NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
370038 | 1bm4 | 4221 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 134 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1bm4 # This FRED archive file contains, for PDB entry <1bm4>: # # - 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_1bm4 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1bm4 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 3679.19 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 $PROTEIN__MOLONEY_MURINE_LEUKEMIA_VIRUS_CAPSID_ A . 1 1 stop_ save_ save_PROTEIN__MOLONEY_MURINE_LEUKEMIA_VIRUS_CAPSID_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "PROTEIN MOLONEY MURINE LEUKEMIA VIRUS CAPSID " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code CAKVKGITQGPNESPSAFLERLKEAYRRYTPY _Entity.Number_of_monomers 32 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 CYS . 1 1 2 ALA . 1 1 3 LYS . 1 1 4 VAL . 1 1 5 LYS . 1 1 6 GLY . 1 1 7 ILE . 1 1 8 THR . 1 1 9 GLN . 1 1 10 GLY . 1 1 11 PRO . 1 1 12 ASN . 1 1 13 GLU . 1 1 14 SER . 1 1 15 PRO . 1 1 16 SER . 1 1 17 ALA . 1 1 18 PHE . 1 1 19 LEU . 1 1 20 GLU . 1 1 21 ARG . 1 1 22 LEU . 1 1 23 LYS . 1 1 24 GLU . 1 1 25 ALA . 1 1 26 TYR . 1 1 27 ARG . 1 1 28 ARG . 1 1 29 TYR . 1 1 30 THR . 1 1 31 PRO . 1 1 32 TYR . 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 CYS 1 1 1 1 ALA 2 2 1 1 LYS 3 3 1 1 VAL 4 4 1 1 LYS 5 5 1 1 GLY 6 6 1 1 ILE 7 7 1 1 THR 8 8 1 1 GLN 9 9 1 1 GLY 10 10 1 1 PRO 11 11 1 1 ASN 12 12 1 1 GLU 13 13 1 1 SER 14 14 1 1 PRO 15 15 1 1 SER 16 16 1 1 ALA 17 17 1 1 PHE 18 18 1 1 LEU 19 19 1 1 GLU 20 20 1 1 ARG 21 21 1 1 LEU 22 22 1 1 LYS 23 23 1 1 GLU 24 24 1 1 ALA 25 25 1 1 TYR 26 26 1 1 ARG 27 27 1 1 ARG 28 28 1 1 TYR 29 29 1 1 THR 30 30 1 1 PRO 31 31 1 1 TYR 32 32 1 1 stop_ save_ save_Discover_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 CYS HA 1 1 CYHn HA 1 1 1 1 2 1 1 2 ALA H 1 2 ALA HN 1 1 2 1 1 1 1 3 LYS H 1 3 LYS+ HN 1 1 2 1 2 1 1 3 LYS HA 1 3 LYS+ HA 1 1 3 1 1 1 1 3 LYS HA 1 3 LYS+ HA 1 1 3 1 2 1 1 4 VAL H 1 4 VAL HN 1 1 4 1 1 1 1 3 LYS HA 1 3 LYS+ HA 1 1 4 1 2 1 1 4 VAL HA 1 4 VAL HA 1 1 5 1 1 1 1 4 VAL H 1 4 VAL HN 1 1 5 1 2 1 1 5 LYS H 1 5 LYS+ HN 1 1 6 1 1 1 1 4 VAL HA 1 4 VAL HA 1 1 6 1 2 1 1 5 LYS H 1 5 LYS+ HN 1 1 7 1 1 1 1 4 VAL HB 1 4 VAL HB 1 1 7 1 2 1 1 5 LYS H 1 5 LYS+ HN 1 1 8 1 1 1 1 5 LYS H 1 5 LYS+ HN 1 1 8 1 2 1 1 6 GLY QA 1 6 GLY HA* 1 1 9 1 1 1 1 5 LYS HA 1 5 LYS+ HA 1 1 9 1 2 1 1 6 GLY H 1 6 GLY HN 1 1 10 1 1 1 1 6 GLY QA 1 6 GLY HA* 1 1 10 1 2 1 1 7 ILE H 1 7 ILE HN 1 1 11 1 1 1 1 7 ILE H 1 7 ILE HN 1 1 11 1 2 1 1 7 ILE HB 1 7 ILE HB 1 1 12 1 1 1 1 7 ILE H 1 7 ILE HN 1 1 12 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 13 1 1 1 1 7 ILE HA 1 7 ILE HA 1 1 13 1 2 1 1 8 THR H 1 8 THR HN 1 1 14 1 1 1 1 8 THR MG 1 8 THR HG2* 1 1 14 1 2 1 1 9 GLN H 1 9 GLN HN 1 1 15 1 1 1 1 9 GLN H 1 9 GLN HN 1 1 15 1 2 1 1 9 GLN HA 1 9 GLN HA 1 1 16 1 1 1 1 9 GLN H 1 9 GLN HN 1 1 16 1 2 1 1 9 GLN HG2 1 9 GLN HG2 1 1 17 1 1 1 1 9 GLN H 1 9 GLN HN 1 1 17 1 2 1 1 10 GLY QA 1 10 GLY HA* 1 1 18 1 1 1 1 9 GLN H 1 9 GLN HN 1 1 18 1 2 1 1 11 PRO HD3 1 11 PRO HD1 1 1 19 1 1 1 1 9 GLN HA 1 9 GLN HA 1 1 19 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 20 1 1 1 1 10 GLY H 1 10 GLY HN 1 1 20 1 2 1 1 11 PRO HD2 1 11 PRO HD2 1 1 21 1 1 1 1 10 GLY H 1 10 GLY HN 1 1 21 1 2 1 1 11 PRO HD3 1 11 PRO HD1 1 1 22 1 1 1 1 10 GLY QA 1 10 GLY HA* 1 1 22 1 2 1 1 11 PRO HD2 1 11 PRO HD2 1 1 23 1 1 1 1 10 GLY QA 1 10 GLY HA* 1 1 23 1 2 1 1 11 PRO HD3 1 11 PRO HD1 1 1 24 1 1 1 1 10 GLY QA 1 10 GLY HA* 1 1 24 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 25 1 1 1 1 11 PRO HA 1 11 PRO HA 1 1 25 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 26 1 1 1 1 11 PRO QB 1 11 PRO HB* 1 1 26 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 27 1 1 1 1 11 PRO HD3 1 11 PRO HD1 1 1 27 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 28 1 1 1 1 12 ASN H 1 12 ASN HN 1 1 28 1 2 1 1 13 GLU H 1 13 GLU HN 1 1 29 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1 29 1 2 1 1 13 GLU H 1 13 GLU HN 1 1 30 1 1 1 1 12 ASN QB 1 12 ASN HB* 1 1 30 1 2 1 1 13 GLU H 1 13 GLU HN 1 1 31 1 1 1 1 13 GLU H 1 13 GLU HN 1 1 31 1 2 1 1 13 GLU HG2 1 13 GLU HG2 1 1 32 1 1 1 1 13 GLU HA 1 13 GLU HA 1 1 32 1 2 1 1 14 SER H 1 14 SER HN 1 1 33 1 1 1 1 13 GLU HA 1 13 GLU HA 1 1 33 1 2 1 1 16 SER H 1 16 SER HN 1 1 34 1 1 1 1 13 GLU HG2 1 13 GLU HG2 1 1 34 1 2 1 1 14 SER H 1 14 SER HN 1 1 35 1 1 1 1 14 SER HA 1 14 SER HA 1 1 35 1 2 1 1 15 PRO QD 1 15 PRO HD* 1 1 36 1 1 1 1 15 PRO QB 1 15 PRO HB* 1 1 36 1 2 1 1 16 SER H 1 16 SER HN 1 1 37 1 1 1 1 15 PRO HG2 1 15 PRO HG2 1 1 37 1 2 1 1 16 SER H 1 16 SER HN 1 1 38 1 1 1 1 16 SER H 1 16 SER HN 1 1 38 1 2 1 1 16 SER HA 1 16 SER HA 1 1 39 1 1 1 1 16 SER H 1 16 SER HN 1 1 39 1 2 1 1 16 SER QB 1 16 SER HB* 1 1 40 1 1 1 1 16 SER HA 1 16 SER HA 1 1 40 1 2 1 1 19 LEU H 1 19 LEU HN 1 1 41 1 1 1 1 16 SER HA 1 16 SER HA 1 1 41 1 2 1 1 19 LEU HB2 1 19 LEU HB2 1 1 42 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 42 1 2 1 1 20 GLU H 1 20 GLU HN 1 1 43 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 43 1 2 1 1 20 GLU HB2 1 20 GLU HB2 1 1 44 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 44 1 2 1 1 20 GLU QG 1 20 GLU HG* 1 1 45 1 1 1 1 17 ALA MB 1 17 ALA HB* 1 1 45 1 2 1 1 20 GLU QG 1 20 GLU HG* 1 1 46 1 1 1 1 18 PHE H 1 18 PHE HN 1 1 46 1 2 1 1 18 PHE QB 1 18 PHE HB* 1 1 47 1 1 1 1 18 PHE H 1 18 PHE HN 1 1 47 1 2 1 1 18 PHE QD 1 18 PHE HD* 1 1 48 1 1 1 1 18 PHE HA 1 18 PHE HA 1 1 48 1 2 1 1 18 PHE QD 1 18 PHE HD* 1 1 49 1 1 1 1 18 PHE HA 1 18 PHE HA 1 1 49 1 2 1 1 19 LEU H 1 19 LEU HN 1 1 50 1 1 1 1 18 PHE HA 1 18 PHE HA 1 1 50 1 2 1 1 21 ARG H 1 21 ARG+ HN 1 1 51 1 1 1 1 18 PHE HA 1 18 PHE HA 1 1 51 1 2 1 1 21 ARG QB 1 21 ARG+ HB* 1 1 52 1 1 1 1 18 PHE QB 1 18 PHE HB* 1 1 52 1 2 1 1 18 PHE QD 1 18 PHE HD* 1 1 53 1 1 1 1 18 PHE QB 1 18 PHE HB* 1 1 53 1 2 1 1 19 LEU H 1 19 LEU HN 1 1 54 1 1 1 1 18 PHE QD 1 18 PHE HD* 1 1 54 1 2 1 1 19 LEU H 1 19 LEU HN 1 1 55 1 1 1 1 18 PHE QD 1 18 PHE HD* 1 1 55 1 2 1 1 19 LEU QD 1 19 LEU HD* 1 1 56 1 1 1 1 18 PHE QD 1 18 PHE HD* 1 1 56 1 2 1 1 22 LEU MD1 1 22 LEU HD1* 1 1 57 1 1 1 1 18 PHE QE 1 18 PHE HE* 1 1 57 1 2 1 1 19 LEU QD 1 19 LEU HD* 1 1 58 1 1 1 1 18 PHE QE 1 18 PHE HE* 1 1 58 1 2 1 1 22 LEU MD1 1 22 LEU HD1* 1 1 59 1 1 1 1 19 LEU H 1 19 LEU HN 1 1 59 1 2 1 1 19 LEU QD 1 19 LEU HD* 1 1 60 1 1 1 1 19 LEU H 1 19 LEU HN 1 1 60 1 2 1 1 20 GLU H 1 20 GLU HN 1 1 61 1 1 1 1 19 LEU HB3 1 19 LEU HB1 1 1 61 1 2 1 1 20 GLU H 1 20 GLU HN 1 1 62 1 1 1 1 19 LEU QD 1 19 LEU HD* 1 1 62 1 2 1 1 20 GLU H 1 20 GLU HN 1 1 63 1 1 1 1 20 GLU H 1 20 GLU HN 1 1 63 1 2 1 1 20 GLU HA 1 20 GLU HA 1 1 64 1 1 1 1 20 GLU H 1 20 GLU HN 1 1 64 1 2 1 1 21 ARG H 1 21 ARG+ HN 1 1 65 1 1 1 1 20 GLU HA 1 20 GLU HA 1 1 65 1 2 1 1 23 LYS H 1 23 LYS+ HN 1 1 66 1 1 1 1 20 GLU HA 1 20 GLU HA 1 1 66 1 2 1 1 23 LYS QE 1 23 LYS+ HE* 1 1 67 1 1 1 1 20 GLU HB2 1 20 GLU HB2 1 1 67 1 2 1 1 21 ARG H 1 21 ARG+ HN 1 1 68 1 1 1 1 20 GLU HB3 1 20 GLU HB1 1 1 68 1 2 1 1 21 ARG H 1 21 ARG+ HN 1 1 69 1 1 1 1 20 GLU QG 1 20 GLU HG* 1 1 69 1 2 1 1 21 ARG H 1 21 ARG+ HN 1 1 70 1 1 1 1 20 GLU QG 1 20 GLU HG* 1 1 70 1 2 1 1 23 LYS QB 1 23 LYS+ HB* 1 1 71 1 1 1 1 21 ARG H 1 21 ARG+ HN 1 1 71 1 2 1 1 21 ARG HA 1 21 ARG+ HA 1 1 72 1 1 1 1 21 ARG H 1 21 ARG+ HN 1 1 72 1 2 1 1 21 ARG QB 1 21 ARG+ HB* 1 1 73 1 1 1 1 21 ARG H 1 21 ARG+ HN 1 1 73 1 2 1 1 21 ARG HG3 1 21 ARG+ HG1 1 1 74 1 1 1 1 21 ARG H 1 21 ARG+ HN 1 1 74 1 2 1 1 22 LEU H 1 22 LEU HN 1 1 75 1 1 1 1 21 ARG H 1 21 ARG+ HN 1 1 75 1 2 1 1 22 LEU HG 1 22 LEU HG 1 1 76 1 1 1 1 21 ARG H 1 21 ARG+ HN 1 1 76 1 2 1 1 23 LYS H 1 23 LYS+ HN 1 1 77 1 1 1 1 21 ARG HA 1 21 ARG+ HA 1 1 77 1 2 1 1 24 GLU HG2 1 24 GLU HG2 1 1 78 1 1 1 1 21 ARG QB 1 21 ARG+ HB* 1 1 78 1 2 1 1 22 LEU H 1 22 LEU HN 1 1 79 1 1 1 1 22 LEU H 1 22 LEU HN 1 1 79 1 2 1 1 22 LEU HA 1 22 LEU HA 1 1 80 1 1 1 1 22 LEU H 1 22 LEU HN 1 1 80 1 2 1 1 22 LEU QB 1 22 LEU HB* 1 1 81 1 1 1 1 22 LEU H 1 22 LEU HN 1 1 81 1 2 1 1 22 LEU MD1 1 22 LEU HD1* 1 1 82 1 1 1 1 22 LEU H 1 22 LEU HN 1 1 82 1 2 1 1 22 LEU MD2 1 22 LEU HD2* 1 1 83 1 1 1 1 22 LEU H 1 22 LEU HN 1 1 83 1 2 1 1 23 LYS H 1 23 LYS+ HN 1 1 84 1 1 1 1 22 LEU HA 1 22 LEU HA 1 1 84 1 2 1 1 25 ALA MB 1 25 ALA HB* 1 1 85 1 1 1 1 22 LEU QB 1 22 LEU HB* 1 1 85 1 2 1 1 23 LYS H 1 23 LYS+ HN 1 1 86 1 1 1 1 22 LEU MD1 1 22 LEU HD1* 1 1 86 1 2 1 1 23 LYS H 1 23 LYS+ HN 1 1 87 1 1 1 1 22 LEU MD1 1 22 LEU HD1* 1 1 87 1 2 1 1 26 TYR QD 1 26 TYR HD* 1 1 88 1 1 1 1 22 LEU MD1 1 22 LEU HD1* 1 1 88 1 2 1 1 26 TYR QE 1 26 TYR HE* 1 1 89 1 1 1 1 23 LYS H 1 23 LYS+ HN 1 1 89 1 2 1 1 23 LYS QG 1 23 LYS+ HG* 1 1 90 1 1 1 1 23 LYS H 1 23 LYS+ HN 1 1 90 1 2 1 1 24 GLU H 1 24 GLU HN 1 1 91 1 1 1 1 23 LYS HA 1 23 LYS+ HA 1 1 91 1 2 1 1 26 TYR QB 1 26 TYR HB* 1 1 92 1 1 1 1 23 LYS QB 1 23 LYS+ HB* 1 1 92 1 2 1 1 24 GLU H 1 24 GLU HN 1 1 93 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 93 1 2 1 1 24 GLU HA 1 24 GLU HA 1 1 94 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 94 1 2 1 1 24 GLU QB 1 24 GLU HB* 1 1 95 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 95 1 2 1 1 24 GLU HG2 1 24 GLU HG2 1 1 96 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 96 1 2 1 1 24 GLU HG3 1 24 GLU HG1 1 1 97 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 97 1 2 1 1 25 ALA H 1 25 ALA HN 1 1 98 1 1 1 1 24 GLU HA 1 24 GLU HA 1 1 98 1 2 1 1 27 ARG QB 1 27 ARG+ HB* 1 1 99 1 1 1 1 25 ALA H 1 25 ALA HN 1 1 99 1 2 1 1 25 ALA HA 1 25 ALA HA 1 1 100 1 1 1 1 25 ALA H 1 25 ALA HN 1 1 100 1 2 1 1 25 ALA MB 1 25 ALA HB* 1 1 101 1 1 1 1 25 ALA H 1 25 ALA HN 1 1 101 1 2 1 1 26 TYR H 1 26 TYR HN 1 1 102 1 1 1 1 25 ALA H 1 25 ALA HN 1 1 102 1 2 1 1 26 TYR QD 1 26 TYR HD* 1 1 103 1 1 1 1 25 ALA HA 1 25 ALA HA 1 1 103 1 2 1 1 28 ARG QB 1 28 ARG+ HB* 1 1 104 1 1 1 1 25 ALA HA 1 25 ALA HA 1 1 104 1 2 1 1 28 ARG QD 1 28 ARG+ HD* 1 1 105 1 1 1 1 25 ALA MB 1 25 ALA HB* 1 1 105 1 2 1 1 26 TYR H 1 26 TYR HN 1 1 106 1 1 1 1 26 TYR H 1 26 TYR HN 1 1 106 1 2 1 1 26 TYR HA 1 26 TYR HA 1 1 107 1 1 1 1 26 TYR H 1 26 TYR HN 1 1 107 1 2 1 1 27 ARG H 1 27 ARG+ HN 1 1 108 1 1 1 1 26 TYR HA 1 26 TYR HA 1 1 108 1 2 1 1 29 TYR H 1 29 TYR HN 1 1 109 1 1 1 1 26 TYR HA 1 26 TYR HA 1 1 109 1 2 1 1 29 TYR QB 1 29 TYR HB2 1 1 110 1 1 1 1 26 TYR QB 1 26 TYR HB* 1 1 110 1 2 1 1 27 ARG H 1 27 ARG+ HN 1 1 111 1 1 1 1 27 ARG HA 1 27 ARG+ HA 1 1 111 1 2 1 1 27 ARG HE 1 27 ARG+ HE 1 1 112 1 1 1 1 27 ARG HA 1 27 ARG+ HA 1 1 112 1 2 1 1 30 THR H 1 30 THR HN 1 1 113 1 1 1 1 27 ARG HA 1 27 ARG+ HA 1 1 113 1 2 1 1 30 THR MG 1 30 THR HG2* 1 1 114 1 1 1 1 28 ARG H 1 28 ARG+ HN 1 1 114 1 2 1 1 28 ARG HA 1 28 ARG+ HA 1 1 115 1 1 1 1 28 ARG H 1 28 ARG+ HN 1 1 115 1 2 1 1 29 TYR H 1 29 TYR HN 1 1 116 1 1 1 1 28 ARG H 1 28 ARG+ HN 1 1 116 1 2 1 1 29 TYR QE 1 29 TYR HE* 1 1 117 1 1 1 1 28 ARG HA 1 28 ARG+ HA 1 1 117 1 2 1 1 29 TYR HA 1 29 TYR HA 1 1 118 1 1 1 1 28 ARG QB 1 28 ARG+ HB* 1 1 118 1 2 1 1 29 TYR H 1 29 TYR HN 1 1 119 1 1 1 1 28 ARG QB 1 28 ARG+ HB* 1 1 119 1 2 1 1 30 THR H 1 30 THR HN 1 1 120 1 1 1 1 29 TYR H 1 29 TYR HN 1 1 120 1 2 1 1 30 THR H 1 30 THR HN 1 1 121 1 1 1 1 29 TYR QB 1 29 TYR HB2 1 1 121 1 2 1 1 30 THR H 1 30 THR HN 1 1 122 1 1 1 1 29 TYR QD 1 29 TYR HD* 1 1 122 1 2 1 1 30 THR H 1 30 THR HN 1 1 123 1 1 1 1 30 THR H 1 30 THR HN 1 1 123 1 2 1 1 30 THR HB 1 30 THR HB 1 1 124 1 1 1 1 30 THR H 1 30 THR HN 1 1 124 1 2 1 1 31 PRO HA 1 31 PRO HA 1 1 125 1 1 1 1 30 THR H 1 30 THR HN 1 1 125 1 2 1 1 31 PRO QD 1 31 PRO HD* 1 1 126 1 1 1 1 30 THR HA 1 30 THR HA 1 1 126 1 2 1 1 31 PRO QD 1 31 PRO HD* 1 1 127 1 1 1 1 30 THR HA 1 30 THR HA 1 1 127 1 2 1 1 31 PRO HG2 1 31 PRO HG2 1 1 128 1 1 1 1 30 THR HB 1 30 THR HB 1 1 128 1 2 1 1 31 PRO QD 1 31 PRO HD* 1 1 129 1 1 1 1 30 THR HB 1 30 THR HB 1 1 129 1 2 1 1 32 TYR H 1 32 TYR HN 1 1 130 1 1 1 1 30 THR MG 1 30 THR HG2* 1 1 130 1 2 1 1 31 PRO QD 1 31 PRO HD* 1 1 131 1 1 1 1 31 PRO HA 1 31 PRO HA 1 1 131 1 2 1 1 32 TYR H 1 32 TYR HN 1 1 132 1 1 1 1 31 PRO QB 1 31 PRO HB* 1 1 132 1 2 1 1 32 TYR H 1 32 TYR HN 1 1 133 1 1 1 1 31 PRO QD 1 31 PRO HD* 1 1 133 1 2 1 1 32 TYR H 1 32 TYR HN 1 1 134 1 1 1 1 31 PRO QD 1 31 PRO HD* 1 1 134 1 2 1 1 32 TYR QD 1 32 TYR HD* 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 . . . . . 5.0 -1.0 5.0 1 1 2 1 . . . . . 2.7 -1.0 2.7 1 1 3 1 . . . . . 3.5 -1.0 3.5 1 1 4 1 . . . . . 5.0 -1.0 5.0 1 1 5 1 . . . . . 3.5 -1.0 3.5 1 1 6 1 . . . . . 2.7 -1.0 2.7 1 1 7 1 . . . . . 5.0 -1.0 5.0 1 1 8 1 . . . . . 2.7 -1.0 3.7 1 1 9 1 . . . . . 2.7 -1.0 2.7 1 1 10 1 . . . . . 3.5 -1.0 4.5 1 1 11 1 . . . . . 2.7 -1.0 2.7 1 1 12 1 . . . . . 5.0 -1.0 5.0 1 1 13 1 . . . . . 2.7 -1.0 2.7 1 1 14 1 . . . . . 5.0 -1.0 6.0 1 1 15 1 . . . . . 2.7 -1.0 2.7 1 1 16 1 . . . . . 5.0 -1.0 5.0 1 1 17 1 . . . . . 2.7 -1.0 3.7 1 1 18 1 . . . . . 5.0 -1.0 5.0 1 1 19 1 . . . . . 2.7 -1.0 2.7 1 1 20 1 . . . . . 5.0 -1.0 5.0 1 1 21 1 . . . . . 5.0 -1.0 5.0 1 1 22 1 . . . . . 3.5 -1.0 4.5 1 1 23 1 . . . . . 2.7 -1.0 3.7 1 1 24 1 . . . . . 5.0 -1.0 6.0 1 1 25 1 . . . . . 2.7 -1.0 2.7 1 1 26 1 . . . . . 5.0 -1.0 6.0 1 1 27 1 . . . . . 5.0 -1.0 5.0 1 1 28 1 . . . . . 3.5 -1.0 3.5 1 1 29 1 . . . . . 3.5 -1.0 3.5 1 1 30 1 . . . . . 5.0 -1.0 6.0 1 1 31 1 . . . . . 3.5 -1.0 3.5 1 1 32 1 . . . . . 3.5 -1.0 3.5 1 1 33 1 . . . . . 3.5 -1.0 3.5 1 1 34 1 . . . . . 5.0 -1.0 5.0 1 1 35 1 . . . . . 3.5 -1.0 4.5 1 1 36 1 . . . . . 5.0 -1.0 6.0 1 1 37 1 . . . . . 3.5 -1.0 3.5 1 1 38 1 . . . . . 2.7 -1.0 2.7 1 1 39 1 . . . . . 2.7 -1.0 3.7 1 1 40 1 . . . . . 3.5 -1.0 3.5 1 1 41 1 . . . . . 3.5 -1.0 3.5 1 1 42 1 . . . . . 3.5 -1.0 3.5 1 1 43 1 . . . . . 3.5 -1.0 3.5 1 1 44 1 . . . . . 5.0 -1.0 6.0 1 1 45 1 . . . . . 5.0 -1.0 7.0 1 1 46 1 . . . . . 2.7 -1.0 3.7 1 1 47 1 . . . . . 5.0 -1.0 7.0 1 1 48 1 . . . . . 3.5 -1.0 5.5 1 1 49 1 . . . . . 3.5 -1.0 3.5 1 1 50 1 . . . . . 3.5 -1.0 3.5 1 1 51 1 . . . . . 3.5 -1.0 4.5 1 1 52 1 . . . . . 2.7 -1.0 5.7 1 1 53 1 . . . . . 3.5 -1.0 4.5 1 1 54 1 . . . . . 5.0 -1.0 7.0 1 1 55 1 . . . . . 3.5 -1.0 7.9 1 1 56 1 . . . . . 5.0 -1.0 8.0 1 1 57 1 . . . . . 5.0 -1.0 9.4 1 1 58 1 . . . . . 3.5 -1.0 6.5 1 1 59 1 . . . . . 3.5 -1.0 5.9 1 1 60 1 . . . . . 3.5 -1.0 3.5 1 1 61 1 . . . . . 3.5 -1.0 3.5 1 1 62 1 . . . . . 5.0 -1.0 7.4 1 1 63 1 . . . . . 2.7 -1.0 2.7 1 1 64 1 . . . . . 3.5 -1.0 3.5 1 1 65 1 . . . . . 2.7 -1.0 2.7 1 1 66 1 . . . . . 5.0 -1.0 6.0 1 1 67 1 . . . . . 3.5 -1.0 3.5 1 1 68 1 . . . . . 3.5 -1.0 3.5 1 1 69 1 . . . . . 5.0 -1.0 6.0 1 1 70 1 . . . . . 5.0 -1.0 7.0 1 1 71 1 . . . . . 2.7 -1.0 2.7 1 1 72 1 . . . . . 2.7 -1.0 3.7 1 1 73 1 . . . . . 5.0 -1.0 5.0 1 1 74 1 . . . . . 3.5 -1.0 3.5 1 1 75 1 . . . . . 5.0 -1.0 5.0 1 1 76 1 . . . . . 5.0 -1.0 5.0 1 1 77 1 . . . . . 5.0 -1.0 5.0 1 1 78 1 . . . . . 2.7 -1.0 3.7 1 1 79 1 . . . . . 2.7 -1.0 2.7 1 1 80 1 . . . . . 2.7 -1.0 3.7 1 1 81 1 . . . . . 5.0 -1.0 6.0 1 1 82 1 . . . . . 3.5 -1.0 4.5 1 1 83 1 . . . . . 2.7 -1.0 2.7 1 1 84 1 . . . . . 2.7 -1.0 3.7 1 1 85 1 . . . . . 2.7 -1.0 3.7 1 1 86 1 . . . . . 5.0 -1.0 6.0 1 1 87 1 . . . . . 5.0 -1.0 8.0 1 1 88 1 . . . . . 5.0 -1.0 8.0 1 1 89 1 . . . . . 3.5 -1.0 4.5 1 1 90 1 . . . . . 2.7 -1.0 2.7 1 1 91 1 . . . . . 2.7 -1.0 3.7 1 1 92 1 . . . . . 2.7 -1.0 3.7 1 1 93 1 . . . . . 2.7 -1.0 2.7 1 1 94 1 . . . . . 2.7 -1.0 3.7 1 1 95 1 . . . . . 5.0 -1.0 5.0 1 1 96 1 . . . . . 5.0 -1.0 5.0 1 1 97 1 . . . . . 2.7 -1.0 2.7 1 1 98 1 . . . . . 2.7 -1.0 3.7 1 1 99 1 . . . . . 2.7 -1.0 2.7 1 1 100 1 . . . . . 2.7 -1.0 3.7 1 1 101 1 . . . . . 5.0 -1.0 5.0 1 1 102 1 . . . . . 5.0 -1.0 7.0 1 1 103 1 . . . . . 3.5 -1.0 4.5 1 1 104 1 . . . . . 5.0 -1.0 6.0 1 1 105 1 . . . . . 3.5 -1.0 4.5 1 1 106 1 . . . . . 2.7 -1.0 2.7 1 1 107 1 . . . . . 3.5 -1.0 3.5 1 1 108 1 . . . . . 3.5 -1.0 3.5 1 1 109 1 . . . . . 5.0 -1.0 5.0 1 1 110 1 . . . . . 3.5 -1.0 4.5 1 1 111 1 . . . . . 5.0 -1.0 5.0 1 1 112 1 . . . . . 5.0 -1.0 5.0 1 1 113 1 . . . . . 5.0 -1.0 6.0 1 1 114 1 . . . . . 2.7 -1.0 2.7 1 1 115 1 . . . . . 2.7 -1.0 2.7 1 1 116 1 . . . . . 3.5 -1.0 5.5 1 1 117 1 . . . . . 5.0 -1.0 5.0 1 1 118 1 . . . . . 3.5 -1.0 4.5 1 1 119 1 . . . . . 5.0 -1.0 6.0 1 1 120 1 . . . . . 3.5 -1.0 3.5 1 1 121 1 . . . . . 5.0 -1.0 5.0 1 1 122 1 . . . . . 3.5 -1.0 5.5 1 1 123 1 . . . . . 3.5 -1.0 3.5 1 1 124 1 . . . . . 5.0 -1.0 5.0 1 1 125 1 . . . . . 5.0 -1.0 6.0 1 1 126 1 . . . . . 2.7 -1.0 3.7 1 1 127 1 . . . . . 5.0 -1.0 5.0 1 1 128 1 . . . . . 3.5 -1.0 4.5 1 1 129 1 . . . . . 5.0 -1.0 5.0 1 1 130 1 . . . . . 5.0 -1.0 7.0 1 1 131 1 . . . . . 3.5 -1.0 3.5 1 1 132 1 . . . . . 5.0 -1.0 6.0 1 1 133 1 . . . . . 5.0 -1.0 6.0 1 1 134 1 . . . . . 5.0 -1.0 8.0 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 CYS C C -21.449 8.639 -3.672 1.00 . A A . 1 CYS C 1 1 1 2 1 1 1 CYS CA C -21.987 8.989 -5.094 1.00 . A A . 1 CYS CA 1 1 1 3 1 1 1 CYS CB C -21.795 7.848 -6.117 1.00 . A A . 1 CYS CB 1 1 1 4 1 1 1 CYS H1 H -21.553 10.343 -6.598 1.00 . A A . 1 CYS H1 1 1 1 5 1 1 1 CYS H2 H -21.602 11.032 -5.118 1.00 . A A . 1 CYS H2 1 1 1 6 1 1 1 CYS HA H -23.071 9.211 -5.050 1.00 . A A . 1 CYS HA 1 1 1 7 1 1 1 CYS HB2 H -22.313 6.929 -5.785 1.00 . A A . 1 CYS HB2 1 1 1 8 1 1 1 CYS HB3 H -22.263 8.117 -7.083 1.00 . A A . 1 CYS HB3 1 1 1 9 1 1 1 CYS HG H -19.868 6.657 -5.384 1.00 . A A . 1 CYS HG 1 1 1 10 1 1 1 CYS N N -21.292 10.190 -5.616 1.00 . A A . 1 CYS N 1 1 1 11 1 1 1 CYS O O -20.265 8.333 -3.487 1.00 . A A . 1 CYS O 1 1 1 12 1 1 1 CYS SG S -20.034 7.465 -6.425 1.00 . A A . 1 CYS SG 1 1 1 13 1 1 2 ALA C C -21.665 7.003 -0.845 1.00 . A A . 2 ALA C 1 1 1 14 1 1 2 ALA CA C -21.929 8.500 -1.229 1.00 . A A . 2 ALA CA 1 1 1 15 1 1 2 ALA CB C -23.056 9.147 -0.392 1.00 . A A . 2 ALA CB 1 1 1 16 1 1 2 ALA H H -23.269 9.010 -2.906 1.00 . A A . 2 ALA H 1 1 1 17 1 1 2 ALA HA H -20.988 9.043 -1.016 1.00 . A A . 2 ALA HA 1 1 1 18 1 1 2 ALA HB1 H -23.164 10.227 -0.609 1.00 . A A . 2 ALA HB1 1 1 1 19 1 1 2 ALA HB2 H -24.045 8.680 -0.561 1.00 . A A . 2 ALA HB2 1 1 1 20 1 1 2 ALA HB3 H -22.847 9.068 0.691 1.00 . A A . 2 ALA HB3 1 1 1 21 1 1 2 ALA N N -22.325 8.701 -2.652 1.00 . A A . 2 ALA N 1 1 1 22 1 1 2 ALA O O -20.542 6.674 -0.456 1.00 . A A . 2 ALA O 1 1 1 23 1 1 3 LYS C C -21.560 3.771 -1.443 1.00 . A A . 3 LYS C 1 1 1 24 1 1 3 LYS CA C -22.531 4.668 -0.579 1.00 . A A . 3 LYS CA 1 1 1 25 1 1 3 LYS CB C -24.001 4.136 -0.597 1.00 . A A . 3 LYS CB 1 1 1 26 1 1 3 LYS CD C -24.277 1.617 -1.182 1.00 . A A . 3 LYS CD 1 1 1 27 1 1 3 LYS CE C -23.843 0.210 -0.725 1.00 . A A . 3 LYS CE 1 1 1 28 1 1 3 LYS CG C -24.219 2.694 -0.067 1.00 . A A . 3 LYS CG 1 1 1 29 1 1 3 LYS H H -23.578 6.515 -1.106 1.00 . A A . 3 LYS H 1 1 1 30 1 1 3 LYS HA H -22.145 4.641 0.452 1.00 . A A . 3 LYS HA 1 1 1 31 1 1 3 LYS HB2 H -24.619 4.799 0.043 1.00 . A A . 3 LYS HB2 1 1 1 32 1 1 3 LYS HB3 H -24.448 4.245 -1.607 1.00 . A A . 3 LYS HB3 1 1 1 33 1 1 3 LYS HD2 H -25.318 1.572 -1.560 1.00 . A A . 3 LYS HD2 1 1 1 34 1 1 3 LYS HD3 H -23.695 1.927 -2.075 1.00 . A A . 3 LYS HD3 1 1 1 35 1 1 3 LYS HE2 H -24.284 -0.026 0.269 1.00 . A A . 3 LYS HE2 1 1 1 36 1 1 3 LYS HE3 H -24.269 -0.560 -1.407 1.00 . A A . 3 LYS HE3 1 1 1 37 1 1 3 LYS HG2 H -23.443 2.462 0.689 1.00 . A A . 3 LYS HG2 1 1 1 38 1 1 3 LYS HG3 H -25.166 2.652 0.508 1.00 . A A . 3 LYS HG3 1 1 1 39 1 1 3 LYS HZ1 H -21.923 1.072 -0.605 1.00 . A A . 3 LYS HZ1 1 1 1 40 1 1 3 LYS HZ2 H -21.967 -0.451 0.053 1.00 . A A . 3 LYS HZ2 1 1 1 41 1 1 3 LYS HZ3 H -21.957 -0.228 -1.581 1.00 . A A . 3 LYS HZ3 1 1 1 42 1 1 3 LYS N N -22.658 6.099 -0.976 1.00 . A A . 3 LYS N 1 1 1 43 1 1 3 LYS NZ N -22.353 0.129 -0.703 1.00 . A A . 3 LYS NZ 1 1 1 44 1 1 3 LYS O O -21.180 2.690 -0.976 1.00 . A A . 3 LYS O 1 1 1 45 1 1 4 VAL C C -18.855 4.103 -3.515 1.00 . A A . 4 VAL C 1 1 1 46 1 1 4 VAL CA C -20.252 3.388 -3.546 1.00 . A A . 4 VAL CA 1 1 1 47 1 1 4 VAL CB C -20.881 3.255 -4.984 1.00 . A A . 4 VAL CB 1 1 1 48 1 1 4 VAL CG1 C -19.981 2.481 -5.979 1.00 . A A . 4 VAL CG1 1 1 1 49 1 1 4 VAL CG2 C -22.258 2.544 -5.013 1.00 . A A . 4 VAL CG2 1 1 1 50 1 1 4 VAL H H -21.324 5.175 -2.812 1.00 . A A . 4 VAL H 1 1 1 51 1 1 4 VAL HA H -20.109 2.356 -3.164 1.00 . A A . 4 VAL HA 1 1 1 52 1 1 4 VAL HB H -21.023 4.276 -5.392 1.00 . A A . 4 VAL HB 1 1 1 53 1 1 4 VAL HG11 H -18.994 2.963 -6.111 1.00 . A A . 4 VAL HG11 1 1 1 54 1 1 4 VAL HG12 H -19.792 1.440 -5.656 1.00 . A A . 4 VAL HG12 1 1 1 55 1 1 4 VAL HG13 H -20.429 2.433 -6.990 1.00 . A A . 4 VAL HG13 1 1 1 56 1 1 4 VAL HG21 H -23.011 3.077 -4.402 1.00 . A A . 4 VAL HG21 1 1 1 57 1 1 4 VAL HG22 H -22.677 2.493 -6.037 1.00 . A A . 4 VAL HG22 1 1 1 58 1 1 4 VAL HG23 H -22.201 1.507 -4.631 1.00 . A A . 4 VAL HG23 1 1 1 59 1 1 4 VAL N N -21.175 4.172 -2.670 1.00 . A A . 4 VAL N 1 1 1 60 1 1 4 VAL O O -18.481 4.841 -4.432 1.00 . A A . 4 VAL O 1 1 1 61 1 1 5 LYS C C -15.817 3.112 -1.718 1.00 . A A . 5 LYS C 1 1 1 62 1 1 5 LYS CA C -16.638 4.273 -2.381 1.00 . A A . 5 LYS CA 1 1 1 63 1 1 5 LYS CB C -16.488 5.617 -1.599 1.00 . A A . 5 LYS CB 1 1 1 64 1 1 5 LYS CD C -16.692 8.197 -1.581 1.00 . A A . 5 LYS CD 1 1 1 65 1 1 5 LYS CE C -17.585 9.445 -1.767 1.00 . A A . 5 LYS CE 1 1 1 66 1 1 5 LYS CG C -17.223 6.862 -2.163 1.00 . A A . 5 LYS CG 1 1 1 67 1 1 5 LYS H H -18.505 3.252 -1.741 1.00 . A A . 5 LYS H 1 1 1 68 1 1 5 LYS HA H -16.227 4.423 -3.400 1.00 . A A . 5 LYS HA 1 1 1 69 1 1 5 LYS HB2 H -16.796 5.467 -0.545 1.00 . A A . 5 LYS HB2 1 1 1 70 1 1 5 LYS HB3 H -15.405 5.844 -1.543 1.00 . A A . 5 LYS HB3 1 1 1 71 1 1 5 LYS HD2 H -16.530 8.066 -0.491 1.00 . A A . 5 LYS HD2 1 1 1 72 1 1 5 LYS HD3 H -15.678 8.390 -1.983 1.00 . A A . 5 LYS HD3 1 1 1 73 1 1 5 LYS HE2 H -18.526 9.310 -1.190 1.00 . A A . 5 LYS HE2 1 1 1 74 1 1 5 LYS HE3 H -17.087 10.319 -1.292 1.00 . A A . 5 LYS HE3 1 1 1 75 1 1 5 LYS HG2 H -17.137 6.875 -3.267 1.00 . A A . 5 LYS HG2 1 1 1 76 1 1 5 LYS HG3 H -18.309 6.755 -1.964 1.00 . A A . 5 LYS HG3 1 1 1 77 1 1 5 LYS HZ1 H -17.100 9.529 -3.826 1.00 . A A . 5 LYS HZ1 1 1 1 78 1 1 5 LYS HZ2 H -18.674 9.120 -3.527 1.00 . A A . 5 LYS HZ2 1 1 1 79 1 1 5 LYS HZ3 H -18.202 10.684 -3.389 1.00 . A A . 5 LYS HZ3 1 1 1 80 1 1 5 LYS N N -18.076 3.867 -2.444 1.00 . A A . 5 LYS N 1 1 1 81 1 1 5 LYS NZ N -17.890 9.723 -3.198 1.00 . A A . 5 LYS NZ 1 1 1 82 1 1 5 LYS O O -15.226 3.269 -0.645 1.00 . A A . 5 LYS O 1 1 1 83 1 1 6 GLY C C -14.584 -0.314 -2.252 1.00 . A A . 6 GLY C 1 1 1 84 1 1 6 GLY CA C -15.604 0.655 -1.613 1.00 . A A . 6 GLY CA 1 1 1 85 1 1 6 GLY H H -16.307 1.943 -3.244 1.00 . A A . 6 GLY H 1 1 1 86 1 1 6 GLY HA2 H -15.377 0.814 -0.542 1.00 . A A . 6 GLY HA2 1 1 1 87 1 1 6 GLY HA3 H -16.587 0.146 -1.591 1.00 . A A . 6 GLY HA3 1 1 1 88 1 1 6 GLY N N -15.797 1.926 -2.352 1.00 . A A . 6 GLY N 1 1 1 89 1 1 6 GLY O O -14.989 -1.185 -3.017 1.00 . A A . 6 GLY O 1 1 1 90 1 1 7 ILE C C -11.892 1.752 -2.140 1.00 . A A . 7 ILE C 1 1 1 91 1 1 7 ILE CA C -12.519 0.678 -1.186 1.00 . A A . 7 ILE CA 1 1 1 92 1 1 7 ILE CB C -11.409 -0.058 -0.336 1.00 . A A . 7 ILE CB 1 1 1 93 1 1 7 ILE CD1 C -13.030 -0.813 1.641 1.00 . A A . 7 ILE CD1 1 1 1 94 1 1 7 ILE CG1 C -11.964 -1.191 0.591 1.00 . A A . 7 ILE CG1 1 1 1 95 1 1 7 ILE CG2 C -10.616 0.937 0.557 1.00 . A A . 7 ILE CG2 1 1 1 96 1 1 7 ILE H H -12.802 -1.051 -2.569 1.00 . A A . 7 ILE H 1 1 1 97 1 1 7 ILE HA H -13.201 1.181 -0.474 1.00 . A A . 7 ILE HA 1 1 1 98 1 1 7 ILE HB H -10.683 -0.531 -1.022 1.00 . A A . 7 ILE HB 1 1 1 99 1 1 7 ILE HD11 H -12.666 -0.045 2.346 1.00 . A A . 7 ILE HD11 1 1 1 100 1 1 7 ILE HD12 H -13.953 -0.427 1.174 1.00 . A A . 7 ILE HD12 1 1 1 101 1 1 7 ILE HD13 H -13.321 -1.692 2.246 1.00 . A A . 7 ILE HD13 1 1 1 102 1 1 7 ILE HG12 H -12.379 -1.999 -0.043 1.00 . A A . 7 ILE HG12 1 1 1 103 1 1 7 ILE HG13 H -11.116 -1.679 1.111 1.00 . A A . 7 ILE HG13 1 1 1 104 1 1 7 ILE HG21 H -11.269 1.529 1.225 1.00 . A A . 7 ILE HG21 1 1 1 105 1 1 7 ILE HG22 H -9.878 0.420 1.199 1.00 . A A . 7 ILE HG22 1 1 1 106 1 1 7 ILE HG23 H -10.030 1.658 -0.044 1.00 . A A . 7 ILE HG23 1 1 1 107 1 1 7 ILE N N -13.265 -0.313 -2.030 1.00 . A A . 7 ILE N 1 1 1 108 1 1 7 ILE O O -11.230 1.416 -3.125 1.00 . A A . 7 ILE O 1 1 1 109 1 1 8 THR C C -10.138 4.630 -1.817 1.00 . A A . 8 THR C 1 1 1 110 1 1 8 THR CA C -11.419 4.161 -2.584 1.00 . A A . 8 THR CA 1 1 1 111 1 1 8 THR CB C -12.468 5.300 -2.766 1.00 . A A . 8 THR CB 1 1 1 112 1 1 8 THR CG2 C -11.979 6.480 -3.620 1.00 . A A . 8 THR CG2 1 1 1 113 1 1 8 THR H H -12.590 3.217 -0.958 1.00 . A A . 8 THR H 1 1 1 114 1 1 8 THR HA H -11.126 3.826 -3.600 1.00 . A A . 8 THR HA 1 1 1 115 1 1 8 THR HB H -12.772 5.671 -1.765 1.00 . A A . 8 THR HB 1 1 1 116 1 1 8 THR HG1 H -13.601 3.838 -3.250 1.00 . A A . 8 THR HG1 1 1 1 117 1 1 8 THR HG21 H -11.675 6.157 -4.633 1.00 . A A . 8 THR HG21 1 1 1 118 1 1 8 THR HG22 H -12.777 7.233 -3.748 1.00 . A A . 8 THR HG22 1 1 1 119 1 1 8 THR HG23 H -11.117 6.997 -3.161 1.00 . A A . 8 THR HG23 1 1 1 120 1 1 8 THR N N -12.074 3.047 -1.830 1.00 . A A . 8 THR N 1 1 1 121 1 1 8 THR O O -10.220 5.062 -0.664 1.00 . A A . 8 THR O 1 1 1 122 1 1 8 THR OG1 O -13.609 4.783 -3.442 1.00 . A A . 8 THR OG1 1 1 1 123 1 1 9 GLN C C -7.149 3.750 -0.931 1.00 . A A . 9 GLN C 1 1 1 124 1 1 9 GLN CA C -7.615 4.877 -1.909 1.00 . A A . 9 GLN CA 1 1 1 125 1 1 9 GLN CB C -7.577 6.312 -1.277 1.00 . A A . 9 GLN CB 1 1 1 126 1 1 9 GLN CD C -5.066 6.293 -0.482 1.00 . A A . 9 GLN CD 1 1 1 127 1 1 9 GLN CG C -6.188 7.009 -1.246 1.00 . A A . 9 GLN CG 1 1 1 128 1 1 9 GLN H H -9.026 4.006 -3.349 1.00 . A A . 9 GLN H 1 1 1 129 1 1 9 GLN HA H -6.853 4.858 -2.705 1.00 . A A . 9 GLN HA 1 1 1 130 1 1 9 GLN HB2 H -8.253 6.976 -1.850 1.00 . A A . 9 GLN HB2 1 1 1 131 1 1 9 GLN HB3 H -8.017 6.295 -0.260 1.00 . A A . 9 GLN HB3 1 1 1 132 1 1 9 GLN HE21 H -5.733 6.984 1.255 1.00 . A A . 9 GLN HE21 1 1 1 133 1 1 9 GLN HE22 H -4.268 5.872 1.252 1.00 . A A . 9 GLN HE22 1 1 1 134 1 1 9 GLN HG2 H -5.835 7.160 -2.283 1.00 . A A . 9 GLN HG2 1 1 1 135 1 1 9 GLN HG3 H -6.302 8.036 -0.850 1.00 . A A . 9 GLN HG3 1 1 1 136 1 1 9 GLN N N -8.963 4.554 -2.484 1.00 . A A . 9 GLN N 1 1 1 137 1 1 9 GLN NE2 N -4.960 6.482 0.810 1.00 . A A . 9 GLN NE2 1 1 1 138 1 1 9 GLN O O -7.292 3.846 0.287 1.00 . A A . 9 GLN O 1 1 1 139 1 1 9 GLN OE1 O -4.288 5.530 -1.045 1.00 . A A . 9 GLN OE1 1 1 1 140 1 1 10 GLY C C -7.582 1.613 -3.385 1.00 . A A . 10 GLY C 1 1 1 141 1 1 10 GLY CA C -6.305 2.260 -2.763 1.00 . A A . 10 GLY CA 1 1 1 142 1 1 10 GLY H H -5.489 2.962 -0.910 1.00 . A A . 10 GLY H 1 1 1 143 1 1 10 GLY HA2 H -5.895 3.063 -3.398 1.00 . A A . 10 GLY HA2 1 1 1 144 1 1 10 GLY HA3 H -5.529 1.477 -2.808 1.00 . A A . 10 GLY HA3 1 1 1 145 1 1 10 GLY N N -6.376 2.739 -1.355 1.00 . A A . 10 GLY N 1 1 1 146 1 1 10 GLY O O -8.348 1.016 -2.626 1.00 . A A . 10 GLY O 1 1 1 147 1 1 11 PRO C C -9.016 -0.624 -5.114 1.00 . A A . 11 PRO C 1 1 1 148 1 1 11 PRO CA C -8.927 0.912 -5.422 1.00 . A A . 11 PRO CA 1 1 1 149 1 1 11 PRO CB C -8.637 1.195 -6.913 1.00 . A A . 11 PRO CB 1 1 1 150 1 1 11 PRO CD C -7.047 2.489 -5.667 1.00 . A A . 11 PRO CD 1 1 1 151 1 1 11 PRO CG C -7.905 2.534 -6.927 1.00 . A A . 11 PRO CG 1 1 1 152 1 1 11 PRO HA H -9.897 1.379 -5.165 1.00 . A A . 11 PRO HA 1 1 1 153 1 1 11 PRO HB2 H -7.984 0.420 -7.360 1.00 . A A . 11 PRO HB2 1 1 1 154 1 1 11 PRO HB3 H -9.562 1.217 -7.521 1.00 . A A . 11 PRO HB3 1 1 1 155 1 1 11 PRO HD2 H -6.078 1.997 -5.835 1.00 . A A . 11 PRO HD2 1 1 1 156 1 1 11 PRO HD3 H -6.856 3.515 -5.297 1.00 . A A . 11 PRO HD3 1 1 1 157 1 1 11 PRO HG2 H -7.307 2.688 -7.845 1.00 . A A . 11 PRO HG2 1 1 1 158 1 1 11 PRO HG3 H -8.629 3.371 -6.867 1.00 . A A . 11 PRO HG3 1 1 1 159 1 1 11 PRO N N -7.822 1.654 -4.734 1.00 . A A . 11 PRO N 1 1 1 160 1 1 11 PRO O O -8.300 -1.458 -5.679 1.00 . A A . 11 PRO O 1 1 1 161 1 1 12 ASN C C -8.424 -2.740 -2.909 1.00 . A A . 12 ASN C 1 1 1 162 1 1 12 ASN CA C -9.858 -2.278 -3.398 1.00 . A A . 12 ASN CA 1 1 1 163 1 1 12 ASN CB C -10.574 -3.306 -4.330 1.00 . A A . 12 ASN CB 1 1 1 164 1 1 12 ASN CG C -11.084 -4.560 -3.613 1.00 . A A . 12 ASN CG 1 1 1 165 1 1 12 ASN H H -10.199 -0.092 -3.677 1.00 . A A . 12 ASN H 1 1 1 166 1 1 12 ASN HA H -10.455 -2.169 -2.475 1.00 . A A . 12 ASN HA 1 1 1 167 1 1 12 ASN HB2 H -11.467 -2.847 -4.794 1.00 . A A . 12 ASN HB2 1 1 1 168 1 1 12 ASN HB3 H -9.924 -3.578 -5.185 1.00 . A A . 12 ASN HB3 1 1 1 169 1 1 12 ASN HD21 H -9.391 -5.511 -3.962 1.00 . A A . 12 ASN HD21 1 1 1 170 1 1 12 ASN HD22 H -10.727 -6.401 -3.067 1.00 . A A . 12 ASN HD22 1 1 1 171 1 1 12 ASN N N -9.860 -0.960 -4.124 1.00 . A A . 12 ASN N 1 1 1 172 1 1 12 ASN ND2 N -10.363 -5.653 -3.664 1.00 . A A . 12 ASN ND2 1 1 1 173 1 1 12 ASN O O -7.995 -3.864 -3.181 1.00 . A A . 12 ASN O 1 1 1 174 1 1 12 ASN OD1 O -12.133 -4.559 -2.979 1.00 . A A . 12 ASN OD1 1 1 1 175 1 1 13 GLU C C -5.280 -2.643 -3.025 1.00 . A A . 13 GLU C 1 1 1 176 1 1 13 GLU CA C -6.197 -1.962 -1.931 1.00 . A A . 13 GLU CA 1 1 1 177 1 1 13 GLU CB C -6.070 -2.634 -0.523 1.00 . A A . 13 GLU CB 1 1 1 178 1 1 13 GLU CD C -6.365 -4.670 1.040 1.00 . A A . 13 GLU CD 1 1 1 179 1 1 13 GLU CG C -6.563 -4.096 -0.360 1.00 . A A . 13 GLU CG 1 1 1 180 1 1 13 GLU H H -8.160 -0.950 -2.074 1.00 . A A . 13 GLU H 1 1 1 181 1 1 13 GLU HA H -5.771 -0.942 -1.867 1.00 . A A . 13 GLU HA 1 1 1 182 1 1 13 GLU HB2 H -5.007 -2.586 -0.214 1.00 . A A . 13 GLU HB2 1 1 1 183 1 1 13 GLU HB3 H -6.591 -2.000 0.221 1.00 . A A . 13 GLU HB3 1 1 1 184 1 1 13 GLU HE2 H -5.200 -5.804 2.021 1.00 . A A . 13 GLU HE2 1 1 1 185 1 1 13 GLU HG2 H -7.643 -4.141 -0.589 1.00 . A A . 13 GLU HG2 1 1 1 186 1 1 13 GLU HG3 H -6.073 -4.757 -1.101 1.00 . A A . 13 GLU HG3 1 1 1 187 1 1 13 GLU N N -7.674 -1.845 -2.219 1.00 . A A . 13 GLU N 1 1 1 188 1 1 13 GLU O O -4.274 -3.278 -2.696 1.00 . A A . 13 GLU O 1 1 1 189 1 1 13 GLU OE1 O -7.118 -4.448 1.982 1.00 . A A . 13 GLU OE1 1 1 1 190 1 1 13 GLU OE2 O -5.264 -5.467 1.127 1.00 . A A . 13 GLU OE2 1 1 1 191 1 1 14 SER C C -3.405 -2.561 -5.662 1.00 . A A . 14 SER C 1 1 1 192 1 1 14 SER CA C -4.868 -3.099 -5.450 1.00 . A A . 14 SER CA 1 1 1 193 1 1 14 SER CB C -5.730 -2.963 -6.735 1.00 . A A . 14 SER CB 1 1 1 194 1 1 14 SER H H -6.507 -2.017 -4.449 1.00 . A A . 14 SER H 1 1 1 195 1 1 14 SER HA H -4.779 -4.181 -5.221 1.00 . A A . 14 SER HA 1 1 1 196 1 1 14 SER HB2 H -5.801 -1.918 -7.082 1.00 . A A . 14 SER HB2 1 1 1 197 1 1 14 SER HB3 H -5.244 -3.514 -7.563 1.00 . A A . 14 SER HB3 1 1 1 198 1 1 14 SER HG H -7.595 -2.750 -6.203 1.00 . A A . 14 SER HG 1 1 1 199 1 1 14 SER N N -5.570 -2.416 -4.324 1.00 . A A . 14 SER N 1 1 1 200 1 1 14 SER O O -2.507 -3.409 -5.616 1.00 . A A . 14 SER O 1 1 1 201 1 1 14 SER OG O -7.052 -3.481 -6.565 1.00 . A A . 14 SER OG 1 1 1 202 1 1 15 PRO C C -1.141 -0.898 -4.136 1.00 . A A . 15 PRO C 1 1 1 203 1 1 15 PRO CA C -1.664 -0.761 -5.607 1.00 . A A . 15 PRO CA 1 1 1 204 1 1 15 PRO CB C -1.752 0.697 -6.101 1.00 . A A . 15 PRO CB 1 1 1 205 1 1 15 PRO CD C -4.013 -0.135 -6.062 1.00 . A A . 15 PRO CD 1 1 1 206 1 1 15 PRO CG C -3.188 1.121 -5.781 1.00 . A A . 15 PRO CG 1 1 1 207 1 1 15 PRO HA H -0.962 -1.329 -6.249 1.00 . A A . 15 PRO HA 1 1 1 208 1 1 15 PRO HB2 H -0.993 1.364 -5.649 1.00 . A A . 15 PRO HB2 1 1 1 209 1 1 15 PRO HB3 H -1.581 0.733 -7.195 1.00 . A A . 15 PRO HB3 1 1 1 210 1 1 15 PRO HD2 H -4.914 -0.163 -5.424 1.00 . A A . 15 PRO HD2 1 1 1 211 1 1 15 PRO HD3 H -4.346 -0.149 -7.118 1.00 . A A . 15 PRO HD3 1 1 1 212 1 1 15 PRO HG2 H -3.279 1.421 -4.720 1.00 . A A . 15 PRO HG2 1 1 1 213 1 1 15 PRO HG3 H -3.516 1.990 -6.367 1.00 . A A . 15 PRO HG3 1 1 1 214 1 1 15 PRO N N -3.059 -1.239 -5.813 1.00 . A A . 15 PRO N 1 1 1 215 1 1 15 PRO O O -0.047 -1.427 -3.941 1.00 . A A . 15 PRO O 1 1 1 216 1 1 16 SER C C -0.915 -1.667 -1.072 1.00 . A A . 16 SER C 1 1 1 217 1 1 16 SER CA C -1.438 -0.342 -1.712 1.00 . A A . 16 SER CA 1 1 1 218 1 1 16 SER CB C -2.607 0.234 -0.876 1.00 . A A . 16 SER CB 1 1 1 219 1 1 16 SER H H -2.750 0.035 -3.449 1.00 . A A . 16 SER H 1 1 1 220 1 1 16 SER HA H -0.593 0.368 -1.704 1.00 . A A . 16 SER HA 1 1 1 221 1 1 16 SER HB2 H -3.025 1.141 -1.356 1.00 . A A . 16 SER HB2 1 1 1 222 1 1 16 SER HB3 H -3.450 -0.482 -0.806 1.00 . A A . 16 SER HB3 1 1 1 223 1 1 16 SER HG H -1.915 -0.207 0.924 1.00 . A A . 16 SER HG 1 1 1 224 1 1 16 SER N N -1.910 -0.448 -3.118 1.00 . A A . 16 SER N 1 1 1 225 1 1 16 SER O O 0.182 -1.639 -0.518 1.00 . A A . 16 SER O 1 1 1 226 1 1 16 SER OG O -2.166 0.598 0.434 1.00 . A A . 16 SER OG 1 1 1 227 1 1 17 ALA C C 0.163 -4.689 -1.357 1.00 . A A . 17 ALA C 1 1 1 228 1 1 17 ALA CA C -1.104 -4.108 -0.632 1.00 . A A . 17 ALA CA 1 1 1 229 1 1 17 ALA CB C -2.290 -5.083 -0.728 1.00 . A A . 17 ALA CB 1 1 1 230 1 1 17 ALA H H -2.497 -2.752 -1.698 1.00 . A A . 17 ALA H 1 1 1 231 1 1 17 ALA HA H -0.815 -3.983 0.431 1.00 . A A . 17 ALA HA 1 1 1 232 1 1 17 ALA HB1 H -3.169 -4.710 -0.169 1.00 . A A . 17 ALA HB1 1 1 1 233 1 1 17 ALA HB2 H -2.617 -5.254 -1.772 1.00 . A A . 17 ALA HB2 1 1 1 234 1 1 17 ALA HB3 H -2.043 -6.069 -0.293 1.00 . A A . 17 ALA HB3 1 1 1 235 1 1 17 ALA N N -1.625 -2.811 -1.153 1.00 . A A . 17 ALA N 1 1 1 236 1 1 17 ALA O O 0.937 -5.418 -0.727 1.00 . A A . 17 ALA O 1 1 1 237 1 1 18 PHE C C 2.806 -3.528 -2.891 1.00 . A A . 18 PHE C 1 1 1 238 1 1 18 PHE CA C 1.731 -4.597 -3.296 1.00 . A A . 18 PHE CA 1 1 1 239 1 1 18 PHE CB C 1.452 -4.650 -4.826 1.00 . A A . 18 PHE CB 1 1 1 240 1 1 18 PHE CD1 C 3.012 -6.469 -5.694 1.00 . A A . 18 PHE CD1 1 1 1 241 1 1 18 PHE CD2 C 3.409 -4.189 -6.389 1.00 . A A . 18 PHE CD2 1 1 1 242 1 1 18 PHE CE1 C 4.122 -6.884 -6.425 1.00 . A A . 18 PHE CE1 1 1 1 243 1 1 18 PHE CE2 C 4.514 -4.608 -7.126 1.00 . A A . 18 PHE CE2 1 1 1 244 1 1 18 PHE CG C 2.650 -5.117 -5.667 1.00 . A A . 18 PHE CG 1 1 1 245 1 1 18 PHE CZ C 4.874 -5.953 -7.139 1.00 . A A . 18 PHE CZ 1 1 1 246 1 1 18 PHE H H -0.276 -3.710 -3.024 1.00 . A A . 18 PHE H 1 1 1 247 1 1 18 PHE HA H 2.154 -5.559 -2.965 1.00 . A A . 18 PHE HA 1 1 1 248 1 1 18 PHE HB2 H 0.607 -5.335 -5.038 1.00 . A A . 18 PHE HB2 1 1 1 249 1 1 18 PHE HB3 H 1.087 -3.665 -5.181 1.00 . A A . 18 PHE HB3 1 1 1 250 1 1 18 PHE HD1 H 2.440 -7.200 -5.141 1.00 . A A . 18 PHE HD1 1 1 1 251 1 1 18 PHE HD2 H 3.150 -3.140 -6.375 1.00 . A A . 18 PHE HD2 1 1 1 252 1 1 18 PHE HE1 H 4.403 -7.928 -6.439 1.00 . A A . 18 PHE HE1 1 1 1 253 1 1 18 PHE HE2 H 5.097 -3.888 -7.682 1.00 . A A . 18 PHE HE2 1 1 1 254 1 1 18 PHE HZ H 5.736 -6.276 -7.704 1.00 . A A . 18 PHE HZ 1 1 1 255 1 1 18 PHE N N 0.401 -4.389 -2.648 1.00 . A A . 18 PHE N 1 1 1 256 1 1 18 PHE O O 3.919 -3.912 -2.523 1.00 . A A . 18 PHE O 1 1 1 257 1 1 19 LEU C C 3.742 -1.280 -0.849 1.00 . A A . 19 LEU C 1 1 1 258 1 1 19 LEU CA C 3.375 -1.149 -2.372 1.00 . A A . 19 LEU CA 1 1 1 259 1 1 19 LEU CB C 2.684 0.223 -2.669 1.00 . A A . 19 LEU CB 1 1 1 260 1 1 19 LEU CD1 C 4.547 1.439 -3.969 1.00 . A A . 19 LEU CD1 1 1 1 261 1 1 19 LEU CD2 C 2.791 0.162 -5.258 1.00 . A A . 19 LEU CD2 1 1 1 262 1 1 19 LEU CG C 3.081 0.964 -3.977 1.00 . A A . 19 LEU CG 1 1 1 263 1 1 19 LEU H H 1.514 -2.042 -3.211 1.00 . A A . 19 LEU H 1 1 1 264 1 1 19 LEU HA H 4.341 -1.200 -2.904 1.00 . A A . 19 LEU HA 1 1 1 265 1 1 19 LEU HB2 H 1.582 0.124 -2.636 1.00 . A A . 19 LEU HB2 1 1 1 266 1 1 19 LEU HB3 H 2.876 0.932 -1.843 1.00 . A A . 19 LEU HB3 1 1 1 267 1 1 19 LEU HD11 H 4.786 2.030 -3.065 1.00 . A A . 19 LEU HD11 1 1 1 268 1 1 19 LEU HD12 H 5.267 0.601 -4.008 1.00 . A A . 19 LEU HD12 1 1 1 269 1 1 19 LEU HD13 H 4.768 2.086 -4.838 1.00 . A A . 19 LEU HD13 1 1 1 270 1 1 19 LEU HD21 H 1.732 -0.148 -5.315 1.00 . A A . 19 LEU HD21 1 1 1 271 1 1 19 LEU HD22 H 3.000 0.751 -6.170 1.00 . A A . 19 LEU HD22 1 1 1 272 1 1 19 LEU HD23 H 3.399 -0.760 -5.320 1.00 . A A . 19 LEU HD23 1 1 1 273 1 1 19 LEU HG H 2.453 1.876 -4.026 1.00 . A A . 19 LEU HG 1 1 1 274 1 1 19 LEU N N 2.483 -2.224 -2.904 1.00 . A A . 19 LEU N 1 1 1 275 1 1 19 LEU O O 4.841 -0.873 -0.479 1.00 . A A . 19 LEU O 1 1 1 276 1 1 20 GLU C C 4.216 -3.408 1.578 1.00 . A A . 20 GLU C 1 1 1 277 1 1 20 GLU CA C 3.261 -2.180 1.431 1.00 . A A . 20 GLU CA 1 1 1 278 1 1 20 GLU CB C 1.927 -2.397 2.205 1.00 . A A . 20 GLU CB 1 1 1 279 1 1 20 GLU CD C -0.346 -1.364 2.892 1.00 . A A . 20 GLU CD 1 1 1 280 1 1 20 GLU CG C 1.106 -1.110 2.490 1.00 . A A . 20 GLU CG 1 1 1 281 1 1 20 GLU H H 1.913 -1.871 -0.257 1.00 . A A . 20 GLU H 1 1 1 282 1 1 20 GLU HA H 3.830 -1.328 1.822 1.00 . A A . 20 GLU HA 1 1 1 283 1 1 20 GLU HB2 H 1.305 -3.137 1.660 1.00 . A A . 20 GLU HB2 1 1 1 284 1 1 20 GLU HB3 H 2.136 -2.886 3.177 1.00 . A A . 20 GLU HB3 1 1 1 285 1 1 20 GLU HE2 H -1.391 -1.884 4.394 1.00 . A A . 20 GLU HE2 1 1 1 286 1 1 20 GLU HG2 H 1.598 -0.514 3.278 1.00 . A A . 20 GLU HG2 1 1 1 287 1 1 20 GLU HG3 H 1.081 -0.462 1.596 1.00 . A A . 20 GLU HG3 1 1 1 288 1 1 20 GLU N N 2.899 -1.846 0.033 1.00 . A A . 20 GLU N 1 1 1 289 1 1 20 GLU O O 5.181 -3.297 2.337 1.00 . A A . 20 GLU O 1 1 1 290 1 1 20 GLU OE1 O -1.302 -1.216 2.134 1.00 . A A . 20 GLU OE1 1 1 1 291 1 1 20 GLU OE2 O -0.464 -1.745 4.194 1.00 . A A . 20 GLU OE2 1 1 1 292 1 1 21 ARG C C 6.457 -5.005 0.098 1.00 . A A . 21 ARG C 1 1 1 293 1 1 21 ARG CA C 5.082 -5.556 0.641 1.00 . A A . 21 ARG CA 1 1 1 294 1 1 21 ARG CB C 4.506 -6.650 -0.304 1.00 . A A . 21 ARG CB 1 1 1 295 1 1 21 ARG CD C 2.879 -8.667 -0.555 1.00 . A A . 21 ARG CD 1 1 1 296 1 1 21 ARG CG C 3.518 -7.628 0.388 1.00 . A A . 21 ARG CG 1 1 1 297 1 1 21 ARG CZ C 1.061 -8.637 -2.284 1.00 . A A . 21 ARG CZ 1 1 1 298 1 1 21 ARG H H 3.183 -4.548 0.266 1.00 . A A . 21 ARG H 1 1 1 299 1 1 21 ARG HA H 5.276 -5.991 1.627 1.00 . A A . 21 ARG HA 1 1 1 300 1 1 21 ARG HB2 H 4.046 -6.185 -1.198 1.00 . A A . 21 ARG HB2 1 1 1 301 1 1 21 ARG HB3 H 5.339 -7.257 -0.711 1.00 . A A . 21 ARG HB3 1 1 1 302 1 1 21 ARG HD2 H 3.656 -9.108 -1.213 1.00 . A A . 21 ARG HD2 1 1 1 303 1 1 21 ARG HD3 H 2.475 -9.502 0.052 1.00 . A A . 21 ARG HD3 1 1 1 304 1 1 21 ARG HE H 1.489 -7.067 -1.121 1.00 . A A . 21 ARG HE 1 1 1 305 1 1 21 ARG HG2 H 4.065 -8.170 1.185 1.00 . A A . 21 ARG HG2 1 1 1 306 1 1 21 ARG HG3 H 2.731 -7.069 0.936 1.00 . A A . 21 ARG HG3 1 1 1 307 1 1 21 ARG HH11 H 2.009 -10.352 -2.173 1.00 . A A . 21 ARG HH11 1 1 1 308 1 1 21 ARG HH12 H 0.652 -10.262 -3.397 1.00 . A A . 21 ARG HH12 1 1 1 309 1 1 21 ARG HH21 H -0.007 -6.993 -2.529 1.00 . A A . 21 ARG HH21 1 1 1 310 1 1 21 ARG HH22 H -0.450 -8.433 -3.562 1.00 . A A . 21 ARG HH22 1 1 1 311 1 1 21 ARG N N 4.032 -4.517 0.826 1.00 . A A . 21 ARG N 1 1 1 312 1 1 21 ARG NE N 1.784 -8.037 -1.341 1.00 . A A . 21 ARG NE 1 1 1 313 1 1 21 ARG NH1 N 1.254 -9.874 -2.670 1.00 . A A . 21 ARG NH1 1 1 1 314 1 1 21 ARG NH2 N 0.111 -7.956 -2.854 1.00 . A A . 21 ARG NH2 1 1 1 315 1 1 21 ARG O O 7.508 -5.434 0.582 1.00 . A A . 21 ARG O 1 1 1 316 1 1 22 LEU C C 8.209 -2.309 -0.091 1.00 . A A . 22 LEU C 1 1 1 317 1 1 22 LEU CA C 7.669 -3.263 -1.216 1.00 . A A . 22 LEU CA 1 1 1 318 1 1 22 LEU CB C 7.342 -2.448 -2.504 1.00 . A A . 22 LEU CB 1 1 1 319 1 1 22 LEU CD1 C 6.623 -2.279 -4.930 1.00 . A A . 22 LEU CD1 1 1 1 320 1 1 22 LEU CD2 C 8.317 -4.013 -4.303 1.00 . A A . 22 LEU CD2 1 1 1 321 1 1 22 LEU CG C 7.078 -3.238 -3.817 1.00 . A A . 22 LEU CG 1 1 1 322 1 1 22 LEU H H 5.561 -3.761 -1.217 1.00 . A A . 22 LEU H 1 1 1 323 1 1 22 LEU HA H 8.453 -3.991 -1.434 1.00 . A A . 22 LEU HA 1 1 1 324 1 1 22 LEU HB2 H 6.484 -1.782 -2.296 1.00 . A A . 22 LEU HB2 1 1 1 325 1 1 22 LEU HB3 H 8.178 -1.751 -2.701 1.00 . A A . 22 LEU HB3 1 1 1 326 1 1 22 LEU HD11 H 7.359 -1.473 -5.114 1.00 . A A . 22 LEU HD11 1 1 1 327 1 1 22 LEU HD12 H 6.473 -2.806 -5.890 1.00 . A A . 22 LEU HD12 1 1 1 328 1 1 22 LEU HD13 H 5.659 -1.797 -4.687 1.00 . A A . 22 LEU HD13 1 1 1 329 1 1 22 LEU HD21 H 9.185 -3.349 -4.470 1.00 . A A . 22 LEU HD21 1 1 1 330 1 1 22 LEU HD22 H 8.629 -4.785 -3.577 1.00 . A A . 22 LEU HD22 1 1 1 331 1 1 22 LEU HD23 H 8.121 -4.543 -5.253 1.00 . A A . 22 LEU HD23 1 1 1 332 1 1 22 LEU HG H 6.261 -3.967 -3.645 1.00 . A A . 22 LEU HG 1 1 1 333 1 1 22 LEU N N 6.463 -4.026 -0.831 1.00 . A A . 22 LEU N 1 1 1 334 1 1 22 LEU O O 9.429 -2.251 0.073 1.00 . A A . 22 LEU O 1 1 1 335 1 1 23 LYS C C 8.474 -1.348 3.001 1.00 . A A . 23 LYS C 1 1 1 336 1 1 23 LYS CA C 7.877 -0.640 1.738 1.00 . A A . 23 LYS CA 1 1 1 337 1 1 23 LYS CB C 6.721 0.319 2.145 1.00 . A A . 23 LYS CB 1 1 1 338 1 1 23 LYS CD C 5.355 2.459 1.532 1.00 . A A . 23 LYS CD 1 1 1 339 1 1 23 LYS CE C 3.930 1.887 1.396 1.00 . A A . 23 LYS CE 1 1 1 340 1 1 23 LYS CG C 6.474 1.471 1.137 1.00 . A A . 23 LYS CG 1 1 1 341 1 1 23 LYS H H 6.362 -1.784 0.563 1.00 . A A . 23 LYS H 1 1 1 342 1 1 23 LYS HA H 8.710 -0.040 1.318 1.00 . A A . 23 LYS HA 1 1 1 343 1 1 23 LYS HB2 H 5.799 -0.260 2.332 1.00 . A A . 23 LYS HB2 1 1 1 344 1 1 23 LYS HB3 H 6.959 0.784 3.122 1.00 . A A . 23 LYS HB3 1 1 1 345 1 1 23 LYS HD2 H 5.539 2.825 2.563 1.00 . A A . 23 LYS HD2 1 1 1 346 1 1 23 LYS HD3 H 5.459 3.357 0.889 1.00 . A A . 23 LYS HD3 1 1 1 347 1 1 23 LYS HE2 H 3.779 1.494 0.366 1.00 . A A . 23 LYS HE2 1 1 1 348 1 1 23 LYS HE3 H 3.809 1.006 2.062 1.00 . A A . 23 LYS HE3 1 1 1 349 1 1 23 LYS HG2 H 7.418 2.042 1.028 1.00 . A A . 23 LYS HG2 1 1 1 350 1 1 23 LYS HG3 H 6.287 1.066 0.123 1.00 . A A . 23 LYS HG3 1 1 1 351 1 1 23 LYS HZ1 H 3.063 3.324 2.668 1.00 . A A . 23 LYS HZ1 1 1 1 352 1 1 23 LYS HZ2 H 2.988 3.747 1.090 1.00 . A A . 23 LYS HZ2 1 1 1 353 1 1 23 LYS HZ3 H 1.953 2.616 1.682 1.00 . A A . 23 LYS HZ3 1 1 1 354 1 1 23 LYS N N 7.372 -1.580 0.686 1.00 . A A . 23 LYS N 1 1 1 355 1 1 23 LYS NZ N 2.930 2.939 1.723 1.00 . A A . 23 LYS NZ 1 1 1 356 1 1 23 LYS O O 9.461 -0.835 3.532 1.00 . A A . 23 LYS O 1 1 1 357 1 1 24 GLU C C 9.998 -3.965 3.988 1.00 . A A . 24 GLU C 1 1 1 358 1 1 24 GLU CA C 8.639 -3.343 4.485 1.00 . A A . 24 GLU CA 1 1 1 359 1 1 24 GLU CB C 7.643 -4.429 4.989 1.00 . A A . 24 GLU CB 1 1 1 360 1 1 24 GLU CD C 6.152 -6.494 4.592 1.00 . A A . 24 GLU CD 1 1 1 361 1 1 24 GLU CG C 7.203 -5.552 4.013 1.00 . A A . 24 GLU CG 1 1 1 362 1 1 24 GLU H H 7.133 -2.853 2.975 1.00 . A A . 24 GLU H 1 1 1 363 1 1 24 GLU HA H 8.881 -2.678 5.318 1.00 . A A . 24 GLU HA 1 1 1 364 1 1 24 GLU HB2 H 8.089 -4.904 5.885 1.00 . A A . 24 GLU HB2 1 1 1 365 1 1 24 GLU HB3 H 6.741 -3.919 5.383 1.00 . A A . 24 GLU HB3 1 1 1 366 1 1 24 GLU HE2 H 4.273 -6.687 4.754 1.00 . A A . 24 GLU HE2 1 1 1 367 1 1 24 GLU HG2 H 6.811 -5.107 3.085 1.00 . A A . 24 GLU HG2 1 1 1 368 1 1 24 GLU HG3 H 8.073 -6.160 3.704 1.00 . A A . 24 GLU HG3 1 1 1 369 1 1 24 GLU N N 7.950 -2.501 3.471 1.00 . A A . 24 GLU N 1 1 1 370 1 1 24 GLU O O 10.946 -4.020 4.773 1.00 . A A . 24 GLU O 1 1 1 371 1 1 24 GLU OE1 O 6.419 -7.523 5.203 1.00 . A A . 24 GLU OE1 1 1 1 372 1 1 24 GLU OE2 O 4.882 -6.067 4.351 1.00 . A A . 24 GLU OE2 1 1 1 373 1 1 25 ALA C C 12.416 -3.471 2.011 1.00 . A A . 25 ALA C 1 1 1 374 1 1 25 ALA CA C 11.429 -4.690 2.077 1.00 . A A . 25 ALA CA 1 1 1 375 1 1 25 ALA CB C 11.111 -5.262 0.679 1.00 . A A . 25 ALA CB 1 1 1 376 1 1 25 ALA H H 9.271 -4.373 2.156 1.00 . A A . 25 ALA H 1 1 1 377 1 1 25 ALA HA H 11.893 -5.469 2.691 1.00 . A A . 25 ALA HA 1 1 1 378 1 1 25 ALA HB1 H 10.442 -6.142 0.732 1.00 . A A . 25 ALA HB1 1 1 1 379 1 1 25 ALA HB2 H 10.626 -4.525 0.013 1.00 . A A . 25 ALA HB2 1 1 1 380 1 1 25 ALA HB3 H 12.032 -5.599 0.169 1.00 . A A . 25 ALA HB3 1 1 1 381 1 1 25 ALA N N 10.130 -4.365 2.702 1.00 . A A . 25 ALA N 1 1 1 382 1 1 25 ALA O O 13.506 -3.561 2.579 1.00 . A A . 25 ALA O 1 1 1 383 1 1 26 TYR C C 13.239 -0.497 2.776 1.00 . A A . 26 TYR C 1 1 1 384 1 1 26 TYR CA C 12.867 -1.088 1.372 1.00 . A A . 26 TYR CA 1 1 1 385 1 1 26 TYR CB C 12.104 0.003 0.553 1.00 . A A . 26 TYR CB 1 1 1 386 1 1 26 TYR CD1 C 12.214 -1.216 -1.735 1.00 . A A . 26 TYR CD1 1 1 1 387 1 1 26 TYR CD2 C 10.614 0.559 -1.414 1.00 . A A . 26 TYR CD2 1 1 1 388 1 1 26 TYR CE1 C 11.745 -1.405 -3.033 1.00 . A A . 