLY N N -4.401 12.034 -0.387 1.00 . A A . 12 GLY N 1 1 10 2767 1 1 12 GLY O O -1.777 14.102 -1.670 1.00 . A A . 12 GLY O 1 1 10 2768 1 1 13 ILE C C 0.305 12.584 0.440 1.00 . A A . 13 ILE C 1 1 10 2769 1 1 13 ILE CA C -0.720 13.649 0.845 1.00 . A A . 13 ILE CA 1 1 10 2770 1 1 13 ILE CB C -0.659 13.881 2.370 1.00 . A A . 13 ILE CB 1 1 10 2771 1 1 13 ILE CD1 C -1.157 12.808 4.632 1.00 . A A . 13 ILE CD1 1 1 10 2772 1 1 13 ILE CG1 C -1.256 12.691 3.125 1.00 . A A . 13 ILE CG1 1 1 10 2773 1 1 13 ILE CG2 C -1.383 15.170 2.735 1.00 . A A . 13 ILE CG2 1 1 10 2774 1 1 13 ILE H H -2.686 12.876 1.028 1.00 . A A . 13 ILE H 1 1 10 2775 1 1 13 ILE HA H -0.451 14.573 0.358 1.00 . A A . 13 ILE HA 1 1 10 2776 1 1 13 ILE HB H 0.379 13.992 2.650 1.00 . A A . 13 ILE HB 1 1 10 2777 1 1 13 ILE HD11 H -0.834 13.805 4.894 1.00 . A A . 13 ILE HD11 1 1 10 2778 1 1 13 ILE HD12 H -0.441 12.090 5.003 1.00 . A A . 13 ILE HD12 1 1 10 2779 1 1 13 ILE HD13 H -2.123 12.615 5.074 1.00 . A A . 13 ILE HD13 1 1 10 2780 1 1 13 ILE HG12 H -2.302 12.601 2.870 1.00 . A A . 13 ILE HG12 1 1 10 2781 1 1 13 ILE HG13 H -0.740 11.789 2.828 1.00 . A A . 13 ILE HG13 1 1 10 2782 1 1 13 ILE HG21 H -2.352 15.185 2.259 1.00 . A A . 13 ILE HG21 1 1 10 2783 1 1 13 ILE HG22 H -0.804 16.017 2.397 1.00 . A A . 13 ILE HG22 1 1 10 2784 1 1 13 ILE HG23 H -1.507 15.223 3.807 1.00 . A A . 13 ILE HG23 1 1 10 2785 1 1 13 ILE N N -2.074 13.309 0.406 1.00 . A A . 13 ILE N 1 1 10 2786 1 1 13 ILE O O 1.308 12.384 1.122 1.00 . A A . 13 ILE O 1 1 10 2787 1 1 14 GLY C C 1.285 9.793 -0.276 1.00 . A A . 14 GLY C 1 1 10 2788 1 1 14 GLY CA C 0.955 10.931 -1.230 1.00 . A A . 14 GLY CA 1 1 10 2789 1 1 14 GLY H H -0.755 12.178 -1.195 1.00 . A A . 14 GLY H 1 1 10 2790 1 1 14 GLY HA2 H 0.507 10.509 -2.116 1.00 . A A . 14 GLY HA2 1 1 10 2791 1 1 14 GLY HA3 H 1.877 11.418 -1.516 1.00 . A A . 14 GLY HA3 1 1 10 2792 1 1 14 GLY N N 0.051 11.940 -0.693 1.00 . A A . 14 GLY N 1 1 10 2793 1 1 14 GLY O O 2.457 9.486 -0.062 1.00 . A A . 14 GLY O 1 1 10 2794 1 1 15 THR C C -0.634 7.021 1.153 1.00 . A A . 15 THR C 1 1 10 2795 1 1 15 THR CA C 0.517 8.032 1.194 1.00 . A A . 15 THR CA 1 1 10 2796 1 1 15 THR CB C 0.754 8.526 2.644 1.00 . A A . 15 THR CB 1 1 10 2797 1 1 15 THR CG2 C -0.461 9.256 3.197 1.00 . A A . 15 THR CG2 1 1 10 2798 1 1 15 THR H H -0.647 9.410 0.077 1.00 . A A . 15 THR H 1 1 10 2799 1 1 15 THR HA H 1.416 7.535 0.860 1.00 . A A . 15 THR HA 1 1 10 2800 1 1 15 THR HB H 1.589 9.212 2.635 1.00 . A A . 15 THR HB 1 1 10 2801 1 1 15 THR HG1 H 1.952 7.556 3.875 1.00 . A A . 15 THR HG1 1 1 10 2802 1 1 15 THR HG21 H -0.640 10.148 2.616 1.00 . A A . 15 THR HG21 1 1 10 2803 1 1 15 THR HG22 H -0.281 9.526 4.227 1.00 . A A . 15 THR HG22 1 1 10 2804 1 1 15 THR HG23 H -1.326 8.610 3.140 1.00 . A A . 15 THR HG23 1 1 10 2805 1 1 15 THR N N 0.273 9.146 0.285 1.00 . A A . 15 THR N 1 1 10 2806 1 1 15 THR O O -1.804 7.386 1.260 1.00 . A A . 15 THR O 1 1 10 2807 1 1 15 THR OG1 O 1.077 7.423 3.499 1.00 . A A . 15 THR OG1 1 1 10 2808 1 1 16 PRO C C -1.707 4.143 2.285 1.00 . A A . 16 PRO C 1 1 10 2809 1 1 16 PRO CA C -1.314 4.670 0.905 1.00 . A A . 16 PRO CA 1 1 10 2810 1 1 16 PRO CB C -0.599 3.588 0.099 1.00 . A A . 16 PRO CB 1 1 10 2811 1 1 16 PRO CD C 1.053 5.206 0.806 1.00 . A A . 16 PRO CD 1 1 10 2812 1 1 16 PRO CG C 0.852 3.761 0.414 1.00 . A A . 16 PRO CG 1 1 10 2813 1 1 16 PRO HA H -2.199 4.990 0.377 1.00 . A A . 16 PRO HA 1 1 10 2814 1 1 16 PRO HB2 H -0.958 2.616 0.404 1.00 . A A . 16 PRO HB2 1 1 10 2815 1 1 16 PRO HB3 H -0.793 3.734 -0.953 1.00 . A A . 16 PRO HB3 1 1 10 2816 1 1 16 PRO HD2 H 1.601 5.271 1.733 1.00 . A A . 16 PRO HD2 1 1 10 2817 1 1 16 PRO HD3 H 1.575 5.738 0.024 1.00 . A A . 16 PRO HD3 1 1 10 2818 1 1 16 PRO HG2 H 1.124 3.113 1.235 1.00 . A A . 16 PRO HG2 1 1 10 2819 1 1 16 PRO HG3 H 1.441 3.525 -0.458 1.00 . A A . 16 PRO HG3 1 1 10 2820 1 1 16 PRO N N -0.314 5.731 0.971 1.00 . A A . 16 PRO N 1 1 10 2821 1 1 16 PRO O O -0.849 3.811 3.102 1.00 . A A . 16 PRO O 1 1 10 2822 1 1 17 ILE C C -4.219 2.237 3.657 1.00 . A A . 17 ILE C 1 1 10 2823 1 1 17 ILE CA C -3.499 3.567 3.825 1.00 . A A . 17 ILE CA 1 1 10 2824 1 1 17 ILE CB C -4.437 4.580 4.535 1.00 . A A . 17 ILE CB 1 1 10 2825 1 1 17 ILE CD1 C -5.619 5.517 2.436 1.00 . A A . 17 ILE CD1 1 1 10 2826 1 1 17 ILE CG1 C -5.757 4.796 3.762 1.00 . A A . 17 ILE CG1 1 1 10 2827 1 1 17 ILE CG2 C -3.718 5.904 4.754 1.00 . A A . 17 ILE CG2 1 1 10 2828 1 1 17 ILE H H -3.647 4.333 1.850 1.00 . A A . 17 ILE H 1 1 10 2829 1 1 17 ILE HA H -2.639 3.405 4.454 1.00 . A A . 17 ILE HA 1 1 10 2830 1 1 17 ILE HB H -4.670 4.178 5.510 1.00 . A A . 17 ILE HB 1 1 10 2831 1 1 17 ILE HD11 H -5.242 6.514 2.606 1.00 . A A . 17 ILE HD11 1 1 10 2832 1 1 17 ILE HD12 H -6.583 5.574 1.954 1.00 . A A . 17 ILE HD12 1 1 10 2833 1 1 17 ILE HD13 H -4.931 4.976 1.803 1.00 . A A . 17 ILE HD13 1 1 10 2834 1 1 17 ILE HG12 H -6.204 3.835 3.563 1.00 . A A . 17 ILE HG12 1 1 10 2835 1 1 17 ILE HG13 H -6.432 5.372 4.381 1.00 . A A . 17 ILE HG13 1 1 10 2836 1 1 17 ILE HG21 H -3.290 5.923 5.746 1.00 . A A . 17 ILE HG21 1 1 10 2837 1 1 17 ILE HG22 H -4.422 6.718 4.651 1.00 . A A . 17 ILE HG22 1 1 10 2838 1 1 17 ILE HG23 H -2.932 6.013 4.022 1.00 . A A . 17 ILE HG23 1 1 10 2839 1 1 17 ILE N N -3.006 4.060 2.540 1.00 . A A . 17 ILE N 1 1 10 2840 1 1 17 ILE O O -5.171 1.927 4.373 1.00 . A A . 17 ILE O 1 1 10 2841 1 1 18 SER C C -3.512 -0.551 1.335 1.00 . A A . 18 SER C 1 1 10 2842 1 1 18 SER CA C -4.314 0.143 2.421 1.00 . A A . 18 SER CA 1 1 10 2843 1 1 18 SER CB C -5.776 0.277 1.983 1.00 . A A . 18 SER CB 1 1 10 2844 1 1 18 SER H H -2.973 1.759 2.186 1.00 . A A . 18 SER H 1 1 10 2845 1 1 18 SER HA H -4.267 -0.448 3.325 1.00 . A A . 18 SER HA 1 1 10 2846 1 1 18 SER HB2 H -6.127 -0.674 1.609 1.00 . A A . 18 SER HB2 1 1 10 2847 1 1 18 SER HB3 H -6.376 0.575 2.829 1.00 . A A . 18 SER HB3 1 1 10 2848 1 1 18 SER HG H -5.667 2.112 1.308 1.00 . A A . 18 SER HG 1 1 10 2849 1 1 18 SER N N -3.743 1.451 2.708 1.00 . A A . 18 SER N 1 1 10 2850 1 1 18 SER O O -2.930 0.108 0.473 1.00 . A A . 18 SER O 1 1 10 2851 1 1 18 SER OG O -5.914 1.249 0.957 1.00 . A A . 18 SER OG 1 1 10 2852 1 1 19 PHE C C -3.556 -3.909 0.036 1.00 . A A . 19 PHE C 1 1 10 2853 1 1 19 PHE CA C -2.755 -2.660 0.385 1.00 . A A . 19 PHE CA 1 1 10 2854 1 1 19 PHE CB C -1.367 -3.076 0.892 1.00 . A A . 19 PHE CB 1 1 10 2855 1 1 19 PHE CD1 C -0.771 -1.573 2.823 1.00 . A A . 19 PHE CD1 1 1 10 2856 1 1 19 PHE CD2 C 0.434 -1.329 0.781 1.00 . A A . 19 PHE CD2 1 1 10 2857 1 1 19 PHE CE1 C -0.022 -0.560 3.390 1.00 . A A . 19 PHE CE1 1 1 10 2858 1 1 19 PHE CE2 C 1.186 -0.314 1.342 1.00 . A A . 19 PHE CE2 1 1 10 2859 1 1 19 PHE CG C -0.552 -1.970 1.511 1.00 . A A . 19 PHE CG 1 1 10 2860 1 1 19 PHE CZ C 0.957 0.072 2.649 1.00 . A A . 19 PHE CZ 1 1 10 2861 1 1 19 PHE H H -3.969 -2.344 2.092 1.00 . A A . 19 PHE H 1 1 10 2862 1 1 19 PHE HA H -2.642 -2.056 -0.503 1.00 . A A . 19 PHE HA 1 1 10 2863 1 1 19 PHE HB2 H -1.486 -3.852 1.628 1.00 . A A . 19 PHE HB2 1 1 10 2864 1 1 19 PHE HB3 H -0.802 -3.473 0.060 1.00 . A A . 19 PHE HB3 1 1 10 2865 1 1 19 PHE HD1 H -1.536 -2.066 3.405 1.00 . A A . 19 PHE HD1 1 1 10 2866 1 1 19 PHE HD2 H 0.615 -1.628 -0.242 1.00 . A A . 19 PHE HD2 1 1 10 2867 1 1 19 PHE HE1 H -0.204 -0.261 4.412 1.00 . A A . 19 PHE HE1 1 1 10 2868 1 1 19 PHE HE2 H 1.951 0.178 0.760 1.00 . A A . 19 PHE HE2 1 1 10 2869 1 1 19 PHE HZ H 1.543 0.864 3.090 1.00 . A A . 19 PHE HZ 1 1 10 2870 1 1 19 PHE N N -3.482 -1.876 1.375 1.00 . A A . 19 PHE N 1 1 10 2871 1 1 19 PHE O O -4.575 -4.180 0.660 1.00 . A A . 19 PHE O 1 1 10 2872 1 1 20 TYR C C -3.249 -7.077 -0.614 1.00 . A A . 20 TYR C 1 1 10 2873 1 1 20 TYR CA C -3.792 -5.877 -1.373 1.00 . A A . 20 TYR CA 1 1 10 2874 1 1 20 TYR CB C -3.635 -6.125 -2.881 1.00 . A A . 20 TYR CB 1 1 10 2875 1 1 20 TYR CD1 C -3.633 -3.911 -4.100 1.00 . A A . 20 TYR CD1 1 1 10 2876 1 1 20 TYR CD2 C -5.562 -5.297 -4.284 1.00 . A A . 20 TYR CD2 1 1 10 2877 1 1 20 TYR CE1 C -4.225 -2.970 -4.921 1.00 . A A . 20 TYR CE1 1 1 10 2878 1 1 20 TYR CE2 C -6.160 -4.362 -5.109 1.00 . A A . 20 TYR CE2 1 1 10 2879 1 1 20 TYR CG C -4.291 -5.087 -3.765 1.00 . A A . 20 TYR CG 1 1 10 2880 1 1 20 TYR CZ C -5.488 -3.200 -5.423 1.00 . A A . 20 TYR CZ 1 1 10 2881 1 1 20 TYR H H -2.274 -4.391 -1.420 1.00 . A A . 20 TYR H 1 1 10 2882 1 1 20 TYR HA H -4.838 -5.762 -1.141 1.00 . A A . 20 TYR HA 1 1 10 2883 1 1 20 TYR HB2 H -2.584 -6.141 -3.122 1.00 . A A . 20 TYR HB2 1 1 10 2884 1 1 20 TYR HB3 H -4.066 -7.086 -3.122 1.00 . A A . 20 TYR HB3 1 1 10 2885 1 1 20 TYR HD1 H -2.643 -3.733 -3.706 1.00 . A A . 20 TYR HD1 1 1 10 2886 1 1 20 TYR HD2 H -6.088 -6.206 -4.035 1.00 . A A . 20 TYR HD2 1 1 10 2887 1 1 20 TYR HE1 H -3.697 -2.061 -5.166 1.00 . A A . 20 TYR HE1 1 1 10 2888 1 1 20 TYR HE2 H -7.149 -4.544 -5.501 1.00 . A A . 20 TYR HE2 1 1 10 2889 1 1 20 TYR HH H -5.524 -1.482 -6.282 1.00 . A A . 20 TYR HH 1 1 10 2890 1 1 20 TYR N N -3.100 -4.660 -0.958 1.00 . A A . 20 TYR N 1 1 10 2891 1 1 20 TYR O O -3.986 -7.801 0.050 1.00 . A A . 20 TYR O 1 1 10 2892 1 1 20 TYR OH O -6.079 -2.266 -6.239 1.00 . A A . 20 TYR OH 1 1 10 2893 1 1 21 GLY C C 0.207 -8.277 -0.312 1.00 . A A . 21 GLY C 1 1 10 2894 1 1 21 GLY CA C -1.279 -8.364 -0.078 1.00 . A A . 21 GLY CA 1 1 10 2895 1 1 21 GLY H H -1.428 -6.652 -1.282 1.00 . A A . 21 GLY H 1 1 10 2896 1 1 21 GLY HA2 H -1.480 -8.324 0.983 1.00 . A A . 21 GLY HA2 1 1 10 2897 1 1 21 GLY HA3 H -1.646 -9.298 -0.476 1.00 . A A . 21 GLY HA3 1 1 10 2898 1 1 21 GLY N N -1.950 -7.267 -0.732 1.00 . A A . 21 GLY N 1 1 10 2899 1 1 21 GLY O O 0.620 -7.403 -1.110 1.00 . A A . 21 GLY O 1 1 10 2900 1 1 21 GLY OXT O 0.967 -9.041 0.313 1.00 . A A . 21 GLY OXT 1 1 11 2901 1 1 1 GLY C C -7.937 -3.027 1.651 1.00 . A A . 1 GLY C 1 1 11 2902 1 1 1 GLY CA C -8.311 -2.062 0.537 1.00 . A A . 1 GLY CA 1 1 11 2903 1 1 1 GLY H2 H -6.986 -0.694 -0.394 1.00 . A A . 1 GLY H2 1 1 11 2904 1 1 1 GLY HA2 H -8.760 -1.184 0.978 1.00 . A A . 1 GLY HA2 1 1 11 2905 1 1 1 GLY HA3 H -9.039 -2.537 -0.104 1.00 . A A . 1 GLY HA3 1 1 11 2906 1 1 1 GLY N N -7.175 -1.649 -0.274 1.00 . A A . 1 GLY N 1 1 11 2907 1 1 1 GLY O O -8.642 -4.004 1.893 1.00 . A A . 1 GLY O 1 1 11 2908 1 1 2 GLY C C -5.010 -3.251 3.893 1.00 . A A . 2 GLY C 1 1 11 2909 1 1 2 GLY CA C -6.397 -3.613 3.410 1.00 . A A . 2 GLY CA 1 1 11 2910 1 1 2 GLY H H -6.310 -1.963 2.099 1.00 . A A . 2 GLY H 1 1 11 2911 1 1 2 GLY HA2 H -7.089 -3.522 4.235 1.00 . A A . 2 GLY HA2 1 1 11 2912 1 1 2 GLY HA3 H -6.391 -4.636 3.067 1.00 . A A . 2 GLY HA3 1 1 11 2913 1 1 2 GLY N N -6.833 -2.754 2.330 1.00 . A A . 2 GLY N 1 1 11 2914 1 1 2 GLY O O -4.650 -2.074 3.920 1.00 . A A . 2 GLY O 1 1 11 2915 1 1 3 ALA C C -1.927 -5.126 4.218 1.00 . A A . 3 ALA C 1 1 11 2916 1 1 3 ALA CA C -2.863 -4.035 4.725 1.00 . A A . 3 ALA CA 1 1 11 2917 1 1 3 ALA CB C -2.835 -3.966 6.246 1.00 . A A . 3 ALA CB 1 1 11 2918 1 1 3 ALA H H -4.562 -5.174 4.190 1.00 . A A . 3 ALA H 1 1 11 2919 1 1 3 ALA HA H -2.529 -3.082 4.337 1.00 . A A . 3 ALA HA 1 1 11 2920 1 1 3 ALA HB1 H -3.847 -3.990 6.625 1.00 . A A . 3 ALA HB1 1 1 11 2921 1 1 3 ALA HB2 H -2.356 -3.048 6.556 1.00 . A A . 3 ALA HB2 1 1 11 2922 1 1 3 ALA HB3 H -2.284 -4.808 6.634 1.00 . A A . 3 ALA HB3 1 1 11 2923 1 1 3 ALA N N -4.223 -4.257 4.252 1.00 . A A . 3 ALA N 1 1 11 2924 1 1 3 ALA O O -1.158 -5.707 4.979 1.00 . A A . 3 ALA O 1 1 11 2925 1 1 4 GLY C C 0.240 -5.907 2.043 1.00 . A A . 4 GLY C 1 1 11 2926 1 1 4 GLY CA C -1.171 -6.405 2.304 1.00 . A A . 4 GLY CA 1 1 11 2927 1 1 4 GLY H H -2.649 -4.893 2.372 1.00 . A A . 4 GLY H 1 1 11 2928 1 1 4 GLY HA2 H -1.123 -7.264 2.956 1.00 . A A . 4 GLY HA2 1 1 11 2929 1 1 4 GLY HA3 H -1.616 -6.702 1.365 1.00 . A A . 4 GLY HA3 1 1 11 2930 1 1 4 GLY N N -2.010 -5.393 2.921 1.00 . A A . 4 GLY N 1 1 11 2931 1 1 4 GLY O O 0.929 -5.454 2.955 1.00 . A A . 4 GLY O 1 1 11 2932 1 1 5 HIS C C 1.992 -4.478 -0.645 1.00 . A A . 5 HIS C 1 1 11 2933 1 1 5 HIS CA C 2.024 -5.557 0.435 1.00 . A A . 5 HIS CA 1 1 11 2934 1 1 5 HIS CB C 2.878 -6.740 -0.036 1.00 . A A . 5 HIS CB 1 1 11 2935 1 1 5 HIS CD2 C 4.142 -8.067 1.801 1.00 . A A . 5 HIS CD2 1 1 11 2936 1 1 5 HIS CE1 C 2.551 -9.479 2.329 1.00 . A A . 5 HIS CE1 1 1 11 2937 1 1 5 HIS CG C 3.077 -7.795 1.011 1.00 . A A . 5 HIS CG 1 1 11 2938 1 1 5 HIS H H 0.093 -6.375 0.103 1.00 . A A . 5 HIS H 1 1 11 2939 1 1 5 HIS HA H 2.476 -5.137 1.322 1.00 . A A . 5 HIS HA 1 1 11 2940 1 1 5 HIS HB2 H 2.399 -7.204 -0.885 1.00 . A A . 5 HIS HB2 1 1 11 2941 1 1 5 HIS HB3 H 3.850 -6.376 -0.332 1.00 . A A . 5 HIS HB3 1 1 11 2942 1 1 5 HIS HD1 H 1.199 -8.776 0.951 1.00 . A A . 5 HIS HD1 1 1 11 2943 1 1 5 HIS HD2 H 5.091 -7.551 1.794 1.00 . A A . 5 HIS HD2 1 1 11 2944 1 1 5 HIS HE1 H 2.002 -10.277 2.803 1.00 . A A . 5 HIS HE1 1 1 11 2945 1 1 5 HIS HE2 H 4.287 -9.410 3.404 1.00 . A A . 5 HIS HE2 1 1 11 2946 1 1 5 HIS N N 0.681 -5.997 0.794 1.00 . A A . 5 HIS N 1 1 11 2947 1 1 5 HIS ND1 N 2.102 -8.700 1.369 1.00 . A A . 5 HIS ND1 1 1 11 2948 1 1 5 HIS NE2 N 3.789 -9.118 2.614 1.00 . A A . 5 HIS NE2 1 1 11 2949 1 1 5 HIS O O 2.710 -3.484 -0.560 1.00 . A A . 5 HIS O 1 1 11 2950 1 1 6 VAL C C -0.012 -2.660 -2.417 1.00 . A A . 6 VAL C 1 1 11 2951 1 1 6 VAL CA C 1.047 -3.712 -2.748 1.00 . A A . 6 VAL CA 1 1 11 2952 1 1 6 VAL CB C 0.687 -4.410 -4.080 1.00 . A A . 6 VAL CB 1 1 11 2953 1 1 6 VAL CG1 C 0.731 -3.428 -5.242 1.00 . A A . 6 VAL CG1 1 1 11 2954 1 1 6 VAL CG2 C 1.616 -5.587 -4.337 1.00 . A A . 6 VAL CG2 1 1 11 2955 1 1 6 VAL H H 0.605 -5.487 -1.677 1.00 . A A . 6 VAL H 1 1 11 2956 1 1 6 VAL HA H 2.004 -3.223 -2.865 1.00 . A A . 6 VAL HA 1 1 11 2957 1 1 6 VAL HB H -0.322 -4.790 -4.000 1.00 . A A . 6 VAL HB 1 1 11 2958 1 1 6 VAL HG11 H 0.082 -3.777 -6.032 1.00 . A A . 6 VAL HG11 1 1 11 2959 1 1 6 VAL HG12 H 1.741 -3.354 -5.613 1.00 . A A . 6 VAL HG12 1 1 11 2960 1 1 6 VAL HG13 H 0.398 -2.458 -4.906 1.00 . A A . 6 VAL HG13 1 1 11 2961 1 1 6 VAL HG21 H 2.632 -5.232 -4.427 1.00 . A A . 6 VAL HG21 1 1 11 2962 1 1 6 VAL HG22 H 1.326 -6.082 -5.251 1.00 . A A . 6 VAL HG22 1 1 11 2963 1 1 6 VAL HG23 H 1.551 -6.284 -3.514 1.00 . A A . 6 VAL HG23 1 1 11 2964 1 1 6 VAL N N 1.161 -4.675 -1.659 1.00 . A A . 6 VAL N 1 1 11 2965 1 1 6 VAL O O -1.127 -3.002 -2.035 1.00 . A A . 6 VAL O 1 1 11 2966 1 1 7 PRO C C -1.877 -0.287 -3.039 1.00 . A A . 7 PRO C 1 1 11 2967 1 1 7 PRO CA C -0.581 -0.258 -2.228 1.00 . A A . 7 PRO CA 1 1 11 2968 1 1 7 PRO CB C 0.233 0.995 -2.578 1.00 . A A . 7 PRO CB 1 1 11 2969 1 1 7 PRO CD C 1.654 -0.882 -2.961 1.00 . A A . 7 PRO CD 1 1 11 2970 1 1 7 PRO CG C 1.362 0.512 -3.425 1.00 . A A . 7 PRO CG 1 1 11 2971 1 1 7 PRO HA H -0.827 -0.239 -1.177 1.00 . A A . 7 PRO HA 1 1 11 2972 1 1 7 PRO HB2 H -0.392 1.692 -3.117 1.00 . A A . 7 PRO HB2 1 1 11 2973 1 1 7 PRO HB3 H 0.593 1.456 -1.670 1.00 . A A . 7 PRO HB3 1 1 11 2974 1 1 7 PRO HD2 H 2.044 -1.478 -3.773 1.00 . A A . 7 PRO HD2 1 1 11 2975 1 1 7 PRO HD3 H 2.345 -0.870 -2.132 1.00 . A A . 7 PRO HD3 1 1 11 2976 1 1 7 PRO HG2 H 1.066 0.509 -4.463 1.00 . A A . 7 PRO HG2 1 1 11 2977 1 1 7 PRO HG3 H 2.225 1.145 -3.280 1.00 . A A . 7 PRO HG3 1 1 11 2978 1 1 7 PRO N N 0.334 -1.369 -2.536 1.00 . A A . 7 PRO N 1 1 11 2979 1 1 7 PRO O O -1.869 -0.521 -4.249 1.00 . A A . 7 PRO O 1 1 11 2980 1 1 8 GLU C C -4.664 1.409 -3.414 1.00 . A A . 8 GLU C 1 1 11 2981 1 1 8 GLU CA C -4.301 -0.009 -2.988 1.00 . A A . 8 GLU CA 1 1 11 2982 1 1 8 GLU CB C -5.375 -0.538 -2.035 1.00 . A A . 8 GLU CB 1 1 11 2983 1 1 8 GLU CD C -6.385 -2.542 -0.866 1.00 . A A . 8 GLU CD 1 1 11 2984 1 1 8 GLU CG C -5.228 -2.007 -1.693 1.00 . A A . 8 GLU CG 1 1 11 2985 1 1 8 GLU H H -2.922 0.154 -1.394 1.00 . A A . 8 GLU H 1 1 11 2986 1 1 8 GLU HA H -4.262 -0.639 -3.865 1.00 . A A . 8 GLU HA 1 1 11 2987 1 1 8 GLU HB2 H -5.332 0.028 -1.116 1.00 . A A . 8 GLU HB2 1 1 11 2988 1 1 8 GLU HB3 H -6.343 -0.393 -2.491 1.00 . A A . 8 GLU HB3 1 1 11 2989 1 1 8 GLU HG2 H -5.174 -2.573 -2.611 1.00 . A A . 8 GLU HG2 1 1 11 2990 1 1 8 GLU HG3 H -4.314 -2.142 -1.134 1.00 . A A . 8 GLU HG3 1 1 11 2991 1 1 8 GLU N N -2.990 -0.032 -2.355 1.00 . A A . 8 GLU N 1 1 11 2992 1 1 8 GLU O O -4.646 1.741 -4.596 1.00 . A A . 8 GLU O 1 1 11 2993 1 1 8 GLU OE1 O -6.537 -3.775 -0.772 1.00 . A A . 8 GLU OE1 1 1 11 2994 1 1 9 TYR C C -4.509 4.589 -1.923 1.00 . A A . 9 TYR C 1 1 11 2995 1 1 9 TYR CA C -5.378 3.623 -2.711 1.00 . A A . 9 TYR CA 1 1 11 2996 1 1 9 TYR CB C -6.852 3.877 -2.374 1.00 . A A . 9 TYR CB 1 1 11 2997 1 1 9 TYR CD1 C -8.025 1.716 -2.990 1.00 . A A . 9 TYR CD1 1 1 11 2998 1 1 9 TYR CD2 C -8.572 3.688 -4.214 1.00 . A A . 9 TYR CD2 1 1 11 2999 1 1 9 TYR CE1 C -8.918 0.990 -3.752 1.00 . A A . 9 TYR CE1 1 1 11 3000 1 1 9 TYR CE2 C -9.469 2.967 -4.980 1.00 . A A . 9 TYR CE2 1 1 11 3001 1 1 9 TYR CG C -7.835 3.077 -3.207 1.00 . A A . 9 TYR CG 1 1 11 3002 1 1 9 TYR CZ C -9.638 1.620 -4.746 1.00 . A A . 9 TYR CZ 1 1 11 3003 1 1 9 TYR H H -5.004 1.921 -1.509 1.00 . A A . 9 TYR H 1 1 11 3004 1 1 9 TYR HA H -5.227 3.802 -3.765 1.00 . A A . 9 TYR HA 1 1 11 3005 1 1 9 TYR HB2 H -7.020 3.628 -1.339 1.00 . A A . 9 TYR HB2 1 1 11 3006 1 1 9 TYR HB3 H -7.069 4.924 -2.523 1.00 . A A . 9 TYR HB3 1 1 11 3007 1 1 9 TYR HD1 H -7.460 1.226 -2.212 1.00 . A A . 9 TYR HD1 1 1 11 3008 1 1 9 TYR HD2 H -8.435 4.743 -4.397 1.00 . A A . 9 TYR HD2 1 1 11 3009 1 1 9 TYR HE1 H -9.052 -0.066 -3.568 1.00 . A A . 9 TYR HE1 1 1 11 3010 1 1 9 TYR HE2 H -10.031 3.460 -5.759 1.00 . A A . 9 TYR HE2 1 1 11 3011 1 1 9 TYR HH H -10.497 1.205 -6.415 1.00 . A A . 9 TYR HH 1 1 11 3012 1 1 9 TYR N N -5.002 2.243 -2.437 1.00 . A A . 9 TYR N 1 1 11 3013 1 1 9 TYR O O -4.162 4.333 -0.763 1.00 . A A . 9 TYR O 1 1 11 3014 1 1 9 TYR OH O -10.530 0.900 -5.506 1.00 . A A . 9 TYR OH 1 1 11 3015 1 1 10 PHE C C -4.219 7.929 -1.608 1.00 . A A . 10 PHE C 1 1 11 3016 1 1 10 PHE CA C -3.350 6.725 -1.936 1.00 . A A . 10 PHE CA 1 1 11 3017 1 1 10 PHE CB C -2.211 7.175 -2.858 1.00 . A A . 10 PHE CB 1 1 11 3018 1 1 10 PHE CD1 C -2.063 5.307 -4.549 1.00 . A A . 10 PHE CD1 1 1 11 3019 1 1 10 PHE CD2 C -0.156 5.769 -3.196 1.00 . A A . 10 PHE CD2 1 1 11 3020 1 1 10 PHE CE1 C -1.374 4.289 -5.180 1.00 . A A . 10 PHE CE1 1 1 11 3021 1 1 10 PHE CE2 C 0.538 4.754 -3.824 1.00 . A A . 10 PHE CE2 1 1 11 3022 1 1 10 PHE CG C -1.464 6.059 -3.548 1.00 . A A . 10 PHE CG 1 1 11 3023 1 1 10 PHE CZ C -0.070 4.012 -4.817 1.00 . A A . 10 PHE CZ 1 1 11 3024 1 1 10 PHE H H -4.490 5.836 -3.471 1.00 . A A . 10 PHE H 1 1 11 3025 1 1 10 PHE HA H -2.938 6.324 -1.022 1.00 . A A . 10 PHE HA 1 1 11 3026 1 1 10 PHE HB2 H -2.618 7.819 -3.614 1.00 . A A . 10 PHE HB2 1 1 11 3027 1 1 10 PHE HB3 H -1.496 7.735 -2.272 1.00 . A A . 10 PHE HB3 1 1 11 3028 1 1 10 PHE HD1 H -3.083 5.521 -4.834 1.00 . A A . 10 PHE HD1 1 1 11 3029 1 1 10 PHE HD2 H 0.322 6.348 -2.420 1.00 . A A . 10 PHE HD2 1 1 11 3030 1 1 10 PHE HE1 H -1.853 3.712 -5.957 1.00 . A A . 10 PHE HE1 1 1 11 3031 1 1 10 PHE HE2 H 1.557 4.539 -3.538 1.00 . A A . 10 PHE HE2 1 1 11 3032 1 1 10 PHE HZ H 0.471 3.219 -5.310 1.00 . A A . 10 PHE HZ 1 1 11 3033 1 1 10 PHE N N -4.168 5.697 -2.557 1.00 . A A . 10 PHE N 1 1 11 3034 1 1 10 PHE O O -5.045 8.340 -2.420 1.00 . A A . 10 PHE O 1 1 11 3035 1 1 11 VAL C C -3.986 10.464 1.036 1.00 . A A . 11 VAL C 1 1 11 3036 1 1 11 VAL CA C -4.786 9.657 0.021 1.00 . A A . 11 VAL CA 1 1 11 3037 1 1 11 VAL CB C -6.144 9.271 0.672 1.00 . A A . 11 VAL CB 1 1 11 3038 1 1 11 VAL CG1 C -7.182 8.901 -0.378 1.00 . A A . 11 VAL CG1 1 1 11 3039 1 1 11 VAL CG2 C -5.961 8.132 1.665 1.00 . A A . 11 VAL CG2 1 1 11 3040 1 1 11 VAL H H -3.336 8.114 0.164 1.00 . A A . 11 VAL H 1 1 11 3041 1 1 11 VAL HA H -4.986 10.277 -0.841 1.00 . A A . 11 VAL HA 1 1 11 3042 1 1 11 VAL HB H -6.511 10.130 1.213 1.00 . A A . 11 VAL HB 1 1 11 3043 1 1 11 VAL HG11 H -7.823 9.748 -0.564 1.00 . A A . 11 VAL HG11 1 1 11 3044 1 1 11 VAL HG12 H -7.776 8.071 -0.019 1.00 . A A . 11 VAL HG12 1 1 11 3045 1 1 11 VAL HG13 H -6.684 8.617 -1.293 1.00 . A A . 11 VAL HG13 1 1 11 3046 1 1 11 VAL HG21 H -4.944 7.775 1.620 1.00 . A A . 11 VAL HG21 1 1 11 3047 1 1 11 VAL HG22 H -6.639 7.327 1.417 1.00 . A A . 11 VAL HG22 1 1 11 3048 1 1 11 VAL HG23 H -6.175 8.488 2.662 1.00 . A A . 11 VAL HG23 1 1 11 3049 1 1 11 VAL N N -4.025 8.490 -0.427 1.00 . A A . 11 VAL N 1 1 11 3050 1 1 11 VAL O O -2.840 10.131 1.334 1.00 . A A . 11 VAL O 1 1 11 3051 1 1 12 GLY C C -2.922 13.305 1.929 1.00 . A A . 12 GLY C 1 1 11 3052 1 1 12 GLY CA C -3.955 12.384 2.537 1.00 . A A . 12 GLY CA 1 1 11 3053 1 1 12 GLY H H -5.502 11.729 1.264 1.00 . A A . 12 GLY H 1 1 11 3054 1 1 12 GLY HA2 H -4.707 12.980 3.017 1.00 . A A . 12 GLY HA2 1 1 11 3055 1 1 12 GLY HA3 H -3.475 11.765 3.281 1.00 . A A . 12 GLY HA3 1 1 11 3056 1 1 12 GLY N N -4.598 11.523 1.555 1.00 . A A . 12 GLY N 1 1 11 3057 1 1 12 GLY O O -2.937 14.511 2.157 1.00 . A A . 12 GLY O 1 1 11 3058 1 1 13 ILE C C -0.263 12.523 -0.509 1.00 . A A . 13 ILE C 1 1 11 3059 1 1 13 ILE CA C -0.971 13.451 0.488 1.00 . A A . 13 ILE CA 1 1 11 3060 1 1 13 ILE CB C 0.032 14.042 1.522 1.00 . A A . 13 ILE CB 1 1 11 3061 1 1 13 ILE CD1 C 0.365 16.215 0.228 1.00 . A A . 13 ILE CD1 1 1 11 3062 1 1 13 ILE CG1 C 1.023 15.003 0.851 1.00 . A A . 13 ILE CG1 1 1 11 3063 1 1 13 ILE CG2 C 0.773 12.936 2.267 1.00 . A A . 13 ILE CG2 1 1 11 3064 1 1 13 ILE H H -2.113 11.750 1.030 1.00 . A A . 13 ILE H 1 1 11 3065 1 1 13 ILE HA H -1.421 14.269 -0.058 1.00 . A A . 13 ILE HA 1 1 11 3066 1 1 13 ILE HB H -0.541 14.594 2.252 1.00 . A A . 13 ILE HB 1 1 11 3067 1 1 13 ILE HD11 H -0.142 15.924 -0.679 1.00 . A A . 13 ILE HD11 1 1 11 3068 1 1 13 ILE HD12 H 1.118 16.955 -0.002 1.00 . A A . 13 ILE HD12 1 1 11 3069 1 1 13 ILE HD13 H -0.350 16.634 0.921 1.00 . A A . 13 ILE HD13 1 1 11 3070 1 1 13 ILE HG12 H 1.730 15.353 1.587 1.00 . A A . 13 ILE HG12 1 1 11 3071 1 1 13 ILE HG13 H 1.553 14.475 0.072 1.00 . A A . 13 ILE HG13 1 1 11 3072 1 1 13 ILE HG21 H 1.822 13.187 2.333 1.00 . A A . 13 ILE HG21 1 1 11 3073 1 1 13 ILE HG22 H 0.659 12.003 1.733 1.00 . A A . 13 ILE HG22 1 1 11 3074 1 1 13 ILE HG23 H 0.363 12.835 3.261 1.00 . A A . 13 ILE HG23 1 1 11 3075 1 1 13 ILE N N -2.040 12.720 1.155 1.00 . A A . 13 ILE N 1 1 11 3076 1 1 13 ILE O O 0.951 12.561 -0.695 1.00 . A A . 13 ILE O 1 1 11 3077 1 1 14 GLY C C 0.133 9.544 -1.487 1.00 . A A . 14 GLY C 1 1 11 3078 1 1 14 GLY CA C -0.526 10.749 -2.131 1.00 . A A . 14 GLY CA 1 1 11 3079 1 1 14 GLY H H -2.020 11.699 -0.975 1.00 . A A . 14 GLY H 1 1 11 3080 1 1 14 GLY HA2 H -1.332 10.410 -2.764 1.00 . A A . 14 GLY HA2 1 1 11 3081 1 1 14 GLY HA3 H 0.204 11.262 -2.739 1.00 . A A . 14 GLY HA3 1 1 11 3082 1 1 14 GLY N N -1.059 11.683 -1.156 1.00 . A A . 14 GLY N 1 1 11 3083 1 1 14 GLY O O 0.824 8.779 -2.154 1.00 . A A . 14 GLY O 1 1 11 3084 1 1 15 THR C C -0.571 7.108 0.601 1.00 . A A . 15 THR C 1 1 11 3085 1 1 15 THR CA C 0.461 8.230 0.521 1.00 . A A . 15 THR CA 1 1 11 3086 1 1 15 THR CB C 0.949 8.630 1.937 1.00 . A A . 15 THR CB 1 1 11 3087 1 1 15 THR CG2 C -0.174 9.228 2.771 1.00 . A A . 15 THR CG2 1 1 11 3088 1 1 15 THR H H -0.672 9.993 0.282 1.00 . A A . 15 THR H 1 1 11 3089 1 1 15 THR HA H 1.313 7.875 -0.043 1.00 . A A . 15 THR HA 1 1 11 3090 1 1 15 THR HB H 1.725 9.375 1.830 1.00 . A A . 15 THR HB 1 1 11 3091 1 1 15 THR HG1 H 0.790 6.886 2.852 1.00 . A A . 15 THR HG1 1 1 11 3092 1 1 15 THR HG21 H 0.200 9.478 3.753 1.00 . A A . 15 THR HG21 1 1 11 3093 1 1 15 THR HG22 H -0.976 8.510 2.864 1.00 . A A . 15 THR HG22 1 1 11 3094 1 1 15 THR HG23 H -0.545 10.121 2.290 1.00 . A A . 15 THR HG23 1 1 11 3095 1 1 15 THR N N -0.100 9.362 -0.195 1.00 . A A . 15 THR N 1 1 11 3096 1 1 15 THR O O -1.756 7.358 0.851 1.00 . A A . 15 THR O 1 1 11 3097 1 1 15 THR OG1 O 1.497 7.494 2.618 1.00 . A A . 15 THR OG1 1 1 11 3098 1 1 16 PRO C C -1.506 4.373 1.817 1.00 . A A . 16 PRO C 1 1 11 3099 1 1 16 PRO CA C -1.056 4.712 0.401 1.00 . A A . 16 PRO CA 1 1 11 3100 1 1 16 PRO CB C -0.217 3.574 -0.179 1.00 . A A . 16 PRO CB 1 1 11 3101 1 1 16 PRO CD C 1.232 5.472 0.033 1.00 . A A . 16 PRO CD 1 1 11 3102 1 1 16 PRO CG C 1.199 3.969 0.072 1.00 . A A . 16 PRO CG 1 1 11 3103 1 1 16 PRO HA H -1.923 4.876 -0.221 1.00 . A A . 16 PRO HA 1 1 11 3104 1 1 16 PRO HB2 H -0.465 2.650 0.322 1.00 . A A . 16 PRO HB2 1 1 11 3105 1 1 16 PRO HB3 H -0.419 3.481 -1.236 1.00 . A A . 16 PRO HB3 1 1 11 3106 1 1 16 PRO HD2 H 1.926 5.852 0.768 1.00 . A A . 16 PRO HD2 1 1 11 3107 1 1 16 PRO HD3 H 1.500 5.817 -0.955 1.00 . A A . 16 PRO HD3 1 1 11 3108 1 1 16 PRO HG2 H 1.511 3.612 1.042 1.00 . A A . 16 PRO HG2 1 1 11 3109 1 1 16 PRO HG3 H 1.835 3.559 -0.700 1.00 . A A . 16 PRO HG3 1 1 11 3110 1 1 16 PRO N N -0.151 5.860 0.367 1.00 . A A . 16 PRO N 1 1 11 3111 1 1 16 PRO O O -0.688 4.112 2.696 1.00 . A A . 16 PRO O 1 1 11 3112 1 1 17 ILE C C -4.165 2.745 3.221 1.00 . A A . 17 ILE C 1 1 11 3113 1 1 17 ILE CA C -3.376 4.046 3.332 1.00 . A A . 17 ILE CA 1 1 11 3114 1 1 17 ILE CB C -4.274 5.193 3.871 1.00 . A A . 17 ILE CB 1 1 11 3115 1 1 17 ILE CD1 C -2.301 6.679 4.539 1.00 . A A . 17 ILE CD1 1 1 11 3116 1 1 17 ILE CG1 C -3.570 6.547 3.718 1.00 . A A . 17 ILE CG1 1 1 11 3117 1 1 17 ILE CG2 C -4.635 4.961 5.336 1.00 . A A . 17 ILE CG2 1 1 11 3118 1 1 17 ILE H H -3.416 4.575 1.281 1.00 . A A . 17 ILE H 1 1 11 3119 1 1 17 ILE HA H -2.554 3.897 4.019 1.00 . A A . 17 ILE HA 1 1 11 3120 1 1 17 ILE HB H -5.189 5.204 3.297 1.00 . A A . 17 ILE HB 1 1 11 3121 1 1 17 ILE HD11 H -2.322 7.609 5.088 1.00 . A A . 17 ILE HD11 1 1 11 3122 1 1 17 ILE HD12 H -1.445 6.666 3.881 1.00 . A A . 17 ILE HD12 1 1 11 3123 1 1 17 ILE HD13 H -2.235 5.854 5.233 1.00 . A A . 17 ILE HD13 1 1 11 3124 1 1 17 ILE HG12 H -3.306 6.692 2.682 1.00 . A A . 17 ILE HG12 1 1 11 3125 1 1 17 ILE HG13 H -4.246 7.332 4.025 1.00 . A A . 17 ILE HG13 1 1 11 3126 1 1 17 ILE HG21 H -3.749 5.064 5.946 1.00 . A A . 17 ILE HG21 1 1 11 3127 1 1 17 ILE HG22 H -5.040 3.967 5.454 1.00 . A A . 17 ILE HG22 1 1 11 3128 1 1 17 ILE HG23 H -5.371 5.689 5.644 1.00 . A A . 17 ILE HG23 1 1 11 3129 1 1 17 ILE N N -2.813 4.368 2.026 1.00 . A A . 17 ILE N 1 1 11 3130 1 1 17 ILE O O -5.224 2.566 3.819 1.00 . A A . 17 ILE O 1 1 11 3131 1 1 18 SER C C -3.340 -0.265 1.234 1.00 . A A . 18 SER C 1 1 11 3132 1 1 18 SER CA C -4.217 0.534 2.183 1.00 . A A . 18 SER CA 1 1 11 3133 1 1 18 SER CB C -5.624 0.672 1.599 1.00 . A A . 18 SER CB 1 1 11 3134 1 1 18 SER H H -2.774 2.056 1.978 1.00 . A A . 18 SER H 1 1 11 3135 1 1 18 SER HA H -4.274 0.014 3.128 1.00 . A A . 18 SER HA 1 1 11 3136 1 1 18 SER HB2 H -5.963 -0.299 1.261 1.00 . A A . 18 SER HB2 1 1 11 3137 1 1 18 SER HB3 H -6.292 1.038 2.361 1.00 . A A . 18 SER HB3 1 1 11 3138 1 1 18 SER HG H -5.496 2.465 0.821 1.00 . A A . 18 SER HG 1 1 11 3139 1 1 18 SER N N -3.618 1.838 2.424 1.00 . A A . 18 SER N 1 1 11 3140 1 1 18 SER O O -2.707 0.303 0.344 1.00 . A A . 18 SER O 1 1 11 3141 1 1 18 SER OG O -5.643 1.568 0.499 1.00 . A A . 18 SER OG 1 1 11 3142 1 1 19 PHE C C -3.155 -3.812 0.438 1.00 . A A . 19 PHE C 1 1 11 3143 1 1 19 PHE CA C -2.482 -2.452 0.590 1.00 . A A . 19 PHE CA 1 1 11 3144 1 1 19 PHE CB C -1.079 -2.678 1.179 1.00 . A A . 19 PHE CB 1 1 11 3145 1 1 19 PHE CD1 C -0.696 -0.990 3.006 1.00 . A A . 