26 TYR CE1 1 1 1 389 1 1 26 TYR CE2 C 10.148 0.373 -2.714 1.00 . A A . 26 TYR CE2 1 1 1 390 1 1 26 TYR CG C 11.647 -0.239 -0.907 1.00 . A A . 26 TYR CG 1 1 1 391 1 1 26 TYR CZ C 10.714 -0.609 -3.521 1.00 . A A . 26 TYR CZ 1 1 1 392 1 1 26 TYR H H 11.172 -2.375 0.857 1.00 . A A . 26 TYR H 1 1 1 393 1 1 26 TYR HA H 13.821 -1.343 0.880 1.00 . A A . 26 TYR HA 1 1 1 394 1 1 26 TYR HB2 H 11.218 0.304 1.146 1.00 . A A . 26 TYR HB2 1 1 1 395 1 1 26 TYR HB3 H 12.735 0.912 0.530 1.00 . A A . 26 TYR HB3 1 1 1 396 1 1 26 TYR HD1 H 12.999 -1.854 -1.367 1.00 . A A . 26 TYR HD1 1 1 1 397 1 1 26 TYR HD2 H 10.157 1.322 -0.799 1.00 . A A . 26 TYR HD2 1 1 1 398 1 1 26 TYR HE1 H 12.186 -2.175 -3.650 1.00 . A A . 26 TYR HE1 1 1 1 399 1 1 26 TYR HE2 H 9.344 0.985 -3.097 1.00 . A A . 26 TYR HE2 1 1 1 400 1 1 26 TYR HH H 10.777 -1.463 -5.226 1.00 . A A . 26 TYR HH 1 1 1 401 1 1 26 TYR N N 12.036 -2.324 1.406 1.00 . A A . 26 TYR N 1 1 1 402 1 1 26 TYR O O 14.354 -0.001 2.923 1.00 . A A . 26 TYR O 1 1 1 403 1 1 26 TYR OH O 10.240 -0.797 -4.791 1.00 . A A . 26 TYR OH 1 1 1 404 1 1 27 ARG C C 13.702 -1.334 5.885 1.00 . A A . 27 ARG C 1 1 1 405 1 1 27 ARG CA C 12.758 -0.275 5.212 1.00 . A A . 27 ARG CA 1 1 1 406 1 1 27 ARG CB C 11.429 -0.093 5.998 1.00 . A A . 27 ARG CB 1 1 1 407 1 1 27 ARG CD C 12.170 1.964 7.469 1.00 . A A . 27 ARG CD 1 1 1 408 1 1 27 ARG CG C 11.549 0.550 7.406 1.00 . A A . 27 ARG CG 1 1 1 409 1 1 27 ARG CZ C 11.587 3.552 5.594 1.00 . A A . 27 ARG CZ 1 1 1 410 1 1 27 ARG H H 11.440 -0.945 3.553 1.00 . A A . 27 ARG H 1 1 1 411 1 1 27 ARG HA H 13.332 0.665 5.223 1.00 . A A . 27 ARG HA 1 1 1 412 1 1 27 ARG HB2 H 10.728 0.536 5.412 1.00 . A A . 27 ARG HB2 1 1 1 413 1 1 27 ARG HB3 H 10.909 -1.068 6.086 1.00 . A A . 27 ARG HB3 1 1 1 414 1 1 27 ARG HD2 H 12.255 2.256 8.534 1.00 . A A . 27 ARG HD2 1 1 1 415 1 1 27 ARG HD3 H 13.222 1.947 7.134 1.00 . A A . 27 ARG HD3 1 1 1 416 1 1 27 ARG HE H 10.454 3.294 7.204 1.00 . A A . 27 ARG HE 1 1 1 417 1 1 27 ARG HG2 H 10.547 0.574 7.876 1.00 . A A . 27 ARG HG2 1 1 1 418 1 1 27 ARG HG3 H 12.136 -0.124 8.061 1.00 . A A . 27 ARG HG3 1 1 1 419 1 1 27 ARG HH11 H 13.362 2.701 5.297 1.00 . A A . 27 ARG HH11 1 1 1 420 1 1 27 ARG HH12 H 12.754 3.804 3.980 1.00 . A A . 27 ARG HH12 1 1 1 421 1 1 27 ARG HH21 H 9.864 4.532 5.676 1.00 . A A . 27 ARG HH21 1 1 1 422 1 1 27 ARG HH22 H 10.907 4.804 4.208 1.00 . A A . 27 ARG HH22 1 1 1 423 1 1 27 ARG N N 12.367 -0.566 3.803 1.00 . A A . 27 ARG N 1 1 1 424 1 1 27 ARG NE N 11.330 2.981 6.774 1.00 . A A . 27 ARG NE 1 1 1 425 1 1 27 ARG NH1 N 12.667 3.336 4.883 1.00 . A A . 27 ARG NH1 1 1 1 426 1 1 27 ARG NH2 N 10.706 4.383 5.117 1.00 . A A . 27 ARG NH2 1 1 1 427 1 1 27 ARG O O 14.452 -0.949 6.786 1.00 . A A . 27 ARG O 1 1 1 428 1 1 28 ARG C C 16.261 -3.149 5.302 1.00 . A A . 28 ARG C 1 1 1 429 1 1 28 ARG CA C 14.827 -3.556 5.816 1.00 . A A . 28 ARG CA 1 1 1 430 1 1 28 ARG CB C 14.389 -4.952 5.275 1.00 . A A . 28 ARG CB 1 1 1 431 1 1 28 ARG CD C 15.711 -6.398 6.998 1.00 . A A . 28 ARG CD 1 1 1 432 1 1 28 ARG CG C 15.360 -6.138 5.516 1.00 . A A . 28 ARG CG 1 1 1 433 1 1 28 ARG CZ C 18.124 -7.093 7.080 1.00 . A A . 28 ARG CZ 1 1 1 434 1 1 28 ARG H H 13.178 -2.829 4.631 1.00 . A A . 28 ARG H 1 1 1 435 1 1 28 ARG HA H 14.859 -3.568 6.907 1.00 . A A . 28 ARG HA 1 1 1 436 1 1 28 ARG HB2 H 13.403 -5.217 5.707 1.00 . A A . 28 ARG HB2 1 1 1 437 1 1 28 ARG HB3 H 14.207 -4.887 4.184 1.00 . A A . 28 ARG HB3 1 1 1 438 1 1 28 ARG HD2 H 15.957 -5.462 7.538 1.00 . A A . 28 ARG HD2 1 1 1 439 1 1 28 ARG HD3 H 14.813 -6.779 7.524 1.00 . A A . 28 ARG HD3 1 1 1 440 1 1 28 ARG HE H 16.619 -8.370 7.314 1.00 . A A . 28 ARG HE 1 1 1 441 1 1 28 ARG HG2 H 14.927 -7.058 5.074 1.00 . A A . 28 ARG HG2 1 1 1 442 1 1 28 ARG HG3 H 16.283 -5.965 4.929 1.00 . A A . 28 ARG HG3 1 1 1 443 1 1 28 ARG HH11 H 17.910 -5.159 6.638 1.00 . A A . 28 ARG HH11 1 1 1 444 1 1 28 ARG HH12 H 19.618 -5.776 6.816 1.00 . A A . 28 ARG HH12 1 1 1 445 1 1 28 ARG HH21 H 18.585 -8.985 7.476 1.00 . A A . 28 ARG HH21 1 1 1 446 1 1 28 ARG HH22 H 19.965 -7.821 7.247 1.00 . A A . 28 ARG HH22 1 1 1 447 1 1 28 ARG N N 13.744 -2.613 5.451 1.00 . A A . 28 ARG N 1 1 1 448 1 1 28 ARG NE N 16.820 -7.384 7.125 1.00 . A A . 28 ARG NE 1 1 1 449 1 1 28 ARG NH1 N 18.605 -5.895 6.836 1.00 . A A . 28 ARG NH1 1 1 1 450 1 1 28 ARG NH2 N 18.973 -8.059 7.284 1.00 . A A . 28 ARG NH2 1 1 1 451 1 1 28 ARG O O 17.245 -3.461 5.979 1.00 . A A . 28 ARG O 1 1 1 452 1 1 29 TYR C C 17.629 -0.388 3.364 1.00 . A A . 29 TYR C 1 1 1 453 1 1 29 TYR CA C 17.659 -1.948 3.600 1.00 . A A . 29 TYR CA 1 1 1 454 1 1 29 TYR CB C 18.012 -2.763 2.308 1.00 . A A . 29 TYR CB 1 1 1 455 1 1 29 TYR CD1 C 16.585 -2.243 0.250 1.00 . A A . 29 TYR CD1 1 1 1 456 1 1 29 TYR CD2 C 16.345 -4.403 1.305 1.00 . A A . 29 TYR CD2 1 1 1 457 1 1 29 TYR CE1 C 15.645 -2.612 -0.709 1.00 . A A . 29 TYR CE1 1 1 1 458 1 1 29 TYR CE2 C 15.397 -4.765 0.352 1.00 . A A . 29 TYR CE2 1 1 1 459 1 1 29 TYR CG C 16.943 -3.138 1.261 1.00 . A A . 29 TYR CG 1 1 1 460 1 1 29 TYR CZ C 15.051 -3.871 -0.659 1.00 . A A . 29 TYR CZ 1 1 1 461 1 1 29 TYR H H 15.484 -2.359 3.640 1.00 . A A . 29 TYR H 1 1 1 462 1 1 29 TYR HA H 18.486 -2.091 4.324 1.00 . A A . 29 TYR HA 1 1 1 463 1 1 29 TYR HB2 H 18.794 -2.219 1.755 1.00 . A A . 29 TYR HB2 1 1 1 464 1 1 29 TYR HB3 H 18.528 -3.687 2.631 1.00 . A A . 29 TYR HB3 1 1 1 465 1 1 29 TYR HD1 H 17.032 -1.259 0.208 1.00 . A A . 29 TYR HD1 1 1 1 466 1 1 29 TYR HD2 H 16.597 -5.099 2.092 1.00 . A A . 29 TYR HD2 1 1 1 467 1 1 29 TYR HE1 H 15.353 -1.904 -1.468 1.00 . A A . 29 TYR HE1 1 1 1 468 1 1 29 TYR HE2 H 14.904 -5.722 0.441 1.00 . A A . 29 TYR HE2 1 1 1 469 1 1 29 TYR HH H 13.915 -5.152 -1.495 1.00 . A A . 29 TYR HH 1 1 1 470 1 1 29 TYR N N 16.377 -2.495 4.133 1.00 . A A . 29 TYR N 1 1 1 471 1 1 29 TYR O O 18.253 0.116 2.425 1.00 . A A . 29 TYR O 1 1 1 472 1 1 29 TYR OH O 14.109 -4.218 -1.590 1.00 . A A . 29 TYR OH 1 1 1 473 1 1 30 THR C C 16.449 2.368 5.644 1.00 . A A . 30 THR C 1 1 1 474 1 1 30 THR CA C 17.135 1.899 4.299 1.00 . A A . 30 THR CA 1 1 1 475 1 1 30 THR CB C 16.474 2.653 3.103 1.00 . A A . 30 THR CB 1 1 1 476 1 1 30 THR CG2 C 16.740 4.169 3.093 1.00 . A A . 30 THR CG2 1 1 1 477 1 1 30 THR H H 16.417 -0.113 4.922 1.00 . A A . 30 THR H 1 1 1 478 1 1 30 THR HA H 18.210 2.148 4.283 1.00 . A A . 30 THR HA 1 1 1 479 1 1 30 THR HB H 15.395 2.468 3.174 1.00 . A A . 30 THR HB 1 1 1 480 1 1 30 THR HG1 H 17.446 1.350 2.042 1.00 . A A . 30 THR HG1 1 1 1 481 1 1 30 THR HG21 H 17.821 4.396 3.035 1.00 . A A . 30 THR HG21 1 1 1 482 1 1 30 THR HG22 H 16.266 4.647 2.216 1.00 . A A . 30 THR HG22 1 1 1 483 1 1 30 THR HG23 H 16.341 4.676 3.991 1.00 . A A . 30 THR HG23 1 1 1 484 1 1 30 THR N N 16.998 0.408 4.253 1.00 . A A . 30 THR N 1 1 1 485 1 1 30 THR O O 15.217 2.274 5.754 1.00 . A A . 30 THR O 1 1 1 486 1 1 30 THR OG1 O 16.969 2.184 1.853 1.00 . A A . 30 THR OG1 1 1 1 487 1 1 31 PRO C C 15.933 4.748 7.992 1.00 . A A . 31 PRO C 1 1 1 488 1 1 31 PRO CA C 16.563 3.310 7.971 1.00 . A A . 31 PRO CA 1 1 1 489 1 1 31 PRO CB C 17.785 3.119 8.894 1.00 . A A . 31 PRO CB 1 1 1 490 1 1 31 PRO CD C 18.632 3.032 6.635 1.00 . A A . 31 PRO CD 1 1 1 491 1 1 31 PRO CG C 18.993 3.519 8.039 1.00 . A A . 31 PRO CG 1 1 1 492 1 1 31 PRO HA H 15.767 2.606 8.285 1.00 . A A . 31 PRO HA 1 1 1 493 1 1 31 PRO HB2 H 17.719 3.701 9.833 1.00 . A A . 31 PRO HB2 1 1 1 494 1 1 31 PRO HB3 H 17.870 2.056 9.195 1.00 . A A . 31 PRO HB3 1 1 1 495 1 1 31 PRO HD2 H 18.943 3.738 5.838 1.00 . A A . 31 PRO HD2 1 1 1 496 1 1 31 PRO HD3 H 19.076 2.042 6.410 1.00 . A A . 31 PRO HD3 1 1 1 497 1 1 31 PRO HG2 H 19.107 4.621 8.041 1.00 . A A . 31 PRO HG2 1 1 1 498 1 1 31 PRO HG3 H 19.943 3.093 8.409 1.00 . A A . 31 PRO HG3 1 1 1 499 1 1 31 PRO N N 17.166 2.917 6.664 1.00 . A A . 31 PRO N 1 1 1 500 1 1 31 PRO O O 16.418 5.656 8.670 1.00 . A A . 31 PRO O 1 1 1 501 1 1 32 TYR C C 15.015 7.286 6.349 1.00 . A A . 32 TYR C 1 1 1 502 1 1 32 TYR CA C 14.103 6.231 7.050 1.00 . A A . 32 TYR CA 1 1 1 503 1 1 32 TYR CB C 13.515 6.772 8.394 1.00 . A A . 32 TYR CB 1 1 1 504 1 1 32 TYR CD1 C 11.067 6.079 8.593 1.00 . A A . 32 TYR CD1 1 1 1 505 1 1 32 TYR CD2 C 12.686 4.994 10.021 1.00 . A A . 32 TYR CD2 1 1 1 506 1 1 32 TYR CE1 C 10.055 5.300 9.153 1.00 . A A . 32 TYR CE1 1 1 1 507 1 1 32 TYR CE2 C 11.673 4.220 10.582 1.00 . A A . 32 TYR CE2 1 1 1 508 1 1 32 TYR CG C 12.392 5.925 9.019 1.00 . A A . 32 TYR CG 1 1 1 509 1 1 32 TYR CZ C 10.360 4.368 10.141 1.00 . A A . 32 TYR CZ 1 1 1 510 1 1 32 TYR H H 14.653 4.111 6.645 1.00 . A A . 32 TYR H 1 1 1 511 1 1 32 TYR HA H 13.261 6.063 6.352 1.00 . A A . 32 TYR HA 1 1 1 512 1 1 32 TYR HB2 H 14.327 6.933 9.129 1.00 . A A . 32 TYR HB2 1 1 1 513 1 1 32 TYR HB3 H 13.125 7.794 8.231 1.00 . A A . 32 TYR HB3 1 1 1 514 1 1 32 TYR HD1 H 10.818 6.805 7.833 1.00 . A A . 32 TYR HD1 1 1 1 515 1 1 32 TYR HD2 H 13.704 4.869 10.365 1.00 . A A . 32 TYR HD2 1 1 1 516 1 1 32 TYR HE1 H 9.031 5.421 8.831 1.00 . A A . 32 TYR HE1 1 1 1 517 1 1 32 TYR HE2 H 11.913 3.501 11.353 1.00 . A A . 32 TYR HE2 1 1 1 518 1 1 32 TYR HH H 9.700 3.129 11.439 1.00 . A A . 32 TYR HH 1 1 1 519 1 1 32 TYR N N 14.828 4.928 7.239 1.00 . A A . 32 TYR N 1 1 1 520 1 1 32 TYR O O 15.571 8.229 6.908 1.00 . A A . 32 TYR O 1 1 1 521 1 1 32 TYR OXT O 15.121 7.064 5.007 1.00 . A A . 32 TYR OXT 1 1 1 522 1 1 32 TYR OH O 9.363 3.595 10.671 1.00 . A A . 32 TYR OH 1 1 2 523 1 1 1 CYS C C -17.710 -16.385 -0.245 1.00 . A A . 1 CYS C 1 1 2 524 1 1 1 CYS CA C -17.384 -16.799 -1.714 1.00 . A A . 1 CYS CA 1 1 2 525 1 1 1 CYS CB C -17.023 -15.596 -2.612 1.00 . A A . 1 CYS CB 1 1 2 526 1 1 1 CYS H1 H -19.345 -16.820 -2.370 1.00 . A A . 1 CYS H1 1 1 2 527 1 1 1 CYS H2 H -18.868 -18.255 -1.752 1.00 . A A . 1 CYS H2 1 1 2 528 1 1 1 CYS HA H -16.530 -17.502 -1.732 1.00 . A A . 1 CYS HA 1 1 2 529 1 1 1 CYS HB2 H -16.824 -15.927 -3.650 1.00 . A A . 1 CYS HB2 1 1 2 530 1 1 1 CYS HB3 H -17.853 -14.867 -2.673 1.00 . A A . 1 CYS HB3 1 1 2 531 1 1 1 CYS HG H -16.133 -14.045 -1.038 1.00 . A A . 1 CYS HG 1 1 2 532 1 1 1 CYS N N -18.551 -17.469 -2.331 1.00 . A A . 1 CYS N 1 1 2 533 1 1 1 CYS O O -18.482 -15.454 0.005 1.00 . A A . 1 CYS O 1 1 2 534 1 1 1 CYS SG S -15.529 -14.752 -1.989 1.00 . A A . 1 CYS SG 1 1 2 535 1 1 2 ALA C C -16.824 -15.459 2.791 1.00 . A A . 2 ALA C 1 1 2 536 1 1 2 ALA CA C -17.349 -16.812 2.187 1.00 . A A . 2 ALA CA 1 1 2 537 1 1 2 ALA CB C -16.707 -18.009 2.919 1.00 . A A . 2 ALA CB 1 1 2 538 1 1 2 ALA H H -16.564 -17.887 0.425 1.00 . A A . 2 ALA H 1 1 2 539 1 1 2 ALA HA H -18.442 -16.821 2.374 1.00 . A A . 2 ALA HA 1 1 2 540 1 1 2 ALA HB1 H -17.115 -18.979 2.576 1.00 . A A . 2 ALA HB1 1 1 2 541 1 1 2 ALA HB2 H -15.608 -18.046 2.795 1.00 . A A . 2 ALA HB2 1 1 2 542 1 1 2 ALA HB3 H -16.905 -17.963 4.007 1.00 . A A . 2 ALA HB3 1 1 2 543 1 1 2 ALA N N -17.086 -17.063 0.737 1.00 . A A . 2 ALA N 1 1 2 544 1 1 2 ALA O O -17.354 -15.023 3.816 1.00 . A A . 2 ALA O 1 1 2 545 1 1 3 LYS C C -14.781 -12.725 1.327 1.00 . A A . 3 LYS C 1 1 2 546 1 1 3 LYS CA C -15.400 -13.426 2.584 1.00 . A A . 3 LYS CA 1 1 2 547 1 1 3 LYS CB C -14.442 -13.458 3.827 1.00 . A A . 3 LYS CB 1 1 2 548 1 1 3 LYS CD C -12.627 -15.304 3.338 1.00 . A A . 3 LYS CD 1 1 2 549 1 1 3 LYS CE C -11.376 -15.505 2.460 1.00 . A A . 3 LYS CE 1 1 2 550 1 1 3 LYS CG C -12.937 -13.825 3.690 1.00 . A A . 3 LYS CG 1 1 2 551 1 1 3 LYS H H -15.682 -15.117 1.237 1.00 . A A . 3 LYS H 1 1 2 552 1 1 3 LYS HA H -16.319 -12.882 2.855 1.00 . A A . 3 LYS HA 1 1 2 553 1 1 3 LYS HB2 H -14.477 -12.445 4.272 1.00 . A A . 3 LYS HB2 1 1 2 554 1 1 3 LYS HB3 H -14.896 -14.092 4.614 1.00 . A A . 3 LYS HB3 1 1 2 555 1 1 3 LYS HD2 H -12.498 -15.861 4.288 1.00 . A A . 3 LYS HD2 1 1 2 556 1 1 3 LYS HD3 H -13.494 -15.805 2.870 1.00 . A A . 3 LYS HD3 1 1 2 557 1 1 3 LYS HE2 H -10.520 -14.931 2.879 1.00 . A A . 3 LYS HE2 1 1 2 558 1 1 3 LYS HE3 H -11.046 -16.567 2.502 1.00 . A A . 3 LYS HE3 1 1 2 559 1 1 3 LYS HG2 H -12.465 -13.127 2.972 1.00 . A A . 3 LYS HG2 1 1 2 560 1 1 3 LYS HG3 H -12.427 -13.582 4.643 1.00 . A A . 3 LYS HG3 1 1 2 561 1 1 3 LYS HZ1 H -12.365 -14.337 1.002 1.00 . A A . 3 LYS HZ1 1 1 2 562 1 1 3 LYS HZ2 H -10.828 -14.752 0.537 1.00 . A A . 3 LYS HZ2 1 1 2 563 1 1 3 LYS HZ3 H -12.062 -15.856 0.481 1.00 . A A . 3 LYS HZ3 1 1 2 564 1 1 3 LYS N N -15.811 -14.797 2.195 1.00 . A A . 3 LYS N 1 1 2 565 1 1 3 LYS NZ N -11.663 -15.102 1.052 1.00 . A A . 3 LYS NZ 1 1 2 566 1 1 3 LYS O O -13.732 -13.138 0.811 1.00 . A A . 3 LYS O 1 1 2 567 1 1 4 VAL C C -14.025 -9.670 -0.006 1.00 . A A . 4 VAL C 1 1 2 568 1 1 4 VAL CA C -14.956 -10.897 -0.380 1.00 . A A . 4 VAL CA 1 1 2 569 1 1 4 VAL CB C -16.250 -10.536 -1.206 1.00 . A A . 4 VAL CB 1 1 2 570 1 1 4 VAL CG1 C -17.203 -9.483 -0.585 1.00 . A A . 4 VAL CG1 1 1 2 571 1 1 4 VAL CG2 C -15.924 -10.115 -2.656 1.00 . A A . 4 VAL CG2 1 1 2 572 1 1 4 VAL H H -16.308 -11.409 1.300 1.00 . A A . 4 VAL H 1 1 2 573 1 1 4 VAL HA H -14.325 -11.546 -1.018 1.00 . A A . 4 VAL HA 1 1 2 574 1 1 4 VAL HB H -16.842 -11.468 -1.313 1.00 . A A . 4 VAL HB 1 1 2 575 1 1 4 VAL HG11 H -17.527 -9.762 0.432 1.00 . A A . 4 VAL HG11 1 1 2 576 1 1 4 VAL HG12 H -16.730 -8.485 -0.511 1.00 . A A . 4 VAL HG12 1 1 2 577 1 1 4 VAL HG13 H -18.124 -9.358 -1.185 1.00 . A A . 4 VAL HG13 1 1 2 578 1 1 4 VAL HG21 H -15.314 -10.874 -3.180 1.00 . A A . 4 VAL HG21 1 1 2 579 1 1 4 VAL HG22 H -16.839 -9.975 -3.262 1.00 . A A . 4 VAL HG22 1 1 2 580 1 1 4 VAL HG23 H -15.363 -9.162 -2.700 1.00 . A A . 4 VAL HG23 1 1 2 581 1 1 4 VAL N N -15.433 -11.657 0.826 1.00 . A A . 4 VAL N 1 1 2 582 1 1 4 VAL O O -14.158 -8.556 -0.517 1.00 . A A . 4 VAL O 1 1 2 583 1 1 5 LYS C C -10.732 -9.858 1.660 1.00 . A A . 5 LYS C 1 1 2 584 1 1 5 LYS CA C -11.884 -8.969 1.097 1.00 . A A . 5 LYS CA 1 1 2 585 1 1 5 LYS CB C -12.357 -7.830 2.051 1.00 . A A . 5 LYS CB 1 1 2 586 1 1 5 LYS CD C -10.570 -6.034 1.405 1.00 . A A . 5 LYS CD 1 1 2 587 1 1 5 LYS CE C -9.680 -4.905 1.959 1.00 . A A . 5 LYS CE 1 1 2 588 1 1 5 LYS CG C -11.302 -6.799 2.530 1.00 . A A . 5 LYS CG 1 1 2 589 1 1 5 LYS H H -12.917 -10.899 1.120 1.00 . A A . 5 LYS H 1 1 2 590 1 1 5 LYS HA H -11.547 -8.514 0.144 1.00 . A A . 5 LYS HA 1 1 2 591 1 1 5 LYS HB2 H -13.187 -7.282 1.563 1.00 . A A . 5 LYS HB2 1 1 2 592 1 1 5 LYS HB3 H -12.822 -8.285 2.948 1.00 . A A . 5 LYS HB3 1 1 2 593 1 1 5 LYS HD2 H -9.962 -6.747 0.813 1.00 . A A . 5 LYS HD2 1 1 2 594 1 1 5 LYS HD3 H -11.317 -5.622 0.696 1.00 . A A . 5 LYS HD3 1 1 2 595 1 1 5 LYS HE2 H -10.306 -4.174 2.517 1.00 . A A . 5 LYS HE2 1 1 2 596 1 1 5 LYS HE3 H -8.960 -5.303 2.708 1.00 . A A . 5 LYS HE3 1 1 2 597 1 1 5 LYS HG2 H -11.814 -6.080 3.200 1.00 . A A . 5 LYS HG2 1 1 2 598 1 1 5 LYS HG3 H -10.564 -7.310 3.180 1.00 . A A . 5 LYS HG3 1 1 2 599 1 1 5 LYS HZ1 H -9.564 -4.153 -0.009 1.00 . A A . 5 LYS HZ1 1 1 2 600 1 1 5 LYS HZ2 H -8.607 -3.302 1.050 1.00 . A A . 5 LYS HZ2 1 1 2 601 1 1 5 LYS HZ3 H -8.154 -4.787 0.480 1.00 . A A . 5 LYS HZ3 1 1 2 602 1 1 5 LYS N N -13.006 -9.913 0.838 1.00 . A A . 5 LYS N 1 1 2 603 1 1 5 LYS NZ N -8.966 -4.241 0.839 1.00 . A A . 5 LYS NZ 1 1 2 604 1 1 5 LYS O O -10.485 -9.915 2.869 1.00 . A A . 5 LYS O 1 1 2 605 1 1 6 GLY C C -8.895 -12.783 0.098 1.00 . A A . 6 GLY C 1 1 2 606 1 1 6 GLY CA C -9.408 -11.880 1.230 1.00 . A A . 6 GLY CA 1 1 2 607 1 1 6 GLY H H -10.437 -10.541 -0.187 1.00 . A A . 6 GLY H 1 1 2 608 1 1 6 GLY HA2 H -8.584 -11.617 1.915 1.00 . A A . 6 GLY HA2 1 1 2 609 1 1 6 GLY HA3 H -10.117 -12.473 1.843 1.00 . A A . 6 GLY HA3 1 1 2 610 1 1 6 GLY N N -10.105 -10.654 0.777 1.00 . A A . 6 GLY N 1 1 2 611 1 1 6 GLY O O -9.408 -13.892 -0.082 1.00 . A A . 6 GLY O 1 1 2 612 1 1 7 ILE C C -5.708 -13.337 -1.147 1.00 . A A . 7 ILE C 1 1 2 613 1 1 7 ILE CA C -7.164 -13.100 -1.680 1.00 . A A . 7 ILE CA 1 1 2 614 1 1 7 ILE CB C -7.204 -12.333 -3.057 1.00 . A A . 7 ILE CB 1 1 2 615 1 1 7 ILE CD1 C -9.612 -13.247 -3.753 1.00 . A A . 7 ILE CD1 1 1 2 616 1 1 7 ILE CG1 C -8.648 -12.053 -3.589 1.00 . A A . 7 ILE CG1 1 1 2 617 1 1 7 ILE CG2 C -6.436 -13.098 -4.169 1.00 . A A . 7 ILE CG2 1 1 2 618 1 1 7 ILE H H -7.552 -11.377 -0.351 1.00 . A A . 7 ILE H 1 1 2 619 1 1 7 ILE HA H -7.653 -14.085 -1.826 1.00 . A A . 7 ILE HA 1 1 2 620 1 1 7 ILE HB H -6.721 -11.351 -2.924 1.00 . A A . 7 ILE HB 1 1 2 621 1 1 7 ILE HD11 H -9.224 -14.004 -4.459 1.00 . A A . 7 ILE HD11 1 1 2 622 1 1 7 ILE HD12 H -9.806 -13.757 -2.792 1.00 . A A . 7 ILE HD12 1 1 2 623 1 1 7 ILE HD13 H -10.593 -12.916 -4.141 1.00 . A A . 7 ILE HD13 1 1 2 624 1 1 7 ILE HG12 H -9.132 -11.315 -2.922 1.00 . A A . 7 ILE HG12 1 1 2 625 1 1 7 ILE HG13 H -8.582 -11.519 -4.557 1.00 . A A . 7 ILE HG13 1 1 2 626 1 1 7 ILE HG21 H -6.824 -14.121 -4.328 1.00 . A A . 7 ILE HG21 1 1 2 627 1 1 7 ILE HG22 H -6.496 -12.575 -5.143 1.00 . A A . 7 ILE HG22 1 1 2 628 1 1 7 ILE HG23 H -5.358 -13.188 -3.946 1.00 . A A . 7 ILE HG23 1 1 2 629 1 1 7 ILE N N -7.876 -12.310 -0.628 1.00 . A A . 7 ILE N 1 1 2 630 1 1 7 ILE O O -5.046 -12.420 -0.646 1.00 . A A . 7 ILE O 1 1 2 631 1 1 8 THR C C -2.649 -14.230 -0.782 1.00 . A A . 8 THR C 1 1 2 632 1 1 8 THR CA C -3.969 -15.070 -0.583 1.00 . A A . 8 THR CA 1 1 2 633 1 1 8 THR CB C -3.767 -16.551 -1.060 1.00 . A A . 8 THR CB 1 1 2 634 1 1 8 THR CG2 C -2.691 -17.330 -0.281 1.00 . A A . 8 THR CG2 1 1 2 635 1 1 8 THR H H -5.860 -15.265 -1.671 1.00 . A A . 8 THR H 1 1 2 636 1 1 8 THR HA H -4.162 -15.067 0.508 1.00 . A A . 8 THR HA 1 1 2 637 1 1 8 THR HB H -3.506 -16.537 -2.138 1.00 . A A . 8 THR HB 1 1 2 638 1 1 8 THR HG1 H -4.664 -18.225 -0.758 1.00 . A A . 8 THR HG1 1 1 2 639 1 1 8 THR HG21 H -2.915 -17.370 0.802 1.00 . A A . 8 THR HG21 1 1 2 640 1 1 8 THR HG22 H -2.591 -18.372 -0.639 1.00 . A A . 8 THR HG22 1 1 2 641 1 1 8 THR HG23 H -1.691 -16.870 -0.387 1.00 . A A . 8 THR HG23 1 1 2 642 1 1 8 THR N N -5.204 -14.577 -1.285 1.00 . A A . 8 THR N 1 1 2 643 1 1 8 THR O O -1.806 -14.241 0.121 1.00 . A A . 8 THR O 1 1 2 644 1 1 8 THR OG1 O -4.956 -17.317 -0.873 1.00 . A A . 8 THR OG1 1 1 2 645 1 1 9 GLN C C -1.992 -11.177 -2.708 1.00 . A A . 9 GLN C 1 1 2 646 1 1 9 GLN CA C -1.412 -12.450 -2.003 1.00 . A A . 9 GLN CA 1 1 2 647 1 1 9 GLN CB C -0.172 -13.072 -2.731 1.00 . A A . 9 GLN CB 1 1 2 648 1 1 9 GLN CD C 1.477 -13.036 -0.716 1.00 . A A . 9 GLN CD 1 1 2 649 1 1 9 GLN CG C 0.826 -13.857 -1.840 1.00 . A A . 9 GLN CG 1 1 2 650 1 1 9 GLN H H -3.345 -13.219 -2.336 1.00 . A A . 9 GLN H 1 1 2 651 1 1 9 GLN HA H -1.140 -12.102 -0.995 1.00 . A A . 9 GLN HA 1 1 2 652 1 1 9 GLN HB2 H -0.503 -13.721 -3.566 1.00 . A A . 9 GLN HB2 1 1 2 653 1 1 9 GLN HB3 H 0.412 -12.288 -3.245 1.00 . A A . 9 GLN HB3 1 1 2 654 1 1 9 GLN HE21 H 0.214 -13.813 0.605 1.00 . A A . 9 GLN HE21 1 1 2 655 1 1 9 GLN HE22 H 1.507 -12.649 1.220 1.00 . A A . 9 GLN HE22 1 1 2 656 1 1 9 GLN HG2 H 0.336 -14.766 -1.436 1.00 . A A . 9 GLN HG2 1 1 2 657 1 1 9 GLN HG3 H 1.644 -14.247 -2.473 1.00 . A A . 9 GLN HG3 1 1 2 658 1 1 9 GLN N N -2.459 -13.500 -1.902 1.00 . A A . 9 GLN N 1 1 2 659 1 1 9 GLN NE2 N 1.068 -13.245 0.513 1.00 . A A . 9 GLN NE2 1 1 2 660 1 1 9 GLN O O -1.328 -10.564 -3.553 1.00 . A A . 9 GLN O 1 1 2 661 1 1 9 GLN OE1 O 2.318 -12.168 -0.940 1.00 . A A . 9 GLN OE1 1 1 2 662 1 1 10 GLY C C -5.265 -9.093 -2.567 1.00 . A A . 10 GLY C 1 1 2 663 1 1 10 GLY CA C -3.963 -9.747 -3.122 1.00 . A A . 10 GLY CA 1 1 2 664 1 1 10 GLY H H -3.664 -11.311 -1.597 1.00 . A A . 10 GLY H 1 1 2 665 1 1 10 GLY HA2 H -3.284 -8.942 -3.433 1.00 . A A . 10 GLY HA2 1 1 2 666 1 1 10 GLY HA3 H -4.241 -10.275 -4.057 1.00 . A A . 10 GLY HA3 1 1 2 667 1 1 10 GLY N N -3.210 -10.736 -2.325 1.00 . A A . 10 GLY N 1 1 2 668 1 1 10 GLY O O -6.164 -8.929 -3.399 1.00 . A A . 10 GLY O 1 1 2 669 1 1 11 PRO C C -6.941 -6.532 -1.270 1.00 . A A . 11 PRO C 1 1 2 670 1 1 11 PRO CA C -6.740 -8.028 -0.822 1.00 . A A . 11 PRO CA 1 1 2 671 1 1 11 PRO CB C -6.621 -8.230 0.706 1.00 . A A . 11 PRO CB 1 1 2 672 1 1 11 PRO CD C -4.499 -8.890 -0.186 1.00 . A A . 11 PRO CD 1 1 2 673 1 1 11 PRO CG C -5.118 -8.138 0.991 1.00 . A A . 11 PRO CG 1 1 2 674 1 1 11 PRO HA H -7.619 -8.594 -1.192 1.00 . A A . 11 PRO HA 1 1 2 675 1 1 11 PRO HB2 H -7.211 -7.505 1.298 1.00 . A A . 11 PRO HB2 1 1 2 676 1 1 11 PRO HB3 H -6.997 -9.233 0.990 1.00 . A A . 11 PRO HB3 1 1 2 677 1 1 11 PRO HD2 H -3.474 -8.549 -0.428 1.00 . A A . 11 PRO HD2 1 1 2 678 1 1 11 PRO HD3 H -4.440 -9.971 0.052 1.00 . A A . 11 PRO HD3 1 1 2 679 1 1 11 PRO HG2 H -4.786 -7.080 0.992 1.00 . A A . 11 PRO HG2 1 1 2 680 1 1 11 PRO HG3 H -4.836 -8.570 1.970 1.00 . A A . 11 PRO HG3 1 1 2 681 1 1 11 PRO N N -5.459 -8.654 -1.284 1.00 . A A . 11 PRO N 1 1 2 682 1 1 11 PRO O O -6.930 -5.601 -0.457 1.00 . A A . 11 PRO O 1 1 2 683 1 1 12 ASN C C -5.597 -4.408 -3.179 1.00 . A A . 12 ASN C 1 1 2 684 1 1 12 ASN CA C -7.051 -5.001 -3.293 1.00 . A A . 12 ASN CA 1 1 2 685 1 1 12 ASN CB C -8.110 -3.966 -2.789 1.00 . A A . 12 ASN CB 1 1 2 686 1 1 12 ASN CG C -9.585 -4.381 -2.730 1.00 . A A . 12 ASN CG 1 1 2 687 1 1 12 ASN H H -7.050 -7.216 -3.104 1.00 . A A . 12 ASN H 1 1 2 688 1 1 12 ASN HA H -7.242 -5.176 -4.369 1.00 . A A . 12 ASN HA 1 1 2 689 1 1 12 ASN HB2 H -7.828 -3.613 -1.782 1.00 . A A . 12 ASN HB2 1 1 2 690 1 1 12 ASN HB3 H -8.045 -3.052 -3.409 1.00 . A A . 12 ASN HB3 1 1 2 691 1 1 12 ASN HD21 H -9.680 -4.657 -4.711 1.00 . A A . 12 ASN HD21 1 1 2 692 1 1 12 ASN HD22 H -11.202 -4.926 -3.712 1.00 . A A . 12 ASN HD22 1 1 2 693 1 1 12 ASN N N -7.144 -6.327 -2.587 1.00 . A A . 12 ASN N 1 1 2 694 1 1 12 ASN ND2 N -10.219 -4.668 -3.841 1.00 . A A . 12 ASN ND2 1 1 2 695 1 1 12 ASN O O -5.319 -3.525 -2.359 1.00 . A A . 12 ASN O 1 1 2 696 1 1 12 ASN OD1 O -10.191 -4.420 -1.662 1.00 . A A . 12 ASN OD1 1 1 2 697 1 1 13 GLU C C -2.623 -3.369 -4.615 1.00 . A A . 13 GLU C 1 1 2 698 1 1 13 GLU CA C -3.204 -4.596 -3.837 1.00 . A A . 13 GLU CA 1 1 2 699 1 1 13 GLU CB C -2.442 -5.906 -4.188 1.00 . A A . 13 GLU CB 1 1 2 700 1 1 13 GLU CD C -1.580 -7.651 -5.929 1.00 . A A . 13 GLU CD 1 1 2 701 1 1 13 GLU CG C -2.430 -6.406 -5.662 1.00 . A A . 13 GLU CG 1 1 2 702 1 1 13 GLU H H -4.967 -5.728 -4.534 1.00 . A A . 13 GLU H 1 1 2 703 1 1 13 GLU HA H -3.012 -4.331 -2.780 1.00 . A A . 13 GLU HA 1 1 2 704 1 1 13 GLU HB2 H -1.395 -5.768 -3.873 1.00 . A A . 13 GLU HB2 1 1 2 705 1 1 13 GLU HB3 H -2.804 -6.716 -3.528 1.00 . A A . 13 GLU HB3 1 1 2 706 1 1 13 GLU HE2 H -1.265 -8.941 -7.298 1.00 . A A . 13 GLU HE2 1 1 2 707 1 1 13 GLU HG2 H -3.461 -6.616 -5.999 1.00 . A A . 13 GLU HG2 1 1 2 708 1 1 13 GLU HG3 H -2.058 -5.609 -6.331 1.00 . A A . 13 GLU HG3 1 1 2 709 1 1 13 GLU N N -4.660 -4.905 -4.008 1.00 . A A . 13 GLU N 1 1 2 710 1 1 13 GLU O O -1.598 -2.835 -4.174 1.00 . A A . 13 GLU O 1 1 2 711 1 1 13 GLU OE1 O -0.763 -8.124 -5.143 1.00 . A A . 13 GLU OE1 1 1 2 712 1 1 13 GLU OE2 O -1.827 -8.176 -7.160 1.00 . A A . 13 GLU OE2 1 1 2 713 1 1 14 SER C C -3.094 -0.323 -5.497 1.00 . A A . 14 SER C 1 1 2 714 1 1 14 SER CA C -2.909 -1.622 -6.378 1.00 . A A . 14 SER CA 1 1 2 715 1 1 14 SER CB C -3.736 -1.559 -7.691 1.00 . A A . 14 SER CB 1 1 2 716 1 1 14 SER H H -4.114 -3.410 -5.945 1.00 . A A . 14 SER H 1 1 2 717 1 1 14 SER HA H -1.834 -1.641 -6.647 1.00 . A A . 14 SER HA 1 1 2 718 1 1 14 SER HB2 H -3.497 -0.622 -8.231 1.00 . A A . 14 SER HB2 1 1 2 719 1 1 14 SER HB3 H -3.408 -2.371 -8.369 1.00 . A A . 14 SER HB3 1 1 2 720 1 1 14 SER HG H -5.567 -1.522 -8.355 1.00 . A A . 14 SER HG 1 1 2 721 1 1 14 SER N N -3.251 -2.909 -5.713 1.00 . A A . 14 SER N 1 1 2 722 1 1 14 SER O O -2.181 0.502 -5.606 1.00 . A A . 14 SER O 1 1 2 723 1 1 14 SER OG O -5.150 -1.651 -7.496 1.00 . A A . 14 SER OG 1 1 2 724 1 1 15 PRO C C -2.942 0.992 -2.564 1.00 . A A . 15 PRO C 1 1 2 725 1 1 15 PRO CA C -4.059 1.091 -3.660 1.00 . A A . 15 PRO CA 1 1 2 726 1 1 15 PRO CB C -5.499 1.132 -3.100 1.00 . A A . 15 PRO CB 1 1 2 727 1 1 15 PRO CD C -5.399 -0.778 -4.566 1.00 . A A . 15 PRO CD 1 1 2 728 1 1 15 PRO CG C -6.052 -0.282 -3.276 1.00 . A A . 15 PRO CG 1 1 2 729 1 1 15 PRO HA H -3.859 2.029 -4.214 1.00 . A A . 15 PRO HA 1 1 2 730 1 1 15 PRO HB2 H -5.556 1.482 -2.051 1.00 . A A . 15 PRO HB2 1 1 2 731 1 1 15 PRO HB3 H -6.105 1.844 -3.693 1.00 . A A . 15 PRO HB3 1 1 2 732 1 1 15 PRO HD2 H -5.306 -1.876 -4.555 1.00 . A A . 15 PRO HD2 1 1 2 733 1 1 15 PRO HD3 H -6.017 -0.503 -5.443 1.00 . A A . 15 PRO HD3 1 1 2 734 1 1 15 PRO HG2 H -5.748 -0.921 -2.424 1.00 . A A . 15 PRO HG2 1 1 2 735 1 1 15 PRO HG3 H -7.157 -0.309 -3.320 1.00 . A A . 15 PRO HG3 1 1 2 736 1 1 15 PRO N N -4.109 -0.061 -4.607 1.00 . A A . 15 PRO N 1 1 2 737 1 1 15 PRO O O -2.149 1.934 -2.459 1.00 . A A . 15 PRO O 1 1 2 738 1 1 16 SER C C -1.798 -1.754 -0.186 1.00 . A A . 16 SER C 1 1 2 739 1 1 16 SER CA C -1.731 -0.314 -0.803 1.00 . A A . 16 SER CA 1 1 2 740 1 1 16 SER CB C -1.730 0.765 0.320 1.00 . A A . 16 SER CB 1 1 2 741 1 1 16 SER H H -3.422 -0.879 -2.074 1.00 . A A . 16 SER H 1 1 2 742 1 1 16 SER HA H -0.788 -0.243 -1.369 1.00 . A A . 16 SER HA 1 1 2 743 1 1 16 SER HB2 H -2.749 0.921 0.724 1.00 . A A . 16 SER HB2 1 1 2 744 1 1 16 SER HB3 H -1.119 0.445 1.182 1.00 . A A . 16 SER HB3 1 1 2 745 1 1 16 SER HG H -1.557 2.108 -1.068 1.00 . A A . 16 SER HG 1 1 2 746 1 1 16 SER N N -2.857 -0.090 -1.754 1.00 . A A . 16 SER N 1 1 2 747 1 1 16 SER O O -2.262 -1.960 0.938 1.00 . A A . 16 SER O 1 1 2 748 1 1 16 SER OG O -1.195 1.996 -0.162 1.00 . A A . 16 SER OG 1 1 2 749 1 1 17 ALA C C 0.422 -4.673 -1.035 1.00 . A A . 17 ALA C 1 1 2 750 1 1 17 ALA CA C -0.806 -4.046 -0.288 1.00 . A A . 17 ALA CA 1 1 2 751 1 1 17 ALA CB C -1.982 -5.049 -0.249 1.00 . A A . 17 ALA CB 1 1 2 752 1 1 17 ALA H H -1.055 -2.489 -1.876 1.00 . A A . 17 ALA H 1 1 2 753 1 1 17 ALA HA H -0.473 -3.865 0.759 1.00 . A A . 17 ALA HA 1 1 2 754 1 1 17 ALA HB1 H -2.920 -4.578 0.107 1.00 . A A . 17 ALA HB1 1 1 2 755 1 1 17 ALA HB2 H -2.198 -5.520 -1.221 1.00 . A A . 17 ALA HB2 1 1 2 756 1 1 17 ALA HB3 H -1.767 -5.876 0.454 1.00 . A A . 17 ALA HB3 1 1 2 757 1 1 17 ALA N N -1.250 -2.752 -0.904 1.00 . A A . 17 ALA N 1 1 2 758 1 1 17 ALA O O 1.297 -5.240 -0.372 1.00 . A A . 17 ALA O 1 1 2 759 1 1 18 PHE C C 2.839 -3.615 -2.883 1.00 . A A . 18 PHE C 1 1 2 760 1 1 18 PHE CA C 1.846 -4.812 -3.086 1.00 . A A . 18 PHE CA 1 1 2 761 1 1 18 PHE CB C 1.557 -5.088 -4.590 1.00 . A A . 18 PHE CB 1 1 2 762 1 1 18 PHE CD1 C 2.979 -7.087 -5.280 1.00 . A A . 18 PHE CD1 1 1 2 763 1 1 18 PHE CD2 C 3.675 -4.890 -6.003 1.00 . A A . 18 PHE CD2 1 1 2 764 1 1 18 PHE CE1 C 4.106 -7.642 -5.882 1.00 . A A . 18 PHE CE1 1 1 2 765 1 1 18 PHE CE2 C 4.801 -5.446 -6.605 1.00 . A A . 18 PHE CE2 1 1 2 766 1 1 18 PHE CG C 2.759 -5.705 -5.330 1.00 . A A . 18 PHE CG 1 1 2 767 1 1 18 PHE CZ C 5.016 -6.821 -6.543 1.00 . A A . 18 PHE CZ 1 1 2 768 1 1 18 PHE H H -0.241 -4.114 -2.845 1.00 . A A . 18 PHE H 1 1 2 769 1 1 18 PHE HA H 2.353 -5.693 -2.659 1.00 . A A . 18 PHE HA 1 1 2 770 1 1 18 PHE HB2 H 0.708 -5.787 -4.700 1.00 . A A . 18 PHE HB2 1 1 2 771 1 1 18 PHE HB3 H 1.211 -4.168 -5.101 1.00 . A A . 18 PHE HB3 1 1 2 772 1 1 18 PHE HD1 H 2.285 -7.734 -4.764 1.00 . A A . 18 PHE HD1 1 1 2 773 1 1 18 PHE HD2 H 3.532 -3.820 -6.041 1.00 . A A . 18 PHE HD2 1 1 2 774 1 1 18 PHE HE1 H 4.276 -8.708 -5.834 1.00 . A A . 18 PHE HE1 1 1 2 775 1 1 18 PHE HE2 H 5.513 -4.812 -7.114 1.00 . A A . 18 PHE HE2 1 1 2 776 1 1 18 PHE HZ H 5.891 -7.252 -7.009 1.00 . A A . 18 PHE HZ 1 1 2 777 1 1 18 PHE N N 0.535 -4.609 -2.385 1.00 . A A . 18 PHE N 1 1 2 778 1 1 18 PHE O O 4.013 -3.850 -2.590 1.00 . A A . 18 PHE O 1 1 2 779 1 1 19 LEU C C 3.616 -1.293 -0.979 1.00 . A A . 19 LEU C 1 1 2 780 1 1 19 LEU CA C 3.105 -1.157 -2.462 1.00 . A A . 19 LEU CA 1 1 2 781 1 1 19 LEU CB C 2.156 0.073 -2.621 1.00 . A A . 19 LEU CB 1 1 2 782 1 1 19 LEU CD1 C 1.145 -0.171 -5.001 1.00 . A A . 19 LEU CD1 1 1 2 783 1 1 19 LEU CD2 C 1.335 2.078 -3.938 1.00 . A A . 19 LEU CD2 1 1 2 784 1 1 19 LEU CG C 1.991 0.689 -4.040 1.00 . A A . 19 LEU CG 1 1 2 785 1 1 19 LEU H H 1.376 -2.314 -3.218 1.00 . A A . 19 LEU H 1 1 2 786 1 1 19 LEU HA H 4.006 -1.002 -3.086 1.00 . A A . 19 LEU HA 1 1 2 787 1 1 19 LEU HB2 H 1.161 -0.155 -2.203 1.00 . A A . 19 LEU HB2 1 1 2 788 1 1 19 LEU HB3 H 2.523 0.875 -1.954 1.00 . A A . 19 LEU HB3 1 1 2 789 1 1 19 LEU HD11 H 0.150 -0.412 -4.580 1.00 . A A . 19 LEU HD11 1 1 2 790 1 1 19 LEU HD12 H 0.966 0.341 -5.965 1.00 . A A . 19 LEU HD12 1 1 2 791 1 1 19 LEU HD13 H 1.642 -1.125 -5.251 1.00 . A A . 19 LEU HD13 1 1 2 792 1 1 19 LEU HD21 H 1.923 2.770 -3.307 1.00 . A A . 19 LEU HD21 1 1 2 793 1 1 19 LEU HD22 H 1.241 2.561 -4.928 1.00 . A A . 19 LEU HD22 1 1 2 794 1 1 19 LEU HD23 H 0.316 2.029 -3.509 1.00 . A A . 19 LEU HD23 1 1 2 795 1 1 19 LEU HG H 2.996 0.826 -4.486 1.00 . A A . 19 LEU HG 1 1 2 796 1 1 19 LEU N N 2.364 -2.357 -2.955 1.00 . A A . 19 LEU N 1 1 2 797 1 1 19 LEU O O 4.791 -1.032 -0.732 1.00 . A A . 19 LEU O 1 1 2 798 1 1 20 GLU C C 4.245 -3.281 1.488 1.00 . A A . 20 GLU C 1 1 2 799 1 1 20 GLU CA C 3.236 -2.091 1.363 1.00 . A A . 20 GLU CA 1 1 2 800 1 1 20 GLU CB C 1.940 -2.377 2.178 1.00 . A A . 20 GLU CB 1 1 2 801 1 1 20 GLU CD C -0.143 -1.407 3.400 1.00 . A A . 20 GLU CD 1 1 2 802 1 1 20 GLU CG C 1.165 -1.123 2.655 1.00 . A A . 20 GLU CG 1 1 2 803 1 1 20 GLU H H 1.804 -1.756 -0.248 1.00 . A A . 20 GLU H 1 1 2 804 1 1 20 GLU HA H 3.781 -1.214 1.738 1.00 . A A . 20 GLU HA 1 1 2 805 1 1 20 GLU HB2 H 1.274 -3.038 1.600 1.00 . A A . 20 GLU HB2 1 1 2 806 1 1 20 GLU HB3 H 2.157 -2.997 3.065 1.00 . A A . 20 GLU HB3 1 1 2 807 1 1 20 GLU HE2 H -1.641 -0.494 4.116 1.00 . A A . 20 GLU HE2 1 1 2 808 1 1 20 GLU HG2 H 1.806 -0.514 3.320 1.00 . A A . 20 GLU HG2 1 1 2 809 1 1 20 GLU HG3 H 0.934 -0.472 1.794 1.00 . A A . 20 GLU HG3 1 1 2 810 1 1 20 GLU N N 2.793 -1.754 -0.015 1.00 . A A . 20 GLU N 1 1 2 811 1 1 20 GLU O O 5.200 -3.141 2.256 1.00 . A A . 20 GLU O 1 1 2 812 1 1 20 GLU OE1 O -0.550 -2.524 3.709 1.00 . A A . 20 GLU OE1 1 1 2 813 1 1 20 GLU OE2 O -0.822 -0.262 3.678 1.00 . A A . 20 GLU OE2 1 1 2 814 1 1 21 ARG C C 6.565 -4.845 0.078 1.00 . A A . 21 ARG C 1 1 2 815 1 1 21 ARG CA C 5.192 -5.418 0.600 1.00 . A A . 21 ARG CA 1 1 2 816 1 1 21 ARG CB C 4.668 -6.554 -0.325 1.00 . A A . 21 ARG CB 1 1 2 817 1 1 21 ARG CD C 3.120 -8.648 -0.466 1.00 . A A . 21 ARG CD 1 1 2 818 1 1 21 ARG CG C 3.819 -7.611 0.432 1.00 . A A . 21 ARG CG 1 1 2 819 1 1 21 ARG CZ C 1.132 -8.596 -1.985 1.00 . A A . 21 ARG CZ 1 1 2 820 1 1 21 ARG H H 3.228 -4.506 0.241 1.00 . A A . 21 ARG H 1 1 2 821 1 1 21 ARG HA H 5.377 -5.823 1.600 1.00 . A A . 21 ARG HA 1 1 2 822 1 1 21 ARG HB2 H 4.118 -6.132 -1.188 1.00 . A A . 21 ARG HB2 1 1 2 823 1 1 21 ARG HB3 H 5.521 -7.087 -0.790 1.00 . A A . 21 ARG HB3 1 1 2 824 1 1 21 ARG HD2 H 3.824 -9.035 -1.233 1.00 . A A . 21 ARG HD2 1 1 2 825 1 1 21 ARG HD3 H 2.823 -9.525 0.147 1.00 . A A . 21 ARG HD3 1 1 2 826 1 1 21 ARG HE H 1.646 -7.066 -0.807 1.00 . A A . 21 ARG HE 1 1 2 827 1 1 21 ARG HG2 H 4.485 -8.150 1.135 1.00 . A A . 21 ARG HG2 1 1 2 828 1 1 21 ARG HG3 H 3.077 -7.115 1.091 1.00 . A A . 21 ARG HG3 1 1 2 829 1 1 21 ARG HH11 H 2.020 -10.366 -1.978 1.00 . A A . 21 ARG HH11 1 1 2 830 1 1 21 ARG HH12 H 0.555 -10.148 -3.072 1.00 . A A . 21 ARG HH12 1 1 2 831 1 1 21 ARG HH21 H 0.064 -6.947 -2.117 1.00 . A A . 21 ARG HH21 1 1 2 832 1 1 21 ARG HH22 H -0.380 -8.326 -3.239 1.00 . A A . 21 ARG HH22 1 1 2 833 1 1 21 ARG N N 4.111 -4.399 0.740 1.00 . A A . 21 ARG N 1 1 2 834 1 1 21 ARG NE N 1.918 -8.026 -1.078 1.00 . A A . 21 ARG NE 1 1 2 835 1 1 21 ARG NH1 N 1.297 -9.805 -2.448 1.00 . A A . 21 ARG NH1 1 1 2 836 1 1 21 ARG NH2 N 0.136 -7.911 -2.448 1.00 . A A . 21 ARG NH2 1 1 2 837 1 1 21 ARG O O 7.612 -5.244 0.595 1.00 . A A . 21 ARG O 1 1 2 838 1 1 22 LEU C C 8.228 -2.100 -0.046 1.00 . A A . 22 LEU C 1 1 2 839 1 1 22 LEU CA C 7.766 -3.069 -1.196 1.00 . A A . 22 LEU CA 1 1 2 840 1 1 22 LEU CB C 7.469 -2.264 -2.498 1.00 . A A . 22 LEU CB 1 1 2 841 1 1 22 LEU CD1 C 6.735 -2.122 -4.926 1.00 . A A . 22 LEU CD1 1 1 2 842 1 1 22 LEU CD2 C 8.406 -3.880 -4.273 1.00 . A A . 22 LEU CD2 1 1 2 843 1 1 22 LEU CG C 7.188 -3.067 -3.800 1.00 . A A . 22 LEU CG 1 1 2 844 1 1 22 LEU H H 5.675 -3.633 -1.271 1.00 . A A . 22 LEU H 1 1 2 845 1 1 22 LEU HA H 8.581 -3.773 -1.380 1.00 . A A . 22 LEU HA 1 1 2 846 1 1 22 LEU HB2 H 6.621 -1.581 -2.309 1.00 . A A . 22 LEU HB2 1 1 2 847 1 1 22 LEU HB3 H 8.321 -1.585 -2.695 1.00 . A A . 22 LEU HB3 1 1 2 848 1 1 22 LEU HD11 H 5.811 -1.579 -4.653 1.00 . A A . 22 LEU HD11 1 1 2 849 1 1 22 LEU HD12 H 7.504 -1.364 -5.172 1.00 . A A . 22 LEU HD12 1 1 2 850 1 1 22 LEU HD13 H 6.508 -2.675 -5.857 1.00 . A A . 22 LEU HD13 1 1 2 851 1 1 22 LEU HD21 H 9.284 -3.240 -4.478 1.00 . A A . 22 LEU HD21 1 1 2 852 1 1 22 LEU HD22 H 8.716 -4.630 -3.523 1.00 . A A . 22 LEU HD22 1 1 2 853 1 1 22 LEU HD23 H 8.181 -4.444 -5.198 1.00 . A A . 22 LEU HD23 1 1 2 854 1 1 22 LEU HG H 6.358 -3.778 -3.611 1.00 . A A . 22 LEU HG 1 1 2 855 1 1 22 LEU N N 6.572 -3.873 -0.857 1.00 . A A . 22 LEU N 1 1 2 856 1 1 22 LEU O O 9.440 -1.991 0.156 1.00 . A A . 22 LEU O 1 1 2 857 1 1 23 LYS C C 8.456 -1.310 3.041 1.00 . A A . 23 LYS C 1 1 2 858 1 1 23 LYS CA C 7.761 -0.547 1.863 1.00 . A A . 23 LYS CA 1 1 2 859 1 1 23 LYS CB C 6.526 0.220 2.427 1.00 . A A . 23 LYS CB 1 1 2 860 1 1 23 LYS CD C 6.730 2.507 1.188 1.00 . A A . 23 LYS CD 1 1 2 861 1 1 23 LYS CE C 6.053 3.557 0.284 1.00 . A A . 23 LYS CE 1 1 2 862 1 1 23 LYS CG C 5.848 1.282 1.524 1.00 . A A . 23 LYS CG 1 1 2 863 1 1 23 LYS H H 6.346 -1.691 0.574 1.00 . A A . 23 LYS H 1 1 2 864 1 1 23 LYS HA H 8.509 0.182 1.493 1.00 . A A . 23 LYS HA 1 1 2 865 1 1 23 LYS HB2 H 5.765 -0.516 2.750 1.00 . A A . 23 LYS HB2 1 1 2 866 1 1 23 LYS HB3 H 6.812 0.729 3.369 1.00 . A A . 23 LYS HB3 1 1 2 867 1 1 23 LYS HD2 H 7.116 2.972 2.117 1.00 . A A . 23 LYS HD2 1 1 2 868 1 1 23 LYS HD3 H 7.638 2.145 0.665 1.00 . A A . 23 LYS HD3 1 1 2 869 1 1 23 LYS HE2 H 6.835 4.229 -0.138 1.00 . A A . 23 LYS HE2 1 1 2 870 1 1 23 LYS HE3 H 5.607 3.065 -0.609 1.00 . A A . 23 LYS HE3 1 1 2 871 1 1 23 LYS HG2 H 5.505 0.809 0.587 1.00 . A A . 23 LYS HG2 1 1 2 872 1 1 23 LYS HG3 H 4.919 1.613 2.028 1.00 . A A . 23 LYS HG3 1 1 2 873 1 1 23 LYS HZ1 H 5.449 4.844 1.838 1.00 . A A . 23 LYS HZ1 1 1 2 874 1 1 23 LYS HZ2 H 4.571 5.069 0.466 1.00 . A A . 23 LYS HZ2 1 1 2 875 1 1 23 LYS HZ3 H 4.294 3.761 1.423 1.00 . A A . 23 LYS HZ3 1 1 2 876 1 1 23 LYS N N 7.336 -1.424 0.723 1.00 . A A . 23 LYS N 1 1 2 877 1 1 23 LYS NZ N 5.040 4.351 1.034 1.00 . A A . 23 LYS NZ 1 1 2 878 1 1 23 LYS O O 9.453 -0.804 3.559 1.00 . A A . 23 LYS O 1 1 2 879 1 1 24 GLU C C 9.977 -4.024 3.904 1.00 . A A . 24 GLU C 1 1 2 880 1 1 24 GLU CA C 8.660 -3.360 4.445 1.00 . A A . 24 GLU CA 1 1 2 881 1 1 24 GLU CB C 7.642 -4.407 4.991 1.00 . A A . 24 GLU CB 1 1 2 882 1 1 24 GLU CD C 7.663 -6.740 3.715 1.00 . A A . 24 GLU CD 1 1 2 883 1 1 24 GLU CG C 6.956 -5.423 4.036 1.00 . A A . 24 GLU CG 1 1 2 884 1 1 24 GLU H H 7.136 -2.820 2.967 1.00 . A A . 24 GLU H 1 1 2 885 1 1 24 GLU HA H 8.958 -2.707 5.269 1.00 . A A . 24 GLU HA 1 1 2 886 1 1 24 GLU HB2 H 8.108 -4.953 5.833 1.00 . A A . 24 GLU HB2 1 1 2 887 1 1 24 GLU HB3 H 6.833 -3.832 5.486 1.00 . A A . 24 GLU HB3 1 1 2 888 1 1 24 GLU HE2 H 7.389 -8.329 2.690 1.00 . A A . 24 GLU HE2 1 1 2 889 1 1 24 GLU HG2 H 5.970 -5.692 4.456 1.00 . A A . 24 GLU HG2 1 1 2 890 1 1 24 GLU HG3 H 6.727 -4.924 3.084 1.00 . A A . 24 GLU HG3 1 1 2 891 1 1 24 GLU N N 7.965 -2.493 3.461 1.00 . A A . 24 GLU N 1 1 2 892 1 1 24 GLU O O 10.936 -4.131 4.671 1.00 . A A . 24 GLU O 1 1 2 893 1 1 24 GLU OE1 O 8.754 -7.083 4.162 1.00 . A A . 24 GLU OE1 1 1 2 894 1 1 24 GLU OE2 O 6.926 -7.509 2.866 1.00 . A A . 24 GLU OE2 1 1 2 895 1 1 25 ALA C C 12.435 -3.676 1.931 1.00 . A A . 25 ALA C 1 1 2 896 1 1 25 ALA CA C 11.349 -4.814 1.970 1.00 . A A . 25 ALA CA 1 1 2 897 1 1 25 ALA CB C 10.978 -5.304 0.555 1.00 . A A . 25 ALA CB 1 1 2 898 1 1 25 ALA H H 9.200 -4.414 2.086 1.00 . A A . 25 ALA H 1 1 2 899 1 1 25 ALA HA H 11.760 -5.647 2.550 1.00 . A A . 25 ALA HA 1 1 2 900 1 1 25 ALA HB1 H 10.246 -6.134 0.576 1.00 . A A . 25 ALA HB1 1 1 2 901 1 1 25 ALA HB2 H 10.542 -4.501 -0.069 1.00 . A A . 25 ALA HB2 1 1 2 902 1 1 25 ALA HB3 H 11.865 -5.681 0.014 1.00 . A A . 25 ALA HB3 1 1 2 903 1 1 25 ALA N N 10.073 -4.423 2.615 1.00 . A A . 25 ALA N 1 1 2 904 1 1 25 ALA O O 13.558 -3.893 2.400 1.00 . A A . 25 ALA O 1 1 2 905 1 1 26 TYR C C 13.157 -0.610 2.917 1.00 . A A . 26 TYR C 1 1 2 906 1 1 26 TYR CA C 12.977 -1.275 1.500 1.00 . A A . 26 TYR CA 1 1 2 907 1 1 26 TYR CB C 12.404 -0.229 0.491 1.00 . A A . 26 TYR CB 1 1 2 908 1 1 26 TYR CD1 C 13.794 -0.837 -1.571 1.00 . A A . 26 TYR CD1 1 1 2 909 1 1 26 TYR CD2 C 11.417 -0.530 -1.847 1.00 . A A . 26 TYR CD2 1 1 2 910 1 1 26 TYR CE1 C 13.918 -1.107 -2.931 1.00 . A A . 26 TYR CE1 1 1 2 911 1 1 26 TYR CE2 C 11.540 -0.803 -3.207 1.00 . A A . 26 TYR CE2 1 1 2 912 1 1 26 TYR CG C 12.541 -0.556 -1.013 1.00 . A A . 26 TYR CG 1 1 2 913 1 1 26 TYR CZ C 12.791 -1.091 -3.747 1.00 . A A . 26 TYR CZ 1 1 2 914 1 1 26 TYR H H 11.214 -2.416 0.923 1.00 . A A . 26 TYR H 1 1 2 915 1 1 26 TYR HA H 13.972 -1.598 1.179 1.00 . A A . 26 TYR HA 1 1 2 916 1 1 26 TYR HB2 H 11.351 -0.003 0.754 1.00 . A A . 26 TYR HB2 1 1 2 917 1 1 26 TYR HB3 H 12.922 0.738 0.639 1.00 . A A . 26 TYR HB3 1 1 2 918 1 1 26 TYR HD1 H 14.677 -0.851 -0.951 1.00 . A A . 26 TYR HD1 1 1 2 919 1 1 26 TYR HD2 H 10.444 -0.289 -1.445 1.00 . A A . 26 TYR HD2 1 1 2 920 1 1 26 TYR HE1 H 14.887 -1.327 -3.354 1.00 . A A . 26 TYR HE1 1 1 2 921 1 1 26 TYR HE2 H 10.665 -0.781 -3.839 1.00 . A A . 26 TYR HE2 1 1 2 922 1 1 26 TYR HH H 12.065 -1.263 -5.503 1.00 . A A . 26 TYR HH 1 1 2 923 1 1 26 TYR N N 12.093 -2.465 1.442 1.00 . A A . 26 TYR N 1 1 2 924 1 1 26 TYR O O 14.009 0.271 3.053 1.00 . A A . 26 TYR O 1 1 2 925 1 1 26 TYR OH O 12.924 -1.345 -5.086 1.00 . A A . 26 TYR OH 1 1 2 926 1 1 27 ARG C C 13.406 -1.962 6.119 1.00 . A A . 27 ARG C 1 1 2 927 1 1 27 ARG CA C 12.823 -0.698 5.390 1.00 . A A . 27 ARG CA 1 1 2 928 1 1 27 ARG CB C 11.548 -0.097 6.060 1.00 . A A . 27 ARG CB 1 1 2 929 1 1 27 ARG CD C 12.429 2.236 6.873 1.00 . A A . 27 ARG CD 1 1 2 930 1 1 27 ARG CG C 11.813 0.865 7.244 1.00 . A A . 27 ARG CG 1 1 2 931 1 1 27 ARG CZ C 11.526 3.346 4.794 1.00 . A A . 27 ARG CZ 1 1 2 932 1 1 27 ARG H H 11.706 -1.696 3.751 1.00 . A A . 27 ARG H 1 1 2 933 1 1 27 ARG HA H 13.634 0.055 5.419 1.00 . A A . 27 ARG HA 1 1 2 934 1 1 27 ARG HB2 H 10.919 0.450 5.328 1.00 . A A . 27 ARG HB2 1 1 2 935 1 1 27 ARG HB3 H 10.888 -0.922 6.394 1.00 . A A . 27 ARG HB3 1 1 2 936 1 1 27 ARG HD2 H 12.687 2.762 7.816 1.00 . A A . 27 ARG HD2 1 1 2 937 1 1 27 ARG HD3 H 13.413 2.119 6.376 1.00 . A A . 27 ARG HD3 1 1 2 938 1 1 27 ARG HE H 10.752 3.625 6.598 1.00 . A A . 27 ARG HE 1 1 2 939 1 1 27 ARG HG2 H 10.864 1.031 7.789 1.00 . A A . 27 ARG HG2 1 1 2 940 1 1 27 ARG HG3 H 12.461 0.356 7.986 1.00 . A A . 27 ARG HG3 1 1 2 941 1 1 27 ARG HH11 H 12.935 2.025 4.371 1.00 . A A . 27 ARG HH11 1 1 2 942 1 1 27 ARG HH12 H 12.297 2.994 2.970 1.00 . A A . 27 ARG HH12 1 1 2 943 1 1 27 ARG HH21 H 10.047 4.664 4.957 1.00 . A A . 27 ARG HH21 1 1 2 944 1 1 27 ARG HH22 H 10.732 4.382 3.296 1.00 . A A . 27 ARG HH22 1 1 2 945 1 1 27 ARG N N 12.433 -1.006 3.981 1.00 . A A . 27 ARG N 1 1 2 946 1 1 27 ARG NE N 11.486 3.106 6.108 1.00 . A A . 27 ARG NE 1 1 2 947 1 1 27 ARG NH1 N 12.351 2.760 3.962 1.00 . A A . 27 ARG NH1 1 1 2 948 1 1 27 ARG NH2 N 10.685 4.209 4.302 1.00 . A A . 27 ARG NH2 1 1 2 949 1 1 27 ARG O O 12.960 -2.349 7.203 1.00 . A A . 27 ARG O 1 1 2 950 1 1 28 ARG C C 16.425 -4.139 5.242 1.00 . A A . 28 ARG C 1 1 2 951 1 1 28 ARG CA C 15.112 -3.812 6.037 1.00 . A A . 28 ARG CA 1 1 2 952 1 1 28 ARG CB C 14.139 -5.035 6.018 1.00 . A A . 28 ARG CB 1 1 2 953 1 1 28 ARG CD C 13.711 -7.483 6.881 1.00 . A A . 28 ARG CD 1 1 2 954 1 1 28 ARG CG C 14.719 -6.349 6.615 1.00 . A A . 28 ARG CG 1 1 2 955 1 1 28 ARG CZ C 11.840 -7.733 5.220 1.00 . A A . 28 ARG CZ 1 1 2 956 1 1 28 ARG H H 14.825 -2.089 4.715 1.00 . A A . 28 ARG H 1 1 2 957 1 1 28 ARG HA H 15.425 -3.574 7.065 1.00 . A A . 28 ARG HA 1 1 2 958 1 1 28 ARG HB2 H 13.226 -4.769 6.583 1.00 . A A . 28 ARG HB2 1 1 2 959 1 1 28 ARG HB3 H 13.783 -5.215 4.983 1.00 . A A . 28 ARG HB3 1 1 2 960 1 1 28 ARG HD2 H 14.249 -8.321 7.367 1.00 . A A . 28 ARG HD2 1 1 2 961 1 1 28 ARG HD3 H 12.975 -7.173 7.650 1.00 . A A . 28 ARG HD3 1 1 2 962 1 1 28 ARG HE H 13.596 -8.625 5.005 1.00 . A A . 28 ARG HE 1 1 2 963 1 1 28 ARG HG2 H 15.530 -6.729 5.960 1.00 . A A . 28 ARG HG2 1 1 2 964 1 1 28 ARG HG3 H 15.229 -6.114 7.570 1.00 . A A . 28 ARG HG3 1 1 2 965 1 1 28 ARG HH11 H 11.426 -6.449 6.651 1.00 . A A . 28 ARG HH11 1 1 2 966 1 1 28 ARG HH12 H 10.109 -6.763 5.408 1.00 . A A . 28 ARG HH12 1 1 2 967 1 1 28 ARG HH21 H 12.044 -8.908 3.622 1.00 . A A . 28 ARG HH21 1 1 2 968 1 1 28 ARG HH22 H 10.447 -8.035 3.869 1.00 . A A . 28 ARG HH22 1 1 2 969 1 1 28 ARG N N 14.434 -2.595 5.512 1.00 . A A . 28 ARG N 1 1 2 970 1 1 28 ARG NE N 13.080 -7.999 5.629 1.00 . A A . 28 ARG NE 1 1 2 971 1 1 28 ARG NH1 N 11.019 -6.941 5.856 1.00 . A A . 28 ARG NH1 1 1 2 972 1 1 28 ARG NH2 N 11.413 -8.281 4.123 1.00 . A A . 28 ARG NH2 1 1 2 973 1 1 28 ARG O O 17.383 -4.591 5.871 1.00 . A A . 28 ARG O 1 1 2 974 1 1 29 TYR C C 19.070 -3.508 3.550 1.00 . A A . 29 TYR C 1 1 2 975 1 1 29 TYR CA C 17.734 -4.221 3.097 1.00 . A A . 29 TYR CA 1 1 2 976 1 1 29 TYR CB C 17.358 -3.877 1.619 1.00 . A A . 29 TYR CB 1 1 2 977 1 1 29 TYR CD1 C 16.739 -1.363 1.858 1.00 . A A . 29 TYR CD1 1 1 2 978 1 1 29 TYR CD2 C 17.731 -2.147 -0.194 1.00 . A A . 29 TYR CD2 1 1 2 979 1 1 29 TYR CE1 C 16.680 -0.074 1.339 1.00 . A A . 29 TYR CE1 1 1 2 980 1 1 29 TYR CE2 C 17.659 -0.859 -0.718 1.00 . A A . 29 TYR CE2 1 1 2 981 1 1 29 TYR CG C 17.278 -2.414 1.103 1.00 . A A . 29 TYR CG 1 1 2 982 1 1 29 TYR CZ C 17.136 0.176 0.050 1.00 . A A . 29 TYR CZ 1 1 2 983 1 1 29 TYR H H 15.598 -3.738 3.454 1.00 . A A . 29 TYR H 1 1 2 984 1 1 29 TYR HA H 17.959 -5.303 3.165 1.00 . A A . 29 TYR HA 1 1 2 985 1 1 29 TYR HB2 H 18.099 -4.421 1.002 1.00 . A A . 29 TYR HB2 1 1 2 986 1 1 29 TYR HB3 H 16.408 -4.379 1.350 1.00 . A A . 29 TYR HB3 1 1 2 987 1 1 29 TYR HD1 H 16.357 -1.524 2.853 1.00 . A A . 29 TYR HD1 1 1 2 988 1 1 29 TYR HD2 H 18.139 -2.938 -0.808 1.00 . A A . 29 TYR HD2 1 1 2 989 1 1 29 TYR HE1 H 16.261 0.726 1.934 1.00 . A A . 29 TYR HE1 1 1 2 990 1 1 29 TYR HE2 H 18.000 -0.677 -1.725 1.00 . A A . 29 TYR HE2 1 1 2 991 1 1 29 TYR HH H 17.360 1.421 -1.377 1.00 . A A . 29 TYR HH 1 1 2 992 1 1 29 TYR N N 16.499 -3.952 3.903 1.00 . A A . 29 TYR N 1 1 2 993 1 1 29 TYR O O 20.143 -4.083 3.353 1.00 . A A . 29 TYR O 1 1 2 994 1 1 29 TYR OH O 17.034 1.435 -0.475 1.00 . A A . 29 TYR OH 1 1 2 995 1 1 30 THR C C 19.863 -2.189 6.531 1.00 . A A . 30 THR C 1 1 2 996 1 1 30 THR CA C 20.138 -1.802 5.025 1.00 . A A . 30 THR CA 1 1 2 997 1 1 30 THR CB C 20.299 -0.256 4.825 1.00 . A A . 30 THR CB 1 1 2 998 1 1 30 THR CG2 C 19.092 0.635 5.188 1.00 . A A . 30 THR CG2 1 1 2 999 1 1 30 THR H H 18.059 -2.044 4.401 1.00 . A A . 30 THR H 1 1 2 1000 1 1 30 THR HA H 21.091 -2.259 4.703 1.00 . A A . 30 THR HA 1 1 2 1001 1 1 30 THR HB H 20.562 -0.095 3.761 1.00 . A A . 30 THR HB 1 1 2 1002 1 1 30 THR HG1 H 20.981 0.728 6.360 1.00 . A A . 30 THR HG1 1 1 2 1003 1 1 30 THR HG21 H 18.801 0.542 6.251 1.00 . A A . 30 THR HG21 1 1 2 1004 1 1 30 THR HG22 H 19.312 1.702 5.001 1.00 . A A . 30 THR HG22 1 1 2 1005 1 1 30 THR HG23 H 18.202 0.384 4.583 1.00 . A A . 30 THR HG23 1 1 2 1006 1 1 30 THR N N 19.021 -2.319 4.181 1.00 . A A . 30 THR N 1 1 2 1007 1 1 30 THR O O 18.752 -1.924 7.011 1.00 . A A . 30 THR O 1 1 2 1008 1 1 30 THR OG1 O 21.374 0.206 5.639 1.00 . A A . 30 THR OG1 1 1 2 1009 1 1 31 PRO C C 20.390 -1.811 9.714 1.00 . A A . 31 PRO C 1 1 2 1010 1 1 31 PRO CA C 20.560 -3.062 8.779 1.00 . A A . 31 PRO CA 1 1 2 1011 1 1 31 PRO CB C 21.782 -3.935 9.136 1.00 . A A . 31 PRO CB 1 1 2 1012 1 1 31 PRO CD C 22.159 -3.163 6.877 1.00 . A A . 31 PRO CD 1 1 2 1013 1 1 31 PRO CG C 22.892 -3.496 8.178 1.00 . A A . 31 PRO CG 1 1 2 1014 1 1 31 PRO HA H 19.628 -3.650 8.889 1.00 . A A . 31 PRO HA 1 1 2 1015 1 1 31 PRO HB2 H 22.083 -3.861 10.199 1.00 . A A . 31 PRO HB2 1 1 2 1016 1 1 31 PRO HB3 H 21.539 -5.001 8.961 1.00 . A A . 31 PRO HB3 1 1 2 1017 1 1 31 PRO HD2 H 22.679 -2.356 6.325 1.00 . A A . 31 PRO HD2 1 1 2 1018 1 1 31 PRO HD3 H 22.098 -4.049 6.214 1.00 . A A . 31 PRO HD3 1 1 2 1019 1 1 31 PRO HG2 H 23.400 -2.594 8.572 1.00 . A A . 31 PRO HG2 1 1 2 1020 1 1 31 PRO HG3 H 23.671 -4.269 8.044 1.00 . A A . 31 PRO HG3 1 1 2 1021 1 1 31 PRO N N 20.808 -2.774 7.332 1.00 . A A . 31 PRO N 1 1 2 1022 1 1 31 PRO O O 19.592 -1.856 10.653 1.00 . A A . 31 PRO O 1 1 2 1023 1 1 32 TYR C C 20.455 1.644 9.015 1.00 . A A . 32 TYR C 1 1 2 1024 1 1 32 TYR CA C 20.889 0.608 10.093 1.00 . A A . 32 TYR CA 1 1 2 1025 1 1 32 TYR CB C 22.187 1.065 10.820 1.00 . A A . 32 TYR CB 1 1 2 1026 1 1 32 TYR CD1 C 22.019 0.401 13.283 1.00 . A A . 32 TYR CD1 1 1 2 1027 1 1 32 TYR CD2 C 23.577 -0.794 11.876 1.00 . A A . 32 TYR CD2 1 1 2 1028 1 1 32 TYR CE1 C 22.387 -0.396 14.366 1.00 . A A . 32 TYR CE1 1 1 2 1029 1 1 32 TYR CE2 C 23.942 -1.590 12.959 1.00 . A A . 32 TYR CE2 1 1 2 1030 1 1 32 TYR CG C 22.610 0.206 12.029 1.00 . A A . 32 TYR CG 1 1 2 1031 1 1 32 TYR CZ C 23.348 -1.390 14.202 1.00 . A A . 32 TYR CZ 1 1 2 1032 1 1 32 TYR H H 21.666 -0.817 8.587 1.00 . A A . 32 TYR H 1 1 2 1033 1 1 32 TYR HA H 20.072 0.549 10.840 1.00 . A A . 32 TYR HA 1 1 2 1034 1 1 32 TYR HB2 H 23.020 1.137 10.093 1.00 . A A . 32 TYR HB2 1 1 2 1035 1 1 32 TYR HB3 H 22.057 2.106 11.171 1.00 . A A . 32 TYR HB3 1 1 2 1036 1 1 32 TYR HD1 H 21.265 1.164 13.419 1.00 . A A . 32 TYR HD1 1 1 2 1037 1 1 32 TYR HD2 H 24.037 -0.966 10.914 1.00 . A A . 32 TYR HD2 1 1 2 1038 1 1 32 TYR HE1 H 21.922 -0.240 15.328 1.00 . A A . 32 TYR HE1 1 1 2 1039 1 1 32 TYR HE2 H 24.685 -2.365 12.839 1.00 . A A . 32 TYR HE2 1 1 2 1040 1 1 32 TYR HH H 23.198 -1.923 16.027 1.00 . A A . 32 TYR HH 1 1 2 1041 1 1 32 TYR N N 21.117 -0.712 9.446 1.00 . A A . 32 TYR N 1 1 2 1042 1 1 32 TYR O O 20.778 1.613 7.824 1.00 . A A . 32 TYR O 1 1 2 1043 1 1 32 TYR OXT O 19.661 2.624 9.536 1.00 . A A . 32 TYR OXT 1 1 2 1044 1 1 32 TYR OH O 23.712 -2.178 15.260 1.00 . A A . 32 TYR OH 1 1 3 1045 1 1 1 CYS C C 0.969 -4.627 -9.108 1.00 . A A . 1 CYS C 1 1 3 1046 1 1 1 CYS CA C -0.170 -3.588 -8.865 1.00 . A A . 1 CYS CA 1 1 3 1047 1 1 1 CYS CB C -0.327 -2.603 -10.043 1.00 . A A . 1 CYS CB 1 1 3 1048 1 1 1 CYS H1 H 0.321 -3.420 -6.859 1.00 . A A . 1 CYS H1 1 1 3 1049 1 1 1 CYS H2 H 0.952 -2.234 -7.783 1.00 . A A . 1 CYS H2 1 1 3 1050 1 1 1 CYS HA H -1.135 -4.107 -8.728 1.00 . A A . 1 CYS HA 1 1 3 1051 1 1 1 CYS HB2 H 0.588 -1.999 -10.197 1.00 . A A . 1 CYS HB2 1 1 3 1052 1 1 1 CYS HB3 H -0.487 -3.159 -10.986 1.00 . A A . 1 CYS HB3 1 1 3 1053 1 1 1 CYS HG H -1.228 -0.729 -8.839 1.00 . A A . 1 CYS HG 1 1 3 1054 1 1 1 CYS N N 0.104 -2.796 -7.644 1.00 . A A . 1 CYS N 1 1 3 1055 1 1 1 CYS O O 2.130 -4.262 -9.332 1.00 . A A . 1 CYS O 1 1 3 1056 1 1 1 CYS SG S -1.757 -1.490 -9.795 1.00 . A A . 1 CYS SG 1 1 3 1057 1 1 2 ALA C C 1.922 -7.414 -10.706 1.00 . A A . 2 ALA C 1 1 3 1058 1 1 2 ALA CA C 1.655 -7.017 -9.211 1.00 . A A . 2 ALA CA 1 1 3 1059 1 1 2 ALA CB C 1.127 -8.181 -8.346 1.00 . A A . 2 ALA CB 1 1 3 1060 1 1 2 ALA H H -0.370 -6.123 -8.994 1.00 . A A . 2 ALA H 1 1 3 1061 1 1 2 ALA HA H 2.628 -6.704 -8.780 1.00 . A A . 2 ALA HA 1 1 3 1062 1 1 2 ALA HB1 H 0.998 -7.880 -7.289 1.00 . A A . 2 ALA HB1 1 1 3 1063 1 1 2 ALA HB2 H 0.154 -8.571 -8.692 1.00 . A A . 2 ALA HB2 1 1 3 1064 1 1 2 ALA HB3 H 1.835 -9.029 -8.343 1.00 . A A . 2 ALA HB3 1 1 3 1065 1 1 2 ALA N N 0.639 -5.933 -9.079 1.00 . A A . 2 ALA N 1 1 3 1066 1 1 2 ALA O O 1.477 -8.461 -11.202 1.00 . A A . 2 ALA O 1 1 3 1067 1 1 3 LYS C C 1.735 -6.456 -13.773 1.00 . A A . 3 LYS C 1 1 3 1068 1 1 3 LYS CA C 3.011 -6.638 -12.869 1.00 . A A . 3 LYS CA 1 1 3 1069 1 1 3 LYS CB C 3.824 -7.952 -13.106 1.00 . A A . 3 LYS CB 1 1 3 1070 1 1 3 LYS CD C 5.230 -9.385 -14.715 1.00 . A A . 3 LYS CD 1 1 3 1071 1 1 3 LYS CE C 5.806 -9.519 -16.138 1.00 . A A . 3 LYS CE 1 1 3 1072 1 1 3 LYS CG C 4.441 -8.073 -14.521 1.00 . A A . 3 LYS CG 1 1 3 1073 1 1 3 LYS H H 2.844 -5.670 -10.882 1.00 . A A . 3 LYS H 1 1 3 1074 1 1 3 LYS HA H 3.658 -5.778 -13.124 1.00 . A A . 3 LYS HA 1 1 3 1075 1 1 3 LYS HB2 H 4.640 -8.004 -12.360 1.00 . A A . 3 LYS HB2 1 1 3 1076 1 1 3 LYS HB3 H 3.196 -8.838 -12.892 1.00 . A A . 3 LYS HB3 1 1 3 1077 1 1 3 LYS HD2 H 6.042 -9.432 -13.960 1.00 . A A . 3 LYS HD2 1 1 3 1078 1 1 3 LYS HD3 H 4.564 -10.242 -14.487 1.00 . A A . 3 LYS HD3 1 1 3 1079 1 1 3 LYS HE2 H 4.985 -9.461 -16.888 1.00 . A A . 3 LYS HE2 1 1 3 1080 1 1 3 LYS HE3 H 6.468 -8.652 -16.367 1.00 . A A . 3 LYS HE3 1 1 3 1081 1 1 3 LYS HG2 H 3.636 -8.003 -15.280 1.00 . A A . 3 LYS HG2 1 1 3 1082 1 1 3 LYS HG3 H 5.098 -7.200 -14.710 1.00 . A A . 3 LYS HG3 1 1 3 1083 1 1 3 LYS HZ1 H 5.956 -11.622 -16.065 1.00 . A A . 3 LYS HZ1 1 1 3 1084 1 1 3 LYS HZ2 H 6.945 -10.961 -17.200 1.00 . A A . 3 LYS HZ2 1 1 3 1085 1 1 3 LYS HZ3 H 7.336 -10.869 -15.605 1.00 . A A . 3 LYS HZ3 1 1 3 1086 1 1 3 LYS N N 2.675 -6.538 -11.411 1.00 . A A . 3 LYS N 1 1 3 1087 1 1 3 LYS NZ N 6.548 -10.804 -16.263 1.00 . A A . 3 LYS NZ 1 1 3 1088 1 1 3 LYS O O 1.522 -5.370 -14.313 1.00 . A A . 3 LYS O 1 1 3 1089 1 1 4 VAL C C -1.426 -8.031 -13.470 1.00 . A A . 4 VAL C 1 1 3 1090 1 1 4 VAL CA C -0.467 -7.376 -14.520 1.00 . A A . 4 VAL CA 1 1 3 1091 1 1 4 VAL CB C -0.525 -8.043 -15.944 1.00 . A A . 4 VAL CB 1 1 3 1092 1 1 4 VAL CG1 C -1.943 -8.037 -16.565 1.00 . A A . 4 VAL CG1 1 1 3 1093 1 1 4 VAL CG2 C 0.411 -7.375 -16.980 1.00 . A A . 4 VAL CG2 1 1 3 1094 1 1 4 VAL H H 1.134 -8.227 -13.243 1.00 . A A . 4 VAL H 1 1 3 1095 1 1 4 VAL HA H -0.756 -6.312 -14.645 1.00 . A A . 4 VAL HA 1 1 3 1096 1 1 4 VAL HB H -0.211 -9.102 -15.844 1.00 . A A . 4 VAL HB 1 1 3 1097 1 1 4 VAL HG11 H -2.674 -8.583 -15.940 1.00 . A A . 4 VAL HG11 1 1 3 1098 1 1 4 VAL HG12 H -2.335 -7.011 -16.703 1.00 . A A . 4 VAL HG12 1 1 3 1099 1 1 4 VAL HG13 H -1.963 -8.528 -17.556 1.00 . A A . 4 VAL HG13 1 1 3 1100 1 1 4 VAL HG21 H 1.467 -7.405 -16.657 1.00 . A A . 4 VAL HG21 1 1 3 1101 1 1 4 VAL HG22 H 0.372 -7.876 -17.966 1.00 . A A . 4 VAL HG22 1 1 3 1102 1 1 4 VAL HG23 H 0.158 -6.309 -17.141 1.00 . A A . 4 VAL HG23 1 1 3 1103 1 1 4 VAL N N 0.900 -7.497 -13.924 1.00 . A A . 4 VAL N 1 1 3 1104 1 1 4 VAL O O -1.649 -9.246 -13.491 1.00 . A A . 4 VAL O 1 1 3 1105 1 1 5 LYS C C -3.036 -6.354 -10.566 1.00 . A A . 5 LYS C 1 1 3 1106 1 1 5 LYS CA C -2.800 -7.663 -11.381 1.00 . A A . 5 LYS CA 1 1 3 1107 1 1 5 LYS CB C -2.175 -8.788 -10.490 1.00 . A A . 5 LYS CB 1 1 3 1108 1 1 5 LYS CD C -1.718 -11.314 -10.229 1.00 . A A . 5 LYS CD 1 1 3 1109 1 1 5 LYS CE C -0.789 -11.930 -11.300 1.00 . A A . 5 LYS CE 1 1 3 1110 1 1 5 LYS CG C -2.709 -10.223 -10.716 1.00 . A A . 5 LYS CG 1 1 3 1111 1 1 5 LYS H H -1.631 -6.242 -12.571 1.00 . A A . 5 LYS H 1 1 3 1112 1 1 5 LYS HA H -3.765 -8.017 -11.795 1.00 . A A . 5 LYS HA 1 1 3 1113 1 1 5 LYS HB2 H -1.076 -8.751 -10.598 1.00 . A A . 5 LYS HB2 1 1 3 1114 1 1 5 LYS HB3 H -2.327 -8.569 -9.414 1.00 . A A . 5 LYS HB3 1 1 3 1115 1 1 5 LYS HD2 H -1.126 -10.946 -9.366 1.00 . A A . 5 LYS HD2 1 1 3 1116 1 1 5 LYS HD3 H -2.314 -12.142 -9.794 1.00 . A A . 5 LYS HD3 1 1 3 1117 1 1 5 LYS HE2 H -0.146 -12.703 -10.825 1.00 . A A . 5 LYS HE2 1 1 3 1118 1 1 5 LYS HE3 H -1.406 -12.496 -12.033 1.00 . A A . 5 LYS HE3 1 1 3 1119 1 1 5 LYS HG2 H -3.669 -10.325 -10.170 1.00 . A A . 5 LYS HG2 1 1 3 1120 1 1 5 LYS HG3 H -2.987 -10.399 -11.773 1.00 . A A . 5 LYS HG3 1 1 3 1121 1 1 5 LYS HZ1 H 0.569 -10.282 -11.378 1.00 . A A . 5 LYS HZ1 1 1 3 1122 1 1 5 LYS HZ2 H 0.727 -11.309 -12.665 1.00 . A A . 5 LYS HZ2 1 1 3 1123 1 1 5 LYS HZ3 H -0.560 -10.277 -12.564 1.00 . A A . 5 LYS HZ3 1 1 3 1124 1 1 5 LYS N N -1.908 -7.230 -12.502 1.00 . A A . 5 LYS N 1 1 3 1125 1 1 5 LYS NZ N 0.044 -10.916 -12.005 1.00 . A A . 5 LYS NZ 1 1 3 1126 1 1 5 LYS O O -2.313 -6.067 -9.604 1.00 . A A . 5 LYS O 1 1 3 1127 1 1 6 GLY C C -5.312 -3.341 -10.899 1.00 . A A . 6 GLY C 1 1 3 1128 1 1 6 GLY CA C -3.994 -4.085 -10.605 1.00 . A A . 6 GLY CA 1 1 3 1129 1 1 6 GLY H H -4.538 -5.863 -11.801 1.00 . A A . 6 GLY H 1 1 3 1130 1 1 6 GLY HA2 H -3.784 -4.000 -9.526 1.00 . A A . 6 GLY HA2 1 1 3 1131 1 1 6 GLY HA3 H -3.143 -3.586 -11.110 1.00 . A A . 6 GLY HA3 1 1 3 1132 1 1 6 GLY N N -3.978 -5.510 -11.017 1.00 . A A . 6 GLY N 1 1 3 1133 1 1 6 GLY O O -6.403 -3.912 -10.787 1.00 . A A . 6 GLY O 1 1 3 1134 1 1 7 ILE C C -7.071 -1.672 -12.935 1.00 . A A . 7 ILE C 1 1 3 1135 1 1 7 ILE CA C -6.394 -1.189 -11.597 1.00 . A A . 7 ILE CA 1 1 3 1136 1 1 7 ILE CB C -5.946 0.324 -11.672 1.00 . A A . 7 ILE CB 1 1 3 1137 1 1 7 ILE CD1 C -5.714 0.680 -9.039 1.00 . A A . 7 ILE CD1 1 1 3 1138 1 1 7 ILE CG1 C -5.118 0.844 -10.450 1.00 . A A . 7 ILE CG1 1 1 3 1139 1 1 7 ILE CG2 C -7.188 1.245 -11.823 1.00 . A A . 7 ILE CG2 1 1 3 1140 1 1 7 ILE H H -4.254 -1.692 -11.327 1.00 . A A . 7 ILE H 1 1 3 1141 1 1 7 ILE HA H -7.127 -1.288 -10.770 1.00 . A A . 7 ILE HA 1 1 3 1142 1 1 7 ILE HB H -5.305 0.461 -12.566 1.00 . A A . 7 ILE HB 1 1 3 1143 1 1 7 ILE HD11 H -6.683 1.199 -8.929 1.00 . A A . 7 ILE HD11 1 1 3 1144 1 1 7 ILE HD12 H -5.868 -0.385 -8.785 1.00 . A A . 7 ILE HD12 1 1 3 1145 1 1 7 ILE HD13 H -5.037 1.097 -8.272 1.00 . A A . 7 ILE HD13 1 1 3 1146 1 1 7 ILE HG12 H -4.127 0.353 -10.456 1.00 . A A . 7 ILE HG12 1 1 3 1147 1 1 7 ILE HG13 H -4.875 1.913 -10.607 1.00 . A A . 7 ILE HG13 1 1 3 1148 1 1 7 ILE HG21 H -7.898 1.143 -10.981 1.00 . A A . 7 ILE HG21 1 1 3 1149 1 1 7 ILE HG22 H -6.905 2.313 -11.882 1.00 . A A . 7 ILE HG22 1 1 3 1150 1 1 7 ILE HG23 H -7.754 1.031 -12.749 1.00 . A A . 7 ILE HG23 1 1 3 1151 1 1 7 ILE N N -5.208 -2.065 -11.313 1.00 . A A . 7 ILE N 1 1 3 1152 1 1 7 ILE O O -6.640 -1.326 -14.040 1.00 . A A . 7 ILE O 1 1 3 1153 1 1 8 THR C C -10.092 -3.583 -13.885 1.00 . A A . 8 THR C 1 1 3 1154 1 1 8 THR CA C -8.534 -3.432 -13.929 1.00 . A A . 8 THR CA 1 1 3 1155 1 1 8 THR CB C -7.790 -4.822 -13.869 1.00 . A A . 8 THR CB 1 1 3 1156 1 1 8 THR CG2 C -6.328 -4.760 -14.338 1.00 . A A . 8 THR CG2 1 1 3 1157 1 1 8 THR H H -8.239 -2.814 -11.829 1.00 . A A . 8 THR H 1 1 3 1158 1 1 8 THR HA H -8.311 -2.962 -14.909 1.00 . A A . 8 THR HA 1 1 3 1159 1 1 8 THR HB H -8.333 -5.524 -14.532 1.00 . A A . 8 THR HB 1 1 3 1160 1 1 8 THR HG1 H -7.201 -4.771 -12.003 1.00 . A A . 8 THR HG1 1 1 3 1161 1 1 8 THR HG21 H -6.248 -4.383 -15.375 1.00 . A A . 8 THR HG21 1 1 3 1162 1 1 8 THR HG22 H -5.704 -4.102 -13.708 1.00 . A A . 8 THR HG22 1 1 3 1163 1 1 8 THR HG23 H -5.862 -5.763 -14.323 1.00 . A A . 8 THR HG23 1 1 3 1164 1 1 8 THR N N -8.086 -2.544 -12.807 1.00 . A A . 8 THR N 1 1 3 1165 1 1 8 THR O O -10.785 -2.993 -14.715 1.00 . A A . 8 THR O 1 1 3 1166 1 1 8 THR OG1 O -7.768 -5.352 -12.540 1.00 . A A . 8 THR OG1 1 1 3 1167 1 1 9 GLN C C -12.190 -4.586 -11.045 1.00 . A A . 9 GLN C 1 1 3 1168 1 1 9 GLN CA C -12.094 -4.329 -12.589 1.00 . A A . 9 GLN CA 1 1 3 1169 1 1 9 GLN CB C -12.879 -5.338 -13.486 1.00 . A A . 9 GLN CB 1 1 3 1170 1 1 9 GLN CD C -13.255 -7.710 -14.446 1.00 . A A . 9 GLN CD 1 1 3 1171 1 1 9 GLN CG C -12.462 -6.836 -13.472 1.00 . A A . 9 GLN CG 1 1 3 1172 1 1 9 GLN H H -10.008 -4.563 -12.160 1.00 . A A . 9 GLN H 1 1 3 1173 1 1 9 GLN HA H -12.484 -3.315 -12.766 1.00 . A A . 9 GLN HA 1 1 3 1174 1 1 9 GLN HB2 H -13.953 -5.268 -13.229 1.00 . A A . 9 GLN HB2 1 1 3 1175 1 1 9 GLN HB3 H -12.825 -4.965 -14.529 1.00 . A A . 9 GLN HB3 1 1 3 1176 1 1 9 GLN HE21 H -11.835 -7.539 -15.841 1.00 . A A . 9 GLN HE21 1 1 3 1177 1 1 9 GLN HE22 H -13.332 -8.551 -16.221 1.00 . A A . 9 GLN HE22 1 1 3 1178 1 1 9 GLN HG2 H -11.377 -6.938 -13.662 1.00 . A A . 9 GLN HG2 1 1 3 1179 1 1 9 GLN HG3 H -12.610 -7.259 -12.462 1.00 . A A . 9 GLN HG3 1 1 3 1180 1 1 9 GLN N N -10.648 -4.349 -12.928 1.00 . A A . 9 GLN N 1 1 3 1181 1 1 9 GLN NE2 N -12.737 -7.970 -15.623 1.00 . A A . 9 GLN NE2 1 1 3 1182 1 1 9 GLN O O -12.627 -5.634 -10.564 1.00 . A A . 9 GLN O 1 1 3 1183 1 1 9 GLN OE1 O -14.353 -8.175 -14.161 1.00 . A A . 9 GLN OE1 1 1 3 1184 1 1 10 GLY C C -9.878 -2.978 -8.611 1.00 . A A . 10 GLY C 1 1 3 1185 1 1 10 GLY CA C -11.033 -3.953 -8.959 1.00 . A A . 10 GLY CA 1 1 3 1186 1 1 10 GLY H H -11.362 -2.805 -10.797 1.00 . A A . 10 GLY H 1 1 3 1187 1 1 10 GLY HA2 H -11.793 -3.970 -8.161 1.00 . A A . 10 GLY HA2 1 1 3 1188 1 1 10 GLY HA3 H -10.606 -4.977 -8.983 1.00 . A A . 10 GLY HA3 1 1 3 1189 1 1 10 GLY N N -11.658 -3.629 -10.263 1.00 . A A . 10 GLY N 1 1 3 1190 1 1 10 GLY O O -8.725 -3.365 -8.821 1.00 . A A . 10 GLY O 1 1 3 1191 1 1 11 PRO C C -8.226 -1.084 -6.501 1.00 . A A . 11 PRO C 1 1 3 1192 1 1 11 PRO CA C -9.009 -0.766 -7.818 1.00 . A A . 11 PRO CA 1 1 3 1193 1 1 11 PRO CB C -9.761 0.582 -7.814 1.00 . A A . 11 PRO CB 1 1 3 1194 1 1 11 PRO CD C -11.446 -1.131 -8.006 1.00 . A A . 11 PRO CD 1 1 3 1195 1 1 11 PRO CG C -11.191 0.243 -7.387 1.00 . A A . 11 PRO CG 1 1 3 1196 1 1 11 PRO HA H -8.280 -0.750 -8.653 1.00 . A A . 11 PRO HA 1 1 3 1197 1 1 11 PRO HB2 H -9.294 1.344 -7.161 1.00 . A A . 11 PRO HB2 1 1 3 1198 1 1 11 PRO HB3 H -9.771 1.012 -8.835 1.00 . A A . 11 PRO HB3 1 1 3 1199 1 1 11 PRO HD2 H -12.152 -1.729 -7.398 1.00 . A A . 11 PRO HD2 1 1 3 1200 1 1 11 PRO HD3 H -11.856 -1.046 -9.030 1.00 . A A . 11 PRO HD3 1 1 3 1201 1 1 11 PRO HG2 H -11.251 0.181 -6.283 1.00 . A A . 11 PRO HG2 1 1 3 1202 1 1 11 PRO HG3 H -11.930 1.000 -7.711 1.00 . A A . 11 PRO HG3 1 1 3 1203 1 1 11 PRO N N -10.104 -1.735 -8.090 1.00 . A A . 11 PRO N 1 1 3 1204 1 1 11 PRO O O -8.554 -0.612 -5.409 1.00 . A A . 11 PRO O 1 1 3 1205 1 1 12 ASN C C -5.594 -1.355 -4.624 1.00 . A A . 12 ASN C 1 1 3 1206 1 1 12 ASN CA C -6.378 -2.420 -5.481 1.00 . A A . 12 ASN CA 1 1 3 1207 1 1 12 ASN CB C -5.418 -3.512 -6.048 1.00 . A A . 12 ASN CB 1 1 3 1208 1 1 12 ASN CG C -4.183 -3.070 -6.861 1.00 . A A . 12 ASN CG 1 1 3 1209 1 1 12 ASN H H -7.212 -2.394 -7.546 1.00 . A A . 12 ASN H 1 1 3 1210 1 1 12 ASN HA H -7.077 -2.897 -4.767 1.00 . A A . 12 ASN HA 1 1 3 1211 1 1 12 ASN HB2 H -5.091 -4.128 -5.189 1.00 . A A . 12 ASN HB2 1 1 3 1212 1 1 12 ASN HB3 H -5.986 -4.225 -6.675 1.00 . A A . 12 ASN HB3 1 1 3 1213 1 1 12 ASN HD21 H -3.021 -4.325 -5.840 1.00 . A A . 12 ASN HD21 1 1 3 1214 1 1 12 ASN HD22 H -2.235 -3.181 -7.042 1.00 . A A . 12 ASN HD22 1 1 3 1215 1 1 12 ASN N N -7.173 -1.904 -6.641 1.00 . A A . 12 ASN N 1 1 3 1216 1 1 12 ASN ND2 N -3.038 -3.656 -6.613 1.00 . A A . 12 ASN ND2 1 1 3 1217 1 1 12 ASN O O -5.414 -1.568 -3.422 1.00 . A A . 12 ASN O 1 1 3 1218 1 1 12 ASN OD1 O -4.230 -2.196 -7.720 1.00 . A A . 12 ASN OD1 1 1 3 1219 1 1 13 GLU C C -5.638 1.787 -3.789 1.00 . A A . 13 GLU C 1 1 3 1220 1 1 13 GLU CA C -4.527 0.902 -4.440 1.00 . A A . 13 GLU CA 1 1 3 1221 1 1 13 GLU CB C -3.598 1.702 -5.401 1.00 . A A . 13 GLU CB 1 1 3 1222 1 1 13 GLU CD C -1.498 0.147 -5.249 1.00 . A A . 13 GLU CD 1 1 3 1223 1 1 13 GLU CG C -2.496 0.895 -6.133 1.00 . A A . 13 GLU CG 1 1 3 1224 1 1 13 GLU H H -5.364 -0.180 -6.204 1.00 . A A . 13 GLU H 1 1 3 1225 1 1 13 GLU HA H -3.864 0.550 -3.612 1.00 . A A . 13 GLU HA 1 1 3 1226 1 1 13 GLU HB2 H -4.214 2.225 -6.158 1.00 . A A . 13 GLU HB2 1 1 3 1227 1 1 13 GLU HB3 H -3.116 2.520 -4.831 1.00 . A A . 13 GLU HB3 1 1 3 1228 1 1 13 GLU HE2 H -1.179 -1.636 -4.563 1.00 . A A . 13 GLU HE2 1 1 3 1229 1 1 13 GLU HG2 H -3.002 0.152 -6.773 1.00 . A A . 13 GLU HG2 1 1 3 1230 1 1 13 GLU HG3 H -1.931 1.551 -6.818 1.00 . A A . 13 GLU HG3 1 1 3 1231 1 1 13 GLU N N -5.156 -0.221 -5.201 1.00 . A A . 13 GLU N 1 1 3 1232 1 1 13 GLU O O -5.917 2.919 -4.193 1.00 . A A . 13 GLU O 1 1 3 1233 1 1 13 GLU OE1 O -0.492 0.653 -4.761 1.00 . A A . 13 GLU OE1 1 1 3 1234 1 1 13 GLU OE2 O -1.857 -1.154 -5.075 1.00 . A A . 13 GLU OE2 1 1 3 1235 1 1 14 SER C C -6.606 2.154 -0.281 1.00 . A A . 14 SER C 1 1 3 1236 1 1 14 SER CA C -7.108 2.002 -1.782 1.00 . A A . 14 SER CA 1 1 3 1237 1 1 14 SER CB C -8.456 1.238 -1.904 1.00 . A A . 14 SER CB 1 1 3 1238 1 1 14 SER H H -5.925 0.264 -2.581 1.00 . A A . 14 SER H 1 1 3 1239 1 1 14 SER HA H -7.267 3.042 -2.126 1.00 . A A . 14 SER HA 1 1 3 1240 1 1 14 SER HB2 H -8.814 1.225 -2.953 1.00 . A A . 14 SER HB2 1 1 3 1241 1 1 14 SER HB3 H -8.345 0.174 -1.610 1.00 . A A . 14 SER HB3 1 1 3 1242 1 1 14 SER HG H -9.034 1.936 -0.208 1.00 . A A . 14 SER HG 1 1 3 1243 1 1 14 SER N N -6.200 1.252 -2.694 1.00 . A A . 14 SER N 1 1 3 1244 1 1 14 SER O O -7.450 2.013 0.616 1.00 . A A . 14 SER O 1 1 3 1245 1 1 14 SER OG O -9.450 1.846 -1.081 1.00 . A A . 14 SER OG 1 1 3 1246 1 1 15 PRO C C -3.308 1.431 -1.034 1.00 . A A . 15 PRO C 1 1 3 1247 1 1 15 PRO CA C -4.195 2.728 -0.842 1.00 . A A . 15 PRO CA 1 1 3 1248 1 1 15 PRO CB C -3.509 3.919 -0.137 1.00 . A A . 15 PRO CB 1 1 3 1249 1 1 15 PRO CD C -5.005 2.975 1.463 1.00 . A A . 15 PRO CD 1 1 3 1250 1 1 15 PRO CG C -3.560 3.481 1.315 1.00 . A A . 15 PRO CG 1 1 3 1251 1 1 15 PRO HA H -4.498 3.087 -1.839 1.00 . A A . 15 PRO HA 1 1 3 1252 1 1 15 PRO HB2 H -2.483 4.147 -0.478 1.00 . A A . 15 PRO HB2 1 1 3 1253 1 1 15 PRO HB3 H -4.085 4.855 -0.290 1.00 . A A . 15 PRO HB3 1 1 3 1254 1 1 15 PRO HD2 H -5.092 2.149 2.194 1.00 . A A . 15 PRO HD2 1 1 3 1255 1 1 15 PRO HD3 H -5.686 3.789 1.783 1.00 . A A . 15 PRO HD3 1 1 3 1256 1 1 15 PRO HG2 H -2.840 2.663 1.516 1.00 . A A . 15 PRO HG2 1 1 3 1257 1 1 15 PRO HG3 H -3.250 4.314 1.941 1.00 . A A . 15 PRO HG3 1 1 3 1258 1 1 15 PRO N N -5.338 2.532 0.088 1.00 . A A . 15 PRO N 1 1 3 1259 1 1 15 PRO O O -3.740 0.293 -0.851 1.00 . A A . 15 PRO O 1 1 3 1260 1 1 16 SER C C -0.871 -0.704 -1.021 1.00 . A A . 16 SER C 1 1 3 1261 1 1 16 SER CA C -0.830 0.850 -1.301 1.00 . A A . 16 SER CA 1 1 3 1262 1 1 16 SER CB C -0.038 1.608 -0.188 1.00 . A A . 16 SER CB 1 1 3 1263 1 1 16 SER H H -2.010 2.714 -1.266 1.00 . A A . 16 SER H 1 1 3 1264 1 1 16 SER HA H -0.270 0.901 -2.252 1.00 . A A . 16 SER HA 1 1 3 1265 1 1 16 SER HB2 H 0.092 2.682 -0.435 1.00 . A A . 16 SER HB2 1 1 3 1266 1 1 16 SER HB3 H -0.589 1.582 0.774 1.00 . A A . 16 SER HB3 1 1 3 1267 1 1 16 SER HG H 1.097 0.078 0.000 1.00 . A A . 16 SER HG 1 1 3 1268 1 1 16 SER N N -2.062 1.703 -1.423 1.00 . A A . 16 SER N 1 1 3 1269 1 1 16 SER O O 0.025 -1.227 -0.348 1.00 . A A . 16 SER O 1 1 3 1270 1 1 16 SER OG O 1.256 1.038 0.003 1.00 . A A . 16 SER OG 1 1 3 1271 1 1 17 ALA C C -0.481 -3.337 -2.840 1.00 . A A . 17 ALA C 1 1 3 1272 1 1 17 ALA CA C -1.584 -2.955 -1.796 1.00 . A A . 17 ALA CA 1 1 3 1273 1 1 17 ALA CB C -2.962 -3.516 -2.187 1.00 . A A . 17 ALA CB 1 1 3 1274 1 1 17 ALA H H -2.609 -0.986 -1.936 1.00 . A A . 17 ALA H 1 1 3 1275 1 1 17 ALA HA H -1.286 -3.361 -0.803 1.00 . A A . 17 ALA HA 1 1 3 1276 1 1 17 ALA HB1 H -3.746 -3.233 -1.458 1.00 . A A . 17 ALA HB1 1 1 3 1277 1 1 17 ALA HB2 H -3.295 -3.152 -3.179 1.00 . A A . 17 ALA HB2 1 1 3 1278 1 1 17 ALA HB3 H -2.955 -4.621 -2.230 1.00 . A A . 17 ALA HB3 1 1 3 1279 1 1 17 ALA N N -1.738 -1.477 -1.692 1.00 . A A . 17 ALA N 1 1 3 1280 1 1 17 ALA O O -0.295 -2.635 -3.840 1.00 . A A . 17 ALA O 1 1 3 1281 1 1 18 PHE C C 2.768 -3.590 -2.823 1.00 . A A . 18 PHE C 1 1 3 1282 1 1 18 PHE CA C 1.665 -4.647 -3.208 1.00 . A A . 18 PHE CA 1 1 3 1283 1 1 18 PHE CB C 1.514 -4.801 -4.759 1.00 . A A . 18 PHE CB 1 1 3 1284 1 1 18 PHE CD1 C 2.986 -6.783 -5.390 1.00 . A A . 18 PHE CD1 1 1 3 1285 1 1 18 PHE CD2 C 3.574 -4.603 -6.246 1.00 . A A . 18 PHE CD2 1 1 3 1286 1 1 18 PHE CE1 C 4.079 -7.338 -6.052 1.00 . A A . 18 PHE CE1 1 1 3 1287 1 1 18 PHE CE2 C 4.665 -5.159 -6.910 1.00 . A A . 18 PHE CE2 1 1 3 1288 1 1 18 PHE CG C 2.726 -5.412 -5.482 1.00 . A A . 18 PHE CG 1 1 3 1289 1 1 18 PHE CZ C 4.917 -6.526 -6.812 1.00 . A A . 18 PHE CZ 1 1 3 1290 1 1 18 PHE H H 0.035 -4.907 -1.725 1.00 . A A . 18 PHE H 1 1 3 1291 1 1 18 PHE HA H 2.037 -5.597 -2.795 1.00 . A A . 18 PHE HA 1 1 3 1292 1 1 18 PHE HB2 H 0.628 -5.426 -4.982 1.00 . A A . 18 PHE HB2 1 1 3 1293 1 1 18 PHE HB3 H 1.269 -3.824 -5.213 1.00 . A A . 18 PHE HB3 1 1 3 1294 1 1 18 PHE HD1 H 2.339 -7.425 -4.808 1.00 . A A . 18 PHE HD1 1 1 3 1295 1 1 18 PHE HD2 H 3.387 -3.542 -6.334 1.00 . A A . 18 PHE HD2 1 1 3 1296 1 1 18 PHE HE1 H 4.272 -8.399 -5.980 1.00 . A A . 18 PHE HE1 1 1 3 1297 1 1 18 PHE HE2 H 5.312 -4.532 -7.505 1.00 . A A . 18 PHE HE2 1 1 3 1298 1 1 18 PHE HZ H 5.762 -6.957 -7.329 1.00 . A A . 18 PHE HZ 1 1 3 1299 1 1 18 PHE N N 0.328 -4.382 -2.554 1.00 . A A . 18 PHE N 1 1 3 1300 1 1 18 PHE O O 3.872 -3.986 -2.435 1.00 . A A . 18 PHE O 1 1 3 1301 1 1 19 LEU C C 3.691 -1.228 -0.830 1.00 . A A . 19 LEU C 1 1 3 1302 1 1 19 LEU CA C 3.391 -1.206 -2.375 1.00 . A A . 19 LEU CA 1 1 3 1303 1 1 19 LEU CB C 2.743 0.148 -2.805 1.00 . A A . 19 LEU CB 1 1 3 1304 1 1 19 LEU CD1 C 4.582 1.267 -4.205 1.00 . A A . 19 LEU CD1 1 1 3 1305 1 1 19 LEU CD2 C 2.861 -0.179 -5.377 1.00 . A A . 19 LEU CD2 1 1 3 1306 1 1 19 LEU CG C 3.131 0.754 -4.182 1.00 . A A . 19 LEU CG 1 1 3 1307 1 1 19 LEU H H 1.510 -2.086 -3.164 1.00 . A A . 19 LEU H 1 1 3 1308 1 1 19 LEU HA H 4.377 -1.315 -2.860 1.00 . A A . 19 LEU HA 1 1 3 1309 1 1 19 LEU HB2 H 1.642 0.075 -2.765 1.00 . A A . 19 LEU HB2 1 1 3 1310 1 1 19 LEU HB3 H 2.958 0.917 -2.039 1.00 . A A . 19 LEU HB3 1 1 3 1311 1 1 19 LEU HD11 H 4.767 2.008 -3.406 1.00 . A A . 19 LEU HD11 1 1 3 1312 1 1 19 LEU HD12 H 5.321 0.457 -4.076 1.00 . A A . 19 LEU HD12 1 1 3 1313 1 1 19 LEU HD13 H 4.819 1.770 -5.162 1.00 . A A . 19 LEU HD13 1 1 3 1314 1 1 19 LEU HD21 H 1.812 -0.529 -5.390 1.00 . A A . 19 LEU HD21 1 1 3 1315 1 1 19 LEU HD22 H 3.040 0.332 -6.342 1.00 . A A . 19 LEU HD22 1 1 3 1316 1 1 19 LEU HD23 H 3.503 -1.078 -5.359 1.00 . A A . 19 LEU HD23 1 1 3 1317 1 1 19 LEU HG H 2.481 1.641 -4.326 1.00 . A A . 19 LEU HG 1 1 3 1318 1 1 19 LEU N N 2.482 -2.278 -2.878 1.00 . A A . 19 LEU N 1 1 3 1319 1 1 19 LEU O O 4.714 -0.673 -0.428 1.00 . A A . 19 LEU O 1 1 3 1320 1 1 20 GLU C C 4.246 -3.432 1.549 1.00 . A A . 20 GLU C 1 1 3 1321 1 1 20 GLU CA C 3.270 -2.215 1.428 1.00 . A A . 20 GLU CA 1 1 3 1322 1 1 20 GLU CB C 1.964 -2.496 2.239 1.00 . A A . 20 GLU CB 1 1 3 1323 1 1 20 GLU CD C 1.941 -0.416 3.794 1.00 . A A . 20 GLU CD 1 1 3 1324 1 1 20 GLU CG C 1.186 -1.270 2.780 1.00 . A A . 20 GLU CG 1 1 3 1325 1 1 20 GLU H H 1.915 -1.979 -0.278 1.00 . A A . 20 GLU H 1 1 3 1326 1 1 20 GLU HA H 3.835 -1.364 1.822 1.00 . A A . 20 GLU HA 1 1 3 1327 1 1 20 GLU HB2 H 1.266 -3.120 1.640 1.00 . A A . 20 GLU HB2 1 1 3 1328 1 1 20 GLU HB3 H 2.196 -3.135 3.114 1.00 . A A . 20 GLU HB3 1 1 3 1329 1 1 20 GLU HE2 H 2.283 -0.307 5.672 1.00 . A A . 20 GLU HE2 1 1 3 1330 1 1 20 GLU HG2 H 0.855 -0.619 1.956 1.00 . A A . 20 GLU HG2 1 1 3 1331 1 1 20 GLU HG3 H 0.248 -1.615 3.254 1.00 . A A . 20 GLU HG3 1 1 3 1332 1 1 20 GLU N N 2.874 -1.849 0.043 1.00 . A A . 20 GLU N 1 1 3 1333 1 1 20 GLU O O 5.133 -3.394 2.409 1.00 . A A . 20 GLU O 1 1 3 1334 1 1 20 GLU OE1 O 2.608 0.568 3.485 1.00 . A A . 20 GLU OE1 1 1 3 1335 1 1 20 GLU OE2 O 1.800 -0.873 5.070 1.00 . A A . 20 GLU OE2 1 1 3 1336 1 1 21 ARG C C 6.547 -4.970 0.033 1.00 . A A . 21 ARG C 1 1 3 1337 1 1 21 ARG CA C 5.178 -5.527 0.559 1.00 . A A . 21 ARG CA 1 1 3 1338 1 1 21 ARG CB C 4.632 -6.639 -0.383 1.00 . A A . 21 ARG CB 1 1 3 1339 1 1 21 ARG CD C 3.866 -8.444 1.332 1.00 . A A . 21 ARG CD 1 1 3 1340 1 1 21 ARG CG C 3.464 -7.487 0.187 1.00 . A A . 21 ARG CG 1 1 3 1341 1 1 21 ARG CZ C 2.095 -8.571 3.118 1.00 . A A . 21 ARG CZ 1 1 3 1342 1 1 21 ARG H H 3.354 -4.445 0.068 1.00 . A A . 21 ARG H 1 1 3 1343 1 1 21 ARG HA H 5.365 -5.948 1.544 1.00 . A A . 21 ARG HA 1 1 3 1344 1 1 21 ARG HB2 H 4.326 -6.194 -1.351 1.00 . A A . 21 ARG HB2 1 1 3 1345 1 1 21 ARG HB3 H 5.456 -7.329 -0.657 1.00 . A A . 21 ARG HB3 1 1 3 1346 1 1 21 ARG HD2 H 4.478 -9.271 0.916 1.00 . A A . 21 ARG HD2 1 1 3 1347 1 1 21 ARG HD3 H 4.546 -7.963 2.063 1.00 . A A . 21 ARG HD3 1 1 3 1348 1 1 21 ARG HE H 2.149 -9.790 1.553 1.00 . A A . 21 ARG HE 1 1 3 1349 1 1 21 ARG HG2 H 2.648 -6.813 0.516 1.00 . A A . 21 ARG HG2 1 1 3 1350 1 1 21 ARG HG3 H 3.015 -8.082 -0.634 1.00 . A A . 21 ARG HG3 1 1 3 1351 1 1 21 ARG HH11 H 3.434 -7.157 3.498 1.00 . A A . 21 ARG HH11 1 1 3 1352 1 1 21 ARG HH12 H 2.080 -7.331 4.700 1.00 . A A . 21 ARG HH12 1 1 3 1353 1 1 21 ARG HH21 H 0.664 -9.942 2.978 1.00 . A A . 21 ARG HH21 1 1 3 1354 1 1 21 ARG HH22 H 0.609 -8.821 4.410 1.00 . A A . 21 ARG HH22 1 1 3 1355 1 1 21 ARG N N 4.123 -4.492 0.726 1.00 . A A . 21 ARG N 1 1 3 1356 1 1 21 ARG NE N 2.652 -9.009 1.984 1.00 . A A . 21 ARG NE 1 1 3 1357 1 1 21 ARG NH1 N 2.563 -7.578 3.835 1.00 . A A . 21 ARG NH1 1 1 3 1358 1 1 21 ARG NH2 N 1.017 -9.166 3.540 1.00 . A A . 21 ARG NH2 1 1 3 1359 1 1 21 ARG O O 7.594 -5.377 0.544 1.00 . A A . 21 ARG O 1 1 3 1360 1 1 22 LEU C C 8.242 -2.247 -0.128 1.00 . A A . 22 LEU C 1 1 3 1361 1 1 22 LEU CA C 7.745 -3.214 -1.262 1.00 . A A . 22 LEU CA 1 1 3 1362 1 1 22 LEU CB C 7.428 -2.411 -2.560 1.00 . A A . 22 LEU CB 1 1 3 1363 1 1 22 LEU CD1 C 6.695 -2.282 -4.992 1.00 . A A . 22 LEU CD1 1 1 3 1364 1 1 22 LEU CD2 C 8.335 -4.055 -4.325 1.00 . A A . 22 LEU CD2 1 1 3 1365 1 1 22 LEU CG C 7.130 -3.221 -3.855 1.00 . A A . 22 LEU CG 1 1 3 1366 1 1 22 LEU H H 5.651 -3.772 -1.320 1.00 . A A . 22 LEU H 1 1 3 1367 1 1 22 LEU HA H 8.550 -3.928 -1.461 1.00 . A A . 22 LEU HA 1 1 3 1368 1 1 22 LEU HB2 H 6.588 -1.721 -2.355 1.00 . A A . 22 LEU HB2 1 1 3 1369 1 1 22 LEU HB3 H 8.282 -1.738 -2.774 1.00 . A A . 22 LEU HB3 1 1 3 1370 1 1 22 LEU HD11 H 7.468 -1.529 -5.234 1.00 . A A . 22 LEU HD11 1 1 3 1371 1 1 22 LEU HD12 H 6.478 -2.839 -5.922 1.00 . A A . 22 LEU HD12 1 1 3 1372 1 1 22 LEU HD13 H 5.771 -1.736 -4.735 1.00 . A A . 22 LEU HD13 1 1 3 1373 1 1 22 LEU HD21 H 9.227 -3.429 -4.515 1.00 . A A . 22 LEU HD21 1 1 3 1374 1 1 22 LEU HD22 H 8.622 -4.818 -3.578 1.00 . A A . 22 LEU HD22 1 1 3 1375 1 1 22 LEU HD23 H 8.114 -4.605 -5.258 1.00 . A A . 22 LEU HD23 1 1 3 1376 1 1 22 LEU HG H 6.287 -3.915 -3.660 1.00 . A A . 22 LEU HG 1 1 3 1377 1 1 22 LEU N N 6.549 -4.001 -0.901 1.00 . A A . 22 LEU N 1 1 3 1378 1 1 22 LEU O O 9.457 -2.112 0.022 1.00 . A A . 22 LEU O 1 1 3 1379 1 1 23 LYS C C 8.465 -1.276 2.985 1.00 . A A . 23 LYS C 1 1 3 1380 1 1 23 LYS CA C 7.818 -0.611 1.718 1.00 . A A . 23 LYS CA 1 1 3 1381 1 1 23 LYS CB C 6.568 0.241 2.058 1.00 . A A . 23 LYS CB 1 1 3 1382 1 1 23 LYS CD C 5.548 2.399 3.100 1.00 . A A . 23 LYS CD 1 1 3 1383 1 1 23 LYS CE C 4.739 2.932 1.890 1.00 . A A . 23 LYS CE 1 1 3 1384 1 1 23 LYS CG C 6.823 1.568 2.804 1.00 . A A . 23 LYS CG 1 1 3 1385 1 1 23 LYS H H 6.370 -1.832 0.536 1.00 . A A . 23 LYS H 1 1 3 1386 1 1 23 LYS HA H 8.595 0.053 1.289 1.00 . A A . 23 LYS HA 1 1 3 1387 1 1 23 LYS HB2 H 6.095 0.526 1.105 1.00 . A A . 23 LYS HB2 1 1 3 1388 1 1 23 LYS HB3 H 5.825 -0.370 2.608 1.00 . A A . 23 LYS HB3 1 1 3 1389 1 1 23 LYS HD2 H 4.895 1.846 3.805 1.00 . A A . 23 LYS HD2 1 1 3 1390 1 1 23 LYS HD3 H 5.876 3.275 3.695 1.00 . A A . 23 LYS HD3 1 1 3 1391 1 1 23 LYS HE2 H 4.170 3.833 2.212 1.00 . A A . 23 LYS HE2 1 1 3 1392 1 1 23 LYS HE3 H 5.423 3.308 1.098 1.00 . A A . 23 LYS HE3 1 1 3 1393 1 1 23 LYS HG2 H 7.339 1.354 3.763 1.00 . A A . 23 LYS HG2 1 1 3 1394 1 1 23 LYS HG3 H 7.546 2.187 2.234 1.00 . A A . 23 LYS HG3 1 1 3 1395 1 1 23 LYS HZ1 H 3.294 1.424 2.132 1.00 . A A . 23 LYS HZ1 1 1 3 1396 1 1 23 LYS HZ2 H 3.050 2.265 0.742 1.00 . A A . 23 LYS HZ2 1 1 3 1397 1 1 23 LYS HZ3 H 4.256 1.154 0.830 1.00 . A A . 23 LYS HZ3 1 1 3 1398 1 1 23 LYS N N 7.368 -1.585 0.669 1.00 . A A . 23 LYS N 1 1 3 1399 1 1 23 LYS NZ N 3.794 1.908 1.359 1.00 . A A . 23 LYS NZ 1 1 3 1400 1 1 23 LYS O O 9.466 -0.757 3.485 1.00 . A A . 23 LYS O 1 1 3 1401 1 1 24 GLU C C 9.987 -3.907 3.984 1.00 . A A . 24 GLU C 1 1 3 1402 1 1 24 GLU CA C 8.636 -3.267 4.486 1.00 . A A . 24 GLU CA 1 1 3 1403 1 1 24 GLU CB C 7.603 -4.330 4.975 1.00 . A A . 24 GLU CB 1 1 3 1404 1 1 24 GLU CD C 5.867 -6.159 4.348 1.00 . A A . 24 GLU CD 1 1 3 1405 1 1 24 GLU CG C 7.173 -5.453 3.992 1.00 . A A . 24 GLU CG 1 1 3 1406 1 1 24 GLU H H 7.135 -2.780 2.984 1.00 . A A . 24 GLU H 1 1 3 1407 1 1 24 GLU HA H 8.888 -2.606 5.319 1.00 . A A . 24 GLU HA 1 1 3 1408 1 1 24 GLU HB2 H 8.003 -4.810 5.889 1.00 . A A . 24 GLU HB2 1 1 3 1409 1 1 24 GLU HB3 H 6.704 -3.792 5.341 1.00 . A A . 24 GLU HB3 1 1 3 1410 1 1 24 GLU HE2 H 5.029 -4.588 3.570 1.00 . A A . 24 GLU HE2 1 1 3 1411 1 1 24 GLU HG2 H 7.077 -5.049 2.971 1.00 . A A . 24 GLU HG2 1 1 3 1412 1 1 24 GLU HG3 H 7.972 -6.214 3.916 1.00 . A A . 24 GLU HG3 1 1 3 1413 1 1 24 GLU N N 7.947 -2.421 3.477 1.00 . A A . 24 GLU N 1 1 3 1414 1 1 24 GLU O O 10.953 -3.938 4.751 1.00 . A A . 24 GLU O 1 1 3 1415 1 1 24 GLU OE1 O 5.806 -7.285 4.832 1.00 . A A . 24 GLU OE1 1 1 3 1416 1 1 24 GLU OE2 O 4.771 -5.419 4.002 1.00 . A A . 24 GLU OE2 1 1 3 1417 1 1 25 ALA C C 12.392 -3.549 1.912 1.00 . A A . 25 ALA C 1 1 3 1418 1 1 25 ALA CA C 11.360 -4.725 2.055 1.00 . A A . 25 ALA CA 1 1 3 1419 1 1 25 ALA CB C 10.975 -5.313 0.684 1.00 . A A . 25 ALA CB 1 1 3 1420 1 1 25 ALA H H 9.211 -4.390 2.189 1.00 . A A . 25 ALA H 1 1 3 1421 1 1 25 ALA HA H 11.823 -5.507 2.668 1.00 . A A . 25 ALA HA 1 1 3 1422 1 1 25 ALA HB1 H 10.284 -6.172 0.777 1.00 . A A . 25 ALA HB1 1 1 3 1423 1 1 25 ALA HB2 H 10.486 -4.573 0.023 1.00 . A A . 25 ALA HB2 1 1 3 1424 1 1 25 ALA HB3 H 11.865 -5.686 0.146 1.00 . A A . 25 ALA HB3 1 1 3 1425 1 1 25 ALA N N 10.085 -4.353 2.711 1.00 . A A . 25 ALA N 1 1 3 1426 1 1 25 ALA O O 13.549 -3.716 2.307 1.00 . A A . 25 ALA O 1 1 3 1427 1 1 26 TYR C C 13.276 -0.651 2.917 1.00 . A A . 26 TYR C 1 1 3 1428 1 1 26 TYR CA C 12.829 -1.120 1.488 1.00 . A A . 26 TYR CA 1 1 3 1429 1 1 26 TYR CB C 12.054 0.017 0.752 1.00 . A A . 26 TYR CB 1 1 3 1430 1 1 26 TYR CD1 C 11.960 -0.507 -1.749 1.00 . A A . 26 TYR CD1 1 1 3 1431 1 1 26 TYR CD2 C 13.570 1.115 -0.966 1.00 . A A . 26 TYR CD2 1 1 3 1432 1 1 26 TYR CE1 C 12.427 -0.337 -3.051 1.00 . A A . 26 TYR CE1 1 1 3 1433 1 1 26 TYR CE2 C 14.033 1.286 -2.269 1.00 . A A . 26 TYR CE2 1 1 3 1434 1 1 26 TYR CG C 12.527 0.221 -0.697 1.00 . A A . 26 TYR CG 1 1 3 1435 1 1 26 TYR CZ C 13.459 0.560 -3.309 1.00 . A A . 26 TYR CZ 1 1 3 1436 1 1 26 TYR H H 11.086 -2.342 0.952 1.00 . A A . 26 TYR H 1 1 3 1437 1 1 26 TYR HA H 13.757 -1.356 0.959 1.00 . A A . 26 TYR HA 1 1 3 1438 1 1 26 TYR HB2 H 10.957 -0.133 0.784 1.00 . A A . 26 TYR HB2 1 1 3 1439 1 1 26 TYR HB3 H 12.169 0.982 1.285 1.00 . A A . 26 TYR HB3 1 1 3 1440 1 1 26 TYR HD1 H 11.165 -1.213 -1.563 1.00 . A A . 26 TYR HD1 1 1 3 1441 1 1 26 TYR HD2 H 14.029 1.677 -0.163 1.00 . A A . 26 TYR HD2 1 1 3 1442 1 1 26 TYR HE1 H 11.990 -0.898 -3.863 1.00 . A A . 26 TYR HE1 1 1 3 1443 1 1 26 TYR HE2 H 14.835 1.981 -2.463 1.00 . A A . 26 TYR HE2 1 1 3 1444 1 1 26 TYR HH H 14.576 1.411 -4.604 1.00 . A A . 26 TYR HH 1 1 3 1445 1 1 26 TYR N N 11.989 -2.349 1.438 1.00 . A A . 26 TYR N 1 1 3 1446 1 1 26 TYR O O 14.361 -0.074 3.025 1.00 . A A . 26 TYR O 1 1 3 1447 1 1 26 TYR OH O 13.905 0.726 -4.592 1.00 . A A . 26 TYR OH 1 1 3 1448 1 1 27 ARG C C 13.991 -1.952 5.887 1.00 . A A . 27 ARG C 1 1 3 1449 1 1 27 ARG CA C 13.042 -0.794 5.390 1.00 . A A . 27 ARG CA 1 1 3 1450 1 1 27 ARG CB C 11.792 -0.640 6.312 1.00 . A A . 27 ARG CB 1 1 3 1451 1 1 27 ARG CD C 11.716 1.822 7.206 1.00 . A A . 27 ARG CD 1 1 3 1452 1 1 27 ARG CG C 11.996 0.331 7.510 1.00 . A A . 27 ARG CG 1 1 3 1453 1 1 27 ARG CZ C 12.579 3.494 5.539 1.00 . A A . 27 ARG CZ 1 1 3 1454 1 1 27 ARG H H 11.603 -1.333 3.775 1.00 . A A . 27 ARG H 1 1 3 1455 1 1 27 ARG HA H 13.673 0.112 5.440 1.00 . A A . 27 ARG HA 1 1 3 1456 1 1 27 ARG HB2 H 10.895 -0.298 5.757 1.00 . A A . 27 ARG HB2 1 1 3 1457 1 1 27 ARG HB3 H 11.489 -1.637 6.692 1.00 . A A . 27 ARG HB3 1 1 3 1458 1 1 27 ARG HD2 H 10.689 1.912 6.795 1.00 . A A . 27 ARG HD2 1 1 3 1459 1 1 27 ARG HD3 H 11.709 2.393 8.158 1.00 . A A . 27 ARG HD3 1 1 3 1460 1 1 27 ARG HE H 13.646 1.955 6.140 1.00 . A A . 27 ARG HE 1 1 3 1461 1 1 27 ARG HG2 H 11.304 0.022 8.317 1.00 . A A . 27 ARG HG2 1 1 3 1462 1 1 27 ARG HG3 H 13.000 0.199 7.961 1.00 . A A . 27 ARG HG3 1 1 3 1463 1 1 27 ARG HH11 H 10.827 3.979 6.272 1.00 . A A . 27 ARG HH11 1 1 3 1464 1 1 27 ARG HH12 H 11.511 5.102 4.997 1.00 . A A . 27 ARG HH12 1 1 3 1465 1 1 27 ARG HH21 H 14.360 3.177 4.752 1.00 . A A . 27 ARG HH21 1 1 3 1466 1 1 27 ARG HH22 H 13.439 4.648 4.157 1.00 . A A . 27 ARG HH22 1 1 3 1467 1 1 27 ARG N N 12.522 -0.927 3.998 1.00 . A A . 27 ARG N 1 1 3 1468 1 1 27 ARG NE N 12.733 2.407 6.289 1.00 . A A . 27 ARG NE 1 1 3 1469 1 1 27 ARG NH1 N 11.521 4.264 5.579 1.00 . A A . 27 ARG NH1 1 1 3 1470 1 1 27 ARG NH2 N 13.545 3.808 4.727 1.00 . A A . 27 ARG NH2 1 1 3 1471 1 1 27 ARG O O 14.548 -1.821 6.978 1.00 . A A . 27 ARG O 1 1 3 1472 1 1 28 ARG C C 16.693 -3.145 4.471 1.00 . A A . 28 ARG C 1 1 3 1473 1 1 28 ARG CA C 15.498 -3.824 5.227 1.00 . A A . 28 ARG CA 1 1 3 1474 1 1 28 ARG CB C 15.275 -5.266 4.670 1.00 . A A . 28 ARG CB 1 1 3 1475 1 1 28 ARG CD C 14.212 -6.403 6.757 1.00 . A A . 28 ARG CD 1 1 3 1476 1 1 28 ARG CG C 14.101 -6.096 5.249 1.00 . A A . 28 ARG CG 1 1 3 1477 1 1 28 ARG CZ C 11.910 -6.127 7.722 1.00 . A A . 28 ARG CZ 1 1 3 1478 1 1 28 ARG H H 13.753 -3.081 4.235 1.00 . A A . 28 ARG H 1 1 3 1479 1 1 28 ARG HA H 15.760 -3.878 6.280 1.00 . A A . 28 ARG HA 1 1 3 1480 1 1 28 ARG HB2 H 15.144 -5.221 3.571 1.00 . A A . 28 ARG HB2 1 1 3 1481 1 1 28 ARG HB3 H 16.210 -5.845 4.803 1.00 . A A . 28 ARG HB3 1 1 3 1482 1 1 28 ARG HD2 H 15.002 -7.165 6.919 1.00 . A A . 28 ARG HD2 1 1 3 1483 1 1 28 ARG HD3 H 14.570 -5.526 7.334 1.00 . A A . 28 ARG HD3 1 1 3 1484 1 1 28 ARG HE H 12.744 -7.905 7.405 1.00 . A A . 28 ARG HE 1 1 3 1485 1 1 28 ARG HG2 H 13.153 -5.564 5.028 1.00 . A A . 28 ARG HG2 1 1 3 1486 1 1 28 ARG HG3 H 14.013 -7.049 4.690 1.00 . A A . 28 ARG HG3 1 1 3 1487 1 1 28 ARG HH11 H 12.745 -4.436 7.178 1.00 . A A . 28 ARG HH11 1 1 3 1488 1 1 28 ARG HH12 H 11.096 -4.299 7.951 1.00 . A A . 28 ARG HH12 1 1 3 1489 1 1 28 ARG HH21 H 10.867 -7.725 8.275 1.00 . A A . 28 ARG HH21 1 1 3 1490 1 1 28 ARG HH22 H 10.106 -6.093 8.547 1.00 . A A . 28 ARG HH22 1 1 3 1491 1 1 28 ARG N N 14.246 -3.037 5.124 1.00 . A A . 28 ARG N 1 1 3 1492 1 1 28 ARG NE N 12.915 -6.901 7.298 1.00 . A A . 28 ARG NE 1 1 3 1493 1 1 28 ARG NH1 N 11.922 -4.818 7.651 1.00 . A A . 28 ARG NH1 1 1 3 1494 1 1 28 ARG NH2 N 10.858 -6.705 8.225 1.00 . A A . 28 ARG NH2 1 1 3 1495 1 1 28 ARG O O 17.791 -3.074 5.024 1.00 . A A . 28 ARG O 1 1 3 1496 1 1 29 TYR C C 18.072 -0.654 2.979 1.00 . A A . 29 TYR C 1 1 3 1497 1 1 29 TYR CA C 17.563 -2.025 2.398 1.00 . A A . 29 TYR CA 1 1 3 1498 1 1 29 TYR CB C 17.026 -1.827 0.937 1.00 . A A . 29 TYR CB 1 1 3 1499 1 1 29 TYR CD1 C 16.453 -4.319 0.477 1.00 . A A . 29 TYR CD1 1 1 3 1500 1 1 29 TYR CD2 C 15.346 -2.595 -0.796 1.00 . A A . 29 TYR CD2 1 1 3 1501 1 1 29 TYR CE1 C 15.642 -5.280 -0.121 1.00 . A A . 29 TYR CE1 1 1 3 1502 1 1 29 TYR CE2 C 14.535 -3.556 -1.394 1.00 . A A . 29 TYR CE2 1 1 3 1503 1 1 29 TYR CG C 16.287 -2.960 0.175 1.00 . A A . 29 TYR CG 1 1 3 1504 1 1 29 TYR CZ C 14.683 -4.898 -1.055 1.00 . A A . 29 TYR CZ 1 1 3 1505 1 1 29 TYR H H 15.558 -2.856 2.846 1.00 . A A . 29 TYR H 1 1 3 1506 1 1 29 TYR HA H 18.438 -2.704 2.364 1.00 . A A . 29 TYR HA 1 1 3 1507 1 1 29 TYR HB2 H 16.357 -0.941 0.946 1.00 . A A . 29 TYR HB2 1 1 3 1508 1 1 29 TYR HB3 H 17.874 -1.510 0.301 1.00 . A A . 29 TYR HB3 1 1 3 1509 1 1 29 TYR HD1 H 17.173 -4.632 1.220 1.00 . A A . 29 TYR HD1 1 1 3 1510 1 1 29 TYR HD2 H 15.197 -1.556 -1.054 1.00 . A A . 29 TYR HD2 1 1 3 1511 1 1 29 TYR HE1 H 15.737 -6.317 0.164 1.00 . A A . 29 TYR HE1 1 1 3 1512 1 1 29 TYR HE2 H 13.772 -3.243 -2.090 1.00 . A A . 29 TYR HE2 1 1 3 1513 1 1 29 TYR HH H 13.335 -5.421 -2.297 1.00 . A A . 29 TYR HH 1 1 3 1514 1 1 29 TYR N N 16.490 -2.653 3.230 1.00 . A A . 29 TYR N 1 1 3 1515 1 1 29 TYR O O 19.281 -0.455 3.096 1.00 . A A . 29 TYR O 1 1 3 1516 1 1 29 TYR OH O 13.874 -5.842 -1.625 1.00 . A A . 29 TYR OH 1 1 3 1517 1 1 30 THR C C 16.691 1.456 5.485 1.00 . A A . 30 THR C 1 1 3 1518 1 1 30 THR CA C 17.513 1.498 4.135 1.00 . A A . 30 THR CA 1 1 3 1519 1 1 30 THR CB C 17.193 2.750 3.292 1.00 . A A . 30 THR CB 1 1 3 1520 1 1 30 THR CG2 C 17.564 4.086 3.955 1.00 . A A . 30 THR CG2 1 1 3 1521 1 1 30 THR H H 16.187 -0.025 3.235 1.00 . A A . 30 THR H 1 1 3 1522 1 1 30 THR HA H 18.596 1.550 4.354 1.00 . A A . 30 THR HA 1 1 3 1523 1 1 30 THR HB H 16.116 2.701 3.114 1.00 . A A . 30 THR HB 1 1 3 1524 1 1 30 THR HG1 H 18.012 1.782 1.851 1.00 . A A . 30 THR HG1 1 1 3 1525 1 1 30 THR HG21 H 18.645 4.144 4.179 1.00 . A A . 30 THR HG21 1 1 3 1526 1 1 30 THR HG22 H 17.324 4.937 3.291 1.00 . A A . 30 THR HG22 1 1 3 1527 1 1 30 THR HG23 H 17.014 4.247 4.900 1.00 . A A . 30 THR HG23 1 1 3 1528 1 1 30 THR N N 17.169 0.279 3.348 1.00 . A A . 30 THR N 1 1 3 1529 1 1 30 THR O O 15.530 1.893 5.510 1.00 . A A . 30 THR O 1 1 3 1530 1 1 30 THR OG1 O 17.905 2.716 2.060 1.00 . A A . 30 THR OG1 1 1 3 1531 1 1 31 PRO C C 16.453 2.121 8.795 1.00 . A A . 31 PRO C 1 1 3 1532 1 1 31 PRO CA C 16.499 0.824 7.912 1.00 . A A . 31 PRO CA 1 1 3 1533 1 1 31 PRO CB C 17.265 -0.365 8.537 1.00 . A A . 31 PRO CB 1 1 3 1534 1 1 31 PRO CD C 18.564 0.317 6.630 1.00 . A A . 31 PRO CD 1 1 3 1535 1 1 31 PRO CG C 18.712 -0.216 8.052 1.00 . A A . 31 PRO CG 1 1 3 1536 1 1 31 PRO HA H 15.448 0.519 7.746 1.00 . A A . 31 PRO HA 1 1 3 1537 1 1 31 PRO HB2 H 17.190 -0.406 9.641 1.00 . A A . 31 PRO HB2 1 1 3 1538 1 1 31 PRO HB3 H 16.845 -1.320 8.165 1.00 . A A . 31 PRO HB3 1 1 3 1539 1 1 31 PRO HD2 H 19.346 1.050 6.352 1.00 . A A . 31 PRO HD2 1 1 3 1540 1 1 31 PRO HD3 H 18.566 -0.487 5.866 1.00 . A A . 31 PRO HD3 1 1 3 1541 1 1 31 PRO HG2 H 19.250 0.520 8.683 1.00 . A A . 31 PRO HG2 1 1 3 1542 1 1 31 PRO HG3 H 19.279 -1.165 8.096 1.00 . A A . 31 PRO HG3 1 1 3 1543 1 1 31 PRO N N 17.246 0.965 6.627 1.00 . A A . 31 PRO N 1 1 3 1544 1 1 31 PRO O O 16.952 2.154 9.923 1.00 . A A . 31 PRO O 1 1 3 1545 1 1 32 TYR C C 14.525 5.252 8.771 1.00 . A A . 32 TYR C 1 1 3 1546 1 1 32 TYR CA C 15.905 4.553 8.884 1.00 . A A . 32 TYR CA 1 1 3 1547 1 1 32 TYR CB C 17.004 5.402 8.176 1.00 . A A . 32 TYR CB 1 1 3 1548 1 1 32 TYR CD1 C 19.089 5.410 9.645 1.00 . A A . 32 TYR CD1 1 1 3 1549 1 1 32 TYR CD2 C 19.149 4.149 7.587 1.00 . A A . 32 TYR CD2 1 1 3 1550 1 1 32 TYR CE1 C 20.391 5.001 9.932 1.00 . A A . 32 TYR CE1 1 1 3 1551 1 1 32 TYR CE2 C 20.448 3.739 7.876 1.00 . A A . 32 TYR CE2 1 1 3 1552 1 1 32 TYR CG C 18.458 4.984 8.472 1.00 . A A . 32 TYR CG 1 1 3 1553 1 1 32 TYR CZ C 21.067 4.165 9.047 1.00 . A A . 32 TYR CZ 1 1 3 1554 1 1 32 TYR H H 15.596 3.055 7.281 1.00 . A A . 32 TYR H 1 1 3 1555 1 1 32 TYR HA H 16.152 4.481 9.965 1.00 . A A . 32 TYR HA 1 1 3 1556 1 1 32 TYR HB2 H 16.824 5.420 7.084 1.00 . A A . 32 TYR HB2 1 1 3 1557 1 1 32 TYR HB3 H 16.892 6.464 8.473 1.00 . A A . 32 TYR HB3 1 1 3 1558 1 1 32 TYR HD1 H 18.568 6.048 10.346 1.00 . A A . 32 TYR HD1 1 1 3 1559 1 1 32 TYR HD2 H 18.671 3.792 6.687 1.00 . A A . 32 TYR HD2 1 1 3 1560 1 1 32 TYR HE1 H 20.864 5.329 10.846 1.00 . A A . 32 TYR HE1 1 1 3 1561 1 1 32 TYR HE2 H 20.976 3.083 7.199 1.00 . A A . 32 TYR HE2 1 1 3 1562 1 1 32 TYR HH H 22.616 4.142 10.160 1.00 . A A . 32 TYR HH 1 1 3 1563 1 1 32 TYR N N 15.838 3.195 8.267 1.00 . A A . 32 TYR N 1 1 3 1564 1 1 32 TYR O O 13.900 5.412 7.723 1.00 . A A . 32 TYR O 1 1 3 1565 1 1 32 TYR OXT O 14.080 5.717 9.974 1.00 . A A . 32 TYR OXT 1 1 3 1566 1 1 32 TYR OH O 22.342 3.754 9.327 1.00 . A A . 32 TYR OH 1 1 4 1567 1 1 1 CYS C C -10.235 -3.292 -13.301 1.00 . A A . 1 CYS C 1 1 4 1568 1 1 1 CYS CA C -9.864 -4.554 -12.457 1.00 . A A . 1 CYS CA 1 1 4 1569 1 1 1 CYS CB C -10.686 -5.814 -12.809 1.00 . A A . 1 CYS CB 1 1 4 1570 1 1 1 CYS H1 H -9.592 -5.043 -10.470 1.00 . A A . 1 CYS H1 1 1 4 1571 1 1 1 CYS H2 H -11.055 -4.417 -10.788 1.00 . A A . 1 CYS H2 1 1 4 1572 1 1 1 CYS HA H -8.796 -4.779 -12.643 1.00 . A A . 1 CYS HA 1 1 4 1573 1 1 1 CYS HB2 H -11.757 -5.698 -12.553 1.00 . A A . 1 CYS HB2 1 1 4 1574 1 1 1 CYS HB3 H -10.645 -6.013 -13.897 1.00 . A A . 1 CYS HB3 1 1 4 1575 1 1 1 CYS HG H -10.921 -8.144 -12.388 1.00 . A A . 1 CYS HG 1 1 4 1576 1 1 1 CYS N N -10.057 -4.303 -11.009 1.00 . A A . 1 CYS N 1 1 4 1577 1 1 1 CYS O O -9.322 -2.655 -13.837 1.00 . A A . 1 CYS O 1 1 4 1578 1 1 1 CYS SG S -10.020 -7.274 -11.938 1.00 . A A . 1 CYS SG 1 1 4 1579 1 1 2 ALA C C -11.737 -0.369 -13.490 1.00 . A A . 2 ALA C 1 1 4 1580 1 1 2 ALA CA C -11.924 -1.724 -14.259 1.00 . A A . 2 ALA CA 1 1 4 1581 1 1 2 ALA CB C -13.384 -1.986 -14.682 1.00 . A A . 2 ALA CB 1 1 4 1582 1 1 2 ALA H H -12.200 -3.527 -12.992 1.00 . A A . 2 ALA H 1 1 4 1583 1 1 2 ALA HA H -11.314 -1.667 -15.185 1.00 . A A . 2 ALA HA 1 1 4 1584 1 1 2 ALA HB1 H -13.491 -2.934 -15.242 1.00 . A A . 2 ALA HB1 1 1 4 1585 1 1 2 ALA HB2 H -14.078 -2.028 -13.823 1.00 . A A . 2 ALA HB2 1 1 4 1586 1 1 2 ALA HB3 H -13.756 -1.187 -15.350 1.00 . A A . 2 ALA HB3 1 1 4 1587 1 1 2 ALA N N -11.522 -2.899 -13.433 1.00 . A A . 2 ALA N 1 1 4 1588 1 1 2 ALA O O -12.686 0.213 -12.948 1.00 . A A . 2 ALA O 1 1 4 1589 1 1 3 LYS C C -10.422 1.050 -11.058 1.00 . A A . 3 LYS C 1 1 4 1590 1 1 3 LYS CA C -10.015 1.252 -12.566 1.00 . A A . 3 LYS CA 1 1 4 1591 1 1 3 LYS CB C -10.553 2.595 -13.160 1.00 . A A . 3 LYS CB 1 1 4 1592 1 1 3 LYS CD C -10.633 4.290 -15.098 1.00 . A A . 3 LYS CD 1 1 4 1593 1 1 3 LYS CE C -10.201 4.709 -16.522 1.00 . A A . 3 LYS CE 1 1 4 1594 1 1 3 LYS CG C -9.980 3.001 -14.544 1.00 . A A . 3 LYS CG 1 1 4 1595 1 1 3 LYS H H -9.798 -0.587 -13.793 1.00 . A A . 3 LYS H 1 1 4 1596 1 1 3 LYS HA H -8.909 1.291 -12.581 1.00 . A A . 3 LYS HA 1 1 4 1597 1 1 3 LYS HB2 H -11.659 2.555 -13.205 1.00 . A A . 3 LYS HB2 1 1 4 1598 1 1 3 LYS HB3 H -10.341 3.410 -12.440 1.00 . A A . 3 LYS HB3 1 1 4 1599 1 1 3 LYS HD2 H -11.731 4.132 -15.113 1.00 . A A . 3 LYS HD2 1 1 4 1600 1 1 3 LYS HD3 H -10.491 5.125 -14.383 1.00 . A A . 3 LYS HD3 1 1 4 1601 1 1 3 LYS HE2 H -10.325 3.853 -17.223 1.00 . A A . 3 LYS HE2 1 1 4 1602 1 1 3 LYS HE3 H -10.910 5.479 -16.902 1.00 . A A . 3 LYS HE3 1 1 4 1603 1 1 3 LYS HG2 H -8.881 3.118 -14.465 1.00 . A A . 3 LYS HG2 1 1 4 1604 1 1 3 LYS HG3 H -10.137 2.171 -15.261 1.00 . A A . 3 LYS HG3 1 1 4 1605 1 1 3 LYS HZ1 H -8.683 6.055 -15.940 1.00 . A A . 3 LYS HZ1 1 1 4 1606 1 1 3 LYS HZ2 H -8.124 4.542 -16.213 1.00 . A A . 3 LYS HZ2 1 1 4 1607 1 1 3 LYS HZ3 H -8.491 5.520 -17.483 1.00 . A A . 3 LYS HZ3 1 1 4 1608 1 1 3 LYS N N -10.469 0.102 -13.424 1.00 . A A . 3 LYS N 1 1 4 1609 1 1 3 LYS NZ N -8.807 5.234 -16.546 1.00 . A A . 3 LYS NZ 1 1 4 1610 1 1 3 LYS O O -11.343 1.704 -10.564 1.00 . A A . 3 LYS O 1 1 4 1611 1 1 4 VAL C C -11.722 -0.920 -9.064 1.00 . A A . 4 VAL C 1 1 4 1612 1 1 4 VAL CA C -10.191 -0.540 -9.073 1.00 . A A . 4 VAL CA 1 1 4 1613 1 1 4 VAL CB C -9.770 0.330 -7.824 1.00 . A A . 4 VAL CB 1 1 4 1614 1 1 4 VAL CG1 C -8.235 0.362 -7.635 1.00 . A A . 4 VAL CG1 1 1 4 1615 1 1 4 VAL CG2 C -10.297 1.778 -7.694 1.00 . A A . 4 VAL CG2 1 1 4 1616 1 1 4 VAL H H -9.057 -0.391 -10.956 1.00 . A A . 4 VAL H 1 1 4 1617 1 1 4 VAL HA H -9.651 -1.503 -8.977 1.00 . A A . 4 VAL HA 1 1 4 1618 1 1 4 VAL HB H -10.164 -0.207 -6.938 1.00 . A A . 4 VAL HB 1 1 4 1619 1 1 4 VAL HG11 H -7.793 -0.651 -7.638 1.00 . A A . 4 VAL HG11 1 1 4 1620 1 1 4 VAL HG12 H -7.735 0.935 -8.438 1.00 . A A . 4 VAL HG12 1 1 4 1621 1 1 4 VAL HG13 H -7.949 0.832 -6.675 1.00 . A A . 4 VAL HG13 1 1 4 1622 1 1 4 VAL HG21 H -11.398 1.827 -7.759 1.00 . A A . 4 VAL HG21 1 1 4 1623 1 1 4 VAL HG22 H -10.019 2.233 -6.725 1.00 . A A . 4 VAL HG22 1 1 4 1624 1 1 4 VAL HG23 H -9.898 2.438 -8.486 1.00 . A A . 