19 PHE CD1 1 1 11 3146 1 1 19 PHE CD2 C 0.550 -0.776 0.984 1.00 . A A . 19 PHE CD2 1 1 11 3147 1 1 19 PHE CE1 C -0.064 0.128 3.518 1.00 . A A . 19 PHE CE1 1 1 11 3148 1 1 19 PHE CE2 C 1.187 0.340 1.491 1.00 . A A . 19 PHE CE2 1 1 11 3149 1 1 19 PHE CG C -0.399 -1.453 1.733 1.00 . A A . 19 PHE CG 1 1 11 3150 1 1 19 PHE CZ C 0.878 0.792 2.759 1.00 . A A . 19 PHE CZ 1 1 11 3151 1 1 19 PHE H H -3.819 -1.965 2.164 1.00 . A A . 19 PHE H 1 1 11 3152 1 1 19 PHE HA H -2.390 -1.993 -0.384 1.00 . A A . 19 PHE HA 1 1 11 3153 1 1 19 PHE HB2 H -1.153 -3.401 1.972 1.00 . A A . 19 PHE HB2 1 1 11 3154 1 1 19 PHE HB3 H -0.444 -3.081 0.405 1.00 . A A . 19 PHE HB3 1 1 11 3155 1 1 19 PHE HD1 H -1.434 -1.509 3.601 1.00 . A A . 19 PHE HD1 1 1 11 3156 1 1 19 PHE HD2 H 0.789 -1.126 -0.008 1.00 . A A . 19 PHE HD2 1 1 11 3157 1 1 19 PHE HE1 H -0.306 0.479 4.509 1.00 . A A . 19 PHE HE1 1 1 11 3158 1 1 19 PHE HE2 H 1.925 0.857 0.898 1.00 . A A . 19 PHE HE2 1 1 11 3159 1 1 19 PHE HZ H 1.375 1.665 3.157 1.00 . A A . 19 PHE HZ 1 1 11 3160 1 1 19 PHE N N -3.294 -1.575 1.430 1.00 . A A . 19 PHE N 1 1 11 3161 1 1 19 PHE O O -4.066 -4.147 1.189 1.00 . A A . 19 PHE O 1 1 11 3162 1 1 20 TYR C C -2.058 -6.869 -1.177 1.00 . A A . 20 TYR C 1 1 11 3163 1 1 20 TYR CA C -3.180 -5.948 -0.739 1.00 . A A . 20 TYR CA 1 1 11 3164 1 1 20 TYR CB C -4.320 -5.997 -1.772 1.00 . A A . 20 TYR CB 1 1 11 3165 1 1 20 TYR CD1 C -2.847 -5.070 -3.631 1.00 . A A . 20 TYR CD1 1 1 11 3166 1 1 20 TYR CD2 C -5.176 -4.576 -3.680 1.00 . A A . 20 TYR CD2 1 1 11 3167 1 1 20 TYR CE1 C -2.667 -4.346 -4.793 1.00 . A A . 20 TYR CE1 1 1 11 3168 1 1 20 TYR CE2 C -5.002 -3.850 -4.842 1.00 . A A . 20 TYR CE2 1 1 11 3169 1 1 20 TYR CG C -4.104 -5.199 -3.051 1.00 . A A . 20 TYR CG 1 1 11 3170 1 1 20 TYR CZ C -3.746 -3.737 -5.394 1.00 . A A . 20 TYR CZ 1 1 11 3171 1 1 20 TYR H H -1.912 -4.277 -1.045 1.00 . A A . 20 TYR H 1 1 11 3172 1 1 20 TYR HA H -3.559 -6.310 0.206 1.00 . A A . 20 TYR HA 1 1 11 3173 1 1 20 TYR HB2 H -4.471 -7.025 -2.063 1.00 . A A . 20 TYR HB2 1 1 11 3174 1 1 20 TYR HB3 H -5.218 -5.640 -1.304 1.00 . A A . 20 TYR HB3 1 1 11 3175 1 1 20 TYR HD1 H -2.002 -5.549 -3.159 1.00 . A A . 20 TYR HD1 1 1 11 3176 1 1 20 TYR HD2 H -6.160 -4.663 -3.245 1.00 . A A . 20 TYR HD2 1 1 11 3177 1 1 20 TYR HE1 H -1.681 -4.258 -5.226 1.00 . A A . 20 TYR HE1 1 1 11 3178 1 1 20 TYR HE2 H -5.850 -3.375 -5.314 1.00 . A A . 20 TYR HE2 1 1 11 3179 1 1 20 TYR HH H -3.170 -2.162 -6.333 1.00 . A A . 20 TYR HH 1 1 11 3180 1 1 20 TYR N N -2.667 -4.601 -0.504 1.00 . A A . 20 TYR N 1 1 11 3181 1 1 20 TYR O O -0.945 -6.418 -1.448 1.00 . A A . 20 TYR O 1 1 11 3182 1 1 20 TYR OH O -3.566 -3.013 -6.549 1.00 . A A . 20 TYR OH 1 1 11 3183 1 1 21 GLY C C -0.195 -9.165 -0.679 1.00 . A A . 21 GLY C 1 1 11 3184 1 1 21 GLY CA C -1.379 -9.139 -1.624 1.00 . A A . 21 GLY CA 1 1 11 3185 1 1 21 GLY H H -3.274 -8.431 -0.993 1.00 . A A . 21 GLY H 1 1 11 3186 1 1 21 GLY HA2 H -1.842 -10.114 -1.634 1.00 . A A . 21 GLY HA2 1 1 11 3187 1 1 21 GLY HA3 H -1.028 -8.907 -2.618 1.00 . A A . 21 GLY HA3 1 1 11 3188 1 1 21 GLY N N -2.365 -8.151 -1.231 1.00 . A A . 21 GLY N 1 1 11 3189 1 1 21 GLY O O -0.387 -8.897 0.527 1.00 . A A . 21 GLY O 1 1 11 3190 1 1 21 GLY OXT O 0.932 -9.426 -1.132 1.00 . A A . 21 GLY OXT 1 1 12 3191 1 1 1 GLY C C -7.933 -3.074 1.654 1.00 . A A . 1 GLY C 1 1 12 3192 1 1 1 GLY CA C -8.310 -2.100 0.549 1.00 . A A . 1 GLY CA 1 1 12 3193 1 1 1 GLY H2 H -6.989 -0.713 -0.361 1.00 . A A . 1 GLY H2 1 1 12 3194 1 1 1 GLY HA2 H -8.765 -1.229 0.997 1.00 . A A . 1 GLY HA2 1 1 12 3195 1 1 1 GLY HA3 H -9.033 -2.574 -0.099 1.00 . A A . 1 GLY HA3 1 1 12 3196 1 1 1 GLY N N -7.174 -1.670 -0.255 1.00 . A A . 1 GLY N 1 1 12 3197 1 1 1 GLY O O -8.632 -4.055 1.887 1.00 . A A . 1 GLY O 1 1 12 3198 1 1 2 GLY C C -5.006 -3.300 3.899 1.00 . A A . 2 GLY C 1 1 12 3199 1 1 2 GLY CA C -6.390 -3.666 3.411 1.00 . A A . 2 GLY CA 1 1 12 3200 1 1 2 GLY H H -6.310 -2.004 2.112 1.00 . A A . 2 GLY H 1 1 12 3201 1 1 2 GLY HA2 H -7.085 -3.588 4.233 1.00 . A A . 2 GLY HA2 1 1 12 3202 1 1 2 GLY HA3 H -6.376 -4.687 3.056 1.00 . A A . 2 GLY HA3 1 1 12 3203 1 1 2 GLY N N -6.829 -2.800 2.336 1.00 . A A . 2 GLY N 1 1 12 3204 1 1 2 GLY O O -4.657 -2.120 3.941 1.00 . A A . 2 GLY O 1 1 12 3205 1 1 3 ALA C C -1.909 -5.153 4.206 1.00 . A A . 3 ALA C 1 1 12 3206 1 1 3 ALA CA C -2.853 -4.073 4.722 1.00 . A A . 3 ALA CA 1 1 12 3207 1 1 3 ALA CB C -2.827 -4.018 6.243 1.00 . A A . 3 ALA CB 1 1 12 3208 1 1 3 ALA H H -4.542 -5.221 4.172 1.00 . A A . 3 ALA H 1 1 12 3209 1 1 3 ALA HA H -2.525 -3.115 4.343 1.00 . A A . 3 ALA HA 1 1 12 3210 1 1 3 ALA HB1 H -3.182 -3.053 6.574 1.00 . A A . 3 ALA HB1 1 1 12 3211 1 1 3 ALA HB2 H -1.815 -4.169 6.591 1.00 . A A . 3 ALA HB2 1 1 12 3212 1 1 3 ALA HB3 H -3.465 -4.793 6.642 1.00 . A A . 3 ALA HB3 1 1 12 3213 1 1 3 ALA N N -4.211 -4.303 4.245 1.00 . A A . 3 ALA N 1 1 12 3214 1 1 3 ALA O O -1.133 -5.734 4.962 1.00 . A A . 3 ALA O 1 1 12 3215 1 1 4 GLY C C 0.263 -5.898 2.024 1.00 . A A . 4 GLY C 1 1 12 3216 1 1 4 GLY CA C -1.144 -6.410 2.281 1.00 . A A . 4 GLY CA 1 1 12 3217 1 1 4 GLY H H -2.633 -4.911 2.363 1.00 . A A . 4 GLY H 1 1 12 3218 1 1 4 GLY HA2 H -1.090 -7.275 2.925 1.00 . A A . 4 GLY HA2 1 1 12 3219 1 1 4 GLY HA3 H -1.586 -6.701 1.340 1.00 . A A . 4 GLY HA3 1 1 12 3220 1 1 4 GLY N N -1.990 -5.411 2.907 1.00 . A A . 4 GLY N 1 1 12 3221 1 1 4 GLY O O 0.950 -5.452 2.942 1.00 . A A . 4 GLY O 1 1 12 3222 1 1 5 HIS C C 2.001 -4.432 -0.655 1.00 . A A . 5 HIS C 1 1 12 3223 1 1 5 HIS CA C 2.044 -5.515 0.420 1.00 . A A . 5 HIS CA 1 1 12 3224 1 1 5 HIS CB C 2.908 -6.688 -0.054 1.00 . A A . 5 HIS CB 1 1 12 3225 1 1 5 HIS CD2 C 4.169 -8.022 1.780 1.00 . A A . 5 HIS CD2 1 1 12 3226 1 1 5 HIS CE1 C 2.587 -9.453 2.281 1.00 . A A . 5 HIS CE1 1 1 12 3227 1 1 5 HIS CG C 3.108 -7.752 0.986 1.00 . A A . 5 HIS CG 1 1 12 3228 1 1 5 HIS H H 0.117 -6.343 0.078 1.00 . A A . 5 HIS H 1 1 12 3229 1 1 5 HIS HA H 2.489 -5.095 1.309 1.00 . A A . 5 HIS HA 1 1 12 3230 1 1 5 HIS HB2 H 2.440 -7.147 -0.911 1.00 . A A . 5 HIS HB2 1 1 12 3231 1 1 5 HIS HB3 H 3.882 -6.314 -0.338 1.00 . A A . 5 HIS HB3 1 1 12 3232 1 1 5 HIS HD1 H 1.240 -8.746 0.901 1.00 . A A . 5 HIS HD1 1 1 12 3233 1 1 5 HIS HD2 H 5.115 -7.499 1.786 1.00 . A A . 5 HIS HD2 1 1 12 3234 1 1 5 HIS HE1 H 2.040 -10.261 2.742 1.00 . A A . 5 HIS HE1 1 1 12 3235 1 1 5 HIS HE2 H 4.314 -9.382 3.369 1.00 . A A . 5 HIS HE2 1 1 12 3236 1 1 5 HIS N N 0.702 -5.970 0.776 1.00 . A A . 5 HIS N 1 1 12 3237 1 1 5 HIS ND1 N 2.140 -8.669 1.324 1.00 . A A . 5 HIS ND1 1 1 12 3238 1 1 5 HIS NE2 N 3.819 -9.085 2.578 1.00 . A A . 5 HIS NE2 1 1 12 3239 1 1 5 HIS O O 2.717 -3.436 -0.568 1.00 . A A . 5 HIS O 1 1 12 3240 1 1 6 VAL C C -0.014 -2.619 -2.420 1.00 . A A . 6 VAL C 1 1 12 3241 1 1 6 VAL CA C 1.048 -3.664 -2.753 1.00 . A A . 6 VAL CA 1 1 12 3242 1 1 6 VAL CB C 0.690 -4.361 -4.086 1.00 . A A . 6 VAL CB 1 1 12 3243 1 1 6 VAL CG1 C 0.725 -3.376 -5.245 1.00 . A A . 6 VAL CG1 1 1 12 3244 1 1 6 VAL CG2 C 1.628 -5.531 -4.348 1.00 . A A . 6 VAL CG2 1 1 12 3245 1 1 6 VAL H H 0.619 -5.445 -1.687 1.00 . A A . 6 VAL H 1 1 12 3246 1 1 6 VAL HA H 2.002 -3.170 -2.871 1.00 . A A . 6 VAL HA 1 1 12 3247 1 1 6 VAL HB H -0.315 -4.748 -4.005 1.00 . A A . 6 VAL HB 1 1 12 3248 1 1 6 VAL HG11 H 1.080 -3.876 -6.134 1.00 . A A . 6 VAL HG11 1 1 12 3249 1 1 6 VAL HG12 H 1.390 -2.558 -5.002 1.00 . A A . 6 VAL HG12 1 1 12 3250 1 1 6 VAL HG13 H -0.268 -2.990 -5.420 1.00 . A A . 6 VAL HG13 1 1 12 3251 1 1 6 VAL HG21 H 2.250 -5.696 -3.481 1.00 . A A . 6 VAL HG21 1 1 12 3252 1 1 6 VAL HG22 H 2.252 -5.309 -5.201 1.00 . A A . 6 VAL HG22 1 1 12 3253 1 1 6 VAL HG23 H 1.048 -6.419 -4.550 1.00 . A A . 6 VAL HG23 1 1 12 3254 1 1 6 VAL N N 1.169 -4.630 -1.667 1.00 . A A . 6 VAL N 1 1 12 3255 1 1 6 VAL O O -1.135 -2.965 -2.053 1.00 . A A . 6 VAL O 1 1 12 3256 1 1 7 PRO C C -1.882 -0.252 -3.012 1.00 . A A . 7 PRO C 1 1 12 3257 1 1 7 PRO CA C -0.578 -0.216 -2.213 1.00 . A A . 7 PRO CA 1 1 12 3258 1 1 7 PRO CB C 0.232 1.027 -2.593 1.00 . A A . 7 PRO CB 1 1 12 3259 1 1 7 PRO CD C 1.669 -0.848 -2.926 1.00 . A A . 7 PRO CD 1 1 12 3260 1 1 7 PRO CG C 1.654 0.597 -2.514 1.00 . A A . 7 PRO CG 1 1 12 3261 1 1 7 PRO HA H -0.810 -0.182 -1.160 1.00 . A A . 7 PRO HA 1 1 12 3262 1 1 7 PRO HB2 H -0.031 1.339 -3.593 1.00 . A A . 7 PRO HB2 1 1 12 3263 1 1 7 PRO HB3 H 0.022 1.822 -1.895 1.00 . A A . 7 PRO HB3 1 1 12 3264 1 1 7 PRO HD2 H 1.804 -0.936 -3.993 1.00 . A A . 7 PRO HD2 1 1 12 3265 1 1 7 PRO HD3 H 2.446 -1.381 -2.399 1.00 . A A . 7 PRO HD3 1 1 12 3266 1 1 7 PRO HG2 H 2.254 1.186 -3.191 1.00 . A A . 7 PRO HG2 1 1 12 3267 1 1 7 PRO HG3 H 2.015 0.702 -1.501 1.00 . A A . 7 PRO HG3 1 1 12 3268 1 1 7 PRO N N 0.337 -1.328 -2.522 1.00 . A A . 7 PRO N 1 1 12 3269 1 1 7 PRO O O -1.880 -0.487 -4.220 1.00 . A A . 7 PRO O 1 1 12 3270 1 1 8 GLU C C -4.683 1.429 -3.361 1.00 . A A . 8 GLU C 1 1 12 3271 1 1 8 GLU CA C -4.305 0.014 -2.945 1.00 . A A . 8 GLU CA 1 1 12 3272 1 1 8 GLU CB C -5.370 -0.530 -1.991 1.00 . A A . 8 GLU CB 1 1 12 3273 1 1 8 GLU CD C -6.379 -2.554 -0.855 1.00 . A A . 8 GLU CD 1 1 12 3274 1 1 8 GLU CG C -5.222 -2.005 -1.673 1.00 . A A . 8 GLU CG 1 1 12 3275 1 1 8 GLU H H -2.915 0.186 -1.361 1.00 . A A . 8 GLU H 1 1 12 3276 1 1 8 GLU HA H -4.265 -0.612 -3.825 1.00 . A A . 8 GLU HA 1 1 12 3277 1 1 8 GLU HB2 H -5.315 0.019 -1.062 1.00 . A A . 8 GLU HB2 1 1 12 3278 1 1 8 GLU HB3 H -6.343 -0.375 -2.431 1.00 . A A . 8 GLU HB3 1 1 12 3279 1 1 8 GLU HG2 H -5.167 -2.554 -2.601 1.00 . A A . 8 GLU HG2 1 1 12 3280 1 1 8 GLU HG3 H -4.307 -2.149 -1.117 1.00 . A A . 8 GLU HG3 1 1 12 3281 1 1 8 GLU N N -2.990 -0.003 -2.321 1.00 . A A . 8 GLU N 1 1 12 3282 1 1 8 GLU O O -4.668 1.769 -4.542 1.00 . A A . 8 GLU O 1 1 12 3283 1 1 8 GLU OE1 O -6.527 -3.788 -0.777 1.00 . A A . 8 GLU OE1 1 1 12 3284 1 1 9 TYR C C -4.539 4.602 -1.881 1.00 . A A . 9 TYR C 1 1 12 3285 1 1 9 TYR CA C -5.422 3.630 -2.647 1.00 . A A . 9 TYR CA 1 1 12 3286 1 1 9 TYR CB C -6.889 3.875 -2.273 1.00 . A A . 9 TYR CB 1 1 12 3287 1 1 9 TYR CD1 C -8.062 1.690 -2.779 1.00 . A A . 9 TYR CD1 1 1 12 3288 1 1 9 TYR CD2 C -8.643 3.607 -4.069 1.00 . A A . 9 TYR CD2 1 1 12 3289 1 1 9 TYR CE1 C -8.967 0.929 -3.494 1.00 . A A . 9 TYR CE1 1 1 12 3290 1 1 9 TYR CE2 C -9.552 2.853 -4.787 1.00 . A A . 9 TYR CE2 1 1 12 3291 1 1 9 TYR CG C -7.884 3.041 -3.053 1.00 . A A . 9 TYR CG 1 1 12 3292 1 1 9 TYR CZ C -9.710 1.515 -4.496 1.00 . A A . 9 TYR CZ 1 1 12 3293 1 1 9 TYR H H -5.030 1.927 -1.455 1.00 . A A . 9 TYR H 1 1 12 3294 1 1 9 TYR HA H -5.297 3.809 -3.704 1.00 . A A . 9 TYR HA 1 1 12 3295 1 1 9 TYR HB2 H -7.022 3.656 -1.227 1.00 . A A . 9 TYR HB2 1 1 12 3296 1 1 9 TYR HB3 H -7.124 4.916 -2.445 1.00 . A A . 9 TYR HB3 1 1 12 3297 1 1 9 TYR HD1 H -7.479 1.233 -1.993 1.00 . A A . 9 TYR HD1 1 1 12 3298 1 1 9 TYR HD2 H -8.517 4.656 -4.296 1.00 . A A . 9 TYR HD2 1 1 12 3299 1 1 9 TYR HE1 H -9.090 -0.119 -3.264 1.00 . A A . 9 TYR HE1 1 1 12 3300 1 1 9 TYR HE2 H -10.133 3.313 -5.573 1.00 . A A . 9 TYR HE2 1 1 12 3301 1 1 9 TYR HH H -10.636 1.066 -6.119 1.00 . A A . 9 TYR HH 1 1 12 3302 1 1 9 TYR N N -5.031 2.255 -2.380 1.00 . A A . 9 TYR N 1 1 12 3303 1 1 9 TYR O O -4.180 4.357 -0.723 1.00 . A A . 9 TYR O 1 1 12 3304 1 1 9 TYR OH O -10.612 0.761 -5.209 1.00 . A A . 9 TYR OH 1 1 12 3305 1 1 10 PHE C C -4.228 7.952 -1.621 1.00 . A A . 10 PHE C 1 1 12 3306 1 1 10 PHE CA C -3.374 6.733 -1.930 1.00 . A A . 10 PHE CA 1 1 12 3307 1 1 10 PHE CB C -2.231 7.157 -2.860 1.00 . A A . 10 PHE CB 1 1 12 3308 1 1 10 PHE CD1 C -2.107 5.258 -4.520 1.00 . A A . 10 PHE CD1 1 1 12 3309 1 1 10 PHE CD2 C -0.189 5.731 -3.186 1.00 . A A . 10 PHE CD2 1 1 12 3310 1 1 10 PHE CE1 C -1.427 4.226 -5.138 1.00 . A A . 10 PHE CE1 1 1 12 3311 1 1 10 PHE CE2 C 0.496 4.700 -3.799 1.00 . A A . 10 PHE CE2 1 1 12 3312 1 1 10 PHE CG C -1.497 6.023 -3.536 1.00 . A A . 10 PHE CG 1 1 12 3313 1 1 10 PHE CZ C -0.123 3.946 -4.777 1.00 . A A . 10 PHE CZ 1 1 12 3314 1 1 10 PHE H H -4.535 5.834 -3.442 1.00 . A A . 10 PHE H 1 1 12 3315 1 1 10 PHE HA H -2.962 6.344 -1.010 1.00 . A A . 10 PHE HA 1 1 12 3316 1 1 10 PHE HB2 H -2.633 7.794 -3.626 1.00 . A A . 10 PHE HB2 1 1 12 3317 1 1 10 PHE HB3 H -1.510 7.719 -2.285 1.00 . A A . 10 PHE HB3 1 1 12 3318 1 1 10 PHE HD1 H -3.126 5.475 -4.802 1.00 . A A . 10 PHE HD1 1 1 12 3319 1 1 10 PHE HD2 H 0.299 6.318 -2.421 1.00 . A A . 10 PHE HD2 1 1 12 3320 1 1 10 PHE HE1 H -1.914 3.639 -5.901 1.00 . A A . 10 PHE HE1 1 1 12 3321 1 1 10 PHE HE2 H 1.515 4.482 -3.516 1.00 . A A . 10 PHE HE2 1 1 12 3322 1 1 10 PHE HZ H 0.409 3.140 -5.258 1.00 . A A . 10 PHE HZ 1 1 12 3323 1 1 10 PHE N N -4.202 5.703 -2.531 1.00 . A A . 10 PHE N 1 1 12 3324 1 1 10 PHE O O -5.043 8.363 -2.444 1.00 . A A . 10 PHE O 1 1 12 3325 1 1 11 VAL C C -3.970 10.511 0.994 1.00 . A A . 11 VAL C 1 1 12 3326 1 1 11 VAL CA C -4.778 9.708 -0.016 1.00 . A A . 11 VAL CA 1 1 12 3327 1 1 11 VAL CB C -6.146 9.350 0.627 1.00 . A A . 11 VAL CB 1 1 12 3328 1 1 11 VAL CG1 C -7.181 8.981 -0.425 1.00 . A A . 11 VAL CG1 1 1 12 3329 1 1 11 VAL CG2 C -5.990 8.223 1.637 1.00 . A A . 11 VAL CG2 1 1 12 3330 1 1 11 VAL H H -3.350 8.147 0.151 1.00 . A A . 11 VAL H 1 1 12 3331 1 1 11 VAL HA H -4.961 10.322 -0.887 1.00 . A A . 11 VAL HA 1 1 12 3332 1 1 11 VAL HB H -6.505 10.223 1.153 1.00 . A A . 11 VAL HB 1 1 12 3333 1 1 11 VAL HG11 H -7.783 9.847 -0.659 1.00 . A A . 11 VAL HG11 1 1 12 3334 1 1 11 VAL HG12 H -7.816 8.194 -0.045 1.00 . A A . 11 VAL HG12 1 1 12 3335 1 1 11 VAL HG13 H -6.680 8.639 -1.319 1.00 . A A . 11 VAL HG13 1 1 12 3336 1 1 11 VAL HG21 H -6.851 8.204 2.290 1.00 . A A . 11 VAL HG21 1 1 12 3337 1 1 11 VAL HG22 H -5.098 8.386 2.224 1.00 . A A . 11 VAL HG22 1 1 12 3338 1 1 11 VAL HG23 H -5.912 7.280 1.117 1.00 . A A . 11 VAL HG23 1 1 12 3339 1 1 11 VAL N N -4.031 8.525 -0.448 1.00 . A A . 11 VAL N 1 1 12 3340 1 1 11 VAL O O -2.837 10.158 1.313 1.00 . A A . 11 VAL O 1 1 12 3341 1 1 12 GLY C C -2.851 13.344 1.855 1.00 . A A . 12 GLY C 1 1 12 3342 1 1 12 GLY CA C -3.910 12.455 2.464 1.00 . A A . 12 GLY CA 1 1 12 3343 1 1 12 GLY H H -5.458 11.819 1.182 1.00 . A A . 12 GLY H 1 1 12 3344 1 1 12 GLY HA2 H -4.652 13.076 2.928 1.00 . A A . 12 GLY HA2 1 1 12 3345 1 1 12 GLY HA3 H -3.450 11.835 3.221 1.00 . A A . 12 GLY HA3 1 1 12 3346 1 1 12 GLY N N -4.563 11.596 1.488 1.00 . A A . 12 GLY N 1 1 12 3347 1 1 12 GLY O O -2.840 14.553 2.066 1.00 . A A . 12 GLY O 1 1 12 3348 1 1 13 ILE C C -0.186 12.467 -0.544 1.00 . A A . 13 ILE C 1 1 12 3349 1 1 13 ILE CA C -0.881 13.425 0.430 1.00 . A A . 13 ILE CA 1 1 12 3350 1 1 13 ILE CB C 0.123 14.009 1.465 1.00 . A A . 13 ILE CB 1 1 12 3351 1 1 13 ILE CD1 C 2.111 15.590 1.744 1.00 . A A . 13 ILE CD1 1 1 12 3352 1 1 13 ILE CG1 C 1.151 14.922 0.782 1.00 . A A . 13 ILE CG1 1 1 12 3353 1 1 13 ILE CG2 C 0.814 12.896 2.247 1.00 . A A . 13 ILE CG2 1 1 12 3354 1 1 13 ILE H H -2.068 11.759 0.984 1.00 . A A . 13 ILE H 1 1 12 3355 1 1 13 ILE HA H -1.307 14.244 -0.133 1.00 . A A . 13 ILE HA 1 1 12 3356 1 1 13 ILE HB H -0.443 14.597 2.173 1.00 . A A . 13 ILE HB 1 1 12 3357 1 1 13 ILE HD11 H 2.020 15.133 2.719 1.00 . A A . 13 ILE HD11 1 1 12 3358 1 1 13 ILE HD12 H 1.875 16.642 1.816 1.00 . A A . 13 ILE HD12 1 1 12 3359 1 1 13 ILE HD13 H 3.122 15.472 1.385 1.00 . A A . 13 ILE HD13 1 1 12 3360 1 1 13 ILE HG12 H 1.736 14.337 0.087 1.00 . A A . 13 ILE HG12 1 1 12 3361 1 1 13 ILE HG13 H 0.629 15.698 0.240 1.00 . A A . 13 ILE HG13 1 1 12 3362 1 1 13 ILE HG21 H 0.486 12.921 3.275 1.00 . A A . 13 ILE HG21 1 1 12 3363 1 1 13 ILE HG22 H 1.885 13.038 2.206 1.00 . A A . 13 ILE HG22 1 1 12 3364 1 1 13 ILE HG23 H 0.561 11.939 1.811 1.00 . A A . 13 ILE HG23 1 1 12 3365 1 1 13 ILE N N -1.973 12.728 1.096 1.00 . A A . 13 ILE N 1 1 12 3366 1 1 13 ILE O O 1.032 12.467 -0.710 1.00 . A A . 13 ILE O 1 1 12 3367 1 1 14 GLY C C 0.156 9.476 -1.481 1.00 . A A . 14 GLY C 1 1 12 3368 1 1 14 GLY CA C -0.473 10.684 -2.150 1.00 . A A . 14 GLY CA 1 1 12 3369 1 1 14 GLY H H -1.956 11.689 -1.031 1.00 . A A . 14 GLY H 1 1 12 3370 1 1 14 GLY HA2 H -1.280 10.349 -2.785 1.00 . A A . 14 GLY HA2 1 1 12 3371 1 1 14 GLY HA3 H 0.272 11.170 -2.762 1.00 . A A . 14 GLY HA3 1 1 12 3372 1 1 14 GLY N N -0.995 11.643 -1.196 1.00 . A A . 14 GLY N 1 1 12 3373 1 1 14 GLY O O 0.850 8.694 -2.127 1.00 . A A . 14 GLY O 1 1 12 3374 1 1 15 THR C C -0.626 7.075 0.627 1.00 . A A . 15 THR C 1 1 12 3375 1 1 15 THR CA C 0.428 8.178 0.544 1.00 . A A . 15 THR CA 1 1 12 3376 1 1 15 THR CB C 0.906 8.584 1.963 1.00 . A A . 15 THR CB 1 1 12 3377 1 1 15 THR CG2 C -0.217 9.213 2.775 1.00 . A A . 15 THR CG2 1 1 12 3378 1 1 15 THR H H -0.676 9.952 0.268 1.00 . A A . 15 THR H 1 1 12 3379 1 1 15 THR HA H 1.280 7.801 -0.005 1.00 . A A . 15 THR HA 1 1 12 3380 1 1 15 THR HB H 1.697 9.314 1.856 1.00 . A A . 15 THR HB 1 1 12 3381 1 1 15 THR HG1 H 0.704 6.854 2.895 1.00 . A A . 15 THR HG1 1 1 12 3382 1 1 15 THR HG21 H -1.161 8.782 2.477 1.00 . A A . 15 THR HG21 1 1 12 3383 1 1 15 THR HG22 H -0.236 10.278 2.600 1.00 . A A . 15 THR HG22 1 1 12 3384 1 1 15 THR HG23 H -0.051 9.023 3.826 1.00 . A A . 15 THR HG23 1 1 12 3385 1 1 15 THR N N -0.103 9.310 -0.193 1.00 . A A . 15 THR N 1 1 12 3386 1 1 15 THR O O -1.805 7.345 0.869 1.00 . A A . 15 THR O 1 1 12 3387 1 1 15 THR OG1 O 1.425 7.446 2.663 1.00 . A A . 15 THR OG1 1 1 12 3388 1 1 16 PRO C C -1.596 4.348 1.851 1.00 . A A . 16 PRO C 1 1 12 3389 1 1 16 PRO CA C -1.149 4.688 0.434 1.00 . A A . 16 PRO CA 1 1 12 3390 1 1 16 PRO CB C -0.334 3.539 -0.160 1.00 . A A . 16 PRO CB 1 1 12 3391 1 1 16 PRO CD C 1.153 5.406 0.072 1.00 . A A . 16 PRO CD 1 1 12 3392 1 1 16 PRO CG C 1.090 3.903 0.092 1.00 . A A . 16 PRO CG 1 1 12 3393 1 1 16 PRO HA H -2.019 4.870 -0.180 1.00 . A A . 16 PRO HA 1 1 12 3394 1 1 16 PRO HB2 H -0.599 2.616 0.332 1.00 . A A . 16 PRO HB2 1 1 12 3395 1 1 16 PRO HB3 H -0.540 3.461 -1.217 1.00 . A A . 16 PRO HB3 1 1 12 3396 1 1 16 PRO HD2 H 1.847 5.763 0.818 1.00 . A A . 16 PRO HD2 1 1 12 3397 1 1 16 PRO HD3 H 1.437 5.758 -0.907 1.00 . A A . 16 PRO HD3 1 1 12 3398 1 1 16 PRO HG2 H 1.397 3.528 1.058 1.00 . A A . 16 PRO HG2 1 1 12 3399 1 1 16 PRO HG3 H 1.715 3.492 -0.686 1.00 . A A . 16 PRO HG3 1 1 12 3400 1 1 16 PRO N N -0.225 5.818 0.398 1.00 . A A . 16 PRO N 1 1 12 3401 1 1 16 PRO O O -0.774 4.077 2.725 1.00 . A A . 16 PRO O 1 1 12 3402 1 1 17 ILE C C -4.230 2.717 3.268 1.00 . A A . 17 ILE C 1 1 12 3403 1 1 17 ILE CA C -3.459 4.030 3.374 1.00 . A A . 17 ILE CA 1 1 12 3404 1 1 17 ILE CB C -4.377 5.164 3.906 1.00 . A A . 17 ILE CB 1 1 12 3405 1 1 17 ILE CD1 C -2.425 6.690 4.546 1.00 . A A . 17 ILE CD1 1 1 12 3406 1 1 17 ILE CG1 C -3.698 6.530 3.738 1.00 . A A . 17 ILE CG1 1 1 12 3407 1 1 17 ILE CG2 C -4.727 4.940 5.375 1.00 . A A . 17 ILE CG2 1 1 12 3408 1 1 17 ILE H H -3.508 4.566 1.325 1.00 . A A . 17 ILE H 1 1 12 3409 1 1 17 ILE HA H -2.637 3.897 4.062 1.00 . A A . 17 ILE HA 1 1 12 3410 1 1 17 ILE HB H -5.293 5.153 3.337 1.00 . A A . 17 ILE HB 1 1 12 3411 1 1 17 ILE HD11 H -1.741 5.891 4.301 1.00 . A A . 17 ILE HD11 1 1 12 3412 1 1 17 ILE HD12 H -2.660 6.653 5.599 1.00 . A A . 17 ILE HD12 1 1 12 3413 1 1 17 ILE HD13 H -1.967 7.641 4.313 1.00 . A A . 17 ILE HD13 1 1 12 3414 1 1 17 ILE HG12 H -3.446 6.673 2.698 1.00 . A A . 17 ILE HG12 1 1 12 3415 1 1 17 ILE HG13 H -4.386 7.304 4.045 1.00 . A A . 17 ILE HG13 1 1 12 3416 1 1 17 ILE HG21 H -4.153 4.109 5.759 1.00 . A A . 17 ILE HG21 1 1 12 3417 1 1 17 ILE HG22 H -5.780 4.721 5.465 1.00 . A A . 17 ILE HG22 1 1 12 3418 1 1 17 ILE HG23 H -4.494 5.829 5.941 1.00 . A A . 17 ILE HG23 1 1 12 3419 1 1 17 ILE N N -2.900 4.352 2.067 1.00 . A A . 17 ILE N 1 1 12 3420 1 1 17 ILE O O -5.282 2.523 3.873 1.00 . A A . 17 ILE O 1 1 12 3421 1 1 18 SER C C -3.370 -0.275 1.270 1.00 . A A . 18 SER C 1 1 12 3422 1 1 18 SER CA C -4.253 0.505 2.230 1.00 . A A . 18 SER CA 1 1 12 3423 1 1 18 SER CB C -5.668 0.623 1.659 1.00 . A A . 18 SER CB 1 1 12 3424 1 1 18 SER H H -2.836 2.052 2.019 1.00 . A A . 18 SER H 1 1 12 3425 1 1 18 SER HA H -4.292 -0.017 3.174 1.00 . A A . 18 SER HA 1 1 12 3426 1 1 18 SER HB2 H -5.992 -0.348 1.315 1.00 . A A . 18 SER HB2 1 1 12 3427 1 1 18 SER HB3 H -6.334 0.971 2.431 1.00 . A A . 18 SER HB3 1 1 12 3428 1 1 18 SER HG H -5.613 2.429 0.901 1.00 . A A . 18 SER HG 1 1 12 3429 1 1 18 SER N N -3.674 1.820 2.468 1.00 . A A . 18 SER N 1 1 12 3430 1 1 18 SER O O -2.747 0.309 0.383 1.00 . A A . 18 SER O 1 1 12 3431 1 1 18 SER OG O -5.712 1.530 0.568 1.00 . A A . 18 SER OG 1 1 12 3432 1 1 19 PHE C C -3.145 -3.811 0.440 1.00 . A A . 19 PHE C 1 1 12 3433 1 1 19 PHE CA C -2.487 -2.445 0.603 1.00 . A A . 19 PHE CA 1 1 12 3434 1 1 19 PHE CB C -1.081 -2.664 1.188 1.00 . A A . 19 PHE CB 1 1 12 3435 1 1 19 PHE CD1 C -0.721 -1.011 3.054 1.00 . A A . 19 PHE CD1 1 1 12 3436 1 1 19 PHE CD2 C 0.519 -0.734 1.035 1.00 . A A . 19 PHE CD2 1 1 12 3437 1 1 19 PHE CE1 C -0.104 0.104 3.589 1.00 . A A . 19 PHE CE1 1 1 12 3438 1 1 19 PHE CE2 C 1.141 0.379 1.565 1.00 . A A . 19 PHE CE2 1 1 12 3439 1 1 19 PHE CG C -0.419 -1.441 1.768 1.00 . A A . 19 PHE CG 1 1 12 3440 1 1 19 PHE CZ C 0.828 0.799 2.845 1.00 . A A . 19 PHE CZ 1 1 12 3441 1 1 19 PHE H H -3.823 -1.990 2.190 1.00 . A A . 19 PHE H 1 1 12 3442 1 1 19 PHE HA H -2.401 -1.976 -0.366 1.00 . A A . 19 PHE HA 1 1 12 3443 1 1 19 PHE HB2 H -1.145 -3.405 1.965 1.00 . A A . 19 PHE HB2 1 1 12 3444 1 1 19 PHE HB3 H -0.441 -3.042 0.407 1.00 . A A . 19 PHE HB3 1 1 12 3445 1 1 19 PHE HD1 H -1.450 -1.553 3.636 1.00 . A A . 19 PHE HD1 1 1 12 3446 1 1 19 PHE HD2 H 0.763 -1.060 0.034 1.00 . A A . 19 PHE HD2 1 1 12 3447 1 1 19 PHE HE1 H -0.350 0.431 4.587 1.00 . A A . 19 PHE HE1 1 1 12 3448 1 1 19 PHE HE2 H 1.872 0.919 0.982 1.00 . A A . 19 PHE HE2 1 1 12 3449 1 1 19 PHE HZ H 1.313 1.669 3.261 1.00 . A A . 19 PHE HZ 1 1 12 3450 1 1 19 PHE N N -3.308 -1.586 1.455 1.00 . A A . 19 PHE N 1 1 12 3451 1 1 19 PHE O O -4.046 -4.164 1.193 1.00 . A A . 19 PHE O 1 1 12 3452 1 1 20 TYR C C -2.033 -6.841 -1.206 1.00 . A A . 20 TYR C 1 1 12 3453 1 1 20 TYR CA C -3.160 -5.932 -0.764 1.00 . A A . 20 TYR CA 1 1 12 3454 1 1 20 TYR CB C -4.301 -5.980 -1.796 1.00 . A A . 20 TYR CB 1 1 12 3455 1 1 20 TYR CD1 C -2.836 -5.042 -3.656 1.00 . A A . 20 TYR CD1 1 1 12 3456 1 1 20 TYR CD2 C -5.166 -4.547 -3.691 1.00 . A A . 20 TYR CD2 1 1 12 3457 1 1 20 TYR CE1 C -2.663 -4.312 -4.816 1.00 . A A . 20 TYR CE1 1 1 12 3458 1 1 20 TYR CE2 C -4.998 -3.815 -4.850 1.00 . A A . 20 TYR CE2 1 1 12 3459 1 1 20 TYR CG C -4.090 -5.172 -3.070 1.00 . A A . 20 TYR CG 1 1 12 3460 1 1 20 TYR CZ C -3.745 -3.700 -5.408 1.00 . A A . 20 TYR CZ 1 1 12 3461 1 1 20 TYR H H -1.911 -4.245 -1.061 1.00 . A A . 20 TYR H 1 1 12 3462 1 1 20 TYR HA H -3.538 -6.304 0.178 1.00 . A A . 20 TYR HA 1 1 12 3463 1 1 20 TYR HB2 H -4.445 -7.008 -2.095 1.00 . A A . 20 TYR HB2 1 1 12 3464 1 1 20 TYR HB3 H -5.202 -5.634 -1.326 1.00 . A A . 20 TYR HB3 1 1 12 3465 1 1 20 TYR HD1 H -1.988 -5.519 -3.191 1.00 . A A . 20 TYR HD1 1 1 12 3466 1 1 20 TYR HD2 H -6.148 -4.639 -3.251 1.00 . A A . 20 TYR HD2 1 1 12 3467 1 1 20 TYR HE1 H -1.679 -4.224 -5.255 1.00 . A A . 20 TYR HE1 1 1 12 3468 1 1 20 TYR HE2 H -5.847 -3.336 -5.313 1.00 . A A . 20 TYR HE2 1 1 12 3469 1 1 20 TYR HH H -3.189 -2.115 -6.343 1.00 . A A . 20 TYR HH 1 1 12 3470 1 1 20 TYR N N -2.659 -4.582 -0.517 1.00 . A A . 20 TYR N 1 1 12 3471 1 1 20 TYR O O -0.921 -6.381 -1.472 1.00 . A A . 20 TYR O 1 1 12 3472 1 1 20 TYR OH O -3.571 -2.971 -6.560 1.00 . A A . 20 TYR OH 1 1 12 3473 1 1 21 GLY C C -0.157 -9.133 -0.724 1.00 . A A . 21 GLY C 1 1 12 3474 1 1 21 GLY CA C -1.338 -9.103 -1.673 1.00 . A A . 21 GLY CA 1 1 12 3475 1 1 21 GLY H H -3.238 -8.413 -1.038 1.00 . A A . 21 GLY H 1 1 12 3476 1 1 21 GLY HA2 H -1.796 -10.081 -1.694 1.00 . A A . 21 GLY HA2 1 1 12 3477 1 1 21 GLY HA3 H -0.985 -8.859 -2.663 1.00 . A A . 21 GLY HA3 1 1 12 3478 1 1 21 GLY N N -2.331 -8.125 -1.272 1.00 . A A . 21 GLY N 1 1 12 3479 1 1 21 GLY O O 0.972 -9.387 -1.175 1.00 . A A . 21 GLY O 1 1 12 3480 1 1 21 GLY OXT O -0.353 -8.874 0.482 1.00 . A A . 21 GLY OXT 1 1 13 3481 1 1 1 GLY C C -8.158 -2.565 2.002 1.00 . A A . 1 GLY C 1 1 13 3482 1 1 1 GLY CA C -8.582 -2.135 0.609 1.00 . A A . 1 GLY CA 1 1 13 3483 1 1 1 GLY H2 H -7.189 -0.801 -0.260 1.00 . A A . 1 GLY H2 1 1 13 3484 1 1 1 GLY HA2 H -9.263 -1.302 0.698 1.00 . A A . 1 GLY HA2 1 1 13 3485 1 1 1 GLY HA3 H -9.101 -2.956 0.136 1.00 . A A . 1 GLY HA3 1 1 13 3486 1 1 1 GLY N N -7.474 -1.738 -0.237 1.00 . A A . 1 GLY N 1 1 13 3487 1 1 1 GLY O O -8.779 -2.172 2.988 1.00 . A A . 1 GLY O 1 1 13 3488 1 1 2 GLY C C -5.208 -3.517 3.653 1.00 . A A . 2 GLY C 1 1 13 3489 1 1 2 GLY CA C -6.659 -3.854 3.383 1.00 . A A . 2 GLY CA 1 1 13 3490 1 1 2 GLY H H -6.660 -3.674 1.271 1.00 . A A . 2 GLY H 1 1 13 3491 1 1 2 GLY HA2 H -7.269 -3.406 4.153 1.00 . A A . 2 GLY HA2 1 1 13 3492 1 1 2 GLY HA3 H -6.781 -4.927 3.425 1.00 . A A . 2 GLY HA3 1 1 13 3493 1 1 2 GLY N N -7.116 -3.382 2.090 1.00 . A A . 2 GLY N 1 1 13 3494 1 1 2 GLY O O -4.800 -2.363 3.534 1.00 . A A . 2 GLY O 1 1 13 3495 1 1 3 ALA C C -2.202 -5.441 3.609 1.00 . A A . 3 ALA C 1 1 13 3496 1 1 3 ALA CA C -3.012 -4.348 4.289 1.00 . A A . 3 ALA CA 1 1 13 3497 1 1 3 ALA CB C -2.765 -4.354 5.790 1.00 . A A . 3 ALA CB 1 1 13 3498 1 1 3 ALA H H -4.811 -5.427 4.070 1.00 . A A . 3 ALA H 1 1 13 3499 1 1 3 ALA HA H -2.710 -3.387 3.897 1.00 . A A . 3 ALA HA 1 1 13 3500 1 1 3 ALA HB1 H -1.917 -3.725 6.018 1.00 . A A . 3 ALA HB1 1 1 13 3501 1 1 3 ALA HB2 H -2.563 -5.362 6.119 1.00 . A A . 3 ALA HB2 1 1 13 3502 1 1 3 ALA HB3 H -3.639 -3.976 6.301 1.00 . A A . 3 ALA HB3 1 1 13 3503 1 1 3 ALA N N -4.428 -4.528 4.005 1.00 . A A . 3 ALA N 1 1 13 3504 1 1 3 ALA O O -2.648 -6.582 3.518 1.00 . A A . 3 ALA O 1 1 13 3505 1 1 4 GLY C C 1.080 -5.419 1.887 1.00 . A A . 4 GLY C 1 1 13 3506 1 1 4 GLY CA C -0.182 -6.047 2.443 1.00 . A A . 4 GLY CA 1 1 13 3507 1 1 4 GLY H H -0.720 -4.157 3.216 1.00 . A A . 4 GLY H 1 1 13 3508 1 1 4 GLY HA2 H 0.092 -6.823 3.140 1.00 . A A . 4 GLY HA2 1 1 13 3509 1 1 4 GLY HA3 H -0.741 -6.485 1.630 1.00 . A A . 4 GLY HA3 1 1 13 3510 1 1 4 GLY N N -1.023 -5.084 3.121 1.00 . A A . 4 GLY N 1 1 13 3511 1 1 4 GLY O O 1.761 -4.667 2.579 1.00 . A A . 4 GLY O 1 1 13 3512 1 1 5 HIS C C 2.253 -4.225 -1.101 1.00 . A A . 5 HIS C 1 1 13 3513 1 1 5 HIS CA C 2.603 -5.233 -0.010 1.00 . A A . 5 HIS CA 1 1 13 3514 1 1 5 HIS CB C 3.409 -6.381 -0.636 1.00 . A A . 5 HIS CB 1 1 13 3515 1 1 5 HIS CD2 C 3.612 -7.625 1.642 1.00 . A A . 5 HIS CD2 1 1 13 3516 1 1 5 HIS CE1 C 4.344 -9.543 0.886 1.00 . A A . 5 HIS CE1 1 1 13 3517 1 1 5 HIS CG C 3.714 -7.519 0.295 1.00 . A A . 5 HIS CG 1 1 13 3518 1 1 5 HIS H H 0.822 -6.370 0.140 1.00 . A A . 5 HIS H 1 1 13 3519 1 1 5 HIS HA H 3.208 -4.745 0.739 1.00 . A A . 5 HIS HA 1 1 13 3520 1 1 5 HIS HB2 H 2.854 -6.782 -1.469 1.00 . A A . 5 HIS HB2 1 1 13 3521 1 1 5 HIS HB3 H 4.349 -5.989 -0.998 1.00 . A A . 5 HIS HB3 1 1 13 3522 1 1 5 HIS HD1 H 4.335 -8.986 -1.079 1.00 . A A . 5 HIS HD1 1 1 13 3523 1 1 5 HIS HD2 H 3.281 -6.852 2.320 1.00 . A A . 5 HIS HD2 1 1 13 3524 1 1 5 HIS HE1 H 4.696 -10.563 0.839 1.00 . A A . 