4 VAL HG23 1 1 4 1625 1 1 4 VAL N N -9.767 0.076 -10.383 1.00 . A A . 4 VAL N 1 1 4 1626 1 1 4 VAL O O -12.612 -0.122 -8.745 1.00 . A A . 4 VAL O 1 1 4 1627 1 1 5 LYS C C -13.259 -4.242 -9.306 1.00 . A A . 5 LYS C 1 1 4 1628 1 1 5 LYS CA C -13.415 -2.705 -9.492 1.00 . A A . 5 LYS CA 1 1 4 1629 1 1 5 LYS CB C -14.145 -2.297 -10.814 1.00 . A A . 5 LYS CB 1 1 4 1630 1 1 5 LYS CD C -15.910 -0.558 -9.928 1.00 . A A . 5 LYS CD 1 1 4 1631 1 1 5 LYS CE C -15.637 0.751 -10.703 1.00 . A A . 5 LYS CE 1 1 4 1632 1 1 5 LYS CG C -15.631 -1.895 -10.665 1.00 . A A . 5 LYS CG 1 1 4 1633 1 1 5 LYS H H -11.232 -2.801 -9.614 1.00 . A A . 5 LYS H 1 1 4 1634 1 1 5 LYS HA H -13.975 -2.304 -8.623 1.00 . A A . 5 LYS HA 1 1 4 1635 1 1 5 LYS HB2 H -13.608 -1.482 -11.326 1.00 . A A . 5 LYS HB2 1 1 4 1636 1 1 5 LYS HB3 H -14.080 -3.117 -11.555 1.00 . A A . 5 LYS HB3 1 1 4 1637 1 1 5 LYS HD2 H -16.988 -0.562 -9.666 1.00 . A A . 5 LYS HD2 1 1 4 1638 1 1 5 LYS HD3 H -15.407 -0.540 -8.941 1.00 . A A . 5 LYS HD3 1 1 4 1639 1 1 5 LYS HE2 H -16.083 0.704 -11.721 1.00 . A A . 5 LYS HE2 1 1 4 1640 1 1 5 LYS HE3 H -16.187 1.578 -10.201 1.00 . A A . 5 LYS HE3 1 1 4 1641 1 1 5 LYS HG2 H -16.100 -1.862 -11.668 1.00 . A A . 5 LYS HG2 1 1 4 1642 1 1 5 LYS HG3 H -16.167 -2.715 -10.147 1.00 . A A . 5 LYS HG3 1 1 4 1643 1 1 5 LYS HZ1 H -13.641 0.702 -9.965 1.00 . A A . 5 LYS HZ1 1 1 4 1644 1 1 5 LYS HZ2 H -13.694 0.696 -11.597 1.00 . A A . 5 LYS HZ2 1 1 4 1645 1 1 5 LYS HZ3 H -13.960 2.085 -10.783 1.00 . A A . 5 LYS HZ3 1 1 4 1646 1 1 5 LYS N N -12.029 -2.161 -9.481 1.00 . A A . 5 LYS N 1 1 4 1647 1 1 5 LYS NZ N -14.187 1.084 -10.765 1.00 . A A . 5 LYS NZ 1 1 4 1648 1 1 5 LYS O O -13.155 -4.995 -10.282 1.00 . A A . 5 LYS O 1 1 4 1649 1 1 6 GLY C C -12.886 -6.646 -6.438 1.00 . A A . 6 GLY C 1 1 4 1650 1 1 6 GLY CA C -12.450 -5.980 -7.759 1.00 . A A . 6 GLY CA 1 1 4 1651 1 1 6 GLY H H -13.222 -3.966 -7.323 1.00 . A A . 6 GLY H 1 1 4 1652 1 1 6 GLY HA2 H -12.632 -6.703 -8.576 1.00 . A A . 6 GLY HA2 1 1 4 1653 1 1 6 GLY HA3 H -11.357 -5.802 -7.778 1.00 . A A . 6 GLY HA3 1 1 4 1654 1 1 6 GLY N N -13.106 -4.683 -8.047 1.00 . A A . 6 GLY N 1 1 4 1655 1 1 6 GLY O O -14.066 -6.637 -6.076 1.00 . A A . 6 GLY O 1 1 4 1656 1 1 7 ILE C C -12.080 -7.356 -3.226 1.00 . A A . 7 ILE C 1 1 4 1657 1 1 7 ILE CA C -12.238 -8.156 -4.571 1.00 . A A . 7 ILE CA 1 1 4 1658 1 1 7 ILE CB C -11.343 -9.448 -4.710 1.00 . A A . 7 ILE CB 1 1 4 1659 1 1 7 ILE CD1 C -13.120 -11.088 -3.697 1.00 . A A . 7 ILE CD1 1 1 4 1660 1 1 7 ILE CG1 C -11.687 -10.527 -3.638 1.00 . A A . 7 ILE CG1 1 1 4 1661 1 1 7 ILE CG2 C -9.816 -9.179 -4.606 1.00 . A A . 7 ILE CG2 1 1 4 1662 1 1 7 ILE H H -10.985 -7.235 -6.126 1.00 . A A . 7 ILE H 1 1 4 1663 1 1 7 ILE HA H -13.293 -8.489 -4.636 1.00 . A A . 7 ILE HA 1 1 4 1664 1 1 7 ILE HB H -11.537 -9.891 -5.707 1.00 . A A . 7 ILE HB 1 1 4 1665 1 1 7 ILE HD11 H -13.374 -11.473 -4.703 1.00 . A A . 7 ILE HD11 1 1 4 1666 1 1 7 ILE HD12 H -13.252 -11.925 -2.987 1.00 . A A . 7 ILE HD12 1 1 4 1667 1 1 7 ILE HD13 H -13.880 -10.331 -3.431 1.00 . A A . 7 ILE HD13 1 1 4 1668 1 1 7 ILE HG12 H -10.999 -11.388 -3.756 1.00 . A A . 7 ILE HG12 1 1 4 1669 1 1 7 ILE HG13 H -11.486 -10.145 -2.619 1.00 . A A . 7 ILE HG13 1 1 4 1670 1 1 7 ILE HG21 H -9.461 -8.476 -5.381 1.00 . A A . 7 ILE HG21 1 1 4 1671 1 1 7 ILE HG22 H -9.521 -8.751 -3.631 1.00 . A A . 7 ILE HG22 1 1 4 1672 1 1 7 ILE HG23 H -9.223 -10.102 -4.749 1.00 . A A . 7 ILE HG23 1 1 4 1673 1 1 7 ILE N N -11.933 -7.281 -5.741 1.00 . A A . 7 ILE N 1 1 4 1674 1 1 7 ILE O O -11.030 -6.780 -2.922 1.00 . A A . 7 ILE O 1 1 4 1675 1 1 8 THR C C -12.446 -6.815 0.006 1.00 . A A . 8 THR C 1 1 4 1676 1 1 8 THR CA C -13.289 -6.400 -1.252 1.00 . A A . 8 THR CA 1 1 4 1677 1 1 8 THR CB C -14.816 -6.307 -0.906 1.00 . A A . 8 THR CB 1 1 4 1678 1 1 8 THR CG2 C -15.151 -5.216 0.126 1.00 . A A . 8 THR CG2 1 1 4 1679 1 1 8 THR H H -14.009 -7.694 -2.861 1.00 . A A . 8 THR H 1 1 4 1680 1 1 8 THR HA H -12.929 -5.395 -1.549 1.00 . A A . 8 THR HA 1 1 4 1681 1 1 8 THR HB H -15.154 -7.293 -0.528 1.00 . A A . 8 THR HB 1 1 4 1682 1 1 8 THR HG1 H -15.542 -5.011 -2.133 1.00 . A A . 8 THR HG1 1 1 4 1683 1 1 8 THR HG21 H -14.808 -4.213 -0.191 1.00 . A A . 8 THR HG21 1 1 4 1684 1 1 8 THR HG22 H -16.241 -5.152 0.304 1.00 . A A . 8 THR HG22 1 1 4 1685 1 1 8 THR HG23 H -14.684 -5.422 1.108 1.00 . A A . 8 THR HG23 1 1 4 1686 1 1 8 THR N N -13.158 -7.330 -2.419 1.00 . A A . 8 THR N 1 1 4 1687 1 1 8 THR O O -11.817 -5.937 0.602 1.00 . A A . 8 THR O 1 1 4 1688 1 1 8 THR OG1 O -15.588 -5.968 -2.055 1.00 . A A . 8 THR OG1 1 1 4 1689 1 1 9 GLN C C -10.770 -9.802 1.308 1.00 . A A . 9 GLN C 1 1 4 1690 1 1 9 GLN CA C -11.655 -8.550 1.612 1.00 . A A . 9 GLN CA 1 1 4 1691 1 1 9 GLN CB C -12.640 -8.718 2.812 1.00 . A A . 9 GLN CB 1 1 4 1692 1 1 9 GLN CD C -14.636 -9.902 3.959 1.00 . A A . 9 GLN CD 1 1 4 1693 1 1 9 GLN CG C -13.796 -9.754 2.689 1.00 . A A . 9 GLN CG 1 1 4 1694 1 1 9 GLN H H -12.749 -8.770 -0.245 1.00 . A A . 9 GLN H 1 1 4 1695 1 1 9 GLN HA H -10.896 -7.807 1.855 1.00 . A A . 9 GLN HA 1 1 4 1696 1 1 9 GLN HB2 H -12.035 -8.963 3.708 1.00 . A A . 9 GLN HB2 1 1 4 1697 1 1 9 GLN HB3 H -13.076 -7.727 3.047 1.00 . A A . 9 GLN HB3 1 1 4 1698 1 1 9 GLN HE21 H -13.379 -11.275 4.683 1.00 . A A . 9 GLN HE21 1 1 4 1699 1 1 9 GLN HE22 H -14.851 -10.805 5.694 1.00 . A A . 9 GLN HE22 1 1 4 1700 1 1 9 GLN HG2 H -14.477 -9.453 1.872 1.00 . A A . 9 GLN HG2 1 1 4 1701 1 1 9 GLN HG3 H -13.409 -10.742 2.380 1.00 . A A . 9 GLN HG3 1 1 4 1702 1 1 9 GLN N N -12.442 -8.095 0.441 1.00 . A A . 9 GLN N 1 1 4 1703 1 1 9 GLN NE2 N -14.250 -10.769 4.866 1.00 . A A . 9 GLN NE2 1 1 4 1704 1 1 9 GLN O O -10.935 -10.876 1.882 1.00 . A A . 9 GLN O 1 1 4 1705 1 1 9 GLN OE1 O -15.653 -9.245 4.150 1.00 . A A . 9 GLN OE1 1 1 4 1706 1 1 10 GLY C C -7.940 -8.516 -0.954 1.00 . A A . 10 GLY C 1 1 4 1707 1 1 10 GLY CA C -9.377 -8.640 -0.398 1.00 . A A . 10 GLY CA 1 1 4 1708 1 1 10 GLY H H -8.906 -9.883 1.332 1.00 . A A . 10 GLY H 1 1 4 1709 1 1 10 GLY HA2 H -10.059 -8.790 -1.254 1.00 . A A . 10 GLY HA2 1 1 4 1710 1 1 10 GLY HA3 H -9.643 -7.638 -0.011 1.00 . A A . 10 GLY HA3 1 1 4 1711 1 1 10 GLY N N -9.621 -9.686 0.632 1.00 . A A . 10 GLY N 1 1 4 1712 1 1 10 GLY O O -7.347 -7.460 -0.719 1.00 . A A . 10 GLY O 1 1 4 1713 1 1 11 PRO C C -6.139 -8.299 -3.761 1.00 . A A . 11 PRO C 1 1 4 1714 1 1 11 PRO CA C -6.071 -9.206 -2.474 1.00 . A A . 11 PRO CA 1 1 4 1715 1 1 11 PRO CB C -5.622 -10.661 -2.733 1.00 . A A . 11 PRO CB 1 1 4 1716 1 1 11 PRO CD C -7.888 -10.825 -1.926 1.00 . A A . 11 PRO CD 1 1 4 1717 1 1 11 PRO CG C -6.912 -11.465 -2.914 1.00 . A A . 11 PRO CG 1 1 4 1718 1 1 11 PRO HA H -5.345 -8.707 -1.804 1.00 . A A . 11 PRO HA 1 1 4 1719 1 1 11 PRO HB2 H -4.933 -10.765 -3.594 1.00 . A A . 11 PRO HB2 1 1 4 1720 1 1 11 PRO HB3 H -5.065 -11.042 -1.853 1.00 . A A . 11 PRO HB3 1 1 4 1721 1 1 11 PRO HD2 H -8.929 -10.854 -2.297 1.00 . A A . 11 PRO HD2 1 1 4 1722 1 1 11 PRO HD3 H -7.866 -11.361 -0.956 1.00 . A A . 11 PRO HD3 1 1 4 1723 1 1 11 PRO HG2 H -7.284 -11.356 -3.951 1.00 . A A . 11 PRO HG2 1 1 4 1724 1 1 11 PRO HG3 H -6.771 -12.547 -2.732 1.00 . A A . 11 PRO HG3 1 1 4 1725 1 1 11 PRO N N -7.369 -9.451 -1.771 1.00 . A A . 11 PRO N 1 1 4 1726 1 1 11 PRO O O -5.474 -8.559 -4.769 1.00 . A A . 11 PRO O 1 1 4 1727 1 1 12 ASN C C -5.660 -5.122 -4.489 1.00 . A A . 12 ASN C 1 1 4 1728 1 1 12 ASN CA C -6.858 -6.105 -4.737 1.00 . A A . 12 ASN CA 1 1 4 1729 1 1 12 ASN CB C -8.264 -5.441 -4.677 1.00 . A A . 12 ASN CB 1 1 4 1730 1 1 12 ASN CG C -8.600 -4.517 -5.850 1.00 . A A . 12 ASN CG 1 1 4 1731 1 1 12 ASN H H -7.250 -7.008 -2.752 1.00 . A A . 12 ASN H 1 1 4 1732 1 1 12 ASN HA H -6.732 -6.558 -5.744 1.00 . A A . 12 ASN HA 1 1 4 1733 1 1 12 ASN HB2 H -9.050 -6.219 -4.672 1.00 . A A . 12 ASN HB2 1 1 4 1734 1 1 12 ASN HB3 H -8.409 -4.907 -3.718 1.00 . A A . 12 ASN HB3 1 1 4 1735 1 1 12 ASN HD21 H -7.621 -3.028 -4.988 1.00 . A A . 12 ASN HD21 1 1 4 1736 1 1 12 ASN HD22 H -8.419 -2.724 -6.625 1.00 . A A . 12 ASN HD22 1 1 4 1737 1 1 12 ASN N N -6.856 -7.161 -3.687 1.00 . A A . 12 ASN N 1 1 4 1738 1 1 12 ASN ND2 N -8.240 -3.260 -5.773 1.00 . A A . 12 ASN ND2 1 1 4 1739 1 1 12 ASN O O -5.811 -4.015 -3.964 1.00 . A A . 12 ASN O 1 1 4 1740 1 1 12 ASN OD1 O -9.188 -4.918 -6.847 1.00 . A A . 12 ASN OD1 1 1 4 1741 1 1 13 GLU C C -2.355 -4.048 -5.194 1.00 . A A . 13 GLU C 1 1 4 1742 1 1 13 GLU CA C -3.178 -5.034 -4.295 1.00 . A A . 13 GLU CA 1 1 4 1743 1 1 13 GLU CB C -2.350 -6.300 -3.908 1.00 . A A . 13 GLU CB 1 1 4 1744 1 1 13 GLU CD C -0.982 -8.415 -4.573 1.00 . A A . 13 GLU CD 1 1 4 1745 1 1 13 GLU CG C -1.824 -7.226 -5.043 1.00 . A A . 13 GLU CG 1 1 4 1746 1 1 13 GLU H H -4.534 -6.602 -5.021 1.00 . A A . 13 GLU H 1 1 4 1747 1 1 13 GLU HA H -3.385 -4.424 -3.388 1.00 . A A . 13 GLU HA 1 1 4 1748 1 1 13 GLU HB2 H -1.481 -5.971 -3.316 1.00 . A A . 13 GLU HB2 1 1 4 1749 1 1 13 GLU HB3 H -2.932 -6.908 -3.186 1.00 . A A . 13 GLU HB3 1 1 4 1750 1 1 13 GLU HE2 H -0.426 -10.142 -5.183 1.00 . A A . 13 GLU HE2 1 1 4 1751 1 1 13 GLU HG2 H -2.673 -7.616 -5.636 1.00 . A A . 13 GLU HG2 1 1 4 1752 1 1 13 GLU HG3 H -1.212 -6.646 -5.759 1.00 . A A . 13 GLU HG3 1 1 4 1753 1 1 13 GLU N N -4.456 -5.591 -4.840 1.00 . A A . 13 GLU N 1 1 4 1754 1 1 13 GLU O O -1.397 -3.455 -4.684 1.00 . A A . 13 GLU O 1 1 4 1755 1 1 13 GLU OE1 O -0.373 -8.465 -3.504 1.00 . A A . 13 GLU OE1 1 1 4 1756 1 1 13 GLU OE2 O -0.968 -9.416 -5.496 1.00 . A A . 13 GLU OE2 1 1 4 1757 1 1 14 SER C C -2.433 -1.236 -6.756 1.00 . A A . 14 SER C 1 1 4 1758 1 1 14 SER CA C -2.199 -2.704 -7.295 1.00 . A A . 14 SER CA 1 1 4 1759 1 1 14 SER CB C -2.826 -2.854 -8.700 1.00 . A A . 14 SER CB 1 1 4 1760 1 1 14 SER H H -3.542 -4.386 -6.751 1.00 . A A . 14 SER H 1 1 4 1761 1 1 14 SER HA H -1.101 -2.828 -7.381 1.00 . A A . 14 SER HA 1 1 4 1762 1 1 14 SER HB2 H -2.697 -3.886 -9.084 1.00 . A A . 14 SER HB2 1 1 4 1763 1 1 14 SER HB3 H -3.919 -2.675 -8.681 1.00 . A A . 14 SER HB3 1 1 4 1764 1 1 14 SER HG H -2.066 -1.118 -9.166 1.00 . A A . 14 SER HG 1 1 4 1765 1 1 14 SER N N -2.738 -3.817 -6.464 1.00 . A A . 14 SER N 1 1 4 1766 1 1 14 SER O O -1.509 -0.453 -6.991 1.00 . A A . 14 SER O 1 1 4 1767 1 1 14 SER OG O -2.208 -1.956 -9.623 1.00 . A A . 14 SER OG 1 1 4 1768 1 1 15 PRO C C -2.663 0.780 -4.215 1.00 . A A . 15 PRO C 1 1 4 1769 1 1 15 PRO CA C -3.579 0.596 -5.469 1.00 . A A . 15 PRO CA 1 1 4 1770 1 1 15 PRO CB C -5.081 0.772 -5.166 1.00 . A A . 15 PRO CB 1 1 4 1771 1 1 15 PRO CD C -4.832 -1.467 -5.996 1.00 . A A . 15 PRO CD 1 1 4 1772 1 1 15 PRO CG C -5.579 -0.656 -4.940 1.00 . A A . 15 PRO CG 1 1 4 1773 1 1 15 PRO HA H -3.262 1.363 -6.204 1.00 . A A . 15 PRO HA 1 1 4 1774 1 1 15 PRO HB2 H -5.287 1.438 -4.305 1.00 . A A . 15 PRO HB2 1 1 4 1775 1 1 15 PRO HB3 H -5.592 1.224 -6.039 1.00 . A A . 15 PRO HB3 1 1 4 1776 1 1 15 PRO HD2 H -4.765 -2.518 -5.681 1.00 . A A . 15 PRO HD2 1 1 4 1777 1 1 15 PRO HD3 H -5.356 -1.438 -6.971 1.00 . A A . 15 PRO HD3 1 1 4 1778 1 1 15 PRO HG2 H -5.319 -1.013 -3.926 1.00 . A A . 15 PRO HG2 1 1 4 1779 1 1 15 PRO HG3 H -6.668 -0.748 -5.004 1.00 . A A . 15 PRO HG3 1 1 4 1780 1 1 15 PRO N N -3.534 -0.766 -6.082 1.00 . A A . 15 PRO N 1 1 4 1781 1 1 15 PRO O O -1.826 1.688 -4.211 1.00 . A A . 15 PRO O 1 1 4 1782 1 1 16 SER C C -2.086 -1.292 -1.093 1.00 . A A . 16 SER C 1 1 4 1783 1 1 16 SER CA C -1.909 -0.007 -1.971 1.00 . A A . 16 SER CA 1 1 4 1784 1 1 16 SER CB C -2.134 1.283 -1.130 1.00 . A A . 16 SER CB 1 1 4 1785 1 1 16 SER H H -3.427 -0.836 -3.352 1.00 . A A . 16 SER H 1 1 4 1786 1 1 16 SER HA H -0.877 -0.012 -2.351 1.00 . A A . 16 SER HA 1 1 4 1787 1 1 16 SER HB2 H -3.209 1.439 -0.912 1.00 . A A . 16 SER HB2 1 1 4 1788 1 1 16 SER HB3 H -1.639 1.202 -0.143 1.00 . A A . 16 SER HB3 1 1 4 1789 1 1 16 SER HG H -1.700 2.251 -2.760 1.00 . A A . 16 SER HG 1 1 4 1790 1 1 16 SER N N -2.822 -0.032 -3.146 1.00 . A A . 16 SER N 1 1 4 1791 1 1 16 SER O O -2.706 -1.282 -0.026 1.00 . A A . 16 SER O 1 1 4 1792 1 1 16 SER OG O -1.598 2.423 -1.801 1.00 . A A . 16 SER OG 1 1 4 1793 1 1 17 ALA C C 0.258 -4.213 -1.086 1.00 . A A . 17 ALA C 1 1 4 1794 1 1 17 ALA CA C -1.067 -3.519 -0.617 1.00 . A A . 17 ALA CA 1 1 4 1795 1 1 17 ALA CB C -2.233 -4.523 -0.510 1.00 . A A . 17 ALA CB 1 1 4 1796 1 1 17 ALA H H -1.112 -2.319 -2.489 1.00 . A A . 17 ALA H 1 1 4 1797 1 1 17 ALA HA H -0.861 -3.122 0.399 1.00 . A A . 17 ALA HA 1 1 4 1798 1 1 17 ALA HB1 H -3.159 -4.032 -0.155 1.00 . A A . 17 ALA HB1 1 1 4 1799 1 1 17 ALA HB2 H -2.470 -5.012 -1.465 1.00 . A A . 17 ALA HB2 1 1 4 1800 1 1 17 ALA HB3 H -2.007 -5.326 0.215 1.00 . A A . 17 ALA HB3 1 1 4 1801 1 1 17 ALA N N -1.453 -2.396 -1.525 1.00 . A A . 17 ALA N 1 1 4 1802 1 1 17 ALA O O 1.123 -4.453 -0.242 1.00 . A A . 17 ALA O 1 1 4 1803 1 1 18 PHE C C 2.884 -3.627 -2.786 1.00 . A A . 18 PHE C 1 1 4 1804 1 1 18 PHE CA C 1.842 -4.799 -2.938 1.00 . A A . 18 PHE CA 1 1 4 1805 1 1 18 PHE CB C 1.644 -5.210 -4.426 1.00 . A A . 18 PHE CB 1 1 4 1806 1 1 18 PHE CD1 C 2.994 -7.309 -4.942 1.00 . A A . 18 PHE CD1 1 1 4 1807 1 1 18 PHE CD2 C 3.859 -5.182 -5.691 1.00 . A A . 18 PHE CD2 1 1 4 1808 1 1 18 PHE CE1 C 4.118 -7.948 -5.462 1.00 . A A . 18 PHE CE1 1 1 4 1809 1 1 18 PHE CE2 C 4.982 -5.823 -6.209 1.00 . A A . 18 PHE CE2 1 1 4 1810 1 1 18 PHE CG C 2.860 -5.921 -5.047 1.00 . A A . 18 PHE CG 1 1 4 1811 1 1 18 PHE CZ C 5.111 -7.204 -6.094 1.00 . A A . 18 PHE CZ 1 1 4 1812 1 1 18 PHE H H -0.294 -4.225 -3.021 1.00 . A A . 18 PHE H 1 1 4 1813 1 1 18 PHE HA H 2.255 -5.652 -2.374 1.00 . A A . 18 PHE HA 1 1 4 1814 1 1 18 PHE HB2 H 0.772 -5.885 -4.523 1.00 . A A . 18 PHE HB2 1 1 4 1815 1 1 18 PHE HB3 H 1.361 -4.330 -5.037 1.00 . A A . 18 PHE HB3 1 1 4 1816 1 1 18 PHE HD1 H 2.234 -7.898 -4.452 1.00 . A A . 18 PHE HD1 1 1 4 1817 1 1 18 PHE HD2 H 3.778 -4.108 -5.774 1.00 . A A . 18 PHE HD2 1 1 4 1818 1 1 18 PHE HE1 H 4.221 -9.020 -5.378 1.00 . A A . 18 PHE HE1 1 1 4 1819 1 1 18 PHE HE2 H 5.755 -5.248 -6.698 1.00 . A A . 18 PHE HE2 1 1 4 1820 1 1 18 PHE HZ H 5.983 -7.699 -6.498 1.00 . A A . 18 PHE HZ 1 1 4 1821 1 1 18 PHE N N 0.482 -4.479 -2.396 1.00 . A A . 18 PHE N 1 1 4 1822 1 1 18 PHE O O 4.040 -3.875 -2.440 1.00 . A A . 18 PHE O 1 1 4 1823 1 1 19 LEU C C 3.684 -1.197 -1.006 1.00 . A A . 19 LEU C 1 1 4 1824 1 1 19 LEU CA C 3.183 -1.146 -2.499 1.00 . A A . 19 LEU CA 1 1 4 1825 1 1 19 LEU CB C 2.198 0.051 -2.708 1.00 . A A . 19 LEU CB 1 1 4 1826 1 1 19 LEU CD1 C 3.169 1.026 -4.889 1.00 . A A . 19 LEU CD1 1 1 4 1827 1 1 19 LEU CD2 C 1.058 -0.343 -5.021 1.00 . A A . 19 LEU CD2 1 1 4 1828 1 1 19 LEU CG C 1.899 0.594 -4.136 1.00 . A A . 19 LEU CG 1 1 4 1829 1 1 19 LEU H H 1.491 -2.323 -3.297 1.00 . A A . 19 LEU H 1 1 4 1830 1 1 19 LEU HA H 4.088 -1.001 -3.118 1.00 . A A . 19 LEU HA 1 1 4 1831 1 1 19 LEU HB2 H 1.245 -0.174 -2.200 1.00 . A A . 19 LEU HB2 1 1 4 1832 1 1 19 LEU HB3 H 2.561 0.919 -2.129 1.00 . A A . 19 LEU HB3 1 1 4 1833 1 1 19 LEU HD11 H 3.776 1.734 -4.296 1.00 . A A . 19 LEU HD11 1 1 4 1834 1 1 19 LEU HD12 H 3.817 0.167 -5.142 1.00 . A A . 19 LEU HD12 1 1 4 1835 1 1 19 LEU HD13 H 2.924 1.535 -5.840 1.00 . A A . 19 LEU HD13 1 1 4 1836 1 1 19 LEU HD21 H 0.121 -0.658 -4.526 1.00 . A A . 19 LEU HD21 1 1 4 1837 1 1 19 LEU HD22 H 0.755 0.162 -5.957 1.00 . A A . 19 LEU HD22 1 1 4 1838 1 1 19 LEU HD23 H 1.604 -1.255 -5.319 1.00 . A A . 19 LEU HD23 1 1 4 1839 1 1 19 LEU HG H 1.284 1.507 -3.997 1.00 . A A . 19 LEU HG 1 1 4 1840 1 1 19 LEU N N 2.458 -2.366 -2.969 1.00 . A A . 19 LEU N 1 1 4 1841 1 1 19 LEU O O 4.829 -0.827 -0.743 1.00 . A A . 19 LEU O 1 1 4 1842 1 1 20 GLU C C 4.241 -3.209 1.515 1.00 . A A . 20 GLU C 1 1 4 1843 1 1 20 GLU CA C 3.311 -1.961 1.345 1.00 . A A . 20 GLU CA 1 1 4 1844 1 1 20 GLU CB C 2.038 -2.113 2.223 1.00 . A A . 20 GLU CB 1 1 4 1845 1 1 20 GLU CD C -0.017 -0.989 3.287 1.00 . A A . 20 GLU CD 1 1 4 1846 1 1 20 GLU CG C 1.277 -0.792 2.503 1.00 . A A . 20 GLU CG 1 1 4 1847 1 1 20 GLU H H 1.903 -1.828 -0.307 1.00 . A A . 20 GLU H 1 1 4 1848 1 1 20 GLU HA H 3.906 -1.095 1.654 1.00 . A A . 20 GLU HA 1 1 4 1849 1 1 20 GLU HB2 H 1.353 -2.863 1.779 1.00 . A A . 20 GLU HB2 1 1 4 1850 1 1 20 GLU HB3 H 2.323 -2.556 3.197 1.00 . A A . 20 GLU HB3 1 1 4 1851 1 1 20 GLU HE2 H -1.858 -1.390 3.004 1.00 . A A . 20 GLU HE2 1 1 4 1852 1 1 20 GLU HG2 H 1.922 -0.091 3.063 1.00 . A A . 20 GLU HG2 1 1 4 1853 1 1 20 GLU HG3 H 1.032 -0.274 1.558 1.00 . A A . 20 GLU HG3 1 1 4 1854 1 1 20 GLU N N 2.872 -1.690 -0.046 1.00 . A A . 20 GLU N 1 1 4 1855 1 1 20 GLU O O 5.187 -3.118 2.299 1.00 . A A . 20 GLU O 1 1 4 1856 1 1 20 GLU OE1 O -0.110 -0.868 4.504 1.00 . A A . 20 GLU OE1 1 1 4 1857 1 1 20 GLU OE2 O -1.062 -1.308 2.476 1.00 . A A . 20 GLU OE2 1 1 4 1858 1 1 21 ARG C C 6.500 -4.890 0.220 1.00 . A A . 21 ARG C 1 1 4 1859 1 1 21 ARG CA C 5.082 -5.415 0.674 1.00 . A A . 21 ARG CA 1 1 4 1860 1 1 21 ARG CB C 4.604 -6.507 -0.331 1.00 . A A . 21 ARG CB 1 1 4 1861 1 1 21 ARG CD C 2.958 -8.365 -1.042 1.00 . A A . 21 ARG CD 1 1 4 1862 1 1 21 ARG CG C 3.265 -7.233 -0.031 1.00 . A A . 21 ARG CG 1 1 4 1863 1 1 21 ARG CZ C 0.702 -9.299 -0.412 1.00 . A A . 21 ARG CZ 1 1 4 1864 1 1 21 ARG H H 3.163 -4.385 0.294 1.00 . A A . 21 ARG H 1 1 4 1865 1 1 21 ARG HA H 5.186 -5.858 1.673 1.00 . A A . 21 ARG HA 1 1 4 1866 1 1 21 ARG HB2 H 4.554 -6.071 -1.347 1.00 . A A . 21 ARG HB2 1 1 4 1867 1 1 21 ARG HB3 H 5.399 -7.275 -0.403 1.00 . A A . 21 ARG HB3 1 1 4 1868 1 1 21 ARG HD2 H 3.376 -8.095 -2.034 1.00 . A A . 21 ARG HD2 1 1 4 1869 1 1 21 ARG HD3 H 3.506 -9.291 -0.774 1.00 . A A . 21 ARG HD3 1 1 4 1870 1 1 21 ARG HE H 1.014 -8.336 -2.101 1.00 . A A . 21 ARG HE 1 1 4 1871 1 1 21 ARG HG2 H 3.273 -7.629 1.001 1.00 . A A . 21 ARG HG2 1 1 4 1872 1 1 21 ARG HG3 H 2.445 -6.491 -0.036 1.00 . A A . 21 ARG HG3 1 1 4 1873 1 1 21 ARG HH11 H 2.061 -9.570 0.968 1.00 . A A . 21 ARG HH11 1 1 4 1874 1 1 21 ARG HH12 H 0.405 -10.273 1.319 1.00 . A A . 21 ARG HH12 1 1 4 1875 1 1 21 ARG HH21 H -0.770 -9.129 -1.717 1.00 . A A . 21 ARG HH21 1 1 4 1876 1 1 21 ARG HH22 H -1.144 -10.015 -0.158 1.00 . A A . 21 ARG HH22 1 1 4 1877 1 1 21 ARG N N 4.055 -4.334 0.788 1.00 . A A . 21 ARG N 1 1 4 1878 1 1 21 ARG NE N 1.499 -8.622 -1.237 1.00 . A A . 21 ARG NE 1 1 4 1879 1 1 21 ARG NH1 N 1.086 -9.774 0.744 1.00 . A A . 21 ARG NH1 1 1 4 1880 1 1 21 ARG NH2 N -0.530 -9.493 -0.785 1.00 . A A . 21 ARG NH2 1 1 4 1881 1 1 21 ARG O O 7.510 -5.230 0.843 1.00 . A A . 21 ARG O 1 1 4 1882 1 1 22 LEU C C 8.254 -2.245 -0.082 1.00 . A A . 22 LEU C 1 1 4 1883 1 1 22 LEU CA C 7.766 -3.251 -1.184 1.00 . A A . 22 LEU CA 1 1 4 1884 1 1 22 LEU CB C 7.471 -2.489 -2.511 1.00 . A A . 22 LEU CB 1 1 4 1885 1 1 22 LEU CD1 C 6.765 -2.404 -4.943 1.00 . A A . 22 LEU CD1 1 1 4 1886 1 1 22 LEU CD2 C 8.390 -4.179 -4.224 1.00 . A A . 22 LEU CD2 1 1 4 1887 1 1 22 LEU CG C 7.183 -3.329 -3.787 1.00 . A A . 22 LEU CG 1 1 4 1888 1 1 22 LEU H H 5.674 -3.797 -1.263 1.00 . A A . 22 LEU H 1 1 4 1889 1 1 22 LEU HA H 8.565 -3.980 -1.346 1.00 . A A . 22 LEU HA 1 1 4 1890 1 1 22 LEU HB2 H 6.629 -1.790 -2.342 1.00 . A A . 22 LEU HB2 1 1 4 1891 1 1 22 LEU HB3 H 8.331 -1.827 -2.735 1.00 . A A . 22 LEU HB3 1 1 4 1892 1 1 22 LEU HD11 H 5.857 -1.826 -4.694 1.00 . A A . 22 LEU HD11 1 1 4 1893 1 1 22 LEU HD12 H 7.558 -1.676 -5.200 1.00 . A A . 22 LEU HD12 1 1 4 1894 1 1 22 LEU HD13 H 6.533 -2.974 -5.862 1.00 . A A . 22 LEU HD13 1 1 4 1895 1 1 22 LEU HD21 H 9.289 -3.562 -4.406 1.00 . A A . 22 LEU HD21 1 1 4 1896 1 1 22 LEU HD22 H 8.658 -4.933 -3.462 1.00 . A A . 22 LEU HD22 1 1 4 1897 1 1 22 LEU HD23 H 8.181 -4.740 -5.155 1.00 . A A . 22 LEU HD23 1 1 4 1898 1 1 22 LEU HG H 6.334 -4.012 -3.581 1.00 . A A . 22 LEU HG 1 1 4 1899 1 1 22 LEU N N 6.559 -4.017 -0.809 1.00 . A A . 22 LEU N 1 1 4 1900 1 1 22 LEU O O 9.464 -2.173 0.136 1.00 . A A . 22 LEU O 1 1 4 1901 1 1 23 LYS C C 8.400 -1.453 3.004 1.00 . A A . 23 LYS C 1 1 4 1902 1 1 23 LYS CA C 7.779 -0.664 1.801 1.00 . A A . 23 LYS CA 1 1 4 1903 1 1 23 LYS CB C 6.531 0.137 2.275 1.00 . A A . 23 LYS CB 1 1 4 1904 1 1 23 LYS CD C 6.680 2.742 2.078 1.00 . A A . 23 LYS CD 1 1 4 1905 1 1 23 LYS CE C 8.202 2.879 2.281 1.00 . A A . 23 LYS CE 1 1 4 1906 1 1 23 LYS CG C 6.212 1.410 1.446 1.00 . A A . 23 LYS CG 1 1 4 1907 1 1 23 LYS H H 6.378 -1.735 0.448 1.00 . A A . 23 LYS H 1 1 4 1908 1 1 23 LYS HA H 8.567 0.037 1.469 1.00 . A A . 23 LYS HA 1 1 4 1909 1 1 23 LYS HB2 H 5.649 -0.528 2.300 1.00 . A A . 23 LYS HB2 1 1 4 1910 1 1 23 LYS HB3 H 6.636 0.428 3.340 1.00 . A A . 23 LYS HB3 1 1 4 1911 1 1 23 LYS HD2 H 6.307 3.572 1.444 1.00 . A A . 23 LYS HD2 1 1 4 1912 1 1 23 LYS HD3 H 6.151 2.867 3.045 1.00 . A A . 23 LYS HD3 1 1 4 1913 1 1 23 LYS HE2 H 8.582 2.049 2.918 1.00 . A A . 23 LYS HE2 1 1 4 1914 1 1 23 LYS HE3 H 8.739 2.769 1.313 1.00 . A A . 23 LYS HE3 1 1 4 1915 1 1 23 LYS HG2 H 6.588 1.312 0.407 1.00 . A A . 23 LYS HG2 1 1 4 1916 1 1 23 LYS HG3 H 5.113 1.468 1.318 1.00 . A A . 23 LYS HG3 1 1 4 1917 1 1 23 LYS HZ1 H 7.819 4.437 3.642 1.00 . A A . 23 LYS HZ1 1 1 4 1918 1 1 23 LYS HZ2 H 9.421 4.222 3.413 1.00 . A A . 23 LYS HZ2 1 1 4 1919 1 1 23 LYS HZ3 H 8.506 4.979 2.254 1.00 . A A . 23 LYS HZ3 1 1 4 1920 1 1 23 LYS N N 7.370 -1.511 0.636 1.00 . A A . 23 LYS N 1 1 4 1921 1 1 23 LYS NZ N 8.502 4.192 2.915 1.00 . A A . 23 LYS NZ 1 1 4 1922 1 1 23 LYS O O 9.361 -0.954 3.593 1.00 . A A . 23 LYS O 1 1 4 1923 1 1 24 GLU C C 9.989 -4.042 3.839 1.00 . A A . 24 GLU C 1 1 4 1924 1 1 24 GLU CA C 8.561 -3.584 4.301 1.00 . A A . 24 GLU CA 1 1 4 1925 1 1 24 GLU CB C 7.628 -4.817 4.507 1.00 . A A . 24 GLU CB 1 1 4 1926 1 1 24 GLU CD C 6.426 -4.228 6.733 1.00 . A A . 24 GLU CD 1 1 4 1927 1 1 24 GLU CG C 6.288 -4.572 5.251 1.00 . A A . 24 GLU CG 1 1 4 1928 1 1 24 GLU H H 7.115 -2.982 2.787 1.00 . A A . 24 GLU H 1 1 4 1929 1 1 24 GLU HA H 8.670 -3.040 5.244 1.00 . A A . 24 GLU HA 1 1 4 1930 1 1 24 GLU HB2 H 7.409 -5.284 3.526 1.00 . A A . 24 GLU HB2 1 1 4 1931 1 1 24 GLU HB3 H 8.181 -5.603 5.060 1.00 . A A . 24 GLU HB3 1 1 4 1932 1 1 24 GLU HE2 H 6.514 -2.733 7.900 1.00 . A A . 24 GLU HE2 1 1 4 1933 1 1 24 GLU HG2 H 5.699 -3.783 4.747 1.00 . A A . 24 GLU HG2 1 1 4 1934 1 1 24 GLU HG3 H 5.662 -5.480 5.180 1.00 . A A . 24 GLU HG3 1 1 4 1935 1 1 24 GLU N N 7.904 -2.658 3.346 1.00 . A A . 24 GLU N 1 1 4 1936 1 1 24 GLU O O 10.933 -3.969 4.630 1.00 . A A . 24 GLU O 1 1 4 1937 1 1 24 GLU OE1 O 6.534 -5.066 7.622 1.00 . A A . 24 GLU OE1 1 1 4 1938 1 1 24 GLU OE2 O 6.415 -2.885 6.959 1.00 . A A . 24 GLU OE2 1 1 4 1939 1 1 25 ALA C C 12.437 -3.473 1.922 1.00 . A A . 25 ALA C 1 1 4 1940 1 1 25 ALA CA C 11.477 -4.715 1.951 1.00 . A A . 25 ALA CA 1 1 4 1941 1 1 25 ALA CB C 11.200 -5.255 0.533 1.00 . A A . 25 ALA CB 1 1 4 1942 1 1 25 ALA H H 9.293 -4.534 2.021 1.00 . A A . 25 ALA H 1 1 4 1943 1 1 25 ALA HA H 11.960 -5.495 2.556 1.00 . A A . 25 ALA HA 1 1 4 1944 1 1 25 ALA HB1 H 10.556 -6.155 0.551 1.00 . A A . 25 ALA HB1 1 1 4 1945 1 1 25 ALA HB2 H 10.705 -4.510 -0.116 1.00 . A A . 25 ALA HB2 1 1 4 1946 1 1 25 ALA HB3 H 12.139 -5.550 0.028 1.00 . A A . 25 ALA HB3 1 1 4 1947 1 1 25 ALA N N 10.156 -4.453 2.562 1.00 . A A . 25 ALA N 1 1 4 1948 1 1 25 ALA O O 13.556 -3.590 2.419 1.00 . A A . 25 ALA O 1 1 4 1949 1 1 26 TYR C C 13.183 -0.612 3.030 1.00 . A A . 26 TYR C 1 1 4 1950 1 1 26 TYR CA C 12.801 -1.017 1.558 1.00 . A A . 26 TYR CA 1 1 4 1951 1 1 26 TYR CB C 11.983 0.139 0.899 1.00 . A A . 26 TYR CB 1 1 4 1952 1 1 26 TYR CD1 C 12.326 -0.647 -1.547 1.00 . A A . 26 TYR CD1 1 1 4 1953 1 1 26 TYR CD2 C 10.408 0.713 -1.003 1.00 . A A . 26 TYR CD2 1 1 4 1954 1 1 26 TYR CE1 C 11.892 -0.730 -2.868 1.00 . A A . 26 TYR CE1 1 1 4 1955 1 1 26 TYR CE2 C 9.976 0.630 -2.324 1.00 . A A . 26 TYR CE2 1 1 4 1956 1 1 26 TYR CG C 11.578 0.059 -0.595 1.00 . A A . 26 TYR CG 1 1 4 1957 1 1 26 TYR CZ C 10.714 -0.095 -3.253 1.00 . A A . 26 TYR CZ 1 1 4 1958 1 1 26 TYR H H 11.133 -2.297 0.921 1.00 . A A . 26 TYR H 1 1 4 1959 1 1 26 TYR HA H 13.743 -1.161 1.011 1.00 . A A . 26 TYR HA 1 1 4 1960 1 1 26 TYR HB2 H 11.075 0.299 1.512 1.00 . A A . 26 TYR HB2 1 1 4 1961 1 1 26 TYR HB3 H 12.556 1.079 1.015 1.00 . A A . 26 TYR HB3 1 1 4 1962 1 1 26 TYR HD1 H 13.237 -1.155 -1.267 1.00 . A A . 26 TYR HD1 1 1 4 1963 1 1 26 TYR HD2 H 9.817 1.273 -0.296 1.00 . A A . 26 TYR HD2 1 1 4 1964 1 1 26 TYR HE1 H 12.470 -1.290 -3.587 1.00 . A A . 26 TYR HE1 1 1 4 1965 1 1 26 TYR HE2 H 9.064 1.120 -2.633 1.00 . A A . 26 TYR HE2 1 1 4 1966 1 1 26 TYR HH H 10.893 -0.720 -5.048 1.00 . A A . 26 TYR HH 1 1 4 1967 1 1 26 TYR N N 12.018 -2.283 1.440 1.00 . A A . 26 TYR N 1 1 4 1968 1 1 26 TYR O O 14.305 -0.148 3.252 1.00 . A A . 26 TYR O 1 1 4 1969 1 1 26 TYR OH O 10.268 -0.195 -4.543 1.00 . A A . 26 TYR OH 1 1 4 1970 1 1 27 ARG C C 13.748 -1.652 6.020 1.00 . A A . 27 ARG C 1 1 4 1971 1 1 27 ARG CA C 12.631 -0.674 5.475 1.00 . A A . 27 ARG CA 1 1 4 1972 1 1 27 ARG CB C 11.285 -0.823 6.267 1.00 . A A . 27 ARG CB 1 1 4 1973 1 1 27 ARG CD C 11.392 0.027 8.786 1.00 . A A . 27 ARG CD 1 1 4 1974 1 1 27 ARG CG C 11.007 0.295 7.316 1.00 . A A . 27 ARG CG 1 1 4 1975 1 1 27 ARG CZ C 13.565 -0.143 10.035 1.00 . A A . 27 ARG CZ 1 1 4 1976 1 1 27 ARG H H 11.389 -1.194 3.712 1.00 . A A . 27 ARG H 1 1 4 1977 1 1 27 ARG HA H 13.037 0.346 5.605 1.00 . A A . 27 ARG HA 1 1 4 1978 1 1 27 ARG HB2 H 10.413 -0.800 5.583 1.00 . A A . 27 ARG HB2 1 1 4 1979 1 1 27 ARG HB3 H 11.194 -1.825 6.730 1.00 . A A . 27 ARG HB3 1 1 4 1980 1 1 27 ARG HD2 H 11.059 0.896 9.390 1.00 . A A . 27 ARG HD2 1 1 4 1981 1 1 27 ARG HD3 H 10.837 -0.853 9.170 1.00 . A A . 27 ARG HD3 1 1 4 1982 1 1 27 ARG HE H 13.411 -0.509 8.105 1.00 . A A . 27 ARG HE 1 1 4 1983 1 1 27 ARG HG2 H 11.444 1.259 6.986 1.00 . A A . 27 ARG HG2 1 1 4 1984 1 1 27 ARG HG3 H 9.918 0.501 7.310 1.00 . A A . 27 ARG HG3 1 1 4 1985 1 1 27 ARG HH11 H 12.093 0.488 11.163 1.00 . A A . 27 ARG HH11 1 1 4 1986 1 1 27 ARG HH12 H 13.702 0.238 12.002 1.00 . A A . 27 ARG HH12 1 1 4 1987 1 1 27 ARG HH21 H 15.136 -0.784 9.029 1.00 . A A . 27 ARG HH21 1 1 4 1988 1 1 27 ARG HH22 H 15.369 -0.473 10.817 1.00 . A A . 27 ARG HH22 1 1 4 1989 1 1 27 ARG N N 12.301 -0.834 4.029 1.00 . A A . 27 ARG N 1 1 4 1990 1 1 27 ARG NE N 12.854 -0.188 8.918 1.00 . A A . 27 ARG NE 1 1 4 1991 1 1 27 ARG NH1 N 13.078 0.220 11.194 1.00 . A A . 27 ARG NH1 1 1 4 1992 1 1 27 ARG NH2 N 14.818 -0.483 9.957 1.00 . A A . 27 ARG NH2 1 1 4 1993 1 1 27 ARG O O 14.444 -1.270 6.967 1.00 . A A . 27 ARG O 1 1 4 1994 1 1 28 ARG C C 16.583 -2.881 5.328 1.00 . A A . 28 ARG C 1 1 4 1995 1 1 28 ARG CA C 15.240 -3.638 5.663 1.00 . A A . 28 ARG CA 1 1 4 1996 1 1 28 ARG CB C 15.074 -4.928 4.797 1.00 . A A . 28 ARG CB 1 1 4 1997 1 1 28 ARG CD C 16.600 -6.663 6.086 1.00 . A A . 28 ARG CD 1 1 4 1998 1 1 28 ARG CG C 16.214 -5.983 4.757 1.00 . A A . 28 ARG CG 1 1 4 1999 1 1 28 ARG CZ C 18.210 -6.113 7.936 1.00 . A A . 28 ARG CZ 1 1 4 2000 1 1 28 ARG H H 13.415 -3.106 4.641 1.00 . A A . 28 ARG H 1 1 4 2001 1 1 28 ARG HA H 15.260 -3.902 6.724 1.00 . A A . 28 ARG HA 1 1 4 2002 1 1 28 ARG HB2 H 14.144 -5.448 5.101 1.00 . A A . 28 ARG HB2 1 1 4 2003 1 1 28 ARG HB3 H 14.899 -4.635 3.744 1.00 . A A . 28 ARG HB3 1 1 4 2004 1 1 28 ARG HD2 H 15.691 -6.874 6.687 1.00 . A A . 28 ARG HD2 1 1 4 2005 1 1 28 ARG HD3 H 17.057 -7.647 5.855 1.00 . A A . 28 ARG HD3 1 1 4 2006 1 1 28 ARG HE H 17.718 -4.825 6.506 1.00 . A A . 28 ARG HE 1 1 4 2007 1 1 28 ARG HG2 H 15.895 -6.778 4.054 1.00 . A A . 28 ARG HG2 1 1 4 2008 1 1 28 ARG HG3 H 17.109 -5.559 4.259 1.00 . A A . 28 ARG HG3 1 1 4 2009 1 1 28 ARG HH11 H 17.506 -7.942 8.049 1.00 . A A . 28 ARG HH11 1 1 4 2010 1 1 28 ARG HH12 H 18.661 -7.440 9.378 1.00 . A A . 28 ARG HH12 1 1 4 2011 1 1 28 ARG HH21 H 19.006 -4.304 7.978 1.00 . A A . 28 ARG HH21 1 1 4 2012 1 1 28 ARG HH22 H 19.474 -5.444 9.323 1.00 . A A . 28 ARG HH22 1 1 4 2013 1 1 28 ARG N N 13.995 -2.853 5.442 1.00 . A A . 28 ARG N 1 1 4 2014 1 1 28 ARG NE N 17.562 -5.799 6.821 1.00 . A A . 28 ARG NE 1 1 4 2015 1 1 28 ARG NH1 N 18.124 -7.281 8.523 1.00 . A A . 28 ARG NH1 1 1 4 2016 1 1 28 ARG NH2 N 18.973 -5.203 8.467 1.00 . A A . 28 ARG NH2 1 1 4 2017 1 1 28 ARG O O 17.593 -3.117 6.001 1.00 . A A . 28 ARG O 1 1 4 2018 1 1 29 TYR C C 17.972 0.114 4.211 1.00 . A A . 29 TYR C 1 1 4 2019 1 1 29 TYR CA C 17.829 -1.379 3.755 1.00 . A A . 29 TYR CA 1 1 4 2020 1 1 29 TYR CB C 17.787 -1.509 2.194 1.00 . A A . 29 TYR CB 1 1 4 2021 1 1 29 TYR CD1 C 18.561 -3.932 1.870 1.00 . A A . 29 TYR CD1 1 1 4 2022 1 1 29 TYR CD2 C 16.377 -3.294 1.063 1.00 . A A . 29 TYR CD2 1 1 4 2023 1 1 29 TYR CE1 C 18.276 -5.264 1.575 1.00 . A A . 29 TYR CE1 1 1 4 2024 1 1 29 TYR CE2 C 16.094 -4.625 0.769 1.00 . A A . 29 TYR CE2 1 1 4 2025 1 1 29 TYR CG C 17.604 -2.939 1.634 1.00 . A A . 29 TYR CG 1 1 4 2026 1 1 29 TYR CZ C 17.043 -5.610 1.028 1.00 . A A . 29 TYR CZ 1 1 4 2027 1 1 29 TYR H H 15.684 -1.929 3.830 1.00 . A A . 29 TYR H 1 1 4 2028 1 1 29 TYR HA H 18.736 -1.904 4.117 1.00 . A A . 29 TYR HA 1 1 4 2029 1 1 29 TYR HB2 H 16.994 -0.845 1.796 1.00 . A A . 29 TYR HB2 1 1 4 2030 1 1 29 TYR HB3 H 18.714 -1.086 1.766 1.00 . A A . 29 TYR HB3 1 1 4 2031 1 1 29 TYR HD1 H 19.501 -3.683 2.340 1.00 . A A . 29 TYR HD1 1 1 4 2032 1 1 29 TYR HD2 H 15.607 -2.552 0.912 1.00 . A A . 29 TYR HD2 1 1 4 2033 1 1 29 TYR HE1 H 18.989 -6.035 1.818 1.00 . A A . 29 TYR HE1 1 1 4 2034 1 1 29 TYR HE2 H 15.109 -4.878 0.402 1.00 . A A . 29 TYR HE2 1 1 4 2035 1 1 29 TYR HH H 15.912 -6.983 0.334 1.00 . A A . 29 TYR HH 1 1 4 2036 1 1 29 TYR N N 16.596 -2.024 4.296 1.00 . A A . 29 TYR N 1 1 4 2037 1 1 29 TYR O O 19.074 0.528 4.579 1.00 . A A . 29 TYR O 1 1 4 2038 1 1 29 TYR OH O 16.753 -6.926 0.792 1.00 . A A . 29 TYR OH 1 1 4 2039 1 1 30 THR C C 15.885 2.397 5.917 1.00 . A A . 30 THR C 1 1 4 2040 1 1 30 THR CA C 16.872 2.319 4.694 1.00 . A A . 30 THR CA 1 1 4 2041 1 1 30 THR CB C 16.409 3.261 3.545 1.00 . A A . 30 THR CB 1 1 4 2042 1 1 30 THR CG2 C 16.395 4.750 3.909 1.00 . A A . 30 THR CG2 1 1 4 2043 1 1 30 THR H H 16.004 0.420 4.016 1.00 . A A . 30 THR H 1 1 4 2044 1 1 30 THR HA H 17.887 2.634 4.997 1.00 . A A . 30 THR HA 1 1 4 2045 1 1 30 THR HB H 15.389 2.960 3.245 1.00 . A A . 30 THR HB 1 1 4 2046 1 1 30 THR HG1 H 17.499 2.203 2.378 1.00 . A A . 30 THR HG1 1 1 4 2047 1 1 30 THR HG21 H 17.391 5.106 4.225 1.00 . A A . 30 THR HG21 1 1 4 2048 1 1 30 THR HG22 H 16.084 5.360 3.042 1.00 . A A . 30 THR HG22 1 1 4 2049 1 1 30 THR HG23 H 15.680 4.970 4.722 1.00 . A A . 30 THR HG23 1 1 4 2050 1 1 30 THR N N 16.892 0.921 4.178 1.00 . A A . 30 THR N 1 1 4 2051 1 1 30 THR O O 14.759 1.906 5.781 1.00 . A A . 30 THR O 1 1 4 2052 1 1 30 THR OG1 O 17.294 3.142 2.437 1.00 . A A . 30 THR OG1 1 1 4 2053 1 1 31 PRO C C 13.727 3.567 7.959 1.00 . A A . 31 PRO C 1 1 4 2054 1 1 31 PRO CA C 15.212 3.139 8.234 1.00 . A A . 31 PRO CA 1 1 4 2055 1 1 31 PRO CB C 15.936 4.133 9.166 1.00 . A A . 31 PRO CB 1 1 4 2056 1 1 31 PRO CD C 17.473 3.684 7.360 1.00 . A A . 31 PRO CD 1 1 4 2057 1 1 31 PRO CG C 17.423 3.945 8.866 1.00 . A A . 31 PRO CG 1 1 4 2058 1 1 31 PRO HA H 15.152 2.135 8.688 1.00 . A A . 31 PRO HA 1 1 4 2059 1 1 31 PRO HB2 H 15.646 5.180 8.946 1.00 . A A . 31 PRO HB2 1 1 4 2060 1 1 31 PRO HB3 H 15.696 3.960 10.232 1.00 . A A . 31 PRO HB3 1 1 4 2061 1 1 31 PRO HD2 H 17.566 4.624 6.780 1.00 . A A . 31 PRO HD2 1 1 4 2062 1 1 31 PRO HD3 H 18.330 3.033 7.098 1.00 . A A . 31 PRO HD3 1 1 4 2063 1 1 31 PRO HG2 H 18.034 4.816 9.167 1.00 . A A . 31 PRO HG2 1 1 4 2064 1 1 31 PRO HG3 H 17.819 3.070 9.417 1.00 . A A . 31 PRO HG3 1 1 4 2065 1 1 31 PRO N N 16.171 3.052 7.083 1.00 . A A . 31 PRO N 1 1 4 2066 1 1 31 PRO O O 12.808 3.033 8.582 1.00 . A A . 31 PRO O 1 1 4 2067 1 1 32 TYR C C 11.723 4.055 5.193 1.00 . A A . 32 TYR C 1 1 4 2068 1 1 32 TYR CA C 12.147 4.832 6.489 1.00 . A A . 32 TYR CA 1 1 4 2069 1 1 32 TYR CB C 12.140 6.381 6.279 1.00 . A A . 32 TYR CB 1 1 4 2070 1 1 32 TYR CD1 C 12.960 7.054 3.945 1.00 . A A . 32 TYR CD1 1 1 4 2071 1 1 32 TYR CD2 C 14.341 7.604 5.848 1.00 . A A . 32 TYR CD2 1 1 4 2072 1 1 32 TYR CE1 C 13.905 7.626 3.095 1.00 . A A . 32 TYR CE1 1 1 4 2073 1 1 32 TYR CE2 C 15.283 8.178 4.998 1.00 . A A . 32 TYR CE2 1 1 4 2074 1 1 32 TYR CG C 13.174 7.031 5.327 1.00 . A A . 32 TYR CG 1 1 4 2075 1 1 32 TYR CZ C 15.065 8.187 3.624 1.00 . A A . 32 TYR CZ 1 1 4 2076 1 1 32 TYR H H 14.364 4.878 6.617 1.00 . A A . 32 TYR H 1 1 4 2077 1 1 32 TYR HA H 11.367 4.590 7.238 1.00 . A A . 32 TYR HA 1 1 4 2078 1 1 32 TYR HB2 H 11.127 6.685 5.949 1.00 . A A . 32 TYR HB2 1 1 4 2079 1 1 32 TYR HB3 H 12.218 6.859 7.276 1.00 . A A . 32 TYR HB3 1 1 4 2080 1 1 32 TYR HD1 H 12.064 6.621 3.524 1.00 . A A . 32 TYR HD1 1 1 4 2081 1 1 32 TYR HD2 H 14.524 7.602 6.914 1.00 . A A . 32 TYR HD2 1 1 4 2082 1 1 32 TYR HE1 H 13.733 7.626 2.029 1.00 . A A . 32 TYR HE1 1 1 4 2083 1 1 32 TYR HE2 H 16.186 8.614 5.401 1.00 . A A . 32 TYR HE2 1 1 4 2084 1 1 32 TYR HH H 15.715 8.633 1.886 1.00 . A A . 32 TYR HH 1 1 4 2085 1 1 32 TYR N N 13.501 4.478 7.000 1.00 . A A . 32 TYR N 1 1 4 2086 1 1 32 TYR O O 10.715 4.352 4.546 1.00 . A A . 32 TYR O 1 1 4 2087 1 1 32 TYR OXT O 12.530 2.994 4.860 1.00 . A A . 32 TYR OXT 1 1 4 2088 1 1 32 TYR OH O 16.006 8.732 2.794 1.00 . A A . 32 TYR OH 1 1 5 2089 1 1 1 CYS C C -6.750 10.583 -0.135 1.00 . A A . 1 CYS C 1 1 5 2090 1 1 1 CYS CA C -7.554 9.624 0.805 1.00 . A A . 1 CYS CA 1 1 5 2091 1 1 1 CYS CB C -9.006 10.074 1.093 1.00 . A A . 1 CYS CB 1 1 5 2092 1 1 1 CYS H1 H -5.926 9.139 2.020 1.00 . A A . 1 CYS H1 1 1 5 2093 1 1 1 CYS H2 H -7.378 8.820 2.713 1.00 . A A . 1 CYS H2 1 1 5 2094 1 1 1 CYS HA H -7.608 8.627 0.330 1.00 . A A . 1 CYS HA 1 1 5 2095 1 1 1 CYS HB2 H -9.587 10.103 0.155 1.00 . A A . 1 CYS HB2 1 1 5 2096 1 1 1 CYS HB3 H -9.529 9.352 1.747 1.00 . A A . 1 CYS HB3 1 1 5 2097 1 1 1 CYS HG H -8.570 11.424 3.037 1.00 . A A . 1 CYS HG 1 1 5 2098 1 1 1 CYS N N -6.883 9.496 2.122 1.00 . A A . 1 CYS N 1 1 5 2099 1 1 1 CYS O O -7.060 11.769 -0.283 1.00 . A A . 1 CYS O 1 1 5 2100 1 1 1 CYS SG S -9.093 11.737 1.855 1.00 . A A . 1 CYS SG 1 1 5 2101 1 1 2 ALA C C -4.271 10.014 -2.875 1.00 . A A . 2 ALA C 1 1 5 2102 1 1 2 ALA CA C -4.779 10.845 -1.649 1.00 . A A . 2 ALA CA 1 1 5 2103 1 1 2 ALA CB C -3.599 11.305 -0.766 1.00 . A A . 2 ALA CB 1 1 5 2104 1 1 2 ALA H H -5.498 9.071 -0.550 1.00 . A A . 2 ALA H 1 1 5 2105 1 1 2 ALA HA H -5.308 11.742 -2.032 1.00 . A A . 2 ALA HA 1 1 5 2106 1 1 2 ALA HB1 H -3.950 11.923 0.083 1.00 . A A . 2 ALA HB1 1 1 5 2107 1 1 2 ALA HB2 H -3.032 10.457 -0.339 1.00 . A A . 2 ALA HB2 1 1 5 2108 1 1 2 ALA HB3 H -2.883 11.930 -1.331 1.00 . A A . 2 ALA HB3 1 1 5 2109 1 1 2 ALA N N -5.696 10.047 -0.786 1.00 . A A . 2 ALA N 1 1 5 2110 1 1 2 ALA O O -3.979 8.819 -2.748 1.00 . A A . 2 ALA O 1 1 5 2111 1 1 3 LYS C C -5.172 9.841 -6.115 1.00 . A A . 3 LYS C 1 1 5 2112 1 1 3 LYS CA C -3.810 10.131 -5.399 1.00 . A A . 3 LYS CA 1 1 5 2113 1 1 3 LYS CB C -2.921 8.847 -5.446 1.00 . A A . 3 LYS CB 1 1 5 2114 1 1 3 LYS CD C -0.722 7.676 -4.651 1.00 . A A . 3 LYS CD 1 1 5 2115 1 1 3 LYS CE C -1.387 6.551 -3.820 1.00 . A A . 3 LYS CE 1 1 5 2116 1 1 3 LYS CG C -1.502 9.001 -4.843 1.00 . A A . 3 LYS CG 1 1 5 2117 1 1 3 LYS H H -4.400 11.682 -3.944 1.00 . A A . 3 LYS H 1 1 5 2118 1 1 3 LYS HA H -3.269 10.919 -5.960 1.00 . A A . 3 LYS HA 1 1 5 2119 1 1 3 LYS HB2 H -3.471 8.017 -4.966 1.00 . A A . 3 LYS HB2 1 1 5 2120 1 1 3 LYS HB3 H -2.814 8.518 -6.499 1.00 . A A . 3 LYS HB3 1 1 5 2121 1 1 3 LYS HD2 H -0.471 7.269 -5.652 1.00 . A A . 3 LYS HD2 1 1 5 2122 1 1 3 LYS HD3 H 0.266 7.917 -4.210 1.00 . A A . 3 LYS HD3 1 1 5 2123 1 1 3 LYS HE2 H -2.238 6.119 -4.391 1.00 . A A . 3 LYS HE2 1 1 5 2124 1 1 3 LYS HE3 H -0.673 5.705 -3.714 1.00 . A A . 3 LYS HE3 1 1 5 2125 1 1 3 LYS HG2 H -0.907 9.684 -5.481 1.00 . A A . 3 LYS HG2 1 1 5 2126 1 1 3 LYS HG3 H -1.560 9.526 -3.870 1.00 . A A . 3 LYS HG3 1 1 5 2127 1 1 3 LYS HZ1 H -1.109 7.509 -1.956 1.00 . A A . 3 LYS HZ1 1 1 5 2128 1 1 3 LYS HZ2 H -2.621 7.716 -2.572 1.00 . A A . 3 LYS HZ2 1 1 5 2129 1 1 3 LYS HZ3 H -2.211 6.282 -1.874 1.00 . A A . 3 LYS HZ3 1 1 5 2130 1 1 3 LYS N N -4.128 10.698 -4.036 1.00 . A A . 3 LYS N 1 1 5 2131 1 1 3 LYS NZ N -1.845 7.024 -2.483 1.00 . A A . 3 LYS NZ 1 1 5 2132 1 1 3 LYS O O -5.896 8.902 -5.770 1.00 . A A . 3 LYS O 1 1 5 2133 1 1 4 VAL C C -6.757 9.933 -9.191 1.00 . A A . 4 VAL C 1 1 5 2134 1 1 4 VAL CA C -6.859 10.627 -7.786 1.00 . A A . 4 VAL CA 1 1 5 2135 1 1 4 VAL CB C -7.457 12.085 -7.851 1.00 . A A . 4 VAL CB 1 1 5 2136 1 1 4 VAL CG1 C -7.915 12.601 -6.468 1.00 . A A . 4 VAL CG1 1 1 5 2137 1 1 4 VAL CG2 C -6.589 13.180 -8.521 1.00 . A A . 4 VAL CG2 1 1 5 2138 1 1 4 VAL H H -4.790 11.302 -7.444 1.00 . A A . 4 VAL H 1 1 5 2139 1 1 4 VAL HA H -7.580 10.015 -7.203 1.00 . A A . 4 VAL HA 1 1 5 2140 1 1 4 VAL HB H -8.381 12.012 -8.459 1.00 . A A . 4 VAL HB 1 1 5 2141 1 1 4 VAL HG11 H -8.628 11.908 -5.988 1.00 . A A . 4 VAL HG11 1 1 5 2142 1 1 4 VAL HG12 H -7.068 12.726 -5.769 1.00 . A A . 4 VAL HG12 1 1 5 2143 1 1 4 VAL HG13 H -8.428 13.579 -6.538 1.00 . A A . 4 VAL HG13 1 1 5 2144 1 1 4 VAL HG21 H -6.275 12.893 -9.541 1.00 . A A . 4 VAL HG21 1 1 5 2145 1 1 4 VAL HG22 H -7.139 14.134 -8.620 1.00 . A A . 4 VAL HG22 1 1 5 2146 1 1 4 VAL HG23 H -5.671 13.397 -7.945 1.00 . A A . 4 VAL HG23 1 1 5 2147 1 1 4 VAL N N -5.517 10.664 -7.120 1.00 . A A . 4 VAL N 1 1 5 2148 1 1 4 VAL O O -6.968 10.532 -10.249 1.00 . A A . 4 VAL O 1 1 5 2149 1 1 5 LYS C C -7.459 6.456 -9.763 1.00 . A A . 5 LYS C 1 1 5 2150 1 1 5 LYS CA C -6.752 7.719 -10.346 1.00 . A A . 5 LYS CA 1 1 5 2151 1 1 5 LYS CB C -5.427 7.393 -11.098 1.00 . A A . 5 LYS CB 1 1 5 2152 1 1 5 LYS CD C -3.548 8.186 -12.680 1.00 . A A . 5 LYS CD 1 1 5 2153 1 1 5 LYS CE C -2.938 9.381 -13.440 1.00 . A A . 5 LYS CE 1 1 5 2154 1 1 5 LYS CG C -4.826 8.572 -11.905 1.00 . A A . 5 LYS CG 1 1 5 2155 1 1 5 LYS H H -6.445 8.232 -8.225 1.00 . A A . 5 LYS H 1 1 5 2156 1 1 5 LYS HA H -7.449 8.193 -11.069 1.00 . A A . 5 LYS HA 1 1 5 2157 1 1 5 LYS HB2 H -4.679 7.002 -10.380 1.00 . A A . 5 LYS HB2 1 1 5 2158 1 1 5 LYS HB3 H -5.615 6.550 -11.791 1.00 . A A . 5 LYS HB3 1 1 5 2159 1 1 5 LYS HD2 H -2.810 7.766 -11.966 1.00 . A A . 5 LYS HD2 1 1 5 2160 1 1 5 LYS HD3 H -3.786 7.360 -13.380 1.00 . A A . 5 LYS HD3 1 1 5 2161 1 1 5 LYS HE2 H -3.689 9.812 -14.141 1.00 . A A . 5 LYS HE2 1 1 5 2162 1 1 5 LYS HE3 H -2.706 10.206 -12.728 1.00 . A A . 5 LYS HE3 1 1 5 2163 1 1 5 LYS HG2 H -5.593 8.968 -12.602 1.00 . A A . 5 LYS HG2 1 1 5 2164 1 1 5 LYS HG3 H -4.608 9.409 -11.211 1.00 . A A . 5 LYS HG3 1 1 5 2165 1 1 5 LYS HZ1 H -1.000 8.558 -13.541 1.00 . A A . 5 LYS HZ1 1 1 5 2166 1 1 5 LYS HZ2 H -1.908 8.207 -14.858 1.00 . A A . 5 LYS HZ2 1 1 5 2167 1 1 5 LYS HZ3 H -1.254 9.707 -14.688 1.00 . A A . 5 LYS HZ3 1 1 5 2168 1 1 5 LYS N N -6.485 8.617 -9.180 1.00 . A A . 5 LYS N 1 1 5 2169 1 1 5 LYS NZ N -1.715 8.947 -14.169 1.00 . A A . 5 LYS NZ 1 1 5 2170 1 1 5 LYS O O -6.858 5.390 -9.594 1.00 . A A . 5 LYS O 1 1 5 2171 1 1 6 GLY C C -10.173 6.803 -7.272 1.00 . A A . 6 GLY C 1 1 5 2172 1 1 6 GLY CA C -9.184 5.954 -8.099 1.00 . A A . 6 GLY CA 1 1 5 2173 1 1 6 GLY H H -9.071 7.575 -9.540 1.00 . A A . 6 GLY H 1 1 5 2174 1 1 6 GLY HA2 H -9.610 4.977 -8.380 1.00 . A A . 6 GLY HA2 1 1 5 2175 1 1 6 GLY HA3 H -8.325 5.739 -7.429 1.00 . A A . 6 GLY HA3 1 1 5 2176 1 1 6 GLY N N -8.713 6.637 -9.324 1.00 . A A . 6 GLY N 1 1 5 2177 1 1 6 GLY O O -10.092 8.036 -7.252 1.00 . A A . 6 GLY O 1 1 5 2178 1 1 7 ILE C C -11.243 7.295 -4.287 1.00 . A A . 7 ILE C 1 1 5 2179 1 1 7 ILE CA C -12.006 6.841 -5.591 1.00 . A A . 7 ILE CA 1 1 5 2180 1 1 7 ILE CB C -13.252 5.908 -5.327 1.00 . A A . 7 ILE CB 1 1 5 2181 1 1 7 ILE CD1 C -15.789 6.069 -4.720 1.00 . A A . 7 ILE CD1 1 1 5 2182 1 1 7 ILE CG1 C -14.397 6.721 -4.646 1.00 . A A . 7 ILE CG1 1 1 5 2183 1 1 7 ILE CG2 C -12.926 4.663 -4.452 1.00 . A A . 7 ILE CG2 1 1 5 2184 1 1 7 ILE H H -11.027 5.112 -6.593 1.00 . A A . 7 ILE H 1 1 5 2185 1 1 7 ILE HA H -12.372 7.757 -6.100 1.00 . A A . 7 ILE HA 1 1 5 2186 1 1 7 ILE HB H -13.630 5.559 -6.309 1.00 . A A . 7 ILE HB 1 1 5 2187 1 1 7 ILE HD11 H -16.094 5.865 -5.763 1.00 . A A . 7 ILE HD11 1 1 5 2188 1 1 7 ILE HD12 H -15.832 5.111 -4.169 1.00 . A A . 7 ILE HD12 1 1 5 2189 1 1 7 ILE HD13 H -16.563 6.725 -4.281 1.00 . A A . 7 ILE HD13 1 1 5 2190 1 1 7 ILE HG12 H -14.147 6.937 -3.587 1.00 . A A . 7 ILE HG12 1 1 5 2191 1 1 7 ILE HG13 H -14.485 7.717 -5.122 1.00 . A A . 7 ILE HG13 1 1 5 2192 1 1 7 ILE HG21 H -12.100 4.065 -4.873 1.00 . A A . 7 ILE HG21 1 1 5 2193 1 1 7 ILE HG22 H -12.633 4.931 -3.418 1.00 . A A . 7 ILE HG22 1 1 5 2194 1 1 7 ILE HG23 H -13.790 3.978 -4.372 1.00 . A A . 7 ILE HG23 1 1 5 2195 1 1 7 ILE N N -11.072 6.140 -6.528 1.00 . A A . 7 ILE N 1 1 5 2196 1 1 7 ILE O O -10.458 6.545 -3.697 1.00 . A A . 7 ILE O 1 1 5 2197 1 1 8 THR C C -11.935 9.827 -1.742 1.00 . A A . 8 THR C 1 1 5 2198 1 1 8 THR CA C -10.843 9.112 -2.616 1.00 . A A . 8 THR CA 1 1 5 2199 1 1 8 THR CB C -9.647 10.061 -2.992 1.00 . A A . 8 THR CB 1 1 5 2200 1 1 8 THR CG2 C -8.409 9.312 -3.514 1.00 . A A . 8 THR CG2 1 1 5 2201 1 1 8 THR H H -12.171 9.070 -4.395 1.00 . A A . 8 THR H 1 1 5 2202 1 1 8 THR HA H -10.439 8.305 -1.974 1.00 . A A . 8 THR HA 1 1 5 2203 1 1 8 THR HB H -9.353 10.629 -2.086 1.00 . A A . 8 THR HB 1 1 5 2204 1 1 8 THR HG1 H -10.118 10.436 -4.799 1.00 . A A . 8 THR HG1 1 1 5 2205 1 1 8 THR HG21 H -8.018 8.593 -2.772 1.00 . A A . 8 THR HG21 1 1 5 2206 1 1 8 THR HG22 H -8.615 8.743 -4.442 1.00 . A A . 8 THR HG22 1 1 5 2207 1 1 8 THR HG23 H -7.585 10.012 -3.745 1.00 . A A . 8 THR HG23 1 1 5 2208 1 1 8 THR N N -11.463 8.552 -3.865 1.00 . A A . 8 THR N 1 1 5 2209 1 1 8 THR O O -11.844 11.017 -1.428 1.00 . A A . 8 THR O 1 1 5 2210 1 1 8 THR OG1 O -10.019 10.978 -4.012 1.00 . A A . 8 THR OG1 1 1 5 2211 1 1 9 GLN C C -14.209 8.180 0.600 1.00 . A A . 9 GLN C 1 1 5 2212 1 1 9 GLN CA C -13.878 9.483 -0.198 1.00 . A A . 9 GLN CA 1 1 5 2213 1 1 9 GLN CB C -15.157 10.168 -0.765 1.00 . A A . 9 GLN CB 1 1 5 2214 1 1 9 GLN CD C -16.274 12.287 -1.772 1.00 . A A . 9 GLN CD 1 1 5 2215 1 1 9 GLN CG C -14.974 11.598 -1.334 1.00 . A A . 9 GLN CG 1 1 5 2216 1 1 9 GLN H H -12.762 8.056 -1.344 1.00 . A A . 9 GLN H 1 1 5 2217 1 1 9 GLN HA H -13.350 10.172 0.476 1.00 . A A . 9 GLN HA 1 1 5 2218 1 1 9 GLN HB2 H -15.621 9.514 -1.531 1.00 . A A . 9 GLN HB2 1 1 5 2219 1 1 9 GLN HB3 H -15.911 10.220 0.045 1.00 . A A . 9 GLN HB3 1 1 5 2220 1 1 9 GLN HE21 H -15.326 13.214 -3.268 1.00 . A A . 9 GLN HE21 1 1 5 2221 1 1 9 GLN HE22 H -17.124 13.545 -3.015 1.00 . A A . 9 GLN HE22 1 1 5 2222 1 1 9 GLN HG2 H -14.493 12.241 -0.575 1.00 . A A . 9 GLN HG2 1 1 5 2223 1 1 9 GLN HG3 H -14.261 11.560 -2.179 1.00 . A A . 9 GLN HG3 1 1 5 2224 1 1 9 GLN N N -12.947 9.063 -1.281 1.00 . A A . 9 GLN N 1 1 5 2225 1 1 9 GLN NE2 N -16.232 13.088 -2.808 1.00 . A A . 9 GLN NE2 1 1 5 2226 1 1 9 GLN O O -15.265 7.562 0.433 1.00 . A A . 9 GLN O 1 1 5 2227 1 1 9 GLN OE1 O -17.339 12.149 -1.178 1.00 . A A . 9 GLN OE1 1 1 5 2228 1 1 10 GLY C C -11.826 5.915 0.199 1.00 . A A . 10 GLY C 1 1 5 2229 1 1 10 GLY CA C -12.911 6.216 1.269 1.00 . A A . 10 GLY CA 1 1 5 2230 1 1 10 GLY H H -12.459 8.341 1.497 1.00 . A A . 10 GLY H 1 1 5 2231 1 1 10 GLY HA2 H -12.627 5.838 2.262 1.00 . A A . 10 GLY HA2 1 1 5 2232 1 1 10 GLY HA3 H -13.806 5.629 0.988 1.00 . A A . 10 GLY HA3 1 1 5 2233 1 1 10 GLY N N -13.216 7.667 1.351 1.00 . A A . 10 GLY N 1 1 5 2234 1 1 10 GLY O O -12.185 5.972 -0.982 1.00 . A A . 10 GLY O 1 1 5 2235 1 1 11 PRO C C -9.702 4.025 -1.318 1.00 . A A . 11 PRO C 1 1 5 2236 1 1 11 PRO CA C -9.500 5.351 -0.522 1.00 . A A . 11 PRO CA 1 1 5 2237 1 1 11 PRO CB C -8.179 5.351 0.280 1.00 . A A . 11 PRO CB 1 1 5 2238 1 1 11 PRO CD C -9.935 5.803 1.839 1.00 . A A . 11 PRO CD 1 1 5 2239 1 1 11 PRO CG C -8.588 5.096 1.729 1.00 . A A . 11 PRO CG 1 1 5 2240 1 1 11 PRO HA H -9.493 6.197 -1.239 1.00 . A A . 11 PRO HA 1 1 5 2241 1 1 11 PRO HB2 H -7.434 4.614 -0.077 1.00 . A A . 11 PRO HB2 1 1 5 2242 1 1 11 PRO HB3 H -7.689 6.338 0.194 1.00 . A A . 11 PRO HB3 1 1 5 2243 1 1 11 PRO HD2 H -10.534 5.409 2.680 1.00 . A A . 11 PRO HD2 1 1 5 2244 1 1 11 PRO HD3 H -9.778 6.886 1.968 1.00 . A A . 11 PRO HD3 1 1 5 2245 1 1 11 PRO HG2 H -8.711 4.010 1.909 1.00 . A A . 11 PRO HG2 1 1 5 2246 1 1 11 PRO HG3 H -7.847 5.467 2.461 1.00 . A A . 11 PRO HG3 1 1 5 2247 1 1 11 PRO N N -10.533 5.610 0.511 1.00 . A A . 11 PRO N 1 1 5 2248 1 1 11 PRO O O -10.176 3.000 -0.822 1.00 . A A . 11 PRO O 1 1 5 2249 1 1 12 ASN C C -8.602 1.650 -3.174 1.00 . A A . 12 ASN C 1 1 5 2250 1 1 12 ASN CA C -9.376 2.970 -3.553 1.00 . A A . 12 ASN CA 1 1 5 2251 1 1 12 ASN CB C -8.876 3.552 -4.908 1.00 . A A . 12 ASN CB 1 1 5 2252 1 1 12 ASN CG C -9.414 2.835 -6.148 1.00 . A A . 12 ASN CG 1 1 5 2253 1 1 12 ASN H H -9.249 5.087 -2.845 1.00 . A A . 12 ASN H 1 1 5 2254 1 1 12 ASN HA H -10.446 2.687 -3.630 1.00 . A A . 12 ASN HA 1 1 5 2255 1 1 12 ASN HB2 H -9.199 4.603 -5.025 1.00 . A A . 12 ASN HB2 1 1 5 2256 1 1 12 ASN HB3 H -7.771 3.611 -4.935 1.00 . A A . 12 ASN HB3 1 1 5 2257 1 1 12 ASN HD21 H -7.875 1.564 -6.173 1.00 . A A . 12 ASN HD21 1 1 5 2258 1 1 12 ASN HD22 H -9.171 1.405 -7.472 1.00 . A A . 12 ASN HD22 1 1 5 2259 1 1 12 ASN N N -9.260 4.094 -2.574 1.00 . A A . 12 ASN N 1 1 5 2260 1 1 12 ASN ND2 N -8.719 1.855 -6.671 1.00 . A A . 12 ASN ND2 1 1 5 2261 1 1 12 ASN O O -9.095 0.563 -3.483 1.00 . A A . 12 ASN O 1 1 5 2262 1 1 12 ASN OD1 O -10.468 3.175 -6.677 1.00 . A A . 12 ASN OD1 1 1 5 2263 1 1 13 GLU C C -6.213 -0.621 -2.685 1.00 . A A . 13 GLU C 1 1 5 2264 1 1 13 GLU CA C -6.711 0.601 -1.824 1.00 . A A . 13 GLU CA 1 1 5 2265 1 1 13 GLU CB C -7.616 0.085 -0.657 1.00 . A A . 13 GLU CB 1 1 5 2266 1 1 13 GLU CD C -8.676 0.621 1.667 1.00 . A A . 13 GLU CD 1 1 5 2267 1 1 13 GLU CG C -7.718 1.050 0.554 1.00 . A A . 13 GLU CG 1 1 5 2268 1 1 13 GLU H H -7.209 2.707 -2.287 1.00 . A A . 13 GLU H 1 1 5 2269 1 1 13 GLU HA H -5.778 1.008 -1.392 1.00 . A A . 13 GLU HA 1 1 5 2270 1 1 13 GLU HB2 H -8.629 -0.168 -1.029 1.00 . A A . 13 GLU HB2 1 1 5 2271 1 1 13 GLU HB3 H -7.223 -0.877 -0.269 1.00 . A A . 13 GLU HB3 1 1 5 2272 1 1 13 GLU HE2 H -9.260 1.167 3.382 1.00 . A A . 13 GLU HE2 1 1 5 2273 1 1 13 GLU HG2 H -6.717 1.198 1.001 1.00 . A A . 13 GLU HG2 1 1 5 2274 1 1 13 GLU HG3 H -8.039 2.051 0.218 1.00 . A A . 13 GLU HG3 1 1 5 2275 1 1 13 GLU N N -7.410 1.733 -2.537 1.00 . A A . 13 GLU N 1 1 5 2276 1 1 13 GLU O O -5.367 -1.359 -2.172 1.00 . A A . 13 GLU O 1 1 5 2277 1 1 13 GLU OE1 O -9.396 -0.374 1.634 1.00 . A A . 13 GLU OE1 1 1 5 2278 1 1 13 GLU OE2 O -8.642 1.482 2.720 1.00 . A A . 13 GLU OE2 1 1 5 2279 1 1 14 SER C C -4.651 -2.215 -4.940 1.00 . A A . 14 SER C 1 1 5 2280 1 1 14 SER CA C -6.214 -2.014 -4.775 1.00 . A A . 14 SER CA 1 1 5 2281 1 1 14 SER CB C -6.950 -1.846 -6.129 1.00 . A A . 14 SER CB 1 1 5 2282 1 1 14 SER H H -7.497 -0.308 -4.139 1.00 . A A . 14 SER H 1 1 5 2283 1 1 14 SER HA H -6.579 -2.939 -4.288 1.00 . A A . 14 SER HA 1 1 5 2284 1 1 14 SER HB2 H -8.048 -1.847 -5.971 1.00 . A A . 14 SER HB2 1 1 5 2285 1 1 14 SER HB3 H -6.727 -0.872 -6.602 1.00 . A A . 14 SER HB3 1 1 5 2286 1 1 14 SER HG H -6.762 -3.731 -6.603 1.00 . A A . 14 SER HG 1 1 5 2287 1 1 14 SER N N -6.637 -0.842 -3.944 1.00 . A A . 14 SER N 1 1 5 2288 1 1 14 SER O O -4.229 -3.336 -4.638 1.00 . A A . 14 SER O 1 1 5 2289 1 1 14 SER OG O -6.618 -2.889 -7.046 1.00 . A A . 14 SER OG 1 1 5 2290 1 1 15 PRO C C -1.616 -1.394 -3.789 1.00 . A A . 15 PRO C 1 1 5 2291 1 1 15 PRO CA C -2.270 -1.461 -5.218 1.00 . A A . 15 PRO CA 1 1 5 2292 1 1 15 PRO CB C -1.756 -0.346 -6.151 1.00 . A A . 15 PRO CB 1 1 5 2293 1 1 15 PRO CD C -4.121 0.053 -5.899 1.00 . A A . 15 PRO CD 1 1 5 2294 1 1 15 PRO CG C -2.782 0.782 -6.034 1.00 . A A . 15 PRO CG 1 1 5 2295 1 1 15 PRO HA H -1.986 -2.448 -5.632 1.00 . A A . 15 PRO HA 1 1 5 2296 1 1 15 PRO HB2 H -0.726 -0.012 -5.916 1.00 . A A . 15 PRO HB2 1 1 5 2297 1 1 15 PRO HB3 H -1.723 -0.719 -7.194 1.00 . A A . 15 PRO HB3 1 1 5 2298 1 1 15 PRO HD2 H -4.826 0.629 -5.272 1.00 . A A . 15 PRO HD2 1 1 5 2299 1 1 15 PRO HD3 H -4.583 -0.089 -6.895 1.00 . A A . 15 PRO HD3 1 1 5 2300 1 1 15 PRO HG2 H -2.580 1.388 -5.130 1.00 . A A . 15 PRO HG2 1 1 5 2301 1 1 15 PRO HG3 H -2.757 1.470 -6.899 1.00 . A A . 15 PRO HG3 1 1 5 2302 1 1 15 PRO N N -3.749 -1.251 -5.314 1.00 . A A . 15 PRO N 1 1 5 2303 1 1 15 PRO O O -0.431 -1.718 -3.675 1.00 . A A . 15 PRO O 1 1 5 2304 1 1 16 SER C C -0.997 -1.867 -0.671 1.00 . A A . 16 SER C 1 1 5 2305 1 1 16 SER CA C -1.735 -0.684 -1.386 1.00 . A A . 16 SER CA 1 1 5 2306 1 1 16 SER CB C -2.868 -0.128 -0.484 1.00 . A A . 16 SER CB 1 1 5 2307 1 1 16 SER H H -3.278 -0.691 -2.957 1.00 . A A . 16 SER H 1 1 5 2308 1 1 16 SER HA H -0.985 0.105 -1.541 1.00 . A A . 16 SER HA 1 1 5 2309 1 1 16 SER HB2 H -2.430 0.232 0.467 1.00 . A A . 16 SER HB2 1 1 5 2310 1 1 16 SER HB3 H -3.327 0.771 -0.939 1.00 . A A . 16 SER HB3 1 1 5 2311 1 1 16 SER HG H -4.404 -1.253 -0.990 1.00 . A A . 16 SER HG 1 1 5 2312 1 1 16 SER N N -2.330 -0.988 -2.718 1.00 . A A . 16 SER N 1 1 5 2313 1 1 16 SER O O 0.102 -1.643 -0.162 1.00 . A A . 16 SER O 1 1 5 2314 1 1 16 SER OG O -3.880 -1.092 -0.178 1.00 . A A . 16 SER OG 1 1 5 2315 1 1 17 ALA C C 0.475 -4.707 -0.978 1.00 . A A . 17 ALA C 1 1 5 2316 1 1 17 ALA CA C -0.799 -4.300 -0.153 1.00 . A A . 17 ALA CA 1 1 5 2317 1 1 17 ALA CB C -1.841 -5.436 -0.125 1.00 . A A . 17 ALA CB 1 1 5 2318 1 1 17 ALA H H -2.478 -3.149 -1.054 1.00 . A A . 17 ALA H 1 1 5 2319 1 1 17 ALA HA H -0.446 -4.103 0.879 1.00 . A A . 17 ALA HA 1 1 5 2320 1 1 17 ALA HB1 H -2.707 -5.188 0.518 1.00 . A A . 17 ALA HB1 1 1 5 2321 1 1 17 ALA HB2 H -2.234 -5.678 -1.131 1.00 . A A . 17 ALA HB2 1 1 5 2322 1 1 17 ALA HB3 H -1.408 -6.369 0.283 1.00 . A A . 17 ALA HB3 1 1 5 2323 1 1 17 ALA N N -1.533 -3.104 -0.659 1.00 . A A . 17 ALA N 1 1 5 2324 1 1 17 ALA O O 1.488 -5.072 -0.375 1.00 . A A . 17 ALA O 1 1 5 2325 1 1 18 PHE C C 2.735 -3.534 -2.905 1.00 . A A . 18 PHE C 1 1 5 2326 1 1 18 PHE CA C 1.697 -4.687 -3.162 1.00 . A A . 18 PHE CA 1 1 5 2327 1 1 18 PHE CB C 1.199 -4.722 -4.638 1.00 . A A . 18 PHE CB 1 1 5 2328 1 1 18 PHE CD1 C 3.053 -4.045 -6.257 1.00 . A A . 18 PHE CD1 1 1 5 2329 1 1 18 PHE CD2 C 2.395 -6.368 -6.170 1.00 . A A . 18 PHE CD2 1 1 5 2330 1 1 18 PHE CE1 C 3.964 -4.343 -7.268 1.00 . A A . 18 PHE CE1 1 1 5 2331 1 1 18 PHE CE2 C 3.298 -6.661 -7.190 1.00 . A A . 18 PHE CE2 1 1 5 2332 1 1 18 PHE CG C 2.260 -5.057 -5.702 1.00 . A A . 18 PHE CG 1 1 5 2333 1 1 18 PHE CZ C 4.080 -5.648 -7.740 1.00 . A A . 18 PHE CZ 1 1 5 2334 1 1 18 PHE H H -0.406 -4.182 -2.678 1.00 . A A . 18 PHE H 1 1 5 2335 1 1 18 PHE HA H 2.223 -5.624 -2.912 1.00 . A A . 18 PHE HA 1 1 5 2336 1 1 18 PHE HB2 H 0.370 -5.453 -4.735 1.00 . A A . 18 PHE HB2 1 1 5 2337 1 1 18 PHE HB3 H 0.717 -3.758 -4.898 1.00 . A A . 18 PHE HB3 1 1 5 2338 1 1 18 PHE HD1 H 2.957 -3.023 -5.914 1.00 . A A . 18 PHE HD1 1 1 5 2339 1 1 18 PHE HD2 H 1.776 -7.156 -5.766 1.00 . A A . 18 PHE HD2 1 1 5 2340 1 1 18 PHE HE1 H 4.565 -3.555 -7.702 1.00 . A A . 18 PHE HE1 1 1 5 2341 1 1 18 PHE HE2 H 3.381 -7.672 -7.565 1.00 . A A . 18 PHE HE2 1 1 5 2342 1 1 18 PHE HZ H 4.767 -5.872 -8.543 1.00 . A A . 18 PHE HZ 1 1 5 2343 1 1 18 PHE N N 0.463 -4.600 -2.323 1.00 . A A . 18 PHE N 1 1 5 2344 1 1 18 PHE O O 3.931 -3.808 -2.786 1.00 . A A . 18 PHE O 1 1 5 2345 1 1 19 LEU C C 3.720 -1.305 -0.891 1.00 . A A . 19 LEU C 1 1 5 2346 1 1 19 LEU CA C 3.110 -1.128 -2.324 1.00 . A A . 19 LEU CA 1 1 5 2347 1 1 19 LEU CB C 2.187 0.125 -2.382 1.00 . A A . 19 LEU CB 1 1 5 2348 1 1 19 LEU CD1 C 3.656 1.730 -3.750 1.00 . A A . 19 LEU CD1 1 1 5 2349 1 1 19 LEU CD2 C 1.869 2.628 -2.235 1.00 . A A . 19 LEU CD2 1 1 5 2350 1 1 19 LEU CG C 2.898 1.501 -2.428 1.00 . A A . 19 LEU CG 1 1 5 2351 1 1 19 LEU H H 1.263 -2.199 -2.945 1.00 . A A . 19 LEU H 1 1 5 2352 1 1 19 LEU HA H 3.962 -1.013 -3.020 1.00 . A A . 19 LEU HA 1 1 5 2353 1 1 19 LEU HB2 H 1.496 0.055 -3.239 1.00 . A A . 19 LEU HB2 1 1 5 2354 1 1 19 LEU HB3 H 1.501 0.103 -1.513 1.00 . A A . 19 LEU HB3 1 1 5 2355 1 1 19 LEU HD11 H 2.989 1.659 -4.630 1.00 . A A . 19 LEU HD11 1 1 5 2356 1 1 19 LEU HD12 H 4.134 2.726 -3.785 1.00 . A A . 19 LEU HD12 1 1 5 2357 1 1 19 LEU HD13 H 4.465 0.993 -3.901 1.00 . A A . 19 LEU HD13 1 1 5 2358 1 1 19 LEU HD21 H 1.335 2.533 -1.271 1.00 . A A . 19 LEU HD21 1 1 5 2359 1 1 19 LEU HD22 H 2.345 3.625 -2.245 1.00 . A A . 19 LEU HD22 1 1 5 2360 1 1 19 LEU HD23 H 1.102 2.623 -3.033 1.00 . A A . 19 LEU HD23 1 1 5 2361 1 1 19 LEU HG H 3.623 1.547 -1.593 1.00 . A A . 19 LEU HG 1 1 5 2362 1 1 19 LEU N N 2.281 -2.274 -2.796 1.00 . A A . 19 LEU N 1 1 5 2363 1 1 19 LEU O O 4.908 -1.044 -0.698 1.00 . A A . 19 LEU O 1 1 5 2364 1 1 20 GLU C C 4.380 -3.347 1.503 1.00 . A A . 20 GLU C 1 1 5 2365 1 1 20 GLU CA C 3.435 -2.104 1.452 1.00 . A A . 20 GLU CA 1 1 5 2366 1 1 20 GLU CB C 2.210 -2.318 2.388 1.00 . A A . 20 GLU CB 1 1 5 2367 1 1 20 GLU CD C 2.200 -0.120 3.770 1.00 . A A . 20 GLU CD 1 1 5 2368 1 1 20 GLU CG C 1.441 -1.039 2.814 1.00 . A A . 20 GLU CG 1 1 5 2369 1 1 20 GLU H H 1.928 -1.697 -0.106 1.00 . A A . 20 GLU H 1 1 5 2370 1 1 20 GLU HA H 4.046 -1.251 1.773 1.00 . A A . 20 GLU HA 1 1 5 2371 1 1 20 GLU HB2 H 1.502 -3.027 1.916 1.00 . A A . 20 GLU HB2 1 1 5 2372 1 1 20 GLU HB3 H 2.532 -2.845 3.309 1.00 . A A . 20 GLU HB3 1 1 5 2373 1 1 20 GLU HE2 H 2.388 0.242 5.629 1.00 . A A . 20 GLU HE2 1 1 5 2374 1 1 20 GLU HG2 H 1.140 -0.452 1.928 1.00 . A A . 20 GLU HG2 1 1 5 2375 1 1 20 GLU HG3 H 0.487 -1.330 3.291 1.00 . A A . 20 GLU HG3 1 1 5 2376 1 1 20 GLU N N 2.933 -1.761 0.099 1.00 . A A . 20 GLU N 1 1 5 2377 1 1 20 GLU O O 5.395 -3.260 2.194 1.00 . A A . 20 GLU O 1 1 5 2378 1 1 20 GLU OE1 O 2.991 0.746 3.407 1.00 . A A . 20 GLU OE1 1 1 5 2379 1 1 20 GLU OE2 O 1.897 -0.366 5.075 1.00 . A A . 20 GLU OE2 1 1 5 2380 1 1 21 ARG C C 6.561 -4.951 -0.001 1.00 . A A . 21 ARG C 1 1 5 2381 1 1 21 ARG CA C 5.162 -5.498 0.491 1.00 . A A . 21 ARG CA 1 1 5 2382 1 1 21 ARG CB C 4.503 -6.447 -0.551 1.00 . A A . 21 ARG CB 1 1 5 2383 1 1 21 ARG CD C 4.772 -8.444 -2.187 1.00 . A A . 21 ARG CD 1 1 5 2384 1 1 21 ARG CG C 5.297 -7.727 -0.920 1.00 . A A . 21 ARG CG 1 1 5 2385 1 1 21 ARG CZ C 6.094 -7.521 -4.126 1.00 . A A . 21 ARG CZ 1 1 5 2386 1 1 21 ARG H H 3.235 -4.480 0.277 1.00 . A A . 21 ARG H 1 1 5 2387 1 1 21 ARG HA H 5.324 -6.031 1.437 1.00 . A A . 21 ARG HA 1 1 5 2388 1 1 21 ARG HB2 H 3.501 -6.763 -0.196 1.00 . A A . 21 ARG HB2 1 1 5 2389 1 1 21 ARG HB3 H 4.301 -5.869 -1.470 1.00 . A A . 21 ARG HB3 1 1 5 2390 1 1 21 ARG HD2 H 5.232 -9.449 -2.282 1.00 . A A . 21 ARG HD2 1 1 5 2391 1 1 21 ARG HD3 H 3.693 -8.666 -2.054 1.00 . A A . 21 ARG HD3 1 1 5 2392 1 1 21 ARG HE H 4.190 -7.083 -3.820 1.00 . A A . 21 ARG HE 1 1 5 2393 1 1 21 ARG HG2 H 6.371 -7.492 -1.050 1.00 . A A . 21 ARG HG2 1 1 5 2394 1 1 21 ARG HG3 H 5.268 -8.424 -0.060 1.00 . A A . 21 ARG HG3 1 1 5 2395 1 1 21 ARG HH11 H 7.129 -8.705 -2.962 1.00 . A A . 21 ARG HH11 1 1 5 2396 1 1 21 ARG HH12 H 8.035 -7.986 -4.382 1.00 . A A . 21 ARG HH12 1 1 5 2397 1 1 21 ARG HH21 H 5.222 -6.283 -5.417 1.00 . A A . 21 ARG HH21 1 1 5 2398 1 1 21 ARG HH22 H 6.979 -6.674 -5.686 1.00 . A A . 21 ARG HH22 1 1 5 2399 1 1 21 ARG N N 4.143 -4.444 0.753 1.00 . A A . 21 ARG N 1 1 5 2400 1 1 21 ARG NE N 4.957 -7.645 -3.439 1.00 . A A . 21 ARG NE 1 1 5 2401 1 1 21 ARG NH1 N 7.206 -8.133 -3.804 1.00 . A A . 21 ARG NH1 1 1 5 2402 1 1 21 ARG NH2 N 6.100 -6.751 -5.173 1.00 . A A . 21 ARG NH2 1 1 5 2403 1 1 21 ARG O O 7.600 -5.396 0.494 1.00 . A A . 21 ARG O 1 1 5 2404 1 1 22 LEU C C 8.322 -2.272 -0.159 1.00 . A A . 22 LEU C 1 1 5 2405 1 1 22 LEU CA C 7.788 -3.207 -1.300 1.00 . A A . 22 LEU CA 1 1 5 2406 1 1 22 LEU CB C 7.463 -2.387 -2.585 1.00 . A A . 22 LEU CB 1 1 5 2407 1 1 22 LEU CD1 C 6.650 -2.221 -4.980 1.00 . A A . 22 LEU CD1 1 1 5 2408 1 1 22 LEU CD2 C 8.352 -3.974 -4.403 1.00 . A A . 22 LEU CD2 1 1 5 2409 1 1 22 LEU CG C 7.139 -3.181 -3.882 1.00 . A A . 22 LEU CG 1 1 5 2410 1 1 22 LEU H H 5.678 -3.662 -1.277 1.00 . A A . 22 LEU H 1 1 5 2411 1 1 22 LEU HA H 8.570 -3.937 -1.520 1.00 . A A . 22 LEU HA 1 1 5 2412 1 1 22 LEU HB2 H 6.629 -1.694 -2.367 1.00 . A A . 22 LEU HB2 1 1 5 2413 1 1 22 LEU HB3 H 8.314 -1.713 -2.800 1.00 . A A . 22 LEU HB3 1 1 5 2414 1 1 22 LEU HD11 H 5.740 -1.676 -4.669 1.00 . A A . 22 LEU HD11 1 1 5 2415 1 1 22 LEU HD12 H 7.413 -1.462 -5.239 1.00 . A A . 22 LEU HD12 1 1 5 2416 1 1 22 LEU HD13 H 6.392 -2.756 -5.912 1.00 . A A . 22 LEU HD13 1 1 5 2417 1 1 22 LEU HD21 H 9.229 -3.321 -4.569 1.00 . A A . 22 LEU HD21 1 1 5 2418 1 1 22 LEU HD22 H 8.664 -4.761 -3.692 1.00 . A A . 22 LEU HD22 1 1 5 2419 1 1 22 LEU HD23 H 8.137 -4.476 -5.363 1.00 . A A . 22 LEU HD23 1 1 5 2420 1 1 22 LEU HG H 6.316 -3.891 -3.665 1.00 . A A . 22 LEU HG 1 1 5 2421 1 1 22 LEU N N 6.581 -3.968 -0.925 1.00 . A A . 22 LEU N 1 1 5 2422 1 1 22 LEU O O 9.525 -2.316 0.098 1.00 . A A . 22 LEU O 1 1 5 2423 1 1 23 LYS C C 8.526 -1.366 2.918 1.00 . A A . 23 LYS C 1 1 5 2424 1 1 23 LYS CA C 7.985 -0.587 1.664 1.00 . A A . 23 LYS CA 1 1 5 2425 1 1 23 LYS CB C 6.820 0.355 2.081 1.00 . A A . 23 LYS CB 1 1 5 2426 1 1 23 LYS CD C 5.189 2.244 1.436 1.00 . A A . 23 LYS CD 1 1 5 2427 1 1 23 LYS CE C 4.854 3.455 0.540 1.00 . A A . 23 LYS CE 1 1 5 2428 1 1 23 LYS CG C 6.482 1.479 1.066 1.00 . A A . 23 LYS CG 1 1 5 2429 1 1 23 LYS H H 6.484 -1.606 0.366 1.00 . A A . 23 LYS H 1 1 5 2430 1 1 23 LYS HA H 8.832 0.025 1.298 1.00 . A A . 23 LYS HA 1 1 5 2431 1 1 23 LYS HB2 H 5.922 -0.244 2.315 1.00 . A A . 23 LYS HB2 1 1 5 2432 1 1 23 LYS HB3 H 7.076 0.844 3.042 1.00 . A A . 23 LYS HB3 1 1 5 2433 1 1 23 LYS HD2 H 4.347 1.525 1.368 1.00 . A A . 23 LYS HD2 1 1 5 2434 1 1 23 LYS HD3 H 5.200 2.537 2.505 1.00 . A A . 23 LYS HD3 1 1 5 2435 1 1 23 LYS HE2 H 4.946 3.176 -0.533 1.00 . A A . 23 LYS HE2 1 1 5 2436 1 1 23 LYS HE3 H 3.780 3.719 0.668 1.00 . A A . 23 LYS HE3 1 1 5 2437 1 1 23 LYS HG2 H 7.346 2.167 0.992 1.00 . A A . 23 LYS HG2 1 1 5 2438 1 1 23 LYS HG3 H 6.368 1.047 0.051 1.00 . A A . 23 LYS HG3 1 1 5 2439 1 1 23 LYS HZ1 H 5.618 4.920 1.848 1.00 . A A . 23 LYS HZ1 1 1 5 2440 1 1 23 LYS HZ2 H 6.717 4.414 0.748 1.00 . A A . 23 LYS HZ2 1 1 5 2441 1 1 23 LYS HZ3 H 5.527 5.455 0.294 1.00 . A A . 23 LYS HZ3 1 1 5 2442 1 1 23 LYS N N 7.495 -1.466 0.549 1.00 . A A . 23 LYS N 1 1 5 2443 1 1 23 LYS NZ N 5.718 4.623 0.869 1.00 . A A . 23 LYS NZ 1 1 5 2444 1 1 23 LYS O O 9.545 -0.961 3.482 1.00 . A A . 23 LYS O 1 1 5 2445 1 1 24 GLU C C 9.764 -4.116 3.966 1.00 . A A . 24 GLU C 1 1 5 2446 1 1 24 GLU CA C 8.408 -3.420 4.347 1.00 . A A . 24 GLU CA 1 1 5 2447 1 1 24 GLU CB C 7.311 -4.499 4.593 1.00 . A A . 24 GLU CB 1 1 5 2448 1 1 24 GLU CD C 4.913 -5.046 5.348 1.00 . A A . 24 GLU CD 1 1 5 2449 1 1 24 GLU CG C 6.026 -4.002 5.307 1.00 . A A . 24 GLU CG 1 1 5 2450 1 1 24 GLU H H 7.065 -2.744 2.781 1.00 . A A . 24 GLU H 1 1 5 2451 1 1 24 GLU HA H 8.582 -2.836 5.258 1.00 . A A . 24 GLU HA 1 1 5 2452 1 1 24 GLU HB2 H 7.048 -4.983 3.630 1.00 . A A . 24 GLU HB2 1 1 5 2453 1 1 24 GLU HB3 H 7.736 -5.317 5.208 1.00 . A A . 24 GLU HB3 1 1 5 2454 1 1 24 GLU HE2 H 4.235 -6.435 6.449 1.00 . A A . 24 GLU HE2 1 1 5 2455 1 1 24 GLU HG2 H 6.261 -3.674 6.336 1.00 . A A . 24 GLU HG2 1 1 5 2456 1 1 24 GLU HG3 H 5.618 -3.109 4.800 1.00 . A A . 24 GLU HG3 1 1 5 2457 1 1 24 GLU N N 7.885 -2.476 3.329 1.00 . A A . 24 GLU N 1 1 5 2458 1 1 24 GLU O O 10.574 -4.369 4.862 1.00 . A A . 24 GLU O 1 1 5 2459 1 1 24 GLU OE1 O 4.076 -5.193 4.462 1.00 . A A . 24 GLU OE1 1 1 5 2460 1 1 24 GLU OE2 O 4.950 -5.798 6.482 1.00 . A A . 24 GLU OE2 1 1 5 2461 1 1 25 ALA C C 12.376 -3.521 2.119 1.00 . A A . 25 ALA C 1 1 5 2462 1 1 25 ALA CA C 11.376 -4.733 2.163 1.00 . A A . 25 ALA CA 1 1 5 2463 1 1 25 ALA CB C 11.160 -5.339 0.761 1.00 . A A . 25 ALA CB 1 1 5 2464 1 1 25 ALA H H 9.253 -4.269 2.034 1.00 . A A . 25 ALA H 1 1 5 2465 1 1 25 ALA HA H 11.805 -5.490 2.823 1.00 . A A . 25 ALA HA 1 1 5 2466 1 1 25 ALA HB1 H 10.490 -6.220 0.784 1.00 . A A . 25 ALA HB1 1 1 5 2467 1 1 25 ALA HB2 H 10.717 -4.620 0.047 1.00 . A A . 25 ALA HB2 1 1 5 2468 1 1 25 ALA HB3 H 12.114 -5.682 0.320 1.00 . A A . 25 ALA HB3 1 1 5 2469 1 1 25 ALA N N 10.029 -4.414 2.677 1.00 . A A . 25 ALA N 1 1 5 2470 1 1 25 ALA O O 13.518 -3.679 2.555 1.00 . A A . 25 ALA O 1 1 5 2471 1 1 26 TYR C C 13.267 -0.443 2.847 1.00 . A A . 26 TYR C 1 1 5 2472 1 1 26 TYR CA C 12.852 -1.136 1.506 1.00 . A A . 26 TYR CA 1 1 5 2473 1 1 26 TYR CB C 12.110 -0.091 0.615 1.00 . A A . 26 TYR CB 1 1 5 2474 1 1 26 TYR CD1 C 12.182 -1.504 -1.577 1.00 . A A . 26 TYR CD1 1 1 5 2475 1 1 26 TYR CD2 C 10.897 0.537 -1.498 1.00 . A A . 26 TYR CD2 1 1 5 2476 1 1 26 TYR CE1 C 11.797 -1.695 -2.902 1.00 . A A . 26 TYR CE1 1 1 5 2477 1 1 26 TYR CE2 C 10.513 0.344 -2.822 1.00 . A A . 26 TYR CE2 1 1 5 2478 1 1 26 TYR CG C 11.735 -0.385 -0.859 1.00 . A A . 26 TYR CG 1 1 5 2479 1 1 26 TYR CZ C 10.964 -0.769 -3.522 1.00 . A A . 26 TYR CZ 1 1 5 2480 1 1 26 TYR H H 11.101 -2.367 1.084 1.00 . A A . 26 TYR H 1 1 5 2481 1 1 26 TYR HA H 13.798 -1.454 1.031 1.00 . A A . 26 TYR HA 1 1 5 2482 1 1 26 TYR HB2 H 11.192 0.222 1.151 1.00 . A A . 26 TYR HB2 1 1 5 2483 1 1 26 TYR HB3 H 12.727 0.829 0.592 1.00 . A A . 26 TYR HB3 1 1 5 2484 1 1 26 TYR HD1 H 12.819 -2.239 -1.107 1.00 . A A . 26 TYR HD1 1 1 5 2485 1 1 26 TYR HD2 H 10.535 1.409 -0.970 1.00 . A A . 26 TYR HD2 1 1 5 2486 1 1 26 TYR HE1 H 12.145 -2.566 -3.439 1.00 . A A . 26 TYR HE1 1 1 5 2487 1 1 26 TYR HE2 H 9.862 1.055 -3.309 1.00 . A A . 26 TYR HE2 1 1 5 2488 1 1 26 TYR HH H 11.017 -1.718 -5.181 1.00 . A A . 26 TYR HH 1 1 5 2489 1 1 26 TYR N N 11.974 -2.333 1.623 1.00 . A A . 26 TYR N 1 1 5 2490 1 1 26 TYR O O 14.331 0.191 2.859 1.00 . A A . 26 TYR O 1 1 5 2491 1 1 26 TYR OH O 10.572 -0.948 -4.821 1.00 . A A . 26 TYR OH 1 1 5 2492 1 1 27 ARG C C 14.105 -1.208 5.828 1.00 . A A . 27 ARG C 1 1 5 2493 1 1 27 ARG CA C 13.024 -0.177 5.322 1.00 . A A . 27 ARG CA 1 1 5 2494 1 1 27 ARG CB C 11.781 -0.036 6.252 1.00 . A A . 27 ARG CB 1 1 5 2495 1 1 27 ARG CD C 12.376 -0.066 8.796 1.00 . A A . 27 ARG CD 1 1 5 2496 1 1 27 ARG CG C 12.030 0.778 7.552 1.00 . A A . 27 ARG CG 1 1 5 2497 1 1 27 ARG CZ C 13.080 0.517 11.133 1.00 . A A . 27 ARG CZ 1 1 5 2498 1 1 27 ARG H H 11.605 -1.021 3.816 1.00 . A A . 27 ARG H 1 1 5 2499 1 1 27 ARG HA H 13.516 0.815 5.251 1.00 . A A . 27 ARG HA 1 1 5 2500 1 1 27 ARG HB2 H 10.982 0.499 5.698 1.00 . A A . 27 ARG HB2 1 1 5 2501 1 1 27 ARG HB3 H 11.333 -1.026 6.473 1.00 . A A . 27 ARG HB3 1 1 5 2502 1 1 27 ARG HD2 H 11.486 -0.650 9.106 1.00 . A A . 27 ARG HD2 1 1 5 2503 1 1 27 ARG HD3 H 13.169 -0.802 8.566 1.00 . A A . 27 ARG HD3 1 1 5 2504 1 1 27 ARG HE H 13.280 1.761 9.622 1.00 . A A . 27 ARG HE 1 1 5 2505 1 1 27 ARG HG2 H 12.808 1.545 7.359 1.00 . A A . 27 ARG HG2 1 1 5 2506 1 1 27 ARG HG3 H 11.120 1.368 7.783 1.00 . A A . 27 ARG HG3 1 1 5 2507 1 1 27 ARG HH11 H 12.332 -1.291 10.994 1.00 . A A . 27 ARG HH11 1 1 5 2508 1 1 27 ARG HH12 H 12.984 -0.807 12.636 1.00 . A A . 27 ARG HH12 1 1 5 2509 1 1 27 ARG HH21 H 13.876 2.298 11.432 1.00 . A A . 27 ARG HH21 1 1 5 2510 1 1 27 ARG HH22 H 13.810 1.174 12.871 1.00 . A A . 27 ARG HH22 1 1 5 2511 1 1 27 ARG N N 12.521 -0.574 3.971 1.00 . A A . 27 ARG N 1 1 5 2512 1 1 27 ARG NE N 12.854 0.845 9.866 1.00 . A A . 27 ARG NE 1 1 5 2513 1 1 27 ARG NH1 N 12.760 -0.640 11.655 1.00 . A A . 27 ARG NH1 1 1 5 2514 1 1 27 ARG NH2 N 13.653 1.406 11.889 1.00 . A A . 27 ARG NH2 1 1 5 2515 1 1 27 ARG O O 13.884 -2.077 6.676 1.00 . A A . 27 ARG O 1 1 5 2516 1 1 28 ARG C C 17.686 -1.425 4.726 1.00 . A A . 28 ARG C 1 1 5 2517 1 1 28 ARG CA C 16.401 -2.083 5.328 1.00 . A A . 28 ARG CA 1 1 5 2518 1 1 28 ARG CB C 16.063 -3.443 4.632 1.00 . A A . 28 ARG CB 1 1 5 2519 1 1 28 ARG CD C 15.833 -5.246 6.489 1.00 . A A . 28 ARG CD 1 1 5 2520 1 1 28 ARG CG C 16.680 -4.684 5.323 1.00 . A A . 28 ARG CG 1 1 5 2521 1 1 28 ARG CZ C 13.459 -5.816 5.859 1.00 . A A . 28 ARG CZ 1 1 5 2522 1 1 28 ARG H H 15.300 -0.427 4.458 1.00 . A A . 28 ARG H 1 1 5 2523 1 1 28 ARG HA H 16.564 -2.198 6.403 1.00 . A A . 28 ARG HA 1 1 5 2524 1 1 28 ARG HB2 H 14.970 -3.589 4.558 1.00 . A A . 28 ARG HB2 1 1 5 2525 1 1 28 ARG HB3 H 16.367 -3.423 3.568 1.00 . A A . 28 ARG HB3 1 1 5 2526 1 1 28 ARG HD2 H 16.496 -5.844 7.146 1.00 . A A . 28 ARG HD2 1 1 5 2527 1 1 28 ARG HD3 H 15.469 -4.434 7.152 1.00 . A A . 28 ARG HD3 1 1 5 2528 1 1 28 ARG HE H 14.954 -7.101 5.704 1.00 . A A . 28 ARG HE 1 1 5 2529 1 1 28 ARG HG2 H 16.857 -5.478 4.571 1.00 . A A . 28 ARG HG2 1 1 5 2530 1 1 28 ARG HG3 H 17.697 -4.435 5.687 1.00 . A A . 28 ARG HG3 1 1 5 2531 1 1 28 ARG HH11 H 13.608 -3.918 6.474 1.00 . A A . 28 ARG HH11 1 1 5 2532 1 1 28 ARG HH12 H 11.980 -4.484 5.857 1.00 . A A . 28 ARG HH12 1 1 5 2533 1 1 28 ARG HH21 H 13.022 -7.620 5.138 1.00 . A A . 28 ARG HH21 1 1 5 2534 1 1 28 ARG HH22 H 11.666 -6.399 5.281 1.00 . A A . 28 ARG HH22 1 1 5 2535 1 1 28 ARG N N 15.290 -1.118 5.209 1.00 . A A . 28 ARG N 1 1 5 2536 1 1 28 ARG NE N 14.743 -6.145 6.004 1.00 . A A . 28 ARG NE 1 1 5 2537 1 1 28 ARG NH1 N 12.955 -4.651 6.163 1.00 . A A . 28 ARG NH1 1 1 5 2538 1 1 28 ARG NH2 N 12.641 -6.703 5.375 1.00 . A A . 28 ARG NH2 1 1 5 2539 1 1 28 ARG O O 18.679 -1.293 5.443 1.00 . A A . 28 ARG O 1 1 5 2540 1 1 29 TYR C C 18.492 1.486 3.444 1.00 . A A . 29 TYR C 1 1 5 2541 1 1 29 TYR CA C 18.687 0.003 2.940 1.00 . A A . 29 TYR CA 1 1 5 2542 1 1 29 TYR CB C 18.688 -0.115 1.384 1.00 . A A . 29 TYR CB 1 1 5 2543 1 1 29 TYR CD1 C 17.304 1.730 0.277 1.00 . A A . 29 TYR CD1 1 1 5 2544 1 1 29 TYR CD2 C 16.571 -0.558 0.045 1.00 . A A . 29 TYR CD2 1 1 5 2545 1 1 29 TYR CE1 C 16.201 2.157 -0.459 1.00 . A A . 29 TYR CE1 1 1 5 2546 1 1 29 TYR CE2 C 15.497 -0.132 -0.729 1.00 . A A . 29 TYR CE2 1 1 5 2547 1 1 29 TYR CG C 17.479 0.371 0.561 1.00 . A A . 29 TYR CG 1 1 5 2548 1 1 29 TYR CZ C 15.302 1.225 -0.969 1.00 . A A . 29 TYR CZ 1 1 5 2549 1 1 29 TYR H H 16.795 -1.149 2.935 1.00 . A A . 29 TYR H 1 1 5 2550 1 1 29 TYR HA H 19.691 -0.297 3.304 1.00 . A A . 29 TYR HA 1 1 5 2551 1 1 29 TYR HB2 H 19.591 0.401 1.005 1.00 . A A . 29 TYR HB2 1 1 5 2552 1 1 29 TYR HB3 H 18.872 -1.176 1.125 1.00 . A A . 29 TYR HB3 1 1 5 2553 1 1 29 TYR HD1 H 18.018 2.458 0.636 1.00 . A A . 29 TYR HD1 1 1 5 2554 1 1 29 TYR HD2 H 16.697 -1.615 0.232 1.00 . A A . 29 TYR HD2 1 1 5 2555 1 1 29 TYR HE1 H 16.043 3.211 -0.631 1.00 . A A . 29 TYR HE1 1 1 5 2556 1 1 29 TYR HE2 H 14.815 -0.866 -1.120 1.00 . A A . 29 TYR HE2 1 1 5 2557 1 1 29 TYR HH H 13.713 0.882 -1.978 1.00 . A A . 29 TYR HH 1 1 5 2558 1 1 29 TYR N N 17.665 -0.961 3.453 1.00 . A A . 29 TYR N 1 1 5 2559 1 1 29 TYR O O 19.492 2.186 3.608 1.00 . A A . 29 TYR O 1 1 5 2560 1 1 29 TYR OH O 14.223 1.647 -1.699 1.00 . A A . 29 TYR OH 1 1 5 2561 1 1 30 THR C C 16.489 3.020 5.809 1.00 . A A . 30 THR C 1 1 5 2562 1 1 30 THR CA C 16.999 3.287 4.342 1.00 . A A . 30 THR CA 1 1 5 2563 1 1 30 THR CB C 15.939 4.104 3.546 1.00 . A A . 30 THR CB 1 1 5 2564 1 1 30 THR CG2 C 15.811 5.569 3.997 1.00 . A A . 30 THR CG2 1 1 5 2565 1 1 30 THR H H 16.525 1.249 3.662 1.00 . A A . 30 THR H 1 1 5 2566 1 1 30 THR HA H 17.923 3.893 4.348 1.00 . A A . 30 THR HA 1 1 5 2567 1 1 30 THR HB H 14.963 3.602 3.664 1.00 . A A . 30 THR HB 1 1 5 2568 1 1 30 THR HG1 H 16.546 3.261 1.938 1.00 . A A . 30 THR HG1 1 1 5 2569 1 1 30 THR HG21 H 16.761 6.121 3.873 1.00 . A A . 30 THR HG21 1 1 5 2570 1 1 30 THR HG22 H 15.049 6.103 3.400 1.00 . A A . 30 THR HG22 1 1 5 2571 1 1 30 THR HG23 H 15.503 5.657 5.055 1.00 . A A . 30 THR HG23 1 1 5 2572 1 1 30 THR N N 17.252 1.972 3.683 1.00 . A A . 30 THR N 1 1 5 2573 1 1 30 THR O O 15.532 2.247 5.964 1.00 . A A . 30 THR O 1 1 5 2574 1 1 30 THR OG1 O 16.287 4.159 2.168 1.00 . A A . 30 THR OG1 1 1 5 2575 1 1 31 PRO C C 14.988 3.745 8.565 1.00 . A A . 31 PRO C 1 1 5 2576 1 1 31 PRO CA C 16.505 3.460 8.287 1.00 . A A . 31 PRO CA 1 1 5 2577 1 1 31 PRO CB C 17.417 4.400 9.103 1.00 . A A . 31 PRO CB 1 1 5 2578 1 1 31 PRO CD C 18.250 4.469 6.841 1.00 . A A . 31 PRO CD 1 1 5 2579 1 1 31 PRO CG C 18.710 4.508 8.296 1.00 . A A . 31 PRO CG 1 1 5 2580 1 1 31 PRO HA H 16.676 2.403 8.565 1.00 . A A . 31 PRO HA 1 1 5 2581 1 1 31 PRO HB2 H 16.971 5.409 9.209 1.00 . A A . 31 PRO HB2 1 1 5 2582 1 1 31 PRO HB3 H 17.593 4.024 10.129 1.00 . A A . 31 PRO HB3 1 1 5 2583 1 1 31 PRO HD2 H 18.012 5.477 6.447 1.00 . A A . 31 PRO HD2 1 1 5 2584 1 1 31 PRO HD3 H 19.032 4.024 6.196 1.00 . A A . 31 PRO HD3 1 1 5 2585 1 1 31 PRO HG2 H 19.291 5.420 8.534 1.00 . A A . 31 PRO HG2 1 1 5 2586 1 1 31 PRO HG3 H 19.367 3.642 8.512 1.00 . A A . 31 PRO HG3 1 1 5 2587 1 1 31 PRO N N 17.023 3.653 6.897 1.00 . A A . 31 PRO N 1 1 5 2588 1 1 31 PRO O O 14.384 3.055 9.390 1.00 . A A . 31 PRO O 1 1 5 2589 1 1 32 TYR C C 12.485 5.376 6.479 1.00 . A A . 32 TYR C 1 1 5 2590 1 1 32 TYR CA C 12.910 4.959 7.909 1.00 . A A . 32 TYR CA 1 1 5 2591 1 1 32 TYR CB C 12.516 6.036 8.962 1.00 . A A . 32 TYR CB 1 1 5 2592 1 1 32 TYR CD1 C 11.532 4.763 10.939 1.00 . A A . 32 TYR CD1 1 1 5 2593 1 1 32 TYR CD2 C 13.653 5.878 11.241 1.00 . A A . 32 TYR CD2 1 1 5 2594 1 1 32 TYR CE1 C 11.594 4.293 12.249 1.00 . A A . 32 TYR CE1 1 1 5 2595 1 1 32 TYR CE2 C 13.713 5.406 12.551 1.00 . A A . 32 TYR CE2 1 1 5 2596 1 1 32 TYR CG C 12.563 5.557 10.425 1.00 . A A . 32 TYR CG 1 1 5 2597 1 1 32 TYR CZ C 12.685 4.612 13.051 1.00 . A A . 32 TYR CZ 1 1 5 2598 1 1 32 TYR H H 15.011 5.212 7.242 1.00 . A A . 32 TYR H 1 1 5 2599 1 1 32 TYR HA H 12.378 4.017 8.150 1.00 . A A . 32 TYR HA 1 1 5 2600 1 1 32 TYR HB2 H 13.135 6.944 8.827 1.00 . A A . 32 TYR HB2 1 1 5 2601 1 1 32 TYR HB3 H 11.487 6.393 8.756 1.00 . A A . 32 TYR HB3 1 1 5 2602 1 1 32 TYR HD1 H 10.684 4.501 10.323 1.00 . A A . 32 TYR HD1 1 1 5 2603 1 1 32 TYR HD2 H 14.466 6.478 10.855 1.00 . A A . 32 TYR HD2 1 1 5 2604 1 1 32 TYR HE1 H 10.797 3.679 12.643 1.00 . A A . 32 TYR HE1 1 1 5 2605 1 1 32 TYR HE2 H 14.563 5.654 13.170 1.00 . A A . 32 TYR HE2 1 1 5 2606 1 1 32 TYR HH H 13.453 4.578 14.799 1.00 . A A . 32 TYR HH 1 1 5 2607 1 1 32 TYR N N 14.382 4.742 7.901 1.00 . A A . 32 TYR N 1 1 5 2608 1 1 32 TYR O O 12.808 6.428 5.931 1.00 . A A . 32 TYR O 1 1 5 2609 1 1 32 TYR OXT O 11.706 4.435 5.871 1.00 . A A . 32 TYR OXT 1 1 5 2610 1 1 32 TYR OH O 12.756 4.119 14.326 1.00 . A A . 32 TYR OH 1 1 6 2611 1 1 1 CYS C C -21.359 -1.234 -6.202 1.00 . A A . 1 CYS C 1 1 6 2612 1 1 1 CYS CA C -22.672 -0.511 -6.632 1.00 . A A . 1 CYS CA 1 1 6 2613 1 1 1 CYS CB C -23.376 -1.211 -7.812 1.00 . A A . 1 CYS CB 1 1 6 2614 1 1 1 CYS H1 H -23.232 1.344 -7.360 1.00 . A A . 1 CYS H1 1 1 6 2615 1 1 1 CYS H2 H -21.758 0.870 -7.871 1.00 . A A . 1 CYS H2 1 1 6 2616 1 1 1 CYS HA H -23.386 -0.471 -5.786 1.00 . A A . 1 CYS HA 1 1 6 2617 1 1 1 CYS HB2 H -24.279 -0.652 -8.127 1.00 . A A . 1 CYS HB2 1 1 6 2618 1 1 1 CYS HB3 H -22.718 -1.270 -8.700 1.00 . A A . 1 CYS HB3 1 1 6 2619 1 1 1 CYS HG H -24.404 -3.237 -8.500 1.00 . A A . 1 CYS HG 1 1 6 2620 1 1 1 CYS N N -22.372 0.876 -7.050 1.00 . A A . 1 CYS N 1 1 6 2621 1 1 1 CYS O O -20.500 -1.551 -7.035 1.00 . A A . 1 CYS O 1 1 6 2622 1 1 1 CYS SG S -23.880 -2.895 -7.325 1.00 . A A . 1 CYS SG 1 1 6 2623 1 1 2 ALA C C -20.116 -3.642 -3.896 1.00 . A A . 2 ALA C 1 1 6 2624 1 1 2 ALA CA C -19.975 -2.136 -4.332 1.00 . A A . 2 ALA CA 1 1 6 2625 1 1 2 ALA CB C -19.598 -1.212 -3.152 1.00 . A A . 2 ALA CB 1 1 6 2626 1 1 2 ALA H H -21.893 -1.046 -4.281 1.00 . A A . 2 ALA H 1 1 6 2627 1 1 2 ALA HA H -19.138 -2.119 -5.055 1.00 . A A . 2 ALA HA 1 1 6 2628 1 1 2 ALA HB1 H -19.428 -0.166 -3.475 1.00 . A A . 2 ALA HB1 1 1 6 2629 1 1 2 ALA HB2 H -20.370 -1.196 -2.359 1.00 . A A . 2 ALA HB2 1 1 6 2630 1 1 2 ALA HB3 H -18.660 -1.540 -2.670 1.00 . A A . 2 ALA HB3 1 1 6 2631 1 1 2 ALA N N -21.206 -1.500 -4.891 1.00 . A A . 2 ALA N 1 1 6 2632 1 1 2 ALA O O -19.387 -4.093 -3.006 1.00 . A A . 2 ALA O 1 1 6 2633 1 1 3 LYS C C -20.067 -6.807 -4.504 1.00 . A A . 3 LYS C 1 1 6 2634 1 1 3 LYS CA C -21.259 -5.855 -4.137 1.00 . A A . 3 LYS CA 1 1 6 2635 1 1 3 LYS CB C -22.573 -6.326 -4.828 1.00 . A A . 3 LYS CB 1 1 6 2636 1 1 3 LYS CD C -25.135 -6.277 -5.001 1.00 . A A . 3 LYS CD 1 1 6 2637 1 1 3 LYS CE C -26.453 -5.666 -4.482 1.00 . A A . 3 LYS CE 1 1 6 2638 1 1 3 LYS CG C -23.887 -5.681 -4.315 1.00 . A A . 3 LYS CG 1 1 6 2639 1 1 3 LYS H H -21.647 -3.948 -5.128 1.00 . A A . 3 LYS H 1 1 6 2640 1 1 3 LYS HA H -21.418 -5.868 -3.048 1.00 . A A . 3 LYS HA 1 1 6 2641 1 1 3 LYS HB2 H -22.484 -6.195 -5.926 1.00 . A A . 3 LYS HB2 1 1 6 2642 1 1 3 LYS HB3 H -22.660 -7.423 -4.692 1.00 . A A . 3 LYS HB3 1 1 6 2643 1 1 3 LYS HD2 H -25.047 -6.132 -6.096 1.00 . A A . 3 LYS HD2 1 1 6 2644 1 1 3 LYS HD3 H -25.136 -7.376 -4.848 1.00 . A A . 3 LYS HD3 1 1 6 2645 1 1 3 LYS HE2 H -26.525 -5.801 -3.379 1.00 . A A . 3 LYS HE2 1 1 6 2646 1 1 3 LYS HE3 H -26.454 -4.564 -4.637 1.00 . A A . 3 LYS HE3 1 1 6 2647 1 1 3 LYS HG2 H -23.958 -5.814 -3.216 1.00 . A A . 3 LYS HG2 1 1 6 2648 1 1 3 LYS HG3 H -23.853 -4.584 -4.475 1.00 . A A . 3 LYS HG3 1 1 6 2649 1 1 3 LYS HZ1 H -27.624 -7.326 -5.049 1.00 . A A . 3 LYS HZ1 1 1 6 2650 1 1 3 LYS HZ2 H -28.524 -5.967 -4.846 1.00 . A A . 3 LYS HZ2 1 1 6 2651 1 1 3 LYS HZ3 H -27.594 -6.153 -6.189 1.00 . A A . 3 LYS HZ3 1 1 6 2652 1 1 3 LYS N N -20.979 -4.453 -4.548 1.00 . A A . 3 LYS N 1 1 6 2653 1 1 3 LYS NZ N -27.608 -6.305 -5.172 1.00 . A A . 3 LYS NZ 1 1 6 2654 1 1 3 LYS O O -19.900 -7.186 -5.665 1.00 . A A . 3 LYS O 1 1 6 2655 1 1 4 VAL C C -16.987 -7.180 -4.828 1.00 . A A . 4 VAL C 1 1 6 2656 1 1 4 VAL CA C -17.869 -7.783 -3.656 1.00 . A A . 4 VAL CA 1 1 6 2657 1 1 4 VAL CB C -18.005 -9.357 -3.738 1.00 . A A . 4 VAL CB 1 1 6 2658 1 1 4 VAL CG1 C -18.515 -9.989 -2.423 1.00 . A A . 4 VAL CG1 1 1 6 2659 1 1 4 VAL CG2 C -18.802 -9.960 -4.918 1.00 . A A . 4 VAL CG2 1 1 6 2660 1 1 4 VAL H H -19.474 -6.663 -2.621 1.00 . A A . 4 VAL H 1 1 6 2661 1 1 4 VAL HA H -17.278 -7.549 -2.751 1.00 . A A . 4 VAL HA 1 1 6 2662 1 1 4 VAL HB H -16.971 -9.740 -3.858 1.00 . A A . 4 VAL HB 1 1 6 2663 1 1 4 VAL HG11 H -17.919 -9.665 -1.550 1.00 . A A . 4 VAL HG11 1 1 6 2664 1 1 4 VAL HG12 H -19.568 -9.719 -2.217 1.00 . A A . 4 VAL HG12 1 1 6 2665 1 1 4 VAL HG13 H -18.465 -11.094 -2.447 1.00 . A A . 4 VAL HG13 1 1 6 2666 1 1 4 VAL HG21 H -18.451 -9.566 -5.890 1.00 . A A . 4 VAL HG21 1 1 6 2667 1 1 4 VAL HG22 H -18.707 -11.061 -4.965 1.00 . A A . 4 VAL HG22 1 1 6 2668 1 1 4 VAL HG23 H -19.882 -9.729 -4.851 1.00 . A A . 4 VAL HG23 1 1 6 2669 1 1 4 VAL N N -19.231 -7.137 -3.496 1.00 . A A . 4 VAL N 1 1 6 2670 1 1 4 VAL O O -16.357 -7.892 -5.613 1.00 . A A . 4 VAL O 1 1 6 2671 1 1 5 LYS C C -15.998 -3.625 -5.396 1.00 . A A . 5 LYS C 1 1 6 2672 1 1 5 LYS CA C -16.111 -5.094 -5.918 1.00 . A A . 5 LYS CA 1 1 6 2673 1 1 5 LYS CB C -16.761 -5.194 -7.341 1.00 . A A . 5 LYS CB 1 1 6 2674 1 1 5 LYS CD C -18.661 -4.075 -8.810 1.00 . A A . 5 LYS CD 1 1 6 2675 1 1 5 LYS CE C -17.932 -2.759 -9.174 1.00 . A A . 5 LYS CE 1 1 6 2676 1 1 5 LYS CG C -18.260 -4.798 -7.500 1.00 . A A . 5 LYS CG 1 1 6 2677 1 1 5 LYS H H -17.413 -5.334 -4.156 1.00 . A A . 5 LYS H 1 1 6 2678 1 1 5 LYS HA H -15.089 -5.520 -5.982 1.00 . A A . 5 LYS HA 1 1 6 2679 1 1 5 LYS HB2 H -16.130 -4.608 -8.034 1.00 . A A . 5 LYS HB2 1 1 6 2680 1 1 5 LYS HB3 H -16.641 -6.232 -7.709 1.00 . A A . 5 LYS HB3 1 1 6 2681 1 1 5 LYS HD2 H -18.550 -4.786 -9.651 1.00 . A A . 5 LYS HD2 1 1 6 2682 1 1 5 LYS HD3 H -19.751 -3.876 -8.768 1.00 . A A . 5 LYS HD3 1 1 6 2683 1 1 5 LYS HE2 H -16.888 -2.978 -9.483 1.00 . A A . 5 LYS HE2 1 1 6 2684 1 1 5 LYS HE3 H -18.396 -2.325 -10.087 1.00 . A A . 5 LYS HE3 1 1 6 2685 1 1 5 LYS HG2 H -18.875 -5.714 -7.399 1.00 . A A . 5 LYS HG2 1 1 6 2686 1 1 5 LYS HG3 H -18.594 -4.185 -6.642 1.00 . A A . 5 LYS HG3 1 1 6 2687 1 1 5 LYS HZ1 H -18.914 -1.514 -7.761 1.00 . A A . 5 LYS HZ1 1 1 6 2688 1 1 5 LYS HZ2 H -17.508 -2.148 -7.203 1.00 . A A . 5 LYS HZ2 1 1 6 2689 1 1 5 LYS HZ3 H -17.418 -0.900 -8.260 1.00 . A A . 5 LYS HZ3 1 1 6 2690 1 1 5 LYS N N -16.898 -5.835 -4.893 1.00 . A A . 5 LYS N 1 1 6 2691 1 1 5 LYS NZ N -17.951 -1.765 -8.067 1.00 . A A . 5 LYS NZ 1 1 6 2692 1 1 5 LYS O O -16.753 -2.735 -5.803 1.00 . A A . 5 LYS O 1 1 6 2693 1 1 6 GLY C C -14.860 -0.840 -4.044 1.00 . A A . 6 GLY C 1 1 6 2694 1 1 6 GLY CA C -15.265 -2.226 -3.496 1.00 . A A . 6 GLY CA 1 1 6 2695 1 1 6 GLY H H -14.545 -4.201 -4.166 1.00 . A A . 6 GLY H 1 1 6 2696 1 1 6 GLY HA2 H -16.325 -2.169 -3.176 1.00 . A A . 6 GLY HA2 1 1 6 2697 1 1 6 GLY HA3 H -14.721 -2.446 -2.560 1.00 . A A . 6 GLY HA3 1 1 6 2698 1 1 6 GLY N N -15.103 -3.379 -4.422 1.00 . A A . 6 GLY N 1 1 6 2699 1 1 6 GLY O O -15.710 -0.116 -4.568 1.00 . A A . 6 GLY O 1 1 6 2700 1 1 7 ILE C C -12.646 0.760 -5.858 1.00 . A A . 7 ILE C 1 1 6 2701 1 1 7 ILE CA C -13.091 0.888 -4.356 1.00 . A A . 7 ILE CA 1 1 6 2702 1 1 7 ILE CB C -11.930 1.401 -3.420 1.00 . A A . 7 ILE CB 1 1 6 2703 1 1 7 ILE CD1 C -11.100 1.511 -0.950 1.00 . A A . 7 ILE CD1 1 1 6 2704 1 1 7 ILE CG1 C -12.309 1.461 -1.904 1.00 . A A . 7 ILE CG1 1 1 6 2705 1 1 7 ILE CG2 C -11.500 2.835 -3.847 1.00 . A A . 7 ILE CG2 1 1 6 2706 1 1 7 ILE H H -12.946 -1.168 -3.524 1.00 . A A . 7 ILE H 1 1 6 2707 1 1 7 ILE HA H -13.913 1.630 -4.292 1.00 . A A . 7 ILE HA 1 1 6 2708 1 1 7 ILE HB H -11.070 0.711 -3.530 1.00 . A A . 7 ILE HB 1 1 6 2709 1 1 7 ILE HD11 H -10.437 0.636 -1.084 1.00 . A A . 7 ILE HD11 1 1 6 2710 1 1 7 ILE HD12 H -10.481 2.416 -1.097 1.00 . A A . 7 ILE HD12 1 1 6 2711 1 1 7 ILE HD13 H -11.421 1.513 0.108 1.00 . A A . 7 ILE HD13 1 1 6 2712 1 1 7 ILE HG12 H -12.988 2.312 -1.701 1.00 . A A . 7 ILE HG12 1 1 6 2713 1 1 7 ILE HG13 H -12.900 0.573 -1.616 1.00 . A A . 7 ILE HG13 1 1 6 2714 1 1 7 ILE HG21 H -11.138 2.871 -4.891 1.00 . A A . 7 ILE HG21 1 1 6 2715 1 1 7 ILE HG22 H -12.330 3.562 -3.769 1.00 . A A . 7 ILE HG22 1 1 6 2716 1 1 7 ILE HG23 H -10.673 3.229 -3.229 1.00 . A A . 7 ILE HG23 1 1 6 2717 1 1 7 ILE N N -13.576 -0.462 -3.916 1.00 . A A . 7 ILE N 1 1 6 2718 1 1 7 ILE O O -11.478 0.486 -6.159 1.00 . A A . 7 ILE O 1 1 6 2719 1 1 8 THR C C -13.563 2.030 -9.044 1.00 . A A . 8 THR C 1 1 6 2720 1 1 8 THR CA C -13.359 0.701 -8.247 1.00 . A A . 8 THR CA 1 1 6 2721 1 1 8 THR CB C -14.309 -0.422 -8.797 1.00 . A A . 8 THR CB 1 1 6 2722 1 1 8 THR CG2 C -14.145 -1.779 -8.093 1.00 . A A . 8 THR CG2 1 1 6 2723 1 1 8 THR H H -14.547 0.981 -6.398 1.00 . A A . 8 THR H 1 1 6 2724 1 1 8 THR HA H -12.321 0.352 -8.432 1.00 . A A . 8 THR HA 1 1 6 2725 1 1 8 THR HB H -14.076 -0.557 -9.873 1.00 . A A . 8 THR HB 1 1 6 2726 1 1 8 THR HG1 H -15.679 0.894 -8.997 1.00 . A A . 8 THR HG1 1 1 6 2727 1 1 8 THR HG21 H -13.098 -2.134 -8.129 1.00 . A A . 8 THR HG21 1 1 6 2728 1 1 8 THR HG22 H -14.433 -1.724 -7.027 1.00 . A A . 8 THR HG22 1 1 6 2729 1 1 8 THR HG23 H -14.766 -2.560 -8.562 1.00 . A A . 8 THR HG23 1 1 6 2730 1 1 8 THR N N -13.598 0.948 -6.790 1.00 . A A . 8 THR N 1 1 6 2731 1 1 8 THR O O -14.639 2.279 -9.599 1.00 . A A . 8 THR O 1 1 6 2732 1 1 8 THR OG1 O -15.674 -0.019 -8.661 1.00 . A A . 8 THR OG1 1 1 6 2733 1 1 9 GLN C C -10.853 4.193 -10.297 1.00 . A A . 9 GLN C 1 1 6 2734 1 1 9 GLN CA C -12.390 3.932 -10.150 1.00 . A A . 9 GLN CA 1 1 6 2735 1 1 9 GLN CB C -13.212 5.185 -9.728 1.00 . A A . 9 GLN CB 1 1 6 2736 1 1 9 GLN CD C -14.050 7.546 -10.375 1.00 . A A . 9 GLN CD 1 1 6 2737 1 1 9 GLN CG C -13.303 6.285 -10.816 1.00 . A A . 9 GLN CG 1 1 6 2738 1 1 9 GLN H H -11.625 2.498 -8.756 1.00 . A A . 9 GLN H 1 1 6 2739 1 1 9 GLN HA H -12.768 3.540 -11.109 1.00 . A A . 9 GLN HA 1 1 6 2740 1 1 9 GLN HB2 H -14.243 4.879 -9.458 1.00 . A A . 9 GLN HB2 1 1 6 2741 1 1 9 GLN HB3 H -12.787 5.605 -8.795 1.00 . A A . 9 GLN HB3 1 1 6 2742 1 1 9 GLN HE21 H -12.388 8.294 -9.562 1.00 . A A . 9 GLN HE21 1 1 6 2743 1 1 9 GLN HE22 H -13.938 9.293 -9.473 1.00 . A A . 9 GLN HE22 1 1 6 2744 1 1 9 GLN HG2 H -12.294 6.564 -11.177 1.00 . A A . 9 GLN HG2 1 1 6 2745 1 1 9 GLN HG3 H -13.821 5.883 -11.707 1.00 . A A . 9 GLN HG3 1 1 6 2746 1 1 9 GLN N N -12.511 2.863 -9.125 1.00 . A A . 9 GLN N 1 1 6 2747 1 1 9 GLN NE2 N -13.375 8.485 -9.753 1.00 . A A . 9 GLN NE2 1 1 6 2748 1 1 9 GLN O O -10.314 5.205 -9.839 1.00 . A A . 9 GLN O 1 1 6 2749 1 1 9 GLN OE1 O -15.244 7.708 -10.593 1.00 . A A . 9 GLN OE1 1 1 6 2750 1 1 10 GLY C C -8.892 1.828 -9.049 1.00 . A A . 10 GLY C 1 1 6 2751 1 1 10 GLY CA C -8.806 2.835 -10.233 1.00 . A A . 10 GLY CA 1 1 6 2752 1 1 10 GLY H H -10.709 2.467 -11.256 1.00 . A A . 10 GLY H 1 1 6 2753 1 1 10 GLY HA2 H -8.154 2.434 -11.023 1.00 . A A . 10 GLY HA2 1 1 6 2754 1 1 10 GLY HA3 H -8.291 3.739 -9.859 1.00 . A A . 10 GLY HA3 1 1 6 2755 1 1 10 GLY N N -10.124 3.186 -10.817 1.00 . A A . 10 GLY N 1 1 6 2756 1 1 10 GLY O O -9.078 2.301 -7.925 1.00 . A A . 10 GLY O 1 1 6 2757 1 1 11 PRO C C -7.628 -0.246 -7.030 1.00 . A A . 11 PRO C 1 1 6 2758 1 1 11 PRO CA C -8.725 -0.506 -8.108 1.00 . A A . 11 PRO CA 1 1 6 2759 1 1 11 PRO CB C -8.520 -1.845 -8.846 1.00 . A A . 11 PRO CB 1 1 6 2760 1 1 11 PRO CD C -8.883 -0.176 -10.537 1.00 . A A . 11 PRO CD 1 1 6 2761 1 1 11 PRO CG C -9.190 -1.636 -10.201 1.00 . A A . 11 PRO CG 1 1 6 2762 1 1 11 PRO HA H -9.719 -0.524 -7.616 1.00 . A A . 11 PRO HA 1 1 6 2763 1 1 11 PRO HB2 H -7.444 -2.067 -8.999 1.00 . A A . 11 PRO HB2 1 1 6 2764 1 1 11 PRO HB3 H -8.941 -2.703 -8.290 1.00 . A A . 11 PRO HB3 1 1 6 2765 1 1 11 PRO HD2 H -7.951 -0.077 -11.127 1.00 . A A . 11 PRO HD2 1 1 6 2766 1 1 11 PRO HD3 H -9.716 0.269 -11.101 1.00 . A A . 11 PRO HD3 1 1 6 2767 1 1 11 PRO HG2 H -8.822 -2.338 -10.973 1.00 . A A . 11 PRO HG2 1 1 6 2768 1 1 11 PRO HG3 H -10.283 -1.792 -10.116 1.00 . A A . 11 PRO HG3 1 1 6 2769 1 1 11 PRO N N -8.751 0.478 -9.226 1.00 . A A . 11 PRO N 1 1 6 2770 1 1 11 PRO O O -6.436 -0.459 -7.256 1.00 . A A . 11 PRO O 1 1 6 2771 1 1 12 ASN C C -6.352 -0.378 -4.000 1.00 . A A . 12 ASN C 1 1 6 2772 1 1 12 ASN CA C -7.134 0.735 -4.796 1.00 . A A . 12 ASN CA 1 1 6 2773 1 1 12 ASN CB C -8.024 1.598 -3.856 1.00 . A A . 12 ASN CB 1 1 6 2774 1 1 12 ASN CG C -7.292 2.397 -2.773 1.00 . A A . 12 ASN CG 1 1 6 2775 1 1 12 ASN H H -9.005 0.646 -6.026 1.00 . A A . 12 ASN H 1 1 6 2776 1 1 12 ASN HA H -6.353 1.371 -5.253 1.00 . A A . 12 ASN HA 1 1 6 2777 1 1 12 ASN HB2 H -8.637 2.308 -4.444 1.00 . A A . 12 ASN HB2 1 1 6 2778 1 1 12 ASN HB3 H -8.760 0.953 -3.341 1.00 . A A . 12 ASN HB3 1 1 6 2779 1 1 12 ASN HD21 H -6.879 3.883 -4.051 1.00 . A A . 12 ASN HD21 1 1 6 2780 1 1 12 ASN HD22 H -6.306 4.027 -2.305 1.00 . A A . 12 ASN HD22 1 1 6 2781 1 1 12 ASN N N -8.064 0.256 -5.870 1.00 . A A . 12 ASN N 1 1 6 2782 1 1 12 ASN ND2 N -6.767 3.556 -3.088 1.00 . A A . 12 ASN ND2 1 1 6 2783 1 1 12 ASN O O -5.220 -0.129 -3.569 1.00 . A A . 12 ASN O 1 1 6 2784 1 1 12 ASN OD1 O -7.194 1.989 -1.622 1.00 . A A . 12 ASN OD1 1 1 6 2785 1 1 13 GLU C C -5.191 -3.439 -3.406 1.00 . A A . 13 GLU C 1 1 6 2786 1 1 13 GLU CA C -6.352 -2.572 -2.820 1.00 . A A . 13 GLU CA 1 1 6 2787 1 1 13 GLU CB C -7.511 -3.477 -2.301 1.00 . A A . 13 GLU CB 1 1 6 2788 1 1 13 GLU CD C -8.252 -1.938 -0.326 1.00 . A A . 13 GLU CD 1 1 6 2789 1 1 13 GLU CG C -8.672 -2.800 -1.518 1.00 . A A . 13 GLU CG 1 1 6 2790 1 1 13 GLU H H -7.889 -1.614 -4.126 1.00 . A A . 13 GLU H 1 1 6 2791 1 1 13 GLU HA H -5.891 -2.043 -1.967 1.00 . A A . 13 GLU HA 1 1 6 2792 1 1 13 GLU HB2 H -7.941 -4.054 -3.143 1.00 . A A . 13 GLU HB2 1 1 6 2793 1 1 13 GLU HB3 H -7.074 -4.250 -1.636 1.00 . A A . 13 GLU HB3 1 1 6 2794 1 1 13 GLU HE2 H -7.812 -0.121 0.085 1.00 . A A . 13 GLU HE2 1 1 6 2795 1 1 13 GLU HG2 H -9.283 -2.182 -2.202 1.00 . A A . 13 GLU HG2 1 1 6 2796 1 1 13 GLU HG3 H -9.363 -3.577 -1.144 1.00 . A A . 13 GLU HG3 1 1 6 2797 1 1 13 GLU N N -6.932 -1.567 -3.764 1.00 . A A . 13 GLU N 1 1 6 2798 1 1 13 GLU O O -4.216 -3.672 -2.689 1.00 . A A . 13 GLU O 1 1 6 2799 1 1 13 GLU OE1 O -8.035 -2.377 0.799 1.00 . A A . 13 GLU OE1 1 1 6 2800 1 1 13 GLU OE2 O -8.131 -0.626 -0.666 1.00 . A A . 13 GLU OE2 1 1 6 2801 1 1 14 SER C C -2.778 -3.672 -5.411 1.00 . A A . 14 SER C 1 1 6 2802 1 1 14 SER CA C -4.098 -4.546 -5.362 1.00 . A A . 14 SER CA 1 1 6 2803 1 1 14 SER CB C -4.587 -4.954 -6.773 1.00 . A A . 14 SER CB 1 1 6 2804 1 1 14 SER H H -6.082 -3.549 -5.168 1.00 . A A . 14 SER H 1 1 6 2805 1 1 14 SER HA H -3.837 -5.469 -4.806 1.00 . A A . 14 SER HA 1 1 6 2806 1 1 14 SER HB2 H -5.494 -5.585 -6.698 1.00 . A A . 14 SER HB2 1 1 6 2807 1 1 14 SER HB3 H -4.893 -4.083 -7.381 1.00 . A A . 14 SER HB3 1 1 6 2808 1 1 14 SER HG H -2.783 -5.170 -7.487 1.00 . A A . 14 SER HG 1 1 6 2809 1 1 14 SER N N -5.249 -3.883 -4.677 1.00 . A A . 14 SER N 1 1 6 2810 1 1 14 SER O O -1.765 -4.215 -4.957 1.00 . A A . 14 SER O 1 1 6 2811 1 1 14 SER OG O -3.587 -5.699 -7.468 1.00 . A A . 14 SER OG 1 1 6 2812 1 1 15 PRO C C -1.112 -1.218 -4.193 1.00 . A A . 15 PRO C 1 1 6 2813 1 1 15 PRO CA C -1.471 -1.545 -5.678 1.00 . A A . 15 PRO CA 1 1 6 2814 1 1 15 PRO CB C -1.773 -0.298 -6.534 1.00 . A A . 15 PRO CB 1 1 6 2815 1 1 15 PRO CD C -3.771 -1.651 -6.549 1.00 . A A . 15 PRO CD 1 1 6 2816 1 1 15 PRO CG C -3.297 -0.198 -6.575 1.00 . A A . 15 PRO CG 1 1 6 2817 1 1 15 PRO HA H -0.590 -2.069 -6.099 1.00 . A A . 15 PRO HA 1 1 6 2818 1 1 15 PRO HB2 H -1.296 0.627 -6.154 1.00 . A A . 15 PRO HB2 1 1 6 2819 1 1 15 PRO HB3 H -1.382 -0.448 -7.559 1.00 . A A . 15 PRO HB3 1 1 6 2820 1 1 15 PRO HD2 H -4.741 -1.727 -6.032 1.00 . A A . 15 PRO HD2 1 1 6 2821 1 1 15 PRO HD3 H -3.904 -2.031 -7.580 1.00 . A A . 15 PRO HD3 1 1 6 2822 1 1 15 PRO HG2 H -3.671 0.343 -5.685 1.00 . A A . 15 PRO HG2 1 1 6 2823 1 1 15 PRO HG3 H -3.670 0.350 -7.460 1.00 . A A . 15 PRO HG3 1 1 6 2824 1 1 15 PRO N N -2.690 -2.376 -5.860 1.00 . A A . 15 PRO N 1 1 6 2825 1 1 15 PRO O O 0.051 -1.410 -3.852 1.00 . A A . 15 PRO O 1 1 6 2826 1 1 16 SER C C -1.188 -1.641 -1.003 1.00 . A A . 16 SER C 1 1 6 2827 1 1 16 SER CA C -1.676 -0.438 -1.892 1.00 . A A . 16 SER CA 1 1 6 2828 1 1 16 SER CB C -2.902 0.268 -1.260 1.00 . A A . 16 SER CB 1 1 6 2829 1 1 16 SER H H -2.991 -0.697 -3.616 1.00 . A A . 16 SER H 1 1 6 2830 1 1 16 SER HA H -0.838 0.270 -1.937 1.00 . A A . 16 SER HA 1 1 6 2831 1 1 16 SER HB2 H -2.675 0.548 -0.212 1.00 . A A . 16 SER HB2 1 1 6 2832 1 1 16 SER HB3 H -3.092 1.231 -1.772 1.00 . A A . 16 SER HB3 1 1 6 2833 1 1 16 SER HG H -4.532 -0.352 -2.138 1.00 . A A . 16 SER HG 1 1 6 2834 1 1 16 SER N N -2.026 -0.776 -3.299 1.00 . A A . 16 SER N 1 1 6 2835 1 1 16 SER O O -0.278 -1.440 -0.190 1.00 . A A . 16 SER O 1 1 6 2836 1 1 16 SER OG O -4.093 -0.520 -1.282 1.00 . A A . 16 SER OG 1 1 6 2837 1 1 17 ALA C C 0.345 -4.458 -1.259 1.00 . A A . 17 ALA C 1 1 6 2838 1 1 17 ALA CA C -1.045 -4.100 -0.620 1.00 . A A . 17 ALA CA 1 1 6 2839 1 1 17 ALA CB C -2.066 -5.238 -0.807 1.00 . A A . 17 ALA CB 1 1 6 2840 1 1 17 ALA H H -2.500 -2.932 -1.818 1.00 . A A . 17 ALA H 1 1 6 2841 1 1 17 ALA HA H -0.860 -3.957 0.463 1.00 . A A . 17 ALA HA 1 1 6 2842 1 1 17 ALA HB1 H -3.026 -5.015 -0.303 1.00 . A A . 17 ALA HB1 1 1 6 2843 1 1 17 ALA HB2 H -2.292 -5.433 -1.873 1.00 . A A . 17 ALA HB2 1 1 6 2844 1 1 17 ALA HB3 H -1.695 -6.185 -0.374 1.00 . A A . 17 ALA HB3 1 1 6 2845 1 1 17 ALA N N -1.695 -2.879 -1.176 1.00 . A A . 17 ALA N 1 1 6 2846 1 1 17 ALA O O 1.274 -4.768 -0.509 1.00 . A A . 17 ALA O 1 1 6 2847 1 1 18 PHE C C 2.909 -3.440 -2.927 1.00 . A A . 18 PHE C 1 1 6 2848 1 1 18 PHE CA C 1.859 -4.567 -3.247 1.00 . A A . 18 PHE CA 1 1 6 2849 1 1 18 PHE CB C 1.593 -4.708 -4.775 1.00 . A A . 18 PHE CB 1 1 6 2850 1 1 18 PHE CD1 C 2.832 -6.755 -5.641 1.00 . A A . 18 PHE CD1 1 1 6 2851 1 1 18 PHE CD2 C 3.740 -4.575 -6.152 1.00 . A A . 18 PHE CD2 1 1 6 2852 1 1 18 PHE CE1 C 3.888 -7.354 -6.325 1.00 . A A . 