5 HIS HE1 1 1 13 3525 1 1 5 HIS HE2 H 3.797 -9.329 2.839 1.00 . A A . 5 HIS HE2 1 1 13 3526 1 1 5 HIS N N 1.402 -5.745 0.640 1.00 . A A . 5 HIS N 1 1 13 3527 1 1 5 HIS ND1 N 4.177 -8.739 -0.145 1.00 . A A . 5 HIS ND1 1 1 13 3528 1 1 5 HIS NE2 N 4.008 -8.895 1.987 1.00 . A A . 5 HIS NE2 1 1 13 3529 1 1 5 HIS O O 2.857 -3.159 -1.186 1.00 . A A . 5 HIS O 1 1 13 3530 1 1 6 VAL C C -0.222 -2.739 -2.596 1.00 . A A . 6 VAL C 1 1 13 3531 1 1 6 VAL CA C 0.883 -3.691 -3.037 1.00 . A A . 6 VAL CA 1 1 13 3532 1 1 6 VAL CB C 0.437 -4.488 -4.285 1.00 . A A . 6 VAL CB 1 1 13 3533 1 1 6 VAL CG1 C 1.648 -5.033 -5.023 1.00 . A A . 6 VAL CG1 1 1 13 3534 1 1 6 VAL CG2 C -0.502 -5.623 -3.903 1.00 . A A . 6 VAL CG2 1 1 13 3535 1 1 6 VAL H H 0.834 -5.440 -1.837 1.00 . A A . 6 VAL H 1 1 13 3536 1 1 6 VAL HA H 1.748 -3.103 -3.311 1.00 . A A . 6 VAL HA 1 1 13 3537 1 1 6 VAL HB H -0.090 -3.817 -4.948 1.00 . A A . 6 VAL HB 1 1 13 3538 1 1 6 VAL HG11 H 2.480 -5.114 -4.340 1.00 . A A . 6 VAL HG11 1 1 13 3539 1 1 6 VAL HG12 H 1.909 -4.367 -5.832 1.00 . A A . 6 VAL HG12 1 1 13 3540 1 1 6 VAL HG13 H 1.416 -6.010 -5.423 1.00 . A A . 6 VAL HG13 1 1 13 3541 1 1 6 VAL HG21 H -0.347 -6.456 -4.572 1.00 . A A . 6 VAL HG21 1 1 13 3542 1 1 6 VAL HG22 H -1.524 -5.284 -3.977 1.00 . A A . 6 VAL HG22 1 1 13 3543 1 1 6 VAL HG23 H -0.298 -5.932 -2.889 1.00 . A A . 6 VAL HG23 1 1 13 3544 1 1 6 VAL N N 1.286 -4.573 -1.946 1.00 . A A . 6 VAL N 1 1 13 3545 1 1 6 VAL O O -1.269 -3.172 -2.126 1.00 . A A . 6 VAL O 1 1 13 3546 1 1 7 PRO C C -2.241 -0.381 -3.104 1.00 . A A . 7 PRO C 1 1 13 3547 1 1 7 PRO CA C -0.935 -0.384 -2.311 1.00 . A A . 7 PRO CA 1 1 13 3548 1 1 7 PRO CB C -0.170 0.919 -2.557 1.00 . A A . 7 PRO CB 1 1 13 3549 1 1 7 PRO CD C 1.266 -0.851 -3.251 1.00 . A A . 7 PRO CD 1 1 13 3550 1 1 7 PRO CG C 0.889 0.570 -3.545 1.00 . A A . 7 PRO CG 1 1 13 3551 1 1 7 PRO HA H -1.166 -0.463 -1.259 1.00 . A A . 7 PRO HA 1 1 13 3552 1 1 7 PRO HB2 H -0.844 1.666 -2.951 1.00 . A A . 7 PRO HB2 1 1 13 3553 1 1 7 PRO HB3 H 0.258 1.269 -1.629 1.00 . A A . 7 PRO HB3 1 1 13 3554 1 1 7 PRO HD2 H 1.570 -1.356 -4.155 1.00 . A A . 7 PRO HD2 1 1 13 3555 1 1 7 PRO HD3 H 2.053 -0.889 -2.512 1.00 . A A . 7 PRO HD3 1 1 13 3556 1 1 7 PRO HG2 H 0.497 0.656 -4.548 1.00 . A A . 7 PRO HG2 1 1 13 3557 1 1 7 PRO HG3 H 1.742 1.219 -3.415 1.00 . A A . 7 PRO HG3 1 1 13 3558 1 1 7 PRO N N 0.020 -1.427 -2.720 1.00 . A A . 7 PRO N 1 1 13 3559 1 1 7 PRO O O -2.249 -0.556 -4.321 1.00 . A A . 7 PRO O 1 1 13 3560 1 1 8 GLU C C -5.005 1.349 -3.368 1.00 . A A . 8 GLU C 1 1 13 3561 1 1 8 GLU CA C -4.662 -0.087 -3.001 1.00 . A A . 8 GLU CA 1 1 13 3562 1 1 8 GLU CB C -5.731 -0.625 -2.046 1.00 . A A . 8 GLU CB 1 1 13 3563 1 1 8 GLU CD C -6.836 -2.630 -0.985 1.00 . A A . 8 GLU CD 1 1 13 3564 1 1 8 GLU CG C -5.691 -2.126 -1.843 1.00 . A A . 8 GLU CG 1 1 13 3565 1 1 8 GLU H H -3.255 -0.001 -1.425 1.00 . A A . 8 GLU H 1 1 13 3566 1 1 8 GLU HA H -4.650 -0.689 -3.897 1.00 . A A . 8 GLU HA 1 1 13 3567 1 1 8 GLU HB2 H -5.602 -0.154 -1.083 1.00 . A A . 8 GLU HB2 1 1 13 3568 1 1 8 GLU HB3 H -6.705 -0.362 -2.434 1.00 . A A . 8 GLU HB3 1 1 13 3569 1 1 8 GLU HG2 H -5.746 -2.608 -2.808 1.00 . A A . 8 GLU HG2 1 1 13 3570 1 1 8 GLU HG3 H -4.760 -2.387 -1.364 1.00 . A A . 8 GLU HG3 1 1 13 3571 1 1 8 GLU N N -3.342 -0.152 -2.391 1.00 . A A . 8 GLU N 1 1 13 3572 1 1 8 GLU O O -5.038 1.714 -4.541 1.00 . A A . 8 GLU O 1 1 13 3573 1 1 8 GLU OE1 O -7.126 -3.843 -1.008 1.00 . A A . 8 GLU OE1 1 1 13 3574 1 1 9 TYR C C -4.727 4.462 -1.704 1.00 . A A . 9 TYR C 1 1 13 3575 1 1 9 TYR CA C -5.608 3.562 -2.556 1.00 . A A . 9 TYR CA 1 1 13 3576 1 1 9 TYR CB C -7.083 3.826 -2.219 1.00 . A A . 9 TYR CB 1 1 13 3577 1 1 9 TYR CD1 C -8.314 1.717 -2.887 1.00 . A A . 9 TYR CD1 1 1 13 3578 1 1 9 TYR CD2 C -8.753 3.715 -4.110 1.00 . A A . 9 TYR CD2 1 1 13 3579 1 1 9 TYR CE1 C -9.209 1.028 -3.682 1.00 . A A . 9 TYR CE1 1 1 13 3580 1 1 9 TYR CE2 C -9.652 3.033 -4.909 1.00 . A A . 9 TYR CE2 1 1 13 3581 1 1 9 TYR CG C -8.070 3.070 -3.087 1.00 . A A . 9 TYR CG 1 1 13 3582 1 1 9 TYR CZ C -9.876 1.691 -4.690 1.00 . A A . 9 TYR CZ 1 1 13 3583 1 1 9 TYR H H -5.224 1.811 -1.431 1.00 . A A . 9 TYR H 1 1 13 3584 1 1 9 TYR HA H -5.441 3.794 -3.596 1.00 . A A . 9 TYR HA 1 1 13 3585 1 1 9 TYR HB2 H -7.262 3.544 -1.195 1.00 . A A . 9 TYR HB2 1 1 13 3586 1 1 9 TYR HB3 H -7.282 4.882 -2.334 1.00 . A A . 9 TYR HB3 1 1 13 3587 1 1 9 TYR HD1 H -7.791 1.200 -2.097 1.00 . A A . 9 TYR HD1 1 1 13 3588 1 1 9 TYR HD2 H -8.575 4.767 -4.280 1.00 . A A . 9 TYR HD2 1 1 13 3589 1 1 9 TYR HE1 H -9.386 -0.023 -3.511 1.00 . A A . 9 TYR HE1 1 1 13 3590 1 1 9 TYR HE2 H -10.174 3.552 -5.698 1.00 . A A . 9 TYR HE2 1 1 13 3591 1 1 9 TYR HH H -10.292 0.387 -6.040 1.00 . A A . 9 TYR HH 1 1 13 3592 1 1 9 TYR N N -5.262 2.163 -2.350 1.00 . A A . 9 TYR N 1 1 13 3593 1 1 9 TYR O O -4.390 4.127 -0.563 1.00 . A A . 9 TYR O 1 1 13 3594 1 1 9 TYR OH O -10.769 1.008 -5.483 1.00 . A A . 9 TYR OH 1 1 13 3595 1 1 10 PHE C C -4.390 7.664 -0.968 1.00 . A A . 10 PHE C 1 1 13 3596 1 1 10 PHE CA C -3.527 6.570 -1.571 1.00 . A A . 10 PHE CA 1 1 13 3597 1 1 10 PHE CB C -2.495 7.204 -2.511 1.00 . A A . 10 PHE CB 1 1 13 3598 1 1 10 PHE CD1 C -1.899 5.119 -3.805 1.00 . A A . 10 PHE CD1 1 1 13 3599 1 1 10 PHE CD2 C -0.135 6.478 -2.957 1.00 . A A . 10 PHE CD2 1 1 13 3600 1 1 10 PHE CE1 C -0.973 4.249 -4.348 1.00 . A A . 10 PHE CE1 1 1 13 3601 1 1 10 PHE CE2 C 0.797 5.613 -3.501 1.00 . A A . 10 PHE CE2 1 1 13 3602 1 1 10 PHE CG C -1.492 6.243 -3.102 1.00 . A A . 10 PHE CG 1 1 13 3603 1 1 10 PHE CZ C 0.376 4.497 -4.195 1.00 . A A . 10 PHE CZ 1 1 13 3604 1 1 10 PHE H H -4.673 5.805 -3.170 1.00 . A A . 10 PHE H 1 1 13 3605 1 1 10 PHE HA H -3.011 6.054 -0.775 1.00 . A A . 10 PHE HA 1 1 13 3606 1 1 10 PHE HB2 H -3.014 7.679 -3.323 1.00 . A A . 10 PHE HB2 1 1 13 3607 1 1 10 PHE HB3 H -1.946 7.956 -1.963 1.00 . A A . 10 PHE HB3 1 1 13 3608 1 1 10 PHE HD1 H -2.955 4.924 -3.925 1.00 . A A . 10 PHE HD1 1 1 13 3609 1 1 10 PHE HD2 H 0.198 7.349 -2.412 1.00 . A A . 10 PHE HD2 1 1 13 3610 1 1 10 PHE HE1 H -1.306 3.377 -4.892 1.00 . A A . 10 PHE HE1 1 1 13 3611 1 1 10 PHE HE2 H 1.852 5.809 -3.380 1.00 . A A . 10 PHE HE2 1 1 13 3612 1 1 10 PHE HZ H 1.101 3.819 -4.620 1.00 . A A . 10 PHE HZ 1 1 13 3613 1 1 10 PHE N N -4.361 5.603 -2.265 1.00 . A A . 10 PHE N 1 1 13 3614 1 1 10 PHE O O -5.444 8.001 -1.503 1.00 . A A . 10 PHE O 1 1 13 3615 1 1 11 VAL C C -4.228 10.646 0.213 1.00 . A A . 11 VAL C 1 1 13 3616 1 1 11 VAL CA C -4.651 9.292 0.803 1.00 . A A . 11 VAL CA 1 1 13 3617 1 1 11 VAL CB C -4.430 9.248 2.335 1.00 . A A . 11 VAL CB 1 1 13 3618 1 1 11 VAL CG1 C -3.046 9.739 2.705 1.00 . A A . 11 VAL CG1 1 1 13 3619 1 1 11 VAL CG2 C -5.505 10.032 3.076 1.00 . A A . 11 VAL CG2 1 1 13 3620 1 1 11 VAL H H -3.072 7.914 0.499 1.00 . A A . 11 VAL H 1 1 13 3621 1 1 11 VAL HA H -5.705 9.147 0.608 1.00 . A A . 11 VAL HA 1 1 13 3622 1 1 11 VAL HB H -4.503 8.216 2.648 1.00 . A A . 11 VAL HB 1 1 13 3623 1 1 11 VAL HG11 H -3.086 10.252 3.654 1.00 . A A . 11 VAL HG11 1 1 13 3624 1 1 11 VAL HG12 H -2.689 10.419 1.944 1.00 . A A . 11 VAL HG12 1 1 13 3625 1 1 11 VAL HG13 H -2.373 8.898 2.781 1.00 . A A . 11 VAL HG13 1 1 13 3626 1 1 11 VAL HG21 H -6.458 9.887 2.588 1.00 . A A . 11 VAL HG21 1 1 13 3627 1 1 11 VAL HG22 H -5.256 11.083 3.068 1.00 . A A . 11 VAL HG22 1 1 13 3628 1 1 11 VAL HG23 H -5.566 9.685 4.097 1.00 . A A . 11 VAL HG23 1 1 13 3629 1 1 11 VAL N N -3.931 8.222 0.135 1.00 . A A . 11 VAL N 1 1 13 3630 1 1 11 VAL O O -3.311 10.706 -0.610 1.00 . A A . 11 VAL O 1 1 13 3631 1 1 12 GLY C C -3.331 13.662 0.599 1.00 . A A . 12 GLY C 1 1 13 3632 1 1 12 GLY CA C -4.626 13.047 0.105 1.00 . A A . 12 GLY CA 1 1 13 3633 1 1 12 GLY H H -5.631 11.594 1.256 1.00 . A A . 12 GLY H 1 1 13 3634 1 1 12 GLY HA2 H -4.589 12.999 -0.973 1.00 . A A . 12 GLY HA2 1 1 13 3635 1 1 12 GLY HA3 H -5.437 13.692 0.387 1.00 . A A . 12 GLY HA3 1 1 13 3636 1 1 12 GLY N N -4.909 11.713 0.615 1.00 . A A . 12 GLY N 1 1 13 3637 1 1 12 GLY O O -3.281 14.855 0.889 1.00 . A A . 12 GLY O 1 1 13 3638 1 1 13 ILE C C 0.142 12.493 0.496 1.00 . A A . 13 ILE C 1 1 13 3639 1 1 13 ILE CA C -0.978 13.360 1.090 1.00 . A A . 13 ILE CA 1 1 13 3640 1 1 13 ILE CB C -0.869 13.464 2.638 1.00 . A A . 13 ILE CB 1 1 13 3641 1 1 13 ILE CD1 C 0.197 15.782 2.585 1.00 . A A . 13 ILE CD1 1 1 13 3642 1 1 13 ILE CG1 C 0.319 14.343 3.044 1.00 . A A . 13 ILE CG1 1 1 13 3643 1 1 13 ILE CG2 C -0.757 12.095 3.287 1.00 . A A . 13 ILE CG2 1 1 13 3644 1 1 13 ILE H H -2.394 11.930 0.397 1.00 . A A . 13 ILE H 1 1 13 3645 1 1 13 ILE HA H -0.872 14.355 0.683 1.00 . A A . 13 ILE HA 1 1 13 3646 1 1 13 ILE HB H -1.776 13.924 3.002 1.00 . A A . 13 ILE HB 1 1 13 3647 1 1 13 ILE HD11 H 0.989 16.368 3.024 1.00 . A A . 13 ILE HD11 1 1 13 3648 1 1 13 ILE HD12 H -0.759 16.177 2.896 1.00 . A A . 13 ILE HD12 1 1 13 3649 1 1 13 ILE HD13 H 0.272 15.822 1.509 1.00 . A A . 13 ILE HD13 1 1 13 3650 1 1 13 ILE HG12 H 0.406 14.347 4.121 1.00 . A A . 13 ILE HG12 1 1 13 3651 1 1 13 ILE HG13 H 1.223 13.934 2.616 1.00 . A A . 13 ILE HG13 1 1 13 3652 1 1 13 ILE HG21 H -0.621 12.211 4.352 1.00 . A A . 13 ILE HG21 1 1 13 3653 1 1 13 ILE HG22 H 0.091 11.570 2.871 1.00 . A A . 13 ILE HG22 1 1 13 3654 1 1 13 ILE HG23 H -1.658 11.533 3.097 1.00 . A A . 13 ILE HG23 1 1 13 3655 1 1 13 ILE N N -2.285 12.867 0.664 1.00 . A A . 13 ILE N 1 1 13 3656 1 1 13 ILE O O 1.241 12.382 1.037 1.00 . A A . 13 ILE O 1 1 13 3657 1 1 14 GLY C C 1.319 9.888 -0.657 1.00 . A A . 14 GLY C 1 1 13 3658 1 1 14 GLY CA C 0.812 11.114 -1.400 1.00 . A A . 14 GLY CA 1 1 13 3659 1 1 14 GLY H H -1.035 12.094 -1.060 1.00 . A A . 14 GLY H 1 1 13 3660 1 1 14 GLY HA2 H 0.350 10.785 -2.319 1.00 . A A . 14 GLY HA2 1 1 13 3661 1 1 14 GLY HA3 H 1.657 11.739 -1.650 1.00 . A A . 14 GLY HA3 1 1 13 3662 1 1 14 GLY N N -0.154 11.926 -0.669 1.00 . A A . 14 GLY N 1 1 13 3663 1 1 14 GLY O O 2.512 9.594 -0.698 1.00 . A A . 14 GLY O 1 1 13 3664 1 1 15 THR C C -0.312 6.940 0.748 1.00 . A A . 15 THR C 1 1 13 3665 1 1 15 THR CA C 0.840 7.948 0.702 1.00 . A A . 15 THR CA 1 1 13 3666 1 1 15 THR CB C 1.364 8.259 2.128 1.00 . A A . 15 THR CB 1 1 13 3667 1 1 15 THR CG2 C 0.263 8.792 3.029 1.00 . A A . 15 THR CG2 1 1 13 3668 1 1 15 THR H H -0.511 9.408 -0.017 1.00 . A A . 15 THR H 1 1 13 3669 1 1 15 THR HA H 1.651 7.504 0.140 1.00 . A A . 15 THR HA 1 1 13 3670 1 1 15 THR HB H 2.134 9.013 2.049 1.00 . A A . 15 THR HB 1 1 13 3671 1 1 15 THR HG1 H 2.784 7.298 3.101 1.00 . A A . 15 THR HG1 1 1 13 3672 1 1 15 THR HG21 H -0.618 8.175 2.924 1.00 . A A . 15 THR HG21 1 1 13 3673 1 1 15 THR HG22 H 0.027 9.807 2.748 1.00 . A A . 15 THR HG22 1 1 13 3674 1 1 15 THR HG23 H 0.596 8.769 4.056 1.00 . A A . 15 THR HG23 1 1 13 3675 1 1 15 THR N N 0.433 9.153 -0.006 1.00 . A A . 15 THR N 1 1 13 3676 1 1 15 THR O O -1.469 7.314 0.962 1.00 . A A . 15 THR O 1 1 13 3677 1 1 15 THR OG1 O 1.929 7.083 2.719 1.00 . A A . 15 THR OG1 1 1 13 3678 1 1 16 PRO C C -1.446 4.169 1.908 1.00 . A A . 16 PRO C 1 1 13 3679 1 1 16 PRO CA C -1.027 4.597 0.505 1.00 . A A . 16 PRO CA 1 1 13 3680 1 1 16 PRO CB C -0.327 3.449 -0.217 1.00 . A A . 16 PRO CB 1 1 13 3681 1 1 16 PRO CD C 1.332 5.131 0.208 1.00 . A A . 16 PRO CD 1 1 13 3682 1 1 16 PRO CG C 1.124 3.646 0.063 1.00 . A A . 16 PRO CG 1 1 13 3683 1 1 16 PRO HA H -1.902 4.893 -0.054 1.00 . A A . 16 PRO HA 1 1 13 3684 1 1 16 PRO HB2 H -0.681 2.506 0.173 1.00 . A A . 16 PRO HB2 1 1 13 3685 1 1 16 PRO HB3 H -0.535 3.507 -1.276 1.00 . A A . 16 PRO HB3 1 1 13 3686 1 1 16 PRO HD2 H 2.013 5.336 1.020 1.00 . A A . 16 PRO HD2 1 1 13 3687 1 1 16 PRO HD3 H 1.707 5.549 -0.713 1.00 . A A . 16 PRO HD3 1 1 13 3688 1 1 16 PRO HG2 H 1.389 3.141 0.979 1.00 . A A . 16 PRO HG2 1 1 13 3689 1 1 16 PRO HG3 H 1.710 3.265 -0.759 1.00 . A A . 16 PRO HG3 1 1 13 3690 1 1 16 PRO N N -0.016 5.652 0.510 1.00 . A A . 16 PRO N 1 1 13 3691 1 1 16 PRO O O -0.611 3.815 2.738 1.00 . A A . 16 PRO O 1 1 13 3692 1 1 17 ILE C C -4.107 2.515 3.282 1.00 . A A . 17 ILE C 1 1 13 3693 1 1 17 ILE CA C -3.277 3.784 3.457 1.00 . A A . 17 ILE CA 1 1 13 3694 1 1 17 ILE CB C -4.132 4.905 4.104 1.00 . A A . 17 ILE CB 1 1 13 3695 1 1 17 ILE CD1 C -2.110 6.337 4.743 1.00 . A A . 17 ILE CD1 1 1 13 3696 1 1 17 ILE CG1 C -3.423 6.260 3.988 1.00 . A A . 17 ILE CG1 1 1 13 3697 1 1 17 ILE CG2 C -4.415 4.594 5.571 1.00 . A A . 17 ILE CG2 1 1 13 3698 1 1 17 ILE H H -3.368 4.461 1.454 1.00 . A A . 17 ILE H 1 1 13 3699 1 1 17 ILE HA H -2.440 3.566 4.105 1.00 . A A . 17 ILE HA 1 1 13 3700 1 1 17 ILE HB H -5.075 4.955 3.583 1.00 . A A . 17 ILE HB 1 1 13 3701 1 1 17 ILE HD11 H -1.300 6.473 4.043 1.00 . A A . 17 ILE HD11 1 1 13 3702 1 1 17 ILE HD12 H -1.959 5.421 5.296 1.00 . A A . 17 ILE HD12 1 1 13 3703 1 1 17 ILE HD13 H -2.137 7.172 5.429 1.00 . A A . 17 ILE HD13 1 1 13 3704 1 1 17 ILE HG12 H -3.217 6.462 2.949 1.00 . A A . 17 ILE HG12 1 1 13 3705 1 1 17 ILE HG13 H -4.073 7.031 4.376 1.00 . A A . 17 ILE HG13 1 1 13 3706 1 1 17 ILE HG21 H -5.306 5.120 5.885 1.00 . A A . 17 ILE HG21 1 1 13 3707 1 1 17 ILE HG22 H -3.579 4.914 6.176 1.00 . A A . 17 ILE HG22 1 1 13 3708 1 1 17 ILE HG23 H -4.564 3.532 5.693 1.00 . A A . 17 ILE HG23 1 1 13 3709 1 1 17 ILE N N -2.747 4.186 2.160 1.00 . A A . 17 ILE N 1 1 13 3710 1 1 17 ILE O O -5.151 2.328 3.904 1.00 . A A . 17 ILE O 1 1 13 3711 1 1 18 SER C C -3.444 -0.409 1.110 1.00 . A A . 18 SER C 1 1 13 3712 1 1 18 SER CA C -4.274 0.383 2.109 1.00 . A A . 18 SER CA 1 1 13 3713 1 1 18 SER CB C -5.680 0.615 1.549 1.00 . A A . 18 SER CB 1 1 13 3714 1 1 18 SER H H -2.783 1.867 1.949 1.00 . A A . 18 SER H 1 1 13 3715 1 1 18 SER HA H -4.347 -0.182 3.027 1.00 . A A . 18 SER HA 1 1 13 3716 1 1 18 SER HB2 H -6.082 -0.322 1.193 1.00 . A A . 18 SER HB2 1 1 13 3717 1 1 18 SER HB3 H -6.315 1.003 2.330 1.00 . A A . 18 SER HB3 1 1 13 3718 1 1 18 SER HG H -5.399 2.408 0.806 1.00 . A A . 18 SER HG 1 1 13 3719 1 1 18 SER N N -3.619 1.647 2.410 1.00 . A A . 18 SER N 1 1 13 3720 1 1 18 SER O O -2.773 0.174 0.258 1.00 . A A . 18 SER O 1 1 13 3721 1 1 18 SER OG O -5.659 1.540 0.472 1.00 . A A . 18 SER OG 1 1 13 3722 1 1 19 PHE C C -3.568 -3.866 0.056 1.00 . A A . 19 PHE C 1 1 13 3723 1 1 19 PHE CA C -2.746 -2.608 0.325 1.00 . A A . 19 PHE CA 1 1 13 3724 1 1 19 PHE CB C -1.386 -3.010 0.910 1.00 . A A . 19 PHE CB 1 1 13 3725 1 1 19 PHE CD1 C -0.828 -1.417 2.778 1.00 . A A . 19 PHE CD1 1 1 13 3726 1 1 19 PHE CD2 C 0.439 -1.292 0.761 1.00 . A A . 19 PHE CD2 1 1 13 3727 1 1 19 PHE CE1 C -0.084 -0.383 3.312 1.00 . A A . 19 PHE CE1 1 1 13 3728 1 1 19 PHE CE2 C 1.186 -0.258 1.291 1.00 . A A . 19 PHE CE2 1 1 13 3729 1 1 19 PHE CG C -0.575 -1.884 1.495 1.00 . A A . 19 PHE CG 1 1 13 3730 1 1 19 PHE CZ C 0.924 0.198 2.569 1.00 . A A . 19 PHE CZ 1 1 13 3731 1 1 19 PHE H H -4.050 -2.127 1.926 1.00 . A A . 19 PHE H 1 1 13 3732 1 1 19 PHE HA H -2.593 -2.083 -0.609 1.00 . A A . 19 PHE HA 1 1 13 3733 1 1 19 PHE HB2 H -1.548 -3.738 1.685 1.00 . A A . 19 PHE HB2 1 1 13 3734 1 1 19 PHE HB3 H -0.798 -3.466 0.126 1.00 . A A . 19 PHE HB3 1 1 13 3735 1 1 19 PHE HD1 H -1.615 -1.870 3.361 1.00 . A A . 19 PHE HD1 1 1 13 3736 1 1 19 PHE HD2 H 0.645 -1.646 -0.238 1.00 . A A . 19 PHE HD2 1 1 13 3737 1 1 19 PHE HE1 H -0.289 -0.029 4.312 1.00 . A A . 19 PHE HE1 1 1 13 3738 1 1 19 PHE HE2 H 1.973 0.195 0.707 1.00 . A A . 19 PHE HE2 1 1 13 3739 1 1 19 PHE HZ H 1.507 1.006 2.985 1.00 . A A . 19 PHE HZ 1 1 13 3740 1 1 19 PHE N N -3.490 -1.729 1.219 1.00 . A A . 19 PHE N 1 1 13 3741 1 1 19 PHE O O -4.604 -4.070 0.684 1.00 . A A . 19 PHE O 1 1 13 3742 1 1 20 TYR C C -3.250 -7.108 -0.435 1.00 . A A . 20 TYR C 1 1 13 3743 1 1 20 TYR CA C -3.829 -5.928 -1.200 1.00 . A A . 20 TYR CA 1 1 13 3744 1 1 20 TYR CB C -3.771 -6.229 -2.704 1.00 . A A . 20 TYR CB 1 1 13 3745 1 1 20 TYR CD1 C -3.699 -4.063 -4.005 1.00 . A A . 20 TYR CD1 1 1 13 3746 1 1 20 TYR CD2 C -5.721 -5.324 -4.030 1.00 . A A . 20 TYR CD2 1 1 13 3747 1 1 20 TYR CE1 C -4.275 -3.114 -4.828 1.00 . A A . 20 TYR CE1 1 1 13 3748 1 1 20 TYR CE2 C -6.304 -4.380 -4.854 1.00 . A A . 20 TYR CE2 1 1 13 3749 1 1 20 TYR CG C -4.410 -5.181 -3.590 1.00 . A A . 20 TYR CG 1 1 13 3750 1 1 20 TYR CZ C -5.577 -3.277 -5.248 1.00 . A A . 20 TYR CZ 1 1 13 3751 1 1 20 TYR H H -2.270 -4.483 -1.341 1.00 . A A . 20 TYR H 1 1 13 3752 1 1 20 TYR HA H -4.858 -5.800 -0.908 1.00 . A A . 20 TYR HA 1 1 13 3753 1 1 20 TYR HB2 H -2.736 -6.319 -3.001 1.00 . A A . 20 TYR HB2 1 1 13 3754 1 1 20 TYR HB3 H -4.271 -7.170 -2.891 1.00 . A A . 20 TYR HB3 1 1 13 3755 1 1 20 TYR HD1 H -2.678 -3.938 -3.675 1.00 . A A . 20 TYR HD1 1 1 13 3756 1 1 20 TYR HD2 H -6.289 -6.188 -3.716 1.00 . A A . 20 TYR HD2 1 1 13 3757 1 1 20 TYR HE1 H -3.706 -2.251 -5.137 1.00 . A A . 20 TYR HE1 1 1 13 3758 1 1 20 TYR HE2 H -7.324 -4.508 -5.185 1.00 . A A . 20 TYR HE2 1 1 13 3759 1 1 20 TYR HH H -5.511 -1.646 -6.264 1.00 . A A . 20 TYR HH 1 1 13 3760 1 1 20 TYR N N -3.111 -4.698 -0.870 1.00 . A A . 20 TYR N 1 1 13 3761 1 1 20 TYR O O -3.945 -7.780 0.324 1.00 . A A . 20 TYR O 1 1 13 3762 1 1 20 TYR OH O -6.156 -2.333 -6.066 1.00 . A A . 20 TYR OH 1 1 13 3763 1 1 21 GLY C C 0.197 -8.363 -0.326 1.00 . A A . 21 GLY C 1 1 13 3764 1 1 21 GLY CA C -1.274 -8.430 -0.007 1.00 . A A . 21 GLY CA 1 1 13 3765 1 1 21 GLY H H -1.482 -6.768 -1.275 1.00 . A A . 21 GLY H 1 1 13 3766 1 1 21 GLY HA2 H -1.414 -8.358 1.062 1.00 . A A . 21 GLY HA2 1 1 13 3767 1 1 21 GLY HA3 H -1.672 -9.369 -0.359 1.00 . A A . 21 GLY HA3 1 1 13 3768 1 1 21 GLY N N -1.970 -7.342 -0.654 1.00 . A A . 21 GLY N 1 1 13 3769 1 1 21 GLY O O 0.566 -7.519 -1.174 1.00 . A A . 21 GLY O 1 1 13 3770 1 1 21 GLY OXT O 0.991 -9.105 0.285 1.00 . A A . 21 GLY OXT 1 1 14 3771 1 1 1 GLY C C -8.151 -2.543 2.247 1.00 . A A . 1 GLY C 1 1 14 3772 1 1 1 GLY CA C -8.522 -2.271 0.799 1.00 . A A . 1 GLY CA 1 1 14 3773 1 1 1 GLY H2 H -7.215 -0.874 -0.112 1.00 . A A . 1 GLY H2 1 1 14 3774 1 1 1 GLY HA2 H -9.284 -1.508 0.776 1.00 . A A . 1 GLY HA2 1 1 14 3775 1 1 1 GLY HA3 H -8.924 -3.176 0.369 1.00 . A A . 1 GLY HA3 1 1 14 3776 1 1 1 GLY N N -7.400 -1.831 -0.011 1.00 . A A . 1 GLY N 1 1 14 3777 1 1 1 GLY O O -8.868 -2.134 3.156 1.00 . A A . 1 GLY O 1 1 14 3778 1 1 2 GLY C C -5.133 -3.422 4.016 1.00 . A A . 2 GLY C 1 1 14 3779 1 1 2 GLY CA C -6.627 -3.554 3.818 1.00 . A A . 2 GLY CA 1 1 14 3780 1 1 2 GLY H H -6.509 -3.549 1.700 1.00 . A A . 2 GLY H 1 1 14 3781 1 1 2 GLY HA2 H -7.128 -2.885 4.501 1.00 . A A . 2 GLY HA2 1 1 14 3782 1 1 2 GLY HA3 H -6.921 -4.568 4.045 1.00 . A A . 2 GLY HA3 1 1 14 3783 1 1 2 GLY N N -7.043 -3.238 2.464 1.00 . A A . 2 GLY N 1 1 14 3784 1 1 2 GLY O O -4.566 -2.351 3.808 1.00 . A A . 2 GLY O 1 1 14 3785 1 1 3 ALA C C -2.407 -5.637 3.829 1.00 . A A . 3 ALA C 1 1 14 3786 1 1 3 ALA CA C -3.054 -4.520 4.633 1.00 . A A . 3 ALA CA 1 1 14 3787 1 1 3 ALA CB C -2.744 -4.677 6.114 1.00 . A A . 3 ALA CB 1 1 14 3788 1 1 3 ALA H H -4.998 -5.337 4.553 1.00 . A A . 3 ALA H 1 1 14 3789 1 1 3 ALA HA H -2.656 -3.571 4.300 1.00 . A A . 3 ALA HA 1 1 14 3790 1 1 3 ALA HB1 H -1.690 -4.511 6.280 1.00 . A A . 3 ALA HB1 1 1 14 3791 1 1 3 ALA HB2 H -3.006 -5.674 6.434 1.00 . A A . 3 ALA HB2 1 1 14 3792 1 1 3 ALA HB3 H -3.315 -3.956 6.680 1.00 . A A . 3 ALA HB3 1 1 14 3793 1 1 3 ALA N N -4.493 -4.510 4.412 1.00 . A A . 3 ALA N 1 1 14 3794 1 1 3 ALA O O -2.993 -6.707 3.668 1.00 . A A . 3 ALA O 1 1 14 3795 1 1 4 GLY C C 0.826 -5.900 2.034 1.00 . A A . 4 GLY C 1 1 14 3796 1 1 4 GLY CA C -0.522 -6.380 2.527 1.00 . A A . 4 GLY CA 1 1 14 3797 1 1 4 GLY H H -0.795 -4.511 3.472 1.00 . A A . 4 GLY H 1 1 14 3798 1 1 4 GLY HA2 H -0.377 -7.265 3.129 1.00 . A A . 4 GLY HA2 1 1 14 3799 1 1 4 GLY HA3 H -1.135 -6.634 1.675 1.00 . A A . 4 GLY HA3 1 1 14 3800 1 1 4 GLY N N -1.211 -5.383 3.317 1.00 . A A . 4 GLY N 1 1 14 3801 1 1 4 GLY O O 1.670 -5.484 2.829 1.00 . A A . 4 GLY O 1 1 14 3802 1 1 5 HIS C C 2.131 -4.388 -0.831 1.00 . A A . 5 HIS C 1 1 14 3803 1 1 5 HIS CA C 2.318 -5.539 0.150 1.00 . A A . 5 HIS CA 1 1 14 3804 1 1 5 HIS CB C 3.014 -6.707 -0.554 1.00 . A A . 5 HIS CB 1 1 14 3805 1 1 5 HIS CD2 C 2.854 -9.200 0.138 1.00 . A A . 5 HIS CD2 1 1 14 3806 1 1 5 HIS CE1 C 3.856 -9.060 2.081 1.00 . A A . 5 HIS CE1 1 1 14 3807 1 1 5 HIS CG C 3.210 -7.907 0.318 1.00 . A A . 5 HIS CG 1 1 14 3808 1 1 5 HIS H H 0.338 -6.318 0.133 1.00 . A A . 5 HIS H 1 1 14 3809 1 1 5 HIS HA H 2.944 -5.200 0.961 1.00 . A A . 5 HIS HA 1 1 14 3810 1 1 5 HIS HB2 H 2.424 -7.010 -1.406 1.00 . A A . 5 HIS HB2 1 1 14 3811 1 1 5 HIS HB3 H 3.987 -6.382 -0.897 1.00 . A A . 5 HIS HB3 1 1 14 3812 1 1 5 HIS HD1 H 4.199 -7.045 1.967 1.00 . A A . 5 HIS HD1 1 1 14 3813 1 1 5 HIS HD2 H 2.340 -9.609 -0.721 1.00 . A A . 5 HIS HD2 1 1 14 3814 1 1 5 HIS HE1 H 4.282 -9.319 3.039 1.00 . A A . 5 HIS HE1 1 1 14 3815 1 1 5 HIS HE2 H 2.992 -10.811 1.469 1.00 . A A . 5 HIS HE2 1 1 14 3816 1 1 5 HIS N N 1.045 -5.967 0.725 1.00 . A A . 5 HIS N 1 1 14 3817 1 1 5 HIS ND1 N 3.836 -7.853 1.546 1.00 . A A . 5 HIS ND1 1 1 14 3818 1 1 5 HIS NE2 N 3.265 -9.896 1.248 1.00 . A A . 5 HIS NE2 1 1 14 3819 1 1 5 HIS O O 2.724 -3.323 -0.664 1.00 . A A . 5 HIS O 1 1 14 3820 1 1 6 VAL C C -0.092 -2.683 -2.432 1.00 . A A . 6 VAL C 1 1 14 3821 1 1 6 VAL CA C 1.073 -3.575 -2.856 1.00 . A A . 6 VAL CA 1 1 14 3822 1 1 6 VAL CB C 0.787 -4.199 -4.240 1.00 . A A . 6 VAL CB 1 1 14 3823 1 1 6 VAL CG1 C 0.610 -3.121 -5.302 1.00 . A A . 6 VAL CG1 1 1 14 3824 1 1 6 VAL CG2 C 1.900 -5.157 -4.634 1.00 . A A . 6 VAL CG2 1 1 14 3825 1 1 6 VAL H H 0.869 -5.483 -1.946 1.00 . A A . 6 VAL H 1 1 14 3826 1 1 6 VAL HA H 1.965 -2.970 -2.934 1.00 . A A . 6 VAL HA 1 1 14 3827 1 1 6 VAL HB H -0.132 -4.760 -4.173 1.00 . A A . 6 VAL HB 1 1 14 3828 1 1 6 VAL HG11 H 0.600 -3.579 -6.281 1.00 . A A . 6 VAL HG11 1 1 14 3829 1 1 6 VAL HG12 H 1.428 -2.419 -5.242 1.00 . A A . 6 VAL HG12 1 1 14 3830 1 1 6 VAL HG13 H -0.323 -2.603 -5.137 1.00 . A A . 6 VAL HG13 1 1 14 3831 1 1 6 VAL HG21 H 1.762 -5.469 -5.659 1.00 . A A . 6 VAL HG21 1 1 14 3832 1 1 6 VAL HG22 H 1.876 -6.023 -3.988 1.00 . A A . 6 VAL HG22 1 1 14 3833 1 1 6 VAL HG23 H 2.854 -4.661 -4.535 1.00 . A A . 6 VAL HG23 1 1 14 3834 1 1 6 VAL N N 1.315 -4.601 -1.854 1.00 . A A . 6 VAL N 1 1 14 3835 1 1 6 VAL O O -1.157 -3.171 -2.057 1.00 . A A . 6 VAL O 1 1 14 3836 1 1 7 PRO C C -2.175 -0.391 -2.872 1.00 . A A . 7 PRO C 1 1 14 3837 1 1 7 PRO CA C -0.889 -0.367 -2.044 1.00 . A A . 7 PRO CA 1 1 14 3838 1 1 7 PRO CB C -0.174 0.977 -2.231 1.00 . A A . 7 PRO CB 1 1 14 3839 1 1 7 PRO CD C 1.380 -0.716 -2.852 1.00 . A A . 7 PRO CD 1 1 14 3840 1 1 7 PRO CG C 0.963 0.692 -3.148 1.00 . A A . 7 PRO CG 1 1 14 3841 1 1 7 PRO HA H -1.145 -0.486 -1.002 1.00 . A A . 7 PRO HA 1 1 14 3842 1 1 7 PRO HB2 H -0.858 1.692 -2.663 1.00 . A A . 7 PRO HB2 1 1 14 3843 1 1 7 PRO HB3 H 0.173 1.337 -1.274 1.00 . A A . 7 PRO HB3 1 1 14 3844 1 1 7 PRO HD2 H 1.791 -1.183 -3.735 1.00 . A A . 7 PRO HD2 1 1 14 3845 1 1 7 PRO HD3 H 2.095 -0.737 -2.043 1.00 . A A . 7 PRO HD3 1 1 14 3846 1 1 7 PRO HG2 H 0.640 0.780 -4.175 1.00 . A A . 7 PRO HG2 1 1 14 3847 1 1 7 PRO HG3 H 1.776 1.374 -2.949 1.00 . A A . 7 PRO HG3 1 1 14 3848 1 1 7 PRO N N 0.119 -1.357 -2.454 1.00 . A A . 7 PRO N 1 1 14 3849 1 1 7 PRO O O -2.149 -0.551 -4.093 1.00 . A A . 7 PRO O 1 1 14 3850 1 1 8 GLU C C -4.975 1.253 -3.197 1.00 . A A . 8 GLU C 1 1 14 3851 1 1 8 GLU CA C -4.608 -0.177 -2.812 1.00 . A A . 8 GLU CA 1 1 14 3852 1 1 8 GLU CB C -5.677 -0.722 -1.862 1.00 . A A . 8 GLU CB 1 1 14 3853 1 1 8 GLU CD C -6.617 -2.711 -0.621 1.00 . A A . 8 GLU CD 1 1 14 3854 1 1 8 GLU CG C -5.470 -2.167 -1.452 1.00 . A A . 8 GLU CG 1 1 14 3855 1 1 8 GLU H H -3.233 -0.073 -1.213 1.00 . A A . 8 GLU H 1 1 14 3856 1 1 8 GLU HA H -4.573 -0.789 -3.701 1.00 . A A . 8 GLU HA 1 1 14 3857 1 1 8 GLU HB2 H -5.686 -0.117 -0.966 1.00 . A A . 8 GLU HB2 1 1 14 3858 1 1 8 GLU HB3 H -6.641 -0.644 -2.344 1.00 . A A . 8 GLU HB3 1 1 14 3859 1 1 8 GLU HG2 H -5.373 -2.769 -2.342 1.00 . A A . 8 GLU HG2 1 1 14 3860 1 1 8 GLU HG3 H -4.562 -2.234 -0.871 1.00 . A A . 8 GLU HG3 1 1 14 3861 1 1 8 GLU N N -3.296 -0.207 -2.181 1.00 . A A . 8 GLU N 1 1 14 3862 1 1 8 GLU O O -5.009 1.605 -4.372 1.00 . A A . 8 GLU O 1 1 14 3863 1 1 8 GLU OE1 O -6.772 -3.945 -0.535 1.00 . A A . 8 GLU OE1 1 1 14 3864 1 1 9 TYR C C -4.712 4.402 -1.642 1.00 . A A . 9 TYR C 1 1 14 3865 1 1 9 TYR CA C -5.629 3.462 -2.412 1.00 . A A . 9 TYR CA 1 1 14 3866 1 1 9 TYR CB C -7.084 3.720 -1.999 1.00 . A A . 9 TYR CB 1 1 14 3867 1 1 9 TYR CD1 C -8.314 1.605 -2.655 1.00 . A A . 9 TYR CD1 1 1 14 3868 1 1 9 TYR CD2 C -8.887 3.635 -3.765 1.00 . A A . 9 TYR CD2 1 1 14 3869 1 1 9 TYR CE1 C -9.256 0.925 -3.403 1.00 . A A . 9 TYR CE1 1 1 14 3870 1 1 9 TYR CE2 C -9.833 2.962 -4.516 1.00 . A A . 9 TYR CE2 1 1 14 3871 1 1 9 TYR CG C -8.111 2.970 -2.824 1.00 . A A . 9 TYR CG 1 1 14 3872 1 1 9 TYR CZ C -10.013 1.608 -4.330 1.00 . A A . 9 TYR CZ 1 1 14 3873 1 1 9 TYR H H -5.217 1.729 -1.267 1.00 . A A . 9 TYR H 1 1 14 3874 1 1 9 TYR HA H -5.524 3.665 -3.468 1.00 . A A . 9 TYR HA 1 1 14 3875 1 1 9 TYR HB2 H -7.211 3.427 -0.971 1.00 . A A . 9 TYR HB2 1 1 14 3876 1 1 9 TYR HB3 H -7.291 4.775 -2.094 1.00 . A A . 9 TYR HB3 1 1 14 3877 1 1 9 TYR HD1 H -7.720 1.073 -1.926 1.00 . A A . 9 TYR HD1 1 1 14 3878 1 1 9 TYR HD2 H -8.742 4.696 -3.909 1.00 . A A . 9 TYR HD2 1 1 14 3879 1 1 9 TYR HE1 H -9.396 -0.135 -3.258 1.00 . A A . 9 TYR HE1 1 1 14 3880 1 1 9 TYR HE2 H -10.426 3.497 -5.242 1.00 . A A . 9 TYR HE2 1 1 14 3881 1 1 9 TYR HH H -10.956 1.276 -5.973 1.00 . A A . 9 TYR HH 1 1 14 3882 1 1 9 TYR N N -5.255 2.072 -2.188 1.00 . A A . 9 TYR N 1 1 14 3883 1 1 9 TYR O O -4.279 4.096 -0.525 1.00 . A A . 9 TYR O 1 1 14 3884 1 1 9 TYR OH O -10.953 0.935 -5.075 1.00 . A A . 9 TYR OH 1 1 14 3885 1 1 10 PHE C C -4.410 7.744 -1.193 1.00 . A A . 10 PHE C 1 1 14 3886 1 1 10 PHE CA C -3.572 6.555 -1.636 1.00 . A A . 10 PHE CA 1 1 14 3887 1 1 10 PHE CB C -2.499 7.054 -2.616 1.00 . A A . 10 PHE CB 1 1 14 3888 1 1 10 PHE CD1 C -2.058 4.900 -3.858 1.00 . A A . 10 PHE CD1 1 1 14 3889 1 1 10 PHE CD2 C -0.202 6.110 -2.977 1.00 . A A . 10 PHE CD2 1 1 14 3890 1 1 10 PHE CE1 C -1.199 3.944 -4.362 1.00 . A A . 10 PHE CE1 1 1 14 3891 1 1 10 PHE CE2 C 0.660 5.154 -3.478 1.00 . A A . 10 PHE CE2 1 1 14 3892 1 1 10 PHE CG C -1.571 5.995 -3.159 1.00 . A A . 10 PHE CG 1 1 14 3893 1 1 10 PHE CZ C 0.162 4.070 -4.171 1.00 . A A . 10 PHE CZ 1 1 14 3894 1 1 10 PHE H H -4.814 5.724 -3.127 1.00 . A A . 10 PHE H 1 1 14 3895 1 1 10 PHE HA H -3.095 6.118 -0.775 1.00 . A A . 10 PHE HA 1 1 14 3896 1 1 10 PHE HB2 H -2.988 7.522 -3.451 1.00 . A A . 10 PHE HB2 1 1 14 3897 1 1 10 PHE HB3 H -1.892 7.793 -2.112 1.00 . A A . 10 PHE HB3 1 1 14 3898 1 1 10 PHE HD1 H -3.123 4.798 -4.008 1.00 . A A . 10 PHE HD1 1 1 14 3899 1 1 10 PHE HD2 H 0.190 6.958 -2.434 1.00 . A A . 10 PHE HD2 1 1 14 3900 1 1 10 PHE HE1 H -1.592 3.096 -4.904 1.00 . A A . 10 PHE HE1 1 1 14 3901 1 1 10 PHE HE2 H 1.725 5.256 -3.326 1.00 . A A . 10 PHE HE2 1 1 14 3902 1 1 10 PHE HZ H 0.836 3.324 -4.563 1.00 . A A . 10 PHE HZ 1 1 14 3903 1 1 10 PHE N N -4.428 5.547 -2.244 1.00 . A A . 10 PHE N 1 1 14 3904 1 1 10 PHE O O -5.423 8.062 -1.813 1.00 . A A . 10 PHE O 1 1 14 3905 1 1 11 VAL C C -4.100 10.847 -0.266 1.00 . A A . 11 VAL C 1 1 14 3906 1 1 11 VAL CA C -4.678 9.584 0.358 1.00 . A A . 11 VAL CA 1 1 14 3907 1 1 11 VAL CB C -4.626 9.703 1.896 1.00 . A A . 11 VAL CB 1 1 14 3908 1 1 11 VAL CG1 C -5.347 8.538 2.551 1.00 . A A . 11 VAL CG1 1 1 14 3909 1 1 11 VAL CG2 C -3.193 9.795 2.393 1.00 . A A . 11 VAL CG2 1 1 14 3910 1 1 11 VAL H H -3.145 8.120 0.299 1.00 . A A . 11 VAL H 1 1 14 3911 1 1 11 VAL HA H -5.713 9.495 0.060 1.00 . A A . 11 VAL HA 1 1 14 3912 1 1 11 VAL HB H -5.138 10.613 2.181 1.00 . A A . 11 VAL HB 1 1 14 3913 1 1 11 VAL HG11 H -6.402 8.760 2.620 1.00 . A A . 11 VAL HG11 1 1 14 3914 1 1 11 VAL HG12 H -4.947 8.378 3.542 1.00 . A A . 11 VAL HG12 1 1 14 3915 1 1 11 VAL HG13 H -5.204 7.647 1.957 1.00 . A A . 11 VAL HG13 1 1 14 3916 1 1 11 VAL HG21 H -2.782 10.760 2.133 1.00 . A A . 11 VAL HG21 1 1 14 3917 1 1 11 VAL HG22 H -2.602 9.017 1.930 1.00 . A A . 11 VAL HG22 1 1 14 3918 1 1 11 VAL HG23 H -3.173 9.672 3.465 1.00 . A A . 11 VAL HG23 1 1 14 3919 1 1 11 VAL N N -3.974 8.410 -0.139 1.00 . A A . 11 VAL N 1 1 14 3920 1 1 11 VAL O O -3.113 10.789 -1.002 1.00 . A A . 11 VAL O 1 1 14 3921 1 1 12 GLY C C -2.850 13.615 -0.084 1.00 . A A . 12 GLY C 1 1 14 3922 1 1 12 GLY CA C -4.263 13.256 -0.499 1.00 . A A . 12 GLY CA 1 1 14 3923 1 1 12 GLY H H -5.496 11.958 0.626 1.00 . A A . 12 GLY H 1 1 14 3924 1 1 12 GLY HA2 H -4.302 13.208 -1.575 1.00 . A A . 12 GLY HA2 1 1 14 3925 1 1 12 GLY HA3 H -4.933 14.032 -0.163 1.00 . A A . 12 GLY HA3 1 1 14 3926 1 1 12 GLY N N -4.717 11.982 0.036 1.00 . A A . 12 GLY N 1 1 14 3927 1 1 12 GLY O O -2.191 14.418 -0.739 1.00 . A A . 12 GLY O 1 1 14 3928 1 1 13 ILE C C 0.015 12.447 0.781 1.00 . A A . 13 ILE C 1 1 14 3929 1 1 13 ILE CA C -1.037 13.293 1.513 1.00 . A A . 13 ILE CA 1 1 14 3930 1 1 13 ILE CB C -0.950 13.036 3.037 1.00 . A A . 13 ILE CB 1 1 14 3931 1 1 13 ILE CD1 C -2.291 13.156 5.207 1.00 . A A . 13 ILE CD1 1 1 14 3932 1 1 13 ILE CG1 C -2.245 13.481 3.728 1.00 . A A . 13 ILE CG1 1 1 14 3933 1 1 13 ILE CG2 C 0.241 13.777 3.639 1.00 . A A . 13 ILE CG2 1 1 14 3934 1 1 13 ILE H H -2.956 12.393 1.484 1.00 . A A . 13 ILE H 1 1 14 3935 1 1 13 ILE HA H -0.823 14.333 1.330 1.00 . A A . 13 ILE HA 1 1 14 3936 1 1 13 ILE HB H -0.806 11.977 3.198 1.00 . A A . 13 ILE HB 1 1 14 3937 1 1 13 ILE HD11 H -1.369 12.676 5.498 1.00 . A A . 13 ILE HD11 1 1 14 3938 1 1 13 ILE HD12 H -3.120 12.493 5.403 1.00 . A A . 13 ILE HD12 1 1 14 3939 1 1 13 ILE HD13 H -2.419 14.069 5.770 1.00 . A A . 13 ILE HD13 1 1 14 3940 1 1 13 ILE HG12 H -2.352 14.549 3.621 1.00 . A A . 13 ILE HG12 1 1 14 3941 1 1 13 ILE HG13 H -3.083 12.990 3.253 1.00 . A A . 13 ILE HG13 1 1 14 3942 1 1 13 ILE HG21 H 1.107 13.636 3.009 1.00 . A A . 13 ILE HG21 1 1 14 3943 1 1 13 ILE HG22 H 0.447 13.388 4.625 1.00 . A A . 13 ILE HG22 1 1 14 3944 1 1 13 ILE HG23 H 0.012 14.830 3.708 1.00 . A A . 13 ILE HG23 1 1 14 3945 1 1 13 ILE N N -2.383 13.023 1.007 1.00 . A A . 13 ILE N 1 1 14 3946 1 1 13 ILE O O 1.067 12.126 1.329 1.00 . A A . 13 ILE O 1 1 14 3947 1 1 14 GLY C C 1.158 10.082 -0.644 1.00 . A A . 14 GLY C 1 1 14 3948 1 1 14 GLY CA C 0.623 11.341 -1.308 1.00 . A A . 14 GLY CA 1 1 14 3949 1 1 14 GLY H H -1.133 12.433 -0.844 1.00 . A A . 14 GLY H 1 1 14 3950 1 1 14 GLY HA2 H 0.100 11.057 -2.209 1.00 . A A . 14 GLY HA2 1 1 14 3951 1 1 14 GLY HA3 H 1.459 11.969 -1.580 1.00 . A A . 14 GLY HA3 1 1 14 3952 1 1 14 GLY N N -0.284 12.118 -0.471 1.00 . A A . 14 GLY N 1 1 14 3953 1 1 14 GLY O O 2.347 9.787 -0.738 1.00 . A A . 14 GLY O 1 1 14 3954 1 1 15 THR C C -0.434 7.098 0.736 1.00 . A A . 15 THR C 1 1 14 3955 1 1 15 THR CA C 0.709 8.110 0.686 1.00 . A A . 15 THR CA 1 1 14 3956 1 1 15 THR CB C 1.240 8.394 2.116 1.00 . A A . 15 THR CB 1 1 14 3957 1 1 15 THR CG2 C 0.200 9.107 2.968 1.00 . A A . 15 THR CG2 1 1 14 3958 1 1 15 THR H H -0.648 9.607 0.063 1.00 . A A . 15 THR H 1 1 14 3959 1 1 15 THR HA H 1.518 7.686 0.107 1.00 . A A . 15 THR HA 1 1 14 3960 1 1 15 THR HB H 2.108 9.033 2.034 1.00 . A A . 15 THR HB 1 1 14 3961 1 1 15 THR HG1 H 0.844 6.704 3.061 1.00 . A A . 15 THR HG1 1 1 14 3962 1 1 15 THR HG21 H 0.500 9.074 4.005 1.00 . A A . 15 THR HG21 1 1 14 3963 1 1 15 THR HG22 H -0.755 8.618 2.853 1.00 . A A . 15 THR HG22 1 1 14 3964 1 1 15 THR HG23 H 0.118 10.136 2.649 1.00 . A A . 15 THR HG23 1 1 14 3965 1 1 15 THR N N 0.289 9.333 0.019 1.00 . A A . 15 THR N 1 1 14 3966 1 1 15 THR O O -1.593 7.461 0.942 1.00 . A A . 15 THR O 1 1 14 3967 1 1 15 THR OG1 O 1.629 7.173 2.761 1.00 . A A . 15 THR OG1 1 1 14 3968 1 1 16 PRO C C -1.656 4.474 1.947 1.00 . A A . 16 PRO C 1 1 14 3969 1 1 16 PRO CA C -1.117 4.737 0.545 1.00 . A A . 16 PRO CA 1 1 14 3970 1 1 16 PRO CB C -0.345 3.521 0.035 1.00 . A A . 16 PRO CB 1 1 14 3971 1 1 16 PRO CD C 1.237 5.297 0.258 1.00 . A A . 16 PRO CD 1 1 14 3972 1 1 16 PRO CG C 1.080 3.807 0.360 1.00 . A A . 16 PRO CG 1 1 14 3973 1 1 16 PRO HA H -1.939 4.950 -0.121 1.00 . A A . 16 PRO HA 1 1 14 3974 1 1 16 PRO HB2 H -0.695 2.632 0.541 1.00 . A A . 16 PRO HB2 1 1 14 3975 1 1 16 PRO HB3 H -0.494 3.417 -1.030 1.00 . A A . 16 PRO HB3 1 1 14 3976 1 1 16 PRO HD2 H 1.938 5.653 0.999 1.00 . A A . 16 PRO HD2 1 1 14 3977 1 1 16 PRO HD3 H 1.561 5.576 -0.734 1.00 . A A . 16 PRO HD3 1 1 14 3978 1 1 16 PRO HG2 H 1.301 3.474 1.363 1.00 . A A . 16 PRO HG2 1 1 14 3979 1 1 16 PRO HG3 H 1.724 3.313 -0.352 1.00 . A A . 16 PRO HG3 1 1 14 3980 1 1 16 PRO N N -0.120 5.808 0.528 1.00 . A A . 16 PRO N 1 1 14 3981 1 1 16 PRO O O -0.910 4.500 2.925 1.00 . A A . 16 PRO O 1 1 14 3982 1 1 17 ILE C C -4.285 2.593 3.280 1.00 . A A . 17 ILE C 1 1 14 3983 1 1 17 ILE CA C -3.582 3.949 3.326 1.00 . A A . 17 ILE CA 1 1 14 3984 1 1 17 ILE CB C -4.572 5.080 3.706 1.00 . A A . 17 ILE CB 1 1 14 3985 1 1 17 ILE CD1 C -5.912 6.085 5.637 1.00 . A A . 17 ILE CD1 1 1 14 3986 1 1 17 ILE CG1 C -5.009 4.960 5.172 1.00 . A A . 17 ILE CG1 1 1 14 3987 1 1 17 ILE CG2 C -5.782 5.073 2.775 1.00 . A A . 17 ILE CG2 1 1 14 3988 1 1 17 ILE H H -3.502 4.212 1.224 1.00 . A A . 17 ILE H 1 1 14 3989 1 1 17 ILE HA H -2.802 3.907 4.068 1.00 . A A . 17 ILE HA 1 1 14 3990 1 1 17 ILE HB H -4.063 6.024 3.571 1.00 . A A . 17 ILE HB 1 1 14 3991 1 1 17 ILE HD11 H -6.011 6.815 4.848 1.00 . A A . 17 ILE HD11 1 1 14 3992 1 1 17 ILE HD12 H -5.482 6.554 6.510 1.00 . A A . 17 ILE HD12 1 1 14 3993 1 1 17 ILE HD13 H -6.884 5.686 5.884 1.00 . A A . 17 ILE HD13 1 1 14 3994 1 1 17 ILE HG12 H -5.542 4.032 5.307 1.00 . A A . 17 ILE HG12 1 1 14 3995 1 1 17 ILE HG13 H -4.130 4.958 5.802 1.00 . A A . 17 ILE HG13 1 1 14 3996 1 1 17 ILE HG21 H -5.465 5.311 1.770 1.00 . A A . 17 ILE HG21 1 1 14 3997 1 1 17 ILE HG22 H -6.499 5.808 3.109 1.00 . A A . 17 ILE HG22 1 1 14 3998 1 1 17 ILE HG23 H -6.238 4.094 2.786 1.00 . A A . 17 ILE HG23 1 1 14 3999 1 1 17 ILE N N -2.952 4.220 2.040 1.00 . A A . 17 ILE N 1 1 14 4000 1 1 17 ILE O O -5.287 2.350 3.948 1.00 . A A . 17 ILE O 1 1 14 4001 1 1 18 SER C C -3.372 -0.410 1.317 1.00 . A A . 18 SER C 1 1 14 4002 1 1 18 SER CA C -4.247 0.366 2.292 1.00 . A A . 18 SER CA 1 1 14 4003 1 1 18 SER CB C -5.691 0.416 1.780 1.00 . A A . 18 SER CB 1 1 14 4004 1 1 18 SER H H -2.920 1.976 1.978 1.00 . A A . 18 SER H 1 1 14 4005 1 1 18 SER HA H -4.228 -0.131 3.251 1.00 . A A . 18 SER HA 1 1 14 4006 1 1 18 SER HB2 H -5.995 -0.573 1.471 1.00 . A A . 18 SER HB2 1 1 14 4007 1 1 18 SER HB3 H -6.339 0.758 2.573 1.00 . A A . 18 SER HB3 1 1 14 4008 1 1 18 SER HG H -5.804 2.206 0.996 1.00 . A A . 18 SER HG 1 1 14 4009 1 1 18 SER N N -3.723 1.712 2.471 1.00 . A A . 18 SER N 1 1 14 4010 1 1 18 SER O O -2.746 0.182 0.439 1.00 . A A . 18 SER O 1 1 14 4011 1 1 18 SER OG O -5.812 1.298 0.674 1.00 . A A . 18 SER OG 1 1 14 4012 1 1 19 PHE C C -3.263 -3.934 0.447 1.00 . A A . 19 PHE C 1 1 14 4013 1 1 19 PHE CA C -2.538 -2.600 0.614 1.00 . A A . 19 PHE CA 1 1 14 4014 1 1 19 PHE CB C -1.141 -2.875 1.198 1.00 . A A . 19 PHE CB 1 1 14 4015 1 1 19 PHE CD1 C -0.696 -1.168 2.994 1.00 . A A . 19 PHE CD1 1 1 14 4016 1 1 19 PHE CD2 C 0.564 -1.046 0.974 1.00 . A A . 19 PHE CD2 1 1 14 4017 1 1 19 PHE CE1 C -0.026 -0.065 3.484 1.00 . A A . 19 PHE CE1 1 1 14 4018 1 1 19 PHE CE2 C 1.238 0.059 1.459 1.00 . A A . 19 PHE CE2 1 1 14 4019 1 1 19 PHE CG C -0.411 -1.671 1.732 1.00 . A A . 19 PHE CG 1 1 14 4020 1 1 19 PHE CZ C 0.943 0.549 2.716 1.00 . A A . 19 PHE CZ 1 1 14 4021 1 1 19 PHE H H -3.854 -2.135 2.205 1.00 . A A . 19 PHE H 1 1 14 4022 1 1 19 PHE HA H -2.440 -2.126 -0.351 1.00 . A A . 19 PHE HA 1 1 14 4023 1 1 19 PHE HB2 H -1.238 -3.583 2.002 1.00 . A A . 19 PHE HB2 1 1 14 4024 1 1 19 PHE HB3 H -0.526 -3.315 0.424 1.00 . A A . 19 PHE HB3 1 1 14 4025 1 1 19 PHE HD1 H -1.454 -1.648 3.596 1.00 . A A . 19 PHE HD1 1 1 14 4026 1 1 19 PHE HD2 H 0.796 -1.428 -0.010 1.00 . A A . 19 PHE HD2 1 1 14 4027 1 1 19 PHE HE1 H -0.257 0.317 4.468 1.00 . A A . 19 PHE HE1 1 1 14 4028 1 1 19 PHE HE2 H 1.996 0.539 0.856 1.00 . A A . 19 PHE HE2 1 1 14 4029 1 1 19 PHE HZ H 1.469 1.412 3.097 1.00 . A A . 19 PHE HZ 1 1 14 4030 1 1 19 PHE N N -3.330 -1.729 1.476 1.00 . A A . 19 PHE N 1 1 14 4031 1 1 19 PHE O O -4.248 -4.194 1.138 1.00 . A A . 19 PHE O 1 1 14 4032 1 1 20 TYR C C -2.264 -7.146 -0.886 1.00 . A A . 20 TYR C 1 1 14 4033 1 1 20 TYR CA C -3.356 -6.093 -0.680 1.00 . A A . 20 TYR CA 1 1 14 4034 1 1 20 TYR CB C -4.376 -6.085 -1.842 1.00 . A A . 20 TYR CB 1 1 14 4035 1 1 20 TYR CD1 C -2.755 -5.435 -3.702 1.00 . A A . 20 TYR CD1 1 1 14 4036 1 1 20 TYR CD2 C -4.901 -4.406 -3.651 1.00 . A A . 20 TYR CD2 1 1 14 4037 1 1 20 TYR CE1 C -2.437 -4.716 -4.838 1.00 . A A . 20 TYR CE1 1 1 14 4038 1 1 20 TYR CE2 C -4.586 -3.683 -4.785 1.00 . A A . 20 TYR CE2 1 1 14 4039 1 1 20 TYR CG C -3.992 -5.293 -3.086 1.00 . A A . 20 TYR CG 1 1 14 4040 1 1 20 TYR CZ C -3.353 -3.842 -5.373 1.00 . A A . 20 TYR CZ 1 1 14 4041 1 1 20 TYR H H -1.966 -4.511 -0.957 1.00 . A A . 20 TYR H 1 1 14 4042 1 1 20 TYR HA H -3.885 -6.352 0.227 1.00 . A A . 20 TYR HA 1 1 14 4043 1 1 20 TYR HB2 H -4.549 -7.103 -2.154 1.00 . A A . 20 TYR HB2 1 1 14 4044 1 1 20 TYR HB3 H -5.307 -5.681 -1.473 1.00 . A A . 20 TYR HB3 1 1 14 4045 1 1 20 TYR HD1 H -2.034 -6.118 -3.277 1.00 . A A . 20 TYR HD1 1 1 14 4046 1 1 20 TYR HD2 H -5.867 -4.282 -3.190 1.00 . A A . 20 TYR HD2 1 1 14 4047 1 1 20 TYR HE1 H -1.472 -4.842 -5.303 1.00 . A A . 20 TYR HE1 1 1 14 4048 1 1 20 TYR HE2 H -5.307 -2.997 -5.205 1.00 . A A . 20 TYR HE2 1 1 14 4049 1 1 20 TYR HH H -2.786 -2.227 -6.250 1.00 . A A . 20 TYR HH 1 1 14 4050 1 1 20 TYR N N -2.766 -4.775 -0.448 1.00 . A A . 20 TYR N 1 1 14 4051 1 1 20 TYR O O -1.431 -7.347 -0.007 1.00 . A A . 20 TYR O 1 1 14 4052 1 1 20 TYR OH O -3.036 -3.124 -6.503 1.00 . A A . 20 TYR OH 1 1 14 4053 1 1 21 GLY C C 0.149 -8.275 -2.267 1.00 . A A . 21 GLY C 1 1 14 4054 1 1 21 GLY CA C -1.266 -8.824 -2.315 1.00 . A A . 21 GLY CA 1 1 14 4055 1 1 21 GLY H H -2.950 -7.607 -2.702 1.00 . A A . 21 GLY H 1 1 14 4056 1 1 21 GLY HA2 H -1.357 -9.615 -1.584 1.00 . A A . 21 GLY HA2 1 1 14 4057 1 1 21 GLY HA3 H -1.449 -9.232 -3.297 1.00 . A A . 21 GLY HA3 1 1 14 4058 1 1 21 GLY N N -2.267 -7.810 -2.035 1.00 . A A . 21 GLY N 1 1 14 4059 1 1 21 GLY O O 1.096 -9.079 -2.185 1.00 . A A . 21 GLY O 1 1 14 4060 1 1 21 GLY OXT O 0.313 -7.034 -2.294 1.00 . A A . 21 GLY OXT 1 1 15 4061 1 1 1 GLY C C -8.217 -3.019 1.525 1.00 . A A . 1 GLY C 1 1 15 4062 1 1 1 GLY CA C -8.557 -1.985 0.466 1.00 . A A . 1 GLY CA 1 1 15 4063 1 1 1 GLY H2 H -7.090 -0.693 -0.357 1.00 . A A . 1 GLY H2 1 1 15 4064 1 1 1 GLY HA2 H -8.929 -1.098 0.954 1.00 . A A . 1 GLY HA2 1 1 15 4065 1 1 1 GLY HA3 H -9.333 -2.382 -0.171 1.00 . A A . 1 GLY HA3 1 1 15 4066 1 1 1 GLY N N -7.418 -1.619 -0.362 1.00 . A A . 1 GLY N 1 1 15 4067 1 1 1 GLY O O -9.022 -3.898 1.821 1.00 . A A . 1 GLY O 1 1 15 4068 1 1 2 GLY C C -5.208 -3.532 3.619 1.00 . A A . 2 GLY C 1 1 15 4069 1 1 2 GLY CA C -6.606 -3.838 3.126 1.00 . A A . 2 GLY CA 1 1 15 4070 1 1 2 GLY H H -6.431 -2.186 1.828 1.00 . A A . 2 GLY H 1 1 15 4071 1 1 2 GLY HA2 H -7.294 -3.781 3.957 1.00 . A A . 2 GLY HA2 1 1 15 4072 1 1 2 GLY HA3 H -6.624 -4.839 2.721 1.00 . A A . 2 GLY HA3 1 1 15 4073 1 1 2 GLY N N -7.030 -2.907 2.101 1.00 . A A . 2 GLY N 1 1 15 4074 1 1 2 GLY O O -4.856 -2.366 3.807 1.00 . A A . 2 GLY O 1 1 15 4075 1 1 3 ALA C C -2.132 -5.452 3.629 1.00 . A A . 3 ALA C 1 1 15 4076 1 1 3 ALA CA C -3.030 -4.400 4.262 1.00 . A A . 3 ALA CA 1 1 15 4077 1 1 3 ALA CB C -2.961 -4.482 5.780 1.00 . A A . 3 ALA CB 1 1 15 4078 1 1 3 ALA H H -4.733 -5.471 3.615 1.00 . A A . 3 ALA H 1 1 15 4079 1 1 3 ALA HA H -2.693 -3.419 3.959 1.00 . A A . 3 ALA HA 1 1 15 4080 1 1 3 ALA HB1 H -2.006 -4.890 6.075 1.00 . A A . 3 ALA HB1 1 1 15 4081 1 1 3 ALA HB2 H -3.753 -5.122 6.142 1.00 . A A . 3 ALA HB2 1 1 15 4082 1 1 3 ALA HB3 H -3.075 -3.494 6.201 1.00 . A A . 3 ALA HB3 1 1 15 4083 1 1 3 ALA N N -4.402 -4.566 3.804 1.00 . A A . 3 ALA N 1 1 15 4084 1 1 3 ALA O O -2.513 -6.613 3.519 1.00 . A A . 3 ALA O 1 1 15 4085 1 1 4 GLY C C 1.209 -5.247 2.040 1.00 . A A . 4 GLY C 1 1 15 4086 1 1 4 GLY CA C -0.024 -5.949 2.572 1.00 . A A . 4 GLY CA 1 1 15 4087 1 1 4 GLY H H -0.703 -4.092 3.308 1.00 . A A . 4 GLY H 1 1 15 4088 1 1 4 GLY HA2 H 0.281 -6.691 3.295 1.00 . A A . 4 GLY HA2 1 1 15 4089 1 1 4 GLY HA3 H -0.524 -6.445 1.754 1.00 . A A . 4 GLY HA3 1 1 15 4090 1 1 4 GLY N N -0.949 -5.034 3.203 1.00 . A A . 4 GLY N 1 1 15 4091 1 1 4 GLY O O 1.864 -4.498 2.765 1.00 . A A . 4 GLY O 1 1 15 4092 1 1 5 HIS C C 2.321 -4.031 -1.034 1.00 . A A . 5 HIS C 1 1 15 4093 1 1 5 HIS CA C 2.712 -4.900 0.156 1.00 . A A . 5 HIS CA 1 1 15 4094 1 1 5 HIS CB C 3.695 -5.981 -0.312 1.00 . A A . 5 HIS CB 1 1 15 4095 1 1 5 HIS CD2 C 3.777 -8.444 0.487 1.00 . A A . 5 HIS CD2 1 1 15 4096 1 1 5 HIS CE1 C 4.273 -8.090 2.588 1.00 . A A . 5 HIS CE1 1 1 15 4097 1 1 5 HIS CG C 3.879 -7.106 0.659 1.00 . A A . 5 HIS CG 1 1 15 4098 1 1 5 HIS H H 0.982 -6.124 0.252 1.00 . A A . 5 HIS H 1 1 15 4099 1 1 5 HIS HA H 3.199 -4.282 0.895 1.00 . A A . 5 HIS HA 1 1 15 4100 1 1 5 HIS HB2 H 3.338 -6.403 -1.239 1.00 . A A . 5 HIS HB2 1 1 15 4101 1 1 5 HIS HB3 H 4.661 -5.527 -0.481 1.00 . A A . 5 HIS HB3 1 1 15 4102 1 1 5 HIS HD1 H 4.321 -6.049 2.428 1.00 . A A . 5 HIS HD1 1 1 15 4103 1 1 5 HIS HD2 H 3.543 -8.953 -0.437 1.00 . A A . 5 HIS HD2 1 1 15 4104 1 1 5 HIS HE1 H 4.503 -8.249 3.631 1.00 . A A . 5 HIS HE1 1 1 15 4105 1 1 5 HIS HE2 H 3.749 -9.949 1.934 1.00 . A A . 5 HIS HE2 1 1 15 4106 1 1 5 HIS N N 1.538 -5.499 0.780 1.00 . A A . 5 HIS N 1 1 15 4107 1 1 5 HIS ND1 N 4.192 -6.917 1.988 1.00 . A A . 5 HIS ND1 1 1 15 4108 1 1 5 HIS NE2 N 4.022 -9.038 1.702 1.00 . A A . 5 HIS NE2 1 1 15 4109 1 1 5 HIS O O 2.940 -2.998 -1.280 1.00 . A A . 5 HIS O 1 1 15 4110 1 1 6 VAL C C -0.171 -2.661 -2.553 1.00 . A A . 6 VAL C 1 1 15 4111 1 1 6 VAL CA C 0.866 -3.702 -2.954 1.00 . A A . 6 VAL CA 1 1 15 4112 1 1 6 VAL CB C 0.267 -4.633 -4.031 1.00 . A A . 6 VAL CB 1 1 15 4113 1 1 6 VAL CG1 C -0.067 -3.853 -5.295 1.00 . A A . 6 VAL CG1 1 1 15 4114 1 1 6 VAL CG2 C 1.219 -5.778 -4.343 1.00 . A A . 6 VAL CG2 1 1 15 4115 1 1 6 VAL H H 0.848 -5.293 -1.548 1.00 . A A . 6 VAL H 1 1 15 4116 1 1 6 VAL HA H 1.726 -3.201 -3.373 1.00 . A A . 6 VAL HA 1 1 15 4117 1 1 6 VAL HB H -0.650 -5.053 -3.643 1.00 . A A . 6 VAL HB 1 1 15 4118 1 1 6 VAL HG11 H 0.223 -4.430 -6.161 1.00 . A A . 6 VAL HG11 1 1 15 4119 1 1 6 VAL HG12 H 0.468 -2.915 -5.291 1.00 . A A . 6 VAL HG12 1 1 15 4120 1 1 6 VAL HG13 H -1.130 -3.661 -5.330 1.00 . A A . 6 VAL HG13 1 1 15 4121 1 1 6 VAL HG21 H 0.723 -6.497 -4.977 1.00 . A A . 6 VAL HG21 1 1 15 4122 1 1 6 VAL HG22 H 1.519 -6.257 -3.421 1.00 . A A . 6 VAL HG22 1 1 15 4123 1 1 6 VAL HG23 H 2.092 -5.393 -4.847 1.00 . A A . 6 VAL HG23 1 1 15 4124 1 1 6 VAL N N 1.307 -4.455 -1.783 1.00 . A A . 6 VAL N 1 1 15 4125 1 1 6 VAL O O -1.237 -3.006 -2.060 1.00 . A A . 6 VAL O 1 1 15 4126 1 1 7 PRO C C -2.074 -0.260 -3.146 1.00 . A A . 7 PRO C 1 1 15 4127 1 1 7 PRO CA C -0.753 -0.263 -2.379 1.00 . A A . 7 PRO CA 1 1 15 4128 1 1 7 PRO CB C 0.062 0.988 -2.728 1.00 . A A . 7 PRO CB 1 1 15 4129 1 1 7 PRO CD C 1.413 -0.888 -3.310 1.00 . A A . 7 PRO CD 1 1 15 4130 1 1 7 PRO CG C 1.094 0.527 -3.695 1.00 . A A . 7 PRO CG 1 1 15 4131 1 1 7 PRO HA H -0.961 -0.266 -1.319 1.00 . A A . 7 PRO HA 1 1 15 4132 1 1 7 PRO HB2 H -0.588 1.729 -3.170 1.00 . A A . 7 PRO HB2 1 1 15 4133 1 1 7 PRO HB3 H 0.513 1.387 -1.831 1.00 . A A . 7 PRO HB3 1 1 15 4134 1 1 7 PRO HD2 H 1.690 -1.464 -4.181 1.00 . A A . 7 PRO HD2 1 1 15 4135 1 1 7 PRO HD3 H 2.198 -0.911 -2.571 1.00 . A A . 7 PRO HD3 1 1 15 4136 1 1 7 PRO HG2 H 0.700 0.562 -4.700 1.00 . A A . 7 PRO HG2 1 1 15 4137 1 1 7 PRO HG3 H 1.977 1.143 -3.615 1.00 . A A . 7 PRO HG3 1 1 15 4138 1 1 7 PRO N N 0.143 -1.372 -2.742 1.00 . A A . 7 PRO N 1 1 15 4139 1 1 7 PRO O O -2.100 -0.426 -4.364 1.00 . A A . 7 PRO O 1 1 15 4140 1 1 8 GLU C C -4.847 1.433 -3.410 1.00 . A A . 8 GLU C 1 1 15 4141 1 1 8 GLU CA C -4.494 0.005 -3.012 1.00 . A A . 8 GLU CA 1 1 15 4142 1 1 8 GLU CB C -5.555 -0.520 -2.042 1.00 . A A . 8 GLU CB 1 1 15 4143 1 1 8 GLU CD C -6.812 -2.517 -1.136 1.00 . A A . 8 GLU CD 1 1 15 4144 1 1 8 GLU CG C -5.637 -2.033 -1.965 1.00 . A A . 8 GLU CG 1 1 15 4145 1 1 8 GLU H H -3.072 0.090 -1.449 1.00 . A A . 8 GLU H 1 1 15 4146 1 1 8 GLU HA H -4.488 -0.613 -3.897 1.00 . A A . 8 GLU HA 1 1 15 4147 1 1 8 GLU HB2 H -5.336 -0.145 -1.053 1.00 . A A . 8 GLU HB2 1 1 15 4148 1 1 8 GLU HB3 H -6.522 -0.146 -2.350 1.00 . A A . 8 GLU HB3 1 1 15 4149 1 1 8 GLU HG2 H -5.736 -2.427 -2.966 1.00 . A A . 8 GLU HG2 1 1 15 4150 1 1 8 GLU HG3 H -4.724 -2.408 -1.523 1.00 . A A . 8 GLU HG3 1 1 15 4151 1 1 8 GLU N N -3.167 -0.049 -2.415 1.00 . A A . 8 GLU N 1 1 15 4152 1 1 8 GLU O O -4.885 1.771 -4.590 1.00 . A A . 8 GLU O 1 1 15 4153 1 1 8 GLU OE1 O -7.154 -3.714 -1.212 1.00 . A A . 8 GLU OE1 1 1 15 4154 1 1 9 TYR C C -4.606 4.595 -1.827 1.00 . A A . 9 TYR C 1 1 15 4155 1 1 9 TYR CA C -5.474 3.658 -2.654 1.00 . A A . 9 TYR CA 1 1 15 4156 1 1 9 TYR CB C -6.951 3.911 -2.329 1.00 . A A . 9 TYR CB 1 1 15 4157 1 1 9 TYR CD1 C -8.163 1.783 -2.976 1.00 . A A . 9 TYR CD1 1 1 15 4158 1 1 9 TYR CD2 C -8.600 3.758 -4.237 1.00 . A A . 9 TYR CD2 1 1 15 4159 1 1 9 TYR CE1 C -9.045 1.076 -3.770 1.00 . A A . 9 TYR CE1 1 1 15 4160 1 1 9 TYR CE2 C -9.485 3.058 -5.034 1.00 . A A . 9 TYR CE2 1 1 15 4161 1 1 9 TYR CG C -7.924 3.136 -3.196 1.00 . A A . 9 TYR CG 1 1 15 4162 1 1 9 TYR CZ C -9.704 1.718 -4.796 1.00 . A A . 9 TYR CZ 1 1 15 4163 1 1 9 TYR H H -5.074 1.937 -1.487 1.00 . A A . 9 TYR H 1 1 15 4164 1 1 9 TYR HA H -5.306 3.863 -3.701 1.00 . A A . 9 TYR HA 1 1 15 4165 1 1 9 TYR HB2 H -7.135 3.638 -1.303 1.00 . A A . 9 TYR HB2 1 1 15 4166 1 1 9 TYR HB3 H -7.162 4.964 -2.458 1.00 . A A . 9 TYR HB3 1 1 15 4167 1 1 9 TYR HD1 H -7.645 1.283 -2.172 1.00 . A A . 9 TYR HD1 1 1 15 4168 1 1 9 TYR HD2 H -8.427 4.808 -4.422 1.00 . A A . 9 TYR HD2 1 1 15 4169 1 1 9 TYR HE1 H -9.218 0.027 -3.583 1.00 . A A . 9 TYR HE1 1 1 15 4170 1 1 9 TYR HE2 H -10.002 3.561 -5.839 1.00 . A A . 9 TYR HE2 1 1 15 4171 1 1 9 TYR HH H -10.094 0.404 -6.145 1.00 . A A . 9 TYR HH 1 1 15 4172 1 1 9 TYR N N -5.114 2.266 -2.410 1.00 . A A . 9 TYR N 1 1 15 4173 1 1 9 TYR O O -4.247 4.283 -0.688 1.00 . A A . 9 TYR O 1 1 15 4174 1 1 9 TYR OH O -10.583 1.017 -5.588 1.00 . A A . 9 TYR OH 1 1 15 4175 1 1 10 PHE C C -4.341 7.945 -1.390 1.00 . A A . 10 PHE C 1 1 15 4176 1 1 10 PHE CA C -3.470 6.747 -1.738 1.00 . A A . 10 PHE CA 1 1 15 4177 1 1 10 PHE CB C -2.314 7.214 -2.628 1.00 . A A . 10 PHE CB 1 1 15 4178 1 1 10 PHE CD1 C -2.255 5.575 -4.543 1.00 . A A . 10 PHE CD1 1 1 15 4179 1 1 10 PHE CD2 C -0.396 5.648 -3.054 1.00 . A A . 10 PHE CD2 1 1 15 4180 1 1 10 PHE CE1 C -1.637 4.576 -5.273 1.00 . A A . 10 PHE CE1 1 1 15 4181 1 1 10 PHE CE2 C 0.227 4.650 -3.780 1.00 . A A . 10 PHE CE2 1 1 15 4182 1 1 10 PHE CG C -1.642 6.122 -3.425 1.00 . A A . 10 PHE CG 1 1 15 4183 1 1 10 PHE CZ C -0.394 4.114 -4.890 1.00 . A A . 10 PHE CZ 1 1 15 4184 1 1 10 PHE H H -4.615 5.925 -3.310 1.00 . A A . 10 PHE H 1 1 15 4185 1 1 10 PHE HA H -3.076 6.315 -0.830 1.00 . A A . 10 PHE HA 1 1 15 4186 1 1 10 PHE HB2 H -2.688 7.948 -3.317 1.00 . A A . 10 PHE HB2 1 1 15 4187 1 1 10 PHE HB3 H -1.562 7.674 -2.002 1.00 . A A . 10 PHE HB3 1 1 15 4188 1 1 10 PHE HD1 H -3.228 5.935 -4.844 1.00 . A A . 10 PHE HD1 1 1 15 4189 1 1 10 PHE HD2 H 0.093 6.065 -2.186 1.00 . A A . 10 PHE HD2 1 1 15 4190 1 1 10 PHE HE1 H -2.126 4.160 -6.139 1.00 . A A . 10 PHE HE1 1 1 15 4191 1 1 10 PHE HE2 H 1.199 4.290 -3.477 1.00 . A A . 10 PHE HE2 1 1 15 4192 1 1 10 PHE HZ H 0.091 3.334 -5.457 1.00 . A A . 10 PHE HZ 1 1 15 4193 1 1 10 PHE N N -4.284 5.742 -2.406 1.00 . A A . 10 PHE N 1 1 15 4194 1 1 10 PHE O O -5.132 8.397 -2.215 1.00 . A A . 10 PHE O 1 1 15 4195 1 1 11 VAL C C -4.201 10.462 1.266 1.00 . A A . 11 VAL C 1 1 15 4196 1 1 11 VAL CA C -4.994 9.599 0.283 1.00 . A A . 11 VAL CA 1 1 15 4197 1 1 11 VAL CB C -6.316 9.150 0.978 1.00 . A A . 11 VAL CB 1 1 15 4198 1 1 11 VAL CG1 C -7.123 10.350 1.455 1.00 . A A . 11 VAL CG1 1 1 15 4199 1 1 11 VAL CG2 C -7.172 8.287 0.060 1.00 . A A . 11 VAL CG2 1 1 15 4200 1 1 11 VAL H H -3.548 8.045 0.437 1.00 . A A . 11 VAL H 1 1 15 4201 1 1 11 VAL HA H -5.250 10.193 -0.581 1.00 . A A . 11 VAL HA 1 1 15 4202 1 1 11 VAL HB H -6.053 8.562 1.843 1.00 . A A . 11 VAL HB 1 1 15 4203 1 1 11 VAL HG11 H -7.313 11.010 0.622 1.00 . A A . 11 VAL HG11 1 1 15 4204 1 1 11 VAL HG12 H -6.567 10.880 2.214 1.00 . A A . 11 VAL HG12 1 1 15 4205 1 1 11 VAL HG13 H -8.061 10.011 1.868 1.00 . A A . 11 VAL HG13 1 1 15 4206 1 1 11 VAL HG21 H -7.526 7.424 0.604 1.00 . A A . 11 VAL HG21 1 1 15 4207 1 1 11 VAL HG22 H -6.581 7.963 -0.783 1.00 . A A . 11 VAL HG22 1 1 15 4208 1 1 11 VAL HG23 H -8.015 8.863 -0.291 1.00 . A A . 11 VAL HG23 1 1 15 4209 1 1 11 VAL N N -4.201 8.452 -0.174 1.00 . A A . 11 VAL N 1 1 15 4210 1 1 11 VAL O O -3.410 9.954 2.058 1.00 . A A . 11 VAL O 1 1 15 4211 1 1 12 GLY C C -2.601 13.396 1.453 1.00 . A A . 12 GLY C 1 1 15 4212 1 1 12 GLY CA C -3.769 12.703 2.097 1.00 . A A . 12 GLY CA 1 1 15 4213 1 1 12 GLY H H -5.071 12.105 0.558 1.00 . A A . 12 GLY H 1 1 15 4214 1 1 12 GLY HA2 H -4.478 13.445 2.411 1.00 . A A . 12 GLY HA2 1 1 15 4215 1 1 12 GLY HA3 H -3.419 12.166 2.967 1.00 . A A . 12 GLY HA3 1 1 15 4216 1 1 12 GLY N N -4.431 11.769 1.208 1.00 . A A . 12 GLY N 1 1 15 4217 1 1 12 GLY O O -2.584 14.616 1.320 1.00 . A A . 12 GLY O 1 1 15 4218 1 1 13 ILE C C 0.163 12.060 -0.527 1.00 . A A . 13 ILE C 1 1 15 4219 1 1 13 ILE CA C -0.420 13.111 0.403 1.00 . A A . 13 ILE CA 1 1 15 4220 1 1 13 ILE CB C 0.669 13.516 1.431 1.00 . A A . 13 ILE CB 1 1 15 4221 1 1 13 ILE CD1 C 1.907 12.728 3.522 1.00 . A A . 13 ILE CD1 1 1 15 4222 1 1 13 ILE CG1 C 0.790 12.458 2.534 1.00 . A A . 13 ILE CG1 1 1 15 4223 1 1 13 ILE CG2 C 0.383 14.890 2.024 1.00 . A A . 13 ILE CG2 1 1 15 4224 1 1 13 ILE H H -1.741 11.646 1.188 1.00 . A A . 13 ILE H 1 1 15 4225 1 1 13 ILE HA H -0.688 13.985 -0.174 1.00 . A A . 13 ILE HA 1 1 15 4226 1 1 13 ILE HB H 1.610 13.577 0.905 1.00 . A A . 13 ILE HB 1 1 15 4227 1 1 13 ILE HD11 H 1.486 12.965 4.486 1.00 . A A . 13 ILE HD11 1 1 15 4228 1 1 13 ILE HD12 H 2.501 13.559 3.172 1.00 . A A . 13 ILE HD12 1 1 15 4229 1 1 13 ILE HD13 H 2.532 11.850 3.607 1.00 . A A . 13 ILE HD13 1 1 15 4230 1 1 13 ILE HG12 H -0.135 12.415 3.087 1.00 . A A . 13 ILE HG12 1 1 15 4231 1 1 13 ILE HG13 H 0.975 11.495 2.079 1.00 . A A . 13 ILE HG13 1 1 15 4232 1 1 13 ILE HG21 H 0.525 15.646 1.266 1.00 . A A . 13 ILE HG21 1 1 15 4233 1 1 13 ILE HG22 H 1.055 15.074 2.848 1.00 . A A . 13 ILE HG22 1 1 15 4234 1 1 13 ILE HG23 H -0.638 14.923 2.378 1.00 . A A . 13 ILE HG23 1 1 15 4235 1 1 13 ILE N N -1.633 12.606 1.049 1.00 . A A . 13 ILE N 1 1 15 4236 1 1 13 ILE O O 1.374 11.877 -0.598 1.00 . A A . 13 ILE O 1 1 15 4237 1 1 14 GLY C C 0.313 9.138 -1.435 1.00 . A A . 14 GLY C 1 1 15 4238 1 1 14 GLY CA C -0.282 10.332 -2.155 1.00 . A A . 14 GLY CA 1 1 15 4239 1 1 14 GLY H H -1.671 11.558 -1.136 1.00 . A A . 14 GLY H 1 1 15 4240 1 1 14 GLY HA2 H -1.130 10.003 -2.738 1.00 . A A . 14 GLY HA2 1 1 15 4241 1 1 14 GLY HA3 H 0.462 10.745 -2.820 1.00 . A A . 14 GLY HA3 1 1 15 4242 1 1 14 GLY N N -0.717 11.366 -1.237 1.00 . A A . 14 GLY N 1 1 15 4243 1 1 14 GLY O O 1.091 8.381 -2.010 1.00 . A A . 14 GLY O 1 1 15 4244 1 1 15 THR C C -0.668 6.772 0.699 1.00 . A A . 15 THR C 1 1 15 4245 1 1 15 THR CA C 0.413 7.847 0.614 1.00 . A A . 15 THR CA 1 1 15 4246 1 1 15 THR CB C 0.849 8.301 2.030 1.00 . A A . 15 THR CB 1 1 15 4247 1 1 15 THR CG2 C -0.312 8.918 2.802 1.00 . A A . 15 THR CG2 1 1 15 4248 1 1 15 THR H H -0.702 9.588 0.219 1.00 . A A . 15 THR H 1 1 15 4249 1 1 15 THR HA H 1.274 7.432 0.109 1.00 . A A . 15 THR HA 1 1 15 4250 1 1 15 THR HB H 1.621 9.050 1.923 1.00 . A A . 15 THR HB 1 1 15 4251 1 1 15 THR HG1 H 1.744 7.510 3.598 1.00 . A A . 15 THR HG1 1 1 15 4252 1 1 15 THR HG21 H 0.073 9.614 3.534 1.00 . A A . 15 THR HG21 1 1 15 4253 1 1 15 THR HG22 H -0.867 8.139 3.302 1.00 . A A . 15 THR HG22 1 1 15 4254 1 1 15 THR HG23 H -0.962 9.441 2.117 1.00 . A A . 15 THR HG23 1 1 15 4255 1 1 15 THR N N -0.070 8.961 -0.179 1.00 . A A . 15 THR N 1 1 15 4256 1 1 15 THR O O -1.846 7.076 0.924 1.00 . A A . 15 THR O 1 1 15 4257 1 1 15 THR OG1 O 1.379 7.196 2.769 1.00 . A A . 15 THR OG1 1 1 15 4258 1 1 16 PRO C C -1.641 4.004 1.934 1.00 . A A . 16 PRO C 1 1 15 4259 1 1 16 PRO CA C -1.249 4.401 0.518 1.00 . A A . 16 PRO CA 1 1 15 4260 1 1 16 PRO CB C -0.505 3.263 -0.167 1.00 . A A . 16 PRO CB 1 1 15 4261 1 1 16 PRO CD C 1.070 5.054 0.171 1.00 . A A . 16 PRO CD 1 1 15 4262 1 1 16 PRO CG C 0.943 3.558 0.041 1.00 . A A . 16 PRO CG 1 1 15 4263 1 1 16 PRO HA H -2.142 4.635 -0.043 1.00 . A A . 16 PRO HA 1 1 15 4264 1 1 16 PRO HB2 H -0.785 2.323 0.287 1.00 . A A . 16 PRO HB2 1 1 15 4265 1 1 16 PRO HB3 H -0.758 3.252 -1.214 1.00 . A A . 16 PRO HB3 1 1 15 4266 1 1 16 PRO HD2 H 1.748 5.305 0.972 1.00 . A A . 16 PRO HD2 1 1 15 4267 1 1 16 PRO HD3 H 1.411 5.484 -0.759 1.00 . A A . 16 PRO HD3 1 1 15 4268 1 1 16 PRO HG2 H 1.287 3.076 0.946 1.00 . A A . 16 PRO HG2 1 1 15 4269 1 1 16 PRO HG3 H 1.513 3.208 -0.806 1.00 . A A . 16 PRO HG3 1 1 15 4270 1 1 16 PRO N N -0.298 5.504 0.485 1.00 . A A . 16 PRO N 1 1 15 4271 1 1 16 PRO O O -0.815 3.539 2.718 1.00 . A A . 16 PRO O 1 1 15 4272 1 1 17 ILE C C -4.188 2.494 3.469 1.00 . A A . 17 ILE C 1 1 15 4273 1 1 17 ILE CA C -3.431 3.809 3.557 1.00 . A A . 17 ILE CA 1 1 15 4274 1 1 17 ILE CB C -4.343 4.909 4.166 1.00 . A A . 17 ILE CB 1 1 15 4275 1 1 17 ILE CD1 C -5.434 5.793 2.007 1.00 . A A . 17 ILE CD1 1 1 15 4276 1 1 17 ILE CG1 C -5.632 5.110 3.344 1.00 . A A . 17 ILE CG1 1 1 15 4277 1 1 17 ILE CG2 C -3.578 6.220 4.292 1.00 . A A . 17 ILE CG2 1 1 15 4278 1 1 17 ILE H H -3.523 4.526 1.565 1.00 . A A . 17 ILE H 1 1 15 4279 1 1 17 ILE HA H -2.584 3.667 4.208 1.00 . A A . 17 ILE HA 1 1 15 4280 1 1 17 ILE HB H -4.613 4.594 5.164 1.00 . A A . 17 ILE HB 1 1 15 4281 1 1 17 ILE HD11 H -5.583 6.857 2.119 1.00 . A A . 17 ILE HD11 1 1 15 4282 1 1 17 ILE HD12 H -6.145 5.403 1.294 1.00 . A A . 17 ILE HD12 1 1 15 4283 1 1 17 ILE HD13 H -4.431 5.606 1.653 1.00 . A A . 17 ILE HD13 1 1 15 4284 1 1 17 ILE HG12 H -6.079 4.147 3.154 1.00 . A A . 