18 PHE CE1 1 1 6 2853 1 1 18 PHE CE2 C 4.795 -5.176 -6.834 1.00 . A A . 18 PHE CE2 1 1 6 2854 1 1 18 PHE CG C 2.751 -5.360 -5.549 1.00 . A A . 18 PHE CG 1 1 6 2855 1 1 18 PHE CZ C 4.868 -6.564 -6.921 1.00 . A A . 18 PHE CZ 1 1 6 2856 1 1 18 PHE H H -0.312 -4.097 -3.126 1.00 . A A . 18 PHE H 1 1 6 2857 1 1 18 PHE HA H 2.302 -5.502 -2.863 1.00 . A A . 18 PHE HA 1 1 6 2858 1 1 18 PHE HB2 H 0.683 -5.317 -4.955 1.00 . A A . 18 PHE HB2 1 1 6 2859 1 1 18 PHE HB3 H 1.333 -3.723 -5.211 1.00 . A A . 18 PHE HB3 1 1 6 2860 1 1 18 PHE HD1 H 2.075 -7.378 -5.185 1.00 . A A . 18 PHE HD1 1 1 6 2861 1 1 18 PHE HD2 H 3.695 -3.497 -6.087 1.00 . A A . 18 PHE HD2 1 1 6 2862 1 1 18 PHE HE1 H 3.939 -8.431 -6.401 1.00 . A A . 18 PHE HE1 1 1 6 2863 1 1 18 PHE HE2 H 5.551 -4.566 -7.305 1.00 . A A . 18 PHE HE2 1 1 6 2864 1 1 18 PHE HZ H 5.681 -7.026 -7.461 1.00 . A A . 18 PHE HZ 1 1 6 2865 1 1 18 PHE N N 0.525 -4.378 -2.597 1.00 . A A . 18 PHE N 1 1 6 2866 1 1 18 PHE O O 4.072 -3.753 -2.667 1.00 . A A . 18 PHE O 1 1 6 2867 1 1 19 LEU C C 3.749 -1.284 -0.792 1.00 . A A . 19 LEU C 1 1 6 2868 1 1 19 LEU CA C 3.328 -1.050 -2.287 1.00 . A A . 19 LEU CA 1 1 6 2869 1 1 19 LEU CB C 2.502 0.269 -2.442 1.00 . A A . 19 LEU CB 1 1 6 2870 1 1 19 LEU CD1 C 2.555 0.489 -5.027 1.00 . A A . 19 LEU CD1 1 1 6 2871 1 1 19 LEU CD2 C 2.082 2.485 -3.599 1.00 . A A . 19 LEU CD2 1 1 6 2872 1 1 19 LEU CG C 2.851 1.154 -3.670 1.00 . A A . 19 LEU CG 1 1 6 2873 1 1 19 LEU H H 1.528 -2.027 -3.161 1.00 . A A . 19 LEU H 1 1 6 2874 1 1 19 LEU HA H 4.278 -0.963 -2.850 1.00 . A A . 19 LEU HA 1 1 6 2875 1 1 19 LEU HB2 H 1.415 0.072 -2.416 1.00 . A A . 19 LEU HB2 1 1 6 2876 1 1 19 LEU HB3 H 2.635 0.899 -1.541 1.00 . A A . 19 LEU HB3 1 1 6 2877 1 1 19 LEU HD11 H 3.097 -0.466 -5.147 1.00 . A A . 19 LEU HD11 1 1 6 2878 1 1 19 LEU HD12 H 1.479 0.270 -5.155 1.00 . A A . 19 LEU HD12 1 1 6 2879 1 1 19 LEU HD13 H 2.858 1.132 -5.875 1.00 . A A . 19 LEU HD13 1 1 6 2880 1 1 19 LEU HD21 H 2.299 3.037 -2.665 1.00 . A A . 19 LEU HD21 1 1 6 2881 1 1 19 LEU HD22 H 2.349 3.161 -4.432 1.00 . A A . 19 LEU HD22 1 1 6 2882 1 1 19 LEU HD23 H 0.986 2.333 -3.641 1.00 . A A . 19 LEU HD23 1 1 6 2883 1 1 19 LEU HG H 3.935 1.388 -3.631 1.00 . A A . 19 LEU HG 1 1 6 2884 1 1 19 LEU N N 2.515 -2.156 -2.881 1.00 . A A . 19 LEU N 1 1 6 2885 1 1 19 LEU O O 4.890 -0.978 -0.456 1.00 . A A . 19 LEU O 1 1 6 2886 1 1 20 GLU C C 4.139 -3.547 1.573 1.00 . A A . 20 GLU C 1 1 6 2887 1 1 20 GLU CA C 3.274 -2.242 1.465 1.00 . A A . 20 GLU CA 1 1 6 2888 1 1 20 GLU CB C 1.932 -2.361 2.253 1.00 . A A . 20 GLU CB 1 1 6 2889 1 1 20 GLU CD C 1.551 0.294 2.212 1.00 . A A . 20 GLU CD 1 1 6 2890 1 1 20 GLU CG C 1.324 -1.071 2.877 1.00 . A A . 20 GLU CG 1 1 6 2891 1 1 20 GLU H H 1.935 -1.937 -0.227 1.00 . A A . 20 GLU H 1 1 6 2892 1 1 20 GLU HA H 3.907 -1.439 1.859 1.00 . A A . 20 GLU HA 1 1 6 2893 1 1 20 GLU HB2 H 1.166 -2.871 1.635 1.00 . A A . 20 GLU HB2 1 1 6 2894 1 1 20 GLU HB3 H 2.066 -3.072 3.094 1.00 . A A . 20 GLU HB3 1 1 6 2895 1 1 20 GLU HE2 H 0.413 -0.373 0.759 1.00 . A A . 20 GLU HE2 1 1 6 2896 1 1 20 GLU HG2 H 0.236 -1.212 3.017 1.00 . A A . 20 GLU HG2 1 1 6 2897 1 1 20 GLU HG3 H 1.711 -0.978 3.909 1.00 . A A . 20 GLU HG3 1 1 6 2898 1 1 20 GLU N N 2.898 -1.845 0.085 1.00 . A A . 20 GLU N 1 1 6 2899 1 1 20 GLU O O 5.025 -3.604 2.434 1.00 . A A . 20 GLU O 1 1 6 2900 1 1 20 GLU OE1 O 2.274 1.159 2.701 1.00 . A A . 20 GLU OE1 1 1 6 2901 1 1 20 GLU OE2 O 0.866 0.441 1.039 1.00 . A A . 20 GLU OE2 1 1 6 2902 1 1 21 ARG C C 6.383 -5.064 0.014 1.00 . A A . 21 ARG C 1 1 6 2903 1 1 21 ARG CA C 4.965 -5.620 0.428 1.00 . A A . 21 ARG CA 1 1 6 2904 1 1 21 ARG CB C 4.327 -6.509 -0.679 1.00 . A A . 21 ARG CB 1 1 6 2905 1 1 21 ARG CD C 4.477 -8.450 -2.325 1.00 . A A . 21 ARG CD 1 1 6 2906 1 1 21 ARG CG C 5.124 -7.763 -1.105 1.00 . A A . 21 ARG CG 1 1 6 2907 1 1 21 ARG CZ C 6.320 -9.495 -3.681 1.00 . A A . 21 ARG CZ 1 1 6 2908 1 1 21 ARG H H 3.098 -4.522 0.149 1.00 . A A . 21 ARG H 1 1 6 2909 1 1 21 ARG HA H 5.086 -6.208 1.347 1.00 . A A . 21 ARG HA 1 1 6 2910 1 1 21 ARG HB2 H 3.319 -6.837 -0.354 1.00 . A A . 21 ARG HB2 1 1 6 2911 1 1 21 ARG HB3 H 4.149 -5.890 -1.576 1.00 . A A . 21 ARG HB3 1 1 6 2912 1 1 21 ARG HD2 H 3.475 -8.832 -2.039 1.00 . A A . 21 ARG HD2 1 1 6 2913 1 1 21 ARG HD3 H 4.263 -7.724 -3.135 1.00 . A A . 21 ARG HD3 1 1 6 2914 1 1 21 ARG HE H 5.125 -10.539 -2.489 1.00 . A A . 21 ARG HE 1 1 6 2915 1 1 21 ARG HG2 H 6.170 -7.482 -1.343 1.00 . A A . 21 ARG HG2 1 1 6 2916 1 1 21 ARG HG3 H 5.202 -8.470 -0.256 1.00 . A A . 21 ARG HG3 1 1 6 2917 1 1 21 ARG HH11 H 6.214 -7.544 -3.883 1.00 . A A . 21 ARG HH11 1 1 6 2918 1 1 21 ARG HH12 H 7.527 -8.383 -4.845 1.00 . A A . 21 ARG HH12 1 1 6 2919 1 1 21 ARG HH21 H 6.599 -11.460 -3.612 1.00 . A A . 21 ARG HH21 1 1 6 2920 1 1 21 ARG HH22 H 7.712 -10.499 -4.685 1.00 . A A . 21 ARG HH22 1 1 6 2921 1 1 21 ARG N N 3.954 -4.566 0.709 1.00 . A A . 21 ARG N 1 1 6 2922 1 1 21 ARG NE N 5.306 -9.585 -2.814 1.00 . A A . 21 ARG NE 1 1 6 2923 1 1 21 ARG NH1 N 6.736 -8.365 -4.200 1.00 . A A . 21 ARG NH1 1 1 6 2924 1 1 21 ARG NH2 N 6.936 -10.589 -4.026 1.00 . A A . 21 ARG NH2 1 1 6 2925 1 1 21 ARG O O 7.397 -5.541 0.530 1.00 . A A . 21 ARG O 1 1 6 2926 1 1 22 LEU C C 8.223 -2.393 -0.055 1.00 . A A . 22 LEU C 1 1 6 2927 1 1 22 LEU CA C 7.693 -3.321 -1.204 1.00 . A A . 22 LEU CA 1 1 6 2928 1 1 22 LEU CB C 7.421 -2.477 -2.484 1.00 . A A . 22 LEU CB 1 1 6 2929 1 1 22 LEU CD1 C 6.703 -2.242 -4.899 1.00 . A A . 22 LEU CD1 1 1 6 2930 1 1 22 LEU CD2 C 8.404 -3.996 -4.314 1.00 . A A . 22 LEU CD2 1 1 6 2931 1 1 22 LEU CG C 7.162 -3.235 -3.816 1.00 . A A . 22 LEU CG 1 1 6 2932 1 1 22 LEU H H 5.579 -3.766 -1.310 1.00 . A A . 22 LEU H 1 1 6 2933 1 1 22 LEU HA H 8.465 -4.068 -1.411 1.00 . A A . 22 LEU HA 1 1 6 2934 1 1 22 LEU HB2 H 6.575 -1.790 -2.284 1.00 . A A . 22 LEU HB2 1 1 6 2935 1 1 22 LEU HB3 H 8.278 -1.798 -2.648 1.00 . A A . 22 LEU HB3 1 1 6 2936 1 1 22 LEU HD11 H 7.458 -1.457 -5.093 1.00 . A A . 22 LEU HD11 1 1 6 2937 1 1 22 LEU HD12 H 6.502 -2.748 -5.860 1.00 . A A . 22 LEU HD12 1 1 6 2938 1 1 22 LEU HD13 H 5.766 -1.731 -4.610 1.00 . A A . 22 LEU HD13 1 1 6 2939 1 1 22 LEU HD21 H 9.267 -3.320 -4.469 1.00 . A A . 22 LEU HD21 1 1 6 2940 1 1 22 LEU HD22 H 8.725 -4.776 -3.600 1.00 . A A . 22 LEU HD22 1 1 6 2941 1 1 22 LEU HD23 H 8.211 -4.509 -5.275 1.00 . A A . 22 LEU HD23 1 1 6 2942 1 1 22 LEU HG H 6.345 -3.966 -3.658 1.00 . A A . 22 LEU HG 1 1 6 2943 1 1 22 LEU N N 6.453 -4.053 -0.874 1.00 . A A . 22 LEU N 1 1 6 2944 1 1 22 LEU O O 9.437 -2.348 0.144 1.00 . A A . 22 LEU O 1 1 6 2945 1 1 23 LYS C C 8.482 -1.310 2.986 1.00 . A A . 23 LYS C 1 1 6 2946 1 1 23 LYS CA C 7.807 -0.672 1.723 1.00 . A A . 23 LYS CA 1 1 6 2947 1 1 23 LYS CB C 6.529 0.141 2.074 1.00 . A A . 23 LYS CB 1 1 6 2948 1 1 23 LYS CD C 5.400 2.109 3.229 1.00 . A A . 23 LYS CD 1 1 6 2949 1 1 23 LYS CE C 5.500 3.452 3.973 1.00 . A A . 23 LYS CE 1 1 6 2950 1 1 23 LYS CG C 6.746 1.409 2.930 1.00 . A A . 23 LYS CG 1 1 6 2951 1 1 23 LYS H H 6.363 -1.837 0.505 1.00 . A A . 23 LYS H 1 1 6 2952 1 1 23 LYS HA H 8.559 0.006 1.272 1.00 . A A . 23 LYS HA 1 1 6 2953 1 1 23 LYS HB2 H 6.032 0.462 1.137 1.00 . A A . 23 LYS HB2 1 1 6 2954 1 1 23 LYS HB3 H 5.796 -0.521 2.575 1.00 . A A . 23 LYS HB3 1 1 6 2955 1 1 23 LYS HD2 H 4.878 2.293 2.267 1.00 . A A . 23 LYS HD2 1 1 6 2956 1 1 23 LYS HD3 H 4.719 1.418 3.767 1.00 . A A . 23 LYS HD3 1 1 6 2957 1 1 23 LYS HE2 H 6.217 4.126 3.452 1.00 . A A . 23 LYS HE2 1 1 6 2958 1 1 23 LYS HE3 H 4.521 3.978 3.896 1.00 . A A . 23 LYS HE3 1 1 6 2959 1 1 23 LYS HG2 H 7.264 1.142 3.871 1.00 . A A . 23 LYS HG2 1 1 6 2960 1 1 23 LYS HG3 H 7.429 2.099 2.395 1.00 . A A . 23 LYS HG3 1 1 6 2961 1 1 23 LYS HZ1 H 5.207 2.653 5.899 1.00 . A A . 23 LYS HZ1 1 1 6 2962 1 1 23 LYS HZ2 H 6.789 2.807 5.509 1.00 . A A . 23 LYS HZ2 1 1 6 2963 1 1 23 LYS HZ3 H 5.920 4.137 5.941 1.00 . A A . 23 LYS HZ3 1 1 6 2964 1 1 23 LYS N N 7.367 -1.664 0.696 1.00 . A A . 23 LYS N 1 1 6 2965 1 1 23 LYS NZ N 5.873 3.261 5.403 1.00 . A A . 23 LYS NZ 1 1 6 2966 1 1 23 LYS O O 9.503 -0.800 3.458 1.00 . A A . 23 LYS O 1 1 6 2967 1 1 24 GLU C C 9.970 -3.922 4.115 1.00 . A A . 24 GLU C 1 1 6 2968 1 1 24 GLU CA C 8.602 -3.258 4.544 1.00 . A A . 24 GLU CA 1 1 6 2969 1 1 24 GLU CB C 7.550 -4.312 5.002 1.00 . A A . 24 GLU CB 1 1 6 2970 1 1 24 GLU CD C 5.937 -6.238 4.443 1.00 . A A . 24 GLU CD 1 1 6 2971 1 1 24 GLU CG C 7.177 -5.458 4.022 1.00 . A A . 24 GLU CG 1 1 6 2972 1 1 24 GLU H H 7.134 -2.778 2.996 1.00 . A A . 24 GLU H 1 1 6 2973 1 1 24 GLU HA H 8.821 -2.584 5.376 1.00 . A A . 24 GLU HA 1 1 6 2974 1 1 24 GLU HB2 H 7.904 -4.773 5.942 1.00 . A A . 24 GLU HB2 1 1 6 2975 1 1 24 GLU HB3 H 6.629 -3.776 5.313 1.00 . A A . 24 GLU HB3 1 1 6 2976 1 1 24 GLU HE2 H 4.966 -4.855 3.477 1.00 . A A . 24 GLU HE2 1 1 6 2977 1 1 24 GLU HG2 H 7.025 -5.070 3.001 1.00 . A A . 24 GLU HG2 1 1 6 2978 1 1 24 GLU HG3 H 8.018 -6.169 3.930 1.00 . A A . 24 GLU HG3 1 1 6 2979 1 1 24 GLU N N 7.940 -2.427 3.509 1.00 . A A . 24 GLU N 1 1 6 2980 1 1 24 GLU O O 10.848 -4.094 4.969 1.00 . A A . 24 GLU O 1 1 6 2981 1 1 24 GLU OE1 O 5.983 -7.269 5.108 1.00 . A A . 24 GLU OE1 1 1 6 2982 1 1 24 GLU OE2 O 4.784 -5.653 4.000 1.00 . A A . 24 GLU OE2 1 1 6 2983 1 1 25 ALA C C 12.424 -3.475 1.916 1.00 . A A . 25 ALA C 1 1 6 2984 1 1 25 ALA CA C 11.438 -4.661 2.223 1.00 . A A . 25 ALA CA 1 1 6 2985 1 1 25 ALA CB C 11.046 -5.432 0.948 1.00 . A A . 25 ALA CB 1 1 6 2986 1 1 25 ALA H H 9.324 -4.224 2.237 1.00 . A A . 25 ALA H 1 1 6 2987 1 1 25 ALA HA H 11.938 -5.339 2.927 1.00 . A A . 25 ALA HA 1 1 6 2988 1 1 25 ALA HB1 H 10.360 -6.277 1.158 1.00 . A A . 25 ALA HB1 1 1 6 2989 1 1 25 ALA HB2 H 10.555 -4.791 0.192 1.00 . A A . 25 ALA HB2 1 1 6 2990 1 1 25 ALA HB3 H 11.931 -5.874 0.464 1.00 . A A . 25 ALA HB3 1 1 6 2991 1 1 25 ALA N N 10.152 -4.264 2.823 1.00 . A A . 25 ALA N 1 1 6 2992 1 1 25 ALA O O 13.609 -3.610 2.222 1.00 . A A . 25 ALA O 1 1 6 2993 1 1 26 TYR C C 13.395 -0.529 2.626 1.00 . A A . 26 TYR C 1 1 6 2994 1 1 26 TYR CA C 12.817 -1.071 1.262 1.00 . A A . 26 TYR CA 1 1 6 2995 1 1 26 TYR CB C 11.954 0.044 0.589 1.00 . A A . 26 TYR CB 1 1 6 2996 1 1 26 TYR CD1 C 12.018 -0.980 -1.800 1.00 . A A . 26 TYR CD1 1 1 6 2997 1 1 26 TYR CD2 C 10.369 0.698 -1.266 1.00 . A A . 26 TYR CD2 1 1 6 2998 1 1 26 TYR CE1 C 11.522 -1.055 -3.099 1.00 . A A . 26 TYR CE1 1 1 6 2999 1 1 26 TYR CE2 C 9.876 0.626 -2.567 1.00 . A A . 26 TYR CE2 1 1 6 3000 1 1 26 TYR CG C 11.442 -0.108 -0.865 1.00 . A A . 26 TYR CG 1 1 6 3001 1 1 26 TYR CZ C 10.454 -0.248 -3.481 1.00 . A A . 26 TYR CZ 1 1 6 3002 1 1 26 TYR H H 11.056 -2.348 0.941 1.00 . A A . 26 TYR H 1 1 6 3003 1 1 26 TYR HA H 13.675 -1.309 0.621 1.00 . A A . 26 TYR HA 1 1 6 3004 1 1 26 TYR HB2 H 11.089 0.252 1.252 1.00 . A A . 26 TYR HB2 1 1 6 3005 1 1 26 TYR HB3 H 12.534 0.987 0.607 1.00 . A A . 26 TYR HB3 1 1 6 3006 1 1 26 TYR HD1 H 12.846 -1.612 -1.525 1.00 . A A . 26 TYR HD1 1 1 6 3007 1 1 26 TYR HD2 H 9.912 1.389 -0.572 1.00 . A A . 26 TYR HD2 1 1 6 3008 1 1 26 TYR HE1 H 11.969 -1.743 -3.802 1.00 . A A . 26 TYR HE1 1 1 6 3009 1 1 26 TYR HE2 H 9.043 1.243 -2.868 1.00 . A A . 26 TYR HE2 1 1 6 3010 1 1 26 TYR HH H 10.514 -0.904 -5.273 1.00 . A A . 26 TYR HH 1 1 6 3011 1 1 26 TYR N N 11.984 -2.310 1.383 1.00 . A A . 26 TYR N 1 1 6 3012 1 1 26 TYR O O 14.562 -0.134 2.697 1.00 . A A . 26 TYR O 1 1 6 3013 1 1 26 TYR OH O 9.957 -0.321 -4.754 1.00 . A A . 26 TYR OH 1 1 6 3014 1 1 27 ARG C C 14.235 -1.600 5.462 1.00 . A A . 27 ARG C 1 1 6 3015 1 1 27 ARG CA C 13.098 -0.559 5.119 1.00 . A A . 27 ARG CA 1 1 6 3016 1 1 27 ARG CB C 11.800 -0.790 5.949 1.00 . A A . 27 ARG CB 1 1 6 3017 1 1 27 ARG CD C 10.700 -1.522 8.195 1.00 . A A . 27 ARG CD 1 1 6 3018 1 1 27 ARG CG C 11.925 -0.888 7.496 1.00 . A A . 27 ARG CG 1 1 6 3019 1 1 27 ARG CZ C 9.873 -3.891 8.424 1.00 . A A . 27 ARG CZ 1 1 6 3020 1 1 27 ARG H H 11.631 -0.839 3.491 1.00 . A A . 27 ARG H 1 1 6 3021 1 1 27 ARG HA H 13.516 0.439 5.350 1.00 . A A . 27 ARG HA 1 1 6 3022 1 1 27 ARG HB2 H 11.066 0.010 5.721 1.00 . A A . 27 ARG HB2 1 1 6 3023 1 1 27 ARG HB3 H 11.313 -1.709 5.574 1.00 . A A . 27 ARG HB3 1 1 6 3024 1 1 27 ARG HD2 H 10.826 -1.411 9.292 1.00 . A A . 27 ARG HD2 1 1 6 3025 1 1 27 ARG HD3 H 9.776 -0.967 7.930 1.00 . A A . 27 ARG HD3 1 1 6 3026 1 1 27 ARG HE H 11.095 -3.308 6.980 1.00 . A A . 27 ARG HE 1 1 6 3027 1 1 27 ARG HG2 H 12.831 -1.457 7.787 1.00 . A A . 27 ARG HG2 1 1 6 3028 1 1 27 ARG HG3 H 12.102 0.127 7.905 1.00 . A A . 27 ARG HG3 1 1 6 3029 1 1 27 ARG HH11 H 9.126 -2.685 9.782 1.00 . A A . 27 ARG HH11 1 1 6 3030 1 1 27 ARG HH12 H 8.608 -4.437 9.884 1.00 . A A . 27 ARG HH12 1 1 6 3031 1 1 27 ARG HH21 H 10.513 -5.234 7.121 1.00 . A A . 27 ARG HH21 1 1 6 3032 1 1 27 ARG HH22 H 9.385 -5.823 8.433 1.00 . A A . 27 ARG HH22 1 1 6 3033 1 1 27 ARG N N 12.601 -0.572 3.712 1.00 . A A . 27 ARG N 1 1 6 3034 1 1 27 ARG NE N 10.588 -2.958 7.805 1.00 . A A . 27 ARG NE 1 1 6 3035 1 1 27 ARG NH1 N 9.123 -3.658 9.471 1.00 . A A . 27 ARG NH1 1 1 6 3036 1 1 27 ARG NH2 N 9.925 -5.102 7.950 1.00 . A A . 27 ARG NH2 1 1 6 3037 1 1 27 ARG O O 15.131 -1.244 6.230 1.00 . A A . 27 ARG O 1 1 6 3038 1 1 28 ARG C C 16.590 -3.493 4.188 1.00 . A A . 28 ARG C 1 1 6 3039 1 1 28 ARG CA C 15.351 -3.800 5.106 1.00 . A A . 28 ARG CA 1 1 6 3040 1 1 28 ARG CB C 14.780 -5.230 4.866 1.00 . A A . 28 ARG CB 1 1 6 3041 1 1 28 ARG CD C 16.419 -6.580 6.439 1.00 . A A . 28 ARG CD 1 1 6 3042 1 1 28 ARG CG C 15.748 -6.434 5.054 1.00 . A A . 28 ARG CG 1 1 6 3043 1 1 28 ARG CZ C 18.097 -5.182 7.682 1.00 . A A . 28 ARG CZ 1 1 6 3044 1 1 28 ARG H H 13.626 -3.005 4.133 1.00 . A A . 28 ARG H 1 1 6 3045 1 1 28 ARG HA H 15.679 -3.704 6.140 1.00 . A A . 28 ARG HA 1 1 6 3046 1 1 28 ARG HB2 H 13.915 -5.384 5.542 1.00 . A A . 28 ARG HB2 1 1 6 3047 1 1 28 ARG HB3 H 14.349 -5.297 3.848 1.00 . A A . 28 ARG HB3 1 1 6 3048 1 1 28 ARG HD2 H 15.653 -6.418 7.227 1.00 . A A . 28 ARG HD2 1 1 6 3049 1 1 28 ARG HD3 H 16.772 -7.624 6.554 1.00 . A A . 28 ARG HD3 1 1 6 3050 1 1 28 ARG HE H 17.802 -5.023 5.751 1.00 . A A . 28 ARG HE 1 1 6 3051 1 1 28 ARG HG2 H 15.164 -7.357 4.862 1.00 . A A . 28 ARG HG2 1 1 6 3052 1 1 28 ARG HG3 H 16.511 -6.443 4.250 1.00 . A A . 28 ARG HG3 1 1 6 3053 1 1 28 ARG HH11 H 17.370 -6.618 8.799 1.00 . A A . 28 ARG HH11 1 1 6 3054 1 1 28 ARG HH12 H 18.375 -5.353 9.663 1.00 . A A . 28 ARG HH12 1 1 6 3055 1 1 28 ARG HH21 H 18.860 -3.634 6.706 1.00 . A A . 28 ARG HH21 1 1 6 3056 1 1 28 ARG HH22 H 19.208 -3.738 8.495 1.00 . A A . 28 ARG HH22 1 1 6 3057 1 1 28 ARG N N 14.229 -2.850 4.940 1.00 . A A . 28 ARG N 1 1 6 3058 1 1 28 ARG NE N 17.569 -5.635 6.552 1.00 . A A . 28 ARG NE 1 1 6 3059 1 1 28 ARG NH1 N 17.929 -5.765 8.841 1.00 . A A . 28 ARG NH1 1 1 6 3060 1 1 28 ARG NH2 N 18.821 -4.100 7.621 1.00 . A A . 28 ARG NH2 1 1 6 3061 1 1 28 ARG O O 17.723 -3.589 4.671 1.00 . A A . 28 ARG O 1 1 6 3062 1 1 29 TYR C C 18.194 -1.323 2.387 1.00 . A A . 29 TYR C 1 1 6 3063 1 1 29 TYR CA C 17.535 -2.702 2.006 1.00 . A A . 29 TYR CA 1 1 6 3064 1 1 29 TYR CB C 16.993 -2.646 0.541 1.00 . A A . 29 TYR CB 1 1 6 3065 1 1 29 TYR CD1 C 16.532 -5.177 0.327 1.00 . A A . 29 TYR CD1 1 1 6 3066 1 1 29 TYR CD2 C 15.041 -3.617 -0.754 1.00 . A A . 29 TYR CD2 1 1 6 3067 1 1 29 TYR CE1 C 15.679 -6.224 -0.008 1.00 . A A . 29 TYR CE1 1 1 6 3068 1 1 29 TYR CE2 C 14.192 -4.666 -1.095 1.00 . A A . 29 TYR CE2 1 1 6 3069 1 1 29 TYR CG C 16.202 -3.858 -0.014 1.00 . A A . 29 TYR CG 1 1 6 3070 1 1 29 TYR CZ C 14.514 -5.969 -0.728 1.00 . A A . 29 TYR CZ 1 1 6 3071 1 1 29 TYR H H 15.434 -3.198 2.575 1.00 . A A . 29 TYR H 1 1 6 3072 1 1 29 TYR HA H 18.350 -3.450 2.056 1.00 . A A . 29 TYR HA 1 1 6 3073 1 1 29 TYR HB2 H 16.378 -1.730 0.443 1.00 . A A . 29 TYR HB2 1 1 6 3074 1 1 29 TYR HB3 H 17.845 -2.467 -0.142 1.00 . A A . 29 TYR HB3 1 1 6 3075 1 1 29 TYR HD1 H 17.413 -5.387 0.916 1.00 . A A . 29 TYR HD1 1 1 6 3076 1 1 29 TYR HD2 H 14.769 -2.608 -1.021 1.00 . A A . 29 TYR HD2 1 1 6 3077 1 1 29 TYR HE1 H 15.908 -7.219 0.342 1.00 . A A . 29 TYR HE1 1 1 6 3078 1 1 29 TYR HE2 H 13.254 -4.453 -1.587 1.00 . A A . 29 TYR HE2 1 1 6 3079 1 1 29 TYR HH H 14.052 -7.820 -0.750 1.00 . A A . 29 TYR HH 1 1 6 3080 1 1 29 TYR N N 16.410 -3.133 2.905 1.00 . A A . 29 TYR N 1 1 6 3081 1 1 29 TYR O O 19.339 -1.065 2.006 1.00 . A A . 29 TYR O 1 1 6 3082 1 1 29 TYR OH O 13.664 -6.994 -1.045 1.00 . A A . 29 TYR OH 1 1 6 3083 1 1 30 THR C C 19.022 -0.013 5.119 1.00 . A A . 30 THR C 1 1 6 3084 1 1 30 THR CA C 18.147 0.620 3.962 1.00 . A A . 30 THR CA 1 1 6 3085 1 1 30 THR CB C 17.033 1.544 4.544 1.00 . A A . 30 THR CB 1 1 6 3086 1 1 30 THR CG2 C 17.579 2.867 5.106 1.00 . A A . 30 THR CG2 1 1 6 3087 1 1 30 THR H H 16.648 -0.915 3.522 1.00 . A A . 30 THR H 1 1 6 3088 1 1 30 THR HA H 18.772 1.216 3.273 1.00 . A A . 30 THR HA 1 1 6 3089 1 1 30 THR HB H 16.520 0.992 5.353 1.00 . A A . 30 THR HB 1 1 6 3090 1 1 30 THR HG1 H 15.667 1.100 3.217 1.00 . A A . 30 THR HG1 1 1 6 3091 1 1 30 THR HG21 H 18.301 2.708 5.927 1.00 . A A . 30 THR HG21 1 1 6 3092 1 1 30 THR HG22 H 18.081 3.466 4.323 1.00 . A A . 30 THR HG22 1 1 6 3093 1 1 30 THR HG23 H 16.761 3.491 5.512 1.00 . A A . 30 THR HG23 1 1 6 3094 1 1 30 THR N N 17.513 -0.476 3.185 1.00 . A A . 30 THR N 1 1 6 3095 1 1 30 THR O O 18.494 -0.833 5.884 1.00 . A A . 30 THR O 1 1 6 3096 1 1 30 THR OG1 O 16.082 1.917 3.543 1.00 . A A . 30 THR OG1 1 1 6 3097 1 1 31 PRO C C 21.153 -0.469 7.658 1.00 . A A . 31 PRO C 1 1 6 3098 1 1 31 PRO CA C 21.246 -0.589 6.098 1.00 . A A . 31 PRO CA 1 1 6 3099 1 1 31 PRO CB C 22.631 -0.176 5.554 1.00 . A A . 31 PRO CB 1 1 6 3100 1 1 31 PRO CD C 21.058 1.287 4.478 1.00 . A A . 31 PRO CD 1 1 6 3101 1 1 31 PRO CG C 22.467 1.266 5.067 1.00 . A A . 31 PRO CG 1 1 6 3102 1 1 31 PRO HA H 21.050 -1.655 5.868 1.00 . A A . 31 PRO HA 1 1 6 3103 1 1 31 PRO HB2 H 23.451 -0.285 6.290 1.00 . A A . 31 PRO HB2 1 1 6 3104 1 1 31 PRO HB3 H 22.902 -0.827 4.699 1.00 . A A . 31 PRO HB3 1 1 6 3105 1 1 31 PRO HD2 H 20.589 2.288 4.558 1.00 . A A . 31 PRO HD2 1 1 6 3106 1 1 31 PRO HD3 H 21.067 0.997 3.408 1.00 . A A . 31 PRO HD3 1 1 6 3107 1 1 31 PRO HG2 H 22.542 1.971 5.920 1.00 . A A . 31 PRO HG2 1 1 6 3108 1 1 31 PRO HG3 H 23.241 1.564 4.333 1.00 . A A . 31 PRO HG3 1 1 6 3109 1 1 31 PRO N N 20.345 0.273 5.275 1.00 . A A . 31 PRO N 1 1 6 3110 1 1 31 PRO O O 21.544 -1.403 8.366 1.00 . A A . 31 PRO O 1 1 6 3111 1 1 32 TYR C C 20.040 0.203 10.642 1.00 . A A . 32 TYR C 1 1 6 3112 1 1 32 TYR CA C 20.910 1.029 9.642 1.00 . A A . 32 TYR CA 1 1 6 3113 1 1 32 TYR CB C 20.656 2.565 9.757 1.00 . A A . 32 TYR CB 1 1 6 3114 1 1 32 TYR CD1 C 22.902 3.671 9.235 1.00 . A A . 32 TYR CD1 1 1 6 3115 1 1 32 TYR CD2 C 21.039 4.111 7.761 1.00 . A A . 32 TYR CD2 1 1 6 3116 1 1 32 TYR CE1 C 23.721 4.463 8.432 1.00 . A A . 32 TYR CE1 1 1 6 3117 1 1 32 TYR CE2 C 21.860 4.904 6.961 1.00 . A A . 32 TYR CE2 1 1 6 3118 1 1 32 TYR CG C 21.555 3.485 8.902 1.00 . A A . 32 TYR CG 1 1 6 3119 1 1 32 TYR CZ C 23.200 5.077 7.297 1.00 . A A . 32 TYR CZ 1 1 6 3120 1 1 32 TYR H H 20.358 1.331 7.521 1.00 . A A . 32 TYR H 1 1 6 3121 1 1 32 TYR HA H 21.966 0.828 9.912 1.00 . A A . 32 TYR HA 1 1 6 3122 1 1 32 TYR HB2 H 19.588 2.779 9.559 1.00 . A A . 32 TYR HB2 1 1 6 3123 1 1 32 TYR HB3 H 20.782 2.865 10.816 1.00 . A A . 32 TYR HB3 1 1 6 3124 1 1 32 TYR HD1 H 23.320 3.195 10.110 1.00 . A A . 32 TYR HD1 1 1 6 3125 1 1 32 TYR HD2 H 20.002 3.980 7.487 1.00 . A A . 32 TYR HD2 1 1 6 3126 1 1 32 TYR HE1 H 24.761 4.604 8.688 1.00 . A A . 32 TYR HE1 1 1 6 3127 1 1 32 TYR HE2 H 21.451 5.381 6.082 1.00 . A A . 32 TYR HE2 1 1 6 3128 1 1 32 TYR HH H 23.497 6.238 5.806 1.00 . A A . 32 TYR HH 1 1 6 3129 1 1 32 TYR N N 20.658 0.646 8.222 1.00 . A A . 32 TYR N 1 1 6 3130 1 1 32 TYR O O 19.275 0.693 11.473 1.00 . A A . 32 TYR O 1 1 6 3131 1 1 32 TYR OXT O 20.265 -1.145 10.526 1.00 . A A . 32 TYR OXT 1 1 6 3132 1 1 32 TYR OH O 24.015 5.850 6.513 1.00 . A A . 32 TYR OH 1 1 7 3133 1 1 1 CYS C C -11.444 1.215 -7.046 1.00 . A A . 1 CYS C 1 1 7 3134 1 1 1 CYS CA C -11.590 0.393 -8.368 1.00 . A A . 1 CYS CA 1 1 7 3135 1 1 1 CYS CB C -11.158 -1.093 -8.317 1.00 . A A . 1 CYS CB 1 1 7 3136 1 1 1 CYS H1 H -10.924 0.555 -10.318 1.00 . A A . 1 CYS H1 1 1 7 3137 1 1 1 CYS H2 H -9.777 0.898 -9.221 1.00 . A A . 1 CYS H2 1 1 7 3138 1 1 1 CYS HA H -12.656 0.420 -8.664 1.00 . A A . 1 CYS HA 1 1 7 3139 1 1 1 CYS HB2 H -11.321 -1.587 -9.294 1.00 . A A . 1 CYS HB2 1 1 7 3140 1 1 1 CYS HB3 H -10.081 -1.206 -8.089 1.00 . A A . 1 CYS HB3 1 1 7 3141 1 1 1 CYS HG H -11.555 -3.173 -7.225 1.00 . A A . 1 CYS HG 1 1 7 3142 1 1 1 CYS N N -10.773 1.038 -9.425 1.00 . A A . 1 CYS N 1 1 7 3143 1 1 1 CYS O O -12.162 2.210 -6.896 1.00 . A A . 1 CYS O 1 1 7 3144 1 1 1 CYS SG S -12.132 -1.984 -7.058 1.00 . A A . 1 CYS SG 1 1 7 3145 1 1 2 ALA C C -8.739 1.561 -4.510 1.00 . A A . 2 ALA C 1 1 7 3146 1 1 2 ALA CA C -10.261 1.648 -4.889 1.00 . A A . 2 ALA CA 1 1 7 3147 1 1 2 ALA CB C -11.183 1.113 -3.772 1.00 . A A . 2 ALA CB 1 1 7 3148 1 1 2 ALA H H -10.042 -0.019 -6.332 1.00 . A A . 2 ALA H 1 1 7 3149 1 1 2 ALA HA H -10.504 2.716 -5.043 1.00 . A A . 2 ALA HA 1 1 7 3150 1 1 2 ALA HB1 H -12.251 1.217 -4.038 1.00 . A A . 2 ALA HB1 1 1 7 3151 1 1 2 ALA HB2 H -11.001 0.044 -3.550 1.00 . A A . 2 ALA HB2 1 1 7 3152 1 1 2 ALA HB3 H -11.035 1.669 -2.827 1.00 . A A . 2 ALA HB3 1 1 7 3153 1 1 2 ALA N N -10.532 0.856 -6.118 1.00 . A A . 2 ALA N 1 1 7 3154 1 1 2 ALA O O -8.318 0.661 -3.783 1.00 . A A . 2 ALA O 1 1 7 3155 1 1 3 LYS C C -6.549 3.290 -6.931 1.00 . A A . 3 LYS C 1 1 7 3156 1 1 3 LYS CA C -7.922 3.226 -6.186 1.00 . A A . 3 LYS CA 1 1 7 3157 1 1 3 LYS CB C -8.449 4.653 -5.836 1.00 . A A . 3 LYS CB 1 1 7 3158 1 1 3 LYS CD C -10.423 4.788 -7.488 1.00 . A A . 3 LYS CD 1 1 7 3159 1 1 3 LYS CE C -11.120 5.523 -8.642 1.00 . A A . 3 LYS CE 1 1 7 3160 1 1 3 LYS CG C -9.099 5.427 -7.014 1.00 . A A . 3 LYS CG 1 1 7 3161 1 1 3 LYS H H -6.873 2.112 -4.633 1.00 . A A . 3 LYS H 1 1 7 3162 1 1 3 LYS HA H -8.621 2.687 -6.835 1.00 . A A . 3 LYS HA 1 1 7 3163 1 1 3 LYS HB2 H -9.183 4.606 -5.008 1.00 . A A . 3 LYS HB2 1 1 7 3164 1 1 3 LYS HB3 H -7.621 5.254 -5.410 1.00 . A A . 3 LYS HB3 1 1 7 3165 1 1 3 LYS HD2 H -10.223 3.747 -7.806 1.00 . A A . 3 LYS HD2 1 1 7 3166 1 1 3 LYS HD3 H -11.109 4.701 -6.620 1.00 . A A . 3 LYS HD3 1 1 7 3167 1 1 3 LYS HE2 H -11.370 6.566 -8.345 1.00 . A A . 3 LYS HE2 1 1 7 3168 1 1 3 LYS HE3 H -10.431 5.618 -9.512 1.00 . A A . 3 LYS HE3 1 1 7 3169 1 1 3 LYS HG2 H -9.288 6.470 -6.689 1.00 . A A . 3 LYS HG2 1 1 7 3170 1 1 3 LYS HG3 H -8.380 5.518 -7.851 1.00 . A A . 3 LYS HG3 1 1 7 3171 1 1 3 LYS HZ1 H -12.125 3.769 -9.232 1.00 . A A . 3 LYS HZ1 1 1 7 3172 1 1 3 LYS HZ2 H -13.008 4.684 -8.224 1.00 . A A . 3 LYS HZ2 1 1 7 3173 1 1 3 LYS HZ3 H -12.862 5.131 -9.805 1.00 . A A . 3 LYS HZ3 1 1 7 3174 1 1 3 LYS N N -7.798 2.414 -4.953 1.00 . A A . 3 LYS N 1 1 7 3175 1 1 3 LYS NZ N -12.341 4.750 -9.004 1.00 . A A . 3 LYS NZ 1 1 7 3176 1 1 3 LYS O O -5.518 3.654 -6.354 1.00 . A A . 3 LYS O 1 1 7 3177 1 1 4 VAL C C -5.315 4.348 -9.858 1.00 . A A . 4 VAL C 1 1 7 3178 1 1 4 VAL CA C -5.354 2.969 -9.110 1.00 . A A . 4 VAL CA 1 1 7 3179 1 1 4 VAL CB C -5.377 1.700 -10.040 1.00 . A A . 4 VAL CB 1 1 7 3180 1 1 4 VAL CG1 C -6.595 1.511 -10.981 1.00 . A A . 4 VAL CG1 1 1 7 3181 1 1 4 VAL CG2 C -4.085 1.566 -10.878 1.00 . A A . 4 VAL CG2 1 1 7 3182 1 1 4 VAL H H -7.469 3.067 -8.672 1.00 . A A . 4 VAL H 1 1 7 3183 1 1 4 VAL HA H -4.428 2.887 -8.503 1.00 . A A . 4 VAL HA 1 1 7 3184 1 1 4 VAL HB H -5.379 0.828 -9.357 1.00 . A A . 4 VAL HB 1 1 7 3185 1 1 4 VAL HG11 H -7.551 1.517 -10.429 1.00 . A A . 4 VAL HG11 1 1 7 3186 1 1 4 VAL HG12 H -6.657 2.299 -11.753 1.00 . A A . 4 VAL HG12 1 1 7 3187 1 1 4 VAL HG13 H -6.551 0.544 -11.516 1.00 . A A . 4 VAL HG13 1 1 7 3188 1 1 4 VAL HG21 H -3.177 1.610 -10.247 1.00 . A A . 4 VAL HG21 1 1 7 3189 1 1 4 VAL HG22 H -4.042 0.602 -11.418 1.00 . A A . 4 VAL HG22 1 1 7 3190 1 1 4 VAL HG23 H -3.997 2.368 -11.636 1.00 . A A . 4 VAL HG23 1 1 7 3191 1 1 4 VAL N N -6.560 2.954 -8.233 1.00 . A A . 4 VAL N 1 1 7 3192 1 1 4 VAL O O -5.771 4.527 -10.990 1.00 . A A . 4 VAL O 1 1 7 3193 1 1 5 LYS C C -2.844 6.827 -9.489 1.00 . A A . 5 LYS C 1 1 7 3194 1 1 5 LYS CA C -4.382 6.657 -9.734 1.00 . A A . 5 LYS CA 1 1 7 3195 1 1 5 LYS CB C -5.329 7.756 -9.140 1.00 . A A . 5 LYS CB 1 1 7 3196 1 1 5 LYS CD C -5.334 7.393 -6.517 1.00 . A A . 5 LYS CD 1 1 7 3197 1 1 5 LYS CE C -4.313 7.545 -5.372 1.00 . A A . 5 LYS CE 1 1 7 3198 1 1 5 LYS CG C -5.128 8.355 -7.719 1.00 . A A . 5 LYS CG 1 1 7 3199 1 1 5 LYS H H -4.357 4.966 -8.283 1.00 . A A . 5 LYS H 1 1 7 3200 1 1 5 LYS HA H -4.539 6.666 -10.834 1.00 . A A . 5 LYS HA 1 1 7 3201 1 1 5 LYS HB2 H -5.295 8.610 -9.843 1.00 . A A . 5 LYS HB2 1 1 7 3202 1 1 5 LYS HB3 H -6.378 7.407 -9.229 1.00 . A A . 5 LYS HB3 1 1 7 3203 1 1 5 LYS HD2 H -6.353 7.562 -6.116 1.00 . A A . 5 LYS HD2 1 1 7 3204 1 1 5 LYS HD3 H -5.372 6.337 -6.839 1.00 . A A . 5 LYS HD3 1 1 7 3205 1 1 5 LYS HE2 H -4.269 8.607 -5.042 1.00 . A A . 5 LYS HE2 1 1 7 3206 1 1 5 LYS HE3 H -4.664 6.984 -4.478 1.00 . A A . 5 LYS HE3 1 1 7 3207 1 1 5 LYS HG2 H -4.142 8.854 -7.678 1.00 . A A . 5 LYS HG2 1 1 7 3208 1 1 5 LYS HG3 H -5.828 9.206 -7.600 1.00 . A A . 5 LYS HG3 1 1 7 3209 1 1 5 LYS HZ1 H -2.706 7.427 -6.738 1.00 . A A . 5 LYS HZ1 1 1 7 3210 1 1 5 LYS HZ2 H -2.199 7.275 -5.164 1.00 . A A . 5 LYS HZ2 1 1 7 3211 1 1 5 LYS HZ3 H -2.943 6.036 -5.977 1.00 . A A . 5 LYS HZ3 1 1 7 3212 1 1 5 LYS N N -4.751 5.334 -9.155 1.00 . A A . 5 LYS N 1 1 7 3213 1 1 5 LYS NZ N -2.973 7.055 -5.803 1.00 . A A . 5 LYS NZ 1 1 7 3214 1 1 5 LYS O O -2.387 7.409 -8.498 1.00 . A A . 5 LYS O 1 1 7 3215 1 1 6 GLY C C 0.464 5.964 -10.739 1.00 . A A . 6 GLY C 1 1 7 3216 1 1 6 GLY CA C -0.753 5.581 -9.877 1.00 . A A . 6 GLY CA 1 1 7 3217 1 1 6 GLY H H -2.535 5.762 -11.139 1.00 . A A . 6 GLY H 1 1 7 3218 1 1 6 GLY HA2 H -0.568 5.779 -8.801 1.00 . A A . 6 GLY HA2 1 1 7 3219 1 1 6 GLY HA3 H -0.865 4.481 -9.911 1.00 . A A . 6 GLY HA3 1 1 7 3220 1 1 6 GLY N N -2.039 6.161 -10.333 1.00 . A A . 6 GLY N 1 1 7 3221 1 1 6 GLY O O 0.588 5.515 -11.879 1.00 . A A . 6 GLY O 1 1 7 3222 1 1 7 ILE C C 3.761 6.813 -9.718 1.00 . A A . 7 ILE C 1 1 7 3223 1 1 7 ILE CA C 2.683 7.102 -10.816 1.00 . A A . 7 ILE CA 1 1 7 3224 1 1 7 ILE CB C 2.685 8.596 -11.320 1.00 . A A . 7 ILE CB 1 1 7 3225 1 1 7 ILE CD1 C 1.332 10.350 -12.730 1.00 . A A . 7 ILE CD1 1 1 7 3226 1 1 7 ILE CG1 C 1.605 8.867 -12.417 1.00 . A A . 7 ILE CG1 1 1 7 3227 1 1 7 ILE CG2 C 4.073 8.972 -11.913 1.00 . A A . 7 ILE CG2 1 1 7 3228 1 1 7 ILE H H 1.108 7.163 -9.271 1.00 . A A . 7 ILE H 1 1 7 3229 1 1 7 ILE HA H 2.877 6.448 -11.692 1.00 . A A . 7 ILE HA 1 1 7 3230 1 1 7 ILE HB H 2.462 9.244 -10.448 1.00 . A A . 7 ILE HB 1 1 7 3231 1 1 7 ILE HD11 H 1.056 10.917 -11.821 1.00 . A A . 7 ILE HD11 1 1 7 3232 1 1 7 ILE HD12 H 2.206 10.852 -13.184 1.00 . A A . 7 ILE HD12 1 1 7 3233 1 1 7 ILE HD13 H 0.496 10.459 -13.446 1.00 . A A . 7 ILE HD13 1 1 7 3234 1 1 7 ILE HG12 H 1.854 8.323 -13.349 1.00 . A A . 7 ILE HG12 1 1 7 3235 1 1 7 ILE HG13 H 0.635 8.437 -12.102 1.00 . A A . 7 ILE HG13 1 1 7 3236 1 1 7 ILE HG21 H 4.890 8.859 -11.176 1.00 . A A . 7 ILE HG21 1 1 7 3237 1 1 7 ILE HG22 H 4.338 8.352 -12.790 1.00 . A A . 7 ILE HG22 1 1 7 3238 1 1 7 ILE HG23 H 4.116 10.027 -12.240 1.00 . A A . 7 ILE HG23 1 1 7 3239 1 1 7 ILE N N 1.379 6.758 -10.171 1.00 . A A . 7 ILE N 1 1 7 3240 1 1 7 ILE O O 3.909 7.583 -8.761 1.00 . A A . 7 ILE O 1 1 7 3241 1 1 8 THR C C 6.560 4.316 -9.336 1.00 . A A . 8 THR C 1 1 7 3242 1 1 8 THR CA C 5.487 5.292 -8.745 1.00 . A A . 8 THR CA 1 1 7 3243 1 1 8 THR CB C 4.745 4.705 -7.494 1.00 . A A . 8 THR CB 1 1 7 3244 1 1 8 THR CG2 C 5.674 4.291 -6.341 1.00 . A A . 8 THR CG2 1 1 7 3245 1 1 8 THR H H 4.143 5.012 -10.504 1.00 . A A . 8 THR H 1 1 7 3246 1 1 8 THR HA H 6.049 6.193 -8.425 1.00 . A A . 8 THR HA 1 1 7 3247 1 1 8 THR HB H 4.142 3.835 -7.818 1.00 . A A . 8 THR HB 1 1 7 3248 1 1 8 THR HG1 H 3.873 6.435 -7.557 1.00 . A A . 8 THR HG1 1 1 7 3249 1 1 8 THR HG21 H 6.304 5.134 -6.000 1.00 . A A . 8 THR HG21 1 1 7 3250 1 1 8 THR HG22 H 5.090 3.955 -5.467 1.00 . A A . 8 THR HG22 1 1 7 3251 1 1 8 THR HG23 H 6.350 3.463 -6.620 1.00 . A A . 8 THR HG23 1 1 7 3252 1 1 8 THR N N 4.475 5.673 -9.790 1.00 . A A . 8 THR N 1 1 7 3253 1 1 8 THR O O 7.741 4.671 -9.341 1.00 . A A . 8 THR O 1 1 7 3254 1 1 8 THR OG1 O 3.874 5.686 -6.935 1.00 . A A . 8 THR OG1 1 1 7 3255 1 1 9 GLN C C 6.335 1.497 -11.634 1.00 . A A . 9 GLN C 1 1 7 3256 1 1 9 GLN CA C 7.139 2.167 -10.473 1.00 . A A . 9 GLN CA 1 1 7 3257 1 1 9 GLN CB C 7.715 1.124 -9.467 1.00 . A A . 9 GLN CB 1 1 7 3258 1 1 9 GLN CD C 9.265 0.600 -7.437 1.00 . A A . 9 GLN CD 1 1 7 3259 1 1 9 GLN CG C 8.710 1.656 -8.401 1.00 . A A . 9 GLN CG 1 1 7 3260 1 1 9 GLN H H 5.245 3.106 -10.217 1.00 . A A . 9 GLN H 1 1 7 3261 1 1 9 GLN HA H 7.962 2.740 -10.925 1.00 . A A . 9 GLN HA 1 1 7 3262 1 1 9 GLN HB2 H 6.881 0.594 -8.969 1.00 . A A . 9 GLN HB2 1 1 7 3263 1 1 9 GLN HB3 H 8.228 0.334 -10.050 1.00 . A A . 9 GLN HB3 1 1 7 3264 1 1 9 GLN HE21 H 10.388 -0.188 -8.886 1.00 . A A . 9 GLN HE21 1 1 7 3265 1 1 9 GLN HE22 H 10.478 -0.949 -7.211 1.00 . A A . 9 GLN HE22 1 1 7 3266 1 1 9 GLN HG2 H 9.551 2.184 -8.889 1.00 . A A . 9 GLN HG2 1 1 7 3267 1 1 9 GLN HG3 H 8.214 2.431 -7.790 1.00 . A A . 9 GLN HG3 1 1 7 3268 1 1 9 GLN N N 6.193 3.101 -9.796 1.00 . A A . 9 GLN N 1 1 7 3269 1 1 9 GLN NE2 N 10.150 -0.257 -7.893 1.00 . A A . 9 GLN NE2 1 1 7 3270 1 1 9 GLN O O 5.977 0.316 -11.591 1.00 . A A . 9 GLN O 1 1 7 3271 1 1 9 GLN OE1 O 8.933 0.544 -6.255 1.00 . A A . 9 GLN OE1 1 1 7 3272 1 1 10 GLY C C 3.359 2.524 -12.118 1.00 . A A . 10 GLY C 1 1 7 3273 1 1 10 GLY CA C 4.519 2.194 -13.123 1.00 . A A . 10 GLY CA 1 1 7 3274 1 1 10 GLY H H 6.309 3.254 -12.559 1.00 . A A . 10 GLY H 1 1 7 3275 1 1 10 GLY HA2 H 4.433 2.870 -13.988 1.00 . A A . 10 GLY HA2 1 1 7 3276 1 1 10 GLY HA3 H 4.370 1.169 -13.510 1.00 . A A . 10 GLY HA3 1 1 7 3277 1 1 10 GLY N N 5.897 2.320 -12.606 1.00 . A A . 10 GLY N 1 1 7 3278 1 1 10 GLY O O 3.606 2.968 -10.989 1.00 . A A . 10 GLY O 1 1 7 3279 1 1 11 PRO C C 1.024 1.087 -10.450 1.00 . A A . 11 PRO C 1 1 7 3280 1 1 11 PRO CA C 0.934 2.213 -11.538 1.00 . A A . 11 PRO CA 1 1 7 3281 1 1 11 PRO CB C -0.267 2.054 -12.497 1.00 . A A . 11 PRO CB 1 1 7 3282 1 1 11 PRO CD C 1.669 2.403 -13.895 1.00 . A A . 11 PRO CD 1 1 7 3283 1 1 11 PRO CG C 0.170 2.692 -13.815 1.00 . A A . 11 PRO CG 1 1 7 3284 1 1 11 PRO HA H 0.854 3.179 -11.011 1.00 . A A . 11 PRO HA 1 1 7 3285 1 1 11 PRO HB2 H -0.501 0.986 -12.677 1.00 . A A . 11 PRO HB2 1 1 7 3286 1 1 11 PRO HB3 H -1.188 2.512 -12.090 1.00 . A A . 11 PRO HB3 1 1 7 3287 1 1 11 PRO HD2 H 1.921 1.483 -14.452 1.00 . A A . 11 PRO HD2 1 1 7 3288 1 1 11 PRO HD3 H 2.211 3.245 -14.369 1.00 . A A . 11 PRO HD3 1 1 7 3289 1 1 11 PRO HG2 H -0.386 2.303 -14.688 1.00 . A A . 11 PRO HG2 1 1 7 3290 1 1 11 PRO HG3 H -0.003 3.786 -13.784 1.00 . A A . 11 PRO HG3 1 1 7 3291 1 1 11 PRO N N 2.081 2.263 -12.492 1.00 . A A . 11 PRO N 1 1 7 3292 1 1 11 PRO O O 0.476 -0.011 -10.586 1.00 . A A . 11 PRO O 1 1 7 3293 1 1 12 ASN C C 1.203 0.088 -7.161 1.00 . A A . 12 ASN C 1 1 7 3294 1 1 12 ASN CA C 2.180 0.340 -8.375 1.00 . A A . 12 ASN CA 1 1 7 3295 1 1 12 ASN CB C 3.588 0.860 -7.945 1.00 . A A . 12 ASN CB 1 1 7 3296 1 1 12 ASN CG C 4.527 -0.145 -7.276 1.00 . A A . 12 ASN CG 1 1 7 3297 1 1 12 ASN H H 2.248 2.267 -9.462 1.00 . A A . 12 ASN H 1 1 7 3298 1 1 12 ASN HA H 2.294 -0.643 -8.877 1.00 . A A . 12 ASN HA 1 1 7 3299 1 1 12 ASN HB2 H 4.161 1.215 -8.824 1.00 . A A . 12 ASN HB2 1 1 7 3300 1 1 12 ASN HB3 H 3.460 1.741 -7.289 1.00 . A A . 12 ASN HB3 1 1 7 3301 1 1 12 ASN HD21 H 5.587 1.351 -6.489 1.00 . A A . 12 ASN HD21 1 1 7 3302 1 1 12 ASN HD22 H 6.166 -0.374 -6.221 1.00 . A A . 12 ASN HD22 1 1 7 3303 1 1 12 ASN N N 1.735 1.383 -9.353 1.00 . A A . 12 ASN N 1 1 7 3304 1 1 12 ASN ND2 N 5.499 0.334 -6.542 1.00 . A A . 12 ASN ND2 1 1 7 3305 1 1 12 ASN O O 1.642 -0.321 -6.081 1.00 . A A . 12 ASN O 1 1 7 3306 1 1 12 ASN OD1 O 4.451 -1.355 -7.451 1.00 . A A . 12 ASN OD1 1 1 7 3307 1 1 13 GLU C C -2.573 0.236 -6.764 1.00 . A A . 13 GLU C 1 1 7 3308 1 1 13 GLU CA C -1.109 0.255 -6.209 1.00 . A A . 13 GLU CA 1 1 7 3309 1 1 13 GLU CB C -0.905 1.468 -5.236 1.00 . A A . 13 GLU CB 1 1 7 3310 1 1 13 GLU CD C -2.364 3.531 -6.068 1.00 . A A . 13 GLU CD 1 1 7 3311 1 1 13 GLU CG C -0.985 2.931 -5.771 1.00 . A A . 13 GLU CG 1 1 7 3312 1 1 13 GLU H H -0.372 0.608 -8.271 1.00 . A A . 13 GLU H 1 1 7 3313 1 1 13 GLU HA H -0.949 -0.680 -5.634 1.00 . A A . 13 GLU HA 1 1 7 3314 1 1 13 GLU HB2 H -1.599 1.367 -4.381 1.00 . A A . 13 GLU HB2 1 1 7 3315 1 1 13 GLU HB3 H 0.091 1.346 -4.772 1.00 . A A . 13 GLU HB3 1 1 7 3316 1 1 13 GLU HE2 H -4.220 3.312 -5.605 1.00 . A A . 13 GLU HE2 1 1 7 3317 1 1 13 GLU HG2 H -0.499 3.601 -5.040 1.00 . A A . 13 GLU HG2 1 1 7 3318 1 1 13 GLU HG3 H -0.371 3.013 -6.684 1.00 . A A . 13 GLU HG3 1 1 7 3319 1 1 13 GLU N N -0.119 0.309 -7.321 1.00 . A A . 13 GLU N 1 1 7 3320 1 1 13 GLU O O -2.917 0.927 -7.728 1.00 . A A . 13 GLU O 1 1 7 3321 1 1 13 GLU OE1 O -2.558 4.411 -6.905 1.00 . A A . 13 GLU OE1 1 1 7 3322 1 1 13 GLU OE2 O -3.348 3.028 -5.272 1.00 . A A . 13 GLU OE2 1 1 7 3323 1 1 14 SER C C -5.184 0.125 -4.390 1.00 . A A . 14 SER C 1 1 7 3324 1 1 14 SER CA C -4.886 -0.032 -5.926 1.00 . A A . 14 SER CA 1 1 7 3325 1 1 14 SER CB C -5.831 -0.978 -6.707 1.00 . A A . 14 SER CB 1 1 7 3326 1 1 14 SER H H -3.023 -1.044 -5.335 1.00 . A A . 14 SER H 1 1 7 3327 1 1 14 SER HA H -5.025 0.976 -6.364 1.00 . A A . 14 SER HA 1 1 7 3328 1 1 14 SER HB2 H -5.614 -0.899 -7.790 1.00 . A A . 14 SER HB2 1 1 7 3329 1 1 14 SER HB3 H -5.663 -2.045 -6.474 1.00 . A A . 14 SER HB3 1 1 7 3330 1 1 14 SER HG H -7.338 -0.543 -5.531 1.00 . A A . 14 SER HG 1 1 7 3331 1 1 14 SER N N -3.468 -0.476 -6.061 1.00 . A A . 14 SER N 1 1 7 3332 1 1 14 SER O O -5.280 1.287 -3.985 1.00 . A A . 14 SER O 1 1 7 3333 1 1 14 SER OG O -7.202 -0.629 -6.484 1.00 . A A . 14 SER OG 1 1 7 3334 1 1 15 PRO C C -3.951 -0.398 -1.260 1.00 . A A . 15 PRO C 1 1 7 3335 1 1 15 PRO CA C -5.325 -0.653 -1.997 1.00 . A A . 15 PRO CA 1 1 7 3336 1 1 15 PRO CB C -5.994 -1.969 -1.548 1.00 . A A . 15 PRO CB 1 1 7 3337 1 1 15 PRO CD C -5.352 -2.328 -3.831 1.00 . A A . 15 PRO CD 1 1 7 3338 1 1 15 PRO CG C -5.368 -3.018 -2.471 1.00 . A A . 15 PRO CG 1 1 7 3339 1 1 15 PRO HA H -5.981 0.204 -1.747 1.00 . A A . 15 PRO HA 1 1 7 3340 1 1 15 PRO HB2 H -5.842 -2.200 -0.476 1.00 . A A . 15 PRO HB2 1 1 7 3341 1 1 15 PRO HB3 H -7.091 -1.919 -1.702 1.00 . A A . 15 PRO HB3 1 1 7 3342 1 1 15 PRO HD2 H -4.500 -2.673 -4.449 1.00 . A A . 15 PRO HD2 1 1 7 3343 1 1 15 PRO HD3 H -6.291 -2.549 -4.374 1.00 . A A . 15 PRO HD3 1 1 7 3344 1 1 15 PRO HG2 H -4.326 -3.220 -2.154 1.00 . A A . 15 PRO HG2 1 1 7 3345 1 1 15 PRO HG3 H -5.915 -3.980 -2.475 1.00 . A A . 15 PRO HG3 1 1 7 3346 1 1 15 PRO N N -5.274 -0.895 -3.477 1.00 . A A . 15 PRO N 1 1 7 3347 1 1 15 PRO O O -3.860 -0.587 -0.043 1.00 . A A . 15 PRO O 1 1 7 3348 1 1 16 SER C C -1.077 -1.700 -1.579 1.00 . A A . 16 SER C 1 1 7 3349 1 1 16 SER CA C -1.440 -0.168 -1.611 1.00 . A A . 16 SER CA 1 1 7 3350 1 1 16 SER CB C -1.120 0.683 -0.346 1.00 . A A . 16 SER CB 1 1 7 3351 1 1 16 SER H H -3.150 0.041 -2.976 1.00 . A A . 16 SER H 1 1 7 3352 1 1 16 SER HA H -0.825 0.234 -2.436 1.00 . A A . 16 SER HA 1 1 7 3353 1 1 16 SER HB2 H -0.026 0.765 -0.219 1.00 . A A . 16 SER HB2 1 1 7 3354 1 1 16 SER HB3 H -1.476 1.720 -0.498 1.00 . A A . 16 SER HB3 1 1 7 3355 1 1 16 SER HG H -2.614 -0.089 0.613 1.00 . A A . 16 SER HG 1 1 7 3356 1 1 16 SER N N -2.881 -0.012 -1.991 1.00 . A A . 16 SER N 1 1 7 3357 1 1 16 SER O O -1.051 -2.292 -2.662 1.00 . A A . 16 SER O 1 1 7 3358 1 1 16 SER OG O -1.690 0.156 0.849 1.00 . A A . 16 SER OG 1 1 7 3359 1 1 17 ALA C C 0.495 -4.534 -0.983 1.00 . A A . 17 ALA C 1 1 7 3360 1 1 17 ALA CA C -0.683 -3.826 -0.211 1.00 . A A . 17 ALA CA 1 1 7 3361 1 1 17 ALA CB C -2.053 -4.478 -0.523 1.00 . A A . 17 ALA CB 1 1 7 3362 1 1 17 ALA H H -0.965 -1.712 0.396 1.00 . A A . 17 ALA H 1 1 7 3363 1 1 17 ALA HA H -0.444 -3.988 0.863 1.00 . A A . 17 ALA HA 1 1 7 3364 1 1 17 ALA HB1 H -2.872 -4.004 0.053 1.00 . A A . 17 ALA HB1 1 1 7 3365 1 1 17 ALA HB2 H -2.323 -4.399 -1.592 1.00 . A A . 17 ALA HB2 1 1 7 3366 1 1 17 ALA HB3 H -2.066 -5.551 -0.263 1.00 . A A . 17 ALA HB3 1 1 7 3367 1 1 17 ALA N N -0.821 -2.338 -0.411 1.00 . A A . 17 ALA N 1 1 7 3368 1 1 17 ALA O O 1.365 -5.125 -0.335 1.00 . A A . 17 ALA O 1 1 7 3369 1 1 18 PHE C C 2.886 -3.597 -2.848 1.00 . A A . 18 PHE C 1 1 7 3370 1 1 18 PHE CA C 1.816 -4.720 -3.093 1.00 . A A . 18 PHE CA 1 1 7 3371 1 1 18 PHE CB C 1.418 -4.843 -4.593 1.00 . A A . 18 PHE CB 1 1 7 3372 1 1 18 PHE CD1 C 3.007 -6.562 -5.581 1.00 . A A . 18 PHE CD1 1 1 7 3373 1 1 18 PHE CD2 C 3.259 -4.259 -6.267 1.00 . A A . 18 PHE CD2 1 1 7 3374 1 1 18 PHE CE1 C 4.092 -6.919 -6.380 1.00 . A A . 18 PHE CE1 1 1 7 3375 1 1 18 PHE CE2 C 4.341 -4.620 -7.068 1.00 . A A . 18 PHE CE2 1 1 7 3376 1 1 18 PHE CG C 2.581 -5.232 -5.523 1.00 . A A . 18 PHE CG 1 1 7 3377 1 1 18 PHE CZ C 4.757 -5.947 -7.122 1.00 . A A . 18 PHE CZ 1 1 7 3378 1 1 18 PHE H H -0.190 -3.878 -2.698 1.00 . A A . 18 PHE H 1 1 7 3379 1 1 18 PHE HA H 2.282 -5.664 -2.767 1.00 . A A . 18 PHE HA 1 1 7 3380 1 1 18 PHE HB2 H 0.615 -5.599 -4.706 1.00 . A A . 18 PHE HB2 1 1 7 3381 1 1 18 PHE HB3 H 0.949 -3.902 -4.946 1.00 . A A . 18 PHE HB3 1 1 7 3382 1 1 18 PHE HD1 H 2.509 -7.314 -4.989 1.00 . A A . 18 PHE HD1 1 1 7 3383 1 1 18 PHE HD2 H 2.970 -3.215 -6.206 1.00 . A A . 18 PHE HD2 1 1 7 3384 1 1 18 PHE HE1 H 4.422 -7.947 -6.416 1.00 . A A . 18 PHE HE1 1 1 7 3385 1 1 18 PHE HE2 H 4.868 -3.868 -7.638 1.00 . A A . 18 PHE HE2 1 1 7 3386 1 1 18 PHE HZ H 5.602 -6.223 -7.737 1.00 . A A . 18 PHE HZ 1 1 7 3387 1 1 18 PHE N N 0.551 -4.496 -2.326 1.00 . A A . 18 PHE N 1 1 7 3388 1 1 18 PHE O O 4.034 -3.903 -2.521 1.00 . A A . 18 PHE O 1 1 7 3389 1 1 19 LEU C C 3.777 -1.301 -0.946 1.00 . A A . 19 LEU C 1 1 7 3390 1 1 19 LEU CA C 3.284 -1.162 -2.426 1.00 . A A . 19 LEU CA 1 1 7 3391 1 1 19 LEU CB C 2.374 0.091 -2.571 1.00 . A A . 19 LEU CB 1 1 7 3392 1 1 19 LEU CD1 C 4.017 1.708 -3.691 1.00 . A A . 19 LEU CD1 1 1 7 3393 1 1 19 LEU CD2 C 2.043 2.594 -2.429 1.00 . A A . 19 LEU CD2 1 1 7 3394 1 1 19 LEU CG C 3.084 1.466 -2.493 1.00 . A A . 19 LEU CG 1 1 7 3395 1 1 19 LEU H H 1.507 -2.233 -3.225 1.00 . A A . 19 LEU H 1 1 7 3396 1 1 19 LEU HA H 4.185 -1.065 -3.059 1.00 . A A . 19 LEU HA 1 1 7 3397 1 1 19 LEU HB2 H 1.806 0.034 -3.512 1.00 . A A . 19 LEU HB2 1 1 7 3398 1 1 19 LEU HB3 H 1.586 0.047 -1.798 1.00 . A A . 19 LEU HB3 1 1 7 3399 1 1 19 LEU HD11 H 3.479 1.639 -4.656 1.00 . A A . 19 LEU HD11 1 1 7 3400 1 1 19 LEU HD12 H 4.491 2.703 -3.643 1.00 . A A . 19 LEU HD12 1 1 7 3401 1 1 19 LEU HD13 H 4.843 0.974 -3.730 1.00 . A A . 19 LEU HD13 1 1 7 3402 1 1 19 LEU HD21 H 1.363 2.477 -1.566 1.00 . A A . 19 LEU HD21 1 1 7 3403 1 1 19 LEU HD22 H 2.523 3.584 -2.329 1.00 . A A . 19 LEU HD22 1 1 7 3404 1 1 19 LEU HD23 H 1.415 2.631 -3.339 1.00 . A A . 19 LEU HD23 1 1 7 3405 1 1 19 LEU HG H 3.689 1.510 -1.566 1.00 . A A . 19 LEU HG 1 1 7 3406 1 1 19 LEU N N 2.488 -2.315 -2.939 1.00 . A A . 19 LEU N 1 1 7 3407 1 1 19 LEU O O 4.935 -1.012 -0.657 1.00 . A A . 19 LEU O 1 1 7 3408 1 1 20 GLU C C 4.254 -3.284 1.563 1.00 . A A . 20 GLU C 1 1 7 3409 1 1 20 GLU CA C 3.291 -2.066 1.375 1.00 . A A . 20 GLU CA 1 1 7 3410 1 1 20 GLU CB C 1.969 -2.280 2.164 1.00 . A A . 20 GLU CB 1 1 7 3411 1 1 20 GLU CD C -0.027 -1.188 3.396 1.00 . A A . 20 GLU CD 1 1 7 3412 1 1 20 GLU CG C 1.214 -0.978 2.531 1.00 . A A . 20 GLU CG 1 1 7 3413 1 1 20 GLU H H 1.950 -1.737 -0.352 1.00 . A A . 20 GLU H 1 1 7 3414 1 1 20 GLU HA H 3.858 -1.198 1.731 1.00 . A A . 20 GLU HA 1 1 7 3415 1 1 20 GLU HB2 H 1.307 -2.960 1.603 1.00 . A A . 20 GLU HB2 1 1 7 3416 1 1 20 GLU HB3 H 2.151 -2.852 3.092 1.00 . A A . 20 GLU HB3 1 1 7 3417 1 1 20 GLU HE2 H -1.723 -2.034 3.373 1.00 . A A . 20 GLU HE2 1 1 7 3418 1 1 20 GLU HG2 H 1.891 -0.291 3.071 1.00 . A A . 20 GLU HG2 1 1 7 3419 1 1 20 GLU HG3 H 0.908 -0.438 1.618 1.00 . A A . 20 GLU HG3 1 1 7 3420 1 1 20 GLU N N 2.913 -1.752 -0.025 1.00 . A A . 20 GLU N 1 1 7 3421 1 1 20 GLU O O 5.183 -3.156 2.364 1.00 . A A . 20 GLU O 1 1 7 3422 1 1 20 GLU OE1 O -0.161 -0.708 4.517 1.00 . A A . 20 GLU OE1 1 1 7 3423 1 1 20 GLU OE2 O -0.972 -1.954 2.783 1.00 . A A . 20 GLU OE2 1 1 7 3424 1 1 21 ARG C C 6.582 -4.854 0.223 1.00 . A A . 21 ARG C 1 1 7 3425 1 1 21 ARG CA C 5.200 -5.431 0.705 1.00 . A A . 21 ARG CA 1 1 7 3426 1 1 21 ARG CB C 4.709 -6.533 -0.277 1.00 . A A . 21 ARG CB 1 1 7 3427 1 1 21 ARG CD C 2.957 -8.351 -0.782 1.00 . A A . 21 ARG CD 1 1 7 3428 1 1 21 ARG CG C 3.645 -7.499 0.305 1.00 . A A . 21 ARG CG 1 1 7 3429 1 1 21 ARG CZ C 0.727 -9.064 0.141 1.00 . A A . 21 ARG CZ 1 1 7 3430 1 1 21 ARG H H 3.269 -4.491 0.276 1.00 . A A . 21 ARG H 1 1 7 3431 1 1 21 ARG HA H 5.351 -5.861 1.703 1.00 . A A . 21 ARG HA 1 1 7 3432 1 1 21 ARG HB2 H 4.344 -6.064 -1.212 1.00 . A A . 21 ARG HB2 1 1 7 3433 1 1 21 ARG HB3 H 5.571 -7.149 -0.603 1.00 . A A . 21 ARG HB3 1 1 7 3434 1 1 21 ARG HD2 H 2.473 -7.704 -1.543 1.00 . A A . 21 ARG HD2 1 1 7 3435 1 1 21 ARG HD3 H 3.730 -8.907 -1.352 1.00 . A A . 21 ARG HD3 1 1 7 3436 1 1 21 ARG HE H 2.250 -10.313 -0.095 1.00 . A A . 21 ARG HE 1 1 7 3437 1 1 21 ARG HG2 H 4.119 -8.155 1.062 1.00 . A A . 21 ARG HG2 1 1 7 3438 1 1 21 ARG HG3 H 2.883 -6.925 0.866 1.00 . A A . 21 ARG HG3 1 1 7 3439 1 1 21 ARG HH11 H 0.837 -7.113 -0.173 1.00 . A A . 21 ARG HH11 1 1 7 3440 1 1 21 ARG HH12 H -0.771 -7.759 0.414 1.00 . A A . 21 ARG HH12 1 1 7 3441 1 1 21 ARG HH21 H 0.412 -10.977 0.574 1.00 . A A . 21 ARG HH21 1 1 7 3442 1 1 21 ARG HH22 H -0.979 -9.830 0.816 1.00 . A A . 21 ARG HH22 1 1 7 3443 1 1 21 ARG N N 4.122 -4.408 0.830 1.00 . A A . 21 ARG N 1 1 7 3444 1 1 21 ARG NE N 1.987 -9.330 -0.210 1.00 . A A . 21 ARG NE 1 1 7 3445 1 1 21 ARG NH1 N 0.195 -7.867 0.103 1.00 . A A . 21 ARG NH1 1 1 7 3446 1 1 21 ARG NH2 N -0.017 -10.050 0.551 1.00 . A A . 21 ARG NH2 1 1 7 3447 1 1 21 ARG O O 7.612 -5.172 0.823 1.00 . A A . 21 ARG O 1 1 7 3448 1 1 22 LEU C C 8.266 -2.176 -0.090 1.00 . A A . 22 LEU C 1 1 7 3449 1 1 22 LEU CA C 7.785 -3.187 -1.189 1.00 . A A . 22 LEU CA 1 1 7 3450 1 1 22 LEU CB C 7.468 -2.443 -2.520 1.00 . A A . 22 LEU CB 1 1 7 3451 1 1 22 LEU CD1 C 6.768 -2.433 -4.951 1.00 . A A . 22 LEU CD1 1 1 7 3452 1 1 22 LEU CD2 C 8.518 -4.069 -4.223 1.00 . A A . 22 LEU CD2 1 1 7 3453 1 1 22 LEU CG C 7.249 -3.314 -3.789 1.00 . A A . 22 LEU CG 1 1 7 3454 1 1 22 LEU H H 5.697 -3.749 -1.218 1.00 . A A . 22 LEU H 1 1 7 3455 1 1 22 LEU HA H 8.594 -3.902 -1.353 1.00 . A A . 22 LEU HA 1 1 7 3456 1 1 22 LEU HB2 H 6.588 -1.791 -2.369 1.00 . A A . 22 LEU HB2 1 1 7 3457 1 1 22 LEU HB3 H 8.290 -1.734 -2.735 1.00 . A A . 22 LEU HB3 1 1 7 3458 1 1 22 LEU HD11 H 5.814 -1.932 -4.706 1.00 . A A . 22 LEU HD11 1 1 7 3459 1 1 22 LEU HD12 H 7.507 -1.652 -5.211 1.00 . A A . 22 LEU HD12 1 1 7 3460 1 1 22 LEU HD13 H 6.581 -3.026 -5.865 1.00 . A A . 22 LEU HD13 1 1 7 3461 1 1 22 LEU HD21 H 9.364 -3.383 -4.420 1.00 . A A . 22 LEU HD21 1 1 7 3462 1 1 22 LEU HD22 H 8.854 -4.789 -3.456 1.00 . A A . 22 LEU HD22 1 1 7 3463 1 1 22 LEU HD23 H 8.350 -4.653 -5.147 1.00 . A A . 22 LEU HD23 1 1 7 3464 1 1 22 LEU HG H 6.452 -4.057 -3.580 1.00 . A A . 22 LEU HG 1 1 7 3465 1 1 22 LEU N N 6.596 -3.971 -0.796 1.00 . A A . 22 LEU N 1 1 7 3466 1 1 22 LEU O O 9.475 -2.102 0.115 1.00 . A A . 22 LEU O 1 1 7 3467 1 1 23 LYS C C 8.433 -1.404 3.013 1.00 . A A . 23 LYS C 1 1 7 3468 1 1 23 LYS CA C 7.840 -0.593 1.803 1.00 . A A . 23 LYS CA 1 1 7 3469 1 1 23 LYS CB C 6.628 0.263 2.270 1.00 . A A . 23 LYS CB 1 1 7 3470 1 1 23 LYS CD C 4.809 2.015 1.586 1.00 . A A . 23 LYS CD 1 1 7 3471 1 1 23 LYS CE C 4.722 2.795 2.911 1.00 . A A . 23 LYS CE 1 1 7 3472 1 1 23 LYS CG C 6.194 1.393 1.296 1.00 . A A . 23 LYS CG 1 1 7 3473 1 1 23 LYS H H 6.392 -1.638 0.456 1.00 . A A . 23 LYS H 1 1 7 3474 1 1 23 LYS HA H 8.649 0.084 1.461 1.00 . A A . 23 LYS HA 1 1 7 3475 1 1 23 LYS HB2 H 5.778 -0.405 2.500 1.00 . A A . 23 LYS HB2 1 1 7 3476 1 1 23 LYS HB3 H 6.877 0.734 3.241 1.00 . A A . 23 LYS HB3 1 1 7 3477 1 1 23 LYS HD2 H 4.560 2.685 0.738 1.00 . A A . 23 LYS HD2 1 1 7 3478 1 1 23 LYS HD3 H 4.043 1.216 1.545 1.00 . A A . 23 LYS HD3 1 1 7 3479 1 1 23 LYS HE2 H 4.961 2.126 3.767 1.00 . A A . 23 LYS HE2 1 1 7 3480 1 1 23 LYS HE3 H 5.508 3.583 2.939 1.00 . A A . 23 LYS HE3 1 1 7 3481 1 1 23 LYS HG2 H 6.974 2.179 1.260 1.00 . A A . 23 LYS HG2 1 1 7 3482 1 1 23 LYS HG3 H 6.172 0.992 0.263 1.00 . A A . 23 LYS HG3 1 1 7 3483 1 1 23 LYS HZ1 H 2.620 2.680 3.070 1.00 . A A . 23 LYS HZ1 1 1 7 3484 1 1 23 LYS HZ2 H 3.247 3.925 3.937 1.00 . A A . 23 LYS HZ2 1 1 7 3485 1 1 23 LYS HZ3 H 3.130 4.036 2.304 1.00 . A A . 23 LYS HZ3 1 1 7 3486 1 1 23 LYS N N 7.396 -1.451 0.653 1.00 . A A . 23 LYS N 1 1 7 3487 1 1 23 LYS NZ N 3.366 3.389 3.067 1.00 . A A . 23 LYS NZ 1 1 7 3488 1 1 23 LYS O O 9.417 -0.957 3.606 1.00 . A A . 23 LYS O 1 1 7 3489 1 1 24 GLU C C 9.851 -4.145 3.877 1.00 . A A . 24 GLU C 1 1 7 3490 1 1 24 GLU CA C 8.471 -3.533 4.334 1.00 . A A . 24 GLU CA 1 1 7 3491 1 1 24 GLU CB C 7.399 -4.643 4.593 1.00 . A A . 24 GLU CB 1 1 7 3492 1 1 24 GLU CD C 8.392 -5.898 6.705 1.00 . A A . 24 GLU CD 1 1 7 3493 1 1 24 GLU CG C 7.252 -5.106 6.066 1.00 . A A . 24 GLU CG 1 1 7 3494 1 1 24 GLU H H 7.069 -2.866 2.806 1.00 . A A . 24 GLU H 1 1 7 3495 1 1 24 GLU HA H 8.646 -2.951 5.245 1.00 . A A . 24 GLU HA 1 1 7 3496 1 1 24 GLU HB2 H 6.385 -4.289 4.314 1.00 . A A . 24 GLU HB2 1 1 7 3497 1 1 24 GLU HB3 H 7.557 -5.512 3.925 1.00 . A A . 24 GLU HB3 1 1 7 3498 1 1 24 GLU HE2 H 9.002 -6.443 8.428 1.00 . A A . 24 GLU HE2 1 1 7 3499 1 1 24 GLU HG2 H 7.039 -4.227 6.705 1.00 . A A . 24 GLU HG2 1 1 7 3500 1 1 24 GLU HG3 H 6.348 -5.736 6.149 1.00 . A A . 24 GLU HG3 1 1 7 3501 1 1 24 GLU N N 7.880 -2.585 3.359 1.00 . A A . 24 GLU N 1 1 7 3502 1 1 24 GLU O O 10.752 -4.301 4.705 1.00 . A A . 24 GLU O 1 1 7 3503 1 1 24 GLU OE1 O 9.282 -6.473 6.085 1.00 . A A . 24 GLU OE1 1 1 7 3504 1 1 24 GLU OE2 O 8.285 -5.925 8.061 1.00 . A A . 24 GLU OE2 1 1 7 3505 1 1 25 ALA C C 12.341 -3.536 1.882 1.00 . A A . 25 ALA C 1 1 7 3506 1 1 25 ALA CA C 11.345 -4.748 1.965 1.00 . A A . 25 ALA CA 1 1 7 3507 1 1 25 ALA CB C 11.031 -5.308 0.563 1.00 . A A . 25 ALA CB 1 1 7 3508 1 1 25 ALA H H 9.183 -4.457 2.008 1.00 . A A . 25 ALA H 1 1 7 3509 1 1 25 ALA HA H 11.827 -5.522 2.569 1.00 . A A . 25 ALA HA 1 1 7 3510 1 1 25 ALA HB1 H 10.360 -6.189 0.603 1.00 . A A . 25 ALA HB1 1 1 7 3511 1 1 25 ALA HB2 H 10.546 -4.559 -0.091 1.00 . A A . 25 ALA HB2 1 1 7 3512 1 1 25 ALA HB3 H 11.952 -5.637 0.045 1.00 . A A . 25 ALA HB3 1 1 7 3513 1 1 25 ALA N N 10.030 -4.462 2.577 1.00 . A A . 25 ALA N 1 1 7 3514 1 1 25 ALA O O 13.525 -3.725 2.165 1.00 . A A . 25 ALA O 1 1 7 3515 1 1 26 TYR C C 13.167 -0.487 2.807 1.00 . A A . 26 TYR C 1 1 7 3516 1 1 26 TYR CA C 12.781 -1.116 1.423 1.00 . A A . 26 TYR CA 1 1 7 3517 1 1 26 TYR CB C 12.076 -0.040 0.536 1.00 . A A . 26 TYR CB 1 1 7 3518 1 1 26 TYR CD1 C 12.204 -1.414 -1.675 1.00 . A A . 26 TYR CD1 1 1 7 3519 1 1 26 TYR CD2 C 10.831 0.569 -1.575 1.00 . A A . 26 TYR CD2 1 1 7 3520 1 1 26 TYR CE1 C 11.790 -1.632 -2.987 1.00 . A A . 26 TYR CE1 1 1 7 3521 1 1 26 TYR CE2 C 10.425 0.353 -2.892 1.00 . A A . 26 TYR CE2 1 1 7 3522 1 1 26 TYR CG C 11.718 -0.317 -0.948 1.00 . A A . 26 TYR CG 1 1 7 3523 1 1 26 TYR CZ C 10.903 -0.750 -3.593 1.00 . A A . 26 TYR CZ 1 1 7 3524 1 1 26 TYR H H 11.003 -2.307 1.015 1.00 . A A . 26 TYR H 1 1 7 3525 1 1 26 TYR HA H 13.723 -1.434 0.959 1.00 . A A . 26 TYR HA 1 1 7 3526 1 1 26 TYR HB2 H 11.156 0.281 1.064 1.00 . A A . 26 TYR HB2 1 1 7 3527 1 1 26 TYR HB3 H 12.716 0.864 0.532 1.00 . A A . 26 TYR HB3 1 1 7 3528 1 1 26 TYR HD1 H 12.885 -2.118 -1.222 1.00 . A A . 26 TYR HD1 1 1 7 3529 1 1 26 TYR HD2 H 10.442 1.424 -1.040 1.00 . A A . 26 TYR HD2 1 1 7 3530 1 1 26 TYR HE1 H 12.151 -2.490 -3.535 1.00 . A A . 26 TYR HE1 1 1 7 3531 1 1 26 TYR HE2 H 9.734 1.038 -3.362 1.00 . A A . 26 TYR HE2 1 1 7 3532 1 1 26 TYR HH H 9.886 -0.293 -5.180 1.00 . A A . 26 TYR HH 1 1 7 3533 1 1 26 TYR N N 11.904 -2.314 1.508 1.00 . A A . 26 TYR N 1 1 7 3534 1 1 26 TYR O O 14.276 0.046 2.922 1.00 . A A . 26 TYR O 1 1 7 3535 1 1 26 TYR OH O 10.493 -0.991 -4.878 1.00 . A A . 26 TYR OH 1 1 7 3536 1 1 27 ARG C C 13.689 -1.428 5.864 1.00 . A A . 27 ARG C 1 1 7 3537 1 1 27 ARG CA C 12.755 -0.296 5.275 1.00 . A A . 27 ARG CA 1 1 7 3538 1 1 27 ARG CB C 11.421 -0.103 6.062 1.00 . A A . 27 ARG CB 1 1 7 3539 1 1 27 ARG CD C 11.514 2.024 7.624 1.00 . A A . 27 ARG CD 1 1 7 3540 1 1 27 ARG CG C 11.537 0.480 7.496 1.00 . A A . 27 ARG CG 1 1 7 3541 1 1 27 ARG CZ C 13.891 2.829 7.407 1.00 . A A . 27 ARG CZ 1 1 7 3542 1 1 27 ARG H H 11.412 -0.990 3.647 1.00 . A A . 27 ARG H 1 1 7 3543 1 1 27 ARG HA H 13.337 0.644 5.304 1.00 . A A . 27 ARG HA 1 1 7 3544 1 1 27 ARG HB2 H 10.711 0.529 5.490 1.00 . A A . 27 ARG HB2 1 1 7 3545 1 1 27 ARG HB3 H 10.913 -1.086 6.128 1.00 . A A . 27 ARG HB3 1 1 7 3546 1 1 27 ARG HD2 H 10.559 2.398 7.202 1.00 . A A . 27 ARG HD2 1 1 7 3547 1 1 27 ARG HD3 H 11.451 2.316 8.693 1.00 . A A . 27 ARG HD3 1 1 7 3548 1 1 27 ARG HE H 12.496 3.205 6.053 1.00 . A A . 27 ARG HE 1 1 7 3549 1 1 27 ARG HG2 H 10.677 0.095 8.080 1.00 . A A . 27 ARG HG2 1 1 7 3550 1 1 27 ARG HG3 H 12.414 0.052 8.016 1.00 . A A . 27 ARG HG3 1 1 7 3551 1 1 27 ARG HH11 H 13.552 1.806 9.041 1.00 . A A . 27 ARG HH11 1 1 7 3552 1 1 27 ARG HH12 H 15.251 2.483 8.867 1.00 . A A . 27 ARG HH12 1 1 7 3553 1 1 27 ARG HH21 H 14.434 3.862 5.801 1.00 . A A . 27 ARG HH21 1 1 7 3554 1 1 27 ARG HH22 H 15.745 3.368 6.961 1.00 . A A . 27 ARG HH22 1 1 7 3555 1 1 27 ARG N N 12.333 -0.580 3.869 1.00 . A A . 27 ARG N 1 1 7 3556 1 1 27 ARG NE N 12.642 2.733 6.949 1.00 . A A . 27 ARG NE 1 1 7 3557 1 1 27 ARG NH1 N 14.289 2.298 8.534 1.00 . A A . 27 ARG NH1 1 1 7 3558 1 1 27 ARG NH2 N 14.757 3.480 6.690 1.00 . A A . 27 ARG NH2 1 1 7 3559 1 1 27 ARG O O 13.377 -2.095 6.855 1.00 . A A . 27 ARG O 1 1 7 3560 1 1 28 ARG C C 17.238 -2.295 4.961 1.00 . A A . 28 ARG C 1 1 7 3561 1 1 28 ARG CA C 15.825 -2.707 5.500 1.00 . A A . 28 ARG CA 1 1 7 3562 1 1 28 ARG CB C 15.422 -4.077 4.865 1.00 . A A . 28 ARG CB 1 1 7 3563 1 1 28 ARG CD C 13.949 -6.164 4.748 1.00 . A A . 28 ARG CD 1 1 7 3564 1 1 28 ARG CG C 14.097 -4.741 5.317 1.00 . A A . 28 ARG CG 1 1 7 3565 1 1 28 ARG CZ C 12.211 -7.965 4.747 1.00 . A A . 28 ARG CZ 1 1 7 3566 1 1 28 ARG H H 15.025 -0.964 4.468 1.00 . A A . 28 ARG H 1 1 7 3567 1 1 28 ARG HA H 15.896 -2.783 6.589 1.00 . A A . 28 ARG HA 1 1 7 3568 1 1 28 ARG HB2 H 15.402 -3.977 3.762 1.00 . A A . 28 ARG HB2 1 1 7 3569 1 1 28 ARG HB3 H 16.242 -4.793 5.064 1.00 . A A . 28 ARG HB3 1 1 7 3570 1 1 28 ARG HD2 H 14.141 -6.142 3.655 1.00 . A A . 28 ARG HD2 1 1 7 3571 1 1 28 ARG HD3 H 14.737 -6.808 5.191 1.00 . A A . 28 ARG HD3 1 1 7 3572 1 1 28 ARG HE H 11.818 -6.080 5.277 1.00 . A A . 28 ARG HE 1 1 7 3573 1 1 28 ARG HG2 H 14.028 -4.756 6.422 1.00 . A A . 28 ARG HG2 1 1 7 3574 1 1 28 ARG HG3 H 13.255 -4.107 4.978 1.00 . A A . 28 ARG HG3 1 1 7 3575 1 1 28 ARG HH11 H 13.989 -8.579 4.186 1.00 . A A . 28 ARG HH11 1 1 7 3576 1 1 28 ARG HH12 H 12.655 -9.831 4.145 1.00 . A A . 28 ARG HH12 1 1 7 3577 1 1 28 ARG HH21 H 10.349 -7.548 5.309 1.00 . A A . 28 ARG HH21 1 1 7 3578 1 1 28 ARG HH22 H 10.696 -9.253 4.734 1.00 . A A . 28 ARG HH22 1 1 7 3579 1 1 28 ARG N N 14.853 -1.628 5.220 1.00 . A A . 28 ARG N 1 1 7 3580 1 1 28 ARG NE N 12.588 -6.712 5.008 1.00 . A A . 28 ARG NE 1 1 7 3581 1 1 28 ARG NH1 N 13.027 -8.895 4.314 1.00 . A A . 28 ARG NH1 1 1 7 3582 1 1 28 ARG NH2 N 10.968 -8.290 4.931 1.00 . A A . 28 ARG NH2 1 1 7 3583 1 1 28 ARG O O 18.190 -2.324 5.743 1.00 . A A . 28 ARG O 1 1 7 3584 1 1 29 TYR C C 19.441 -0.326 3.692 1.00 . A A . 29 TYR C 1 1 7 3585 1 1 29 TYR CA C 18.754 -1.606 3.085 1.00 . A A . 29 TYR CA 1 1 7 3586 1 1 29 TYR CB C 18.625 -1.515 1.531 1.00 . A A . 29 TYR CB 1 1 7 3587 1 1 29 TYR CD1 C 18.029 0.864 0.771 1.00 . A A . 29 TYR CD1 1 1 7 3588 1 1 29 TYR CD2 C 16.509 -0.932 0.229 1.00 . A A . 29 TYR CD2 1 1 7 3589 1 1 29 TYR CE1 C 17.197 1.767 0.111 1.00 . A A . 29 TYR CE1 1 1 7 3590 1 1 29 TYR CE2 C 15.694 -0.030 -0.454 1.00 . A A . 29 TYR CE2 1 1 7 3591 1 1 29 TYR CG C 17.681 -0.491 0.854 1.00 . A A . 29 TYR CG 1 1 7 3592 1 1 29 TYR CZ C 16.029 1.317 -0.499 1.00 . A A . 29 TYR CZ 1 1 7 3593 1 1 29 TYR H H 16.552 -1.946 3.082 1.00 . A A . 29 TYR H 1 1 7 3594 1 1 29 TYR HA H 19.451 -2.435 3.320 1.00 . A A . 29 TYR HA 1 1 7 3595 1 1 29 TYR HB2 H 19.639 -1.355 1.118 1.00 . A A . 29 TYR HB2 1 1 7 3596 1 1 29 TYR HB3 H 18.382 -2.531 1.162 1.00 . A A . 29 TYR HB3 1 1 7 3597 1 1 29 TYR HD1 H 18.946 1.222 1.216 1.00 . A A . 29 TYR HD1 1 1 7 3598 1 1 29 TYR HD2 H 16.232 -1.976 0.250 1.00 . A A . 29 TYR HD2 1 1 7 3599 1 1 29 TYR HE1 H 17.471 2.811 0.067 1.00 . A A . 29 TYR HE1 1 1 7 3600 1 1 29 TYR HE2 H 14.802 -0.372 -0.954 1.00 . A A . 29 TYR HE2 1 1 7 3601 1 1 29 TYR HH H 15.585 3.070 -1.118 1.00 . A A . 29 TYR HH 1 1 7 3602 1 1 29 TYR N N 17.406 -1.940 3.657 1.00 . A A . 29 TYR N 1 1 7 3603 1 1 29 TYR O O 20.662 -0.342 3.866 1.00 . A A . 29 TYR O 1 1 7 3604 1 1 29 TYR OH O 15.204 2.191 -1.156 1.00 . A A . 29 TYR OH 1 1 7 3605 1 1 30 THR C C 18.373 1.631 6.336 1.00 . A A . 30 THR C 1 1 7 3606 1 1 30 THR CA C 19.190 1.775 5.003 1.00 . A A . 30 THR CA 1 1 7 3607 1 1 30 THR CB C 19.128 3.197 4.361 1.00 . A A . 30 THR CB 1 1 7 3608 1 1 30 THR CG2 C 17.772 3.687 3.811 1.00 . A A . 30 THR CG2 1 1 7 3609 1 1 30 THR H H 17.697 0.605 3.874 1.00 . A A . 30 THR H 1 1 7 3610 1 1 30 THR HA H 20.261 1.630 5.241 1.00 . A A . 30 THR HA 1 1 7 3611 1 1 30 THR HB H 19.885 3.190 3.557 1.00 . A A . 30 THR HB 1 1 7 3612 1 1 30 THR HG1 H 18.717 4.417 5.825 1.00 . A A . 30 THR HG1 1 1 7 3613 1 1 30 THR HG21 H 17.379 3.015 3.026 1.00 . A A . 30 THR HG21 1 1 7 3614 1 1 30 THR HG22 H 16.996 3.766 4.592 1.00 . A A . 30 THR HG22 1 1 7 3615 1 1 30 THR HG23 H 17.868 4.688 3.351 1.00 . A A . 30 THR HG23 1 1 7 3616 1 1 30 THR N N 18.698 0.736 4.056 1.00 . A A . 30 THR N 1 1 7 3617 1 1 30 THR O O 17.224 2.086 6.395 1.00 . A A . 30 THR O 1 1 7 3618 1 1 30 THR OG1 O 19.519 4.165 5.332 1.00 . A A . 30 THR OG1 1 1 7 3619 1 1 31 PRO C C 17.877 2.563 9.299 1.00 . A A . 31 PRO C 1 1 7 3620 1 1 31 PRO CA C 18.281 1.133 8.802 1.00 . A A . 31 PRO CA 1 1 7 3621 1 1 31 PRO CB C 19.338 0.448 9.696 1.00 . A A . 31 PRO CB 1 1 7 3622 1 1 31 PRO CD C 20.169 0.276 7.438 1.00 . A A . 31 PRO CD 1 1 7 3623 1 1 31 PRO CG C 20.103 -0.489 8.759 1.00 . A A . 31 PRO CG 1 1 7 3624 1 1 31 PRO HA H 17.354 0.531 8.787 1.00 . A A . 31 PRO HA 1 1 7 3625 1 1 31 PRO HB2 H 20.041 1.185 10.136 1.00 . A A . 31 PRO HB2 1 1 7 3626 1 1 31 PRO HB3 H 18.879 -0.091 10.547 1.00 . A A . 31 PRO HB3 1 1 7 3627 1 1 31 PRO HD2 H 21.048 0.950 7.393 1.00 . A A . 31 PRO HD2 1 1 7 3628 1 1 31 PRO HD3 H 20.230 -0.414 6.571 1.00 . A A . 31 PRO HD3 1 1 7 3629 1 1 31 PRO HG2 H 21.105 -0.759 9.144 1.00 . A A . 31 PRO HG2 1 1 7 3630 1 1 31 PRO HG3 H 19.545 -1.436 8.620 1.00 . A A . 31 PRO HG3 1 1 7 3631 1 1 31 PRO N N 18.921 1.063 7.453 1.00 . A A . 31 PRO N 1 1 7 3632 1 1 31 PRO O O 16.751 2.754 9.765 1.00 . A A . 31 PRO O 1 1 7 3633 1 1 32 TYR C C 17.691 5.623 8.094 1.00 . A A . 32 TYR C 1 1 7 3634 1 1 32 TYR CA C 18.414 5.000 9.328 1.00 . A A . 32 TYR CA 1 1 7 3635 1 1 32 TYR CB C 19.733 5.771 9.631 1.00 . A A . 32 TYR CB 1 1 7 3636 1 1 32 TYR CD1 C 19.932 5.799 12.177 1.00 . A A . 32 TYR CD1 1 1 7 3637 1 1 32 TYR CD2 C 21.627 4.632 10.911 1.00 . A A . 32 TYR CD2 1 1 7 3638 1 1 32 TYR CE1 C 20.571 5.439 13.361 1.00 . A A . 32 TYR CE1 1 1 7 3639 1 1 32 TYR CE2 C 22.265 4.274 12.097 1.00 . A A . 32 TYR CE2 1 1 7 3640 1 1 32 TYR CG C 20.453 5.395 10.942 1.00 . A A . 32 TYR CG 1 1 7 3641 1 1 32 TYR CZ C 21.736 4.677 13.320 1.00 . A A . 32 TYR CZ 1 1 7 3642 1 1 32 TYR H H 19.573 3.265 8.577 1.00 . A A . 32 TYR H 1 1 7 3643 1 1 32 TYR HA H 17.733 5.104 10.196 1.00 . A A . 32 TYR HA 1 1 7 3644 1 1 32 TYR HB2 H 20.426 5.681 8.770 1.00 . A A . 32 TYR HB2 1 1 7 3645 1 1 32 TYR HB3 H 19.516 6.857 9.672 1.00 . A A . 32 TYR HB3 1 1 7 3646 1 1 32 TYR HD1 H 19.023 6.382 12.222 1.00 . A A . 32 TYR HD1 1 1 7 3647 1 1 32 TYR HD2 H 22.042 4.307 9.967 1.00 . A A . 32 TYR HD2 1 1 7 3648 1 1 32 TYR HE1 H 20.164 5.745 14.314 1.00 . A A . 32 TYR HE1 1 1 7 3649 1 1 32 TYR HE2 H 23.170 3.685 12.060 1.00 . A A . 32 TYR HE2 1 1 7 3650 1 1 32 TYR HH H 23.120 3.783 14.288 1.00 . A A . 32 TYR HH 1 1 7 3651 1 1 32 TYR N N 18.748 3.566 9.105 1.00 . A A . 32 TYR N 1 1 7 3652 1 1 32 TYR O O 17.704 5.163 6.949 1.00 . A A . 32 TYR O 1 1 7 3653 1 1 32 TYR OXT O 17.016 6.764 8.420 1.00 . A A . 32 TYR OXT 1 1 7 3654 1 1 32 TYR OH O 22.352 4.322 14.490 1.00 . A A . 32 TYR OH 1 1 8 3655 1 1 1 CYS C C 6.767 17.876 -6.504 1.00 . A A . 1 CYS C 1 1 8 3656 1 1 1 CYS CA C 8.179 17.839 -5.834 1.00 . A A . 1 CYS CA 1 1 8 3657 1 1 1 CYS CB C 8.713 19.172 -5.255 1.00 . A A . 1 CYS CB 1 1 8 3658 1 1 1 CYS H1 H 10.096 17.315 -6.390 1.00 . A A . 1 CYS H1 1 1 8 3659 1 1 1 CYS H2 H 9.293 18.114 -7.551 1.00 . A A . 1 CYS H2 1 1 8 3660 1 1 1 CYS HA H 8.136 17.109 -5.003 1.00 . A A . 1 CYS HA 1 1 8 3661 1 1 1 CYS HB2 H 9.700 19.031 -4.773 1.00 . A A . 1 CYS HB2 1 1 8 3662 1 1 1 CYS HB3 H 8.865 19.936 -6.042 1.00 . A A . 1 CYS HB3 1 1 8 3663 1 1 1 CYS HG H 7.750 18.898 -3.086 1.00 . A A . 1 CYS HG 1 1 8 3664 1 1 1 CYS N N 9.174 17.385 -6.837 1.00 . A A . 1 CYS N 1 1 8 3665 1 1 1 CYS O O 6.116 16.829 -6.556 1.00 . A A . 1 CYS O 1 1 8 3666 1 1 1 CYS SG S 7.558 19.838 -4.008 1.00 . A A . 1 CYS SG 1 1 8 3667 1 1 2 ALA C C 5.173 18.849 -9.311 1.00 . A A . 2 ALA C 1 1 8 3668 1 1 2 ALA CA C 4.994 19.080 -7.773 1.00 . A A . 2 ALA CA 1 1 8 3669 1 1 2 ALA CB C 4.401 20.458 -7.418 1.00 . A A . 2 ALA CB 1 1 8 3670 1 1 2 ALA H H 6.892 19.833 -6.923 1.00 . A A . 2 ALA H 1 1 8 3671 1 1 2 ALA HA H 4.282 18.313 -7.402 1.00 . A A . 2 ALA HA 1 1 8 3672 1 1 2 ALA HB1 H 4.255 20.581 -6.328 1.00 . A A . 2 ALA HB1 1 1 8 3673 1 1 2 ALA HB2 H 5.038 21.294 -7.766 1.00 . A A . 2 ALA HB2 1 1 8 3674 1 1 2 ALA HB3 H 3.410 20.599 -7.888 1.00 . A A . 2 ALA HB3 1 1 8 3675 1 1 2 ALA N N 6.294 19.011 -7.053 1.00 . A A . 2 ALA N 1 1 8 3676 1 1 2 ALA O O 5.133 19.784 -10.117 1.00 . A A . 2 ALA O 1 1 8 3677 1 1 3 LYS C C 5.261 15.630 -11.242 1.00 . A A . 3 LYS C 1 1 8 3678 1 1 3 LYS CA C 5.444 17.184 -11.148 1.00 . A A . 3 LYS CA 1 1 8 3679 1 1 3 LYS CB C 6.789 17.652 -11.792 1.00 . A A . 3 LYS CB 1 1 8 3680 1 1 3 LYS CD C 8.081 18.184 -14.003 1.00 . A A . 3 LYS CD 1 1 8 3681 1 1 3 LYS CE C 9.435 17.487 -13.743 1.00 . A A . 3 LYS CE 1 1 8 3682 1 1 3 LYS CG C 6.820 17.573 -13.340 1.00 . A A . 3 LYS CG 1 1 8 3683 1 1 3 LYS H H 5.185 16.888 -8.995 1.00 . A A . 3 LYS H 1 1 8 3684 1 1 3 LYS HA H 4.597 17.678 -11.652 1.00 . A A . 3 LYS HA 1 1 8 3685 1 1 3 LYS HB2 H 6.983 18.704 -11.503 1.00 . A A . 3 LYS HB2 1 1 8 3686 1 1 3 LYS HB3 H 7.629 17.083 -11.349 1.00 . A A . 3 LYS HB3 1 1 8 3687 1 1 3 LYS HD2 H 7.909 18.260 -15.096 1.00 . A A . 3 LYS HD2 1 1 8 3688 1 1 3 LYS HD3 H 8.161 19.242 -13.681 1.00 . A A . 3 LYS HD3 1 1 8 3689 1 1 3 LYS HE2 H 10.254 18.118 -14.154 1.00 . A A . 3 LYS HE2 1 1 8 3690 1 1 3 LYS HE3 H 9.639 17.453 -12.650 1.00 . A A . 3 LYS HE3 1 1 8 3691 1 1 3 LYS HG2 H 6.675 16.530 -13.676 1.00 . A A . 3 LYS HG2 1 1 8 3692 1 1 3 LYS HG3 H 5.937 18.112 -13.736 1.00 . A A . 3 LYS HG3 1 1 8 3693 1 1 3 LYS HZ1 H 9.304 16.130 -15.354 1.00 . A A . 3 LYS HZ1 1 1 8 3694 1 1 3 LYS HZ2 H 10.377 15.639 -14.207 1.00 . A A . 3 LYS HZ2 1 1 8 3695 1 1 3 LYS HZ3 H 8.761 15.505 -13.940 1.00 . A A . 3 LYS HZ3 1 1 8 3696 1 1 3 LYS N N 5.380 17.579 -9.719 1.00 . A A . 3 LYS N 1 1 8 3697 1 1 3 LYS NZ N 9.479 16.122 -14.340 1.00 . A A . 3 LYS NZ 1 1 8 3698 1 1 3 LYS O O 6.191 14.871 -10.950 1.00 . A A . 3 LYS O 1 1 8 3699 1 1 4 VAL C C 4.161 12.642 -11.068 1.00 . A A . 4 VAL C 1 1 8 3700 1 1 4 VAL CA C 3.670 13.791 -12.042 1.00 . A A . 4 VAL CA 1 1 8 3701 1 1 4 VAL CB C 4.068 13.585 -13.559 1.00 . A A . 4 VAL CB 1 1 8 3702 1 1 4 VAL CG1 C 5.566 13.428 -13.921 1.00 . A A . 4 VAL CG1 1 1 8 3703 1 1 4 VAL CG2 C 3.296 12.405 -14.195 1.00 . A A . 4 VAL CG2 1 1 8 3704 1 1 4 VAL H H 3.395 15.968 -11.842 1.00 . A A . 4 VAL H 1 1 8 3705 1 1 4 VAL HA H 2.566 13.730 -11.978 1.00 . A A . 4 VAL HA 1 1 8 3706 1 1 4 VAL HB H 3.714 14.481 -14.109 1.00 . A A . 4 VAL HB 1 1 8 3707 1 1 4 VAL HG11 H 6.181 14.247 -13.516 1.00 . A A . 4 VAL HG11 1 1 8 3708 1 1 4 VAL HG12 H 5.997 12.485 -13.535 1.00 . A A . 4 VAL HG12 1 1 8 3709 1 1 4 VAL HG13 H 5.722 13.424 -15.016 1.00 . A A . 4 VAL HG13 1 1 8 3710 1 1 4 VAL HG21 H 2.202 12.511 -14.076 1.00 . A A . 4 VAL HG21 1 1 8 3711 1 1 4 VAL HG22 H 3.486 12.324 -15.282 1.00 . A A . 4 VAL HG22 1 1 8 3712 1 1 4 VAL HG23 H 3.580 11.434 -13.746 1.00 . A A . 4 VAL HG23 1 1 8 3713 1 1 4 VAL N N 4.054 15.201 -11.668 1.00 . A A . 4 VAL N 1 1 8 3714 1 1 4 VAL O O 4.971 11.777 -11.409 1.00 . A A . 4 VAL O 1 1 8 3715 1 1 5 LYS C C 2.328 11.539 -8.030 1.00 . A A . 5 LYS C 1 1 8 3716 1 1 5 LYS CA C 3.491 11.319 -9.053 1.00 . A A . 5 LYS CA 1 1 8 3717 1 1 5 LYS CB C 4.851 10.920 -8.381 1.00 . A A . 5 LYS CB 1 1 8 3718 1 1 5 LYS CD C 6.483 12.919 -8.243 1.00 . A A . 5 LYS CD 1 1 8 3719 1 1 5 LYS CE C 7.283 13.867 -7.340 1.00 . A A . 5 LYS CE 1 1 8 3720 1 1 5 LYS CG C 5.628 11.904 -7.463 1.00 . A A . 5 LYS CG 1 1 8 3721 1 1 5 LYS H H 2.888 13.327 -9.668 1.00 . A A . 5 LYS H 1 1 8 3722 1 1 5 LYS HA H 3.195 10.476 -9.711 1.00 . A A . 5 LYS HA 1 1 8 3723 1 1 5 LYS HB2 H 4.655 10.007 -7.787 1.00 . A A . 5 LYS HB2 1 1 8 3724 1 1 5 LYS HB3 H 5.533 10.558 -9.175 1.00 . A A . 5 LYS HB3 1 1 8 3725 1 1 5 LYS HD2 H 7.155 12.377 -8.940 1.00 . A A . 5 LYS HD2 1 1 8 3726 1 1 5 LYS HD3 H 5.814 13.514 -8.890 1.00 . A A . 5 LYS HD3 1 1 8 3727 1 1 5 LYS HE2 H 6.594 14.401 -6.649 1.00 . A A . 5 LYS HE2 1 1 8 3728 1 1 5 LYS HE3 H 7.980 13.302 -6.683 1.00 . A A . 5 LYS HE3 1 1 8 3729 1 1 5 LYS HG2 H 4.931 12.423 -6.776 1.00 . A A . 5 LYS HG2 1 1 8 3730 1 1 5 LYS HG3 H 6.289 11.312 -6.800 1.00 . A A . 5 LYS HG3 1 1 8 3731 1 1 5 LYS HZ1 H 7.409 15.185 -8.973 1.00 . A A . 5 LYS HZ1 1 1 8 3732 1 1 5 LYS HZ2 H 8.373 15.659 -7.718 1.00 . A A . 5 LYS HZ2 1 1 8 3733 1 1 5 LYS HZ3 H 8.814 14.401 -8.699 1.00 . A A . 5 LYS HZ3 1 1 8 3734 1 1 5 LYS N N 3.564 12.577 -9.862 1.00 . A A . 5 LYS N 1 1 8 3735 1 1 5 LYS NZ N 8.011 14.825 -8.218 1.00 . A A . 5 LYS NZ 1 1 8 3736 1 1 5 LYS O O 2.539 11.803 -6.842 1.00 . A A . 5 LYS O 1 1 8 3737 1 1 6 GLY C C -1.413 11.954 -8.482 1.00 . A A . 6 GLY C 1 1 8 3738 1 1 6 GLY CA C -0.045 12.157 -7.813 1.00 . A A . 6 GLY CA 1 1 8 3739 1 1 6 GLY H H 1.021 11.275 -9.526 1.00 . A A . 6 GLY H 1 1 8 3740 1 1 6 GLY HA2 H -0.066 11.826 -6.757 1.00 . A A . 6 GLY HA2 1 1 8 3741 1 1 6 GLY HA3 H 0.149 13.247 -7.770 1.00 . A A . 6 GLY HA3 1 1 8 3742 1 1 6 GLY N N 1.079 11.515 -8.530 1.00 . A A . 6 GLY N 1 1 8 3743 1 1 6 GLY O O -1.804 12.747 -9.341 1.00 . A A . 6 GLY O 1 1 8 3744 1 1 7 ILE C C -4.527 11.678 -7.812 1.00 . A A . 7 ILE C 1 1 8 3745 1 1 7 ILE CA C -3.554 10.678 -8.545 1.00 . A A . 7 ILE CA 1 1 8 3746 1 1 7 ILE CB C -3.959 9.172 -8.307 1.00 . A A . 7 ILE CB 1 1 8 3747 1 1 7 ILE CD1 C -2.667 8.226 -10.441 1.00 . A A . 7 ILE CD1 1 1 8 3748 1 1 7 ILE CG1 C -2.976 8.126 -8.932 1.00 . A A . 7 ILE CG1 1 1 8 3749 1 1 7 ILE CG2 C -5.369 8.877 -8.887 1.00 . A A . 7 ILE CG2 1 1 8 3750 1 1 7 ILE H H -1.648 10.258 -7.458 1.00 . A A . 7 ILE H 1 1 8 3751 1 1 7 ILE HA H -3.592 10.876 -9.636 1.00 . A A . 7 ILE HA 1 1 8 3752 1 1 7 ILE HB H -3.988 8.978 -7.217 1.00 . A A . 7 ILE HB 1 1 8 3753 1 1 7 ILE HD11 H -2.208 9.197 -10.706 1.00 . A A . 7 ILE HD11 1 1 8 3754 1 1 7 ILE HD12 H -1.954 7.441 -10.754 1.00 . A A . 7 ILE HD12 1 1 8 3755 1 1 7 ILE HD13 H -3.572 8.103 -11.063 1.00 . A A . 7 ILE HD13 1 1 8 3756 1 1 7 ILE HG12 H -2.013 8.173 -8.390 1.00 . A A . 7 ILE HG12 1 1 8 3757 1 1 7 ILE HG13 H -3.344 7.104 -8.711 1.00 . A A . 7 ILE HG13 1 1 8 3758 1 1 7 ILE HG21 H -5.437 9.089 -9.970 1.00 . A A . 7 ILE HG21 1 1 8 3759 1 1 7 ILE HG22 H -5.653 7.818 -8.749 1.00 . A A . 7 ILE HG22 1 1 8 3760 1 1 7 ILE HG23 H -6.157 9.474 -8.393 1.00 . A A . 7 ILE HG23 1 1 8 3761 1 1 7 ILE N N -2.160 10.925 -8.055 1.00 . A A . 7 ILE N 1 1 8 3762 1 1 7 ILE O O -4.503 11.816 -6.584 1.00 . A A . 7 ILE O 1 1 8 3763 1 1 8 THR C C -7.257 13.269 -7.116 1.00 . A A . 8 THR C 1 1 8 3764 1 1 8 THR CA C -6.083 13.612 -8.104 1.00 . A A . 8 THR CA 1 1 8 3765 1 1 8 THR CB C -6.601 14.384 -9.364 1.00 . A A . 8 THR CB 1 1 8 3766 1 1 8 THR CG2 C -7.227 15.753 -9.046 1.00 . A A . 8 THR CG2 1 1 8 3767 1 1 8 THR H H -5.205 12.276 -9.590 1.00 . A A . 8 THR H 1 1 8 3768 1 1 8 THR HA H -5.359 14.273 -7.584 1.00 . A A . 8 THR HA 1 1 8 3769 1 1 8 THR HB H -7.349 13.748 -9.882 1.00 . A A . 8 THR HB 1 1 8 3770 1 1 8 THR HG1 H -5.810 15.432 -10.769 1.00 . A A . 8 THR HG1 1 1 8 3771 1 1 8 THR HG21 H -8.095 15.660 -8.367 1.00 . A A . 8 THR HG21 1 1 8 3772 1 1 8 THR HG22 H -6.505 16.437 -8.561 1.00 . A A . 8 THR HG22 1 1 8 3773 1 1 8 THR HG23 H -7.599 16.257 -9.957 1.00 . A A . 8 THR HG23 1 1 8 3774 1 1 8 THR N N -5.369 12.390 -8.585 1.00 . A A . 8 THR N 1 1 8 3775 1 1 8 THR O O -8.321 12.793 -7.519 1.00 . A A . 8 THR O 1 1 8 3776 1 1 8 THR OG1 O -5.528 14.670 -10.256 1.00 . A A . 8 THR OG1 1 1 8 3777 1 1 9 GLN C C -8.842 12.118 -4.608 1.00 . A A . 9 GLN C 1 1 8 3778 1 1 9 GLN CA C -8.062 13.477 -4.719 1.00 . A A . 9 GLN CA 1 1 8 3779 1 1 9 GLN CB C -8.987 14.727 -4.875 1.00 . A A . 9 GLN CB 1 1 8 3780 1 1 9 GLN CD C -10.762 16.273 -3.813 1.00 . A A . 9 GLN CD 1 1 8 3781 1 1 9 GLN CG C -9.852 15.056 -3.630 1.00 . A A . 9 GLN CG 1 1 8 3782 1 1 9 GLN H H -6.068 13.819 -5.624 1.00 . A A . 9 GLN H 1 1 8 3783 1 1 9 GLN HA H -7.548 13.515 -3.739 1.00 . A A . 9 GLN HA 1 1 8 3784 1 1 9 GLN HB2 H -8.378 15.626 -5.104 1.00 . A A . 9 GLN HB2 1 1 8 3785 1 1 9 GLN HB3 H -9.635 14.589 -5.764 1.00 . A A . 9 GLN HB3 1 1 8 3786 1 1 9 GLN HE21 H -12.237 15.125 -4.514 1.00 . A A . 9 GLN HE21 1 1 8 3787 1 1 9 GLN HE22 H -12.521 16.944 -4.378 1.00 . A A . 9 GLN HE22 1 1 8 3788 1 1 9 GLN HG2 H -10.456 14.180 -3.326 1.00 . A A . 9 GLN HG2 1 1 8 3789 1 1 9 GLN HG3 H -9.196 15.260 -2.763 1.00 . A A . 9 GLN HG3 1 1 8 3790 1 1 9 GLN N N -7.044 13.572 -5.818 1.00 . A A . 9 GLN N 1 1 8 3791 1 1 9 GLN NE2 N -11.982 16.083 -4.258 1.00 . A A . 9 GLN NE2 1 1 8 3792 1 1 9 GLN O O -10.064 12.048 -4.733 1.00 . A A . 9 GLN O 1 1 8 3793 1 1 9 GLN OE1 O -10.388 17.411 -3.554 1.00 . A A . 9 GLN OE1 1 1 8 3794 1 1 10 GLY C C -6.418 9.244 -4.059 1.00 . A A . 10 GLY C 1 1 8 3795 1 1 10 GLY CA C -6.814 10.722 -4.291 1.00 . A A . 10 GLY CA 1 1 8 3796 1 1 10 GLY H H -8.692 10.907 -3.178 1.00 . A A . 10 GLY H 1 1 8 3797 1 1 10 GLY HA2 H -6.504 10.965 -5.323 1.00 . A A . 10 GLY HA2 1 1 8 3798 1 1 10 GLY HA3 H -6.188 11.363 -3.641 1.00 . A A . 10 GLY HA3 1 1 8 3799 1 1 10 GLY N N -8.253 11.039 -4.089 1.00 . A A . 10 GLY N 1 1 8 3800 1 1 10 GLY O O -5.642 9.010 -3.127 1.00 . A A . 10 GLY O 1 1 8 3801 1 1 11 PRO C C -4.920 6.555 -5.311 1.00 . A A . 11 PRO C 1 1 8 3802 1 1 11 PRO CA C -6.355 6.827 -4.731 1.00 . A A . 11 PRO CA 1 1 8 3803 1 1 11 PRO CB C -7.499 6.061 -5.432 1.00 . A A . 11 PRO CB 1 1 8 3804 1 1 11 PRO CD C -7.895 8.392 -5.898 1.00 . A A . 11 PRO CD 1 1 8 3805 1 1 11 PRO CG C -8.000 7.004 -6.529 1.00 . A A . 11 PRO CG 1 1 8 3806 1 1 11 PRO HA H -6.329 6.528 -3.664 1.00 . A A . 11 PRO HA 1 1 8 3807 1 1 11 PRO HB2 H -7.190 5.077 -5.832 1.00 . A A . 11 PRO HB2 1 1 8 3808 1 1 11 PRO HB3 H -8.315 5.858 -4.712 1.00 . A A . 11 PRO HB3 1 1 8 3809 1 1 11 PRO HD2 H -7.668 9.179 -6.643 1.00 . A A . 11 PRO HD2 1 1 8 3810 1 1 11 PRO HD3 H -8.852 8.665 -5.411 1.00 . A A . 11 PRO HD3 1 1 8 3811 1 1 11 PRO HG2 H -7.345 6.933 -7.417 1.00 . A A . 11 PRO HG2 1 1 8 3812 1 1 11 PRO HG3 H -9.026 6.766 -6.865 1.00 . A A . 11 PRO HG3 1 1 8 3813 1 1 11 PRO N N -6.825 8.234 -4.889 1.00 . A A . 11 PRO N 1 1 8 3814 1 1 11 PRO O O -4.727 5.788 -6.259 1.00 . A A . 11 PRO O 1 1 8 3815 1 1 12 ASN C C -1.807 5.805 -4.280 1.00 . A A . 12 ASN C 1 1 8 3816 1 1 12 ASN CA C -2.467 6.983 -5.081 1.00 . A A . 12 ASN CA 1 1 8 3817 1 1 12 ASN CB C -1.810 8.376 -4.847 1.00 . A A . 12 ASN CB 1 1 8 3818 1 1 12 ASN CG C -0.454 8.579 -5.522 1.00 . A A . 12 ASN CG 1 1 8 3819 1 1 12 ASN H H -4.193 7.784 -3.928 1.00 . A A . 12 ASN H 1 1 8 3820 1 1 12 ASN HA H -2.390 6.735 -6.160 1.00 . A A . 12 ASN HA 1 1 8 3821 1 1 12 ASN HB2 H -2.461 9.178 -5.246 1.00 . A A . 12 ASN HB2 1 1 8 3822 1 1 12 ASN HB3 H -1.734 8.598 -3.764 1.00 . A A . 12 ASN HB3 1 1 8 3823 1 1 12 ASN HD21 H 0.487 7.654 -4.039 1.00 . A A . 12 ASN HD21 1 1 8 3824 1 1 12 ASN HD22 H 1.497 8.365 -5.409 1.00 . A A . 12 ASN HD22 1 1 8 3825 1 1 12 ASN N N -3.894 7.149 -4.678 1.00 . A A . 12 ASN N 1 1 8 3826 1 1 12 ASN ND2 N 0.632 8.224 -4.881 1.00 . A A . 12 ASN ND2 1 1 8 3827 1 1 12 ASN O O -0.931 6.005 -3.434 1.00 . A A . 12 ASN O 1 1 8 3828 1 1 12 ASN OD1 O -0.363 9.076 -6.638 1.00 . A A . 12 ASN OD1 1 1 8 3829 1 1 13 GLU C C -2.449 3.638 -2.123 1.00 . A A . 13 GLU C 1 1 8 3830 1 1 13 GLU CA C -2.095 3.372 -3.641 1.00 . A A . 13 GLU CA 1 1 8 3831 1 1 13 GLU CB C -0.641 2.829 -3.861 1.00 . A A . 13 GLU CB 1 1 8 3832 1 1 13 GLU CD C -0.784 0.349 -4.733 1.00 . A A . 13 GLU CD 1 1 8 3833 1 1 13 GLU CG C -0.492 1.827 -5.041 1.00 . A A . 13 GLU CG 1 1 8 3834 1 1 13 GLU H H -3.086 4.637 -5.188 1.00 . A A . 13 GLU H 1 1 8 3835 1 1 13 GLU HA H -2.815 2.588 -3.944 1.00 . A A . 13 GLU HA 1 1 8 3836 1 1 13 GLU HB2 H 0.068 3.670 -4.001 1.00 . A A . 13 GLU HB2 1 1 8 3837 1 1 13 GLU HB3 H -0.257 2.339 -2.947 1.00 . A A . 13 GLU HB3 1 1 8 3838 1 1 13 GLU HE2 H -2.020 -0.770 -3.830 1.00 . A A . 13 GLU HE2 1 1 8 3839 1 1 13 GLU HG2 H -1.105 2.141 -5.904 1.00 . A A . 13 GLU HG2 1 1 8 3840 1 1 13 GLU HG3 H 0.551 1.873 -5.406 1.00 . A A . 13 GLU HG3 1 1 8 3841 1 1 13 GLU N N -2.295 4.570 -4.533 1.00 . A A . 13 GLU N 1 1 8 3842 1 1 13 GLU O O -1.685 3.319 -1.206 1.00 . A A . 13 GLU O 1 1 8 3843 1 1 13 GLU OE1 O -0.008 -0.563 -4.999 1.00 . A A . 13 GLU OE1 1 1 8 3844 1 1 13 GLU OE2 O -1.975 0.154 -4.099 1.00 . A A . 13 GLU OE2 1 1 8 3845 1 1 14 SER C C -4.397 3.022 0.338 1.00 . A A . 14 SER C 1 1 8 3846 1 1 14 SER CA C -4.204 4.356 -0.484 1.00 . A A . 14 SER CA 1 1 8 3847 1 1 14 SER CB C -5.501 5.190 -0.637 1.00 . A A . 14 SER CB 1 1 8 3848 1 1 14 SER H H -4.164 4.471 -2.700 1.00 . A A . 14 SER H 1 1 8 3849 1 1 14 SER HA H -3.475 4.963 0.089 1.00 . A A . 14 SER HA 1 1 8 3850 1 1 14 SER HB2 H -5.280 6.137 -1.170 1.00 . A A . 14 SER HB2 1 1 8 3851 1 1 14 SER HB3 H -6.262 4.669 -1.247 1.00 . A A . 14 SER HB3 1 1 8 3852 1 1 14 SER HG H -6.779 6.110 0.515 1.00 . A A . 14 SER HG 1 1 8 3853 1 1 14 SER N N -3.679 4.130 -1.865 1.00 . A A . 14 SER N 1 1 8 3854 1 1 14 SER O O -3.791 2.965 1.413 1.00 . A A . 14 SER O 1 1 8 3855 1 1 14 SER OG O -6.044 5.503 0.645 1.00 . A A . 14 SER OG 1 1 8 3856 1 1 15 PRO C C -3.463 -0.096 0.354 1.00 . A A . 15 PRO C 1 1 8 3857 1 1 15 PRO CA C -4.881 0.565 0.538 1.00 . A A . 15 PRO CA 1 1 8 3858 1 1 15 PRO CB C -6.014 -0.251 -0.117 1.00 . A A . 15 PRO CB 1 1 8 3859 1 1 15 PRO CD C -6.014 1.887 -1.235 1.00 . A A . 15 PRO CD 1 1 8 3860 1 1 15 PRO CG C -6.240 0.395 -1.485 1.00 . A A . 15 PRO CG 1 1 8 3861 1 1 15 PRO HA H -5.045 0.622 1.631 1.00 . A A . 15 PRO HA 1 1 8 3862 1 1 15 PRO HB2 H -5.795 -1.334 -0.188 1.00 . A A . 15 PRO HB2 1 1 8 3863 1 1 15 PRO HB3 H -6.932 -0.163 0.497 1.00 . A A . 15 PRO HB3 1 1 8 3864 1 1 15 PRO HD2 H -5.623 2.380 -2.144 1.00 . A A . 15 PRO HD2 1 1 8 3865 1 1 15 PRO HD3 H -6.963 2.387 -0.960 1.00 . A A . 15 PRO HD3 1 1 8 3866 1 1 15 PRO HG2 H -5.497 0.011 -2.212 1.00 . A A . 15 PRO HG2 1 1 8 3867 1 1 15 PRO HG3 H -7.242 0.179 -1.902 1.00 . A A . 15 PRO HG3 1 1 8 3868 1 1 15 PRO N N -5.081 1.910 -0.089 1.00 . A A . 15 PRO N 1 1 8 3869 1 1 15 PRO O O -3.096 -0.946 1.169 1.00 . A A . 15 PRO O 1 1 8 3870 1 1 16 SER C C -1.092 -1.639 -1.169 1.00 . A A . 16 SER C 1 1 8 3871 1 1 16 SER CA C -1.242 -0.104 -0.882 1.00 . A A . 16 SER CA 1 1 8 3872 1 1 16 SER CB C -0.387 0.460 0.299 1.00 . A A . 16 SER CB 1 1 8 3873 1 1 16 SER H H -3.097 1.070 -1.191 1.00 . A A . 16 SER H 1 1 8 3874 1 1 16 SER HA H -0.867 0.368 -1.807 1.00 . A A . 16 SER HA 1 1 8 3875 1 1 16 SER HB2 H -0.895 0.371 1.278 1.00 . A A . 16 SER HB2 1 1 8 3876 1 1 16 SER HB3 H 0.546 -0.118 0.417 1.00 . A A . 16 SER HB3 1 1 8 3877 1 1 16 SER HG H -0.793 2.308 -0.286 1.00 . A A . 16 SER HG 1 1 8 3878 1 1 16 SER N N -2.673 0.290 -0.678 1.00 . A A . 16 SER N 1 1 8 3879 1 1 16 SER O O -1.112 -2.013 -2.346 1.00 . A A . 16 SER O 1 1 8 3880 1 1 16 SER OG O -0.020 1.820 0.062 1.00 . A A . 16 SER OG 1 1 8 3881 1 1 17 ALA C C 0.455 -4.479 -1.067 1.00 . A A . 17 ALA C 1 1 8 3882 1 1 17 ALA CA C -0.774 -3.983 -0.224 1.00 . A A . 17 ALA CA 1 1 8 3883 1 1 17 ALA CB C -2.125 -4.584 -0.689 1.00 . A A . 17 ALA CB 1 1 8 3884 1 1 17 ALA H H -1.274 -2.059 0.733 1.00 . A A . 17 ALA H 1 1 8 3885 1 1 17 ALA HA H -0.544 -4.330 0.799 1.00 . A A . 17 ALA HA 1 1 8 3886 1 1 17 ALA HB1 H -2.954 -4.295 -0.014 1.00 . A A . 17 ALA HB1 1 1 8 3887 1 1 17 ALA HB2 H -2.410 -4.261 -1.707 1.00 . A A . 17 ALA HB2 1 1 8 3888 1 1 17 ALA HB3 H -2.094 -5.690 -0.696 1.00 . A A . 17 ALA HB3 1 1 8 3889 1 1 17 ALA N N -0.938 -2.496 -0.136 1.00 . A A . 17 ALA N 1 1 8 3890 1 1 17 ALA O O 1.436 -4.921 -0.465 1.00 . A A . 17 ALA O 1 1 8 3891 1 1 18 PHE C C 2.768 -3.426 -2.943 1.00 . A A . 18 PHE C 1 1 8 3892 1 1 18 PHE CA C 1.693 -4.535 -3.235 1.00 . A A . 18 PHE CA 1 1 8 3893 1 1 18 PHE CB C 1.232 -4.562 -4.722 1.00 . A A . 18 PHE CB 1 1 8 3894 1 1 18 PHE CD1 C 2.892 -6.076 -5.938 1.00 . A A . 18 PHE CD1 1 1 8 3895 1 1 18 PHE CD2 C 2.883 -3.719 -6.470 1.00 . A A . 18 PHE CD2 1 1 8 3896 1 1 18 PHE CE1 C 3.942 -6.272 -6.834 1.00 . A A . 18 PHE CE1 1 1 8 3897 1 1 18 PHE CE2 C 3.929 -3.917 -7.367 1.00 . A A . 18 PHE CE2 1 1 8 3898 1 1 18 PHE CG C 2.358 -4.796 -5.748 1.00 . A A . 18 PHE CG 1 1 8 3899 1 1 18 PHE CZ C 4.460 -5.193 -7.545 1.00 . A A . 18 PHE CZ 1 1 8 3900 1 1 18 PHE H H -0.365 -3.858 -2.749 1.00 . A A . 18 PHE H 1 1 8 3901 1 1 18 PHE HA H 2.177 -5.495 -2.983 1.00 . A A . 18 PHE HA 1 1 8 3902 1 1 18 PHE HB2 H 0.472 -5.358 -4.860 1.00 . A A . 18 PHE HB2 1 1 8 3903 1 1 18 PHE HB3 H 0.688 -3.628 -4.969 1.00 . A A . 18 PHE HB3 1 1 8 3904 1 1 18 PHE HD1 H 2.502 -6.918 -5.385 1.00 . A A . 18 PHE HD1 1 1 8 3905 1 1 18 PHE HD2 H 2.490 -2.721 -6.329 1.00 . A A . 18 PHE HD2 1 1 8 3906 1 1 18 PHE HE1 H 4.354 -7.260 -6.978 1.00 . A A . 18 PHE HE1 1 1 8 3907 1 1 18 PHE HE2 H 4.336 -3.081 -7.917 1.00 . A A . 18 PHE HE2 1 1 8 3908 1 1 18 PHE HZ H 5.276 -5.344 -8.238 1.00 . A A . 18 PHE HZ 1 1 8 3909 1 1 18 PHE N N 0.453 -4.383 -2.411 1.00 . A A . 18 PHE N 1 1 8 3910 1 1 18 PHE O O 3.930 -3.758 -2.695 1.00 . A A . 18 PHE O 1 1 8 3911 1 1 19 LEU C C 3.702 -1.301 -0.861 1.00 . A A . 19 LEU C 1 1 8 3912 1 1 19 LEU CA C 3.203 -1.038 -2.322 1.00 . A A . 19 LEU CA 1 1 8 3913 1 1 19 LEU CB C 2.339 0.259 -2.386 1.00 . A A . 19 LEU CB 1 1 8 3914 1 1 19 LEU CD1 C 3.805 2.057 -1.245 1.00 . A A . 19 LEU CD1 1 1 8 3915 1 1 19 LEU CD2 C 3.904 1.784 -3.759 1.00 . A A . 19 LEU CD2 1 1 8 3916 1 1 19 LEU CG C 3.026 1.646 -2.504 1.00 . A A . 19 LEU CG 1 1 8 3917 1 1 19 LEU H H 1.367 -2.034 -3.089 1.00 . A A . 19 LEU H 1 1 8 3918 1 1 19 LEU HA H 4.104 -0.927 -2.953 1.00 . A A . 19 LEU HA 1 1 8 3919 1 1 19 LEU HB2 H 1.635 0.182 -3.225 1.00 . A A . 19 LEU HB2 1 1 8 3920 1 1 19 LEU HB3 H 1.659 0.290 -1.520 1.00 . A A . 19 LEU HB3 1 1 8 3921 1 1 19 LEU HD11 H 3.186 1.954 -0.334 1.00 . A A . 19 LEU HD11 1 1 8 3922 1 1 19 LEU HD12 H 4.716 1.449 -1.098 1.00 . A A . 19 LEU HD12 1 1 8 3923 1 1 19 LEU HD13 H 4.128 3.113 -1.295 1.00 . A A . 19 LEU HD13 1 1 8 3924 1 1 19 LEU HD21 H 3.355 1.506 -4.678 1.00 . A A . 19 LEU HD21 1 1 8 3925 1 1 19 LEU HD22 H 4.251 2.825 -3.898 1.00 . A A . 19 LEU HD22 1 1 8 3926 1 1 19 LEU HD23 H 4.808 1.150 -3.713 1.00 . A A . 19 LEU HD23 1 1 8 3927 1 1 19 LEU HG H 2.208 2.385 -2.612 1.00 . A A . 19 LEU HG 1 1 8 3928 1 1 19 LEU N N 2.369 -2.141 -2.894 1.00 . A A . 19 LEU N 1 1 8 3929 1 1 19 LEU O O 4.867 -1.043 -0.572 1.00 . A A . 19 LEU O 1 1 8 3930 1 1 20 GLU C C 4.281 -3.432 1.471 1.00 . A A . 20 GLU C 1 1 8 3931 1 1 20 GLU CA C 3.283 -2.230 1.415 1.00 . A A . 20 GLU CA 1 1 8 3932 1 1 20 GLU CB C 1.993 -2.545 2.236 1.00 . A A . 20 GLU CB 1 1 8 3933 1 1 20 GLU CD C 3.134 -2.990 4.549 1.00 . A A . 20 GLU CD 1 1 8 3934 1 1 20 GLU CG C 2.050 -2.254 3.759 1.00 . A A . 20 GLU CG 1 1 8 3935 1 1 20 GLU H H 1.901 -1.938 -0.282 1.00 . A A . 20 GLU H 1 1 8 3936 1 1 20 GLU HA H 3.833 -1.363 1.798 1.00 . A A . 20 GLU HA 1 1 8 3937 1 1 20 GLU HB2 H 1.134 -1.985 1.832 1.00 . A A . 20 GLU HB2 1 1 8 3938 1 1 20 GLU HB3 H 1.689 -3.600 2.078 1.00 . A A . 20 GLU HB3 1 1 8 3939 1 1 20 GLU HE2 H 3.729 -4.791 4.908 1.00 . A A . 20 GLU HE2 1 1 8 3940 1 1 20 GLU HG2 H 2.165 -1.169 3.927 1.00 . A A . 20 GLU HG2 1 1 8 3941 1 1 20 GLU HG3 H 1.075 -2.511 4.212 1.00 . A A . 20 GLU HG3 1 1 8 3942 1 1 20 GLU N N 2.860 -1.834 0.048 1.00 . A A . 20 GLU N 1 1 8 3943 1 1 20 GLU O O 5.295 -3.329 2.167 1.00 . A A . 20 GLU O 1 1 8 3944 1 1 20 GLU OE1 O 4.083 -2.423 5.084 1.00 . A A . 20 GLU OE1 1 1 8 3945 1 1 20 GLU OE2 O 2.949 -4.340 4.543 1.00 . A A . 20 GLU OE2 1 1 8 3946 1 1 21 ARG C C 6.427 -5.106 -0.031 1.00 . A A . 21 ARG C 1 1 8 3947 1 1 21 ARG CA C 5.028 -5.612 0.489 1.00 . A A . 21 ARG CA 1 1 8 3948 1 1 21 ARG CB C 4.343 -6.611 -0.498 1.00 . A A . 21 ARG CB 1 1 8 3949 1 1 21 ARG CD C 5.892 -8.321 -1.799 1.00 . A A . 21 ARG CD 1 1 8 3950 1 1 21 ARG CG C 4.950 -8.041 -0.607 1.00 . A A . 21 ARG CG 1 1 8 3951 1 1 21 ARG CZ C 8.296 -7.835 -2.336 1.00 . A A . 21 ARG CZ 1 1 8 3952 1 1 21 ARG H H 3.119 -4.533 0.264 1.00 . A A . 21 ARG H 1 1 8 3953 1 1 21 ARG HA H 5.189 -6.098 1.459 1.00 . A A . 21 ARG HA 1 1 8 3954 1 1 21 ARG HB2 H 3.296 -6.762 -0.167 1.00 . A A . 21 ARG HB2 1 1 8 3955 1 1 21 ARG HB3 H 4.237 -6.157 -1.503 1.00 . A A . 21 ARG HB3 1 1 8 3956 1 1 21 ARG HD2 H 5.982 -9.420 -1.927 1.00 . A A . 21 ARG HD2 1 1 8 3957 1 1 21 ARG HD3 H 5.446 -7.935 -2.738 1.00 . A A . 21 ARG HD3 1 1 8 3958 1 1 21 ARG HE H 7.370 -7.085 -0.753 1.00 . A A . 21 ARG HE 1 1 8 3959 1 1 21 ARG HG2 H 5.418 -8.349 0.350 1.00 . A A . 21 ARG HG2 1 1 8 3960 1 1 21 ARG HG3 H 4.102 -8.747 -0.710 1.00 . A A . 21 ARG HG3 1 1 8 3961 1 1 21 ARG HH11 H 7.451 -9.047 -3.626 1.00 . A A . 21 ARG HH11 1 1 8 3962 1 1 21 ARG HH12 H 9.195 -8.601 -3.962 1.00 . A A . 21 ARG HH12 1 1 8 3963 1 1 21 ARG HH21 H 9.293 -6.624 -1.134 1.00 . A A . 21 ARG HH21 1 1 8 3964 1 1 21 ARG HH22 H 10.189 -7.268 -2.591 1.00 . A A . 21 ARG HH22 1 1 8 3965 1 1 21 ARG N N 4.037 -4.525 0.723 1.00 . A A . 21 ARG N 1 1 8 3966 1 1 21 ARG NE N 7.229 -7.723 -1.555 1.00 . A A . 21 ARG NE 1 1 8 3967 1 1 21 ARG NH1 N 8.328 -8.562 -3.425 1.00 . A A . 21 ARG NH1 1 1 8 3968 1 1 21 ARG NH2 N 9.367 -7.181 -1.991 1.00 . A A . 21 ARG NH2 1 1 8 3969 1 1 21 ARG O O 7.464 -5.642 0.378 1.00 . A A . 21 ARG O 1 1 8 3970 1 1 22 LEU C C 8.221 -2.401 -0.134 1.00 . A A . 22 LEU C 1 1 8 3971 1 1 22 LEU CA C 7.691 -3.345 -1.273 1.00 . A A . 22 LEU CA 1 1 8 3972 1 1 22 LEU CB C 7.377 -2.535 -2.566 1.00 . A A . 22 LEU CB 1 1 8 3973 1 1 22 LEU CD1 C 6.525 -2.407 -4.952 1.00 . A A . 22 LEU CD1 1 1 8 3974 1 1 22 LEU CD2 C 8.309 -4.079 -4.403 1.00 . A A . 22 LEU CD2 1 1 8 3975 1 1 22 LEU CG C 7.072 -3.341 -3.860 1.00 . A A . 22 LEU CG 1 1 8 3976 1 1 22 LEU H H 5.575 -3.787 -1.293 1.00 . A A . 22 LEU H 1 1 8 3977 1 1 22 LEU HA H 8.471 -4.078 -1.483 1.00 . A A . 22 LEU HA 1 1 8 3978 1 1 22 LEU HB2 H 6.537 -1.844 -2.359 1.00 . A A . 22 LEU HB2 1 1 8 3979 1 1 22 LEU HB3 H 8.229 -1.863 -2.781 1.00 . A A . 22 LEU HB3 1 1 8 3980 1 1 22 LEU HD11 H 7.241 -1.606 -5.217 1.00 . A A . 22 LEU HD11 1 1 8 3981 1 1 22 LEU HD12 H 6.294 -2.958 -5.883 1.00 . A A . 22 LEU HD12 1 1 8 3982 1 1 22 LEU HD13 H 5.584 -1.921 -4.638 1.00 . A A . 22 LEU HD13 1 1 8 3983 1 1 22 LEU HD21 H 9.137 -3.383 -4.637 1.00 . A A . 22 LEU HD21 1 1 8 3984 1 1 22 LEU HD22 H 8.697 -4.818 -3.682 1.00 . A A . 22 LEU HD22 1 1 8 3985 1 1 22 LEU HD23 H 8.078 -4.634 -5.332 1.00 . A A . 22 LEU HD23 1 1 8 3986 1 1 22 LEU HG H 6.282 -4.089 -3.638 1.00 . A A . 22 LEU HG 1 1 8 3987 1 1 22 LEU N N 6.469 -4.094 -0.917 1.00 . A A . 22 LEU N 1 1 8 3988 1 1 22 LEU O O 9.436 -2.369 0.075 1.00 . A A . 22 LEU O 1 1 8 3989 1 1 23 LYS C C 8.524 -1.367 2.887 1.00 . A A . 23 LYS C 1 1 8 3990 1 1 23 LYS CA C 7.817 -0.692 1.661 1.00 . A A . 23 LYS CA 1 1 8 3991 1 1 23 LYS CB C 6.540 0.082 2.093 1.00 . A A . 23 LYS CB 1 1 8 3992 1 1 23 LYS CD C 5.484 1.863 3.657 1.00 . A A . 23 LYS CD 1 1 8 3993 1 1 23 LYS CE C 4.854 0.950 4.731 1.00 . A A . 23 LYS CE 1 1 8 3994 1 1 23 LYS CG C 6.775 1.285 3.039 1.00 . A A . 23 LYS CG 1 1 8 3995 1 1 23 LYS H H 6.358 -1.851 0.481 1.00 . A A . 23 LYS H 1 1 8 3996 1 1 23 LYS HA H 8.545 0.017 1.222 1.00 . A A . 23 LYS HA 1 1 8 3997 1 1 23 LYS HB2 H 6.004 0.457 1.198 1.00 . A A . 23 LYS HB2 1 1 8 3998 1 1 23 LYS HB3 H 5.845 -0.637 2.561 1.00 . A A . 23 LYS HB3 1 1 8 3999 1 1 23 LYS HD2 H 5.739 2.847 4.099 1.00 . A A . 23 LYS HD2 1 1 8 4000 1 1 23 LYS HD3 H 4.758 2.092 2.850 1.00 . A A . 23 LYS HD3 1 1 8 4001 1 1 23 LYS HE2 H 4.528 -0.014 4.282 1.00 . A A . 23 LYS HE2 1 1 8 4002 1 1 23 LYS HE3 H 5.621 0.661 5.485 1.00 . A A . 23 LYS HE3 1 1 8 4003 1 1 23 LYS HG2 H 7.484 1.017 3.848 1.00 . A A . 23 LYS HG2 1 1 8 4004 1 1 23 LYS HG3 H 7.299 2.081 2.471 1.00 . A A . 23 LYS HG3 1 1 8 4005 1 1 23 LYS HZ1 H 3.990 2.524 5.831 1.00 . A A . 23 LYS HZ1 1 1 8 4006 1 1 23 LYS HZ2 H 2.971 1.902 4.711 1.00 . A A . 23 LYS HZ2 1 1 8 4007 1 1 23 LYS HZ3 H 3.253 1.082 6.113 1.00 . A A . 23 LYS HZ3 1 1 8 4008 1 1 23 LYS N N 7.369 -1.649 0.605 1.00 . A A . 23 LYS N 1 1 8 4009 1 1 23 LYS NZ N 3.709 1.643 5.379 1.00 . A A . 23 LYS NZ 1 1 8 4010 1 1 23 LYS O O 9.560 -0.867 3.330 1.00 . A A . 23 LYS O 1 1 8 4011 1 1 24 GLU C C 10.016 -3.919 4.088 1.00 . A A . 24 GLU C 1 1 8 4012 1 1 24 GLU CA C 8.637 -3.276 4.493 1.00 . A A . 24 GLU CA 1 1 8 4013 1 1 24 GLU CB C 7.595 -4.329 4.970 1.00 . A A . 24 GLU CB 1 1 8 4014 1 1 24 GLU CD C 5.911 -6.233 4.398 1.00 . A A . 24 GLU CD 1 1 8 4015 1 1 24 GLU CG C 7.163 -5.455 3.989 1.00 . A A . 24 GLU CG 1 1 8 4016 1 1 24 GLU H H 7.149 -2.822 2.951 1.00 . A A . 24 GLU H 1 1 8 4017 1 1 24 GLU HA H 8.843 -2.581 5.312 1.00 . A A . 24 GLU HA 1 1 8 4018 1 1 24 GLU HB2 H 7.978 -4.803 5.895 1.00 . A A . 24 GLU HB2 1 1 8 4019 1 1 24 GLU HB3 H 6.694 -3.781 5.314 1.00 . A A . 24 GLU HB3 1 1 8 4020 1 1 24 GLU HE2 H 5.109 -7.942 4.176 1.00 . A A . 24 GLU HE2 1 1 8 4021 1 1 24 GLU HG2 H 6.968 -5.039 2.987 1.00 . A A . 24 GLU HG2 1 1 8 4022 1 1 24 GLU HG3 H 7.999 -6.166 3.847 1.00 . A A . 24 GLU HG3 1 1 8 4023 1 1 24 GLU N N 7.984 -2.478 3.424 1.00 . A A . 24 GLU N 1 1 8 4024 1 1 24 GLU O O 10.937 -3.937 4.907 1.00 . A A . 24 GLU O 1 1 8 4025 1 1 24 GLU OE1 O 4.998 -5.778 5.084 1.00 . A A . 24 GLU OE1 1 1 8 4026 1 1 24 GLU OE2 O 5.898 -7.490 3.872 1.00 . A A . 24 GLU OE2 1 1 8 4027 1 1 25 ALA C C 12.462 -3.432 2.139 1.00 . A A . 25 ALA C 1 1 8 4028 1 1 25 ALA CA C 11.503 -4.672 2.234 1.00 . A A . 25 ALA CA 1 1 8 4029 1 1 25 ALA CB C 11.205 -5.302 0.857 1.00 . A A . 25 ALA CB 1 1 8 4030 1 1 25 ALA H H 9.357 -4.310 2.244 1.00 . A A . 25 ALA H 1 1 8 4031 1 1 25 ALA HA H 11.978 -5.414 2.883 1.00 . A A . 25 ALA HA 1 1 8 4032 1 1 25 ALA HB1 H 10.606 -6.227 0.955 1.00 . A A . 25 ALA HB1 1 1 8 4033 1 1 25 ALA HB2 H 10.657 -4.617 0.184 1.00 . A A . 25 ALA HB2 1 1 8 4034 1 1 25 ALA HB3 H 12.138 -5.583 0.335 1.00 . A A . 25 ALA HB3 1 1 8 4035 1 1 25 ALA N N 10.187 -4.368 2.826 1.00 . A A . 25 ALA N 1 1 8 4036 1 1 25 ALA O O 13.547 -3.482 2.722 1.00 . A A . 25 ALA O 1 1 8 4037 1 1 26 TYR C C 13.286 -0.454 2.820 1.00 . A A . 26 TYR C 1 1 8 4038 1 1 26 TYR CA C 12.904 -1.071 1.427 1.00 . A A . 26 TYR CA 1 1 8 4039 1 1 26 TYR CB C 12.149 0.002 0.583 1.00 . A A . 26 TYR CB 1 1 8 4040 1 1 26 TYR CD1 C 13.080 -0.598 -1.734 1.00 . A A . 26 TYR CD1 1 1 8 4041 1 1 26 TYR CD2 C 10.744 -0.022 -1.539 1.00 . A A . 26 TYR CD2 1 1 8 4042 1 1 26 TYR CE1 C 12.921 -0.780 -3.106 1.00 . A A . 26 TYR CE1 1 1 8 4043 1 1 26 TYR CE2 C 10.589 -0.196 -2.913 1.00 . A A . 26 TYR CE2 1 1 8 4044 1 1 26 TYR CG C 11.987 -0.238 -0.934 1.00 . A A . 26 TYR CG 1 1 8 4045 1 1 26 TYR CZ C 11.674 -0.580 -3.693 1.00 . A A . 26 TYR CZ 1 1 8 4046 1 1 26 TYR H H 11.216 -2.388 0.934 1.00 . A A . 26 TYR H 1 1 8 4047 1 1 26 TYR HA H 13.847 -1.343 0.934 1.00 . A A . 26 TYR HA 1 1 8 4048 1 1 26 TYR HB2 H 11.164 0.195 1.053 1.00 . A A . 26 TYR HB2 1 1 8 4049 1 1 26 TYR HB3 H 12.678 0.970 0.678 1.00 . A A . 26 TYR HB3 1 1 8 4050 1 1 26 TYR HD1 H 14.060 -0.737 -1.299 1.00 . A A . 26 TYR HD1 1 1 8 4051 1 1 26 TYR HD2 H 9.891 0.275 -0.948 1.00 . A A . 26 TYR HD2 1 1 8 4052 1 1 26 TYR HE1 H 13.769 -1.069 -3.709 1.00 . A A . 26 TYR HE1 1 1 8 4053 1 1 26 TYR HE2 H 9.628 -0.029 -3.377 1.00 . A A . 26 TYR HE2 1 1 8 4054 1 1 26 TYR HH H 12.354 -0.998 -5.425 1.00 . A A . 26 TYR HH 1 1 8 4055 1 1 26 TYR N N 12.076 -2.309 1.487 1.00 . A A . 26 TYR N 1 1 8 4056 1 1 26 TYR O O 14.442 -0.059 2.991 1.00 . A A . 26 TYR O 1 1 8 4057 1 1 26 TYR OH O 11.510 -0.758 -5.040 1.00 . A A . 26 TYR OH 1 1 8 4058 1 1 27 ARG C C 13.691 -1.066 5.936 1.00 . A A . 27 ARG C 1 1 8 4059 1 1 27 ARG CA C 12.736 -0.040 5.220 1.00 . A A . 27 ARG CA 1 1 8 4060 1 1 27 ARG CB C 11.394 0.142 5.987 1.00 . A A . 27 ARG CB 1 1 8 4061 1 1 27 ARG CD C 12.119 1.937 7.797 1.00 . A A . 27 ARG CD 1 1 8 4062 1 1 27 ARG CG C 11.455 0.578 7.479 1.00 . A A . 27 ARG CG 1 1 8 4063 1 1 27 ARG CZ C 14.453 2.748 8.243 1.00 . A A . 27 ARG CZ 1 1 8 4064 1 1 27 ARG H H 11.432 -0.726 3.554 1.00 . A A . 27 ARG H 1 1 8 4065 1 1 27 ARG HA H 13.278 0.926 5.205 1.00 . A A . 27 ARG HA 1 1 8 4066 1 1 27 ARG HB2 H 10.772 0.884 5.447 1.00 . A A . 27 ARG HB2 1 1 8 4067 1 1 27 ARG HB3 H 10.811 -0.799 5.934 1.00 . A A . 27 ARG HB3 1 1 8 4068 1 1 27 ARG HD2 H 11.807 2.702 7.056 1.00 . A A . 27 ARG HD2 1 1 8 4069 1 1 27 ARG HD3 H 11.739 2.289 8.778 1.00 . A A . 27 ARG HD3 1 1 8 4070 1 1 27 ARG HE H 14.061 0.929 7.543 1.00 . A A . 27 ARG HE 1 1 8 4071 1 1 27 ARG HG2 H 10.410 0.625 7.845 1.00 . A A . 27 ARG HG2 1 1 8 4072 1 1 27 ARG HG3 H 11.906 -0.225 8.096 1.00 . A A . 27 ARG HG3 1 1 8 4073 1 1 27 ARG HH11 H 13.079 4.095 8.668 1.00 . A A . 27 ARG HH11 1 1 8 4074 1 1 27 ARG HH12 H 14.830 4.600 8.930 1.00 . A A . 27 ARG HH12 1 1 8 4075 1 1 27 ARG HH21 H 16.029 1.583 7.820 1.00 . A A . 27 ARG HH21 1 1 8 4076 1 1 27 ARG HH22 H 16.344 3.224 8.541 1.00 . A A . 27 ARG HH22 1 1 8 4077 1 1 27 ARG N N 12.377 -0.400 3.817 1.00 . A A . 27 ARG N 1 1 8 4078 1 1 27 ARG NE N 13.603 1.808 7.842 1.00 . A A . 27 ARG NE 1 1 8 4079 1 1 27 ARG NH1 N 14.086 3.931 8.670 1.00 . A A . 27 ARG NH1 1 1 8 4080 1 1 27 ARG NH2 N 15.723 2.483 8.211 1.00 . A A . 27 ARG NH2 1 1 8 4081 1 1 27 ARG O O 14.546 -0.605 6.702 1.00 . A A . 27 ARG O 1 1 8 4082 1 1 28 ARG C C 16.062 -3.147 5.599 1.00 . A A . 28 ARG C 1 1 8 4083 1 1 28 ARG CA C 14.616 -3.372 6.175 1.00 . A A . 28 ARG CA 1 1 8 4084 1 1 28 ARG CB C 14.056 -4.775 5.803 1.00 . A A . 28 ARG CB 1 1 8 4085 1 1 28 ARG CD C 14.154 -7.313 6.123 1.00 . A A . 28 ARG CD 1 1 8 4086 1 1 28 ARG CG C 14.790 -5.957 6.477 1.00 . A A . 28 ARG CG 1 1 8 4087 1 1 28 ARG CZ C 15.397 -9.495 6.368 1.00 . A A . 