17 ILE HG12 1 1 15 4285 1 1 17 ILE HG13 H -6.324 5.709 3.922 1.00 . A A . 17 ILE HG13 1 1 15 4286 1 1 17 ILE HG21 H -4.271 7.025 4.485 1.00 . A A . 17 ILE HG21 1 1 15 4287 1 1 17 ILE HG22 H -3.046 6.415 3.372 1.00 . A A . 17 ILE HG22 1 1 15 4288 1 1 17 ILE HG23 H -2.873 6.149 5.108 1.00 . A A . 17 ILE HG23 1 1 15 4289 1 1 17 ILE N N -2.914 4.167 2.244 1.00 . A A . 17 ILE N 1 1 15 4290 1 1 17 ILE O O -5.133 2.235 4.214 1.00 . A A . 17 ILE O 1 1 15 4291 1 1 18 SER C C -3.530 -0.378 1.237 1.00 . A A . 18 SER C 1 1 15 4292 1 1 18 SER CA C -4.330 0.363 2.297 1.00 . A A . 18 SER CA 1 1 15 4293 1 1 18 SER CB C -5.788 0.500 1.849 1.00 . A A . 18 SER CB 1 1 15 4294 1 1 18 SER H H -2.978 1.951 1.995 1.00 . A A . 18 SER H 1 1 15 4295 1 1 18 SER HA H -4.294 -0.197 3.219 1.00 . A A . 18 SER HA 1 1 15 4296 1 1 18 SER HB2 H -6.146 -0.457 1.507 1.00 . A A . 18 SER HB2 1 1 15 4297 1 1 18 SER HB3 H -6.386 0.831 2.682 1.00 . A A . 18 SER HB3 1 1 15 4298 1 1 18 SER HG H -5.725 2.320 1.126 1.00 . A A . 18 SER HG 1 1 15 4299 1 1 18 SER N N -3.741 1.669 2.538 1.00 . A A . 18 SER N 1 1 15 4300 1 1 18 SER O O -2.985 0.236 0.319 1.00 . A A . 18 SER O 1 1 15 4301 1 1 18 SER OG O -5.915 1.438 0.790 1.00 . A A . 18 SER OG 1 1 15 4302 1 1 19 PHE C C -3.543 -3.765 0.084 1.00 . A A . 19 PHE C 1 1 15 4303 1 1 19 PHE CA C -2.729 -2.520 0.415 1.00 . A A . 19 PHE CA 1 1 15 4304 1 1 19 PHE CB C -1.360 -2.939 0.966 1.00 . A A . 19 PHE CB 1 1 15 4305 1 1 19 PHE CD1 C -0.762 -1.327 2.805 1.00 . A A . 19 PHE CD1 1 1 15 4306 1 1 19 PHE CD2 C 0.486 -1.249 0.773 1.00 . A A . 19 PHE CD2 1 1 15 4307 1 1 19 PHE CE1 C 0.003 -0.294 3.316 1.00 . A A . 19 PHE CE1 1 1 15 4308 1 1 19 PHE CE2 C 1.253 -0.217 1.280 1.00 . A A . 19 PHE CE2 1 1 15 4309 1 1 19 PHE CG C -0.529 -1.815 1.527 1.00 . A A . 19 PHE CG 1 1 15 4310 1 1 19 PHE CZ C 1.010 0.260 2.554 1.00 . A A . 19 PHE CZ 1 1 15 4311 1 1 19 PHE H H -3.921 -2.122 2.123 1.00 . A A . 19 PHE H 1 1 15 4312 1 1 19 PHE HA H -2.588 -1.943 -0.487 1.00 . A A . 19 PHE HA 1 1 15 4313 1 1 19 PHE HB2 H -1.507 -3.665 1.747 1.00 . A A . 19 PHE HB2 1 1 15 4314 1 1 19 PHE HB3 H -0.795 -3.399 0.167 1.00 . A A . 19 PHE HB3 1 1 15 4315 1 1 19 PHE HD1 H -1.550 -1.760 3.402 1.00 . A A . 19 PHE HD1 1 1 15 4316 1 1 19 PHE HD2 H 0.677 -1.621 -0.222 1.00 . A A . 19 PHE HD2 1 1 15 4317 1 1 19 PHE HE1 H -0.189 0.077 4.312 1.00 . A A . 19 PHE HE1 1 1 15 4318 1 1 19 PHE HE2 H 2.041 0.215 0.682 1.00 . A A . 19 PHE HE2 1 1 15 4319 1 1 19 PHE HZ H 1.609 1.066 2.952 1.00 . A A . 19 PHE HZ 1 1 15 4320 1 1 19 PHE N N -3.461 -1.692 1.367 1.00 . A A . 19 PHE N 1 1 15 4321 1 1 19 PHE O O -4.582 -4.002 0.691 1.00 . A A . 19 PHE O 1 1 15 4322 1 1 20 TYR C C -3.263 -6.956 -0.475 1.00 . A A . 20 TYR C 1 1 15 4323 1 1 20 TYR CA C -3.771 -5.769 -1.273 1.00 . A A . 20 TYR CA 1 1 15 4324 1 1 20 TYR CB C -3.584 -6.054 -2.770 1.00 . A A . 20 TYR CB 1 1 15 4325 1 1 20 TYR CD1 C -3.499 -3.892 -4.075 1.00 . A A . 20 TYR CD1 1 1 15 4326 1 1 20 TYR CD2 C -5.484 -5.205 -4.198 1.00 . A A . 20 TYR CD2 1 1 15 4327 1 1 20 TYR CE1 C -4.058 -2.961 -4.929 1.00 . A A . 20 TYR CE1 1 1 15 4328 1 1 20 TYR CE2 C -6.049 -4.279 -5.054 1.00 . A A . 20 TYR CE2 1 1 15 4329 1 1 20 TYR CG C -4.203 -5.027 -3.693 1.00 . A A . 20 TYR CG 1 1 15 4330 1 1 20 TYR CZ C -5.332 -3.158 -5.416 1.00 . A A . 20 TYR CZ 1 1 15 4331 1 1 20 TYR H H -2.228 -4.304 -1.320 1.00 . A A . 20 TYR H 1 1 15 4332 1 1 20 TYR HA H -4.820 -5.633 -1.067 1.00 . A A . 20 TYR HA 1 1 15 4333 1 1 20 TYR HB2 H -2.528 -6.095 -2.988 1.00 . A A . 20 TYR HB2 1 1 15 4334 1 1 20 TYR HB3 H -4.027 -7.013 -2.999 1.00 . A A . 20 TYR HB3 1 1 15 4335 1 1 20 TYR HD1 H -2.501 -3.741 -3.693 1.00 . A A . 20 TYR HD1 1 1 15 4336 1 1 20 TYR HD2 H -6.044 -6.082 -3.910 1.00 . A A . 20 TYR HD2 1 1 15 4337 1 1 20 TYR HE1 H -3.495 -2.084 -5.212 1.00 . A A . 20 TYR HE1 1 1 15 4338 1 1 20 TYR HE2 H -7.046 -4.434 -5.436 1.00 . A A . 20 TYR HE2 1 1 15 4339 1 1 20 TYR HH H -5.274 -1.505 -6.394 1.00 . A A . 20 TYR HH 1 1 15 4340 1 1 20 TYR N N -3.071 -4.549 -0.874 1.00 . A A . 20 TYR N 1 1 15 4341 1 1 20 TYR O O -4.025 -7.651 0.192 1.00 . A A . 20 TYR O 1 1 15 4342 1 1 20 TYR OH O -5.889 -2.232 -6.265 1.00 . A A . 20 TYR OH 1 1 15 4343 1 1 21 GLY C C 0.168 -8.179 -0.042 1.00 . A A . 21 GLY C 1 1 15 4344 1 1 21 GLY CA C -1.325 -8.260 0.133 1.00 . A A . 21 GLY CA 1 1 15 4345 1 1 21 GLY H H -1.421 -6.577 -1.114 1.00 . A A . 21 GLY H 1 1 15 4346 1 1 21 GLY HA2 H -1.569 -8.204 1.185 1.00 . A A . 21 GLY HA2 1 1 15 4347 1 1 21 GLY HA3 H -1.680 -9.196 -0.268 1.00 . A A . 21 GLY HA3 1 1 15 4348 1 1 21 GLY N N -1.965 -7.169 -0.560 1.00 . A A . 21 GLY N 1 1 15 4349 1 1 21 GLY O O 0.613 -7.322 -0.843 1.00 . A A . 21 GLY O 1 1 15 4350 1 1 21 GLY OXT O 0.901 -8.925 0.632 1.00 . A A . 21 GLY OXT 1 1 16 4351 1 1 1 GLY C C -8.193 -3.122 1.796 1.00 . A A . 1 GLY C 1 1 16 4352 1 1 1 GLY CA C -8.492 -2.121 0.695 1.00 . A A . 1 GLY CA 1 1 16 4353 1 1 1 GLY H2 H -7.092 -0.748 -0.104 1.00 . A A . 1 GLY H2 1 1 16 4354 1 1 1 GLY HA2 H -8.949 -1.249 1.137 1.00 . A A . 1 GLY HA2 1 1 16 4355 1 1 1 GLY HA3 H -9.196 -2.565 0.005 1.00 . A A . 1 GLY HA3 1 1 16 4356 1 1 1 GLY N N -7.314 -1.701 -0.052 1.00 . A A . 1 GLY N 1 1 16 4357 1 1 1 GLY O O -8.989 -4.024 2.050 1.00 . A A . 1 GLY O 1 1 16 4358 1 1 2 GLY C C -5.228 -3.759 3.895 1.00 . A A . 2 GLY C 1 1 16 4359 1 1 2 GLY CA C -6.691 -3.870 3.526 1.00 . A A . 2 GLY CA 1 1 16 4360 1 1 2 GLY H H -6.458 -2.230 2.218 1.00 . A A . 2 GLY H 1 1 16 4361 1 1 2 GLY HA2 H -7.290 -3.643 4.396 1.00 . A A . 2 GLY HA2 1 1 16 4362 1 1 2 GLY HA3 H -6.897 -4.883 3.213 1.00 . A A . 2 GLY HA3 1 1 16 4363 1 1 2 GLY N N -7.055 -2.965 2.456 1.00 . A A . 2 GLY N 1 1 16 4364 1 1 2 GLY O O -4.680 -2.656 3.957 1.00 . A A . 2 GLY O 1 1 16 4365 1 1 3 ALA C C -2.453 -5.947 3.580 1.00 . A A . 3 ALA C 1 1 16 4366 1 1 3 ALA CA C -3.180 -4.941 4.461 1.00 . A A . 3 ALA CA 1 1 16 4367 1 1 3 ALA CB C -3.003 -5.291 5.932 1.00 . A A . 3 ALA CB 1 1 16 4368 1 1 3 ALA H H -5.081 -5.743 4.027 1.00 . A A . 3 ALA H 1 1 16 4369 1 1 3 ALA HA H -2.763 -3.957 4.293 1.00 . A A . 3 ALA HA 1 1 16 4370 1 1 3 ALA HB1 H -2.245 -4.656 6.366 1.00 . A A . 3 ALA HB1 1 1 16 4371 1 1 3 ALA HB2 H -2.702 -6.324 6.022 1.00 . A A . 3 ALA HB2 1 1 16 4372 1 1 3 ALA HB3 H -3.938 -5.142 6.453 1.00 . A A . 3 ALA HB3 1 1 16 4373 1 1 3 ALA N N -4.593 -4.898 4.116 1.00 . A A . 3 ALA N 1 1 16 4374 1 1 3 ALA O O -2.994 -7.003 3.259 1.00 . A A . 3 ALA O 1 1 16 4375 1 1 4 GLY C C 0.899 -5.923 2.009 1.00 . A A . 4 GLY C 1 1 16 4376 1 1 4 GLY CA C -0.463 -6.494 2.335 1.00 . A A . 4 GLY CA 1 1 16 4377 1 1 4 GLY H H -0.854 -4.756 3.468 1.00 . A A . 4 GLY H 1 1 16 4378 1 1 4 GLY HA2 H -0.335 -7.441 2.841 1.00 . A A . 4 GLY HA2 1 1 16 4379 1 1 4 GLY HA3 H -1.004 -6.657 1.416 1.00 . A A . 4 GLY HA3 1 1 16 4380 1 1 4 GLY N N -1.234 -5.612 3.185 1.00 . A A . 4 GLY N 1 1 16 4381 1 1 4 GLY O O 1.646 -5.534 2.903 1.00 . A A . 4 GLY O 1 1 16 4382 1 1 5 HIS C C 2.313 -4.232 -0.755 1.00 . A A . 5 HIS C 1 1 16 4383 1 1 5 HIS CA C 2.506 -5.337 0.277 1.00 . A A . 5 HIS CA 1 1 16 4384 1 1 5 HIS CB C 3.382 -6.448 -0.313 1.00 . A A . 5 HIS CB 1 1 16 4385 1 1 5 HIS CD2 C 4.124 -7.192 2.066 1.00 . A A . 5 HIS CD2 1 1 16 4386 1 1 5 HIS CE1 C 5.302 -8.951 1.498 1.00 . A A . 5 HIS CE1 1 1 16 4387 1 1 5 HIS CG C 4.066 -7.299 0.716 1.00 . A A . 5 HIS CG 1 1 16 4388 1 1 5 HIS H H 0.576 -6.191 0.054 1.00 . A A . 5 HIS H 1 1 16 4389 1 1 5 HIS HA H 3.007 -4.919 1.139 1.00 . A A . 5 HIS HA 1 1 16 4390 1 1 5 HIS HB2 H 2.767 -7.096 -0.919 1.00 . A A . 5 HIS HB2 1 1 16 4391 1 1 5 HIS HB3 H 4.144 -6.002 -0.935 1.00 . A A . 5 HIS HB3 1 1 16 4392 1 1 5 HIS HD1 H 4.969 -8.759 -0.513 1.00 . A A . 5 HIS HD1 1 1 16 4393 1 1 5 HIS HD2 H 3.649 -6.429 2.670 1.00 . A A . 5 HIS HD2 1 1 16 4394 1 1 5 HIS HE1 H 5.925 -9.832 1.552 1.00 . A A . 5 HIS HE1 1 1 16 4395 1 1 5 HIS HE2 H 5.082 -8.428 3.468 1.00 . A A . 5 HIS HE2 1 1 16 4396 1 1 5 HIS N N 1.223 -5.868 0.724 1.00 . A A . 5 HIS N 1 1 16 4397 1 1 5 HIS ND1 N 4.815 -8.413 0.393 1.00 . A A . 5 HIS ND1 1 1 16 4398 1 1 5 HIS NE2 N 4.896 -8.229 2.525 1.00 . A A . 5 HIS NE2 1 1 16 4399 1 1 5 HIS O O 2.974 -3.198 -0.694 1.00 . A A . 5 HIS O 1 1 16 4400 1 1 6 VAL C C 0.050 -2.504 -2.272 1.00 . A A . 6 VAL C 1 1 16 4401 1 1 6 VAL CA C 1.141 -3.463 -2.737 1.00 . A A . 6 VAL CA 1 1 16 4402 1 1 6 VAL CB C 0.716 -4.134 -4.062 1.00 . A A . 6 VAL CB 1 1 16 4403 1 1 6 VAL CG1 C 0.623 -3.111 -5.186 1.00 . A A . 6 VAL CG1 1 1 16 4404 1 1 6 VAL CG2 C 1.680 -5.252 -4.433 1.00 . A A . 6 VAL CG2 1 1 16 4405 1 1 6 VAL H H 0.905 -5.294 -1.702 1.00 . A A . 6 VAL H 1 1 16 4406 1 1 6 VAL HA H 2.050 -2.904 -2.912 1.00 . A A . 6 VAL HA 1 1 16 4407 1 1 6 VAL HB H -0.264 -4.567 -3.922 1.00 . A A . 6 VAL HB 1 1 16 4408 1 1 6 VAL HG11 H 0.429 -2.134 -4.769 1.00 . A A . 6 VAL HG11 1 1 16 4409 1 1 6 VAL HG12 H -0.179 -3.383 -5.855 1.00 . A A . 6 VAL HG12 1 1 16 4410 1 1 6 VAL HG13 H 1.555 -3.090 -5.732 1.00 . A A . 6 VAL HG13 1 1 16 4411 1 1 6 VAL HG21 H 2.140 -5.641 -3.537 1.00 . A A . 6 VAL HG21 1 1 16 4412 1 1 6 VAL HG22 H 2.442 -4.865 -5.091 1.00 . A A . 6 VAL HG22 1 1 16 4413 1 1 6 VAL HG23 H 1.138 -6.043 -4.932 1.00 . A A . 6 VAL HG23 1 1 16 4414 1 1 6 VAL N N 1.409 -4.451 -1.700 1.00 . A A . 6 VAL N 1 1 16 4415 1 1 6 VAL O O -1.009 -2.938 -1.830 1.00 . A A . 6 VAL O 1 1 16 4416 1 1 7 PRO C C -1.952 -0.152 -2.703 1.00 . A A . 7 PRO C 1 1 16 4417 1 1 7 PRO CA C -0.651 -0.165 -1.900 1.00 . A A . 7 PRO CA 1 1 16 4418 1 1 7 PRO CB C 0.110 1.150 -2.102 1.00 . A A . 7 PRO CB 1 1 16 4419 1 1 7 PRO CD C 1.563 -0.599 -2.824 1.00 . A A . 7 PRO CD 1 1 16 4420 1 1 7 PRO CG C 1.189 0.831 -3.079 1.00 . A A . 7 PRO CG 1 1 16 4421 1 1 7 PRO HA H -0.887 -0.279 -0.851 1.00 . A A . 7 PRO HA 1 1 16 4422 1 1 7 PRO HB2 H -0.563 1.900 -2.491 1.00 . A A . 7 PRO HB2 1 1 16 4423 1 1 7 PRO HB3 H 0.519 1.481 -1.158 1.00 . A A . 7 PRO HB3 1 1 16 4424 1 1 7 PRO HD2 H 1.886 -1.073 -3.739 1.00 . A A . 7 PRO HD2 1 1 16 4425 1 1 7 PRO HD3 H 2.334 -0.660 -2.072 1.00 . A A . 7 PRO HD3 1 1 16 4426 1 1 7 PRO HG2 H 0.819 0.949 -4.086 1.00 . A A . 7 PRO HG2 1 1 16 4427 1 1 7 PRO HG3 H 2.039 1.477 -2.912 1.00 . A A . 7 PRO HG3 1 1 16 4428 1 1 7 PRO N N 0.306 -1.190 -2.338 1.00 . A A . 7 PRO N 1 1 16 4429 1 1 7 PRO O O -1.944 -0.261 -3.930 1.00 . A A . 7 PRO O 1 1 16 4430 1 1 8 GLU C C -4.764 1.472 -2.973 1.00 . A A . 8 GLU C 1 1 16 4431 1 1 8 GLU CA C -4.383 0.039 -2.614 1.00 . A A . 8 GLU CA 1 1 16 4432 1 1 8 GLU CB C -5.449 -0.536 -1.677 1.00 . A A . 8 GLU CB 1 1 16 4433 1 1 8 GLU CD C -6.531 -2.582 -0.672 1.00 . A A . 8 GLU CD 1 1 16 4434 1 1 8 GLU CG C -5.335 -2.027 -1.426 1.00 . A A . 8 GLU CG 1 1 16 4435 1 1 8 GLU H H -2.996 0.080 -1.017 1.00 . A A . 8 GLU H 1 1 16 4436 1 1 8 GLU HA H -4.348 -0.554 -3.515 1.00 . A A . 8 GLU HA 1 1 16 4437 1 1 8 GLU HB2 H -5.379 -0.030 -0.725 1.00 . A A . 8 GLU HB2 1 1 16 4438 1 1 8 GLU HB3 H -6.422 -0.341 -2.104 1.00 . A A . 8 GLU HB3 1 1 16 4439 1 1 8 GLU HG2 H -5.259 -2.535 -2.375 1.00 . A A . 8 GLU HG2 1 1 16 4440 1 1 8 GLU HG3 H -4.442 -2.215 -0.845 1.00 . A A . 8 GLU HG3 1 1 16 4441 1 1 8 GLU N N -3.066 -0.008 -1.991 1.00 . A A . 8 GLU N 1 1 16 4442 1 1 8 GLU O O -4.775 1.851 -4.139 1.00 . A A . 8 GLU O 1 1 16 4443 1 1 8 GLU OE1 O -6.726 -3.813 -0.667 1.00 . A A . 8 GLU OE1 1 1 16 4444 1 1 9 TYR C C -4.584 4.601 -1.396 1.00 . A A . 9 TYR C 1 1 16 4445 1 1 9 TYR CA C -5.492 3.647 -2.160 1.00 . A A . 9 TYR CA 1 1 16 4446 1 1 9 TYR CB C -6.945 3.877 -1.729 1.00 . A A . 9 TYR CB 1 1 16 4447 1 1 9 TYR CD1 C -8.125 1.741 -2.412 1.00 . A A . 9 TYR CD1 1 1 16 4448 1 1 9 TYR CD2 C -8.784 3.781 -3.456 1.00 . A A . 9 TYR CD2 1 1 16 4449 1 1 9 TYR CE1 C -9.059 1.051 -3.162 1.00 . A A . 9 TYR CE1 1 1 16 4450 1 1 9 TYR CE2 C -9.721 3.097 -4.209 1.00 . A A . 9 TYR CE2 1 1 16 4451 1 1 9 TYR CG C -7.971 3.117 -2.547 1.00 . A A . 9 TYR CG 1 1 16 4452 1 1 9 TYR CZ C -9.854 1.734 -4.058 1.00 . A A . 9 TYR CZ 1 1 16 4453 1 1 9 TYR H H -5.075 1.899 -1.041 1.00 . A A . 9 TYR H 1 1 16 4454 1 1 9 TYR HA H -5.405 3.860 -3.215 1.00 . A A . 9 TYR HA 1 1 16 4455 1 1 9 TYR HB2 H -7.056 3.573 -0.700 1.00 . A A . 9 TYR HB2 1 1 16 4456 1 1 9 TYR HB3 H -7.172 4.930 -1.810 1.00 . A A . 9 TYR HB3 1 1 16 4457 1 1 9 TYR HD1 H -7.501 1.210 -1.710 1.00 . A A . 9 TYR HD1 1 1 16 4458 1 1 9 TYR HD2 H -8.677 4.849 -3.575 1.00 . A A . 9 TYR HD2 1 1 16 4459 1 1 9 TYR HE1 H -9.163 -0.017 -3.043 1.00 . A A . 9 TYR HE1 1 1 16 4460 1 1 9 TYR HE2 H -10.344 3.631 -4.911 1.00 . A A . 9 TYR HE2 1 1 16 4461 1 1 9 TYR HH H -10.963 1.532 -5.614 1.00 . A A . 9 TYR HH 1 1 16 4462 1 1 9 TYR N N -5.092 2.261 -1.953 1.00 . A A . 9 TYR N 1 1 16 4463 1 1 9 TYR O O -4.148 4.306 -0.279 1.00 . A A . 9 TYR O 1 1 16 4464 1 1 9 TYR OH O -10.784 1.050 -4.803 1.00 . A A . 9 TYR OH 1 1 16 4465 1 1 10 PHE C C -4.330 7.982 -1.041 1.00 . A A . 10 PHE C 1 1 16 4466 1 1 10 PHE CA C -3.480 6.773 -1.409 1.00 . A A . 10 PHE CA 1 1 16 4467 1 1 10 PHE CB C -2.376 7.230 -2.373 1.00 . A A . 10 PHE CB 1 1 16 4468 1 1 10 PHE CD1 C -2.012 5.150 -3.752 1.00 . A A . 10 PHE CD1 1 1 16 4469 1 1 10 PHE CD2 C -0.146 6.104 -2.616 1.00 . A A . 10 PHE CD2 1 1 16 4470 1 1 10 PHE CE1 C -1.198 4.159 -4.263 1.00 . A A . 10 PHE CE1 1 1 16 4471 1 1 10 PHE CE2 C 0.673 5.118 -3.128 1.00 . A A . 10 PHE CE2 1 1 16 4472 1 1 10 PHE CG C -1.498 6.133 -2.920 1.00 . A A . 10 PHE CG 1 1 16 4473 1 1 10 PHE CZ C 0.146 4.143 -3.951 1.00 . A A . 10 PHE CZ 1 1 16 4474 1 1 10 PHE H H -4.715 5.913 -2.887 1.00 . A A . 10 PHE H 1 1 16 4475 1 1 10 PHE HA H -3.031 6.367 -0.514 1.00 . A A . 10 PHE HA 1 1 16 4476 1 1 10 PHE HB2 H -2.834 7.729 -3.209 1.00 . A A . 10 PHE HB2 1 1 16 4477 1 1 10 PHE HB3 H -1.738 7.934 -1.857 1.00 . A A . 10 PHE HB3 1 1 16 4478 1 1 10 PHE HD1 H -3.064 5.161 -3.997 1.00 . A A . 10 PHE HD1 1 1 16 4479 1 1 10 PHE HD2 H 0.266 6.863 -1.969 1.00 . A A . 10 PHE HD2 1 1 16 4480 1 1 10 PHE HE1 H -1.613 3.397 -4.908 1.00 . A A . 10 PHE HE1 1 1 16 4481 1 1 10 PHE HE2 H 1.724 5.108 -2.883 1.00 . A A . 10 PHE HE2 1 1 16 4482 1 1 10 PHE HZ H 0.786 3.371 -4.353 1.00 . A A . 10 PHE HZ 1 1 16 4483 1 1 10 PHE N N -4.320 5.746 -2.005 1.00 . A A . 10 PHE N 1 1 16 4484 1 1 10 PHE O O -5.321 8.272 -1.709 1.00 . A A . 10 PHE O 1 1 16 4485 1 1 11 VAL C C -4.214 11.096 -0.362 1.00 . A A . 11 VAL C 1 1 16 4486 1 1 11 VAL CA C -4.660 9.873 0.439 1.00 . A A . 11 VAL CA 1 1 16 4487 1 1 11 VAL CB C -4.475 10.152 1.947 1.00 . A A . 11 VAL CB 1 1 16 4488 1 1 11 VAL CG1 C -5.093 9.038 2.776 1.00 . A A . 11 VAL CG1 1 1 16 4489 1 1 11 VAL CG2 C -3.004 10.324 2.295 1.00 . A A . 11 VAL CG2 1 1 16 4490 1 1 11 VAL H H -3.130 8.405 0.493 1.00 . A A . 11 VAL H 1 1 16 4491 1 1 11 VAL HA H -5.712 9.704 0.253 1.00 . A A . 11 VAL HA 1 1 16 4492 1 1 11 VAL HB H -4.988 11.072 2.187 1.00 . A A . 11 VAL HB 1 1 16 4493 1 1 11 VAL HG11 H -4.834 9.178 3.815 1.00 . A A . 11 VAL HG11 1 1 16 4494 1 1 11 VAL HG12 H -4.717 8.086 2.436 1.00 . A A . 11 VAL HG12 1 1 16 4495 1 1 11 VAL HG13 H -6.167 9.062 2.665 1.00 . A A . 11 VAL HG13 1 1 16 4496 1 1 11 VAL HG21 H -2.426 10.393 1.386 1.00 . A A . 11 VAL HG21 1 1 16 4497 1 1 11 VAL HG22 H -2.670 9.476 2.873 1.00 . A A . 11 VAL HG22 1 1 16 4498 1 1 11 VAL HG23 H -2.875 11.227 2.874 1.00 . A A . 11 VAL HG23 1 1 16 4499 1 1 11 VAL N N -3.936 8.685 0.006 1.00 . A A . 11 VAL N 1 1 16 4500 1 1 11 VAL O O -3.528 10.964 -1.376 1.00 . A A . 11 VAL O 1 1 16 4501 1 1 12 GLY C C -2.753 13.717 -0.714 1.00 . A A . 12 GLY C 1 1 16 4502 1 1 12 GLY CA C -4.247 13.513 -0.580 1.00 . A A . 12 GLY CA 1 1 16 4503 1 1 12 GLY H H -5.149 12.317 0.913 1.00 . A A . 12 GLY H 1 1 16 4504 1 1 12 GLY HA2 H -4.676 13.495 -1.564 1.00 . A A . 12 GLY HA2 1 1 16 4505 1 1 12 GLY HA3 H -4.664 14.346 -0.034 1.00 . A A . 12 GLY HA3 1 1 16 4506 1 1 12 GLY N N -4.605 12.280 0.102 1.00 . A A . 12 GLY N 1 1 16 4507 1 1 12 GLY O O -2.270 14.153 -1.756 1.00 . A A . 12 GLY O 1 1 16 4508 1 1 13 ILE C C 0.140 12.320 -0.213 1.00 . A A . 13 ILE C 1 1 16 4509 1 1 13 ILE CA C -0.570 13.560 0.335 1.00 . A A . 13 ILE CA 1 1 16 4510 1 1 13 ILE CB C -0.028 13.895 1.743 1.00 . A A . 13 ILE CB 1 1 16 4511 1 1 13 ILE CD1 C -0.025 13.127 4.177 1.00 . A A . 13 ILE CD1 1 1 16 4512 1 1 13 ILE CG1 C -0.573 12.910 2.782 1.00 . A A . 13 ILE CG1 1 1 16 4513 1 1 13 ILE CG2 C -0.389 15.328 2.117 1.00 . A A . 13 ILE CG2 1 1 16 4514 1 1 13 ILE H H -2.467 13.061 1.135 1.00 . A A . 13 ILE H 1 1 16 4515 1 1 13 ILE HA H -0.339 14.391 -0.314 1.00 . A A . 13 ILE HA 1 1 16 4516 1 1 13 ILE HB H 1.048 13.820 1.716 1.00 . A A . 13 ILE HB 1 1 16 4517 1 1 13 ILE HD11 H 0.576 12.278 4.465 1.00 . A A . 13 ILE HD11 1 1 16 4518 1 1 13 ILE HD12 H -0.844 13.238 4.872 1.00 . A A . 13 ILE HD12 1 1 16 4519 1 1 13 ILE HD13 H 0.582 14.020 4.190 1.00 . A A . 13 ILE HD13 1 1 16 4520 1 1 13 ILE HG12 H -1.647 13.007 2.830 1.00 . A A . 13 ILE HG12 1 1 16 4521 1 1 13 ILE HG13 H -0.322 11.903 2.479 1.00 . A A . 13 ILE HG13 1 1 16 4522 1 1 13 ILE HG21 H -0.075 15.525 3.131 1.00 . A A . 13 ILE HG21 1 1 16 4523 1 1 13 ILE HG22 H -1.458 15.461 2.038 1.00 . A A . 13 ILE HG22 1 1 16 4524 1 1 13 ILE HG23 H 0.109 16.011 1.444 1.00 . A A . 13 ILE HG23 1 1 16 4525 1 1 13 ILE N N -2.022 13.403 0.339 1.00 . A A . 13 ILE N 1 1 16 4526 1 1 13 ILE O O 1.248 11.989 0.208 1.00 . A A . 13 ILE O 1 1 16 4527 1 1 14 GLY C C 0.508 9.400 -0.835 1.00 . A A . 14 GLY C 1 1 16 4528 1 1 14 GLY CA C 0.051 10.475 -1.807 1.00 . A A . 14 GLY CA 1 1 16 4529 1 1 14 GLY H H -1.379 12.000 -1.465 1.00 . A A . 14 GLY H 1 1 16 4530 1 1 14 GLY HA2 H -0.697 10.050 -2.459 1.00 . A A . 14 GLY HA2 1 1 16 4531 1 1 14 GLY HA3 H 0.897 10.777 -2.409 1.00 . A A . 14 GLY HA3 1 1 16 4532 1 1 14 GLY N N -0.508 11.659 -1.169 1.00 . A A . 14 GLY N 1 1 16 4533 1 1 14 GLY O O 1.462 8.676 -1.108 1.00 . A A . 14 GLY O 1 1 16 4534 1 1 15 THR C C -0.829 7.137 1.265 1.00 . A A . 15 THR C 1 1 16 4535 1 1 15 THR CA C 0.181 8.281 1.285 1.00 . A A . 15 THR CA 1 1 16 4536 1 1 15 THR CB C 0.239 8.900 2.693 1.00 . A A . 15 THR CB 1 1 16 4537 1 1 15 THR CG2 C 0.849 7.929 3.695 1.00 . A A . 15 THR CG2 1 1 16 4538 1 1 15 THR H H -0.928 9.879 0.462 1.00 . A A . 15 THR H 1 1 16 4539 1 1 15 THR HA H 1.161 7.894 1.039 1.00 . A A . 15 THR HA 1 1 16 4540 1 1 15 THR HB H -0.768 9.138 3.008 1.00 . A A . 15 THR HB 1 1 16 4541 1 1 15 THR HG1 H 1.340 10.251 1.760 1.00 . A A . 15 THR HG1 1 1 16 4542 1 1 15 THR HG21 H 1.738 8.366 4.124 1.00 . A A . 15 THR HG21 1 1 16 4543 1 1 15 THR HG22 H 1.105 7.008 3.193 1.00 . A A . 15 THR HG22 1 1 16 4544 1 1 15 THR HG23 H 0.134 7.726 4.479 1.00 . A A . 15 THR HG23 1 1 16 4545 1 1 15 THR N N -0.171 9.284 0.293 1.00 . A A . 15 THR N 1 1 16 4546 1 1 15 THR O O -2.025 7.359 1.451 1.00 . A A . 15 THR O 1 1 16 4547 1 1 15 THR OG1 O 1.015 10.103 2.657 1.00 . A A . 15 THR OG1 1 1 16 4548 1 1 16 PRO C C -1.741 4.321 2.357 1.00 . A A . 16 PRO C 1 1 16 4549 1 1 16 PRO CA C -1.245 4.736 0.974 1.00 . A A . 16 PRO CA 1 1 16 4550 1 1 16 PRO CB C -0.356 3.647 0.374 1.00 . A A . 16 PRO CB 1 1 16 4551 1 1 16 PRO CD C 1.045 5.554 0.776 1.00 . A A . 16 PRO CD 1 1 16 4552 1 1 16 PRO CG C 1.037 4.050 0.724 1.00 . A A . 16 PRO CG 1 1 16 4553 1 1 16 PRO HA H -2.093 4.908 0.328 1.00 . A A . 16 PRO HA 1 1 16 4554 1 1 16 PRO HB2 H -0.612 2.691 0.806 1.00 . A A . 16 PRO HB2 1 1 16 4555 1 1 16 PRO HB3 H -0.499 3.613 -0.695 1.00 . A A . 16 PRO HB3 1 1 16 4556 1 1 16 PRO HD2 H 1.675 5.899 1.582 1.00 . A A . 16 PRO HD2 1 1 16 4557 1 1 16 PRO HD3 H 1.380 5.959 -0.168 1.00 . A A . 16 PRO HD3 1 1 16 4558 1 1 16 PRO HG2 H 1.303 3.642 1.689 1.00 . A A . 16 PRO HG2 1 1 16 4559 1 1 16 PRO HG3 H 1.721 3.697 -0.033 1.00 . A A . 16 PRO HG3 1 1 16 4560 1 1 16 PRO N N -0.367 5.904 1.025 1.00 . A A . 16 PRO N 1 1 16 4561 1 1 16 PRO O O -0.948 4.088 3.268 1.00 . A A . 16 PRO O 1 1 16 4562 1 1 17 ILE C C -4.340 2.480 3.643 1.00 . A A . 17 ILE C 1 1 16 4563 1 1 17 ILE CA C -3.652 3.829 3.775 1.00 . A A . 17 ILE CA 1 1 16 4564 1 1 17 ILE CB C -4.666 4.875 4.286 1.00 . A A . 17 ILE CB 1 1 16 4565 1 1 17 ILE CD1 C -6.873 6.021 3.706 1.00 . A A . 17 ILE CD1 1 1 16 4566 1 1 17 ILE CG1 C -5.723 5.168 3.214 1.00 . A A . 17 ILE CG1 1 1 16 4567 1 1 17 ILE CG2 C -3.945 6.151 4.700 1.00 . A A . 17 ILE CG2 1 1 16 4568 1 1 17 ILE H H -3.637 4.418 1.737 1.00 . A A . 17 ILE H 1 1 16 4569 1 1 17 ILE HA H -2.856 3.739 4.498 1.00 . A A . 17 ILE HA 1 1 16 4570 1 1 17 ILE HB H -5.154 4.470 5.160 1.00 . A A . 17 ILE HB 1 1 16 4571 1 1 17 ILE HD11 H -7.108 5.754 4.727 1.00 . A A . 17 ILE HD11 1 1 16 4572 1 1 17 ILE HD12 H -7.738 5.855 3.083 1.00 . A A . 17 ILE HD12 1 1 16 4573 1 1 17 ILE HD13 H -6.592 7.063 3.663 1.00 . A A . 17 ILE HD13 1 1 16 4574 1 1 17 ILE HG12 H -5.256 5.687 2.390 1.00 . A A . 17 ILE HG12 1 1 16 4575 1 1 17 ILE HG13 H -6.131 4.233 2.858 1.00 . A A . 17 ILE HG13 1 1 16 4576 1 1 17 ILE HG21 H -3.615 6.061 5.725 1.00 . A A . 17 ILE HG21 1 1 16 4577 1 1 17 ILE HG22 H -4.618 6.990 4.610 1.00 . A A . 17 ILE HG22 1 1 16 4578 1 1 17 ILE HG23 H -3.090 6.306 4.057 1.00 . A A . 17 ILE HG23 1 1 16 4579 1 1 17 ILE N N -3.054 4.223 2.503 1.00 . A A . 17 ILE N 1 1 16 4580 1 1 17 ILE O O -5.365 2.218 4.271 1.00 . A A . 17 ILE O 1 1 16 4581 1 1 18 SER C C -3.364 -0.422 1.573 1.00 . A A . 18 SER C 1 1 16 4582 1 1 18 SER CA C -4.268 0.297 2.561 1.00 . A A . 18 SER CA 1 1 16 4583 1 1 18 SER CB C -5.698 0.361 2.015 1.00 . A A . 18 SER CB 1 1 16 4584 1 1 18 SER H H -2.936 1.920 2.358 1.00 . A A . 18 SER H 1 1 16 4585 1 1 18 SER HA H -4.268 -0.245 3.496 1.00 . A A . 18 SER HA 1 1 16 4586 1 1 18 SER HB2 H -5.975 -0.608 1.627 1.00 . A A . 18 SER HB2 1 1 16 4587 1 1 18 SER HB3 H -6.371 0.635 2.812 1.00 . A A . 18 SER HB3 1 1 16 4588 1 1 18 SER HG H -5.724 2.202 1.346 1.00 . A A . 18 SER HG 1 1 16 4589 1 1 18 SER N N -3.753 1.633 2.816 1.00 . A A . 18 SER N 1 1 16 4590 1 1 18 SER O O -2.763 0.213 0.706 1.00 . A A . 18 SER O 1 1 16 4591 1 1 18 SER OG O -5.807 1.317 0.972 1.00 . A A . 18 SER OG 1 1 16 4592 1 1 19 PHE C C -3.063 -3.891 0.562 1.00 . A A . 19 PHE C 1 1 16 4593 1 1 19 PHE CA C -2.415 -2.536 0.824 1.00 . A A . 19 PHE CA 1 1 16 4594 1 1 19 PHE CB C -1.018 -2.774 1.426 1.00 . A A . 19 PHE CB 1 1 16 4595 1 1 19 PHE CD1 C -0.608 -0.987 3.152 1.00 . A A . 19 PHE CD1 1 1 16 4596 1 1 19 PHE CD2 C 0.677 -0.943 1.144 1.00 . A A . 19 PHE CD2 1 1 16 4597 1 1 19 PHE CE1 C 0.051 0.142 3.602 1.00 . A A . 19 PHE CE1 1 1 16 4598 1 1 19 PHE CE2 C 1.338 0.186 1.588 1.00 . A A . 19 PHE CE2 1 1 16 4599 1 1 19 PHE CG C -0.303 -1.542 1.917 1.00 . A A . 19 PHE CG 1 1 16 4600 1 1 19 PHE CZ C 1.026 0.729 2.819 1.00 . A A . 19 PHE CZ 1 1 16 4601 1 1 19 PHE H H -3.758 -2.187 2.429 1.00 . A A . 19 PHE H 1 1 16 4602 1 1 19 PHE HA H -2.314 -2.005 -0.112 1.00 . A A . 19 PHE HA 1 1 16 4603 1 1 19 PHE HB2 H -1.114 -3.450 2.258 1.00 . A A . 19 PHE HB2 1 1 16 4604 1 1 19 PHE HB3 H -0.396 -3.237 0.674 1.00 . A A . 19 PHE HB3 1 1 16 4605 1 1 19 PHE HD1 H -1.371 -1.444 3.765 1.00 . A A . 19 PHE HD1 1 1 16 4606 1 1 19 PHE HD2 H 0.924 -1.367 0.181 1.00 . A A . 19 PHE HD2 1 1 16 4607 1 1 19 PHE HE1 H -0.197 0.564 4.564 1.00 . A A . 19 PHE HE1 1 1 16 4608 1 1 19 PHE HE2 H 2.100 0.642 0.974 1.00 . A A . 19 PHE HE2 1 1 16 4609 1 1 19 PHE HZ H 1.541 1.611 3.168 1.00 . A A . 19 PHE HZ 1 1 16 4610 1 1 19 PHE N N -3.258 -1.737 1.709 1.00 . A A . 19 PHE N 1 1 16 4611 1 1 19 PHE O O -4.078 -4.225 1.167 1.00 . A A . 19 PHE O 1 1 16 4612 1 1 20 TYR C C -1.801 -6.820 -1.284 1.00 . A A . 20 TYR C 1 1 16 4613 1 1 20 TYR CA C -2.929 -6.004 -0.658 1.00 . A A . 20 TYR CA 1 1 16 4614 1 1 20 TYR CB C -4.161 -5.966 -1.593 1.00 . A A . 20 TYR CB 1 1 16 4615 1 1 20 TYR CD1 C -2.782 -4.953 -3.487 1.00 . A A . 20 TYR CD1 1 1 16 4616 1 1 20 TYR CD2 C -5.132 -4.575 -3.467 1.00 . A A . 20 TYR CD2 1 1 16 4617 1 1 20 TYR CE1 C -2.671 -4.212 -4.646 1.00 . A A . 20 TYR CE1 1 1 16 4618 1 1 20 TYR CE2 C -5.026 -3.832 -4.626 1.00 . A A . 20 TYR CE2 1 1 16 4619 1 1 20 TYR CG C -4.014 -5.149 -2.872 1.00 . A A . 20 TYR CG 1 1 16 4620 1 1 20 TYR CZ C -3.795 -3.653 -5.212 1.00 . A A . 20 TYR CZ 1 1 16 4621 1 1 20 TYR H H -1.634 -4.331 -0.752 1.00 . A A . 20 TYR H 1 1 16 4622 1 1 20 TYR HA H -3.215 -6.484 0.269 1.00 . A A . 20 TYR HA 1 1 16 4623 1 1 20 TYR HB2 H -4.405 -6.973 -1.885 1.00 . A A . 20 TYR HB2 1 1 16 4624 1 1 20 TYR HB3 H -4.993 -5.560 -1.042 1.00 . A A . 20 TYR HB3 1 1 16 4625 1 1 20 TYR HD1 H -1.900 -5.392 -3.044 1.00 . A A . 20 TYR HD1 1 1 16 4626 1 1 20 TYR HD2 H -6.099 -4.714 -3.006 1.00 . A A . 20 TYR HD2 1 1 16 4627 1 1 20 TYR HE1 H -1.703 -4.071 -5.105 1.00 . A A . 20 TYR HE1 1 1 16 4628 1 1 20 TYR HE2 H -5.911 -3.396 -5.069 1.00 . A A . 20 TYR HE2 1 1 16 4629 1 1 20 TYR HH H -3.381 -2.024 -6.147 1.00 . A A . 20 TYR HH 1 1 16 4630 1 1 20 TYR N N -2.452 -4.666 -0.320 1.00 . A A . 20 TYR N 1 1 16 4631 1 1 20 TYR O O -0.622 -6.480 -1.129 1.00 . A A . 20 TYR O 1 1 16 4632 1 1 20 TYR OH O -3.684 -2.911 -6.365 1.00 . A A . 20 TYR OH 1 1 16 4633 1 1 21 GLY C C -1.832 -9.839 -3.391 1.00 . A A . 21 GLY C 1 1 16 4634 1 1 21 GLY CA C -1.172 -8.715 -2.631 1.00 . A A . 21 GLY CA 1 1 16 4635 1 1 21 GLY H H -3.109 -8.098 -2.089 1.00 . A A . 21 GLY H 1 1 16 4636 1 1 21 GLY HA2 H -0.588 -8.117 -3.316 1.00 . A A . 21 GLY HA2 1 1 16 4637 1 1 21 GLY HA3 H -0.519 -9.133 -1.880 1.00 . A A . 21 GLY HA3 1 1 16 4638 1 1 21 GLY N N -2.157 -7.876 -1.990 1.00 . A A . 21 GLY N 1 1 16 4639 1 1 21 GLY O O -3.079 -9.901 -3.369 1.00 . A A . 21 GLY O 1 1 16 4640 1 1 21 GLY OXT O -1.111 -10.648 -4.004 1.00 . A A . 21 GLY OXT 1 1 17 4641 1 1 1 GLY C C -8.121 -2.844 2.194 1.00 . A A . 1 GLY C 1 1 17 4642 1 1 1 GLY CA C -8.454 -2.567 0.740 1.00 . A A . 1 GLY CA 1 1 17 4643 1 1 1 GLY H2 H -7.246 -1.048 -0.102 1.00 . A A . 1 GLY H2 1 1 17 4644 1 1 1 GLY HA2 H -9.276 -1.867 0.703 1.00 . A A . 1 GLY HA2 1 1 17 4645 1 1 1 GLY HA3 H -8.766 -3.490 0.273 1.00 . A A . 1 GLY HA3 1 1 17 4646 1 1 1 GLY N N -7.346 -2.017 -0.018 1.00 . A A . 1 GLY N 1 1 17 4647 1 1 1 GLY O O -8.910 -2.531 3.081 1.00 . A A . 1 GLY O 1 1 17 4648 1 1 2 GLY C C -5.088 -3.695 4.030 1.00 . A A . 2 GLY C 1 1 17 4649 1 1 2 GLY CA C -6.584 -3.760 3.808 1.00 . A A . 2 GLY CA 1 1 17 4650 1 1 2 GLY H H -6.371 -3.685 1.700 1.00 . A A . 2 GLY H 1 1 17 4651 1 1 2 GLY HA2 H -7.062 -3.060 4.476 1.00 . A A . 2 GLY HA2 1 1 17 4652 1 1 2 GLY HA3 H -6.929 -4.755 4.044 1.00 . A A . 2 GLY HA3 1 1 17 4653 1 1 2 GLY N N -6.965 -3.443 2.445 1.00 . A A . 2 GLY N 1 1 17 4654 1 1 2 GLY O O -4.475 -2.642 3.869 1.00 . A A . 2 GLY O 1 1 17 4655 1 1 3 ALA C C -2.413 -5.883 3.688 1.00 . A A . 3 ALA C 1 1 17 4656 1 1 3 ALA CA C -3.069 -4.899 4.648 1.00 . A A . 3 ALA CA 1 1 17 4657 1 1 3 ALA CB C -2.798 -5.299 6.091 1.00 . A A . 3 ALA CB 1 1 17 4658 1 1 3 ALA H H -5.045 -5.630 4.511 1.00 . A A . 3 ALA H 1 1 17 4659 1 1 3 ALA HA H -2.649 -3.917 4.483 1.00 . A A . 3 ALA HA 1 1 17 4660 1 1 3 ALA HB1 H -3.605 -4.950 6.718 1.00 . A A . 3 ALA HB1 1 1 17 4661 1 1 3 ALA HB2 H -1.870 -4.857 6.418 1.00 . A A . 3 ALA HB2 1 1 17 4662 1 1 3 ALA HB3 H -2.728 -6.375 6.159 1.00 . A A . 3 ALA HB3 1 1 17 4663 1 1 3 ALA N N -4.503 -4.823 4.402 1.00 . A A . 3 ALA N 1 1 17 4664 1 1 3 ALA O O -3.001 -6.903 3.332 1.00 . A A . 3 ALA O 1 1 17 4665 1 1 4 GLY C C 0.888 -5.872 2.011 1.00 . A A . 4 GLY C 1 1 17 4666 1 1 4 GLY CA C -0.482 -6.422 2.346 1.00 . A A . 4 GLY CA 1 1 17 4667 1 1 4 GLY H H -0.782 -4.736 3.580 1.00 . A A . 4 GLY H 1 1 17 4668 1 1 4 GLY HA2 H -0.371 -7.399 2.791 1.00 . A A . 4 GLY HA2 1 1 17 4669 1 1 4 GLY HA3 H -1.054 -6.515 1.435 1.00 . A A . 4 GLY HA3 1 1 17 4670 1 1 4 GLY N N -1.197 -5.565 3.266 1.00 . A A . 4 GLY N 1 1 17 4671 1 1 4 GLY O O 1.705 -5.638 2.900 1.00 . A A . 4 GLY O 1 1 17 4672 1 1 5 HIS C C 2.210 -4.079 -0.805 1.00 . A A . 5 HIS C 1 1 17 4673 1 1 5 HIS CA C 2.419 -5.133 0.274 1.00 . A A . 5 HIS CA 1 1 17 4674 1 1 5 HIS CB C 3.324 -6.251 -0.252 1.00 . A A . 5 HIS CB 1 1 17 4675 1 1 5 HIS CD2 C 3.659 -8.520 0.965 1.00 . A A . 5 HIS CD2 1 1 17 4676 1 1 5 HIS CE1 C 4.833 -7.797 2.670 1.00 . A A . 5 HIS CE1 1 1 17 4677 1 1 5 HIS CG C 3.813 -7.181 0.815 1.00 . A A . 5 HIS CG 1 1 17 4678 1 1 5 HIS H H 0.440 -5.871 0.065 1.00 . A A . 5 HIS H 1 1 17 4679 1 1 5 HIS HA H 2.899 -4.665 1.122 1.00 . A A . 5 HIS HA 1 1 17 4680 1 1 5 HIS HB2 H 2.777 -6.836 -0.976 1.00 . A A . 5 HIS HB2 1 1 17 4681 1 1 5 HIS HB3 H 4.187 -5.811 -0.731 1.00 . A A . 5 HIS HB3 1 1 17 4682 1 1 5 HIS HD1 H 4.825 -5.836 2.088 1.00 . A A . 5 HIS HD1 1 1 17 4683 1 1 5 HIS HD2 H 3.127 -9.182 0.296 1.00 . A A . 5 HIS HD2 1 1 17 4684 1 1 5 HIS HE1 H 5.400 -7.769 3.590 1.00 . A A . 5 HIS HE1 1 1 17 4685 1 1 5 HIS HE2 H 4.245 -9.756 2.556 1.00 . A A . 5 HIS HE2 1 1 17 4686 1 1 5 HIS N N 1.139 -5.664 0.729 1.00 . A A . 5 HIS N 1 1 17 4687 1 1 5 HIS ND1 N 4.553 -6.761 1.902 1.00 . A A . 5 HIS ND1 1 1 17 4688 1 1 5 HIS NE2 N 4.302 -8.877 2.125 1.00 . A A . 5 HIS NE2 1 1 17 4689 1 1 5 HIS O O 2.844 -3.029 -0.785 1.00 . A A . 5 HIS O 1 1 17 4690 1 1 6 VAL C C -0.097 -2.471 -2.370 1.00 . A A . 6 VAL C 1 1 17 4691 1 1 6 VAL CA C 1.016 -3.417 -2.812 1.00 . A A . 6 VAL CA 1 1 17 4692 1 1 6 VAL CB C 0.596 -4.146 -4.109 1.00 . A A . 6 VAL CB 1 1 17 4693 1 1 6 VAL CG1 C 0.477 -3.167 -5.270 1.00 . A A . 6 VAL CG1 1 1 17 4694 1 1 6 VAL CG2 C 1.579 -5.257 -4.443 1.00 . A A . 6 VAL CG2 1 1 17 4695 1 1 6 VAL H H 0.819 -5.208 -1.702 1.00 . A A . 6 VAL H 1 1 17 4696 1 1 6 VAL HA H 1.909 -2.844 -3.012 1.00 . A A . 6 VAL HA 1 1 17 4697 1 1 6 VAL HB H -0.375 -4.593 -3.946 1.00 . A A . 6 VAL HB 1 1 17 4698 1 1 6 VAL HG11 H 1.452 -2.762 -5.499 1.00 . A A . 6 VAL HG11 1 1 17 4699 1 1 6 VAL HG12 H -0.191 -2.364 -4.996 1.00 . A A . 6 VAL HG12 1 1 17 4700 1 1 6 VAL HG13 H 0.087 -3.681 -6.136 1.00 . A A . 6 VAL HG13 1 1 17 4701 1 1 6 VAL HG21 H 2.543 -5.026 -4.015 1.00 . A A . 6 VAL HG21 1 1 17 4702 1 1 6 VAL HG22 H 1.673 -5.346 -5.515 1.00 . A A . 6 VAL HG22 1 1 17 4703 1 1 6 VAL HG23 H 1.220 -6.191 -4.034 1.00 . A A . 6 VAL HG23 1 1 17 4704 1 1 6 VAL N N 1.308 -4.357 -1.739 1.00 . A A . 6 VAL N 1 1 17 4705 1 1 6 VAL O O -1.139 -2.917 -1.901 1.00 . A A . 6 VAL O 1 1 17 4706 1 1 7 PRO C C -2.172 -0.188 -2.836 1.00 . A A . 7 PRO C 1 1 17 4707 1 1 7 PRO CA C -0.854 -0.142 -2.058 1.00 . A A . 7 PRO CA 1 1 17 4708 1 1 7 PRO CB C -0.133 1.186 -2.317 1.00 . A A . 7 PRO CB 1 1 17 4709 1 1 7 PRO CD C 1.361 -0.547 -2.991 1.00 . A A . 7 PRO CD 1 1 17 4710 1 1 7 PRO CG C 0.947 0.864 -3.290 1.00 . A A . 7 PRO CG 1 1 17 4711 1 1 7 PRO HA H -1.069 -0.226 -1.003 1.00 . A A . 7 PRO HA 1 1 17 4712 1 1 7 PRO HB2 H -0.832 1.902 -2.728 1.00 . A A . 7 PRO HB2 1 1 17 4713 1 1 7 PRO HB3 H 0.271 1.564 -1.390 1.00 . A A . 7 PRO HB3 1 1 17 4714 1 1 7 PRO HD2 H 1.693 -1.042 -3.892 1.00 . A A . 7 PRO HD2 1 1 17 4715 1 1 7 PRO HD3 H 2.138 -0.562 -2.241 1.00 . A A . 7 PRO HD3 1 1 17 4716 1 1 7 PRO HG2 H 0.569 0.938 -4.299 1.00 . A A . 7 PRO HG2 1 1 17 4717 1 1 7 PRO HG3 H 1.781 1.537 -3.149 1.00 . A A . 7 PRO HG3 1 1 17 4718 1 1 7 PRO N N 0.124 -1.155 -2.479 1.00 . A A . 7 PRO N 1 1 17 4719 1 1 7 PRO O O -2.185 -0.304 -4.061 1.00 . A A . 7 PRO O 1 1 17 4720 1 1 8 GLU C C -5.047 1.349 -3.001 1.00 . A A . 8 GLU C 1 1 17 4721 1 1 8 GLU CA C -4.607 -0.077 -2.689 1.00 . A A . 8 GLU CA 1 1 17 4722 1 1 8 GLU CB C -5.623 -0.716 -1.737 1.00 . A A . 8 GLU CB 1 1 17 4723 1 1 8 GLU CD C -6.465 -2.815 -0.605 1.00 . A A . 8 GLU CD 1 1 17 4724 1 1 8 GLU CG C -5.336 -2.163 -1.388 1.00 . A A . 8 GLU CG 1 1 17 4725 1 1 8 GLU H H -3.185 0.027 -1.130 1.00 . A A . 8 GLU H 1 1 17 4726 1 1 8 GLU HA H -4.570 -0.646 -3.607 1.00 . A A . 8 GLU HA 1 1 17 4727 1 1 8 GLU HB2 H -5.640 -0.148 -0.818 1.00 . A A . 8 GLU HB2 1 1 17 4728 1 1 8 GLU HB3 H -6.602 -0.668 -2.193 1.00 . A A . 8 GLU HB3 1 1 17 4729 1 1 8 GLU HG2 H -5.188 -2.718 -2.303 1.00 . A A . 8 GLU HG2 1 1 17 4730 1 1 8 GLU HG3 H -4.435 -2.205 -0.794 1.00 . A A . 8 GLU HG3 1 1 17 4731 1 1 8 GLU N N -3.274 -0.076 -2.100 1.00 . A A . 8 GLU N 1 1 17 4732 1 1 8 GLU O O -5.042 1.782 -4.151 1.00 . A A . 8 GLU O 1 1 17 4733 1 1 8 GLU OE1 O -6.519 -4.059 -0.537 1.00 . A A . 8 GLU OE1 1 1 17 4734 1 1 9 TYR C C -4.843 4.403 -1.501 1.00 . A A . 9 TYR C 1 1 17 4735 1 1 9 TYR CA C -5.871 3.457 -2.102 1.00 . A A . 9 TYR CA 1 1 17 4736 1 1 9 TYR CB C -7.228 3.680 -1.422 1.00 . A A . 9 TYR CB 1 1 17 4737 1 1 9 TYR CD1 C -8.414 1.460 -1.696 1.00 . A A . 9 TYR CD1 1 1 17 4738 1 1 9 TYR CD2 C -9.355 3.378 -2.752 1.00 . A A . 9 TYR CD2 1 1 17 4739 1 1 9 TYR CE1 C -9.441 0.680 -2.187 1.00 . A A . 9 TYR CE1 1 1 17 4740 1 1 9 TYR CE2 C -10.387 2.604 -3.245 1.00 . A A . 9 TYR CE2 1 1 17 4741 1 1 9 TYR CG C -8.350 2.822 -1.971 1.00 . A A . 9 TYR CG 1 1 17 4742 1 1 9 TYR CZ C -10.425 1.255 -2.961 1.00 . A A . 9 TYR CZ 1 1 17 4743 1 1 9 TYR H H -5.406 1.677 -1.060 1.00 . A A . 9 TYR H 1 1 17 4744 1 1 9 TYR HA H -5.965 3.668 -3.156 1.00 . A A . 9 TYR HA 1 1 17 4745 1 1 9 TYR HB2 H -7.130 3.465 -0.371 1.00 . A A . 9 TYR HB2 1 1 17 4746 1 1 9 TYR HB3 H -7.514 4.715 -1.545 1.00 . A A . 9 TYR HB3 1 1 17 4747 1 1 9 TYR HD1 H -7.642 1.010 -1.088 1.00 . A A . 9 TYR HD1 1 1 17 4748 1 1 9 TYR HD2 H -9.320 4.434 -2.975 1.00 . A A . 9 TYR HD2 1 1 17 4749 1 1 9 TYR HE1 H -9.471 -0.377 -1.964 1.00 . A A . 9 TYR HE1 1 1 17 4750 1 1 9 TYR HE2 H -11.158 3.056 -3.852 1.00 . A A . 9 TYR HE2 1 1 17 4751 1 1 9 TYR HH H -11.938 0.976 -4.112 1.00 . A A . 9 TYR HH 1 1 17 4752 1 1 9 TYR N N -5.428 2.078 -1.957 1.00 . A A . 9 TYR N 1 1 17 4753 1 1 9 TYR O O -4.245 4.107 -0.462 1.00 . A A . 9 TYR O 1 1 17 4754 1 1 9 TYR OH O -11.448 0.480 -3.452 1.00 . A A . 9 TYR OH 1 1 17 4755 1 1 10 PHE C C -4.401 7.763 -1.183 1.00 . A A . 10 PHE C 1 1 17 4756 1 1 10 PHE CA C -3.685 6.521 -1.688 1.00 . A A . 10 PHE CA 1 1 17 4757 1 1 10 PHE CB C -2.711 6.936 -2.798 1.00 . A A . 10 PHE CB 1 1 17 4758 1 1 10 PHE CD1 C -2.685 4.918 -4.308 1.00 . A A . 10 PHE CD1 1 1 17 4759 1 1 10 PHE CD2 C -0.636 5.622 -3.313 1.00 . A A . 10 PHE CD2 1 1 17 4760 1 1 10 PHE CE1 C -2.026 3.884 -4.943 1.00 . A A . 10 PHE CE1 1 1 17 4761 1 1 10 PHE CE2 C 0.028 4.588 -3.945 1.00 . A A . 10 PHE CE2 1 1 17 4762 1 1 10 PHE CG C -1.999 5.800 -3.485 1.00 . A A . 10 PHE CG 1 1 17 4763 1 1 10 PHE CZ C -0.668 3.720 -4.762 1.00 . A A . 10 PHE CZ 1 1 17 4764 1 1 10 PHE H H -5.149 5.710 -2.972 1.00 . A A . 10 PHE H 1 1 17 4765 1 1 10 PHE HA H -3.125 6.085 -0.874 1.00 . A A . 10 PHE HA 1 1 17 4766 1 1 10 PHE HB2 H -3.255 7.486 -3.545 1.00 . A A . 10 PHE HB2 1 1 17 4767 1 1 10 PHE HB3 H -1.959 7.585 -2.370 1.00 . A A . 10 PHE HB3 1 1 17 4768 1 1 10 PHE HD1 H -3.748 5.046 -4.451 1.00 . A A . 10 PHE HD1 1 1 17 4769 1 1 10 PHE HD2 H -0.090 6.301 -2.676 1.00 . A A . 10 PHE HD2 1 1 17 4770 1 1 10 PHE HE1 H -2.573 3.206 -5.581 1.00 . A A . 10 PHE HE1 1 1 17 4771 1 1 10 PHE HE2 H 1.091 4.462 -3.801 1.00 . A A . 10 PHE HE2 1 1 17 4772 1 1 10 PHE HZ H -0.150 2.911 -5.257 1.00 . A A . 10 PHE HZ 1 1 17 4773 1 1 10 PHE N N -4.640 5.533 -2.155 1.00 . A A . 10 PHE N 1 1 17 4774 1 1 10 PHE O O -5.412 8.184 -1.742 1.00 . A A . 10 PHE O 1 1 17 4775 1 1 11 VAL C C -3.821 10.763 -0.318 1.00 . A A . 11 VAL C 1 1 17 4776 1 1 11 VAL CA C -4.385 9.566 0.440 1.00 . A A . 11 VAL CA 1 1 17 4777 1 1 11 VAL CB C -4.026 9.686 1.943 1.00 . A A . 11 VAL CB 1 1 17 4778 1 1 11 VAL CG1 C -4.687 10.901 2.577 1.00 . A A . 11 VAL CG1 1 1 17 4779 1 1 11 VAL CG2 C -4.418 8.422 2.689 1.00 . A A . 11 VAL CG2 1 1 17 4780 1 1 11 VAL H H -3.026 7.968 0.230 1.00 . A A . 11 VAL H 1 1 17 4781 1 1 11 VAL HA H -5.461 9.551 0.336 1.00 . A A . 11 VAL HA 1 1 17 4782 1 1 11 VAL HB H -2.956 9.805 2.025 1.00 . A A . 11 VAL HB 1 1 17 4783 1 1 11 VAL HG11 H -4.613 10.831 3.653 1.00 . A A . 11 VAL HG11 1 1 17 4784 1 1 11 VAL HG12 H -5.726 10.937 2.289 1.00 . A A . 11 VAL HG12 1 1 17 4785 1 1 11 VAL HG13 H -4.189 11.798 2.241 1.00 . A A . 11 VAL HG13 1 1 17 4786 1 1 11 VAL HG21 H -3.891 7.577 2.270 1.00 . A A . 11 VAL HG21 1 1 17 4787 1 1 11 VAL HG22 H -5.482 8.266 2.596 1.00 . A A . 11 VAL HG22 1 1 17 4788 1 1 11 VAL HG23 H -4.160 8.526 3.733 1.00 . A A . 11 VAL HG23 1 1 17 4789 1 1 11 VAL N N -3.849 8.351 -0.144 1.00 . A A . 11 VAL N 1 1 17 4790 1 1 11 VAL O O -2.724 10.677 -0.874 1.00 . A A . 11 VAL O 1 1 17 4791 1 1 12 GLY C C -2.760 13.548 -0.609 1.00 . A A . 12 GLY C 1 1 17 4792 1 1 12 GLY CA C -4.131 13.060 -1.047 1.00 . A A . 12 GLY CA 1 1 17 4793 1 1 12 GLY H H -5.434 11.858 0.109 1.00 . A A . 12 GLY H 1 1 17 4794 1 1 12 GLY HA2 H -4.096 12.846 -2.101 1.00 . A A . 12 GLY HA2 1 1 17 4795 1 1 12 GLY HA3 H -4.851 13.845 -0.875 1.00 . A A . 12 GLY HA3 1 1 17 4796 1 1 12 GLY N N -4.569 11.862 -0.346 1.00 . A A . 12 GLY N 1 1 17 4797 1 1 12 GLY O O -2.079 14.244 -1.356 1.00 . A A . 12 GLY O 1 1 17 4798 1 1 13 ILE C C 0.060 12.652 0.628 1.00 . A A . 13 ILE C 1 1 17 4799 1 1 13 ILE CA C -1.058 13.581 1.137 1.00 . A A . 13 ILE CA 1 1 17 4800 1 1 13 ILE CB C -1.071 13.593 2.688 1.00 . A A . 13 ILE CB 1 1 17 4801 1 1 13 ILE CD1 C -2.627 15.622 2.824 1.00 . A A . 13 ILE CD1 1 1 17 4802 1 1 13 ILE CG1 C -2.391 14.175 3.213 1.00 . A A . 13 ILE CG1 1 1 17 4803 1 1 13 ILE CG2 C 0.104 14.397 3.236 1.00 . A A . 13 ILE CG2 1 1 17 4804 1 1 13 ILE H H -2.944 12.619 1.140 1.00 . A A . 13 ILE H 1 1 17 4805 1 1 13 ILE HA H -0.855 14.581 0.789 1.00 . A A . 13 ILE HA 1 1 17 4806 1 1 13 ILE HB H -0.973 12.575 3.036 1.00 . A A . 13 ILE HB 1 1 17 4807 1 1 13 ILE HD11 H -3.361 15.667 2.033 1.00 . A A . 13 ILE HD11 1 1 17 4808 1 1 13 ILE HD12 H -1.700 16.058 2.482 1.00 . A A . 13 ILE HD12 1 1 17 4809 1 1 13 ILE HD13 H -2.988 16.170 3.682 1.00 . A A . 13 ILE HD13 1 1 17 4810 1 1 13 ILE HG12 H -3.212 13.592 2.823 1.00 . A A . 13 ILE HG12 1 1 17 4811 1 1 13 ILE HG13 H -2.397 14.116 4.292 1.00 . A A . 13 ILE HG13 1 1 17 4812 1 1 13 ILE HG21 H -0.021 15.438 2.977 1.00 . A A . 13 ILE HG21 1 1 17 4813 1 1 13 ILE HG22 H 1.024 14.027 2.807 1.00 . A A . 13 ILE HG22 1 1 17 4814 1 1 13 ILE HG23 H 0.140 14.295 4.311 1.00 . A A . 13 ILE HG23 1 1 17 4815 1 1 13 ILE N N -2.357 13.179 0.599 1.00 . A A . 13 ILE N 1 1 17 4816 1 1 13 ILE O O 1.053 12.412 1.311 1.00 . A A . 13 ILE O 1 1 17 4817 1 1 14 GLY C C 1.279 10.089 -0.382 1.00 . A A . 14 GLY C 1 1 17 4818 1 1 14 GLY CA C 0.868 11.287 -1.226 1.00 . A A . 14 GLY CA 1 1 17 4819 1 1 14 GLY H H -0.922 12.410 -1.088 1.00 . A A . 14 GLY H 1 1 17 4820 1 1 14 GLY HA2 H 0.454 10.922 -2.154 1.00 . A A . 14 GLY HA2 1 1 17 4821 1 1 14 GLY HA3 H 1.749 11.870 -1.449 1.00 . A A . 14 GLY HA3 1 1 17 4822 1 1 14 GLY N N -0.115 12.158 -0.594 1.00 . A A . 14 GLY N 1 1 17 4823 1 1 14 GLY O O 2.466 9.797 -0.260 1.00 . A A . 14 GLY O 1 1 17 4824 1 1 15 THR C C -0.515 7.206 0.980 1.00 . A A . 15 THR C 1 1 17 4825 1 1 15 THR CA C 0.620 8.228 1.020 1.00 . A A . 15 THR CA 1 1 17 4826 1 1 15 THR CB C 0.916 8.637 2.486 1.00 . A A . 15 THR CB 1 1 17 4827 1 1 15 THR CG2 C -0.234 9.438 3.085 1.00 . A A . 15 THR CG2 1 1 17 4828 1 1 15 THR H H -0.621 9.658 0.068 1.00 . A A . 15 THR H 1 1 17 4829 1 1 15 THR HA H 1.511 7.769 0.615 1.00 . A A . 15 THR HA 1 1 17 4830 1 1 15 THR HB H 1.802 9.255 2.493 1.00 . A A . 15 THR HB 1 1 17 4831 1 1 15 THR HG1 H 0.349 6.968 3.384 1.00 . A A . 15 THR HG1 1 1 17 4832 1 1 15 THR HG21 H -0.392 10.332 2.500 1.00 . A A . 15 THR HG21 1 1 17 4833 1 1 15 THR HG22 H 0.010 9.712 4.101 1.00 . A A . 15 THR HG22 1 1 17 4834 1 1 15 THR HG23 H -1.131 8.838 3.078 1.00 . A A . 15 THR HG23 1 1 17 4835 1 1 15 THR N N 0.312 9.391 0.198 1.00 . A A . 15 THR N 1 1 17 4836 1 1 15 THR O O -1.683 7.560 1.109 1.00 . A A . 15 THR O 1 1 17 4837 1 1 15 THR OG1 O 1.162 7.473 3.288 1.00 . A A . 15 THR OG1 1 1 17 4838 1 1 16 PRO C C -1.803 4.576 2.109 1.00 . A A . 16 PRO C 1 1 17 4839 1 1 16 PRO CA C -1.179 4.842 0.741 1.00 . A A . 16 PRO CA 1 1 17 4840 1 1 16 PRO CB C -0.378 3.617 0.277 1.00 . A A . 16 PRO CB 1 1 17 4841 1 1 16 PRO CD C 1.176 5.404 0.624 1.00 . A A . 16 PRO CD 1 1 17 4842 1 1 16 PRO CG C 0.954 4.139 -0.151 1.00 . A A . 16 PRO CG 1 1 17 4843 1 1 16 PRO HA H -1.961 5.059 0.027 1.00 . A A . 16 PRO HA 1 1 17 4844 1 1 16 PRO HB2 H -0.281 2.920 1.096 1.00 . A A . 16 PRO HB2 1 1 17 4845 1 1 16 PRO HB3 H -0.894 3.141 -0.545 1.00 . A A . 16 PRO HB3 1 1 17 4846 1 1 16 PRO HD2 H 1.633 5.189 1.579 1.00 . A A . 16 PRO HD2 1 1 17 4847 1 1 16 PRO HD3 H 1.782 6.095 0.058 1.00 . A A . 16 PRO HD3 1 1 17 4848 1 1 16 PRO HG2 H 1.723 3.418 0.082 1.00 . A A . 16 PRO HG2 1 1 17 4849 1 1 16 PRO HG3 H 0.944 4.347 -1.210 1.00 . A A . 16 PRO HG3 1 1 17 4850 1 1 16 PRO N N -0.187 5.919 0.795 1.00 . A A . 16 PRO N 1 1 17 4851 1 1 16 PRO O O -1.120 4.640 3.130 1.00 . A A . 16 PRO O 1 1 17 4852 1 1 17 ILE C C -4.467 2.636 3.324 1.00 . A A . 17 ILE C 1 1 17 4853 1 1 17 ILE CA C -3.791 4.008 3.382 1.00 . A A . 17 ILE CA 1 1 17 4854 1 1 17 ILE CB C -4.818 5.128 3.698 1.00 . A A . 17 ILE CB 1 1 17 4855 1 1 17 ILE CD1 C -4.256 5.215 6.185 1.00 . A A . 17 ILE CD1 1 1 17 4856 1 1 17 ILE CG1 C -5.333 5.021 5.139 1.00 . A A . 17 ILE CG1 1 1 17 4857 1 1 17 ILE CG2 C -5.977 5.100 2.707 1.00 . A A . 17 ILE CG2 1 1 17 4858 1 1 17 ILE H H -3.596 4.242 1.282 1.00 . A A . 17 ILE H 1 1 17 4859 1 1 17 ILE HA H -3.050 3.988 4.166 1.00 . A A . 17 ILE HA 1 1 17 4860 1 1 17 ILE HB H -4.314 6.076 3.582 1.00 . A A . 17 ILE HB 1 1 17 4861 1 1 17 ILE HD11 H -3.537 4.412 6.114 1.00 . A A . 17 ILE HD11 1 1 17 4862 1 1 17 ILE HD12 H -4.703 5.211 7.167 1.00 . A A . 17 ILE HD12 1 1 17 4863 1 1 17 ILE HD13 H -3.758 6.157 6.017 1.00 . A A . 17 ILE HD13 1 1 17 4864 1 1 17 ILE HG12 H -6.089 5.775 5.300 1.00 . A A . 17 ILE HG12 1 1 17 4865 1 1 17 ILE HG13 H -5.769 4.042 5.286 1.00 . A A . 17 ILE HG13 1 1 17 4866 1 1 17 ILE HG21 H -5.969 4.166 2.167 1.00 . A A . 17 ILE HG21 1 1 17 4867 1 1 17 ILE HG22 H -5.874 5.920 2.011 1.00 . A A . 17 ILE HG22 1 1 17 4868 1 1 17 ILE HG23 H -6.911 5.199 3.243 1.00 . A A . 17 ILE HG23 1 1 17 4869 1 1 17 ILE N N -3.095 4.279 2.130 1.00 . A A . 17 ILE N 1 1 17 4870 1 1 17 ILE O O -5.493 2.383 3.952 1.00 . A A . 17 ILE O 1 1 17 4871 1 1 18 SER C C -3.414 -0.364 1.433 1.00 . A A . 18 SER C 1 1 17 4872 1 1 18 SER CA C -4.338 0.389 2.380 1.00 . A A . 18 SER CA 1 1 17 4873 1 1 18 SER CB C -5.771 0.387 1.835 1.00 . A A . 18 SER CB 1 1 17 4874 1 1 18 SER H H -3.034 2.026 2.100 1.00 . A A . 18 SER H 1 1 17 4875 1 1 18 SER HA H -4.324 -0.099 3.343 1.00 . A A . 18 SER HA 1 1 17 4876 1 1 18 SER HB2 H -6.020 -0.603 1.484 1.00 . A A . 18 SER HB2 1 1 17 4877 1 1 18 SER HB3 H -6.453 0.671 2.624 1.00 . A A . 18 SER HB3 1 1 17 4878 1 1 18 SER HG H -5.960 2.196 1.111 1.00 . A A . 18 SER HG 1 1 17 4879 1 1 18 SER N N -3.854 1.753 2.558 1.00 . A A . 18 SER N 1 1 17 4880 1 1 18 SER O O -2.799 0.243 0.556 1.00 . A A . 18 SER O 1 1 17 4881 1 1 18 SER OG O -5.913 1.300 0.758 1.00 . A A . 18 SER OG 1 1 17 4882 1 1 19 PHE C C -3.082 -3.877 0.574 1.00 . A A . 19 PHE C 1 1 17 4883 1 1 19 PHE CA C -2.449 -2.505 0.781 1.00 . A A . 19 PHE CA 1 1 17 4884 1 1 19 PHE CB C -1.058 -2.707 1.406 1.00 . A A . 19 PHE CB 1 1 17 4885 1 1 19 PHE CD1 C -0.646 -0.834 3.038 1.00 . A A . 19 PHE CD1 1 1 17 4886 1 1 19 PHE CD2 C 0.617 -0.878 1.016 1.00 . A A . 19 PHE CD2 1 1 17 4887 1 1 19 PHE CE1 C 0.006 0.321 3.423 1.00 . A A . 19 PHE CE1 1 1 17 4888 1 1 19 PHE CE2 C 1.273 0.277 1.396 1.00 . A A . 19 PHE CE2 1 1 17 4889 1 1 19 PHE CG C -0.349 -1.447 1.828 1.00 . A A . 19 PHE CG 1 1 17 4890 1 1 19 PHE CZ C 0.967 0.876 2.602 1.00 . A A . 19 PHE CZ 1 1 17 4891 1 1 19 PHE H H -3.816 -2.099 2.344 1.00 . A A . 19 PHE H 1 1 17 4892 1 1 19 PHE HA H -2.340 -2.018 -0.178 1.00 . A A . 19 PHE HA 1 1 17 4893 1 1 19 PHE HB2 H -1.160 -3.335 2.274 1.00 . A A . 19 PHE HB2 1 1 17 4894 1 1 19 PHE HB3 H -0.429 -3.213 0.690 1.00 . A A . 19 PHE HB3 1 1 17 4895 1 1 19 PHE HD1 H -1.397 -1.267 3.682 1.00 . A A . 19 PHE HD1 1 1 17 4896 1 1 19 PHE HD2 H 0.857 -1.346 0.072 1.00 . A A . 19 PHE HD2 1 1 17 4897 1 1 19 PHE HE1 H -0.233 0.790 4.366 1.00 . A A . 19 PHE HE1 1 1 17 4898 1 1 19 PHE HE2 H 2.024 0.709 0.751 1.00 . A A . 19 PHE HE2 1 1 17 4899 1 1 19 PHE HZ H 1.478 1.780 2.900 1.00 . A A . 19 PHE HZ 1 1 17 4900 1 1 19 PHE N N -3.306 -1.673 1.618 1.00 . A A . 19 PHE N 1 1 17 4901 1 1 19 PHE O O -4.081 -4.211 1.210 1.00 . A A . 19 PHE O 1 1 17 4902 1 1 20 TYR C C -1.791 -6.819 -1.228 1.00 . A A . 20 TYR C 1 1 17 4903 1 1 20 TYR CA C -2.926 -6.021 -0.596 1.00 . A A . 20 TYR CA 1 1 17 4904 1 1 20 TYR CB C -4.175 -6.037 -1.507 1.00 . A A . 20 TYR CB 1 1 17 4905 1 1 20 TYR CD1 C -2.860 -5.008 -3.438 1.00 . A A . 20 TYR CD1 1 1 17 4906 1 1 20 TYR CD2 C -5.225 -4.752 -3.414 1.00 . A A . 20 TYR CD2 1 1 17 4907 1 1 20 TYR CE1 C -2.792 -4.294 -4.619 1.00 . A A . 20 TYR CE1 1 1 17 4908 1 1 20 TYR CE2 C -5.165 -4.036 -4.594 1.00 . A A . 20 TYR CE2 1 1 17 4909 1 1 20 TYR CG C -4.077 -5.251 -2.811 1.00 . A A . 20 TYR CG 1 1 17 4910 1 1 20 TYR CZ C -3.946 -3.809 -5.191 1.00 . A A . 20 TYR CZ 1 1 17 4911 1 1 20 TYR H H -1.671 -4.322 -0.751 1.00 . A A . 20 TYR H 1 1 17 4912 1 1 20 TYR HA H -3.181 -6.485 0.346 1.00 . A A . 20 TYR HA 1 1 17 4913 1 1 20 TYR HB2 H -4.398 -7.057 -1.768 1.00 . A A . 20 TYR HB2 1 1 17 4914 1 1 20 TYR HB3 H -5.007 -5.639 -0.950 1.00 . A A . 20 TYR HB3 1 1 17 4915 1 1 20 TYR HD1 H -1.954 -5.388 -2.989 1.00 . A A . 20 TYR HD1 1 1 17 4916 1 1 20 TYR HD2 H -6.182 -4.928 -2.943 1.00 . A A . 20 TYR HD2 1 1 17 4917 1 1 20 TYR HE1 H -1.836 -4.116 -5.087 1.00 . A A . 20 TYR HE1 1 1 17 4918 1 1 20 TYR HE2 H -6.071 -3.657 -5.043 1.00 . A A . 20 TYR HE2 1 1 17 4919 1 1 20 TYR HH H -3.579 -2.200 -6.177 1.00 . A A . 20 TYR HH 1 1 17 4920 1 1 20 TYR N N -2.473 -4.663 -0.299 1.00 . A A . 20 TYR N 1 1 17 4921 1 1 20 TYR O O -0.621 -6.434 -1.122 1.00 . A A . 20 TYR O 1 1 17 4922 1 1 20 TYR OH O -3.880 -3.095 -6.364 1.00 . A A . 20 TYR OH 1 1 17 4923 1 1 21 GLY C C -1.780 -9.911 -3.224 1.00 . A A . 21 GLY C 1 1 17 4924 1 1 21 GLY CA C -1.139 -8.736 -2.529 1.00 . A A . 21 GLY CA 1 1 17 4925 1 1 21 GLY H H -3.079 -8.166 -1.948 1.00 . A A . 21 GLY H 1 1 17 4926 1 1 21 GLY HA2 H -0.601 -8.144 -3.255 1.00 . A A . 21 GLY HA2 1 1 17 4927 1 1 21 GLY HA3 H -0.446 -9.101 -1.785 1.00 . A A . 21 GLY HA3 1 1 17 4928 1 1 21 GLY N N -2.132 -7.910 -1.886 1.00 . A A . 21 GLY N 1 1 17 4929 1 1 21 GLY O O -3.026 -9.991 -3.200 1.00 . A A . 21 GLY O 1 1 17 4930 1 1 21 GLY OXT O -1.045 -10.745 -3.784 1.00 . A A . 21 GLY OXT 1 1 18 4931 1 1 1 GLY C C -8.081 -3.326 1.473 1.00 . A A . 1 GLY C 1 1 18 4932 1 1 1 GLY CA C -8.482 -2.407 0.333 1.00 . A A . 1 GLY CA 1 1 18 4933 1 1 1 GLY H2 H -7.214 -0.928 -0.493 1.00 . A A . 1 GLY H2 1 1 18 4934 1 1 1 GLY HA2 H -9.032 -1.572 0.740 1.00 . A A . 1 GLY HA2 1 1 18 4935 1 1 1 GLY HA3 H -9.128 -2.952 -0.341 1.00 . A A . 1 GLY HA3 1 1 18 4936 1 1 1 GLY N N -7.349 -1.895 -0.423 1.00 . A A . 1 GLY N 1 1 18 4937 1 1 1 GLY O O -8.738 -4.334 1.724 1.00 . A A . 1 GLY O 1 1 18 4938 1 1 2 GLY C C -5.122 -3.474 3.659 1.00 . A A . 2 GLY C 1 1 18 4939 1 1 2 GLY CA C -6.550 -3.789 3.277 1.00 . A A . 2 GLY CA 1 1 18 4940 1 1 2 GLY H H -6.523 -2.165 1.929 1.00 . A A . 2 GLY H 1 1 18 4941 1 1 2 GLY HA2 H -7.189 -3.610 4.129 1.00 . A A . 2 GLY HA2 1 1 18 4942 1 1 2 GLY HA3 H -6.618 -4.831 3.002 1.00 . A A . 2 GLY HA3 1 1 18 4943 1 1 2 GLY N N -7.008 -2.978 2.168 1.00 . A A . 2 GLY N 1 1 18 4944 1 1 2 GLY O O -4.725 -2.308 3.689 1.00 . A A . 2 GLY O 1 1 18 4945 1 1 3 ALA C C -2.115 -5.435 3.612 1.00 . A A . 3 ALA C 1 1 18 4946 1 1 3 ALA CA C -2.942 -4.353 4.285 1.00 . A A . 3 ALA CA 1 1 18 4947 1 1 3 ALA CB C -2.770 -4.405 5.796 1.00 . A A . 3 ALA CB 1 1 18 4948 1 1 3 ALA H H -4.714 -5.415 3.856 1.00 . A A . 3 ALA H 1 1 18 4949 1 1 3 ALA HA H -2.610 -3.385 3.935 1.00 . A A . 3 ALA HA 1 1 18 4950 1 1 3 ALA HB1 H -3.718 -4.639 6.258 1.00 . A A . 3 ALA HB1 1 1 18 4951 1 1 3 ALA HB2 H -2.421 -3.448 6.153 1.00 . A A . 3 ALA HB2 1 1 18 4952 1 1 3 ALA HB3 H -2.049 -5.169 6.049 1.00 . A A . 3 ALA HB3 1 1 18 4953 1 1 3 ALA N N -4.342 -4.509 3.923 1.00 . A A . 3 ALA N 1 1 18 4954 1 1 3 ALA O O -2.559 -6.575 3.497 1.00 . A A . 3 ALA O 1 1 18 4955 1 1 4 GLY C C 1.189 -5.403 1.946 1.00 . A A . 4 GLY C 1 1 18 4956 1 1 4 GLY CA C -0.077 -6.032 2.482 1.00 . A A . 4 GLY CA 1 1 18 4957 1 1 4 GLY H H -0.628 -4.148 3.263 1.00 . A A . 4 GLY H 1 1 18 4958 1 1 4 GLY HA2 H 0.188 -6.812 3.176 1.00 . A A . 4 GLY HA2 1 1 18 4959 1 1 4 GLY HA3 H -0.625 -6.467 1.660 1.00 . A A . 4 GLY HA3 1 1 18 4960 1 1 4 GLY N N -0.927 -5.074 3.154 1.00 . A A . 4 GLY N 1 1 18 4961 1 1 4 GLY O O 1.985 -4.853 2.706 1.00 . A A . 4 GLY O 1 1 18 4962 1 1 5 HIS C C 2.249 -3.979 -1.143 1.00 . A A . 5 HIS C 1 1 18 4963 1 1 5 HIS CA C 2.581 -4.932 0.005 1.00 . A A . 5 HIS CA 1 1 18 4964 1 1 5 HIS CB C 3.500 -6.050 -0.501 1.00 . A A . 5 HIS CB 1 1 18 4965 1 1 5 HIS CD2 C 4.605 -6.246 1.845 1.00 . A A . 5 HIS CD2 1 1 18 4966 1 1 5 HIS CE1 C 5.938 -7.937 1.429 1.00 . A A . 5 HIS CE1 1 1 18 4967 1 1 5 HIS CG C 4.407 -6.612 0.554 1.00 . A A . 5 HIS CG 1 1 18 4968 1 1 5 HIS H H 0.711 -5.950 0.085 1.00 . A A . 5 HIS H 1 1 18 4969 1 1 5 HIS HA H 3.111 -4.374 0.763 1.00 . A A . 5 HIS HA 1 1 18 4970 1 1 5 HIS HB2 H 2.894 -6.858 -0.881 1.00 . A A . 5 HIS HB2 1 1 18 4971 1 1 5 HIS HB3 H 4.117 -5.663 -1.298 1.00 . A A . 5 HIS HB3 1 1 18 4972 1 1 5 HIS HD1 H 5.352 -8.164 -0.520 1.00 . A A . 5 HIS HD1 1 1 18 4973 1 1 5 HIS HD2 H 4.104 -5.445 2.368 1.00 . A A . 5 HIS HD2 1 1 18 4974 1 1 5 HIS HE1 H 6.679 -8.715 1.544 1.00 . A A . 5 HIS HE1 1 1 18 4975 1 1 5 HIS HE2 H 5.950 -7.020 3.261 1.00 . A A . 5 HIS HE2 1 1 18 4976 1 1 5 HIS N N 1.386 -5.492 0.636 1.00 . A A . 5 HIS N 1 1 18 4977 1 1 5 HIS ND1 N 5.259 -7.675 0.326 1.00 . A A . 5 HIS ND1 1 1 18 4978 1 1 5 HIS NE2 N 5.562 -7.085 2.363 1.00 . A A . 5 HIS NE2 1 1 18 4979 1 1 5 HIS O O 2.884 -2.940 -1.283 1.00 . A A . 5 HIS O 1 1 18 4980 1 1 6 VAL C C -0.156 -2.464 -2.666 1.00 . A A . 6 VAL C 1 1 18 4981 1 1 6 VAL CA C 0.893 -3.483 -3.097 1.00 . A A . 6 VAL CA 1 1 18 4982 1 1 6 VAL CB C 0.343 -4.320 -4.275 1.00 . A A . 6 VAL CB 1 1 18 4983 1 1 6 VAL CG1 C 0.054 -3.436 -5.481 1.00 . A A . 6 VAL CG1 1 1 18 4984 1 1 6 VAL CG2 C 1.316 -5.428 -4.643 1.00 . A A . 6 VAL CG2 1 1 18 4985 1 1 6 VAL H H 0.791 -5.173 -1.819 1.00 . A A . 6 VAL H 1 1 18 4986 1 1 6 VAL HA H 1.778 -2.959 -3.432 1.00 . A A . 6 VAL HA 1 1 18 4987 1 1 6 VAL HB H -0.585 -4.774 -3.961 1.00 . A A . 6 VAL HB 1 1 18 4988 1 1 6 VAL HG11 H 0.161 -4.017 -6.386 1.00 . A A . 6 VAL HG11 1 1 18 4989 1 1 6 VAL HG12 H 0.749 -2.610 -5.498 1.00 . A A . 6 VAL HG12 1 1 18 4990 1 1 6 VAL HG13 H -0.955 -3.056 -5.415 1.00 . A A . 6 VAL HG13 1 1 18 4991 1 1 6 VAL HG21 H 2.120 -5.455 -3.923 1.00 . A A . 6 VAL HG21 1 1 18 4992 1 1 6 VAL HG22 H 1.719 -5.243 -5.628 1.00 . A A . 6 VAL HG22 1 1 18 4993 1 1 6 VAL HG23 H 0.798 -6.377 -4.641 1.00 . A A . 6 VAL HG23 1 1 18 4994 1 1 6 VAL N N 1.269 -4.333 -1.966 1.00 . A A . 6 VAL N 1 1 18 4995 1 1 6 VAL O O -1.220 -2.837 -2.200 1.00 . A A . 6 VAL O 1 1 18 4996 1 1 7 PRO C C -2.111 -0.099 -3.151 1.00 . A A . 7 PRO C 1 1 18 4997 1 1 7 PRO CA C -0.780 -0.091 -2.396 1.00 . A A . 7 PRO CA 1 1 18 4998 1 1 7 PRO CB C 0.000 1.191 -2.709 1.00 . A A . 7 PRO CB 1 1 18 4999 1 1 7 PRO CD C 1.405 -0.634 -3.331 1.00 . A A . 7 PRO CD 1 1 18 5000 1 1 7 PRO CG C 1.057 0.783 -3.676 1.00 . A A . 7 PRO CG 1 1 18 5001 1 1 7 PRO HA H -0.981 -0.132 -1.336 1.00 . A A . 7 PRO HA 1 1 18 5002 1 1 7 PRO HB2 H -0.669 1.923 -3.142 1.00 . A A . 7 PRO HB2 1 1 18 5003 1 1 7 PRO HB3 H 0.428 1.585 -1.800 1.00 . A A . 7 PRO HB3 1 1 18 5004 1 1 7 PRO HD2 H 1.711 -1.176 -4.214 1.00 . A A . 7 PRO HD2 1 1 18 5005 1 1 7 PRO HD3 H 2.180 -0.662 -2.579 1.00 . A A . 7 PRO HD3 1 1 18 5006 1 1 7 PRO HG2 H 0.675 0.841 -4.684 1.00 . A A . 7 PRO HG2 1 1 18 5007 1 1 7 PRO HG3 H 1.923 1.419 -3.564 1.00 . A A . 7 PRO HG3 1 1 18 5008 1 1 7 PRO N N 0.140 -1.165 -2.799 1.00 . A A . 7 PRO N 1 1 18 5009 1 1 7 PRO O O -2.147 -0.200 -4.377 1.00 . A A . 7 PRO O 1 1 18 5010 1 1 8 GLU C C -4.964 1.505 -3.229 1.00 . A A . 8 GLU C 1 1 18 5011 1 1 8 GLU CA C -4.542 0.064 -2.968 1.00 . A A . 8 GLU CA 1 1 18 5012 1 1 8 GLU CB C -5.559 -0.589 -2.025 1.00 . A A . 8 GLU CB 1 1 18 5013 1 1 8 GLU CD C -6.491 -2.715 -1.028 1.00 . A A . 8 GLU CD 1 1 18 5014 1 1 8 GLU CG C -5.348 -2.073 -1.794 1.00 . A A . 8 GLU CG 1 1 18 5015 1 1 8 GLU H H -3.096 0.120 -1.429 1.00 . A A . 8 GLU H 1 1 18 5016 1 1 8 GLU HA H -4.526 -0.476 -3.904 1.00 . A A . 8 GLU HA 1 1 18 5017 1 1 8 GLU HB2 H -5.507 -0.092 -1.067 1.00 . A A . 8 GLU HB2 1 1 18 5018 1 1 8 GLU HB3 H -6.549 -0.449 -2.435 1.00 . A A . 8 GLU HB3 1 1 18 5019 1 1 8 GLU HG2 H -5.258 -2.564 -2.752 1.00 . A A . 8 GLU HG2 1 1 18 5020 1 1 8 GLU HG3 H -4.435 -2.211 -1.234 1.00 . A A . 8 GLU HG3 1 1 18 5021 1 1 8 GLU N N -3.201 0.028 -2.399 1.00 . A A . 8 GLU N 1 1 18 5022 1 1 8 GLU O O -4.987 1.967 -4.366 1.00 . A A . 8 GLU O 1 1 18 5023 1 1 8 GLU OE1 O -6.576 -3.957 -0.998 1.00 . A A . 8 GLU OE1 1 1 18 5024 1 1 9 TYR C C -4.750 4.492 -1.493 1.00 . A A . 9 TYR C 1 1 18 5025 1 1 9 TYR CA C -5.723 3.598 -2.245 1.00 . A A . 9 TYR CA 1 1 18 5026 1 1 9 TYR CB C -7.134 3.789 -1.677 1.00 . A A . 9 TYR CB 1 1 18 5027 1 1 9 TYR CD1 C -8.316 1.655 -2.355 1.00 . A A . 9 TYR CD1 1 1 18 5028 1 1 9 TYR CD2 C -9.148 3.722 -3.199 1.00 . A A . 9 TYR CD2 1 1 18 5029 1 1 9 TYR CE1 C -9.304 0.973 -3.037 1.00 . A A . 9 TYR CE1 1 1 18 5030 1 1 9 TYR CE2 C -10.140 3.047 -3.884 1.00 . A A . 9 TYR CE2 1 1 18 5031 1 1 9 TYR CG C -8.220 3.039 -2.424 1.00 . A A . 9 TYR CG 1 1 18 5032 1 1 9 TYR CZ C -10.213 1.673 -3.801 1.00 . A A . 9 TYR CZ 1 1 18 5033 1 1 9 TYR H H -5.258 1.781 -1.270 1.00 . A A . 9 TYR H 1 1 18 5034 1 1 9 TYR HA H -5.721 3.878 -3.287 1.00 . A A . 9 TYR HA 1 1 18 5035 1 1 9 TYR HB2 H -7.146 3.452 -0.653 1.00 . A A . 9 TYR HB2 1 1 18 5036 1 1 9 TYR HB3 H -7.382 4.841 -1.703 1.00 . A A . 9 TYR HB3 1 1 18 5037 1 1 9 TYR HD1 H -7.604 1.108 -1.756 1.00 . A A . 9 TYR HD1 1 1 18 5038 1 1 9 TYR HD2 H -9.087 4.799 -3.265 1.00 . A A . 9 TYR HD2 1 1 18 5039 1 1 9 TYR HE1 H -9.363 -0.103 -2.970 1.00 . A A . 9 TYR HE1 1 1 18 5040 1 1 9 TYR HE2 H -10.851 3.596 -4.483 1.00 . A A . 9 TYR HE2 1 1 18 5041 1 1 9 TYR HH H -10.861 0.706 -5.332 1.00 . A A . 9 TYR HH 1 1 18 5042 1 1 9 TYR N N -5.299 2.210 -2.154 1.00 . A A . 9 TYR N 1 1 18 5043 1 1 9 TYR O O -4.223 4.112 -0.444 1.00 . A A . 9 TYR O 1 1 18 5044 1 1 9 TYR OH O -11.200 0.997 -4.481 1.00 . A A . 