28 ARG CZ 1 1 8 4088 1 1 28 ARG H H 12.930 -2.724 5.014 1.00 . A A . 28 ARG H 1 1 8 4089 1 1 28 ARG HA H 14.666 -3.265 7.263 1.00 . A A . 28 ARG HA 1 1 8 4090 1 1 28 ARG HB2 H 12.987 -4.835 6.095 1.00 . A A . 28 ARG HB2 1 1 8 4091 1 1 28 ARG HB3 H 14.063 -4.909 4.702 1.00 . A A . 28 ARG HB3 1 1 8 4092 1 1 28 ARG HD2 H 13.082 -7.315 6.408 1.00 . A A . 28 ARG HD2 1 1 8 4093 1 1 28 ARG HD3 H 14.155 -7.456 5.027 1.00 . A A . 28 ARG HD3 1 1 8 4094 1 1 28 ARG HE H 14.944 -8.318 7.895 1.00 . A A . 28 ARG HE 1 1 8 4095 1 1 28 ARG HG2 H 15.858 -5.956 6.176 1.00 . A A . 28 ARG HG2 1 1 8 4096 1 1 28 ARG HG3 H 14.794 -5.805 7.574 1.00 . A A . 28 ARG HG3 1 1 8 4097 1 1 28 ARG HH11 H 15.043 -9.082 4.452 1.00 . A A . 28 ARG HH11 1 1 8 4098 1 1 28 ARG HH12 H 15.872 -10.665 4.813 1.00 . A A . 28 ARG HH12 1 1 8 4099 1 1 28 ARG HH21 H 15.912 -10.101 8.187 1.00 . A A . 28 ARG HH21 1 1 8 4100 1 1 28 ARG HH22 H 16.357 -11.182 6.793 1.00 . A A . 28 ARG HH22 1 1 8 4101 1 1 28 ARG N N 13.609 -2.395 5.700 1.00 . A A . 28 ARG N 1 1 8 4102 1 1 28 ARG NE N 14.859 -8.384 6.877 1.00 . A A . 28 ARG NE 1 1 8 4103 1 1 28 ARG NH1 N 15.423 -9.791 5.093 1.00 . A A . 28 ARG NH1 1 1 8 4104 1 1 28 ARG NH2 N 15.940 -10.341 7.194 1.00 . A A . 28 ARG NH2 1 1 8 4105 1 1 28 ARG O O 17.032 -3.329 6.337 1.00 . A A . 28 ARG O 1 1 8 4106 1 1 29 TYR C C 18.004 -1.064 3.528 1.00 . A A . 29 TYR C 1 1 8 4107 1 1 29 TYR CA C 17.550 -2.568 3.668 1.00 . A A . 29 TYR CA 1 1 8 4108 1 1 29 TYR CB C 17.491 -3.274 2.268 1.00 . A A . 29 TYR CB 1 1 8 4109 1 1 29 TYR CD1 C 17.395 -5.692 3.123 1.00 . A A . 29 TYR CD1 1 1 8 4110 1 1 29 TYR CD2 C 15.839 -5.009 1.408 1.00 . A A . 29 TYR CD2 1 1 8 4111 1 1 29 TYR CE1 C 16.700 -6.887 3.275 1.00 . A A . 29 TYR CE1 1 1 8 4112 1 1 29 TYR CE2 C 15.150 -6.209 1.557 1.00 . A A . 29 TYR CE2 1 1 8 4113 1 1 29 TYR CG C 16.948 -4.726 2.213 1.00 . A A . 29 TYR CG 1 1 8 4114 1 1 29 TYR CZ C 15.578 -7.147 2.492 1.00 . A A . 29 TYR CZ 1 1 8 4115 1 1 29 TYR H H 15.334 -2.766 3.774 1.00 . A A . 29 TYR H 1 1 8 4116 1 1 29 TYR HA H 18.349 -3.055 4.261 1.00 . A A . 29 TYR HA 1 1 8 4117 1 1 29 TYR HB2 H 16.911 -2.630 1.578 1.00 . A A . 29 TYR HB2 1 1 8 4118 1 1 29 TYR HB3 H 18.508 -3.279 1.833 1.00 . A A . 29 TYR HB3 1 1 8 4119 1 1 29 TYR HD1 H 18.225 -5.478 3.781 1.00 . A A . 29 TYR HD1 1 1 8 4120 1 1 29 TYR HD2 H 15.448 -4.261 0.732 1.00 . A A . 29 TYR HD2 1 1 8 4121 1 1 29 TYR HE1 H 16.999 -7.574 4.050 1.00 . A A . 29 TYR HE1 1 1 8 4122 1 1 29 TYR HE2 H 14.244 -6.363 0.991 1.00 . A A . 29 TYR HE2 1 1 8 4123 1 1 29 TYR HH H 14.246 -8.384 1.941 1.00 . A A . 29 TYR HH 1 1 8 4124 1 1 29 TYR N N 16.210 -2.762 4.316 1.00 . A A . 29 TYR N 1 1 8 4125 1 1 29 TYR O O 19.018 -0.798 2.876 1.00 . A A . 29 TYR O 1 1 8 4126 1 1 29 TYR OH O 14.858 -8.296 2.678 1.00 . A A . 29 TYR OH 1 1 8 4127 1 1 30 THR C C 18.455 1.564 5.622 1.00 . A A . 30 THR C 1 1 8 4128 1 1 30 THR CA C 17.759 1.332 4.229 1.00 . A A . 30 THR CA 1 1 8 4129 1 1 30 THR CB C 16.535 2.282 4.057 1.00 . A A . 30 THR CB 1 1 8 4130 1 1 30 THR CG2 C 16.893 3.777 3.994 1.00 . A A . 30 THR CG2 1 1 8 4131 1 1 30 THR H H 16.594 -0.465 4.788 1.00 . A A . 30 THR H 1 1 8 4132 1 1 30 THR HA H 18.456 1.544 3.398 1.00 . A A . 30 THR HA 1 1 8 4133 1 1 30 THR HB H 15.855 2.114 4.909 1.00 . A A . 30 THR HB 1 1 8 4134 1 1 30 THR HG1 H 15.423 1.145 2.923 1.00 . A A . 30 THR HG1 1 1 8 4135 1 1 30 THR HG21 H 17.560 4.003 3.141 1.00 . A A . 30 THR HG21 1 1 8 4136 1 1 30 THR HG22 H 15.985 4.394 3.862 1.00 . A A . 30 THR HG22 1 1 8 4137 1 1 30 THR HG23 H 17.389 4.131 4.915 1.00 . A A . 30 THR HG23 1 1 8 4138 1 1 30 THR N N 17.319 -0.090 4.165 1.00 . A A . 30 THR N 1 1 8 4139 1 1 30 THR O O 17.846 1.231 6.650 1.00 . A A . 30 THR O 1 1 8 4140 1 1 30 THR OG1 O 15.858 2.016 2.832 1.00 . A A . 30 THR OG1 1 1 8 4141 1 1 31 PRO C C 19.823 3.431 8.012 1.00 . A A . 31 PRO C 1 1 8 4142 1 1 31 PRO CA C 20.374 2.325 7.045 1.00 . A A . 31 PRO CA 1 1 8 4143 1 1 31 PRO CB C 21.820 2.597 6.580 1.00 . A A . 31 PRO CB 1 1 8 4144 1 1 31 PRO CD C 20.470 2.620 4.578 1.00 . A A . 31 PRO CD 1 1 8 4145 1 1 31 PRO CG C 21.689 3.286 5.218 1.00 . A A . 31 PRO CG 1 1 8 4146 1 1 31 PRO HA H 20.329 1.377 7.616 1.00 . A A . 31 PRO HA 1 1 8 4147 1 1 31 PRO HB2 H 22.413 3.190 7.303 1.00 . A A . 31 PRO HB2 1 1 8 4148 1 1 31 PRO HB3 H 22.357 1.635 6.460 1.00 . A A . 31 PRO HB3 1 1 8 4149 1 1 31 PRO HD2 H 19.901 3.329 3.943 1.00 . A A . 31 PRO HD2 1 1 8 4150 1 1 31 PRO HD3 H 20.756 1.755 3.949 1.00 . A A . 31 PRO HD3 1 1 8 4151 1 1 31 PRO HG2 H 21.508 4.371 5.355 1.00 . A A . 31 PRO HG2 1 1 8 4152 1 1 31 PRO HG3 H 22.602 3.188 4.599 1.00 . A A . 31 PRO HG3 1 1 8 4153 1 1 31 PRO N N 19.678 2.158 5.734 1.00 . A A . 31 PRO N 1 1 8 4154 1 1 31 PRO O O 20.024 3.341 9.227 1.00 . A A . 31 PRO O 1 1 8 4155 1 1 32 TYR C C 17.491 5.223 9.283 1.00 . A A . 32 TYR C 1 1 8 4156 1 1 32 TYR CA C 18.662 5.625 8.335 1.00 . A A . 32 TYR CA 1 1 8 4157 1 1 32 TYR CB C 18.268 6.773 7.356 1.00 . A A . 32 TYR CB 1 1 8 4158 1 1 32 TYR CD1 C 20.359 8.207 7.071 1.00 . A A . 32 TYR CD1 1 1 8 4159 1 1 32 TYR CD2 C 19.514 7.023 5.142 1.00 . A A . 32 TYR CD2 1 1 8 4160 1 1 32 TYR CE1 C 21.409 8.706 6.302 1.00 . A A . 32 TYR CE1 1 1 8 4161 1 1 32 TYR CE2 C 20.564 7.525 4.375 1.00 . A A . 32 TYR CE2 1 1 8 4162 1 1 32 TYR CG C 19.407 7.358 6.497 1.00 . A A . 32 TYR CG 1 1 8 4163 1 1 32 TYR CZ C 21.511 8.364 4.957 1.00 . A A . 32 TYR CZ 1 1 8 4164 1 1 32 TYR H H 19.087 4.461 6.493 1.00 . A A . 32 TYR H 1 1 8 4165 1 1 32 TYR HA H 19.493 5.980 8.977 1.00 . A A . 32 TYR HA 1 1 8 4166 1 1 32 TYR HB2 H 17.428 6.444 6.711 1.00 . A A . 32 TYR HB2 1 1 8 4167 1 1 32 TYR HB3 H 17.826 7.603 7.941 1.00 . A A . 32 TYR HB3 1 1 8 4168 1 1 32 TYR HD1 H 20.293 8.477 8.116 1.00 . A A . 32 TYR HD1 1 1 8 4169 1 1 32 TYR HD2 H 18.786 6.372 4.678 1.00 . A A . 32 TYR HD2 1 1 8 4170 1 1 32 TYR HE1 H 22.148 9.357 6.748 1.00 . A A . 32 TYR HE1 1 1 8 4171 1 1 32 TYR HE2 H 20.637 7.262 3.331 1.00 . A A . 32 TYR HE2 1 1 8 4172 1 1 32 TYR HH H 22.448 8.553 3.305 1.00 . A A . 32 TYR HH 1 1 8 4173 1 1 32 TYR N N 19.106 4.459 7.518 1.00 . A A . 32 TYR N 1 1 8 4174 1 1 32 TYR O O 16.322 5.591 9.158 1.00 . A A . 32 TYR O 1 1 8 4175 1 1 32 TYR OXT O 17.889 4.319 10.234 1.00 . A A . 32 TYR OXT 1 1 8 4176 1 1 32 TYR OH O 22.546 8.857 4.209 1.00 . A A . 32 TYR OH 1 1 9 4177 1 1 1 CYS C C -12.971 -14.178 -4.753 1.00 . A A . 1 CYS C 1 1 9 4178 1 1 1 CYS CA C -13.078 -15.563 -4.044 1.00 . A A . 1 CYS CA 1 1 9 4179 1 1 1 CYS CB C -12.489 -15.522 -2.616 1.00 . A A . 1 CYS CB 1 1 9 4180 1 1 1 CYS H1 H -12.825 -16.764 -5.711 1.00 . A A . 1 CYS H1 1 1 9 4181 1 1 1 CYS H2 H -12.387 -17.490 -4.322 1.00 . A A . 1 CYS H2 1 1 9 4182 1 1 1 CYS HA H -14.139 -15.872 -3.966 1.00 . A A . 1 CYS HA 1 1 9 4183 1 1 1 CYS HB2 H -11.402 -15.308 -2.615 1.00 . A A . 1 CYS HB2 1 1 9 4184 1 1 1 CYS HB3 H -12.954 -14.708 -2.029 1.00 . A A . 1 CYS HB3 1 1 9 4185 1 1 1 CYS HG H -11.812 -17.792 -2.260 1.00 . A A . 1 CYS HG 1 1 9 4186 1 1 1 CYS N N -12.345 -16.593 -4.819 1.00 . A A . 1 CYS N 1 1 9 4187 1 1 1 CYS O O -11.883 -13.596 -4.846 1.00 . A A . 1 CYS O 1 1 9 4188 1 1 1 CYS SG S -12.805 -17.085 -1.725 1.00 . A A . 1 CYS SG 1 1 9 4189 1 1 2 ALA C C -14.404 -11.077 -4.844 1.00 . A A . 2 ALA C 1 1 9 4190 1 1 2 ALA CA C -14.131 -12.261 -5.847 1.00 . A A . 2 ALA CA 1 1 9 4191 1 1 2 ALA CB C -15.214 -12.373 -6.941 1.00 . A A . 2 ALA CB 1 1 9 4192 1 1 2 ALA H H -14.952 -14.183 -5.124 1.00 . A A . 2 ALA H 1 1 9 4193 1 1 2 ALA HA H -13.169 -12.021 -6.341 1.00 . A A . 2 ALA HA 1 1 9 4194 1 1 2 ALA HB1 H -14.988 -13.169 -7.677 1.00 . A A . 2 ALA HB1 1 1 9 4195 1 1 2 ALA HB2 H -16.221 -12.575 -6.526 1.00 . A A . 2 ALA HB2 1 1 9 4196 1 1 2 ALA HB3 H -15.294 -11.432 -7.518 1.00 . A A . 2 ALA HB3 1 1 9 4197 1 1 2 ALA N N -14.099 -13.625 -5.234 1.00 . A A . 2 ALA N 1 1 9 4198 1 1 2 ALA O O -15.060 -10.088 -5.190 1.00 . A A . 2 ALA O 1 1 9 4199 1 1 3 LYS C C -12.864 -10.260 -1.484 1.00 . A A . 3 LYS C 1 1 9 4200 1 1 3 LYS CA C -13.935 -10.049 -2.608 1.00 . A A . 3 LYS CA 1 1 9 4201 1 1 3 LYS CB C -15.389 -9.935 -2.030 1.00 . A A . 3 LYS CB 1 1 9 4202 1 1 3 LYS CD C -16.129 -7.633 -2.944 1.00 . A A . 3 LYS CD 1 1 9 4203 1 1 3 LYS CE C -16.945 -6.359 -2.647 1.00 . A A . 3 LYS CE 1 1 9 4204 1 1 3 LYS CG C -15.856 -8.498 -1.689 1.00 . A A . 3 LYS CG 1 1 9 4205 1 1 3 LYS H H -13.140 -11.869 -3.546 1.00 . A A . 3 LYS H 1 1 9 4206 1 1 3 LYS HA H -13.647 -9.134 -3.133 1.00 . A A . 3 LYS HA 1 1 9 4207 1 1 3 LYS HB2 H -16.128 -10.366 -2.735 1.00 . A A . 3 LYS HB2 1 1 9 4208 1 1 3 LYS HB3 H -15.500 -10.578 -1.136 1.00 . A A . 3 LYS HB3 1 1 9 4209 1 1 3 LYS HD2 H -15.158 -7.371 -3.413 1.00 . A A . 3 LYS HD2 1 1 9 4210 1 1 3 LYS HD3 H -16.659 -8.244 -3.704 1.00 . A A . 3 LYS HD3 1 1 9 4211 1 1 3 LYS HE2 H -17.942 -6.630 -2.236 1.00 . A A . 3 LYS HE2 1 1 9 4212 1 1 3 LYS HE3 H -16.449 -5.759 -1.851 1.00 . A A . 3 LYS HE3 1 1 9 4213 1 1 3 LYS HG2 H -16.779 -8.578 -1.080 1.00 . A A . 3 LYS HG2 1 1 9 4214 1 1 3 LYS HG3 H -15.116 -8.002 -1.028 1.00 . A A . 3 LYS HG3 1 1 9 4215 1 1 3 LYS HZ1 H -17.356 -6.123 -4.717 1.00 . A A . 3 LYS HZ1 1 1 9 4216 1 1 3 LYS HZ2 H -17.734 -4.770 -3.860 1.00 . A A . 3 LYS HZ2 1 1 9 4217 1 1 3 LYS HZ3 H -16.175 -5.116 -4.166 1.00 . A A . 3 LYS HZ3 1 1 9 4218 1 1 3 LYS N N -13.858 -11.145 -3.611 1.00 . A A . 3 LYS N 1 1 9 4219 1 1 3 LYS NZ N -17.081 -5.565 -3.899 1.00 . A A . 3 LYS NZ 1 1 9 4220 1 1 3 LYS O O -11.982 -9.418 -1.294 1.00 . A A . 3 LYS O 1 1 9 4221 1 1 4 VAL C C -10.756 -12.496 -0.157 1.00 . A A . 4 VAL C 1 1 9 4222 1 1 4 VAL CA C -11.983 -11.671 0.385 1.00 . A A . 4 VAL CA 1 1 9 4223 1 1 4 VAL CB C -12.780 -12.381 1.545 1.00 . A A . 4 VAL CB 1 1 9 4224 1 1 4 VAL CG1 C -11.912 -12.658 2.798 1.00 . A A . 4 VAL CG1 1 1 9 4225 1 1 4 VAL CG2 C -14.008 -11.585 2.060 1.00 . A A . 4 VAL CG2 1 1 9 4226 1 1 4 VAL H H -13.524 -12.095 -1.163 1.00 . A A . 4 VAL H 1 1 9 4227 1 1 4 VAL HA H -11.578 -10.727 0.804 1.00 . A A . 4 VAL HA 1 1 9 4228 1 1 4 VAL HB H -13.143 -13.359 1.166 1.00 . A A . 4 VAL HB 1 1 9 4229 1 1 4 VAL HG11 H -11.049 -13.312 2.576 1.00 . A A . 4 VAL HG11 1 1 9 4230 1 1 4 VAL HG12 H -11.507 -11.729 3.243 1.00 . A A . 4 VAL HG12 1 1 9 4231 1 1 4 VAL HG13 H -12.482 -13.177 3.592 1.00 . A A . 4 VAL HG13 1 1 9 4232 1 1 4 VAL HG21 H -13.727 -10.583 2.437 1.00 . A A . 4 VAL HG21 1 1 9 4233 1 1 4 VAL HG22 H -14.762 -11.429 1.266 1.00 . A A . 4 VAL HG22 1 1 9 4234 1 1 4 VAL HG23 H -14.535 -12.108 2.881 1.00 . A A . 4 VAL HG23 1 1 9 4235 1 1 4 VAL N N -12.914 -11.389 -0.753 1.00 . A A . 4 VAL N 1 1 9 4236 1 1 4 VAL O O -10.556 -13.674 0.150 1.00 . A A . 4 VAL O 1 1 9 4237 1 1 5 LYS C C -7.703 -10.849 -1.544 1.00 . A A . 5 LYS C 1 1 9 4238 1 1 5 LYS CA C -8.440 -12.140 -1.025 1.00 . A A . 5 LYS CA 1 1 9 4239 1 1 5 LYS CB C -8.170 -13.411 -1.895 1.00 . A A . 5 LYS CB 1 1 9 4240 1 1 5 LYS CD C -8.098 -14.675 -4.118 1.00 . A A . 5 LYS CD 1 1 9 4241 1 1 5 LYS CE C -8.347 -14.695 -5.638 1.00 . A A . 5 LYS CE 1 1 9 4242 1 1 5 LYS CG C -8.606 -13.412 -3.383 1.00 . A A . 5 LYS CG 1 1 9 4243 1 1 5 LYS H H -10.157 -10.840 -1.122 1.00 . A A . 5 LYS H 1 1 9 4244 1 1 5 LYS HA H -8.049 -12.332 -0.005 1.00 . A A . 5 LYS HA 1 1 9 4245 1 1 5 LYS HB2 H -7.082 -13.611 -1.840 1.00 . A A . 5 LYS HB2 1 1 9 4246 1 1 5 LYS HB3 H -8.627 -14.283 -1.388 1.00 . A A . 5 LYS HB3 1 1 9 4247 1 1 5 LYS HD2 H -7.003 -14.747 -3.959 1.00 . A A . 5 LYS HD2 1 1 9 4248 1 1 5 LYS HD3 H -8.502 -15.588 -3.637 1.00 . A A . 5 LYS HD3 1 1 9 4249 1 1 5 LYS HE2 H -8.038 -13.727 -6.092 1.00 . A A . 5 LYS HE2 1 1 9 4250 1 1 5 LYS HE3 H -7.676 -15.450 -6.107 1.00 . A A . 5 LYS HE3 1 1 9 4251 1 1 5 LYS HG2 H -9.708 -13.335 -3.441 1.00 . A A . 5 LYS HG2 1 1 9 4252 1 1 5 LYS HG3 H -8.220 -12.504 -3.887 1.00 . A A . 5 LYS HG3 1 1 9 4253 1 1 5 LYS HZ1 H -10.086 -15.907 -5.556 1.00 . A A . 5 LYS HZ1 1 1 9 4254 1 1 5 LYS HZ2 H -10.439 -14.331 -5.541 1.00 . A A . 5 LYS HZ2 1 1 9 4255 1 1 5 LYS HZ3 H -9.985 -15.048 -6.956 1.00 . A A . 5 LYS HZ3 1 1 9 4256 1 1 5 LYS N N -9.899 -11.830 -0.947 1.00 . A A . 5 LYS N 1 1 9 4257 1 1 5 LYS NZ N -9.766 -15.011 -5.953 1.00 . A A . 5 LYS NZ 1 1 9 4258 1 1 5 LYS O O -6.834 -10.913 -2.417 1.00 . A A . 5 LYS O 1 1 9 4259 1 1 6 GLY C C -8.408 -7.826 -2.839 1.00 . A A . 6 GLY C 1 1 9 4260 1 1 6 GLY CA C -7.725 -8.351 -1.550 1.00 . A A . 6 GLY CA 1 1 9 4261 1 1 6 GLY H H -8.679 -9.773 -0.174 1.00 . A A . 6 GLY H 1 1 9 4262 1 1 6 GLY HA2 H -7.979 -7.634 -0.753 1.00 . A A . 6 GLY HA2 1 1 9 4263 1 1 6 GLY HA3 H -6.637 -8.324 -1.688 1.00 . A A . 6 GLY HA3 1 1 9 4264 1 1 6 GLY N N -8.074 -9.672 -0.996 1.00 . A A . 6 GLY N 1 1 9 4265 1 1 6 GLY O O -7.722 -7.330 -3.736 1.00 . A A . 6 GLY O 1 1 9 4266 1 1 7 ILE C C -11.681 -6.452 -3.382 1.00 . A A . 7 ILE C 1 1 9 4267 1 1 7 ILE CA C -10.558 -7.332 -4.037 1.00 . A A . 7 ILE CA 1 1 9 4268 1 1 7 ILE CB C -11.106 -8.523 -4.916 1.00 . A A . 7 ILE CB 1 1 9 4269 1 1 7 ILE CD1 C -10.322 -10.641 -6.242 1.00 . A A . 7 ILE CD1 1 1 9 4270 1 1 7 ILE CG1 C -9.961 -9.249 -5.692 1.00 . A A . 7 ILE CG1 1 1 9 4271 1 1 7 ILE CG2 C -12.148 -8.034 -5.962 1.00 . A A . 7 ILE CG2 1 1 9 4272 1 1 7 ILE H H -10.215 -8.312 -2.100 1.00 . A A . 7 ILE H 1 1 9 4273 1 1 7 ILE HA H -9.937 -6.687 -4.691 1.00 . A A . 7 ILE HA 1 1 9 4274 1 1 7 ILE HB H -11.591 -9.254 -4.242 1.00 . A A . 7 ILE HB 1 1 9 4275 1 1 7 ILE HD11 H -10.692 -11.309 -5.443 1.00 . A A . 7 ILE HD11 1 1 9 4276 1 1 7 ILE HD12 H -11.101 -10.591 -7.024 1.00 . A A . 7 ILE HD12 1 1 9 4277 1 1 7 ILE HD13 H -9.440 -11.128 -6.696 1.00 . A A . 7 ILE HD13 1 1 9 4278 1 1 7 ILE HG12 H -9.578 -8.607 -6.509 1.00 . A A . 7 ILE HG12 1 1 9 4279 1 1 7 ILE HG13 H -9.087 -9.393 -5.031 1.00 . A A . 7 ILE HG13 1 1 9 4280 1 1 7 ILE HG21 H -13.027 -7.561 -5.487 1.00 . A A . 7 ILE HG21 1 1 9 4281 1 1 7 ILE HG22 H -11.720 -7.298 -6.667 1.00 . A A . 7 ILE HG22 1 1 9 4282 1 1 7 ILE HG23 H -12.555 -8.866 -6.566 1.00 . A A . 7 ILE HG23 1 1 9 4283 1 1 7 ILE N N -9.749 -7.867 -2.898 1.00 . A A . 7 ILE N 1 1 9 4284 1 1 7 ILE O O -12.574 -6.964 -2.699 1.00 . A A . 7 ILE O 1 1 9 4285 1 1 8 THR C C -13.630 -3.744 -4.166 1.00 . A A . 8 THR C 1 1 9 4286 1 1 8 THR CA C -12.670 -4.190 -3.021 1.00 . A A . 8 THR CA 1 1 9 4287 1 1 8 THR CB C -12.000 -2.988 -2.268 1.00 . A A . 8 THR CB 1 1 9 4288 1 1 8 THR CG2 C -11.283 -3.425 -0.980 1.00 . A A . 8 THR CG2 1 1 9 4289 1 1 8 THR H H -11.029 -4.836 -4.363 1.00 . A A . 8 THR H 1 1 9 4290 1 1 8 THR HA H -13.310 -4.705 -2.278 1.00 . A A . 8 THR HA 1 1 9 4291 1 1 8 THR HB H -12.798 -2.268 -1.996 1.00 . A A . 8 THR HB 1 1 9 4292 1 1 8 THR HG1 H -10.275 -2.111 -2.534 1.00 . A A . 8 THR HG1 1 1 9 4293 1 1 8 THR HG21 H -11.976 -3.922 -0.275 1.00 . A A . 8 THR HG21 1 1 9 4294 1 1 8 THR HG22 H -10.464 -4.141 -1.184 1.00 . A A . 8 THR HG22 1 1 9 4295 1 1 8 THR HG23 H -10.841 -2.565 -0.443 1.00 . A A . 8 THR HG23 1 1 9 4296 1 1 8 THR N N -11.649 -5.126 -3.594 1.00 . A A . 8 THR N 1 1 9 4297 1 1 8 THR O O -14.721 -4.310 -4.265 1.00 . A A . 8 THR O 1 1 9 4298 1 1 8 THR OG1 O -11.043 -2.328 -3.095 1.00 . A A . 8 THR OG1 1 1 9 4299 1 1 9 GLN C C -13.265 -1.820 -7.328 1.00 . A A . 9 GLN C 1 1 9 4300 1 1 9 GLN CA C -14.133 -2.340 -6.151 1.00 . A A . 9 GLN CA 1 1 9 4301 1 1 9 GLN CB C -15.180 -1.319 -5.599 1.00 . A A . 9 GLN CB 1 1 9 4302 1 1 9 GLN CD C -17.419 -2.334 -6.511 1.00 . A A . 9 GLN CD 1 1 9 4303 1 1 9 GLN CG C -16.449 -1.139 -6.470 1.00 . A A . 9 GLN CG 1 1 9 4304 1 1 9 GLN H H -12.284 -2.540 -5.025 1.00 . A A . 9 GLN H 1 1 9 4305 1 1 9 GLN HA H -14.626 -3.210 -6.590 1.00 . A A . 9 GLN HA 1 1 9 4306 1 1 9 GLN HB2 H -15.515 -1.610 -4.583 1.00 . A A . 9 GLN HB2 1 1 9 4307 1 1 9 GLN HB3 H -14.690 -0.337 -5.446 1.00 . A A . 9 GLN HB3 1 1 9 4308 1 1 9 GLN HE21 H -18.211 -1.636 -8.201 1.00 . A A . 9 GLN HE21 1 1 9 4309 1 1 9 GLN HE22 H -18.907 -3.182 -7.484 1.00 . A A . 9 GLN HE22 1 1 9 4310 1 1 9 GLN HG2 H -17.019 -0.272 -6.086 1.00 . A A . 9 GLN HG2 1 1 9 4311 1 1 9 GLN HG3 H -16.147 -0.847 -7.494 1.00 . A A . 9 GLN HG3 1 1 9 4312 1 1 9 GLN N N -13.276 -2.770 -5.028 1.00 . A A . 9 GLN N 1 1 9 4313 1 1 9 GLN NE2 N -18.234 -2.413 -7.534 1.00 . A A . 9 GLN NE2 1 1 9 4314 1 1 9 GLN O O -13.232 -0.628 -7.632 1.00 . A A . 9 GLN O 1 1 9 4315 1 1 9 GLN OE1 O -17.483 -3.195 -5.635 1.00 . A A . 9 GLN OE1 1 1 9 4316 1 1 10 GLY C C -10.920 -4.405 -7.493 1.00 . A A . 10 GLY C 1 1 9 4317 1 1 10 GLY CA C -12.374 -4.093 -7.952 1.00 . A A . 10 GLY CA 1 1 9 4318 1 1 10 GLY H H -13.198 -2.410 -9.062 1.00 . A A . 10 GLY H 1 1 9 4319 1 1 10 GLY HA2 H -13.064 -4.565 -7.229 1.00 . A A . 10 GLY HA2 1 1 9 4320 1 1 10 GLY HA3 H -12.562 -4.665 -8.878 1.00 . A A . 10 GLY HA3 1 1 9 4321 1 1 10 GLY N N -12.703 -2.656 -8.209 1.00 . A A . 10 GLY N 1 1 9 4322 1 1 10 GLY O O -10.769 -4.825 -6.342 1.00 . A A . 10 GLY O 1 1 9 4323 1 1 11 PRO C C -7.689 -3.964 -6.963 1.00 . A A . 11 PRO C 1 1 9 4324 1 1 11 PRO CA C -8.495 -4.832 -7.988 1.00 . A A . 11 PRO CA 1 1 9 4325 1 1 11 PRO CB C -7.851 -4.921 -9.389 1.00 . A A . 11 PRO CB 1 1 9 4326 1 1 11 PRO CD C -9.925 -3.724 -9.683 1.00 . A A . 11 PRO CD 1 1 9 4327 1 1 11 PRO CG C -8.486 -3.784 -10.195 1.00 . A A . 11 PRO CG 1 1 9 4328 1 1 11 PRO HA H -8.572 -5.858 -7.574 1.00 . A A . 11 PRO HA 1 1 9 4329 1 1 11 PRO HB2 H -6.746 -4.856 -9.368 1.00 . A A . 11 PRO HB2 1 1 9 4330 1 1 11 PRO HB3 H -8.097 -5.896 -9.856 1.00 . A A . 11 PRO HB3 1 1 9 4331 1 1 11 PRO HD2 H -10.305 -2.684 -9.656 1.00 . A A . 11 PRO HD2 1 1 9 4332 1 1 11 PRO HD3 H -10.600 -4.323 -10.326 1.00 . A A . 11 PRO HD3 1 1 9 4333 1 1 11 PRO HG2 H -7.964 -2.831 -9.975 1.00 . A A . 11 PRO HG2 1 1 9 4334 1 1 11 PRO HG3 H -8.426 -3.947 -11.288 1.00 . A A . 11 PRO HG3 1 1 9 4335 1 1 11 PRO N N -9.843 -4.290 -8.324 1.00 . A A . 11 PRO N 1 1 9 4336 1 1 11 PRO O O -6.943 -3.047 -7.322 1.00 . A A . 11 PRO O 1 1 9 4337 1 1 12 ASN C C -5.701 -3.702 -4.363 1.00 . A A . 12 ASN C 1 1 9 4338 1 1 12 ASN CA C -7.238 -3.482 -4.563 1.00 . A A . 12 ASN CA 1 1 9 4339 1 1 12 ASN CB C -8.036 -3.842 -3.277 1.00 . A A . 12 ASN CB 1 1 9 4340 1 1 12 ASN CG C -7.920 -2.822 -2.141 1.00 . A A . 12 ASN CG 1 1 9 4341 1 1 12 ASN H H -8.606 -4.953 -5.508 1.00 . A A . 12 ASN H 1 1 9 4342 1 1 12 ASN HA H -7.369 -2.408 -4.787 1.00 . A A . 12 ASN HA 1 1 9 4343 1 1 12 ASN HB2 H -9.115 -3.909 -3.506 1.00 . A A . 12 ASN HB2 1 1 9 4344 1 1 12 ASN HB3 H -7.780 -4.854 -2.913 1.00 . A A . 12 ASN HB3 1 1 9 4345 1 1 12 ASN HD21 H -6.261 -3.677 -1.435 1.00 . A A . 12 ASN HD21 1 1 9 4346 1 1 12 ASN HD22 H -6.942 -2.211 -0.554 1.00 . A A . 12 ASN HD22 1 1 9 4347 1 1 12 ASN N N -7.844 -4.284 -5.668 1.00 . A A . 12 ASN N 1 1 9 4348 1 1 12 ASN ND2 N -6.966 -2.959 -1.253 1.00 . A A . 12 ASN ND2 1 1 9 4349 1 1 12 ASN O O -4.968 -2.727 -4.167 1.00 . A A . 12 ASN O 1 1 9 4350 1 1 12 ASN OD1 O -8.718 -1.897 -2.031 1.00 . A A . 12 ASN OD1 1 1 9 4351 1 1 13 GLU C C -2.689 -5.142 -5.013 1.00 . A A . 13 GLU C 1 1 9 4352 1 1 13 GLU CA C -3.829 -5.287 -3.937 1.00 . A A . 13 GLU CA 1 1 9 4353 1 1 13 GLU CB C -3.904 -6.730 -3.364 1.00 . A A . 13 GLU CB 1 1 9 4354 1 1 13 GLU CD C -4.273 -9.231 -3.711 1.00 . A A . 13 GLU CD 1 1 9 4355 1 1 13 GLU CG C -3.949 -7.905 -4.378 1.00 . A A . 13 GLU CG 1 1 9 4356 1 1 13 GLU H H -5.955 -5.663 -4.507 1.00 . A A . 13 GLU H 1 1 9 4357 1 1 13 GLU HA H -3.533 -4.601 -3.123 1.00 . A A . 13 GLU HA 1 1 9 4358 1 1 13 GLU HB2 H -3.025 -6.879 -2.710 1.00 . A A . 13 GLU HB2 1 1 9 4359 1 1 13 GLU HB3 H -4.758 -6.803 -2.659 1.00 . A A . 13 GLU HB3 1 1 9 4360 1 1 13 GLU HE2 H -5.838 -10.351 -3.472 1.00 . A A . 13 GLU HE2 1 1 9 4361 1 1 13 GLU HG2 H -4.696 -7.701 -5.168 1.00 . A A . 13 GLU HG2 1 1 9 4362 1 1 13 GLU HG3 H -2.984 -8.005 -4.907 1.00 . A A . 13 GLU HG3 1 1 9 4363 1 1 13 GLU N N -5.224 -4.958 -4.362 1.00 . A A . 13 GLU N 1 1 9 4364 1 1 13 GLU O O -1.549 -5.508 -4.715 1.00 . A A . 13 GLU O 1 1 9 4365 1 1 13 GLU OE1 O -3.551 -9.777 -2.879 1.00 . A A . 13 GLU OE1 1 1 9 4366 1 1 13 GLU OE2 O -5.488 -9.700 -4.107 1.00 . A A . 13 GLU OE2 1 1 9 4367 1 1 14 SER C C -1.530 -2.573 -6.802 1.00 . A A . 14 SER C 1 1 9 4368 1 1 14 SER CA C -1.902 -4.073 -7.124 1.00 . A A . 14 SER CA 1 1 9 4369 1 1 14 SER CB C -2.397 -4.303 -8.572 1.00 . A A . 14 SER CB 1 1 9 4370 1 1 14 SER H H -3.946 -4.337 -6.304 1.00 . A A . 14 SER H 1 1 9 4371 1 1 14 SER HA H -0.968 -4.658 -7.002 1.00 . A A . 14 SER HA 1 1 9 4372 1 1 14 SER HB2 H -2.587 -5.382 -8.735 1.00 . A A . 14 SER HB2 1 1 9 4373 1 1 14 SER HB3 H -3.364 -3.809 -8.777 1.00 . A A . 14 SER HB3 1 1 9 4374 1 1 14 SER HG H -1.237 -2.943 -9.355 1.00 . A A . 14 SER HG 1 1 9 4375 1 1 14 SER N N -2.957 -4.587 -6.208 1.00 . A A . 14 SER N 1 1 9 4376 1 1 14 SER O O -0.339 -2.367 -6.547 1.00 . A A . 14 SER O 1 1 9 4377 1 1 14 SER OG O -1.423 -3.873 -9.522 1.00 . A A . 14 SER OG 1 1 9 4378 1 1 15 PRO C C -1.638 0.002 -4.787 1.00 . A A . 15 PRO C 1 1 9 4379 1 1 15 PRO CA C -1.992 -0.146 -6.311 1.00 . A A . 15 PRO CA 1 1 9 4380 1 1 15 PRO CB C -3.200 0.713 -6.744 1.00 . A A . 15 PRO CB 1 1 9 4381 1 1 15 PRO CD C -3.818 -1.570 -7.199 1.00 . A A . 15 PRO CD 1 1 9 4382 1 1 15 PRO CG C -4.399 -0.237 -6.731 1.00 . A A . 15 PRO CG 1 1 9 4383 1 1 15 PRO HA H -1.089 0.181 -6.864 1.00 . A A . 15 PRO HA 1 1 9 4384 1 1 15 PRO HB2 H -3.359 1.604 -6.108 1.00 . A A . 15 PRO HB2 1 1 9 4385 1 1 15 PRO HB3 H -3.036 1.094 -7.771 1.00 . A A . 15 PRO HB3 1 1 9 4386 1 1 15 PRO HD2 H -4.387 -2.412 -6.767 1.00 . A A . 15 PRO HD2 1 1 9 4387 1 1 15 PRO HD3 H -3.883 -1.647 -8.301 1.00 . A A . 15 PRO HD3 1 1 9 4388 1 1 15 PRO HG2 H -4.800 -0.338 -5.703 1.00 . A A . 15 PRO HG2 1 1 9 4389 1 1 15 PRO HG3 H -5.235 0.108 -7.367 1.00 . A A . 15 PRO HG3 1 1 9 4390 1 1 15 PRO N N -2.405 -1.511 -6.763 1.00 . A A . 15 PRO N 1 1 9 4391 1 1 15 PRO O O -0.662 0.682 -4.466 1.00 . A A . 15 PRO O 1 1 9 4392 1 1 16 SER C C -1.576 -2.224 -2.118 1.00 . A A . 16 SER C 1 1 9 4393 1 1 16 SER CA C -2.034 -0.760 -2.444 1.00 . A A . 16 SER CA 1 1 9 4394 1 1 16 SER CB C -3.269 -0.308 -1.626 1.00 . A A . 16 SER CB 1 1 9 4395 1 1 16 SER H H -3.016 -1.318 -4.258 1.00 . A A . 16 SER H 1 1 9 4396 1 1 16 SER HA H -1.190 -0.105 -2.239 1.00 . A A . 16 SER HA 1 1 9 4397 1 1 16 SER HB2 H -3.601 0.696 -1.957 1.00 . A A . 16 SER HB2 1 1 9 4398 1 1 16 SER HB3 H -4.129 -0.987 -1.798 1.00 . A A . 16 SER HB3 1 1 9 4399 1 1 16 SER HG H -3.657 0.258 0.193 1.00 . A A . 16 SER HG 1 1 9 4400 1 1 16 SER N N -2.407 -0.609 -3.865 1.00 . A A . 16 SER N 1 1 9 4401 1 1 16 SER O O -1.630 -3.114 -2.969 1.00 . A A . 16 SER O 1 1 9 4402 1 1 16 SER OG O -2.961 -0.253 -0.233 1.00 . A A . 16 SER OG 1 1 9 4403 1 1 17 ALA C C 0.522 -4.526 -1.062 1.00 . A A . 17 ALA C 1 1 9 4404 1 1 17 ALA CA C -0.698 -3.832 -0.348 1.00 . A A . 17 ALA CA 1 1 9 4405 1 1 17 ALA CB C -1.938 -4.757 -0.338 1.00 . A A . 17 ALA CB 1 1 9 4406 1 1 17 ALA H H -1.253 -1.672 -0.261 1.00 . A A . 17 ALA H 1 1 9 4407 1 1 17 ALA HA H -0.372 -3.696 0.699 1.00 . A A . 17 ALA HA 1 1 9 4408 1 1 17 ALA HB1 H -2.795 -4.283 0.176 1.00 . A A . 17 ALA HB1 1 1 9 4409 1 1 17 ALA HB2 H -2.274 -5.024 -1.353 1.00 . A A . 17 ALA HB2 1 1 9 4410 1 1 17 ALA HB3 H -1.737 -5.705 0.196 1.00 . A A . 17 ALA HB3 1 1 9 4411 1 1 17 ALA N N -1.089 -2.477 -0.882 1.00 . A A . 17 ALA N 1 1 9 4412 1 1 17 ALA O O 1.434 -4.986 -0.373 1.00 . A A . 17 ALA O 1 1 9 4413 1 1 18 PHE C C 2.878 -3.538 -2.866 1.00 . A A . 18 PHE C 1 1 9 4414 1 1 18 PHE CA C 1.895 -4.731 -3.144 1.00 . A A . 18 PHE CA 1 1 9 4415 1 1 18 PHE CB C 1.533 -4.879 -4.651 1.00 . A A . 18 PHE CB 1 1 9 4416 1 1 18 PHE CD1 C 3.571 -6.089 -5.592 1.00 . A A . 18 PHE CD1 1 1 9 4417 1 1 18 PHE CD2 C 2.982 -3.940 -6.524 1.00 . A A . 18 PHE CD2 1 1 9 4418 1 1 18 PHE CE1 C 4.668 -6.160 -6.447 1.00 . A A . 18 PHE CE1 1 1 9 4419 1 1 18 PHE CE2 C 4.076 -4.015 -7.384 1.00 . A A . 18 PHE CE2 1 1 9 4420 1 1 18 PHE CG C 2.720 -4.979 -5.624 1.00 . A A . 18 PHE CG 1 1 9 4421 1 1 18 PHE CZ C 4.918 -5.124 -7.344 1.00 . A A . 18 PHE CZ 1 1 9 4422 1 1 18 PHE H H -0.228 -4.166 -2.849 1.00 . A A . 18 PHE H 1 1 9 4423 1 1 18 PHE HA H 2.428 -5.637 -2.821 1.00 . A A . 18 PHE HA 1 1 9 4424 1 1 18 PHE HB2 H 0.918 -5.788 -4.792 1.00 . A A . 18 PHE HB2 1 1 9 4425 1 1 18 PHE HB3 H 0.860 -4.054 -4.962 1.00 . A A . 18 PHE HB3 1 1 9 4426 1 1 18 PHE HD1 H 3.395 -6.889 -4.887 1.00 . A A . 18 PHE HD1 1 1 9 4427 1 1 18 PHE HD2 H 2.348 -3.063 -6.551 1.00 . A A . 18 PHE HD2 1 1 9 4428 1 1 18 PHE HE1 H 5.330 -7.014 -6.410 1.00 . A A . 18 PHE HE1 1 1 9 4429 1 1 18 PHE HE2 H 4.277 -3.208 -8.075 1.00 . A A . 18 PHE HE2 1 1 9 4430 1 1 18 PHE HZ H 5.771 -5.178 -8.005 1.00 . A A . 18 PHE HZ 1 1 9 4431 1 1 18 PHE N N 0.593 -4.621 -2.406 1.00 . A A . 18 PHE N 1 1 9 4432 1 1 18 PHE O O 4.043 -3.781 -2.541 1.00 . A A . 18 PHE O 1 1 9 4433 1 1 19 LEU C C 3.658 -1.237 -0.913 1.00 . A A . 19 LEU C 1 1 9 4434 1 1 19 LEU CA C 3.119 -1.095 -2.385 1.00 . A A . 19 LEU CA 1 1 9 4435 1 1 19 LEU CB C 2.115 0.084 -2.533 1.00 . A A . 19 LEU CB 1 1 9 4436 1 1 19 LEU CD1 C 3.735 1.957 -3.206 1.00 . A A . 19 LEU CD1 1 1 9 4437 1 1 19 LEU CD2 C 1.474 2.507 -2.249 1.00 . A A . 19 LEU CD2 1 1 9 4438 1 1 19 LEU CG C 2.643 1.508 -2.218 1.00 . A A . 19 LEU CG 1 1 9 4439 1 1 19 LEU H H 1.412 -2.254 -3.210 1.00 . A A . 19 LEU H 1 1 9 4440 1 1 19 LEU HA H 4.005 -0.917 -3.025 1.00 . A A . 19 LEU HA 1 1 9 4441 1 1 19 LEU HB2 H 1.709 0.099 -3.565 1.00 . A A . 19 LEU HB2 1 1 9 4442 1 1 19 LEU HB3 H 1.234 -0.115 -1.891 1.00 . A A . 19 LEU HB3 1 1 9 4443 1 1 19 LEU HD11 H 3.382 1.923 -4.255 1.00 . A A . 19 LEU HD11 1 1 9 4444 1 1 19 LEU HD12 H 4.071 2.992 -3.012 1.00 . A A . 19 LEU HD12 1 1 9 4445 1 1 19 LEU HD13 H 4.634 1.316 -3.145 1.00 . A A . 19 LEU HD13 1 1 9 4446 1 1 19 LEU HD21 H 0.690 2.238 -1.515 1.00 . A A . 19 LEU HD21 1 1 9 4447 1 1 19 LEU HD22 H 1.799 3.534 -2.007 1.00 . A A . 19 LEU HD22 1 1 9 4448 1 1 19 LEU HD23 H 0.987 2.544 -3.243 1.00 . A A . 19 LEU HD23 1 1 9 4449 1 1 19 LEU HG H 3.063 1.519 -1.194 1.00 . A A . 19 LEU HG 1 1 9 4450 1 1 19 LEU N N 2.392 -2.286 -2.913 1.00 . A A . 19 LEU N 1 1 9 4451 1 1 19 LEU O O 4.813 -0.886 -0.673 1.00 . A A . 19 LEU O 1 1 9 4452 1 1 20 GLU C C 4.281 -3.292 1.578 1.00 . A A . 20 GLU C 1 1 9 4453 1 1 20 GLU CA C 3.353 -2.038 1.431 1.00 . A A . 20 GLU CA 1 1 9 4454 1 1 20 GLU CB C 2.107 -2.162 2.358 1.00 . A A . 20 GLU CB 1 1 9 4455 1 1 20 GLU CD C 0.856 0.063 1.794 1.00 . A A . 20 GLU CD 1 1 9 4456 1 1 20 GLU CG C 1.499 -0.824 2.861 1.00 . A A . 20 GLU CG 1 1 9 4457 1 1 20 GLU H H 1.883 -1.754 -0.163 1.00 . A A . 20 GLU H 1 1 9 4458 1 1 20 GLU HA H 3.965 -1.180 1.726 1.00 . A A . 20 GLU HA 1 1 9 4459 1 1 20 GLU HB2 H 1.333 -2.805 1.899 1.00 . A A . 20 GLU HB2 1 1 9 4460 1 1 20 GLU HB3 H 2.399 -2.728 3.266 1.00 . A A . 20 GLU HB3 1 1 9 4461 1 1 20 GLU HE2 H -0.679 -1.067 2.047 1.00 . A A . 20 GLU HE2 1 1 9 4462 1 1 20 GLU HG2 H 0.752 -1.027 3.651 1.00 . A A . 20 GLU HG2 1 1 9 4463 1 1 20 GLU HG3 H 2.280 -0.232 3.372 1.00 . A A . 20 GLU HG3 1 1 9 4464 1 1 20 GLU N N 2.876 -1.769 0.049 1.00 . A A . 20 GLU N 1 1 9 4465 1 1 20 GLU O O 5.222 -3.220 2.372 1.00 . A A . 20 GLU O 1 1 9 4466 1 1 20 GLU OE1 O 1.431 1.018 1.276 1.00 . A A . 20 GLU OE1 1 1 9 4467 1 1 20 GLU OE2 O -0.405 -0.351 1.473 1.00 . A A . 20 GLU OE2 1 1 9 4468 1 1 21 ARG C C 6.523 -4.924 0.149 1.00 . A A . 21 ARG C 1 1 9 4469 1 1 21 ARG CA C 5.131 -5.459 0.661 1.00 . A A . 21 ARG CA 1 1 9 4470 1 1 21 ARG CB C 4.534 -6.543 -0.291 1.00 . A A . 21 ARG CB 1 1 9 4471 1 1 21 ARG CD C 2.790 -8.496 -0.528 1.00 . A A . 21 ARG CD 1 1 9 4472 1 1 21 ARG CG C 3.537 -7.514 0.401 1.00 . A A . 21 ARG CG 1 1 9 4473 1 1 21 ARG CZ C 0.638 -8.479 -1.830 1.00 . A A . 21 ARG CZ 1 1 9 4474 1 1 21 ARG H H 3.225 -4.441 0.299 1.00 . A A . 21 ARG H 1 1 9 4475 1 1 21 ARG HA H 5.302 -5.888 1.656 1.00 . A A . 21 ARG HA 1 1 9 4476 1 1 21 ARG HB2 H 4.073 -6.067 -1.177 1.00 . A A . 21 ARG HB2 1 1 9 4477 1 1 21 ARG HB3 H 5.356 -7.154 -0.714 1.00 . A A . 21 ARG HB3 1 1 9 4478 1 1 21 ARG HD2 H 3.488 -8.920 -1.279 1.00 . A A . 21 ARG HD2 1 1 9 4479 1 1 21 ARG HD3 H 2.454 -9.353 0.090 1.00 . A A . 21 ARG HD3 1 1 9 4480 1 1 21 ARG HE H 1.503 -6.822 -1.111 1.00 . A A . 21 ARG HE 1 1 9 4481 1 1 21 ARG HG2 H 4.111 -8.108 1.140 1.00 . A A . 21 ARG HG2 1 1 9 4482 1 1 21 ARG HG3 H 2.808 -6.952 1.019 1.00 . A A . 21 ARG HG3 1 1 9 4483 1 1 21 ARG HH11 H 1.324 -10.282 -1.472 1.00 . A A . 21 ARG HH11 1 1 9 4484 1 1 21 ARG HH12 H -0.244 -10.190 -2.411 1.00 . A A . 21 ARG HH12 1 1 9 4485 1 1 21 ARG HH21 H -0.179 -6.753 -2.362 1.00 . A A . 21 ARG HH21 1 1 9 4486 1 1 21 ARG HH22 H -1.044 -8.278 -2.871 1.00 . A A . 21 ARG HH22 1 1 9 4487 1 1 21 ARG N N 4.100 -4.394 0.822 1.00 . A A . 21 ARG N 1 1 9 4488 1 1 21 ARG NE N 1.623 -7.843 -1.191 1.00 . A A . 21 ARG NE 1 1 9 4489 1 1 21 ARG NH1 N 0.560 -9.783 -1.929 1.00 . A A . 21 ARG NH1 1 1 9 4490 1 1 21 ARG NH2 N -0.300 -7.772 -2.385 1.00 . A A . 21 ARG NH2 1 1 9 4491 1 1 21 ARG O O 7.553 -5.274 0.733 1.00 . A A . 21 ARG O 1 1 9 4492 1 1 22 LEU C C 8.257 -2.226 -0.128 1.00 . A A . 22 LEU C 1 1 9 4493 1 1 22 LEU CA C 7.766 -3.241 -1.227 1.00 . A A . 22 LEU CA 1 1 9 4494 1 1 22 LEU CB C 7.457 -2.473 -2.548 1.00 . A A . 22 LEU CB 1 1 9 4495 1 1 22 LEU CD1 C 6.678 -2.414 -4.956 1.00 . A A . 22 LEU CD1 1 1 9 4496 1 1 22 LEU CD2 C 8.434 -4.084 -4.303 1.00 . A A . 22 LEU CD2 1 1 9 4497 1 1 22 LEU CG C 7.186 -3.319 -3.823 1.00 . A A . 22 LEU CG 1 1 9 4498 1 1 22 LEU H H 5.674 -3.815 -1.315 1.00 . A A . 22 LEU H 1 1 9 4499 1 1 22 LEU HA H 8.570 -3.960 -1.399 1.00 . A A . 22 LEU HA 1 1 9 4500 1 1 22 LEU HB2 H 6.595 -1.799 -2.371 1.00 . A A . 22 LEU HB2 1 1 9 4501 1 1 22 LEU HB3 H 8.296 -1.784 -2.771 1.00 . A A . 22 LEU HB3 1 1 9 4502 1 1 22 LEU HD11 H 7.408 -1.629 -5.228 1.00 . A A . 22 LEU HD11 1 1 9 4503 1 1 22 LEU HD12 H 6.465 -2.992 -5.874 1.00 . A A . 22 LEU HD12 1 1 9 4504 1 1 22 LEU HD13 H 5.735 -1.908 -4.678 1.00 . A A . 22 LEU HD13 1 1 9 4505 1 1 22 LEU HD21 H 9.275 -3.405 -4.541 1.00 . A A . 22 LEU HD21 1 1 9 4506 1 1 22 LEU HD22 H 8.797 -4.803 -3.546 1.00 . A A . 22 LEU HD22 1 1 9 4507 1 1 22 LEU HD23 H 8.223 -4.674 -5.214 1.00 . A A . 22 LEU HD23 1 1 9 4508 1 1 22 LEU HG H 6.386 -4.055 -3.599 1.00 . A A . 22 LEU HG 1 1 9 4509 1 1 22 LEU N N 6.561 -4.023 -0.857 1.00 . A A . 22 LEU N 1 1 9 4510 1 1 22 LEU O O 9.469 -2.060 0.028 1.00 . A A . 22 LEU O 1 1 9 4511 1 1 23 LYS C C 8.370 -1.343 2.978 1.00 . A A . 23 LYS C 1 1 9 4512 1 1 23 LYS CA C 7.741 -0.626 1.732 1.00 . A A . 23 LYS CA 1 1 9 4513 1 1 23 LYS CB C 6.453 0.160 2.104 1.00 . A A . 23 LYS CB 1 1 9 4514 1 1 23 LYS CD C 5.350 2.226 3.222 1.00 . A A . 23 LYS CD 1 1 9 4515 1 1 23 LYS CE C 4.334 2.562 2.103 1.00 . A A . 23 LYS CE 1 1 9 4516 1 1 23 LYS CG C 6.668 1.509 2.826 1.00 . A A . 23 LYS CG 1 1 9 4517 1 1 23 LYS H H 6.373 -1.812 0.443 1.00 . A A . 23 LYS H 1 1 9 4518 1 1 23 LYS HA H 8.507 0.078 1.352 1.00 . A A . 23 LYS HA 1 1 9 4519 1 1 23 LYS HB2 H 5.877 0.377 1.184 1.00 . A A . 23 LYS HB2 1 1 9 4520 1 1 23 LYS HB3 H 5.796 -0.486 2.719 1.00 . A A . 23 LYS HB3 1 1 9 4521 1 1 23 LYS HD2 H 4.834 1.598 3.976 1.00 . A A . 23 LYS HD2 1 1 9 4522 1 1 23 LYS HD3 H 5.602 3.148 3.784 1.00 . A A . 23 LYS HD3 1 1 9 4523 1 1 23 LYS HE2 H 4.002 1.634 1.587 1.00 . A A . 23 LYS HE2 1 1 9 4524 1 1 23 LYS HE3 H 3.397 2.952 2.561 1.00 . A A . 23 LYS HE3 1 1 9 4525 1 1 23 LYS HG2 H 7.270 1.342 3.742 1.00 . A A . 23 LYS HG2 1 1 9 4526 1 1 23 LYS HG3 H 7.297 2.173 2.202 1.00 . A A . 23 LYS HG3 1 1 9 4527 1 1 23 LYS HZ1 H 5.148 4.434 1.571 1.00 . A A . 23 LYS HZ1 1 1 9 4528 1 1 23 LYS HZ2 H 5.737 3.199 0.671 1.00 . A A . 23 LYS HZ2 1 1 9 4529 1 1 23 LYS HZ3 H 4.228 3.781 0.369 1.00 . A A . 23 LYS HZ3 1 1 9 4530 1 1 23 LYS N N 7.357 -1.557 0.628 1.00 . A A . 23 LYS N 1 1 9 4531 1 1 23 LYS NZ N 4.883 3.545 1.128 1.00 . A A . 23 LYS NZ 1 1 9 4532 1 1 23 LYS O O 9.366 -0.847 3.505 1.00 . A A . 23 LYS O 1 1 9 4533 1 1 24 GLU C C 9.928 -3.935 3.838 1.00 . A A . 24 GLU C 1 1 9 4534 1 1 24 GLU CA C 8.539 -3.429 4.352 1.00 . A A . 24 GLU CA 1 1 9 4535 1 1 24 GLU CB C 7.589 -4.635 4.632 1.00 . A A . 24 GLU CB 1 1 9 4536 1 1 24 GLU CD C 7.078 -4.363 7.162 1.00 . A A . 24 GLU CD 1 1 9 4537 1 1 24 GLU CG C 6.524 -4.395 5.732 1.00 . A A . 24 GLU CG 1 1 9 4538 1 1 24 GLU H H 7.049 -2.854 2.883 1.00 . A A . 24 GLU H 1 1 9 4539 1 1 24 GLU HA H 8.715 -2.862 5.270 1.00 . A A . 24 GLU HA 1 1 9 4540 1 1 24 GLU HB2 H 7.088 -4.958 3.697 1.00 . A A . 24 GLU HB2 1 1 9 4541 1 1 24 GLU HB3 H 8.178 -5.527 4.926 1.00 . A A . 24 GLU HB3 1 1 9 4542 1 1 24 GLU HE2 H 7.039 -3.305 8.739 1.00 . A A . 24 GLU HE2 1 1 9 4543 1 1 24 GLU HG2 H 5.957 -3.468 5.520 1.00 . A A . 24 GLU HG2 1 1 9 4544 1 1 24 GLU HG3 H 5.768 -5.200 5.693 1.00 . A A . 24 GLU HG3 1 1 9 4545 1 1 24 GLU N N 7.847 -2.509 3.416 1.00 . A A . 24 GLU N 1 1 9 4546 1 1 24 GLU O O 10.896 -3.891 4.600 1.00 . A A . 24 GLU O 1 1 9 4547 1 1 24 GLU OE1 O 7.770 -5.257 7.650 1.00 . A A . 24 GLU OE1 1 1 9 4548 1 1 24 GLU OE2 O 6.713 -3.240 7.840 1.00 . A A . 24 GLU OE2 1 1 9 4549 1 1 25 ALA C C 12.400 -3.565 1.937 1.00 . A A . 25 ALA C 1 1 9 4550 1 1 25 ALA CA C 11.342 -4.726 1.944 1.00 . A A . 25 ALA CA 1 1 9 4551 1 1 25 ALA CB C 11.015 -5.222 0.521 1.00 . A A . 25 ALA CB 1 1 9 4552 1 1 25 ALA H H 9.169 -4.442 2.048 1.00 . A A . 25 ALA H 1 1 9 4553 1 1 25 ALA HA H 11.763 -5.555 2.527 1.00 . A A . 25 ALA HA 1 1 9 4554 1 1 25 ALA HB1 H 10.307 -6.073 0.529 1.00 . A A . 25 ALA HB1 1 1 9 4555 1 1 25 ALA HB2 H 10.570 -4.433 -0.112 1.00 . A A . 25 ALA HB2 1 1 9 4556 1 1 25 ALA HB3 H 11.925 -5.574 0.001 1.00 . A A . 25 ALA HB3 1 1 9 4557 1 1 25 ALA N N 10.047 -4.372 2.566 1.00 . A A . 25 ALA N 1 1 9 4558 1 1 25 ALA O O 13.493 -3.767 2.467 1.00 . A A . 25 ALA O 1 1 9 4559 1 1 26 TYR C C 13.230 -0.639 3.001 1.00 . A A . 26 TYR C 1 1 9 4560 1 1 26 TYR CA C 12.979 -1.165 1.541 1.00 . A A . 26 TYR CA 1 1 9 4561 1 1 26 TYR CB C 12.372 -0.032 0.655 1.00 . A A . 26 TYR CB 1 1 9 4562 1 1 26 TYR CD1 C 14.040 0.674 -1.130 1.00 . A A . 26 TYR CD1 1 1 9 4563 1 1 26 TYR CD2 C 12.216 -0.767 -1.789 1.00 . A A . 26 TYR CD2 1 1 9 4564 1 1 26 TYR CE1 C 14.525 0.658 -2.436 1.00 . A A . 26 TYR CE1 1 1 9 4565 1 1 26 TYR CE2 C 12.706 -0.785 -3.094 1.00 . A A . 26 TYR CE2 1 1 9 4566 1 1 26 TYR CG C 12.882 -0.040 -0.797 1.00 . A A . 26 TYR CG 1 1 9 4567 1 1 26 TYR CZ C 13.858 -0.073 -3.416 1.00 . A A . 26 TYR CZ 1 1 9 4568 1 1 26 TYR H H 11.223 -2.304 0.889 1.00 . A A . 26 TYR H 1 1 9 4569 1 1 26 TYR HA H 13.960 -1.470 1.149 1.00 . A A . 26 TYR HA 1 1 9 4570 1 1 26 TYR HB2 H 11.264 -0.038 0.682 1.00 . A A . 26 TYR HB2 1 1 9 4571 1 1 26 TYR HB3 H 12.614 0.961 1.083 1.00 . A A . 26 TYR HB3 1 1 9 4572 1 1 26 TYR HD1 H 14.566 1.242 -0.376 1.00 . A A . 26 TYR HD1 1 1 9 4573 1 1 26 TYR HD2 H 11.322 -1.324 -1.554 1.00 . A A . 26 TYR HD2 1 1 9 4574 1 1 26 TYR HE1 H 15.418 1.215 -2.681 1.00 . A A . 26 TYR HE1 1 1 9 4575 1 1 26 TYR HE2 H 12.194 -1.350 -3.859 1.00 . A A . 26 TYR HE2 1 1 9 4576 1 1 26 TYR HH H 15.085 0.491 -4.768 1.00 . A A . 26 TYR HH 1 1 9 4577 1 1 26 TYR N N 12.086 -2.351 1.434 1.00 . A A . 26 TYR N 1 1 9 4578 1 1 26 TYR O O 14.341 -0.181 3.272 1.00 . A A . 26 TYR O 1 1 9 4579 1 1 26 TYR OH O 14.329 -0.095 -4.701 1.00 . A A . 26 TYR OH 1 1 9 4580 1 1 27 ARG C C 13.408 -1.349 6.148 1.00 . A A . 27 ARG C 1 1 9 4581 1 1 27 ARG CA C 12.490 -0.341 5.371 1.00 . A A . 27 ARG CA 1 1 9 4582 1 1 27 ARG CB C 11.069 -0.217 5.988 1.00 . A A . 27 ARG CB 1 1 9 4583 1 1 27 ARG CD C 9.580 0.386 7.973 1.00 . A A . 27 ARG CD 1 1 9 4584 1 1 27 ARG CG C 11.021 0.290 7.445 1.00 . A A . 27 ARG CG 1 1 9 4585 1 1 27 ARG CZ C 8.590 0.981 10.199 1.00 . A A . 27 ARG CZ 1 1 9 4586 1 1 27 ARG H H 11.349 -1.016 3.588 1.00 . A A . 27 ARG H 1 1 9 4587 1 1 27 ARG HA H 13.012 0.635 5.434 1.00 . A A . 27 ARG HA 1 1 9 4588 1 1 27 ARG HB2 H 10.464 0.475 5.368 1.00 . A A . 27 ARG HB2 1 1 9 4589 1 1 27 ARG HB3 H 10.548 -1.194 5.921 1.00 . A A . 27 ARG HB3 1 1 9 4590 1 1 27 ARG HD2 H 8.996 1.105 7.359 1.00 . A A . 27 ARG HD2 1 1 9 4591 1 1 27 ARG HD3 H 9.077 -0.600 7.881 1.00 . A A . 27 ARG HD3 1 1 9 4592 1 1 27 ARG HE H 10.549 1.032 9.813 1.00 . A A . 27 ARG HE 1 1 9 4593 1 1 27 ARG HG2 H 11.616 -0.391 8.089 1.00 . A A . 27 ARG HG2 1 1 9 4594 1 1 27 ARG HG3 H 11.523 1.277 7.507 1.00 . A A . 27 ARG HG3 1 1 9 4595 1 1 27 ARG HH11 H 7.246 0.478 8.856 1.00 . A A . 27 ARG HH11 1 1 9 4596 1 1 27 ARG HH12 H 6.604 0.926 10.511 1.00 . A A . 27 ARG HH12 1 1 9 4597 1 1 27 ARG HH21 H 9.779 1.532 11.693 1.00 . A A . 27 ARG HH21 1 1 9 4598 1 1 27 ARG HH22 H 7.991 1.481 12.028 1.00 . A A . 27 ARG HH22 1 1 9 4599 1 1 27 ARG N N 12.263 -0.689 3.936 1.00 . A A . 27 ARG N 1 1 9 4600 1 1 27 ARG NE N 9.639 0.824 9.389 1.00 . A A . 27 ARG NE 1 1 9 4601 1 1 27 ARG NH1 N 7.350 0.770 9.830 1.00 . A A . 27 ARG NH1 1 1 9 4602 1 1 27 ARG NH2 N 8.807 1.369 11.423 1.00 . A A . 27 ARG NH2 1 1 9 4603 1 1 27 ARG O O 14.274 -0.893 6.898 1.00 . A A . 27 ARG O 1 1 9 4604 1 1 28 ARG C C 15.629 -3.624 5.714 1.00 . A A . 28 ARG C 1 1 9 4605 1 1 28 ARG CA C 14.250 -3.669 6.473 1.00 . A A . 28 ARG CA 1 1 9 4606 1 1 28 ARG CB C 13.623 -5.082 6.317 1.00 . A A . 28 ARG CB 1 1 9 4607 1 1 28 ARG CD C 11.758 -6.781 6.674 1.00 . A A . 28 ARG CD 1 1 9 4608 1 1 28 ARG CG C 12.312 -5.403 7.085 1.00 . A A . 28 ARG CG 1 1 9 4609 1 1 28 ARG CZ C 9.625 -8.059 6.943 1.00 . A A . 28 ARG CZ 1 1 9 4610 1 1 28 ARG H H 12.499 -3.021 5.402 1.00 . A A . 28 ARG H 1 1 9 4611 1 1 28 ARG HA H 14.429 -3.461 7.533 1.00 . A A . 28 ARG HA 1 1 9 4612 1 1 28 ARG HB2 H 13.461 -5.267 5.235 1.00 . A A . 28 ARG HB2 1 1 9 4613 1 1 28 ARG HB3 H 14.381 -5.832 6.619 1.00 . A A . 28 ARG HB3 1 1 9 4614 1 1 28 ARG HD2 H 11.822 -6.895 5.572 1.00 . A A . 28 ARG HD2 1 1 9 4615 1 1 28 ARG HD3 H 12.410 -7.573 7.099 1.00 . A A . 28 ARG HD3 1 1 9 4616 1 1 28 ARG HE H 9.799 -6.155 7.467 1.00 . A A . 28 ARG HE 1 1 9 4617 1 1 28 ARG HG2 H 12.486 -5.364 8.178 1.00 . A A . 28 ARG HG2 1 1 9 4618 1 1 28 ARG HG3 H 11.562 -4.615 6.882 1.00 . A A . 28 ARG HG3 1 1 9 4619 1 1 28 ARG HH11 H 11.107 -9.134 6.230 1.00 . A A . 28 ARG HH11 1 1 9 4620 1 1 28 ARG HH12 H 9.496 -9.990 6.395 1.00 . A A . 28 ARG HH12 1 1 9 4621 1 1 28 ARG HH21 H 8.019 -7.107 7.588 1.00 . A A . 28 ARG HH21 1 1 9 4622 1 1 28 ARG HH22 H 7.817 -8.875 7.151 1.00 . A A . 28 ARG HH22 1 1 9 4623 1 1 28 ARG N N 13.263 -2.679 5.987 1.00 . A A . 28 ARG N 1 1 9 4624 1 1 28 ARG NE N 10.342 -6.947 7.099 1.00 . A A . 28 ARG NE 1 1 9 4625 1 1 28 ARG NH1 N 10.114 -9.181 6.473 1.00 . A A . 28 ARG NH1 1 1 9 4626 1 1 28 ARG NH2 N 8.369 -8.025 7.275 1.00 . A A . 28 ARG NH2 1 1 9 4627 1 1 28 ARG O O 16.675 -3.787 6.346 1.00 . A A . 28 ARG O 1 1 9 4628 1 1 29 TYR C C 16.972 -2.434 2.587 1.00 . A A . 29 TYR C 1 1 9 4629 1 1 29 TYR CA C 16.813 -3.694 3.507 1.00 . A A . 29 TYR CA 1 1 9 4630 1 1 29 TYR CB C 16.634 -5.027 2.687 1.00 . A A . 29 TYR CB 1 1 9 4631 1 1 29 TYR CD1 C 16.623 -6.845 4.501 1.00 . A A . 29 TYR CD1 1 1 9 4632 1 1 29 TYR CD2 C 14.752 -6.721 2.981 1.00 . A A . 29 TYR CD2 1 1 9 4633 1 1 29 TYR CE1 C 15.961 -7.831 5.230 1.00 . A A . 29 TYR CE1 1 1 9 4634 1 1 29 TYR CE2 C 14.090 -7.703 3.712 1.00 . A A . 29 TYR CE2 1 1 9 4635 1 1 29 TYR CG C 16.015 -6.268 3.381 1.00 . A A . 29 TYR CG 1 1 9 4636 1 1 29 TYR CZ C 14.694 -8.258 4.836 1.00 . A A . 29 TYR CZ 1 1 9 4637 1 1 29 TYR H H 14.683 -3.408 3.953 1.00 . A A . 29 TYR H 1 1 9 4638 1 1 29 TYR HA H 17.734 -3.793 4.116 1.00 . A A . 29 TYR HA 1 1 9 4639 1 1 29 TYR HB2 H 16.029 -4.805 1.786 1.00 . A A . 29 TYR HB2 1 1 9 4640 1 1 29 TYR HB3 H 17.616 -5.312 2.266 1.00 . A A . 29 TYR HB3 1 1 9 4641 1 1 29 TYR HD1 H 17.580 -6.479 4.848 1.00 . A A . 29 TYR HD1 1 1 9 4642 1 1 29 TYR HD2 H 14.253 -6.274 2.134 1.00 . A A . 29 TYR HD2 1 1 9 4643 1 1 29 TYR HE1 H 16.409 -8.206 6.136 1.00 . A A . 29 TYR HE1 1 1 9 4644 1 1 29 TYR HE2 H 13.087 -7.993 3.430 1.00 . A A . 29 TYR HE2 1 1 9 4645 1 1 29 TYR HH H 14.641 -9.598 6.186 1.00 . A A . 29 TYR HH 1 1 9 4646 1 1 29 TYR N N 15.622 -3.475 4.373 1.00 . A A . 29 TYR N 1 1 9 4647 1 1 29 TYR O O 16.643 -2.460 1.397 1.00 . A A . 29 TYR O 1 1 9 4648 1 1 29 TYR OH O 14.016 -9.184 5.584 1.00 . A A . 29 TYR OH 1 1 9 4649 1 1 30 THR C C 18.817 0.164 1.684 1.00 . A A . 30 THR C 1 1 9 4650 1 1 30 THR CA C 17.444 0.012 2.436 1.00 . A A . 30 THR CA 1 1 9 4651 1 1 30 THR CB C 17.221 1.188 3.439 1.00 . A A . 30 THR CB 1 1 9 4652 1 1 30 THR CG2 C 16.673 2.449 2.756 1.00 . A A . 30 THR CG2 1 1 9 4653 1 1 30 THR H H 17.516 -1.332 4.165 1.00 . A A . 30 THR H 1 1 9 4654 1 1 30 THR HA H 16.600 0.035 1.723 1.00 . A A . 30 THR HA 1 1 9 4655 1 1 30 THR HB H 18.188 1.417 3.915 1.00 . A A . 30 THR HB 1 1 9 4656 1 1 30 THR HG1 H 15.504 0.458 3.987 1.00 . A A . 30 THR HG1 1 1 9 4657 1 1 30 THR HG21 H 17.356 2.825 1.977 1.00 . A A . 30 THR HG21 1 1 9 4658 1 1 30 THR HG22 H 15.690 2.271 2.282 1.00 . A A . 30 THR HG22 1 1 9 4659 1 1 30 THR HG23 H 16.537 3.267 3.486 1.00 . A A . 30 THR HG23 1 1 9 4660 1 1 30 THR N N 17.446 -1.302 3.146 1.00 . A A . 30 THR N 1 1 9 4661 1 1 30 THR O O 19.852 0.254 2.359 1.00 . A A . 30 THR O 1 1 9 4662 1 1 30 THR OG1 O 16.267 0.864 4.448 1.00 . A A . 30 THR OG1 1 1 9 4663 1 1 31 PRO C C 21.150 1.045 -0.636 1.00 . A A . 31 PRO C 1 1 9 4664 1 1 31 PRO CA C 20.201 -0.176 -0.359 1.00 . A A . 31 PRO CA 1 1 9 4665 1 1 31 PRO CB C 19.658 -0.870 -1.630 1.00 . A A . 31 PRO CB 1 1 9 4666 1 1 31 PRO CD C 17.751 0.131 -0.576 1.00 . A A . 31 PRO CD 1 1 9 4667 1 1 31 PRO CG C 18.356 -0.130 -1.954 1.00 . A A . 31 PRO CG 1 1 9 4668 1 1 31 PRO HA H 20.772 -0.904 0.254 1.00 . A A . 31 PRO HA 1 1 9 4669 1 1 31 PRO HB2 H 20.374 -0.863 -2.474 1.00 . A A . 31 PRO HB2 1 1 9 4670 1 1 31 PRO HB3 H 19.445 -1.937 -1.417 1.00 . A A . 31 PRO HB3 1 1 9 4671 1 1 31 PRO HD2 H 17.189 1.085 -0.522 1.00 . A A . 31 PRO HD2 1 1 9 4672 1 1 31 PRO HD3 H 17.060 -0.687 -0.298 1.00 . A A . 31 PRO HD3 1 1 9 4673 1 1 31 PRO HG2 H 18.577 0.828 -2.467 1.00 . A A . 31 PRO HG2 1 1 9 4674 1 1 31 PRO HG3 H 17.684 -0.711 -2.613 1.00 . A A . 31 PRO HG3 1 1 9 4675 1 1 31 PRO N N 18.918 0.159 0.323 1.00 . A A . 31 PRO N 1 1 9 4676 1 1 31 PRO O O 21.469 1.364 -1.786 1.00 . A A . 31 PRO O 1 1 9 4677 1 1 32 TYR C C 23.477 3.025 1.384 1.00 . A A . 32 TYR C 1 1 9 4678 1 1 32 TYR CA C 22.362 3.006 0.308 1.00 . A A . 32 TYR CA 1 1 9 4679 1 1 32 TYR CB C 21.398 4.224 0.460 1.00 . A A . 32 TYR CB 1 1 9 4680 1 1 32 TYR CD1 C 20.728 4.969 -1.895 1.00 . A A . 32 TYR CD1 1 1 9 4681 1 1 32 TYR CD2 C 19.044 3.972 -0.483 1.00 . A A . 32 TYR CD2 1 1 9 4682 1 1 32 TYR CE1 C 19.794 5.082 -2.925 1.00 . A A . 32 TYR CE1 1 1 9 4683 1 1 32 TYR CE2 C 18.112 4.085 -1.511 1.00 . A A . 32 TYR CE2 1 1 9 4684 1 1 32 TYR CG C 20.360 4.409 -0.667 1.00 . A A . 32 TYR CG 1 1 9 4685 1 1 32 TYR CZ C 18.487 4.639 -2.731 1.00 . A A . 32 TYR CZ 1 1 9 4686 1 1 32 TYR H H 21.185 1.402 1.315 1.00 . A A . 32 TYR H 1 1 9 4687 1 1 32 TYR HA H 22.859 3.077 -0.680 1.00 . A A . 32 TYR HA 1 1 9 4688 1 1 32 TYR HB2 H 20.888 4.172 1.443 1.00 . A A . 32 TYR HB2 1 1 9 4689 1 1 32 TYR HB3 H 21.998 5.152 0.529 1.00 . A A . 32 TYR HB3 1 1 9 4690 1 1 32 TYR HD1 H 21.743 5.300 -2.062 1.00 . A A . 32 TYR HD1 1 1 9 4691 1 1 32 TYR HD2 H 18.757 3.513 0.448 1.00 . A A . 32 TYR HD2 1 1 9 4692 1 1 32 TYR HE1 H 20.092 5.505 -3.873 1.00 . A A . 32 TYR HE1 1 1 9 4693 1 1 32 TYR HE2 H 17.100 3.737 -1.371 1.00 . A A . 32 TYR HE2 1 1 9 4694 1 1 32 TYR HH H 17.987 5.141 -4.503 1.00 . A A . 32 TYR HH 1 1 9 4695 1 1 32 TYR N N 21.605 1.726 0.431 1.00 . A A . 32 TYR N 1 1 9 4696 1 1 32 TYR O O 23.301 3.280 2.574 1.00 . A A . 32 TYR O 1 1 9 4697 1 1 32 TYR OXT O 24.704 2.725 0.871 1.00 . A A . 32 TYR OXT 1 1 9 4698 1 1 32 TYR OH O 17.569 4.736 -3.740 1.00 . A A . 32 TYR OH 1 1 stop_ save_
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