9 TYR OH 1 1 18 5045 1 1 10 PHE C C -4.399 7.776 -0.799 1.00 . A A . 10 PHE C 1 1 18 5046 1 1 10 PHE CA C -3.614 6.631 -1.418 1.00 . A A . 10 PHE CA 1 1 18 5047 1 1 10 PHE CB C -2.621 7.204 -2.436 1.00 . A A . 10 PHE CB 1 1 18 5048 1 1 10 PHE CD1 C -2.356 5.253 -4.012 1.00 . A A . 10 PHE CD1 1 1 18 5049 1 1 10 PHE CD2 C -0.405 6.156 -2.980 1.00 . A A . 10 PHE CD2 1 1 18 5050 1 1 10 PHE CE1 C -1.578 4.321 -4.674 1.00 . A A . 10 PHE CE1 1 1 18 5051 1 1 10 PHE CE2 C 0.375 5.227 -3.640 1.00 . A A . 10 PHE CE2 1 1 18 5052 1 1 10 PHE CG C -1.779 6.180 -3.156 1.00 . A A . 10 PHE CG 1 1 18 5053 1 1 10 PHE CZ C -0.211 4.309 -4.487 1.00 . A A . 10 PHE CZ 1 1 18 5054 1 1 10 PHE H H -4.974 5.918 -2.865 1.00 . A A . 10 PHE H 1 1 18 5055 1 1 10 PHE HA H -3.067 6.119 -0.639 1.00 . A A . 10 PHE HA 1 1 18 5056 1 1 10 PHE HB2 H -3.167 7.761 -3.175 1.00 . A A . 10 PHE HB2 1 1 18 5057 1 1 10 PHE HB3 H -1.950 7.876 -1.920 1.00 . A A . 10 PHE HB3 1 1 18 5058 1 1 10 PHE HD1 H -3.426 5.260 -4.158 1.00 . A A . 10 PHE HD1 1 1 18 5059 1 1 10 PHE HD2 H 0.055 6.873 -2.317 1.00 . A A . 10 PHE HD2 1 1 18 5060 1 1 10 PHE HE1 H -2.040 3.605 -5.337 1.00 . A A . 10 PHE HE1 1 1 18 5061 1 1 10 PHE HE2 H 1.445 5.219 -3.492 1.00 . A A . 10 PHE HE2 1 1 18 5062 1 1 10 PHE HZ H 0.398 3.583 -5.003 1.00 . A A . 10 PHE HZ 1 1 18 5063 1 1 10 PHE N N -4.519 5.676 -2.033 1.00 . A A . 10 PHE N 1 1 18 5064 1 1 10 PHE O O -5.439 8.180 -1.313 1.00 . A A . 10 PHE O 1 1 18 5065 1 1 11 VAL C C -4.154 10.722 0.253 1.00 . A A . 11 VAL C 1 1 18 5066 1 1 11 VAL CA C -4.501 9.419 0.983 1.00 . A A . 11 VAL CA 1 1 18 5067 1 1 11 VAL CB C -4.060 9.472 2.469 1.00 . A A . 11 VAL CB 1 1 18 5068 1 1 11 VAL CG1 C -2.592 9.833 2.594 1.00 . A A . 11 VAL CG1 1 1 18 5069 1 1 11 VAL CG2 C -4.928 10.431 3.274 1.00 . A A . 11 VAL CG2 1 1 18 5070 1 1 11 VAL H H -3.033 7.937 0.635 1.00 . A A . 11 VAL H 1 1 18 5071 1 1 11 VAL HA H -5.572 9.273 0.948 1.00 . A A . 11 VAL HA 1 1 18 5072 1 1 11 VAL HB H -4.189 8.484 2.884 1.00 . A A . 11 VAL HB 1 1 18 5073 1 1 11 VAL HG11 H -1.989 9.041 2.175 1.00 . A A . 11 VAL HG11 1 1 18 5074 1 1 11 VAL HG12 H -2.340 9.965 3.636 1.00 . A A . 11 VAL HG12 1 1 18 5075 1 1 11 VAL HG13 H -2.400 10.752 2.059 1.00 . A A . 11 VAL HG13 1 1 18 5076 1 1 11 VAL HG21 H -4.738 10.290 4.328 1.00 . A A . 11 VAL HG21 1 1 18 5077 1 1 11 VAL HG22 H -5.970 10.234 3.067 1.00 . A A . 11 VAL HG22 1 1 18 5078 1 1 11 VAL HG23 H -4.692 11.448 2.999 1.00 . A A . 11 VAL HG23 1 1 18 5079 1 1 11 VAL N N -3.879 8.302 0.293 1.00 . A A . 11 VAL N 1 1 18 5080 1 1 11 VAL O O -3.255 10.739 -0.593 1.00 . A A . 11 VAL O 1 1 18 5081 1 1 12 GLY C C -3.378 13.782 0.305 1.00 . A A . 12 GLY C 1 1 18 5082 1 1 12 GLY CA C -4.668 13.081 -0.081 1.00 . A A . 12 GLY CA 1 1 18 5083 1 1 12 GLY H H -5.581 11.703 1.231 1.00 . A A . 12 GLY H 1 1 18 5084 1 1 12 GLY HA2 H -4.667 12.934 -1.150 1.00 . A A . 12 GLY HA2 1 1 18 5085 1 1 12 GLY HA3 H -5.491 13.722 0.174 1.00 . A A . 12 GLY HA3 1 1 18 5086 1 1 12 GLY N N -4.878 11.792 0.563 1.00 . A A . 12 GLY N 1 1 18 5087 1 1 12 GLY O O -3.356 14.997 0.485 1.00 . A A . 12 GLY O 1 1 18 5088 1 1 13 ILE C C 0.113 12.644 0.243 1.00 . A A . 13 ILE C 1 1 18 5089 1 1 13 ILE CA C -0.998 13.580 0.733 1.00 . A A . 13 ILE CA 1 1 18 5090 1 1 13 ILE CB C -0.866 13.879 2.254 1.00 . A A . 13 ILE CB 1 1 18 5091 1 1 13 ILE CD1 C 0.491 15.189 3.977 1.00 . A A . 13 ILE CD1 1 1 18 5092 1 1 13 ILE CG1 C 0.337 14.794 2.523 1.00 . A A . 13 ILE CG1 1 1 18 5093 1 1 13 ILE CG2 C -0.753 12.592 3.062 1.00 . A A . 13 ILE CG2 1 1 18 5094 1 1 13 ILE H H -2.398 12.066 0.226 1.00 . A A . 13 ILE H 1 1 18 5095 1 1 13 ILE HA H -0.906 14.514 0.198 1.00 . A A . 13 ILE HA 1 1 18 5096 1 1 13 ILE HB H -1.764 14.386 2.570 1.00 . A A . 13 ILE HB 1 1 18 5097 1 1 13 ILE HD11 H -0.361 15.778 4.282 1.00 . A A . 13 ILE HD11 1 1 18 5098 1 1 13 ILE HD12 H 1.392 15.770 4.099 1.00 . A A . 13 ILE HD12 1 1 18 5099 1 1 13 ILE HD13 H 0.550 14.299 4.587 1.00 . A A . 13 ILE HD13 1 1 18 5100 1 1 13 ILE HG12 H 1.241 14.287 2.222 1.00 . A A . 13 ILE HG12 1 1 18 5101 1 1 13 ILE HG13 H 0.228 15.698 1.943 1.00 . A A . 13 ILE HG13 1 1 18 5102 1 1 13 ILE HG21 H -1.718 12.110 3.106 1.00 . A A . 13 ILE HG21 1 1 18 5103 1 1 13 ILE HG22 H -0.422 12.824 4.064 1.00 . A A . 13 ILE HG22 1 1 18 5104 1 1 13 ILE HG23 H -0.042 11.931 2.591 1.00 . A A . 13 ILE HG23 1 1 18 5105 1 1 13 ILE N N -2.306 13.026 0.401 1.00 . A A . 13 ILE N 1 1 18 5106 1 1 13 ILE O O 1.222 12.613 0.773 1.00 . A A . 13 ILE O 1 1 18 5107 1 1 14 GLY C C 1.236 9.901 -0.487 1.00 . A A . 14 GLY C 1 1 18 5108 1 1 14 GLY CA C 0.761 10.999 -1.423 1.00 . A A . 14 GLY CA 1 1 18 5109 1 1 14 GLY H H -1.090 12.008 -1.213 1.00 . A A . 14 GLY H 1 1 18 5110 1 1 14 GLY HA2 H 0.305 10.541 -2.287 1.00 . A A . 14 GLY HA2 1 1 18 5111 1 1 14 GLY HA3 H 1.618 11.571 -1.749 1.00 . A A . 14 GLY HA3 1 1 18 5112 1 1 14 GLY N N -0.201 11.909 -0.818 1.00 . A A . 14 GLY N 1 1 18 5113 1 1 14 GLY O O 2.436 9.713 -0.302 1.00 . A A . 14 GLY O 1 1 18 5114 1 1 15 THR C C -0.396 6.976 0.948 1.00 . A A . 15 THR C 1 1 18 5115 1 1 15 THR CA C 0.654 8.085 1.012 1.00 . A A . 15 THR CA 1 1 18 5116 1 1 15 THR CB C 0.768 8.599 2.465 1.00 . A A . 15 THR CB 1 1 18 5117 1 1 15 THR CG2 C 1.288 7.511 3.394 1.00 . A A . 15 THR CG2 1 1 18 5118 1 1 15 THR H H -0.639 9.355 -0.081 1.00 . A A . 15 THR H 1 1 18 5119 1 1 15 THR HA H 1.611 7.686 0.711 1.00 . A A . 15 THR HA 1 1 18 5120 1 1 15 THR HB H -0.213 8.900 2.804 1.00 . A A . 15 THR HB 1 1 18 5121 1 1 15 THR HG1 H 2.057 9.862 1.655 1.00 . A A . 15 THR HG1 1 1 18 5122 1 1 15 THR HG21 H 0.869 7.648 4.381 1.00 . A A . 15 THR HG21 1 1 18 5123 1 1 15 THR HG22 H 2.364 7.568 3.450 1.00 . A A . 15 THR HG22 1 1 18 5124 1 1 15 THR HG23 H 0.999 6.543 3.013 1.00 . A A . 15 THR HG23 1 1 18 5125 1 1 15 THR N N 0.305 9.168 0.101 1.00 . A A . 15 THR N 1 1 18 5126 1 1 15 THR O O -1.586 7.235 1.104 1.00 . A A . 15 THR O 1 1 18 5127 1 1 15 THR OG1 O 1.648 9.729 2.519 1.00 . A A . 15 THR OG1 1 1 18 5128 1 1 16 PRO C C -1.481 4.237 1.987 1.00 . A A . 16 PRO C 1 1 18 5129 1 1 16 PRO CA C -0.890 4.589 0.624 1.00 . A A . 16 PRO CA 1 1 18 5130 1 1 16 PRO CB C -0.012 3.436 0.113 1.00 . A A . 16 PRO CB 1 1 18 5131 1 1 16 PRO CD C 1.420 5.318 0.497 1.00 . A A . 16 PRO CD 1 1 18 5132 1 1 16 PRO CG C 1.277 4.063 -0.310 1.00 . A A . 16 PRO CG 1 1 18 5133 1 1 16 PRO HA H -1.691 4.777 -0.077 1.00 . A A . 16 PRO HA 1 1 18 5134 1 1 16 PRO HB2 H 0.142 2.723 0.909 1.00 . A A . 16 PRO HB2 1 1 18 5135 1 1 16 PRO HB3 H -0.504 2.952 -0.718 1.00 . A A . 16 PRO HB3 1 1 18 5136 1 1 16 PRO HD2 H 1.909 5.111 1.438 1.00 . A A . 16 PRO HD2 1 1 18 5137 1 1 16 PRO HD3 H 1.963 6.069 -0.058 1.00 . A A . 16 PRO HD3 1 1 18 5138 1 1 16 PRO HG2 H 2.096 3.390 -0.104 1.00 . A A . 16 PRO HG2 1 1 18 5139 1 1 16 PRO HG3 H 1.242 4.298 -1.364 1.00 . A A . 16 PRO HG3 1 1 18 5140 1 1 16 PRO N N 0.028 5.727 0.708 1.00 . A A . 16 PRO N 1 1 18 5141 1 1 16 PRO O O -0.749 4.026 2.950 1.00 . A A . 16 PRO O 1 1 18 5142 1 1 17 ILE C C -4.229 2.532 3.192 1.00 . A A . 17 ILE C 1 1 18 5143 1 1 17 ILE CA C -3.478 3.850 3.313 1.00 . A A . 17 ILE CA 1 1 18 5144 1 1 17 ILE CB C -4.454 4.967 3.743 1.00 . A A . 17 ILE CB 1 1 18 5145 1 1 17 ILE CD1 C -6.460 6.345 2.966 1.00 . A A . 17 ILE CD1 1 1 18 5146 1 1 17 ILE CG1 C -5.413 5.316 2.596 1.00 . A A . 17 ILE CG1 1 1 18 5147 1 1 17 ILE CG2 C -3.680 6.198 4.196 1.00 . A A . 17 ILE CG2 1 1 18 5148 1 1 17 ILE H H -3.340 4.353 1.256 1.00 . A A . 17 ILE H 1 1 18 5149 1 1 17 ILE HA H -2.722 3.743 4.072 1.00 . A A . 17 ILE HA 1 1 18 5150 1 1 17 ILE HB H -5.028 4.607 4.584 1.00 . A A . 17 ILE HB 1 1 18 5151 1 1 17 ILE HD11 H -7.373 6.139 2.428 1.00 . A A . 17 ILE HD11 1 1 18 5152 1 1 17 ILE HD12 H -6.104 7.331 2.707 1.00 . A A . 17 ILE HD12 1 1 18 5153 1 1 17 ILE HD13 H -6.651 6.298 4.028 1.00 . A A . 17 ILE HD13 1 1 18 5154 1 1 17 ILE HG12 H -4.842 5.709 1.769 1.00 . A A . 17 ILE HG12 1 1 18 5155 1 1 17 ILE HG13 H -5.924 4.419 2.281 1.00 . A A . 17 ILE HG13 1 1 18 5156 1 1 17 ILE HG21 H -2.884 5.899 4.861 1.00 . A A . 17 ILE HG21 1 1 18 5157 1 1 17 ILE HG22 H -4.346 6.873 4.712 1.00 . A A . 17 ILE HG22 1 1 18 5158 1 1 17 ILE HG23 H -3.260 6.696 3.333 1.00 . A A . 17 ILE HG23 1 1 18 5159 1 1 17 ILE N N -2.803 4.175 2.060 1.00 . A A . 17 ILE N 1 1 18 5160 1 1 17 ILE O O -5.267 2.324 3.817 1.00 . A A . 17 ILE O 1 1 18 5161 1 1 18 SER C C -3.364 -0.423 1.145 1.00 . A A . 18 SER C 1 1 18 5162 1 1 18 SER CA C -4.237 0.328 2.138 1.00 . A A . 18 SER CA 1 1 18 5163 1 1 18 SER CB C -5.669 0.434 1.604 1.00 . A A . 18 SER CB 1 1 18 5164 1 1 18 SER H H -2.840 1.895 1.930 1.00 . A A . 18 SER H 1 1 18 5165 1 1 18 SER HA H -4.247 -0.210 3.075 1.00 . A A . 18 SER HA 1 1 18 5166 1 1 18 SER HB2 H -5.977 -0.525 1.216 1.00 . A A . 18 SER HB2 1 1 18 5167 1 1 18 SER HB3 H -6.328 0.727 2.406 1.00 . A A . 18 SER HB3 1 1 18 5168 1 1 18 SER HG H -5.496 2.259 0.910 1.00 . A A . 18 SER HG 1 1 18 5169 1 1 18 SER N N -3.673 1.649 2.381 1.00 . A A . 18 SER N 1 1 18 5170 1 1 18 SER O O -2.751 0.195 0.277 1.00 . A A . 18 SER O 1 1 18 5171 1 1 18 SER OG O -5.755 1.396 0.563 1.00 . A A . 18 SER OG 1 1 18 5172 1 1 19 PHE C C -3.126 -3.924 0.156 1.00 . A A . 19 PHE C 1 1 18 5173 1 1 19 PHE CA C -2.487 -2.557 0.372 1.00 . A A . 19 PHE CA 1 1 18 5174 1 1 19 PHE CB C -1.063 -2.779 0.905 1.00 . A A . 19 PHE CB 1 1 18 5175 1 1 19 PHE CD1 C -0.691 -1.230 2.855 1.00 . A A . 19 PHE CD1 1 1 18 5176 1 1 19 PHE CD2 C 0.509 -0.822 0.835 1.00 . A A . 19 PHE CD2 1 1 18 5177 1 1 19 PHE CE1 C -0.080 -0.140 3.443 1.00 . A A . 19 PHE CE1 1 1 18 5178 1 1 19 PHE CE2 C 1.125 0.268 1.418 1.00 . A A . 19 PHE CE2 1 1 18 5179 1 1 19 PHE CG C -0.408 -1.582 1.543 1.00 . A A . 19 PHE CG 1 1 18 5180 1 1 19 PHE CZ C 0.830 0.610 2.724 1.00 . A A . 19 PHE CZ 1 1 18 5181 1 1 19 PHE H H -3.807 -2.184 1.993 1.00 . A A . 19 PHE H 1 1 18 5182 1 1 19 PHE HA H -2.432 -2.045 -0.577 1.00 . A A . 19 PHE HA 1 1 18 5183 1 1 19 PHE HB2 H -1.089 -3.569 1.632 1.00 . A A . 19 PHE HB2 1 1 18 5184 1 1 19 PHE HB3 H -0.437 -3.092 0.082 1.00 . A A . 19 PHE HB3 1 1 18 5185 1 1 19 PHE HD1 H -1.403 -1.816 3.418 1.00 . A A . 19 PHE HD1 1 1 18 5186 1 1 19 PHE HD2 H 0.738 -1.086 -0.187 1.00 . A A . 19 PHE HD2 1 1 18 5187 1 1 19 PHE HE1 H -0.312 0.126 4.463 1.00 . A A . 19 PHE HE1 1 1 18 5188 1 1 19 PHE HE2 H 1.838 0.851 0.855 1.00 . A A . 19 PHE HE2 1 1 18 5189 1 1 19 PHE HZ H 1.312 1.462 3.181 1.00 . A A . 19 PHE HZ 1 1 18 5190 1 1 19 PHE N N -3.299 -1.743 1.274 1.00 . A A . 19 PHE N 1 1 18 5191 1 1 19 PHE O O -3.988 -4.341 0.924 1.00 . A A . 19 PHE O 1 1 18 5192 1 1 20 TYR C C -2.195 -6.985 -0.614 1.00 . A A . 20 TYR C 1 1 18 5193 1 1 20 TYR CA C -3.157 -5.959 -1.194 1.00 . A A . 20 TYR CA 1 1 18 5194 1 1 20 TYR CB C -3.265 -6.216 -2.703 1.00 . A A . 20 TYR CB 1 1 18 5195 1 1 20 TYR CD1 C -3.323 -4.040 -3.992 1.00 . A A . 20 TYR CD1 1 1 18 5196 1 1 20 TYR CD2 C -5.342 -5.290 -3.808 1.00 . A A . 20 TYR CD2 1 1 18 5197 1 1 20 TYR CE1 C -3.977 -3.085 -4.746 1.00 . A A . 20 TYR CE1 1 1 18 5198 1 1 20 TYR CE2 C -6.002 -4.342 -4.567 1.00 . A A . 20 TYR CE2 1 1 18 5199 1 1 20 TYR CG C -3.992 -5.155 -3.506 1.00 . A A . 20 TYR CG 1 1 18 5200 1 1 20 TYR CZ C -5.315 -3.241 -5.032 1.00 . A A . 20 TYR CZ 1 1 18 5201 1 1 20 TYR H H -1.961 -4.227 -1.427 1.00 . A A . 20 TYR H 1 1 18 5202 1 1 20 TYR HA H -4.127 -6.083 -0.735 1.00 . A A . 20 TYR HA 1 1 18 5203 1 1 20 TYR HB2 H -2.273 -6.309 -3.108 1.00 . A A . 20 TYR HB2 1 1 18 5204 1 1 20 TYR HB3 H -3.786 -7.150 -2.853 1.00 . A A . 20 TYR HB3 1 1 18 5205 1 1 20 TYR HD1 H -2.272 -3.920 -3.768 1.00 . A A . 20 TYR HD1 1 1 18 5206 1 1 20 TYR HD2 H -5.879 -6.152 -3.440 1.00 . A A . 20 TYR HD2 1 1 18 5207 1 1 20 TYR HE1 H -3.437 -2.223 -5.110 1.00 . A A . 20 TYR HE1 1 1 18 5208 1 1 20 TYR HE2 H -7.053 -4.466 -4.790 1.00 . A A . 20 TYR HE2 1 1 18 5209 1 1 20 TYR HH H -5.342 -1.625 -6.074 1.00 . A A . 20 TYR HH 1 1 18 5210 1 1 20 TYR N N -2.670 -4.620 -0.876 1.00 . A A . 20 TYR N 1 1 18 5211 1 1 20 TYR O O -1.049 -6.655 -0.287 1.00 . A A . 20 TYR O 1 1 18 5212 1 1 20 TYR OH O -5.970 -2.292 -5.782 1.00 . A A . 20 TYR OH 1 1 18 5213 1 1 21 GLY C C -2.481 -10.628 -0.245 1.00 . A A . 21 GLY C 1 1 18 5214 1 1 21 GLY CA C -1.830 -9.288 -0.010 1.00 . A A . 21 GLY CA 1 1 18 5215 1 1 21 GLY H H -3.560 -8.417 -0.831 1.00 . A A . 21 GLY H 1 1 18 5216 1 1 21 GLY HA2 H -0.869 -9.267 -0.507 1.00 . A A . 21 GLY HA2 1 1 18 5217 1 1 21 GLY HA3 H -1.683 -9.147 1.049 1.00 . A A . 21 GLY HA3 1 1 18 5218 1 1 21 GLY N N -2.650 -8.217 -0.525 1.00 . A A . 21 GLY N 1 1 18 5219 1 1 21 GLY O O -3.579 -10.645 -0.843 1.00 . A A . 21 GLY O 1 1 18 5220 1 1 21 GLY OXT O -1.903 -11.655 0.159 1.00 . A A . 21 GLY OXT 1 1 19 5221 1 1 1 GLY C C -7.890 -2.791 2.271 1.00 . A A . 1 GLY C 1 1 19 5222 1 1 1 GLY CA C -8.293 -2.311 0.886 1.00 . A A . 1 GLY CA 1 1 19 5223 1 1 1 GLY H2 H -6.989 -0.905 -0.004 1.00 . A A . 1 GLY H2 1 1 19 5224 1 1 1 GLY HA2 H -8.991 -1.495 0.998 1.00 . A A . 1 GLY HA2 1 1 19 5225 1 1 1 GLY HA3 H -8.792 -3.120 0.371 1.00 . A A . 1 GLY HA3 1 1 19 5226 1 1 1 GLY N N -7.179 -1.861 0.072 1.00 . A A . 1 GLY N 1 1 19 5227 1 1 1 GLY O O -8.544 -2.464 3.255 1.00 . A A . 1 GLY O 1 1 19 5228 1 1 2 GLY C C -4.975 -3.678 3.986 1.00 . A A . 2 GLY C 1 1 19 5229 1 1 2 GLY CA C -6.385 -4.094 3.630 1.00 . A A . 2 GLY CA 1 1 19 5230 1 1 2 GLY H H -6.339 -3.816 1.528 1.00 . A A . 2 GLY H 1 1 19 5231 1 1 2 GLY HA2 H -7.056 -3.737 4.396 1.00 . A A . 2 GLY HA2 1 1 19 5232 1 1 2 GLY HA3 H -6.433 -5.173 3.604 1.00 . A A . 2 GLY HA3 1 1 19 5233 1 1 2 GLY N N -6.824 -3.577 2.347 1.00 . A A . 2 GLY N 1 1 19 5234 1 1 2 GLY O O -4.607 -2.515 3.832 1.00 . A A . 2 GLY O 1 1 19 5235 1 1 3 ALA C C -1.867 -5.423 4.265 1.00 . A A . 3 ALA C 1 1 19 5236 1 1 3 ALA CA C -2.803 -4.366 4.844 1.00 . A A . 3 ALA CA 1 1 19 5237 1 1 3 ALA CB C -2.680 -4.312 6.361 1.00 . A A . 3 ALA CB 1 1 19 5238 1 1 3 ALA H H -4.536 -5.539 4.556 1.00 . A A . 3 ALA H 1 1 19 5239 1 1 3 ALA HA H -2.526 -3.401 4.448 1.00 . A A . 3 ALA HA 1 1 19 5240 1 1 3 ALA HB1 H -2.225 -5.224 6.718 1.00 . A A . 3 ALA HB1 1 1 19 5241 1 1 3 ALA HB2 H -3.662 -4.204 6.798 1.00 . A A . 3 ALA HB2 1 1 19 5242 1 1 3 ALA HB3 H -2.065 -3.469 6.642 1.00 . A A . 3 ALA HB3 1 1 19 5243 1 1 3 ALA N N -4.183 -4.631 4.459 1.00 . A A . 3 ALA N 1 1 19 5244 1 1 3 ALA O O -1.085 -6.042 4.985 1.00 . A A . 3 ALA O 1 1 19 5245 1 1 4 GLY C C 0.297 -6.111 2.081 1.00 . A A . 4 GLY C 1 1 19 5246 1 1 4 GLY CA C -1.128 -6.599 2.278 1.00 . A A . 4 GLY CA 1 1 19 5247 1 1 4 GLY H H -2.613 -5.100 2.444 1.00 . A A . 4 GLY H 1 1 19 5248 1 1 4 GLY HA2 H -1.107 -7.508 2.858 1.00 . A A . 4 GLY HA2 1 1 19 5249 1 1 4 GLY HA3 H -1.561 -6.814 1.311 1.00 . A A . 4 GLY HA3 1 1 19 5250 1 1 4 GLY N N -1.964 -5.624 2.957 1.00 . A A . 4 GLY N 1 1 19 5251 1 1 4 GLY O O 0.994 -5.789 3.039 1.00 . A A . 4 GLY O 1 1 19 5252 1 1 5 HIS C C 2.072 -4.427 -0.436 1.00 . A A . 5 HIS C 1 1 19 5253 1 1 5 HIS CA C 2.091 -5.616 0.518 1.00 . A A . 5 HIS CA 1 1 19 5254 1 1 5 HIS CB C 2.917 -6.759 -0.085 1.00 . A A . 5 HIS CB 1 1 19 5255 1 1 5 HIS CD2 C 3.285 -7.782 2.277 1.00 . A A . 5 HIS CD2 1 1 19 5256 1 1 5 HIS CE1 C 4.339 -9.608 1.675 1.00 . A A . 5 HIS CE1 1 1 19 5257 1 1 5 HIS CG C 3.383 -7.766 0.925 1.00 . A A . 5 HIS CG 1 1 19 5258 1 1 5 HIS H H 0.138 -6.339 0.100 1.00 . A A . 5 HIS H 1 1 19 5259 1 1 5 HIS HA H 2.554 -5.306 1.442 1.00 . A A . 5 HIS HA 1 1 19 5260 1 1 5 HIS HB2 H 2.318 -7.278 -0.817 1.00 . A A . 5 HIS HB2 1 1 19 5261 1 1 5 HIS HB3 H 3.790 -6.344 -0.569 1.00 . A A . 5 HIS HB3 1 1 19 5262 1 1 5 HIS HD1 H 4.278 -9.206 -0.332 1.00 . A A . 5 HIS HD1 1 1 19 5263 1 1 5 HIS HD2 H 2.820 -7.026 2.893 1.00 . A A . 5 HIS HD2 1 1 19 5264 1 1 5 HIS HE1 H 4.857 -10.554 1.711 1.00 . A A . 5 HIS HE1 1 1 19 5265 1 1 5 HIS HE2 H 3.875 -9.264 3.641 1.00 . A A . 5 HIS HE2 1 1 19 5266 1 1 5 HIS N N 0.739 -6.065 0.832 1.00 . A A . 5 HIS N 1 1 19 5267 1 1 5 HIS ND1 N 4.050 -8.926 0.580 1.00 . A A . 5 HIS ND1 1 1 19 5268 1 1 5 HIS NE2 N 3.886 -8.935 2.717 1.00 . A A . 5 HIS NE2 1 1 19 5269 1 1 5 HIS O O 2.689 -3.401 -0.163 1.00 . A A . 5 HIS O 1 1 19 5270 1 1 6 VAL C C 0.085 -2.563 -2.176 1.00 . A A . 6 VAL C 1 1 19 5271 1 1 6 VAL CA C 1.264 -3.471 -2.514 1.00 . A A . 6 VAL CA 1 1 19 5272 1 1 6 VAL CB C 1.153 -3.986 -3.968 1.00 . A A . 6 VAL CB 1 1 19 5273 1 1 6 VAL CG1 C 2.508 -4.475 -4.458 1.00 . A A . 6 VAL CG1 1 1 19 5274 1 1 6 VAL CG2 C 0.125 -5.099 -4.079 1.00 . A A . 6 VAL CG2 1 1 19 5275 1 1 6 VAL H H 0.870 -5.393 -1.715 1.00 . A A . 6 VAL H 1 1 19 5276 1 1 6 VAL HA H 2.173 -2.889 -2.434 1.00 . A A . 6 VAL HA 1 1 19 5277 1 1 6 VAL HB H 0.840 -3.167 -4.597 1.00 . A A . 6 VAL HB 1 1 19 5278 1 1 6 VAL HG11 H 3.288 -3.873 -4.017 1.00 . A A . 6 VAL HG11 1 1 19 5279 1 1 6 VAL HG12 H 2.553 -4.391 -5.534 1.00 . A A . 6 VAL HG12 1 1 19 5280 1 1 6 VAL HG13 H 2.644 -5.507 -4.172 1.00 . A A . 6 VAL HG13 1 1 19 5281 1 1 6 VAL HG21 H 0.021 -5.592 -3.125 1.00 . A A . 6 VAL HG21 1 1 19 5282 1 1 6 VAL HG22 H 0.448 -5.815 -4.821 1.00 . A A . 6 VAL HG22 1 1 19 5283 1 1 6 VAL HG23 H -0.826 -4.682 -4.374 1.00 . A A . 6 VAL HG23 1 1 19 5284 1 1 6 VAL N N 1.356 -4.558 -1.546 1.00 . A A . 6 VAL N 1 1 19 5285 1 1 6 VAL O O -1.006 -3.040 -1.877 1.00 . A A . 6 VAL O 1 1 19 5286 1 1 7 PRO C C -1.974 -0.300 -2.702 1.00 . A A . 7 PRO C 1 1 19 5287 1 1 7 PRO CA C -0.715 -0.243 -1.834 1.00 . A A . 7 PRO CA 1 1 19 5288 1 1 7 PRO CB C 0.000 1.099 -2.030 1.00 . A A . 7 PRO CB 1 1 19 5289 1 1 7 PRO CD C 1.601 -0.611 -2.482 1.00 . A A . 7 PRO CD 1 1 19 5290 1 1 7 PRO CG C 1.211 0.790 -2.842 1.00 . A A . 7 PRO CG 1 1 19 5291 1 1 7 PRO HA H -1.007 -0.336 -0.798 1.00 . A A . 7 PRO HA 1 1 19 5292 1 1 7 PRO HB2 H -0.654 1.785 -2.547 1.00 . A A . 7 PRO HB2 1 1 19 5293 1 1 7 PRO HB3 H 0.269 1.510 -1.066 1.00 . A A . 7 PRO HB3 1 1 19 5294 1 1 7 PRO HD2 H 2.083 -1.097 -3.316 1.00 . A A . 7 PRO HD2 1 1 19 5295 1 1 7 PRO HD3 H 2.244 -0.615 -1.614 1.00 . A A . 7 PRO HD3 1 1 19 5296 1 1 7 PRO HG2 H 0.974 0.855 -3.895 1.00 . A A . 7 PRO HG2 1 1 19 5297 1 1 7 PRO HG3 H 2.007 1.477 -2.593 1.00 . A A . 7 PRO HG3 1 1 19 5298 1 1 7 PRO N N 0.309 -1.241 -2.179 1.00 . A A . 7 PRO N 1 1 19 5299 1 1 7 PRO O O -1.908 -0.472 -3.918 1.00 . A A . 7 PRO O 1 1 19 5300 1 1 8 GLU C C -4.810 1.292 -3.091 1.00 . A A . 8 GLU C 1 1 19 5301 1 1 8 GLU CA C -4.414 -0.132 -2.716 1.00 . A A . 8 GLU CA 1 1 19 5302 1 1 8 GLU CB C -5.495 -0.719 -1.805 1.00 . A A . 8 GLU CB 1 1 19 5303 1 1 8 GLU CD C -6.410 -2.728 -0.573 1.00 . A A . 8 GLU CD 1 1 19 5304 1 1 8 GLU CG C -5.270 -2.164 -1.406 1.00 . A A . 8 GLU CG 1 1 19 5305 1 1 8 GLU H H -3.090 0.015 -1.078 1.00 . A A . 8 GLU H 1 1 19 5306 1 1 8 GLU HA H -4.335 -0.730 -3.613 1.00 . A A . 8 GLU HA 1 1 19 5307 1 1 8 GLU HB2 H -5.544 -0.128 -0.903 1.00 . A A . 8 GLU HB2 1 1 19 5308 1 1 8 GLU HB3 H -6.447 -0.656 -2.313 1.00 . A A . 8 GLU HB3 1 1 19 5309 1 1 8 GLU HG2 H -5.168 -2.761 -2.300 1.00 . A A . 8 GLU HG2 1 1 19 5310 1 1 8 GLU HG3 H -4.358 -2.226 -0.827 1.00 . A A . 8 GLU HG3 1 1 19 5311 1 1 8 GLU N N -3.121 -0.131 -2.046 1.00 . A A . 8 GLU N 1 1 19 5312 1 1 8 GLU O O -4.830 1.661 -4.262 1.00 . A A . 8 GLU O 1 1 19 5313 1 1 8 GLU OE1 O -6.570 -3.963 -0.515 1.00 . A A . 8 GLU OE1 1 1 19 5314 1 1 9 TYR C C -4.592 4.402 -1.513 1.00 . A A . 9 TYR C 1 1 19 5315 1 1 9 TYR CA C -5.524 3.470 -2.272 1.00 . A A . 9 TYR CA 1 1 19 5316 1 1 9 TYR CB C -6.969 3.706 -1.812 1.00 . A A . 9 TYR CB 1 1 19 5317 1 1 9 TYR CD1 C -8.171 1.571 -2.456 1.00 . A A . 9 TYR CD1 1 1 19 5318 1 1 9 TYR CD2 C -8.850 3.607 -3.493 1.00 . A A . 9 TYR CD2 1 1 19 5319 1 1 9 TYR CE1 C -9.128 0.881 -3.173 1.00 . A A . 9 TYR CE1 1 1 19 5320 1 1 9 TYR CE2 C -9.813 2.924 -4.213 1.00 . A A . 9 TYR CE2 1 1 19 5321 1 1 9 TYR CG C -8.014 2.944 -2.605 1.00 . A A . 9 TYR CG 1 1 19 5322 1 1 9 TYR CZ C -9.946 1.561 -4.051 1.00 . A A . 9 TYR CZ 1 1 19 5323 1 1 9 TYR H H -5.090 1.728 -1.158 1.00 . A A . 9 TYR H 1 1 19 5324 1 1 9 TYR HA H -5.452 3.688 -3.327 1.00 . A A . 9 TYR HA 1 1 19 5325 1 1 9 TYR HB2 H -7.058 3.409 -0.780 1.00 . A A . 9 TYR HB2 1 1 19 5326 1 1 9 TYR HB3 H -7.193 4.760 -1.896 1.00 . A A . 9 TYR HB3 1 1 19 5327 1 1 9 TYR HD1 H -7.530 1.041 -1.768 1.00 . A A . 9 TYR HD1 1 1 19 5328 1 1 9 TYR HD2 H -8.741 4.674 -3.621 1.00 . A A . 9 TYR HD2 1 1 19 5329 1 1 9 TYR HE1 H -9.233 -0.186 -3.046 1.00 . A A . 9 TYR HE1 1 1 19 5330 1 1 9 TYR HE2 H -10.452 3.458 -4.899 1.00 . A A . 9 TYR HE2 1 1 19 5331 1 1 9 TYR HH H -10.858 1.136 -5.688 1.00 . A A . 9 TYR HH 1 1 19 5332 1 1 9 TYR N N -5.125 2.086 -2.073 1.00 . A A . 9 TYR N 1 1 19 5333 1 1 9 TYR O O -4.121 4.074 -0.417 1.00 . A A . 9 TYR O 1 1 19 5334 1 1 9 TYR OH O -10.902 0.877 -4.765 1.00 . A A . 9 TYR OH 1 1 19 5335 1 1 10 PHE C C -4.245 7.765 -1.059 1.00 . A A . 10 PHE C 1 1 19 5336 1 1 10 PHE CA C -3.452 6.542 -1.490 1.00 . A A . 10 PHE CA 1 1 19 5337 1 1 10 PHE CB C -2.353 6.998 -2.459 1.00 . A A . 10 PHE CB 1 1 19 5338 1 1 10 PHE CD1 C -2.066 4.976 -3.937 1.00 . A A . 10 PHE CD1 1 1 19 5339 1 1 10 PHE CD2 C -0.170 5.795 -2.748 1.00 . A A . 10 PHE CD2 1 1 19 5340 1 1 10 PHE CE1 C -1.291 3.979 -4.495 1.00 . A A . 10 PHE CE1 1 1 19 5341 1 1 10 PHE CE2 C 0.611 4.802 -3.306 1.00 . A A . 10 PHE CE2 1 1 19 5342 1 1 10 PHE CG C -1.518 5.893 -3.054 1.00 . A A . 10 PHE CG 1 1 19 5343 1 1 10 PHE CZ C 0.050 3.892 -4.179 1.00 . A A . 10 PHE CZ 1 1 19 5344 1 1 10 PHE H H -4.737 5.754 -2.967 1.00 . A A . 10 PHE H 1 1 19 5345 1 1 10 PHE HA H -2.997 6.094 -0.621 1.00 . A A . 10 PHE HA 1 1 19 5346 1 1 10 PHE HB2 H -2.810 7.538 -3.268 1.00 . A A . 10 PHE HB2 1 1 19 5347 1 1 10 PHE HB3 H -1.686 7.665 -1.929 1.00 . A A . 10 PHE HB3 1 1 19 5348 1 1 10 PHE HD1 H -3.116 5.042 -4.184 1.00 . A A . 10 PHE HD1 1 1 19 5349 1 1 10 PHE HD2 H 0.270 6.503 -2.061 1.00 . A A . 10 PHE HD2 1 1 19 5350 1 1 10 PHE HE1 H -1.733 3.268 -5.178 1.00 . A A . 10 PHE HE1 1 1 19 5351 1 1 10 PHE HE2 H 1.661 4.737 -3.058 1.00 . A A . 10 PHE HE2 1 1 19 5352 1 1 10 PHE HZ H 0.659 3.115 -4.616 1.00 . A A . 10 PHE HZ 1 1 19 5353 1 1 10 PHE N N -4.329 5.556 -2.099 1.00 . A A . 10 PHE N 1 1 19 5354 1 1 10 PHE O O -5.198 8.169 -1.725 1.00 . A A . 10 PHE O 1 1 19 5355 1 1 11 VAL C C -3.986 10.751 -0.301 1.00 . A A . 11 VAL C 1 1 19 5356 1 1 11 VAL CA C -4.440 9.570 0.552 1.00 . A A . 11 VAL CA 1 1 19 5357 1 1 11 VAL CB C -4.061 9.813 2.035 1.00 . A A . 11 VAL CB 1 1 19 5358 1 1 11 VAL CG1 C -4.795 11.020 2.605 1.00 . A A . 11 VAL CG1 1 1 19 5359 1 1 11 VAL CG2 C -4.350 8.578 2.873 1.00 . A A . 11 VAL CG2 1 1 19 5360 1 1 11 VAL H H -3.032 7.999 0.495 1.00 . A A . 11 VAL H 1 1 19 5361 1 1 11 VAL HA H -5.513 9.463 0.475 1.00 . A A . 11 VAL HA 1 1 19 5362 1 1 11 VAL HB H -3.001 10.012 2.085 1.00 . A A . 11 VAL HB 1 1 19 5363 1 1 11 VAL HG11 H -5.859 10.895 2.461 1.00 . A A . 11 VAL HG11 1 1 19 5364 1 1 11 VAL HG12 H -4.465 11.914 2.100 1.00 . A A . 11 VAL HG12 1 1 19 5365 1 1 11 VAL HG13 H -4.583 11.104 3.661 1.00 . A A . 11 VAL HG13 1 1 19 5366 1 1 11 VAL HG21 H -5.137 8.003 2.408 1.00 . A A . 11 VAL HG21 1 1 19 5367 1 1 11 VAL HG22 H -4.660 8.878 3.863 1.00 . A A . 11 VAL HG22 1 1 19 5368 1 1 11 VAL HG23 H -3.456 7.974 2.944 1.00 . A A . 11 VAL HG23 1 1 19 5369 1 1 11 VAL N N -3.819 8.364 0.035 1.00 . A A . 11 VAL N 1 1 19 5370 1 1 11 VAL O O -2.913 10.697 -0.903 1.00 . A A . 11 VAL O 1 1 19 5371 1 1 12 GLY C C -3.100 13.548 -0.858 1.00 . A A . 12 GLY C 1 1 19 5372 1 1 12 GLY CA C -4.475 12.975 -1.153 1.00 . A A . 12 GLY CA 1 1 19 5373 1 1 12 GLY H H -5.647 11.770 0.134 1.00 . A A . 12 GLY H 1 1 19 5374 1 1 12 GLY HA2 H -4.515 12.706 -2.193 1.00 . A A . 12 GLY HA2 1 1 19 5375 1 1 12 GLY HA3 H -5.218 13.737 -0.965 1.00 . A A . 12 GLY HA3 1 1 19 5376 1 1 12 GLY N N -4.803 11.800 -0.360 1.00 . A A . 12 GLY N 1 1 19 5377 1 1 12 GLY O O -2.490 14.179 -1.715 1.00 . A A . 12 GLY O 1 1 19 5378 1 1 13 ILE C C -0.182 12.861 0.320 1.00 . A A . 13 ILE C 1 1 19 5379 1 1 13 ILE CA C -1.299 13.821 0.759 1.00 . A A . 13 ILE CA 1 1 19 5380 1 1 13 ILE CB C -1.231 14.043 2.290 1.00 . A A . 13 ILE CB 1 1 19 5381 1 1 13 ILE CD1 C -2.625 14.735 4.313 1.00 . A A . 13 ILE CD1 1 1 19 5382 1 1 13 ILE CG1 C -2.564 14.596 2.805 1.00 . A A . 13 ILE CG1 1 1 19 5383 1 1 13 ILE CG2 C -0.096 15.001 2.642 1.00 . A A . 13 ILE CG2 1 1 19 5384 1 1 13 ILE H H -3.144 12.810 0.988 1.00 . A A . 13 ILE H 1 1 19 5385 1 1 13 ILE HA H -1.144 14.770 0.269 1.00 . A A . 13 ILE HA 1 1 19 5386 1 1 13 ILE HB H -1.032 13.093 2.763 1.00 . A A . 13 ILE HB 1 1 19 5387 1 1 13 ILE HD11 H -1.824 14.165 4.760 1.00 . A A . 13 ILE HD11 1 1 19 5388 1 1 13 ILE HD12 H -3.574 14.363 4.669 1.00 . A A . 13 ILE HD12 1 1 19 5389 1 1 13 ILE HD13 H -2.521 15.775 4.584 1.00 . A A . 13 ILE HD13 1 1 19 5390 1 1 13 ILE HG12 H -2.727 15.574 2.378 1.00 . A A . 13 ILE HG12 1 1 19 5391 1 1 13 ILE HG13 H -3.362 13.937 2.499 1.00 . A A . 13 ILE HG13 1 1 19 5392 1 1 13 ILE HG21 H -0.079 15.160 3.709 1.00 . A A . 13 ILE HG21 1 1 19 5393 1 1 13 ILE HG22 H -0.252 15.944 2.139 1.00 . A A . 13 ILE HG22 1 1 19 5394 1 1 13 ILE HG23 H 0.845 14.576 2.326 1.00 . A A . 13 ILE HG23 1 1 19 5395 1 1 13 ILE N N -2.612 13.324 0.354 1.00 . A A . 13 ILE N 1 1 19 5396 1 1 13 ILE O O 0.858 12.755 0.965 1.00 . A A . 13 ILE O 1 1 19 5397 1 1 14 GLY C C 1.037 10.200 -0.362 1.00 . A A . 14 GLY C 1 1 19 5398 1 1 14 GLY CA C 0.566 11.255 -1.351 1.00 . A A . 14 GLY CA 1 1 19 5399 1 1 14 GLY H H -1.257 12.333 -1.272 1.00 . A A . 14 GLY H 1 1 19 5400 1 1 14 GLY HA2 H 0.127 10.756 -2.200 1.00 . A A . 14 GLY HA2 1 1 19 5401 1 1 14 GLY HA3 H 1.424 11.818 -1.688 1.00 . A A . 14 GLY HA3 1 1 19 5402 1 1 14 GLY N N -0.411 12.184 -0.800 1.00 . A A . 14 GLY N 1 1 19 5403 1 1 14 GLY O O 2.237 10.014 -0.174 1.00 . A A . 14 GLY O 1 1 19 5404 1 1 15 THR C C -0.527 7.314 1.195 1.00 . A A . 15 THR C 1 1 19 5405 1 1 15 THR CA C 0.461 8.479 1.244 1.00 . A A . 15 THR CA 1 1 19 5406 1 1 15 THR CB C 0.490 9.055 2.678 1.00 . A A . 15 THR CB 1 1 19 5407 1 1 15 THR CG2 C 1.021 8.033 3.672 1.00 . A A . 15 THR CG2 1 1 19 5408 1 1 15 THR H H -0.841 9.695 0.096 1.00 . A A . 15 THR H 1 1 19 5409 1 1 15 THR HA H 1.449 8.116 1.002 1.00 . A A . 15 THR HA 1 1 19 5410 1 1 15 THR HB H -0.518 9.321 2.962 1.00 . A A . 15 THR HB 1 1 19 5411 1 1 15 THR HG1 H 1.623 10.437 1.831 1.00 . A A . 15 THR HG1 1 1 19 5412 1 1 15 THR HG21 H 0.746 8.326 4.674 1.00 . A A . 15 THR HG21 1 1 19 5413 1 1 15 THR HG22 H 2.098 7.980 3.594 1.00 . A A . 15 THR HG22 1 1 19 5414 1 1 15 THR HG23 H 0.598 7.062 3.452 1.00 . A A . 15 THR HG23 1 1 19 5415 1 1 15 THR N N 0.104 9.509 0.277 1.00 . A A . 15 THR N 1 1 19 5416 1 1 15 THR O O -1.726 7.510 1.357 1.00 . A A . 15 THR O 1 1 19 5417 1 1 15 THR OG1 O 1.310 10.230 2.721 1.00 . A A . 15 THR OG1 1 1 19 5418 1 1 16 PRO C C -1.504 4.560 2.268 1.00 . A A . 16 PRO C 1 1 19 5419 1 1 16 PRO CA C -0.893 4.894 0.909 1.00 . A A . 16 PRO CA 1 1 19 5420 1 1 16 PRO CB C 0.064 3.786 0.462 1.00 . A A . 16 PRO CB 1 1 19 5421 1 1 16 PRO CD C 1.385 5.757 0.766 1.00 . A A . 16 PRO CD 1 1 19 5422 1 1 16 PRO CG C 1.418 4.258 0.868 1.00 . A A . 16 PRO CG 1 1 19 5423 1 1 16 PRO HA H -1.681 5.011 0.180 1.00 . A A . 16 PRO HA 1 1 19 5424 1 1 16 PRO HB2 H -0.198 2.861 0.956 1.00 . A A . 16 PRO HB2 1 1 19 5425 1 1 16 PRO HB3 H -0.003 3.660 -0.608 1.00 . A A . 16 PRO HB3 1 1 19 5426 1 1 16 PRO HD2 H 1.997 6.202 1.537 1.00 . A A . 16 PRO HD2 1 1 19 5427 1 1 16 PRO HD3 H 1.717 6.076 -0.212 1.00 . A A . 16 PRO HD3 1 1 19 5428 1 1 16 PRO HG2 H 1.622 3.955 1.884 1.00 . A A . 16 PRO HG2 1 1 19 5429 1 1 16 PRO HG3 H 2.164 3.853 0.199 1.00 . A A . 16 PRO HG3 1 1 19 5430 1 1 16 PRO N N -0.037 6.084 0.971 1.00 . A A . 16 PRO N 1 1 19 5431 1 1 16 PRO O O -0.823 4.616 3.291 1.00 . A A . 16 PRO O 1 1 19 5432 1 1 17 ILE C C -4.222 2.565 3.387 1.00 . A A . 17 ILE C 1 1 19 5433 1 1 17 ILE CA C -3.470 3.893 3.524 1.00 . A A . 17 ILE CA 1 1 19 5434 1 1 17 ILE CB C -4.426 5.041 3.943 1.00 . A A . 17 ILE CB 1 1 19 5435 1 1 17 ILE CD1 C -5.803 5.977 5.881 1.00 . A A . 17 ILE CD1 1 1 19 5436 1 1 17 ILE CG1 C -4.939 4.840 5.376 1.00 . A A . 17 ILE CG1 1 1 19 5437 1 1 17 ILE CG2 C -5.587 5.167 2.959 1.00 . A A . 17 ILE CG2 1 1 19 5438 1 1 17 ILE H H -3.287 4.198 1.433 1.00 . A A . 17 ILE H 1 1 19 5439 1 1 17 ILE HA H -2.717 3.778 4.289 1.00 . A A . 17 ILE HA 1 1 19 5440 1 1 17 ILE HB H -3.866 5.965 3.902 1.00 . A A . 17 ILE HB 1 1 19 5441 1 1 17 ILE HD11 H -5.333 6.431 6.739 1.00 . A A . 17 ILE HD11 1 1 19 5442 1 1 17 ILE HD12 H -6.773 5.591 6.162 1.00 . A A . 17 ILE HD12 1 1 19 5443 1 1 17 ILE HD13 H -5.920 6.713 5.101 1.00 . A A . 17 ILE HD13 1 1 19 5444 1 1 17 ILE HG12 H -5.526 3.935 5.415 1.00 . A A . 17 ILE HG12 1 1 19 5445 1 1 17 ILE HG13 H -4.094 4.744 6.042 1.00 . A A . 17 ILE HG13 1 1 19 5446 1 1 17 ILE HG21 H -5.430 6.024 2.322 1.00 . A A . 17 ILE HG21 1 1 19 5447 1 1 17 ILE HG22 H -6.510 5.291 3.506 1.00 . A A . 17 ILE HG22 1 1 19 5448 1 1 17 ILE HG23 H -5.644 4.274 2.354 1.00 . A A . 17 ILE HG23 1 1 19 5449 1 1 17 ILE N N -2.786 4.221 2.279 1.00 . A A . 17 ILE N 1 1 19 5450 1 1 17 ILE O O -5.286 2.350 3.968 1.00 . A A . 17 ILE O 1 1 19 5451 1 1 18 SER C C -3.283 -0.430 1.432 1.00 . A A . 18 SER C 1 1 19 5452 1 1 18 SER CA C -4.195 0.348 2.367 1.00 . A A . 18 SER CA 1 1 19 5453 1 1 18 SER CB C -5.600 0.455 1.767 1.00 . A A . 18 SER CB 1 1 19 5454 1 1 18 SER H H -2.781 1.907 2.192 1.00 . A A . 18 SER H 1 1 19 5455 1 1 18 SER HA H -4.251 -0.172 3.313 1.00 . A A . 18 SER HA 1 1 19 5456 1 1 18 SER HB2 H -5.907 -0.515 1.402 1.00 . A A . 18 SER HB2 1 1 19 5457 1 1 18 SER HB3 H -6.288 0.786 2.527 1.00 . A A . 18 SER HB3 1 1 19 5458 1 1 18 SER HG H -5.558 2.272 1.037 1.00 . A A . 18 SER HG 1 1 19 5459 1 1 18 SER N N -3.633 1.671 2.611 1.00 . A A . 18 SER N 1 1 19 5460 1 1 18 SER O O -2.607 0.165 0.595 1.00 . A A . 18 SER O 1 1 19 5461 1 1 18 SER OG O -5.629 1.377 0.687 1.00 . A A . 18 SER OG 1 1 19 5462 1 1 19 PHE C C -3.079 -3.953 0.513 1.00 . A A . 19 PHE C 1 1 19 5463 1 1 19 PHE CA C -2.412 -2.599 0.739 1.00 . A A . 19 PHE CA 1 1 19 5464 1 1 19 PHE CB C -1.027 -2.845 1.368 1.00 . A A . 19 PHE CB 1 1 19 5465 1 1 19 PHE CD1 C -0.733 -1.265 3.305 1.00 . A A . 19 PHE CD1 1 1 19 5466 1 1 19 PHE CD2 C 0.560 -0.900 1.334 1.00 . A A . 19 PHE CD2 1 1 19 5467 1 1 19 PHE CE1 C -0.146 -0.163 3.898 1.00 . A A . 19 PHE CE1 1 1 19 5468 1 1 19 PHE CE2 C 1.149 0.202 1.922 1.00 . A A . 19 PHE CE2 1 1 19 5469 1 1 19 PHE CG C -0.388 -1.646 2.017 1.00 . A A . 19 PHE CG 1 1 19 5470 1 1 19 PHE CZ C 0.796 0.571 3.205 1.00 . A A . 19 PHE CZ 1 1 19 5471 1 1 19 PHE H H -3.815 -2.167 2.274 1.00 . A A . 19 PHE H 1 1 19 5472 1 1 19 PHE HA H -2.285 -2.107 -0.215 1.00 . A A . 19 PHE HA 1 1 19 5473 1 1 19 PHE HB2 H -1.121 -3.615 2.114 1.00 . A A . 19 PHE HB2 1 1 19 5474 1 1 19 PHE HB3 H -0.359 -3.195 0.594 1.00 . A A . 19 PHE HB3 1 1 19 5475 1 1 19 PHE HD1 H -1.470 -1.838 3.848 1.00 . A A . 19 PHE HD1 1 1 19 5476 1 1 19 PHE HD2 H 0.838 -1.186 0.331 1.00 . A A . 19 PHE HD2 1 1 19 5477 1 1 19 PHE HE1 H -0.424 0.123 4.901 1.00 . A A . 19 PHE HE1 1 1 19 5478 1 1 19 PHE HE2 H 1.887 0.776 1.379 1.00 . A A . 19 PHE HE2 1 1 19 5479 1 1 19 PHE HZ H 1.256 1.433 3.666 1.00 . A A . 19 PHE HZ 1 1 19 5480 1 1 19 PHE N N -3.255 -1.750 1.578 1.00 . A A . 19 PHE N 1 1 19 5481 1 1 19 PHE O O -4.019 -4.316 1.219 1.00 . A A . 19 PHE O 1 1 19 5482 1 1 20 TYR C C -2.008 -6.841 -1.513 1.00 . A A . 20 TYR C 1 1 19 5483 1 1 20 TYR CA C -3.077 -6.033 -0.777 1.00 . A A . 20 TYR CA 1 1 19 5484 1 1 20 TYR CB C -4.390 -5.969 -1.594 1.00 . A A . 20 TYR CB 1 1 19 5485 1 1 20 TYR CD1 C -3.170 -4.676 -3.428 1.00 . A A . 20 TYR CD1 1 1 19 5486 1 1 20 TYR CD2 C -5.546 -4.793 -3.512 1.00 . A A . 20 TYR CD2 1 1 19 5487 1 1 20 TYR CE1 C -3.164 -3.915 -4.582 1.00 . A A . 20 TYR CE1 1 1 19 5488 1 1 20 TYR CE2 C -5.547 -4.034 -4.667 1.00 . A A . 20 TYR CE2 1 1 19 5489 1 1 20 TYR CG C -4.359 -5.128 -2.868 1.00 . A A . 20 TYR CG 1 1 19 5490 1 1 20 TYR CZ C -4.352 -3.597 -5.196 1.00 . A A . 20 TYR CZ 1 1 19 5491 1 1 20 TYR H H -1.800 -4.348 -0.959 1.00 . A A . 20 TYR H 1 1 19 5492 1 1 20 TYR HA H -3.281 -6.529 0.162 1.00 . A A . 20 TYR HA 1 1 19 5493 1 1 20 TYR HB2 H -4.674 -6.968 -1.876 1.00 . A A . 20 TYR HB2 1 1 19 5494 1 1 20 TYR HB3 H -5.162 -5.564 -0.959 1.00 . A A . 20 TYR HB3 1 1 19 5495 1 1 20 TYR HD1 H -2.237 -4.924 -2.945 1.00 . A A . 20 TYR HD1 1 1 19 5496 1 1 20 TYR HD2 H -6.482 -5.136 -3.096 1.00 . A A . 20 TYR HD2 1 1 19 5497 1 1 20 TYR HE1 H -2.227 -3.576 -4.998 1.00 . A A . 20 TYR HE1 1 1 19 5498 1 1 20 TYR HE2 H -6.480 -3.786 -5.149 1.00 . A A . 20 TYR HE2 1 1 19 5499 1 1 20 TYR HH H -3.833 -2.040 -6.196 1.00 . A A . 20 TYR HH 1 1 19 5500 1 1 20 TYR N N -2.568 -4.700 -0.452 1.00 . A A . 20 TYR N 1 1 19 5501 1 1 20 TYR O O -0.810 -6.644 -1.281 1.00 . A A . 20 TYR O 1 1 19 5502 1 1 20 TYR OH O -4.347 -2.839 -6.344 1.00 . A A . 20 TYR OH 1 1 19 5503 1 1 21 GLY C C -2.240 -9.505 -4.044 1.00 . A A . 21 GLY C 1 1 19 5504 1 1 21 GLY CA C -1.501 -8.548 -3.142 1.00 . A A . 21 GLY CA 1 1 19 5505 1 1 21 GLY H H -3.392 -7.853 -2.544 1.00 . A A . 21 GLY H 1 1 19 5506 1 1 21 GLY HA2 H -0.871 -7.907 -3.740 1.00 . A A . 21 GLY HA2 1 1 19 5507 1 1 21 GLY HA3 H -0.888 -9.111 -2.455 1.00 . A A . 21 GLY HA3 1 1 19 5508 1 1 21 GLY N N -2.429 -7.735 -2.392 1.00 . A A . 21 GLY N 1 1 19 5509 1 1 21 GLY O O -1.581 -10.267 -4.774 1.00 . A A . 21 GLY O 1 1 19 5510 1 1 21 GLY OXT O -3.489 -9.486 -4.009 1.00 . A A . 21 GLY OXT 1 1 20 5511 1 1 1 GLY C C -8.032 -2.424 2.345 1.00 . A A . 1 GLY C 1 1 20 5512 1 1 1 GLY CA C -8.435 -2.202 0.898 1.00 . A A . 1 GLY CA 1 1 20 5513 1 1 1 GLY H2 H -7.150 -0.859 -0.115 1.00 . A A . 1 GLY H2 1 1 20 5514 1 1 1 GLY HA2 H -9.191 -1.431 0.866 1.00 . A A . 1 GLY HA2 1 1 20 5515 1 1 1 GLY HA3 H -8.860 -3.118 0.513 1.00 . A A . 1 GLY HA3 1 1 20 5516 1 1 1 GLY N N -7.332 -1.808 0.042 1.00 . A A . 1 GLY N 1 1 20 5517 1 1 1 GLY O O -8.737 -1.997 3.256 1.00 . A A . 1 GLY O 1 1 20 5518 1 1 2 GLY C C -4.965 -3.305 4.071 1.00 . A A . 2 GLY C 1 1 20 5519 1 1 2 GLY CA C -6.470 -3.367 3.921 1.00 . A A . 2 GLY CA 1 1 20 5520 1 1 2 GLY H H -6.386 -3.429 1.802 1.00 . A A . 2 GLY H 1 1 20 5521 1 1 2 GLY HA2 H -6.915 -2.639 4.582 1.00 . A A . 2 GLY HA2 1 1 20 5522 1 1 2 GLY HA3 H -6.807 -4.351 4.208 1.00 . A A . 2 GLY HA3 1 1 20 5523 1 1 2 GLY N N -6.912 -3.099 2.564 1.00 . A A . 2 GLY N 1 1 20 5524 1 1 2 GLY O O -4.353 -2.273 3.803 1.00 . A A . 2 GLY O 1 1 20 5525 1 1 3 ALA C C -2.322 -5.535 3.770 1.00 . A A . 3 ALA C 1 1 20 5526 1 1 3 ALA CA C -2.928 -4.478 4.682 1.00 . A A . 3 ALA CA 1 1 20 5527 1 1 3 ALA CB C -2.593 -4.773 6.137 1.00 . A A . 3 ALA CB 1 1 20 5528 1 1 3 ALA H H -4.914 -5.198 4.691 1.00 . A A . 3 ALA H 1 1 20 5529 1 1 3 ALA HA H -2.511 -3.515 4.428 1.00 . A A . 3 ALA HA 1 1 20 5530 1 1 3 ALA HB1 H -1.580 -4.462 6.344 1.00 . A A . 3 ALA HB1 1 1 20 5531 1 1 3 ALA HB2 H -2.688 -5.834 6.321 1.00 . A A . 3 ALA HB2 1 1 20 5532 1 1 3 ALA HB3 H -3.274 -4.236 6.780 1.00 . A A . 3 ALA HB3 1 1 20 5533 1 1 3 ALA N N -4.370 -4.408 4.498 1.00 . A A . 3 ALA N 1 1 20 5534 1 1 3 ALA O O -2.945 -6.560 3.496 1.00 . A A . 3 ALA O 1 1 20 5535 1 1 4 GLY C C 0.937 -5.735 2.027 1.00 . A A . 4 GLY C 1 1 20 5536 1 1 4 GLY CA C -0.447 -6.209 2.413 1.00 . A A . 4 GLY CA 1 1 20 5537 1 1 4 GLY H H -0.666 -4.440 3.544 1.00 . A A . 4 GLY H 1 1 20 5538 1 1 4 GLY HA2 H -0.365 -7.164 2.911 1.00 . A A . 4 GLY HA2 1 1 20 5539 1 1 4 GLY HA3 H -1.039 -6.329 1.518 1.00 . A A . 4 GLY HA3 1 1 20 5540 1 1 4 GLY N N -1.113 -5.276 3.295 1.00 . A A . 4 GLY N 1 1 20 5541 1 1 4 GLY O O 1.769 -5.461 2.887 1.00 . A A . 4 GLY O 1 1 20 5542 1 1 5 HIS C C 2.282 -4.146 -0.870 1.00 . A A . 5 HIS C 1 1 20 5543 1 1 5 HIS CA C 2.477 -5.189 0.224 1.00 . A A . 5 HIS CA 1 1 20 5544 1 1 5 HIS CB C 3.303 -6.363 -0.319 1.00 . A A . 5 HIS CB 1 1 20 5545 1 1 5 HIS CD2 C 4.909 -7.562 1.328 1.00 . A A . 5 HIS CD2 1 1 20 5546 1 1 5 HIS CE1 C 3.486 -8.995 2.183 1.00 . A A . 5 HIS CE1 1 1 20 5547 1 1 5 HIS CG C 3.714 -7.357 0.725 1.00 . A A . 5 HIS CG 1 1 20 5548 1 1 5 HIS H H 0.472 -5.872 0.087 1.00 . A A . 5 HIS H 1 1 20 5549 1 1 5 HIS HA H 3.010 -4.733 1.046 1.00 . A A . 5 HIS HA 1 1 20 5550 1 1 5 HIS HB2 H 2.721 -6.886 -1.063 1.00 . A A . 5 HIS HB2 1 1 20 5551 1 1 5 HIS HB3 H 4.200 -5.975 -0.781 1.00 . A A . 5 HIS HB3 1 1 20 5552 1 1 5 HIS HD1 H 1.896 -8.379 1.050 1.00 . A A . 5 HIS HD1 1 1 20 5553 1 1 5 HIS HD2 H 5.825 -7.024 1.134 1.00 . A A . 5 HIS HD2 1 1 20 5554 1 1 5 HIS HE1 H 3.057 -9.787 2.780 1.00 . A A . 5 HIS HE1 1 1 20 5555 1 1 5 HIS HE2 H 5.393 -8.852 2.914 1.00 . A A . 5 HIS HE2 1 1 20 5556 1 1 5 HIS N N 1.184 -5.639 0.728 1.00 . A A . 5 HIS N 1 1 20 5557 1 1 5 HIS ND1 N 2.844 -8.272 1.284 1.00 . A A . 5 HIS ND1 1 1 20 5558 1 1 5 HIS NE2 N 4.741 -8.585 2.230 1.00 . A A . 5 HIS NE2 1 1 20 5559 1 1 5 HIS O O 2.904 -3.089 -0.845 1.00 . A A . 5 HIS O 1 1 20 5560 1 1 6 VAL C C -0.025 -2.586 -2.505 1.00 . A A . 6 VAL C 1 1 20 5561 1 1 6 VAL CA C 1.115 -3.523 -2.905 1.00 . A A . 6 VAL CA 1 1 20 5562 1 1 6 VAL CB C 0.781 -4.282 -4.215 1.00 . A A . 6 VAL CB 1 1 20 5563 1 1 6 VAL CG1 C -0.257 -5.367 -3.974 1.00 . A A . 6 VAL CG1 1 1 20 5564 1 1 6 VAL CG2 C 0.313 -3.325 -5.303 1.00 . A A . 6 VAL CG2 1 1 20 5565 1 1 6 VAL H H 0.923 -5.300 -1.776 1.00 . A A . 6 VAL H 1 1 20 5566 1 1 6 VAL HA H 2.003 -2.928 -3.076 1.00 . A A . 6 VAL HA 1 1 20 5567 1 1 6 VAL HB H 1.686 -4.762 -4.562 1.00 . A A . 6 VAL HB 1 1 20 5568 1 1 6 VAL HG11 H -1.246 -4.944 -4.061 1.00 . A A . 6 VAL HG11 1 1 20 5569 1 1 6 VAL HG12 H -0.125 -5.775 -2.981 1.00 . A A . 6 VAL HG12 1 1 20 5570 1 1 6 VAL HG13 H -0.134 -6.152 -4.705 1.00 . A A . 6 VAL HG13 1 1 20 5571 1 1 6 VAL HG21 H 0.592 -3.715 -6.271 1.00 . A A . 6 VAL HG21 1 1 20 5572 1 1 6 VAL HG22 H 0.776 -2.361 -5.157 1.00 . A A . 6 VAL HG22 1 1 20 5573 1 1 6 VAL HG23 H -0.761 -3.221 -5.253 1.00 . A A . 6 VAL HG23 1 1 20 5574 1 1 6 VAL N N 1.402 -4.446 -1.816 1.00 . A A . 6 VAL N 1 1 20 5575 1 1 6 VAL O O -1.066 -3.033 -2.029 1.00 . A A . 6 VAL O 1 1 20 5576 1 1 7 PRO C C -2.140 -0.377 -3.004 1.00 . A A . 7 PRO C 1 1 20 5577 1 1 7 PRO CA C -0.801 -0.243 -2.281 1.00 . A A . 7 PRO CA 1 1 20 5578 1 1 7 PRO CB C -0.123 1.069 -2.689 1.00 . A A . 7 PRO CB 1 1 20 5579 1 1 7 PRO CD C 1.433 -0.676 -3.165 1.00 . A A . 7 PRO CD 1 1 20 5580 1 1 7 PRO CG C 1.331 0.758 -2.738 1.00 . A A . 7 PRO CG 1 1 20 5581 1 1 7 PRO HA H -0.974 -0.238 -1.215 1.00 . A A . 7 PRO HA 1 1 20 5582 1 1 7 PRO HB2 H -0.494 1.380 -3.656 1.00 . A A . 7 PRO HB2 1 1 20 5583 1 1 7 PRO HB3 H -0.338 1.830 -1.955 1.00 . A A . 7 PRO HB3 1 1 20 5584 1 1 7 PRO HD2 H 1.481 -0.750 -4.241 1.00 . A A . 7 PRO HD2 1 1 20 5585 1 1 7 PRO HD3 H 2.294 -1.144 -2.714 1.00 . A A . 7 PRO HD3 1 1 20 5586 1 1 7 PRO HG2 H 1.819 1.399 -3.456 1.00 . A A . 7 PRO HG2 1 1 20 5587 1 1 7 PRO HG3 H 1.767 0.889 -1.758 1.00 . A A . 7 PRO HG3 1 1 20 5588 1 1 7 PRO N N 0.186 -1.271 -2.654 1.00 . A A . 7 PRO N 1 1 20 5589 1 1 7 PRO O O -2.189 -0.621 -4.208 1.00 . A A . 7 PRO O 1 1 20 5590 1 1 8 GLU C C -5.009 1.117 -3.302 1.00 . A A . 8 GLU C 1 1 20 5591 1 1 8 GLU CA C -4.567 -0.255 -2.809 1.00 . A A . 8 GLU CA 1 1 20 5592 1 1 8 GLU CB C -5.570 -0.753 -1.766 1.00 . A A . 8 GLU CB 1 1 20 5593 1 1 8 GLU CD C -6.567 -2.723 -0.540 1.00 . A A . 8 GLU CD 1 1 20 5594 1 1 8 GLU CG C -5.442 -2.226 -1.426 1.00 . A A . 8 GLU CG 1 1 20 5595 1 1 8 GLU H H -3.108 0.025 -1.302 1.00 . A A . 8 GLU H 1 1 20 5596 1 1 8 GLU HA H -4.552 -0.941 -3.643 1.00 . A A . 8 GLU HA 1 1 20 5597 1 1 8 GLU HB2 H -5.431 -0.188 -0.856 1.00 . A A . 8 GLU HB2 1 1 20 5598 1 1 8 GLU HB3 H -6.570 -0.578 -2.135 1.00 . A A . 8 GLU HB3 1 1 20 5599 1 1 8 GLU HG2 H -5.451 -2.794 -2.344 1.00 . A A . 8 GLU HG2 1 1 20 5600 1 1 8 GLU HG3 H -4.503 -2.383 -0.915 1.00 . A A . 8 GLU HG3 1 1 20 5601 1 1 8 GLU N N -3.222 -0.188 -2.254 1.00 . A A . 8 GLU N 1 1 20 5602 1 1 8 GLU O O -5.077 1.370 -4.502 1.00 . A A . 8 GLU O 1 1 20 5603 1 1 8 GLU OE1 O -6.727 -3.950 -0.389 1.00 . A A . 8 GLU OE1 1 1 20 5604 1 1 9 TYR C C -4.888 4.390 -2.013 1.00 . A A . 9 TYR C 1 1 20 5605 1 1 9 TYR CA C -5.757 3.349 -2.701 1.00 . A A . 9 TYR CA 1 1 20 5606 1 1 9 TYR CB C -7.219 3.572 -2.303 1.00 . A A . 9 TYR CB 1 1 20 5607 1 1 9 TYR CD1 C -8.352 1.312 -2.234 1.00 . A A . 9 TYR CD1 1 1 20 5608 1 1 9 TYR CD2 C -8.935 2.809 -3.995 1.00 . A A . 9 TYR CD2 1 1 20 5609 1 1 9 TYR CE1 C -9.233 0.372 -2.734 1.00 . A A . 9 TYR CE1 1 1 20 5610 1 1 9 TYR CE2 C -9.818 1.875 -4.501 1.00 . A A . 9 TYR CE2 1 1 20 5611 1 1 9 TYR CG C -8.188 2.546 -2.854 1.00 . A A . 9 TYR CG 1 1 20 5612 1 1 9 TYR CZ C -9.962 0.659 -3.867 1.00 . A A . 9 TYR CZ 1 1 20 5613 1 1 9 TYR H H -5.247 1.746 -1.414 1.00 . A A . 9 TYR H 1 1 20 5614 1 1 9 TYR HA H -5.661 3.467 -3.770 1.00 . A A . 9 TYR HA 1 1 20 5615 1 1 9 TYR HB2 H -7.295 3.555 -1.230 1.00 . A A . 9 TYR HB2 1 1 20 5616 1 1 9 TYR HB3 H -7.532 4.544 -2.660 1.00 . A A . 9 TYR HB3 1 1 20 5617 1 1 9 TYR HD1 H -7.779 1.091 -1.346 1.00 . A A . 9 TYR HD1 1 1 20 5618 1 1 9 TYR HD2 H -8.820 3.762 -4.489 1.00 . A A . 9 TYR HD2 1 1 20 5619 1 1 9 TYR HE1 H -9.345 -0.579 -2.238 1.00 . A A . 9 TYR HE1 1 1 20 5620 1 1 9 TYR HE2 H -10.391 2.099 -5.390 1.00 . A A . 9 TYR HE2 1 1 20 5621 1 1 9 TYR HH H -11.008 -0.092 -5.296 1.00 . A A . 9 TYR HH 1 1 20 5622 1 1 9 TYR N N -5.315 2.005 -2.361 1.00 . A A . 9 TYR N 1 1 20 5623 1 1 9 TYR O O -4.587 4.278 -0.820 1.00 . A A . 9 TYR O 1 1 20 5624 1 1 9 TYR OH O -10.840 -0.274 -4.368 1.00 . A A . 9 TYR OH 1 1 20 5625 1 1 10 PHE C C -4.594 7.601 -1.735 1.00 . A A . 10 PHE C 1 1 20 5626 1 1 10 PHE CA C -3.691 6.492 -2.252 1.00 . A A . 10 PHE CA 1 1 20 5627 1 1 10 PHE CB C -2.753 7.050 -3.330 1.00 . A A . 10 PHE CB 1 1 20 5628 1 1 10 PHE CD1 C -2.067 4.865 -4.389 1.00 . A A . 10 PHE CD1 1 1 20 5629 1 1 10 PHE CD2 C -0.362 6.389 -3.710 1.00 . A A . 10 PHE CD2 1 1 20 5630 1 1 10 PHE CE1 C -1.105 3.983 -4.838 1.00 . A A . 10 PHE CE1 1 1 20 5631 1 1 10 PHE CE2 C 0.604 5.509 -4.157 1.00 . A A . 10 PHE CE2 1 1 20 5632 1 1 10 PHE CG C -1.709 6.079 -3.819 1.00 . A A . 10 PHE CG 1 1 20 5633 1 1 10 PHE CZ C 0.233 4.304 -4.721 1.00 . A A . 10 PHE CZ 1 1 20 5634 1 1 10 PHE H H -4.800 5.433 -3.702 1.00 . A A . 10 PHE H 1 1 20 5635 1 1 10 PHE HA H -3.103 6.108 -1.433 1.00 . A A . 10 PHE HA 1 1 20 5636 1 1 10 PHE HB2 H -3.343 7.357 -4.178 1.00 . A A . 10 PHE HB2 1 1 20 5637 1 1 10 PHE HB3 H -2.241 7.913 -2.931 1.00 . A A . 10 PHE HB3 1 1 20 5638 1 1 10 PHE HD1 H -3.113 4.613 -4.481 1.00 . A A . 10 PHE HD1 1 1 20 5639 1 1 10 PHE HD2 H -0.069 7.330 -3.269 1.00 . A A . 10 PHE HD2 1 1 20 5640 1 1 10 PHE HE1 H -1.399 3.041 -5.278 1.00 . A A . 10 PHE HE1 1 1 20 5641 1 1 10 PHE HE2 H 1.650 5.762 -4.065 1.00 . A A . 10 PHE HE2 1 1 20 5642 1 1 10 PHE HZ H 0.987 3.615 -5.071 1.00 . A A . 10 PHE HZ 1 1 20 5643 1 1 10 PHE N N -4.507 5.404 -2.769 1.00 . A A . 10 PHE N 1 1 20 5644 1 1 10 PHE O O -5.741 7.721 -2.161 1.00 . A A . 10 PHE O 1 1 20 5645 1 1 11 VAL C C -4.175 10.843 -0.543 1.00 . A A . 11 VAL C 1 1 20 5646 1 1 11 VAL CA C -4.855 9.507 -0.272 1.00 . A A . 11 VAL CA 1 1 20 5647 1 1 11 VAL CB C -5.085 9.346 1.247 1.00 . A A . 11 VAL CB 1 1 20 5648 1 1 11 VAL CG1 C -5.877 8.079 1.539 1.00 . A A . 11 VAL CG1 1 1 20 5649 1 1 11 VAL CG2 C -3.764 9.339 1.999 1.00 . A A . 11 VAL CG2 1 1 20 5650 1 1 11 VAL H H -3.156 8.274 -0.531 1.00 . A A . 11 VAL H 1 1 20 5651 1 1 11 VAL HA H -5.821 9.506 -0.760 1.00 . A A . 11 VAL HA 1 1 20 5652 1 1 11 VAL HB H -5.665 10.190 1.593 1.00 . A A . 11 VAL HB 1 1 20 5653 1 1 11 VAL HG11 H -5.861 7.436 0.672 1.00 . A A . 11 VAL HG11 1 1 20 5654 1 1 11 VAL HG12 H -6.897 8.340 1.778 1.00 . A A . 11 VAL HG12 1 1 20 5655 1 1 11 VAL HG13 H -5.433 7.563 2.379 1.00 . A A . 11 VAL HG13 1 1 20 5656 1 1 11 VAL HG21 H -3.915 8.940 2.991 1.00 . A A . 11 VAL HG21 1 1 20 5657 1 1 11 VAL HG22 H -3.385 10.348 2.070 1.00 . A A . 11 VAL HG22 1 1 20 5658 1 1 11 VAL HG23 H -3.051 8.724 1.469 1.00 . A A . 11 VAL HG23 1 1 20 5659 1 1 11 VAL N N -4.079 8.409 -0.827 1.00 . A A . 11 VAL N 1 1 20 5660 1 1 11 VAL O O -3.155 10.902 -1.228 1.00 . A A . 11 VAL O 1 1 20 5661 1 1 12 GLY C C -2.837 13.427 0.438 1.00 . A A . 12 GLY C 1 1 20 5662 1 1 12 GLY CA C -4.204 13.242 -0.190 1.00 . A A . 12 GLY CA 1 1 20 5663 1 1 12 GLY H H -5.563 11.793 0.531 1.00 . A A . 12 GLY H 1 1 20 5664 1 1 12 GLY HA2 H -4.122 13.433 -1.247 1.00 . A A . 12 GLY HA2 1 1 20 5665 1 1 12 GLY HA3 H -4.885 13.962 0.241 1.00 . A A . 12 GLY HA3 1 1 20 5666 1 1 12 GLY N N -4.750 11.910 -0.001 1.00 . A A . 12 GLY N 1 1 20 5667 1 1 12 GLY O O -2.112 14.355 0.093 1.00 . A A . 12 GLY O 1 1 20 5668 1 1 13 ILE C C -0.095 11.956 1.225 1.00 . A A . 13 ILE C 1 1 20 5669 1 1 13 ILE CA C -1.193 12.631 2.048 1.00 . A A . 13 ILE CA 1 1 20 5670 1 1 13 ILE CB C -1.261 12.002 3.462 1.00 . A A . 13 ILE CB 1 1 20 5671 1 1 13 ILE CD1 C -2.801 11.659 5.469 1.00 . A A . 13 ILE CD1 1 1 20 5672 1 1 13 ILE CG1 C -2.601 12.334 4.130 1.00 . A A . 13 ILE CG1 1 1 20 5673 1 1 13 ILE CG2 C -0.111 12.504 4.329 1.00 . A A . 13 ILE CG2 1 1 20 5674 1 1 13 ILE H H -3.105 11.831 1.602 1.00 . A A . 13 ILE H 1 1 20 5675 1 1 13 ILE HA H -0.949 13.673 2.147 1.00 . A A . 13 ILE HA 1 1 20 5676 1 1 13 ILE HB H -1.168 10.931 3.364 1.00 . A A . 13 ILE HB 1 1 20 5677 1 1 13 ILE HD11 H -2.613 10.600 5.371 1.00 . A A . 13 ILE HD11 1 1 20 5678 1 1 13 ILE HD12 H -3.815 11.815 5.804 1.00 . A A . 13 ILE HD12 1 1 20 5679 1 1 13 ILE HD13 H -2.115 12.079 6.190 1.00 . A A . 13 ILE HD13 1 1 20 5680 1 1 13 ILE HG12 H -2.664 13.400 4.284 1.00 . A A . 13 ILE HG12 1 1 20 5681 1 1 13 ILE HG13 H -3.405 12.023 3.477 1.00 . A A . 13 ILE HG13 1 1 20 5682 1 1 13 ILE HG21 H -0.498 12.844 5.280 1.00 . A A . 13 ILE HG21 1 1 20 5683 1 1 13 ILE HG22 H 0.386 13.324 3.829 1.00 . A A . 13 ILE HG22 1 1 20 5684 1 1 13 ILE HG23 H 0.593 11.702 4.493 1.00 . A A . 13 ILE HG23 1 1 20 5685 1 1 13 ILE N N -2.485 12.547 1.368 1.00 . A A . 13 ILE N 1 1 20 5686 1 1 13 ILE O O 0.975 11.617 1.733 1.00 . A A . 13 ILE O 1 1 20 5687 1 1 14 GLY C C 0.759 9.683 -0.783 1.00 . A A . 14 GLY C 1 1 20 5688 1 1 14 GLY CA C 0.579 11.180 -0.981 1.00 . A A . 14 GLY CA 1 1 20 5689 1 1 14 GLY H H -1.232 12.098 -0.388 1.00 . A A . 14 GLY H 1 1 20 5690 1 1 14 GLY HA2 H 0.236 11.353 -1.990 1.00 . A A . 14 GLY HA2 1 1 20 5691 1 1 14 GLY HA3 H 1.538 11.663 -0.855 1.00 . A A . 14 GLY HA3 1 1 20 5692 1 1 14 GLY N N -0.370 11.787 -0.056 1.00 . A A . 14 GLY N 1 1 20 5693 1 1 14 GLY O O 0.803 8.923 -1.748 1.00 . A A . 14 GLY O 1 1 20 5694 1 1 15 THR C C -0.260 7.138 0.947 1.00 . A A . 15 THR C 1 1 20 5695 1 1 15 THR CA C 1.076 7.863 0.787 1.00 . A A . 15 THR CA 1 1 20 5696 1 1 15 THR CB C 1.927 7.705 2.073 1.00 . A A . 15 THR CB 1 1 20 5697 1 1 15 THR CG2 C 1.260 8.375 3.269 1.00 . A A . 15 THR CG2 1 1 20 5698 1 1 15 THR H H 0.845 9.928 1.189 1.00 . A A . 15 THR H 1 1 20 5699 1 1 15 THR HA H 1.619 7.410 -0.031 1.00 . A A . 15 THR HA 1 1 20 5700 1 1 15 THR HB H 2.884 8.181 1.907 1.00 . A A . 15 THR HB 1 1 20 5701 1 1 15 THR HG1 H 1.347 5.932 2.727 1.00 . A A . 15 THR HG1 1 1 20 5702 1 1 15 THR HG21 H 0.285 7.940 3.428 1.00 . A A . 15 THR HG21 1 1 20 5703 1 1 15 THR HG22 H 1.154 9.433 3.076 1.00 . A A . 15 THR HG22 1 1 20 5704 1 1 15 THR HG23 H 1.869 8.230 4.149 1.00 . A A . 15 THR HG23 1 1 20 5705 1 1 15 THR N N 0.878 9.265 0.463 1.00 . A A . 15 THR N 1 1 20 5706 1 1 15 THR O O -1.201 7.662 1.547 1.00 . A A . 15 THR O 1 1 20 5707 1 1 15 THR OG1 O 2.150 6.319 2.364 1.00 . A A . 15 THR OG1 1 1 20 5708 1 1 16 PRO C C -1.799 4.550 1.881 1.00 . A A . 16 PRO C 1 1 20 5709 1 1 16 PRO CA C -1.576 5.110 0.480 1.00 . A A . 16 PRO CA 1 1 20 5710 1 1 16 PRO CB C -1.313 3.978 -0.514 1.00 . A A . 16 PRO CB 1 1 20 5711 1 1 16 PRO CD C 0.715 5.230 -0.340 1.00 . A A . 16 PRO CD 1 1 20 5712 1 1 16 PRO CG C 0.170 3.846 -0.551 1.00 . A A . 16 PRO CG 1 1 20 5713 1 1 16 PRO HA H -2.447 5.671 0.173 1.00 . A A . 16 PRO HA 1 1 20 5714 1 1 16 PRO HB2 H -1.784 3.070 -0.162 1.00 . A A . 16 PRO HB2 1 1 20 5715 1 1 16 PRO HB3 H -1.711 4.243 -1.481 1.00 . A A . 16 PRO HB3 1 1 20 5716 1 1 16 PRO HD2 H 1.622 5.192 0.246 1.00 . A A . 16 PRO HD2 1 1 20 5717 1 1 16 PRO HD3 H 0.898 5.713 -1.288 1.00 . A A . 16 PRO HD3 1 1 20 5718 1 1 16 PRO HG2 H 0.498 3.188 0.239 1.00 . A A . 16 PRO HG2 1 1 20 5719 1 1 16 PRO HG3 H 0.479 3.464 -1.512 1.00 . A A . 16 PRO HG3 1 1 20 5720 1 1 16 PRO N N -0.360 5.918 0.401 1.00 . A A . 16 PRO N 1 1 20 5721 1 1 16 PRO O O -0.854 4.130 2.548 1.00 . A A . 16 PRO O 1 1 20 5722 1 1 17 ILE C C -4.105 2.678 3.480 1.00 . A A . 17 ILE C 1 1 20 5723 1 1 17 ILE CA C -3.382 4.010 3.639 1.00 . A A . 17 ILE CA 1 1 20 5724 1 1 17 ILE CB C -4.247 5.002 4.459 1.00 . A A . 17 ILE CB 1 1 20 5725 1 1 17 ILE CD1 C -4.493 7.463 5.090 1.00 . A A . 17 ILE CD1 1 1 20 5726 1 1 17 ILE CG1 C -3.692 6.424 4.331 1.00 . A A . 17 ILE CG1 1 1 20 5727 1 1 17 ILE CG2 C -4.284 4.591 5.930 1.00 . A A . 17 ILE CG2 1 1 20 5728 1 1 17 ILE H H -3.764 4.868 1.745 1.00 . A A . 17 ILE H 1 1 20 5729 1 1 17 ILE HA H -2.456 3.840 4.169 1.00 . A A . 17 ILE HA 1 1 20 5730 1 1 17 ILE HB H -5.256 4.977 4.074 1.00 . A A . 17 ILE HB 1 1 20 5731 1 1 17 ILE HD11 H -5.112 8.015 4.399 1.00 . A A . 17 ILE HD11 1 1 20 5732 1 1 17 ILE HD12 H -3.819 8.141 5.592 1.00 . A A . 17 ILE HD12 1 1 20 5733 1 1 17 ILE HD13 H -5.119 6.972 5.820 1.00 . A A . 17 ILE HD13 1 1 20 5734 1 1 17 ILE HG12 H -2.683 6.444 4.711 1.00 . A A . 17 ILE HG12 1 1 20 5735 1 1 17 ILE HG13 H -3.685 6.708 3.289 1.00 . A A . 17 ILE HG13 1 1 20 5736 1 1 17 ILE HG21 H -4.565 5.441 6.533 1.00 . A A . 17 ILE HG21 1 1 20 5737 1 1 17 ILE HG22 H -3.307 4.243 6.230 1.00 . A A . 17 ILE HG22 1 1 20 5738 1 1 17 ILE HG23 H -5.006 3.798 6.063 1.00 . A A . 17 ILE HG23 1 1 20 5739 1 1 17 ILE N N -3.049 4.534 2.321 1.00 . A A . 17 ILE N 1 1 20 5740 1 1 17 ILE O O -5.042 2.351 4.204 1.00 . A A . 17 ILE O 1 1 20 5741 1 1 18 SER C C -3.307 -0.164 1.266 1.00 . A A . 18 SER C 1 1 20 5742 1 1 18 SER CA C -4.210 0.604 2.217 1.00 . A A . 18 SER CA 1 1 20 5743 1 1 18 SER CB C -5.611 0.734 1.623 1.00 . A A . 18 SER CB 1 1 20 5744 1 1 18 SER H H -2.895 2.238 1.968 1.00 . A A . 18 SER H 1 1 20 5745 1 1 18 SER HA H -4.273 0.059 3.148 1.00 . A A . 18 SER HA 1 1 20 5746 1 1 18 SER HB2 H -5.937 -0.235 1.273 1.00 . A A . 18 SER HB2 1 1 20 5747 1 1 18 SER HB3 H -6.290 1.085 2.383 1.00 . A A . 18 SER HB3 1 1 20 5748 1 1 18 SER HG H -5.452 2.532 0.857 1.00 . A A . 18 SER HG 1 1 20 5749 1 1 18 SER N N -3.644 1.911 2.508 1.00 . A A . 18 SER N 1 1 20 5750 1 1 18 SER O O -2.689 0.421 0.373 1.00 . A A . 18 SER O 1 1 20 5751 1 1 18 SER OG O -5.629 1.642 0.531 1.00 . A A . 18 SER OG 1 1 20 5752 1 1 19 PHE C C -3.072 -3.714 0.541 1.00 . A A . 19 PHE C 1 1 20 5753 1 1 19 PHE CA C -2.404 -2.349 0.652 1.00 . A A . 19 PHE CA 1 1 20 5754 1 1 19 PHE CB C -1.003 -2.544 1.258 1.00 . A A . 19 PHE CB 1 1 20 5755 1 1 19 PHE CD1 C -0.534 -0.640 2.838 1.00 . A A . 19 PHE CD1 1 1 20 5756 1 1 19 PHE CD2 C 0.678 -0.738 0.787 1.00 . A A . 19 PHE CD2 1 1 20 5757 1 1 19 PHE CE1 C 0.141 0.513 3.187 1.00 . A A . 19 PHE CE1 1 1 20 5758 1 1 19 PHE CE2 C 1.357 0.415 1.131 1.00 . A A . 19 PHE CE2 1 1 20 5759 1 1 19 PHE CG C -0.277 -1.278 1.633 1.00 . A A . 19 PHE CG 1 1 20 5760 1 1 19 PHE CZ C 1.087 1.043 2.332 1.00 . A A . 19 PHE CZ 1 1 20 5761 1 1 19 PHE H H -3.754 -1.860 2.209 1.00 . A A . 19 PHE H 1 1 20 5762 1 1 19 PHE HA H -2.315 -1.914 -0.332 1.00 . A A . 19 PHE HA 1 1 20 5763 1 1 19 PHE HB2 H -1.092 -3.146 2.147 1.00 . A A . 19 PHE HB2 1 1 20 5764 1 1 19 PHE HB3 H -0.390 -3.074 0.544 1.00 . A A . 19 PHE HB3 1 1 20 5765 1 1 19 PHE HD1 H -1.274 -1.053 3.509 1.00 . A A . 19 PHE HD1 1 1 20 5766 1 1 19 PHE HD2 H 0.888 -1.224 -0.154 1.00 . A A . 19 PHE HD2 1 1 20 5767 1 1 19 PHE HE1 H -0.073 1.002 4.126 1.00 . A A . 19 PHE HE1 1 1 20 5768 1 1 19 PHE HE2 H 2.099 0.826 0.463 1.00 . A A . 19 PHE HE2 1 1 20 5769 1 1 19 PHE HZ H 1.617 1.944 2.602 1.00 . A A . 19 PHE HZ 1 1 20 5770 1 1 19 PHE N N -3.230 -1.469 1.472 1.00 . A A . 19 PHE N 1 1 20 5771 1 1 19 PHE O O -4.077 -3.972 1.202 1.00 . A A . 19 PHE O 1 1 20 5772 1 1 20 TYR C C -1.923 -6.846 -0.995 1.00 . A A . 20 TYR C 1 1 20 5773 1 1 20 TYR CA C -3.015 -5.936 -0.456 1.00 . A A . 20 TYR CA 1 1 20 5774 1 1 20 TYR CB C -4.241 -5.954 -1.391 1.00 . A A . 20 TYR CB 1 1 20 5775 1 1 20 TYR CD1 C -3.712 -4.293 -3.236 1.00 . A A . 20 TYR CD1 1 1 20 5776 1 1 20 TYR CD2 C -3.982 -6.585 -3.829 1.00 . A A . 20 TYR CD2 1 1 20 5777 1 1 20 TYR CE1 C -3.484 -3.974 -4.562 1.00 . A A . 20 TYR CE1 1 1 20 5778 1 1 20 TYR CE2 C -3.751 -6.275 -5.154 1.00 . A A . 20 TYR CE2 1 1 20 5779 1 1 20 TYR CG C -3.964 -5.602 -2.844 1.00 . A A . 20 TYR CG 1 1 20 5780 1 1 20 TYR CZ C -3.503 -4.969 -5.516 1.00 . A A . 20 TYR CZ 1 1 20 5781 1 1 20 TYR H H -1.687 -4.314 -0.760 1.00 . A A . 20 TYR H 1 1 20 5782 1 1 20 TYR HA H -3.314 -6.300 0.516 1.00 . A A . 20 TYR HA 1 1 20 5783 1 1 20 TYR HB2 H -4.667 -6.946 -1.378 1.00 . A A . 20 TYR HB2 1 1 20 5784 1 1 20 TYR HB3 H -4.970 -5.261 -1.017 1.00 . A A . 20 TYR HB3 1 1 20 5785 1 1 20 TYR HD1 H -3.691 -3.517 -2.488 1.00 . A A . 20 TYR HD1 1 1 20 5786 1 1 20 TYR HD2 H -4.177 -7.607 -3.543 1.00 . A A . 20 TYR HD2 1 1 20 5787 1 1 20 TYR HE1 H -3.290 -2.952 -4.844 1.00 . A A . 20 TYR HE1 1 1 20 5788 1 1 20 TYR HE2 H -3.767 -7.055 -5.901 1.00 . A A . 20 TYR HE2 1 1 20 5789 1 1 20 TYR HH H -2.730 -5.340 -7.235 1.00 . A A . 20 TYR HH 1 1 20 5790 1 1 20 TYR N N -2.496 -4.584 -0.274 1.00 . A A . 20 TYR N 1 1 20 5791 1 1 20 TYR O O -0.732 -6.539 -0.880 1.00 . A A . 20 TYR O 1 1 20 5792 1 1 20 TYR OH O -3.275 -4.657 -6.837 1.00 . A A . 20 TYR OH 1 1 20 5793 1 1 21 GLY C C -2.100 -10.053 -2.786 1.00 . A A . 21 GLY C 1 1 20 5794 1 1 21 GLY CA C -1.387 -8.893 -2.140 1.00 . A A . 21 GLY CA 1 1 20 5795 1 1 21 GLY H H -3.293 -8.135 -1.654 1.00 . A A . 21 GLY H 1 1 20 5796 1 1 21 GLY HA2 H -0.779 -8.392 -2.879 1.00 . A A . 21 GLY HA2 1 1 20 5797 1 1 21 GLY HA3 H -0.751 -9.266 -1.352 1.00 . A A . 21 GLY HA3 1 1 20 5798 1 1 21 GLY N N -2.328 -7.951 -1.585 1.00 . A A . 21 GLY N 1 1 20 5799 1 1 21 GLY O O -1.427 -11.025 -3.175 1.00 . A A . 21 GLY O 1 1 20 5800 1 1 21 GLY OXT O -3.342 -9.983 -2.897 1.00 . A A . 21 GLY OXT 1 1 stop_ save_
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